smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[C@@H]1CCCN(C[C@H]([NH3+])CC(F)F)[C@H]1C ZINC000393728922 710670497 /nfs/dbraw/zinc/67/04/97/710670497.db2.gz LHLGKFPIHFQZRU-KXUCPTDWSA-N 2 0 220.307 2.089 20 0 BEADRP CN(C)[C@H](C[NH2+]C1CC2(CCC2)C1)C1CC1 ZINC000381712175 710682749 /nfs/dbraw/zinc/68/27/49/710682749.db2.gz KLTILZRYBSZUPK-CYBMUJFWSA-N 2 0 222.376 2.249 20 0 BEADRP CCO[C@@H]1CCC[C@@H]([NH2+]CC[C@@H](C)[NH+](C)C)C1 ZINC000721238859 712900134 /nfs/dbraw/zinc/90/01/34/712900134.db2.gz LPLHYJAVYKNRPS-MGPQQGTHSA-N 2 0 242.407 2.264 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@H+](C)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000723077904 710724619 /nfs/dbraw/zinc/72/46/19/710724619.db2.gz JILRUKUCDOWWAK-ZBBUEOHVSA-N 2 0 222.376 2.247 20 0 BEADRP Cc1ccccc1OCC[N@@H+]1CC[C@@H](CC[NH3+])C1 ZINC000723669334 710731333 /nfs/dbraw/zinc/73/13/33/710731333.db2.gz HPZGQECYCWJSLQ-CQSZACIVSA-N 2 0 248.370 2.045 20 0 BEADRP C[C@@H]1C[C@H](C)CC[N@H+](C[C@@H]2CC[C@H]([NH3+])C2)C1 ZINC000723780923 710731729 /nfs/dbraw/zinc/73/17/29/710731729.db2.gz WUPKDLYRXQEAOT-SYQHCUMBSA-N 2 0 224.392 2.482 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@@H]1CCCC[C@H]1C ZINC000723829984 710733129 /nfs/dbraw/zinc/73/31/29/710733129.db2.gz WOQXKCBLPBWBSS-FVCCEPFGSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@H]1CCCC[C@@H]1C ZINC000723829987 710733414 /nfs/dbraw/zinc/73/34/14/710733414.db2.gz WOQXKCBLPBWBSS-RNJOBUHISA-N 2 0 210.365 2.010 20 0 BEADRP C[C@H]1OCC[N@H+](CCCCCCC[NH3+])[C@@H]1C ZINC000380492804 712901369 /nfs/dbraw/zinc/90/13/69/712901369.db2.gz AYTFQNFSUKSUIY-CHWSQXEVSA-N 2 0 228.380 2.005 20 0 BEADRP CC(C)(C)[C@@H]1CC[N@H+](C[C@@H]([NH3+])CC(F)F)C1 ZINC000380612379 712901807 /nfs/dbraw/zinc/90/18/07/712901807.db2.gz YMTHLMKMMAUMHQ-ZJUUUORDSA-N 2 0 234.334 2.337 20 0 BEADRP CC[C@@H]1[C@@H](C)CC[N@@H+]1C[C@@]1(C)CCC[NH2+]C1 ZINC000383994985 710987244 /nfs/dbraw/zinc/98/72/44/710987244.db2.gz AATPGSLGIGAVAH-MJBXVCDLSA-N 2 0 224.392 2.497 20 0 BEADRP C1=C(CC[NH2+][C@H]2[C@@H]3[NH2+]C[C@H]4C[C@H]2C[C@H]34)CCCC1 ZINC000385463228 711013780 /nfs/dbraw/zinc/01/37/80/711013780.db2.gz AAZFFXBZOKYSGC-ZVDSWSACSA-N 2 0 246.398 2.463 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@@]2(C)CCC[NH2+]C2)[C@@H]1C ZINC000380702836 712902566 /nfs/dbraw/zinc/90/25/66/712902566.db2.gz XSIZJJVEFUAALL-UPJWGTAASA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)(CC[NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2)C1CC1 ZINC000385592989 711016856 /nfs/dbraw/zinc/01/68/56/711016856.db2.gz IZMANBUPJVFUCD-RCZQDCHWSA-N 2 0 248.414 2.399 20 0 BEADRP C[C@H]([NH2+]CCC1CCC1)[C@H]1CCCC[NH2+]1 ZINC000386139956 711023533 /nfs/dbraw/zinc/02/35/33/711023533.db2.gz QGBISVJWMRZENV-WCQYABFASA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]([NH2+]CCC1CCC1)[C@@H]1CCCC[NH2+]1 ZINC000386139957 711023594 /nfs/dbraw/zinc/02/35/94/711023594.db2.gz QGBISVJWMRZENV-YPMHNXCESA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1C[N@H+](CCCC(C)(F)F)CC[C@@H]1[NH3+] ZINC000390067680 711104546 /nfs/dbraw/zinc/10/45/46/711104546.db2.gz DIHZGKAVIFLIAG-ZJUUUORDSA-N 2 0 220.307 2.091 20 0 BEADRP C[C@@H]1C[C@H]([NH3+])CC[N@@H+]1CCCC(C)(F)F ZINC000390075489 711104918 /nfs/dbraw/zinc/10/49/18/711104918.db2.gz SMNJGKDMCGNMTO-NXEZZACHSA-N 2 0 220.307 2.233 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+]CCN1CCC[C@@H]1C ZINC000390344574 711112479 /nfs/dbraw/zinc/11/24/79/711112479.db2.gz NTOZEWAZMYGTEY-IHRRRGAJSA-N 2 0 224.392 2.495 20 0 BEADRP Cc1nc(C)c(C[NH2+]CCCCCC[NH3+])s1 ZINC000390312945 711113188 /nfs/dbraw/zinc/11/31/88/711113188.db2.gz GHFMCYPULGXSED-UHFFFAOYSA-N 2 0 241.404 2.369 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+]CCN1CCC[C@@H]1C ZINC000390344585 711113374 /nfs/dbraw/zinc/11/33/74/711113374.db2.gz NTOZEWAZMYGTEY-MELADBBJSA-N 2 0 224.392 2.495 20 0 BEADRP C[NH+](C)C1CCC([NH2+]Cc2ccoc2)CC1 ZINC000390556351 711125448 /nfs/dbraw/zinc/12/54/48/711125448.db2.gz QMNNQICUJJADPJ-UHFFFAOYSA-N 2 0 222.332 2.242 20 0 BEADRP C[C@H](C[NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23)C(C)(C)C ZINC000392940424 711155385 /nfs/dbraw/zinc/15/53/85/711155385.db2.gz ZVXFSTBTWMBYRK-QQOHENMQSA-N 2 0 236.403 2.255 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]2C[N@H+](CCCC3CC3)C[C@@H]21 ZINC000394594342 711195277 /nfs/dbraw/zinc/19/52/77/711195277.db2.gz GCIREFZQGXBDIT-MELADBBJSA-N 2 0 222.376 2.236 20 0 BEADRP COC(C)(C)CC[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000396438832 711220983 /nfs/dbraw/zinc/22/09/83/711220983.db2.gz JFKCZFMLHFQACE-LBPRGKRZSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H](CCC1CC1)[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000398215870 711404345 /nfs/dbraw/zinc/40/43/45/711404345.db2.gz LWOMFBAXRMTSQN-MDZLAQPJSA-N 2 0 210.365 2.010 20 0 BEADRP C[NH+]1CCC(C[NH2+]C(C)(C)C2CCC2)CC1 ZINC000398191190 711404475 /nfs/dbraw/zinc/40/44/75/711404475.db2.gz RQUSIPAIDLGPLC-UHFFFAOYSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000381258190 710613752 /nfs/dbraw/zinc/61/37/52/710613752.db2.gz RHYIIIWNWLGUQG-RISCZKNCSA-N 2 0 222.376 2.249 20 0 BEADRP CC(C)([NH3+])CC[NH2+]Cc1cccc2cccnc21 ZINC000384982108 711003046 /nfs/dbraw/zinc/00/30/46/711003046.db2.gz NQAQNCLYJZANLX-UHFFFAOYSA-N 2 0 243.354 2.452 20 0 BEADRP CO[C@@H](C[N@@H+]1CC[C@@H](CC[NH3+])C1)c1ccccc1 ZINC000386019271 711020274 /nfs/dbraw/zinc/02/02/74/711020274.db2.gz WRTCWLMSDQTGSF-HIFRSBDPSA-N 2 0 248.370 2.045 20 0 BEADRP CC[NH2+]CC1CC[NH+](CCCC2CC2)CC1 ZINC000394524704 711194224 /nfs/dbraw/zinc/19/42/24/711194224.db2.gz XGIQZABXMOBTJL-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP CCC[N@H+](C[C@@H]1C[C@H]1CC)C1CC[NH2+]CC1 ZINC000723089360 711501890 /nfs/dbraw/zinc/50/18/90/711501890.db2.gz POGZRLKQIAWKKV-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1C[C@@H]2CCC[C@@H]([NH3+])[C@@H]2C1 ZINC000723126403 711506559 /nfs/dbraw/zinc/50/65/59/711506559.db2.gz JDTBEXNKZSKIJI-MBJXGIAVSA-N 2 0 222.376 2.092 20 0 BEADRP Cc1cccc(OCC[N@@H+]2CC[C@@H](CC[NH3+])C2)c1 ZINC000723670434 711533423 /nfs/dbraw/zinc/53/34/23/711533423.db2.gz RKUUXDHUZOABCT-CQSZACIVSA-N 2 0 248.370 2.045 20 0 BEADRP C[C@@H]1CCCC[C@H]1C[N@@H+]1CC[C@@H](CC[NH3+])C1 ZINC000723678357 711533828 /nfs/dbraw/zinc/53/38/28/711533828.db2.gz JZZPOORMCCEWGF-MCIONIFRSA-N 2 0 224.392 2.483 20 0 BEADRP COCc1cccc(C[N@@H+]2CC[C@@H](CC[NH3+])C2)c1 ZINC000723690525 711534017 /nfs/dbraw/zinc/53/40/17/711534017.db2.gz QVSBAXMNTQOUDZ-CYBMUJFWSA-N 2 0 248.370 2.004 20 0 BEADRP COc1ccc(C[N@@H+]2CC[C@@H](CC[NH3+])C2)cc1C ZINC000723690543 711534275 /nfs/dbraw/zinc/53/42/75/711534275.db2.gz RLQWWWPDZTWOFH-CYBMUJFWSA-N 2 0 248.370 2.174 20 0 BEADRP Cc1ccsc1C[N@@H+]1CC[C@H](CC[NH3+])C1 ZINC000723713252 711536089 /nfs/dbraw/zinc/53/60/89/711536089.db2.gz WJDPWDIABDUDNU-NSHDSACASA-N 2 0 224.373 2.227 20 0 BEADRP Cc1cc(C)nc(C[N@@H+]2CCC[C@@H](CC[NH3+])C2)c1 ZINC000723846368 711539072 /nfs/dbraw/zinc/53/90/72/711539072.db2.gz RGEKRTOFARIMDP-AWEZNQCLSA-N 2 0 247.386 2.259 20 0 BEADRP COc1ccccc1C[N@@H+]1C[C@@H](C)[C@H](CC[NH3+])C1 ZINC000723901458 711544871 /nfs/dbraw/zinc/54/48/71/711544871.db2.gz OXHUDEPMDBWUDI-CHWSQXEVSA-N 2 0 248.370 2.112 20 0 BEADRP Cc1ccccc1C[N@H+]1C[C@@H](C)[C@H](CC[NH3+])C1 ZINC000723910291 711544918 /nfs/dbraw/zinc/54/49/18/711544918.db2.gz UIFDGZSUZNIHTE-UKRRQHHQSA-N 2 0 232.371 2.412 20 0 BEADRP C1=CCC(CC[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)C1 ZINC000724127663 711563249 /nfs/dbraw/zinc/56/32/49/711563249.db2.gz ACJNPBJNIOCOKO-QLFBSQMISA-N 2 0 234.387 2.320 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]CCC1CC=CC1 ZINC000724203843 711569667 /nfs/dbraw/zinc/56/96/67/711569667.db2.gz VWZFYEKQMDPKCQ-KBPBESRZSA-N 2 0 222.376 2.450 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]CCCCC2CC2)C12CCC2 ZINC000716369643 711573578 /nfs/dbraw/zinc/57/35/78/711573578.db2.gz LOHPIORDUXMESV-OLZOCXBDSA-N 2 0 222.376 2.426 20 0 BEADRP C[N@H+](CCCF)CCCCCCC[NH3+] ZINC000716752657 711580975 /nfs/dbraw/zinc/58/09/75/711580975.db2.gz JOIKVJVIQUGCFA-UHFFFAOYSA-N 2 0 204.333 2.187 20 0 BEADRP Cc1ccc([C@H](C)[NH2+]C[C@@H]2C[NH2+]C[C@H]2C)c(C)n1 ZINC000925787338 711751024 /nfs/dbraw/zinc/75/10/24/711751024.db2.gz YOGXTPUMZDRAJN-OSMZGAPFSA-N 2 0 247.386 2.205 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+]C[C@@H]2C[NH2+]C[C@H]2C)c(C)n1 ZINC000925787340 711751420 /nfs/dbraw/zinc/75/14/20/711751420.db2.gz YOGXTPUMZDRAJN-QKCSRTOESA-N 2 0 247.386 2.205 20 0 BEADRP C[C@H]1CC[C@H]([NH2+]CC[C@@H]2C[NH2+]C[C@H]2C)C1 ZINC000722552713 711761300 /nfs/dbraw/zinc/76/13/00/711761300.db2.gz BKHOEIDBRBZLAU-LOWDOPEQSA-N 2 0 210.365 2.010 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]C2CC(SC)C2)[C@H](C)C1 ZINC000925170342 711786423 /nfs/dbraw/zinc/78/64/23/711786423.db2.gz MPAZCTVLTBBWCJ-XVSSEFHLSA-N 2 0 242.432 2.200 20 0 BEADRP CSC(C)(C)C[NH2+][C@@H]1CCCC[C@@H]1C[NH3+] ZINC000229083499 711837647 /nfs/dbraw/zinc/83/76/47/711837647.db2.gz DKWQBQAFSMAKRA-GHMZBOCLSA-N 2 0 230.421 2.235 20 0 BEADRP [NH3+]CC[C@H]1CCC[N@H+](CCc2cccs2)C1 ZINC000069724371 711893590 /nfs/dbraw/zinc/89/35/90/711893590.db2.gz UXCIXTVAACPFQC-GFCCVEGCSA-N 2 0 238.400 2.351 20 0 BEADRP COC[C@@H](C[N@H+](C)C1CCC([NH3+])CC1)C(C)C ZINC000721911906 711917601 /nfs/dbraw/zinc/91/76/01/711917601.db2.gz LCPSIWXHPIMSER-IYXRBSQSSA-N 2 0 242.407 2.107 20 0 BEADRP CC1(C)CC(C[N@@H+]2CC[C@]3(C2)CCC[NH2+]C3)C1 ZINC000530219203 711937785 /nfs/dbraw/zinc/93/77/85/711937785.db2.gz OPDSMGFERGUNJT-OAHLLOKOSA-N 2 0 236.403 2.498 20 0 BEADRP CC[C@@H]1CCC[N@H+](C[C@H]2CCCC[NH2+]C2)C1 ZINC000700239998 711988177 /nfs/dbraw/zinc/98/81/77/711988177.db2.gz ZLVFKYMPDKSVLD-KGLIPLIRSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@H](CC[NH2+]C[C@@H]1CC[C@@H]2C[C@@H]2C1)[NH+](C)C ZINC000700472534 711994068 /nfs/dbraw/zinc/99/40/68/711994068.db2.gz RZYAQXOLIMBXQO-SYQHCUMBSA-N 2 0 224.392 2.352 20 0 BEADRP C[NH+]1CCC(C[NH2+]CC2CC(C)(C)C2)CC1 ZINC000701689352 712027623 /nfs/dbraw/zinc/02/76/23/712027623.db2.gz DBKGBNOWKKUFDY-UHFFFAOYSA-N 2 0 224.392 2.354 20 0 BEADRP CC1(C)C[C@]1(C)C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000701944893 712033353 /nfs/dbraw/zinc/03/33/53/712033353.db2.gz QINXLWHGKDHBMS-QVHKTLOISA-N 2 0 236.403 2.400 20 0 BEADRP CC1(C)C[C@]1(C)C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000701944892 712033357 /nfs/dbraw/zinc/03/33/57/712033357.db2.gz QINXLWHGKDHBMS-KYEXWDHISA-N 2 0 236.403 2.400 20 0 BEADRP CCCCCC[N@@H+]1C[C@@]2(C)C[NH2+]C[C@@]2(C)C1 ZINC000702628111 712057013 /nfs/dbraw/zinc/05/70/13/712057013.db2.gz QVBBZBWZFAFNTJ-OKILXGFUSA-N 2 0 224.392 2.498 20 0 BEADRP Cc1cnccc1CN(C)C1(C[NH3+])CCCCC1 ZINC000705303261 712127654 /nfs/dbraw/zinc/12/76/54/712127654.db2.gz JAUWTXPCMHHHDN-UHFFFAOYSA-N 2 0 247.386 2.483 20 0 BEADRP CC[NH+]1CCC(C[NH2+]C2CC(SC)C2)CC1 ZINC000706918585 712158354 /nfs/dbraw/zinc/15/83/54/712158354.db2.gz QATHNQBDHZZVIA-UHFFFAOYSA-N 2 0 242.432 2.202 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+][C@H]2CCCC23CC3)C12CCC2 ZINC000706949932 712163040 /nfs/dbraw/zinc/16/30/40/712163040.db2.gz WHYIBVYKKDREPV-WOPDTQHZSA-N 2 0 220.360 2.179 20 0 BEADRP C[C@H](C[N@H+](C)CCC[NH3+])CC(C)(C)C ZINC000708315136 712186299 /nfs/dbraw/zinc/18/62/99/712186299.db2.gz SRXBGHWLIOQFBY-NSHDSACASA-N 2 0 200.370 2.339 20 0 BEADRP C[C@H](C[NH+]1C[C@H]2C[NH2+]C[C@@H]2C1)CC(C)(C)C ZINC000709121836 712209355 /nfs/dbraw/zinc/20/93/55/712209355.db2.gz GQAIAHUKIZPULE-YNEHKIRRSA-N 2 0 224.392 2.210 20 0 BEADRP CS[C@@H]1CC[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000709413484 712221374 /nfs/dbraw/zinc/22/13/74/712221374.db2.gz FQWNQOJGZIFCOP-CUWLOBTFSA-N 2 0 240.416 2.143 20 0 BEADRP C[C@@H]1[C@H]2CC[C@@H](C[C@@H]1[NH2+][C@@H]1CC[C@@H]3C[C@@H]3C1)[NH2+]2 ZINC000709421403 712221455 /nfs/dbraw/zinc/22/14/55/712221455.db2.gz DDZAJBWTTKSBPA-YLYOMACISA-N 2 0 234.387 2.294 20 0 BEADRP C[C@H]1[C@H]2CC[C@@H](C[C@H]1[NH2+]C1CCCCC1)[NH2+]2 ZINC000709432884 712221877 /nfs/dbraw/zinc/22/18/77/712221877.db2.gz FSUALWQUPCACLV-SCUASFONSA-N 2 0 222.376 2.438 20 0 BEADRP C[C@@H](Cc1ccco1)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000709460887 712222372 /nfs/dbraw/zinc/22/23/72/712222372.db2.gz PPYXNLBLZKIZGU-ACJTYDJDSA-N 2 0 234.343 2.083 20 0 BEADRP [NH3+][C@@H]1C[C@H]2C[C@@H](C1)[N@H+](C[C@@H]1CCC(F)(F)C1)C2 ZINC000709843660 712229506 /nfs/dbraw/zinc/22/95/06/712229506.db2.gz NKROAILBWKIFON-KXNHARMFSA-N 2 0 244.329 2.233 20 0 BEADRP C[C@@H](CC1CCC1)[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000710276195 712250029 /nfs/dbraw/zinc/25/00/29/712250029.db2.gz GYVBWPJUKOHNKC-MDZLAQPJSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@H](CC1CCC1)[NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32 ZINC000710264562 712250156 /nfs/dbraw/zinc/25/01/56/712250156.db2.gz XBVIBKPAJICNIK-PCTWNACOSA-N 2 0 234.387 2.151 20 0 BEADRP C[N@H+](CCCCCC[NH3+])CCC1CCOCC1 ZINC000710751478 712256404 /nfs/dbraw/zinc/25/64/04/712256404.db2.gz SJNWIODHFYIWKT-UHFFFAOYSA-N 2 0 242.407 2.254 20 0 BEADRP C[N@H+](CCCCCC[NH3+])C[C@@H]1CC(C)(C)CO1 ZINC000710763708 712256632 /nfs/dbraw/zinc/25/66/32/712256632.db2.gz AHSFTEHKTGNAOY-ZDUSSCGKSA-N 2 0 242.407 2.252 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@H]1C[C@@H]2CC[C@@H](C2)C1 ZINC000711071441 712278972 /nfs/dbraw/zinc/27/89/72/712278972.db2.gz RQZLGTYNXSELRR-MQYQWHSLSA-N 2 0 224.392 2.495 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH2+][C@@H]2C[C@@H]3CC[C@@H](C3)C2)C1 ZINC000711204770 712289081 /nfs/dbraw/zinc/28/90/81/712289081.db2.gz TXJKOQQCAQSMJR-XGUBFFRZSA-N 2 0 236.403 2.497 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+]C[C@]12CCC[C@H]1[NH2+]CC2 ZINC000711235472 712290354 /nfs/dbraw/zinc/29/03/54/712290354.db2.gz JXZOCQHJDRUBEN-OUCADQQQSA-N 2 0 222.376 2.297 20 0 BEADRP [NH3+]CCCCCC[N@@H+]1CCC[C@H](CF)C1 ZINC000711484471 712306557 /nfs/dbraw/zinc/30/65/57/712306557.db2.gz MIAAYJUXWWWXRJ-GFCCVEGCSA-N 2 0 216.344 2.187 20 0 BEADRP C[C@H]1c2sccc2CC[N@H+]1C[C@@H]1CC[NH2+]C1 ZINC000712263441 712345075 /nfs/dbraw/zinc/34/50/75/712345075.db2.gz HMKZIFCVDRJGEU-WDEREUQCSA-N 2 0 236.384 2.277 20 0 BEADRP C[C@@H]1CSCC[N@H+](C[C@@]2(C)CCC[NH2+]C2)C1 ZINC000379538600 712387663 /nfs/dbraw/zinc/38/76/63/712387663.db2.gz DRSYCTADWCUIAM-STQMWFEESA-N 2 0 242.432 2.061 20 0 BEADRP CC1(C)[C@@H]2C[N@@H+](CCCCCCC[NH3+])C[C@@H]21 ZINC000379564320 712388397 /nfs/dbraw/zinc/38/83/97/712388397.db2.gz MTXYYIDSRLYPND-BETUJISGSA-N 2 0 224.392 2.483 20 0 BEADRP CC[C@@H]1CCCN(C[C@@H]([NH3+])CC(F)F)C1 ZINC000379783116 712398832 /nfs/dbraw/zinc/39/88/32/712398832.db2.gz GUGLZUIIEOBDGJ-ZJUUUORDSA-N 2 0 220.307 2.091 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+][C@@H]2C[C@@H]3CCCC[C@H]23)C12CCC2 ZINC000712373205 712428323 /nfs/dbraw/zinc/42/83/23/712428323.db2.gz HAHRLCOTSUQVFN-HPCHECBXSA-N 2 0 234.387 2.425 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@@H]2C[C@@H]3CCCC[C@H]23)CC1 ZINC000712377921 712428849 /nfs/dbraw/zinc/42/88/49/712428849.db2.gz NWRRAAHJLVOWFS-SOUVJXGZSA-N 2 0 236.403 2.497 20 0 BEADRP C(C[C@@H]1C[C@H]1C1CC1)[NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23 ZINC000712677371 712440706 /nfs/dbraw/zinc/44/07/06/712440706.db2.gz ZYJRJGOPAUGYLT-RMCMBSFLSA-N 2 0 246.398 2.009 20 0 BEADRP COc1cccc(CN2CC[NH2+]CCC2(C)C)c1 ZINC000712560653 712445914 /nfs/dbraw/zinc/44/59/14/712445914.db2.gz DIUQEDMDNWLRMP-UHFFFAOYSA-N 2 0 248.370 2.269 20 0 BEADRP CC[C@H](C)C[N@@H+]1CC[NH2+]CCC12CCC2 ZINC000713173131 712453439 /nfs/dbraw/zinc/45/34/39/712453439.db2.gz DIMSASNJUCGBDD-LBPRGKRZSA-N 2 0 210.365 2.251 20 0 BEADRP C=C/C=C\CC[N@H+]1CCC[C@H]([C@H](C)[NH3+])C1 ZINC000713700476 712469594 /nfs/dbraw/zinc/46/95/94/712469594.db2.gz CENYBCZWMXCIQY-AIMRDXAKSA-N 2 0 208.349 2.178 20 0 BEADRP C=C/C=C\CC[N@@H+](C)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000713731292 712470709 /nfs/dbraw/zinc/47/07/09/712470709.db2.gz FDRSGQFQADQSIX-CEMVGMONSA-N 2 0 220.360 2.334 20 0 BEADRP C=C/C=C/CC[N@H+]1C[C@H](C[NH3+])[C@H](C(F)(F)F)C1 ZINC000713757103 712471989 /nfs/dbraw/zinc/47/19/89/712471989.db2.gz FPZHTRUUYRGFLX-MJKAUQOVSA-N 2 0 248.292 2.188 20 0 BEADRP CC1(C)CCC[C@@H](CN2CCCC[C@@H]2C[NH3+])O1 ZINC000714321996 712482222 /nfs/dbraw/zinc/48/22/22/712482222.db2.gz XOONDTDWMVOKRK-OLZOCXBDSA-N 2 0 240.391 2.147 20 0 BEADRP CC(C)(C[NH3+])C1CC[NH+](CC2CC2)CC1 ZINC000714407892 712485672 /nfs/dbraw/zinc/48/56/72/712485672.db2.gz YITLEMSLEVSUDT-UHFFFAOYSA-N 2 0 210.365 2.093 20 0 BEADRP CC(C)(C[NH3+])C1CC[NH+](Cc2ccncc2)CC1 ZINC000714459833 712490695 /nfs/dbraw/zinc/49/06/95/712490695.db2.gz YFOYNMUZWADOPV-UHFFFAOYSA-N 2 0 247.386 2.279 20 0 BEADRP CO[C@H]1C[C@H](C[NH2+][C@H]2C[C@H]([NH3+])c3ccccc32)C1 ZINC000714708610 712496152 /nfs/dbraw/zinc/49/61/52/712496152.db2.gz WHUPMEWIDANCAV-GVARAGBVSA-N 2 0 246.354 2.146 20 0 BEADRP CO[C@H]1C[C@H](C[NH2+][C@@H]2C[C@@H]([NH3+])c3ccccc32)C1 ZINC000714708621 712496284 /nfs/dbraw/zinc/49/62/84/712496284.db2.gz WHUPMEWIDANCAV-YIKOMLBNSA-N 2 0 246.354 2.146 20 0 BEADRP [NH3+][C@@H]1C[C@H]2C[C@@H](C1)[N@H+](CC[C@@H]1C[C@H]1C1CC1)C2 ZINC000714782485 712498208 /nfs/dbraw/zinc/49/82/08/712498208.db2.gz QLSWEVUNOJBDRO-YADOHIMWSA-N 2 0 234.387 2.234 20 0 BEADRP [NH3+]CCC1CC[NH+](CC[C@@H]2C[C@H]2C2CC2)CC1 ZINC000714856073 712501870 /nfs/dbraw/zinc/50/18/70/712501870.db2.gz ATGLTBOODLVVCG-CABCVRRESA-N 2 0 236.403 2.483 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+]C1CCC(C)([NH+](C)C)CC1 ZINC000715491935 712523011 /nfs/dbraw/zinc/52/30/11/712523011.db2.gz RIBJFLZSAVSULW-IWMBGFJWSA-N 2 0 224.392 2.495 20 0 BEADRP CC[C@](C)(C[NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1)OC ZINC000715543933 712527286 /nfs/dbraw/zinc/52/72/86/712527286.db2.gz OSFVEERIKZPQLK-MGPQQGTHSA-N 2 0 242.407 2.264 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC[C@@H]2CCCS2)CC[N@@H+]1C ZINC000715603384 712527665 /nfs/dbraw/zinc/52/76/65/712527665.db2.gz PZIIYVAFCABIHT-UPJWGTAASA-N 2 0 242.432 2.344 20 0 BEADRP CC[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H]([NH+](C)C)C2)CO1 ZINC000715560760 712528564 /nfs/dbraw/zinc/52/85/64/712528564.db2.gz DSWDTWUOPPHTQA-ZOBORPQBSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@H]([NH+](C)C)C2)CS1 ZINC000715572727 712529321 /nfs/dbraw/zinc/52/93/21/712529321.db2.gz MVADITPXZXVCFP-VOAKCMCISA-N 2 0 242.432 2.343 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H]([NH+](C)C)C2)CS1 ZINC000715572721 712529434 /nfs/dbraw/zinc/52/94/34/712529434.db2.gz MVADITPXZXVCFP-FVCCEPFGSA-N 2 0 242.432 2.343 20 0 BEADRP CC[C@@H]([NH2+]CCC[NH+]1CCCC1)C(C)C ZINC000037229487 712554473 /nfs/dbraw/zinc/55/44/73/712554473.db2.gz BQAFNCUMKHQBAQ-CYBMUJFWSA-N 2 0 212.381 2.497 20 0 BEADRP C(CCC1CC1)C[NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23 ZINC000716340234 712555549 /nfs/dbraw/zinc/55/55/49/712555549.db2.gz CUMWHIKFYYHHGQ-XPABHHOTSA-N 2 0 234.387 2.153 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]CCCCC2CC2)C1 ZINC000716412942 712559450 /nfs/dbraw/zinc/55/94/50/712559450.db2.gz LIFRQWXMRCNVIK-OLZOCXBDSA-N 2 0 210.365 2.426 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@@H]2C[C@@H]2[C@H]2C[C@H]2C)CC1 ZINC000716584499 712564225 /nfs/dbraw/zinc/56/42/25/712564225.db2.gz PPJSCKJWIBAUSO-DHMWGJHJSA-N 2 0 236.403 2.352 20 0 BEADRP CC[N@H+](C)C[C@H]1CC[NH+](CCCC2CC2)C1 ZINC000813335343 712587830 /nfs/dbraw/zinc/58/78/30/712587830.db2.gz AHENPZUPACKVIL-CQSZACIVSA-N 2 0 224.392 2.450 20 0 BEADRP C(C[C@@H]1CC[C@@H]2C[C@@H]21)[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000717027449 712609428 /nfs/dbraw/zinc/60/94/28/712609428.db2.gz NPNQBIDAHMDJEG-LFTMDZKFSA-N 2 0 248.414 2.400 20 0 BEADRP CCCC[C@H](C)[NH2+]C[C@@H]1C[NH2+]CCC1(F)F ZINC000717303988 712645822 /nfs/dbraw/zinc/64/58/22/712645822.db2.gz LJTRTXVYEMPTDA-QWRGUYRKSA-N 2 0 234.334 2.400 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]C2CCC=CCC2)C1 ZINC000718065931 712740875 /nfs/dbraw/zinc/74/08/75/712740875.db2.gz DRGGMGUPPJMTGF-AAEUAGOBSA-N 2 0 208.349 2.345 20 0 BEADRP [NH3+]C[C@H]1CC[N@H+](CCC2CCCCC2)C1 ZINC000037741974 712753642 /nfs/dbraw/zinc/75/36/42/712753642.db2.gz WUAWHUYYQJUGFE-CYBMUJFWSA-N 2 0 210.365 2.237 20 0 BEADRP [NH3+]C[C@@H]1CC[N@H+](CCC2CCCCC2)C1 ZINC000037741975 712753653 /nfs/dbraw/zinc/75/36/53/712753653.db2.gz WUAWHUYYQJUGFE-ZDUSSCGKSA-N 2 0 210.365 2.237 20 0 BEADRP C[C@@H]1CC[N@H+](CCCC(C)(F)F)C[C@@H]1C[NH3+] ZINC000718570264 712775077 /nfs/dbraw/zinc/77/50/77/712775077.db2.gz JJFKHMLOJIXFSL-MNOVXSKESA-N 2 0 234.334 2.339 20 0 BEADRP COCC(C)(C)CC[NH2+][C@@H](C)[C@H]1CCCC[NH2+]1 ZINC000718713871 712778145 /nfs/dbraw/zinc/77/81/45/712778145.db2.gz AERMGYYXQGDSPS-QWHCGFSZSA-N 2 0 242.407 2.169 20 0 BEADRP C[C@@H]([NH3+])[C@@H]1CCC[N@H+](CCCC(C)(F)F)C1 ZINC000718710772 712778361 /nfs/dbraw/zinc/77/83/61/712778361.db2.gz XXMGTYVCLJURJV-GHMZBOCLSA-N 2 0 234.334 2.481 20 0 BEADRP CO[C@@H]1CCC[C@H]([NH2+]CC[C@H](C)[NH+](C)C)CC1 ZINC000718774413 712782479 /nfs/dbraw/zinc/78/24/79/712782479.db2.gz HUVLAJXYBAHQLK-MELADBBJSA-N 2 0 242.407 2.264 20 0 BEADRP C[C@@H](C[NH2+][C@H]1CCSC1)C[NH+]1CCCCC1 ZINC000038041653 712801489 /nfs/dbraw/zinc/80/14/89/712801489.db2.gz GIKKLCGTDAZDLJ-STQMWFEESA-N 2 0 242.432 2.204 20 0 BEADRP CCCCCC[NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2 ZINC000392806655 712837937 /nfs/dbraw/zinc/83/79/37/712837937.db2.gz CRTTYHFXABKPRY-YHQUGGNUSA-N 2 0 222.376 2.153 20 0 BEADRP CC1(C)C[NH2+]C[C@H]1[NH2+]C1CCCCCC1 ZINC000720779077 712865307 /nfs/dbraw/zinc/86/53/07/712865307.db2.gz FLNCCTGARQNACD-GFCCVEGCSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]1C[N@H+](C)[C@@H](C)CN1c1cc2[nH]ccc2c[nH+]1 ZINC001164633108 719161887 /nfs/dbraw/zinc/16/18/87/719161887.db2.gz GQCPUZRVXALSJZ-QWRGUYRKSA-N 2 0 244.342 2.092 20 0 BEADRP C[NH+](C)[C@@H]1CCCC[C@@H]1Nc1cc[nH+]cc1 ZINC000309953678 960308004 /nfs/dbraw/zinc/30/80/04/960308004.db2.gz HGHUMXAEMQXMAE-QWHCGFSZSA-N 2 0 219.332 2.366 20 0 BEADRP CC[C@H](C)CC[NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32 ZINC000696217393 961873682 /nfs/dbraw/zinc/87/36/82/961873682.db2.gz NVIGNSDHUUJLGU-SNIKSBKOSA-N 2 0 222.376 2.009 20 0 BEADRP CNc1cccc(NC(=[NH2+])SCC[NH3+])c1C ZINC001167916628 961867851 /nfs/dbraw/zinc/86/78/51/961867851.db2.gz UVOFVLLVWWTBBW-UHFFFAOYSA-N 2 0 238.360 2.075 20 0 BEADRP C[C@H]1C[C@H]([NH2+]C2CCC(CC[NH3+])CC2)CCO1 ZINC001168090326 963681293 /nfs/dbraw/zinc/68/12/93/963681293.db2.gz CESITGIGXQWSGE-GFJIZPEISA-N 2 0 240.391 2.051 20 0 BEADRP COCC1([NH2+]C2CCC([NH+](C)C)CC2)CCC1 ZINC001168297533 964394111 /nfs/dbraw/zinc/39/41/11/964394111.db2.gz BECDRHRDQBGQCP-UHFFFAOYSA-N 2 0 240.391 2.018 20 0 BEADRP CC(C)CC[N@@H+]1CCC[C@@H](C[NH3+])[C@H](C)C1 ZINC001205983999 967931865 /nfs/dbraw/zinc/93/18/65/967931865.db2.gz QUDZGQLMXXNTMC-OLZOCXBDSA-N 2 0 212.381 2.339 20 0 BEADRP C[NH2+]CC[C@@H]1CCCC[N@@H+]1CC1CCC1 ZINC000083839995 1165934379 /nfs/dbraw/zinc/93/43/79/1165934379.db2.gz QVGJUZIJYZOTRL-ZDUSSCGKSA-N 2 0 210.365 2.251 20 0 BEADRP C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CCC1CC1 ZINC000083912473 1165938410 /nfs/dbraw/zinc/93/84/10/1165938410.db2.gz LNSYBMVIOZERPV-YHWZYXNKSA-N 2 0 208.349 2.001 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+]CC1(O)CCCCC1 ZINC000226389984 1165972746 /nfs/dbraw/zinc/97/27/46/1165972746.db2.gz ZHPWJSYACADDDB-UHFFFAOYSA-N 2 0 242.407 2.002 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H](C)CN(C)C ZINC000118276901 1166001550 /nfs/dbraw/zinc/00/15/50/1166001550.db2.gz XQXZYVRCZWGWCA-KGLIPLIRSA-N 2 0 243.439 2.037 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+][C@@H]2CCC[C@H]([NH3+])C2)C1 ZINC000086402697 1166006957 /nfs/dbraw/zinc/00/69/57/1166006957.db2.gz BWEDVWQSUBGHHW-YVECIDJPSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@@H](Cc1ccco1)[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000086403005 1166007104 /nfs/dbraw/zinc/00/71/04/1166007104.db2.gz BAGGXJGLXYBLDG-SRVKXCTJSA-N 2 0 222.332 2.070 20 0 BEADRP C[C@@H]1CCC[N@H+](CC(C)(C)C[NH+](C)C)C1 ZINC001207275797 968710444 /nfs/dbraw/zinc/71/04/44/968710444.db2.gz PQIZGSCZMANBSA-GFCCVEGCSA-N 2 0 212.381 2.306 20 0 BEADRP C[NH+](C)CC(C)(C)C[N@@H+]1CC[C@]2(CC2(F)F)C1 ZINC001207286508 968720096 /nfs/dbraw/zinc/72/00/96/968720096.db2.gz VLYRCCJIKGDRPF-LBPRGKRZSA-N 2 0 246.345 2.305 20 0 BEADRP CC(C)(C)CCC[N@@H+]1CC[C@@H](CC[NH3+])C1 ZINC000300827604 1166149575 /nfs/dbraw/zinc/14/95/75/1166149575.db2.gz HUGPGQRMNYIBTI-GFCCVEGCSA-N 2 0 212.381 2.483 20 0 BEADRP CCCC[N@@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC000390756979 1166187812 /nfs/dbraw/zinc/18/78/12/1166187812.db2.gz ILLCZAYBCNUUCG-UHFFFAOYSA-N 2 0 210.365 2.252 20 0 BEADRP C[NH+](C)CC1(C[N@H+](C)CC2CC2)CCCC1 ZINC001208182016 969112306 /nfs/dbraw/zinc/11/23/06/969112306.db2.gz KMROHLRCNXOAPH-UHFFFAOYSA-N 2 0 224.392 2.450 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2CCC[C@H]3C[C@H]32)CC1 ZINC001208602871 969157555 /nfs/dbraw/zinc/15/75/55/969157555.db2.gz PSYIBIVOJIBYKW-UONOGXRCSA-N 2 0 222.376 2.203 20 0 BEADRP CC[NH+]1CCC(C[N@H+](C)CCC2CC2)CC1 ZINC001208601732 969157982 /nfs/dbraw/zinc/15/79/82/969157982.db2.gz RTTGDEYOHGTAIP-UHFFFAOYSA-N 2 0 224.392 2.450 20 0 BEADRP C[C@@H]1C[N@H+](CCC2CC[NH2+]CC2)[C@@H](C)[C@H]1C ZINC000399640126 1166248846 /nfs/dbraw/zinc/24/88/46/1166248846.db2.gz XFCSWCROQSJSNW-AGIUHOORSA-N 2 0 224.392 2.352 20 0 BEADRP C[N@H+](C[C@@H]1CC1(C)C)C[C@H]1CCC[NH+](C)C1 ZINC001208607576 969162013 /nfs/dbraw/zinc/16/20/13/969162013.db2.gz DDHQDWOCYUXIQC-STQMWFEESA-N 2 0 224.392 2.306 20 0 BEADRP CCO[C@@H]1CCC[N@H+](CC(C)(C)C[NH+](C)C)C1 ZINC001207285216 1166273005 /nfs/dbraw/zinc/27/30/05/1166273005.db2.gz DFMZUJRECBXWFE-CYBMUJFWSA-N 2 0 242.407 2.075 20 0 BEADRP CCCCC[C@H](O)C[NH2+][C@H]1CCC[N@H+](C)CC1 ZINC001253549799 969221451 /nfs/dbraw/zinc/22/14/51/969221451.db2.gz GCEBBQNWXWIKLB-KBPBESRZSA-N 2 0 242.407 2.002 20 0 BEADRP CC[N@@H+](Cc1ccncc1)C[C@H]1CC[C@@H]([NH3+])C1 ZINC000227797956 1166327524 /nfs/dbraw/zinc/32/75/24/1166327524.db2.gz VOGBQRUCORNPQX-UONOGXRCSA-N 2 0 233.359 2.031 20 0 BEADRP C[N@@H+](Cc1ccccc1F)C[C@H]1CC[C@@H]([NH3+])C1 ZINC000227803672 1166330251 /nfs/dbraw/zinc/33/02/51/1166330251.db2.gz VDQIPAVMHKRSTJ-WCQYABFASA-N 2 0 236.334 2.385 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2CCC[C@@H]3CCC[C@H]32)C[NH2+]1 ZINC000228018615 1166379952 /nfs/dbraw/zinc/37/99/52/1166379952.db2.gz VEUCWUGYRDUPKE-ZOBORPQBSA-N 2 0 222.376 2.391 20 0 BEADRP CC[N@@H+]1CCC[C@H](C[NH2+][C@H]2CC[C@H](C)C2)C1 ZINC000253182779 1166407411 /nfs/dbraw/zinc/40/74/11/1166407411.db2.gz GDDKHENKRRFJEC-MJBXVCDLSA-N 2 0 224.392 2.497 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+][C@@H]1CC=CCC1)C2 ZINC001169115629 969457767 /nfs/dbraw/zinc/45/77/67/969457767.db2.gz LSDHQZBBRRRMPY-SYQHCUMBSA-N 2 0 220.360 2.310 20 0 BEADRP CCC(CC)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000250788640 1166429984 /nfs/dbraw/zinc/42/99/84/1166429984.db2.gz YCGMGHQKLDRPCR-XYYAHUGASA-N 2 0 210.365 2.390 20 0 BEADRP C[N@@H+]1CCC[C@H](NC(=[NH2+])C(C)(C)C)CC1 ZINC001254499711 969656985 /nfs/dbraw/zinc/65/69/85/969656985.db2.gz OFLIPKXWOPFZFR-JTQLQIEISA-N 2 0 211.353 2.084 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH2+]C[C@@H]2CC[C@@H](F)C2)CC1 ZINC001254497631 969658230 /nfs/dbraw/zinc/65/82/30/969658230.db2.gz LUQLVJDLVBIWTK-JHJVBQTASA-N 2 0 228.355 2.199 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH2+]C[C@H]2CCC(F)(F)C2)CC1 ZINC001254499208 969662522 /nfs/dbraw/zinc/66/25/22/969662522.db2.gz COOIREBYZWWATD-NWDGAFQWSA-N 2 0 246.345 2.496 20 0 BEADRP C[C@H]([NH3+])c1ccc(O[C@H]2CCCC[NH2+]C2)cc1 ZINC001217972954 1166503723 /nfs/dbraw/zinc/50/37/23/1166503723.db2.gz RVPHFMRWGLQYHO-FZMZJTMJSA-N 2 0 234.343 2.227 20 0 BEADRP CC[C@@H]1CC[N@@H+]([C@@H]2CCC[NH+](C)CC2)C1 ZINC001254534599 969732682 /nfs/dbraw/zinc/73/26/82/969732682.db2.gz YCQPUWBEDCTCOA-CHWSQXEVSA-N 2 0 210.365 2.203 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]CCC(F)F)CC1 ZINC000393797124 1166535270 /nfs/dbraw/zinc/53/52/70/1166535270.db2.gz OMRNRYAAHRCNHW-UHFFFAOYSA-N 2 0 220.307 2.104 20 0 BEADRP C(=C/C1CC1)\C[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000378861345 1166563638 /nfs/dbraw/zinc/56/36/38/1166563638.db2.gz QVVGXEKHXSEPPN-JLAUGEKOSA-N 2 0 220.360 2.169 20 0 BEADRP C[C@H]1CC[C@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3C)C1 ZINC001170098025 970266099 /nfs/dbraw/zinc/26/60/99/970266099.db2.gz JSPHJAIIQVNIML-YHQUGGNUSA-N 2 0 222.376 2.390 20 0 BEADRP CC(C)[N@H+](CCC[NH3+])[C@@H]1CCOC(C)(C)C1 ZINC001255527346 970290663 /nfs/dbraw/zinc/29/06/63/970290663.db2.gz KDKGTXUYXAOMKR-GFCCVEGCSA-N 2 0 228.380 2.003 20 0 BEADRP CC[C@@H]1CCC[N@@H+]([C@@H]2CC[NH2+][C@H](C)C2)C1 ZINC000252968675 1166774149 /nfs/dbraw/zinc/77/41/49/1166774149.db2.gz YSHLPAJQSFDQCS-JHJVBQTASA-N 2 0 210.365 2.249 20 0 BEADRP CC[NH+](CC)CC[C@H](C)n1ccnc1[C@H](C)[NH3+] ZINC001255940628 970572290 /nfs/dbraw/zinc/57/22/90/970572290.db2.gz FDPYJEAWEMCGBA-RYUDHWBXSA-N 2 0 238.379 2.196 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]C12CC(C1)C2 ZINC001255943366 970575597 /nfs/dbraw/zinc/57/55/97/970575597.db2.gz LQHRROWVSXNJDW-PNESKVBLSA-N 2 0 210.365 2.249 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]C12CC(C1)C2 ZINC001255943365 970576962 /nfs/dbraw/zinc/57/69/62/970576962.db2.gz LQHRROWVSXNJDW-HIFPTAJRSA-N 2 0 210.365 2.249 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+][C@@H]1CCOC[C@@H]1C ZINC001255948098 970580241 /nfs/dbraw/zinc/58/02/41/970580241.db2.gz DYJCSMHPZPFWJY-MELADBBJSA-N 2 0 242.407 2.121 20 0 BEADRP CCCC[C@H](CO)[NH2+][C@H](C)CC[NH+](CC)CC ZINC001255946617 970584737 /nfs/dbraw/zinc/58/47/37/970584737.db2.gz XDPBKEYENHUSBF-ZIAGYGMSSA-N 2 0 244.423 2.248 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[N@H+](C)CC1CC1 ZINC001255954870 970586597 /nfs/dbraw/zinc/58/65/97/970586597.db2.gz JQAAFGCBOVZXRG-GFCCVEGCSA-N 2 0 212.381 2.449 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[N@H+](C)C(C)C ZINC001255955105 970589500 /nfs/dbraw/zinc/58/95/00/970589500.db2.gz NZEUJOGZKPPLLW-LBPRGKRZSA-N 2 0 200.370 2.447 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[N@@H+]1CC[C@@H](C)C1 ZINC001255956750 970595434 /nfs/dbraw/zinc/59/54/34/970595434.db2.gz MCXFSMOPAAOKLB-OLZOCXBDSA-N 2 0 212.381 2.449 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+][C@@H](C)[C@@H]1CCCO1 ZINC001255955636 970595710 /nfs/dbraw/zinc/59/57/10/970595710.db2.gz VVDWTFRHROQINK-IHRRRGAJSA-N 2 0 242.407 2.264 20 0 BEADRP C[NH+]1CCC([N@@H+]2CC[C@H]3CCC[C@@H]3C2)CC1 ZINC001256205054 970706871 /nfs/dbraw/zinc/70/68/71/970706871.db2.gz VKGULSPKSARELR-CHWSQXEVSA-N 2 0 222.376 2.203 20 0 BEADRP CN1CCC([N@@H+]2CCC[C@@H](C(F)F)C2)CC1 ZINC001256207391 970710429 /nfs/dbraw/zinc/71/04/29/970710429.db2.gz HJIUHWZTWWLNIQ-SNVBAGLBSA-N 2 0 232.318 2.058 20 0 BEADRP CC[NH+](CC)C1CCC([NH2+]C2(C)COC2)CC1 ZINC001173101558 975023441 /nfs/dbraw/zinc/02/34/41/975023441.db2.gz KHLMSXXSQITACY-UHFFFAOYSA-N 2 0 240.391 2.018 20 0 BEADRP Cc1cnccc1CC[N@@H+](C)CC[C@H]([NH3+])C(C)C ZINC000397484493 1166995050 /nfs/dbraw/zinc/99/50/50/1166995050.db2.gz AWQUZNKLDHIDTG-HNNXBMFYSA-N 2 0 249.402 2.238 20 0 BEADRP CC(C)C[N@H+](C)Cc1cc2c(s1)CC[NH2+]C2 ZINC000688038037 1167024401 /nfs/dbraw/zinc/02/44/01/1167024401.db2.gz GXDWXXOCSAXCEB-UHFFFAOYSA-N 2 0 238.400 2.482 20 0 BEADRP CCSC[C@H](C)[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC001173293203 975170163 /nfs/dbraw/zinc/17/01/63/975170163.db2.gz YQNWEHVLURYLST-QWHCGFSZSA-N 2 0 244.448 2.450 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+][C@H]2CCC[C@H](F)C2)C12CCC2 ZINC001332875578 975304063 /nfs/dbraw/zinc/30/40/63/975304063.db2.gz BVZAKCWYQGWMNG-YFKTTZPYSA-N 2 0 226.339 2.127 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H](F)C2)C12CCC2 ZINC001332875572 975304173 /nfs/dbraw/zinc/30/41/73/975304173.db2.gz BVZAKCWYQGWMNG-KKOKHZNYSA-N 2 0 226.339 2.127 20 0 BEADRP CC(C)([NH2+]C1CC[NH2+]CC1)c1ccc(F)cc1 ZINC000215648854 1167110048 /nfs/dbraw/zinc/11/00/48/1167110048.db2.gz HPQWVKZGKWLCPO-UHFFFAOYSA-N 2 0 236.334 2.402 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@@H]2CC23CCC3)CC1 ZINC000721224535 975360388 /nfs/dbraw/zinc/36/03/88/975360388.db2.gz MVIAPHFVWXZIQI-CYBMUJFWSA-N 2 0 222.376 2.391 20 0 BEADRP Cc1sccc1C[N@@H+]1CC[C@@H]([NH3+])[C@H](F)CC1 ZINC001206200441 975376397 /nfs/dbraw/zinc/37/63/97/975376397.db2.gz RPYGJNMGQYKAIO-VXGBXAGGSA-N 2 0 242.363 2.318 20 0 BEADRP C1CCC2(C1)CC[N@@H+]([C@@H]1CCC[NH2+]C1)C2 ZINC000308955095 1167228217 /nfs/dbraw/zinc/22/82/17/1167228217.db2.gz YDUWCYWSKGBPRB-GFCCVEGCSA-N 2 0 208.349 2.005 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@@H](C)Cc1cccc(Cl)c1 ZINC000309322877 1167290676 /nfs/dbraw/zinc/29/06/76/1167290676.db2.gz HKZYHKIQAJSOCM-QWRGUYRKSA-N 2 0 240.778 2.455 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H]2C[C@H]2C2CC2)CC1 ZINC000309589127 1167329489 /nfs/dbraw/zinc/32/94/89/1167329489.db2.gz UCWMHELTYIUDBT-UONOGXRCSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@H]1CC([N@@H+]2CC[C@]3(CC[NH2+]C3)C2)C[C@H](C)C1 ZINC000310143891 1167423348 /nfs/dbraw/zinc/42/33/48/1167423348.db2.gz DUSUNTAUQCIRJV-NFAWXSAZSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]1C[N@@H+]([C@H]2CCc3c2cccc3F)CC[C@H]1[NH3+] ZINC000251617090 1167449740 /nfs/dbraw/zinc/44/97/40/1167449740.db2.gz DTEYCLRRZGABKQ-KMUNFCNLSA-N 2 0 248.345 2.482 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@H]2CC[N@H+](C)C2)C[C@H]1C ZINC000251799936 1167460355 /nfs/dbraw/zinc/46/03/55/1167460355.db2.gz LXQXEXNCOGRKQX-SYQHCUMBSA-N 2 0 224.392 2.352 20 0 BEADRP Cc1ccc(CC[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)o1 ZINC000689733037 1167463554 /nfs/dbraw/zinc/46/35/54/1167463554.db2.gz KAJWTJXABRQFAX-AGUYFDCRSA-N 2 0 248.370 2.345 20 0 BEADRP C[NH2+]C[C@@H]1CCC[N@@H+]([C@H]2CCC[C@@H](C)C2)C1 ZINC000251931657 1167465331 /nfs/dbraw/zinc/46/53/31/1167465331.db2.gz VJDBPCSZJZHVFS-RDBSUJKOSA-N 2 0 224.392 2.497 20 0 BEADRP C[N@H+](CC1CC[NH2+]CC1)CC1(C)CCCC1 ZINC000380694763 1167503392 /nfs/dbraw/zinc/50/33/92/1167503392.db2.gz JSIXOSYSDGXBOZ-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[N@H+](C)C[C@H]1CCC[NH2+]C1 ZINC000252088985 1167588628 /nfs/dbraw/zinc/58/86/28/1167588628.db2.gz DHFGMHRDZVJKGO-RDBSUJKOSA-N 2 0 224.392 2.497 20 0 BEADRP COC1(C[NH2+]CCC[N@H+](C)CC(C)C)CCC1 ZINC001336758220 977924066 /nfs/dbraw/zinc/92/40/66/977924066.db2.gz QASYISNIZZBQES-UHFFFAOYSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2C[C@@H]3CC[NH2+]C[C@@H]3C2)C[C@@H]1C ZINC000310397857 1167681327 /nfs/dbraw/zinc/68/13/27/1167681327.db2.gz MIFPGUTWJHAJDJ-FQKPHLNHSA-N 2 0 236.403 2.352 20 0 BEADRP CC(C)[C@@H](C[NH3+])C[N@@H+]1CCCCC[C@@H]1C ZINC000226957560 1167764414 /nfs/dbraw/zinc/76/44/14/1167764414.db2.gz YQKXHYYFMKHFOQ-STQMWFEESA-N 2 0 212.381 2.482 20 0 BEADRP Cc1cccc(F)c1C[N@@H+]1CCC[C@@H]([NH3+])CC1 ZINC001205117507 1167771223 /nfs/dbraw/zinc/77/12/23/1167771223.db2.gz PRQDUWCEYMRSIL-GFCCVEGCSA-N 2 0 236.334 2.447 20 0 BEADRP Cc1cc(C)c(C[N@@H+]2CCC[C@H]([NH3+])CC2)cn1 ZINC001205117681 1167770787 /nfs/dbraw/zinc/77/07/87/1167770787.db2.gz RPUXDLGYPMVLHZ-AWEZNQCLSA-N 2 0 233.359 2.012 20 0 BEADRP C1CC[C@H]2CCC[N@H+]([C@H]3CCC[NH2+]C3)[C@@H]2C1 ZINC000252372139 1167826045 /nfs/dbraw/zinc/82/60/45/1167826045.db2.gz HBTGAYJPEGRVRI-MELADBBJSA-N 2 0 222.376 2.393 20 0 BEADRP CCC[C@H](C)C[N@@H+]1CC[C@]2(C1)C[NH2+]CC[C@H]2F ZINC001235409751 979037066 /nfs/dbraw/zinc/03/70/66/979037066.db2.gz WUTILDPETAWHJQ-BFHYXJOUSA-N 2 0 242.382 2.446 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CCCC[C@](C)(C[NH3+])C1 ZINC001206542134 979647728 /nfs/dbraw/zinc/64/77/28/979647728.db2.gz SEOUNJNWKIDIHM-JHJVBQTASA-N 2 0 210.365 2.093 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH2+]CCOc2ccccc2)CC1 ZINC000086818955 1168311073 /nfs/dbraw/zinc/31/10/73/1168311073.db2.gz KJAUJRVMOFZSEE-AWEZNQCLSA-N 2 0 248.370 2.139 20 0 BEADRP [NH3+]CC1(C[N@H+](Cc2cccs2)C2CC2)CC1 ZINC000168767200 1168389840 /nfs/dbraw/zinc/38/98/40/1168389840.db2.gz ZUVYZRXWHFZXOB-UHFFFAOYSA-N 2 0 236.384 2.451 20 0 BEADRP CCC1CCC([N@H+](C)C[C@@H](C)C[NH3+])CC1 ZINC000042515300 1168394226 /nfs/dbraw/zinc/39/42/26/1168394226.db2.gz HQWJCBBOXMQRAQ-HIFPTAJRSA-N 2 0 212.381 2.482 20 0 BEADRP CCC[N@H+](CC1CC[NH+](C)CC1)C1CC1 ZINC001119933684 1168440380 /nfs/dbraw/zinc/44/03/80/1168440380.db2.gz HWPHUXAFPHLXKJ-UHFFFAOYSA-N 2 0 210.365 2.203 20 0 BEADRP C[NH2+]Cc1ccccc1C1=CCC[NH2+]CC1 ZINC001238950307 980388946 /nfs/dbraw/zinc/38/89/46/980388946.db2.gz MQCBSFWAPGRUMS-UHFFFAOYSA-N 2 0 216.328 2.173 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H](C)CCC(C)C ZINC001345469984 980616382 /nfs/dbraw/zinc/61/63/82/980616382.db2.gz MNVMCAAXIUNEJW-VXGBXAGGSA-N 2 0 200.370 2.399 20 0 BEADRP CCCCC[N@@H+]1CCC[C@@](F)(C[NH3+])CC1 ZINC001205537178 980904292 /nfs/dbraw/zinc/90/42/92/980904292.db2.gz DWORSKXKWYPVIG-LBPRGKRZSA-N 2 0 216.344 2.330 20 0 BEADRP CCCCC[N@@H+]1CCC[C@](F)(C[NH3+])CC1 ZINC001205537177 980905548 /nfs/dbraw/zinc/90/55/48/980905548.db2.gz DWORSKXKWYPVIG-GFCCVEGCSA-N 2 0 216.344 2.330 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@H]1C[C@@H]2[C@H](C1)C2(C)C ZINC001170711204 1168581493 /nfs/dbraw/zinc/58/14/93/1168581493.db2.gz HYAQFXQYNFLAST-CLLJXQQHSA-N 2 0 224.392 2.352 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@H]1Cc2cccc(Cl)c2C1 ZINC001246316272 1168633206 /nfs/dbraw/zinc/63/32/06/1168633206.db2.gz YRMROBHFATUPOR-QWRGUYRKSA-N 2 0 238.762 2.134 20 0 BEADRP CO[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@H+](C)C(C)(C)C2)C1 ZINC001348100600 981281972 /nfs/dbraw/zinc/28/19/72/981281972.db2.gz YFSFFZCTDWMZJU-YNEHKIRRSA-N 2 0 240.391 2.016 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]Cc1ccc(C)cc1 ZINC001348515042 981379856 /nfs/dbraw/zinc/37/98/56/981379856.db2.gz ISTYPMRGTLXLSY-GFCCVEGCSA-N 2 0 206.333 2.083 20 0 BEADRP CO[C@H]1CCC[C@@H]([NH2+]CCCCCCC[NH3+])C1 ZINC001172922872 1168683330 /nfs/dbraw/zinc/68/33/30/1168683330.db2.gz JKMKHKYVGPBJGR-KGLIPLIRSA-N 2 0 242.407 2.443 20 0 BEADRP CO[C@@H]1CCC[C@H]([NH2+]C(C)(C)CC[NH+](C)C)C1 ZINC001172921124 1168683557 /nfs/dbraw/zinc/68/35/57/1168683557.db2.gz VBKSLWGMAPDLTC-QWHCGFSZSA-N 2 0 242.407 2.264 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH2+]C2CC(C)(C)C2)CC1 ZINC000258121868 1168934589 /nfs/dbraw/zinc/93/45/89/1168934589.db2.gz POTMXZPSZWADBU-LLVKDONJSA-N 2 0 210.365 2.249 20 0 BEADRP CCC[C@@H](C)C[N@H+]1CCc2nccn2CC1 ZINC001201552973 983311880 /nfs/dbraw/zinc/31/18/80/983311880.db2.gz XDGQGWIFDNWELR-GFCCVEGCSA-N 2 0 221.348 2.177 20 0 BEADRP CN1CCC([N@H+](C)CCC(C)(C)C)CC1 ZINC001202055540 983540818 /nfs/dbraw/zinc/54/08/18/983540818.db2.gz MDWPSQIPNYJKGN-UHFFFAOYSA-N 2 0 212.381 2.449 20 0 BEADRP CSC1(C[NH2+][C@@H](C)C2C[NH2+]C2)CCCCC1 ZINC000686225310 1169102620 /nfs/dbraw/zinc/10/26/20/1169102620.db2.gz HCAVGAAPOIGEMS-NSHDSACASA-N 2 0 242.432 2.250 20 0 BEADRP C1=C[C@@H](C[NH2+]CC2C[C@H]3CC[C@@H](C2)[NH2+]3)CC1 ZINC001574775191 984119247 /nfs/dbraw/zinc/11/92/47/984119247.db2.gz XNYFWYWYEQLBAR-RLAWYHOSSA-N 2 0 220.360 2.073 20 0 BEADRP CCOCC[C@H](C)[NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1 ZINC001172414668 974682655 /nfs/dbraw/zinc/68/26/55/974682655.db2.gz GWOITIFXJWGAKA-BFHYXJOUSA-N 2 0 242.407 2.264 20 0 BEADRP CC(C)OCC[C@H](C)[NH+]1CCC([NH+](C)C)CC1 ZINC001172438915 974796586 /nfs/dbraw/zinc/79/65/86/974796586.db2.gz ATOPVDBMVAYJHR-ZDUSSCGKSA-N 2 0 242.407 2.216 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)[C@@H](C)CCOC(C)C ZINC001172455562 974818281 /nfs/dbraw/zinc/81/82/81/974818281.db2.gz VPZAICIFSHCOEK-AWEZNQCLSA-N 2 0 244.423 2.464 20 0 BEADRP C[C@]1(C[NH3+])CCC[N@@H+](C2CCSCC2)CC1 ZINC001246577307 972880699 /nfs/dbraw/zinc/88/06/99/972880699.db2.gz NYRMYENGDNOGEQ-ZDUSSCGKSA-N 2 0 242.432 2.333 20 0 BEADRP CC(C)CCC[C@@H](C)[NH+]1CC(C)(C[NH3+])C1 ZINC001246598362 973013303 /nfs/dbraw/zinc/01/33/03/973013303.db2.gz NXQRBLHNCHHZPP-GFCCVEGCSA-N 2 0 212.381 2.482 20 0 BEADRP CC(C)[N@H+](CCC[NH3+])[C@H](C)Cc1ccccn1 ZINC001256396861 970803573 /nfs/dbraw/zinc/80/35/73/970803573.db2.gz LVDWGPMCAFNWNO-CYBMUJFWSA-N 2 0 235.375 2.072 20 0 BEADRP C[C@H](Cc1ccccn1)[NH2+]C(C)(C)C(C)(C)[NH3+] ZINC001256406088 970813151 /nfs/dbraw/zinc/81/31/51/970813151.db2.gz SGHSNAFMLKXLCN-LLVKDONJSA-N 2 0 235.375 2.118 20 0 BEADRP CC[N@H+](CCCCCC[NH3+])[C@H]1CCCOC1 ZINC000402642573 970819549 /nfs/dbraw/zinc/81/95/49/970819549.db2.gz FNDHPZUMTNUGCL-ZDUSSCGKSA-N 2 0 228.380 2.006 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)[C@H]1CCOC(C)(C)C1 ZINC000351918935 970823586 /nfs/dbraw/zinc/82/35/86/970823586.db2.gz LAKMYMSSPPIFHL-ZDUSSCGKSA-N 2 0 242.407 2.218 20 0 BEADRP F[C@@H]1C[C@H]1NC1CC[NH+](Cc2ccccc2)CC1 ZINC001256599476 970871973 /nfs/dbraw/zinc/87/19/73/970871973.db2.gz SPWYEUXLWRDMNG-HUUCEWRRSA-N 2 0 248.345 2.351 20 0 BEADRP CCCCCC[N@@H+]1CCC(F)(F)[C@@H](C[NH3+])C1 ZINC000403174070 970893935 /nfs/dbraw/zinc/89/39/35/970893935.db2.gz OGNBLWYPWUIXSL-NSHDSACASA-N 2 0 234.334 2.483 20 0 BEADRP CC/C=C/[NH2+]C1CCC([NH+]2CCOCC2)CC1 ZINC001256685272 970920942 /nfs/dbraw/zinc/92/09/42/970920942.db2.gz AWNHZVPRKVDFQD-FPYGCLRLSA-N 2 0 238.375 2.143 20 0 BEADRP CCC[N@H+](CCC[NH3+])[C@H](C)Cc1ccncc1 ZINC001256719860 970942315 /nfs/dbraw/zinc/94/23/15/970942315.db2.gz VIIMTBIPIVKBEI-CYBMUJFWSA-N 2 0 235.375 2.073 20 0 BEADRP [NH3+]CCCC[NH2+][C@@H]1CCO[C@H](c2ccccc2)C1 ZINC001256787312 970989167 /nfs/dbraw/zinc/98/91/67/970989167.db2.gz QLQJVBHZSBFZOQ-CABCVRRESA-N 2 0 248.370 2.235 20 0 BEADRP C[NH2+]Cc1cccc(Nc2[nH+]ccn2C)c1F ZINC001216219483 970990951 /nfs/dbraw/zinc/99/09/51/970990951.db2.gz VYRGAYIZKCOKOC-UHFFFAOYSA-N 2 0 234.278 2.022 20 0 BEADRP ClC(Cl)=CC[N@H+]1CC[C@H]2C[NH2+]C[C@H]2CC1 ZINC000403600470 970993862 /nfs/dbraw/zinc/99/38/62/970993862.db2.gz GMRSUVOOXLXJER-AOOOYVTPSA-N 2 0 249.185 2.237 20 0 BEADRP CCC[N@H+](C)C1CCN(c2cc[nH+]cc2)CC1 ZINC001256855666 970999261 /nfs/dbraw/zinc/99/92/61/970999261.db2.gz RKMXOUSBFSSESW-UHFFFAOYSA-N 2 0 233.359 2.392 20 0 BEADRP CC[C@@H]1CO[C@@H](CC)C[N@@H+]1CCCCCC[NH3+] ZINC000403731889 971033554 /nfs/dbraw/zinc/03/35/54/971033554.db2.gz BABZVGRCCDWKKW-KGLIPLIRSA-N 2 0 242.407 2.395 20 0 BEADRP C[C@H]1CC([NH2+]CC[C@H]2CCC[N@@H+]2C)C[C@H](C)O1 ZINC001257084118 971094854 /nfs/dbraw/zinc/09/48/54/971094854.db2.gz ODYZNUQYEMYKCY-SGMGOOAPSA-N 2 0 240.391 2.016 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]C2(C)CCC2)CC1 ZINC001257204917 971125203 /nfs/dbraw/zinc/12/52/03/971125203.db2.gz TZEBDMMKMFJTKA-UHFFFAOYSA-N 2 0 210.365 2.391 20 0 BEADRP C[C@@H]1CCC[N@H+](C/C=C\Cl)[C@@H]1CC[NH3+] ZINC000404368519 971156507 /nfs/dbraw/zinc/15/65/07/971156507.db2.gz QEZLGAGLQVDZBW-KQLCGWBMSA-N 2 0 216.756 2.188 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+][C@H]1C[C@@H]([NH3+])C12CCC2 ZINC000404521628 971170607 /nfs/dbraw/zinc/17/06/07/971170607.db2.gz PVVWTCOOLKXBAL-YFKTTZPYSA-N 2 0 210.365 2.281 20 0 BEADRP CCc1cc(NC2(C)CC[NH2+]CC2)cc[nH+]1 ZINC000307773933 971174498 /nfs/dbraw/zinc/17/44/98/971174498.db2.gz GFFUSDIIKCXBEY-UHFFFAOYSA-N 2 0 219.332 2.198 20 0 BEADRP CCc1cc(NC2C[NH+](C(C)C)C2)cc[nH+]1 ZINC000307769315 971175268 /nfs/dbraw/zinc/17/52/68/971175268.db2.gz LBINJPFQCHSPLI-UHFFFAOYSA-N 2 0 219.332 2.149 20 0 BEADRP CCC(CC)[N@@H+]1C[C@H]2CC[NH+](C)C[C@H]2C1 ZINC001257297072 971183941 /nfs/dbraw/zinc/18/39/41/971183941.db2.gz PKHPUGPTPCQQDJ-NEPJUHHUSA-N 2 0 210.365 2.059 20 0 BEADRP CC1(C)[C@H]([NH3+])C[C@@H]1[NH2+]CCc1cccs1 ZINC000404842974 971186411 /nfs/dbraw/zinc/18/64/11/971186411.db2.gz CHPDXWHVAMUQDX-MNOVXSKESA-N 2 0 224.373 2.006 20 0 BEADRP C[C@H]1C[C@@H](C[NH+]2CCC(F)(F)CC2)CC[NH2+]1 ZINC000405013367 971190007 /nfs/dbraw/zinc/19/00/07/971190007.db2.gz GHRFXDYGMWTHAK-QWRGUYRKSA-N 2 0 232.318 2.106 20 0 BEADRP FC1(F)CC12CC[NH+](CCC[NH2+]C1CC1)CC2 ZINC000405061440 971192582 /nfs/dbraw/zinc/19/25/82/971192582.db2.gz OQVCWMNTOAHMPE-UHFFFAOYSA-N 2 0 244.329 2.250 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]C[C@@H]2CCCCS2)C12CCC2 ZINC000405237644 971214153 /nfs/dbraw/zinc/21/41/53/971214153.db2.gz FTWUESPRIBYKMF-QJPTWQEYSA-N 2 0 240.416 2.132 20 0 BEADRP CC(F)(F)CCC[NH2+][C@@H]1C[C@H]([NH3+])C1(C)C ZINC000405223950 971215243 /nfs/dbraw/zinc/21/52/43/971215243.db2.gz NSPRIRDDRNJZOA-DTWKUNHWSA-N 2 0 220.307 2.137 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405224823 971215493 /nfs/dbraw/zinc/21/54/93/971215493.db2.gz OBMJTKRADVSEHM-MRVWCRGKSA-N 2 0 248.370 2.460 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]CCc2ccccc2F)C12CCC2 ZINC000405238367 971216570 /nfs/dbraw/zinc/21/65/70/971216570.db2.gz VBGUICQLQUXOBL-KGLIPLIRSA-N 2 0 248.345 2.228 20 0 BEADRP Cc1ccccc1CC[NH2+][C@@H]1C[C@H]([NH3+])C12CCC2 ZINC000405261111 971218698 /nfs/dbraw/zinc/21/86/98/971218698.db2.gz OUNQRHCUZLAVBK-LSDHHAIUSA-N 2 0 244.382 2.397 20 0 BEADRP Cc1ccccc1CC[NH2+][C@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405261103 971220952 /nfs/dbraw/zinc/22/09/52/971220952.db2.gz OUNQRHCUZLAVBK-CABCVRRESA-N 2 0 244.382 2.397 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2C[C@@H]([NH3+])C23CCC3)s1 ZINC000405247861 971222048 /nfs/dbraw/zinc/22/20/48/971222048.db2.gz GQQFWZNKGUPBPE-VXGBXAGGSA-N 2 0 236.384 2.416 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2C[C@H]([NH3+])C23CCC3)cc1 ZINC000405246773 971222436 /nfs/dbraw/zinc/22/24/36/971222436.db2.gz HUQWZRXFFWUXIV-KBPBESRZSA-N 2 0 230.355 2.355 20 0 BEADRP CCC[C@H](C)[N@H+]1C[C@H]2C[NH+](CCC)C[C@H]2C1 ZINC001257327070 971226476 /nfs/dbraw/zinc/22/64/76/971226476.db2.gz GEVPISPEIPQVKA-MELADBBJSA-N 2 0 224.392 2.449 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]Cc2cccc(F)c2)C12CCC2 ZINC000405326105 971239252 /nfs/dbraw/zinc/23/92/52/971239252.db2.gz UKALJMZXFHUZII-CHWSQXEVSA-N 2 0 234.318 2.185 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@@H]2C[C@@H]([NH3+])C23CCC3)C1 ZINC000405350720 971240742 /nfs/dbraw/zinc/24/07/42/971240742.db2.gz NXSCOTFMBMVREK-YVECIDJPSA-N 2 0 222.376 2.425 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@@H]2C[C@H]([NH3+])C23CCC3)C1 ZINC000405350714 971243175 /nfs/dbraw/zinc/24/31/75/971243175.db2.gz NXSCOTFMBMVREK-MROQNXINSA-N 2 0 222.376 2.425 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]CC2CCCCC2)C12CCC2 ZINC000405360450 971243794 /nfs/dbraw/zinc/24/37/94/971243794.db2.gz TYTIETDVRBAPEK-CHWSQXEVSA-N 2 0 222.376 2.426 20 0 BEADRP C[C@H]1CC[C@H]([NH2+][C@@H]2C[C@@H]([NH3+])C23CCC3)CC1 ZINC000405376502 971248695 /nfs/dbraw/zinc/24/86/95/971248695.db2.gz BMRMGLRTOZBWGS-FDYHWXHSSA-N 2 0 222.376 2.425 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]CCCC2CC2)C12CCC2 ZINC000405430249 971254566 /nfs/dbraw/zinc/25/45/66/971254566.db2.gz APYJKRHRJONERA-VXGBXAGGSA-N 2 0 208.349 2.036 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@@H]2C[C@H]([NH3+])C23CCC3)C1 ZINC000405443663 971256622 /nfs/dbraw/zinc/25/66/22/971256622.db2.gz FFOPFBZZUUYUDF-NOOOWODRSA-N 2 0 208.349 2.035 20 0 BEADRP CCC(CC)C[NH2+][C@@H]1C[C@H]([NH3+])C12CCC2 ZINC000405465483 971259365 /nfs/dbraw/zinc/25/93/65/971259365.db2.gz JSVJGHXSOKNKQE-NWDGAFQWSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]([NH2+][C@H]1C[C@@H]([NH3+])C12CCC2)C1CCC1 ZINC000405469381 971260752 /nfs/dbraw/zinc/26/07/52/971260752.db2.gz KOBPGWDZWBLXCE-WCQGTBRESA-N 2 0 208.349 2.035 20 0 BEADRP CC1(C[NH2+][C@H]2C[C@@H]([NH3+])C23CCC3)CCC1 ZINC000405531745 971267535 /nfs/dbraw/zinc/26/75/35/971267535.db2.gz YICCTNBNAOTAEO-MNOVXSKESA-N 2 0 208.349 2.036 20 0 BEADRP CCC[C@H](CC)[NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405498820 971267668 /nfs/dbraw/zinc/26/76/68/971267668.db2.gz QOULLZXRAMDCMS-QJPTWQEYSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@@]1([NH3+])CC[N@H+](CCC2CCCCC2)C1 ZINC000405794945 971309748 /nfs/dbraw/zinc/30/97/48/971309748.db2.gz MZKNBBXOUIZJMJ-CYBMUJFWSA-N 2 0 210.365 2.380 20 0 BEADRP C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C[C@H]1C[C@H]2C=C[C@@H]1C2 ZINC001276758548 971324194 /nfs/dbraw/zinc/32/41/94/971324194.db2.gz FAFZSUFLMHZDEO-BLRNQLGPSA-N 2 0 246.398 2.413 20 0 BEADRP CC[C@@H](C)[NH2+][C@H]1CC[C@H]([NH+]2CCOCC2)CC1 ZINC001257432806 971339021 /nfs/dbraw/zinc/33/90/21/971339021.db2.gz AIENKDXAUWTTET-MGPQQGTHSA-N 2 0 240.391 2.018 20 0 BEADRP CC[C@H](C)[NH+]1CCC([NH3+])(CC2CC2)CC1 ZINC001257434597 971341848 /nfs/dbraw/zinc/34/18/48/971341848.db2.gz SAIXVLPFLSCVSK-NSHDSACASA-N 2 0 210.365 2.378 20 0 BEADRP CCCC[NH+](CCCC)CCCOC1C[NH2+]C1 ZINC001217789188 971406703 /nfs/dbraw/zinc/40/67/03/971406703.db2.gz FIAKXVZZCIQHKB-UHFFFAOYSA-N 2 0 242.407 2.267 20 0 BEADRP CCCC[C@H](CC)C[NH+]1CC2(C1)CC[NH2+]C2 ZINC000724110280 971495634 /nfs/dbraw/zinc/49/56/34/971495634.db2.gz DTNWSRKFARXSIC-ZDUSSCGKSA-N 2 0 224.392 2.498 20 0 BEADRP CC(C)C[NH+]1CCC([N@H+](C)CC2CC2)CC1 ZINC001258011405 971554248 /nfs/dbraw/zinc/55/42/48/971554248.db2.gz MDFAKBSGMOGVIV-UHFFFAOYSA-N 2 0 224.392 2.449 20 0 BEADRP CC(C)C[NH+]1CCC([NH2+]C23CC(C2)C3)CC1 ZINC001258002201 971551827 /nfs/dbraw/zinc/55/18/27/971551827.db2.gz BADPYGDYEUTALU-UHFFFAOYSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@H]([NH3+])c1ccc(O[C@H]2CCC[NH2+]CC2)cc1 ZINC001217998818 971563866 /nfs/dbraw/zinc/56/38/66/971563866.db2.gz FKPWAEWDSMMQDW-AAEUAGOBSA-N 2 0 234.343 2.227 20 0 BEADRP C[C@@H]([NH3+])c1ccc(O[C@@H]2CCC[NH2+]CC2)cc1 ZINC001217998819 971565868 /nfs/dbraw/zinc/56/58/68/971565868.db2.gz FKPWAEWDSMMQDW-DGCLKSJQSA-N 2 0 234.343 2.227 20 0 BEADRP C[C@H]([NH3+])c1ccc(O[C@H]2CC[NH2+]CC[C@H]2C)cc1 ZINC001218034118 971575737 /nfs/dbraw/zinc/57/57/37/971575737.db2.gz LYWHCHQUBUNMGG-XUJVJEKNSA-N 2 0 248.370 2.473 20 0 BEADRP [NH3+]Cc1ccc(O[C@H]2CCC[C@]23CC[NH2+]C3)cc1 ZINC001218091186 971596865 /nfs/dbraw/zinc/59/68/65/971596865.db2.gz DEUVBESRKXPDDQ-LSDHHAIUSA-N 2 0 246.354 2.056 20 0 BEADRP C[C@@H]([NH3+])c1ccc(O[C@H]2CC[NH2+][C@H](C)C2)cc1 ZINC001218053433 971591608 /nfs/dbraw/zinc/59/16/08/971591608.db2.gz QVFGWSXOILTLHI-GYSYKLTISA-N 2 0 234.343 2.226 20 0 BEADRP C[C@@H]1C[C@H](Oc2ccc([C@@H]3C[C@H]3[NH3+])cc2)CC[NH2+]1 ZINC001218054250 971592825 /nfs/dbraw/zinc/59/28/25/971592825.db2.gz YGSGVZJLOCJJIC-QPKOPYBWSA-N 2 0 246.354 2.021 20 0 BEADRP CCN1CCC([NH2+][C@@H]2C[C@@H]3[C@H](C2)C3(C)C)CC1 ZINC001170714986 971632954 /nfs/dbraw/zinc/63/29/54/971632954.db2.gz CTOMLUHINZCEOK-ZSOGYDGISA-N 2 0 236.403 2.495 20 0 BEADRP CC1(C)[C@@H]2C[C@H]([NH2+][C@H]3CCC[C@H]([NH3+])C3)C[C@@H]21 ZINC001170729304 971668192 /nfs/dbraw/zinc/66/81/92/971668192.db2.gz CDWUZRJZGFAUHU-NWBUJAPZSA-N 2 0 222.376 2.281 20 0 BEADRP CCCC[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172100788 974347975 /nfs/dbraw/zinc/34/79/75/974347975.db2.gz TXYHQSYULVNWHS-XYYAHUGASA-N 2 0 210.365 2.391 20 0 BEADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]CCc1ccco1)C2 ZINC001172103748 974363447 /nfs/dbraw/zinc/36/34/47/974363447.db2.gz XGRRFIUXNAWAET-BTTYYORXSA-N 2 0 248.370 2.427 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+][C@H](C)CCOC ZINC000309654802 971723970 /nfs/dbraw/zinc/72/39/70/971723970.db2.gz PHCHBOQBUATWPV-QWHCGFSZSA-N 2 0 230.396 2.121 20 0 BEADRP C[NH+](C)C[C@@]12C[C@@H]1C[N@@H+]([C@H]1C[C@@H]3[C@H](C1)C3(C)C)C2 ZINC001170765996 971758089 /nfs/dbraw/zinc/75/80/89/971758089.db2.gz ZZCDEERHDVUXFE-XYFZXANASA-N 2 0 248.414 2.305 20 0 BEADRP CC[NH+]1C[C@@H]2C[NH+]([C@H]3C[C@@H]4[C@H](C3)C4(C)C)C[C@H]2C1 ZINC001170767997 971761214 /nfs/dbraw/zinc/76/12/14/971761214.db2.gz VSLFEPQIGTYMHH-ARILJUKYSA-N 2 0 248.414 2.305 20 0 BEADRP CC[N@H+]1C[C@@H]2C[NH+]([C@H]3C[C@@H]4[C@H](C3)C4(C)C)C[C@@H]2C1 ZINC001170768005 971761943 /nfs/dbraw/zinc/76/19/43/971761943.db2.gz VSLFEPQIGTYMHH-SBAKFKMJSA-N 2 0 248.414 2.305 20 0 BEADRP [NH3+]CC1(F)CC[NH+](C[C@@H]2CC=CCC2)CC1 ZINC001222528005 972538968 /nfs/dbraw/zinc/53/89/68/972538968.db2.gz SLAOTINNWGJHNS-GFCCVEGCSA-N 2 0 226.339 2.106 20 0 BEADRP CC[C@H](C)OCC[C@@H](C)[NH2+]C[C@H]1CC[N@H+](C)C1 ZINC001172315674 974522291 /nfs/dbraw/zinc/52/22/91/974522291.db2.gz CLAYFPBLKAVOLF-HZSPNIEDSA-N 2 0 242.407 2.121 20 0 BEADRP CC1(C)C[C@@H](Oc2ccc(CC[NH3+])cc2)CC[NH2+]1 ZINC001218475964 971827193 /nfs/dbraw/zinc/82/71/93/971827193.db2.gz OPACOUUOJRQAGE-AWEZNQCLSA-N 2 0 248.370 2.097 20 0 BEADRP [NH3+]CCCCCCC[NH2+][C@@H]1CCCOCC1 ZINC001170791722 971832881 /nfs/dbraw/zinc/83/28/81/971832881.db2.gz CQAFDVVSCFWLTG-CYBMUJFWSA-N 2 0 228.380 2.054 20 0 BEADRP CCC[C@@H](C)C[NH+]1CCC(F)(C[NH3+])CC1 ZINC001222526517 972543147 /nfs/dbraw/zinc/54/31/47/972543147.db2.gz CMAVBVMXDAGCCP-LLVKDONJSA-N 2 0 216.344 2.185 20 0 BEADRP C[NH+](C)[C@H]1CCCC[C@H]1Nc1cc[nH+]cc1 ZINC000309953677 971892713 /nfs/dbraw/zinc/89/27/13/971892713.db2.gz HGHUMXAEMQXMAE-OLZOCXBDSA-N 2 0 219.332 2.366 20 0 BEADRP C[NH+](C)C1CCC([NH2+][C@H]2C[C@@H]2C2CC2)CC1 ZINC000309984367 971910537 /nfs/dbraw/zinc/91/05/37/971910537.db2.gz XRRMBRLJAHUWEM-PQAZSJQKSA-N 2 0 222.376 2.247 20 0 BEADRP [NH3+]C[C@H]1CCCC[N@H+](CCc2ccccc2)C1 ZINC000310220504 971959726 /nfs/dbraw/zinc/95/97/26/971959726.db2.gz FWGSPVCGXUKEPG-OAHLLOKOSA-N 2 0 232.371 2.290 20 0 BEADRP Cc1cc(N[C@@H]([NH3+])CCC[NH3+])cc(C)c1C ZINC001170898573 972058896 /nfs/dbraw/zinc/05/88/96/972058896.db2.gz FCURUOHQHXEFII-CYBMUJFWSA-N 2 0 221.348 2.047 20 0 BEADRP Cc1cc(C)c(C)c(N[C@@H]([NH3+])CCC[NH3+])c1C ZINC001170899300 972060872 /nfs/dbraw/zinc/06/08/72/972060872.db2.gz AAWYLPXVWFZFBU-CYBMUJFWSA-N 2 0 235.375 2.356 20 0 BEADRP C[C@@H]([NH3+])CCNc1ccc([C@@H]2CCC[NH2+]C2)cc1 ZINC001170894876 972067748 /nfs/dbraw/zinc/06/77/48/972067748.db2.gz NJFMIPOMCZUZCA-TZMCWYRMSA-N 2 0 247.386 2.303 20 0 BEADRP [NH3+]CCC[C@@H]([NH3+])Nc1cccc(C2CCC2)c1 ZINC001170905081 972080317 /nfs/dbraw/zinc/08/03/17/972080317.db2.gz RDTQLGRVVKRWHZ-AWEZNQCLSA-N 2 0 233.359 2.390 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H](C[NH2+][C@@H]2C[C@@H]3[C@H](C2)C3(C)C)C1 ZINC001246101317 972157551 /nfs/dbraw/zinc/15/75/51/972157551.db2.gz PKAMFRCNDRSEBJ-ZUWCUPBKSA-N 2 0 236.403 2.256 20 0 BEADRP CC(C)OCC[C@@H](C)[NH2+]C[C@@H]1CCC[NH2+][C@H]1C ZINC001246114754 972180174 /nfs/dbraw/zinc/18/01/74/972180174.db2.gz XERJGVRGTRIWLK-RDBSUJKOSA-N 2 0 242.407 2.168 20 0 BEADRP C[N@@H+]1CCC=C(c2cccc3c2CC[C@@H]3[NH3+])C1 ZINC001241571244 1169735005 /nfs/dbraw/zinc/73/50/05/1169735005.db2.gz WQDHSPJQCOSTES-HNNXBMFYSA-N 2 0 228.339 2.352 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2C[C@@H]([NH3+])C2)CC(C)(C)C1 ZINC001246190718 972211644 /nfs/dbraw/zinc/21/16/44/972211644.db2.gz RRESNSRJXWDVKA-WYUUTHIRSA-N 2 0 210.365 2.281 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)CC[C@@H](C)SC ZINC001208149257 957027721 /nfs/dbraw/zinc/02/77/21/957027721.db2.gz MWALOSVQLGTODE-GFCCVEGCSA-N 2 0 232.437 2.402 20 0 BEADRP CC[C@@H]1CCC[N@H+](C[C@H]2CCC[NH+](C)C2)C1 ZINC001208608376 957088621 /nfs/dbraw/zinc/08/86/21/957088621.db2.gz IDQJGGCMPZXSIJ-KGLIPLIRSA-N 2 0 224.392 2.450 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH+]2CC3(C2)CCCC3)C1 ZINC001208608174 957094445 /nfs/dbraw/zinc/09/44/45/957094445.db2.gz QYBFPXUGGSZWOB-CYBMUJFWSA-N 2 0 222.376 2.204 20 0 BEADRP C[C@H]1CCCC[N@@H+](C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000705581197 957354809 /nfs/dbraw/zinc/35/48/09/957354809.db2.gz HREXQXQPOKDGKM-ICIURTGMSA-N 2 0 222.376 2.391 20 0 BEADRP Cc1ccc(C[C@H](C)[NH2+]CC[C@H](C)[NH3+])cc1 ZINC001246304286 972265638 /nfs/dbraw/zinc/26/56/38/972265638.db2.gz LHTHJGBHGGXRLO-STQMWFEESA-N 2 0 220.360 2.253 20 0 BEADRP Cc1cc(N2CC[NH+](C[C@@H]3C[C@@H]3C)CC2)cc[nH+]1 ZINC001209426248 957446502 /nfs/dbraw/zinc/44/65/02/957446502.db2.gz JSWOKBWMTZICGK-JSGCOSHPSA-N 2 0 245.370 2.168 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@H]1CCc2c(F)cccc2C1 ZINC001246311418 972273874 /nfs/dbraw/zinc/27/38/74/972273874.db2.gz CLTFSTUHWMKUOE-NEPJUHHUSA-N 2 0 236.334 2.010 20 0 BEADRP c1cc(NCC[C@H]2CCC[NH2+]2)[nH+]c2c1CCC2 ZINC000166877019 957645778 /nfs/dbraw/zinc/64/57/78/957645778.db2.gz MUAKVAWPAHCETQ-GFCCVEGCSA-N 2 0 231.343 2.124 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@@H]2CC[C@H](C)[NH2+]C2)C1 ZINC000397535116 957680885 /nfs/dbraw/zinc/68/08/85/957680885.db2.gz OJPMJGGSUIIWTO-XQHKEYJVSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C2CC3(C2)CC(F)(F)C3)CC[NH2+]1 ZINC001246336312 972297490 /nfs/dbraw/zinc/29/74/90/972297490.db2.gz UNWIFSUPZWPXDQ-ZJUUUORDSA-N 2 0 244.329 2.294 20 0 BEADRP C[NH2+]CCC(=O)NCC[PH+](C(C)C)C(C)C ZINC001221254137 972306754 /nfs/dbraw/zinc/30/67/54/972306754.db2.gz GGQGXVDDIFMFPC-UHFFFAOYSA-N 2 0 246.335 2.011 20 0 BEADRP CCCC1CCC([NH2+][C@H]2CC23C[NH2+]C3)CC1 ZINC001246443016 972316479 /nfs/dbraw/zinc/31/64/79/972316479.db2.gz FPEZFEIOSCOWCC-BPCQOVAHSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H](CC(F)(F)F)[NH2+]C[C@@H]1C[NH2+]C[C@@H](C)C1 ZINC000398645021 958341300 /nfs/dbraw/zinc/34/13/00/958341300.db2.gz BVOLTLWMYWIHCP-AEJSXWLSSA-N 2 0 238.297 2.163 20 0 BEADRP C[C@H]1C[NH2+]C[C@H](C[NH2+]C2CCCCC2)C1 ZINC000398808955 958398174 /nfs/dbraw/zinc/39/81/74/958398174.db2.gz OPXNYVQNCMMJFS-VXGBXAGGSA-N 2 0 210.365 2.154 20 0 BEADRP CC[C@@H](C)OCC[C@H](C)[NH2+][C@H]1CCCC[C@H]1[NH3+] ZINC001246474681 972347192 /nfs/dbraw/zinc/34/71/92/972347192.db2.gz AWXKVOIMSAAQEX-DGAVXFQQSA-N 2 0 242.407 2.440 20 0 BEADRP C[C@@H]1CC[C@@H](N(C)CCc2cccs2)C[NH2+]1 ZINC000398983361 958471789 /nfs/dbraw/zinc/47/17/89/958471789.db2.gz GZQPIKSYMXATID-VXGBXAGGSA-N 2 0 238.400 2.363 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[N@@H+]2CC[C@H](c3ccccc3)C2)C1 ZINC000693547766 958759038 /nfs/dbraw/zinc/75/90/38/958759038.db2.gz SBZIEJGGZJOHIU-AEGPPILISA-N 2 0 230.355 2.213 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)S3)C1 ZINC000403674968 958787617 /nfs/dbraw/zinc/78/76/17/958787617.db2.gz PTVHJVIJVCTUQU-GJHMDTBVSA-N 2 0 240.416 2.273 20 0 BEADRP C([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)[C@]12C[C@H]1CCC2 ZINC000693570702 958865089 /nfs/dbraw/zinc/86/50/89/958865089.db2.gz ZKNWNGZWAJZENO-JARUQAPTSA-N 2 0 234.387 2.154 20 0 BEADRP C[C@@H]1C[C@@H](C)[C@@H](C)[N@H+](C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000693578905 958869019 /nfs/dbraw/zinc/86/90/19/958869019.db2.gz LMQQTJVSBOSEJB-VEGXAWMVSA-N 2 0 210.365 2.090 20 0 BEADRP C[C@@H](Cc1ccccn1)[NH2+]CC[C@H]1CCC[N@@H+]1C ZINC000707961851 958879336 /nfs/dbraw/zinc/87/93/36/958879336.db2.gz VMONDLYLFQKGSE-DZGCQCFKSA-N 2 0 247.386 2.087 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+]C2CCC3(CC3)CC2)C1 ZINC000693601534 958925283 /nfs/dbraw/zinc/92/52/83/958925283.db2.gz GTGOXNIUUOTHGB-XYPYZODXSA-N 2 0 208.349 2.036 20 0 BEADRP Cc1nc(C)c([C@H](C)[NH2+]C[C@H]2C[C@H]([NH3+])C2)s1 ZINC000693601150 958927787 /nfs/dbraw/zinc/92/77/87/958927787.db2.gz DIUBRACRGFBOBI-SWPVVBRQSA-N 2 0 239.388 2.148 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CCC[NH2+]1)C1CCCCC1 ZINC000235212532 959064928 /nfs/dbraw/zinc/06/49/28/959064928.db2.gz IOJVZDKMAPNRCJ-DGCLKSJQSA-N 2 0 210.365 2.297 20 0 BEADRP C1=CCC(C[N@@H+]2CCCC3(CC[NH2+]CC3)C2)C1 ZINC001350396647 959169746 /nfs/dbraw/zinc/16/97/46/959169746.db2.gz DRGFCASSPAMKTC-UHFFFAOYSA-N 2 0 234.387 2.418 20 0 BEADRP Cc1c[nH]c(CN2CCC[C@@]23CCC[NH2+]C3)c1C ZINC001222242919 972421448 /nfs/dbraw/zinc/42/14/48/972421448.db2.gz HZVVHGYPCRYQKS-OAHLLOKOSA-N 2 0 247.386 2.350 20 0 BEADRP C[NH+](C)C1CCC([NH2+][C@@H]2CC2(C)C)CC1 ZINC000309045211 959569738 /nfs/dbraw/zinc/56/97/38/959569738.db2.gz OBSMWZXRCHKNBV-HTAVTVPLSA-N 2 0 210.365 2.247 20 0 BEADRP [NH3+]CCCCCCCO[C@H]1CCC[NH2+]C[C@@H]1F ZINC001217766059 959580595 /nfs/dbraw/zinc/58/05/95/959580595.db2.gz PVLZQSUECCYDKC-STQMWFEESA-N 2 0 246.370 2.002 20 0 BEADRP CC1=C[C@H](C)[C@H](C[NH+]2CC3(C2)CC[NH2+]C3)CC1 ZINC001222379690 972450011 /nfs/dbraw/zinc/45/00/11/972450011.db2.gz IKIFXQLGKVSDDW-KBPBESRZSA-N 2 0 234.387 2.274 20 0 BEADRP [NH3+]Cc1cccc(O[C@H]2CCC[C@]23CC[NH2+]C3)c1 ZINC001218098679 959863394 /nfs/dbraw/zinc/86/33/94/959863394.db2.gz YQUJFHBUPXJUTL-LSDHHAIUSA-N 2 0 246.354 2.056 20 0 BEADRP CC1(C)CC[C@@H]([NH+]2CCC(C)([NH3+])CC2)C1 ZINC000393768427 959901565 /nfs/dbraw/zinc/90/15/65/959901565.db2.gz IFJQTQZGHDBUCD-LLVKDONJSA-N 2 0 210.365 2.378 20 0 BEADRP CCCCC[C@H](C)[N@@H+]1C[C@H](C)[C@H](C[NH3+])C1 ZINC000708863824 959986220 /nfs/dbraw/zinc/98/62/20/959986220.db2.gz QEWOGKAMTZZMLV-RWMBFGLXSA-N 2 0 212.381 2.482 20 0 BEADRP C[C@@]1(F)CCCC[N@H+](CC2CC[NH2+]CC2)C1 ZINC001207436776 960089347 /nfs/dbraw/zinc/08/93/47/960089347.db2.gz PPDPOGGMZKZRPQ-CYBMUJFWSA-N 2 0 228.355 2.200 20 0 BEADRP C[C@]1(F)CCCC[N@H+](CC2CC[NH2+]CC2)C1 ZINC001207436777 960091518 /nfs/dbraw/zinc/09/15/18/960091518.db2.gz PPDPOGGMZKZRPQ-ZDUSSCGKSA-N 2 0 228.355 2.200 20 0 BEADRP CCOCC[C@H](C)[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC001172410557 974673579 /nfs/dbraw/zinc/67/35/79/974673579.db2.gz HUPCLGUULQNZKY-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)C1(Cl)CC1 ZINC000695655869 960327513 /nfs/dbraw/zinc/32/75/13/960327513.db2.gz OCLSTRVJNWHJLR-QJPTWQEYSA-N 2 0 242.794 2.363 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@H](C)C2(Cl)CC2)CC1 ZINC000695694660 960377596 /nfs/dbraw/zinc/37/75/96/960377596.db2.gz BKSLXRLOIXICQY-LLVKDONJSA-N 2 0 244.810 2.468 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCCOc2ccccc2)CC[NH2+]1 ZINC000709358886 960529381 /nfs/dbraw/zinc/52/93/81/960529381.db2.gz WJKHQLLHHHGBOD-KGLIPLIRSA-N 2 0 248.370 2.186 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CCCOc2ccccc2)CC[NH2+]1 ZINC000709358888 960529539 /nfs/dbraw/zinc/52/95/39/960529539.db2.gz WJKHQLLHHHGBOD-UONOGXRCSA-N 2 0 248.370 2.186 20 0 BEADRP C[C@@H]1C[C@@H]([N@@H+]2CCC[C@@H]2c2ccncc2)CC[NH2+]1 ZINC000709467547 960612923 /nfs/dbraw/zinc/61/29/23/960612923.db2.gz UMNAQUPEGQMUFW-VHDGCEQUSA-N 2 0 245.370 2.359 20 0 BEADRP C[C@@H](C[NH3+])C[N@H+](C)[C@@H]1CCCC(C)(C)C1 ZINC000709525821 960633512 /nfs/dbraw/zinc/63/35/12/960633512.db2.gz RTKRSYRGDVFZRW-NWDGAFQWSA-N 2 0 212.381 2.482 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@@H]2CC[NH2+][C@H](C)C2)C1 ZINC000300056241 961008058 /nfs/dbraw/zinc/00/80/58/961008058.db2.gz OHYYVIKXDUQDIL-LPWJVIDDSA-N 2 0 210.365 2.153 20 0 BEADRP CO[C@H](C[N@H+](C)C1CCC([NH3+])CC1)C1CCC1 ZINC000692219528 961361014 /nfs/dbraw/zinc/36/10/14/961361014.db2.gz ZQBZEMVZZUOJKM-JXQTWKCFSA-N 2 0 240.391 2.003 20 0 BEADRP C(CC[NH+]1CCCC1)C[NH2+][C@@H]1C[C@H]2C[C@H]2C1 ZINC001167893566 961508639 /nfs/dbraw/zinc/50/86/39/961508639.db2.gz IROGPLVWFUPMHF-BTTYYORXSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@@H](Cc1ccccc1Cl)[NH2+]C1CC([NH3+])C1 ZINC000087651392 961603277 /nfs/dbraw/zinc/60/32/77/961603277.db2.gz ZNAPBAAPKJSQFJ-GCVQQVDUSA-N 2 0 238.762 2.350 20 0 BEADRP C(C1CC[NH2+]CC1)[N@H+]1C[C@@H]2CCC[C@@H](C2)C1 ZINC000300760995 961658919 /nfs/dbraw/zinc/65/89/19/961658919.db2.gz NMSWCAKQJQMIGE-OKILXGFUSA-N 2 0 222.376 2.108 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+]C[C@@H]1CC[C@H]([NH3+])C1 ZINC000925883977 961724259 /nfs/dbraw/zinc/72/42/59/961724259.db2.gz ZSYQBZOFNIMXRX-XQQFMLRXSA-N 2 0 233.359 2.168 20 0 BEADRP C[C@H]1C[C@@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167959901 962842758 /nfs/dbraw/zinc/84/27/58/962842758.db2.gz UMYZOAQTMHNCJC-OKFLDJDMSA-N 2 0 234.387 2.390 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H](Nc2[nH+]ccc3[nH]ccc32)C1 ZINC001154976997 962927315 /nfs/dbraw/zinc/92/73/15/962927315.db2.gz MHYFJWSJLOYMKR-NXEZZACHSA-N 2 0 230.315 2.245 20 0 BEADRP Cc1ccc(NC[C@H]2C[NH2+][C@H](C)C2)[nH+]c1C ZINC001155101306 962974565 /nfs/dbraw/zinc/97/45/65/962974565.db2.gz UWJXQAFEDYXASW-ZYHUDNBSSA-N 2 0 219.332 2.108 20 0 BEADRP Cc1[nH+]c(N(CCC[NH3+])C(C)C)cc2[nH]ccc21 ZINC001156123846 963263002 /nfs/dbraw/zinc/26/30/02/963263002.db2.gz CAIPOHTUAGKXKM-UHFFFAOYSA-N 2 0 246.358 2.435 20 0 BEADRP CCC(C)(C)CC[N@@H+]1CC[C@@H](CC[NH3+])C1 ZINC000696804422 963514740 /nfs/dbraw/zinc/51/47/40/963514740.db2.gz YFHXNZKOEAAOIF-GFCCVEGCSA-N 2 0 212.381 2.483 20 0 BEADRP Cn1ccc2c1cc[nH+]c2NC1(C)CC[NH2+]CC1 ZINC001157396807 963595247 /nfs/dbraw/zinc/59/52/47/963595247.db2.gz GJGRALHEBNBHRD-UHFFFAOYSA-N 2 0 244.342 2.127 20 0 BEADRP CC[NH+](CC)CCCC[NH2+][C@@H]1CCO[C@@H](C)C1 ZINC001168072526 963606256 /nfs/dbraw/zinc/60/62/56/963606256.db2.gz SWNIQTKOQLWWNN-UONOGXRCSA-N 2 0 242.407 2.266 20 0 BEADRP C([C@H]1CCCC[NH2+]C1)[N@@H+]1CCC2(CCC2)C1 ZINC000697017447 963639144 /nfs/dbraw/zinc/63/91/44/963639144.db2.gz SBLSYDYOBBEOED-ZDUSSCGKSA-N 2 0 222.376 2.252 20 0 BEADRP C[C@@H]1C[C@H](C)[N@H+](C[C@@H]2CCCC[NH2+]C2)C1 ZINC000697043518 963667858 /nfs/dbraw/zinc/66/78/58/963667858.db2.gz WPHMLVHMZILBKJ-FRRDWIJNSA-N 2 0 210.365 2.106 20 0 BEADRP C[NH2+]CC[C@H](C)[NH2+]C[C@H]1CCCC[C@H]1C ZINC000714413447 963690617 /nfs/dbraw/zinc/69/06/17/963690617.db2.gz QRZAFQBJYAAXBO-FRRDWIJNSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@H]2CC[C@@H]([NH+](C)C)CC2)CCO1 ZINC001168100450 963706926 /nfs/dbraw/zinc/70/69/26/963706926.db2.gz CRQOQLCAKZPSIV-MQYQWHSLSA-N 2 0 240.391 2.016 20 0 BEADRP C[NH2+]CCN(c1cc2[nH]ccc2c[nH+]1)C(C)(C)C ZINC001157825453 963741607 /nfs/dbraw/zinc/74/16/07/963741607.db2.gz JNJQCCWEQPRLQU-UHFFFAOYSA-N 2 0 246.358 2.387 20 0 BEADRP CC(C)Oc1cc[nH+]c(NCC[C@H]2CCC[NH2+]2)c1 ZINC001158628039 963898321 /nfs/dbraw/zinc/89/83/21/963898321.db2.gz WHNANOYKJMSJJI-GFCCVEGCSA-N 2 0 249.358 2.423 20 0 BEADRP C[C@]1(C[NH3+])CCCN(c2cc3[nH]ccc3c[nH+]2)C1 ZINC001158675656 963900694 /nfs/dbraw/zinc/90/06/94/963900694.db2.gz OMWWGHRJFOEINF-CQSZACIVSA-N 2 0 244.342 2.128 20 0 BEADRP Cc1cncc(NC2(C)CC[NH2+]CC2)c1C ZINC001168186228 963942560 /nfs/dbraw/zinc/94/25/60/963942560.db2.gz VHTXKDGDMQEECS-UHFFFAOYSA-N 2 0 219.332 2.252 20 0 BEADRP c1cc2c(cc1NC1=CCC[NH2+]CC1)CC[NH2+]C2 ZINC001159601031 964130255 /nfs/dbraw/zinc/13/02/55/964130255.db2.gz RDFYJDPKVPTZEB-UHFFFAOYSA-N 2 0 243.354 2.012 20 0 BEADRP [NH3+]Cc1ccccc1NC=CC1CC[NH2+]CC1 ZINC001159736130 964165743 /nfs/dbraw/zinc/16/57/43/964165743.db2.gz ZMUFKFZFRCYLMC-JXMROGBWSA-N 2 0 231.343 2.071 20 0 BEADRP c1cc([C@@H]2CC[NH2+]C2)ccc1NC1=CCC[NH2+]C1 ZINC001159775836 964191631 /nfs/dbraw/zinc/19/16/31/964191631.db2.gz NFCFYEAPUGRMKO-CYBMUJFWSA-N 2 0 243.354 2.053 20 0 BEADRP [NH3+]CCc1ccccc1NC=CC1CC[NH2+]CC1 ZINC001159998089 964237937 /nfs/dbraw/zinc/23/79/37/964237937.db2.gz UKGWZOFUYVEBHO-XYOKQWHBSA-N 2 0 245.370 2.113 20 0 BEADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H](Nc1cccc(N)[nH+]1)C2 ZINC001160468809 964307348 /nfs/dbraw/zinc/30/73/48/964307348.db2.gz HEMLTFNKBNRYME-CNDDSTCGSA-N 2 0 246.358 2.091 20 0 BEADRP C[NH+](C)C1CCC([N@@H+]2CCC3(CC3)C2)CC1 ZINC001168314448 964421650 /nfs/dbraw/zinc/42/16/50/964421650.db2.gz LGFXCWLTJYYDGM-UHFFFAOYSA-N 2 0 222.376 2.345 20 0 BEADRP C[NH+](C)C1CCC([N@H+](C)Cc2ccncc2)CC1 ZINC001168315524 964425017 /nfs/dbraw/zinc/42/50/17/964425017.db2.gz XQIKNDAZOYARAY-UHFFFAOYSA-N 2 0 247.386 2.386 20 0 BEADRP C[NH+](C)C1CCC([N@H+](C)Cc2ccccn2)CC1 ZINC001168314945 964425957 /nfs/dbraw/zinc/42/59/57/964425957.db2.gz IPLKFDKIXQAEIE-UHFFFAOYSA-N 2 0 247.386 2.386 20 0 BEADRP C[NH+](C)C1CCC([N@@H+]2C[C@@H]3C[C@@H]3[C@H](F)C2)CC1 ZINC001168318772 964434230 /nfs/dbraw/zinc/43/42/30/964434230.db2.gz FMYDRNFXJYHTFC-FDZXDKCCSA-N 2 0 240.366 2.149 20 0 BEADRP CC(C)[NH+]1CC(Nc2ccccc2C(C)(C)[NH3+])C1 ZINC001168317688 964437269 /nfs/dbraw/zinc/43/72/69/964437269.db2.gz RXEHOPNNQOUCNX-UHFFFAOYSA-N 2 0 247.386 2.385 20 0 BEADRP CSCC[N@H+](C)C1CCC([NH+](C)C)CC1 ZINC001168328807 964460167 /nfs/dbraw/zinc/46/01/67/964460167.db2.gz KNHRUBRNVMKDJU-UHFFFAOYSA-N 2 0 230.421 2.154 20 0 BEADRP Cc1c[nH+]c(Nc2cccc(CC[NH3+])c2)cc1N ZINC001161077091 964515534 /nfs/dbraw/zinc/51/55/34/964515534.db2.gz MJIUUMOIQDBULO-UHFFFAOYSA-N 2 0 242.326 2.217 20 0 BEADRP CC(C)CCC[NH2+]CC[C@@H](C)[NH+](C)C ZINC000697825489 964548217 /nfs/dbraw/zinc/54/82/17/964548217.db2.gz PBJDXOMPLYHXOW-GFCCVEGCSA-N 2 0 200.370 2.352 20 0 BEADRP CC(C)C[C@@H](C)[NH2+]CC[C@H](C)[NH+](C)C ZINC000697869427 964594060 /nfs/dbraw/zinc/59/40/60/964594060.db2.gz GXOSROIGSOJFEE-NEPJUHHUSA-N 2 0 200.370 2.351 20 0 BEADRP CCC(CC)C[NH2+]CC[C@@H](C)[NH+](C)C ZINC000697869337 964596908 /nfs/dbraw/zinc/59/69/08/964596908.db2.gz FHQPQDLNYMCFNC-LLVKDONJSA-N 2 0 200.370 2.352 20 0 BEADRP C[C@H](CC[NH2+][C@@H]1CCCC1(C)C)[NH+](C)C ZINC000697877972 964601947 /nfs/dbraw/zinc/60/19/47/964601947.db2.gz GMVAESHAZPAGQG-VXGBXAGGSA-N 2 0 212.381 2.495 20 0 BEADRP Cc1ccc(C[NH2+]CC[C@@H](C)[NH+](C)C)cc1 ZINC000697886870 964632927 /nfs/dbraw/zinc/63/29/27/964632927.db2.gz IWUGWKZIDJDNJG-CYBMUJFWSA-N 2 0 220.360 2.425 20 0 BEADRP C[NH+](C)CCCCNc1cccc2c1C[NH2+]CC2 ZINC001161731048 964718921 /nfs/dbraw/zinc/71/89/21/964718921.db2.gz YOGLTCOUEHRRBU-UHFFFAOYSA-N 2 0 247.386 2.086 20 0 BEADRP C[C@H]([NH3+])c1ccc(NCCCC[NH+](C)C)cc1 ZINC001161730621 964719965 /nfs/dbraw/zinc/71/99/65/964719965.db2.gz MPDIBSWSQANYSF-LBPRGKRZSA-N 2 0 235.375 2.460 20 0 BEADRP CC[NH+](CC)C[C@H](C)OCCC[NH+]1CCCC1 ZINC001224745226 964916984 /nfs/dbraw/zinc/91/69/84/964916984.db2.gz YZFHTQHOBPKHCL-AWEZNQCLSA-N 2 0 242.407 2.219 20 0 BEADRP C(C1CC1)[NH+]1CCC([NH2+][C@@H]2C[C@@H]2C2CC2)CC1 ZINC001168370847 964925421 /nfs/dbraw/zinc/92/54/21/964925421.db2.gz GCAHIJUXBHSNST-HUUCEWRRSA-N 2 0 234.387 2.249 20 0 BEADRP CN(C)c1cc[nH+]c(N[C@@]2(C)CCC[N@H+](C)C2)c1 ZINC001162343034 964940223 /nfs/dbraw/zinc/94/02/23/964940223.db2.gz ZYPZTPDQENGQBZ-AWEZNQCLSA-N 2 0 248.374 2.044 20 0 BEADRP CCc1cc(NC[C@@H]2CCC[NH2+]C[C@H]2C)cc[nH+]1 ZINC001162471978 964989645 /nfs/dbraw/zinc/98/96/45/964989645.db2.gz RZABEZOVYUPLGY-OLZOCXBDSA-N 2 0 247.386 2.114 20 0 BEADRP C(C1CC1)[NH+]1CCC([N@@H+]2CCC3(CC3)C2)CC1 ZINC001168374141 964991471 /nfs/dbraw/zinc/99/14/71/964991471.db2.gz WQNQOGAKBOHDBF-UHFFFAOYSA-N 2 0 234.387 2.347 20 0 BEADRP Nc1cc[nH+]c(Nc2ccc(C[NH3+])c(F)c2)c1 ZINC001162522463 965018985 /nfs/dbraw/zinc/01/89/85/965018985.db2.gz FDVUJYSRSDRBFJ-UHFFFAOYSA-N 2 0 232.262 2.005 20 0 BEADRP Nc1cccc(Nc2ccc(C[NH3+])c(F)c2)[nH+]1 ZINC001162522871 965022065 /nfs/dbraw/zinc/02/20/65/965022065.db2.gz UDGBRTNHESQOIL-UHFFFAOYSA-N 2 0 232.262 2.005 20 0 BEADRP Cc1cc[nH+]c(NC[C@H]2C[NH2+][C@H](C)C2)c1C ZINC001162552289 965043521 /nfs/dbraw/zinc/04/35/21/965043521.db2.gz CUTQXGAQKXDUQS-ZYHUDNBSSA-N 2 0 219.332 2.108 20 0 BEADRP Cc1[nH]c2ccc(N[C@@H]3CC[NH2+][C@@H]3C)cc2[nH+]1 ZINC001162673044 965104832 /nfs/dbraw/zinc/10/48/32/965104832.db2.gz IIDMIHAXZHNIRW-LDYMZIIASA-N 2 0 230.315 2.034 20 0 BEADRP C(C1CC1)[NH+]1CCC([NH+]2C3CCC2CC3)CC1 ZINC001168388089 965116221 /nfs/dbraw/zinc/11/62/21/965116221.db2.gz AGMGNILVOBBZMA-UHFFFAOYSA-N 2 0 234.387 2.488 20 0 BEADRP CCC(CC)[NH2+]CCCCC[NH+](C)C ZINC001257286514 1169860419 /nfs/dbraw/zinc/86/04/19/1169860419.db2.gz CBKZYJFDLLOMGP-UHFFFAOYSA-N 2 0 200.370 2.497 20 0 BEADRP CC(C)[N@@H+]1CC[C@@H](Nc2cccc(N)[nH+]2)[C@@H](C)C1 ZINC001163365411 965369755 /nfs/dbraw/zinc/36/97/55/965369755.db2.gz ZVKAJMURYHKZIO-NWDGAFQWSA-N 2 0 248.374 2.195 20 0 BEADRP C[NH+](C)C[C@@]12C[C@@H]1C[N@@H+](C1CCCCC1)C2 ZINC001257461668 1169870065 /nfs/dbraw/zinc/87/00/65/1169870065.db2.gz XETVXDQJQYNORW-TZMCWYRMSA-N 2 0 222.376 2.203 20 0 BEADRP [NH3+][C@H]1CCC[N@H+](Cc2cccc3[nH]ccc32)CC1 ZINC001205093867 965718918 /nfs/dbraw/zinc/71/89/18/965718918.db2.gz GWKPWIMMGAYMQY-ZDUSSCGKSA-N 2 0 243.354 2.481 20 0 BEADRP Cc1cc2cc[nH]c2c(N(CCC[NH3+])C(C)C)[nH+]1 ZINC001164122837 965745517 /nfs/dbraw/zinc/74/55/17/965745517.db2.gz QJNVSWMENGIDJR-UHFFFAOYSA-N 2 0 246.358 2.435 20 0 BEADRP C[C@@H]1CC[N@H+](CC2C[C@H]3CC[C@@H](C2)[NH2+]3)C[C@@H]1C ZINC000699202798 965805744 /nfs/dbraw/zinc/80/57/44/965805744.db2.gz DTZZHSWJOMJVIT-WQGXVZNYSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@H](C[NH3+])C[N@H+](C)[C@@H](C)Cc1cccc(F)c1 ZINC001168465693 965812485 /nfs/dbraw/zinc/81/24/85/965812485.db2.gz VGVYVYHVFCXZTQ-NEPJUHHUSA-N 2 0 238.350 2.283 20 0 BEADRP C[C@H](C[NH3+])C[N@H+](C)[C@H](C)Cc1cccc(F)c1 ZINC001168465699 965812561 /nfs/dbraw/zinc/81/25/61/965812561.db2.gz VGVYVYHVFCXZTQ-VXGBXAGGSA-N 2 0 238.350 2.283 20 0 BEADRP C([NH2+][C@@H]1CCC[C@@H]2C[C@@H]21)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000699284097 965829521 /nfs/dbraw/zinc/82/95/21/965829521.db2.gz XMEPWQASRMEQCA-FKENJMTJSA-N 2 0 234.387 2.295 20 0 BEADRP CCCC[N@H+](C)CC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000699303321 965837349 /nfs/dbraw/zinc/83/73/49/965837349.db2.gz ACGNMATXVXTNAM-YHWZYXNKSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@H]1C[N@H+](CCCC2CCCC2)C[C@H]1C[NH3+] ZINC001205131416 965938414 /nfs/dbraw/zinc/93/84/14/965938414.db2.gz YCZLIZYIRSXOGA-GXTWGEPZSA-N 2 0 224.392 2.483 20 0 BEADRP COc1cccc(C[NH2+][C@@H](C)C2CC[NH2+]CC2)c1 ZINC000400393462 965950334 /nfs/dbraw/zinc/95/03/34/965950334.db2.gz JJBYAAUBBCBCFK-LBPRGKRZSA-N 2 0 248.370 2.173 20 0 BEADRP C[NH+](C)C[C@H]1CCCN1c1[nH+]ccc2[nH]ccc21 ZINC001165070901 965954934 /nfs/dbraw/zinc/95/49/34/965954934.db2.gz CHFYWSUSMDRJRR-LLVKDONJSA-N 2 0 244.342 2.093 20 0 BEADRP Cc1ccc(N2C[C@@H]3C[C@]3(C[NH+](C)C)C2)[nH+]c1C ZINC001165184128 965975836 /nfs/dbraw/zinc/97/58/36/965975836.db2.gz LTVIBGHFRDNGMI-ZFWWWQNUSA-N 2 0 245.370 2.086 20 0 BEADRP CC1=C[C@@H](C)[C@H](C[N@H+]2C[C@H]3C[NH2+]C[C@H]3C2)CC1 ZINC001234979685 965982085 /nfs/dbraw/zinc/98/20/85/965982085.db2.gz QVNJVQMNUUYYPP-BARDWOONSA-N 2 0 234.387 2.130 20 0 BEADRP C[NH+](C)C1CCC([NH2+][C@@H]2C[C@H]3C[C@H]3C2)CC1 ZINC000715229954 965985695 /nfs/dbraw/zinc/98/56/95/965985695.db2.gz UQMFDFXIMDBYII-UEFQQIBISA-N 2 0 222.376 2.247 20 0 BEADRP C[C@H](CN1CC[C@@H]2[NH2+]CC[C@H]21)c1ccccc1 ZINC001235039689 965987379 /nfs/dbraw/zinc/98/73/79/965987379.db2.gz XJVCFOKLRGDLFQ-VHDGCEQUSA-N 2 0 230.355 2.226 20 0 BEADRP CC[C@@H](C)C[N@@H+]1CCCC[C@@]12CC[NH2+]C2 ZINC001235123358 966008334 /nfs/dbraw/zinc/00/83/34/966008334.db2.gz JIRJCLONQSZDNO-OLZOCXBDSA-N 2 0 210.365 2.251 20 0 BEADRP COc1ccc2c(c1)nccc2-n1c[nH+]cc1N ZINC001203523010 966672388 /nfs/dbraw/zinc/67/23/88/966672388.db2.gz PPSNHVBSEYQPPF-UHFFFAOYSA-N 2 0 240.266 2.011 20 0 BEADRP CC1CC(C[N@H+](C)CCCCCC[NH3+])C1 ZINC000691960312 966714934 /nfs/dbraw/zinc/71/49/34/966714934.db2.gz BLMGPQDBJLBJJG-UHFFFAOYSA-N 2 0 212.381 2.483 20 0 BEADRP Cc1cnc(C)c(Nc2cc[nH+]c(CO)c2)c1 ZINC001203655875 966721020 /nfs/dbraw/zinc/72/10/20/966721020.db2.gz FKBZCTQNKLMFAE-UHFFFAOYSA-N 2 0 229.283 2.329 20 0 BEADRP Cn1c[nH+]cc1N1C[C@H](CC[NH3+])c2ccccc21 ZINC001168543615 966851885 /nfs/dbraw/zinc/85/18/85/966851885.db2.gz IYLCDZNHJDBQBV-NSHDSACASA-N 2 0 242.326 2.004 20 0 BEADRP CC[N@H+](CCn1ccnc1)Cc1ccc(O)cc1 ZINC001204098853 966895817 /nfs/dbraw/zinc/89/58/17/966895817.db2.gz LHYIIHRIQFMCJY-UHFFFAOYSA-N 2 0 245.326 2.111 20 0 BEADRP CC1CC[NH+](CC2CC[NH+](C)CC2)CC1 ZINC000203454319 967050602 /nfs/dbraw/zinc/05/06/02/967050602.db2.gz FSQMPBJHJUTTQH-UHFFFAOYSA-N 2 0 210.365 2.060 20 0 BEADRP CCCC[N@H+](CC)CC[C@H]1COC(C)(C)N1 ZINC001204611298 967104495 /nfs/dbraw/zinc/10/44/95/967104495.db2.gz KHTQFEMIKSXZPK-LBPRGKRZSA-N 2 0 228.380 2.223 20 0 BEADRP C[NH+](C)C1CCC([NH2+]C[C@@H]2CCCCO2)CC1 ZINC000715571335 967185407 /nfs/dbraw/zinc/18/54/07/967185407.db2.gz HNRCDQLAZSHHJC-RUXDESIVSA-N 2 0 240.391 2.018 20 0 BEADRP Cc1cccc(C[NH2+]C2CCC([NH+](C)C)CC2)n1 ZINC000715581394 967195019 /nfs/dbraw/zinc/19/50/19/967195019.db2.gz CPDPPZUBEGFOPX-UHFFFAOYSA-N 2 0 247.386 2.352 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@H]([NH+](C)C)C2)CCO1 ZINC000715583355 967196209 /nfs/dbraw/zinc/19/62/09/967196209.db2.gz JWTVQZNMMYOURA-RQJABVFESA-N 2 0 240.391 2.016 20 0 BEADRP CC/C=C\CCC[NH+]1CCC(C[NH3+])CC1 ZINC001205026618 967297363 /nfs/dbraw/zinc/29/73/63/967297363.db2.gz UOPDVLZVQVSZDY-ARJAWSKDSA-N 2 0 210.365 2.404 20 0 BEADRP C[C@H]1CC[C@@H](C[NH3+])N1Cc1ccc2[nH]ccc2c1 ZINC001205063920 967316221 /nfs/dbraw/zinc/31/62/21/967316221.db2.gz FIZLAYANEUDADV-FZMZJTMJSA-N 2 0 243.354 2.480 20 0 BEADRP CCOc1ccccc1C[N@@H+]1CCC[C@H]([NH3+])CC1 ZINC001205095578 967337565 /nfs/dbraw/zinc/33/75/65/967337565.db2.gz ZMHBBPNMLHBJCG-AWEZNQCLSA-N 2 0 248.370 2.399 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@@H]([NH3+])CC2)s1 ZINC001205093912 967339880 /nfs/dbraw/zinc/33/98/80/967339880.db2.gz HXPDJKGPSVYQRY-LLVKDONJSA-N 2 0 224.373 2.370 20 0 BEADRP [NH3+][C@@H]1CCC[N@H+](CCc2cccs2)CC1 ZINC001205093764 967341425 /nfs/dbraw/zinc/34/14/25/967341425.db2.gz FWCWPMWNJQZIIK-LLVKDONJSA-N 2 0 224.373 2.104 20 0 BEADRP CN(C)c1cccc(C[N@@H+]2CCC[C@H]([NH3+])CC2)c1 ZINC001205109479 967352038 /nfs/dbraw/zinc/35/20/38/967352038.db2.gz GYHMZXWCVOAAAY-AWEZNQCLSA-N 2 0 247.386 2.066 20 0 BEADRP Cc1ccc(F)cc1C[N@@H+]1CCC[C@H]([NH3+])CC1 ZINC001205109275 967352125 /nfs/dbraw/zinc/35/21/25/967352125.db2.gz DIFIVJKCTFVMOK-AWEZNQCLSA-N 2 0 236.334 2.447 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@@H]([NH3+])CC2)c(C)n1 ZINC001205117128 967363254 /nfs/dbraw/zinc/36/32/54/967363254.db2.gz LGNSFOVESSWRPE-CQSZACIVSA-N 2 0 233.359 2.012 20 0 BEADRP Cc1cccc(CC[N@H+]2C[C@H](C)[C@H](C[NH3+])C2)c1 ZINC001205131395 967374249 /nfs/dbraw/zinc/37/42/49/967374249.db2.gz XTMKCRYYMXINTQ-DZGCQCFKSA-N 2 0 232.371 2.064 20 0 BEADRP COc1cc(C)cc(C[N@@H+]2C[C@H](C)[C@H](C[NH3+])C2)c1 ZINC001205140918 967389610 /nfs/dbraw/zinc/38/96/10/967389610.db2.gz RRTSHHQOKHOFNM-GXTWGEPZSA-N 2 0 248.370 2.030 20 0 BEADRP Cc1cc(C[N@@H+]2CCC[C@](C)([NH3+])CC2)ccn1 ZINC001205263639 967454658 /nfs/dbraw/zinc/45/46/58/967454658.db2.gz BCQBDNLEDOUEIT-AWEZNQCLSA-N 2 0 233.359 2.093 20 0 BEADRP C[C@]1([NH3+])CCC[N@H+](Cc2ccsc2)CC1 ZINC001205263899 967456214 /nfs/dbraw/zinc/45/62/14/967456214.db2.gz FMADWPWOLJWWNT-LBPRGKRZSA-N 2 0 224.373 2.451 20 0 BEADRP Cc1ccnc(C[N@@H+]2CCC[C@](C)([NH3+])CC2)c1 ZINC001205265827 967456923 /nfs/dbraw/zinc/45/69/23/967456923.db2.gz RQQJPMRYZOEWLJ-AWEZNQCLSA-N 2 0 233.359 2.093 20 0 BEADRP Cc1ncccc1C[N@@H+]1CCC[C@@](C)([NH3+])CC1 ZINC001205266703 967457434 /nfs/dbraw/zinc/45/74/34/967457434.db2.gz WJEROUVAALZMDX-CQSZACIVSA-N 2 0 233.359 2.093 20 0 BEADRP Cc1ccncc1C[N@@H+]1CCC[C@@](C)([NH3+])CC1 ZINC001205273147 967467452 /nfs/dbraw/zinc/46/74/52/967467452.db2.gz GBLATKZTHHJFAH-CQSZACIVSA-N 2 0 233.359 2.093 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]CCC2SCCS2)C1 ZINC000693778504 967469188 /nfs/dbraw/zinc/46/91/88/967469188.db2.gz YYJDOKOXQCWLEL-NXEZZACHSA-N 2 0 246.445 2.042 20 0 BEADRP Cc1c(O)cccc1C[N@@H+]1CCC[C@](C)([NH3+])CC1 ZINC001205280897 967472443 /nfs/dbraw/zinc/47/24/43/967472443.db2.gz LGUZZPCNHRESSR-HNNXBMFYSA-N 2 0 248.370 2.404 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@@H]2C[C@H]3C=C[C@@H]2C3)C[C@@H]1C[NH3+] ZINC001205297122 967495685 /nfs/dbraw/zinc/49/56/85/967495685.db2.gz ZKBTVZOWGRVMSJ-SEBNEYGDSA-N 2 0 234.387 2.115 20 0 BEADRP Cc1cnc(C[N@@H+]2CCC[C@@](C)([NH3+])CC2)c(C)c1 ZINC001205296171 967497594 /nfs/dbraw/zinc/49/75/94/967497594.db2.gz IICICOQJSIQKLF-OAHLLOKOSA-N 2 0 247.386 2.402 20 0 BEADRP CC[NH+]1CCC(C[NH+]2CCC(F)(F)CC2)CC1 ZINC001205513052 967648722 /nfs/dbraw/zinc/64/87/22/967648722.db2.gz BKYZIWVXDNFZKC-UHFFFAOYSA-N 2 0 246.345 2.449 20 0 BEADRP CSCCC[N@@H+]1CC[C@H](C)[C@@H](C[NH3+])CC1 ZINC001205603584 967721554 /nfs/dbraw/zinc/72/15/54/967721554.db2.gz QOUFCKSHKPOONP-NWDGAFQWSA-N 2 0 230.421 2.046 20 0 BEADRP Cc1ncccc1C[N@@H+]1CC[C@@H](C[NH3+])[C@@H](C)CC1 ZINC001205618427 967725757 /nfs/dbraw/zinc/72/57/57/967725757.db2.gz VWFXTYUPXJKEDL-JSGCOSHPSA-N 2 0 247.386 2.197 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@@H](C[NH3+])[C@@H](C)CC2)[nH]1 ZINC001205618226 967727228 /nfs/dbraw/zinc/72/72/28/967727228.db2.gz SVGJCILYBLAVRH-AAEUAGOBSA-N 2 0 235.375 2.130 20 0 BEADRP Cc1cncc(C[N@H+]2CC[C@H](C)[C@@H](C[NH3+])CC2)c1 ZINC001205617582 967729371 /nfs/dbraw/zinc/72/93/71/967729371.db2.gz LCGYTXNEGSYDRW-DZGCQCFKSA-N 2 0 247.386 2.197 20 0 BEADRP C[C@@H]1[C@@H](C[NH3+])CCC[N@@H+]1C[C@@H]1C[C@H]2C=C[C@@H]1C2 ZINC001205901802 967876281 /nfs/dbraw/zinc/87/62/81/967876281.db2.gz GJODZEHNHGRGSI-KHMAMNHCSA-N 2 0 234.387 2.258 20 0 BEADRP C[C@@H]1[C@H](C[NH3+])CCC[N@@H+]1C[C@@H]1C[C@H]2C=C[C@@H]1C2 ZINC001205901957 967876625 /nfs/dbraw/zinc/87/66/25/967876625.db2.gz GJODZEHNHGRGSI-SEBNEYGDSA-N 2 0 234.387 2.258 20 0 BEADRP C[C@H]1C[N@H+](CC(C)(C)C)CCC[C@@H]1C[NH3+] ZINC001205981140 967922728 /nfs/dbraw/zinc/92/27/28/967922728.db2.gz BXWMJAUPGZPUKG-NWDGAFQWSA-N 2 0 212.381 2.339 20 0 BEADRP C[C@@H]1CC[N@H+](CCCC[NH3+])CCC1(F)F ZINC001205982183 967930723 /nfs/dbraw/zinc/93/07/23/967930723.db2.gz LIBFOKIILFYUHU-SNVBAGLBSA-N 2 0 220.307 2.093 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@@H](C[NH3+])[C@@H](C)C2)o1 ZINC001205983916 967934320 /nfs/dbraw/zinc/93/43/20/967934320.db2.gz QGKOCEMIQVKVJL-AAEUAGOBSA-N 2 0 236.359 2.395 20 0 BEADRP C[C@H]1C[N@H+](Cc2cccc(N)c2)CCC[C@H]1C[NH3+] ZINC001206013475 967968159 /nfs/dbraw/zinc/96/81/59/967968159.db2.gz ROHKQXXPBVZDSF-JSGCOSHPSA-N 2 0 247.386 2.076 20 0 BEADRP C[N@H+](C[C@H]1C[C@@H]([NH3+])C1)C1CCCCCC1 ZINC000693579846 968090485 /nfs/dbraw/zinc/09/04/85/968090485.db2.gz PRUDVEVESXDYNE-TXEJJXNPSA-N 2 0 210.365 2.378 20 0 BEADRP C[C@H](C[NH+](C)C)Nc1ccc([C@@H]2CCC[NH2+]2)cc1 ZINC001163776566 968115909 /nfs/dbraw/zinc/11/59/09/968115909.db2.gz DLNBXPXMOJSJDG-DOMZBBRYSA-N 2 0 247.386 2.473 20 0 BEADRP C[C@H](C[NH+](C)C)Nc1cc[nH+]c(C2CC2)c1 ZINC001163782443 968120656 /nfs/dbraw/zinc/12/06/56/968120656.db2.gz INFLKLPQZLIYAI-SNVBAGLBSA-N 2 0 219.332 2.321 20 0 BEADRP Cc1cc(C[N@@H+]2CC[C@H]([NH3+])[C@@H](F)CC2)cs1 ZINC001206214219 968148530 /nfs/dbraw/zinc/14/85/30/968148530.db2.gz XWTCNWDLLMULDH-RYUDHWBXSA-N 2 0 242.363 2.318 20 0 BEADRP Cc1cccc(CCN2CCC[NH2+]C[C@@H]2C)c1 ZINC001206257399 968176228 /nfs/dbraw/zinc/17/62/28/968176228.db2.gz CYBCFEWKXNOMLP-AWEZNQCLSA-N 2 0 232.371 2.221 20 0 BEADRP CC[C@@H](C)C[N@@H+]1CCC[C@@](C)(C[NH3+])CC1 ZINC001206294003 968203449 /nfs/dbraw/zinc/20/34/49/968203449.db2.gz ILAFNCJFWUWUAQ-CHWSQXEVSA-N 2 0 212.381 2.483 20 0 BEADRP CSCCC[N@@H+]1CCC[C@@](C)(C[NH3+])CC1 ZINC001206296342 968207475 /nfs/dbraw/zinc/20/74/75/968207475.db2.gz RJPMESNWHVVXHW-GFCCVEGCSA-N 2 0 230.421 2.190 20 0 BEADRP [NH3+][C@H]1CCN(c2cc[nH+]cc2-c2ccccc2)C1 ZINC001164281619 968212886 /nfs/dbraw/zinc/21/28/86/968212886.db2.gz INTQEILGRWUSKM-ZDUSSCGKSA-N 2 0 239.322 2.286 20 0 BEADRP C[C@@]1(C[NH3+])CCC[N@H+](Cc2cccc(N)c2)CC1 ZINC001206317235 968226351 /nfs/dbraw/zinc/22/63/51/968226351.db2.gz DGBVWSGSQSZAMU-OAHLLOKOSA-N 2 0 247.386 2.220 20 0 BEADRP C[C@]1(C[NH3+])CCC[N@H+](Cc2ccccc2N)CC1 ZINC001206326870 968234836 /nfs/dbraw/zinc/23/48/36/968234836.db2.gz PYZJPETYXHITLP-HNNXBMFYSA-N 2 0 247.386 2.220 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000387964944 968278165 /nfs/dbraw/zinc/27/81/65/968278165.db2.gz DVWYWKLUMBLBBS-YJBUHQLJSA-N 2 0 222.376 2.247 20 0 BEADRP CCCC(=O)Nc1c[nH+]ccc1-n1ccnc1C ZINC001251846295 968364220 /nfs/dbraw/zinc/36/42/20/968364220.db2.gz BBGANIDBJXMEOW-UHFFFAOYSA-N 2 0 244.298 2.314 20 0 BEADRP Cc1cccnc1C[N@@H+]1CCCC[C@@](C)(C[NH3+])C1 ZINC001206549803 968376939 /nfs/dbraw/zinc/37/69/39/968376939.db2.gz PYVKUEUINPXHFC-HNNXBMFYSA-N 2 0 247.386 2.341 20 0 BEADRP Cc1ccc(C[N@@H+]2CCCC[C@](C)(C[NH3+])C2)nc1 ZINC001206556812 968379789 /nfs/dbraw/zinc/37/97/89/968379789.db2.gz XNAGTOUHGODZLV-OAHLLOKOSA-N 2 0 247.386 2.341 20 0 BEADRP Cc1cc(C)c(C[N@@H+]2CCCC[C@H](C[NH3+])C2)[nH]1 ZINC001206616965 968420465 /nfs/dbraw/zinc/42/04/65/968420465.db2.gz VKOLIZUDBQOMJL-CYBMUJFWSA-N 2 0 235.375 2.192 20 0 BEADRP C[C@H]1CC[C@@H]([N@H+](C)C2CCC([NH3+])CC2)C1 ZINC000085869187 968509356 /nfs/dbraw/zinc/50/93/56/968509356.db2.gz GLRZLXGJJPLQRQ-YWPUVAFDSA-N 2 0 210.365 2.377 20 0 BEADRP [NH3+]C/C=C/CNc1nccc2ccccc21 ZINC000164522565 968522063 /nfs/dbraw/zinc/52/20/63/968522063.db2.gz DRDMRPWTLIWJPH-ONEGZZNKSA-N 2 0 213.284 2.162 20 0 BEADRP C[NH+](C)CC(C)(C)CNc1cccn2c[nH+]cc12 ZINC001168769082 968597948 /nfs/dbraw/zinc/59/79/48/968597948.db2.gz LWIYPMMJPLSOJR-UHFFFAOYSA-N 2 0 246.358 2.334 20 0 BEADRP Nc1cc[nH+]c2cc(C3=CCC[NH2+]C3)ccc12 ZINC001240669674 968633256 /nfs/dbraw/zinc/63/32/56/968633256.db2.gz QKBAGWAQRGQUNE-UHFFFAOYSA-N 2 0 225.295 2.194 20 0 BEADRP C[NH+]1CCC(C[NH+]2C[C@@H]3CCC[C@H]3C2)CC1 ZINC001207392358 968750487 /nfs/dbraw/zinc/75/04/87/968750487.db2.gz ZRSQUMVLKLJVFN-KBPBESRZSA-N 2 0 222.376 2.060 20 0 BEADRP C(c1cccn2c[nH+]cc12)=C1CC[NH2+]CC1 ZINC001240878672 968789265 /nfs/dbraw/zinc/78/92/65/968789265.db2.gz MULATWOSPGCWJE-UHFFFAOYSA-N 2 0 213.284 2.101 20 0 BEADRP C[N@H+](CC1CCCC1)C[C@@H]1CCCC[NH2+]C1 ZINC000829275125 968825732 /nfs/dbraw/zinc/82/57/32/968825732.db2.gz KLUYVMYNMVUWLQ-CQSZACIVSA-N 2 0 224.392 2.498 20 0 BEADRP C[N@H+]1CC=C(c2ccc(C3([NH3+])CC3)cc2)CC1 ZINC001241322777 968975674 /nfs/dbraw/zinc/97/56/74/968975674.db2.gz SMINZYNHKBLXOW-UHFFFAOYSA-N 2 0 228.339 2.353 20 0 BEADRP C[NH+]1CCC(C)(C[N@@H+]2CCC[C@@H](F)C2)CC1 ZINC001208105798 968999528 /nfs/dbraw/zinc/99/95/28/968999528.db2.gz CMCKHKSJVDRPII-GFCCVEGCSA-N 2 0 228.355 2.152 20 0 BEADRP C[NH+]1CCC(C)(C[N@@H+]2C[C@@H]3CCC[C@@H]3C2)CC1 ZINC001208102315 969002035 /nfs/dbraw/zinc/00/20/35/969002035.db2.gz DRPAIIVMDUHELG-OKILXGFUSA-N 2 0 236.403 2.450 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)CCC(C)C ZINC000349380903 969081565 /nfs/dbraw/zinc/08/15/65/969081565.db2.gz GAUCGFFKRNFZHS-UHFFFAOYSA-N 2 0 200.370 2.306 20 0 BEADRP C[C@H](C[NH+](C)C)Nc1cc(N2CCCC2)cc[nH+]1 ZINC001155915940 969122685 /nfs/dbraw/zinc/12/26/85/969122685.db2.gz KQAKQAYGMZXROU-GFCCVEGCSA-N 2 0 248.374 2.044 20 0 BEADRP Cc1ccnc(C)c1N[C@@H]1CCC[C@@H]([NH3+])C1 ZINC000304584278 969144530 /nfs/dbraw/zinc/14/45/30/969144530.db2.gz STADDPMCWKKBNQ-VXGBXAGGSA-N 2 0 219.332 2.380 20 0 BEADRP Cc1ccccc1OCC[N@@H+](C)C1CC[NH2+]CC1 ZINC000036300531 969153884 /nfs/dbraw/zinc/15/38/84/969153884.db2.gz QISUPFFXZNXNLN-UHFFFAOYSA-N 2 0 248.370 2.058 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH+]2CCC(C)(F)CC2)C1 ZINC001208605097 969156381 /nfs/dbraw/zinc/15/63/81/969156381.db2.gz YRSCQXHYKFHJAL-LBPRGKRZSA-N 2 0 228.355 2.152 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH+]2CC[C@@H]3CCC[C@H]3C2)C1 ZINC001208605175 969158117 /nfs/dbraw/zinc/15/81/17/969158117.db2.gz AJMCXDZMFNZIRN-KKUMJFAQSA-N 2 0 236.403 2.450 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH+]2CC[C@](C)(CF)C2)C1 ZINC001208607259 969164731 /nfs/dbraw/zinc/16/47/31/969164731.db2.gz KXMLWNWMGAYRBL-QWHCGFSZSA-N 2 0 228.355 2.010 20 0 BEADRP CC(C)N(CCC[NH3+])c1cc2[nH]ccc2c[nH+]1 ZINC001156118546 969193561 /nfs/dbraw/zinc/19/35/61/969193561.db2.gz PUOJCJXEYDGPEP-UHFFFAOYSA-N 2 0 232.331 2.127 20 0 BEADRP C[N@H+](C1CC1)C1CC[NH+](CCC2CC2)CC1 ZINC001208688055 969194805 /nfs/dbraw/zinc/19/48/05/969194805.db2.gz JLJGDODVFSSNQE-UHFFFAOYSA-N 2 0 222.376 2.345 20 0 BEADRP CCCCC[C@@H](O)C[NH2+]CCC[NH+]1CCCC1 ZINC001253517121 969196101 /nfs/dbraw/zinc/19/61/01/969196101.db2.gz DLGOXIFNOPQFCQ-CQSZACIVSA-N 2 0 242.407 2.003 20 0 BEADRP CCCCC[C@@H](O)C[N@H+](CC)CCC[NH+](C)C ZINC001253540542 969212147 /nfs/dbraw/zinc/21/21/47/969212147.db2.gz FIYKEFJNKVNPFP-CQSZACIVSA-N 2 0 244.423 2.201 20 0 BEADRP Cc1cnccc1C[N@@H+]1CCC[C@@H](C[NH3+])[C@@H](C)C1 ZINC001205995730 969264509 /nfs/dbraw/zinc/26/45/09/969264509.db2.gz PSICHOYFJPVYRV-KBPBESRZSA-N 2 0 247.386 2.197 20 0 BEADRP C[C@H]1C[N@H+](Cc2ccoc2)CCC[C@H]1C[NH3+] ZINC001205996331 969304331 /nfs/dbraw/zinc/30/43/31/969304331.db2.gz WGQIDGOMUCXZBF-AAEUAGOBSA-N 2 0 222.332 2.086 20 0 BEADRP c1ccc(C[N@H+]2CC[C@@H](C[NH+]3CCC3)C2)cc1 ZINC001208947515 969312629 /nfs/dbraw/zinc/31/26/29/969312629.db2.gz LMYGICLKKTUERM-HNNXBMFYSA-N 2 0 230.355 2.214 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+][C@@H]1CC[C@@H](F)C1)C2 ZINC001169080307 969404175 /nfs/dbraw/zinc/40/41/75/969404175.db2.gz MKXOZRKMGONXRD-NJMOYASZSA-N 2 0 226.339 2.092 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]CCC(F)(F)F)C2 ZINC001169079812 969404535 /nfs/dbraw/zinc/40/45/35/969404535.db2.gz LRSBOXJDDFOICL-ILWJIGKKSA-N 2 0 236.281 2.154 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)C1CCC1 ZINC001169118770 969412138 /nfs/dbraw/zinc/41/21/38/969412138.db2.gz NFYCYGBPVWDOJO-ZRJCITRHSA-N 2 0 222.376 2.390 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CCCCCC1)C2 ZINC001169124307 969418359 /nfs/dbraw/zinc/41/83/59/969418359.db2.gz BUSBXTGDXRTUOU-WDNDVIMCSA-N 2 0 222.376 2.488 20 0 BEADRP C(C[N@@H+]1CCC2(CC2)C1)C[NH+]1CCCCC1 ZINC001209449206 969516699 /nfs/dbraw/zinc/51/66/99/969516699.db2.gz DHCZJHLPUULWNK-UHFFFAOYSA-N 2 0 222.376 2.348 20 0 BEADRP C[C@@H](C[NH3+])C[N@H+](C)C1CCc2ccccc2CC1 ZINC001254454866 969642900 /nfs/dbraw/zinc/64/29/00/969642900.db2.gz JCHPOKAHKOPQIB-ZDUSSCGKSA-N 2 0 246.398 2.461 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH2+][C@@H]2CCc3ncccc32)CC1 ZINC001254506944 969672002 /nfs/dbraw/zinc/67/20/02/969672002.db2.gz DDUCEFOKQIXHGV-SWLSCSKDSA-N 2 0 245.370 2.143 20 0 BEADRP Cc1ccnc(CC[NH2+][C@@H]2CCC[N@@H+](C)CC2)c1 ZINC001254505893 969676086 /nfs/dbraw/zinc/67/60/86/969676086.db2.gz KZHHZWMYXQUVCU-CQSZACIVSA-N 2 0 247.386 2.006 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[N@H+](C)CC1)c1cccc(N)c1 ZINC001254509305 969684476 /nfs/dbraw/zinc/68/44/76/969684476.db2.gz YMTHBOPDNQPZEY-SWLSCSKDSA-N 2 0 247.386 2.404 20 0 BEADRP C[N@H+](CCc1cccnc1)[C@H]1CCC[NH+](C)CC1 ZINC001254525447 969719692 /nfs/dbraw/zinc/71/96/92/969719692.db2.gz ISMBUIRCJDXTGJ-HNNXBMFYSA-N 2 0 247.386 2.040 20 0 BEADRP Cc1cc2cc[nH]c2c(NCC[C@H]2CCC[NH2+]2)[nH+]1 ZINC001169559046 969754087 /nfs/dbraw/zinc/75/40/87/969754087.db2.gz YPMXDHVTCJCBJX-GFCCVEGCSA-N 2 0 244.342 2.425 20 0 BEADRP [NH3+]Cc1ccc2c(n1)N(c1cc[nH+]cc1)CCC2 ZINC001169584849 969785169 /nfs/dbraw/zinc/78/51/69/969785169.db2.gz UINOHSCRHAJVKY-UHFFFAOYSA-N 2 0 240.310 2.020 20 0 BEADRP CN1CCC[C@](C)([NH2+]C2Cc3ccccc3C2)C1 ZINC001255018169 969846598 /nfs/dbraw/zinc/84/65/98/969846598.db2.gz HDFLPHJZFBSHJS-INIZCTEOSA-N 2 0 244.382 2.228 20 0 BEADRP C([NH2+]C1CC[NH+](CC2CC2)CC1)C1CCC1 ZINC000166954833 969868118 /nfs/dbraw/zinc/86/81/18/969868118.db2.gz QAAFOBRCTJCHCU-UHFFFAOYSA-N 2 0 222.376 2.251 20 0 BEADRP CCCC[C@@H](C)[NH+]1CCC([NH3+])(CCOC)CC1 ZINC001255321593 970095225 /nfs/dbraw/zinc/09/52/25/970095225.db2.gz UMAAPCGHKRSJFT-CYBMUJFWSA-N 2 0 242.407 2.395 20 0 BEADRP C[C@H]([NH3+])c1nc2ccccc2n1-c1cc[nH+]cc1 ZINC000091692125 970259673 /nfs/dbraw/zinc/25/96/73/970259673.db2.gz LAVQQACTFVCDCG-JTQLQIEISA-N 2 0 238.294 2.440 20 0 BEADRP C[C@H]1CC[C@H]([NH2+]C(C)(C)CC[NH+](C)C)C1 ZINC001170100914 970292166 /nfs/dbraw/zinc/29/21/66/970292166.db2.gz MUOQWQFZWFXMHG-RYUDHWBXSA-N 2 0 212.381 2.495 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+]C(C)(C)CC[NH+](C)C)C1 ZINC001170100913 970293504 /nfs/dbraw/zinc/29/35/04/970293504.db2.gz MUOQWQFZWFXMHG-NWDGAFQWSA-N 2 0 212.381 2.495 20 0 BEADRP C1=C(c2cccc(C[NH+]3CCCC3)c2)C[NH2+]C1 ZINC001243108749 970333967 /nfs/dbraw/zinc/33/39/67/970333967.db2.gz FYVDLGAOPFIAGT-UHFFFAOYSA-N 2 0 228.339 2.269 20 0 BEADRP COC[C@H](C)[NH2+]C1CC[NH+](CC(C)(C)C)CC1 ZINC001255563661 970350844 /nfs/dbraw/zinc/35/08/44/970350844.db2.gz WURNQLMUCPSGAG-LBPRGKRZSA-N 2 0 242.407 2.121 20 0 BEADRP COC[C@@H](C)[NH2+]C[C@H](C)CC(C)(C)CC[NH3+] ZINC001255564056 970352592 /nfs/dbraw/zinc/35/25/92/970352592.db2.gz UFQWTLOEXKIQLK-VXGBXAGGSA-N 2 0 230.396 2.012 20 0 BEADRP CCCC[NH+]1CCC([N@H+](C)[C@H](C)COC)CC1 ZINC001255577375 970375549 /nfs/dbraw/zinc/37/55/49/970375549.db2.gz FXVLNILSEYPAQW-CYBMUJFWSA-N 2 0 242.407 2.218 20 0 BEADRP C[C@H](CC(F)(F)F)[NH2+][C@]1(C)CCCN(C)C1 ZINC001255644125 970417874 /nfs/dbraw/zinc/41/78/74/970417874.db2.gz LCEBVCGIHUNSTL-NXEZZACHSA-N 2 0 238.297 2.401 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)[C@@H]1CC[C@@H](C)C1 ZINC001170156373 970484025 /nfs/dbraw/zinc/48/40/25/970484025.db2.gz DUDNIHKFWMOWPX-CHWSQXEVSA-N 2 0 212.381 2.449 20 0 BEADRP CC[C@@H]1C[C@@H]([NH2+]C(C)(C)C(C)(C)[NH3+])CCO1 ZINC001170183392 970558724 /nfs/dbraw/zinc/55/87/24/970558724.db2.gz RIXNQZBNKMOOBA-WDEREUQCSA-N 2 0 228.380 2.050 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]CCCC[NH+](C)C ZINC001255939153 970566304 /nfs/dbraw/zinc/56/63/04/970566304.db2.gz CMYJQOAACKGPLS-CQSZACIVSA-N 2 0 243.439 2.038 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]C1CC=CC1 ZINC001255940375 970573087 /nfs/dbraw/zinc/57/30/87/970573087.db2.gz AWICQJLPAFJXKC-GFCCVEGCSA-N 2 0 210.365 2.415 20 0 BEADRP CC(C)C[C@H](C)[NH2+][C@@H](C)C1CC[NH2+]CC1 ZINC000400336380 970577331 /nfs/dbraw/zinc/57/73/31/970577331.db2.gz GAKRLZLJPDQQQJ-RYUDHWBXSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@@H]([NH2+]Cc1ccc(F)cc1)C1CC[NH2+]CC1 ZINC000400341315 970579672 /nfs/dbraw/zinc/57/96/72/970579672.db2.gz IUHHZVHKEUSORG-LLVKDONJSA-N 2 0 236.334 2.303 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)n1cccc1CC[NH3+] ZINC001255949536 970580469 /nfs/dbraw/zinc/58/04/69/970580469.db2.gz XXZLUPYRVOVEMK-CYBMUJFWSA-N 2 0 237.391 2.282 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+][C@@H](CO)C(C)(C)C ZINC001255947672 970581398 /nfs/dbraw/zinc/58/13/98/970581398.db2.gz UVDMRBHYYKVLAL-STQMWFEESA-N 2 0 244.423 2.103 20 0 BEADRP CC[C@H]([NH2+][C@H](C)C1CC[NH2+]CC1)C1CC1 ZINC000400357173 970582179 /nfs/dbraw/zinc/58/21/79/970582179.db2.gz BSZRKEOMWADBLR-MFKMUULPSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@H]1C[C@@H]([N@H+](CC)CCC[NH+](C)C)CCO1 ZINC001170238945 970619288 /nfs/dbraw/zinc/61/92/88/970619288.db2.gz LJMXGNAMYNBNQR-KBPBESRZSA-N 2 0 242.407 2.218 20 0 BEADRP CC[N@H+](C1CC1)C1CCN(C2CC2)CC1 ZINC001256072290 970635795 /nfs/dbraw/zinc/63/57/95/970635795.db2.gz AMKQYDOWCRDRSD-UHFFFAOYSA-N 2 0 208.349 2.098 20 0 BEADRP CSC(C)(C)C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000401024987 970653673 /nfs/dbraw/zinc/65/36/73/970653673.db2.gz NCYMTHCEAIPDFL-QJPTWQEYSA-N 2 0 242.432 2.106 20 0 BEADRP CSC(C)(C)C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000401024980 970653986 /nfs/dbraw/zinc/65/39/86/970653986.db2.gz NCYMTHCEAIPDFL-GRYCIOLGSA-N 2 0 242.432 2.106 20 0 BEADRP C[C@H](Cc1ccco1)[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000400996871 970655588 /nfs/dbraw/zinc/65/55/88/970655588.db2.gz CFXNCAZMYSJWHT-AAVRWANBSA-N 2 0 248.370 2.188 20 0 BEADRP C[NH+]1CCC([NH+]2CC3CCC(CC3)C2)CC1 ZINC001256209893 970719418 /nfs/dbraw/zinc/71/94/18/970719418.db2.gz BZRAUSJLXSOCCJ-UHFFFAOYSA-N 2 0 222.376 2.203 20 0 BEADRP CC(C)CC[C@@H](C)NC(=[NH2+])SCC[NH3+] ZINC001256354302 970750065 /nfs/dbraw/zinc/75/00/65/970750065.db2.gz GVKXYQWWEWWWDT-SECBINFHSA-N 2 0 217.382 2.027 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]Cc1cnc2ccccc2c1 ZINC001327416966 972570419 /nfs/dbraw/zinc/57/04/19/972570419.db2.gz WHGIKFHZFOHMNK-GFCCVEGCSA-N 2 0 243.354 2.322 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]Cc1ccc(C)c(F)c1 ZINC001327416462 972572948 /nfs/dbraw/zinc/57/29/48/972572948.db2.gz SNWBNNJIZCGYFK-NSHDSACASA-N 2 0 224.323 2.222 20 0 BEADRP C[C@@H]1CC[C@@H]([N@@H+]2CCC[C@@](F)(C[NH3+])CC2)C1 ZINC001246548263 972681423 /nfs/dbraw/zinc/68/14/23/972681423.db2.gz JVTMBMAWZAFVAJ-UPJWGTAASA-N 2 0 228.355 2.328 20 0 BEADRP C[C@@H](CC1CC1)[N@@H+]1CCC(F)(F)[C@H](C[NH3+])C1 ZINC001246560395 972792482 /nfs/dbraw/zinc/79/24/82/972792482.db2.gz ULPMPFLRVLILIC-GXSJLCMTSA-N 2 0 232.318 2.091 20 0 BEADRP CC(C)([NH3+])CNc1ccc(C2([NH3+])CCC2)cc1 ZINC001171193188 972843531 /nfs/dbraw/zinc/84/35/31/972843531.db2.gz QTSSAQIAEHYBPT-UHFFFAOYSA-N 2 0 233.359 2.174 20 0 BEADRP C[C@]1(C[NH3+])CCC[N@@H+]([C@@H]2C[C@H]3C[C@H]3C2)CC1 ZINC001246577789 972893961 /nfs/dbraw/zinc/89/39/61/972893961.db2.gz PPYPWULJAVSTJH-CRWXNKLISA-N 2 0 222.376 2.236 20 0 BEADRP C[C@@H]1CC([N@@H+]2C[C@H]3CCC[NH2+][C@H]3C2)C[C@@H](C)C1 ZINC001246658233 973065728 /nfs/dbraw/zinc/06/57/28/973065728.db2.gz PTIXQQFTQWEXDV-XPCVCDNBSA-N 2 0 236.403 2.495 20 0 BEADRP CC(C)CC[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000232554772 973091121 /nfs/dbraw/zinc/09/11/21/973091121.db2.gz WQHAGFLUYCTFPT-UHFFFAOYSA-N 2 0 212.381 2.354 20 0 BEADRP C[C@@H]1C[C@@H]([N@@H+]2CC[C@H](c3ccccn3)C2)CC[NH2+]1 ZINC001246791652 973098280 /nfs/dbraw/zinc/09/82/80/973098280.db2.gz HPVMTQRQRWKPPA-RDBSUJKOSA-N 2 0 245.370 2.011 20 0 BEADRP [NH3+]CC1CCC([NH2+]CCNc2ccccc2)CC1 ZINC001329025545 973439342 /nfs/dbraw/zinc/43/93/42/973439342.db2.gz YMLGAEIAYHSSJZ-UHFFFAOYSA-N 2 0 247.386 2.206 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CC2(C)CC(F)(F)C2)CC[NH2+]1 ZINC000720921529 973635529 /nfs/dbraw/zinc/63/55/29/973635529.db2.gz CTDCGGVNXWTWDL-VHSXEESVSA-N 2 0 232.318 2.152 20 0 BEADRP C[C@H]1C[C@@H](C[N@H+](C)CCC(F)(F)F)CC[NH2+]1 ZINC000235657776 973878659 /nfs/dbraw/zinc/87/86/59/973878659.db2.gz NJHQWIPDOWSIFV-UWVGGRQHSA-N 2 0 238.297 2.259 20 0 BEADRP c1ccc(C[N@@H+]2CCCC3(CC[NH2+]CC3)C2)nc1 ZINC000257708536 974111740 /nfs/dbraw/zinc/11/17/40/974111740.db2.gz NELHRCCSNBWINZ-UHFFFAOYSA-N 2 0 245.370 2.047 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+][C@@H]2Cc3cccc(F)c3C2)C1 ZINC001171773396 974157915 /nfs/dbraw/zinc/15/79/15/974157915.db2.gz KMKDATUIJBEPIS-YNEHKIRRSA-N 2 0 248.345 2.152 20 0 BEADRP CC1([NH3+])CC[NH+]([C@H]2Cc3cccc(F)c3C2)CC1 ZINC001171782915 974174054 /nfs/dbraw/zinc/17/40/54/974174054.db2.gz HHTKZBAGKBNONF-LBPRGKRZSA-N 2 0 248.345 2.106 20 0 BEADRP [NH3+][C@H]1CC[N@H+](CCCC(F)(F)F)CC[C@H]1F ZINC001206153487 974256055 /nfs/dbraw/zinc/25/60/55/974256055.db2.gz CXAMZBPKYKONHI-BDAKNGLRSA-N 2 0 242.260 2.090 20 0 BEADRP [NH3+][C@@H]1CC[N@H+](CCCC(F)(F)F)CC[C@@H]1F ZINC001206153639 974260722 /nfs/dbraw/zinc/26/07/22/974260722.db2.gz CXAMZBPKYKONHI-DTWKUNHWSA-N 2 0 242.260 2.090 20 0 BEADRP C[C@H]([NH3+])c1nccn1[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172098431 974340765 /nfs/dbraw/zinc/34/07/65/974340765.db2.gz DWPHZWXIDWHONC-WUHRBBMRSA-N 2 0 248.374 2.091 20 0 BEADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]CC1(C)CC1)C2 ZINC001172100979 974346064 /nfs/dbraw/zinc/34/60/64/974346064.db2.gz VOVYWTNGXPIIOB-CLLJXQQHSA-N 2 0 222.376 2.391 20 0 BEADRP CCOCCC[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172099519 974347744 /nfs/dbraw/zinc/34/77/44/974347744.db2.gz JAMNPKOTZZTJDW-BTTYYORXSA-N 2 0 240.391 2.018 20 0 BEADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]CC1(F)CCC1)C2 ZINC001172107767 974364071 /nfs/dbraw/zinc/36/40/71/974364071.db2.gz BXFKATZVSGUJSB-CLLJXQQHSA-N 2 0 240.366 2.484 20 0 BEADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]C[Si](C)(C)C)C2 ZINC001172110739 974371525 /nfs/dbraw/zinc/37/15/25/974371525.db2.gz ODMHITKRYISTLG-XYYAHUGASA-N 2 0 240.467 2.469 20 0 BEADRP CN1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCCC1)C2 ZINC001172115154 974383875 /nfs/dbraw/zinc/38/38/75/974383875.db2.gz VIBFBUBPTJIKHY-ITGUQSILSA-N 2 0 208.349 2.098 20 0 BEADRP CCCCN(C)CC[NH2+]C1C[C@H]2CC[C@@H](C1)O2 ZINC001172218398 974446515 /nfs/dbraw/zinc/44/65/15/974446515.db2.gz TVRVGWQJZOKYML-AGUYFDCRSA-N 2 0 240.391 2.018 20 0 BEADRP C[NH+](C)CCC(C)(C)[NH2+]C1C[C@H]2CC[C@@H](C1)O2 ZINC001172220224 974453333 /nfs/dbraw/zinc/45/33/33/974453333.db2.gz GQWPWIXNWPPOCT-YHWZYXNKSA-N 2 0 240.391 2.016 20 0 BEADRP CC[C@H](C)OCC[C@H](C)[N@H+](C)CCC[NH+](C)C ZINC001172334376 974601005 /nfs/dbraw/zinc/60/10/05/974601005.db2.gz BPBPMQHVHDIOQW-KBPBESRZSA-N 2 0 244.423 2.464 20 0 BEADRP CCOCC[C@H](C)[NH+]1CCC(C[NH+](C)C)CC1 ZINC001172422848 974697692 /nfs/dbraw/zinc/69/76/92/974697692.db2.gz ABTODSOQUUJNPB-ZDUSSCGKSA-N 2 0 242.407 2.075 20 0 BEADRP CC(C)OCC[C@H](C)[NH2+]CCCC[NH+](C)C ZINC001172429983 974709500 /nfs/dbraw/zinc/70/95/00/974709500.db2.gz BRKOLZJZRNFUPT-ZDUSSCGKSA-N 2 0 230.396 2.121 20 0 BEADRP CCOCC[C@H](C)[NH+]1CCC([N@H+](C)CC)CC1 ZINC001172432647 974719397 /nfs/dbraw/zinc/71/93/97/974719397.db2.gz XNRMQDLCCATLNY-ZDUSSCGKSA-N 2 0 242.407 2.218 20 0 BEADRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]Cc1ccc2c(c1)CCC2 ZINC001331822582 974828580 /nfs/dbraw/zinc/82/85/80/974828580.db2.gz SGRHECQTYYNBQQ-CVEARBPZSA-N 2 0 244.382 2.392 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@@H]([NH2+]Cc3ccccc3)[C@H]2C1 ZINC001204089097 974864749 /nfs/dbraw/zinc/86/47/49/974864749.db2.gz KSBIZZKVSZCIAG-SOUVJXGZSA-N 2 0 230.355 2.116 20 0 BEADRP NCC1([NH2+][C@@H]2CC[C@@H](c3ccccc3)C2)CC1 ZINC001172557022 974870875 /nfs/dbraw/zinc/87/08/75/974870875.db2.gz NZYXVUSHAXNHRU-ZIAGYGMSSA-N 2 0 230.355 2.404 20 0 BEADRP CCCOC1CCC([NH2+]CCCC[NH3+])CC1 ZINC001173092387 975017141 /nfs/dbraw/zinc/01/71/41/975017141.db2.gz PMBWPSUWNMPDPR-UHFFFAOYSA-N 2 0 228.380 2.053 20 0 BEADRP C[N@@H+]1CC[C@@H]2CN(c3cc[nH+]cc3C3CC3)C[C@@H]21 ZINC001332320683 975055168 /nfs/dbraw/zinc/05/51/68/975055168.db2.gz XLHHKYLKWAQWJX-DOMZBBRYSA-N 2 0 243.354 2.099 20 0 BEADRP CC[C@H]1CC[C@@H]([N@H+](C)CCC[NH+](C)C)C1 ZINC001173275531 975086864 /nfs/dbraw/zinc/08/68/64/975086864.db2.gz VUDICFJFSNUHIK-QWHCGFSZSA-N 2 0 212.381 2.449 20 0 BEADRP CCCC[C@@H](CC(C)C)[NH2+]CCN(C)CC[NH3+] ZINC001173252298 975093178 /nfs/dbraw/zinc/09/31/78/975093178.db2.gz IIPAUWXMWKKQBZ-AWEZNQCLSA-N 2 0 243.439 2.071 20 0 BEADRP CCSC[C@H](C)[NH2+][C@H]1CCN(CC(C)C)C1 ZINC001173296312 975184598 /nfs/dbraw/zinc/18/45/98/975184598.db2.gz RMDGTQSJSIRBMG-STQMWFEESA-N 2 0 244.448 2.448 20 0 BEADRP C[NH+](C)Cc1cccc(Nc2cc[nH+]cc2)c1 ZINC001173882456 975932826 /nfs/dbraw/zinc/93/28/26/975932826.db2.gz LOAHVCFDSACTNV-UHFFFAOYSA-N 2 0 227.311 2.309 20 0 BEADRP Cn1c[nH+]cc1Nc1ccccc1C[NH+](C)C ZINC001173929440 976037743 /nfs/dbraw/zinc/03/77/43/976037743.db2.gz BCPIUUYTOXXIOK-UHFFFAOYSA-N 2 0 230.315 2.225 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[N@@H+]2CC[C@@H](Cc3ccccc3)C2)C1 ZINC001334775082 976642724 /nfs/dbraw/zinc/64/27/24/976642724.db2.gz QYOGEWTUSZJYEE-HRCADAONSA-N 2 0 244.382 2.288 20 0 BEADRP c1cc(N2CC[C@H](C[NH+]3CCCC3)C2)cc[nH+]1 ZINC001336396311 977659598 /nfs/dbraw/zinc/65/95/98/977659598.db2.gz KCDGRRBMEIOSRE-CYBMUJFWSA-N 2 0 231.343 2.004 20 0 BEADRP CCc1ccc(NCC2=CC[N@H+](C)CC2)nc1 ZINC001336579282 977790969 /nfs/dbraw/zinc/79/09/69/977790969.db2.gz USXJJRHRPGNJCX-UHFFFAOYSA-N 2 0 231.343 2.318 20 0 BEADRP C[NH2+][C@@]12CC[C@@]([NH2+]CC(C)(C)OC)(C1)CCC2 ZINC001277584822 977793306 /nfs/dbraw/zinc/79/33/06/977793306.db2.gz RIGATCUPUHCSLL-UONOGXRCSA-N 2 0 240.391 2.066 20 0 BEADRP C[C@H]1CC[N@@H+]1Cc1cc2c[nH+]ccc2[nH]1 ZINC001232012225 977838006 /nfs/dbraw/zinc/83/80/06/977838006.db2.gz WKMADQLFMQCYER-VIFPVBQESA-N 2 0 201.273 2.157 20 0 BEADRP C[C@@H]1COCC[N@H+](Cc2cc3c[nH+]ccc3[nH]2)C1 ZINC001232011412 977839695 /nfs/dbraw/zinc/83/96/95/977839695.db2.gz JXYKWSLOCMNGQH-NSHDSACASA-N 2 0 245.326 2.031 20 0 BEADRP C[N@@H+](Cc1cc2c[nH+]ccc2[nH]1)CC1CC1 ZINC001232012370 977839709 /nfs/dbraw/zinc/83/97/09/977839709.db2.gz ZTXRPTWXCWWQPJ-UHFFFAOYSA-N 2 0 215.300 2.405 20 0 BEADRP Cc1cccc(C[N@@H+]2CCC[C@](C)(C[NH3+])CC2)n1 ZINC001206293979 978292513 /nfs/dbraw/zinc/29/25/13/978292513.db2.gz IGMXDJUFHFOGNY-HNNXBMFYSA-N 2 0 247.386 2.341 20 0 BEADRP C[C@]1(C[NH3+])CCC[N@H+](C[C@H]2CCC=CO2)CC1 ZINC001206293270 978293170 /nfs/dbraw/zinc/29/31/70/978293170.db2.gz GYCVALYSUFTMPZ-KGLIPLIRSA-N 2 0 238.375 2.130 20 0 BEADRP CCCC[NH+]1CCC(Nc2cc[nH+]cc2)CC1 ZINC001337650552 978441032 /nfs/dbraw/zinc/44/10/32/978441032.db2.gz GGYWRKGPAGKWLX-UHFFFAOYSA-N 2 0 233.359 2.180 20 0 BEADRP Cc1cccc(C[NH2+][C@@H]2CC[C@H]3C[N@@H+](C)C[C@H]32)c1 ZINC001179818644 978760534 /nfs/dbraw/zinc/76/05/34/978760534.db2.gz ZFHBCDFYJIVSTM-ARFHVFGLSA-N 2 0 244.382 2.425 20 0 BEADRP c1cc(NC[C@@H]2CCC[N@H+](CC3CC3)C2)cc[nH+]1 ZINC001339463824 978855745 /nfs/dbraw/zinc/85/57/45/978855745.db2.gz FLWVQARIYUYPAX-AWEZNQCLSA-N 2 0 245.370 2.037 20 0 BEADRP CC1=C[C@H](C)[C@H](C[N@@H+]2CC[C@H]3[NH2+]C[C@H]3C2)CC1 ZINC001235025476 978954671 /nfs/dbraw/zinc/95/46/71/978954671.db2.gz BZMLWXFEZDYROA-ZQDZILKHSA-N 2 0 234.387 2.273 20 0 BEADRP CC1=C[C@@H](C)[C@H](C[N@@H+]2CCC3(C[NH2+]C3)C2)CC1 ZINC001235023999 978955098 /nfs/dbraw/zinc/95/50/98/978955098.db2.gz JGHYLWARNPBBDX-KGLIPLIRSA-N 2 0 234.387 2.274 20 0 BEADRP CC1=C[C@H](C)[C@@H](C[N@@H+]2CC[C@@]3(CC[NH2+]3)C2)CC1 ZINC001235062689 978967992 /nfs/dbraw/zinc/96/79/92/978967992.db2.gz BTCKIVOANMOZEJ-ZNMIVQPWSA-N 2 0 234.387 2.417 20 0 BEADRP CCCC[C@@H](CC)C[N@H+]1C[C@@H]2[C@@H]([NH3+])[C@@H]2C1 ZINC001235210540 978999052 /nfs/dbraw/zinc/99/90/52/978999052.db2.gz LUBSBRGFOTUZPH-NDBYEHHHSA-N 2 0 210.365 2.092 20 0 BEADRP CCC[NH+]1CCC([C@H]2CCCC[NH2+]2)CC1 ZINC001235232999 978999799 /nfs/dbraw/zinc/99/97/99/978999799.db2.gz LFVJGAGLWBDJFD-CYBMUJFWSA-N 2 0 210.365 2.251 20 0 BEADRP c1nocc1C[NH+]1CCC([C@H]2CCCC[NH2+]2)CC1 ZINC001235230069 979000676 /nfs/dbraw/zinc/00/06/76/979000676.db2.gz NHIAKHHOHJEBCJ-CQSZACIVSA-N 2 0 249.358 2.029 20 0 BEADRP CCc1cccc(C)c1CN1CC[C@H]2[NH2+]CC[C@@H]21 ZINC001235236213 979003669 /nfs/dbraw/zinc/00/36/69/979003669.db2.gz VHLDPXACHANZCF-CVEARBPZSA-N 2 0 244.382 2.494 20 0 BEADRP CC1=C[C@H](C)[C@H](C[N@@H+]2C[C@H]3C[NH2+]CC[C@@H]32)CC1 ZINC001235256774 979012112 /nfs/dbraw/zinc/01/21/12/979012112.db2.gz GQMUBVNKTKODFG-XQLPTFJDSA-N 2 0 234.387 2.273 20 0 BEADRP CCCCc1ccc(C[N@H+]2C[C@@H]3[C@H]([NH3+])[C@@H]3C2)cc1 ZINC001235285948 979019661 /nfs/dbraw/zinc/01/96/61/979019661.db2.gz WSNZVCRKRVCWLQ-MUJYYYPQSA-N 2 0 244.382 2.418 20 0 BEADRP CC(C)[N@H+](CC[C@H]1COC(C)(C)N1)CC1CC1 ZINC001235695706 979123897 /nfs/dbraw/zinc/12/38/97/979123897.db2.gz ZXKGGBAHMPJJNK-ZDUSSCGKSA-N 2 0 240.391 2.221 20 0 BEADRP Cc1cccc(CC[N@@H+]2CCCC3(C[NH2+]C3)C2)c1 ZINC001235711216 979127533 /nfs/dbraw/zinc/12/75/33/979127533.db2.gz MSAORRDIRLFHTB-UHFFFAOYSA-N 2 0 244.382 2.223 20 0 BEADRP CCC[C@H](C)C[N@@H+]1CCCC2(C[NH2+]C2)C1 ZINC001235710846 979130057 /nfs/dbraw/zinc/13/00/57/979130057.db2.gz HVEMWOQZNXPAGB-LBPRGKRZSA-N 2 0 210.365 2.108 20 0 BEADRP C[NH2+]CCC[N@H+](C)CCc1cccc(Cl)c1 ZINC001235839712 979169762 /nfs/dbraw/zinc/16/97/62/979169762.db2.gz VNEIDFJJDFUMKU-UHFFFAOYSA-N 2 0 240.778 2.424 20 0 BEADRP C[N@@H+](C/C=C/c1ccccc1)CCCC[NH3+] ZINC001235963160 979233133 /nfs/dbraw/zinc/23/31/33/979233133.db2.gz RJFFDLUSZYXVOR-JXMROGBWSA-N 2 0 218.344 2.371 20 0 BEADRP [NH3+]CCCC[NH+]1CCC2(CC[C@@H](F)C2)CC1 ZINC001235984012 979268613 /nfs/dbraw/zinc/26/86/13/979268613.db2.gz AYBIOIYOTVKBCB-GFCCVEGCSA-N 2 0 228.355 2.330 20 0 BEADRP CC/C=C\CCCN1C[C@H]2CC[C@@H](C1)[NH2+]C2 ZINC001236059820 979348499 /nfs/dbraw/zinc/34/84/99/979348499.db2.gz MIWOCRVNQWAYNY-NMEQGOOXSA-N 2 0 222.376 2.417 20 0 BEADRP C[C@H]1CN(Cc2cccc3c2CCC3)CCC[NH2+]1 ZINC001236101864 979387274 /nfs/dbraw/zinc/38/72/74/979387274.db2.gz ZZUHEZATNCCBTH-ZDUSSCGKSA-N 2 0 244.382 2.359 20 0 BEADRP CC(C)[C@H]1CCC[N@@H+]1CC[C@H]1COC(C)(C)N1 ZINC001236109745 979391907 /nfs/dbraw/zinc/39/19/07/979391907.db2.gz WCAODBFQZBQFDL-QWHCGFSZSA-N 2 0 240.391 2.221 20 0 BEADRP [NH3+]CCCC[N@@H+]1C[C@@H]2C[C@H](C1)c1ccccc12 ZINC001236108636 979392944 /nfs/dbraw/zinc/39/29/44/979392944.db2.gz LRUONPUERBTLFE-BETUJISGSA-N 2 0 230.355 2.312 20 0 BEADRP CC(C)[C@@H]1CCC[N@@H+]1CC[C@H]1COC(C)(C)N1 ZINC001236109747 979394872 /nfs/dbraw/zinc/39/48/72/979394872.db2.gz WCAODBFQZBQFDL-STQMWFEESA-N 2 0 240.391 2.221 20 0 BEADRP C(C1CCCC1)[N@H+]1C[C@@H]2CC[NH2+]CC[C@@H]2C1 ZINC001236315035 979524990 /nfs/dbraw/zinc/52/49/90/979524990.db2.gz UZWPGHVDSZAFQM-OKILXGFUSA-N 2 0 222.376 2.108 20 0 BEADRP CC1=C[C@H](C)[C@@H](C[N@H+](C)[C@@H]2[C@H]3C[NH2+]C[C@H]32)CC1 ZINC001236411236 979588021 /nfs/dbraw/zinc/58/80/21/979588021.db2.gz NAWMFYRYEWIQCV-XPABHHOTSA-N 2 0 234.387 2.128 20 0 BEADRP COC(C)(C)CC[N@@H+]1CCC[C@](C)([NH3+])CC1 ZINC001205254831 979729054 /nfs/dbraw/zinc/72/90/54/979729054.db2.gz CATLEJWHRILMCB-ZDUSSCGKSA-N 2 0 228.380 2.005 20 0 BEADRP CS[C@@H](C)CC[N@@H+]1CCC[C@@](C)([NH3+])CC1 ZINC001205254698 979729223 /nfs/dbraw/zinc/72/92/23/979729223.db2.gz ACGQGHGTXOAZFP-NWDGAFQWSA-N 2 0 230.421 2.331 20 0 BEADRP COc1ccc(C[N@@H+]2CCC[C@@](C)([NH3+])CC2)cc1 ZINC001205265172 979821877 /nfs/dbraw/zinc/82/18/77/979821877.db2.gz OAGLBVPCJSDTEP-OAHLLOKOSA-N 2 0 248.370 2.399 20 0 BEADRP [NH3+]CCCC[N@@H+]1CCc2cc(F)c(F)cc2C1 ZINC001237191643 979839953 /nfs/dbraw/zinc/83/99/53/979839953.db2.gz PNFZCJFRQSYMSL-UHFFFAOYSA-N 2 0 240.297 2.062 20 0 BEADRP CNc1ccccc1C[N@@H+]1CCC[C@](C)([NH3+])CC1 ZINC001205280681 979875329 /nfs/dbraw/zinc/87/53/29/979875329.db2.gz FUNIIQSFSPIKRP-HNNXBMFYSA-N 2 0 247.386 2.432 20 0 BEADRP C[C@H]([NH2+]CC1CC[NH+](C)CC1)c1ccc[nH]1 ZINC001342997827 979970013 /nfs/dbraw/zinc/97/00/13/979970013.db2.gz GCSOSDWANKOQHB-NSHDSACASA-N 2 0 221.348 2.007 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+][C@@H]1CC[C@@H]2C[N@H+](C)C[C@@H]12 ZINC001184386309 980058848 /nfs/dbraw/zinc/05/88/48/980058848.db2.gz BRKGZNJAWKPDFQ-ODXJTPSBSA-N 2 0 224.392 2.351 20 0 BEADRP C[NH+](C)CCc1cccc(C[NH+]2CCCC2)c1 ZINC001250157278 980113030 /nfs/dbraw/zinc/11/30/30/980113030.db2.gz DRYDEPDKWCVJHW-UHFFFAOYSA-N 2 0 232.371 2.387 20 0 BEADRP c1[nH+]cn2c1cccc2C[NH+]1CC2CC(C2)C1 ZINC001238111084 980164118 /nfs/dbraw/zinc/16/41/18/980164118.db2.gz QXZUSYVRSBPKHO-UHFFFAOYSA-N 2 0 227.311 2.176 20 0 BEADRP [NH3+]Cc1ccc(-c2cccc(C[NH3+])c2)cc1 ZINC000005763209 980246632 /nfs/dbraw/zinc/24/66/32/980246632.db2.gz SDILHMRCZWKJDG-UHFFFAOYSA-N 2 0 212.296 2.271 20 0 BEADRP c1cc2c(cc1C1=CCC[NH2+]CC1)CC[NH2+]C2 ZINC001238940954 980379476 /nfs/dbraw/zinc/37/94/76/980379476.db2.gz XPCNIZOEBUPBGF-UHFFFAOYSA-N 2 0 228.339 2.099 20 0 BEADRP C([C@H]1CC2CCC1CC2)N1CC[C@H]2[NH2+]CC[C@@H]2C1 ZINC000691658352 980382277 /nfs/dbraw/zinc/38/22/77/980382277.db2.gz BZTYKHRDJBCZQD-KDQUWOQTSA-N 2 0 248.414 2.497 20 0 BEADRP C[C@H]([NH3+])c1cccc(C2=CCC[NH2+]CC2)c1 ZINC001238948605 980390255 /nfs/dbraw/zinc/39/02/55/980390255.db2.gz ZRHOUOXLRQNULC-NSHDSACASA-N 2 0 216.328 2.473 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@@H](C)CCC(C)C ZINC001345469983 980616117 /nfs/dbraw/zinc/61/61/17/980616117.db2.gz MNVMCAAXIUNEJW-RYUDHWBXSA-N 2 0 200.370 2.399 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H](C)c1ccccc1N(C)C ZINC001345484654 980617840 /nfs/dbraw/zinc/61/78/40/980617840.db2.gz YQCGWCLGEFIUFQ-OLZOCXBDSA-N 2 0 249.402 2.401 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]Cc1cccc2c1CCC2 ZINC001346138891 980765512 /nfs/dbraw/zinc/76/55/12/980765512.db2.gz KWPZXHWWUXXUFF-LBPRGKRZSA-N 2 0 232.371 2.120 20 0 BEADRP C[NH+]1CCC2(CC[N@H+](Cc3ccco3)C2)CC1 ZINC001203285399 980806440 /nfs/dbraw/zinc/80/64/40/980806440.db2.gz JTVHYFZOVNJAFS-UHFFFAOYSA-N 2 0 234.343 2.197 20 0 BEADRP CC(C)C[NH+]1CCC([NH2+][C@H]2C[C@H]2C2CC2)CC1 ZINC000716667515 981065218 /nfs/dbraw/zinc/06/52/18/981065218.db2.gz NRHJMWKJIVGDDX-GJZGRUSLSA-N 2 0 236.403 2.495 20 0 BEADRP CCOC(C)(C)C[N@@H+]1CC[C@@H](C)[C@@H](C[NH3+])CC1 ZINC001205604854 981180974 /nfs/dbraw/zinc/18/09/74/981180974.db2.gz YFIVJSRBGHOIRV-CHWSQXEVSA-N 2 0 242.407 2.108 20 0 BEADRP CC[N@@H+]1CCc2cc(C3=CC[NH2+]CC3)ccc2C1 ZINC001240468295 981402858 /nfs/dbraw/zinc/40/28/58/981402858.db2.gz PKMURBCYVWKRDW-UHFFFAOYSA-N 2 0 242.366 2.441 20 0 BEADRP c1cc([C@H]2CC[NH2+]C2)ccc1C1=CC[NH2+]CC1 ZINC001240469899 981407193 /nfs/dbraw/zinc/40/71/93/981407193.db2.gz PEFSBKFETWERLH-HNNXBMFYSA-N 2 0 228.339 2.140 20 0 BEADRP CC(C)([NH3+])c1cccc(C2=CC[NH2+]CC2)c1 ZINC001240469840 981407678 /nfs/dbraw/zinc/40/76/78/981407678.db2.gz MQICADSOCMUUOQ-UHFFFAOYSA-N 2 0 216.328 2.257 20 0 BEADRP C[C@@H]1CC[N@H+](Cc2cccc(N)c2)CC[C@H]1C[NH3+] ZINC001205638818 981412712 /nfs/dbraw/zinc/41/27/12/981412712.db2.gz SERXEMVDSLTTJC-OCCSQVGLSA-N 2 0 247.386 2.076 20 0 BEADRP c1cc(C2=CCC[NH2+]C2)ccc1C[NH+]1CCC1 ZINC001240670214 981579538 /nfs/dbraw/zinc/57/95/38/981579538.db2.gz YNHLFWLUYWLGRA-UHFFFAOYSA-N 2 0 228.339 2.269 20 0 BEADRP COc1ccc(C2=CCC[NH2+]C2)cc1C[NH+](C)C ZINC001240670171 981581178 /nfs/dbraw/zinc/58/11/78/981581178.db2.gz WHGGAWYSSMLDOS-UHFFFAOYSA-N 2 0 246.354 2.134 20 0 BEADRP COc1ccc(C2=CCC[NH2+]C2)c(C[NH+](C)C)c1 ZINC001240670966 981582112 /nfs/dbraw/zinc/58/21/12/981582112.db2.gz PPGNOVBHZQIZAE-UHFFFAOYSA-N 2 0 246.354 2.134 20 0 BEADRP [NH3+][C@H]1CCc2ccc(C3=CCC[NH2+]C3)cc21 ZINC001240671379 981582811 /nfs/dbraw/zinc/58/28/11/981582811.db2.gz ULFRDSJLUDIMPH-AWEZNQCLSA-N 2 0 214.312 2.009 20 0 BEADRP [NH3+]C1(c2ccccc2C2=CCC[NH2+]C2)CCC1 ZINC001240671073 981583203 /nfs/dbraw/zinc/58/32/03/981583203.db2.gz SBZZXVPHOUFDPT-UHFFFAOYSA-N 2 0 228.339 2.401 20 0 BEADRP C[N@@H+]1CCc2c(F)cc(C3=CCC[NH2+]C3)cc2C1 ZINC001240679849 981584959 /nfs/dbraw/zinc/58/49/59/981584959.db2.gz KLNUZPBDUYQZPR-UHFFFAOYSA-N 2 0 246.329 2.190 20 0 BEADRP c1cc(CC[NH2+][C@@H]2CC[C@H]3[NH2+]CCC[C@@H]3C2)co1 ZINC001580887743 981715607 /nfs/dbraw/zinc/71/56/07/981715607.db2.gz GVTONVVPQBEDLT-RBSFLKMASA-N 2 0 248.370 2.332 20 0 BEADRP c1cc2c(cc1C[NH+]1CC(C3CC3)C1)C[NH2+]CC2 ZINC001580889921 981716985 /nfs/dbraw/zinc/71/69/85/981716985.db2.gz FLRHWZKZEOKDHA-UHFFFAOYSA-N 2 0 242.366 2.174 20 0 BEADRP c1ccc(C2CC2)c(C[NH2+]C[C@H]2[C@@H]3C[NH2+]C[C@H]23)c1 ZINC001580892328 981725628 /nfs/dbraw/zinc/72/56/28/981725628.db2.gz RMTWMFLIINMECR-PHZGNYQRSA-N 2 0 242.366 2.119 20 0 BEADRP C[N@H+]1CC=C(c2ccc3c(c2)C[NH2+]C3)CC1 ZINC001241322307 982482640 /nfs/dbraw/zinc/48/26/40/982482640.db2.gz LRAGCKYQDQFPMV-UHFFFAOYSA-N 2 0 214.312 2.009 20 0 BEADRP C[N@H+]1CC=C(c2cccc(C[NH3+])c2F)CC1 ZINC001241329920 982492865 /nfs/dbraw/zinc/49/28/65/982492865.db2.gz FRHJOSKFCUSTEW-UHFFFAOYSA-N 2 0 220.291 2.003 20 0 BEADRP C[NH+](C)Cc1cccc(-c2ccc(C[NH3+])cc2)n1 ZINC001241913479 983130774 /nfs/dbraw/zinc/13/07/74/983130774.db2.gz XOFUOTJZGWUKSC-UHFFFAOYSA-N 2 0 241.338 2.269 20 0 BEADRP CC[NH+]1C[C@@H]2C[NH+](CC3CCCCC3)C[C@H]2C1 ZINC001201401263 983200953 /nfs/dbraw/zinc/20/09/53/983200953.db2.gz FPQKUSCDJOBWQV-HUUCEWRRSA-N 2 0 236.403 2.450 20 0 BEADRP Cn1cc[nH+]c1Nc1cccc(C[NH+](C)C)c1 ZINC001201384754 983212605 /nfs/dbraw/zinc/21/26/05/983212605.db2.gz POTVTGMSTRAPGH-UHFFFAOYSA-N 2 0 230.315 2.225 20 0 BEADRP C[NH+]1CCC2(C[NH+](C[C@@H]3CC=CCC3)C2)CC1 ZINC001201421540 983222259 /nfs/dbraw/zinc/22/22/59/983222259.db2.gz CLBMDYZZDPQQRU-CQSZACIVSA-N 2 0 234.387 2.370 20 0 BEADRP C[NH+](C)Cc1cncc(C2=C[C@H]3CC[C@@H](C2)[NH2+]3)c1 ZINC001242025563 983236214 /nfs/dbraw/zinc/23/62/14/983236214.db2.gz DNZONOZUODFKFP-CABCVRRESA-N 2 0 243.354 2.051 20 0 BEADRP C[NH2+]Cc1ccc(C2=C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC001242026269 983238714 /nfs/dbraw/zinc/23/87/14/983238714.db2.gz OOMGKJLAYPXDPO-CABCVRRESA-N 2 0 228.339 2.314 20 0 BEADRP CCC[C@@H](C)C[NH+]1CC2(C1)CC[NH+](C)CC2 ZINC001201552214 983307987 /nfs/dbraw/zinc/30/79/87/983307987.db2.gz BRBWBRNFDSIJLJ-CYBMUJFWSA-N 2 0 224.392 2.450 20 0 BEADRP CC[N@H+](C)C1CCN(CCCSC)CC1 ZINC001201697584 983410330 /nfs/dbraw/zinc/41/03/30/983410330.db2.gz IKJFDHZOTKLGKJ-UHFFFAOYSA-N 2 0 230.421 2.156 20 0 BEADRP CSCCCN1CCC([N@H+](C)C2CC2)CC1 ZINC001201697086 983410434 /nfs/dbraw/zinc/41/04/34/983410434.db2.gz ZLGPPCYJBPECBC-UHFFFAOYSA-N 2 0 242.432 2.298 20 0 BEADRP CC(C)[N@H+](CC1CC1)C1CCN(C)CC1 ZINC001201952359 983523952 /nfs/dbraw/zinc/52/39/52/983523952.db2.gz NMKGKRFJUWQNCD-UHFFFAOYSA-N 2 0 210.365 2.201 20 0 BEADRP CC[N@H+](CCn1ccnc1)CC1CCCC1 ZINC001202190051 983596158 /nfs/dbraw/zinc/59/61/58/983596158.db2.gz KAWUUESLLHFBLW-UHFFFAOYSA-N 2 0 221.348 2.395 20 0 BEADRP CCCC[C@@H](O)C[NH2+]C1CC[NH+](CCC)CC1 ZINC001252107177 983672503 /nfs/dbraw/zinc/67/25/03/983672503.db2.gz GDVMYENAMQCPCJ-CQSZACIVSA-N 2 0 242.407 2.002 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CC[C@@H]([NH3+])C1)c1ccccc1 ZINC001576244540 984160038 /nfs/dbraw/zinc/16/00/38/984160038.db2.gz LHTDYTSJARXWOS-SGMGOOAPSA-N 2 0 218.344 2.465 20 0 BEADRP C[C@@H]1CCC(C)(C)C[C@H]1[NH2+][C@H]1C[C@@H]([NH3+])C1 ZINC001576647942 984179280 /nfs/dbraw/zinc/17/92/80/984179280.db2.gz VPPVAFJXEUYUTN-WISYIIOYSA-N 2 0 210.365 2.281 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@]2(C)CC[NH2+]C2)C[C@@H]1C ZINC001576669907 984179428 /nfs/dbraw/zinc/17/94/28/984179428.db2.gz BZEFTJBPYCDNRQ-ZOBORPQBSA-N 2 0 224.392 2.400 20 0 BEADRP CCCCC[C@@H](O)C[NH2+]C1CC[NH+](CC)CC1 ZINC001253550089 984201320 /nfs/dbraw/zinc/20/13/20/984201320.db2.gz WSIFTSBHDXYAOZ-CQSZACIVSA-N 2 0 242.407 2.002 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCCC[NH2+]C1)c1cccc(O)c1 ZINC001579485852 984281327 /nfs/dbraw/zinc/28/13/27/984281327.db2.gz ULCAVYXFMUKXDT-STQMWFEESA-N 2 0 248.370 2.433 20 0 BEADRP C[C@H]1C[N@H+](Cc2ccccc2)CCC[C@@H]1C[NH3+] ZINC001205985211 984302114 /nfs/dbraw/zinc/30/21/14/984302114.db2.gz WODXCDNADFUUSF-DZGCQCFKSA-N 2 0 232.371 2.493 20 0 BEADRP [NH3+][C@@H]1CCc2ccc(C3=CC[NH2+]CC3)cc21 ZINC001240470408 984303695 /nfs/dbraw/zinc/30/36/95/984303695.db2.gz FYNIZRRLPAZFNH-CQSZACIVSA-N 2 0 214.312 2.009 20 0 BEADRP CC(C)([NH3+])c1ccccc1C1=CC[NH2+]CC1 ZINC001240470094 984304003 /nfs/dbraw/zinc/30/40/03/984304003.db2.gz VNRQHMWLDPFYRR-UHFFFAOYSA-N 2 0 216.328 2.257 20 0 BEADRP C[NH2+]Cc1ccc(-c2[nH+]ccc(N)c2C)cc1 ZINC001242990229 984353593 /nfs/dbraw/zinc/35/35/93/984353593.db2.gz GKMWUSNIKKQGEP-UHFFFAOYSA-N 2 0 227.311 2.359 20 0 BEADRP CC[C@H](C)C[NH+]1CCC2(CC[N@H+](C)C2)CC1 ZINC001275061848 984457475 /nfs/dbraw/zinc/45/74/75/984457475.db2.gz LOWOAOVWBLWACI-ZDUSSCGKSA-N 2 0 224.392 2.450 20 0 BEADRP CCC[N@@H+]1CCC[C@]2(CCC[NH+](C)C2)C1 ZINC001275103961 984487981 /nfs/dbraw/zinc/48/79/81/984487981.db2.gz VXZMYYDVBYMVJY-ZDUSSCGKSA-N 2 0 210.365 2.204 20 0 BEADRP CCCC[N@H+]1C[C@@H]2CC[NH+](C)CC[C@@H]2C1 ZINC001275114607 984493056 /nfs/dbraw/zinc/49/30/56/984493056.db2.gz BADNJDQLEFVGNN-BETUJISGSA-N 2 0 210.365 2.060 20 0 BEADRP CSCCC[N@H+]1C[C@@H]2CC[NH+](C)CC[C@@H]2C1 ZINC001275109441 984493467 /nfs/dbraw/zinc/49/34/67/984493467.db2.gz FGXNIMMVVYIPJE-BETUJISGSA-N 2 0 242.432 2.013 20 0 BEADRP C1=C(c2cc(C[NH+]3CCCCC3)ccn2)C[NH2+]C1 ZINC001243109691 984565930 /nfs/dbraw/zinc/56/59/30/984565930.db2.gz FEANMTUWWXFSIL-UHFFFAOYSA-N 2 0 243.354 2.054 20 0 BEADRP C1=C(c2ccc([C@@H]3CCC[NH2+]3)cc2)C[NH2+]C1 ZINC001243110255 984566497 /nfs/dbraw/zinc/56/64/97/984566497.db2.gz DMZUBQIVXOQRSF-AWEZNQCLSA-N 2 0 214.312 2.098 20 0 BEADRP C[N@H+]1CC[C@H]2C[NH+](Cc3ccoc3)C[C@H]2CC1 ZINC001275943457 984736271 /nfs/dbraw/zinc/73/62/71/984736271.db2.gz IBBWFESMSNTXPJ-OKILXGFUSA-N 2 0 234.343 2.053 20 0 BEADRP CC[NH2+]C1CC[NH+](C[C@@]2(C)CCCCO2)CC1 ZINC001577821381 984807068 /nfs/dbraw/zinc/80/70/68/984807068.db2.gz LSRDOFFOMYBSMW-CQSZACIVSA-N 2 0 240.391 2.020 20 0 BEADRP Cc1ccc(C[NH+]2CCC3(CC[N@@H+](C)C3)CC2)[nH]1 ZINC001276072189 984810599 /nfs/dbraw/zinc/81/05/99/984810599.db2.gz PKGMVXIXITZLCC-UHFFFAOYSA-N 2 0 247.386 2.241 20 0 BEADRP C[NH+](C)CCC[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000925500804 984827044 /nfs/dbraw/zinc/82/70/44/984827044.db2.gz FSIXWSWLRCGJOU-OAHLLOKOSA-N 3 0 249.402 2.008 20 0 BEADRP CCOc1ccc(C[NH2+][C@H](C)CC[NH3+])c(C)c1 ZINC001578179330 984866793 /nfs/dbraw/zinc/86/67/93/984866793.db2.gz CEQRWANERFMWEB-GFCCVEGCSA-N 2 0 236.359 2.221 20 0 BEADRP CCS[C@@H]1CCCC[C@H]1[NH2+]C[C@H]1CCC[NH2+]1 ZINC001578217081 984871235 /nfs/dbraw/zinc/87/12/35/984871235.db2.gz YXTSNXITQOIOPW-JHJVBQTASA-N 2 0 242.432 2.392 20 0 BEADRP CCc1ccc(C[NH2+]C[C@H]2C[C@@H]([NH3+])C2)cc1 ZINC001578260036 984911767 /nfs/dbraw/zinc/91/17/67/984911767.db2.gz YNVIUEJBMNDSNR-OKILXGFUSA-N 2 0 218.344 2.076 20 0 BEADRP C[N@H+](CCC[NH3+])[C@@H]1CCC[C@@H]1C(C)(C)C ZINC001578466473 985100162 /nfs/dbraw/zinc/10/01/62/985100162.db2.gz OERWNFQHXZDKSS-NWDGAFQWSA-N 2 0 212.381 2.482 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]Cc1csc(C)c1 ZINC001578571940 985210954 /nfs/dbraw/zinc/21/09/54/985210954.db2.gz XUCQAVMZVILLSZ-SECBINFHSA-N 2 0 212.362 2.144 20 0 BEADRP C[NH2+]CCCSCC[NH+](C(C)C)C(C)C ZINC001578691538 985293396 /nfs/dbraw/zinc/29/33/96/985293396.db2.gz PVGZLDYXHSCSGO-UHFFFAOYSA-N 2 0 232.437 2.448 20 0 BEADRP C[NH2+]CCC[N@H+](C)C[C@H]1CCc2ccccc2C1 ZINC001578687338 985298026 /nfs/dbraw/zinc/29/80/26/985298026.db2.gz JLNAXIPBKQELBK-AWEZNQCLSA-N 2 0 246.398 2.333 20 0 BEADRP c1c(C[N@@H+]2CC[C@@H]3C[C@@H]3C2)sc2c1C[NH2+]CC2 ZINC000687979617 985444481 /nfs/dbraw/zinc/44/44/81/985444481.db2.gz APGPHGWQSPUETJ-ZYHUDNBSSA-N 2 0 248.395 2.236 20 0 BEADRP COC[C@@H](CC(C)(C)C)[NH2+][C@H](C)CCC[NH3+] ZINC001578960923 985576838 /nfs/dbraw/zinc/57/68/38/985576838.db2.gz QHDFCLXZWSXXTL-VXGBXAGGSA-N 2 0 230.396 2.155 20 0 BEADRP COC[C@H](CC(C)(C)C)[NH2+][C@@H](C)CCC[NH3+] ZINC001578960922 985580922 /nfs/dbraw/zinc/58/09/22/985580922.db2.gz QHDFCLXZWSXXTL-RYUDHWBXSA-N 2 0 230.396 2.155 20 0 BEADRP C[NH+](C)Cc1cncc(/C=C/C2CC[NH2+]CC2)c1 ZINC001243897710 985582406 /nfs/dbraw/zinc/58/24/06/985582406.db2.gz QJCKXHHSGZGDPY-ONEGZZNKSA-N 2 0 245.370 2.156 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H](C)CCSC ZINC001258198113 985593474 /nfs/dbraw/zinc/59/34/74/985593474.db2.gz FZXPPNGKFDXSEN-GFCCVEGCSA-N 2 0 232.437 2.450 20 0 BEADRP CSCC[C@H](C)[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC001258199964 985608409 /nfs/dbraw/zinc/60/84/09/985608409.db2.gz LXXROOYSMKWHQP-QWHCGFSZSA-N 2 0 244.448 2.450 20 0 BEADRP CSCC[C@@H](C)[NH2+]CC(C)(C)C[NH+](C)C ZINC001258203235 985614659 /nfs/dbraw/zinc/61/46/59/985614659.db2.gz BROIACILVPOYQB-LLVKDONJSA-N 2 0 232.437 2.305 20 0 BEADRP COCC[C@H]([NH3+])C[NH2+][C@H](C)CCC=C(C)C ZINC001579001081 985641172 /nfs/dbraw/zinc/64/11/72/985641172.db2.gz FMEDIQYITMIAPP-OLZOCXBDSA-N 2 0 228.380 2.075 20 0 BEADRP c1ncc(C2=C[NH2+]CCC2)cc1C[NH+]1CCCC1 ZINC001243953123 985663439 /nfs/dbraw/zinc/66/34/39/985663439.db2.gz VPLSJTSDVYEISK-UHFFFAOYSA-N 2 0 243.354 2.402 20 0 BEADRP CC[C@@H](CC(F)F)C[N@@H+]1CC[C@@H](CC[NH3+])C1 ZINC000688725590 985716268 /nfs/dbraw/zinc/71/62/68/985716268.db2.gz IQKBEMHRDDXRCG-WDEREUQCSA-N 2 0 234.334 2.339 20 0 BEADRP CC[C@@H](CC(F)F)C[N@@H+]1CCC[C@@H](C[NH3+])C1 ZINC000688760801 985719355 /nfs/dbraw/zinc/71/93/55/985719355.db2.gz LUMZCBBJCPFYJO-QWRGUYRKSA-N 2 0 234.334 2.339 20 0 BEADRP CSC(C)(C)C[C@@H](C)[NH2+]CCCC[NH3+] ZINC001258320768 985804309 /nfs/dbraw/zinc/80/43/09/985804309.db2.gz CPORBIVZOMQLPV-SNVBAGLBSA-N 2 0 218.410 2.235 20 0 BEADRP CSCCCCC[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC001579371367 985863557 /nfs/dbraw/zinc/86/35/57/985863557.db2.gz FNUAUKVDMKUZDG-ZDUSSCGKSA-N 2 0 244.448 2.499 20 0 BEADRP CSCCCCC[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC001579371366 985865470 /nfs/dbraw/zinc/86/54/70/985865470.db2.gz FNUAUKVDMKUZDG-CYBMUJFWSA-N 2 0 244.448 2.499 20 0 BEADRP C[C@H](CC1CC1)[NH2+]CCCCC[NH+](C)C ZINC001258447902 985887602 /nfs/dbraw/zinc/88/76/02/985887602.db2.gz YLQBFFQPGQVUBI-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@H](CC1CC1)[NH+]1CCC(C[NH+](C)C)CC1 ZINC001258461653 985905839 /nfs/dbraw/zinc/90/58/39/985905839.db2.gz DJJOJJCXTRGKKI-GFCCVEGCSA-N 2 0 224.392 2.449 20 0 BEADRP C[C@]1(CN[C@H]2CC[NH2+]C2)C[C@@H]1c1ccccc1 ZINC001579509441 986052981 /nfs/dbraw/zinc/05/29/81/986052981.db2.gz OTFYMFDQGKDVFQ-RRFJBIMHSA-N 2 0 230.355 2.132 20 0 BEADRP CCCC[C@@H](CCC)[N@@H+]1CCO[C@H](C[NH3+])C1 ZINC001258752885 986116121 /nfs/dbraw/zinc/11/61/21/986116121.db2.gz NAQIJATZUGLOLU-CHWSQXEVSA-N 2 0 228.380 2.005 20 0 BEADRP CCCC[C@@H](CCC)NC(=[NH2+])NCCCC[NH3+] ZINC001258755074 986118127 /nfs/dbraw/zinc/11/81/27/986118127.db2.gz CRMMDTKCZVPFHM-GFCCVEGCSA-N 2 0 242.411 2.198 20 0 BEADRP CCCC[C@H](CCC)NC(=[NH2+])NCCCC[NH3+] ZINC001258755075 986118721 /nfs/dbraw/zinc/11/87/21/986118721.db2.gz CRMMDTKCZVPFHM-LBPRGKRZSA-N 2 0 242.411 2.198 20 0 BEADRP Cc1cc(C[NH2+][C@@H]2C[C@H]([NH3+])C2(C)C)cc(C)c1O ZINC001579601778 986128468 /nfs/dbraw/zinc/12/84/68/986128468.db2.gz ZXRFTGDEDAZULS-QWHCGFSZSA-N 2 0 248.370 2.224 20 0 BEADRP Cc1cccnc1[C@H](C)[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC001579808116 986222713 /nfs/dbraw/zinc/22/27/13/986222713.db2.gz ZKLGXQFVVGMIOP-UONOGXRCSA-N 2 0 247.386 2.430 20 0 BEADRP C[C@H]1CCC[C@@H]([N@H+]2C[C@H]3C[NH+](C)C[C@H]3C2)C1 ZINC001258825526 986289911 /nfs/dbraw/zinc/28/99/11/986289911.db2.gz DBHSJPLDWQMPCL-IGQOVBAYSA-N 2 0 222.376 2.059 20 0 BEADRP CCCC[C@H](C)[NH2+]C[C@@H]1C[NH+]2CCC1CC2 ZINC001462632289 986469612 /nfs/dbraw/zinc/46/96/12/986469612.db2.gz CUWJATFNYASIJY-GXTWGEPZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@]1(C[N@@H+]2CCC[C@@H](CCF)C2)CCC[NH2+]C1 ZINC000689421677 986582869 /nfs/dbraw/zinc/58/28/69/986582869.db2.gz MGZCUYDGDYBFFS-UONOGXRCSA-N 2 0 242.382 2.448 20 0 BEADRP [NH3+][C@@H]1CCC[N@H+](CCCC(F)(F)F)CC1 ZINC000378662195 986616211 /nfs/dbraw/zinc/61/62/11/986616211.db2.gz CICVRJIECDUSOB-SECBINFHSA-N 2 0 224.270 2.142 20 0 BEADRP FC1CC[NH+](CCC2C[C@H]3CC[C@@H](C2)[NH2+]3)CC1 ZINC000689464219 986626493 /nfs/dbraw/zinc/62/64/93/986626493.db2.gz VLBMKIZPVYCTGN-QXMXGUDHSA-N 2 0 240.366 2.341 20 0 BEADRP [NH3+][C@H]1CC12CC([NH2+][C@@H]1CCc3ccccc31)C2 ZINC001580166658 986643006 /nfs/dbraw/zinc/64/30/06/986643006.db2.gz QUILZXFQYQEHGT-YTELLUSKSA-N 2 0 228.339 2.143 20 0 BEADRP [NH3+][C@@H]1CC12CC([NH2+]Cc1cccc3cc[nH]c31)C2 ZINC001580165902 986644846 /nfs/dbraw/zinc/64/48/46/986644846.db2.gz NSJPICVPECMVRI-JVWICGRDSA-N 2 0 241.338 2.137 20 0 BEADRP CC1CC[NH+]([C@@H]2CCC[N@H+](C)CC2)CC1 ZINC001254517947 986651086 /nfs/dbraw/zinc/65/10/86/986651086.db2.gz ZOTSJWJCVBSSTJ-CYBMUJFWSA-N 2 0 210.365 2.203 20 0 BEADRP [NH3+]CC1(C[NH2+]Cc2cccc3[nH]ccc32)CCC1 ZINC001580243830 986696214 /nfs/dbraw/zinc/69/62/14/986696214.db2.gz MCKGEWXQXWKFOD-UHFFFAOYSA-N 2 0 243.354 2.387 20 0 BEADRP COC(C)(C)C[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC000383134255 986779776 /nfs/dbraw/zinc/77/97/76/986779776.db2.gz VYPNVELKWGTELW-YHWZYXNKSA-N 2 0 240.391 2.016 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[NH2+][C@@H](c2ccncc2)C2CC2)C1 ZINC001580389241 986817388 /nfs/dbraw/zinc/81/73/88/986817388.db2.gz FHHXISKLBGZZRC-NILFDRSVSA-N 2 0 245.370 2.250 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]C2CCC(C(F)(F)F)CC2)C1 ZINC001580429943 986848283 /nfs/dbraw/zinc/84/82/83/986848283.db2.gz CCEMIIRQNZAJGR-ILCXDJLASA-N 2 0 236.281 2.187 20 0 BEADRP C[N@@H+]1CC[C@H](n2c(CC[NH3+])cc3ccccc32)C1 ZINC001255424619 986944135 /nfs/dbraw/zinc/94/41/35/986944135.db2.gz ZIOUPXFRCZDFFO-AWEZNQCLSA-N 2 0 243.354 2.019 20 0 BEADRP C[NH2+]Cc1ccc2c(ccn2[C@@H]2CC[N@H+](C)C2)c1 ZINC001255432828 986953761 /nfs/dbraw/zinc/95/37/61/986953761.db2.gz UQPCWBAKYSTSJF-CQSZACIVSA-N 2 0 243.354 2.237 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)n1cccc1C[NH3+] ZINC001255942566 987080511 /nfs/dbraw/zinc/08/05/11/987080511.db2.gz FJMODWYLZWGVOI-GFCCVEGCSA-N 2 0 223.364 2.240 20 0 BEADRP CC[NH+](CC)CC[C@H](C)n1ccc(C[NH3+])c1 ZINC001255947090 987094769 /nfs/dbraw/zinc/09/47/69/987094769.db2.gz NNFRYLBVOGZFOL-LBPRGKRZSA-N 2 0 223.364 2.240 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)n1ccc(C[NH3+])c1 ZINC001255947089 987094905 /nfs/dbraw/zinc/09/49/05/987094905.db2.gz NNFRYLBVOGZFOL-GFCCVEGCSA-N 2 0 223.364 2.240 20 0 BEADRP Cc1cnc(-c2ccc3c[nH+]cn3c2)c(C[NH3+])c1 ZINC001245895529 987109245 /nfs/dbraw/zinc/10/92/45/987109245.db2.gz ZVPWXTBEDCMTHN-UHFFFAOYSA-N 2 0 238.294 2.163 20 0 BEADRP Cc1c(N)cc[nH+]c1-c1ccc2c[nH+]cn2c1 ZINC001245895600 987113932 /nfs/dbraw/zinc/11/39/32/987113932.db2.gz CHDRFNLTJCZGLT-UHFFFAOYSA-N 2 0 224.267 2.287 20 0 BEADRP [NH3+]Cc1cccc(-c2ccc3c[nH+]cn3c2)c1 ZINC001245898042 987129721 /nfs/dbraw/zinc/12/97/21/987129721.db2.gz MNRPXQOTKIGBCW-UHFFFAOYSA-N 2 0 223.279 2.460 20 0 BEADRP C[C@@H](Cc1ccccn1)[NH2+]C(C)(C)CC[NH+](C)C ZINC001256401989 987212568 /nfs/dbraw/zinc/21/25/68/987212568.db2.gz XDNFVSWMEXGBOI-ZDUSSCGKSA-N 2 0 249.402 2.333 20 0 BEADRP [NH3+]C1CC([NH2+]CCCC2CCCCC2)C1 ZINC000694053777 987319958 /nfs/dbraw/zinc/31/99/58/987319958.db2.gz RXLCUPLHFBJNFI-UHFFFAOYSA-N 2 0 210.365 2.426 20 0 BEADRP [NH3+]C1(C[NH2+][C@H]2CCCC[C@H]2C2CC2)CC1 ZINC000695988523 987336776 /nfs/dbraw/zinc/33/67/76/987336776.db2.gz SUTJKBLPCBWVST-RYUDHWBXSA-N 2 0 208.349 2.036 20 0 BEADRP CC[C@@H]1CCC[N@@H+]1C[C@@H]1CCCC[NH2+]C1 ZINC000697041058 987346126 /nfs/dbraw/zinc/34/61/26/987346126.db2.gz KJOOQLGPFYHEDJ-CHWSQXEVSA-N 2 0 210.365 2.251 20 0 BEADRP CC[C@@H]1CC[N@H+](C[C@H]2CCCC[NH2+]C2)C1 ZINC000697044073 987347110 /nfs/dbraw/zinc/34/71/10/987347110.db2.gz ZEMJLSWVOCGFDM-OLZOCXBDSA-N 2 0 210.365 2.108 20 0 BEADRP CC[C@H]1C[N@H+](C[C@H]2CCCC[NH2+]C2)CCS1 ZINC000697054786 987347227 /nfs/dbraw/zinc/34/72/27/987347227.db2.gz FZCGTSYJMJSPRA-STQMWFEESA-N 2 0 242.432 2.204 20 0 BEADRP CC(C)CC[N@H+](C)C[C@H]1CCCC[NH2+]C1 ZINC000697041142 987347264 /nfs/dbraw/zinc/34/72/64/987347264.db2.gz LQTGFVOFLVZTRO-ZDUSSCGKSA-N 2 0 212.381 2.354 20 0 BEADRP CC[C@@]1(C)CC[N@H+](C[C@H]2CCCC[NH2+]C2)C1 ZINC000697036853 987347708 /nfs/dbraw/zinc/34/77/08/987347708.db2.gz MSSRCJHNDAUIHS-KBPBESRZSA-N 2 0 224.392 2.498 20 0 BEADRP CC[C@H]1CCC[N@@H+]1C[C@@H]1CCCC[NH2+]C1 ZINC000697041061 987347803 /nfs/dbraw/zinc/34/78/03/987347803.db2.gz KJOOQLGPFYHEDJ-OLZOCXBDSA-N 2 0 210.365 2.251 20 0 BEADRP CC[C@H]1CC[N@H+](C[C@@H]2CCCC[NH2+]C2)C1 ZINC000697044075 987348695 /nfs/dbraw/zinc/34/86/95/987348695.db2.gz ZEMJLSWVOCGFDM-QWHCGFSZSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@@H]1[C@H](C)SCC[N@@H+]1C[C@H]1CCCC[NH2+]C1 ZINC000697058706 987348706 /nfs/dbraw/zinc/34/87/06/987348706.db2.gz TYRWPJPVOHUGDB-AGIUHOORSA-N 2 0 242.432 2.202 20 0 BEADRP Cc1ccccc1CCN[C@H]1CCCC[NH2+]C1 ZINC001246076602 987369574 /nfs/dbraw/zinc/36/95/74/987369574.db2.gz QSNOIKWNSYEXIQ-HNNXBMFYSA-N 2 0 232.371 2.269 20 0 BEADRP CC(C)COCC[C@H](C)[NH2+]CC1([NH3+])CCCC1 ZINC001246077723 987369811 /nfs/dbraw/zinc/36/98/11/987369811.db2.gz YAPUWZYJEJPFDU-ZDUSSCGKSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C2(C)CCCCC2)CC[NH2+]1 ZINC001246080750 987376996 /nfs/dbraw/zinc/37/69/96/987376996.db2.gz JQASRWZKMWPGNU-VXGBXAGGSA-N 2 0 210.365 2.439 20 0 BEADRP C[C@H]1CC[C@H]([NH2+][C@H]2C[C@@H]3[C@H](C2)C3(C)C)CN1 ZINC001246084565 987379844 /nfs/dbraw/zinc/37/98/44/987379844.db2.gz KSNSRTQGHCKYGI-NWBUJAPZSA-N 2 0 222.376 2.151 20 0 BEADRP C[C@H]1CC[C@H]([NH2+][C@@H]2C[C@@H]3[C@H](C2)C3(C)C)CN1 ZINC001246084568 987379902 /nfs/dbraw/zinc/37/99/02/987379902.db2.gz KSNSRTQGHCKYGI-PJSNJIKXSA-N 2 0 222.376 2.151 20 0 BEADRP CC(C)OCC[C@H](C)[NH2+]C[C@H]1C[NH2+]C[C@@H](C)C1 ZINC001246096181 987408693 /nfs/dbraw/zinc/40/86/93/987408693.db2.gz DIICDDLEDMGRKQ-MELADBBJSA-N 2 0 242.407 2.025 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+][C@H]2C[C@@H]3[C@H](C2)C3(C)C)C[NH2+]1 ZINC001246098917 987413001 /nfs/dbraw/zinc/41/30/01/987413001.db2.gz QKGVTEMIRQWZTH-XHJNMGKDSA-N 2 0 236.403 2.399 20 0 BEADRP C[C@H]1CCC[C@H]([NH2+]C[C@H]2C[NH2+]C[C@@H](C)C2)C1 ZINC001246102096 987424658 /nfs/dbraw/zinc/42/46/58/987424658.db2.gz QZTDYYDAFKHJKH-FQUUOJAGSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+][C@@H]2C[C@@H]3[C@H](C2)C3(C)C)[NH2+]C1 ZINC001246102751 987429721 /nfs/dbraw/zinc/42/97/21/987429721.db2.gz FIBOXGMJDLBSFE-KSTCHIGDSA-N 2 0 236.403 2.399 20 0 BEADRP CSCC[C@H](C)[NH2+]C[C@@H]1CC[C@@H](C)C[NH2+]1 ZINC001246105090 987432172 /nfs/dbraw/zinc/43/21/72/987432172.db2.gz LPXKMCODMYXWNF-WOPDTQHZSA-N 2 0 230.421 2.106 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C[C@H]2CC[C@@H](C)C[NH2+]2)C1 ZINC001246104956 987432508 /nfs/dbraw/zinc/43/25/08/987432508.db2.gz KZAGOGYIDFBJGB-FDYHWXHSSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+]C[C@H]2CC[C@@H](C)C[NH2+]2)C1 ZINC001246104965 987434783 /nfs/dbraw/zinc/43/47/83/987434783.db2.gz KZAGOGYIDFBJGB-UMSGYPCISA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)CCC[C@@H](C)[NH2+][C@H]1C[NH2+]C[C@@H]1C ZINC001246107423 987438544 /nfs/dbraw/zinc/43/85/44/987438544.db2.gz IABXRPMSTQARBD-XQQFMLRXSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]C[C@@H]1C[NH2+]C[C@@H](C)C1 ZINC001246107184 987439518 /nfs/dbraw/zinc/43/95/18/987439518.db2.gz ZITXRHSFIMEARC-GVXVVHGQSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@H]1C[C@@H](n2cc(C[NH3+])c3ccccc32)CC[NH2+]1 ZINC001246110082 987441074 /nfs/dbraw/zinc/44/10/74/987441074.db2.gz QMBJBKCBSXPOBP-AAEUAGOBSA-N 2 0 243.354 2.413 20 0 BEADRP C[C@H](CC1CC1)[NH2+]C[C@@H]1C[NH2+]CC[C@H]1C ZINC001246113431 987451886 /nfs/dbraw/zinc/45/18/86/987451886.db2.gz QUPXKJGNOSJSHK-WZRBSPASSA-N 2 0 210.365 2.010 20 0 BEADRP CCC[C@H](CC)[NH2+]C[C@H]1C[NH2+]CC[C@H]1C ZINC001246116547 987459821 /nfs/dbraw/zinc/45/98/21/987459821.db2.gz WKVDUMBYZJBGHQ-UPJWGTAASA-N 2 0 212.381 2.400 20 0 BEADRP CCCCC[C@H](CCC)[NH2+]CCC1(O)C[NH2+]C1 ZINC001246118059 987463087 /nfs/dbraw/zinc/46/30/87/987463087.db2.gz OHYWCNKKGNVLDP-ZDUSSCGKSA-N 2 0 242.407 2.049 20 0 BEADRP C[C@@H]1CC[NH2+]C[C@@H]1C[NH2+][C@H]1C[C@@H]2[C@H](C1)C2(C)C ZINC001246121493 987468601 /nfs/dbraw/zinc/46/86/01/987468601.db2.gz RIKVQOMZWZZTJL-XGFWRYKXSA-N 2 0 236.403 2.256 20 0 BEADRP CC[C@@H](CC(C)C)[NH2+][C@H]1C[NH2+]CC12CC2 ZINC001246132904 987485298 /nfs/dbraw/zinc/48/52/98/987485298.db2.gz NGDGHAAUPZMWDP-RYUDHWBXSA-N 2 0 210.365 2.153 20 0 BEADRP C1[C@@H]2C[C@@H]([NH2+][C@@H]3CCC4(C3)CC[NH2+]CC4)C[C@H]12 ZINC001246134465 987489573 /nfs/dbraw/zinc/48/95/73/987489573.db2.gz SPBQRFSPJCMFIU-XJFOESAGSA-N 2 0 234.387 2.297 20 0 BEADRP CC1(C)CCC([NH2+][C@@H]2C[NH2+]CC23CC3)CC1 ZINC001246134712 987490797 /nfs/dbraw/zinc/49/07/97/987490797.db2.gz RWFZNQAVCXCNFI-GFCCVEGCSA-N 2 0 222.376 2.297 20 0 BEADRP CC(C)CC(CC(C)C)[NH2+][C@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001246143762 987498502 /nfs/dbraw/zinc/49/85/02/987498502.db2.gz GZSBYAQDERGZSS-BTTYYORXSA-N 2 0 224.392 2.255 20 0 BEADRP CCCCC[C@@H](CC)[NH2+][C@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001246149917 987506166 /nfs/dbraw/zinc/50/61/66/987506166.db2.gz VCUMPBYJDWGCJZ-FVCCEPFGSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@@H](C)C[C@H](CC)[NH2+][C@H]1[C@@H]2C[C@H]1C[NH2+]C2 ZINC001246151077 987513575 /nfs/dbraw/zinc/51/35/75/987513575.db2.gz VXDHFRHQBWDDPM-DGTMBMJNSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@H]1CC[C@H](n2c(C[NH3+])cc3ccccc32)C[NH2+]1 ZINC001246164758 987528239 /nfs/dbraw/zinc/52/82/39/987528239.db2.gz BCZQQWCTOJVMMM-AAEUAGOBSA-N 2 0 243.354 2.413 20 0 BEADRP [NH3+]Cc1cc2ccccc2n1[C@@H]1CCC[NH2+]C1 ZINC001246164638 987529007 /nfs/dbraw/zinc/52/90/07/987529007.db2.gz ACYYNBWVYUQBKY-GFCCVEGCSA-N 2 0 229.327 2.025 20 0 BEADRP CC(C)C[C@H](C)C[C@H](C)[NH2+]C[C@@H]1CC[NH2+]1 ZINC001246192976 987588828 /nfs/dbraw/zinc/58/88/28/987588828.db2.gz KWDZQHXNPYTIAG-AVGNSLFASA-N 2 0 212.381 2.399 20 0 BEADRP CC1(C)[C@@H]2C[C@H]([NH2+]C[C@@H]3CCC[NH2+]C3)C[C@@H]21 ZINC001246199638 987594746 /nfs/dbraw/zinc/59/47/46/987594746.db2.gz YDALLTRUGBPJNN-FVCCEPFGSA-N 2 0 222.376 2.010 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@H]2C[C@@H]2c2ccccc2)CC[NH2+]1 ZINC001246210778 987605623 /nfs/dbraw/zinc/60/56/23/987605623.db2.gz KHETVUGRBYWJAI-BEAPCOKYSA-N 2 0 230.355 2.273 20 0 BEADRP CC(C)C[C@@H](C)C[C@@H](C)[NH2+]C[C@@H]1CC[NH2+]1 ZINC001246217496 987614364 /nfs/dbraw/zinc/61/43/64/987614364.db2.gz KWDZQHXNPYTIAG-UPJWGTAASA-N 2 0 212.381 2.399 20 0 BEADRP C[C@@H](CCCC(C)(C)O)[NH2+][C@@H]1CC[NH2+][C@H](C)C1 ZINC001246230734 987629497 /nfs/dbraw/zinc/62/94/97/987629497.db2.gz LLTSJXCPBKRQKN-YNEHKIRRSA-N 2 0 242.407 2.046 20 0 BEADRP Cc1ccnc(CCC[NH2+][C@H]2CC[NH2+][C@H](C)C2)c1 ZINC001246241427 987642172 /nfs/dbraw/zinc/64/21/72/987642172.db2.gz RCACJZGTGMXVLC-HIFRSBDPSA-N 2 0 247.386 2.053 20 0 BEADRP C[C@H]1C[C@H]([NH2+]Cc2c[nH]c3ccccc23)CC[NH2+]1 ZINC001246242553 987644581 /nfs/dbraw/zinc/64/45/81/987644581.db2.gz FPVIWBYERNKEEG-WCQYABFASA-N 2 0 243.354 2.398 20 0 BEADRP c1[nH]c2ccccc2c1C[NH2+][C@H]1CCC[NH2+]CC1 ZINC001246242722 987646740 /nfs/dbraw/zinc/64/67/40/987646740.db2.gz GXSKFCNURLXKLO-ZDUSSCGKSA-N 2 0 243.354 2.400 20 0 BEADRP CCCC[C@@H]1C[C@H](NCCC(C)(C)[NH3+])CC[NH2+]1 ZINC001246271905 987665484 /nfs/dbraw/zinc/66/54/84/987665484.db2.gz JGHCJVOMSDHPLH-CHWSQXEVSA-N 3 0 241.423 2.014 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@H](c2ccncc2)C2CC2)CC[NH2+]1 ZINC001246279792 987672223 /nfs/dbraw/zinc/67/22/23/987672223.db2.gz QGMYWPLQPMECCO-UGFHNGPFSA-N 2 0 245.370 2.263 20 0 BEADRP C[C@H]1C[C@@H]([NH2+][C@@H]2C[C@H]2c2ccc(F)cc2)CC[NH2+]1 ZINC001246283662 987679309 /nfs/dbraw/zinc/67/93/09/987679309.db2.gz XENXYSUKPLCSPY-FBUXBERBSA-N 2 0 248.345 2.412 20 0 BEADRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccccc1N ZINC001246294484 987685086 /nfs/dbraw/zinc/68/50/86/987685086.db2.gz VUJHDDMDEMZPST-ACJTYDJDSA-N 2 0 245.370 2.202 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2C[C@H](C)[C@H](C)C2)CC1 ZINC001474370321 987703180 /nfs/dbraw/zinc/70/31/80/987703180.db2.gz XHFKPXATGCTOKO-BETUJISGSA-N 2 0 224.392 2.306 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@@H](C)CC(C)(C)SC ZINC001246312064 987711147 /nfs/dbraw/zinc/71/11/47/987711147.db2.gz FJUUUAUTIJYTOZ-UWVGGRQHSA-N 2 0 218.410 2.234 20 0 BEADRP CC[C@H]([NH3+])C[NH2+]C1CC(C)(C)OC(C)(C)C1 ZINC001246314024 987717492 /nfs/dbraw/zinc/71/74/92/987717492.db2.gz NAEPKSONKVFHRN-JTQLQIEISA-N 2 0 228.380 2.050 20 0 BEADRP [NH3+]CCc1cc2ccccc2n1[C@@H]1CCC[NH2+]C1 ZINC001246319787 987725441 /nfs/dbraw/zinc/72/54/41/987725441.db2.gz OMYWGKCTWFDCPG-CQSZACIVSA-N 2 0 243.354 2.067 20 0 BEADRP C[C@H]1C[C@@H](n2ccc3cccc(C[NH3+])c32)CC[NH2+]1 ZINC001246325900 987731457 /nfs/dbraw/zinc/73/14/57/987731457.db2.gz KISDGNYIKRWDEW-FZMZJTMJSA-N 2 0 243.354 2.413 20 0 BEADRP [NH3+]Cc1cccc2ccn([C@@H]3CCC[NH2+]C3)c21 ZINC001246327828 987735342 /nfs/dbraw/zinc/73/53/42/987735342.db2.gz VWAXIOZOJHBTPY-CYBMUJFWSA-N 2 0 229.327 2.025 20 0 BEADRP C[C@@H]1CC[C@@H](n2ccc3cccc(C[NH3+])c32)C[NH2+]1 ZINC001246327676 987735390 /nfs/dbraw/zinc/73/53/90/987735390.db2.gz UFECQAPVCAIQLH-BXUZGUMPSA-N 2 0 243.354 2.413 20 0 BEADRP CCC[C@H]([NH2+]C1CC[NH2+]CC1)c1ccncc1 ZINC001246328133 987735508 /nfs/dbraw/zinc/73/55/08/987735508.db2.gz WSVJGRJZOZPGAS-AWEZNQCLSA-N 2 0 233.359 2.264 20 0 BEADRP CCOCC[C@H](C)[NH2+][C@@]12CC[C@@]([NH3+])(C1)CCC2 ZINC001246343414 987751870 /nfs/dbraw/zinc/75/18/70/987751870.db2.gz XZXYKVDSLJNUMB-MJBXVCDLSA-N 2 0 240.391 2.195 20 0 BEADRP CCCC[C@H]1C[C@@H](NC(C)(C)CC[NH3+])CC[NH2+]1 ZINC001246357835 987767050 /nfs/dbraw/zinc/76/70/50/987767050.db2.gz ASTHAITYFFKGAQ-STQMWFEESA-N 2 0 241.423 2.014 20 0 BEADRP CCCC1([NH2+][C@H]2CC[NH2+][C@@H](C)C2)CCC1 ZINC001246390654 987780343 /nfs/dbraw/zinc/78/03/43/987780343.db2.gz YJWHDOPHOYMPIW-RYUDHWBXSA-N 2 0 210.365 2.439 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCc3ccccc32)CC[NH2+]1 ZINC001246421633 987793651 /nfs/dbraw/zinc/79/36/51/987793651.db2.gz SGSGQUMGIHZLLZ-SNPRPXQTSA-N 2 0 244.382 2.447 20 0 BEADRP CC[C@@H](C)C[C@@H](CC)[NH2+]CCCNCCC[NH3+] ZINC001246451889 987793665 /nfs/dbraw/zinc/79/36/65/987793665.db2.gz ICOGFOBAZNFFGY-ZIAGYGMSSA-N 2 0 243.439 2.119 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C[C@H]2CCc3ccccc32)CC[NH2+]1 ZINC001246421635 987795437 /nfs/dbraw/zinc/79/54/37/987795437.db2.gz SGSGQUMGIHZLLZ-YUELXQCFSA-N 2 0 244.382 2.447 20 0 BEADRP CCC[C@H](Cc1ccccc1)[NH2+][C@@H]1CC12C[NH2+]C2 ZINC001246445420 987801913 /nfs/dbraw/zinc/80/19/13/987801913.db2.gz OBKNGTSORBKMQX-HUUCEWRRSA-N 2 0 244.382 2.349 20 0 BEADRP C[C@H]1[C@H]2C[C@@H](C[C@H]1[NH2+]C1CC[NH2+]CC1)C2(C)C ZINC001246445329 987803675 /nfs/dbraw/zinc/80/36/75/987803675.db2.gz WYKIFZHYWSZNHX-CDGCEXEKSA-N 2 0 236.403 2.399 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CC23C[NH2+]C3)CC(C)(C)C1 ZINC001246446372 987804778 /nfs/dbraw/zinc/80/47/78/987804778.db2.gz RVUOZNJFFHKOGN-GRYCIOLGSA-N 2 0 222.376 2.153 20 0 BEADRP CCCCC[C@@H](CC)[NH2+]CCCNCCC[NH3+] ZINC001246452614 987810122 /nfs/dbraw/zinc/81/01/22/987810122.db2.gz KOKYVWBAWHWRTK-CQSZACIVSA-N 2 0 243.439 2.263 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]C[C@H]2C[NH+]3CCC2CC3)C1 ZINC001474735453 987814221 /nfs/dbraw/zinc/81/42/21/987814221.db2.gz PHRWVRCLQJLYOZ-VHDGCEQUSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H]1CCC[C@@H]([NH2+]C[C@@]2(C)CCC[NH2+]2)C1 ZINC001246457779 987816930 /nfs/dbraw/zinc/81/69/30/987816930.db2.gz UZIRCVZKLSUEEQ-YNEHKIRRSA-N 2 0 210.365 2.297 20 0 BEADRP CCC1CCC([NH2+][C@H]2C[C@H]([NH2+]C)C2)CC1 ZINC001246459838 987817009 /nfs/dbraw/zinc/81/70/09/987817009.db2.gz HAYOPRSBKSANRZ-VNOJIWKOSA-N 2 0 210.365 2.295 20 0 BEADRP c1ccc2c(c1)CCC[C@H]2C[NH2+][C@H]1CCCNC1 ZINC001246463369 987823524 /nfs/dbraw/zinc/82/35/24/987823524.db2.gz DIHSQBAFKFEACC-GJZGRUSLSA-N 2 0 244.382 2.448 20 0 BEADRP Cn1ccc2ccc(C[NH2+]C3CC[NH2+]CC3)cc21 ZINC001246470606 987829567 /nfs/dbraw/zinc/82/95/67/987829567.db2.gz NRNZHCGYUZYUFX-UHFFFAOYSA-N 2 0 243.354 2.020 20 0 BEADRP CCCCC[C@@H](C)[NH2+]C[C@@H]1CC[NH2+]C[C@@H]1F ZINC001246474858 987832691 /nfs/dbraw/zinc/83/26/91/987832691.db2.gz BVMYRJSPGLWMOR-AGIUHOORSA-N 2 0 230.371 2.492 20 0 BEADRP c1cc2c(s1)CC[C@H]2[NH2+]C1CC[NH2+]CC1 ZINC001246477086 987834301 /nfs/dbraw/zinc/83/43/01/987834301.db2.gz ZRYCJLZHNYBCLV-LLVKDONJSA-N 2 0 222.357 2.077 20 0 BEADRP CC1(C)[C@@H]2C[C@H]([NH2+][C@H]3CCCC[C@H]3[NH3+])C[C@@H]21 ZINC001246479252 987839307 /nfs/dbraw/zinc/83/93/07/987839307.db2.gz SONDHQYQMCNSNQ-MLGHIDQZSA-N 2 0 222.376 2.281 20 0 BEADRP CCC1CCC([NH2+][C@H]2C[C@@H]([NH2+]C)C2)CC1 ZINC001246494010 987846823 /nfs/dbraw/zinc/84/68/23/987846823.db2.gz HAYOPRSBKSANRZ-BPNZPQAUSA-N 2 0 210.365 2.295 20 0 BEADRP CC1(C)CC(C[NH2+][C@H]2CCCC[NH2+]C2)C1 ZINC001246496174 987850230 /nfs/dbraw/zinc/85/02/30/987850230.db2.gz DCFWNGXHPQANRI-LBPRGKRZSA-N 2 0 210.365 2.154 20 0 BEADRP C[NH2+][C@H]1C[C@@H]([NH2+]C2C[C@@H](C)C[C@H](C)C2)C1 ZINC001246494793 987850325 /nfs/dbraw/zinc/85/03/25/987850325.db2.gz HTBLJIUNSHFWBL-MRBYEJRBSA-N 2 0 210.365 2.151 20 0 BEADRP CCCC(C[NH3+])(CCC)N[C@@H]1CC[C@H](C)[NH2+]C1 ZINC001246498769 987853365 /nfs/dbraw/zinc/85/33/65/987853365.db2.gz XOUHKXUOCHXUIF-QWHCGFSZSA-N 2 0 241.423 2.014 20 0 BEADRP CCCCCC[C@H](C)[N@@H+]1CCO[C@H](CC[NH3+])C1 ZINC001246536659 987893205 /nfs/dbraw/zinc/89/32/05/987893205.db2.gz VULAOWJBJXVVDT-UONOGXRCSA-N 2 0 242.407 2.395 20 0 BEADRP CC(C)OCC[C@@H](C)[N@@H+]1CCC[C@H]([NH3+])CC1 ZINC001246538411 987897439 /nfs/dbraw/zinc/89/74/39/987897439.db2.gz BVMVTEZYKXIRQR-OLZOCXBDSA-N 2 0 228.380 2.003 20 0 BEADRP CC(C)COCC[C@@H](C)[NH+]1CCC(C[NH3+])CC1 ZINC001246537662 987899737 /nfs/dbraw/zinc/89/97/37/987899737.db2.gz JHGOCIJZWGYCMB-CYBMUJFWSA-N 2 0 242.407 2.108 20 0 BEADRP CCOC1CCC([N@@H+]2CCC[C@H]([NH3+])CC2)CC1 ZINC001246540003 987900952 /nfs/dbraw/zinc/90/09/52/987900952.db2.gz DXIKQFKBRPEYKH-HSBZDZAISA-N 2 0 240.391 2.147 20 0 BEADRP CO[C@@H]1CCC[C@@H]([N@@H+]2CCC[C@@](C)([NH3+])CC2)C1 ZINC001246546813 987925868 /nfs/dbraw/zinc/92/58/68/987925868.db2.gz AKRHKGCNEADANT-MGPQQGTHSA-N 2 0 240.391 2.147 20 0 BEADRP C[C@@H]1c2ccccc2CC[N@@H+]1C1CC[NH2+]CC1 ZINC001246547768 987927667 /nfs/dbraw/zinc/92/76/67/987927667.db2.gz NPZLGYJUTKSJAF-GFCCVEGCSA-N 2 0 230.355 2.358 20 0 BEADRP CCC(CC)[N@@H+]1CCC[C@@](F)(C[NH3+])CC1 ZINC001246549385 987938313 /nfs/dbraw/zinc/93/83/13/987938313.db2.gz MFFFJNKNWGKWEY-LBPRGKRZSA-N 2 0 216.344 2.328 20 0 BEADRP CC1(C)C[C@H]([N@@H+]2CCC[C@@](C)([NH3+])CC2)CCO1 ZINC001246552077 987949358 /nfs/dbraw/zinc/94/93/58/987949358.db2.gz NRBVZNCPKHXICI-TZMCWYRMSA-N 2 0 240.391 2.147 20 0 BEADRP CSCC[C@@H](C)[N@@H+]1CCC[C@@](C)([NH3+])CC1 ZINC001246552938 987951782 /nfs/dbraw/zinc/95/17/82/987951782.db2.gz QDXBDAMEBHOKGZ-VXGBXAGGSA-N 2 0 230.421 2.331 20 0 BEADRP C[C@H](CC1CC1)[N@@H+]1CCC[C@](F)(C[NH3+])CC1 ZINC001246552845 987952083 /nfs/dbraw/zinc/95/20/83/987952083.db2.gz VVDUYNXMIGZXFI-DGCLKSJQSA-N 2 0 228.355 2.328 20 0 BEADRP CC[C@@H]1C[C@@H]([N@@H+]2CCC[C@@](C)([NH3+])CC2)CCO1 ZINC001246551687 987952922 /nfs/dbraw/zinc/95/29/22/987952922.db2.gz MKFQZNDFZPNPCM-BFHYXJOUSA-N 2 0 240.391 2.147 20 0 BEADRP C[C@H](CC1CC1)[N@@H+]1CCC[C@@](F)(C[NH3+])CC1 ZINC001246552847 987953037 /nfs/dbraw/zinc/95/30/37/987953037.db2.gz VVDUYNXMIGZXFI-YPMHNXCESA-N 2 0 228.355 2.328 20 0 BEADRP CC1(C)C[C@H]([N@@H+]2CCC[C@](C)([NH3+])CC2)CCO1 ZINC001246552075 987955625 /nfs/dbraw/zinc/95/56/25/987955625.db2.gz NRBVZNCPKHXICI-OCCSQVGLSA-N 2 0 240.391 2.147 20 0 BEADRP CC1(C)CC[C@H]([N@@H+]2CCC(F)(F)[C@H](C[NH3+])C2)C1 ZINC001246553306 987960077 /nfs/dbraw/zinc/96/00/77/987960077.db2.gz AUEMDAXSVSUTQF-MNOVXSKESA-N 2 0 246.345 2.481 20 0 BEADRP CCC[C@H](C)[N@@H+]1CCC[C@](F)(C[NH3+])CC1 ZINC001246553601 987960316 /nfs/dbraw/zinc/96/03/16/987960316.db2.gz ZKEOBOMTQCNKBM-NWDGAFQWSA-N 2 0 216.344 2.328 20 0 BEADRP C[C@H]1CC[N@@H+](C2CCCC2)CC[C@H]1C[NH3+] ZINC001246558593 987973641 /nfs/dbraw/zinc/97/36/41/987973641.db2.gz MQPYQKBLGQPPRI-RYUDHWBXSA-N 2 0 210.365 2.236 20 0 BEADRP CC[C@@H]1CC[C@@H]([N@@H+]2CCC(F)(F)[C@H](C[NH3+])C2)C1 ZINC001246557584 987979232 /nfs/dbraw/zinc/97/92/32/987979232.db2.gz MIZWOROXXRCCCN-IJLUTSLNSA-N 2 0 246.345 2.481 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]Cc1ccc2cnccc2c1 ZINC001118020020 987985206 /nfs/dbraw/zinc/98/52/06/987985206.db2.gz SYFAVMMNPQSCCE-LBPRGKRZSA-N 2 0 243.354 2.180 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H](C)c1ccnc(Cl)c1 ZINC001118059791 987998092 /nfs/dbraw/zinc/99/80/92/987998092.db2.gz STQOJPSTTQKVSU-NXEZZACHSA-N 2 0 241.766 2.241 20 0 BEADRP C[C@H]1C[N@@H+](C2CCSCC2)CCC[C@@H]1C[NH3+] ZINC001246564956 988012467 /nfs/dbraw/zinc/01/24/67/988012467.db2.gz GWVNVMNDNQAXHU-NWDGAFQWSA-N 2 0 242.432 2.189 20 0 BEADRP CS[C@H]1CC[C@@H]([NH2+]C2CCC(C[NH3+])CC2)C1 ZINC001118118891 988019596 /nfs/dbraw/zinc/01/95/96/988019596.db2.gz KLIHEUQBRCOTFP-TUUUFIMRSA-N 2 0 242.432 2.378 20 0 BEADRP C[C@@H]1C[N@@H+]([C@H]2C[C@H]3C[C@H]3C2)CCC[C@@H]1C[NH3+] ZINC001246571770 988057318 /nfs/dbraw/zinc/05/73/18/988057318.db2.gz WYZLHAYFWBAYGA-POQQGIQPSA-N 2 0 222.376 2.092 20 0 BEADRP CCOCC[C@@H](C)[N@@H+]1CCC[C@@](C)(C[NH3+])CC1 ZINC001246571266 988058120 /nfs/dbraw/zinc/05/81/20/988058120.db2.gz AREYRNVZLFEHKS-ZIAGYGMSSA-N 2 0 242.407 2.252 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2CCC[C@@](C)(F)CC2)CC[NH2+]1 ZINC001246573131 988067490 /nfs/dbraw/zinc/06/74/90/988067490.db2.gz YUBYOFQTQWTFPD-JHJVBQTASA-N 2 0 228.355 2.341 20 0 BEADRP CC(C)OCC[C@H](C)[N@@H+]1CCCC[C@@H](C[NH3+])C1 ZINC001246584164 988119612 /nfs/dbraw/zinc/11/96/12/988119612.db2.gz SOQUJIIKDGVMBP-KBPBESRZSA-N 2 0 242.407 2.251 20 0 BEADRP Cc1cccc2c1CC[C@H]([NH+]1CC(C)(C[NH3+])C1)C2 ZINC001246588889 988158822 /nfs/dbraw/zinc/15/88/22/988158822.db2.gz LRMPTROAWKSOJL-AWEZNQCLSA-N 2 0 244.382 2.133 20 0 BEADRP CC1(C[NH3+])C[NH+](C2CC(C)(C)OC(C)(C)C2)C1 ZINC001246590394 988162693 /nfs/dbraw/zinc/16/26/93/988162693.db2.gz TZANLKJLQYCQJW-UHFFFAOYSA-N 2 0 240.391 2.003 20 0 BEADRP C[C@@H](Cc1ccccn1)[N@@H+]1CCCC[C@H](C[NH3+])C1 ZINC001246592532 988174398 /nfs/dbraw/zinc/17/43/98/988174398.db2.gz KBGCQTOZJRHHAP-UONOGXRCSA-N 2 0 247.386 2.073 20 0 BEADRP C[C@@]1(C[NH3+])CCCC[N@@H+]([C@H]2CCCOCC2)C1 ZINC001246593915 988182761 /nfs/dbraw/zinc/18/27/61/988182761.db2.gz OTSZHERGZFZJFL-KBPBESRZSA-N 2 0 240.391 2.006 20 0 BEADRP C[C@@H]1CC([NH+]2CC(C)(C[NH3+])C2)C[C@@H](C)C1 ZINC001246599703 988202749 /nfs/dbraw/zinc/20/27/49/988202749.db2.gz PWBHJUYAGIKRRD-QWRGUYRKSA-N 2 0 210.365 2.092 20 0 BEADRP C[NH2+]CC1C[NH+](C2CCC(C(C)C)CC2)C1 ZINC001246602288 988217707 /nfs/dbraw/zinc/21/77/07/988217707.db2.gz WHRCFFBWWJQKOW-UHFFFAOYSA-N 2 0 224.392 2.352 20 0 BEADRP CSCC[C@@H](C)[N@@H+]1CCC[C@@]12CCC[NH2+]C2 ZINC001246609744 988227237 /nfs/dbraw/zinc/22/72/37/988227237.db2.gz NAGCSMWTWLXONL-CHWSQXEVSA-N 2 0 242.432 2.346 20 0 BEADRP CCSC[C@@H](C)[N@@H+]1CCC[C@@]12CCC[NH2+]C2 ZINC001246609521 988229300 /nfs/dbraw/zinc/22/93/00/988229300.db2.gz LUTGYTPXUVUQAR-CHWSQXEVSA-N 2 0 242.432 2.346 20 0 BEADRP CC[C@@H]1CC[C@H]([NH+]2CCC(F)(C[NH3+])CC2)C1 ZINC001246618227 988248009 /nfs/dbraw/zinc/24/80/09/988248009.db2.gz HUZARURPTMILCM-NEPJUHHUSA-N 2 0 228.355 2.328 20 0 BEADRP CC1(C)[C@@H]2C[C@@H]([NH+]3CCC(F)(C[NH3+])CC3)C[C@@H]21 ZINC001246624820 988279870 /nfs/dbraw/zinc/27/98/70/988279870.db2.gz FRUMUDYXUIMBAV-CNDDSTCGSA-N 2 0 240.366 2.184 20 0 BEADRP C1CC12CCC([N@@H+]1CC[C@H]3[NH2+]CC[C@H]31)CC2 ZINC001246635028 988316679 /nfs/dbraw/zinc/31/66/79/988316679.db2.gz IZPAGBIJMMMLMM-CHWSQXEVSA-N 2 0 220.360 2.145 20 0 BEADRP CC[C@H]1CC[C@@H]([N@@H+]2CC[C@H]3[NH2+]CC[C@H]32)C1 ZINC001246640308 988342797 /nfs/dbraw/zinc/34/27/97/988342797.db2.gz SBRGLLAOYXLWIT-UMSGYPCISA-N 2 0 208.349 2.001 20 0 BEADRP CC[C@@H]1CC[C@@H]([N@@H+]2CC[C@@H]3[NH2+]CC[C@H]32)C1 ZINC001246644304 988358266 /nfs/dbraw/zinc/35/82/66/988358266.db2.gz SBRGLLAOYXLWIT-FVCCEPFGSA-N 2 0 208.349 2.001 20 0 BEADRP CCCC[C@@H](CC)[N@@H+]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC001246647288 988361382 /nfs/dbraw/zinc/36/13/82/988361382.db2.gz KABQJUBGNWPMEC-HZSPNIEDSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1C[C@@H]([N@H+]2C[C@H]3[C@H](CCC3(F)F)C2)CC[NH2+]1 ZINC001246656403 988385741 /nfs/dbraw/zinc/38/57/41/988385741.db2.gz NOJKRZHMJRVRJY-USZNOCQGSA-N 2 0 244.329 2.104 20 0 BEADRP CCCCC[C@@H](CC)[N@H+]1C[C@@H]2[C@H]([NH3+])[C@@H]2C1 ZINC001246657992 988387526 /nfs/dbraw/zinc/38/75/26/988387526.db2.gz BMGXNDCTDAUABS-FVCCEPFGSA-N 2 0 210.365 2.234 20 0 BEADRP CCCC[C@H](C)[N@@H+]1C[C@H]2CCC[C@@]2([NH3+])C1 ZINC001246658851 988388027 /nfs/dbraw/zinc/38/80/27/988388027.db2.gz AYDZLGPCTXSDMD-YNEHKIRRSA-N 2 0 210.365 2.378 20 0 BEADRP CC(C)(C)C1CCC([N@H+]2C[C@@H]3[C@H]([NH3+])[C@@H]3C2)CC1 ZINC001246665937 988406224 /nfs/dbraw/zinc/40/62/24/988406224.db2.gz VJERIBYKBCXEJA-MOIJGLSHSA-N 2 0 236.403 2.480 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2CC[C@H](c3ccncc3)C2)CC[NH2+]1 ZINC001246774104 988455302 /nfs/dbraw/zinc/45/53/02/988455302.db2.gz COTYVIFTYIEHGP-VHDGCEQUSA-N 2 0 245.370 2.011 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2CCCC3(C[NH2+]C3)C2)C[C@@H]1C ZINC001246792232 988468817 /nfs/dbraw/zinc/46/88/17/988468817.db2.gz ORBVMOXMLUWNIW-RDBSUJKOSA-N 2 0 236.403 2.497 20 0 BEADRP COC(C)(C)[C@@H]1CCC[N@@H+]1[C@H]1CC[NH2+][C@H](C)C1 ZINC001246811808 988497218 /nfs/dbraw/zinc/49/72/18/988497218.db2.gz XMXHUXTUYZPDAC-AGIUHOORSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@@H]1CC[N@@H+]([C@H]2CC[NH2+][C@H](C)C2)[C@H](C)C1 ZINC001246811409 988497907 /nfs/dbraw/zinc/49/79/07/988497907.db2.gz VELJTGIBRWVDFS-LPWJVIDDSA-N 2 0 210.365 2.247 20 0 BEADRP CC(C)C[C@H](C)C[C@H](C)N1CCO[C@@H](C[NH3+])C1 ZINC001246822522 988508895 /nfs/dbraw/zinc/50/88/95/988508895.db2.gz BKPBOBWWVZKDJI-IHRRRGAJSA-N 2 0 242.407 2.107 20 0 BEADRP CCCC(CCC)[N@@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1 ZINC001246846429 988552428 /nfs/dbraw/zinc/55/24/28/988552428.db2.gz NPDAZVZRNKDCEM-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP CCCCC[C@H](C)[N@H+]1C[C@H]2C[NH2+]CC[C@@H]2C1 ZINC001246845905 988557236 /nfs/dbraw/zinc/55/72/36/988557236.db2.gz NERUPRRCAVXVSR-BFHYXJOUSA-N 2 0 224.392 2.497 20 0 BEADRP CCCCC[C@H](C)[N@@H+]1C[C@H]2CC[C@@]2([NH3+])C1 ZINC001246857569 988590282 /nfs/dbraw/zinc/59/02/82/988590282.db2.gz AZWHTYFKLVCCOG-YNEHKIRRSA-N 2 0 210.365 2.378 20 0 BEADRP CC1(C)CCC([N@@H+]2C[C@H]3CC[C@@]3([NH3+])C2)CC1 ZINC001246859855 988595716 /nfs/dbraw/zinc/59/57/16/988595716.db2.gz KWMLIRXMHSHVCQ-BXUZGUMPSA-N 2 0 222.376 2.378 20 0 BEADRP CC(C)CC[C@H](C)[N@@H+]1C[C@@H]2CC[C@@]2([NH3+])C1 ZINC001246862124 988600032 /nfs/dbraw/zinc/60/00/32/988600032.db2.gz QBMRWEPKEWYPEA-RWMBFGLXSA-N 2 0 210.365 2.234 20 0 BEADRP C[NH2+]C[C@H]1CC[N@@H+]([C@@H](C)Cc2ccc(C)cc2)C1 ZINC001246863879 988607009 /nfs/dbraw/zinc/60/70/09/988607009.db2.gz LZQIQHZPHLTMDG-GOEBONIOSA-N 2 0 246.398 2.467 20 0 BEADRP C[C@@H]1C[C@@H](N2CCc3c(F)cccc3C2)CC[NH2+]1 ZINC001246863560 988612658 /nfs/dbraw/zinc/61/26/58/988612658.db2.gz QPRLIPPBQSKXJZ-YPMHNXCESA-N 2 0 248.345 2.324 20 0 BEADRP CC[C@@H](CC(C)C)[N@@H+]1CC[C@@H](C[NH2+]C)C1 ZINC001246866136 988622361 /nfs/dbraw/zinc/62/23/61/988622361.db2.gz ZXTQXFAZDOEERL-STQMWFEESA-N 2 0 212.381 2.352 20 0 BEADRP C[NH2+]CC[C@@H](C)[N@@H+]1Cc2ccccc2C[C@@H]1C ZINC001246874047 988632062 /nfs/dbraw/zinc/63/20/62/988632062.db2.gz UVBNDJVPWHJJTD-OLZOCXBDSA-N 2 0 232.371 2.431 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CCc2ccncc2)CC1(C)C ZINC001118856469 988654138 /nfs/dbraw/zinc/65/41/38/988654138.db2.gz XHPOPQOIXNODNA-AWEZNQCLSA-N 2 0 247.386 2.087 20 0 BEADRP CCC[N@H+](C1CCOCC1)[C@@H]1CC[NH2+][C@H](C)C1 ZINC001246900270 988674222 /nfs/dbraw/zinc/67/42/22/988674222.db2.gz UOTJSRDMYYEVPC-TZMCWYRMSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@@H]1CC[C@H]([N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)C1 ZINC001246935404 988758409 /nfs/dbraw/zinc/75/84/09/988758409.db2.gz VDBMWDDJAWCDJQ-MQYQWHSLSA-N 2 0 222.376 2.106 20 0 BEADRP C1[C@@H]2CC[NH2+]CC[C@@H]2C[N@H+]1C1CCCCC1 ZINC001246934291 988759004 /nfs/dbraw/zinc/75/90/04/988759004.db2.gz UAHDUYISEUCUFP-BETUJISGSA-N 2 0 222.376 2.251 20 0 BEADRP CC[C@H]1CCCC[N@@H+]1[C@H]1CC[NH2+][C@@H](C)C1 ZINC001246936585 988766155 /nfs/dbraw/zinc/76/61/55/988766155.db2.gz FMAHAOQRSOBZIB-AVGNSLFASA-N 2 0 210.365 2.391 20 0 BEADRP CCCCCC[C@@H](C)[N@H+](C)[C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001246951307 988788948 /nfs/dbraw/zinc/78/89/48/988788948.db2.gz ZWDXXSDBXKYWKQ-MQYQWHSLSA-N 2 0 224.392 2.495 20 0 BEADRP CC(C)CCC[C@H](C)[N@H+](C)[C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001246947498 988789704 /nfs/dbraw/zinc/78/97/04/988789704.db2.gz LETQSPRTROQNEE-IGQOVBAYSA-N 2 0 224.392 2.351 20 0 BEADRP CC[NH+](CC)C1CC[NH+](C[C@@H](C)COC)CC1 ZINC001324346183 988807893 /nfs/dbraw/zinc/80/78/93/988807893.db2.gz XSAKRRHXPGJWIA-CYBMUJFWSA-N 2 0 242.407 2.075 20 0 BEADRP CCCC[C@@H](CC(C)C)[N@H+]1C[C@@H](OC)[C@@H](N)C1 ZINC001246983847 988817095 /nfs/dbraw/zinc/81/70/95/988817095.db2.gz UONKNRCQWIKVQA-MELADBBJSA-N 2 0 242.407 2.249 20 0 BEADRP C[NH2+]CC[C@H](C)[N@H+](C)[C@H]1CC[C@H](C)CC1 ZINC001247003605 988838247 /nfs/dbraw/zinc/83/82/47/988838247.db2.gz MXHAIUGQRLFYNB-AVGNSLFASA-N 2 0 212.381 2.495 20 0 BEADRP C[C@@H]1CC[C@H](N2CC[C@@H]3[NH2+]CCC[C@@H]3C2)C1 ZINC001247016395 988843594 /nfs/dbraw/zinc/84/35/94/988843594.db2.gz USGLBMIEVVDJPB-MQYQWHSLSA-N 2 0 222.376 2.249 20 0 BEADRP CC(C)(CNc1cc[nH+]cc1)C[NH+]1CCCC1 ZINC001515204620 989002935 /nfs/dbraw/zinc/00/29/35/989002935.db2.gz KFZCDGSMCDSQKW-UHFFFAOYSA-N 2 0 233.359 2.037 20 0 BEADRP Cc1cccnc1C[NH2+]CCCC[N@@H+](C)C1CC1 ZINC001325317429 989155376 /nfs/dbraw/zinc/15/53/76/989155376.db2.gz AOJCCORYLUKAKB-UHFFFAOYSA-N 2 0 247.386 2.354 20 0 BEADRP [NH3+]CCCC[NH2+]Cc1cnc2ccccc2c1 ZINC001325627685 989222204 /nfs/dbraw/zinc/22/22/04/989222204.db2.gz VLHZPUCWBUZSPT-UHFFFAOYSA-N 2 0 229.327 2.063 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H]1CC[C@H]1C1CCC1 ZINC001325722340 989242686 /nfs/dbraw/zinc/24/26/86/989242686.db2.gz MCGGUWCEISTOCR-KGYLQXTDSA-N 2 0 210.365 2.153 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]C1C2CC3CC(C2)CC1C3 ZINC001325722916 989242783 /nfs/dbraw/zinc/24/27/83/989242783.db2.gz PIJWBLYJNOVPBM-IBEXFIOLSA-N 2 0 236.403 2.399 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H]1CC[C@@H]1C1CCC1 ZINC001325722354 989243252 /nfs/dbraw/zinc/24/32/52/989243252.db2.gz MCGGUWCEISTOCR-RTXFEEFZSA-N 2 0 210.365 2.153 20 0 BEADRP Cc1cc(N[C@H]2CCCC[C@@H]2[NH+](C)C)cc[nH+]1 ZINC001325777743 989257970 /nfs/dbraw/zinc/25/79/70/989257970.db2.gz YFNLOZXHQSTKOU-KBPBESRZSA-N 2 0 233.359 2.097 20 0 BEADRP C[C@@H]1C[C@@H]1[C@H]1C[C@@H]1C[NH2+]C1CCC(C[NH3+])CC1 ZINC001119630473 989267532 /nfs/dbraw/zinc/26/75/32/989267532.db2.gz FSAXXVWDDWFHGA-JPKGQRBZSA-N 2 0 236.403 2.386 20 0 BEADRP CCC1(CC)[C@H]([NH2+]CC[C@@H](C)[NH2+]C)C[C@H]1OC ZINC001326037030 989336569 /nfs/dbraw/zinc/33/65/69/989336569.db2.gz UPRDWGANCDBBQT-JHJVBQTASA-N 2 0 242.407 2.168 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+][C@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C ZINC001119699007 989343569 /nfs/dbraw/zinc/34/35/69/989343569.db2.gz GZKJDUKXRPRXJD-BNDIWNMDSA-N 2 0 222.376 2.151 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+][C@H]1CCC[C@@H](F)C1 ZINC001119699098 989345398 /nfs/dbraw/zinc/34/53/98/989345398.db2.gz JBCFMADWUFBSHC-NURACPHSSA-N 2 0 240.366 2.373 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H]1CC[C@H]1C(C)(C)C ZINC001326474135 989569891 /nfs/dbraw/zinc/56/98/91/989569891.db2.gz SNLBDURIBAEZCH-UTUOFQBUSA-N 2 0 212.381 2.399 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@H]1[C@H](C)CCC[C@@H]1C ZINC001326472532 989572838 /nfs/dbraw/zinc/57/28/38/989572838.db2.gz AJYDABSZHPZNDT-QNWHQSFQSA-N 2 0 212.381 2.399 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H]1[C@H](C)CCC[C@@H]1C ZINC001326472534 989575224 /nfs/dbraw/zinc/57/52/24/989575224.db2.gz AJYDABSZHPZNDT-XQHKEYJVSA-N 2 0 212.381 2.399 20 0 BEADRP CC1([NH+]2CCC2)CCC(Nc2cc[nH+]cc2)CC1 ZINC001120790721 989882023 /nfs/dbraw/zinc/88/20/23/989882023.db2.gz KENNGBASDWCWBF-UHFFFAOYSA-N 2 0 245.370 2.322 20 0 BEADRP C[C@@H]1CC[N@@H+]1Cc1ccc(OCC[NH+](C)C)cc1 ZINC001138769270 991032947 /nfs/dbraw/zinc/03/29/47/991032947.db2.gz MMRNUECDKBYZRJ-CYBMUJFWSA-N 2 0 248.370 2.221 20 0 BEADRP C[C@@H]1CC(NC(=[NH2+])SCC[NH3+])C[C@@H](C)C1 ZINC001258151762 991034038 /nfs/dbraw/zinc/03/40/38/991034038.db2.gz NLCDALBIMQFMIJ-IUCAKERBSA-N 2 0 229.393 2.027 20 0 BEADRP CCC(CC)C[NH2+][C@@H]1CC[C@H]2C[N@H+](C)C[C@@H]21 ZINC001308554269 991036528 /nfs/dbraw/zinc/03/65/28/991036528.db2.gz NPJMDGMEQZUKHS-MELADBBJSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@H]1CC([N@H+]2C[C@H]3C[NH+](C)C[C@H]3C2)C[C@H](C)C1 ZINC001258169136 991066120 /nfs/dbraw/zinc/06/61/20/991066120.db2.gz USXDQRYXSJLCJA-SYQHCUMBSA-N 2 0 236.403 2.305 20 0 BEADRP CSCC[C@H](C)[N@H+](CCC[NH3+])C(C)C ZINC001258200048 991115675 /nfs/dbraw/zinc/11/56/75/991115675.db2.gz OMUVNRFJTADUCI-NSHDSACASA-N 2 0 218.410 2.187 20 0 BEADRP CCCCN(C)CC[NH2+][C@H](C)CCSC ZINC001258199299 991115352 /nfs/dbraw/zinc/11/53/52/991115352.db2.gz FCNZUWLZGMCWMV-GFCCVEGCSA-N 2 0 232.437 2.450 20 0 BEADRP CSCC[C@H](C)[NH2+]CCCCC[NH+](C)C ZINC001258200344 991116042 /nfs/dbraw/zinc/11/60/42/991116042.db2.gz TWNVNAWOBTVBOR-LBPRGKRZSA-N 2 0 232.437 2.450 20 0 BEADRP CSCC[C@@H](C)[NH2+]CCCCC[NH+](C)C ZINC001258200343 991116530 /nfs/dbraw/zinc/11/65/30/991116530.db2.gz TWNVNAWOBTVBOR-GFCCVEGCSA-N 2 0 232.437 2.450 20 0 BEADRP CC(C)C1(C[N@@H+]2C[C@H]3C[NH+](C)C[C@@]3(C)C2)CC1 ZINC001308959766 991234469 /nfs/dbraw/zinc/23/44/69/991234469.db2.gz DMUKADCTADHFAX-KGLIPLIRSA-N 2 0 236.403 2.306 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[C@H]2C[N@H+](C)C[C@@H]21 ZINC001560622562 991526415 /nfs/dbraw/zinc/52/64/15/991526415.db2.gz KSRMRUOLXDYHLW-IKOXMDCHSA-N 2 0 222.376 2.105 20 0 BEADRP C[C@H](Cc1cccnc1)[NH2+]C(C)(C)CC[NH+](C)C ZINC001258614766 991541013 /nfs/dbraw/zinc/54/10/13/991541013.db2.gz VQBFOBCMNZIGKW-CYBMUJFWSA-N 2 0 249.402 2.333 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2CC[C@H](C)[C@@H](F)C2)CC1 ZINC001560708081 991570336 /nfs/dbraw/zinc/57/03/36/991570336.db2.gz BATLXMGYRLGXNN-JSGCOSHPSA-N 2 0 242.382 2.398 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCSCC[NH3+])CC(C)(C)C1 ZINC001258690174 991623043 /nfs/dbraw/zinc/62/30/43/991623043.db2.gz PEXOVQATZCRBEV-NEPJUHHUSA-N 2 0 244.448 2.483 20 0 BEADRP CCC[NH+]1CCC(Nc2cccc(C[NH3+])c2)CC1 ZINC001258764751 991726708 /nfs/dbraw/zinc/72/67/08/991726708.db2.gz BLAOVKKVYFJILE-UHFFFAOYSA-N 2 0 247.386 2.432 20 0 BEADRP CCC[NH+]1CCC(n2cccc2CC[NH3+])CC1 ZINC001258768426 991733643 /nfs/dbraw/zinc/73/36/43/991733643.db2.gz MZIGCIBEWNRYHM-UHFFFAOYSA-N 2 0 235.375 2.036 20 0 BEADRP CC[C@H](C[C@@H](C)CC)NC(=[NH2+])SCC[NH3+] ZINC001258780578 991751784 /nfs/dbraw/zinc/75/17/84/991751784.db2.gz PIIKMBUUPZHGSC-VHSXEESVSA-N 2 0 231.409 2.417 20 0 BEADRP C[C@H]1CCC[C@H]([NH2+][C@H]2CCC[C@H]([NH3+])C2)C1 ZINC001258813177 991820493 /nfs/dbraw/zinc/82/04/93/991820493.db2.gz BWEDVWQSUBGHHW-CYDGBPFRSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@H]1CCC[C@H]([N@@H+]2C[C@H]3CC[NH+](C)C[C@H]3C2)C1 ZINC001258819999 991841618 /nfs/dbraw/zinc/84/16/18/991841618.db2.gz JEKPQAPIGSKRIY-XGUBFFRZSA-N 2 0 236.403 2.449 20 0 BEADRP C[C@@H]1CCC[C@H]([N@@H+]2C[C@H]3CC[NH+](C)C[C@H]3C2)C1 ZINC001258819997 991843256 /nfs/dbraw/zinc/84/32/56/991843256.db2.gz JEKPQAPIGSKRIY-KBXIAJHMSA-N 2 0 236.403 2.449 20 0 BEADRP C[C@@H]1CCC[C@@H]([N@@H+]2C[C@H]3C[C@@]3(C[NH+](C)C)C2)C1 ZINC001258827014 991849750 /nfs/dbraw/zinc/84/97/50/991849750.db2.gz GJJRVLBQMOLHMB-KBUPBQIOSA-N 2 0 236.403 2.449 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)n1nccc1C[NH3+] ZINC001258897463 991891222 /nfs/dbraw/zinc/89/12/22/991891222.db2.gz KDYKGJHWAKPBBS-GFCCVEGCSA-N 2 0 238.379 2.025 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H](CO)C(C)C ZINC001258896264 991892621 /nfs/dbraw/zinc/89/26/21/991892621.db2.gz JTWXWDCIRXWHBX-KBPBESRZSA-N 2 0 244.423 2.103 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+]C(C)(C)C(C)=O ZINC001258898480 991892936 /nfs/dbraw/zinc/89/29/36/991892936.db2.gz YEKPMQBVNLTFOF-LBPRGKRZSA-N 2 0 242.407 2.454 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+]C(C)(C)CCO ZINC001258899984 991895973 /nfs/dbraw/zinc/89/59/73/991895973.db2.gz XLBQILBJFAFAQR-ZDUSSCGKSA-N 2 0 244.423 2.248 20 0 BEADRP CCOC1C[NH+]([C@@H](C)CCC[NH+](CC)CC)C1 ZINC001258907317 991899811 /nfs/dbraw/zinc/89/98/11/991899811.db2.gz IPZDFNVXRPRLBA-ZDUSSCGKSA-N 2 0 242.407 2.218 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]Cc1cc(F)ccc1C ZINC001261370935 992280541 /nfs/dbraw/zinc/28/05/41/992280541.db2.gz ZENPRGWCOMLQIR-NSHDSACASA-N 2 0 224.323 2.222 20 0 BEADRP Cc1csc(CCC[NH2+][C@H](C)C[C@@H](C)[NH3+])n1 ZINC001261423315 992294029 /nfs/dbraw/zinc/29/40/29/992294029.db2.gz SXLDABMBUHXRGU-NXEZZACHSA-N 2 0 241.404 2.100 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H]1CCC12CCCC2 ZINC001261424062 992294728 /nfs/dbraw/zinc/29/47/28/992294728.db2.gz MGQXDUNXMQJFPR-NEPJUHHUSA-N 2 0 210.365 2.297 20 0 BEADRP [NH3+]CC1CCC([NH2+]C/C=C\C2CC2)CC1 ZINC001261424012 992295146 /nfs/dbraw/zinc/29/51/46/992295146.db2.gz LDRHLRFSMNGRLT-UPHRSURJSA-N 2 0 208.349 2.060 20 0 BEADRP [NH3+]CC1CCC([NH2+]CC[C@H]2CCSC2)CC1 ZINC001261903638 992568711 /nfs/dbraw/zinc/56/87/11/992568711.db2.gz GELBLBMHGQWOFJ-CPCZMJQVSA-N 2 0 242.432 2.237 20 0 BEADRP CC1=CCC[C@H](C)[C@H]1C[NH2+][C@@]1(C)CC[NH2+]C1 ZINC001573624539 992653667 /nfs/dbraw/zinc/65/36/67/992653667.db2.gz DFANJODFGQYOCM-IHRRRGAJSA-N 2 0 222.376 2.320 20 0 BEADRP Cc1occc1C[NH+]1CCC([C@H]2C[C@@H]2[NH3+])CC1 ZINC001574207998 992820891 /nfs/dbraw/zinc/82/08/91/992820891.db2.gz KKOUUCXTHDSPDE-KGLIPLIRSA-N 2 0 234.343 2.147 20 0 BEADRP [NH3+]C1CC[NH+](C[C@@H]2C[C@@H]2c2ccccc2)CC1 ZINC001574271016 992836083 /nfs/dbraw/zinc/83/60/83/992836083.db2.gz WTAYFLBGPOKORW-DZGCQCFKSA-N 2 0 230.355 2.213 20 0 BEADRP C(C[N@@H+]1CC[C@@H](C2CCC2)C1)[C@H]1CC[NH2+]C1 ZINC001574773963 992899190 /nfs/dbraw/zinc/89/91/90/992899190.db2.gz HNPIXMNJYDCNHK-TZMCWYRMSA-N 2 0 222.376 2.108 20 0 BEADRP C1=C[C@H](CCC[NH2+]CC2CC[NH2+]CC2)CC1 ZINC001574775187 992902303 /nfs/dbraw/zinc/90/23/03/992902303.db2.gz XKQSNHGQWKSJKD-ZDUSSCGKSA-N 2 0 222.376 2.322 20 0 BEADRP C([NH2+][C@@H]1C[C@H]2CCC[C@@H]21)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC001574795345 992909585 /nfs/dbraw/zinc/90/95/85/992909585.db2.gz MJKOLJSNYYXOFH-FKENJMTJSA-N 2 0 234.387 2.295 20 0 BEADRP C([NH2+][C@@]12CCC[C@@H]1[NH2+]CC2)[C@@H]1CC[C@H]2C[C@H]2C1 ZINC001574795110 992909942 /nfs/dbraw/zinc/90/99/42/992909942.db2.gz LCGKOWWMEVQSOA-QKGCVVFFSA-N 2 0 234.387 2.297 20 0 BEADRP C(C1CC1)[N@H+](CC1C[NH2+]C1)C1CCCCC1 ZINC001574795966 992911295 /nfs/dbraw/zinc/91/12/95/992911295.db2.gz RKSGBUWGJIUGNP-UHFFFAOYSA-N 2 0 222.376 2.251 20 0 BEADRP CC(C)(C)[C@@H]1CCC[N@@H+]1C[C@@]12C[C@@H]1C[NH2+]C2 ZINC001575120254 992989055 /nfs/dbraw/zinc/98/90/55/992989055.db2.gz SJKHKGLQXYGZOJ-DYEKYZERSA-N 2 0 222.376 2.106 20 0 BEADRP CC(C)(C)CC[C@H]([NH3+])C[NH2+]CCC1(O)CCC1 ZINC001575131368 992994120 /nfs/dbraw/zinc/99/41/20/992994120.db2.gz UBSZFMGEKKDRJA-LBPRGKRZSA-N 2 0 242.407 2.035 20 0 BEADRP CC(C)(C)CC[C@@H]([NH3+])C[NH2+]CCC1(O)CCC1 ZINC001575131366 992994944 /nfs/dbraw/zinc/99/49/44/992994944.db2.gz UBSZFMGEKKDRJA-GFCCVEGCSA-N 2 0 242.407 2.035 20 0 BEADRP CC(C)(CC(F)(F)F)[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC001575297691 993002837 /nfs/dbraw/zinc/00/28/37/993002837.db2.gz IPKDJZWMQXNAKU-SECBINFHSA-N 2 0 238.297 2.307 20 0 BEADRP Cc1cc(F)cc(N[C@@H](C)CC[NH+](C)C)n1 ZINC001262680441 993020598 /nfs/dbraw/zinc/02/05/98/993020598.db2.gz CSHBKPIKWAZNGL-VIFPVBQESA-N 2 0 225.311 2.281 20 0 BEADRP CC(C)C([NH2+]C[C@@H]1C[NH2+]C[C@H]1C)C(C)C ZINC001575473343 993054473 /nfs/dbraw/zinc/05/44/73/993054473.db2.gz TYYJFVDLFZSHFT-NEPJUHHUSA-N 2 0 212.381 2.112 20 0 BEADRP CC(C)[C@H]1CCC[C@H]1[NH2+][C@H]1CC[NH2+][C@@H]1C ZINC001575498643 993056663 /nfs/dbraw/zinc/05/66/63/993056663.db2.gz NESMMTZNWRKVQZ-FVCCEPFGSA-N 2 0 210.365 2.151 20 0 BEADRP CC(C)[C@@H]1CCCCC[N@@H+]1C[C@@]12C[C@@H]1C[NH2+]C2 ZINC001575499619 993058439 /nfs/dbraw/zinc/05/84/39/993058439.db2.gz FLNIKPYYVQADEF-ILXRZTDVSA-N 2 0 236.403 2.497 20 0 BEADRP CC(C)C[C@@H]1CCC[N@H+](C[C@]23C[C@H]2C[NH2+]C3)C1 ZINC001575549351 993069424 /nfs/dbraw/zinc/06/94/24/993069424.db2.gz GOHPWCSJTZPCHQ-SOUVJXGZSA-N 2 0 236.403 2.354 20 0 BEADRP CC(C)CSCCC[N@H+](C)C1CC([NH3+])C1 ZINC001575617726 993083697 /nfs/dbraw/zinc/08/36/97/993083697.db2.gz QNKMTYAKBIOGRY-UHFFFAOYSA-N 2 0 230.421 2.187 20 0 BEADRP CC(C)COc1ccccc1C[NH2+]C/C=C\C[NH3+] ZINC001575617867 993087093 /nfs/dbraw/zinc/08/70/93/993087093.db2.gz UVRNOIPGXCMRSS-WAYWQWQTSA-N 2 0 248.370 2.326 20 0 BEADRP CC(C)C[C@@H]1C[C@H]1[NH2+][C@@H]1C[C@H]([NH3+])C1(C)C ZINC001575633497 993088894 /nfs/dbraw/zinc/08/88/94/993088894.db2.gz BMHFOVHSGNRHMO-WISYIIOYSA-N 2 0 210.365 2.136 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C1CC(OC(C)(C)C)C1 ZINC001575943081 993132513 /nfs/dbraw/zinc/13/25/13/993132513.db2.gz MZHKOEHCPGCZCX-PNESKVBLSA-N 2 0 242.407 2.440 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]C/C=C\c1cccc(F)c1 ZINC001575987490 993150721 /nfs/dbraw/zinc/15/07/21/993150721.db2.gz HVBLPFQIEFKTEK-USEMIUTHSA-N 2 0 222.307 2.023 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[NH2+]C[C@H]1C)[C@H]1CC2CCC1CC2 ZINC001576252807 993233353 /nfs/dbraw/zinc/23/33/53/993233353.db2.gz TZXOBTRFCQTNRF-RSUORJDLSA-N 2 0 236.403 2.399 20 0 BEADRP CC1(C)C(C)(C)C1(C)[NH2+]C[C@@]12C[C@@H]1C[NH2+]C2 ZINC001576366077 993277842 /nfs/dbraw/zinc/27/78/42/993277842.db2.gz UVGOSHYLKNMDHK-YGRLFVJLSA-N 2 0 222.376 2.010 20 0 BEADRP Cc1sccc1C[NH+]1CCC(C[NH3+])CC1 ZINC000379846577 993283596 /nfs/dbraw/zinc/28/35/96/993283596.db2.gz HZPYKCLQDQGWQD-UHFFFAOYSA-N 2 0 224.373 2.227 20 0 BEADRP CC1(C)CC[C@H](C[NH2+]C[C@H]2CCSC2)[NH2+]C1 ZINC001576421068 993300220 /nfs/dbraw/zinc/30/02/20/993300220.db2.gz DSWDSVTVIQEPEG-VXGBXAGGSA-N 2 0 242.432 2.107 20 0 BEADRP CC1(C)C[NH2+]C[C@@H]1[NH2+]C[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC001576477169 993315029 /nfs/dbraw/zinc/31/50/29/993315029.db2.gz REOMWOYHVBLWRN-NDBYEHHHSA-N 2 0 222.376 2.010 20 0 BEADRP Cc1ncsc1C[N@@H+]1CCCC[C@@H](C[NH3+])C1 ZINC000380752191 993344063 /nfs/dbraw/zinc/34/40/63/993344063.db2.gz UJJFVYNHAKHNKF-NSHDSACASA-N 2 0 239.388 2.012 20 0 BEADRP C[C@@H]1CC(C)(C)C[N@@H+]1CCC[NH2+]C1CC1 ZINC001576590140 993352940 /nfs/dbraw/zinc/35/29/40/993352940.db2.gz ZDJIAUAKLMTLSY-LLVKDONJSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@H]1CC(C)(C)CC[C@H]1[NH2+][C@H]1C[C@@H]([NH3+])C1 ZINC001576588576 993359716 /nfs/dbraw/zinc/35/97/16/993359716.db2.gz BUKAKPVVHFVGJM-NNYUYHANSA-N 2 0 210.365 2.281 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@@H]2C[C@@H]2C2CC2)CC1 ZINC000381521475 993402504 /nfs/dbraw/zinc/40/25/04/993402504.db2.gz UUYAJXYOOYODGT-ZIAGYGMSSA-N 2 0 222.376 2.247 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+][C@@H](C)C1CC1 ZINC000382356214 993446173 /nfs/dbraw/zinc/44/61/73/993446173.db2.gz IJGQKTAKXYVQMR-RYUDHWBXSA-N 2 0 212.381 2.495 20 0 BEADRP C[C@H](Cc1ccco1)[N@@H+]1CCCC[C@@H](C[NH3+])C1 ZINC000383652631 993507455 /nfs/dbraw/zinc/50/74/55/993507455.db2.gz DVOCYRQVWNACQJ-OLZOCXBDSA-N 2 0 236.359 2.271 20 0 BEADRP C[C@H](Cc1ccco1)[N@@H+]1CCCC[C@H](C[NH3+])C1 ZINC000383652629 993510192 /nfs/dbraw/zinc/51/01/92/993510192.db2.gz DVOCYRQVWNACQJ-CHWSQXEVSA-N 2 0 236.359 2.271 20 0 BEADRP CCC(O)(CC)C(C)(C)C[NH2+]CC(C)(C)C[NH3+] ZINC001577179151 993534642 /nfs/dbraw/zinc/53/46/42/993534642.db2.gz FFICBODXVOFJRC-UHFFFAOYSA-N 2 0 244.423 2.138 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@H]2CCC[NH2+][C@@H]2C)C1 ZINC000384206569 993558171 /nfs/dbraw/zinc/55/81/71/993558171.db2.gz BUJKILLMWRIDJM-LPWJVIDDSA-N 2 0 210.365 2.153 20 0 BEADRP CC/C=C/CC[NH+]1CCC(OCCC[NH3+])CC1 ZINC001577312770 993585415 /nfs/dbraw/zinc/58/54/15/993585415.db2.gz MEKGYYQLZIPCCU-ONEGZZNKSA-N 2 0 240.391 2.173 20 0 BEADRP Cc1ccc(C)c(C[N@H+]2CC[NH2+]C[C@H](C)C2)c1 ZINC000385299374 993656713 /nfs/dbraw/zinc/65/67/13/993656713.db2.gz KPWVWEHBRDUOAC-ZDUSSCGKSA-N 2 0 232.371 2.345 20 0 BEADRP CCCCO[C@@H]1C[C@@H]([NH2+]C/C=C/C[NH3+])C1(C)C ZINC001577463372 993668725 /nfs/dbraw/zinc/66/87/25/993668725.db2.gz UWYNOBOIUVSVNB-AMRKSYTLSA-N 2 0 240.391 2.075 20 0 BEADRP CCCSC[C@@H](C)[NH2+]CCC1(C[NH3+])CC1 ZINC001577596700 993689913 /nfs/dbraw/zinc/68/99/13/993689913.db2.gz DBKFXWNJCGXJLR-LLVKDONJSA-N 2 0 230.421 2.237 20 0 BEADRP CN(C)[C@H](C[NH2+]C1CC(C)(C)C1)C1CC1 ZINC000389908435 993766802 /nfs/dbraw/zinc/76/68/02/993766802.db2.gz IAHDRINDUNYUHG-GFCCVEGCSA-N 2 0 210.365 2.105 20 0 BEADRP C[N@@H+]1CC[C@H](C[NH2+]C2CCC3(CC3)CC2)C1 ZINC000390470474 993791653 /nfs/dbraw/zinc/79/16/53/993791653.db2.gz JCERMHZNRUMCNO-GFCCVEGCSA-N 2 0 222.376 2.251 20 0 BEADRP [NH3+]C[C@@H]1CCCC[N@H+](CCc2cccs2)C1 ZINC000390470307 993792495 /nfs/dbraw/zinc/79/24/95/993792495.db2.gz HCAXZRDXPYYVTC-LBPRGKRZSA-N 2 0 238.400 2.351 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C2CCC(C[NH3+])CC2)CCS1 ZINC001332419409 994087336 /nfs/dbraw/zinc/08/73/36/994087336.db2.gz CVDYVIGCJMRKQA-XVSSEFHLSA-N 2 0 242.432 2.378 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+]C[C@@H]2CCc3ccccc32)C1 ZINC001334754631 994627802 /nfs/dbraw/zinc/62/78/02/994627802.db2.gz QBGSSEMGCBSDME-FPMFFAJLSA-N 2 0 230.355 2.043 20 0 BEADRP C[NH+](C)[C@@H]1CC[C@H]2C[N@H+](CC3CC3)C[C@@H]2C1 ZINC001335584631 994818831 /nfs/dbraw/zinc/81/88/31/994818831.db2.gz WXKFMLDIXIFISH-MELADBBJSA-N 2 0 222.376 2.059 20 0 BEADRP C[C@H](CCC1CC1)[NH2+][C@@H]1CC[C@H]2C[N@H+](C)C[C@H]21 ZINC001621570548 1170164144 /nfs/dbraw/zinc/16/41/44/1170164144.db2.gz XACUCJSLKICMMB-FAAHXZRKSA-N 2 0 236.403 2.495 20 0 BEADRP CCc1ccc(C[N@H+](C)CCCC[NH3+])cc1 ZINC000036198785 1170912289 /nfs/dbraw/zinc/91/22/89/1170912289.db2.gz SKBMLJLJTCTFHU-UHFFFAOYSA-N 2 0 220.360 2.420 20 0 BEADRP CCCC[N@H+](CC)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000040747537 1171153161 /nfs/dbraw/zinc/15/31/61/1171153161.db2.gz BJATXMDWIRXQAI-FUNVUKJBSA-N 2 0 210.365 2.391 20 0 BEADRP CC(C)CC[C@@H](C)[NH+]1CCC(C[NH3+])CC1 ZINC000044512116 1171386938 /nfs/dbraw/zinc/38/69/38/1171386938.db2.gz WDBGQCKDSBKKRM-GFCCVEGCSA-N 2 0 212.381 2.482 20 0 BEADRP CC[NH+](CC)C[C@@H](O)C[NH2+]C1(C)CCCCC1 ZINC000045045445 1171432409 /nfs/dbraw/zinc/43/24/09/1171432409.db2.gz FGVNSFYUIMFSTF-ZDUSSCGKSA-N 2 0 242.407 2.002 20 0 BEADRP CC[NH+](CC)C[C@H](O)C[NH2+]C1(C)CCCCC1 ZINC000045045443 1171432908 /nfs/dbraw/zinc/43/29/08/1171432908.db2.gz FGVNSFYUIMFSTF-CYBMUJFWSA-N 2 0 242.407 2.002 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+]CCCCCO ZINC000051020632 1171864187 /nfs/dbraw/zinc/86/41/87/1171864187.db2.gz SOEHRHUPGQYLCJ-AWEZNQCLSA-N 2 0 244.423 2.249 20 0 BEADRP CC[C@H]1CO[C@@H](C)C[N@@H+]1CC(CC)(CC)C[NH3+] ZINC000051257658 1171887923 /nfs/dbraw/zinc/88/79/23/1171887923.db2.gz SJPFQSAYWLHHBV-STQMWFEESA-N 2 0 242.407 2.251 20 0 BEADRP CC[C@@H]1CO[C@@H](C)C[N@@H+]1CC(CC)(CC)C[NH3+] ZINC000051257656 1171889622 /nfs/dbraw/zinc/88/96/22/1171889622.db2.gz SJPFQSAYWLHHBV-QWHCGFSZSA-N 2 0 242.407 2.251 20 0 BEADRP CCC[C@H](C)C[N@@H+]1C[C@H](C[NH3+])CC[C@@H]1C ZINC000051321022 1171893934 /nfs/dbraw/zinc/89/39/34/1171893934.db2.gz ILTCSGLOPJDUCO-AVGNSLFASA-N 2 0 212.381 2.482 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+]C[C@@H](C)Cc1ccccc1 ZINC000414994223 398137846 /nfs/dbraw/zinc/13/78/46/398137846.db2.gz UOFOSMXCIINPDO-GXTWGEPZSA-N 2 0 220.360 2.192 20 0 BEADRP CC[NH+](CC)CCC[N@@H+]1C[C@H](C)C[C@@H]1C ZINC000548918496 398139110 /nfs/dbraw/zinc/13/91/10/398139110.db2.gz AWNOTSNGIQMCNR-OLZOCXBDSA-N 2 0 212.381 2.449 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCC[NH+]2CCCCC2)[C@H]1C ZINC000309324725 136210494 /nfs/dbraw/zinc/21/04/94/136210494.db2.gz HVWPKVJHRBRKAZ-RDBSUJKOSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1cc(C[N@H+]2CC[C@@H]([C@H](C)[NH3+])C2)ccc1F ZINC000228152194 178000205 /nfs/dbraw/zinc/00/02/05/178000205.db2.gz HIWVPSGJCIQHNE-WCQYABFASA-N 2 0 236.334 2.303 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H](C)C1CC1 ZINC000422942354 398159877 /nfs/dbraw/zinc/15/98/77/398159877.db2.gz PLDJAMFYQPESSH-VHSXEESVSA-N 2 0 233.359 2.298 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]CCCc1cccc(F)c1 ZINC000422906934 398157028 /nfs/dbraw/zinc/15/70/28/398157028.db2.gz KOYTVEXVBNOUNC-LBPRGKRZSA-N 2 0 238.350 2.475 20 0 BEADRP C[C@H](C[C@@H]1CCCO1)[NH2+][C@H]1CCCCC[C@H]1[NH3+] ZINC000422907307 398157231 /nfs/dbraw/zinc/15/72/31/398157231.db2.gz WWGQVGMFDIHJBL-RQJABVFESA-N 2 0 240.391 2.194 20 0 BEADRP CC[C@H]([NH2+][C@@H](C)C[C@H]1CCCO1)[C@@H]1CCC[NH2+]1 ZINC000422906992 398157270 /nfs/dbraw/zinc/15/72/70/398157270.db2.gz WCLMIDOJRUFDLB-CRWXNKLISA-N 2 0 240.391 2.064 20 0 BEADRP C[C@@H]1C[C@H](CC[NH2+][C@H]2CCC[C@H]([NH3+])C2)CCO1 ZINC000563426364 398170795 /nfs/dbraw/zinc/17/07/95/398170795.db2.gz UDXMUTMGCGKWFY-MQYQWHSLSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H]1C[C@H](CC[NH2+][C@H]2CCC[C@@H]([NH3+])C2)CCO1 ZINC000563426365 398171014 /nfs/dbraw/zinc/17/10/14/398171014.db2.gz UDXMUTMGCGKWFY-SYQHCUMBSA-N 2 0 240.391 2.051 20 0 BEADRP CC[NH+](CC)CCCN1CC[C@]2(CC2(F)F)C1 ZINC000649908587 398183651 /nfs/dbraw/zinc/18/36/51/398183651.db2.gz RWAYXHZWYKAOQF-LBPRGKRZSA-N 2 0 246.345 2.449 20 0 BEADRP C[NH2+]CCC[N@H+](C)C[C@@H](C)c1ccc(F)cc1 ZINC000415118945 398163728 /nfs/dbraw/zinc/16/37/28/398163728.db2.gz DVFBXHWSDGVOFS-GFCCVEGCSA-N 2 0 238.350 2.471 20 0 BEADRP COC[C@@H]([NH2+]C1CCC([NH3+])CC1)C1CCCC1 ZINC000423233121 398165290 /nfs/dbraw/zinc/16/52/90/398165290.db2.gz OAEBMDRTXHPKCI-JXQTWKCFSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H](CCc1ccccc1)[NH2+]CC1([NH3+])CCC1 ZINC000342146420 398189320 /nfs/dbraw/zinc/18/93/20/398189320.db2.gz SVCZIAPPSQIGFO-ZDUSSCGKSA-N 2 0 232.371 2.479 20 0 BEADRP Cc1cc(F)ccc1C[NH2+]CC1=CC[N@H+](C)CC1 ZINC000271894734 178085271 /nfs/dbraw/zinc/08/52/71/178085271.db2.gz PBLFMOADOVWHED-UHFFFAOYSA-N 2 0 248.345 2.486 20 0 BEADRP CCC[C@H](C[NH2+]CCC[N@H+](C)C(C)C)OC ZINC000385947782 398193396 /nfs/dbraw/zinc/19/33/96/398193396.db2.gz CDKXWGUFIIFSRO-CYBMUJFWSA-N 2 0 230.396 2.121 20 0 BEADRP Cc1cc(N2CC[C@@H](C[NH3+])C2)c2ccccc2[nH+]1 ZINC000019439056 178117171 /nfs/dbraw/zinc/11/71/71/178117171.db2.gz PZNIFTAJDVVEPN-LBPRGKRZSA-N 2 0 241.338 2.328 20 0 BEADRP Cc1cc(N2CC[C@H]([NH+]3CCCC3)C2)cc[nH+]1 ZINC000302218026 178118905 /nfs/dbraw/zinc/11/89/05/178118905.db2.gz KLWQGJTWKJKGPM-AWEZNQCLSA-N 2 0 231.343 2.065 20 0 BEADRP Cc1cc(N2CC[C@H](C[NH+]3CCCC3)C2)cc[nH+]1 ZINC000293133097 178119702 /nfs/dbraw/zinc/11/97/02/178119702.db2.gz RUIXMCMJUJPKOS-CQSZACIVSA-N 2 0 245.370 2.312 20 0 BEADRP C[C@@H]1[C@@H](C)CC[N@@H+]1CCCC1CC[NH2+]CC1 ZINC000380602292 398202448 /nfs/dbraw/zinc/20/24/48/398202448.db2.gz HJGSJNOUCVGFNQ-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@H](CO)C1CCCCC1 ZINC000386276972 398204387 /nfs/dbraw/zinc/20/43/87/398204387.db2.gz QCVRBWGQTXRTLT-GXTWGEPZSA-N 2 0 242.407 2.035 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]Cc2cccc3c2CC[NH2+]C3)[C@@H]1C ZINC000386302698 398205116 /nfs/dbraw/zinc/20/51/16/398205116.db2.gz VRPBRQCVSJMVGW-HSMVNMDESA-N 2 0 244.382 2.466 20 0 BEADRP Cc1ccccc1C1([NH2+][C@H](C)C2C[NH2+]C2)CC1 ZINC000647800507 398205734 /nfs/dbraw/zinc/20/57/34/398205734.db2.gz DDCIWQAYXNBPSS-GFCCVEGCSA-N 2 0 230.355 2.182 20 0 BEADRP CCOc1cccc(C[NH2+]C2CCC([NH3+])CC2)c1 ZINC000051694478 398214040 /nfs/dbraw/zinc/21/40/40/398214040.db2.gz JOTWATBTWPJFEF-UHFFFAOYSA-N 2 0 248.370 2.445 20 0 BEADRP Cc1cc(NCC[C@@H]2CCC[NH2+]C2)cc[nH+]1 ZINC000229575098 178163489 /nfs/dbraw/zinc/16/34/89/178163489.db2.gz SUQOTWJDYYUVIX-LBPRGKRZSA-N 2 0 219.332 2.192 20 0 BEADRP CCOCCCC[NH2+][C@H](C)C1CC[NH+](C)CC1 ZINC000165159035 538934773 /nfs/dbraw/zinc/93/47/73/538934773.db2.gz YDARLWDWFGHQHH-CYBMUJFWSA-N 2 0 242.407 2.123 20 0 BEADRP CC[C@H](Cc1cccs1)[NH2+][C@H](C)CN ZINC000643519419 398232895 /nfs/dbraw/zinc/23/28/95/398232895.db2.gz SPRJVBVPWHXFNW-NXEZZACHSA-N 2 0 212.362 2.006 20 0 BEADRP Cc1cc([C@@H](C)[NH2+]CCCC[NH3+])c(C)o1 ZINC000037715242 178224081 /nfs/dbraw/zinc/22/40/81/178224081.db2.gz GJBOLJOEIOOPSS-SNVBAGLBSA-N 2 0 210.321 2.286 20 0 BEADRP CCC[N@H+](CCCOC(C)C)C1CC[NH2+]CC1 ZINC000431103845 398234782 /nfs/dbraw/zinc/23/47/82/398234782.db2.gz ZHDNURMTXGXUMA-UHFFFAOYSA-N 2 0 242.407 2.266 20 0 BEADRP Cc1cc([C@H](C)[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)no1 ZINC000333893844 178256440 /nfs/dbraw/zinc/25/64/40/178256440.db2.gz YROOBKCGEOCFRD-QNWHQSFQSA-N 2 0 249.358 2.022 20 0 BEADRP Fc1ccc(F)c(C[NH2+]CC2CC[NH2+]CC2)c1 ZINC000094010485 398244047 /nfs/dbraw/zinc/24/40/47/398244047.db2.gz CACYJZGEUVJCNI-UHFFFAOYSA-N 2 0 240.297 2.054 20 0 BEADRP CCc1ccccc1C[NH2+]CC1CC[NH2+]CC1 ZINC000094010520 398244531 /nfs/dbraw/zinc/24/45/31/398244531.db2.gz SSHKXPMBAROZBE-UHFFFAOYSA-N 2 0 232.371 2.338 20 0 BEADRP C[NH+](C)CCOc1cccc(C2=CC[NH2+]CC2)c1 ZINC000649442980 398248636 /nfs/dbraw/zinc/24/86/36/398248636.db2.gz GIPJCVPPSYOAQB-UHFFFAOYSA-N 2 0 246.354 2.004 20 0 BEADRP CC(C)[NH2+]CCC[NH2+][C@@H](C)[C@H]1CC1(C)C ZINC000576694689 365657717 /nfs/dbraw/zinc/65/77/17/365657717.db2.gz MSHXZBIVKSFWLE-NWDGAFQWSA-N 2 0 212.381 2.399 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]C[C@@H]2COc3ccccc32)C1 ZINC000576718174 365669161 /nfs/dbraw/zinc/66/91/61/365669161.db2.gz UXVVGVKTTRTFHU-JHJVBQTASA-N 2 0 246.354 2.022 20 0 BEADRP Cc1cccc(CC[N@@H+](C)C[C@H]2CC[NH+](C)C2)c1 ZINC000449262921 398266228 /nfs/dbraw/zinc/26/62/28/398266228.db2.gz FYSJXIUHQKGWCQ-MRXNPFEDSA-N 2 0 246.398 2.421 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+]C[C@H]1CCCC[N@H+](C)C1 ZINC000624124196 346853971 /nfs/dbraw/zinc/85/39/71/346853971.db2.gz ZSSHLMDDESGQDW-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)[C@H](C)[NH2+]CCC[N@H+](C)C(C)C ZINC000166562560 361851577 /nfs/dbraw/zinc/85/15/77/361851577.db2.gz FBUSIUYPLXFZER-LBPRGKRZSA-N 2 0 200.370 2.351 20 0 BEADRP CC(C)[N@@H+](C)CCC[NH2+][C@@H](C)CC1CC1 ZINC000166564460 361853257 /nfs/dbraw/zinc/85/32/57/361853257.db2.gz SMGFXXAVQWRZDQ-LBPRGKRZSA-N 2 0 212.381 2.495 20 0 BEADRP CC(C)[N@@H+](C)CCC[NH2+][C@H](C)CC1CC1 ZINC000166564563 361853309 /nfs/dbraw/zinc/85/33/09/361853309.db2.gz SMGFXXAVQWRZDQ-GFCCVEGCSA-N 2 0 212.381 2.495 20 0 BEADRP CCC(CC)[NH2+]CCC[N@H+](C)C(C)C ZINC000166567027 361853509 /nfs/dbraw/zinc/85/35/09/361853509.db2.gz RKLLVMDFFFJJHO-UHFFFAOYSA-N 2 0 200.370 2.495 20 0 BEADRP CC[C@H]1CC[N@H+](CC[C@@H]2CCC[NH+]2C)C1 ZINC000162230869 349613531 /nfs/dbraw/zinc/61/35/31/349613531.db2.gz HBBJFUQGDKIZKQ-STQMWFEESA-N 2 0 210.365 2.203 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)c1ccccn1)C1CC[NH+](C)CC1 ZINC000037220380 538961933 /nfs/dbraw/zinc/96/19/33/538961933.db2.gz RNEZHQYWTDRPNR-OLZOCXBDSA-N 2 0 247.386 2.463 20 0 BEADRP CCCCC[NH2+][C@H](C)C1CC[NH+](C)CC1 ZINC000037208920 538962000 /nfs/dbraw/zinc/96/20/00/538962000.db2.gz QHDGHTJPFUSDBZ-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@H]([NH2+][C@@H](C)C1CC[NH+](C)CC1)c1cccnc1 ZINC000037220819 538962022 /nfs/dbraw/zinc/96/20/22/538962022.db2.gz YKSYQNXTHXBJAC-STQMWFEESA-N 2 0 247.386 2.463 20 0 BEADRP C(C[NH2+]C(C1CC1)C1CC1)C[C@@H]1CCC[NH2+]1 ZINC000309592691 342729242 /nfs/dbraw/zinc/72/92/42/342729242.db2.gz HKECHPRTFODWAL-ZDUSSCGKSA-N 2 0 222.376 2.297 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H]1CCC[C@H]1C ZINC000083389773 398280469 /nfs/dbraw/zinc/28/04/69/398280469.db2.gz NUVFNGJUGRABEX-OLZOCXBDSA-N 2 0 212.381 2.497 20 0 BEADRP CCC(CC)[NH2+]CCC[NH+](CC)CC ZINC000019942954 168387100 /nfs/dbraw/zinc/38/71/00/168387100.db2.gz XGXAKAPRTVWWSC-UHFFFAOYSA-N 2 0 200.370 2.497 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]CC1CC(F)(F)C1 ZINC000335611993 136237308 /nfs/dbraw/zinc/23/73/08/136237308.db2.gz NTYDJUSOCJXRRP-MNOVXSKESA-N 2 0 232.318 2.281 20 0 BEADRP Cc1cc(N)cc(C[NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)c1 ZINC000335365119 398287093 /nfs/dbraw/zinc/28/70/93/398287093.db2.gz YIPJPUXLBHJZCZ-IUODEOHRSA-N 2 0 247.386 2.150 20 0 BEADRP C1C[C@H]2C[C@H]([NH2+]C3CCSCC3)CC[N@@H+]2C1 ZINC000106868995 398286220 /nfs/dbraw/zinc/28/62/20/398286220.db2.gz IRSLVGSOGWWFBB-OLZOCXBDSA-N 2 0 240.416 2.098 20 0 BEADRP C[N@H+](C/C=C/c1ccccc1)C1CC[NH2+]CC1 ZINC000036300569 342809048 /nfs/dbraw/zinc/80/90/48/342809048.db2.gz PFMPDTRROMGAJB-VMPITWQZSA-N 2 0 230.355 2.384 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC1(C)C)C1CC[NH+](C)CC1 ZINC000045116888 538990919 /nfs/dbraw/zinc/99/09/19/538990919.db2.gz QOWUDHRBLVHKNP-ZYHUDNBSSA-N 2 0 210.365 2.105 20 0 BEADRP CCC[C@H](C)[NH2+][C@H](C)CN(CC)CC ZINC000045689642 538992716 /nfs/dbraw/zinc/99/27/16/538992716.db2.gz YHERBNPYOVUDLK-NWDGAFQWSA-N 2 0 200.370 2.495 20 0 BEADRP CC1CC[NH+](CCCC[NH2+]C2CSC2)CC1 ZINC000381475011 539001932 /nfs/dbraw/zinc/00/19/32/539001932.db2.gz QELDFAYLZYUFAK-UHFFFAOYSA-N 2 0 242.432 2.204 20 0 BEADRP C[N@H+](CCC[NH3+])CCc1c(F)cccc1Cl ZINC000381996078 398294808 /nfs/dbraw/zinc/29/48/08/398294808.db2.gz XXQQRVALTQPEFJ-UHFFFAOYSA-N 2 0 244.741 2.302 20 0 BEADRP C[C@H]1C[C@@H]([NH+]2CCC(C)(C)CC2)CC[NH2+]1 ZINC000197532360 539012319 /nfs/dbraw/zinc/01/23/19/539012319.db2.gz YJADHPWJQNQDBK-RYUDHWBXSA-N 2 0 210.365 2.249 20 0 BEADRP C[N@H+](CC1CC1)C[C@@H]1CC[NH+](CC2CCC2)C1 ZINC000350764160 398302192 /nfs/dbraw/zinc/30/21/92/398302192.db2.gz ONQLSOABYMRCKW-HNNXBMFYSA-N 2 0 236.403 2.450 20 0 BEADRP CC(C)[N@H+](CC1CC1)C[C@H]1CC[NH2+][C@@H](C)C1 ZINC000232639024 342867971 /nfs/dbraw/zinc/86/79/71/342867971.db2.gz KLMGDXXPIXYCHO-JSGCOSHPSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H](C[NH2+]CCC[NH+](C)C)c1ccccc1 ZINC000013732597 342870870 /nfs/dbraw/zinc/87/08/70/342870870.db2.gz NHDXBEQRIZLAJW-ZDUSSCGKSA-N 2 0 220.360 2.331 20 0 BEADRP C[C@@H]([NH2+]CC[C@H](C)F)C1CC[NH+](C)CC1 ZINC000382154211 398308106 /nfs/dbraw/zinc/30/81/06/398308106.db2.gz QUGAGRAKGPIZEL-WDEREUQCSA-N 2 0 216.344 2.054 20 0 BEADRP C[NH+](C)CCCNCc1nccc2ccccc21 ZINC000134738261 342880834 /nfs/dbraw/zinc/88/08/34/342880834.db2.gz NXMPMLOQHSYZOW-UHFFFAOYSA-N 2 0 243.354 2.276 20 0 BEADRP C(C1CC1)[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000134871392 342910136 /nfs/dbraw/zinc/91/01/36/342910136.db2.gz CSKBTEYENJBTKP-ZFWWWQNUSA-N 2 0 234.387 2.345 20 0 BEADRP CCO[C@H]1C[C@@H]([NH2+]CCC[NH2+]C(C)C)C1(C)C ZINC000233778867 342912250 /nfs/dbraw/zinc/91/22/50/342912250.db2.gz YYXWWJYPWUQFBQ-OLZOCXBDSA-N 2 0 242.407 2.168 20 0 BEADRP C([NH2+]C1CCCC1)[C@H]1CC[N@@H+](C2CC2)C1 ZINC000037408433 342930637 /nfs/dbraw/zinc/93/06/37/342930637.db2.gz ZZRXJFZFEGXNTH-LLVKDONJSA-N 2 0 208.349 2.003 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H](C)C1(C)CC1 ZINC000037467899 342932696 /nfs/dbraw/zinc/93/26/96/342932696.db2.gz REJUNCGUGJNFLX-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP Cc1cccc([C@@H](C)[NH2+]CCCC[NH3+])c1 ZINC000037715476 342943871 /nfs/dbraw/zinc/94/38/71/342943871.db2.gz JZVZJRFZGNPISS-GFCCVEGCSA-N 2 0 206.333 2.385 20 0 BEADRP CC[C@@H](c1ccccc1)[N@@H+]1CCCO[C@H](C[NH3+])C1 ZINC000313350932 259333742 /nfs/dbraw/zinc/33/37/42/259333742.db2.gz LDLYUAKFCZJNSB-CABCVRRESA-N 2 0 248.370 2.187 20 0 BEADRP CCc1cc(NCC2CC[NH+](C)CC2)cc[nH+]1 ZINC000307766397 529555292 /nfs/dbraw/zinc/55/52/92/529555292.db2.gz DJXGLVOLKDORLM-UHFFFAOYSA-N 2 0 233.359 2.398 20 0 BEADRP CCc1cc(N[C@@H](C)CC[NH+](C)C)cc[nH+]1 ZINC000307812310 529559487 /nfs/dbraw/zinc/55/94/87/529559487.db2.gz JCAUYEVQRMXHKD-NSHDSACASA-N 2 0 221.348 2.396 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH+](C)CC[C@H](C)F)[C@H](C)C1 ZINC000351852907 136257474 /nfs/dbraw/zinc/25/74/74/136257474.db2.gz AZTGJKZVZIHOEC-AGIUHOORSA-N 2 0 230.371 2.397 20 0 BEADRP CC(C)C[C@@H](C)[N@@H+]1CC[C@@H](C[NH+](C)C)C1 ZINC000355693238 187212822 /nfs/dbraw/zinc/21/28/22/187212822.db2.gz VBYXETRAMKOWCI-OLZOCXBDSA-N 2 0 212.381 2.305 20 0 BEADRP CC(C)(C)[NH+]1CCC([NH2+]CC2CC2)CC1 ZINC000037786506 342980971 /nfs/dbraw/zinc/98/09/71/342980971.db2.gz WYPMCOYQFGFVRV-UHFFFAOYSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CC[N@@H+]([C@H]2CCc3ccc(F)cc32)C1 ZINC000351856985 136258336 /nfs/dbraw/zinc/25/83/36/136258336.db2.gz AHWCYIIWZQIXEX-NVBFEUDRSA-N 2 0 248.345 2.482 20 0 BEADRP CCC(C)(C)[C@H](C)[NH2+][C@@H]1CC[NH2+]C[C@H]1C ZINC000576862098 365705252 /nfs/dbraw/zinc/70/52/52/365705252.db2.gz IYVOWCWWWUSWBB-GRYCIOLGSA-N 2 0 212.381 2.399 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C2CCCC2)[C@@H]2CCC[C@@H]21 ZINC000367625808 187229353 /nfs/dbraw/zinc/22/93/53/187229353.db2.gz ZAJPPFXMGKLSJP-IHRRRGAJSA-N 2 0 222.376 2.391 20 0 BEADRP CCCC[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C)C1 ZINC000247116279 343077055 /nfs/dbraw/zinc/07/70/55/343077055.db2.gz AHGYQMWZVZSQAH-QWHCGFSZSA-N 2 0 210.365 2.203 20 0 BEADRP C[C@H]([NH2+][C@H]1CCCC[C@H]1C[NH3+])c1ccoc1 ZINC000576861477 365706115 /nfs/dbraw/zinc/70/61/15/365706115.db2.gz XWAFIGLJJHNLKV-GVXVVHGQSA-N 2 0 222.332 2.448 20 0 BEADRP CC(C)C[C@H]([NH3+])C[N@@H+]1CC[C@H]2CCC[C@H]21 ZINC000355107505 187233148 /nfs/dbraw/zinc/23/31/48/187233148.db2.gz NSPOKMZBCCOVFJ-FRRDWIJNSA-N 2 0 210.365 2.234 20 0 BEADRP Cc1ccccc1CC[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000094183061 343152444 /nfs/dbraw/zinc/15/24/44/343152444.db2.gz AOPJMCQKPRLAMH-HUUCEWRRSA-N 2 0 232.371 2.397 20 0 BEADRP Cc1ccc2cc(C[N@H+](C)CCC[NH3+])ccc2n1 ZINC000097862704 343155604 /nfs/dbraw/zinc/15/56/04/343155604.db2.gz KVUIGLVGANZOTF-UHFFFAOYSA-N 2 0 243.354 2.324 20 0 BEADRP CC(C)Oc1ccc(C[N@H+](C)CCC[NH3+])cc1 ZINC000123322254 343162196 /nfs/dbraw/zinc/16/21/96/343162196.db2.gz HVAKHSOZSURTRA-UHFFFAOYSA-N 2 0 236.359 2.254 20 0 BEADRP Fc1ccc2c(c1)[C@@H]([NH2+]CC1CC[NH2+]CC1)CC2 ZINC000576976072 365738258 /nfs/dbraw/zinc/73/82/58/365738258.db2.gz GVCMXAYFFODQOG-HNNXBMFYSA-N 2 0 248.345 2.402 20 0 BEADRP CCc1ccc(C[NH2+]CCC[NH2+]C)s1 ZINC000163309902 343206431 /nfs/dbraw/zinc/20/64/31/343206431.db2.gz CXEYMFZFKGIQCU-UHFFFAOYSA-N 2 0 212.362 2.010 20 0 BEADRP C[NH2+]CCC[N@H+](C)Cc1ccc(C)cc1C ZINC000087472106 136281482 /nfs/dbraw/zinc/28/14/82/136281482.db2.gz UCDXLEDUGPYRQC-UHFFFAOYSA-N 2 0 220.360 2.345 20 0 BEADRP CCC[C@@H](C)C[N@@H+]1CCC[C@H](CC[NH3+])C1 ZINC000069626586 343286454 /nfs/dbraw/zinc/28/64/54/343286454.db2.gz QWLXGMQOWMZGIR-CHWSQXEVSA-N 2 0 212.381 2.483 20 0 BEADRP Cc1ccsc1[C@H](C)[NH2+]CCCC[NH3+] ZINC000069636607 343287318 /nfs/dbraw/zinc/28/73/18/343287318.db2.gz HQUZXZVOSCVQEX-JTQLQIEISA-N 2 0 212.362 2.446 20 0 BEADRP CC(C)[N@H+](CC[C@H]1CCC[NH2+]C1)CC1CC1 ZINC000051919310 343278963 /nfs/dbraw/zinc/27/89/63/343278963.db2.gz OVAHMZUHPHKYLW-CYBMUJFWSA-N 2 0 224.392 2.497 20 0 BEADRP CCCCC[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@@H]1C ZINC000036907535 343327504 /nfs/dbraw/zinc/32/75/04/343327504.db2.gz YUXAOOKQNMXUKB-RWMBFGLXSA-N 2 0 212.381 2.495 20 0 BEADRP C[C@@H]1C[C@@H]([NH3+])CC[N@@H+]1CCCOc1ccccc1 ZINC000052092377 343300513 /nfs/dbraw/zinc/30/05/13/343300513.db2.gz PNKMOBPFELNHOS-KGLIPLIRSA-N 2 0 248.370 2.267 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]CC1CC(F)(F)C1 ZINC000335613056 136295724 /nfs/dbraw/zinc/29/57/24/136295724.db2.gz RWLYBTLHCIWDAM-KOLCDFICSA-N 2 0 232.318 2.009 20 0 BEADRP Fc1ccccc1CN[C@@H]1CCCC[NH2+]C1 ZINC000335643002 136308809 /nfs/dbraw/zinc/30/88/09/136308809.db2.gz LIBSJEBFOVYJNU-GFCCVEGCSA-N 2 0 222.307 2.057 20 0 BEADRP CC(C)[N@@H+]1CC[C@@H](CNc2ccccn2)C1 ZINC000040624137 343407208 /nfs/dbraw/zinc/40/72/08/343407208.db2.gz YACYDBUGRRMHHN-LBPRGKRZSA-N 2 0 219.332 2.224 20 0 BEADRP C[C@@H]1C[C@H]1C[N@@H+]1CC[C@H](C2CC[NH+](C)CC2)C1 ZINC000349157520 136327764 /nfs/dbraw/zinc/32/77/64/136327764.db2.gz YTPCJFVNDMXXMU-SNPRPXQTSA-N 2 0 236.403 2.306 20 0 BEADRP CC(C)(C)[C@H]1CC[N@H+](C[C@@]2(C)CC[NH2+]C2)C1 ZINC000166299332 136332104 /nfs/dbraw/zinc/33/21/04/136332104.db2.gz HCTCUBLMJXWPCU-JSGCOSHPSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H](c1cccnc1)[NH+]1CCC(C[NH+](C)C)CC1 ZINC000350953508 136366288 /nfs/dbraw/zinc/36/62/88/136366288.db2.gz WJKJJDLJILHVEZ-ZDUSSCGKSA-N 2 0 247.386 2.416 20 0 BEADRP CC[NH+]1CCC([NH2+]CCc2ccsc2)CC1 ZINC000042598634 343445013 /nfs/dbraw/zinc/44/50/13/343445013.db2.gz KVSLASSKEWHSKK-UHFFFAOYSA-N 2 0 238.400 2.365 20 0 BEADRP Cn1cncc1CC[NH2+]CC1CCCCC1 ZINC000060312922 343479109 /nfs/dbraw/zinc/47/91/09/343479109.db2.gz DDZATDUARAGZOT-UHFFFAOYSA-N 2 0 221.348 2.133 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CCC[NH+](C)C)[C@H](C)C1 ZINC000082857408 343468579 /nfs/dbraw/zinc/46/85/79/343468579.db2.gz RNQHERPPMCAAGN-UPJWGTAASA-N 2 0 212.381 2.352 20 0 BEADRP CCN1C[C@H](C)[C@H]([NH2+]C[C@H](C)C(C)C)C1 ZINC000379948015 365759908 /nfs/dbraw/zinc/75/99/08/365759908.db2.gz RRSAXNBVTYVVSY-RWMBFGLXSA-N 2 0 212.381 2.208 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H]2CC=CCC2)[C@@H](C)C1 ZINC000222092404 349818329 /nfs/dbraw/zinc/81/83/29/349818329.db2.gz PQEQXRXDTAPIBQ-MJBXVCDLSA-N 2 0 222.376 2.415 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]Cc1ccc(C)s1 ZINC000086070640 343610426 /nfs/dbraw/zinc/61/04/26/343610426.db2.gz IEYABCGETZGKAZ-VIFPVBQESA-N 2 0 212.362 2.002 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]Cc1ccc(Cl)s1 ZINC000086070739 343610641 /nfs/dbraw/zinc/61/06/41/343610641.db2.gz KMXLHWUIGZSBCN-QMMMGPOBSA-N 2 0 232.780 2.347 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]CC23CCC(CC2)C3)C1 ZINC000570226584 323053706 /nfs/dbraw/zinc/05/37/06/323053706.db2.gz OBADUXRTNNUTGF-DKNRTOFZSA-N 2 0 222.376 2.426 20 0 BEADRP [NH3+]CCCC[NH2+]Cc1ccc(F)c(Cl)c1 ZINC000088040993 343696709 /nfs/dbraw/zinc/69/67/09/343696709.db2.gz IKHHIRJEELVIGT-UHFFFAOYSA-N 2 0 230.714 2.308 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@@H]([NH3+])C1)C1CCCC1 ZINC000088162888 343709398 /nfs/dbraw/zinc/70/93/98/343709398.db2.gz SMPRYMGHYAGJJI-CYZMBNFOSA-N 2 0 210.365 2.425 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@H]2CCC[C@H]3C[C@H]32)CC1 ZINC000408510654 343760553 /nfs/dbraw/zinc/76/05/53/343760553.db2.gz XAJANBPRAOLWGC-ZNMIVQPWSA-N 2 0 236.403 2.497 20 0 BEADRP Cc1ccsc1C[N@@H+]1CCC[C@H](C[NH3+])C1 ZINC000044527837 343781329 /nfs/dbraw/zinc/78/13/29/343781329.db2.gz YCOGWWMYVPRJNH-LLVKDONJSA-N 2 0 224.373 2.227 20 0 BEADRP C[C@@H](C[NH+]1CCC(C[NH3+])CC1)c1ccccc1 ZINC000044512306 343781531 /nfs/dbraw/zinc/78/15/31/343781531.db2.gz ROBPTFKDADHZJE-ZDUSSCGKSA-N 2 0 232.371 2.461 20 0 BEADRP C[C@@H](NC[C@H]1CCC[NH2+]1)c1cccc(F)c1 ZINC000235213327 187274073 /nfs/dbraw/zinc/27/40/73/187274073.db2.gz ARICLCQGZDSLTI-ZWNOBZJWSA-N 2 0 222.307 2.228 20 0 BEADRP C(CC1CC[NH2+]CC1)[NH2+]C1CCCCC1 ZINC000040397810 187273550 /nfs/dbraw/zinc/27/35/50/187273550.db2.gz KYDDLXDHUGVHPW-UHFFFAOYSA-N 2 0 210.365 2.298 20 0 BEADRP CC(C)[C@H]1CC[C@@H]1[NH2+]CC1=CC[N@H+](C)CC1 ZINC000336665060 537817432 /nfs/dbraw/zinc/81/74/32/537817432.db2.gz LKBNVBQAPVKWGX-KGLIPLIRSA-N 2 0 222.376 2.273 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+][C@H]1CCCC[C@@H]1C[NH3+] ZINC000387661121 346995282 /nfs/dbraw/zinc/99/52/82/346995282.db2.gz HLONGKNINXWJNM-NDBYEHHHSA-N 2 0 210.365 2.140 20 0 BEADRP Cc1cc(C[N@@H+]2C[C@H](C[NH3+])[C@@H](C)C[C@@H]2C)ccn1 ZINC000621776703 343899396 /nfs/dbraw/zinc/89/93/96/343899396.db2.gz SZWUBVAASGCCRL-WHOFXGATSA-N 2 0 247.386 2.195 20 0 BEADRP COc1ccc(C[NH+]2CCC(C[NH3+])CC2)cc1C ZINC000050597689 187357135 /nfs/dbraw/zinc/35/71/35/187357135.db2.gz OTPMYJWXKVDARG-UHFFFAOYSA-N 2 0 248.370 2.174 20 0 BEADRP C[NH+]1CCC(CC[NH2+][C@H]2CC[C@H]2C2CC2)CC1 ZINC000348120206 537839846 /nfs/dbraw/zinc/83/98/46/537839846.db2.gz OXSWJFWANQTQIH-GJZGRUSLSA-N 2 0 236.403 2.497 20 0 BEADRP CC[C@H](C)C[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000634733659 344113721 /nfs/dbraw/zinc/11/37/21/344113721.db2.gz KUFJKPATNQWJLU-NWDGAFQWSA-N 2 0 212.381 2.400 20 0 BEADRP Cc1ccncc1C[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000634733913 344114531 /nfs/dbraw/zinc/11/45/31/344114531.db2.gz QZZQXRNDJCAWBA-CQSZACIVSA-N 2 0 247.386 2.258 20 0 BEADRP Cc1cnccc1C[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000634734086 344114689 /nfs/dbraw/zinc/11/46/89/344114689.db2.gz WLWMXMIHIUYTQY-AWEZNQCLSA-N 2 0 247.386 2.258 20 0 BEADRP CC1(C)CC[C@H]([NH2+]CCC[NH2+]C2CC2)C1 ZINC000129587850 344213526 /nfs/dbraw/zinc/21/35/26/344213526.db2.gz YYJNXHKXAQIQGS-LBPRGKRZSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]1C[C@H]([NH3+])CN1CCCOCc1ccccc1 ZINC000385069946 344314019 /nfs/dbraw/zinc/31/40/19/344314019.db2.gz HLUONAXBUJHOGW-ZFWWWQNUSA-N 2 0 248.370 2.015 20 0 BEADRP C[C@@H]1C[C@H]([NH3+])CN1Cc1cccc2cccnc21 ZINC000385100197 344326425 /nfs/dbraw/zinc/32/64/25/344326425.db2.gz PCPBCOFNHSRUFR-RISCZKNCSA-N 2 0 241.338 2.156 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000387729681 347046828 /nfs/dbraw/zinc/04/68/28/347046828.db2.gz RSAZZNODOKKJFZ-NDBYEHHHSA-N 2 0 210.365 2.105 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]C[C@@H]2C[C@@H]2C)CC1 ZINC000132821230 344308258 /nfs/dbraw/zinc/30/82/58/344308258.db2.gz GCSCAFANFWBAIW-RYUDHWBXSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CC2CCC2)CN1C1CC1 ZINC000132864184 344309744 /nfs/dbraw/zinc/30/97/44/344309744.db2.gz ONENFHJQTVEEIY-CMPLNLGQSA-N 2 0 208.349 2.001 20 0 BEADRP CC(C)(CN[C@H]1CC[NH2+]C1)c1ccccc1F ZINC000215645640 344391989 /nfs/dbraw/zinc/39/19/89/344391989.db2.gz IUIATOGHJVVIFP-NSHDSACASA-N 2 0 236.334 2.055 20 0 BEADRP CCc1cc(N[C@H]2CC[NH2+]CC(C)(C)C2)ncn1 ZINC000634813836 344399182 /nfs/dbraw/zinc/39/91/82/344399182.db2.gz ZDWSGAJLHSGOPQ-LBPRGKRZSA-N 2 0 248.374 2.229 20 0 BEADRP c1cc2nccc(N[C@H]3CCC[NH2+]CC3)c2s1 ZINC000634813619 344399225 /nfs/dbraw/zinc/39/92/25/344399225.db2.gz ROUZZQZBKGMHFK-JTQLQIEISA-N 2 0 247.367 2.272 20 0 BEADRP CCC1CCC([N@H+](C)CCC[NH2+]C)CC1 ZINC000042516778 344456538 /nfs/dbraw/zinc/45/65/38/344456538.db2.gz OWRSOGZHORFLLQ-UHFFFAOYSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]CCCF ZINC000389331097 344459786 /nfs/dbraw/zinc/45/97/86/344459786.db2.gz LSBQSZKBCBJWRI-NEPJUHHUSA-N 2 0 216.344 2.246 20 0 BEADRP CC[NH2+]CC1CC[NH+](CC2(C)CC2)CC1 ZINC000381501703 344513482 /nfs/dbraw/zinc/51/34/82/344513482.db2.gz PLWMFYNAWCZBCE-UHFFFAOYSA-N 2 0 210.365 2.108 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H]1CC[C@H]1C1CC1 ZINC000336775300 537848283 /nfs/dbraw/zinc/84/82/83/537848283.db2.gz YQLRBDVDSJKBTB-UONOGXRCSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)C[C@H](C)[NH2+]CCCC[NH+](C)C ZINC000045663309 344574622 /nfs/dbraw/zinc/57/46/22/344574622.db2.gz WEBWGIDFGPJZOA-LBPRGKRZSA-N 2 0 200.370 2.352 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+]Cc1ccc(C[NH3+])cc1 ZINC000309435100 347061252 /nfs/dbraw/zinc/06/12/52/347061252.db2.gz MOFNQIVRGMBXQN-ZDUSSCGKSA-N 2 0 218.344 2.424 20 0 BEADRP CC[C@@H]([NH3+])CN[C@@H](C)c1sc(C)nc1C ZINC000049538806 344651703 /nfs/dbraw/zinc/65/17/03/344651703.db2.gz UIFOANBBALSIHK-OIBJUYFYSA-N 2 0 227.377 2.148 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+]CC1CCCCC1 ZINC000049551924 344652969 /nfs/dbraw/zinc/65/29/69/344652969.db2.gz WHQRFIYIKPTLKP-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+]CCC(C)(C)C ZINC000049557030 344653409 /nfs/dbraw/zinc/65/34/09/344653409.db2.gz UGYWAAICIDXFFZ-LLVKDONJSA-N 2 0 200.370 2.352 20 0 BEADRP Cc1ccc(C)c(C[NH2+]CCCC[NH3+])c1 ZINC000049670283 344677699 /nfs/dbraw/zinc/67/76/99/344677699.db2.gz VQJMQHVXRDICBZ-UHFFFAOYSA-N 2 0 206.333 2.132 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCCC(C)(F)F)CC[N@@H+]1C ZINC000390110261 259380493 /nfs/dbraw/zinc/38/04/93/259380493.db2.gz WNOJMMRJKPLLIH-GHMZBOCLSA-N 2 0 234.334 2.494 20 0 BEADRP CCOCCC[N@@H+]1CC[C@@H](C[NH+](CC)CC)C1 ZINC000076003215 344790507 /nfs/dbraw/zinc/79/05/07/344790507.db2.gz YALRRALSVALMAG-AWEZNQCLSA-N 2 0 242.407 2.077 20 0 BEADRP CC(C)C[C@@H](C)[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000037485329 187293378 /nfs/dbraw/zinc/29/33/78/187293378.db2.gz LVIOGPRFNAMSPW-CHWSQXEVSA-N 2 0 224.392 2.495 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]C[C@@H]2CCCCO2)CC1 ZINC000049855610 192083504 /nfs/dbraw/zinc/08/35/04/192083504.db2.gz UCDIPXJALMTJQU-AWEZNQCLSA-N 2 0 240.391 2.018 20 0 BEADRP CC(C)[C@H](C[NH3+])CNc1ccc([C@H](C)[NH3+])cc1 ZINC000634995035 345183636 /nfs/dbraw/zinc/18/36/36/345183636.db2.gz SOJZPKJGPAWRKC-WCQYABFASA-N 2 0 235.375 2.349 20 0 BEADRP C[C@H]1CC2(CCC2)C[N@@H+]1CC12CC(C1)C[NH2+]2 ZINC000634995189 345183792 /nfs/dbraw/zinc/18/37/92/345183792.db2.gz XVZWEWWRTCMDKL-DCBWTQNWSA-N 2 0 220.360 2.003 20 0 BEADRP c1ccc2c(c1)CC[C@H]2C[NH2+]CC12CC(C1)C[NH2+]2 ZINC000634996047 345185932 /nfs/dbraw/zinc/18/59/32/345185932.db2.gz XUKKDKBUKHWRNZ-UGWHAMFMSA-N 2 0 242.366 2.058 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1ccon1 ZINC000634948910 345125430 /nfs/dbraw/zinc/12/54/30/345125430.db2.gz APQMBTSLINQTLA-GFCCVEGCSA-N 2 0 239.363 2.275 20 0 BEADRP C[NH+](C)CC[C@H](NCc1ccon1)C(C)(C)C ZINC000634962396 345136342 /nfs/dbraw/zinc/13/63/42/345136342.db2.gz SCBSYXJUJAQPGY-LBPRGKRZSA-N 2 0 239.363 2.131 20 0 BEADRP C/C=C/C[C@H]1CCCN(CC23CC(C2)C[NH2+]3)C1 ZINC000634997046 345194000 /nfs/dbraw/zinc/19/40/00/345194000.db2.gz BOHQHWUXFLHQOD-PAJGUDDTSA-N 2 0 234.387 2.417 20 0 BEADRP C[C@@H]1C[N@H+](C/C=C\c2ccc(F)cc2)C[C@H]1C[NH3+] ZINC000634998758 345199566 /nfs/dbraw/zinc/19/95/66/345199566.db2.gz KORNVFXDYKFDHQ-BTBCPRSTSA-N 2 0 248.345 2.366 20 0 BEADRP Cc1cc(C[N@H+]2C[C@H](C)[C@H](C[NH3+])C2)ccc1F ZINC000634998869 345199744 /nfs/dbraw/zinc/19/97/44/345199744.db2.gz LZPQSPUSFSCADX-WCQYABFASA-N 2 0 236.334 2.161 20 0 BEADRP C[C@@H]1C[N@H+](C[C@@H]2C[C@H]2c2ccccc2)C[C@H]1C[NH3+] ZINC000634999610 345199917 /nfs/dbraw/zinc/19/99/17/345199917.db2.gz WZILUUWDDZNTQK-BVUBDWEXSA-N 2 0 244.382 2.317 20 0 BEADRP C[C@H](Cc1ccccc1)C[N@@H+]1C[C@@H](C)[C@@H](C[NH3+])C1 ZINC000634999614 345199968 /nfs/dbraw/zinc/19/99/68/345199968.db2.gz WZXDXGJGOXAFRM-FMKPAKJESA-N 2 0 246.398 2.392 20 0 BEADRP Cc1cc(F)ccc1C[N@@H+]1C[C@@H](C[NH3+])[C@H](C)C1 ZINC000634999665 345200714 /nfs/dbraw/zinc/20/07/14/345200714.db2.gz XOCUEKZOXISMEW-DGCLKSJQSA-N 2 0 236.334 2.161 20 0 BEADRP C[C@H]1C[C@@H](C[NH+]2CCC(C)(F)CC2)CC[NH2+]1 ZINC000635001528 345201244 /nfs/dbraw/zinc/20/12/44/345201244.db2.gz CHZWJQQEWKSVFP-RYUDHWBXSA-N 2 0 228.355 2.199 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCCC12CC2)[C@H]1CCCC[NH2+]1 ZINC000635003286 345205436 /nfs/dbraw/zinc/20/54/36/345205436.db2.gz HTYBMDQOTWSZSA-JHJVBQTASA-N 2 0 222.376 2.439 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCCC12CC2)[C@@H]1CCC[NH2+]1 ZINC000635004143 345206810 /nfs/dbraw/zinc/20/68/10/345206810.db2.gz NIZKQMVSGFFRPZ-SDDRHHMPSA-N 2 0 208.349 2.049 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]([NH3+])Cc1ccccc1)C1CC1 ZINC000635004674 345208407 /nfs/dbraw/zinc/20/84/07/345208407.db2.gz JWNZMHJFOVRCMR-IUODEOHRSA-N 2 0 232.371 2.335 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CCCC12CC2 ZINC000635004841 345208560 /nfs/dbraw/zinc/20/85/60/345208560.db2.gz QCEMGZAFMDUXDS-RWMBFGLXSA-N 2 0 222.376 2.426 20 0 BEADRP CC[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)C1CC1 ZINC000635005687 345209602 /nfs/dbraw/zinc/20/96/02/345209602.db2.gz JZEVHAOGJFISEZ-DRZSPHRISA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+][C@H]1CC[C@H](C[NH3+])CC1 ZINC000635009787 345211848 /nfs/dbraw/zinc/21/18/48/345211848.db2.gz ZSCWNVGPPUHOEK-LPWJVIDDSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]1CCC[C@@H]1[NH2+][C@H]1CC[C@H](C[NH3+])CC1 ZINC000635009785 345211890 /nfs/dbraw/zinc/21/18/90/345211890.db2.gz ZSCWNVGPPUHOEK-CYDGBPFRSA-N 2 0 210.365 2.282 20 0 BEADRP CCC[C@@H](C)Nc1cc(N2CC[NH2+]CC2)cc[nH+]1 ZINC000635009290 345216408 /nfs/dbraw/zinc/21/64/08/345216408.db2.gz MXOOCJPHTPGKOJ-GFCCVEGCSA-N 2 0 248.374 2.092 20 0 BEADRP C[N@@H+]1CCC[C@@H]2CN(C/C=C/Cl)CC[C@@H]21 ZINC000158866720 345385221 /nfs/dbraw/zinc/38/52/21/345385221.db2.gz XRNXTWPJMRBORC-ZBWCZXCSSA-N 2 0 228.767 2.155 20 0 BEADRP COCCC[NH+]1CCC([NH2+][C@@H](C)C(C)C)CC1 ZINC000159084319 345408617 /nfs/dbraw/zinc/40/86/17/345408617.db2.gz PKHNZXLSKQVGBV-ZDUSSCGKSA-N 2 0 242.407 2.121 20 0 BEADRP CCOC(C)(C)C[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000159307366 345422101 /nfs/dbraw/zinc/42/21/01/345422101.db2.gz RMQKLACBZCGNJY-CHWSQXEVSA-N 2 0 240.391 2.018 20 0 BEADRP CC(C)[C@H]([NH3+])CC[N@H+](C)Cc1ccccc1 ZINC000058058259 192088235 /nfs/dbraw/zinc/08/82/35/192088235.db2.gz HGULBZJMCQKVRU-CQSZACIVSA-N 2 0 220.360 2.492 20 0 BEADRP CC(C)C[C@H](C)C[N@@H+]1CC[C@H]2[NH2+]CC[C@@H]2C1 ZINC000309246939 187308130 /nfs/dbraw/zinc/30/81/30/187308130.db2.gz CMSLCOBUKKRLMP-BFHYXJOUSA-N 2 0 224.392 2.352 20 0 BEADRP [NH3+]C1CCC([NH2+]CCOCc2ccccc2)CC1 ZINC000390257616 259384203 /nfs/dbraw/zinc/38/42/03/259384203.db2.gz XNTODCMQMPLXAE-UHFFFAOYSA-N 2 0 248.370 2.063 20 0 BEADRP COCc1cccc(C[N@@H+]2C[C@@H](C[NH3+])C[C@H]2C)c1 ZINC000216074572 345743819 /nfs/dbraw/zinc/74/38/19/345743819.db2.gz VZZIDNWGCVDTRL-IUODEOHRSA-N 2 0 248.370 2.002 20 0 BEADRP C(C[N@@H+]1CCC[C@H]2CCC[C@H]21)[C@H]1CC[NH2+]C1 ZINC000251294655 187359843 /nfs/dbraw/zinc/35/98/43/187359843.db2.gz OAUDKEJYPNAFMB-MGPQQGTHSA-N 2 0 222.376 2.251 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@@H]2CC[C@H](C)C2)CC1 ZINC000070643699 345793565 /nfs/dbraw/zinc/79/35/65/345793565.db2.gz FDRPFUJCLLNMHL-GXTWGEPZSA-N 2 0 224.392 2.497 20 0 BEADRP C(C[N@@H+]1CC[C@@H]2CCCC[C@@H]21)[C@H]1CC[NH2+]C1 ZINC000400889408 345866712 /nfs/dbraw/zinc/86/67/12/345866712.db2.gz ZSOBJHPJYOMJRE-RDBSUJKOSA-N 2 0 222.376 2.251 20 0 BEADRP CC1(C)SC[C@@H]1[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000309815619 187311063 /nfs/dbraw/zinc/31/10/63/187311063.db2.gz VFHHABUJJJNSRB-SRVKXCTJSA-N 2 0 240.416 2.097 20 0 BEADRP C[C@H](CC1CCC1)[NH2+]C[C@@H]1CCCN1C ZINC000166878500 345925373 /nfs/dbraw/zinc/92/53/73/345925373.db2.gz LEHTWAWSCUCLHB-YPMHNXCESA-N 2 0 210.365 2.249 20 0 BEADRP CC[C@@H](C)[N@@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000181132593 345929329 /nfs/dbraw/zinc/92/93/29/345929329.db2.gz DDKNNRVTFYQVCL-CHWSQXEVSA-N 2 0 210.365 2.203 20 0 BEADRP CSCCCC[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000401010340 346032675 /nfs/dbraw/zinc/03/26/75/346032675.db2.gz GPDFRWWBKCLYHP-JHJVBQTASA-N 2 0 242.432 2.107 20 0 BEADRP CSCCCC[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000401010336 346033046 /nfs/dbraw/zinc/03/30/46/346033046.db2.gz GPDFRWWBKCLYHP-FRRDWIJNSA-N 2 0 242.432 2.107 20 0 BEADRP Cc1cccc(C)c1CN1CC[C@@H]2C[NH2+]C[C@@H]21 ZINC000335299510 179035197 /nfs/dbraw/zinc/03/51/97/179035197.db2.gz KJKMIDQMKXPXPP-HIFRSBDPSA-N 2 0 230.355 2.097 20 0 BEADRP Cc1cccc(CC[NH2+][C@H](C)CC[NH+](C)C)c1 ZINC000336686682 179060601 /nfs/dbraw/zinc/06/06/01/179060601.db2.gz GHCLVVHRMSULFF-CQSZACIVSA-N 2 0 234.387 2.467 20 0 BEADRP Cc1cccc(C[N@@H+]2CC[C@]3(CC[NH2+]C3)C2)c1 ZINC000031994558 179081677 /nfs/dbraw/zinc/08/16/77/179081677.db2.gz FYRIYXLPXCYYNJ-HNNXBMFYSA-N 2 0 230.355 2.180 20 0 BEADRP Cc1cccc(C[N@@H+]2CCC[C@H](C[NH3+])C2)c1 ZINC000011888321 179076095 /nfs/dbraw/zinc/07/60/95/179076095.db2.gz CBHXHESECXQGEL-CQSZACIVSA-N 2 0 218.344 2.166 20 0 BEADRP C[C@H]1CCC(C)(C)[N@@H+]1CC[C@H]1CC[NH2+]C1 ZINC000641801053 362752872 /nfs/dbraw/zinc/75/28/72/362752872.db2.gz LYCMVCPFFJSVAM-NWDGAFQWSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@H]1CCC(C)(C)[N@@H+]1CC[C@@H]1CC[NH2+]C1 ZINC000641801054 362753548 /nfs/dbraw/zinc/75/35/48/362753548.db2.gz LYCMVCPFFJSVAM-RYUDHWBXSA-N 2 0 210.365 2.249 20 0 BEADRP CC1(C)CC(C[NH2+][C@@H]2C[C@@H]([NH3+])C2(C)C)C1 ZINC000641801230 362754894 /nfs/dbraw/zinc/75/48/94/362754894.db2.gz OCCJLIVAIPHKQZ-GHMZBOCLSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@H](c1cccnc1)[NH+]1CCC(CC[NH3+])CC1 ZINC000070183399 349967278 /nfs/dbraw/zinc/96/72/78/349967278.db2.gz NCYOIWGJBRIQQK-GFCCVEGCSA-N 2 0 233.359 2.203 20 0 BEADRP CC1(C)[C@@H]([NH3+])C[C@@H]1[NH2+]CCCC1CCC1 ZINC000641802166 362758462 /nfs/dbraw/zinc/75/84/62/362758462.db2.gz YLBAULFOKHMPDH-RYUDHWBXSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H](C[NH2+][C@@H](C)C1CCC1)C[NH+]1CCCC1 ZINC000178243707 346662729 /nfs/dbraw/zinc/66/27/29/346662729.db2.gz PCIZFYCSEUEDIC-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP Cc1cccc(OCC[N@H+]2CC[C@@H]([C@H](C)[NH3+])C2)c1 ZINC000228202289 179166681 /nfs/dbraw/zinc/16/66/81/179166681.db2.gz IWDJZXHEHHTUFB-UONOGXRCSA-N 2 0 248.370 2.043 20 0 BEADRP Cc1cccc(OCC[NH2+][C@H]2CCC[NH2+]CC2)c1 ZINC000129196148 179168830 /nfs/dbraw/zinc/16/88/30/179168830.db2.gz JHXIEHXZBFKVRI-AWEZNQCLSA-N 2 0 248.370 2.106 20 0 BEADRP C[C@H](C[N@@H+]1C[C@@H]2CCC[C@]2([NH3+])C1)C(C)(C)C ZINC000622004561 370655630 /nfs/dbraw/zinc/65/56/30/370655630.db2.gz QMBUBOVJDSBGKU-DYEKYZERSA-N 2 0 224.392 2.482 20 0 BEADRP Cc1csc(C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)c1 ZINC000382080712 347145242 /nfs/dbraw/zinc/14/52/42/347145242.db2.gz IFOZBXQRNJDMGO-GHMZBOCLSA-N 2 0 224.373 2.416 20 0 BEADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+][C@@H]1CO[C@H](C)C1 ZINC000402170009 349975548 /nfs/dbraw/zinc/97/55/48/349975548.db2.gz UVDCBERDHIHEAS-MQYQWHSLSA-N 2 0 240.391 2.064 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+][C@@H](C)[C@@H]1CCCC[NH2+]1 ZINC000388007560 347152156 /nfs/dbraw/zinc/15/21/56/347152156.db2.gz NAYDPHXIWLRMBS-RNJOBUHISA-N 2 0 210.365 2.153 20 0 BEADRP CC1(C)CC[C@H]([NH2+]CC2=CC[NH2+]CC2)C1 ZINC000335499589 347229995 /nfs/dbraw/zinc/22/99/95/347229995.db2.gz HCKYUWGITXPAEY-LBPRGKRZSA-N 2 0 208.349 2.074 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCC(C)(C)O2)CC[N@@H+]1C ZINC000160329993 347253008 /nfs/dbraw/zinc/25/30/08/347253008.db2.gz LNRMPFLVNKRSEH-UPJWGTAASA-N 2 0 240.391 2.016 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCC(C)(C)O2)CC[N@@H+]1C ZINC000160330247 347257696 /nfs/dbraw/zinc/25/76/96/347257696.db2.gz LNRMPFLVNKRSEH-AGIUHOORSA-N 2 0 240.391 2.016 20 0 BEADRP CC(C)C[C@@H](C)[NH2+]CCC[NH+]1CCCC1 ZINC000020129005 347408019 /nfs/dbraw/zinc/40/80/19/347408019.db2.gz UQYLHZFTONWLPZ-CYBMUJFWSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+]C[C@@H]1CCCN1C ZINC000390681396 347425728 /nfs/dbraw/zinc/42/57/28/347425728.db2.gz ZXVPMFCNHIRAKH-ZJUUUORDSA-N 2 0 238.297 2.401 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+]C[C@@H]1CCCC1(C)C ZINC000388512108 347440832 /nfs/dbraw/zinc/44/08/32/347440832.db2.gz VSGSQZLDSIEOGX-STQMWFEESA-N 2 0 242.407 2.156 20 0 BEADRP C[C@@H](C[NH2+]CC1(C)CC1)C[NH+]1CCCC1 ZINC000380105798 365882012 /nfs/dbraw/zinc/88/20/12/365882012.db2.gz NBJDHCBLDOYPSX-LBPRGKRZSA-N 2 0 210.365 2.108 20 0 BEADRP Cc1ccccc1CCC[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC000359283911 179261392 /nfs/dbraw/zinc/26/13/92/179261392.db2.gz KIXOKSVNFQJGJF-IYBDPMFKSA-N 2 0 244.382 2.079 20 0 BEADRP Cc1ccccc1CC[NH2+]C1CCC([NH3+])CC1 ZINC000094182641 179266294 /nfs/dbraw/zinc/26/62/94/179266294.db2.gz BTXCXUISAPMQDF-UHFFFAOYSA-N 2 0 232.371 2.397 20 0 BEADRP Cc1ccccc1C[N@H+]1C[C@H](C[NH3+])C[C@H]1C ZINC000228074013 179276988 /nfs/dbraw/zinc/27/69/88/179276988.db2.gz UHUWXBOGCHTLEN-OLZOCXBDSA-N 2 0 218.344 2.164 20 0 BEADRP Cc1ccccc1C[C@@H](C)[NH2+]C1CC[NH2+]CC1 ZINC000038041522 179288893 /nfs/dbraw/zinc/28/88/93/179288893.db2.gz QGKQFYVYVUXXJO-CYBMUJFWSA-N 2 0 232.371 2.268 20 0 BEADRP Cc1ccccc1C[C@@H]([NH2+]CCN(C)C)C1CC1 ZINC000286920711 179289572 /nfs/dbraw/zinc/28/95/72/179289572.db2.gz FOTKULNXVHYPAQ-MRXNPFEDSA-N 2 0 246.398 2.467 20 0 BEADRP Cc1ccccc1C[C@H](C)[NH2+][C@@H]1CN(C)C[C@@H]1C ZINC000358002522 179291211 /nfs/dbraw/zinc/29/12/11/179291211.db2.gz GHYJWQNQQKIGBZ-OFQRWUPVSA-N 2 0 246.398 2.466 20 0 BEADRP CCN1CC[C@H]2CC[C@@H](C1)[N@@H+]2CC1(C)CC1 ZINC000577329430 365925798 /nfs/dbraw/zinc/92/57/98/365925798.db2.gz POYDDCLYDMHFMO-OLZOCXBDSA-N 2 0 222.376 2.345 20 0 BEADRP CS[C@@H]1CC[C@H]1[NH2+]CCC[N@H+](C)CC(C)C ZINC000593647108 347926153 /nfs/dbraw/zinc/92/61/53/347926153.db2.gz WJJXMMPBUDBPJV-CHWSQXEVSA-N 2 0 244.448 2.448 20 0 BEADRP Cc1ccccc1[C@@H](C)[NH2+][C@@H]1CCN(C)C1 ZINC000042544508 179321424 /nfs/dbraw/zinc/32/14/24/179321424.db2.gz BSPXSDDJBJPGJS-CHWSQXEVSA-N 2 0 218.344 2.350 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H]1CCc2c1cccc2F ZINC000577363055 365933780 /nfs/dbraw/zinc/93/37/80/365933780.db2.gz JMOLIXRZPXOKQF-CQSZACIVSA-N 2 0 236.334 2.402 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+]CC1CC[NH2+]CC1 ZINC000577383044 365940440 /nfs/dbraw/zinc/94/04/40/365940440.db2.gz MIZUNZYDOUIHQE-QWHCGFSZSA-N 2 0 210.365 2.010 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)CSCCF)C1 ZINC000595010209 348159605 /nfs/dbraw/zinc/15/96/05/348159605.db2.gz IZPGPNKGEUGIND-NEPJUHHUSA-N 2 0 248.411 2.009 20 0 BEADRP CCSC1(C[NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)CC1 ZINC000595100234 348195180 /nfs/dbraw/zinc/19/51/80/348195180.db2.gz QDCHLMZEFHPJME-NEPJUHHUSA-N 2 0 242.432 2.344 20 0 BEADRP C(C[NH2+]C1(C2CC2)CC1)C[NH+]1CCCC1 ZINC000308851006 323180003 /nfs/dbraw/zinc/18/00/03/323180003.db2.gz REYDWCNUAGDDSF-UHFFFAOYSA-N 2 0 208.349 2.005 20 0 BEADRP C[C@@H](c1cccnc1)[N@@H+]1CC[C@@H](C)[C@H](C[NH3+])C1 ZINC000253176865 348229247 /nfs/dbraw/zinc/22/92/47/348229247.db2.gz ALZILMHMUQIRFN-MBNYWOFBSA-N 2 0 233.359 2.059 20 0 BEADRP C[N@@H+]1CCC[C@@H]1CC[NH+]1C2CCC1CC2 ZINC000535765312 323190609 /nfs/dbraw/zinc/19/06/09/323190609.db2.gz IYYPTGLTPDQGPT-PNESKVBLSA-N 2 0 208.349 2.098 20 0 BEADRP Cc1ccncc1[C@@H](C)[NH2+]CC1CC[NH+](C)CC1 ZINC000357776517 179495839 /nfs/dbraw/zinc/49/58/39/179495839.db2.gz CNIBXTRYERTKBH-CYBMUJFWSA-N 2 0 247.386 2.382 20 0 BEADRP CSCC1(CC[NH2+][C@H]2CCC[C@H]2C[NH3+])CC1 ZINC000596648942 348604653 /nfs/dbraw/zinc/60/46/53/348604653.db2.gz BOEUWFLMZBKRME-RYUDHWBXSA-N 2 0 242.432 2.237 20 0 BEADRP CCSC1(C[NH2+][C@@H](CC)[C@@H]2CCC[NH2+]2)CC1 ZINC000596652333 348606754 /nfs/dbraw/zinc/60/67/54/348606754.db2.gz PQIRDOXLODOWIB-RYUDHWBXSA-N 2 0 242.432 2.392 20 0 BEADRP CCSC1(C[NH2+][C@@H](C)CCCC[NH3+])CC1 ZINC000596654234 348607612 /nfs/dbraw/zinc/60/76/12/348607612.db2.gz ZCYKBVUZUMUTOQ-NSHDSACASA-N 2 0 230.421 2.379 20 0 BEADRP C[NH+](C)C[C@@H]1CC[N@H+](CC2(C)CCC2)C1 ZINC000432829412 192372877 /nfs/dbraw/zinc/37/28/77/192372877.db2.gz PUZAPBOQYQFKAD-LBPRGKRZSA-N 2 0 210.365 2.060 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+]C1CCC(F)(F)CC1 ZINC000390082121 538011977 /nfs/dbraw/zinc/01/19/77/538011977.db2.gz BVPIWKBMLKJYPB-SNVBAGLBSA-N 2 0 234.334 2.494 20 0 BEADRP COC1([C@@H](C)[NH2+]CCCC[NH+](C)C)CCCC1 ZINC000421824157 192387457 /nfs/dbraw/zinc/38/74/57/192387457.db2.gz HIDMBLHUDSZCQH-CYBMUJFWSA-N 2 0 242.407 2.266 20 0 BEADRP CC[C@H](C)C[NH2+][C@@H]1CC[N@H+](C)[C@H]2CCC[C@H]21 ZINC000421873251 192398107 /nfs/dbraw/zinc/39/81/07/192398107.db2.gz HHIUTPUKYSLNGT-FQUUOJAGSA-N 2 0 224.392 2.495 20 0 BEADRP CCOc1ccc(C[N@@H+]2CC[C@@H]([NH3+])C[C@H]2C)cc1 ZINC000252685975 349210145 /nfs/dbraw/zinc/21/01/45/349210145.db2.gz IYTBJFSIMGWWNY-TZMCWYRMSA-N 2 0 248.370 2.397 20 0 BEADRP CC[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000388590903 349203364 /nfs/dbraw/zinc/20/33/64/349203364.db2.gz APCXIVGVPWIAGY-JHJVBQTASA-N 2 0 210.365 2.154 20 0 BEADRP CC[C@H]1CCC[C@@H]1[NH2+]CC1CC[NH2+]CC1 ZINC000388633902 349279304 /nfs/dbraw/zinc/27/93/04/349279304.db2.gz LWKTZYDLVDBDGJ-STQMWFEESA-N 2 0 210.365 2.154 20 0 BEADRP CSC1CC[NH+](C[C@@H]2CC[NH2+][C@H](C)C2)CC1 ZINC000300919453 349430456 /nfs/dbraw/zinc/43/04/56/349430456.db2.gz YOKWRRGPALXOHK-VXGBXAGGSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H](c1ccncc1)N1CC[C@H](C[NH+](C)C)C1 ZINC000603939455 350057128 /nfs/dbraw/zinc/05/71/28/350057128.db2.gz MDFBZUHXMQTVKY-QWHCGFSZSA-N 2 0 233.359 2.026 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)nc1C ZINC000313915496 350165441 /nfs/dbraw/zinc/16/54/41/350165441.db2.gz JPXMPFYUZYVRIL-CHWSQXEVSA-N 2 0 233.359 2.058 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)nc1C ZINC000313915499 350166090 /nfs/dbraw/zinc/16/60/90/350166090.db2.gz JPXMPFYUZYVRIL-QWHCGFSZSA-N 2 0 233.359 2.058 20 0 BEADRP CC(C)CN(CC[NH3+])Cc1ccccc1 ZINC000032011648 350175479 /nfs/dbraw/zinc/17/54/79/350175479.db2.gz VEYLXGLFNXLEDQ-UHFFFAOYSA-N 2 0 206.333 2.103 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)C(C)C)C1 ZINC000151105468 191059221 /nfs/dbraw/zinc/05/92/21/191059221.db2.gz NMLVNUJEHIOCNI-QWHCGFSZSA-N 2 0 212.381 2.352 20 0 BEADRP C([NH2+][C@@H](C1CC1)C1CCC1)[C@H]1CCC[NH2+]C1 ZINC000324788295 323282909 /nfs/dbraw/zinc/28/29/09/323282909.db2.gz IYKBDOIRJGNIOF-SMDDNHRTSA-N 2 0 222.376 2.154 20 0 BEADRP CCC(CC)C[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000154175057 191074997 /nfs/dbraw/zinc/07/49/97/191074997.db2.gz DXBIIQRZHASUKU-YPMHNXCESA-N 2 0 212.381 2.495 20 0 BEADRP Cc1nccn1CC[C@H]1CCCC[N@H+]1C ZINC000230201920 180261964 /nfs/dbraw/zinc/26/19/64/180261964.db2.gz IBBOSNNDVUJHOG-GFCCVEGCSA-N 2 0 207.321 2.066 20 0 BEADRP CC(C)OCCC[NH2+][C@@H]1CCCCC[C@@H]1[NH3+] ZINC000422773426 192461622 /nfs/dbraw/zinc/46/16/22/192461622.db2.gz ZVRPOTUNHNKTNS-QWHCGFSZSA-N 2 0 228.380 2.051 20 0 BEADRP Clc1ccc(CC[NH2+]C2CC[NH2+]CC2)cc1 ZINC000038040642 350302812 /nfs/dbraw/zinc/30/28/12/350302812.db2.gz OXFUGFRQSJAAKL-UHFFFAOYSA-N 2 0 238.762 2.224 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C2CC2)C2CCC2)C1 ZINC000324871788 350314115 /nfs/dbraw/zinc/31/41/15/350314115.db2.gz CBWGYTNFYJMDGI-SWLSCSKDSA-N 2 0 236.403 2.497 20 0 BEADRP CC(C)Oc1cccc(CN2CC[C@H]([NH3+])C2)c1 ZINC000050228054 350315114 /nfs/dbraw/zinc/31/51/14/350315114.db2.gz JHOFOWUJHUDLHE-ZDUSSCGKSA-N 2 0 234.343 2.007 20 0 BEADRP CC(C)[C@H]([NH2+]CC1CC[NH2+]CC1)C1CC1 ZINC000324326291 350292513 /nfs/dbraw/zinc/29/25/13/350292513.db2.gz ZIWLPXXPMQGEDG-ZDUSSCGKSA-N 2 0 210.365 2.010 20 0 BEADRP CC(C)[C@@H]([NH2+]CC1CC[NH2+]CC1)C1CC1 ZINC000324326290 350293105 /nfs/dbraw/zinc/29/31/05/350293105.db2.gz ZIWLPXXPMQGEDG-CYBMUJFWSA-N 2 0 210.365 2.010 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@H]2CCOC2(C)C)CC1(C)C ZINC000623537453 362956166 /nfs/dbraw/zinc/95/61/66/362956166.db2.gz YKSCGTVDUBYYDO-RYUDHWBXSA-N 2 0 240.391 2.016 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@H]([NH3+])C[C@H]2C)cc1 ZINC000226873704 350461111 /nfs/dbraw/zinc/46/11/11/350461111.db2.gz MMYZMMWCQQINKD-OCCSQVGLSA-N 2 0 218.344 2.307 20 0 BEADRP CCC(CC)(CC)C[NH2+]C[C@@H](C)C[NH3+] ZINC000391130402 350465832 /nfs/dbraw/zinc/46/58/32/350465832.db2.gz GBSRHPWICBAIEA-NSHDSACASA-N 2 0 200.370 2.387 20 0 BEADRP C[C@@H]([NH3+])C[N@H+](C)CCCCc1ccccc1 ZINC000163003978 350492764 /nfs/dbraw/zinc/49/27/64/350492764.db2.gz DJBBHONKRBKHED-CYBMUJFWSA-N 2 0 220.360 2.288 20 0 BEADRP C[C@H]([NH3+])C[N@H+](C)CCCCc1ccccc1 ZINC000163003870 350492852 /nfs/dbraw/zinc/49/28/52/350492852.db2.gz DJBBHONKRBKHED-ZDUSSCGKSA-N 2 0 220.360 2.288 20 0 BEADRP C[C@@H]([NH3+])[C@@H]1CC[N@H+](CCCOc2ccccc2)C1 ZINC000163172196 350509163 /nfs/dbraw/zinc/50/91/63/350509163.db2.gz GZEWUYAOGDGPGK-ZIAGYGMSSA-N 2 0 248.370 2.125 20 0 BEADRP CC[NH2+][C@H]1CCCC[C@@H]1C[NH+](CC)CC ZINC000060720695 350498711 /nfs/dbraw/zinc/49/87/11/350498711.db2.gz NNLSWNZYQXHCHB-OLZOCXBDSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@H]([NH2+][C@H]1CCCC1(C)C)[C@H]1CCC[NH2+]1 ZINC000400656598 362963313 /nfs/dbraw/zinc/96/33/13/362963313.db2.gz RAVSBGBICMONQP-TUAOUCFPSA-N 2 0 210.365 2.295 20 0 BEADRP COCCN1CCC[C@@H]1C[NH2+][C@@H](C)C(C)(C)C ZINC000163419076 350520636 /nfs/dbraw/zinc/52/06/36/350520636.db2.gz JZINZQZRHDMTCI-QWHCGFSZSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCCC1(C)C)[C@H]1CCC[NH2+]1 ZINC000400656583 362964039 /nfs/dbraw/zinc/96/40/39/362964039.db2.gz RAVSBGBICMONQP-QJPTWQEYSA-N 2 0 210.365 2.295 20 0 BEADRP CC(C)C[NH+]1CCC([C@@H]2CCC[NH2+]2)CC1 ZINC000063197521 350575504 /nfs/dbraw/zinc/57/55/04/350575504.db2.gz YYUXEEAWQCIGRK-ZDUSSCGKSA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@@H]1OCC[C@H]1[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623548233 362968014 /nfs/dbraw/zinc/96/80/14/362968014.db2.gz QSWKJPBUBXGNGY-XQQFMLRXSA-N 2 0 240.391 2.016 20 0 BEADRP COCC[C@H](C)C[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623548951 362969491 /nfs/dbraw/zinc/96/94/91/362969491.db2.gz KAYCSAXXVSPELE-QWHCGFSZSA-N 2 0 242.407 2.121 20 0 BEADRP CCN1CCC[C@@H]1C[NH2+][C@@H](C)c1ccncc1 ZINC000019960031 350917489 /nfs/dbraw/zinc/91/74/89/350917489.db2.gz APZPSLSEMUJPGI-GXTWGEPZSA-N 2 0 233.359 2.217 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)C1CCC1 ZINC000252715905 538100749 /nfs/dbraw/zinc/10/07/49/538100749.db2.gz XAYYSTZSAJEYPP-UBHSHLNASA-N 2 0 222.376 2.391 20 0 BEADRP CCC[C@H](C[N@H+](C)CC1CC[NH+](C)CC1)OC ZINC000638028269 351907567 /nfs/dbraw/zinc/90/75/67/351907567.db2.gz DPOSXMAZAKSWBV-CQSZACIVSA-N 2 0 242.407 2.075 20 0 BEADRP CC(C)C1(C[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)CC1 ZINC000638360606 352171835 /nfs/dbraw/zinc/17/18/35/352171835.db2.gz XEHCNWKAHXIJHS-CYBMUJFWSA-N 2 0 236.403 2.497 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+]CC2CCSCC2)C1 ZINC000638382173 352193772 /nfs/dbraw/zinc/19/37/72/352193772.db2.gz SSDRGVCLVUUSPD-CYBMUJFWSA-N 2 0 242.432 2.061 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]C[C@@H]2C[C@H]3C[C@H]3C2)CC1 ZINC000638319785 352143970 /nfs/dbraw/zinc/14/39/70/352143970.db2.gz AOIWAYLPHVNVOX-BTTYYORXSA-N 2 0 236.403 2.495 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](C)[C@@H]2CC2(F)F)C1 ZINC000638408354 352213785 /nfs/dbraw/zinc/21/37/85/352213785.db2.gz AHEYAVYEWULFAT-UTUOFQBUSA-N 2 0 246.345 2.352 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H]2CS[C@H](C)C2)C1 ZINC000638409119 352219075 /nfs/dbraw/zinc/21/90/75/352219075.db2.gz JIAWTVFEPBANFB-JHJVBQTASA-N 2 0 242.432 2.202 20 0 BEADRP CC(C)C1(C[NH2+]CCCC[NH+](C)C)CC1 ZINC000638451499 352259038 /nfs/dbraw/zinc/25/90/38/352259038.db2.gz OGJLXXIUTXAXTH-UHFFFAOYSA-N 2 0 212.381 2.354 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CC1(C2CC2)CCC1 ZINC000391421236 259426026 /nfs/dbraw/zinc/42/60/26/259426026.db2.gz CJBWYVWECCOGBE-LLVKDONJSA-N 2 0 210.365 2.284 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@H](C)[C@@H]2CC2(F)F)CC1 ZINC000638562681 352387961 /nfs/dbraw/zinc/38/79/61/352387961.db2.gz AUWSPQIUGKFBEO-PWSUYJOCSA-N 2 0 246.345 2.352 20 0 BEADRP CC1CCC([NH2+][C@@H]2CCC[C@H]([NH3+])C2)CC1 ZINC000086401860 538104125 /nfs/dbraw/zinc/10/41/25/538104125.db2.gz GUBGSODFOXBQMU-PYNQCMFNSA-N 2 0 210.365 2.425 20 0 BEADRP COC1([C@H](C)[NH2+]CC[C@H]2CCC[N@@H+]2C)CCC1 ZINC000412026406 191240210 /nfs/dbraw/zinc/24/02/10/191240210.db2.gz SFFFXFRNNJKUTF-QWHCGFSZSA-N 2 0 240.391 2.018 20 0 BEADRP CC[C@@H](C)C[N@@H+]1CC[C@@]2(C1)CCC[NH+](C)C2 ZINC000334217506 352817586 /nfs/dbraw/zinc/81/75/86/352817586.db2.gz HGCXOSIFIKYVRS-KGLIPLIRSA-N 2 0 224.392 2.450 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C2CCC([NH+](C)C)CC2)CCO1 ZINC000334217142 352817758 /nfs/dbraw/zinc/81/77/58/352817758.db2.gz CRQOQLCAKZPSIV-ZIHBUVQPSA-N 2 0 240.391 2.016 20 0 BEADRP Cc1sccc1CN1CC[NH+]2CCC1CC2 ZINC000334205476 352799964 /nfs/dbraw/zinc/79/99/64/352799964.db2.gz UPWHPCZROFRPEH-UHFFFAOYSA-N 2 0 236.384 2.337 20 0 BEADRP CC[NH+](CC)CCC[NH2+]C[C@](C)(OC)C1CC1 ZINC000638863766 353037731 /nfs/dbraw/zinc/03/77/31/353037731.db2.gz MGUDFHMBMZZSMD-AWEZNQCLSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)C[C@H](C)C[N@@H+]1CC[C@@H]([NH3+])[C@H](C)C1 ZINC000300831790 188001720 /nfs/dbraw/zinc/00/17/20/188001720.db2.gz CCWIQMWOKXTLTP-YNEHKIRRSA-N 2 0 212.381 2.338 20 0 BEADRP C(C[C@H]1CCC[NH2+]1)[NH2+]C1CCCCCC1 ZINC000042172225 187977497 /nfs/dbraw/zinc/97/74/97/187977497.db2.gz BCVXUXUKVVQBBT-CYBMUJFWSA-N 2 0 210.365 2.441 20 0 BEADRP C(C1CCCCC1)[N@@H+]1CC[C@]2(CC[NH2+]C2)C1 ZINC000031994527 188233377 /nfs/dbraw/zinc/23/33/77/188233377.db2.gz CMDIFNVECSBZAR-AWEZNQCLSA-N 2 0 222.376 2.252 20 0 BEADRP CC(C)[C@H]1CCC[N@@H+]1CC[C@H]1CC[NH2+]C1 ZINC000251361054 188258664 /nfs/dbraw/zinc/25/86/64/188258664.db2.gz DHVUDBOQQPPAHM-CHWSQXEVSA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)C[C@@H](CN(C)C)[NH2+][C@H]1CCSC1 ZINC000037166742 188279428 /nfs/dbraw/zinc/27/94/28/188279428.db2.gz ZPRIELJPHORXIA-RYUDHWBXSA-N 2 0 230.421 2.058 20 0 BEADRP C[C@H]1CCC[N@H+](CCC2CC[NH2+]CC2)[C@H]1C ZINC000252219724 353299351 /nfs/dbraw/zinc/29/93/51/353299351.db2.gz YRTHNYBSOKWNCL-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP CS[C@H](C)C[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000252951168 353313098 /nfs/dbraw/zinc/31/30/98/353313098.db2.gz DPCXQIVTHOEXAU-FDYHWXHSSA-N 2 0 242.432 2.248 20 0 BEADRP CSc1ccc(CN2CCC[NH2+]CC2)cc1 ZINC000036946406 188324765 /nfs/dbraw/zinc/32/47/65/188324765.db2.gz SLOVHLULZYJPLA-UHFFFAOYSA-N 2 0 236.384 2.204 20 0 BEADRP C([C@@H]1CCC[NH2+]C1)[N@@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC000227167742 188330971 /nfs/dbraw/zinc/33/09/71/188330971.db2.gz OKPGHPGGXNNHFU-RDBSUJKOSA-N 2 0 222.376 2.251 20 0 BEADRP Cc1ccc(C[NH2+]CCCC[NH3+])c(C)c1 ZINC000037714585 188337868 /nfs/dbraw/zinc/33/78/68/188337868.db2.gz BYUPVHOUCUMVKC-UHFFFAOYSA-N 2 0 206.333 2.132 20 0 BEADRP CC(C)C[C@@H](C)C[C@H](C)[NH2+]CCC[NH3+] ZINC000308851065 188341264 /nfs/dbraw/zinc/34/12/64/188341264.db2.gz RGWMNOWTMHRVHI-NEPJUHHUSA-N 2 0 200.370 2.386 20 0 BEADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+][C@@H]1CCSC1 ZINC000231348340 353595121 /nfs/dbraw/zinc/59/51/21/353595121.db2.gz LFRXWXHHKJRCCX-FRRDWIJNSA-N 2 0 242.432 2.392 20 0 BEADRP Cc1c[nH+]ccc1N1CCC([NH2+]C(C)C)CC1 ZINC000192559606 353554430 /nfs/dbraw/zinc/55/44/30/353554430.db2.gz LJHUSORDMUHLMM-UHFFFAOYSA-N 2 0 233.359 2.357 20 0 BEADRP CCC[C@@H](C[N@@H+]1CCC[C@@H]([NH+](C)C)CC1)OC ZINC000639106238 353613251 /nfs/dbraw/zinc/61/32/51/353613251.db2.gz XLRLXKYMIRCJJE-KGLIPLIRSA-N 2 0 242.407 2.218 20 0 BEADRP CC(C)C1CC[NH+](C[C@@]2(C)CC[NH2+]C2)CC1 ZINC000232539853 353736885 /nfs/dbraw/zinc/73/68/85/353736885.db2.gz MQKKMWKSATVTFO-AWEZNQCLSA-N 2 0 224.392 2.354 20 0 BEADRP Fc1ccccc1CC[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000128854185 181011497 /nfs/dbraw/zinc/01/14/97/181011497.db2.gz BZJCLIUJWDEHCT-CYBMUJFWSA-N 2 0 236.334 2.100 20 0 BEADRP CC(C)[N@@H+]1CC[C@H](C[NH2+][C@@H](C)[C@@H]2CC2(F)F)C1 ZINC000639170767 354125496 /nfs/dbraw/zinc/12/54/96/354125496.db2.gz XOMWPJIQSGXCFW-TUAOUCFPSA-N 2 0 246.345 2.350 20 0 BEADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)[C@@H]2CC2(F)F)C1 ZINC000639170766 354125847 /nfs/dbraw/zinc/12/58/47/354125847.db2.gz XOMWPJIQSGXCFW-SRVKXCTJSA-N 2 0 246.345 2.350 20 0 BEADRP CCC[C@H](C)C[N@H+](C)[C@@H]1CCC[NH2+]CC1 ZINC000231463821 363344350 /nfs/dbraw/zinc/34/43/50/363344350.db2.gz KPBLXDDUQMBHBY-QWHCGFSZSA-N 2 0 212.381 2.497 20 0 BEADRP CC[C@@H](C)[C@H](C[N@H+](CC)CCC[NH+](C)C)OC ZINC000639175024 354190783 /nfs/dbraw/zinc/19/07/83/354190783.db2.gz GNOBGTUDKUDURI-KGLIPLIRSA-N 2 0 244.423 2.321 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]C[C@@H]2C[C@H]2C2CC2)[C@H](C)C1 ZINC000449742832 202017488 /nfs/dbraw/zinc/01/74/88/202017488.db2.gz RMVGRGVCRSRSRX-UNQGMJICSA-N 2 0 236.403 2.352 20 0 BEADRP C([NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)[C@@H]1C[C@H]1C1CC1 ZINC000449743390 202017880 /nfs/dbraw/zinc/01/78/80/202017880.db2.gz XFZJFYVDUMPKFH-AJNGGQMLSA-N 2 0 234.387 2.249 20 0 BEADRP CCC[N@H+](CCC[NH+](C)C)C[C@@](C)(CC)OC ZINC000639176218 354220251 /nfs/dbraw/zinc/22/02/51/354220251.db2.gz ZGYWLVPZTHJBPR-CQSZACIVSA-N 2 0 244.423 2.465 20 0 BEADRP C[C@H]1CCCC[C@H]1C[NH2+]C[C@H]1CCCN1C ZINC000623634732 366199236 /nfs/dbraw/zinc/19/92/36/366199236.db2.gz YGQYWGSFXQSUSW-MELADBBJSA-N 2 0 224.392 2.497 20 0 BEADRP CCc1cc(N2CC[C@H]3CC[C@@H](C2)[N@@H+]3C)cc[nH+]1 ZINC000334650440 354443250 /nfs/dbraw/zinc/44/32/50/354443250.db2.gz GLRRMWLGUQLKRC-HIFRSBDPSA-N 2 0 245.370 2.317 20 0 BEADRP COc1cc(C)ccc1C[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000578083163 366230707 /nfs/dbraw/zinc/23/07/07/366230707.db2.gz NMPHJPFFPNPTTR-KGLIPLIRSA-N 2 0 248.370 2.363 20 0 BEADRP C([NH2+][C@H]1CCCC12CCC2)[C@@H]1CCC[NH2+]1 ZINC000335128252 354775170 /nfs/dbraw/zinc/77/51/70/354775170.db2.gz GHDFMJRELIIYNO-RYUDHWBXSA-N 2 0 208.349 2.051 20 0 BEADRP COc1cc(C)ccc1C[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000578083165 366231401 /nfs/dbraw/zinc/23/14/01/366231401.db2.gz NMPHJPFFPNPTTR-ZIAGYGMSSA-N 2 0 248.370 2.363 20 0 BEADRP C[C@H]1CCCCC[N@@H+]1CCc1cncn1C ZINC000335145404 354854468 /nfs/dbraw/zinc/85/44/68/354854468.db2.gz CNRTZMSOIKPGLP-LBPRGKRZSA-N 2 0 221.348 2.227 20 0 BEADRP C[C@H]([NH2+][C@H]1CCCCC1(C)C)C1C[NH2+]C1 ZINC000335145918 354856492 /nfs/dbraw/zinc/85/64/92/354856492.db2.gz JRYBAXWVULJNIO-JQWIXIFHSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@@H]1CCC[N@@H+]1C[C@@H]1CC[NH2+][C@@H](C)C1 ZINC000233923324 363410340 /nfs/dbraw/zinc/41/03/40/363410340.db2.gz RWNYEXCVPFQXRV-YNEHKIRRSA-N 2 0 210.365 2.249 20 0 BEADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@H](C)C(C)(C)C ZINC000166032365 354864942 /nfs/dbraw/zinc/86/49/42/354864942.db2.gz NHOSZUCDULHSNH-CHWSQXEVSA-N 2 0 244.423 2.367 20 0 BEADRP Cc1cccc(C)c1C[NH2+][C@@H](C)CC[NH3+] ZINC000235086721 363437648 /nfs/dbraw/zinc/43/76/48/363437648.db2.gz LZJVGEIRTFKPBG-LBPRGKRZSA-N 2 0 206.333 2.130 20 0 BEADRP CC(C)([NH3+])C[NH2+][C@H]1Cc2ccc(Cl)cc2C1 ZINC000335174723 354941956 /nfs/dbraw/zinc/94/19/56/354941956.db2.gz CDCQMTSQIKFKDA-LBPRGKRZSA-N 2 0 238.762 2.134 20 0 BEADRP C[C@@H]([NH3+])c1ccc(N[C@H]2CCC[NH2+]CC2)cc1 ZINC000335178685 354964761 /nfs/dbraw/zinc/96/47/61/354964761.db2.gz ODZVUEDNZQTWOK-YPMHNXCESA-N 2 0 233.359 2.260 20 0 BEADRP CCN1CCCC[C@@H]1C[NH2+][C@H](C)[C@H]1CCCO1 ZINC000346566068 354970340 /nfs/dbraw/zinc/97/03/40/354970340.db2.gz RNAOYIOAIHMMGE-MGPQQGTHSA-N 2 0 240.391 2.018 20 0 BEADRP [NH3+]CC1CC[NH+]([C@@H]2CCc3ccc(F)cc32)CC1 ZINC000335227907 355070070 /nfs/dbraw/zinc/07/00/70/355070070.db2.gz BJIXJGFNIJHCTR-OAHLLOKOSA-N 2 0 248.345 2.484 20 0 BEADRP C[N@H+](Cc1cccc2c1NCC2)CC(C)(C)C[NH3+] ZINC000346694258 355076203 /nfs/dbraw/zinc/07/62/03/355076203.db2.gz TVUSEVULWLBSNX-UHFFFAOYSA-N 2 0 247.386 2.071 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+]Cc1cccs1 ZINC000335219642 355059320 /nfs/dbraw/zinc/05/93/20/355059320.db2.gz UNCJWUNSANICJT-CMPLNLGQSA-N 2 0 224.373 2.226 20 0 BEADRP COc1ccc([C@H]2CCN(CC(C)(C)[NH3+])C2)cc1 ZINC000346828872 355128506 /nfs/dbraw/zinc/12/85/06/355128506.db2.gz JEKLYWHNQVKPEC-ZDUSSCGKSA-N 2 0 248.370 2.222 20 0 BEADRP CC(C)([NH3+])C[N@@H+]1CC[C@@H](Cc2ccccc2)C1 ZINC000346848848 355137684 /nfs/dbraw/zinc/13/76/84/355137684.db2.gz OHYXVMRIIMSYMF-AWEZNQCLSA-N 2 0 232.371 2.288 20 0 BEADRP CC[C@]1(C)CCC[N@H+](C[C@@H]2CCC[NH2+]C2)C1 ZINC000346977892 355211787 /nfs/dbraw/zinc/21/17/87/355211787.db2.gz NECZOWBPQOIPNF-ZIAGYGMSSA-N 2 0 224.392 2.498 20 0 BEADRP CC[N@H+](C)C[C@@H]1CC[NH+](CC[C@H](C)F)C1 ZINC000352003346 134034891 /nfs/dbraw/zinc/03/48/91/134034891.db2.gz LLXTYQZFSNGIHB-RYUDHWBXSA-N 2 0 216.344 2.008 20 0 BEADRP C[C@@H]1CC[N@H+](CC2CC[NH2+]CC2)C[C@@H](C)C1 ZINC000346989550 355189266 /nfs/dbraw/zinc/18/92/66/355189266.db2.gz RTLYOWSUIVNMQK-OLZOCXBDSA-N 2 0 224.392 2.354 20 0 BEADRP Fc1ccc(C2([NH2+]C[C@@H]3CCC[NH2+]C3)CC2)cc1 ZINC000346988559 355189671 /nfs/dbraw/zinc/18/96/71/355189671.db2.gz RGLPRJHGPOPYHI-GFCCVEGCSA-N 2 0 248.345 2.404 20 0 BEADRP CC(C)([NH3+])C[N@H+](C[C@@H]1CCCO1)C1CCCC1 ZINC000346999352 355196968 /nfs/dbraw/zinc/19/69/68/355196968.db2.gz GAUQKWRAUZWZJE-ZDUSSCGKSA-N 2 0 240.391 2.147 20 0 BEADRP C[NH+](C)C[C@H]1CC[N@H+](CC2CCCCC2)C1 ZINC000113511974 355247868 /nfs/dbraw/zinc/24/78/68/355247868.db2.gz IZBBBJXBUZTRNQ-CQSZACIVSA-N 2 0 224.392 2.450 20 0 BEADRP C[N@H+](CCCC[NH2+]C[C@@H]1C[C@H]2C[C@H]2C1)C1CC1 ZINC000639245038 355232874 /nfs/dbraw/zinc/23/28/74/355232874.db2.gz SLQCBLQVKJCMNU-BTTYYORXSA-N 2 0 236.403 2.497 20 0 BEADRP CC[C@@H](C[N@@H+]1CC[C@@H](C[NH+](CC)CC)C1)OC ZINC000412975992 191345910 /nfs/dbraw/zinc/34/59/10/191345910.db2.gz HGJZYKGIVSIXKD-KBPBESRZSA-N 2 0 242.407 2.075 20 0 BEADRP Cc1cc(C[NH2+]C2CC[NH2+]CC2)ccc1Cl ZINC000335281211 355271385 /nfs/dbraw/zinc/27/13/85/355271385.db2.gz ZOXMMBIKLSBHKL-UHFFFAOYSA-N 2 0 238.762 2.490 20 0 BEADRP CC[C@@](C)(C[NH2+]CC[C@H]1CCC[N@H+](C)C1)OC ZINC000639258127 355305053 /nfs/dbraw/zinc/30/50/53/355305053.db2.gz ZWRVMHPHBFYMFM-KGLIPLIRSA-N 2 0 242.407 2.123 20 0 BEADRP CO[C@@H]1CCC[C@H]1[NH2+]CC[C@@H]1CCCC[N@@H+]1C ZINC000216365028 355358324 /nfs/dbraw/zinc/35/83/24/355358324.db2.gz KVAQJPABYDRHAN-BFHYXJOUSA-N 2 0 240.391 2.018 20 0 BEADRP CC[NH+](CC)CCOCC[NH2+][C@@H]1CCC[C@@H]1C ZINC000349674632 355408238 /nfs/dbraw/zinc/40/82/38/355408238.db2.gz ZLARWFKIYYGRHB-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@@H]([NH3+])c1ccc(NC[C@]2(C)CC[NH2+]C2)cc1 ZINC000414800391 191572441 /nfs/dbraw/zinc/57/24/41/191572441.db2.gz HXMGNEOCJSXJLT-BXUZGUMPSA-N 2 0 233.359 2.118 20 0 BEADRP CC1(C)C[C@@H]1C[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000538159264 324659657 /nfs/dbraw/zinc/65/96/57/324659657.db2.gz NOGVUAJXLDJPKQ-CYBMUJFWSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CC[C@H]2CC[NH2+]C2)C[C@H]1C ZINC000414824542 191585657 /nfs/dbraw/zinc/58/56/57/191585657.db2.gz AUVWIUYUHOVFCD-SYQHCUMBSA-N 2 0 224.392 2.400 20 0 BEADRP C[NH2+]CCC[NH2+]C/C=C\c1ccc(F)cc1F ZINC000414858732 191602975 /nfs/dbraw/zinc/60/29/75/191602975.db2.gz KVWHVMISACRTRJ-RQOWECAXSA-N 2 0 240.297 2.177 20 0 BEADRP COCCC1(C[NH2+][C@H](C)CCCC[NH3+])CCC1 ZINC000415006781 191648119 /nfs/dbraw/zinc/64/81/19/191648119.db2.gz AFULPXSIXRUCTG-CYBMUJFWSA-N 2 0 242.407 2.300 20 0 BEADRP [NH3+]C[C@H]1CC[C@H](C[NH2+][C@H]2CCCSC2)CC1 ZINC000415028452 191656638 /nfs/dbraw/zinc/65/66/38/191656638.db2.gz YPXREIRRNMLUNL-AVGNSLFASA-N 2 0 242.432 2.237 20 0 BEADRP [NH3+]C[C@H]1CC[C@H]([NH2+]Cc2cc(F)ccc2F)C1 ZINC000415030708 191657716 /nfs/dbraw/zinc/65/77/16/191657716.db2.gz FWWBSKCKDJMUOO-CABZTGNLSA-N 2 0 240.297 2.182 20 0 BEADRP Cc1cc(N)cc(C[NH2+]C[C@@H]2CC[NH2+][C@H](C)C2)c1 ZINC000414972415 191637236 /nfs/dbraw/zinc/63/72/36/191637236.db2.gz XWWPWTFTFBTCFD-CHWSQXEVSA-N 2 0 247.386 2.055 20 0 BEADRP COc1ccc(C)cc1C[NH2+][C@H]1CC[C@@H](C[NH3+])C1 ZINC000415031129 191657315 /nfs/dbraw/zinc/65/73/15/191657315.db2.gz GMHFIIRHLJNYFK-OCCSQVGLSA-N 2 0 248.370 2.221 20 0 BEADRP C[C@H]1C[C@@H](C[NH2+]Cc2cccc(F)c2)CC[NH2+]1 ZINC000415091319 191676304 /nfs/dbraw/zinc/67/63/04/191676304.db2.gz YWXHFZTYHGLMFW-AAEUAGOBSA-N 2 0 236.334 2.303 20 0 BEADRP C[C@@H]1C[C@@H](C[NH2+]Cc2cccc(F)c2)CC[NH2+]1 ZINC000415091323 191676868 /nfs/dbraw/zinc/67/68/68/191676868.db2.gz YWXHFZTYHGLMFW-YPMHNXCESA-N 2 0 236.334 2.303 20 0 BEADRP C[C@H]1CC2(C[N@@H+]1CC1(C)CC1)CC[NH2+]CC2 ZINC000583559179 355609955 /nfs/dbraw/zinc/60/99/55/355609955.db2.gz JAWZETUXQNMVBU-LBPRGKRZSA-N 2 0 222.376 2.251 20 0 BEADRP [NH3+]C[C@H]1CC[C@H]([NH2+]CC2CCCCC2)C1 ZINC000415046334 191662012 /nfs/dbraw/zinc/66/20/12/191662012.db2.gz UZPIGGYHVFIZLJ-STQMWFEESA-N 2 0 210.365 2.284 20 0 BEADRP CC1(C)CC[C@H]([NH2+][C@@H]2CC[C@H](C[NH3+])C2)C1 ZINC000415047381 191662343 /nfs/dbraw/zinc/66/23/43/191662343.db2.gz WAKTZXPOYKPXFT-TUAOUCFPSA-N 2 0 210.365 2.282 20 0 BEADRP CCC[C@H](C[NH2+]C[C@@H]1CCN1C(C)(C)C)OC ZINC000639303221 355652964 /nfs/dbraw/zinc/65/29/64/355652964.db2.gz NYECCODFQCPNOW-QWHCGFSZSA-N 2 0 242.407 2.264 20 0 BEADRP Cc1ccc(CC[N@@H+](C)CC2CN(C)C2)cc1 ZINC000639309350 355665440 /nfs/dbraw/zinc/66/54/40/355665440.db2.gz MDVJFZNEBRREGF-UHFFFAOYSA-N 2 0 232.371 2.031 20 0 BEADRP CCOc1cccc(C[N@@H+]2C[C@H](C[NH3+])C[C@@H]2C)c1 ZINC000215955892 355619267 /nfs/dbraw/zinc/61/92/67/355619267.db2.gz FQZNAAUGYWLEPT-JSGCOSHPSA-N 2 0 248.370 2.254 20 0 BEADRP Cc1cc(C[N@H+]2C[C@@H](C[NH3+])C[C@@H]2C)ccc1F ZINC000215959969 355620673 /nfs/dbraw/zinc/62/06/73/355620673.db2.gz VVVJAAIQBYLOBH-WCQYABFASA-N 2 0 236.334 2.303 20 0 BEADRP C[N@@H+]1CC[C@]2(CC[NH+]([C@@H]3C=CCCC3)C2)C1 ZINC000335887760 355679927 /nfs/dbraw/zinc/67/99/27/355679927.db2.gz CFBLXFVFIGLAGK-KGLIPLIRSA-N 2 0 220.360 2.123 20 0 BEADRP CC[C@](C)(C[NH2+]C[C@H]1CCCC[N@H+](C)C1)OC ZINC000639345774 355791874 /nfs/dbraw/zinc/79/18/74/355791874.db2.gz ACOBQQIGVLEMGR-ZIAGYGMSSA-N 2 0 242.407 2.123 20 0 BEADRP CC[C@@](C)(C[NH2+]C[C@H]1CCCC[N@H+](C)C1)OC ZINC000639345772 355791972 /nfs/dbraw/zinc/79/19/72/355791972.db2.gz ACOBQQIGVLEMGR-KGLIPLIRSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCCC[N@H+](C)C2)CS1 ZINC000639346598 355793536 /nfs/dbraw/zinc/79/35/36/355793536.db2.gz HMKUZJWSOYHEFS-AGIUHOORSA-N 2 0 242.432 2.202 20 0 BEADRP CCOc1ccc(C[N@@H+]2C[C@H](C[NH3+])C[C@@H]2C)cc1 ZINC000216029051 355797953 /nfs/dbraw/zinc/79/79/53/355797953.db2.gz WGAVVGBFHSRTLX-JSGCOSHPSA-N 2 0 248.370 2.254 20 0 BEADRP Cn1cccc1[C@H]1CCC[N@@H+]1CC1CC[NH2+]CC1 ZINC000336053439 134060898 /nfs/dbraw/zinc/06/08/98/134060898.db2.gz XUKMLNIARFJXER-OAHLLOKOSA-N 2 0 247.386 2.162 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@H]2CCC[C@H]2C)CC1 ZINC000084901969 355872438 /nfs/dbraw/zinc/87/24/38/355872438.db2.gz CFCZJTSLILIARJ-OCCSQVGLSA-N 2 0 224.392 2.497 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]CCCC2CCOCC2)C1 ZINC000582228973 355992672 /nfs/dbraw/zinc/99/26/72/355992672.db2.gz GKVSWVXCHYJPNZ-KGLIPLIRSA-N 2 0 240.391 2.053 20 0 BEADRP C[C@@H]1C[C@H]1C[N@@H+]1CC[C@@H](Oc2ccncc2)C1 ZINC000351471954 355996637 /nfs/dbraw/zinc/99/66/37/355996637.db2.gz NIIQRMBMUPKVHS-MBNYWOFBSA-N 2 0 232.327 2.191 20 0 BEADRP C([NH2+]C1C2CC3CC(C2)CC1C3)[C@H]1CCC[NH2+]1 ZINC000216495194 355996703 /nfs/dbraw/zinc/99/67/03/355996703.db2.gz YYEHWKSTTLJKKR-DUTNFGBUSA-N 2 0 234.387 2.153 20 0 BEADRP CCN1CC[C@H]2CC[C@@H](C1)[N@@H+]2C[C@H]1C[C@@H]1C ZINC000351232408 355965627 /nfs/dbraw/zinc/96/56/27/355965627.db2.gz XWSUUNCHDFJHKY-DGAVXFQQSA-N 2 0 222.376 2.201 20 0 BEADRP CCc1ccccc1C[NH2+][C@@](C)(C[NH3+])C1CC1 ZINC000420295433 192203820 /nfs/dbraw/zinc/20/38/20/192203820.db2.gz VNTXGGYXKOUUBU-HNNXBMFYSA-N 2 0 232.371 2.466 20 0 BEADRP CC[N@H+](CC[C@H]1CC[NH2+]C1)[C@@H](C)C(C)C ZINC000420295764 192204214 /nfs/dbraw/zinc/20/42/14/192204214.db2.gz CQJMFDHACRFTMD-QWHCGFSZSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H]([NH3+])C[N@@H+]1CCC[C@@H]1CCc1ccccc1 ZINC000420297419 192204599 /nfs/dbraw/zinc/20/45/99/192204599.db2.gz DIIBBELAXOBEGU-DZGCQCFKSA-N 2 0 232.371 2.431 20 0 BEADRP C[C@@H](c1cccc(O)c1)[N@H+](C)CC[C@H]1CC[NH2+]C1 ZINC000420296023 192204919 /nfs/dbraw/zinc/20/49/19/192204919.db2.gz CVTSRNJMUXOYCM-QWHCGFSZSA-N 2 0 248.370 2.385 20 0 BEADRP CCC[C@H]1CCC[N@H+](CC[C@@H]2CC[NH2+]C2)C1 ZINC000420297079 192205579 /nfs/dbraw/zinc/20/55/79/192205579.db2.gz FINZSZGNUHZINE-KBPBESRZSA-N 2 0 224.392 2.498 20 0 BEADRP CC(C)C[N@@H+](Cc1ccccc1)C[C@@H](C)[NH3+] ZINC000420296876 192205961 /nfs/dbraw/zinc/20/59/61/192205961.db2.gz CILFCLXPBYHNJA-CYBMUJFWSA-N 2 0 220.360 2.492 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CCC[N@H+](CC[C@@H]2CCCCO2)C1 ZINC000420281781 192199777 /nfs/dbraw/zinc/19/97/77/192199777.db2.gz AJWSCCZZTMMPFP-MJBXVCDLSA-N 2 0 240.391 2.005 20 0 BEADRP [NH3+]CC[C@H]1CCC[N@H+](CC[C@@H]2CCCCO2)C1 ZINC000420321216 192200519 /nfs/dbraw/zinc/20/05/19/192200519.db2.gz ZSZYPPZYGPUWIU-KGLIPLIRSA-N 2 0 240.391 2.006 20 0 BEADRP C[C@@H]([NH3+])[C@H]1CCC[N@H+](CCCc2ccncc2)C1 ZINC000420292677 192202571 /nfs/dbraw/zinc/20/25/71/192202571.db2.gz PVJXNQJUOOGUTD-HIFRSBDPSA-N 2 0 247.386 2.073 20 0 BEADRP [NH3+]CCC[N@H+](CCCF)CC1CCCC1 ZINC000420316338 192213452 /nfs/dbraw/zinc/21/34/52/192213452.db2.gz NKUITXHZDADBOJ-UHFFFAOYSA-N 2 0 216.344 2.187 20 0 BEADRP CCCCC[N@@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1 ZINC000420331968 192213822 /nfs/dbraw/zinc/21/38/22/192213822.db2.gz CJEJVYJODXASAW-KBPBESRZSA-N 2 0 224.392 2.498 20 0 BEADRP Cc1ccc(CCN2CCC[C@H]3C[NH2+]C[C@H]32)cc1 ZINC000420339585 192215916 /nfs/dbraw/zinc/21/59/16/192215916.db2.gz MAYJGQUYCIFHAQ-JKSUJKDBSA-N 2 0 244.382 2.221 20 0 BEADRP CO[C@@H](C)C[N@H+](CC[C@H]1CCC[NH2+]C1)C(C)C ZINC000420307609 192208237 /nfs/dbraw/zinc/20/82/37/192208237.db2.gz RNVPFAFZGIYJSK-UONOGXRCSA-N 2 0 242.407 2.121 20 0 BEADRP CC(C)[C@@H]1C[N@H+](CC[C@H]2CC[NH2+]C2)CCS1 ZINC000420314103 192212139 /nfs/dbraw/zinc/21/21/39/192212139.db2.gz YSVUWFCXCCTVGV-OLZOCXBDSA-N 2 0 242.432 2.059 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]1[NH2+]CCCCCF ZINC000420372066 192228870 /nfs/dbraw/zinc/22/88/70/192228870.db2.gz XWJAYLUNYWXDQB-LLVKDONJSA-N 2 0 216.344 2.104 20 0 BEADRP CC[N@H+](C[C@@H](C[NH3+])c1ccc(OC)cc1)C1CC1 ZINC000420326241 192230110 /nfs/dbraw/zinc/23/01/10/192230110.db2.gz XAMRXKFARCAMPQ-CYBMUJFWSA-N 2 0 248.370 2.222 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]1[NH2+]CCCCCF ZINC000420372067 192230476 /nfs/dbraw/zinc/23/04/76/192230476.db2.gz XWJAYLUNYWXDQB-NSHDSACASA-N 2 0 216.344 2.104 20 0 BEADRP c1cncc([C@H]2CCC[N@H+]2CC[C@H]2CC[NH2+]C2)c1 ZINC000420354796 192219070 /nfs/dbraw/zinc/21/90/70/192219070.db2.gz DKELWUYPNHISHL-UKRRQHHQSA-N 2 0 245.370 2.218 20 0 BEADRP c1cc([C@@H]2CCC[N@H+]2CC[C@H]2CC[NH2+]C2)ccn1 ZINC000420363488 192223747 /nfs/dbraw/zinc/22/37/47/192223747.db2.gz PHBXAVVNPDHRNG-HIFRSBDPSA-N 2 0 245.370 2.218 20 0 BEADRP CCCC[NH+]1CCC([C@H]2C[C@H]([NH3+])CCO2)CC1 ZINC000420383143 192235700 /nfs/dbraw/zinc/23/57/00/192235700.db2.gz FEOWEDCDRSLDBO-ZIAGYGMSSA-N 2 0 240.391 2.005 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1CCCC[C@H]1C(C)C ZINC000420395542 192237324 /nfs/dbraw/zinc/23/73/24/192237324.db2.gz DMSQANOYWNOLPB-QWHCGFSZSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H]([NH3+])C[NH2+][C@H](C)C(C)(C)c1ccccc1 ZINC000420411527 192239115 /nfs/dbraw/zinc/23/91/15/192239115.db2.gz RTDGAHDIGOZBKI-VXGBXAGGSA-N 2 0 220.360 2.290 20 0 BEADRP CCCC[N@@H+]1CCCC[C@@H]1[C@@H]1CC[NH2+]C1 ZINC000420409529 192239200 /nfs/dbraw/zinc/23/92/00/192239200.db2.gz XFHIXICTTJSTMH-CHWSQXEVSA-N 2 0 210.365 2.251 20 0 BEADRP CCCC[N@@H+]1CCCC[C@H]1[C@@H]1CC[NH2+]C1 ZINC000420409530 192239683 /nfs/dbraw/zinc/23/96/83/192239683.db2.gz XFHIXICTTJSTMH-OLZOCXBDSA-N 2 0 210.365 2.251 20 0 BEADRP CC(C)CC[C@@H]1CCC[C@H]1[NH2+]CCOCC[NH3+] ZINC000420417313 192240514 /nfs/dbraw/zinc/24/05/14/192240514.db2.gz WIVFRPFLJZHNED-UONOGXRCSA-N 2 0 242.407 2.156 20 0 BEADRP CC(C)[C@@H]1CCCC[C@H]1[NH2+]C[C@H]1CC[NH2+]C1 ZINC000420421209 192241855 /nfs/dbraw/zinc/24/18/55/192241855.db2.gz YNJXKJMFQJOALK-MELADBBJSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)c1cccnc1 ZINC000420379296 192233536 /nfs/dbraw/zinc/23/35/36/192233536.db2.gz VAKWARVCVAYKRB-STQMWFEESA-N 2 0 233.359 2.122 20 0 BEADRP C[C@H]1CC[N@H+](Cc2cccs2)C[C@@H]1C[NH3+] ZINC000167598974 134118861 /nfs/dbraw/zinc/11/88/61/134118861.db2.gz GOSSCKJLDSKVQF-QWRGUYRKSA-N 2 0 224.373 2.165 20 0 BEADRP CCCCOCC[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@H]1C ZINC000249613228 535313357 /nfs/dbraw/zinc/31/33/57/535313357.db2.gz IFZFBRCSFFJZCR-MGPQQGTHSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]CCC(C)(C)C ZINC000422945027 192512648 /nfs/dbraw/zinc/51/26/48/192512648.db2.gz SYMRZDWZPXWVTN-VXGBXAGGSA-N 2 0 212.381 2.400 20 0 BEADRP CCC1CCC([NH2+][C@@H]2CCC[C@@H]2[NH3+])CC1 ZINC000335426492 535321923 /nfs/dbraw/zinc/32/19/23/535321923.db2.gz WTXPNXIDXJDJRV-IFWUJCSASA-N 2 0 210.365 2.425 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H]1CCCC(F)(F)C1 ZINC000422987872 192519200 /nfs/dbraw/zinc/51/92/00/192519200.db2.gz HOONMUSMLBXTIN-ZJUUUORDSA-N 2 0 220.307 2.281 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H](C)CCC[NH3+])cc1 ZINC000422982294 192518213 /nfs/dbraw/zinc/51/82/13/192518213.db2.gz QFBBOLWVNMQXJX-ZDUSSCGKSA-N 2 0 220.360 2.255 20 0 BEADRP COc1cc(F)cc(C[NH2+][C@@H](C)CCC[NH3+])c1 ZINC000423015380 192540713 /nfs/dbraw/zinc/54/07/13/192540713.db2.gz KOTQFWAIJCYQOI-JTQLQIEISA-N 2 0 240.322 2.051 20 0 BEADRP CCC[C@@H](C)C[N@@H+]1CCC[C@@H](C[NH2+]C)C1 ZINC000223496045 535326715 /nfs/dbraw/zinc/32/67/15/535326715.db2.gz QMZLCKLSOMTUCN-OLZOCXBDSA-N 2 0 212.381 2.354 20 0 BEADRP CCc1cc(NCCC[NH+]2CCCCC2)cc[nH+]1 ZINC000450230028 202101636 /nfs/dbraw/zinc/10/16/36/202101636.db2.gz YQOIBHXEKUKANN-UHFFFAOYSA-N 2 0 247.386 2.354 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CCC[C@H]1CCCCO1 ZINC000423036507 192547788 /nfs/dbraw/zinc/54/77/88/192547788.db2.gz LEVZWJDLRXQVSG-UONOGXRCSA-N 2 0 242.407 2.443 20 0 BEADRP C[C@@H](C[NH2+]C1CCC(C[NH3+])CC1)C(F)(F)F ZINC000423044372 192550244 /nfs/dbraw/zinc/55/02/44/192550244.db2.gz AKJWLTAMZSSIRJ-IDKOKCKLSA-N 2 0 238.297 2.292 20 0 BEADRP C[C@@H](CN(C)C)[NH2+][C@H]1CC[C@@H](C)[C@@H](C)C1 ZINC000130079509 325010505 /nfs/dbraw/zinc/01/05/05/325010505.db2.gz QWLHOFMKXYBXAW-VOAKCMCISA-N 2 0 212.381 2.351 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CCCc1ccccc1F ZINC000423093176 192566064 /nfs/dbraw/zinc/56/60/64/192566064.db2.gz GFZPHJZHLQVCKG-GFCCVEGCSA-N 2 0 238.350 2.475 20 0 BEADRP CCCC[N@@H+]1CCC2(C1)CC[NH+](C)CC2 ZINC000639757342 356663574 /nfs/dbraw/zinc/66/35/74/356663574.db2.gz GPAUTVZCWYJMRG-UHFFFAOYSA-N 2 0 210.365 2.204 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@H]1CCCC12CCOCC2 ZINC000423116696 192573238 /nfs/dbraw/zinc/57/32/38/192573238.db2.gz RCTUAXKNLMWYJE-STQMWFEESA-N 2 0 240.391 2.053 20 0 BEADRP CCc1cc(N[C@H](C)C(C)(C)C[NH+](C)C)cc[nH+]1 ZINC000450351558 202140325 /nfs/dbraw/zinc/14/03/25/202140325.db2.gz VLJSRUADHYIUHP-GFCCVEGCSA-N 2 0 249.402 2.454 20 0 BEADRP Cc1ccc(CC[NH2+][C@H]2CCCCC[C@@H]2[NH3+])cn1 ZINC000563951295 356664967 /nfs/dbraw/zinc/66/49/67/356664967.db2.gz XUXHHLIASPAJBJ-GJZGRUSLSA-N 2 0 247.386 2.182 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]C[C@@H]1CCCSC1 ZINC000423119359 192575171 /nfs/dbraw/zinc/57/51/71/192575171.db2.gz DQTDHPXXMCUYIQ-YNEHKIRRSA-N 2 0 242.432 2.379 20 0 BEADRP Cc1cccnc1C(C)(C)C[NH2+][C@@H](C)CCC[NH3+] ZINC000423141698 192584505 /nfs/dbraw/zinc/58/45/05/192584505.db2.gz RJNWOBXDNWOMTJ-ZDUSSCGKSA-N 2 0 249.402 2.385 20 0 BEADRP CCC[C@H](C[NH2+][C@@H]1CCCCC[C@@H]1[NH3+])OC ZINC000423144611 192586407 /nfs/dbraw/zinc/58/64/07/192586407.db2.gz HNAXCDXNLUJMLK-FRRDWIJNSA-N 2 0 228.380 2.051 20 0 BEADRP CC(C)[C@@H]1C[C@H]1C[NH2+][C@@H](C)[C@@H]1CCC[NH2+]1 ZINC000423146503 192588347 /nfs/dbraw/zinc/58/83/47/192588347.db2.gz AOTQQQRRTOREDZ-CYDGBPFRSA-N 2 0 210.365 2.009 20 0 BEADRP C[NH+](C)C[C@H]1CC[N@H+](C[C@H]2CCC(F)(F)C2)C1 ZINC000450408141 202156522 /nfs/dbraw/zinc/15/65/22/202156522.db2.gz VFBVJJBRAKYHHP-NWDGAFQWSA-N 2 0 246.345 2.305 20 0 BEADRP CCC[N@H+](C)CCC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000086573169 538557313 /nfs/dbraw/zinc/55/73/13/538557313.db2.gz OIPJRQXRQWZXIN-YHWZYXNKSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]Cc1cccc(F)c1F ZINC000583681132 356706998 /nfs/dbraw/zinc/70/69/98/356706998.db2.gz DLTZAVHOXOWCOR-VIFPVBQESA-N 2 0 228.286 2.182 20 0 BEADRP CCC[NH+](C)[C@H](C)CC[N@@H+](C)CCC ZINC000153331336 538568349 /nfs/dbraw/zinc/56/83/49/538568349.db2.gz CLEUYPOQRBDAEB-GFCCVEGCSA-N 2 0 200.370 2.449 20 0 BEADRP CCC(=O)CCC[N@H+](C)[C@H]1CCN(C)[C@@H](C)C1 ZINC000450467074 202174089 /nfs/dbraw/zinc/17/40/89/202174089.db2.gz KHULMFFBGCUZJR-STQMWFEESA-N 2 0 240.391 2.160 20 0 BEADRP CCC(=O)CCC[N@H+](C)[C@H]1CCN(C)[C@H](C)C1 ZINC000450467072 202174308 /nfs/dbraw/zinc/17/43/08/202174308.db2.gz KHULMFFBGCUZJR-OLZOCXBDSA-N 2 0 240.391 2.160 20 0 BEADRP CC/C=C\C[NH2+][C@H](C)c1ccc(C[NH3+])nc1C ZINC000423152190 192591774 /nfs/dbraw/zinc/59/17/74/192591774.db2.gz DXTNKMUTDPPGFP-ISALQUGTSA-N 2 0 233.359 2.466 20 0 BEADRP COCC1(C[NH2+][C@@H](C)CCCC[NH3+])CCCC1 ZINC000423158537 192595186 /nfs/dbraw/zinc/59/51/86/192595186.db2.gz DCWMPRBZHVQMSG-ZDUSSCGKSA-N 2 0 242.407 2.300 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@H]2CC2(C)C)CC1(C)C ZINC000623371750 356880800 /nfs/dbraw/zinc/88/08/00/356880800.db2.gz QASGQYUHENUMBV-QWRGUYRKSA-N 2 0 210.365 2.247 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[C@@H]1C1CC1)C1C[NH2+]C1 ZINC000423168708 192604747 /nfs/dbraw/zinc/60/47/47/192604747.db2.gz HYRVUPQRWCCGIA-VHRBIJSZSA-N 2 0 222.376 2.010 20 0 BEADRP CC[NH+]1CCC(CC[NH2+][C@@H](C)[C@@H](C)OC)CC1 ZINC000361766898 356936877 /nfs/dbraw/zinc/93/68/77/356936877.db2.gz AGDXURDGWYXDOX-QWHCGFSZSA-N 2 0 242.407 2.121 20 0 BEADRP C([C@H]1CCCC[NH2+]C1)[NH+]1CCCCCC1 ZINC000257651213 538739496 /nfs/dbraw/zinc/73/94/96/538739496.db2.gz GAKLNLFHTKMVHK-ZDUSSCGKSA-N 2 0 210.365 2.252 20 0 BEADRP C[C@@H](C[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1)C1CC1 ZINC000623375494 356894718 /nfs/dbraw/zinc/89/47/18/356894718.db2.gz PZFTWUNHJZWXSK-WCQYABFASA-N 2 0 224.392 2.495 20 0 BEADRP CCOc1ccc([C@H](C)[NH2+]CCC[NH2+]C)cc1 ZINC000423192709 192618363 /nfs/dbraw/zinc/61/83/63/192618363.db2.gz VUJHIGOZUOCZMW-LBPRGKRZSA-N 2 0 236.359 2.345 20 0 BEADRP Cc1ccc2c(c1)[C@@H]([NH2+]CCC[NH3+])CCC2 ZINC000423196844 192622356 /nfs/dbraw/zinc/62/23/56/192622356.db2.gz WPECGYWDIFQOIY-AWEZNQCLSA-N 2 0 218.344 2.311 20 0 BEADRP Cc1nc2c(s1)[C@H]([NH2+]CC[C@H](C)[NH3+])CCC2 ZINC000423225655 192636705 /nfs/dbraw/zinc/63/67/05/192636705.db2.gz NRATZRUEGKOQLM-WCBMZHEXSA-N 2 0 239.388 2.156 20 0 BEADRP C[C@@H](C[NH2+]C1CCC(C)CC1)C[NH+](C)C ZINC000389641876 357007869 /nfs/dbraw/zinc/00/78/69/357007869.db2.gz QVXWOAZULLXRDX-CPCZMJQVSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H](CC(C)(C)C)[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000423238390 192645801 /nfs/dbraw/zinc/64/58/01/192645801.db2.gz ACZVINVNVPZTIO-RYUDHWBXSA-N 2 0 212.381 2.400 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+]C2CC(C)(C)C2)C1 ZINC000389864298 357057316 /nfs/dbraw/zinc/05/73/16/357057316.db2.gz FYJHWSZXYPGKHP-LLVKDONJSA-N 2 0 210.365 2.106 20 0 BEADRP CC[NH+]1CCC(CCC[N@H+](C)CCOC)CC1 ZINC000122048036 357162411 /nfs/dbraw/zinc/16/24/11/357162411.db2.gz UVFOGBWEEOWRFS-UHFFFAOYSA-N 2 0 242.407 2.077 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@@H]1CCC[C@@H]2C[C@@]21C ZINC000423267365 192662034 /nfs/dbraw/zinc/66/20/34/192662034.db2.gz FKQUEAMAUCCEOQ-LPWJVIDDSA-N 2 0 210.365 2.138 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@H]1CCC[C@@H]1CCCF ZINC000423266952 192662121 /nfs/dbraw/zinc/66/21/21/192662121.db2.gz FACRDQBSYQZYNE-UPJWGTAASA-N 2 0 230.371 2.478 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]CC1CC(C)(C)C1 ZINC000393802928 357299907 /nfs/dbraw/zinc/29/99/07/357299907.db2.gz UPCRDYUVFNVJHH-YPMHNXCESA-N 2 0 224.392 2.352 20 0 BEADRP CCN(CC)C[C@H](C)[NH2+][C@@H](C)[C@H]1CCCOC1 ZINC000356849533 538819238 /nfs/dbraw/zinc/81/92/38/538819238.db2.gz PSLANNGPNUUWMM-IHRRRGAJSA-N 2 0 242.407 2.121 20 0 BEADRP Cc1cccnc1CN1CC2CCC1(C[NH3+])CC2 ZINC000582556631 357343130 /nfs/dbraw/zinc/34/31/30/357343130.db2.gz MMEYFVHCTNDTIE-UHFFFAOYSA-N 2 0 245.370 2.093 20 0 BEADRP CC[C@H]([NH2+][C@H]1CCC[C@@H](F)C1)[C@@H]1CCC[NH2+]1 ZINC000582606942 357349242 /nfs/dbraw/zinc/34/92/42/357349242.db2.gz ZZPPBYXOJVSCQQ-VOAKCMCISA-N 2 0 228.355 2.387 20 0 BEADRP CC[C@@H]1CCC[C@H](C[N@H+](C)CCC[NH3+])C1 ZINC000394504800 357363227 /nfs/dbraw/zinc/36/32/27/357363227.db2.gz FCASSFUWLJELPC-OLZOCXBDSA-N 2 0 212.381 2.483 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]C1CC(C)(C)C1 ZINC000395193030 357417072 /nfs/dbraw/zinc/41/70/72/357417072.db2.gz ZCSATZOTOPTCNG-NTZNESFSSA-N 2 0 224.392 2.493 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@H](C)CCCOC)CC1 ZINC000395421490 357432912 /nfs/dbraw/zinc/43/29/12/357432912.db2.gz UAHURGZGSOCBRD-CYBMUJFWSA-N 2 0 242.407 2.123 20 0 BEADRP Cc1ccsc1CC[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000582915657 357436035 /nfs/dbraw/zinc/43/60/35/357436035.db2.gz IJSIHIILWSZDFG-VXGBXAGGSA-N 2 0 238.400 2.459 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@@H](Cc1ccccc1)C1CC1 ZINC000423302872 192690383 /nfs/dbraw/zinc/69/03/83/192690383.db2.gz WDRWGJOWWFVCHZ-WFASDCNBSA-N 2 0 232.371 2.192 20 0 BEADRP CCC[C@]1([NH2+]CCc2ccncc2C)CCOC1 ZINC000397542524 357573521 /nfs/dbraw/zinc/57/35/21/357573521.db2.gz YFGDQBWHBIJHPU-HNNXBMFYSA-N 2 0 248.370 2.481 20 0 BEADRP CC(C)CSCC[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000397364322 357513638 /nfs/dbraw/zinc/51/36/38/357513638.db2.gz YOBOWTSRLPYYAW-NWDGAFQWSA-N 2 0 230.421 2.235 20 0 BEADRP Cc1cnccc1C[N@@H+]1C[C@H](C[NH3+])[C@@H](C)C[C@H]1C ZINC000397487375 357515876 /nfs/dbraw/zinc/51/58/76/357515876.db2.gz WHIJTFVAPMHXQS-LNSITVRQSA-N 2 0 247.386 2.195 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@H]2CC[C@H](C)C2)CC1 ZINC000230407067 357539480 /nfs/dbraw/zinc/53/94/80/357539480.db2.gz CNAYQKFNFDKNPK-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]([NH2+]CCC[NH+]1CCCCC1)[C@@H]1C[C@H]1C ZINC000321553216 357589435 /nfs/dbraw/zinc/58/94/35/357589435.db2.gz MAKBSYBNIGMPEA-HZSPNIEDSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)C1CC1 ZINC000159978955 538881062 /nfs/dbraw/zinc/88/10/62/538881062.db2.gz SDFPXNQBIRETAY-KWCYVHTRSA-N 2 0 222.376 2.249 20 0 BEADRP CCC(=O)CCC[NH+]1CCC(C[NH+](C)C)CC1 ZINC000232851965 357685114 /nfs/dbraw/zinc/68/51/14/357685114.db2.gz NQRXHAAZJYNTSK-UHFFFAOYSA-N 2 0 240.391 2.019 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H](C)c1sc(C)nc1C ZINC000086070549 357818280 /nfs/dbraw/zinc/81/82/80/357818280.db2.gz UUJDSZMFMCCYKP-RKDXNWHRSA-N 2 0 241.404 2.266 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+]CC1CCC(C)CC1 ZINC000234713818 357826780 /nfs/dbraw/zinc/82/67/80/357826780.db2.gz HNCCWBYBCBHFDI-JXQTWKCFSA-N 2 0 242.407 2.156 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+]C[C@H]1CCCC[C@@H]1C ZINC000234791908 357829063 /nfs/dbraw/zinc/82/90/63/357829063.db2.gz OCNSODWSZBUFNA-MJBXVCDLSA-N 2 0 242.407 2.156 20 0 BEADRP CC(C)[NH2+]CCC[NH2+][C@H]1CC[C@@H]1C(C)C ZINC000583316291 357898440 /nfs/dbraw/zinc/89/84/40/357898440.db2.gz FOGQWMHTUOMUTO-OLZOCXBDSA-N 2 0 212.381 2.399 20 0 BEADRP CC(C)=CC[NH2+][C@@H]1CCC[C@H]1[C@H]1CCC[NH2+]1 ZINC000261561820 535371256 /nfs/dbraw/zinc/37/12/56/535371256.db2.gz AWPLBJJNGHPMOS-MGPQQGTHSA-N 2 0 222.376 2.463 20 0 BEADRP CC(C)C[C@H](C[NH3+])NCc1cccc(F)c1F ZINC000583740341 357931610 /nfs/dbraw/zinc/93/16/10/357931610.db2.gz RRBYTTNDEKZUDE-LLVKDONJSA-N 2 0 242.313 2.428 20 0 BEADRP Cc1csc([C@H](C)N[C@H]2CCC[NH2+]CC2)n1 ZINC000168759074 134247672 /nfs/dbraw/zinc/24/76/72/134247672.db2.gz RSWHLDDYOOJHQD-QWRGUYRKSA-N 2 0 239.388 2.244 20 0 BEADRP Cc1ccsc1C[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000168771620 134247744 /nfs/dbraw/zinc/24/77/44/134247744.db2.gz UTVHXAAMPYIYDO-LLVKDONJSA-N 2 0 224.373 2.288 20 0 BEADRP CC[NH+](CC)CCC[NH2+]C(C1CC1)C1CC1 ZINC000036984067 358054823 /nfs/dbraw/zinc/05/48/23/358054823.db2.gz JPLFRQRPNCBRMS-UHFFFAOYSA-N 2 0 224.392 2.497 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+]C(C2CC2)C2CC2)C1 ZINC000037484242 358072795 /nfs/dbraw/zinc/07/27/95/358072795.db2.gz UGRQIMHAELXZIR-LLVKDONJSA-N 2 0 222.376 2.106 20 0 BEADRP C[NH+](C)CC1CC[NH+](CC2(C)CC2)CC1 ZINC000584565731 358060505 /nfs/dbraw/zinc/06/05/05/358060505.db2.gz UDFFRIQRUCFONU-UHFFFAOYSA-N 2 0 210.365 2.060 20 0 BEADRP c1cc(CC[NH2+][C@H]2CCC[NH2+]CC2)cs1 ZINC000168737173 134248024 /nfs/dbraw/zinc/24/80/24/134248024.db2.gz PRHXSLGVSFULGJ-LBPRGKRZSA-N 2 0 224.373 2.022 20 0 BEADRP C[C@H]1CCC[C@H]([NH2+]C2CC([NH+](C)C)C2)C1 ZINC000584790307 358179716 /nfs/dbraw/zinc/17/97/16/358179716.db2.gz LNYAFTBZEXOAHE-ZSVAQUKISA-N 2 0 210.365 2.247 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000222907660 358216415 /nfs/dbraw/zinc/21/64/15/358216415.db2.gz JPLZWDBXRKWRSG-JHJVBQTASA-N 2 0 236.359 2.460 20 0 BEADRP CC(C)OCCCC[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000224969801 358243447 /nfs/dbraw/zinc/24/34/47/358243447.db2.gz KUSBPPIWHCNXCD-STQMWFEESA-N 2 0 228.380 2.051 20 0 BEADRP CSCC[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000172434633 134266005 /nfs/dbraw/zinc/26/60/05/134266005.db2.gz LZXVLDIHPLIOHH-CYBMUJFWSA-N 2 0 242.432 2.300 20 0 BEADRP C[C@]1(C[N@@H+]2CC[C@@H]3CCCC[C@@H]32)CC[NH2+]C1 ZINC000226595332 358340776 /nfs/dbraw/zinc/34/07/76/358340776.db2.gz XUIRUNFHFATIGK-IHRRRGAJSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@@H]1C[N@@H+](CC[C@H]2CCC[NH2+]C2)C[C@H](C)S1 ZINC000226670227 358342473 /nfs/dbraw/zinc/34/24/73/358342473.db2.gz MQHKKZVZXIQPKM-FRRDWIJNSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H](c1ccccc1F)[N@@H+]1CC[C@@H](C[NH3+])C1 ZINC000219122130 134274467 /nfs/dbraw/zinc/27/44/67/134274467.db2.gz DCZNYNSJWHXWJD-QWRGUYRKSA-N 2 0 222.307 2.167 20 0 BEADRP C[C@H](CC[N@H+](C)CCC[NH3+])c1ccccc1 ZINC000227744515 358362932 /nfs/dbraw/zinc/36/29/32/358362932.db2.gz KODNGUBUBKGHTO-CYBMUJFWSA-N 2 0 220.360 2.461 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@H](C)C(C)C)CC1 ZINC000044517469 358388621 /nfs/dbraw/zinc/38/86/21/358388621.db2.gz LRLGGKNFJJUYBA-GFCCVEGCSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@]1(C[NH3+])CC[N@H+](CCCOc2ccccc2)C1 ZINC000235706936 358447829 /nfs/dbraw/zinc/44/78/29/358447829.db2.gz OOTMFISGQXQRMT-OAHLLOKOSA-N 2 0 248.370 2.126 20 0 BEADRP C[C@H]([NH2+]CC1(C[NH+](C)C)CCCC1)C1CC1 ZINC000135016058 325388850 /nfs/dbraw/zinc/38/88/50/325388850.db2.gz KGKMMOLCOMTWLN-LBPRGKRZSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@H]1CCCC[C@H]1[NH2+]CCOCC[NH+](C)C ZINC000219319204 134281441 /nfs/dbraw/zinc/28/14/41/134281441.db2.gz ADUSIJYVSWWVMT-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP CC[NH+]1CCC([NH2+]CCOCCC(C)C)CC1 ZINC000045093813 358558750 /nfs/dbraw/zinc/55/87/50/358558750.db2.gz XWZILEBUFVJIRQ-UHFFFAOYSA-N 2 0 242.407 2.123 20 0 BEADRP CCCCOCC[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000127999644 358568614 /nfs/dbraw/zinc/56/86/14/358568614.db2.gz XTPIKNBNZCNBEZ-UONOGXRCSA-N 2 0 240.391 2.020 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)C1CCC1 ZINC000132416712 491135908 /nfs/dbraw/zinc/13/59/08/491135908.db2.gz XAYYSTZSAJEYPP-FPMFFAJLSA-N 2 0 222.376 2.391 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000132078684 358705302 /nfs/dbraw/zinc/70/53/02/358705302.db2.gz XHIBOUBAEPTLBU-HUUCEWRRSA-N 2 0 247.386 2.063 20 0 BEADRP C[C@H](CC[NH+](C)C)N[C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000132059622 358705660 /nfs/dbraw/zinc/70/56/60/358705660.db2.gz KZVOSBBGCYLGHT-BYCMXARLSA-N 2 0 247.386 2.061 20 0 BEADRP CCOCCC[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000131914791 358700034 /nfs/dbraw/zinc/70/00/34/358700034.db2.gz PZQVMLMDWRBCJU-ZIAGYGMSSA-N 2 0 234.343 2.147 20 0 BEADRP CC[C@H](CCO)C[NH2+][C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000132184639 358709539 /nfs/dbraw/zinc/70/95/39/358709539.db2.gz MBRODTKYPCJFLK-UGFHNGPFSA-N 2 0 248.370 2.129 20 0 BEADRP C[C@H](CC1CC1)[NH2+][C@@H]1CCN2CCCC[C@H]12 ZINC000132402313 358722542 /nfs/dbraw/zinc/72/25/42/358722542.db2.gz SIYXPCRGCOCYCW-MRVWCRGKSA-N 2 0 222.376 2.391 20 0 BEADRP CC[C@H](CCO)[NH2+][C@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000134355865 358787580 /nfs/dbraw/zinc/78/75/80/358787580.db2.gz UFPOFZRAOFJBBF-MCIONIFRSA-N 2 0 242.407 2.048 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[NH2+]CCN1CCCC1 ZINC000134841634 358807635 /nfs/dbraw/zinc/80/76/35/358807635.db2.gz NMAZHTIALYSFNM-ZIAGYGMSSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@H]1CCCC[C@@H]1C[NH2+]CCN1CCCC1 ZINC000134841653 358807993 /nfs/dbraw/zinc/80/79/93/358807993.db2.gz NMAZHTIALYSFNM-UONOGXRCSA-N 2 0 224.392 2.498 20 0 BEADRP CC(C)Oc1cccc(C[NH2+][C@@H](C)CC[NH3+])c1 ZINC000136138055 358864960 /nfs/dbraw/zinc/86/49/60/358864960.db2.gz KSQJLJYDYLVRLM-LBPRGKRZSA-N 2 0 236.359 2.301 20 0 BEADRP C[C@H]([NH2+]Cc1ccc(C[NH3+])cc1)[C@H]1CCCOC1 ZINC000578324014 366512354 /nfs/dbraw/zinc/51/23/54/366512354.db2.gz CJHVTTGBNIRXMJ-WFASDCNBSA-N 2 0 248.370 2.050 20 0 BEADRP CCC[NH+]1CCC([NH2+]C[C@H]2C[C@@H]2C)CC1 ZINC000132739777 491138124 /nfs/dbraw/zinc/13/81/24/491138124.db2.gz DEYKNBJYLDNMLT-NWDGAFQWSA-N 2 0 210.365 2.106 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]CCc2ccsc2)C1 ZINC000086403618 358968119 /nfs/dbraw/zinc/96/81/19/358968119.db2.gz LDWGYNNUBMCVPM-VXGBXAGGSA-N 2 0 224.373 2.150 20 0 BEADRP [NH3+][C@H](C[NH2+][C@@H]1CCC[C@@H]1CCCF)C1CC1 ZINC000423317182 192702316 /nfs/dbraw/zinc/70/23/16/192702316.db2.gz KAWQMZGXGIRGHU-JHJVBQTASA-N 2 0 228.355 2.232 20 0 BEADRP [NH3+]CCCC[NH2+][C@@H]1CCC[C@H]1CCCF ZINC000423332281 192713923 /nfs/dbraw/zinc/71/39/23/192713923.db2.gz QRXQXGAQRIHIDS-NWDGAFQWSA-N 2 0 216.344 2.233 20 0 BEADRP Cc1cccc2c1CC[C@@H]2[NH2+]CCCC[NH3+] ZINC000423345667 192722182 /nfs/dbraw/zinc/72/21/82/192722182.db2.gz YBPNIACIWBXSJX-AWEZNQCLSA-N 2 0 218.344 2.311 20 0 BEADRP CC[C@H]([NH2+]C[C@H]1CC[NH2+]C1)c1ccccc1OC ZINC000423348068 192724381 /nfs/dbraw/zinc/72/43/81/192724381.db2.gz SLHGHGLRESAWQF-JSGCOSHPSA-N 2 0 248.370 2.345 20 0 BEADRP CC[C@@H]([NH2+]CC1(COC)CC[NH2+]CC1)C(C)C ZINC000423402798 192744239 /nfs/dbraw/zinc/74/42/39/192744239.db2.gz XDPCBASRZSIVQT-CYBMUJFWSA-N 2 0 242.407 2.027 20 0 BEADRP CC[C@H]([NH2+]CC1(COC)CC[NH2+]CC1)C(C)C ZINC000423402799 192744583 /nfs/dbraw/zinc/74/45/83/192744583.db2.gz XDPCBASRZSIVQT-ZDUSSCGKSA-N 2 0 242.407 2.027 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@@H]2C2CCC2)CC[NH2+]1 ZINC000423388095 192761740 /nfs/dbraw/zinc/76/17/40/192761740.db2.gz SYHSYSLOHDTQTQ-FMKGYKFTSA-N 2 0 222.376 2.295 20 0 BEADRP CO[C@@H](C[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1)C(C)C ZINC000623436965 359330033 /nfs/dbraw/zinc/33/00/33/359330033.db2.gz LSXRXXOVEQABHH-OLZOCXBDSA-N 2 0 242.407 2.120 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@H]2CCCSC2)CC1(C)C ZINC000623439386 359332304 /nfs/dbraw/zinc/33/23/04/359332304.db2.gz GRPPWZBOXXFELC-RYUDHWBXSA-N 2 0 242.432 2.344 20 0 BEADRP CCC[C@H]([NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21)C1CCCC1 ZINC000423437542 192769762 /nfs/dbraw/zinc/76/97/62/192769762.db2.gz UIDXNJBAQSNVQX-RFQIPJPRSA-N 2 0 222.376 2.153 20 0 BEADRP c1ccc([C@H]2CC[C@H]([NH2+][C@@H]3[C@H]4C[NH2+]C[C@H]43)C2)cc1 ZINC000423459076 192777160 /nfs/dbraw/zinc/77/71/60/192777160.db2.gz RCTSXJJJGFWJLV-RFBLXINOSA-N 2 0 242.366 2.130 20 0 BEADRP COc1ccccc1[C@H](C)[NH2+][C@@H]1CC[C@@H](C[NH3+])C1 ZINC000423491653 192793403 /nfs/dbraw/zinc/79/34/03/192793403.db2.gz KEJGVJJCBAPXEL-YNEHKIRRSA-N 2 0 248.370 2.473 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[C@H]([NH3+])C1)C1(C)CC1 ZINC000423473773 192785867 /nfs/dbraw/zinc/78/58/67/192785867.db2.gz OBTSELLHXGNVRK-TUAOUCFPSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@H]2CCc3ccccc32)C1 ZINC000423492015 192794366 /nfs/dbraw/zinc/79/43/66/192794366.db2.gz LDIMTPDCBHXMIY-ZLDLUXBVSA-N 2 0 230.355 2.391 20 0 BEADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@@H]2CCC23CCCC3)C1 ZINC000423506802 192798035 /nfs/dbraw/zinc/79/80/35/192798035.db2.gz MIKWYZKWAKKRBG-JHJVBQTASA-N 2 0 222.376 2.426 20 0 BEADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@@H]2CCCC23CCC3)C1 ZINC000423500826 192796462 /nfs/dbraw/zinc/79/64/62/192796462.db2.gz JARAHUCXPXDBSD-FRRDWIJNSA-N 2 0 222.376 2.426 20 0 BEADRP C[NH+](C)CCCC(C)(C)[NH2+]CC1=CCCOC1 ZINC000379578513 359553023 /nfs/dbraw/zinc/55/30/23/359553023.db2.gz CDAAFSZRJOWODP-UHFFFAOYSA-N 2 0 240.391 2.043 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]CC2=CCCCC2)C1 ZINC000379591798 359557431 /nfs/dbraw/zinc/55/74/31/359557431.db2.gz YCMNUBHVPOMYFX-STQMWFEESA-N 2 0 208.349 2.346 20 0 BEADRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]CC1=CCCCC1 ZINC000379586397 359561399 /nfs/dbraw/zinc/56/13/99/359561399.db2.gz JMEUAZXHBHJUEH-OLZOCXBDSA-N 2 0 208.349 2.204 20 0 BEADRP CCC[NH+]1CCC([NH2+]C[C@H](C)C2CC2)CC1 ZINC000132910140 491142121 /nfs/dbraw/zinc/14/21/21/491142121.db2.gz JLHCRLLTUVXBTP-LBPRGKRZSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)c1cc(N2CC[C@@H]([NH3+])C2)nc(C(C)C)n1 ZINC000045954593 359745537 /nfs/dbraw/zinc/74/55/37/359745537.db2.gz FAOQRBTVTXTIDN-LLVKDONJSA-N 2 0 248.374 2.261 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H]2CCCC23CC3)C1 ZINC000578454355 366575026 /nfs/dbraw/zinc/57/50/26/366575026.db2.gz XLDZAYNGWDHVOO-STQMWFEESA-N 2 0 222.376 2.251 20 0 BEADRP CCO[C@H]1C[C@@H]([NH2+]CCC[NH3+])C12CCCCC2 ZINC000087298419 359906365 /nfs/dbraw/zinc/90/63/65/359906365.db2.gz NEZTVAFQEUMWLY-OLZOCXBDSA-N 2 0 240.391 2.053 20 0 BEADRP [NH3+]CCCC[NH2+]Cc1cccc(C2CC2)c1 ZINC000087011882 359893658 /nfs/dbraw/zinc/89/36/58/359893658.db2.gz NHFPPFBCFCWUIZ-UHFFFAOYSA-N 2 0 218.344 2.393 20 0 BEADRP CC(C)(C[NH2+]C1CC[NH2+]CC1)c1cccs1 ZINC000087619449 359921590 /nfs/dbraw/zinc/92/15/90/359921590.db2.gz WQOJFRBPJVZHHM-UHFFFAOYSA-N 2 0 238.400 2.367 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H]2CCC[C@@H](F)C2)C1 ZINC000578787449 366650538 /nfs/dbraw/zinc/65/05/38/366650538.db2.gz PEOVDXUUAZIOMO-KKOKHZNYSA-N 2 0 214.328 2.127 20 0 BEADRP CCOc1cccc(C[NH2+][C@@H]2CCC[C@@H]2C[NH3+])c1 ZINC000089149828 359993623 /nfs/dbraw/zinc/99/36/23/359993623.db2.gz KMKUVOFNLRWKEV-UKRRQHHQSA-N 2 0 248.370 2.302 20 0 BEADRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]CCOC1CCCCC1 ZINC000089150693 359993642 /nfs/dbraw/zinc/99/36/42/359993642.db2.gz WLEMJNDWGGERBG-TZMCWYRMSA-N 2 0 240.391 2.053 20 0 BEADRP CC(C)CCOCC[NH2+][C@H]1CCCC[C@H]1C[NH3+] ZINC000089145914 359993004 /nfs/dbraw/zinc/99/30/04/359993004.db2.gz RUVDUBCSPLZJKU-KBPBESRZSA-N 2 0 242.407 2.156 20 0 BEADRP COc1ccccc1C[N@H+](C)CC[C@@H]1CC[NH2+]C1 ZINC000089749236 360036585 /nfs/dbraw/zinc/03/65/85/360036585.db2.gz LSWBSPSXKBVGFI-ZDUSSCGKSA-N 2 0 248.370 2.127 20 0 BEADRP Cc1ccccc1C[N@H+](C)CC[C@H]1CC[NH2+]C1 ZINC000089749189 360036710 /nfs/dbraw/zinc/03/67/10/360036710.db2.gz LHIAZRDVKJSELO-CQSZACIVSA-N 2 0 232.371 2.426 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc(F)cc1F ZINC000089150512 359993972 /nfs/dbraw/zinc/99/39/72/359993972.db2.gz YUVZIHCJVIHTER-ZANVPECISA-N 2 0 240.297 2.182 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]CCc1cccc(F)c1 ZINC000089148168 359993981 /nfs/dbraw/zinc/99/39/81/359993981.db2.gz NHXDNWLPYGAZEF-GXTWGEPZSA-N 2 0 236.334 2.085 20 0 BEADRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]Cc1ccc(F)c(F)c1 ZINC000089150404 359993992 /nfs/dbraw/zinc/99/39/92/359993992.db2.gz VFKMFTFOCZBGEG-MFKMUULPSA-N 2 0 240.297 2.182 20 0 BEADRP CCOc1cccc(C[NH2+][C@H]2CCC[C@H]2C[NH3+])c1 ZINC000089149831 359994059 /nfs/dbraw/zinc/99/40/59/359994059.db2.gz KMKUVOFNLRWKEV-ZFWWWQNUSA-N 2 0 248.370 2.302 20 0 BEADRP COCc1ccccc1C[NH2+][C@H]1CCC[C@H]1C[NH3+] ZINC000089149879 359994228 /nfs/dbraw/zinc/99/42/28/359994228.db2.gz ZCGAEWAIUHBVFQ-WFASDCNBSA-N 2 0 248.370 2.050 20 0 BEADRP CC1(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)CCC1 ZINC000090219852 360066195 /nfs/dbraw/zinc/06/61/95/360066195.db2.gz RJYGCKZYEQMESY-CHWSQXEVSA-N 2 0 222.376 2.393 20 0 BEADRP C([NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)C1(C2CC2)CC1 ZINC000090772695 360086674 /nfs/dbraw/zinc/08/66/74/360086674.db2.gz VUZHWDSIQVJVQA-ZIAGYGMSSA-N 2 0 234.387 2.393 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]CC1(C2CC2)CC1 ZINC000090772729 360086760 /nfs/dbraw/zinc/08/67/60/360086760.db2.gz ZWZJXOPAANFGGM-YPMHNXCESA-N 2 0 222.376 2.106 20 0 BEADRP CC[C@H](COC)[NH2+][C@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000093516605 360255896 /nfs/dbraw/zinc/25/58/96/360255896.db2.gz QSJINEJGWISMFN-MCIONIFRSA-N 2 0 242.407 2.312 20 0 BEADRP CC(C)(C)CC[NH+]1CCC(OCCC[NH3+])CC1 ZINC000094070679 360294707 /nfs/dbraw/zinc/29/47/07/360294707.db2.gz UETBKMNISBEGPM-UHFFFAOYSA-N 2 0 242.407 2.252 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+][C@@H]1CCOC2(CCC2)C1 ZINC000094370482 360306354 /nfs/dbraw/zinc/30/63/54/360306354.db2.gz KMHDUSWRRFRUJW-QWHCGFSZSA-N 2 0 240.391 2.018 20 0 BEADRP CCC[C@H](C)C[NH+]1CCC(OCCC[NH3+])CC1 ZINC000094069992 360294466 /nfs/dbraw/zinc/29/44/66/360294466.db2.gz FKULIWHKMQYUSV-ZDUSSCGKSA-N 2 0 242.407 2.252 20 0 BEADRP CCC[NH+]1CCC([NH2+]C[C@]2(C)CCCO2)CC1 ZINC000094797744 360317972 /nfs/dbraw/zinc/31/79/72/360317972.db2.gz DVLCDDOPJPWTQN-AWEZNQCLSA-N 2 0 240.391 2.020 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]C[C@]2(C)CCCO2)CC1 ZINC000094797936 360318566 /nfs/dbraw/zinc/31/85/66/360318566.db2.gz CEWKCSDJBLDGIL-AWEZNQCLSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@H](CCCO)[NH2+][C@@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000094941526 360326938 /nfs/dbraw/zinc/32/69/38/360326938.db2.gz WSMNXFQKBUBUOV-RDBSUJKOSA-N 2 0 242.407 2.048 20 0 BEADRP Cc1ncc([C@H](C)[NH2+]CCCC[NH+](C)C)s1 ZINC000309458729 491148631 /nfs/dbraw/zinc/14/86/31/491148631.db2.gz OEXUWONIWRWAGO-JTQLQIEISA-N 2 0 241.404 2.444 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CC[N@H+](C)C(C)(C)C2)CCO1 ZINC000623481307 360443849 /nfs/dbraw/zinc/44/38/49/360443849.db2.gz ZLLZYFCKQAVUSA-FRRDWIJNSA-N 2 0 240.391 2.016 20 0 BEADRP C([NH2+]C1CCCCCC1)C1CC[NH2+]CC1 ZINC000040397404 200659682 /nfs/dbraw/zinc/65/96/82/200659682.db2.gz INBICYINYYXVQF-UHFFFAOYSA-N 2 0 210.365 2.298 20 0 BEADRP C[C@H]([NH2+]C1(C2CC2)CC1)C1CC[NH+](C)CC1 ZINC000309606073 491152241 /nfs/dbraw/zinc/15/22/41/491152241.db2.gz YQORRCNSGAIJKV-NSHDSACASA-N 2 0 222.376 2.249 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+]C[C@H]1CCCC[C@@H]1C ZINC000414803218 200765090 /nfs/dbraw/zinc/76/50/90/200765090.db2.gz WGAVBFVECFHVON-YNEHKIRRSA-N 2 0 212.381 2.386 20 0 BEADRP CC[C@@H](Cc1ccccc1)[NH2+]C[C@@H](C)C[NH3+] ZINC000414870689 200773364 /nfs/dbraw/zinc/77/33/64/200773364.db2.gz CDUSHZDIAVOZLV-JSGCOSHPSA-N 2 0 220.360 2.192 20 0 BEADRP CCCC[C@@H](CC)[NH2+]CC1([NH3+])CCOCC1 ZINC000629388770 361035654 /nfs/dbraw/zinc/03/56/54/361035654.db2.gz SVYGHZLVMGGYSD-GFCCVEGCSA-N 2 0 228.380 2.053 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1[NH2+][C@H]1CCCC[C@H]1C ZINC000629390395 361037709 /nfs/dbraw/zinc/03/77/09/361037709.db2.gz DXGNJMGBZWWQMZ-MROQNXINSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H](CCC1CCCC1)[NH2+]CCOCCC[NH3+] ZINC000629400352 361052060 /nfs/dbraw/zinc/05/20/60/361052060.db2.gz VEXVUFURVBTHJL-CYBMUJFWSA-N 2 0 242.407 2.300 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+][C@H]1CCCCC1(C)C ZINC000629405445 361052747 /nfs/dbraw/zinc/05/27/47/361052747.db2.gz AYJPMSABMZYCFG-TUAOUCFPSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+][C@H]1CCCC(C)(C)C1 ZINC000629406517 361054746 /nfs/dbraw/zinc/05/47/46/361054746.db2.gz NGTSEZQKCRAKBU-SDDRHHMPSA-N 2 0 210.365 2.295 20 0 BEADRP FC1(F)C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC[NH2+]CC1 ZINC000629500596 361100984 /nfs/dbraw/zinc/10/09/84/361100984.db2.gz XFAKFHFCJQVTAC-TXEJJXNPSA-N 2 0 244.329 2.248 20 0 BEADRP CCC[C@H](C)[C@@H](CC)[NH2+]CC1([NH3+])CCOCC1 ZINC000629520315 361116181 /nfs/dbraw/zinc/11/61/81/361116181.db2.gz GEHBDLRLMPHYLG-QWHCGFSZSA-N 2 0 242.407 2.299 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1[NH2+][C@H](C)C1CCSCC1 ZINC000629527490 361131126 /nfs/dbraw/zinc/13/11/26/361131126.db2.gz WYYVEOFBDTYNHN-KGYLQXTDSA-N 2 0 242.432 2.248 20 0 BEADRP CC[C@@H]1CC[C@H](C)C[C@@H]1[NH2+]CCOCC[NH2+]C ZINC000629530238 361144501 /nfs/dbraw/zinc/14/45/01/361144501.db2.gz AIKUMUWRNYCWOW-MJBXVCDLSA-N 2 0 242.407 2.027 20 0 BEADRP C[NH2+]CCOCC[NH2+][C@H](C)[C@@H]1CCCC[C@@H]1C ZINC000629530761 361145902 /nfs/dbraw/zinc/14/59/02/361145902.db2.gz QLPUHDOVFDNHLS-BFHYXJOUSA-N 2 0 242.407 2.027 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CC[C@H]1CC=CCC1 ZINC000629531542 361148630 /nfs/dbraw/zinc/14/86/30/361148630.db2.gz OJDQRRKFLCFWSR-XQQFMLRXSA-N 2 0 210.365 2.448 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CC[C@@H]1CC=CCC1 ZINC000629531543 361149023 /nfs/dbraw/zinc/14/90/23/361149023.db2.gz OJDQRRKFLCFWSR-YNEHKIRRSA-N 2 0 210.365 2.448 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CC[C@H]1CC=CCC1 ZINC000629531540 361149407 /nfs/dbraw/zinc/14/94/07/361149407.db2.gz OJDQRRKFLCFWSR-AVGNSLFASA-N 2 0 210.365 2.448 20 0 BEADRP Cc1cccc([C@@H](C)[NH2+]CC2([NH3+])CCOCC2)c1 ZINC000629524227 361122694 /nfs/dbraw/zinc/12/26/94/361122694.db2.gz OMBOFGAIFLFZPT-CYBMUJFWSA-N 2 0 248.370 2.154 20 0 BEADRP Cc1ccc(C(C)(C)C[NH2+][C@H](C)C[C@@H](C)[NH3+])nc1 ZINC000629524615 361124329 /nfs/dbraw/zinc/12/43/29/361124329.db2.gz UAPZYZPNVOJJMI-CHWSQXEVSA-N 2 0 249.402 2.383 20 0 BEADRP Cc1ccc(C(C)(C)C[NH2+][C@@H](C)C[C@@H](C)[NH3+])nc1 ZINC000629524616 361124872 /nfs/dbraw/zinc/12/48/72/361124872.db2.gz UAPZYZPNVOJJMI-OLZOCXBDSA-N 2 0 249.402 2.383 20 0 BEADRP CC[C@@H]1CCCC[C@H]1[NH2+]CC1([NH3+])CCOCC1 ZINC000629524749 361126083 /nfs/dbraw/zinc/12/60/83/361126083.db2.gz OIABDGKTMQRCBO-CHWSQXEVSA-N 2 0 240.391 2.053 20 0 BEADRP [NH3+][C@@H]1CCCC[C@H]1[NH2+][C@H]1CC[C@H]1C1CCC1 ZINC000424372247 200925053 /nfs/dbraw/zinc/92/50/53/200925053.db2.gz HQVYXYPUTFJWRS-RFQIPJPRSA-N 2 0 222.376 2.425 20 0 BEADRP C[C@@H]1CC[C@H](C)C[N@H+]1CCCc1cncn1C ZINC000579137396 366722007 /nfs/dbraw/zinc/72/20/07/366722007.db2.gz AZERKVAZAUYTKR-QWHCGFSZSA-N 2 0 235.375 2.473 20 0 BEADRP CC1CC(C[NH2+][C@@H]2CC[NH2+]CC[C@@H]2C)C1 ZINC000622044445 370672831 /nfs/dbraw/zinc/67/28/31/370672831.db2.gz FSVHQJDOIGLPOY-PYNQCMFNSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CC1(F)F)[C@H]1CCCC[NH2+]1 ZINC000622043665 370674554 /nfs/dbraw/zinc/67/45/54/370674554.db2.gz HFLQJAMDQSNUNR-OUAUKWLOSA-N 2 0 232.318 2.152 20 0 BEADRP CC[C@H]([NH2+]CC[C@H]1CC1(F)F)[C@@H]1CCC[NH2+]1 ZINC000622044109 370675467 /nfs/dbraw/zinc/67/54/67/370675467.db2.gz VINMLNFUTVYFHD-DCAQKATOSA-N 2 0 232.318 2.152 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CC[C@@H]1CC1(F)F ZINC000622043887 370675590 /nfs/dbraw/zinc/67/55/90/370675590.db2.gz OVEDPSYIISRFBJ-NXEZZACHSA-N 2 0 220.307 2.139 20 0 BEADRP CC1CC(C[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)C1 ZINC000622044314 370675964 /nfs/dbraw/zinc/67/59/64/370675964.db2.gz ARFJHSQZHCHSGC-DMTXQYTPSA-N 2 0 222.376 2.010 20 0 BEADRP COC1(C[C@H](C)[NH2+][C@@H](C)CC[NH+](C)C)CCC1 ZINC000429524655 201112322 /nfs/dbraw/zinc/11/23/22/201112322.db2.gz XVUKMYMGIMUNMQ-STQMWFEESA-N 2 0 242.407 2.264 20 0 BEADRP C[NH+](C)[C@H]1CCC[N@H+](CCC2CC2)CC1 ZINC000429528148 201112452 /nfs/dbraw/zinc/11/24/52/201112452.db2.gz IPAWIRWBVBRHLC-ZDUSSCGKSA-N 2 0 210.365 2.203 20 0 BEADRP CC[C@@H]1CC[C@H](C)C[C@@H]1[NH2+]CCOCCC[NH3+] ZINC000629536298 361398574 /nfs/dbraw/zinc/39/85/74/361398574.db2.gz GBHLIFCZEXBAAZ-MJBXVCDLSA-N 2 0 242.407 2.156 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]C[C@]1(C)C[C@H]2C[C@H]2C1 ZINC000629537705 361401035 /nfs/dbraw/zinc/40/10/35/361401035.db2.gz LKRPSDSCAAWKGZ-OFTGVCEQSA-N 2 0 210.365 2.138 20 0 BEADRP C/C=C/C[NH2+][C@H](C)c1ccc(C[NH3+])nc1C ZINC000629535345 361410061 /nfs/dbraw/zinc/41/00/61/361410061.db2.gz DDFAWQUMHGFSLA-ORAHPGNNSA-N 2 0 219.332 2.075 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC[NH2+][C@H]1C)C1CCCCC1 ZINC000629544615 361423568 /nfs/dbraw/zinc/42/35/68/361423568.db2.gz BBQQULBFNCAUDD-NTZNESFSSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H](CCCc1cccnc1)[NH2+][C@@H]1CC[NH2+][C@H]1C ZINC000629546949 361429398 /nfs/dbraw/zinc/42/93/98/361429398.db2.gz QPCJULOIVBYSGC-VNHYZAJKSA-N 2 0 247.386 2.133 20 0 BEADRP CCC[C@H]([NH2+][C@@H]1CC[NH2+][C@H]1C)C1CCC1 ZINC000629547268 361430506 /nfs/dbraw/zinc/43/05/06/361430506.db2.gz SKKJOUFVTXMNOU-UHTWSYAYSA-N 2 0 210.365 2.295 20 0 BEADRP CCC[C@@H]([NH2+][C@@H]1CC[NH2+][C@H]1C)C1CCC1 ZINC000629547267 361430885 /nfs/dbraw/zinc/43/08/85/361430885.db2.gz SKKJOUFVTXMNOU-CYZMBNFOSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+]C1CCC(C(F)F)CC1 ZINC000629547690 361431800 /nfs/dbraw/zinc/43/18/00/361431800.db2.gz UIHLAJWMWMXRIL-IDWGSYCQSA-N 2 0 232.318 2.150 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1CCCC12CC2 ZINC000629555204 361446021 /nfs/dbraw/zinc/44/60/21/361446021.db2.gz RVCYJYJWITTZBO-RWMBFGLXSA-N 2 0 222.376 2.284 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]C[C@@H]1CCCC12CC2 ZINC000629555296 361446140 /nfs/dbraw/zinc/44/61/40/361446140.db2.gz UMJDUVCXDMOTPZ-QJPTWQEYSA-N 2 0 208.349 2.036 20 0 BEADRP C[C@]1(C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)C[C@H]2C[C@H]2C1 ZINC000629541600 361416436 /nfs/dbraw/zinc/41/64/36/361416436.db2.gz XQOJYFZJVCZKEQ-SVNAVSNXSA-N 2 0 234.387 2.295 20 0 BEADRP CC(C)C[N@@H+]1CC[C@H](C(F)(F)F)[C@H](C[NH3+])C1 ZINC000629563983 361458619 /nfs/dbraw/zinc/45/86/19/361458619.db2.gz IUOSXGIKQBVYGU-ZJUUUORDSA-N 2 0 238.297 2.102 20 0 BEADRP C[C@H]1CCC[C@@H](CC[N@H+](C)CCOCC[NH3+])C1 ZINC000629576859 361468446 /nfs/dbraw/zinc/46/84/46/361468446.db2.gz DRTBLMQPXGDSLA-KBPBESRZSA-N 2 0 242.407 2.110 20 0 BEADRP C[C@]12C[NH2+]C[C@@]1(C)C[N@H+](CC1CCCCC1)C2 ZINC000629584554 361473677 /nfs/dbraw/zinc/47/36/77/361473677.db2.gz RTPQWXCSFYAPPG-GASCZTMLSA-N 2 0 236.403 2.498 20 0 BEADRP CCCC[N@@H+]1CC[C@H](C(F)(F)F)[C@@H](C[NH3+])C1 ZINC000629567153 361457758 /nfs/dbraw/zinc/45/77/58/361457758.db2.gz WYTMXXXWRGYDPO-UWVGGRQHSA-N 2 0 238.297 2.246 20 0 BEADRP CC(C)C[C@H]([NH3+])C[NH2+]C[C@@H](C)c1ccncc1 ZINC000629656143 361561362 /nfs/dbraw/zinc/56/13/62/361561362.db2.gz OBCYOXTVMCFQCZ-OCCSQVGLSA-N 2 0 235.375 2.148 20 0 BEADRP Cc1ccc(CCC[NH2+][C@H]2CC[C@H](C)NC2)cn1 ZINC000629659776 361564259 /nfs/dbraw/zinc/56/42/59/361564259.db2.gz GTQPDJHTPKMLHH-ZFWWWQNUSA-N 2 0 247.386 2.053 20 0 BEADRP COc1ccc(C(C)(C)[NH2+]CCC[NH3+])cc1F ZINC000629652617 361551164 /nfs/dbraw/zinc/55/11/64/361551164.db2.gz AAZBHLVXTXFHFQ-UHFFFAOYSA-N 2 0 240.322 2.008 20 0 BEADRP CC[C@H]1CCC[C@H](C[N@H+](C)CCOCC[NH3+])C1 ZINC000629667996 361589074 /nfs/dbraw/zinc/58/90/74/361589074.db2.gz ZAIUKPYABRYGCE-KBPBESRZSA-N 2 0 242.407 2.110 20 0 BEADRP CCC1([NH2+]C2CC[NH+](C(C)C)CC2)CC1 ZINC000448552609 201243746 /nfs/dbraw/zinc/24/37/46/201243746.db2.gz OSGKDXFAXHQBOR-UHFFFAOYSA-N 2 0 210.365 2.391 20 0 BEADRP CC[N@H+](Cc1ccc(C)cn1)[C@H]1CCC[NH2+]CC1 ZINC000435379098 201264392 /nfs/dbraw/zinc/26/43/92/201264392.db2.gz AYTVPWAFLBMPHW-HNNXBMFYSA-N 2 0 247.386 2.354 20 0 BEADRP C[C@@H](Cc1ccccc1)C[N@@H+]1CC[C@H](C[NH3+])C1 ZINC000435378807 201264575 /nfs/dbraw/zinc/26/45/75/201264575.db2.gz KAPBGEUSQXXVEV-DZGCQCFKSA-N 2 0 232.371 2.146 20 0 BEADRP CCCc1cccc(C[N@@H+]2CC[C@H](C[NH3+])C2)c1 ZINC000435368855 201266466 /nfs/dbraw/zinc/26/64/66/201266466.db2.gz JLIQTFIXPGMBCB-OAHLLOKOSA-N 2 0 232.371 2.420 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](C[C@H](C)Cc2ccccc2)C1 ZINC000435377073 201266540 /nfs/dbraw/zinc/26/65/40/201266540.db2.gz XUHHPSSGITZWTN-ZBFHGGJFSA-N 2 0 246.398 2.407 20 0 BEADRP CC[N@H+](Cc1cccc(O)c1)[C@@H]1CCC[NH2+]CC1 ZINC000435391530 201267964 /nfs/dbraw/zinc/26/79/64/201267964.db2.gz STYMBTUXGZBJPL-CQSZACIVSA-N 2 0 248.370 2.356 20 0 BEADRP C[C@@H](Cc1ccccc1)C[NH+]1CCC([NH3+])CC1 ZINC000435398009 201270364 /nfs/dbraw/zinc/27/03/64/201270364.db2.gz LYGBNGNJQJDUGP-ZDUSSCGKSA-N 2 0 232.371 2.288 20 0 BEADRP C[C@@H]1CC[N@H+](CC[C@@H]2CCC[NH+]2C)C[C@@H]1C ZINC000154410082 201277604 /nfs/dbraw/zinc/27/76/04/201277604.db2.gz BHAIOBIZDVCTJN-RDBSUJKOSA-N 2 0 224.392 2.449 20 0 BEADRP c1cc(C2=CC[NH2+]CC2)ccc1C[C@@H]1CC[NH2+]C1 ZINC000629723890 361665691 /nfs/dbraw/zinc/66/56/91/361665691.db2.gz TWKXVCOSUWFRBV-AWEZNQCLSA-N 2 0 242.366 2.215 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCC[C@H]1Cc1ccccc1 ZINC000435871038 201290332 /nfs/dbraw/zinc/29/03/32/201290332.db2.gz ISWQWQGWRUKNOI-HNNXBMFYSA-N 2 0 232.371 2.303 20 0 BEADRP c1cc(C[NH2+]C2CC2)cc(C2=CC[NH2+]CC2)c1 ZINC000629722634 361662338 /nfs/dbraw/zinc/66/23/38/361662338.db2.gz DMZKRCBJNDMEQT-UHFFFAOYSA-N 2 0 228.339 2.315 20 0 BEADRP [NH3+][C@H]1CCc2cc(C3=CC[NH2+]CC3)ccc21 ZINC000629722809 361663817 /nfs/dbraw/zinc/66/38/17/361663817.db2.gz FCVVNCJZGMDVOC-AWEZNQCLSA-N 2 0 214.312 2.009 20 0 BEADRP [NH3+]C1CCC([NH2+][C@H]2CC[C@@H]2C2CCC2)CC1 ZINC000335135467 181342805 /nfs/dbraw/zinc/34/28/05/181342805.db2.gz HFRJLNZWFPDHEQ-PQAZSJQKSA-N 2 0 222.376 2.425 20 0 BEADRP [NH3+]C1CC[NH+]([C@H]2CCCc3ccccc32)CC1 ZINC000020521555 181345232 /nfs/dbraw/zinc/34/52/32/181345232.db2.gz DWAXSSDWUGOQTM-HNNXBMFYSA-N 2 0 230.355 2.487 20 0 BEADRP [NH3+]C1CC[NH+](Cc2cccc(C3CC3)c2)CC1 ZINC000094522025 181345258 /nfs/dbraw/zinc/34/52/58/181345258.db2.gz LKOCGKCEUKDBMA-UHFFFAOYSA-N 2 0 230.355 2.487 20 0 BEADRP Cc1ccc(CC[C@H](C)[NH2+]CCC[NH3+])cc1 ZINC000437782594 201371624 /nfs/dbraw/zinc/37/16/24/201371624.db2.gz GJODOUWYJXOMMQ-ZDUSSCGKSA-N 2 0 220.360 2.255 20 0 BEADRP [NH3+]CCC[NH2+][C@@H]1CCC[C@H]1c1ccccc1 ZINC000437779777 201371754 /nfs/dbraw/zinc/37/17/54/201371754.db2.gz CAJVAUYCYWRIBJ-UONOGXRCSA-N 2 0 218.344 2.261 20 0 BEADRP [NH3+]CCC[NH2+][C@@H]1CCC[C@H]1c1ccc(F)cc1 ZINC000437793045 201373444 /nfs/dbraw/zinc/37/34/44/201373444.db2.gz MSIDOQKCNOZYRK-UONOGXRCSA-N 2 0 236.334 2.400 20 0 BEADRP CCN(CC[NH3+])c1cc(C)[nH+]c2ccc(F)cc21 ZINC000630524122 364209288 /nfs/dbraw/zinc/20/92/88/364209288.db2.gz VMUGDYREONTREU-UHFFFAOYSA-N 2 0 247.317 2.467 20 0 BEADRP CC[C@@H](C)C[NH+]1CCN(c2cc[nH+]cc2)CC1 ZINC000151329442 541353969 /nfs/dbraw/zinc/35/39/69/541353969.db2.gz WBISQLMYYYFFQT-CYBMUJFWSA-N 2 0 233.359 2.250 20 0 BEADRP CCN1CC[C@@H]([NH2+]CC2CCCCC2)C1 ZINC000336897824 364851209 /nfs/dbraw/zinc/85/12/09/364851209.db2.gz PTCZYYGGMJQRKG-CYBMUJFWSA-N 2 0 210.365 2.251 20 0 BEADRP Cc1ccncc1[C@@H](C)[NH2+]CC1CC[NH2+]CC1 ZINC000573436880 364831447 /nfs/dbraw/zinc/83/14/47/364831447.db2.gz MXADMKJXGDCOPF-GFCCVEGCSA-N 2 0 233.359 2.040 20 0 BEADRP Cc1cnccc1C[NH2+]CC[C@@H]1CCC[N@@H+](C)C1 ZINC000573806726 364921658 /nfs/dbraw/zinc/92/16/58/364921658.db2.gz OJMBFDITFUBSGN-AWEZNQCLSA-N 2 0 247.386 2.212 20 0 BEADRP Cc1ccc(CC[N@H+]2CC[C@@H]([NH3+])C[C@H]2C)cc1 ZINC000573931522 364949874 /nfs/dbraw/zinc/94/98/74/364949874.db2.gz XAIWMECWOHUNQY-UKRRQHHQSA-N 2 0 232.371 2.349 20 0 BEADRP [NH3+]CCCC[NH2+]Cc1ccc(OC(F)F)cc1 ZINC000037714625 181377813 /nfs/dbraw/zinc/37/78/13/181377813.db2.gz XVYDPACDBUDJBS-UHFFFAOYSA-N 2 0 244.285 2.117 20 0 BEADRP C[C@H]1CCC[C@@H]([NH2+]CCOCC[NH+](C)C)CC1 ZINC000235556764 541441535 /nfs/dbraw/zinc/44/15/35/541441535.db2.gz ZEQBXCGKKDZRQM-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCC[C@H]1C)C1CC[NH+](C)CC1 ZINC000252125558 541445741 /nfs/dbraw/zinc/44/57/41/541445741.db2.gz JZVMBTRHABMEMH-YRGRVCCFSA-N 2 0 224.392 2.495 20 0 BEADRP [NH3+]CCC[N@@H+]1CCC[C@H]1c1ccccc1 ZINC000034492707 181381064 /nfs/dbraw/zinc/38/10/64/181381064.db2.gz PLCSEZLEEKMIDY-ZDUSSCGKSA-N 2 0 204.317 2.172 20 0 BEADRP CC[C@@H](C)[N@H+](C)CCCc1cncn1C ZINC000574288293 365029688 /nfs/dbraw/zinc/02/96/88/365029688.db2.gz GTMYPFRKLPIUGS-LLVKDONJSA-N 2 0 209.337 2.083 20 0 BEADRP [NH3+]CCC[NH+]1CCC(c2ccccc2)CC1 ZINC000027738925 181380269 /nfs/dbraw/zinc/38/02/69/181380269.db2.gz VFUJSEYJDNKMEI-UHFFFAOYSA-N 2 0 218.344 2.215 20 0 BEADRP Cc1cccc([C@H](C)[NH2+]C[C@H](C)C[NH3+])c1 ZINC000379880350 365336113 /nfs/dbraw/zinc/33/61/13/365336113.db2.gz VKAHROZEMLYNSW-NEPJUHHUSA-N 2 0 206.333 2.240 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H]1C[C@@H](C)CC[C@@H]1C ZINC000576099195 365483364 /nfs/dbraw/zinc/48/33/64/365483364.db2.gz HEHUBINCOWDRDZ-RWMBFGLXSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H]1CSC[C@@H]1[NH2+]CCCC[N@H+](C)C1CC1 ZINC000453593593 202780027 /nfs/dbraw/zinc/78/00/27/202780027.db2.gz GWQAGDSOTHXION-AAEUAGOBSA-N 2 0 242.432 2.202 20 0 BEADRP Cc1cncc([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](C)C2)c1 ZINC000184351226 367072727 /nfs/dbraw/zinc/07/27/27/367072727.db2.gz MGLHAOBNPGEYOL-KGLIPLIRSA-N 2 0 247.386 2.382 20 0 BEADRP Cc1cncc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](C)C2)c1 ZINC000184351276 367072884 /nfs/dbraw/zinc/07/28/84/367072884.db2.gz MGLHAOBNPGEYOL-UONOGXRCSA-N 2 0 247.386 2.382 20 0 BEADRP C[NH2+]Cc1ccc(N[C@@H]2CCC[C@H]([NH3+])C2)cc1 ZINC000579978704 367114802 /nfs/dbraw/zinc/11/48/02/367114802.db2.gz AHQUTWOZNMYUJD-GXTWGEPZSA-N 2 0 233.359 2.088 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H]1C[C@@H](OC)C1(CC)CC ZINC000580827654 367178195 /nfs/dbraw/zinc/17/81/95/367178195.db2.gz XVQJCRUDGDTDGA-CHWSQXEVSA-N 2 0 242.407 2.169 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H]1CCc2c1cccc2OC ZINC000580887079 367196929 /nfs/dbraw/zinc/19/69/29/367196929.db2.gz VSYCLNLFIKLHBH-AWEZNQCLSA-N 2 0 248.370 2.272 20 0 BEADRP C[C@H]1C[C@@H](C[N@H+](C)Cc2cccc(O)c2)CC[NH2+]1 ZINC000580939946 367210343 /nfs/dbraw/zinc/21/03/43/367210343.db2.gz NKZDVDVQNBLKHF-JSGCOSHPSA-N 2 0 248.370 2.212 20 0 BEADRP CCO[C@@H]1CCCC[C@H]1[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000581022556 367239653 /nfs/dbraw/zinc/23/96/53/367239653.db2.gz ZEMPGNOYTWMARP-IGQOVBAYSA-N 2 0 240.391 2.194 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H]1C[C@H](OC(C)C)C1(C)C ZINC000581065719 367249912 /nfs/dbraw/zinc/24/99/12/367249912.db2.gz HYJJQPGFLQAQPH-STQMWFEESA-N 2 0 242.407 2.168 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[C@H]([NH3+])C1)c1ccoc1 ZINC000581185199 367285915 /nfs/dbraw/zinc/28/59/15/367285915.db2.gz GIVUDSVPLZCSTI-GVXVVHGQSA-N 2 0 222.332 2.448 20 0 BEADRP C[C@@H]1CC[N@H+](CC[C@H]2CCC[NH2+]C2)[C@H]1C ZINC000380806858 367306342 /nfs/dbraw/zinc/30/63/42/367306342.db2.gz QNEYGBMOYSWATM-FRRDWIJNSA-N 2 0 210.365 2.106 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@@H]2CCC2(C)C)CC1 ZINC000380860835 367319249 /nfs/dbraw/zinc/31/92/49/367319249.db2.gz ZLROEFDBRWJLCC-CYBMUJFWSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H](c1ccncc1)[N@H+](C)C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000383922995 367659966 /nfs/dbraw/zinc/65/99/66/367659966.db2.gz HXOXLXGVPCRTBH-HZSPNIEDSA-N 2 0 247.386 2.463 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCCSC1)[C@H]1CCCC[NH2+]1 ZINC000384095219 367672350 /nfs/dbraw/zinc/67/23/50/367672350.db2.gz CXYXMIGLJNMLMB-YNEHKIRRSA-N 2 0 242.432 2.250 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]CC1CCCCC1 ZINC000252710420 367690196 /nfs/dbraw/zinc/69/01/96/367690196.db2.gz GPLNZMMVGDJOCD-TZMCWYRMSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1cccc(C[N@@H+](C)C2CC([NH3+])C2)c1C ZINC000384706888 367718086 /nfs/dbraw/zinc/71/80/86/367718086.db2.gz CKBYKZOYFUIKCS-UHFFFAOYSA-N 2 0 218.344 2.225 20 0 BEADRP CC/C=C/C[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@@H]1C ZINC000384866945 367746326 /nfs/dbraw/zinc/74/63/26/367746326.db2.gz NZEHXOUCVMZTQD-PDSHNHIRSA-N 2 0 210.365 2.271 20 0 BEADRP C[C@H](CCCO)C[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000384661497 367713270 /nfs/dbraw/zinc/71/32/70/367713270.db2.gz BHHYIPFWWQTSEQ-KCPJHIHWSA-N 2 0 248.370 2.129 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+]CC(C)(C)C1CCC1 ZINC000385029099 367776100 /nfs/dbraw/zinc/77/61/00/367776100.db2.gz KDRMTSFBILEEIL-ZDUSSCGKSA-N 2 0 242.407 2.156 20 0 BEADRP [NH3+][C@@H]1CC[C@@H]2C[N@H+](C/C=C\c3ccccc3)C[C@H]12 ZINC000385774189 367863330 /nfs/dbraw/zinc/86/33/30/367863330.db2.gz WEYFXHHMOUYZGT-WEMDRRJRSA-N 2 0 242.366 2.369 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2CCSCC[C@H]2C)CC[NH2+]1 ZINC000385411262 367826138 /nfs/dbraw/zinc/82/61/38/367826138.db2.gz UVBSIKWXLRAHRU-JHJVBQTASA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H]([N@H+](C)CC[C@@H]1CCC[NH2+]C1)C1(C)CC1 ZINC000385417290 367827812 /nfs/dbraw/zinc/82/78/12/367827812.db2.gz ZHKIHCMJHOJTFF-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCC[C@H]2CCC[NH2+]2)[C@@H]1C ZINC000386094011 367910705 /nfs/dbraw/zinc/91/07/05/367910705.db2.gz GJKZRQOBXXYBKE-LPWJVIDDSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC=CCC1)[C@H]1CCCC[NH2+]1 ZINC000386125386 367916000 /nfs/dbraw/zinc/91/60/00/367916000.db2.gz NQUMITAELWXBJG-YNEHKIRRSA-N 2 0 208.349 2.215 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC[C@H]2CCC[NH2+]C2)[C@H]1C ZINC000386171673 367922609 /nfs/dbraw/zinc/92/26/09/367922609.db2.gz YYLAHLUJDJLVRZ-XQHKEYJVSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@H]([NH2+]CC1CC(F)(F)C1)[C@H]1CCCC[NH2+]1 ZINC000386010495 367897292 /nfs/dbraw/zinc/89/72/92/367897292.db2.gz MMGITVLBYFNUSV-GXSJLCMTSA-N 2 0 232.318 2.152 20 0 BEADRP COCCC(C)(C)C[NH2+][C@@H](C)[C@H]1CCCC[NH2+]1 ZINC000386468230 367978512 /nfs/dbraw/zinc/97/85/12/367978512.db2.gz QCCSVSIAFMCKPI-QWHCGFSZSA-N 2 0 242.407 2.169 20 0 BEADRP CCOCC(C)(C)C[NH2+][C@@H](C)[C@H]1CCCC[NH2+]1 ZINC000386506003 367981564 /nfs/dbraw/zinc/98/15/64/367981564.db2.gz WMPTVIVGCDVPDG-QWHCGFSZSA-N 2 0 242.407 2.169 20 0 BEADRP C[C@@H](NCCc1ccccc1)[C@H]1CCCC[NH2+]1 ZINC000386612497 368002119 /nfs/dbraw/zinc/00/21/19/368002119.db2.gz WVZWSYKKDJXZSA-UKRRQHHQSA-N 2 0 232.371 2.349 20 0 BEADRP C[NH+](C)CCCC(C)(C)[NH2+]Cc1cscn1 ZINC000387309600 368149321 /nfs/dbraw/zinc/14/93/21/368149321.db2.gz KXJFZZOUFHSONO-UHFFFAOYSA-N 2 0 241.404 2.353 20 0 BEADRP CC[C@H]([NH2+]CCOCC[NH+](C)C)C1CCCC1 ZINC000387475131 368225858 /nfs/dbraw/zinc/22/58/58/368225858.db2.gz UKJQAMKAQYIEFO-AWEZNQCLSA-N 2 0 242.407 2.123 20 0 BEADRP Cc1cccc([C@H](C)[NH2+]CCCC[NH3+])c1 ZINC000037715477 368268773 /nfs/dbraw/zinc/26/87/73/368268773.db2.gz JZVZJRFZGNPISS-LBPRGKRZSA-N 2 0 206.333 2.385 20 0 BEADRP Cc1cscc1C[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000087309623 368891473 /nfs/dbraw/zinc/89/14/73/368891473.db2.gz IAONOMPNFUEJHQ-RYUDHWBXSA-N 2 0 224.373 2.416 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]CC(C1CC1)C1CC1 ZINC000084223071 368850385 /nfs/dbraw/zinc/85/03/85/368850385.db2.gz PXJDILBAPPDSFW-GXTWGEPZSA-N 2 0 222.376 2.140 20 0 BEADRP Cc1cc(C)c(CN2C[C@H](C)[NH2+]C[C@@H]2C)c(C)n1 ZINC000631827503 368995340 /nfs/dbraw/zinc/99/53/40/368995340.db2.gz PLTCGBYRSYWGAG-STQMWFEESA-N 2 0 247.386 2.189 20 0 BEADRP C[N@@H+]1CCCC[C@@H](C[NH2+]CC2(C)CCC2)C1 ZINC000623656912 368996793 /nfs/dbraw/zinc/99/67/93/368996793.db2.gz FLDYARZZRAGUFB-ZDUSSCGKSA-N 2 0 224.392 2.498 20 0 BEADRP Cc1cnccc1C[NH2+]C[C@H]1CCCC[N@@H+](C)C1 ZINC000623657450 368998093 /nfs/dbraw/zinc/99/80/93/368998093.db2.gz RCKIVWFEQBFODX-CQSZACIVSA-N 2 0 247.386 2.212 20 0 BEADRP CC[C@H](C)C[NH2+]C[C@H]1CCCC[N@H+](C)C1 ZINC000623657780 368999862 /nfs/dbraw/zinc/99/98/62/368999862.db2.gz YXPRIKOCMUWOGH-QWHCGFSZSA-N 2 0 212.381 2.354 20 0 BEADRP Cc1cc(C)c(C[N@H+]2CC[C@H]([C@H](C)[NH3+])C2)c(C)n1 ZINC000631824192 368987612 /nfs/dbraw/zinc/98/76/12/368987612.db2.gz YJQASIAHMPZSQK-JSGCOSHPSA-N 2 0 247.386 2.176 20 0 BEADRP Cc1cccc(C)c1C[N@@H+]1C[C@@H](C[NH3+])[C@H](C)C1 ZINC000631839694 369169976 /nfs/dbraw/zinc/16/99/76/369169976.db2.gz JRSKBYAHNSJXSG-ZIAGYGMSSA-N 2 0 232.371 2.330 20 0 BEADRP Cc1cccc(C)c1C[N@H+]1C[C@H](C)[C@H](C[NH3+])C1 ZINC000631839693 369170068 /nfs/dbraw/zinc/17/00/68/369170068.db2.gz JRSKBYAHNSJXSG-UONOGXRCSA-N 2 0 232.371 2.330 20 0 BEADRP C[NH+](C)CCCC[NH2+]C1CC2(CCC2)C1 ZINC000459386473 203260805 /nfs/dbraw/zinc/26/08/05/203260805.db2.gz HKCWXYZXHUISKP-UHFFFAOYSA-N 2 0 210.365 2.251 20 0 BEADRP CC(C)[N@H+](CCc1cncn1C)CC1CCC1 ZINC000459429607 203281191 /nfs/dbraw/zinc/28/11/91/203281191.db2.gz PRBOKUMMPKSQHC-UHFFFAOYSA-N 2 0 235.375 2.473 20 0 BEADRP C[C@H](Cc1ccsc1)N[C@H](C)[C@H]1CCC[NH2+]1 ZINC000400483033 369350793 /nfs/dbraw/zinc/35/07/93/369350793.db2.gz WPTAGDQTUUEHOP-NQBHXWOUSA-N 2 0 238.400 2.409 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H]2C[C@@H](OCC)C2)CC1 ZINC000459626773 203320425 /nfs/dbraw/zinc/32/04/25/203320425.db2.gz CUENKFYYSODIEW-OKILXGFUSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc3c[nH+]cn3c2)[C@H]1C ZINC000459658446 203331774 /nfs/dbraw/zinc/33/17/74/203331774.db2.gz KILSAFUVWOLYPR-UHIISALHSA-N 2 0 229.327 2.468 20 0 BEADRP C[N@@H+]1CCC[C@@H](CC[NH2+][C@H]2CCCSC2)C1 ZINC000459724466 203342390 /nfs/dbraw/zinc/34/23/90/203342390.db2.gz DSTOYNDQZPDNJP-STQMWFEESA-N 2 0 242.432 2.204 20 0 BEADRP C[N@@H+]1CCC[C@@H](CC[NH2+][C@@H]2CCCSC2)C1 ZINC000459724465 203343382 /nfs/dbraw/zinc/34/33/82/203343382.db2.gz DSTOYNDQZPDNJP-QWHCGFSZSA-N 2 0 242.432 2.204 20 0 BEADRP CC(C)[C@@H](C)[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC000459736645 203346237 /nfs/dbraw/zinc/34/62/37/203346237.db2.gz QEFSUWFEHVGBHT-OLZOCXBDSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)c1ccccn1 ZINC000459737337 203347832 /nfs/dbraw/zinc/34/78/32/203347832.db2.gz QYFSBWACOJJVCO-KGLIPLIRSA-N 2 0 247.386 2.464 20 0 BEADRP Cc1cc(C[NH+]2C[C@H]3C[NH2+]C[C@@H]3C2)c(C)s1 ZINC000082238104 370973694 /nfs/dbraw/zinc/97/36/94/370973694.db2.gz HZIKNIUNIWAOCK-CHWSQXEVSA-N 2 0 236.384 2.016 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)C1CCC1 ZINC000459787789 203369531 /nfs/dbraw/zinc/36/95/31/203369531.db2.gz PZDWDJMEJQYKSN-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)C1CCC1 ZINC000459787786 203370121 /nfs/dbraw/zinc/37/01/21/203370121.db2.gz PZDWDJMEJQYKSN-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CSC[C@@H]1[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC000459798035 203372323 /nfs/dbraw/zinc/37/23/23/203372323.db2.gz XKELHXXGWGDTRY-AGIUHOORSA-N 2 0 242.432 2.059 20 0 BEADRP C[C@H]1C[C@@H]([NH3+])CN1Cc1cc2ccccc2o1 ZINC000631863088 369596679 /nfs/dbraw/zinc/59/66/79/369596679.db2.gz XKKSFSHFSZHWNX-CMPLNLGQSA-N 2 0 230.311 2.354 20 0 BEADRP C[C@@H]1C[C@H]([NH3+])CN1Cc1cc2ccccc2o1 ZINC000631863094 369597875 /nfs/dbraw/zinc/59/78/75/369597875.db2.gz XKKSFSHFSZHWNX-PWSUYJOCSA-N 2 0 230.311 2.354 20 0 BEADRP C[C@@H]1CN(c2cc[nH+]c3ccccc32)CC[C@H]1[NH3+] ZINC000251903952 369980857 /nfs/dbraw/zinc/98/08/57/369980857.db2.gz WQSGBYFGDNVMSD-DGCLKSJQSA-N 2 0 241.338 2.408 20 0 BEADRP C[C@H](CCc1ccccc1)[NH+]1C[C@@H]2C[NH2+]C[C@H]2C1 ZINC000252453214 370045167 /nfs/dbraw/zinc/04/51/67/370045167.db2.gz DGNQKOXZPNHBLQ-KBMXLJTQSA-N 2 0 244.382 2.159 20 0 BEADRP COc1ccccc1C[N@@H+]1CC[C@H](C)[C@H](C[NH3+])C1 ZINC000253199450 370161176 /nfs/dbraw/zinc/16/11/76/370161176.db2.gz WKBONDJEZHGZOB-GXTWGEPZSA-N 2 0 248.370 2.112 20 0 BEADRP C(C[NH2+][C@]12CCC[C@@H]1C[NH2+]C2)CC1CCC1 ZINC000631867149 370212308 /nfs/dbraw/zinc/21/23/08/370212308.db2.gz KSUQIFHLYSGWGU-KGLIPLIRSA-N 2 0 222.376 2.298 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+]CC1CC[NH+](CC)CC1 ZINC000310024675 370290086 /nfs/dbraw/zinc/29/00/86/370290086.db2.gz OQTWQXYZJREBFX-ZIAGYGMSSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@H]1CC[C@H]1[NH2+]CC1CC[NH+](CC)CC1 ZINC000310024674 370290288 /nfs/dbraw/zinc/29/02/88/370290288.db2.gz OQTWQXYZJREBFX-UONOGXRCSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CC1(F)F)C1CC[NH+](C)CC1 ZINC000621769668 370512439 /nfs/dbraw/zinc/51/24/39/370512439.db2.gz FJIHLYIEWUIEJJ-JQWIXIFHSA-N 2 0 246.345 2.352 20 0 BEADRP [NH3+][C@@]12CCC[C@@H]1C[N@H+](CC1CCCCC1)C2 ZINC000621777652 370527276 /nfs/dbraw/zinc/52/72/76/370527276.db2.gz DJBVHYATJHXSHZ-ZIAGYGMSSA-N 2 0 222.376 2.380 20 0 BEADRP CC[C@H](CC(F)F)C[N@@H+]1C[C@H]2CCC[C@@]2([NH3+])C1 ZINC000621784432 370535491 /nfs/dbraw/zinc/53/54/91/370535491.db2.gz OVRSSUCOFLPBTB-NQBHXWOUSA-N 2 0 246.345 2.481 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@]2(C)CCCOC2)CC1(C)C ZINC000623908125 371149588 /nfs/dbraw/zinc/14/95/88/371149588.db2.gz PULIHWSOCPVZQU-GXTWGEPZSA-N 2 0 240.391 2.018 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@@]2(C)CCCOC2)CC1(C)C ZINC000623908126 371149834 /nfs/dbraw/zinc/14/98/34/371149834.db2.gz PULIHWSOCPVZQU-JSGCOSHPSA-N 2 0 240.391 2.018 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]2C[N@H+](CC3CCCC3)C[C@H]21 ZINC000228471113 181586115 /nfs/dbraw/zinc/58/61/15/181586115.db2.gz WLFFXPIBHJRZDU-BFHYXJOUSA-N 2 0 222.376 2.236 20 0 BEADRP C[C@@H]([NH2+]CC1CC=CC1)C1CC[NH+](C)CC1 ZINC000624076281 371293919 /nfs/dbraw/zinc/29/39/19/371293919.db2.gz QHJUVKSUNJAFQZ-GFCCVEGCSA-N 2 0 222.376 2.273 20 0 BEADRP [NH3+][C@H]1CCCCC[C@H]1[NH2+]C1CCSCC1 ZINC000335159247 181640032 /nfs/dbraw/zinc/64/00/32/181640032.db2.gz WANPDROCSPOFRT-NWDGAFQWSA-N 2 0 228.405 2.132 20 0 BEADRP COCCC[C@H](C)[NH2+]C[C@@H]1CCCC[N@H+](C)C1 ZINC000624120521 371321341 /nfs/dbraw/zinc/32/13/41/371321341.db2.gz BBUYNTLIEVKNJV-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP C[N@@H+]1CCCC[C@H](C[NH2+]C2CC(C)(C)C2)C1 ZINC000624123449 371324149 /nfs/dbraw/zinc/32/41/49/371324149.db2.gz MDTSSDGUHJLHKU-GFCCVEGCSA-N 2 0 224.392 2.497 20 0 BEADRP C[N@@H+]1CCCC[C@@H](C[NH2+][C@@H]2CCC2(C)C)C1 ZINC000624123394 371324656 /nfs/dbraw/zinc/32/46/56/371324656.db2.gz LCPHBRXYOJQBIG-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CC([NH2+]C[C@@H]2CCCN2C)C[C@@H](C)C1 ZINC000125397533 371339183 /nfs/dbraw/zinc/33/91/83/371339183.db2.gz IHRNNEBUWRWBNX-OBJOEFQTSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@H+](C)C(C)(C)C2)[C@H](C)O1 ZINC000631218279 372242365 /nfs/dbraw/zinc/24/23/65/372242365.db2.gz MHSCYJOFIRUHJD-XQHKEYJVSA-N 2 0 240.391 2.015 20 0 BEADRP C[C@@H](c1cccnc1)N1CCCCC[C@@H]([NH3+])C1 ZINC000631834445 372618200 /nfs/dbraw/zinc/61/82/00/372618200.db2.gz XJTUKVPYGJJBHC-GXTWGEPZSA-N 2 0 233.359 2.346 20 0 BEADRP CCO[C@H](C[N@@H+]1CCCCC[C@@H]([NH3+])C1)C1CC1 ZINC000631835335 372622278 /nfs/dbraw/zinc/62/22/78/372622278.db2.gz SAWBHTAUXOWYSQ-ZIAGYGMSSA-N 2 0 240.391 2.005 20 0 BEADRP CCO[C@@H](C[N@@H+]1CCCCC[C@@H]([NH3+])C1)C1CC1 ZINC000631835333 372623677 /nfs/dbraw/zinc/62/36/77/372623677.db2.gz SAWBHTAUXOWYSQ-KGLIPLIRSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@H]1C[N@H+](CCC2CCCC2)C[C@H]1C[NH3+] ZINC000631839948 372636772 /nfs/dbraw/zinc/63/67/72/372636772.db2.gz NEVFXQZDWVQKFL-WCQYABFASA-N 2 0 210.365 2.093 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]1[NH2+]Cc1ccccc1 ZINC000038458033 372642785 /nfs/dbraw/zinc/64/27/85/372642785.db2.gz CLMPJOHICGFIQG-ZDUSSCGKSA-N 2 0 218.344 2.164 20 0 BEADRP C([C@@H]1CC[NH2+]C1)[N@@H+]1CCC[C@H](C2CCC2)CC1 ZINC000631873777 372675368 /nfs/dbraw/zinc/67/53/68/372675368.db2.gz WBCADJVWECMQBS-HIFRSBDPSA-N 2 0 236.403 2.498 20 0 BEADRP CC(C)CC[N@@H+]1CCC[C@@H]2C[NH2+]CC[C@@H]21 ZINC000631884989 372680249 /nfs/dbraw/zinc/68/02/49/372680249.db2.gz RKRRVSKXYSJTBB-OLZOCXBDSA-N 2 0 210.365 2.106 20 0 BEADRP Cc1cc(C[NH2+][C@@H]2CCC[C@H]2C[NH3+])ccc1F ZINC000414794274 205773450 /nfs/dbraw/zinc/77/34/50/205773450.db2.gz LQNQHSNKWTVVHE-GXTWGEPZSA-N 2 0 236.334 2.351 20 0 BEADRP CC[C@@H]1CCC[C@@H]([NH2+]C[C@@H](C)C[NH2+]C)C1 ZINC000414850676 205774785 /nfs/dbraw/zinc/77/47/85/205774785.db2.gz ZRHRAXXISDCTKD-YNEHKIRRSA-N 2 0 212.381 2.400 20 0 BEADRP CSCCCC[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@@H]1C ZINC000223738556 259569297 /nfs/dbraw/zinc/56/92/97/259569297.db2.gz QIMVZSBPEYEUFG-YNEHKIRRSA-N 2 0 244.448 2.448 20 0 BEADRP C(C1CC1)[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000246433211 374260516 /nfs/dbraw/zinc/26/05/16/374260516.db2.gz CSKBTEYENJBTKP-DZGCQCFKSA-N 2 0 234.387 2.345 20 0 BEADRP CCC[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000246559593 374273532 /nfs/dbraw/zinc/27/35/32/374273532.db2.gz KUKRNAUGFUSGAA-GXTWGEPZSA-N 2 0 222.376 2.345 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+][C@@H]2CC23CC3)c2ccccc21 ZINC000424378110 206038671 /nfs/dbraw/zinc/03/86/71/206038671.db2.gz SCQKFUVMMFOPEF-FRRDWIJNSA-N 2 0 214.312 2.273 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCCC[C@H]1[NH3+])[C@H]1CC1(C)C ZINC000424369425 206038768 /nfs/dbraw/zinc/03/87/68/206038768.db2.gz BUNZTNPTDQRVSO-DDHJBXDOSA-N 2 0 210.365 2.281 20 0 BEADRP [NH3+][C@@H]1CCCC[C@H]1[NH2+][C@@H]1CCC12CCC2 ZINC000424380357 206038808 /nfs/dbraw/zinc/03/88/08/206038808.db2.gz WXZVLFLIYFQZEZ-IJLUTSLNSA-N 2 0 208.349 2.179 20 0 BEADRP COCC[C@@H]1CCC[C@H]1[NH2+][C@@H]1CCCC[C@H]1[NH3+] ZINC000424378985 206039964 /nfs/dbraw/zinc/03/99/64/206039964.db2.gz UUFJQBUOTYYZPN-REWJHTLYSA-N 2 0 240.391 2.051 20 0 BEADRP COC1(C[C@@H](C)[NH2+][C@H](C)CC[NH+](C)C)CCC1 ZINC000429524652 206060367 /nfs/dbraw/zinc/06/03/67/206060367.db2.gz XVUKMYMGIMUNMQ-CHWSQXEVSA-N 2 0 242.407 2.264 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CC2CCC2)[C@H](C)C1 ZINC000166956050 206141492 /nfs/dbraw/zinc/14/14/92/206141492.db2.gz DLVDLELQCTZUIC-YPMHNXCESA-N 2 0 210.365 2.106 20 0 BEADRP CCOCC(C)(C)[NH2+]CCC[NH+](CC)CC ZINC000339370542 170353876 /nfs/dbraw/zinc/35/38/76/170353876.db2.gz AUQIULHRKCRTTB-UHFFFAOYSA-N 2 0 230.396 2.123 20 0 BEADRP CC(C)C[C@H]1CC[N@H+](CC2CC[NH2+]CC2)C1 ZINC000178972789 134314022 /nfs/dbraw/zinc/31/40/22/134314022.db2.gz UZCCXRFDIFCJRS-CQSZACIVSA-N 2 0 224.392 2.354 20 0 BEADRP CCCC[C@H](COC)[NH2+]CC1CC[NH+](C)CC1 ZINC000126305140 169003979 /nfs/dbraw/zinc/00/39/79/169003979.db2.gz CWLSNGMJCBRXOD-CQSZACIVSA-N 2 0 242.407 2.123 20 0 BEADRP CCCC[C@H](COC)[NH2+][C@@H](C)CC[NH+](C)C ZINC000336750766 169004818 /nfs/dbraw/zinc/00/48/18/169004818.db2.gz ZTMUYBPZFWTGPW-QWHCGFSZSA-N 2 0 230.396 2.121 20 0 BEADRP CCC[N@H+](CC)C[C@H](C)Nc1cc[nH+]cc1C ZINC000357794720 169127737 /nfs/dbraw/zinc/12/77/37/169127737.db2.gz CRHLVRKPGDPNFD-ZDUSSCGKSA-N 2 0 235.375 2.344 20 0 BEADRP CCC[N@H+](C[C@H]1CCCCO1)C1CC[NH2+]CC1 ZINC000037539187 169172373 /nfs/dbraw/zinc/17/23/73/169172373.db2.gz BUURVQQERXDXKB-CQSZACIVSA-N 2 0 240.391 2.020 20 0 BEADRP CCC[N@H+](CCC[NH3+])Cc1ccccc1 ZINC000036883452 169155907 /nfs/dbraw/zinc/15/59/07/169155907.db2.gz RPCAZXDMNFBHKB-UHFFFAOYSA-N 2 0 206.333 2.247 20 0 BEADRP CCC[NH+]1CCC([NH2+]CCc2cccnc2)CC1 ZINC000037717674 169187825 /nfs/dbraw/zinc/18/78/25/169187825.db2.gz LLZLZYPEQKWDAL-UHFFFAOYSA-N 2 0 247.386 2.088 20 0 BEADRP CCC[NH+]1CCC([NH2+]C[C@H]2CC[C@H](C)O2)CC1 ZINC000127736468 169187945 /nfs/dbraw/zinc/18/79/45/169187945.db2.gz QCZCWZQDXBEGTJ-GXTWGEPZSA-N 2 0 240.391 2.018 20 0 BEADRP CCC[NH+]1CCC([NH2+]CCc2ccco2)CC1 ZINC000035121637 169188160 /nfs/dbraw/zinc/18/81/60/169188160.db2.gz UZQGGHJEOPZDQS-UHFFFAOYSA-N 2 0 236.359 2.286 20 0 BEADRP CCC[NH+]1CCC([NH2+]CC[C@@H](C)F)CC1 ZINC000340467108 169188621 /nfs/dbraw/zinc/18/86/21/169188621.db2.gz OLHCDWRDCVOZPR-LLVKDONJSA-N 2 0 216.344 2.199 20 0 BEADRP CCC[NH+]1CCC([NH2+]C[C@H]2CC[C@@H](C)O2)CC1 ZINC000127736920 169188789 /nfs/dbraw/zinc/18/87/89/169188789.db2.gz QCZCWZQDXBEGTJ-TZMCWYRMSA-N 2 0 240.391 2.018 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H](C)[C@@H]2CCCO2)CC1 ZINC000020205800 169189362 /nfs/dbraw/zinc/18/93/62/169189362.db2.gz XHMINQOXFUIFEL-OCCSQVGLSA-N 2 0 240.391 2.018 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H]2CC[C@H]2C)CC1 ZINC000336656193 169189821 /nfs/dbraw/zinc/18/98/21/169189821.db2.gz AHRFHMUPABEXLD-DGCLKSJQSA-N 2 0 210.365 2.249 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H]2CSC2(C)C)CC1 ZINC000336671475 169190217 /nfs/dbraw/zinc/19/02/17/169190217.db2.gz AMEWVSJOQOOVJV-LBPRGKRZSA-N 2 0 242.432 2.344 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H](C)C(C)(C)OC)CC1 ZINC000302322684 169190395 /nfs/dbraw/zinc/19/03/95/169190395.db2.gz CIZINFYFZQAXFO-GFCCVEGCSA-N 2 0 242.407 2.264 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H]2C[C@H](C)[C@@H]2C)C1 ZINC000309976875 169208018 /nfs/dbraw/zinc/20/80/18/169208018.db2.gz UBJWWFHJAFZJFP-IGQOVBAYSA-N 2 0 224.392 2.352 20 0 BEADRP c1c[nH]c(CNc2cccc(C3CC3)n2)n1 ZINC000292930522 183359057 /nfs/dbraw/zinc/35/90/57/183359057.db2.gz IXDBJJJQMMFCSM-UHFFFAOYSA-N 2 0 214.272 2.294 20 0 BEADRP c1cc(C2CC2)ccc1C[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC000094522264 183335121 /nfs/dbraw/zinc/33/51/21/183335121.db2.gz AGCJSMGVIZUXAH-IYBDPMFKSA-N 2 0 242.366 2.215 20 0 BEADRP c1[nH+]cn2cc(C[NH2+][C@H]3CCCSC3)ccc12 ZINC000297562290 183375534 /nfs/dbraw/zinc/37/55/34/183375534.db2.gz QPEPEYDJROXZSF-LBPRGKRZSA-N 2 0 247.367 2.320 20 0 BEADRP c1ccc(C[N@@H+](CC2CC[NH2+]CC2)C2CC2)nc1 ZINC000094021673 183396099 /nfs/dbraw/zinc/39/60/99/183396099.db2.gz WVLINNTWASIGNE-UHFFFAOYSA-N 2 0 245.370 2.046 20 0 BEADRP CCC[C@@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000020523812 169369397 /nfs/dbraw/zinc/36/93/97/169369397.db2.gz CPXDLEUJNIEIRU-ODWCKFRGSA-N 2 0 210.365 2.390 20 0 BEADRP CCC[C@@H](C)[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000037485343 169370060 /nfs/dbraw/zinc/37/00/60/169370060.db2.gz KLFYBJYPRHYDQQ-NEPJUHHUSA-N 2 0 210.365 2.249 20 0 BEADRP CCC[C@@H](C)C[N@@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC000366486239 169358924 /nfs/dbraw/zinc/35/89/24/169358924.db2.gz CYEZBPYVHDEVDI-ZIAGYGMSSA-N 2 0 224.392 2.450 20 0 BEADRP CCC[C@@H](CC)[NH2+]CC1CC[NH+](C)CC1 ZINC000054243867 169378424 /nfs/dbraw/zinc/37/84/24/169378424.db2.gz HBELONFWSNSXGH-CYBMUJFWSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H](C[NH2+][C@H]1CC[C@@H](C)C1)C[NH+]1CCCC1 ZINC000227203572 134376013 /nfs/dbraw/zinc/37/60/13/134376013.db2.gz VJXAVWFAEDEYKP-RDBSUJKOSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH+]1CCC(C)(C[NH2+]C2CCCC2)CC1 ZINC000227330591 134378028 /nfs/dbraw/zinc/37/80/28/134378028.db2.gz YSXJUTHMHPGIOO-UHFFFAOYSA-N 2 0 210.365 2.251 20 0 BEADRP Cc1ccc([C@H](C)[NH2+]C2CC[NH2+]CC2)s1 ZINC000049161926 383877365 /nfs/dbraw/zinc/87/73/65/383877365.db2.gz OUXNKJICTGUSJV-JTQLQIEISA-N 2 0 224.373 2.459 20 0 BEADRP [NH3+]CC[C@@H]1CCC[N@H+](CC2CCCC2)C1 ZINC000070533447 383934348 /nfs/dbraw/zinc/93/43/48/383934348.db2.gz LNAOIVGFHGQXQY-ZDUSSCGKSA-N 2 0 210.365 2.237 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]Cc1ccnc2ccccc12 ZINC000564970351 383988428 /nfs/dbraw/zinc/98/84/28/383988428.db2.gz JTFBWNZQOYZSRT-NEPJUHHUSA-N 2 0 243.354 2.450 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+]CCc1cccc2[nH]ccc21 ZINC000569447675 384051636 /nfs/dbraw/zinc/05/16/36/384051636.db2.gz NVVMYZODUOHQDG-DZGCQCFKSA-N 2 0 243.354 2.180 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000643549040 384037766 /nfs/dbraw/zinc/03/77/66/384037766.db2.gz ZJEOUXFIOBDNFN-FRRDWIJNSA-N 2 0 222.376 2.439 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)[C@H]1C ZINC000643548788 384038613 /nfs/dbraw/zinc/03/86/13/384038613.db2.gz VEQKJTLVHHFPMI-XQHKEYJVSA-N 2 0 222.376 2.295 20 0 BEADRP CC1(C)CC([NH2+]Cc2cc[nH]c2)CC(C)(C)[NH2+]1 ZINC000090994280 384088885 /nfs/dbraw/zinc/08/88/85/384088885.db2.gz QXVJOFUVZPMLQJ-UHFFFAOYSA-N 2 0 235.375 2.414 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CCc1ccccc1F ZINC000310116180 384058051 /nfs/dbraw/zinc/05/80/51/384058051.db2.gz CMANAZWKZMQZHO-LBPRGKRZSA-N 2 0 238.350 2.475 20 0 BEADRP C[C@@H]([NH2+]C1CC[NH2+]CC1)c1ccccc1 ZINC000038040467 384060231 /nfs/dbraw/zinc/06/02/31/384060231.db2.gz YIHGPADYGNMOGL-LLVKDONJSA-N 2 0 204.317 2.089 20 0 BEADRP CCC[NH+]1CCC(C[N@H+](C)C(C)C)CC1 ZINC000560336451 384075338 /nfs/dbraw/zinc/07/53/38/384075338.db2.gz DBUKTMJPWMZBNQ-UHFFFAOYSA-N 2 0 212.381 2.449 20 0 BEADRP C[NH2+]CCC[N@H+](C)[C@@H](C)C1CCCCC1 ZINC000087472221 384150581 /nfs/dbraw/zinc/15/05/81/384150581.db2.gz DVSFWGVPIFANTB-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H]1CSC[C@@H]1[NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000449175467 384166905 /nfs/dbraw/zinc/16/69/05/384166905.db2.gz RBXVBSOXGIOJPA-LPWJVIDDSA-N 2 0 242.432 2.200 20 0 BEADRP C[NH2+]CCC[N@@H+]1[C@H](C)C[C@@H]2CCCC[C@H]21 ZINC000309636648 384185040 /nfs/dbraw/zinc/18/50/40/384185040.db2.gz MYGIERPFAZSWBT-FRRDWIJNSA-N 2 0 210.365 2.249 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H]2CCc3ccccc3C2)C1 ZINC000222999363 384181840 /nfs/dbraw/zinc/18/18/40/384181840.db2.gz HLXQWGPADKOEAF-OWCLPIDISA-N 2 0 244.382 2.403 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CC[N@H+](Cc2ccc3c(c2)CCC3)C1 ZINC000163242840 384188974 /nfs/dbraw/zinc/18/89/74/384188974.db2.gz IIJKKCIRIWDQBE-BLLLJJGKSA-N 2 0 244.382 2.344 20 0 BEADRP C[C@@H]1CCC[C@@H]1C[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000230650963 259648764 /nfs/dbraw/zinc/64/87/64/259648764.db2.gz FQUDZKXOQKKKDA-FDYHWXHSSA-N 2 0 210.365 2.282 20 0 BEADRP Cc1ccoc1C[N@H+](C)CC1CC[NH+](C)CC1 ZINC000093089169 384210237 /nfs/dbraw/zinc/21/02/37/384210237.db2.gz SKUILBTYUBOPCI-UHFFFAOYSA-N 2 0 236.359 2.362 20 0 BEADRP C[C@@H]1C[C@H](N(C)Cc2ccco2)CC[N@@H+]1C ZINC000093643685 384255124 /nfs/dbraw/zinc/25/51/24/384255124.db2.gz RAEVLCSDKRRREY-VXGBXAGGSA-N 2 0 222.332 2.194 20 0 BEADRP CN(CCC[NH+]1CCCC1)Cc1ccoc1 ZINC000336709888 384256403 /nfs/dbraw/zinc/25/64/03/384256403.db2.gz XUJCCSIITJNRFZ-UHFFFAOYSA-N 2 0 222.332 2.197 20 0 BEADRP CC[N@H+](Cc1ccncc1)[C@@H]1CCC[NH2+]CC1 ZINC000113712501 384260999 /nfs/dbraw/zinc/26/09/99/384260999.db2.gz BAYXAEPCUIDNRS-CQSZACIVSA-N 2 0 233.359 2.046 20 0 BEADRP CC[NH+](CC)C[C@@H]1CC[N@H+](CCCSC)C1 ZINC000174215593 384307619 /nfs/dbraw/zinc/30/76/19/384307619.db2.gz YQLDJDBBVBVYGW-ZDUSSCGKSA-N 2 0 244.448 2.403 20 0 BEADRP CSCCC[N@H+](C)CCCn1ccnc1C ZINC000119847002 384307836 /nfs/dbraw/zinc/30/78/36/384307836.db2.gz ZFECGXRTHSTYCR-UHFFFAOYSA-N 2 0 241.404 2.267 20 0 BEADRP c1cn(CC[N@@H+]2CCc3ccsc3C2)cn1 ZINC000133756409 384310126 /nfs/dbraw/zinc/31/01/26/384310126.db2.gz OOKPGDVDHBJIQB-UHFFFAOYSA-N 2 0 233.340 2.003 20 0 BEADRP CSCC[N@@H+]1CC[C@H](C)[C@@H](n2ccnc2)C1 ZINC000119975512 384322610 /nfs/dbraw/zinc/32/26/10/384322610.db2.gz PLYQLPCKNDMLQN-RYUDHWBXSA-N 2 0 239.388 2.129 20 0 BEADRP C[C@@H]([NH2+]CCCC[NH+](C)C)c1nccs1 ZINC000083143270 384283979 /nfs/dbraw/zinc/28/39/79/384283979.db2.gz KCKUSNONPBHEGI-SNVBAGLBSA-N 2 0 227.377 2.136 20 0 BEADRP CSCC[N@H+](C)CC[C@H]1CCCC[NH+]1C ZINC000173962693 384291572 /nfs/dbraw/zinc/29/15/72/384291572.db2.gz NDCZETXQLAABOW-GFCCVEGCSA-N 2 0 230.421 2.156 20 0 BEADRP C[C@@H]1C[C@H]1C[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000159041987 384298206 /nfs/dbraw/zinc/29/82/06/384298206.db2.gz FCODEVGEWKTVMJ-OLZOCXBDSA-N 2 0 245.370 2.296 20 0 BEADRP CCC(C)(C)C[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000174513606 384338355 /nfs/dbraw/zinc/33/83/55/384338355.db2.gz DLEFOXAYHPBHOM-NEPJUHHUSA-N 2 0 212.381 2.495 20 0 BEADRP C[C@@H]1CN(C)C[C@H]1[NH2+]CC1CCCCCC1 ZINC000309736246 384357216 /nfs/dbraw/zinc/35/72/16/384357216.db2.gz CKOMRZAQUNXFRC-TZMCWYRMSA-N 2 0 224.392 2.497 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCCCOC)[C@H](C)C1 ZINC000174776562 384363837 /nfs/dbraw/zinc/36/38/37/384363837.db2.gz SUWBYOYSPVASLV-ZIAGYGMSSA-N 2 0 242.407 2.075 20 0 BEADRP CC1(C)[C@H]([NH2+]CCCCC(F)(F)F)C[C@@H]1[NH3+] ZINC000405472052 384367603 /nfs/dbraw/zinc/36/76/03/384367603.db2.gz LBXWLWOHGLLRRV-DTWKUNHWSA-N 2 0 238.297 2.434 20 0 BEADRP COCC[C@H](C)[NH2+]CC(C)(C)C[NH+]1CCCC1 ZINC000357877181 384329037 /nfs/dbraw/zinc/32/90/37/384329037.db2.gz NNGZWMLQDXMNKX-ZDUSSCGKSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CC[NH2+]C1)c1cccs1 ZINC000095068385 384330206 /nfs/dbraw/zinc/33/02/06/384330206.db2.gz SGONINODYFRNLP-NXEZZACHSA-N 2 0 210.346 2.008 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+][C@@H]1CCC12CCC2 ZINC000308830945 384333507 /nfs/dbraw/zinc/33/35/07/384333507.db2.gz GERBBSIPSSZBBG-NWDGAFQWSA-N 2 0 210.365 2.249 20 0 BEADRP C(C[NH2+][C@H]1CCC[C@H]2C[C@H]21)C[NH+]1CCCC1 ZINC000304582228 384397149 /nfs/dbraw/zinc/39/71/49/384397149.db2.gz OHZMBUHPQPZXNM-MJBXVCDLSA-N 2 0 222.376 2.251 20 0 BEADRP CN(CCC[NH3+])Cc1cc(Cl)ccc1F ZINC000084511649 384402212 /nfs/dbraw/zinc/40/22/12/384402212.db2.gz RKLGBIOXIGZOOT-UHFFFAOYSA-N 2 0 230.714 2.260 20 0 BEADRP Cc1ccsc1CN[C@@H]1CCC[NH2+][C@@H]1C ZINC000335642687 384419064 /nfs/dbraw/zinc/41/90/64/384419064.db2.gz HHYLSAHJHFQTID-GHMZBOCLSA-N 2 0 224.373 2.287 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1Nc1ccccn1 ZINC000084213452 384377168 /nfs/dbraw/zinc/37/71/68/384377168.db2.gz SWILFNYZLYLOQU-QWRGUYRKSA-N 2 0 205.305 2.011 20 0 BEADRP C[N@H+]1CC=C(C[NH2+][C@H]2CCC(C)(C)C2)CC1 ZINC000335602284 384377665 /nfs/dbraw/zinc/37/76/65/384377665.db2.gz GALCLFZUKGVOQX-ZDUSSCGKSA-N 2 0 222.376 2.417 20 0 BEADRP CC(C)[C@H](C)C[NH2+][C@@H]1CCCC[C@@H]1C[NH3+] ZINC000084217036 384377889 /nfs/dbraw/zinc/37/78/89/384377889.db2.gz FDQYHCSGRCLJME-JHJVBQTASA-N 2 0 212.381 2.386 20 0 BEADRP C[N@H+]1CC=C(C[NH2+][C@H]2CCC23CCC3)CC1 ZINC000335602320 384378760 /nfs/dbraw/zinc/37/87/60/384378760.db2.gz QCMMQMGGPVTGSN-ZDUSSCGKSA-N 2 0 220.360 2.171 20 0 BEADRP c1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000045331752 384386347 /nfs/dbraw/zinc/38/63/47/384386347.db2.gz MBORLOMNPQQJJD-PBWFPOADSA-N 2 0 216.328 2.059 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]C2Cc3ccccc3C2)C1 ZINC000236330598 384387931 /nfs/dbraw/zinc/38/79/31/384387931.db2.gz BLTQVEPPMJVNQZ-KBPBESRZSA-N 2 0 230.355 2.013 20 0 BEADRP C[N@H+](CC1CC[NH2+]CC1)C1CC(C)(C)C1 ZINC000335662071 384467149 /nfs/dbraw/zinc/46/71/49/384467149.db2.gz DWLVZNDIKNJSPX-UHFFFAOYSA-N 2 0 210.365 2.106 20 0 BEADRP CN1CCC[C@@H]([NH2+]C2CCC(F)(F)CC2)C1 ZINC000647175013 384468832 /nfs/dbraw/zinc/46/88/32/384468832.db2.gz UHLIOKFSNFHZJJ-LLVKDONJSA-N 2 0 232.318 2.248 20 0 BEADRP CCC[C@H](C)[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000037485344 384507370 /nfs/dbraw/zinc/50/73/70/384507370.db2.gz KLFYBJYPRHYDQQ-RYUDHWBXSA-N 2 0 210.365 2.249 20 0 BEADRP c1cncc(C[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)c1 ZINC000249919499 384529884 /nfs/dbraw/zinc/52/98/84/384529884.db2.gz UXJSDQVKUJMCPM-RBSFLKMASA-N 2 0 245.370 2.092 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH2+]C2CCC(F)(F)CC2)C1 ZINC000647181547 384562933 /nfs/dbraw/zinc/56/29/33/384562933.db2.gz GOPHUMKFHGWHGN-NSHDSACASA-N 2 0 246.345 2.496 20 0 BEADRP Cc1cccc(CC[NH2+][C@H]2CCCCC[C@H]2[NH3+])n1 ZINC000423081064 384550910 /nfs/dbraw/zinc/55/09/10/384550910.db2.gz AZUGCOSXVPOMGW-CABCVRRESA-N 2 0 247.386 2.182 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCC[C@H]([NH3+])C1)[C@H]1C[C@@H]1C ZINC000423370256 384551053 /nfs/dbraw/zinc/55/10/53/384551053.db2.gz PIHRIFTXDKRKEA-WJTVCTBASA-N 2 0 210.365 2.281 20 0 BEADRP C[C@H]([NH2+]CCC[NH+]1CCCC1)c1ccncc1 ZINC000020129014 384582049 /nfs/dbraw/zinc/58/20/49/384582049.db2.gz BWVCQXAAPYXYIK-ZDUSSCGKSA-N 2 0 233.359 2.218 20 0 BEADRP CC(C)C[C@H]([NH3+])C[N@@H+]1CC[C@H]2CCC[C@@H]21 ZINC000355107484 384584234 /nfs/dbraw/zinc/58/42/34/384584234.db2.gz NSPOKMZBCCOVFJ-AGIUHOORSA-N 2 0 210.365 2.234 20 0 BEADRP CC(C)[NH2+]C[C@@H]1C[N@H+](C)C[C@H]1c1ccccc1 ZINC000647344670 384603387 /nfs/dbraw/zinc/60/33/87/384603387.db2.gz WOUOLCMTHHNEMF-CABCVRRESA-N 2 0 232.371 2.330 20 0 BEADRP C1[C@@H]2CC[C@@H]([NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)C[C@H]12 ZINC000403313573 384629365 /nfs/dbraw/zinc/62/93/65/384629365.db2.gz BLUKRLYVRXPGGA-VQJWOFKYSA-N 2 0 234.387 2.391 20 0 BEADRP CC(C)[N@@H+]1CC[C@H](C[NH2+]CC(C)(C)C)C1 ZINC000041051477 384595084 /nfs/dbraw/zinc/59/50/84/384595084.db2.gz HBOUDVZSGHDZKQ-GFCCVEGCSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCC12CCCC2)C[NH+](C)C ZINC000309769736 384598924 /nfs/dbraw/zinc/59/89/24/384598924.db2.gz OJQTYSWHZLNCBE-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]C2CC(C(F)(F)F)C2)C1 ZINC000568247598 384600494 /nfs/dbraw/zinc/60/04/94/384600494.db2.gz RDYJLWNVSPXOJA-DSAQSWLYSA-N 2 0 236.281 2.187 20 0 BEADRP CC(C)[NH+](CCC[NH2+][C@@H]1CO[C@@H](C)C1)C(C)C ZINC000647188929 384647923 /nfs/dbraw/zinc/64/79/23/384647923.db2.gz SAMRRBJUBPVUSJ-KBPBESRZSA-N 2 0 242.407 2.262 20 0 BEADRP CCCCOCCC[NH2+][C@H]1CCCC[C@@H]1C[NH3+] ZINC000160195415 384656246 /nfs/dbraw/zinc/65/62/46/384656246.db2.gz CKBMTGPZEUQJNU-KGLIPLIRSA-N 2 0 242.407 2.300 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH2+]CCC(C)(C)C)C1 ZINC000044536038 384656772 /nfs/dbraw/zinc/65/67/72/384656772.db2.gz MRUBQZFBAMDXFZ-LBPRGKRZSA-N 2 0 212.381 2.354 20 0 BEADRP CSCCC[NH2+][C@@H]1CC[N@H+](C)[C@H]2CCC[C@@H]21 ZINC000309935864 384725032 /nfs/dbraw/zinc/72/50/32/384725032.db2.gz ZTBPYAGZZOTQGY-UPJWGTAASA-N 2 0 242.432 2.202 20 0 BEADRP C[NH+](C)CC1(C[NH2+]Cc2cc[nH]c2)CCCC1 ZINC000185293091 384701014 /nfs/dbraw/zinc/70/10/14/384701014.db2.gz ZOAFIGAULSVRKJ-UHFFFAOYSA-N 2 0 235.375 2.226 20 0 BEADRP C(C1CC1)[N@@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000647544066 384715188 /nfs/dbraw/zinc/71/51/88/384715188.db2.gz VZNMMOGASAABMA-KGLIPLIRSA-N 2 0 222.376 2.108 20 0 BEADRP Fc1ccc2c(c1)[C@@H]([NH2+]CC[C@@H]1CC[NH2+]C1)CC2 ZINC000423241149 384778121 /nfs/dbraw/zinc/77/81/21/384778121.db2.gz DEUKGHDMGRYJJC-NHYWBVRUSA-N 2 0 248.345 2.402 20 0 BEADRP C[C@@H]([NH3+])c1ccc(N[C@@H]2C[NH2+]C[C@@H](C)C2)cc1 ZINC000647546606 384732845 /nfs/dbraw/zinc/73/28/45/384732845.db2.gz RIPHRRMZVFBEOE-WDMOLILDSA-N 2 0 233.359 2.116 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]CCc1ccsc1 ZINC000308469583 384739596 /nfs/dbraw/zinc/73/95/96/384739596.db2.gz BGPLSPYSVFERLL-JTQLQIEISA-N 2 0 212.362 2.008 20 0 BEADRP C[NH+](C)CCC[NH2+][C@@H]1CCC[C@H]1CCCF ZINC000309957371 384740116 /nfs/dbraw/zinc/74/01/16/384740116.db2.gz JBHNIPNPAOFXJI-QWHCGFSZSA-N 2 0 230.371 2.446 20 0 BEADRP C[C@H]([NH2+]CCN)C1CCC(C(F)(F)F)CC1 ZINC000423192541 384746884 /nfs/dbraw/zinc/74/68/84/384746884.db2.gz VVBBXHGWTWLJHV-IDKOKCKLSA-N 2 0 238.297 2.292 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)[C@H]1CC1(C)C ZINC000397596463 384755086 /nfs/dbraw/zinc/75/50/86/384755086.db2.gz KIGJCEIXIAHZAF-OUCADQQQSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)[C@H]1CC1(C)C ZINC000397596467 384756840 /nfs/dbraw/zinc/75/68/40/384756840.db2.gz KIGJCEIXIAHZAF-SGMGOOAPSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@@H]([NH2+]C1CCCCCC1)[C@@H]1CCC[NH2+]1 ZINC000335037247 384780312 /nfs/dbraw/zinc/78/03/12/384780312.db2.gz BSCWARQBJXOYQX-YPMHNXCESA-N 2 0 210.365 2.439 20 0 BEADRP C([NH2+][C@@H]1CC[NH2+]C12CCCC2)[C@H]1CCSC1 ZINC000647553476 384767857 /nfs/dbraw/zinc/76/78/57/384767857.db2.gz ALJGRUBCXLIXBH-VXGBXAGGSA-N 2 0 240.416 2.004 20 0 BEADRP CC(C)CC[NH2+][C@@H]1CC[N@H+](C)[C@H]2CCC[C@@H]21 ZINC000375852032 384826486 /nfs/dbraw/zinc/82/64/86/384826486.db2.gz NBBOPOWNCLCSCR-MCIONIFRSA-N 2 0 224.392 2.495 20 0 BEADRP COCC[C@@H]1CCC[C@@H]1[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000423359617 384833215 /nfs/dbraw/zinc/83/32/15/384833215.db2.gz DNBMDZLTHMHZQA-CRWXNKLISA-N 2 0 240.391 2.051 20 0 BEADRP Cc1ccoc1C[NH2+]CCCC[NH+](C)C ZINC000126733688 384798202 /nfs/dbraw/zinc/79/82/02/384798202.db2.gz QPJHXTAIZDZIFH-UHFFFAOYSA-N 2 0 210.321 2.019 20 0 BEADRP C[C@@H](CCC1CC1)[NH2+][C@@H]1CCN(C2CC2)C1 ZINC000336753689 384800437 /nfs/dbraw/zinc/80/04/37/384800437.db2.gz WMKDBQSEDOSIJQ-WCQYABFASA-N 2 0 222.376 2.391 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+]CC1CC(C)(C)C1 ZINC000564826480 384805002 /nfs/dbraw/zinc/80/50/02/384805002.db2.gz PUBIMJFDICXKJZ-WCQYABFASA-N 2 0 224.392 2.400 20 0 BEADRP C(C[NH2+]C[C@@H]1CCSC1)C[NH+]1CCCCC1 ZINC000163629789 384837079 /nfs/dbraw/zinc/83/70/79/384837079.db2.gz UGGZMXXAOLMDPI-ZDUSSCGKSA-N 2 0 242.432 2.205 20 0 BEADRP C[NH+]1CCC(C[NH2+]C[C@@H]2CC[C@H]3C[C@H]3C2)CC1 ZINC000403862279 384876312 /nfs/dbraw/zinc/87/63/12/384876312.db2.gz WQPOBBJVIBTIRA-QLFBSQMISA-N 2 0 236.403 2.354 20 0 BEADRP COC[C@H]([NH2+][C@@H]1CCC[C@@H]([NH3+])C1)C1CCCC1 ZINC000423364808 384842344 /nfs/dbraw/zinc/84/23/44/384842344.db2.gz JYJPKGPMQNULAY-MCIONIFRSA-N 2 0 240.391 2.051 20 0 BEADRP C[NH+]1CCC(CC[NH2+][C@@H]2CCC2(C)C)CC1 ZINC000336672474 384846821 /nfs/dbraw/zinc/84/68/21/384846821.db2.gz SULVHVBRJYCLIJ-CYBMUJFWSA-N 2 0 224.392 2.497 20 0 BEADRP C[N@H+]1CC=C(C[NH2+]C[C@@H]2CC[C@H]3C[C@H]3C2)CC1 ZINC000403677729 384850571 /nfs/dbraw/zinc/85/05/71/384850571.db2.gz PLNXXFYURNBWPU-QLFBSQMISA-N 2 0 234.387 2.274 20 0 BEADRP CC[C@@H](C)C[NH2+]CCN(CC)C(C)C ZINC000308600597 384856193 /nfs/dbraw/zinc/85/61/93/384856193.db2.gz OFKAMSSXTCCCBC-GFCCVEGCSA-N 2 0 200.370 2.352 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CCCC[C@@H]2C[NH3+])nc1C ZINC000314214871 384860580 /nfs/dbraw/zinc/86/05/80/384860580.db2.gz UAQORMYYJXKYKL-HIFRSBDPSA-N 2 0 247.386 2.306 20 0 BEADRP CC(C)Oc1ccc(CN[C@@H]2CCC[C@H]2[NH3+])cc1 ZINC000258920501 384952084 /nfs/dbraw/zinc/95/20/84/384952084.db2.gz ISYGNPHMTYYDOK-HUUCEWRRSA-N 2 0 248.370 2.443 20 0 BEADRP Cc1ccc(C[NH2+]CC[C@@H]2CC[NH2+]C2)cc1C ZINC000258984314 384954292 /nfs/dbraw/zinc/95/42/92/384954292.db2.gz LEYXXFPNKRRKLU-AWEZNQCLSA-N 2 0 232.371 2.393 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH2+][C@@H]2CCCC2(C)C)C1 ZINC000086857122 384893638 /nfs/dbraw/zinc/89/36/38/384893638.db2.gz DTPQYFLXSWBZLC-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@@H]([NH3+])C[C@@H]2C)cc1 ZINC000049708895 384897654 /nfs/dbraw/zinc/89/76/54/384897654.db2.gz MMYZMMWCQQINKD-GXTWGEPZSA-N 2 0 218.344 2.307 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CCc1cccc(F)c1 ZINC000310215335 384904285 /nfs/dbraw/zinc/90/42/85/384904285.db2.gz FBBZJHSKKKLXJE-LBPRGKRZSA-N 2 0 238.350 2.475 20 0 BEADRP CC[C@@H](CSC)[NH2+][C@@H](C)CCCC[NH3+] ZINC000308661016 384905908 /nfs/dbraw/zinc/90/59/08/384905908.db2.gz PUCNFKKZHASZDS-QWRGUYRKSA-N 2 0 218.410 2.235 20 0 BEADRP COc1ccc(C)cc1CC[NH2+][C@H]1CCC[C@H]1[NH3+] ZINC000259239213 384958954 /nfs/dbraw/zinc/95/89/54/384958954.db2.gz YHQADCDHTLTGKP-KGLIPLIRSA-N 2 0 248.370 2.016 20 0 BEADRP CC(C)(C)[C@H]1CCC[N@@H+]1CC[C@@H]1CC[NH2+]C1 ZINC000257777262 384926534 /nfs/dbraw/zinc/92/65/34/384926534.db2.gz MRQDOHUKJVNXEE-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)(C)[C@@H]1CCC[N@@H+]1CC[C@@H]1CC[NH2+]C1 ZINC000257777263 384927169 /nfs/dbraw/zinc/92/71/69/384927169.db2.gz MRQDOHUKJVNXEE-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP Cc1ccc(CC[NH2+]CC(C)(C)[NH3+])c(C)c1 ZINC000258680780 384932682 /nfs/dbraw/zinc/93/26/82/384932682.db2.gz AWUZGHRDIGGVEN-UHFFFAOYSA-N 2 0 220.360 2.173 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[C@H]1C1CCC1)C1CC[NH+](C)CC1 ZINC000643908607 384933556 /nfs/dbraw/zinc/93/35/56/384933556.db2.gz PSCPHHUPUMIJAT-BYCMXARLSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@H](NC[C@H]1CCC[N@H+](C)C1)c1ccoc1 ZINC000087290076 384936410 /nfs/dbraw/zinc/93/64/10/384936410.db2.gz GIVRKPQGKQCSNU-NWDGAFQWSA-N 2 0 222.332 2.272 20 0 BEADRP CCc1ccc(CC[N@H+](C)CCC[NH2+]C)cc1 ZINC000258854276 384947997 /nfs/dbraw/zinc/94/79/97/384947997.db2.gz XUSLXPQHHISEGE-UHFFFAOYSA-N 2 0 234.387 2.333 20 0 BEADRP C[C@@H]1CCC[N@H+](C[C@H]2CCCCO2)[C@@H]1CC[NH3+] ZINC000404281181 384965798 /nfs/dbraw/zinc/96/57/98/384965798.db2.gz FAWRGGXLJSPLQP-MGPQQGTHSA-N 2 0 240.391 2.005 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H](C)C2CC2)[C@H](C)C1 ZINC000177387002 384992215 /nfs/dbraw/zinc/99/22/15/384992215.db2.gz KAAVRKKGRUQBIK-MDZLAQPJSA-N 2 0 210.365 2.105 20 0 BEADRP CC[C@H](CSC)[NH2+][C@@H]1CN(CC)C[C@H]1C ZINC000336762000 384994098 /nfs/dbraw/zinc/99/40/98/384994098.db2.gz NIPZYGBEDSQWKQ-IJLUTSLNSA-N 2 0 230.421 2.058 20 0 BEADRP C[NH+](C)CC[C@@H]([NH2+]Cc1cc[nH]c1)C(C)(C)C ZINC000086254392 385002454 /nfs/dbraw/zinc/00/24/54/385002454.db2.gz ZEMVYUQEKLCPOM-CYBMUJFWSA-N 2 0 237.391 2.471 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+][C@H]1CC[C@H]1C1CC1 ZINC000423462828 384962005 /nfs/dbraw/zinc/96/20/05/384962005.db2.gz POEGSZWDKGBRHQ-DVUXXLOYSA-N 2 0 234.387 2.281 20 0 BEADRP COCc1cccc(C[NH2+][C@@H]2C[C@@H]([NH3+])C2(C)C)c1 ZINC000404758043 385050692 /nfs/dbraw/zinc/05/06/92/385050692.db2.gz APZJHAXAENVOJD-ZIAGYGMSSA-N 2 0 248.370 2.048 20 0 BEADRP Cc1ccc(F)cc1CN1CC[C@@H]([NH3+])[C@H](C)C1 ZINC000157085177 385063894 /nfs/dbraw/zinc/06/38/94/385063894.db2.gz MPFLJVRKQUVRSD-BXUZGUMPSA-N 2 0 236.334 2.303 20 0 BEADRP C[C@H](F)CC[NH2+][C@@H]1CC[N@H+](C)[C@H]2CCC[C@H]21 ZINC000340464313 385065211 /nfs/dbraw/zinc/06/52/11/385065211.db2.gz SPVKTRBFSQTGLH-RVMXOQNASA-N 2 0 228.355 2.197 20 0 BEADRP CC(C)C1([NH2+][C@@H]2CN(C3CC3)C[C@H]2C)CC1 ZINC000340479253 385068663 /nfs/dbraw/zinc/06/86/63/385068663.db2.gz PJJBTPSKOSWDOJ-DGCLKSJQSA-N 2 0 222.376 2.247 20 0 BEADRP CC(C)C1([NH2+][C@@H]2CN(C3CC3)C[C@@H]2C)CC1 ZINC000340479257 385069577 /nfs/dbraw/zinc/06/95/77/385069577.db2.gz PJJBTPSKOSWDOJ-WCQYABFASA-N 2 0 222.376 2.247 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+]C[C@H]1CCCC[C@H]1C ZINC000300024702 385074356 /nfs/dbraw/zinc/07/43/56/385074356.db2.gz OCNSODWSZBUFNA-MCIONIFRSA-N 2 0 242.407 2.156 20 0 BEADRP CC1(C)[C@H]([NH3+])C[C@H]1NCc1ccccc1F ZINC000404806682 385077718 /nfs/dbraw/zinc/07/77/18/385077718.db2.gz ZCMRCCVHDHZRGY-VXGBXAGGSA-N 2 0 222.307 2.041 20 0 BEADRP C1=C(CC[NH2+][C@@H]2CC[C@H]2C2CC2)CC[NH2+]C1 ZINC000423543714 385025349 /nfs/dbraw/zinc/02/53/49/385025349.db2.gz VPKLVEQVUQVGMN-UONOGXRCSA-N 2 0 220.360 2.074 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@@H]([NH3+])[C@@H](C)C2)cc1C ZINC000227055365 385085265 /nfs/dbraw/zinc/08/52/65/385085265.db2.gz NWERWQIKMPZRGH-DZGCQCFKSA-N 2 0 232.371 2.473 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@H]([NH3+])[C@@H](C)C2)cc1C ZINC000227055374 385085682 /nfs/dbraw/zinc/08/56/82/385085682.db2.gz NWERWQIKMPZRGH-ZFWWWQNUSA-N 2 0 232.371 2.473 20 0 BEADRP Cc1ccc(C[NH2+]C[C@@H](C)C[NH+](C)C)cc1 ZINC000291666349 385201660 /nfs/dbraw/zinc/20/16/60/385201660.db2.gz FWADYTAJKVGSOH-CYBMUJFWSA-N 2 0 220.360 2.282 20 0 BEADRP [NH3+]C1CC[NH+](Cc2ccc3cnccc3c2)CC1 ZINC000647482105 385195457 /nfs/dbraw/zinc/19/54/57/385195457.db2.gz WVCPRSPRQISHNW-UHFFFAOYSA-N 2 0 241.338 2.158 20 0 BEADRP [NH3+][C@@H]1CCCC[C@H]1[NH2+][C@@H]1CC[C@@H]1C1CC1 ZINC000424370893 385151458 /nfs/dbraw/zinc/15/14/58/385151458.db2.gz DXZOTCXVPJKDLM-FDYHWXHSSA-N 2 0 208.349 2.035 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CC23CC3)[C@H]2CCC[C@@H]21 ZINC000424321269 385160290 /nfs/dbraw/zinc/16/02/90/385160290.db2.gz KCMFLPRVTBXEMI-MROQNXINSA-N 2 0 220.360 2.001 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H](C)C1CCC1 ZINC000178033235 385175891 /nfs/dbraw/zinc/17/58/91/385175891.db2.gz YRRLGNOINYBBIZ-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H](C)C1CCC1 ZINC000178033245 385176399 /nfs/dbraw/zinc/17/63/99/385176399.db2.gz YRRLGNOINYBBIZ-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP C[N@@H+]1C[C@@H](C[NH2+]CC2CC2)[C@H](c2ccccc2)C1 ZINC000647248817 385212702 /nfs/dbraw/zinc/21/27/02/385212702.db2.gz IJQWATRXINEEAA-CVEARBPZSA-N 2 0 244.382 2.331 20 0 BEADRP CCCN(CC)CC[NH2+][C@H](C)C1CCC1 ZINC000178231685 385214132 /nfs/dbraw/zinc/21/41/32/385214132.db2.gz JCJIFHNONZRQMB-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CC[N@H+](CC)C1 ZINC000252713515 385217270 /nfs/dbraw/zinc/21/72/70/385217270.db2.gz PKIHKCWZYWMVAU-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CCCC(F)(F)F ZINC000308876224 385241658 /nfs/dbraw/zinc/24/16/58/385241658.db2.gz UOCUZXGWQAHDMW-VIFPVBQESA-N 2 0 226.286 2.436 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+][C@H](C)CCC[NH3+])o1 ZINC000308895988 385251040 /nfs/dbraw/zinc/25/10/40/385251040.db2.gz ZJFNEFCDBRXVRS-MWLCHTKSSA-N 2 0 210.321 2.366 20 0 BEADRP C[C@H]([NH2+]CCCC[NH3+])c1ccc(F)c(F)c1 ZINC000037714957 385309612 /nfs/dbraw/zinc/30/96/12/385309612.db2.gz GZUIWGWVGVKZMI-VIFPVBQESA-N 2 0 228.286 2.354 20 0 BEADRP C[C@]1(C[N@@H+]2CCC[C@@H]3CCC[C@H]32)CC[NH2+]C1 ZINC000228026577 385315382 /nfs/dbraw/zinc/31/53/82/385315382.db2.gz OQVPWCOLWYBJOC-MJBXVCDLSA-N 2 0 222.376 2.251 20 0 BEADRP C[NH+](C)CCCC[NH2+]Cc1ccc(Cl)o1 ZINC000045598323 385269395 /nfs/dbraw/zinc/26/93/95/385269395.db2.gz KLJIQBJNCCLJSR-UHFFFAOYSA-N 2 0 230.739 2.364 20 0 BEADRP C[C@H]([NH2+]CCCC[NH+](C)C)c1ccco1 ZINC000045663404 385273322 /nfs/dbraw/zinc/27/33/22/385273322.db2.gz VGJWAJJHTIAOON-NSHDSACASA-N 2 0 210.321 2.272 20 0 BEADRP C[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000034264456 385276935 /nfs/dbraw/zinc/27/69/35/385276935.db2.gz FOSNQWWFKGJNOZ-CQSZACIVSA-N 2 0 218.344 2.070 20 0 BEADRP [NH3+]CC[C@H]1CCCC[N@@H+]1CCCCCF ZINC000308909142 385283998 /nfs/dbraw/zinc/28/39/98/385283998.db2.gz FYCSJFZWENHSIH-GFCCVEGCSA-N 2 0 216.344 2.330 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)C2CCC2)C1 ZINC000178510410 385290679 /nfs/dbraw/zinc/29/06/79/385290679.db2.gz SDQJFFZKWWRFBI-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP C[N@H+]1CC=C(C[NH2+]C2CCCCC2)CC1 ZINC000308944123 385300008 /nfs/dbraw/zinc/30/00/08/385300008.db2.gz NCFQZKBGMKNGHV-UHFFFAOYSA-N 2 0 208.349 2.171 20 0 BEADRP CC[C@@H]([NH2+]C[C@H](C)C[NH3+])c1ccccc1 ZINC000308981059 385323815 /nfs/dbraw/zinc/32/38/15/385323815.db2.gz KIPJQNJOOSEZJX-DGCLKSJQSA-N 2 0 206.333 2.322 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H]1CSC[C@H]1C ZINC000336698541 385330459 /nfs/dbraw/zinc/33/04/59/385330459.db2.gz ONXMONXTOICKEB-NEPJUHHUSA-N 2 0 230.421 2.059 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]C[C@@H]1CCCCS1 ZINC000308998278 385337968 /nfs/dbraw/zinc/33/79/68/385337968.db2.gz KOOYOGDLGGRCPD-RYUDHWBXSA-N 2 0 230.421 2.379 20 0 BEADRP CC(C)CCC[NH2+]CC1=CC[N@H+](C)CC1 ZINC000309009695 385359103 /nfs/dbraw/zinc/35/91/03/385359103.db2.gz RHJKAEBRHMOWSG-UHFFFAOYSA-N 2 0 210.365 2.274 20 0 BEADRP Cc1cc(C)cc(C[N@H+]2CC[C@@H]([C@H](C)[NH3+])C2)c1 ZINC000228201036 385363535 /nfs/dbraw/zinc/36/35/35/385363535.db2.gz RBLQPORCPZTZAD-DZGCQCFKSA-N 2 0 232.371 2.473 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]CCCCF)CC1 ZINC000309004945 385365328 /nfs/dbraw/zinc/36/53/28/385365328.db2.gz UAXZHRDRPUYKOL-UHFFFAOYSA-N 2 0 216.344 2.199 20 0 BEADRP C[N@H+](CCCn1ccnc1)C[Si](C)(C)C ZINC000178434173 385372702 /nfs/dbraw/zinc/37/27/02/385372702.db2.gz GHLPEYDZMKTYSY-UHFFFAOYSA-N 2 0 225.412 2.082 20 0 BEADRP Cc1ccc(C)c(C[N@H+]2C[C@H](C[NH3+])C[C@H]2C)c1 ZINC000228078912 385327732 /nfs/dbraw/zinc/32/77/32/385327732.db2.gz DJCRXGQGHNOFAK-KGLIPLIRSA-N 2 0 232.371 2.473 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H](C)c1cccc(F)c1 ZINC000308972843 385327806 /nfs/dbraw/zinc/32/78/06/385327806.db2.gz HFXJGVYXYOVKKC-ZJUUUORDSA-N 2 0 210.296 2.071 20 0 BEADRP C[NH+](C)CCC[NH2+]C1CCC2(CC2)CC1 ZINC000309066951 385392200 /nfs/dbraw/zinc/39/22/00/385392200.db2.gz ZYVOECFDJCXEKY-UHFFFAOYSA-N 2 0 210.365 2.251 20 0 BEADRP CCSCC[NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1 ZINC000309061024 385397245 /nfs/dbraw/zinc/39/72/45/385397245.db2.gz WPPWAWBUMMQVFN-NEPJUHHUSA-N 2 0 230.421 2.202 20 0 BEADRP C[C@@H]1[C@@H]([NH2+]CCC(C)(C)C)CCCN1C ZINC000309090941 385414432 /nfs/dbraw/zinc/41/44/32/385414432.db2.gz BEQRFHPLZDKSIE-NEPJUHHUSA-N 2 0 212.381 2.495 20 0 BEADRP CCc1ccc(C[NH2+][C@H](C)CCC[NH3+])cc1 ZINC000309203668 385479634 /nfs/dbraw/zinc/47/96/34/385479634.db2.gz AUBOEQXTQVGFAP-GFCCVEGCSA-N 2 0 220.360 2.466 20 0 BEADRP CSCC[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000179700861 385483767 /nfs/dbraw/zinc/48/37/67/385483767.db2.gz CCUATBXKFLUVOK-UHFFFAOYSA-N 2 0 244.448 2.403 20 0 BEADRP CC(C)c1nccc(NCC[N@@H+](C)C(C)C)n1 ZINC000110480927 385493207 /nfs/dbraw/zinc/49/32/07/385493207.db2.gz KPUKBWXCUOUCBC-UHFFFAOYSA-N 2 0 236.363 2.352 20 0 BEADRP CC(C)(C)CCC[N@@H+]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000309339103 385539200 /nfs/dbraw/zinc/53/92/00/385539200.db2.gz KGRPNFROILTXGK-QWHCGFSZSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CC[C@H]1CCCCO1 ZINC000309356529 385547801 /nfs/dbraw/zinc/54/78/01/385547801.db2.gz NLFLWETVPPJVBG-QWHCGFSZSA-N 2 0 228.380 2.053 20 0 BEADRP Cc1ccsc1CC[NH2+][C@H]1CN(C)C[C@@H]1C ZINC000309356247 385547958 /nfs/dbraw/zinc/54/79/58/385547958.db2.gz AFOJIIFAJLVQBM-RYUDHWBXSA-N 2 0 238.400 2.139 20 0 BEADRP Cc1ccsc1CC[NH2+][C@@H]1CN(C)C[C@@H]1C ZINC000309356246 385548098 /nfs/dbraw/zinc/54/80/98/385548098.db2.gz AFOJIIFAJLVQBM-NWDGAFQWSA-N 2 0 238.400 2.139 20 0 BEADRP CC(C)(C)CCC[N@@H+]1C[C@@H]2CC[C@H]([NH3+])[C@H]2C1 ZINC000309388807 385560068 /nfs/dbraw/zinc/56/00/68/385560068.db2.gz SPOTUJVGAJGNGR-AVGNSLFASA-N 2 0 224.392 2.482 20 0 BEADRP C[C@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1nccs1 ZINC000309422746 385577304 /nfs/dbraw/zinc/57/73/04/385577304.db2.gz BFKKOIFVBZPAIX-WDEREUQCSA-N 2 0 239.388 2.326 20 0 BEADRP CC(C)[C@H]1C[C@H]([NH2+]CCN(C)C(C)C)CS1 ZINC000309401540 385571774 /nfs/dbraw/zinc/57/17/74/385571774.db2.gz WIFIMEIVRBAHDV-QWHCGFSZSA-N 2 0 244.448 2.446 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H]1CCCc2occc21 ZINC000336676055 385601598 /nfs/dbraw/zinc/60/15/98/385601598.db2.gz VNAMMSZKFIPIRN-PWSUYJOCSA-N 2 0 222.332 2.374 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CCc1ccccc1F ZINC000309457771 385590720 /nfs/dbraw/zinc/59/07/20/385590720.db2.gz REBIOQAJIZUSGX-LLVKDONJSA-N 2 0 224.323 2.085 20 0 BEADRP [NH3+]CCCC[NH2+][C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000082862877 385591495 /nfs/dbraw/zinc/59/14/95/385591495.db2.gz DKHAPZUUMFTRIE-VHSXEESVSA-N 2 0 238.297 2.436 20 0 BEADRP CCCC[NH+]1CCC([NH2+]C[C@@H]2C[C@@H]2C)CC1 ZINC000336724478 385614937 /nfs/dbraw/zinc/61/49/37/385614937.db2.gz FJDPJSYXCFGAST-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]Cc1ccc(F)c(C)c1 ZINC000414849681 385624545 /nfs/dbraw/zinc/62/45/45/385624545.db2.gz YADWQMRVYLHYPW-SNVBAGLBSA-N 2 0 224.323 2.079 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H]1C[C@H](C)[C@H]1C ZINC000336677603 385609283 /nfs/dbraw/zinc/60/92/83/385609283.db2.gz HYUQVQFHFTULJT-YNEHKIRRSA-N 2 0 212.381 2.352 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+]C[C@@H](C)CC)C1 ZINC000093064966 385651135 /nfs/dbraw/zinc/65/11/35/385651135.db2.gz XAFHMGNHQRVWDG-QWHCGFSZSA-N 2 0 212.381 2.354 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H](C)Cc1ccccc1F ZINC000414851557 385656473 /nfs/dbraw/zinc/65/64/73/385656473.db2.gz PISVINQRJWRIIA-VXGBXAGGSA-N 2 0 238.350 2.202 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]C[C@H](C)CC(C)C ZINC000414853099 385682553 /nfs/dbraw/zinc/68/25/53/385682553.db2.gz RTDPPQPTILGKGH-VXGBXAGGSA-N 2 0 200.370 2.114 20 0 BEADRP C[C@H](CCCC(F)(F)F)[NH2+]C[C@H]1CCC[NH2+]1 ZINC000414853366 385688694 /nfs/dbraw/zinc/68/86/94/385688694.db2.gz XUAVWZRBWPBWSQ-NXEZZACHSA-N 2 0 238.297 2.449 20 0 BEADRP C[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)C1CC1 ZINC000309587803 385713947 /nfs/dbraw/zinc/71/39/47/385713947.db2.gz SPTDZIZTZVRUMA-LLVKDONJSA-N 2 0 222.376 2.249 20 0 BEADRP CC(C)C[C@@H](CN(C)C)[NH2+][C@@H](C)CCCC[NH3+] ZINC000336692445 385734659 /nfs/dbraw/zinc/73/46/59/385734659.db2.gz HUZKCMUFBBYMAW-KBPBESRZSA-N 2 0 243.439 2.070 20 0 BEADRP C[NH2+]CCC[NH2+][C@H](C)CCc1ccccc1 ZINC000414858293 385734939 /nfs/dbraw/zinc/73/49/39/385734939.db2.gz IUZKPKYPEUHXQI-CYBMUJFWSA-N 2 0 220.360 2.207 20 0 BEADRP CC[C@H]1CCC[C@H](C[NH2+]CCC[NH2+]C)C1 ZINC000414859807 385738343 /nfs/dbraw/zinc/73/83/43/385738343.db2.gz NXECSKXEWXHLQI-STQMWFEESA-N 2 0 212.381 2.402 20 0 BEADRP CC[C@@H](Cc1ccccc1)[NH2+]CCC[NH2+]C ZINC000414860955 385743334 /nfs/dbraw/zinc/74/33/34/385743334.db2.gz QYVKRDZFGPFQTF-AWEZNQCLSA-N 2 0 220.360 2.207 20 0 BEADRP CCSc1cccc(C[NH2+]CCC[NH2+]C)c1 ZINC000414860170 385745548 /nfs/dbraw/zinc/74/55/48/385745548.db2.gz OMRQQZHKVLSDTQ-UHFFFAOYSA-N 2 0 238.400 2.498 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1CCCC[C@H]1C1CC1 ZINC000414861321 385748964 /nfs/dbraw/zinc/74/89/64/385748964.db2.gz RWOKNLHQRGNTDE-QWHCGFSZSA-N 2 0 210.365 2.154 20 0 BEADRP C[NH2+]CCC[NH2+][C@H]1CCCC[C@H]1C1CC1 ZINC000414861322 385749128 /nfs/dbraw/zinc/74/91/28/385749128.db2.gz RWOKNLHQRGNTDE-STQMWFEESA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H]([NH2+]Cc1ccccc1)[C@@H]1CCC[NH2+]C1 ZINC000414861302 385749694 /nfs/dbraw/zinc/74/96/94/385749694.db2.gz WKDZYEFUGUHSQU-GXTWGEPZSA-N 2 0 218.344 2.164 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H]1CSC[C@@H]1C ZINC000336698543 385753064 /nfs/dbraw/zinc/75/30/64/385753064.db2.gz ONXMONXTOICKEB-RYUDHWBXSA-N 2 0 230.421 2.059 20 0 BEADRP CC(C)([NH2+]CCn1ccnc1)c1cccs1 ZINC000309624792 385753221 /nfs/dbraw/zinc/75/32/21/385753221.db2.gz PVLLZQSGCCSWET-UHFFFAOYSA-N 2 0 235.356 2.470 20 0 BEADRP C[NH2+]CCC[NH2+]Cc1ccc2nc(C)ccc2c1 ZINC000414863122 385755929 /nfs/dbraw/zinc/75/59/29/385755929.db2.gz WUJGUCMTCMYQPG-UHFFFAOYSA-N 2 0 243.354 2.242 20 0 BEADRP C[NH2+]CCC[NH2+][C@H]1C[C@H](C)CC(C)(C)C1 ZINC000414864534 385764527 /nfs/dbraw/zinc/76/45/27/385764527.db2.gz ZJQCHLXNUPZNCA-RYUDHWBXSA-N 2 0 212.381 2.400 20 0 BEADRP CC[C@@H]([NH2+]CCC[NH3+])c1cccc(C)c1 ZINC000336703073 385772310 /nfs/dbraw/zinc/77/23/10/385772310.db2.gz QHQGURWYUFQAOJ-CYBMUJFWSA-N 2 0 206.333 2.385 20 0 BEADRP CC(C)[C@@H]1CCC[C@H]1[NH2+][C@@H]1CCCNC1 ZINC000414866516 385780336 /nfs/dbraw/zinc/78/03/36/385780336.db2.gz NATUJLVBXAPYSU-FRRDWIJNSA-N 2 0 210.365 2.153 20 0 BEADRP Cc1ccc(CCC[NH2+][C@H]2CC[NH2+][C@H](C)C2)cn1 ZINC000414945426 385799117 /nfs/dbraw/zinc/79/91/17/385799117.db2.gz IHBOQVZPJSJIBO-HIFRSBDPSA-N 2 0 247.386 2.053 20 0 BEADRP F[C@H]1CCC[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000647799634 385799828 /nfs/dbraw/zinc/79/98/28/385799828.db2.gz NHLLTWVJQJOADL-MSXOGSJSSA-N 2 0 226.339 2.140 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]C1Cc2ccccc2C1 ZINC000336713021 385803378 /nfs/dbraw/zinc/80/33/78/385803378.db2.gz OCENCNAFDIGITM-LBPRGKRZSA-N 2 0 232.371 2.261 20 0 BEADRP C[C@H]1C[NH2+]CC[C@H]1[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC000414947804 385805088 /nfs/dbraw/zinc/80/50/88/385805088.db2.gz WZGZPYVLNJSOIZ-QCEMKRCNSA-N 2 0 244.382 2.378 20 0 BEADRP CCc1ccc(C[NH2+]C2(C)CC[NH2+]CC2)cc1 ZINC000414947862 385806406 /nfs/dbraw/zinc/80/64/06/385806406.db2.gz XGGOLIQXBDULRE-UHFFFAOYSA-N 2 0 232.371 2.481 20 0 BEADRP C[C@@H](C[NH2+][C@@H](C)[C@@H]1CCCC[NH2+]1)CC(F)F ZINC000647800563 385807793 /nfs/dbraw/zinc/80/77/93/385807793.db2.gz FGYWEMBRTHSLFL-VWYCJHECSA-N 2 0 234.334 2.398 20 0 BEADRP CCC[NH2+]CC[NH2+][C@@H](C)CCC(F)(F)F ZINC000414867800 385809440 /nfs/dbraw/zinc/80/94/40/385809440.db2.gz JEOCUDHRRVAHHU-VIFPVBQESA-N 2 0 226.286 2.307 20 0 BEADRP C[C@@H](C[NH2+][C@@H](C)[C@H]1CCC[NH2+]1)CC(F)F ZINC000647801557 385811267 /nfs/dbraw/zinc/81/12/67/385811267.db2.gz YHJIKSWIJOICPY-KXUCPTDWSA-N 2 0 220.307 2.008 20 0 BEADRP CC[C@@H]([NH2+]C[C@H](C)C[NH3+])c1ccccc1OC ZINC000336716538 385812621 /nfs/dbraw/zinc/81/26/21/385812621.db2.gz QDHSRUGIFNRBQG-DGCLKSJQSA-N 2 0 236.359 2.331 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+]Cc1ccc(C[NH3+])cc1 ZINC000647802036 385833433 /nfs/dbraw/zinc/83/34/33/385833433.db2.gz CFWZSCQKXVEFRY-GFCCVEGCSA-N 2 0 244.338 2.459 20 0 BEADRP COc1cc(C[NH2+][C@H]2CC[NH2+][C@@H](C)C2)ccc1C ZINC000414954129 385834191 /nfs/dbraw/zinc/83/41/91/385834191.db2.gz SIATZFMATPXACP-JSGCOSHPSA-N 2 0 248.370 2.234 20 0 BEADRP C[C@H]([NH2+]C1(c2cccc(F)c2)CCC1)C1C[NH2+]C1 ZINC000647802267 385835496 /nfs/dbraw/zinc/83/54/96/385835496.db2.gz HQKXTQHCMPNWIF-NSHDSACASA-N 2 0 248.345 2.402 20 0 BEADRP CC(C)(C)C[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000112341317 385839165 /nfs/dbraw/zinc/83/91/65/385839165.db2.gz VJNQQHQMQXDHRS-NWDGAFQWSA-N 2 0 210.365 2.249 20 0 BEADRP Cc1cc(C[NH2+]C[C@@H](C)C[NH3+])ccc1Cl ZINC000414869650 385839555 /nfs/dbraw/zinc/83/95/55/385839555.db2.gz BBDBRPCTJTZJPO-VIFPVBQESA-N 2 0 226.751 2.333 20 0 BEADRP C[C@@H]1SCC[C@@H]1[NH2+][C@@H]1CCCCC[C@@H]1[NH3+] ZINC000647804205 385840716 /nfs/dbraw/zinc/84/07/16/385840716.db2.gz LJLAVHQDEVUWHI-FIQHERPVSA-N 2 0 228.405 2.130 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]CC1CCC(F)CC1 ZINC000647804318 385840763 /nfs/dbraw/zinc/84/07/63/385840763.db2.gz OZXPYIQSBQMRJU-MVKMKZAISA-N 2 0 228.355 2.232 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]Cc1ccccc1OCC1CC1 ZINC000414870751 385847289 /nfs/dbraw/zinc/84/72/89/385847289.db2.gz CHUPAAXUXFKLQN-GFCCVEGCSA-N 2 0 248.370 2.160 20 0 BEADRP CC(C)C1([NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)CC1 ZINC000647797904 385792332 /nfs/dbraw/zinc/79/23/32/385792332.db2.gz GUPGWCKHNOLXIU-RWMBFGLXSA-N 2 0 222.376 2.153 20 0 BEADRP CO[C@H](C)[C@H](C)[NH2+]CCCCC[NH+]1CCCC1 ZINC000340479111 385889203 /nfs/dbraw/zinc/88/92/03/385889203.db2.gz VSRHVZYSVKEEJY-UONOGXRCSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CCc1cc(F)cc(F)c1 ZINC000336721180 385892667 /nfs/dbraw/zinc/89/26/67/385892667.db2.gz SKRWSVYKMYFFKJ-SNVBAGLBSA-N 2 0 242.313 2.224 20 0 BEADRP CCC[NH2+]CC[NH2+][C@@H]1CCC[C@@H]1C1CC1 ZINC000414875622 385896788 /nfs/dbraw/zinc/89/67/88/385896788.db2.gz UYHBZNKAQWUSQI-CHWSQXEVSA-N 2 0 210.365 2.154 20 0 BEADRP C[N@H+](CCC[NH3+])[C@@H]1CCCc2ccc(F)cc21 ZINC000647847702 385898672 /nfs/dbraw/zinc/89/86/72/385898672.db2.gz ZXKBVQSOZKYJRJ-CQSZACIVSA-N 2 0 236.334 2.484 20 0 BEADRP Cc1cc(N)cc(C[NH2+][C@H](C)C[C@H]2CCC[NH2+]2)c1 ZINC000414964002 385902373 /nfs/dbraw/zinc/90/23/73/385902373.db2.gz LKFKSBAJPBAJPO-IUODEOHRSA-N 2 0 247.386 2.197 20 0 BEADRP CC[C@@H](Cc1ccccc1)[NH2+]CC1([NH3+])CCC1 ZINC000414876185 385905488 /nfs/dbraw/zinc/90/54/88/385905488.db2.gz KWVFFNKVXYQWIX-AWEZNQCLSA-N 2 0 232.371 2.479 20 0 BEADRP COC[C@@]1(C[NH2+]C[C@H](C)CC(C)C)CCC[NH2+]1 ZINC000414965500 385906106 /nfs/dbraw/zinc/90/61/06/385906106.db2.gz ZORDNHXXOCNVJC-KGLIPLIRSA-N 2 0 242.407 2.027 20 0 BEADRP CCC[NH2+]CC[NH2+][C@H]1CCC[C@@H]1C(C)C ZINC000414876384 385907167 /nfs/dbraw/zinc/90/71/67/385907167.db2.gz VTHFQUSULYUELM-OLZOCXBDSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CC2([NH3+])CCC2)[C@H](C)C1 ZINC000414877730 385929791 /nfs/dbraw/zinc/92/97/91/385929791.db2.gz NCVVMVCGGUNXIT-UTUOFQBUSA-N 2 0 210.365 2.282 20 0 BEADRP COc1ccccc1C[C@@H](C)[NH2+]CC1([NH3+])CCC1 ZINC000414877440 385922397 /nfs/dbraw/zinc/92/23/97/385922397.db2.gz MXVZANFNUHVDHK-GFCCVEGCSA-N 2 0 248.370 2.097 20 0 BEADRP C([NH2+][C@H]1CCC12CCCC2)[C@H]1CCC[NH2+]1 ZINC000335034817 385923337 /nfs/dbraw/zinc/92/33/37/385923337.db2.gz YMGOIHHGCVJRMY-NEPJUHHUSA-N 2 0 208.349 2.051 20 0 BEADRP C([NH2+][C@H]1CCC12CCCC2)[C@@H]1CCC[NH2+]1 ZINC000335034819 385924282 /nfs/dbraw/zinc/92/42/82/385924282.db2.gz YMGOIHHGCVJRMY-RYUDHWBXSA-N 2 0 208.349 2.051 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@H](C)[C@@]1(C)CCCO1 ZINC000340469493 385859552 /nfs/dbraw/zinc/85/95/52/385859552.db2.gz KEFWBJLGRACTON-ZIAGYGMSSA-N 2 0 242.407 2.264 20 0 BEADRP [NH3+]C1(C[NH2+][C@H]2CCC[C@H](C3CC3)C2)CCC1 ZINC000414871923 385859691 /nfs/dbraw/zinc/85/96/91/385859691.db2.gz DSIBWLATJSEGCN-STQMWFEESA-N 2 0 222.376 2.426 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H]2CCCC[C@@H]2C2CC2)CCC1 ZINC000414872138 385862323 /nfs/dbraw/zinc/86/23/23/385862323.db2.gz FJKZIBMUKPURCZ-CHWSQXEVSA-N 2 0 222.376 2.426 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+]Cc1ccsc1 ZINC000335037576 385927851 /nfs/dbraw/zinc/92/78/51/385927851.db2.gz FDLJJAVYSOIFOF-JQWIXIFHSA-N 2 0 224.373 2.226 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@@H]2CC[C@@H]2C2CCC2)CC1 ZINC000337990804 385870063 /nfs/dbraw/zinc/87/00/63/385870063.db2.gz CSKVOGGJGWTKCS-HUUCEWRRSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]C/C=C/c1ccc(F)cc1F ZINC000414873336 385875554 /nfs/dbraw/zinc/87/55/54/385875554.db2.gz HBALOOYPVPGHLD-VMZHVLLKSA-N 2 0 240.297 2.162 20 0 BEADRP CC[C@@H]1CCC[C@H](C[NH2+]C[C@@H](C)C[NH3+])C1 ZINC000414873727 385880227 /nfs/dbraw/zinc/88/02/27/385880227.db2.gz HTKFKYYDKJPQOU-XQQFMLRXSA-N 2 0 212.381 2.387 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+]CC1CCSCC1 ZINC000335019230 385978855 /nfs/dbraw/zinc/97/88/55/385978855.db2.gz LVQPYSWGVYQJFJ-WCQYABFASA-N 2 0 242.432 2.107 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]1[NH2+]CC1CCC(F)(F)CC1 ZINC000335020931 385981546 /nfs/dbraw/zinc/98/15/46/385981546.db2.gz CZGXXUHQUBSZJA-QWRGUYRKSA-N 2 0 232.318 2.281 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+]C1CCCCC1 ZINC000335023351 385984504 /nfs/dbraw/zinc/98/45/04/385984504.db2.gz GTFDJBWASBJQJE-WCQYABFASA-N 2 0 210.365 2.297 20 0 BEADRP FC1(F)CCC[C@H](C[NH2+]C2CC[NH2+]CC2)C1 ZINC000335023579 385985132 /nfs/dbraw/zinc/98/51/32/385985132.db2.gz SCHAPCOVRDISKW-JTQLQIEISA-N 2 0 232.318 2.154 20 0 BEADRP CC[C@H]1CC[C@@H]1[NH2+]CC1=CC[N@H+](C)CC1 ZINC000336748837 385988758 /nfs/dbraw/zinc/98/87/58/385988758.db2.gz CZUGPKNMFGWKBC-STQMWFEESA-N 2 0 208.349 2.027 20 0 BEADRP C[C@@H](CCCC(F)(F)F)[NH2+][C@@H]1CC[NH2+]C1 ZINC000414881439 385991270 /nfs/dbraw/zinc/99/12/70/385991270.db2.gz KZULKNWMIJSKHV-DTWKUNHWSA-N 2 0 224.270 2.059 20 0 BEADRP CCC[NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000335042679 385935602 /nfs/dbraw/zinc/93/56/02/385935602.db2.gz UHCRMSIDNWSARO-ZFWWWQNUSA-N 2 0 246.354 2.242 20 0 BEADRP Cc1ccccc1C[C@@H](C)[NH2+]CC1([NH3+])CCC1 ZINC000414878705 385940614 /nfs/dbraw/zinc/94/06/14/385940614.db2.gz ORMIIWJCSBAXOB-CYBMUJFWSA-N 2 0 232.371 2.397 20 0 BEADRP CCCC[C@@H]1CCC[C@@H]1[NH2+][C@H]1CC[NH2+]C1 ZINC000414878878 385943068 /nfs/dbraw/zinc/94/30/68/385943068.db2.gz HYVASTXUDFQHRO-AGIUHOORSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]([NH2+]C1CCC([NH3+])CC1)c1ccncc1F ZINC000335048088 385943997 /nfs/dbraw/zinc/94/39/97/385943997.db2.gz AVZFEYFGNPXBML-KPPDAEKUSA-N 2 0 237.322 2.141 20 0 BEADRP CC[NH+](CC)CCC[NH+]1C[C@H](C)[C@@H](C)C1 ZINC000338305351 385952630 /nfs/dbraw/zinc/95/26/30/385952630.db2.gz KIDHSIWIIFOLOH-STQMWFEESA-N 2 0 212.381 2.306 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@H]1CCC[C@H]2C[C@H]21 ZINC000304648739 385955894 /nfs/dbraw/zinc/95/58/94/385955894.db2.gz YAYJLFNFVBABBH-MJBXVCDLSA-N 2 0 224.392 2.495 20 0 BEADRP CC(C)[C@H]1CCC[C@@H]1[NH2+]CC1([NH3+])CCC1 ZINC000414880033 385958549 /nfs/dbraw/zinc/95/85/49/385958549.db2.gz QJEBWVIKTQTKDN-NEPJUHHUSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CC2([NH3+])CCCCCC2)CCO1 ZINC000335057521 385959551 /nfs/dbraw/zinc/95/95/51/385959551.db2.gz FKAPLZHXMZQQOL-QWHCGFSZSA-N 2 0 240.391 2.195 20 0 BEADRP C1CC12CCC([NH2+]C1CC[NH2+]CC1)CC2 ZINC000335012359 385967885 /nfs/dbraw/zinc/96/78/85/385967885.db2.gz YPVXXTUTNUEBSO-UHFFFAOYSA-N 2 0 208.349 2.051 20 0 BEADRP C[C@H]1CCC[C@H](C[NH2+]CC2([NH3+])CCC2)C1 ZINC000414880823 385971576 /nfs/dbraw/zinc/97/15/76/385971576.db2.gz RCJKZVWPJOOGJF-RYUDHWBXSA-N 2 0 210.365 2.284 20 0 BEADRP Cc1ccc(C[NH2+]C[C@@H](C)C[NH3+])cc1Cl ZINC000414881855 386005436 /nfs/dbraw/zinc/00/54/36/386005436.db2.gz SVBAPPMXFKUUCV-VIFPVBQESA-N 2 0 226.751 2.333 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CN(C2CC2)C[C@@H]1C)[C@H]1C[C@H]1C ZINC000414111183 386005754 /nfs/dbraw/zinc/00/57/54/386005754.db2.gz MDOXRRHTFMQLAO-VJFWYMLFSA-N 2 0 236.403 2.493 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CN(C2CC2)C[C@@H]1C)[C@@H]1C[C@@H]1C ZINC000414111184 386006884 /nfs/dbraw/zinc/00/68/84/386006884.db2.gz MDOXRRHTFMQLAO-ZYDPBQMLSA-N 2 0 236.403 2.493 20 0 BEADRP C[C@@H]([NH2+]CC1([NH3+])CCC1)C1CCCCC1 ZINC000414882383 386011091 /nfs/dbraw/zinc/01/10/91/386011091.db2.gz UEUKUFPDRIKAJN-LLVKDONJSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1)[C@H]1C[C@H]1C ZINC000414117310 386011329 /nfs/dbraw/zinc/01/13/29/386011329.db2.gz RVJGGNGKOPQGSN-HTOAHKCRSA-N 2 0 224.392 2.493 20 0 BEADRP CC[C@@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)C1CC1 ZINC000414170852 386015972 /nfs/dbraw/zinc/01/59/72/386015972.db2.gz CLEMYGLHPYKZFM-GXTWGEPZSA-N 2 0 224.392 2.497 20 0 BEADRP COC(C)(C)[C@@H](C)[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC000414169825 386016390 /nfs/dbraw/zinc/01/63/90/386016390.db2.gz BODLPBZMNOWFFD-OLZOCXBDSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H](Cc1ccc(F)cc1)[NH2+]C[C@H]([NH3+])C1CC1 ZINC000414882591 386016597 /nfs/dbraw/zinc/01/65/97/386016597.db2.gz BYFXOBCWTBOLKS-YGRLFVJLSA-N 2 0 236.334 2.084 20 0 BEADRP C[N@@H+]1CCC[C@H](CC[NH2+][C@@H]2CCC2(C)C)C1 ZINC000414168595 386016776 /nfs/dbraw/zinc/01/67/76/386016776.db2.gz ANUPTYXQDIYIGU-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+]C1CC2(CCC2)C1 ZINC000336752783 386017398 /nfs/dbraw/zinc/01/73/98/386017398.db2.gz HCUCINZUTNKVIX-NSHDSACASA-N 2 0 210.365 2.249 20 0 BEADRP CC[C@H](C)[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000414177195 386020469 /nfs/dbraw/zinc/02/04/69/386020469.db2.gz ICFWJHZMXCVHSZ-JTQLQIEISA-N 2 0 203.289 2.222 20 0 BEADRP C[C@H]1CCC[C@@H]([NH2+]CC2=CC[NH2+]CC2)C1 ZINC000335061872 386027252 /nfs/dbraw/zinc/02/72/52/386027252.db2.gz YSUODMGFCMOKGM-WCQYABFASA-N 2 0 208.349 2.074 20 0 BEADRP Fc1ccc2c(c1)CC[C@H]2[NH2+]CC1=CC[NH2+]CC1 ZINC000335061497 386027473 /nfs/dbraw/zinc/02/74/73/386027473.db2.gz WZRXITZCYLFJRN-OAHLLOKOSA-N 2 0 246.329 2.322 20 0 BEADRP CCc1cccc(F)c1CNCC1([NH3+])CCC1 ZINC000414883476 386032940 /nfs/dbraw/zinc/03/29/40/386032940.db2.gz VAZZIWYPXDQYLS-UHFFFAOYSA-N 2 0 236.334 2.359 20 0 BEADRP C[C@H](C1CCC1)[N@@H+]1C[C@@H](C)[C@](C)(C[NH3+])C1 ZINC000393911263 386040316 /nfs/dbraw/zinc/04/03/16/386040316.db2.gz CBRVABWLWPFOKG-NQBHXWOUSA-N 2 0 210.365 2.092 20 0 BEADRP F[C@@H]1CCCC[C@H]1[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000414291497 386101639 /nfs/dbraw/zinc/10/16/39/386101639.db2.gz UKOXHEIBSBABER-REWJHTLYSA-N 2 0 240.366 2.484 20 0 BEADRP C[C@H](CC[NH3+])[NH2+]CCCCOc1ccccc1 ZINC000414888729 386104787 /nfs/dbraw/zinc/10/47/87/386104787.db2.gz FLXSJHHIIVPDBR-CYBMUJFWSA-N 2 0 236.359 2.173 20 0 BEADRP Fc1ccc(C[N@H+](C[C@H]2CC[NH2+]C2)C2CC2)cc1 ZINC000647873529 386121230 /nfs/dbraw/zinc/12/12/30/386121230.db2.gz WOPOZGRIOAFZBD-ZDUSSCGKSA-N 2 0 248.345 2.400 20 0 BEADRP COC1(C[NH2+]C[C@@H](C)C[NH+](C)C)CCCCC1 ZINC000319780965 386061301 /nfs/dbraw/zinc/06/13/01/386061301.db2.gz ZDZMNSNHKDFJSL-CYBMUJFWSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC=CCC1)c1cnccc1N ZINC000335032937 386067980 /nfs/dbraw/zinc/06/79/80/386067980.db2.gz CJSIYERUXXHFKG-MNOVXSKESA-N 2 0 217.316 2.253 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCSc2ccccc21)C1C[NH2+]C1 ZINC000335037973 386068152 /nfs/dbraw/zinc/06/81/52/386068152.db2.gz JURKQJKZKBFICW-ZWNOBZJWSA-N 2 0 248.395 2.421 20 0 BEADRP C1=C(C[NH2+]C2CCCCCC2)CC[NH2+]C1 ZINC000129430670 386076045 /nfs/dbraw/zinc/07/60/45/386076045.db2.gz YZMNYMHOPPLJEO-UHFFFAOYSA-N 2 0 208.349 2.219 20 0 BEADRP CC[C@@H]1CCC[C@H](C[NH2+][C@H]2CC[NH2+]C2)C1 ZINC000414886753 386078321 /nfs/dbraw/zinc/07/83/21/386078321.db2.gz QLCFCVGOBWXTGT-AGIUHOORSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H](C[NH2+][C@@H](C)Cc1ccc(F)cc1)N(C)C ZINC000223199928 386079906 /nfs/dbraw/zinc/07/99/06/386079906.db2.gz KJOZPBRTQWOSKY-NWDGAFQWSA-N 2 0 238.350 2.296 20 0 BEADRP CCc1ccc(CCN2CC[C@H]([NH2+]C)C2)cc1 ZINC000430602340 386082560 /nfs/dbraw/zinc/08/25/60/386082560.db2.gz GRIRRNWVGQAXSU-HNNXBMFYSA-N 2 0 232.371 2.085 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]CC1(C2CC2)CCC1 ZINC000391421237 386088648 /nfs/dbraw/zinc/08/86/48/386088648.db2.gz CJBWYVWECCOGBE-NSHDSACASA-N 2 0 210.365 2.284 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@@H]([NH3+])C2CC2)C[C@@H]1C ZINC000414891940 386145526 /nfs/dbraw/zinc/14/55/26/386145526.db2.gz OZNWEFSHCWRTCF-RSLMWUCJSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H]1CCc2ccccc2C1 ZINC000336729902 386149850 /nfs/dbraw/zinc/14/98/50/386149850.db2.gz XQVKHHQGWNCUQC-IUODEOHRSA-N 2 0 232.371 2.261 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CCC[C@@H]([NH3+])C1 ZINC000414992018 386151809 /nfs/dbraw/zinc/15/18/09/386151809.db2.gz BKWGMWAGESETEC-XQHKEYJVSA-N 2 0 210.365 2.282 20 0 BEADRP CCC1(C)CCC([NH2+][C@H]2CC[NH2+]C2)CC1 ZINC000414892709 386153237 /nfs/dbraw/zinc/15/32/37/386153237.db2.gz YDPFPTUHOOUCNR-CPCZMJQVSA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+]C[C@H](C)c1ccccc1 ZINC000414991469 386154561 /nfs/dbraw/zinc/15/45/61/386154561.db2.gz QEZBNIRZFQQXGO-WCQYABFASA-N 2 0 206.333 2.117 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000414992435 386155492 /nfs/dbraw/zinc/15/54/92/386155492.db2.gz ROXAHGCGLPFZDX-KXUCPTDWSA-N 2 0 238.297 2.434 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]C1CCSCC1 ZINC000335159246 386155982 /nfs/dbraw/zinc/15/59/82/386155982.db2.gz WANPDROCSPOFRT-NEPJUHHUSA-N 2 0 228.405 2.132 20 0 BEADRP [NH3+]CCCN(Cc1ccccc1F)C1CC1 ZINC000414678302 386160155 /nfs/dbraw/zinc/16/01/55/386160155.db2.gz KIKOVLZVWZPPSC-UHFFFAOYSA-N 2 0 222.307 2.139 20 0 BEADRP CC[C@H](F)CN1CC[C@@H](C[NH+](CC)CC)C1 ZINC000440801727 386162248 /nfs/dbraw/zinc/16/22/48/386162248.db2.gz RIVSTJOXFILKJI-STQMWFEESA-N 2 0 230.371 2.398 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@@H](C)Cc1ccc(F)cc1 ZINC000414993764 386165046 /nfs/dbraw/zinc/16/50/46/386165046.db2.gz UFFILWIGJPRQQJ-GWCFXTLKSA-N 2 0 224.323 2.084 20 0 BEADRP [NH3+][C@H](C[NH2+][C@H]1CCC[C@@H](C2CC2)C1)C1CC1 ZINC000414894271 386170981 /nfs/dbraw/zinc/17/09/81/386170981.db2.gz SQKBGUBKUWLBFS-HZSPNIEDSA-N 2 0 222.376 2.282 20 0 BEADRP CC[C@@H](Cc1ccccc1)[NH2+]C[C@H]([NH3+])C1CC1 ZINC000414895011 386180406 /nfs/dbraw/zinc/18/04/06/386180406.db2.gz VBJWFGSKNJLEQP-GJZGRUSLSA-N 2 0 232.371 2.335 20 0 BEADRP C[C@H](CCCC(F)(F)F)[NH2+]C[C@@H]([NH3+])C1CC1 ZINC000414895253 386183430 /nfs/dbraw/zinc/18/34/30/386183430.db2.gz WKBXEVRWQMWLJB-PSASIEDQSA-N 2 0 238.297 2.434 20 0 BEADRP C[C@@H](CC[NH3+])[NH2+]C/C=C\c1ccc(F)cc1F ZINC000414895405 386184599 /nfs/dbraw/zinc/18/45/99/386184599.db2.gz NNACRKREWIRDNY-ZMWSMAPVSA-N 2 0 240.297 2.305 20 0 BEADRP C[C@H](c1ccc(F)cc1)[N@H+](C)C[C@H]1CC[NH2+]C1 ZINC000647874407 386136174 /nfs/dbraw/zinc/13/61/74/386136174.db2.gz RZFCFJDUKODIBQ-NEPJUHHUSA-N 2 0 236.334 2.428 20 0 BEADRP c1csc([C@@H]2CCC[N@H+]2C[C@@H]2CC[NH2+]C2)c1 ZINC000647872811 386141098 /nfs/dbraw/zinc/14/10/98/386141098.db2.gz WXSJDKSHDPPKIF-NEPJUHHUSA-N 2 0 236.384 2.495 20 0 BEADRP C[C@@H](CC1CCCC1)[NH2+]C[C@@H]([NH3+])C1CC1 ZINC000414891355 386141233 /nfs/dbraw/zinc/14/12/33/386141233.db2.gz NXFMCBFDRFXBKX-GXFFZTMASA-N 2 0 210.365 2.282 20 0 BEADRP c1ccc([C@H]2CCC[N@H+]2C[C@H]2CC[NH2+]C2)cc1 ZINC000647874481 386141468 /nfs/dbraw/zinc/14/14/68/386141468.db2.gz ZSRCRDFIXHAXEU-DZGCQCFKSA-N 2 0 230.355 2.433 20 0 BEADRP C[C@H](CC[NH3+])[NH2+][C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000414891526 386141957 /nfs/dbraw/zinc/14/19/57/386141957.db2.gz ILSJYNNAPOKQIJ-OPRDCNLKSA-N 2 0 238.297 2.434 20 0 BEADRP COc1ccc([C@H](C)[N@H+](C)C[C@@H]2CC[NH2+]C2)cc1 ZINC000647874679 386144002 /nfs/dbraw/zinc/14/40/02/386144002.db2.gz MMPZRICYWGCPKN-QWHCGFSZSA-N 2 0 248.370 2.298 20 0 BEADRP CC[N@H+](CCc1ccccc1)C[C@@H]1CC[NH2+]C1 ZINC000647880973 386202870 /nfs/dbraw/zinc/20/28/70/386202870.db2.gz KJVNAPZZPRXAMN-OAHLLOKOSA-N 2 0 232.371 2.161 20 0 BEADRP CC[N@@H+](Cc1ccc(OC)cc1)C[C@@H]1CC[NH2+]C1 ZINC000647880941 386203107 /nfs/dbraw/zinc/20/31/07/386203107.db2.gz HOEADKOEFPDYMK-CQSZACIVSA-N 2 0 248.370 2.127 20 0 BEADRP Cc1cccc(C[NH2+]C[C@]2(C)CCC[NH2+]C2)c1 ZINC000414895971 386204036 /nfs/dbraw/zinc/20/40/36/386204036.db2.gz ADZREESFJDQHDB-OAHLLOKOSA-N 2 0 232.371 2.474 20 0 BEADRP Fc1ccccc1C1([NH2+]CC2CC[NH2+]CC2)CC1 ZINC000346980579 386204182 /nfs/dbraw/zinc/20/41/82/386204182.db2.gz MAXWRECTDHNBSN-UHFFFAOYSA-N 2 0 248.345 2.404 20 0 BEADRP Cc1cccc(C[NH2+]C[C@@]2(C)CCC[NH2+]C2)c1 ZINC000414895970 386204926 /nfs/dbraw/zinc/20/49/26/386204926.db2.gz ADZREESFJDQHDB-HNNXBMFYSA-N 2 0 232.371 2.474 20 0 BEADRP Cc1ccc2cc(C[NH2+][C@@H](C)CC[NH3+])ccc2n1 ZINC000414896928 386209028 /nfs/dbraw/zinc/20/90/28/386209028.db2.gz QBHNUZTXWCMJHG-NSHDSACASA-N 2 0 243.354 2.370 20 0 BEADRP CC[C@H](C)[C@@H](C)[N@H+](C[C@@H]1CC[NH2+]C1)C1CC1 ZINC000647884522 386259591 /nfs/dbraw/zinc/25/95/91/386259591.db2.gz ZECYVXSBODGPAU-YNEHKIRRSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H](c1ccccn1)[N@H+](C)C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000414702602 386210619 /nfs/dbraw/zinc/21/06/19/386210619.db2.gz ICUZAHJLTBWGLW-HZSPNIEDSA-N 2 0 247.386 2.463 20 0 BEADRP C[C@H]1C[C@H](c2ccccc2)C[N@@H+]1CCC[NH3+] ZINC000414702793 386211431 /nfs/dbraw/zinc/21/14/31/386211431.db2.gz LXCUNFJNPDJMBZ-JSGCOSHPSA-N 2 0 218.344 2.213 20 0 BEADRP CC[N@H+](C[C@@H]1CC[NH2+][C@H](C)C1)C1CCC1 ZINC000414704296 386213828 /nfs/dbraw/zinc/21/38/28/386213828.db2.gz MVBZBSBYDOSZIV-VXGBXAGGSA-N 2 0 210.365 2.249 20 0 BEADRP CCSCC[N@H+](C)[C@@H]1CCN(C)C[C@H]1C ZINC000336648797 386259770 /nfs/dbraw/zinc/25/97/70/386259770.db2.gz PPWGSARFHVPBII-VXGBXAGGSA-N 2 0 230.421 2.012 20 0 BEADRP Cc1cc(C[NH2+]CCCC[NH3+])ccc1Cl ZINC000414897730 386218361 /nfs/dbraw/zinc/21/83/61/386218361.db2.gz CKBZQPJDGFIGHW-UHFFFAOYSA-N 2 0 226.751 2.477 20 0 BEADRP C[C@H](C[NH2+]C[C@H]1CCC[NH2+]C1)c1ccccc1 ZINC000132020840 386219244 /nfs/dbraw/zinc/21/92/44/386219244.db2.gz ZBZUNAZLFPKGCF-KGLIPLIRSA-N 2 0 232.371 2.379 20 0 BEADRP C[C@@H](c1cccnc1)[N@H+](C)C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000414709933 386225505 /nfs/dbraw/zinc/22/55/05/386225505.db2.gz KPFWMLQJVYFAOH-HZSPNIEDSA-N 2 0 247.386 2.463 20 0 BEADRP [NH3+]CCC[N@H+](CCc1cccc(F)c1)C1CC1 ZINC000414710330 386228083 /nfs/dbraw/zinc/22/80/83/386228083.db2.gz RVINXQCHQCKZFO-UHFFFAOYSA-N 2 0 236.334 2.181 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000339066401 386233485 /nfs/dbraw/zinc/23/34/85/386233485.db2.gz BZKLPLKIBXGSBJ-VHDGCEQUSA-N 2 0 248.370 2.427 20 0 BEADRP CC[C@@H]1c2ccsc2CC[N@H+]1CCC[NH3+] ZINC000414693060 386194398 /nfs/dbraw/zinc/19/43/98/386194398.db2.gz BRHOZABJBBNCPC-LLVKDONJSA-N 2 0 224.373 2.406 20 0 BEADRP CCCCO[C@@H]1C[C@@H]([N@H+](C)CCC[NH3+])C1(C)C ZINC000414696036 386197332 /nfs/dbraw/zinc/19/73/32/386197332.db2.gz AULASGGQKUCTAW-CHWSQXEVSA-N 2 0 242.407 2.251 20 0 BEADRP COc1ccc2oc(C[NH2+][C@@H](C)CC[NH3+])cc2c1 ZINC000414896279 386198977 /nfs/dbraw/zinc/19/89/77/386198977.db2.gz OLWVKJWLWADSMW-JTQLQIEISA-N 2 0 248.326 2.268 20 0 BEADRP CCC[C@]1(C)CCC[N@H+](C[C@@H]2CC[NH2+]C2)C1 ZINC000647886128 386294738 /nfs/dbraw/zinc/29/47/38/386294738.db2.gz XKWLNKGAINCQJF-ZIAGYGMSSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H]1C[C@@H](c2ccccc2)C[N@@H+]1C[C@@H]1CC[NH2+]C1 ZINC000647885883 386296095 /nfs/dbraw/zinc/29/60/95/386296095.db2.gz DRFTWKROMNKOCK-IIAWOOMASA-N 2 0 244.382 2.474 20 0 BEADRP CC[N@H+](CCC[NH3+])[C@H](C)c1cccc(O)c1 ZINC000414734216 386299203 /nfs/dbraw/zinc/29/92/03/386299203.db2.gz BQAWQIYWTLXDPD-LLVKDONJSA-N 2 0 222.332 2.124 20 0 BEADRP C[C@H](CCc1cccc(F)c1)[NH2+][C@@H](C)[C@H](C)[NH3+] ZINC000415006386 386324883 /nfs/dbraw/zinc/32/48/83/386324883.db2.gz BIRQPBREOHWHCB-WOPDTQHZSA-N 2 0 238.350 2.472 20 0 BEADRP Cc1ccc(CN[C@@H](C)[C@H](C)[NH3+])cc1C ZINC000415004308 386276887 /nfs/dbraw/zinc/27/68/87/386276887.db2.gz HNNFJJRUUPGXBE-RYUDHWBXSA-N 2 0 206.333 2.129 20 0 BEADRP CC(C)C[C@@H]1CCCC[N@@H+]1C[C@H]1CC[NH2+]C1 ZINC000647888166 386341023 /nfs/dbraw/zinc/34/10/23/386341023.db2.gz VEMHKBDLASNELL-KBPBESRZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H](CCc1ccc(F)cc1)[NH2+]CCCC[NH3+] ZINC000414903829 386345215 /nfs/dbraw/zinc/34/52/15/386345215.db2.gz LUKCAKLGCWRMAC-GFCCVEGCSA-N 2 0 238.350 2.475 20 0 BEADRP CN(CC[C@@H]1CCC[N@@H+]1C)CCC(F)(F)F ZINC000336686979 386348110 /nfs/dbraw/zinc/34/81/10/386348110.db2.gz XETJMCBHKGBBEU-JTQLQIEISA-N 2 0 238.297 2.355 20 0 BEADRP Cc1ccc([C@]2(C)CC[N@H+](CCC[NH3+])C2)cc1 ZINC000414747096 386350836 /nfs/dbraw/zinc/35/08/36/386350836.db2.gz RRDCHXDIDVCQCW-OAHLLOKOSA-N 2 0 232.371 2.307 20 0 BEADRP Cc1ccnc([C@@H](C)[NH2+]CC2CC[NH+](C)CC2)c1 ZINC000353520645 386350954 /nfs/dbraw/zinc/35/09/54/386350954.db2.gz OHOCNHSOSJWPNX-CYBMUJFWSA-N 2 0 247.386 2.382 20 0 BEADRP CCC[C@@H]1[C@H](C)CCC[N@@H+]1C[C@H]1CC[NH2+]C1 ZINC000647889970 386362807 /nfs/dbraw/zinc/36/28/07/386362807.db2.gz CDCZOTCMALWEMK-HZSPNIEDSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]([NH2+]CC(C)(C)C[NH+]1CCCC1)C1CC1 ZINC000336743224 386370018 /nfs/dbraw/zinc/37/00/18/386370018.db2.gz OUWVEXLUPNHSJM-GFCCVEGCSA-N 2 0 224.392 2.497 20 0 BEADRP CCC[C@@H](C)C[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000415008134 386377164 /nfs/dbraw/zinc/37/71/64/386377164.db2.gz MMSOHFGTZMMYPH-KWCYVHTRSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H](C[NH2+]CCCC[NH3+])Cc1ccccc1 ZINC000414902562 386329067 /nfs/dbraw/zinc/32/90/67/386329067.db2.gz JZASGXNGBWDMPZ-ZDUSSCGKSA-N 2 0 220.360 2.194 20 0 BEADRP CC[C@@H](CSC)[N@H+](C)CCc1cncn1C ZINC000298394140 386334531 /nfs/dbraw/zinc/33/45/31/386334531.db2.gz LMPMKZJZBQDSOG-NSHDSACASA-N 2 0 241.404 2.036 20 0 BEADRP CC(C)[C@@H]1CC[N@H+](CC[C@H]2CCC[NH+]2C)C1 ZINC000336681588 386337353 /nfs/dbraw/zinc/33/73/53/386337353.db2.gz QWSHAMKSXMCEKQ-ZIAGYGMSSA-N 2 0 224.392 2.449 20 0 BEADRP COC1CC([NH2+]CC[C@@H](C)[NH+]2CCCCC2)C1 ZINC000347483318 386438508 /nfs/dbraw/zinc/43/85/08/386438508.db2.gz MKFUMMTTWVQJJC-IYXRBSQSSA-N 2 0 240.391 2.018 20 0 BEADRP COc1ccc([C@@H](C)C[N@H+](C)C2CC([NH3+])C2)cc1 ZINC000414769386 386445563 /nfs/dbraw/zinc/44/55/63/386445563.db2.gz KBBLNRCSVFDBBN-XGNXJENSSA-N 2 0 248.370 2.220 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+][C@@H]1CCCSC1 ZINC000157119793 386449696 /nfs/dbraw/zinc/44/96/96/386449696.db2.gz RVVIQCLXNZALAC-FDYHWXHSSA-N 2 0 242.432 2.200 20 0 BEADRP [NH3+]CCCC[NH2+]C/C=C/c1ccc(F)cc1 ZINC000414907735 386392976 /nfs/dbraw/zinc/39/29/76/386392976.db2.gz PVORVBUZAYUYDX-ONEGZZNKSA-N 2 0 222.307 2.167 20 0 BEADRP CC(C)[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H]([NH3+])C2)CCO1 ZINC000414907739 386393949 /nfs/dbraw/zinc/39/39/49/386393949.db2.gz AVSPSVOQQYNIHL-DGAVXFQQSA-N 2 0 240.391 2.050 20 0 BEADRP CC(C)[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H]([NH3+])C2)CCO1 ZINC000414907747 386394214 /nfs/dbraw/zinc/39/42/14/386394214.db2.gz AVSPSVOQQYNIHL-SYQHCUMBSA-N 2 0 240.391 2.050 20 0 BEADRP Cc1ccsc1C[NH2+][C@@H](C)CCC[NH3+] ZINC000308481136 386396306 /nfs/dbraw/zinc/39/63/06/386396306.db2.gz GXZLMKKEWAOYFM-JTQLQIEISA-N 2 0 212.362 2.274 20 0 BEADRP COc1cc(C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)ccc1C ZINC000414908489 386398632 /nfs/dbraw/zinc/39/86/32/386398632.db2.gz BKXOZDUKMBFKHT-ZIAGYGMSSA-N 2 0 248.370 2.363 20 0 BEADRP C[C@@H]1OCC[C@H]1[NH2+]CCCCC[NH+]1CCCC1 ZINC000339500240 386451534 /nfs/dbraw/zinc/45/15/34/386451534.db2.gz YQNKGYBNQLSDMG-UONOGXRCSA-N 2 0 240.391 2.020 20 0 BEADRP c1cncc(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)c1 ZINC000093451343 386413159 /nfs/dbraw/zinc/41/31/59/386413159.db2.gz UXJSDQVKUJMCPM-SOUVJXGZSA-N 2 0 245.370 2.092 20 0 BEADRP C[C@H](C[C@H]1CCCCC[NH2+]1)[NH2+][C@@H]1CCCOC1 ZINC000093516497 386420165 /nfs/dbraw/zinc/42/01/65/386420165.db2.gz LVQWYOFXJINCOT-MGPQQGTHSA-N 2 0 240.391 2.066 20 0 BEADRP CO[C@H](C)C[N@H+](CC[C@H]1CCC[NH+]1C)C(C)C ZINC000336714279 386432773 /nfs/dbraw/zinc/43/27/73/386432773.db2.gz QPHPUVCEJWYRBA-ZIAGYGMSSA-N 2 0 242.407 2.216 20 0 BEADRP CC[C@@H]1C[C@H](C)C[N@@H+]1C[C@H]1CC[NH2+][C@@H](C)C1 ZINC000399173390 386434259 /nfs/dbraw/zinc/43/42/59/386434259.db2.gz PBOMNUQGPBJWFZ-XDQVBPFNSA-N 2 0 224.392 2.495 20 0 BEADRP CC(C)(C)[C@H]1CC[C@@H]1[NH2+]C1CC[NH2+]CC1 ZINC000335453497 386528489 /nfs/dbraw/zinc/52/84/89/386528489.db2.gz WCBVSGQJGSXFMG-RYUDHWBXSA-N 2 0 210.365 2.153 20 0 BEADRP Cc1ccoc1CNC[C@H]1CC[N@@H+](C2CC2)C1 ZINC000135146919 386480696 /nfs/dbraw/zinc/48/06/96/386480696.db2.gz ILQYKLUUNYEBHA-GFCCVEGCSA-N 2 0 234.343 2.162 20 0 BEADRP CC[NH2+][C@H](C)CN[C@H](C)CCc1ccco1 ZINC000519538657 386480823 /nfs/dbraw/zinc/48/08/23/386480823.db2.gz JOIIMDOFWHTIOX-VXGBXAGGSA-N 2 0 224.348 2.188 20 0 BEADRP CCCC[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000340635203 386487572 /nfs/dbraw/zinc/48/75/72/386487572.db2.gz CALPGRGIMLTFTF-UHFFFAOYSA-N 2 0 212.381 2.450 20 0 BEADRP C[C@H](CCc1ccsc1)[NH2+][C@H](C)[C@H](C)[NH3+] ZINC000415013201 386495979 /nfs/dbraw/zinc/49/59/79/386495979.db2.gz KNZHREREWXJIOY-OUAUKWLOSA-N 2 0 226.389 2.395 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]Cc1ccc2c[nH]nc2c1 ZINC000415014808 386500021 /nfs/dbraw/zinc/50/00/21/386500021.db2.gz MWZVLNXLIKRLAV-NSHDSACASA-N 2 0 246.358 2.170 20 0 BEADRP C[C@H](Cc1ccccc1)C[N@@H+]1CC[C@H]([NH3+])[C@@H]1C ZINC000414781381 386500931 /nfs/dbraw/zinc/50/09/31/386500931.db2.gz HQSKBVINJQZWQC-IPYPFGDCSA-N 2 0 232.371 2.287 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]C/C=C/c1ccccc1 ZINC000415017808 386502296 /nfs/dbraw/zinc/50/22/96/386502296.db2.gz GDJGLBCOFWDJOH-BCRSCGJKSA-N 2 0 218.344 2.417 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@H](C)CC1CCOCC1 ZINC000415018554 386502409 /nfs/dbraw/zinc/50/24/09/386502409.db2.gz UKNFIUAHUALNRO-CHWSQXEVSA-N 2 0 242.407 2.299 20 0 BEADRP CCCc1cccc(CN[C@@H](C)[C@H](C)[NH3+])c1 ZINC000415016652 386503752 /nfs/dbraw/zinc/50/37/52/386503752.db2.gz OISHPWUDBVHMRP-RYUDHWBXSA-N 2 0 220.360 2.464 20 0 BEADRP C[C@H]([NH3+])[C@H](C)[NH2+][C@@H]1Cc2ccc(Cl)cc2C1 ZINC000415019165 386505854 /nfs/dbraw/zinc/50/58/54/386505854.db2.gz RPIWFSXSZPDEMU-MWODSPESSA-N 2 0 238.762 2.133 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C[C@@H]2CC23CC3)[C@H]2CCC[C@@H]21 ZINC000417339911 386506078 /nfs/dbraw/zinc/50/60/78/386506078.db2.gz OWXNMWJZTPESMD-CRWXNKLISA-N 2 0 234.387 2.249 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C[C@@H]2CC23CC3)[C@@H]2CCC[C@@H]21 ZINC000417339916 386507510 /nfs/dbraw/zinc/50/75/10/386507510.db2.gz OWXNMWJZTPESMD-XUXIUFHCSA-N 2 0 234.387 2.249 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C[C@@H]2CC23CC3)[C@@H]2CCC[C@H]21 ZINC000417339913 386507665 /nfs/dbraw/zinc/50/76/65/386507665.db2.gz OWXNMWJZTPESMD-XDQVBPFNSA-N 2 0 234.387 2.249 20 0 BEADRP Cc1cc(C[NH2+][C@H](C)CCC[NH3+])ccc1F ZINC000415021170 386512345 /nfs/dbraw/zinc/51/23/45/386512345.db2.gz KBAJJOSHJURFAQ-LLVKDONJSA-N 2 0 224.323 2.351 20 0 BEADRP C[C@H]1CCCC[C@@H]1C[N@@H+]1CCC[C@H]2C[NH2+]C[C@H]21 ZINC000414785773 386513270 /nfs/dbraw/zinc/51/32/70/386513270.db2.gz TWXGJKOMDVDABX-BYNSBNAKSA-N 2 0 236.403 2.497 20 0 BEADRP COCC(C)(C)C[NH2+]C[C@H]1CC[C@H](C[NH3+])CC1 ZINC000415026199 386514095 /nfs/dbraw/zinc/51/40/95/386514095.db2.gz SEYXUQZKLTYWHL-JOCQHMNTSA-N 2 0 242.407 2.014 20 0 BEADRP C[N@H+](CC[C@@H]1CCC[NH2+]C1)CC1CCC1 ZINC000061458132 386514489 /nfs/dbraw/zinc/51/44/89/386514489.db2.gz QMUYLBWURVXLMG-LBPRGKRZSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@@H]([NH3+])[C@@H](C)[NH2+][C@H](C)CCc1ccc(F)cc1 ZINC000415024975 386514952 /nfs/dbraw/zinc/51/49/52/386514952.db2.gz ZIPKAHIUPWQLQX-IJLUTSLNSA-N 2 0 238.350 2.472 20 0 BEADRP CC(C)c1ncc(C[NH2+][C@H](C)CCC[NH3+])s1 ZINC000415027398 386516096 /nfs/dbraw/zinc/51/60/96/386516096.db2.gz WPBNHNKARXFXKA-SNVBAGLBSA-N 2 0 241.404 2.484 20 0 BEADRP COCc1cccc(C[NH2+][C@@H]2CC[C@H](C[NH3+])C2)c1 ZINC000415029190 386516341 /nfs/dbraw/zinc/51/63/41/386516341.db2.gz DNEQTNBYIJWJNI-SWLSCSKDSA-N 2 0 248.370 2.050 20 0 BEADRP CCCOc1ccc(C[NH2+]C2CC[NH2+]CC2)cc1 ZINC000414784902 386516982 /nfs/dbraw/zinc/51/69/82/386516982.db2.gz IEEWCEBOKLJLOA-UHFFFAOYSA-N 2 0 248.370 2.317 20 0 BEADRP CCCC1CCC([NH2+][C@@H]2[C@H]3C[NH2+]C[C@H]32)CC1 ZINC000415031235 386519168 /nfs/dbraw/zinc/51/91/68/386519168.db2.gz FZZPBYSFWGTQJX-TWASESMYSA-N 2 0 222.376 2.153 20 0 BEADRP [NH3+]C[C@@H]1CC[C@H]([NH2+]C/C=C\c2ccccc2)C1 ZINC000415032343 386520027 /nfs/dbraw/zinc/52/00/27/386520027.db2.gz IAJWTYTUFAKXBJ-JBLNNTITSA-N 2 0 230.355 2.417 20 0 BEADRP C[C@H](CCC1CC1)[NH2+][C@H]1CC[C@H](C[NH3+])C1 ZINC000415033153 386520967 /nfs/dbraw/zinc/52/09/67/386520967.db2.gz IQJPQBOMVXDZLZ-WXHSDQCUSA-N 2 0 210.365 2.282 20 0 BEADRP CCCC1CCC(C[NH2+][C@@H]2[C@H]3C[NH2+]C[C@H]32)CC1 ZINC000415035852 386520971 /nfs/dbraw/zinc/52/09/71/386520971.db2.gz LEPILHCNHWTWQL-QSCRHYGLSA-N 2 0 236.403 2.400 20 0 BEADRP CC(C)CC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000415034977 386522113 /nfs/dbraw/zinc/52/21/13/386522113.db2.gz KHIBRRHXGCQOQF-SBJFKYEJSA-N 2 0 236.403 2.399 20 0 BEADRP CCC[C@@H](C)C[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000414915585 386523588 /nfs/dbraw/zinc/52/35/88/386523588.db2.gz ZRXWQASBQSIQJY-OLZOCXBDSA-N 2 0 212.381 2.402 20 0 BEADRP CCC(CC)(CC)C[NH2+]C[C@H]1C[NH2+]CCCO1 ZINC000415036981 386524726 /nfs/dbraw/zinc/52/47/26/386524726.db2.gz KUIOHLNXGSDVSR-CYBMUJFWSA-N 2 0 242.407 2.171 20 0 BEADRP Cc1cccc(CC[C@H](C)[NH2+][C@@H]2[C@H]3C[NH2+]C[C@H]32)c1 ZINC000415036334 386524757 /nfs/dbraw/zinc/52/47/57/386524757.db2.gz LRLATOFMROHFHI-ARLBYUKCSA-N 2 0 244.382 2.124 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CC[C@@H](C[NH3+])C2)cc1 ZINC000415036892 386525241 /nfs/dbraw/zinc/52/52/41/386525241.db2.gz LTDQMFHXCRGVQG-KGLIPLIRSA-N 2 0 218.344 2.212 20 0 BEADRP CCOc1cccc(C[NH2+][C@H]2CC[C@H](C[NH3+])C2)c1 ZINC000415039873 386525939 /nfs/dbraw/zinc/52/59/39/386525939.db2.gz OMDFRQXKJLKIMT-JSGCOSHPSA-N 2 0 248.370 2.302 20 0 BEADRP C[C@@H](CCc1ccsc1)[NH2+]C1CC[NH2+]CC1 ZINC000414787614 386526597 /nfs/dbraw/zinc/52/65/97/386526597.db2.gz ZLYKWQXIULDGGK-NSHDSACASA-N 2 0 238.400 2.411 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@H]1CCc2ccccc2C1 ZINC000414786472 386526918 /nfs/dbraw/zinc/52/69/18/386526918.db2.gz BHBPFGFGMCGDCL-LSDHHAIUSA-N 2 0 232.371 2.117 20 0 BEADRP CCOc1cccc(C[NH2+][C@@H]2CC[C@H](C[NH3+])C2)c1 ZINC000415039872 386527039 /nfs/dbraw/zinc/52/70/39/386527039.db2.gz OMDFRQXKJLKIMT-GXTWGEPZSA-N 2 0 248.370 2.302 20 0 BEADRP C[C@@H](C[NH2+][C@H]1CCc2ccccc2C1)C[NH+](C)C ZINC000291709192 386453781 /nfs/dbraw/zinc/45/37/81/386453781.db2.gz LBHIQBFSBLKSBP-BBRMVZONSA-N 2 0 246.398 2.331 20 0 BEADRP CSC1(C[NH+]2CCC(C[NH+](C)C)CC2)CC1 ZINC000347576322 386455384 /nfs/dbraw/zinc/45/53/84/386455384.db2.gz AWIIGYIYWZBDEL-UHFFFAOYSA-N 2 0 242.432 2.156 20 0 BEADRP CCc1ccc(C[N@@H+]2CC[C@H]([NH3+])[C@H](C)C2)cc1 ZINC000094339165 386457850 /nfs/dbraw/zinc/45/78/50/386457850.db2.gz UHSCNENIZQZPMG-DOMZBBRYSA-N 2 0 232.371 2.418 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]CC[C@H]2CCC[NH2+]2)C1 ZINC000414911622 386458410 /nfs/dbraw/zinc/45/84/10/386458410.db2.gz WYLWEBQTRLVCAW-UPJWGTAASA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H](C[N@@H+]1CC[C@H]([NH3+])[C@H](C)C1)c1ccccc1 ZINC000094339087 386458390 /nfs/dbraw/zinc/45/83/90/386458390.db2.gz NLMVPNGWBMQFEC-NFAWXSAZSA-N 2 0 232.371 2.459 20 0 BEADRP C[C@H]1C[C@H](C[NH2+]CCc2cccs2)CC[NH2+]1 ZINC000415079996 386582478 /nfs/dbraw/zinc/58/24/78/386582478.db2.gz IZBBLDOJDQHLSG-NWDGAFQWSA-N 2 0 238.400 2.268 20 0 BEADRP CCSCC[NH2+]CC1(C[NH+](C)C)CCCC1 ZINC000336781230 386585961 /nfs/dbraw/zinc/58/59/61/386585961.db2.gz UCTWGRANQVGUTA-UHFFFAOYSA-N 2 0 244.448 2.451 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC000414800632 386587621 /nfs/dbraw/zinc/58/76/21/386587621.db2.gz SIVZXORJFUHQCG-SOUVJXGZSA-N 2 0 232.371 2.363 20 0 BEADRP C[C@H](CCc1ccsc1)[NH2+][C@@H](CN)C1CC1 ZINC000414803036 386595435 /nfs/dbraw/zinc/59/54/35/386595435.db2.gz IYSOZUZHGRPCHC-MFKMUULPSA-N 2 0 238.400 2.396 20 0 BEADRP CCOc1cccc(CNC[C@@H]([NH3+])C(C)C)c1 ZINC000414802773 386596208 /nfs/dbraw/zinc/59/62/08/386596208.db2.gz VXCQERBGFIMXEQ-CQSZACIVSA-N 2 0 236.359 2.158 20 0 BEADRP CC[C@@H](Cc1ccc(C)cc1)[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000415046464 386531327 /nfs/dbraw/zinc/53/13/27/386531327.db2.gz XIDVXNZYCLDWSW-CAOSSQGBSA-N 2 0 244.382 2.124 20 0 BEADRP CC[C@@H]1C[C@@H](C[NH2+][C@@H](CN)C(C)(C)C)CCO1 ZINC000415056045 386538127 /nfs/dbraw/zinc/53/81/27/386538127.db2.gz PDXNFQBDIMHKJM-XQQFMLRXSA-N 2 0 242.407 2.155 20 0 BEADRP CC[C@@]1(C)CC[N@H+](CC[C@H]2CCC[NH2+]C2)C1 ZINC000399386457 386538800 /nfs/dbraw/zinc/53/88/00/386538800.db2.gz RIUVNBMEEYTJOP-KGLIPLIRSA-N 2 0 224.392 2.498 20 0 BEADRP CC(C)(C)[C@H](C[NH3+])NCc1cccc(F)c1F ZINC000415059710 386541130 /nfs/dbraw/zinc/54/11/30/386541130.db2.gz VMSUJGXLYVZUGF-NSHDSACASA-N 2 0 242.313 2.428 20 0 BEADRP C[NH2+]CCC[NH2+]C1(c2ccccc2C)CC1 ZINC000647995304 386545734 /nfs/dbraw/zinc/54/57/34/386545734.db2.gz MZFUISQRLXFIPZ-UHFFFAOYSA-N 2 0 218.344 2.183 20 0 BEADRP C[C@H]([NH3+])C[N@@H+]1CC[C@@H]([C@H]2CCCC2(C)C)C1 ZINC000647995268 386547005 /nfs/dbraw/zinc/54/70/05/386547005.db2.gz KBDZTNJYZDNYPV-YNEHKIRRSA-N 2 0 224.392 2.482 20 0 BEADRP Fc1ccc(/C=C/C[NH2+]C2CC[NH2+]CC2)cc1 ZINC000414791885 386548687 /nfs/dbraw/zinc/54/86/87/386548687.db2.gz RGGAGXAMZSBUBM-OWOJBTEDSA-N 2 0 234.318 2.181 20 0 BEADRP CC[C@H]1CCC[C@H](C[NH2+][C@@H]2[C@H]3C[NH2+]C[C@H]32)C1 ZINC000415065741 386549243 /nfs/dbraw/zinc/54/92/43/386549243.db2.gz SDVKEIAZTVTFIK-QSLWVIQJSA-N 2 0 222.376 2.010 20 0 BEADRP CC1(C)CC[C@@H]([NH2+][C@@H]2CCCC[NH2+]C2)C1 ZINC000415066489 386549511 /nfs/dbraw/zinc/54/95/11/386549511.db2.gz IWRHKTRGNOUUGB-VXGBXAGGSA-N 2 0 210.365 2.297 20 0 BEADRP FC(F)(F)C[C@H]1CC[N@H+](CCn2ccnc2)C1 ZINC000278567195 386549766 /nfs/dbraw/zinc/54/97/66/386549766.db2.gz BVUAMGRRFQZUCW-SNVBAGLBSA-N 2 0 247.264 2.157 20 0 BEADRP CC(C)C[C@@H](C)C[C@H](C)[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000415069682 386552244 /nfs/dbraw/zinc/55/22/44/386552244.db2.gz XLPXBTNZQBOPPA-BJJPWKGXSA-N 2 0 224.392 2.255 20 0 BEADRP C[C@H](CCC1CC1)[NH2+][C@@H]1CCCC[NH2+]C1 ZINC000415070316 386552632 /nfs/dbraw/zinc/55/26/32/386552632.db2.gz IFEDAHNWTXPLKG-DGCLKSJQSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+][C@@H]2CCCC[NH2+]C2)C1 ZINC000415071005 386554904 /nfs/dbraw/zinc/55/49/04/386554904.db2.gz RZPNTTPNBWRBBY-JHJVBQTASA-N 2 0 210.365 2.297 20 0 BEADRP CC(C)[N@@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000647974877 386555339 /nfs/dbraw/zinc/55/53/39/386555339.db2.gz AEWLAVCMRPSYAD-OLZOCXBDSA-N 2 0 210.365 2.106 20 0 BEADRP CCC[N@@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000647974962 386555604 /nfs/dbraw/zinc/55/56/04/386555604.db2.gz DQEKWVANEYFEFO-CHWSQXEVSA-N 2 0 210.365 2.108 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+][C@@H](C)Cc1ccccc1F ZINC000414794390 386559612 /nfs/dbraw/zinc/55/96/12/386559612.db2.gz LZRNTEZWSYELGY-FZMZJTMJSA-N 2 0 238.350 2.330 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000414919808 386563964 /nfs/dbraw/zinc/56/39/64/386563964.db2.gz XUAAOESODCJXIV-WCQYABFASA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H](CCC(F)(F)F)[NH2+]CC(C)(C)[NH3+] ZINC000414796010 386564185 /nfs/dbraw/zinc/56/41/85/386564185.db2.gz BJNNXLHQDCSLDA-ZETCQYMHSA-N 2 0 212.259 2.044 20 0 BEADRP CC(C)([NH3+])C[NH2+][C@H]1CCCC[C@@H]1C1CC1 ZINC000414796785 386568486 /nfs/dbraw/zinc/56/84/86/386568486.db2.gz CIPSBXBYLFYYJD-NEPJUHHUSA-N 2 0 210.365 2.282 20 0 BEADRP c1ccc2c(c1)CC[C@H]([NH2+][C@@H]1CCCC[NH2+]C1)C2 ZINC000415075694 386569711 /nfs/dbraw/zinc/56/97/11/386569711.db2.gz RDOCLETWJVADEG-JKSUJKDBSA-N 2 0 244.382 2.276 20 0 BEADRP CC(C)C1CC([NH2+][C@@H]2CCCC[NH2+]C2)C1 ZINC000335496227 386619392 /nfs/dbraw/zinc/61/93/92/386619392.db2.gz OLUMWCIFDKRKNO-OTTFEQOBSA-N 2 0 210.365 2.153 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCCC[C@@H]1C1CCC1 ZINC000647997632 386619509 /nfs/dbraw/zinc/61/95/09/386619509.db2.gz UMUFGRWKVZQIHT-CYBMUJFWSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@@H](CCc1ccccc1F)[NH2+]CC(C)(C)[NH3+] ZINC000414809637 386620847 /nfs/dbraw/zinc/62/08/47/386620847.db2.gz VVYUZBVRAUWJEO-NSHDSACASA-N 2 0 238.350 2.474 20 0 BEADRP C[C@H](C[C@@H]1CCC[NH2+]1)[NH2+][C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000415111121 386621249 /nfs/dbraw/zinc/62/12/49/386621249.db2.gz OHQWBDTXVXHCGJ-PEBLQZBPSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@H](C[C@H]1CCC[NH2+]1)[NH2+][C@H]1CCC[C@@H]2C[C@@H]21 ZINC000415111122 386621392 /nfs/dbraw/zinc/62/13/92/386621392.db2.gz OHQWBDTXVXHCGJ-POQQGIQPSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@@H](C[NH2+]CC(C)(C)[NH3+])Cc1ccccc1 ZINC000414809599 386622219 /nfs/dbraw/zinc/62/22/19/386622219.db2.gz VSHBQPCETXJMLS-GFCCVEGCSA-N 2 0 220.360 2.192 20 0 BEADRP CSc1ccc(CN[C@H](C[NH3+])C2CC2)cc1 ZINC000414808287 386622331 /nfs/dbraw/zinc/62/23/31/386622331.db2.gz SCMRLXBHEQASGO-CYBMUJFWSA-N 2 0 236.384 2.235 20 0 BEADRP C[C@@H]1C[C@@H](C[NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)CC[NH2+]1 ZINC000415104429 386623609 /nfs/dbraw/zinc/62/36/09/386623609.db2.gz DYSUCLXRVQNRSW-XHJNMGKDSA-N 2 0 222.376 2.153 20 0 BEADRP Cc1ccccc1C1(C[NH2+]CC(C)(C)[NH3+])CC1 ZINC000415100760 386623702 /nfs/dbraw/zinc/62/37/02/386623702.db2.gz HYKFNEXQGGVEJO-UHFFFAOYSA-N 2 0 232.371 2.354 20 0 BEADRP C[C@@H]1C[C@H](C[NH2+][C@@]2(C)CC=CCC2)CC[NH2+]1 ZINC000415103045 386624437 /nfs/dbraw/zinc/62/44/37/386624437.db2.gz BVFPMLPXDLSXAA-MCIONIFRSA-N 2 0 222.376 2.463 20 0 BEADRP CC(C)C[C@@H]([NH3+])C[NH2+][C@@]1(C)CC=CCC1 ZINC000415105864 386628619 /nfs/dbraw/zinc/62/86/19/386628619.db2.gz GRIURAGCTPKKIZ-OLZOCXBDSA-N 2 0 210.365 2.448 20 0 BEADRP C[C@@H]1C[C@H]1C[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000336782348 386635067 /nfs/dbraw/zinc/63/50/67/386635067.db2.gz XIPKFPWUVBHEFK-YPMHNXCESA-N 2 0 222.376 2.106 20 0 BEADRP COc1cccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)c1 ZINC000414811604 386637046 /nfs/dbraw/zinc/63/70/46/386637046.db2.gz JRZBHHJIZNCPTI-PBWFPOADSA-N 2 0 246.354 2.068 20 0 BEADRP C[C@@]1(C[NH2+]Cc2cccs2)CCC[NH2+]C1 ZINC000062862190 386639433 /nfs/dbraw/zinc/63/94/33/386639433.db2.gz QJKZGYXYMQDYBE-GFCCVEGCSA-N 2 0 224.373 2.227 20 0 BEADRP C[C@@H](C[NH2+][C@H]1CCC12CCC2)C[NH+](C)C ZINC000336758916 386642718 /nfs/dbraw/zinc/64/27/18/386642718.db2.gz KXQGXZKTUSBWMS-RYUDHWBXSA-N 2 0 210.365 2.106 20 0 BEADRP CCOC[C@@H](C)[NH2+]Cc1ccc([C@H](C)[NH3+])cc1 ZINC000414813140 386643359 /nfs/dbraw/zinc/64/33/59/386643359.db2.gz SLCCZAAYZUHQKH-NEPJUHHUSA-N 2 0 236.359 2.221 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]C[C@H]2CC23CC3)[C@@H](C)C1 ZINC000417372118 386643630 /nfs/dbraw/zinc/64/36/30/386643630.db2.gz WNMBSRCMFOYHCV-XQQFMLRXSA-N 2 0 222.376 2.106 20 0 BEADRP C([NH2+][C@H]1CCC12CCCC2)[C@H]1CCC[NH2+]C1 ZINC000335519373 386656159 /nfs/dbraw/zinc/65/61/59/386656159.db2.gz ORFCYKRNHMUYAR-STQMWFEESA-N 2 0 222.376 2.298 20 0 BEADRP C[C@H]([NH3+])c1ccc(C[NH2+]C[C@H]2C[C@@H]2C)cc1 ZINC000414814596 386646432 /nfs/dbraw/zinc/64/64/32/386646432.db2.gz OFCKIABUGURSOF-COPLHBTASA-N 2 0 218.344 2.452 20 0 BEADRP C[C@@H]([NH3+])c1ccc(C[NH2+]CC[C@@H]2CCOC2)cc1 ZINC000414815384 386648852 /nfs/dbraw/zinc/64/88/52/386648852.db2.gz PGJVJSNQMLQWHP-TZMCWYRMSA-N 2 0 248.370 2.223 20 0 BEADRP Cc1occc1C[NH2+]CC[C@H]1CCC[N@@H+](C)C1 ZINC000414461914 386601225 /nfs/dbraw/zinc/60/12/25/386601225.db2.gz LMVKSTQHPRQJOA-CYBMUJFWSA-N 2 0 236.359 2.410 20 0 BEADRP C[C@@H](CCc1cccc(F)c1)[NH2+]CC(C)(C)[NH3+] ZINC000414801677 386601677 /nfs/dbraw/zinc/60/16/77/386601677.db2.gz JOOPGVWXRCQDMN-NSHDSACASA-N 2 0 238.350 2.474 20 0 BEADRP Cc1ccccc1C[NH2+]C[C@@]1(C)CC[NH2+]C1 ZINC000415091824 386610450 /nfs/dbraw/zinc/61/04/50/386610450.db2.gz RDYLAOXKPMMOTR-AWEZNQCLSA-N 2 0 218.344 2.084 20 0 BEADRP C[NH+](C)C1CCC([NH2+][C@H]2COC(C)(C)C2)CC1 ZINC000335491994 386610522 /nfs/dbraw/zinc/61/05/22/386610522.db2.gz RAIBSARBFMLWIM-OTTFEQOBSA-N 2 0 240.391 2.016 20 0 BEADRP [NH3+]C[C@@H](NC/C=C\c1ccc(F)cc1)C1CC1 ZINC000414807922 386612101 /nfs/dbraw/zinc/61/21/01/386612101.db2.gz RTSPXHBBRLXOIZ-DDGIKZQJSA-N 2 0 234.318 2.166 20 0 BEADRP C[C@]1(C[NH2+]CC2CCCCC2)CC[NH2+]C1 ZINC000415098528 386616554 /nfs/dbraw/zinc/61/65/54/386616554.db2.gz FMFLZNMIVYORQE-ZDUSSCGKSA-N 2 0 210.365 2.156 20 0 BEADRP CC(C)([NH3+])C[NH2+][C@H]1C[C@H]1C1CCCCC1 ZINC000415108050 386617827 /nfs/dbraw/zinc/61/78/27/386617827.db2.gz ONZJMJUVTPYVLH-RYUDHWBXSA-N 2 0 210.365 2.282 20 0 BEADRP NC[C@H]([NH2+][C@@H]1CCC[C@@H](C2CC2)C1)C1CC1 ZINC000414807421 386618048 /nfs/dbraw/zinc/61/80/48/386618048.db2.gz QYXBSALLLMEMSR-MCIONIFRSA-N 2 0 222.376 2.282 20 0 BEADRP C[NH+]1CCC([C@@H]2CC[N@H+](CC3CC3)C2)CC1 ZINC000335521431 386662096 /nfs/dbraw/zinc/66/20/96/386662096.db2.gz UGCZIIXUOGYNPQ-CQSZACIVSA-N 2 0 222.376 2.060 20 0 BEADRP C[C@H](CC1CC1)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000414822088 386671462 /nfs/dbraw/zinc/67/14/62/386671462.db2.gz BYNLQTWKNLTODK-MDFVCYEDSA-N 2 0 208.349 2.048 20 0 BEADRP C[C@@H]([NH2+]CCC(C)(C)C)[C@H]1CCC[NH2+]C1 ZINC000414824023 386680218 /nfs/dbraw/zinc/68/02/18/386680218.db2.gz PWWKNZCHHMMNDI-NEPJUHHUSA-N 2 0 212.381 2.400 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]C[C@H](C)c1ccccc1 ZINC000414830788 386709100 /nfs/dbraw/zinc/70/91/00/386709100.db2.gz CKNKZECGQBOBLQ-OLZOCXBDSA-N 2 0 220.360 2.235 20 0 BEADRP C(=C/c1ccccc1)\C[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000414825505 386690994 /nfs/dbraw/zinc/69/09/94/386690994.db2.gz CJPMFIXXHPKSQQ-NFBGWVBBSA-N 2 0 230.355 2.289 20 0 BEADRP C[C@@H]1CCC[C@@H](C[NH2+]CC[C@H]2CC[NH2+]C2)C1 ZINC000414827592 386692926 /nfs/dbraw/zinc/69/29/26/386692926.db2.gz HJPQBBDRQOITIM-MGPQQGTHSA-N 2 0 224.392 2.402 20 0 BEADRP Cc1cccc(C[NH2+]C[C@H]2CCC[NH2+]C2)c1C ZINC000414827909 386697368 /nfs/dbraw/zinc/69/73/68/386697368.db2.gz KZHGSUIDAAOYQW-AWEZNQCLSA-N 2 0 232.371 2.393 20 0 BEADRP Fc1ccc(/C=C/C[NH2+]CC[C@@H]2CC[NH2+]C2)cc1 ZINC000414828947 386700927 /nfs/dbraw/zinc/70/09/27/386700927.db2.gz JYUDVCCPKQKLAK-VSZDKKFSSA-N 2 0 248.345 2.428 20 0 BEADRP CCC[C@H]([NH2+]C1CC[NH2+]CC1)C1CCC1 ZINC000324969436 386707325 /nfs/dbraw/zinc/70/73/25/386707325.db2.gz ZTDUWDYIFABEKO-ZDUSSCGKSA-N 2 0 210.365 2.297 20 0 BEADRP Cc1cc(NCC[N@@H+](C)C2CCCCC2)cc[nH+]1 ZINC000357186398 386734631 /nfs/dbraw/zinc/73/46/31/386734631.db2.gz JGJXRLNOTFUIEU-UHFFFAOYSA-N 2 0 247.386 2.488 20 0 BEADRP C[C@H]1CCCC[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000414838726 386739555 /nfs/dbraw/zinc/73/95/55/386739555.db2.gz XGOJVADCHMWIPU-BEUHCMRWSA-N 2 0 222.376 2.438 20 0 BEADRP C[C@H](Cc1ccccc1)C[N@@H+]1C[C@@H](C)[C@H]([NH3+])C1 ZINC000340693023 386714245 /nfs/dbraw/zinc/71/42/45/386714245.db2.gz WXKOYBGDRLIFOZ-UMVBOHGHSA-N 2 0 232.371 2.144 20 0 BEADRP CC[C@H](C[N@H+]1C[C@H]([NH3+])[C@@H](C)C1)c1ccccc1 ZINC000340692941 386714862 /nfs/dbraw/zinc/71/48/62/386714862.db2.gz WNSMXQITFCZKTH-GUTXKFCHSA-N 2 0 232.371 2.459 20 0 BEADRP CC(C)[C@H]1CCC[C@H]1[NH2+]C1CC[NH2+]CC1 ZINC000335484925 386715088 /nfs/dbraw/zinc/71/50/88/386715088.db2.gz XKJHVEIRZDOSIG-CHWSQXEVSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@]1(C[NH2+][C@H]2CCC23CCC3)CCC[NH2+]C1 ZINC000335486507 386717238 /nfs/dbraw/zinc/71/72/38/386717238.db2.gz HEMROZIZAVYCEE-QWHCGFSZSA-N 2 0 222.376 2.298 20 0 BEADRP C[C@H]1CC([NH2+]CC[C@@H]2CC[NH2+]C2)C[C@H](C)C1 ZINC000414832264 386718436 /nfs/dbraw/zinc/71/84/36/386718436.db2.gz OGUIDLYWPUWSJZ-UPJWGTAASA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000414832761 386720534 /nfs/dbraw/zinc/72/05/34/386720534.db2.gz OTIJDGQGIBDUSX-MGPQQGTHSA-N 2 0 224.392 2.402 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CC[C@H](C)[C@@H](C)C1 ZINC000414834132 386720857 /nfs/dbraw/zinc/72/08/57/386720857.db2.gz GYEDKRQJUXPWEQ-ZDEQEGDKSA-N 2 0 212.381 2.256 20 0 BEADRP CC(C)CCC1CC[NH+](CCOCC[NH3+])CC1 ZINC000357108818 386721024 /nfs/dbraw/zinc/72/10/24/386721024.db2.gz VHOBUHAHCRDOBX-UHFFFAOYSA-N 2 0 242.407 2.110 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CC[C@@H](C)[C@@H](C)C1 ZINC000414834126 386721141 /nfs/dbraw/zinc/72/11/41/386721141.db2.gz GYEDKRQJUXPWEQ-QNWHQSFQSA-N 2 0 212.381 2.256 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H]1CCCC[C@H]1C1CC1 ZINC000414834870 386725565 /nfs/dbraw/zinc/72/55/65/386725565.db2.gz HZKGPGVNBXCIHG-UBHSHLNASA-N 2 0 224.392 2.400 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CCC[C@@H](C2CC2)C1 ZINC000414835809 386727435 /nfs/dbraw/zinc/72/74/35/386727435.db2.gz IPFZYKJKWBYZAF-IACUBPJLSA-N 2 0 224.392 2.400 20 0 BEADRP C(=C/c1ccccc1)\C[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000414836252 386728654 /nfs/dbraw/zinc/72/86/54/386728654.db2.gz URFSZMHTHFXMGO-SGJXGLNRSA-N 2 0 230.355 2.289 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]Cc1cc(C)cc(C)c1 ZINC000414835260 386728814 /nfs/dbraw/zinc/72/88/14/386728814.db2.gz IFRPXAWYYAEONI-CYBMUJFWSA-N 2 0 220.360 2.249 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1cocn1 ZINC000192279435 386750683 /nfs/dbraw/zinc/75/06/83/386750683.db2.gz PHNMGISVNPLUGT-GFCCVEGCSA-N 2 0 239.363 2.275 20 0 BEADRP COC1(CC[NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)CCC1 ZINC000336663986 386752198 /nfs/dbraw/zinc/75/21/98/386752198.db2.gz WSABQULOYXKJDD-STQMWFEESA-N 2 0 240.391 2.018 20 0 BEADRP COC[C@H](CC(C)C)[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000414841446 386754948 /nfs/dbraw/zinc/75/49/48/386754948.db2.gz OIHZDIYRIJTBBL-KBPBESRZSA-N 2 0 242.407 2.027 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]CC1([NH3+])CCCCC1 ZINC000414842922 386757467 /nfs/dbraw/zinc/75/74/67/386757467.db2.gz NLKHJYMVVXMGSG-NSHDSACASA-N 2 0 210.365 2.426 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]Cc1ccc2ncccc2c1 ZINC000414843157 386757819 /nfs/dbraw/zinc/75/78/19/386757819.db2.gz PTXNGTLGCPRNNY-LBPRGKRZSA-N 2 0 243.354 2.180 20 0 BEADRP [NH3+]C[C@H]1CCC[N@@H+]([C@@H]2CCc3ccc(F)cc32)C1 ZINC000334143456 386743035 /nfs/dbraw/zinc/74/30/35/386743035.db2.gz RPLZIDFDKHDAFR-IAQYHMDHSA-N 2 0 248.345 2.484 20 0 BEADRP C[NH+](C)CCNc1cc[nH+]c2cc(F)ccc12 ZINC000045285803 386744059 /nfs/dbraw/zinc/74/40/59/386744059.db2.gz GBCPGUFGPQWCHR-UHFFFAOYSA-N 2 0 233.290 2.347 20 0 BEADRP [NH3+]C[C@@H]1CCC[N@@H+]([C@H]2CCc3ccc(F)cc32)C1 ZINC000334143457 386744168 /nfs/dbraw/zinc/74/41/68/386744168.db2.gz RPLZIDFDKHDAFR-NHYWBVRUSA-N 2 0 248.345 2.484 20 0 BEADRP C[C@@H]1CC[NH2+]C[C@@H]1NC/C=C/c1ccc(F)cc1 ZINC000414932121 386775916 /nfs/dbraw/zinc/77/59/16/386775916.db2.gz QSPFPGZUKLWIQF-RDYIKARRSA-N 2 0 248.345 2.427 20 0 BEADRP COc1cc(C[NH2+][C@@H]2CC[NH2+]C[C@H]2C)ccc1C ZINC000414933243 386787975 /nfs/dbraw/zinc/78/79/75/386787975.db2.gz DJXUDISQLUHSTQ-TZMCWYRMSA-N 2 0 248.370 2.091 20 0 BEADRP C[C@@H]1CCC[C@H](C[N@H+](C)C2CC([NH3+])C2)C1 ZINC000394999399 386797127 /nfs/dbraw/zinc/79/71/27/386797127.db2.gz FPRYAGIQCFMSNG-IALDZJHCSA-N 2 0 210.365 2.234 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]CCc1cccc(F)c1 ZINC000336668994 386798373 /nfs/dbraw/zinc/79/83/73/386798373.db2.gz RBQPJAGUVSWVQT-NSHDSACASA-N 2 0 224.323 2.085 20 0 BEADRP CC[C@H](C[NH2+][C@H](C)C[C@H]1CCCCC[NH2+]1)OC ZINC000336669540 386801196 /nfs/dbraw/zinc/80/11/96/386801196.db2.gz AMPBCPHWPHYODT-MGPQQGTHSA-N 2 0 242.407 2.312 20 0 BEADRP C[C@@H](CCC1CC1)[NH2+]CCC[NH2+]C1CC1 ZINC000398472850 386826175 /nfs/dbraw/zinc/82/61/75/386826175.db2.gz OQOAFDPHLNNHTL-NSHDSACASA-N 2 0 210.365 2.297 20 0 BEADRP CCOc1cccc(C[NH2+][C@@H](C)CCC[NH3+])c1 ZINC000336672647 386827574 /nfs/dbraw/zinc/82/75/74/386827574.db2.gz BIFJIAYSZZZSJC-LBPRGKRZSA-N 2 0 236.359 2.302 20 0 BEADRP CCCCC[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@H]1C ZINC000249335647 386828845 /nfs/dbraw/zinc/82/88/45/386828845.db2.gz YUXAOOKQNMXUKB-FRRDWIJNSA-N 2 0 212.381 2.495 20 0 BEADRP CC[C@H](Cc1ccccc1)[NH2+]C[C@H](C)C[NH2+]C ZINC000414847151 386831325 /nfs/dbraw/zinc/83/13/25/386831325.db2.gz VIMOMEFUEMFBAE-UKRRQHHQSA-N 2 0 234.387 2.453 20 0 BEADRP C[C@H](C[NH2+][C@@H](C)CCc1ccco1)C[NH+](C)C ZINC000293364100 386835158 /nfs/dbraw/zinc/83/51/58/386835158.db2.gz HOELPCQAKDREFK-OLZOCXBDSA-N 2 0 238.375 2.388 20 0 BEADRP CS[C@@H]1CC[C@H]1[NH2+]CCCC[N@H+](C)C1CC1 ZINC000425340271 386842793 /nfs/dbraw/zinc/84/27/93/386842793.db2.gz ADDNZANJGNKEFR-CHWSQXEVSA-N 2 0 242.432 2.344 20 0 BEADRP CS[C@@H]1CC[C@@H]1[NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1 ZINC000425341736 386844376 /nfs/dbraw/zinc/84/43/76/386844376.db2.gz GBNSOEVIKUBAQH-MROQNXINSA-N 2 0 242.432 2.343 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]Cc2cc(F)cc(F)c2)C1 ZINC000334843051 386891166 /nfs/dbraw/zinc/89/11/66/386891166.db2.gz AGJKGSJYHOUOHY-QWHCGFSZSA-N 2 0 240.297 2.324 20 0 BEADRP Cc1ccc(C[NH2+]C2(C)CC[NH2+]CC2)cc1F ZINC000334845594 386891818 /nfs/dbraw/zinc/89/18/18/386891818.db2.gz XRNDSERAAGBPDE-UHFFFAOYSA-N 2 0 236.334 2.366 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C/C=C\c2ccccc2)CC[NH2+]1 ZINC000414942459 386891998 /nfs/dbraw/zinc/89/19/98/386891998.db2.gz DNAQQCYVDJKOBX-DBVFPWQWSA-N 2 0 230.355 2.430 20 0 BEADRP CO[C@@H](C)[C@@H](C)[NH2+]CC(C)(C)C[NH+]1CCCC1 ZINC000357842141 386854073 /nfs/dbraw/zinc/85/40/73/386854073.db2.gz ATSPRGWKKWSTLZ-OLZOCXBDSA-N 2 0 242.407 2.121 20 0 BEADRP Cc1cc(C[NH2+][C@@H]2CCC[NH2+]CC2)ccc1F ZINC000334846713 386894044 /nfs/dbraw/zinc/89/40/44/386894044.db2.gz KWZGWXNPPPAMBY-CYBMUJFWSA-N 2 0 236.334 2.366 20 0 BEADRP Cc1cc(C[NH2+][C@H]2CCC[C@H]([NH3+])C2)ccc1F ZINC000334846801 386894534 /nfs/dbraw/zinc/89/45/34/386894534.db2.gz PXQBLGJZKYSZJF-STQMWFEESA-N 2 0 236.334 2.494 20 0 BEADRP CC(C)C[C@H](C)C[NH2+][C@@H]1CC[NH2+]C[C@H]1C ZINC000414940188 386877131 /nfs/dbraw/zinc/87/71/31/386877131.db2.gz JYXYXAAPVRMMKC-YNEHKIRRSA-N 2 0 212.381 2.256 20 0 BEADRP C[C@H]1C[NH2+]CC[C@@H]1[NH2+]Cc1cc(Cl)cs1 ZINC000334839793 386885025 /nfs/dbraw/zinc/88/50/25/386885025.db2.gz BCIYHYLTXHFBCE-KWQFWETISA-N 2 0 244.791 2.489 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]Cc2cc(F)cc(F)c2)C1 ZINC000334843050 386890903 /nfs/dbraw/zinc/89/09/03/386890903.db2.gz AGJKGSJYHOUOHY-OLZOCXBDSA-N 2 0 240.297 2.324 20 0 BEADRP CCOC[C@H](C)[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000341476054 386916440 /nfs/dbraw/zinc/91/64/40/386916440.db2.gz CCKPXZNYLPDMBC-LBPRGKRZSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@H]1C[C@H]([NH2+]Cc2ccc(F)cc2)CC[NH2+]1 ZINC000334862399 386917818 /nfs/dbraw/zinc/91/78/18/386917818.db2.gz LCXGDWZCOBJYDQ-GXFFZTMASA-N 2 0 222.307 2.056 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CC[NH2+][C@@H](C)C2)cc1 ZINC000334864372 386919294 /nfs/dbraw/zinc/91/92/94/386919294.db2.gz PHOJWWZRJUXBTK-GXTWGEPZSA-N 2 0 218.344 2.225 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)cc1F ZINC000334847486 386896176 /nfs/dbraw/zinc/89/61/76/386896176.db2.gz USNAYYCZUGVFIF-QWHCGFSZSA-N 2 0 236.334 2.494 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)cc1F ZINC000334847479 386896679 /nfs/dbraw/zinc/89/66/79/386896679.db2.gz USNAYYCZUGVFIF-CHWSQXEVSA-N 2 0 236.334 2.494 20 0 BEADRP Fc1cccc2c1C[N@H+](CC1CC[NH2+]CC1)C2 ZINC000334851208 386900163 /nfs/dbraw/zinc/90/01/63/386900163.db2.gz BCAPJJWDWTUSID-UHFFFAOYSA-N 2 0 234.318 2.141 20 0 BEADRP Cc1cccc(C[NH2+][C@@H]2CC[NH2+]C[C@H]2C)c1C ZINC000334857190 386908703 /nfs/dbraw/zinc/90/87/03/386908703.db2.gz LSGQOHCCGOXRKC-IUODEOHRSA-N 2 0 232.371 2.391 20 0 BEADRP Cc1cc(C[NH2+][C@H]2CC[NH2+]C[C@H]2C)c(C)s1 ZINC000334856177 386909339 /nfs/dbraw/zinc/90/93/39/386909339.db2.gz GVHYMJHAPQSVPL-RNCFNFMXSA-N 2 0 238.400 2.453 20 0 BEADRP Cc1cc(F)ccc1C[NH2+][C@@H]1CC[NH2+]C[C@H]1C ZINC000334859604 386912504 /nfs/dbraw/zinc/91/25/04/386912504.db2.gz ZWOXBBQUGZXNCL-BXUZGUMPSA-N 2 0 236.334 2.222 20 0 BEADRP Cc1cccc(C[NH2+][C@H]2CC[NH2+][C@H](C)C2)c1 ZINC000334865148 386922557 /nfs/dbraw/zinc/92/25/57/386922557.db2.gz QZDOZDWIFPADBG-OCCSQVGLSA-N 2 0 218.344 2.225 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+][C@@H]2CCCC[C@H]2O)c2ccccc21 ZINC000331932939 386928861 /nfs/dbraw/zinc/92/88/61/386928861.db2.gz IOQNHHSXIVDSAY-LJISPDSOSA-N 2 0 246.354 2.024 20 0 BEADRP C[C@H]([NH2+]C1Cc2ccccc2C1)[C@@H]1CCC[NH2+]C1 ZINC000334873248 386934682 /nfs/dbraw/zinc/93/46/82/386934682.db2.gz FNXXCZBJKYFDNK-SWLSCSKDSA-N 2 0 244.382 2.132 20 0 BEADRP C[C@@H]([NH2+]C1Cc2ccccc2C1)[C@@H]1CCC[NH2+]C1 ZINC000334873246 386935219 /nfs/dbraw/zinc/93/52/19/386935219.db2.gz FNXXCZBJKYFDNK-IUODEOHRSA-N 2 0 244.382 2.132 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H]1CC[C@@H]1SC ZINC000425356536 386968699 /nfs/dbraw/zinc/96/86/99/386968699.db2.gz PLZLLVFKSYPWGO-RYUDHWBXSA-N 2 0 230.421 2.202 20 0 BEADRP CS[C@@H]1CC[C@@H]1[NH2+]CCC[N@H+](C)C(C)C ZINC000425359396 386977723 /nfs/dbraw/zinc/97/77/23/386977723.db2.gz PXXPEUNPIYTMNL-NWDGAFQWSA-N 2 0 230.421 2.200 20 0 BEADRP CO[C@H](C)CC[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000358666569 386995915 /nfs/dbraw/zinc/99/59/15/386995915.db2.gz QCTUEPMATFXKOE-GFCCVEGCSA-N 2 0 242.407 2.264 20 0 BEADRP C[C@H]([NH3+])C1CC[NH+]([C@@H](C)c2cccnc2)CC1 ZINC000110643857 387066607 /nfs/dbraw/zinc/06/66/07/387066607.db2.gz CBINASZVGXFCBM-RYUDHWBXSA-N 2 0 233.359 2.202 20 0 BEADRP [NH3+]CC[C@@H]1CCC[N@H+](CCc2ccccc2)C1 ZINC000070074086 387042827 /nfs/dbraw/zinc/04/28/27/387042827.db2.gz BVNPENLXFKTULE-HNNXBMFYSA-N 2 0 232.371 2.290 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CC2CC(F)(F)C2)[C@@H](C)C1 ZINC000425957012 387045724 /nfs/dbraw/zinc/04/57/24/387045724.db2.gz ZNQKZYYBVOWSPW-JQWIXIFHSA-N 2 0 246.345 2.352 20 0 BEADRP Cc1c[nH+]ccc1NC1CCC([NH+](C)C)CC1 ZINC000334968268 387051238 /nfs/dbraw/zinc/05/12/38/387051238.db2.gz QYBIVCVYMAYRDA-UHFFFAOYSA-N 2 0 233.359 2.097 20 0 BEADRP C[NH+](C)CCC[NH2+][C@H]1CC[C@H]1C1CCC1 ZINC000336764771 387055292 /nfs/dbraw/zinc/05/52/92/387055292.db2.gz QIUZMAJKHBLCCC-STQMWFEESA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]CCc1c[nH]c2ccccc12 ZINC000336788644 387062446 /nfs/dbraw/zinc/06/24/46/387062446.db2.gz HKJNVPHNZRSVRU-LBPRGKRZSA-N 2 0 245.370 2.427 20 0 BEADRP C(C1CCC1)[NH+]1CCC([C@H]2CC[NH2+]C2)CC1 ZINC000334977192 387063856 /nfs/dbraw/zinc/06/38/56/387063856.db2.gz ANZQMCZACFIQJP-AWEZNQCLSA-N 2 0 222.376 2.108 20 0 BEADRP C(C1CCC1)[N@@H+]1CCC[C@@H]([C@H]2CC[NH2+]C2)C1 ZINC000334978861 387065425 /nfs/dbraw/zinc/06/54/25/387065425.db2.gz CAGYSGDXKAZMOX-UONOGXRCSA-N 2 0 222.376 2.108 20 0 BEADRP CS[C@@H]1CC[C@H]1[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC000425372837 387014448 /nfs/dbraw/zinc/01/44/48/387014448.db2.gz UFLLNTWOFWNUBK-YNEHKIRRSA-N 2 0 242.432 2.202 20 0 BEADRP CCOC(C)(C)C[NH2+][C@@H]1CC[N@H+](CC)C[C@H]1C ZINC000188692749 387070777 /nfs/dbraw/zinc/07/07/77/387070777.db2.gz WUJZZZZPBOTJEM-CHWSQXEVSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@H]1CCc2c1c(F)ccc2F ZINC000423298558 387130244 /nfs/dbraw/zinc/13/02/44/387130244.db2.gz ONTJCPJZKKFEJJ-UFBFGSQYSA-N 2 0 240.297 2.137 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H]1CCC[C@H]1CCCF ZINC000423298523 387130603 /nfs/dbraw/zinc/13/06/03/387130603.db2.gz AJUMHPXKAGJQEG-WOPDTQHZSA-N 2 0 216.344 2.089 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)c1nccs1 ZINC000070733435 387091253 /nfs/dbraw/zinc/09/12/53/387091253.db2.gz URUNTABGTHJDTF-MNOVXSKESA-N 2 0 239.388 2.183 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)c1nccs1 ZINC000070733434 387091524 /nfs/dbraw/zinc/09/15/24/387091524.db2.gz URUNTABGTHJDTF-QWRGUYRKSA-N 2 0 239.388 2.183 20 0 BEADRP CC[C@](C)(C[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)OC ZINC000322514415 387093087 /nfs/dbraw/zinc/09/30/87/387093087.db2.gz JTUQVBUJCCDHNK-MGPQQGTHSA-N 2 0 240.391 2.018 20 0 BEADRP CC1(F)CC([NH2+][C@@H]2CCCCC[C@@H]2[NH3+])C1 ZINC000335004821 387099680 /nfs/dbraw/zinc/09/96/80/387099680.db2.gz GNOOHVCJVUYLLJ-LVFLEHKBSA-N 2 0 214.328 2.127 20 0 BEADRP CC[C@@H]([NH2+]CC1C[NH2+]C1)C1CCCCC1 ZINC000423300527 387131430 /nfs/dbraw/zinc/13/14/30/387131430.db2.gz FDJUIXYVKVEYRB-CYBMUJFWSA-N 2 0 210.365 2.154 20 0 BEADRP [NH3+][C@H]1CCCCC[C@H]1[NH2+]C1CC(F)(F)C1 ZINC000335006093 387100974 /nfs/dbraw/zinc/10/09/74/387100974.db2.gz ANDKQAQMGQQJLG-VHSXEESVSA-N 2 0 218.291 2.034 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+]C1CCC2(CC2)CC1 ZINC000335007603 387103119 /nfs/dbraw/zinc/10/31/19/387103119.db2.gz PARVQYVPHSYBED-YPMHNXCESA-N 2 0 222.376 2.297 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H]2CC[C@H](OC)C2)CC1 ZINC000188817754 387104208 /nfs/dbraw/zinc/10/42/08/387104208.db2.gz MGCBSLNPGAJOTL-KGLIPLIRSA-N 2 0 240.391 2.018 20 0 BEADRP CCc1ccccc1C[N@@H+]1C[C@@H](C[NH3+])C[C@H]1C ZINC000250262662 387111765 /nfs/dbraw/zinc/11/17/65/387111765.db2.gz DVDAHRXMHABHPY-CHWSQXEVSA-N 2 0 232.371 2.418 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H]2CCCC23CCC3)CCC1 ZINC000335025044 387116616 /nfs/dbraw/zinc/11/66/16/387116616.db2.gz QVQZBHUDOQEBTC-LLVKDONJSA-N 2 0 208.349 2.180 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H](C)[C@H]2C[C@H]2C)CC1 ZINC000321351240 387126030 /nfs/dbraw/zinc/12/60/30/387126030.db2.gz CRYYMFZBLZMCFG-BZPMIXESSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H](C[NH2+][C@@H](C)[C@H]1CCC[NH2+]C1)C(F)(F)F ZINC000643482100 387128254 /nfs/dbraw/zinc/12/82/54/387128254.db2.gz FIKZPXIHJZBSTD-GUBZILKMSA-N 2 0 238.297 2.163 20 0 BEADRP COc1cc([C@H](C)[NH2+]C[C@H](C)C[NH3+])ccc1F ZINC000423299533 387129120 /nfs/dbraw/zinc/12/91/20/387129120.db2.gz BSZNIXNVUFCDDS-ZJUUUORDSA-N 2 0 240.322 2.080 20 0 BEADRP COc1cc([C@H](C)[NH2+]C[C@@H](C)C[NH3+])ccc1F ZINC000423299531 387129787 /nfs/dbraw/zinc/12/97/87/387129787.db2.gz BSZNIXNVUFCDDS-UWVGGRQHSA-N 2 0 240.322 2.080 20 0 BEADRP C[C@@H]([NH2+]CC1C[NH2+]C1)c1cc2c(s1)CCC2 ZINC000423305581 387141397 /nfs/dbraw/zinc/14/13/97/387141397.db2.gz RFODCEOQNADQSV-SECBINFHSA-N 2 0 236.384 2.107 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@H](C1CC1)C1CCCC1 ZINC000423308532 387144045 /nfs/dbraw/zinc/14/40/45/387144045.db2.gz OREDLPKICYYART-GWCFXTLKSA-N 2 0 210.365 2.140 20 0 BEADRP C[C@H]([NH2+]CC1C[NH2+]C1)C1CCCCCC1 ZINC000423307410 387144412 /nfs/dbraw/zinc/14/44/12/387144412.db2.gz VZUSCLCNYAMXMH-NSHDSACASA-N 2 0 210.365 2.154 20 0 BEADRP C[N@H+](CCCCF)CCC[NH+]1CCCC1 ZINC000352393926 387145215 /nfs/dbraw/zinc/14/52/15/387145215.db2.gz FDRHPMRHABAJGK-UHFFFAOYSA-N 2 0 216.344 2.154 20 0 BEADRP C[C@@H]([NH2+]C[C@@H](C)C[NH3+])c1cccc(F)c1F ZINC000423310017 387145585 /nfs/dbraw/zinc/14/55/85/387145585.db2.gz RCTMCBVMZVSSGD-DTWKUNHWSA-N 2 0 228.286 2.210 20 0 BEADRP c1ccc(C[C@@H]2CC[C@H]([NH2+]CC3C[NH2+]C3)C2)cc1 ZINC000423309367 387145922 /nfs/dbraw/zinc/14/59/22/387145922.db2.gz ZGSLSMGJNNFNQA-HOCLYGCPSA-N 2 0 244.382 2.207 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H](C)C[NH3+])c1ccsc1 ZINC000423309228 387145947 /nfs/dbraw/zinc/14/59/47/387145947.db2.gz PXVYTPPUSWFWFV-GXSJLCMTSA-N 2 0 212.362 2.384 20 0 BEADRP CC[C@H]([NH2+]C[C@H](C)C[NH3+])c1ccsc1 ZINC000423309229 387146800 /nfs/dbraw/zinc/14/68/00/387146800.db2.gz PXVYTPPUSWFWFV-KOLCDFICSA-N 2 0 212.362 2.384 20 0 BEADRP [NH3+][C@H](C[NH2+]C1CCC(C(F)F)CC1)C1CC1 ZINC000423312857 387151382 /nfs/dbraw/zinc/15/13/82/387151382.db2.gz DWBBHEIPWXIOQB-VQXHTEKXSA-N 2 0 232.318 2.137 20 0 BEADRP CCC[NH2+]CC[NH2+][C@@H](C)CCCc1cccnc1 ZINC000423313762 387151415 /nfs/dbraw/zinc/15/14/15/387151415.db2.gz UTMJTHDOYPJUJZ-AWEZNQCLSA-N 2 0 249.402 2.382 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H]1CCCC12CCCC2 ZINC000423313247 387151910 /nfs/dbraw/zinc/15/19/10/387151910.db2.gz WQSYEGOIFPEXQV-VXGBXAGGSA-N 2 0 210.365 2.284 20 0 BEADRP C[C@@H]1Cc2ccc(F)cc2[C@H]1[NH2+]CCCC[NH3+] ZINC000423315381 387154043 /nfs/dbraw/zinc/15/40/43/387154043.db2.gz APBWAHXHTNWLGY-YGRLFVJLSA-N 2 0 236.334 2.388 20 0 BEADRP CCCCO[C@@H]1C[C@H]([NH2+]C[C@@H](C)C[NH3+])C1(C)C ZINC000423316190 387156412 /nfs/dbraw/zinc/15/64/12/387156412.db2.gz ZQTJDWNOMFPSBO-RWMBFGLXSA-N 2 0 242.407 2.155 20 0 BEADRP [NH3+]C1(C[NH2+][C@H](C2CC2)C2CCCC2)CCC1 ZINC000423316404 387156472 /nfs/dbraw/zinc/15/64/72/387156472.db2.gz AQEUXGVIFFUJKL-ZDUSSCGKSA-N 2 0 222.376 2.426 20 0 BEADRP C[C@@H]([NH2+]CC1(C)CC[NH2+]CC1)c1ccco1 ZINC000423318599 387158440 /nfs/dbraw/zinc/15/84/40/387158440.db2.gz CPIZXQFJAUMTGF-LLVKDONJSA-N 2 0 222.332 2.320 20 0 BEADRP CCC[C@@H]([NH2+]CC1([NH3+])CCC1)C1CCC1 ZINC000423317478 387158508 /nfs/dbraw/zinc/15/85/08/387158508.db2.gz BMZRFWKPFAQTFZ-GFCCVEGCSA-N 2 0 210.365 2.426 20 0 BEADRP CC[C@@H]([NH2+]CC1([NH3+])CCC1)C1CCCC1 ZINC000423319121 387159691 /nfs/dbraw/zinc/15/96/91/387159691.db2.gz CWYJQTAOHFDAAQ-GFCCVEGCSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@@H](CCCc1cccnc1)[NH2+]C[C@H]([NH3+])C1CC1 ZINC000423320242 387162550 /nfs/dbraw/zinc/16/25/50/387162550.db2.gz MFTXSOQQAXFJNA-WFASDCNBSA-N 2 0 247.386 2.120 20 0 BEADRP [NH3+][C@@H](C[NH2+]C1CCC2(CC2)CC1)C1CC1 ZINC000423320741 387163076 /nfs/dbraw/zinc/16/30/76/387163076.db2.gz MOMBLKIEOMLNFL-LBPRGKRZSA-N 2 0 208.349 2.036 20 0 BEADRP CC1(F)CC([NH2+]C2CC[NH+](CC3CC3)CC2)C1 ZINC000571748383 387167843 /nfs/dbraw/zinc/16/78/43/387167843.db2.gz IVMMZFMKBVATTN-UHFFFAOYSA-N 2 0 240.366 2.341 20 0 BEADRP CCC(CC)[N@H+](CCOC)C[C@]1(C)CC[NH2+]C1 ZINC000062911979 387173580 /nfs/dbraw/zinc/17/35/80/387173580.db2.gz BHVVYSQNJNDHRA-CQSZACIVSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@@H]([NH2+]C[C@H]([NH3+])C2CC2)C1 ZINC000423330374 387174837 /nfs/dbraw/zinc/17/48/37/387174837.db2.gz UFPMBKWANHZIFA-URBCHYCLSA-N 2 0 210.365 2.138 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H]2CCC[C@H]2CCCF)CCC1 ZINC000423330699 387175138 /nfs/dbraw/zinc/17/51/38/387175138.db2.gz PSXYDQUJOKDLMT-NWDGAFQWSA-N 2 0 228.355 2.376 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@H]([NH2+]CC2([NH3+])CCC2)C1 ZINC000423330998 387175775 /nfs/dbraw/zinc/17/57/75/387175775.db2.gz OBIJCCNNJMRQFR-GRYCIOLGSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)[C@H]1CCC[C@@H]([NH2+]CC2C[NH2+]C2)C1 ZINC000423331684 387175912 /nfs/dbraw/zinc/17/59/12/387175912.db2.gz UTCBOHGYFCJUKI-QWHCGFSZSA-N 2 0 210.365 2.010 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H]2CCC[C@@H]2CCCF)CCC1 ZINC000423330701 387176260 /nfs/dbraw/zinc/17/62/60/387176260.db2.gz PSXYDQUJOKDLMT-VXGBXAGGSA-N 2 0 228.355 2.376 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H]2CC[C@H]2C2CCC2)CCC1 ZINC000423332714 387177772 /nfs/dbraw/zinc/17/77/72/387177772.db2.gz QWQXXOWPJHDRLK-NWDGAFQWSA-N 2 0 208.349 2.036 20 0 BEADRP Cc1cncc([C@@H](C)[NH2+]C[C@@]2(C)CCC[NH2+]C2)c1 ZINC000423334939 387181380 /nfs/dbraw/zinc/18/13/80/387181380.db2.gz IMBIJDJYDVYNRN-HIFRSBDPSA-N 2 0 247.386 2.430 20 0 BEADRP CSCC1CCC([NH2+]CC2([NH3+])CCC2)CC1 ZINC000423335259 387183844 /nfs/dbraw/zinc/18/38/44/387183844.db2.gz RJSVOZXFXDUWAE-UHFFFAOYSA-N 2 0 242.432 2.379 20 0 BEADRP C1=C(C[NH2+][C@H]2CCC[C@@H](C3CC3)C2)CC[NH2+]C1 ZINC000423337195 387185363 /nfs/dbraw/zinc/18/53/63/387185363.db2.gz HLMYUWHYJDRWMB-CABCVRRESA-N 2 0 234.387 2.465 20 0 BEADRP C[C@@H]([NH2+]CC1=CC[NH2+]CC1)c1ccc(F)cc1 ZINC000423337025 387185719 /nfs/dbraw/zinc/18/57/19/387185719.db2.gz HCAPBNHNUUDCGG-LLVKDONJSA-N 2 0 234.318 2.396 20 0 BEADRP Cc1ccccc1C[C@H](C)[NH2+]CC1=CC[NH2+]CC1 ZINC000423337997 387185794 /nfs/dbraw/zinc/18/57/94/387185794.db2.gz HYBIUCUZTZTQQM-AWEZNQCLSA-N 2 0 244.382 2.435 20 0 BEADRP COc1cccc2c1CC[C@@H]2[NH2+]CCCC[NH3+] ZINC000423340646 387188082 /nfs/dbraw/zinc/18/80/82/387188082.db2.gz STKLNWPANVQUFD-ZDUSSCGKSA-N 2 0 234.343 2.011 20 0 BEADRP c1ccc(CCC[N@@H+]2CC[C@@H]3[NH2+]CC[C@H]3C2)cc1 ZINC000336794651 387190007 /nfs/dbraw/zinc/19/00/07/387190007.db2.gz DPDRBMHDXUSNPD-HOTGVXAUSA-N 2 0 244.382 2.303 20 0 BEADRP CC[C@H]([NH2+]CC1(C)CC[NH2+]CC1)C(C)C ZINC000423341017 387191083 /nfs/dbraw/zinc/19/10/83/387191083.db2.gz WHFDUINQFBHWLY-LBPRGKRZSA-N 2 0 212.381 2.400 20 0 BEADRP CC(C)[C@H]1CC[C@@H](C)C[C@@H]1[NH2+]CC1C[NH2+]C1 ZINC000423302180 387133990 /nfs/dbraw/zinc/13/39/90/387133990.db2.gz JEJYIQVZLPFBOE-BNOWGMLFSA-N 2 0 224.392 2.256 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H](C)c1nccc2ccccc21 ZINC000423302663 387134668 /nfs/dbraw/zinc/13/46/68/387134668.db2.gz HSLFYHRVYKLBCT-VXGBXAGGSA-N 2 0 243.354 2.480 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H](Cc1ccccc1)C1CC1 ZINC000423302869 387135357 /nfs/dbraw/zinc/13/53/57/387135357.db2.gz WDRWGJOWWFVCHZ-IUODEOHRSA-N 2 0 232.371 2.192 20 0 BEADRP CC[C@@H]1C[C@H](C)CC[C@H]1[NH2+]C[C@H](C)C[NH3+] ZINC000423301799 387135395 /nfs/dbraw/zinc/13/53/95/387135395.db2.gz GNJPRYDJPZNAGJ-FDYHWXHSSA-N 2 0 212.381 2.386 20 0 BEADRP c1ccc([C@H]2CCC[C@@H]2[NH2+]CC2C[NH2+]C2)cc1 ZINC000423303570 387136250 /nfs/dbraw/zinc/13/62/50/387136250.db2.gz LZDJQUZWAVVYSH-CABCVRRESA-N 2 0 230.355 2.132 20 0 BEADRP Cc1cccc([C@@H](C)[NH2+]CC2C[NH2+]C2)c1C ZINC000423304160 387137071 /nfs/dbraw/zinc/13/70/71/387137071.db2.gz NHXKLWGJPFYTEH-GFCCVEGCSA-N 2 0 218.344 2.173 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+]C[C@H](C)C[NH3+])[C@H](C)C2 ZINC000423302986 387137223 /nfs/dbraw/zinc/13/72/23/387137223.db2.gz IGLUTSJYWZEFKX-LALPHHSUSA-N 2 0 232.371 2.413 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+]CC2C[NH2+]C2)cc1C ZINC000423304646 387139564 /nfs/dbraw/zinc/13/95/64/387139564.db2.gz OMNBSGOFKWMDQU-GFCCVEGCSA-N 2 0 218.344 2.173 20 0 BEADRP Cc1ccc([C@H](C)[NH2+]CC2C[NH2+]C2)cc1C ZINC000423304647 387139885 /nfs/dbraw/zinc/13/98/85/387139885.db2.gz OMNBSGOFKWMDQU-LBPRGKRZSA-N 2 0 218.344 2.173 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H](C)C[NH3+])c1cccc(F)c1 ZINC000423305634 387141162 /nfs/dbraw/zinc/14/11/62/387141162.db2.gz KUDYPFCZMFNYRK-GXFFZTMASA-N 2 0 224.323 2.461 20 0 BEADRP CCCOc1ccc([C@H](C)[NH2+]CC2C[NH2+]C2)cc1 ZINC000423305481 387141206 /nfs/dbraw/zinc/14/12/06/387141206.db2.gz QSYILKFVCNXTPG-LBPRGKRZSA-N 2 0 248.370 2.345 20 0 BEADRP C[C@H](Cc1ccccc1F)[NH2+]CC1=CC[NH2+]CC1 ZINC000423358104 387210106 /nfs/dbraw/zinc/21/01/06/387210106.db2.gz SZSYRUQNGYJBEU-GFCCVEGCSA-N 2 0 248.345 2.266 20 0 BEADRP COc1cccc2c1CCC[C@@H]2[NH2+]CCC[NH3+] ZINC000643496762 387219382 /nfs/dbraw/zinc/21/93/82/387219382.db2.gz CVERTLGPAVYQFZ-ZDUSSCGKSA-N 2 0 234.343 2.011 20 0 BEADRP CC[C@H]([NH2+][C@H]1CCC[C@@H]([NH3+])C1)c1ccncc1 ZINC000423368799 387220662 /nfs/dbraw/zinc/22/06/62/387220662.db2.gz NOEWGCGQHBPYFL-RDBSUJKOSA-N 2 0 233.359 2.392 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)c1cccnc1 ZINC000423425945 387253246 /nfs/dbraw/zinc/25/32/46/387253246.db2.gz DSIBYDJYIWSDAH-TUKIKUTGSA-N 2 0 245.370 2.120 20 0 BEADRP CCC(C)(C)[C@H](C)[NH2+]CC1CC[NH2+]CC1 ZINC000643497184 387228782 /nfs/dbraw/zinc/22/87/82/387228782.db2.gz LSZTXHAGYQAKGS-NSHDSACASA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@H]1CCC[C@@H]1CCCF ZINC000423396990 387233147 /nfs/dbraw/zinc/23/31/47/387233147.db2.gz NYWWEQUZRSUURU-MQYQWHSLSA-N 2 0 242.382 2.492 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+][C@@H]1CCc2cc(F)ccc21 ZINC000423402064 387237894 /nfs/dbraw/zinc/23/78/94/387237894.db2.gz RFUUYYZHRJTFOZ-VCTAVGKDSA-N 2 0 248.345 2.401 20 0 BEADRP Cc1ccnc([C@H](C)[NH2+]CC2=CC[N@H+](C)CC2)c1 ZINC000353618571 387243197 /nfs/dbraw/zinc/24/31/97/387243197.db2.gz GQWFDXHCBOSPJL-ZDUSSCGKSA-N 2 0 245.370 2.303 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+][C@H]1CCCC12CCC2 ZINC000423406331 387244281 /nfs/dbraw/zinc/24/42/81/387244281.db2.gz UQJWGSUAWYLLMI-UPJWGTAASA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)c1ccco1 ZINC000423420205 387248082 /nfs/dbraw/zinc/24/80/82/387248082.db2.gz AEQRIJOVXKUQEL-WCFLWFBJSA-N 2 0 234.343 2.318 20 0 BEADRP CC(C)[C@H]([NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21)c1ccccc1 ZINC000423420650 387250083 /nfs/dbraw/zinc/25/00/83/387250083.db2.gz BSBKLRFKLKYOIE-LJISPDSOSA-N 2 0 230.355 2.191 20 0 BEADRP C1C[C@H]([NH2+][C@@H]2[C@H]3C[NH2+]C[C@H]32)C2(C1)CCCCC2 ZINC000423423963 387250145 /nfs/dbraw/zinc/25/01/45/387250145.db2.gz FBYHVLFKQJQZSF-RFQIPJPRSA-N 2 0 234.387 2.297 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000423346501 387195062 /nfs/dbraw/zinc/19/50/62/387195062.db2.gz PVOGTQFMKQEYFK-AGIUHOORSA-N 2 0 210.365 2.154 20 0 BEADRP CC(C)(C)[C@@H]1CC[C@@H]1[NH2+]CC1([NH3+])CCC1 ZINC000423345711 387196076 /nfs/dbraw/zinc/19/60/76/387196076.db2.gz YWLBWLLRRFDAIZ-MNOVXSKESA-N 2 0 210.365 2.282 20 0 BEADRP CCC1CCC([NH2+]CC2=CC[NH2+]CC2)CC1 ZINC000423347446 387198160 /nfs/dbraw/zinc/19/81/60/387198160.db2.gz QNXZHPMUVGPOJI-UHFFFAOYSA-N 2 0 222.376 2.465 20 0 BEADRP COC[C@H]([NH2+][C@@H](C)CCCC[NH3+])C1CCCC1 ZINC000423425499 387252407 /nfs/dbraw/zinc/25/24/07/387252407.db2.gz GYVIOXURIMNTLY-JSGCOSHPSA-N 2 0 242.407 2.299 20 0 BEADRP C1=C(C[NH2+][C@H]2CCCC[C@H]2C2CC2)CC[NH2+]C1 ZINC000423349219 387200734 /nfs/dbraw/zinc/20/07/34/387200734.db2.gz WDFLBNAFCQYEFX-GJZGRUSLSA-N 2 0 234.387 2.465 20 0 BEADRP C[C@@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)[C@H]1C[C@H]1C ZINC000423348661 387200821 /nfs/dbraw/zinc/20/08/21/387200821.db2.gz UGXARFUCYAZQJI-FVCCEPFGSA-N 2 0 210.365 2.010 20 0 BEADRP Cc1ccncc1C[NH+]1CCC(C[NH+](C)C)CC1 ZINC000353444728 387201515 /nfs/dbraw/zinc/20/15/15/387201515.db2.gz CIAFCTFTGLIOGD-UHFFFAOYSA-N 2 0 247.386 2.164 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+]C[C@H]1CCC[C@@H]([NH3+])C1 ZINC000423467412 387314912 /nfs/dbraw/zinc/31/49/12/387314912.db2.gz IVSKKEREXFXQIG-MBNYWOFBSA-N 2 0 236.359 2.318 20 0 BEADRP C[C@@H]([NH2+][C@H](C1CC1)C1CCCC1)[C@H](C)[NH3+] ZINC000423469482 387316471 /nfs/dbraw/zinc/31/64/71/387316471.db2.gz PBAYPRYJMXSLOT-CWSCBRNRSA-N 2 0 210.365 2.281 20 0 BEADRP C[C@@H](CN)[NH2+][C@H]1CCCCc2ccccc21 ZINC000423381406 387262396 /nfs/dbraw/zinc/26/23/96/387262396.db2.gz ZRDOZHFTOYMLCE-FZMZJTMJSA-N 2 0 218.344 2.391 20 0 BEADRP C[C@@H](C[NH3+])N[C@@H]1CCc2ccc(Cl)cc21 ZINC000423381365 387262725 /nfs/dbraw/zinc/26/27/25/387262725.db2.gz ZNQZXEBOOWLPFV-QPUJVOFHSA-N 2 0 224.735 2.264 20 0 BEADRP CC[C@H](N[C@@H](C)C[NH3+])c1cccc(OC)c1 ZINC000423380320 387263762 /nfs/dbraw/zinc/26/37/62/387263762.db2.gz YHRUBJVDFQGHLA-GWCFXTLKSA-N 2 0 222.332 2.083 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@@H]1CCCC12CCC2 ZINC000423382451 387266595 /nfs/dbraw/zinc/26/65/95/387266595.db2.gz IPIGEGVPQDUAFT-VXGBXAGGSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@@H]([NH3+])C1)c1cncc(F)c1 ZINC000423385076 387267031 /nfs/dbraw/zinc/26/70/31/387267031.db2.gz LLYQSTHQCCNJFS-ZWKOPEQDSA-N 2 0 237.322 2.141 20 0 BEADRP Cc1cc(C[NH2+][C@H](C)CC[NH3+])c(C)s1 ZINC000572224072 387276851 /nfs/dbraw/zinc/27/68/51/387276851.db2.gz IITHWOYVLWVRQP-MRVPVSSYSA-N 2 0 212.362 2.192 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1CCCc2ccccc2C1 ZINC000643498560 387277406 /nfs/dbraw/zinc/27/74/06/387277406.db2.gz APMYSAHNPIKXQV-OAHLLOKOSA-N 2 0 232.371 2.133 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H]1CCCc2ccc(O)cc21 ZINC000643499307 387282245 /nfs/dbraw/zinc/28/22/45/387282245.db2.gz ZNWWXAIPQHKUTB-OAHLLOKOSA-N 2 0 248.370 2.359 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@H]2C2CC[NH2+]CC2)[C@@H]1C ZINC000423430796 387282367 /nfs/dbraw/zinc/28/23/67/387282367.db2.gz IKUPJMIRTWTJGT-SJVBDLOYSA-N 2 0 222.376 2.009 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000423432690 387283359 /nfs/dbraw/zinc/28/33/59/387283359.db2.gz MPTMLPNKAOQOBI-BYCMXARLSA-N 2 0 248.370 2.188 20 0 BEADRP CC[C@H]1CC[C@H]1[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000423432027 387283394 /nfs/dbraw/zinc/28/33/94/387283394.db2.gz JBSVFIQWRUQAFF-SCUASFONSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]([NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21)C(C)(C)c1ccccc1 ZINC000423431549 387284040 /nfs/dbraw/zinc/28/40/40/387284040.db2.gz LTYSHONPBOQKES-RZFFKMDDSA-N 2 0 244.382 2.160 20 0 BEADRP CC(C)CCC[N@@H+]1CCC[C@]2(CC[NH2+]C2)C1 ZINC000352525447 387288344 /nfs/dbraw/zinc/28/83/44/387288344.db2.gz GQCXSATXIFKEEB-CQSZACIVSA-N 2 0 224.392 2.498 20 0 BEADRP c1ccc([C@@H]2CC[C@@H]([NH2+][C@@H]3[C@H]4C[NH2+]C[C@H]43)C2)cc1 ZINC000423438305 387288360 /nfs/dbraw/zinc/28/83/60/387288360.db2.gz RCTSXJJJGFWJLV-SUJAAXHWSA-N 2 0 242.366 2.130 20 0 BEADRP CC(C)CCC[N@@H+]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC000352525446 387288943 /nfs/dbraw/zinc/28/89/43/387288943.db2.gz GQCXSATXIFKEEB-AWEZNQCLSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000423442110 387292878 /nfs/dbraw/zinc/29/28/78/387292878.db2.gz UVWOSLYSMQCTLT-UGFHNGPFSA-N 3 0 247.386 2.238 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@H](C)C1CCOCC1 ZINC000353910383 387296000 /nfs/dbraw/zinc/29/60/00/387296000.db2.gz DDYCFXBYOBHYFK-CYBMUJFWSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H]([NH3+])[C@H](C)[NH2+][C@H]1c2ccccc2C[C@@H]1C ZINC000423448583 387297673 /nfs/dbraw/zinc/29/76/73/387297673.db2.gz QOQQWFDBTSTWAL-AYGWYOGXSA-N 2 0 218.344 2.245 20 0 BEADRP C[C@H]([NH3+])[C@H](C)[NH2+][C@@H]1CCCC[C@@H]1C1CC1 ZINC000423452767 387300050 /nfs/dbraw/zinc/30/00/50/387300050.db2.gz WWEGYCFCQMQODP-YRRQLQLVSA-N 2 0 210.365 2.281 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@@H](C)C1CCSCC1 ZINC000423451788 387300106 /nfs/dbraw/zinc/30/01/06/387300106.db2.gz IYNFCGJFHICHGR-QWRGUYRKSA-N 2 0 230.421 2.235 20 0 BEADRP C[C@H]([NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21)[C@@H]1CCCC[C@H]1C ZINC000423450309 387300110 /nfs/dbraw/zinc/30/01/10/387300110.db2.gz HGQQKHNJIBLGQS-FDFVQJQPSA-N 2 0 222.376 2.009 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]Cc1ccc2c(c1)CCCN2 ZINC000423450098 387300447 /nfs/dbraw/zinc/30/04/47/387300447.db2.gz SICRYUSBUFDWOL-VXGBXAGGSA-N 2 0 247.386 2.260 20 0 BEADRP CC[C@H](COC)[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000360501648 387301029 /nfs/dbraw/zinc/30/10/29/387301029.db2.gz VZXSIFGDWNECRS-GFCCVEGCSA-N 2 0 240.391 2.018 20 0 BEADRP CCc1cccnc1[C@@H](C)[NH2+][C@@H](C)CCC[NH3+] ZINC000423454448 387301863 /nfs/dbraw/zinc/30/18/63/387301863.db2.gz LOZWETZSCCAHCH-NWDGAFQWSA-N 2 0 235.375 2.422 20 0 BEADRP CC(C)CO[C@@H]1C[C@H]([NH2+][C@@H](C)[C@@H](C)[NH3+])C1(C)C ZINC000423454120 387302580 /nfs/dbraw/zinc/30/25/80/387302580.db2.gz YPJZIHBIKQARQG-MROQNXINSA-N 2 0 242.407 2.151 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)c1ccoc1 ZINC000583257682 387305033 /nfs/dbraw/zinc/30/50/33/387305033.db2.gz QLYOVHWFWHGKOR-LEWSCRJBSA-N 2 0 234.343 2.318 20 0 BEADRP CC[C@H]([NH2+]CCC1=CC[NH2+]CC1)[C@H]1C[C@H]1C ZINC000423540448 387365612 /nfs/dbraw/zinc/36/56/12/387365612.db2.gz QIOPYQWOZVOWHL-XBFCOCLRSA-N 2 0 222.376 2.320 20 0 BEADRP C[C@@H]([NH2+]CCC1=CC[NH2+]CC1)C1(C)CC1 ZINC000423540865 387366171 /nfs/dbraw/zinc/36/61/71/387366171.db2.gz QYIZUNJPKPZLDE-LLVKDONJSA-N 2 0 208.349 2.074 20 0 BEADRP CCC1CC([NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)C1 ZINC000423541141 387366187 /nfs/dbraw/zinc/36/61/87/387366187.db2.gz FFEBLKWSRUAJBJ-VWGAPNJBSA-N 2 0 222.376 2.153 20 0 BEADRP CC[C@@H]([NH2+]CCC1=CC[NH2+]CC1)C1CCC1 ZINC000423540199 387366408 /nfs/dbraw/zinc/36/64/08/387366408.db2.gz QBAHSQATNJYLEY-CQSZACIVSA-N 2 0 222.376 2.465 20 0 BEADRP CC1(C)CCC[C@@H]1[NH2+]CCC1=CC[NH2+]CC1 ZINC000423543190 387368317 /nfs/dbraw/zinc/36/83/17/387368317.db2.gz UNXJMKSTCSUGNI-ZDUSSCGKSA-N 2 0 222.376 2.465 20 0 BEADRP C[C@@H]([NH2+]CCC1=CC[NH2+]CC1)c1cncc(F)c1 ZINC000423545114 387368847 /nfs/dbraw/zinc/36/88/47/387368847.db2.gz XQAIJZOFIDJLRO-LLVKDONJSA-N 2 0 249.333 2.181 20 0 BEADRP CC[C@@H]1C[C@H]([NH2+][C@H](C)[C@H]2CCCC[NH2+]2)CCO1 ZINC000423545636 387369140 /nfs/dbraw/zinc/36/91/40/387369140.db2.gz JTDVKFWQQZYODZ-AAVRWANBSA-N 2 0 240.391 2.064 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]CCC2=CC[NH2+]CC2)C1 ZINC000423547909 387370186 /nfs/dbraw/zinc/37/01/86/387370186.db2.gz GDLMDEYSHXYQAY-TZMCWYRMSA-N 2 0 222.376 2.465 20 0 BEADRP CC[C@H]([NH2+]CCC[NH2+]C1CC1)[C@H]1C[C@H]1C ZINC000423546528 387370820 /nfs/dbraw/zinc/37/08/20/387370820.db2.gz FLERSVUMBYSYSQ-WXHSDQCUSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1Cc2ccccc21)[C@@H]1CCCC[NH2+]1 ZINC000643453502 387371489 /nfs/dbraw/zinc/37/14/89/387371489.db2.gz IQMQTKVHEMHWBL-INWMFGNUSA-N 2 0 244.382 2.447 20 0 BEADRP Cc1cc(C[NH2+]C2CCC(C[NH3+])CC2)cc(C)n1 ZINC000423557552 387374606 /nfs/dbraw/zinc/37/46/06/387374606.db2.gz RMUMXAZEWMEYER-UHFFFAOYSA-N 2 0 247.386 2.306 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000423566418 387377447 /nfs/dbraw/zinc/37/74/47/387377447.db2.gz ZJQOAGHXODJUEG-NMFUWQPSSA-N 2 0 248.370 2.188 20 0 BEADRP CC[C@@H]1C[C@@H]([NH2+]C2CCC(C[NH3+])CC2)CCO1 ZINC000423561335 387377724 /nfs/dbraw/zinc/37/77/24/387377724.db2.gz VVTHWVUBKOADOH-CLRIEMFWSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]C[C@H]1CC12CCSCC2 ZINC000423564695 387377819 /nfs/dbraw/zinc/37/78/19/387377819.db2.gz YADHTHRCLWTXAS-SDDRHHMPSA-N 2 0 242.432 2.235 20 0 BEADRP COc1ccc([C@H](C)[NH2+][C@H]2CC[C@H](C[NH3+])C2)cc1 ZINC000423485678 387330948 /nfs/dbraw/zinc/33/09/48/387330948.db2.gz BCPAZBSMWHBQTO-OBJOEFQTSA-N 2 0 248.370 2.473 20 0 BEADRP C(C[NH2+][C@@H]1CCC12CCC2)C[C@H]1CCC[NH2+]1 ZINC000423487220 387333241 /nfs/dbraw/zinc/33/32/41/387333241.db2.gz TYJQAOGPUSEAFD-CHWSQXEVSA-N 2 0 222.376 2.441 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[C@@H](C[NH3+])C1)c1ccco1 ZINC000423488894 387334218 /nfs/dbraw/zinc/33/42/18/387334218.db2.gz FJLDNGZDHUBVFO-AXFHLTTASA-N 2 0 208.305 2.058 20 0 BEADRP C[C@@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1ccco1 ZINC000423491529 387335148 /nfs/dbraw/zinc/33/51/48/387335148.db2.gz ZINZNJSQJBQWPT-NEPJUHHUSA-N 2 0 222.332 2.462 20 0 BEADRP COc1ccccc1[C@H](C)[NH2+][C@H]1CC[C@H](C[NH3+])C1 ZINC000423491650 387335748 /nfs/dbraw/zinc/33/57/48/387335748.db2.gz KEJGVJJCBAPXEL-AVGNSLFASA-N 2 0 248.370 2.473 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H](C[NH3+])C1)c1ccccc1 ZINC000423492119 387336311 /nfs/dbraw/zinc/33/63/11/387336311.db2.gz LVGSUIXIWBTEQZ-OUCADQQQSA-N 2 0 218.344 2.465 20 0 BEADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@H]2CCCC23CCC3)C1 ZINC000423500825 387339722 /nfs/dbraw/zinc/33/97/22/387339722.db2.gz JARAHUCXPXDBSD-AGIUHOORSA-N 2 0 222.376 2.426 20 0 BEADRP CCc1cccnc1[C@H](C)[NH2+][C@H]1CC[C@@H](C[NH3+])C1 ZINC000423498712 387339878 /nfs/dbraw/zinc/33/98/78/387339878.db2.gz HGWGGFCQWYEMRW-SCRDCRAPSA-N 2 0 247.386 2.422 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C2(C3CC3)CC2)CN1C1CC1 ZINC000309805232 387344007 /nfs/dbraw/zinc/34/40/07/387344007.db2.gz RZQZBFHRVDTBAH-ZYHUDNBSSA-N 2 0 220.360 2.144 20 0 BEADRP C[C@@H]1OCC[C@H]1[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000423512545 387347491 /nfs/dbraw/zinc/34/74/91/387347491.db2.gz UYDRUEFHPVBLIC-CFVMTHIKSA-N 2 0 248.370 2.234 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+][C@H](C)C1C[NH2+]C1)CC2 ZINC000643468989 387424107 /nfs/dbraw/zinc/42/41/07/387424107.db2.gz WRQRVNYTXPVSDP-IAQYHMDHSA-N 2 0 230.355 2.180 20 0 BEADRP C[C@H](Cc1ccsc1)NCC[NH2+]C1CC1 ZINC000643506798 387461631 /nfs/dbraw/zinc/46/16/31/387461631.db2.gz IXQKHILPUDEKPH-SNVBAGLBSA-N 2 0 224.373 2.021 20 0 BEADRP CC(C)(C[NH2+][C@@H]1CCC[C@H]1[NH3+])[C@H]1CCCCO1 ZINC000643466638 387389190 /nfs/dbraw/zinc/38/91/90/387389190.db2.gz JYRJEMKWEAHLRI-JHJVBQTASA-N 2 0 240.391 2.051 20 0 BEADRP Cc1n[nH]cc1[C@@H](C)NC[C@H]([NH3+])c1ccccc1 ZINC000643508857 387499967 /nfs/dbraw/zinc/49/99/67/387499967.db2.gz JAPOXYAENZSWBM-YGRLFVJLSA-N 2 0 244.342 2.069 20 0 BEADRP C[C@@H](Cc1cccs1)[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000643509247 387506640 /nfs/dbraw/zinc/50/66/40/387506640.db2.gz NSOPNFDGPFUCEV-RYUDHWBXSA-N 2 0 238.400 2.268 20 0 BEADRP CC(C)OC1CCC([NH2+][C@H](C)C[C@@H](C)[NH3+])CC1 ZINC000643475974 387513966 /nfs/dbraw/zinc/51/39/66/387513966.db2.gz ZFPITISCIWAIKN-IWMBGFJWSA-N 2 0 242.407 2.438 20 0 BEADRP C[NH+](C)CCC[NH2+][C@@H](C1CC1)C1CCC1 ZINC000324757235 387522251 /nfs/dbraw/zinc/52/22/51/387522251.db2.gz WNGCNNQPZKMRSF-CYBMUJFWSA-N 2 0 210.365 2.106 20 0 BEADRP CC[N@@H+]1CC[C@@H](N(C)CC2(F)CC2)C[C@@H]1C ZINC000527219147 387538873 /nfs/dbraw/zinc/53/88/73/387538873.db2.gz IHRZLMUDOXDWIL-NWDGAFQWSA-N 2 0 228.355 2.293 20 0 BEADRP Cc1occc1C[NH2+][C@H]1CCCC[C@H]1C[NH3+] ZINC000643472174 387485692 /nfs/dbraw/zinc/48/56/92/387485692.db2.gz DQAIPMFLCVLQQC-AAEUAGOBSA-N 2 0 222.332 2.195 20 0 BEADRP c1ccc2c(c1)CCC[C@@H]([NH2+]CCNC1CC1)C2 ZINC000643507467 387486062 /nfs/dbraw/zinc/48/60/62/387486062.db2.gz FQDUKGLLNBOBOJ-MRXNPFEDSA-N 2 0 244.382 2.276 20 0 BEADRP COc1cccc(C[C@H]2CCC[N@@H+]2CCC[NH3+])c1 ZINC000516258533 387490283 /nfs/dbraw/zinc/49/02/83/387490283.db2.gz GWKYWBZMIUFIMJ-CQSZACIVSA-N 2 0 248.370 2.051 20 0 BEADRP CCCCOCC[N@H+](C)[C@H]1CCN(C)[C@H](C)C1 ZINC000362184823 387581562 /nfs/dbraw/zinc/58/15/62/387581562.db2.gz JOVWSNCNMZCIIH-KGLIPLIRSA-N 2 0 242.407 2.218 20 0 BEADRP C[C@@H]1CCCC[C@@H]1OCC[NH2+][C@H]1CCC[C@@H]1[NH3+] ZINC000422714010 387628527 /nfs/dbraw/zinc/62/85/27/387628527.db2.gz QGEGGHFBIAPBHZ-RFGFWPKPSA-N 2 0 240.391 2.051 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+][C@H](C)Cc1cccs1 ZINC000643511615 387593409 /nfs/dbraw/zinc/59/34/09/387593409.db2.gz LEVINDVWEQCGQJ-PWSUYJOCSA-N 2 0 226.389 2.252 20 0 BEADRP C[C@@H]1CCCC[C@@H]1OCC[NH2+][C@@H]1CCC[C@H]1[NH3+] ZINC000422714012 387628728 /nfs/dbraw/zinc/62/87/28/387628728.db2.gz QGEGGHFBIAPBHZ-SYQHCUMBSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H]1CCc2c1cc(F)cc2F ZINC000643514847 387599824 /nfs/dbraw/zinc/59/98/24/387599824.db2.gz QHBQOCDLMILPKE-OQPBUACISA-N 2 0 240.297 2.137 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@@H]1CCCc2ccccc2C1 ZINC000643514877 387600066 /nfs/dbraw/zinc/60/00/66/387600066.db2.gz AAMLCFNWNFZBEO-SWLSCSKDSA-N 2 0 232.371 2.118 20 0 BEADRP c1ccc(CCC[NH+]2CCC3(CC[NH2+]3)CC2)cc1 ZINC000422636377 387608872 /nfs/dbraw/zinc/60/88/72/387608872.db2.gz NAAUPMBIZFWIKR-UHFFFAOYSA-N 2 0 244.382 2.447 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CCc1c(F)cccc1F ZINC000422698497 387616491 /nfs/dbraw/zinc/61/64/91/387616491.db2.gz ZOAKKOKODOSFJI-SNVBAGLBSA-N 2 0 242.313 2.224 20 0 BEADRP C[C@@H]1CCCC[C@H]1OCCN1CCC[C@@H]1C[NH3+] ZINC000430593104 387629454 /nfs/dbraw/zinc/62/94/54/387629454.db2.gz DDPJCMFQLQAVTR-MGPQQGTHSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@@H]([NH2+]C1[C@H](C)CCC[C@H]1C)C1C[NH2+]C1 ZINC000422703567 387617763 /nfs/dbraw/zinc/61/77/63/387617763.db2.gz NJGFLXOERIIELJ-GMTAPVOTSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCCC[C@H]1C)C1C[NH2+]C1 ZINC000422707166 387620035 /nfs/dbraw/zinc/62/00/35/387620035.db2.gz VUZMJWPHNPWNBX-WOPDTQHZSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]([NH3+])[C@@H](Cc1ccccc1)[NH2+]CC1CCC1 ZINC000422713614 387625784 /nfs/dbraw/zinc/62/57/84/387625784.db2.gz KDJNFCKWHJNZBP-IUODEOHRSA-N 2 0 232.371 2.335 20 0 BEADRP C[C@@H](Cc1cccs1)[NH2+]C[C@@H]([NH3+])C1CC1 ZINC000643516560 387627530 /nfs/dbraw/zinc/62/75/30/387627530.db2.gz SBOJZXAVVLYRSO-JOYOIKCWSA-N 2 0 224.373 2.006 20 0 BEADRP CC[C@@H]([NH2+]CCCC[NH3+])c1ccc(OC)cc1 ZINC000037714970 387566134 /nfs/dbraw/zinc/56/61/34/387566134.db2.gz CPEJORLNGMIUOQ-CQSZACIVSA-N 2 0 236.359 2.475 20 0 BEADRP Clc1cnccc1NCCN1CC=CCC1 ZINC000280185765 387570783 /nfs/dbraw/zinc/57/07/83/387570783.db2.gz IIYWZMLUXFSAEJ-UHFFFAOYSA-N 2 0 237.734 2.409 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@H](CN(C)C)c1ccccc1 ZINC000336789915 387575399 /nfs/dbraw/zinc/57/53/99/387575399.db2.gz KDUGFJDPLSSHSZ-DZGCQCFKSA-N 2 0 249.402 2.006 20 0 BEADRP C[NH2+]C[C@@H]1CCC[N@H+](CCc2ccc(C)cc2)C1 ZINC000430605605 387632778 /nfs/dbraw/zinc/63/27/78/387632778.db2.gz STFGTPOTJXOQON-INIZCTEOSA-N 2 0 246.398 2.469 20 0 BEADRP C[C@H]([NH2+]Cc1cccc(Cl)c1)C1C[NH2+]C1 ZINC000422727090 387635952 /nfs/dbraw/zinc/63/59/52/387635952.db2.gz GMEQEZGRPLYCGR-VIFPVBQESA-N 2 0 224.735 2.038 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@@H](C)[C@H]1C)C1C[NH2+]C1 ZINC000422729330 387638624 /nfs/dbraw/zinc/63/86/24/387638624.db2.gz KMXFUSMUUJSPGA-DCQANWLSSA-N 2 0 210.365 2.009 20 0 BEADRP CCCCOCCC[NH2+][C@H]1CC[NH2+]CC[C@@H]1C ZINC000422729952 387638876 /nfs/dbraw/zinc/63/88/76/387638876.db2.gz LQJZSTSWDZOCRX-KBPBESRZSA-N 2 0 242.407 2.171 20 0 BEADRP CC[C@@H]([NH2+]CC1CCSCC1)[C@@H]1CCC[NH2+]1 ZINC000422735752 387643567 /nfs/dbraw/zinc/64/35/67/387643567.db2.gz VCVVOVZHUHYANH-OLZOCXBDSA-N 2 0 242.432 2.250 20 0 BEADRP C[C@H]([NH2+]CCC[NH+]1CCCC1)[C@@H]1C[C@H]1C1CC1 ZINC000527632498 387643833 /nfs/dbraw/zinc/64/38/33/387643833.db2.gz PCDGFTIXOITWMX-QEJZJMRPSA-N 2 0 236.403 2.497 20 0 BEADRP CCCCOCCC[NH2+][C@H]1CCCCC[C@H]1[NH3+] ZINC000422737300 387646067 /nfs/dbraw/zinc/64/60/67/387646067.db2.gz XFRKEXXYIDOSAV-KGLIPLIRSA-N 2 0 242.407 2.443 20 0 BEADRP CO[C@H](C[NH2+][C@@H]1CCC[C@@H]1C[NH3+])c1ccccc1 ZINC000422738670 387646368 /nfs/dbraw/zinc/64/63/68/387646368.db2.gz JSLIVWWHKWPRQL-RBSFLKMASA-N 2 0 248.370 2.091 20 0 BEADRP Cc1ccccc1[C@@H](C)[NH2+][C@H](C)C1C[NH2+]C1 ZINC000422745571 387648036 /nfs/dbraw/zinc/64/80/36/387648036.db2.gz MHLBHSKMWQOJKA-VXGBXAGGSA-N 2 0 218.344 2.254 20 0 BEADRP CCOc1ccccc1C[NH2+][C@@H]1CCC[C@@H]1C[NH3+] ZINC000422740518 387648792 /nfs/dbraw/zinc/64/87/92/387648792.db2.gz NQZNOJUCUCTGGG-TZMCWYRMSA-N 2 0 248.370 2.302 20 0 BEADRP Cc1ccccc1C[C@@H](C)[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000422746494 387650267 /nfs/dbraw/zinc/65/02/67/387650267.db2.gz WQWNPQJRPCZTOK-OLZOCXBDSA-N 2 0 232.371 2.124 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2ccnc(C)c2)C1 ZINC000527643838 387652236 /nfs/dbraw/zinc/65/22/36/387652236.db2.gz CZPGKYDOSBFMDS-OAHLLOKOSA-N 2 0 247.386 2.212 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]CCc1ccccc1 ZINC000422748876 387653121 /nfs/dbraw/zinc/65/31/21/387653121.db2.gz WOEOOLOKOBTHLC-CABCVRRESA-N 2 0 232.371 2.479 20 0 BEADRP Cc1ccccc1CC[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000422750301 387655109 /nfs/dbraw/zinc/65/51/09/387655109.db2.gz CRBRTTXFYVGPQF-XYPWUTKMSA-N 2 0 244.382 2.410 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CCSc1ccccc1 ZINC000422756380 387657822 /nfs/dbraw/zinc/65/78/22/387657822.db2.gz CHLLERLFWYRZCJ-NEPJUHHUSA-N 2 0 238.400 2.494 20 0 BEADRP COc1ccccc1[C@H](C)[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000422753920 387658479 /nfs/dbraw/zinc/65/84/79/387658479.db2.gz JATDGUDWOBOXPK-SRVKXCTJSA-N 2 0 236.359 2.472 20 0 BEADRP CS[C@@H]1CCC[C@H]([NH2+][C@H](C)C[C@@H](C)[NH3+])C1 ZINC000422754792 387658495 /nfs/dbraw/zinc/65/84/95/387658495.db2.gz GENZUGMIJVDXRP-WISYIIOYSA-N 2 0 230.421 2.376 20 0 BEADRP C[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)[C@@H]1C[C@H]1C1CC1 ZINC000527686844 387658435 /nfs/dbraw/zinc/65/84/35/387658435.db2.gz XTGPEDRPGKZJEF-UGFHNGPFSA-N 2 0 234.387 2.273 20 0 BEADRP Cc1ccc(OCC[NH2+][C@@H](C)C[C@H](C)[NH3+])cc1 ZINC000422753889 387658531 /nfs/dbraw/zinc/65/85/31/387658531.db2.gz IYUAUAYUFSUAAD-STQMWFEESA-N 2 0 236.359 2.089 20 0 BEADRP CS[C@@H]1CCC[C@@H]([NH2+][C@@H](C)[C@H]2CCC[NH2+]2)C1 ZINC000422758842 387660175 /nfs/dbraw/zinc/66/01/75/387660175.db2.gz KDMVPOLFLCCCOR-UMSGYPCISA-N 2 0 242.432 2.391 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CCSc1ccccc1 ZINC000422756382 387661260 /nfs/dbraw/zinc/66/12/60/387661260.db2.gz CHLLERLFWYRZCJ-RYUDHWBXSA-N 2 0 238.400 2.494 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCc2nc[nH]c2C1)[C@@H]1C[C@H]1C1CC1 ZINC000527714008 387670152 /nfs/dbraw/zinc/67/01/52/387670152.db2.gz YDJWVYMNYCHPOS-IXOXFDKPSA-N 2 0 245.370 2.291 20 0 BEADRP COc1cccc(C[NH2+][C@@H]2CC[NH2+]CC[C@H]2C)c1 ZINC000422774451 387672439 /nfs/dbraw/zinc/67/24/39/387672439.db2.gz XBHIAIISRPOCHZ-IUODEOHRSA-N 2 0 248.370 2.173 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H](C)C(C)C)[C@@H]1CCC[NH2+]1 ZINC000422774633 387673432 /nfs/dbraw/zinc/67/34/32/387673432.db2.gz XURLALZVJHHOEE-UPJWGTAASA-N 2 0 212.381 2.399 20 0 BEADRP COc1cc(CC[NH2+][C@H]2CCC[C@H]2[NH3+])ccc1C ZINC000422775113 387673497 /nfs/dbraw/zinc/67/34/97/387673497.db2.gz ACSQLWNKLLLWRN-KGLIPLIRSA-N 2 0 248.370 2.016 20 0 BEADRP Cc1ccccc1O[C@H](C)C[NH2+][C@@H]1CCC[C@@H]1[NH3+] ZINC000422795546 387696034 /nfs/dbraw/zinc/69/60/34/387696034.db2.gz VYCUWKIIKOHHGF-HZSPNIEDSA-N 2 0 248.370 2.232 20 0 BEADRP COc1ccc([C@H](C)[NH2+][C@@H](C)C[C@H](C)[NH3+])cc1 ZINC000422777271 387674299 /nfs/dbraw/zinc/67/42/99/387674299.db2.gz FGIVLPMDBJETIX-SRVKXCTJSA-N 2 0 236.359 2.472 20 0 BEADRP Cc1ccc(O[C@H](C)C[NH2+][C@H]2CCC[C@@H]2[NH3+])cc1 ZINC000422781117 387681794 /nfs/dbraw/zinc/68/17/94/387681794.db2.gz DREJBZWSMXWKBY-SNPRPXQTSA-N 2 0 248.370 2.232 20 0 BEADRP CCc1ccc(C[NH2+][C@H](C)C2C[NH2+]C2)s1 ZINC000422862939 387745209 /nfs/dbraw/zinc/74/52/09/387745209.db2.gz OFUOKRILKQUEIB-SECBINFHSA-N 2 0 224.373 2.008 20 0 BEADRP CO[C@H](C)[C@H](C)[NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000128532058 387749545 /nfs/dbraw/zinc/74/95/45/387749545.db2.gz YETHDJPOROILNJ-WDEREUQCSA-N 2 0 242.407 2.309 20 0 BEADRP CO[C@H](C)[C@H](C)[NH2+]CCC[N@@H+]1CCCC[C@@H]1C ZINC000128554177 387750015 /nfs/dbraw/zinc/75/00/15/387750015.db2.gz IJROWCHYEGUBNK-MELADBBJSA-N 2 0 242.407 2.264 20 0 BEADRP CC[C@H]([NH2+]C[C@H]1CCCS1)[C@@H]1CCC[NH2+]1 ZINC000422871572 387750559 /nfs/dbraw/zinc/75/05/59/387750559.db2.gz DCYXRKPXEYVVBR-WOPDTQHZSA-N 2 0 228.405 2.002 20 0 BEADRP COc1cc(C)ccc1C[NH2+][C@H](C)C[C@H](C)[NH3+] ZINC000422872781 387751915 /nfs/dbraw/zinc/75/19/15/387751915.db2.gz IPRFMBCYLIISRA-NWDGAFQWSA-N 2 0 236.359 2.219 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[C@H]2CCC[C@H]2C1 ZINC000422796204 387697844 /nfs/dbraw/zinc/69/78/44/387697844.db2.gz XSIHVGSLRODTEE-ITGHMWBKSA-N 2 0 222.376 2.425 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@H]2CCC[C@H]2C1)C1C[NH2+]C1 ZINC000422796286 387699813 /nfs/dbraw/zinc/69/98/13/387699813.db2.gz YCHCPNNDFGWCME-KZVDOYCCSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@@H]1CCc2ccccc21 ZINC000422799509 387700011 /nfs/dbraw/zinc/70/00/11/387700011.db2.gz XCEPZKVALARYFS-MISXGVKJSA-N 2 0 218.344 2.389 20 0 BEADRP C[C@H]([NH2+]Cc1cc(F)cc(F)c1)[C@@H]1CC[NH2+]C1 ZINC000422803493 387701771 /nfs/dbraw/zinc/70/17/71/387701771.db2.gz IYNQLCLXSSNQEY-GXSJLCMTSA-N 2 0 240.297 2.052 20 0 BEADRP CO[C@H](C[NH2+][C@H]1CCCC[C@@H]1C[NH3+])C(C)(C)C ZINC000422801759 387702512 /nfs/dbraw/zinc/70/25/12/387702512.db2.gz AMYVHYXBLAGMMY-FRRDWIJNSA-N 2 0 242.407 2.155 20 0 BEADRP CCO[C@H](CC[NH2+][C@@H](C)[C@@H]1CCC[NH2+]1)C(C)C ZINC000422806076 387704579 /nfs/dbraw/zinc/70/45/79/387704579.db2.gz HTJWMEJMNJUYRE-MELADBBJSA-N 2 0 242.407 2.168 20 0 BEADRP CCO[C@@H](CC[NH2+][C@H](C)[C@@H]1CCC[NH2+]1)C(C)C ZINC000422806279 387704820 /nfs/dbraw/zinc/70/48/20/387704820.db2.gz HTJWMEJMNJUYRE-RDBSUJKOSA-N 2 0 242.407 2.168 20 0 BEADRP c1cc(CC[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)cs1 ZINC000422805551 387705097 /nfs/dbraw/zinc/70/50/97/387705097.db2.gz JKULZGQFELGILN-FUNVUKJBSA-N 2 0 236.384 2.163 20 0 BEADRP CCO[C@H](CC[NH2+][C@H](C)[C@@H]1CCC[NH2+]1)C(C)C ZINC000422806073 387706001 /nfs/dbraw/zinc/70/60/01/387706001.db2.gz HTJWMEJMNJUYRE-HZSPNIEDSA-N 2 0 242.407 2.168 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H](C)Cc1cccs1 ZINC000422809410 387707586 /nfs/dbraw/zinc/70/75/86/387707586.db2.gz PQLCXJTXHUUGCC-DCAQKATOSA-N 2 0 226.389 2.395 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CC1(c2ccccc2)CC1 ZINC000422810558 387708568 /nfs/dbraw/zinc/70/85/68/387708568.db2.gz NQJLNCDRCMEADT-CYBMUJFWSA-N 2 0 232.371 2.435 20 0 BEADRP CC[C@@H]1CCCC[C@H]1[NH2+][C@H](C)C1C[NH2+]C1 ZINC000422812164 387711785 /nfs/dbraw/zinc/71/17/85/387711785.db2.gz QBMLRZBXOLTTSF-NQBHXWOUSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH2+]CCC1CCCCC1)C1C[NH2+]C1 ZINC000422813951 387712231 /nfs/dbraw/zinc/71/22/31/387712231.db2.gz ZHXWNFVGQRITEM-NSHDSACASA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CCN(C)c1ccccc1 ZINC000422815304 387714087 /nfs/dbraw/zinc/71/40/87/387714087.db2.gz XHBNXGVCWJPDRI-CQSZACIVSA-N 2 0 249.402 2.230 20 0 BEADRP C[NH+](C)CCCC[NH2+]Cc1ccccc1F ZINC000045598298 387714334 /nfs/dbraw/zinc/71/43/34/387714334.db2.gz NJVWCSBBBLTHKX-UHFFFAOYSA-N 2 0 224.323 2.257 20 0 BEADRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]CC1(c2ccccc2)CC1 ZINC000422816193 387714714 /nfs/dbraw/zinc/71/47/14/387714714.db2.gz ZIENQSPDUCPRSK-UKRRQHHQSA-N 2 0 244.382 2.435 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCC[NH2+]CC1)C1CCSCC1 ZINC000643522570 387719806 /nfs/dbraw/zinc/71/98/06/387719806.db2.gz PNMJAISLZFFNCE-DGCLKSJQSA-N 2 0 242.432 2.250 20 0 BEADRP Cc1cncc([C@@H](C)[NH2+][C@@H]2CCC[NH2+]CC2)c1 ZINC000643523306 387720999 /nfs/dbraw/zinc/72/09/99/387720999.db2.gz ZYTZSDZAFUNRCJ-TZMCWYRMSA-N 2 0 233.359 2.183 20 0 BEADRP C1CC2(C1)CCC[C@H]2[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000643522769 387722072 /nfs/dbraw/zinc/72/20/72/387722072.db2.gz FFZMVVYBMYRENG-CHWSQXEVSA-N 2 0 222.376 2.441 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000643521885 387722555 /nfs/dbraw/zinc/72/25/55/387722555.db2.gz DUWRCDITCLYARB-QWHCGFSZSA-N 2 0 233.359 2.183 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCC[NH2+]CC1)[C@H]1C[C@@H]1C ZINC000643522969 387724437 /nfs/dbraw/zinc/72/44/37/387724437.db2.gz QSIIMYCWLIVITC-RNJOBUHISA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]([NH2+]CC(C)(C)c1ccccc1)C1C[NH2+]C1 ZINC000422831954 387725976 /nfs/dbraw/zinc/72/59/76/387725976.db2.gz KKKQHMGGZMBLFA-GFCCVEGCSA-N 2 0 232.371 2.162 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)[C@@H]2CC23CC3)C1 ZINC000527849183 387755591 /nfs/dbraw/zinc/75/55/91/387755591.db2.gz KSDOVBIZQVIOMC-UPJWGTAASA-N 2 0 222.376 2.106 20 0 BEADRP C[C@H](Cc1ccncc1)[NH2+][C@@H](C)CCCC[NH3+] ZINC000422835137 387728559 /nfs/dbraw/zinc/72/85/59/387728559.db2.gz IJROUFDVHPIASO-QWHCGFSZSA-N 2 0 235.375 2.120 20 0 BEADRP Cc1cc(C[NH2+][C@@H](C)C[C@H](C)[NH3+])ccc1F ZINC000422789685 387730369 /nfs/dbraw/zinc/73/03/69/387730369.db2.gz BKZLHXBQMLPSON-QWRGUYRKSA-N 2 0 224.323 2.350 20 0 BEADRP C[NH+](C)CC1CC[NH+](CC2CCC2)CC1 ZINC000441197293 387735612 /nfs/dbraw/zinc/73/56/12/387735612.db2.gz MEHQKLXQNLNANT-UHFFFAOYSA-N 2 0 210.365 2.060 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@@H]2CCCc3cccnc32)C1 ZINC000643524091 387736585 /nfs/dbraw/zinc/73/65/85/387736585.db2.gz HDHFVTKIZIWUNC-MGPQQGTHSA-N 2 0 245.370 2.319 20 0 BEADRP Cc1ccc([C@H](C)[NH2+][C@@H]2CC[NH2+]C[C@H]2C)c(C)n1 ZINC000643524914 387740175 /nfs/dbraw/zinc/74/01/75/387740175.db2.gz WXBPPUUHUSJOEW-RIEGTJTDSA-N 2 0 247.386 2.347 20 0 BEADRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)[C@@H]1CC12CC2 ZINC000527905331 387762734 /nfs/dbraw/zinc/76/27/34/387762734.db2.gz NJIRALPBUZSAAA-WYTNZGFTSA-N 2 0 234.387 2.390 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCC[NH2+]CC1)c1cccc(O)c1 ZINC000129104576 387763459 /nfs/dbraw/zinc/76/34/59/387763459.db2.gz KGVWOCBPVUBFIF-DGCLKSJQSA-N 2 0 234.343 2.185 20 0 BEADRP C[C@H]([NH3+])C[NH2+][C@H]1CC[C@@](C)(c2ccccc2)C1 ZINC000643527910 387764093 /nfs/dbraw/zinc/76/40/93/387764093.db2.gz VFOQJTGRWZRDLW-AEGPPILISA-N 2 0 232.371 2.434 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCC[NH2+]CC1)c1cccc(O)c1 ZINC000129104956 387764277 /nfs/dbraw/zinc/76/42/77/387764277.db2.gz KGVWOCBPVUBFIF-YPMHNXCESA-N 2 0 234.343 2.185 20 0 BEADRP Cc1ccc([C@H]([NH2+]C[C@H](C)[NH3+])C2CC2)cc1 ZINC000643528246 387767040 /nfs/dbraw/zinc/76/70/40/387767040.db2.gz FZFFWKRAPAWVCP-FZMZJTMJSA-N 2 0 218.344 2.383 20 0 BEADRP C[C@H]([NH3+])C[NH2+][C@@H]1CC[C@@H](Cc2ccccc2)C1 ZINC000643527698 387767668 /nfs/dbraw/zinc/76/76/68/387767668.db2.gz RFJWEQKFZFNMTM-AEGPPILISA-N 2 0 232.371 2.335 20 0 BEADRP CCCOc1ccc(C[NH2+][C@H](C)C2C[NH2+]C2)cc1 ZINC000422904085 387767618 /nfs/dbraw/zinc/76/76/18/387767618.db2.gz WWWCVADSULTVNK-GFCCVEGCSA-N 2 0 248.370 2.173 20 0 BEADRP C[C@H](C[C@@H]1CCCO1)[NH2+][C@@H]1CCCC[C@@H]1C[NH3+] ZINC000422904443 387767827 /nfs/dbraw/zinc/76/78/27/387767827.db2.gz PYLOCCUTFQRFSC-YIYPIFLZSA-N 2 0 240.391 2.051 20 0 BEADRP CC[C@H](Cc1ccc(C)cc1)[NH2+]C[C@@H](C)[NH3+] ZINC000643528562 387768905 /nfs/dbraw/zinc/76/89/05/387768905.db2.gz LLLGZSHSIXNOJW-TZMCWYRMSA-N 2 0 220.360 2.253 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CCc2ccccc21 ZINC000422909135 387769116 /nfs/dbraw/zinc/76/91/16/387769116.db2.gz NKBGUJAIULGZMX-YUELXQCFSA-N 2 0 230.355 2.186 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCc2ccccc21)[C@@H]1CCC[NH2+]1 ZINC000422909008 387769737 /nfs/dbraw/zinc/76/97/37/387769737.db2.gz NITNSTQYKYTYMU-BJJXKVORSA-N 2 0 244.382 2.447 20 0 BEADRP CC(C)[C@H](Cc1ccc(F)cc1)[NH2+]C[C@H](C)[NH3+] ZINC000643528960 387772000 /nfs/dbraw/zinc/77/20/00/387772000.db2.gz RUJFKFLRNAUNRS-FZMZJTMJSA-N 2 0 238.350 2.330 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+]CCc1cc2ccccc2o1 ZINC000422915266 387773097 /nfs/dbraw/zinc/77/30/97/387773097.db2.gz AORKAWMXSKYFAF-UONOGXRCSA-N 2 0 244.338 2.445 20 0 BEADRP CC(C)[C@H]1OCCC[C@H]1C[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000422922009 387777710 /nfs/dbraw/zinc/77/77/10/387777710.db2.gz RPDWTFKZEJJSEC-XDQVBPFNSA-N 2 0 242.407 2.153 20 0 BEADRP CC(C)[C@H]1OCCC[C@@H]1C[NH2+][C@H](C)CCC[NH3+] ZINC000422924948 387778096 /nfs/dbraw/zinc/77/80/96/387778096.db2.gz ZKXOTTRFYYOXFF-MGPQQGTHSA-N 2 0 242.407 2.155 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@@H]1C1CCCCC1)C1C[NH2+]C1 ZINC000422922025 387778178 /nfs/dbraw/zinc/77/81/78/387778178.db2.gz PLIGPVUQYCPUPH-ZLKJLUDKSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H]([NH2+]C1(Cc2ccccc2)CCC1)C1C[NH2+]C1 ZINC000422960212 387812332 /nfs/dbraw/zinc/81/23/32/387812332.db2.gz VRVMVTGPVQISHI-ZDUSSCGKSA-N 2 0 244.382 2.349 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1C[C@H]1Cc1ccccc1 ZINC000422926613 387779303 /nfs/dbraw/zinc/77/93/03/387779303.db2.gz XBQPMZCSVZZFBH-XUWVNRHRSA-N 2 0 244.382 2.335 20 0 BEADRP CCCC1(C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)CC1 ZINC000422926981 387779741 /nfs/dbraw/zinc/77/97/41/387779741.db2.gz FJOBOLXNCGXCNS-FUNVUKJBSA-N 2 0 222.376 2.439 20 0 BEADRP Cc1ccc(CCC[NH2+][C@@H](C)C2C[NH2+]C2)c(C)c1 ZINC000643457125 387780400 /nfs/dbraw/zinc/78/04/00/387780400.db2.gz YVCZMUDOIYSEQU-AWEZNQCLSA-N 2 0 246.398 2.434 20 0 BEADRP CCC(CC)(CC)C[NH2+][C@H](C)C1C[NH2+]C1 ZINC000422931885 387780571 /nfs/dbraw/zinc/78/05/71/387780571.db2.gz YICZGDMTSZJAGW-LLVKDONJSA-N 2 0 212.381 2.400 20 0 BEADRP C1=CCC(C[NH2+]C2CC[NH+](CC3CC3)CC2)C1 ZINC000527944733 387781911 /nfs/dbraw/zinc/78/19/11/387781911.db2.gz PSJOQRLRMAQWDZ-UHFFFAOYSA-N 2 0 234.387 2.417 20 0 BEADRP CCC1(CC)[C@H]([NH2+][C@@H]2CCC[C@@H]2[NH3+])C[C@H]1OC ZINC000422937735 387783095 /nfs/dbraw/zinc/78/30/95/387783095.db2.gz KCKWSUJGTPKFFN-UMSGYPCISA-N 2 0 240.391 2.050 20 0 BEADRP Cc1cccc(C)c1CC[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000422934954 387783115 /nfs/dbraw/zinc/78/31/15/387783115.db2.gz GVNURYSEVMCWRE-ZDUSSCGKSA-N 2 0 232.371 2.043 20 0 BEADRP C[C@H]([NH2+]CCc1ccc(Cl)s1)C1C[NH2+]C1 ZINC000422944080 387785582 /nfs/dbraw/zinc/78/55/82/387785582.db2.gz RMCGEVDYVNSEAE-QMMMGPOBSA-N 2 0 244.791 2.142 20 0 BEADRP Cc1cccc(C)c1CC[NH2+][C@H]1CCC[C@@H]1[NH3+] ZINC000422945101 387785609 /nfs/dbraw/zinc/78/56/09/387785609.db2.gz UAKVLSMLBQBKPN-GJZGRUSLSA-N 2 0 232.371 2.315 20 0 BEADRP C[C@H](C[C@H]1CCCO1)[NH2+]C1CCC(C[NH3+])CC1 ZINC000422901672 387787045 /nfs/dbraw/zinc/78/70/45/387787045.db2.gz LMIISWKSJPZOSW-BLYZHGLHSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H]([NH3+])C[N@@H+]1CCC[C@H]1Cc1ccccc1 ZINC000442662741 387812763 /nfs/dbraw/zinc/81/27/63/387812763.db2.gz IEIHQQZPXRPMPT-OCCSQVGLSA-N 2 0 218.344 2.041 20 0 BEADRP CCC(CC)[NH2+]CCCN1CCCO[C@H](C)C1 ZINC000432423226 387788952 /nfs/dbraw/zinc/78/89/52/387788952.db2.gz IXVBDLDWHWWQAB-CYBMUJFWSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]C[C@H](C)Oc1ccccc1 ZINC000422981076 387792221 /nfs/dbraw/zinc/79/22/21/387792221.db2.gz NCNHMRNSTMPCDJ-STQMWFEESA-N 2 0 236.359 2.171 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+][C@H]1CC=CCC1 ZINC000422986708 387795025 /nfs/dbraw/zinc/79/50/25/387795025.db2.gz HENDSFOIGIUVQS-FRRDWIJNSA-N 2 0 208.349 2.073 20 0 BEADRP C[C@@H]([NH2+]CC1Cc2ccccc2C1)[C@@H]1CCC[NH2+]1 ZINC000422984763 387796587 /nfs/dbraw/zinc/79/65/87/387796587.db2.gz ZCVQFDBSNTYQHV-WBMJQRKESA-N 2 0 244.382 2.132 20 0 BEADRP CC[C@H]([NH2+]CCc1ccc(O)cc1)[C@@H]1CCC[NH2+]1 ZINC000422987970 387798617 /nfs/dbraw/zinc/79/86/17/387798617.db2.gz JOGSIWAEFCFPDA-GJZGRUSLSA-N 2 0 248.370 2.055 20 0 BEADRP CC[C@H]([NH2+]CCCC(F)(F)F)[C@@H]1CCC[NH2+]1 ZINC000422964301 387813165 /nfs/dbraw/zinc/81/31/65/387813165.db2.gz IFOGIGILMRDHFV-UWVGGRQHSA-N 2 0 238.297 2.449 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CCC[C@@H]1CCCC[C@@H]1O ZINC000422991658 387800098 /nfs/dbraw/zinc/80/00/98/387800098.db2.gz PYPCZMNEYKYUNQ-XUXIUFHCSA-N 2 0 242.407 2.033 20 0 BEADRP CCOc1cccc(CC[NH2+][C@@H]2CCC[C@@H]2[NH3+])c1 ZINC000422991762 387800502 /nfs/dbraw/zinc/80/05/02/387800502.db2.gz BOFBPJDKMPRAEN-LSDHHAIUSA-N 2 0 248.370 2.097 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]C[C@H]1[C@@H]2c3ccccc3C[C@H]12 ZINC000422992866 387800950 /nfs/dbraw/zinc/80/09/50/387800950.db2.gz RVAXOEOZMRQXMD-QSDOXLQRSA-N 2 0 244.382 2.288 20 0 BEADRP CSc1cc(C[NH2+][C@H](C)CCC[NH3+])ccn1 ZINC000422991703 387801065 /nfs/dbraw/zinc/80/10/65/387801065.db2.gz PDGNRALEPXAOTR-SNVBAGLBSA-N 2 0 239.388 2.021 20 0 BEADRP CC(C)=CC[N@@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000152484203 387801878 /nfs/dbraw/zinc/80/18/78/387801878.db2.gz ZRSQSFWIABCRTH-ZDUSSCGKSA-N 2 0 210.365 2.226 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]C[C@@H]1CCc2ccccc2C1 ZINC000643478046 387802198 /nfs/dbraw/zinc/80/21/98/387802198.db2.gz PURWDMFUIIFXDD-DAXOMENPSA-N 2 0 244.382 2.261 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CCCc1ccccn1 ZINC000422996350 387802990 /nfs/dbraw/zinc/80/29/90/387802990.db2.gz LLXJKCJVOPHZEX-ZDUSSCGKSA-N 2 0 235.375 2.121 20 0 BEADRP COc1cc(C)cc(C[NH2+][C@H]2CCC[C@@H]2C[NH3+])c1 ZINC000423001382 387805470 /nfs/dbraw/zinc/80/54/70/387805470.db2.gz IBGOSYUQRCLNAX-HIFRSBDPSA-N 2 0 248.370 2.221 20 0 BEADRP COc1cccc(CCC[NH2+][C@H]2CCC[C@H]2[NH3+])c1 ZINC000422949481 387807579 /nfs/dbraw/zinc/80/75/79/387807579.db2.gz VGFBBEZNNWKGEH-CABCVRRESA-N 2 0 248.370 2.097 20 0 BEADRP Cc1ccc2c(c1C)OC[C@@H]2[NH2+][C@@H](C)C[C@@H](C)[NH3+] ZINC000422958083 387809017 /nfs/dbraw/zinc/80/90/17/387809017.db2.gz OMXXVVQNTPRNMA-SUNKGSAMSA-N 2 0 248.370 2.452 20 0 BEADRP C[C@@H]([NH2+][C@@H]1c2ccccc2C[C@H]1C)C1C[NH2+]C1 ZINC000422958050 387809079 /nfs/dbraw/zinc/80/90/79/387809079.db2.gz OHICMUZESSMQHN-HFAKWTLXSA-N 2 0 230.355 2.117 20 0 BEADRP C[C@H]([NH2+][C@H]1c2ccccc2C[C@H]1C)C1C[NH2+]C1 ZINC000422958051 387809807 /nfs/dbraw/zinc/80/98/07/387809807.db2.gz OHICMUZESSMQHN-JRPNMDOOSA-N 2 0 230.355 2.117 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+]C[C@H](C)[NH3+])[C@@H](C)C2 ZINC000643526605 387757185 /nfs/dbraw/zinc/75/71/85/387757185.db2.gz CCGUSYWKKQWRJA-COPLHBTASA-N 2 0 218.344 2.165 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+]C/C=C\c1ccccc1 ZINC000422973229 387821831 /nfs/dbraw/zinc/82/18/31/387821831.db2.gz BLSSYDOQGOAGDL-AJHXJQRKSA-N 2 0 248.370 2.043 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CCC[C@H]([NH+](C)C)CC1 ZINC000432796995 387821928 /nfs/dbraw/zinc/82/19/28/387821928.db2.gz JMJIMIQSQHVICG-UPJWGTAASA-N 2 0 210.365 2.059 20 0 BEADRP CC[C@@H]([NH2+]C[C@H]1CC=CCC1)[C@@H]1CCC[NH2+]1 ZINC000422974822 387822901 /nfs/dbraw/zinc/82/29/01/387822901.db2.gz RTZNDSAXOYMLDI-MJBXVCDLSA-N 2 0 222.376 2.463 20 0 BEADRP CC[C@H]([NH2+]C[C@H]1CC=CCC1)[C@@H]1CCC[NH2+]1 ZINC000422974820 387823229 /nfs/dbraw/zinc/82/32/29/387823229.db2.gz RTZNDSAXOYMLDI-IHRRRGAJSA-N 2 0 222.376 2.463 20 0 BEADRP CC(C)[NH+](CCCN[C@H](C)C[C@H](C)[NH3+])C(C)C ZINC000423003551 387825767 /nfs/dbraw/zinc/82/57/67/387825767.db2.gz HWCOTVPWYGAWOM-UONOGXRCSA-N 2 0 243.439 2.211 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CC1Cc2ccccc2C1 ZINC000422976014 387826952 /nfs/dbraw/zinc/82/69/52/387826952.db2.gz CRWOEWDARUYNML-NWDGAFQWSA-N 2 0 232.371 2.117 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)C[C@H](C)[NH3+])[C@H]1COc2ccccc21 ZINC000423007236 387829237 /nfs/dbraw/zinc/82/92/37/387829237.db2.gz XDHHXSSSFNDMMH-CIQGVGRVSA-N 2 0 248.370 2.267 20 0 BEADRP CC[NH+]1CCC([NH2+]C/C=C/c2ccncc2)CC1 ZINC000486933751 387831012 /nfs/dbraw/zinc/83/10/12/387831012.db2.gz AOJNLXPEMNCZBP-ONEGZZNKSA-N 2 0 245.370 2.169 20 0 BEADRP Cc1ccc(CC[C@@H](C)[NH2+][C@H](C)C2C[NH2+]C2)o1 ZINC000423009908 387834765 /nfs/dbraw/zinc/83/47/65/387834765.db2.gz WJZPCNHYAWHOJB-ZYHUDNBSSA-N 2 0 236.359 2.107 20 0 BEADRP CC(C)CSCCC[NH2+][C@H](C)C[C@@H](C)[NH3+] ZINC000423014868 387838335 /nfs/dbraw/zinc/83/83/35/387838335.db2.gz PYEQKZWFPSIPSP-VXGBXAGGSA-N 2 0 232.437 2.481 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]CCC1Cc2ccccc2C1 ZINC000423016291 387838531 /nfs/dbraw/zinc/83/85/31/387838531.db2.gz SRZBDSFWJZUVOT-HZPDHXFCSA-N 2 0 244.382 2.261 20 0 BEADRP CS[C@H](C[NH2+][C@@H](C)[C@H]1CCC[NH2+]1)C(C)(C)C ZINC000423025906 387843446 /nfs/dbraw/zinc/84/34/46/387843446.db2.gz AGIKMNRPPJPYJF-QJPTWQEYSA-N 2 0 244.448 2.494 20 0 BEADRP Cc1csc([C@H](C)C[NH2+][C@@H]2CCC[C@@H]2[NH3+])n1 ZINC000423034320 387849038 /nfs/dbraw/zinc/84/90/38/387849038.db2.gz HSNPNTIUTDYMRN-DVVUODLYSA-N 2 0 239.388 2.024 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@@H]2CCC[C@H]2[NH3+])C[C@@H]1C ZINC000423033767 387849362 /nfs/dbraw/zinc/84/93/62/387849362.db2.gz GVVMRKSATKDHTQ-KSSYENDESA-N 2 0 210.365 2.281 20 0 BEADRP C[NH+](C)CCC[N@H+](C)CC1Cc2ccccc2C1 ZINC000582578267 387851300 /nfs/dbraw/zinc/85/13/00/387851300.db2.gz UMYFLVQKDFFZDT-UHFFFAOYSA-N 2 0 246.398 2.285 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CCC[C@H]1CCCCO1 ZINC000423035474 387851308 /nfs/dbraw/zinc/85/13/08/387851308.db2.gz JOCURWWEOUFBHA-RWMBFGLXSA-N 2 0 228.380 2.051 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CCCCO1)[C@@H]1CCCC[NH2+]1 ZINC000423039216 387853401 /nfs/dbraw/zinc/85/34/01/387853401.db2.gz DZGDQUWOSNSQHS-MCIONIFRSA-N 2 0 240.391 2.066 20 0 BEADRP CC(C)C[C@@H]1OCCC[C@@H]1[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000423047227 387858079 /nfs/dbraw/zinc/85/80/79/387858079.db2.gz FWGQGJZBAYYADF-XUXIUFHCSA-N 2 0 242.407 2.296 20 0 BEADRP CSCCCCC[NH2+][C@H]1CNCC[C@@H]1C ZINC000423049091 387858290 /nfs/dbraw/zinc/85/82/90/387858290.db2.gz IVVXBFMYAZZTCX-RYUDHWBXSA-N 2 0 230.421 2.107 20 0 BEADRP C[N@H+]1C[C@@H]2C[NH+](CC3CCCCCC3)C[C@@H]2C1 ZINC000193630928 387858390 /nfs/dbraw/zinc/85/83/90/387858390.db2.gz MGEQRVDCKVUWTG-GASCZTMLSA-N 2 0 236.403 2.450 20 0 BEADRP CC(C)C[C@@H]1OCCC[C@H]1[NH2+][C@H](C)CCC[NH3+] ZINC000423052534 387859747 /nfs/dbraw/zinc/85/97/47/387859747.db2.gz QDUGJFOCHJOHBI-MCIONIFRSA-N 2 0 242.407 2.297 20 0 BEADRP C[C@H](CC(F)(F)F)[NH2+]C1CCC(C[NH3+])CC1 ZINC000423050508 387859755 /nfs/dbraw/zinc/85/97/55/387859755.db2.gz LYFCPYFGJFKTQV-XNWIYYODSA-N 2 0 238.297 2.434 20 0 BEADRP Cc1oc2ccccc2c1C[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000423052614 387860637 /nfs/dbraw/zinc/86/06/37/387860637.db2.gz QZZBNINFUSFCCS-JTQLQIEISA-N 2 0 244.338 2.439 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCCCC[C@H]1[NH3+])C(F)(F)F ZINC000423052224 387860691 /nfs/dbraw/zinc/86/06/91/387860691.db2.gz PFUSZPBAOHIJNZ-BBBLOLIVSA-N 2 0 238.297 2.434 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@H](C)CC(F)(F)F ZINC000423052977 387860707 /nfs/dbraw/zinc/86/07/07/387860707.db2.gz RQFZUBHUBXPZGM-XLPZGREQSA-N 2 0 212.259 2.043 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1cccc(O)c1 ZINC000643534946 387862016 /nfs/dbraw/zinc/86/20/16/387862016.db2.gz GEFTZIXJRFRUBN-SMDDNHRTSA-N 2 0 246.354 2.185 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)[C@@H]1C[C@@H]1C ZINC000643535361 387862505 /nfs/dbraw/zinc/86/25/05/387862505.db2.gz CGRGGSDWSCLXFU-QNWHQSFQSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@@H]2CCCCC[C@@H]2[NH3+])C1 ZINC000423059622 387864232 /nfs/dbraw/zinc/86/42/32/387864232.db2.gz GDFCTCYXBUHPPX-MROQNXINSA-N 2 0 210.365 2.425 20 0 BEADRP c1cc2c(o1)CCC[C@H]2[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000643535590 387864231 /nfs/dbraw/zinc/86/42/31/387864231.db2.gz NJEMWYNBWLKPQT-TZMCWYRMSA-N 2 0 246.354 2.389 20 0 BEADRP CC(C)C(C[NH2+][C@H](C)C1C[NH2+]C1)C(C)C ZINC000423073240 387874602 /nfs/dbraw/zinc/87/46/02/387874602.db2.gz RBCWLGHPGCXTGP-LLVKDONJSA-N 2 0 212.381 2.112 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@H]2CCCCC[C@@H]2[NH3+])C1 ZINC000423059623 387865583 /nfs/dbraw/zinc/86/55/83/387865583.db2.gz GDFCTCYXBUHPPX-VOAKCMCISA-N 2 0 210.365 2.425 20 0 BEADRP CC[C@@H]([NH2+][C@H]1CC12CC[NH2+]CC2)C1CCC1 ZINC000643535872 387865759 /nfs/dbraw/zinc/86/57/59/387865759.db2.gz KHVLXEPPCXGCNB-OLZOCXBDSA-N 2 0 222.376 2.297 20 0 BEADRP CC(C)C(C)(C)C[NH2+][C@H](C)C[C@H](C)[NH3+] ZINC000423060315 387866088 /nfs/dbraw/zinc/86/60/88/387866088.db2.gz OEJPINXTEWDOLP-WDEREUQCSA-N 2 0 200.370 2.384 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC[NH2+]CC[C@H]1C)c1ccncc1 ZINC000643460298 387874635 /nfs/dbraw/zinc/87/46/35/387874635.db2.gz NDMCWUSBDJAMGC-NFAWXSAZSA-N 2 0 247.386 2.163 20 0 BEADRP CC(C)[C@@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)C1CC1 ZINC000643536168 387867631 /nfs/dbraw/zinc/86/76/31/387867631.db2.gz RZSVDKBUFWMUBJ-CHWSQXEVSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1ccoc1 ZINC000643536164 387867942 /nfs/dbraw/zinc/86/79/42/387867942.db2.gz RZFBKWTVSKCGLS-CMPLNLGQSA-N 2 0 220.316 2.072 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1ccoc1 ZINC000643536167 387868011 /nfs/dbraw/zinc/86/80/11/387868011.db2.gz RZFBKWTVSKCGLS-ZYHUDNBSSA-N 2 0 220.316 2.072 20 0 BEADRP CC[C@@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1ccncc1 ZINC000643536622 387868543 /nfs/dbraw/zinc/86/85/43/387868543.db2.gz SWIKIIWLEGGYDI-KGLIPLIRSA-N 2 0 245.370 2.264 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC12CC[NH2+]CC2)C1CCCC1 ZINC000643536953 387869226 /nfs/dbraw/zinc/86/92/26/387869226.db2.gz XLZIJKNCTYMDDP-YPMHNXCESA-N 2 0 222.376 2.297 20 0 BEADRP C1[C@H]([NH2+][C@@H]2CCCC23CCC3)C12CC[NH2+]CC2 ZINC000643536676 387869357 /nfs/dbraw/zinc/86/93/57/387869357.db2.gz UVDZHYDGBXVWEJ-OLZOCXBDSA-N 2 0 234.387 2.441 20 0 BEADRP CCC(O)(CC)CC[NH2+][C@H]1CCCCC[C@@H]1[NH3+] ZINC000423065803 387869616 /nfs/dbraw/zinc/86/96/16/387869616.db2.gz CMMCAQKADDCQRT-STQMWFEESA-N 2 0 242.407 2.177 20 0 BEADRP Cc1cc(NC[C@@H]2CC[N@@H+]2C2CCCC2)cc[nH+]1 ZINC000528205917 387869914 /nfs/dbraw/zinc/86/99/14/387869914.db2.gz ATLFPJQGAODOMQ-HNNXBMFYSA-N 2 0 245.370 2.241 20 0 BEADRP CC(C)C(C[NH2+][C@@H]1CCC[C@H]1[NH3+])C(C)C ZINC000423068345 387870354 /nfs/dbraw/zinc/87/03/54/387870354.db2.gz JVCONBBQWJWBHW-CHWSQXEVSA-N 2 0 212.381 2.384 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]Cc1ccc2c(n1)CCCC2 ZINC000423072117 387871065 /nfs/dbraw/zinc/87/10/65/387871065.db2.gz GTMZUTZRMLZFNU-GFCCVEGCSA-N 2 0 247.386 2.177 20 0 BEADRP CC[C@@H]([NH2+]CCC(O)(CC)CC)[C@@H]1CCC[NH2+]1 ZINC000423069831 387871656 /nfs/dbraw/zinc/87/16/56/387871656.db2.gz MJPBPFRUOZOVEV-OLZOCXBDSA-N 2 0 242.407 2.048 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+]CCC1=CCCCC1 ZINC000422965122 387814543 /nfs/dbraw/zinc/81/45/43/387814543.db2.gz NTZKOFZSJAQXPX-QWHCGFSZSA-N 2 0 208.349 2.346 20 0 BEADRP COc1ccccc1C[C@@H]1CCCN1C[C@H](C)[NH3+] ZINC000442656101 387815316 /nfs/dbraw/zinc/81/53/16/387815316.db2.gz DOCQMWPUBFETBO-JSGCOSHPSA-N 2 0 248.370 2.049 20 0 BEADRP [NH3+][C@H]1CCCCC[C@@H]1[NH2+]CCc1ccccc1O ZINC000422966918 387815545 /nfs/dbraw/zinc/81/55/45/387815545.db2.gz AVQHWUUMFWRBSO-KBPBESRZSA-N 2 0 248.370 2.184 20 0 BEADRP COCC[C@H]([NH2+][C@@H](C)[C@H]1CCC[NH2+]1)C(C)(C)C ZINC000423105913 387890960 /nfs/dbraw/zinc/89/09/60/387890960.db2.gz CRCMPFXSYHMATJ-XQQFMLRXSA-N 2 0 242.407 2.168 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CC1(C(F)(F)F)CCC1 ZINC000423111863 387893729 /nfs/dbraw/zinc/89/37/29/387893729.db2.gz RABOSKXSZDCJKM-DTWKUNHWSA-N 2 0 238.297 2.434 20 0 BEADRP CC[C@@H]([NH2+][C@@H]1CCC1(C)C)[C@@H]1CCC[NH2+]1 ZINC000423111948 387895198 /nfs/dbraw/zinc/89/51/98/387895198.db2.gz RIXKGOXWWOSRCI-GRYCIOLGSA-N 2 0 210.365 2.295 20 0 BEADRP CCC(O)(CC)CC[NH2+]C1CCC(C[NH3+])CC1 ZINC000423074482 387875119 /nfs/dbraw/zinc/87/51/19/387875119.db2.gz UUIZDMYYOGLBRX-UHFFFAOYSA-N 2 0 242.407 2.035 20 0 BEADRP CCC(C)(C)C[NH2+][C@H]1CC[NH2+]CC[C@@H]1C ZINC000423076296 387877208 /nfs/dbraw/zinc/87/72/08/387877208.db2.gz QTMUIJWYCQLTQO-RYUDHWBXSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCC12CCCC2)[C@@H]1CCC[NH2+]1 ZINC000423075877 387877250 /nfs/dbraw/zinc/87/72/50/387877250.db2.gz PORCEYPISZYIFH-FRRDWIJNSA-N 2 0 222.376 2.439 20 0 BEADRP CC1(CC[NH2+][C@@H]2CCCC[C@H]2C[NH3+])CC1 ZINC000423083672 387878185 /nfs/dbraw/zinc/87/81/85/387878185.db2.gz GFYREANMORHCIA-NWDGAFQWSA-N 2 0 210.365 2.284 20 0 BEADRP CC1(CC[NH2+][C@@H]2CCCCC[C@H]2[NH3+])CC1 ZINC000423084726 387878266 /nfs/dbraw/zinc/87/82/66/387878266.db2.gz IQBRHWVEJROOBO-VXGBXAGGSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]Cc1ccc2ncccc2c1 ZINC000423081453 387879389 /nfs/dbraw/zinc/87/93/89/387879389.db2.gz BSBDNOKQTMGMFB-NEPJUHHUSA-N 2 0 243.354 2.450 20 0 BEADRP [NH3+]CCCC[NH2+][C@@H]1CCCc2ccc(O)cc21 ZINC000236213016 387879674 /nfs/dbraw/zinc/87/96/74/387879674.db2.gz JLIXVPVIPGHONA-CQSZACIVSA-N 2 0 234.343 2.098 20 0 BEADRP Cc1ncc([C@H](C)[NH2+][C@H](C)CCC[NH3+])s1 ZINC000643539247 387879752 /nfs/dbraw/zinc/87/97/52/387879752.db2.gz MRFIFUHUUVJZRO-BDAKNGLRSA-N 2 0 227.377 2.230 20 0 BEADRP C[C@@H]1C[C@H](C)[N@H+](CCC2CC[NH2+]CC2)C1 ZINC000157893529 387880964 /nfs/dbraw/zinc/88/09/64/387880964.db2.gz MCRPDVMSLZZPJJ-NEPJUHHUSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]([NH2+][C@H]1C[C@H](c2cccc(F)c2)C1)C1C[NH2+]C1 ZINC000423092381 387883777 /nfs/dbraw/zinc/88/37/77/387883777.db2.gz BRTRFWNZECHZAJ-IXPVHAAZSA-N 2 0 248.345 2.269 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CC[C@@H]1C1CC1 ZINC000423095866 387884302 /nfs/dbraw/zinc/88/43/02/387884302.db2.gz NHHROIYZSRSNOA-RFQIPJPRSA-N 2 0 222.376 2.282 20 0 BEADRP CC1(C)C(C[NH2+][C@@H]2CCC[C@H]2[NH3+])C1(C)C ZINC000423096402 387884502 /nfs/dbraw/zinc/88/45/02/387884502.db2.gz OUASHTSBMZFNSS-NXEZZACHSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CCCc1ccccc1F ZINC000423095432 387884907 /nfs/dbraw/zinc/88/49/07/387884907.db2.gz MDLLCPIJBMXXPA-RYUDHWBXSA-N 2 0 238.350 2.474 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC000423095821 387885419 /nfs/dbraw/zinc/88/54/19/387885419.db2.gz NBZPZLWTEIQICK-OUAUKWLOSA-N 2 0 232.318 2.139 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC(F)(F)C1)[C@@H]1CCC[NH2+]1 ZINC000423095210 387885426 /nfs/dbraw/zinc/88/54/26/387885426.db2.gz LQGHJTMTNXFDSL-DCAQKATOSA-N 2 0 232.318 2.152 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CC1C(C)(C)C1(C)C ZINC000423098909 387887175 /nfs/dbraw/zinc/88/71/75/387887175.db2.gz SXYGHVGSWXHETB-UWVGGRQHSA-N 2 0 212.381 2.384 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CCCC(F)(F)C1 ZINC000423103429 387889062 /nfs/dbraw/zinc/88/90/62/387889062.db2.gz AKLCYSLOVMEJNB-MXWKQRLJSA-N 2 0 232.318 2.281 20 0 BEADRP C[C@H]1CC[C@@H](C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000423101257 387889092 /nfs/dbraw/zinc/88/90/92/387889092.db2.gz VSAYZIWPVNFSRC-IZXDZPFWSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CCC1C[C@H](C)O[C@@H](C)C1 ZINC000423116314 387898803 /nfs/dbraw/zinc/89/88/03/387898803.db2.gz PIIZLFZBBGJJBT-AGIUHOORSA-N 2 0 242.407 2.297 20 0 BEADRP COCC[C@H]([NH2+][C@@H]1CCC[NH2+]CC1)C(C)(C)C ZINC000423117233 387899308 /nfs/dbraw/zinc/89/93/08/387899308.db2.gz UIRYAUYCLAEEGZ-OLZOCXBDSA-N 2 0 242.407 2.169 20 0 BEADRP COCC[C@H]([NH2+][C@H]1CCC[NH2+]CC1)C(C)(C)C ZINC000423117235 387899333 /nfs/dbraw/zinc/89/93/33/387899333.db2.gz UIRYAUYCLAEEGZ-STQMWFEESA-N 2 0 242.407 2.169 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CCC1C[C@@H](C)O[C@H](C)C1 ZINC000423118052 387900237 /nfs/dbraw/zinc/90/02/37/387900237.db2.gz YOTKNDDJHFAZQH-WUHRBBMRSA-N 2 0 242.407 2.296 20 0 BEADRP CO[C@H](C)[C@@H](C)[NH2+][C@@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000423125611 387904535 /nfs/dbraw/zinc/90/45/35/387904535.db2.gz AKZUMSHHSGBLFG-REWJHTLYSA-N 2 0 242.407 2.310 20 0 BEADRP C=Cc1ccc(CC[NH2+][C@@H](C)[C@H]2CC[NH2+]C2)cc1 ZINC000423125552 387905790 /nfs/dbraw/zinc/90/57/90/387905790.db2.gz ADXJHSFMMJABKE-BBRMVZONSA-N 2 0 244.382 2.460 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[C@@H](F)C1)[C@H]1CCCC[NH2+]1 ZINC000423129214 387907320 /nfs/dbraw/zinc/90/73/20/387907320.db2.gz QWFFHISOUWFSEM-FVCCEPFGSA-N 2 0 228.355 2.387 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CCCCC(F)(F)C1)C1C[NH2+]C1 ZINC000423130116 387907657 /nfs/dbraw/zinc/90/76/57/387907657.db2.gz MJDTVFHCZXTLHI-MNOVXSKESA-N 2 0 246.345 2.400 20 0 BEADRP COCC(C)(C)CCC[NH2+][C@H](C)[C@@H]1CCC[NH2+]1 ZINC000423129219 387907755 /nfs/dbraw/zinc/90/77/55/387907755.db2.gz QWITUOWATYYIQS-OLZOCXBDSA-N 2 0 242.407 2.169 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+][C@@H]1CC[C@@H](F)C1 ZINC000423132454 387908755 /nfs/dbraw/zinc/90/87/55/387908755.db2.gz UQESBBGVCMZKCG-KKOKHZNYSA-N 2 0 214.328 2.127 20 0 BEADRP Cc1cccc2c1OC[C@@H]([NH2+][C@H](C)CCC[NH3+])C2 ZINC000423133304 387909614 /nfs/dbraw/zinc/90/96/14/387909614.db2.gz CUFQCYWMCIIBJJ-OCCSQVGLSA-N 2 0 248.370 2.016 20 0 BEADRP COCC1(C[NH2+][C@@H](C)C[C@H](C)[NH3+])CCCCC1 ZINC000423134764 387912556 /nfs/dbraw/zinc/91/25/56/387912556.db2.gz FHDUTIUQXGPHAP-STQMWFEESA-N 2 0 242.407 2.299 20 0 BEADRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]C1CC(C(F)(F)F)C1 ZINC000423136860 387914671 /nfs/dbraw/zinc/91/46/71/387914671.db2.gz ZQEYQKSYSLWRNF-SEZDTBSWSA-N 2 0 236.281 2.044 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCCC1(C)C)C1C[NH2+]C1 ZINC000423135906 387914715 /nfs/dbraw/zinc/91/47/15/387914715.db2.gz OOWYJNXGPSXSFC-CMPLNLGQSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@H]([NH3+])[C@@H](Cc1ccccc1)[NH2+]CCCCF ZINC000423141733 387917444 /nfs/dbraw/zinc/91/74/44/387917444.db2.gz RNULSZPPQLVYBM-GXTWGEPZSA-N 2 0 238.350 2.284 20 0 BEADRP Cc1ccc(F)c(CC[NH2+][C@@H]2CCC[C@H]2[NH3+])c1 ZINC000423151387 387930223 /nfs/dbraw/zinc/93/02/23/387930223.db2.gz KCFFJHVMPJMJOC-ZIAGYGMSSA-N 2 0 236.334 2.146 20 0 BEADRP C[C@H]([NH2+]C1(Cc2ccc(F)cc2)CC1)C1C[NH2+]C1 ZINC000423155837 387934037 /nfs/dbraw/zinc/93/40/37/387934037.db2.gz LUAYFHSSZXUING-NSHDSACASA-N 2 0 248.345 2.098 20 0 BEADRP Cc1cccnc1CCC[NH2+][C@H]1CCC[C@H]1C[NH3+] ZINC000423155546 387934342 /nfs/dbraw/zinc/93/43/42/387934342.db2.gz QQWMARWJKGRSLO-ZFWWWQNUSA-N 2 0 247.386 2.040 20 0 BEADRP Cc1cccnc1CCC[NH2+][C@H]1CCC[C@@H]1C[NH3+] ZINC000423155544 387934824 /nfs/dbraw/zinc/93/48/24/387934824.db2.gz QQWMARWJKGRSLO-HIFRSBDPSA-N 2 0 247.386 2.040 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCCC(C)(C)C1)C1C[NH2+]C1 ZINC000423157872 387936072 /nfs/dbraw/zinc/93/60/72/387936072.db2.gz BTKCKWBMIWQKOV-RYUDHWBXSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H](CC(C)(C)C)[NH2+][C@@H]1CCOC[C@@H]1[C@@H](C)[NH3+] ZINC000423157648 387936472 /nfs/dbraw/zinc/93/64/72/387936472.db2.gz BKNZWJQKWIZFAK-FDYHWXHSSA-N 2 0 242.407 2.153 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]CCC(C)(F)F ZINC000423145042 387923194 /nfs/dbraw/zinc/92/31/94/387923194.db2.gz ITUGVDSJMWHURG-ZJUUUORDSA-N 2 0 220.307 2.009 20 0 BEADRP Cc1cccnc1CCC[NH2+][C@H](C)[C@@H]1CCC[NH2+]1 ZINC000423147085 387924016 /nfs/dbraw/zinc/92/40/16/387924016.db2.gz CBRIDKZPZXXSEM-HIFRSBDPSA-N 2 0 247.386 2.053 20 0 BEADRP F[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000423148186 387925181 /nfs/dbraw/zinc/92/51/81/387925181.db2.gz UTIXIQNJSHIZQA-VJTDZRGJSA-N 2 0 240.366 2.387 20 0 BEADRP Cc1ccc(F)c(CC[NH2+][C@H](C)C[C@@H](C)[NH3+])c1 ZINC000423147029 387925832 /nfs/dbraw/zinc/92/58/32/387925832.db2.gz BTJNDKRHKWZXJQ-VXGBXAGGSA-N 2 0 238.350 2.392 20 0 BEADRP CC(C)C[C@@H]1C[C@H]1[NH2+][C@H](C)[C@@H]1CCC[NH2+]1 ZINC000423167753 387953157 /nfs/dbraw/zinc/95/31/57/387953157.db2.gz FUKSZYKCTHTFNF-FVCCEPFGSA-N 2 0 210.365 2.151 20 0 BEADRP CC(C)C[C@H](C)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000044535008 387937928 /nfs/dbraw/zinc/93/79/28/387937928.db2.gz PFZADHSVZZJEMN-STQMWFEESA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@@H]1C[C@H]1C1CC1 ZINC000423159183 387938042 /nfs/dbraw/zinc/93/80/42/387938042.db2.gz FMMTZDMZDCJIJS-WXHSDQCUSA-N 2 0 210.365 2.140 20 0 BEADRP CCCC[C@H](C)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000044533298 387938336 /nfs/dbraw/zinc/93/83/36/387938336.db2.gz HGYXWFGDEOULSL-QWHCGFSZSA-N 2 0 212.381 2.497 20 0 BEADRP CSCC1CCC([NH2+][C@H]2CCC[C@@H]2[NH3+])CC1 ZINC000423159127 387939422 /nfs/dbraw/zinc/93/94/22/387939422.db2.gz OUZWIPLWZCPOFS-TYUFSLCMSA-N 2 0 242.432 2.378 20 0 BEADRP CCO[C@H]1C[C@@H]([NH2+][C@H]2C[C@H]([NH3+])c3ccccc32)C1 ZINC000423160736 387941090 /nfs/dbraw/zinc/94/10/90/387941090.db2.gz HTOLXPIDFCKTNB-JLUCKKNBSA-N 2 0 246.354 2.288 20 0 BEADRP C[C@H]([NH2+]CC(C)(C)C1=CCCC1)C1C[NH2+]C1 ZINC000423160999 387942066 /nfs/dbraw/zinc/94/20/66/387942066.db2.gz IHJBRYZLYHMFMO-NSHDSACASA-N 2 0 222.376 2.320 20 0 BEADRP CCn1cc([C@@H](C)[NH2+][C@@H](C)CCCC[NH3+])cn1 ZINC000423162501 387942810 /nfs/dbraw/zinc/94/28/10/387942810.db2.gz PPMHODCNCUAHNF-NWDGAFQWSA-N 2 0 238.379 2.071 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]CCC[C@H]1CCOC1 ZINC000423161060 387943606 /nfs/dbraw/zinc/94/36/06/387943606.db2.gz NDNMFXBYWUUMLM-MJBXVCDLSA-N 2 0 240.391 2.053 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]C[C@@H]1C[C@H]1C1CC1 ZINC000423162397 387943918 /nfs/dbraw/zinc/94/39/18/387943918.db2.gz LAHCWWPJWNOWLQ-XDQVBPFNSA-N 2 0 222.376 2.140 20 0 BEADRP CCO[C@@H]1CCCC[C@H]1[NH2+][C@H](C)CCC[NH3+] ZINC000423165368 387948066 /nfs/dbraw/zinc/94/80/66/387948066.db2.gz PWGYJRKIMWNWNK-JHJVBQTASA-N 2 0 228.380 2.051 20 0 BEADRP C[C@@H]([NH2+]C1CCC(C(F)F)CC1)C1C[NH2+]C1 ZINC000423164756 387948597 /nfs/dbraw/zinc/94/85/97/387948597.db2.gz ACAWVZOSSQZSEH-FKTRJACZSA-N 2 0 232.318 2.008 20 0 BEADRP CC(C)C[C@@H]1C[C@H]1[NH2+][C@@H](C)[C@@H]1CCC[NH2+]1 ZINC000423167754 387951665 /nfs/dbraw/zinc/95/16/65/387951665.db2.gz FUKSZYKCTHTFNF-QNWHQSFQSA-N 2 0 210.365 2.151 20 0 BEADRP COC1CCC([NH2+][C@@H](C)[C@H]2CCCC[NH2+]2)CC1 ZINC000423172321 387958837 /nfs/dbraw/zinc/95/88/37/387958837.db2.gz SEXYCCGINHVOSS-GFJIZPEISA-N 2 0 240.391 2.064 20 0 BEADRP C[C@@H]([NH2+]CC1([NH3+])CCCCC1)[C@@H]1CCCOC1 ZINC000423175620 387962831 /nfs/dbraw/zinc/96/28/31/387962831.db2.gz FAQACBOEHKBMDD-CHWSQXEVSA-N 2 0 240.391 2.053 20 0 BEADRP COc1ccc([C@H](C)[C@H](C)[NH2+]CCC[NH3+])cc1 ZINC000423179435 387965811 /nfs/dbraw/zinc/96/58/11/387965811.db2.gz DFHQYHJNPQYZRM-NEPJUHHUSA-N 2 0 236.359 2.126 20 0 BEADRP F[C@@H]1CCCC[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000423180193 387966605 /nfs/dbraw/zinc/96/66/05/387966605.db2.gz KHDGWJABAGFWOC-NRUFJFEESA-N 2 0 226.339 2.140 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+]CC1([NH3+])CCCCC1 ZINC000423183389 387967413 /nfs/dbraw/zinc/96/74/13/387967413.db2.gz ROBDGDZOBQKNII-VXGBXAGGSA-N 2 0 210.365 2.426 20 0 BEADRP CO[C@@H](c1ccccc1)[C@H](C)[NH2+]C1CC[NH2+]CC1 ZINC000423184631 387969139 /nfs/dbraw/zinc/96/91/39/387969139.db2.gz MJMGEOKUXGKGHY-SWLSCSKDSA-N 2 0 248.370 2.104 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H]1CCCC[C@H]1F ZINC000423184079 387969818 /nfs/dbraw/zinc/96/98/18/387969818.db2.gz MTQACTABOITQEF-QJPTWQEYSA-N 2 0 216.344 2.374 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1CCCc2cc(OC)ccc21 ZINC000423184698 387970083 /nfs/dbraw/zinc/97/00/83/387970083.db2.gz ILUBAEDHJGQBRL-OAHLLOKOSA-N 2 0 248.370 2.272 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1C[C@H]1C1CC1)[C@@H]1CCCC[NH2+]1 ZINC000423170275 387956710 /nfs/dbraw/zinc/95/67/10/387956710.db2.gz XQYZSSYQQLKKCP-SAXRGWBVSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+]C[C@@H]1C[C@H]1C1CC1 ZINC000423170766 387956987 /nfs/dbraw/zinc/95/69/87/387956987.db2.gz YULOCWKZSKEVHA-PYJNHQTQSA-N 2 0 222.376 2.010 20 0 BEADRP c1cncc([C@H]([NH2+]C2CC[NH2+]CC2)C2CCC2)c1 ZINC000423195205 387979685 /nfs/dbraw/zinc/97/96/85/387979685.db2.gz YUVZUAGOUZDMBM-OAHLLOKOSA-N 2 0 245.370 2.264 20 0 BEADRP CC[C@@H]([NH2+]CCC[NH2+]C)c1ccccc1 ZINC000423189336 387973539 /nfs/dbraw/zinc/97/35/39/387973539.db2.gz PFLYEQUMRATXRO-CYBMUJFWSA-N 2 0 206.333 2.337 20 0 BEADRP C[C@H]([NH2+]CCC[NH3+])c1ccc2ccccc2n1 ZINC000423189531 387974486 /nfs/dbraw/zinc/97/44/86/387974486.db2.gz MUHAAMUNOHQTNO-NSHDSACASA-N 2 0 229.327 2.234 20 0 BEADRP FCCC[C@@H]1CCC[C@H]1[NH2+]C1CC[NH2+]CC1 ZINC000423189745 387974674 /nfs/dbraw/zinc/97/46/74/387974674.db2.gz RJDJLUBKTACGKL-WCQYABFASA-N 2 0 228.355 2.246 20 0 BEADRP CCCC[C@H](C)[C@@H](C)[NH2+]CCC[NH2+]C ZINC000423201438 387988043 /nfs/dbraw/zinc/98/80/43/387988043.db2.gz ORJRCERJMKJQOX-NWDGAFQWSA-N 2 0 200.370 2.400 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1CCCc2ccc(OC)cc21 ZINC000423204088 387988867 /nfs/dbraw/zinc/98/88/67/387988867.db2.gz UIJJVBMVZPXREK-OAHLLOKOSA-N 2 0 248.370 2.272 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC2([NH3+])CCCCCC2)[C@H](C)O1 ZINC000423204550 387990048 /nfs/dbraw/zinc/99/00/48/387990048.db2.gz URJYHAJBJJWZTG-AGIUHOORSA-N 2 0 240.391 2.194 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC2([NH3+])CCCCCC2)[C@@H](C)O1 ZINC000423204553 387990992 /nfs/dbraw/zinc/99/09/92/387990992.db2.gz URJYHAJBJJWZTG-UPJWGTAASA-N 2 0 240.391 2.194 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1CCC[NH2+]C1)[C@@H]1C[C@@H]1C ZINC000423205622 387991035 /nfs/dbraw/zinc/99/10/35/387991035.db2.gz FGIYLXSMNBIONZ-LOWDOPEQSA-N 2 0 210.365 2.010 20 0 BEADRP FCCC[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000423204737 387991710 /nfs/dbraw/zinc/99/17/10/387991710.db2.gz DQAUTQNQFMKAAC-RDBSUJKOSA-N 2 0 242.382 2.494 20 0 BEADRP C[C@H]1CCC[C@@H]([NH2+][C@@H]2CCCC[C@H]2[NH3+])C1 ZINC000424367789 387991820 /nfs/dbraw/zinc/99/18/20/387991820.db2.gz NVQUPGQWFQHGHG-UMSGYPCISA-N 2 0 210.365 2.425 20 0 BEADRP Cc1ccncc1[C@@H](C)[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000423208856 387993006 /nfs/dbraw/zinc/99/30/06/387993006.db2.gz IBUIDRBIPOMKGG-OLZOCXBDSA-N 2 0 233.359 2.040 20 0 BEADRP CO[C@H](C)[C@@H](C)[NH2+]CC1([NH3+])CCCCCC1 ZINC000423207689 387993103 /nfs/dbraw/zinc/99/31/03/387993103.db2.gz YEFLYOSHUCXCGT-VXGBXAGGSA-N 2 0 228.380 2.051 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000423208857 387993738 /nfs/dbraw/zinc/99/37/38/387993738.db2.gz IBUIDRBIPOMKGG-QWHCGFSZSA-N 2 0 233.359 2.040 20 0 BEADRP Cc1ccc(C[C@H](N[C@@H]2CC[NH2+]C2)C2CC2)cc1 ZINC000423211977 387995633 /nfs/dbraw/zinc/99/56/33/387995633.db2.gz ZICMUJODDAVIRI-CVEARBPZSA-N 2 0 244.382 2.268 20 0 BEADRP C[C@@H](C[NH2+][C@@H](C)[C@@H]1CCC[NH2+]1)CC(F)(F)F ZINC000423196126 387982010 /nfs/dbraw/zinc/98/20/10/387982010.db2.gz YZTJHIQBGDLQDH-UTLUCORTSA-N 2 0 238.297 2.305 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H](c1cccnc1)C1CCC1 ZINC000423198164 387983353 /nfs/dbraw/zinc/98/33/53/387983353.db2.gz DLLLPVSYTAEZLE-CQSZACIVSA-N 2 0 233.359 2.122 20 0 BEADRP C[NH2+]CCC[NH2+][C@H]1C[C@@H](OCC(C)C)C1(C)C ZINC000423198064 387983362 /nfs/dbraw/zinc/98/33/62/387983362.db2.gz CUIFOYQCGAXFIM-QWHCGFSZSA-N 2 0 242.407 2.025 20 0 BEADRP C[NH2+]CCC[NH2+][C@H]1c2ccccc2C[C@@H]1C ZINC000423198251 387984019 /nfs/dbraw/zinc/98/40/19/387984019.db2.gz DVKKJDWKGULPSU-SMDDNHRTSA-N 2 0 218.344 2.119 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H](c1ccccc1)C1CC1 ZINC000423197935 387984673 /nfs/dbraw/zinc/98/46/73/387984673.db2.gz CBCYTTTWDUILKL-AWEZNQCLSA-N 2 0 218.344 2.337 20 0 BEADRP C[NH2+]CCC[NH2+][C@H]1CCCc2ccc(F)cc21 ZINC000423198155 387984821 /nfs/dbraw/zinc/98/48/21/387984821.db2.gz DKDMRHQHYWZMNX-AWEZNQCLSA-N 2 0 236.334 2.402 20 0 BEADRP CCc1cc(N[C@H]2CCC[C@H]([NH+](C)C)C2)cc[nH+]1 ZINC000450368993 387995729 /nfs/dbraw/zinc/99/57/29/387995729.db2.gz LPEXCJGFHAZWDH-ZFWWWQNUSA-N 2 0 247.386 2.351 20 0 BEADRP C[NH2+]CCC[NH2+][C@H]1C[C@H](C)c2ccccc21 ZINC000423198921 387986021 /nfs/dbraw/zinc/98/60/21/387986021.db2.gz IRGFUFCSSOKADX-FZMZJTMJSA-N 2 0 218.344 2.434 20 0 BEADRP CC[C@@H]1C[C@H](C)CC[C@@H]1[NH2+][C@@H]1CC[NH2+]C1 ZINC000423201705 387987055 /nfs/dbraw/zinc/98/70/55/387987055.db2.gz JCLYVLMQJXVSEH-LPWJVIDDSA-N 2 0 210.365 2.153 20 0 BEADRP CCO[C@@H]1C[C@@H]([NH2+][C@@H]2CCCC[C@H]2[NH3+])C1(C)C ZINC000424372121 387997279 /nfs/dbraw/zinc/99/72/79/387997279.db2.gz HCEWVMIPPHOBAK-FDYHWXHSSA-N 2 0 240.391 2.050 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)[C@H]1C[C@H]1C)[C@H]1CCC[NH2+]C1 ZINC000423216061 387997489 /nfs/dbraw/zinc/99/74/89/387997489.db2.gz NYLFJHSSVPZARB-BNDIWNMDSA-N 2 0 210.365 2.009 20 0 BEADRP [NH3+][C@@H]1CCCC[C@H]1[NH2+][C@@H]1CCc2ccccc2C1 ZINC000424374117 387998527 /nfs/dbraw/zinc/99/85/27/387998527.db2.gz YMVZMAKXQQQMFX-BZUAXINKSA-N 2 0 244.382 2.403 20 0 BEADRP CCC[C@@H]([NH2+]CC[C@H](C)[NH3+])c1ccccn1 ZINC000423225511 388007416 /nfs/dbraw/zinc/00/74/16/388007416.db2.gz NBDAQEPPZJPJBW-NWDGAFQWSA-N 2 0 221.348 2.250 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H]1CCc2cc(F)ccc21 ZINC000423224910 388008075 /nfs/dbraw/zinc/00/80/75/388008075.db2.gz KLKJCKFEVSHXDP-TVQRCGJNSA-N 2 0 222.307 2.140 20 0 BEADRP CCO[C@@H]1C[C@@H]([NH2+]CC[C@H](C)[NH3+])C12CCCC2 ZINC000423226850 388011249 /nfs/dbraw/zinc/01/12/49/388011249.db2.gz SNQCDUCBHZPYMA-YNEHKIRRSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]C[C@@H]1C[C@H]1C1CCC1 ZINC000424372770 387996350 /nfs/dbraw/zinc/99/63/50/387996350.db2.gz HLBQDHXIWJQNFE-UQOMUDLDSA-N 2 0 236.403 2.400 20 0 BEADRP Cc1ccc([C@H](C)[NH2+]CC[C@H](C)[NH3+])cc1 ZINC000423241484 388024527 /nfs/dbraw/zinc/02/45/27/388024527.db2.gz XVZWGZJCUDZONU-RYUDHWBXSA-N 2 0 206.333 2.383 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@H](Cc1ccccc1)C1CC1 ZINC000423226807 388011599 /nfs/dbraw/zinc/01/15/99/388011599.db2.gz SKJAAHZTZANQRF-SWLSCSKDSA-N 2 0 232.371 2.335 20 0 BEADRP CO[C@H](c1ccccc1)[C@H](C)[NH2+]CC[C@H](C)[NH3+] ZINC000423227204 388011927 /nfs/dbraw/zinc/01/19/27/388011927.db2.gz UVNZJBCRKUMVQD-OBJOEFQTSA-N 2 0 236.359 2.090 20 0 BEADRP CC(C)C[C@@H]([NH2+]CC[C@H](C)[NH3+])c1ccccn1 ZINC000423226809 388012071 /nfs/dbraw/zinc/01/20/71/388012071.db2.gz SKSOUGXHAHKHAL-GXTWGEPZSA-N 2 0 235.375 2.496 20 0 BEADRP CCN(CC[NH2+][C@H](C)C1(C)CC1)C(C)C ZINC000156632746 388012959 /nfs/dbraw/zinc/01/29/59/388012959.db2.gz DMAPIPKBLYIXON-GFCCVEGCSA-N 2 0 212.381 2.495 20 0 BEADRP CCO[C@@H]1C[C@H]([NH2+]CC[C@H](C)[NH3+])C1(CC)CC ZINC000423227839 388013700 /nfs/dbraw/zinc/01/37/00/388013700.db2.gz XGJAQCHGVGFXRJ-RWMBFGLXSA-N 2 0 242.407 2.297 20 0 BEADRP COc1cccc([C@H](C)[NH2+]CC[C@H](C)[NH3+])c1 ZINC000423228580 388013913 /nfs/dbraw/zinc/01/39/13/388013913.db2.gz DEWWUVDIFQHGOS-QWRGUYRKSA-N 2 0 222.332 2.083 20 0 BEADRP CC[C@@H]([NH2+]CC[C@H](C)[NH3+])c1ccc(OC)cc1 ZINC000423230089 388015231 /nfs/dbraw/zinc/01/52/31/388015231.db2.gz INNRLAJESHGCAE-SMDDNHRTSA-N 2 0 236.359 2.473 20 0 BEADRP COc1ccc2c(c1)[C@@H]([NH2+]CC[C@H](C)[NH3+])CCC2 ZINC000423229028 388015889 /nfs/dbraw/zinc/01/58/89/388015889.db2.gz GLGJXHPIMQPKRZ-NHYWBVRUSA-N 2 0 248.370 2.400 20 0 BEADRP CCOc1ccc([C@@H](C)[NH2+]CC[C@H](C)[NH3+])cc1 ZINC000423235271 388018274 /nfs/dbraw/zinc/01/82/74/388018274.db2.gz QRDNFRKTDHSEPF-NWDGAFQWSA-N 2 0 236.359 2.473 20 0 BEADRP CCOC[C@H]1CCC[C@@H]1[NH2+]C1CCC([NH3+])CC1 ZINC000423233764 388018517 /nfs/dbraw/zinc/01/85/17/388018517.db2.gz OQXMWGDDRWPGAW-RYSNWHEDSA-N 2 0 240.391 2.051 20 0 BEADRP CCNCC[NH2+][C@H]1CCC[C@@H](c2cccnc2)C1 ZINC000423234925 388019385 /nfs/dbraw/zinc/01/93/85/388019385.db2.gz MQSKXADAYFHGOX-HIFRSBDPSA-N 2 0 247.386 2.307 20 0 BEADRP CCc1ccc([C@H](C)[NH2+]CC[C@@H]2CC[NH2+]C2)o1 ZINC000423243591 388025989 /nfs/dbraw/zinc/02/59/89/388025989.db2.gz GQUNFXLFCYNUED-RYUDHWBXSA-N 2 0 236.359 2.492 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H](c1cccnc1)C(C)C ZINC000423269906 388020777 /nfs/dbraw/zinc/02/07/77/388020777.db2.gz HIEYWVOSVWMBDV-GXTWGEPZSA-N 2 0 235.375 2.224 20 0 BEADRP Cc1ccncc1[C@@H](C)[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000423243539 388026096 /nfs/dbraw/zinc/02/60/96/388026096.db2.gz GLWJSLUVFVYBBL-OLZOCXBDSA-N 2 0 233.359 2.040 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H](c1cccnc1)C(C)C ZINC000423269908 388021424 /nfs/dbraw/zinc/02/14/24/388021424.db2.gz HIEYWVOSVWMBDV-OCCSQVGLSA-N 2 0 235.375 2.224 20 0 BEADRP COc1ccccc1[C@@H](C)[NH2+]CC[C@H](C)[NH3+] ZINC000423238023 388022090 /nfs/dbraw/zinc/02/20/90/388022090.db2.gz UUWXDOBPTYBOGL-WDEREUQCSA-N 2 0 222.332 2.083 20 0 BEADRP CC[C@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)C1CC1 ZINC000423256068 388036771 /nfs/dbraw/zinc/03/67/71/388036771.db2.gz DIODFGCOEBYHGQ-AAEUAGOBSA-N 2 0 210.365 2.154 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H]1CCCc2c(O)cccc21 ZINC000423255605 388036774 /nfs/dbraw/zinc/03/67/74/388036774.db2.gz AJAOEHOODHOFFK-FZMZJTMJSA-N 2 0 248.370 2.215 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC[N@H+](C)[C@@H]2CCC[C@H]21)C1CC1 ZINC000453292790 388036751 /nfs/dbraw/zinc/03/67/51/388036751.db2.gz PEBXKBQERWLNBE-YXCITZCRSA-N 2 0 222.376 2.247 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)C1(C)CC1 ZINC000423255536 388037570 /nfs/dbraw/zinc/03/75/70/388037570.db2.gz CCVVBXIWMLJLIY-NEPJUHHUSA-N 2 0 210.365 2.154 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)C1CC1 ZINC000083055511 388044544 /nfs/dbraw/zinc/04/45/44/388044544.db2.gz GNWFSRFGQZOYQH-SMDDNHRTSA-N 2 0 222.376 2.249 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000423264422 388041326 /nfs/dbraw/zinc/04/13/26/388041326.db2.gz YSVDLPZCFPZMPJ-UONOGXRCSA-N 2 0 247.386 2.430 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@H]1c2ccccc2C[C@H]1C ZINC000423264524 388042432 /nfs/dbraw/zinc/04/24/32/388042432.db2.gz CDXDHYJCRURPRR-KCPJHIHWSA-N 2 0 232.371 2.493 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@H]1CC(C)(C)C[C@H]1C ZINC000423263906 388042963 /nfs/dbraw/zinc/04/29/63/388042963.db2.gz BJPSWMQCMXKOSC-UTUOFQBUSA-N 2 0 212.381 2.384 20 0 BEADRP CC[C@@H]([NH2+]C[C@H](C)C[NH+]1CCCC1)C1CC1 ZINC000083056518 388044149 /nfs/dbraw/zinc/04/41/49/388044149.db2.gz GOIMDCYUHFDILZ-GXTWGEPZSA-N 2 0 224.392 2.497 20 0 BEADRP CCc1ccc([C@H](C)[NH2+]CC[C@H]2CC[NH2+]C2)o1 ZINC000423243590 388026578 /nfs/dbraw/zinc/02/65/78/388026578.db2.gz GQUNFXLFCYNUED-NWDGAFQWSA-N 2 0 236.359 2.492 20 0 BEADRP C(C[C@@H]1CC[NH2+]C1)[NH2+][C@H]1CCCC12CCC2 ZINC000423245484 388027542 /nfs/dbraw/zinc/02/75/42/388027542.db2.gz JAJHSXVTQRBDAK-STQMWFEESA-N 2 0 222.376 2.298 20 0 BEADRP C(C[C@@H]1CC[NH2+]C1)[NH2+][C@@H]1CCCC12CCC2 ZINC000423245483 388027553 /nfs/dbraw/zinc/02/75/53/388027553.db2.gz JAJHSXVTQRBDAK-QWHCGFSZSA-N 2 0 222.376 2.298 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]C1CC(C)(F)C1 ZINC000453256544 388028469 /nfs/dbraw/zinc/02/84/69/388028469.db2.gz UFZLSYQEUJIYML-LLDQHTGMSA-N 2 0 228.355 2.195 20 0 BEADRP FC(F)C1CCC([NH2+]CC[C@@H]2CC[NH2+]C2)CC1 ZINC000423247833 388030256 /nfs/dbraw/zinc/03/02/56/388030256.db2.gz LRTYGYVSUQUJLU-UNXYVOJBSA-N 2 0 246.345 2.400 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H]1CCc2ccc(C)cc21 ZINC000423274630 388055791 /nfs/dbraw/zinc/05/57/91/388055791.db2.gz MEPKJRWQZXOMBW-DOMZBBRYSA-N 2 0 232.371 2.427 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H](C)c1cccs1 ZINC000423275158 388056695 /nfs/dbraw/zinc/05/66/95/388056695.db2.gz MPYRJNVOOCGUMJ-NXEZZACHSA-N 2 0 212.362 2.254 20 0 BEADRP CC(C)[C@@H]1C[C@H]1C[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000453362263 388059782 /nfs/dbraw/zinc/05/97/82/388059782.db2.gz QYNAGTXDMHYPFM-XUXIUFHCSA-N 2 0 224.392 2.351 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H](C)C[NH2+]C)C(C)(C)C ZINC000423278207 388059912 /nfs/dbraw/zinc/05/99/12/388059912.db2.gz QUIOKXFBJHGOFH-WDEREUQCSA-N 2 0 200.370 2.256 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H]1CCc2c1cccc2C ZINC000423280979 388062563 /nfs/dbraw/zinc/06/25/63/388062563.db2.gz VEJIDOJAAJUFQS-ABAIWWIYSA-N 2 0 232.371 2.427 20 0 BEADRP COc1ccc2c(c1)CCC[C@H]2[NH2+]CC(C)(C)[NH3+] ZINC000423281784 388063384 /nfs/dbraw/zinc/06/33/84/388063384.db2.gz BQXRVEQFXBVBHS-CQSZACIVSA-N 2 0 248.370 2.400 20 0 BEADRP Cc1cc([C@H](C)[NH2+]CC[C@@H]2CCC[NH2+]C2)no1 ZINC000423281928 388063432 /nfs/dbraw/zinc/06/34/32/388063432.db2.gz VYXRFMSLRYITPO-RYUDHWBXSA-N 2 0 237.347 2.023 20 0 BEADRP CC(C)([NH3+])C[NH2+][C@@H](Cc1ccccc1)C1CC1 ZINC000423281843 388063501 /nfs/dbraw/zinc/06/35/01/388063501.db2.gz CABNJVZLJDBYHF-AWEZNQCLSA-N 2 0 232.371 2.335 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H](C1CC1)C1CCC1 ZINC000423282368 388064824 /nfs/dbraw/zinc/06/48/24/388064824.db2.gz WLLHVLTXLWESNK-ZWNOBZJWSA-N 2 0 210.365 2.010 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H](C1CC1)C1CCC1 ZINC000423282365 388065475 /nfs/dbraw/zinc/06/54/75/388065475.db2.gz WLLHVLTXLWESNK-GXFFZTMASA-N 2 0 210.365 2.010 20 0 BEADRP CC(C)([NH3+])C[NH2+][C@H](C1CC1)C1CCCC1 ZINC000423287358 388070444 /nfs/dbraw/zinc/07/04/44/388070444.db2.gz LSALNCWNFJXTHB-LBPRGKRZSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccccc1 ZINC000084215456 388073076 /nfs/dbraw/zinc/07/30/76/388073076.db2.gz AQVMHPUPDGCRMP-KBPBESRZSA-N 2 0 218.344 2.294 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)NCC[NH2+]C1CCCCCC1 ZINC000423288240 388073721 /nfs/dbraw/zinc/07/37/21/388073721.db2.gz RECDVMNVEGUKLU-OLZOCXBDSA-N 2 0 241.423 2.014 20 0 BEADRP CC[C@H](c1ccc(F)cc1)[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC000084221685 388075374 /nfs/dbraw/zinc/07/53/74/388075374.db2.gz HIMFLNDJATVPDK-VNHYZAJKSA-N 2 0 248.345 2.428 20 0 BEADRP CCC([NH3+])(CC)C[NH2+][C@H](C)Cc1ccoc1 ZINC000423291192 388075590 /nfs/dbraw/zinc/07/55/90/388075590.db2.gz HFSLCWLUMRJMHG-LLVKDONJSA-N 2 0 224.348 2.318 20 0 BEADRP COC[C@H]([NH2+]Cc1ccc([C@@H](C)[NH3+])cc1)C1CC1 ZINC000423293654 388076310 /nfs/dbraw/zinc/07/63/10/388076310.db2.gz RVAWMFKTZOYTER-ABAIWWIYSA-N 2 0 248.370 2.221 20 0 BEADRP CC(C)[C@H]([NH2+][C@H]1CCC[C@@H]([NH3+])C1)C1CC1 ZINC000324224222 388114819 /nfs/dbraw/zinc/11/48/19/388114819.db2.gz FXFZDSNPFXYDOE-AGIUHOORSA-N 2 0 210.365 2.281 20 0 BEADRP CSC[C@H](C)[NH2+][C@@H]1CC[N@H+](C)[C@H]2CCC[C@H]21 ZINC000336658276 388076816 /nfs/dbraw/zinc/07/68/16/388076816.db2.gz BHMPUCLPWKORBM-RVMXOQNASA-N 2 0 242.432 2.200 20 0 BEADRP CCc1nc(C)c([C@H](C)[NH2+]C[C@@H](C)C[NH3+])s1 ZINC000423295549 388077634 /nfs/dbraw/zinc/07/76/34/388077634.db2.gz FCRMAJBFRHSWLK-IUCAKERBSA-N 2 0 241.404 2.259 20 0 BEADRP CCc1ccc([C@H](C)[NH2+]C[C@H](C)C[NH3+])o1 ZINC000423297626 388080172 /nfs/dbraw/zinc/08/01/72/388080172.db2.gz LCFHJAGHBNUADB-ZJUUUORDSA-N 2 0 210.321 2.087 20 0 BEADRP Cc1ccsc1[C@H](C)[NH2+]C[C@@H](C)C[NH3+] ZINC000423298120 388080227 /nfs/dbraw/zinc/08/02/27/388080227.db2.gz NEYUSWNWBPGUGI-WPRPVWTQSA-N 2 0 212.362 2.302 20 0 BEADRP C(C1CCCCCC1)[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC000085282045 388085861 /nfs/dbraw/zinc/08/58/61/388085861.db2.gz VBPQKOQVDGJQBO-OKILXGFUSA-N 2 0 222.376 2.108 20 0 BEADRP C[C@@H]1CSC[C@@H]1[NH2+]CCCC[N@H+](C)C1CC1 ZINC000453593598 388089028 /nfs/dbraw/zinc/08/90/28/388089028.db2.gz GWQAGDSOTHXION-YPMHNXCESA-N 2 0 242.432 2.202 20 0 BEADRP CC(C)OC[C@@H](C)[NH2+]CCCC[N@H+](C)C1CC1 ZINC000453601803 388090400 /nfs/dbraw/zinc/09/04/00/388090400.db2.gz VXSUWSNQTSBKPO-CYBMUJFWSA-N 2 0 242.407 2.264 20 0 BEADRP Cc1ccccc1C[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000086403260 388101435 /nfs/dbraw/zinc/10/14/35/388101435.db2.gz JKIYZIXUMKZRHK-KBPBESRZSA-N 2 0 218.344 2.355 20 0 BEADRP C[C@H](C[C@H]1CCC[NH2+]1)[NH2+]CCc1cccs1 ZINC000086494985 388103729 /nfs/dbraw/zinc/10/37/29/388103729.db2.gz XBJGKLGOFMTUGY-VXGBXAGGSA-N 2 0 238.400 2.411 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@H]2CCCOCC2)CC1 ZINC000086870142 388109605 /nfs/dbraw/zinc/10/96/05/388109605.db2.gz JYPBXSIQIHRULW-ZDUSSCGKSA-N 2 0 240.391 2.018 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H]1c2ccccc2C[C@H]1C ZINC000423267431 388045260 /nfs/dbraw/zinc/04/52/60/388045260.db2.gz DZEGAAHELRUIEK-YWPYICTPSA-N 2 0 232.371 2.365 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H](C)c1ccccc1N(C)C ZINC000423267470 388046116 /nfs/dbraw/zinc/04/61/16/388046116.db2.gz FEKBXOUWFPUFOO-OLZOCXBDSA-N 2 0 249.402 2.259 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@H](C)C1CCSCC1 ZINC000423269467 388047338 /nfs/dbraw/zinc/04/73/38/388047338.db2.gz HGPIHIDAHYBWSD-ZYHUDNBSSA-N 2 0 230.421 2.091 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H](C)c1ccc(F)cc1 ZINC000423269492 388047368 /nfs/dbraw/zinc/04/73/68/388047368.db2.gz GYZPQRGSXIXRJB-MNOVXSKESA-N 2 0 224.323 2.332 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1C[C@@H](C)CC[C@@H]1C ZINC000423269174 388047822 /nfs/dbraw/zinc/04/78/22/388047822.db2.gz GWEOJGNOYLZEJE-ZDEQEGDKSA-N 2 0 212.381 2.256 20 0 BEADRP CCC1(CC)[C@H]([NH2+]C[C@H](C)C[NH2+]C)C[C@H]1OC ZINC000423268704 388048114 /nfs/dbraw/zinc/04/81/14/388048114.db2.gz GGLDMSWZTQKQCD-JHJVBQTASA-N 2 0 242.407 2.025 20 0 BEADRP CCC1(CC)[C@H]([NH2+]C[C@@H](C)C[NH2+]C)C[C@H]1OC ZINC000423268707 388048293 /nfs/dbraw/zinc/04/82/93/388048293.db2.gz GGLDMSWZTQKQCD-YNEHKIRRSA-N 2 0 242.407 2.025 20 0 BEADRP CC/C=C\C[NH2+][C@@H]1CC[N@H+](C)[C@@H]2CCC[C@@H]21 ZINC000453332243 388048822 /nfs/dbraw/zinc/04/88/22/388048822.db2.gz VTNFZKLMTDQAFK-YNLGZWBXSA-N 2 0 222.376 2.415 20 0 BEADRP CCC[NH+]1CCC([NH2+]C2CC(C)(F)C2)CC1 ZINC000449374851 388185761 /nfs/dbraw/zinc/18/57/61/388185761.db2.gz CKZDQKUPFFIOMG-UHFFFAOYSA-N 2 0 228.355 2.341 20 0 BEADRP Cc1cccc(CC[N@H+]2CC[C@H](C[NH+](C)C)C2)c1 ZINC000449035475 388134279 /nfs/dbraw/zinc/13/42/79/388134279.db2.gz OMJCPMYVFYTHHU-MRXNPFEDSA-N 2 0 246.398 2.421 20 0 BEADRP CC[N@@H+]1CC[C@H](NCc2ccnc(C)c2)[C@H](C)C1 ZINC000449402886 388195116 /nfs/dbraw/zinc/19/51/16/388195116.db2.gz NQMREMRKCPZOHM-DOMZBBRYSA-N 2 0 247.386 2.210 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)C1CC1 ZINC000449442084 388207250 /nfs/dbraw/zinc/20/72/50/388207250.db2.gz WFDMGXKNUNUYAG-RTXFEEFZSA-N 2 0 208.349 2.001 20 0 BEADRP CC/C=C/C[NH2+][C@@H]1CC[N@H+](CC)C[C@H]1C ZINC000449455703 388210304 /nfs/dbraw/zinc/21/03/04/388210304.db2.gz LOSYAEYVCHLIBI-AMRKSYTLSA-N 2 0 210.365 2.273 20 0 BEADRP CCC(CC)C[N@@H+]1CC[C@@H](C)[C@H](C[NH3+])C1 ZINC000164666337 388242444 /nfs/dbraw/zinc/24/24/44/388242444.db2.gz ISLWBCJGLUPLAK-DGCLKSJQSA-N 2 0 212.381 2.339 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@H]2C[C@H]2Cc2ccccc2)C1 ZINC000516663570 256603388 /nfs/dbraw/zinc/60/33/88/256603388.db2.gz STKWFTVNBVNGCK-WCVJEAGWSA-N 2 0 244.382 2.477 20 0 BEADRP C[NH+](C/C=C/C[N@@H+](C)CC1CC1)CC1CC1 ZINC000193490512 388361200 /nfs/dbraw/zinc/36/12/00/388361200.db2.gz HSEBIYRUBYFMAL-ONEGZZNKSA-N 2 0 222.376 2.226 20 0 BEADRP Cc1ccc(C[NH2+]CCCC[NH3+])cc1Cl ZINC000235775884 388375302 /nfs/dbraw/zinc/37/53/02/388375302.db2.gz UGMYXQHVGLFWFB-UHFFFAOYSA-N 2 0 226.751 2.477 20 0 BEADRP CCC(C)(C)[C@@H](C)[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000519643941 256654977 /nfs/dbraw/zinc/65/49/77/256654977.db2.gz WHVUNHNLEUTACD-NEPJUHHUSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H]([NH3+])[C@H]1CC[N@H+](C[C@@H]2CCC(F)(F)C2)C1 ZINC000300924105 388386457 /nfs/dbraw/zinc/38/64/57/388386457.db2.gz LRFSLUTWBMJOTR-AXFHLTTASA-N 2 0 232.318 2.091 20 0 BEADRP C[C@@H]1C[N@H+](C[C@H]2CCC(F)(F)C2)CC[C@H]1[NH3+] ZINC000300785733 388394087 /nfs/dbraw/zinc/39/40/87/388394087.db2.gz BEBQREPYARJJFF-OUAUKWLOSA-N 2 0 232.318 2.091 20 0 BEADRP C[C@@H]1C[C@H]([NH3+])CC[N@@H+]1C[C@H]1CCC(F)(F)C1 ZINC000300997952 388397618 /nfs/dbraw/zinc/39/76/18/388397618.db2.gz VHKLEWWKLKSFKN-OUAUKWLOSA-N 2 0 232.318 2.233 20 0 BEADRP C[C@H]1C[C@H]([NH2+]C2CC[NH+](C(C)(C)C)CC2)CO1 ZINC000335426511 388450647 /nfs/dbraw/zinc/45/06/47/388450647.db2.gz XHYXLNZYPUEQHK-AAEUAGOBSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CCCC[N@@H+]1CCCCCF ZINC000336674027 388461736 /nfs/dbraw/zinc/46/17/36/388461736.db2.gz GYPLAGBCPJIJTE-RYUDHWBXSA-N 2 0 216.344 2.328 20 0 BEADRP CCC[C@H](C)C[N@@H+]1CC[C@@]2(CC[NH2+]C2)C1 ZINC000336717616 388468196 /nfs/dbraw/zinc/46/81/96/388468196.db2.gz YCMUJNBEBMDCNA-QWHCGFSZSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@H](C[NH2+][C@@H](C)C1CCSCC1)C[NH+](C)C ZINC000336725243 388470277 /nfs/dbraw/zinc/47/02/77/388470277.db2.gz BKNZYWTYRZXGBA-NEPJUHHUSA-N 2 0 244.448 2.305 20 0 BEADRP CC[C@](C)(C[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@H]1C)OC ZINC000322511803 388437538 /nfs/dbraw/zinc/43/75/38/388437538.db2.gz JBNQTNIHAQSPDG-XJFOESAGSA-N 2 0 242.407 2.120 20 0 BEADRP COC(C)(C)[C@@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000322549678 388437665 /nfs/dbraw/zinc/43/76/65/388437665.db2.gz AXEICEWGGYTOTO-ODWCKFRGSA-N 2 0 240.391 2.015 20 0 BEADRP COC(C)(C)[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000322549680 388437713 /nfs/dbraw/zinc/43/77/13/388437713.db2.gz AXEICEWGGYTOTO-WODVXLOZSA-N 2 0 240.391 2.015 20 0 BEADRP C[N@@H+]1CC[C@@]2(CC[NH+](CC3CC(C)(C)C3)C2)C1 ZINC000528510621 388538329 /nfs/dbraw/zinc/53/83/29/388538329.db2.gz BMJILERZVIYPRK-OAHLLOKOSA-N 2 0 236.403 2.450 20 0 BEADRP CCC[C@H](C[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)OC ZINC000356333471 388547790 /nfs/dbraw/zinc/54/77/90/388547790.db2.gz KYNXDFPWMLXFCU-BFHYXJOUSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@H](C)[N@H+](C)C[C@@H]2C)CS1 ZINC000397796014 388499684 /nfs/dbraw/zinc/49/96/84/388499684.db2.gz ANLLFKJMHIAKMH-IEECTRCBSA-N 2 0 242.432 2.199 20 0 BEADRP c1ccc([C@H]2CCC[N@H+]2CC[C@@H]2CC[NH2+]C2)nc1 ZINC000516973474 388529727 /nfs/dbraw/zinc/52/97/27/388529727.db2.gz UMTBJOILTKSCND-DZGCQCFKSA-N 2 0 245.370 2.218 20 0 BEADRP C[C@@H]1CC([NH2+][C@@H]2CCCCC[C@@H]2[NH3+])C[C@@H](C)O1 ZINC000516173948 256768241 /nfs/dbraw/zinc/76/82/41/256768241.db2.gz PCRMRBKUSDYQRG-MHDGFBEUSA-N 2 0 240.391 2.192 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@H]2CCC[C@H]2F)[C@@H]2CCC[C@H]21 ZINC000550934150 388617086 /nfs/dbraw/zinc/61/70/86/388617086.db2.gz WVMNOXKPDVJCNZ-ZUWCUPBKSA-N 2 0 240.366 2.339 20 0 BEADRP C[C@@H]1CC[N@H+](CC[C@@H]2CCC[NH+]2C)C[C@H]1C ZINC000245558748 388589834 /nfs/dbraw/zinc/58/98/34/388589834.db2.gz BHAIOBIZDVCTJN-MCIONIFRSA-N 2 0 224.392 2.449 20 0 BEADRP Cc1cncc([C@H](C)[NH2+]CC2CC[NH+](C)CC2)c1 ZINC000184345983 256845005 /nfs/dbraw/zinc/84/50/05/256845005.db2.gz KQKHXKZIPJJJFL-ZDUSSCGKSA-N 2 0 247.386 2.382 20 0 BEADRP CO[C@H](C[N@@H+]1CC[C@@H]([NH3+])C[C@H]1C)c1ccccc1 ZINC000379171134 388594317 /nfs/dbraw/zinc/59/43/17/388594317.db2.gz DIKNAXKSMCFXGE-BPLDGKMQSA-N 2 0 248.370 2.186 20 0 BEADRP Cc1ncccc1CN(C)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000245744288 388602081 /nfs/dbraw/zinc/60/20/81/388602081.db2.gz MLQYUQGDLANSLB-WFASDCNBSA-N 2 0 247.386 2.305 20 0 BEADRP CC(C)[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)C1CC1 ZINC000401055243 388605336 /nfs/dbraw/zinc/60/53/36/388605336.db2.gz DIGZRSDIHXBIOA-YJNKXOJESA-N 2 0 236.403 2.399 20 0 BEADRP c1cn(CCCn2ccnc2C2CC2)cn1 ZINC000530128845 388612677 /nfs/dbraw/zinc/61/26/77/388612677.db2.gz DPIGQZXDSAOWOP-UHFFFAOYSA-N 2 0 216.288 2.047 20 0 BEADRP COc1ccnc(Cn2ccnc2C2CC2)c1 ZINC000530131174 388615439 /nfs/dbraw/zinc/61/54/39/388615439.db2.gz MJVCVXNPBPVTCM-UHFFFAOYSA-N 2 0 229.283 2.212 20 0 BEADRP CC[C@@H](C)[NH2+]Cc1cnc2n1CCCC2 ZINC000367440018 388565404 /nfs/dbraw/zinc/56/54/04/388565404.db2.gz ZAKXNJVEYQEQQK-SNVBAGLBSA-N 2 0 207.321 2.108 20 0 BEADRP Cc1ccccc1OCC[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000517588786 256829751 /nfs/dbraw/zinc/82/97/51/256829751.db2.gz SVARTAXHWJCBSQ-KGLIPLIRSA-N 2 0 248.370 2.233 20 0 BEADRP CCC[N@H+](C)C[C@H]1CC[NH+](CCOC(C)C)C1 ZINC000081569613 388584317 /nfs/dbraw/zinc/58/43/17/388584317.db2.gz GHLWFOQMCPAEQR-CQSZACIVSA-N 2 0 242.407 2.075 20 0 BEADRP C[C@@H](C1CC1)[N@H+](C)CC[C@@H]1CCC[NH+]1C ZINC000125016157 388668120 /nfs/dbraw/zinc/66/81/20/388668120.db2.gz KKOOLZVGFCUJIQ-AAEUAGOBSA-N 2 0 210.365 2.201 20 0 BEADRP COC[C@@H](C)C[N@H+](C)CC[C@H]1CCCC[NH+]1C ZINC000247673363 388668806 /nfs/dbraw/zinc/66/88/06/388668806.db2.gz YWCIIBJJNZHWAI-UONOGXRCSA-N 2 0 242.407 2.075 20 0 BEADRP CC[NH+](CC)CCC[N@H+](CC)C[C@H]1CCCO1 ZINC000191779233 388670192 /nfs/dbraw/zinc/67/01/92/388670192.db2.gz DADMUMKRPIEKND-CQSZACIVSA-N 2 0 242.407 2.219 20 0 BEADRP CC1=CC[C@H]([NH2+]C[C@H]2CCC[N@@H+](C)C2)CC1 ZINC000552117517 388670695 /nfs/dbraw/zinc/67/06/95/388670695.db2.gz PPZPIWQILHKFIS-KGLIPLIRSA-N 2 0 222.376 2.417 20 0 BEADRP CCCCC[NH2+][C@@H]1CC[N@H+](CC)C[C@H]1C ZINC000248054798 388673395 /nfs/dbraw/zinc/67/33/95/388673395.db2.gz XFDNHZZPZHCRRX-CHWSQXEVSA-N 2 0 212.381 2.497 20 0 BEADRP Cc1ccc(C[NH2+]CCC2CC[NH+](C)CC2)nc1 ZINC000125760964 388677085 /nfs/dbraw/zinc/67/70/85/388677085.db2.gz XBWDCUPYHJEGEY-UHFFFAOYSA-N 2 0 247.386 2.212 20 0 BEADRP C1CC1[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000530177350 388621551 /nfs/dbraw/zinc/62/15/51/388621551.db2.gz GKAQNJUFTXKSKE-MELADBBJSA-N 2 0 234.387 2.439 20 0 BEADRP C1CC1[C@H]1CCC[C@@H]1[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000530177351 388622172 /nfs/dbraw/zinc/62/21/72/388622172.db2.gz GKAQNJUFTXKSKE-RDBSUJKOSA-N 2 0 234.387 2.439 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@H]2CC[NH2+]C23CCC3)C1 ZINC000530179674 388622395 /nfs/dbraw/zinc/62/23/95/388622395.db2.gz ZUJMZHFLQZCKPP-AGIUHOORSA-N 2 0 222.376 2.439 20 0 BEADRP CC(C)C[C@@H](C)[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000530179357 388623051 /nfs/dbraw/zinc/62/30/51/388623051.db2.gz XEDUQMXZMKZMSE-VXGBXAGGSA-N 2 0 210.365 2.295 20 0 BEADRP CC1CCC([NH2+][C@H]2CC[NH2+]C23CCC3)CC1 ZINC000530179654 388623251 /nfs/dbraw/zinc/62/32/51/388623251.db2.gz ZRGRVGDJABHNRD-BPCQOVAHSA-N 2 0 222.376 2.439 20 0 BEADRP Cc1ccncc1CCC[N@@H+](C)CCC[NH+](C)C ZINC000564377438 388625005 /nfs/dbraw/zinc/62/50/05/388625005.db2.gz HULOHFZDQPAACC-UHFFFAOYSA-N 2 0 249.402 2.206 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]C[C@@H]1CC[C@H]2C[C@H]2C1 ZINC000530207037 388626898 /nfs/dbraw/zinc/62/68/98/388626898.db2.gz CMVXMVQCCVVXOK-QMIVOQANSA-N 2 0 236.403 2.400 20 0 BEADRP C[NH2+]C1CC[NH+](CC2CC(C)(C)C2)CC1 ZINC000530210872 388627363 /nfs/dbraw/zinc/62/73/63/388627363.db2.gz MLOVMNZBKHAKBE-UHFFFAOYSA-N 2 0 210.365 2.106 20 0 BEADRP COCCC1CC[NH+]([C@@H]2CCC[C@H]([NH3+])C2)CC1 ZINC000530212179 388627628 /nfs/dbraw/zinc/62/76/28/388627628.db2.gz PLINAWMOTKNOGJ-UONOGXRCSA-N 2 0 240.391 2.005 20 0 BEADRP CS[C@H](C)C[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@@H]1C ZINC000246290264 388628625 /nfs/dbraw/zinc/62/86/25/388628625.db2.gz CIFBWXJYROYSBR-NNYUYHANSA-N 2 0 230.421 2.056 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CC1CC=CC1 ZINC000530215582 388628691 /nfs/dbraw/zinc/62/86/91/388628691.db2.gz HOALDJSNEXCGDE-NSHDSACASA-N 2 0 245.370 2.466 20 0 BEADRP CCC1(C[NH2+][C@@H]2C[C@H](C)[N@H+](C)C[C@H]2C)CC1 ZINC000246324586 388630330 /nfs/dbraw/zinc/63/03/30/388630330.db2.gz FPZGULZXHNXWJL-FRRDWIJNSA-N 2 0 224.392 2.495 20 0 BEADRP CC1(C)CC(C[N@@H+]2CC[C@]3(CC[NH2+]C3)C2)C1 ZINC000530216447 388630482 /nfs/dbraw/zinc/63/04/82/388630482.db2.gz BMZWMFMJADVUKC-AWEZNQCLSA-N 2 0 222.376 2.108 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000530216355 388630589 /nfs/dbraw/zinc/63/05/89/388630589.db2.gz AXPAGDWQOXAFPT-SRVKXCTJSA-N 2 0 210.365 2.295 20 0 BEADRP CC(C)CCC[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000530245386 388638916 /nfs/dbraw/zinc/63/89/16/388638916.db2.gz XFIQVYVQUAUNKD-GFCCVEGCSA-N 2 0 210.365 2.297 20 0 BEADRP Cc1ccc(C2=CC[N@H+](C)CC2)cc1C[NH3+] ZINC000530248520 388639718 /nfs/dbraw/zinc/63/97/18/388639718.db2.gz OYVUTLPRPFHQEL-UHFFFAOYSA-N 2 0 216.328 2.173 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH+](C)CCSC)[C@@H](C)C1 ZINC000246789520 388651678 /nfs/dbraw/zinc/65/16/78/388651678.db2.gz MGALPTRIMWGCIE-RYUDHWBXSA-N 2 0 230.421 2.012 20 0 BEADRP COC[C@@H](C)[NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1 ZINC000247049972 388657769 /nfs/dbraw/zinc/65/77/69/388657769.db2.gz NFMOQWFDYOLNLN-ZIAGYGMSSA-N 2 0 242.407 2.123 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CCCSC)[C@@H](C)C1 ZINC000223736893 388657926 /nfs/dbraw/zinc/65/79/26/388657926.db2.gz JEZDTZNQDHXQGL-RYUDHWBXSA-N 2 0 230.421 2.059 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)C(C)C)C1 ZINC000247056058 388657959 /nfs/dbraw/zinc/65/79/59/388657959.db2.gz NMLVNUJEHIOCNI-OLZOCXBDSA-N 2 0 212.381 2.352 20 0 BEADRP CC(C)[N@@H+]1CC[C@H](C[NH2+]C[C@@H]2CCSC2)C1 ZINC000224396866 388664382 /nfs/dbraw/zinc/66/43/82/388664382.db2.gz IWYPRVVTNGZCAG-OLZOCXBDSA-N 2 0 242.432 2.059 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]CC2CC[NH2+]CC2)C1 ZINC000086700451 388690765 /nfs/dbraw/zinc/69/07/65/388690765.db2.gz ZSIYQCDFIOJWDI-YPMHNXCESA-N 2 0 210.365 2.154 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@H]2C[C@@H]2C(F)F)[C@H]2CCC[C@H]21 ZINC000554095452 388799274 /nfs/dbraw/zinc/79/92/74/388799274.db2.gz FNDHLNSTAPQOMF-WTPMCQDGSA-N 2 0 244.329 2.102 20 0 BEADRP C[C@@H]1CCCC[C@H]1[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000252173821 388761802 /nfs/dbraw/zinc/76/18/02/388761802.db2.gz ONXDOIKKFHVVQH-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]CCOC2CCCCC2)C1 ZINC000093216148 388828817 /nfs/dbraw/zinc/82/88/17/388828817.db2.gz IXZOULNDXDFNFY-QWHCGFSZSA-N 2 0 240.391 2.195 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CC2CCC1CC2)C1C[NH2+]C1 ZINC000564988684 388904955 /nfs/dbraw/zinc/90/49/55/388904955.db2.gz NSYDROGYTNPUTO-WTIISPKJSA-N 2 0 222.376 2.010 20 0 BEADRP C[C@H]1C[C@H]([NH3+])CC[N@@H+]1CCCc1ccsc1 ZINC000565665151 388961604 /nfs/dbraw/zinc/96/16/04/388961604.db2.gz FWEXLQPMARMTTE-WCQYABFASA-N 2 0 238.400 2.492 20 0 BEADRP CC(C)[NH2+]CCC[NH2+][C@H]1CCO[C@@H](C(C)C)C1 ZINC000565592460 388955388 /nfs/dbraw/zinc/95/53/88/388955388.db2.gz DPELNINJJVQXCJ-UONOGXRCSA-N 2 0 242.407 2.168 20 0 BEADRP C[C@H]([NH2+]Cc1ccc(C[NH3+])cc1)[C@@H]1C[C@H]1C ZINC000566068845 388985170 /nfs/dbraw/zinc/98/51/70/388985170.db2.gz GXWVCEJOQAPQIS-UHIISALHSA-N 2 0 218.344 2.279 20 0 BEADRP CC(C)[NH2+]CCC[NH2+][C@H]1CC[C@H]1C1CC1 ZINC000566088404 388986532 /nfs/dbraw/zinc/98/65/32/388986532.db2.gz LNHOBSJHJZSYOP-STQMWFEESA-N 2 0 210.365 2.153 20 0 BEADRP Cc1ccc(C[NH2+]CC2=CC[N@H+](C)CC2)cc1 ZINC000271786752 389024833 /nfs/dbraw/zinc/02/48/33/389024833.db2.gz FSOMCNCMBFAQMF-UHFFFAOYSA-N 2 0 230.355 2.347 20 0 BEADRP C[C@@H](CCc1ccco1)[NH2+]CC1=CC[N@H+](C)CC1 ZINC000271836597 389025625 /nfs/dbraw/zinc/02/56/25/389025625.db2.gz GDKZBDAWOYJLRY-ZDUSSCGKSA-N 2 0 248.370 2.452 20 0 BEADRP CN(C)c1cccc(C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)c1 ZINC000517177194 322817414 /nfs/dbraw/zinc/81/74/14/322817414.db2.gz XEMNFEMXOPJOBN-KGLIPLIRSA-N 2 0 247.386 2.112 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@H]2CCCCS2)CC1 ZINC000087682934 535473611 /nfs/dbraw/zinc/47/36/11/535473611.db2.gz JBOYREXQSJBTJA-CYBMUJFWSA-N 2 0 242.432 2.346 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@@H]2CCCCS2)CC1 ZINC000087682932 535473237 /nfs/dbraw/zinc/47/32/37/535473237.db2.gz JBOYREXQSJBTJA-ZDUSSCGKSA-N 2 0 242.432 2.346 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CC[C@@H](C)C1)[C@H]1CCC[NH2+]1 ZINC000400482272 533434446 /nfs/dbraw/zinc/43/44/46/533434446.db2.gz CIDSBBVCWATRED-FVCCEPFGSA-N 2 0 210.365 2.153 20 0 BEADRP CSC1(C[NH2+][C@@H](C)[C@H]2CCC[NH2+]2)CCC1 ZINC000400507644 533511709 /nfs/dbraw/zinc/51/17/09/533511709.db2.gz IJPKATJFZVABQR-WDEREUQCSA-N 2 0 228.405 2.002 20 0 BEADRP C[C@@H]([NH2+][C@H](C)[C@@H]1CCC[NH2+]1)C1CCCC1 ZINC000400378484 533532416 /nfs/dbraw/zinc/53/24/16/533532416.db2.gz JMFGYNGFYSLMHM-WZRBSPASSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@@H]([NH2+][C@H](C)[C@H]1CCC[NH2+]1)C1CCCC1 ZINC000400378481 533533254 /nfs/dbraw/zinc/53/32/54/533533254.db2.gz JMFGYNGFYSLMHM-NQBHXWOUSA-N 2 0 210.365 2.295 20 0 BEADRP Cc1cc(N2CC[NH+](C3CCCC3)CC2)cc[nH+]1 ZINC000302226574 132261930 /nfs/dbraw/zinc/26/19/30/132261930.db2.gz STGQWLMAIJLCDE-UHFFFAOYSA-N 2 0 245.370 2.455 20 0 BEADRP CC(C)[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000036960315 132343041 /nfs/dbraw/zinc/34/30/41/132343041.db2.gz NSUQGRVQPONTDU-UHFFFAOYSA-N 2 0 219.332 2.048 20 0 BEADRP CC[C@H](C)[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000036960321 132343134 /nfs/dbraw/zinc/34/31/34/132343134.db2.gz YEUSSVLHSCFFIM-LBPRGKRZSA-N 2 0 233.359 2.439 20 0 BEADRP Cc1c[nH+]ccc1NCC1([NH+](C)C)CCC1 ZINC000165253313 133644312 /nfs/dbraw/zinc/64/43/12/133644312.db2.gz OHOQOHFCLWBZMT-UHFFFAOYSA-N 2 0 219.332 2.286 20 0 BEADRP CC(C)(C)CC[N@@H+]1C[C@@H]2CCC[C@H]([NH3+])[C@H]2C1 ZINC000252839421 133651972 /nfs/dbraw/zinc/65/19/72/133651972.db2.gz AWRUHZQSYDDKOA-AVGNSLFASA-N 2 0 224.392 2.482 20 0 BEADRP C[C@H]1CCSCC[N@@H+]1CC[C@@H]1CCC[NH+]1C ZINC000335938088 134013080 /nfs/dbraw/zinc/01/30/80/134013080.db2.gz OAFKSKFMSOHTBF-STQMWFEESA-N 2 0 242.432 2.298 20 0 BEADRP Cc1ccsc1C[N@H+]1CC[C@H](C)[C@H](C[NH3+])C1 ZINC000167607994 134153084 /nfs/dbraw/zinc/15/30/84/134153084.db2.gz DSFLDCQYYBKWSA-CMPLNLGQSA-N 2 0 238.400 2.473 20 0 BEADRP [NH3+]CCCC[NH2+]Cc1cc(F)cc(Cl)c1 ZINC000168254162 134161141 /nfs/dbraw/zinc/16/11/41/134161141.db2.gz ZXTAIDBZYASJTQ-UHFFFAOYSA-N 2 0 230.714 2.308 20 0 BEADRP C[C@H](c1cccc(F)c1)N1CCC[C@@H]([NH3+])C1 ZINC000217505859 134249026 /nfs/dbraw/zinc/24/90/26/134249026.db2.gz ZMDZCWJWCILZHW-ZWNOBZJWSA-N 2 0 222.307 2.310 20 0 BEADRP CS[C@H](C)C[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000169087492 134249720 /nfs/dbraw/zinc/24/97/20/134249720.db2.gz HHIFPTUBNVWPMY-JIMOISOXSA-N 2 0 236.384 2.472 20 0 BEADRP C[C@H](CC[NH3+])[NH2+]Cc1ccc(Cl)cc1 ZINC000220486734 134305346 /nfs/dbraw/zinc/30/53/46/134305346.db2.gz JJKZHABYPJDTET-SECBINFHSA-N 2 0 212.724 2.167 20 0 BEADRP Cc1ccc(C[NH2+][C@H](C)CC[NH3+])cc1C ZINC000220539992 134309878 /nfs/dbraw/zinc/30/98/78/134309878.db2.gz MOLSDJOAPFVJJI-GFCCVEGCSA-N 2 0 206.333 2.130 20 0 BEADRP CCC[C@H](C)C[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000226867015 134370168 /nfs/dbraw/zinc/37/01/68/134370168.db2.gz ZAJNUGLUQJHGEL-RWMBFGLXSA-N 2 0 212.381 2.495 20 0 BEADRP CCCC[NH+]1CCC([C@H]2CCC[NH2+]2)CC1 ZINC000063197884 134538598 /nfs/dbraw/zinc/53/85/98/134538598.db2.gz SMQHGKNNUYBRSV-CYBMUJFWSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@H](C[NH2+]C1CC(C)C1)C[NH+]1CCCCC1 ZINC000231787584 134545184 /nfs/dbraw/zinc/54/51/84/134545184.db2.gz NWNVOWWEYIJPRR-ROKHWSDSSA-N 2 0 224.392 2.497 20 0 BEADRP CCCCOCC[NH+]1CCC(C[NH2+]CC)CC1 ZINC000053659112 134745510 /nfs/dbraw/zinc/74/55/10/134745510.db2.gz BVPCJAPNCAQZKD-UHFFFAOYSA-N 2 0 242.407 2.125 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H]2CCC(C)(C)C2)C1 ZINC000250232137 135050374 /nfs/dbraw/zinc/05/03/74/135050374.db2.gz GHOCQOSCAARFEI-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)CCOCC[N@@H+]1CCC[C@@H]([C@H](C)[NH3+])C1 ZINC000250589282 135056292 /nfs/dbraw/zinc/05/62/92/135056292.db2.gz JTGRIYCOJRXFSV-UONOGXRCSA-N 2 0 242.407 2.108 20 0 BEADRP CC[C@@H]1CCC[N@H+](CC[C@H]2CC[NH2+]C2)C1 ZINC000251757252 135076372 /nfs/dbraw/zinc/07/63/72/135076372.db2.gz LSRKSKBSNXYOBT-CHWSQXEVSA-N 2 0 210.365 2.108 20 0 BEADRP CC[C@H]1CCC[N@H+](CC[C@H]2CC[NH2+]C2)C1 ZINC000251757258 135076697 /nfs/dbraw/zinc/07/66/97/135076697.db2.gz LSRKSKBSNXYOBT-QWHCGFSZSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]CCC[NH+](C)C)[C@H]1C ZINC000252087636 135082920 /nfs/dbraw/zinc/08/29/20/135082920.db2.gz DBWCMAHLRMJGQW-AGIUHOORSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H]1CCC[N@H+](C[C@@H]2CCC[NH2+]C2)[C@H]1C ZINC000252111300 135083491 /nfs/dbraw/zinc/08/34/91/135083491.db2.gz HUHIKYFQIDCGHS-FRRDWIJNSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H](C1CC1)[N@H+](CC1CC[NH2+]CC1)C1CC1 ZINC000086702095 135095200 /nfs/dbraw/zinc/09/52/00/135095200.db2.gz AFNZHKSFAWKEKD-LLVKDONJSA-N 2 0 222.376 2.249 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@H]2CCCC2(C)C)CC1 ZINC000086857119 135099495 /nfs/dbraw/zinc/09/94/95/135099495.db2.gz HPCZBKFAPJEGKI-ZDUSSCGKSA-N 2 0 224.392 2.497 20 0 BEADRP CSC[C@H](C)[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@@H]1C ZINC000252713718 135100775 /nfs/dbraw/zinc/10/07/75/135100775.db2.gz QAFINOGIMHLPGJ-FIQHERPVSA-N 2 0 230.421 2.056 20 0 BEADRP CCC[C@@H]1C[C@@H]1[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@H]1C ZINC000252732530 135104978 /nfs/dbraw/zinc/10/49/78/135104978.db2.gz VNTJYJUWWWZKQF-KSTCHIGDSA-N 2 0 224.392 2.493 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CC[N@H+](CCC2CCCC2)C1 ZINC000261535561 135108559 /nfs/dbraw/zinc/10/85/59/135108559.db2.gz ONXWXSRLUDJVDF-WCQYABFASA-N 2 0 210.365 2.236 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CCC[NH2+]CC1 ZINC000252793614 135110796 /nfs/dbraw/zinc/11/07/96/135110796.db2.gz XMAXGFPILDAGTE-AGIUHOORSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@]1(C[N@@H+]2CCCCC(C)(C)C2)CC[NH2+]C1 ZINC000261882912 135112203 /nfs/dbraw/zinc/11/22/03/135112203.db2.gz RIZMLUBEGZARNM-AWEZNQCLSA-N 2 0 224.392 2.498 20 0 BEADRP CC(C)CCC[N@@H+]1C[C@@H]2CCC[C@H]([NH3+])[C@H]2C1 ZINC000252861904 135114196 /nfs/dbraw/zinc/11/41/96/135114196.db2.gz NSIDJBWTQFTMLK-IHRRRGAJSA-N 2 0 224.392 2.482 20 0 BEADRP Cc1ccccc1C[NH2+][C@@H]1CC[N@@H+](C)C[C@H]1C ZINC000252891540 135116339 /nfs/dbraw/zinc/11/63/39/135116339.db2.gz KZMIYWIKDADWTO-UKRRQHHQSA-N 2 0 232.371 2.425 20 0 BEADRP C[C@@H]1C[C@H](C)[N@H+](CC[C@H]2CCC[NH2+]C2)C1 ZINC000253063070 135119936 /nfs/dbraw/zinc/11/99/36/135119936.db2.gz GIYRGRDOZNJLRL-FRRDWIJNSA-N 2 0 210.365 2.106 20 0 BEADRP C[NH2+]CCC[N@H+](C)C1CCC(C)(C)CC1 ZINC000087287408 135121710 /nfs/dbraw/zinc/12/17/10/135121710.db2.gz YFXUREWUMCTRCX-UHFFFAOYSA-N 2 0 212.381 2.497 20 0 BEADRP C[NH2+]CC1CC[NH+](CCC2CCCC2)CC1 ZINC000078526355 135129244 /nfs/dbraw/zinc/12/92/44/135129244.db2.gz NUBVJJAXHNYIIX-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP C(C1CCCCC1)[N@@H+]1CC[C@]2(CCC[NH2+]2)C1 ZINC000257690649 135139020 /nfs/dbraw/zinc/13/90/20/135139020.db2.gz NKRPDRPJGXNMJL-CQSZACIVSA-N 2 0 222.376 2.395 20 0 BEADRP Fc1cccc(C[NH+]2CCC3(CC[NH2+]C3)CC2)c1 ZINC000257699612 135140082 /nfs/dbraw/zinc/14/00/82/135140082.db2.gz PSJHCMDKUFXERL-UHFFFAOYSA-N 2 0 248.345 2.401 20 0 BEADRP C[C@@H](c1ccccn1)[NH+]1CCC2(CC[NH2+]C2)CC1 ZINC000257710317 135141149 /nfs/dbraw/zinc/14/11/49/135141149.db2.gz NPNRVLHWEANPFH-ZDUSSCGKSA-N 2 0 245.370 2.218 20 0 BEADRP C[NH2+]CCC[N@H+](C)CCC1CCCCC1 ZINC000087473703 135143719 /nfs/dbraw/zinc/14/37/19/135143719.db2.gz KZGOVXJQKONBER-UHFFFAOYSA-N 2 0 212.381 2.498 20 0 BEADRP C[C@H]([NH3+])C1CC[NH+](CC2(C)CCC2)CC1 ZINC000261529868 135156266 /nfs/dbraw/zinc/15/62/66/135156266.db2.gz BPUVPPSRMCTFRD-NSHDSACASA-N 2 0 210.365 2.236 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CC[NH2+]C[C@H]1C ZINC000261530650 135158122 /nfs/dbraw/zinc/15/81/22/135158122.db2.gz CYYRJSOLBOGOQU-NDBYEHHHSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H](C1CC1)[N@H+](C)C[C@H]1CC[NH2+][C@H](C)C1 ZINC000261530768 135158330 /nfs/dbraw/zinc/15/83/30/135158330.db2.gz CZKPCMOMCASSEL-UTUOFQBUSA-N 2 0 210.365 2.105 20 0 BEADRP Cc1ccsc1C[NH2+][C@@H]1CC[NH2+]C[C@H]1C ZINC000261531015 135158782 /nfs/dbraw/zinc/15/87/82/135158782.db2.gz DWXJUYNIXBLYCU-GHMZBOCLSA-N 2 0 224.373 2.144 20 0 BEADRP C[C@H]1C[NH2+]CC[C@@H]1[NH2+]C1CCCCCC1 ZINC000261531026 135159157 /nfs/dbraw/zinc/15/91/57/135159157.db2.gz DXNOHFVBMYCCIG-AAEUAGOBSA-N 2 0 210.365 2.297 20 0 BEADRP Cc1ccsc1C[NH2+][C@@H]1CC[NH2+]C[C@@H]1C ZINC000261531018 135159196 /nfs/dbraw/zinc/15/91/96/135159196.db2.gz DWXJUYNIXBLYCU-WDEREUQCSA-N 2 0 224.373 2.144 20 0 BEADRP C[C@H]1C[NH2+]CC[C@H]1[NH2+]C1CCCCCC1 ZINC000261531028 135159476 /nfs/dbraw/zinc/15/94/76/135159476.db2.gz DXNOHFVBMYCCIG-WCQYABFASA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[NH2+]C[C@H]1C)C1CCCC1 ZINC000261531171 135160072 /nfs/dbraw/zinc/16/00/72/135160072.db2.gz FLOPIFHKIVAEEP-WZRBSPASSA-N 2 0 210.365 2.153 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CC[NH2+]C[C@@H]2C)s1 ZINC000261531943 135161701 /nfs/dbraw/zinc/16/17/01/135161701.db2.gz ILRXSYUARHTXEA-CABZTGNLSA-N 2 0 224.373 2.144 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CC[NH2+]C[C@H]2C)s1 ZINC000261531945 135161915 /nfs/dbraw/zinc/16/19/15/135161915.db2.gz ILRXSYUARHTXEA-SKDRFNHKSA-N 2 0 224.373 2.144 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+][C@H]1CCCC[C@@H]1C[NH3+] ZINC000261533199 135163954 /nfs/dbraw/zinc/16/39/54/135163954.db2.gz KLGWZNIDTULJDQ-WOPDTQHZSA-N 2 0 210.365 2.282 20 0 BEADRP CS[C@@H]1CCC[C@H]([NH2+][C@@H]2CCC[C@H]2C[NH3+])C1 ZINC000261534120 135166162 /nfs/dbraw/zinc/16/61/62/135166162.db2.gz NIVIQGCIOSYNSZ-WUHRBBMRSA-N 2 0 242.432 2.378 20 0 BEADRP Cc1ccc(CN2C[C@@H](C)[C@H]([NH3+])C2)c(C)c1 ZINC000261534313 135166502 /nfs/dbraw/zinc/16/65/02/135166502.db2.gz PVDVYHSYHAJGHT-TZMCWYRMSA-N 2 0 218.344 2.082 20 0 BEADRP CC[N@H+](CC1CCC1)C[C@H]1CC[NH2+][C@H](C)C1 ZINC000261534465 135167137 /nfs/dbraw/zinc/16/71/37/135167137.db2.gz QSRIDKGPERMGCK-OCCSQVGLSA-N 2 0 224.392 2.497 20 0 BEADRP C[N@H+](CC1CC[NH2+]CC1)[C@H]1CCC(C)(C)C1 ZINC000087772953 135167735 /nfs/dbraw/zinc/16/77/35/135167735.db2.gz LMAHMNQYFDVREP-ZDUSSCGKSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1[nH+]ccc(NCC2([NH3+])CCC2)c1Cl ZINC000261535628 135170425 /nfs/dbraw/zinc/17/04/25/135170425.db2.gz OVNZHTHRBZAQFG-UHFFFAOYSA-N 2 0 225.723 2.337 20 0 BEADRP C[C@H]([NH2+]C1CCCCCC1)[C@@H]1CC[NH2+]C1 ZINC000261536670 135171856 /nfs/dbraw/zinc/17/18/56/135171856.db2.gz SKYWOOLCFUAMMB-NWDGAFQWSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]([NH2+]C1CCCCCC1)[C@H]1CC[NH2+]C1 ZINC000261536669 135172009 /nfs/dbraw/zinc/17/20/09/135172009.db2.gz SKYWOOLCFUAMMB-NEPJUHHUSA-N 2 0 210.365 2.297 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]1[NH2+]Cc1cccs1 ZINC000261537129 135172788 /nfs/dbraw/zinc/17/27/88/135172788.db2.gz UYKOSCKBDIZBRL-NSHDSACASA-N 2 0 224.373 2.226 20 0 BEADRP CC[N@H+](C[C@@H]1CCC[NH2+]C1)[C@H](C)C(C)C ZINC000261537022 135173011 /nfs/dbraw/zinc/17/30/11/135173011.db2.gz UPBZWXISNFUCNT-CHWSQXEVSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@H]2CCC[NH2+]2)C[C@H]1C ZINC000261537704 135175049 /nfs/dbraw/zinc/17/50/49/135175049.db2.gz WFELSUDSWVFUSN-FVCCEPFGSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1CCC[C@@H]1C[NH2+][C@H]1CCC[C@@H]1C[NH3+] ZINC000261538369 135175211 /nfs/dbraw/zinc/17/52/11/135175211.db2.gz XWFMTTYWDJUQSL-LPWJVIDDSA-N 2 0 210.365 2.140 20 0 BEADRP C[C@@H]1CCC[C@@H]1C[NH2+][C@H]1CCC[C@H]1C[NH3+] ZINC000261538370 135175259 /nfs/dbraw/zinc/17/52/59/135175259.db2.gz XWFMTTYWDJUQSL-XQHKEYJVSA-N 2 0 210.365 2.140 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@H]2CCC[NH2+]2)[C@@H](C)C1 ZINC000261538780 135177030 /nfs/dbraw/zinc/17/70/30/135177030.db2.gz ZHEQYJQCLGTVCK-XQHKEYJVSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[NH2+]C[C@H]1C)c1ccccc1 ZINC000261540470 135179552 /nfs/dbraw/zinc/17/95/52/135179552.db2.gz AGBXKHCZLDHUEK-UMVBOHGHSA-N 2 0 232.371 2.378 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@@](C)(C[NH3+])C2)c(C)c1 ZINC000261540949 135180502 /nfs/dbraw/zinc/18/05/02/135180502.db2.gz ARQZMUWYKRFGPB-HNNXBMFYSA-N 2 0 232.371 2.474 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]CC[C@H]1CCCCO1 ZINC000261542206 135182775 /nfs/dbraw/zinc/18/27/75/135182775.db2.gz NSYQRFYQGDCNLK-MJBXVCDLSA-N 2 0 240.391 2.053 20 0 BEADRP CC[C@@H]1[C@H](C)CC[N@@H+]1C[C@@H]1CCC[NH2+]C1 ZINC000261548323 135186682 /nfs/dbraw/zinc/18/66/82/135186682.db2.gz NKKWLYVOQIBZHK-JHJVBQTASA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@@H]1[C@@H](C)CC[N@@H+]1C[C@@H]1CCC[NH2+]C1 ZINC000261548325 135187104 /nfs/dbraw/zinc/18/71/04/135187104.db2.gz NKKWLYVOQIBZHK-YNEHKIRRSA-N 2 0 210.365 2.106 20 0 BEADRP Cc1ncsc1C[NH+]1CCC([C@@H](C)[NH3+])CC1 ZINC000084149520 135188485 /nfs/dbraw/zinc/18/84/85/135188485.db2.gz BGQAIOORAWURKC-SECBINFHSA-N 2 0 239.388 2.011 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[NH2+]C[C@@H]1C)c1cccc(F)c1 ZINC000261550637 135189117 /nfs/dbraw/zinc/18/91/17/135189117.db2.gz LIKUGSIBXPTPGL-MJVIPROJSA-N 2 0 236.334 2.474 20 0 BEADRP CC[C@H]([NH2+]CC(C)(C)[NH3+])c1ccc(OC)cc1 ZINC000261551314 135190378 /nfs/dbraw/zinc/19/03/78/135190378.db2.gz MCKFBVPSICEVEY-ZDUSSCGKSA-N 2 0 236.359 2.473 20 0 BEADRP Cc1cccc(C[N@@H+]2CC[C@H]3[NH2+]CC[C@@H]3C2)c1C ZINC000261553061 135191931 /nfs/dbraw/zinc/19/19/31/135191931.db2.gz ABOOVRFOPLPRTJ-HZPDHXFCSA-N 2 0 244.382 2.487 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CCC[C@@H]1C[NH3+] ZINC000084217761 135192810 /nfs/dbraw/zinc/19/28/10/135192810.db2.gz AMVCXRFNOSPKSL-FVCCEPFGSA-N 2 0 210.365 2.282 20 0 BEADRP COc1ccc(C[N@@H+]2CC[C@@](C)(C[NH3+])C2)cc1C ZINC000261554949 135194556 /nfs/dbraw/zinc/19/45/56/135194556.db2.gz BDBBDAJZYOYZMX-HNNXBMFYSA-N 2 0 248.370 2.174 20 0 BEADRP Cc1ccc(C)c(C[N@@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@@H]3C2)c1 ZINC000261556910 135197144 /nfs/dbraw/zinc/19/71/44/135197144.db2.gz CFRTWQJWHXLSGL-NUEKZKHPSA-N 2 0 244.382 2.473 20 0 BEADRP C[C@H]([NH3+])CN(C)Cc1ccc(OC(F)F)cc1 ZINC000261558470 135199318 /nfs/dbraw/zinc/19/93/18/135199318.db2.gz SMZWXFPXUMSLPZ-VIFPVBQESA-N 2 0 244.285 2.067 20 0 BEADRP C[C@@H]1[C@H]([NH3+])CCN1Cc1cccc(C2CC2)c1 ZINC000261558865 135199420 /nfs/dbraw/zinc/19/94/20/135199420.db2.gz SUIRFAXHGTYVFR-IAQYHMDHSA-N 2 0 230.355 2.486 20 0 BEADRP C1CC2CCC1C[C@H]2[NH2+][C@H]1CCC[NH2+]CC1 ZINC000261558904 135199459 /nfs/dbraw/zinc/19/94/59/135199459.db2.gz YQCDSFYXNNVSEG-CLRIEMFWSA-N 2 0 222.376 2.297 20 0 BEADRP Cc1ccccc1C[N@@H+]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000261561708 135202686 /nfs/dbraw/zinc/20/26/86/135202686.db2.gz VRTWUIFDHCVLAI-HIFRSBDPSA-N 2 0 230.355 2.036 20 0 BEADRP Cc1ccccc1C[N@@H+]1CC[C@H]2[NH2+]CC[C@H]2C1 ZINC000261561681 135203038 /nfs/dbraw/zinc/20/30/38/135203038.db2.gz VPESSKODPJYVGW-LSDHHAIUSA-N 2 0 230.355 2.179 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+]C[C@H]1CCCC[C@H]1C ZINC000261562833 135204465 /nfs/dbraw/zinc/20/44/65/135204465.db2.gz BQJMWPCPNFEZPE-AAVRWANBSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H](c1ccccc1)[N@@H+]1C[C@@H]2CC[C@H]([NH3+])[C@H]2C1 ZINC000261562947 135205313 /nfs/dbraw/zinc/20/53/13/135205313.db2.gz WSZJTFIYZKVUHL-UNQGMJICSA-N 2 0 230.355 2.417 20 0 BEADRP Cc1ccc(F)cc1C[N@@H+]1C[C@@H]2CC[C@@H]([NH3+])[C@H]2C1 ZINC000261564737 135206718 /nfs/dbraw/zinc/20/67/18/135206718.db2.gz HLFFRXGXANSTNY-TUKIKUTGSA-N 2 0 248.345 2.303 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CC[NH2+]C[C@H]2C)cc1 ZINC000261567795 135209371 /nfs/dbraw/zinc/20/93/71/135209371.db2.gz FDECRWUYGUMLAU-OCCSQVGLSA-N 2 0 218.344 2.083 20 0 BEADRP Cc1ccccc1C[C@H](C)[NH2+][C@@H](C)[C@H](C)[NH3+] ZINC000261568613 135210018 /nfs/dbraw/zinc/21/00/18/135210018.db2.gz FQOYLXKHECKHQT-AVGNSLFASA-N 2 0 220.360 2.251 20 0 BEADRP COc1ccc([C@H](C)[NH2+][C@H]2CC[NH2+]C[C@H]2C)cc1 ZINC000261571455 135213097 /nfs/dbraw/zinc/21/30/97/135213097.db2.gz LBJOXEMJARCBEZ-XUJVJEKNSA-N 2 0 248.370 2.344 20 0 BEADRP CCOc1ccccc1C[N@@H+]1CC[C@](C)(C[NH3+])C1 ZINC000261572624 135214507 /nfs/dbraw/zinc/21/45/07/135214507.db2.gz LVHGZQMHBWDYQX-OAHLLOKOSA-N 2 0 248.370 2.256 20 0 BEADRP Cc1ccc(C[NH2+][C@](C)(C[NH3+])C(C)C)cc1 ZINC000261575431 135216470 /nfs/dbraw/zinc/21/64/70/135216470.db2.gz JRYNUCDONJQCOP-CQSZACIVSA-N 2 0 220.360 2.458 20 0 BEADRP [NH3+][C@@H]1CC[C@@H]2C[N@H+](CC3CCCCC3)C[C@H]12 ZINC000261574648 135216917 /nfs/dbraw/zinc/21/69/17/135216917.db2.gz JKCGDQCQVPLBHE-HZSPNIEDSA-N 2 0 222.376 2.236 20 0 BEADRP C[C@H]1C[C@H]([NH2+][C@@H]2CC[NH2+]C[C@H]2C)C[C@@H](C)C1 ZINC000261576033 135217703 /nfs/dbraw/zinc/21/77/03/135217703.db2.gz KBEUSITWVORGFM-XHJNMGKDSA-N 2 0 224.392 2.399 20 0 BEADRP Cc1cccc(C)c1C[N@@H+]1C[C@@H]2CC[C@@H]([NH3+])[C@@H]2C1 ZINC000261578014 135218867 /nfs/dbraw/zinc/21/88/67/135218867.db2.gz ORUGOYHYMZZVAS-NUEKZKHPSA-N 2 0 244.382 2.473 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@@H]1CCC[C@H](C)[C@H]1C ZINC000261579859 135220470 /nfs/dbraw/zinc/22/04/70/135220470.db2.gz MMOFBQOOYKBZPI-MQLXINIDSA-N 2 0 224.392 2.399 20 0 BEADRP C[NH2+]C[C@@H]1CCN(c2cc[nH+]c(C)c2Cl)C1 ZINC000261580760 135221902 /nfs/dbraw/zinc/22/19/02/135221902.db2.gz NCYSPRUPADECNY-JTQLQIEISA-N 2 0 239.750 2.089 20 0 BEADRP C[C@H](C[N@@H+]1CC[C@H]2[NH2+]CC[C@@H]2C1)c1ccccc1 ZINC000261581568 135222105 /nfs/dbraw/zinc/22/21/05/135222105.db2.gz QSNZEXOQHWFZSE-FVQBIDKESA-N 2 0 244.382 2.474 20 0 BEADRP C[C@H](C[N@@H+]1CC[C@H]2[NH2+]CC[C@H]2C1)c1ccccc1 ZINC000261581570 135222137 /nfs/dbraw/zinc/22/21/37/135222137.db2.gz QSNZEXOQHWFZSE-VNQPRFMTSA-N 2 0 244.382 2.474 20 0 BEADRP CC(C)(C)CC[N@@H+]1C[C@@H]2CCC[C@H]([NH3+])[C@@H]2C1 ZINC000164370819 135224743 /nfs/dbraw/zinc/22/47/43/135224743.db2.gz AWRUHZQSYDDKOA-XQQFMLRXSA-N 2 0 224.392 2.482 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@H]1CCc2ccccc2C1 ZINC000261584116 135225408 /nfs/dbraw/zinc/22/54/08/135225408.db2.gz SCKFFWXHOUAKSU-KCXAZCMYSA-N 2 0 244.382 2.132 20 0 BEADRP C(C1CCCCC1)[N@@H+]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000261584824 135226052 /nfs/dbraw/zinc/22/60/52/135226052.db2.gz QBAJWFPYERFNAI-UONOGXRCSA-N 2 0 222.376 2.108 20 0 BEADRP Cc1[nH+]ccc(N2CC[NH2+]C(C)(C)C2)c1Cl ZINC000261585973 135226914 /nfs/dbraw/zinc/22/69/14/135226914.db2.gz QSTKCWIMZKMLCF-UHFFFAOYSA-N 2 0 239.750 2.232 20 0 BEADRP Cc1ccc(C)c(C[N@@H+]2CC[C@H]3C[NH2+]C[C@@H]3C2)c1 ZINC000261585620 135227169 /nfs/dbraw/zinc/22/71/69/135227169.db2.gz TYCRLJLTKXELAM-GOEBONIOSA-N 2 0 244.382 2.345 20 0 BEADRP Cc1cccc(C)c1C[N@@H+]1CC[C@H]2[NH2+]CC[C@@H]2C1 ZINC000261593517 135234500 /nfs/dbraw/zinc/23/45/00/135234500.db2.gz ZFNACOHVQZINRO-GDBMZVCRSA-N 2 0 244.382 2.487 20 0 BEADRP C(C1CCCCC1)[N@@H+]1CC[C@@H]2[NH2+]CC[C@H]2C1 ZINC000261597531 135236876 /nfs/dbraw/zinc/23/68/76/135236876.db2.gz ZEUMRFFJIRUTRN-KBPBESRZSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@H]1CC[N@H+](CCC2CCCC2)C[C@H]1C[NH3+] ZINC000261599724 135237891 /nfs/dbraw/zinc/23/78/91/135237891.db2.gz ZZCHRKGNHGFAAW-GXTWGEPZSA-N 2 0 224.392 2.483 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[N@@H+]1CC[C@](C)(C[NH3+])C1 ZINC000261682782 135245834 /nfs/dbraw/zinc/24/58/34/135245834.db2.gz HBZMKQIFUMZRRY-MGPQQGTHSA-N 2 0 224.392 2.483 20 0 BEADRP CCC[N@H+](Cc1cccc(N)c1)C1CC[NH2+]CC1 ZINC000261700821 135246480 /nfs/dbraw/zinc/24/64/80/135246480.db2.gz ODESWBWQFTXMJZ-UHFFFAOYSA-N 2 0 247.386 2.233 20 0 BEADRP C[C@H]1C[N@H+](C[C@@]2(C)CC[NH2+]C2)CC(C)(C)C1 ZINC000261714635 135247603 /nfs/dbraw/zinc/24/76/03/135247603.db2.gz FBDCNGKZOCFCTC-OCCSQVGLSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H]1CC[C@]2(CC[N@H+](C[C@]3(C)CC[NH2+]C3)C2)C1 ZINC000261742112 135249082 /nfs/dbraw/zinc/24/90/82/135249082.db2.gz IPYBQJWJXJRRKF-KFWWJZLASA-N 2 0 236.403 2.498 20 0 BEADRP C[C@@H]1CC2(CCC2)C[N@@H+]1C[C@@H]1CCC[NH2+]C1 ZINC000261749099 135249815 /nfs/dbraw/zinc/24/98/15/135249815.db2.gz LRJOZIXNYFPQDR-CHWSQXEVSA-N 2 0 222.376 2.251 20 0 BEADRP CCC[C@@H]1CCC[N@H+](C[C@]2(C)CC[NH2+]C2)C1 ZINC000261758075 135250719 /nfs/dbraw/zinc/25/07/19/135250719.db2.gz KXDZCGZFQXKGMY-ZIAGYGMSSA-N 2 0 224.392 2.498 20 0 BEADRP CCC[N@H+](C[C@@H]1CCSC1)C1CC[NH2+]CC1 ZINC000261778118 135251485 /nfs/dbraw/zinc/25/14/85/135251485.db2.gz FHEOXBJQOGOTDL-LBPRGKRZSA-N 2 0 242.432 2.204 20 0 BEADRP C[C@H]1CC[N@H+](CC2CC[NH2+]CC2)CC1(C)C ZINC000261819321 135255478 /nfs/dbraw/zinc/25/54/78/135255478.db2.gz IFZIYVJNCXVJJX-LBPRGKRZSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@]1(C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)CC[NH2+]C1 ZINC000261878418 135258965 /nfs/dbraw/zinc/25/89/65/135258965.db2.gz QJZOMRMSMUUOLH-KGLIPLIRSA-N 2 0 233.359 2.151 20 0 BEADRP C[C@@]1(C[N@@H+]2CCC[C@H]2c2ccc[nH]2)CC[NH2+]C1 ZINC000261878422 135259259 /nfs/dbraw/zinc/25/92/59/135259259.db2.gz QJZOMRMSMUUOLH-UONOGXRCSA-N 2 0 233.359 2.151 20 0 BEADRP C[C@@H]1C[C@@H]1CN(CC[NH3+])Cc1ccccc1 ZINC000261943964 135264799 /nfs/dbraw/zinc/26/47/99/135264799.db2.gz NDDYWENBQGVLOO-TZMCWYRMSA-N 2 0 218.344 2.103 20 0 BEADRP C[C@@H]1C[N@H+](C[C@@H]2CCC[NH2+]C2)CC(C)(C)C1 ZINC000261985111 135269481 /nfs/dbraw/zinc/26/94/81/135269481.db2.gz RVGZBQXHIWFXSL-QWHCGFSZSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@H]1C[C@H]1C[N@@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000262017357 135272749 /nfs/dbraw/zinc/27/27/49/135272749.db2.gz VUNZJOKHBPPRGI-HNKHHVNMSA-N 2 0 244.382 2.317 20 0 BEADRP CC(C)[C@H]1CCC[N@H+](CC2CC[NH2+]CC2)C1 ZINC000262054188 135277313 /nfs/dbraw/zinc/27/73/13/135277313.db2.gz ZZTZVFLLTCVKON-AWEZNQCLSA-N 2 0 224.392 2.354 20 0 BEADRP CCO[C@H](CC[NH+](C)C)C[NH2+]C1CC(CC)C1 ZINC000342736969 135309292 /nfs/dbraw/zinc/30/92/92/135309292.db2.gz QHLJFZSIZQDDCL-JXQTWKCFSA-N 2 0 242.407 2.121 20 0 BEADRP CCO[C@@H](CC[NH+](C)C)C[NH2+]C1CC(CC)C1 ZINC000342736970 135309603 /nfs/dbraw/zinc/30/96/03/135309603.db2.gz QHLJFZSIZQDDCL-RUXDESIVSA-N 2 0 242.407 2.121 20 0 BEADRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@@H]1CCC1(C)C ZINC000342735910 135316967 /nfs/dbraw/zinc/31/69/67/135316967.db2.gz PTWMSWLWOSOTJE-QWHCGFSZSA-N 2 0 242.407 2.121 20 0 BEADRP CC(C)CC[N@@H+]1CCC[C@@H]2C[NH+](C)CC[C@H]21 ZINC000334356232 135369502 /nfs/dbraw/zinc/36/95/02/135369502.db2.gz MTUINFFTJLUFAL-ZIAGYGMSSA-N 2 0 224.392 2.449 20 0 BEADRP CCC[N@H+](C)C[C@@H]1CC[NH+](CC2CCC2)C1 ZINC000081517051 135387274 /nfs/dbraw/zinc/38/72/74/135387274.db2.gz URSXZUDFLCDMCE-AWEZNQCLSA-N 2 0 224.392 2.450 20 0 BEADRP C[NH+](C)CCC[NH2+][C@H]1CCC[C@H](C2CC2)C1 ZINC000081624256 135388481 /nfs/dbraw/zinc/38/84/81/135388481.db2.gz VTVATOHGEBIAKP-KBPBESRZSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH+](C)CCC[NH2+][C@@H]1CCC[C@H](C2CC2)C1 ZINC000081624253 135388874 /nfs/dbraw/zinc/38/88/74/135388874.db2.gz VTVATOHGEBIAKP-UONOGXRCSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCc2nc[nH]c2C1)c1ccccn1 ZINC000334405933 135393984 /nfs/dbraw/zinc/39/39/84/135393984.db2.gz HOJPAJTUFDPULV-MNOVXSKESA-N 2 0 242.326 2.013 20 0 BEADRP CCC1(C)CC[NH+](CC[C@@H]2CC[NH2+]C2)CC1 ZINC000084385825 135470747 /nfs/dbraw/zinc/47/07/47/135470747.db2.gz LKLKCUVXHFRKBH-ZDUSSCGKSA-N 2 0 224.392 2.498 20 0 BEADRP Cc1ccc(C[NH2+]CC[C@H]2CC[NH2+]C2)s1 ZINC000084385639 135471228 /nfs/dbraw/zinc/47/12/28/135471228.db2.gz PPAXQCFMOIEYTH-LLVKDONJSA-N 2 0 224.373 2.146 20 0 BEADRP C(CC1CC1)[NH2+][C@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000086494536 135492235 /nfs/dbraw/zinc/49/22/35/135492235.db2.gz NHIDYHLFFLFSTE-IHRRRGAJSA-N 2 0 222.376 2.297 20 0 BEADRP COCc1cccc(C[NH+]2CCC(C[NH3+])CC2)c1 ZINC000088555212 135523619 /nfs/dbraw/zinc/52/36/19/135523619.db2.gz MIDGEDLSQJQNMI-UHFFFAOYSA-N 2 0 248.370 2.004 20 0 BEADRP COCc1cccc(C[NH2+][C@@H]2CCC[C@H]2C[NH3+])c1 ZINC000089150222 135531624 /nfs/dbraw/zinc/53/16/24/135531624.db2.gz BWKLLHWGOGOJMA-LSDHHAIUSA-N 2 0 248.370 2.050 20 0 BEADRP C[C@H]1CCC[C@@H]1[NH2+]CC1(C)CC[NH2+]CC1 ZINC000334863181 135826811 /nfs/dbraw/zinc/82/68/11/135826811.db2.gz MNADEMAWNYTTLA-RYUDHWBXSA-N 2 0 210.365 2.154 20 0 BEADRP c1ccc2c(c1)CC[C@@H]2[NH2+]CC1=CC[NH2+]CC1 ZINC000335061531 135886161 /nfs/dbraw/zinc/88/61/61/135886161.db2.gz YITURQPKQRWRQB-HNNXBMFYSA-N 2 0 228.339 2.183 20 0 BEADRP C[C@@H]([NH3+])c1ccc(N[C@@H]2CCC[NH2+]CC2)cc1 ZINC000335178683 135936763 /nfs/dbraw/zinc/93/67/63/135936763.db2.gz ODZVUEDNZQTWOK-DGCLKSJQSA-N 2 0 233.359 2.260 20 0 BEADRP Fc1ccc(C2([NH2+]CC3CC[NH2+]CC3)CC2)cc1 ZINC000346991245 135987807 /nfs/dbraw/zinc/98/78/07/135987807.db2.gz TYGUDGUPWAPSTN-UHFFFAOYSA-N 2 0 248.345 2.404 20 0 BEADRP CC[C@@H]1CCC[N@H+](CCc2cncn2C)C1 ZINC000347738916 136004981 /nfs/dbraw/zinc/00/49/81/136004981.db2.gz WZBJNCCLHZSNMP-GFCCVEGCSA-N 2 0 221.348 2.085 20 0 BEADRP Cc1ccccc1C[NH2+][C@@H]1CCc2nc[nH]c2C1 ZINC000335325967 136051951 /nfs/dbraw/zinc/05/19/51/136051951.db2.gz MYVRAHVCWBNZEJ-CYBMUJFWSA-N 2 0 241.338 2.365 20 0 BEADRP [NH3+]C1CCC([NH2+][C@H]2CCC[C@H](F)C2)CC1 ZINC000335385533 136089116 /nfs/dbraw/zinc/08/91/16/136089116.db2.gz LFINREFOZPWSIH-XKGSQUFQSA-N 2 0 214.328 2.127 20 0 BEADRP Cc1cccc2c1[C@@H](C)C[C@H]2[NH2+]CC1C[NH2+]C1 ZINC000335551540 136097985 /nfs/dbraw/zinc/09/79/85/136097985.db2.gz HKYVJVUJEWOGIN-SMDDNHRTSA-N 2 0 230.355 2.352 20 0 BEADRP C[C@@H]1CC(C)(C)CC[C@@H]1[NH2+]CC1C[NH2+]C1 ZINC000335551592 136098122 /nfs/dbraw/zinc/09/81/22/136098122.db2.gz KBXDTSBTDHWMRL-PWSUYJOCSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CC2C[NH2+]C2)c2ccccc21 ZINC000335551936 136098441 /nfs/dbraw/zinc/09/84/41/136098441.db2.gz LNJGAAHTZOCBNH-IAQYHMDHSA-N 2 0 230.355 2.434 20 0 BEADRP C[C@@H]1CCc2c(F)cccc2[C@H]1[NH2+]CC1C[NH2+]C1 ZINC000335553048 136098876 /nfs/dbraw/zinc/09/88/76/136098876.db2.gz STZVDGFCNOPRGJ-BMIGLBTASA-N 2 0 248.345 2.258 20 0 BEADRP COC1CCC([NH2+][C@H]2CCCCC[C@@H]2[NH3+])CC1 ZINC000335595777 136104841 /nfs/dbraw/zinc/10/48/41/136104841.db2.gz PBMPTNPPDIEIIE-HOAMVYINSA-N 2 0 240.391 2.194 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]1[NH2+]C1CC(c2ccccc2)C1 ZINC000335562407 136106454 /nfs/dbraw/zinc/10/64/54/136106454.db2.gz VZMNMPHSWGCCRV-WUCCLRPBSA-N 2 0 230.355 2.402 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C2CCC(C[NH3+])CC2)C1 ZINC000335567631 136108174 /nfs/dbraw/zinc/10/81/74/136108174.db2.gz MEMYPDZSIWWHDY-XVSSEFHLSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+]C2CCC(C[NH3+])CC2)C1 ZINC000335567632 136108183 /nfs/dbraw/zinc/10/81/83/136108183.db2.gz MEMYPDZSIWWHDY-YWPUVAFDSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1Cc2ccc(F)cc2[C@H]1[NH2+]C1CC[NH2+]CC1 ZINC000335568794 136108644 /nfs/dbraw/zinc/10/86/44/136108644.db2.gz SOWGQAWPNHMSOS-BMIGLBTASA-N 2 0 248.345 2.401 20 0 BEADRP C[C@@H]1C[C@H](N)C[N@@H+]1CCC(C)(C)C1CC1 ZINC000405983530 397778678 /nfs/dbraw/zinc/77/86/78/397778678.db2.gz BJERUDWDKUNUDD-PWSUYJOCSA-N 2 0 210.365 2.234 20 0 BEADRP C[C@H](CC1CC1)[NH2+]C[C@H]1CCCC[N@H+](C)C1 ZINC000624121272 397801203 /nfs/dbraw/zinc/80/12/03/397801203.db2.gz SBWSGUJIOLOLOM-TZMCWYRMSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+]Cc2cc[nH]c2)C1 ZINC000178828548 397849099 /nfs/dbraw/zinc/84/90/99/397849099.db2.gz HVHHOXYVTGGQBP-HNNXBMFYSA-N 2 0 249.402 2.472 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000388106839 397871314 /nfs/dbraw/zinc/87/13/14/397871314.db2.gz XVXHKKGSJKJTOS-ZOBORPQBSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@@H]([NH2+]CCC[NH3+])[C@@H]1CC2CCC1CC2 ZINC000382158589 397915721 /nfs/dbraw/zinc/91/57/21/397915721.db2.gz OYOIMBROBAXMCC-XVSSEFHLSA-N 2 0 210.365 2.140 20 0 BEADRP C[N@@H+]1CCC[C@H]1CC[NH+]1CCC12CCCC2 ZINC000649657804 398025322 /nfs/dbraw/zinc/02/53/22/398025322.db2.gz NKFDPAZPMATBLH-ZDUSSCGKSA-N 2 0 222.376 2.489 20 0 BEADRP Cc1ccoc1CN1CC[C@@H]2CC[N@@H+](C)C[C@@H]21 ZINC000272625695 397980159 /nfs/dbraw/zinc/98/01/59/397980159.db2.gz MNNJFUBWGPABCX-STQMWFEESA-N 2 0 234.343 2.114 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H](C)Cc1ccccc1F ZINC000414851556 398059696 /nfs/dbraw/zinc/05/96/96/398059696.db2.gz PISVINQRJWRIIA-RYUDHWBXSA-N 2 0 238.350 2.202 20 0 BEADRP C[C@H](Cc1cccs1)[NH2+][C@H](C)[C@H](C)[NH3+] ZINC000389297140 398068654 /nfs/dbraw/zinc/06/86/54/398068654.db2.gz GZLDWBYAPUDLEI-KXUCPTDWSA-N 2 0 212.362 2.004 20 0 BEADRP CCC(CC)(CC)[NH2+]C[C@H](O)C[N@H+](C)C(C)C ZINC000383923126 398052063 /nfs/dbraw/zinc/05/20/63/398052063.db2.gz DEKYVQSOYWXSTI-ZDUSSCGKSA-N 2 0 244.423 2.246 20 0 BEADRP C[C@@H](C[C@@H]1CCC[NH2+]1)[NH2+]Cc1cccs1 ZINC000086495075 398055361 /nfs/dbraw/zinc/05/53/61/398055361.db2.gz BGFUIWFWYWWSQS-QWRGUYRKSA-N 2 0 224.373 2.368 20 0 BEADRP CCC(CC)(C[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1)OC ZINC000383993541 398055535 /nfs/dbraw/zinc/05/55/35/398055535.db2.gz NMHJWAJLKZOGPY-STQMWFEESA-N 2 0 242.407 2.264 20 0 BEADRP CC[C@@H]1CCC[C@H]([NH2+]C[C@@H](C)C[NH2+]C)C1 ZINC000414850675 398057478 /nfs/dbraw/zinc/05/74/78/398057478.db2.gz ZRHRAXXISDCTKD-XQQFMLRXSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H]([NH2+]C1CCC([NH3+])CC1)c1ccco1 ZINC000051693186 398057839 /nfs/dbraw/zinc/05/78/39/398057839.db2.gz ATRGEZAPTSAXQR-WHXUTIOJSA-N 2 0 208.305 2.200 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CCCC1(F)F ZINC000390837718 398107649 /nfs/dbraw/zinc/10/76/49/398107649.db2.gz AOHDNFSZMCTOAU-AXFHLTTASA-N 2 0 232.318 2.139 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H]1CCc2ccccc2C1 ZINC000521607537 398097661 /nfs/dbraw/zinc/09/76/61/398097661.db2.gz WYUWZTHRPYANSP-HNNXBMFYSA-N 2 0 232.371 2.133 20 0 BEADRP C[C@@H](CCc1ccco1)[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000128907585 398097701 /nfs/dbraw/zinc/09/77/01/398097701.db2.gz CDVUKLZHBLNSSX-QWHCGFSZSA-N 2 0 236.359 2.332 20 0 BEADRP COc1ccc(C)cc1C[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000414932457 398111799 /nfs/dbraw/zinc/11/17/99/398111799.db2.gz VTQYHCCQCTUQAW-UONOGXRCSA-N 2 0 248.370 2.363 20 0 BEADRP CC(C)C[NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000052380101 167003454 /nfs/dbraw/zinc/00/34/54/167003454.db2.gz JSSLNGAUHRZVNL-OKILXGFUSA-N 2 0 242.407 2.121 20 0 BEADRP [NH3+]CCCC[NH+]1CCC2(CCCC2)CC1 ZINC000062952319 1172793761 /nfs/dbraw/zinc/79/37/61/1172793761.db2.gz LPGYXRVEFFUCNR-UHFFFAOYSA-N 2 0 210.365 2.382 20 0 BEADRP C[C@H]1CCC[C@@H]([NH2+]CC2CC[NH2+]CC2)C1 ZINC000086700459 322869120 /nfs/dbraw/zinc/86/91/20/322869120.db2.gz ZSIYQCDFIOJWDI-WCQYABFASA-N 2 0 210.365 2.154 20 0 BEADRP Cc1ccc(C[NH2+]CC[C@H]2CCC[NH2+]2)cc1 ZINC000258666296 322876105 /nfs/dbraw/zinc/87/61/05/322876105.db2.gz HEAVFHUTAGJHMV-CQSZACIVSA-N 2 0 218.344 2.227 20 0 BEADRP Cc1cc(C)c(C[NH2+]C[C@@H](C)C[NH3+])c(C)c1 ZINC000258810339 322876318 /nfs/dbraw/zinc/87/63/18/322876318.db2.gz SKJAWUVYMIFNOH-NSHDSACASA-N 2 0 220.360 2.296 20 0 BEADRP Cc1cc(C)c(C[NH2+]C[C@H](C)C[NH3+])cc1C ZINC000258779509 322877584 /nfs/dbraw/zinc/87/75/84/322877584.db2.gz OYSADRLRCRHEKN-SNVBAGLBSA-N 2 0 220.360 2.296 20 0 BEADRP Fc1ccc(C[NH2+]CC[C@H]2CCC[NH2+]2)cc1 ZINC000259064611 322879618 /nfs/dbraw/zinc/87/96/18/322879618.db2.gz RILSVUNYMYIBGM-CYBMUJFWSA-N 2 0 222.307 2.057 20 0 BEADRP Cc1ccc(C[NH2+]CC[C@H]2CC[NH2+]C2)c(C)c1 ZINC000259160122 322882246 /nfs/dbraw/zinc/88/22/46/322882246.db2.gz YASYSMWSDWRNSX-CQSZACIVSA-N 2 0 232.371 2.393 20 0 BEADRP CC1=C[C@H](C)C[C@H](C[NH+]2C[C@@H]3C[NH2+]C[C@H]3C2)C1 ZINC000685839071 487585149 /nfs/dbraw/zinc/58/51/49/487585149.db2.gz YWFMQHHTNUNLGK-MXAVVETBSA-N 2 0 234.387 2.130 20 0 BEADRP [NH3+]CC[C@@H]1CCCC[N@@H+]1CC1CC=CC1 ZINC000238598892 487587807 /nfs/dbraw/zinc/58/78/07/487587807.db2.gz IIVPGPJECHLTMJ-ZDUSSCGKSA-N 2 0 208.349 2.156 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CCC[NH+]2CCCCC2)CS1 ZINC000086934485 487590987 /nfs/dbraw/zinc/59/09/87/487590987.db2.gz XAKSNOVJLZIJKD-QWHCGFSZSA-N 2 0 242.432 2.346 20 0 BEADRP CC(C)Oc1ccc(C[NH2+]CCCC[NH3+])cc1 ZINC000037715393 167293591 /nfs/dbraw/zinc/29/35/91/167293591.db2.gz HLFDQKQHENMVAB-UHFFFAOYSA-N 2 0 236.359 2.302 20 0 BEADRP Cc1ccccc1C[NH2+][C@@H]1CC[C@@H]2C[N@@H+](C)C[C@@H]12 ZINC001651697438 1172977237 /nfs/dbraw/zinc/97/72/37/1172977237.db2.gz AACROSYEHBDTJL-BZUAXINKSA-N 2 0 244.382 2.425 20 0 BEADRP Cc1ccncc1C[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000162639897 487601513 /nfs/dbraw/zinc/60/15/13/487601513.db2.gz JEGWUEMMEAPIPO-ZDUSSCGKSA-N 2 0 247.386 2.210 20 0 BEADRP CC[C@H](CC(F)F)C[N@@H+]1CC[C@@]2(CC[NH2+]C2)C1 ZINC000662264457 409560091 /nfs/dbraw/zinc/56/00/91/409560091.db2.gz DHAXZANEWPIOHJ-DGCLKSJQSA-N 2 0 246.345 2.353 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](CC3CC=CC3)C[C@H]21 ZINC000662265087 409560282 /nfs/dbraw/zinc/56/02/82/409560282.db2.gz FUCICWBUZLRUSN-MGPQQGTHSA-N 2 0 220.360 2.012 20 0 BEADRP CCC[N@H+](CC1CC=CC1)C1CC[NH2+]CC1 ZINC000662265849 409560920 /nfs/dbraw/zinc/56/09/20/409560920.db2.gz WFBSKONXRZNESU-UHFFFAOYSA-N 2 0 222.376 2.417 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]2C[N@H+](CC3CC=CC3)C[C@H]21 ZINC000662265060 409561044 /nfs/dbraw/zinc/56/10/44/409561044.db2.gz FUCICWBUZLRUSN-BFHYXJOUSA-N 2 0 220.360 2.012 20 0 BEADRP CO[C@@H](C[NH2+]CC1([NH3+])CCC1)C1CCCCC1 ZINC000662267230 409568118 /nfs/dbraw/zinc/56/81/18/409568118.db2.gz SYLATRMIGOSCNV-ZDUSSCGKSA-N 2 0 240.391 2.053 20 0 BEADRP CC1(C)CCCC[C@H]1C[N@@H+]1CC[C@H](C[NH3+])C1 ZINC000662247740 409549281 /nfs/dbraw/zinc/54/92/81/409549281.db2.gz ZOBYZJRQMOZNMJ-OLZOCXBDSA-N 2 0 224.392 2.483 20 0 BEADRP FCC[C@@H]1CCC[N@H+](CC[C@H]2CC[NH2+]C2)C1 ZINC000662310140 409632744 /nfs/dbraw/zinc/63/27/44/409632744.db2.gz HNWZVAKUMNKLJA-OLZOCXBDSA-N 2 0 228.355 2.058 20 0 BEADRP CO[C@@H](C[NH+]1CCC(C)([NH3+])CC1)C1CCCC1 ZINC000662269833 409573974 /nfs/dbraw/zinc/57/39/74/409573974.db2.gz FSQJPLSYDHGXHM-ZDUSSCGKSA-N 2 0 240.391 2.005 20 0 BEADRP C1=CCC(C[NH+]2CCC([C@H]3CC[NH2+]C3)CC2)C1 ZINC000662272898 409576444 /nfs/dbraw/zinc/57/64/44/409576444.db2.gz KKIDIERKTJNICG-HNNXBMFYSA-N 2 0 234.387 2.274 20 0 BEADRP CC12CC(C1)C[N@@H+]2CCC[NH+]1CCCCC1 ZINC000662385137 409686546 /nfs/dbraw/zinc/68/65/46/409686546.db2.gz LFUOBWAESKCOES-UHFFFAOYSA-N 2 0 222.376 2.347 20 0 BEADRP Cc1ccc(CC[NH2+][C@H]2CCC[C@@H]2[NH3+])c(C)c1 ZINC000259119725 409732701 /nfs/dbraw/zinc/73/27/01/409732701.db2.gz TVLDIYPECVUTCX-GJZGRUSLSA-N 2 0 232.371 2.315 20 0 BEADRP CC1([NH2+]Cc2cccc3c2CCC3)CC[NH2+]CC1 ZINC000650703602 410332905 /nfs/dbraw/zinc/33/29/05/410332905.db2.gz IIYUCCHISZKHHF-UHFFFAOYSA-N 2 0 244.382 2.407 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]Cc1cccc2c1CCC2 ZINC000650704295 410335388 /nfs/dbraw/zinc/33/53/88/410335388.db2.gz RSQRWMLHKAZJRZ-RYUDHWBXSA-N 2 0 232.371 2.391 20 0 BEADRP [NH3+]C[C@H]1CC[C@@H]([NH2+]Cc2cccc3c2CCC3)C1 ZINC000650704034 410336160 /nfs/dbraw/zinc/33/61/60/410336160.db2.gz DBMOAMQBONXWCU-SWLSCSKDSA-N 2 0 244.382 2.392 20 0 BEADRP c1cc2c(c(C[NH2+]C[C@H]3CCC[NH2+]C3)c1)CCC2 ZINC000650703911 410336836 /nfs/dbraw/zinc/33/68/36/410336836.db2.gz XPZHHPXNYBAJCY-ZDUSSCGKSA-N 2 0 244.382 2.265 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CCC[C@H](C)[C@@H]1CC[NH3+] ZINC000650711703 410339306 /nfs/dbraw/zinc/33/93/06/410339306.db2.gz AKWPUORCABKCGS-LOWDOPEQSA-N 2 0 210.365 2.092 20 0 BEADRP C[C@@H]1CCCC[C@H]1[NH2+]CCC1(C[NH3+])CC1 ZINC000650713060 410344226 /nfs/dbraw/zinc/34/42/26/410344226.db2.gz CNSZOJCUEQZDJR-VXGBXAGGSA-N 2 0 210.365 2.284 20 0 BEADRP [NH3+]CC1(CC[NH2+]Cc2cccc(F)c2F)CC1 ZINC000650712679 410345085 /nfs/dbraw/zinc/34/50/85/410345085.db2.gz PAYHQHZAJOAHBL-UHFFFAOYSA-N 2 0 240.297 2.183 20 0 BEADRP C[C@@H]1C[C@@H](C[N@@H+]2CC[C@]3(CC3(F)F)C2)CC[NH2+]1 ZINC000650725381 410359664 /nfs/dbraw/zinc/35/96/64/410359664.db2.gz ZJNLOTMJFQCMPU-WOPDTQHZSA-N 2 0 244.329 2.106 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+][C@@H]1C[C@H]1CC(C)(C)C ZINC000650741751 410374744 /nfs/dbraw/zinc/37/47/44/410374744.db2.gz KREJTVTYDVXOIC-RWMBFGLXSA-N 2 0 242.407 2.155 20 0 BEADRP [NH3+]CC1(CC[NH2+][C@H]2CCc3ccccc32)CC1 ZINC000650742984 410377641 /nfs/dbraw/zinc/37/76/41/410377641.db2.gz JSDSNTSBNRAERD-AWEZNQCLSA-N 2 0 230.355 2.393 20 0 BEADRP CC[C@@H]1CCC[C@H]1[NH2+]CCC1(C[NH3+])CC1 ZINC000650745650 410382580 /nfs/dbraw/zinc/38/25/80/410382580.db2.gz LCTMRAMXGYTLBX-VXGBXAGGSA-N 2 0 210.365 2.284 20 0 BEADRP [NH3+]CC1(CC[NH2+][C@@H]2CCC23CCCC3)CC1 ZINC000650746810 410384554 /nfs/dbraw/zinc/38/45/54/410384554.db2.gz LPYQYORUOWMGKN-GFCCVEGCSA-N 2 0 222.376 2.428 20 0 BEADRP [NH3+]CC1(CC[NH2+][C@H]2CCCc3cccnc32)CC1 ZINC000650746678 410385966 /nfs/dbraw/zinc/38/59/66/410385966.db2.gz IGOXYFOYIMSIIU-ZDUSSCGKSA-N 2 0 245.370 2.178 20 0 BEADRP C[C@H]([NH2+]CCC1(C[NH3+])CC1)C1CCSCC1 ZINC000650746591 410386149 /nfs/dbraw/zinc/38/61/49/410386149.db2.gz FYSFCBZLBXUWGW-NSHDSACASA-N 2 0 242.432 2.237 20 0 BEADRP [NH3+]CC1(CC[NH2+][C@H]2CC[C@@H]2C2CCC2)CC1 ZINC000650747282 410388593 /nfs/dbraw/zinc/38/85/93/410388593.db2.gz WNSQXSYZBMMNCE-OLZOCXBDSA-N 2 0 222.376 2.284 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H]1CNc2ccccc2C1 ZINC000650748574 410389991 /nfs/dbraw/zinc/38/99/91/410389991.db2.gz XHEMYRCLIJZJEV-JSGCOSHPSA-N 2 0 247.386 2.130 20 0 BEADRP CC[C@H]([NH2+]CCC1(C[NH3+])CC1)[C@@H]1C[C@H]1C ZINC000650748476 410390889 /nfs/dbraw/zinc/39/08/89/410390889.db2.gz VCNJTFWBMZTNKI-UTUOFQBUSA-N 2 0 210.365 2.140 20 0 BEADRP C[NH2+]Cc1ccccc1C[NH2+][C@H](C)C1CC1 ZINC000650759526 410407418 /nfs/dbraw/zinc/40/74/18/410407418.db2.gz LKDFWOTXIQECBA-LLVKDONJSA-N 2 0 218.344 2.294 20 0 BEADRP C[C@@H]([NH2+]CCC1CC[NH2+]CC1)c1ccncc1 ZINC000650762761 410411527 /nfs/dbraw/zinc/41/15/27/410411527.db2.gz JHIYHPRDIHYNOS-GFCCVEGCSA-N 2 0 233.359 2.122 20 0 BEADRP C[C@@H]1CCC[C@H]1[NH2+]CCC1CC[NH2+]CC1 ZINC000650763552 410413825 /nfs/dbraw/zinc/41/38/25/410413825.db2.gz DFYWMQMVOHJZRL-DGCLKSJQSA-N 2 0 210.365 2.154 20 0 BEADRP CC(C)[C@H]([NH2+]CCC1CC[NH2+]CC1)C1CC1 ZINC000650764438 410414267 /nfs/dbraw/zinc/41/42/67/410414267.db2.gz YSAFLINLKOPILK-AWEZNQCLSA-N 2 0 224.392 2.400 20 0 BEADRP CN(C[C@H]1CCC[N@@H+]1C)c1[nH+]ccc2[nH]ccc21 ZINC000664029571 410437159 /nfs/dbraw/zinc/43/71/59/410437159.db2.gz RAXVZCQUTBHRDF-LLVKDONJSA-N 2 0 244.342 2.093 20 0 BEADRP CC(C)(C)C[NH+]1CCC([C@@H]2CCC[NH2+]2)CC1 ZINC000063197379 166578418 /nfs/dbraw/zinc/57/84/18/166578418.db2.gz WUYSDMPFHWGTFA-ZDUSSCGKSA-N 2 0 224.392 2.497 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]C[C@@H]2CCC[C@H]3C[C@H]32)C1 ZINC000665264004 410736776 /nfs/dbraw/zinc/73/67/76/410736776.db2.gz ZZVJCLQLDTUAFN-PDWCTOEPSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]CC[C@@]1(C)CC1(F)F ZINC000665266716 410738841 /nfs/dbraw/zinc/73/88/41/410738841.db2.gz IDRLSBGNIMXKOW-WOPDTQHZSA-N 2 0 246.345 2.400 20 0 BEADRP COc1cccc(C[NH2+][C@H]2CCC[C@@H]2C[NH3+])c1C ZINC000665294853 410787949 /nfs/dbraw/zinc/78/79/49/410787949.db2.gz XPGCKEHSDMXZON-OCCSQVGLSA-N 2 0 248.370 2.221 20 0 BEADRP C[NH2+]C[C@@H](C)[NH2+][C@H](Cc1ccccc1)C1CC1 ZINC000665296783 410813703 /nfs/dbraw/zinc/81/37/03/410813703.db2.gz XRRHQDPXLYQUAI-IUODEOHRSA-N 2 0 232.371 2.205 20 0 BEADRP CC1(C[NH+]2CCC(CC[NH3+])CC2)CCC1 ZINC000308959303 410828261 /nfs/dbraw/zinc/82/82/61/410828261.db2.gz FMRRPWPRKPEERV-UHFFFAOYSA-N 2 0 210.365 2.237 20 0 BEADRP CC[C@@H]1CC[C@H](C)C[C@@H]1[NH2+][C@@H](C)C[NH2+]C ZINC000665297631 410818412 /nfs/dbraw/zinc/81/84/12/410818412.db2.gz JBDIVHPLYZLPHC-RVMXOQNASA-N 2 0 212.381 2.399 20 0 BEADRP C[NH2+]C[C@@H](C)[NH2+][C@@H](C)C1CCC(F)(F)CC1 ZINC000665297598 410819045 /nfs/dbraw/zinc/81/90/45/410819045.db2.gz IVZIECRZLJHAKU-ZJUUUORDSA-N 2 0 234.334 2.398 20 0 BEADRP CC(C)C[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC000083846997 167002625 /nfs/dbraw/zinc/00/26/25/167002625.db2.gz NZDICZAMGZSOLY-YHWZYXNKSA-N 2 0 210.365 2.247 20 0 BEADRP CC(C)C[NH2+]C[C@@H](C)N1CCC[C@H](C)C1 ZINC000252123280 167005408 /nfs/dbraw/zinc/00/54/08/167005408.db2.gz JRFUGOVQXMBRCH-QWHCGFSZSA-N 2 0 212.381 2.352 20 0 BEADRP CC(C)[NH2+]C1CC[NH+](C[C@@H]2C[C@@H]2C)CC1 ZINC000336769577 167093826 /nfs/dbraw/zinc/09/38/26/167093826.db2.gz VTUGTKBJSZYKBO-RYUDHWBXSA-N 2 0 210.365 2.105 20 0 BEADRP CC(C)[NH2+]C1CC[NH+](C[C@H]2C[C@@H]2C)CC1 ZINC000336769576 167094984 /nfs/dbraw/zinc/09/49/84/167094984.db2.gz VTUGTKBJSZYKBO-NWDGAFQWSA-N 2 0 210.365 2.105 20 0 BEADRP CC(C)C[C@@H]1CCC[N@@H+]1C[C@@H]1CC[NH2+]C1 ZINC000396981339 410908606 /nfs/dbraw/zinc/90/86/06/410908606.db2.gz UKGKWMKVRJBXAG-OLZOCXBDSA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)OCCC[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@H]1C ZINC000036908373 167223791 /nfs/dbraw/zinc/22/37/91/167223791.db2.gz IZZXJKQGTQMQAL-HZSPNIEDSA-N 2 0 242.407 2.120 20 0 BEADRP CC(C)OCCC[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000127788497 167225252 /nfs/dbraw/zinc/22/52/52/167225252.db2.gz FOPUAUSBUNVECE-UONOGXRCSA-N 2 0 240.391 2.018 20 0 BEADRP CC(C)Oc1cccc(C[N@H+](C)CCC[NH3+])c1 ZINC000123313405 167304848 /nfs/dbraw/zinc/30/48/48/167304848.db2.gz LPJRHFLYUJBGOI-UHFFFAOYSA-N 2 0 236.359 2.254 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[NH2+]CC1)[C@@H]1CC1(C)C ZINC000397752830 410933744 /nfs/dbraw/zinc/93/37/44/410933744.db2.gz CGYKLESZRGZHJH-TUAOUCFPSA-N 2 0 210.365 2.153 20 0 BEADRP CCC[C@H](C[NH2+]C1CCC([NH+](C)C)CC1)OC ZINC000651373025 410957607 /nfs/dbraw/zinc/95/76/07/410957607.db2.gz LBULIRMVCIQSEO-JXQTWKCFSA-N 2 0 242.407 2.264 20 0 BEADRP COC[C@@H](CC(C)(C)C)[NH2+][C@H](C)CC[NH+](C)C ZINC000651693978 411136688 /nfs/dbraw/zinc/13/66/88/411136688.db2.gz LCBVNZNYILANDF-CHWSQXEVSA-N 2 0 244.423 2.367 20 0 BEADRP CCSCC[N@@H+]1C[C@H](C[NH3+])[C@@H](C)C[C@H]1C ZINC000397298427 411143412 /nfs/dbraw/zinc/14/34/12/411143412.db2.gz CLOHBHRCMMEOEC-TUAOUCFPSA-N 2 0 230.421 2.045 20 0 BEADRP CC(C)C[N@H+](C)CCC[NH2+][C@@H]1CSC[C@@H]1C ZINC000651865231 411147808 /nfs/dbraw/zinc/14/78/08/411147808.db2.gz RDKCXAAOHKVTSR-QWHCGFSZSA-N 2 0 244.448 2.305 20 0 BEADRP CC(C)C[N@H+](C)CCC[NH2+][C@H]1COC(C)(C)C1 ZINC000651864809 411147845 /nfs/dbraw/zinc/14/78/45/411147845.db2.gz FNQXRRKIZWXUIX-CYBMUJFWSA-N 2 0 242.407 2.121 20 0 BEADRP CC(C)C[N@H+](C)CCCNCc1ccn(C)c1 ZINC000651865988 411148014 /nfs/dbraw/zinc/14/80/14/411148014.db2.gz PMLYXRHXWXSVBQ-UHFFFAOYSA-N 2 0 237.391 2.093 20 0 BEADRP C1[C@H]([NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)C12CCCC2 ZINC000400989619 411168286 /nfs/dbraw/zinc/16/82/86/411168286.db2.gz XVRMTHOBRZGHFT-SYQHCUMBSA-N 2 0 234.387 2.297 20 0 BEADRP CC[C@@]1(C)CCC[C@@H]1[NH2+]CCOCC[NH+](C)C ZINC000652192596 411168377 /nfs/dbraw/zinc/16/83/77/411168377.db2.gz GDEMGRBUIHOPFH-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)C1(C[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)CC1 ZINC000401005631 411169068 /nfs/dbraw/zinc/16/90/68/411169068.db2.gz PBVVYSFZWJKIJC-HZSPNIEDSA-N 2 0 236.403 2.400 20 0 BEADRP c1ccc(CC[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)cc1 ZINC000401036489 411173167 /nfs/dbraw/zinc/17/31/67/411173167.db2.gz ZCYSZCNTZSEVKD-ARFHVFGLSA-N 2 0 244.382 2.207 20 0 BEADRP C([NH2+][C@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)C(C1CC1)C1CC1 ZINC000401020673 411173230 /nfs/dbraw/zinc/17/32/30/411173230.db2.gz KQOXETPTBOKVQR-KFWWJZLASA-N 2 0 248.414 2.400 20 0 BEADRP C[N@H+]1CC=C(C[NH2+][C@@H]2CCCSCC2)CC1 ZINC000657938878 411174399 /nfs/dbraw/zinc/17/43/99/411174399.db2.gz RJNHHNJDDOQVJF-CYBMUJFWSA-N 2 0 240.416 2.124 20 0 BEADRP Fc1ccccc1C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000401088269 411177160 /nfs/dbraw/zinc/17/71/60/411177160.db2.gz WGKLURITYKNXQG-IACUBPJLSA-N 2 0 248.345 2.303 20 0 BEADRP C1=CC[C@H](C[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)CC1 ZINC000401124618 411178229 /nfs/dbraw/zinc/17/82/29/411178229.db2.gz KYPRISRERXNETL-ZQDZILKHSA-N 2 0 234.387 2.320 20 0 BEADRP C[C@@H]1CCC[N@H+](Cc2cccc(O)c2)[C@H]1CC[NH3+] ZINC000404294058 411183100 /nfs/dbraw/zinc/18/31/00/411183100.db2.gz MROAIQNFCHFBPZ-DOMZBBRYSA-N 2 0 248.370 2.342 20 0 BEADRP COC[C@H](CC(C)(C)C)[NH2+]C1CCC([NH3+])CC1 ZINC000656193375 411198658 /nfs/dbraw/zinc/19/86/58/411198658.db2.gz IJORDUUFJXDZHT-BPCQOVAHSA-N 2 0 242.407 2.297 20 0 BEADRP COC[C@H](CC(C)(C)C)[NH2+]C[C@@H]([NH3+])CC(C)C ZINC000656193906 411199283 /nfs/dbraw/zinc/19/92/83/411199283.db2.gz XQGRBDAGEUXLOL-STQMWFEESA-N 2 0 244.423 2.401 20 0 BEADRP C[C@H](Cc1ccccn1)[NH2+][C@@H](C)C[C@@H]1CCC[NH2+]1 ZINC000656193317 411200540 /nfs/dbraw/zinc/20/05/40/411200540.db2.gz GCGODLMABMJLTI-IPYPFGDCSA-N 2 0 247.386 2.133 20 0 BEADRP CCOC1CC(CC[NH2+][C@H]2CCC[C@@H]([NH3+])C2)C1 ZINC000656198659 411202655 /nfs/dbraw/zinc/20/26/55/411202655.db2.gz BVIUKVDUMYHSMH-DKNRTOFZSA-N 2 0 240.391 2.051 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]CCCOC2CCCC2)C1 ZINC000656197216 411202902 /nfs/dbraw/zinc/20/29/02/411202902.db2.gz PMICIMVXDRFVPL-STQMWFEESA-N 2 0 240.391 2.195 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCC[C@H]([NH3+])C1)[C@@H]1CCCCO1 ZINC000656201505 411206078 /nfs/dbraw/zinc/20/60/78/411206078.db2.gz QJDWSNIDWIQQFC-CRWXNKLISA-N 2 0 240.391 2.194 20 0 BEADRP COc1c(C)cccc1C[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000656201088 411206547 /nfs/dbraw/zinc/20/65/47/411206547.db2.gz SDFXNLIHINUENN-ZIAGYGMSSA-N 2 0 248.370 2.363 20 0 BEADRP Cc1nccc(N[C@H]2CCC[N@@H+]3CCCC[C@@H]23)n1 ZINC000656226192 411215244 /nfs/dbraw/zinc/21/52/44/411215244.db2.gz LLZXDBHCPNDIMN-STQMWFEESA-N 2 0 246.358 2.214 20 0 BEADRP C[C@H]1CC[C@H]([NH2+]CC(C)(C)C[NH+](C)C)CS1 ZINC000655679750 411223224 /nfs/dbraw/zinc/22/32/24/411223224.db2.gz GBPJESPLUFOKGL-RYUDHWBXSA-N 2 0 244.448 2.448 20 0 BEADRP CC(C)[NH2+]CCC[NH2+]C(C1CC1)C1CC1 ZINC000049237986 411229050 /nfs/dbraw/zinc/22/90/50/411229050.db2.gz LOZWGRCAASFCDB-UHFFFAOYSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[NH2+]CC1)c1cccc(O)c1 ZINC000129104766 411229795 /nfs/dbraw/zinc/22/97/95/411229795.db2.gz KGVWOCBPVUBFIF-AAEUAGOBSA-N 2 0 234.343 2.185 20 0 BEADRP COCCCCC[NH2+][C@H]1CCCCC[C@@H]1[NH3+] ZINC000422826946 411232558 /nfs/dbraw/zinc/23/25/58/411232558.db2.gz RPQNDQFHNJTEBA-STQMWFEESA-N 2 0 228.380 2.053 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CCCOC1CCCC1 ZINC000422827473 411232834 /nfs/dbraw/zinc/23/28/34/411232834.db2.gz MZNRJNUXAGGTCV-RYUDHWBXSA-N 2 0 228.380 2.051 20 0 BEADRP CCCC(O)(CCC)C[NH2+][C@H](C)C[C@H](C)[NH3+] ZINC000422976185 411234702 /nfs/dbraw/zinc/23/47/02/411234702.db2.gz HZQNJSFXLHQVEV-NWDGAFQWSA-N 2 0 230.396 2.033 20 0 BEADRP COCC[C@H](C)C[NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000423173430 411236588 /nfs/dbraw/zinc/23/65/88/411236588.db2.gz YOQBHOOUKRDEHW-GLQYFDAESA-N 2 0 248.370 2.393 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000400880757 411165394 /nfs/dbraw/zinc/16/53/94/411165394.db2.gz ANEQHHFHHSUBPN-MBJXGIAVSA-N 2 0 222.376 2.010 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000400880758 411165627 /nfs/dbraw/zinc/16/56/27/411165627.db2.gz ANEQHHFHHSUBPN-PEBLQZBPSA-N 2 0 222.376 2.010 20 0 BEADRP CC(C)[C@H](C)C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000400966516 411166521 /nfs/dbraw/zinc/16/65/21/411166521.db2.gz NJEBQCMTZAOHCV-YIYPIFLZSA-N 2 0 224.392 2.256 20 0 BEADRP CC(C)(C)C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000400950686 411166759 /nfs/dbraw/zinc/16/67/59/411166759.db2.gz WSIAIMFTLBWUHO-GRYCIOLGSA-N 2 0 210.365 2.010 20 0 BEADRP CC(C)[C@@H](C)[NH2+][C@H]1CCN(C(C)(C)C)C1 ZINC000658091075 411242232 /nfs/dbraw/zinc/24/22/32/411242232.db2.gz KTLYZRCSZTUTCP-NEPJUHHUSA-N 2 0 212.381 2.493 20 0 BEADRP C[C@H]1CC[N@H+](CCCC2CC[NH2+]CC2)C1 ZINC000050953008 411269278 /nfs/dbraw/zinc/26/92/78/411269278.db2.gz SRBDBSQUTVKHGY-LBPRGKRZSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@@H]1CCC[N@@H+]1CCCC1CC[NH2+]CC1 ZINC000050952809 411269547 /nfs/dbraw/zinc/26/95/47/411269547.db2.gz AFNYKXLSHVEBQC-GFCCVEGCSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CCCOC(C)(C)C)CC[N@@H+]1C ZINC000658188034 411284195 /nfs/dbraw/zinc/28/41/95/411284195.db2.gz ZDCDYYZCBAKYGS-STQMWFEESA-N 2 0 242.407 2.264 20 0 BEADRP C[N@@H+](Cc1cccc(Cl)c1)C[C@@H]1CC[NH2+]C1 ZINC000051889983 411284825 /nfs/dbraw/zinc/28/48/25/411284825.db2.gz VWCPIOXSSFJNSC-GFCCVEGCSA-N 2 0 238.762 2.381 20 0 BEADRP CC[N@@H+](Cc1cccs1)C[C@@H]1CC[NH2+]C1 ZINC000051890024 411284951 /nfs/dbraw/zinc/28/49/51/411284951.db2.gz NXMYUZSUUCVZKI-LLVKDONJSA-N 2 0 224.373 2.180 20 0 BEADRP C[C@@H]1CCC[C@H]([N@H+](C)C[C@@H]2CC[NH2+]C2)C1 ZINC000051889670 411285959 /nfs/dbraw/zinc/28/59/59/411285959.db2.gz XABDLEAURPRWHR-UPJWGTAASA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCC(C)(C)F)CC[N@@H+]1C ZINC000658193773 411288374 /nfs/dbraw/zinc/28/83/74/411288374.db2.gz YONYOEUHWPJUGN-GHMZBOCLSA-N 2 0 216.344 2.197 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CCC(C)(C)F)[C@H](C)C1 ZINC000658193407 411288564 /nfs/dbraw/zinc/28/85/64/411288564.db2.gz UNMRRPBMMIOHCU-VXGBXAGGSA-N 2 0 230.371 2.445 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CCc2ccoc2)[C@@H]2CCC[C@H]21 ZINC000658196221 411289254 /nfs/dbraw/zinc/28/92/54/411289254.db2.gz CQPRCVRMHQQWNK-SOUVJXGZSA-N 2 0 248.370 2.285 20 0 BEADRP Cc1[nH+]ccc(N[C@@H]2CCC[C@@H]([NH3+])C2)c1Cl ZINC000382452455 411290452 /nfs/dbraw/zinc/29/04/52/411290452.db2.gz NYZCYJUFSMXAEV-NXEZZACHSA-N 2 0 239.750 2.147 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CCc2ccoc2)[C@H](C)C1 ZINC000658202198 411290885 /nfs/dbraw/zinc/29/08/85/411290885.db2.gz VGODWZBLQMKEJB-OCCSQVGLSA-N 2 0 236.359 2.142 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@]2(C)CC2(F)F)CC[N@@H+]1C ZINC000658218635 411298684 /nfs/dbraw/zinc/29/86/84/411298684.db2.gz KJLQNQYKDFGRCZ-MXWKQRLJSA-N 2 0 232.318 2.104 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@H]2CCC[C@H](C)O2)CC1 ZINC000658222928 411301815 /nfs/dbraw/zinc/30/18/15/411301815.db2.gz YSVTXOAIFXPLRQ-GXTWGEPZSA-N 2 0 240.391 2.018 20 0 BEADRP CC[NH+]1CCC([NH2+]CC[C@@]2(C)CC2(F)F)CC1 ZINC000658225488 411304671 /nfs/dbraw/zinc/30/46/71/411304671.db2.gz TXPKOKBDZSHFJK-LBPRGKRZSA-N 2 0 246.345 2.496 20 0 BEADRP CC[NH+]1CCC([NH2+]CC[C@]2(C)CC2(F)F)CC1 ZINC000658225487 411304857 /nfs/dbraw/zinc/30/48/57/411304857.db2.gz TXPKOKBDZSHFJK-GFCCVEGCSA-N 2 0 246.345 2.496 20 0 BEADRP [NH3+]Cc1ccc(C[NH2+]C2CCCC2)c(F)c1 ZINC000129578100 411311850 /nfs/dbraw/zinc/31/18/50/411311850.db2.gz OEPLROVKBKYQKY-UHFFFAOYSA-N 2 0 222.307 2.317 20 0 BEADRP C([C@@H]1CC[NH2+]C1)[N@@H+]1CCC2(C1)CCCCC2 ZINC000303391622 411317764 /nfs/dbraw/zinc/31/77/64/411317764.db2.gz OXRYXYAKBKMREJ-CYBMUJFWSA-N 2 0 222.376 2.252 20 0 BEADRP C[NH+](C)C1CC[NH+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC000659839906 411326298 /nfs/dbraw/zinc/32/62/98/411326298.db2.gz ZYDKGPZHZNZGNW-MCIONIFRSA-N 2 0 236.403 2.449 20 0 BEADRP C[C@H](C[N@@H+]1CC[C@H]2CC[C@@H](C1)[NH2+]2)C(C)(C)C ZINC000304265490 411356977 /nfs/dbraw/zinc/35/69/77/411356977.db2.gz JUOBJWLYYCQQNH-UPJWGTAASA-N 2 0 224.392 2.495 20 0 BEADRP Cc1ccc2c(c1)C[N@@H+](C[C@@H]1CCC[NH2+]C1)CC2 ZINC000656786897 411365933 /nfs/dbraw/zinc/36/59/33/411365933.db2.gz CZBSWJSDWHXYNN-CQSZACIVSA-N 2 0 244.382 2.353 20 0 BEADRP CC(C)C[C@@H](C)C[C@H](C)[NH2+][C@H]1CC[NH2+]C1 ZINC000656788234 411368115 /nfs/dbraw/zinc/36/81/15/411368115.db2.gz YIYUXJRZJZTJPX-AGIUHOORSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+]CC1([NH3+])CCCC1 ZINC000656789585 411368848 /nfs/dbraw/zinc/36/88/48/411368848.db2.gz RQDULMDZWLSFPT-NEPJUHHUSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@H](C[N@@H+]1CC[C@]2(CC[NH2+]C2)C1)C(C)(C)C ZINC000304503596 411369047 /nfs/dbraw/zinc/36/90/47/411369047.db2.gz IUPANPHFWVSSRW-OCCSQVGLSA-N 2 0 224.392 2.354 20 0 BEADRP CCCN(CCC[NH3+])Cc1ccccc1F ZINC000656792176 411372074 /nfs/dbraw/zinc/37/20/74/411372074.db2.gz PCYWAYJORLSMMN-UHFFFAOYSA-N 2 0 224.323 2.387 20 0 BEADRP C1[C@@H]2CC[C@@H]([NH2+][C@@H]3CC[C@@H]4C[NH2+]C[C@@H]4C3)C[C@H]12 ZINC000403376980 411343753 /nfs/dbraw/zinc/34/37/53/411343753.db2.gz DRPGBSKQMAYFSO-PMKSJIGOSA-N 2 0 234.387 2.153 20 0 BEADRP CC1=C[C@@H](C)C[C@H](C[N@H+]2C[C@H]3C[NH+](C)C[C@H]3C2)C1 ZINC000368122137 168124782 /nfs/dbraw/zinc/12/47/82/168124782.db2.gz JRXNXWFSZXHSLI-BVUBDWEXSA-N 2 0 248.414 2.472 20 0 BEADRP CC1CC([NH2+]C2CC([NH+]3CCCCC3)C2)C1 ZINC000335605384 168145348 /nfs/dbraw/zinc/14/53/48/168145348.db2.gz YHJPPELCPZSHNC-UHFFFAOYSA-N 2 0 222.376 2.391 20 0 BEADRP CC1CC([NH2+][C@@H]2CC[N@H+](C)[C@@H]3CCC[C@H]32)C1 ZINC000309759809 168147848 /nfs/dbraw/zinc/14/78/48/168147848.db2.gz IKWIIXKQTMMFGP-PNKMZZHYSA-N 2 0 222.376 2.247 20 0 BEADRP C[C@@H]1CN(C)C[C@@H]1[NH2+]CC1CCC(C)CC1 ZINC000336777864 168156568 /nfs/dbraw/zinc/15/65/68/168156568.db2.gz JSKFKBYNLBTBGK-HHTDUIENSA-N 2 0 224.392 2.352 20 0 BEADRP CC1CCC([NH+]2CCC(C[NH3+])CC2)CC1 ZINC000044511914 168160630 /nfs/dbraw/zinc/16/06/30/168160630.db2.gz FTPKLPSSHOLLPX-UHFFFAOYSA-N 2 0 210.365 2.236 20 0 BEADRP CC1CCC([NH2+]C[C@H]2CC[N@H+](C)C2)CC1 ZINC000037484610 168163646 /nfs/dbraw/zinc/16/36/46/168163646.db2.gz SSUBDPAHIUDIND-OTTFEQOBSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]([NH2+]CCC[NH+]1CCC(C)CC1)C1CC1 ZINC000020146289 168179309 /nfs/dbraw/zinc/17/93/09/168179309.db2.gz ZMXDSEPEOHVJRU-ZDUSSCGKSA-N 2 0 224.392 2.497 20 0 BEADRP CC1CC[NH+](C[C@H]2CC[NH2+][C@H](C)C2)CC1 ZINC000232836222 168182797 /nfs/dbraw/zinc/18/27/97/168182797.db2.gz KXKINBIMLLCKRF-OLZOCXBDSA-N 2 0 210.365 2.106 20 0 BEADRP Cc1cccnc1C[N@H+]1CCC[C@@H](C)[C@@H]1CC[NH3+] ZINC000404286478 411388834 /nfs/dbraw/zinc/38/88/34/411388834.db2.gz IFRGYDIYQKEJGH-HIFRSBDPSA-N 2 0 247.386 2.339 20 0 BEADRP C[N@H+](CC1CC=CC1)C[C@H]1CCC[NH+](C)C1 ZINC000659945374 411389117 /nfs/dbraw/zinc/38/91/17/411389117.db2.gz BGFGHIZKMQKLMB-AWEZNQCLSA-N 2 0 222.376 2.226 20 0 BEADRP C[C@H]1CCC[N@H+](Cc2ccccn2)[C@H]1CC[NH3+] ZINC000404360299 411391593 /nfs/dbraw/zinc/39/15/93/411391593.db2.gz DWXVNHHJYKQGQV-JSGCOSHPSA-N 2 0 233.359 2.031 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H]1CCOC(C)(C)C1 ZINC000070344705 411391791 /nfs/dbraw/zinc/39/17/91/411391791.db2.gz ZNSWEGPOGDPZKB-ZDUSSCGKSA-N 2 0 242.407 2.266 20 0 BEADRP CCC(C)(C)[NH2+][C@@H](C)C(=O)Nc1ccncc1C ZINC000274719549 168300358 /nfs/dbraw/zinc/30/03/58/168300358.db2.gz DDTROMUUXLQIIQ-NSHDSACASA-N 2 0 249.358 2.495 20 0 BEADRP CC1([NH3+])CC[NH+](Cc2cccs2)CC1 ZINC000306677288 411456133 /nfs/dbraw/zinc/45/61/33/411456133.db2.gz YKJRPAOBAKDIBS-UHFFFAOYSA-N 2 0 210.346 2.061 20 0 BEADRP CC[C@@H]1C[C@@H]([NH2+]CCC[NH+]2CCCC2)CCO1 ZINC000070346244 411392031 /nfs/dbraw/zinc/39/20/31/411392031.db2.gz CIONQECJLPLYPO-UONOGXRCSA-N 2 0 240.391 2.020 20 0 BEADRP CC(C)COCC[N@@H+]1CCC[C@H](C)[C@@H]1CC[NH3+] ZINC000404406127 411394305 /nfs/dbraw/zinc/39/43/05/411394305.db2.gz UZLWCNFQDNEXNM-KBPBESRZSA-N 2 0 242.407 2.108 20 0 BEADRP CC(C)[C@@H]1C[C@H]1C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000647797880 411405254 /nfs/dbraw/zinc/40/52/54/411405254.db2.gz GFBVLELIQFEKAG-QMIVOQANSA-N 2 0 236.403 2.256 20 0 BEADRP C[NH2+]Cc1ccccc1C[NH2+]C1CCCC1 ZINC000404695657 411405327 /nfs/dbraw/zinc/40/53/27/411405327.db2.gz VPRQFNHKWVQXLV-UHFFFAOYSA-N 2 0 218.344 2.438 20 0 BEADRP C[NH+](C)CCC[NH2+]Cc1cc2ccncc2s1 ZINC000657287742 411447003 /nfs/dbraw/zinc/44/70/03/411447003.db2.gz ULKNUQYXRGNJMR-UHFFFAOYSA-N 2 0 249.383 2.338 20 0 BEADRP C[C@@H]([NH2+]Cc1ccnn1-c1cc[nH+]cc1)C1CC1 ZINC000657293014 411453199 /nfs/dbraw/zinc/45/31/99/411453199.db2.gz ISKAHFVQKJFCPM-LLVKDONJSA-N 2 0 242.326 2.155 20 0 BEADRP CC1(C)CCCC[C@@H]1C[NH+]1C[C@H]2C[NH2+]C[C@@H]2C1 ZINC000659850919 411477512 /nfs/dbraw/zinc/47/75/12/411477512.db2.gz WSHZNBZKMMGSCH-MGPQQGTHSA-N 2 0 236.403 2.354 20 0 BEADRP C1=CCC(C[N@H+]2CC[C@@H](C[NH+]3CCCC3)C2)C1 ZINC000659949046 411508513 /nfs/dbraw/zinc/50/85/13/411508513.db2.gz UGAOXFNKWQNQFY-HNNXBMFYSA-N 2 0 234.387 2.370 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)CS1 ZINC000655802677 411518596 /nfs/dbraw/zinc/51/85/96/411518596.db2.gz HIJHTYAWBLWDGZ-WUHRBBMRSA-N 2 0 242.432 2.200 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H]2CCC[C@H]3C[C@H]32)C1 ZINC000655803880 411518613 /nfs/dbraw/zinc/51/86/13/411518613.db2.gz GWYDYLYUVPDOJF-ODXJTPSBSA-N 2 0 222.376 2.105 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H]2CCC23CCC3)C1 ZINC000655803900 411518782 /nfs/dbraw/zinc/51/87/82/411518782.db2.gz HFBCWXUSZUNMAA-XQQFMLRXSA-N 2 0 222.376 2.249 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]C2Cc3ccccc3C2)C1 ZINC000655805362 411519267 /nfs/dbraw/zinc/51/92/67/411519267.db2.gz GRKJOYNKWQGXMG-DRQUAOQDSA-N 2 0 244.382 2.084 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1ccncc1 ZINC000655805361 411519323 /nfs/dbraw/zinc/51/93/23/411519323.db2.gz MTOWMSCBEWLPGA-BZPMIXESSA-N 2 0 233.359 2.072 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1cscn1 ZINC000655805374 411519462 /nfs/dbraw/zinc/51/94/62/411519462.db2.gz MUSIJSWFJZXYGP-MXWKQRLJSA-N 2 0 239.388 2.134 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1cccc(O)c1 ZINC000655805009 411519498 /nfs/dbraw/zinc/51/94/98/411519498.db2.gz IFDUHHNXPWYCHZ-SGMGOOAPSA-N 2 0 248.370 2.383 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)C(C)(C)C ZINC000655805161 411519608 /nfs/dbraw/zinc/51/96/08/411519608.db2.gz JSSPKNYNBHQTNX-SDDRHHMPSA-N 2 0 212.381 2.351 20 0 BEADRP CC[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)[C@@H]1C[C@@H]1C ZINC000655804043 411519855 /nfs/dbraw/zinc/51/98/55/411519855.db2.gz NDAAYPWRFNMOAQ-QNSTZXKLSA-N 2 0 224.392 2.351 20 0 BEADRP Cc1ccncc1[C@@H](C)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655805820 411520138 /nfs/dbraw/zinc/52/01/38/411520138.db2.gz SSVLYVXIGXHENQ-MCIONIFRSA-N 2 0 247.386 2.381 20 0 BEADRP CCCC[C@@H](C)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655807081 411520386 /nfs/dbraw/zinc/52/03/86/411520386.db2.gz HZSLQGDZCWOTIX-UPJWGTAASA-N 2 0 212.381 2.495 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)C1 ZINC000655806940 411520610 /nfs/dbraw/zinc/52/06/10/411520610.db2.gz DTSIPFWZIDKBRE-MQYQWHSLSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1CCCC[C@H]1[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655807895 411521695 /nfs/dbraw/zinc/52/16/95/411521695.db2.gz VTXQUOPHQUKIFV-YIYPIFLZSA-N 2 0 224.392 2.495 20 0 BEADRP Cc1sccc1C[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655825100 411527455 /nfs/dbraw/zinc/52/74/55/411527455.db2.gz WTMWDZJZXWCHNJ-BJHJDKERSA-N 2 0 238.400 2.486 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+]C2CC3(CCC3)C2)C1 ZINC000336776606 170007610 /nfs/dbraw/zinc/00/76/10/170007610.db2.gz GDHOXLNSEMNUQD-LBPRGKRZSA-N 2 0 222.376 2.251 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(C)s2)C1 ZINC000037484277 170008261 /nfs/dbraw/zinc/00/82/61/170008261.db2.gz KOGRKLCIVMRCDU-LBPRGKRZSA-N 2 0 238.400 2.488 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccccc2)C1 ZINC000037484259 170008549 /nfs/dbraw/zinc/00/85/49/170008549.db2.gz OFKHHAZDBGZKKG-AWEZNQCLSA-N 2 0 218.344 2.118 20 0 BEADRP CC[N@@H+]1CC[C@@H](CN[C@H](C)c2cscn2)C1 ZINC000252788708 170010573 /nfs/dbraw/zinc/01/05/73/170010573.db2.gz QWCRFMKSASUVJR-MNOVXSKESA-N 2 0 239.388 2.136 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CCC2(C)CC2)[C@H](C)C1 ZINC000309465819 170011024 /nfs/dbraw/zinc/01/10/24/170011024.db2.gz PGMQVWHAKVLQAX-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CCC[C@H](C)C2)C1 ZINC000037484184 170017496 /nfs/dbraw/zinc/01/74/96/170017496.db2.gz AYTUGLYRFRWHKY-BFHYXJOUSA-N 2 0 224.392 2.497 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H](C)CSC)[C@H](C)C1 ZINC000336759666 170022185 /nfs/dbraw/zinc/02/21/85/170022185.db2.gz KYOSYHILFYPIDC-WOPDTQHZSA-N 2 0 230.421 2.058 20 0 BEADRP CC[NH2+]CC1CC[NH+](CCC(F)(F)F)CC1 ZINC000070914083 170110324 /nfs/dbraw/zinc/11/03/24/170110324.db2.gz KVTRDAVIMYMELN-UHFFFAOYSA-N 2 0 238.297 2.260 20 0 BEADRP CC[NH2+]CC1CC[NH+](CC(C)(C)C)CC1 ZINC000066152278 170111163 /nfs/dbraw/zinc/11/11/63/170111163.db2.gz ILRUFRZXDYJSKU-UHFFFAOYSA-N 2 0 212.381 2.354 20 0 BEADRP CC[NH2+]CC1CC[NH+]([C@H](C)c2ccccn2)CC1 ZINC000131481371 170111773 /nfs/dbraw/zinc/11/17/73/170111773.db2.gz NZXMAOBCSDFJAT-CYBMUJFWSA-N 2 0 247.386 2.464 20 0 BEADRP CCOCC(C)(C)C[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000310183467 170352360 /nfs/dbraw/zinc/35/23/60/170352360.db2.gz ODYOOODAMDWANH-QWHCGFSZSA-N 2 0 242.407 2.121 20 0 BEADRP CCOCC(C)(C)C[NH2+][C@@H](C)CCCC[NH3+] ZINC000336644874 170352507 /nfs/dbraw/zinc/35/25/07/170352507.db2.gz COLCRZYIQJIFOI-LBPRGKRZSA-N 2 0 230.396 2.156 20 0 BEADRP C[C@@H]1CN(C)C[C@H]1[NH2+][C@@H]1CC[C@@H]1c1ccccc1 ZINC000657713608 411586409 /nfs/dbraw/zinc/58/64/09/411586409.db2.gz IHOQKOMUBNUDJO-DTZQCDIJSA-N 2 0 244.382 2.472 20 0 BEADRP CC(C)[C@H]([NH2+]Cc1cnc2n1CCC2)C1CC1 ZINC000657757518 411590099 /nfs/dbraw/zinc/59/00/99/411590099.db2.gz SVKQYMCNTDITPD-AWEZNQCLSA-N 2 0 233.359 2.354 20 0 BEADRP c1coc(C[NH2+]CC2CC[NH+](CC3CC3)CC2)c1 ZINC000657811425 411602947 /nfs/dbraw/zinc/60/29/47/411602947.db2.gz BOSQIETVHZSNRC-UHFFFAOYSA-N 2 0 248.370 2.491 20 0 BEADRP C[C@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)C1CC1 ZINC000657813295 411603350 /nfs/dbraw/zinc/60/33/50/411603350.db2.gz NLPMGDXFMXGVQT-LBPRGKRZSA-N 2 0 236.403 2.497 20 0 BEADRP C([NH2+]CC1CC[NH+](CC2CC2)CC1)C1CC1 ZINC000657813463 411603713 /nfs/dbraw/zinc/60/37/13/411603713.db2.gz OXOZRNUXJDEMPL-UHFFFAOYSA-N 2 0 222.376 2.108 20 0 BEADRP CC1(C[NH2+]CC2CC[NH+](CC3CC3)CC2)CC1 ZINC000657813577 411604077 /nfs/dbraw/zinc/60/40/77/411604077.db2.gz SMASVTSMADVZSS-UHFFFAOYSA-N 2 0 236.403 2.498 20 0 BEADRP C(C[NH2+][C@@H]1CCCSCC1)C[NH+]1CCCC1 ZINC000657823930 411607815 /nfs/dbraw/zinc/60/78/15/411607815.db2.gz MCSORWOSMOXSDN-CYBMUJFWSA-N 2 0 242.432 2.348 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@H]1COC2(CCC2)C1 ZINC000657831378 411609108 /nfs/dbraw/zinc/60/91/08/411609108.db2.gz WTCVWWPNJGJVTI-CYBMUJFWSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@@H]1CCCSCC1 ZINC000657858926 411612708 /nfs/dbraw/zinc/61/27/08/411612708.db2.gz MHAFNKJBSFTMRO-VXGBXAGGSA-N 2 0 230.421 2.202 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCC[C@]2(CC[NH+](C)C2)C1 ZINC000660654954 411613214 /nfs/dbraw/zinc/61/32/14/411613214.db2.gz DGUNANXNJUXBCR-UONOGXRCSA-N 2 0 224.392 2.450 20 0 BEADRP C[N@@H+]1CC[C@]2(C1)CCC[NH+](CC1CCC1)C2 ZINC000660658129 411614983 /nfs/dbraw/zinc/61/49/83/411614983.db2.gz CLMSCZHTSQVDMI-AWEZNQCLSA-N 2 0 222.376 2.204 20 0 BEADRP C[N@@H+]1CC[C@]2(C1)CCC[NH+](C[C@@H]1C[C@H]3C[C@H]3C1)C2 ZINC000660662772 411615916 /nfs/dbraw/zinc/61/59/16/411615916.db2.gz WHQNFDJNNGVJGK-FZKCQIBNSA-N 2 0 248.414 2.450 20 0 BEADRP CC[N@@H+]1CCC[C@H](Nc2[nH+]ccc3[nH]ccc32)C1 ZINC000663415805 411653893 /nfs/dbraw/zinc/65/38/93/411653893.db2.gz ROYZXAJGJIZGNE-NSHDSACASA-N 2 0 244.342 2.459 20 0 BEADRP C[C@H]1CCCC[C@@H]1C[NH2+]CC12CC(C1)C[NH2+]2 ZINC000663497541 411678823 /nfs/dbraw/zinc/67/88/23/411678823.db2.gz HAZCJZYIPLTFGA-RJZJGCCBSA-N 2 0 222.376 2.154 20 0 BEADRP C[C@H]1CCCC[C@H]1C[NH2+]CC12CC(C1)C[NH2+]2 ZINC000663497537 411679134 /nfs/dbraw/zinc/67/91/34/411679134.db2.gz HAZCJZYIPLTFGA-AHPWVWPOSA-N 2 0 222.376 2.154 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CC23CC(C2)C[NH2+]3)C[C@H]1C ZINC000663498144 411680997 /nfs/dbraw/zinc/68/09/97/411680997.db2.gz MHYQOJRPTLDHSS-WCCYQHBJSA-N 2 0 222.376 2.153 20 0 BEADRP C([NH2+][C@H]1CCC[C@@H](C2CC2)C1)C12CC(C1)C[NH2+]2 ZINC000663498573 411681302 /nfs/dbraw/zinc/68/13/02/411681302.db2.gz QENBSCXGIGXVPI-YTELLUSKSA-N 2 0 234.387 2.297 20 0 BEADRP CC(C)C[C@H](C)[NH2+]CC[C@@H]([NH3+])C(C)C ZINC000663500371 411683332 /nfs/dbraw/zinc/68/33/32/411683332.db2.gz QKIBUJUTZXLMPU-NWDGAFQWSA-N 2 0 200.370 2.384 20 0 BEADRP CC(C)C[C@@H](C)C[NH2+]CC12CC(C1)C[NH2+]2 ZINC000663500886 411683583 /nfs/dbraw/zinc/68/35/83/411683583.db2.gz QHEDMFCCMFLGNB-PNESKVBLSA-N 2 0 210.365 2.010 20 0 BEADRP C(CC1CCCCC1)[NH2+]CC12CC(C1)C[NH2+]2 ZINC000663500356 411684549 /nfs/dbraw/zinc/68/45/49/411684549.db2.gz KNWMMRBHGSBLFC-UHFFFAOYSA-N 2 0 222.376 2.298 20 0 BEADRP C([NH2+]CC12CC(C1)C[NH2+]2)C1CCCCCC1 ZINC000663501167 411685262 /nfs/dbraw/zinc/68/52/62/411685262.db2.gz BMHSUMJXOVRNCA-UHFFFAOYSA-N 2 0 222.376 2.298 20 0 BEADRP C[C@]1(C[N@H+](CCC2CC2)CC2CC2)CC[NH2+]C1 ZINC000663502227 411685638 /nfs/dbraw/zinc/68/56/38/411685638.db2.gz FXFWMEDGDOBNRY-HNNXBMFYSA-N 2 0 236.403 2.498 20 0 BEADRP COC[C@@H](CC(C)C)[NH2+]CC[C@@H]([NH3+])C(C)C ZINC000663502390 411686123 /nfs/dbraw/zinc/68/61/23/411686123.db2.gz HSYHSNFGWSEULS-CHWSQXEVSA-N 2 0 230.396 2.011 20 0 BEADRP Cc1ccc(CCC[NH2+]CC[C@@H]([NH3+])C(C)C)cn1 ZINC000663502995 411687589 /nfs/dbraw/zinc/68/75/89/411687589.db2.gz KXKUUPYIMITDFC-OAHLLOKOSA-N 2 0 249.402 2.286 20 0 BEADRP CC[N@@H+]1CCN(c2[nH+]ccc3[nH]ccc32)[C@H](C)C1 ZINC000663905144 411770792 /nfs/dbraw/zinc/77/07/92/411770792.db2.gz PUFCOPNJFNIBTH-LLVKDONJSA-N 2 0 244.342 2.093 20 0 BEADRP C[C@H](CCNc1cc[nH+]c2ccccc12)[NH+](C)C ZINC000664243853 411895661 /nfs/dbraw/zinc/89/56/61/411895661.db2.gz NBFKUBKLOPMMPY-GFCCVEGCSA-N 2 0 243.354 2.409 20 0 BEADRP c1cn(CC[N@@H+](CCC2CC2)CC2CC2)cn1 ZINC000662179408 412021050 /nfs/dbraw/zinc/02/10/50/412021050.db2.gz OFSYDDNMWKGURB-UHFFFAOYSA-N 2 0 233.359 2.395 20 0 BEADRP CC(C)=CCC[N@H+]1CCC[C@@H]([C@@H](C)[NH3+])C1 ZINC000662245758 412043286 /nfs/dbraw/zinc/04/32/86/412043286.db2.gz OKZXUSFQLABCMR-CHWSQXEVSA-N 2 0 210.365 2.402 20 0 BEADRP C[C@@H]1C[N@H+](CCCC2CCC2)CC[C@H]1[NH3+] ZINC000662246977 412044725 /nfs/dbraw/zinc/04/47/25/412044725.db2.gz XOMQADSQKJIGDI-DGCLKSJQSA-N 2 0 210.365 2.236 20 0 BEADRP CO[C@@H](C[N@H+](C)CC[C@@H]([NH3+])C(C)C)C1CCC1 ZINC000662248033 412046634 /nfs/dbraw/zinc/04/66/34/412046634.db2.gz RFBVAEXMZFUHHX-KGLIPLIRSA-N 2 0 242.407 2.107 20 0 BEADRP CC(C)=CCC[N@@H+]1C[C@@H]2CCC[C@@H]([NH3+])[C@@H]2C1 ZINC000662264106 412056261 /nfs/dbraw/zinc/05/62/61/412056261.db2.gz AYQCGFLQHLDNGK-BFHYXJOUSA-N 2 0 222.376 2.402 20 0 BEADRP CC(C)=CCC[N@@H+]1C[C@@H]2CCC[C@@H]([NH3+])[C@H]2C1 ZINC000662264112 412056283 /nfs/dbraw/zinc/05/62/83/412056283.db2.gz AYQCGFLQHLDNGK-MELADBBJSA-N 2 0 222.376 2.402 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CC[N@H+](CCCC2CCC2)C1 ZINC000662264167 412056407 /nfs/dbraw/zinc/05/64/07/412056407.db2.gz BOJURTKJJYKZCB-WCQYABFASA-N 2 0 210.365 2.236 20 0 BEADRP CC[C@@H]1CC[N@H+](C[C@@H]2CC[NH2+][C@@H](C)C2)C1 ZINC000233928548 171011270 /nfs/dbraw/zinc/01/12/70/171011270.db2.gz YFKGEZUVMPFYGK-YNEHKIRRSA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]C1CCN(CC)CC1 ZINC000336742134 171042398 /nfs/dbraw/zinc/04/23/98/171042398.db2.gz WKTZTEFNQWJFBE-YPMHNXCESA-N 2 0 210.365 2.249 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]CCN1CCC[C@@H](C)C1 ZINC000310038232 171042573 /nfs/dbraw/zinc/04/25/73/171042573.db2.gz VWZQMZUVRFARGB-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP CO[C@@H](C[N@@H+]1CCCC[C@H]1CC[NH3+])C1CCC1 ZINC000662272585 412063157 /nfs/dbraw/zinc/06/31/57/412063157.db2.gz GVECBOWEVMPQIZ-KBPBESRZSA-N 2 0 240.391 2.005 20 0 BEADRP CC[C@@H]1C[C@@H](C)C[N@@H+]1CCn1ccnc1 ZINC000336651476 171117115 /nfs/dbraw/zinc/11/71/15/171117115.db2.gz VGODZSKVAUNKAI-VXGBXAGGSA-N 2 0 207.321 2.004 20 0 BEADRP C([C@@H]1C[C@H]2C[C@H]2C1)[N@@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1 ZINC000662275045 412068121 /nfs/dbraw/zinc/06/81/21/412068121.db2.gz QGIIEEAXLLLLRO-RBGFHDKUSA-N 2 0 248.414 2.354 20 0 BEADRP CC(C)=CCC[N@H+]1CC[C@@H](C)[C@H](C[NH3+])C1 ZINC000662282661 412072153 /nfs/dbraw/zinc/07/21/53/412072153.db2.gz PRRMRGUIPJKGAF-CHWSQXEVSA-N 2 0 210.365 2.259 20 0 BEADRP c1ccc([C@H]2CCC[N@@H+](C[C@@H]3CC[NH2+]C3)C2)cc1 ZINC000662282508 412073076 /nfs/dbraw/zinc/07/30/76/412073076.db2.gz AZFZFKFYHOWDPE-ZBFHGGJFSA-N 2 0 244.382 2.476 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCC[C@@H]([NH+](C)C)CC1 ZINC000372992404 171279836 /nfs/dbraw/zinc/27/98/36/171279836.db2.gz WYOSFVZSHGKXMG-QWHCGFSZSA-N 2 0 212.381 2.449 20 0 BEADRP C([C@H]1CC[NH2+]C1)[NH+]1CCC(C2CCC2)CC1 ZINC000662298724 412083622 /nfs/dbraw/zinc/08/36/22/412083622.db2.gz FUBFIMSOULDARW-LBPRGKRZSA-N 2 0 222.376 2.108 20 0 BEADRP CC[C@H](C)[NH2+]CC1(SC)CC[NH+](C)CC1 ZINC000309197729 171340175 /nfs/dbraw/zinc/34/01/75/171340175.db2.gz QTOZBGWLJRJYEZ-NSHDSACASA-N 2 0 230.421 2.202 20 0 BEADRP CC[C@H](C)[NH2+]C[C@@H]1N(C)CCCC1(C)C ZINC000336735855 171340811 /nfs/dbraw/zinc/34/08/11/171340811.db2.gz OTEMESMYFSOMOB-RYUDHWBXSA-N 2 0 212.381 2.495 20 0 BEADRP CC[C@H](C)[C@@H](C)[N@H+](CCC[NH2+]C)C1CC1 ZINC000336674214 171361966 /nfs/dbraw/zinc/36/19/66/171361966.db2.gz KBVBWKQULVASRN-NWDGAFQWSA-N 2 0 212.381 2.495 20 0 BEADRP CC[C@H](C)[C@@H](C)[NH2+]CCC[NH+]1CCCC1 ZINC000020129210 171365036 /nfs/dbraw/zinc/36/50/36/171365036.db2.gz FZLSSQOESNOILK-QWHCGFSZSA-N 2 0 212.381 2.497 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+]CC1=CC[N@H+](C)CC1 ZINC000336729578 171388627 /nfs/dbraw/zinc/38/86/27/171388627.db2.gz JDKSUNLPZLSPQU-RYUDHWBXSA-N 2 0 210.365 2.273 20 0 BEADRP CCc1ccc(CN2CC3CC2(C[NH3+])C3)cc1 ZINC000662304401 412088020 /nfs/dbraw/zinc/08/80/20/412088020.db2.gz REYOSQIGGUBHFR-UHFFFAOYSA-N 2 0 230.355 2.172 20 0 BEADRP C[C@@H]([NH3+])C[N@@H+]1CC[C@@H](C2CCCCC2)C1 ZINC000662305362 412091517 /nfs/dbraw/zinc/09/15/17/412091517.db2.gz GFAUVCRMZADUSQ-DGCLKSJQSA-N 2 0 210.365 2.236 20 0 BEADRP FCC[C@@H]1CCC[N@H+](CC[C@@H]2CCC[NH2+]C2)C1 ZINC000662312692 412093678 /nfs/dbraw/zinc/09/36/78/412093678.db2.gz YZFNCJNMYYYBBR-KBPBESRZSA-N 2 0 242.382 2.448 20 0 BEADRP FCC[C@@H]1CCC[N@H+](CC[C@H]2CCC[NH2+]C2)C1 ZINC000662312693 412093724 /nfs/dbraw/zinc/09/37/24/412093724.db2.gz YZFNCJNMYYYBBR-KGLIPLIRSA-N 2 0 242.382 2.448 20 0 BEADRP CC[C@@H]1CCC[C@H](C)[N@@H+]1C[C@H]1CC[NH2+]C1 ZINC000662318855 412097653 /nfs/dbraw/zinc/09/76/53/412097653.db2.gz HRBYOMJKJHCOBF-RWMBFGLXSA-N 2 0 210.365 2.249 20 0 BEADRP C([C@@H]1CC[NH2+]C1)[N@@H+]1CCC[C@H](C2CCC2)C1 ZINC000662317798 412097889 /nfs/dbraw/zinc/09/78/89/412097889.db2.gz SRCKECZRBKKNOH-OCCSQVGLSA-N 2 0 222.376 2.108 20 0 BEADRP CC[C@@H](C)C[N@@H+]1CCO[C@@H](CCC[NH+](C)C)C1 ZINC000662319148 412098388 /nfs/dbraw/zinc/09/83/88/412098388.db2.gz FMIAHFDZJBGLFE-KGLIPLIRSA-N 2 0 242.407 2.075 20 0 BEADRP CCCCC[C@H]1CCCC[N@@H+]1CCOCC[NH3+] ZINC000662320844 412101531 /nfs/dbraw/zinc/10/15/31/412101531.db2.gz WXPYMKXYMHGORP-AWEZNQCLSA-N 2 0 242.407 2.397 20 0 BEADRP C[C@@H]([NH2+]CC1C[C@H](C)C[C@@H](C)C1)C1C[NH2+]C1 ZINC000665239610 412181254 /nfs/dbraw/zinc/18/12/54/412181254.db2.gz VVVMQMFFYUQQIS-IJLUTSLNSA-N 2 0 224.392 2.256 20 0 BEADRP C[C@@H]([NH2+]C1CCC(C[NH3+])CC1)c1cscn1 ZINC000665240722 412182848 /nfs/dbraw/zinc/18/28/48/412182848.db2.gz REVHKUBRQYPDQG-KPPDAEKUSA-N 2 0 239.388 2.311 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[NH2+]C1)[C@@H]1CCCC[C@H]1C ZINC000665241683 412185484 /nfs/dbraw/zinc/18/54/84/412185484.db2.gz WCBMGJYZCRCOOK-FVCCEPFGSA-N 2 0 210.365 2.153 20 0 BEADRP COC[C@@H]([NH2+]CC1([NH3+])CCCC1)C1CCCC1 ZINC000665247467 412192070 /nfs/dbraw/zinc/19/20/70/412192070.db2.gz CHEVAHBBHJEKJF-CYBMUJFWSA-N 2 0 240.391 2.053 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]C[C@@H]1C(C)(C)C1(F)F ZINC000665273813 412215316 /nfs/dbraw/zinc/21/53/16/412215316.db2.gz DRXQSZFSIMHKJJ-GMTAPVOTSA-N 2 0 246.345 2.255 20 0 BEADRP CC(C)(F)CC[NH2+][C@@H]1CCCC[C@H]1C[NH3+] ZINC000665261683 412203267 /nfs/dbraw/zinc/20/32/67/412203267.db2.gz JJTQZOQETHYUIR-WDEREUQCSA-N 2 0 216.344 2.232 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@@H]1CCC[C@@H](C)O1 ZINC000665265533 412203452 /nfs/dbraw/zinc/20/34/52/412203452.db2.gz XOZVKRQTLGKZFC-UPJWGTAASA-N 2 0 228.380 2.051 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CCC(C)(C)F ZINC000665261573 412203606 /nfs/dbraw/zinc/20/36/06/412203606.db2.gz GPKNOVAQCMUOAG-SNVBAGLBSA-N 2 0 204.333 2.232 20 0 BEADRP C[C@]1(CC[NH2+][C@H]2CCC[C@@H]([NH3+])C2)CC1(F)F ZINC000665266858 412204730 /nfs/dbraw/zinc/20/47/30/412204730.db2.gz KXFMJNLRLAOIBK-VWYCJHECSA-N 2 0 232.318 2.281 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CCC[C@H]2C[C@H]21 ZINC000665263928 412206928 /nfs/dbraw/zinc/20/69/28/412206928.db2.gz YGYQNYSWMCGXEK-YHQUGGNUSA-N 2 0 222.376 2.140 20 0 BEADRP C[C@]1(C[NH2+]C2CCC(C[NH3+])CC2)CC1(F)F ZINC000665267504 412210647 /nfs/dbraw/zinc/21/06/47/412210647.db2.gz XZTWPQBBXKADKL-VQXHTEKXSA-N 2 0 232.318 2.139 20 0 BEADRP C[C@]1(C[NH2+][C@H]2CCCCC[C@H]2[NH3+])CC1(F)F ZINC000665266805 412210738 /nfs/dbraw/zinc/21/07/38/412210738.db2.gz KCAZIQOFVCKVRM-OUAUKWLOSA-N 2 0 232.318 2.281 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@H](C)c1ccccn1 ZINC000665232023 412170256 /nfs/dbraw/zinc/17/02/56/412170256.db2.gz DPANHXFLQXCWND-QWHCGFSZSA-N 2 0 235.375 2.292 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[NH2+]CC[C@@H]1C)c1ccccn1 ZINC000665232903 412172400 /nfs/dbraw/zinc/17/24/00/412172400.db2.gz XJYANQPOBIAIPY-GZBFAFLISA-N 2 0 247.386 2.163 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+][C@@H]2C[C@H]3CC[C@@H]2O3)c2ccccc21 ZINC000422748071 412172652 /nfs/dbraw/zinc/17/26/52/412172652.db2.gz RTYGUKJOYLNZBO-YGARTUKASA-N 2 0 244.338 2.041 20 0 BEADRP CCC(C)(C)[C@@H](C)[NH2+][C@H](CCC[NH3+])COC ZINC000665235861 412174488 /nfs/dbraw/zinc/17/44/88/412174488.db2.gz BELHRKFYSDBIMF-VXGBXAGGSA-N 2 0 230.396 2.155 20 0 BEADRP CC[C@@H]([NH2+]C[C@H]1C(C)(C)C1(F)F)[C@@H]1CCC[NH2+]1 ZINC000665274692 412217441 /nfs/dbraw/zinc/21/74/41/412217441.db2.gz WFTVIBZHCBVDML-VWYCJHECSA-N 2 0 246.345 2.398 20 0 BEADRP C1=C(C[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)CCC1 ZINC000665274623 412218074 /nfs/dbraw/zinc/21/80/74/412218074.db2.gz UQSJRPKCTZDIIN-MGPQQGTHSA-N 2 0 220.360 2.074 20 0 BEADRP CC[C@H]1CCCC[C@H]1[NH2+]CC12CC(C1)C[NH2+]2 ZINC000665278788 412222876 /nfs/dbraw/zinc/22/28/76/412222876.db2.gz OUTFCAZSGBTKKA-YIFLHPOLSA-N 2 0 222.376 2.297 20 0 BEADRP C([NH2+][C@H]1CCC12CCCC2)C12CC(C1)C[NH2+]2 ZINC000665279833 412223767 /nfs/dbraw/zinc/22/37/67/412223767.db2.gz NIGMGFMQRLZDNE-LXVYMNJGSA-N 2 0 220.360 2.051 20 0 BEADRP FCCC[C@@H]1CCC[C@@H]1[NH2+]CC12CC(C1)C[NH2+]2 ZINC000665280061 412224523 /nfs/dbraw/zinc/22/45/23/412224523.db2.gz SBEFKJDMPIUPNG-QPPOZKHWSA-N 2 0 240.366 2.246 20 0 BEADRP FCCC[C@@H]1CCC[C@H]1[NH2+]CC12CC(C1)C[NH2+]2 ZINC000665280062 412225429 /nfs/dbraw/zinc/22/54/29/412225429.db2.gz SBEFKJDMPIUPNG-YIFLHPOLSA-N 2 0 240.366 2.246 20 0 BEADRP COCC[C@H]1CCC[C@@H]1[NH2+]CC[C@@H]([NH3+])C(C)C ZINC000665282234 412227389 /nfs/dbraw/zinc/22/73/89/412227389.db2.gz UCBTYBHGPSTFQW-MCIONIFRSA-N 2 0 242.407 2.155 20 0 BEADRP COCC[C@H]1CCC[C@H]1[NH2+]CC[C@@H]([NH3+])C(C)C ZINC000665282235 412227718 /nfs/dbraw/zinc/22/77/18/412227718.db2.gz UCBTYBHGPSTFQW-MGPQQGTHSA-N 2 0 242.407 2.155 20 0 BEADRP [NH3+][C@H]1CCCCC[C@@H]1[NH2+]CCCc1ccco1 ZINC000665283650 412228591 /nfs/dbraw/zinc/22/85/91/412228591.db2.gz RRVRVOWFFBEYKQ-KBPBESRZSA-N 2 0 236.359 2.462 20 0 BEADRP CO[C@H](C[NH2+][C@H](C)C[C@@H](C)[NH3+])C1CCCCC1 ZINC000665284041 412228988 /nfs/dbraw/zinc/22/89/88/412228988.db2.gz ZKGQUJILDRGBID-YRGRVCCFSA-N 2 0 242.407 2.297 20 0 BEADRP CC[C@H]1CCC[C@@H]1[NH2+]C1CCC([NH3+])CC1 ZINC000229635435 171625680 /nfs/dbraw/zinc/62/56/80/171625680.db2.gz CDDVDRWNVAXSTF-WTIISPKJSA-N 2 0 210.365 2.425 20 0 BEADRP COc1cccc(C[NH2+][C@H]2CCC[C@H]([NH3+])C2)c1C ZINC000665294073 412238775 /nfs/dbraw/zinc/23/87/75/412238775.db2.gz HNEMULQUUMDAGG-KBPBESRZSA-N 2 0 248.370 2.363 20 0 BEADRP CC(C)(C[NH2+][C@@H]1CCC[C@H]1[NH3+])CC(F)(F)F ZINC000665301233 412250178 /nfs/dbraw/zinc/25/01/78/412250178.db2.gz RWZAMJFDKQUWEC-RKDXNWHRSA-N 2 0 238.297 2.434 20 0 BEADRP CCc1ccc(C[NH2+][C@@H](C)CCC[NH3+])cc1 ZINC000309203670 171808165 /nfs/dbraw/zinc/80/81/65/171808165.db2.gz AUBOEQXTQVGFAP-LBPRGKRZSA-N 2 0 220.360 2.466 20 0 BEADRP CCc1ccccc1C[NH2+][C@H]1CCC[NH2+]CC1 ZINC000129278985 171883330 /nfs/dbraw/zinc/88/33/30/171883330.db2.gz PHYKLJDMJQJDDC-HNNXBMFYSA-N 2 0 232.371 2.481 20 0 BEADRP CC[C@H]([NH2+][C@@H](C)C1CC[NH+](C)CC1)C1CC1 ZINC000324512979 487624454 /nfs/dbraw/zinc/62/44/54/487624454.db2.gz USTKKLNBXCSWQX-FZMZJTMJSA-N 2 0 224.392 2.495 20 0 BEADRP C[N@H+]1CC=C(C[NH2+][C@@H]2CC[C@@H]2C2CCC2)CC1 ZINC000337990052 172977938 /nfs/dbraw/zinc/97/79/38/172977938.db2.gz SCMPCQRTMJSBTG-HUUCEWRRSA-N 2 0 234.387 2.417 20 0 BEADRP C[NH+]1CCC(CC[NH2+]Cc2cccc(O)c2)CC1 ZINC000105454962 172984146 /nfs/dbraw/zinc/98/41/46/172984146.db2.gz XTITVCUNCRHISL-UHFFFAOYSA-N 2 0 248.370 2.214 20 0 BEADRP C[NH+]1CCC(C[NH2+]CC2CCCC2)CC1 ZINC000044518042 172984927 /nfs/dbraw/zinc/98/49/27/172984927.db2.gz BISXIEZAGVDDIE-UHFFFAOYSA-N 2 0 210.365 2.108 20 0 BEADRP C[N@@H+]1CCCC[C@@H]1CC[NH2+][C@@H]1CCOC1(C)C ZINC000328278706 173006122 /nfs/dbraw/zinc/00/61/22/173006122.db2.gz YSBNICBXVQCCNC-CHWSQXEVSA-N 2 0 240.391 2.018 20 0 BEADRP C[N@@H+]1CCC[C@@H]1CC[NH+]1CC2CCC1CC2 ZINC000371390481 173027426 /nfs/dbraw/zinc/02/74/26/173027426.db2.gz WPKPDMHOBNZETO-ROKHWSDSSA-N 2 0 222.376 2.345 20 0 BEADRP C[N@@H+]1CCC[C@@H]1CC[NH+]1CCC[C@@H]1C1CC1 ZINC000371205639 173028361 /nfs/dbraw/zinc/02/83/61/173028361.db2.gz UFPOVXQRKAGYNL-ZIAGYGMSSA-N 2 0 222.376 2.345 20 0 BEADRP C[N@@H+]1CCC[C@H]1CC[NH+]1CCC[C@@H]1C1CC1 ZINC000371205638 173050291 /nfs/dbraw/zinc/05/02/91/173050291.db2.gz UFPOVXQRKAGYNL-UONOGXRCSA-N 2 0 222.376 2.345 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CCC2CC2)[C@H]2CCC[C@H]21 ZINC000309436389 173152113 /nfs/dbraw/zinc/15/21/13/173152113.db2.gz HHYVFKQGGPIPQI-HZSPNIEDSA-N 2 0 222.376 2.249 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]Cc2ccco2)[C@@H]2CCC[C@H]21 ZINC000367619985 173152949 /nfs/dbraw/zinc/15/29/49/173152949.db2.gz XMQUOFYVMVJZKM-MELADBBJSA-N 2 0 234.343 2.242 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]Cc1ccccc1)C2 ZINC000100243799 173206612 /nfs/dbraw/zinc/20/66/12/173206612.db2.gz IJBWOPMYRYEKGI-QKDCVEJESA-N 2 0 230.355 2.401 20 0 BEADRP C[NH2+]C1CC[NH+](C[C@H]2CCCC[C@H]2C)CC1 ZINC000042864242 173322902 /nfs/dbraw/zinc/32/29/02/173322902.db2.gz SGTDZEQRHDGHTK-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH2+]CCC1CC[NH+](Cc2ncccc2C)CC1 ZINC000161854939 173342506 /nfs/dbraw/zinc/34/25/06/173342506.db2.gz IEFYBKNRRBTSIC-UHFFFAOYSA-N 2 0 247.386 2.212 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCC[C@@H](CC(C)C)C1 ZINC000309651969 173347100 /nfs/dbraw/zinc/34/71/00/173347100.db2.gz UBKZHZPLVKEOQK-ZDUSSCGKSA-N 2 0 212.381 2.354 20 0 BEADRP C[NH2+]CCCN[C@H](C)c1sc(C)nc1C ZINC000043606511 173349776 /nfs/dbraw/zinc/34/97/76/173349776.db2.gz NXQBWMVQXSJEEE-MRVPVSSYSA-N 2 0 227.377 2.020 20 0 BEADRP C[NH2+]CCC[NH2+]Cc1cccc(OC(C)C)c1 ZINC000040719707 173349855 /nfs/dbraw/zinc/34/98/55/173349855.db2.gz JXVAKHXDZNRFRC-UHFFFAOYSA-N 2 0 236.359 2.173 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](C[C@@H](C)c2ccccc2)C1 ZINC000221283703 173370651 /nfs/dbraw/zinc/37/06/51/173370651.db2.gz GCKDVGNWRPGYLR-KGLIPLIRSA-N 2 0 232.371 2.331 20 0 BEADRP C[NH2+]C[C@H]1CCCN1C/C=C/c1ccccc1 ZINC000133218893 173380092 /nfs/dbraw/zinc/38/00/92/173380092.db2.gz CXIVNQIFPJGTPJ-FUVBFXSKSA-N 2 0 230.355 2.384 20 0 BEADRP C[NH2+]C[C@H]1CC[N@H+](Cc2cccc(C)c2C)C1 ZINC000071142593 173382006 /nfs/dbraw/zinc/38/20/06/173382006.db2.gz MJCJUUVQPGBFGO-CQSZACIVSA-N 2 0 232.371 2.345 20 0 BEADRP COC(C)(C)[C@H](C)[NH2+]CCC[NH+]1CCCCC1 ZINC000305970410 173952466 /nfs/dbraw/zinc/95/24/66/173952466.db2.gz JTDQOVJFYNJAMN-ZDUSSCGKSA-N 2 0 242.407 2.266 20 0 BEADRP COCC(C)(C)C[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000336724740 174070961 /nfs/dbraw/zinc/07/09/61/174070961.db2.gz UUMYFNAGJKKTOL-UHFFFAOYSA-N 2 0 242.407 2.121 20 0 BEADRP COCCCCC[N@H+](C)CCCn1ccnc1 ZINC000124424176 174176096 /nfs/dbraw/zinc/17/60/96/174176096.db2.gz LPKZYLWATONUGX-UHFFFAOYSA-N 2 0 239.363 2.022 20 0 BEADRP COc1ccc(C)cc1[C@H](C)[NH2+]C[C@@H](C)C[NH3+] ZINC000336713992 175081142 /nfs/dbraw/zinc/08/11/42/175081142.db2.gz OVWOPEDKFKABMJ-RYUDHWBXSA-N 2 0 236.359 2.249 20 0 BEADRP COc1ccc(C)cc1[C@H](C)[NH2+]CCCC[NH3+] ZINC000037715012 175081338 /nfs/dbraw/zinc/08/13/38/175081338.db2.gz ZHDSUZGUCBYQNF-LBPRGKRZSA-N 2 0 236.359 2.393 20 0 BEADRP COc1ccc(C[N@@H+]2CCC[C@H](C[NH3+])C2)cc1C ZINC000050597691 175099473 /nfs/dbraw/zinc/09/94/73/175099473.db2.gz KPEGFRJHASSHGD-CQSZACIVSA-N 2 0 248.370 2.174 20 0 BEADRP COc1ccc(C[N@@H+]2CC[C@@H](C)[C@@H](C[NH3+])C2)cc1 ZINC000163389060 175101140 /nfs/dbraw/zinc/10/11/40/175101140.db2.gz AKYHEKAJWVADHZ-OCCSQVGLSA-N 2 0 248.370 2.112 20 0 BEADRP COc1ccc(C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)cc1 ZINC000093209640 175109930 /nfs/dbraw/zinc/10/99/30/175109930.db2.gz DIOOHLZCSWWPID-QWHCGFSZSA-N 2 0 234.343 2.055 20 0 BEADRP COc1ccc(Cl)cc1C[NH2+]CCCC[NH3+] ZINC000038051615 175120818 /nfs/dbraw/zinc/12/08/18/175120818.db2.gz OOHYJYDPYBPCGQ-UHFFFAOYSA-N 2 0 242.750 2.177 20 0 BEADRP COc1ccc([C@H](C)[NH2+][C@@H](C)CCC[NH3+])cc1 ZINC000310171119 175189190 /nfs/dbraw/zinc/18/91/90/175189190.db2.gz TYNLFRBYEWLCIE-RYUDHWBXSA-N 2 0 236.359 2.473 20 0 BEADRP COc1cccc(C[NH2+][C@H]2CC[N@H+](C)C[C@H]2C)c1 ZINC000105480727 175267875 /nfs/dbraw/zinc/26/78/75/175267875.db2.gz ZGYKOAUGHLRSPA-DOMZBBRYSA-N 2 0 248.370 2.125 20 0 BEADRP COc1cccc(C[NH2+][C@H]2CCC[N@H+](C)CC2)c1 ZINC000076693008 175267899 /nfs/dbraw/zinc/26/78/99/175267899.db2.gz PNNMPOVYVRWWHT-AWEZNQCLSA-N 2 0 248.370 2.269 20 0 BEADRP COc1cccc([C@@H](C)[NH2+]CCCC[NH3+])c1 ZINC000037714844 175287232 /nfs/dbraw/zinc/28/72/32/175287232.db2.gz YYVBZAJEJZNQLV-LLVKDONJSA-N 2 0 222.332 2.085 20 0 BEADRP COc1ccccc1[C@H](C)[NH2+]CCCC[NH3+] ZINC000037714778 175350548 /nfs/dbraw/zinc/35/05/48/175350548.db2.gz QGCSJMPWNURCTQ-NSHDSACASA-N 2 0 222.332 2.085 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)C1 ZINC000668294949 487630693 /nfs/dbraw/zinc/63/06/93/487630693.db2.gz GWYDYLYUVPDOJF-PEBLQZBPSA-N 2 0 222.376 2.105 20 0 BEADRP CS[C@@H]1CCC[C@@H]([NH2+][C@H](C)CCC[NH3+])C1 ZINC000336675006 175548336 /nfs/dbraw/zinc/54/83/36/175548336.db2.gz HECAWENVHJQVOK-IJLUTSLNSA-N 2 0 230.421 2.378 20 0 BEADRP CS[C@@H]1CCC[C@H]([NH2+][C@H](C)CCC[NH3+])C1 ZINC000336675005 175548949 /nfs/dbraw/zinc/54/89/49/175548949.db2.gz HECAWENVHJQVOK-GRYCIOLGSA-N 2 0 230.421 2.378 20 0 BEADRP CS[C@@H]1CCC[C@H]([NH2+]C2CC[NH2+]CC2)C1 ZINC000235217236 175549313 /nfs/dbraw/zinc/54/93/13/175549313.db2.gz WYYOEWLPOHLWOH-NWDGAFQWSA-N 2 0 228.405 2.002 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]CCc1cccs1 ZINC000308643654 175665103 /nfs/dbraw/zinc/66/51/03/175665103.db2.gz FSBGCQOBAJMLOC-JTQLQIEISA-N 2 0 212.362 2.008 20 0 BEADRP C[C@@H]([NH3+])C1CC[NH+]([C@H](C)c2cccnc2)CC1 ZINC000110643853 175801461 /nfs/dbraw/zinc/80/14/61/175801461.db2.gz CBINASZVGXFCBM-VXGBXAGGSA-N 2 0 233.359 2.202 20 0 BEADRP C[C@@H](c1ccccc1)[N@@H+]1CC[C@@H]([NH3+])[C@H](C)C1 ZINC000251604126 176021445 /nfs/dbraw/zinc/02/14/45/176021445.db2.gz DEXULUOWZSCBAU-MBNYWOFBSA-N 2 0 218.344 2.417 20 0 BEADRP C[C@@H](c1ccccc1)[N@@H+]1CCC[C@H](C[NH3+])C1 ZINC000044527645 176022314 /nfs/dbraw/zinc/02/23/14/176022314.db2.gz NVTLGACRAYICGY-QWHCGFSZSA-N 2 0 218.344 2.418 20 0 BEADRP C[C@@H](c1ccccn1)[N@@H+]1CCC[C@@H](CC[NH3+])C1 ZINC000226325927 176027909 /nfs/dbraw/zinc/02/79/09/176027909.db2.gz WWMCKIQIONJJKV-STQMWFEESA-N 2 0 233.359 2.203 20 0 BEADRP C[C@@H](c1cccs1)[N@H+](C)C[C@@H]1CC[NH2+]C1 ZINC000051889975 176032787 /nfs/dbraw/zinc/03/27/87/176032787.db2.gz UWQCPGDFYYIQES-WDEREUQCSA-N 2 0 224.373 2.350 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[N@@H+]1CCC[C@@H](N)C1 ZINC000227086704 176074942 /nfs/dbraw/zinc/07/49/42/176074942.db2.gz SREOGLUZORHDBK-JHJVBQTASA-N 2 0 210.365 2.236 20 0 BEADRP C[C@@H]1CCC[C@H](CC[NH+]2C[C@H]3C[NH2+]C[C@@H]3C2)C1 ZINC000359294838 176136437 /nfs/dbraw/zinc/13/64/37/176136437.db2.gz AUVFLLAFSVICSF-KBUPBQIOSA-N 2 0 236.403 2.354 20 0 BEADRP C[C@@H]1CCC[C@H]1[NH2+]CC1=CC[N@H+](C)CC1 ZINC000335604328 176149453 /nfs/dbraw/zinc/14/94/53/176149453.db2.gz WYQKMICPHZGGRJ-DGCLKSJQSA-N 2 0 208.349 2.027 20 0 BEADRP C[C@@H]1CC[C@@H](C)[N@H+](CC2CC[NH2+]CC2)C1 ZINC000084048138 176197969 /nfs/dbraw/zinc/19/79/69/176197969.db2.gz RNWBTYAMEAKDKT-VXGBXAGGSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1CC[C@@H]([N@H+](C)C[C@@H]2CCC[NH2+]C2)C1 ZINC000235332458 176206832 /nfs/dbraw/zinc/20/68/32/176206832.db2.gz STWCNQFYYRDJCH-JHJVBQTASA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+][C@@H]1CC[N@H+](C)[C@@H]2CCC[C@@H]21 ZINC000309829093 176218077 /nfs/dbraw/zinc/21/80/77/176218077.db2.gz YBQKDAGYLWXZHS-RKQHYHRCSA-N 2 0 222.376 2.247 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CCC[C@@H]2CCC[NH2+]2)C1 ZINC000308979402 176233150 /nfs/dbraw/zinc/23/31/50/176233150.db2.gz HQOQAWNRKJXHMO-AGIUHOORSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]C[C@H]1CCCSC1 ZINC000304519492 176270992 /nfs/dbraw/zinc/27/09/92/176270992.db2.gz PEYPHDYBPMHZBG-JHJVBQTASA-N 2 0 242.432 2.059 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]CC1CCCC1 ZINC000036908583 176278334 /nfs/dbraw/zinc/27/83/34/176278334.db2.gz ADPPVWLZEVORLJ-BZPMIXESSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+][C@@H]1CC[C@H](F)C1 ZINC000309798613 176279364 /nfs/dbraw/zinc/27/93/64/176279364.db2.gz QSIZYOUBZNPJIM-LBELIVKGSA-N 2 0 228.355 2.195 20 0 BEADRP C[C@@H]1C[N@H+](CC2(C)CCC2)C[C@@]1(C)C[NH3+] ZINC000309013391 176284253 /nfs/dbraw/zinc/28/42/53/176284253.db2.gz YJBXWJWMIAANFQ-DGCLKSJQSA-N 2 0 210.365 2.093 20 0 BEADRP C[C@@H]1C[N@H+](CCC2CCCCC2)C[C@@H]1[NH3+] ZINC000235361061 176288004 /nfs/dbraw/zinc/28/80/04/176288004.db2.gz ZTDWQJFLWKRRLN-YPMHNXCESA-N 2 0 210.365 2.236 20 0 BEADRP C[C@@H]1C[NH+](CC[C@@H]2CCC[N@@H+]2C)C[C@H]1C ZINC000336650834 176292973 /nfs/dbraw/zinc/29/29/73/176292973.db2.gz TYIXCIYRMDZWGD-UPJWGTAASA-N 2 0 210.365 2.059 20 0 BEADRP C[C@@H]1C[N@H+](CC[C@H]2CC[NH2+]C2)C(C)(C)C1 ZINC000335631442 176293827 /nfs/dbraw/zinc/29/38/27/176293827.db2.gz PBPAGEFQEGDBPY-NWDGAFQWSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1C[C@@H](C[NH2+]Cc2cccs2)CC[NH2+]1 ZINC000235392860 176369572 /nfs/dbraw/zinc/36/95/72/176369572.db2.gz XVMKWCNWBIPQJO-MNOVXSKESA-N 2 0 224.373 2.226 20 0 BEADRP C[C@@H]1C[C@@H](C[NH2+]C2(C)CCCC2)CC[NH2+]1 ZINC000235382741 176370148 /nfs/dbraw/zinc/37/01/48/176370148.db2.gz WWYNKOJFJWMGOR-NEPJUHHUSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C[C@H]2CC2(C)C)CC[N@@H+]1C ZINC000300360420 176376393 /nfs/dbraw/zinc/37/63/93/176376393.db2.gz YHHRVYUEZBNPDP-UTUOFQBUSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000309793534 176395532 /nfs/dbraw/zinc/39/55/32/176395532.db2.gz PRIYQOQKXAXYEY-VXGBXAGGSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+][C@@H]1CC[N@H+](C)[C@@H]2CCC[C@H]21 ZINC000309775596 176397351 /nfs/dbraw/zinc/39/73/51/176397351.db2.gz LPSZJWSLJCBQIJ-RKQHYHRCSA-N 2 0 222.376 2.105 20 0 BEADRP CC[NH+]1CCC(C[NH2+]CCC2(C)CC2)CC1 ZINC001652368046 1173071571 /nfs/dbraw/zinc/07/15/71/1173071571.db2.gz FEPFJCFOUMDJEB-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@H](CCC(C)(C)C)[NH2+]CCOCC[NH+](C)C ZINC000302560145 176616172 /nfs/dbraw/zinc/61/61/72/176616172.db2.gz XZXFTPOQNCREEV-CYBMUJFWSA-N 2 0 244.423 2.369 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CCC(C)(F)F ZINC000357714863 176618299 /nfs/dbraw/zinc/61/82/99/176618299.db2.gz IRRWMQDHSBBFAX-SECBINFHSA-N 2 0 208.296 2.139 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H](CN(C)C)c1ccccc1 ZINC000336789917 176620793 /nfs/dbraw/zinc/62/07/93/176620793.db2.gz KDUGFJDPLSSHSZ-UKRRQHHQSA-N 2 0 249.402 2.006 20 0 BEADRP C[C@H](c1cccc(O)c1)[N@H+](C)C[C@@H]1CCC[NH2+]C1 ZINC000226437845 177037933 /nfs/dbraw/zinc/03/79/33/177037933.db2.gz GSNRSUJSCLGWQC-CHWSQXEVSA-N 2 0 248.370 2.385 20 0 BEADRP C[C@H](c1ccccn1)[N@@H+]1CCC[C@H](CC[NH3+])C1 ZINC000070169589 177043975 /nfs/dbraw/zinc/04/39/75/177043975.db2.gz WWMCKIQIONJJKV-CHWSQXEVSA-N 2 0 233.359 2.203 20 0 BEADRP C[C@H](c1ccccn1)[N@@H+]1C[C@@H]2CCC[C@H]([NH3+])[C@@H]2C1 ZINC000125318735 177044045 /nfs/dbraw/zinc/04/40/45/177044045.db2.gz NZZGOCAJVWEUFJ-RQJABVFESA-N 2 0 245.370 2.202 20 0 BEADRP C[C@H]1CCCC[C@H]1[NH2+]CCCC[NH+](C)C ZINC000045662971 177088573 /nfs/dbraw/zinc/08/85/73/177088573.db2.gz FMHWEPVUIKJCFC-QWHCGFSZSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@H]1CCCC[C@H]1[NH2+]C1CCC([NH3+])CC1 ZINC000051692908 177088777 /nfs/dbraw/zinc/08/87/77/177088777.db2.gz XBJSBKWDCYGEQI-YWPUVAFDSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@@H]1CCC[C@H](C)[C@H]1[NH2+]CC1=CC[NH2+]CC1 ZINC000335499596 177118658 /nfs/dbraw/zinc/11/86/58/177118658.db2.gz HJEALSNUWSXJLE-IMRBUKKESA-N 2 0 222.376 2.320 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+]C1Cc2ccccc2C1 ZINC000335044240 177174726 /nfs/dbraw/zinc/17/47/26/177174726.db2.gz XWUARBRLFUUIBF-LRDDRELGSA-N 2 0 244.382 2.132 20 0 BEADRP C[C@@H]1CC[C@H](C)[N@H+](CC2CC[NH2+]CC2)C1 ZINC000084048129 177183142 /nfs/dbraw/zinc/18/31/42/177183142.db2.gz RNWBTYAMEAKDKT-NEPJUHHUSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+]CC2=CC[N@H+](C)CC2)C1 ZINC000309105912 177193227 /nfs/dbraw/zinc/19/32/27/177193227.db2.gz HWKXDEILZBQEHM-WCQYABFASA-N 2 0 208.349 2.027 20 0 BEADRP C[C@H]1C[N@H+](CCC2CCCCC2)C[C@@H]1[NH3+] ZINC000235675818 177246252 /nfs/dbraw/zinc/24/62/52/177246252.db2.gz ZTDWQJFLWKRRLN-AAEUAGOBSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@H]1C[N@H+](CC2CCCCCC2)C[C@@H]1[NH3+] ZINC000235669464 177246629 /nfs/dbraw/zinc/24/66/29/177246629.db2.gz ZVRBWVXUAJALGW-AAEUAGOBSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@H]1C[N@H+](CCCc2ccccc2)CC[C@@H]1[NH3+] ZINC000049713012 177249887 /nfs/dbraw/zinc/24/98/87/177249887.db2.gz DRNWZLBWEXEPDR-ZFWWWQNUSA-N 2 0 232.371 2.288 20 0 BEADRP C[C@H]1CN(c2cc[nH+]c3ccccc32)C[C@@H]1[NH3+] ZINC000235716323 177277202 /nfs/dbraw/zinc/27/72/02/177277202.db2.gz FOEYTZBFVYKWDI-JQWIXIFHSA-N 2 0 227.311 2.018 20 0 BEADRP C[C@@H]1C[C@H](C)C[N@@H+](CCC2CC[NH2+]CC2)C1 ZINC000026515085 177312649 /nfs/dbraw/zinc/31/26/49/177312649.db2.gz ZFUSEAGMIYQSFG-BETUJISGSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H]1C[C@H](C)C[N@@H+](CCC[NH2+]Cc2cc[nH]c2)C1 ZINC000086251047 177313634 /nfs/dbraw/zinc/31/36/34/177313634.db2.gz XTJQBEUQYQCMBW-OKILXGFUSA-N 2 0 249.402 2.472 20 0 BEADRP C[C@H]1C[C@@H]([NH3+])CC[N@@H+]1CCc1ccccc1 ZINC000049708927 177327706 /nfs/dbraw/zinc/32/77/06/177327706.db2.gz NSBXMYHTQVVHAT-JSGCOSHPSA-N 2 0 218.344 2.041 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]C2CCCCCC2)CC[NH2+]1 ZINC000235693349 177331322 /nfs/dbraw/zinc/33/13/22/177331322.db2.gz NYPFZJFPGKJMLM-AAEUAGOBSA-N 2 0 210.365 2.439 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CCc2ccc(O)cc2)CC[N@@H+]1C ZINC000156113757 177331763 /nfs/dbraw/zinc/33/17/63/177331763.db2.gz STRYNYQFCVQJRC-JSGCOSHPSA-N 2 0 248.370 2.007 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@H]1C ZINC000309050385 177335143 /nfs/dbraw/zinc/33/51/43/177335143.db2.gz PIVVJSVBOPVVLH-NAWOPXAZSA-N 2 0 210.365 2.103 20 0 BEADRP C[C@H]1C[C@@H]1C[N@H+](CCC[NH3+])Cc1ccccc1 ZINC000339406329 177342300 /nfs/dbraw/zinc/34/23/00/177342300.db2.gz GEGUPNWLMMYFKQ-DZGCQCFKSA-N 2 0 232.371 2.493 20 0 BEADRP C[C@H](CN1CCCCCC1)[NH2+]C[C@H]1C[C@@H]1C ZINC000336755667 177345524 /nfs/dbraw/zinc/34/55/24/177345524.db2.gz XUXMDDFHXMPAKK-BFHYXJOUSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1C[C@H](C[N@H+](C)CC2CCC2)CC[NH2+]1 ZINC000235723537 177361827 /nfs/dbraw/zinc/36/18/27/177361827.db2.gz XXOBGIURTPNGSY-WCQYABFASA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]1C[C@H](N(C)Cc2cccc(O)c2)CC[N@@H+]1C ZINC000093644762 177364507 /nfs/dbraw/zinc/36/45/07/177364507.db2.gz XOWUZAYHCKPZIB-GXTWGEPZSA-N 2 0 248.370 2.307 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]CC1CCCC1 ZINC000036908584 177369219 /nfs/dbraw/zinc/36/92/19/177369219.db2.gz ADPPVWLZEVORLJ-DYEKYZERSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]CCC(C)(F)F ZINC000357719314 177369620 /nfs/dbraw/zinc/36/96/20/177369620.db2.gz ZAPRIVTYXVMETN-VWYCJHECSA-N 2 0 234.334 2.350 20 0 BEADRP C[C@H]1C[C@H]1C[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000336782345 177381684 /nfs/dbraw/zinc/38/16/84/177381684.db2.gz XIPKFPWUVBHEFK-AAEUAGOBSA-N 2 0 222.376 2.106 20 0 BEADRP C[C@H]1Cc2ncn(CCn3ccnc3)c2C[C@@H]1C ZINC000295070669 177391041 /nfs/dbraw/zinc/39/10/41/177391041.db2.gz CLNDHTDOYMPJSP-RYUDHWBXSA-N 2 0 244.342 2.151 20 0 BEADRP C[C@H]1Cc2ccccc2[C@H]1[NH2+]CCN(C)C ZINC000287098101 177391365 /nfs/dbraw/zinc/39/13/65/177391365.db2.gz PWHVWTURUPQWQW-FZMZJTMJSA-N 2 0 218.344 2.071 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCc2ccccc2C1)[C@@H]1CCC[NH2+]1 ZINC000400347001 225037998 /nfs/dbraw/zinc/03/79/98/225037998.db2.gz HUVFUDUMNZSXJK-MAZHCROVSA-N 2 0 244.382 2.274 20 0 BEADRP Cc1cc(N2CC[N@H+](C)[C@H](C(C)C)C2)cc[nH+]1 ZINC000487078080 225286879 /nfs/dbraw/zinc/28/68/79/225286879.db2.gz XWTKXASOTAYVSJ-AWEZNQCLSA-N 2 0 233.359 2.166 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C)C1 ZINC000488310706 225366541 /nfs/dbraw/zinc/36/65/41/225366541.db2.gz HJMONTNTFAWEAR-SYQHCUMBSA-N 2 0 222.376 2.059 20 0 BEADRP C[C@H]([NH2+]CCCC(C)(F)F)[C@@H]1CCC[NH2+]1 ZINC000400323996 226340618 /nfs/dbraw/zinc/34/06/18/226340618.db2.gz BYKMRIRSHDUKTF-UWVGGRQHSA-N 2 0 220.307 2.152 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCC[C@@H](C)C1)[C@@H]1CCC[NH2+]1 ZINC000400630251 226348005 /nfs/dbraw/zinc/34/80/05/226348005.db2.gz LPLFJCSAWJOUJS-NDBYEHHHSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H]([NH2+][C@H]1CC2CCC1CC2)[C@@H]1CCC[NH2+]1 ZINC000400690082 226349501 /nfs/dbraw/zinc/34/95/01/226349501.db2.gz YVEBUJKQOROWDE-ASUPZPJHSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)C(C)(C)C ZINC000400941002 226352377 /nfs/dbraw/zinc/35/23/77/226352377.db2.gz CVGDWUYQCLWXQT-QNWHQSFQSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)c1cccnc1 ZINC000401010791 226352573 /nfs/dbraw/zinc/35/25/73/226352573.db2.gz MGGWVYSVUITLCE-PMOUVXMZSA-N 2 0 245.370 2.120 20 0 BEADRP C[C@@H]1CN(C)C[C@@H]1[NH2+]Cc1cccc2[nH]ccc21 ZINC000674912609 487653067 /nfs/dbraw/zinc/65/30/67/487653067.db2.gz JQELBKSYRJLUQO-ABAIWWIYSA-N 2 0 243.354 2.208 20 0 BEADRP C[C@H]([NH2+]CCCc1ccccc1)[C@@H]1CCC[NH2+]1 ZINC000400785097 229158579 /nfs/dbraw/zinc/15/85/79/229158579.db2.gz QNKJYQNOFKCVPG-ZFWWWQNUSA-N 2 0 232.371 2.349 20 0 BEADRP CC(C)CC[N@H+](CC[C@H]1CC[NH2+]C1)C1CC1 ZINC000096997299 487685471 /nfs/dbraw/zinc/68/54/71/487685471.db2.gz RUAKSIVNWNHGAX-CYBMUJFWSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH+](C)C[C@H]1CC[N@@H+]([C@@H]2C[C@@H]2c2ccccc2)C1 ZINC000411263449 487697227 /nfs/dbraw/zinc/69/72/27/487697227.db2.gz FEFIRAOOTQPRBV-FVQBIDKESA-N 2 0 244.382 2.426 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@@H]([NH3+])C1)c1ccncc1 ZINC000088169919 487708696 /nfs/dbraw/zinc/70/86/96/487708696.db2.gz VDNWWONLSFYFKI-UHTWSYAYSA-N 2 0 219.332 2.002 20 0 BEADRP C[C@H](CC[NH3+])[NH2+]Cc1nccc2ccccc21 ZINC000136137395 487712217 /nfs/dbraw/zinc/71/22/17/487712217.db2.gz DVEVZOGXCLJZEN-LLVKDONJSA-N 2 0 229.327 2.062 20 0 BEADRP Cc1c[nH+]ccc1NCCC[N@@H+](C)CC(C)C ZINC000651362626 487714074 /nfs/dbraw/zinc/71/40/74/487714074.db2.gz CGGRUWONMMUDMS-UHFFFAOYSA-N 2 0 235.375 2.202 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CC2(C)CC[NH+](C)CC2)CS1 ZINC000226343849 487714373 /nfs/dbraw/zinc/71/43/73/487714373.db2.gz HKDZTSSTQHXRKG-NWDGAFQWSA-N 2 0 242.432 2.202 20 0 BEADRP CC[C@H]1C[C@@H]([NH2+]CCC[N@H+](C)C(C)C)CCO1 ZINC000226340009 487714386 /nfs/dbraw/zinc/71/43/86/487714386.db2.gz JIAGANJGGRZTTH-KBPBESRZSA-N 2 0 242.407 2.264 20 0 BEADRP CC[C@]1(C)CCC[N@H+](C[C@@H]2CC[NH2+]C2)C1 ZINC000379462400 487734035 /nfs/dbraw/zinc/73/40/35/487734035.db2.gz UKWLVJVPNUJENT-CHWSQXEVSA-N 2 0 210.365 2.108 20 0 BEADRP C(C1CCC1)[N@@H+]1CCC[C@H]([C@H]2CCC[NH2+]2)C1 ZINC000250681430 487739029 /nfs/dbraw/zinc/73/90/29/487739029.db2.gz YMTNIUSCZAGENU-UONOGXRCSA-N 2 0 222.376 2.251 20 0 BEADRP c1ccc(C2CC2)c(C[NH2+]C2CC[NH2+]CC2)c1 ZINC000666734173 487744968 /nfs/dbraw/zinc/74/49/68/487744968.db2.gz DHMAISQDGVJXNB-UHFFFAOYSA-N 2 0 230.355 2.406 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](C[C@H](C)C(C)(C)C)C1 ZINC000251124418 487748522 /nfs/dbraw/zinc/74/85/22/487748522.db2.gz RXFKURYNWJQPFN-RYUDHWBXSA-N 2 0 212.381 2.210 20 0 BEADRP CC[C@H]1C[N@H+](CCC(C)(C)C)CC[C@@H]1[NH3+] ZINC000157894876 487760686 /nfs/dbraw/zinc/76/06/86/487760686.db2.gz ZRNVHNGETJENMA-RYUDHWBXSA-N 2 0 212.381 2.482 20 0 BEADRP C[C@H]([NH2+]C1CCC([NH+](C)C)CC1)[C@H]1CC1(F)F ZINC000666229496 487764769 /nfs/dbraw/zinc/76/47/69/487764769.db2.gz OTDYRUWBKJZLNR-WNYYMSAVSA-N 2 0 246.345 2.493 20 0 BEADRP CCc1ccc(C[NH2+][C@H]2CCC[NH2+]CC2)cc1 ZINC000234149770 487765288 /nfs/dbraw/zinc/76/52/88/487765288.db2.gz TVPSGQNYXTYJRG-HNNXBMFYSA-N 2 0 232.371 2.481 20 0 BEADRP CC[C@@H]1C[N@@H+]([C@H](C)c2cccnc2)CC[C@@H]1[NH3+] ZINC000251524469 487765221 /nfs/dbraw/zinc/76/52/21/487765221.db2.gz ACGWYUHUTQFPIC-BZPMIXESSA-N 2 0 233.359 2.202 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H]2C2CC2)CC[NH2+]1 ZINC000414951288 487773701 /nfs/dbraw/zinc/77/37/01/487773701.db2.gz PNLIRSVKZXACNB-RUZUBIRVSA-N 2 0 222.376 2.295 20 0 BEADRP [NH3+]C[C@]12CCC[C@H]1C[N@H+](Cc1ccc(F)cc1)C2 ZINC000385306678 487780137 /nfs/dbraw/zinc/78/01/37/487780137.db2.gz ZALZRROSJSHHQG-ZFWWWQNUSA-N 2 0 248.345 2.387 20 0 BEADRP C[C@@H]1CC[N@H+](CC2CC[NH2+]CC2)[C@H](C)C1 ZINC000051732099 487784415 /nfs/dbraw/zinc/78/44/15/487784415.db2.gz UWUDXSUCGTUOSV-VXGBXAGGSA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@@H]1C[N@H+](Cc2ccsc2)CC[C@H]1[NH3+] ZINC000251691388 487790469 /nfs/dbraw/zinc/79/04/69/487790469.db2.gz IKDYGKRRAHYDRX-VXGBXAGGSA-N 2 0 224.373 2.307 20 0 BEADRP CC[C@H](C[NH+]1CCCC1)Nc1cc[nH+]c(C)c1 ZINC000681386519 487790207 /nfs/dbraw/zinc/79/02/07/487790207.db2.gz YLWKGOCGZMJSNC-CYBMUJFWSA-N 2 0 233.359 2.098 20 0 BEADRP CC[C@H]1C[N@H+](CCCC(C)C)CC[C@H]1[NH3+] ZINC000251720829 487792704 /nfs/dbraw/zinc/79/27/04/487792704.db2.gz JYGUWFSKABZEFL-QWHCGFSZSA-N 2 0 212.381 2.482 20 0 BEADRP C[N@@H+]1CCC[C@H](CC[NH2+][C@@H]2CC[C@H]2C2CC2)C1 ZINC000459799671 487800646 /nfs/dbraw/zinc/80/06/46/487800646.db2.gz YVRRDOGOSXHFLN-VHDGCEQUSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]1CC[N@H+](CC[C@H]2CC[NH2+]C2)[C@H](C)C1 ZINC000252113763 487816478 /nfs/dbraw/zinc/81/64/78/487816478.db2.gz IDXVHGFARSKHLW-JHJVBQTASA-N 2 0 210.365 2.106 20 0 BEADRP [NH3+]CCC[N@@H+]1CCCCC[C@H]1c1ccncc1 ZINC000414671209 487817889 /nfs/dbraw/zinc/81/78/89/487817889.db2.gz NJYRXTJMEMADEO-AWEZNQCLSA-N 2 0 233.359 2.348 20 0 BEADRP Cc1ccccc1CC(C)(C)[NH2+]CCC[NH3+] ZINC000414701272 487819151 /nfs/dbraw/zinc/81/91/51/487819151.db2.gz GQQGKQXMYHMLKP-UHFFFAOYSA-N 2 0 220.360 2.255 20 0 BEADRP [NH3+]CCCN1CC[C@](F)(c2ccccc2F)C1 ZINC000414766544 487823700 /nfs/dbraw/zinc/82/37/00/487823700.db2.gz RFWHQZSANKJXNI-CYBMUJFWSA-N 2 0 240.297 2.045 20 0 BEADRP COc1ccsc1C[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000414936633 487831287 /nfs/dbraw/zinc/83/12/87/487831287.db2.gz ZIVLUQQKEGYQKK-NXEZZACHSA-N 2 0 240.372 2.116 20 0 BEADRP C[C@H](c1ccncc1)[N@@H+]1C[C@@H]2CCC[C@@H]([NH3+])[C@H]2C1 ZINC000252866671 487836879 /nfs/dbraw/zinc/83/68/79/487836879.db2.gz QMCRWCQNUWMDCQ-UQOMUDLDSA-N 2 0 245.370 2.202 20 0 BEADRP CC[C@H]1CN(C)c2ccccc2C[N@@H+]1CCC[NH3+] ZINC000666650358 487851901 /nfs/dbraw/zinc/85/19/01/487851901.db2.gz LTHKLVSPTNHPAP-AWEZNQCLSA-N 2 0 247.386 2.066 20 0 BEADRP C[C@H](CC1CCC1)[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000666789038 487859478 /nfs/dbraw/zinc/85/94/78/487859478.db2.gz ATHCOXJKSCZFCE-DGCLKSJQSA-N 2 0 210.365 2.154 20 0 BEADRP Cc1ccc(CCC[N@H+](CCO)C2CCC2)cn1 ZINC000684406258 487864087 /nfs/dbraw/zinc/86/40/87/487864087.db2.gz WXAGQPQLOBZEHU-UHFFFAOYSA-N 2 0 248.370 2.169 20 0 BEADRP CC1(C[NH2+]CC2([NH3+])CCCCCC2)CC1 ZINC000666808155 487865957 /nfs/dbraw/zinc/86/59/57/487865957.db2.gz BPMKKGOIGOFSNP-UHFFFAOYSA-N 2 0 210.365 2.428 20 0 BEADRP CCc1ccc(C[NH2+][C@H]2CC[NH2+]C[C@@H]2C)s1 ZINC000309331794 487867201 /nfs/dbraw/zinc/86/72/01/487867201.db2.gz IYPGJGPJIAKXAB-GWCFXTLKSA-N 2 0 238.400 2.398 20 0 BEADRP Cc1ccc(CCC[NH2+][C@H]2CCC[NH2+]CC2)cn1 ZINC000666857854 487873392 /nfs/dbraw/zinc/87/33/92/487873392.db2.gz MLSWVSPOVXXBAL-HNNXBMFYSA-N 2 0 247.386 2.054 20 0 BEADRP Cc1cc(F)ccc1C[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000666855297 487890617 /nfs/dbraw/zinc/89/06/17/487890617.db2.gz LDNJWFNLDYXMBM-CQSZACIVSA-N 2 0 236.334 2.366 20 0 BEADRP C[C@@H](CC1CCC1)[NH2+][C@H]1CCC[NH2+]CC1 ZINC000666857874 487891573 /nfs/dbraw/zinc/89/15/73/487891573.db2.gz NORBYRPPWGOECI-AAEUAGOBSA-N 2 0 210.365 2.297 20 0 BEADRP CC(C)C[C@H](C)C[NH2+][C@H]1CCC[NH2+]CC1 ZINC000666858971 487891620 /nfs/dbraw/zinc/89/16/20/487891620.db2.gz PVIMAQWVTCHRCK-STQMWFEESA-N 2 0 212.381 2.400 20 0 BEADRP CC(C)C[C@H](C)C[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000666955543 487892421 /nfs/dbraw/zinc/89/24/21/487892421.db2.gz YJLHOGUBEONHQD-QWHCGFSZSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H](CC1CCC1)[NH2+][C@H]1CC[NH2+]C[C@H]1C ZINC000666880451 487895210 /nfs/dbraw/zinc/89/52/10/487895210.db2.gz NCSSKPYCEMXRIP-WZRBSPASSA-N 2 0 210.365 2.153 20 0 BEADRP CC1(C[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)CCC1 ZINC000666993918 487902252 /nfs/dbraw/zinc/90/22/52/487902252.db2.gz SSOCSWGZEFCAOH-LBPRGKRZSA-N 2 0 222.376 2.441 20 0 BEADRP CN1CC(C[N@H+](C)CC(C)(C)c2ccccc2)C1 ZINC000668540191 487906567 /nfs/dbraw/zinc/90/65/67/487906567.db2.gz ZFUIVKOVYSLXEV-UHFFFAOYSA-N 2 0 246.398 2.458 20 0 BEADRP Fc1ccc(C[NH2+][C@@H]2CC23CC[NH2+]CC3)cc1 ZINC000666950729 487913058 /nfs/dbraw/zinc/91/30/58/487913058.db2.gz CVNCIEIWDUHROT-CYBMUJFWSA-N 2 0 234.318 2.057 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000666954052 487915936 /nfs/dbraw/zinc/91/59/36/487915936.db2.gz ONZUDKWXBNDKJD-AGIUHOORSA-N 2 0 222.376 2.297 20 0 BEADRP CC1(C)CC[C@H]([NH2+][C@H]2CC23CC[NH2+]CC3)C1 ZINC000666953691 487916082 /nfs/dbraw/zinc/91/60/82/487916082.db2.gz FBSVDOOHTBBQGY-RYUDHWBXSA-N 2 0 222.376 2.297 20 0 BEADRP CC1(C)CCC[C@H]1[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000666954096 487916188 /nfs/dbraw/zinc/91/61/88/487916188.db2.gz PTLPIVWKFWKMTI-NEPJUHHUSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H](CCC1CC1)[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000666953887 487916195 /nfs/dbraw/zinc/91/61/95/487916195.db2.gz KBEGJEBWEKKFKH-YPMHNXCESA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H](CC1CCC1)[NH2+][C@@H]1CC[C@@H](C[NH3+])C1 ZINC000666963978 487919792 /nfs/dbraw/zinc/91/97/92/487919792.db2.gz UNEIISCTHULNNJ-RAIGVLPGSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC[NH2+]C1(C)C)C(C)(C)C ZINC000666966504 487920108 /nfs/dbraw/zinc/92/01/08/487920108.db2.gz YNERLDFBCZPQFQ-MNOVXSKESA-N 2 0 212.381 2.399 20 0 BEADRP C([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)[C@@H]1CCSC1 ZINC000666993956 487923451 /nfs/dbraw/zinc/92/34/51/487923451.db2.gz WMIKMHCQNXIAOZ-RYUDHWBXSA-N 2 0 240.416 2.004 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CS[C@H](C)C1)C1CC[NH+](C)CC1 ZINC000396470950 487935168 /nfs/dbraw/zinc/93/51/68/487935168.db2.gz XEBIOURAYRUCOU-WZRBSPASSA-N 2 0 242.432 2.200 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C2CCC([NH+](C)C)CC2)CS1 ZINC000666207373 487935451 /nfs/dbraw/zinc/93/54/51/487935451.db2.gz AKGCBVCQAIVNMI-CQLXCSJHSA-N 2 0 242.432 2.343 20 0 BEADRP C[C@H]1C[C@H]([NH2+]C2CCC([NH+](C)C)CC2)CS1 ZINC000666207376 487935568 /nfs/dbraw/zinc/93/55/68/487935568.db2.gz AKGCBVCQAIVNMI-QCXCNERSSA-N 2 0 242.432 2.343 20 0 BEADRP CC1=CCC[C@H](C)[C@@H]1C[NH+]1C[C@@H]2C[NH2+]C[C@H]2C1 ZINC000682404682 487947608 /nfs/dbraw/zinc/94/76/08/487947608.db2.gz HYVSTPZZCIFQRM-ZQDZILKHSA-N 2 0 234.387 2.130 20 0 BEADRP Cc1ccccc1C[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000258987781 322880788 /nfs/dbraw/zinc/88/07/88/322880788.db2.gz LLSNUISFIJVFTD-CYBMUJFWSA-N 2 0 218.344 2.084 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]Cc1ccnc2ccccc12 ZINC000564970368 322984179 /nfs/dbraw/zinc/98/41/79/322984179.db2.gz JTFBWNZQOYZSRT-VXGBXAGGSA-N 2 0 243.354 2.450 20 0 BEADRP C[C@@H](Cc1ccsc1)[NH2+]CC1=CC[NH2+]CC1 ZINC000567654798 323034626 /nfs/dbraw/zinc/03/46/26/323034626.db2.gz COOSGARFNSKLOS-NSHDSACASA-N 2 0 236.384 2.188 20 0 BEADRP C[C@@H]([NH3+])c1ccc(OCCC2CC[NH2+]CC2)cc1 ZINC000569687302 323036941 /nfs/dbraw/zinc/03/69/41/323036941.db2.gz ZBKJQUCNHNWNAU-GFCCVEGCSA-N 2 0 248.370 2.475 20 0 BEADRP C[NH+]1CCC(CC[NH2+][C@H]2CCC[C@H]3C[C@H]32)CC1 ZINC000408510945 323047253 /nfs/dbraw/zinc/04/72/53/323047253.db2.gz ZGSLAQCFDIVPMJ-ZNMIVQPWSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H](Cc1ccc(O)cc1)[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000570107599 323050270 /nfs/dbraw/zinc/05/02/70/323050270.db2.gz XURHFGCJIMBPDJ-BNOWGMLFSA-N 2 0 248.370 2.183 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]CC23CCC(CC2)C3)C1 ZINC000570226585 323053712 /nfs/dbraw/zinc/05/37/12/323053712.db2.gz OBADUXRTNNUTGF-QPPOZKHWSA-N 2 0 222.376 2.426 20 0 BEADRP CCCc1cccc(C[N@H+](C)CCC[NH3+])c1 ZINC000570396383 323058405 /nfs/dbraw/zinc/05/84/05/323058405.db2.gz JNDWRQKNYBRZSX-UHFFFAOYSA-N 2 0 220.360 2.420 20 0 BEADRP Cc1ccncc1C[NH2+]Cc1ccc(C[NH3+])cc1 ZINC000563136126 323094911 /nfs/dbraw/zinc/09/49/11/323094911.db2.gz SIMSPWJVXLAYRK-UHFFFAOYSA-N 2 0 241.338 2.139 20 0 BEADRP Cc1ncc(C[NH2+]CCCc2ccccc2)n1C ZINC000563441351 323126746 /nfs/dbraw/zinc/12/67/46/323126746.db2.gz QZJKGNRELUJMCP-UHFFFAOYSA-N 2 0 243.354 2.451 20 0 BEADRP Cn1cncc1CC[NH2+][C@@H]1CCc2ccccc21 ZINC000401832020 323127758 /nfs/dbraw/zinc/12/77/58/323127758.db2.gz JWDXVMDNXBIELT-OAHLLOKOSA-N 2 0 241.338 2.240 20 0 BEADRP C[C@@H]1CCC[C@H]1[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000252180558 323141330 /nfs/dbraw/zinc/14/13/30/323141330.db2.gz PYOKJFOPPONBTB-JHJVBQTASA-N 2 0 210.365 2.106 20 0 BEADRP CCC[C@@H](CC)[NH2+]CC1(COC)CC[NH2+]CC1 ZINC000414971340 323152356 /nfs/dbraw/zinc/15/23/56/323152356.db2.gz ITRDCDZKUGUBLJ-CYBMUJFWSA-N 2 0 242.407 2.171 20 0 BEADRP Cc1ccc(CC[NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)o1 ZINC000531940792 323155980 /nfs/dbraw/zinc/15/59/80/323155980.db2.gz MRBLERYZRSCBKY-AAEUAGOBSA-N 2 0 236.359 2.203 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H](c1cccnc1)C(C)C ZINC000571669297 323177069 /nfs/dbraw/zinc/17/70/69/323177069.db2.gz FGHDCOYLJSRMPO-AWEZNQCLSA-N 2 0 235.375 2.368 20 0 BEADRP C[C@H](O)C[C@H](C)C[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000398578337 323186816 /nfs/dbraw/zinc/18/68/16/323186816.db2.gz LAPFPTIBGQDUBM-UOVKNHIHSA-N 2 0 248.370 2.128 20 0 BEADRP CC(C)[C@H]([NH2+][C@H]1CC[NH2+]C[C@H]1C)C1CC1 ZINC000323953517 323188344 /nfs/dbraw/zinc/18/83/44/323188344.db2.gz AAYXGQJTRYINKS-WXHSDQCUSA-N 2 0 210.365 2.009 20 0 BEADRP CC(C)[C@H]([NH2+][C@@H]1CC[NH2+]C[C@@H]1C)C1CC1 ZINC000323953516 323188348 /nfs/dbraw/zinc/18/83/48/323188348.db2.gz AAYXGQJTRYINKS-UHTWSYAYSA-N 2 0 210.365 2.009 20 0 BEADRP CC[C@@]1(C)CC[N@H+](C[C@@H]([NH3+])CC(C)C)C1 ZINC000399422500 323206028 /nfs/dbraw/zinc/20/60/28/323206028.db2.gz VKEABJNQPGHWIN-STQMWFEESA-N 2 0 212.381 2.482 20 0 BEADRP CC1(C)CC[C@H]1[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000530216555 323217185 /nfs/dbraw/zinc/21/71/85/323217185.db2.gz QKUSLLYMSDNORK-GHMZBOCLSA-N 2 0 208.349 2.049 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H](C1CC1)C1CCC1 ZINC000324701767 323263460 /nfs/dbraw/zinc/26/34/60/323263460.db2.gz YLQIRYMELFLMQJ-ZWNOBZJWSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]C(C1CCC1)C1CCC1 ZINC000324712296 323266046 /nfs/dbraw/zinc/26/60/46/323266046.db2.gz CJGXFFGJNIPSSN-SNVBAGLBSA-N 2 0 210.365 2.140 20 0 BEADRP C([NH2+][C@H](C1CC1)C1CCC1)[C@H]1CCC[NH2+]C1 ZINC000324788293 323282501 /nfs/dbraw/zinc/28/25/01/323282501.db2.gz IYKBDOIRJGNIOF-FZMZJTMJSA-N 2 0 222.376 2.154 20 0 BEADRP C[C@@H]([NH3+])[C@@H](C)[NH2+]C(C1CCC1)C1CCC1 ZINC000324774577 323283463 /nfs/dbraw/zinc/28/34/63/323283463.db2.gz DTPWIVULHWLFIP-NXEZZACHSA-N 2 0 210.365 2.281 20 0 BEADRP C(C[NH2+]C1(C2CC2)CC1)C[NH+]1CCCCC1 ZINC000309384256 323365188 /nfs/dbraw/zinc/36/51/88/323365188.db2.gz AHAREHCNENNBMU-UHFFFAOYSA-N 2 0 222.376 2.395 20 0 BEADRP C[C@H]([NH2+]CCC[NH+]1CCCC1)[C@@H]1C[C@H]1C ZINC000321898903 323390522 /nfs/dbraw/zinc/39/05/22/323390522.db2.gz NCANEAXTABIYIQ-FRRDWIJNSA-N 2 0 210.365 2.106 20 0 BEADRP Cc1ccc(CC[NH+]2CCC(C[NH3+])CC2)cc1 ZINC000059600430 324015018 /nfs/dbraw/zinc/01/50/18/324015018.db2.gz SFDPITYPKPYCRD-UHFFFAOYSA-N 2 0 232.371 2.208 20 0 BEADRP C[C@H]([NH2+]CCC1CC[NH+](C)CC1)C1CC1 ZINC000122062546 324025978 /nfs/dbraw/zinc/02/59/78/324025978.db2.gz OHHGLWDHCONYSS-NSHDSACASA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)[C@H](C)[NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1 ZINC000122588709 324050604 /nfs/dbraw/zinc/05/06/04/324050604.db2.gz JICUYKZJQAUSGO-XQQFMLRXSA-N 2 0 212.381 2.493 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H]1CCc2ccc(OC)cc21 ZINC000572832509 324132302 /nfs/dbraw/zinc/13/23/02/324132302.db2.gz ATECNQRYBDYUDB-OAHLLOKOSA-N 2 0 248.370 2.272 20 0 BEADRP CC(C)(C)[C@@H]1CC[C@@H]1[NH2+]CC1CC[NH2+]CC1 ZINC000572510484 324136905 /nfs/dbraw/zinc/13/69/05/324136905.db2.gz RNOAEPFUPXNHJG-OLZOCXBDSA-N 2 0 224.392 2.400 20 0 BEADRP CC[N@H+](C)C[C@@H]1CCN(C/C=C(/C)Cl)C1 ZINC000528396508 324220342 /nfs/dbraw/zinc/22/03/42/324220342.db2.gz IEPCQZHTWCRWDB-QJGQKNTRSA-N 2 0 230.783 2.403 20 0 BEADRP C[C@H]([NH2+]CC(C)(C)N(C)C)C1CC(F)(F)C1 ZINC000529537494 324322392 /nfs/dbraw/zinc/32/23/92/324322392.db2.gz WCGBKSKLJGSHJF-VIFPVBQESA-N 2 0 234.334 2.350 20 0 BEADRP C[C@H]([NH2+]CCC[NH+]1CCCC1)C1CC(F)(F)C1 ZINC000529541228 324331815 /nfs/dbraw/zinc/33/18/15/324331815.db2.gz HFFRLERYXKAEAI-NSHDSACASA-N 2 0 246.345 2.496 20 0 BEADRP CCCC[NH+]1CCC([NH2+][C@@H](C)COCC)CC1 ZINC000130018435 325004544 /nfs/dbraw/zinc/00/45/44/325004544.db2.gz JPIIFRVUSTWKMG-ZDUSSCGKSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@H](CC1CC1)[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000130197736 325023393 /nfs/dbraw/zinc/02/33/93/325023393.db2.gz NCHMNIFHVAOTIW-KWCYVHTRSA-N 2 0 222.376 2.391 20 0 BEADRP CC[C@H](COC)[NH2+]C1CC[NH+](CC(C)C)CC1 ZINC000131229824 325127904 /nfs/dbraw/zinc/12/79/04/325127904.db2.gz ALFCFZCVQAYHNG-CYBMUJFWSA-N 2 0 242.407 2.121 20 0 BEADRP CC(C)[N@@H+]1CC[C@H](C[NH2+][C@@H]2CSC[C@H]2C)C1 ZINC000304365268 325146182 /nfs/dbraw/zinc/14/61/82/325146182.db2.gz FFYHAEMWNOEDRZ-JHJVBQTASA-N 2 0 242.432 2.058 20 0 BEADRP CC[C@H]1CCC[C@H]1[NH2+]CCCC[NH+](C)C ZINC000132997808 325259208 /nfs/dbraw/zinc/25/92/08/325259208.db2.gz ZQCQPLYNJYSMQL-QWHCGFSZSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)C(C)(C)C ZINC000133321848 325285944 /nfs/dbraw/zinc/28/59/44/325285944.db2.gz UFNNQNMKVZLSJX-NWDGAFQWSA-N 2 0 212.381 2.352 20 0 BEADRP CC[NH+](CC)C[C@H]1CC[N@H+](CCCCOC)C1 ZINC000076002682 325324676 /nfs/dbraw/zinc/32/46/76/325324676.db2.gz KDTMMKNZZKWSAT-CQSZACIVSA-N 2 0 242.407 2.077 20 0 BEADRP CC[C@@H]1C[N@H+](Cc2ccsc2)CC[C@@H]1[NH3+] ZINC000122221229 487969399 /nfs/dbraw/zinc/96/93/99/487969399.db2.gz IKDYGKRRAHYDRX-NEPJUHHUSA-N 2 0 224.373 2.307 20 0 BEADRP C[C@H]1CC(C)(C)C[C@H]1[NH2+]C1CC([NH+](C)C)C1 ZINC000566805612 326085004 /nfs/dbraw/zinc/08/50/04/326085004.db2.gz JAAYFIDMJCOXHL-YWPUVAFDSA-N 2 0 224.392 2.493 20 0 BEADRP Cc1ccc(CC[NH2+][C@H]2CCCCC[C@@H]2[NH3+])o1 ZINC000567579779 326221125 /nfs/dbraw/zinc/22/11/25/326221125.db2.gz CBTSXSXGCOWFJV-KBPBESRZSA-N 2 0 236.359 2.380 20 0 BEADRP [NH3+][C@H]1CCCCC[C@H]1[NH2+]CCCC1CC1 ZINC000567647713 326238150 /nfs/dbraw/zinc/23/81/50/326238150.db2.gz OOPAZXOTCGSFMK-QWHCGFSZSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@H]([NH3+])c1ccc(OCC[C@@H]2CC[NH2+]C2)cc1 ZINC000567673876 326243005 /nfs/dbraw/zinc/24/30/05/326243005.db2.gz PQBGWDXKPGWTAQ-RYUDHWBXSA-N 2 0 234.343 2.085 20 0 BEADRP C[C@@H]([NH3+])c1ccc(OCC[C@H]2CC[NH2+]C2)cc1 ZINC000567673877 326243021 /nfs/dbraw/zinc/24/30/21/326243021.db2.gz PQBGWDXKPGWTAQ-VXGBXAGGSA-N 2 0 234.343 2.085 20 0 BEADRP C[N@@H+]1CCC[C@H]1CC[NH2+][C@@H]1CCC1(C)C ZINC000568182726 326321973 /nfs/dbraw/zinc/32/19/73/326321973.db2.gz ZOXVEXZVBDTGDJ-NWDGAFQWSA-N 2 0 210.365 2.249 20 0 BEADRP COC[C@@H]([NH2+]CCC[NH2+]C(C)C)C1CCCC1 ZINC000568974364 326383250 /nfs/dbraw/zinc/38/32/50/326383250.db2.gz JWXJMBNOLUDDLW-CQSZACIVSA-N 2 0 242.407 2.169 20 0 BEADRP C[C@H](Cc1ccccc1)C[N@H+](C)CCC[NH3+] ZINC000568983393 326384532 /nfs/dbraw/zinc/38/45/32/326384532.db2.gz IAQJNLOSKYOPEP-CYBMUJFWSA-N 2 0 220.360 2.146 20 0 BEADRP Cc1ccc(F)cc1C[NH2+][C@@H](C)C[C@@H](C)[NH3+] ZINC000569002506 326386199 /nfs/dbraw/zinc/38/61/99/326386199.db2.gz BXRQKQBANDQAKS-MNOVXSKESA-N 2 0 224.323 2.350 20 0 BEADRP CC[C@@H]1C[C@@H](C[N@H+](C)CCC[NH+](C)C)CCO1 ZINC000569290964 326399014 /nfs/dbraw/zinc/39/90/14/326399014.db2.gz OEGNOKNKBPXYDT-UONOGXRCSA-N 2 0 242.407 2.075 20 0 BEADRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@@H](CC)C(C)C ZINC000166017259 326427584 /nfs/dbraw/zinc/42/75/84/326427584.db2.gz YQDGLPSQOUULMJ-KBPBESRZSA-N 2 0 244.423 2.367 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000388621081 487972582 /nfs/dbraw/zinc/97/25/82/487972582.db2.gz HGSIIDFDJUXJJO-UPJWGTAASA-N 2 0 210.365 2.297 20 0 BEADRP CCN1CCN(c2ccncc2Cl)C[C@H]1C ZINC000677152182 487984813 /nfs/dbraw/zinc/98/48/13/487984813.db2.gz JSOVTNQHMZVILT-SNVBAGLBSA-N 2 0 239.750 2.265 20 0 BEADRP Cc1ccc(CC[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)o1 ZINC000677236880 488004149 /nfs/dbraw/zinc/00/41/49/488004149.db2.gz VLBTZYFYIMMGPE-UONOGXRCSA-N 2 0 248.370 2.347 20 0 BEADRP CC(C)=CCC[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000400962610 488011744 /nfs/dbraw/zinc/01/17/44/488011744.db2.gz AZVQTONEWKUFIA-MGPQQGTHSA-N 2 0 222.376 2.320 20 0 BEADRP C[C@@H]([NH2+]CC1=CCCC1)C1CC[NH+](C)CC1 ZINC000401179611 488018003 /nfs/dbraw/zinc/01/80/03/488018003.db2.gz TWNSOQLBSFLXJC-GFCCVEGCSA-N 2 0 222.376 2.417 20 0 BEADRP CC(C)[N@H+](C)Cc1ccnn1-c1cc[nH+]cc1 ZINC000667472329 488019294 /nfs/dbraw/zinc/01/92/94/488019294.db2.gz CSMYKNZBVXMOKZ-UHFFFAOYSA-N 2 0 230.315 2.108 20 0 BEADRP C[NH+](C)CCC[NH2+]C[C@@H]1CCc2ccccc2C1 ZINC000223450524 488069635 /nfs/dbraw/zinc/06/96/35/488069635.db2.gz MHCFZVLDURMEJG-CQSZACIVSA-N 2 0 246.398 2.333 20 0 BEADRP Cc1ccnc(C[NH+]2CCC(C[NH+](C)C)CC2)c1 ZINC000683003019 488085506 /nfs/dbraw/zinc/08/55/06/488085506.db2.gz SNUUDWPQZDRPLV-UHFFFAOYSA-N 2 0 247.386 2.164 20 0 BEADRP Cc1ccnc(CN(C)[C@@H]2CC[N@H+](C)[C@@H](C)C2)c1 ZINC000683010615 488090334 /nfs/dbraw/zinc/09/03/34/488090334.db2.gz CIFDNNGOQCENOW-DZGCQCFKSA-N 2 0 247.386 2.305 20 0 BEADRP C([NH2+][C@H]1CCC[C@@H]2C[C@@H]21)[C@H]1CC[N@@H+](C2CC2)C1 ZINC000378890531 488109732 /nfs/dbraw/zinc/10/97/32/488109732.db2.gz PVMWLGVKMFPXLZ-UXOAXIEHSA-N 2 0 234.387 2.249 20 0 BEADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)C1 ZINC000378960180 488113516 /nfs/dbraw/zinc/11/35/16/488113516.db2.gz POGJRQPEEFMITM-LJISPDSOSA-N 2 0 236.403 2.495 20 0 BEADRP C[N@H+](C[C@@H]1CC[C@@H]2C[C@@H]2C1)C1CC[NH2+]CC1 ZINC000403171515 488117030 /nfs/dbraw/zinc/11/70/30/488117030.db2.gz KMMKHNHDXOKLKH-UPJWGTAASA-N 2 0 222.376 2.106 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H]2CCC[C@@H]3C[C@@H]32)C1 ZINC000667796579 488123626 /nfs/dbraw/zinc/12/36/26/488123626.db2.gz PJECVSPMODDHMB-XGUBFFRZSA-N 2 0 236.403 2.497 20 0 BEADRP C([C@@H]1CC[C@H]2C[C@H]2C1)[N@@H+]1[C@@H]2CC[C@H]1C[NH2+]CC2 ZINC000403451158 488124165 /nfs/dbraw/zinc/12/41/65/488124165.db2.gz GBJDAVBNRVNALV-KHMAMNHCSA-N 2 0 234.387 2.249 20 0 BEADRP [NH3+]CC1CC[NH+](C[C@@H]2CC[C@H]3C[C@H]3C2)CC1 ZINC000403583092 488128225 /nfs/dbraw/zinc/12/82/25/488128225.db2.gz CJGARWDPSYCCPG-HZSPNIEDSA-N 2 0 222.376 2.093 20 0 BEADRP C[NH2+]CC1CC[NH+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC000403696120 488132566 /nfs/dbraw/zinc/13/25/66/488132566.db2.gz BDHYBZBEJSWDPW-KFWWJZLASA-N 2 0 236.403 2.354 20 0 BEADRP C[C@@H](C[NH2+][C@@H]1CCC[NH2+]CC1)C(C)(C)C ZINC000168781063 487540307 /nfs/dbraw/zinc/54/03/07/487540307.db2.gz CXXGZGWMBHMBAP-NWDGAFQWSA-N 2 0 212.381 2.400 20 0 BEADRP CC(C)C[C@H](C)[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000390083222 488135273 /nfs/dbraw/zinc/13/52/73/488135273.db2.gz SRYHHVVKUSYDOA-RYUDHWBXSA-N 2 0 210.365 2.153 20 0 BEADRP CCN(CC[NH3+])Cc1ccc(OC(F)F)cc1 ZINC000231819743 487477216 /nfs/dbraw/zinc/47/72/16/487477216.db2.gz BENQFKVQZSEHLT-UHFFFAOYSA-N 2 0 244.285 2.069 20 0 BEADRP CCN(CC[NH3+])Cc1ccc(F)c(Cl)c1 ZINC000231819709 487477658 /nfs/dbraw/zinc/47/76/58/487477658.db2.gz XLQHDGBUPYDFRG-UHFFFAOYSA-N 2 0 230.714 2.260 20 0 BEADRP CC[C@H]1C[N@H+](CCc2ccccc2)CC[C@@H]1[NH3+] ZINC000022130143 487478327 /nfs/dbraw/zinc/47/83/27/487478327.db2.gz JBWFBMMQKGBHTC-GJZGRUSLSA-N 2 0 232.371 2.288 20 0 BEADRP CC[C@H]1C[N@H+](CCCC(C)C)CC[C@@H]1[NH3+] ZINC000161559906 487503197 /nfs/dbraw/zinc/50/31/97/487503197.db2.gz JYGUWFSKABZEFL-STQMWFEESA-N 2 0 212.381 2.482 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)C1 ZINC000300242541 487505868 /nfs/dbraw/zinc/50/58/68/487505868.db2.gz NWRYZZCICDSAIN-MROQNXINSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)C1 ZINC000300242543 487505882 /nfs/dbraw/zinc/50/58/82/487505882.db2.gz NWRYZZCICDSAIN-XQHKEYJVSA-N 2 0 210.365 2.282 20 0 BEADRP C[N@H+](CCC[NH3+])Cc1ccccc1C1CC1 ZINC000227742546 487511374 /nfs/dbraw/zinc/51/13/74/487511374.db2.gz JDLDAOCYMKEXDQ-UHFFFAOYSA-N 2 0 218.344 2.345 20 0 BEADRP CCc1ccccc1C[N@H+](C)CCC[NH3+] ZINC000227745019 487510824 /nfs/dbraw/zinc/51/08/24/487510824.db2.gz HMUWLKXMIJKJHC-UHFFFAOYSA-N 2 0 206.333 2.030 20 0 BEADRP C(CC1CCC1)C[N@@H+]1CC[C@@H]2[NH2+]CC[C@H]2C1 ZINC000662274475 487522562 /nfs/dbraw/zinc/52/25/62/487522562.db2.gz UPXDSNJUUCTVHL-KBPBESRZSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@H](c1ccncc1)[N@H+](C)CC(C)(C)C[NH3+] ZINC000086637513 487523320 /nfs/dbraw/zinc/52/33/20/487523320.db2.gz CEXSMVLFFDEUHB-LLVKDONJSA-N 2 0 221.348 2.059 20 0 BEADRP C[N@H+](CCC[NH3+])Cc1ccc2ncccc2c1 ZINC000020247980 487534848 /nfs/dbraw/zinc/53/48/48/487534848.db2.gz DWHHIJBLYJUHHI-UHFFFAOYSA-N 2 0 229.327 2.015 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]Cc1scnc1C1CC1 ZINC000415029016 487834030 /nfs/dbraw/zinc/83/40/30/487834030.db2.gz ZTUJLWNPCRLRTE-SECBINFHSA-N 2 0 239.388 2.238 20 0 BEADRP CC(C)C[C@@H](C)[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000390083225 488134799 /nfs/dbraw/zinc/13/47/99/488134799.db2.gz SRYHHVVKUSYDOA-VXGBXAGGSA-N 2 0 210.365 2.153 20 0 BEADRP COc1ccc(CC[NH2+][C@H]2CCC[C@@H]([NH3+])C2)cc1 ZINC000093209613 488139470 /nfs/dbraw/zinc/13/94/70/488139470.db2.gz XSJJDFKHZZBQKC-KGLIPLIRSA-N 2 0 248.370 2.097 20 0 BEADRP COc1ccc(CC[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)cc1 ZINC000093209572 488139521 /nfs/dbraw/zinc/13/95/21/488139521.db2.gz XSJJDFKHZZBQKC-ZIAGYGMSSA-N 2 0 248.370 2.097 20 0 BEADRP C[C@@H](C[NH2+][C@@H](C)CCC[NH3+])C(C)(C)C ZINC000379505419 488140226 /nfs/dbraw/zinc/14/02/26/488140226.db2.gz OHSDEIMVTWBVGW-QWRGUYRKSA-N 2 0 200.370 2.386 20 0 BEADRP CCc1ccc(CC[NH2+][C@@H]2CCC[C@H]2[NH3+])cc1 ZINC000258874267 488140469 /nfs/dbraw/zinc/14/04/69/488140469.db2.gz GFPZIMBAGJFCLF-HUUCEWRRSA-N 2 0 232.371 2.261 20 0 BEADRP CO[C@H](C[NH2+][C@@H](C)CC[NH+](C)C)C1CCCC1 ZINC000668710283 488151821 /nfs/dbraw/zinc/15/18/21/488151821.db2.gz JEWNGOWVOYNYNQ-GXTWGEPZSA-N 2 0 242.407 2.121 20 0 BEADRP CO[C@H](C[NH2+][C@H](C)CC[NH+](C)C)C1CCCC1 ZINC000668710286 488151973 /nfs/dbraw/zinc/15/19/73/488151973.db2.gz JEWNGOWVOYNYNQ-TZMCWYRMSA-N 2 0 242.407 2.121 20 0 BEADRP Cc1ccccc1C[C@@H](C)[N@H+](C)CCC[NH3+] ZINC000435383466 488170837 /nfs/dbraw/zinc/17/08/37/488170837.db2.gz GXNDHYWERKRBHJ-CYBMUJFWSA-N 2 0 220.360 2.207 20 0 BEADRP Cc1ncc(C[N@@H+]2CCS[C@H](C)CC2)n1C ZINC000668061482 488196609 /nfs/dbraw/zinc/19/66/09/488196609.db2.gz JDRHKIKSQSLGAN-SNVBAGLBSA-N 2 0 239.388 2.056 20 0 BEADRP Cc1ccc(C[NH2+]CCCC[N@@H+](C)C2CC2)cn1 ZINC000453590782 488203462 /nfs/dbraw/zinc/20/34/62/488203462.db2.gz BGJPEHVMWLOSGO-UHFFFAOYSA-N 2 0 247.386 2.354 20 0 BEADRP CC1(C[NH+]2CCN(c3cc[nH+]cc3)CC2)CCC1 ZINC000683696182 488209013 /nfs/dbraw/zinc/20/90/13/488209013.db2.gz GCDPWPSQOFMUMX-UHFFFAOYSA-N 2 0 245.370 2.394 20 0 BEADRP Cc1ncc(CN(C)Cc2ccc(O)cc2)n1C ZINC000668168433 488213304 /nfs/dbraw/zinc/21/33/04/488213304.db2.gz XOSXRRMCKGPARV-UHFFFAOYSA-N 2 0 245.326 2.066 20 0 BEADRP CC(C)[C@H]([NH3+])CC[N@H+](C)CCC1CCC1 ZINC000398612560 488220548 /nfs/dbraw/zinc/22/05/48/488220548.db2.gz AUBGHZQWBKBMIS-CYBMUJFWSA-N 2 0 212.381 2.482 20 0 BEADRP C[N@H+](CCC1CCC1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000398626392 488220573 /nfs/dbraw/zinc/22/05/73/488220573.db2.gz IBGDOVCNMANXEL-PBWFPOADSA-N 2 0 222.376 2.391 20 0 BEADRP CC1(C)CC[C@H]([NH2+]CC2([NH3+])CCCC2)C1 ZINC000129559084 490151142 /nfs/dbraw/zinc/15/11/42/490151142.db2.gz BNAILAAWBGMZGM-NSHDSACASA-N 2 0 210.365 2.426 20 0 BEADRP C[N@H+](CCCC[NH2+]Cc1ccc(O)cc1)C1CC1 ZINC000651599756 490124655 /nfs/dbraw/zinc/12/46/55/490124655.db2.gz HURHCDHMZSCWEN-UHFFFAOYSA-N 2 0 248.370 2.356 20 0 BEADRP C[C@H](Cc1cccs1)[NH2+]CCC[NH+](C)C ZINC000122116288 490125570 /nfs/dbraw/zinc/12/55/70/490125570.db2.gz KQFCQAYXNFCITH-LLVKDONJSA-N 2 0 226.389 2.220 20 0 BEADRP c1ccc(CCCC[NH+]2C[C@H]3C[NH2+]C[C@@H]3C2)cc1 ZINC000122194246 490128772 /nfs/dbraw/zinc/12/87/72/490128772.db2.gz BUFPEFBIOZRFKX-HZPDHXFCSA-N 2 0 244.382 2.161 20 0 BEADRP COc1ccc(C[NH2+][C@H]2CCC[C@H]([NH3+])C2)c(C)c1 ZINC000577887119 490221049 /nfs/dbraw/zinc/22/10/49/490221049.db2.gz FIDLLDYWYHAFMA-KBPBESRZSA-N 2 0 248.370 2.363 20 0 BEADRP CSCC[C@H](C)[N@H+](C)CC[C@@H]1CC[NH2+]C1 ZINC000156878703 490254397 /nfs/dbraw/zinc/25/43/97/490254397.db2.gz PBTJEQDQHUXRTC-RYUDHWBXSA-N 2 0 230.421 2.059 20 0 BEADRP Cc1nccn1CC[NH2+][C@@H](C)Cc1cccs1 ZINC000071269753 490259893 /nfs/dbraw/zinc/25/98/93/490259893.db2.gz OCKKSXNVWJSWSW-NSHDSACASA-N 2 0 249.383 2.474 20 0 BEADRP C[C@H]1CCCCC[C@H]1[NH2+]CCC[NH+](C)C ZINC000125021837 490410670 /nfs/dbraw/zinc/41/06/70/490410670.db2.gz JVQJLNKFOZZONR-QWHCGFSZSA-N 2 0 212.381 2.497 20 0 BEADRP c1oc2ccccc2c1C[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC000131043951 490470964 /nfs/dbraw/zinc/47/09/64/490470964.db2.gz AYMKZOJLWSBREJ-TXEJJXNPSA-N 2 0 242.322 2.084 20 0 BEADRP C[C@]1(C[NH3+])CC[N@H+](C[C@@H]2CCC(F)(F)C2)C1 ZINC000300802347 490568608 /nfs/dbraw/zinc/56/86/08/490568608.db2.gz DCTPNDQNNGXZQK-GHMZBOCLSA-N 2 0 232.318 2.093 20 0 BEADRP CCc1ccc(C[NH2+]CCc2cncn2C)cc1 ZINC000401837209 490588013 /nfs/dbraw/zinc/58/80/13/490588013.db2.gz LTSDUEKWIQDRCU-UHFFFAOYSA-N 2 0 243.354 2.315 20 0 BEADRP C([C@@H]1C[C@H]2C[C@H]2C1)[N@@H+]1CCCC[C@@H]1[C@@H]1CC[NH2+]C1 ZINC000662275366 491085743 /nfs/dbraw/zinc/08/57/43/491085743.db2.gz BIORHJFHZDXEDQ-IBEHDNSVSA-N 2 0 248.414 2.497 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CCCS1)C1CC[NH+](C)CC1 ZINC000087667951 491091198 /nfs/dbraw/zinc/09/11/98/491091198.db2.gz WLVOMAXEKYGJFA-YPMHNXCESA-N 2 0 242.432 2.202 20 0 BEADRP Cc1ncccc1C[N@H+]1CCC[C@H](C)[C@H]1CC[NH3+] ZINC000404292489 491093591 /nfs/dbraw/zinc/09/35/91/491093591.db2.gz LVJHNICPMZWTLE-SWLSCSKDSA-N 2 0 247.386 2.339 20 0 BEADRP CC(C)(C[NH2+][C@H]1CCC[C@@H]1[NH3+])c1cccs1 ZINC000259086651 491101975 /nfs/dbraw/zinc/10/19/75/491101975.db2.gz RNHWPKGUEOARJT-QWRGUYRKSA-N 2 0 238.400 2.495 20 0 BEADRP CC[NH+](CC)C[C@@H]1CC[N@@H+]([C@@H](C)CCOC)C1 ZINC000088536715 491104879 /nfs/dbraw/zinc/10/48/79/491104879.db2.gz ZIIAFQBUEKTEAG-KBPBESRZSA-N 2 0 242.407 2.075 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+]CCCc1ccco1 ZINC000665282900 491107885 /nfs/dbraw/zinc/10/78/85/491107885.db2.gz DORVYRBLNKTLGN-JSGCOSHPSA-N 2 0 236.359 2.190 20 0 BEADRP CCC[N@H+](C[C@@H]1CC[C@@H](C)O1)C1CC[NH2+]CC1 ZINC000232018154 491123798 /nfs/dbraw/zinc/12/37/98/491123798.db2.gz XMZYAULPWGHSIR-OCCSQVGLSA-N 2 0 240.391 2.018 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]C(C2CC2)C2CC2)C1 ZINC000086402320 491123853 /nfs/dbraw/zinc/12/38/53/491123853.db2.gz HBOSQUMJIVJVSP-NWDGAFQWSA-N 2 0 208.349 2.035 20 0 BEADRP CC1=CCC[C@@H](C)[C@H]1C[N@H+](C)CC1CN(C)C1 ZINC000668538699 491127284 /nfs/dbraw/zinc/12/72/84/491127284.db2.gz AJAZHAXIQWLOSX-HIFRSBDPSA-N 2 0 236.403 2.472 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]C[C@@H](C)C2CC2)[C@@H](C)C1 ZINC000222858737 491134181 /nfs/dbraw/zinc/13/41/81/491134181.db2.gz BFKMJMZKCAWKPO-DYEKYZERSA-N 2 0 224.392 2.352 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H]2CCS[C@@H]2C)[C@H](C)C1 ZINC000309630424 491153240 /nfs/dbraw/zinc/15/32/40/491153240.db2.gz HPUFBJRJMFHBPT-FVCCEPFGSA-N 2 0 242.432 2.200 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CC=CCC1)[C@@H]1CCC[NH2+]1 ZINC000400386909 533880869 /nfs/dbraw/zinc/88/08/69/533880869.db2.gz MCRKSBSPNHELHB-XQQFMLRXSA-N 2 0 208.349 2.073 20 0 BEADRP CCC[C@H](C)C[N@@H+]1CCC[C@@H](C[NH2+]C)C1 ZINC000223496107 535610117 /nfs/dbraw/zinc/61/01/17/535610117.db2.gz QMZLCKLSOMTUCN-STQMWFEESA-N 2 0 212.381 2.354 20 0 BEADRP CCC[C@H](C)C[N@@H+]1CCC[C@@H]([C@H](C)[NH3+])C1 ZINC000251286609 535610189 /nfs/dbraw/zinc/61/01/89/535610189.db2.gz GXYFGUWHCPGMAY-RWMBFGLXSA-N 2 0 212.381 2.482 20 0 BEADRP C[C@@H]1C[C@H]1C[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000488358714 534022518 /nfs/dbraw/zinc/02/25/18/534022518.db2.gz XZNGOGZDKFIUBI-KFWWJZLASA-N 2 0 236.403 2.450 20 0 BEADRP CC[C@H](COC)[NH2+]CCC[N@@H+]1CCCC[C@@H]1C ZINC000079706463 536120564 /nfs/dbraw/zinc/12/05/64/536120564.db2.gz LUMXGLFRGMPURO-UONOGXRCSA-N 2 0 242.407 2.266 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@@H]2CC[C@@H]2C2CC2)CC1 ZINC000309647853 582903735 /nfs/dbraw/zinc/90/37/35/582903735.db2.gz MWIVXDWDOWSNKM-ZIAGYGMSSA-N 2 0 222.376 2.106 20 0 BEADRP CC[N@H+](C)C[C@@H]1CC[NH+](C[C@@H]2CCSC2)C1 ZINC000494960061 527817923 /nfs/dbraw/zinc/81/79/23/527817923.db2.gz XPQLSXMEVCJQLA-STQMWFEESA-N 2 0 242.432 2.013 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH+](C)C[C@@H]2C[C@@H]2C)C[C@@H]1C ZINC000488302150 527832389 /nfs/dbraw/zinc/83/23/89/527832389.db2.gz SEQJWIANPMUGFG-XUXIUFHCSA-N 2 0 224.392 2.447 20 0 BEADRP CCC(C)(C)OCC[NH2+][C@@H]1CC[N@H+](C)C[C@@H]1C ZINC000308715883 528593012 /nfs/dbraw/zinc/59/30/12/528593012.db2.gz BDQPBCKLVUCEBI-QWHCGFSZSA-N 2 0 242.407 2.121 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000401163574 529242473 /nfs/dbraw/zinc/24/24/73/529242473.db2.gz PMVFOOWVJFEGOH-PDWCTOEPSA-N 2 0 224.392 2.399 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)CCCOC)C1 ZINC000178511372 534945969 /nfs/dbraw/zinc/94/59/69/534945969.db2.gz UDVZLZPBVDDEOP-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)(C)[C@@H]1CCC[N@@H+]1C[C@@]1(C)CC[NH2+]C1 ZINC000262110975 535075238 /nfs/dbraw/zinc/07/52/38/535075238.db2.gz WKHVMTRERXNDMK-JSGCOSHPSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]C[C@H]2CCSC2)CC1 ZINC000224306035 535161397 /nfs/dbraw/zinc/16/13/97/535161397.db2.gz XNCACQCZDGVGGP-GFCCVEGCSA-N 2 0 242.432 2.202 20 0 BEADRP CC(C)[C@@H](C)[N@H+](C[C@H]1CCC[NH2+]C1)C1CC1 ZINC000261532703 535162386 /nfs/dbraw/zinc/16/23/86/535162386.db2.gz CREYAENNOCTFLF-OLZOCXBDSA-N 2 0 224.392 2.495 20 0 BEADRP CC(C)[C@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH2+]C1 ZINC000257789943 535176241 /nfs/dbraw/zinc/17/62/41/535176241.db2.gz XGYZEFMDIWROOC-ZIAGYGMSSA-N 2 0 224.392 2.497 20 0 BEADRP CCC1(C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)CCOCC1 ZINC000261560188 535296074 /nfs/dbraw/zinc/29/60/74/535296074.db2.gz UJEIPOZHPSIFEM-QWHCGFSZSA-N 2 0 240.391 2.053 20 0 BEADRP CC(C)[C@@](C)(C[NH3+])[NH2+]CCOc1ccccc1 ZINC000261556493 535307836 /nfs/dbraw/zinc/30/78/36/535307836.db2.gz QVGKOKUJVJTMRN-CQSZACIVSA-N 2 0 236.359 2.028 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+]CC1(C)CC[NH2+]CC1 ZINC000261533567 535323387 /nfs/dbraw/zinc/32/33/87/535323387.db2.gz KXYGIGSNMFOGLW-NSHDSACASA-N 2 0 210.365 2.154 20 0 BEADRP CC[C@@H](C)C[N@H+](CC)CC[C@@H]1CC[NH2+]C1 ZINC000086440262 535510040 /nfs/dbraw/zinc/51/00/40/535510040.db2.gz OALCMGZWMITPMO-OLZOCXBDSA-N 2 0 212.381 2.354 20 0 BEADRP CC[NH+](CC)C[C@@H]1CC[N@H+](CC[C@@H](C)F)C1 ZINC000352003396 535585263 /nfs/dbraw/zinc/58/52/63/535585263.db2.gz LUVWPEWJXQQIMA-OLZOCXBDSA-N 2 0 230.371 2.398 20 0 BEADRP CCC[C@H](C)[N@H+](C)CC[C@H]1CCC[NH2+]C1 ZINC000251347843 535629677 /nfs/dbraw/zinc/62/96/77/535629677.db2.gz PYEUMORPPLPSMQ-QWHCGFSZSA-N 2 0 212.381 2.497 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]C2CC(C)(F)C2)[C@H](C)C1 ZINC000335373322 535768980 /nfs/dbraw/zinc/76/89/80/535768980.db2.gz HXQCGKVKYSFLMR-IGJPJIBNSA-N 2 0 228.355 2.197 20 0 BEADRP CC[C@@H]([NH2+]CC1(C)CC[NH+](C)CC1)C1CC1 ZINC000227497993 535803004 /nfs/dbraw/zinc/80/30/04/535803004.db2.gz XGVLPTAKVYCZTO-CYBMUJFWSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH+](C)C[C@@H]1CC[N@H+](CC23CCC(CC2)C3)C1 ZINC000347775878 535944974 /nfs/dbraw/zinc/94/49/74/535944974.db2.gz GTPXDZYAIAICFO-SLTAFYQDSA-N 2 0 236.403 2.450 20 0 BEADRP CC[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)C1CC1 ZINC000130237421 535946934 /nfs/dbraw/zinc/94/69/34/535946934.db2.gz SKLBFACROWMELS-MJBXVCDLSA-N 2 0 222.376 2.391 20 0 BEADRP C[NH+](C)[C@H]1CCC[N@H+](CC2CCC2)CC1 ZINC000336120953 536137076 /nfs/dbraw/zinc/13/70/76/536137076.db2.gz GJAFYROZJUEDIZ-ZDUSSCGKSA-N 2 0 210.365 2.203 20 0 BEADRP CCc1ccc(C[N@@H+]2CC[C@@H]3C[NH2+]C[C@H]3C2)cc1 ZINC000261561595 536178621 /nfs/dbraw/zinc/17/86/21/536178621.db2.gz FZSFWDYBRZCXMJ-CVEARBPZSA-N 2 0 244.382 2.290 20 0 BEADRP COCCC[C@H](C)[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000180405094 536666087 /nfs/dbraw/zinc/66/60/87/536666087.db2.gz NNCNLMONMDTNKP-ZDUSSCGKSA-N 2 0 242.407 2.264 20 0 BEADRP COC1CCC([NH2+][C@@H]2CCCCC[C@@H]2[NH3+])CC1 ZINC000335595776 536740033 /nfs/dbraw/zinc/74/00/33/536740033.db2.gz PBMPTNPPDIEIIE-CLRIEMFWSA-N 2 0 240.391 2.194 20 0 BEADRP COCC[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000152094729 536893483 /nfs/dbraw/zinc/89/34/83/536893483.db2.gz NGWSLTMXKAAYNT-UHFFFAOYSA-N 2 0 240.391 2.020 20 0 BEADRP CC[C@@H]1C[C@H](C[NH2+]CC[C@@H]([NH3+])C(C)C)CCO1 ZINC000853247180 588728848 /nfs/dbraw/zinc/72/88/48/588728848.db2.gz FUHIXARPIOEQHE-MGPQQGTHSA-N 2 0 242.407 2.155 20 0 BEADRP C[C@@H]([NH2+]CCC[NH3+])c1ccc2c(c1)CCCO2 ZINC000853249575 588729132 /nfs/dbraw/zinc/72/91/32/588729132.db2.gz RKPKQWNSJGNDJI-LLVKDONJSA-N 2 0 234.343 2.011 20 0 BEADRP CN1CC[C@@H]([NH2+]Cc2ccnc3ccccc23)C1 ZINC000111728709 588769503 /nfs/dbraw/zinc/76/95/03/588769503.db2.gz VDFOENSJPOCRFX-CYBMUJFWSA-N 2 0 241.338 2.029 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H]2CC[C@H]2C2CC2)CCCC1 ZINC000854224389 588780623 /nfs/dbraw/zinc/78/06/23/588780623.db2.gz VYRQZVXDYQGTIN-NWDGAFQWSA-N 2 0 208.349 2.036 20 0 BEADRP [NH3+]CCCCCC[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000843344089 582533099 /nfs/dbraw/zinc/53/30/99/582533099.db2.gz QAEBFSLSWHGMJC-HUUCEWRRSA-N 3 0 247.386 2.240 20 0 BEADRP CC[C@H]1C[C@@H](C)C[N@@H+]1CC1CC[NH+](C)CC1 ZINC000892068940 582784224 /nfs/dbraw/zinc/78/42/24/582784224.db2.gz WPFSVMAEUONXSZ-OCCSQVGLSA-N 2 0 224.392 2.449 20 0 BEADRP CCCSC[C@H](C)[NH2+]CCC[NH+](C)C ZINC000892429052 582885188 /nfs/dbraw/zinc/88/51/88/582885188.db2.gz BLNJZQXTFLPSKX-NSHDSACASA-N 2 0 218.410 2.059 20 0 BEADRP CCCSC[C@H](C)[NH2+]CC1CC[NH+](C)CC1 ZINC000892945243 583014189 /nfs/dbraw/zinc/01/41/89/583014189.db2.gz ZMMBLDIVBUZJPS-LBPRGKRZSA-N 2 0 244.448 2.450 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CC[C@@H]1CC1(Cl)Cl ZINC000857253851 583136672 /nfs/dbraw/zinc/13/66/72/583136672.db2.gz TYHFFQVUQRVXFD-XHNCKOQMSA-N 2 0 239.190 2.286 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CC(C1CC1)C1CC1 ZINC000308995973 583162050 /nfs/dbraw/zinc/16/20/50/583162050.db2.gz JXBRNKXJIUPTMJ-SNVBAGLBSA-N 2 0 210.365 2.140 20 0 BEADRP CC[N@H+](CCC1CC1)CC1CC[NH+](C)CC1 ZINC000893589812 583168054 /nfs/dbraw/zinc/16/80/54/583168054.db2.gz KWRVEEGMKKZZIH-UHFFFAOYSA-N 2 0 224.392 2.450 20 0 BEADRP CC[C@H]1[C@@H](C)CC[N@@H+]1CC1CC[NH+](C)CC1 ZINC000893674300 583193162 /nfs/dbraw/zinc/19/31/62/583193162.db2.gz YUNFREATYGOHLA-JSGCOSHPSA-N 2 0 224.392 2.449 20 0 BEADRP CC[C@H]1[C@H](C)CC[N@@H+]1CC1CC[NH+](C)CC1 ZINC000893674301 583193516 /nfs/dbraw/zinc/19/35/16/583193516.db2.gz YUNFREATYGOHLA-OCCSQVGLSA-N 2 0 224.392 2.449 20 0 BEADRP C[C@@H]1CCCC[N@H+](CC2CC[NH+](C)CC2)C1 ZINC000893678567 583197696 /nfs/dbraw/zinc/19/76/96/583197696.db2.gz LEXIECRQXCPKCK-CYBMUJFWSA-N 2 0 224.392 2.450 20 0 BEADRP Cc1coc(C[N@H+]2CC[C@H](c3nccn3C)C2)c1 ZINC000894779350 583519504 /nfs/dbraw/zinc/51/95/04/583519504.db2.gz GRMPNKCNAVIUHN-LBPRGKRZSA-N 2 0 245.326 2.311 20 0 BEADRP CN(C)C1(C[NH2+]C[C@@H]2CCc3ccccc32)CC1 ZINC000894954462 583559870 /nfs/dbraw/zinc/55/98/70/583559870.db2.gz LDGAPSMSSJMJLH-AWEZNQCLSA-N 2 0 244.382 2.400 20 0 BEADRP CCCC[C@@H](COC)[NH2+]CC[C@H](C)[NH+](C)C ZINC000895293042 583639006 /nfs/dbraw/zinc/63/90/06/583639006.db2.gz FUDRPXMKKULNSM-STQMWFEESA-N 2 0 230.396 2.121 20 0 BEADRP COCC1CCC([NH2+]CC[C@H](C)[NH+](C)C)CC1 ZINC000895293766 583639391 /nfs/dbraw/zinc/63/93/91/583639391.db2.gz PZXHTBKGQUVLJG-HSBZDZAISA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H](CC[NH2+]CC1CCSCC1)[NH+](C)C ZINC000895293149 583639795 /nfs/dbraw/zinc/63/97/95/583639795.db2.gz VFZDIJIHTVEUAL-NSHDSACASA-N 2 0 230.421 2.059 20 0 BEADRP CC[C@@H]1C[C@@H](C[NH2+]CC[C@@H](C)[NH+](C)C)CCO1 ZINC000895296936 583641494 /nfs/dbraw/zinc/64/14/94/583641494.db2.gz RDXPYHAUHHXTMB-HZSPNIEDSA-N 2 0 242.407 2.121 20 0 BEADRP C[NH+]1CCC(C[NH2+]CC[C@]2(C)CC2(F)F)CC1 ZINC000895379454 583661960 /nfs/dbraw/zinc/66/19/60/583661960.db2.gz BNPSLTAVAWRRID-GFCCVEGCSA-N 2 0 246.345 2.353 20 0 BEADRP C[C@@H](CC[NH2+][C@@H]1C[C@H]2CCC[C@H]2C1)[NH+](C)C ZINC000895429604 583669019 /nfs/dbraw/zinc/66/90/19/583669019.db2.gz QQIMNQLKWYURFH-FQUUOJAGSA-N 2 0 224.392 2.495 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2CCCC(F)(F)CC2)CC1 ZINC000895572701 583692205 /nfs/dbraw/zinc/69/22/05/583692205.db2.gz CLAGPDRRRJECFB-UHFFFAOYSA-N 2 0 246.345 2.449 20 0 BEADRP C[NH+]1CCC(C[NH2+]C[C@]2(C)C[C@H]3C[C@H]3C2)CC1 ZINC000895629863 583698385 /nfs/dbraw/zinc/69/83/85/583698385.db2.gz ASUNJRZGBGFJAI-QDMKHBRRSA-N 2 0 236.403 2.354 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@@H]2CCCC[C@@H]2F)CC1 ZINC000895745668 583715984 /nfs/dbraw/zinc/71/59/84/583715984.db2.gz GVPFDCCOACYDMQ-QWHCGFSZSA-N 2 0 228.355 2.199 20 0 BEADRP CC[NH+]1CCC([NH2+]CC(C)(C)C2CC2)CC1 ZINC000897439430 583984194 /nfs/dbraw/zinc/98/41/94/583984194.db2.gz WOHKHTLOZIGNSO-UHFFFAOYSA-N 2 0 224.392 2.497 20 0 BEADRP C1[C@H]2CCC[C@H]2[C@H]1[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000897955450 584065476 /nfs/dbraw/zinc/06/54/76/584065476.db2.gz UVAGLQKMQOTMSJ-RYPNDVFKSA-N 2 0 234.387 2.391 20 0 BEADRP CSC1(C[N@H+](C)CC(C)(C)C[NH+](C)C)CC1 ZINC000898308119 584109759 /nfs/dbraw/zinc/10/97/59/584109759.db2.gz OWBMKJBSDHFYBP-UHFFFAOYSA-N 2 0 244.448 2.402 20 0 BEADRP CSC[C@H](C)[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000902331945 584562933 /nfs/dbraw/zinc/56/29/33/584562933.db2.gz WZTVKGSMGXHNFH-QWRGUYRKSA-N 2 0 230.421 2.106 20 0 BEADRP COCCCCC[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000902333202 584563726 /nfs/dbraw/zinc/56/37/26/584563726.db2.gz HZGGSQIIWUPHPU-CYBMUJFWSA-N 2 0 242.407 2.171 20 0 BEADRP Cc1cncc(C[NH2+][C@@H]2CC[NH2+]CC(C)(C)C2)c1 ZINC000902371241 584566116 /nfs/dbraw/zinc/56/61/16/584566116.db2.gz OBMYWDHIHXSFBO-CQSZACIVSA-N 2 0 247.386 2.258 20 0 BEADRP CS[C@H](C)C[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000902360245 584571272 /nfs/dbraw/zinc/57/12/72/584571272.db2.gz HHHRRCKDFVMDAD-MNOVXSKESA-N 2 0 230.421 2.106 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]([NH2+][C@@H]2CC=CCC2)C1 ZINC000902362642 584572500 /nfs/dbraw/zinc/57/25/00/584572500.db2.gz RCPVJXWOVBBXHF-CHWSQXEVSA-N 2 0 222.376 2.463 20 0 BEADRP [NH3+]C1(C[NH2+]C(C2CCC2)C2CCC2)CC1 ZINC000902407060 584574244 /nfs/dbraw/zinc/57/42/44/584574244.db2.gz OTXPJFHEWPWCHH-UHFFFAOYSA-N 2 0 208.349 2.036 20 0 BEADRP CC[C@@H]1CC[C@@H](C)C[C@@H]1[NH2+]CC1([NH3+])CC1 ZINC000902406546 584574406 /nfs/dbraw/zinc/57/44/06/584574406.db2.gz NSLSSOIEAALIOF-UTUOFQBUSA-N 2 0 210.365 2.282 20 0 BEADRP COCC[C@H](C)C[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000902390095 584581167 /nfs/dbraw/zinc/58/11/67/584581167.db2.gz GXNLBQGBWJVFQW-QWHCGFSZSA-N 2 0 242.407 2.027 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@H]2CC[NH2+]CC(C)(C)C2)CS1 ZINC000902391305 584581722 /nfs/dbraw/zinc/58/17/22/584581722.db2.gz VBJCSHVWDRJPSI-GRYCIOLGSA-N 2 0 242.432 2.248 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]([NH2+]CC2CC=CC2)C1 ZINC000902394329 584584368 /nfs/dbraw/zinc/58/43/68/584584368.db2.gz AWABNEZMWNHXKN-ZDUSSCGKSA-N 2 0 222.376 2.320 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H]2CC[C@@H]3CCCC[C@@H]3C2)CC1 ZINC000902415551 584589962 /nfs/dbraw/zinc/58/99/62/584589962.db2.gz IKKJRYSHNZHFME-YNEHKIRRSA-N 2 0 222.376 2.426 20 0 BEADRP CC(C)(C[NH2+][C@@H]1CCC[C@@H]1C[NH3+])C1CC1 ZINC000902432806 584595594 /nfs/dbraw/zinc/59/55/94/584595594.db2.gz PZGBYRIPPIXPBP-ZYHUDNBSSA-N 2 0 210.365 2.140 20 0 BEADRP CC(C)(C[NH2+][C@H]1CCC[C@@H]([NH3+])C1)C1CC1 ZINC000902434562 584595865 /nfs/dbraw/zinc/59/58/65/584595865.db2.gz XMYMKLHKIJANFU-NEPJUHHUSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)(C[NH2+][C@@H]1CCC[C@H]([NH3+])C1)C1CC1 ZINC000902434563 584596221 /nfs/dbraw/zinc/59/62/21/584596221.db2.gz XMYMKLHKIJANFU-NWDGAFQWSA-N 2 0 210.365 2.282 20 0 BEADRP CC1(C)CC[C@H]([NH2+][C@H]2C[NH2+]CC2(C)C)C1 ZINC000902443928 584598295 /nfs/dbraw/zinc/59/82/95/584598295.db2.gz MOMUUDFVONAMHK-QWRGUYRKSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H](CCC1CC1)[NH2+][C@@H]1C[NH2+]CC1(C)C ZINC000902444871 584598809 /nfs/dbraw/zinc/59/88/09/584598809.db2.gz OVHNVZLBAXJWAG-ZYHUDNBSSA-N 2 0 210.365 2.153 20 0 BEADRP COc1ccc([C@@H]([NH2+]CC2([NH3+])CC2)C(C)C)cc1 ZINC000902414138 584599520 /nfs/dbraw/zinc/59/95/20/584599520.db2.gz TYZKVMHYNRWNHH-AWEZNQCLSA-N 2 0 248.370 2.473 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+]CC1([NH3+])CC1)CCC2 ZINC000902413381 584599569 /nfs/dbraw/zinc/59/95/69/584599569.db2.gz KZXDSAWQHSIOJN-CQSZACIVSA-N 2 0 230.355 2.453 20 0 BEADRP [NH3+]C1(C[NH2+][C@H]2CCC[C@H]2c2ccccc2)CC1 ZINC000902413749 584599868 /nfs/dbraw/zinc/59/98/68/584599868.db2.gz OFYFNUJXEWAACK-KBPBESRZSA-N 2 0 230.355 2.404 20 0 BEADRP CCCC[C@H]1CCC[C@H]1[NH2+]CC1(N)CC1 ZINC000902414731 584600740 /nfs/dbraw/zinc/60/07/40/584600740.db2.gz ZWOITHJQOWGZHB-NWDGAFQWSA-N 2 0 210.365 2.426 20 0 BEADRP CCCC[C@H](CC)[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902472677 584600989 /nfs/dbraw/zinc/60/09/89/584600989.db2.gz FELSKFYJAMIZST-QNWHQSFQSA-N 2 0 210.365 2.438 20 0 BEADRP C1CC1[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902473828 584601769 /nfs/dbraw/zinc/60/17/69/584601769.db2.gz AERUVHRGIZAXCH-CAEXGNQWSA-N 2 0 234.387 2.438 20 0 BEADRP C1CC1[C@H]1CCCC[C@@H]1[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902473830 584602010 /nfs/dbraw/zinc/60/20/10/584602010.db2.gz AERUVHRGIZAXCH-NIFZNCRKSA-N 2 0 234.387 2.438 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902476171 584602970 /nfs/dbraw/zinc/60/29/70/584602970.db2.gz MVPABWCNFDHBDF-NAWOPXAZSA-N 2 0 208.349 2.048 20 0 BEADRP CC(C)CC[C@@H](C)[NH2+][C@@H]1C[NH2+]CC1(C)C ZINC000902447321 584604804 /nfs/dbraw/zinc/60/48/04/584604804.db2.gz SHEATWHJHNQJGA-VXGBXAGGSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+][C@@H]1C[NH2+]CC1(C)C ZINC000902448173 584604903 /nfs/dbraw/zinc/60/49/03/584604903.db2.gz DGUBIMPOVBTSPN-RKDXNWHRSA-N 2 0 238.297 2.305 20 0 BEADRP C[C@H]([NH2+][C@H]1CCSC(C)(C)C1)[C@@H]1CCC[NH2+]1 ZINC000902450049 584606361 /nfs/dbraw/zinc/60/63/61/584606361.db2.gz CBWZHSFVSQGIST-SRVKXCTJSA-N 2 0 242.432 2.391 20 0 BEADRP CC1(C)C[C@H]([NH2+][C@H]2CCC[C@H]2C[NH3+])CCS1 ZINC000902451177 584606631 /nfs/dbraw/zinc/60/66/31/584606631.db2.gz GHFLTWQNMPIBIO-TUAOUCFPSA-N 2 0 242.432 2.378 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@@H]1CCCC2(CC2)C1 ZINC000902450394 584606872 /nfs/dbraw/zinc/60/68/72/584606872.db2.gz DBYLETOSIKYIDH-QJPTWQEYSA-N 2 0 210.365 2.425 20 0 BEADRP C1[C@H]2CCC[C@H]2[C@H]1[NH2+][C@H]1CC[NH2+]C12CCCC2 ZINC000902453070 584607907 /nfs/dbraw/zinc/60/79/07/584607907.db2.gz BZDAEOXBCSXJDQ-MQYQWHSLSA-N 2 0 234.387 2.439 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+][C@@H]1CCSC(C)(C)C1 ZINC000902453249 584608158 /nfs/dbraw/zinc/60/81/58/584608158.db2.gz OGZDIPJFTIDBFL-GHMZBOCLSA-N 2 0 242.432 2.391 20 0 BEADRP C1[C@H]2CCC[C@@H]2[C@@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000902453954 584608772 /nfs/dbraw/zinc/60/87/72/584608772.db2.gz GHVFPSULEBPTOU-YBMZZXOZSA-N 2 0 220.360 2.048 20 0 BEADRP C[C@@H](CCC(F)(F)F)[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902465098 584612852 /nfs/dbraw/zinc/61/28/52/584612852.db2.gz DCOLUERKJUKOKH-AXTSPUMRSA-N 2 0 236.281 2.200 20 0 BEADRP C[C@]12C[C@H]1CCC[C@@H]2[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902464862 584613035 /nfs/dbraw/zinc/61/30/35/584613035.db2.gz DZBVBHPPWSCAGK-PRFQISJJSA-N 2 0 220.360 2.048 20 0 BEADRP CC1(C)CC[C@H]([NH2+][C@@H]2C[C@H]3CC[C@@H]2[NH2+]3)C1 ZINC000902466272 584614112 /nfs/dbraw/zinc/61/41/12/584614112.db2.gz MARUIGRLMZNOEO-NOOOWODRSA-N 2 0 208.349 2.048 20 0 BEADRP FC(F)C1CCC([NH2+][C@@H]2C[C@@H]3CC[C@H]2[NH2+]3)CC1 ZINC000902469007 584615276 /nfs/dbraw/zinc/61/52/76/584615276.db2.gz NLNDXWIOCBVIPT-JEDMMJBGSA-N 2 0 244.329 2.293 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@H]([NH2+][C@@H]2C[C@H]3CC[C@@H]2[NH2+]3)C1 ZINC000902469163 584615527 /nfs/dbraw/zinc/61/55/27/584615527.db2.gz YLNXSWLIRCAFNO-QQOHENMQSA-N 2 0 222.376 2.294 20 0 BEADRP C1CC2(C1)CCC[C@H]2[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902469930 584616172 /nfs/dbraw/zinc/61/61/72/584616172.db2.gz SWNKBHHGQFPTLM-UMSGYPCISA-N 2 0 220.360 2.192 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@@H]2C[C@@H]3CC[C@H]2[NH2+]3)[C@H](C)C1 ZINC000902470488 584616467 /nfs/dbraw/zinc/61/64/67/584616467.db2.gz YOXYJNCGPKQTEZ-UYYXNEDZSA-N 2 0 222.376 2.294 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+][C@@H]2C[C@@H]3CC[C@H]2[NH2+]3)C[C@@H]1C ZINC000902470449 584616617 /nfs/dbraw/zinc/61/66/17/584616617.db2.gz XTIBGRPLYHGERE-QQOHENMQSA-N 2 0 222.376 2.294 20 0 BEADRP C1CC1[C@@H]1CCC[C@@H]([NH2+][C@@H]2C[C@@H]3CC[C@H]2[NH2+]3)C1 ZINC000902471774 584617267 /nfs/dbraw/zinc/61/72/67/584617267.db2.gz SKGNNNLFNCFHHC-UXXRCYHCSA-N 2 0 234.387 2.438 20 0 BEADRP CC[C@@H]1CCC[C@@H]([NH2+][C@H]2C[C@H](C[NH3+])C2)C1 ZINC000902491804 584618022 /nfs/dbraw/zinc/61/80/22/584618022.db2.gz ZXVIRQSKWSXMJM-FDYHWXHSSA-N 2 0 210.365 2.282 20 0 BEADRP COc1cccc([C@H](C)[NH2+][C@H]2C[C@H](C[NH3+])C2)c1 ZINC000902490983 584618075 /nfs/dbraw/zinc/61/80/75/584618075.db2.gz ZZJFBKCHRFAWNA-GVXVVHGQSA-N 2 0 234.343 2.083 20 0 BEADRP CC1(C)CCCC[C@@H]1[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902491398 584618431 /nfs/dbraw/zinc/61/84/31/584618431.db2.gz WVIVAKGAHQUNKR-SRVKXCTJSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1CC=CC[C@H]1[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000902503860 584621351 /nfs/dbraw/zinc/62/13/51/584621351.db2.gz LIYUIYKSNGUNCF-UXXRCYHCSA-N 2 0 234.387 2.319 20 0 BEADRP C[C@@H]1CC=CC[C@H]1[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000902505796 584621596 /nfs/dbraw/zinc/62/15/96/584621596.db2.gz UCWOQSYDESEANA-YVECIDJPSA-N 2 0 208.349 2.201 20 0 BEADRP CC(C)[NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000902503920 584621659 /nfs/dbraw/zinc/62/16/59/584621659.db2.gz TXIWVTMQNYHZKH-ZFWWWQNUSA-N 2 0 246.354 2.240 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC=CC[C@H]1C)[C@@H]1CCC[NH2+]1 ZINC000902506167 584622299 /nfs/dbraw/zinc/62/22/99/584622299.db2.gz XFMDFHJWTGEGNC-XQHKEYJVSA-N 2 0 208.349 2.071 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@H]2C[C@H](C[NH3+])C2)C[C@@H]1C ZINC000902484184 584624548 /nfs/dbraw/zinc/62/45/48/584624548.db2.gz FFXANTVCNRIMKD-RXGFPQBGSA-N 2 0 210.365 2.138 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+][C@H]2CCCC[C@H]2C2CC2)C1 ZINC000902484113 584624761 /nfs/dbraw/zinc/62/47/61/584624761.db2.gz CVNPFESLQNBRSL-PYJNHQTQSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@@H]1CC(C)(C)C[C@@H]1[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902484138 584624870 /nfs/dbraw/zinc/62/48/70/584624870.db2.gz DLEQPJVZSWNHNR-KKOKHZNYSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1ccc(Cl)cn1 ZINC000902485201 584624954 /nfs/dbraw/zinc/62/49/54/584624954.db2.gz JAHXYGRHWDDNJC-QXEWZRGKSA-N 2 0 239.750 2.123 20 0 BEADRP CO[C@@H](c1ccccc1)[C@@H](C)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902485763 584625194 /nfs/dbraw/zinc/62/51/94/584625194.db2.gz NWBUXTLBFLAVJP-QHSBEEBCSA-N 2 0 248.370 2.090 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902485437 584625393 /nfs/dbraw/zinc/62/53/93/584625393.db2.gz KOIOPACZXASYPB-IWSPIJDZSA-N 2 0 224.270 2.044 20 0 BEADRP CO[C@@H](c1ccccc1)[C@H](C)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902485761 584625451 /nfs/dbraw/zinc/62/54/51/584625451.db2.gz NWBUXTLBFLAVJP-NZBPQXDJSA-N 2 0 248.370 2.090 20 0 BEADRP C[C@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)C1C(C)(C)C1(C)C ZINC000902485589 584625453 /nfs/dbraw/zinc/62/54/53/584625453.db2.gz BBERGTWBADFGAP-DCAQKATOSA-N 2 0 224.392 2.384 20 0 BEADRP C[C@H](CCCC(F)(F)F)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902485727 584625483 /nfs/dbraw/zinc/62/54/83/584625483.db2.gz NDCXXLJFGPFFIG-OPRDCNLKSA-N 2 0 238.297 2.434 20 0 BEADRP CCOc1ccc([C@H](C)[NH2+][C@H]2C[C@H](C[NH3+])C2)cc1 ZINC000902486713 584625972 /nfs/dbraw/zinc/62/59/72/584625972.db2.gz BEPMVEQFLYGIGI-OBJOEFQTSA-N 2 0 248.370 2.473 20 0 BEADRP CC[C@H](Cc1ccccc1)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902486873 584626036 /nfs/dbraw/zinc/62/60/36/584626036.db2.gz DLUGYZAGKZHTPV-RBSFLKMASA-N 2 0 232.371 2.335 20 0 BEADRP CC[C@@H]1CCCC[C@@H]1[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902487337 584626127 /nfs/dbraw/zinc/62/61/27/584626127.db2.gz SZMNLHCJUNHPLH-LPWJVIDDSA-N 2 0 210.365 2.282 20 0 BEADRP CCOc1ccc([C@@H](C)[NH2+][C@H]2C[C@H](C[NH3+])C2)cc1 ZINC000902486716 584626152 /nfs/dbraw/zinc/62/61/52/584626152.db2.gz BEPMVEQFLYGIGI-YRGRVCCFSA-N 2 0 248.370 2.473 20 0 BEADRP COc1ccc2c(c1)[C@@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)CC2 ZINC000902487483 584626423 /nfs/dbraw/zinc/62/64/23/584626423.db2.gz HIMARUWFVLKSQT-WBIUFABUSA-N 2 0 246.354 2.009 20 0 BEADRP COc1ccc([C@H](C)[NH2+][C@H]2C[C@H](C[NH3+])C2)c(C)c1 ZINC000902487691 584626470 /nfs/dbraw/zinc/62/64/70/584626470.db2.gz LXHLAECRUBBWTM-AVGNSLFASA-N 2 0 248.370 2.392 20 0 BEADRP CSCC1CCC([NH2+][C@H]2C[C@H](C[NH3+])C2)CC1 ZINC000902488261 584626848 /nfs/dbraw/zinc/62/68/48/584626848.db2.gz XMWWIVIEVHKHFJ-FLWUZPLOSA-N 2 0 242.432 2.235 20 0 BEADRP C[C@@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1ccc(F)c(F)c1 ZINC000902489460 584627626 /nfs/dbraw/zinc/62/76/26/584627626.db2.gz RPXAEXVWADLBFY-FXPVBKGRSA-N 2 0 240.297 2.353 20 0 BEADRP Cc1ncccc1CC[NH2+][C@H]1CCCC[C@H]1C[NH3+] ZINC000902514647 584629701 /nfs/dbraw/zinc/62/97/01/584629701.db2.gz TWCHXZDUFPHWJB-GJZGRUSLSA-N 2 0 247.386 2.040 20 0 BEADRP CC1(C)C[C@H]([NH3+])C[C@@H]([NH2+]C/C=C\Cl)C1 ZINC000902517468 584630084 /nfs/dbraw/zinc/63/00/84/584630084.db2.gz HZJWOXNOWALPMO-HWKXXFMVSA-N 2 0 216.756 2.235 20 0 BEADRP Cl/C=C/C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000902516017 584630181 /nfs/dbraw/zinc/63/01/81/584630181.db2.gz BROZXZFZGONTGT-WBGAJPHISA-N 2 0 228.767 2.249 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+]C1(C)C(C)(C)C1(C)C ZINC000902521338 584631220 /nfs/dbraw/zinc/63/12/20/584631220.db2.gz RIRIXTLJQRNJDI-LLVKDONJSA-N 2 0 242.407 2.155 20 0 BEADRP C[NH+](C)CCCC[NH2+]C1C[C@@H]2CCC[C@H]2C1 ZINC000902780181 584669552 /nfs/dbraw/zinc/66/95/52/584669552.db2.gz BQEYHILVCQEIGS-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP C[NH+]1CCC(C[NH2+]C2C[C@@H]3CCC[C@H]3C2)CC1 ZINC000902792510 584673491 /nfs/dbraw/zinc/67/34/91/584673491.db2.gz AULMJVHNIAZNTI-KBPBESRZSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H](C[NH2+][C@@H]1C[C@H]2CCC[C@H]2C1)C[NH+](C)C ZINC000902999215 584714795 /nfs/dbraw/zinc/71/47/95/584714795.db2.gz MRAKNVWDEAUTNQ-YIYPIFLZSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1C[C@H]1[C@@H]1C[C@H]1[NH2+][C@@H]1CC[N@H+](C)[C@@H]2CCC[C@@H]21 ZINC000903255682 584739786 /nfs/dbraw/zinc/73/97/86/584739786.db2.gz ZEXTZWBFZORWJL-HQHBRHBDSA-N 2 0 248.414 2.493 20 0 BEADRP C[C@@H]1C[C@H]1[C@@H]1C[C@H]1[NH2+][C@@H]1CC[N@H+](C)[C@H]2CCC[C@H]21 ZINC000903255684 584739893 /nfs/dbraw/zinc/73/98/93/584739893.db2.gz ZEXTZWBFZORWJL-ORKIIUGYSA-N 2 0 248.414 2.493 20 0 BEADRP Cc1cc([C@H]2CCC[N@@H+]2C[C@@H]2CC[C@H]([NH3+])C2)no1 ZINC000903430933 584761470 /nfs/dbraw/zinc/76/14/70/584761470.db2.gz JMFCNMPUVXMELC-MBNYWOFBSA-N 2 0 249.358 2.247 20 0 BEADRP C[C@H]1Cc2ccccc2CN1C[C@H]1CCC[NH2+]1 ZINC000903440416 584763229 /nfs/dbraw/zinc/76/32/29/584763229.db2.gz XAMLJKHLZAFGAF-SWLSCSKDSA-N 2 0 230.355 2.185 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]C[C@H]2CCC[NH2+]2)[C@H]1C ZINC000903458563 584765206 /nfs/dbraw/zinc/76/52/06/584765206.db2.gz DFSJYTCDCBXGBU-YVECIDJPSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@@H]1CC[C@@H](C)C[C@H]1C ZINC000903458927 584765736 /nfs/dbraw/zinc/76/57/36/584765736.db2.gz NFFDTUZHDNZNOR-XGFWRYKXSA-N 2 0 224.392 2.256 20 0 BEADRP CC[C@H]1CCC[C@@H]1[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000903459181 584766114 /nfs/dbraw/zinc/76/61/14/584766114.db2.gz RLORPNNJDUQDMR-VOAKCMCISA-N 2 0 210.365 2.010 20 0 BEADRP CC1(C)CCC[C@@H]1[NH2+]C[C@@H]1CC[C@H]([NH3+])C1 ZINC000903458759 584766216 /nfs/dbraw/zinc/76/62/16/584766216.db2.gz IUUFMSKKOKZQIJ-WOPDTQHZSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[N@@H+]2CCC[C@@H]2c2ccccn2)C1 ZINC000903442214 584767394 /nfs/dbraw/zinc/76/73/94/584767394.db2.gz KXULJCGIHFUAFZ-GZBFAFLISA-N 2 0 245.370 2.346 20 0 BEADRP C[C@H]1C[NH+](C[C@@H]2CC[C@H]([NH3+])C2)C[C@H](C)C1(F)F ZINC000903464238 584767577 /nfs/dbraw/zinc/76/75/77/584767577.db2.gz FAQSXCZHLYJHLB-YFKTTZPYSA-N 2 0 246.345 2.337 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C/C=C\Cl)[C@@H]2CCC[C@H]21 ZINC000903443516 584768968 /nfs/dbraw/zinc/76/89/68/584768968.db2.gz HSZBAFZEITXKRQ-HJTBDDIRSA-N 2 0 228.767 2.201 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@@H+]1CCC[C@H]1c1ccncc1 ZINC000903454646 584773469 /nfs/dbraw/zinc/77/34/69/584773469.db2.gz HFZWRSRNUIJINH-SNPRPXQTSA-N 2 0 245.370 2.074 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@@H+]1CCC[C@@H]1c1ccncc1 ZINC000903454647 584773567 /nfs/dbraw/zinc/77/35/67/584773567.db2.gz HFZWRSRNUIJINH-VHDGCEQUSA-N 2 0 245.370 2.074 20 0 BEADRP FCCCCC[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000903471262 584775271 /nfs/dbraw/zinc/77/52/71/584775271.db2.gz HKJKAGKAZYFXTL-LLVKDONJSA-N 2 0 214.328 2.000 20 0 BEADRP C(C[NH2+][C@H]1CC[NH2+]C12CCC2)CC1CC1 ZINC000903472912 584775983 /nfs/dbraw/zinc/77/59/83/584775983.db2.gz WTAODAJGDPPMDD-LBPRGKRZSA-N 2 0 208.349 2.051 20 0 BEADRP C(C[C@@H]1C[C@H]1C1CC1)[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000903472001 584776133 /nfs/dbraw/zinc/77/61/33/584776133.db2.gz OWAMAYUIWDXWPB-HZSPNIEDSA-N 2 0 234.387 2.297 20 0 BEADRP C([NH2+][C@@H]1CC[NH2+]C12CCCC2)[C@@H]1C[C@H]2C[C@H]2C1 ZINC000903481926 584778504 /nfs/dbraw/zinc/77/85/04/584778504.db2.gz QLVCRPOFBZVETE-XJFOESAGSA-N 2 0 234.387 2.297 20 0 BEADRP C[C@@H]1CCC(C)(C)[N@@H+]1C[C@@H]1C[NH2+]C[C@H]1C ZINC000903482322 584778525 /nfs/dbraw/zinc/77/85/25/584778525.db2.gz BRZYQWFYOQJJOA-UTUOFQBUSA-N 2 0 210.365 2.105 20 0 BEADRP C(C[NH2+][C@H]1CC[NH2+]C12CCCC2)CC1CC1 ZINC000903482001 584778886 /nfs/dbraw/zinc/77/88/86/584778886.db2.gz UDNDKKGEKWNEHS-ZDUSSCGKSA-N 2 0 222.376 2.441 20 0 BEADRP CSCCC[NH2+][C@H]1CC[NH2+]C12CCCC2 ZINC000903484853 584779630 /nfs/dbraw/zinc/77/96/30/584779630.db2.gz WXMHBCCKTIFITA-NSHDSACASA-N 2 0 228.405 2.004 20 0 BEADRP CC1(C)CN([C@@H]2CCc3ccc(F)cc32)C[C@H]1[NH3+] ZINC000903556324 584782761 /nfs/dbraw/zinc/78/27/61/584782761.db2.gz UVGKJTFHXOFRAF-ZIAGYGMSSA-N 2 0 248.345 2.482 20 0 BEADRP CC1(C)CN(CCCc2ccsc2)C[C@@H]1[NH3+] ZINC000903556869 584783104 /nfs/dbraw/zinc/78/31/04/584783104.db2.gz IMVURHQXDWIJDP-LBPRGKRZSA-N 2 0 238.400 2.350 20 0 BEADRP C[N@H+](Cc1ccccc1CF)C1CC[NH2+]CC1 ZINC000903713344 584793608 /nfs/dbraw/zinc/79/36/08/584793608.db2.gz NSONXJUDOLVJNC-UHFFFAOYSA-N 2 0 236.334 2.340 20 0 BEADRP [NH3+]C[C@H]1CCC[N@H+](Cc2ccccc2CF)C1 ZINC000903713158 584793846 /nfs/dbraw/zinc/79/38/46/584793846.db2.gz GKEMGSBPXDRWGG-GFCCVEGCSA-N 2 0 236.334 2.327 20 0 BEADRP C[C@@H]([NH3+])[C@H]1CCC[N@H+](CC2CC(C)C2)C1 ZINC000903716264 584794448 /nfs/dbraw/zinc/79/44/48/584794448.db2.gz LESVNSHWTXHJCB-KPFVRQRISA-N 2 0 210.365 2.092 20 0 BEADRP CC1CC(C[N@@H+]2C[C@@H]3CCC[C@@H]([NH3+])[C@@H]3C2)C1 ZINC000903743088 584796479 /nfs/dbraw/zinc/79/64/79/584796479.db2.gz IEPBWOKAWSQDSP-PNKMZZHYSA-N 2 0 222.376 2.092 20 0 BEADRP C[C@@H]([NH3+])[C@@H]1CC[N@H+](Cc2ccccc2CF)C1 ZINC000903744717 584796941 /nfs/dbraw/zinc/79/69/41/584796941.db2.gz XMXQSWWXBFPOSJ-DGCLKSJQSA-N 2 0 236.334 2.325 20 0 BEADRP C[C@H]1C[C@@H]([NH3+])CC[N@@H+]1Cc1ccccc1CF ZINC000903767214 584797808 /nfs/dbraw/zinc/79/78/08/584797808.db2.gz FSIFYUYSBGDQMF-FZMZJTMJSA-N 2 0 236.334 2.468 20 0 BEADRP C[C@H]1C[C@H]([NH3+])CC[N@@H+]1Cc1ccccc1CF ZINC000903767216 584798068 /nfs/dbraw/zinc/79/80/68/584798068.db2.gz FSIFYUYSBGDQMF-SMDDNHRTSA-N 2 0 236.334 2.468 20 0 BEADRP CC(C)C[C@@H](C)C[NH2+][C@H]1C[NH2+]CC1(C)C ZINC000903821463 584804075 /nfs/dbraw/zinc/80/40/75/584804075.db2.gz LEWSVDFVCSCARB-NEPJUHHUSA-N 2 0 212.381 2.256 20 0 BEADRP Cc1cccnc1[C@H]([NH2+]CCC[NH3+])C(C)(C)C ZINC000903829618 584805846 /nfs/dbraw/zinc/80/58/46/584805846.db2.gz IKPSYVGPZMNWAA-ZDUSSCGKSA-N 2 0 235.375 2.416 20 0 BEADRP C[C@@H]1CC=CC[C@H]1[NH2+]CCC1CC[NH2+]CC1 ZINC000903850918 584807860 /nfs/dbraw/zinc/80/78/60/584807860.db2.gz ZWPUCGJLBIAHJM-TZMCWYRMSA-N 2 0 222.376 2.320 20 0 BEADRP CC(C)=CCCN1CCC[C@@]12CC[NH2+]C2 ZINC000903869085 584813826 /nfs/dbraw/zinc/81/38/26/584813826.db2.gz BAKGQWUZPIHJAC-ZDUSSCGKSA-N 2 0 208.349 2.171 20 0 BEADRP CC(C)C[C@H](C)C[N@@H+]1CCC[C@@]12CC[NH2+]C2 ZINC000903872279 584815629 /nfs/dbraw/zinc/81/56/29/584815629.db2.gz YGSBZOAJFBGTFW-KBPBESRZSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@]1(C)CCCN(C[C@H]([NH3+])CC(F)F)C1 ZINC000903894988 584819435 /nfs/dbraw/zinc/81/94/35/584819435.db2.gz JBSAZXWBRUXVHG-ZYHUDNBSSA-N 2 0 234.334 2.481 20 0 BEADRP CC[C@@]1(C)CCCN(C[C@@H]([NH3+])CC(F)F)C1 ZINC000903894986 584819663 /nfs/dbraw/zinc/81/96/63/584819663.db2.gz JBSAZXWBRUXVHG-JQWIXIFHSA-N 2 0 234.334 2.481 20 0 BEADRP C[C@@H](Cc1cccs1)[NH2+]C[C@H]([NH3+])CC(F)F ZINC000903923257 584823872 /nfs/dbraw/zinc/82/38/72/584823872.db2.gz OZMFWTRPCSLLCO-DTWKUNHWSA-N 2 0 248.342 2.251 20 0 BEADRP C[C@@]1([NH2+]C[C@H](N)CC(F)F)CC=CCC1 ZINC000903929695 584824522 /nfs/dbraw/zinc/82/45/22/584824522.db2.gz JQHWVJAEHNDXAU-MWLCHTKSSA-N 2 0 218.291 2.057 20 0 BEADRP C[C@@H]([NH3+])c1ccc(NC[C@@H]([NH3+])CC(F)F)cc1 ZINC000903918166 584827055 /nfs/dbraw/zinc/82/70/55/584827055.db2.gz UDFYFTWZOUNRDZ-SCZZXKLOSA-N 2 0 243.301 2.101 20 0 BEADRP C[C@H]1CC2(CCC2)CN1C[C@H]([NH3+])CC(F)F ZINC000903917815 584827076 /nfs/dbraw/zinc/82/70/76/584827076.db2.gz NSSSCYXVEWBTGX-VHSXEESVSA-N 2 0 232.318 2.233 20 0 BEADRP CC1(C)CCC[C@H]1[NH2+]C[C@H]1C[NH2+]CCC1(F)F ZINC000903957948 584827373 /nfs/dbraw/zinc/82/73/73/584827373.db2.gz UYTVHLHWWBMAKP-GHMZBOCLSA-N 2 0 246.345 2.400 20 0 BEADRP CC(C)(C)CC[NH2+]C[C@H]1C[NH2+]CCC1(F)F ZINC000903957421 584827420 /nfs/dbraw/zinc/82/74/20/584827420.db2.gz QPLXSPYIRATAHF-JTQLQIEISA-N 2 0 234.334 2.257 20 0 BEADRP CC(C)CCC[NH2+]C[C@@H]1C[NH2+]CCC1(F)F ZINC000903958411 584827469 /nfs/dbraw/zinc/82/74/69/584827469.db2.gz ZRMHHQFQKMRBJL-LLVKDONJSA-N 2 0 234.334 2.257 20 0 BEADRP C[C@@H]1CCC[C@H]1[NH2+]C[C@H]1C[NH2+]CCC1(F)F ZINC000903957390 584827873 /nfs/dbraw/zinc/82/78/73/584827873.db2.gz QKOXLZPLIAKFOI-GMTAPVOTSA-N 2 0 232.318 2.009 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+][C@@H]1CCCC1(C)C ZINC000903973909 584832670 /nfs/dbraw/zinc/83/26/70/584832670.db2.gz IVFUDTBSUVCWTO-JHJVBQTASA-N 2 0 224.392 2.400 20 0 BEADRP Cc1cccc(C[NH2+]C[C@@H]2C[NH2+]C[C@H]2C)c1C ZINC000903964545 584833801 /nfs/dbraw/zinc/83/38/01/584833801.db2.gz LBDZPIVINTVECR-DOMZBBRYSA-N 2 0 232.371 2.249 20 0 BEADRP C[C@@H](CC1CCCC1)[NH2+][C@@H]1C[NH2+]C[C@H]1C ZINC000903964103 584833830 /nfs/dbraw/zinc/83/38/30/584833830.db2.gz LTHLBJJINUOREQ-NTZNESFSSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+][C@@H]1CC[C@@H](C)[C@H](C)C1 ZINC000903964098 584833859 /nfs/dbraw/zinc/83/38/59/584833859.db2.gz LJADWHKUEKEHNH-SYLRKERUSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+]CC(C)(C)c1ccccc1 ZINC000903963998 584834092 /nfs/dbraw/zinc/83/40/92/584834092.db2.gz DCSVXOMCQXCBID-KGLIPLIRSA-N 2 0 246.398 2.409 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@H]1CC[C@@H](C)[C@@H](C)C1 ZINC000903968358 584834943 /nfs/dbraw/zinc/83/49/43/584834943.db2.gz UEIOIWQXMAKOJI-BJJPWKGXSA-N 2 0 224.392 2.256 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@@H]1CC[C@@H](C)[C@@H](C)C1 ZINC000903968361 584834976 /nfs/dbraw/zinc/83/49/76/584834976.db2.gz UEIOIWQXMAKOJI-XHJNMGKDSA-N 2 0 224.392 2.256 20 0 BEADRP Cc1ccccc1C[C@H](C)[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000903968304 584835021 /nfs/dbraw/zinc/83/50/21/584835021.db2.gz SAULRSCCAPWEBR-YCPHGPKFSA-N 2 0 246.398 2.371 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@@H]1CC[C@@H](C)[C@H](C)C1 ZINC000903968360 584835137 /nfs/dbraw/zinc/83/51/37/584835137.db2.gz UEIOIWQXMAKOJI-XGFWRYKXSA-N 2 0 224.392 2.256 20 0 BEADRP COc1ccc([C@H](C)[N@H+](C)C[C@H]2C[C@@H]([NH3+])C2)cc1 ZINC000904307099 584862335 /nfs/dbraw/zinc/86/23/35/584862335.db2.gz KXOABSFFAVZRFT-SGMGOOAPSA-N 2 0 248.370 2.425 20 0 BEADRP CCC[N@H+](C)C[C@H]([NH3+])CCC(C)(C)C ZINC000904307709 584862805 /nfs/dbraw/zinc/86/28/05/584862805.db2.gz UIBROLKOMLRUPP-LLVKDONJSA-N 2 0 200.370 2.482 20 0 BEADRP CC[N@H+](CCc1ccccc1)C[C@H]1C[C@@H]([NH3+])C1 ZINC000904312480 584863496 /nfs/dbraw/zinc/86/34/96/584863496.db2.gz QYGYXLCXMUKNCY-GASCZTMLSA-N 2 0 232.371 2.288 20 0 BEADRP C[N@H+](C[C@]1(C)CCC[NH2+]C1)C(C1CC1)C1CC1 ZINC000904313778 584863544 /nfs/dbraw/zinc/86/35/44/584863544.db2.gz JYVWPTJDBZFIAG-OAHLLOKOSA-N 2 0 236.403 2.497 20 0 BEADRP CC(C)([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccccc1 ZINC000904327801 584865683 /nfs/dbraw/zinc/86/56/83/584865683.db2.gz IWWMCZFADYSMRH-BJHJDKERSA-N 2 0 218.344 2.249 20 0 BEADRP CCC(CC)(CO)[NH2+]C[C@@H]([NH3+])CCC(C)(C)C ZINC000904329722 584865850 /nfs/dbraw/zinc/86/58/50/584865850.db2.gz RVBWKHLLHCOMIY-LBPRGKRZSA-N 2 0 244.423 2.281 20 0 BEADRP CC[C@@](C)([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1nccs1 ZINC000904329201 584865873 /nfs/dbraw/zinc/86/58/73/584865873.db2.gz MNUVUDPCJBOIMI-JFGNBEQYSA-N 2 0 239.388 2.095 20 0 BEADRP CCC(CC)(CO)[NH2+]C[C@H]([NH3+])CCC(C)(C)C ZINC000904329721 584866014 /nfs/dbraw/zinc/86/60/14/584866014.db2.gz RVBWKHLLHCOMIY-GFCCVEGCSA-N 2 0 244.423 2.281 20 0 BEADRP CCC[C@]1(COC)CCC[N@@H+]1C[C@H]1C[C@@H]([NH3+])C1 ZINC000904345132 584867719 /nfs/dbraw/zinc/86/77/19/584867719.db2.gz DAQXAJLRHORXLO-HZSPNIEDSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@H]2C[C@@H]([NH3+])C2)CC12CCC2 ZINC000904345425 584868060 /nfs/dbraw/zinc/86/80/60/584868060.db2.gz DFOYSOGKAGCAIU-UPJWGTAASA-N 2 0 222.376 2.236 20 0 BEADRP C[N@H+](C[C@H]1C[C@@H]([NH3+])C1)[C@@H]1CCC(C)(C)C1 ZINC000904350133 584868781 /nfs/dbraw/zinc/86/87/81/584868781.db2.gz GTAUSMMVISKSRO-GRYCIOLGSA-N 2 0 210.365 2.234 20 0 BEADRP Cc1cc(N)cc(C[NH2+]C[C@]2(C)CCC[NH2+]C2)c1 ZINC000904355542 584871274 /nfs/dbraw/zinc/87/12/74/584871274.db2.gz UFYGYSVPBLNKEX-OAHLLOKOSA-N 2 0 247.386 2.057 20 0 BEADRP Cc1cccc(OC[C@@H](C)[NH2+]C[C@H]2C[C@@H]([NH3+])C2)c1 ZINC000904361936 584871863 /nfs/dbraw/zinc/87/18/63/584871863.db2.gz CMAJOLOCHBYEHJ-MCIONIFRSA-N 2 0 248.370 2.089 20 0 BEADRP CC(C)(C)CC[C@@H]([NH3+])CN[C@@H](C[NH3+])C(C)(C)C ZINC000904357687 584872009 /nfs/dbraw/zinc/87/20/09/584872009.db2.gz ADFLAMVBUQUDAB-NEPJUHHUSA-N 2 0 243.439 2.103 20 0 BEADRP [NH3+]CC1CC([NH2+]CCCc2cccc(F)c2)C1 ZINC000904361012 584872176 /nfs/dbraw/zinc/87/21/76/584872176.db2.gz SJWZSSIRZIZBQI-UHFFFAOYSA-N 2 0 236.334 2.085 20 0 BEADRP [NH3+]CC1CC([NH2+][C@@H]2C[C@@H]2C2CCCCC2)C1 ZINC000904367570 584872722 /nfs/dbraw/zinc/87/27/22/584872722.db2.gz FIOFGXZGUHRILF-CCAROEGRSA-N 2 0 222.376 2.282 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[N@@H+]2CCCC[C@H]2C2CCC2)C1 ZINC000904373652 584873977 /nfs/dbraw/zinc/87/39/77/584873977.db2.gz HTVULQONOSCDHU-YUTCNCBUSA-N 2 0 222.376 2.378 20 0 BEADRP C[C@@H]([NH2+]C1CC(C[NH3+])C1)c1ccccc1 ZINC000904364237 584874330 /nfs/dbraw/zinc/87/43/30/584874330.db2.gz JOBRYMVHMGVWOQ-XSRFYTQQSA-N 2 0 204.317 2.075 20 0 BEADRP CC(C)Oc1ccc(C[NH2+]C[C@H]2C[C@@H]([NH3+])C2)cc1 ZINC000904364104 584874346 /nfs/dbraw/zinc/87/43/46/584874346.db2.gz RPPIEBQYOZQTLR-OKILXGFUSA-N 2 0 248.370 2.301 20 0 BEADRP CC(C)(C)CC[C@@H]([NH3+])C[NH2+]C[C@]1(C)CCCO1 ZINC000904366853 584875022 /nfs/dbraw/zinc/87/50/22/584875022.db2.gz RHHCPNLTXWVXSW-OCCSQVGLSA-N 2 0 242.407 2.299 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH+]2CCC(c3ccco3)CC2)C1 ZINC000904377197 584876115 /nfs/dbraw/zinc/87/61/15/584876115.db2.gz KWPVIMKHPYVBBO-BJHJDKERSA-N 2 0 234.343 2.196 20 0 BEADRP C[C@@H](C[NH2+]C[C@]1(C)CCC[NH2+]C1)c1ccccn1 ZINC000904377394 584876354 /nfs/dbraw/zinc/87/63/54/584876354.db2.gz PTUHMDOGRZFEJC-DZGCQCFKSA-N 2 0 247.386 2.164 20 0 BEADRP C[C@@]1(C[N@@H+]2CC[C@@]3(CC3(F)F)C2)CCC[NH2+]C1 ZINC000904376394 584876424 /nfs/dbraw/zinc/87/64/24/584876424.db2.gz QZXLEBZYUFDQND-VXGBXAGGSA-N 2 0 244.329 2.107 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@H]([NH3+])CCC(C)(C)C)[C@H](C)O1 ZINC000904384298 584877100 /nfs/dbraw/zinc/87/71/00/584877100.db2.gz JORBMVNANGSDMZ-XQHKEYJVSA-N 2 0 242.407 2.296 20 0 BEADRP C/C=C/C[C@@H]1CCC[N@H+](C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000904381650 584877500 /nfs/dbraw/zinc/87/75/00/584877500.db2.gz QRVGJGHZWPZDOR-LZLIAMDJSA-N 2 0 222.376 2.402 20 0 BEADRP CC1(C)Nc2ccccc2[C@@H]1[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000904385908 584877846 /nfs/dbraw/zinc/87/78/46/584877846.db2.gz JLJXGORZKAHQFV-WDMOLILDSA-N 2 0 245.370 2.259 20 0 BEADRP C[N@@H+](Cc1ccc2cc[nH]c2c1)C[C@H]1C[C@@H]([NH3+])C1 ZINC000904385503 584877856 /nfs/dbraw/zinc/87/78/56/584877856.db2.gz XHDODLNXIOLJCZ-XBXGTLAGSA-N 2 0 243.354 2.337 20 0 BEADRP COc1ccccc1C[N@@H+]1CC[C@@H](C[NH3+])[C@H](C)C1 ZINC000904411857 584879556 /nfs/dbraw/zinc/87/95/56/584879556.db2.gz OLYMYHISTWAKOF-OLZOCXBDSA-N 2 0 248.370 2.112 20 0 BEADRP COc1cc(C)c([C@@H](C)NC[C@@H](C)[NH3+])cc1C ZINC000817972711 584993888 /nfs/dbraw/zinc/99/38/88/584993888.db2.gz NXWABSRWXNJRSX-VXGBXAGGSA-N 2 0 236.359 2.310 20 0 BEADRP CCCC[N@H+](C)CC1CC[NH+](CCF)CC1 ZINC000759342316 585368983 /nfs/dbraw/zinc/36/89/83/585368983.db2.gz NUNAYUVNEOBJCQ-UHFFFAOYSA-N 2 0 230.371 2.400 20 0 BEADRP CCCC[N@@H+]1CCC[C@H]2C[NH+](C)CC[C@H]21 ZINC000769663941 585561358 /nfs/dbraw/zinc/56/13/58/585561358.db2.gz ZWRBHEANVHYNMM-QWHCGFSZSA-N 2 0 210.365 2.203 20 0 BEADRP CCCC[N@@H+]1CCC[C@@H]2C[NH+](C)CC[C@H]21 ZINC000769663937 585561425 /nfs/dbraw/zinc/56/14/25/585561425.db2.gz ZWRBHEANVHYNMM-CHWSQXEVSA-N 2 0 210.365 2.203 20 0 BEADRP C[C@H](C1CC1)[NH+]1CCC(n2ccnc2)CC1 ZINC000782180011 585809863 /nfs/dbraw/zinc/80/98/63/585809863.db2.gz BPVAUTJFJBOBFY-LLVKDONJSA-N 2 0 219.332 2.319 20 0 BEADRP C[C@H](C1CC1)[N@@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000782182455 585810215 /nfs/dbraw/zinc/81/02/15/585810215.db2.gz HDFFEUIWFGNBND-OLZOCXBDSA-N 2 0 222.376 2.203 20 0 BEADRP C[C@@H]1CCC[N@H+](CC2CC[NH+](C)CC2)C1 ZINC000788471086 585925105 /nfs/dbraw/zinc/92/51/05/585925105.db2.gz UCTIPNKCMWTLIM-GFCCVEGCSA-N 2 0 210.365 2.060 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2CCSC(C)(C)C2)CC1 ZINC000788483159 585925125 /nfs/dbraw/zinc/92/51/25/585925125.db2.gz SGUACKPGLLVNAT-UHFFFAOYSA-N 2 0 242.432 2.156 20 0 BEADRP CCCC[N@H+](CC)CC1CC[NH+](C)CC1 ZINC000788470716 585925193 /nfs/dbraw/zinc/92/51/93/585925193.db2.gz MFTDMLPZEFOXIC-UHFFFAOYSA-N 2 0 212.381 2.450 20 0 BEADRP [NH3+]Cc1ccc(-c2cccc3c2C[NH2+]CC3)cc1 ZINC000757215197 586440364 /nfs/dbraw/zinc/44/03/64/586440364.db2.gz NKFYEZCCGSECIU-UHFFFAOYSA-N 2 0 238.334 2.458 20 0 BEADRP C[C@@H](C[NH2+][C@H](C)[C@H]1CCC[NH2+]1)C(C)(C)C ZINC000817893532 586834254 /nfs/dbraw/zinc/83/42/54/586834254.db2.gz FMSLVYFCBGGEGV-QJPTWQEYSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@@H](C[NH2+][C@H]1CCOC[C@H]1[C@H](C)[NH3+])C(C)(C)C ZINC000817893964 586834322 /nfs/dbraw/zinc/83/43/22/586834322.db2.gz JTOJKAKXRNSHFW-CYDGBPFRSA-N 2 0 242.407 2.011 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+]CCNc1ccccc1 ZINC000817899542 586835645 /nfs/dbraw/zinc/83/56/45/586835645.db2.gz GQFQAMYZRFGJSP-HIFRSBDPSA-N 2 0 247.386 2.206 20 0 BEADRP CCN(C)c1ccccc1C[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000817902624 586836461 /nfs/dbraw/zinc/83/64/61/586836461.db2.gz VMVWALXNJWZMFI-STQMWFEESA-N 2 0 249.402 2.358 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CCSC(C)(C)C ZINC000817908944 586837531 /nfs/dbraw/zinc/83/75/31/586837531.db2.gz UKDGHBXVADHSHN-NXEZZACHSA-N 2 0 218.410 2.234 20 0 BEADRP Cc1ncc(CC[NH2+][C@H](C)CCCC[NH3+])s1 ZINC000817916440 586839655 /nfs/dbraw/zinc/83/96/55/586839655.db2.gz ZNJKHGPIFUYNGK-SNVBAGLBSA-N 2 0 241.404 2.101 20 0 BEADRP CSCCCCCC[NH2+][C@@H]1CCC[C@@H]1[NH3+] ZINC000817922092 586840556 /nfs/dbraw/zinc/84/05/56/586840556.db2.gz PTTIYACAALEELO-NWDGAFQWSA-N 2 0 230.421 2.379 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H](C)CSC(C)(C)C ZINC000817944153 586841175 /nfs/dbraw/zinc/84/11/75/586841175.db2.gz YECACQKYXQQXDZ-NSHDSACASA-N 2 0 232.437 2.496 20 0 BEADRP Cc1cc(F)ccc1[C@H](C)[NH2+]CCC[NH3+] ZINC000817938321 586843950 /nfs/dbraw/zinc/84/39/50/586843950.db2.gz JAEKKSLCROMUNR-JTQLQIEISA-N 2 0 210.296 2.134 20 0 BEADRP COc1cc(C)c([C@H](C)[NH2+]CCC[NH3+])cc1C ZINC000817938987 586844008 /nfs/dbraw/zinc/84/40/08/586844008.db2.gz XCHNLCCFLYWMNI-LBPRGKRZSA-N 2 0 236.359 2.311 20 0 BEADRP C[C@]1(C[NH2+][C@H]2CCC[C@@H]2[NH3+])CC1(Cl)Cl ZINC000817937827 586844074 /nfs/dbraw/zinc/84/40/74/586844074.db2.gz YGYXUYFBBUUCDJ-XHNCKOQMSA-N 2 0 237.174 2.040 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]C[C@@]1(C)CC1(Cl)Cl ZINC000817937601 586844239 /nfs/dbraw/zinc/84/42/39/586844239.db2.gz SRHIGGCGZODMHT-DJLDLDEBSA-N 2 0 239.190 2.286 20 0 BEADRP C[C@@H](CSC(C)(C)C)[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000817945540 586846243 /nfs/dbraw/zinc/84/62/43/586846243.db2.gz FWYQBJNSKOGRQD-NWDGAFQWSA-N 2 0 244.448 2.496 20 0 BEADRP [NH3+]CCc1ccc(C[NH2+][C@@H]2CC[C@H]2C2CC2)cc1 ZINC000817947599 586847014 /nfs/dbraw/zinc/84/70/14/586847014.db2.gz BTWWEKHCBKNAAX-JKSUJKDBSA-N 2 0 244.382 2.466 20 0 BEADRP [NH3+]CCc1ccc(C[NH2+][C@H]2CC[C@@H]2C2CC2)cc1 ZINC000817947596 586847205 /nfs/dbraw/zinc/84/72/05/586847205.db2.gz BTWWEKHCBKNAAX-CVEARBPZSA-N 2 0 244.382 2.466 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+][C@H]1CCC[NH2+]CC1 ZINC000817968534 586856488 /nfs/dbraw/zinc/85/64/88/586856488.db2.gz LFYQGQWUOMNFFM-AVGNSLFASA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H](CSC(C)(C)C)[NH2+][C@@H]1CC[NH2+]C[C@H]1C ZINC000817972117 586859633 /nfs/dbraw/zinc/85/96/33/586859633.db2.gz TWQVAQQSGIGASU-IJLUTSLNSA-N 2 0 244.448 2.494 20 0 BEADRP C[C@H](CSC(C)(C)C)[NH2+][C@@H](C)[C@@H](C)[NH3+] ZINC000817978011 586862240 /nfs/dbraw/zinc/86/22/40/586862240.db2.gz TVNAYRGQLURIHY-BBBLOLIVSA-N 2 0 218.410 2.232 20 0 BEADRP C1CC1[C@@H]1CC[C@H]1[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000817984810 586862561 /nfs/dbraw/zinc/86/25/61/586862561.db2.gz AIYODOFAJSOFAU-HZSPNIEDSA-N 2 0 234.387 2.439 20 0 BEADRP Cc1ccncc1CCC[N@@H+]1CCC2(COC2)C1 ZINC000827644081 587394157 /nfs/dbraw/zinc/39/41/57/587394157.db2.gz OQZSLZPLZNCYSI-UHFFFAOYSA-N 2 0 246.354 2.045 20 0 BEADRP C[N@H+](CCCC[NH2+]C[C@@H]1CCC=CO1)C1CC1 ZINC000835064738 587780034 /nfs/dbraw/zinc/78/00/34/587780034.db2.gz YIYPKFNDHFSQJH-AWEZNQCLSA-N 2 0 238.375 2.143 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+]Cc1ccc2c(c1)CC(C)(C)O2 ZINC000841048692 587940025 /nfs/dbraw/zinc/94/00/25/587940025.db2.gz KXMSDRQITRRFGF-NSHDSACASA-N 2 0 248.370 2.085 20 0 BEADRP Cc1cc([C@@H]2CCC[N@@H+]2CC[C@@H]2CC[NH2+]C2)no1 ZINC000842471442 588028355 /nfs/dbraw/zinc/02/83/55/588028355.db2.gz BJRKOSCIOVSKER-JSGCOSHPSA-N 2 0 249.358 2.120 20 0 BEADRP CC(C)(C)[C@@H](C[NH3+])NCc1cnc(Cl)s1 ZINC000842474951 588029154 /nfs/dbraw/zinc/02/91/54/588029154.db2.gz FUVUENPACBNSHG-MRVPVSSYSA-N 2 0 247.795 2.260 20 0 BEADRP CC(C)[C@@H]1C[C@@H]([NH2+]CCCCCC[NH3+])CCO1 ZINC000843128180 588082529 /nfs/dbraw/zinc/08/25/29/588082529.db2.gz VEHNXNBHDLVEPE-KBPBESRZSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@@H](CC1CCOCC1)[NH2+]CCCCCC[NH3+] ZINC000843126872 588084610 /nfs/dbraw/zinc/08/46/10/588084610.db2.gz KKUIHSVUHBQVJC-ZDUSSCGKSA-N 2 0 242.407 2.300 20 0 BEADRP COc1ccc(C[NH2+]CCCCCC[NH3+])cc1 ZINC000843127325 588085012 /nfs/dbraw/zinc/08/50/12/588085012.db2.gz FDLWTMVFXHKJBT-UHFFFAOYSA-N 2 0 236.359 2.304 20 0 BEADRP CCn1cc([C@H](C)[NH2+]CCCCCC[NH3+])cn1 ZINC000843341426 588100864 /nfs/dbraw/zinc/10/08/64/588100864.db2.gz DAMLGKZFIHXOBL-LBPRGKRZSA-N 2 0 238.379 2.073 20 0 BEADRP C[C@@H]([NH2+]CCCCCC[NH3+])c1cncs1 ZINC000843340361 588101020 /nfs/dbraw/zinc/10/10/20/588101020.db2.gz BMFXJLWITBFXJW-SNVBAGLBSA-N 2 0 227.377 2.313 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+]CCCCCC[NH3+] ZINC000843342205 588101181 /nfs/dbraw/zinc/10/11/81/588101181.db2.gz OMOUZIAHLANMES-GFCCVEGCSA-N 2 0 224.348 2.319 20 0 BEADRP C[C@H]([NH2+]CCCCCC[NH3+])c1cccnc1 ZINC000843342907 588101663 /nfs/dbraw/zinc/10/16/63/588101663.db2.gz VAKWETIIOGLQFY-LBPRGKRZSA-N 2 0 221.348 2.251 20 0 BEADRP C[N@H+](C[C@H]1CC[NH2+]C1)[C@H]1CCc2ccccc2C1 ZINC000843358332 588103575 /nfs/dbraw/zinc/10/35/75/588103575.db2.gz KYGNBVCLBFKWFG-BBRMVZONSA-N 2 0 244.382 2.085 20 0 BEADRP C[N@H+](C[C@@H]1CC[NH2+]C1)[C@@H]1CCc2ccccc2C1 ZINC000843358334 588103923 /nfs/dbraw/zinc/10/39/23/588103923.db2.gz KYGNBVCLBFKWFG-CZUORRHYSA-N 2 0 244.382 2.085 20 0 BEADRP C[NH+]1CCC(CC[NH2+]C2CCSCC2)CC1 ZINC000105454758 588174050 /nfs/dbraw/zinc/17/40/50/588174050.db2.gz OJJZBIUMRGPILD-UHFFFAOYSA-N 2 0 242.432 2.204 20 0 BEADRP CCOC[C@@H]1CCC[N@H+](CCCCCC[NH3+])C1 ZINC000846218833 588260692 /nfs/dbraw/zinc/26/06/92/588260692.db2.gz YCKUATSPGYRZRE-CQSZACIVSA-N 2 0 242.407 2.254 20 0 BEADRP [NH3+]CCCCCCN1CC[NH2+]Cc2ccccc21 ZINC000846218523 588260928 /nfs/dbraw/zinc/26/09/28/588260928.db2.gz WQVOXRUMPBLRJS-UHFFFAOYSA-N 2 0 247.386 2.115 20 0 BEADRP [NH3+]CCCCCC[N@@H+]1CCC[C@H]2COCC[C@@H]21 ZINC000846219036 588260941 /nfs/dbraw/zinc/26/09/41/588260941.db2.gz DFPBIWTYDBQHEH-KBPBESRZSA-N 2 0 240.391 2.006 20 0 BEADRP C[C@@H]1CC2(C[N@@H+]1C/C=C/Cl)CC[NH2+]CC2 ZINC000846224464 588261554 /nfs/dbraw/zinc/26/15/54/588261554.db2.gz XSVZKOZBQZQQDA-XGQHYKRYSA-N 2 0 228.767 2.203 20 0 BEADRP CC(C)c1ccccc1C[NH+]1C[C@@H]2C[NH2+]C[C@H]2C1 ZINC000848890625 588417513 /nfs/dbraw/zinc/41/75/13/588417513.db2.gz SUIIIZOLLCUMIT-GJZGRUSLSA-N 2 0 244.382 2.461 20 0 BEADRP Cc1cccc(NC(=[NH2+])NC[C@H](C)C[NH+](C)C)c1 ZINC000849030738 588442903 /nfs/dbraw/zinc/44/29/03/588442903.db2.gz VXAZTGTWXSVOGN-LBPRGKRZSA-N 2 0 248.374 2.129 20 0 BEADRP CCC(C)(C)C[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000863483087 589292724 /nfs/dbraw/zinc/29/27/24/589292724.db2.gz QSGLGPBWLLKRGQ-NSHDSACASA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1[NH2+][C@H]1CC[C@@H]1C(C)C ZINC000863543440 589297331 /nfs/dbraw/zinc/29/73/31/589297331.db2.gz OXWDWXLWTWXLPE-MROQNXINSA-N 2 0 210.365 2.151 20 0 BEADRP C[C@@H]([NH3+])CN(C)CCCc1cccc(F)c1 ZINC000863568653 589299938 /nfs/dbraw/zinc/29/99/38/589299938.db2.gz NFWUPOYRZRAPRZ-LLVKDONJSA-N 2 0 224.323 2.037 20 0 BEADRP COCc1ccc(C[NH2+]CCCCCC[NH3+])o1 ZINC000863642620 589307109 /nfs/dbraw/zinc/30/71/09/589307109.db2.gz SYUHUIRLSIBDIB-UHFFFAOYSA-N 2 0 240.347 2.035 20 0 BEADRP C[C@@H]([NH3+])CN(C)CCSCc1ccccc1 ZINC000863652289 589307562 /nfs/dbraw/zinc/30/75/62/589307562.db2.gz RCEFNXKWPKVPOG-GFCCVEGCSA-N 2 0 238.400 2.199 20 0 BEADRP CCC(CC)NC(=[NH2+])NCCC[NH2+]C(C)(C)C ZINC000864454389 589366423 /nfs/dbraw/zinc/36/64/23/589366423.db2.gz NDHLZPFREJIFDM-UHFFFAOYSA-N 2 0 242.411 2.067 20 0 BEADRP CS[C@H]1C[C@H]([NH2+][C@H]2CC[N@H+](C)C(C)(C)C2)C1 ZINC000865733317 589459206 /nfs/dbraw/zinc/45/92/06/589459206.db2.gz HNKADOCNNQIIAA-SRVKXCTJSA-N 2 0 242.432 2.343 20 0 BEADRP CCc1cc(N2CC[C@@H]3[C@H](CC[N@@H+]3C)C2)cc[nH+]1 ZINC000866206195 589480129 /nfs/dbraw/zinc/48/01/29/589480129.db2.gz BYVAPYLYPSMFKE-IUODEOHRSA-N 2 0 245.370 2.174 20 0 BEADRP Cc1cccc(C[C@H](C)[NH2+]CCC[NH+](C)C)c1 ZINC000866215183 589481075 /nfs/dbraw/zinc/48/10/75/589481075.db2.gz VINMWJBXIGRBBQ-AWEZNQCLSA-N 2 0 234.387 2.467 20 0 BEADRP C[C@H](CCc1cccnc1)[NH2+]CCCC[NH+](C)C ZINC000866248206 589482824 /nfs/dbraw/zinc/48/28/24/589482824.db2.gz BBNZTHNVEVJIGU-CQSZACIVSA-N 2 0 249.402 2.334 20 0 BEADRP C(CC1CC1)C[N@H+](C1CC1)C1CC[NH2+]CC1 ZINC000866661640 589508892 /nfs/dbraw/zinc/50/88/92/589508892.db2.gz KFHYKOVYGLPYKD-UHFFFAOYSA-N 2 0 222.376 2.393 20 0 BEADRP CC(C)(C)[C@]1(C[NH3+])CC[N@H+](Cc2ccccn2)C1 ZINC000866705932 589514424 /nfs/dbraw/zinc/51/44/24/589514424.db2.gz JTGYQAVPNUOTAS-HNNXBMFYSA-N 2 0 247.386 2.279 20 0 BEADRP C[NH2+]CCC[N@@H+]1CC[C@@]2(CCc3ccccc32)C1 ZINC000872146126 589885367 /nfs/dbraw/zinc/88/53/67/589885367.db2.gz GIIVXRYRJAOJME-INIZCTEOSA-N 2 0 244.382 2.186 20 0 BEADRP C[C@H]1C[C@@H](C[NH2+][C@@H]2CCCC[C@@H]2F)CC[NH2+]1 ZINC000873215913 589997864 /nfs/dbraw/zinc/99/78/64/589997864.db2.gz HEXDUBOTSZZSLV-ZDEQEGDKSA-N 2 0 228.355 2.245 20 0 BEADRP C[C@H](C[C@H]1CCC[NH2+]1)[NH2+][C@@H]1CCCC[C@@H]1F ZINC000873217695 589998042 /nfs/dbraw/zinc/99/80/42/589998042.db2.gz PMTCXMBWQYIXPR-FVCCEPFGSA-N 2 0 228.355 2.387 20 0 BEADRP C[C@@H]1C[C@@H](C[NH2+][C@@H]2CCCC[C@@H]2F)CC[NH2+]1 ZINC000873215911 589998167 /nfs/dbraw/zinc/99/81/67/589998167.db2.gz HEXDUBOTSZZSLV-MROQNXINSA-N 2 0 228.355 2.245 20 0 BEADRP C[C@@H]1C[C@H](C[NH2+][C@@H]2CCCC[C@@H]2F)CC[NH2+]1 ZINC000873215910 589998346 /nfs/dbraw/zinc/99/83/46/589998346.db2.gz HEXDUBOTSZZSLV-FVCCEPFGSA-N 2 0 228.355 2.245 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[C@H](C)C1)C1CC[NH2+]CC1 ZINC000873220210 589999031 /nfs/dbraw/zinc/99/90/31/589999031.db2.gz GXRKCHJPEYRNFU-LOWVWBTDSA-N 2 0 210.365 2.153 20 0 BEADRP CCC[C@@H](C)C[NH2+][C@@H](C)C1CC[NH2+]CC1 ZINC000873222263 589999401 /nfs/dbraw/zinc/99/94/01/589999401.db2.gz IZISTMWYKPYASK-NEPJUHHUSA-N 2 0 212.381 2.400 20 0 BEADRP CC(C)C[C@H]([NH3+])CN1CC[C@@H]2CSC[C@H]2C1 ZINC000873221960 589999540 /nfs/dbraw/zinc/99/95/40/589999540.db2.gz VCWKGORQTZUNDY-UPJWGTAASA-N 2 0 242.432 2.045 20 0 BEADRP CC(C)(C)CC[NH2+][C@@]12CCC[C@H]1[NH2+]CC2 ZINC000873232335 590002719 /nfs/dbraw/zinc/00/27/19/590002719.db2.gz WSSALVBCKZKCFE-DGCLKSJQSA-N 2 0 210.365 2.297 20 0 BEADRP c1nc(C[NH2+][C@@H]2CCCCC23CC[NH2+]CC3)co1 ZINC000873232895 590003642 /nfs/dbraw/zinc/00/36/42/590003642.db2.gz QHNLPYCTVMXAFM-CYBMUJFWSA-N 2 0 249.358 2.077 20 0 BEADRP C[C@@H](CC1CCCC1)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873253072 590005021 /nfs/dbraw/zinc/00/50/21/590005021.db2.gz YVKPBDJNRBEJOC-WCFLWFBJSA-N 2 0 210.365 2.282 20 0 BEADRP F[C@@H]1CCCC[C@@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000873238932 590005103 /nfs/dbraw/zinc/00/51/03/590005103.db2.gz KHDGWJABAGFWOC-KTCIRNNBSA-N 2 0 226.339 2.140 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+][C@@H]1CCCC[C@@H]1F ZINC000873239402 590005450 /nfs/dbraw/zinc/00/54/50/590005450.db2.gz VLUIETFLJUKJDQ-WUHRBBMRSA-N 2 0 228.355 2.245 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]CC1CCC2(CC2)CC1 ZINC000873242752 590006500 /nfs/dbraw/zinc/00/65/00/590006500.db2.gz SDNKBWAEHSIUAR-CHWSQXEVSA-N 2 0 222.376 2.426 20 0 BEADRP CC(C)(C)[C@H]1CC[C@H]1[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873249232 590007596 /nfs/dbraw/zinc/00/75/96/590007596.db2.gz IYVYPYRDRDQZOZ-WHOHXGKFSA-N 2 0 210.365 2.138 20 0 BEADRP COc1ccsc1[C@@H](C)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873251730 590008788 /nfs/dbraw/zinc/00/87/88/590008788.db2.gz NTJFYBUVDLZSCI-BBBLOLIVSA-N 2 0 240.372 2.145 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccc2c(c1)COC2 ZINC000873253894 590009504 /nfs/dbraw/zinc/00/95/04/590009504.db2.gz GTXBIRLQFOKZSQ-HFAKWTLXSA-N 2 0 246.354 2.105 20 0 BEADRP CC[C@@H]1CCCC[C@@H]1[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873253169 590009512 /nfs/dbraw/zinc/00/95/12/590009512.db2.gz ZPZVJLJEDOIAMP-NDBYEHHHSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)=CCC[C@@H](C)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873254251 590009515 /nfs/dbraw/zinc/00/95/15/590009515.db2.gz ONHBJOZZTUNFHE-UPJWGTAASA-N 2 0 210.365 2.448 20 0 BEADRP CC[C@H]1CCC[C@@H]([NH2+]C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000873254276 590009752 /nfs/dbraw/zinc/00/97/52/590009752.db2.gz PDOFKFPQWFHYQJ-WUHRBBMRSA-N 2 0 210.365 2.282 20 0 BEADRP CCOc1cccc([C@@H](C)[NH2+]C[C@H]2C[C@@H]([NH3+])C2)c1 ZINC000873253844 590009821 /nfs/dbraw/zinc/00/98/21/590009821.db2.gz FZPQMXAXFBVJQM-BZPMIXESSA-N 2 0 248.370 2.473 20 0 BEADRP C[C@H](Cc1ccsc1)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873254851 590010054 /nfs/dbraw/zinc/01/00/54/590010054.db2.gz BWQRJWPLAXNLST-YUSALJHKSA-N 2 0 224.373 2.006 20 0 BEADRP COc1ccccc1[C@@H](C)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873255331 590010185 /nfs/dbraw/zinc/01/01/85/590010185.db2.gz GJHMFGMAHUEHCO-UTUOFQBUSA-N 2 0 234.343 2.083 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1cccc(F)c1F ZINC000873254894 590010376 /nfs/dbraw/zinc/01/03/76/590010376.db2.gz AQPZWAMSRXHWQJ-GUBZILKMSA-N 2 0 240.297 2.353 20 0 BEADRP Cc1ccsc1[C@H](C)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873254623 590010446 /nfs/dbraw/zinc/01/04/46/590010446.db2.gz YNPUKRBPBGDTCQ-GARJFASQSA-N 2 0 224.373 2.444 20 0 BEADRP CO[C@@H](c1ccccc1)[C@H](C)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873254963 590010449 /nfs/dbraw/zinc/01/04/49/590010449.db2.gz CISVZULNZXASCX-NZBPQXDJSA-N 2 0 248.370 2.090 20 0 BEADRP Cc1cc([C@H](C)[NH2+]C[C@H]2C[C@H]([NH3+])C2)oc1C ZINC000873256108 590010691 /nfs/dbraw/zinc/01/06/91/590010691.db2.gz KJIHFODGPKADQG-DLOVCJGASA-N 2 0 222.332 2.284 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+][C@@H]2CCC[C@@H](C3CC3)C2)C1 ZINC000873256301 590011636 /nfs/dbraw/zinc/01/16/36/590011636.db2.gz MZTNMQSFCSGLDH-FMKGYKFTSA-N 2 0 222.376 2.282 20 0 BEADRP COc1ccccc1[C@H](C)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873257264 590011757 /nfs/dbraw/zinc/01/17/57/590011757.db2.gz GJHMFGMAHUEHCO-SRVKXCTJSA-N 2 0 234.343 2.083 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1cccc(F)c1 ZINC000873257182 590011776 /nfs/dbraw/zinc/01/17/76/590011776.db2.gz FFWQOAVDNSBSMO-GIPNMCIBSA-N 2 0 222.307 2.214 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1cc(F)cc(F)c1 ZINC000873257049 590011804 /nfs/dbraw/zinc/01/18/04/590011804.db2.gz DOKOURWWYDXKNF-RVBZMBCESA-N 2 0 240.297 2.353 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccc(F)cc1F ZINC000873256934 590011828 /nfs/dbraw/zinc/01/18/28/590011828.db2.gz RGQYXANCHZUFMZ-ATZCPNFKSA-N 2 0 240.297 2.353 20 0 BEADRP Cc1ccccc1[C@H](C)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873257827 590012072 /nfs/dbraw/zinc/01/20/72/590012072.db2.gz XTLWVVMBXRNGEJ-RWMBFGLXSA-N 2 0 218.344 2.383 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)CC2 ZINC000873258182 590012104 /nfs/dbraw/zinc/01/21/04/590012104.db2.gz NNYHGUZDJDSHSZ-UXIGCNINSA-N 2 0 230.355 2.309 20 0 BEADRP COc1cccc([C@H](C)[NH2+]C[C@H]2C[C@@H]([NH3+])C2)c1 ZINC000873257691 590012107 /nfs/dbraw/zinc/01/21/07/590012107.db2.gz WOYCDPADLAYVPV-GMXVVIOVSA-N 2 0 234.343 2.083 20 0 BEADRP COc1cc(C)ccc1[C@@H](C)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873258148 590012262 /nfs/dbraw/zinc/01/22/62/590012262.db2.gz NCKCQZHCMGFLCY-JHJVBQTASA-N 2 0 248.370 2.392 20 0 BEADRP C[C@@H](CCc1ccccc1)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873258457 590012854 /nfs/dbraw/zinc/01/28/54/590012854.db2.gz QLNDHQJVCXOXDM-QEJZJMRPSA-N 2 0 232.371 2.335 20 0 BEADRP CCC[C@@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1cccnc1 ZINC000873258314 590013024 /nfs/dbraw/zinc/01/30/24/590013024.db2.gz QCCKILIJOQNEDW-MRVWCRGKSA-N 2 0 233.359 2.250 20 0 BEADRP CC[C@@H](Cc1ccccc1)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873258360 590013054 /nfs/dbraw/zinc/01/30/54/590013054.db2.gz OZMJYCGOCOFCKB-KKUMJFAQSA-N 2 0 232.371 2.335 20 0 BEADRP COc1cccc([C@H](C)[NH2+]C[C@H]2C[C@H]([NH3+])C2)c1 ZINC000873258949 590013157 /nfs/dbraw/zinc/01/31/57/590013157.db2.gz WOYCDPADLAYVPV-GVXVVHGQSA-N 2 0 234.343 2.083 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000873260419 590013497 /nfs/dbraw/zinc/01/34/97/590013497.db2.gz ZZJKJANNTOKETI-RGDJUOJXSA-N 2 0 222.376 2.295 20 0 BEADRP CCC[C@H](C)[NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000873260044 590013610 /nfs/dbraw/zinc/01/36/10/590013610.db2.gz QZRVDRCLGXPNBP-RVMXOQNASA-N 2 0 210.365 2.295 20 0 BEADRP CCC[C@@H](C)[NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000873260043 590013708 /nfs/dbraw/zinc/01/37/08/590013708.db2.gz QZRVDRCLGXPNBP-FVCCEPFGSA-N 2 0 210.365 2.295 20 0 BEADRP CC1(C)CC[C@H]1[NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000873262517 590014102 /nfs/dbraw/zinc/01/41/02/590014102.db2.gz ZPPOFKNHWQFZDN-YVECIDJPSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@@H]([NH2+][C@H](C)C1CC[NH2+]CC1)c1cncs1 ZINC000873268544 590015706 /nfs/dbraw/zinc/01/57/06/590015706.db2.gz WWZSYIFWLUGVDU-NXEZZACHSA-N 2 0 239.388 2.182 20 0 BEADRP CC[C@H]1CC[C@H]1[NH2+][C@@H](C)C1CC[NH2+]CC1 ZINC000873272243 590016312 /nfs/dbraw/zinc/01/63/12/590016312.db2.gz QUMXYHLBELIVNK-GMXVVIOVSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC=CC[C@H]1C(F)(F)F)C1C[NH2+]C1 ZINC000873273499 590016594 /nfs/dbraw/zinc/01/65/94/590016594.db2.gz HRLPKQXOXHUPNJ-FBIMIBRVSA-N 2 0 248.292 2.081 20 0 BEADRP COCC(C)(C)CC[NH2+][C@@H]1CCCCC[C@H]1[NH3+] ZINC000873281453 590018822 /nfs/dbraw/zinc/01/88/22/590018822.db2.gz JGBJQJBMCATYAT-CHWSQXEVSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@@H]1C[C@@H]2CCC[C@@H]2O1 ZINC000873282168 590018939 /nfs/dbraw/zinc/01/89/39/590018939.db2.gz QZDDNVDCFHOEOK-RFGFWPKPSA-N 2 0 240.391 2.051 20 0 BEADRP C1=CC[C@@H](C[NH2+]CCC[NH+]2CCCC2)CC1 ZINC000020129169 590077552 /nfs/dbraw/zinc/07/75/52/590077552.db2.gz VWNOVTRBLICBHP-CQSZACIVSA-N 2 0 222.376 2.418 20 0 BEADRP CN(CCC[NH+](C)C)C[C@H]1CC1(Cl)Cl ZINC000877521793 590345737 /nfs/dbraw/zinc/34/57/37/590345737.db2.gz DZTPNHCWAZQOEM-SECBINFHSA-N 2 0 239.190 2.064 20 0 BEADRP C[N@@H+]1CC[C@H]2C[NH+](CC3(C)CCC3)CC[C@@H]21 ZINC000877738386 590404933 /nfs/dbraw/zinc/40/49/33/590404933.db2.gz BIZNZLSLIKUGBS-STQMWFEESA-N 2 0 222.376 2.203 20 0 BEADRP CC(C)CC[N@@H+]1CC[C@H]2[C@@H](CC[NH+]2C)C1 ZINC000877740164 590406866 /nfs/dbraw/zinc/40/68/66/590406866.db2.gz IUCZJLMTGKADSU-STQMWFEESA-N 2 0 210.365 2.059 20 0 BEADRP c1cc(N2CC[NH+](CCCC3CC3)CC2)cc[nH+]1 ZINC000878191543 590520386 /nfs/dbraw/zinc/52/03/86/590520386.db2.gz RHZZHNPRZHQILD-UHFFFAOYSA-N 2 0 245.370 2.394 20 0 BEADRP C=C/C=C\CC[NH+]1CC[C@]2(CC[N@@H+](C)C2)C1 ZINC000878645265 590600328 /nfs/dbraw/zinc/60/03/28/590600328.db2.gz JEYUVGNBJYNHJE-WSNITJDQSA-N 2 0 220.360 2.146 20 0 BEADRP CCCC[N@H+](CCOC)CC1CC[NH+](C)CC1 ZINC000879123636 590699240 /nfs/dbraw/zinc/69/92/40/590699240.db2.gz HZZMGMPDSVRCHP-UHFFFAOYSA-N 2 0 242.407 2.077 20 0 BEADRP CC[NH+](CC)CCC[N@@H+]1C[C@@H](OC)CC[C@H]1C ZINC000879326837 590748286 /nfs/dbraw/zinc/74/82/86/590748286.db2.gz TZABLFFIELICBA-KGLIPLIRSA-N 2 0 242.407 2.218 20 0 BEADRP C[C@H]1C[N@H+](CC2CC2)CCN1c1cc[nH+]cc1 ZINC000880262965 590980910 /nfs/dbraw/zinc/98/09/10/590980910.db2.gz UPELAKCIZJIEFA-LBPRGKRZSA-N 2 0 231.343 2.002 20 0 BEADRP FC[C@H]1CC[N@H+](CCC[NH+]2CCCCC2)C1 ZINC000880298721 590993197 /nfs/dbraw/zinc/99/31/97/590993197.db2.gz IWVDPYXUEMHTKQ-CYBMUJFWSA-N 2 0 228.355 2.154 20 0 BEADRP CC[NH+](CC)CCC[N@@H+]1CC[C@H](CF)C1 ZINC000880298729 590993290 /nfs/dbraw/zinc/99/32/90/590993290.db2.gz JCLGAOYDOYBREA-GFCCVEGCSA-N 2 0 216.344 2.010 20 0 BEADRP CC1([NH+]2CCC2)CC[NH+](CC2CCC2)CC1 ZINC000880472889 591053640 /nfs/dbraw/zinc/05/36/40/591053640.db2.gz HJPWIDDOIQSCTQ-UHFFFAOYSA-N 2 0 222.376 2.347 20 0 BEADRP Fc1ccc(CC[NH2+][C@@H]2CCC[NH2+]CC2)cc1 ZINC000128840495 591165680 /nfs/dbraw/zinc/16/56/80/591165680.db2.gz ILBDOZGYUNRNRH-CQSZACIVSA-N 2 0 236.334 2.100 20 0 BEADRP C[NH2+][C@@H]1CCN(Cc2ccc(C3CC3)cc2)C1 ZINC000128899993 591176925 /nfs/dbraw/zinc/17/69/25/591176925.db2.gz NVTMKDWXXIZURB-OAHLLOKOSA-N 2 0 230.355 2.358 20 0 BEADRP Fc1ccc(C[NH2+][C@@H]2CCC[NH2+]CC2)cc1F ZINC000129194173 591267192 /nfs/dbraw/zinc/26/71/92/591267192.db2.gz ZSJZLWPMSZDDPU-LLVKDONJSA-N 2 0 240.297 2.197 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]C[C@@H]2C=CCC2)[C@@H](C)C1 ZINC000883247012 591588206 /nfs/dbraw/zinc/58/82/06/591588206.db2.gz XHBYMRZJMNKGCK-MJBXVCDLSA-N 2 0 222.376 2.273 20 0 BEADRP C=C/C=C\CC[NH2+][C@@H]1CC[N@@H+](CC)C[C@@H]1C ZINC000883267773 591601200 /nfs/dbraw/zinc/60/12/00/591601200.db2.gz POWNVQCDJDBCPQ-LAYDCRAFSA-N 2 0 222.376 2.439 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](CC[C@H]2CCCC2(F)F)C1 ZINC000883416949 591652472 /nfs/dbraw/zinc/65/24/72/591652472.db2.gz JLQUAGUJSRAHJX-NWDGAFQWSA-N 2 0 246.345 2.353 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](CC[C@@H]2CCCC2(F)F)C1 ZINC000883416950 591653086 /nfs/dbraw/zinc/65/30/86/591653086.db2.gz JLQUAGUJSRAHJX-RYUDHWBXSA-N 2 0 246.345 2.353 20 0 BEADRP [NH3+]C[C@H]1CCC[N@H+](CC[C@@H]2CCCC2(F)F)C1 ZINC000883416014 591653257 /nfs/dbraw/zinc/65/32/57/591653257.db2.gz JWNBXQTZFQLHBA-NEPJUHHUSA-N 2 0 246.345 2.483 20 0 BEADRP [NH3+]C[C@@H]1CCC[N@H+](CC[C@@H]2CCCC2(F)F)C1 ZINC000883416016 591653268 /nfs/dbraw/zinc/65/32/68/591653268.db2.gz JWNBXQTZFQLHBA-RYUDHWBXSA-N 2 0 246.345 2.483 20 0 BEADRP C=C/C=C/CC[N@@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1 ZINC000883429361 591660532 /nfs/dbraw/zinc/66/05/32/591660532.db2.gz SOXWCNWDZCMVTE-RYIMYRPNSA-N 2 0 234.387 2.440 20 0 BEADRP C=C/C=C\CC[NH+]1CCC([C@@H]2CC[NH2+]C2)CC1 ZINC000883427768 591660904 /nfs/dbraw/zinc/66/09/04/591660904.db2.gz BQRQXQMKTCIETN-ABCZVMIZSA-N 2 0 234.387 2.440 20 0 BEADRP CC(C)(C)[C@H](CN)[NH2+]C[C@H]1CCCC(C)(C)O1 ZINC000883430425 591662318 /nfs/dbraw/zinc/66/23/18/591662318.db2.gz VEVRHXQGZUIWJW-NEPJUHHUSA-N 2 0 242.407 2.297 20 0 BEADRP C[C@@]1(c2ccccc2)CCC[N@@H+]1CCC[NH3+] ZINC000883459540 591674719 /nfs/dbraw/zinc/67/47/19/591674719.db2.gz ALRGZYJKWRLORV-AWEZNQCLSA-N 2 0 218.344 2.346 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CCC[NH2+]C1)c1cccc(F)c1 ZINC000132027038 591683858 /nfs/dbraw/zinc/68/38/58/591683858.db2.gz QPXXIGZAUWEOEX-VXGBXAGGSA-N 2 0 236.334 2.476 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]C[C@@H]2CCCOC2)c2ccccc21 ZINC000132029602 591684683 /nfs/dbraw/zinc/68/46/83/591684683.db2.gz YXMMVVYDQGMHBT-NILFDRSVSA-N 2 0 246.354 2.147 20 0 BEADRP C(CCC[N@@H+]1C[C@@H]2C[C@@H]2C1)CC[NH+]1C[C@@H]2C[C@@H]2C1 ZINC000886344692 592213011 /nfs/dbraw/zinc/21/30/11/592213011.db2.gz JLZRAZCRVFIFNZ-GEEKYZPCSA-N 2 0 248.414 2.450 20 0 BEADRP CN(CC[C@H]1CCCC[N@@H+]1C)Cc1ccncc1 ZINC000075861534 592313427 /nfs/dbraw/zinc/31/34/27/592313427.db2.gz QKPKOOZXETWDJF-OAHLLOKOSA-N 2 0 247.386 2.388 20 0 BEADRP [NH3+][C@@]12CCC[C@H]1C[N@H+](CC[C@@H]1C[C@H]1C1CC1)C2 ZINC000886841409 592363508 /nfs/dbraw/zinc/36/35/08/592363508.db2.gz KNYZBHWIQPQYDY-CBBWQLFWSA-N 2 0 234.387 2.236 20 0 BEADRP [NH3+][C@]12CCC[C@@H]1C[N@H+](CC[C@@H]1C[C@H]1C1CC1)C2 ZINC000886841410 592364057 /nfs/dbraw/zinc/36/40/57/592364057.db2.gz KNYZBHWIQPQYDY-KBXIAJHMSA-N 2 0 234.387 2.236 20 0 BEADRP C[C@H]1CC[N@H+](CCC[NH3+])[C@@H]1c1ccccc1 ZINC000886857791 592369802 /nfs/dbraw/zinc/36/98/02/592369802.db2.gz ADBFLKNMYIMBQP-JSGCOSHPSA-N 2 0 218.344 2.418 20 0 BEADRP CC(C)C[N@@H+]1CCCC[C@]2(CC[NH2+]C2)C1 ZINC000886865792 592373965 /nfs/dbraw/zinc/37/39/65/592373965.db2.gz UWKJFILVHOKFLL-CYBMUJFWSA-N 2 0 210.365 2.108 20 0 BEADRP CC[C@@H](C)[N@@H+]1CCCC[C@@]2(CC[NH2+]C2)C1 ZINC000886874558 592376806 /nfs/dbraw/zinc/37/68/06/592376806.db2.gz QGGITXSBTYCGGS-OLZOCXBDSA-N 2 0 210.365 2.251 20 0 BEADRP CCC[N@@H+]1CCN(c2cc[nH+]cc2)C[C@H]1C ZINC000887130509 592449382 /nfs/dbraw/zinc/44/93/82/592449382.db2.gz FRQWYKDCZUTZCX-GFCCVEGCSA-N 2 0 219.332 2.002 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CCC2CCC2)[C@@H](C)C1 ZINC000222261986 592473334 /nfs/dbraw/zinc/47/33/34/592473334.db2.gz AQOKPWXPDOWZQA-JSGCOSHPSA-N 2 0 224.392 2.497 20 0 BEADRP C[N@H+](CCCCCCC[NH3+])C[C@@H]1CCCOC1 ZINC000104198771 592604835 /nfs/dbraw/zinc/60/48/35/592604835.db2.gz SIYYOOCEHGFMMO-AWEZNQCLSA-N 2 0 242.407 2.254 20 0 BEADRP CC(C)CCC[C@H](C)[N@H+](C)CCC[NH3+] ZINC000380284523 993325851 /nfs/dbraw/zinc/32/58/51/993325851.db2.gz ZRFINZGOTPSJNS-LBPRGKRZSA-N 2 0 200.370 2.482 20 0 BEADRP C[C@@H](C[NH2+][C@H]1CC[NH2+]C12CCC2)CC(F)F ZINC000925707240 634393884 /nfs/dbraw/zinc/39/38/84/634393884.db2.gz DPHFRXGCKSDVOH-ZJUUUORDSA-N 2 0 232.318 2.152 20 0 BEADRP C[C@@]1(CC[NH2+][C@@H]2CC[NH2+]C2(C)C)CC1(F)F ZINC000925707418 634396101 /nfs/dbraw/zinc/39/61/01/634396101.db2.gz IZCAMZMGEAOPFL-MWLCHTKSSA-N 2 0 232.318 2.152 20 0 BEADRP C[NH+](C)CCC[NH2+]CCc1ccc(F)c(F)c1 ZINC000124200707 634399117 /nfs/dbraw/zinc/39/91/17/634399117.db2.gz LOLKIDVHYUPGAK-UHFFFAOYSA-N 2 0 242.313 2.049 20 0 BEADRP C[C@@H]1SCC[C@@H]1[NH2+][C@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925713025 634415960 /nfs/dbraw/zinc/41/59/60/634415960.db2.gz RKWYQTZEAOKJIF-USZNOCQGSA-N 2 0 242.432 2.376 20 0 BEADRP C1[C@@H]2CC[C@@H]([NH2+][C@H]3CC[NH2+]C34CCC4)C[C@H]12 ZINC000925713490 634417577 /nfs/dbraw/zinc/41/75/77/634417577.db2.gz UDGLUPLZZVQYMY-RVMXOQNASA-N 2 0 220.360 2.049 20 0 BEADRP C/C=C/C[NH2+][C@@H]1CC[NH2+]C[C@@H]1C1CCCC1 ZINC000925720120 634458089 /nfs/dbraw/zinc/45/80/89/634458089.db2.gz WPZIOCUAPOHMQF-GWSUEFFPSA-N 2 0 222.376 2.320 20 0 BEADRP C[C@]1(C[NH2+][C@@H]2CC[NH2+]C23CCC3)C[C@H]2C[C@H]2C1 ZINC000925720579 634459749 /nfs/dbraw/zinc/45/97/49/634459749.db2.gz ZMWLQOYKTJHQTL-RQJABVFESA-N 2 0 234.387 2.297 20 0 BEADRP C[C@@H]1[C@H](C)SCC[N@@H+]1CC[C@H]1CCC[NH2+]C1 ZINC000253081554 634478723 /nfs/dbraw/zinc/47/87/23/634478723.db2.gz WKCYGPCGWMNDGQ-FRRDWIJNSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H]([NH2+]CC1(CC2CC2)CC1)[C@H]1CCC[NH2+]1 ZINC000925732776 634576863 /nfs/dbraw/zinc/57/68/63/634576863.db2.gz CXSIDBXUQAXEGK-DGCLKSJQSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CC1(C)CC(F)(F)C1 ZINC000925733865 634581585 /nfs/dbraw/zinc/58/15/85/634581585.db2.gz LVDDKGSWUGKXRV-RKDXNWHRSA-N 2 0 220.307 2.137 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CC(C)(C)CC(F)F ZINC000925734749 634583885 /nfs/dbraw/zinc/58/38/85/634583885.db2.gz UIVCKKJRYNJLIT-RKDXNWHRSA-N 2 0 222.323 2.383 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]CC1(C)CC(F)(F)C1 ZINC000925734727 634584038 /nfs/dbraw/zinc/58/40/38/634584038.db2.gz UHWUBWSEHUHDJB-MNOVXSKESA-N 2 0 246.345 2.400 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]CC1(C)CC(F)(F)C1 ZINC000925734725 634585726 /nfs/dbraw/zinc/58/57/26/634585726.db2.gz UHWUBWSEHUHDJB-GHMZBOCLSA-N 2 0 246.345 2.400 20 0 BEADRP CC(C)([NH3+])CC[NH2+][C@H]1CCCc2ccc(O)cc21 ZINC000925736578 634588896 /nfs/dbraw/zinc/58/88/96/634588896.db2.gz BTDXDFLXMYBNSM-AWEZNQCLSA-N 2 0 248.370 2.487 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CC[C@@H]1C[C@H]1C1CC1 ZINC000925803521 635352195 /nfs/dbraw/zinc/35/21/95/635352195.db2.gz ZKBWVPGRPFFGIF-YGNMPJRFSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CC[C@@H]1CC[C@@H]2C[C@@H]21 ZINC000925804571 635358992 /nfs/dbraw/zinc/35/89/92/635358992.db2.gz JUVYXUOLCGYYDX-JZRPKSSGSA-N 2 0 210.365 2.138 20 0 BEADRP c1ccc([C@@H]([NH2+][C@@H]2CCC[NH2+]CC2)C2CC2)nc1 ZINC000925821886 635398242 /nfs/dbraw/zinc/39/82/42/635398242.db2.gz KNTWSWLIEQYTNM-HIFRSBDPSA-N 2 0 245.370 2.264 20 0 BEADRP C[C@@H]1C[C@H]1[C@@H]1C[C@H]1[NH2+][C@@H]1CCCC[C@H]1C[NH3+] ZINC000925823010 635407084 /nfs/dbraw/zinc/40/70/84/635407084.db2.gz NNEVJDBMQBXZNT-QQOHENMQSA-N 2 0 222.376 2.138 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@H]1[C@@H]1C[C@H]1C)[C@H]1CCC[NH2+]C1 ZINC000925824387 635411186 /nfs/dbraw/zinc/41/11/86/635411186.db2.gz SIUPASGFAXNWGQ-GUDWOMEESA-N 2 0 222.376 2.009 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+]CCC1CC=CC1 ZINC000925829856 635462707 /nfs/dbraw/zinc/46/27/07/635462707.db2.gz AGTHMORLJRSJFO-GFCCVEGCSA-N 2 0 208.349 2.073 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCS[C@H](C)C1)[C@H]1CCC[NH2+]C1 ZINC000925862253 635559590 /nfs/dbraw/zinc/55/95/90/635559590.db2.gz ZDLQRAXBIWOTMY-MROQNXINSA-N 2 0 242.432 2.248 20 0 BEADRP CC1(C[NH2+]Cc2ccc(CC[NH3+])cc2)CC1 ZINC000232932360 635521025 /nfs/dbraw/zinc/52/10/25/635521025.db2.gz CFQKPBIYJLVIPG-UHFFFAOYSA-N 2 0 218.344 2.078 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C2CCC([NH3+])CC2)CCS1 ZINC000925861804 635555819 /nfs/dbraw/zinc/55/58/19/635555819.db2.gz STLQXENCRTXOOJ-HBIQZDMRSA-N 2 0 228.405 2.130 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCS[C@H](C)C1)[C@@H]1CCCC[NH2+]1 ZINC000925861586 635556128 /nfs/dbraw/zinc/55/61/28/635556128.db2.gz QJQXRVLDKSDYJN-LPWJVIDDSA-N 2 0 242.432 2.391 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCS[C@H](C)C1)[C@@H]1CCCC[NH2+]1 ZINC000925861590 635556875 /nfs/dbraw/zinc/55/68/75/635556875.db2.gz QJQXRVLDKSDYJN-XQHKEYJVSA-N 2 0 242.432 2.391 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCC[NH2+]CC2)CCS1 ZINC000925861456 635557656 /nfs/dbraw/zinc/55/76/56/635557656.db2.gz PWERUKIRXDZCEE-UTUOFQBUSA-N 2 0 228.405 2.002 20 0 BEADRP CSCCCCC[NH2+]CC1CC[NH+](C)CC1 ZINC000235134523 635565087 /nfs/dbraw/zinc/56/50/87/635565087.db2.gz LLCRYICSKMTGHN-UHFFFAOYSA-N 2 0 244.448 2.451 20 0 BEADRP COC[C@H](C[NH2+][C@H](C)CCCC[NH3+])C(C)C ZINC000925873890 635596404 /nfs/dbraw/zinc/59/64/04/635596404.db2.gz MVDACPMRFWJTDK-OLZOCXBDSA-N 2 0 230.396 2.012 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H](COC)C(C)C)[C@@H]1CCC[NH2+]1 ZINC000925874938 635596700 /nfs/dbraw/zinc/59/67/00/635596700.db2.gz XPNMCEPOFMBRRC-MJBXVCDLSA-N 2 0 242.407 2.025 20 0 BEADRP COC[C@@H](C[NH2+][C@H](C)[C@H]1CCCC[NH2+]1)C(C)C ZINC000925874412 635596708 /nfs/dbraw/zinc/59/67/08/635596708.db2.gz RKCNJGZZEZPBHY-MGPQQGTHSA-N 2 0 242.407 2.025 20 0 BEADRP C1=CCCC(C[NH2+][C@H]2[C@@H]3[NH2+]C[C@H]4C[C@H]2C[C@H]34)CC1 ZINC000925881001 635607859 /nfs/dbraw/zinc/60/78/59/635607859.db2.gz PJPMUJOBKYOXRL-ZVDSWSACSA-N 2 0 246.398 2.319 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+]CC1CCC=CCC1 ZINC000925881050 635608005 /nfs/dbraw/zinc/60/80/05/635608005.db2.gz QHAKXFFOFSODRZ-ZDUSSCGKSA-N 2 0 222.376 2.463 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+]CC1CCC=CCC1 ZINC000925881049 635608189 /nfs/dbraw/zinc/60/81/89/635608189.db2.gz QHAKXFFOFSODRZ-CYBMUJFWSA-N 2 0 222.376 2.463 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]Cc2cccc(C[NH+](C)C)c2)CO1 ZINC000647169848 631291735 /nfs/dbraw/zinc/29/17/35/631291735.db2.gz DHYMAJCLNAJWAM-DOMZBBRYSA-N 2 0 248.370 2.015 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@H](CC[NH3+])C2)cc1 ZINC000083008654 631417467 /nfs/dbraw/zinc/41/74/67/631417467.db2.gz JKIIACLVIPOKPQ-AWEZNQCLSA-N 2 0 218.344 2.166 20 0 BEADRP C[C@H]([NH2+]CCF)c1cccc(C[NH+](C)C)c1 ZINC000926347607 631727533 /nfs/dbraw/zinc/72/75/33/631727533.db2.gz GNYCKVLLDGBYEC-NSHDSACASA-N 2 0 224.323 2.368 20 0 BEADRP C[C@H]([NH2+]C1CCC([NH3+])CC1)c1cccc(O)c1 ZINC000051693266 631868909 /nfs/dbraw/zinc/86/89/09/631868909.db2.gz CRJVNXXERGUWMW-PKSQDBQZSA-N 2 0 234.343 2.313 20 0 BEADRP CCC1CC[NH+](CC[C@@H]2CCC[NH2+]C2)CC1 ZINC000051919114 632011676 /nfs/dbraw/zinc/01/16/76/632011676.db2.gz JQJQUYJUIDTQEN-AWEZNQCLSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H]([NH3+])CN(C)Cc1ccccc1C1CC1 ZINC000309406043 632049809 /nfs/dbraw/zinc/04/98/09/632049809.db2.gz IADABOFZTIUFDJ-LLVKDONJSA-N 2 0 218.344 2.343 20 0 BEADRP CC(C)C[C@H]([NH3+])C[N@H+]1C[C@@H]2CC=CC[C@@H]2C1 ZINC000309494670 632420441 /nfs/dbraw/zinc/42/04/41/632420441.db2.gz JTUQEPBBBSDWEN-MJBXVCDLSA-N 2 0 222.376 2.258 20 0 BEADRP C[C@@H]1CCC[C@@H](C[N@@H+]2CC[C@H](CC[NH3+])C2)C1 ZINC000309480280 632421226 /nfs/dbraw/zinc/42/12/26/632421226.db2.gz WNQIBEFJYSKGLK-HZSPNIEDSA-N 2 0 224.392 2.483 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CCC2CCC2)CC[N@@H+]1C ZINC000161867953 632439856 /nfs/dbraw/zinc/43/98/56/632439856.db2.gz NPOZMAIEMDPEAV-AAEUAGOBSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H](CN1CCC[C@@H](C)C1)[NH2+][C@H]1CC[C@@H]1C ZINC000309559210 632496378 /nfs/dbraw/zinc/49/63/78/632496378.db2.gz KNCXWROZMDEORD-RFGFWPKPSA-N 2 0 224.392 2.495 20 0 BEADRP CS[C@@H]1CCC[C@H]([NH2+]CCC[NH+](C)C)C1 ZINC000235229636 632565255 /nfs/dbraw/zinc/56/52/55/632565255.db2.gz MGLKCEMYSKLBBO-NWDGAFQWSA-N 2 0 230.421 2.202 20 0 BEADRP CSC1CC([NH2+]CC[C@H]2CCC[N@H+](C)C2)C1 ZINC000926571716 632569009 /nfs/dbraw/zinc/56/90/09/632569009.db2.gz AUGJBMXUFGNBMT-PNESKVBLSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H](C[NH2+]C[C@@H]1C[NH2+]C[C@H]1C)C(C)(C)C ZINC000235267267 632599200 /nfs/dbraw/zinc/59/92/00/632599200.db2.gz KMLOBVJFXADPJA-WOPDTQHZSA-N 2 0 212.381 2.114 20 0 BEADRP C[C@@H]1CC[C@H]1[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000309659483 632624058 /nfs/dbraw/zinc/62/40/58/632624058.db2.gz AOOMPMSHUJRNGS-BXUZGUMPSA-N 2 0 222.376 2.391 20 0 BEADRP [NH3+][C@@H](CC(F)F)C[N@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000309711909 632656314 /nfs/dbraw/zinc/65/63/14/632656314.db2.gz KIAMIWNVFQOLKM-AXFHLTTASA-N 2 0 232.318 2.091 20 0 BEADRP C[C@@H]1C[C@H](C[NH+]2CCCCCC2)CC[NH2+]1 ZINC000235367605 632680668 /nfs/dbraw/zinc/68/06/68/632680668.db2.gz FVAWEZGWWQQVMN-CHWSQXEVSA-N 2 0 210.365 2.251 20 0 BEADRP C[N@H+]1C[C@H]2CC[C@@H](C1)C2[NH2+]Cc1cccs1 ZINC000924557917 632840612 /nfs/dbraw/zinc/84/06/12/632840612.db2.gz VOQZATVHXDQHRA-QYJAPNMZSA-N 2 0 236.384 2.178 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@H](C)Cc1ccco1 ZINC000309352114 632963397 /nfs/dbraw/zinc/96/33/97/632963397.db2.gz MQHJDMCBJNITIU-VXGBXAGGSA-N 2 0 224.348 2.318 20 0 BEADRP CC(C)C[C@@H]([NH3+])C[N@H+]1C[C@@H]2CC=CC[C@@H]2C1 ZINC000309494667 633178598 /nfs/dbraw/zinc/17/85/98/633178598.db2.gz JTUQEPBBBSDWEN-HZSPNIEDSA-N 2 0 222.376 2.258 20 0 BEADRP C(C[N@@H+]1CCC2(CCCC2)C1)[C@@H]1CC[NH2+]C1 ZINC000304349938 635941519 /nfs/dbraw/zinc/94/15/19/635941519.db2.gz GIQALAPOGHJAQM-ZDUSSCGKSA-N 2 0 222.376 2.252 20 0 BEADRP C[C@@H]([NH2+]Cc1ccccc1)C1CC[NH2+]CC1 ZINC000306866601 635976276 /nfs/dbraw/zinc/97/62/76/635976276.db2.gz ODXCYRFKFMODGN-GFCCVEGCSA-N 2 0 218.344 2.164 20 0 BEADRP CCOc1cccc(C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)c1 ZINC000093214538 636046082 /nfs/dbraw/zinc/04/60/82/636046082.db2.gz YGBASGVGNRNHMI-KGLIPLIRSA-N 2 0 248.370 2.445 20 0 BEADRP C(C1CC[NH2+]CC1)[N@@H+]1CCC2(CCCC2)C1 ZINC000178972748 636047610 /nfs/dbraw/zinc/04/76/10/636047610.db2.gz YNMMRXWXAJFDSJ-UHFFFAOYSA-N 2 0 222.376 2.252 20 0 BEADRP C[C@@H](CC[NH2+]C1CC(CF)(CF)C1)[NH+](C)C ZINC000895292239 636131634 /nfs/dbraw/zinc/13/16/34/636131634.db2.gz NVJDFJMHTBPHJT-JTQLQIEISA-N 2 0 234.334 2.004 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2 ZINC000328566135 633776994 /nfs/dbraw/zinc/77/69/94/633776994.db2.gz MKQBBMCWFBZSNM-WGSKYGEUSA-N 2 0 222.376 2.007 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+]CC1(C[NH+](C)C)CCCC1 ZINC000309819609 633783950 /nfs/dbraw/zinc/78/39/50/633783950.db2.gz WAXVVIAZHZTLAZ-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP CSCCC[NH2+][C@@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925503468 633829037 /nfs/dbraw/zinc/82/90/37/633829037.db2.gz KLJRITHDHIYRFV-WDEREUQCSA-N 2 0 230.421 2.235 20 0 BEADRP CS[C@@H]1CC[C@@H]([NH2+][C@H]2CC[NH2+]C2(C)C)C1 ZINC000925523686 633896097 /nfs/dbraw/zinc/89/60/97/633896097.db2.gz NKYHCQJTJBZKJJ-MXWKQRLJSA-N 2 0 228.405 2.001 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2C[C@H]([NH3+])C23CCC3)cc1F ZINC000925524433 633900088 /nfs/dbraw/zinc/90/00/88/633900088.db2.gz TXNPJLKZVJPPGH-KBPBESRZSA-N 2 0 248.345 2.494 20 0 BEADRP C[C@H]([NH2+][C@H]1C[C@H]([NH3+])CC(C)(C)C1)C1CC1 ZINC000925586313 634091189 /nfs/dbraw/zinc/09/11/89/634091189.db2.gz CGQORXPWNNTIAZ-DLOVCJGASA-N 2 0 210.365 2.281 20 0 BEADRP CCC[C@@H]1C[C@H]1[NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2 ZINC000925603953 634133117 /nfs/dbraw/zinc/13/31/17/634133117.db2.gz GSEQXEHJIIULQA-DDHJBXDOSA-N 2 0 208.349 2.035 20 0 BEADRP Cc1ccc(CN(C)C[C@@H]([NH3+])CC(F)F)cc1 ZINC000310064257 634133732 /nfs/dbraw/zinc/13/37/32/634133732.db2.gz AQENFCPIFSGEOX-LBPRGKRZSA-N 2 0 242.313 2.409 20 0 BEADRP CO[C@H](C)C[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000925646308 634203808 /nfs/dbraw/zinc/20/38/08/634203808.db2.gz UWMOGFHKICNCJL-OCCSQVGLSA-N 2 0 236.359 2.091 20 0 BEADRP C[NH+](C)CCCCCCC[NH2+]Cc1cocn1 ZINC000192296846 634231335 /nfs/dbraw/zinc/23/13/35/634231335.db2.gz DAIJBMUAZJWPPK-UHFFFAOYSA-N 2 0 239.363 2.276 20 0 BEADRP C1CC2(C1)[NH2+]CC[C@@H]2[NH2+][C@H]1CC2CCC1CC2 ZINC000925675901 634263971 /nfs/dbraw/zinc/26/39/71/634263971.db2.gz HDWFSKYGQBKRSC-HOAMVYINSA-N 2 0 234.387 2.439 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[C@@H]([NH3+])CC(C)(C)C1)C1CC1 ZINC000925679436 634277555 /nfs/dbraw/zinc/27/75/55/634277555.db2.gz CGQORXPWNNTIAZ-YUSALJHKSA-N 2 0 210.365 2.281 20 0 BEADRP CCC1([NH2+][C@@H]2C[C@@H]([NH3+])CC(C)(C)C2)CC1 ZINC000925681344 634280625 /nfs/dbraw/zinc/28/06/25/634280625.db2.gz XGDLPOQJQDCATH-GHMZBOCLSA-N 2 0 210.365 2.425 20 0 BEADRP CC/C=C/C[NH2+][C@@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925682147 634285317 /nfs/dbraw/zinc/28/53/17/634285317.db2.gz UDDHKBIFAICJPP-IEVRTODYSA-N 2 0 210.365 2.448 20 0 BEADRP C[C@H](CC(C)(C)O)[NH2+][C@@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925682760 634287269 /nfs/dbraw/zinc/28/72/69/634287269.db2.gz ZRMXQAWCJZRGQZ-IJLUTSLNSA-N 2 0 242.407 2.032 20 0 BEADRP C1CC(C2([NH2+][C@H]3[C@@H]4[NH2+]C[C@H]5C[C@H]3C[C@H]45)CCC2)C1 ZINC000925684376 634294633 /nfs/dbraw/zinc/29/46/33/634294633.db2.gz ALCCQQFBTWQFEM-WPTOEGHWSA-N 2 0 246.398 2.295 20 0 BEADRP CC1(C)C[C@@H]1[NH2+][C@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925686366 634299691 /nfs/dbraw/zinc/29/96/91/634299691.db2.gz SGFKGORMAOLFTK-DCAQKATOSA-N 2 0 210.365 2.281 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+][C@@H]2CCCC[C@H]2F)C12CCC2 ZINC000925692839 634322697 /nfs/dbraw/zinc/32/26/97/634322697.db2.gz RJQSTMYYKJTBPJ-WYUUTHIRSA-N 2 0 226.339 2.127 20 0 BEADRP CCC[C@H]1CCC[C@@H]1[NH2+][C@@H]1C[NH2+]C[C@H]1C ZINC000925783892 635295996 /nfs/dbraw/zinc/29/59/96/635295996.db2.gz LPLJWZMIXUOPPZ-MROQNXINSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)CCC[N@@H+]1CC[C@@H](C[NH3+])[C@@H](C)C1 ZINC000221652133 635338051 /nfs/dbraw/zinc/33/80/51/635338051.db2.gz HAPWFINZTKCUBV-STQMWFEESA-N 2 0 212.381 2.339 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+][C@@H]1CCC12CCC2 ZINC000925802779 635352178 /nfs/dbraw/zinc/35/21/78/635352178.db2.gz IVKPLRRCSBSQTG-JHJVBQTASA-N 2 0 222.376 2.154 20 0 BEADRP CC[C@H]1CC[C@@H]1[NH2+]CC[C@@H]1C[NH2+]C[C@H]1C ZINC000925803826 635356228 /nfs/dbraw/zinc/35/62/28/635356228.db2.gz VZJOLUCHMYRHFO-XQHKEYJVSA-N 2 0 210.365 2.010 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+][C@H]2CCCOCC2)c2ccccc21 ZINC000261554996 635498501 /nfs/dbraw/zinc/49/85/01/635498501.db2.gz BEQSXUGPDHYSOC-GLQYFDAESA-N 2 0 246.354 2.290 20 0 BEADRP CCc1onc(C)c1C[NH2+][C@H](C)CCCC[NH3+] ZINC000925891380 635618153 /nfs/dbraw/zinc/61/81/53/635618153.db2.gz VFKRMHQEKBHUNJ-SNVBAGLBSA-N 2 0 239.363 2.153 20 0 BEADRP C[C@@H]1CCC[C@H](C[N@@H+]2C[C@@H]3CC[NH2+]C[C@@H]3C2)C1 ZINC000310527392 636265302 /nfs/dbraw/zinc/26/53/02/636265302.db2.gz PBRSWLKYCIBWOR-CBBWQLFWSA-N 2 0 236.403 2.354 20 0 BEADRP C[C@@H]1C[C@H]1C[NH+]1CCC([NH2+]C2CCC2)CC1 ZINC000897981648 636853510 /nfs/dbraw/zinc/85/35/10/636853510.db2.gz PPSNEHPVCQFYRW-NEPJUHHUSA-N 2 0 222.376 2.249 20 0 BEADRP C[N@H+](CC[C@H]1CC[NH2+]C1)Cc1ccccc1 ZINC000084384490 636875718 /nfs/dbraw/zinc/87/57/18/636875718.db2.gz FMLJZRITSJKSAH-CYBMUJFWSA-N 2 0 218.344 2.118 20 0 BEADRP COC(C)(C)CC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000322642865 636876595 /nfs/dbraw/zinc/87/65/95/636876595.db2.gz YOZFQHHKILDFFI-YHWZYXNKSA-N 2 0 240.391 2.016 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(F)cc1 ZINC000089139600 636904970 /nfs/dbraw/zinc/90/49/70/636904970.db2.gz YXLYJNRXNWEPQH-GXTWGEPZSA-N 2 0 236.334 2.433 20 0 BEADRP COCC[C@@H](C)[N@@H+]1CC[C@@](C[NH3+])(C(C)(C)C)C1 ZINC000866707719 636930712 /nfs/dbraw/zinc/93/07/12/636930712.db2.gz VSFVKUPGYMOCQR-OCCSQVGLSA-N 2 0 242.407 2.108 20 0 BEADRP CC1([NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)CC(F)(F)C1 ZINC000873197964 636976782 /nfs/dbraw/zinc/97/67/82/636976782.db2.gz WXFHROSEPOFNTE-WDEREUQCSA-N 2 0 244.329 2.391 20 0 BEADRP CCCC[NH2+]C1CC[NH+](CC(C)C)CC1 ZINC000128497767 637080796 /nfs/dbraw/zinc/08/07/96/637080796.db2.gz RDKNWJWSIQYSGZ-UHFFFAOYSA-N 2 0 212.381 2.497 20 0 BEADRP CCO[C@H]1CCC[N@H+](CCCCCC[NH3+])C1 ZINC000042425547 637243738 /nfs/dbraw/zinc/24/37/38/637243738.db2.gz XZJGFXAHRFVFPD-ZDUSSCGKSA-N 2 0 228.380 2.006 20 0 BEADRP CC[C@H](CSC)[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000902367211 637293942 /nfs/dbraw/zinc/29/39/42/637293942.db2.gz AQKXHOGJRJJBAA-NEPJUHHUSA-N 2 0 244.448 2.496 20 0 BEADRP CC[C@@H](CSC)[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000902367216 637294077 /nfs/dbraw/zinc/29/40/77/637294077.db2.gz AQKXHOGJRJJBAA-RYUDHWBXSA-N 2 0 244.448 2.496 20 0 BEADRP COc1cccc([C@H](C)[NH2+]C[C@@H]2C[NH2+]C[C@H]2C)c1 ZINC000903461606 637362249 /nfs/dbraw/zinc/36/22/49/637362249.db2.gz VOGZMVWJKOZONQ-DYEKYZERSA-N 2 0 248.370 2.201 20 0 BEADRP CC[C@@]1(C)CCC[N@H+](C[C@@H]2C[NH2+]C[C@H]2C)C1 ZINC000903438079 637362527 /nfs/dbraw/zinc/36/25/27/637362527.db2.gz QOOQGYKBXWHNJM-RDBSUJKOSA-N 2 0 224.392 2.354 20 0 BEADRP C([NH2+]C1(C2CCCCC2)CC1)C12CC(C1)C[NH2+]2 ZINC000904473325 637426357 /nfs/dbraw/zinc/42/63/57/637426357.db2.gz QZCQJOHRUPRUKJ-UHFFFAOYSA-N 2 0 234.387 2.441 20 0 BEADRP CC(C)([NH3+])c1ccc(NC[C@H]2C[C@@H]([NH3+])C2)cc1 ZINC000904477416 637427142 /nfs/dbraw/zinc/42/71/42/637427142.db2.gz VVFCQPKUSPVWMH-KLPPZKSPSA-N 2 0 233.359 2.030 20 0 BEADRP Cc1cc(C)c(C[NH2+]C2CC([NH3+])C2)cc1C ZINC000906508742 638181723 /nfs/dbraw/zinc/18/17/23/638181723.db2.gz XHVGQUKSIPANJZ-UHFFFAOYSA-N 2 0 218.344 2.191 20 0 BEADRP [NH3+]C1CC([NH2+][C@@H]2CC[C@@H](Cc3ccccc3)C2)C1 ZINC000906511067 638183845 /nfs/dbraw/zinc/18/38/45/638183845.db2.gz RTHCOXLWLZVHKK-JWMHWRSXSA-N 2 0 244.382 2.477 20 0 BEADRP [NH3+]C1CC([NH2+]Cc2csc3ccccc23)C1 ZINC000906510191 638184590 /nfs/dbraw/zinc/18/45/90/638184590.db2.gz QQWINBOQPRCADM-UHFFFAOYSA-N 2 0 232.352 2.481 20 0 BEADRP [NH3+]C1CC([NH2+]Cc2ccc(OCC3CC3)cc2)C1 ZINC000906511532 638185154 /nfs/dbraw/zinc/18/51/54/638185154.db2.gz ZPMLNHQQYDWGJS-UHFFFAOYSA-N 2 0 246.354 2.055 20 0 BEADRP CC[C@@H]1CCC[C@H](C[NH2+][C@H]2C[C@H]([NH3+])C2)C1 ZINC000906517741 638186902 /nfs/dbraw/zinc/18/69/02/638186902.db2.gz OKGWCNLKCSITTF-YVECIDJPSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+][C@H]2CCC[C@H](C(F)(F)F)C2)C1 ZINC000906518920 638187683 /nfs/dbraw/zinc/18/76/83/638187683.db2.gz UXARPYILYBLTDX-XKNYDFJKSA-N 2 0 236.281 2.187 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+][C@@H]2CCC[C@H](C(F)(F)F)C2)C1 ZINC000906518918 638187768 /nfs/dbraw/zinc/18/77/68/638187768.db2.gz UXARPYILYBLTDX-QEYWKRMJSA-N 2 0 236.281 2.187 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+][C@@H]2CC[C@H](Cc3ccccc3)C2)C1 ZINC000906518843 638187835 /nfs/dbraw/zinc/18/78/35/638187835.db2.gz RTHCOXLWLZVHKK-KLHDSHLOSA-N 2 0 244.382 2.477 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]C/C=C/c2ccc(F)cc2F)C1 ZINC000906517800 638187955 /nfs/dbraw/zinc/18/79/55/638187955.db2.gz RVKQAIGPFPXGOV-LEANHWHLSA-N 2 0 238.281 2.057 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]Cc2ccc(C(F)F)cc2)C1 ZINC000906519334 638189275 /nfs/dbraw/zinc/18/92/75/638189275.db2.gz YRQPSHVWACXCBO-XYPYZODXSA-N 2 0 226.270 2.204 20 0 BEADRP CCCC[NH2+]C[C@H]1CCCCN1C1CC1 ZINC000906527430 638191763 /nfs/dbraw/zinc/19/17/63/638191763.db2.gz JMYIZKRNHVTQNK-CYBMUJFWSA-N 2 0 210.365 2.393 20 0 BEADRP C[N@@H+]1CC[C@@]2(CC[NH+](CCCC(C)(F)F)C2)C1 ZINC000930554886 639810528 /nfs/dbraw/zinc/81/05/28/639810528.db2.gz JKEZHEKOCIUNHX-CYBMUJFWSA-N 2 0 246.345 2.449 20 0 BEADRP C[NH2+]CCCCC(=O)Nc1ccc([C@@H](C)[NH3+])cc1 ZINC000911844450 639854534 /nfs/dbraw/zinc/85/45/34/639854534.db2.gz GKFHPXSXTOZUQE-LLVKDONJSA-N 2 0 249.358 2.035 20 0 BEADRP C=C/C=C\CC[N@H+]1C[C@@]2(C)CN(C)C[C@@]2(C)C1 ZINC000931317182 640155115 /nfs/dbraw/zinc/15/51/15/640155115.db2.gz NLACSIXOKUIDSP-SRLDXXQCSA-N 2 0 234.387 2.392 20 0 BEADRP CN1C[C@]2(C)C[N@H+](CC3=CCCC3)C[C@]2(C)C1 ZINC000931318196 640156155 /nfs/dbraw/zinc/15/61/55/640156155.db2.gz SKECLPCYJSUJMG-GASCZTMLSA-N 2 0 234.387 2.370 20 0 BEADRP C[NH+](C)C1(C)CC[NH+](CCC2CC2)CC1 ZINC000931351241 640166916 /nfs/dbraw/zinc/16/69/16/640166916.db2.gz ILTPROQGUQPTNC-UHFFFAOYSA-N 2 0 210.365 2.203 20 0 BEADRP CC[C@@H](C)C[NH+]1CCC(C)([NH+](C)C)CC1 ZINC000931351301 640168089 /nfs/dbraw/zinc/16/80/89/640168089.db2.gz KQWHWQXNTQRKTN-GFCCVEGCSA-N 2 0 212.381 2.449 20 0 BEADRP C[N@@H+]1CC[C@@H]2C[NH+](CCC3CCC3)C[C@@H]2C1 ZINC000931442067 640200158 /nfs/dbraw/zinc/20/01/58/640200158.db2.gz SZZDAKHQYKGBMF-KGLIPLIRSA-N 2 0 222.376 2.060 20 0 BEADRP CC(C)C[C@H](C)[N@@H+]1C[C@@H]2CC[NH+](C)C[C@@H]2C1 ZINC000931435860 640202252 /nfs/dbraw/zinc/20/22/52/640202252.db2.gz DYCKRVVAAYYIBG-MELADBBJSA-N 2 0 224.392 2.305 20 0 BEADRP C[N@@H+]1CC[C@@H]2C[NH+](C[C@@H]3CC[C@H]4C[C@H]4C3)C[C@@H]2C1 ZINC000931441413 640204818 /nfs/dbraw/zinc/20/48/18/640204818.db2.gz HQTCRPQVXYEJBX-JKJDWNRSSA-N 2 0 248.414 2.306 20 0 BEADRP C[N@@H+]1CC[C@H]2CN(CCCC(C)(F)F)CC[C@H]21 ZINC000931545660 640268458 /nfs/dbraw/zinc/26/84/58/640268458.db2.gz GGMKZMFRSWBUER-NWDGAFQWSA-N 2 0 246.345 2.448 20 0 BEADRP C[C@H](C1CC1)[N@@H+]1CCN(c2cc[nH+]cc2)[C@H](C)C1 ZINC000931683200 640312360 /nfs/dbraw/zinc/31/23/60/640312360.db2.gz HKVUHGNJNLWFCL-CHWSQXEVSA-N 2 0 245.370 2.391 20 0 BEADRP COC(C)(C)C[C@H](C)[NH2+]CC1CC[NH+](C)CC1 ZINC000044515875 640398110 /nfs/dbraw/zinc/39/81/10/640398110.db2.gz WLKGNMWWYOSWMJ-LBPRGKRZSA-N 2 0 242.407 2.121 20 0 BEADRP CC(C)CCC[N@@H+]1CC[C@H](C[NH3+])[C@@H](C)C1 ZINC000165418726 640574525 /nfs/dbraw/zinc/57/45/25/640574525.db2.gz HAPWFINZTKCUBV-QWHCGFSZSA-N 2 0 212.381 2.339 20 0 BEADRP CC(C)[C@@H]1CC[N@H+](CCCCCC[NH3+])C1 ZINC000166308499 640627102 /nfs/dbraw/zinc/62/71/02/640627102.db2.gz CGIXYOLXWYMQEV-CYBMUJFWSA-N 2 0 212.381 2.483 20 0 BEADRP Clc1ccc(CC[NH2+]C2CC[NH2+]CC2)s1 ZINC000226354392 640750074 /nfs/dbraw/zinc/75/00/74/640750074.db2.gz QULVRCQZLWGSOP-UHFFFAOYSA-N 2 0 244.791 2.286 20 0 BEADRP C[N@@H+]1C[C@@H]2C[NH+](C[C@@H]3CC[C@@H]4C[C@@H]4C3)C[C@]2(C)C1 ZINC000933735357 640757061 /nfs/dbraw/zinc/75/70/61/640757061.db2.gz WDCMZXOVJIETGR-LJIZCISZSA-N 2 0 248.414 2.306 20 0 BEADRP C[N@@H+]1C[C@@H]2C[NH+](CC3CCCCC3)C[C@]2(C)C1 ZINC000933741744 640759730 /nfs/dbraw/zinc/75/97/30/640759730.db2.gz GMTWHMLDZNXKEQ-CABCVRRESA-N 2 0 236.403 2.450 20 0 BEADRP C[N@@H+]1C[C@@H]2C[NH+](CCC3CCCC3)C[C@]2(C)C1 ZINC000933740328 640759866 /nfs/dbraw/zinc/75/98/66/640759866.db2.gz JWFRWYJQOFPCDZ-CABCVRRESA-N 2 0 236.403 2.450 20 0 BEADRP C[C@H](c1ccccc1)[N@@H+]1CC[C@@H](CC[NH3+])C1 ZINC000227029880 640809729 /nfs/dbraw/zinc/80/97/29/640809729.db2.gz VUQMMBROUBKCLF-CHWSQXEVSA-N 2 0 218.344 2.418 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CC=CCC1 ZINC000227117099 640815342 /nfs/dbraw/zinc/81/53/42/640815342.db2.gz RBKJUNLGYOPURY-XQQFMLRXSA-N 2 0 208.349 2.202 20 0 BEADRP C(C[NH2+]C1CC1)C[N@@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC000227163053 640818295 /nfs/dbraw/zinc/81/82/95/640818295.db2.gz SAQRORBVPUHVOC-JSGCOSHPSA-N 2 0 222.376 2.393 20 0 BEADRP CCC(CC)C[N@@H+]1CC[C@@H](C[NH3+])[C@@H](C)C1 ZINC000227536054 640839018 /nfs/dbraw/zinc/83/90/18/640839018.db2.gz ROVTWRBUJWSQQL-AAEUAGOBSA-N 2 0 212.381 2.339 20 0 BEADRP Cc1ccsc1C[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000087309918 640870793 /nfs/dbraw/zinc/87/07/93/640870793.db2.gz WSTYEXKECHQCEZ-MNOVXSKESA-N 2 0 224.373 2.002 20 0 BEADRP CSCC[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000228874309 640901416 /nfs/dbraw/zinc/90/14/16/640901416.db2.gz SLYIQRRSMKKALE-WODVXLOZSA-N 2 0 242.432 2.343 20 0 BEADRP C[C@H]1CC([NH2+]C[C@@H]2CCC[NH2+]C2)C[C@H](C)C1 ZINC000087647413 640956222 /nfs/dbraw/zinc/95/62/22/640956222.db2.gz TZUOZLUVYYDJNY-JHJVBQTASA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H]1C[N@H+](CCCCCCC[NH3+])CCCO1 ZINC000061934494 641007780 /nfs/dbraw/zinc/00/77/80/641007780.db2.gz JGSWNNUCLIBVQT-ZDUSSCGKSA-N 2 0 228.380 2.006 20 0 BEADRP CO[C@H]1CCC[N@H+](CCCCCCC[NH3+])C1 ZINC000230314578 641047638 /nfs/dbraw/zinc/04/76/38/641047638.db2.gz JXEDVBUZGSBUSM-ZDUSSCGKSA-N 2 0 228.380 2.006 20 0 BEADRP CCC(C)(C)C[NH2+]CC1CC[NH+](C)CC1 ZINC000230655382 641072858 /nfs/dbraw/zinc/07/28/58/641072858.db2.gz ZAIIYSMSWXXZDQ-UHFFFAOYSA-N 2 0 212.381 2.354 20 0 BEADRP C[N@@H+]1CCC[C@H]1CC[NH+]1CC[C@@H]2CCC[C@@H]21 ZINC000934337386 641129510 /nfs/dbraw/zinc/12/95/10/641129510.db2.gz PUTUZLDFYPJWLU-IHRRRGAJSA-N 2 0 222.376 2.345 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]CCSC(F)(F)F)C1 ZINC000231938003 641218239 /nfs/dbraw/zinc/21/82/39/641218239.db2.gz DQKBVOCMSUDGCY-SFYZADRCSA-N 2 0 242.310 2.099 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@@H]([NH3+])C1)c1ccco1 ZINC000088169560 641320593 /nfs/dbraw/zinc/32/05/93/641320593.db2.gz KCAPPCITMXDBGX-HBNTYKKESA-N 2 0 208.305 2.200 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@@H]([NH3+])C1)c1ccco1 ZINC000088169561 641320919 /nfs/dbraw/zinc/32/09/19/641320919.db2.gz KCAPPCITMXDBGX-AXFHLTTASA-N 2 0 208.305 2.200 20 0 BEADRP COc1ccc(C[NH2+][C@H]2CCCC[C@@H]2C[NH3+])cc1 ZINC000089139322 641464318 /nfs/dbraw/zinc/46/43/18/641464318.db2.gz QWIFDXBIIXHNKU-HIFRSBDPSA-N 2 0 248.370 2.302 20 0 BEADRP COc1ccccc1[C@H](C)[NH2+][C@@H]1CCC[C@@H]1C[NH3+] ZINC000089147628 641466083 /nfs/dbraw/zinc/46/60/83/641466083.db2.gz MVYNUZRJFZVPOY-OUCADQQQSA-N 2 0 248.370 2.473 20 0 BEADRP Cc1cccc(OCC[NH2+][C@H]2CCC[C@@H]2C[NH3+])c1 ZINC000089150416 641476899 /nfs/dbraw/zinc/47/68/99/641476899.db2.gz QWXINCUIBFGYNY-HIFRSBDPSA-N 2 0 248.370 2.091 20 0 BEADRP CC[N@H+](CCCCCC[NH3+])C[C@@H]1CCCO1 ZINC000042471365 641552298 /nfs/dbraw/zinc/55/22/98/641552298.db2.gz UZBKENYOERYMOC-ZDUSSCGKSA-N 2 0 228.380 2.006 20 0 BEADRP CC(C)C(C)(C)C[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000232771961 641570466 /nfs/dbraw/zinc/57/04/66/641570466.db2.gz CXTMWBNQHWUSDM-GFCCVEGCSA-N 2 0 212.381 2.400 20 0 BEADRP [NH3+]CC[C@@H]1CC[N@H+](CCc2cccc(F)c2)C1 ZINC000075173798 641747543 /nfs/dbraw/zinc/74/75/43/641747543.db2.gz HZAFFMRSPGZBGP-CYBMUJFWSA-N 2 0 236.334 2.039 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+][C@@H]1CC[NH2+]C[C@@H]1C1CCCC1 ZINC000925472174 642392317 /nfs/dbraw/zinc/39/23/17/642392317.db2.gz AYURWSFHGMQMMW-NMFUWQPSSA-N 2 0 236.403 2.400 20 0 BEADRP CC[C@@H](C)C[NH2+]C[C@@H]1CCC[N@H+](CC)C1 ZINC000093066491 642454836 /nfs/dbraw/zinc/45/48/36/642454836.db2.gz KBXRDTDIEWVEPK-OLZOCXBDSA-N 2 0 212.381 2.354 20 0 BEADRP CC(C)C(C[NH+]1C[C@@H]2C[NH2+]C[C@H]2C1)C(C)C ZINC000304334339 642510191 /nfs/dbraw/zinc/51/01/91/642510191.db2.gz DRKIJHLHANNBRO-STQMWFEESA-N 2 0 224.392 2.066 20 0 BEADRP CCCCC[C@@H](C)[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000232963154 642640160 /nfs/dbraw/zinc/64/01/60/642640160.db2.gz ZXVCDXVBCKHZLU-UPJWGTAASA-N 2 0 212.381 2.400 20 0 BEADRP CC1(C[NH2+][C@H]2CCCC[C@@H]2C[NH3+])CCC1 ZINC000233027354 642646610 /nfs/dbraw/zinc/64/66/10/642646610.db2.gz WEZYVDQDMLRODJ-NEPJUHHUSA-N 2 0 210.365 2.284 20 0 BEADRP CCCC1(C[NH2+][C@@H]2CCC[C@H]2C[NH3+])CC1 ZINC000233035542 642647166 /nfs/dbraw/zinc/64/71/66/642647166.db2.gz IWCWAIAYNGSNEK-NWDGAFQWSA-N 2 0 210.365 2.284 20 0 BEADRP CCC1(C[NH2+][C@@H]2CCC[C@H]2C[NH3+])CCC1 ZINC000233089549 642652136 /nfs/dbraw/zinc/65/21/36/642652136.db2.gz RNHBYXAFBASJEN-NWDGAFQWSA-N 2 0 210.365 2.284 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CCC[N@H+](CCc2cccs2)C1 ZINC000069626981 642886099 /nfs/dbraw/zinc/88/60/99/642886099.db2.gz WXLONXVLPHPZOP-NWDGAFQWSA-N 2 0 238.400 2.350 20 0 BEADRP C[C@H]1C[NH+](CCCCCC[NH3+])C[C@H](C)S1 ZINC000069910033 642932094 /nfs/dbraw/zinc/93/20/94/642932094.db2.gz SQJHSOBCUBVQSX-RYUDHWBXSA-N 2 0 230.421 2.331 20 0 BEADRP C[N@H+](CCC[NH2+]C1CC1)CC1CCCC1 ZINC000082492324 643326668 /nfs/dbraw/zinc/32/66/68/643326668.db2.gz AATVMDMTQDKJFW-UHFFFAOYSA-N 2 0 210.365 2.251 20 0 BEADRP Cc1ccc(C[NH2+]C[C@@H]2C[NH2+]C[C@H]2C)s1 ZINC000082560824 643343113 /nfs/dbraw/zinc/34/31/13/643343113.db2.gz URIYFUKPLWXLKK-KOLCDFICSA-N 2 0 224.373 2.002 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH+]1CCCCCCC1 ZINC000082560346 643343573 /nfs/dbraw/zinc/34/35/73/643343573.db2.gz BEPPIOFOJOCALP-OLZOCXBDSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@H]([NH3+])C1CC[NH+](CCc2cccs2)CC1 ZINC000082602696 643352521 /nfs/dbraw/zinc/35/25/21/643352521.db2.gz SDHAJKBBZGVJKY-NSHDSACASA-N 2 0 238.400 2.350 20 0 BEADRP C[C@@H]1CCC[N@H+](C[C@@H]2CC[C@H]([NH3+])C2)[C@@H]1C ZINC000085015633 643522496 /nfs/dbraw/zinc/52/24/96/643522496.db2.gz JDPFGPJVSKQTER-LPWJVIDDSA-N 2 0 210.365 2.234 20 0 BEADRP C[NH2+]CCC[N@H+](C)[C@@H]1C[C@H]1c1ccccc1 ZINC000846222426 643650872 /nfs/dbraw/zinc/65/08/72/643650872.db2.gz OIEXAJXZUMXAEG-UONOGXRCSA-N 2 0 218.344 2.084 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CC=CCC1 ZINC000084221224 643651334 /nfs/dbraw/zinc/65/13/34/643651334.db2.gz NOGGAAPXNSETRA-AVGNSLFASA-N 2 0 208.349 2.060 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@@H](C[NH3+])C2)c(C)c1 ZINC000050245202 643655778 /nfs/dbraw/zinc/65/57/78/643655778.db2.gz KCRPIEWMJVFHQU-ZDUSSCGKSA-N 2 0 218.344 2.084 20 0 BEADRP CC[NH+](CC)C[C@H]([NH3+])CCC(C)(C)C ZINC000074212916 643656788 /nfs/dbraw/zinc/65/67/88/643656788.db2.gz JYMKTXBZZSDYDZ-LLVKDONJSA-N 2 0 200.370 2.482 20 0 BEADRP CSc1ccc(C[N@@H+]2CC[C@H](C[NH3+])C2)cc1 ZINC000050245420 643661588 /nfs/dbraw/zinc/66/15/88/643661588.db2.gz MNXUTDILRALDNX-GFCCVEGCSA-N 2 0 236.384 2.189 20 0 BEADRP [NH3+]C[C@H]1CCN(c2cc[nH+]c3ccccc32)C1 ZINC000050249968 643663930 /nfs/dbraw/zinc/66/39/30/643663930.db2.gz ZYEJQNJGRANOMI-LLVKDONJSA-N 2 0 227.311 2.020 20 0 BEADRP CC1(C)CC[NH+](C[C@@H]2CC[C@H]([NH3+])C2)CC1 ZINC000085015769 643678863 /nfs/dbraw/zinc/67/88/63/643678863.db2.gz FLVPTKSZTIYTJV-NEPJUHHUSA-N 2 0 210.365 2.236 20 0 BEADRP C[NH+]1CCC(C[NH+]2CCCCCC2)CC1 ZINC000058518324 643718052 /nfs/dbraw/zinc/71/80/52/643718052.db2.gz UPMLKYHTTKRVLC-UHFFFAOYSA-N 2 0 210.365 2.204 20 0 BEADRP C[N@H+](CCc1cccs1)CC(C)(C)C[NH3+] ZINC000086441664 644136523 /nfs/dbraw/zinc/13/65/23/644136523.db2.gz YMXMMLGOVHXMAI-UHFFFAOYSA-N 2 0 226.389 2.207 20 0 BEADRP CCC1CCC(C[NH2+][C@@H]2CC[NH2+]C2)CC1 ZINC000086728863 644171597 /nfs/dbraw/zinc/17/15/97/644171597.db2.gz OXLWLHIGXRSNPU-WXRRBKDZSA-N 2 0 210.365 2.154 20 0 BEADRP CC(C)CC[C@H](O)C[N@H+](C)CC[C@@H]([NH3+])C(C)C ZINC000923298990 644326244 /nfs/dbraw/zinc/32/62/44/644326244.db2.gz VWERRYRLOORYNW-UONOGXRCSA-N 2 0 244.423 2.089 20 0 BEADRP CCCCCC[C@@H](O)C[NH2+][C@](C)(C[NH3+])C(C)C ZINC000923296244 644335050 /nfs/dbraw/zinc/33/50/50/644335050.db2.gz PZESOZVGVUYMRA-ZIAGYGMSSA-N 2 0 244.423 2.281 20 0 BEADRP CCCCCC[C@@H](O)C[NH2+][C@@](C)(C[NH3+])C(C)C ZINC000923296242 644336210 /nfs/dbraw/zinc/33/62/10/644336210.db2.gz PZESOZVGVUYMRA-KGLIPLIRSA-N 2 0 244.423 2.281 20 0 BEADRP C[C@H](C1CC1)[N@H+](CCC[NH2+]C1CC1)C1CC1 ZINC000923305249 644342064 /nfs/dbraw/zinc/34/20/64/644342064.db2.gz LOLBATYFJSXILX-LLVKDONJSA-N 2 0 222.376 2.391 20 0 BEADRP C[C@@H]([NH3+])[C@@H]1CC[N@H+](CCc2cccc(F)c2)C1 ZINC000923333053 644353877 /nfs/dbraw/zinc/35/38/77/644353877.db2.gz SWWDHBFOGNKJMD-DGCLKSJQSA-N 2 0 236.334 2.037 20 0 BEADRP CCCCCC[C@@H](O)C[NH2+][C@@H]1CCCC[C@H]1[NH3+] ZINC000923383829 644397066 /nfs/dbraw/zinc/39/70/66/644397066.db2.gz MUDBCVAFYHMWNE-MGPQQGTHSA-N 2 0 242.407 2.177 20 0 BEADRP CCCCCC[C@H](O)C[N@@H+]1CC[C@H]([NH3+])C[C@H]1C ZINC000923392205 644398151 /nfs/dbraw/zinc/39/81/51/644398151.db2.gz IIOZYAKZXCMRGU-RDBSUJKOSA-N 2 0 242.407 2.129 20 0 BEADRP C[N@H+](CCC[NH2+]C1CC1)C[C@@H]1CC1(C)C ZINC000923398518 644404845 /nfs/dbraw/zinc/40/48/45/644404845.db2.gz UXQVMMLZWPDKBU-NSHDSACASA-N 2 0 210.365 2.106 20 0 BEADRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]CC1CCCCC1 ZINC000084218723 644419629 /nfs/dbraw/zinc/41/96/29/644419629.db2.gz HAWQQMUODBFYJD-OLZOCXBDSA-N 2 0 210.365 2.284 20 0 BEADRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]CC1CCCCC1 ZINC000084218720 644420594 /nfs/dbraw/zinc/42/05/94/644420594.db2.gz HAWQQMUODBFYJD-CHWSQXEVSA-N 2 0 210.365 2.284 20 0 BEADRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]CCC1CCCC1 ZINC000084219979 644420653 /nfs/dbraw/zinc/42/06/53/644420653.db2.gz SXANWZHUBKQYQH-OLZOCXBDSA-N 2 0 210.365 2.284 20 0 BEADRP Cc1ccccc1C[NH2+][C@H]1CCC[C@H]1C[NH3+] ZINC000084219939 644420956 /nfs/dbraw/zinc/42/09/56/644420956.db2.gz BMHLNQXEHZJINE-JSGCOSHPSA-N 2 0 218.344 2.212 20 0 BEADRP C=C/C=C/CC[N@@H+]1CC[C@H](C[NH3+])[C@@H](C)C1 ZINC000923488346 644462234 /nfs/dbraw/zinc/46/22/34/644462234.db2.gz DSKXQBGNUUTHQK-QITAHTHBSA-N 2 0 208.349 2.035 20 0 BEADRP C[C@@H]1C[N@H+](CCCC2CCC2)CC[C@@H]1C[NH3+] ZINC000923489760 644465854 /nfs/dbraw/zinc/46/58/54/644465854.db2.gz KQXDVSBYSVDLAU-TZMCWYRMSA-N 2 0 224.392 2.483 20 0 BEADRP COc1ccc(C[N@@H+]2CC[C@H](C[NH3+])[C@H](C)C2)cc1 ZINC000923499602 644472633 /nfs/dbraw/zinc/47/26/33/644472633.db2.gz TWWMEEUONJVDHO-TZMCWYRMSA-N 2 0 248.370 2.112 20 0 BEADRP C[C@H]1C[N@H+](CCc2cccs2)CC[C@H]1C[NH3+] ZINC000923497851 644473772 /nfs/dbraw/zinc/47/37/72/644473772.db2.gz MTEMXQLBVYMSRT-RYUDHWBXSA-N 2 0 238.400 2.207 20 0 BEADRP Cc1cccc(C[N@@H+]2CC[C@H](C[NH3+])[C@H](C)C2)c1 ZINC000923498722 644473957 /nfs/dbraw/zinc/47/39/57/644473957.db2.gz JJDHUWYLLHNXIQ-UKRRQHHQSA-N 2 0 232.371 2.412 20 0 BEADRP CC[NH+]1CCC([C@@H]2CCC[NH2+]CC2)CC1 ZINC000923507231 644474864 /nfs/dbraw/zinc/47/48/64/644474864.db2.gz JAYCTPSPZBIMTL-GFCCVEGCSA-N 2 0 210.365 2.108 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@@H](C[NH3+])[C@@H](C)C2)cc1 ZINC000923505096 644476225 /nfs/dbraw/zinc/47/62/25/644476225.db2.gz YEKFYGGMDFKZSR-ZFWWWQNUSA-N 2 0 232.371 2.412 20 0 BEADRP CC(C)[NH+]1CCC([C@@H]2CCC[NH2+]CC2)CC1 ZINC000923509986 644477986 /nfs/dbraw/zinc/47/79/86/644477986.db2.gz RXJABIAHZGVUJO-CYBMUJFWSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H](c1ccc(F)cc1)[N@@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1 ZINC000923517633 644479552 /nfs/dbraw/zinc/47/95/52/644479552.db2.gz GCOQTRXNNOHOSO-FPMFFAJLSA-N 2 0 248.345 2.428 20 0 BEADRP C(CC1CCCC1)C[N@@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1 ZINC000923518514 644482253 /nfs/dbraw/zinc/48/22/53/644482253.db2.gz MCKSDXMAFQAWIU-LSDHHAIUSA-N 2 0 236.403 2.498 20 0 BEADRP [NH3+]CCCCCCC[N@@H+]1CCCCC[C@H]1CO ZINC000923530424 644487884 /nfs/dbraw/zinc/48/78/84/644487884.db2.gz ISQRCYCTIMOCIT-AWEZNQCLSA-N 2 0 242.407 2.133 20 0 BEADRP CCc1ccccc1C[NH2+][C@H]1CCC[C@@H]1C[NH3+] ZINC000089150767 644535246 /nfs/dbraw/zinc/53/52/46/644535246.db2.gz BBSVNJKWVRTJMH-HIFRSBDPSA-N 2 0 232.371 2.466 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]CCOC1CCCC1 ZINC000089146428 644535923 /nfs/dbraw/zinc/53/59/23/644535923.db2.gz YYNFGMLVKSRGTA-GXTWGEPZSA-N 2 0 240.391 2.053 20 0 BEADRP CCc1ccccc1C[NH2+][C@@H]1CCC[C@H]1C[NH3+] ZINC000089150768 644536568 /nfs/dbraw/zinc/53/65/68/644536568.db2.gz BBSVNJKWVRTJMH-DZGCQCFKSA-N 2 0 232.371 2.466 20 0 BEADRP C[N@H+](CCOc1ccccc1)C1CCC([NH3+])CC1 ZINC000091847338 644642173 /nfs/dbraw/zinc/64/21/73/644642173.db2.gz VDAOIHXOSBVJJV-UHFFFAOYSA-N 2 0 248.370 2.267 20 0 BEADRP Cc1ccc(OCC[N@@H+]2CC[C@H]([NH3+])[C@H](C)C2)cc1 ZINC000094341896 644716206 /nfs/dbraw/zinc/71/62/06/644716206.db2.gz XKAZSVCGPVKIFB-HIFRSBDPSA-N 2 0 248.370 2.043 20 0 BEADRP [NH3+]C[C@@H]1CC[N@@H+]([C@H]2CCCc3ccccc32)C1 ZINC000250534546 644761904 /nfs/dbraw/zinc/76/19/04/644761904.db2.gz NWZIHPNDOZRZIH-WFASDCNBSA-N 2 0 230.355 2.345 20 0 BEADRP C[C@@H]1CCC[N@@H+]1CCC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000251554184 644808919 /nfs/dbraw/zinc/80/89/19/644808919.db2.gz AAWUXXYWQSWPDH-RLAWYHOSSA-N 2 0 222.376 2.391 20 0 BEADRP CC[C@@H]1C[N@H+](CCc2cccs2)CC[C@H]1[NH3+] ZINC000251572966 644810724 /nfs/dbraw/zinc/81/07/24/644810724.db2.gz BYLXOVIVYIJYOQ-DGCLKSJQSA-N 2 0 238.400 2.350 20 0 BEADRP CC[C@@H]1CCC[N@H+](CC[C@H]2CC[NH2+]C2)CC1 ZINC000251691232 644816264 /nfs/dbraw/zinc/81/62/64/644816264.db2.gz IJTWVYMJHXWYNI-ZIAGYGMSSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H]1C[N@H+](CCc2ccccc2)CC[C@H]1C[NH3+] ZINC000251855540 644828720 /nfs/dbraw/zinc/82/87/20/644828720.db2.gz RYAXDYAIASELGX-HIFRSBDPSA-N 2 0 232.371 2.146 20 0 BEADRP CC[C@H]1CCC[N@H+](CC[C@H]2CCC[NH2+]C2)C1 ZINC000251907038 644829884 /nfs/dbraw/zinc/82/98/84/644829884.db2.gz XKEBKRCVTQBFQV-UONOGXRCSA-N 2 0 224.392 2.498 20 0 BEADRP CCCC[N@H+](C)CCNC(=[NH2+])Nc1ccccc1 ZINC000304058279 644868694 /nfs/dbraw/zinc/86/86/94/644868694.db2.gz NGFLWVQSDWIDGA-UHFFFAOYSA-N 2 0 248.374 2.355 20 0 BEADRP CCC[C@@H](C)C[N@@H+]1CC[C@]2(CCC[NH2+]2)C1 ZINC000415135599 644886491 /nfs/dbraw/zinc/88/64/91/644886491.db2.gz GJNRDVJHXIPHDI-CHWSQXEVSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CC[N@H+](C[C@H]2CCC[C@@H](C)C2)C1 ZINC000252754390 644900230 /nfs/dbraw/zinc/90/02/30/644900230.db2.gz BBLMGAFLDVWLFC-ZOBORPQBSA-N 2 0 224.392 2.482 20 0 BEADRP C[NH+]1CCC(C[NH2+]C[C@@H]2CCCSC2)CC1 ZINC000304417694 644904723 /nfs/dbraw/zinc/90/47/23/644904723.db2.gz JHGKYHIYOCSZMQ-ZDUSSCGKSA-N 2 0 242.432 2.061 20 0 BEADRP C[NH+]1CCC(C[NH2+]C[C@H]2CCCSC2)CC1 ZINC000304417691 644905083 /nfs/dbraw/zinc/90/50/83/644905083.db2.gz JHGKYHIYOCSZMQ-CYBMUJFWSA-N 2 0 242.432 2.061 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H]2CCCSC2)C1 ZINC000252787537 644906483 /nfs/dbraw/zinc/90/64/83/644906483.db2.gz BBEPVTJNTYGMKM-OLZOCXBDSA-N 2 0 242.432 2.204 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H]2C[C@H]3C=C[C@@H]2CC3)C1 ZINC000926665424 645345601 /nfs/dbraw/zinc/34/56/01/645345601.db2.gz FDOURYDBSDDAAU-AHDPXTMNSA-N 2 0 234.387 2.271 20 0 BEADRP Cc1cccc(C[NH2+][C@H]2C[C@@H]([NH3+])CC(C)(C)C2)n1 ZINC000925485893 645429418 /nfs/dbraw/zinc/42/94/18/645429418.db2.gz PLCRAURXRLCTDL-OCCSQVGLSA-N 2 0 247.386 2.386 20 0 BEADRP C[C@@H]1C[C@H]1[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000925488164 645502853 /nfs/dbraw/zinc/50/28/53/645502853.db2.gz BRPDDJUPBHZCDH-MRVWCRGKSA-N 2 0 218.344 2.465 20 0 BEADRP CCCCOCCC[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000925491525 645541179 /nfs/dbraw/zinc/54/11/79/645541179.db2.gz VVQGJHLVERJMCT-ZDUSSCGKSA-N 2 0 240.391 2.067 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]C[C@]23C[C@H]2CCC3)CC[N@@H+]1C ZINC000927120138 645555730 /nfs/dbraw/zinc/55/57/30/645555730.db2.gz SSAGLKPLSSTXRY-CRWXNKLISA-N 2 0 222.376 2.249 20 0 BEADRP C[C@H]1C[C@H]([NH2+]C[C@]23C[C@H]2CCC3)CC[N@@H+]1C ZINC000927120141 645555803 /nfs/dbraw/zinc/55/58/03/645555803.db2.gz SSAGLKPLSSTXRY-DGAVXFQQSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@H](C[NH2+][C@@H](CCC[NH3+])c1ccccc1)N(C)C ZINC000925494605 645924273 /nfs/dbraw/zinc/92/42/73/645924273.db2.gz KPXMDYGPIKHYNU-HIFRSBDPSA-N 2 0 249.402 2.006 20 0 BEADRP [NH3+]CCC[C@@H]([NH2+]C1CC1)c1ccccc1 ZINC000925494890 645926181 /nfs/dbraw/zinc/92/61/81/645926181.db2.gz RVTIGDUVPLCQJO-CYBMUJFWSA-N 2 0 204.317 2.219 20 0 BEADRP CC1CC(C[NH+]2CCC([NH+](C)C)CC2)C1 ZINC000929264021 646045496 /nfs/dbraw/zinc/04/54/96/646045496.db2.gz PYHJUFXYJPNTPP-UHFFFAOYSA-N 2 0 210.365 2.059 20 0 BEADRP CCOCCC[NH2+][C@@H]1CCCN2CCCC[C@H]12 ZINC000924523937 646046498 /nfs/dbraw/zinc/04/64/98/646046498.db2.gz CZKZOSPZGDBHHA-ZIAGYGMSSA-N 2 0 240.391 2.020 20 0 BEADRP CC[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CCOC ZINC000924538033 646056605 /nfs/dbraw/zinc/05/66/05/646056605.db2.gz QZRGWGHCTFNZIQ-FUDCBSFHSA-N 2 0 240.391 2.016 20 0 BEADRP C[N@H+]1C[C@H]2CC[C@@H](C1)C2[NH2+]Cc1cccc(F)c1 ZINC000924610019 646076769 /nfs/dbraw/zinc/07/67/69/646076769.db2.gz OLBPRJYJFRQJTO-NNQSOWQGSA-N 2 0 248.345 2.256 20 0 BEADRP C[C@@H]1CC[C@@H](C)C1[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000924646782 646083068 /nfs/dbraw/zinc/08/30/68/646083068.db2.gz HGBYFLNIJIGYAC-JHJVBQTASA-N 2 0 236.403 2.495 20 0 BEADRP C[N@H+]1C[C@H]2CC[C@@H](C1)C2[NH2+]Cc1ccsc1 ZINC000924665902 646085507 /nfs/dbraw/zinc/08/55/07/646085507.db2.gz PVKDLVWHWUFWCC-FUNVUKJBSA-N 2 0 236.384 2.178 20 0 BEADRP C[C@@H]1CC[C@@H](C)C1[NH2+]CC1CC[NH+](C)CC1 ZINC000924963223 646145008 /nfs/dbraw/zinc/14/50/08/646145008.db2.gz JDEPNFOUADJGSE-VXGBXAGGSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H](NCCCNc1ccccn1)c1ncco1 ZINC000925232247 646216325 /nfs/dbraw/zinc/21/63/25/646216325.db2.gz LUIMFCABMZNGNS-LLVKDONJSA-N 2 0 246.314 2.222 20 0 BEADRP CC1CC(C[N@H+](C)C[C@H]2CCC[NH+](C)C2)C1 ZINC000929699106 646255724 /nfs/dbraw/zinc/25/57/24/646255724.db2.gz FKCHNSCKBIPQKD-MOKVOYLWSA-N 2 0 224.392 2.306 20 0 BEADRP CC1(C)C[C@@H]([NH3+])C[C@H]([NH2+]CC2CCC2)C1 ZINC000925487539 646296235 /nfs/dbraw/zinc/29/62/35/646296235.db2.gz WTLCYRRMMOPUAA-RYUDHWBXSA-N 2 0 210.365 2.282 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1NC[C@H]1Cc2ccccc21 ZINC000925490780 646300155 /nfs/dbraw/zinc/30/01/55/646300155.db2.gz OVTRTVVBCCDVPG-OCCSQVGLSA-N 2 0 230.355 2.056 20 0 BEADRP CSCC[NH2+][C@@H]1CC[NH2+]C[C@H]1C1CCCC1 ZINC000925501791 646303662 /nfs/dbraw/zinc/30/36/62/646303662.db2.gz CATFKPUCQAAHJL-QWHCGFSZSA-N 2 0 242.432 2.107 20 0 BEADRP CSCCC[NH2+][C@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C ZINC000925505855 646305734 /nfs/dbraw/zinc/30/57/34/646305734.db2.gz UEDLBMGMXLDDSO-WOPDTQHZSA-N 2 0 242.432 2.106 20 0 BEADRP CCO[C@@H](CC[NH2+][C@H]1CC[NH2+]C1(C)C)C(C)C ZINC000925526705 646317305 /nfs/dbraw/zinc/31/73/05/646317305.db2.gz KDKLDZSHVNVRHO-STQMWFEESA-N 2 0 242.407 2.168 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+]CCCOC1CCCC1 ZINC000925531724 646320274 /nfs/dbraw/zinc/32/02/74/646320274.db2.gz MMPUPVQXIOXVHO-ZDUSSCGKSA-N 2 0 240.391 2.066 20 0 BEADRP CC1(C)C[C@@H]([NH2+]CC[C@@H]2CCCO2)C[C@@H]([NH3+])C1 ZINC000925537670 646321175 /nfs/dbraw/zinc/32/11/75/646321175.db2.gz ZYPYMOBCBXRZJK-AGIUHOORSA-N 2 0 240.391 2.051 20 0 BEADRP C([NH2+][C@@H]1CC[NH2+]C12CCCC2)[C@H]1CCCS1 ZINC000925553542 646328878 /nfs/dbraw/zinc/32/88/78/646328878.db2.gz TZOVXHUKRDYFJP-VXGBXAGGSA-N 2 0 240.416 2.146 20 0 BEADRP COCCCC[NH2+][C@H](c1ccccc1)[C@H](C)N ZINC000925560565 646335373 /nfs/dbraw/zinc/33/53/73/646335373.db2.gz ZMNGFUMBILEYAQ-JSGCOSHPSA-N 2 0 236.359 2.091 20 0 BEADRP C1CC([NH2+][C@@H]2CC[NH2+]C[C@H]2C2CCCC2)C1 ZINC000925593394 646350681 /nfs/dbraw/zinc/35/06/81/646350681.db2.gz GGQBTUVBDVPIED-UONOGXRCSA-N 2 0 222.376 2.297 20 0 BEADRP CC1(C)C[C@H]([NH3+])C[C@@H]([NH2+]CCc2ccncc2)C1 ZINC000925614365 646362450 /nfs/dbraw/zinc/36/24/50/646362450.db2.gz IIVJUGHQEBYOGN-ZIAGYGMSSA-N 2 0 247.386 2.120 20 0 BEADRP CC1(C)C[C@@H]([NH3+])C[C@@H]([NH2+]Cc2ccoc2)C1 ZINC000925613583 646362644 /nfs/dbraw/zinc/36/26/44/646362644.db2.gz SVSQENVVJDKNKW-NWDGAFQWSA-N 2 0 222.332 2.275 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+]C[C@@H]1CC=CCC1 ZINC000925614818 646362685 /nfs/dbraw/zinc/36/26/85/646362685.db2.gz CPTKDIAOOOXRJE-NEPJUHHUSA-N 2 0 208.349 2.073 20 0 BEADRP CC1(C)C[C@@H]([NH2+]CCc2ccncc2)C[C@@H]([NH3+])C1 ZINC000925614360 646362920 /nfs/dbraw/zinc/36/29/20/646362920.db2.gz IIVJUGHQEBYOGN-KGLIPLIRSA-N 2 0 247.386 2.120 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+][C@H]1CC=CCC1 ZINC000925619480 646368534 /nfs/dbraw/zinc/36/85/34/646368534.db2.gz NYBKRNCMBJRICT-VZANTVGXSA-N 2 0 220.360 2.201 20 0 BEADRP C([NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2)C12CCC(CC1)C2 ZINC000925624985 646371918 /nfs/dbraw/zinc/37/19/18/646371918.db2.gz FJRBIPFOJONXDT-HPEWVIAJSA-N 2 0 246.398 2.153 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH+]1CCC([NH2+]C(C)C)CC1 ZINC000929960065 646379007 /nfs/dbraw/zinc/37/90/07/646379007.db2.gz AAXMCKJTJROABN-OLZOCXBDSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+][C@H]2CC[NH2+]C23CCCC3)C1 ZINC000925645357 646387226 /nfs/dbraw/zinc/38/72/26/646387226.db2.gz PXMVEHXUXOAJPJ-UPJWGTAASA-N 2 0 222.376 2.439 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]C[C@H]2CCC(F)(F)C2)C12CCC2 ZINC000925654651 646388905 /nfs/dbraw/zinc/38/89/05/646388905.db2.gz HAZJUJYYMUDWBV-AXFHLTTASA-N 2 0 244.329 2.281 20 0 BEADRP C[C@@H]1CCC[C@@H]1C[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000925656159 646393651 /nfs/dbraw/zinc/39/36/51/646393651.db2.gz VZBBZGHBNMTJBB-JHJVBQTASA-N 2 0 222.376 2.297 20 0 BEADRP COCC(C)(C)C[NH2+][C@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925674732 646405783 /nfs/dbraw/zinc/40/57/83/646405783.db2.gz SODMAPABABTTFM-RYUDHWBXSA-N 2 0 242.407 2.155 20 0 BEADRP CC(C)C1([NH2+][C@@H]2C[C@@H]([NH3+])C23CCC3)CC1 ZINC000925677472 646406896 /nfs/dbraw/zinc/40/68/96/646406896.db2.gz QLVNMPHADHMHLD-GHMZBOCLSA-N 2 0 208.349 2.035 20 0 BEADRP COCC[C@H](C)C[NH2+][C@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925685496 646413589 /nfs/dbraw/zinc/41/35/89/646413589.db2.gz JSKAQLHXTIXZDD-XQQFMLRXSA-N 2 0 242.407 2.155 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+]C[C@@H]1C[C@H]1C1CC1 ZINC000925688543 646414671 /nfs/dbraw/zinc/41/46/71/646414671.db2.gz DPWKXPQAJQGGAF-SDYRRRSWSA-N 2 0 234.387 2.138 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[NH2+]C1(C)C)CC(F)(F)F ZINC000925693373 646417587 /nfs/dbraw/zinc/41/75/87/646417587.db2.gz BMSISIRECDTRIC-DTWKUNHWSA-N 2 0 238.297 2.305 20 0 BEADRP C1CC12C[C@@H]2[NH2+][C@H]1CC[NH2+]C[C@H]1C1CCCC1 ZINC000925703478 646427222 /nfs/dbraw/zinc/42/72/22/646427222.db2.gz GEJBGHPKNCCJOV-IHRRRGAJSA-N 2 0 234.387 2.297 20 0 BEADRP CC1(C)[C@@H]([NH2+]CC2=CCCC2)[C@@H]2CCC[NH2+][C@@H]21 ZINC000925707040 646430846 /nfs/dbraw/zinc/43/08/46/646430846.db2.gz MZHTXAUPCVVPGU-RDBSUJKOSA-N 2 0 234.387 2.463 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+]CCCC1CCC1 ZINC000925712142 646437595 /nfs/dbraw/zinc/43/75/95/646437595.db2.gz WDLMLIFGNPLGMM-LBPRGKRZSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H](N)[C@H]([NH2+]CCCCCC[NH3+])c1ccccc1 ZINC000925713405 646437907 /nfs/dbraw/zinc/43/79/07/646437907.db2.gz RVWBYZXSLGEPPO-HIFRSBDPSA-N 2 0 249.402 2.184 20 0 BEADRP C[C@]1(C[NH2+][C@H]2CC[NH2+]C23CCC3)C[C@H]2C[C@H]2C1 ZINC000925720578 646446767 /nfs/dbraw/zinc/44/67/67/646446767.db2.gz ZMWLQOYKTJHQTL-RFQIPJPRSA-N 2 0 234.387 2.297 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+]CCC[C@@H]1C=CCC1 ZINC000925729651 646454795 /nfs/dbraw/zinc/45/47/95/646454795.db2.gz LGWNGMMLTCFGCN-CHWSQXEVSA-N 2 0 222.376 2.463 20 0 BEADRP CC(C)(C[NH2+][C@@H]1CCC[C@H]1C[NH3+])CC(F)F ZINC000925735363 646454842 /nfs/dbraw/zinc/45/48/42/646454842.db2.gz ZMIVAINKEQEYGS-VHSXEESVSA-N 2 0 234.334 2.385 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]CC2(CC3CC3)CC2)C1 ZINC000925732845 646455385 /nfs/dbraw/zinc/45/53/85/646455385.db2.gz DQVFBQITWUQHAC-STQMWFEESA-N 2 0 222.376 2.426 20 0 BEADRP CC1(C)C[C@@H]([NH2+]C[C@@H]2C=CCC2)C[C@@H]([NH3+])C1 ZINC000925732215 646456149 /nfs/dbraw/zinc/45/61/49/646456149.db2.gz PBPLTVPSXPFENY-UPJWGTAASA-N 2 0 222.376 2.448 20 0 BEADRP CC(C)(C[NH2+][C@H]1CCC[C@@H]1[NH3+])CC(F)F ZINC000925733906 646458723 /nfs/dbraw/zinc/45/87/23/646458723.db2.gz MUXAVZIMWOAAPR-IUCAKERBSA-N 2 0 220.307 2.137 20 0 BEADRP CCC1(CC)[C@@H]([NH2+]CCC(C)(C)[NH3+])C[C@@H]1OC ZINC000925740783 646462835 /nfs/dbraw/zinc/46/28/35/646462835.db2.gz LJRUNPXDCBVOAP-RYUDHWBXSA-N 2 0 242.407 2.297 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H]1C[C@@H]2CCCC[C@H]12 ZINC000925764974 646464273 /nfs/dbraw/zinc/46/42/73/646464273.db2.gz LDDICLGZNGSTJF-PJSNJIKXSA-N 2 0 210.365 2.281 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH+]1CCC([NH3+])(CC)CC1 ZINC000925759826 646464455 /nfs/dbraw/zinc/46/44/55/646464455.db2.gz MHJRXOHHMVLSRR-VXGBXAGGSA-N 2 0 210.365 2.378 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]1[NH2+][C@@H]1C[C@@H]2CCCC[C@H]12 ZINC000925763924 646467110 /nfs/dbraw/zinc/46/71/10/646467110.db2.gz DNZQDWXDGKXYHI-PJSNJIKXSA-N 2 0 208.349 2.035 20 0 BEADRP C[C@H]1CCNC[C@H]1[NH2+][C@@H]1C[C@@H]2CCCC[C@H]12 ZINC000925766990 646467959 /nfs/dbraw/zinc/46/79/59/646467959.db2.gz VVMXYDIAEFFGTG-QSLWVIQJSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]C[C@H]1CC2(CCC2)CO1 ZINC000925772507 646470023 /nfs/dbraw/zinc/47/00/23/646470023.db2.gz IINRCFQYYHTZBJ-QWHCGFSZSA-N 2 0 240.391 2.053 20 0 BEADRP CCC[C@H]([NH2+]C[C@@H]1C[NH2+]C[C@H]1C)c1cccnc1 ZINC000925783200 646479612 /nfs/dbraw/zinc/47/96/12/646479612.db2.gz DIXSIUJURZVBDD-SNPRPXQTSA-N 2 0 247.386 2.368 20 0 BEADRP CCC[C@H](C)[C@H](CC)[NH2+][C@@H]1C[NH2+]C[C@H]1C ZINC000925782228 646480005 /nfs/dbraw/zinc/48/00/05/646480005.db2.gz ITYCLHHQZYSIEA-QNWHQSFQSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@@H]1CCC[C@@H]2C[C@@]21C ZINC000925785210 646481238 /nfs/dbraw/zinc/48/12/38/646481238.db2.gz LTQQWZJMLKFQRR-ITGHMWBKSA-N 2 0 222.376 2.010 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@@H]1CCc2ccccc21 ZINC000925790907 646484354 /nfs/dbraw/zinc/48/43/54/646484354.db2.gz MZOQLMTZPAQCJR-OSAQELSMSA-N 2 0 230.355 2.119 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@H]1CCc2cc(F)ccc21 ZINC000925791456 646485280 /nfs/dbraw/zinc/48/52/80/646485280.db2.gz QCEQHCRRNGNXBX-GMXABZIVSA-N 2 0 248.345 2.258 20 0 BEADRP CC[C@H]1CCC[C@H]1[NH2+]CC[C@@H]1C[NH2+]C[C@H]1C ZINC000925795670 646485411 /nfs/dbraw/zinc/48/54/11/646485411.db2.gz HSYWLTLTDTYXDH-XJFOESAGSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@@H]1CCc2c1cccc2F ZINC000925793250 646485440 /nfs/dbraw/zinc/48/54/40/646485440.db2.gz XSDBOYLFEBTLND-JRPNMDOOSA-N 2 0 248.345 2.258 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+]C1[C@@H](C)CCC[C@@H]1C ZINC000925792137 646485448 /nfs/dbraw/zinc/48/54/48/646485448.db2.gz TZWUMYRGEHURIT-RVMXOQNASA-N 2 0 224.392 2.256 20 0 BEADRP CC[C@@H]([NH2+]CC[C@@H]1C[NH2+]C[C@H]1C)C(C)C ZINC000925798512 646486619 /nfs/dbraw/zinc/48/66/19/646486619.db2.gz LHXDCBGNJGMANY-JHJVBQTASA-N 2 0 212.381 2.256 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]C[C@@]12C[C@@H]1CCCC2 ZINC000925803379 646486657 /nfs/dbraw/zinc/48/66/57/646486657.db2.gz YQWLIZCYFRCOQN-ZDEQEGDKSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+][C@H]1CC[C@H]1C1CCC1 ZINC000925803805 646488562 /nfs/dbraw/zinc/48/85/62/646488562.db2.gz VSXNDJZJYFMAOE-RZFFKMDDSA-N 2 0 236.403 2.400 20 0 BEADRP c1ccc(C2(CC[NH2+]C3CC[NH2+]CC3)CC2)cc1 ZINC000925805466 646488657 /nfs/dbraw/zinc/48/86/57/646488657.db2.gz SYGJXNOFOZKRSN-UHFFFAOYSA-N 2 0 244.382 2.450 20 0 BEADRP C[C@H]([NH2+][C@H](c1ccccn1)C1CC1)[C@@H]1CC[NH2+]C1 ZINC000925822687 646496745 /nfs/dbraw/zinc/49/67/45/646496745.db2.gz NZBXBQRFZQMCTH-LNSITVRQSA-N 2 0 245.370 2.120 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@@H]([NH3+])C23CCC3)CCS1 ZINC000925857563 646511528 /nfs/dbraw/zinc/51/15/28/646511528.db2.gz HNMQXSJGEZPXDO-DDHJBXDOSA-N 2 0 240.416 2.130 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[NH2+]CC2)CCS1 ZINC000925861454 646514111 /nfs/dbraw/zinc/51/41/11/646514111.db2.gz PWERUKIRXDZCEE-GRYCIOLGSA-N 2 0 228.405 2.002 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCS[C@H](C)C1)[C@H]1CCC[NH2+]1 ZINC000925862240 646514843 /nfs/dbraw/zinc/51/48/43/646514843.db2.gz YPARFCYHLDQACE-WRWGMCAJSA-N 2 0 228.405 2.001 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)CCS1 ZINC000925861162 646514963 /nfs/dbraw/zinc/51/49/63/646514963.db2.gz NRMLSHJZLLYJLP-HENWMNBSSA-N 2 0 240.416 2.143 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCS[C@H](C)C1)[C@H]1CCC[NH2+]1 ZINC000925862234 646515176 /nfs/dbraw/zinc/51/51/76/646515176.db2.gz YPARFCYHLDQACE-DDHJBXDOSA-N 2 0 228.405 2.001 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCSC2(CCC2)C1)C1C[NH2+]C1 ZINC000925862078 646515337 /nfs/dbraw/zinc/51/53/37/646515337.db2.gz XNYDVKRKQSGNPZ-CMPLNLGQSA-N 2 0 240.416 2.002 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@H]1CCCc2cccnc21 ZINC000925871675 646522204 /nfs/dbraw/zinc/52/22/04/646522204.db2.gz DKFLBYSPMJICBX-GVXVVHGQSA-N 2 0 233.359 2.174 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@H]1CCCc2cccnc21 ZINC000925871676 646522724 /nfs/dbraw/zinc/52/27/24/646522724.db2.gz DKFLBYSPMJICBX-LOWVWBTDSA-N 2 0 233.359 2.174 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+][C@H]2CCCc3cccnc32)C1 ZINC000925871773 646523872 /nfs/dbraw/zinc/52/38/72/646523872.db2.gz HDHFVTKIZIWUNC-MJBXVCDLSA-N 2 0 245.370 2.319 20 0 BEADRP COC[C@H](C[NH2+][C@H]1CCCC[C@@H]1C[NH3+])C(C)C ZINC000925875112 646525671 /nfs/dbraw/zinc/52/56/71/646525671.db2.gz ZRAWAQILYCUPEK-RDBSUJKOSA-N 2 0 242.407 2.012 20 0 BEADRP C[C@H](Cc1cccs1)[NH2+]C[C@@H]1CC[C@H]([NH3+])C1 ZINC000925876794 646527540 /nfs/dbraw/zinc/52/75/40/646527540.db2.gz ILPNKONKAMBHRR-UTUOFQBUSA-N 2 0 238.400 2.396 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CC[C@H]([NH3+])C1)C1CCSCC1 ZINC000925882517 646531147 /nfs/dbraw/zinc/53/11/47/646531147.db2.gz NYJORFVMIREFHP-LOWVWBTDSA-N 2 0 242.432 2.235 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]C[C@]23C[C@H]2CCC3)C1 ZINC000925880976 646531733 /nfs/dbraw/zinc/53/17/33/646531733.db2.gz OUNGAGPKROCGPB-LPWJVIDDSA-N 2 0 208.349 2.036 20 0 BEADRP C[C@H]([NH2+]CC1CCC=CCC1)[C@H]1CC[NH2+]C1 ZINC000925882188 646531757 /nfs/dbraw/zinc/53/17/57/646531757.db2.gz ZAOBKIBRRGIIHT-JSGCOSHPSA-N 2 0 222.376 2.320 20 0 BEADRP CCN1C[C@H]([NH2+][C@@H]2C[C@H]3C=C[C@@H]2CC3)[C@@H](C)C1 ZINC000925929240 646544089 /nfs/dbraw/zinc/54/40/89/646544089.db2.gz LGMPFIHNDFYKRX-AHDPXTMNSA-N 2 0 234.387 2.271 20 0 BEADRP CC[C@H](C[C@](C)(O)CC)[NH2+]C[C@@H](C)C[NH+](C)C ZINC000926473699 646653632 /nfs/dbraw/zinc/65/36/32/646653632.db2.gz NFBPHRKEVWFKTC-MGPQQGTHSA-N 2 0 244.423 2.103 20 0 BEADRP [NH3+]CCCCCCC[N@@H+]1CC[C@@H]2OCC[C@@H]2C1 ZINC000724813962 711616484 /nfs/dbraw/zinc/61/64/84/711616484.db2.gz CBDRMSNGIOQGCR-KGLIPLIRSA-N 2 0 240.391 2.006 20 0 BEADRP CC(C)(C)C[NH2+]C[C@@H](N)c1ccccc1 ZINC000040494967 711691752 /nfs/dbraw/zinc/69/17/52/711691752.db2.gz GIFQCMZMVPUIKX-GFCCVEGCSA-N 2 0 206.333 2.322 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@@H+]1CC[C@@H](C)C[C@@H](C)C1 ZINC000723780134 711730912 /nfs/dbraw/zinc/73/09/12/711730912.db2.gz PTEQQKUEBOMIKS-SYQHCUMBSA-N 2 0 224.392 2.210 20 0 BEADRP C[C@@H]1CCCC[N@H+](CCC[NH2+]C2CC2)C1 ZINC000703659606 712083090 /nfs/dbraw/zinc/08/30/90/712083090.db2.gz BAQDEUCIOQZFBR-GFCCVEGCSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CCSC1)[C@@H]1CCC[NH2+]C1 ZINC000704810571 712118214 /nfs/dbraw/zinc/11/82/14/712118214.db2.gz BVJYLNBTCSCION-YNEHKIRRSA-N 2 0 242.432 2.107 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]CCC2(F)CCC2)C12CCC2 ZINC000705282018 712126919 /nfs/dbraw/zinc/12/69/19/712126919.db2.gz XINIDPRJMIMLHU-GHMZBOCLSA-N 2 0 226.339 2.128 20 0 BEADRP CSC1CC([NH2+][C@H]2CC[N@@H+]3CCCC[C@@H]23)C1 ZINC000706929184 712161459 /nfs/dbraw/zinc/16/14/59/712161459.db2.gz OTPLVKLXKORXCO-TYUFSLCMSA-N 2 0 240.416 2.097 20 0 BEADRP CSCC[C@H](C)[NH2+][C@H](C)CCCC[NH3+] ZINC000379517226 712387128 /nfs/dbraw/zinc/38/71/28/712387128.db2.gz AWOVBJBKLUNYPO-MNOVXSKESA-N 2 0 218.410 2.235 20 0 BEADRP CC[C@H]1CCCN(C[C@H]([NH3+])CC(F)F)C1 ZINC000379783115 712398723 /nfs/dbraw/zinc/39/87/23/712398723.db2.gz GUGLZUIIEOBDGJ-VHSXEESVSA-N 2 0 220.307 2.091 20 0 BEADRP C[C@@H]1C[C@H]([NH3+])CC[N@@H+]1C[C@@H]1CCC(C)(C)CO1 ZINC000713583874 712466134 /nfs/dbraw/zinc/46/61/34/712466134.db2.gz BITKUTMHQNPWJR-UPJWGTAASA-N 2 0 240.391 2.003 20 0 BEADRP CC1([NH3+])CC[NH+](C[C@@H]2CCCC(C)(C)O2)CC1 ZINC000714329791 712482246 /nfs/dbraw/zinc/48/22/46/712482246.db2.gz JXYSQHXHUREXQT-LBPRGKRZSA-N 2 0 240.391 2.147 20 0 BEADRP C[C@H]1C[C@@H]1C[NH2+]C1CCC(C)([NH+](C)C)CC1 ZINC000715491938 712522770 /nfs/dbraw/zinc/52/27/70/712522770.db2.gz RIBJFLZSAVSULW-MRFVTOPCSA-N 2 0 224.392 2.495 20 0 BEADRP FC1(F)CC[NH2+]C[C@@H]1C[NH2+]C(C1CC1)C1CC1 ZINC000717318653 712646631 /nfs/dbraw/zinc/64/66/31/712646631.db2.gz YQTDDMOWWRQHJN-LLVKDONJSA-N 2 0 244.329 2.009 20 0 BEADRP CC[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)C(C)C ZINC000037485283 712650936 /nfs/dbraw/zinc/65/09/36/712650936.db2.gz PMMGYGRRPBRKBX-OCCSQVGLSA-N 2 0 224.392 2.495 20 0 BEADRP CC[C@@H](C)C[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000037485293 712650736 /nfs/dbraw/zinc/65/07/36/712650736.db2.gz GBTOSBZJTUUTDM-NEPJUHHUSA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)C[C@H](C)[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000037485328 712650774 /nfs/dbraw/zinc/65/07/74/712650774.db2.gz LVIOGPRFNAMSPW-STQMWFEESA-N 2 0 224.392 2.495 20 0 BEADRP C[N@@H+]1CCC[C@@H]1CC[NH2+]C1(C2CC2)CCC1 ZINC000717834469 712686587 /nfs/dbraw/zinc/68/65/87/712686587.db2.gz AWKYOMLHJQWUCX-CYBMUJFWSA-N 2 0 222.376 2.393 20 0 BEADRP CCCCCC[N@@H+]1CC[C@@H]2[NH2+]CC[C@H]2C1 ZINC000389566979 712689536 /nfs/dbraw/zinc/68/95/36/712689536.db2.gz AINDVNALZLHTGO-STQMWFEESA-N 2 0 210.365 2.251 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@H]1[NH2+]CCCC[NH+](C)C ZINC000380189189 712708456 /nfs/dbraw/zinc/70/84/56/712708456.db2.gz HDHSUDCJDKSGAM-ITGUQSILSA-N 2 0 212.381 2.352 20 0 BEADRP CO[C@@H]1CCC[C@H]([NH2+][C@H](C)CC[NH+](C)C)CC1 ZINC000718838910 712785060 /nfs/dbraw/zinc/78/50/60/712785060.db2.gz BZQLMEKTMDCAIO-HZSPNIEDSA-N 2 0 242.407 2.264 20 0 BEADRP CO[C@@H]1CCC[C@H]([NH2+]C[C@@H](C)C[NH+](C)C)CC1 ZINC000718845830 712786030 /nfs/dbraw/zinc/78/60/30/712786030.db2.gz XJVJNUBIDHMDND-HZSPNIEDSA-N 2 0 242.407 2.121 20 0 BEADRP CC1(C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)CC(F)(F)C1 ZINC000720922319 712879031 /nfs/dbraw/zinc/87/90/31/712879031.db2.gz HXPOIQNFBLIPHB-ZACCUICWSA-N 2 0 244.329 2.294 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+]Cc1ccccc1 ZINC000722519268 710713605 /nfs/dbraw/zinc/71/36/05/710713605.db2.gz DVJVHRLMMJJKEN-TZMCWYRMSA-N 2 0 218.344 2.022 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1C[NH2+]C[C@H]1C)c1nccs1 ZINC000722511596 710714618 /nfs/dbraw/zinc/71/46/18/710714618.db2.gz AMDGGJCIRNBFRE-GMTAPVOTSA-N 2 0 239.388 2.039 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1CCC[C@H](CC[NH3+])C1 ZINC000723075312 710725237 /nfs/dbraw/zinc/72/52/37/710725237.db2.gz APBFFVOJZHZJCN-UPJWGTAASA-N 2 0 210.365 2.093 20 0 BEADRP C[NH+]1CCC(C[NH2+]C[C@H]2CCCC2(F)F)CC1 ZINC000381937990 710759975 /nfs/dbraw/zinc/75/99/75/710759975.db2.gz QKFREHLBAHIGGB-GFCCVEGCSA-N 2 0 246.345 2.353 20 0 BEADRP C[N@H+](CCC[NH3+])C[C@H]1CC2CCC1CC2 ZINC000382055188 710770126 /nfs/dbraw/zinc/77/01/26/710770126.db2.gz GRJXINBOFFJJAH-WXRRBKDZSA-N 2 0 210.365 2.093 20 0 BEADRP C[C@H](C[N@@H+]1CC[C@H](CC[NH3+])C1)c1ccccc1 ZINC000385182921 711006608 /nfs/dbraw/zinc/00/66/08/711006608.db2.gz PIJJKLZRHSZHHV-KGLIPLIRSA-N 2 0 232.371 2.461 20 0 BEADRP CC1CCC(C[NH2+][C@H]2[C@@H]3[NH2+]C[C@@H]4C[C@H]2C[C@@H]43)CC1 ZINC000385514713 711014350 /nfs/dbraw/zinc/01/43/50/711014350.db2.gz NXSGCMTXMTUIAX-KNFZOUACSA-N 2 0 248.414 2.399 20 0 BEADRP C[C@@H]1CCSCC[N@@H+]1C[C@]1(C)CCC[NH2+]C1 ZINC000385583959 711014771 /nfs/dbraw/zinc/01/47/71/711014771.db2.gz XYKQVEMFCLBLRE-CHWSQXEVSA-N 2 0 242.432 2.204 20 0 BEADRP CC(C)(C)CCC[N@@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1 ZINC000380710497 712902663 /nfs/dbraw/zinc/90/26/63/712902663.db2.gz MXWMNSYPJAHOHP-QWHCGFSZSA-N 2 0 224.392 2.354 20 0 BEADRP CCCN(CC)C[C@H](C)[NH2+][C@H]1CC[C@H]1C ZINC000389869000 711093923 /nfs/dbraw/zinc/09/39/23/711093923.db2.gz IIDFIMMUBBCNDG-AGIUHOORSA-N 2 0 212.381 2.495 20 0 BEADRP CC(F)(F)CCC[NH2+][C@H]1CC[NH2+]CC1(C)C ZINC000390080275 711104376 /nfs/dbraw/zinc/10/43/76/711104376.db2.gz BFQXENSNLULCOM-JTQLQIEISA-N 2 0 234.334 2.400 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[C@H]1C)C[NH+]1CCCCC1 ZINC000390459377 711118984 /nfs/dbraw/zinc/11/89/84/711118984.db2.gz BLSZFNDEDZPRQJ-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)C1(C)CC1)C1CC[NH+](C)CC1 ZINC000390516464 711122839 /nfs/dbraw/zinc/12/28/39/711122839.db2.gz DBRSWKKCMHEYBG-NEPJUHHUSA-N 2 0 224.392 2.495 20 0 BEADRP CSC1(C[NH2+][C@@H]2CC[C@H]2C)CC[NH+](C)CC1 ZINC000390509999 711122997 /nfs/dbraw/zinc/12/29/97/711122997.db2.gz ZCEGHWAEFZMNSL-VXGBXAGGSA-N 2 0 242.432 2.202 20 0 BEADRP CC(C)C[NH+]1CCC([NH2+][C@@H]2CC[C@@H]2C)CC1 ZINC000390575058 711127037 /nfs/dbraw/zinc/12/70/37/711127037.db2.gz OFFLJHHPHXMFML-GXTWGEPZSA-N 2 0 224.392 2.495 20 0 BEADRP CC1(C)CCC[C@@H]1[NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2 ZINC000392859073 711153314 /nfs/dbraw/zinc/15/33/14/711153314.db2.gz DGEDSFVGFFMQPT-VZKILSJISA-N 2 0 234.387 2.151 20 0 BEADRP COC(C)(C)CC[NH2+][C@H](C)C1CC[NH+](C)CC1 ZINC000396438831 711221585 /nfs/dbraw/zinc/22/15/85/711221585.db2.gz JFKCZFMLHFQACE-GFCCVEGCSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H]1NCCC[C@H]1[NH2+]CCCOc1ccccc1 ZINC000396633915 711361726 /nfs/dbraw/zinc/36/17/26/711361726.db2.gz JSWCECGBLQZVLB-DZGCQCFKSA-N 2 0 248.370 2.186 20 0 BEADRP CC[C@]1(C)CC[N@H+](C[C@@]2(C)CCC[NH2+]C2)C1 ZINC000399452879 711430993 /nfs/dbraw/zinc/43/09/93/711430993.db2.gz IVVJIJRYMFYLDA-KGLIPLIRSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@H]1CC2CCC1CC2 ZINC000381123572 710603623 /nfs/dbraw/zinc/60/36/23/710603623.db2.gz JBCPNIBHPJYCHJ-RYSNWHEDSA-N 2 0 224.392 2.495 20 0 BEADRP CNc1ccc(C)cc1C[NH2+][C@H](C)CC[NH+](C)C ZINC000902132449 710879690 /nfs/dbraw/zinc/87/96/90/710879690.db2.gz LBTJQNHNIQPSNT-CYBMUJFWSA-N 2 0 249.402 2.467 20 0 BEADRP CC(C)(C[NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23)C1CCC1 ZINC000384907155 711000070 /nfs/dbraw/zinc/00/00/70/711000070.db2.gz ATNNNEBCJHKCGC-WPTOEGHWSA-N 2 0 248.414 2.399 20 0 BEADRP CS[C@@H]1CC[C@H]([NH2+][C@@H](C)[C@@H]2CCCC[NH2+]2)C1 ZINC000386552788 711032740 /nfs/dbraw/zinc/03/27/40/711032740.db2.gz HGUTYKXJBXOMLM-RVMXOQNASA-N 2 0 242.432 2.391 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H]2CC3CCC2CC3)C1 ZINC000394214669 711188998 /nfs/dbraw/zinc/18/89/98/711188998.db2.gz CZJMYWCOHGBGQE-SHWKFHJASA-N 2 0 236.403 2.497 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CC3CCC2CC3)C1 ZINC000394214666 711189013 /nfs/dbraw/zinc/18/90/13/711189013.db2.gz CZJMYWCOHGBGQE-HXSCFSKGSA-N 2 0 236.403 2.497 20 0 BEADRP [NH3+]CC[C@@H]1CCCC[N@@H+]1CCCC1CC1 ZINC000394502773 711194116 /nfs/dbraw/zinc/19/41/16/711194116.db2.gz RPYVCTHWZWBEFJ-ZDUSSCGKSA-N 2 0 210.365 2.380 20 0 BEADRP C[NH+]1CCC(C[NH2+]CCSC(C)(C)C)CC1 ZINC000304396382 711452349 /nfs/dbraw/zinc/45/23/49/711452349.db2.gz LYBGBDWIDCZQHZ-UHFFFAOYSA-N 2 0 244.448 2.450 20 0 BEADRP C[NH2+]C1CC[NH+](CC[C@@H]2C[C@H]2C2CC2)CC1 ZINC000712687514 711474576 /nfs/dbraw/zinc/47/45/76/711474576.db2.gz ULODHVRZFSMWQI-OCCSQVGLSA-N 2 0 222.376 2.106 20 0 BEADRP Cc1cccc(OCC[N@@H+]2CC[C@H](CC[NH3+])C2)c1 ZINC000723670433 711533385 /nfs/dbraw/zinc/53/33/85/711533385.db2.gz RKUUXDHUZOABCT-AWEZNQCLSA-N 2 0 248.370 2.045 20 0 BEADRP Cc1ccc(F)c(C[N@@H+]2CC[C@@H](CC[NH3+])C2)c1 ZINC000723668966 711533531 /nfs/dbraw/zinc/53/35/31/711533531.db2.gz DVWWLQYHJPLXIA-GFCCVEGCSA-N 2 0 236.334 2.305 20 0 BEADRP C[C@@H]1C[C@H](C)CC[N@H+](CC[C@H]2CC[NH2+]C2)C1 ZINC000723779264 711536770 /nfs/dbraw/zinc/53/67/70/711536770.db2.gz ICMKNACEUUGZLW-MGPQQGTHSA-N 2 0 224.392 2.354 20 0 BEADRP CC[C@H]([NH2+][C@H](C)CC[NH+](C)C)[C@H]1CCCOC1 ZINC000723957653 711547806 /nfs/dbraw/zinc/54/78/06/711547806.db2.gz DNRKOYKPJHREGM-RDBSUJKOSA-N 2 0 242.407 2.121 20 0 BEADRP CC[C@H]([NH2+][C@H](C)CCCC[NH3+])[C@H]1CCCOC1 ZINC000724008815 711555177 /nfs/dbraw/zinc/55/51/77/711555177.db2.gz MKPRTJDYRLBESJ-RDBSUJKOSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CCC1CC=CC1 ZINC000724209489 711570519 /nfs/dbraw/zinc/57/05/19/711570519.db2.gz WQKGFHYTKNEEQS-GFCCVEGCSA-N 2 0 210.365 2.450 20 0 BEADRP C[C@@H](C[NH2+][C@H]1CC2CCC1CC2)C[NH+](C)C ZINC000382229750 711643401 /nfs/dbraw/zinc/64/34/01/711643401.db2.gz GTHQVJKOIQDLBG-ABXWRUBCSA-N 2 0 224.392 2.352 20 0 BEADRP COC[C@@H](C[N@@H+]1CCCC[C@@H]1CC[NH3+])C(C)C ZINC000721959270 711694970 /nfs/dbraw/zinc/69/49/70/711694970.db2.gz HGMRSTZDTFIJAJ-ZIAGYGMSSA-N 2 0 242.407 2.108 20 0 BEADRP C[C@@H]1[C@H]2CC[C@@H](C[C@H]1[NH2+][C@@H]1CCCC[C@@H]1F)[NH2+]2 ZINC000925724568 711728390 /nfs/dbraw/zinc/72/83/90/711728390.db2.gz BJQKLKFLGOSPGD-GSZZWUTPSA-N 2 0 240.366 2.386 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@@H](c2ccccn2)C2CC2)C1 ZINC000925821463 711756327 /nfs/dbraw/zinc/75/63/27/711756327.db2.gz JGYRCOZNAFYDMZ-UMVBOHGHSA-N 2 0 245.370 2.392 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1CC[C@H]([NH3+])C1)c1ccncc1 ZINC000925879742 711762158 /nfs/dbraw/zinc/76/21/58/711762158.db2.gz JNTMQKGCSSKQNC-XBFCOCLRSA-N 2 0 233.359 2.250 20 0 BEADRP C[NH+]1CCC(C[NH2+]CCc2cccs2)CC1 ZINC000054239918 711782635 /nfs/dbraw/zinc/78/26/35/711782635.db2.gz AIVDJINFQHPOLG-UHFFFAOYSA-N 2 0 238.400 2.222 20 0 BEADRP Cc1ccc(C)c(C[N@@H+]2CC[C@@H](CC[NH3+])C2)c1 ZINC000125556724 711794330 /nfs/dbraw/zinc/79/43/30/711794330.db2.gz MQZSIDKDDGFMJU-CQSZACIVSA-N 2 0 232.371 2.474 20 0 BEADRP Cc1ccsc1C[N@H+]1CC[C@H](C)[C@@H](C[NH3+])C1 ZINC000229065729 711837268 /nfs/dbraw/zinc/83/72/68/711837268.db2.gz DSFLDCQYYBKWSA-JQWIXIFHSA-N 2 0 238.400 2.473 20 0 BEADRP COC[C@H](C[N@H+](C)CC[C@H]([NH3+])C(C)C)C(C)C ZINC000721959939 711948470 /nfs/dbraw/zinc/94/84/70/711948470.db2.gz IVTUIRIOILTHJF-KBPBESRZSA-N 2 0 244.423 2.210 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@@H]2C=CCC2)CC1 ZINC000700503907 711995553 /nfs/dbraw/zinc/99/55/53/711995553.db2.gz XAIFLVRXUNWXEY-GFCCVEGCSA-N 2 0 208.349 2.167 20 0 BEADRP C[C@H](CC[NH2+][C@@H](C)CC1CCC1)[NH+](C)C ZINC000700456702 711995872 /nfs/dbraw/zinc/99/58/72/711995872.db2.gz WVQKSVYDLCIKBS-NWDGAFQWSA-N 2 0 212.381 2.495 20 0 BEADRP C[C@@H](CC[NH2+][C@H]1CCOC2(CCC2)C1)[NH+](C)C ZINC000700604732 712001096 /nfs/dbraw/zinc/00/10/96/712001096.db2.gz DSSNQQFXIJRZNK-STQMWFEESA-N 2 0 240.391 2.018 20 0 BEADRP C[C@@H]1CC[C@H]1[NH2+]C[C@@H]1CCCC[N@H+](C)C1 ZINC000700799734 712005597 /nfs/dbraw/zinc/00/55/97/712005597.db2.gz LLUCWCFAKHKZPA-FRRDWIJNSA-N 2 0 210.365 2.106 20 0 BEADRP C(C[NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23)CC1CCC1 ZINC000701746120 712028721 /nfs/dbraw/zinc/02/87/21/712028721.db2.gz AUABLMHNMMYAMY-XPABHHOTSA-N 2 0 234.387 2.153 20 0 BEADRP CC1(C)C[C@]1(C)C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000701944894 712033276 /nfs/dbraw/zinc/03/32/76/712033276.db2.gz QINXLWHGKDHBMS-RGCMKSIDSA-N 2 0 236.403 2.400 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@@H+]1CCCC2(CC2)CC1 ZINC000702486291 712052974 /nfs/dbraw/zinc/05/29/74/712052974.db2.gz MREDBLUHTHDNLP-OLZOCXBDSA-N 2 0 222.376 2.108 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]CC[C@H]1CCSC1 ZINC000704797965 712117802 /nfs/dbraw/zinc/11/78/02/712117802.db2.gz OHMRMFJRKQRKCX-RWMBFGLXSA-N 2 0 242.432 2.237 20 0 BEADRP CSC1CC([NH2+]CCC[N@H+](C)C(C)C)C1 ZINC000706918590 712158386 /nfs/dbraw/zinc/15/83/86/712158386.db2.gz QCYPYLIJTHDWNN-UHFFFAOYSA-N 2 0 230.421 2.200 20 0 BEADRP CC[N@H+](C[C@]1(C)CCC[NH2+]C1)C1CCC1 ZINC000706892300 712159473 /nfs/dbraw/zinc/15/94/73/712159473.db2.gz APIJSGKVFJJUJP-CYBMUJFWSA-N 2 0 210.365 2.251 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+][C@H]2CCCC23CC3)C12CCC2 ZINC000706949927 712162740 /nfs/dbraw/zinc/16/27/40/712162740.db2.gz WHYIBVYKKDREPV-GRYCIOLGSA-N 2 0 220.360 2.179 20 0 BEADRP CC[C@@H](CC(F)F)C[N@H+]1C[C@@H](C[NH3+])[C@H](C)C1 ZINC000708112084 712182124 /nfs/dbraw/zinc/18/21/24/712182124.db2.gz NBLOHWQOODGQFJ-OUAUKWLOSA-N 2 0 234.334 2.194 20 0 BEADRP C[C@H](C[N@@H+]1CC[C@H](C[NH3+])C1)CC(C)(C)C ZINC000709120942 712209213 /nfs/dbraw/zinc/20/92/13/712209213.db2.gz BADAMCPPXGMCIS-NWDGAFQWSA-N 2 0 212.381 2.339 20 0 BEADRP CCC[C@H]1CCC[N@H+](C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000708522007 712211792 /nfs/dbraw/zinc/21/17/92/712211792.db2.gz ZPBZHTJQYKPWOB-RWMBFGLXSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@@H]1[C@H]2CC[C@@H](C[C@@H]1[NH2+]C1CCSCC1)[NH2+]2 ZINC000709283364 712219022 /nfs/dbraw/zinc/21/90/22/712219022.db2.gz MFMCFPQNTDPJOT-MGAJPHDKSA-N 2 0 240.416 2.001 20 0 BEADRP C[C@@H]1[C@H]2CC[C@@H](C[C@H]1[NH2+]C1CCCC1)[NH2+]2 ZINC000709374464 712220519 /nfs/dbraw/zinc/22/05/19/712220519.db2.gz QNEMBIZBDMAUOD-GWNIPJSYSA-N 2 0 208.349 2.048 20 0 BEADRP CS[C@@H]1CC[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000709413483 712221484 /nfs/dbraw/zinc/22/14/84/712221484.db2.gz FQWNQOJGZIFCOP-BLVYXGDSSA-N 2 0 240.416 2.143 20 0 BEADRP C[C@@H]1[C@H]2CC[C@@H](C[C@@H]1[NH2+]C1CCCCC1)[NH2+]2 ZINC000709432880 712221783 /nfs/dbraw/zinc/22/17/83/712221783.db2.gz FSUALWQUPCACLV-CABNGKKXSA-N 2 0 222.376 2.438 20 0 BEADRP CC[C@H](C)C[N@@H+]1C[C@@H](C[NH3+])[C@H](C(F)(F)F)C1 ZINC000709793951 712227576 /nfs/dbraw/zinc/22/75/76/712227576.db2.gz LXPXVKPHNYVQSO-IVZWLZJFSA-N 2 0 238.297 2.102 20 0 BEADRP [NH3+][C@@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccc(F)cc1)C2 ZINC000709839954 712229311 /nfs/dbraw/zinc/22/93/11/712229311.db2.gz ZVTFALRIYXVHNJ-YUTCNCBUSA-N 2 0 234.318 2.137 20 0 BEADRP C([C@@H]1CC[C@@H]2C[C@@H]2C1)[N@@H+]1CC[C@@]2(C1)CCC[NH2+]C2 ZINC000709893796 712230985 /nfs/dbraw/zinc/23/09/85/712230985.db2.gz VAUDDRZCPDJDIT-WCVJEAGWSA-N 2 0 248.414 2.498 20 0 BEADRP CCSCC[N@H+](C)CCCCCC[NH3+] ZINC000710714576 712255215 /nfs/dbraw/zinc/25/52/15/712255215.db2.gz RRULDUYPXNHWDR-UHFFFAOYSA-N 2 0 218.410 2.190 20 0 BEADRP C[N@H+](CCCCCC[NH3+])CC[C@H]1CCCO1 ZINC000710749256 712255439 /nfs/dbraw/zinc/25/54/39/712255439.db2.gz HXLSOYCHKAKRJS-CYBMUJFWSA-N 2 0 228.380 2.006 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]C[C@H]1C=CCC1 ZINC000711670438 712315885 /nfs/dbraw/zinc/31/58/85/712315885.db2.gz VGTOVEJDAHSAHF-RWMBFGLXSA-N 2 0 208.349 2.060 20 0 BEADRP C1=C[C@H](C[NH2+][C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)CC1 ZINC000711790616 712331171 /nfs/dbraw/zinc/33/11/71/712331171.db2.gz ZKIPUQDUEIALNL-BYNSBNAKSA-N 2 0 234.387 2.463 20 0 BEADRP [NH3+]CC[C@H]1CC[N@H+](CCCCC(F)(F)F)C1 ZINC000923479645 712334216 /nfs/dbraw/zinc/33/42/16/712334216.db2.gz AJLQUOZNWILBBY-JTQLQIEISA-N 2 0 238.297 2.390 20 0 BEADRP [NH3+]CC[C@@H]1CC[N@@H+]([C@H]2C[C@@H]2c2ccccc2)C1 ZINC000923480400 712335001 /nfs/dbraw/zinc/33/50/01/712335001.db2.gz YATFFCCWMYOXCQ-YUELXQCFSA-N 2 0 230.355 2.213 20 0 BEADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+][C@@H]2CC[C@H]2C)C1 ZINC000379780123 712398849 /nfs/dbraw/zinc/39/88/49/712398849.db2.gz BVGPYLXRIIYPNG-FRRDWIJNSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@H]1C[N@H+](CC[C@@H]2C[C@H]2C2CC2)CC[C@@H]1[NH3+] ZINC000712690932 712448298 /nfs/dbraw/zinc/44/82/98/712448298.db2.gz FYKJAEPDHAXNHX-GHYVTOPFSA-N 2 0 222.376 2.092 20 0 BEADRP C1=CCC(C[N@@H+]2CC[NH2+]CCC23CCC3)C1 ZINC000713137190 712453358 /nfs/dbraw/zinc/45/33/58/712453358.db2.gz XEBCTLZHNCXBMY-UHFFFAOYSA-N 2 0 220.360 2.171 20 0 BEADRP C=C/C=C/CC[N@@H+]1CC[C@H]([NH3+])[C@@H](CC)C1 ZINC000713700389 712469482 /nfs/dbraw/zinc/46/94/82/712469482.db2.gz AEDXMTZOFVOGJZ-AAAGKOELSA-N 2 0 208.349 2.178 20 0 BEADRP CN(C[C@H]1CCCC(C)(C)O1)CC(C)(C)[NH3+] ZINC000714330416 712482135 /nfs/dbraw/zinc/48/21/35/712482135.db2.gz KIMYQCFGTIYRAT-LLVKDONJSA-N 2 0 228.380 2.003 20 0 BEADRP C[C@@H]1C[N@H+](C[C@H]2CCCC(C)(C)O2)CC[C@H]1[NH3+] ZINC000714368283 712483758 /nfs/dbraw/zinc/48/37/58/712483758.db2.gz LXBMOZOZVGYZEX-JHJVBQTASA-N 2 0 240.391 2.003 20 0 BEADRP C[C@H]1C[C@@H]1C[NH+]1CCC(C(C)(C)C[NH3+])CC1 ZINC000714415670 712485739 /nfs/dbraw/zinc/48/57/39/712485739.db2.gz XQQBYPUXMGIFPS-NWDGAFQWSA-N 2 0 224.392 2.339 20 0 BEADRP CCC1([NH3+])CC[NH+](CC2(OC)CCCC2)CC1 ZINC000714756082 712497908 /nfs/dbraw/zinc/49/79/08/712497908.db2.gz FJOXWIQJQFQDJI-UHFFFAOYSA-N 2 0 240.391 2.149 20 0 BEADRP [NH3+][C@H]1C[C@H]2C[C@@H](C1)[N@H+](CC[C@@H]1C[C@H]1C1CC1)C2 ZINC000714809583 712498466 /nfs/dbraw/zinc/49/84/66/712498466.db2.gz QLSWEVUNOJBDRO-KLLKFSIISA-N 2 0 234.387 2.234 20 0 BEADRP C[C@@H]([NH3+])[C@H]1CC[N@H+](CC[C@@H]2C[C@H]2C2CC2)C1 ZINC000714921317 712499688 /nfs/dbraw/zinc/49/96/88/712499688.db2.gz XMOYPQTVRBELLB-ZZVYKPCYSA-N 2 0 222.376 2.092 20 0 BEADRP C(C[N@@H+]1CC[C@@]2(CC[NH2+]C2)C1)[C@@H]1C[C@H]1C1CC1 ZINC000714920244 712500033 /nfs/dbraw/zinc/50/00/33/712500033.db2.gz MUVCARPJCXKQSI-QLFBSQMISA-N 2 0 234.387 2.108 20 0 BEADRP C[NH+](C)C1(C)CCC([NH2+]CC2CC2)CC1 ZINC000715491229 712522943 /nfs/dbraw/zinc/52/29/43/712522943.db2.gz OZKJSBAAMGLXGQ-UHFFFAOYSA-N 2 0 210.365 2.249 20 0 BEADRP C[NH+](C)C1(C)CCC([NH2+][C@H]2CCCOC2)CC1 ZINC000715512664 712524387 /nfs/dbraw/zinc/52/43/87/712524387.db2.gz ONOOFWYVCAYUSA-MOKVOYLWSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@@H]1OCC[C@H]1[NH2+]C1CCC(C)([NH+](C)C)CC1 ZINC000715513600 712524947 /nfs/dbraw/zinc/52/49/47/712524947.db2.gz RPNNIWJXGSVGIX-RJZJGCCBSA-N 2 0 240.391 2.016 20 0 BEADRP CC[C@](C)(C[NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1)OC ZINC000715543931 712527237 /nfs/dbraw/zinc/52/72/37/712527237.db2.gz OSFVEERIKZPQLK-HZSPNIEDSA-N 2 0 242.407 2.264 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]CC[C@H]2CCCS2)C12CCC2 ZINC000715659322 712529835 /nfs/dbraw/zinc/52/98/35/712529835.db2.gz NXFRDKYZUUKENN-UTUOFQBUSA-N 2 0 240.416 2.132 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]CC[C@H]2CCCS2)C1 ZINC000715751539 712531925 /nfs/dbraw/zinc/53/19/25/712531925.db2.gz FNNJPTKZVAAPMY-IJLUTSLNSA-N 2 0 228.405 2.132 20 0 BEADRP CC[N@H+](CCCCCC[NH3+])CC(C)C ZINC000037111782 712542149 /nfs/dbraw/zinc/54/21/49/712542149.db2.gz PVMZDWAJEXHHSQ-UHFFFAOYSA-N 2 0 200.370 2.483 20 0 BEADRP CCCC[NH+]1CCC([NH2+][C@H]2CCSC2)CC1 ZINC000037149991 712547710 /nfs/dbraw/zinc/54/77/10/712547710.db2.gz PBGDDHGFBGZSNT-ZDUSSCGKSA-N 2 0 242.432 2.346 20 0 BEADRP CC[C@H](C)C[N@H+](C)CCCCCC[NH3+] ZINC000037173547 712550068 /nfs/dbraw/zinc/55/00/68/712550068.db2.gz VNIPDNIMUSTPCB-LBPRGKRZSA-N 2 0 200.370 2.483 20 0 BEADRP CC[C@H]([NH2+]CCC[NH+]1CCCC1)C(C)C ZINC000037229485 712554740 /nfs/dbraw/zinc/55/47/40/712554740.db2.gz BQAFNCUMKHQBAQ-ZDUSSCGKSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C ZINC000716544856 712567540 /nfs/dbraw/zinc/56/75/40/712567540.db2.gz IQPUOTDOBRJITF-VJTDZRGJSA-N 2 0 224.392 2.386 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@H]1[C@H]1C[C@H]1C)[C@@H]1CCCC[NH2+]1 ZINC000716630912 712568222 /nfs/dbraw/zinc/56/82/22/712568222.db2.gz ATAGNTRXLCHCLL-LACSLYJWSA-N 2 0 236.403 2.399 20 0 BEADRP C[C@@H]1C[C@@H]1[C@H]1C[C@H]1C[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000716648564 712568501 /nfs/dbraw/zinc/56/85/01/712568501.db2.gz DZEWDZFVIMTNBB-JWNYTSFGSA-N 2 0 234.387 2.151 20 0 BEADRP C[NH+]1CCC(C[NH2+]CC2(C3CC3)CCC2)CC1 ZINC000391469472 712600813 /nfs/dbraw/zinc/60/08/13/712600813.db2.gz SACAEGPJPCMHCU-UHFFFAOYSA-N 2 0 236.403 2.498 20 0 BEADRP C[N@@H+]1CCC[C@H]1CC[NH2+]C1(C2CC2)CCC1 ZINC000717834471 712686561 /nfs/dbraw/zinc/68/65/61/712686561.db2.gz AWKYOMLHJQWUCX-ZDUSSCGKSA-N 2 0 222.376 2.393 20 0 BEADRP CC(C)(C[NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2)C1CCC1 ZINC000384907153 712704528 /nfs/dbraw/zinc/70/45/28/712704528.db2.gz ATNNNEBCJHKCGC-RCZQDCHWSA-N 2 0 248.414 2.399 20 0 BEADRP CC[C@H]1[C@H](C)CC[N@@H+]1C[C@@H]1CC[C@H]([NH3+])C1 ZINC000717936752 712734849 /nfs/dbraw/zinc/73/48/49/712734849.db2.gz ZADJYYRMRJDQRX-NDBYEHHHSA-N 2 0 210.365 2.234 20 0 BEADRP CC[C@@H]1CO[C@@H](CC)C[N@@H+]1C[C@@H]1CC[C@H]([NH3+])C1 ZINC000717960449 712735105 /nfs/dbraw/zinc/73/51/05/712735105.db2.gz AHIXBZJDBPBPAA-RQJABVFESA-N 2 0 240.391 2.003 20 0 BEADRP C1=CCCC([NH2+][C@H]2CCC[NH2+]CC2)CC1 ZINC000718067394 712740829 /nfs/dbraw/zinc/74/08/29/712740829.db2.gz MZXOLOVUMLVOPM-ZDUSSCGKSA-N 2 0 208.349 2.217 20 0 BEADRP CC(F)(F)CCC[N@@H+]1CC[C@](C)(C[NH3+])C1 ZINC000718572611 712774795 /nfs/dbraw/zinc/77/47/95/712774795.db2.gz SAEYZXRXVULJLY-SNVBAGLBSA-N 2 0 220.307 2.093 20 0 BEADRP C[C@@H]([NH3+])[C@H]1CCC[N@H+](CCCC(C)(F)F)C1 ZINC000718710776 712777729 /nfs/dbraw/zinc/77/77/29/712777729.db2.gz XXMGTYVCLJURJV-MNOVXSKESA-N 2 0 234.334 2.481 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCSC1)C[NH+]1CCCCC1 ZINC000038041652 712801100 /nfs/dbraw/zinc/80/11/00/712801100.db2.gz GIKKLCGTDAZDLJ-CHWSQXEVSA-N 2 0 242.432 2.204 20 0 BEADRP CSCC1CC[NH+](C[C@]2(C)CC[NH2+]C2)CC1 ZINC000719268350 712802550 /nfs/dbraw/zinc/80/25/50/712802550.db2.gz IUBKWCXLLBNLTI-CYBMUJFWSA-N 2 0 242.432 2.061 20 0 BEADRP C[C@H]1[C@H](Nc2cc[nH+]c3ccccc23)CC[N@@H+]1C ZINC000719576716 712812001 /nfs/dbraw/zinc/81/20/01/712812001.db2.gz SEALIFJDIQULKP-WCQYABFASA-N 2 0 241.338 2.161 20 0 BEADRP C[C@@H](c1ccccc1)[N@@H+]1C[C@@H]2C[NH2+]C[C@]2(C)C1 ZINC000720667255 712861471 /nfs/dbraw/zinc/86/14/71/712861471.db2.gz VKPANEBDKAUNQE-AEGPPILISA-N 2 0 230.355 2.289 20 0 BEADRP C[C@H]1CCC[C@H](C[N@@H+]2C[C@@H]3C[NH2+]C[C@]3(C)C2)C1 ZINC000720795161 712865836 /nfs/dbraw/zinc/86/58/36/712865836.db2.gz MVRIKWFWDWIGGG-ZQDZILKHSA-N 2 0 236.403 2.354 20 0 BEADRP C[C@@H](C[N@@H+]1C[C@@H]2C[NH2+]C[C@]2(C)C1)c1ccccc1 ZINC000720826193 712868991 /nfs/dbraw/zinc/86/89/91/712868991.db2.gz CTBGCOUXGJEDIO-CWRNSKLLSA-N 2 0 244.382 2.331 20 0 BEADRP [NH3+]C[C@@H]1C[N@H+](CC2CC=CC2)C[C@H]1C(F)(F)F ZINC000720878441 712872852 /nfs/dbraw/zinc/87/28/52/712872852.db2.gz SRFYJVGKYQQGQN-GHMZBOCLSA-N 2 0 248.292 2.022 20 0 BEADRP C[C@H]([NH2+]CCN1CCC[C@H]1C)C1CCC1 ZINC000380354060 712892988 /nfs/dbraw/zinc/89/29/88/712892988.db2.gz WHKOPDFPNJLOJR-NEPJUHHUSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@@H](C)CN1c1[nH+]ccc2[nH]ccc21 ZINC000663763902 719156766 /nfs/dbraw/zinc/15/67/66/719156766.db2.gz ITUMRTUHPBBCCF-WDEREUQCSA-N 2 0 244.342 2.092 20 0 BEADRP C[C@@H]1CN(c2[nH+]ccc3[nH]ccc32)[C@@H](C)C[N@@H+]1C ZINC000663763899 719155826 /nfs/dbraw/zinc/15/58/26/719155826.db2.gz ITUMRTUHPBBCCF-MNOVXSKESA-N 2 0 244.342 2.092 20 0 BEADRP C[C@@H]1CN(c2cc3[nH]ccc3c[nH+]2)[C@@H](C)C[N@@H+]1C ZINC001164633107 719162954 /nfs/dbraw/zinc/16/29/54/719162954.db2.gz GQCPUZRVXALSJZ-MNOVXSKESA-N 2 0 244.342 2.092 20 0 BEADRP C[NH+](C)[C@@H]1CCCN(c2[nH+]ccc3[nH]ccc32)C1 ZINC000647866491 721886324 /nfs/dbraw/zinc/88/63/24/721886324.db2.gz XBHJNCCYRJONFW-LLVKDONJSA-N 2 0 244.342 2.093 20 0 BEADRP C[C@@H]1C[C@@H](C)[C@H](C)[N@H+](C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000693578434 958867589 /nfs/dbraw/zinc/86/75/89/958867589.db2.gz LMQQTJVSBOSEJB-LBELIVKGSA-N 2 0 210.365 2.090 20 0 BEADRP CC(C)CCC[N@@H+]1CCCC[C@H](C[NH3+])C1 ZINC000308885272 959534902 /nfs/dbraw/zinc/53/49/02/959534902.db2.gz WQMLDPACRUZCBQ-CYBMUJFWSA-N 2 0 212.381 2.483 20 0 BEADRP CC1([NH2+]C2CC[NH+](CC3CC3)CC2)CC1 ZINC000309118751 959658542 /nfs/dbraw/zinc/65/85/42/959658542.db2.gz MRDYOBNJTVYMIU-UHFFFAOYSA-N 2 0 208.349 2.003 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H](C)Cc1ccccc1Cl ZINC000309276424 959824222 /nfs/dbraw/zinc/82/42/22/959824222.db2.gz DVGGTMLYSYYFHR-GHMZBOCLSA-N 2 0 240.778 2.455 20 0 BEADRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)C1(Cl)CC1 ZINC000695648053 960322215 /nfs/dbraw/zinc/32/22/15/960322215.db2.gz LLFLZXYGKFNQBW-YEJSDXFRSA-N 2 0 242.794 2.361 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)[C@@H]1C[C@H]2C[C@H]2C1 ZINC001167956145 962804377 /nfs/dbraw/zinc/80/43/77/962804377.db2.gz KEXHEGFVPVOPEF-CLLJXQQHSA-N 2 0 210.365 2.059 20 0 BEADRP CCCC[N@H+](C)CCC[NH2+][C@H]1CCO[C@@H](C)C1 ZINC001168075749 963614654 /nfs/dbraw/zinc/61/46/54/963614654.db2.gz QNFXQWAFPUFXMK-KBPBESRZSA-N 2 0 242.407 2.266 20 0 BEADRP CC(=O)CC(C)(C)[NH2+]C1CCC([NH+](C)C)CC1 ZINC001168304088 964397155 /nfs/dbraw/zinc/39/71/55/964397155.db2.gz OSAUAJSLZXYBGH-UHFFFAOYSA-N 2 0 240.391 2.207 20 0 BEADRP CC[C@@H]([NH2+]CC[C@H](C)[NH+](C)C)C1CCC1 ZINC000697824827 964543573 /nfs/dbraw/zinc/54/35/73/964543573.db2.gz MGNANTMEDBIDTH-WCQYABFASA-N 2 0 212.381 2.495 20 0 BEADRP C[C@@H](CC[NH2+][C@H]1CCCC1(C)C)[NH+](C)C ZINC000697877971 964603279 /nfs/dbraw/zinc/60/32/79/964603279.db2.gz GMVAESHAZPAGQG-RYUDHWBXSA-N 2 0 212.381 2.495 20 0 BEADRP CCCC[C@@H](CC)[NH2+]C[C@H]1CC[N@H+](C)C1 ZINC000068986698 1165855394 /nfs/dbraw/zinc/85/53/94/1165855394.db2.gz GKLMTIAARKLSRS-CHWSQXEVSA-N 2 0 212.381 2.497 20 0 BEADRP C[NH+]1CCC(C[NH2+]CCC(C)(C)F)CC1 ZINC000698309828 968177735 /nfs/dbraw/zinc/17/77/35/968177735.db2.gz QSYFZDHEYXJNIB-UHFFFAOYSA-N 2 0 216.344 2.056 20 0 BEADRP C[C@@H]1C[C@H]1C[N@@H+]1CCC[C@](C)(C[NH3+])CC1 ZINC001206295304 968202873 /nfs/dbraw/zinc/20/28/73/968202873.db2.gz MKAHFTZPPDOLCF-AGIUHOORSA-N 2 0 210.365 2.093 20 0 BEADRP CC(C)[N@H+](CCCCCO)[C@@H]1CCC[NH2+]CC1 ZINC001206582909 968394270 /nfs/dbraw/zinc/39/42/70/968394270.db2.gz PUALVPGVHMKOIW-CQSZACIVSA-N 2 0 242.407 2.002 20 0 BEADRP C[NH+](C)CC(C)(C)C[NH+]1CCC(C)(F)CC1 ZINC001207274475 968705180 /nfs/dbraw/zinc/70/51/80/968705180.db2.gz CZPSDDQHWLAFBW-UHFFFAOYSA-N 2 0 230.371 2.398 20 0 BEADRP CCC[N@H+](CC)CC(C)(C)C[NH+](C)C ZINC001207275057 968707618 /nfs/dbraw/zinc/70/76/18/968707618.db2.gz JBVGDINSZVFYDA-UHFFFAOYSA-N 2 0 200.370 2.306 20 0 BEADRP c1csc(CN2CC[C@@H]3[NH2+]CCC[C@H]3C2)c1 ZINC000250080353 1166085193 /nfs/dbraw/zinc/08/51/93/1166085193.db2.gz ICZBDOCCOOFFDD-AAEUAGOBSA-N 2 0 236.384 2.322 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2CCCC[C@H](F)C2)CC1 ZINC001207391340 968745372 /nfs/dbraw/zinc/74/53/72/968745372.db2.gz GTRSQTFPECPRHQ-ZDUSSCGKSA-N 2 0 228.355 2.152 20 0 BEADRP CCC(CC)[N@H+](C)CC1CC[NH+](C)CC1 ZINC001207399027 968750223 /nfs/dbraw/zinc/75/02/23/968750223.db2.gz WAWDDYBCGPFORU-UHFFFAOYSA-N 2 0 212.381 2.449 20 0 BEADRP CCC[C@H](C)[N@H+](C)C[C@@H](C[NH3+])C(C)C ZINC000083607070 1166113943 /nfs/dbraw/zinc/11/39/43/1166113943.db2.gz RLLBTDJMDAJQOX-NWDGAFQWSA-N 2 0 200.370 2.338 20 0 BEADRP C[NH+]1CCC(CC[N@@H+]2CCC[C@H]3C[C@H]32)CC1 ZINC001207487494 968787544 /nfs/dbraw/zinc/78/75/44/968787544.db2.gz LDTNLCDWAIPOJY-UONOGXRCSA-N 2 0 222.376 2.203 20 0 BEADRP CC[N@H+](CCC1CC[NH+](C)CC1)C(C)C ZINC001207479413 968791391 /nfs/dbraw/zinc/79/13/91/968791391.db2.gz IJYPXNWQZHRMNM-UHFFFAOYSA-N 2 0 212.381 2.449 20 0 BEADRP C[C@@H]1CCC[N@@H+]1CCC1CC[NH+](C)CC1 ZINC001207480080 968799936 /nfs/dbraw/zinc/79/99/36/968799936.db2.gz TYNHHRKTGPCMNR-GFCCVEGCSA-N 2 0 210.365 2.203 20 0 BEADRP CSCC[N@H+](C)CCC1CC[NH+](C)CC1 ZINC001207487839 968802452 /nfs/dbraw/zinc/80/24/52/968802452.db2.gz UNWJTPXXFGMPTH-UHFFFAOYSA-N 2 0 230.421 2.013 20 0 BEADRP C[NH+]1CCC(C)(C[NH+]2CCC(F)CC2)CC1 ZINC001208108734 969002411 /nfs/dbraw/zinc/00/24/11/969002411.db2.gz ZHQHDMRJNSDDDP-UHFFFAOYSA-N 2 0 228.355 2.152 20 0 BEADRP CC[NH+]1C[C@@H]2C[NH+](CC[C@@H](C)SC)C[C@H]2C1 ZINC001208151098 969073870 /nfs/dbraw/zinc/07/38/70/969073870.db2.gz JHFYEGMFTXKUHZ-JHJVBQTASA-N 2 0 242.432 2.012 20 0 BEADRP CS[C@H](C)CC[NH+]1CC2(C1)CC[NH+](C)CC2 ZINC001208155638 969077752 /nfs/dbraw/zinc/07/77/52/969077752.db2.gz RZCVTLXKOIVUIO-GFCCVEGCSA-N 2 0 242.432 2.156 20 0 BEADRP CCCC1([NH2+]C[C@H](O)C[NH+](CC)CC)CCC1 ZINC001253211669 969113423 /nfs/dbraw/zinc/11/34/23/969113423.db2.gz JKATTZISEYJDQN-ZDUSSCGKSA-N 2 0 242.407 2.002 20 0 BEADRP C[C@H]1CCC[N@H+](C[C@@H]2CCC[NH+](C)C2)CC1 ZINC001208608486 969148561 /nfs/dbraw/zinc/14/85/61/969148561.db2.gz UFHROKJUYYZTTE-UONOGXRCSA-N 2 0 224.392 2.450 20 0 BEADRP C[C@@H]1CCC[N@H+](C[C@H]2CCC[NH+](C)C2)CC1 ZINC001208608485 969149246 /nfs/dbraw/zinc/14/92/46/969149246.db2.gz UFHROKJUYYZTTE-KGLIPLIRSA-N 2 0 224.392 2.450 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2CC[C@](C)(CF)C2)CC1 ZINC001208593564 969150676 /nfs/dbraw/zinc/15/06/76/969150676.db2.gz WMQUFQFESMRITI-CQSZACIVSA-N 2 0 242.382 2.400 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2C[C@H](F)C[C@H]2C)CC1 ZINC001208593646 969150837 /nfs/dbraw/zinc/15/08/37/969150837.db2.gz YJWYQNISPVNDSU-DGCLKSJQSA-N 2 0 228.355 2.151 20 0 BEADRP CC[NH+]1CCC(C[N@H+](C)C(C)(C)C)CC1 ZINC001208599670 969152904 /nfs/dbraw/zinc/15/29/04/969152904.db2.gz KBPCDTVQHFQJKR-UHFFFAOYSA-N 2 0 212.381 2.449 20 0 BEADRP C[C@@H]1[C@H](C)C[N@H+](CCC[NH2+]C2CC2)[C@H]1C ZINC000399667440 1166250441 /nfs/dbraw/zinc/25/04/41/1166250441.db2.gz MRNMZDUNXGKPEF-UTUOFQBUSA-N 2 0 210.365 2.105 20 0 BEADRP CCCCC[C@@H](O)C[NH2+][C@@H]1CCC[N@H+](C)CC1 ZINC001253549802 969221059 /nfs/dbraw/zinc/22/10/59/969221059.db2.gz GCEBBQNWXWIKLB-ZIAGYGMSSA-N 2 0 242.407 2.002 20 0 BEADRP CO[C@@H]1CCC[C@@H]([N@H+](CCC[NH3+])C(C)C)C1 ZINC000226539036 1166288581 /nfs/dbraw/zinc/28/85/81/1166288581.db2.gz FCPFWIUHKPLWFT-CHWSQXEVSA-N 2 0 228.380 2.003 20 0 BEADRP CCCCC[C@H](O)C[NH2+]C(C)(C)CC[NH+](C)C ZINC001253553501 969226742 /nfs/dbraw/zinc/22/67/42/969226742.db2.gz GRJDVPFEVWHEJC-ZDUSSCGKSA-N 2 0 244.423 2.248 20 0 BEADRP CC(C)[C@@H](C[NH3+])C[N@@H+]1CC[C@@H]2CCCC[C@@H]21 ZINC000226598137 1166310805 /nfs/dbraw/zinc/31/08/05/1166310805.db2.gz DZKMQXVZBMIEBF-IHRRRGAJSA-N 2 0 224.392 2.482 20 0 BEADRP FC(F)(F)CCC[NH2+]CCC[NH+]1CCCC1 ZINC000148483623 1166319682 /nfs/dbraw/zinc/31/96/82/1166319682.db2.gz LVXNNDFJARHTPB-UHFFFAOYSA-N 2 0 238.297 2.404 20 0 BEADRP CCOC(C)(C)C[N@H+](C)CC1CC[NH+](C)CC1 ZINC001209075558 969349029 /nfs/dbraw/zinc/34/90/29/969349029.db2.gz SODBERMQXDXWPF-UHFFFAOYSA-N 2 0 242.407 2.075 20 0 BEADRP CCC(CC)C[N@@H+]1C[C@@H](C[NH3+])CC[C@H]1C ZINC000250384063 1166393858 /nfs/dbraw/zinc/39/38/58/1166393858.db2.gz FNYHYLIXGJYPNF-DGCLKSJQSA-N 2 0 212.381 2.482 20 0 BEADRP C[C@@H]1CC(C[N@H+](C)CCC[NH+](C)C)C[C@@H](C)O1 ZINC001209378721 969450466 /nfs/dbraw/zinc/45/04/66/969450466.db2.gz MWGRDQYMHRVDGH-CHWSQXEVSA-N 2 0 242.407 2.074 20 0 BEADRP CC[NH+]1CCC([NH+]2CCC3(CC3)CC2)CC1 ZINC001169246012 969536293 /nfs/dbraw/zinc/53/62/93/969536293.db2.gz LSRDQQBGNKOPCM-UHFFFAOYSA-N 2 0 222.376 2.347 20 0 BEADRP c1ccc(CC[N@@H+]2CC[C@H]3[NH2+]CCC[C@H]3C2)cc1 ZINC000250799599 1166431088 /nfs/dbraw/zinc/43/10/88/1166431088.db2.gz DDDAPRBYVQIKCF-JKSUJKDBSA-N 2 0 244.382 2.303 20 0 BEADRP C1C[C@H]2CCC[N@@H+]([C@@H]3CCC[NH2+]C3)[C@H]2C1 ZINC000250996832 1166466024 /nfs/dbraw/zinc/46/60/24/1166466024.db2.gz DBLMOVNQZLUWJV-XQQFMLRXSA-N 2 0 208.349 2.003 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH2+]C[C@@H]2CCC(F)(F)C2)CC1 ZINC001254499207 969657382 /nfs/dbraw/zinc/65/73/82/969657382.db2.gz COOIREBYZWWATD-NEPJUHHUSA-N 2 0 246.345 2.496 20 0 BEADRP CO[C@H]1CC[C@@H]([NH2+][C@@H]2CCC[N@H+](C)CC2)CC1 ZINC001254515568 969690328 /nfs/dbraw/zinc/69/03/28/969690328.db2.gz YNAMSNLIZSIUHO-MCIONIFRSA-N 2 0 240.391 2.018 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH+]2CCC[C@H](C(F)F)C2)CC1 ZINC001254525426 969717812 /nfs/dbraw/zinc/71/78/12/969717812.db2.gz IETKYSJNCQSNSZ-NWDGAFQWSA-N 2 0 246.345 2.448 20 0 BEADRP C[C@@H]1C[C@@H](C)C[NH+]([C@H]2CCC[N@H+](C)CC2)C1 ZINC001254524912 969718311 /nfs/dbraw/zinc/71/83/11/969718311.db2.gz DQWJPHYCYNZQFJ-MCIONIFRSA-N 2 0 224.392 2.449 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH+]2CCC[C@@H](CF)C2)CC1 ZINC001254524666 969723639 /nfs/dbraw/zinc/72/36/39/969723639.db2.gz YIOFIXUNOWACDW-QWHCGFSZSA-N 2 0 228.355 2.152 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1Oc1cccc2c1C[NH2+]C2 ZINC001218027899 1166511872 /nfs/dbraw/zinc/51/18/72/1166511872.db2.gz BHIJZWQXCLRKKY-RISCZKNCSA-N 2 0 246.354 2.057 20 0 BEADRP CC[NH+]1CCC(C[NH2+]CCCC2CC2)CC1 ZINC000394460577 1166581635 /nfs/dbraw/zinc/58/16/35/1166581635.db2.gz UQJCUEZIXMNKBG-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP Cc1c[nH+]c(NCC[C@H]2CCC[NH2+]2)c(C)c1 ZINC000394737104 1166591598 /nfs/dbraw/zinc/59/15/98/1166591598.db2.gz JYYCRMNFPIKVOT-GFCCVEGCSA-N 2 0 219.332 2.252 20 0 BEADRP Cc1c[nH+]ccc1N[C@H]1CC[N@@H+]2CCCC[C@@H]12 ZINC000226992685 1166604420 /nfs/dbraw/zinc/60/44/20/1166604420.db2.gz AVFQHOVGCABVBO-KBPBESRZSA-N 2 0 231.343 2.429 20 0 BEADRP CCCC[C@@H](C)[N@@H+]1CCC[C@H](C[NH2+]C)C1 ZINC000394604435 1166605175 /nfs/dbraw/zinc/60/51/75/1166605175.db2.gz FMWRNVIIJOXCJQ-CHWSQXEVSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H]1C[C@H]([N@H+](C)CC2CC(F)(F)C2)CC[NH2+]1 ZINC000394748725 1166613219 /nfs/dbraw/zinc/61/32/19/1166613219.db2.gz ZMYXJFDBTQJAJP-MWLCHTKSSA-N 2 0 232.318 2.104 20 0 BEADRP CCCC[NH2+][C@H](C)CC[NH+](CC)CC ZINC001255941916 970575058 /nfs/dbraw/zinc/57/50/58/970575058.db2.gz ZLIHBLQLAYTQQZ-GFCCVEGCSA-N 2 0 200.370 2.497 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]CCC1CC1 ZINC001255946781 970579947 /nfs/dbraw/zinc/57/99/47/970579947.db2.gz ZUZNKOMIOQODBZ-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+][C@@H](CO)C(C)(C)C ZINC001255947671 970580171 /nfs/dbraw/zinc/58/01/71/970580171.db2.gz UVDMRBHYYKVLAL-OLZOCXBDSA-N 2 0 244.423 2.103 20 0 BEADRP c1cc(N2CCC([NH2+]CC3CC3)CC2)cc[nH+]1 ZINC000036960326 1166820453 /nfs/dbraw/zinc/82/04/53/1166820453.db2.gz QVDYMEHFAUMQNX-UHFFFAOYSA-N 2 0 231.343 2.050 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+][C@H]1CCOC[C@H]1C ZINC001255948099 970583752 /nfs/dbraw/zinc/58/37/52/970583752.db2.gz DYJCSMHPZPFWJY-RDBSUJKOSA-N 2 0 242.407 2.121 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[N@H+](C)C1CCOCC1 ZINC001255955472 970587967 /nfs/dbraw/zinc/58/79/67/970587967.db2.gz UPYIFKPJROSQPI-CYBMUJFWSA-N 2 0 242.407 2.218 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[N@@H+]1CC[C@H](C)C1 ZINC001255956752 970595816 /nfs/dbraw/zinc/59/58/16/970595816.db2.gz MCXFSMOPAAOKLB-STQMWFEESA-N 2 0 212.381 2.449 20 0 BEADRP CC[C@H]1C[N@H+](Cc2ccc(C[NH3+])cc2)CCCO1 ZINC000380263338 1166849903 /nfs/dbraw/zinc/84/99/03/1166849903.db2.gz YEZJGVNXNUNBRX-HNNXBMFYSA-N 2 0 248.370 2.146 20 0 BEADRP CCC[C@H](C)C[N@@H+]1CC[C@@H]2[NH2+]CCC[C@H]2C1 ZINC000251279464 1166855153 /nfs/dbraw/zinc/85/51/53/1166855153.db2.gz GDBYLFXTVZXVOW-IHRRRGAJSA-N 2 0 224.392 2.497 20 0 BEADRP CCC[C@H](C)C[N@@H+]1CC[C@H]2[NH2+]CCC[C@H]2C1 ZINC000251279466 1166854685 /nfs/dbraw/zinc/85/46/85/1166854685.db2.gz GDBYLFXTVZXVOW-MELADBBJSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)=CCC[C@@H](C)[N@@H+]1CCC[NH2+]CC1 ZINC000238412007 1166870310 /nfs/dbraw/zinc/87/03/10/1166870310.db2.gz AFDSVKRTDUVHNA-CYBMUJFWSA-N 2 0 210.365 2.417 20 0 BEADRP C[C@@H]1CCC[N@@H+](C2CCN(C)CC2)C[C@@H]1C ZINC001256202665 970702910 /nfs/dbraw/zinc/70/29/10/970702910.db2.gz KIUSKNXULFYMNS-OLZOCXBDSA-N 2 0 224.392 2.449 20 0 BEADRP CCC[NH+]1C[C@@H]2C[NH+]([C@@H]3C[C@H]4C[C@H]4C3)C[C@H]2C1 ZINC001167949405 1167006071 /nfs/dbraw/zinc/00/60/71/1167006071.db2.gz WWQTWCMGXFKSCW-XLWJZTARSA-N 2 0 234.387 2.059 20 0 BEADRP CCSC[C@@H](C)[N@H+](C)CCC[NH+](C)C ZINC001173297385 975184172 /nfs/dbraw/zinc/18/41/72/975184172.db2.gz FTXMAVMCEQWSNN-LLVKDONJSA-N 2 0 218.410 2.012 20 0 BEADRP CCSC[C@@H](C)[N@@H+]1C[C@H]2CC[NH+](C)C[C@H]2C1 ZINC001173302520 975208043 /nfs/dbraw/zinc/20/80/43/975208043.db2.gz SPVKOJDMMAJKLF-UPJWGTAASA-N 2 0 242.432 2.012 20 0 BEADRP C[C@@H]([NH2+]CCC1CC[NH+](C)CC1)c1ncco1 ZINC001332843576 975290637 /nfs/dbraw/zinc/29/06/37/975290637.db2.gz LGMODPGJDSTICI-LLVKDONJSA-N 2 0 237.347 2.057 20 0 BEADRP CCSC[C@@H](C)[NH+]1CC2(C1)CC[NH+](C)CC2 ZINC001173314838 975302399 /nfs/dbraw/zinc/30/23/99/975302399.db2.gz LMSKZQAFKHVMRJ-GFCCVEGCSA-N 2 0 242.432 2.156 20 0 BEADRP CCSC[C@H](C)[N@@H+]1C[C@H]2C[C@@]2(C[NH+](C)C)C1 ZINC001173315647 975302448 /nfs/dbraw/zinc/30/24/48/975302448.db2.gz RVUKSJUJEFUFDJ-YNEHKIRRSA-N 2 0 242.432 2.012 20 0 BEADRP Cc1ccc(OCC[N@H+]2CC[C@H]([NH3+])C[C@H]2C)cc1 ZINC000228180073 1167114647 /nfs/dbraw/zinc/11/46/47/1167114647.db2.gz MPGOWJJYQHADGT-KGLIPLIRSA-N 2 0 248.370 2.185 20 0 BEADRP CC(C)[N@@H+](C)C[C@@H](C)Nc1cc[nH+]cc1 ZINC000308885282 1167211770 /nfs/dbraw/zinc/21/17/70/1167211770.db2.gz VOGLNDSZKYWUCL-LLVKDONJSA-N 2 0 207.321 2.222 20 0 BEADRP CC[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CC[C@H]2C)C1 ZINC000309037570 1167244138 /nfs/dbraw/zinc/24/41/38/1167244138.db2.gz JCAMUXYHBAEEDR-JHJVBQTASA-N 2 0 210.365 2.106 20 0 BEADRP CC[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CC[C@@H]2C)C1 ZINC000309037573 1167245119 /nfs/dbraw/zinc/24/51/19/1167245119.db2.gz JCAMUXYHBAEEDR-YNEHKIRRSA-N 2 0 210.365 2.106 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH2+]CC2CC(C)(C)C2)CC1 ZINC000309614620 1167332702 /nfs/dbraw/zinc/33/27/02/1167332702.db2.gz CIZQKKJZYMRWPX-ZDUSSCGKSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)C[C@@H]1C[C@H]1[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000385322045 1167389833 /nfs/dbraw/zinc/38/98/33/1167389833.db2.gz OGDRPZSIKJWTCL-MGPQQGTHSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1C[C@@H]([N@H+](C)C2CCC([NH3+])CC2)C[C@H](C)O1 ZINC000251701177 1167455167 /nfs/dbraw/zinc/45/51/67/1167455167.db2.gz BFNQBPDBDPFSOX-NRSZHIJWSA-N 2 0 240.391 2.144 20 0 BEADRP [NH3+]C[C@@H]1CCCC[N@@H+](C2CCCCC2)C1 ZINC000215782041 1167478192 /nfs/dbraw/zinc/47/81/92/1167478192.db2.gz YXCAXRCDVGQBGZ-LBPRGKRZSA-N 2 0 210.365 2.380 20 0 BEADRP C[C@H](C[NH3+])C[N@H+](C)[C@H]1C[C@H](C)C[C@H](C)C1 ZINC000252098654 1167626425 /nfs/dbraw/zinc/62/64/25/1167626425.db2.gz ICDZGGUMPGGCAR-XQHKEYJVSA-N 2 0 212.381 2.338 20 0 BEADRP C1CC[C@@H]2C[N@@H+]([C@@H]3CCC[NH2+]C3)CC[C@H]2C1 ZINC000252372285 1167825860 /nfs/dbraw/zinc/82/58/60/1167825860.db2.gz ICLNTGGGMVODTQ-MGPQQGTHSA-N 2 0 222.376 2.251 20 0 BEADRP CCSCC[NH2+][C@@]12CC[C@@]([NH2+]C)(C1)CCC2 ZINC001277914789 978944796 /nfs/dbraw/zinc/94/47/96/978944796.db2.gz XAFQIIKGPNPFGY-OLZOCXBDSA-N 2 0 242.432 2.394 20 0 BEADRP C[NH+](C)CC1(C[NH2+][C@@H]2CCSC2)CCCC1 ZINC000135016144 1168262483 /nfs/dbraw/zinc/26/24/83/1168262483.db2.gz PYELEZROKCHFLC-GFCCVEGCSA-N 2 0 242.432 2.204 20 0 BEADRP [NH3+]CC1CC[NH+]([C@H]2CCc3c2cccc3F)CC1 ZINC000149336272 1168317134 /nfs/dbraw/zinc/31/71/34/1168317134.db2.gz QCRSXPRXMIEYJD-HNNXBMFYSA-N 2 0 248.345 2.484 20 0 BEADRP CC[C@H]1CCCC[N@@H+]1[C@@H]1CC[NH2+][C@@H](C)C1 ZINC000229541143 1168330363 /nfs/dbraw/zinc/33/03/63/1168330363.db2.gz FMAHAOQRSOBZIB-RWMBFGLXSA-N 2 0 210.365 2.391 20 0 BEADRP CC[C@@H]1CCC[N@@H+]([C@@H]2CC[NH2+][C@@H](C)C2)C1 ZINC000229542168 1168333434 /nfs/dbraw/zinc/33/34/34/1168333434.db2.gz YSHLPAJQSFDQCS-YNEHKIRRSA-N 2 0 210.365 2.249 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+][C@@H]1CCCOCC1 ZINC001184419314 980081632 /nfs/dbraw/zinc/08/16/32/980081632.db2.gz ZLTPHWPRJQRJFK-UONOGXRCSA-N 2 0 242.407 2.266 20 0 BEADRP CCCCC[C@H](C)[NH2+]C[C@@H]1CC[N@H+](C)C1 ZINC000037484755 1168418116 /nfs/dbraw/zinc/41/81/16/1168418116.db2.gz LJHQVZKYEOBUPH-STQMWFEESA-N 2 0 212.381 2.497 20 0 BEADRP Cc1cc2[nH]ccc2c(N2C[C@H](C)[NH2+][C@@H](C)C2)[nH+]1 ZINC001158180708 1168546415 /nfs/dbraw/zinc/54/64/15/1168546415.db2.gz YNJQYQFTSNXTIU-QWRGUYRKSA-N 2 0 244.342 2.058 20 0 BEADRP c1cc(N[C@@H]2CC[N@@H+]3CCC[C@H]3C2)cc[nH+]1 ZINC000227334108 1168658528 /nfs/dbraw/zinc/65/85/28/1168658528.db2.gz MFZAQQAQOHQLGQ-OLZOCXBDSA-N 2 0 217.316 2.120 20 0 BEADRP Cc1cc(N(C)C)[nH+]cc1NC[C@@H]1CCCC[NH2+]1 ZINC001171335580 1168664187 /nfs/dbraw/zinc/66/41/87/1168664187.db2.gz YRLJEHMTQVUCGT-LBPRGKRZSA-N 2 0 248.374 2.010 20 0 BEADRP CCC(CC)[N@H+](CC)CCC[NH+](C)C ZINC000344018064 1168727484 /nfs/dbraw/zinc/72/74/84/1168727484.db2.gz FPOCZEWEZPFHBU-UHFFFAOYSA-N 2 0 200.370 2.449 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]CC[C@@H]2CC[C@@H]3C[C@@H]32)C12CCC2 ZINC000717024838 1168834836 /nfs/dbraw/zinc/83/48/36/1168834836.db2.gz VOLZYERDAOFODQ-MRTXSQPYSA-N 2 0 234.387 2.282 20 0 BEADRP CC(C)(C)C[N@@H+]1CCCC[C@]12CC[NH2+]C2 ZINC000257709958 1168934839 /nfs/dbraw/zinc/93/48/39/1168934839.db2.gz SNKDMIPTFYARKH-CYBMUJFWSA-N 2 0 210.365 2.251 20 0 BEADRP CC(C)(C)C[N@@H+]1CCCC[C@@]12CC[NH2+]C2 ZINC000257709959 1168934891 /nfs/dbraw/zinc/93/48/91/1168934891.db2.gz SNKDMIPTFYARKH-ZDUSSCGKSA-N 2 0 210.365 2.251 20 0 BEADRP [NH3+]CC[C@@H]1CC[N@H+](CCC2CCCC2)C1 ZINC000300730220 1168977621 /nfs/dbraw/zinc/97/76/21/1168977621.db2.gz FKOFFZMBVCGCEC-CYBMUJFWSA-N 2 0 210.365 2.237 20 0 BEADRP [NH3+]CC[C@H]1CC[N@H+](CCC2CCCC2)C1 ZINC000300730221 1168977810 /nfs/dbraw/zinc/97/78/10/1168977810.db2.gz FKOFFZMBVCGCEC-ZDUSSCGKSA-N 2 0 210.365 2.237 20 0 BEADRP CCc1ccccc1CN(C)[C@@H]1CCC[NH2+]C1 ZINC000110925965 1168984323 /nfs/dbraw/zinc/98/43/23/1168984323.db2.gz MCYSTDBUIVZTSI-OAHLLOKOSA-N 2 0 232.371 2.433 20 0 BEADRP CC(C)OCC[C@H](C)[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC001172431421 974714110 /nfs/dbraw/zinc/71/41/10/974714110.db2.gz NNCUHMFVFCEZKN-RWMBFGLXSA-N 2 0 228.380 2.050 20 0 BEADRP CC(C)OCC[C@@H](C)[N@H+](C)CCC[NH+](C)C ZINC001172439648 974796181 /nfs/dbraw/zinc/79/61/81/974796181.db2.gz GBUPWDPCLNUAPX-CYBMUJFWSA-N 2 0 230.396 2.074 20 0 BEADRP [NH3+]Cc1cccc(NC=CC2CC[NH2+]CC2)c1 ZINC001159650376 1169439219 /nfs/dbraw/zinc/43/92/19/1169439219.db2.gz VKBHMBIGQWPMGG-RMKNXTFCSA-N 2 0 231.343 2.071 20 0 BEADRP CCC[N@H+](CCC[NH3+])[C@@H](C)Cc1ccccn1 ZINC001256397553 970805404 /nfs/dbraw/zinc/80/54/04/970805404.db2.gz SFNZJISSRGEHLY-ZDUSSCGKSA-N 2 0 235.375 2.073 20 0 BEADRP CC(C)CCC[N@@H+]1CCC(F)(F)[C@H](C[NH3+])C1 ZINC000403196998 970892794 /nfs/dbraw/zinc/89/27/94/970892794.db2.gz YCQNEPQUDFFOLF-LLVKDONJSA-N 2 0 234.334 2.339 20 0 BEADRP F[C@H]1CC[N@@H+](C2CCN(c3cc[nH+]cc3)CC2)C1 ZINC001256856559 970997739 /nfs/dbraw/zinc/99/77/39/970997739.db2.gz JVOWZIQOWXXCLO-LBPRGKRZSA-N 2 0 249.333 2.094 20 0 BEADRP C[C@H]1CC[N@@H+]1C1CCN(c2cc[nH+]cc2)CC1 ZINC001256855785 970999339 /nfs/dbraw/zinc/99/93/39/970999339.db2.gz VXVNTZKDJTWSRE-LBPRGKRZSA-N 2 0 231.343 2.145 20 0 BEADRP C[C@@H]([NH3+])c1ccc(C2=C[NH2+]CCC2)cc1 ZINC001243950748 971041093 /nfs/dbraw/zinc/04/10/93/971041093.db2.gz MBKPRNFLFGDIDO-SNVBAGLBSA-N 2 0 202.301 2.431 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2 ZINC000404521626 971170710 /nfs/dbraw/zinc/17/07/10/971170710.db2.gz PVVWTCOOLKXBAL-NNYUYHANSA-N 2 0 210.365 2.281 20 0 BEADRP CCC[C@@H](C)NC(=[NH2+])SCCSC(N)=[NH2+] ZINC001257309708 971201772 /nfs/dbraw/zinc/20/17/72/971201772.db2.gz XAKCDZGLVRMKBG-SSDOTTSWSA-N 2 0 248.421 2.059 20 0 BEADRP CCC[C@@H](C)[NH+]1CCC([NH3+])(CCOC)CC1 ZINC001257314767 971211430 /nfs/dbraw/zinc/21/14/30/971211430.db2.gz ZIVPMVOJALBJRC-GFCCVEGCSA-N 2 0 228.380 2.005 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]CCc2cccc(F)c2)C12CCC2 ZINC000405234156 971212788 /nfs/dbraw/zinc/21/27/88/971212788.db2.gz RZSFDTJANNSJGO-KGLIPLIRSA-N 2 0 248.345 2.228 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]CCCC(F)(F)F)C12CCC2 ZINC000405226230 971214305 /nfs/dbraw/zinc/21/43/05/971214305.db2.gz DEMQUCSPXNJCKQ-IUCAKERBSA-N 2 0 236.281 2.188 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]CCc2ccsc2)C12CCC2 ZINC000405227244 971216148 /nfs/dbraw/zinc/21/61/48/971216148.db2.gz DRRDIZXAZFHNGX-RYUDHWBXSA-N 2 0 236.384 2.150 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+]CCc2ccccc2)C12CCC2 ZINC000405247936 971218975 /nfs/dbraw/zinc/21/89/75/971218975.db2.gz IFRLGQSHKLTBBN-UONOGXRCSA-N 2 0 230.355 2.089 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]C[C@@H]2CCCC2(F)F)C12CCC2 ZINC000405270632 971219138 /nfs/dbraw/zinc/21/91/38/971219138.db2.gz RQJKQKKEAQDXQN-HBNTYKKESA-N 2 0 244.329 2.281 20 0 BEADRP Cc1ccccc1CC[NH2+][C@H]1C[C@H]([NH3+])C12CCC2 ZINC000405261106 971219714 /nfs/dbraw/zinc/21/97/14/971219714.db2.gz OUNQRHCUZLAVBK-GJZGRUSLSA-N 2 0 244.382 2.397 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+][C@H]1C[C@H]([NH3+])C12CCC2 ZINC000405265060 971222871 /nfs/dbraw/zinc/22/28/71/971222871.db2.gz PCSPCOPVOJCMJF-VOAKCMCISA-N 2 0 222.376 2.425 20 0 BEADRP Cc1cscc1C[NH2+][C@@H]1C[C@H]([NH3+])C12CCC2 ZINC000405293349 971225015 /nfs/dbraw/zinc/22/50/15/971225015.db2.gz ZGLDRFBPNLVNME-NWDGAFQWSA-N 2 0 236.384 2.416 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]CC(C2CC2)C2CC2)C12CCC2 ZINC000405282563 971225589 /nfs/dbraw/zinc/22/55/89/971225589.db2.gz CKNPDFFIZXTCJB-KBPBESRZSA-N 2 0 234.387 2.282 20 0 BEADRP CC1(C)[C@@H]([NH3+])C[C@@H]1[NH2+]CCc1cccc(F)c1 ZINC000405309458 971232690 /nfs/dbraw/zinc/23/26/90/971232690.db2.gz ZWHKSYUPRFXVPF-STQMWFEESA-N 2 0 236.334 2.084 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@H]2C[C@H]([NH3+])C23CCC3)C1 ZINC000405350716 971241622 /nfs/dbraw/zinc/24/16/22/971241622.db2.gz NXSCOTFMBMVREK-VOAKCMCISA-N 2 0 222.376 2.425 20 0 BEADRP CCCC1(C[NH2+][C@@H]2C[C@@H]([NH3+])C23CCC3)CC1 ZINC000405345782 971241802 /nfs/dbraw/zinc/24/18/02/971241802.db2.gz KUZRGLMODPQWMR-VXGBXAGGSA-N 2 0 222.376 2.426 20 0 BEADRP CCCC1(C[NH2+][C@H]2C[C@@H]([NH3+])C23CCC3)CC1 ZINC000405345779 971244089 /nfs/dbraw/zinc/24/40/89/971244089.db2.gz KUZRGLMODPQWMR-NEPJUHHUSA-N 2 0 222.376 2.426 20 0 BEADRP CC(C)(C)CC[NH2+][C@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405439410 971252368 /nfs/dbraw/zinc/25/23/68/971252368.db2.gz DGFVGPJOXZRWNE-MNOVXSKESA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]CCCC2CC2)C12CCC2 ZINC000405430236 971254292 /nfs/dbraw/zinc/25/42/92/971254292.db2.gz APYJKRHRJONERA-NEPJUHHUSA-N 2 0 208.349 2.036 20 0 BEADRP CCC1(C[NH2+][C@@H]2C[C@@H]([NH3+])C23CCC3)CC1 ZINC000405480222 971259857 /nfs/dbraw/zinc/25/98/57/971259857.db2.gz MXOHATGBQPPNCA-GHMZBOCLSA-N 2 0 208.349 2.036 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]CC2CCCC2)C12CCC2 ZINC000405473270 971260090 /nfs/dbraw/zinc/26/00/90/971260090.db2.gz LHIMNMDBGKJRCA-NEPJUHHUSA-N 2 0 208.349 2.036 20 0 BEADRP CCC(CC)C[NH2+][C@H]1C[C@H]([NH3+])C12CCC2 ZINC000405465486 971260355 /nfs/dbraw/zinc/26/03/55/971260355.db2.gz JSVJGHXSOKNKQE-RYUDHWBXSA-N 2 0 210.365 2.282 20 0 BEADRP CC[C@H](C)C[C@H](CC)[NH+]1CC2(C1)CC[NH2+]C2 ZINC000724058051 971381740 /nfs/dbraw/zinc/38/17/40/971381740.db2.gz WFXIFAJMTPNKEU-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1OCc1cccc(C[NH3+])c1 ZINC001217779305 971399885 /nfs/dbraw/zinc/39/98/85/971399885.db2.gz CYWJGWFLMKBJPP-DOMZBBRYSA-N 2 0 248.370 2.050 20 0 BEADRP C[C@H]1C[NH2+]CCC[C@H]1OCc1ccccc1C[NH3+] ZINC001217781395 971402438 /nfs/dbraw/zinc/40/24/38/971402438.db2.gz RQEVJOOJZOTSQE-SWLSCSKDSA-N 2 0 248.370 2.050 20 0 BEADRP CCCCC[C@@H](C)[N@H+](C)C[C@@H](C)C[NH3+] ZINC001257504662 971422832 /nfs/dbraw/zinc/42/28/32/971422832.db2.gz YZSIGWYNHNHMCI-NWDGAFQWSA-N 2 0 200.370 2.482 20 0 BEADRP C[N@H+](CC1CC[NH+](C)CC1)[C@@H]1CCCSC1 ZINC001257678297 971481941 /nfs/dbraw/zinc/48/19/41/971481941.db2.gz URQDTSAUPYUONY-CYBMUJFWSA-N 2 0 242.432 2.156 20 0 BEADRP CC(C)OC1CCC([NH2+]CCCC[NH3+])CC1 ZINC001257870705 971513438 /nfs/dbraw/zinc/51/34/38/971513438.db2.gz SCAMXDIGHQCEKD-UHFFFAOYSA-N 2 0 228.380 2.051 20 0 BEADRP CC(C)OC1CCC([N@@H+](C)C[C@@H](C)C[NH3+])CC1 ZINC001257874566 971512978 /nfs/dbraw/zinc/51/29/78/971512978.db2.gz FRHRVBGYQBNLSW-HSBZDZAISA-N 2 0 242.407 2.249 20 0 BEADRP C[C@@H]1CC[C@@H](OCCCCCCC[NH3+])C[NH2+]1 ZINC001217914181 971516051 /nfs/dbraw/zinc/51/60/51/971516051.db2.gz XDBABFLPGVEPGY-CHWSQXEVSA-N 2 0 228.380 2.053 20 0 BEADRP COCC(C)(C)[NH2+]C1CC[NH+](CC(C)C)CC1 ZINC001258002661 971554565 /nfs/dbraw/zinc/55/45/65/971554565.db2.gz YDSNNRKNBVKXOX-UHFFFAOYSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H]1C[NH2+]CCC[C@@H]1Oc1cccc2c1C[NH2+]C2 ZINC001217992411 971561867 /nfs/dbraw/zinc/56/18/67/971561867.db2.gz RHTLLSZMGAJANR-FZMZJTMJSA-N 2 0 246.354 2.057 20 0 BEADRP C[C@H]1C[NH2+]CCC[C@H]1Oc1cccc2c1C[NH2+]C2 ZINC001217992421 971562104 /nfs/dbraw/zinc/56/21/04/971562104.db2.gz RHTLLSZMGAJANR-SMDDNHRTSA-N 2 0 246.354 2.057 20 0 BEADRP C[C@H]([NH3+])c1ccc(O[C@@H]2CCC[NH2+]C[C@H]2C)cc1 ZINC001217996153 971565473 /nfs/dbraw/zinc/56/54/73/971565473.db2.gz QPSOROSLPFKVLO-TYNCELHUSA-N 2 0 248.370 2.473 20 0 BEADRP C[C@H]1C[C@@H](Oc2ccc([C@@H]3C[C@H]3[NH3+])cc2)CC[NH2+]1 ZINC001218054248 971595138 /nfs/dbraw/zinc/59/51/38/971595138.db2.gz YGSGVZJLOCJJIC-FBUXBERBSA-N 2 0 246.354 2.021 20 0 BEADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]CC1CCC1)C2 ZINC001172099066 974342015 /nfs/dbraw/zinc/34/20/15/974342015.db2.gz FECMMCPKCPORJD-ZSOGYDGISA-N 2 0 222.376 2.391 20 0 BEADRP CN1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCCCC1)C2 ZINC001172109428 974371715 /nfs/dbraw/zinc/37/17/15/974371715.db2.gz DCDOFSFFAWXRSA-WDNDVIMCSA-N 2 0 222.376 2.488 20 0 BEADRP [NH3+]Cc1ccccc1O[C@H]1CC[NH2+]C2(CCC2)C1 ZINC001218309263 971704290 /nfs/dbraw/zinc/70/42/90/971704290.db2.gz OYVFPIQWLPVHRV-ZDUSSCGKSA-N 2 0 246.354 2.199 20 0 BEADRP C[C@H]([NH3+])c1ccc(O[C@H]2CC[NH2+]CC2(C)C)cc1 ZINC001218317897 971708305 /nfs/dbraw/zinc/70/83/05/971708305.db2.gz RJXUNRHUVKKDRT-FZMZJTMJSA-N 2 0 248.370 2.473 20 0 BEADRP CCC=CNc1ccc2c(C3C[NH2+]C3)ncn2c1 ZINC001170768159 971771444 /nfs/dbraw/zinc/77/14/44/971771444.db2.gz RKSMKPTZJCKZMA-ZZXKWVIFSA-N 2 0 242.326 2.357 20 0 BEADRP CC[C@H](C)OCC[C@@H](C)[NH2+]CCC[NH+](C)C ZINC001172315464 974521996 /nfs/dbraw/zinc/52/19/96/974521996.db2.gz KFYWCBYUMNUOCR-OLZOCXBDSA-N 2 0 230.396 2.121 20 0 BEADRP CC[C@H](C)OCC[C@@H](C)[NH2+]C[C@@H]1CC[N@H+](C)C1 ZINC001172315677 974522965 /nfs/dbraw/zinc/52/29/65/974522965.db2.gz CLAYFPBLKAVOLF-RDBSUJKOSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H](Cc1ccco1)[N@@H+]1CCC[C@@H]([NH3+])CC1 ZINC001246539080 972532970 /nfs/dbraw/zinc/53/29/70/972532970.db2.gz ATHBRRKLTHOCDE-VXGBXAGGSA-N 2 0 222.332 2.024 20 0 BEADRP C[NH+](C)[C@H]1CC[C@@H]([NH2+][C@@H]2CCCOCC2)CC1 ZINC001170801389 971846691 /nfs/dbraw/zinc/84/66/91/971846691.db2.gz SXPKMQDDOVQVJT-MCIONIFRSA-N 2 0 240.391 2.018 20 0 BEADRP C[NH+](C)[C@H]1CCC[C@@H](Nc2cc[nH+]cc2)C1 ZINC000309981939 971908450 /nfs/dbraw/zinc/90/84/50/971908450.db2.gz WLVYGQGBBVVANU-OLZOCXBDSA-N 2 0 219.332 2.366 20 0 BEADRP [NH3+]C[C@@H]1CCCC[N@H+](CCc2ccccc2)C1 ZINC000310220502 971961208 /nfs/dbraw/zinc/96/12/08/971961208.db2.gz FWGSPVCGXUKEPG-HNNXBMFYSA-N 2 0 232.371 2.290 20 0 BEADRP CC(C)CC[NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000190775231 972053694 /nfs/dbraw/zinc/05/36/94/972053694.db2.gz BTMBUTNOBRIAGZ-QWHCGFSZSA-N 2 0 212.381 2.495 20 0 BEADRP CC(C)(C)c1ccc(N[C@H]([NH3+])CCC[NH3+])cc1 ZINC001170900231 972065549 /nfs/dbraw/zinc/06/55/49/972065549.db2.gz QPGIFXDJYSLVQW-ZDUSSCGKSA-N 2 0 235.375 2.420 20 0 BEADRP CCOC1CCC([NH2+][C@H]2CCCC[NH2+]C2)CC1 ZINC001246089501 972143326 /nfs/dbraw/zinc/14/33/26/972143326.db2.gz FNQXMIVYMGLORE-MOKVOYLWSA-N 2 0 240.391 2.066 20 0 BEADRP CC(C)COCC[C@@H](C)[NH2+][C@@H]1CCCC[NH2+]C1 ZINC001246091942 972145525 /nfs/dbraw/zinc/14/55/25/972145525.db2.gz RAXPWJZIJVDOFN-ZIAGYGMSSA-N 2 0 242.407 2.169 20 0 BEADRP CC(C)COCC[C@@H](C)[NH2+][C@H]1CCCC[NH2+]C1 ZINC001246091937 972146139 /nfs/dbraw/zinc/14/61/39/972146139.db2.gz RAXPWJZIJVDOFN-KGLIPLIRSA-N 2 0 242.407 2.169 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]C[C@@H]1CC[C@@H](C)C[NH2+]1 ZINC001246106356 972169373 /nfs/dbraw/zinc/16/93/73/972169373.db2.gz PPHNKCQJZVKRFW-MDZLAQPJSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H](CC1CC1)[NH2+]C[C@@H]1CCC[NH2+][C@@H]1C ZINC001246105001 972167302 /nfs/dbraw/zinc/16/73/02/972167302.db2.gz AHJLHNOECIPFFY-WZRBSPASSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H](CC1CC1)[NH2+]C[C@H]1CCC[NH2+][C@H]1C ZINC001246104998 972167788 /nfs/dbraw/zinc/16/77/88/972167788.db2.gz AHJLHNOECIPFFY-NTZNESFSSA-N 2 0 210.365 2.153 20 0 BEADRP C[N@@H+]1CCC=C(c2cccc3c2CC[C@H]3[NH3+])C1 ZINC001241571245 1169730882 /nfs/dbraw/zinc/73/08/82/1169730882.db2.gz WQDHSPJQCOSTES-OAHLLOKOSA-N 2 0 228.339 2.352 20 0 BEADRP C[C@@H]1CC[C@@H](C[NH2+]C2CCCCC2)[NH2+]C1 ZINC001246115096 972177329 /nfs/dbraw/zinc/17/73/29/972177329.db2.gz QUABTAXVDRDLMV-YPMHNXCESA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]C[C@@H]2C[NH2+]CC[C@@H]2C)C1 ZINC001246112279 972178124 /nfs/dbraw/zinc/17/81/24/972178124.db2.gz NLBAXZRBFZVIGX-RFGFWPKPSA-N 2 0 224.392 2.400 20 0 BEADRP Cc1[nH+]c(NC[C@H]2CCCC[NH2+]2)cc2[nH]ccc21 ZINC001160151268 972218623 /nfs/dbraw/zinc/21/86/23/972218623.db2.gz SJSPYFODNDKMMT-LLVKDONJSA-N 2 0 244.342 2.425 20 0 BEADRP CC(C)COCC[C@@H](C)[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC001246207090 972216690 /nfs/dbraw/zinc/21/66/90/972216690.db2.gz TZAHHOSLBXQLDV-MGPQQGTHSA-N 2 0 242.407 2.297 20 0 BEADRP c1cc2cc(C[NH2+][C@@H]3CCC[NH2+]CC3)ccc2[nH]1 ZINC001246232737 972238503 /nfs/dbraw/zinc/23/85/03/972238503.db2.gz ZCJRLVXZGYPYRO-CQSZACIVSA-N 2 0 243.354 2.400 20 0 BEADRP C[C@@H](C[NH2+]CC1CC[NH+](C)CC1)c1ccccn1 ZINC000692947989 957014500 /nfs/dbraw/zinc/01/45/00/957014500.db2.gz BGQULSHLDCRDGT-ZDUSSCGKSA-N 2 0 247.386 2.117 20 0 BEADRP C[C@H](C[NH2+]CC1CC[NH+](C)CC1)c1ccccn1 ZINC000692947988 957016463 /nfs/dbraw/zinc/01/64/63/957016463.db2.gz BGQULSHLDCRDGT-CYBMUJFWSA-N 2 0 247.386 2.117 20 0 BEADRP C[C@@H]1C[C@@H](C[N@@H+]2CCC[C@H]([NH3+])CC2)C[C@H](C)O1 ZINC000724501241 957320755 /nfs/dbraw/zinc/32/07/55/957320755.db2.gz JKLWLUYTUFTJCB-CRWXNKLISA-N 2 0 240.391 2.003 20 0 BEADRP C[C@H]([NH3+])CC[NH2+]C1CC(C)(C)OC(C)(C)C1 ZINC001246302891 972265510 /nfs/dbraw/zinc/26/55/10/972265510.db2.gz CSQVYKXAYMRDNF-JTQLQIEISA-N 2 0 228.380 2.050 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H]1CSc2ccccc2C1 ZINC001246307254 972268426 /nfs/dbraw/zinc/26/84/26/972268426.db2.gz UQHQWEBYGVZPJY-JQWIXIFHSA-N 2 0 236.384 2.030 20 0 BEADRP [NH3+]CCc1ccc2c(ccn2C2CC[NH2+]CC2)c1 ZINC001246308313 972270598 /nfs/dbraw/zinc/27/05/98/972270598.db2.gz JZRYSTGOEAWKLV-UHFFFAOYSA-N 2 0 243.354 2.067 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]Cc2ccc3ncoc3c2)CC[NH2+]1 ZINC001246335590 972294796 /nfs/dbraw/zinc/29/47/96/972294796.db2.gz ZPTCXCWDNHTPGS-JQWIXIFHSA-N 2 0 245.326 2.058 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc3ocnc3c2)CC[NH2+]1 ZINC001246332465 972295820 /nfs/dbraw/zinc/29/58/20/972295820.db2.gz MGBPVLOFNZLYOK-PWSUYJOCSA-N 2 0 245.326 2.058 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+][C@@H]2CC[C@H](C)NC2)CC1 ZINC001246365981 972304647 /nfs/dbraw/zinc/30/46/47/972304647.db2.gz WBDZXLQYWUOUOZ-WUHRBBMRSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+][C@H]2CC[C@@H](C)NC2)CC1 ZINC001246365968 972305139 /nfs/dbraw/zinc/30/51/39/972305139.db2.gz WBDZXLQYWUOUOZ-NDBYEHHHSA-N 2 0 210.365 2.295 20 0 BEADRP C[NH2+]Cc1cccc(Nc2c(C)[nH+]cn2C)c1 ZINC001211136531 958045829 /nfs/dbraw/zinc/04/58/29/958045829.db2.gz KNDRCFNRZVGCSG-UHFFFAOYSA-N 2 0 230.315 2.192 20 0 BEADRP C1[C@@H]([NH2+]C2CCC3(CCCC3)CC2)C12C[NH2+]C2 ZINC001246444294 972318629 /nfs/dbraw/zinc/31/86/29/972318629.db2.gz JYWOWXPTXCBDCT-CYBMUJFWSA-N 2 0 234.387 2.441 20 0 BEADRP COc1c[nH+]ccc1Nc1cc[nH+]c2c1CCC2 ZINC001211259897 958128671 /nfs/dbraw/zinc/12/86/71/958128671.db2.gz KRZHGWXQXDXFJM-UHFFFAOYSA-N 2 0 241.294 2.139 20 0 BEADRP C1C[NH2+]C[C@@H]([NH+]2C3CCCC2CCC3)C1 ZINC000707100359 958374742 /nfs/dbraw/zinc/37/47/42/958374742.db2.gz OKPZPRLQKXXDJS-BPCQOVAHSA-N 2 0 208.349 2.145 20 0 BEADRP C[C@@H]1C[NH2+]C[C@@H](C[NH2+]C2CCCCC2)C1 ZINC000398808952 958397258 /nfs/dbraw/zinc/39/72/58/958397258.db2.gz OPXNYVQNCMMJFS-RYUDHWBXSA-N 2 0 210.365 2.154 20 0 BEADRP CCOCC[C@@H](C)[NH2+]CCCC[NH+]1CCCC1 ZINC001172408099 974668726 /nfs/dbraw/zinc/66/87/26/974668726.db2.gz DVKOYAFCLMHNMA-CQSZACIVSA-N 2 0 242.407 2.267 20 0 BEADRP C[N@H+](C[C@H]1C[C@@H]([NH3+])C1)CC1CCCCC1 ZINC000693570473 958865427 /nfs/dbraw/zinc/86/54/27/958865427.db2.gz YKILPNYLMLQHPZ-BETUJISGSA-N 2 0 210.365 2.236 20 0 BEADRP CCC(CC)C[N@H+](CC)C[C@H]1C[C@@H]([NH3+])C1 ZINC000693587163 958892027 /nfs/dbraw/zinc/89/20/27/958892027.db2.gz ZLLJQPUWDPMBOO-BETUJISGSA-N 2 0 212.381 2.482 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+][C@@H]2CCCC[C@H]2C2CC2)C1 ZINC000693602693 958936970 /nfs/dbraw/zinc/93/69/70/958936970.db2.gz MVTOLCGDNQXQTK-DOERSZECSA-N 2 0 222.376 2.282 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCC[C@]12CCC[NH2+]C2 ZINC001222232899 972417179 /nfs/dbraw/zinc/41/71/79/972417179.db2.gz YKXBGZNFJAGNPV-STQMWFEESA-N 2 0 210.365 2.251 20 0 BEADRP CC(C)O[C@@H]1CCC[N@H+](C[C@@H]2CC[C@H]([NH3+])C2)C1 ZINC000404655828 959325571 /nfs/dbraw/zinc/32/55/71/959325571.db2.gz SYFNQVDXAMDRSJ-HZSPNIEDSA-N 2 0 240.391 2.003 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@H+](C)[C@H]1CCCC[C@H]1C ZINC000300356696 959376523 /nfs/dbraw/zinc/37/65/23/959376523.db2.gz OCIMHMAJFFCUSX-MQYQWHSLSA-N 2 0 224.392 2.352 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]CCc2ccccc2)C12CCC2 ZINC000405247938 959421458 /nfs/dbraw/zinc/42/14/58/959421458.db2.gz IFRLGQSHKLTBBN-ZIAGYGMSSA-N 2 0 230.355 2.089 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]CC2(C3CC3)CC2)C12CCC2 ZINC000405258563 959423167 /nfs/dbraw/zinc/42/31/67/959423167.db2.gz HUCMFZNZYPMVDH-NEPJUHHUSA-N 2 0 220.360 2.036 20 0 BEADRP C[C@H]([NH2+][C@H]1C[C@@H]([NH3+])C12CCC2)c1cccnc1 ZINC000405254078 959424458 /nfs/dbraw/zinc/42/44/58/959424458.db2.gz LJTYEXWMQXWGAV-UHTWSYAYSA-N 2 0 231.343 2.002 20 0 BEADRP C[C@@H]([NH2+][C@H]1C[C@H]([NH3+])C12CCC2)C1CCCC1 ZINC000405356472 959446436 /nfs/dbraw/zinc/44/64/36/959446436.db2.gz RHXHTQRWDMFCEP-WXHSDQCUSA-N 2 0 222.376 2.425 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1OCc1ccccc1C[NH3+] ZINC001217781436 959593579 /nfs/dbraw/zinc/59/35/79/959593579.db2.gz LAMBCTMCSJKPMM-DOMZBBRYSA-N 2 0 248.370 2.050 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1OCc1ccccc1C[NH3+] ZINC001217781439 959594257 /nfs/dbraw/zinc/59/42/57/959594257.db2.gz LAMBCTMCSJKPMM-WFASDCNBSA-N 2 0 248.370 2.050 20 0 BEADRP Cc1cccc2c1CC[C@@H]([N@@H+]1CC[C@](C)([NH3+])C1)C2 ZINC001246532155 972444740 /nfs/dbraw/zinc/44/47/40/972444740.db2.gz UMHJDLRHOHQENJ-ZBFHGGJFSA-N 2 0 244.382 2.275 20 0 BEADRP CCCOC1CCC([N@@H+]2CC[C@@](C)([NH3+])C2)CC1 ZINC001246532209 972450816 /nfs/dbraw/zinc/45/08/16/972450816.db2.gz VXIUUERCORYOMS-JXQTWKCFSA-N 2 0 240.391 2.147 20 0 BEADRP CC1(C)C[C@H](OCc2cccc(C[NH3+])c2)CC[NH2+]1 ZINC001217936528 959788303 /nfs/dbraw/zinc/78/83/03/959788303.db2.gz OEWMUAVLABTMTR-CQSZACIVSA-N 2 0 248.370 2.193 20 0 BEADRP C[C@H]([NH3+])c1ccc(O[C@H]2CC[C@@H](C)[NH2+]C2)cc1 ZINC001218408099 960064158 /nfs/dbraw/zinc/06/41/58/960064158.db2.gz PWLQNVDOVKYWSM-SUNKGSAMSA-N 2 0 234.343 2.226 20 0 BEADRP CO[C@@H]1CCC[C@@H]1[NH2+]CCC[NH+]1CCCCC1 ZINC000695446394 960258096 /nfs/dbraw/zinc/25/80/96/960258096.db2.gz BFEHGFQNNKRIAJ-UONOGXRCSA-N 2 0 240.391 2.020 20 0 BEADRP C[C@@H]1CC[N@H+](CCC2CC[NH+](C)CC2)C1 ZINC001207479745 960354898 /nfs/dbraw/zinc/35/48/98/960354898.db2.gz MQTKMWBVSSKZLY-GFCCVEGCSA-N 2 0 210.365 2.060 20 0 BEADRP C[C@H]1CC[N@H+](CCC2CC[NH+](C)CC2)C1 ZINC001207479746 960355864 /nfs/dbraw/zinc/35/58/64/960355864.db2.gz MQTKMWBVSSKZLY-LBPRGKRZSA-N 2 0 210.365 2.060 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCCC2(CC2)C1)[C@H]1CCC[NH2+]1 ZINC000695725402 960404995 /nfs/dbraw/zinc/40/49/95/960404995.db2.gz WWEKUBFVAFTXGF-YNEHKIRRSA-N 2 0 222.376 2.439 20 0 BEADRP C[C@H]1CCCC[N@@H+]1CCCNc1c[nH+]cn1C ZINC001167751966 960541374 /nfs/dbraw/zinc/54/13/74/960541374.db2.gz QEOHOLFDCWGTSB-LBPRGKRZSA-N 2 0 236.363 2.097 20 0 BEADRP FC1(F)CC[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000709401134 960574050 /nfs/dbraw/zinc/57/40/50/960574050.db2.gz AYYAYGKJEBJRLY-GZBOUJLJSA-N 2 0 230.302 2.047 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@@]2(C)CC=CCC2)CC1 ZINC000398499260 960698039 /nfs/dbraw/zinc/69/80/39/960698039.db2.gz YVLLOJDKERUCGP-AWEZNQCLSA-N 2 0 222.376 2.417 20 0 BEADRP [NH2+]=CNc1ccc(CO[C@@H]2CCCC[C@H]2[NH3+])cc1 ZINC001167868098 961357533 /nfs/dbraw/zinc/35/75/33/961357533.db2.gz RIMFKSHLVAICOS-ZIAGYGMSSA-N 2 0 247.342 2.492 20 0 BEADRP C(CC[NH+]1CCCC1)C[NH2+][C@H]1C[C@H]2C[C@H]2C1 ZINC001167893567 961505604 /nfs/dbraw/zinc/50/56/04/961505604.db2.gz IROGPLVWFUPMHF-WDNDVIMCSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@@H](Cc1ccc(Cl)cc1)[NH2+]C1CC([NH3+])C1 ZINC000087651394 961600274 /nfs/dbraw/zinc/60/02/74/961600274.db2.gz OKDCXGMLIIBTLI-ALXWSUNGSA-N 2 0 238.762 2.350 20 0 BEADRP C(C[NH2+][C@H]1C[C@H]2C[C@H]2C1)C[NH+]1CCCCC1 ZINC001167902099 961648162 /nfs/dbraw/zinc/64/81/62/961648162.db2.gz BIIKNVIVFVIPEK-WDNDVIMCSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@H]1CC[C@H]([NH+]2CCN(c3cc[nH+]cc3)CC2)C1 ZINC000092874347 961896022 /nfs/dbraw/zinc/89/60/22/961896022.db2.gz HMADQCBECSBUIZ-ZFWWWQNUSA-N 2 0 245.370 2.392 20 0 BEADRP Cc1cc(C)[nH+]c(N2CC[C@]3(C2)CCC[NH2+]C3)c1 ZINC000709951774 961942279 /nfs/dbraw/zinc/94/22/79/961942279.db2.gz CELTWVVYQQFKIK-OAHLLOKOSA-N 2 0 245.370 2.278 20 0 BEADRP CCC[C@@H](C)C[NH+]1CC2(C1)CCC[NH2+]C2 ZINC000710012509 962213879 /nfs/dbraw/zinc/21/38/79/962213879.db2.gz BPUKZGGJRITGSP-GFCCVEGCSA-N 2 0 210.365 2.108 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)[C@H]1C[C@H]2C[C@H]2C1 ZINC001167956146 962804757 /nfs/dbraw/zinc/80/47/57/962804757.db2.gz KEXHEGFVPVOPEF-ITGUQSILSA-N 2 0 210.365 2.059 20 0 BEADRP Cc1c[nH+]c(N[C@H]2CCC[C@H]([NH3+])C2)cc1C ZINC001154987726 962933010 /nfs/dbraw/zinc/93/30/10/962933010.db2.gz NBSALJLBFSGDHO-RYUDHWBXSA-N 2 0 219.332 2.380 20 0 BEADRP Cc1cc2[nH]ccc2c(N[C@@H]2CC[NH2+][C@@H]2C)[nH+]1 ZINC001155188121 963014910 /nfs/dbraw/zinc/01/49/10/963014910.db2.gz QUZVOILCOOGHOL-MWLCHTKSSA-N 2 0 230.315 2.034 20 0 BEADRP F[C@@H]1C[C@H]1NC1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167966370 963025958 /nfs/dbraw/zinc/02/59/58/963025958.db2.gz UVFURPDBEOSGAO-ZLMOABSSSA-N 2 0 238.350 2.092 20 0 BEADRP CC(C)Oc1cc[nH+]c(N(C)C2CC[NH2+]CC2)c1 ZINC001156175533 963273180 /nfs/dbraw/zinc/27/31/80/963273180.db2.gz IHMHAQAMPOINDN-UHFFFAOYSA-N 2 0 249.358 2.057 20 0 BEADRP CC(C)(C[NH2+][C@@H]1CCC[C@H]1C[NH3+])C(C)(F)F ZINC000696621528 963298397 /nfs/dbraw/zinc/29/83/97/963298397.db2.gz RJYLEFCIUUIXJE-VHSXEESVSA-N 2 0 234.334 2.385 20 0 BEADRP COc1cc[nH+]c(NCC[C@H]2CCC[N@H+](C)C2)c1 ZINC001156380682 963328893 /nfs/dbraw/zinc/32/88/93/963328893.db2.gz IYQSRRHWXIHREL-GFCCVEGCSA-N 2 0 249.358 2.234 20 0 BEADRP CCC(C)(C)CC[N@@H+]1CC[C@H](CC[NH3+])C1 ZINC000696804425 963514450 /nfs/dbraw/zinc/51/44/50/963514450.db2.gz YFHXNZKOEAAOIF-LBPRGKRZSA-N 2 0 212.381 2.483 20 0 BEADRP CCOc1cc[nH+]c(NC2(C)CC[NH2+]CC2)c1 ZINC001157401788 963598694 /nfs/dbraw/zinc/59/86/94/963598694.db2.gz SGMSTEFFPHSNKS-UHFFFAOYSA-N 2 0 235.331 2.034 20 0 BEADRP CCCc1nccn1C[C@@H]1CCCC[NH2+]C1 ZINC000697002605 963623497 /nfs/dbraw/zinc/62/34/97/963623497.db2.gz YULFFQJEKLJDJP-GFCCVEGCSA-N 2 0 221.348 2.225 20 0 BEADRP Cc1[nH+]c(NC2C[NH+](C(C)C)C2)cc2[nH]ccc21 ZINC001157530570 963645417 /nfs/dbraw/zinc/64/54/17/963645417.db2.gz FQAWYKXMNOOMMU-UHFFFAOYSA-N 2 0 244.342 2.376 20 0 BEADRP C[C@@H]1C[C@H](C)[N@H+](C[C@H]2CCCC[NH2+]C2)C1 ZINC000697043516 963668048 /nfs/dbraw/zinc/66/80/48/963668048.db2.gz WPHMLVHMZILBKJ-AGIUHOORSA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@@H](C)C[N@H+](C)C[C@@H]1CCCC[NH2+]C1 ZINC000697043910 963668101 /nfs/dbraw/zinc/66/81/01/963668101.db2.gz XPIYHECUAPIJEY-CHWSQXEVSA-N 2 0 212.381 2.354 20 0 BEADRP CC1(Nc2cccc3c2CC[C@H]3[NH3+])CC[NH2+]CC1 ZINC001168188282 963949360 /nfs/dbraw/zinc/94/93/60/963949360.db2.gz QQONLKPPRUDQIB-CYBMUJFWSA-N 2 0 245.370 2.187 20 0 BEADRP CN(C)c1cc(NC=CC2CC[NH2+]CC2)cc[nH+]1 ZINC001159261338 964040566 /nfs/dbraw/zinc/04/05/66/964040566.db2.gz HMEHYIDQRROSPV-WEVVVXLNSA-N 2 0 246.358 2.073 20 0 BEADRP c1cc2c(c(NC3=CCC[NH2+]CC3)c1)CC[NH2+]C2 ZINC001159547547 964122873 /nfs/dbraw/zinc/12/28/73/964122873.db2.gz DYGSUHAFVXKLQH-UHFFFAOYSA-N 2 0 243.354 2.012 20 0 BEADRP C(Nc1ccc2c(c1)C[NH2+]CC2)=C1CC[NH2+]CC1 ZINC001159608609 964130333 /nfs/dbraw/zinc/13/03/33/964130333.db2.gz CGDSWNLKWPRTPG-UHFFFAOYSA-N 2 0 243.354 2.012 20 0 BEADRP c1cc2c(cc1NC1=C[NH2+]CCC1)CC[NH2+]CC2 ZINC001159682049 964151164 /nfs/dbraw/zinc/15/11/64/964151164.db2.gz SSPRPZSWKMMIDR-UHFFFAOYSA-N 2 0 243.354 2.012 20 0 BEADRP c1cc([C@H]2CC[NH2+]C2)ccc1NC1=CC[NH2+]CC1 ZINC001159775470 964190228 /nfs/dbraw/zinc/19/02/28/964190228.db2.gz KIVXFAHJYSZNLV-ZDUSSCGKSA-N 2 0 243.354 2.053 20 0 BEADRP CC[NH2+]Cc1cccc(NC2=CCC[NH2+]C2)c1 ZINC001159955950 964233717 /nfs/dbraw/zinc/23/37/17/964233717.db2.gz ARQFZEQFJPRSNQ-UHFFFAOYSA-N 2 0 231.343 2.085 20 0 BEADRP C[NH+](C)C1CCC([NH+]2CC(C)(C)C2)CC1 ZINC001168316442 964430469 /nfs/dbraw/zinc/43/04/69/964430469.db2.gz YTXUWAWDMXYMLW-UHFFFAOYSA-N 2 0 210.365 2.201 20 0 BEADRP C[C@@H](CC[NH2+]C[C@@H]1CC=CCC1)[NH+](C)C ZINC000697877836 964604138 /nfs/dbraw/zinc/60/41/38/964604138.db2.gz FPBGTFPLRADVLR-QWHCGFSZSA-N 2 0 210.365 2.273 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)c1cscn1 ZINC000697892763 964652636 /nfs/dbraw/zinc/65/26/36/964652636.db2.gz QTYXYHZGBUOPDO-VHSXEESVSA-N 2 0 239.388 2.182 20 0 BEADRP C[NH+](C)CCCCNc1ccc2c(c1)C[NH2+]C2 ZINC001161730965 964720762 /nfs/dbraw/zinc/72/07/62/964720762.db2.gz MDYMTZNZAIBIBF-UHFFFAOYSA-N 2 0 233.359 2.044 20 0 BEADRP CC(C)Oc1cc[nH+]c(N[C@H]2C[C@@](C)([NH3+])C2)c1 ZINC001162328729 964934416 /nfs/dbraw/zinc/93/44/16/964934416.db2.gz YLIQOVIFYYBXEN-GSJFWJNXSA-N 2 0 235.331 2.161 20 0 BEADRP [NH3+][C@@H]1CCC[C@H](Nc2c[nH+]cc3cc[nH]c32)C1 ZINC001162396447 964956660 /nfs/dbraw/zinc/95/66/60/964956660.db2.gz JJMOZTVQHVQLDO-MNOVXSKESA-N 2 0 230.315 2.245 20 0 BEADRP [NH3+][C@H]1CCc2c1cccc2N[C@H]1CCC[C@@H]([NH3+])C1 ZINC001162404766 964961664 /nfs/dbraw/zinc/96/16/64/964961664.db2.gz QNAJFPMAUQWCNZ-SUNKGSAMSA-N 2 0 245.370 2.314 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H](Nc2cccc3c2C[NH2+]CC3)C1 ZINC001162402581 964962515 /nfs/dbraw/zinc/96/25/15/964962515.db2.gz UISXVVYIUVWMOI-CHWSQXEVSA-N 2 0 245.370 2.014 20 0 BEADRP [NH3+][C@H]1CCC[C@@H](Nc2cccc3c2C[NH2+]CC3)C1 ZINC001162402583 964963004 /nfs/dbraw/zinc/96/30/04/964963004.db2.gz UISXVVYIUVWMOI-QWHCGFSZSA-N 2 0 245.370 2.014 20 0 BEADRP Cc1c(N)cc[nH+]c1NC[C@@H]1CCC[NH2+]C[C@H]1C ZINC001162454446 964984509 /nfs/dbraw/zinc/98/45/09/964984509.db2.gz OJGIUIPLXKGIGP-PWSUYJOCSA-N 2 0 248.374 2.020 20 0 BEADRP CCc1cc(NC[C@@H]2CCC[NH2+]C[C@@H]2C)cc[nH+]1 ZINC001162471980 964987524 /nfs/dbraw/zinc/98/75/24/964987524.db2.gz RZABEZOVYUPLGY-STQMWFEESA-N 2 0 247.386 2.114 20 0 BEADRP C[C@H]([NH2+][C@@H]1C=CCC1)C1CC[NH+](C)CC1 ZINC000698207359 965107231 /nfs/dbraw/zinc/10/72/31/965107231.db2.gz WLVFBEALUMOTGD-WCQYABFASA-N 2 0 208.349 2.025 20 0 BEADRP C[C@H]1[NH2+]CC[C@H]1Nc1cc[nH+]c(C2CC2)c1 ZINC001162675946 965109094 /nfs/dbraw/zinc/10/90/94/965109094.db2.gz IROYVMALMJPYFC-BXKDBHETSA-N 2 0 217.316 2.121 20 0 BEADRP C[C@H]1CCCC[N@@H+]1CCCNc1cccc(N)[nH+]1 ZINC000168744478 965120573 /nfs/dbraw/zinc/12/05/73/965120573.db2.gz XZCYSRHYXJNSNU-LBPRGKRZSA-N 2 0 248.374 2.340 20 0 BEADRP C1=C[C@H]([NH2+][C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)CC1 ZINC000698277947 965171841 /nfs/dbraw/zinc/17/18/41/965171841.db2.gz MSEXMNOJWLCOEG-XDQVBPFNSA-N 2 0 220.360 2.215 20 0 BEADRP Cc1cc(C)[nH+]c(NC[C@@H]2CC[NH2+]C[C@@H]2F)c1 ZINC001162802539 965186338 /nfs/dbraw/zinc/18/63/38/965186338.db2.gz VJBKHOKQXFKBCD-RYUDHWBXSA-N 2 0 237.322 2.058 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@H]1CCCC[C@H]1C1CC1 ZINC000696000830 965208388 /nfs/dbraw/zinc/20/83/88/965208388.db2.gz GHDGUOSKLJLVPF-UNQGMJICSA-N 2 0 236.403 2.400 20 0 BEADRP C[C@H]([NH3+])c1ccc(N[C@H]2CC[C@@H]3C[NH2+]C[C@@H]32)cc1 ZINC001163266805 965320049 /nfs/dbraw/zinc/32/00/49/965320049.db2.gz BRUHHFSNBOQPAY-FDEJFUCISA-N 2 0 245.370 2.116 20 0 BEADRP C[NH+]1CC2(C1)CC[NH+](C1CCCCC1)CC2 ZINC001257460870 1169869110 /nfs/dbraw/zinc/86/91/10/1169869110.db2.gz CYWHTLWHEKKVGM-UHFFFAOYSA-N 2 0 222.376 2.347 20 0 BEADRP Cc1c2[nH+]c[nH]c2ccc1N[C@H](C)C[NH+](C)C ZINC001163777283 965581869 /nfs/dbraw/zinc/58/18/69/965581869.db2.gz VFQQGKZHEPTUBH-SECBINFHSA-N 2 0 232.331 2.233 20 0 BEADRP [NH3+][C@H]1CCC[N@H+](Cc2c[nH]c3ccccc23)CC1 ZINC001205095200 965739197 /nfs/dbraw/zinc/73/91/97/965739197.db2.gz VEQCZXYVYLYTKO-ZDUSSCGKSA-N 2 0 243.354 2.481 20 0 BEADRP C[C@H]1C[N@@H+](CC2C[C@H]3CC[C@@H](C2)[NH2+]3)CC[C@@H]1C ZINC000699202794 965804422 /nfs/dbraw/zinc/80/44/22/965804422.db2.gz DTZZHSWJOMJVIT-UUQIVFDPSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@H](Cc1cccc(F)c1)[N@@H+](C)C[C@@H](C)C[NH3+] ZINC001168465695 965814607 /nfs/dbraw/zinc/81/46/07/965814607.db2.gz VGVYVYHVFCXZTQ-NWDGAFQWSA-N 2 0 238.350 2.283 20 0 BEADRP Cc1c(O)cccc1C[N@@H+]1CCC[C@@H]([NH3+])CC1 ZINC001205110103 965835246 /nfs/dbraw/zinc/83/52/46/965835246.db2.gz OQZLQGSGZLJMDT-CYBMUJFWSA-N 2 0 234.343 2.014 20 0 BEADRP C[C@@H]1CC[C@H](C[NH3+])CN1c1[nH+]ccc2[nH]ccc21 ZINC001164456852 965890580 /nfs/dbraw/zinc/89/05/80/965890580.db2.gz TUYOITFPQGEGCK-GHMZBOCLSA-N 2 0 244.342 2.127 20 0 BEADRP COC1(C[NH2+][C@@H]2CCC[C@H]([NH+](C)C)C2)CCC1 ZINC000715202145 965947927 /nfs/dbraw/zinc/94/79/27/965947927.db2.gz NKDDMZPTKKPWIG-OLZOCXBDSA-N 2 0 240.391 2.018 20 0 BEADRP Cc1[nH+]c(N2CC(C)([NH+](C)C)C2)cc2[nH]ccc21 ZINC001165120107 965962270 /nfs/dbraw/zinc/96/22/70/965962270.db2.gz IFDIOGQZIGMIPT-UHFFFAOYSA-N 2 0 244.342 2.012 20 0 BEADRP Cc1ccc(N2CCC3(CC([NH3+])C3)CC2)[nH+]c1C ZINC001165243066 966005124 /nfs/dbraw/zinc/00/51/24/966005124.db2.gz FNNLTMFIAKWYFB-UHFFFAOYSA-N 2 0 245.370 2.406 20 0 BEADRP Cc1c(N)cc[nH+]c1NCC[C@@H]1CCC[N@@H+](C)C1 ZINC001165261316 966010100 /nfs/dbraw/zinc/01/01/00/966010100.db2.gz NZCNXJUKRFZTRA-LBPRGKRZSA-N 2 0 248.374 2.116 20 0 BEADRP Cc1ccc(NCC[C@@H]2CCC[N@@H+](C)C2)[nH+]c1N ZINC001165261014 966013628 /nfs/dbraw/zinc/01/36/28/966013628.db2.gz LJNFKSFAKBTPTN-LBPRGKRZSA-N 2 0 248.374 2.116 20 0 BEADRP COc1ccc(C[N@@H+]2C[C@H](C)[C@H](C[NH3+])C2)c(C)c1 ZINC001205140929 966023984 /nfs/dbraw/zinc/02/39/84/966023984.db2.gz SPHCVRKRUDFFKU-GXTWGEPZSA-N 2 0 248.370 2.030 20 0 BEADRP CC1(C[NH3+])C[NH+](CCC2CCCCC2)C1 ZINC001206712198 966258518 /nfs/dbraw/zinc/25/85/18/966258518.db2.gz WJACIIYSROWGLE-UHFFFAOYSA-N 2 0 210.365 2.237 20 0 BEADRP c1cc(C[N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)cs1 ZINC001236314488 966366889 /nfs/dbraw/zinc/36/68/89/966366889.db2.gz OPUXJBVJDQJWGR-BETUJISGSA-N 2 0 236.384 2.180 20 0 BEADRP C[NH2+]C[C@H]1CCC[N@@H+]1CC1Cc2ccccc2C1 ZINC001236421039 966425364 /nfs/dbraw/zinc/42/53/64/966425364.db2.gz RZNVAMQVANYHMS-MRXNPFEDSA-N 2 0 244.382 2.085 20 0 BEADRP C[NH2+]Cc1cccc(Nc2cc(N)cc[nH+]2)c1 ZINC001167033044 966526181 /nfs/dbraw/zinc/52/61/81/966526181.db2.gz QABCSPSUDNGDPI-UHFFFAOYSA-N 2 0 228.299 2.127 20 0 BEADRP CC[N@H+]1C[C@@H]2C[NH+](Cc3cccc(C)c3)C[C@@H]2C1 ZINC001203893544 966814348 /nfs/dbraw/zinc/81/43/48/966814348.db2.gz KKIBSMRFIBVLPR-IYBDPMFKSA-N 2 0 244.382 2.379 20 0 BEADRP C[N@@H+]1CC[C@@H]2C[NH+](Cc3cccs3)C[C@@H]2C1 ZINC001204012822 966851806 /nfs/dbraw/zinc/85/18/06/966851806.db2.gz PAJILZYICLAAEP-NEPJUHHUSA-N 2 0 236.384 2.132 20 0 BEADRP Cc1c(N)cc[nH+]c1N[C@H]1CCCC[C@@H]1[NH+](C)C ZINC001168593398 966960127 /nfs/dbraw/zinc/96/01/27/966960127.db2.gz MOMDGADFHAPWLQ-STQMWFEESA-N 2 0 248.374 2.257 20 0 BEADRP Cc1ccc([C@@H](C)CCN2CCC[NH2+]CC2)o1 ZINC001204654896 967116817 /nfs/dbraw/zinc/11/68/17/967116817.db2.gz BPAZDJGXPWTWNS-LBPRGKRZSA-N 2 0 236.359 2.377 20 0 BEADRP CC1=C[C@H](C)[C@H](C[N@@H+]2CC[C@@](C)([NH3+])C2)CC1 ZINC001204762773 967153858 /nfs/dbraw/zinc/15/38/58/967153858.db2.gz DFNNKZOISLXKRU-MELADBBJSA-N 2 0 222.376 2.402 20 0 BEADRP C[NH+](C)C1CCC([NH2+]CCCCCCO)CC1 ZINC000715578622 967191059 /nfs/dbraw/zinc/19/10/59/967191059.db2.gz FOMBMWSWWXNUSM-UHFFFAOYSA-N 2 0 242.407 2.002 20 0 BEADRP C[NH+](C)C1CCC([NH2+]CCc2cccnc2)CC1 ZINC000715585798 967194974 /nfs/dbraw/zinc/19/49/74/967194974.db2.gz WGUOXVZAFZZGEA-UHFFFAOYSA-N 2 0 247.386 2.087 20 0 BEADRP CC/C=C\CC[N@@H+]1CCC[C@H](C[NH2+]C)C1 ZINC001205000295 967283714 /nfs/dbraw/zinc/28/37/14/967283714.db2.gz CSTVJVWPKFKXFU-DSYXLKISSA-N 2 0 210.365 2.274 20 0 BEADRP C[C@H]1CC[C@@H](C[NH3+])N1Cc1ccc2cc[nH]c2c1 ZINC001205064074 967311022 /nfs/dbraw/zinc/31/10/22/967311022.db2.gz GKYCSTZMSWQDPJ-FZMZJTMJSA-N 2 0 243.354 2.480 20 0 BEADRP Cc1ccc(CN2[C@@H](C)CC[C@H]2C[NH3+])cc1O ZINC001205082253 967335105 /nfs/dbraw/zinc/33/51/05/967335105.db2.gz DMPGIQPOAXGCIY-AAEUAGOBSA-N 2 0 234.343 2.012 20 0 BEADRP COC1CCC(C[N@@H+]2CCC[C@H]([NH3+])CC2)CC1 ZINC001205094592 967338746 /nfs/dbraw/zinc/33/87/46/967338746.db2.gz NDSOXTXOJHCDRO-MOKVOYLWSA-N 2 0 240.391 2.005 20 0 BEADRP CCOc1cccc(C[N@@H+]2CCC[C@H]([NH3+])CC2)c1 ZINC001205102607 967343959 /nfs/dbraw/zinc/34/39/59/967343959.db2.gz UKJNEMIPWOVCOR-AWEZNQCLSA-N 2 0 248.370 2.399 20 0 BEADRP [NH3+][C@H]1CCC[N@H+](Cc2cccc3cc[nH]c32)CC1 ZINC001205109297 967354629 /nfs/dbraw/zinc/35/46/29/967354629.db2.gz DPYPWTDLOONJDJ-AWEZNQCLSA-N 2 0 243.354 2.481 20 0 BEADRP [NH3+][C@@H]1CCC[N@H+](Cc2ccc3ncoc3c2)CC1 ZINC001205117771 967364245 /nfs/dbraw/zinc/36/42/45/967364245.db2.gz UVXCOCGRXCHBDG-GFCCVEGCSA-N 2 0 245.326 2.141 20 0 BEADRP COc1c(C)cccc1C[N@@H+]1C[C@H](C)[C@H](C[NH3+])C1 ZINC001205150728 967397353 /nfs/dbraw/zinc/39/73/53/967397353.db2.gz IVMRGZWWIXYJSU-GXTWGEPZSA-N 2 0 248.370 2.030 20 0 BEADRP C[C@H]1c2ccccc2CC[N@H+]1CCCC[NH3+] ZINC001205164928 967408071 /nfs/dbraw/zinc/40/80/71/967408071.db2.gz WNFYGEBJVWXEDP-LBPRGKRZSA-N 2 0 218.344 2.345 20 0 BEADRP CC1=C[C@@H](C)[C@@H](C[N@H+]2CC[C@@H]([NH3+])[C@H]2C)CC1 ZINC001205171103 967409888 /nfs/dbraw/zinc/40/98/88/967409888.db2.gz KRNPMNNURRBRGZ-AAVRWANBSA-N 2 0 222.376 2.400 20 0 BEADRP CC1(C[N@@H+]2CCC[C@@](C)([NH3+])CC2)CCOCC1 ZINC001205255022 967444555 /nfs/dbraw/zinc/44/45/55/967444555.db2.gz DVYXUCYTIQATIO-CQSZACIVSA-N 2 0 240.391 2.006 20 0 BEADRP C[C@@]1([NH3+])CCC[N@H+](CC2CCSCC2)CC1 ZINC001205255434 967445647 /nfs/dbraw/zinc/44/56/47/967445647.db2.gz IYPXSZXBYFTKJF-CYBMUJFWSA-N 2 0 242.432 2.333 20 0 BEADRP C[C@@H](C[N@@H+]1CCC[C@](C)([NH3+])CC1)C(F)(F)F ZINC001205255006 967446628 /nfs/dbraw/zinc/44/66/28/967446628.db2.gz DORUXEYVZNXBLV-UWVGGRQHSA-N 2 0 238.297 2.388 20 0 BEADRP C[C@]1([NH3+])CCC[N@H+](Cc2cccs2)CC1 ZINC001205263861 967456971 /nfs/dbraw/zinc/45/69/71/967456971.db2.gz CXJBDKBLTCVSBV-LBPRGKRZSA-N 2 0 224.373 2.451 20 0 BEADRP COc1cccc(C[N@@H+]2CCC[C@@](C)([NH3+])CC2)c1 ZINC001205266656 967457977 /nfs/dbraw/zinc/45/79/77/967457977.db2.gz VLZYTCTZSYCTQQ-OAHLLOKOSA-N 2 0 248.370 2.399 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@@](C)([NH3+])CC2)cc1O ZINC001205288845 967482218 /nfs/dbraw/zinc/48/22/18/967482218.db2.gz PADJCWIQHYAWOY-OAHLLOKOSA-N 2 0 248.370 2.404 20 0 BEADRP Cc1ccc(O)cc1C[N@@H+]1CCC[C@](C)([NH3+])CC1 ZINC001205296024 967498401 /nfs/dbraw/zinc/49/84/01/967498401.db2.gz DWPANXAHJJLRGJ-HNNXBMFYSA-N 2 0 248.370 2.404 20 0 BEADRP CC[NH+]1CCC(C[NH2+]C(C)(C)CCOC)CC1 ZINC001205347170 967561239 /nfs/dbraw/zinc/56/12/39/967561239.db2.gz LGARYDDQXYLIFC-UHFFFAOYSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@H](CC[NH2+][C@H]1CCCOC1)[NH+]1CCCCC1 ZINC001205391965 967615053 /nfs/dbraw/zinc/61/50/53/967615053.db2.gz XXESBNMUZGWNEF-KGLIPLIRSA-N 2 0 240.391 2.020 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@@](F)(C[NH3+])CC2)o1 ZINC001205546470 967692733 /nfs/dbraw/zinc/69/27/33/967692733.db2.gz VYBIBZLSELWPPF-ZDUSSCGKSA-N 2 0 240.322 2.241 20 0 BEADRP C[C@@H]1CC[N@H+](Cc2ccco2)CC[C@H]1C[NH3+] ZINC001205601950 967720353 /nfs/dbraw/zinc/72/03/53/967720353.db2.gz HCMMXMUGGXKSRQ-NEPJUHHUSA-N 2 0 222.332 2.086 20 0 BEADRP C[C@@H]1CC[N@H+](Cc2ccccc2)CC[C@H]1C[NH3+] ZINC001205603626 967721506 /nfs/dbraw/zinc/72/15/06/967721506.db2.gz RHXGYYZFKVABAN-HIFRSBDPSA-N 2 0 232.371 2.493 20 0 BEADRP Cc1ncccc1C[N@H+]1CC[C@@H](C)[C@@H](C[NH3+])CC1 ZINC001205618429 967725313 /nfs/dbraw/zinc/72/53/13/967725313.db2.gz VWFXTYUPXJKEDL-TZMCWYRMSA-N 2 0 247.386 2.197 20 0 BEADRP Cc1cncc(C[N@@H+]2CC[C@@H](C[NH3+])[C@@H](C)CC2)c1 ZINC001205617585 967727663 /nfs/dbraw/zinc/72/76/63/967727663.db2.gz LCGYTXNEGSYDRW-ZFWWWQNUSA-N 2 0 247.386 2.197 20 0 BEADRP Cc1cc(C[N@H+]2CC[C@@H](C)[C@H](C[NH3+])CC2)ccn1 ZINC001205617566 967729282 /nfs/dbraw/zinc/72/92/82/967729282.db2.gz KZNMVPWQPNSPCK-DOMZBBRYSA-N 2 0 247.386 2.197 20 0 BEADRP C[C@@H]1CC[N@H+](Cc2ccccc2N)CC[C@H]1C[NH3+] ZINC001205653354 967743349 /nfs/dbraw/zinc/74/33/49/967743349.db2.gz SVVZKTXARLWYFJ-OLZOCXBDSA-N 2 0 247.386 2.076 20 0 BEADRP [NH3+]C[C@H]1C[N@H+](C[C@@H]2CC=CCC2)CCC1(F)F ZINC001205736237 967809680 /nfs/dbraw/zinc/80/96/80/967809680.db2.gz WVULZPXPEZYLIN-NEPJUHHUSA-N 2 0 244.329 2.259 20 0 BEADRP COCC1([N@H+](C)CCCCCCC[NH3+])CC1 ZINC000706376056 967915098 /nfs/dbraw/zinc/91/50/98/967915098.db2.gz GMKPVILLQMJUEP-UHFFFAOYSA-N 2 0 228.380 2.006 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H](C)c1cccc(F)c1 ZINC001118059713 967922354 /nfs/dbraw/zinc/92/23/54/967922354.db2.gz SLJLQRBRUADJNL-MNOVXSKESA-N 2 0 224.323 2.474 20 0 BEADRP COC(C)(C)CC[N@@H+]1CCC[C@H](C[NH3+])[C@H](C)C1 ZINC001205981913 967925246 /nfs/dbraw/zinc/92/52/46/967925246.db2.gz JBPQENOEYBIOTN-CHWSQXEVSA-N 2 0 242.407 2.108 20 0 BEADRP CC(C)CC[N@@H+]1CCC[C@H](C[NH3+])[C@H](C)C1 ZINC001205983997 967928286 /nfs/dbraw/zinc/92/82/86/967928286.db2.gz QUDZGQLMXXNTMC-CHWSQXEVSA-N 2 0 212.381 2.339 20 0 BEADRP Cc1ncccc1C[N@@H+]1CCC[C@H](C[NH3+])[C@H](C)C1 ZINC001205991438 967940777 /nfs/dbraw/zinc/94/07/77/967940777.db2.gz ASKJQXBHIASASS-TZMCWYRMSA-N 2 0 247.386 2.197 20 0 BEADRP C[C@H]1C[N@H+](Cc2ccc(O)cc2)CCC[C@H]1C[NH3+] ZINC001205996136 967950707 /nfs/dbraw/zinc/95/07/07/967950707.db2.gz VAGORDGSOJGFMQ-JSGCOSHPSA-N 2 0 248.370 2.199 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@@H](C[NH3+])[C@@H](C)C2)cn1 ZINC001206003529 967955402 /nfs/dbraw/zinc/95/54/02/967955402.db2.gz IZYZPZBPWCOLCK-WFASDCNBSA-N 2 0 247.386 2.197 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@@H](C[NH3+])[C@@H](C)C2)nc1 ZINC001206003766 967958144 /nfs/dbraw/zinc/95/81/44/967958144.db2.gz MKJKRTVFOPQJDG-KBPBESRZSA-N 2 0 247.386 2.197 20 0 BEADRP C[C@@H]1C[N@H+](Cc2ccccc2N)CCC[C@H]1C[NH3+] ZINC001206026209 967979840 /nfs/dbraw/zinc/97/98/40/967979840.db2.gz QXMJLTNAHKHDIN-OLZOCXBDSA-N 2 0 247.386 2.076 20 0 BEADRP Cc1cc(C[N@@H+]2CC[C@@H]([NH3+])[C@@H](F)CC2)cs1 ZINC001206214218 968146251 /nfs/dbraw/zinc/14/62/51/968146251.db2.gz XWTCNWDLLMULDH-NWDGAFQWSA-N 2 0 242.363 2.318 20 0 BEADRP C[C@]1(C[NH3+])CCC[N@H+](Cc2ccco2)CC1 ZINC001206296766 968197564 /nfs/dbraw/zinc/19/75/64/968197564.db2.gz URMFLIYDYKDDRJ-ZDUSSCGKSA-N 2 0 222.332 2.231 20 0 BEADRP C[C@]1(C[NH3+])CCC[N@H+](Cc2ccccn2)CC1 ZINC001206297224 968204641 /nfs/dbraw/zinc/20/46/41/968204641.db2.gz WSWVEQOBRWJSEH-AWEZNQCLSA-N 2 0 233.359 2.033 20 0 BEADRP C[C@@]1(C[NH3+])CCC[N@H+](Cc2ccccn2)CC1 ZINC001206297226 968208195 /nfs/dbraw/zinc/20/81/95/968208195.db2.gz WSWVEQOBRWJSEH-CQSZACIVSA-N 2 0 233.359 2.033 20 0 BEADRP Cc1ccc2c(c1)[nH+]ccc2N1CC[C@H]([NH3+])C1 ZINC001164287317 968211125 /nfs/dbraw/zinc/21/11/25/968211125.db2.gz FYVBMKZJADFGNQ-NSHDSACASA-N 2 0 227.311 2.081 20 0 BEADRP Cc1ccnc(C[N@@H+]2CCC[C@](C)(C[NH3+])CC2)c1 ZINC001206304612 968211948 /nfs/dbraw/zinc/21/19/48/968211948.db2.gz NFFUGLWLJPDSBC-HNNXBMFYSA-N 2 0 247.386 2.341 20 0 BEADRP CC/C=C\CC[N@@H+]1CCCC[C@](F)(CN)C1 ZINC001206335326 968237704 /nfs/dbraw/zinc/23/77/04/968237704.db2.gz FAZPLCCATPNGBI-SCOBNMCVSA-N 2 0 228.355 2.496 20 0 BEADRP CSCCC[N@@H+]1CCCC[C@](C)(C[NH3+])C1 ZINC001206541995 968365621 /nfs/dbraw/zinc/36/56/21/968365621.db2.gz ORJGTAOOBATCIJ-GFCCVEGCSA-N 2 0 230.421 2.190 20 0 BEADRP COC(C)(C)CC[N@@H+]1CCCC[C@](C)(C[NH3+])C1 ZINC001206542086 968367509 /nfs/dbraw/zinc/36/75/09/968367509.db2.gz QZBFUMDVKPSBGJ-CQSZACIVSA-N 2 0 242.407 2.252 20 0 BEADRP Cc1ccc(C[N@@H+]2CCCC[C@@](C)(C[NH3+])C2)[nH]1 ZINC001206549558 968375104 /nfs/dbraw/zinc/37/51/04/968375104.db2.gz OTQRCAKXRBYHDH-AWEZNQCLSA-N 2 0 235.375 2.274 20 0 BEADRP Cc1cc(C[N@@H+]2CCCC[C@H](C[NH3+])C2)oc1C ZINC001206615566 968418634 /nfs/dbraw/zinc/41/86/34/968418634.db2.gz JBWZXRQXTVYMJI-CYBMUJFWSA-N 2 0 236.359 2.457 20 0 BEADRP C[C@@H]1CC[C@H]([N@H+](C)C2CCC([NH3+])CC2)C1 ZINC000085869179 968508516 /nfs/dbraw/zinc/50/85/16/968508516.db2.gz GLRZLXGJJPLQRQ-XVSSEFHLSA-N 2 0 210.365 2.377 20 0 BEADRP C[C@H](CC1CCC1)[NH2+]CC[C@H](C)[NH+](C)C ZINC000700456700 968567203 /nfs/dbraw/zinc/56/72/03/968567203.db2.gz WVQKSVYDLCIKBS-NEPJUHHUSA-N 2 0 212.381 2.495 20 0 BEADRP CCCC[C@@H](O)C[NH2+]CCC[N@H+](C)CCCC ZINC001252108955 968593352 /nfs/dbraw/zinc/59/33/52/968593352.db2.gz UDUQUVIKASKVDV-CQSZACIVSA-N 2 0 244.423 2.249 20 0 BEADRP CC[N@@H+]1CCc2cc(C3=CCC[NH2+]C3)ccc2C1 ZINC001240658434 968625898 /nfs/dbraw/zinc/62/58/98/968625898.db2.gz CEJXDSLPRDLPJE-UHFFFAOYSA-N 2 0 242.366 2.441 20 0 BEADRP [NH3+]C1(c2ccccc2C2=CCC[NH2+]C2)CC1 ZINC001240670116 968635254 /nfs/dbraw/zinc/63/52/54/968635254.db2.gz FMXBBKNBKXZIMN-UHFFFAOYSA-N 2 0 214.312 2.011 20 0 BEADRP C=Cc1cccc(C[NH+]2CCC([NH3+])CC2)c1 ZINC001240831872 968729433 /nfs/dbraw/zinc/72/94/33/968729433.db2.gz YBMHIGLCHNVUCN-UHFFFAOYSA-N 2 0 216.328 2.253 20 0 BEADRP C(C1CC[NH2+]CC1)[N@@H+]1CC[C@H]2CCC[C@@H]2C1 ZINC001207436018 968768542 /nfs/dbraw/zinc/76/85/42/968768542.db2.gz RZNCDFWHZQUDPA-ZIAGYGMSSA-N 2 0 222.376 2.108 20 0 BEADRP FC1(F)CCCC[N@H+](CC2CC[NH2+]CC2)C1 ZINC001207436530 968770982 /nfs/dbraw/zinc/77/09/82/968770982.db2.gz MVGNFWYFZVTSCZ-UHFFFAOYSA-N 2 0 232.318 2.107 20 0 BEADRP C(c1cccc2c1CC[NH2+]C2)=C1CC[NH2+]CC1 ZINC001240877648 968786931 /nfs/dbraw/zinc/78/69/31/968786931.db2.gz FWBPMJNAOMLDGE-UHFFFAOYSA-N 2 0 228.339 2.099 20 0 BEADRP C[N@H+](CCC1CC[NH+](C)CC1)Cc1ccccn1 ZINC001207480171 968797618 /nfs/dbraw/zinc/79/76/18/968797618.db2.gz VTVSUAKTPROGAY-UHFFFAOYSA-N 2 0 247.386 2.245 20 0 BEADRP C[NH+]1CCC(CC[N@H+]2C[C@@H]3[C@H](C2)C3(C)C)CC1 ZINC001207486036 968799585 /nfs/dbraw/zinc/79/95/85/968799585.db2.gz BSUUNJCADMCQJT-OKILXGFUSA-N 2 0 236.403 2.306 20 0 BEADRP CC(C)[C@H]1CCC[N@@H+]1C[C@@H]1CCCC[NH2+]C1 ZINC000829274395 968824367 /nfs/dbraw/zinc/82/43/67/968824367.db2.gz DCHQHNYNBPYUFW-ZIAGYGMSSA-N 2 0 224.392 2.497 20 0 BEADRP [NH3+][C@H]1CCC[C@@H](Nc2cc3[nH]ccc3c[nH+]2)C1 ZINC001154978506 968834035 /nfs/dbraw/zinc/83/40/35/968834035.db2.gz RILGWHWCORXFIX-WDEREUQCSA-N 2 0 230.315 2.245 20 0 BEADRP C[NH+](C)CC1CC[NH+](C[C@H]2C[C@H]3C=C[C@@H]2C3)CC1 ZINC001207627284 968844460 /nfs/dbraw/zinc/84/44/60/968844460.db2.gz VELBGVRDMHUOEX-ARFHVFGLSA-N 2 0 248.414 2.472 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)C[C@@H]1C[C@H]2C=C[C@@H]1C2 ZINC001207632931 968851805 /nfs/dbraw/zinc/85/18/05/968851805.db2.gz WAAJVZFKAQSXOP-ZNMIVQPWSA-N 2 0 236.403 2.472 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]CCC[C@H]1CCO1 ZINC001207858097 968892762 /nfs/dbraw/zinc/89/27/62/968892762.db2.gz DIQZRZORESEGGJ-KBPBESRZSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@@H]1CCC[N@@H+]1CC1(C)CC[NH+](C)CC1 ZINC001208102988 968998473 /nfs/dbraw/zinc/99/84/73/968998473.db2.gz JCQUORITNTZYQW-GFCCVEGCSA-N 2 0 210.365 2.203 20 0 BEADRP C[NH+]1CCC(C)(C[NH+]2C[C@@H]3CCC[C@H]3C2)CC1 ZINC001208102314 968999928 /nfs/dbraw/zinc/99/99/28/968999928.db2.gz DRPAIIVMDUHELG-KBPBESRZSA-N 2 0 236.403 2.450 20 0 BEADRP COCC[N@H+](CC1(C)CC[NH+](C)CC1)C(C)C ZINC001208105795 969000095 /nfs/dbraw/zinc/00/00/95/969000095.db2.gz CJBYOYZSZIPLFZ-UHFFFAOYSA-N 2 0 242.407 2.075 20 0 BEADRP C[NH+]1CCC(C)(C[N@@H+]2CCCC23CC3)CC1 ZINC001208104534 969000511 /nfs/dbraw/zinc/00/05/11/969000511.db2.gz OBGIOVYMLPSBHI-UHFFFAOYSA-N 2 0 222.376 2.347 20 0 BEADRP CCCC[N@H+](C)CC1(C)CC[NH+](C)CC1 ZINC001208102362 969002054 /nfs/dbraw/zinc/00/20/54/969002054.db2.gz FCVNJXIQLMBQOG-UHFFFAOYSA-N 2 0 212.381 2.450 20 0 BEADRP C[NH+]1CCC(C)(C[N@@H+]2C[C@@H]3C[C@H]2C[C@H]3F)CC1 ZINC001208107600 969002510 /nfs/dbraw/zinc/00/25/10/969002510.db2.gz WOTQTKLWJTTWSV-RWMBFGLXSA-N 2 0 240.366 2.151 20 0 BEADRP CC[C@H](C)[N@H+](C)CC1(C)CC[NH+](C)CC1 ZINC001208110580 969005713 /nfs/dbraw/zinc/00/57/13/969005713.db2.gz WFOYGZHMJOAEEC-LBPRGKRZSA-N 2 0 212.381 2.449 20 0 BEADRP C[C@@H]([NH3+])c1ccccc1C1=CCC[N@H+](C)C1 ZINC001241571912 969067543 /nfs/dbraw/zinc/06/75/43/969067543.db2.gz KJMKBCZWEZKFQO-LLVKDONJSA-N 2 0 216.328 2.425 20 0 BEADRP CC(C)[N@H+](C)CC1(C[NH+](C)C)CCCC1 ZINC001208181948 969106828 /nfs/dbraw/zinc/10/68/28/969106828.db2.gz CPRCTLLGODAYGI-UHFFFAOYSA-N 2 0 212.381 2.449 20 0 BEADRP CCC(CC)[N@H+](CC)C[C@@H](O)C[NH+](CC)CC ZINC001253188412 969107519 /nfs/dbraw/zinc/10/75/19/969107519.db2.gz YAAVYMJFCCIXAY-AWEZNQCLSA-N 2 0 244.423 2.200 20 0 BEADRP CCC[N@H+](C)CC1(C[NH+](C)C)CCCC1 ZINC001208181958 969113404 /nfs/dbraw/zinc/11/34/04/969113404.db2.gz DOFNYVZPMMWZFU-UHFFFAOYSA-N 2 0 212.381 2.450 20 0 BEADRP CC(C)(C)[NH2+]C[C@@H](O)C[NH2+]C1CCCCCC1 ZINC001253384544 969148754 /nfs/dbraw/zinc/14/87/54/969148754.db2.gz YBNKUHKOQJBEDF-ZDUSSCGKSA-N 2 0 242.407 2.048 20 0 BEADRP CCCCC[C@H](C)[NH2+]C[C@H](O)C[NH2+]C(C)(C)C ZINC001253406189 969162864 /nfs/dbraw/zinc/16/28/64/969162864.db2.gz BXRGOZUMWHQRKQ-STQMWFEESA-N 2 0 244.423 2.294 20 0 BEADRP CCC[N@H+]1C[C@@H]2C[NH+](CCC3CC3)C[C@@H]2C1 ZINC001208687127 969195072 /nfs/dbraw/zinc/19/50/72/969195072.db2.gz PRRQCDORRIQYAU-OKILXGFUSA-N 2 0 222.376 2.060 20 0 BEADRP CCCCC[C@H](O)C[NH2+]CCCCC[NH+](C)C ZINC001253549419 969222326 /nfs/dbraw/zinc/22/23/26/969222326.db2.gz QZHDKPWPEUVNAF-AWEZNQCLSA-N 2 0 244.423 2.249 20 0 BEADRP Cc1ccnc(C[N@@H+]2CCC[C@@H](C[NH3+])[C@@H](C)C2)c1 ZINC001205994397 969255176 /nfs/dbraw/zinc/25/51/76/969255176.db2.gz LJYSWOTUGOTCTE-KBPBESRZSA-N 2 0 247.386 2.197 20 0 BEADRP CC[N@@H+](CCCc1cccnc1)CCC[NH+](C)C ZINC001209185797 969374644 /nfs/dbraw/zinc/37/46/44/969374644.db2.gz RDSMMBVVSSREJL-UHFFFAOYSA-N 2 0 249.402 2.288 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]C1CCCC1)C2 ZINC001169079199 969395664 /nfs/dbraw/zinc/39/56/64/969395664.db2.gz JTIDVVUETYEDDX-CLLJXQQHSA-N 2 0 208.349 2.144 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]C(C)(C)C1CC1)C2 ZINC001169078321 969397376 /nfs/dbraw/zinc/39/73/76/969397376.db2.gz CUMLVMZIHPJRKQ-CLLJXQQHSA-N 2 0 222.376 2.390 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]CCC(F)(F)F)C2 ZINC001169079814 969402264 /nfs/dbraw/zinc/40/22/64/969402264.db2.gz LRSBOXJDDFOICL-OWUUHHOZSA-N 2 0 236.281 2.154 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]CC1CCC1)C2 ZINC001169081562 969403629 /nfs/dbraw/zinc/40/36/29/969403629.db2.gz SZBPMKDWNNTZAS-CLLJXQQHSA-N 2 0 208.349 2.001 20 0 BEADRP C[C@@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccncc1 ZINC001169080450 969404497 /nfs/dbraw/zinc/40/44/97/969404497.db2.gz NMYGGOLFSINENC-REBRKWNGSA-N 2 0 245.370 2.357 20 0 BEADRP CC1CC(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3C)C1 ZINC001169079751 969405181 /nfs/dbraw/zinc/40/51/81/969405181.db2.gz LAKULXNWGDZRAG-UMHABRDISA-N 2 0 222.376 2.247 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]Cc1cccs1)C2 ZINC001169080941 969405347 /nfs/dbraw/zinc/40/53/47/969405347.db2.gz NXHYULAMQYJKFI-CNDDSTCGSA-N 2 0 236.384 2.463 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CCC(F)CC1)C2 ZINC001169126244 969433402 /nfs/dbraw/zinc/43/34/02/969433402.db2.gz QNUIMNGMSDQKSB-ITGUQSILSA-N 2 0 226.339 2.046 20 0 BEADRP CC1(C)C[C@@H](Nc2cc[nH+]cc2)C[C@](C)(C[NH3+])C1 ZINC001169138653 969439465 /nfs/dbraw/zinc/43/94/65/969439465.db2.gz RYOFDORUCMPHAG-HIFRSBDPSA-N 2 0 247.386 2.459 20 0 BEADRP CC1(C)C[C@@H](Nc2cc[nH+]cc2)C[C@@](C)(C[NH3+])C1 ZINC001169138654 969440800 /nfs/dbraw/zinc/44/08/00/969440800.db2.gz RYOFDORUCMPHAG-UKRRQHHQSA-N 2 0 247.386 2.459 20 0 BEADRP CCC[N@H+](CCC[NH+](C)C)CCC(C)(C)OC ZINC001209409739 969478633 /nfs/dbraw/zinc/47/86/33/969478633.db2.gz WGPFRPXNRNEXQF-UHFFFAOYSA-N 2 0 244.423 2.465 20 0 BEADRP CC[NH+]1CCC([NH2+]CCCc2ccncc2)CC1 ZINC001169221759 969495512 /nfs/dbraw/zinc/49/55/12/969495512.db2.gz JUDQVCHHTKKXLW-UHFFFAOYSA-N 2 0 247.386 2.088 20 0 BEADRP CCC[N@H+](CCC[NH+]1CCCCC1)CCOC ZINC001209448705 969518370 /nfs/dbraw/zinc/51/83/70/969518370.db2.gz YXJZYCBQQGQADM-UHFFFAOYSA-N 2 0 242.407 2.221 20 0 BEADRP CC[NH+]1CCC(N2CC3CCC2CC3)CC1 ZINC001169265697 969524955 /nfs/dbraw/zinc/52/49/55/969524955.db2.gz PMSUPCOXTBDWBX-UHFFFAOYSA-N 2 0 222.376 2.345 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH2+][C@@H]2C[C@H]3CC[C@@H]2C3)CC1 ZINC001254502595 969669091 /nfs/dbraw/zinc/66/90/91/969669091.db2.gz GSRQPTMSBXOFLW-REWJHTLYSA-N 2 0 222.376 2.249 20 0 BEADRP Cc1cccc(C(=[NH2+])N[C@@H]2CCC[N@@H+](C)CC2)c1 ZINC001254509088 969682111 /nfs/dbraw/zinc/68/21/11/969682111.db2.gz VWGMMSRFYFEABF-CQSZACIVSA-N 2 0 245.370 2.394 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH2+]C(C)(C)c2ccncc2)CC1 ZINC001254510909 969683496 /nfs/dbraw/zinc/68/34/96/969683496.db2.gz ZDMOUHQOKJDROV-AWEZNQCLSA-N 2 0 247.386 2.391 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH2+]C(C)(C)c2ccncc2)CC1 ZINC001254510910 969683845 /nfs/dbraw/zinc/68/38/45/969683845.db2.gz ZDMOUHQOKJDROV-CQSZACIVSA-N 2 0 247.386 2.391 20 0 BEADRP C[C@H]1C[C@@H](CF)[N@@H+]([C@H]2CCC[NH+](C)CC2)C1 ZINC001254516380 969690967 /nfs/dbraw/zinc/69/09/67/969690967.db2.gz MDTGXOWJOBXZAY-AVGNSLFASA-N 2 0 228.355 2.151 20 0 BEADRP C[N@H+](C1CC(F)(F)C1)[C@@H]1CCC[NH+](C)CC1 ZINC001254515841 969691919 /nfs/dbraw/zinc/69/19/19/969691919.db2.gz DXEIFRFNCRHOJY-SNVBAGLBSA-N 2 0 232.318 2.200 20 0 BEADRP C[N@H+](CC1CC(F)(F)C1)[C@@H]1CCC[NH+](C)CC1 ZINC001254524366 969711488 /nfs/dbraw/zinc/71/14/88/969711488.db2.gz AZXYFPOIXHHXCC-GFCCVEGCSA-N 2 0 246.345 2.448 20 0 BEADRP C[N@H+](C[C@H]1CC1(C)C)[C@@H]1CCC[NH+](C)CC1 ZINC001254524847 969714398 /nfs/dbraw/zinc/71/43/98/969714398.db2.gz CVKZBRJJLWACKF-CHWSQXEVSA-N 2 0 224.392 2.449 20 0 BEADRP Cc1cc(N)[nH+]cc1Nc1cc[nH+]c2c1CCC2 ZINC001209965208 969726909 /nfs/dbraw/zinc/72/69/09/969726909.db2.gz OTCRFECNOWNIHB-UHFFFAOYSA-N 2 0 240.310 2.021 20 0 BEADRP Cc1c2[nH+]c[nH]c2ccc1NCC[C@H]1CCC[NH2+]1 ZINC001169563838 969758599 /nfs/dbraw/zinc/75/85/99/969758599.db2.gz CJRSPLBVZGGTKR-LLVKDONJSA-N 2 0 244.342 2.425 20 0 BEADRP Cc1[nH+]cn(-c2ccc(N(C)C)c(C)c2)c1N ZINC001210042507 969773661 /nfs/dbraw/zinc/77/36/61/969773661.db2.gz IEGBUSIRXHUSLS-UHFFFAOYSA-N 2 0 230.315 2.137 20 0 BEADRP [NH3+]Cc1cccc(N[C@H]2CC3CC[NH+](CC3)C2)c1 ZINC001254836898 969800119 /nfs/dbraw/zinc/80/01/19/969800119.db2.gz PRWZUXGCFWRTDP-HNNXBMFYSA-N 2 0 245.370 2.042 20 0 BEADRP [NH3+]Cc1ccn(-c2ccc([C@@H]3CCC[NH2+]3)cc2)c1 ZINC001169725887 969817327 /nfs/dbraw/zinc/81/73/27/969817327.db2.gz LORRPYUUVUFMRQ-HNNXBMFYSA-N 2 0 241.338 2.361 20 0 BEADRP C[NH+](C)CCC(C)(C)Nc1ccccc1CC[NH3+] ZINC001169718253 969831970 /nfs/dbraw/zinc/83/19/70/969831970.db2.gz JYBPPLNOJWHVRO-UHFFFAOYSA-N 2 0 249.402 2.330 20 0 BEADRP CCc1cc(NC(C)(C)CC[NH+](C)C)cc[nH+]1 ZINC001169718603 969832924 /nfs/dbraw/zinc/83/29/24/969832924.db2.gz YRQVNFPFCGYNNE-UHFFFAOYSA-N 2 0 235.375 2.208 20 0 BEADRP C[NH+](C)CCC(C)(C)[NH2+]C1Cc2ccccc2C1 ZINC001255016910 969847171 /nfs/dbraw/zinc/84/71/71/969847171.db2.gz WRPJYNPEDBWQMY-UHFFFAOYSA-N 2 0 246.398 2.474 20 0 BEADRP C[NH2+]CC1C[NH+](C[C@@H]2CCC(C)=C[C@H]2C)C1 ZINC001210560883 969941899 /nfs/dbraw/zinc/94/18/99/969941899.db2.gz BNUHSIDPNVHUSM-OCCSQVGLSA-N 2 0 222.376 2.130 20 0 BEADRP CC1(C)CC([NH3+])CC(C)(C)[NH+]1[C@H]1CCSC1 ZINC001255269416 970016919 /nfs/dbraw/zinc/01/69/19/970016919.db2.gz GXFBGNFRFOJSSS-NSHDSACASA-N 2 0 242.432 2.472 20 0 BEADRP C[NH2+]Cc1ccc(N(C)c2cc(N)cc[nH+]2)cc1 ZINC001211130252 970159714 /nfs/dbraw/zinc/15/97/14/970159714.db2.gz MGJWULFECLJDAJ-UHFFFAOYSA-N 2 0 242.326 2.151 20 0 BEADRP CCC[N@H+](CCC[NH3+])[C@H]1CCOC(C)(C)C1 ZINC001255527566 970291423 /nfs/dbraw/zinc/29/14/23/970291423.db2.gz ORHFMYIINMMQSU-LBPRGKRZSA-N 2 0 228.380 2.005 20 0 BEADRP CC1(C)C[C@@H]([NH2+]Cc2ccccc2C[NH3+])CCO1 ZINC001255530009 970295244 /nfs/dbraw/zinc/29/52/44/970295244.db2.gz YGHMUCQFMMDHGL-AWEZNQCLSA-N 2 0 248.370 2.193 20 0 BEADRP C[C@@H]1CC[C@@H]([N@@H+]2C[C@H]3CC[NH+](C)C[C@H]3C2)C1 ZINC001170134631 970405548 /nfs/dbraw/zinc/40/55/48/970405548.db2.gz CUMNUOVRIVWWJU-YIYPIFLZSA-N 2 0 222.376 2.059 20 0 BEADRP CC[C@H]1C[C@H]([N@H+](CCC[NH3+])C(C)C)CCO1 ZINC001170171045 970542025 /nfs/dbraw/zinc/54/20/25/970542025.db2.gz OOUKXELEWBAUAR-OLZOCXBDSA-N 2 0 228.380 2.003 20 0 BEADRP CCC[N@H+](CCC[NH3+])[C@@H]1CCO[C@H](CC)C1 ZINC001170172489 970563987 /nfs/dbraw/zinc/56/39/87/970563987.db2.gz ZQBJNKWRRPRBPD-CHWSQXEVSA-N 2 0 228.380 2.005 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)NC1(CF)CC1 ZINC001255941249 970563802 /nfs/dbraw/zinc/56/38/02/970563802.db2.gz MLZRROVDQSMIIY-LLVKDONJSA-N 2 0 216.344 2.199 20 0 BEADRP CC[C@@H]1C[C@H]([NH2+][C@@H]2CCC[N@H+](C)CC2)CCO1 ZINC001170171747 970567771 /nfs/dbraw/zinc/56/77/71/970567771.db2.gz UDTRZWWFLCSWJE-MGPQQGTHSA-N 2 0 240.391 2.018 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]C(C)(C)COC ZINC001255944115 970576607 /nfs/dbraw/zinc/57/66/07/970576607.db2.gz RJAFVYLNXOOUMU-LBPRGKRZSA-N 2 0 230.396 2.121 20 0 BEADRP C[C@@H]([NH2+][C@H](C)C1CC[NH2+]CC1)c1ccncc1 ZINC000400359751 970581579 /nfs/dbraw/zinc/58/15/79/970581579.db2.gz PTTUXCSFDPQFGM-VXGBXAGGSA-N 2 0 233.359 2.120 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)c1ccncc1 ZINC000400359748 970581746 /nfs/dbraw/zinc/58/17/46/970581746.db2.gz PTTUXCSFDPQFGM-NEPJUHHUSA-N 2 0 233.359 2.120 20 0 BEADRP CS[C@@H]1CC[C@H]([NH2+][C@H](C)[C@H]2CCC[NH2+]2)C1 ZINC000400366400 970583231 /nfs/dbraw/zinc/58/32/31/970583231.db2.gz FHHCBLNXUUOLAC-WRWGMCAJSA-N 2 0 228.405 2.001 20 0 BEADRP C[C@H](C[NH2+][C@@H](C)[C@@H]1CCC[NH2+]1)C(C)(C)C ZINC000400480487 970587377 /nfs/dbraw/zinc/58/73/77/970587377.db2.gz FMSLVYFCBGGEGV-WOPDTQHZSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)c1cccc(O)c1)C1CC[NH2+]CC1 ZINC000400437889 970588437 /nfs/dbraw/zinc/58/84/37/970588437.db2.gz NFAQIKMBFCXYSP-NEPJUHHUSA-N 2 0 248.370 2.431 20 0 BEADRP CC(C)[C@H]([NH2+][C@H](C)C1CC[NH2+]CC1)C1CC1 ZINC000400433584 970589795 /nfs/dbraw/zinc/58/97/95/970589795.db2.gz LXPUYHRZHKZQFQ-RISCZKNCSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)c1nccs1 ZINC000400463612 970591986 /nfs/dbraw/zinc/59/19/86/970591986.db2.gz SDZFHSDQVSREMH-VHSXEESVSA-N 2 0 239.388 2.182 20 0 BEADRP C[C@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)c1nccs1 ZINC000400463610 970593198 /nfs/dbraw/zinc/59/31/98/970593198.db2.gz SDZFHSDQVSREMH-UWVGGRQHSA-N 2 0 239.388 2.182 20 0 BEADRP C[C@H](C[NH2+][C@@H](C)[C@H]1CCC[NH2+]1)C(C)(C)C ZINC000400480478 970595093 /nfs/dbraw/zinc/59/50/93/970595093.db2.gz FMSLVYFCBGGEGV-GRYCIOLGSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@H](CC1CC1)[NH2+][C@@H](C)C1CC[NH2+]CC1 ZINC000400501914 970596159 /nfs/dbraw/zinc/59/61/59/970596159.db2.gz CGHUXMILBJCRBL-MNOVXSKESA-N 2 0 210.365 2.153 20 0 BEADRP COc1ccc(C[NH2+][C@H](C)C2CC[NH2+]CC2)cc1 ZINC000400489629 970596654 /nfs/dbraw/zinc/59/66/54/970596654.db2.gz YTSQFKPHEMYBBL-GFCCVEGCSA-N 2 0 248.370 2.173 20 0 BEADRP C[C@H]([NH2+]CCC(C)(C)C)C1CC[NH2+]CC1 ZINC000400493106 970597141 /nfs/dbraw/zinc/59/71/41/970597141.db2.gz ZWVFEXKRAVMWNK-NSHDSACASA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H]([NH2+]C1CCCCC1)C1CC[NH2+]CC1 ZINC000400747263 970624676 /nfs/dbraw/zinc/62/46/76/970624676.db2.gz URTXGVQTXAEJFP-LLVKDONJSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H](Cc1ccccc1Cl)[NH2+]C1(C[NH3+])CC1 ZINC001170264327 970644947 /nfs/dbraw/zinc/64/49/47/970644947.db2.gz XGDMGRVUPFIBPG-SNVBAGLBSA-N 2 0 238.762 2.352 20 0 BEADRP Cc1ccc(NCC2C[NH+](C)C2)c(C[NH+](C)C)c1 ZINC001170258451 970646448 /nfs/dbraw/zinc/64/64/48/970646448.db2.gz KVTHXQQSGOOQBJ-UHFFFAOYSA-N 2 0 247.386 2.030 20 0 BEADRP C[NH+]1CCC(n2c(C[NH3+])cc3ccccc32)CC1 ZINC001256194701 970686409 /nfs/dbraw/zinc/68/64/09/970686409.db2.gz NAJWSKNAIZGNBQ-UHFFFAOYSA-N 2 0 243.354 2.367 20 0 BEADRP C[NH+]1CCC([N@@H+]2CC[C@H]3CCC[C@H]3C2)CC1 ZINC001256205055 970702494 /nfs/dbraw/zinc/70/24/94/970702494.db2.gz VKGULSPKSARELR-OLZOCXBDSA-N 2 0 222.376 2.203 20 0 BEADRP C[NH+]1CCC([NH+]2CCC3(CCC3)CC2)CC1 ZINC001256203438 970705359 /nfs/dbraw/zinc/70/53/59/970705359.db2.gz XSUFVBDIVADASE-UHFFFAOYSA-N 2 0 222.376 2.347 20 0 BEADRP CC(C)CC[C@@H](C)[N@H+](C)C[C@H](C)C[NH3+] ZINC001256357584 970732955 /nfs/dbraw/zinc/73/29/55/970732955.db2.gz IBYATORXIZULOB-VXGBXAGGSA-N 2 0 200.370 2.338 20 0 BEADRP CCCC(CCC)[N@@H+]1CCC[C@](O)(C[NH3+])CC1 ZINC001246541388 972573600 /nfs/dbraw/zinc/57/36/00/972573600.db2.gz HHUPWKACQGGYGM-CQSZACIVSA-N 2 0 242.407 2.131 20 0 BEADRP CC1(C)[C@@H]2C[C@@H]([N@@H+]3CCC[C@@H]([NH3+])CC3)C[C@@H]21 ZINC001246543050 972588771 /nfs/dbraw/zinc/58/87/71/972588771.db2.gz RTNFVVZKGHKUHD-LPWJVIDDSA-N 2 0 222.376 2.234 20 0 BEADRP CCOCC[C@@H](C)[N@@H+]1CCC[C@](C)([NH3+])CC1 ZINC001246548000 972678654 /nfs/dbraw/zinc/67/86/54/972678654.db2.gz DXPWUPNHGZJTIH-OLZOCXBDSA-N 2 0 228.380 2.005 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@H](C)CCCc1cccnc1 ZINC001327840121 972753016 /nfs/dbraw/zinc/75/30/16/972753016.db2.gz MSBNIDSBLMMHAO-UONOGXRCSA-N 2 0 249.402 2.380 20 0 BEADRP CCCCC[C@@H](C)[N@@H+]1CCCC[C@](O)(C[NH3+])C1 ZINC001246557967 972780964 /nfs/dbraw/zinc/78/09/64/972780964.db2.gz JSJXMZXCRKBYJE-KGLIPLIRSA-N 2 0 242.407 2.131 20 0 BEADRP C[C@@]1(C[NH3+])CCCC[N@@H+]([C@@H]2CCCSC2)C1 ZINC001246583907 972951458 /nfs/dbraw/zinc/95/14/58/972951458.db2.gz LRGMKILJWLNENE-OLZOCXBDSA-N 2 0 242.432 2.333 20 0 BEADRP C[C@@H](CC(F)(F)F)[N@@H+]1CCCC[C@@H](C[NH3+])C1 ZINC001246596750 973015362 /nfs/dbraw/zinc/01/53/62/973015362.db2.gz VJLKEMZPRRWOHH-UWVGGRQHSA-N 2 0 238.297 2.388 20 0 BEADRP Fc1ccccc1[C@H]1CC[N@@H+](C2CC[NH2+]CC2)C1 ZINC001246808124 973111608 /nfs/dbraw/zinc/11/16/08/973111608.db2.gz RIGHAWPWIUIWPQ-LBPRGKRZSA-N 2 0 248.345 2.367 20 0 BEADRP C[C@H]1C[C@H](N2CCc3ccc(F)cc3C2)CC[NH2+]1 ZINC001246827748 973116355 /nfs/dbraw/zinc/11/63/55/973116355.db2.gz QMRDMBKNULLBJB-XHDPSFHLSA-N 2 0 248.345 2.324 20 0 BEADRP CC(C)CC[C@@H](C)[N@H+]1C[C@H]2CC[C@@H](C1)[C@@H]2[NH3+] ZINC001246843629 973143533 /nfs/dbraw/zinc/14/35/33/973143533.db2.gz VGIDRHXLOPFURM-YIYPIFLZSA-N 2 0 224.392 2.480 20 0 BEADRP CSC(C)(C)C[C@H](C)[N@@H+]1C[C@@H]2CC[C@@]2([NH3+])C1 ZINC001246854705 973174329 /nfs/dbraw/zinc/17/43/29/973174329.db2.gz QQWKUJGHLLWIBQ-GMXVVIOVSA-N 2 0 242.432 2.330 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]C[C@@H]1CCCC[C@H]1C ZINC001328676849 973223281 /nfs/dbraw/zinc/22/32/81/973223281.db2.gz HVBMQZMTSGLGTQ-UPJWGTAASA-N 2 0 212.381 2.400 20 0 BEADRP CC[C@H](CC(C)C)[N@@H+]1C[C@H]2CC[C@@H](C1)[NH2+]C2 ZINC001246867519 973235616 /nfs/dbraw/zinc/23/56/16/973235616.db2.gz OMZYGJCPVPXRMU-MELADBBJSA-N 2 0 224.392 2.495 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]Cc1cc(C)sc1C ZINC001328676349 973258016 /nfs/dbraw/zinc/25/80/16/973258016.db2.gz DAKYNCHEILMUJS-SECBINFHSA-N 2 0 226.389 2.453 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]Cc1ccc2c(c1)CCC2 ZINC001328681535 973266585 /nfs/dbraw/zinc/26/65/85/973266585.db2.gz NJYWCFLDWGZDGI-LBPRGKRZSA-N 2 0 232.371 2.392 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@H](C)Cc1ccsc1 ZINC001329023479 973435159 /nfs/dbraw/zinc/43/51/59/973435159.db2.gz IMFQIFJRIYCTRR-WDEREUQCSA-N 2 0 226.389 2.267 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@H]1CCc2c1cccc2OC ZINC001329024421 973435709 /nfs/dbraw/zinc/43/57/09/973435709.db2.gz RQNUPYZTVVYGAL-FZMZJTMJSA-N 2 0 248.370 2.270 20 0 BEADRP Cc1cccc2c1CC[C@H]([NH2+]CCCC[NH3+])C2 ZINC001171553896 974099023 /nfs/dbraw/zinc/09/90/23/974099023.db2.gz WKNQCFHEFMLJDR-AWEZNQCLSA-N 2 0 232.371 2.181 20 0 BEADRP COC[C@H](C)[NH2+]C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171613489 974116529 /nfs/dbraw/zinc/11/65/29/974116529.db2.gz LLHXAYSIWZYBQF-NSHDSACASA-N 2 0 242.407 2.262 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+][C@H]2Cc3cccc(F)c3C2)C1 ZINC001171783119 974168677 /nfs/dbraw/zinc/16/86/77/974168677.db2.gz KMKDATUIJBEPIS-AVGNSLFASA-N 2 0 248.345 2.152 20 0 BEADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]CC1CC1)C2 ZINC001172100134 974343611 /nfs/dbraw/zinc/34/36/11/974343611.db2.gz NMXBIFCJCQQITD-CLLJXQQHSA-N 2 0 208.349 2.001 20 0 BEADRP CCCC[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172100787 974344177 /nfs/dbraw/zinc/34/41/77/974344177.db2.gz TXYHQSYULVNWHS-CLLJXQQHSA-N 2 0 210.365 2.391 20 0 BEADRP CCC[N@H+](CCC[NH+](C)C)CC1(OC)CCC1 ZINC001330638003 974375592 /nfs/dbraw/zinc/37/55/92/974375592.db2.gz CYWNIELSNSNZPB-UHFFFAOYSA-N 2 0 242.407 2.219 20 0 BEADRP CC[C@H](COC)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)N2C ZINC001172115203 974382359 /nfs/dbraw/zinc/38/23/59/974382359.db2.gz RZPJPGUREFEPIF-SYQHCUMBSA-N 2 0 240.391 2.016 20 0 BEADRP [NH3+]CCCC[NH2+][C@H]1CSc2ccccc2C1 ZINC001172185659 974394377 /nfs/dbraw/zinc/39/43/77/974394377.db2.gz UHUCXSSQCXEYOI-GFCCVEGCSA-N 2 0 236.384 2.032 20 0 BEADRP C[NH+](C)CCCCC[NH2+]C1C[C@H]2CC[C@@H](C1)O2 ZINC001172218370 974444875 /nfs/dbraw/zinc/44/48/75/974444875.db2.gz SAZVVWWOVMCLLP-AGUYFDCRSA-N 2 0 240.391 2.018 20 0 BEADRP CC1(C)C[C@@H]([NH2+]CCCCCCC[NH3+])CO1 ZINC001172278696 974495078 /nfs/dbraw/zinc/49/50/78/974495078.db2.gz WECDRXBWRQMVGX-GFCCVEGCSA-N 2 0 228.380 2.053 20 0 BEADRP CC[C@@H](C)OCC[C@H](C)[NH2+]CCC[NH+](C)C ZINC001172315465 974521195 /nfs/dbraw/zinc/52/11/95/974521195.db2.gz KFYWCBYUMNUOCR-QWHCGFSZSA-N 2 0 230.396 2.121 20 0 BEADRP C[C@@H]1CC[C@@H]([N@H+]2C[C@H]3C[NH+](C)C[C@H]3C2)C[C@@H]1C ZINC001172380126 974585173 /nfs/dbraw/zinc/58/51/73/974585173.db2.gz RHQBLNLGDJNJDQ-QKGCVVFFSA-N 2 0 236.403 2.305 20 0 BEADRP CC[C@@H](C)OCC[C@@H](C)[N@H+](C)CCC[NH+](C)C ZINC001172334379 974597889 /nfs/dbraw/zinc/59/78/89/974597889.db2.gz BPBPMQHVHDIOQW-ZIAGYGMSSA-N 2 0 244.423 2.464 20 0 BEADRP C[C@@H]1CC[C@@H](NC(=[NH2+])SCC[NH3+])C[C@@H]1C ZINC001172359452 974629754 /nfs/dbraw/zinc/62/97/54/974629754.db2.gz MSGRJSIYODHRNS-KXUCPTDWSA-N 2 0 229.393 2.027 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H](C)CCOCC)CC1 ZINC001172407885 974666886 /nfs/dbraw/zinc/66/68/86/974666886.db2.gz BZZXBOHOJUZKLU-ZDUSSCGKSA-N 2 0 242.407 2.266 20 0 BEADRP CCOCC[C@@H](C)[NH2+]CCCCC[NH+](C)C ZINC001172409510 974671294 /nfs/dbraw/zinc/67/12/94/974671294.db2.gz VTOJNVPPNMXPNA-CYBMUJFWSA-N 2 0 230.396 2.123 20 0 BEADRP CCOCC[C@H](C)[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC001172410559 974674122 /nfs/dbraw/zinc/67/41/22/974674122.db2.gz HUPCLGUULQNZKY-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP CCOCC[C@@H](C)[NH2+]Cc1ccccc1C[NH3+] ZINC001172413329 974679974 /nfs/dbraw/zinc/67/99/74/974679974.db2.gz ALCNZUGDLULEMW-GFCCVEGCSA-N 2 0 236.359 2.050 20 0 BEADRP CCOCC[C@H](C)[NH2+][C@H]1CC[C@H]([NH+](C)C)CC1 ZINC001172413595 974680673 /nfs/dbraw/zinc/68/06/73/974680673.db2.gz BMDHQKSAFQCBGY-IHRRRGAJSA-N 2 0 242.407 2.264 20 0 BEADRP CC(C)OCC[C@H](C)[NH2+]CC1CC[NH+](C)CC1 ZINC001172431265 974714046 /nfs/dbraw/zinc/71/40/46/974714046.db2.gz MKCSAMYKCXXADE-ZDUSSCGKSA-N 2 0 242.407 2.121 20 0 BEADRP CC[C@@H](CC(C)C)[NH2+]CCC[NH+](C)C ZINC001172384371 974728065 /nfs/dbraw/zinc/72/80/65/974728065.db2.gz UCWYUMXUXHFLLB-LBPRGKRZSA-N 2 0 200.370 2.352 20 0 BEADRP CC[C@@H](CC(C)C)[NH2+]C[C@H]1CC[N@H+](C)C1 ZINC001172384477 974728310 /nfs/dbraw/zinc/72/83/10/974728310.db2.gz INZHPCCJMQYRDC-OLZOCXBDSA-N 2 0 212.381 2.352 20 0 BEADRP CC[C@H](CC(C)C)[NH2+]C[C@@H]1CC[N@H+](C)C1 ZINC001172384478 974729119 /nfs/dbraw/zinc/72/91/19/974729119.db2.gz INZHPCCJMQYRDC-QWHCGFSZSA-N 2 0 212.381 2.352 20 0 BEADRP CC(C)OCC[C@@H](C)[NH2+]CC(C)(C)C[NH+](C)C ZINC001172446635 974806941 /nfs/dbraw/zinc/80/69/41/974806941.db2.gz CZQKRGGWQVXLKO-CYBMUJFWSA-N 2 0 244.423 2.367 20 0 BEADRP C[C@H](C[NH+](C)C)Oc1cc(N)[nH+]c2ccccc21 ZINC001226418585 974891067 /nfs/dbraw/zinc/89/10/67/974891067.db2.gz PCSZVDARLIXNGV-SNVBAGLBSA-N 2 0 245.326 2.146 20 0 BEADRP Cc1ccc2c(c1)C[C@@H]([NH2+]CCC[NH+](C)C)CC2 ZINC001172824219 974946533 /nfs/dbraw/zinc/94/65/33/974946533.db2.gz RKWXDQFGVFOYJA-INIZCTEOSA-N 2 0 246.398 2.394 20 0 BEADRP CO[C@@H]1CCC[C@H]([NH2+][C@@H]2CCC[N@H+](C)CC2)C1 ZINC001172923979 974970731 /nfs/dbraw/zinc/97/07/31/974970731.db2.gz OWKCIVFUIUJUFF-HZSPNIEDSA-N 2 0 240.391 2.018 20 0 BEADRP CO[C@@H]1CCC[C@@H]([NH2+][C@H]2CCC[N@H+](C)CC2)C1 ZINC001172923978 974971693 /nfs/dbraw/zinc/97/16/93/974971693.db2.gz OWKCIVFUIUJUFF-BFHYXJOUSA-N 2 0 240.391 2.018 20 0 BEADRP Cc1[nH]c2ccc(NCC(C)(C)[NH3+])cc2[nH+]1 ZINC000258776305 975007378 /nfs/dbraw/zinc/00/73/78/975007378.db2.gz IDCUSZZWHSJNRL-UHFFFAOYSA-N 2 0 218.304 2.021 20 0 BEADRP C[C@H]1C[C@H](n2ccnc2[C@@H]2CCC[NH2+]C2)CCO1 ZINC001173173278 975054255 /nfs/dbraw/zinc/05/42/55/975054255.db2.gz FGAIMTMPGVTPBC-YNEHKIRRSA-N 2 0 249.358 2.090 20 0 BEADRP CC[C@@H]1CC[C@H]([N@H+](C)CCC[NH+](C)C)C1 ZINC001173275529 975085468 /nfs/dbraw/zinc/08/54/68/975085468.db2.gz VUDICFJFSNUHIK-OLZOCXBDSA-N 2 0 212.381 2.449 20 0 BEADRP CCCC[C@H](CC(C)C)[N@@H+]1CCO[C@H](C[NH3+])C1 ZINC001173251038 975089275 /nfs/dbraw/zinc/08/92/75/975089275.db2.gz YDRWUODHYCFCPD-ZIAGYGMSSA-N 2 0 242.407 2.251 20 0 BEADRP COc1cccc2c1CC[C@H]2[NH2+]CCC(C)(C)[NH3+] ZINC001332402815 975096283 /nfs/dbraw/zinc/09/62/83/975096283.db2.gz SNXBCBHGKYKCOY-CYBMUJFWSA-N 2 0 248.370 2.400 20 0 BEADRP CCc1ccc(C[C@@H](C)[NH2+]C[C@@H](C)C[NH3+])cc1 ZINC001173241577 975163361 /nfs/dbraw/zinc/16/33/61/975163361.db2.gz OJKYVVIHYXRRLU-QWHCGFSZSA-N 2 0 234.387 2.364 20 0 BEADRP CCSC[C@H](C)[N@@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC001173311911 975224908 /nfs/dbraw/zinc/22/49/08/975224908.db2.gz QZDQVNBTCOLVNS-QWHCGFSZSA-N 2 0 242.432 2.156 20 0 BEADRP CC[C@@H]1CC[C@@H]([N@@H+]2C[C@H]3CC[NH+](C)C[C@H]3C2)C1 ZINC001173278791 975235632 /nfs/dbraw/zinc/23/56/32/975235632.db2.gz FPGXTCFGWRPXFZ-APIJFGDWSA-N 2 0 236.403 2.449 20 0 BEADRP CC[N@@H+]1CC[C@@H](n2ccc3cc(C[NH3+])ccc32)C1 ZINC001173347954 975287812 /nfs/dbraw/zinc/28/78/12/975287812.db2.gz KMVUDFOWLGAZAC-CQSZACIVSA-N 2 0 243.354 2.367 20 0 BEADRP CC[N@@H+]1CC[C@H](n2ccc3ccc(C[NH3+])cc32)C1 ZINC001173351811 975299851 /nfs/dbraw/zinc/29/98/51/975299851.db2.gz ZGOMBODPHKKULZ-AWEZNQCLSA-N 2 0 243.354 2.367 20 0 BEADRP C[N@H+]1C[C@H]2CC[C@@H](C1)C2[NH2+][C@H]1CCC[C@H](F)C1 ZINC001332897840 975312632 /nfs/dbraw/zinc/31/26/32/975312632.db2.gz LPYNKALKDMUNLU-BMNJFWBPSA-N 2 0 240.366 2.197 20 0 BEADRP Cn1cc[nH+]c1Nc1ccccc1C[NH+](C)C ZINC001173927625 976036425 /nfs/dbraw/zinc/03/64/25/976036425.db2.gz KWARDOWPWXJPAS-UHFFFAOYSA-N 2 0 230.315 2.225 20 0 BEADRP Cc1c[nH+]ccc1Nc1c[nH+]ccc1N(C)C ZINC001174536386 976816373 /nfs/dbraw/zinc/81/63/73/976816373.db2.gz CXZGALLPGXPQHG-UHFFFAOYSA-N 2 0 228.299 2.017 20 0 BEADRP C[N@@H+]1CCC[C@@H]2CN(c3cc[nH+]cc3)CC[C@H]21 ZINC001336391780 977656188 /nfs/dbraw/zinc/65/61/88/977656188.db2.gz NFGAWVRZIADVHU-TZMCWYRMSA-N 2 0 231.343 2.002 20 0 BEADRP C[N@H+](Cc1cc2c[nH+]ccc2[nH]1)C1CCOCC1 ZINC001232011958 977837668 /nfs/dbraw/zinc/83/76/68/977837668.db2.gz QHUJDAVQCHCSEE-UHFFFAOYSA-N 2 0 245.326 2.174 20 0 BEADRP CC[NH+](CC)Cc1cc2c[nH+]ccc2[nH]1 ZINC001232011761 977838677 /nfs/dbraw/zinc/83/86/77/977838677.db2.gz ORSRUDDLJLRXRU-UHFFFAOYSA-N 2 0 203.289 2.405 20 0 BEADRP CC1C[NH+](Cc2cc3c[nH+]ccc3[nH]2)C1 ZINC001232012202 977840015 /nfs/dbraw/zinc/84/00/15/977840015.db2.gz VQGKYWVLGZBRRO-UHFFFAOYSA-N 2 0 201.273 2.015 20 0 BEADRP F[C@H]1C[C@@H]2C[C@H]1C[N@@H+]2Cc1cc2c[nH+]ccc2[nH]1 ZINC001232016500 977842930 /nfs/dbraw/zinc/84/29/30/977842930.db2.gz YJXVFCSZCSPNFJ-DRZSPHRISA-N 2 0 245.301 2.495 20 0 BEADRP CSCC[N@H+](C)Cc1cc2c[nH+]ccc2[nH]1 ZINC001232017554 977847065 /nfs/dbraw/zinc/84/70/65/977847065.db2.gz VACAISPPLXQXNC-UHFFFAOYSA-N 2 0 235.356 2.358 20 0 BEADRP C[C@@H]1CN(c2cc[nH+]cc2C2CC2)C[C@H](C)[NH2+]1 ZINC001336694683 977860484 /nfs/dbraw/zinc/86/04/84/977860484.db2.gz ACLBMGZVCGHFIE-PHIMTYICSA-N 2 0 231.343 2.146 20 0 BEADRP Cc1cc(Nc2cc[nH+]c(N(C)C)c2)cc(C)[nH+]1 ZINC001176053795 977900045 /nfs/dbraw/zinc/90/00/45/977900045.db2.gz JNMOUSJVIHDDEE-UHFFFAOYSA-N 2 0 242.326 2.325 20 0 BEADRP CCC[NH+]1CCC(CNc2cc[nH+]cc2)CC1 ZINC001336909893 978048887 /nfs/dbraw/zinc/04/88/87/978048887.db2.gz SIRQALJYOVHTAT-UHFFFAOYSA-N 2 0 233.359 2.037 20 0 BEADRP CC[NH+](CC)[C@H]1CCN(c2cc[nH+]cc2)C1 ZINC001336908739 978050040 /nfs/dbraw/zinc/05/00/40/978050040.db2.gz HMVAFFJWCTWEHX-ZDUSSCGKSA-N 2 0 219.332 2.002 20 0 BEADRP CC(C)[C@@H](CNc1cc[nH+]cc1)[NH+]1CCCC1 ZINC001336917101 978051848 /nfs/dbraw/zinc/05/18/48/978051848.db2.gz ZRGMFZDOPFPVKK-CQSZACIVSA-N 2 0 233.359 2.036 20 0 BEADRP C[C@]1(C[NH3+])CCC[N@H+](Cc2cccnc2)CC1 ZINC001206293308 978295044 /nfs/dbraw/zinc/29/50/44/978295044.db2.gz HGNLYXKOIVIBGJ-AWEZNQCLSA-N 2 0 233.359 2.033 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@@](C)(C[NH3+])CC2)[nH]1 ZINC001206304809 978373383 /nfs/dbraw/zinc/37/33/83/978373383.db2.gz PUAUBGSVBKQAEQ-CQSZACIVSA-N 2 0 235.375 2.274 20 0 BEADRP C[C@@H]1CC[C@H]1[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC001337805551 978504839 /nfs/dbraw/zinc/50/48/39/978504839.db2.gz NFYZBQQHUOKNKX-GRYCIOLGSA-N 2 0 210.365 2.153 20 0 BEADRP Cc1cccc(C[NH2+][C@@H]2CC[C@@H]3C[N@@H+](C)C[C@@H]23)c1 ZINC001179818647 978759970 /nfs/dbraw/zinc/75/99/70/978759970.db2.gz ZFHBCDFYJIVSTM-BZUAXINKSA-N 2 0 244.382 2.425 20 0 BEADRP CCN1CCC[C@H]([NH2+]CC[C@@H]2CCCCO2)C1 ZINC001180311044 978854790 /nfs/dbraw/zinc/85/47/90/978854790.db2.gz WPDCZTDOKVJGGY-KBPBESRZSA-N 2 0 240.391 2.020 20 0 BEADRP C[C@@H]1CN(c2cc[nH+]cc2)CC[N@@H+](C2CCC2)C1 ZINC001339458380 978855418 /nfs/dbraw/zinc/85/54/18/978855418.db2.gz IYPYTFRMLARDRE-ZDUSSCGKSA-N 2 0 245.370 2.392 20 0 BEADRP CC1=C[C@@H](C)[C@H](C[N@@H+]2CC[C@H]3[NH2+]C[C@H]3C2)CC1 ZINC001235025474 978956200 /nfs/dbraw/zinc/95/62/00/978956200.db2.gz BZMLWXFEZDYROA-CBBWQLFWSA-N 2 0 234.387 2.273 20 0 BEADRP F[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[NH2+]C23CCC3)C1 ZINC001340065396 978962981 /nfs/dbraw/zinc/96/29/81/978962981.db2.gz TYUYCBBEEQMATC-GRYCIOLGSA-N 2 0 226.339 2.141 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CCCC[C@]12CCC[NH2+]C2 ZINC001235176298 978989812 /nfs/dbraw/zinc/98/98/12/978989812.db2.gz ZYZGNYNNUMFXQZ-MGPQQGTHSA-N 2 0 222.376 2.251 20 0 BEADRP CC(C)C[NH+]1CCC([C@@H]2CCCC[NH2+]2)CC1 ZINC001235234504 979003078 /nfs/dbraw/zinc/00/30/78/979003078.db2.gz ZIDUGINQCOTAMF-AWEZNQCLSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)C[NH+]1CCC([C@H]2CCCC[NH2+]2)CC1 ZINC001235234505 979004131 /nfs/dbraw/zinc/00/41/31/979004131.db2.gz ZIDUGINQCOTAMF-CQSZACIVSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)Cc1ccc(C[N@H+]2C[C@@H]3[C@H]([NH3+])[C@@H]3C2)cc1 ZINC001235284099 979016200 /nfs/dbraw/zinc/01/62/00/979016200.db2.gz JQSNJBVCVXBRMA-MUJYYYPQSA-N 2 0 244.382 2.274 20 0 BEADRP CC(C)CCC[N@@H+]1CC[C@]2(C1)C[NH2+]CC[C@H]2F ZINC001235410502 979039351 /nfs/dbraw/zinc/03/93/51/979039351.db2.gz YGCVCCVTOMHDNB-ZIAGYGMSSA-N 2 0 242.382 2.446 20 0 BEADRP CCC[C@H]1CCCC[N@@H+]1C[C@@H]1CNC(C)(C)O1 ZINC001235694941 979124297 /nfs/dbraw/zinc/12/42/97/979124297.db2.gz XLDHRJDPVVDNHE-STQMWFEESA-N 2 0 240.391 2.366 20 0 BEADRP C[N@H+](CCC1CC[NH2+]CC1)Cc1cccc(N)c1 ZINC001235717979 979133198 /nfs/dbraw/zinc/13/31/98/979133198.db2.gz QPEPNERHWHDXQI-UHFFFAOYSA-N 2 0 247.386 2.090 20 0 BEADRP CC[C@@H]1CCC[N@H+](CC[C@H]2COC(C)(C)N2)C1 ZINC001235949286 979218126 /nfs/dbraw/zinc/21/81/26/979218126.db2.gz CMXRRNGZICWBBL-OLZOCXBDSA-N 2 0 240.391 2.223 20 0 BEADRP CC/C=C\CCC[N@@H+]1C[C@@H](C)C[C@H]([NH3+])C1 ZINC001236043960 979339810 /nfs/dbraw/zinc/33/98/10/979339810.db2.gz HBNDFKIVQOTBMG-AIMRDXAKSA-N 2 0 210.365 2.402 20 0 BEADRP CCCCCCN1C[C@H]2CC[C@@H](C1)[NH2+]C2 ZINC001236058765 979349452 /nfs/dbraw/zinc/34/94/52/979349452.db2.gz AYYREMNFBBSYFQ-STQMWFEESA-N 2 0 210.365 2.251 20 0 BEADRP C([C@H]1CCCC[NH2+]1)[NH+]1CC2CCC(CC2)C1 ZINC001236089494 979378595 /nfs/dbraw/zinc/37/85/95/979378595.db2.gz VOWUIFFAWLJZRC-JXQTWKCFSA-N 2 0 222.376 2.251 20 0 BEADRP C[N@@H+](CC/C=C/c1cccnc1)CCCC[NH3+] ZINC001236100247 979390382 /nfs/dbraw/zinc/39/03/82/979390382.db2.gz BANIGQKWGUNXRE-FARCUNLSSA-N 2 0 233.359 2.156 20 0 BEADRP [NH3+]CCCC[NH+]1CCC(c2cccc(O)c2)CC1 ZINC001236306999 979509194 /nfs/dbraw/zinc/50/91/94/979509194.db2.gz IBEZWNCOVZDQJG-UHFFFAOYSA-N 2 0 248.370 2.311 20 0 BEADRP C[C@@H]([NH3+])CN(Cc1ccccc1)C1CCC1 ZINC001236440780 979600191 /nfs/dbraw/zinc/60/01/91/979600191.db2.gz HAACFFAXPGSQPZ-GFCCVEGCSA-N 2 0 218.344 2.388 20 0 BEADRP C[C@]1([NH3+])CCC[N@H+](Cc2ccc(O)cc2)CC1 ZINC001205263700 979805634 /nfs/dbraw/zinc/80/56/34/979805634.db2.gz BPVMXRPYUVPUFF-AWEZNQCLSA-N 2 0 234.343 2.096 20 0 BEADRP CCc1ccc(C[N@@H+]2CCC[C@@](C)([NH3+])CC2)nc1 ZINC001205280806 979883052 /nfs/dbraw/zinc/88/30/52/979883052.db2.gz JHXQJTBBVFOFML-OAHLLOKOSA-N 2 0 247.386 2.347 20 0 BEADRP CNc1ccc(C[N@@H+]2CCC[C@](C)([NH3+])CC2)cc1 ZINC001205296100 980062929 /nfs/dbraw/zinc/06/29/29/980062929.db2.gz GVWIMXVHHWHEFH-HNNXBMFYSA-N 2 0 247.386 2.432 20 0 BEADRP c1[nH+]cn2c1cccc2C[N@@H+]1CCC[C@@H]2C[C@@H]21 ZINC001238109676 980159529 /nfs/dbraw/zinc/15/95/29/980159529.db2.gz IQAJOBKPEQBAGS-RISCZKNCSA-N 2 0 227.311 2.319 20 0 BEADRP [NH3+][C@H]1CCc2c1cccc2C1=CCC[NH2+]CC1 ZINC001238947306 980385834 /nfs/dbraw/zinc/38/58/34/980385834.db2.gz NKMPVRJQKMEUNW-HNNXBMFYSA-N 2 0 228.339 2.399 20 0 BEADRP [NH3+][C@@H]1CCc2ccc(C3=CCC[NH2+]CC3)cc21 ZINC001238951034 980389846 /nfs/dbraw/zinc/38/98/46/980389846.db2.gz RYIAGAVXAPFJIL-OAHLLOKOSA-N 2 0 228.339 2.399 20 0 BEADRP C[C@@H]1CC=CC[C@H]1[NH2+]C1CCC(C[NH3+])CC1 ZINC001345096269 980547605 /nfs/dbraw/zinc/54/76/05/980547605.db2.gz AMRJBLRRHNSDSD-BLYZHGLHSA-N 2 0 222.376 2.448 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@@H]1CCCC12CCC2 ZINC001345484165 980618736 /nfs/dbraw/zinc/61/87/36/980618736.db2.gz VZYCOGXNCOZACE-NWDGAFQWSA-N 2 0 210.365 2.297 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H]1CCCC12CCC2 ZINC001345484157 980618822 /nfs/dbraw/zinc/61/88/22/980618822.db2.gz VZYCOGXNCOZACE-NEPJUHHUSA-N 2 0 210.365 2.297 20 0 BEADRP [NH3+]C[C@@]1(F)CCC[N@H+](Cc2ccsc2)CC1 ZINC001205545669 980947145 /nfs/dbraw/zinc/94/71/45/980947145.db2.gz LNFOBTADWUUHKZ-GFCCVEGCSA-N 2 0 242.363 2.401 20 0 BEADRP COC(C)(C)CC[N@@H+]1CC[C@@H](C)[C@@H](C[NH3+])CC1 ZINC001205599911 981153111 /nfs/dbraw/zinc/15/31/11/981153111.db2.gz AMWWIRHSVGSAMJ-CHWSQXEVSA-N 2 0 242.407 2.108 20 0 BEADRP CC(C)CC[N@H+]1CC[C@@H](C[NH3+])[C@@H](C)CC1 ZINC001205601379 981162671 /nfs/dbraw/zinc/16/26/71/981162671.db2.gz DYELBMKBBNTSGJ-STQMWFEESA-N 2 0 212.381 2.339 20 0 BEADRP Cc1cccc(C[N@H+]2CC[C@@H](C)[C@H](C[NH3+])CC2)n1 ZINC001205602650 981164233 /nfs/dbraw/zinc/16/42/33/981164233.db2.gz KXUPRQMEQNUAEM-OCCSQVGLSA-N 2 0 247.386 2.197 20 0 BEADRP c1cc2cccc(C[NH+]3C[C@@H]4C[NH2+]C[C@H]4C3)c2o1 ZINC001347782794 981172212 /nfs/dbraw/zinc/17/22/12/981172212.db2.gz VMWIWPJCJJEHPF-KBPBESRZSA-N 2 0 242.322 2.084 20 0 BEADRP C[C@H]1CC[N@H+](Cc2ccc(O)cc2)CC[C@H]1C[NH3+] ZINC001205603680 981174457 /nfs/dbraw/zinc/17/44/57/981174457.db2.gz RXKGVNRMUVKVBK-JSGCOSHPSA-N 2 0 248.370 2.199 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@@H](C)[C@@H](C[NH3+])CC2)o1 ZINC001205604819 981182105 /nfs/dbraw/zinc/18/21/05/981182105.db2.gz XUUMHOKJVIUUML-DGCLKSJQSA-N 2 0 236.359 2.395 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]Cc1c(C)cccc1C ZINC001348516036 981380855 /nfs/dbraw/zinc/38/08/55/981380855.db2.gz RTYJLCXQXUBCES-CYBMUJFWSA-N 2 0 220.360 2.391 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]Cc1cnc2ccccc2c1 ZINC001348516880 981380974 /nfs/dbraw/zinc/38/09/74/981380974.db2.gz WNIAZRVSMLGPGY-GFCCVEGCSA-N 2 0 243.354 2.180 20 0 BEADRP COc1ccc(C2=CC[NH2+]CC2)cc1C[NH+](C)C ZINC001240468662 981405574 /nfs/dbraw/zinc/40/55/74/981405574.db2.gz IZLWANHMSPZAKU-UHFFFAOYSA-N 2 0 246.354 2.134 20 0 BEADRP C[C@H]1CC[N@H+](Cc2cccc(N)c2)CC[C@H]1C[NH3+] ZINC001205638817 981412999 /nfs/dbraw/zinc/41/29/99/981412999.db2.gz SERXEMVDSLTTJC-JSGCOSHPSA-N 2 0 247.386 2.076 20 0 BEADRP c1cc(C2=CCC[NH2+]C2)ncc1C[NH+]1CCCC1 ZINC001240653260 981564437 /nfs/dbraw/zinc/56/44/37/981564437.db2.gz PYXQVPIISOLKSG-UHFFFAOYSA-N 2 0 243.354 2.054 20 0 BEADRP [NH3+]C1(c2ccc(C3=CCC[NH2+]C3)cc2)CCC1 ZINC001240663665 981573185 /nfs/dbraw/zinc/57/31/85/981573185.db2.gz BLEMNDKHVHERKD-UHFFFAOYSA-N 2 0 228.339 2.401 20 0 BEADRP c1ncc(C2=CCC[NH2+]C2)cc1C[NH+]1CCCC1 ZINC001240670089 981579574 /nfs/dbraw/zinc/57/95/74/981579574.db2.gz DULPQYZUEKRCLC-UHFFFAOYSA-N 2 0 243.354 2.054 20 0 BEADRP CC(C)([NH3+])c1ccccc1C1=CCC[NH2+]C1 ZINC001240670050 981580920 /nfs/dbraw/zinc/58/09/20/981580920.db2.gz DEVOTTKKUFXETG-UHFFFAOYSA-N 2 0 216.328 2.257 20 0 BEADRP C[C@H]([NH3+])c1ccccc1C1=CCC[NH2+]C1 ZINC001240670195 981581160 /nfs/dbraw/zinc/58/11/60/981581160.db2.gz XPZCTKQQCLBIJM-JTQLQIEISA-N 2 0 202.301 2.083 20 0 BEADRP C[N@@H+]1CCc2ccc(C3=CCC[NH2+]C3)cc2C1 ZINC001240680627 981585704 /nfs/dbraw/zinc/58/57/04/981585704.db2.gz VUCRVWANDARZFN-UHFFFAOYSA-N 2 0 228.339 2.051 20 0 BEADRP c1cc([C@H]([NH2+]C[C@@H]2CCC[NH2+]C2)C2CC2)ccn1 ZINC001580888051 981720977 /nfs/dbraw/zinc/72/09/77/981720977.db2.gz POXWCCHEWXEELJ-IUODEOHRSA-N 2 0 245.370 2.122 20 0 BEADRP [NH3+][C@H]1CCc2ccc(C=C3CC[NH2+]CC3)cc21 ZINC001240879459 981934742 /nfs/dbraw/zinc/93/47/42/981934742.db2.gz RNTHMTLLTQCAHN-HNNXBMFYSA-N 2 0 228.339 2.399 20 0 BEADRP C[N@H+]1CC=C(c2cccc3c2CC[C@H]3[NH3+])CC1 ZINC001241330085 982491166 /nfs/dbraw/zinc/49/11/66/982491166.db2.gz IQJJZIIDMFTJJN-OAHLLOKOSA-N 2 0 228.339 2.352 20 0 BEADRP C[NH2+]Cc1ccccc1C1=CC[N@H+](C)CC1 ZINC001241333518 982500991 /nfs/dbraw/zinc/50/09/91/982500991.db2.gz WELPDFMWDINCSO-UHFFFAOYSA-N 2 0 216.328 2.125 20 0 BEADRP CNc1ccccc1CN1C[C@H](C)CC[C@@H]1C[NH3+] ZINC001205838168 982695747 /nfs/dbraw/zinc/69/57/47/982695747.db2.gz BABYIKWGRISICC-TZMCWYRMSA-N 2 0 247.386 2.288 20 0 BEADRP C[NH+](C)Cc1ccnc(-c2ccc(C[NH3+])cc2)c1 ZINC001241913392 983131026 /nfs/dbraw/zinc/13/10/26/983131026.db2.gz WALUOYVDTCXOSO-UHFFFAOYSA-N 2 0 241.338 2.269 20 0 BEADRP CS[C@@H]1CCC[C@H]([NH2+]CCCN2CCC2)C1 ZINC001354171429 983182731 /nfs/dbraw/zinc/18/27/31/983182731.db2.gz QSEPLSNSTJCZRN-QWHCGFSZSA-N 2 0 242.432 2.346 20 0 BEADRP CNc1ccc(C[N@@H+]2CCC[C@@H](C[NH3+])[C@@H]2C)cc1 ZINC001205915860 983184289 /nfs/dbraw/zinc/18/42/89/983184289.db2.gz RBYAWNMQBBDWMW-JSGCOSHPSA-N 2 0 247.386 2.288 20 0 BEADRP C[NH+]1CC2(C1)CC[NH+](C[C@@H]1CC=CCC1)CC2 ZINC001201422089 983220707 /nfs/dbraw/zinc/22/07/07/983220707.db2.gz GPWCNJYIJKFTDF-CQSZACIVSA-N 2 0 234.387 2.370 20 0 BEADRP C[NH+](C)Cc1cccc(C2=C[C@H]3CC[C@@H](C2)[NH2+]3)n1 ZINC001242021177 983230823 /nfs/dbraw/zinc/23/08/23/983230823.db2.gz AQWCZDVIFRALRW-OLZOCXBDSA-N 2 0 243.354 2.051 20 0 BEADRP CC[C@@H](C)C[NH+]1CCC([N@H+](C)CC)CC1 ZINC001201517246 983313350 /nfs/dbraw/zinc/31/33/50/983313350.db2.gz OSHNZFQZUIXVBW-GFCCVEGCSA-N 2 0 212.381 2.449 20 0 BEADRP CC[N@@H+]1CC[C@H]2C[NH+](Cc3ccccc3)C[C@H]2C1 ZINC001201587736 983348611 /nfs/dbraw/zinc/34/86/11/983348611.db2.gz XFDKMCLDPCNZCF-JKSUJKDBSA-N 2 0 244.382 2.460 20 0 BEADRP CCCCC[NH+]1C[C@@H]2C[NH+](CCC)C[C@H]2C1 ZINC001201743953 983450632 /nfs/dbraw/zinc/45/06/32/983450632.db2.gz AZLAMSKOZHQDJD-KBPBESRZSA-N 2 0 224.392 2.450 20 0 BEADRP CC[NH+]1C[C@H]2C[NH+](CC3CCCC3)C[C@@H]2C1 ZINC001202190303 983595790 /nfs/dbraw/zinc/59/57/90/983595790.db2.gz NUDUMSVKVOOYBV-KBPBESRZSA-N 2 0 222.376 2.060 20 0 BEADRP CN1CCC[C@@H]2C[N@H+](CC3CCCC3)C[C@@H]21 ZINC001202190297 983595817 /nfs/dbraw/zinc/59/58/17/983595817.db2.gz NOAQXSRFJVFOON-KGLIPLIRSA-N 2 0 222.376 2.203 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[N@H+](C)C[C@H]21)C1CCC1 ZINC001561053070 984014071 /nfs/dbraw/zinc/01/40/71/984014071.db2.gz RYVQAQGYUXEUHI-SCUASFONSA-N 2 0 222.376 2.105 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[N@H+](C)C[C@@H]21)C1CCC1 ZINC001561053067 984015475 /nfs/dbraw/zinc/01/54/75/984015475.db2.gz RYVQAQGYUXEUHI-DOERSZECSA-N 2 0 222.376 2.105 20 0 BEADRP [NH3+]CCc1cccc(-c2ccc3c(c2)C[NH2+]C3)c1 ZINC001242674205 984041878 /nfs/dbraw/zinc/04/18/78/984041878.db2.gz NXAMFSMCSSVMOC-UHFFFAOYSA-N 2 0 238.334 2.458 20 0 BEADRP [NH3+]CCc1ccc(-c2ccc3c(c2)C[NH2+]C3)cc1 ZINC001242676259 984045415 /nfs/dbraw/zinc/04/54/15/984045415.db2.gz OOWVASYJSLPQLH-UHFFFAOYSA-N 2 0 238.334 2.458 20 0 BEADRP C[C@@H](Cc1ccc(O)cc1)[NH2+]C[C@H]1CC[C@@H]([NH3+])C1 ZINC001576052620 984144201 /nfs/dbraw/zinc/14/42/01/984144201.db2.gz LZEAPCMONUBVIK-FPMFFAJLSA-N 2 0 248.370 2.040 20 0 BEADRP C[C@@H]1CCC[C@@H](CC[N@H+](C)[C@@H]2[C@H]3C[NH2+]C[C@H]32)C1 ZINC001576670109 984178230 /nfs/dbraw/zinc/17/82/30/984178230.db2.gz YIINMYLEUHGFPI-SEBNEYGDSA-N 2 0 236.403 2.352 20 0 BEADRP C[C@@H]1C[N@H+](CC2CCC2)CCC[C@@H]1C[NH3+] ZINC001205983886 984214568 /nfs/dbraw/zinc/21/45/68/984214568.db2.gz PVOLCLPQHRVRIP-DGCLKSJQSA-N 2 0 210.365 2.093 20 0 BEADRP C[C@@H]1C[N@H+](CC2CCCC2)CCC[C@H]1C[NH3+] ZINC001205985018 984219765 /nfs/dbraw/zinc/21/97/65/984219765.db2.gz VBHBJELQMSVOCA-OCCSQVGLSA-N 2 0 224.392 2.483 20 0 BEADRP [NH3+]Cc1c[nH]c2ccc(C3=CC[NH2+]CC3)cc12 ZINC001240470475 984303705 /nfs/dbraw/zinc/30/37/05/984303705.db2.gz JLTCOAYEQYNCQP-UHFFFAOYSA-N 2 0 227.311 2.003 20 0 BEADRP C[NH2+]Cc1ccc(-c2[nH+]ccc3c2CCN3)cc1 ZINC001242990316 984353613 /nfs/dbraw/zinc/35/36/13/984353613.db2.gz IDCCZCKXVCZDRH-UHFFFAOYSA-N 2 0 239.322 2.436 20 0 BEADRP C[NH2+]Cc1cccc(-c2ccc([C@H](C)[NH3+])nc2)c1 ZINC001242999962 984365804 /nfs/dbraw/zinc/36/58/04/984365804.db2.gz VJXRUQOVHREGAS-NSHDSACASA-N 2 0 241.338 2.488 20 0 BEADRP CCCC[NH2+][C@@]12CC[C@@]([NH2+]C)(C1)CCC2 ZINC001275115187 984495140 /nfs/dbraw/zinc/49/51/40/984495140.db2.gz IRHWXHYYLFMUJU-OLZOCXBDSA-N 2 0 210.365 2.441 20 0 BEADRP CCCCC[N@H+]1C[C@@H]2CC[NH+](C)CC[C@@H]2C1 ZINC001275121298 984498120 /nfs/dbraw/zinc/49/81/20/984498120.db2.gz TZPNONORPBIALP-OKILXGFUSA-N 2 0 224.392 2.450 20 0 BEADRP C[N@@H+]1CCCC2(CC[NH+](CC3CC3)CC2)C1 ZINC001275136970 984504387 /nfs/dbraw/zinc/50/43/87/984504387.db2.gz IASDUHVESDVMSX-UHFFFAOYSA-N 2 0 222.376 2.204 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+]Cc2ccc3c(c2)CCCC3)C1 ZINC001580427842 984531850 /nfs/dbraw/zinc/53/18/50/984531850.db2.gz VSBXATYMUGXZCY-SAZUREKKSA-N 2 0 244.382 2.392 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+][C@@H]2CC[C@H]3CCCC[C@@H]3C2)C1 ZINC001580423468 984533465 /nfs/dbraw/zinc/53/34/65/984533465.db2.gz ZYFXFHFRLAGJTJ-KSTCHIGDSA-N 2 0 222.376 2.425 20 0 BEADRP C1=C(c2ccccc2C2CC[NH2+]CC2)C[NH2+]C1 ZINC001243112300 984582336 /nfs/dbraw/zinc/58/23/36/984582336.db2.gz WJMYEGDYWCLXTC-UHFFFAOYSA-N 2 0 228.339 2.140 20 0 BEADRP CC[N@H+](CCSC)CC(CC)(CC)C[NH3+] ZINC001577728900 984687656 /nfs/dbraw/zinc/68/76/56/984687656.db2.gz VWEJEZKTRXJAKD-UHFFFAOYSA-N 2 0 232.437 2.436 20 0 BEADRP C[C@H]1C[C@H]1C[NH+]1CCC2(CC[N@H+](C)C2)CC1 ZINC001276031486 984788114 /nfs/dbraw/zinc/78/81/14/984788114.db2.gz HRLNDIDBRFKFLV-STQMWFEESA-N 2 0 222.376 2.060 20 0 BEADRP CCOCCCC[NH2+]Cc1ccc(C[NH3+])cc1 ZINC001578105684 984852759 /nfs/dbraw/zinc/85/27/59/984852759.db2.gz FZHMEXKRGMLBGV-UHFFFAOYSA-N 2 0 236.359 2.052 20 0 BEADRP CCO[C@@H]1CCCC[C@H]1[NH2+][C@H]1CC[C@@H](C[NH3+])C1 ZINC001578148914 984855125 /nfs/dbraw/zinc/85/51/25/984855125.db2.gz NSWHANSRSOOYAX-XJFOESAGSA-N 2 0 240.391 2.051 20 0 BEADRP CCC[C@@H](CC)N(CC[NH3+])CC[NH+](CC)CC ZINC001257250142 984855668 /nfs/dbraw/zinc/85/56/68/984855668.db2.gz WKZSMKUUSLFCTJ-CQSZACIVSA-N 2 0 243.439 2.168 20 0 BEADRP CCOc1ccccc1C[NH2+]C[C@H]1CC[C@@H]([NH3+])C1 ZINC001578197897 984866767 /nfs/dbraw/zinc/86/67/67/984866767.db2.gz RVQRQZNKXKYRAM-GXTWGEPZSA-N 2 0 248.370 2.302 20 0 BEADRP CC1CC(C[NH2+][C@H]2CC[NH2+]CC2(C)C)C1 ZINC000691886679 984892435 /nfs/dbraw/zinc/89/24/35/984892435.db2.gz UJEPBHHWDANPAU-MCIGGMRASA-N 2 0 210.365 2.010 20 0 BEADRP CCC[C@H](C)[N@H+](CC)CCC[NH+](C)C ZINC001257324433 984896976 /nfs/dbraw/zinc/89/69/76/984896976.db2.gz OLVOHXSWVXKTOL-LBPRGKRZSA-N 2 0 200.370 2.449 20 0 BEADRP CCC[C@H](C)[NH+]1C[C@@H]2C[NH+](CC)C[C@H]2C1 ZINC001257326527 984897387 /nfs/dbraw/zinc/89/73/87/984897387.db2.gz BITQQQYMGOOJSK-AVGNSLFASA-N 2 0 210.365 2.059 20 0 BEADRP CCc1cccc(C[NH2+][C@H]2C[C@H]([NH3+])C2(C)C)c1 ZINC001578266170 984912112 /nfs/dbraw/zinc/91/21/12/984912112.db2.gz BSKHEGWEMMMUKP-KBPBESRZSA-N 2 0 232.371 2.464 20 0 BEADRP CCC[C@H](C)CC[C@H](C)[NH2+]CCOCC[NH3+] ZINC001257469081 985089049 /nfs/dbraw/zinc/08/90/49/985089049.db2.gz SVQOTNOUCGPAJQ-STQMWFEESA-N 2 0 230.396 2.156 20 0 BEADRP C[N@H+](CCCCCC[NH3+])C[C@@]1(C)CCCCO1 ZINC001578465851 985099576 /nfs/dbraw/zinc/09/95/76/985099576.db2.gz RDOSNWLTUFBOLB-CQSZACIVSA-N 2 0 242.407 2.397 20 0 BEADRP CCCCCC(CCCCC)[NH2+]C[C@@H](O)C[NH3+] ZINC001257549791 985231247 /nfs/dbraw/zinc/23/12/47/985231247.db2.gz DEVRKHMHQPGQIC-AWEZNQCLSA-N 2 0 244.423 2.425 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)[C@@H]1CCCSC1 ZINC001257682898 985275399 /nfs/dbraw/zinc/27/53/99/985275399.db2.gz KPFBFXSMZZUTSM-GFCCVEGCSA-N 2 0 230.421 2.156 20 0 BEADRP CSCC[C@@H](C)[N@H+](C)CCC[NH2+]C1CC1 ZINC000156910871 985277775 /nfs/dbraw/zinc/27/77/75/985277775.db2.gz PZOUPIOWRUKOQQ-LLVKDONJSA-N 2 0 230.421 2.202 20 0 BEADRP c1c(C[N@@H+]2CC[C@H]3C[C@H]3C2)sc2c1C[NH2+]CC2 ZINC000687979613 985446088 /nfs/dbraw/zinc/44/60/88/985446088.db2.gz APGPHGWQSPUETJ-JQWIXIFHSA-N 2 0 248.395 2.236 20 0 BEADRP C[C@H]([NH3+])c1ccc(/C=C/C2CC[NH2+]CC2)cn1 ZINC001243896154 985581096 /nfs/dbraw/zinc/58/10/96/985581096.db2.gz GUKFASYWUIOAEU-VUDBWIFFSA-N 2 0 231.343 2.114 20 0 BEADRP [NH3+][C@H](CC(F)F)C[N@@H+]1CCC[C@H]1C1CCC1 ZINC000688242615 985584363 /nfs/dbraw/zinc/58/43/63/985584363.db2.gz VHGDVTZWLSGJEG-MNOVXSKESA-N 2 0 232.318 2.233 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H](C)CCSC ZINC001258198114 985593664 /nfs/dbraw/zinc/59/36/64/985593664.db2.gz FZXPPNGKFDXSEN-LBPRGKRZSA-N 2 0 232.437 2.450 20 0 BEADRP [NH3+]C1(c2ccccc2C2=C[NH2+]CCC2)CC1 ZINC001243952162 985662870 /nfs/dbraw/zinc/66/28/70/985662870.db2.gz MWLSIEIDHLYXIY-UHFFFAOYSA-N 2 0 214.312 2.359 20 0 BEADRP COCCCC1(C[N@H+](C)C2CC([NH3+])C2)CCC1 ZINC001579012500 985666720 /nfs/dbraw/zinc/66/67/20/985666720.db2.gz NWAVAHOMIDNNTI-UHFFFAOYSA-N 2 0 240.391 2.005 20 0 BEADRP COCCCC[N@@H+]1CCCC[C@@]12CCC[NH2+]C2 ZINC001579013286 985667954 /nfs/dbraw/zinc/66/79/54/985667954.db2.gz ZFOPVUMPNMNZHX-AWEZNQCLSA-N 2 0 240.391 2.021 20 0 BEADRP COCc1ccc(C[NH2+]C[C@H]2CC[C@@H]([NH3+])C2)cc1 ZINC001579090627 985709946 /nfs/dbraw/zinc/70/99/46/985709946.db2.gz LSJRSCKEHCZSEE-LSDHHAIUSA-N 2 0 248.370 2.050 20 0 BEADRP CC[C@H](CC(F)F)C[N@@H+]1CC[C@H](CC[NH3+])C1 ZINC000688725587 985717111 /nfs/dbraw/zinc/71/71/11/985717111.db2.gz IQKBEMHRDDXRCG-MNOVXSKESA-N 2 0 234.334 2.339 20 0 BEADRP CC[C@H](CC(F)F)C[N@@H+]1CCC[C@@H](C[NH3+])C1 ZINC000688760799 985719308 /nfs/dbraw/zinc/71/93/08/985719308.db2.gz LUMZCBBJCPFYJO-MNOVXSKESA-N 2 0 234.334 2.339 20 0 BEADRP CC[C@H](CC(F)F)C[N@@H+]1CCC[C@H](C[NH3+])C1 ZINC000688760796 985719537 /nfs/dbraw/zinc/71/95/37/985719537.db2.gz LUMZCBBJCPFYJO-GHMZBOCLSA-N 2 0 234.334 2.339 20 0 BEADRP C[C@@H]([NH2+]CCC1([NH3+])CCOCC1)C1CCCC1 ZINC001579414713 985887664 /nfs/dbraw/zinc/88/76/64/985887664.db2.gz LTXNNABFDPEOAP-GFCCVEGCSA-N 2 0 240.391 2.053 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]CCCCC[NH+](C)C ZINC001258447903 985889682 /nfs/dbraw/zinc/88/96/82/985889682.db2.gz YLQBFFQPGQVUBI-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H](CC1CC1)[NH+]1CC2(C1)CC[NH+](C)CC2 ZINC001258475008 985942151 /nfs/dbraw/zinc/94/21/51/985942151.db2.gz ZZCAJRBZBLHSNG-LBPRGKRZSA-N 2 0 222.376 2.203 20 0 BEADRP C[C@@H]1C[C@H](C[NH2+][C@@H]2CCCC[C@H]2[NH3+])C[C@H](C)O1 ZINC001579492392 986013485 /nfs/dbraw/zinc/01/34/85/986013485.db2.gz ALVPONRXXZANIS-MBJXGIAVSA-N 2 0 240.391 2.050 20 0 BEADRP F[C@H]1CCCC[C@H]1[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC001461679040 986105406 /nfs/dbraw/zinc/10/54/06/986105406.db2.gz UKOXHEIBSBABER-RFQIPJPRSA-N 2 0 240.366 2.484 20 0 BEADRP Cc1cc(C[NH+]2CCC(CC[NH3+])CC2)c(C)o1 ZINC001579598504 986109474 /nfs/dbraw/zinc/10/94/74/986109474.db2.gz YNBJVJAQCOVWKD-UHFFFAOYSA-N 2 0 236.359 2.457 20 0 BEADRP Cc1cc(C[NH2+][C@@H]2C[C@@H]([NH3+])C2(C)C)cc(C)c1O ZINC001579601776 986127583 /nfs/dbraw/zinc/12/75/83/986127583.db2.gz ZXRFTGDEDAZULS-CHWSQXEVSA-N 2 0 248.370 2.224 20 0 BEADRP Cc1ccc(F)c(C[NH2+]C[C@H]2CC[C@@H]([NH3+])C2)c1 ZINC001579706568 986183874 /nfs/dbraw/zinc/18/38/74/986183874.db2.gz QZRLYIZPKBURTG-WCQYABFASA-N 2 0 236.334 2.351 20 0 BEADRP Cc1cccc(CC2C[NH+](C[C@H]3C[C@@H]([NH3+])C3)C2)c1 ZINC001579759653 986207785 /nfs/dbraw/zinc/20/77/85/986207785.db2.gz QPGVNBPBZDPTBY-FZNQNYSPSA-N 2 0 244.382 2.207 20 0 BEADRP C[C@H]1CCC[C@@H]([NH2+]C[C@H]2CCC[N@H+](C)C2)C1 ZINC001258807683 986265995 /nfs/dbraw/zinc/26/59/95/986265995.db2.gz JQNCSLPKMWJRKT-BFHYXJOUSA-N 2 0 224.392 2.497 20 0 BEADRP Cn1cccc1[C@@H]1CCC[N@@H+]1C[C@H]1CC[C@@H]([NH3+])C1 ZINC001579975210 986380147 /nfs/dbraw/zinc/38/01/47/986380147.db2.gz WFXSLDSBTTVIQL-GUTXKFCHSA-N 2 0 247.386 2.289 20 0 BEADRP C[NH2+]Cc1cccc(-c2cc(C[NH3+])ccn2)c1F ZINC001244856931 986401271 /nfs/dbraw/zinc/40/12/71/986401271.db2.gz QVFZHRAFVJQIGN-UHFFFAOYSA-N 2 0 245.301 2.066 20 0 BEADRP C[NH+](C)Cc1cccc(-c2c[nH+]ccc2N)c1F ZINC001244863902 986403834 /nfs/dbraw/zinc/40/38/34/986403834.db2.gz GWCFMEUNMYDYCC-UHFFFAOYSA-N 2 0 245.301 2.362 20 0 BEADRP FC(F)C1CC([NH2+]C[C@@H]2CCC[NH2+]CC2)C1 ZINC001580024126 986423355 /nfs/dbraw/zinc/42/33/55/986423355.db2.gz QINCLLPVAACCOL-KPPDAEKUSA-N 2 0 232.318 2.009 20 0 BEADRP F[C@]1(c2ccccc2)C[C@H]1[NH2+]CC1CC[NH2+]CC1 ZINC001580026274 986423850 /nfs/dbraw/zinc/42/38/50/986423850.db2.gz BJEWLFCTGLFALQ-CABCVRRESA-N 2 0 248.345 2.213 20 0 BEADRP F[C@]1(c2ccccc2)C[C@@H]1[NH2+]CC1CC[NH2+]CC1 ZINC001580026275 986428127 /nfs/dbraw/zinc/42/81/27/986428127.db2.gz BJEWLFCTGLFALQ-GJZGRUSLSA-N 2 0 248.345 2.213 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[NH+]2CCC1CC2)C1CCCC1 ZINC001462632603 986465723 /nfs/dbraw/zinc/46/57/23/986465723.db2.gz DTYNQGKLUYDCTA-WFASDCNBSA-N 2 0 236.403 2.497 20 0 BEADRP CCCC[C@@H](C)[NH2+]C[C@@H]1C[NH+]2CCC1CC2 ZINC001462632295 986467062 /nfs/dbraw/zinc/46/70/62/986467062.db2.gz CUWJATFNYASIJY-TZMCWYRMSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H](C[NH2+][C@H]1CCCOC1)CC(C)(C)CC[NH3+] ZINC001254369907 986600579 /nfs/dbraw/zinc/60/05/79/986600579.db2.gz MDIRYJXEFLPRHR-OLZOCXBDSA-N 2 0 242.407 2.156 20 0 BEADRP [NH3+][C@@]12CCC[C@@H]1C[N@H+](CC1CC3(CCC3)C1)C2 ZINC001580158561 986629939 /nfs/dbraw/zinc/62/99/39/986629939.db2.gz SUKBRYOTICYQAQ-UKRRQHHQSA-N 2 0 234.387 2.380 20 0 BEADRP [NH3+][C@@H]1CC12CC([NH2+]CC[C@@H]1CC=CCC1)C2 ZINC001580164353 986637516 /nfs/dbraw/zinc/63/75/16/986637516.db2.gz HOSAMTXYTAZUMQ-NELGMTEASA-N 2 0 220.360 2.202 20 0 BEADRP [NH3+][C@@H]1CC12CC([NH2+][C@@H]1CCc3ccccc31)C2 ZINC001580166654 986639774 /nfs/dbraw/zinc/63/97/74/986639774.db2.gz QUILZXFQYQEHGT-INTODGSJSA-N 2 0 228.339 2.143 20 0 BEADRP [NH3+][C@@H]1CC12CC([NH2+]C[C@@H]1C[C@H]1C1CCCC1)C2 ZINC001580167207 986640864 /nfs/dbraw/zinc/64/08/64/986640864.db2.gz VQZJLMJACAYBNK-WQNPGBKJSA-N 2 0 234.387 2.282 20 0 BEADRP [NH3+][C@@H]1CC12CC([NH2+]C[C@@H]1C[C@@H]1C1CCCC1)C2 ZINC001580167204 986642423 /nfs/dbraw/zinc/64/24/23/986642423.db2.gz VQZJLMJACAYBNK-FMUKHGEOSA-N 2 0 234.387 2.282 20 0 BEADRP [NH3+]C1CC([NH2+]CCC[C@@H]2CC2(Cl)Cl)C1 ZINC001580167015 986644896 /nfs/dbraw/zinc/64/48/96/986644896.db2.gz ZAJJGPOMOWFHHD-AFPNSQJFSA-N 2 0 237.174 2.040 20 0 BEADRP [NH3+][C@H]1C[C@H]2C[C@@H](C1)[N@H+](CC1CC3(CCC3)C1)C2 ZINC001580169459 986649062 /nfs/dbraw/zinc/64/90/62/986649062.db2.gz FYWGLMSFTTYTGQ-UBHSHLNASA-N 2 0 234.387 2.378 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH+]2C[C@H]3CCC[C@@H]3C2)CC1 ZINC001254515814 986664962 /nfs/dbraw/zinc/66/49/62/986664962.db2.gz DJLYCFKHCUMNKO-MCIONIFRSA-N 2 0 222.376 2.203 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH+]2C[C@@H]3CCC[C@@H]3C2)CC1 ZINC001254515812 986671520 /nfs/dbraw/zinc/67/15/20/986671520.db2.gz DJLYCFKHCUMNKO-HZSPNIEDSA-N 2 0 222.376 2.203 20 0 BEADRP C[NH+](C)C1CCC([NH2+]CC2CCC2)CC1 ZINC000379930774 986683746 /nfs/dbraw/zinc/68/37/46/986683746.db2.gz OHITUIZPFWWNNH-UHFFFAOYSA-N 2 0 210.365 2.249 20 0 BEADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@@H]2CC[C@@H]3CCC[C@H]23)C1 ZINC001580258359 986713620 /nfs/dbraw/zinc/71/36/20/986713620.db2.gz NSRSOUVLFICBRD-XHJNMGKDSA-N 2 0 222.376 2.282 20 0 BEADRP [NH3+]CC[C@@H]1CCCC[N@@H+]1CC1CCSCC1 ZINC001580286314 986732574 /nfs/dbraw/zinc/73/25/74/986732574.db2.gz CKEZVBDIUUKMDR-ZDUSSCGKSA-N 2 0 242.432 2.333 20 0 BEADRP Cc1cc(C)c(C[NH+]2CC3(C2)CC[NH+](C)CC3)[nH]1 ZINC001137331188 986787165 /nfs/dbraw/zinc/78/71/65/986787165.db2.gz UIUJEOPZPRTCEV-UHFFFAOYSA-N 2 0 247.386 2.159 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[NH2+][C@@H]2C[C@@H]3CC[C@@H](C3)C2)C1 ZINC001580389916 986816067 /nfs/dbraw/zinc/81/60/67/986816067.db2.gz XDKAIQVBAMXULQ-VJTDZRGJSA-N 2 0 222.376 2.282 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[NH2+][C@H](c2cccnc2)C2CC2)C1 ZINC001580389495 986816377 /nfs/dbraw/zinc/81/63/77/986816377.db2.gz KJWWQWUFTJRZNF-GLQYFDAESA-N 2 0 245.370 2.250 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+][C@H]2CCC[C@H]2Cc2ccccc2)C1 ZINC001580423201 986841061 /nfs/dbraw/zinc/84/10/61/986841061.db2.gz UCBQKFMGSPTIOF-JONQDZQNSA-N 2 0 244.382 2.477 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+][C@@H]2CC[C@H]3CCCC[C@H]3C2)C1 ZINC001580423467 986841375 /nfs/dbraw/zinc/84/13/75/986841375.db2.gz ZYFXFHFRLAGJTJ-ITGHMWBKSA-N 2 0 222.376 2.425 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+]CCc2ccc(Cl)cc2)C1 ZINC001580427862 986845026 /nfs/dbraw/zinc/84/50/26/986845026.db2.gz XMIOMEQWLRUDNE-AULYBMBSSA-N 2 0 238.762 2.209 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]C2CC(c3cccc(F)c3)C2)C1 ZINC001580430681 986848709 /nfs/dbraw/zinc/84/87/09/986848709.db2.gz VEWYXNHUKIOBDY-AZQWLYJSSA-N 2 0 234.318 2.151 20 0 BEADRP CCCC[C@H](C)N(CC[NH3+])CC[NH+](CC)CC ZINC001255312904 986907252 /nfs/dbraw/zinc/90/72/52/986907252.db2.gz BMGYQXSMUOVCMR-AWEZNQCLSA-N 2 0 243.439 2.168 20 0 BEADRP CCCC[C@@H](C)[N@H+]1C[C@H]2C[NH+](C)C[C@H]2C1 ZINC001255331038 986926472 /nfs/dbraw/zinc/92/64/72/986926472.db2.gz YNGPIUMBFVJHOM-UPJWGTAASA-N 2 0 210.365 2.059 20 0 BEADRP C[NH+](C)Cc1cccc(-c2ccncc2C[NH3+])c1 ZINC001245560832 986954800 /nfs/dbraw/zinc/95/48/00/986954800.db2.gz VSGAQEQWPMGQGU-UHFFFAOYSA-N 2 0 241.338 2.269 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]C[C@@H]1CCCOC1 ZINC001255944782 987079646 /nfs/dbraw/zinc/07/96/46/987079646.db2.gz ZKJGBSHJHYWLJR-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)([NH3+])c1ccc(-c2c[nH+]ccc2N)cc1 ZINC001245912003 987143997 /nfs/dbraw/zinc/14/39/97/987143997.db2.gz HVHDAMHBHXAIST-UHFFFAOYSA-N 2 0 227.311 2.355 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CC[N@H+](C[C@H]2CC3CCC2CC3)C1 ZINC000691657811 987288366 /nfs/dbraw/zinc/28/83/66/987288366.db2.gz AIQKXNBCFRNUME-HTXSYXIBSA-N 2 0 236.403 2.482 20 0 BEADRP CC1(C)[C@H]([NH2+]CCCCF)[C@@H]2CCC[NH2+][C@@H]21 ZINC000693662183 987313752 /nfs/dbraw/zinc/31/37/52/987313752.db2.gz FLLFWVUXEKJVNA-TUAOUCFPSA-N 2 0 228.355 2.102 20 0 BEADRP C[C@H](C[NH2+][C@@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C)C1CC1 ZINC000693679646 987313838 /nfs/dbraw/zinc/31/38/38/987313838.db2.gz QLRDQYOHZVLJLK-RUZUBIRVSA-N 2 0 236.403 2.399 20 0 BEADRP CC1CC(C[NH2+][C@@H]2[C@@H]3CCC[NH2+][C@@H]3C2(C)C)C1 ZINC000693719286 987313891 /nfs/dbraw/zinc/31/38/91/987313891.db2.gz RDMHTHFANJRMSA-MYXTYHMWSA-N 2 0 236.403 2.399 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H](C)C1(Cl)CC1 ZINC000695684473 987334722 /nfs/dbraw/zinc/33/47/22/987334722.db2.gz GADXNVUWOWDXRG-NSHDSACASA-N 2 0 232.799 2.468 20 0 BEADRP C[C@@H]1C[N@@H+](C[C@@H]2CCCC[NH2+]C2)C[C@H](C)S1 ZINC000697059071 987346665 /nfs/dbraw/zinc/34/66/65/987346665.db2.gz WMHVRXFLUFJBDV-FRRDWIJNSA-N 2 0 242.432 2.202 20 0 BEADRP CCC1CC[NH+](C[C@H]2CCCC[NH2+]C2)CC1 ZINC000697053759 987347250 /nfs/dbraw/zinc/34/72/50/987347250.db2.gz XDNLUXITXGHCSJ-AWEZNQCLSA-N 2 0 224.392 2.498 20 0 BEADRP CC1(C)CC[N@H+](C[C@@H]2CCCC[NH2+]C2)C1 ZINC000697038341 987348062 /nfs/dbraw/zinc/34/80/62/987348062.db2.gz BRJHIZFSNVCKBA-GFCCVEGCSA-N 2 0 210.365 2.108 20 0 BEADRP CC[N@H+](CC1CC1)C[C@@H]1CCCC[NH2+]C1 ZINC000697040311 987348089 /nfs/dbraw/zinc/34/80/89/987348089.db2.gz HZRKADQZWCGDPM-CYBMUJFWSA-N 2 0 210.365 2.108 20 0 BEADRP CCCOC1CCC([NH2+]C2CC[NH2+]CC2)CC1 ZINC001246072184 987359959 /nfs/dbraw/zinc/35/99/59/987359959.db2.gz GYMCHURZTXPWDW-UHFFFAOYSA-N 2 0 240.391 2.066 20 0 BEADRP CSC(C)(C)C[C@@H](C)[NH2+]C1CC[NH2+]CC1 ZINC001246079541 987372643 /nfs/dbraw/zinc/37/26/43/987372643.db2.gz QCNZGDNLLULSLJ-SNVBAGLBSA-N 2 0 230.421 2.248 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CCCCCCCC[NH3+])CN1 ZINC001246079532 987373761 /nfs/dbraw/zinc/37/37/61/987373761.db2.gz KPVSASALKWWMFN-ZIAGYGMSSA-N 2 0 241.423 2.016 20 0 BEADRP C[C@@H]1C[C@@H](C)[N@H+](CC2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000699310217 987374546 /nfs/dbraw/zinc/37/45/46/987374546.db2.gz FLSRAYNKDIQJRC-DUJLVANISA-N 2 0 222.376 2.247 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+][C@H]2CC[C@H](C)NC2)C1 ZINC001246083816 987381485 /nfs/dbraw/zinc/38/14/85/987381485.db2.gz KHFMBHIDFPGSFM-XQHKEYJVSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H]1CC[C@@H](C[NH2+]C2Cc3ccccc3C2)C[NH2+]1 ZINC001246095091 987405019 /nfs/dbraw/zinc/40/50/19/987405019.db2.gz JSJHPOTWGPEVBL-QWHCGFSZSA-N 2 0 244.382 2.132 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+]C2Cc3ccccc3C2)C[NH2+]1 ZINC001246095089 987406028 /nfs/dbraw/zinc/40/60/28/987406028.db2.gz JSJHPOTWGPEVBL-OLZOCXBDSA-N 2 0 244.382 2.132 20 0 BEADRP C[C@@]1([NH2+]C2CCCCCCC2)CC[NH2+]C1 ZINC001246095900 987406036 /nfs/dbraw/zinc/40/60/36/987406036.db2.gz GWZAQQMIKVLJOJ-CYBMUJFWSA-N 2 0 210.365 2.441 20 0 BEADRP CSCC[C@H](C)[NH2+]C[C@H]1CC[C@H](C)[NH2+]C1 ZINC001246099005 987414396 /nfs/dbraw/zinc/41/43/96/987414396.db2.gz QYDFQXGMGDCZIQ-SRVKXCTJSA-N 2 0 230.421 2.106 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]C[C@H]1C[NH2+]C[C@@H](C)C1 ZINC001246107181 987436770 /nfs/dbraw/zinc/43/67/70/987436770.db2.gz ZITXRHSFIMEARC-GMXVVIOVSA-N 2 0 210.365 2.010 20 0 BEADRP C1C[C@@H]([NH2+][C@H]2CCC3(C2)CC[NH2+]CC3)CS1 ZINC001246133793 987486528 /nfs/dbraw/zinc/48/65/28/987486528.db2.gz QSPDMMLEPBLNNF-NWDGAFQWSA-N 2 0 240.416 2.004 20 0 BEADRP CC1(C)CCC[C@H]([NH2+][C@@H]2C[NH2+]CC23CC3)C1 ZINC001246136398 987494711 /nfs/dbraw/zinc/49/47/11/987494711.db2.gz WTSJIXYSZFDKFS-NWDGAFQWSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C[C@]2(F)CC[NH2+]C2)CC(C)(C)C1 ZINC001246142517 987496941 /nfs/dbraw/zinc/49/69/41/987496941.db2.gz IVEADAAXDLXMNB-BZPMIXESSA-N 2 0 242.382 2.492 20 0 BEADRP CC(C)(C)C1CCC([NH2+][C@H]2[C@H]3C[NH2+]C[C@H]32)CC1 ZINC001246146410 987502397 /nfs/dbraw/zinc/50/23/97/987502397.db2.gz ITBMOKAFRCGKTE-MOIJGLSHSA-N 2 0 236.403 2.399 20 0 BEADRP C[C@H]1C[C@H]([NH2+][C@H]2CC[C@@H]3C[NH2+]C[C@@H]32)C[C@@H](C)C1 ZINC001246145199 987503658 /nfs/dbraw/zinc/50/36/58/987503658.db2.gz PADVIRTYXYECEK-QZOBBIQNSA-N 2 0 236.403 2.399 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@H]2CC[C@@H]3C[NH2+]C[C@@H]32)C[C@@H]1C ZINC001246145126 987503993 /nfs/dbraw/zinc/50/39/93/987503993.db2.gz OUBHXAJDEAXXHB-QZOBBIQNSA-N 2 0 236.403 2.399 20 0 BEADRP CCCC[C@H](CC(C)C)[NH2+][C@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001246148019 987507235 /nfs/dbraw/zinc/50/72/35/987507235.db2.gz OMKRWWJULFOSTE-YIYPIFLZSA-N 2 0 224.392 2.399 20 0 BEADRP CC(C)C[C@H](C)C[C@@H](C)[NH2+][C@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001246150676 987508634 /nfs/dbraw/zinc/50/86/34/987508634.db2.gz XLPXBTNZQBOPPA-VJTDZRGJSA-N 2 0 224.392 2.255 20 0 BEADRP CC[C@H](C)C[C@H](CC)[NH2+][C@H]1[C@@H]2C[C@H]1C[NH2+]C2 ZINC001246151081 987512039 /nfs/dbraw/zinc/51/20/39/987512039.db2.gz VXDHFRHQBWDDPM-PDWCTOEPSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@H]1CC[C@@H](n2c(C[NH3+])cc3ccccc32)C[NH2+]1 ZINC001246164761 987526331 /nfs/dbraw/zinc/52/63/31/987526331.db2.gz BCZQQWCTOJVMMM-WCQYABFASA-N 2 0 243.354 2.413 20 0 BEADRP C[C@H](c1cccnc1)[N@@H+]1C[C@H]2CC[NH+](C)C[C@H]2C1 ZINC001473702074 987530843 /nfs/dbraw/zinc/53/08/43/987530843.db2.gz BOAKPLVMAMDKDZ-YUELXQCFSA-N 2 0 245.370 2.026 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[NH2+][C@H](C)C1)c1cccc(N)c1 ZINC001246175246 987543893 /nfs/dbraw/zinc/54/38/93/987543893.db2.gz JECYUTRPXLBECJ-SUNKGSAMSA-N 2 0 233.359 2.060 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]C/C=C/c2ccccc2)CC[NH2+]1 ZINC001246177743 987550169 /nfs/dbraw/zinc/55/01/69/987550169.db2.gz DNAQQCYVDJKOBX-MNOINKQASA-N 2 0 230.355 2.430 20 0 BEADRP CC(C)C[C@H](C)C[C@@H](C)[NH2+]C[C@@H]1CC[NH2+]1 ZINC001246192978 987558337 /nfs/dbraw/zinc/55/83/37/987558337.db2.gz KWDZQHXNPYTIAG-XQQFMLRXSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C[C@H]2CCC[NH2+]2)C[C@@H]1C ZINC001246188340 987572590 /nfs/dbraw/zinc/57/25/90/987572590.db2.gz WFELSUDSWVFUSN-YVECIDJPSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)CCC[N@@H+]1C[C@H]2C[NH+](C)C[C@@]2(C)C1 ZINC001473842379 987578472 /nfs/dbraw/zinc/57/84/72/987578472.db2.gz NVRYDDAZGAJCSA-KGLIPLIRSA-N 2 0 224.392 2.306 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C[C@H]2CC[NH2+]2)CC(C)(C)C1 ZINC001246192671 987582092 /nfs/dbraw/zinc/58/20/92/987582092.db2.gz JHPGLFIUQJOVBS-IJLUTSLNSA-N 2 0 210.365 2.153 20 0 BEADRP CSC(C)(C)C[C@H](C)[NH2+]C[C@H]1CCC[NH2+]C1 ZINC001246195583 987590497 /nfs/dbraw/zinc/59/04/97/987590497.db2.gz ADOKDUGKLLGOJA-RYUDHWBXSA-N 2 0 244.448 2.496 20 0 BEADRP CSC(C)(C)C[C@H](C)[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC001246195582 987592812 /nfs/dbraw/zinc/59/28/12/987592812.db2.gz ADOKDUGKLLGOJA-NWDGAFQWSA-N 2 0 244.448 2.496 20 0 BEADRP Fc1ccc(CCC[NH2+]C2CC[NH2+]CC2)cc1 ZINC001246203638 987600586 /nfs/dbraw/zinc/60/05/86/987600586.db2.gz CCJSXNUXJQHEFJ-UHFFFAOYSA-N 2 0 236.334 2.100 20 0 BEADRP C[C@@H]1CC[C@@H](N[C@H]2CCNc3ccccc32)C[NH2+]1 ZINC001246229906 987625005 /nfs/dbraw/zinc/62/50/05/987625005.db2.gz LWTPRBXLSTYHSA-JMSVASOKSA-N 2 0 245.370 2.273 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CCCc3ncccc32)CC[NH2+]1 ZINC001246231918 987628644 /nfs/dbraw/zinc/62/86/44/987628644.db2.gz UZPDONRNTVNOIL-JMSVASOKSA-N 2 0 245.370 2.189 20 0 BEADRP C[C@H]1C[C@@H]([NH2+][C@H]2CC[C@@H]3CCC[C@@H]32)CC[NH2+]1 ZINC001246232776 987629625 /nfs/dbraw/zinc/62/96/25/987629625.db2.gz ZRSXQOGTKRSLIJ-PEDHHIEDSA-N 2 0 222.376 2.295 20 0 BEADRP Cc1ccccc1OC[C@H](C)[NH2+]C1CC[NH2+]CC1 ZINC001246236558 987634539 /nfs/dbraw/zinc/63/45/39/987634539.db2.gz MICADAQJTDIWRF-ZDUSSCGKSA-N 2 0 248.370 2.104 20 0 BEADRP CC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1cccnc1 ZINC001246238375 987638537 /nfs/dbraw/zinc/63/85/37/987638537.db2.gz LQKUIPBFSJZWGN-IZGVIRRGSA-N 2 0 245.370 2.405 20 0 BEADRP CCC1([NH2+][C@H]2C[NH2+][C@H](C)C2)CCCCC1 ZINC001246253247 987651485 /nfs/dbraw/zinc/65/14/85/987651485.db2.gz DDLJPYKBZYOWQK-VXGBXAGGSA-N 2 0 210.365 2.439 20 0 BEADRP C[C@H]1C[C@H]([NH2+][C@@H]2C[C@H]2c2ccccc2)CC[NH2+]1 ZINC001246263632 987659035 /nfs/dbraw/zinc/65/90/35/987659035.db2.gz KHETVUGRBYWJAI-PMOUVXMZSA-N 2 0 230.355 2.273 20 0 BEADRP c1cc2ccncc2c(C[NH2+]C2CC[NH2+]CC2)c1 ZINC001246294126 987686591 /nfs/dbraw/zinc/68/65/91/987686591.db2.gz LWZWXMQFCFHJRI-UHFFFAOYSA-N 2 0 241.338 2.076 20 0 BEADRP Cc1ccc2c(c1)C[C@@H]([NH2+]CC[C@H](C)[NH3+])CC2 ZINC001246302528 987701007 /nfs/dbraw/zinc/70/10/07/987701007.db2.gz ZCYXYRZVJRKRPX-WFASDCNBSA-N 2 0 232.371 2.179 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H]1CCO[C@@H](c2ccccc2)C1 ZINC001246302730 987701889 /nfs/dbraw/zinc/70/18/89/987701889.db2.gz AGJKZKKTNKLCQS-NWANDNLSSA-N 2 0 248.370 2.234 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2CCSC[C@H]2C)CC1 ZINC001474376494 987704851 /nfs/dbraw/zinc/70/48/51/987704851.db2.gz OFOKGIWFEYUHRQ-GFCCVEGCSA-N 2 0 242.432 2.156 20 0 BEADRP Cc1cccc2c1CC[C@H]([NH2+]CC[C@H](C)[NH3+])C2 ZINC001246305923 987706133 /nfs/dbraw/zinc/70/61/33/987706133.db2.gz PCDJMFLNYOZHTI-JSGCOSHPSA-N 2 0 232.371 2.179 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@H](c2cccnc2)C2CC2)CC[NH2+]1 ZINC001246325512 987731008 /nfs/dbraw/zinc/73/10/08/987731008.db2.gz ASEVCPXHEVMUSF-UGFHNGPFSA-N 2 0 245.370 2.263 20 0 BEADRP C[C@@H]1CC[C@H](n2ccc3cccc(C[NH3+])c32)C[NH2+]1 ZINC001246327681 987735596 /nfs/dbraw/zinc/73/55/96/987735596.db2.gz UFECQAPVCAIQLH-RISCZKNCSA-N 2 0 243.354 2.413 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C(C)(C)c2ccncc2)CC[NH2+]1 ZINC001246329023 987735946 /nfs/dbraw/zinc/73/59/46/987735946.db2.gz MWGLSKBINULLTL-DGCLKSJQSA-N 2 0 233.359 2.047 20 0 BEADRP Cc1cccc2c1CC[C@@H]([NH2+]C[C@@H]([NH3+])C(C)C)C2 ZINC001246332890 987740003 /nfs/dbraw/zinc/74/00/03/987740003.db2.gz NWSQISJVHZDECV-GDBMZVCRSA-N 2 0 246.398 2.425 20 0 BEADRP CC[N@H+](C[C@@H](C)OC)CC1CC[NH+](CC)CC1 ZINC001474537926 987751735 /nfs/dbraw/zinc/75/17/35/987751735.db2.gz QCEYCVJKCZEWKS-CYBMUJFWSA-N 2 0 242.407 2.075 20 0 BEADRP [NH3+][C@@]12CC[C@@]([NH2+][C@H]3CCCSC3)(C1)CCC2 ZINC001246342213 987752972 /nfs/dbraw/zinc/75/29/72/987752972.db2.gz RXWHHFORLBICLW-RWMBFGLXSA-N 2 0 240.416 2.276 20 0 BEADRP C[NH2+]CC[C@H](C)[NH2+]CCc1c[nH]c2ccccc12 ZINC001246345654 987757705 /nfs/dbraw/zinc/75/77/05/987757705.db2.gz JSRZBYKTJCVFAQ-LBPRGKRZSA-N 2 0 245.370 2.298 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+][C@@H]2CC[NH2+][C@H](C)C2)CC1 ZINC001246358623 987768686 /nfs/dbraw/zinc/76/86/86/987768686.db2.gz GAZAVGXSJNBHAV-FVCCEPFGSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+][C@H]2CCCC[NH2+]C2)CC1 ZINC001246363049 987770292 /nfs/dbraw/zinc/77/02/92/987770292.db2.gz OPSPVZOOYBNHSQ-XQQFMLRXSA-N 2 0 210.365 2.297 20 0 BEADRP C([NH2+]C1CC[NH2+]CC1)C1(CC2CCC2)CC1 ZINC001246375119 987775465 /nfs/dbraw/zinc/77/54/65/987775465.db2.gz HRHLTLINVNNGBH-UHFFFAOYSA-N 2 0 222.376 2.298 20 0 BEADRP Cc1cccc(C(C)(C)C[NH2+]C2CC[NH2+]CC2)n1 ZINC001246394275 987785062 /nfs/dbraw/zinc/78/50/62/987785062.db2.gz ZHABFWIEMWAONA-UHFFFAOYSA-N 2 0 247.386 2.009 20 0 BEADRP C[C@H]1C[C@H]([NH2+]C(C)(C)Cc2ccncc2)CC[NH2+]1 ZINC001246410861 987790695 /nfs/dbraw/zinc/79/06/95/987790695.db2.gz YEMGNGIQEFXSTH-GXTWGEPZSA-N 2 0 247.386 2.133 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCC(C)(C)C2)C[NH2+]1 ZINC001246437249 987800654 /nfs/dbraw/zinc/80/06/54/987800654.db2.gz UMQDKCHMZIZFBS-UTUOFQBUSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)CCC[C@H](C)[NH2+][C@@H]1CC12C[NH2+]C2 ZINC001246445426 987803458 /nfs/dbraw/zinc/80/34/58/987803458.db2.gz OCMBLVKOBNMREV-NWDGAFQWSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)=CCC[C@H](C)[NH2+][C@@H]1CC12C[NH2+]C2 ZINC001246446825 987806366 /nfs/dbraw/zinc/80/63/66/987806366.db2.gz UGCNJZDOFRQJDB-NWDGAFQWSA-N 2 0 208.349 2.073 20 0 BEADRP CC(C)C[C@H](C)C[C@@H](C)[NH2+][C@H]1CC12C[NH2+]C2 ZINC001246446765 987806666 /nfs/dbraw/zinc/80/66/66/987806666.db2.gz TYQVJQLOHIKWML-XQQFMLRXSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CC23C[NH2+]C3)CC(C)(C)C1 ZINC001246446373 987806984 /nfs/dbraw/zinc/80/69/84/987806984.db2.gz RVUOZNJFFHKOGN-IJLUTSLNSA-N 2 0 222.376 2.153 20 0 BEADRP CCCC[C@H](CCC)[NH2+]CCCNCCC[NH3+] ZINC001246453878 987810265 /nfs/dbraw/zinc/81/02/65/987810265.db2.gz QREFFBWGTFTMHK-AWEZNQCLSA-N 2 0 243.439 2.263 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2Cc3ccc(F)cc3C2)CC[NH2+]1 ZINC001246451895 987810335 /nfs/dbraw/zinc/81/03/35/987810335.db2.gz IFIOPLPUHFROKX-VCTAVGKDSA-N 2 0 248.345 2.023 20 0 BEADRP C[C@H]1C[C@H]([NH2+][C@H]2C[C@@](C)([NH3+])C2)C[C@@H](C)C1 ZINC001246458506 987816850 /nfs/dbraw/zinc/81/68/50/987816850.db2.gz HAKYSZJHASUFHR-PNWMVKDVSA-N 2 0 210.365 2.281 20 0 BEADRP CC[C@]1([NH2+]C2CCC(C)CC2)CC[NH2+]C1 ZINC001246459183 987817106 /nfs/dbraw/zinc/81/71/06/987817106.db2.gz JMJQNPQHLPWONF-BPCQOVAHSA-N 2 0 210.365 2.297 20 0 BEADRP C[NH2+][C@H]1C[C@H]([NH2+][C@@H]2CC[C@@H](C)[C@H](C)C2)C1 ZINC001246461678 987819699 /nfs/dbraw/zinc/81/96/99/987819699.db2.gz PEMDERSRFFMBNC-SYLRKERUSA-N 2 0 210.365 2.151 20 0 BEADRP CC(C)[NH2+]CC[NH2+][C@@H]1CC[C@H](C)[C@@H](C)C1 ZINC001246467633 987825216 /nfs/dbraw/zinc/82/52/16/987825216.db2.gz ZJJFXJNEVGWQBZ-RWMBFGLXSA-N 2 0 212.381 2.399 20 0 BEADRP CC1(C)CCC[C@H]([NH2+][C@H]2C[C@@](C)([NH3+])C2)C1 ZINC001246466006 987826301 /nfs/dbraw/zinc/82/63/01/987826301.db2.gz UTQVHDDLLZGIFM-GMXVVIOVSA-N 2 0 210.365 2.425 20 0 BEADRP CC(C)CC[C@H](C)[NH2+]C[C@@H]1CC[NH2+]C[C@@H]1F ZINC001246474849 987830596 /nfs/dbraw/zinc/83/05/96/987830596.db2.gz BQQRPORORIKCTE-AVGNSLFASA-N 2 0 230.371 2.348 20 0 BEADRP CC1(C)CCC[C@@H]([NH2+]C[C@@H]2CC[NH2+]C[C@@H]2F)C1 ZINC001246475960 987832302 /nfs/dbraw/zinc/83/23/02/987832302.db2.gz IAFLBDDFXVZTFF-XQQFMLRXSA-N 2 0 242.382 2.492 20 0 BEADRP CCCC[C@@H](CC)[NH2+]C[C@@H]1CC[NH2+]C[C@@H]1F ZINC001246478215 987834907 /nfs/dbraw/zinc/83/49/07/987834907.db2.gz VBOSZPJYIGXFGT-XQQFMLRXSA-N 2 0 230.371 2.492 20 0 BEADRP C[C@@H]1CC[C@@H](N[C@H]2CCc3sccc32)C[NH2+]1 ZINC001246478159 987834919 /nfs/dbraw/zinc/83/49/19/987834919.db2.gz LRROKOXPBVEPJQ-FOGDFJRCSA-N 2 0 236.384 2.466 20 0 BEADRP CCC1CCC([NH2+]C[C@@H]2CC[NH2+]C[C@@H]2F)CC1 ZINC001246478118 987836013 /nfs/dbraw/zinc/83/60/13/987836013.db2.gz SPFIISVZWSIARH-YIOUJQMASA-N 2 0 242.382 2.492 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@H]2CCCC[C@H]2[NH3+])C1 ZINC001246478300 987838485 /nfs/dbraw/zinc/83/84/85/987838485.db2.gz NVQUPGQWFQHGHG-XQHKEYJVSA-N 2 0 210.365 2.425 20 0 BEADRP C[NH2+][C@H]1C[C@@H]([NH2+][C@@H]2CC[C@@H](C)[C@@H](C)C2)C1 ZINC001246496633 987849891 /nfs/dbraw/zinc/84/98/91/987849891.db2.gz PEMDERSRFFMBNC-MLGHIDQZSA-N 2 0 210.365 2.151 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCc3ccncc32)CC[NH2+]1 ZINC001246501645 987855972 /nfs/dbraw/zinc/85/59/72/987855972.db2.gz BCJUWANASIIMGJ-UXIGCNINSA-N 2 0 245.370 2.189 20 0 BEADRP C[C@@H]1C[C@@H]([NH+]2[C@H](C)CCC[C@H]2C)CC[NH2+]1 ZINC001246519381 987864555 /nfs/dbraw/zinc/86/45/55/987864555.db2.gz NBIOJMORQJJEIV-LPWJVIDDSA-N 2 0 210.365 2.390 20 0 BEADRP CCCCCC[C@@H](C)[N@@H+]1CCO[C@@H](CC[NH3+])C1 ZINC001246536658 987894578 /nfs/dbraw/zinc/89/45/78/987894578.db2.gz VULAOWJBJXVVDT-KGLIPLIRSA-N 2 0 242.407 2.395 20 0 BEADRP CSC(C)(C)C[C@H](C)[N@@H+]1C[C@H](C)[C@H](C[NH3+])C1 ZINC001246540747 987900869 /nfs/dbraw/zinc/90/08/69/987900869.db2.gz KATOVLKNHYSGIP-SDDRHHMPSA-N 2 0 244.448 2.433 20 0 BEADRP C[C@H]1C[N@@H+]([C@H]2CCCC(C)(C)C2)C[C@H]1C[NH3+] ZINC001246539306 987902819 /nfs/dbraw/zinc/90/28/19/987902819.db2.gz HMRHMIUOXIVJDM-XQQFMLRXSA-N 2 0 224.392 2.482 20 0 BEADRP CCCCC[C@@H](C)[N@@H+]1C[C@H](C)[C@H](C[NH3+])C1 ZINC001246542538 987909003 /nfs/dbraw/zinc/90/90/03/987909003.db2.gz QEWOGKAMTZZMLV-YNEHKIRRSA-N 2 0 212.381 2.482 20 0 BEADRP [NH3+][C@@H]1CCC[N@@H+]([C@H]2Cc3cccc(F)c3C2)CC1 ZINC001246542997 987913697 /nfs/dbraw/zinc/91/36/97/987913697.db2.gz QWZBYFANCUUZIX-OLZOCXBDSA-N 2 0 248.345 2.106 20 0 BEADRP C[C@H](Cc1ccncc1)[N@@H+]1CCC[C@](C)([NH3+])CC1 ZINC001246548385 987938459 /nfs/dbraw/zinc/93/84/59/987938459.db2.gz GKXQUCGGILPRRI-HIFRSBDPSA-N 2 0 247.386 2.216 20 0 BEADRP CC(C)OCC[C@H](C)[N@@H+]1CCC[C@@](C)([NH3+])CC1 ZINC001246552904 987950682 /nfs/dbraw/zinc/95/06/82/987950682.db2.gz QBZCPODKBJHSDY-UONOGXRCSA-N 2 0 242.407 2.393 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]Cc1cccc2cccnc21 ZINC001117953253 987966136 /nfs/dbraw/zinc/96/61/36/987966136.db2.gz CWVGHKBSCULFGL-LBPRGKRZSA-N 2 0 243.354 2.322 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]C/C=C\c1ccccc1OC ZINC001117953789 987967231 /nfs/dbraw/zinc/96/72/31/987967231.db2.gz PVEZAIXHRHYTJS-FWPCIQOSSA-N 2 0 248.370 2.296 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]Cc1ccc(C)c(OC)c1 ZINC001117953145 987967926 /nfs/dbraw/zinc/96/79/26/987967926.db2.gz BCISPYFSXXSSRY-GFCCVEGCSA-N 2 0 236.359 2.091 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2CCC(F)(F)[C@@H](C[NH3+])C2)C1 ZINC001246559836 987982273 /nfs/dbraw/zinc/98/22/73/987982273.db2.gz TZIRKJMWUMGSHA-VWYCJHECSA-N 2 0 232.318 2.091 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]Cc1ccc(C)c(C)c1 ZINC001118019654 987988564 /nfs/dbraw/zinc/98/85/64/987988564.db2.gz QRWQIHNFKKANLJ-CYBMUJFWSA-N 2 0 220.360 2.391 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2CC[C@@H](C)[C@H](C[NH3+])CC2)C1 ZINC001246561455 987997297 /nfs/dbraw/zinc/99/72/97/987997297.db2.gz SUMGDYFFCQGTCT-MQYQWHSLSA-N 2 0 224.392 2.482 20 0 BEADRP C[C@@H](CC1CC1)[N@@H+]1CC[C@@H](C)[C@H](C[NH3+])CC1 ZINC001246563696 988006082 /nfs/dbraw/zinc/00/60/82/988006082.db2.gz XNYZMGKPMNROIE-DYEKYZERSA-N 2 0 224.392 2.482 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@@H](C)c1sc(C)nc1C ZINC001118121824 988025422 /nfs/dbraw/zinc/02/54/22/988025422.db2.gz JDZXKYFAQAXLTM-IUCAKERBSA-N 2 0 241.404 2.409 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H]1CCc2ccc(F)cc21 ZINC001118122127 988026837 /nfs/dbraw/zinc/02/68/37/988026837.db2.gz PQAQXZFPLGTPAR-QMTHXVAHSA-N 2 0 236.334 2.401 20 0 BEADRP CC(C)=CCC[C@H](C)[N@@H+]1C[C@@H](C)[C@H]([NH3+])C1 ZINC001246570129 988054180 /nfs/dbraw/zinc/05/41/80/988054180.db2.gz ZOBKTRHWPMPPHV-FRRDWIJNSA-N 2 0 210.365 2.400 20 0 BEADRP C[NH2+]CC[C@H](C)[N@@H+]1CCC[C@H](C)[C@@H](C)C1 ZINC001246572965 988071964 /nfs/dbraw/zinc/07/19/64/988071964.db2.gz LNHDZFKQQNZENQ-AVGNSLFASA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H]1C[C@@H]([N@@H+]2CCC[C@@H](C)[C@H](C)C2)CC[NH2+]1 ZINC001246578155 988091799 /nfs/dbraw/zinc/09/17/99/988091799.db2.gz YJQMPHGCOLYBLB-SYQHCUMBSA-N 2 0 224.392 2.495 20 0 BEADRP CSCC[C@@H](C)[N@@H+]1CCCC[C@H](C[NH3+])C1 ZINC001246580938 988116419 /nfs/dbraw/zinc/11/64/19/988116419.db2.gz JCAFOVJBKGDBBC-VXGBXAGGSA-N 2 0 230.421 2.189 20 0 BEADRP C[C@H](Cc1ccccn1)[N@@H+]1CCCC[C@H](C[NH3+])C1 ZINC001246592533 988178242 /nfs/dbraw/zinc/17/82/42/988178242.db2.gz KBGCQTOZJRHHAP-ZIAGYGMSSA-N 2 0 247.386 2.073 20 0 BEADRP C[C@H]1C[C@@H]([N@@H+]2CCCC[C@](C)(C[NH3+])C2)CCO1 ZINC001246594248 988190850 /nfs/dbraw/zinc/19/08/50/988190850.db2.gz PIEDEAYFKWHYIY-MELADBBJSA-N 2 0 240.391 2.005 20 0 BEADRP CCCC[C@H](CC(C)C)[NH+]1CC(C[NH3+])C1 ZINC001246598234 988193831 /nfs/dbraw/zinc/19/38/31/988193831.db2.gz UXNUFMUTWFBFAY-CYBMUJFWSA-N 2 0 212.381 2.482 20 0 BEADRP CC[C@@H](Cc1ccccc1)[NH+]1CC(C)(C[NH3+])C1 ZINC001246597626 988200939 /nfs/dbraw/zinc/20/09/39/988200939.db2.gz MBOCECPFCHWFJA-AWEZNQCLSA-N 2 0 232.371 2.288 20 0 BEADRP CCCC[C@H](CCC)[NH+]1CC(C[NH2+]C)C1 ZINC001246601472 988208675 /nfs/dbraw/zinc/20/86/75/988208675.db2.gz UDYMHYYXSMPTQZ-ZDUSSCGKSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H]1CC[C@@H]([N@@H+]2CCC[C@]23CCC[NH2+]C3)C1 ZINC001246608774 988228762 /nfs/dbraw/zinc/22/87/62/988228762.db2.gz JQSFOCFCROBADP-MCIONIFRSA-N 2 0 222.376 2.393 20 0 BEADRP C[C@@H](CC1CC1)[N@@H+]1CCC[C@]12CCC[NH2+]C2 ZINC001246613396 988234711 /nfs/dbraw/zinc/23/47/11/988234711.db2.gz YWYDPKQYAJYZID-JSGCOSHPSA-N 2 0 222.376 2.393 20 0 BEADRP CC[C@@H]1CC[C@@H]([NH+]2CCC(F)(C[NH3+])CC2)C1 ZINC001246618230 988253847 /nfs/dbraw/zinc/25/38/47/988253847.db2.gz HUZARURPTMILCM-VXGBXAGGSA-N 2 0 228.355 2.328 20 0 BEADRP CC(C)CCC[C@@H](C)[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC001246628165 988300928 /nfs/dbraw/zinc/30/09/28/988300928.db2.gz XUWRHDFHZITTDJ-MCIONIFRSA-N 2 0 224.392 2.352 20 0 BEADRP CC1(C)CC[C@H]([NH+]2CCC(F)(C[NH3+])CC2)C1 ZINC001246632052 988312309 /nfs/dbraw/zinc/31/23/09/988312309.db2.gz YXCLHIUTBZBKGR-NSHDSACASA-N 2 0 228.355 2.328 20 0 BEADRP CC(C)CCC[C@@H](C)[N@@H+]1CCC2(C[NH2+]C2)C1 ZINC001246632606 988316855 /nfs/dbraw/zinc/31/68/55/988316855.db2.gz YKBJKALQFLZVEP-CYBMUJFWSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1CC([N@@H+]2CC[C@@H]3CC[NH2+][C@@H]3C2)C[C@H](C)C1 ZINC001246633915 988320188 /nfs/dbraw/zinc/32/01/88/988320188.db2.gz FMERGSXVHUKCSD-GUIRCDHDSA-N 2 0 236.403 2.495 20 0 BEADRP CC(C)CCC[C@H](C)[N@@H+]1CCC2(C[NH2+]C2)C1 ZINC001246632607 988321513 /nfs/dbraw/zinc/32/15/13/988321513.db2.gz YKBJKALQFLZVEP-ZDUSSCGKSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H](CC(C)C)[N@@H+]1CC[C@H]2[NH2+]CC[C@H]21 ZINC001246635134 988324161 /nfs/dbraw/zinc/32/41/61/988324161.db2.gz BSZFQDLWTPNLJJ-YNEHKIRRSA-N 2 0 210.365 2.247 20 0 BEADRP C[C@@H]1C[C@H]([N@H+]2C[C@@H]3CC(F)(F)C[C@@H]3C2)CC[NH2+]1 ZINC001246636634 988328792 /nfs/dbraw/zinc/32/87/92/988328792.db2.gz DFAIOMYZQYYYNN-WISYIIOYSA-N 2 0 244.329 2.104 20 0 BEADRP C[C@H]1C[C@H]([N@H+]2C[C@@H]3CC(F)(F)C[C@@H]3C2)CC[NH2+]1 ZINC001246636633 988331343 /nfs/dbraw/zinc/33/13/43/988331343.db2.gz DFAIOMYZQYYYNN-NNYUYHANSA-N 2 0 244.329 2.104 20 0 BEADRP C1C[C@@H]2[C@H](CC[N@@H+]2C2CCCCCC2)[NH2+]1 ZINC001246637518 988333758 /nfs/dbraw/zinc/33/37/58/988333758.db2.gz ZIWUCUXKKPQASX-QWHCGFSZSA-N 2 0 208.349 2.145 20 0 BEADRP C[C@H]1CC[C@H]([N@H+]2C[C@@H]3CC(F)(F)C[C@@H]3C2)C[NH2+]1 ZINC001246640481 988334505 /nfs/dbraw/zinc/33/45/05/988334505.db2.gz UONSFSKAHKTOKM-YFKTTZPYSA-N 2 0 244.329 2.104 20 0 BEADRP CC[C@@H]1CC[C@@H]([N@@H+]2CC[C@H]3[NH2+]CC[C@H]32)C1 ZINC001246640307 988335999 /nfs/dbraw/zinc/33/59/99/988335999.db2.gz SBRGLLAOYXLWIT-FDYHWXHSSA-N 2 0 208.349 2.001 20 0 BEADRP C1[C@@H]2C[C@H]([N@@H+]3CCCC[C@@]34CC[NH2+]C4)C[C@H]12 ZINC001246645852 988364052 /nfs/dbraw/zinc/36/40/52/988364052.db2.gz WSKZRICTSLUXDG-DGAVXFQQSA-N 2 0 220.360 2.003 20 0 BEADRP C[C@H]1CC[C@@H]([N@H+]2C[C@H]3[C@H](CCC3(F)F)C2)C[NH2+]1 ZINC001246654517 988379691 /nfs/dbraw/zinc/37/96/91/988379691.db2.gz ICSDDTWLEVWPPT-QCNOEVLYSA-N 2 0 244.329 2.104 20 0 BEADRP CC[C@H](C)C[C@H](CC)[N@@H+]1C[C@@H]2CC[NH2+][C@@H]2C1 ZINC001246653441 988380119 /nfs/dbraw/zinc/38/01/19/988380119.db2.gz SZABWMCKKATUHC-XDQVBPFNSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1C[C@@H]([N@H+]2C[C@@H]3[C@@H]([NH3+])[C@@H]3C2)CC(C)(C)C1 ZINC001246655317 988383285 /nfs/dbraw/zinc/38/32/85/988383285.db2.gz HENGGZJFUBQPRD-KVSVUVNWSA-N 2 0 222.376 2.090 20 0 BEADRP C[C@H]1C[C@@H]([N@H+]2C[C@@H]3[C@@H]([NH3+])[C@@H]3C2)CC(C)(C)C1 ZINC001246655319 988383499 /nfs/dbraw/zinc/38/34/99/988383499.db2.gz HENGGZJFUBQPRD-OBPIAQAESA-N 2 0 222.376 2.090 20 0 BEADRP CCCC[C@@H](C)[N@@H+]1C[C@H]2CCC[C@@]2([NH3+])C1 ZINC001246658850 988385165 /nfs/dbraw/zinc/38/51/65/988385165.db2.gz AYDZLGPCTXSDMD-JHJVBQTASA-N 2 0 210.365 2.378 20 0 BEADRP C[C@@H]1C[C@@H]([N@H+]2C[C@@H]3[C@H]([NH3+])[C@@H]3C2)CC(C)(C)C1 ZINC001246659784 988392729 /nfs/dbraw/zinc/39/27/29/988392729.db2.gz HENGGZJFUBQPRD-NJMOYASZSA-N 2 0 222.376 2.090 20 0 BEADRP CC[C@@H]1CC[C@@H]([N@@H+]2C[C@H]3CCC[NH2+][C@H]3C2)C1 ZINC001246662296 988399391 /nfs/dbraw/zinc/39/93/91/988399391.db2.gz ZJCUOSUOCJVSCZ-SYQHCUMBSA-N 2 0 222.376 2.249 20 0 BEADRP CCCC1CCC([N@H+]2C[C@@H]3[C@H]([NH3+])[C@@H]3C2)CC1 ZINC001246664507 988405462 /nfs/dbraw/zinc/40/54/62/988405462.db2.gz RBIBDJYQZYOJOD-MOIJGLSHSA-N 2 0 222.376 2.234 20 0 BEADRP C[C@@H]1C[C@@H]([N@@H+]2CC[C@H](c3ccncc3)C2)CC[NH2+]1 ZINC001246774102 988452729 /nfs/dbraw/zinc/45/27/29/988452729.db2.gz COTYVIFTYIEHGP-SNPRPXQTSA-N 2 0 245.370 2.011 20 0 BEADRP CCCC[N@H+](CCC)[C@H](C)CC[NH2+]C ZINC001246773953 988452857 /nfs/dbraw/zinc/45/28/57/988452857.db2.gz DLJNWFRNIVMSQM-GFCCVEGCSA-N 2 0 200.370 2.497 20 0 BEADRP Fc1ccccc1[C@@H]1CC[N@@H+](C2CC[NH2+]CC2)C1 ZINC001246808123 988488226 /nfs/dbraw/zinc/48/82/26/988488226.db2.gz RIGHAWPWIUIWPQ-GFCCVEGCSA-N 2 0 248.345 2.367 20 0 BEADRP c1ccc([C@@H]2CCC[N@H+](C3CC[NH2+]CC3)C2)nc1 ZINC001246808157 988489490 /nfs/dbraw/zinc/48/94/90/988489490.db2.gz RNBGSGRDZUOBHR-CYBMUJFWSA-N 2 0 245.370 2.013 20 0 BEADRP COC(C)(C)[C@@H]1CCC[N@@H+]1[C@H]1CC[C@@H](C)[NH2+]C1 ZINC001246810617 988490908 /nfs/dbraw/zinc/49/09/08/988490908.db2.gz PKQAUCABJYPPAP-AGIUHOORSA-N 2 0 240.391 2.016 20 0 BEADRP COC(C)(C)[C@@H]1CCC[N@@H+]1[C@H]1CC[NH2+][C@@H](C)C1 ZINC001246811811 988497515 /nfs/dbraw/zinc/49/75/15/988497515.db2.gz XMXHUXTUYZPDAC-AVGNSLFASA-N 2 0 240.391 2.016 20 0 BEADRP CCCCC[C@H](CCC)[N@@H+]1CCO[C@@H](C[NH3+])C1 ZINC001246823404 988508988 /nfs/dbraw/zinc/50/89/88/988508988.db2.gz GFSMVEDUALUGSB-KBPBESRZSA-N 2 0 242.407 2.395 20 0 BEADRP C[C@@H]1C[C@@H](N2Cc3cccc(F)c3C2)CC[NH2+]1 ZINC001246822653 988510530 /nfs/dbraw/zinc/51/05/30/988510530.db2.gz MHQYRXXJVDGHES-PWSUYJOCSA-N 2 0 234.318 2.282 20 0 BEADRP CCC(CC)[N@H+](CC)[C@@H](C)CC[NH2+]C ZINC001246838699 988521739 /nfs/dbraw/zinc/52/17/39/988521739.db2.gz DWTLEVBHJHPXBG-NSHDSACASA-N 2 0 200.370 2.495 20 0 BEADRP C[C@@H]1CC([N@H+]2C[C@H]3CC[C@@H](C2)[C@@H]3[NH3+])C[C@@H](C)C1 ZINC001246839064 988542809 /nfs/dbraw/zinc/54/28/09/988542809.db2.gz APYZHVUHTQJOEZ-BAYHKCFCSA-N 2 0 236.403 2.480 20 0 BEADRP CC[C@H](CC(C)C)[N@H+]1C[C@H]2CC[C@@H](C1)[C@@H]2[NH3+] ZINC001246840162 988544664 /nfs/dbraw/zinc/54/46/64/988544664.db2.gz FKNVMMLJTKGVPX-XJFOESAGSA-N 2 0 224.392 2.480 20 0 BEADRP CC1(C)CCC[C@H]([N@@H+]2C[C@@H]3CC[C@]3([NH3+])C2)C1 ZINC001246857031 988581655 /nfs/dbraw/zinc/58/16/55/988581655.db2.gz ZBAXGEYHZXYKBB-OBJOEFQTSA-N 2 0 222.376 2.378 20 0 BEADRP Cc1ccc(C[C@H](C)[N@@H+]2C[C@@H]3CC[C@]3([NH3+])C2)cc1 ZINC001246858703 988585873 /nfs/dbraw/zinc/58/58/73/988585873.db2.gz HYAVMZRXHBILKG-BPUTZDHNSA-N 2 0 244.382 2.349 20 0 BEADRP CC[C@@H](CC(C)C)[N@@H+]1C[C@H]2CC[C@@H](C1)[NH2+]C2 ZINC001246867516 988620857 /nfs/dbraw/zinc/62/08/57/988620857.db2.gz OMZYGJCPVPXRMU-IHRRRGAJSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H]1CCC[C@@H]([N@@H+]2C[C@H]3CC[C@@H](C2)[NH2+]C3)C1 ZINC001246867592 988623188 /nfs/dbraw/zinc/62/31/88/988623188.db2.gz PMPOMMLRPUTAOX-XDQVBPFNSA-N 2 0 222.376 2.249 20 0 BEADRP C[NH2+]CC[C@H](C)[N@@H+]1Cc2ccccc2C[C@@H]1C ZINC001246874053 988633559 /nfs/dbraw/zinc/63/35/59/988633559.db2.gz UVBNDJVPWHJJTD-STQMWFEESA-N 2 0 232.371 2.431 20 0 BEADRP C[C@H]1C[C@H]([NH+]2C[C@@H]3CCCC[C@H]3C2)CC[NH2+]1 ZINC001246894387 988663661 /nfs/dbraw/zinc/66/36/61/988663661.db2.gz NMNXCDDLJRNACS-XDQVBPFNSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@H]1C[C@@H]([NH+]2C[C@@H]3CCCC[C@H]3C2)CC[NH2+]1 ZINC001246894388 988666297 /nfs/dbraw/zinc/66/62/97/988666297.db2.gz NMNXCDDLJRNACS-XUXIUFHCSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@@H]1C[N@H+]([C@@H]2CC[NH2+][C@H](C)C2)C2(CC2)C1 ZINC001246895952 988669736 /nfs/dbraw/zinc/66/97/36/988669736.db2.gz RKWFQJWLQWPNCK-QJPTWQEYSA-N 2 0 208.349 2.001 20 0 BEADRP C[C@@H]1C[N@H+]([C@@H]2CC[NH2+][C@@H](C)C2)C2(CC2)C1 ZINC001246895954 988671817 /nfs/dbraw/zinc/67/18/17/988671817.db2.gz RKWFQJWLQWPNCK-SDDRHHMPSA-N 2 0 208.349 2.001 20 0 BEADRP C1CC[C@H]2[C@H](C1)CCC[N@@H+]2[C@H]1CCC[NH2+]C1 ZINC001246918889 988732063 /nfs/dbraw/zinc/73/20/63/988732063.db2.gz HBTGAYJPEGRVRI-RDBSUJKOSA-N 2 0 222.376 2.393 20 0 BEADRP C[C@H]1CCC[C@H]([N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)C1 ZINC001246928733 988753176 /nfs/dbraw/zinc/75/31/76/988753176.db2.gz BTMCBCPGVNNINB-XQLPTFJDSA-N 2 0 236.403 2.497 20 0 BEADRP CC[C@@H]1CC[C@H]([N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)C1 ZINC001246941956 988776126 /nfs/dbraw/zinc/77/61/26/988776126.db2.gz MVMVGWALVRBVLB-KBXIAJHMSA-N 2 0 236.403 2.497 20 0 BEADRP CCCC[C@H](CCC)[N@H+](C)[C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001246946815 988781648 /nfs/dbraw/zinc/78/16/48/988781648.db2.gz HVFDKURMROLXKI-IGQOVBAYSA-N 2 0 224.392 2.495 20 0 BEADRP CCCCCC[C@H](C)[N@H+](C)[C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001246951296 988784312 /nfs/dbraw/zinc/78/43/12/988784312.db2.gz ZWDXXSDBXKYWKQ-IGQOVBAYSA-N 2 0 224.392 2.495 20 0 BEADRP CCCC[C@H](CC(C)C)[N@H+]1C[C@@H](OC)[C@@H](N)C1 ZINC001246983846 988815138 /nfs/dbraw/zinc/81/51/38/988815138.db2.gz UONKNRCQWIKVQA-HZSPNIEDSA-N 2 0 242.407 2.249 20 0 BEADRP COc1cccc2c1CC[C@@H]2[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC001119091009 988834233 /nfs/dbraw/zinc/83/42/33/988834233.db2.gz UCAFWGMEKWCMCT-MJVIPROJSA-N 2 0 246.354 2.009 20 0 BEADRP Cc1cccnc1C[NH2+]CC[C@@H]1CCC[N@@H+](C)C1 ZINC001324757229 988973455 /nfs/dbraw/zinc/97/34/55/988973455.db2.gz JEWXVMJXCSMZBU-AWEZNQCLSA-N 2 0 247.386 2.212 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC001325268715 989139339 /nfs/dbraw/zinc/13/93/39/989139339.db2.gz UBUNCCUYEQBXST-SNPRPXQTSA-N 2 0 232.371 2.378 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]Cc1cc(C)cc(C)c1 ZINC001325319023 989155899 /nfs/dbraw/zinc/15/58/99/989155899.db2.gz IXOKTXSGVFTHRX-ZDUSSCGKSA-N 2 0 220.360 2.391 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H]1CC[C@@H](C)[C@@H](C)C1 ZINC001325715352 989239550 /nfs/dbraw/zinc/23/95/50/989239550.db2.gz BOIBJIFEGRZBRM-YVECIDJPSA-N 2 0 212.381 2.399 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@@H]1CCc2ccc(OC)cc21 ZINC001325745319 989249907 /nfs/dbraw/zinc/24/99/07/989249907.db2.gz XBGAVPZIJIGMTC-XHDPSFHLSA-N 2 0 248.370 2.270 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@@H](C1CC1)C1CCC1 ZINC001325755721 989251534 /nfs/dbraw/zinc/25/15/34/989251534.db2.gz GONUSIWMBVRYEF-GXFFZTMASA-N 2 0 210.365 2.153 20 0 BEADRP Cc1ccc([C@H](C)[NH2+]CCCC[NH3+])c(C)n1 ZINC001325756490 989252406 /nfs/dbraw/zinc/25/24/06/989252406.db2.gz VMGXLLURLRPBJS-NSHDSACASA-N 2 0 221.348 2.088 20 0 BEADRP Cc1ccc2c(c1)CC[C@H]2[NH2+]CCCC[NH3+] ZINC001325755660 989252693 /nfs/dbraw/zinc/25/26/93/989252693.db2.gz FATSJCWTVMCIHH-CQSZACIVSA-N 2 0 218.344 2.311 20 0 BEADRP CC[N@@H+]1CCC[C@H](C[NH2+][C@H](C)C2(Cl)CC2)C1 ZINC001119623189 989252759 /nfs/dbraw/zinc/25/27/59/989252759.db2.gz FWZKVHVFIQLMFM-VXGBXAGGSA-N 2 0 244.810 2.468 20 0 BEADRP [NH3+]CCCC[NH2+][C@@H]1CCCc2ccccc2C1 ZINC001325755868 989253026 /nfs/dbraw/zinc/25/30/26/989253026.db2.gz JVVZHROZSYQZCM-OAHLLOKOSA-N 2 0 232.371 2.263 20 0 BEADRP CCOc1cccc([C@@H](C)[NH2+]CCCC[NH3+])c1 ZINC001325755936 989253819 /nfs/dbraw/zinc/25/38/19/989253819.db2.gz LUSOWBARBMYRQO-GFCCVEGCSA-N 2 0 236.359 2.475 20 0 BEADRP Cc1cc(N[C@@H]2CCCC[C@H]2[NH+](C)C)cc[nH+]1 ZINC001325777746 989259208 /nfs/dbraw/zinc/25/92/08/989259208.db2.gz YFNLOZXHQSTKOU-ZIAGYGMSSA-N 2 0 233.359 2.097 20 0 BEADRP C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C[NH2+]C1CCC(C[NH3+])CC1 ZINC001119630482 989265789 /nfs/dbraw/zinc/26/57/89/989265789.db2.gz FSAXXVWDDWFHGA-SFKRNEKASA-N 2 0 236.403 2.386 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]C/C=C\C1CC1 ZINC001326036392 989336732 /nfs/dbraw/zinc/33/67/32/989336732.db2.gz QKTGMJYVULWBSQ-DLRQAJBASA-N 2 0 245.370 2.466 20 0 BEADRP COc1cc(C[NH2+][C@@H](C)C[C@@H](C)[NH3+])ccc1F ZINC001326200790 989421634 /nfs/dbraw/zinc/42/16/34/989421634.db2.gz CZQKECVNQQMZOZ-ZJUUUORDSA-N 2 0 240.322 2.050 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H]1CC[C@@H]1C(C)(C)C ZINC001326474133 989568371 /nfs/dbraw/zinc/56/83/71/989568371.db2.gz SNLBDURIBAEZCH-GRYCIOLGSA-N 2 0 212.381 2.399 20 0 BEADRP Cc1ccccc1NC(=[NH2+])NC[C@H](C)C[NH+](C)C ZINC001326949521 989788343 /nfs/dbraw/zinc/78/83/43/989788343.db2.gz SNBLEHHKPVIHQN-NSHDSACASA-N 2 0 248.374 2.129 20 0 BEADRP C[C@H]1C[C@H](NC(=[NH2+])SCC[NH3+])C[C@@H](C)C1 ZINC001258151770 991032494 /nfs/dbraw/zinc/03/24/94/991032494.db2.gz NLCDALBIMQFMIJ-MYJAWHEDSA-N 2 0 229.393 2.027 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@@H]([NH2+]Cc3cccc(F)c3)[C@@H]2C1 ZINC001308554301 991034809 /nfs/dbraw/zinc/03/48/09/991034809.db2.gz NVQJHFJYTGZLGU-NWANDNLSSA-N 2 0 248.345 2.256 20 0 BEADRP C[C@@H]1CC([NH2+][C@@H]2CCC[C@@H]2[NH3+])C[C@@H](C)C1 ZINC001258164806 991057314 /nfs/dbraw/zinc/05/73/14/991057314.db2.gz WZTVUUQWRMTLPN-XRRVDJEJSA-N 2 0 210.365 2.281 20 0 BEADRP CSCC[C@@H](C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001258202720 991118406 /nfs/dbraw/zinc/11/84/06/991118406.db2.gz SLYIQRRSMKKALE-FVCCEPFGSA-N 2 0 242.432 2.343 20 0 BEADRP CSCC[C@@H](C)[NH+]1CC2(C1)CC[NH+](C)CC2 ZINC001258226898 991159985 /nfs/dbraw/zinc/15/99/85/991159985.db2.gz SGUCYYRNLRXVSU-GFCCVEGCSA-N 2 0 242.432 2.156 20 0 BEADRP CC[N@H+]1C[C@@H]2C[NH+]([C@H](C)CCSC)C[C@@H]2C1 ZINC001258227858 991164181 /nfs/dbraw/zinc/16/41/81/991164181.db2.gz HJKDKHDJTTUUIG-UPJWGTAASA-N 2 0 242.432 2.012 20 0 BEADRP CC[NH+]1C[C@@H]2C[NH+]([C@H](C)CCSC)C[C@H]2C1 ZINC001258227856 991166885 /nfs/dbraw/zinc/16/68/85/991166885.db2.gz HJKDKHDJTTUUIG-JHJVBQTASA-N 2 0 242.432 2.012 20 0 BEADRP C[C@H](CC1CC1)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001258449124 991396427 /nfs/dbraw/zinc/39/64/27/991396427.db2.gz VFAFQMCGAVQHBJ-RUZUBIRVSA-N 2 0 222.376 2.390 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]CC12CC[NH+](CC1)CC2 ZINC001258450282 991401104 /nfs/dbraw/zinc/40/11/04/991401104.db2.gz BPKYEFODXYHTDW-LBPRGKRZSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@@H](CC1CC1)[N@@H+]1C[C@H]2C[C@@]2(C[NH+](C)C)C1 ZINC001258474600 991447232 /nfs/dbraw/zinc/44/72/32/991447232.db2.gz VBRJFJTZLWGLMH-IACUBPJLSA-N 2 0 222.376 2.059 20 0 BEADRP C1[C@H]2CCC[C@H]([NH2+][C@H]3CC[N@@H+]4CCC[C@@H]4C3)[C@@H]12 ZINC001560500814 991487895 /nfs/dbraw/zinc/48/78/95/991487895.db2.gz DNFJOCUWIWKGKC-SEBNEYGDSA-N 2 0 234.387 2.391 20 0 BEADRP CCC[C@H](Cc1ccccc1)[NH2+]C1CC([NH3+])C1 ZINC001258650724 991586982 /nfs/dbraw/zinc/58/69/82/991586982.db2.gz BUSYIXUUDLWSQH-SHARSMKWSA-N 2 0 232.371 2.477 20 0 BEADRP C[C@H](CC1CCC1)[NH2+][C@@H]1CC[C@H]2C[N@H+](C)C[C@H]21 ZINC001561052479 991706290 /nfs/dbraw/zinc/70/62/90/991706290.db2.gz BZENTAHWHLDEKX-FAAHXZRKSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@H](CC1CCC1)[NH2+][C@@H]1CC[C@@H]2C[N@H+](C)C[C@@H]12 ZINC001561052480 991707794 /nfs/dbraw/zinc/70/77/94/991707794.db2.gz BZENTAHWHLDEKX-NMFUWQPSSA-N 2 0 236.403 2.495 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[C@@H]2C[N@H+](C)C[C@@H]12)C1CCC1 ZINC001561053639 991709280 /nfs/dbraw/zinc/70/92/80/991709280.db2.gz XZYWYUREPOJRHZ-APIJFGDWSA-N 2 0 236.403 2.495 20 0 BEADRP CCC[NH+]1CCC([NH2+]C[C@H]2C[C@H](F)C2)CC1 ZINC001258766567 991726425 /nfs/dbraw/zinc/72/64/25/991726425.db2.gz ZBJAZWDHDYEKBW-HAQNSBGRSA-N 2 0 228.355 2.199 20 0 BEADRP CC[C@H](C[C@@H](C)CC)[NH2+]CCSCC[NH3+] ZINC001258783086 991753452 /nfs/dbraw/zinc/75/34/52/991753452.db2.gz AYIRLYOKZWHXIA-NWDGAFQWSA-N 2 0 232.437 2.483 20 0 BEADRP CC[C@H](C)C[C@H](CC)[NH2+]CCSCC[NH3+] ZINC001258783087 991754627 /nfs/dbraw/zinc/75/46/27/991754627.db2.gz AYIRLYOKZWHXIA-RYUDHWBXSA-N 2 0 232.437 2.483 20 0 BEADRP CC[NH+]1C[C@@H]2C[NH+]([C@@H]3CCC[C@H](C)C3)C[C@H]2C1 ZINC001258830993 991863485 /nfs/dbraw/zinc/86/34/85/991863485.db2.gz XGLJTDHKOBUZRD-GBJTYRQASA-N 2 0 236.403 2.449 20 0 BEADRP CC[N@H+]1C[C@@H]2C[NH+]([C@@H]3CCC[C@@H](C)C3)C[C@@H]2C1 ZINC001258830991 991863795 /nfs/dbraw/zinc/86/37/95/991863795.db2.gz XGLJTDHKOBUZRD-APIJFGDWSA-N 2 0 236.403 2.449 20 0 BEADRP CS[C@@H]1CC[C@H]([N@H+](C)CCn2ccnc2)C1 ZINC001319441768 991870848 /nfs/dbraw/zinc/87/08/48/991870848.db2.gz CSCLBPBDZVKHHN-NWDGAFQWSA-N 2 0 239.388 2.099 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H]1C[C@@H]1C ZINC001258898441 991888921 /nfs/dbraw/zinc/88/89/21/991888921.db2.gz XLLBLCWRAPAHDJ-AVGNSLFASA-N 2 0 212.381 2.495 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+]CC1CSC1 ZINC001258899899 991890927 /nfs/dbraw/zinc/89/09/27/991890927.db2.gz VYAAPSLDUIENKD-LBPRGKRZSA-N 2 0 244.448 2.450 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[N@H+](CCN)C(C)C ZINC001258898291 991891707 /nfs/dbraw/zinc/89/17/07/991891707.db2.gz HQUKKCHAPGYPCQ-CQSZACIVSA-N 2 0 243.439 2.166 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)n1ccc(C[NH3+])n1 ZINC001258898698 991896310 /nfs/dbraw/zinc/89/63/10/991896310.db2.gz PGLAQYUHGPILRO-GFCCVEGCSA-N 2 0 238.379 2.025 20 0 BEADRP c1cc(C[NH2+][C@H]2CCC[NH2+]CC2)cc2c1CCC2 ZINC001261370381 992277592 /nfs/dbraw/zinc/27/75/92/992277592.db2.gz HWLVTFZRGRNPBR-INIZCTEOSA-N 2 0 244.382 2.407 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]C[C@@H](C)C(C)(C)C ZINC001261370459 992278532 /nfs/dbraw/zinc/27/85/32/992278532.db2.gz KEMMTLITTBCYPH-MNOVXSKESA-N 2 0 200.370 2.256 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]C[C@H](C)C(C)(C)C ZINC001261370461 992278966 /nfs/dbraw/zinc/27/89/66/992278966.db2.gz KEMMTLITTBCYPH-WDEREUQCSA-N 2 0 200.370 2.256 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]C1CCC(C(F)F)CC1 ZINC001261423933 992295522 /nfs/dbraw/zinc/29/55/22/992295522.db2.gz JAKYCEOLHQMFTF-WHXUTIOJSA-N 2 0 234.334 2.398 20 0 BEADRP C[C@H]([NH3+])CN[C@@H](C)c1ccc(C(F)(F)F)nc1 ZINC001261891040 992564161 /nfs/dbraw/zinc/56/41/61/992564161.db2.gz WVHOLXPXNWASGR-YUMQZZPRSA-N 2 0 247.264 2.098 20 0 BEADRP CC(C)(C)OC1CCC([NH2+][C@H]2CC[NH2+]C2)CC1 ZINC001573469476 992614935 /nfs/dbraw/zinc/61/49/35/992614935.db2.gz PWRKWVOBFKUARZ-CPCZMJQVSA-N 2 0 240.391 2.064 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+]C[C@@H]1CCc2ccccc21 ZINC001262202568 992799097 /nfs/dbraw/zinc/79/90/97/992799097.db2.gz XACZCVSTOJTYLF-DZGCQCFKSA-N 2 0 244.382 2.447 20 0 BEADRP C(C[C@@H]1CC[NH2+]C1)[NH2+][C@H]1C[C@@H]2CC[C@@H](C2)C1 ZINC001574774291 992900267 /nfs/dbraw/zinc/90/02/67/992900267.db2.gz KUFUGIUCDKMFFD-IGQOVBAYSA-N 2 0 222.376 2.154 20 0 BEADRP C([NH2+][C@H]1C[C@@H]2CCC[C@@H]21)[C@@H]1CCCCC[NH2+]1 ZINC001574801586 992915297 /nfs/dbraw/zinc/91/52/97/992915297.db2.gz RWULSPXAYGAETO-XUXIUFHCSA-N 2 0 222.376 2.297 20 0 BEADRP C=C/C=C\CC[NH2+]CC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC001574889631 992938255 /nfs/dbraw/zinc/93/82/55/992938255.db2.gz TZYSSDCTUATHEU-BEJLUXAGSA-N 2 0 220.360 2.239 20 0 BEADRP CC(C)(C[NH3+])C[NH+]1CC(Cc2ccccc2)C1 ZINC001575315136 993009951 /nfs/dbraw/zinc/00/99/51/993009951.db2.gz JFNLQYRVADIURI-UHFFFAOYSA-N 2 0 232.371 2.146 20 0 BEADRP C[NH+](C)[C@@H]1CC[C@@H]2CN(c3cc[nH+]cc3)C[C@@H]2C1 ZINC001262674992 993017323 /nfs/dbraw/zinc/01/73/23/993017323.db2.gz SHZJZUIDRQFBRZ-VNHYZAJKSA-N 2 0 245.370 2.248 20 0 BEADRP CC(C)([NH3+])CC[NH2+]Cc1cccc2cc[nH]c21 ZINC001575354212 993019161 /nfs/dbraw/zinc/01/91/61/993019161.db2.gz IJLAGICHEKEQRE-UHFFFAOYSA-N 2 0 231.343 2.385 20 0 BEADRP C[NH+](C)[C@@H]1CC[C@H]2CN(c3cc[nH+]cc3)C[C@H]2C1 ZINC001262674989 993019184 /nfs/dbraw/zinc/01/91/84/993019184.db2.gz SHZJZUIDRQFBRZ-GZBFAFLISA-N 2 0 245.370 2.248 20 0 BEADRP CC(C)([NH3+])C[NH2+]C[C@H]1C[C@@H]1C1CCCC1 ZINC001575358364 993025885 /nfs/dbraw/zinc/02/58/85/993025885.db2.gz PDKDTVKGCQWOHS-VXGBXAGGSA-N 2 0 210.365 2.140 20 0 BEADRP CC(C)[C@H](C[NH3+])C[NH2+]C[C@@H]1C(C)(C)C1(F)F ZINC001575422905 993042672 /nfs/dbraw/zinc/04/26/72/993042672.db2.gz OFXSFZYJSWVVCJ-NXEZZACHSA-N 2 0 234.334 2.098 20 0 BEADRP CC(C)[C@H]([NH3+])CNCc1ccc2scnc2c1 ZINC001575460595 993045422 /nfs/dbraw/zinc/04/54/22/993045422.db2.gz MISMCJSKGXHNBT-LLVKDONJSA-N 2 0 249.383 2.369 20 0 BEADRP CC(C)[C@@H]1CCCCC[N@@H+]1C[C@]12C[C@H]1C[NH2+]C2 ZINC001575499628 993059247 /nfs/dbraw/zinc/05/92/47/993059247.db2.gz FLNIKPYYVQADEF-SOUVJXGZSA-N 2 0 236.403 2.497 20 0 BEADRP CC(C)[C@@H]1[N@H+](C[C@H]2C[C@@H]([NH3+])C2)CC12CCC2 ZINC001575519482 993063989 /nfs/dbraw/zinc/06/39/89/993063989.db2.gz CNTRXNRBJQXGTQ-XQQFMLRXSA-N 2 0 222.376 2.234 20 0 BEADRP CC(C)[C@@H]1[NH2+]CC12CC[NH+](CCCCF)CC2 ZINC001575525492 993064485 /nfs/dbraw/zinc/06/44/85/993064485.db2.gz ZWYNYQWJDAIDIP-ZDUSSCGKSA-N 2 0 242.382 2.446 20 0 BEADRP C[C@H](CCc1ccc(O)cc1)[NH2+]CC1([NH3+])CCC1 ZINC001575965863 993142784 /nfs/dbraw/zinc/14/27/84/993142784.db2.gz IFLGNALKKXSDJC-GFCCVEGCSA-N 2 0 248.370 2.184 20 0 BEADRP C[C@@H](c1ccccc1)[N@@H+]1C[C@H]2C[NH2+]C[C@@]2(C)C1 ZINC001576312112 993258858 /nfs/dbraw/zinc/25/88/58/993258858.db2.gz VKPANEBDKAUNQE-CFVMTHIKSA-N 2 0 230.355 2.289 20 0 BEADRP C[C@H](CC1CC1)[N@@H+]1CCCC[C@H](C[NH3+])C1 ZINC000379855305 993286916 /nfs/dbraw/zinc/28/69/16/993286916.db2.gz BSZWEZJIMBIUCZ-DGCLKSJQSA-N 2 0 210.365 2.236 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]C1CC(C)C1 ZINC000380184470 993318837 /nfs/dbraw/zinc/31/88/37/993318837.db2.gz MRUQDWFFGCWINF-OTTFEQOBSA-N 2 0 212.381 2.495 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]C1CC(C)C1 ZINC000380184462 993320847 /nfs/dbraw/zinc/32/08/47/993320847.db2.gz MRUQDWFFGCWINF-CPCZMJQVSA-N 2 0 212.381 2.495 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+]CC1CC2(CCC2)C1 ZINC001576487276 993320490 /nfs/dbraw/zinc/32/04/90/993320490.db2.gz HTBPXIFBFWRIQG-LBPRGKRZSA-N 2 0 222.376 2.297 20 0 BEADRP CC1(C[N@@H+]2C[C@@H]3CCC[C@]3([NH3+])C2)CCCC1 ZINC001576503432 993325767 /nfs/dbraw/zinc/32/57/67/993325767.db2.gz STVWDSLMQGWRNU-JSGCOSHPSA-N 2 0 222.376 2.380 20 0 BEADRP C[C@]1(C[NH2+]C2CC3(CC([NH3+])C3)C2)CCCS1 ZINC001576519247 993329576 /nfs/dbraw/zinc/32/95/76/993329576.db2.gz LGVFFCJFJVAWQR-AYNROABZSA-N 2 0 240.416 2.132 20 0 BEADRP C[C@@H]1CC(C)(C)CC[C@@H]1[NH2+][C@H]1C[C@@H]([NH3+])C1 ZINC001576588578 993359002 /nfs/dbraw/zinc/35/90/02/993359002.db2.gz BUKAKPVVHFVGJM-WYUUTHIRSA-N 2 0 210.365 2.281 20 0 BEADRP CC1CC(C[NH2+]C[C@]2(C)CCC[NH2+]C2)C1 ZINC001576597130 993361326 /nfs/dbraw/zinc/36/13/26/993361326.db2.gz CIMZWCFGEZCVGA-WXRRBKDZSA-N 2 0 210.365 2.012 20 0 BEADRP C[C@@H]1CC(CC[NH2+]CC(C)(C)C[NH3+])C[C@@H](C)O1 ZINC001576599862 993364727 /nfs/dbraw/zinc/36/47/27/993364727.db2.gz VYKOLVVETDXNML-VXGBXAGGSA-N 2 0 242.407 2.155 20 0 BEADRP C[C@H]1C[N@H+](CC2(C[NH3+])CCC2)CCC1(F)F ZINC001576800767 993428094 /nfs/dbraw/zinc/42/80/94/993428094.db2.gz LPOJBFILYNGHHQ-JTQLQIEISA-N 2 0 232.318 2.093 20 0 BEADRP C[C@@H]1C[N@H+](CCSC(C)(C)C)CC[C@H]1C[NH3+] ZINC001576807267 993430210 /nfs/dbraw/zinc/43/02/10/993430210.db2.gz OZUNNOSCAGXQDD-NEPJUHHUSA-N 2 0 244.448 2.435 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C/C=C/C2CC2)CC[N@@H+]1C ZINC000382312865 993448679 /nfs/dbraw/zinc/44/86/79/993448679.db2.gz QPCUKPDTDLLCIG-WTQORWENSA-N 2 0 208.349 2.025 20 0 BEADRP CCOc1cccnc1N[C@@H]1CCC[C@H]([NH3+])C1 ZINC000382407082 993459484 /nfs/dbraw/zinc/45/94/84/993459484.db2.gz BMPUBWOEWXPDLJ-WDEREUQCSA-N 2 0 235.331 2.162 20 0 BEADRP CCOc1cccnc1N[C@H]1CCC[C@H]([NH3+])C1 ZINC000382407080 993459958 /nfs/dbraw/zinc/45/99/58/993459958.db2.gz BMPUBWOEWXPDLJ-QWRGUYRKSA-N 2 0 235.331 2.162 20 0 BEADRP [NH3+]C[C@@H]1CCCC[N@H+](Cc2ccccc2F)C1 ZINC000383487763 993494777 /nfs/dbraw/zinc/49/47/77/993494777.db2.gz AFSHDGWDCGAHTJ-LBPRGKRZSA-N 2 0 236.334 2.387 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+]C1CC(C)(c2ccccc2)C1 ZINC001577124571 993512217 /nfs/dbraw/zinc/51/22/17/993512217.db2.gz IQIBDWYHBZVZJW-WLYUNCDWSA-N 2 0 232.371 2.434 20 0 BEADRP CC[C@H]1CCCC[C@H]1C[NH2+][C@H]1C[C@H]([NH3+])C1 ZINC001577254367 993563384 /nfs/dbraw/zinc/56/33/84/993563384.db2.gz JVGQQARKDPIACJ-CYDGBPFRSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1[NH2+]CCC[C@@H]1C[NH2+]C1CCCCC1 ZINC000384288074 993568267 /nfs/dbraw/zinc/56/82/67/993568267.db2.gz VQOBTCLTPZRQQI-NWDGAFQWSA-N 2 0 210.365 2.297 20 0 BEADRP CCCC[C@H](CC)[NH2+]C[C@H]1CCC2(C[NH2+]C2)O1 ZINC001577387955 993637656 /nfs/dbraw/zinc/63/76/56/993637656.db2.gz COUJQFSMOSUOMR-QWHCGFSZSA-N 2 0 240.391 2.066 20 0 BEADRP Cc1ccc(C)c(C[N@H+]2CC[NH2+]C[C@@H](C)C2)c1 ZINC000385299373 993657297 /nfs/dbraw/zinc/65/72/97/993657297.db2.gz KPWVWEHBRDUOAC-CYBMUJFWSA-N 2 0 232.371 2.345 20 0 BEADRP CCCCO[C@@H]1C[C@H]([NH2+]C/C=C/C[NH3+])C1(C)C ZINC001577463374 993666844 /nfs/dbraw/zinc/66/68/44/993666844.db2.gz UWYNOBOIUVSVNB-VFZNBBLXSA-N 2 0 240.391 2.075 20 0 BEADRP N#Cc1ccc(C[N@H+]2CCCC[C@@H](C[NH3+])C2)cc1 ZINC000386338135 993685534 /nfs/dbraw/zinc/68/55/34/993685534.db2.gz LDDNTCPFYKSRAP-HNNXBMFYSA-N 2 0 243.354 2.119 20 0 BEADRP CCCSC[C@H](C)[NH2+][C@@H]1CCCC[C@H]1[NH3+] ZINC001577597360 993691110 /nfs/dbraw/zinc/69/11/10/993691110.db2.gz YZNRSBYGDRVKAB-QJPTWQEYSA-N 2 0 230.421 2.378 20 0 BEADRP C[C@H]1CCC[C@H]([NH+]2CCC(C)([NH3+])CC2)C1 ZINC000390672437 993799300 /nfs/dbraw/zinc/79/93/00/993799300.db2.gz VYEUAEJBXIIJEN-RYUDHWBXSA-N 2 0 210.365 2.378 20 0 BEADRP C[C@@H]1CCC[C@H]([NH+]2CCC(C)([NH3+])CC2)C1 ZINC000390672435 993800445 /nfs/dbraw/zinc/80/04/45/993800445.db2.gz VYEUAEJBXIIJEN-NEPJUHHUSA-N 2 0 210.365 2.378 20 0 BEADRP C[C@H]1CCC[C@@H]([NH+]2CCC(C)([NH3+])CC2)C1 ZINC000390672436 993801026 /nfs/dbraw/zinc/80/10/26/993801026.db2.gz VYEUAEJBXIIJEN-NWDGAFQWSA-N 2 0 210.365 2.378 20 0 BEADRP C[C@H]1C[C@H]([NH2+]C2CCC(C[NH3+])CC2)CCS1 ZINC001332419412 994082910 /nfs/dbraw/zinc/08/29/10/994082910.db2.gz CVDYVIGCJMRKQA-YWPUVAFDSA-N 2 0 242.432 2.378 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CCC2CCCC2)CC[NH2+]1 ZINC000821987591 994415228 /nfs/dbraw/zinc/41/52/28/994415228.db2.gz FKPLGBWADRRZNP-WCQYABFASA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1CC[NH2+]C[C@H]1C[NH2+]C1CCC(F)(F)CC1 ZINC000822168046 994419153 /nfs/dbraw/zinc/41/91/53/994419153.db2.gz JILYMGXKQOJEBG-MNOVXSKESA-N 2 0 246.345 2.400 20 0 BEADRP C[C@@H]1CC[NH2+]C[C@@H]1C[NH2+]C1CCC(F)(F)CC1 ZINC000822168042 994420767 /nfs/dbraw/zinc/42/07/67/994420767.db2.gz JILYMGXKQOJEBG-GHMZBOCLSA-N 2 0 246.345 2.400 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]([NH2+]C/C=C/C2CC2)C1 ZINC001334742622 994627821 /nfs/dbraw/zinc/62/78/21/994627821.db2.gz JQTRFVOKYMMJLA-OOPCZODUSA-N 2 0 222.376 2.320 20 0 BEADRP C[NH+](C)[C@@H]1CC[C@@H]2C[N@H+](CC3CC3)C[C@H]2C1 ZINC001335584634 994821099 /nfs/dbraw/zinc/82/10/99/994821099.db2.gz WXKFMLDIXIFISH-MGPQQGTHSA-N 2 0 222.376 2.059 20 0 BEADRP C[C@H](CCC1CC1)[NH2+][C@@H]1CC[C@H]2C[N@H+](C)C[C@@H]21 ZINC001621570551 1170163357 /nfs/dbraw/zinc/16/33/57/1170163357.db2.gz XACUCJSLKICMMB-UQOMUDLDSA-N 2 0 236.403 2.495 20 0 BEADRP CC[C@H]1CCC[N@H+](CC2CC[NH2+]CC2)C1 ZINC000036169885 1170197234 /nfs/dbraw/zinc/19/72/34/1170197234.db2.gz NQKRTTCXCHUPHP-LBPRGKRZSA-N 2 0 210.365 2.108 20 0 BEADRP CC1(C)CC[C@@H]([NH2+]C[C@H]2C[NH+]3CCC2CC3)C1 ZINC001621551535 1170845239 /nfs/dbraw/zinc/84/52/39/1170845239.db2.gz LFRSOUAKCSFMHB-UONOGXRCSA-N 2 0 236.403 2.497 20 0 BEADRP CC1(C)CC[C@H]([NH2+]C[C@@H]2C[NH+]3CCC2CC3)C1 ZINC001621551534 1170845259 /nfs/dbraw/zinc/84/52/59/1170845259.db2.gz LFRSOUAKCSFMHB-KGLIPLIRSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H](CCC1CC1)[NH2+]C[C@H]1C[NH+]2CCC1CC2 ZINC001621551542 1170845507 /nfs/dbraw/zinc/84/55/07/1170845507.db2.gz LHSZHMBWENXLLY-DOMZBBRYSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H]1C[C@H]1C[N@@H+]1CCC(C)(C)NC(C)(C)C1 ZINC001621570402 1170851411 /nfs/dbraw/zinc/85/14/11/1170851411.db2.gz SYDSHKHFCQSOOU-RYUDHWBXSA-N 2 0 224.392 2.495 20 0 BEADRP Cc1nc([C@H](C)[NH2+]CCCC[NH3+])c(C)s1 ZINC000037715235 1170964539 /nfs/dbraw/zinc/96/45/39/1170964539.db2.gz DZOZOBPXZZTZCC-QMMMGPOBSA-N 2 0 227.377 2.149 20 0 BEADRP CCN(Cc1cccnc1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000040747493 1171152752 /nfs/dbraw/zinc/15/27/52/1171152752.db2.gz GABSEWZLKQLQMR-YIONKMFJSA-N 2 0 245.370 2.187 20 0 BEADRP C[N@H+](CC[C@@H]1CCCC[NH2+]1)CC(C)(C)C ZINC000045074019 1171433319 /nfs/dbraw/zinc/43/33/19/1171433319.db2.gz HVVYVVRRZQGXGY-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H](Cc1ccco1)[NH2+]CCCn1ccnc1 ZINC000049328054 1171687848 /nfs/dbraw/zinc/68/78/48/1171687848.db2.gz NSKYLJVGTSZWPA-LBPRGKRZSA-N 2 0 233.315 2.087 20 0 BEADRP [NH3+]CCCC[N@@H+]1CC[C@H](c2ccccc2)C1 ZINC000050598418 1171819753 /nfs/dbraw/zinc/81/97/53/1171819753.db2.gz XACKUUHJOIDKBH-AWEZNQCLSA-N 2 0 218.344 2.215 20 0 BEADRP Cc1cccc(CC[N@H+]2CC[NH2+]C[C@H](C)C2)c1 ZINC000051670990 1171908953 /nfs/dbraw/zinc/90/89/53/1171908953.db2.gz AUZHUQHRUBGPHH-AWEZNQCLSA-N 2 0 232.371 2.079 20 0 BEADRP CCc1ccc(C[NH+]2CCC(C[NH3+])CC2)o1 ZINC000051726105 1171913576 /nfs/dbraw/zinc/91/35/76/1171913576.db2.gz RTCCVAGBTFKLAZ-UHFFFAOYSA-N 2 0 222.332 2.013 20 0 BEADRP C[NH2+]CC[C@@H](C)[N@H+](C)Cc1ccccc1C ZINC000052547074 1171974353 /nfs/dbraw/zinc/97/43/53/1171974353.db2.gz CNUCZSHOSBDCPZ-CYBMUJFWSA-N 2 0 220.360 2.425 20 0 BEADRP CCCC[NH+]1CCC([NH2+][C@H](CC)COC)CC1 ZINC000079712275 136210464 /nfs/dbraw/zinc/21/04/64/136210464.db2.gz DBBGUFDIWZLABK-CYBMUJFWSA-N 2 0 242.407 2.266 20 0 BEADRP CO[C@H](C[N@@H+]1C[C@@H](C[NH3+])C[C@H]1C)c1ccccc1 ZINC000379241321 398141330 /nfs/dbraw/zinc/14/13/30/398141330.db2.gz WZKTUCDRJVNGKP-UMVBOHGHSA-N 2 0 248.370 2.043 20 0 BEADRP c1cn(CC[N@@H+]2CCC[C@H]2C2CCC2)cn1 ZINC000161613343 349476478 /nfs/dbraw/zinc/47/64/78/349476478.db2.gz DNYPKBGLVNXRAQ-ZDUSSCGKSA-N 2 0 219.332 2.148 20 0 BEADRP Cc1cc(C[N@H+]2C[C@H](C[NH3+])C[C@H]2C)ccc1F ZINC000228060225 178007763 /nfs/dbraw/zinc/00/77/63/178007763.db2.gz VVVJAAIQBYLOBH-YPMHNXCESA-N 2 0 236.334 2.303 20 0 BEADRP COC1CCC([NH2+]C[C@@H]2CCC[C@H]([NH3+])C2)CC1 ZINC000415012468 398153938 /nfs/dbraw/zinc/15/39/38/398153938.db2.gz XHMRDXLEWDZWAX-KBHBFKLGSA-N 2 0 240.391 2.051 20 0 BEADRP Cc1ccc(CC[NH2+]C[C@@]2(C)CC[NH2+]C2)c(C)c1 ZINC000415089583 398159552 /nfs/dbraw/zinc/15/95/52/398159552.db2.gz NTLNKODTPRWMPI-MRXNPFEDSA-N 2 0 246.398 2.435 20 0 BEADRP Cc1ccc(CC[NH2+]C[C@]2(C)CC[NH2+]C2)c(C)c1 ZINC000415089581 398159786 /nfs/dbraw/zinc/15/97/86/398159786.db2.gz NTLNKODTPRWMPI-INIZCTEOSA-N 2 0 246.398 2.435 20 0 BEADRP C[C@@H](Cc1ccsc1)[NH2+]CCC[NH2+]C1CC1 ZINC000382548223 398183464 /nfs/dbraw/zinc/18/34/64/398183464.db2.gz QWZOHHNVLSJIHF-NSHDSACASA-N 2 0 238.400 2.411 20 0 BEADRP FC1(F)C[C@@]12CC[N@H+](CCCn1ccnc1)C2 ZINC000649907411 398181127 /nfs/dbraw/zinc/18/11/27/398181127.db2.gz QUKVLMSAVHENCF-LLVKDONJSA-N 2 0 241.285 2.004 20 0 BEADRP Cc1ccccc1OCC[NH2+][C@H]1CCC[C@H]1C[NH3+] ZINC000422943960 398160232 /nfs/dbraw/zinc/16/02/32/398160232.db2.gz LSNUCHAEAFPQTP-KBPBESRZSA-N 2 0 248.370 2.091 20 0 BEADRP CCc1cnccc1[C@H](C)[NH2+][C@H](C)C[C@@H](C)[NH3+] ZINC000423019931 398161189 /nfs/dbraw/zinc/16/11/89/398161189.db2.gz XVYVBJLLAAZTNT-UTUOFQBUSA-N 2 0 235.375 2.420 20 0 BEADRP CC[C@H](CSC)[NH2+]C1CCC(C[NH3+])CC1 ZINC000423019960 398161334 /nfs/dbraw/zinc/16/13/34/398161334.db2.gz YAPNSMXOFBAJNN-MOENNCHZSA-N 2 0 230.421 2.235 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H]1CCO[C@@H](C(C)(C)C)C1 ZINC000423023743 398163264 /nfs/dbraw/zinc/16/32/64/398163264.db2.gz KLUXWNUFJJHPBP-FRRDWIJNSA-N 2 0 242.407 2.297 20 0 BEADRP CC[C@H]([NH2+]CC1([NH3+])CCCCC1)C1CC1 ZINC000423174344 398163967 /nfs/dbraw/zinc/16/39/67/398163967.db2.gz ALEWMSFEXIVGDE-LBPRGKRZSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[NH2+]1)C1C(C)(C)C1(C)C ZINC000423233166 398165141 /nfs/dbraw/zinc/16/51/41/398165141.db2.gz JIBRNIHBPCBFJL-WDEREUQCSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000083390566 398185665 /nfs/dbraw/zinc/18/56/65/398185665.db2.gz VKJTUBXRAAFNRQ-DYEKYZERSA-N 2 0 222.376 2.249 20 0 BEADRP CCC[C@@H](C[NH2+]C[C@@H](C)C[NH+]1CCCC1)OC ZINC000386162610 398198807 /nfs/dbraw/zinc/19/88/07/398198807.db2.gz VDNCLZARAJGCFH-KGLIPLIRSA-N 2 0 242.407 2.123 20 0 BEADRP CCC[C@H](C[NH2+]C[C@@H](C)C[NH+]1CCCC1)OC ZINC000386162615 398198945 /nfs/dbraw/zinc/19/89/45/398198945.db2.gz VDNCLZARAJGCFH-ZIAGYGMSSA-N 2 0 242.407 2.123 20 0 BEADRP FC1(CC[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)CCC1 ZINC000647796771 398201512 /nfs/dbraw/zinc/20/15/12/398201512.db2.gz NBIZHHULIBHZAH-RWMBFGLXSA-N 2 0 240.366 2.246 20 0 BEADRP CC(C)CCC[N@@H+]1C[C@@H]2CC[C@H]([NH3+])[C@H]2C1 ZINC000336712914 398205058 /nfs/dbraw/zinc/20/50/58/398205058.db2.gz VHQWXCVFGQJFDM-AVGNSLFASA-N 2 0 210.365 2.092 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+]CCC(C)(C)C1CC1 ZINC000336894926 398218183 /nfs/dbraw/zinc/21/81/83/398218183.db2.gz YBVPFLPYMRZCIG-CYBMUJFWSA-N 2 0 242.407 2.156 20 0 BEADRP Cc1cccnc1[C@H]([NH2+]C[C@H]1CC[NH2+]C1)C(C)C ZINC000649414609 398218299 /nfs/dbraw/zinc/21/82/99/398218299.db2.gz LNGFWJZYWDATRF-UONOGXRCSA-N 2 0 247.386 2.286 20 0 BEADRP [NH3+]CC[C@H]1CCC[N@H+](Cc2ccccc2F)C1 ZINC000070169342 398221629 /nfs/dbraw/zinc/22/16/29/398221629.db2.gz NACZYFVJAJJUKD-GFCCVEGCSA-N 2 0 236.334 2.387 20 0 BEADRP C[C@@H]([NH2+]CCC[NH3+])c1cnc2ccsc2c1 ZINC000082928261 136222159 /nfs/dbraw/zinc/22/21/59/136222159.db2.gz GVFDDJOFOCRQSJ-SECBINFHSA-N 2 0 235.356 2.296 20 0 BEADRP Cc1cc(N[C@@H](C)[C@@H]2CCC[NH2+]C2)cc[nH+]1 ZINC000229574534 178179338 /nfs/dbraw/zinc/17/93/38/178179338.db2.gz BVBWFXJLZWTIPY-NWDGAFQWSA-N 2 0 219.332 2.190 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H]1CC[C@@H](C)C[C@@H]1C ZINC000576458083 365600940 /nfs/dbraw/zinc/60/09/40/365600940.db2.gz IEDJYQUGLXFICV-FRRDWIJNSA-N 2 0 212.381 2.400 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H]1CC[C@@H](C)C[C@H]1C ZINC000576458086 365601049 /nfs/dbraw/zinc/60/10/49/365601049.db2.gz IEDJYQUGLXFICV-JHJVBQTASA-N 2 0 212.381 2.400 20 0 BEADRP CC[NH2+]CC1CC[NH+](CCCCCOC)CC1 ZINC000430558393 398228370 /nfs/dbraw/zinc/22/83/70/398228370.db2.gz AJSGGEFSVGHGDE-UHFFFAOYSA-N 2 0 242.407 2.125 20 0 BEADRP C[C@](C[NH3+])([NH2+]Cc1ccc2c(c1)CCC2)C1CC1 ZINC000430572561 398228978 /nfs/dbraw/zinc/22/89/78/398228978.db2.gz KGWBYWWCLHGIGJ-MRXNPFEDSA-N 2 0 244.382 2.392 20 0 BEADRP CCc1ccccc1CN1CCC[C@@H]1C[NH2+]C ZINC000133081613 398230829 /nfs/dbraw/zinc/23/08/29/398230829.db2.gz AWMHDBDLKOHDGP-OAHLLOKOSA-N 2 0 232.371 2.433 20 0 BEADRP C[C@H](Cc1cccs1)[NH2+]CC1([NH3+])CCC1 ZINC000643517913 398231026 /nfs/dbraw/zinc/23/10/26/398231026.db2.gz YFLKIHYRZIWDDT-SNVBAGLBSA-N 2 0 224.373 2.150 20 0 BEADRP C[NH+](C)C1CCC([NH2+]Cc2ccncc2)CC1 ZINC000421370102 192334903 /nfs/dbraw/zinc/33/49/03/192334903.db2.gz IWHAMXJHXSJGHK-UHFFFAOYSA-N 2 0 233.359 2.044 20 0 BEADRP CC[NH+]1CCC([NH2+]CCc2cccc(C)n2)CC1 ZINC000280672626 538937583 /nfs/dbraw/zinc/93/75/83/538937583.db2.gz UITRWSRJOLKDNH-UHFFFAOYSA-N 2 0 247.386 2.006 20 0 BEADRP Cc1cc([C@H](C)[NH2+]CCC[NH3+])c(C)s1 ZINC000037713512 178247209 /nfs/dbraw/zinc/24/72/09/178247209.db2.gz VNKPRLKQNZPBSA-VIFPVBQESA-N 2 0 212.362 2.364 20 0 BEADRP CCCC[N@@H+]1CC[C@H](C[NH+](C)CCC)C1 ZINC000174949731 259311017 /nfs/dbraw/zinc/31/10/17/259311017.db2.gz OVGZZTOFLTZDQC-CYBMUJFWSA-N 2 0 212.381 2.450 20 0 BEADRP CCC[C@H](C[NH2+]CC1CC[NH+](CC)CC1)OC ZINC000386162302 398263475 /nfs/dbraw/zinc/26/34/75/398263475.db2.gz UZTOTWVRWCKVDX-CQSZACIVSA-N 2 0 242.407 2.123 20 0 BEADRP CCC[NH+](CCC)CCC[NH2+][C@@H]1CO[C@@H](C)C1 ZINC000647178680 398264675 /nfs/dbraw/zinc/26/46/75/398264675.db2.gz CYYFZGCANFIFLN-KBPBESRZSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@@H]1CC[N@H+](CC[C@@H]2CCC[NH+]2C)[C@@H]1C ZINC000162149801 349576936 /nfs/dbraw/zinc/57/69/36/349576936.db2.gz JLVCENIRZQBVIT-UPJWGTAASA-N 2 0 210.365 2.201 20 0 BEADRP C[N@@H+]1CCC[C@@H]1CC[NH+]1CCSC(C)(C)C1 ZINC000162215743 349590039 /nfs/dbraw/zinc/59/00/39/349590039.db2.gz VMEGRCVMRPROSO-GFCCVEGCSA-N 2 0 242.432 2.298 20 0 BEADRP CC(C)CC[N@H+](C)CC[C@@H]1CCC[NH+]1C ZINC000179308173 538954892 /nfs/dbraw/zinc/95/48/92/538954892.db2.gz KXLVTLPPFRZHAV-ZDUSSCGKSA-N 2 0 212.381 2.449 20 0 BEADRP C1CC1[C@H]1CC[C@@H]1[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000348109803 136234341 /nfs/dbraw/zinc/23/43/41/136234341.db2.gz ZITBKZLCCIZSGY-TUVASFSCSA-N 2 0 234.387 2.391 20 0 BEADRP CC(C)COCCC[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000129839022 323009736 /nfs/dbraw/zinc/00/97/36/323009736.db2.gz ALMFLNALDHYSHP-KBPBESRZSA-N 2 0 242.407 2.121 20 0 BEADRP CCC[C@@H](C)[NH2+]CCC[N@H+](C)C(C)C ZINC000166563957 361851611 /nfs/dbraw/zinc/85/16/11/361851611.db2.gz OLEZZIJKLHVHHJ-GFCCVEGCSA-N 2 0 200.370 2.495 20 0 BEADRP C[C@@H](CCCC(F)(F)F)[NH2+]CCC[NH3+] ZINC000166663794 361854625 /nfs/dbraw/zinc/85/46/25/361854625.db2.gz BPEMVRAAUAUBHF-QMMMGPOBSA-N 2 0 212.259 2.046 20 0 BEADRP C[N@@H+]1CCC[C@@H]1CC[NH+]1C[C@@H]2CCC[C@@H]2C1 ZINC000162235679 349615821 /nfs/dbraw/zinc/61/58/21/349615821.db2.gz XUPHFIQYOBGQSB-HZSPNIEDSA-N 2 0 222.376 2.203 20 0 BEADRP [NH3+]C[C@@H]1CCC[N@H+](C[C@@H]2C[C@H]2c2ccccc2)C1 ZINC000583934828 342728320 /nfs/dbraw/zinc/72/83/20/342728320.db2.gz XSOPXYLORMYQND-BPUTZDHNSA-N 2 0 244.382 2.461 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H]1CCC[C@@H]1C ZINC000083389771 398280683 /nfs/dbraw/zinc/28/06/83/398280683.db2.gz NUVFNGJUGRABEX-STQMWFEESA-N 2 0 212.381 2.497 20 0 BEADRP CCN(CC)C[C@@H](C)[NH2+][C@@H](C)C(C)C ZINC000045690491 538993005 /nfs/dbraw/zinc/99/30/05/538993005.db2.gz NKJAQYJUORWCSY-NEPJUHHUSA-N 2 0 200.370 2.351 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@H]1C)C1CC[NH+](C)CC1 ZINC000379774275 538980393 /nfs/dbraw/zinc/98/03/93/538980393.db2.gz CCGPYMYBGXIEGR-NTZNESFSSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H](C)CCC(C)(C)C ZINC000395092564 398299302 /nfs/dbraw/zinc/29/93/02/398299302.db2.gz AKLPFUDCGRHELJ-MNOVXSKESA-N 2 0 200.370 2.386 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@]2(C)C[C@H]3C[C@H]3C2)CC[N@@H+]1C ZINC000624200545 342847357 /nfs/dbraw/zinc/84/73/57/342847357.db2.gz OCRAOWRKTNUFLK-UXXRCYHCSA-N 2 0 236.403 2.495 20 0 BEADRP CCC[C@H](C)CCC[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC000625096966 342852241 /nfs/dbraw/zinc/85/22/41/342852241.db2.gz HSDDUOVEMFXCHE-MELADBBJSA-N 2 0 224.392 2.354 20 0 BEADRP Cc1ccccc1CCC[N@H+](C)CCC[NH3+] ZINC000382086419 398305060 /nfs/dbraw/zinc/30/50/60/398305060.db2.gz UZGILMHWOAKWFH-UHFFFAOYSA-N 2 0 220.360 2.208 20 0 BEADRP C[C@H](C[NH2+]CCC[NH+](C)C)c1ccccc1 ZINC000013732600 342870988 /nfs/dbraw/zinc/87/09/88/342870988.db2.gz NHDXBEQRIZLAJW-CYBMUJFWSA-N 2 0 220.360 2.331 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]CC2CCC2)CC1 ZINC000037180281 342924348 /nfs/dbraw/zinc/92/43/48/342924348.db2.gz HQIIGDKXRCABNF-UHFFFAOYSA-N 2 0 210.365 2.249 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H](C)C1(C)CC1 ZINC000037467901 342932694 /nfs/dbraw/zinc/93/26/94/342932694.db2.gz REJUNCGUGJNFLX-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP COCCC[C@H](C)[NH2+]CCC1CC[NH+](C)CC1 ZINC000178748044 536664950 /nfs/dbraw/zinc/66/49/50/536664950.db2.gz GRYUXDHAFHITBQ-ZDUSSCGKSA-N 2 0 242.407 2.123 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C2CC(F)(F)C2)[C@H]2CCC[C@@H]21 ZINC000353589579 187208878 /nfs/dbraw/zinc/20/88/78/187208878.db2.gz QPASCCIQXJCPGO-WOPDTQHZSA-N 2 0 244.329 2.247 20 0 BEADRP CCc1cc(NCC(C)(C)[NH+](C)C)cc[nH+]1 ZINC000307814509 529553695 /nfs/dbraw/zinc/55/36/95/529553695.db2.gz KLNFHUWUQMZDSN-UHFFFAOYSA-N 2 0 221.348 2.396 20 0 BEADRP CCC1CCC([NH2+]CCC[NH+](C)C)CC1 ZINC000019958186 342964815 /nfs/dbraw/zinc/96/48/15/342964815.db2.gz HMBMWYXMYDFIKQ-UHFFFAOYSA-N 2 0 212.381 2.497 20 0 BEADRP CSCCCCC[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000235179443 342990042 /nfs/dbraw/zinc/99/00/42/342990042.db2.gz KQYHCJBEQRIMEK-RYUDHWBXSA-N 2 0 230.421 2.379 20 0 BEADRP C(CC1CCCC1)C[N@@H+]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000357068184 187213798 /nfs/dbraw/zinc/21/37/98/187213798.db2.gz DKWFPLQEUWACPA-LSDHHAIUSA-N 2 0 236.403 2.498 20 0 BEADRP Cc1ccc(C[NH2+]C[C@H]2CCC[N@@H+](C)C2)s1 ZINC000044534341 343009029 /nfs/dbraw/zinc/00/90/29/343009029.db2.gz HLBWHADIAQDQGD-GFCCVEGCSA-N 2 0 238.400 2.488 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C[C@H]2CC[C@H](C[NH3+])CC2)[C@@H]1C ZINC000386277432 342994283 /nfs/dbraw/zinc/99/42/83/342994283.db2.gz QECFUBVFQRVDEK-DHGKCCLASA-N 2 0 224.392 2.386 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C[C@H]2CC[C@H](C[NH3+])CC2)[C@H]1C ZINC000386277437 342994619 /nfs/dbraw/zinc/99/46/19/342994619.db2.gz QECFUBVFQRVDEK-XVIXHAIJSA-N 2 0 224.392 2.386 20 0 BEADRP C[C@H](CC(F)(F)F)[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000235465809 343038920 /nfs/dbraw/zinc/03/89/20/343038920.db2.gz HHWRWHNIUYVHAH-IWSPIJDZSA-N 2 0 224.270 2.187 20 0 BEADRP CCSCC[N@@H+]1CCC2(C1)CC[NH+](C)CC2 ZINC000602878111 349790184 /nfs/dbraw/zinc/79/01/84/349790184.db2.gz VNKRNEXWJOEGOV-UHFFFAOYSA-N 2 0 242.432 2.157 20 0 BEADRP C[C@@H]([NH2+]CCCC(F)(F)F)[C@@H]1CCCC[NH2+]1 ZINC000386593046 343078909 /nfs/dbraw/zinc/07/89/09/343078909.db2.gz RYXIFBASAVJXLA-ZJUUUORDSA-N 2 0 238.297 2.449 20 0 BEADRP C[C@H]([NH2+]CCCC(F)(F)F)[C@H]1CCCC[NH2+]1 ZINC000386593045 343078730 /nfs/dbraw/zinc/07/87/30/343078730.db2.gz RYXIFBASAVJXLA-VHSXEESVSA-N 2 0 238.297 2.449 20 0 BEADRP COCc1ccccc1C[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000093214621 343150875 /nfs/dbraw/zinc/15/08/75/343150875.db2.gz DDLVOUMZEQGFMK-HUUCEWRRSA-N 2 0 248.370 2.193 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]CCc2ccc(F)cc2)C1 ZINC000093209415 343151125 /nfs/dbraw/zinc/15/11/25/343151125.db2.gz AUUPBNPVJDPSPD-ZIAGYGMSSA-N 2 0 236.334 2.228 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]CCCc2ccccc2)C1 ZINC000093210091 343151221 /nfs/dbraw/zinc/15/12/21/343151221.db2.gz MJSZYFRIPVKXIC-LSDHHAIUSA-N 2 0 232.371 2.479 20 0 BEADRP C[C@H]([NH2+]CC1CC[NH2+]CC1)c1cccc(O)c1 ZINC000094010171 343151926 /nfs/dbraw/zinc/15/19/26/343151926.db2.gz JDWITTNSRAVPQK-NSHDSACASA-N 2 0 234.343 2.042 20 0 BEADRP C[C@@H]1C[C@@H]([NH3+])CC[N@@H+]1Cc1ccc2c(c1)CCC2 ZINC000124495241 343163009 /nfs/dbraw/zinc/16/30/09/343163009.db2.gz PXBUIXSKYSTARG-WBMJQRKESA-N 2 0 244.382 2.487 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]Cc1cccc2cccnc21 ZINC000311239810 136275736 /nfs/dbraw/zinc/27/57/36/136275736.db2.gz VXHVILBLJBFISK-LBPRGKRZSA-N 2 0 243.354 2.452 20 0 BEADRP C[N@H+](CC1CCCC1)CC1CC[NH2+]CC1 ZINC000082492420 136276583 /nfs/dbraw/zinc/27/65/83/136276583.db2.gz WIAGFGWIIXYUKS-UHFFFAOYSA-N 2 0 210.365 2.108 20 0 BEADRP C[N@H+](Cc1cccc2ncccc12)C1CC([NH3+])C1 ZINC000634688549 343249008 /nfs/dbraw/zinc/24/90/08/343249008.db2.gz WCKGRDQWXZKLGE-UHFFFAOYSA-N 2 0 241.338 2.156 20 0 BEADRP CC(C)c1ncc(C[NH2+][C@@H](C)C[C@H](C)[NH3+])s1 ZINC000584053361 343308941 /nfs/dbraw/zinc/30/89/41/343308941.db2.gz IYFOTJWYCYKKSY-UWVGGRQHSA-N 2 0 241.404 2.482 20 0 BEADRP CCC1([NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)CC1 ZINC000335626661 136299901 /nfs/dbraw/zinc/29/99/01/136299901.db2.gz VYUCOWCTGSNKEO-RYUDHWBXSA-N 2 0 208.349 2.145 20 0 BEADRP c1ccc2c(c1)CC[C@@H]2C[NH2+]C1CC[NH2+]CC1 ZINC000335650431 136304788 /nfs/dbraw/zinc/30/47/88/136304788.db2.gz OJLUEJOCRCJSCD-CYBMUJFWSA-N 2 0 230.355 2.058 20 0 BEADRP C1[C@@H]([NH2+]C2CC[NH2+]CC2)[C@@H]1C1CCCCC1 ZINC000335650720 136304993 /nfs/dbraw/zinc/30/49/93/136304993.db2.gz XUQFUYGXJHWPBD-UONOGXRCSA-N 2 0 222.376 2.297 20 0 BEADRP Cc1cc(Cl)ccc1CN[C@@H]1CC[NH2+]C1 ZINC000335642369 136308875 /nfs/dbraw/zinc/30/88/75/136308875.db2.gz JCFSQNXBTIVXQF-GFCCVEGCSA-N 2 0 224.735 2.100 20 0 BEADRP Fc1ccccc1CN[C@H]1CCCC[NH2+]C1 ZINC000335643004 136309034 /nfs/dbraw/zinc/30/90/34/136309034.db2.gz LIBSJEBFOVYJNU-LBPRGKRZSA-N 2 0 222.307 2.057 20 0 BEADRP CC(C)(C)[C@H]1CC[N@H+](CC2CC[NH2+]CC2)C1 ZINC000166228940 136315111 /nfs/dbraw/zinc/31/51/11/136315111.db2.gz ADAYUTWVZOMBQV-ZDUSSCGKSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@H](CCC1CC1)[NH2+]CC1([NH3+])CCCC1 ZINC000398230158 488215619 /nfs/dbraw/zinc/21/56/19/488215619.db2.gz RZKSCNVZYKBSSI-LLVKDONJSA-N 2 0 210.365 2.426 20 0 BEADRP CC[NH+]1CCC([NH2+]CCc2ccc(O)cc2)CC1 ZINC000040734878 343408207 /nfs/dbraw/zinc/40/82/07/343408207.db2.gz YPQCDZKVIVDWRH-UHFFFAOYSA-N 2 0 248.370 2.009 20 0 BEADRP CC1=C[C@@H](C)C[N@H+](CC[C@H]2CCC[NH+]2C)C1 ZINC000335891856 136358889 /nfs/dbraw/zinc/35/88/89/136358889.db2.gz AYVKIMNBQWTOCX-TZMCWYRMSA-N 2 0 222.376 2.369 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CC2CCCC2)[C@H](C)C1 ZINC000166861263 136364339 /nfs/dbraw/zinc/36/43/39/136364339.db2.gz BZYHWXRVAGGKKO-TZMCWYRMSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+]Cc1ccc(F)c(Cl)c1 ZINC000258728846 136373889 /nfs/dbraw/zinc/37/38/89/136373889.db2.gz JVBNWGRUAAFSOQ-QMMMGPOBSA-N 2 0 230.714 2.164 20 0 BEADRP CCCCC[N@H+](CCC[NH2+]C)C(C)C ZINC000042559239 343443461 /nfs/dbraw/zinc/44/34/61/343443461.db2.gz ZEUSLKDXSHODBW-UHFFFAOYSA-N 2 0 200.370 2.497 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccn(C)c2)[C@@H](C)C1 ZINC000271211010 136375036 /nfs/dbraw/zinc/37/50/36/136375036.db2.gz UMMAGAUKJDAYPU-ZFWWWQNUSA-N 2 0 249.402 2.187 20 0 BEADRP C[C@@H]([NH3+])C1CC[NH+](Cc2cccs2)CC1 ZINC000082474671 343444365 /nfs/dbraw/zinc/44/43/65/343444365.db2.gz LIFFSKHSSHGYGC-SNVBAGLBSA-N 2 0 224.373 2.307 20 0 BEADRP C[C@@H]([NH3+])C1CC[NH+](CCC(C)(C)C)CC1 ZINC000082474743 343444444 /nfs/dbraw/zinc/44/44/44/343444444.db2.gz ZRDQAEBHKKCWBW-LLVKDONJSA-N 2 0 212.381 2.482 20 0 BEADRP CSC1CC[NH+](CC[C@H]2CCC[N@@H+]2C)CC1 ZINC000602922603 349812245 /nfs/dbraw/zinc/81/22/45/349812245.db2.gz KTJGAYPEGHPHIV-GFCCVEGCSA-N 2 0 242.432 2.298 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]CCC[NH+](C)C)[C@@H]1C ZINC000082857404 343468360 /nfs/dbraw/zinc/46/83/60/343468360.db2.gz DBWCMAHLRMJGQW-UPJWGTAASA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H]1CC[C@@H](C)[C@H]([NH2+]CCC[NH+](C)C)C1 ZINC000082857414 343468538 /nfs/dbraw/zinc/46/85/38/343468538.db2.gz RGFBZJNRYDIFLW-JHJVBQTASA-N 2 0 212.381 2.352 20 0 BEADRP Cc1ccnc([C@@H](C)[NH2+]CCCC[NH+](C)C)c1 ZINC000286365601 187345409 /nfs/dbraw/zinc/34/54/09/187345409.db2.gz ZJGMQXADZNYUKO-CYBMUJFWSA-N 2 0 235.375 2.382 20 0 BEADRP C/C=C\C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000384648558 343702198 /nfs/dbraw/zinc/70/21/98/343702198.db2.gz ABXPOWKYNNQWGV-URFMKQJRSA-N 2 0 208.349 2.073 20 0 BEADRP Cc1ccc2c(c1)[C@@H]([NH2+][C@H](C)CCC[NH3+])CO2 ZINC000576458584 343750798 /nfs/dbraw/zinc/75/07/98/343750798.db2.gz OXVNPAIDJVDZPE-YPMHNXCESA-N 2 0 234.343 2.146 20 0 BEADRP CCc1ccc(C[NH+]2CCC(C[NH3+])CC2)cc1 ZINC000044511902 343781157 /nfs/dbraw/zinc/78/11/57/343781157.db2.gz FUBKKHNABGPOFS-UHFFFAOYSA-N 2 0 232.371 2.420 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+][C@@H]1CCCC[C@H]1C[NH3+] ZINC000387661119 346994855 /nfs/dbraw/zinc/99/48/55/346994855.db2.gz HLONGKNINXWJNM-MROQNXINSA-N 2 0 210.365 2.140 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+]CC1(C)CCC1 ZINC000336716109 537824553 /nfs/dbraw/zinc/82/45/53/537824553.db2.gz XEYMOPFCUNMIEQ-UHFFFAOYSA-N 2 0 212.381 2.497 20 0 BEADRP CC[C@H]([NH2+]CCC[NH+](C)C)C1CCCC1 ZINC000387655689 346992377 /nfs/dbraw/zinc/99/23/77/346992377.db2.gz LTRUXJVVDIVJJP-ZDUSSCGKSA-N 2 0 212.381 2.497 20 0 BEADRP Cc1ccc(C[NH2+]C2CCC([NH+](C)C)CC2)cn1 ZINC000353436010 178602043 /nfs/dbraw/zinc/60/20/43/178602043.db2.gz ARNREQWPURQBSU-UHFFFAOYSA-N 2 0 247.386 2.352 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@@]3(CC[NH2+]C3)C2)cc1 ZINC000031994552 343886744 /nfs/dbraw/zinc/88/67/44/343886744.db2.gz ZDTXWPZXPPEOOO-OAHLLOKOSA-N 2 0 230.355 2.180 20 0 BEADRP Cc1cc(C[N@@H+]2C[C@H](C[NH3+])[C@H](C)C[C@@H]2C)ccn1 ZINC000621776704 343899547 /nfs/dbraw/zinc/89/95/47/343899547.db2.gz SZWUBVAASGCCRL-ZLDLUXBVSA-N 2 0 247.386 2.195 20 0 BEADRP CC(C)=CCC[N@@H+]1C[C@@H]2CCC[C@]2([NH3+])C1 ZINC000621784632 343907822 /nfs/dbraw/zinc/90/78/22/343907822.db2.gz RSKAIWMUROVPGF-STQMWFEESA-N 2 0 208.349 2.156 20 0 BEADRP C(CC1CC1)[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000128060033 187285652 /nfs/dbraw/zinc/28/56/52/187285652.db2.gz JWXWUZWMLFWAES-STQMWFEESA-N 2 0 208.349 2.003 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]([NH2+]C2CCCC2)C1 ZINC000634733166 344108180 /nfs/dbraw/zinc/10/81/80/344108180.db2.gz YSCXOPCDSQLTJC-GFCCVEGCSA-N 2 0 210.365 2.297 20 0 BEADRP C(C[NH+](CC1CC1)CC1CC1)[C@H]1CCC[NH2+]C1 ZINC000070505432 187358554 /nfs/dbraw/zinc/35/85/54/187358554.db2.gz DRVVZFOSHUJZLI-CYBMUJFWSA-N 2 0 236.403 2.498 20 0 BEADRP CCC[C@@H](C)C[NH2+][C@]12CCC[C@@H]1C[NH2+]C2 ZINC000634733416 344113184 /nfs/dbraw/zinc/11/31/84/344113184.db2.gz FFVBXQFBOBYKMV-UPJWGTAASA-N 2 0 210.365 2.154 20 0 BEADRP CC(C)[N@H+](C)CCNc1nc2ccccc2[nH]1 ZINC000049773261 187357864 /nfs/dbraw/zinc/35/78/64/187357864.db2.gz XIBHFTJPTJTWBE-UHFFFAOYSA-N 2 0 232.331 2.315 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)C1CC1 ZINC000093977906 344150589 /nfs/dbraw/zinc/15/05/89/344150589.db2.gz WFDMGXKNUNUYAG-CYZMBNFOSA-N 2 0 208.349 2.001 20 0 BEADRP Cc1cnccc1CN(C)CC[C@@H]([NH3+])C(C)C ZINC000384906740 344222122 /nfs/dbraw/zinc/22/21/22/344222122.db2.gz AQVDJCBJSBWEFG-CQSZACIVSA-N 2 0 235.375 2.195 20 0 BEADRP C[C@@H]([NH2+]CCC[NH+]1CCCC1)C1CCC1 ZINC000132249389 344289758 /nfs/dbraw/zinc/28/97/58/344289758.db2.gz UTWNVPIGQMOWBB-GFCCVEGCSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@H]1C[C@@H]([NH3+])CN1CCCOCc1ccccc1 ZINC000385069943 344313954 /nfs/dbraw/zinc/31/39/54/344313954.db2.gz HLUONAXBUJHOGW-DZGCQCFKSA-N 2 0 248.370 2.015 20 0 BEADRP C[C@@H]1C[C@H]([NH3+])CN1CCCOCc1ccccc1 ZINC000385069944 344314281 /nfs/dbraw/zinc/31/42/81/344314281.db2.gz HLUONAXBUJHOGW-HIFRSBDPSA-N 2 0 248.370 2.015 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC2CCC2)CN1C1CC1 ZINC000132863487 344309903 /nfs/dbraw/zinc/30/99/03/344309903.db2.gz ONENFHJQTVEEIY-PWSUYJOCSA-N 2 0 208.349 2.001 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CCc1ccc(F)cc1F ZINC000584285623 344419821 /nfs/dbraw/zinc/41/98/21/344419821.db2.gz VMPIVKFNKSBTDD-UWVGGRQHSA-N 2 0 242.313 2.223 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@@H]1CC[C@H]1C1CC1 ZINC000336768389 537844947 /nfs/dbraw/zinc/84/49/47/537844947.db2.gz UPMIDBGBNVBCDK-KGYLQXTDSA-N 2 0 210.365 2.105 20 0 BEADRP CCc1ccc(CN2C[C@@H](C)[C@H]([NH3+])C2)s1 ZINC000300046933 344380638 /nfs/dbraw/zinc/38/06/38/344380638.db2.gz BDHYIKXLRKRZQV-BXKDBHETSA-N 2 0 224.373 2.090 20 0 BEADRP C[N@H+]1CC=C(C[NH2+][C@@H]2CC[C@@H]2C2CC2)CC1 ZINC000336775442 537847092 /nfs/dbraw/zinc/84/70/92/537847092.db2.gz ZARUZAPKYKPJOW-ZIAGYGMSSA-N 2 0 220.360 2.027 20 0 BEADRP C[C@@H]1CSC[C@H]1[NH2+]CC[C@@H]1CCCC[N@@H+]1C ZINC000381039293 344472928 /nfs/dbraw/zinc/47/29/28/344472928.db2.gz BWNSUVUOUOLXLE-FRRDWIJNSA-N 2 0 242.432 2.202 20 0 BEADRP CC[C@@H](C)[C@H](C)[NH2+]CCCC[NH+](C)C ZINC000045663731 344574589 /nfs/dbraw/zinc/57/45/89/344574589.db2.gz AAYZRUKGPNNXKR-NEPJUHHUSA-N 2 0 200.370 2.352 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@@H](F)C1)[C@@H]1CCC[NH2+]C1 ZINC000573967519 344580055 /nfs/dbraw/zinc/58/00/55/344580055.db2.gz SOZKQKOMJUXOMT-UMSGYPCISA-N 2 0 228.355 2.245 20 0 BEADRP Cc1ccsc1C[NH2+][C@H](C)CC[NH+](C)C ZINC000049551914 344652622 /nfs/dbraw/zinc/65/26/22/344652622.db2.gz RYWISOCYCVQZEU-LLVKDONJSA-N 2 0 226.389 2.486 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+]Cc1cccs1 ZINC000049551898 344652837 /nfs/dbraw/zinc/65/28/37/344652837.db2.gz AIRLVVYRFRWMJR-SNVBAGLBSA-N 2 0 212.362 2.178 20 0 BEADRP CCCC[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C)C1 ZINC000158485064 344661701 /nfs/dbraw/zinc/66/17/01/344661701.db2.gz AHGYQMWZVZSQAH-CHWSQXEVSA-N 2 0 210.365 2.203 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]C2CCSCC2)[C@H](C)C1 ZINC000178095982 344637352 /nfs/dbraw/zinc/63/73/52/344637352.db2.gz IWSORUZLIYYQOS-YPMHNXCESA-N 2 0 242.432 2.202 20 0 BEADRP CSC[C@@H]1CCC[N@@H+]1CCC1CC[NH2+]CC1 ZINC000399993729 344748852 /nfs/dbraw/zinc/74/88/52/344748852.db2.gz IGLCTYRAPREGHQ-ZDUSSCGKSA-N 2 0 242.432 2.204 20 0 BEADRP CSC[C@@H]1CCC[N@@H+]1CC[C@@H]1CCC[NH2+]C1 ZINC000399997687 344748903 /nfs/dbraw/zinc/74/89/03/344748903.db2.gz LJDNHOMCPUFNNE-STQMWFEESA-N 2 0 242.432 2.204 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CCCC(C)(F)F)CC[N@@H+]1C ZINC000390110264 259380201 /nfs/dbraw/zinc/38/02/01/259380201.db2.gz WNOJMMRJKPLLIH-WDEREUQCSA-N 2 0 234.334 2.494 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCCC(C)(F)F)CC[N@@H+]1C ZINC000390110262 259380408 /nfs/dbraw/zinc/38/04/08/259380408.db2.gz WNOJMMRJKPLLIH-MNOVXSKESA-N 2 0 234.334 2.494 20 0 BEADRP CN(Cc1cccc(Cl)c1F)C1CC([NH3+])C1 ZINC000385067930 344855068 /nfs/dbraw/zinc/85/50/68/344855068.db2.gz VKWFRASZEHHNNJ-UHFFFAOYSA-N 2 0 242.725 2.401 20 0 BEADRP CC[C@H]([NH2+]CCCC1CC1)[C@@H]1CCC[NH2+]1 ZINC000578757439 344911788 /nfs/dbraw/zinc/91/17/88/344911788.db2.gz AEYDFOUGECSZFF-STQMWFEESA-N 2 0 210.365 2.297 20 0 BEADRP C1C[C@H]([NH2+][C@H]2CC[NH2+]C2)C2(C1)CCCCC2 ZINC000313024771 187294805 /nfs/dbraw/zinc/29/48/05/187294805.db2.gz NKXDUEBTVUIQCV-STQMWFEESA-N 2 0 222.376 2.441 20 0 BEADRP CC(C)[N@@H+]1CC[C@H](C)[C@@H](n2ccnc2)C1 ZINC000120163501 187294986 /nfs/dbraw/zinc/29/49/86/187294986.db2.gz XVOVMQNCEHJZQP-RYUDHWBXSA-N 2 0 207.321 2.174 20 0 BEADRP C1[C@H]2CCC[C@@H]([NH2+][C@H]3CC[N@@H+]4CCC[C@@H]4C3)[C@@H]12 ZINC000306073403 187295344 /nfs/dbraw/zinc/29/53/44/187295344.db2.gz DNFJOCUWIWKGKC-QKGCVVFFSA-N 2 0 234.387 2.391 20 0 BEADRP CC(C)OCCCC[NH2+][C@@H]1CCCC[C@H]1C[NH3+] ZINC000224982341 345062706 /nfs/dbraw/zinc/06/27/06/345062706.db2.gz IKGMGMPMCWKKNN-UONOGXRCSA-N 2 0 242.407 2.299 20 0 BEADRP CC(C)C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C)C1 ZINC000248167081 345063816 /nfs/dbraw/zinc/06/38/16/345063816.db2.gz TYFVEOHVWGMFQO-QWHCGFSZSA-N 2 0 210.365 2.059 20 0 BEADRP CC(C)C[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C)C1 ZINC000248167082 345064013 /nfs/dbraw/zinc/06/40/13/345064013.db2.gz TYFVEOHVWGMFQO-STQMWFEESA-N 2 0 210.365 2.059 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC2CCCC2)CC[N@@H+]1C ZINC000155880528 345110158 /nfs/dbraw/zinc/11/01/58/345110158.db2.gz LRDUKCGLVODQIS-DGCLKSJQSA-N 2 0 210.365 2.249 20 0 BEADRP CC(F)(F)CCC[NH2+][C@H]1CCC[C@H]1C[NH3+] ZINC000390230672 259382875 /nfs/dbraw/zinc/38/28/75/259382875.db2.gz GQEXCQOICCQCFD-UWVGGRQHSA-N 2 0 220.307 2.139 20 0 BEADRP C[C@@H]1CC[C@@]2(CC[N@H+](CC34CC(C3)C[NH2+]4)C2)C1 ZINC000634993341 345189539 /nfs/dbraw/zinc/18/95/39/345189539.db2.gz RGXBIWJSOMYDSP-FEWQNLEASA-N 2 0 234.387 2.251 20 0 BEADRP C[NH2+]Cc1cccc(NC[C@H](C[NH3+])C(C)C)c1 ZINC000634995426 345184361 /nfs/dbraw/zinc/18/43/61/345184361.db2.gz DQLOTMCXTKWJGJ-ZDUSSCGKSA-N 2 0 235.375 2.049 20 0 BEADRP C[C@@H]1CCCC[C@@]1(C)[NH2+]CC12CC(C1)C[NH2+]2 ZINC000634996573 345188657 /nfs/dbraw/zinc/18/86/57/345188657.db2.gz OERJCNYONGASKY-NELGMTEASA-N 2 0 222.376 2.297 20 0 BEADRP [NH3+][C@H]1CCCCCN(Cc2cccc(O)c2)C1 ZINC000634997409 345195567 /nfs/dbraw/zinc/19/55/67/345195567.db2.gz KMFIHIUXSMCOOK-ZDUSSCGKSA-N 2 0 234.343 2.096 20 0 BEADRP C[C@@H]1C[N@H+](Cc2coc3ccccc23)C[C@H]1C[NH3+] ZINC000634998093 345197434 /nfs/dbraw/zinc/19/74/34/345197434.db2.gz ANHCOFUNYRDIIL-VXGBXAGGSA-N 2 0 244.338 2.459 20 0 BEADRP C[C@@H]1C[N@H+](C/C=C/c2ccccc2)C[C@H]1C[NH3+] ZINC000634998231 345198356 /nfs/dbraw/zinc/19/83/56/345198356.db2.gz CITPPGOSINXVLR-IEOKHJKGSA-N 2 0 230.355 2.226 20 0 BEADRP COc1cc(C[N@H+]2C[C@@H](C[NH3+])[C@H](C)C2)ccc1C ZINC000634999692 345199998 /nfs/dbraw/zinc/19/99/98/345199998.db2.gz XXQRNWAPZOPSER-TZMCWYRMSA-N 2 0 248.370 2.030 20 0 BEADRP C[C@@H]1C[C@@H](C[NH+]2CCC(C)(F)CC2)CC[NH2+]1 ZINC000635001525 345201225 /nfs/dbraw/zinc/20/12/25/345201225.db2.gz CHZWJQQEWKSVFP-NEPJUHHUSA-N 2 0 228.355 2.199 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCCC12CC2)[C@@H]1CCC[NH2+]1 ZINC000635004483 345207781 /nfs/dbraw/zinc/20/77/81/345207781.db2.gz PFSUHTUTAFZJAG-RWMBFGLXSA-N 2 0 222.376 2.439 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CC(C)(C)F ZINC000635004484 345207847 /nfs/dbraw/zinc/20/78/47/345207847.db2.gz PIKIRKRKDPLWOD-SECBINFHSA-N 2 0 239.338 2.247 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[NH2+]CC(C)(C)C1)[C@H]1C[C@H]1C ZINC000635004764 345208385 /nfs/dbraw/zinc/20/83/85/345208385.db2.gz DXGHRNMIGISELR-XQHKEYJVSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+][C@H]1CCCC12CC2 ZINC000635004852 345208395 /nfs/dbraw/zinc/20/83/95/345208395.db2.gz QKHONVYSVKKMBT-AGIUHOORSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+][C@@H]1CCCC12CC2 ZINC000635004855 345208794 /nfs/dbraw/zinc/20/87/94/345208794.db2.gz QKHONVYSVKKMBT-JHJVBQTASA-N 2 0 222.376 2.297 20 0 BEADRP [NH3+]C[C@H]1CC[C@H]([NH2+]C2CCCCC2)CC1 ZINC000635005170 345209179 /nfs/dbraw/zinc/20/91/79/345209179.db2.gz HGWRQCBWTCJTGO-AULYBMBSSA-N 2 0 210.365 2.426 20 0 BEADRP CC[C@@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)C1CC1 ZINC000635005690 345210144 /nfs/dbraw/zinc/21/01/44/345210144.db2.gz JZEVHAOGJFISEZ-RAIGVLPGSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@H]1CCCC12CC2 ZINC000635006054 345210854 /nfs/dbraw/zinc/21/08/54/345210854.db2.gz XGEYYWCHAYYBIT-NEPJUHHUSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)c1nccs1 ZINC000635006772 345211264 /nfs/dbraw/zinc/21/12/64/345211264.db2.gz NMYFGMGBZZKWDV-GMTAPVOTSA-N 2 0 239.388 2.311 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CC[C@@H]1CNc2ccccc21 ZINC000635010077 345211942 /nfs/dbraw/zinc/21/19/42/345211942.db2.gz XYXZJZPIJCJWOG-RWMBFGLXSA-N 2 0 247.386 2.301 20 0 BEADRP COCCC[C@@H](C)[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000635010539 345212695 /nfs/dbraw/zinc/21/26/95/345212695.db2.gz KCJPBQAVPDBFGF-OLZOCXBDSA-N 2 0 242.407 2.169 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]1[NH2+]Cc1cccc2[nH]ccc21 ZINC000635012238 345214659 /nfs/dbraw/zinc/21/46/59/345214659.db2.gz JVSXCYZGYPDQCE-JSGCOSHPSA-N 2 0 229.327 2.137 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CC[C@H](C[NH3+])CC2)[C@@H]1C ZINC000635007689 345215253 /nfs/dbraw/zinc/21/52/53/345215253.db2.gz XDQRHVCFEWBHAL-VEGXAWMVSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]Cc1ccc2cccnc2c1 ZINC000635020072 345223040 /nfs/dbraw/zinc/22/30/40/345223040.db2.gz JPJUARNHGKMZPP-NEPJUHHUSA-N 2 0 243.354 2.450 20 0 BEADRP CC(C)N(C)C[C@H](C)[NH2+][C@H]1CCC[C@H]1C ZINC000380276425 345265359 /nfs/dbraw/zinc/26/53/59/345265359.db2.gz XUKGIPBJGZGTAK-AGIUHOORSA-N 2 0 212.381 2.493 20 0 BEADRP Cc1cccc(CNC2CC[NH+](C3CC3)CC2)n1 ZINC000381308998 345287788 /nfs/dbraw/zinc/28/77/88/345287788.db2.gz MNBCHMCIZXKSOL-UHFFFAOYSA-N 2 0 245.370 2.106 20 0 BEADRP C[C@@H](c1cc(F)ccc1F)N(C)CCC[NH3+] ZINC000133209034 345365896 /nfs/dbraw/zinc/36/58/96/345365896.db2.gz NOJYOKAIERDPOO-VIFPVBQESA-N 2 0 228.286 2.306 20 0 BEADRP CCCC[N@@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000081632174 345488586 /nfs/dbraw/zinc/48/85/86/345488586.db2.gz VONPVOBDSDIYSW-CQSZACIVSA-N 2 0 224.392 2.450 20 0 BEADRP CC(C)C[N@@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000081634503 345488869 /nfs/dbraw/zinc/48/88/69/345488869.db2.gz FWQPWETUNNWRKW-AWEZNQCLSA-N 2 0 224.392 2.306 20 0 BEADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+]CC2(C)CC2)C1 ZINC000380295992 345469730 /nfs/dbraw/zinc/46/97/30/345469730.db2.gz CRWGXPQTHBWECT-LBPRGKRZSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H](CC[NH3+])[NH2+]Cc1ccnc2ccccc12 ZINC000136136275 345480111 /nfs/dbraw/zinc/48/01/11/345480111.db2.gz AOOHPKZBXCSNQB-LLVKDONJSA-N 2 0 229.327 2.062 20 0 BEADRP CC(C)C[C@@H](C)[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000336697915 187307611 /nfs/dbraw/zinc/30/76/11/187307611.db2.gz OLNSSCLEFZDSOX-CHWSQXEVSA-N 2 0 212.381 2.400 20 0 BEADRP CC(C)C[C@H](C)C[N@@H+]1CC[C@@H]2[NH2+]CC[C@H]2C1 ZINC000309246940 187308545 /nfs/dbraw/zinc/30/85/45/187308545.db2.gz CMSLCOBUKKRLMP-IHRRRGAJSA-N 2 0 224.392 2.352 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+]CC1(COC)CC[NH2+]CC1 ZINC000319102838 259384796 /nfs/dbraw/zinc/38/47/96/259384796.db2.gz FJSOOYFTZHBRFO-STQMWFEESA-N 2 0 242.407 2.027 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000319126691 259385159 /nfs/dbraw/zinc/38/51/59/259385159.db2.gz IMYXSYMNJDYXAH-MSXOGSJSSA-N 2 0 210.365 2.294 20 0 BEADRP CSCCCN1CCC[C@@H]([NH2+]C(C)C)C1 ZINC000070585658 345788638 /nfs/dbraw/zinc/78/86/38/345788638.db2.gz DGHBYGKSJNIDEJ-GFCCVEGCSA-N 2 0 230.421 2.202 20 0 BEADRP COc1ccc(C[NH2+][C@H]2CCC[C@@H]2C[NH3+])c(C)c1 ZINC000562960243 345840027 /nfs/dbraw/zinc/84/00/27/345840027.db2.gz LYJGHGILMKNJHJ-DOMZBBRYSA-N 2 0 248.370 2.221 20 0 BEADRP CC[C@@H](C)[C@H](C)[NH2+]CCC1=CC[NH2+]CC1 ZINC000319178517 259386282 /nfs/dbraw/zinc/38/62/82/259386282.db2.gz NWQIZBGHABRZEF-NEPJUHHUSA-N 2 0 210.365 2.320 20 0 BEADRP C[C@H](Cc1cccs1)[NH2+]C[C@H]1CCCN1C ZINC000166877953 345925224 /nfs/dbraw/zinc/92/52/24/345925224.db2.gz XRUDINQYLIRQCG-VXGBXAGGSA-N 2 0 238.400 2.363 20 0 BEADRP C[C@@H]1C[C@@H](NCc2cnc(C3CC3)o2)CC[N@@H+]1C ZINC000628223412 345964304 /nfs/dbraw/zinc/96/43/04/345964304.db2.gz CYPPSQQJZIHXGW-PWSUYJOCSA-N 2 0 249.358 2.124 20 0 BEADRP CC[C@H](CSC)[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000401008669 346030829 /nfs/dbraw/zinc/03/08/29/346030829.db2.gz FVLNTVPPICRYKC-WUHRBBMRSA-N 2 0 242.432 2.106 20 0 BEADRP CC[C@H](CSC)[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000401008660 346030849 /nfs/dbraw/zinc/03/08/49/346030849.db2.gz FVLNTVPPICRYKC-FDYHWXHSSA-N 2 0 242.432 2.106 20 0 BEADRP CC(C)SCC[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000401019066 346033494 /nfs/dbraw/zinc/03/34/94/346033494.db2.gz JYCDEZXYUUMTTG-FRRDWIJNSA-N 2 0 242.432 2.106 20 0 BEADRP C[NH2+]CCC1CC[NH+](CC2(C)CC2)CC1 ZINC000381487583 346037149 /nfs/dbraw/zinc/03/71/49/346037149.db2.gz KAJNNUFRGFPHPE-UHFFFAOYSA-N 2 0 210.365 2.108 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@@H](C)C2CC2)CC1 ZINC000020189136 187315915 /nfs/dbraw/zinc/31/59/15/187315915.db2.gz JCMMZQOUXPBESL-NSHDSACASA-N 2 0 210.365 2.247 20 0 BEADRP CC[C@H](C)C[N@H+](C)CC[C@@H]1CCC[NH2+]C1 ZINC000051918987 346207392 /nfs/dbraw/zinc/20/73/92/346207392.db2.gz IPCIKTZFFFEEJE-STQMWFEESA-N 2 0 212.381 2.354 20 0 BEADRP CCCCC[N@@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC000366481850 537954664 /nfs/dbraw/zinc/95/46/64/537954664.db2.gz LWBIVBLZERWHBI-ZDUSSCGKSA-N 2 0 210.365 2.204 20 0 BEADRP Cc1cccc(C)c1CN1C[C@H]([NH3+])[C@@H](C)C1 ZINC000235677017 179035768 /nfs/dbraw/zinc/03/57/68/179035768.db2.gz JCKHJDLGGWBNON-JSGCOSHPSA-N 2 0 218.344 2.082 20 0 BEADRP CC[NH+]1CCC([NH2+]CCc2ncccc2C)CC1 ZINC000295049403 346350557 /nfs/dbraw/zinc/35/05/57/346350557.db2.gz PJIPLJPZICCBNJ-UHFFFAOYSA-N 2 0 247.386 2.006 20 0 BEADRP CC1(C)CC[NH+](C[C@@H]2CCCC[NH2+]C2)CC1 ZINC000669378801 537970930 /nfs/dbraw/zinc/97/09/30/537970930.db2.gz NWLVUTACWKBOKG-CYBMUJFWSA-N 2 0 224.392 2.498 20 0 BEADRP CCc1nc(C)cc(NCc2nccn2CC)n1 ZINC000295081174 346357625 /nfs/dbraw/zinc/35/76/25/346357625.db2.gz XTXPIBVUNHFYJB-UHFFFAOYSA-N 2 0 245.330 2.176 20 0 BEADRP Cc1cccc(C[N@H+]2CC[C@@H]([C@@H](C)[NH3+])C2)c1 ZINC000107935072 179080472 /nfs/dbraw/zinc/08/04/72/179080472.db2.gz BPSLYPCHBVNWEJ-TZMCWYRMSA-N 2 0 218.344 2.164 20 0 BEADRP Cc1cccc(C[N@H+]2CC[C@H]([C@@H](C)[NH3+])C2)c1C ZINC000126889038 179082681 /nfs/dbraw/zinc/08/26/81/179082681.db2.gz ZFEKOWXRNGNBGA-HIFRSBDPSA-N 2 0 232.371 2.473 20 0 BEADRP CC(C)[N@H+](CC1CCC1)C[C@@]1(C)CC[NH2+]C1 ZINC000261729286 535047908 /nfs/dbraw/zinc/04/79/08/535047908.db2.gz GZEBEOGEZAKHKO-AWEZNQCLSA-N 2 0 224.392 2.497 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H]1CC[C@H]1C1CCC1 ZINC000574981066 346488346 /nfs/dbraw/zinc/48/83/46/346488346.db2.gz WOFODTDJNBOYJT-QWHCGFSZSA-N 2 0 210.365 2.154 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H]1CC[C@H]1C1CCC1 ZINC000574981067 346488406 /nfs/dbraw/zinc/48/84/06/346488406.db2.gz WOFODTDJNBOYJT-STQMWFEESA-N 2 0 210.365 2.154 20 0 BEADRP CC[C@@H](c1ccncc1)[N@H+](C)CCn1ccnc1 ZINC000162534934 346525988 /nfs/dbraw/zinc/52/59/88/346525988.db2.gz RLMVARGHCRPOIS-AWEZNQCLSA-N 2 0 244.342 2.361 20 0 BEADRP C[C@@H]1CC[C@H](CN)[N@H+](C[C@H]2CCCCO2)[C@H]1C ZINC000641806337 362763897 /nfs/dbraw/zinc/76/38/97/362763897.db2.gz QOZWLPCQGAMIGS-XJFOESAGSA-N 2 0 240.391 2.003 20 0 BEADRP COC[C@H](C)C[NH2+][C@H](CC[NH+](C)C)C(C)(C)C ZINC000187912245 346648720 /nfs/dbraw/zinc/64/87/20/346648720.db2.gz DKOKQKKMLYWWGC-CHWSQXEVSA-N 2 0 244.423 2.225 20 0 BEADRP CCCOc1ccc(CN2CC[C@H]([NH3+])[C@@H]2C)cc1 ZINC000380607921 365841420 /nfs/dbraw/zinc/84/14/20/365841420.db2.gz JFMXPWBBAOLNJY-WFASDCNBSA-N 2 0 248.370 2.397 20 0 BEADRP Cc1cccc(OCC[NH2+][C@@H](C)CCC[NH3+])c1 ZINC000336672572 179168798 /nfs/dbraw/zinc/16/87/98/179168798.db2.gz BFSIGQSCNJYQCY-ZDUSSCGKSA-N 2 0 236.359 2.091 20 0 BEADRP CCC[C@H](C)C[N@@H+]1C[C@@H]2CCC[C@]2([NH3+])C1 ZINC000622004474 370654038 /nfs/dbraw/zinc/65/40/38/370654038.db2.gz PGYLMEFOGKNULV-AVGNSLFASA-N 2 0 210.365 2.236 20 0 BEADRP CC(C)(C)CC[N@@H+]1C[C@H]2CCC[C@]2([NH3+])C1 ZINC000622003474 370654250 /nfs/dbraw/zinc/65/42/50/370654250.db2.gz AGMNJRNFQMNLGX-YPMHNXCESA-N 2 0 210.365 2.236 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@H]1C ZINC000387970945 347138054 /nfs/dbraw/zinc/13/80/54/347138054.db2.gz GBNXKDXUPSABQK-XGFWRYKXSA-N 2 0 224.392 2.351 20 0 BEADRP C[C@H]([NH2+]Cc1ccc(C[NH3+])cc1)c1cccnc1 ZINC000582063403 347157570 /nfs/dbraw/zinc/15/75/70/347157570.db2.gz CPBZSQGDRWUSMP-LBPRGKRZSA-N 2 0 241.338 2.391 20 0 BEADRP CC[NH+]1CCC(CC[NH2+]C[C@@H]2C[C@H]2C)CC1 ZINC000309957766 347205460 /nfs/dbraw/zinc/20/54/60/347205460.db2.gz JIWYGLFVBBGCCR-OCCSQVGLSA-N 2 0 224.392 2.354 20 0 BEADRP Cc1cccc([C@@H](C)[N@@H+]2CCCO[C@H](C[NH3+])C2)c1 ZINC000313352782 179179653 /nfs/dbraw/zinc/17/96/53/179179653.db2.gz LTDOBSNNVSFANF-UKRRQHHQSA-N 2 0 248.370 2.106 20 0 BEADRP CCC[NH+]1CCC([NH2+]C[C@@H]2C[C@H]2CC)CC1 ZINC000388093688 347187329 /nfs/dbraw/zinc/18/73/29/347187329.db2.gz WFGJHWOEOYPCMX-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1cc(C[NH2+]C(C)(C)CCC[NH+](C)C)on1 ZINC000395668449 362793769 /nfs/dbraw/zinc/79/37/69/362793769.db2.gz KRHKQWNGHHYFLA-UHFFFAOYSA-N 2 0 239.363 2.193 20 0 BEADRP C(C[NH+]1C[C@H]2C[NH2+]C[C@@H]2C1)C1CCCCC1 ZINC000085734150 347240564 /nfs/dbraw/zinc/24/05/64/347240564.db2.gz JPLCKFBXJXXXFV-ZIAGYGMSSA-N 2 0 222.376 2.108 20 0 BEADRP CC[C@@H](C)[NH2+]CCC[NH+]1CCC(C)CC1 ZINC000020146330 347410321 /nfs/dbraw/zinc/41/03/21/347410321.db2.gz AGORSHVGMCCSDH-CYBMUJFWSA-N 2 0 212.381 2.497 20 0 BEADRP Cc1ccc(CN(C)[C@@H](C)C[NH3+])cc1C ZINC000020226766 347430965 /nfs/dbraw/zinc/43/09/65/347430965.db2.gz OPRBNDCEPWHJTK-LBPRGKRZSA-N 2 0 206.333 2.082 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]CCOCC1CCC1 ZINC000577214614 365883953 /nfs/dbraw/zinc/88/39/53/365883953.db2.gz PTUSFNQEOBHVDD-ZIAGYGMSSA-N 2 0 240.391 2.053 20 0 BEADRP Cc1ccccc1CC[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000132283950 179266284 /nfs/dbraw/zinc/26/62/84/179266284.db2.gz WWENZJHFZDHLMN-CQSZACIVSA-N 2 0 232.371 2.127 20 0 BEADRP Cc1ccccc1CC[NH2+][C@@H](C)CCC[NH3+] ZINC000309379471 179266721 /nfs/dbraw/zinc/26/67/21/179266721.db2.gz GIAJXFPSIHFLHI-ZDUSSCGKSA-N 2 0 220.360 2.255 20 0 BEADRP Cc1ccccc1CC[NH2+][C@H]1CC[N@@H+](C)C[C@H]1C ZINC000358290462 179267592 /nfs/dbraw/zinc/26/75/92/179267592.db2.gz RLJLOZDBQALZOY-ZBFHGGJFSA-N 2 0 246.398 2.467 20 0 BEADRP Cc1ccccc1CC[NH2+][C@H]1CCC[C@H]1C[NH3+] ZINC000094182727 179267853 /nfs/dbraw/zinc/26/78/53/179267853.db2.gz KSNYARNHFBWAAD-GJZGRUSLSA-N 2 0 232.371 2.255 20 0 BEADRP Cc1nc(CN2CCC([C@@H](C)[NH3+])CC2)cs1 ZINC000082474640 347614955 /nfs/dbraw/zinc/61/49/55/347614955.db2.gz LVGQCVDUFUPVKS-SECBINFHSA-N 2 0 239.388 2.011 20 0 BEADRP Cc1ccccc1C[N@H+]1CC[C@H]2C[NH2+]C[C@H]2CC1 ZINC000335271337 179276618 /nfs/dbraw/zinc/27/66/18/179276618.db2.gz SOBJLAUGNWXNJB-GASCZTMLSA-N 2 0 244.382 2.426 20 0 BEADRP Cc1ccccc1C[C@H](C)[NH2+][C@H]1CCN(C)C1 ZINC000061989165 179291202 /nfs/dbraw/zinc/29/12/02/179291202.db2.gz HNFBPYLOHAUOFT-ZFWWWQNUSA-N 2 0 232.371 2.220 20 0 BEADRP CCS[C@@H]1CCCC[N@H+](C[C@@H]2CC[NH2+]C2)C1 ZINC000592477064 347791361 /nfs/dbraw/zinc/79/13/61/347791361.db2.gz QYLYNUMHGZSOEE-CHWSQXEVSA-N 2 0 242.432 2.204 20 0 BEADRP Cc1ccccc1OCC[NH+]1CCC(C[NH3+])CC1 ZINC000011889101 179311378 /nfs/dbraw/zinc/31/13/78/179311378.db2.gz MJWCSYMLRCEXRR-UHFFFAOYSA-N 2 0 248.370 2.045 20 0 BEADRP CCCC[NH2+][C@H](Cc1ccccc1)[C@@H](C)[NH3+] ZINC000201263790 347880768 /nfs/dbraw/zinc/88/07/68/347880768.db2.gz RJOHFBHGRAQINE-TZMCWYRMSA-N 2 0 220.360 2.335 20 0 BEADRP CC[C@@H](C)[C@H](C)[NH2+]CC1(C)CC[NH2+]CC1 ZINC000319565032 259398486 /nfs/dbraw/zinc/39/84/86/259398486.db2.gz QHDGBIRVHNEZSU-NEPJUHHUSA-N 2 0 212.381 2.400 20 0 BEADRP CC[C@H](C)[C@@H](C)[NH2+]CC1(C)CC[NH2+]CC1 ZINC000319565033 259398518 /nfs/dbraw/zinc/39/85/18/259398518.db2.gz QHDGBIRVHNEZSU-NWDGAFQWSA-N 2 0 212.381 2.400 20 0 BEADRP CCSCC[NH2+]CCC[N@H+](C)CC(C)C ZINC000593645467 347926324 /nfs/dbraw/zinc/92/63/24/347926324.db2.gz JDONKXIGMTYHQC-UHFFFAOYSA-N 2 0 232.437 2.307 20 0 BEADRP Cc1ccccc1[C@H]1CCC[N@H+]1C[C@H](C)[NH3+] ZINC000336405941 179347432 /nfs/dbraw/zinc/34/74/32/179347432.db2.gz DSLRHJMTZVLHKH-GXTWGEPZSA-N 2 0 218.344 2.479 20 0 BEADRP CCOc1ccc([C@@H](C)[NH2+]C2CC[NH2+]CC2)cc1 ZINC000038041299 348038350 /nfs/dbraw/zinc/03/83/50/348038350.db2.gz IIMWOEUUFIHKLW-GFCCVEGCSA-N 2 0 248.370 2.488 20 0 BEADRP C[C@H]1C[C@H](C)C[NH+](CCSCC[NH+](C)C)C1 ZINC000594889278 348122966 /nfs/dbraw/zinc/12/29/66/348122966.db2.gz AJEBHLHOBDLZQB-STQMWFEESA-N 2 0 244.448 2.259 20 0 BEADRP CSCC1(CC[NH2+][C@@H]2CN(C)C[C@@H]2C)CC1 ZINC000594963599 348145589 /nfs/dbraw/zinc/14/55/89/348145589.db2.gz RWULWNYIQQEDSV-NWDGAFQWSA-N 2 0 242.432 2.059 20 0 BEADRP C[C@@H](CSCCF)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000595015916 348186136 /nfs/dbraw/zinc/18/61/36/348186136.db2.gz FEDNYMWKBFDATF-RYUDHWBXSA-N 2 0 248.411 2.009 20 0 BEADRP Cc1cccnc1CC[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000296382288 179371207 /nfs/dbraw/zinc/37/12/07/179371207.db2.gz JQWKJMLGFQLPJP-UONOGXRCSA-N 2 0 247.386 2.005 20 0 BEADRP Cc1cccnc1CC[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000296382287 179371404 /nfs/dbraw/zinc/37/14/04/179371404.db2.gz JQWKJMLGFQLPJP-KGLIPLIRSA-N 2 0 247.386 2.005 20 0 BEADRP Cc1ccncc1C[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000226345473 179486398 /nfs/dbraw/zinc/48/63/98/179486398.db2.gz SDRFCVKOZQHMDG-UHFFFAOYSA-N 2 0 247.386 2.212 20 0 BEADRP CSCC1(CC[NH2+][C@@H]2CCC[C@@H]2C[NH3+])CC1 ZINC000596648943 348604240 /nfs/dbraw/zinc/60/42/40/348604240.db2.gz BOEUWFLMZBKRME-VXGBXAGGSA-N 2 0 242.432 2.237 20 0 BEADRP CSCC1(CC[NH2+][C@H](C)C[C@@H](C)[NH3+])CC1 ZINC000596649691 348605035 /nfs/dbraw/zinc/60/50/35/348605035.db2.gz FEQMKWNHSRQPPL-GHMZBOCLSA-N 2 0 230.421 2.235 20 0 BEADRP CSCC1(CC[NH2+][C@@H](C)C[C@H](C)[NH3+])CC1 ZINC000596649693 348605424 /nfs/dbraw/zinc/60/54/24/348605424.db2.gz FEQMKWNHSRQPPL-QWRGUYRKSA-N 2 0 230.421 2.235 20 0 BEADRP CCSC1(C[NH2+]C2CCC(C[NH3+])CC2)CC1 ZINC000596653518 348606786 /nfs/dbraw/zinc/60/67/86/348606786.db2.gz UXNUQYTWTVHZRU-UHFFFAOYSA-N 2 0 242.432 2.379 20 0 BEADRP CC[NH+]1CCC([NH2+]CC2(C(C)C)CC2)CC1 ZINC000132303044 348874905 /nfs/dbraw/zinc/87/49/05/348874905.db2.gz BLEXZTQQQDUKCE-UHFFFAOYSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)[C@@H]1CCCC[N@@H+]1C[C@H]1CC[NH2+]C1 ZINC000251329704 490214748 /nfs/dbraw/zinc/21/47/48/490214748.db2.gz NYNXRHISTOGBHF-STQMWFEESA-N 2 0 210.365 2.106 20 0 BEADRP C[NH+]1CCC(CC[NH2+]CC2(C)CC2)CC1 ZINC000308936035 349168212 /nfs/dbraw/zinc/16/82/12/349168212.db2.gz KVLFQEUBJMMNOC-UHFFFAOYSA-N 2 0 210.365 2.108 20 0 BEADRP CCc1ccc(C[N@@H+]2C[C@@H](C[NH3+])C[C@H]2C)s1 ZINC000250453236 349171178 /nfs/dbraw/zinc/17/11/78/349171178.db2.gz ZVZJRIJMNSQSRI-GHMZBOCLSA-N 2 0 238.400 2.480 20 0 BEADRP CC1=CC[C@H]([NH2+]CCN(C)C(C)C)CC1 ZINC000380262281 349280719 /nfs/dbraw/zinc/28/07/19/349280719.db2.gz RZJNJNQQZQXZPP-ZDUSSCGKSA-N 2 0 210.365 2.415 20 0 BEADRP CSC1CC[NH+](C[C@@H]2CC[NH2+][C@@H](C)C2)CC1 ZINC000300919444 349429106 /nfs/dbraw/zinc/42/91/06/349429106.db2.gz YOKWRRGPALXOHK-NWDGAFQWSA-N 2 0 242.432 2.202 20 0 BEADRP CC[C@@H]([NH2+]CCCC[NH3+])c1ccc(F)cn1 ZINC000161321801 349421473 /nfs/dbraw/zinc/42/14/73/349421473.db2.gz CVHPCHHKZZKKGR-LLVKDONJSA-N 2 0 225.311 2.000 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H](C)CC1CC1 ZINC000131442183 191015086 /nfs/dbraw/zinc/01/50/86/191015086.db2.gz DVDNHUCXJYKLFI-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+]CC2CC(F)(F)C2)CC1(C)C ZINC000623530051 362949603 /nfs/dbraw/zinc/94/96/03/362949603.db2.gz LAUNDINRMYTWDS-LLVKDONJSA-N 2 0 246.345 2.494 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CCCSC)[C@H](C)C1 ZINC000132473611 191032081 /nfs/dbraw/zinc/03/20/81/191032081.db2.gz JEZDTZNQDHXQGL-NEPJUHHUSA-N 2 0 230.421 2.059 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@@H]2CCC[C@H]3C[C@H]32)CC1 ZINC000304615071 350158598 /nfs/dbraw/zinc/15/85/98/350158598.db2.gz SGCSWCBTGIFUOZ-BFHYXJOUSA-N 2 0 222.376 2.106 20 0 BEADRP CC[N@@H+]1CCC[C@H](C[NH2+]CC2(C)CCC2)C1 ZINC000336771595 538057957 /nfs/dbraw/zinc/05/79/57/538057957.db2.gz USIYZGYEJVTXJZ-CYBMUJFWSA-N 2 0 224.392 2.498 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)C(C)C)C1 ZINC000151105522 191060045 /nfs/dbraw/zinc/06/00/45/191060045.db2.gz NMLVNUJEHIOCNI-STQMWFEESA-N 2 0 212.381 2.352 20 0 BEADRP Cc1ncc(C[NH2+][C@@H](C)CCCC[NH3+])s1 ZINC000336686127 180155034 /nfs/dbraw/zinc/15/50/34/180155034.db2.gz KVVWPKJSWOUPGU-VIFPVBQESA-N 2 0 227.377 2.059 20 0 BEADRP Cc1nccc(NC[C@H](C)[N@@H+]2CCC[C@@H](C)C2)n1 ZINC000266190667 180200031 /nfs/dbraw/zinc/20/00/31/180200031.db2.gz BTMHVRGPQNQWKH-NEPJUHHUSA-N 2 0 248.374 2.317 20 0 BEADRP Cc1ncccc1N[C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000128062224 180227858 /nfs/dbraw/zinc/22/78/58/180227858.db2.gz GHJCZCWODRTUHJ-PWSUYJOCSA-N 2 0 219.332 2.285 20 0 BEADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+]Cc2ccn(C)c2)C1 ZINC000125013983 191080169 /nfs/dbraw/zinc/08/01/69/191080169.db2.gz VNBPPOWUMQAXHP-CQSZACIVSA-N 2 0 249.402 2.235 20 0 BEADRP C[C@H](C[NH2+]CCC[NH+](C)C)C(C)(C)C ZINC000125774616 490441433 /nfs/dbraw/zinc/44/14/33/490441433.db2.gz RRXVXMAZLNQTOG-LLVKDONJSA-N 2 0 200.370 2.210 20 0 BEADRP C[C@H](CCc1ccccc1)[NH+]1C[C@H]2C[NH2+]C[C@@H]2C1 ZINC000108265952 350347578 /nfs/dbraw/zinc/34/75/78/350347578.db2.gz DGNQKOXZPNHBLQ-FVQBIDKESA-N 2 0 244.382 2.159 20 0 BEADRP C[C@H](CC1CC1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000069663204 350376449 /nfs/dbraw/zinc/37/64/49/350376449.db2.gz VFAFQMCGAVQHBJ-NDNKKMJESA-N 2 0 222.376 2.390 20 0 BEADRP Cc1ncsc1C[NH2+]C[C@@H]1CCC[C@@H]([NH3+])C1 ZINC000070838277 180320759 /nfs/dbraw/zinc/32/07/59/180320759.db2.gz PVOXDAFCPDJUEA-GHMZBOCLSA-N 2 0 239.388 2.059 20 0 BEADRP Cc1ncsc1C[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000309423019 180320861 /nfs/dbraw/zinc/32/08/61/180320861.db2.gz BGKZPBWNXWWLRN-NSHDSACASA-N 2 0 239.388 2.073 20 0 BEADRP CCC(CC)(CC)C[NH2+]C[C@H](C)C[NH3+] ZINC000391130394 350465916 /nfs/dbraw/zinc/46/59/16/350465916.db2.gz GBSRHPWICBAIEA-LLVKDONJSA-N 2 0 200.370 2.387 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623538881 362958582 /nfs/dbraw/zinc/95/85/82/362958582.db2.gz YJKFTNWRIBNSHD-AGIUHOORSA-N 2 0 224.392 2.495 20 0 BEADRP CC[C@@](C)(C[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1)OC ZINC000623538713 362958776 /nfs/dbraw/zinc/95/87/76/362958776.db2.gz RIBKIFNNWZBMRI-OCCSQVGLSA-N 2 0 242.407 2.264 20 0 BEADRP CC[C@@H](C)C[NH2+]CCC1CC[NH+](C)CC1 ZINC000093067171 259414346 /nfs/dbraw/zinc/41/43/46/259414346.db2.gz KKXQGVUGXWIIDT-GFCCVEGCSA-N 2 0 212.381 2.354 20 0 BEADRP CC[NH+](CC)CCSCC1CC[NH2+]CC1 ZINC000059711719 350497612 /nfs/dbraw/zinc/49/76/12/350497612.db2.gz INEQOTLCYXRBNM-UHFFFAOYSA-N 2 0 230.421 2.061 20 0 BEADRP CCC(CC)(CC)C[NH2+]CC1([NH3+])CCOCC1 ZINC000391245173 350504692 /nfs/dbraw/zinc/50/46/92/350504692.db2.gz UECNHRPUZKVAJK-UHFFFAOYSA-N 2 0 242.407 2.300 20 0 BEADRP C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CCCC1 ZINC000054628034 1172130002 /nfs/dbraw/zinc/13/00/02/1172130002.db2.gz DAJURWIMSNZEPR-AGUYFDCRSA-N 2 0 222.376 2.391 20 0 BEADRP CC[C@H]1CCCC[C@@H]1[NH2+]CCN(C)CC ZINC000070558517 350537875 /nfs/dbraw/zinc/53/78/75/350537875.db2.gz SBTNRNRGEAEKCR-STQMWFEESA-N 2 0 212.381 2.497 20 0 BEADRP C[C@H]([NH2+][C@H]1CCCC1(C)C)[C@@H]1CCC[NH2+]1 ZINC000400656595 362963270 /nfs/dbraw/zinc/96/32/70/362963270.db2.gz RAVSBGBICMONQP-SRVKXCTJSA-N 2 0 210.365 2.295 20 0 BEADRP CC(C)=CC[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000228840968 191107999 /nfs/dbraw/zinc/10/79/99/191107999.db2.gz AWPLBJJNGHPMOS-MCIONIFRSA-N 2 0 222.376 2.463 20 0 BEADRP CC(C)C[NH+]1CCC([C@H]2CCC[NH2+]2)CC1 ZINC000063197522 350575498 /nfs/dbraw/zinc/57/54/98/350575498.db2.gz YYUXEEAWQCIGRK-CYBMUJFWSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H](C)c1ccccc1 ZINC000422742903 192469343 /nfs/dbraw/zinc/46/93/43/192469343.db2.gz HFMFHXXJCVJXHV-SRVKXCTJSA-N 2 0 206.333 2.463 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+]Cc1ccc(Cl)s1 ZINC000070600381 350546823 /nfs/dbraw/zinc/54/68/23/350546823.db2.gz RGBUMTAHRSIESY-ZETCQYMHSA-N 2 0 218.753 2.086 20 0 BEADRP CC[N@@H+]1CCC[C@@H]1CNc1cc[nH+]c(C)c1 ZINC000229560668 350579827 /nfs/dbraw/zinc/57/98/27/350579827.db2.gz LVQWOMDEGLFNRV-CYBMUJFWSA-N 2 0 219.332 2.286 20 0 BEADRP CCO[C@H]1C[C@@H]([NH2+][C@@H]2CC[N@H+](C)C(C)(C)C2)C1 ZINC000623546796 362968513 /nfs/dbraw/zinc/96/85/13/362968513.db2.gz SKCAYAIUBGUULX-UPJWGTAASA-N 2 0 240.391 2.016 20 0 BEADRP Cc1ncn(Cc2cnc3ccccn23)c1C ZINC000177304318 365992453 /nfs/dbraw/zinc/99/24/53/365992453.db2.gz MWAORBNEDJLUES-UHFFFAOYSA-N 2 0 226.283 2.196 20 0 BEADRP C[C@@H]1C[C@@H](C[N@H+](C)C2CC(C)(C)C2)CC[NH2+]1 ZINC000334623374 350738174 /nfs/dbraw/zinc/73/81/74/350738174.db2.gz UHPKNIHBNHWLAC-NEPJUHHUSA-N 2 0 224.392 2.495 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000336683717 350919796 /nfs/dbraw/zinc/91/97/96/350919796.db2.gz ZIJBGEABSBEWRO-AVGNSLFASA-N 2 0 222.376 2.391 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@@H]1C[C@@H](C)[C@@H]1C ZINC000336711665 191126422 /nfs/dbraw/zinc/12/64/22/191126422.db2.gz UNVDTPIAWDIJFD-FRRDWIJNSA-N 2 0 212.381 2.351 20 0 BEADRP C[C@@H](CCc1ccco1)[NH2+]CCC[NH2+]C1CC1 ZINC000382576734 350881385 /nfs/dbraw/zinc/88/13/85/350881385.db2.gz GNTVSXQZTFNTOA-LBPRGKRZSA-N 2 0 236.359 2.332 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H]2CCCC2(C)C)C1 ZINC000086856770 351037884 /nfs/dbraw/zinc/03/78/84/351037884.db2.gz QNAAKZYHTIAQJO-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)C1CCC1 ZINC000252715906 538100662 /nfs/dbraw/zinc/10/06/62/538100662.db2.gz XAYYSTZSAJEYPP-YUTCNCBUSA-N 2 0 222.376 2.391 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@@H]([NH3+])C1)C1CCCC1 ZINC000088162889 351671742 /nfs/dbraw/zinc/67/17/42/351671742.db2.gz SMPRYMGHYAGJJI-UHTWSYAYSA-N 2 0 210.365 2.425 20 0 BEADRP CCC[C@@H](C[NH+]1CCC(C[NH+](C)C)CC1)OC ZINC000637906714 351776432 /nfs/dbraw/zinc/77/64/32/351776432.db2.gz CXWLMZHPDHPICR-AWEZNQCLSA-N 2 0 242.407 2.075 20 0 BEADRP CCN1CCC([N@H+](C)C[C@@](C)(CC)OC)CC1 ZINC000637886898 351756690 /nfs/dbraw/zinc/75/66/90/351756690.db2.gz MGWZPFMPDAIEJJ-CQSZACIVSA-N 2 0 242.407 2.218 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CCC[C@@H]2C[NH3+])cc1F ZINC000414792922 351772979 /nfs/dbraw/zinc/77/29/79/351772979.db2.gz JIWLQKJZWVLZOB-TZMCWYRMSA-N 2 0 236.334 2.351 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H](C)CCCC[NH3+])o1 ZINC000577840086 366078822 /nfs/dbraw/zinc/07/88/22/366078822.db2.gz IZJWIAUAZVLPKU-NSHDSACASA-N 2 0 224.348 2.238 20 0 BEADRP CC(C)[NH2+]C1CC[NH+](CCC[C@@H]2CCO2)CC1 ZINC000638002322 351878221 /nfs/dbraw/zinc/87/82/21/351878221.db2.gz XSHQRLUALJPQLR-CQSZACIVSA-N 2 0 240.391 2.018 20 0 BEADRP CCC[C@@H](C[N@H+](C)CC1CC[NH+](C)CC1)OC ZINC000638028268 351907486 /nfs/dbraw/zinc/90/74/86/351907486.db2.gz DPOSXMAZAKSWBV-AWEZNQCLSA-N 2 0 242.407 2.075 20 0 BEADRP CC(C)C[NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000169231699 535170748 /nfs/dbraw/zinc/17/07/48/535170748.db2.gz ACTKCCVGUYWYCS-OLZOCXBDSA-N 2 0 204.317 2.377 20 0 BEADRP CCSCCC[NH2+][C@H](C)C1CC[NH+](C)CC1 ZINC000300901079 363114855 /nfs/dbraw/zinc/11/48/55/363114855.db2.gz IXOQKZDDDLNHRK-GFCCVEGCSA-N 2 0 244.448 2.450 20 0 BEADRP CC[C@@H](C)[C@H](C[NH2+]CCC[N@H+](C)C(C)C)OC ZINC000638337033 352155378 /nfs/dbraw/zinc/15/53/78/352155378.db2.gz BOUGLVCJNMSXDN-KGLIPLIRSA-N 2 0 244.423 2.367 20 0 BEADRP CCC[C@@H](C[NH2+]C[C@H]1CC[N@H+](CCC)C1)OC ZINC000638410036 352217584 /nfs/dbraw/zinc/21/75/84/352217584.db2.gz TYLJAJMWWOJSKD-KGLIPLIRSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)C[C@H](C)C[NH+]1CCC(C[NH3+])CC1 ZINC000300739518 187642488 /nfs/dbraw/zinc/64/24/88/187642488.db2.gz ARIDMDFWJUXKNR-LBPRGKRZSA-N 2 0 212.381 2.339 20 0 BEADRP CC[N@@H+]1CCC[C@H](C[NH2+]C[C@@H]2C[C@H]3C[C@H]3C2)C1 ZINC000638452124 352262293 /nfs/dbraw/zinc/26/22/93/352262293.db2.gz VEEOBYDUOOGSTM-APIJFGDWSA-N 2 0 236.403 2.354 20 0 BEADRP C[C@H]1C[N@H+](Cc2cccc3c2CCC3)C[C@H]1C[NH3+] ZINC000630074881 363158597 /nfs/dbraw/zinc/15/85/97/363158597.db2.gz BWSIEDPMSRPRGH-SWLSCSKDSA-N 2 0 244.382 2.202 20 0 BEADRP Cc1ccsc1C[NH2+]C[C@H]1CCC[N@@H+](C)C1 ZINC000044535261 352352036 /nfs/dbraw/zinc/35/20/36/352352036.db2.gz HUXGGGFSKHVCBI-GFCCVEGCSA-N 2 0 238.400 2.488 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+]C[C@H]1CCC[C@@H](C)C1 ZINC000414955621 352374666 /nfs/dbraw/zinc/37/46/66/352374666.db2.gz MIMRHDPVBFORFV-UPJWGTAASA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H]([NH2+]CCC1CC[NH+](C)CC1)[C@@H]1CC1(F)F ZINC000638567348 352390772 /nfs/dbraw/zinc/39/07/72/352390772.db2.gz ZKTLCWNZVIMRFY-PWSUYJOCSA-N 2 0 246.345 2.352 20 0 BEADRP C[C@H]([NH2+]CCC1CC[NH+](C)CC1)[C@@H]1CC1(F)F ZINC000638567347 352390777 /nfs/dbraw/zinc/39/07/77/352390777.db2.gz ZKTLCWNZVIMRFY-JQWIXIFHSA-N 2 0 246.345 2.352 20 0 BEADRP CCCCN(C)CC[NH2+][C@H]1CS[C@@H](C)C1 ZINC000638586884 352418585 /nfs/dbraw/zinc/41/85/85/352418585.db2.gz XBPJMNSXWSSBKJ-NWDGAFQWSA-N 2 0 230.421 2.202 20 0 BEADRP CCCCN(C)CC[NH2+][C@@H]1CS[C@H](C)C1 ZINC000638586883 352418596 /nfs/dbraw/zinc/41/85/96/352418596.db2.gz XBPJMNSXWSSBKJ-NEPJUHHUSA-N 2 0 230.421 2.202 20 0 BEADRP CCOc1ccccc1C[N@@H+]1CCC[C@H](C[NH3+])C1 ZINC000044527770 352654377 /nfs/dbraw/zinc/65/43/77/352654377.db2.gz LWXGUYOELPWASK-CYBMUJFWSA-N 2 0 248.370 2.256 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@H](C[NH3+])C2)s1 ZINC000044527730 352654921 /nfs/dbraw/zinc/65/49/21/352654921.db2.gz XLGIBSYEMBNIGU-LLVKDONJSA-N 2 0 224.373 2.227 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H]1CCC[C@H]2C[C@H]21 ZINC000304644198 352736269 /nfs/dbraw/zinc/73/62/69/352736269.db2.gz XHFIRKZAOWCESN-MJBXVCDLSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]C2CCC([NH+](C)C)CC2)CCO1 ZINC000334217118 352817921 /nfs/dbraw/zinc/81/79/21/352817921.db2.gz CRQOQLCAKZPSIV-AHPWVWPOSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@H](F)CC[N@@H+]1CC[C@]2(C1)CCC[NH+](C)C2 ZINC000334219518 352821259 /nfs/dbraw/zinc/82/12/59/352821259.db2.gz FUJHWHWWFBNTFR-QWHCGFSZSA-N 2 0 228.355 2.152 20 0 BEADRP C[N@H+](CC1CCC1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000334260892 352893223 /nfs/dbraw/zinc/89/32/23/352893223.db2.gz SHTTZGFMMLUXDU-PBWFPOADSA-N 2 0 222.376 2.344 20 0 BEADRP C(C[NH+]1CCC([NH+]2CCCC2)CC1)C1CC1 ZINC000336661776 188010979 /nfs/dbraw/zinc/01/09/79/188010979.db2.gz AFWWRNBQDSEZLK-UHFFFAOYSA-N 2 0 222.376 2.347 20 0 BEADRP CC(C)[N@@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000336650894 188011371 /nfs/dbraw/zinc/01/13/71/188011371.db2.gz UFIONESPTZCDTM-CYBMUJFWSA-N 2 0 210.365 2.059 20 0 BEADRP CCCCOCC[NH+]1CCC(C[NH+](C)C)CC1 ZINC000341178357 188044279 /nfs/dbraw/zinc/04/42/79/188044279.db2.gz VIZCGVQWGDMNBO-UHFFFAOYSA-N 2 0 242.407 2.077 20 0 BEADRP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+][C@@H]2CCOC2(C)C)C1 ZINC000340254708 188035411 /nfs/dbraw/zinc/03/54/11/188035411.db2.gz FKYLTDAEYWDBMA-JHJVBQTASA-N 2 0 240.391 2.016 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]CC1CCC(C)CC1 ZINC000414846775 259434091 /nfs/dbraw/zinc/43/40/91/259434091.db2.gz VEORWQPAWOGFJI-CPCZMJQVSA-N 2 0 212.381 2.258 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]C[C@H]2CCC=CO2)CC1 ZINC000050267749 188045948 /nfs/dbraw/zinc/04/59/48/188045948.db2.gz ZRTWOPNPBSJQMO-CQSZACIVSA-N 2 0 238.375 2.142 20 0 BEADRP CC(=O)Nc1cccc([C@@H](C)[NH2+]CCCC[NH3+])c1 ZINC000037715172 358476645 /nfs/dbraw/zinc/47/66/45/358476645.db2.gz ZBOMHZDOOLUWDL-LLVKDONJSA-N 2 0 249.358 2.035 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC=CCC1)C1CC[NH+](C)CC1 ZINC000084066306 538113084 /nfs/dbraw/zinc/11/30/84/538113084.db2.gz XVJKEFSSQMZRQP-GXTWGEPZSA-N 2 0 222.376 2.415 20 0 BEADRP CC[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)C2CCC2)C1 ZINC000336768280 353279233 /nfs/dbraw/zinc/27/92/33/353279233.db2.gz QSIOFSOHALNVRB-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)C[C@H]1CCCCC[N@@H+]1CCOCC[NH3+] ZINC000357094040 188239485 /nfs/dbraw/zinc/23/94/85/188239485.db2.gz XVQUGLSXBVHAAC-CQSZACIVSA-N 2 0 242.407 2.252 20 0 BEADRP C[C@@H]1CCC[C@H](C[N@@H+]2CC[C@@H]([NH3+])[C@H](C)C2)C1 ZINC000251718415 353287810 /nfs/dbraw/zinc/28/78/10/353287810.db2.gz ILBOPLDSZVRMND-YIYPIFLZSA-N 2 0 224.392 2.482 20 0 BEADRP CC[C@@H]1CCC[N@H+](C[C@H]2CCC[NH2+]C2)CC1 ZINC000251834495 353292950 /nfs/dbraw/zinc/29/29/50/353292950.db2.gz QFISPLDUTYATLE-KGLIPLIRSA-N 2 0 224.392 2.498 20 0 BEADRP C(C[N@@H+]1[C@H]2CC[C@@H]1CCC2)C1CC[NH2+]CC1 ZINC000336538764 188256696 /nfs/dbraw/zinc/25/66/96/188256696.db2.gz QYDIDIKAFDGSCD-OKILXGFUSA-N 2 0 222.376 2.393 20 0 BEADRP C[C@H]1C[C@H](C[NH3+])C[N@@H+]1C[C@H]1CCC[C@@H](C)C1 ZINC000251970280 353294360 /nfs/dbraw/zinc/29/43/60/353294360.db2.gz YCWOXAIQSXHGFV-ZOBORPQBSA-N 2 0 224.392 2.482 20 0 BEADRP CC(C)C[C@@H](C)[NH2+][C@H](C)Cn1ccnc1 ZINC000037157789 188279634 /nfs/dbraw/zinc/27/96/34/188279634.db2.gz NDPSPFHHUJWEAY-VXGBXAGGSA-N 2 0 209.337 2.296 20 0 BEADRP CC(C)[C@H](C)C[NH2+][C@@H](C)CCCC[NH3+] ZINC000308637288 188340147 /nfs/dbraw/zinc/34/01/47/188340147.db2.gz BKDBDQRAXGTSCX-NEPJUHHUSA-N 2 0 200.370 2.386 20 0 BEADRP CCCC[C@H](CC)C[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC000085283177 538116310 /nfs/dbraw/zinc/11/63/10/538116310.db2.gz JKDGBULEUOPIDQ-MELADBBJSA-N 2 0 224.392 2.354 20 0 BEADRP C(C[NH2+]C1CC2(CCC2)C1)C[NH+]1CCCC1 ZINC000309340072 188344922 /nfs/dbraw/zinc/34/49/22/188344922.db2.gz KWJUBNHJYHQDPQ-UHFFFAOYSA-N 2 0 222.376 2.395 20 0 BEADRP CC(C)C[C@H](C[NH2+][C@@H](C)CCCC[NH3+])N(C)C ZINC000310552186 188348980 /nfs/dbraw/zinc/34/89/80/188348980.db2.gz UWEGRDTXLQQMRJ-UONOGXRCSA-N 2 0 243.439 2.070 20 0 BEADRP C[N@H+](CC1CC1)C[C@H]1CC[NH+](CC2CC2)C1 ZINC000336710416 188358799 /nfs/dbraw/zinc/35/87/99/188358799.db2.gz YYVXWPOAHDMOOT-CQSZACIVSA-N 2 0 222.376 2.060 20 0 BEADRP C[N@H+](CCCCCF)CCCn1ccnc1 ZINC000284060948 188386028 /nfs/dbraw/zinc/38/60/28/188386028.db2.gz KDTFYJYJYZKWEP-UHFFFAOYSA-N 2 0 227.327 2.345 20 0 BEADRP CC[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH3+] ZINC000252368453 363230232 /nfs/dbraw/zinc/23/02/32/363230232.db2.gz OXJYWERKFNGMGY-UONOGXRCSA-N 2 0 218.344 2.246 20 0 BEADRP CC(C)C[N@H+](C[C@H]1CC[NH2+][C@@H](C)C1)C1CC1 ZINC000232709557 353760193 /nfs/dbraw/zinc/76/01/93/353760193.db2.gz OTNOTEOISXTQPE-STQMWFEESA-N 2 0 224.392 2.495 20 0 BEADRP Fc1ccccc1C[N@@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000082554243 181011437 /nfs/dbraw/zinc/01/14/37/181011437.db2.gz DCPDPAUTFJVXIF-UHFFFAOYSA-N 2 0 248.345 2.401 20 0 BEADRP C[C@@H](c1cccnc1)N(C)C[C@@H]1CCC[NH2+]C1 ZINC000220425892 353836403 /nfs/dbraw/zinc/83/64/03/353836403.db2.gz XUEFFTWWMYPORX-QWHCGFSZSA-N 2 0 233.359 2.074 20 0 BEADRP CCC[C@H](C[N@H+](C)CCC[NH+]1CCCC1)OC ZINC000639132483 353842015 /nfs/dbraw/zinc/84/20/15/353842015.db2.gz OXMHJDXAIAXNLM-CQSZACIVSA-N 2 0 242.407 2.219 20 0 BEADRP CCC[N@H+](CC1CC1)C[C@H]1CC[NH2+][C@@H](C)C1 ZINC000233035089 353788561 /nfs/dbraw/zinc/78/85/61/353788561.db2.gz REMWBNMXUDUQCZ-JSGCOSHPSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1C[C@H]1C[N@H+](C)CCC[NH+]1CCCC1 ZINC000343614029 353933700 /nfs/dbraw/zinc/93/37/00/353933700.db2.gz IPDSJZKCPKORNS-STQMWFEESA-N 2 0 210.365 2.060 20 0 BEADRP Cc1c[nH+]ccc1N1CCC(C[NH+](C)C)CC1 ZINC000334549103 353988380 /nfs/dbraw/zinc/98/83/80/353988380.db2.gz YAVJUADNMMNRNC-UHFFFAOYSA-N 2 0 233.359 2.168 20 0 BEADRP C[C@H](CCc1ccccc1)[NH2+]C1CC[NH2+]CC1 ZINC000038040708 358482476 /nfs/dbraw/zinc/48/24/76/358482476.db2.gz OXLJIAUWRDGAGR-CYBMUJFWSA-N 2 0 232.371 2.349 20 0 BEADRP CO[C@@H](C[N@H+](C)CCC[NH+](C)C)C1CCCC1 ZINC000639167267 354050195 /nfs/dbraw/zinc/05/01/95/354050195.db2.gz CGAAXMGVNXCXBS-AWEZNQCLSA-N 2 0 242.407 2.075 20 0 BEADRP c1ccc(C[N@@H+]2CC[C@@H]3[NH2+]CCC[C@H]3C2)cc1 ZINC000252476224 363334063 /nfs/dbraw/zinc/33/40/63/363334063.db2.gz MAIRFDXCHHKPFG-GJZGRUSLSA-N 2 0 230.355 2.261 20 0 BEADRP CC[C@H](C)[C@H](C[N@H+](CC)CCC[NH+](C)C)OC ZINC000639175023 354190680 /nfs/dbraw/zinc/19/06/80/354190680.db2.gz GNOBGTUDKUDURI-KBPBESRZSA-N 2 0 244.423 2.321 20 0 BEADRP CCC[C@@H](C)C[N@H+](C)[C@@H]1CCC[NH2+]CC1 ZINC000231463797 363344946 /nfs/dbraw/zinc/34/49/46/363344946.db2.gz KPBLXDDUQMBHBY-CHWSQXEVSA-N 2 0 212.381 2.497 20 0 BEADRP CCC[C@H](C[N@H+](C)[C@H]1CCN(C)C[C@H]1C)OC ZINC000639180423 354278602 /nfs/dbraw/zinc/27/86/02/354278602.db2.gz WSDMMQOMWOFQNG-MCIONIFRSA-N 2 0 242.407 2.074 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C[C@H]2CCCN2C)C[C@H]1C ZINC000623634621 366202389 /nfs/dbraw/zinc/20/23/89/366202389.db2.gz MZSQXECDNBZURN-AAVRWANBSA-N 2 0 224.392 2.495 20 0 BEADRP C(CC1CCCCC1)[NH2+]C[C@@H]1CCC[NH2+]1 ZINC000232563427 363375169 /nfs/dbraw/zinc/37/51/69/363375169.db2.gz CRELUTOWZINROL-ZDUSSCGKSA-N 2 0 210.365 2.298 20 0 BEADRP COc1cc(C)ccc1C[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000578083162 366231548 /nfs/dbraw/zinc/23/15/48/366231548.db2.gz NMPHJPFFPNPTTR-KBPBESRZSA-N 2 0 248.370 2.363 20 0 BEADRP CC1(C)CCCN[C@H]1C[NH2+]C1CCCC1 ZINC000232981143 363390481 /nfs/dbraw/zinc/39/04/81/363390481.db2.gz RMVBBGMJKONWEV-LBPRGKRZSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]([NH3+])c1ccc(NC2CCC([NH3+])CC2)cc1 ZINC000335174739 354941520 /nfs/dbraw/zinc/94/15/20/354941520.db2.gz DFDXQYJPCCXBSK-JKDOVBDQSA-N 2 0 233.359 2.388 20 0 BEADRP Cc1csc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)c1 ZINC000335164406 354951953 /nfs/dbraw/zinc/95/19/53/354951953.db2.gz SFYGCZRLTHKBMO-FOSCPWQOSA-N 2 0 236.384 2.429 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21)[C@@H]1CCOC1 ZINC000166059217 354954753 /nfs/dbraw/zinc/95/47/53/354954753.db2.gz MUOOIXVAXABZBU-IDTSFGKNSA-N 2 0 246.354 2.146 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21)[C@H]1CCOC1 ZINC000166059447 354954766 /nfs/dbraw/zinc/95/47/66/354954766.db2.gz MUOOIXVAXABZBU-LWWSYDQCSA-N 2 0 246.354 2.146 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1)[C@@H]1CCCO1 ZINC000346559515 354968518 /nfs/dbraw/zinc/96/85/18/354968518.db2.gz OOEUZKWYGZFRKV-DGAVXFQQSA-N 2 0 240.391 2.016 20 0 BEADRP [NH3+][C@H]1CCCCC[C@H]1[NH2+]CC1CCCC1 ZINC000335197963 355031170 /nfs/dbraw/zinc/03/11/70/355031170.db2.gz RIKKWLSXBRQXPC-QWHCGFSZSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@@H]1C[C@H]1C[N@@H+]1CCCC12CC[NH+](C)CC2 ZINC000335204525 355039701 /nfs/dbraw/zinc/03/97/01/355039701.db2.gz NZPLRDGYJWCREB-OLZOCXBDSA-N 2 0 222.376 2.203 20 0 BEADRP CC[C@H]1C[C@H](C[N@H+](C)CC(C)(C)C[NH3+])CCO1 ZINC000346679945 355011014 /nfs/dbraw/zinc/01/10/14/355011014.db2.gz MKZUBORYWRXTRF-OLZOCXBDSA-N 2 0 242.407 2.108 20 0 BEADRP CCCCOCC[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@@H]1C ZINC000040506804 358493878 /nfs/dbraw/zinc/49/38/78/358493878.db2.gz IFZFBRCSFFJZCR-MELADBBJSA-N 2 0 242.407 2.121 20 0 BEADRP CCCCOCC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000040506697 358494209 /nfs/dbraw/zinc/49/42/09/358494209.db2.gz XOILBOAVUPQEOE-AGUYFDCRSA-N 2 0 240.391 2.018 20 0 BEADRP CO[C@H](C)[C@H](C)[NH2+]CC[C@H](C)[NH+]1CCCCC1 ZINC000346869030 355158076 /nfs/dbraw/zinc/15/80/76/355158076.db2.gz KDXPHBUAKQZPEO-MELADBBJSA-N 2 0 242.407 2.264 20 0 BEADRP C1CC1[C@@H]1CCC[C@@H]([NH2+]C2CC[NH2+]CC2)C1 ZINC000335252440 355207483 /nfs/dbraw/zinc/20/74/83/355207483.db2.gz PHGDWRJMMREHRO-TZMCWYRMSA-N 2 0 222.376 2.297 20 0 BEADRP c1ccc(C2([NH2+]C[C@@H]3CCC[NH2+]C3)CC2)cc1 ZINC000346964722 355172142 /nfs/dbraw/zinc/17/21/42/355172142.db2.gz BROSSGKZCKNEFE-CYBMUJFWSA-N 2 0 230.355 2.265 20 0 BEADRP C[C@@H]1CCC[C@@H](C)[N@H+](C[C@H]2CCC[NH2+]C2)C1 ZINC000346965931 355173025 /nfs/dbraw/zinc/17/30/25/355173025.db2.gz CELFRZSTANHTBY-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1ccccc1C[NH2+][C@H]1CC[NH2+]CC[C@@H]1C ZINC000335256231 355189490 /nfs/dbraw/zinc/18/94/90/355189490.db2.gz FDJAELUVTCOHTB-ZFWWWQNUSA-N 2 0 232.371 2.473 20 0 BEADRP C[C@H]1CC[N@H+](CC2CC[NH2+]CC2)C[C@H](C)C1 ZINC000346989553 355189617 /nfs/dbraw/zinc/18/96/17/355189617.db2.gz RTLYOWSUIVNMQK-QWHCGFSZSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCc2c1cccc2F)C1C[NH2+]C1 ZINC000335257369 355193480 /nfs/dbraw/zinc/19/34/80/355193480.db2.gz GDJJQVROGOYNKV-OTYXRUKQSA-N 2 0 234.318 2.011 20 0 BEADRP C[C@@H]1CC[C@]2(CC[N@H+](C[C@@H]3CCC[NH2+]C3)C2)C1 ZINC000347000065 355196851 /nfs/dbraw/zinc/19/68/51/355196851.db2.gz YKRJHKIOIJPCIJ-KFWWJZLASA-N 2 0 236.403 2.498 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CCCC[N@H+](C)C2CC2)CS1 ZINC000639244744 355248554 /nfs/dbraw/zinc/24/85/54/355248554.db2.gz OQLHIIMSVQKORD-RYUDHWBXSA-N 2 0 242.432 2.344 20 0 BEADRP CC[C@H](C[N@H+](C)[C@H]1CC[NH+](CC)C[C@@H]1C)OC ZINC000412978753 191349072 /nfs/dbraw/zinc/34/90/72/191349072.db2.gz RAENIUXGXWCRLM-MJBXVCDLSA-N 2 0 242.407 2.074 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CC[C@H]2CCC[N@H+](C)C2)CS1 ZINC000639256768 355300136 /nfs/dbraw/zinc/30/01/36/355300136.db2.gz FQTDWRMVEBMJDF-JHJVBQTASA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)c1ccncc1 ZINC000414168738 191451804 /nfs/dbraw/zinc/45/18/04/191451804.db2.gz ALBZJVPCLYPJRD-KGLIPLIRSA-N 2 0 247.386 2.464 20 0 BEADRP C[NH+]1CCC2(CCC[N@@H+]2Cc2ccco2)CC1 ZINC000335792388 355445295 /nfs/dbraw/zinc/44/52/95/355445295.db2.gz OAKVNOPCVWZXBN-UHFFFAOYSA-N 2 0 234.343 2.340 20 0 BEADRP CC(C)[C@](C)(O)C[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000261569440 535285522 /nfs/dbraw/zinc/28/55/22/535285522.db2.gz JUHMPSMLHJAUNA-RBSFLKMASA-N 2 0 248.370 2.128 20 0 BEADRP Cc1ccc(F)cc1C[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000414827164 191587244 /nfs/dbraw/zinc/58/72/44/191587244.db2.gz GSWMLTYQABSUEY-LBPRGKRZSA-N 2 0 236.334 2.223 20 0 BEADRP C[C@H](CC1CC1)[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000414844974 191598544 /nfs/dbraw/zinc/59/85/44/191598544.db2.gz RZPFZROTQMQALF-YPMHNXCESA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000414844973 191598677 /nfs/dbraw/zinc/59/86/77/191598677.db2.gz RZPFZROTQMQALF-WCQYABFASA-N 2 0 210.365 2.154 20 0 BEADRP CC[C@H](C)C[C@H](CC)[NH2+]CCC[NH2+]C ZINC000414859349 191604015 /nfs/dbraw/zinc/60/40/15/191604015.db2.gz MOIOYRMSZGAQHK-RYUDHWBXSA-N 2 0 200.370 2.400 20 0 BEADRP C[C@@H]([NH2+]Cc1cccs1)[C@H]1CCC[NH2+]C1 ZINC000414860812 191604506 /nfs/dbraw/zinc/60/45/06/191604506.db2.gz VVIXUENGQCTBEX-MNOVXSKESA-N 2 0 224.373 2.226 20 0 BEADRP C[C@H](CC1CC1)[NH2+]C[C@@H]1CCC[C@@H]([NH3+])C1 ZINC000415003602 191646694 /nfs/dbraw/zinc/64/66/94/191646694.db2.gz NIWGKIKHJYVGQD-RAIGVLPGSA-N 2 0 210.365 2.282 20 0 BEADRP CCCC[C@H](COC)[NH2+]C[C@H]1CCC[C@@H]([NH3+])C1 ZINC000415005113 191647596 /nfs/dbraw/zinc/64/75/96/191647596.db2.gz OYBOGVUARCLIBU-BFHYXJOUSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CC[C@@H](C[NH3+])C1 ZINC000415051891 191653619 /nfs/dbraw/zinc/65/36/19/191653619.db2.gz ZZAXNKSEWHZXJU-NDBYEHHHSA-N 2 0 210.365 2.282 20 0 BEADRP Cc1ccc(CCC[NH2+][C@@H](C)CCC[NH3+])cn1 ZINC000415020089 191654027 /nfs/dbraw/zinc/65/40/27/191654027.db2.gz IXUUYRFNJBBLLJ-LBPRGKRZSA-N 2 0 235.375 2.040 20 0 BEADRP C[NH2+]Cc1cccc(N[C@@H](C)C[C@H]2CCC[NH2+]2)c1 ZINC000414869480 191608344 /nfs/dbraw/zinc/60/83/44/191608344.db2.gz QXCUYJXLRYQRHH-GXTWGEPZSA-N 2 0 247.386 2.349 20 0 BEADRP Cc1cc(C[NH2+][C@@H]2CC[C@@H](C[NH3+])C2)ccc1F ZINC000415027012 191656550 /nfs/dbraw/zinc/65/65/50/191656550.db2.gz APEMPNHTHVSNKN-DGCLKSJQSA-N 2 0 236.334 2.351 20 0 BEADRP C[C@H](CCCC(F)(F)F)[NH2+][C@H]1CC[NH2+]C1 ZINC000414881436 191613478 /nfs/dbraw/zinc/61/34/78/191613478.db2.gz KZULKNWMIJSKHV-BDAKNGLRSA-N 2 0 224.270 2.059 20 0 BEADRP C[C@H](CCc1cccc(F)c1)[NH2+]C[C@@H](C)C[NH3+] ZINC000414880435 191613570 /nfs/dbraw/zinc/61/35/70/191613570.db2.gz QRDSVZDVXNIXHA-NWDGAFQWSA-N 2 0 238.350 2.331 20 0 BEADRP c1ccc2c(c1)CC[C@H]([NH2+]CC[C@H]1CCC[NH2+]1)C2 ZINC000414912995 191622505 /nfs/dbraw/zinc/62/25/05/191622505.db2.gz ZFTRZLMDKKLALL-CVEARBPZSA-N 2 0 244.382 2.276 20 0 BEADRP CCCC[C@H](COC)[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000414924378 191624081 /nfs/dbraw/zinc/62/40/81/191624081.db2.gz KBASYSREZRFGCM-YNEHKIRRSA-N 2 0 228.380 2.051 20 0 BEADRP C(C[NH2+]C1CCSCC1)C[C@@H]1CCC[NH2+]1 ZINC000414975012 191638606 /nfs/dbraw/zinc/63/86/06/191638606.db2.gz OCFADTIRNWPNRP-NSHDSACASA-N 2 0 228.405 2.004 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CC[NH2+][C@@H](C)C1)c1cccc(O)c1 ZINC000415120496 191682938 /nfs/dbraw/zinc/68/29/38/191682938.db2.gz YGYLBVNMOIPSAQ-YNEHKIRRSA-N 2 0 248.370 2.431 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CC[C@H](C[NH3+])C2)s1 ZINC000415036886 191659091 /nfs/dbraw/zinc/65/90/91/191659091.db2.gz LSWIXHMMCRQWET-WDEREUQCSA-N 2 0 224.373 2.274 20 0 BEADRP Cc1cccc(CC[NH2+][C@H](C)C[C@@H](C)[NH3+])c1 ZINC000422853521 192488269 /nfs/dbraw/zinc/48/82/69/192488269.db2.gz YZQSOPVBLLIKMC-CHWSQXEVSA-N 2 0 220.360 2.253 20 0 BEADRP c1ccc2c(c1)CC[C@@H]2C[NH2+]CC1CC[NH2+]CC1 ZINC000415082531 191674366 /nfs/dbraw/zinc/67/43/66/191674366.db2.gz ONDYOSATHRPQCV-OAHLLOKOSA-N 2 0 244.382 2.306 20 0 BEADRP CC(C)CC[C@](C)(O)C[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000583575715 355657285 /nfs/dbraw/zinc/65/72/85/355657285.db2.gz PYKWVNHSQQSGLX-MCIONIFRSA-N 2 0 242.407 2.033 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)[C@@H]1CC1(F)F ZINC000639347485 355793891 /nfs/dbraw/zinc/79/38/91/355793891.db2.gz ODVUMYZZZGKQRS-SRVKXCTJSA-N 2 0 246.345 2.352 20 0 BEADRP Cc1ccc(C[N@H+]2C[C@@H](C[NH3+])C[C@@H]2C)cc1C ZINC000216009462 355795468 /nfs/dbraw/zinc/79/54/68/355795468.db2.gz XERLLWGCXCOUPZ-DZGCQCFKSA-N 2 0 232.371 2.473 20 0 BEADRP Cc1ccc(C[N@H+]2C[C@H](C[NH3+])C[C@@H]2C)cc1F ZINC000216048298 355800324 /nfs/dbraw/zinc/80/03/24/355800324.db2.gz AANOTBDSQYHWSN-AAEUAGOBSA-N 2 0 236.334 2.303 20 0 BEADRP CC[C@]1(C)CC[N@H+](CC[C@H]2CC[NH2+]C2)C1 ZINC000399376568 355867467 /nfs/dbraw/zinc/86/74/67/355867467.db2.gz OBCPRJFPTMFAMU-CHWSQXEVSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@@H]1CC(C)(C)C[C@H]1[NH2+]CCC[NH+](C)C ZINC000192390003 355982301 /nfs/dbraw/zinc/98/23/01/355982301.db2.gz YPEYTFWNVHSKKB-VXGBXAGGSA-N 2 0 212.381 2.352 20 0 BEADRP CCc1cc(NCCCC[NH3+])c2ccccc2[nH+]1 ZINC000420244055 192185528 /nfs/dbraw/zinc/18/55/28/192185528.db2.gz YGTMLOCHYGBIQO-UHFFFAOYSA-N 2 0 243.354 2.370 20 0 BEADRP Cc1ccc(C[C@H]2CCC[N@H+]2C[C@@H](C)[NH3+])cc1 ZINC000420298201 192204612 /nfs/dbraw/zinc/20/46/12/192204612.db2.gz GZTWYGZGJVVCHT-UKRRQHHQSA-N 2 0 232.371 2.349 20 0 BEADRP C[C@H]1C[N@H+](CCCc2ccsc2)CC[C@@H]1[NH3+] ZINC000420296017 192204911 /nfs/dbraw/zinc/20/49/11/192204911.db2.gz WLBHZYFXJWROCO-AAEUAGOBSA-N 2 0 238.400 2.350 20 0 BEADRP C[C@H](c1cccc(O)c1)[N@H+](C)CC[C@H]1CC[NH2+]C1 ZINC000420296019 192205077 /nfs/dbraw/zinc/20/50/77/192205077.db2.gz CVTSRNJMUXOYCM-CHWSQXEVSA-N 2 0 248.370 2.385 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](CCCc2ccsc2)C1 ZINC000420303083 192206405 /nfs/dbraw/zinc/20/64/05/192206405.db2.gz WVEVTPGXMXLTAI-ZDUSSCGKSA-N 2 0 238.400 2.222 20 0 BEADRP FCCCCC[N@@H+]1CCC[C@@H]([C@H]2CC[NH2+]C2)C1 ZINC000420320284 192195669 /nfs/dbraw/zinc/19/56/69/192195669.db2.gz BCVRBFWKCCPIBQ-UONOGXRCSA-N 2 0 242.382 2.448 20 0 BEADRP FCCCCC[N@@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1 ZINC000420320282 192196076 /nfs/dbraw/zinc/19/60/76/192196076.db2.gz BCVRBFWKCCPIBQ-KGLIPLIRSA-N 2 0 242.382 2.448 20 0 BEADRP CCC[N@H+](C)C[C@H](C[NH3+])c1ccc(OC)cc1 ZINC000420302963 192206614 /nfs/dbraw/zinc/20/66/14/192206614.db2.gz KCNMNVIXNKNETO-ZDUSSCGKSA-N 2 0 236.359 2.079 20 0 BEADRP CC[N@H+](CC[C@H]1CCCO1)[C@H]1CCC[NH2+]CC1 ZINC000420300993 192207097 /nfs/dbraw/zinc/20/70/97/192207097.db2.gz ABEHWVCBGQZIDF-UONOGXRCSA-N 2 0 240.391 2.020 20 0 BEADRP CC(C)[C@H]([NH3+])CC[N@H+](C)CC[C@H]1CCCCO1 ZINC000420289682 192200951 /nfs/dbraw/zinc/20/09/51/192200951.db2.gz KSOJGSFBBMKUJV-ZIAGYGMSSA-N 2 0 242.407 2.251 20 0 BEADRP CC(C)[C@H]([NH3+])CC[N@H+](C)CC[C@@H]1CCCCO1 ZINC000420289681 192201261 /nfs/dbraw/zinc/20/12/61/192201261.db2.gz KSOJGSFBBMKUJV-UONOGXRCSA-N 2 0 242.407 2.251 20 0 BEADRP C[C@@H]1CC[C@@H](C)[NH+]1CC[C@H]1CCC[NH2+]C1 ZINC000420314663 192213505 /nfs/dbraw/zinc/21/35/05/192213505.db2.gz ZHGJZCFFVSXCDW-JHJVBQTASA-N 2 0 210.365 2.249 20 0 BEADRP COc1ccccc1[C@@H](C)[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000420371676 192213693 /nfs/dbraw/zinc/21/36/93/192213693.db2.gz KWQVAWZESSFEDQ-CHWSQXEVSA-N 2 0 248.370 2.345 20 0 BEADRP Fc1cccc(CCCN2CC[C@@H]3C[NH2+]C[C@@H]32)c1 ZINC000420330154 192215231 /nfs/dbraw/zinc/21/52/31/192215231.db2.gz AFLNLXZQRZNBCE-HIFRSBDPSA-N 2 0 248.345 2.052 20 0 BEADRP C[C@H](C1CC1)[N@H+](CC[C@@H]1CC[NH2+]C1)C1CC1 ZINC000420299997 192207679 /nfs/dbraw/zinc/20/76/79/192207679.db2.gz GYGXXYQIUXBBIK-NEPJUHHUSA-N 2 0 222.376 2.249 20 0 BEADRP CO[C@H](C)C[N@H+](CC[C@@H]1CCC[NH2+]C1)C(C)C ZINC000420307607 192208175 /nfs/dbraw/zinc/20/81/75/192208175.db2.gz RNVPFAFZGIYJSK-KGLIPLIRSA-N 2 0 242.407 2.121 20 0 BEADRP C[N@H+](CC[C@@H]1CCC[NH2+]C1)C(C1CC1)C1CC1 ZINC000420304834 192209806 /nfs/dbraw/zinc/20/98/06/192209806.db2.gz OSKZJSLGFMCXLS-LBPRGKRZSA-N 2 0 236.403 2.497 20 0 BEADRP Cc1ccccc1C[C@H]1CCC[N@H+]1C[C@@H](C)[NH3+] ZINC000420308408 192210251 /nfs/dbraw/zinc/21/02/51/192210251.db2.gz SCPNQXSVKDFUQO-UKRRQHHQSA-N 2 0 232.371 2.349 20 0 BEADRP CCc1cccc(C[N@@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@H]3C2)c1 ZINC000420311390 192211062 /nfs/dbraw/zinc/21/10/62/192211062.db2.gz RBDVXMNDVUEMCZ-HRCADAONSA-N 2 0 244.382 2.418 20 0 BEADRP C[N@H+](CC[C@H]1CC[NH2+]C1)C(C1CC1)C1CC1 ZINC000420311001 192211761 /nfs/dbraw/zinc/21/17/61/192211761.db2.gz VQEHAAFNGSTCGV-LLVKDONJSA-N 2 0 222.376 2.106 20 0 BEADRP C[C@@]1(C[NH3+])CC[N@H+](CCCc2ccsc2)C1 ZINC000420313355 192212031 /nfs/dbraw/zinc/21/20/31/192212031.db2.gz JLUOTOKKOYJSRR-ZDUSSCGKSA-N 2 0 238.400 2.351 20 0 BEADRP [NH3+]C1(C[NH2+]C[C@H]2CCCC(F)(F)C2)CCC1 ZINC000420316150 192212320 /nfs/dbraw/zinc/21/23/20/192212320.db2.gz XXULTBWMDSNBSU-JTQLQIEISA-N 2 0 232.318 2.283 20 0 BEADRP CCc1cccc(C[N@@H+]2CC[C@]3(CC[NH2+]C3)C2)c1 ZINC000420315723 192212447 /nfs/dbraw/zinc/21/24/47/192212447.db2.gz XIAJKKYEFDQQPI-INIZCTEOSA-N 2 0 244.382 2.434 20 0 BEADRP CC(C)[N@H+](CC[C@@H]1CC[NH2+]C1)CC1CCC1 ZINC000420370554 192227837 /nfs/dbraw/zinc/22/78/37/192227837.db2.gz JNYQRZWIKNHAGC-ZDUSSCGKSA-N 2 0 224.392 2.497 20 0 BEADRP CCSCC[N@@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1 ZINC000420328339 192229420 /nfs/dbraw/zinc/22/94/20/192229420.db2.gz MHXCHPCZPQNTLG-OLZOCXBDSA-N 2 0 242.432 2.061 20 0 BEADRP Cc1cc([C@@H]2CCC[N@@H+]2CC[C@@H]2CC[NH2+]C2)on1 ZINC000420326824 192229726 /nfs/dbraw/zinc/22/97/26/192229726.db2.gz XVHBZAZAYFFEOZ-STQMWFEESA-N 2 0 249.358 2.120 20 0 BEADRP C[C@@H]1OCC[C@H]1C[N@@H+]1CCC[C@@H](c2ncc[nH]2)C1 ZINC000639532159 356381762 /nfs/dbraw/zinc/38/17/62/356381762.db2.gz BIMFKAYCJCBTOX-RWMBFGLXSA-N 2 0 249.358 2.014 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CC[NH2+]C1)C1CCCC1 ZINC000420403223 192238029 /nfs/dbraw/zinc/23/80/29/192238029.db2.gz KWFUYMZWVAFYMO-VXGBXAGGSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCC[NH2+]C1)c1ccccn1 ZINC000420399470 192238541 /nfs/dbraw/zinc/23/85/41/192238541.db2.gz HYRUSEONKDVQMR-QWHCGFSZSA-N 2 0 233.359 2.122 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+]CCC1CC[NH2+]CC1 ZINC000420410186 192239065 /nfs/dbraw/zinc/23/90/65/192239065.db2.gz REQWTDFMHSUSHO-RYUDHWBXSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H]([NH3+])C[NH2+][C@@H](C)C(C)(C)c1ccccc1 ZINC000420411526 192239081 /nfs/dbraw/zinc/23/90/81/192239081.db2.gz RTDGAHDIGOZBKI-RYUDHWBXSA-N 2 0 220.360 2.290 20 0 BEADRP [NH3+]CCC[NH2+][C@H](C[C@H]1CCOC1)c1ccccc1 ZINC000420410988 192239142 /nfs/dbraw/zinc/23/91/42/192239142.db2.gz RNOONDRPFTYVAV-UKRRQHHQSA-N 2 0 248.370 2.093 20 0 BEADRP CCc1cc(N(C)C[C@H]2CCC[N@@H+]2C)cc[nH+]1 ZINC000420635810 192253038 /nfs/dbraw/zinc/25/30/38/192253038.db2.gz MILAWBBDTRPWIT-CQSZACIVSA-N 2 0 233.359 2.174 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@@H](C)[C@H](C[NH3+])C2)s1 ZINC000167596605 134118443 /nfs/dbraw/zinc/11/84/43/134118443.db2.gz CNHUWTXKMZMZPT-ZYHUDNBSSA-N 2 0 238.400 2.473 20 0 BEADRP CCc1cc(N2CC[C@H]([NH+]3CC=CC3)C2)cc[nH+]1 ZINC000336188720 134122472 /nfs/dbraw/zinc/12/24/72/134122472.db2.gz VTDNPXHVFOVIHH-HNNXBMFYSA-N 2 0 243.354 2.095 20 0 BEADRP CC1CC([NH2+]CCN2CCCC2(C)C)C1 ZINC000449782029 202034003 /nfs/dbraw/zinc/03/40/03/202034003.db2.gz KAGXBJPYIPMSML-UHFFFAOYSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H]1CSC[C@@H]1[NH2+]CCN1CCCC1(C)C ZINC000449781955 202035213 /nfs/dbraw/zinc/03/52/13/202035213.db2.gz JTEGNZFRWWTBCI-NEPJUHHUSA-N 2 0 242.432 2.202 20 0 BEADRP Cc1nccn1C[C@H]1CCCC[N@H+]1C(C)C ZINC000336194071 134125111 /nfs/dbraw/zinc/12/51/11/134125111.db2.gz QYCMKNLDGYBLLZ-CYBMUJFWSA-N 2 0 221.348 2.454 20 0 BEADRP Cc1ccccc1OCC[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000422944482 192513567 /nfs/dbraw/zinc/51/35/67/192513567.db2.gz MHXPAWOGHSUCNM-STQMWFEESA-N 2 0 236.359 2.089 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+]C1CCC(C[NH3+])CC1 ZINC000335017625 535322742 /nfs/dbraw/zinc/32/27/42/535322742.db2.gz KZVULMAGPODGFM-MCIGGMRASA-N 2 0 210.365 2.282 20 0 BEADRP CCCC(O)(CCC)C[NH2+][C@@H]1CCC[C@H]1C[NH3+] ZINC000422974982 192534435 /nfs/dbraw/zinc/53/44/35/192534435.db2.gz FVTBDCJFIAHTPN-QWHCGFSZSA-N 2 0 242.407 2.035 20 0 BEADRP CCC(CC)[C@H](CN[C@@H](C)C[C@H](C)[NH3+])[NH+](C)C ZINC000422965472 192529404 /nfs/dbraw/zinc/52/94/04/192529404.db2.gz OTPRGTVAFWKSEK-OBJOEFQTSA-N 2 0 243.439 2.068 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CC1(CCO)CCCCC1 ZINC000423004109 192533014 /nfs/dbraw/zinc/53/30/14/192533014.db2.gz JEHYATRNTVCSMV-STQMWFEESA-N 2 0 242.407 2.035 20 0 BEADRP CO[C@@H]1[C@H](C)[C@H]([NH2+][C@@H](C)CCCC[NH3+])C1(C)C ZINC000423019006 192542002 /nfs/dbraw/zinc/54/20/02/192542002.db2.gz STOBOIVRBFLITQ-QNWHQSFQSA-N 2 0 242.407 2.153 20 0 BEADRP COCCC(C)(C)C[NH2+][C@H]1CCCCC[C@H]1[NH3+] ZINC000423035710 192548447 /nfs/dbraw/zinc/54/84/47/192548447.db2.gz JTMZRWIJHNPWBT-OLZOCXBDSA-N 2 0 242.407 2.299 20 0 BEADRP CCOC[C@@H]([NH2+]C1CCC(C[NH3+])CC1)C(C)C ZINC000423070145 192557585 /nfs/dbraw/zinc/55/75/85/192557585.db2.gz MWZMXHGRFSRXGC-JXQTWKCFSA-N 2 0 242.407 2.155 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H]1CCc2ccccc2OC1 ZINC000423108750 192569916 /nfs/dbraw/zinc/56/99/16/192569916.db2.gz GHBPWCQZILPWNX-OCCSQVGLSA-N 2 0 248.370 2.097 20 0 BEADRP CC[C@H]1CC[C@H]([NH2+][C@@H](CCC[NH3+])COC)CC1 ZINC000423124644 192576793 /nfs/dbraw/zinc/57/67/93/192576793.db2.gz GTGMMSBHMUMVGB-IHRRRGAJSA-N 2 0 242.407 2.299 20 0 BEADRP CC[C@@H](C)C[N@@H+]1CCC2(C1)CC[NH+](C)CC2 ZINC000639758873 356670080 /nfs/dbraw/zinc/67/00/80/356670080.db2.gz YADCCLDJCUREBW-CYBMUJFWSA-N 2 0 224.392 2.450 20 0 BEADRP C1C[C@H]2CC([NH2+][C@H]3CC4CCC3CC4)C[C@@H]1[NH2+]2 ZINC000423134826 192582003 /nfs/dbraw/zinc/58/20/03/192582003.db2.gz SFXVKSZETIQYDG-GXDBUFDYSA-N 2 0 234.387 2.438 20 0 BEADRP CC(F)(F)CC[NH2+]C1CCC(C[NH3+])CC1 ZINC000423143461 192586744 /nfs/dbraw/zinc/58/67/44/192586744.db2.gz DDZNECCYIKNNDB-UHFFFAOYSA-N 2 0 220.307 2.139 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CC(C)(C)c1ccccn1 ZINC000423143836 192586788 /nfs/dbraw/zinc/58/67/88/192586788.db2.gz DZGRXGFBOISFQH-VXGBXAGGSA-N 2 0 235.375 2.075 20 0 BEADRP CC[C@H]([NH2+]C[C@H](C)C[NH+](C)C)[C@@H]1C[C@@H]1C ZINC000321136880 259469236 /nfs/dbraw/zinc/46/92/36/259469236.db2.gz UOZJOBLZKFHOBI-RVMXOQNASA-N 2 0 212.381 2.208 20 0 BEADRP CC[NH+](CC)CCC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000086573158 538557938 /nfs/dbraw/zinc/55/79/38/538557938.db2.gz MBXIRJJESLSTDT-YHWZYXNKSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[N@H+](C)C(C)(C)C1)C1CC1 ZINC000623341411 356741938 /nfs/dbraw/zinc/74/19/38/356741938.db2.gz AVRJWNSLIMUOCG-JQWIXIFHSA-N 2 0 210.365 2.247 20 0 BEADRP CC(C)OCCC[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623338224 356732875 /nfs/dbraw/zinc/73/28/75/356732875.db2.gz QNRWQNFOCNROSI-CYBMUJFWSA-N 2 0 242.407 2.264 20 0 BEADRP Cc1csc(C[NH2+][C@H](C)C[C@H](C)[NH3+])c1 ZINC000423156941 192595915 /nfs/dbraw/zinc/59/59/15/192595915.db2.gz UPFUWTXGICGBLE-VHSXEESVSA-N 2 0 212.362 2.272 20 0 BEADRP CC[NH+]1CCC(CC[NH2+][C@H](C)[C@H](C)OC)CC1 ZINC000361766897 356936690 /nfs/dbraw/zinc/93/66/90/356936690.db2.gz AGDXURDGWYXDOX-OLZOCXBDSA-N 2 0 242.407 2.121 20 0 BEADRP CCC(C)(C)CC[N@@H+]1CC[C@H]([C@H](C)[NH3+])C1 ZINC000261550463 535350565 /nfs/dbraw/zinc/35/05/65/535350565.db2.gz PLYFTMNKMOBEGE-RYUDHWBXSA-N 2 0 212.381 2.482 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+]C[C@@H]2CCCCO2)CC1(C)C ZINC000623377439 356896829 /nfs/dbraw/zinc/89/68/29/356896829.db2.gz ZAARRMJNQDBTMJ-OLZOCXBDSA-N 2 0 240.391 2.018 20 0 BEADRP CCc1ccc(C[N@@H+]2CCC[C@@H](C[NH3+])C2)s1 ZINC000019843414 356901664 /nfs/dbraw/zinc/90/16/64/356901664.db2.gz ZHOBWWOMZJERAV-NSHDSACASA-N 2 0 238.400 2.481 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H](C)C1C(C)(C)C1(C)C ZINC000423197964 192623165 /nfs/dbraw/zinc/62/31/65/192623165.db2.gz CHFNBTQGUQHVLB-JTQLQIEISA-N 2 0 212.381 2.256 20 0 BEADRP CC(C)[C@@H]([NH2+]CC[C@H](C)[NH3+])c1ccc(F)cn1 ZINC000423222437 192633023 /nfs/dbraw/zinc/63/30/23/192633023.db2.gz AYPHTMBCYVZQHT-GXFFZTMASA-N 2 0 239.338 2.245 20 0 BEADRP CCc1nc(C)c([C@@H](C)[NH2+]CC[C@H](C)[NH3+])s1 ZINC000423223639 192634257 /nfs/dbraw/zinc/63/42/57/192634257.db2.gz GZKJYBHLTUTGJE-DTWKUNHWSA-N 2 0 241.404 2.402 20 0 BEADRP CC[NH+]1CCC([NH2+]CC2CC(C)(C)C2)CC1 ZINC000390639184 357109230 /nfs/dbraw/zinc/10/92/30/357109230.db2.gz MNCRFOCHUGLLAH-UHFFFAOYSA-N 2 0 224.392 2.497 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH2+]C2CC(C)(C)C2)C1 ZINC000389864299 357057323 /nfs/dbraw/zinc/05/73/23/357057323.db2.gz FYJHWSZXYPGKHP-NSHDSACASA-N 2 0 210.365 2.106 20 0 BEADRP C[NH+](C)[C@@H]1CCC[C@H]([NH2+]CC2(C)CC2)C1 ZINC000389984730 357079012 /nfs/dbraw/zinc/07/90/12/357079012.db2.gz LJOGETHPNYEUDO-NWDGAFQWSA-N 2 0 210.365 2.249 20 0 BEADRP COC[C@H]([NH2+]C1CCC([NH3+])CC1)C1CCCC1 ZINC000423233122 192642462 /nfs/dbraw/zinc/64/24/62/192642462.db2.gz OAEBMDRTXHPKCI-RUXDESIVSA-N 2 0 240.391 2.051 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]CCOCc2ccccc2)C1 ZINC000390229025 357087230 /nfs/dbraw/zinc/08/72/30/357087230.db2.gz FEJGJJIPPWAFEH-GJZGRUSLSA-N 2 0 248.370 2.063 20 0 BEADRP CC(F)(F)CCC[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000390253066 357087535 /nfs/dbraw/zinc/08/75/35/357087535.db2.gz VDOYEDZLOUYLNI-NXEZZACHSA-N 2 0 220.307 2.281 20 0 BEADRP CC[C@H]([NH2+]CC[C@@H]1CC[NH2+]C1)[C@@H]1C[C@H]1C ZINC000423240251 192645456 /nfs/dbraw/zinc/64/54/56/192645456.db2.gz BYNUYKGTHBYVPU-XQHKEYJVSA-N 2 0 210.365 2.010 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H](C)c1ccsc1 ZINC000423273924 192666654 /nfs/dbraw/zinc/66/66/54/192666654.db2.gz LMIBAPPWPBQCBS-VHSXEESVSA-N 2 0 212.362 2.254 20 0 BEADRP C[N@@H+]1CCCC[C@H](C[NH2+][C@H]2CCC[C@@H]3C[C@@H]32)C1 ZINC000628425708 357253121 /nfs/dbraw/zinc/25/31/21/357253121.db2.gz SNBGIOCXBXMITM-KBXIAJHMSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]1CCCC[C@H]1C[N@@H+]1CCC[C@@H](C[NH3+])C1 ZINC000347032454 134196462 /nfs/dbraw/zinc/19/64/62/134196462.db2.gz ABIDRIJWUOFBGV-RDBSUJKOSA-N 2 0 224.392 2.483 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H]1CCc2ccc(F)cc21 ZINC000423280272 192673502 /nfs/dbraw/zinc/67/35/02/192673502.db2.gz UHSVKDNOLNAGSV-HZMBPMFUSA-N 2 0 236.334 2.258 20 0 BEADRP CCN(CC)C[C@H](C)[NH2+][C@H](C)[C@H]1CCCOC1 ZINC000356849535 538819607 /nfs/dbraw/zinc/81/96/07/538819607.db2.gz PSLANNGPNUUWMM-MJBXVCDLSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H](CCCc1cccnc1)[NH2+]CC(C)(C)[NH3+] ZINC000423288767 192680240 /nfs/dbraw/zinc/68/02/40/192680240.db2.gz UWTZNLDHISCAGR-GFCCVEGCSA-N 2 0 235.375 2.120 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCC[C@@H](F)C1)[C@@H]1CCC[NH2+]1 ZINC000582606940 357349393 /nfs/dbraw/zinc/34/93/93/357349393.db2.gz ZZPPBYXOJVSCQQ-NDBYEHHHSA-N 2 0 228.355 2.387 20 0 BEADRP C[C@H]([NH2+]CCCC1CC1)[C@@H]1CCCC[NH2+]1 ZINC000395242877 357429528 /nfs/dbraw/zinc/42/95/28/357429528.db2.gz RCZHWKDCNVBHNX-AAEUAGOBSA-N 2 0 210.365 2.297 20 0 BEADRP CC[N@H+](C)C[C@H]1CC[NH+](CC2(C)CC2)C1 ZINC000584386854 357481155 /nfs/dbraw/zinc/48/11/55/357481155.db2.gz FZZBCXDQRBYDAA-GFCCVEGCSA-N 2 0 210.365 2.060 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCC[C@@H]([NH3+])C1)CC(F)(F)F ZINC000396919799 357486631 /nfs/dbraw/zinc/48/66/31/357486631.db2.gz XUPDRWOPZDZLRH-IVZWLZJFSA-N 2 0 238.297 2.434 20 0 BEADRP CC(C)CSCC[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000397364319 357513828 /nfs/dbraw/zinc/51/38/28/357513828.db2.gz YOBOWTSRLPYYAW-NEPJUHHUSA-N 2 0 230.421 2.235 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@@H]2CC[C@@H](C)C2)CC1 ZINC000230407059 357539674 /nfs/dbraw/zinc/53/96/74/357539674.db2.gz CNAYQKFNFDKNPK-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@H](C)C[NH+]1CCC([C@@H]2CCC[NH2+]2)CC1 ZINC000063197478 357593673 /nfs/dbraw/zinc/59/36/73/357593673.db2.gz FCZPLLBWCNOFFE-JSGCOSHPSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H](C)C[NH+]1CCC([C@@H]2CCC[NH2+]2)CC1 ZINC000063197477 357593795 /nfs/dbraw/zinc/59/37/95/357593795.db2.gz FCZPLLBWCNOFFE-OCCSQVGLSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH+](C)CCOCC[NH2+]C1CCC(C)(C)CC1 ZINC000231676476 357619775 /nfs/dbraw/zinc/61/97/75/357619775.db2.gz XLMIASVCDCAKOZ-UHFFFAOYSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)C1CC([NH2+]CCC[NH+]2CCCC2)C1 ZINC000232536811 357670243 /nfs/dbraw/zinc/67/02/43/357670243.db2.gz NQEGLUGRGKTTGS-UHFFFAOYSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H]1C[C@H](C)CC[C@@H]1[NH2+]C[C@H](C)C[NH3+] ZINC000423301800 192691098 /nfs/dbraw/zinc/69/10/98/192691098.db2.gz GNJPRYDJPZNAGJ-LPWJVIDDSA-N 2 0 212.381 2.386 20 0 BEADRP CC1(C[NH2+]C2CCN(c3cc[nH+]cc3)CC2)CC1 ZINC000232873932 357686215 /nfs/dbraw/zinc/68/62/15/357686215.db2.gz ZPKIPQYTVUJBON-UHFFFAOYSA-N 2 0 245.370 2.440 20 0 BEADRP CCC1(C[NH2+][C@H](CCC[NH3+])COC)CCCC1 ZINC000232996330 357688409 /nfs/dbraw/zinc/68/84/09/357688409.db2.gz VIRNAIICUAYJIR-CYBMUJFWSA-N 2 0 242.407 2.300 20 0 BEADRP Cc1ccncc1[C@@H](C)NC[C@H](C)C[NH+](C)C ZINC000293659106 491114280 /nfs/dbraw/zinc/11/42/80/491114280.db2.gz LUIHTCRZTMCQIS-WCQYABFASA-N 2 0 235.375 2.238 20 0 BEADRP CC[C@H](C)C[C@H](C)[NH2+][C@@H](CCC[NH3+])COC ZINC000234003770 357768380 /nfs/dbraw/zinc/76/83/80/357768380.db2.gz JVNOBQFSYGXVFK-AVGNSLFASA-N 2 0 230.396 2.155 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H](C)c1sc(C)nc1C ZINC000086070550 357817991 /nfs/dbraw/zinc/81/79/91/357817991.db2.gz UUJDSZMFMCCYKP-BDAKNGLRSA-N 2 0 241.404 2.266 20 0 BEADRP Cc1c[nH+]ccc1N1CC[N@@H+]2CCCC[C@@H]2C1 ZINC000191979854 357818698 /nfs/dbraw/zinc/81/86/98/357818698.db2.gz KQEJKFKPIIBOSG-CYBMUJFWSA-N 2 0 231.343 2.065 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+]C[C@@H]1CCC[C@@H](C)C1 ZINC000234789327 357829361 /nfs/dbraw/zinc/82/93/61/357829361.db2.gz NHVMIWDSWPHATR-MCIONIFRSA-N 2 0 242.407 2.156 20 0 BEADRP C[C@H](CCC1CC1)[NH2+]CC1CC[NH2+]CC1 ZINC000398110038 357843007 /nfs/dbraw/zinc/84/30/07/357843007.db2.gz WUQVUUBRHJOEHA-LLVKDONJSA-N 2 0 210.365 2.154 20 0 BEADRP Cc1c[nH+]ccc1N(C)C[C@H]1CCC[N@H+](C)C1 ZINC000192598349 357845454 /nfs/dbraw/zinc/84/54/54/357845454.db2.gz PTHNOMJLYYENSZ-ZDUSSCGKSA-N 2 0 233.359 2.168 20 0 BEADRP CSCC[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000193080160 357867326 /nfs/dbraw/zinc/86/73/26/357867326.db2.gz ZCTNVNSVBVCNTK-UHFFFAOYSA-N 2 0 242.432 2.157 20 0 BEADRP C[C@H](CCc1ccccc1)[NH2+]C[C@@H]1CCC[NH2+]1 ZINC000235424874 357869310 /nfs/dbraw/zinc/86/93/10/357869310.db2.gz TZQRLYFZWULRPA-HIFRSBDPSA-N 2 0 232.371 2.349 20 0 BEADRP C[NH+](C)CCCC(C)(C)[NH2+]C[C@H]1CCCOC1 ZINC000387248923 357909659 /nfs/dbraw/zinc/90/96/59/357909659.db2.gz YOUBDZQOWNYDHS-CYBMUJFWSA-N 2 0 242.407 2.123 20 0 BEADRP Cc1cc(Cl)ccc1C[N@H+](C)CCC[NH3+] ZINC000220232001 358028828 /nfs/dbraw/zinc/02/88/28/358028828.db2.gz RAKHARXRMFFULS-UHFFFAOYSA-N 2 0 226.751 2.429 20 0 BEADRP Cc1cscc1C[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000168772028 134247792 /nfs/dbraw/zinc/24/77/92/134247792.db2.gz OXDVJNZHVNBZGO-GFCCVEGCSA-N 2 0 224.373 2.288 20 0 BEADRP Cc1cccc(C[NH2+][C@H]2CCC[NH2+]CC2)c1 ZINC000168710046 134246614 /nfs/dbraw/zinc/24/66/14/134246614.db2.gz PBNQGKADPWPKGX-AWEZNQCLSA-N 2 0 218.344 2.227 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]C2CCC2)c2ccccc21 ZINC000169240410 134249804 /nfs/dbraw/zinc/24/98/04/134249804.db2.gz SBLAUDULRUUGNC-STQMWFEESA-N 2 0 202.301 2.273 20 0 BEADRP CC(C)C[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000169231623 134249811 /nfs/dbraw/zinc/24/98/11/134249811.db2.gz ACTKCCVGUYWYCS-CHWSQXEVSA-N 2 0 204.317 2.377 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@H]([NH3+])C1)c1ccncc1 ZINC000086402251 491123828 /nfs/dbraw/zinc/12/38/28/491123828.db2.gz VDNWWONLSFYFKI-DRZSPHRISA-N 2 0 219.332 2.002 20 0 BEADRP CCC(CC)[NH2+]C[C@@H]1CC[N@@H+](C(C)C)C1 ZINC000040621438 358243052 /nfs/dbraw/zinc/24/30/52/358243052.db2.gz NPLDKIAVAMREJO-LBPRGKRZSA-N 2 0 212.381 2.495 20 0 BEADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)C2CC2)C1 ZINC000040621459 358243212 /nfs/dbraw/zinc/24/32/12/358243212.db2.gz AHDNCOBMGLDNLK-RYUDHWBXSA-N 2 0 210.365 2.105 20 0 BEADRP CC1=CCC[C@H](C)[C@H]1C[N@H+](C)CC1CN(C)C1 ZINC000668538701 491127327 /nfs/dbraw/zinc/12/73/27/491127327.db2.gz AJAZHAXIQWLOSX-ZFWWWQNUSA-N 2 0 236.403 2.472 20 0 BEADRP C[C@@H](c1ccc(F)cc1)[N@@H+]1CC[C@@H](C[NH3+])C1 ZINC000219098120 134273620 /nfs/dbraw/zinc/27/36/20/134273620.db2.gz FGFOVDQKNMJXSB-QWRGUYRKSA-N 2 0 222.307 2.167 20 0 BEADRP Cc1cccc(C[N@H+]2CC[C@@H]([NH3+])C[C@H]2C)c1 ZINC000226878798 358346635 /nfs/dbraw/zinc/34/66/35/358346635.db2.gz OGAWICBJXCBKIG-TZMCWYRMSA-N 2 0 218.344 2.307 20 0 BEADRP CC[NH+]1CCC(C[NH2+]Cc2ccc(C)o2)CC1 ZINC000044517401 358388471 /nfs/dbraw/zinc/38/84/71/358388471.db2.gz LZCWGVRQFVAQTP-UHFFFAOYSA-N 2 0 236.359 2.410 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1cccc(O)c1 ZINC000044534560 358389259 /nfs/dbraw/zinc/38/92/59/358389259.db2.gz ZXDUYUYVSOILOH-OLZOCXBDSA-N 2 0 248.370 2.385 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1ccncc1 ZINC000044535024 358389805 /nfs/dbraw/zinc/38/98/05/358389805.db2.gz IUUHDEBWQKNNHR-OLZOCXBDSA-N 2 0 233.359 2.074 20 0 BEADRP CC(C)CCC[NH2+]CCCC[NH+](C)C ZINC000165228908 358434084 /nfs/dbraw/zinc/43/40/84/358434084.db2.gz AWQBHWOQXGCHSP-UHFFFAOYSA-N 2 0 200.370 2.354 20 0 BEADRP CCCC[NH+]1CCC([NH2+][C@@H](C)[C@H](C)OC)CC1 ZINC000130019339 358605704 /nfs/dbraw/zinc/60/57/04/358605704.db2.gz GLZWZSKOLHBPGA-STQMWFEESA-N 2 0 242.407 2.264 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H](C)[C@H]1CCCC[C@H]1C ZINC000423306034 192694513 /nfs/dbraw/zinc/69/45/13/192694513.db2.gz KYLQNMFTFUPVMA-LPWJVIDDSA-N 2 0 212.381 2.386 20 0 BEADRP CN(C)C1(C[NH2+][C@@H]2CCCOCC2)CCCC1 ZINC000132032748 358704723 /nfs/dbraw/zinc/70/47/23/358704723.db2.gz NCGSRVHYPHSKHW-CYBMUJFWSA-N 2 0 240.391 2.020 20 0 BEADRP C[C@@H]1C[C@@H](C[NH3+])C[N@@H+]1CCCOc1ccccc1 ZINC000131597601 358684306 /nfs/dbraw/zinc/68/43/06/358684306.db2.gz OOXZVUSMUMBUDU-KGLIPLIRSA-N 2 0 248.370 2.125 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000132078479 358705908 /nfs/dbraw/zinc/70/59/08/358705908.db2.gz XHIBOUBAEPTLBU-GJZGRUSLSA-N 2 0 247.386 2.063 20 0 BEADRP FCCC[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000133004316 358743174 /nfs/dbraw/zinc/74/31/74/358743174.db2.gz DYABPCWGNZTDCB-ZDUSSCGKSA-N 2 0 228.355 2.296 20 0 BEADRP CC[C@H](O)CC[NH2+][C@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000135034552 358816673 /nfs/dbraw/zinc/81/66/73/358816673.db2.gz JNZOXZPTWHZEHK-RDBSUJKOSA-N 2 0 242.407 2.048 20 0 BEADRP CC[C@H](CCO)[NH2+][C@@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000134355824 358787503 /nfs/dbraw/zinc/78/75/03/358787503.db2.gz UFPOFZRAOFJBBF-MJBXVCDLSA-N 2 0 242.407 2.048 20 0 BEADRP C[C@H](CC[NH3+])[NH2+]Cc1cccc2cccnc21 ZINC000136134602 358865207 /nfs/dbraw/zinc/86/52/07/358865207.db2.gz DWJRVABTYGIIDU-LLVKDONJSA-N 2 0 229.327 2.062 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H]1CCCC12CCCC2 ZINC000423313244 192698824 /nfs/dbraw/zinc/69/88/24/192698824.db2.gz WQSYEGOIFPEXQV-NEPJUHHUSA-N 2 0 210.365 2.284 20 0 BEADRP CC[C@H](C)C[N@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000246464476 359107216 /nfs/dbraw/zinc/10/72/16/359107216.db2.gz ZGLSWMYAQQSKGY-STQMWFEESA-N 2 0 212.381 2.306 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]C[C@H]1CCCS1 ZINC000246482047 359116321 /nfs/dbraw/zinc/11/63/21/359116321.db2.gz GQOHRAQPBBWBEP-LPWJVIDDSA-N 2 0 242.432 2.200 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[C@@H](C)C1)C[NH+]1CCCC1 ZINC000070762695 359062557 /nfs/dbraw/zinc/06/25/57/359062557.db2.gz VJXAVWFAEDEYKP-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H](CCC1CC1)[NH2+]CC1=CC[NH2+]CC1 ZINC000423344495 192721721 /nfs/dbraw/zinc/72/17/21/192721721.db2.gz MZKOJDPIHZICPR-LLVKDONJSA-N 2 0 208.349 2.074 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+][C@@H]1CC=CCC1 ZINC000247233849 359203485 /nfs/dbraw/zinc/20/34/85/359203485.db2.gz XEADMHTWLUHBPI-SYQHCUMBSA-N 2 0 222.376 2.413 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)[C@H]1C[C@H]1C ZINC000423419041 192749242 /nfs/dbraw/zinc/74/92/42/192749242.db2.gz IHNWFKOMZWFCOH-KSTCHIGDSA-N 2 0 224.392 2.386 20 0 BEADRP C[C@H](Cc1ccsc1)[NH2+]CC1CC[NH2+]CC1 ZINC000086700880 359355716 /nfs/dbraw/zinc/35/57/16/359355716.db2.gz USYYWUSQFXEPPY-LLVKDONJSA-N 2 0 238.400 2.268 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@H]2C2CC[NH2+]CC2)[C@H]1C ZINC000423430795 192766948 /nfs/dbraw/zinc/76/69/48/192766948.db2.gz IKUPJMIRTWTJGT-NGKICAJHSA-N 2 0 222.376 2.009 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CCC(F)(F)F)CC1(C)C ZINC000623436184 359328517 /nfs/dbraw/zinc/32/85/17/359328517.db2.gz IFILNRFFYFEMSB-VIFPVBQESA-N 2 0 238.297 2.401 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+][C@H]2CCCSC2)CC1(C)C ZINC000623439384 359332849 /nfs/dbraw/zinc/33/28/49/359332849.db2.gz GRPPWZBOXXFELC-NEPJUHHUSA-N 2 0 242.432 2.344 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CC2(C)CC2)CC1(C)C ZINC000623439658 359333014 /nfs/dbraw/zinc/33/30/14/359333014.db2.gz SBAUEJAOTNGCSE-NSHDSACASA-N 2 0 210.365 2.249 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@H]1CCC[C@H](c2cccnc2)C1 ZINC000423464005 192780167 /nfs/dbraw/zinc/78/01/67/192780167.db2.gz LRCIUYGVTUHTID-QEJZJMRPSA-N 2 0 247.386 2.435 20 0 BEADRP CC[C@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)C(C)C ZINC000423440867 192770285 /nfs/dbraw/zinc/77/02/85/192770285.db2.gz PAKQXIWALPLVRE-MELADBBJSA-N 2 0 224.392 2.399 20 0 BEADRP CC(C)C1CC([NH2+][C@@H]2C[C@H]2C2CC[NH2+]CC2)C1 ZINC000423449001 192773529 /nfs/dbraw/zinc/77/35/29/192773529.db2.gz VTEYPQMSUHNUKA-PFSRBDOWSA-N 2 0 236.403 2.399 20 0 BEADRP CCC1CC([NH2+]C[C@@H]2CCC[C@H]([NH3+])C2)C1 ZINC000423481954 192789558 /nfs/dbraw/zinc/78/95/58/192789558.db2.gz XDOFUQMQGJTULY-QBHFIFKDSA-N 2 0 210.365 2.282 20 0 BEADRP CCN1CCC([NH2+][C@H]2CCC[C@H](OC)C2)CC1 ZINC000223816928 491140563 /nfs/dbraw/zinc/14/05/63/491140563.db2.gz LBYXVLIOFXMVBU-KBPBESRZSA-N 2 0 240.391 2.018 20 0 BEADRP CC[C@H]([NH2+]CCC[C@H]1CCC[NH2+]1)C1CC1 ZINC000423490975 192792156 /nfs/dbraw/zinc/79/21/56/192792156.db2.gz YGMXGFRLRZLRBL-OLZOCXBDSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000423511076 192798439 /nfs/dbraw/zinc/79/84/39/192798439.db2.gz NCNIFGPHGFSHEB-HIFRSBDPSA-N 3 0 249.402 2.184 20 0 BEADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@@H]2CCC23CCC3)C1 ZINC000423524076 192803475 /nfs/dbraw/zinc/80/34/75/192803475.db2.gz ZGGSPHWASPPLDX-IJLUTSLNSA-N 2 0 208.349 2.036 20 0 BEADRP C[C@@H]([NH3+])[C@@H](C)[NH2+][C@H](C)Cc1ccsc1 ZINC000379542095 359540202 /nfs/dbraw/zinc/54/02/02/359540202.db2.gz QUTUZVRXRHLLJV-OPRDCNLKSA-N 2 0 212.362 2.004 20 0 BEADRP C(C[C@@H]1CCC[NH2+]C1)SCC1CC[NH2+]CC1 ZINC000580441359 359550382 /nfs/dbraw/zinc/55/03/82/359550382.db2.gz PSAPNPMCQMPJSR-LBPRGKRZSA-N 2 0 242.432 2.109 20 0 BEADRP CC[C@@H]1C[C@H]([NH2+][C@H]2CCCC[C@@H]2C[NH3+])CCO1 ZINC000423547645 192809987 /nfs/dbraw/zinc/80/99/87/192809987.db2.gz LOLMCLJUFKXLDE-SYQHCUMBSA-N 2 0 240.391 2.051 20 0 BEADRP CC[C@H]([NH2+]CCC[NH2+]C1CC1)[C@H]1C[C@@H]1C ZINC000423546521 192810008 /nfs/dbraw/zinc/81/00/08/192810008.db2.gz FLERSVUMBYSYSQ-DRZSPHRISA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H](Cc1ccoc1)[NH2+]CCC1=CC[NH2+]CC1 ZINC000423546729 192810644 /nfs/dbraw/zinc/81/06/44/192810644.db2.gz ZHMNIHIFJGJELS-LBPRGKRZSA-N 2 0 234.343 2.110 20 0 BEADRP CC(C)[C@H]1CC[C@H]1[NH2+]CCCC[NH+](C)C ZINC000308997544 491142093 /nfs/dbraw/zinc/14/20/93/491142093.db2.gz MYZDZIOBEDCPER-CHWSQXEVSA-N 2 0 212.381 2.352 20 0 BEADRP C[N@@H+]1CCC[C@H]1CC[NH+]1CCSC(C)(C)C1 ZINC000162215623 359711310 /nfs/dbraw/zinc/71/13/10/359711310.db2.gz VMEGRCVMRPROSO-LBPRGKRZSA-N 2 0 242.432 2.298 20 0 BEADRP C[C@H](CC1CCC1)[NH2+]CCCC[NH+](C)C ZINC000132995293 491145238 /nfs/dbraw/zinc/14/52/38/491145238.db2.gz FONCWLTWBJFXAH-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H]1CCCC[C@H]1C[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000087646948 359922149 /nfs/dbraw/zinc/92/21/49/359922149.db2.gz LLZKBJNVLGPPPU-MCIONIFRSA-N 2 0 224.392 2.402 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+]CCc1ccccc1 ZINC000089139561 359991710 /nfs/dbraw/zinc/99/17/10/359991710.db2.gz JVHGYNWOXVOSFF-HUUCEWRRSA-N 2 0 232.371 2.336 20 0 BEADRP COCc1cccc(C[N@@H+]2CCC[C@H](C[NH3+])C2)c1 ZINC000088555213 359965515 /nfs/dbraw/zinc/96/55/15/359965515.db2.gz HANJLFZRPXIHTB-OAHLLOKOSA-N 2 0 248.370 2.004 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+]Cc1cccc(F)c1 ZINC000089140766 359992987 /nfs/dbraw/zinc/99/29/87/359992987.db2.gz FNRDMDRZUAGEAC-OCCSQVGLSA-N 2 0 236.334 2.433 20 0 BEADRP C[C@H]([NH2+][C@H]1CCCC[C@@H]1C[NH3+])c1ccccn1 ZINC000089139985 359993168 /nfs/dbraw/zinc/99/31/68/359993168.db2.gz DQTGHNJQYARDHW-SCRDCRAPSA-N 2 0 233.359 2.250 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]CC1(C)CCCC1 ZINC000089555363 360026393 /nfs/dbraw/zinc/02/63/93/360026393.db2.gz IAPZSHYFRUURSX-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP COc1cccc(C[N@H+](C)CC[C@H]2CC[NH2+]C2)c1 ZINC000089749233 360036989 /nfs/dbraw/zinc/03/69/89/360036989.db2.gz ZEYNRECJGJOTHO-CYBMUJFWSA-N 2 0 248.370 2.127 20 0 BEADRP Cc1cccc(CC[NH2+][C@H]2CCC[C@H]2C[NH3+])c1 ZINC000089150528 359994085 /nfs/dbraw/zinc/99/40/85/359994085.db2.gz ADWXGDFNDNTWQZ-GJZGRUSLSA-N 2 0 232.371 2.255 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]CCc1cccc(F)c1 ZINC000089148169 359994205 /nfs/dbraw/zinc/99/42/05/359994205.db2.gz NHXDNWLPYGAZEF-JSGCOSHPSA-N 2 0 236.334 2.085 20 0 BEADRP CC(C)C1(C[NH2+][C@H]2CC[N@H+](C)C[C@H]2C)CC1 ZINC000090230522 360067561 /nfs/dbraw/zinc/06/75/61/360067561.db2.gz SNUDHVCQFKJEFK-OLZOCXBDSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@H](CC[NH+]1C[C@H]2C[NH2+]C[C@@H]2C1)c1ccccc1 ZINC000090320652 360070176 /nfs/dbraw/zinc/07/01/76/360070176.db2.gz ZBRDSZZLKCOBMI-FVQBIDKESA-N 2 0 244.382 2.331 20 0 BEADRP COCCCC[NH2+][C@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000093516160 360255661 /nfs/dbraw/zinc/25/56/61/360255661.db2.gz SIJOKKXHBTZBHP-ZIAGYGMSSA-N 2 0 242.407 2.313 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]Cc2ccc(F)cc2F)C1 ZINC000093215776 360223061 /nfs/dbraw/zinc/22/30/61/360223061.db2.gz PFPUWPSGCZAFKO-NEPJUHHUSA-N 2 0 240.297 2.324 20 0 BEADRP C[C@H]([NH2+]C1CC(F)(F)C1)C1CC[NH+](C)CC1 ZINC000309390582 491147826 /nfs/dbraw/zinc/14/78/26/491147826.db2.gz FSSBKHZAKUKJCC-VIFPVBQESA-N 2 0 232.318 2.104 20 0 BEADRP CCC[C@@H](C)C[NH+]1CCC(OCCC[NH3+])CC1 ZINC000094069991 360293963 /nfs/dbraw/zinc/29/39/63/360293963.db2.gz FKULIWHKMQYUSV-CYBMUJFWSA-N 2 0 242.407 2.252 20 0 BEADRP C[C@@H]([NH2+]CCC1(C)CC1)C1CC[NH+](C)CC1 ZINC000309475053 491149421 /nfs/dbraw/zinc/14/94/21/491149421.db2.gz RTEUSYRQEWDKMS-GFCCVEGCSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CC[C@@H](C)[C@@H]([NH2+]C[C@@H]2CCCN2C)C1 ZINC000226017019 360518725 /nfs/dbraw/zinc/51/87/25/360518725.db2.gz WYEIWLSRMYLTKX-MQYQWHSLSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+][C@@H]1CC[C@@H](C)[C@H](C)C1 ZINC000629406530 361054944 /nfs/dbraw/zinc/05/49/44/361054944.db2.gz NIJYSLSFBKFDLE-UJPOAAIJSA-N 2 0 210.365 2.151 20 0 BEADRP CC1(C)CC[C@@H]([NH2+][C@@H]2CC[NH2+]C23CCC3)C1 ZINC000629385201 361032580 /nfs/dbraw/zinc/03/25/80/361032580.db2.gz UJXFKIPLABSZAY-VXGBXAGGSA-N 2 0 222.376 2.439 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1[NH2+][C@H](C)CC1CCC1 ZINC000629389277 361036184 /nfs/dbraw/zinc/03/61/84/361036184.db2.gz UGXWZSQWUWUGBY-KGYLQXTDSA-N 2 0 210.365 2.295 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1[NH2+]C1CCC(C)CC1 ZINC000629404451 361050197 /nfs/dbraw/zinc/05/01/97/361050197.db2.gz MZRVKXOIORWZJN-IFWUJCSASA-N 2 0 210.365 2.295 20 0 BEADRP CC[C@@H]1CCC[C@@H](C[NH2+]CCOCCC[NH3+])C1 ZINC000629399779 361051097 /nfs/dbraw/zinc/05/10/97/361051097.db2.gz BOIQOQIRBOOVLC-ZIAGYGMSSA-N 2 0 242.407 2.158 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+][C@@H]1CCCC[C@H]1C1CC1 ZINC000629408449 361059118 /nfs/dbraw/zinc/05/91/18/361059118.db2.gz VIYKHVQXOSAOTN-SCUASFONSA-N 2 0 222.376 2.295 20 0 BEADRP CC(C)[C@H]([NH2+]CC[C@H]1CC[NH2+]C1)C1CC1 ZINC000578994886 366686951 /nfs/dbraw/zinc/68/69/51/366686951.db2.gz WHVSAMWTPKPILW-YPMHNXCESA-N 2 0 210.365 2.010 20 0 BEADRP CCC[C@@H](C)[C@@H](CC)[NH2+]CC1([NH3+])CCOCC1 ZINC000629520313 361116751 /nfs/dbraw/zinc/11/67/51/361116751.db2.gz GEHBDLRLMPHYLG-CHWSQXEVSA-N 2 0 242.407 2.299 20 0 BEADRP C1CC1C1([NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)CC1 ZINC000309697898 491154649 /nfs/dbraw/zinc/15/46/49/491154649.db2.gz RXSVCAUIELJUKA-CHWSQXEVSA-N 2 0 220.360 2.145 20 0 BEADRP C1CC1C1([NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)CC1 ZINC000309697900 491154605 /nfs/dbraw/zinc/15/46/05/491154605.db2.gz RXSVCAUIELJUKA-QWHCGFSZSA-N 2 0 220.360 2.145 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+]CC2([NH3+])CCOCC2)cc1 ZINC000629524175 361122138 /nfs/dbraw/zinc/12/21/38/361122138.db2.gz MYWHLADYVGBZQJ-CYBMUJFWSA-N 2 0 248.370 2.154 20 0 BEADRP C[C@@H]([NH2+]CC1([NH3+])CCOCC1)C1CCCCC1 ZINC000629523305 361124235 /nfs/dbraw/zinc/12/42/35/361124235.db2.gz DHELLFFXYYBATO-GFCCVEGCSA-N 2 0 240.391 2.053 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[NH2+][C@H]1CC ZINC000629526279 361127642 /nfs/dbraw/zinc/12/76/42/361127642.db2.gz OTEGGOFFBJMZGW-MROQNXINSA-N 2 0 210.365 2.295 20 0 BEADRP Cc1cc(C)cc(CN(C)[C@@H](C)C[NH3+])c1 ZINC000158512970 361199824 /nfs/dbraw/zinc/19/98/24/361199824.db2.gz GCZMZLCWKREGCD-LBPRGKRZSA-N 2 0 206.333 2.082 20 0 BEADRP FC1(F)C[C@@H]1CC[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000622043718 370675542 /nfs/dbraw/zinc/67/55/42/370675542.db2.gz IQQINODSPYCCTB-FIQHERPVSA-N 2 0 244.329 2.009 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H]1CCc2c1cc(F)cc2F ZINC000622045236 370678282 /nfs/dbraw/zinc/67/82/82/370678282.db2.gz JLMPELTWBGROII-ISVAXAHUSA-N 2 0 240.297 2.279 20 0 BEADRP CC(C)CO[C@H]1C[C@@H]([NH2+]CC[C@H](C)[NH3+])C1(C)C ZINC000622045192 370678304 /nfs/dbraw/zinc/67/83/04/370678304.db2.gz GCNUALCOZHTVAF-XQQFMLRXSA-N 2 0 242.407 2.153 20 0 BEADRP [NH3+]CCCOCC[NH2+][C@H]1CCCC12CCCC2 ZINC000629536242 361398971 /nfs/dbraw/zinc/39/89/71/361398971.db2.gz FPXCHJZOGGQPMC-ZDUSSCGKSA-N 2 0 240.391 2.054 20 0 BEADRP CC[C@@H]1C[C@H](C)CC[C@@H]1[NH2+]CCOCCC[NH3+] ZINC000629537233 361401251 /nfs/dbraw/zinc/40/12/51/361401251.db2.gz JFIKCLDMTDVASS-MCIONIFRSA-N 2 0 242.407 2.156 20 0 BEADRP CCC[C@H](C)CCC[N@@H+]1CCCO[C@H](C[NH3+])C1 ZINC000629535735 361410207 /nfs/dbraw/zinc/41/02/07/361410207.db2.gz DPVNBTPXQRBXDG-UONOGXRCSA-N 2 0 242.407 2.252 20 0 BEADRP CC(C)C[C@H]([NH3+])C(=O)Nc1ccc([C@H](C)[NH3+])cc1 ZINC000429578284 201117708 /nfs/dbraw/zinc/11/77/08/201117708.db2.gz SGGWSVGFBJVDFK-GWCFXTLKSA-N 2 0 249.358 2.018 20 0 BEADRP C[C@H]([NH2+]C1CCC([NH+](C)C)CC1)[C@@H]1CCCO1 ZINC000429978431 201137108 /nfs/dbraw/zinc/13/71/08/201137108.db2.gz DVDPJPPVGNKOTR-ABXWRUBCSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)[C@H]1CCCO1 ZINC000429978432 201136413 /nfs/dbraw/zinc/13/64/13/201136413.db2.gz DVDPJPPVGNKOTR-BLYZHGLHSA-N 2 0 240.391 2.016 20 0 BEADRP CC[C@@H]1CCCC[C@H]1[NH2+][C@@H]1CC[NH2+][C@H]1C ZINC000629544289 361420602 /nfs/dbraw/zinc/42/06/02/361420602.db2.gz JBBDGIAWZIJJOG-UMSGYPCISA-N 2 0 210.365 2.295 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+][C@H]1CCCC12CCC2 ZINC000629545597 361426658 /nfs/dbraw/zinc/42/66/58/361426658.db2.gz LTJXHSHWOVGCLT-TUAOUCFPSA-N 2 0 208.349 2.049 20 0 BEADRP C[C@@H]1C[N@@H+](C[C@@H]2CCC[NH2+]C2)C[C@H](C)C1(F)F ZINC000629553170 361437176 /nfs/dbraw/zinc/43/71/76/361437176.db2.gz VJIZYJRUUSYQBX-GRYCIOLGSA-N 2 0 246.345 2.209 20 0 BEADRP CC(C)[C@H]1CCC[C@H]([NH2+][C@@H]2CC[NH2+]C2)C1 ZINC000629553237 361437197 /nfs/dbraw/zinc/43/71/97/361437197.db2.gz QWCMMFGDBNGKSZ-RWMBFGLXSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCCC12CC2)[C@H]1CCC[NH2+]1 ZINC000629554280 361440277 /nfs/dbraw/zinc/44/02/77/361440277.db2.gz HGYIPMFUXMZEAZ-RWMBFGLXSA-N 2 0 222.376 2.297 20 0 BEADRP CC(C)[C@H]1CCCC[C@@H]1[NH2+]CCOCCC[NH3+] ZINC000629541476 361416401 /nfs/dbraw/zinc/41/64/01/361416401.db2.gz PEXZPMKJPMLTGF-KGLIPLIRSA-N 2 0 242.407 2.156 20 0 BEADRP CC[C@H](c1ccccc1)[N@H+](C)CCOCC[NH3+] ZINC000629579297 361464214 /nfs/dbraw/zinc/46/42/14/361464214.db2.gz QUFZGMNSCYVKFH-CQSZACIVSA-N 2 0 236.359 2.045 20 0 BEADRP C[N@H+](CCOCC[NH3+])CCC1CCCCCC1 ZINC000629581361 361471170 /nfs/dbraw/zinc/47/11/70/361471170.db2.gz XYTPQBMKNNDEMU-UHFFFAOYSA-N 2 0 242.407 2.254 20 0 BEADRP COc1cccc2c1CN(C[C@H]1CCC[NH2+]C1)C2 ZINC000629580905 361471652 /nfs/dbraw/zinc/47/16/52/361471652.db2.gz YCPXODGWOVAGKT-LBPRGKRZSA-N 2 0 246.354 2.010 20 0 BEADRP C[C@]12C[NH2+]C[C@@]1(C)C[N@H+](CCC1CCCC1)C2 ZINC000629585294 361474476 /nfs/dbraw/zinc/47/44/76/361474476.db2.gz QGGSXXQYUIEDOY-GASCZTMLSA-N 2 0 236.403 2.498 20 0 BEADRP C[C@]12C[NH2+]C[C@@]1(C)C[N@H+](CC1CCCC1)C2 ZINC000629594986 361482140 /nfs/dbraw/zinc/48/21/40/361482140.db2.gz KZVJYKRSXRHXGS-OKILXGFUSA-N 2 0 222.376 2.108 20 0 BEADRP CC(C)=CCC[N@@H+]1C[C@@]2(C)C[NH2+]C[C@@]2(C)C1 ZINC000629595849 361483607 /nfs/dbraw/zinc/48/36/07/361483607.db2.gz ROFUUCSIMIZXRF-OKILXGFUSA-N 2 0 222.376 2.274 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+]CCC1CCCCC1 ZINC000629601356 361492258 /nfs/dbraw/zinc/49/22/58/361492258.db2.gz CWXJAQHQVNEZJZ-WCQYABFASA-N 2 0 210.365 2.297 20 0 BEADRP c1cc(C[NH+](C2CC2)C2CC2)c2c(c1)C[NH2+]CC2 ZINC000629566808 361457060 /nfs/dbraw/zinc/45/70/60/361457060.db2.gz IDWBQIXQWHMOSU-UHFFFAOYSA-N 2 0 242.366 2.459 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CCC(C)C)[C@H](C)C1 ZINC000151768844 201180795 /nfs/dbraw/zinc/18/07/95/201180795.db2.gz GHFFQHKDQDJCJY-CHWSQXEVSA-N 2 0 212.381 2.352 20 0 BEADRP CCCC[C@H](C[NH3+])NCc1ccc(COC)o1 ZINC000629647637 361537559 /nfs/dbraw/zinc/53/75/59/361537559.db2.gz CMZXJOYRZICTGG-LLVKDONJSA-N 2 0 240.347 2.033 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)C(C)(C)C ZINC000152459401 201200788 /nfs/dbraw/zinc/20/07/88/201200788.db2.gz VGHMXPUWMHNNPU-NEPJUHHUSA-N 2 0 224.392 2.495 20 0 BEADRP CC1(C[NH2+][C@H]2CC[NH2+]C23CCC3)CCC1 ZINC000629651175 361556046 /nfs/dbraw/zinc/55/60/46/361556046.db2.gz KSJVTQHYFRXFBC-NSHDSACASA-N 2 0 208.349 2.051 20 0 BEADRP [NH3+]C1CCC([NH2+]CCc2ccc(F)cc2)CC1 ZINC000094074042 181341158 /nfs/dbraw/zinc/34/11/58/181341158.db2.gz PRJZBSHPMYKBHT-UHFFFAOYSA-N 2 0 236.334 2.228 20 0 BEADRP [NH3+]C1CCC([NH2+]Cc2cc(F)ccc2F)CC1 ZINC000051692814 181341312 /nfs/dbraw/zinc/34/13/12/181341312.db2.gz ZLMFLACWPXBAHH-UHFFFAOYSA-N 2 0 240.297 2.324 20 0 BEADRP Cc1ccc(C[C@@H](C)[N@H+](C)CCC[NH3+])cc1 ZINC000435396778 201270051 /nfs/dbraw/zinc/27/00/51/201270051.db2.gz YJXXQWNACVRMLB-CYBMUJFWSA-N 2 0 220.360 2.207 20 0 BEADRP CCCCOCC[N@H+](CC)[C@@H]1CCC[NH2+]CC1 ZINC000435629573 201279732 /nfs/dbraw/zinc/27/97/32/201279732.db2.gz ULFPIWCRDUTBRZ-CQSZACIVSA-N 2 0 242.407 2.267 20 0 BEADRP CC[N@H+](Cc1cccc(N)c1)[C@@H]1CCC[NH2+]CC1 ZINC000435612986 201280330 /nfs/dbraw/zinc/28/03/30/201280330.db2.gz ILJZADQUCNMDIZ-OAHLLOKOSA-N 2 0 247.386 2.233 20 0 BEADRP CCc1cc(NC2CC[NH+](C3CC3)CC2)cc[nH+]1 ZINC000450234923 201287084 /nfs/dbraw/zinc/28/70/84/201287084.db2.gz VXIYAOSEGRUIMZ-UHFFFAOYSA-N 2 0 245.370 2.105 20 0 BEADRP C[NH2+]CCC[N@@H+]1CC[C@@H](c2ccc(OC)cc2)C1 ZINC000435875602 201289679 /nfs/dbraw/zinc/28/96/79/201289679.db2.gz TXQUEQXHEHPPEY-CQSZACIVSA-N 2 0 248.370 2.094 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCC[C@H]1c1ccccc1 ZINC000435872272 201290348 /nfs/dbraw/zinc/29/03/48/201290348.db2.gz NTBUYBNMDUBJEE-AWEZNQCLSA-N 2 0 218.344 2.433 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCC[C@H]1c1ccc(OC)cc1 ZINC000435886224 201296736 /nfs/dbraw/zinc/29/67/36/201296736.db2.gz URVFIVMCVZIMEY-HNNXBMFYSA-N 2 0 248.370 2.442 20 0 BEADRP [NH3+]C1CC[NH+](CCCCOc2ccccc2)CC1 ZINC000339414653 181343512 /nfs/dbraw/zinc/34/35/12/181343512.db2.gz IGMYSAASTWXHRL-UHFFFAOYSA-N 2 0 248.370 2.269 20 0 BEADRP C[NH2+]CCC[N@H+](C)[C@@H](C)Cc1ccc(C)cc1 ZINC000435873635 201292859 /nfs/dbraw/zinc/29/28/59/201292859.db2.gz DYZMRVUTUMFGHP-AWEZNQCLSA-N 2 0 234.387 2.467 20 0 BEADRP Cc1ccc2[nH+]ccc(N[C@@H](C)C[NH+](C)C)c2c1 ZINC000436709285 201333599 /nfs/dbraw/zinc/33/35/99/201333599.db2.gz VEZCGXAZEYGTKT-LBPRGKRZSA-N 2 0 243.354 2.327 20 0 BEADRP CSc1ccccc1C[C@@H](C)[NH2+]CCC[NH3+] ZINC000437768979 201371664 /nfs/dbraw/zinc/37/16/64/201371664.db2.gz CVDAULSPJKQCMS-LLVKDONJSA-N 2 0 238.400 2.278 20 0 BEADRP [NH3+]CCC[NH2+][C@H]1CCC[C@H]1c1ccccc1 ZINC000437779770 201372694 /nfs/dbraw/zinc/37/26/94/201372694.db2.gz CAJVAUYCYWRIBJ-KBPBESRZSA-N 2 0 218.344 2.261 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]C1CC(C)(F)C1 ZINC000453256545 202722273 /nfs/dbraw/zinc/72/22/73/202722273.db2.gz UFZLSYQEUJIYML-SRMYXAEUSA-N 2 0 228.355 2.195 20 0 BEADRP [NH3+]CC1CC[NH+](Cc2cc(F)ccc2F)CC1 ZINC000043458818 181364839 /nfs/dbraw/zinc/36/48/39/181364839.db2.gz BLGQXZCFGZYLMY-UHFFFAOYSA-N 2 0 240.297 2.136 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCCC[N@H+](C)C2CC2)CCO1 ZINC000453387785 202757038 /nfs/dbraw/zinc/75/70/38/202757038.db2.gz BFQXRSHIUUJALD-CHWSQXEVSA-N 2 0 240.391 2.018 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH+](C)CC2(C)CC2)[C@@H](C)C1 ZINC000573633584 364880669 /nfs/dbraw/zinc/88/06/69/364880669.db2.gz HDMHDWVVFURXKB-QWHCGFSZSA-N 2 0 224.392 2.449 20 0 BEADRP [NH3+]CCCC[NH2+]Cc1ccccc1OC(F)F ZINC000037715054 181377434 /nfs/dbraw/zinc/37/74/34/181377434.db2.gz UGORZVJHDKLPCZ-UHFFFAOYSA-N 2 0 244.285 2.117 20 0 BEADRP [NH3+]CCC[NH2+]Cc1ccccc1C(F)(F)F ZINC000037713078 181384012 /nfs/dbraw/zinc/38/40/12/181384012.db2.gz CJSJQIRNJMOELO-UHFFFAOYSA-N 2 0 232.249 2.144 20 0 BEADRP C[C@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1ccoc1 ZINC000574269160 365023305 /nfs/dbraw/zinc/02/33/05/365023305.db2.gz LBQXRGUQMFZJHX-WCQYABFASA-N 2 0 222.332 2.462 20 0 BEADRP CC[C@H](C)[N@H+](C)CCCc1cncn1C ZINC000574288294 365029085 /nfs/dbraw/zinc/02/90/85/365029085.db2.gz GTMYPFRKLPIUGS-NSHDSACASA-N 2 0 209.337 2.083 20 0 BEADRP Cc1cnccc1C[NH2+]C1CCC([NH+](C)C)CC1 ZINC000574628883 365104416 /nfs/dbraw/zinc/10/44/16/365104416.db2.gz KGNJITQGZKKFAS-UHFFFAOYSA-N 2 0 247.386 2.352 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+][C@@H]1CCC[C@@H](F)C1 ZINC000575989224 365437094 /nfs/dbraw/zinc/43/70/94/365437094.db2.gz XILGATKOSNNGGP-LPWJVIDDSA-N 2 0 228.355 2.245 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H](C)c1ccoc1 ZINC000576027218 365453955 /nfs/dbraw/zinc/45/39/55/365453955.db2.gz WAPMUEGKLKWPFK-MNOVXSKESA-N 2 0 210.321 2.448 20 0 BEADRP CC[N@H+](C)C[C@@H]1CC[NH+](CC=C(C)C)C1 ZINC000173916477 365454968 /nfs/dbraw/zinc/45/49/68/365454968.db2.gz XDUFLPGFWCCERB-ZDUSSCGKSA-N 2 0 210.365 2.226 20 0 BEADRP CC[N@H+](C)C[C@@H]1CC[NH+](CC2CCCC2)C1 ZINC000173907174 365455365 /nfs/dbraw/zinc/45/53/65/365455365.db2.gz WTSLFYMGLGTEMF-AWEZNQCLSA-N 2 0 224.392 2.450 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1C[C@H]1C1CC1)c1cnccc1N ZINC000579822513 367023679 /nfs/dbraw/zinc/02/36/79/367023679.db2.gz XNLZXMSECIRUHK-USWWRNFRSA-N 2 0 231.343 2.191 20 0 BEADRP C[NH2+]Cc1ccc(N[C@H]2CCC[C@H]([NH3+])C2)cc1 ZINC000579978705 367114137 /nfs/dbraw/zinc/11/41/37/367114137.db2.gz AHQUTWOZNMYUJD-JSGCOSHPSA-N 2 0 233.359 2.088 20 0 BEADRP C(=C\c1ccccc1)\CN1CC[C@]2(CC[NH2+]C2)C1 ZINC000381082599 367348888 /nfs/dbraw/zinc/34/88/88/367348888.db2.gz IUNQKCWCRVIKKQ-OUOZUETKSA-N 2 0 242.366 2.385 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000381128747 367352979 /nfs/dbraw/zinc/35/29/79/367352979.db2.gz KCKMBZCRXPGSDU-HZSPNIEDSA-N 2 0 224.392 2.352 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H](C)C(C)(C)CC ZINC000581185085 367286711 /nfs/dbraw/zinc/28/67/11/367286711.db2.gz LFFJESZIHLECOP-LLVKDONJSA-N 2 0 200.370 2.400 20 0 BEADRP C[C@@H]1CC[N@H+](CC[C@@H]2CCC[NH2+]C2)[C@H]1C ZINC000380806857 367306218 /nfs/dbraw/zinc/30/62/18/367306218.db2.gz QNEYGBMOYSWATM-AGIUHOORSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]1C[C@H]([NH2+]C[C@@H]2C[C@H]2C2CC2)CC[N@@H+]1C ZINC000382184838 367494621 /nfs/dbraw/zinc/49/46/21/367494621.db2.gz AWEVJURBBLLHBG-DEQVHRJGSA-N 2 0 222.376 2.105 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2C[C@H]2C2CC2)CC[N@@H+]1C ZINC000382184840 367495065 /nfs/dbraw/zinc/49/50/65/367495065.db2.gz AWEVJURBBLLHBG-SAXRGWBVSA-N 2 0 222.376 2.105 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+]CCC[NH2+]C1CC1 ZINC000382526916 367533515 /nfs/dbraw/zinc/53/35/15/367533515.db2.gz BOXMJLABJLPPDS-YPMHNXCESA-N 2 0 210.365 2.297 20 0 BEADRP c1ccc2c(c1)CC[C@H]([NH2+]CCC[NH2+]C1CC1)C2 ZINC000382550149 367537178 /nfs/dbraw/zinc/53/71/78/367537178.db2.gz SWTMRHSPQKBKPB-INIZCTEOSA-N 2 0 244.382 2.276 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]CCC[NH2+]C2CC2)C1 ZINC000382604785 367548575 /nfs/dbraw/zinc/54/85/75/367548575.db2.gz VRIYZMDTRDOFGO-DGCLKSJQSA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@@H]([NH2+][C@@H](CCC[NH3+])COC)C1CCCC1 ZINC000382796445 367557368 /nfs/dbraw/zinc/55/73/68/367557368.db2.gz UXGGQJNOIUPTEN-UONOGXRCSA-N 2 0 242.407 2.299 20 0 BEADRP CCC[C@@H](C)[C@H]1CCC[N@@H+]1CCC[NH2+]C ZINC000581612320 367634527 /nfs/dbraw/zinc/63/45/27/367634527.db2.gz LVGZUFLGDTUUPD-CHWSQXEVSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCC[NH+]2CCCCC2)[C@H](C)O1 ZINC000385004772 367770901 /nfs/dbraw/zinc/77/09/01/367770901.db2.gz WEJBSAMKUBYYPR-RDBSUJKOSA-N 2 0 240.391 2.018 20 0 BEADRP C[N@H+](Cc1ccnc2ccccc12)C1CC([NH3+])C1 ZINC000384849230 367743219 /nfs/dbraw/zinc/74/32/19/367743219.db2.gz BCUUKTCLGNFELS-UHFFFAOYSA-N 2 0 241.338 2.156 20 0 BEADRP CC/C=C/C[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000384889884 367752396 /nfs/dbraw/zinc/75/23/96/367752396.db2.gz SZQBPCLDVKAEIE-HNFMAKEJSA-N 2 0 208.349 2.169 20 0 BEADRP COCCC[C@H](C)[NH2+]Cc1ccc(C[NH3+])cc1 ZINC000581884878 367875143 /nfs/dbraw/zinc/87/51/43/367875143.db2.gz KGHNEXRQGHFBRE-LBPRGKRZSA-N 2 0 236.359 2.050 20 0 BEADRP C[C@@H](CN1CC[C@@H]2C[NH2+]C[C@@H]21)c1ccccc1 ZINC000385410141 367826245 /nfs/dbraw/zinc/82/62/45/367826245.db2.gz YUYBDAMMQFDELY-CFVMTHIKSA-N 2 0 230.355 2.084 20 0 BEADRP C[C@@H]1C[C@@H](C[N@@H+]2CCSCC[C@H]2C)CC[NH2+]1 ZINC000385411263 367826573 /nfs/dbraw/zinc/82/65/73/367826573.db2.gz UVBSIKWXLRAHRU-UPJWGTAASA-N 2 0 242.432 2.202 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]Cc1scnc1C1CC1 ZINC000581824187 367832902 /nfs/dbraw/zinc/83/29/02/367832902.db2.gz AXNFSIAXDPSIOT-DTWKUNHWSA-N 2 0 239.388 2.236 20 0 BEADRP CC[N@H+](CCC1CC1)C[C@H]1CC[NH2+][C@@H](C)C1 ZINC000385489132 367835021 /nfs/dbraw/zinc/83/50/21/367835021.db2.gz DXBFFHYIWKLTDL-JSGCOSHPSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]([N@H+](C)CC[C@H]1CC[NH2+]C1)C1(C)CC1 ZINC000385524041 367840186 /nfs/dbraw/zinc/84/01/86/367840186.db2.gz WANLMNUJDXXFEQ-VXGBXAGGSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]([NH2+]CC1(C)CCC1)[C@@H]1CCCC[NH2+]1 ZINC000386127262 367915957 /nfs/dbraw/zinc/91/59/57/367915957.db2.gz NXXBKFVXXHSRPO-RYUDHWBXSA-N 2 0 210.365 2.297 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+][C@@H]1CC12CCCC2 ZINC000387025126 368042310 /nfs/dbraw/zinc/04/23/10/368042310.db2.gz NGAYLCGCKNEZAR-YNEHKIRRSA-N 2 0 222.376 2.426 20 0 BEADRP C(C[NH2+]C[C@@H]1C[C@H]2C[C@H]2C1)C[NH+]1CCCCC1 ZINC000252860594 368164356 /nfs/dbraw/zinc/16/43/56/368164356.db2.gz NAVJHFPJKQAEOV-QDMKHBRRSA-N 2 0 236.403 2.498 20 0 BEADRP C[C@H](c1ccccc1)[N@@H+]1CC[C@H]([C@H](C)[NH3+])C1 ZINC000059868982 368534584 /nfs/dbraw/zinc/53/45/84/368534584.db2.gz MRWADXJLYWZRTH-SCRDCRAPSA-N 2 0 218.344 2.417 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+]CC2CC[NH2+]CC2)o1 ZINC000086700572 368883745 /nfs/dbraw/zinc/88/37/45/368883745.db2.gz VDXFYPKQPVYZBR-LLVKDONJSA-N 2 0 222.332 2.238 20 0 BEADRP Cc1ccc([C@H](C)[NH2+]CC2CC[NH2+]CC2)o1 ZINC000086700575 368883966 /nfs/dbraw/zinc/88/39/66/368883966.db2.gz VDXFYPKQPVYZBR-NSHDSACASA-N 2 0 222.332 2.238 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)[C@H]1C[C@H]1C ZINC000623657271 368998192 /nfs/dbraw/zinc/99/81/92/368998192.db2.gz MNZNXGOUYWTIMB-RFGFWPKPSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1CCC[C@H]1[NH2+]C[C@H]1CCCC[N@H+](C)C1 ZINC000623656344 368993237 /nfs/dbraw/zinc/99/32/37/368993237.db2.gz SFHFTFUTXJPCJT-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1ccc(C[N@@H+]2C[C@@H](C[NH3+])[C@H](C)C2)c(C)c1 ZINC000631837283 369096073 /nfs/dbraw/zinc/09/60/73/369096073.db2.gz QPGYCBVYQTXIHP-UKRRQHHQSA-N 2 0 232.371 2.330 20 0 BEADRP C[C@@H]1C[N@H+](C[C@@H]2CCCC[C@H]2C)C[C@H]1C[NH3+] ZINC000631837328 369096444 /nfs/dbraw/zinc/09/64/44/369096444.db2.gz QSJAIXGKHHEXPK-YIYPIFLZSA-N 2 0 224.392 2.339 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]CCCC1CC1 ZINC000567647712 326237785 /nfs/dbraw/zinc/23/77/85/326237785.db2.gz OOPAZXOTCGSFMK-OLZOCXBDSA-N 2 0 210.365 2.426 20 0 BEADRP [NH3+][C@H]1CCCCC[C@@H]1[NH2+]CCCC1CC1 ZINC000567647714 326238066 /nfs/dbraw/zinc/23/80/66/326238066.db2.gz OOPAZXOTCGSFMK-STQMWFEESA-N 2 0 210.365 2.426 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CCC[C@H](F)C1 ZINC000567735662 326253215 /nfs/dbraw/zinc/25/32/15/326253215.db2.gz OQJSYQNPUFPWCW-CYDGBPFRSA-N 2 0 228.355 2.374 20 0 BEADRP CCOC1(C)CN(CCCc2cnccc2C)C1 ZINC000459611643 203316535 /nfs/dbraw/zinc/31/65/35/203316535.db2.gz AWTMLMZTELXLMY-UHFFFAOYSA-N 2 0 248.370 2.433 20 0 BEADRP Cc1ccc(C[NH2+]CC[C@@H]2CCC[N@@H+](C)C2)o1 ZINC000459732738 203344940 /nfs/dbraw/zinc/34/49/40/203344940.db2.gz MTTNCEFQVMZDPM-ZDUSSCGKSA-N 2 0 236.359 2.410 20 0 BEADRP Fc1cccc2c1CN(CCCn1ccnc1)C2 ZINC000459747242 203354254 /nfs/dbraw/zinc/35/42/54/203354254.db2.gz KYXFEHABCBHDAD-UHFFFAOYSA-N 2 0 245.301 2.428 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC000459776122 203366307 /nfs/dbraw/zinc/36/63/07/203366307.db2.gz KCANJWWJJMKGRC-MJBXVCDLSA-N 2 0 224.392 2.497 20 0 BEADRP CCC[C@H](C)[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC000459742364 203351970 /nfs/dbraw/zinc/35/19/70/203351970.db2.gz VVIVBYGCKLAKNH-QWHCGFSZSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@H]([NH2+]C[C@H](C1CC1)N(C)C)C1CCCC1 ZINC000166319455 203387681 /nfs/dbraw/zinc/38/76/81/203387681.db2.gz WZTGERVXOBRHLU-SMDDNHRTSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1CCC[C@H]([N@H+](C)CC[C@H]2CC[NH2+]C2)C1 ZINC000251724761 369913368 /nfs/dbraw/zinc/91/33/68/369913368.db2.gz IRNIRGJUUPXTHA-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP CC[NH+]1CCC(CC[NH2+]CC2(C)CC2)CC1 ZINC000309941669 370276642 /nfs/dbraw/zinc/27/66/42/370276642.db2.gz BVWVBZPYCMLZLT-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP CC1CC(C[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)C1 ZINC000621384333 370328076 /nfs/dbraw/zinc/32/80/76/370328076.db2.gz CCIHNBZXGNMDBN-CLRIEMFWSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC[C@@H]2CC2(F)F)CC[N@@H+]1C ZINC000621770568 370513015 /nfs/dbraw/zinc/51/30/15/370513015.db2.gz TWRSSIHORPTSIH-GMTAPVOTSA-N 2 0 232.318 2.104 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CC1(F)F)C1CC[NH+](C)CC1 ZINC000621769670 370513119 /nfs/dbraw/zinc/51/31/19/370513119.db2.gz FJIHLYIEWUIEJJ-ZYHUDNBSSA-N 2 0 246.345 2.352 20 0 BEADRP CC[NH+]1CCC([NH2+]CC[C@@H]2CC2(F)F)CC1 ZINC000621734641 370491568 /nfs/dbraw/zinc/49/15/68/370491568.db2.gz RHSBYGMRQQSXOZ-SNVBAGLBSA-N 2 0 232.318 2.106 20 0 BEADRP CCC[NH+]1CCC([NH2+]CC2CC(C)C2)CC1 ZINC000621739681 370497264 /nfs/dbraw/zinc/49/72/64/370497264.db2.gz RWJBICHBBJBFJO-UHFFFAOYSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1cc(C[N@H+]2CCC[C@@H](C)[C@@H]2CC[NH3+])ccn1 ZINC000621776325 370524573 /nfs/dbraw/zinc/52/45/73/370524573.db2.gz JCDVDBSOLBTJKP-DOMZBBRYSA-N 2 0 247.386 2.339 20 0 BEADRP C[C@@H]1C[C@H]([NH3+])CCN1Cc1cncc(Cl)c1 ZINC000621776670 370525441 /nfs/dbraw/zinc/52/54/41/370525441.db2.gz SESFCKNLZNRAHN-BXKDBHETSA-N 2 0 239.750 2.047 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+]CC(C1CC1)C1CC1 ZINC000568749072 326374644 /nfs/dbraw/zinc/37/46/44/326374644.db2.gz UPUCSORANXLJAS-NHYWBVRUSA-N 2 0 236.403 2.400 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H](C)[C@@H]1CCCCO1 ZINC000623849220 371123580 /nfs/dbraw/zinc/12/35/80/371123580.db2.gz ZNTBMMKWRHFQPK-KGLIPLIRSA-N 2 0 242.407 2.266 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H](C)[C@H]1CCCCO1 ZINC000623849222 371124422 /nfs/dbraw/zinc/12/44/22/371124422.db2.gz ZNTBMMKWRHFQPK-ZIAGYGMSSA-N 2 0 242.407 2.266 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H](C)CCc1ccco1 ZINC000569106282 326390509 /nfs/dbraw/zinc/39/05/09/326390509.db2.gz YDLWGDJFCXDJJW-GFCCVEGCSA-N 2 0 224.348 2.190 20 0 BEADRP CCC[C@H](C)[NH2+]C[C@H]1CCCC[N@H+](C)C1 ZINC000624120035 371319310 /nfs/dbraw/zinc/31/93/10/371319310.db2.gz QEFGPVZCTRNONB-QWHCGFSZSA-N 2 0 212.381 2.497 20 0 BEADRP CC(C)[C@H](C)[NH2+]C[C@@H]1CCCC[N@H+](C)C1 ZINC000624120448 371321834 /nfs/dbraw/zinc/32/18/34/371321834.db2.gz ZKEXPWFGPDJRIO-STQMWFEESA-N 2 0 212.381 2.352 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]Cc2ccc(F)c(F)c2)C1 ZINC000093215562 181648813 /nfs/dbraw/zinc/64/88/13/181648813.db2.gz DHLPWEFTDVFWTA-QWRGUYRKSA-N 2 0 240.297 2.324 20 0 BEADRP C[N@@H+]1CCCC[C@@H](C[NH2+][C@H]2CCC2(C)C)C1 ZINC000624123395 371324869 /nfs/dbraw/zinc/32/48/69/371324869.db2.gz LCPHBRXYOJQBIG-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP C/C=C/C[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000624197658 371386579 /nfs/dbraw/zinc/38/65/79/371386579.db2.gz SOCPGOPIOIANRU-AATRIKPKSA-N 2 0 210.365 2.415 20 0 BEADRP C/C=C\C[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000624197249 371384570 /nfs/dbraw/zinc/38/45/70/371384570.db2.gz GTEWQFOGMPAADU-IHWYPQMZSA-N 2 0 208.349 2.027 20 0 BEADRP C[N@@H+]1CCC[C@H]1CC[NH+]1CCC(C)(C)C1 ZINC000162075547 371608103 /nfs/dbraw/zinc/60/81/03/371608103.db2.gz UPUJFSQYKDLGOM-LBPRGKRZSA-N 2 0 210.365 2.203 20 0 BEADRP CC[C@@H](CSC)[NH2+][C@H](C)C1CC[NH+](C)CC1 ZINC000162359272 371663902 /nfs/dbraw/zinc/66/39/02/371663902.db2.gz GRSIQDAYYFSEFR-YPMHNXCESA-N 2 0 244.448 2.448 20 0 BEADRP COCCC[C@@H](C)[NH2+]C[C@H](C)C[NH+]1CCCC1 ZINC000178244211 134305181 /nfs/dbraw/zinc/30/51/81/134305181.db2.gz HISJLBWNRKXGEN-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP Cc1ccc(C[NH2+]CC2=CC[N@H+](C)CC2)c(F)c1 ZINC000631108444 372203309 /nfs/dbraw/zinc/20/33/09/372203309.db2.gz PEQSCSWUOLHFFS-UHFFFAOYSA-N 2 0 248.345 2.486 20 0 BEADRP CCCC[NH+]1CCC([NH2+]C2CCOCC2)CC1 ZINC000037149878 168825552 /nfs/dbraw/zinc/82/55/52/168825552.db2.gz GTSPEJMPIOKJDS-UHFFFAOYSA-N 2 0 240.391 2.020 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CC(C)(C)F)[C@@H]2CCC[C@H]21 ZINC000631665963 372491266 /nfs/dbraw/zinc/49/12/66/372491266.db2.gz ZWTNVFBMOAAQNR-SDDRHHMPSA-N 2 0 228.355 2.197 20 0 BEADRP Cc1cc(C)c(C[N@@H+](C)CC(C)(C)C[NH3+])c(C)n1 ZINC000631822192 372598958 /nfs/dbraw/zinc/59/89/58/372598958.db2.gz WAVTUSWFKDBUBI-UHFFFAOYSA-N 2 0 249.402 2.424 20 0 BEADRP Cc1cc(C)c(C[N@H+]2C[C@H](C[NH3+])C[C@@H]2C)c(C)n1 ZINC000631822440 372599333 /nfs/dbraw/zinc/59/93/33/372599333.db2.gz DETYDOCUIBQAKA-JSGCOSHPSA-N 2 0 247.386 2.176 20 0 BEADRP CCC(C)(C)CC[N@H+]1C[C@@H](C[NH3+])[C@H](C)C1 ZINC000631837985 372607795 /nfs/dbraw/zinc/60/77/95/372607795.db2.gz YLUVTZHTSBIQDK-VXGBXAGGSA-N 2 0 212.381 2.339 20 0 BEADRP Cc1ncc(CN2CCCCC[C@@H]([NH3+])C2)s1 ZINC000631834182 372618036 /nfs/dbraw/zinc/61/80/36/372618036.db2.gz QYBPYWSWUBMJTG-LLVKDONJSA-N 2 0 239.388 2.155 20 0 BEADRP C[C@@H](c1ccncc1)N1CCCCC[C@@H]([NH3+])C1 ZINC000631834323 372618504 /nfs/dbraw/zinc/61/85/04/372618504.db2.gz VBHAMWJUZCCCNC-GXTWGEPZSA-N 2 0 233.359 2.346 20 0 BEADRP CC[C@H](CC(F)F)C[N@H+]1C[C@@H](C[NH3+])[C@H](C)C1 ZINC000631837121 372628025 /nfs/dbraw/zinc/62/80/25/372628025.db2.gz NBLOHWQOODGQFJ-GMTAPVOTSA-N 2 0 234.334 2.194 20 0 BEADRP CCc1cccc(C[N@@H+]2C[C@H](C)[C@H](C[NH3+])C2)c1 ZINC000631837950 372630254 /nfs/dbraw/zinc/63/02/54/372630254.db2.gz HMWBIJGXNDHXGY-SWLSCSKDSA-N 2 0 232.371 2.276 20 0 BEADRP Cc1ccccc1CCC[N@@H+]1C[C@@H](C[NH3+])[C@H](C)C1 ZINC000631840293 372636810 /nfs/dbraw/zinc/63/68/10/372636810.db2.gz RFMJLNFFCMOCDE-GDBMZVCRSA-N 2 0 246.398 2.454 20 0 BEADRP Cc1ccccc1C[N@H+]1C[C@H](C)[C@H](C[NH3+])C1 ZINC000631842688 372640824 /nfs/dbraw/zinc/64/08/24/372640824.db2.gz DNOHWCIEPPAUDF-GXTWGEPZSA-N 2 0 218.344 2.022 20 0 BEADRP C[C@H]1C[N@H+](Cc2ccc(Cl)cc2)C[C@H]1C[NH3+] ZINC000631845161 372642720 /nfs/dbraw/zinc/64/27/20/372642720.db2.gz UVCIDVCTSUUJOK-CMPLNLGQSA-N 2 0 238.762 2.367 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCC[C@H](C2CCC2)CC1 ZINC000631872412 372673592 /nfs/dbraw/zinc/67/35/92/372673592.db2.gz AIPXEVPYANMVEH-AWEZNQCLSA-N 2 0 224.392 2.498 20 0 BEADRP CC(C)[C@H]1CCC[N@@H+]1C[C@]1(C)CC[NH2+]C1 ZINC000084126959 205794575 /nfs/dbraw/zinc/79/45/75/205794575.db2.gz DGFYXAXNYDSJPT-CHWSQXEVSA-N 2 0 210.365 2.106 20 0 BEADRP CCN(CC[NH3+])Cc1ccc2ncccc2c1 ZINC000041160361 374116498 /nfs/dbraw/zinc/11/64/98/374116498.db2.gz WMFPGYRAKJHYSC-UHFFFAOYSA-N 2 0 229.327 2.015 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CCCCF)[C@@H](C)C1 ZINC000309063944 170013240 /nfs/dbraw/zinc/01/32/40/170013240.db2.gz YHLQEGPPODKSSE-NWDGAFQWSA-N 2 0 216.344 2.056 20 0 BEADRP C[C@@H]1CCC[N@H+](CC[C@H]2CCC[NH+]2C)C1 ZINC000246575495 374276255 /nfs/dbraw/zinc/27/62/55/374276255.db2.gz CEFHIKARRVAVCP-CHWSQXEVSA-N 2 0 210.365 2.203 20 0 BEADRP COCC[C@H]1CCC[C@@H]1[NH2+][C@@H]1CCCC[C@H]1[NH3+] ZINC000424378987 206038281 /nfs/dbraw/zinc/03/82/81/206038281.db2.gz UUFJQBUOTYYZPN-YIYPIFLZSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H](Cc1ccoc1)[NH2+][C@@H]1CCCC[C@H]1[NH3+] ZINC000424377727 206038335 /nfs/dbraw/zinc/03/83/35/206038335.db2.gz RRMXLNXSCLWZLD-CYZMBNFOSA-N 2 0 222.332 2.070 20 0 BEADRP CCC[N@H+](C)CCCCn1ccnc1C ZINC000120418853 169075993 /nfs/dbraw/zinc/07/59/93/169075993.db2.gz CXTNOZAYOSCGLH-UHFFFAOYSA-N 2 0 209.337 2.314 20 0 BEADRP Oc1ccc(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000106868641 183270528 /nfs/dbraw/zinc/27/05/28/183270528.db2.gz YBWMVOTYQJDMMG-ZIAGYGMSSA-N 2 0 246.354 2.109 20 0 BEADRP CCC[NH+]1CCC(C[NH2+]C[C@H]2C[C@@H]2C)CC1 ZINC000336783187 169186286 /nfs/dbraw/zinc/18/62/86/169186286.db2.gz ZQXYQPPXAPHEFL-GXTWGEPZSA-N 2 0 224.392 2.354 20 0 BEADRP CCC[NH+]1CCC(C[NH2+][C@@H](C)[C@@H](C)OC)CC1 ZINC000361156067 169186358 /nfs/dbraw/zinc/18/63/58/169186358.db2.gz QPROAIYPBCARSO-QWHCGFSZSA-N 2 0 242.407 2.121 20 0 BEADRP CCC[NH+]1CCC([NH2+]CCc2ccncc2)CC1 ZINC000048484495 169187809 /nfs/dbraw/zinc/18/78/09/169187809.db2.gz KUNXZILTPXCFIR-UHFFFAOYSA-N 2 0 247.386 2.088 20 0 BEADRP CCC[NH+]1CCC([NH2+]CCC(C)(F)F)CC1 ZINC000357715901 169188312 /nfs/dbraw/zinc/18/83/12/169188312.db2.gz YQXUFPCEJQWEGC-UHFFFAOYSA-N 2 0 234.334 2.496 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H]2C[C@H](C)[C@H]2C)CC1 ZINC000309428911 169189110 /nfs/dbraw/zinc/18/91/10/169189110.db2.gz YWQOZTAOPPLOIS-OUCADQQQSA-N 2 0 224.392 2.495 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+]C2CCCC2)C1 ZINC000076453760 169206423 /nfs/dbraw/zinc/20/64/23/169206423.db2.gz BUPFBXZFKMQSLA-LBPRGKRZSA-N 2 0 210.365 2.251 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+]C[C@@H]2CCSC2)C1 ZINC000309942950 169207640 /nfs/dbraw/zinc/20/76/40/169207640.db2.gz CGXZLYTYHQSSOW-STQMWFEESA-N 2 0 242.432 2.061 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H]2C[C@@H](C)[C@H]2C)C1 ZINC000309976871 169209058 /nfs/dbraw/zinc/20/90/58/169209058.db2.gz UBJWWFHJAFZJFP-AAVRWANBSA-N 2 0 224.392 2.352 20 0 BEADRP c1cc(C[NH2+]CC2CC[NH+](C3CC3)CC2)ccn1 ZINC000278534952 183350296 /nfs/dbraw/zinc/35/02/96/183350296.db2.gz VWRLJMIJNOVKNV-UHFFFAOYSA-N 2 0 245.370 2.046 20 0 BEADRP c1cc(C[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)cs1 ZINC000037408352 183350638 /nfs/dbraw/zinc/35/06/38/183350638.db2.gz ZSTOYRSCDSVWHW-NSHDSACASA-N 2 0 236.384 2.322 20 0 BEADRP c1[nH+]cn2cc(C[NH2+]C3CCSCC3)ccc12 ZINC000297550559 183375687 /nfs/dbraw/zinc/37/56/87/183375687.db2.gz PSCDBSLVYLTDHK-UHFFFAOYSA-N 2 0 247.367 2.320 20 0 BEADRP CCC[NH2+][C@H](C)CCC[NH+](CC)CC ZINC000019915220 169286477 /nfs/dbraw/zinc/28/64/77/169286477.db2.gz HWZXTGYOKNVBBZ-GFCCVEGCSA-N 2 0 200.370 2.497 20 0 BEADRP c1ccc(CCC[N@@H+]2CC[C@H]3[NH2+]CC[C@@H]3C2)cc1 ZINC000336794652 183391173 /nfs/dbraw/zinc/39/11/73/183391173.db2.gz DPDRBMHDXUSNPD-HZPDHXFCSA-N 2 0 244.382 2.303 20 0 BEADRP c1ccc(C[NH+]2CCC([C@@H]3CCC[NH2+]3)CC2)nc1 ZINC000063197613 183397533 /nfs/dbraw/zinc/39/75/33/183397533.db2.gz HWSQKZUHRCRALA-HNNXBMFYSA-N 2 0 245.370 2.046 20 0 BEADRP c1ccc2c(NC[C@H]3CCC[NH2+]3)cc[nH+]c2c1 ZINC000053255486 183440072 /nfs/dbraw/zinc/44/00/72/183440072.db2.gz GLRRFNVWIBOGNG-LLVKDONJSA-N 2 0 227.311 2.399 20 0 BEADRP CCC[C@@H](C)[NH2+]CCC1CC[NH+](C)CC1 ZINC000122137379 169369407 /nfs/dbraw/zinc/36/94/07/169369407.db2.gz MEWBKRVDOMOSPR-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP CC[N@H+](CC[C@H]1CCC[NH+]1C)CC(C)C ZINC000179308093 134319817 /nfs/dbraw/zinc/31/98/17/134319817.db2.gz TUMVKMUVFGPVMH-CYBMUJFWSA-N 2 0 212.381 2.449 20 0 BEADRP CC(C)CCOCCN1CCC[C@H](C)[C@@H]1C[NH3+] ZINC000221456620 134324646 /nfs/dbraw/zinc/32/46/46/134324646.db2.gz XPMDIPCGHYBKTL-KBPBESRZSA-N 2 0 242.407 2.108 20 0 BEADRP CCC[NH+]1CCC([NH2+]C[C@@H]2CC2(C)C)CC1 ZINC000223812914 134342867 /nfs/dbraw/zinc/34/28/67/134342867.db2.gz HAMQIRVRKZHLST-LBPRGKRZSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)C[C@@H](C[NH2+]C[C@@H]1CCSC1)N(C)C ZINC000224307655 134346017 /nfs/dbraw/zinc/34/60/17/134346017.db2.gz WSKJQQXTTRIFIC-STQMWFEESA-N 2 0 244.448 2.305 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+]C[C@@H]1CCSC1 ZINC000226373785 134364658 /nfs/dbraw/zinc/36/46/58/134364658.db2.gz MRUJVNFTMJHXSL-LBPRGKRZSA-N 2 0 230.421 2.059 20 0 BEADRP CC[C@@H](C)C[N@H+](C)CC[C@@H]([NH3+])C(C)C ZINC000226431052 134365429 /nfs/dbraw/zinc/36/54/29/134365429.db2.gz YEMUEODYKFDVIA-VXGBXAGGSA-N 2 0 200.370 2.338 20 0 BEADRP CC1(C)CCC[N@H+](CC2CC[NH2+]CC2)C1 ZINC000069793386 383846292 /nfs/dbraw/zinc/84/62/92/383846292.db2.gz JGXDINJKSMQFIX-UHFFFAOYSA-N 2 0 210.365 2.108 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCC(C)(C)C2)C1 ZINC000087771483 383865595 /nfs/dbraw/zinc/86/55/95/383865595.db2.gz PPPFFLUGQOLAIT-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP CCC(CC)[NH2+][C@@H]1C[C@@H](C)N(C2CC2)C1 ZINC000131944113 383909233 /nfs/dbraw/zinc/90/92/33/383909233.db2.gz AQQCETSLQMXRSY-ZYHUDNBSSA-N 2 0 210.365 2.390 20 0 BEADRP C[C@@H](Cc1ccoc1)[NH2+]CCCCn1ccnc1 ZINC000560126807 383915724 /nfs/dbraw/zinc/91/57/24/383915724.db2.gz KWCSZAFAEWELTL-ZDUSSCGKSA-N 2 0 247.342 2.477 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)o1 ZINC000401109885 383933469 /nfs/dbraw/zinc/93/34/69/383933469.db2.gz GXLWTLVBTGYFQI-RWMBFGLXSA-N 2 0 234.343 2.066 20 0 BEADRP C[C@H](Cc1cccs1)[NH2+][C@@H]1CC[C@H](C[NH3+])C1 ZINC000643542622 383980872 /nfs/dbraw/zinc/98/08/72/383980872.db2.gz SKNPIDJQVFTGRZ-GRYCIOLGSA-N 2 0 238.400 2.396 20 0 BEADRP Cc1ccc([C@H](C)[NH2+][C@H]2CC[C@@H](C[NH3+])C2)c(C)n1 ZINC000643542789 383983852 /nfs/dbraw/zinc/98/38/52/383983852.db2.gz ZQSCPSHUKJGPOC-MJBXVCDLSA-N 2 0 247.386 2.476 20 0 BEADRP CC[N@H+](CCC1CC[NH2+]CC1)CC(C)C ZINC000037111666 383942122 /nfs/dbraw/zinc/94/21/22/383942122.db2.gz DKKRKFKBQLKSPL-UHFFFAOYSA-N 2 0 212.381 2.354 20 0 BEADRP CS[C@@H]1CCCC[N@H+](CC2CC[NH2+]CC2)C1 ZINC000336460631 383951777 /nfs/dbraw/zinc/95/17/77/383951777.db2.gz QFNGEKQFXOGUJB-CYBMUJFWSA-N 2 0 242.432 2.204 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+]CCC[NH2+]C2CC2)c(C)n1 ZINC000643545097 384009828 /nfs/dbraw/zinc/00/98/28/384009828.db2.gz PQKFJXBCLPMRAL-GFCCVEGCSA-N 2 0 247.386 2.491 20 0 BEADRP C1CC1C([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)C1CC1 ZINC000643546530 384014607 /nfs/dbraw/zinc/01/46/07/384014607.db2.gz QFLOIVDLVGRIPS-ZDUSSCGKSA-N 2 0 234.387 2.439 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]1[NH2+]CCc1cccc2[nH]ccc21 ZINC000569447680 384050472 /nfs/dbraw/zinc/05/04/72/384050472.db2.gz NVVMYZODUOHQDG-ZFWWWQNUSA-N 2 0 243.354 2.180 20 0 BEADRP C[C@@H]([NH3+])[C@H]1CCC[N@H+](Cc2ccsc2)C1 ZINC000069627039 384051226 /nfs/dbraw/zinc/05/12/26/384051226.db2.gz ACIPRISQWRHXBB-PWSUYJOCSA-N 2 0 224.373 2.307 20 0 BEADRP C[C@@H](Cc1ccoc1)[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000643547396 384033717 /nfs/dbraw/zinc/03/37/17/384033717.db2.gz DTWINHLYJVGBFH-GXTWGEPZSA-N 2 0 248.370 2.475 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]CC1(C)CCC1 ZINC000090220110 384036985 /nfs/dbraw/zinc/03/69/85/384036985.db2.gz PBUWGGJZFXEGCN-AGIUHOORSA-N 2 0 224.392 2.495 20 0 BEADRP C[NH+](C)C[C@@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000114478114 384039525 /nfs/dbraw/zinc/03/95/25/384039525.db2.gz LWPGKSJFJFIKBO-HNNXBMFYSA-N 2 0 232.371 2.113 20 0 BEADRP CSC1(C[NH2+]CC2(C)CC[NH+](C)CC2)CC1 ZINC000304249664 384081621 /nfs/dbraw/zinc/08/16/21/384081621.db2.gz GTVGIPJBPFQLRX-UHFFFAOYSA-N 2 0 242.432 2.204 20 0 BEADRP C[C@H](C[NH2+]Cc1ccn(C)c1)C[NH+]1CCCCC1 ZINC000091008676 384094121 /nfs/dbraw/zinc/09/41/21/384094121.db2.gz DYBVIJKIALEOIV-CQSZACIVSA-N 2 0 249.402 2.237 20 0 BEADRP CC[C@@H]1C[N@H+](C[C@H]2CCC(F)(F)C2)CC[C@@H]1[NH3+] ZINC000302380966 384156299 /nfs/dbraw/zinc/15/62/99/384156299.db2.gz IGZVMKUIJDWMAZ-TUAOUCFPSA-N 2 0 246.345 2.481 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1)CC(F)F ZINC000647318595 384247403 /nfs/dbraw/zinc/24/74/03/384247403.db2.gz UKDHTQSXOGFTNU-GARJFASQSA-N 2 0 234.334 2.350 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H]1CC(C)(C)C[C@@H]1C ZINC000569566730 384250135 /nfs/dbraw/zinc/25/01/35/384250135.db2.gz YCRKMSKFPDCVOF-NWDGAFQWSA-N 2 0 212.381 2.400 20 0 BEADRP [NH3+]CCC1CC[NH+](C[C@H]2CCC(F)(F)C2)CC1 ZINC000302523597 384260263 /nfs/dbraw/zinc/26/02/63/384260263.db2.gz WPYDODNTOJSNLG-LBPRGKRZSA-N 2 0 246.345 2.483 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]2C[N@H+](Cc3cccs3)C[C@H]21 ZINC000228537475 384272989 /nfs/dbraw/zinc/27/29/89/384272989.db2.gz FUMKYKSMYPIVMB-CYZMBNFOSA-N 2 0 236.384 2.307 20 0 BEADRP CC[N@H+](C)C[C@@H]1CC[NH+](CCOC(C)(C)C)C1 ZINC000173885882 384276463 /nfs/dbraw/zinc/27/64/63/384276463.db2.gz QKIHWAIPDHKUJP-ZDUSSCGKSA-N 2 0 242.407 2.075 20 0 BEADRP CC(C)CCOCC[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000119518347 384280841 /nfs/dbraw/zinc/28/08/41/384280841.db2.gz XZHWNNRZIWAMPW-ZIAGYGMSSA-N 2 0 242.407 2.121 20 0 BEADRP CC[C@H](C)C[N@H+](C)C[C@H]1CC[NH2+][C@@H](C)C1 ZINC000300056939 384285436 /nfs/dbraw/zinc/28/54/36/384285436.db2.gz WSMPAVRNPXUQOV-AVGNSLFASA-N 2 0 212.381 2.352 20 0 BEADRP CSCC[N@@H+]1CC[C@@H](C)[C@@H](n2ccnc2)C1 ZINC000119975352 384321490 /nfs/dbraw/zinc/32/14/90/384321490.db2.gz PLYQLPCKNDMLQN-NEPJUHHUSA-N 2 0 239.388 2.129 20 0 BEADRP CCSCC[N@@H+]1CC[C@@H](C[NH+](C)CC)C1 ZINC000173919712 384289734 /nfs/dbraw/zinc/28/97/34/384289734.db2.gz PUTASHABFMLWHN-LBPRGKRZSA-N 2 0 230.421 2.013 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@@H]1CCC12CCC2 ZINC000308830947 384336038 /nfs/dbraw/zinc/33/60/38/384336038.db2.gz GERBBSIPSSZBBG-VXGBXAGGSA-N 2 0 210.365 2.249 20 0 BEADRP CSC1(C[NH2+]CCN(C)C(C)C)CCC1 ZINC000308838342 384342266 /nfs/dbraw/zinc/34/22/66/384342266.db2.gz XLJZHUBPUQUDDL-UHFFFAOYSA-N 2 0 230.421 2.202 20 0 BEADRP C[C@H]1C[C@H]([NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)CO1 ZINC000401979194 384360269 /nfs/dbraw/zinc/36/02/69/384360269.db2.gz ZJRACUSDOSFLLY-QWRGUYRKSA-N 2 0 240.391 2.063 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)CO1 ZINC000401979195 384361242 /nfs/dbraw/zinc/36/12/42/384361242.db2.gz ZJRACUSDOSFLLY-WDEREUQCSA-N 2 0 240.391 2.063 20 0 BEADRP CCSCC[N@H+](C)[C@@H]1CC[NH+](CC)C[C@H]1C ZINC000174780926 384363795 /nfs/dbraw/zinc/36/37/95/384363795.db2.gz ZBRAWCMEJDBGLS-CHWSQXEVSA-N 2 0 244.448 2.402 20 0 BEADRP C[C@@H](Cc1ccccc1F)[NH2+]CCC[NH+](C)C ZINC000134047420 384328808 /nfs/dbraw/zinc/32/88/08/384328808.db2.gz OOJOPKWCUATTJO-LBPRGKRZSA-N 2 0 238.350 2.298 20 0 BEADRP CC(C)[C@@H]([NH3+])CC[N@H+](C)C[C@H]1CCSC1 ZINC000300232772 384331539 /nfs/dbraw/zinc/33/15/39/384331539.db2.gz NAULQEGMBFCWCL-NEPJUHHUSA-N 2 0 230.421 2.045 20 0 BEADRP C[C@H]([NH2+]CCC1CC[NH+](C)CC1)c1ccccn1 ZINC000159013833 384333122 /nfs/dbraw/zinc/33/31/22/384333122.db2.gz SHZKZICFRGNPKA-ZDUSSCGKSA-N 2 0 247.386 2.464 20 0 BEADRP CC[C@@H](C)C[N@@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000335570589 384333559 /nfs/dbraw/zinc/33/35/59/384333559.db2.gz LPCHEWUWSANWQF-GFCCVEGCSA-N 2 0 210.365 2.108 20 0 BEADRP CN(CCC[NH3+])Cc1ccc(F)c(Cl)c1 ZINC000084511646 384402074 /nfs/dbraw/zinc/40/20/74/384402074.db2.gz PFPQNBHAVDMHOK-UHFFFAOYSA-N 2 0 230.714 2.260 20 0 BEADRP C[C@@H]([NH2+]CCCC[NH+](C)C)c1cccnc1 ZINC000045663323 384402814 /nfs/dbraw/zinc/40/28/14/384402814.db2.gz HOGPEBPIQPEBBK-GFCCVEGCSA-N 2 0 221.348 2.074 20 0 BEADRP C[C@@H]([NH2+]CCCC[NH+](C)C)c1ccccn1 ZINC000045663110 384403285 /nfs/dbraw/zinc/40/32/85/384403285.db2.gz YRJXFSHYTHJGQC-GFCCVEGCSA-N 2 0 221.348 2.074 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@@H]1CCc2ccccc2C1 ZINC000045664081 384403369 /nfs/dbraw/zinc/40/33/69/384403369.db2.gz XMFXXBJWKMCELM-MRXNPFEDSA-N 2 0 246.398 2.475 20 0 BEADRP CC1(C)[C@H]([NH3+])C[C@@H]1[NH2+]C[C@@H]1CC[C@H]2C[C@H]2C1 ZINC000405530113 384405354 /nfs/dbraw/zinc/40/53/54/384405354.db2.gz XWUMECYPDCPHCV-MLGHIDQZSA-N 2 0 222.376 2.138 20 0 BEADRP Cc1ccc(F)cc1C[N@H+]1CC[C@H]([C@H](C)[NH3+])C1 ZINC000229060513 384415557 /nfs/dbraw/zinc/41/55/57/384415557.db2.gz CZTNHRXIRRGYBT-RYUDHWBXSA-N 2 0 236.334 2.303 20 0 BEADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@H]2CCC[C@H]([NH3+])C2)cc1 ZINC000521369805 384424434 /nfs/dbraw/zinc/42/44/34/384424434.db2.gz FKNYPVWVLNWWOW-CQDKDKBSSA-N 3 0 247.386 2.066 20 0 BEADRP CC(C)C1([NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)CC1 ZINC000334195352 384387974 /nfs/dbraw/zinc/38/79/74/384387974.db2.gz KFACJIPGTSLVCL-QWHCGFSZSA-N 2 0 222.376 2.391 20 0 BEADRP [NH3+]C[C@H]1CCCN1C/C=C/c1ccccc1 ZINC000144681049 384440212 /nfs/dbraw/zinc/44/02/12/384440212.db2.gz OLXSIFMDQTZGKU-YOIVXCQUSA-N 2 0 216.328 2.123 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2CCC3(CCC3)C2)CC[NH2+]1 ZINC000335664642 384478612 /nfs/dbraw/zinc/47/86/12/384478612.db2.gz VXCSALFNQBQIIH-CHWSQXEVSA-N 2 0 222.376 2.251 20 0 BEADRP Fc1ccc2c(c1)[C@H]([NH2+]CC1=CC[NH2+]CC1)CC2 ZINC000335059725 384520368 /nfs/dbraw/zinc/52/03/68/384520368.db2.gz NOSIAXXTXZBBBU-OAHLLOKOSA-N 2 0 246.329 2.322 20 0 BEADRP CC[NH+](CC)C[C@@H]1CC[N@H+](CCCF)C1 ZINC000151130693 384541973 /nfs/dbraw/zinc/54/19/73/384541973.db2.gz RYAJRMFMBYVXCL-LBPRGKRZSA-N 2 0 216.344 2.010 20 0 BEADRP [NH3+]CC[C@@H]1CCC[N@H+](C[C@@H]2CCC(F)(F)C2)C1 ZINC000305994992 384561147 /nfs/dbraw/zinc/56/11/47/384561147.db2.gz MQKYNOGSDZFYER-NWDGAFQWSA-N 2 0 246.345 2.483 20 0 BEADRP CC(C)C[C@H]([NH3+])C[N@@H+]1CC[C@@H]2CCC[C@@H]21 ZINC000355107500 384584186 /nfs/dbraw/zinc/58/41/86/384584186.db2.gz NSPOKMZBCCOVFJ-AVGNSLFASA-N 2 0 210.365 2.234 20 0 BEADRP C[C@H]1CN(C)C[C@H]1[NH2+]C[C@H]1C[C@@H]1c1ccccc1 ZINC000647230507 384586494 /nfs/dbraw/zinc/58/64/94/384586494.db2.gz UXPMOGJWJUJKEL-LCGIIJARSA-N 2 0 244.382 2.330 20 0 BEADRP CC(C)[C@@H](C)[NH2+]C[C@@H]1CC[N@@H+](C(C)C)C1 ZINC000040621544 384588435 /nfs/dbraw/zinc/58/84/35/384588435.db2.gz AFXVSPFALRJPHW-OLZOCXBDSA-N 2 0 212.381 2.351 20 0 BEADRP FC1(F)CC[C@@H](CN2CC[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000306018132 384564836 /nfs/dbraw/zinc/56/48/36/384564836.db2.gz PSXVULWFDLVPJX-UTUOFQBUSA-N 2 0 244.329 2.248 20 0 BEADRP Cc1cccc(CC[NH2+][C@H]2CCCC[C@H]2C[NH3+])n1 ZINC000423087190 384566130 /nfs/dbraw/zinc/56/61/30/384566130.db2.gz OYTOHPRLWLQLLY-ZFWWWQNUSA-N 2 0 247.386 2.040 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@H]2CCC(F)(F)C2)C[C@@H]1C[NH3+] ZINC000306053944 384567666 /nfs/dbraw/zinc/56/76/66/384567666.db2.gz WXWNKODGXHLZMY-WOPDTQHZSA-N 2 0 246.345 2.339 20 0 BEADRP Cc1cc(C)cc(C[N@@H+]2CC[C@](C)(C[NH3+])C2)c1 ZINC000235846957 384632718 /nfs/dbraw/zinc/63/27/18/384632718.db2.gz TWKUKQTUFCUOBF-OAHLLOKOSA-N 2 0 232.371 2.474 20 0 BEADRP CSCCCN(C)C[C@H]([NH3+])CC(C)C ZINC000300862791 384614704 /nfs/dbraw/zinc/61/47/04/384614704.db2.gz PLJGQVXHIAGTSK-LLVKDONJSA-N 2 0 218.410 2.045 20 0 BEADRP COCc1cccc(C[NH+]2CCC(C)([NH3+])CC2)c1 ZINC000647531430 384620669 /nfs/dbraw/zinc/62/06/69/384620669.db2.gz WHRTXPXMBUHYFP-UHFFFAOYSA-N 2 0 248.370 2.146 20 0 BEADRP CC(C)C[C@H](C)C[NH+]1CCC(C)([NH3+])CC1 ZINC000647530794 384623822 /nfs/dbraw/zinc/62/38/22/384623822.db2.gz GFVMEVHKOAOLFD-LBPRGKRZSA-N 2 0 212.381 2.482 20 0 BEADRP c1ccc([C@@H]2CC[N@@H+](CC3CC[NH2+]CC3)C2)cc1 ZINC000050599366 384636505 /nfs/dbraw/zinc/63/65/05/384636505.db2.gz RJABRYAOJWHDDJ-MRXNPFEDSA-N 2 0 244.382 2.476 20 0 BEADRP C[C@@H]([NH3+])[C@H]1CC[N@H+](CCCC(C)(C)C)C1 ZINC000300896315 384639382 /nfs/dbraw/zinc/63/93/82/384639382.db2.gz QGPQAXIKNMGPCI-NEPJUHHUSA-N 2 0 212.381 2.482 20 0 BEADRP C[C@@H](C[C@H]1CCC[NH2+]1)[NH2+]Cc1cccs1 ZINC000086495077 384658224 /nfs/dbraw/zinc/65/82/24/384658224.db2.gz BGFUIWFWYWWSQS-WDEREUQCSA-N 2 0 224.373 2.368 20 0 BEADRP C[C@H](C[C@H]1CCC[NH2+]1)[NH2+]Cc1cccs1 ZINC000086495079 384659135 /nfs/dbraw/zinc/65/91/35/384659135.db2.gz BGFUIWFWYWWSQS-GHMZBOCLSA-N 2 0 224.373 2.368 20 0 BEADRP C[C@@H]1C[C@H]([NH3+])CC[N@@H+]1CCCc1ccccc1 ZINC000049713021 384678955 /nfs/dbraw/zinc/67/89/55/384678955.db2.gz MTTCZJGUWUHMSE-UKRRQHHQSA-N 2 0 232.371 2.431 20 0 BEADRP Cc1ncc(C[NH+]2CCC([C@H](C)[NH3+])CC2)s1 ZINC000082475139 384686859 /nfs/dbraw/zinc/68/68/59/384686859.db2.gz XDFYAKPZMRYMLJ-VIFPVBQESA-N 2 0 239.388 2.011 20 0 BEADRP C([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000403498494 384707733 /nfs/dbraw/zinc/70/77/33/384707733.db2.gz XKZVTOGRPNIVET-FGZZBPHYSA-N 2 0 248.414 2.400 20 0 BEADRP FC1(C[N@@H+]2CCC[C@H]([C@H]3CCC[NH2+]C3)C2)CC1 ZINC000647543748 384712726 /nfs/dbraw/zinc/71/27/26/384712726.db2.gz RPJHQPHJYKERLV-STQMWFEESA-N 2 0 240.366 2.200 20 0 BEADRP C[N@H+](CCC[NH3+])CCCCc1ccccc1 ZINC000162981164 384715062 /nfs/dbraw/zinc/71/50/62/384715062.db2.gz KDKSREMNIFPQMS-UHFFFAOYSA-N 2 0 220.360 2.290 20 0 BEADRP CC[NH+](CC)CCCNC(=[NH2+])Nc1ccccc1 ZINC000052046893 384715020 /nfs/dbraw/zinc/71/50/20/384715020.db2.gz LEBFMTKLPBSJAX-UHFFFAOYSA-N 2 0 248.374 2.355 20 0 BEADRP C[N@H+](Cc1cccc2cnccc21)C1CC([NH3+])C1 ZINC000647544855 384718046 /nfs/dbraw/zinc/71/80/46/384718046.db2.gz KGRXLFGIADWLDD-UHFFFAOYSA-N 2 0 241.338 2.156 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCCc2cc(OC)ccc2C1 ZINC000518771406 384722481 /nfs/dbraw/zinc/72/24/81/384722481.db2.gz MVUAQCIDHHJLBK-UHFFFAOYSA-N 2 0 248.370 2.053 20 0 BEADRP [NH3+]CCC[NH2+]C1(c2ccccc2F)CCC1 ZINC000647553014 384777916 /nfs/dbraw/zinc/77/79/16/384777916.db2.gz MXSLULDTCNWNLM-UHFFFAOYSA-N 2 0 222.307 2.143 20 0 BEADRP CC[NH2+]Cc1cccc(N[C@@H]2C[NH2+]C[C@H](C)C2)c1 ZINC000647546385 384729591 /nfs/dbraw/zinc/72/95/91/384729591.db2.gz HXZFYWWPLDIPEL-DOMZBBRYSA-N 2 0 247.386 2.206 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)C1CCCC1 ZINC000054081313 384730150 /nfs/dbraw/zinc/73/01/50/384730150.db2.gz AQVGAELORJIDAU-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP C1[C@@H]2[C@H]1CCC[C@@H]2[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000647551797 384754980 /nfs/dbraw/zinc/75/49/80/384754980.db2.gz MIWOMBZPZKFAFU-QAIIKZMUSA-N 2 0 234.387 2.153 20 0 BEADRP C[NH+](C)C1CCC([NH2+]C2CCSCC2)CC1 ZINC000309977853 384758602 /nfs/dbraw/zinc/75/86/02/384758602.db2.gz UOHRTZDAFCVNOX-UHFFFAOYSA-N 2 0 242.432 2.344 20 0 BEADRP C[C@@]1(C[N@@H+]2CC[C@@H](C3CCC3)C2)CC[NH2+]C1 ZINC000647552016 384758679 /nfs/dbraw/zinc/75/86/79/384758679.db2.gz AHNDZPNZLLLZIB-ZIAGYGMSSA-N 2 0 222.376 2.108 20 0 BEADRP C[C@H](CO)CCC[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000300703980 384760590 /nfs/dbraw/zinc/76/05/90/384760590.db2.gz PHBVAWGBXAPJPW-TUKIKUTGSA-N 2 0 248.370 2.129 20 0 BEADRP CC1(C)CCC[C@@H]1[C@@H]1CC[N@H+](CCC[NH3+])C1 ZINC000647552759 384761140 /nfs/dbraw/zinc/76/11/40/384761140.db2.gz VNDBGEMJNTYZRJ-CHWSQXEVSA-N 2 0 224.392 2.483 20 0 BEADRP C[C@H](CO)CCC[NH2+][C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000300703979 384761589 /nfs/dbraw/zinc/76/15/89/384761589.db2.gz PHBVAWGBXAPJPW-CQDKDKBSSA-N 2 0 248.370 2.129 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1 ZINC000423210430 384761771 /nfs/dbraw/zinc/76/17/71/384761771.db2.gz GHASCPWWXBKDCY-CRWXNKLISA-N 2 0 224.392 2.399 20 0 BEADRP C([NH2+][C@@H]1CC[NH2+]C12CCCC2)[C@@H]1CCSC1 ZINC000647553474 384768387 /nfs/dbraw/zinc/76/83/87/384768387.db2.gz ALJGRUBCXLIXBH-NWDGAFQWSA-N 2 0 240.416 2.004 20 0 BEADRP CC[C@@H](C)C[NH2+][C@@H]1CC[NH2+]C12CCCC2 ZINC000647554300 384770788 /nfs/dbraw/zinc/77/07/88/384770788.db2.gz WGJANKGXQFXNNP-VXGBXAGGSA-N 2 0 210.365 2.297 20 0 BEADRP CC(C)[C@H]1CC[C@@H]1[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000423357625 384831509 /nfs/dbraw/zinc/83/15/09/384831509.db2.gz MKSAMRZQZIUTGL-UPJWGTAASA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)[C@H]1CC[C@H]1[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000423357624 384832158 /nfs/dbraw/zinc/83/21/58/384832158.db2.gz MKSAMRZQZIUTGL-JHJVBQTASA-N 2 0 210.365 2.153 20 0 BEADRP CCC([NH3+])(CC)C[NH2+][C@@H]1CC[C@H]1C1CC1 ZINC000423289293 384785299 /nfs/dbraw/zinc/78/52/99/384785299.db2.gz ATJLNOUUCMEXHS-NWDGAFQWSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000423339586 384813150 /nfs/dbraw/zinc/81/31/50/384813150.db2.gz LJKZRWBWMQLAAZ-MELADBBJSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H](C[NH2+][C@@H](C)C(C)(C)C)C[NH+](C)C ZINC000308645538 384885852 /nfs/dbraw/zinc/88/58/52/384885852.db2.gz HJJUQGCDDDEWEE-MNOVXSKESA-N 2 0 200.370 2.208 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000423363743 384843472 /nfs/dbraw/zinc/84/34/72/384843472.db2.gz AGXGGRYEJPPPIL-YNEHKIRRSA-N 2 0 233.359 2.311 20 0 BEADRP C[C@@H]([NH3+])[C@@H]1CCC[N@H+](CCc2ccccc2)C1 ZINC000104424503 384850042 /nfs/dbraw/zinc/85/00/42/384850042.db2.gz RFFOXKXUQRKNFZ-UKRRQHHQSA-N 2 0 232.371 2.288 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+][C@@H]1CCc2ccc(F)cc21 ZINC000423402017 384851399 /nfs/dbraw/zinc/85/13/99/384851399.db2.gz RDLVVAVNAMTAKY-VCTAVGKDSA-N 2 0 248.345 2.401 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+][C@@H]1CC[NH2+][C@H](C)C1 ZINC000423388126 384852514 /nfs/dbraw/zinc/85/25/14/384852514.db2.gz TUSPGBCJOHOJBW-FVCCEPFGSA-N 2 0 210.365 2.151 20 0 BEADRP CC(C)[C@H]1CC[C@H]1[NH2+][C@@H]1CC[NH2+][C@H](C)C1 ZINC000423388125 384853854 /nfs/dbraw/zinc/85/38/54/384853854.db2.gz TUSPGBCJOHOJBW-FDYHWXHSSA-N 2 0 210.365 2.151 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CCOc1ccccc1 ZINC000310197327 384889058 /nfs/dbraw/zinc/88/90/58/384889058.db2.gz BCAKZLALEKXCNW-ZDUSSCGKSA-N 2 0 236.359 2.173 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+]C[C@H](C)C[NH3+])s1 ZINC000308604106 384861296 /nfs/dbraw/zinc/86/12/96/384861296.db2.gz GKCUCTZWOLDXQK-PSASIEDQSA-N 2 0 212.362 2.302 20 0 BEADRP Fc1ccccc1C[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000259056052 384950345 /nfs/dbraw/zinc/95/03/45/384950345.db2.gz QPSCWSCYDQFIMK-GFCCVEGCSA-N 2 0 236.334 2.305 20 0 BEADRP CC(C)CCC[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000258994682 384955483 /nfs/dbraw/zinc/95/54/83/384955483.db2.gz MBDHVFBDEJAJCT-ZDUSSCGKSA-N 2 0 212.381 2.402 20 0 BEADRP Cc1ccc(C)c(C[NH2+]C[C@H]2CCC[NH2+]C2)c1 ZINC000259009701 384955527 /nfs/dbraw/zinc/95/55/27/384955527.db2.gz MYDJLAMWWOFKLN-AWEZNQCLSA-N 2 0 232.371 2.393 20 0 BEADRP Clc1ccc(C[NH2+]CC[C@@H]2CC[NH2+]C2)cc1 ZINC000259021979 384955657 /nfs/dbraw/zinc/95/56/57/384955657.db2.gz NYRUYDFYPJDZRE-GFCCVEGCSA-N 2 0 238.762 2.429 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCC[C@H]1C)N(C)C1CC1 ZINC000151962330 384893222 /nfs/dbraw/zinc/89/32/22/384893222.db2.gz LCSGODWUXYRKHW-NQBHXWOUSA-N 2 0 210.365 2.247 20 0 BEADRP CN(CC[NH+](C)C)c1cc[nH+]c2ccccc21 ZINC000027312858 384895062 /nfs/dbraw/zinc/89/50/62/384895062.db2.gz HSHDEKOKCTTXII-UHFFFAOYSA-N 2 0 229.327 2.233 20 0 BEADRP COc1ccc(CC[N@@H+]2CC[C@H]([NH3+])C[C@H]2C)cc1 ZINC000049707594 384897167 /nfs/dbraw/zinc/89/71/67/384897167.db2.gz XRWCGEOGVYZXEM-OCCSQVGLSA-N 2 0 248.370 2.049 20 0 BEADRP Cc1ccc(C[N@@H+]2CCCC[C@@H]2CC[NH3+])nc1 ZINC000156599590 384903047 /nfs/dbraw/zinc/90/30/47/384903047.db2.gz NDJUACVICMTEPU-CQSZACIVSA-N 2 0 233.359 2.093 20 0 BEADRP CC[C@H](CSC)[NH2+][C@@H](C)CCCC[NH3+] ZINC000308661017 384904063 /nfs/dbraw/zinc/90/40/63/384904063.db2.gz PUCNFKKZHASZDS-WDEREUQCSA-N 2 0 218.410 2.235 20 0 BEADRP CC(C)[C@@H]1CCCC[N@@H+]1CC[C@@H]1CC[NH2+]C1 ZINC000257770881 384929005 /nfs/dbraw/zinc/92/90/05/384929005.db2.gz IFTVDTFCCSQSJX-KBPBESRZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]([NH3+])CC[NH2+]Cc1ccc(F)c(Cl)c1 ZINC000258686173 384932530 /nfs/dbraw/zinc/93/25/30/384932530.db2.gz FMKCMICHBOOIEI-QMMMGPOBSA-N 2 0 230.714 2.306 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]Cc1coc2ccccc12 ZINC000258699948 384933658 /nfs/dbraw/zinc/93/36/58/384933658.db2.gz GREMNWWBMFQRON-SNVBAGLBSA-N 2 0 218.300 2.117 20 0 BEADRP COc1ccc(C[NH2+]C[C@H](C)C[NH3+])cc1Cl ZINC000258671967 384936566 /nfs/dbraw/zinc/93/65/66/384936566.db2.gz CXEINFLVIXSJOH-SECBINFHSA-N 2 0 242.750 2.033 20 0 BEADRP Cc1ccsc1CC[NH2+][C@@H]1CCC[C@@H]1[NH3+] ZINC000258800992 384936824 /nfs/dbraw/zinc/93/68/24/384936824.db2.gz CDTDFWSRGMEPPS-WDEREUQCSA-N 2 0 224.373 2.068 20 0 BEADRP Cc1cnccc1C[N@H+]1CCC[C@H](C)[C@@H]1CC[NH3+] ZINC000404265931 384966548 /nfs/dbraw/zinc/96/65/48/384966548.db2.gz HHTKPNIPEAPNGK-WFASDCNBSA-N 2 0 247.386 2.339 20 0 BEADRP C[C@@H]1CC[C@H](C[N@@H+]2CCC[C@H](C)[C@@H]2CC[NH3+])O1 ZINC000404274806 384967088 /nfs/dbraw/zinc/96/70/88/384967088.db2.gz AHFGYRZBYAPEPR-DGAVXFQQSA-N 2 0 240.391 2.003 20 0 BEADRP [NH3+]CCC[NH2+][C@H]1CCCC12CCCCC2 ZINC000312983565 385018689 /nfs/dbraw/zinc/01/86/89/385018689.db2.gz DVVRWYOBPLYQHI-LBPRGKRZSA-N 2 0 210.365 2.428 20 0 BEADRP Cc1ccsc1C[N@H+](C)CC[C@H]1CC[NH2+]C1 ZINC000259171528 384964469 /nfs/dbraw/zinc/96/44/69/384964469.db2.gz YRCAAKDTXCKJOK-GFCCVEGCSA-N 2 0 238.400 2.488 20 0 BEADRP CCC(CC)[C@H](C[NH2+][C@@H](C)CCC[NH3+])N(C)C ZINC000310407238 385048799 /nfs/dbraw/zinc/04/87/99/385048799.db2.gz OKTAWDINEQQTMV-JSGCOSHPSA-N 2 0 243.439 2.070 20 0 BEADRP COCc1cccc(C[NH2+][C@H]2C[C@H]([NH3+])C2(C)C)c1 ZINC000404758033 385051667 /nfs/dbraw/zinc/05/16/67/385051667.db2.gz APZJHAXAENVOJD-KBPBESRZSA-N 2 0 248.370 2.048 20 0 BEADRP Cc1ccc(F)cc1C[N@@H+]1CCC[C@H](C[NH3+])C1 ZINC000157056653 385054970 /nfs/dbraw/zinc/05/49/70/385054970.db2.gz MCBLFAZGSCRNIM-GFCCVEGCSA-N 2 0 236.334 2.305 20 0 BEADRP CC1(C)[C@H]([NH2+]Cc2cccc(F)c2)C[C@@H]1[NH3+] ZINC000404779647 385055852 /nfs/dbraw/zinc/05/58/52/385055852.db2.gz MTCGITAXMBCQGA-NWDGAFQWSA-N 2 0 222.307 2.041 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CCOC1CCCCC1 ZINC000310453542 385065576 /nfs/dbraw/zinc/06/55/76/385065576.db2.gz YPMUFONWSLLZIS-ZDUSSCGKSA-N 2 0 242.407 2.443 20 0 BEADRP C[C@H](F)CC[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@@H]1C ZINC000340471971 385068143 /nfs/dbraw/zinc/06/81/43/385068143.db2.gz XXZDUYROMVARHS-FIQHERPVSA-N 2 0 216.344 2.053 20 0 BEADRP CC(C)C1([NH2+][C@H]2CN(C3CC3)C[C@@H]2C)CC1 ZINC000340479251 385068316 /nfs/dbraw/zinc/06/83/16/385068316.db2.gz PJJBTPSKOSWDOJ-AAEUAGOBSA-N 2 0 222.376 2.247 20 0 BEADRP C(C1CC[NH2+]CC1)[N@H+](C1CC1)C1CCCC1 ZINC000086702063 385040681 /nfs/dbraw/zinc/04/06/81/385040681.db2.gz JYSNDXHIRGZUAX-UHFFFAOYSA-N 2 0 222.376 2.393 20 0 BEADRP CC(C)C[C@H](C[NH2+][C@H](C)CCCC[NH3+])N(C)C ZINC000310552187 385114628 /nfs/dbraw/zinc/11/46/28/385114628.db2.gz UWEGRDTXLQQMRJ-ZIAGYGMSSA-N 2 0 243.439 2.070 20 0 BEADRP COCc1cccc(C[NH2+][C@@H](C)CCC[NH3+])c1 ZINC000310570289 385119723 /nfs/dbraw/zinc/11/97/23/385119723.db2.gz YZFCHMUJSKVTTK-LBPRGKRZSA-N 2 0 236.359 2.050 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)C1CCC1 ZINC000177943957 385141871 /nfs/dbraw/zinc/14/18/71/385141871.db2.gz FHNBTYNGADTUSR-NEPJUHHUSA-N 2 0 222.376 2.249 20 0 BEADRP CC1(C)[C@@H]([NH3+])C[C@@H]1[NH2+]CCC1CCCC1 ZINC000404878102 385121856 /nfs/dbraw/zinc/12/18/56/385121856.db2.gz YBSAQZIJUXMZSO-RYUDHWBXSA-N 2 0 210.365 2.282 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H]1CCCSC1 ZINC000061571277 385122804 /nfs/dbraw/zinc/12/28/04/385122804.db2.gz PEOICROGXWQDTK-GFCCVEGCSA-N 2 0 230.421 2.204 20 0 BEADRP Cc1ccc(CN2CCCC[C@@H]2[C@H](C)[NH3+])nc1 ZINC000227353376 385130719 /nfs/dbraw/zinc/13/07/19/385130719.db2.gz DHAJBYAICGADGF-GXTWGEPZSA-N 2 0 233.359 2.092 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@@H]([NH3+])[C@@H](C)C2)c(C)c1 ZINC000227056251 385085532 /nfs/dbraw/zinc/08/55/32/385085532.db2.gz LTOCQTFKTFIULR-DZGCQCFKSA-N 2 0 232.371 2.473 20 0 BEADRP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]CC1=CCCCC1 ZINC000336236003 385090866 /nfs/dbraw/zinc/09/08/66/385090866.db2.gz GIPIORSPFUVUOC-JSGCOSHPSA-N 2 0 222.376 2.417 20 0 BEADRP C[C@H]([NH3+])[C@H]1CC[N@H+](C[C@@H](C)c2ccccc2)C1 ZINC000227200539 385106938 /nfs/dbraw/zinc/10/69/38/385106938.db2.gz WAJVGTQPDLBEFU-IPYPFGDCSA-N 2 0 232.371 2.459 20 0 BEADRP CC(C)[N@H+](C)CCN[C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000227540425 385158156 /nfs/dbraw/zinc/15/81/56/385158156.db2.gz JUSCZQKTPWFNLG-CABCVRRESA-N 2 0 247.386 2.061 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@H](C)c1ccco1 ZINC000308808932 385177027 /nfs/dbraw/zinc/17/70/27/385177027.db2.gz GQDMJWFQDXDXSE-GHMZBOCLSA-N 2 0 210.321 2.448 20 0 BEADRP C(C1CCCC1)[N@H+](C1CC1)C1CC[NH2+]CC1 ZINC000647482603 385212984 /nfs/dbraw/zinc/21/29/84/385212984.db2.gz SGHLRKZAKYVJJH-UHFFFAOYSA-N 2 0 222.376 2.393 20 0 BEADRP CC[C@@H]1CCC[C@H]1[NH2+]C[C@H]1CC[N@H+](CC)C1 ZINC000252713516 385217339 /nfs/dbraw/zinc/21/73/39/385217339.db2.gz PKIHKCWZYWMVAU-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP CCSCCC[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@@H]1C ZINC000300990047 385221402 /nfs/dbraw/zinc/22/14/02/385221402.db2.gz VSZFFQNMZRHCCS-YNEHKIRRSA-N 2 0 244.448 2.448 20 0 BEADRP C[NH+](C)CCC1CC[NH+](Cc2ccncc2)CC1 ZINC000130271900 385233083 /nfs/dbraw/zinc/23/30/83/385233083.db2.gz HZFNMMZZPAKQLZ-UHFFFAOYSA-N 2 0 247.386 2.245 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+][C@@H](C)CCC[NH3+])o1 ZINC000308895984 385251139 /nfs/dbraw/zinc/25/11/39/385251139.db2.gz ZJFNEFCDBRXVRS-GXSJLCMTSA-N 2 0 210.321 2.366 20 0 BEADRP [NH3+]C[C@H]1CCC[N@H+](C/C=C/c2ccccc2)C1 ZINC000044529434 385309549 /nfs/dbraw/zinc/30/95/49/385309549.db2.gz DZPCSYAGAXXUTP-SGJXGLNRSA-N 2 0 230.355 2.371 20 0 BEADRP C[C@H]([NH2+][C@H]1CCCC[C@H]1C[NH3+])c1ccncc1 ZINC000160945458 385311655 /nfs/dbraw/zinc/31/16/55/385311655.db2.gz OOERCCOLKHSXKL-UBHSHLNASA-N 2 0 233.359 2.250 20 0 BEADRP CC[C@@H]1CCC[C@H](C[N@@H+]2CCCNCC2)C1 ZINC000346679775 385260018 /nfs/dbraw/zinc/26/00/18/385260018.db2.gz ATFAJTWAGNAPFJ-KGLIPLIRSA-N 2 0 224.392 2.498 20 0 BEADRP CC1(C)CCC[C@@H](C[N@@H+]2CC[C@H](C[NH3+])C2)C1 ZINC000647490852 385282825 /nfs/dbraw/zinc/28/28/25/385282825.db2.gz VOCAWENLJACLBV-CHWSQXEVSA-N 2 0 224.392 2.483 20 0 BEADRP COCC[N@H+](C)CCC[NH2+][C@@H](C)C1CCCC1 ZINC000153786422 385282980 /nfs/dbraw/zinc/28/29/80/385282980.db2.gz LDUZYYJYPJSFOL-ZDUSSCGKSA-N 2 0 242.407 2.123 20 0 BEADRP CC[C@@H]1C[C@H]([NH2+][C@@H]2CCN(C)[C@H](C)C2)CCO1 ZINC000157810598 385286222 /nfs/dbraw/zinc/28/62/22/385286222.db2.gz ACOZWPOTZYBXTO-AAVRWANBSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@H]([NH2+]C1CC[NH2+]CC1)C1CCCCC1 ZINC000052334198 385288241 /nfs/dbraw/zinc/28/82/41/385288241.db2.gz GJQNFHQWNKCNOR-NSHDSACASA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)C1CCC1 ZINC000308996567 385338053 /nfs/dbraw/zinc/33/80/53/385338053.db2.gz MRPNRLOBOUUNFV-LLVKDONJSA-N 2 0 208.349 2.027 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@H]1CCCCS1 ZINC000308998281 385338757 /nfs/dbraw/zinc/33/87/57/385338757.db2.gz KOOYOGDLGGRCPD-VXGBXAGGSA-N 2 0 230.421 2.379 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@H]([C@H](C)[NH3+])C2)cc1F ZINC000228150121 385350153 /nfs/dbraw/zinc/35/01/53/385350153.db2.gz MQTZHKYWUQRDSI-AAEUAGOBSA-N 2 0 236.334 2.303 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H](C)c1cccc(F)c1 ZINC000308972839 385328561 /nfs/dbraw/zinc/32/85/61/385328561.db2.gz HFXJGVYXYOVKKC-NXEZZACHSA-N 2 0 210.296 2.071 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@@H](C)C1CCC1 ZINC000309075948 385397729 /nfs/dbraw/zinc/39/77/29/385397729.db2.gz KJOFGXQXLGQLQP-LBPRGKRZSA-N 2 0 212.381 2.495 20 0 BEADRP C[N@H+](CCC[NH3+])Cc1cc2cc(F)ccc2o1 ZINC000647497032 385398538 /nfs/dbraw/zinc/39/85/38/385398538.db2.gz XBILIQGJAVHMAL-UHFFFAOYSA-N 2 0 236.290 2.353 20 0 BEADRP C[C@H](C[N@H+]1C[C@H]2C[NH+](C)C[C@H]2C1)c1ccccc1 ZINC000193610408 385405312 /nfs/dbraw/zinc/40/53/12/385405312.db2.gz WQARIAAQBJSDAW-BMFZPTHFSA-N 2 0 244.382 2.284 20 0 BEADRP CCC[C@H](C)C[NH2+]CC1=CC[N@H+](C)CC1 ZINC000309092800 385413923 /nfs/dbraw/zinc/41/39/23/385413923.db2.gz CTTZXXVJOXXKEJ-LBPRGKRZSA-N 2 0 210.365 2.274 20 0 BEADRP CCN1CCC[C@H]1C[NH2+]CC1(OC)CCCC1 ZINC000319554223 385447546 /nfs/dbraw/zinc/44/75/46/385447546.db2.gz CRTOUGYVGDCWDQ-ZDUSSCGKSA-N 2 0 240.391 2.020 20 0 BEADRP CC[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)C1CC1 ZINC000309190235 385457109 /nfs/dbraw/zinc/45/71/09/385457109.db2.gz PMQYVXGLPJNIJL-CYBMUJFWSA-N 2 0 208.349 2.027 20 0 BEADRP CC[C@H]([NH2+]CC1=CC[N@H+](C)CC1)C1CC1 ZINC000309190236 385457200 /nfs/dbraw/zinc/45/72/00/385457200.db2.gz PMQYVXGLPJNIJL-ZDUSSCGKSA-N 2 0 208.349 2.027 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@H]2C[C@@H](C)[C@@H]2C)CC1 ZINC000309279140 385507067 /nfs/dbraw/zinc/50/70/67/385507067.db2.gz FFXSFYMFCPPWDM-DYEKYZERSA-N 2 0 224.392 2.493 20 0 BEADRP CC(C)(C)CCC[N@@H+]1CC[C@@H]2[NH2+]CC[C@@H]2C1 ZINC000309290352 385515796 /nfs/dbraw/zinc/51/57/96/385515796.db2.gz PZVUZXYRHMXSLG-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)CC[N@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000172351224 385530783 /nfs/dbraw/zinc/53/07/83/385530783.db2.gz HVWHADZVSWNFEZ-CYBMUJFWSA-N 2 0 212.381 2.306 20 0 BEADRP CC(C)(C)CCC[N@@H+]1C[C@@H]2CC[C@@H]([NH3+])[C@H]2C1 ZINC000309388809 385560410 /nfs/dbraw/zinc/56/04/10/385560410.db2.gz SPOTUJVGAJGNGR-RWMBFGLXSA-N 2 0 224.392 2.482 20 0 BEADRP C(C[C@@H]1CCC[NH2+]C1)[NH2+]C1CCCCC1 ZINC000054309142 385563966 /nfs/dbraw/zinc/56/39/66/385563966.db2.gz YYMLRPFOOZKDAN-LBPRGKRZSA-N 2 0 210.365 2.298 20 0 BEADRP c1ccc([C@@H]([NH2+]C2CC[NH2+]CC2)C2CC2)cc1 ZINC000038041213 385599283 /nfs/dbraw/zinc/59/92/83/385599283.db2.gz SEYBDHBWNKXQIL-OAHLLOKOSA-N 2 0 230.355 2.479 20 0 BEADRP FC(F)(F)[C@@H]1CCC[C@@H]([NH2+][C@H]2CC[NH2+]C2)C1 ZINC000250667700 385604795 /nfs/dbraw/zinc/60/47/95/385604795.db2.gz SJVXEZYSOZHYDR-BBBLOLIVSA-N 2 0 236.281 2.059 20 0 BEADRP CCCC[N@H+](C[C@H]1CCC[NH2+]C1)C1CC1 ZINC000042491303 385584953 /nfs/dbraw/zinc/58/49/53/385584953.db2.gz ZZJAGAYGIBTLPM-LBPRGKRZSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCCN(C)[C@H]1C)[C@H]1CC1(C)C ZINC000309458199 385589666 /nfs/dbraw/zinc/58/96/66/385589666.db2.gz OAWIODQMGZWHNT-WUHRBBMRSA-N 2 0 224.392 2.493 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CCc1ccc(F)cc1 ZINC000309486775 385614531 /nfs/dbraw/zinc/61/45/31/385614531.db2.gz XFZCJLCXJHNMMC-LLVKDONJSA-N 2 0 224.323 2.085 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]C[C@@H](C)c1ccc(F)cc1 ZINC000414848796 385620437 /nfs/dbraw/zinc/62/04/37/385620437.db2.gz XJSPDPKOJCANAQ-NWDGAFQWSA-N 2 0 238.350 2.374 20 0 BEADRP Cc1nc(C[NH2+]CCC[C@H]2CCC[NH2+]2)cs1 ZINC000309539898 385674097 /nfs/dbraw/zinc/67/40/97/385674097.db2.gz GFXLIYXOJDBDJE-NSHDSACASA-N 2 0 239.388 2.073 20 0 BEADRP C[C@H]([NH2+]C1CC[NH+](C2CCC2)CC1)C1CC1 ZINC000309546962 385681279 /nfs/dbraw/zinc/68/12/79/385681279.db2.gz HBTIUVLOJPOAEB-NSHDSACASA-N 2 0 222.376 2.391 20 0 BEADRP CC[C@@H](C)[NH2+]C[C@H]1N(C)CCCC1(C)C ZINC000336735856 385718777 /nfs/dbraw/zinc/71/87/77/385718777.db2.gz OTEMESMYFSOMOB-VXGBXAGGSA-N 2 0 212.381 2.495 20 0 BEADRP C[NH2+]CCC[NH2+][C@H]1CCC[C@@H](C2CC2)C1 ZINC000414856878 385718262 /nfs/dbraw/zinc/71/82/62/385718262.db2.gz BENJJTNYAJBOFR-OLZOCXBDSA-N 2 0 210.365 2.154 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1CCC[C@H](C2CC2)C1 ZINC000414856879 385718451 /nfs/dbraw/zinc/71/84/51/385718451.db2.gz BENJJTNYAJBOFR-QWHCGFSZSA-N 2 0 210.365 2.154 20 0 BEADRP Cc1nc(C)c(C[NH2+][C@H](C)CCCC[NH3+])s1 ZINC000309586783 385712094 /nfs/dbraw/zinc/71/20/94/385712094.db2.gz WAKKZSFCKMWLBD-SECBINFHSA-N 2 0 241.404 2.367 20 0 BEADRP C[NH2+]CCC[NH2+][C@H]1CCC(C)(C)C[C@H]1C ZINC000414857548 385729072 /nfs/dbraw/zinc/72/90/72/385729072.db2.gz DWJOJOXAGRYJEV-NEPJUHHUSA-N 2 0 212.381 2.400 20 0 BEADRP C[NH2+]CCC[NH2+]Cc1cc(C)c2ncccc2c1 ZINC000414857718 385732276 /nfs/dbraw/zinc/73/22/76/385732276.db2.gz FKPMLUQCRZDEFK-UHFFFAOYSA-N 2 0 243.354 2.242 20 0 BEADRP C[NH2+]Cc1cccc(NC[C@H]([NH3+])CC(C)C)c1 ZINC000414859362 385733598 /nfs/dbraw/zinc/73/35/98/385733598.db2.gz AROMYSOJNKSOOV-CYBMUJFWSA-N 2 0 235.375 2.191 20 0 BEADRP C[NH2+]CCC[NH2+][C@H](C)Cc1ccccc1C ZINC000414858242 385734076 /nfs/dbraw/zinc/73/40/76/385734076.db2.gz IIPNKXKDILHYLT-CYBMUJFWSA-N 2 0 220.360 2.125 20 0 BEADRP C[NH2+]Cc1cccc(NC[C@@H]([NH3+])CC(C)C)c1 ZINC000414859364 385734108 /nfs/dbraw/zinc/73/41/08/385734108.db2.gz AROMYSOJNKSOOV-ZDUSSCGKSA-N 2 0 235.375 2.191 20 0 BEADRP C[C@@H]1C[C@H]1C[N@@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000488291044 385734813 /nfs/dbraw/zinc/73/48/13/385734813.db2.gz GVRPXNXETTZCDX-MCIONIFRSA-N 2 0 222.376 2.060 20 0 BEADRP C[NH2+]CCC[NH2+][C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000414858952 385735038 /nfs/dbraw/zinc/73/50/38/385735038.db2.gz LQUDVNLADCUDAO-UWVGGRQHSA-N 2 0 238.297 2.307 20 0 BEADRP C[C@@H]([NH2+]Cc1ccsc1)[C@H]1CCC[NH2+]C1 ZINC000414859857 385738188 /nfs/dbraw/zinc/73/81/88/385738188.db2.gz UTNREXLVBZHBCP-PWSUYJOCSA-N 2 0 224.373 2.226 20 0 BEADRP C[C@H]([NH2+]Cc1ccsc1)[C@@H]1CCC[NH2+]C1 ZINC000414859850 385738738 /nfs/dbraw/zinc/73/87/38/385738738.db2.gz UTNREXLVBZHBCP-CMPLNLGQSA-N 2 0 224.373 2.226 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H](C)[C@H](C)c1ccccc1 ZINC000414861669 385752421 /nfs/dbraw/zinc/75/24/21/385752421.db2.gz SSHMKSQTACKNKQ-STQMWFEESA-N 2 0 220.360 2.378 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCC[C@H]1C)[C@H]1CCC[NH2+]C1 ZINC000414863096 385756707 /nfs/dbraw/zinc/75/67/07/385756707.db2.gz XXWUISQREWNBOT-NDBYEHHHSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]Cc1cccc(C(F)(F)F)c1 ZINC000336700512 385765640 /nfs/dbraw/zinc/76/56/40/385765640.db2.gz JRLZXNDIFOHHPB-SECBINFHSA-N 2 0 246.276 2.390 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CCCOC1CCCCC1 ZINC000336701714 385768694 /nfs/dbraw/zinc/76/86/94/385768694.db2.gz JWPJUDGCUGYRQX-CYBMUJFWSA-N 2 0 242.407 2.443 20 0 BEADRP CC[N@H+](CCC(C)C)[C@H]1CCC[NH2+]CC1 ZINC000309652764 385769908 /nfs/dbraw/zinc/76/99/08/385769908.db2.gz UFRXJYLWLXDERW-ZDUSSCGKSA-N 2 0 212.381 2.497 20 0 BEADRP CCN(CC[C@H]1CCC[N@@H+]1C)Cc1ccncc1 ZINC000271029959 385773269 /nfs/dbraw/zinc/77/32/69/385773269.db2.gz QCOJTHDGBHALOT-OAHLLOKOSA-N 2 0 247.386 2.388 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCc3ccccc3C2)CC[NH2+]1 ZINC000414947438 385802054 /nfs/dbraw/zinc/80/20/54/385802054.db2.gz KVBFWHLEHRSJIX-WQVCFCJDSA-N 2 0 244.382 2.274 20 0 BEADRP C[C@H]1C[NH2+]CC[C@@H]1[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC000414947806 385805156 /nfs/dbraw/zinc/80/51/56/385805156.db2.gz WZGZPYVLNJSOIZ-TUUVXOQKSA-N 2 0 244.382 2.378 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC000414947805 385806542 /nfs/dbraw/zinc/80/65/42/385806542.db2.gz WZGZPYVLNJSOIZ-SYAUCNOPSA-N 2 0 244.382 2.378 20 0 BEADRP CC[C@@H]([NH2+]C[C@H](C)CC(F)F)[C@@H]1CCC[NH2+]1 ZINC000647801125 385811323 /nfs/dbraw/zinc/81/13/23/385811323.db2.gz OQRRPFJTOQDGBI-MXWKQRLJSA-N 2 0 234.334 2.398 20 0 BEADRP C[C@@H]([NH2+]C[C@H](C)C[NH+](C)C)C1CCCC1 ZINC000336714661 385811729 /nfs/dbraw/zinc/81/17/29/385811729.db2.gz WCAJIDMFQVVTJW-NWDGAFQWSA-N 2 0 212.381 2.352 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+]CC1=CC[N@H+](C)CC1 ZINC000271869226 385857032 /nfs/dbraw/zinc/85/70/32/385857032.db2.gz MGJIZVSSHZHGNS-ZDUSSCGKSA-N 2 0 245.370 2.303 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]CC1CCC(F)CC1 ZINC000647804638 385838570 /nfs/dbraw/zinc/83/85/70/385838570.db2.gz WHYGTOXMOPHGRS-BLYZHGLHSA-N 2 0 242.382 2.492 20 0 BEADRP CC[C@@H](Cc1ccccc1)[NH2+][C@@H]1CCCNC1 ZINC000414870301 385848963 /nfs/dbraw/zinc/84/89/63/385848963.db2.gz SFJVIAZQXIDHDA-LSDHHAIUSA-N 2 0 232.371 2.349 20 0 BEADRP C[C@@H](CCc1ccsc1)N[C@H]1CC[NH2+]C1 ZINC000414867135 385793304 /nfs/dbraw/zinc/79/33/04/385793304.db2.gz GFBNJYDXTFQBJO-JQWIXIFHSA-N 2 0 224.373 2.021 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)C(F)F ZINC000647798621 385795485 /nfs/dbraw/zinc/79/54/85/385795485.db2.gz UHTUGQZYVWORBJ-YTWAJWBKSA-N 2 0 232.318 2.008 20 0 BEADRP C[C@@H]1CC([NH2+]C2CCC(C[NH3+])CC2)C[C@@H](C)O1 ZINC000335037709 385928519 /nfs/dbraw/zinc/92/85/19/385928519.db2.gz FBYBOPDQQQEXFL-OKZRHMCRSA-N 2 0 240.391 2.050 20 0 BEADRP CCc1oc2ccccc2c1CN[C@@H](C)C[NH3+] ZINC000414961780 385887324 /nfs/dbraw/zinc/88/73/24/385887324.db2.gz WDXZKYGNDWNRAS-JTQLQIEISA-N 2 0 232.327 2.432 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@@H](C)CCc1ccsc1 ZINC000414874693 385887714 /nfs/dbraw/zinc/88/77/14/385887714.db2.gz IURDDIMABPPJIH-QWRGUYRKSA-N 2 0 226.389 2.254 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H]1CCC[C@@H](C2CC2)C1 ZINC000414875696 385901953 /nfs/dbraw/zinc/90/19/53/385901953.db2.gz KHHKDUSDHNHNSP-RTXFEEFZSA-N 2 0 210.365 2.140 20 0 BEADRP CS[C@H]1CC[C@H]1[NH2+]C1CCC([NH+](C)C)CC1 ZINC000336721722 385907094 /nfs/dbraw/zinc/90/70/94/385907094.db2.gz ZZNZWYQSQVQUMX-TUUUFIMRSA-N 2 0 242.432 2.343 20 0 BEADRP CCCC[C@H](COC)[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000414965228 385913268 /nfs/dbraw/zinc/91/32/68/385913268.db2.gz NJOJKVSXGCMGIT-UONOGXRCSA-N 2 0 242.407 2.313 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+]C[C@H]1CCCC[C@H]1C ZINC000414965878 385914223 /nfs/dbraw/zinc/91/42/23/385914223.db2.gz WCGHEKWELNWDMR-JHJVBQTASA-N 2 0 212.381 2.400 20 0 BEADRP C([NH2+][C@@H]1CCC12CCCC2)[C@@H]1CCC[NH2+]1 ZINC000335034818 385923511 /nfs/dbraw/zinc/92/35/11/385923511.db2.gz YMGOIHHGCVJRMY-NWDGAFQWSA-N 2 0 208.349 2.051 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H]2CCCC[C@H]2C2CC2)CCC1 ZINC000414872140 385861411 /nfs/dbraw/zinc/86/14/11/385861411.db2.gz FJKZIBMUKPURCZ-QWHCGFSZSA-N 2 0 222.376 2.426 20 0 BEADRP CCC[NH2+]CC[NH2+]C1C[C@@H](C)C[C@H](C)C1 ZINC000414872397 385865804 /nfs/dbraw/zinc/86/58/04/385865804.db2.gz PVSDKGCBGAOZFQ-RYUDHWBXSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H]1CCC(C)(C)C[C@H]1C ZINC000414872897 385871530 /nfs/dbraw/zinc/87/15/30/385871530.db2.gz GMSYFQZRABWBKM-IJLUTSLNSA-N 2 0 212.381 2.386 20 0 BEADRP CC[N@H+](CCCn1ccnc1)Cc1ccncc1 ZINC000272069043 385874235 /nfs/dbraw/zinc/87/42/35/385874235.db2.gz UCXHJWFZRGYPEH-UHFFFAOYSA-N 2 0 244.342 2.190 20 0 BEADRP C[C@@H](C[NH2+]C[C@@H](C)C[NH3+])Cc1ccccc1 ZINC000414873521 385876924 /nfs/dbraw/zinc/87/69/24/385876924.db2.gz HKPQPRSXGJNWQC-OLZOCXBDSA-N 2 0 220.360 2.050 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]C[C@@H](C)Cc1ccccc1 ZINC000414873523 385877685 /nfs/dbraw/zinc/87/76/85/385877685.db2.gz HKPQPRSXGJNWQC-QWHCGFSZSA-N 2 0 220.360 2.050 20 0 BEADRP CC[N@H+](C)C[C@@H]1CC[NH+](C[C@@](C)(CC)OC)C1 ZINC000638136049 385878741 /nfs/dbraw/zinc/87/87/41/385878741.db2.gz WRBKHOVNMJTZTO-UONOGXRCSA-N 2 0 242.407 2.075 20 0 BEADRP CC[C@@H]1CCC[C@@H](C[NH2+]C[C@@H](C)C[NH3+])C1 ZINC000414873729 385880766 /nfs/dbraw/zinc/88/07/66/385880766.db2.gz HTKFKYYDKJPQOU-YNEHKIRRSA-N 2 0 212.381 2.387 20 0 BEADRP C([NH2+]C1CCC2(CC2)CC1)[C@@H]1CCC[NH2+]C1 ZINC000335019746 385977883 /nfs/dbraw/zinc/97/78/83/385977883.db2.gz SEHMLVCTVUBPPX-GFCCVEGCSA-N 2 0 222.376 2.298 20 0 BEADRP C([NH2+][C@H]1CCCC12CCC2)[C@H]1CCC[NH2+]C1 ZINC000335018795 385978141 /nfs/dbraw/zinc/97/81/41/385978141.db2.gz LAAFMFHCNPDONI-STQMWFEESA-N 2 0 222.376 2.298 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]CC1CCSCC1 ZINC000335019263 385978521 /nfs/dbraw/zinc/97/85/21/385978521.db2.gz NAPONXLLUPLIIR-OLZOCXBDSA-N 2 0 242.432 2.379 20 0 BEADRP [NH3+]C1(C[NH2+][C@H]2CCC23CCCC3)CCC1 ZINC000335023798 385984805 /nfs/dbraw/zinc/98/48/05/385984805.db2.gz MKYLWWNXSBQLQK-NSHDSACASA-N 2 0 208.349 2.180 20 0 BEADRP C[C@@H]([NH2+]CC1CC[NH+](C)CC1)[C@H]1CC1(C)C ZINC000336749002 385990433 /nfs/dbraw/zinc/99/04/33/385990433.db2.gz TUVQBZBOIJSGCN-DGCLKSJQSA-N 2 0 224.392 2.352 20 0 BEADRP C[NH+](C)CCC[NH2+][C@@H]1CCC12CCCC2 ZINC000189035581 385932467 /nfs/dbraw/zinc/93/24/67/385932467.db2.gz ZRIYLDMNNNLPQQ-GFCCVEGCSA-N 2 0 210.365 2.251 20 0 BEADRP CC1(C[NH2+][C@@H]2CCC[C@H]2[NH3+])Cc2ccccc2C1 ZINC000335044217 385938931 /nfs/dbraw/zinc/93/89/31/385938931.db2.gz XSERYUWLPRWJBH-HUUCEWRRSA-N 2 0 244.382 2.261 20 0 BEADRP C[NH+](C)CCC[NH2+][C@@H]1CCCC12CCC2 ZINC000394728175 385939653 /nfs/dbraw/zinc/93/96/53/385939653.db2.gz JONNEDMAAFDSMT-GFCCVEGCSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+]C1CCC(C[NH3+])CC1 ZINC000335046136 385941267 /nfs/dbraw/zinc/94/12/67/385941267.db2.gz ZSCWNVGPPUHOEK-XVSSEFHLSA-N 2 0 210.365 2.282 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](C)[C@H]2C[C@H]2C)C1 ZINC000414066984 385941855 /nfs/dbraw/zinc/94/18/55/385941855.db2.gz IMGYRMKSBHITDD-SYQHCUMBSA-N 2 0 224.392 2.352 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](C)[C@@H]2C[C@H]2C)C1 ZINC000414066977 385942821 /nfs/dbraw/zinc/94/28/21/385942821.db2.gz IMGYRMKSBHITDD-AAVRWANBSA-N 2 0 224.392 2.352 20 0 BEADRP CCCC[C@@H]1CCC[C@H]1[NH2+][C@H]1CC[NH2+]C1 ZINC000414878883 385944484 /nfs/dbraw/zinc/94/44/84/385944484.db2.gz HYVASTXUDFQHRO-FRRDWIJNSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1CCC[C@H](C)[C@H]1[NH2+]CC1([NH3+])CCC1 ZINC000335050355 385946770 /nfs/dbraw/zinc/94/67/70/385946770.db2.gz BZRFJLBQFTXIJU-GDNZZTSVSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H](C[NH2+]Cc1cccc2[nH]ccc21)C[NH+](C)C ZINC000291744023 385947006 /nfs/dbraw/zinc/94/70/06/385947006.db2.gz PHTKQOVQEUPLDV-LBPRGKRZSA-N 2 0 245.370 2.455 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]CCCC(F)(F)F ZINC000123931514 385947557 /nfs/dbraw/zinc/94/75/57/385947557.db2.gz IEXGJXYRDXFCCP-DTWKUNHWSA-N 2 0 224.270 2.046 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]CCCC(F)(F)F ZINC000123931902 385950072 /nfs/dbraw/zinc/95/00/72/385950072.db2.gz IEXGJXYRDXFCCP-IUCAKERBSA-N 2 0 224.270 2.046 20 0 BEADRP [NH3+]C1(CN[C@@H]2CCc3cc(F)ccc32)CCC1 ZINC000335052518 385951416 /nfs/dbraw/zinc/95/14/16/385951416.db2.gz LTRZIHXQTWTEJU-CYBMUJFWSA-N 2 0 234.318 2.284 20 0 BEADRP CC[C@@H](C)[N@@H+]1CCC[C@@H](c2ncc[nH]2)C1 ZINC000273133988 385971860 /nfs/dbraw/zinc/97/18/60/385971860.db2.gz VLBDSGGTNJABFH-GHMZBOCLSA-N 2 0 207.321 2.388 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@H](C)[C@H]1CC1(C)C ZINC000336750029 386000923 /nfs/dbraw/zinc/00/09/23/386000923.db2.gz FLQMZZWGRZRXFX-IJLUTSLNSA-N 2 0 212.381 2.351 20 0 BEADRP CC[C@H]1CCC[C@@H]([NH2+]CC2([NH3+])CCC2)C1 ZINC000414881485 386001064 /nfs/dbraw/zinc/00/10/64/386001064.db2.gz SJKWVQOLRGBWPJ-NWDGAFQWSA-N 2 0 210.365 2.426 20 0 BEADRP CCN1CCCC[C@@H]1C[NH2+][C@H](C)[C@@H]1C[C@@H]1C ZINC000414111673 386006559 /nfs/dbraw/zinc/00/65/59/386006559.db2.gz JDHQPLQNDFNEKP-REWJHTLYSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1)[C@H]1C[C@H]1C ZINC000414117308 386010642 /nfs/dbraw/zinc/01/06/42/386010642.db2.gz RVJGGNGKOPQGSN-BJJPWKGXSA-N 2 0 224.392 2.493 20 0 BEADRP C[C@H]([NH2+]CC1([NH3+])CCC1)C1CCCCC1 ZINC000414882385 386011048 /nfs/dbraw/zinc/01/10/48/386011048.db2.gz UEUKUFPDRIKAJN-NSHDSACASA-N 2 0 210.365 2.426 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H]1C[C@@H](C)CC(C)(C)C1 ZINC000414882304 386012710 /nfs/dbraw/zinc/01/27/10/386012710.db2.gz UABUVFZZEQUROJ-IJLUTSLNSA-N 2 0 212.381 2.386 20 0 BEADRP CC[C@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)C1CC1 ZINC000414170853 386015786 /nfs/dbraw/zinc/01/57/86/386015786.db2.gz CLEMYGLHPYKZFM-JSGCOSHPSA-N 2 0 224.392 2.497 20 0 BEADRP C[N@@H+]1CCC[C@H](CC[NH2+][C@H]2CCC2(C)C)C1 ZINC000414168598 386016703 /nfs/dbraw/zinc/01/67/03/386016703.db2.gz ANUPTYXQDIYIGU-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP COC1(C[NH2+][C@H](C)CCCC[NH3+])CCCC1 ZINC000309521694 386018590 /nfs/dbraw/zinc/01/85/90/386018590.db2.gz UGVYTPWQMJTUQT-GFCCVEGCSA-N 2 0 228.380 2.053 20 0 BEADRP C[NH2+][C@@H]1CCN(c2cc[nH+]c3ccccc32)C1 ZINC000129122247 386031740 /nfs/dbraw/zinc/03/17/40/386031740.db2.gz LTEPWXMJPVHSCQ-LLVKDONJSA-N 2 0 227.311 2.033 20 0 BEADRP COCCC[C@H](C)[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC000414201709 386037152 /nfs/dbraw/zinc/03/71/52/386037152.db2.gz YIGAOKKZAOLQSX-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)C[N@@H+]1CC[C@]2(C1)CCC[NH+](C)C2 ZINC000334429118 386039514 /nfs/dbraw/zinc/03/95/14/386039514.db2.gz IRTHRNMXDNCYAN-CYBMUJFWSA-N 2 0 210.365 2.060 20 0 BEADRP C[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)[C@@H]1C[C@H]1C ZINC000414159816 386046198 /nfs/dbraw/zinc/04/61/98/386046198.db2.gz YTEIEWYEWOYAJE-LALPHHSUSA-N 2 0 236.403 2.495 20 0 BEADRP COC1(C[NH2+]C[C@H](C)C[NH+](C)C)CCCCC1 ZINC000319780968 386062365 /nfs/dbraw/zinc/06/23/65/386062365.db2.gz ZDZMNSNHKDFJSL-ZDUSSCGKSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@H]1C[C@H]([NH2+]C[C@H]([NH3+])C2CC2)C[C@@H](C)C1 ZINC000414885963 386065668 /nfs/dbraw/zinc/06/56/68/386065668.db2.gz GXFAIWMVYLXHAM-YGNMPJRFSA-N 2 0 210.365 2.138 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@H]2CC2(C)C)[C@@H]2CCC[C@H]21 ZINC000414217391 386072400 /nfs/dbraw/zinc/07/24/00/386072400.db2.gz CCSCJFYWAXFXHA-RVMXOQNASA-N 2 0 222.376 2.247 20 0 BEADRP C[NH+](C)[C@H]1CCC[N@H+](CCOC(C)(C)C)CC1 ZINC000365382124 386072853 /nfs/dbraw/zinc/07/28/53/386072853.db2.gz WJBNXTBYDMREMJ-ZDUSSCGKSA-N 2 0 242.407 2.218 20 0 BEADRP C[C@@H](C[NH2+][C@H]1CCC12CCC2)N(C)C1CC1 ZINC000336728773 386081263 /nfs/dbraw/zinc/08/12/63/386081263.db2.gz CRGKMCVQRDCNEL-AAEUAGOBSA-N 2 0 222.376 2.391 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCC12CCC2)N(C)C1CC1 ZINC000336728776 386082345 /nfs/dbraw/zinc/08/23/45/386082345.db2.gz CRGKMCVQRDCNEL-YPMHNXCESA-N 2 0 222.376 2.391 20 0 BEADRP FC1(F)CC[C@H](C[N@@H+]2CC[C@]3(CC[NH2+]C3)C2)C1 ZINC000310087565 386083163 /nfs/dbraw/zinc/08/31/63/386083163.db2.gz BLOPNIZDEWTGOT-RYUDHWBXSA-N 2 0 244.329 2.107 20 0 BEADRP CC[C@@H]([NH3+])CNCc1ccc(F)c(Cl)c1 ZINC000414987910 386122657 /nfs/dbraw/zinc/12/26/57/386122657.db2.gz ZKYUTQZJJXCIFB-SECBINFHSA-N 2 0 230.714 2.306 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@@H](C)CCc1ccsc1 ZINC000414984334 386093239 /nfs/dbraw/zinc/09/32/39/386093239.db2.gz GDMCCDZGPRUZDM-CMPLNLGQSA-N 2 0 226.389 2.396 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H]2CCC[C@H]2C2CC2)CCC1 ZINC000414887753 386095673 /nfs/dbraw/zinc/09/56/73/386095673.db2.gz ZKEQJSVRANXWFS-NWDGAFQWSA-N 2 0 208.349 2.036 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@H]([NH3+])C2CC2)C[C@H]1C ZINC000414891938 386144728 /nfs/dbraw/zinc/14/47/28/386144728.db2.gz OZNWEFSHCWRTCF-AAXDQBDMSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)c1ccncc1F ZINC000340530512 386146070 /nfs/dbraw/zinc/14/60/70/386146070.db2.gz HCUUOOHISIVRSO-LLVKDONJSA-N 2 0 249.333 2.133 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@@H]([NH3+])C2CC2)C[C@H]1C ZINC000414891948 386146240 /nfs/dbraw/zinc/14/62/40/386146240.db2.gz OZNWEFSHCWRTCF-VCDKRKBESA-N 2 0 210.365 2.138 20 0 BEADRP [NH3+]CCC[N@@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC000414676184 386148153 /nfs/dbraw/zinc/14/81/53/386148153.db2.gz NBIDMNZHQLMHLX-CYBMUJFWSA-N 2 0 222.307 2.311 20 0 BEADRP C[C@@H]1CC(C)(C)CC[C@H]1[NH2+][C@@H]1CC[NH2+]C1 ZINC000414892270 386150162 /nfs/dbraw/zinc/15/01/62/386150162.db2.gz XTTFRFQIQSMPEX-IJLUTSLNSA-N 2 0 210.365 2.153 20 0 BEADRP [NH3+][C@H]1CCCCC[C@@H]1[NH2+]C1CCSCC1 ZINC000335159248 386155831 /nfs/dbraw/zinc/15/58/31/386155831.db2.gz WANPDROCSPOFRT-RYUDHWBXSA-N 2 0 228.405 2.132 20 0 BEADRP COc1ccccc1C[NH2+]C[C@@H]1CCC[C@@H]([NH3+])C1 ZINC000414992343 386156705 /nfs/dbraw/zinc/15/67/05/386156705.db2.gz KHUNJYFOVNQMCW-TZMCWYRMSA-N 2 0 248.370 2.302 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@H]1Cc2ccc(Cl)cc2C1 ZINC000414992851 386158492 /nfs/dbraw/zinc/15/84/92/386158492.db2.gz SCJRTMGRNRGKBO-STQMWFEESA-N 2 0 238.762 2.134 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@@H]1CCCC[C@@H]1C1CC1 ZINC000414992987 386161156 /nfs/dbraw/zinc/16/11/56/386161156.db2.gz SKIYDFOUOTVBBX-YNEHKIRRSA-N 2 0 210.365 2.282 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@H](C)CCC(F)(F)F ZINC000414993661 386161823 /nfs/dbraw/zinc/16/18/23/386161823.db2.gz TUZMCAKIYZMASU-SFYZADRCSA-N 2 0 212.259 2.044 20 0 BEADRP CC[NH+](CC)[C@H]1CCN(c2cc[nH+]c(C)c2)C1 ZINC000274951876 386165590 /nfs/dbraw/zinc/16/55/90/386165590.db2.gz VIKCOOREQJIFHP-AWEZNQCLSA-N 2 0 233.359 2.311 20 0 BEADRP COc1ccccc1[C@@H]1CCC[N@@H+]1CCC[NH3+] ZINC000414686748 386177162 /nfs/dbraw/zinc/17/71/62/386177162.db2.gz AZGNMRGKWMFEIV-ZDUSSCGKSA-N 2 0 234.343 2.181 20 0 BEADRP C[C@@H](CCC(F)(F)F)[NH2+]C[C@H]([NH3+])C1CC1 ZINC000414894863 386178431 /nfs/dbraw/zinc/17/84/31/386178431.db2.gz UTXBGGINWLPQDO-CBAPKCEASA-N 2 0 224.270 2.044 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@H](CC)Cc1ccccc1 ZINC000414995788 386179905 /nfs/dbraw/zinc/17/99/05/386179905.db2.gz WSGKXSGXMCRONP-ZIAGYGMSSA-N 2 0 220.360 2.335 20 0 BEADRP C[C@@H](CCCC(F)(F)F)[NH2+]C[C@H]([NH3+])C1CC1 ZINC000414895256 386181424 /nfs/dbraw/zinc/18/14/24/386181424.db2.gz WKBXEVRWQMWLJB-WPRPVWTQSA-N 2 0 238.297 2.434 20 0 BEADRP C[C@H]([NH2+]C[C@@H]([NH3+])C1CC1)C1CCCCC1 ZINC000414895219 386182839 /nfs/dbraw/zinc/18/28/39/386182839.db2.gz WBTUVBQPWKZLTL-GXFFZTMASA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]([NH2+][C@H]1CCCC[C@H]1C[NH3+])c1ccccn1 ZINC000160812891 386184617 /nfs/dbraw/zinc/18/46/17/386184617.db2.gz DQTGHNJQYARDHW-OBJOEFQTSA-N 2 0 233.359 2.250 20 0 BEADRP CC(C)N(C)C[C@@H](C)[NH2+][C@H]1CCOC(C)(C)C1 ZINC000310429085 386185575 /nfs/dbraw/zinc/18/55/75/386185575.db2.gz MSKQCNUTWGXNMQ-OLZOCXBDSA-N 2 0 242.407 2.262 20 0 BEADRP CC[C@H]([NH3+])CNCc1ccc(F)c(Cl)c1 ZINC000414987912 386125102 /nfs/dbraw/zinc/12/51/02/386125102.db2.gz ZKYUTQZJJXCIFB-VIFPVBQESA-N 2 0 230.714 2.306 20 0 BEADRP CC[N@H+](C)C[C@@H]1CC[NH+](CC2(C)CCC2)C1 ZINC000340282436 386203263 /nfs/dbraw/zinc/20/32/63/386203263.db2.gz KDSTZLZOIILNQP-ZDUSSCGKSA-N 2 0 224.392 2.450 20 0 BEADRP C[C@H](CC[NH3+])[NH2+]C[C@H](C)c1ccc(F)cc1 ZINC000414896776 386207891 /nfs/dbraw/zinc/20/78/91/386207891.db2.gz PUWPHBFCOIWFSQ-WDEREUQCSA-N 2 0 224.323 2.256 20 0 BEADRP Cc1ccccc1C[C@@H](C)[NH2+]CCCC[NH3+] ZINC000414896828 386208865 /nfs/dbraw/zinc/20/88/65/386208865.db2.gz AGUIFKGBVYOXGQ-CYBMUJFWSA-N 2 0 220.360 2.255 20 0 BEADRP Cc1cc(C)cc(C[N@H+]2C[C@H](C[NH3+])C[C@@H]2C)c1 ZINC000131484855 386209193 /nfs/dbraw/zinc/20/91/93/386209193.db2.gz UFOCGSBCMHGCOX-ZFWWWQNUSA-N 2 0 232.371 2.473 20 0 BEADRP C[C@@H](C[NH2+]C[C@@H]1CCC[NH2+]C1)c1ccccc1 ZINC000132020198 386218771 /nfs/dbraw/zinc/21/87/71/386218771.db2.gz ZBZUNAZLFPKGCF-UONOGXRCSA-N 2 0 232.371 2.379 20 0 BEADRP CC(C)[N@H+](C)CCN[C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000132090003 386219432 /nfs/dbraw/zinc/21/94/32/386219432.db2.gz JUSCZQKTPWFNLG-LSDHHAIUSA-N 2 0 247.386 2.061 20 0 BEADRP CC[NH+](CC)CCN[C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000131886745 386226546 /nfs/dbraw/zinc/22/65/46/386226546.db2.gz LUKPNPRVMJHJRW-GJZGRUSLSA-N 2 0 247.386 2.063 20 0 BEADRP COc1ccc([C@H](C)C[N@@H+]2CCC[C@@H]2CN)cc1 ZINC000347125425 386237104 /nfs/dbraw/zinc/23/71/04/386237104.db2.gz YFVPLCJEWFKGCU-TZMCWYRMSA-N 2 0 248.370 2.222 20 0 BEADRP CCOc1cccc(C[N@H+](C)C2CC[NH2+]CC2)c1 ZINC000347096086 386247323 /nfs/dbraw/zinc/24/73/23/386247323.db2.gz IXCWMOYSZVPXMY-UHFFFAOYSA-N 2 0 248.370 2.269 20 0 BEADRP C[N@H+](CCC1CC1)C[C@@H]1CCC[NH+](C)C1 ZINC000336645586 386250869 /nfs/dbraw/zinc/25/08/69/386250869.db2.gz IEIWFUKXQUDSNO-CYBMUJFWSA-N 2 0 210.365 2.060 20 0 BEADRP CCSCC[N@H+](C)[C@H]1CCN(C)C[C@H]1C ZINC000336648794 386261245 /nfs/dbraw/zinc/26/12/45/386261245.db2.gz PPWGSARFHVPBII-NEPJUHHUSA-N 2 0 230.421 2.012 20 0 BEADRP Cc1ccccc1C[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000414896045 386195387 /nfs/dbraw/zinc/19/53/87/386195387.db2.gz AVPUQAGBEPSLMG-HNNXBMFYSA-N 2 0 232.371 2.474 20 0 BEADRP COc1ccc2oc(C[NH2+][C@H](C)CC[NH3+])cc2c1 ZINC000414896284 386199242 /nfs/dbraw/zinc/19/92/42/386199242.db2.gz OLWVKJWLWADSMW-SNVBAGLBSA-N 2 0 248.326 2.268 20 0 BEADRP Cc1ccc(C[C@H](C)[N@H+](C)C[C@H]2CC[NH2+]C2)cc1 ZINC000647886091 386294084 /nfs/dbraw/zinc/29/40/84/386294084.db2.gz PZSZCUFLZUATQV-HOCLYGCPSA-N 2 0 246.398 2.467 20 0 BEADRP C[C@H](CC[NH3+])[NH2+]Cc1cccc2c1OC(C)(C)C2 ZINC000414901436 386302323 /nfs/dbraw/zinc/30/23/23/386302323.db2.gz WZXWVLXPTDRAFT-LLVKDONJSA-N 2 0 248.370 2.227 20 0 BEADRP Cc1cc(C[NH2+][C@H](C)CC[NH3+])cc2cccnc12 ZINC000414901728 386311738 /nfs/dbraw/zinc/31/17/38/386311738.db2.gz XJXKHTTXYOPWGE-GFCCVEGCSA-N 2 0 243.354 2.370 20 0 BEADRP C[C@@H](C1CCCCC1)[N@H+](C)C[C@@H]1CC[NH2+]C1 ZINC000647988776 386317867 /nfs/dbraw/zinc/31/78/67/386317867.db2.gz KSPAVCSDHUAPEM-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP CCN1C[C@H]([NH2+][C@@H](C)CC(C)(C)OC)[C@@H](C)C1 ZINC000347141901 386261541 /nfs/dbraw/zinc/26/15/41/386261541.db2.gz HXKPWOLKDLYGLD-AVGNSLFASA-N 2 0 242.407 2.120 20 0 BEADRP COCc1cccc(C[N@H+](C)C2CC[NH2+]CC2)c1 ZINC000347161927 386265296 /nfs/dbraw/zinc/26/52/96/386265296.db2.gz HUYSWJRBGCLGBK-UHFFFAOYSA-N 2 0 248.370 2.017 20 0 BEADRP C[NH2+]CCC[N@H+](C)CCCCC1CCOCC1 ZINC000310063087 386356302 /nfs/dbraw/zinc/35/63/02/386356302.db2.gz DVIFIBNUHFQDAQ-UHFFFAOYSA-N 2 0 242.407 2.125 20 0 BEADRP C[N@@H+](Cc1cc2ccccc2o1)C[C@H]1CC[NH2+]C1 ZINC000647889300 386357616 /nfs/dbraw/zinc/35/76/16/386357616.db2.gz CQFPUQSJJYSKSO-LBPRGKRZSA-N 2 0 244.338 2.474 20 0 BEADRP CC[N@H+](C)C[C@@H]1CC[NH+](CCC(C)(C)OC)C1 ZINC000336691323 386359916 /nfs/dbraw/zinc/35/99/16/386359916.db2.gz GEIRANYNIYDJFM-ZDUSSCGKSA-N 2 0 242.407 2.075 20 0 BEADRP COC(C)(C)CC[NH+]1CCC(C[NH+](C)C)CC1 ZINC000336691324 386360966 /nfs/dbraw/zinc/36/09/66/386360966.db2.gz GHINHXVRXGNPKC-UHFFFAOYSA-N 2 0 242.407 2.075 20 0 BEADRP Cn1cccc1C[NH2+]CC(C)(C)C[NH+]1CCCC1 ZINC000276677656 386361704 /nfs/dbraw/zinc/36/17/04/386361704.db2.gz GUCQWZIUKGIOFD-UHFFFAOYSA-N 2 0 249.402 2.237 20 0 BEADRP COC(C)(C)CC[NH+]1CCC([NH2+]C(C)C)CC1 ZINC000336693021 386365570 /nfs/dbraw/zinc/36/55/70/386365570.db2.gz KLRZNTCDPNIATN-UHFFFAOYSA-N 2 0 242.407 2.264 20 0 BEADRP C[C@@H](C[NH2+]CCCC[NH3+])Cc1ccccc1 ZINC000414902560 386329820 /nfs/dbraw/zinc/32/98/20/386329820.db2.gz JZASGXNGBWDMPZ-CYBMUJFWSA-N 2 0 220.360 2.194 20 0 BEADRP C[C@@H]1CC2(C[N@@H+]1Cc1ccncc1)CC[NH2+]CC2 ZINC000335275528 386334810 /nfs/dbraw/zinc/33/48/10/386334810.db2.gz CEHMAXFWICFHFG-CYBMUJFWSA-N 2 0 245.370 2.046 20 0 BEADRP c1cn(CC[N@@H+]2CC[C@H]2c2ccccc2)cn1 ZINC000336715931 386445110 /nfs/dbraw/zinc/44/51/10/386445110.db2.gz VFYXNGCAQQAXBV-AWEZNQCLSA-N 2 0 227.311 2.330 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+][C@@H]1CCCSC1 ZINC000157119569 386449990 /nfs/dbraw/zinc/44/99/90/386449990.db2.gz RVVIQCLXNZALAC-LPWJVIDDSA-N 2 0 242.432 2.200 20 0 BEADRP CC(C)[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@@H]([NH3+])C2)CCO1 ZINC000414907745 386393118 /nfs/dbraw/zinc/39/31/18/386393118.db2.gz AVSPSVOQQYNIHL-RQJABVFESA-N 2 0 240.391 2.050 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H]([NH+](C)C)C2)[C@@H]1C ZINC000336776737 386400830 /nfs/dbraw/zinc/40/08/30/386400830.db2.gz GMLPXUPROGSJBO-KSTCHIGDSA-N 2 0 224.392 2.493 20 0 BEADRP C[C@H]([NH3+])C[N@@H+]1C[C@@H](c2ccccc2)C[C@@H]1C ZINC000442664581 386420067 /nfs/dbraw/zinc/42/00/67/386420067.db2.gz MNYGRXUINYDJFF-OBJOEFQTSA-N 2 0 218.344 2.212 20 0 BEADRP C[C@H]([NH3+])C[N@@H+]1C[C@H](c2ccccc2)C[C@@H]1C ZINC000442664588 386420573 /nfs/dbraw/zinc/42/05/73/386420573.db2.gz MNYGRXUINYDJFF-SGMGOOAPSA-N 2 0 218.344 2.212 20 0 BEADRP CCSCC[N@@H+]1CC[C@]2(C1)CCC[NH+](C)C2 ZINC000339434376 386424029 /nfs/dbraw/zinc/42/40/29/386424029.db2.gz JYSWUILMXVVVOE-CYBMUJFWSA-N 2 0 242.432 2.157 20 0 BEADRP CC[C@@H]1C[C@@H](C)C[N@@H+]1CC[C@H]1CC[NH2+]C1 ZINC000399148418 386427194 /nfs/dbraw/zinc/42/71/94/386427194.db2.gz GCVIQBLCXQRYEQ-JHJVBQTASA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@@H]1C[C@H](C)C[N@@H+]1CC[C@@H]1CCC[NH2+]C1 ZINC000399163026 386428464 /nfs/dbraw/zinc/42/84/64/386428464.db2.gz LOLHRVQTVQATEM-MELADBBJSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCN(C)[C@@H](C)C1)[C@H]1CC1(C)C ZINC000336743498 386431439 /nfs/dbraw/zinc/43/14/39/386431439.db2.gz PFZVFCINFYGTFE-WUHRBBMRSA-N 2 0 224.392 2.493 20 0 BEADRP CC[C@@H]1C[C@H](C)C[N@@H+]1C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000399173388 386433296 /nfs/dbraw/zinc/43/32/96/386433296.db2.gz PBOMNUQGPBJWFZ-REWJHTLYSA-N 2 0 224.392 2.495 20 0 BEADRP CO[C@@H](C)C[N@H+](CC[C@H]1CCC[NH+]1C)C(C)C ZINC000336714278 386434080 /nfs/dbraw/zinc/43/40/80/386434080.db2.gz QPHPUVCEJWYRBA-UONOGXRCSA-N 2 0 242.407 2.216 20 0 BEADRP CC[C@@H]1C[C@H](C)C[N@@H+]1C[C@H]1CC[NH2+][C@H](C)C1 ZINC000399173389 386435289 /nfs/dbraw/zinc/43/52/89/386435289.db2.gz PBOMNUQGPBJWFZ-RFQIPJPRSA-N 2 0 224.392 2.495 20 0 BEADRP CC1(C)CCC[C@@H]1[NH2+][C@@H]1CC[C@H](C[NH3+])C1 ZINC000415042824 386528440 /nfs/dbraw/zinc/52/84/40/386528440.db2.gz RGPCBEMXCBLHED-TUAOUCFPSA-N 2 0 210.365 2.282 20 0 BEADRP CC1(C[N@@H+]2CCC[C@H]([C@H]3CC[NH2+]C3)C2)CCC1 ZINC000414775184 386470813 /nfs/dbraw/zinc/47/08/13/386470813.db2.gz GGSQITKINANGRQ-KBPBESRZSA-N 2 0 236.403 2.498 20 0 BEADRP CCc1cc(OC)ccc1C[NH2+]C1CC[NH2+]CC1 ZINC000414775473 386471218 /nfs/dbraw/zinc/47/12/18/386471218.db2.gz CUBVDEBQTHAPIA-UHFFFAOYSA-N 2 0 248.370 2.099 20 0 BEADRP Cc1ccc(F)c(C[NH2+]CCn2ccnc2)c1 ZINC000227281353 386472646 /nfs/dbraw/zinc/47/26/46/386472646.db2.gz VSDSJIJIFHYPQN-UHFFFAOYSA-N 2 0 233.290 2.120 20 0 BEADRP CC[C@@H]1C[N@H+](CC[C@@H]2CCCCO2)CC[C@@H]1[NH3+] ZINC000647934370 386472829 /nfs/dbraw/zinc/47/28/29/386472829.db2.gz CDDABYTUTIGYMC-RDBSUJKOSA-N 2 0 240.391 2.005 20 0 BEADRP CC[C@@H]1C[N@H+](CC[C@@H]2CCCCO2)CC[C@H]1[NH3+] ZINC000647934367 386472911 /nfs/dbraw/zinc/47/29/11/386472911.db2.gz CDDABYTUTIGYMC-HZSPNIEDSA-N 2 0 240.391 2.005 20 0 BEADRP CC[C@@H]1C[N@H+](CC[C@H]2CCCCO2)CC[C@@H]1[NH3+] ZINC000647934368 386473109 /nfs/dbraw/zinc/47/31/09/386473109.db2.gz CDDABYTUTIGYMC-MCIONIFRSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@H](CN(C)C)[NH2+][C@H]1CC[C@H]1C1CCC1 ZINC000336742079 386476939 /nfs/dbraw/zinc/47/69/39/386476939.db2.gz WGWHEOLDKVOOJT-WXHSDQCUSA-N 2 0 210.365 2.105 20 0 BEADRP Cc1ncsc1CC[NH2+][C@H](C)CCCC[NH3+] ZINC000391227274 386488719 /nfs/dbraw/zinc/48/87/19/386488719.db2.gz FDVSORYTQVZZTQ-SNVBAGLBSA-N 2 0 241.404 2.101 20 0 BEADRP CC[C@H](Cc1ccccc1)[NH2+][C@@H](C)[C@@H](C)[NH3+] ZINC000415015844 386499232 /nfs/dbraw/zinc/49/92/32/386499232.db2.gz NHOQSMSVQDHLGD-MBNYWOFBSA-N 2 0 220.360 2.333 20 0 BEADRP CCCc1cccc(CN[C@H](C)[C@@H](C)[NH3+])c1 ZINC000415016654 386502943 /nfs/dbraw/zinc/50/29/43/386502943.db2.gz OISHPWUDBVHMRP-VXGBXAGGSA-N 2 0 220.360 2.464 20 0 BEADRP CCOc1ccccc1C[NH2+][C@@H](C)CCC[NH3+] ZINC000415018938 386505200 /nfs/dbraw/zinc/50/52/00/386505200.db2.gz HOVLAQPASPYGNY-LBPRGKRZSA-N 2 0 236.359 2.302 20 0 BEADRP C[C@@H]([NH2+][C@H]1Cc2ccc(Cl)cc2C1)[C@H](C)[NH3+] ZINC000415019168 386506091 /nfs/dbraw/zinc/50/60/91/386506091.db2.gz RPIWFSXSZPDEMU-RWEMILLDSA-N 2 0 238.762 2.133 20 0 BEADRP COc1ccccc1/C=C/CN(C)C1CC([NH3+])C1 ZINC000414783353 386512111 /nfs/dbraw/zinc/51/21/11/386512111.db2.gz YYZWBITTYOLSFN-FNORWQNLSA-N 2 0 246.354 2.130 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]Cc1cc(F)c(F)c(F)c1 ZINC000415021196 386512478 /nfs/dbraw/zinc/51/24/78/386512478.db2.gz KCGKVVGZMUYSBA-MRVPVSSYSA-N 2 0 246.276 2.321 20 0 BEADRP C[C@@H](C[NH2+][C@@H](C)CCC[NH3+])CC1CCOCC1 ZINC000415025457 386514250 /nfs/dbraw/zinc/51/42/50/386514250.db2.gz QZQRTPZRRYFLEM-OLZOCXBDSA-N 2 0 242.407 2.156 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H](C)CCC(F)(F)F ZINC000415024573 386514629 /nfs/dbraw/zinc/51/46/29/386514629.db2.gz PDDZFFNBHJKHPV-BDAKNGLRSA-N 2 0 226.286 2.434 20 0 BEADRP CC(C)CCC[C@@H](C)[NH2+]C[C@@H]1C[NH2+]CCCO1 ZINC000415028817 386515868 /nfs/dbraw/zinc/51/58/68/386515868.db2.gz AGXZGOAHRPOSRO-KGLIPLIRSA-N 2 0 242.407 2.169 20 0 BEADRP Cc1ccc(CCC[NH2+][C@H]2CC[C@H](C[NH3+])C2)cn1 ZINC000415027598 386515896 /nfs/dbraw/zinc/51/58/96/386515896.db2.gz BFYNOOJUHXUYPE-GJZGRUSLSA-N 2 0 247.386 2.040 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CC[C@H](C[NH3+])C2)cc1F ZINC000415028138 386516625 /nfs/dbraw/zinc/51/66/25/386516625.db2.gz CGZCFQFTWIHHGM-AAEUAGOBSA-N 2 0 236.334 2.351 20 0 BEADRP CCc1cc(OC)ccc1CN1CC[C@H]([NH3+])[C@@H]1C ZINC000414784786 386516956 /nfs/dbraw/zinc/51/69/56/386516956.db2.gz LIFCMEKNIVLGBE-NHYWBVRUSA-N 2 0 248.370 2.179 20 0 BEADRP Cc1ccc(CCC[NH2+][C@@H]2CC[C@@H](C[NH3+])C2)cn1 ZINC000415027599 386517203 /nfs/dbraw/zinc/51/72/03/386517203.db2.gz BFYNOOJUHXUYPE-HUUCEWRRSA-N 2 0 247.386 2.040 20 0 BEADRP Cc1ccncc1C[N@@H+]1CCCC[C@@H]1CC[NH3+] ZINC000135500127 386520353 /nfs/dbraw/zinc/52/03/53/386520353.db2.gz VUYJDYFDEVHCLJ-CQSZACIVSA-N 2 0 233.359 2.093 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CCCC[C@H]1[C@H]1CC[NH2+]C1 ZINC000415033814 386521137 /nfs/dbraw/zinc/52/11/37/386521137.db2.gz CCAALLDVQFTLCJ-RQJABVFESA-N 2 0 222.376 2.106 20 0 BEADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+]Cc2cc(F)cc(F)c2)C1 ZINC000415034697 386522442 /nfs/dbraw/zinc/52/24/42/386522442.db2.gz KDNSOLMGGQRMNK-NOZJJQNGSA-N 2 0 240.297 2.182 20 0 BEADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+]Cc2c(F)cccc2F)C1 ZINC000415037383 386524191 /nfs/dbraw/zinc/52/41/91/386524191.db2.gz MGPYEKUCTOZQAY-NXEZZACHSA-N 2 0 240.297 2.182 20 0 BEADRP [NH3+]C[C@@H]1CC[C@H]([NH2+]Cc2cccc(F)c2)C1 ZINC000415036918 386524639 /nfs/dbraw/zinc/52/46/39/386524639.db2.gz LUABHZOQQRXEGP-MFKMUULPSA-N 2 0 222.307 2.043 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+][C@H]1CCc2ccccc2C1 ZINC000414786468 386524849 /nfs/dbraw/zinc/52/48/49/386524849.db2.gz BHBPFGFGMCGDCL-GJZGRUSLSA-N 2 0 232.371 2.117 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@@H]([NH3+])[C@H](C)C2)cc1C ZINC000094338840 386457960 /nfs/dbraw/zinc/45/79/60/386457960.db2.gz NWERWQIKMPZRGH-UKRRQHHQSA-N 2 0 232.371 2.473 20 0 BEADRP CO[C@@H]1CCCC[C@@H]1[NH2+]C1CCC(C[NH3+])CC1 ZINC000415074375 386575008 /nfs/dbraw/zinc/57/50/08/386575008.db2.gz CKUGCHMTHJCION-CLRIEMFWSA-N 2 0 240.391 2.051 20 0 BEADRP CCc1ccccc1C[NH2+]C[C@@]1(C)CC[NH2+]C1 ZINC000415082028 386598321 /nfs/dbraw/zinc/59/83/21/386598321.db2.gz LEOYVOMBYDZZGK-HNNXBMFYSA-N 2 0 232.371 2.338 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@@H](C)Cc1ccoc1 ZINC000336757409 386586155 /nfs/dbraw/zinc/58/61/55/386586155.db2.gz YYWCOSMDHKRVFQ-NEPJUHHUSA-N 2 0 224.348 2.140 20 0 BEADRP C[C@H]1C[C@@H](C[NH2+]CCc2ccccc2)CC[NH2+]1 ZINC000415078741 386588536 /nfs/dbraw/zinc/58/85/36/386588536.db2.gz GWHAWWBSUBFZCM-ZFWWWQNUSA-N 2 0 232.371 2.207 20 0 BEADRP C[C@H](CC1CC1)[NH2+]C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000415079571 386591313 /nfs/dbraw/zinc/59/13/13/386591313.db2.gz IJAMIRMEINRIHV-NQBHXWOUSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H](Cc1ccccc1F)[NH2+][C@@H](CN)C1CC1 ZINC000414799813 386593191 /nfs/dbraw/zinc/59/31/91/386593191.db2.gz DXOBBHAZXAUPOM-YGRLFVJLSA-N 2 0 236.334 2.084 20 0 BEADRP C[C@H]([NH2+]CCC[NH3+])C(C)(C)c1ccccc1 ZINC000415080394 386593722 /nfs/dbraw/zinc/59/37/22/386593722.db2.gz JEOGPDCQRJJAFO-LBPRGKRZSA-N 2 0 220.360 2.291 20 0 BEADRP c1ccc2c(c1)CC[C@H]2C[NH2+]CC1CC[NH2+]CC1 ZINC000415082530 386593967 /nfs/dbraw/zinc/59/39/67/386593967.db2.gz ONDYOSATHRPQCV-HNNXBMFYSA-N 2 0 244.382 2.306 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@@H]1CC[C@@H](C)[C@H](C)C1 ZINC000414802372 386596026 /nfs/dbraw/zinc/59/60/26/386596026.db2.gz VOPJLLUAVNJKEV-FDYHWXHSSA-N 2 0 212.381 2.384 20 0 BEADRP CC(C)([NH3+])C[NH2+]C[C@@H]1CCc2ccccc21 ZINC000415084090 386596238 /nfs/dbraw/zinc/59/62/38/386596238.db2.gz QXQDPPXMWCWXDR-LBPRGKRZSA-N 2 0 218.344 2.043 20 0 BEADRP C[C@@H](CCc1ccsc1)[NH2+][C@H](CN)C1CC1 ZINC000414803034 386596260 /nfs/dbraw/zinc/59/62/60/386596260.db2.gz IYSOZUZHGRPCHC-GXFFZTMASA-N 2 0 238.400 2.396 20 0 BEADRP C[C@H](CCC1CCCC1)[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000415046562 386531154 /nfs/dbraw/zinc/53/11/54/386531154.db2.gz XMLJUQPJDMULCJ-ZZVYKPCYSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H](C1CCC1)[N@@H+]1C[C@@H](C)[C@](C)(C[NH3+])C1 ZINC000415048084 386533630 /nfs/dbraw/zinc/53/36/30/386533630.db2.gz CBRVABWLWPFOKG-NTZNESFSSA-N 2 0 210.365 2.092 20 0 BEADRP CC[C@@H]1C[C@H](C[NH2+][C@@H](CN)C(C)(C)C)CCO1 ZINC000415056044 386537502 /nfs/dbraw/zinc/53/75/02/386537502.db2.gz PDXNFQBDIMHKJM-UPJWGTAASA-N 2 0 242.407 2.155 20 0 BEADRP COc1ccsc1CN[C@H](C[NH3+])C(C)(C)C ZINC000415056047 386537817 /nfs/dbraw/zinc/53/78/17/386537817.db2.gz PDYRHBZIWHITHI-LLVKDONJSA-N 2 0 242.388 2.220 20 0 BEADRP CC1(C)CCC[C@@H]1[C@H]1CC[N@H+](CCN)C1 ZINC000647995411 386539402 /nfs/dbraw/zinc/53/94/02/386539402.db2.gz VVLGEQQQTKVPKV-NWDGAFQWSA-N 2 0 210.365 2.093 20 0 BEADRP [NH3+]CCC[C@@H]([NH2+]CC1CC1)c1ccccc1 ZINC000415058165 386540795 /nfs/dbraw/zinc/54/07/95/386540795.db2.gz SWBUGGSZWVSMJG-CQSZACIVSA-N 2 0 218.344 2.466 20 0 BEADRP C[C@@H]1C[N@@H+]([C@H]2CCC[C@H]2C2CC2)C[C@@]1(C)C[NH3+] ZINC000415060105 386541519 /nfs/dbraw/zinc/54/15/19/386541519.db2.gz TYVVEGCICQJTNV-UQOMUDLDSA-N 2 0 236.403 2.482 20 0 BEADRP C[C@@H](CCC(F)(F)F)[NH2+][C@H]1CCCC[NH2+]C1 ZINC000415070982 386554740 /nfs/dbraw/zinc/55/47/40/386554740.db2.gz JJHGOIBKIDWTPA-UWVGGRQHSA-N 2 0 238.297 2.449 20 0 BEADRP Cc1cc(C[NH2+][C@@H]2CCC[C@@H]2C[NH3+])ccc1F ZINC000414794277 386556821 /nfs/dbraw/zinc/55/68/21/386556821.db2.gz LQNQHSNKWTVVHE-TZMCWYRMSA-N 2 0 236.334 2.351 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+][C@H](C)Cc1ccccc1F ZINC000414794393 386562121 /nfs/dbraw/zinc/56/21/21/386562121.db2.gz LZRNTEZWSYELGY-RISCZKNCSA-N 2 0 238.350 2.330 20 0 BEADRP C[C@H](CC1CC1)[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000414919807 386562783 /nfs/dbraw/zinc/56/27/83/386562783.db2.gz XUAAOESODCJXIV-DGCLKSJQSA-N 2 0 210.365 2.154 20 0 BEADRP CC(C)([NH3+])C[NH2+]CCc1ccc(F)cc1Cl ZINC000415075883 386572678 /nfs/dbraw/zinc/57/26/78/386572678.db2.gz AOSOMIUSDQGLNW-UHFFFAOYSA-N 2 0 244.741 2.349 20 0 BEADRP COCc1ccc(C[NH2+][C@@H]2CCC[C@@H]2C[NH3+])cc1 ZINC000414795562 386572886 /nfs/dbraw/zinc/57/28/86/386572886.db2.gz MYOITAUEVJOTMQ-HUUCEWRRSA-N 2 0 248.370 2.050 20 0 BEADRP C[C@H]([NH3+])c1ccc(C[NH2+]CC2CC2)cc1 ZINC000414808159 386621325 /nfs/dbraw/zinc/62/13/25/386621325.db2.gz KLARGXLZUSSGJD-JTQLQIEISA-N 2 0 204.317 2.206 20 0 BEADRP C[C@@H]1C[C@@H](C[NH2+][C@H]2CCC[C@@H]3C[C@@H]32)CC[NH2+]1 ZINC000415104423 386623667 /nfs/dbraw/zinc/62/36/67/386623667.db2.gz DYSUCLXRVQNRSW-BJJPWKGXSA-N 2 0 222.376 2.153 20 0 BEADRP Cc1cccc(CC[NH2+]C[C@@]2(C)CC[NH2+]C2)c1 ZINC000415103689 386624499 /nfs/dbraw/zinc/62/44/99/386624499.db2.gz KRNLBABHNJYFDB-OAHLLOKOSA-N 2 0 232.371 2.127 20 0 BEADRP C[C@@H]([NH2+]C1CCC([NH3+])CC1)C1CCSCC1 ZINC000335499413 386626349 /nfs/dbraw/zinc/62/63/49/386626349.db2.gz DOAAROJRPLNHSP-QFWMXSHPSA-N 2 0 242.432 2.378 20 0 BEADRP C[C@@H]1CC(C)(C)C[N@@H+]1C[C@H]1CC[NH2+][C@H](C)C1 ZINC000415127049 386627875 /nfs/dbraw/zinc/62/78/75/386627875.db2.gz RKFOPLUKZOQFBL-UPJWGTAASA-N 2 0 224.392 2.495 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+]C1CCC([NH3+])CC1 ZINC000335499831 386628702 /nfs/dbraw/zinc/62/87/02/386628702.db2.gz KRTQYKOIVQPXJP-HIFPTAJRSA-N 2 0 233.359 2.311 20 0 BEADRP C[C@H](CCCc1cccnc1)[NH2+]C1CC[NH2+]CC1 ZINC000415105945 386628652 /nfs/dbraw/zinc/62/86/52/386628652.db2.gz GWYAUOSAPTUNJC-CYBMUJFWSA-N 2 0 247.386 2.134 20 0 BEADRP C[C@H]1CC(C)(C)C[C@H]1[NH2+]CC1=CC[NH2+]CC1 ZINC000335502114 386630743 /nfs/dbraw/zinc/63/07/43/386630743.db2.gz VUSNKGMPXMVXQC-WCQYABFASA-N 2 0 222.376 2.320 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CC[NH2+][C@H](C)C1)c1cccc(O)c1 ZINC000415120492 386631983 /nfs/dbraw/zinc/63/19/83/386631983.db2.gz YGYLBVNMOIPSAQ-UPJWGTAASA-N 2 0 248.370 2.431 20 0 BEADRP CO[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1)CC(C)C ZINC000417379454 386656023 /nfs/dbraw/zinc/65/60/23/386656023.db2.gz UOIPWPRXNZVQHU-MCIONIFRSA-N 2 0 242.407 2.120 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]C[C@@H]1CC12CC2 ZINC000417371117 386644460 /nfs/dbraw/zinc/64/44/60/386644460.db2.gz VAUYLEDYZJIRPF-NDBYEHHHSA-N 2 0 222.376 2.105 20 0 BEADRP CC(C)C[C@H](C)C[N@H+]1C[C@H]2C[NH+](C)C[C@H]2C1 ZINC000337200793 386647857 /nfs/dbraw/zinc/64/78/57/386647857.db2.gz FHROTHHTNXIBRX-MELADBBJSA-N 2 0 224.392 2.162 20 0 BEADRP Cc1ccc(C)c(C[N@@H+]2CCC[C@H](C[NH3+])C2)c1 ZINC000049256941 386603998 /nfs/dbraw/zinc/60/39/98/386603998.db2.gz BWYHOZAOONDVNR-CQSZACIVSA-N 2 0 232.371 2.474 20 0 BEADRP Cc1ccccc1C[NH2+]C[C@@H]1CC[NH2+][C@@H](C)C1 ZINC000415092653 386609579 /nfs/dbraw/zinc/60/95/79/386609579.db2.gz UBSUUXITIAXNLK-UONOGXRCSA-N 2 0 232.371 2.473 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@H]1CCC[C@H](F)C1 ZINC000520231103 386609733 /nfs/dbraw/zinc/60/97/33/386609733.db2.gz ADVSZCFDVAKCTP-WOPDTQHZSA-N 2 0 216.344 2.374 20 0 BEADRP CC[C@H](COC)[NH2+]Cc1ccc([C@@H](C)[NH3+])cc1 ZINC000414805269 386611440 /nfs/dbraw/zinc/61/14/40/386611440.db2.gz AJTSWJSDAQYHKH-BXUZGUMPSA-N 2 0 236.359 2.221 20 0 BEADRP CC(C)([NH3+])C[NH2+]CCc1cc2ccccc2o1 ZINC000415093493 386613387 /nfs/dbraw/zinc/61/33/87/386613387.db2.gz VJQLBJZLEGJMEP-UHFFFAOYSA-N 2 0 232.327 2.302 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCCC[NH2+]C1)C1CCSCC1 ZINC000335493674 386613647 /nfs/dbraw/zinc/61/36/47/386613647.db2.gz CCVAPOQULHFZFQ-YPMHNXCESA-N 2 0 242.432 2.250 20 0 BEADRP Cc1ccc(C[NH2+]CC2CC[NH2+]CC2)cc1F ZINC000415096315 386614791 /nfs/dbraw/zinc/61/47/91/386614791.db2.gz BBDWFJLKLZRTQM-UHFFFAOYSA-N 2 0 236.334 2.223 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]CCC1CC(F)(F)C1 ZINC000453432677 386615822 /nfs/dbraw/zinc/61/58/22/386615822.db2.gz SBRCTWXFJFAMAX-PWSUYJOCSA-N 2 0 246.345 2.352 20 0 BEADRP CC(C)C[C@H]([NH3+])CNCc1ccc([C@H](C)[NH3+])cc1 ZINC000414819866 386660172 /nfs/dbraw/zinc/66/01/72/386660172.db2.gz ZVNZSQLAJLKVFP-WFASDCNBSA-N 2 0 249.402 2.169 20 0 BEADRP C[C@@H](CCC(F)(F)F)[NH2+]C[C@@H]1CCC[NH2+]1 ZINC000414820344 386664231 /nfs/dbraw/zinc/66/42/31/386664231.db2.gz AMUJHORBCOENIZ-IUCAKERBSA-N 2 0 224.270 2.059 20 0 BEADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H]2CCCOCC2)cc1 ZINC000414818949 386666919 /nfs/dbraw/zinc/66/69/19/386666919.db2.gz XGLSEKQTKGNRDO-SWLSCSKDSA-N 2 0 248.370 2.365 20 0 BEADRP c1ccc(OCCCC[NH2+]C[C@H]2CCC[NH2+]2)cc1 ZINC000414821940 386671189 /nfs/dbraw/zinc/67/11/89/386671189.db2.gz CZGYJPLTBGJGPZ-CQSZACIVSA-N 2 0 248.370 2.187 20 0 BEADRP C[C@H]([NH3+])CC[NH2+]C/C=C\c1ccc(F)cc1F ZINC000414821808 386678635 /nfs/dbraw/zinc/67/86/35/386678635.db2.gz LXEKUEQZABOICQ-ZMWSMAPVSA-N 2 0 240.297 2.305 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H](C)CCc1ccsc1 ZINC000414823926 386680663 /nfs/dbraw/zinc/68/06/63/386680663.db2.gz PRMDSLAEUYYYDI-QWRGUYRKSA-N 2 0 226.389 2.396 20 0 BEADRP C[C@@H]([NH2+]CCC(C)(C)C)[C@@H]1CCC[NH2+]C1 ZINC000414824030 386680952 /nfs/dbraw/zinc/68/09/52/386680952.db2.gz PWWKNZCHHMMNDI-VXGBXAGGSA-N 2 0 212.381 2.400 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]C/C=C\c1ccc(F)cc1 ZINC000414830689 386710043 /nfs/dbraw/zinc/71/00/43/386710043.db2.gz CGQLAUARAJEWEB-VSQXVHSFSA-N 2 0 236.334 2.284 20 0 BEADRP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)C1CCC1 ZINC000414831216 386710076 /nfs/dbraw/zinc/71/00/76/386710076.db2.gz PRVAOHQFXRXKGA-MDFVCYEDSA-N 2 0 208.349 2.048 20 0 BEADRP C[C@H](C[NH2+]C[C@@H]1CCC[NH2+]C1)Cc1ccccc1 ZINC000414831007 386711114 /nfs/dbraw/zinc/71/11/14/386711114.db2.gz PBRBLCAFMCIHOU-GOEBONIOSA-N 2 0 246.398 2.454 20 0 BEADRP C[C@H]([NH2+]CCCC[NH+](C)C)[C@@H]1CC1(C)C ZINC000336759775 386683941 /nfs/dbraw/zinc/68/39/41/386683941.db2.gz LQNICMAYYSIMDH-RYUDHWBXSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H]([NH2+]CCCC[NH+](C)C)[C@H]1CC1(C)C ZINC000336759776 386685901 /nfs/dbraw/zinc/68/59/01/386685901.db2.gz LQNICMAYYSIMDH-VXGBXAGGSA-N 2 0 212.381 2.352 20 0 BEADRP CC1(C)CC[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000414825655 386690720 /nfs/dbraw/zinc/69/07/20/386690720.db2.gz HKCZJSXGXLCLLI-DAAZQVBGSA-N 2 0 222.376 2.438 20 0 BEADRP C[C@@H](C1CCC1)[N@H+](C)CCn1ccnc1 ZINC000357045332 386699848 /nfs/dbraw/zinc/69/98/48/386699848.db2.gz WOJVYZCDBXXVNP-NSHDSACASA-N 2 0 207.321 2.004 20 0 BEADRP C(C[C@H]1CC[NH2+]C1)[NH2+][C@H]1CCC[C@H]1C1CC1 ZINC000414833754 386712228 /nfs/dbraw/zinc/71/22/28/386712228.db2.gz QAXOQTVIMOEPTI-XBFCOCLRSA-N 2 0 222.376 2.154 20 0 BEADRP CC(C)C1CC([NH2+][C@@H]2CC[NH2+][C@@H](C)C2)C1 ZINC000335537779 386740830 /nfs/dbraw/zinc/74/08/30/386740830.db2.gz FGWZNHNNXHASTD-GMKTYKIGSA-N 2 0 210.365 2.151 20 0 BEADRP CCCC[C@H](COC)[NH2+]CC1([NH3+])CCCCC1 ZINC000414837366 386735725 /nfs/dbraw/zinc/73/57/25/386735725.db2.gz GZQKIVACESVUCP-CYBMUJFWSA-N 2 0 242.407 2.443 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]C/C=C/c1ccccc1OC ZINC000414833100 386713604 /nfs/dbraw/zinc/71/36/04/386713604.db2.gz GDEWUTMFHNMDDA-CFNZNRNTSA-N 2 0 248.370 2.154 20 0 BEADRP [NH3+]C[C@H]1CC[C@H]([NH2+]C2CCC3(CC3)CC2)C1 ZINC000335486509 386716380 /nfs/dbraw/zinc/71/63/80/386716380.db2.gz HEOQTAGNJPAKMO-AAEUAGOBSA-N 2 0 222.376 2.426 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000414833896 386717594 /nfs/dbraw/zinc/71/75/94/386717594.db2.gz RUFXIJYFRLKPCC-VKYHIEHISA-N 2 0 208.349 2.048 20 0 BEADRP C[C@@H]1CCCC[C@H]1C[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000414832762 386720851 /nfs/dbraw/zinc/72/08/51/386720851.db2.gz OTIJDGQGIBDUSX-RDBSUJKOSA-N 2 0 224.392 2.402 20 0 BEADRP C[C@@H]1CCCC[C@H]1C[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000414832760 386721352 /nfs/dbraw/zinc/72/13/52/386721352.db2.gz OTIJDGQGIBDUSX-MCIONIFRSA-N 2 0 224.392 2.402 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CCCC[C@@H]1C1CC1 ZINC000414834868 386724137 /nfs/dbraw/zinc/72/41/37/386724137.db2.gz HZKGPGVNBXCIHG-IACUBPJLSA-N 2 0 224.392 2.400 20 0 BEADRP Cc1cc(C[N@@H+]2CCC[C@@H](C[NH3+])C2)ccc1F ZINC000050559346 386727424 /nfs/dbraw/zinc/72/74/24/386727424.db2.gz HTESUXGYBPBIAS-ZDUSSCGKSA-N 2 0 236.334 2.305 20 0 BEADRP C(=C\c1ccccc1)\C[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000414836255 386729873 /nfs/dbraw/zinc/72/98/73/386729873.db2.gz URFSZMHTHFXMGO-UFRMUOTOSA-N 2 0 230.355 2.289 20 0 BEADRP CCSCC[C@@H](C)[N@H+](C)C[C@@]1(C)CC[NH2+]C1 ZINC000340712618 386760872 /nfs/dbraw/zinc/76/08/72/386760872.db2.gz PNEKRJAQTYOIDQ-OLZOCXBDSA-N 2 0 244.448 2.450 20 0 BEADRP CCSCC[C@H](C)[N@H+](C)C[C@@]1(C)CC[NH2+]C1 ZINC000340712626 386761182 /nfs/dbraw/zinc/76/11/82/386761182.db2.gz PNEKRJAQTYOIDQ-STQMWFEESA-N 2 0 244.448 2.450 20 0 BEADRP [NH3+]C[C@H]1CCCN1Cc1ccc2ccccc2n1 ZINC000020247166 386789548 /nfs/dbraw/zinc/78/95/48/386789548.db2.gz ROKFNJVWCBKKEO-CQSZACIVSA-N 2 0 241.338 2.158 20 0 BEADRP C[C@@H](NCC[C@@H]1CCCC[N@@H+]1C)c1ccon1 ZINC000349204811 386789653 /nfs/dbraw/zinc/78/96/53/386789653.db2.gz VIRKRWRILIKOPB-NEPJUHHUSA-N 2 0 237.347 2.200 20 0 BEADRP C[C@H](NCC[C@@H]1CCCC[N@@H+]1C)c1ccon1 ZINC000349204816 386791557 /nfs/dbraw/zinc/79/15/57/386791557.db2.gz VIRKRWRILIKOPB-RYUDHWBXSA-N 2 0 237.347 2.200 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]Cc1ccc(C)cc1C ZINC000414844006 386770304 /nfs/dbraw/zinc/77/03/04/386770304.db2.gz QVJSPZJGCOBICA-LBPRGKRZSA-N 2 0 220.360 2.249 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CC[C@H](C)C[C@H]1C ZINC000414844873 386771418 /nfs/dbraw/zinc/77/14/18/386771418.db2.gz RQNBWCGJMHTKAA-WUHRBBMRSA-N 2 0 212.381 2.256 20 0 BEADRP COc1cc(C[NH2+][C@@H]2CC[NH2+]C[C@@H]2C)ccc1C ZINC000414933235 386787009 /nfs/dbraw/zinc/78/70/09/386787009.db2.gz DJXUDISQLUHSTQ-GXTWGEPZSA-N 2 0 248.370 2.091 20 0 BEADRP C[C@H]([NH2+]CC1(C2CC2)CC1)[C@H]1CCCC[NH2+]1 ZINC000395242253 386789394 /nfs/dbraw/zinc/78/93/94/386789394.db2.gz YZHOSIWCXBQMMU-WCQYABFASA-N 2 0 222.376 2.297 20 0 BEADRP CC[C@H]([NH3+])C[NH2+]CCSCc1ccccc1 ZINC000336670473 386803146 /nfs/dbraw/zinc/80/31/46/386803146.db2.gz RVKYEXMMSGTGBI-ZDUSSCGKSA-N 2 0 238.400 2.247 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]Cc1cc(C)ccc1C ZINC000414847238 386831835 /nfs/dbraw/zinc/83/18/35/386831835.db2.gz VTJUJPYOVSJCNN-LBPRGKRZSA-N 2 0 220.360 2.249 20 0 BEADRP [NH3+][C@H]1CCN([C@@H]2CCCc3ccc(F)cc32)C1 ZINC000334783771 386843256 /nfs/dbraw/zinc/84/32/56/386843256.db2.gz BTNOPDFOIVJMJX-GXTWGEPZSA-N 2 0 234.318 2.236 20 0 BEADRP CC[C@H](COC)[NH2+]CC(C)(C)C[NH+]1CCCC1 ZINC000357847310 386852562 /nfs/dbraw/zinc/85/25/62/386852562.db2.gz IXTDXMQPJOOPBE-CYBMUJFWSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@H]1C[C@H](C[N@@H+]2CCCC3(CC3)C2)CC[NH2+]1 ZINC000334833061 386870335 /nfs/dbraw/zinc/87/03/35/386870335.db2.gz MLXQMHFWYILIHR-QWHCGFSZSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+]Cc1cc(Cl)cs1 ZINC000334839792 386884354 /nfs/dbraw/zinc/88/43/54/386884354.db2.gz BCIYHYLTXHFBCE-KCJUWKMLSA-N 2 0 244.791 2.489 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CC[NH2+][C@H](C)C2)cc1 ZINC000334864395 386920044 /nfs/dbraw/zinc/92/00/44/386920044.db2.gz PHOJWWZRJUXBTK-OCCSQVGLSA-N 2 0 218.344 2.225 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CCC[NH2+]CC2)cc1F ZINC000334848336 386896667 /nfs/dbraw/zinc/89/66/67/386896667.db2.gz RJECYAYHRPEVCM-CYBMUJFWSA-N 2 0 236.334 2.366 20 0 BEADRP Cc1cccc(C[NH2+][C@H]2CC[NH2+][C@@H](C)C2)c1 ZINC000334865145 386922326 /nfs/dbraw/zinc/92/23/26/386922326.db2.gz QZDOZDWIFPADBG-JSGCOSHPSA-N 2 0 218.344 2.225 20 0 BEADRP Cc1ccsc1C[NH2+][C@@H]1CC[NH2+][C@@H](C)C1 ZINC000334866212 386924521 /nfs/dbraw/zinc/92/45/21/386924521.db2.gz ULEOFMHTIFKVHX-WDEREUQCSA-N 2 0 224.373 2.287 20 0 BEADRP CC1CCC([NH2+][C@H]2CC[NH2+][C@@H](C)C2)CC1 ZINC000334867464 386926480 /nfs/dbraw/zinc/92/64/80/386926480.db2.gz GAZAVGXSJNBHAV-MVKMKZAISA-N 2 0 210.365 2.295 20 0 BEADRP c1ccc(C[N@@H+]2CCCC[C@@H]2[C@@H]2CC[NH2+]C2)nc1 ZINC000334869663 386927677 /nfs/dbraw/zinc/92/76/77/386927677.db2.gz RMLOORFZAOORPT-UKRRQHHQSA-N 2 0 245.370 2.046 20 0 BEADRP c1csc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)c1 ZINC000334879250 386940163 /nfs/dbraw/zinc/94/01/63/386940163.db2.gz ATHCOKADPORNII-ZACCUICWSA-N 2 0 222.357 2.121 20 0 BEADRP C[NH+](C)CC1CC[NH+](CCCCCF)CC1 ZINC000341846274 386979189 /nfs/dbraw/zinc/97/91/89/386979189.db2.gz GPVUNRYEWZEICW-UHFFFAOYSA-N 2 0 230.371 2.400 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@@H]1CC[C@H]1C1CCC1 ZINC000336745332 386985590 /nfs/dbraw/zinc/98/55/90/386985590.db2.gz QRHUDXNKTKWCRD-KWCYVHTRSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H]([NH3+])C1CC[NH+](Cc2ccc(F)cc2)CC1 ZINC000104436277 387004317 /nfs/dbraw/zinc/00/43/17/387004317.db2.gz ULIMPFUMTNWNOY-NSHDSACASA-N 2 0 236.334 2.385 20 0 BEADRP C[NH+](C)CCC[NH2+][C@@H]1CC[C@H]1C1CCC1 ZINC000336764770 387055639 /nfs/dbraw/zinc/05/56/39/387055639.db2.gz QIUZMAJKHBLCCC-QWHCGFSZSA-N 2 0 210.365 2.106 20 0 BEADRP Cc1ccc(C[N@H+]2C[C@H](C[NH3+])C[C@H]2C)cc1F ZINC000228067038 387063132 /nfs/dbraw/zinc/06/31/32/387063132.db2.gz AANOTBDSQYHWSN-YPMHNXCESA-N 2 0 236.334 2.303 20 0 BEADRP C(C1CCC1)[N@@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1 ZINC000334978860 387064710 /nfs/dbraw/zinc/06/47/10/387064710.db2.gz CAGYSGDXKAZMOX-KGLIPLIRSA-N 2 0 222.376 2.108 20 0 BEADRP C(C1CCC1)[N@@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1 ZINC000334978859 387065264 /nfs/dbraw/zinc/06/52/64/387065264.db2.gz CAGYSGDXKAZMOX-KBPBESRZSA-N 2 0 222.376 2.108 20 0 BEADRP CC(C)[C@](C)([NH2+]CC[C@@H]1CCC[N@@H+]1C)C(N)=O ZINC000331344256 387016396 /nfs/dbraw/zinc/01/63/96/387016396.db2.gz LECTZHWCMOOBFF-AAEUAGOBSA-N 2 0 241.379 2.010 20 0 BEADRP CC[NH+](CC)CCSC[C@H](C)[NH+](C)C ZINC000358858652 387026255 /nfs/dbraw/zinc/02/62/55/387026255.db2.gz HUBQHWVMNYFIRZ-NSHDSACASA-N 2 0 218.410 2.012 20 0 BEADRP CCOC(C)(C)C[NH2+][C@H]1CC[N@H+](CC)C[C@H]1C ZINC000188692728 387069250 /nfs/dbraw/zinc/06/92/50/387069250.db2.gz WUJZZZZPBOTJEM-OLZOCXBDSA-N 2 0 242.407 2.121 20 0 BEADRP CCOc1ccc(C[N@@H+]2CC[C@H]([C@@H](C)[NH3+])C2)cc1 ZINC000126903833 387072303 /nfs/dbraw/zinc/07/23/03/387072303.db2.gz BAXMBCKYOZUBNV-OCCSQVGLSA-N 2 0 248.370 2.254 20 0 BEADRP C[C@H]([NH3+])[C@H]1CC[N@H+](CCCc2ccccc2)C1 ZINC000165980619 387073546 /nfs/dbraw/zinc/07/35/46/387073546.db2.gz XEVXFIWERNPMFQ-ZFWWWQNUSA-N 2 0 232.371 2.288 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H]1CCCNc2ccccc21 ZINC000423299539 387130765 /nfs/dbraw/zinc/13/07/65/387130765.db2.gz BUEHPTDVMVUDME-RISCZKNCSA-N 2 0 233.359 2.118 20 0 BEADRP [NH3+]CC[C@H]1CCC[N@H+](Cc2ccc(F)cc2)C1 ZINC000070975625 387085858 /nfs/dbraw/zinc/08/58/58/387085858.db2.gz UXDGEDUUESMTNK-GFCCVEGCSA-N 2 0 236.334 2.387 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCC[NH2+]C1)c1nccs1 ZINC000070733436 387090632 /nfs/dbraw/zinc/09/06/32/387090632.db2.gz URUNTABGTHJDTF-WDEREUQCSA-N 2 0 239.388 2.183 20 0 BEADRP C[C@H]([NH3+])[C@H]1CC[N@H+](C/C=C/c2ccccc2)C1 ZINC000127228949 387100395 /nfs/dbraw/zinc/10/03/95/387100395.db2.gz HPRVDICNGHPYNR-MNOINKQASA-N 2 0 230.355 2.369 20 0 BEADRP CO[C@H]1CC[C@@H]([NH2+]C2CC[NH+](C(C)C)CC2)C1 ZINC000188799343 387103073 /nfs/dbraw/zinc/10/30/73/387103073.db2.gz XYWUTYSOLVQBGF-KGLIPLIRSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@@H]([NH2+]C1CCC2(CC2)CC1)[C@@H]1CCC[NH2+]1 ZINC000335010071 387104066 /nfs/dbraw/zinc/10/40/66/387104066.db2.gz MSPACGURZKSVRC-YPMHNXCESA-N 2 0 222.376 2.439 20 0 BEADRP C1CC2(CCCC2)[C@@H]1[NH2+][C@H]1CCC[NH2+]CC1 ZINC000335011850 387106039 /nfs/dbraw/zinc/10/60/39/387106039.db2.gz VXMTVMDPVLDCJX-QWHCGFSZSA-N 2 0 222.376 2.441 20 0 BEADRP C[C@@H]([NH2+]CC1C[NH2+]C1)C1CCC(F)(F)CC1 ZINC000423300937 387131675 /nfs/dbraw/zinc/13/16/75/387131675.db2.gz GBQWDDIRHUCHFK-SECBINFHSA-N 2 0 232.318 2.009 20 0 BEADRP CC1=CCC[NH+](CC[C@@H]2CCC[N@H+]2C)C1 ZINC000335025088 387116950 /nfs/dbraw/zinc/11/69/50/387116950.db2.gz GXTCBZABIDJWPE-ZDUSSCGKSA-N 2 0 208.349 2.123 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+]CC12CCC(CC1)C2 ZINC000335024959 387117276 /nfs/dbraw/zinc/11/72/76/387117276.db2.gz RAGZAGWQWXGWKD-CMOBGSAGSA-N 2 0 208.349 2.036 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CC[NH2+]CC[C@H]2C)cc1 ZINC000335026556 387117896 /nfs/dbraw/zinc/11/78/96/387117896.db2.gz QFHAQNXLLQZBGT-HIFRSBDPSA-N 2 0 232.371 2.473 20 0 BEADRP C[C@H]1CC(C)(C)C[C@@H]1[NH2+]CC1([NH3+])CCC1 ZINC000335026111 387119002 /nfs/dbraw/zinc/11/90/02/387119002.db2.gz XBLSMWFWSCGTIS-QWRGUYRKSA-N 2 0 210.365 2.282 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H](C)C[NH3+])c1ccccc1F ZINC000423299013 387130135 /nfs/dbraw/zinc/13/01/35/387130135.db2.gz BGSGCSSTIBNKHJ-GXFFZTMASA-N 2 0 224.323 2.461 20 0 BEADRP C[N@H+](Cc1ccc2c(c1)CCC2)C1CC[NH2+]CC1 ZINC000070499590 387067761 /nfs/dbraw/zinc/06/77/61/387067761.db2.gz PJIGRAZKDIZXHI-UHFFFAOYSA-N 2 0 244.382 2.359 20 0 BEADRP [NH3+][C@@H]1CCC[C@H](C[NH2+]Cc2ccccc2)C1 ZINC000070503231 387068130 /nfs/dbraw/zinc/06/81/30/387068130.db2.gz AJQUQEQNKJSLHS-UONOGXRCSA-N 2 0 218.344 2.294 20 0 BEADRP FC(F)(F)CCN1CCC[C@@]2(CC[NH2+]C2)C1 ZINC000334980885 387068335 /nfs/dbraw/zinc/06/83/35/387068335.db2.gz PYLFMQUETVPAOO-JTQLQIEISA-N 2 0 236.281 2.014 20 0 BEADRP CC[C@@H]([NH2+]CC1C[NH2+]C1)c1cccc(F)c1 ZINC000423308031 387143220 /nfs/dbraw/zinc/14/32/20/387143220.db2.gz XBGZNEZPFUQISF-CYBMUJFWSA-N 2 0 222.307 2.086 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCn2ccnc2C1)C1CCCC1 ZINC000336319201 387143424 /nfs/dbraw/zinc/14/34/24/387143424.db2.gz VBFZIZPCHDOVII-DGCLKSJQSA-N 2 0 233.359 2.366 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCn2ccnc2C1)C1CCCC1 ZINC000336319204 387143722 /nfs/dbraw/zinc/14/37/22/387143722.db2.gz VBFZIZPCHDOVII-YPMHNXCESA-N 2 0 233.359 2.366 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCn2ccnc2C1)C1CCCC1 ZINC000336319202 387143900 /nfs/dbraw/zinc/14/39/00/387143900.db2.gz VBFZIZPCHDOVII-WCQYABFASA-N 2 0 233.359 2.366 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H]1CCCc2ccc(F)cc21 ZINC000423310632 387146733 /nfs/dbraw/zinc/14/67/33/387146733.db2.gz SDIVLVBKKWAWCU-YGRLFVJLSA-N 2 0 236.334 2.388 20 0 BEADRP C[C@@H]1Cc2ccc(F)cc2[C@@H]1[NH2+]CCCC[NH3+] ZINC000423315380 387154205 /nfs/dbraw/zinc/15/42/05/387154205.db2.gz APBWAHXHTNWLGY-QMTHXVAHSA-N 2 0 236.334 2.388 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H](C)[C@@H]1C[C@H]1c1ccccc1 ZINC000423313958 387154983 /nfs/dbraw/zinc/15/49/83/387154983.db2.gz XMGKBPHKAXJDBS-UXOAXIEHSA-N 2 0 232.371 2.363 20 0 BEADRP [NH3+]CCCC[NH2+][C@@H]1CCCNc2ccccc21 ZINC000423317210 387155784 /nfs/dbraw/zinc/15/57/84/387155784.db2.gz CNHHCCGNYOSTEU-CQSZACIVSA-N 2 0 233.359 2.262 20 0 BEADRP C[C@@H]([NH2+]C[C@H]([NH3+])C1CC1)C1C(C)(C)C1(C)C ZINC000423318981 387158915 /nfs/dbraw/zinc/15/89/15/387158915.db2.gz LHIKEVOEBKNMOS-KOLCDFICSA-N 2 0 224.392 2.384 20 0 BEADRP CC[C@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)C1CC1 ZINC000423318162 387159395 /nfs/dbraw/zinc/15/93/95/387159395.db2.gz CFDVBFRFQDUEMN-STQMWFEESA-N 2 0 210.365 2.154 20 0 BEADRP Cc1cc([C@@H](C)[NH2+]CC2(C)CC[NH2+]CC2)no1 ZINC000423319135 387159760 /nfs/dbraw/zinc/15/97/60/387159760.db2.gz CYKFRICNBGVCNW-LLVKDONJSA-N 2 0 237.347 2.023 20 0 BEADRP C[C@@H]1CC(C)(C)C[C@@H]1[NH2+]C[C@@H]([NH3+])C1CC1 ZINC000423317773 387160183 /nfs/dbraw/zinc/16/01/83/387160183.db2.gz KOEBNWOUROYAKO-JLLWLGSASA-N 2 0 210.365 2.138 20 0 BEADRP [NH3+][C@H](C[NH2+][C@H](C1CC1)C1CCCC1)C1CC1 ZINC000423320660 387162115 /nfs/dbraw/zinc/16/21/15/387162115.db2.gz MJOROROILCQEGO-KGLIPLIRSA-N 2 0 222.376 2.282 20 0 BEADRP CCc1ccc([C@H](C)[NH2+]CCCC[NH3+])o1 ZINC000423321775 387164409 /nfs/dbraw/zinc/16/44/09/387164409.db2.gz FYCMPXGBQHAOIN-JTQLQIEISA-N 2 0 210.321 2.232 20 0 BEADRP CC1(C)CCC[C@H]([NH2+]C[C@@H]([NH3+])C2CC2)C1 ZINC000423322656 387165837 /nfs/dbraw/zinc/16/58/37/387165837.db2.gz OBZBUDDLNNZOSK-NWDGAFQWSA-N 2 0 210.365 2.282 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000423324200 387168846 /nfs/dbraw/zinc/16/88/46/387168846.db2.gz AUCHGCAISRRIRV-ZFWWWQNUSA-N 2 0 247.386 2.430 20 0 BEADRP CC[C@@H]([NH2+]C[C@H]([NH3+])C1CC1)c1ccccc1 ZINC000423329456 387172364 /nfs/dbraw/zinc/17/23/64/387172364.db2.gz SVBLGIZMMOAARL-UONOGXRCSA-N 2 0 218.344 2.465 20 0 BEADRP C[C@@H]1CC[C@@H](C)[C@@H]([NH2+]CC2([NH3+])CCC2)C1 ZINC000423331001 387174981 /nfs/dbraw/zinc/17/49/81/387174981.db2.gz OBIJCCNNJMRQFR-UTUOFQBUSA-N 2 0 210.365 2.282 20 0 BEADRP CC[C@H]([NH2+]CC1(C)CC[NH2+]CC1)[C@H]1C[C@H]1C ZINC000423332737 387178074 /nfs/dbraw/zinc/17/80/74/387178074.db2.gz PHJGNZNPXVMKDN-AGIUHOORSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]([NH2+]CC1C[NH2+]C1)[C@H]1CCCC[C@H]1C ZINC000423334547 387181025 /nfs/dbraw/zinc/18/10/25/387181025.db2.gz WREWZSXIFUHTGE-WZRBSPASSA-N 2 0 210.365 2.010 20 0 BEADRP Cc1cncc([C@H](C)[NH2+]C[C@@]2(C)CCC[NH2+]C2)c1 ZINC000423334941 387181871 /nfs/dbraw/zinc/18/18/71/387181871.db2.gz IMBIJDJYDVYNRN-ZFWWWQNUSA-N 2 0 247.386 2.430 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+]CC1=CC[NH2+]CC1 ZINC000423335398 387183071 /nfs/dbraw/zinc/18/30/71/387183071.db2.gz GFICWUMNQJGTKP-SECBINFHSA-N 2 0 236.281 2.227 20 0 BEADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+][C@H]1CCCOC1 ZINC000251208131 387185698 /nfs/dbraw/zinc/18/56/98/387185698.db2.gz LVQWYOFXJINCOT-RDBSUJKOSA-N 2 0 240.391 2.066 20 0 BEADRP C1=C(C[NH2+][C@@H]2CCC[C@@H](C3CC3)C2)CC[NH2+]C1 ZINC000423337197 387186122 /nfs/dbraw/zinc/18/61/22/387186122.db2.gz HLMYUWHYJDRWMB-HUUCEWRRSA-N 2 0 234.387 2.465 20 0 BEADRP CC(C)(C)[C@@H]1CC[C@@H]1[NH2+]C[C@H]([NH3+])C1CC1 ZINC000423339735 387187419 /nfs/dbraw/zinc/18/74/19/387187419.db2.gz ZPLUEVFGGFZITN-WOPDTQHZSA-N 2 0 210.365 2.138 20 0 BEADRP CC[C@H]([NH2+]CC1=CC[NH2+]CC1)C1CCC1 ZINC000423340012 387188222 /nfs/dbraw/zinc/18/82/22/387188222.db2.gz BUARPKMPSWFCNQ-ZDUSSCGKSA-N 2 0 208.349 2.074 20 0 BEADRP COc1cccc2c1CC[C@H]2[NH2+]CCCC[NH3+] ZINC000423340643 387188457 /nfs/dbraw/zinc/18/84/57/387188457.db2.gz STKLNWPANVQUFD-CYBMUJFWSA-N 2 0 234.343 2.011 20 0 BEADRP CCC1(CC)[C@H]([NH2+]CCCC[NH3+])[C@@H](C)[C@@H]1OC ZINC000423341852 387190289 /nfs/dbraw/zinc/19/02/89/387190289.db2.gz YDMHTEILQNLIAE-UPJWGTAASA-N 2 0 242.407 2.155 20 0 BEADRP Cc1ccc([C@@H]([NH2+]CC2C[NH2+]C2)C2CC2)cc1 ZINC000423301913 387135339 /nfs/dbraw/zinc/13/53/39/387135339.db2.gz IQBBUZFBQRIQBT-OAHLLOKOSA-N 2 0 230.355 2.255 20 0 BEADRP C[C@H]([NH2+]CC1C[NH2+]C1)[C@@H](C)C1CCCCC1 ZINC000423303649 387138166 /nfs/dbraw/zinc/13/81/66/387138166.db2.gz MGFDPMHGXMHCSX-NEPJUHHUSA-N 2 0 224.392 2.400 20 0 BEADRP COc1ccc([C@H]([NH2+]CC2C[NH2+]C2)C(C)C)cc1 ZINC000423304869 387139127 /nfs/dbraw/zinc/13/91/27/387139127.db2.gz PKDSKSQRICELLL-OAHLLOKOSA-N 2 0 248.370 2.201 20 0 BEADRP C[C@H]([NH2+]CC1C[NH2+]C1)c1ccc2c(c1)CCCC2 ZINC000423305252 387139286 /nfs/dbraw/zinc/13/92/86/387139286.db2.gz QFOLQPNNZXLDCV-LBPRGKRZSA-N 2 0 244.382 2.435 20 0 BEADRP C[C@H]([NH2+]CC1C[NH2+]C1)C(C)(C)c1ccccc1 ZINC000423305293 387139682 /nfs/dbraw/zinc/13/96/82/387139682.db2.gz QLBWLXYPRUUCQR-LBPRGKRZSA-N 2 0 232.371 2.162 20 0 BEADRP Cc1cc([C@@H](C)[NH2+]CC2C[NH2+]C2)cc(C)c1F ZINC000423304840 387139934 /nfs/dbraw/zinc/13/99/34/387139934.db2.gz PDDKYAAMWWFCOF-LLVKDONJSA-N 2 0 236.334 2.313 20 0 BEADRP CC[C@H]([NH2+]CC1C[NH2+]C1)c1ccc(C)cc1 ZINC000423305866 387141330 /nfs/dbraw/zinc/14/13/30/387141330.db2.gz SBGFMJNQYJMYNT-AWEZNQCLSA-N 2 0 218.344 2.255 20 0 BEADRP CC(C)[C@@H](Cc1ccccc1)[NH2+]C[C@@H]1CC[NH2+]C1 ZINC000423351691 387202325 /nfs/dbraw/zinc/20/23/25/387202325.db2.gz ZKHWXMDLZVOXQV-HZPDHXFCSA-N 2 0 246.398 2.453 20 0 BEADRP CC[C@H]([NH2+]CC[C@H]1CCC[NH2+]1)c1ccncc1 ZINC000423352745 387203082 /nfs/dbraw/zinc/20/30/82/387203082.db2.gz BLFPYSSBQKMMKF-KGLIPLIRSA-N 2 0 233.359 2.264 20 0 BEADRP C[C@@H]([NH2+]CC1=CC[NH2+]CC1)c1ccsc1 ZINC000423350444 387204015 /nfs/dbraw/zinc/20/40/15/387204015.db2.gz ZOJKEFHWWJGFTQ-SNVBAGLBSA-N 2 0 222.357 2.318 20 0 BEADRP CC[C@H]([NH2+]CC[C@H]1CCC[NH2+]1)[C@H]1C[C@H]1C ZINC000423354779 387206293 /nfs/dbraw/zinc/20/62/93/387206293.db2.gz GWYDWZXVTCLDJG-NDBYEHHHSA-N 2 0 210.365 2.153 20 0 BEADRP C1=C(C[NH2+][C@H]2CC[C@@H]2C2CCC2)CC[NH2+]C1 ZINC000423356409 387208676 /nfs/dbraw/zinc/20/86/76/387208676.db2.gz QOQIOLLPBBPMIM-KGLIPLIRSA-N 2 0 220.360 2.074 20 0 BEADRP CCC[C@H]([NH2+]CC1=CC[NH2+]CC1)C1CCC1 ZINC000423361003 387213783 /nfs/dbraw/zinc/21/37/83/387213783.db2.gz WPJUMPOLGZOMEN-AWEZNQCLSA-N 2 0 222.376 2.465 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[NH2+]C[C@H]1C)c1ccncc1 ZINC000423364604 387216651 /nfs/dbraw/zinc/21/66/51/387216651.db2.gz CNTOHMZDXWYFOT-KWCYVHTRSA-N 2 0 233.359 2.120 20 0 BEADRP Cc1nocc1C[N@H+](C)CCCn1ccnc1C ZINC000353511372 387217752 /nfs/dbraw/zinc/21/77/52/387217752.db2.gz BBXKMAQKZPEEQQ-UHFFFAOYSA-N 2 0 248.330 2.010 20 0 BEADRP COc1cccc([C@H](C)[NH2+][C@@H]2CC[NH2+][C@@H](C)C2)c1 ZINC000423372699 387225526 /nfs/dbraw/zinc/22/55/26/387225526.db2.gz IKTDGTPKHASWCF-SGMGOOAPSA-N 2 0 248.370 2.486 20 0 BEADRP C[C@H](Cc1coc2ccccc12)[NH2+]CC1C[NH2+]C1 ZINC000423326110 387228707 /nfs/dbraw/zinc/22/87/07/387228707.db2.gz QMUBSGWRBFIZHP-LLVKDONJSA-N 2 0 244.338 2.173 20 0 BEADRP COc1ccc([C@H](C)[NH2+][C@@H]2CC[NH2+][C@@H](C)C2)cc1 ZINC000423398224 387231974 /nfs/dbraw/zinc/23/19/74/387231974.db2.gz VDBYKDPINWEYRS-SGMGOOAPSA-N 2 0 248.370 2.486 20 0 BEADRP [NH3+]CCCC[NH2+][C@@H]1CCC[C@@H](c2cccnc2)C1 ZINC000423326818 387232994 /nfs/dbraw/zinc/23/29/94/387232994.db2.gz MIIFOYCXELMGIH-UKRRQHHQSA-N 2 0 247.386 2.436 20 0 BEADRP CC(C)[C@H]([NH2+][C@@H]1CC[NH2+]C[C@H]1C)c1cccnc1 ZINC000423399467 387234233 /nfs/dbraw/zinc/23/42/33/387234233.db2.gz PNWHEKSVUGJKKQ-YUELXQCFSA-N 2 0 247.386 2.366 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@@H]1CCC[C@@H]1CCCF ZINC000423403750 387240977 /nfs/dbraw/zinc/24/09/77/387240977.db2.gz ZMDUSNWGNZGMEB-JHJVBQTASA-N 2 0 230.371 2.492 20 0 BEADRP COC[C@H]([NH2+][C@@H]1CCC[C@@H]([NH3+])C1)c1ccccc1 ZINC000423406144 387243831 /nfs/dbraw/zinc/24/38/31/387243831.db2.gz YQFCSKDJCYNZFY-KFWWJZLASA-N 2 0 248.370 2.234 20 0 BEADRP COCC1(C[NH2+][C@H](C)C(C)(C)C)CC[NH2+]CC1 ZINC000423410522 387247144 /nfs/dbraw/zinc/24/71/44/387247144.db2.gz RXLLAXAMKJAIIN-GFCCVEGCSA-N 2 0 242.407 2.027 20 0 BEADRP COCC1(C[NH2+][C@@H](C)C(C)(C)C)CC[NH2+]CC1 ZINC000423410523 387247212 /nfs/dbraw/zinc/24/72/12/387247212.db2.gz RXLLAXAMKJAIIN-LBPRGKRZSA-N 2 0 242.407 2.027 20 0 BEADRP COC[C@@H]([NH2+][C@H](C)CCCC[NH3+])C1CCCC1 ZINC000423425501 387251903 /nfs/dbraw/zinc/25/19/03/387251903.db2.gz GYVIOXURIMNTLY-TZMCWYRMSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@@H]([NH2+]CC1=CC[NH2+]CC1)C1CCCC1 ZINC000423345380 387195232 /nfs/dbraw/zinc/19/52/32/387195232.db2.gz NVLVHYMSGINOHX-LLVKDONJSA-N 2 0 208.349 2.074 20 0 BEADRP C1=C(C[NH2+][C@@H]2CCCC[C@H]2C2CC2)CC[NH2+]C1 ZINC000423349221 387199498 /nfs/dbraw/zinc/19/94/98/387199498.db2.gz WDFLBNAFCQYEFX-LSDHHAIUSA-N 2 0 234.387 2.465 20 0 BEADRP CCc1cccnc1[C@H](C)[NH2+]CC1=CC[NH2+]CC1 ZINC000423348553 387199950 /nfs/dbraw/zinc/19/99/50/387199950.db2.gz UCWHMBOFVLOQMJ-LBPRGKRZSA-N 2 0 245.370 2.214 20 0 BEADRP CCc1cccnc1[C@@H](C)[NH2+]CC1=CC[NH2+]CC1 ZINC000423348552 387200350 /nfs/dbraw/zinc/20/03/50/387200350.db2.gz UCWHMBOFVLOQMJ-GFCCVEGCSA-N 2 0 245.370 2.214 20 0 BEADRP CC[C@H]([NH3+])C[NH2+]C1CCc2ccccc2CC1 ZINC000423465671 387312110 /nfs/dbraw/zinc/31/21/10/387312110.db2.gz MZEMGOXAKJQFST-AWEZNQCLSA-N 2 0 232.371 2.261 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1CCC[C@@H]([NH3+])C1)C1CC1 ZINC000423463993 387312385 /nfs/dbraw/zinc/31/23/85/387312385.db2.gz GHMUMNNDPKIMME-RTXFEEFZSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)[C@@H]([NH2+][C@H](C)CCC[NH3+])c1cccnc1 ZINC000423463805 387312628 /nfs/dbraw/zinc/31/26/28/387312628.db2.gz VJDFGACOVOSOBR-TZMCWYRMSA-N 2 0 235.375 2.496 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@H]1CCC[C@@H](c2cccnc2)C1 ZINC000423464006 387313118 /nfs/dbraw/zinc/31/31/18/387313118.db2.gz LRCIUYGVTUHTID-SNPRPXQTSA-N 2 0 247.386 2.435 20 0 BEADRP CC(C)[C@H]([NH2+][C@H](C)CCC[NH3+])c1cccnc1 ZINC000423463804 387313206 /nfs/dbraw/zinc/31/32/06/387313206.db2.gz VJDFGACOVOSOBR-OCCSQVGLSA-N 2 0 235.375 2.496 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H]1CCCc2ccc(O)cc21 ZINC000423467355 387315357 /nfs/dbraw/zinc/31/53/57/387315357.db2.gz XKYUOYFBTASLFB-IAQYHMDHSA-N 2 0 248.370 2.487 20 0 BEADRP C[C@@H](C[NH3+])N[C@H]1CCc2ccc(Cl)cc21 ZINC000423381366 387262470 /nfs/dbraw/zinc/26/24/70/387262470.db2.gz ZNQZXEBOOWLPFV-UFBFGSQYSA-N 2 0 224.735 2.264 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)c1ccncc1 ZINC000423384120 387268252 /nfs/dbraw/zinc/26/82/52/387268252.db2.gz QACGCKPEFBMGBP-BNOWGMLFSA-N 2 0 233.359 2.263 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[NH2+][C@@H](C)C1)c1ccncc1 ZINC000423384126 387268780 /nfs/dbraw/zinc/26/87/80/387268780.db2.gz QACGCKPEFBMGBP-YUTCNCBUSA-N 2 0 233.359 2.263 20 0 BEADRP C[C@H]1CC(C)(C)C[C@H]1[NH2+][C@H]1CC[NH2+]C[C@H]1C ZINC000423384414 387268819 /nfs/dbraw/zinc/26/88/19/387268819.db2.gz FXGFCNFPEGTXAJ-QNWHQSFQSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCC23CCC3)CC[NH2+]1 ZINC000423388040 387270503 /nfs/dbraw/zinc/27/05/03/387270503.db2.gz SXGHAGWDAKVCBN-JHJVBQTASA-N 2 0 222.376 2.439 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@@H]1CC(C)(C)C[C@H]1C ZINC000423388052 387272339 /nfs/dbraw/zinc/27/23/39/387272339.db2.gz SXNZOYBEXPKXOP-IJLUTSLNSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@@H](C2CC2)C2CCC2)CC[NH2+]1 ZINC000423388156 387273778 /nfs/dbraw/zinc/27/37/78/387273778.db2.gz TZBXPDYGUAJKAP-DDTOSNHZSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@H]2C2CCC2)CC[NH2+]1 ZINC000423388096 387274158 /nfs/dbraw/zinc/27/41/58/387274158.db2.gz SYHSYSLOHDTQTQ-RUZUBIRVSA-N 2 0 222.376 2.295 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@@H]1C[C@@H](C)CC[C@@H]1C ZINC000423391063 387276010 /nfs/dbraw/zinc/27/60/10/387276010.db2.gz PDFVNZQBNQGNOD-WUHRBBMRSA-N 2 0 212.381 2.399 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@@H]1C[C@H](C)CC[C@H]1C ZINC000423391061 387276991 /nfs/dbraw/zinc/27/69/91/387276991.db2.gz PDFVNZQBNQGNOD-FDYHWXHSSA-N 2 0 212.381 2.399 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@H](C)CC(C)(C)C ZINC000423396080 387280722 /nfs/dbraw/zinc/28/07/22/387280722.db2.gz TUHAPJRYEXAPJA-GHMZBOCLSA-N 2 0 200.370 2.399 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2C[C@H]2C2CC[NH2+]CC2)[C@@H]1C ZINC000423430793 387281213 /nfs/dbraw/zinc/28/12/13/387281213.db2.gz IKUPJMIRTWTJGT-IGJDLRFWSA-N 2 0 222.376 2.009 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CCC23CCCC3)CC[NH2+]1 ZINC000423394539 387281567 /nfs/dbraw/zinc/28/15/67/387281567.db2.gz ZWQCCFNKDHPXPJ-UPJWGTAASA-N 2 0 222.376 2.439 20 0 BEADRP C[C@H](C[NH2+][C@H](C)[C@@H]1C[C@H]1C)C[NH+]1CCCC1 ZINC000321594237 387283219 /nfs/dbraw/zinc/28/32/19/387283219.db2.gz PODKFRNQQCYMGN-AAVRWANBSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@H]([NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21)[C@@H](C)C1CCCCC1 ZINC000423436641 387286213 /nfs/dbraw/zinc/28/62/13/387286213.db2.gz PZFMGDBCVDOQDK-VEESAYDSSA-N 2 0 236.403 2.399 20 0 BEADRP CCOC[C@@H]1CCC[C@@H]1[NH2+][C@H](C)CCCC[NH3+] ZINC000423438693 387288628 /nfs/dbraw/zinc/28/86/28/387288628.db2.gz RRZFIWAFSCFZSZ-RDBSUJKOSA-N 2 0 242.407 2.299 20 0 BEADRP CCOC[C@@H]1CCC[C@@H]1[NH2+][C@@H](C)CCCC[NH3+] ZINC000423438690 387288822 /nfs/dbraw/zinc/28/88/22/387288822.db2.gz RRZFIWAFSCFZSZ-IHRRRGAJSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)c1ccncc1 ZINC000423444855 387294909 /nfs/dbraw/zinc/29/49/09/387294909.db2.gz RJHLVUAZDPFWMJ-TUKIKUTGSA-N 2 0 245.370 2.120 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@H]1CCCC12CCC2 ZINC000423446962 387295272 /nfs/dbraw/zinc/29/52/72/387295272.db2.gz CXSUCDKSUQVUBL-RYUDHWBXSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H]1CC[C@H]1C1CCC1 ZINC000423452369 387299921 /nfs/dbraw/zinc/29/99/21/387299921.db2.gz JPJUZKVGJQUNRJ-WXHSDQCUSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]([NH3+])[C@H](C)[NH2+][C@H]1CCCC[C@@H]1C1CC1 ZINC000423452764 387300097 /nfs/dbraw/zinc/30/00/97/387300097.db2.gz WWEGYCFCQMQODP-DJIHRAIXSA-N 2 0 210.365 2.281 20 0 BEADRP CCCCO[C@@H]1C[C@@H]([NH2+]C[C@@H]([NH3+])CC)C1(C)C ZINC000423455424 387304096 /nfs/dbraw/zinc/30/40/96/387304096.db2.gz CKKQXBGAEHWCAE-YNEHKIRRSA-N 2 0 242.407 2.297 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@@H](C1CC1)C1CCCC1 ZINC000423456602 387305036 /nfs/dbraw/zinc/30/50/36/387305036.db2.gz DSIQSEMJRRCKNN-CHWSQXEVSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]([NH3+])[C@H](C)[NH2+][C@H]1CCCC12CCCC2 ZINC000423457489 387306691 /nfs/dbraw/zinc/30/66/91/387306691.db2.gz FXSHSNBPYMNILU-SRVKXCTJSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCCC12CCCC2)[C@H](C)[NH3+] ZINC000423457490 387307207 /nfs/dbraw/zinc/30/72/07/387307207.db2.gz FXSHSNBPYMNILU-TUAOUCFPSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@]12C[C@H]1CCC[C@@H]2[NH2+]CCC1=CC[NH2+]CC1 ZINC000423535559 387360762 /nfs/dbraw/zinc/36/07/62/387360762.db2.gz DGRUACFBZMXFEM-ILXRZTDVSA-N 2 0 234.387 2.465 20 0 BEADRP C[C@H]([NH2+]CCC[C@H]1CCC[NH2+]1)C1(C)CC1 ZINC000423480856 387361835 /nfs/dbraw/zinc/36/18/35/387361835.db2.gz NPYPZDTVJOAXIP-RYUDHWBXSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)C1(C)CC1 ZINC000423538513 387363350 /nfs/dbraw/zinc/36/33/50/387363350.db2.gz GNMMLCMXVCIXHV-QNWHQSFQSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]([NH2+]CCC1=CC[NH2+]CC1)c1cccc(O)c1 ZINC000423536872 387364559 /nfs/dbraw/zinc/36/45/59/387364559.db2.gz ILKAWWNKFJQJFH-GFCCVEGCSA-N 2 0 246.354 2.353 20 0 BEADRP C[C@H]([NH2+]CCC1=CC[NH2+]CC1)c1cncs1 ZINC000423540464 387365649 /nfs/dbraw/zinc/36/56/49/387365649.db2.gz QKHKCFKBAPNFIC-JTQLQIEISA-N 2 0 237.372 2.104 20 0 BEADRP C[C@H]([NH2+]CCC1=CC[NH2+]CC1)C1CCCC1 ZINC000423542328 387367569 /nfs/dbraw/zinc/36/75/69/387367569.db2.gz TVKGBFCCCQDUEG-LBPRGKRZSA-N 2 0 222.376 2.465 20 0 BEADRP CC[C@@H]1C[C@H]([NH2+][C@H](C)[C@@H]2CCCC[NH2+]2)CCO1 ZINC000423545645 387370992 /nfs/dbraw/zinc/37/09/92/387370992.db2.gz JTDVKFWQQZYODZ-SYQHCUMBSA-N 2 0 240.391 2.064 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)[C@H]1C[C@H]1C ZINC000423550498 387372064 /nfs/dbraw/zinc/37/20/64/387372064.db2.gz NXXXLQWKHOHDDO-LEZGYBIHSA-N 2 0 222.376 2.009 20 0 BEADRP C[C@@H]([NH2+]CCC1=CC[NH2+]CC1)c1ccco1 ZINC000423561093 387374867 /nfs/dbraw/zinc/37/48/67/387374867.db2.gz PRDMPQVUMJQTQA-LLVKDONJSA-N 2 0 220.316 2.240 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000423555058 387376243 /nfs/dbraw/zinc/37/62/43/387376243.db2.gz XRJOYBLCGVIYSY-KSTCHIGDSA-N 2 0 222.376 2.153 20 0 BEADRP C1CC([C@@H]2CC[C@H]2[NH2+][C@H]2CCCC[NH2+]C2)C1 ZINC000423568605 387380103 /nfs/dbraw/zinc/38/01/03/387380103.db2.gz VQVXIVYWPIMVQO-MELADBBJSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]1CCCC[C@H]1[NH2+][C@@H]1CCCC[NH2+]C1 ZINC000423569256 387381461 /nfs/dbraw/zinc/38/14/61/387381461.db2.gz VZEMLTIMEVHOFB-JHJVBQTASA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[C@@H]([NH3+])C1)c1cccnc1 ZINC000423474923 387321801 /nfs/dbraw/zinc/32/18/01/387321801.db2.gz PHPMCQNYVSFTOW-OUCADQQQSA-N 2 0 233.359 2.250 20 0 BEADRP C[C@@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1ccncc1 ZINC000423477759 387324598 /nfs/dbraw/zinc/32/45/98/387324598.db2.gz KITUDVZOMFYHEP-OCCSQVGLSA-N 2 0 233.359 2.264 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@@H]1c2ccccc2C[C@H]1C ZINC000423478380 387325124 /nfs/dbraw/zinc/32/51/24/387325124.db2.gz UNLUCFRVKDJROG-OSMZGAPFSA-N 2 0 218.344 2.247 20 0 BEADRP CCC1CC([NH2+]C[C@H]2CCC[C@H]([NH3+])C2)C1 ZINC000423481956 387326699 /nfs/dbraw/zinc/32/66/99/387326699.db2.gz XDOFUQMQGJTULY-ZFQMDJOTSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)CC[C@@H]([NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21)C1CC1 ZINC000423430496 387326817 /nfs/dbraw/zinc/32/68/17/387326817.db2.gz MTFWQQWIDMNJEE-RQJABVFESA-N 2 0 222.376 2.009 20 0 BEADRP CC[NH+](CC)CCC[N@@H+]1CCC[C@@H](OC)CC1 ZINC000372796285 387328940 /nfs/dbraw/zinc/32/89/40/387328940.db2.gz BSYAWGPEPPWVFK-CQSZACIVSA-N 2 0 242.407 2.219 20 0 BEADRP C[C@H]([NH3+])[C@H](C)[NH2+][C@@H]1CCC[C@@H](c2cccnc2)C1 ZINC000423482981 387329222 /nfs/dbraw/zinc/32/92/22/387329222.db2.gz XQHVKEZHOUXRLD-RMRHIDDWSA-N 2 0 247.386 2.433 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@H]1CCCC12CCCC2 ZINC000423486011 387330621 /nfs/dbraw/zinc/33/06/21/387330621.db2.gz ZJMZUIVMBBGNRF-RYUDHWBXSA-N 2 0 210.365 2.426 20 0 BEADRP CCO[C@@H]1C[C@H]([NH2+]C[C@@H]([NH3+])CC)C12CCCC2 ZINC000423485995 387330956 /nfs/dbraw/zinc/33/09/56/387330956.db2.gz ZIJBLYSXNPDVBZ-RWMBFGLXSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000423487342 387332984 /nfs/dbraw/zinc/33/29/84/387332984.db2.gz UDKGYHYYLYAPSR-OCCSQVGLSA-N 2 0 236.359 2.332 20 0 BEADRP C(C[NH2+][C@@H]1CCC12CCC2)C[C@@H]1CCC[NH2+]1 ZINC000423487223 387333467 /nfs/dbraw/zinc/33/34/67/387333467.db2.gz TYJQAOGPUSEAFD-QWHCGFSZSA-N 2 0 222.376 2.441 20 0 BEADRP Cc1cc(N)cc(C[NH2+][C@@H]2CCCC[C@H]2C[NH3+])c1 ZINC000423486341 387334411 /nfs/dbraw/zinc/33/44/11/387334411.db2.gz WJCILUSUNVTIKH-DZGCQCFKSA-N 2 0 247.386 2.184 20 0 BEADRP CC[C@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)C1CC1 ZINC000423490977 387336002 /nfs/dbraw/zinc/33/60/02/387336002.db2.gz YGMXGFRLRZLRBL-STQMWFEESA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@@H]([NH2+]CCC[C@H]1CCC[NH2+]1)C1CC1 ZINC000423490974 387336404 /nfs/dbraw/zinc/33/64/04/387336404.db2.gz YGMXGFRLRZLRBL-CHWSQXEVSA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[C@H](C[NH3+])C1)[C@H]1C[C@H]1C ZINC000423493394 387336941 /nfs/dbraw/zinc/33/69/41/387336941.db2.gz BPOHDTJLDFAVBF-FHUSYTEZSA-N 2 0 210.365 2.138 20 0 BEADRP CCCC[C@H](C)[C@@H](C)[NH2+]C[C@@H]1C[NH2+]CCCO1 ZINC000423492166 387337074 /nfs/dbraw/zinc/33/70/74/387337074.db2.gz LYRVASGHYNKSJU-MJBXVCDLSA-N 2 0 242.407 2.169 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@H]2CCN(C)[C@H](C)C2)C[C@H](C)O1 ZINC000515125241 387337399 /nfs/dbraw/zinc/33/73/99/387337399.db2.gz KCGJRBXBXVGYOR-PEBLQZBPSA-N 2 0 240.391 2.015 20 0 BEADRP CCC[C@@H]([NH2+]C[C@@H]1C[NH2+]CCCO1)C(C)(C)C ZINC000423495707 387337923 /nfs/dbraw/zinc/33/79/23/387337923.db2.gz UZZAQJOSCSPFDD-QWHCGFSZSA-N 2 0 242.407 2.169 20 0 BEADRP CC[C@@H](C)C[N@@H+]1CCC[C@H]([NH+](C)C)CC1 ZINC000372992403 387338230 /nfs/dbraw/zinc/33/82/30/387338230.db2.gz WYOSFVZSHGKXMG-OLZOCXBDSA-N 2 0 212.381 2.449 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[C@H](C[NH3+])C1)C1CCC1 ZINC000423499185 387340269 /nfs/dbraw/zinc/34/02/69/387340269.db2.gz HNVYOVCXHUDRMY-UHTWSYAYSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])C1)C1CCSCC1 ZINC000423501292 387340763 /nfs/dbraw/zinc/34/07/63/387340763.db2.gz JHVWNAKZXBHWEK-GVXVVHGQSA-N 2 0 242.432 2.235 20 0 BEADRP Cc1ccc(CCC[NH2+][C@@H](C)CC[NH+](C)C)cn1 ZINC000354180919 387342810 /nfs/dbraw/zinc/34/28/10/387342810.db2.gz JZDPZTWNNUBAFL-AWEZNQCLSA-N 2 0 249.402 2.252 20 0 BEADRP CCCN(CC)C[C@@H](C)[NH2+][C@H]1CCOC[C@@H]1C ZINC000515859443 387430373 /nfs/dbraw/zinc/43/03/73/387430373.db2.gz RNBUGZRFWBLHMN-MJBXVCDLSA-N 2 0 242.407 2.121 20 0 BEADRP COCC1(CC[NH2+][C@H]2CCCCC[C@H]2[NH3+])CC1 ZINC000515846275 387435535 /nfs/dbraw/zinc/43/55/35/387435535.db2.gz LOHGELYJKIGCEX-OLZOCXBDSA-N 2 0 240.391 2.053 20 0 BEADRP COCC1(CC[NH2+][C@H]2CCCCC[C@@H]2[NH3+])CC1 ZINC000515846277 387435935 /nfs/dbraw/zinc/43/59/35/387435935.db2.gz LOHGELYJKIGCEX-STQMWFEESA-N 2 0 240.391 2.053 20 0 BEADRP CC[C@@H](Cc1cccs1)[NH2+]C[C@H]1CCC[NH2+]1 ZINC000643505740 387453191 /nfs/dbraw/zinc/45/31/91/387453191.db2.gz ZYBFCWLILAHJQD-NWDGAFQWSA-N 2 0 238.400 2.411 20 0 BEADRP CC[C@@H](Cc1cccs1)[NH2+]C[C@@H]1CCC[NH2+]1 ZINC000643505741 387453680 /nfs/dbraw/zinc/45/36/80/387453680.db2.gz ZYBFCWLILAHJQD-RYUDHWBXSA-N 2 0 238.400 2.411 20 0 BEADRP CSC1(C[NH2+]CCC[NH+]2CCCCC2)CC1 ZINC000304260331 387454700 /nfs/dbraw/zinc/45/47/00/387454700.db2.gz IZKXPRRSHTZOHH-UHFFFAOYSA-N 2 0 242.432 2.348 20 0 BEADRP c1ccc2c(c1)CCC[C@@H]([NH2+]C[C@H]1CCC[NH2+]1)C2 ZINC000643505771 387456024 /nfs/dbraw/zinc/45/60/24/387456024.db2.gz JFOMSRHVJDHADJ-HZPDHXFCSA-N 2 0 244.382 2.276 20 0 BEADRP Cc1ccncc1CN(C)CC[C@@H]1CCC[N@@H+]1C ZINC000361411875 387456994 /nfs/dbraw/zinc/45/69/94/387456994.db2.gz CMSAPRLVSLKYCA-HNNXBMFYSA-N 2 0 247.386 2.306 20 0 BEADRP C[NH+](C)CCC[NH2+]C(C1CCC1)C1CCC1 ZINC000304286210 387459249 /nfs/dbraw/zinc/45/92/49/387459249.db2.gz GFDMZKXYQVYJDW-UHFFFAOYSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)(C[NH2+][C@@H]1CCC[C@@H]1[NH3+])[C@@H]1CCCCO1 ZINC000643466640 387388722 /nfs/dbraw/zinc/38/87/22/387388722.db2.gz JYRJEMKWEAHLRI-XQQFMLRXSA-N 2 0 240.391 2.051 20 0 BEADRP CO[C@H](C)[C@@H](C)[NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1 ZINC000361071064 387395488 /nfs/dbraw/zinc/39/54/88/387395488.db2.gz ZVGFHAZYWLXNTB-MGPQQGTHSA-N 2 0 242.407 2.120 20 0 BEADRP CO[C@H](C)[C@@H](C)[NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1 ZINC000361071063 387396917 /nfs/dbraw/zinc/39/69/17/387396917.db2.gz ZVGFHAZYWLXNTB-MCIONIFRSA-N 2 0 242.407 2.120 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H]2COC(C)(C)C2)CC1 ZINC000396839720 387499428 /nfs/dbraw/zinc/49/94/28/387499428.db2.gz FQEPIRBRPBSYMO-CYBMUJFWSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@@H](CCc1ccco1)[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000643509293 387501488 /nfs/dbraw/zinc/50/14/88/387501488.db2.gz UWCIHJSVMTXPLR-STQMWFEESA-N 2 0 236.359 2.190 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+]CC[C@@H]2CC[NH2+]C2)c(C)n1 ZINC000643509171 387505590 /nfs/dbraw/zinc/50/55/90/387505590.db2.gz CDFXYYURGZQYSC-OCCSQVGLSA-N 2 0 247.386 2.349 20 0 BEADRP C[C@@H](Cc1cccs1)[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000643509246 387505776 /nfs/dbraw/zinc/50/57/76/387505776.db2.gz NSOPNFDGPFUCEV-NWDGAFQWSA-N 2 0 238.400 2.268 20 0 BEADRP CC(C)OC1CCC([NH2+][C@@H](C)C[C@@H](C)[NH3+])CC1 ZINC000643475975 387513558 /nfs/dbraw/zinc/51/35/58/387513558.db2.gz ZFPITISCIWAIKN-KBHBFKLGSA-N 2 0 242.407 2.438 20 0 BEADRP FC1(CN2CCC[C@H]([NH+]3CCCC3)CC2)CC1 ZINC000527220166 387535669 /nfs/dbraw/zinc/53/56/69/387535669.db2.gz FNLHIDCJIQXAKU-ZDUSSCGKSA-N 2 0 240.366 2.439 20 0 BEADRP C[C@H]1CC[N@H+](CC2(F)CC2)C[C@@H]1n1ccnc1 ZINC000527220056 387536156 /nfs/dbraw/zinc/53/61/56/387536156.db2.gz RQXBENSFSZHNFW-RYUDHWBXSA-N 2 0 237.322 2.268 20 0 BEADRP C[N@H+](CC1CC1)C[C@H]1CCN(CC2(F)CC2)C1 ZINC000527219398 387538522 /nfs/dbraw/zinc/53/85/22/387538522.db2.gz WUWBHSYVJPIPOJ-CYBMUJFWSA-N 2 0 240.366 2.152 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]2C[N@H+](CCCCCF)C[C@@H]21 ZINC000304454835 387483061 /nfs/dbraw/zinc/48/30/61/387483061.db2.gz YQCXOTJPHUITKO-RWMBFGLXSA-N 2 0 228.355 2.185 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](CCCCCF)C[C@H]21 ZINC000304454834 387483699 /nfs/dbraw/zinc/48/36/99/387483699.db2.gz YQCXOTJPHUITKO-JHJVBQTASA-N 2 0 228.355 2.185 20 0 BEADRP CC(C)[NH2+]CCC[NH2+][C@@H](C)CC1CCOCC1 ZINC000643508383 387488956 /nfs/dbraw/zinc/48/89/56/387488956.db2.gz XSCPYVWNIALDMN-ZDUSSCGKSA-N 2 0 242.407 2.169 20 0 BEADRP C[C@H](C[NH2+]C[C@H]1CC=CCC1)N(C)C1CC1 ZINC000122195471 387490816 /nfs/dbraw/zinc/49/08/16/387490816.db2.gz QKCLWWLTCVUZEY-OLZOCXBDSA-N 2 0 222.376 2.415 20 0 BEADRP C[NH2+][C@@H]1CCN(Cc2cccc3cccnc32)C1 ZINC000211644004 387588464 /nfs/dbraw/zinc/58/84/64/387588464.db2.gz DHSZFVKSSQZHKE-CQSZACIVSA-N 2 0 241.338 2.029 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@H](C)Cc1cccs1 ZINC000643511616 387593565 /nfs/dbraw/zinc/59/35/65/387593565.db2.gz LEVINDVWEQCGQJ-ZYHUDNBSSA-N 2 0 226.389 2.252 20 0 BEADRP C[C@H]([NH2+]CCCCC(C)(C)C)C1C[NH2+]C1 ZINC000422716713 387628679 /nfs/dbraw/zinc/62/86/79/387628679.db2.gz NQYKWNBEGBZCLV-NSHDSACASA-N 2 0 212.381 2.400 20 0 BEADRP CCC([NH3+])(CC)C[NH2+][C@@H]1CCC[C@H](OC)C1 ZINC000643513772 387598073 /nfs/dbraw/zinc/59/80/73/387598073.db2.gz MSGDSLJOMVDWGB-NEPJUHHUSA-N 2 0 228.380 2.051 20 0 BEADRP C[NH2+]CCC[NH2+]Cc1cccc(C2CC2)c1 ZINC000422551435 387598237 /nfs/dbraw/zinc/59/82/37/387598237.db2.gz DYXAZVFAGPYWNB-UHFFFAOYSA-N 2 0 218.344 2.263 20 0 BEADRP CC[C@H](C[NH2+][C@H](C)C1C[NH2+]C1)c1ccccc1 ZINC000422716450 387628899 /nfs/dbraw/zinc/62/88/99/387628899.db2.gz NEFLZPJNLFSJNR-CHWSQXEVSA-N 2 0 232.371 2.378 20 0 BEADRP COc1cccc([C@H](C)[NH2+][C@H](C)C[C@H](C)[NH3+])c1 ZINC000422714719 387628916 /nfs/dbraw/zinc/62/89/16/387628916.db2.gz RIQDJJREDJPIRV-TUAOUCFPSA-N 2 0 236.359 2.472 20 0 BEADRP C[C@@H]1CCCC[C@@H]1OCC[NH2+][C@@H]1CCC[C@@H]1[NH3+] ZINC000422714011 387628934 /nfs/dbraw/zinc/62/89/34/387628934.db2.gz QGEGGHFBIAPBHZ-RQJABVFESA-N 2 0 240.391 2.051 20 0 BEADRP CC(C)CCC[NH+]1CCC2(CC[NH2+]2)CC1 ZINC000422561052 387602143 /nfs/dbraw/zinc/60/21/43/387602143.db2.gz IRXBTOXIBUCMHM-UHFFFAOYSA-N 2 0 210.365 2.251 20 0 BEADRP COCCCCC[N@@H+]1C[C@H](C[NH3+])[C@H](C)C[C@@H]1C ZINC000422640735 387609883 /nfs/dbraw/zinc/60/98/83/387609883.db2.gz WAARMPRBJJSJSQ-RDBSUJKOSA-N 2 0 242.407 2.108 20 0 BEADRP C[C@@H]1C[C@H](C)[N@H+](Cc2cccc(N)c2)C[C@H]1C[NH3+] ZINC000422641333 387610850 /nfs/dbraw/zinc/61/08/50/387610850.db2.gz XQUJCNFXBUZMJN-MBNYWOFBSA-N 2 0 247.386 2.074 20 0 BEADRP COCCCCC[N@@H+]1C[C@H](C[NH3+])[C@@H](C)C[C@H]1C ZINC000422640734 387611093 /nfs/dbraw/zinc/61/10/93/387611093.db2.gz WAARMPRBJJSJSQ-MJBXVCDLSA-N 2 0 242.407 2.108 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CCc1c(F)cccc1F ZINC000422692603 387613551 /nfs/dbraw/zinc/61/35/51/387613551.db2.gz KLHXHAFAZMADKS-NXEZZACHSA-N 2 0 242.313 2.223 20 0 BEADRP C[C@H]([NH2+]C1[C@H](C)CCC[C@H]1C)C1C[NH2+]C1 ZINC000422703568 387617273 /nfs/dbraw/zinc/61/72/73/387617273.db2.gz NJGFLXOERIIELJ-MXWKQRLJSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CCCC[C@H]1C)C1C[NH2+]C1 ZINC000422707164 387620311 /nfs/dbraw/zinc/62/03/11/387620311.db2.gz VUZMJWPHNPWNBX-IJLUTSLNSA-N 2 0 210.365 2.010 20 0 BEADRP Cc1ccsc1C[NH2+][C@@H](C)C[C@@H](C)[NH3+] ZINC000422709540 387622278 /nfs/dbraw/zinc/62/22/78/387622278.db2.gz ZJARYFMHUIMOPB-ZJUUUORDSA-N 2 0 212.362 2.272 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+]C1[C@H](C)CCC[C@H]1C ZINC000422708773 387623047 /nfs/dbraw/zinc/62/30/47/387623047.db2.gz YEJHWSODOFMDLG-UPJWGTAASA-N 2 0 242.407 2.155 20 0 BEADRP CC[C@H](C)[C@H](O)C[NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000422713321 387624954 /nfs/dbraw/zinc/62/49/54/387624954.db2.gz PMMBLURXPYXBSB-OADPDTJPSA-N 2 0 248.370 2.128 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)nc1 ZINC000399681351 387566245 /nfs/dbraw/zinc/56/62/45/387566245.db2.gz QMRKWKXDZGXPJN-UKRRQHHQSA-N 2 0 247.386 2.005 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CCO[C@@H]1CCCC[C@@H]1C ZINC000422716307 387627691 /nfs/dbraw/zinc/62/76/91/387627691.db2.gz UGFHHGCJQSPTBO-XDQVBPFNSA-N 2 0 242.407 2.297 20 0 BEADRP CSCCC[N@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000375757182 387579605 /nfs/dbraw/zinc/57/96/05/387579605.db2.gz YHXBUFCOQMFEHN-FUNVUKJBSA-N 2 0 242.432 2.297 20 0 BEADRP CC(C)[C@@H]1CCCC[C@@H]1[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000422717673 387630442 /nfs/dbraw/zinc/63/04/42/387630442.db2.gz OVACZOYAWPRRQR-UBHSHLNASA-N 2 0 224.392 2.399 20 0 BEADRP CCc1cccc(OCCN2CCC[C@H]2C[NH3+])c1 ZINC000430595299 387631349 /nfs/dbraw/zinc/63/13/49/387631349.db2.gz XFOZPFHXYRQUBY-AWEZNQCLSA-N 2 0 248.370 2.051 20 0 BEADRP CC(C)[C@@H]1CCCC[C@H]1[NH2+][C@H](C)C1C[NH2+]C1 ZINC000422717672 387631788 /nfs/dbraw/zinc/63/17/88/387631788.db2.gz OVACZOYAWPRRQR-KWCYVHTRSA-N 2 0 224.392 2.399 20 0 BEADRP CC(C)[C@@H]1CCC[C@@H]([NH2+][C@H]2CC[NH2+]C2)C1 ZINC000422719360 387633320 /nfs/dbraw/zinc/63/33/20/387633320.db2.gz QWCMMFGDBNGKSZ-UPJWGTAASA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]Cc1ccc(F)cc1 ZINC000422726839 387635726 /nfs/dbraw/zinc/63/57/26/387635726.db2.gz GBRLFURZZWMGFV-ZJUUUORDSA-N 2 0 210.296 2.041 20 0 BEADRP CC(C)CCC[C@@H](C)[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000422728318 387637566 /nfs/dbraw/zinc/63/75/66/387637566.db2.gz JBKUIRDBPRBAFK-NEPJUHHUSA-N 2 0 212.381 2.399 20 0 BEADRP COc1ccc(C[NH2+][C@H]2CC[NH2+]CC[C@@H]2C)cc1 ZINC000422729056 387638670 /nfs/dbraw/zinc/63/86/70/387638670.db2.gz HINJPWAQFDCZGK-WFASDCNBSA-N 2 0 248.370 2.173 20 0 BEADRP CC(C)CCC[C@H](C)[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000422728320 387639190 /nfs/dbraw/zinc/63/91/90/387639190.db2.gz JBKUIRDBPRBAFK-RYUDHWBXSA-N 2 0 212.381 2.399 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CC(C)C ZINC000422733794 387641374 /nfs/dbraw/zinc/64/13/74/387641374.db2.gz RIFQHCSFHKIJSO-SNVBAGLBSA-N 2 0 221.348 2.155 20 0 BEADRP Cc1ccccc1OCCC[NH2+][C@@H]1CCC[C@H]1[NH3+] ZINC000422740802 387647541 /nfs/dbraw/zinc/64/75/41/387647541.db2.gz NFLFJMHOJBTKEL-ZIAGYGMSSA-N 2 0 248.370 2.233 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)[C@@H]2C[C@H]2C2CC2)C1 ZINC000527639397 387647932 /nfs/dbraw/zinc/64/79/32/387647932.db2.gz CAKNMCPHBNGGHK-JURCDPSOSA-N 2 0 236.403 2.352 20 0 BEADRP C[NH+](C)C[C@H]1CC[N@H+](C[C@H]2CC=CCC2)C1 ZINC000125465169 387656130 /nfs/dbraw/zinc/65/61/30/387656130.db2.gz LLAYEOXJBXUEQP-UONOGXRCSA-N 2 0 222.376 2.226 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCc2ccccc2C1)[C@H]1CCC[NH2+]1 ZINC000422752905 387658067 /nfs/dbraw/zinc/65/80/67/387658067.db2.gz HUVFUDUMNZSXJK-DAXOMENPSA-N 2 0 244.382 2.274 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCc2ccccc2C1)[C@H]1CCC[NH2+]1 ZINC000422752907 387658216 /nfs/dbraw/zinc/65/82/16/387658216.db2.gz HUVFUDUMNZSXJK-UHOFOFEASA-N 2 0 244.382 2.274 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CCc1cccs1 ZINC000422759455 387660795 /nfs/dbraw/zinc/66/07/95/387660795.db2.gz PCBKIXVGQJIRGA-NXEZZACHSA-N 2 0 212.362 2.006 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]CCSc1ccccc1 ZINC000422756388 387661828 /nfs/dbraw/zinc/66/18/28/387661828.db2.gz CICKDKIUDCTSDV-CHWSQXEVSA-N 2 0 236.384 2.248 20 0 BEADRP C[NH2+]CC1CC[NH+](CCc2ccc(C)cc2)CC1 ZINC000430933986 387662910 /nfs/dbraw/zinc/66/29/10/387662910.db2.gz KMVOAHHDFPFGAL-UHFFFAOYSA-N 2 0 246.398 2.469 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]1[NH2+]CC1(c2cccc(F)c2)CC1 ZINC000422765725 387665053 /nfs/dbraw/zinc/66/50/53/387665053.db2.gz LAQWPUKYGSZISK-KBPBESRZSA-N 2 0 248.345 2.327 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CCOC1CCCCCC1 ZINC000422770001 387669822 /nfs/dbraw/zinc/66/98/22/387669822.db2.gz WCQSOUVFDBECCR-CHWSQXEVSA-N 2 0 242.407 2.441 20 0 BEADRP COC[C@@H]([NH2+]CCC[NH+]1CCCCC1)C(C)C ZINC000126036806 387670085 /nfs/dbraw/zinc/67/00/85/387670085.db2.gz KRZWZZSFZCTDAY-CQSZACIVSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)[C@H](C)C[NH2+][C@H]1CC[NH2+]CC[C@@H]1C ZINC000422772766 387670524 /nfs/dbraw/zinc/67/05/24/387670524.db2.gz SVINCNQCXLYDNY-XQQFMLRXSA-N 2 0 212.381 2.256 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CCCN(C)c1ccccc1 ZINC000422771208 387670860 /nfs/dbraw/zinc/67/08/60/387670860.db2.gz XEHNNMNWXLPJCO-ZIAGYGMSSA-N 2 0 249.402 2.228 20 0 BEADRP Cc1ccccc1C[NH2+][C@H](C)C[C@H](C)[NH3+] ZINC000422770623 387671521 /nfs/dbraw/zinc/67/15/21/387671521.db2.gz UYIRLGUQRYHJGZ-NWDGAFQWSA-N 2 0 206.333 2.210 20 0 BEADRP CC[C@@H]([NH2+]C[C@H](C)C(C)C)[C@@H]1CCC[NH2+]1 ZINC000422774634 387672634 /nfs/dbraw/zinc/67/26/34/387672634.db2.gz XURLALZVJHHOEE-XQQFMLRXSA-N 2 0 212.381 2.399 20 0 BEADRP COc1cccc(C[NH2+][C@@H]2CC[NH2+]CC[C@@H]2C)c1 ZINC000422774452 387672856 /nfs/dbraw/zinc/67/28/56/387672856.db2.gz XBHIAIISRPOCHZ-SWLSCSKDSA-N 2 0 248.370 2.173 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]CCCOCC1CC1 ZINC000422780030 387677559 /nfs/dbraw/zinc/67/75/59/387677559.db2.gz GQSIKYSVFIMZNE-KGLIPLIRSA-N 2 0 240.391 2.053 20 0 BEADRP CC(C)(C)c1nc(C[NH2+]CCCC[NH3+])cs1 ZINC000126423326 387682790 /nfs/dbraw/zinc/68/27/90/387682790.db2.gz SABAOOXEDHAKKP-UHFFFAOYSA-N 2 0 241.404 2.269 20 0 BEADRP Cc1cc(C)cc(CC[NH2+][C@H]2CCC[C@@H]2[NH3+])c1 ZINC000422783815 387682770 /nfs/dbraw/zinc/68/27/70/387682770.db2.gz NGVXXFMBIKPJHT-GJZGRUSLSA-N 2 0 232.371 2.315 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)C1C[NH2+]C1)C1CCCCC1 ZINC000422784764 387684059 /nfs/dbraw/zinc/68/40/59/387684059.db2.gz OLYPHYDKKSOLQP-MNOVXSKESA-N 2 0 210.365 2.153 20 0 BEADRP CO[C@@H]1CCCC[C@H]1[NH2+][C@H](C)CCCC[NH3+] ZINC000422783444 387684079 /nfs/dbraw/zinc/68/40/79/387684079.db2.gz HLARJZUWOGBQBA-JHJVBQTASA-N 2 0 228.380 2.051 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]1[NH2+]CCCOC1CCCCC1 ZINC000422783484 387684801 /nfs/dbraw/zinc/68/48/01/387684801.db2.gz LEBQYWRUUCMMTM-KBPBESRZSA-N 2 0 240.391 2.195 20 0 BEADRP CC(C)CC[NH+]1CCC([NH2+]CC2CC2)CC1 ZINC000123366811 387686713 /nfs/dbraw/zinc/68/67/13/387686713.db2.gz JDVILDMHMMJMBE-UHFFFAOYSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1cc(F)ccc1CC[NH2+][C@@H](C)C[C@@H](C)[NH3+] ZINC000422867936 387749364 /nfs/dbraw/zinc/74/93/64/387749364.db2.gz TWSMJRNFZJBVBF-NEPJUHHUSA-N 2 0 238.350 2.392 20 0 BEADRP CO[C@@H](C)[C@H](C)[NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000128532505 387749515 /nfs/dbraw/zinc/74/95/15/387749515.db2.gz YETHDJPOROILNJ-QWRGUYRKSA-N 2 0 242.407 2.309 20 0 BEADRP CCc1noc(CC)c1C[NH2+][C@H](C)CCC[NH3+] ZINC000422869728 387749777 /nfs/dbraw/zinc/74/97/77/387749777.db2.gz WUQACNLXSAQUNG-SNVBAGLBSA-N 2 0 239.363 2.016 20 0 BEADRP CO[C@H](C)[C@H](C)[NH2+]CCC[N@@H+]1CCCC[C@H]1C ZINC000128553968 387750846 /nfs/dbraw/zinc/75/08/46/387750846.db2.gz IJROWCHYEGUBNK-HZSPNIEDSA-N 2 0 242.407 2.264 20 0 BEADRP CC(C)CC1(C[NH2+][C@H](C)C2C[NH2+]C2)CCC1 ZINC000422879593 387756582 /nfs/dbraw/zinc/75/65/82/387756582.db2.gz VOYUJIPVQXHWDU-GFCCVEGCSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]([NH2+]CCC[NH+]1CCCC1)[C@@H]1CC12CC2 ZINC000527845022 387753429 /nfs/dbraw/zinc/75/34/29/387753429.db2.gz HPXHMLYYKOYRAV-OLZOCXBDSA-N 2 0 222.376 2.251 20 0 BEADRP COCC[C@H](C)[NH2+]CCC[NH+]1CCC(C)CC1 ZINC000045018617 387699483 /nfs/dbraw/zinc/69/94/83/387699483.db2.gz WXSPTYNRTIWMTI-AWEZNQCLSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+]CCc1ccsc1 ZINC000422802277 387701056 /nfs/dbraw/zinc/70/10/56/387701056.db2.gz DGMNSKFLPDEROK-AAEUAGOBSA-N 2 0 238.400 2.268 20 0 BEADRP CC[C@H]([NH2+][C@H](C)CCCC[NH3+])C1CCOCC1 ZINC000422804577 387702986 /nfs/dbraw/zinc/70/29/86/387702986.db2.gz FPJDEGFKHLZTEW-OCCSQVGLSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]CCc1ccsc1 ZINC000422802478 387703197 /nfs/dbraw/zinc/70/31/97/387703197.db2.gz DGMNSKFLPDEROK-DGCLKSJQSA-N 2 0 238.400 2.268 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]Cc1cc(F)cc(F)c1 ZINC000422807475 387704977 /nfs/dbraw/zinc/70/49/77/387704977.db2.gz PAHQJGGDCRNJCF-IUCAKERBSA-N 2 0 228.286 2.180 20 0 BEADRP CO[C@H](C[NH2+]C1CCC(C[NH3+])CC1)C(C)(C)C ZINC000422806405 387705862 /nfs/dbraw/zinc/70/58/62/387705862.db2.gz IGODQIDOOZNFAX-WXRRBKDZSA-N 2 0 242.407 2.155 20 0 BEADRP CO[C@H](C[NH2+][C@@H]1CC[NH2+]CC[C@@H]1C)C(C)(C)C ZINC000422808616 387709033 /nfs/dbraw/zinc/70/90/33/387709033.db2.gz LGJMLRIAUNQJPB-YNEHKIRRSA-N 2 0 242.407 2.025 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CC1(c2ccccc2)CC1 ZINC000422813787 387711177 /nfs/dbraw/zinc/71/11/77/387711177.db2.gz SJNODHNSEFVEQE-STQMWFEESA-N 2 0 232.371 2.434 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)C1C[NH2+]C1)[C@H](C)c1ccccc1 ZINC000422817838 387713578 /nfs/dbraw/zinc/71/35/78/387713578.db2.gz DXRTWTCVZKKCEA-XQQFMLRXSA-N 2 0 232.371 2.376 20 0 BEADRP CCO[C@H](CC[NH2+][C@@H](C)CCC[NH3+])C(C)C ZINC000422814597 387713910 /nfs/dbraw/zinc/71/39/10/387713910.db2.gz VOPKUWMZZUNAFB-QWHCGFSZSA-N 2 0 230.396 2.155 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CCN(C)c1ccccc1 ZINC000422815303 387714666 /nfs/dbraw/zinc/71/46/66/387714666.db2.gz XHBNXGVCWJPDRI-AWEZNQCLSA-N 2 0 249.402 2.230 20 0 BEADRP C[C@H]([NH2+]CC1(c2ccccc2)CCC1)C1C[NH2+]C1 ZINC000422814469 387715782 /nfs/dbraw/zinc/71/57/82/387715782.db2.gz UZOUVLGAPSYHLC-ZDUSSCGKSA-N 2 0 244.382 2.306 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CCc1cc(F)ccc1F ZINC000422819854 387716679 /nfs/dbraw/zinc/71/66/79/387716679.db2.gz JCSJIGZPZIAJMX-NXEZZACHSA-N 2 0 242.313 2.223 20 0 BEADRP Cc1ncc([C@@H](C)[NH2+][C@H]2CCC[NH2+]CC2)s1 ZINC000643521742 387717507 /nfs/dbraw/zinc/71/75/07/387717507.db2.gz APMOTZWMAOBBSG-KOLCDFICSA-N 2 0 239.388 2.244 20 0 BEADRP Cc1ccncc1[C@@H](C)[NH2+][C@H]1CCC[NH2+]CC1 ZINC000643521884 387720971 /nfs/dbraw/zinc/72/09/71/387720971.db2.gz DUWRCDITCLYARB-OLZOCXBDSA-N 2 0 233.359 2.183 20 0 BEADRP C1CC2(C1)CCC[C@@H]2[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000643522770 387721008 /nfs/dbraw/zinc/72/10/08/387721008.db2.gz FFZMVVYBMYRENG-OLZOCXBDSA-N 2 0 222.376 2.441 20 0 BEADRP CC[C@H]([NH2+]C[C@]1(C)CCCS1)[C@@H]1CCC[NH2+]1 ZINC000422880351 387755556 /nfs/dbraw/zinc/75/55/56/387755556.db2.gz WTZIUAPWPHIGIO-AVGNSLFASA-N 2 0 242.432 2.392 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]CCCOC1CCCC1 ZINC000422834753 387725218 /nfs/dbraw/zinc/72/52/18/387725218.db2.gz XKQANKHVNIBJFS-GXTWGEPZSA-N 2 0 240.391 2.053 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCC[NH2+]CC1)[C@H]1C[C@H]1C ZINC000643522968 387725258 /nfs/dbraw/zinc/72/52/58/387725258.db2.gz QSIIMYCWLIVITC-NDBYEHHHSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCCC1(C)C)[C@@H]1CCC[NH2+]1 ZINC000422839643 387729634 /nfs/dbraw/zinc/72/96/34/387729634.db2.gz RAVSBGBICMONQP-GRYCIOLGSA-N 2 0 210.365 2.295 20 0 BEADRP CC(C)CCOCC[NH2+][C@@H]1CCCCC[C@@H]1[NH3+] ZINC000422788942 387730925 /nfs/dbraw/zinc/73/09/25/387730925.db2.gz WFHCSKMGLITYLM-UONOGXRCSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@H]([NH3+])C1)c1ccoc1 ZINC000643523953 387734187 /nfs/dbraw/zinc/73/41/87/387734187.db2.gz PMNHFGBUSYHAKF-ZMLRMANQSA-N 2 0 208.305 2.200 20 0 BEADRP CC[C@@H]([NH2+]C[C@]1(C)CCCS1)[C@@H]1CCC[NH2+]1 ZINC000422880349 387755884 /nfs/dbraw/zinc/75/58/84/387755884.db2.gz WTZIUAPWPHIGIO-AGIUHOORSA-N 2 0 242.432 2.392 20 0 BEADRP Cc1cccc(O[C@H](C)C[NH2+][C@H]2CCC[C@@H]2[NH3+])c1 ZINC000422790163 387735665 /nfs/dbraw/zinc/73/56/65/387735665.db2.gz PDXRIZOZJGRXPG-SNPRPXQTSA-N 2 0 248.370 2.232 20 0 BEADRP Cc1ncc([C@H](C)[NH2+][C@@H]2CCC[C@H]([NH3+])C2)s1 ZINC000643524239 387738081 /nfs/dbraw/zinc/73/80/81/387738081.db2.gz XYZHHMVPZBYVNZ-INTQDDNPSA-N 2 0 239.388 2.372 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]C[C@@H](C)N(C)c1ccccc1 ZINC000422856201 387740890 /nfs/dbraw/zinc/74/08/90/387740890.db2.gz FTEYQYVKLZPGSS-BFHYXJOUSA-N 2 0 249.402 2.227 20 0 BEADRP CCC1(C[NH2+][C@H](C)C2C[NH2+]C2)CCCC1 ZINC000422892188 387763187 /nfs/dbraw/zinc/76/31/87/387763187.db2.gz XRFPOWODQYSMAE-LLVKDONJSA-N 2 0 210.365 2.154 20 0 BEADRP Cc1ccc(C[NH2+][C@@H](C)C[C@H](C)[NH3+])s1 ZINC000422896094 387765401 /nfs/dbraw/zinc/76/54/01/387765401.db2.gz XJNLBLWWXBGMJV-IUCAKERBSA-N 2 0 212.362 2.272 20 0 BEADRP C[C@H]([NH3+])C[NH2+][C@H]1CC[C@H](Cc2ccccc2)C1 ZINC000643527699 387766979 /nfs/dbraw/zinc/76/69/79/387766979.db2.gz RFJWEQKFZFNMTM-CFVMTHIKSA-N 2 0 232.371 2.335 20 0 BEADRP COc1ccc([C@H]2C[C@@H]2[C@H](C)[NH2+]C[C@@H](C)[NH3+])cc1 ZINC000643527742 387767641 /nfs/dbraw/zinc/76/76/41/387767641.db2.gz RSAXOVKMPXNXKS-BAESOJJISA-N 2 0 248.370 2.124 20 0 BEADRP Cc1cccc(C[C@@H]([NH2+]C[C@H](C)[NH3+])C2CC2)c1 ZINC000643528659 387768966 /nfs/dbraw/zinc/76/89/66/387768966.db2.gz MORVMGXQTJWMLT-SWLSCSKDSA-N 2 0 232.371 2.253 20 0 BEADRP CC(C)[C@@H](Cc1ccc(F)cc1)[NH2+]C[C@@H](C)[NH3+] ZINC000643528959 387772192 /nfs/dbraw/zinc/77/21/92/387772192.db2.gz RUJFKFLRNAUNRS-BXUZGUMPSA-N 2 0 238.350 2.330 20 0 BEADRP Cc1ccc(C[C@H]([NH2+]C[C@@H](C)[NH3+])C2CC2)cc1 ZINC000643529061 387772921 /nfs/dbraw/zinc/77/29/21/387772921.db2.gz UFPJBUFHJLDTCJ-DOMZBBRYSA-N 2 0 232.371 2.253 20 0 BEADRP C[C@H]([NH3+])C[NH2+][C@H]1CCC[C@H]1c1ccccc1 ZINC000643529023 387772943 /nfs/dbraw/zinc/77/29/43/387772943.db2.gz SUURVMGGPLSQCF-UBHSHLNASA-N 2 0 218.344 2.260 20 0 BEADRP CC(C)[C@H](Cc1ccc(F)cc1)[NH2+]C[C@@H](C)[NH3+] ZINC000643528961 387773150 /nfs/dbraw/zinc/77/31/50/387773150.db2.gz RUJFKFLRNAUNRS-RISCZKNCSA-N 2 0 238.350 2.330 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+][C@@H]1C[C@@H]1Cc1ccccc1 ZINC000422921152 387774954 /nfs/dbraw/zinc/77/49/54/387774954.db2.gz NMHOFHDEWHDCIZ-LJISPDSOSA-N 2 0 230.355 2.087 20 0 BEADRP C[C@H](Cc1coc2ccccc12)[NH2+]C[C@H](C)[NH3+] ZINC000643529896 387777066 /nfs/dbraw/zinc/77/70/66/387777066.db2.gz UNBWQVUENFEBQN-WDEREUQCSA-N 2 0 232.327 2.301 20 0 BEADRP Cc1cccc(CC[C@@H](C)[NH2+]C[C@H](C)[NH3+])c1 ZINC000643529381 387777427 /nfs/dbraw/zinc/77/74/27/387777427.db2.gz ZBXOFGVXRLTGHV-QWHCGFSZSA-N 2 0 220.360 2.253 20 0 BEADRP C[C@H]([NH3+])C[NH2+]C1CCC(OC2CCCC2)CC1 ZINC000643529644 387777913 /nfs/dbraw/zinc/77/79/13/387777913.db2.gz IUASJOWAFASXBW-DCBWTQNWSA-N 2 0 240.391 2.194 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H]1C[C@H]1Cc1ccccc1 ZINC000422926846 387780346 /nfs/dbraw/zinc/78/03/46/387780346.db2.gz XQNHMEKAABQLTK-BPLDGKMQSA-N 2 0 232.371 2.335 20 0 BEADRP C[C@H]1CN(C2CC2)C[C@@H]1[NH2+]CC1CC=CC1 ZINC000527942035 387781686 /nfs/dbraw/zinc/78/16/86/387781686.db2.gz APHRRBBWKPBFLN-FZMZJTMJSA-N 2 0 220.360 2.025 20 0 BEADRP CCOCCC1(C[NH2+][C@H]2CCC[C@H]2[NH3+])CCC1 ZINC000422937994 387783421 /nfs/dbraw/zinc/78/34/21/387783421.db2.gz KKVCJMVWKZMXJL-OLZOCXBDSA-N 2 0 240.391 2.053 20 0 BEADRP Cc1ccccc1OCC[NH2+][C@H](C)C[C@@H](C)[NH3+] ZINC000422944475 387785338 /nfs/dbraw/zinc/78/53/38/387785338.db2.gz MHXPAWOGHSUCNM-CHWSQXEVSA-N 2 0 236.359 2.089 20 0 BEADRP C[C@H](C[C@@H]1CCCO1)[NH2+]C1CCC(C[NH3+])CC1 ZINC000422901674 387786943 /nfs/dbraw/zinc/78/69/43/387786943.db2.gz LMIISWKSJPZOSW-RYSNWHEDSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]C[C@H](C)Oc1ccccc1 ZINC000422980909 387790723 /nfs/dbraw/zinc/79/07/23/387790723.db2.gz MRKACFCMAKKCQA-XQQFMLRXSA-N 2 0 236.359 2.169 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCC[C@@H]1C[NH3+])Oc1ccccc1 ZINC000422983013 387794237 /nfs/dbraw/zinc/79/42/37/387794237.db2.gz SDELCAPUFCGUMB-UMVBOHGHSA-N 2 0 248.370 2.171 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@H]1CCc2c1cccc2O ZINC000422981459 387794462 /nfs/dbraw/zinc/79/44/62/387794462.db2.gz SWVCEXZTWDJUBS-KWBADKCTSA-N 2 0 234.343 2.095 20 0 BEADRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]CC1Cc2ccccc2C1 ZINC000422983628 387794611 /nfs/dbraw/zinc/79/46/11/387794611.db2.gz UJJXSTRZRLZHOU-HZPDHXFCSA-N 2 0 244.382 2.118 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CCCC(F)(F)F ZINC000422962461 387813031 /nfs/dbraw/zinc/81/30/31/387813031.db2.gz CORPZFHWZQCSLH-HTQZYQBOSA-N 2 0 212.259 2.044 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H]1CCCC(F)(F)C1 ZINC000422985920 387795980 /nfs/dbraw/zinc/79/59/80/387795980.db2.gz BAJLYLBUKMCFSZ-LPEHRKFASA-N 2 0 220.307 2.280 20 0 BEADRP [NH3+][C@H]1CCCCC[C@@H]1[NH2+]CCc1ccc(O)cc1 ZINC000422990780 387800441 /nfs/dbraw/zinc/80/04/41/387800441.db2.gz NYTZLLBGKBDPKG-GJZGRUSLSA-N 2 0 248.370 2.184 20 0 BEADRP CCC(CC)[C@H](CC[NH2+][C@@H]1CCC[C@@H]1[NH3+])OC ZINC000422991535 387800475 /nfs/dbraw/zinc/80/04/75/387800475.db2.gz BLWFJPORXGOSSB-MJBXVCDLSA-N 2 0 242.407 2.297 20 0 BEADRP CCOc1cccc(CC[NH2+][C@H]2CCC[C@@H]2[NH3+])c1 ZINC000422991760 387801077 /nfs/dbraw/zinc/80/10/77/387801077.db2.gz BOFBPJDKMPRAEN-GJZGRUSLSA-N 2 0 248.370 2.097 20 0 BEADRP c1ccc2c(c1)CC[C@H](C[NH2+]C1CC[NH2+]CC1)C2 ZINC000643478068 387801383 /nfs/dbraw/zinc/80/13/83/387801383.db2.gz RSCKRZVMCCAFKY-ZDUSSCGKSA-N 2 0 244.382 2.133 20 0 BEADRP CC[C@@H]([NH2+][C@H]1CC=CCC1)[C@@H]1CCC[NH2+]1 ZINC000422997684 387801740 /nfs/dbraw/zinc/80/17/40/387801740.db2.gz VHFJSTCRFOQMQE-XQQFMLRXSA-N 2 0 208.349 2.215 20 0 BEADRP c1ccc2c(c1)CC[C@@H](C[NH2+]C1CC[NH2+]CC1)C2 ZINC000643478067 387802080 /nfs/dbraw/zinc/80/20/80/387802080.db2.gz RSCKRZVMCCAFKY-CYBMUJFWSA-N 2 0 244.382 2.133 20 0 BEADRP COc1cc[nH+]c(NCc2cncn2C(C)C)c1 ZINC000424153056 387805288 /nfs/dbraw/zinc/80/52/88/387805288.db2.gz HSIOYJCLGNEWOD-UHFFFAOYSA-N 2 0 246.314 2.480 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H](C)CCc1ccco1 ZINC000422965068 387813431 /nfs/dbraw/zinc/81/34/31/387813431.db2.gz NMGZTJKERPNXLN-SRVKXCTJSA-N 2 0 224.348 2.316 20 0 BEADRP Cc1ccccc1OCC[NH2+][C@H](C)CCC[NH3+] ZINC000422949552 387807288 /nfs/dbraw/zinc/80/72/88/387807288.db2.gz UGHIOAQTSLYDOQ-CYBMUJFWSA-N 2 0 236.359 2.091 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CC1(C)C)[C@H]1CCCC[NH2+]1 ZINC000422954774 387809065 /nfs/dbraw/zinc/80/90/65/387809065.db2.gz JQHZTZLVKPOQFY-IJLUTSLNSA-N 2 0 210.365 2.153 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](C)[C@H]2CC23CC3)C1 ZINC000527855960 387757372 /nfs/dbraw/zinc/75/73/72/387757372.db2.gz XKJUXRAHAQPYRP-MGPQQGTHSA-N 2 0 236.403 2.497 20 0 BEADRP Cc1ccccc1C[C@@H]([NH2+]C[C@H](C)[NH3+])C1CC1 ZINC000643526678 387758667 /nfs/dbraw/zinc/75/86/67/387758667.db2.gz DRVAAQSQCCPPOU-SWLSCSKDSA-N 2 0 232.371 2.253 20 0 BEADRP Cc1nc(CC[NH2+][C@@H](C)C[C@H](C)[NH3+])sc1C ZINC000422889363 387759151 /nfs/dbraw/zinc/75/91/51/387759151.db2.gz GBUOJFTZKCLMKI-IUCAKERBSA-N 2 0 241.404 2.018 20 0 BEADRP COc1cccc2c1CC[C@@H]2[NH2+][C@H](C)C[C@@H](C)[NH3+] ZINC000422888908 387760236 /nfs/dbraw/zinc/76/02/36/387760236.db2.gz OGVQRTPEQZTOCX-GYSYKLTISA-N 2 0 248.370 2.398 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CC=CCC1)[C@H]1CCC[NH2+]1 ZINC000422972551 387821430 /nfs/dbraw/zinc/82/14/30/387821430.db2.gz MCRKSBSPNHELHB-JHJVBQTASA-N 2 0 208.349 2.073 20 0 BEADRP CCC(CC)(CO)C[NH2+][C@H]1CCCCC[C@H]1[NH3+] ZINC000423003468 387825823 /nfs/dbraw/zinc/82/58/23/387825823.db2.gz MGCOALGUNMECBC-OLZOCXBDSA-N 2 0 242.407 2.035 20 0 BEADRP CC(C)[NH+](CCC[NH2+][C@H](C)CCC[NH3+])C(C)C ZINC000423004070 387826283 /nfs/dbraw/zinc/82/62/83/387826283.db2.gz JATFDFQOSQJRMJ-CQSZACIVSA-N 3 0 243.439 2.212 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CC1Cc2ccccc2C1 ZINC000422976016 387827448 /nfs/dbraw/zinc/82/74/48/387827448.db2.gz CRWOEWDARUYNML-VXGBXAGGSA-N 2 0 232.371 2.117 20 0 BEADRP COCC(C)(C)C[N@@H+]1CCC[C@H]([NH+](C)C)CC1 ZINC000432815291 387828564 /nfs/dbraw/zinc/82/85/64/387828564.db2.gz FGQPPZDKXWEQDH-ZDUSSCGKSA-N 2 0 242.407 2.075 20 0 BEADRP C[C@H]([NH2+]CC12CCC(CC1)C2)[C@@H]1CCC[NH2+]1 ZINC000423008623 387831734 /nfs/dbraw/zinc/83/17/34/387831734.db2.gz ARZZCRUHCGBIBW-AHPWVWPOSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H](Cc1ccoc1)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000423010132 387833444 /nfs/dbraw/zinc/83/34/44/387833444.db2.gz XDGYIZOOUBFTJT-RAQOOLMWSA-N 2 0 234.343 2.083 20 0 BEADRP Cc1ccc(CC[C@@H](C)[NH2+][C@@H](C)C2C[NH2+]C2)o1 ZINC000423009907 387833989 /nfs/dbraw/zinc/83/39/89/387833989.db2.gz WJZPCNHYAWHOJB-PWSUYJOCSA-N 2 0 236.359 2.107 20 0 BEADRP Cc1ccc(CC[N@H+]2C[C@@H](C[NH3+])C[C@@H]2C)cc1 ZINC000442763708 387834846 /nfs/dbraw/zinc/83/48/46/387834846.db2.gz JBIZKZFUJNSJKW-DZGCQCFKSA-N 2 0 232.371 2.207 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@H](c1cccnc1)C1CC1 ZINC000423011999 387836145 /nfs/dbraw/zinc/83/61/45/387836145.db2.gz JXHZEORHWGZIQK-MJVIPROJSA-N 2 0 233.359 2.248 20 0 BEADRP CC[C@@H]([NH2+]CCc1ccncc1C)[C@@H]1CCC[NH2+]1 ZINC000423012009 387836784 /nfs/dbraw/zinc/83/67/84/387836784.db2.gz JYBHKOIZXOFCHL-CABCVRRESA-N 2 0 247.386 2.053 20 0 BEADRP Cc1cnccc1CC[NH2+][C@@H]1CCCC[C@H]1C[NH3+] ZINC000423014110 387836825 /nfs/dbraw/zinc/83/68/25/387836825.db2.gz OHNPXPQKGPCWDU-LSDHHAIUSA-N 2 0 247.386 2.040 20 0 BEADRP CC[C@H]([NH2+][C@@H](C)C[C@@H](C)[NH3+])c1c(C)noc1C ZINC000423015250 387838544 /nfs/dbraw/zinc/83/85/44/387838544.db2.gz QOFGEFJVXCXNJQ-PTRXPTGYSA-N 2 0 239.363 2.458 20 0 BEADRP C[C@@H]1C[C@@H](C[NH3+])C[N@@H+]1[C@H]1CCc2ccc(F)cc21 ZINC000442779850 387839122 /nfs/dbraw/zinc/83/91/22/387839122.db2.gz JQVCJFMBVCIOKL-ZETOZRRWSA-N 2 0 248.345 2.482 20 0 BEADRP CC(C)OCCCC[NH2+][C@H]1CC[NH2+]CC[C@H]1C ZINC000423031531 387846362 /nfs/dbraw/zinc/84/63/62/387846362.db2.gz LGBGSPBQFUXURI-KGLIPLIRSA-N 2 0 242.407 2.169 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+][C@H]1CC12CCCC2 ZINC000423075245 387873864 /nfs/dbraw/zinc/87/38/64/387873864.db2.gz OCHLOTDDMFBMHK-UPJWGTAASA-N 2 0 222.376 2.297 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+][C@@H]1CCC12CCCC2 ZINC000423074530 387873904 /nfs/dbraw/zinc/87/39/04/387873904.db2.gz LYDNUDURPHPXOY-CHWSQXEVSA-N 2 0 240.391 2.053 20 0 BEADRP Cc1cnc([C@H](C)C[NH2+][C@@H](C)C[C@@H](C)[NH3+])s1 ZINC000423035769 387850513 /nfs/dbraw/zinc/85/05/13/387850513.db2.gz KDESHAYYLLBSHN-BBBLOLIVSA-N 2 0 241.404 2.270 20 0 BEADRP Cc1cnc([C@H](C)C[NH2+][C@H](C)C[C@@H](C)[NH3+])s1 ZINC000423035771 387850759 /nfs/dbraw/zinc/85/07/59/387850759.db2.gz KDESHAYYLLBSHN-OPRDCNLKSA-N 2 0 241.404 2.270 20 0 BEADRP Cc1cnc([C@@H](C)C[NH2+][C@H](C)CCC[NH3+])s1 ZINC000423037652 387850886 /nfs/dbraw/zinc/85/08/86/387850886.db2.gz NHMVUKFOJYEEPH-VHSXEESVSA-N 2 0 241.404 2.272 20 0 BEADRP CC(C)O[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@H]2[NH3+])C1(C)C ZINC000423044092 387854851 /nfs/dbraw/zinc/85/48/51/387854851.db2.gz ATBZJUWYILMDHJ-MROQNXINSA-N 2 0 240.391 2.048 20 0 BEADRP CC[C@H](CC(F)(F)F)[NH2+][C@@H](C)C[C@@H](C)[NH3+] ZINC000423041247 387855003 /nfs/dbraw/zinc/85/50/03/387855003.db2.gz WQYKMTHLFRJYJD-HRDYMLBCSA-N 2 0 226.286 2.433 20 0 BEADRP CC(C)O[C@@H]1C[C@H]([NH2+][C@@H](C)C[C@H](C)[NH3+])C1(C)C ZINC000423053761 387861767 /nfs/dbraw/zinc/86/17/67/387861767.db2.gz SVRFRCIVXBATDV-ZDEQEGDKSA-N 2 0 242.407 2.294 20 0 BEADRP CC(C)O[C@H]1C[C@@H]([NH2+][C@@H](C)C[C@H](C)[NH3+])C1(C)C ZINC000423053759 387861951 /nfs/dbraw/zinc/86/19/51/387861951.db2.gz SVRFRCIVXBATDV-RVMXOQNASA-N 2 0 242.407 2.294 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)[C@@H]1C[C@H]1C ZINC000643535359 387863247 /nfs/dbraw/zinc/86/32/47/387863247.db2.gz CGRGGSDWSCLXFU-FVCCEPFGSA-N 2 0 222.376 2.153 20 0 BEADRP Cc1ccncc1[C@@H](C)[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000643535594 387863675 /nfs/dbraw/zinc/86/36/75/387863675.db2.gz NOXWAVTVWGQRSE-TZMCWYRMSA-N 2 0 245.370 2.183 20 0 BEADRP c1cc2c(o1)CCC[C@@H]2[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000643535587 387864302 /nfs/dbraw/zinc/86/43/02/387864302.db2.gz NJEMWYNBWLKPQT-GXTWGEPZSA-N 2 0 246.354 2.389 20 0 BEADRP Cc1ccncc1[C@@H](C)[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000643535593 387864488 /nfs/dbraw/zinc/86/44/88/387864488.db2.gz NOXWAVTVWGQRSE-OCCSQVGLSA-N 2 0 245.370 2.183 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@@H](C)CC1)C1C[NH2+]C1 ZINC000423059927 387865284 /nfs/dbraw/zinc/86/52/84/387865284.db2.gz NFDZTTAOEFXORV-NTZNESFSSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)[C@H](CC(F)(F)F)[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000423059052 387865428 /nfs/dbraw/zinc/86/54/28/387865428.db2.gz KUYVBRBDQYZXGB-WPRPVWTQSA-N 2 0 238.297 2.161 20 0 BEADRP CC[C@H]([NH2+][C@H]1CC12CC[NH2+]CC2)C1CCC1 ZINC000643535875 387866501 /nfs/dbraw/zinc/86/65/01/387866501.db2.gz KHVLXEPPCXGCNB-STQMWFEESA-N 2 0 222.376 2.297 20 0 BEADRP CSC1(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)CC1 ZINC000193817228 387866863 /nfs/dbraw/zinc/86/68/63/387866863.db2.gz NBGNJHOIPXNNRE-YOGCLGLASA-N 2 0 240.416 2.097 20 0 BEADRP CC[C@H]([NH2+][C@H]1CC[C@H](C)C1)[C@@H]1CCC[NH2+]1 ZINC000423062020 387868411 /nfs/dbraw/zinc/86/84/11/387868411.db2.gz MCRDBOLXOMYKBQ-CYDGBPFRSA-N 2 0 210.365 2.295 20 0 BEADRP C1[C@H]([NH2+][C@H]2CCCC23CCC3)C12CC[NH2+]CC2 ZINC000643536678 387868705 /nfs/dbraw/zinc/86/87/05/387868705.db2.gz UVDZHYDGBXVWEJ-STQMWFEESA-N 2 0 234.387 2.441 20 0 BEADRP C[C@H]([NH2+][C@H]1CC12CC[NH2+]CC2)C(C)(C)C ZINC000643536500 387869119 /nfs/dbraw/zinc/86/91/19/387869119.db2.gz UKQGDVIWQYPBAY-QWRGUYRKSA-N 2 0 210.365 2.153 20 0 BEADRP C1[C@@H]([NH2+][C@@H]2CCCC23CCC3)C12CC[NH2+]CC2 ZINC000643536675 387869425 /nfs/dbraw/zinc/86/94/25/387869425.db2.gz UVDZHYDGBXVWEJ-CHWSQXEVSA-N 2 0 234.387 2.441 20 0 BEADRP CC(C)C1CC([NH2+][C@H]2CC23CC[NH2+]CC3)C1 ZINC000643536976 387871815 /nfs/dbraw/zinc/87/18/15/387871815.db2.gz ZSOVWWSFWAKJLF-BPCQOVAHSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]Cc1ccc2c(n1)CCCC2 ZINC000423072054 387871901 /nfs/dbraw/zinc/87/19/01/387871901.db2.gz GOBLCTOFBYJIAP-RYUDHWBXSA-N 2 0 247.386 2.176 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@H]1CCCc2occc21 ZINC000422964190 387813703 /nfs/dbraw/zinc/81/37/03/387813703.db2.gz KPKOLBBDULEISN-NHCYSSNCSA-N 2 0 222.332 2.372 20 0 BEADRP C[C@@H]([NH2+][C@H]1C[C@H](c2ccccc2)C1)C1C[NH2+]C1 ZINC000422967320 387815567 /nfs/dbraw/zinc/81/55/67/387815567.db2.gz OXHLIPJOIHVFCD-UXIGCNINSA-N 2 0 230.355 2.130 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]CCc1ccccc1O ZINC000422966921 387815657 /nfs/dbraw/zinc/81/56/57/387815657.db2.gz AVQHWUUMFWRBSO-ZIAGYGMSSA-N 2 0 248.370 2.184 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CC1(c2ccccn2)CCC1 ZINC000423101873 387889682 /nfs/dbraw/zinc/88/96/82/387889682.db2.gz DJWXHIXMYFIWIZ-QWHCGFSZSA-N 2 0 247.386 2.219 20 0 BEADRP Cc1cccc(CCC[NH2+][C@@H](C)CCCC[NH3+])n1 ZINC000423104322 387890083 /nfs/dbraw/zinc/89/00/83/387890083.db2.gz LSWGVJGHVSVMHG-ZDUSSCGKSA-N 2 0 249.402 2.430 20 0 BEADRP CC(C)OCCC[N@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000158075314 387891014 /nfs/dbraw/zinc/89/10/14/387891014.db2.gz UNKZEOSFEYFGEH-AWEZNQCLSA-N 2 0 242.407 2.075 20 0 BEADRP CC(C)(O)C(C)(C)[NH2+]CCC[NH+]1CCCCC1 ZINC000444608052 387891416 /nfs/dbraw/zinc/89/14/16/387891416.db2.gz KHECGCQDJIYFDH-UHFFFAOYSA-N 2 0 242.407 2.002 20 0 BEADRP [NH3+]C1CCC([NH2+][C@@H]2CCC[C@H]2OC(F)F)CC1 ZINC000423106444 387891565 /nfs/dbraw/zinc/89/15/65/387891565.db2.gz CSNUQDQIRJEVTK-JPPWEJMLSA-N 2 0 248.317 2.006 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CCc1cccc2[nH]ccc21 ZINC000423105164 387892011 /nfs/dbraw/zinc/89/20/11/387892011.db2.gz CAKKGNDGJDSLCI-VXGBXAGGSA-N 2 0 245.370 2.426 20 0 BEADRP CCSCCC[NH2+][C@H]1CCCCC[C@@H]1[NH3+] ZINC000423110690 387892972 /nfs/dbraw/zinc/89/29/72/387892972.db2.gz IICLVNRFMIFNSF-RYUDHWBXSA-N 2 0 230.421 2.379 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CCC[C@H]1C)[C@H]1CCC[NH2+]1 ZINC000423110909 387893660 /nfs/dbraw/zinc/89/36/60/387893660.db2.gz WGIWZWNGRBSHMD-FVCCEPFGSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCC1(C)C)[C@@H]1CCCC[NH2+]1 ZINC000423109974 387893780 /nfs/dbraw/zinc/89/37/80/387893780.db2.gz OHHNMWGJKIJTPJ-GRYCIOLGSA-N 2 0 210.365 2.295 20 0 BEADRP COCC1(C[NH2+][C@H]2CCCCC[C@H]2[NH3+])CCC1 ZINC000423110671 387893918 /nfs/dbraw/zinc/89/39/18/387893918.db2.gz IGLPQMJBCVOMIC-OLZOCXBDSA-N 2 0 240.391 2.053 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CCc1ccc2[nH]ccc2c1 ZINC000423109806 387894047 /nfs/dbraw/zinc/89/40/47/387894047.db2.gz UZBWRDWZCJNXPJ-VXGBXAGGSA-N 2 0 245.370 2.426 20 0 BEADRP Cc1ccccc1[C@H]1C[C@H]([NH2+][C@H](C)C2C[NH2+]C2)C1 ZINC000423109853 387894179 /nfs/dbraw/zinc/89/41/79/387894179.db2.gz VFQULCCINFGUFR-UMVBOHGHSA-N 2 0 244.382 2.439 20 0 BEADRP CCSCCC[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000423116702 387898079 /nfs/dbraw/zinc/89/80/79/387898079.db2.gz REHWBCCCSXHFFT-FOSCPWQOSA-N 2 0 228.405 2.002 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]C[C@@](C)(O)C1CCCCC1 ZINC000423072308 387875072 /nfs/dbraw/zinc/87/50/72/387875072.db2.gz JDTMIXLKDTWXDI-OUCADQQQSA-N 2 0 242.407 2.033 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCCCC[C@@H]1[NH3+])c1ccncc1 ZINC000643460225 387875286 /nfs/dbraw/zinc/87/52/86/387875286.db2.gz CORXTPCROLADHC-VHDGCEQUSA-N 2 0 247.386 2.435 20 0 BEADRP CC[C@@H]([NH2+]C[C@H](C)c1ccncc1)[C@@H]1CCC[NH2+]1 ZINC000643460374 387875432 /nfs/dbraw/zinc/87/54/32/387875432.db2.gz WRCJABCCGDEGPR-CFVMTHIKSA-N 2 0 247.386 2.305 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]C[C@@H](C)c1ccncc1 ZINC000643460232 387875496 /nfs/dbraw/zinc/87/54/96/387875496.db2.gz DAHTXFAIXIVOGK-OLZOCXBDSA-N 2 0 235.375 2.292 20 0 BEADRP CCSCCC[NH2+][C@H]1CC[NH2+]CC[C@@H]1C ZINC000423117733 387898430 /nfs/dbraw/zinc/89/84/30/387898430.db2.gz WXIVKOAAPKANLH-RYUDHWBXSA-N 2 0 230.421 2.107 20 0 BEADRP CC[C@](C)(C[NH2+][C@@H]1CCN2CCCC[C@H]12)OC ZINC000322518375 387878597 /nfs/dbraw/zinc/87/85/97/387878597.db2.gz KYEOBZAGSICWPT-MGPQQGTHSA-N 2 0 240.391 2.018 20 0 BEADRP Cc1ncc([C@@H](C)[NH2+][C@H](C)CCC[NH3+])s1 ZINC000643539250 387879605 /nfs/dbraw/zinc/87/96/05/387879605.db2.gz MRFIFUHUUVJZRO-RKDXNWHRSA-N 2 0 227.377 2.230 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@@H]1CCCc2cccnc21 ZINC000643539331 387879928 /nfs/dbraw/zinc/87/99/28/387879928.db2.gz MYBKSWPHTPJCRB-WCQYABFASA-N 2 0 233.359 2.176 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]CCC1(C)CC1 ZINC000423087945 387880737 /nfs/dbraw/zinc/88/07/37/387880737.db2.gz QPSYKTLJDLLBHB-NEPJUHHUSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CC[C@@H](C)C1)[C@H]1CCC[NH2+]1 ZINC000423092549 387882729 /nfs/dbraw/zinc/88/27/29/387882729.db2.gz CIDSBBVCWATRED-FDYHWXHSSA-N 2 0 210.365 2.153 20 0 BEADRP CC1(C)C(C[NH2+][C@H]2CCC[C@@H]2[NH3+])C1(C)C ZINC000423096403 387885741 /nfs/dbraw/zinc/88/57/41/387885741.db2.gz OUASHTSBMZFNSS-UWVGGRQHSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1CC[C@@H]1C1CC1 ZINC000423100691 387886698 /nfs/dbraw/zinc/88/66/98/387886698.db2.gz VLVSMBZODSOLRI-RAIGVLPGSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1CCC[C@@H]1C[NH2+][C@H]1CC[NH2+]CC[C@@H]1C ZINC000423098108 387887457 /nfs/dbraw/zinc/88/74/57/387887457.db2.gz KGFUOJPHXGRNSK-RQJABVFESA-N 2 0 224.392 2.400 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H]1CC[C@H]1C ZINC000423116159 387899111 /nfs/dbraw/zinc/89/91/11/387899111.db2.gz ZRTPHBCBTMPAGT-PUYPPJJSSA-N 2 0 233.359 2.298 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CC[C@@H]1C[C@@H](C)O[C@@H](C)C1 ZINC000423118053 387900384 /nfs/dbraw/zinc/90/03/84/387900384.db2.gz YOTKNDDJHFAZQH-YHQUGGNUSA-N 2 0 242.407 2.296 20 0 BEADRP CCOCC(C)(C)C[NH2+][C@H]1CC[NH2+]CC[C@H]1C ZINC000423121174 387900451 /nfs/dbraw/zinc/90/04/51/387900451.db2.gz IDEHMAXNKITTJC-OLZOCXBDSA-N 2 0 242.407 2.027 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CCCSC1)[C@@H]1CCCC[NH2+]1 ZINC000423119054 387900754 /nfs/dbraw/zinc/90/07/54/387900754.db2.gz CXYXMIGLJNMLMB-UPJWGTAASA-N 2 0 242.432 2.250 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]C1CC(C(F)(F)F)C1 ZINC000423122215 387902077 /nfs/dbraw/zinc/90/20/77/387902077.db2.gz JQHCVSZIOIRAEM-IDKOKCKLSA-N 2 0 238.297 2.434 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC000423126549 387905348 /nfs/dbraw/zinc/90/53/48/387905348.db2.gz AVTYFZJRPLYGSL-ZQDZILKHSA-N 2 0 230.355 2.260 20 0 BEADRP CCc1noc(C)c1C[NH2+][C@@H](C)CCCC[NH3+] ZINC000423130220 387907098 /nfs/dbraw/zinc/90/70/98/387907098.db2.gz GDUYNBZMEUNGHH-JTQLQIEISA-N 2 0 239.363 2.153 20 0 BEADRP Cc1cccnc1C(C)(C)C[NH2+][C@@H]1CCC[C@H]1[NH3+] ZINC000423133225 387910282 /nfs/dbraw/zinc/91/02/82/387910282.db2.gz CMYPLAFRVROGFQ-CHWSQXEVSA-N 2 0 247.386 2.137 20 0 BEADRP COCC1(C[NH2+][C@H]2CCC[C@@H]2[NH3+])CCCCC1 ZINC000423134199 387911574 /nfs/dbraw/zinc/91/15/74/387911574.db2.gz DNVKHDMYPBEVJT-STQMWFEESA-N 2 0 240.391 2.053 20 0 BEADRP CC[C@H]1CC[C@H]([NH2+][C@H]2CCC[C@@H]2[NH3+])CC1 ZINC000423137674 387914476 /nfs/dbraw/zinc/91/44/76/387914476.db2.gz WTXPNXIDXJDJRV-CYDGBPFRSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC2CCC1CC2)[C@H]1CCC[NH2+]1 ZINC000423138925 387915884 /nfs/dbraw/zinc/91/58/84/387915884.db2.gz YVEBUJKQOROWDE-MGBPRESASA-N 2 0 222.376 2.295 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CCCCC1(F)F ZINC000423150831 387930035 /nfs/dbraw/zinc/93/00/35/387930035.db2.gz ZHTWFQRVULGLNG-AXFHLTTASA-N 2 0 232.318 2.281 20 0 BEADRP C[C@@H](C[C@H]1CCCCC[NH2+]1)[NH2+]C[C@H]1CCCO1 ZINC000423150641 387930436 /nfs/dbraw/zinc/93/04/36/387930436.db2.gz BOFCXGWBJPMSTJ-BFHYXJOUSA-N 2 0 240.391 2.066 20 0 BEADRP Cc1ccc(F)c(CC[NH2+][C@@H](C)CCC[NH3+])c1 ZINC000423152742 387931950 /nfs/dbraw/zinc/93/19/50/387931950.db2.gz MCIDOCLCJAGHCC-LBPRGKRZSA-N 2 0 238.350 2.394 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H]1C[C@H]1C1CC1)[C@@H]1CCC[NH2+]1 ZINC000423157744 387935964 /nfs/dbraw/zinc/93/59/64/387935964.db2.gz BPYKBGMJXQBWJU-FQUUOJAGSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CSc2ccccc21)C1C[NH2+]C1 ZINC000423143330 387921200 /nfs/dbraw/zinc/92/12/00/387921200.db2.gz CQHQIUKZQJUQPY-CMPLNLGQSA-N 2 0 248.395 2.073 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CCCCC1(F)F)C1C[NH2+]C1 ZINC000423144743 387921489 /nfs/dbraw/zinc/92/14/89/387921489.db2.gz HUZGAHDPZSVEES-MWLCHTKSSA-N 2 0 232.318 2.009 20 0 BEADRP Cc1ccc(F)c(CC[NH2+][C@@H](C)C[C@@H](C)[NH3+])c1 ZINC000423147026 387924077 /nfs/dbraw/zinc/92/40/77/387924077.db2.gz BTJNDKRHKWZXJQ-NEPJUHHUSA-N 2 0 238.350 2.392 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CCCC(C)(F)F ZINC000423147245 387924585 /nfs/dbraw/zinc/92/45/85/387924585.db2.gz RLSITZBFEJPVAP-IUCAKERBSA-N 2 0 208.296 2.137 20 0 BEADRP CCn1ccnc1[C@H](C)[NH2+][C@@H](C)CCCC[NH3+] ZINC000423146890 387924747 /nfs/dbraw/zinc/92/47/47/387924747.db2.gz BNJMASAVFPJBFA-RYUDHWBXSA-N 2 0 238.379 2.071 20 0 BEADRP F[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCC[C@H]1[C@H]1CCC[NH2+]1 ZINC000423148182 387924956 /nfs/dbraw/zinc/92/49/56/387924956.db2.gz UTIXIQNJSHIZQA-MRTXSQPYSA-N 2 0 240.366 2.387 20 0 BEADRP CC(C)(C[NH2+][C@@H]1CCC[C@@H]1C[NH3+])c1ccccn1 ZINC000423147900 387925002 /nfs/dbraw/zinc/92/50/02/387925002.db2.gz TXOAIOBHDUJTHJ-CHWSQXEVSA-N 2 0 247.386 2.076 20 0 BEADRP CC(C)(C[NH2+][C@H]1CCC[C@H]1C[NH3+])c1ccccn1 ZINC000423147903 387925309 /nfs/dbraw/zinc/92/53/09/387925309.db2.gz TXOAIOBHDUJTHJ-STQMWFEESA-N 2 0 247.386 2.076 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+][C@@H]1CCCCC[C@H]1[NH3+] ZINC000423147569 387925645 /nfs/dbraw/zinc/92/56/45/387925645.db2.gz CWPIMXRVCOPNJB-YVECIDJPSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CC(C)(C)C1(O)CCCC1 ZINC000423168907 387954818 /nfs/dbraw/zinc/95/48/18/387954818.db2.gz VIMUDMMBQGYZLQ-NEPJUHHUSA-N 2 0 242.407 2.033 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[C@@H]1C1CC1)C1C[NH2+]C1 ZINC000423168709 387954931 /nfs/dbraw/zinc/95/49/31/387954931.db2.gz HYRVUPQRWCCGIA-ZKYQVNSYSA-N 2 0 222.376 2.010 20 0 BEADRP CC[C@]1(C(C)C)C[C@@H]1[NH2+][C@H](C)C1C[NH2+]C1 ZINC000423169465 387955588 /nfs/dbraw/zinc/95/55/88/387955588.db2.gz VXEJGOWTWGCOCB-KGYLQXTDSA-N 2 0 210.365 2.009 20 0 BEADRP C1[C@@H]2[C@H]1CCC[C@H]2[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000423169326 387955715 /nfs/dbraw/zinc/95/57/15/387955715.db2.gz JCMZPMOHIYPRLO-OSJZAZGFSA-N 2 0 220.360 2.048 20 0 BEADRP CC(C)C[C@@H](C)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000044535010 387938055 /nfs/dbraw/zinc/93/80/55/387938055.db2.gz PFZADHSVZZJEMN-CHWSQXEVSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H]([NH2+]CC1CCCCCC1)C1C[NH2+]C1 ZINC000423158060 387938322 /nfs/dbraw/zinc/93/83/22/387938322.db2.gz WCTJKOLOKIQDQS-NSHDSACASA-N 2 0 210.365 2.154 20 0 BEADRP CCO[C@@H]1CCC[C@H]1[NH2+]C1CCC(C[NH3+])CC1 ZINC000423160824 387940575 /nfs/dbraw/zinc/94/05/75/387940575.db2.gz HZJHGLFSRQYIKJ-NWINJMCUSA-N 2 0 240.391 2.051 20 0 BEADRP CCO[C@H]1C[C@@H]([NH2+][C@@H]2C[C@@H]([NH3+])c3ccccc32)C1 ZINC000423160732 387940861 /nfs/dbraw/zinc/94/08/61/387940861.db2.gz HTOLXPIDFCKTNB-BAESOJJISA-N 2 0 246.354 2.288 20 0 BEADRP CC[C@H](C)[C@H](C[NH2+][C@@H]1CC[NH2+]CC[C@H]1C)OC ZINC000423159424 387941728 /nfs/dbraw/zinc/94/17/28/387941728.db2.gz PFKPXIIYTDIFNH-DGAVXFQQSA-N 2 0 242.407 2.025 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H]2CCCCC[C@H]2[NH3+])nc1 ZINC000423160971 387941956 /nfs/dbraw/zinc/94/19/56/387941956.db2.gz IFKVNZSMZPRDKY-HUUCEWRRSA-N 2 0 247.386 2.182 20 0 BEADRP CC[C@]1(C(C)C)C[C@@H]1[NH2+]C1CC[NH2+]CC1 ZINC000423162126 387944051 /nfs/dbraw/zinc/94/40/51/387944051.db2.gz KNFSGTQRJQWPHD-QWHCGFSZSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH2+]C1CCC(C(F)F)CC1)C1C[NH2+]C1 ZINC000423164757 387947908 /nfs/dbraw/zinc/94/79/08/387947908.db2.gz ACAWVZOSSQZSEH-SILCLGDVSA-N 2 0 232.318 2.008 20 0 BEADRP CC(C)=CCC[C@@H](C)[NH2+][C@H](C)C1C[NH2+]C1 ZINC000423165965 387950851 /nfs/dbraw/zinc/95/08/51/387950851.db2.gz YOCXXKPHTVUIDI-VXGBXAGGSA-N 2 0 210.365 2.319 20 0 BEADRP C[C@@H]([NH2+]CCC1CC(F)(F)C1)[C@@H]1CCC[NH2+]1 ZINC000423167607 387951653 /nfs/dbraw/zinc/95/16/53/387951653.db2.gz SPRRMTUAEJWCEH-KOLCDFICSA-N 2 0 232.318 2.152 20 0 BEADRP COC1CCC([NH2+][C@@H](C)[C@@H]2CCCC[NH2+]2)CC1 ZINC000423172319 387958790 /nfs/dbraw/zinc/95/87/90/387958790.db2.gz SEXYCCGINHVOSS-ABXWRUBCSA-N 2 0 240.391 2.064 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H]1C[C@H]1c1ccccc1F ZINC000423172654 387959600 /nfs/dbraw/zinc/95/96/00/387959600.db2.gz UOQSJUMKBOGFFN-SCDSUCTJSA-N 2 0 236.334 2.399 20 0 BEADRP COc1ccc(Cl)cc1[C@H](C)[NH2+]CCC[NH3+] ZINC000423175596 387961332 /nfs/dbraw/zinc/96/13/32/387961332.db2.gz DYUYQRIPKZUJTM-VIFPVBQESA-N 2 0 242.750 2.348 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCC[C@H]1[NH3+])CC(F)(F)F ZINC000423175255 387962101 /nfs/dbraw/zinc/96/21/01/387962101.db2.gz DNTZOEWUBHUZGD-DJLDLDEBSA-N 2 0 224.270 2.044 20 0 BEADRP CC(C)[C@H](C)C[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000156369315 387963004 /nfs/dbraw/zinc/96/30/04/387963004.db2.gz YKSVDSMVMMQRMJ-JHJVBQTASA-N 2 0 212.381 2.351 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+][C@@H]1CCCC[C@H]1F ZINC000423180883 387965405 /nfs/dbraw/zinc/96/54/05/387965405.db2.gz KQSVPWGASAJAKJ-FDYHWXHSSA-N 2 0 228.355 2.374 20 0 BEADRP CC[C@H](C[NH2+][C@@H]1CCC[C@H]1[NH3+])CC(F)(F)F ZINC000423180934 387967285 /nfs/dbraw/zinc/96/72/85/387967285.db2.gz KXHQZNAUSOPSJG-IVZWLZJFSA-N 2 0 238.297 2.434 20 0 BEADRP COc1ccc([C@H]2C[C@@H]2[C@@H](C)[NH2+]CCC[NH3+])cc1 ZINC000423187592 387972305 /nfs/dbraw/zinc/97/23/05/387972305.db2.gz KXCASEAQHQWQJD-KCPJHIHWSA-N 2 0 248.370 2.126 20 0 BEADRP C[C@@H]([NH2+]CC1([NH3+])CCCCC1)C1CCOCC1 ZINC000423187543 387970888 /nfs/dbraw/zinc/97/08/88/387970888.db2.gz YDYJOMXLZFIVCC-GFCCVEGCSA-N 2 0 240.391 2.053 20 0 BEADRP [NH3+]CCC[NH2+][C@@H]1CCC[C@@H](c2cccnc2)C1 ZINC000423194868 387979340 /nfs/dbraw/zinc/97/93/40/387979340.db2.gz RYPLXRBIBGKWJF-TZMCWYRMSA-N 2 0 233.359 2.046 20 0 BEADRP Cc1cccc2c1[C@H](C)C[C@@H]2[NH2+]CCC[NH3+] ZINC000423196644 387981398 /nfs/dbraw/zinc/98/13/98/387981398.db2.gz VTNFBDMTJPRJOR-YPMHNXCESA-N 2 0 218.344 2.482 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCCC[C@H]2[NH3+])CS1 ZINC000423189906 387972959 /nfs/dbraw/zinc/97/29/59/387972959.db2.gz RMHKHGUVWPVCQE-WRWGMCAJSA-N 2 0 228.405 2.130 20 0 BEADRP C[C@@H]([NH2+]C1CCCCC1)[C@@H]1CCCC[NH2+]1 ZINC000238375647 387974058 /nfs/dbraw/zinc/97/40/58/387974058.db2.gz SDFAWIMHEMUDAO-YPMHNXCESA-N 2 0 210.365 2.439 20 0 BEADRP C[C@@H]([NH2+]CCC[NH3+])c1ccc2ccccc2n1 ZINC000423189530 387974607 /nfs/dbraw/zinc/97/46/07/387974607.db2.gz MUHAAMUNOHQTNO-LLVKDONJSA-N 2 0 229.327 2.234 20 0 BEADRP CC(C)C[C@@H]([NH2+]CCC[NH3+])c1ccccn1 ZINC000423191748 387975242 /nfs/dbraw/zinc/97/52/42/387975242.db2.gz PEABHVQRMFTKMI-CYBMUJFWSA-N 2 0 221.348 2.107 20 0 BEADRP CC[N@H+](C)C[C@@H]1CC[NH+](CC2=CCCC2)C1 ZINC000645812119 387978242 /nfs/dbraw/zinc/97/82/42/387978242.db2.gz NLCBMWPUQYZOGV-AWEZNQCLSA-N 2 0 222.376 2.370 20 0 BEADRP CC[C@@H]1CC[C@H](C)C[C@@H]1[NH2+]CCC[NH2+]C ZINC000423201626 387988251 /nfs/dbraw/zinc/98/82/51/387988251.db2.gz PFNCVMVJSMDBDX-XQQFMLRXSA-N 2 0 212.381 2.400 20 0 BEADRP C[NH2+]CCC[NH2+]C1CCC(CSC)CC1 ZINC000423202583 387988854 /nfs/dbraw/zinc/98/88/54/387988854.db2.gz RDRKAMCYZJIMKO-UHFFFAOYSA-N 2 0 230.421 2.107 20 0 BEADRP COC[C@H]([NH2+]CC1([NH3+])CCCCCC1)C1CC1 ZINC000423202599 387988922 /nfs/dbraw/zinc/98/89/22/387988922.db2.gz REKJOFOMPTXUMY-ZDUSSCGKSA-N 2 0 240.391 2.053 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1CCc2ccc(C)cc21 ZINC000423205057 387990922 /nfs/dbraw/zinc/99/09/22/387990922.db2.gz VEVOIQWSWGNLIL-CQSZACIVSA-N 2 0 218.344 2.181 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]CCC[NH+](C)C)[C@H]1C ZINC000252087637 135082223 /nfs/dbraw/zinc/08/22/23/135082223.db2.gz DBWCMAHLRMJGQW-FRRDWIJNSA-N 2 0 212.381 2.352 20 0 BEADRP Cc1cncc([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[NH2+]C2)c1 ZINC000423206824 387992227 /nfs/dbraw/zinc/99/22/27/387992227.db2.gz CEAMMNCCHPPIBK-HZSPNIEDSA-N 2 0 247.386 2.429 20 0 BEADRP CC[C@@H]1C[C@@H](C[NH2+][C@@H]2CCCC[C@H]2[NH3+])CCO1 ZINC000424365882 387992585 /nfs/dbraw/zinc/99/25/85/387992585.db2.gz HXAXIQZJVVYTFH-REWJHTLYSA-N 2 0 240.391 2.051 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H](C)c1ccc2c(c1)CCC2 ZINC000423209056 387992768 /nfs/dbraw/zinc/99/27/68/387992768.db2.gz ZNNMHNHVNAWQIZ-LBPRGKRZSA-N 2 0 232.371 2.435 20 0 BEADRP Cc1cccc2c1[C@@H](C)C[C@H]2[NH2+]CCC[NH3+] ZINC000423196643 387982328 /nfs/dbraw/zinc/98/23/28/387982328.db2.gz VTNFBDMTJPRJOR-WCQYABFASA-N 2 0 218.344 2.482 20 0 BEADRP C[C@H]([NH2+]CCC[NH3+])c1nccc2ccccc21 ZINC000423196410 387982409 /nfs/dbraw/zinc/98/24/09/387982409.db2.gz VFMFKXARYYROJK-NSHDSACASA-N 2 0 229.327 2.234 20 0 BEADRP CCC1(C[NH2+][C@@H](C)[C@@H]2CCC[NH2+]2)CCC1 ZINC000400501361 387982708 /nfs/dbraw/zinc/98/27/08/387982708.db2.gz FZXGDQUOHJLBPU-RYUDHWBXSA-N 2 0 210.365 2.297 20 0 BEADRP C[NH2+]CCC[NH2+][C@H]1CCc2c1cccc2F ZINC000423198501 387983434 /nfs/dbraw/zinc/98/34/34/387983434.db2.gz GGAQYDBFGAPFJG-ZDUSSCGKSA-N 2 0 222.307 2.012 20 0 BEADRP CCO[C@H]1C[C@@H]([NH2+]CCC[NH2+]C)C1(CC)CC ZINC000423198088 387983630 /nfs/dbraw/zinc/98/36/30/387983630.db2.gz CZWZJNACGOBRBD-OLZOCXBDSA-N 2 0 242.407 2.169 20 0 BEADRP CCC1(CC)[C@H]([NH2+]CCC[NH2+]C)[C@@H](C)[C@@H]1OC ZINC000423197857 387983830 /nfs/dbraw/zinc/98/38/30/387983830.db2.gz BNROEMAKZHRYBN-UPJWGTAASA-N 2 0 242.407 2.025 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H](C)C1CCC(F)(F)CC1 ZINC000423199358 387986614 /nfs/dbraw/zinc/98/66/14/387986614.db2.gz JXAPWKMYEUPVOX-JTQLQIEISA-N 2 0 234.334 2.400 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H]1C[C@]1(F)c1ccccc1 ZINC000424375327 387999529 /nfs/dbraw/zinc/99/95/29/387999529.db2.gz MUJJTVOLNUKRQD-XBFCOCLRSA-N 2 0 236.334 2.341 20 0 BEADRP CCC1CC([NH2+][C@H](C)[C@@H]2CCC[NH2+]C2)C1 ZINC000423218001 387999668 /nfs/dbraw/zinc/99/96/68/387999668.db2.gz QYJLLYUGHZNOOR-CQLXCSJHSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H]1CCC[NH2+]C1)c1ccncc1 ZINC000423217707 387999721 /nfs/dbraw/zinc/99/97/21/387999721.db2.gz UJWBRUNOEVQGKW-TZMCWYRMSA-N 2 0 233.359 2.122 20 0 BEADRP CC(C)CC[C@H]([NH2+][C@@H]1CC[NH2+]C1)C1CC1 ZINC000423216997 388000415 /nfs/dbraw/zinc/00/04/15/388000415.db2.gz RCAGKLJZFRCENM-OLZOCXBDSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)c1ccncc1)[C@@H]1CCC[NH2+]C1 ZINC000423220189 388001345 /nfs/dbraw/zinc/00/13/45/388001345.db2.gz UYFYASNZVJJZNU-OUCADQQQSA-N 2 0 233.359 2.120 20 0 BEADRP C[C@@H]([NH2+]CC[C@H](C)[NH3+])c1ccc2c(c1)COC2 ZINC000423223940 388005437 /nfs/dbraw/zinc/00/54/37/388005437.db2.gz IAPRKABOMLVVGP-WDEREUQCSA-N 2 0 234.343 2.105 20 0 BEADRP CCc1nc(C)c([C@H](C)[NH2+]CC[C@H](C)[NH3+])s1 ZINC000423223640 388005464 /nfs/dbraw/zinc/00/54/64/388005464.db2.gz GZKJYBHLTUTGJE-IUCAKERBSA-N 2 0 241.404 2.402 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+]CC[C@H](C)[NH3+])s1 ZINC000423226472 388009244 /nfs/dbraw/zinc/00/92/44/388009244.db2.gz QVYJKVFJAHIDNR-WCBMZHEXSA-N 2 0 212.362 2.444 20 0 BEADRP COc1ccc([C@@H](C)[NH2+]CC[C@H](C)[NH3+])c(C)c1 ZINC000423227447 388010728 /nfs/dbraw/zinc/01/07/28/388010728.db2.gz VVXFNZDJCQMGNV-NWDGAFQWSA-N 2 0 236.359 2.392 20 0 BEADRP CCc1cc(N[C@@H]2CCC[C@H]([NH+](C)C)C2)cc[nH+]1 ZINC000450368991 387996758 /nfs/dbraw/zinc/99/67/58/387996758.db2.gz LPEXCJGFHAZWDH-HIFRSBDPSA-N 2 0 247.386 2.351 20 0 BEADRP c1cc2c(o1)CCC[C@H]2[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000423241111 388025030 /nfs/dbraw/zinc/02/50/30/388025030.db2.gz DBBSIJVMQSGEJB-DGCLKSJQSA-N 2 0 234.343 2.246 20 0 BEADRP C[C@@H]1CC(C)(C)C[C@@H]1[NH2+]C[C@@H]1CCC[NH2+]1 ZINC000423243449 388025660 /nfs/dbraw/zinc/02/56/60/388025660.db2.gz WNMNJRBDSQDEOT-WOPDTQHZSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)C[C@H]([NH2+]CC[C@H](C)[NH3+])c1ccccn1 ZINC000423226810 388011460 /nfs/dbraw/zinc/01/14/60/388011460.db2.gz SKSOUGXHAHKHAL-JSGCOSHPSA-N 2 0 235.375 2.496 20 0 BEADRP C[C@H]([NH3+])CC[NH2+]C1CCC(C(F)F)CC1 ZINC000423227085 388011994 /nfs/dbraw/zinc/01/19/94/388011994.db2.gz UKVWSSXBHDKTRO-IDKOKCKLSA-N 2 0 220.307 2.137 20 0 BEADRP CCC[C@H]([NH2+]CC[C@H](C)[NH3+])c1cccnc1 ZINC000423226948 388012038 /nfs/dbraw/zinc/01/20/38/388012038.db2.gz SWYCQESDJDFLCR-AAEUAGOBSA-N 2 0 221.348 2.250 20 0 BEADRP COc1ccc([C@@H](C)[NH2+]CC[C@H](C)[NH3+])c(F)c1 ZINC000423229472 388014865 /nfs/dbraw/zinc/01/48/65/388014865.db2.gz HDVZIFFOZVWJEZ-VHSXEESVSA-N 2 0 240.322 2.222 20 0 BEADRP CC[C@H]([NH2+]CC[C@H](C)[NH3+])c1ccc(OC)cc1 ZINC000423230087 388015418 /nfs/dbraw/zinc/01/54/18/388015418.db2.gz INNRLAJESHGCAE-FZMZJTMJSA-N 2 0 236.359 2.473 20 0 BEADRP CC(C)(C)[C@@H]1CC[C@H]1[NH2+]C[C@H]1CCC[NH2+]1 ZINC000423231146 388016533 /nfs/dbraw/zinc/01/65/33/388016533.db2.gz FUJKJUGEEOHOPV-IJLUTSLNSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@H]1CCc2ccccc21 ZINC000423236162 388021247 /nfs/dbraw/zinc/02/12/47/388021247.db2.gz RPSPRASMLWZZCJ-GWCFXTLKSA-N 2 0 204.317 2.001 20 0 BEADRP CCOc1ccccc1[C@H](C)[NH2+]CC[C@H](C)[NH3+] ZINC000423235754 388021287 /nfs/dbraw/zinc/02/12/87/388021287.db2.gz RLRXEKVPYUZGHF-RYUDHWBXSA-N 2 0 236.359 2.473 20 0 BEADRP COc1ccc2c(c1)CCC[C@H]2[NH2+]CC[C@H](C)[NH3+] ZINC000423238490 388022373 /nfs/dbraw/zinc/02/23/73/388022373.db2.gz VEYRPILJMXKZMV-XHDPSFHLSA-N 2 0 248.370 2.400 20 0 BEADRP C[C@H](CC[NH3+])[NH2+]Cc1ccccc1Cl ZINC000066147943 388023319 /nfs/dbraw/zinc/02/33/19/388023319.db2.gz BJAUEFKAXSWKPX-SECBINFHSA-N 2 0 212.724 2.167 20 0 BEADRP COc1cccc([C@H](C)[NH2+]CC[C@H]2CC[NH2+]C2)c1 ZINC000423250183 388032074 /nfs/dbraw/zinc/03/20/74/388032074.db2.gz PYCGCZCLLANNOM-QWHCGFSZSA-N 2 0 248.370 2.345 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1ccccc1F ZINC000423253797 388035040 /nfs/dbraw/zinc/03/50/40/388035040.db2.gz WIGWCJZQKSHGGK-NWDGAFQWSA-N 2 0 236.334 2.476 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1ccc(F)cc1 ZINC000423254481 388035864 /nfs/dbraw/zinc/03/58/64/388035864.db2.gz YEDLXQUPHUOGNP-NWDGAFQWSA-N 2 0 236.334 2.476 20 0 BEADRP CC[C@H]([NH2+]C[C@@H](C)C[NH2+]C)[C@H]1CC1(C)C ZINC000423255732 388036906 /nfs/dbraw/zinc/03/69/06/388036906.db2.gz APZNKWMKLRQBJB-TUAOUCFPSA-N 2 0 212.381 2.256 20 0 BEADRP C(C[C@H]1CC[NH2+]C1)[NH2+][C@@H]1CC[C@H]1C1CCC1 ZINC000423254657 388037404 /nfs/dbraw/zinc/03/74/04/388037404.db2.gz ZAUPHIXDTWQPGL-KWCYVHTRSA-N 2 0 222.376 2.154 20 0 BEADRP Cc1ccc([C@H](C)[NH2+]CC[C@H]2CC[NH2+]C2)o1 ZINC000423254669 388037661 /nfs/dbraw/zinc/03/76/61/388037661.db2.gz ZBZPXVPZPMOUID-NWDGAFQWSA-N 2 0 222.332 2.238 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H](C)C[NH+]1CCCC1)C1CC1 ZINC000083056514 388044477 /nfs/dbraw/zinc/04/44/77/388044477.db2.gz GOIMDCYUHFDILZ-TZMCWYRMSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCC[NH2+]C1)C(C)(C)C ZINC000423261916 388039904 /nfs/dbraw/zinc/03/99/04/388039904.db2.gz TYAZJGGPCBPWBW-NWDGAFQWSA-N 2 0 212.381 2.400 20 0 BEADRP CC[C@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)C(C)C ZINC000423262350 388040519 /nfs/dbraw/zinc/04/05/19/388040519.db2.gz VFKHJWBSQBVRKL-STQMWFEESA-N 2 0 212.381 2.400 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@@H]1c2ccccc2C[C@@H]1C ZINC000423264523 388042094 /nfs/dbraw/zinc/04/20/94/388042094.db2.gz CDXDHYJCRURPRR-GLQYFDAESA-N 2 0 232.371 2.493 20 0 BEADRP C[C@@H]1CCC[C@@H](C)C1[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000423244576 388027445 /nfs/dbraw/zinc/02/74/45/388027445.db2.gz HSZZMKPQCRKERY-UPJWGTAASA-N 2 0 224.392 2.400 20 0 BEADRP CC[C@@H]([NH2+]C[C@H](C)C[NH2+]C)C1CCCC1 ZINC000423266188 388044181 /nfs/dbraw/zinc/04/41/81/388044181.db2.gz CYYDSEWFJDRZNZ-DGCLKSJQSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H]1CCC[C@H](C)[C@H]1[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000423244574 388028214 /nfs/dbraw/zinc/02/82/14/388028214.db2.gz HSZZMKPQCRKERY-RFQIPJPRSA-N 2 0 224.392 2.400 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+][C@H]1[C@H](C)CCC[C@@H]1C ZINC000423271722 388050876 /nfs/dbraw/zinc/05/08/76/388050876.db2.gz JEYSCWWEGDMDEI-QNWHQSFQSA-N 2 0 212.381 2.384 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H](C)c1ccsc1 ZINC000423273921 388052533 /nfs/dbraw/zinc/05/25/33/388052533.db2.gz LMIBAPPWPBQCBS-NXEZZACHSA-N 2 0 212.362 2.254 20 0 BEADRP CCc1cccnc1[C@H](C)[NH2+]CCCC[NH3+] ZINC000423325172 388053397 /nfs/dbraw/zinc/05/33/97/388053397.db2.gz LEAFNRFXQZMJFY-NSHDSACASA-N 2 0 221.348 2.034 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H](C)c1ccsc1 ZINC000423273922 388053675 /nfs/dbraw/zinc/05/36/75/388053675.db2.gz LMIBAPPWPBQCBS-UWVGGRQHSA-N 2 0 212.362 2.254 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CC[NH2+]C1CCCCCC1 ZINC000423275010 388055528 /nfs/dbraw/zinc/05/55/28/388055528.db2.gz LGZBCVLHZLXMGE-CYBMUJFWSA-N 3 0 241.423 2.016 20 0 BEADRP CCC1CC([NH2+][C@H]2CCCC[C@H]2C[NH3+])C1 ZINC000423277795 388059131 /nfs/dbraw/zinc/05/91/31/388059131.db2.gz OSSYDZKVWVZAKJ-MVKMKZAISA-N 2 0 210.365 2.282 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H]1CCc2ccccc21 ZINC000423280974 388062393 /nfs/dbraw/zinc/06/23/93/388062393.db2.gz VDDNNUPBQLODLY-BXUZGUMPSA-N 2 0 218.344 2.119 20 0 BEADRP C[N@H+](CCc1ccccc1)CC(C)(C)C[NH3+] ZINC000083852818 388063320 /nfs/dbraw/zinc/06/33/20/388063320.db2.gz TYGUKLIXAAHSAR-UHFFFAOYSA-N 2 0 220.360 2.146 20 0 BEADRP Cc1cc([C@@H](C)[NH2+]CC[C@@H]2CCC[NH2+]C2)no1 ZINC000423281919 388063610 /nfs/dbraw/zinc/06/36/10/388063610.db2.gz VYXRFMSLRYITPO-NEPJUHHUSA-N 2 0 237.347 2.023 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H]1CCc2c1cccc2F ZINC000423282054 388063622 /nfs/dbraw/zinc/06/36/22/388063622.db2.gz WHQCHIPEHUSWLJ-QMTHXVAHSA-N 2 0 236.334 2.258 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H]1CCc2c1cccc2F ZINC000423282055 388063639 /nfs/dbraw/zinc/06/36/39/388063639.db2.gz WHQCHIPEHUSWLJ-YGRLFVJLSA-N 2 0 236.334 2.258 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+][C@H]1CCC12CCCC2 ZINC000423281150 388063935 /nfs/dbraw/zinc/06/39/35/388063935.db2.gz UZDOQVGEMVPQSY-RYUDHWBXSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@@H]1CCC12CCCC2 ZINC000423281151 388064332 /nfs/dbraw/zinc/06/43/32/388064332.db2.gz UZDOQVGEMVPQSY-VXGBXAGGSA-N 2 0 210.365 2.282 20 0 BEADRP FCC[C@@H]1CCC[C@@H]1[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000423283617 388065470 /nfs/dbraw/zinc/06/54/70/388065470.db2.gz XPQHXWPVUOVYJQ-IHRRRGAJSA-N 2 0 242.382 2.494 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCCC[N@H+](C)C2CC2)[C@@H](C)O1 ZINC000453389445 388067901 /nfs/dbraw/zinc/06/79/01/388067901.db2.gz CKGXFVVMLJCCNM-BZPMIXESSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+][C@H]1CC=CCC1 ZINC000084066789 388070797 /nfs/dbraw/zinc/07/07/97/388070797.db2.gz XEADMHTWLUHBPI-MQYQWHSLSA-N 2 0 222.376 2.413 20 0 BEADRP CCCCO[C@H]1C[C@H]([NH2+]CC(C)(C)[NH3+])C1(C)C ZINC000423286398 388070914 /nfs/dbraw/zinc/07/09/14/388070914.db2.gz GZHYSRACNQBIMQ-RYUDHWBXSA-N 2 0 242.407 2.297 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCCC[N@H+](C)C2CC2)[C@H]1C ZINC000453396860 388071367 /nfs/dbraw/zinc/07/13/67/388071367.db2.gz IWWWADXJWPERAL-MBNYWOFBSA-N 2 0 224.392 2.495 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+]Cc1ccccc1 ZINC000084215451 388073440 /nfs/dbraw/zinc/07/34/40/388073440.db2.gz AQVMHPUPDGCRMP-ZIAGYGMSSA-N 2 0 218.344 2.294 20 0 BEADRP CCO[C@H]1C[C@H]([NH2+]CC(C)(C)[NH3+])C12CCCC2 ZINC000423289595 388074185 /nfs/dbraw/zinc/07/41/85/388074185.db2.gz XUQKDOFLRKUHPN-RYUDHWBXSA-N 2 0 240.391 2.051 20 0 BEADRP CCC([NH3+])(CC)CN[C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000423290025 388074417 /nfs/dbraw/zinc/07/44/17/388074417.db2.gz CABLLSCIVSBMSA-KGLIPLIRSA-N 2 0 247.386 2.238 20 0 BEADRP CC(C)CO[C@@H]1C[C@H]([NH2+]CC(C)(C)[NH3+])C1(C)C ZINC000423290370 388075020 /nfs/dbraw/zinc/07/50/20/388075020.db2.gz ZVPBVTYNUZSPEP-NWDGAFQWSA-N 2 0 242.407 2.153 20 0 BEADRP COC(C)(C)[C@H](C)[NH2+]CCCC[N@H+](C)C1CC1 ZINC000453410039 388077124 /nfs/dbraw/zinc/07/71/24/388077124.db2.gz UQKNKPDNCKFMLQ-LBPRGKRZSA-N 2 0 242.407 2.264 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H](C)c1ccc2c(c1)CCC2 ZINC000423294445 388077753 /nfs/dbraw/zinc/07/77/53/388077753.db2.gz BYUKXNVXSJSLGB-VXGBXAGGSA-N 2 0 232.371 2.421 20 0 BEADRP CO[C@H](C)[C@@H](C)[NH2+]Cc1ccc([C@H](C)[NH3+])cc1 ZINC000423296450 388078158 /nfs/dbraw/zinc/07/81/58/388078158.db2.gz ZGNPQJFNZNEWLP-QJPTWQEYSA-N 2 0 236.359 2.219 20 0 BEADRP C[C@H]([NH3+])c1ccc(C[NH2+]C2CCC(O)CC2)cc1 ZINC000423296353 388078337 /nfs/dbraw/zinc/07/83/37/388078337.db2.gz YXOXEJWHQZQNIX-QGLTVNCISA-N 2 0 248.370 2.099 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H](C)c1cc(F)cc(F)c1 ZINC000423296660 388078897 /nfs/dbraw/zinc/07/88/97/388078897.db2.gz HGZUQJIRCQPNRD-BDAKNGLRSA-N 2 0 228.286 2.210 20 0 BEADRP CCC[C@H]([NH2+]C[C@@H](C)C[NH3+])c1cccnc1 ZINC000423298430 388080358 /nfs/dbraw/zinc/08/03/58/388080358.db2.gz AACGURXOQKDCDV-AAEUAGOBSA-N 2 0 221.348 2.107 20 0 BEADRP Cc1csc([C@H](C)[NH2+][C@H](C)CCC[NH3+])n1 ZINC000336659884 388086750 /nfs/dbraw/zinc/08/67/50/388086750.db2.gz BPQNDKGDHDQTGQ-SCZZXKLOSA-N 2 0 227.377 2.230 20 0 BEADRP Cc1ncccc1C[NH2+]CCCC[N@@H+](C)C1CC1 ZINC000453590103 388087868 /nfs/dbraw/zinc/08/78/68/388087868.db2.gz ANFPNAWIFIFVFL-UHFFFAOYSA-N 2 0 247.386 2.354 20 0 BEADRP C[N@H+](CCCC[NH2+]Cc1ccncc1)C1CC1 ZINC000453597506 388090142 /nfs/dbraw/zinc/09/01/42/388090142.db2.gz NUTNUSCNZSAJQR-UHFFFAOYSA-N 2 0 233.359 2.046 20 0 BEADRP C[N@H+](CCCC[NH2+]C[C@H]1CCSC1)C1CC1 ZINC000453603382 388090944 /nfs/dbraw/zinc/09/09/44/388090944.db2.gz YCVJCGFCTWBYAN-GFCCVEGCSA-N 2 0 242.432 2.204 20 0 BEADRP CC(C)C[C@@H](C)[NH2+]CC1(C)CC[NH2+]CC1 ZINC000336660972 388096867 /nfs/dbraw/zinc/09/68/67/388096867.db2.gz BXMFRRHJPANTBC-GFCCVEGCSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H]1CN(c2cc[nH+]c3ccccc32)[C@@H](C)C[NH2+]1 ZINC000086471345 388103582 /nfs/dbraw/zinc/10/35/82/388103582.db2.gz MRUCMEQMCGIMFM-NEPJUHHUSA-N 2 0 241.338 2.421 20 0 BEADRP CSCCC[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000086494481 388103715 /nfs/dbraw/zinc/10/37/15/388103715.db2.gz WXTWDRARRHDWTH-XQQFMLRXSA-N 2 0 242.432 2.250 20 0 BEADRP C[C@@H](c1cccnc1)[N@H+](C)CC(C)(C)C[NH3+] ZINC000086637100 388105872 /nfs/dbraw/zinc/10/58/72/388105872.db2.gz JMHKZQPHZVUAER-NSHDSACASA-N 2 0 221.348 2.059 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CC2CC[NH2+]CC2)[C@H](C)C1 ZINC000086701229 388106689 /nfs/dbraw/zinc/10/66/89/388106689.db2.gz VMBMDUPHVVPXNB-YRGRVCCFSA-N 2 0 224.392 2.400 20 0 BEADRP C(C[NH+]1C[C@H]2CCC[C@@H]2C1)[C@@H]1CCC[NH2+]C1 ZINC000162729134 388107115 /nfs/dbraw/zinc/10/71/15/388107115.db2.gz DNFGVZUXGHICIJ-BFHYXJOUSA-N 2 0 222.376 2.108 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1c2ccccc2C[C@H]1C ZINC000423267432 388045233 /nfs/dbraw/zinc/04/52/33/388045233.db2.gz DZEGAAHELRUIEK-ZOWXZIJZSA-N 2 0 232.371 2.365 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H](C)c1ccccc1N(C)C ZINC000423267472 388045991 /nfs/dbraw/zinc/04/59/91/388045991.db2.gz FEKBXOUWFPUFOO-STQMWFEESA-N 2 0 249.402 2.259 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H](Cc1ccccc1)C1CC1 ZINC000423271206 388050118 /nfs/dbraw/zinc/05/01/18/388050118.db2.gz IRXOIACKTSVQIU-CJNGLKHVSA-N 2 0 246.398 2.453 20 0 BEADRP CCCN1CCC[C@H]1C[NH2+][C@@H]1C[C@H](C)O[C@H]1C ZINC000449322364 388172471 /nfs/dbraw/zinc/17/24/71/388172471.db2.gz XFHNTRXAPBJWRK-XDQVBPFNSA-N 2 0 240.391 2.016 20 0 BEADRP CC(C)[C@@H]([NH2+]C1CCC([NH3+])CC1)C1CC1 ZINC000324312490 388116686 /nfs/dbraw/zinc/11/66/86/388116686.db2.gz WRWGJECWUJPPRM-WXRRBKDZSA-N 2 0 210.365 2.281 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@H](C2CC2)C2CCC2)C1 ZINC000324824578 388124958 /nfs/dbraw/zinc/12/49/58/388124958.db2.gz SZEVDBNOFIJYAI-RDBSUJKOSA-N 2 0 222.376 2.425 20 0 BEADRP C[C@@H](Cc1ccoc1)[NH2+]CC(C)(C)C[NH+](C)C ZINC000449060721 388137713 /nfs/dbraw/zinc/13/77/13/388137713.db2.gz GQECQTVYSMMBDH-LBPRGKRZSA-N 2 0 238.375 2.388 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CSC[C@@H]2C)C1 ZINC000449095308 388140921 /nfs/dbraw/zinc/14/09/21/388140921.db2.gz XQSKYQIGFNPCGJ-YNEHKIRRSA-N 2 0 242.432 2.059 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H]([NH+](C)C)C2)[C@H](C)O1 ZINC000449178569 388153510 /nfs/dbraw/zinc/15/35/10/388153510.db2.gz XPNPLKVPIHHRMZ-BJJPWKGXSA-N 2 0 240.391 2.015 20 0 BEADRP CC/C=C\C[NH2+][C@@H]1CC[N@H+](CC)C[C@@H]1C ZINC000449455704 388210096 /nfs/dbraw/zinc/21/00/96/388210096.db2.gz LOSYAEYVCHLIBI-ASOISWSRSA-N 2 0 210.365 2.273 20 0 BEADRP CC(C)OC[C@@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000449560641 388232332 /nfs/dbraw/zinc/23/23/32/388232332.db2.gz NXZJSZOCIQFJRE-RLAWYHOSSA-N 2 0 240.391 2.015 20 0 BEADRP C[C@@H]1CC[N@H+](CCC(C)(C)C)C[C@@H]1C[NH3+] ZINC000164665239 388242967 /nfs/dbraw/zinc/24/29/67/388242967.db2.gz SBIHQKKKMLLHFJ-NEPJUHHUSA-N 2 0 212.381 2.339 20 0 BEADRP C[N@@H+]1CCC[C@H]1CC[NH+]1CCC(CF)CC1 ZINC000451394824 388269036 /nfs/dbraw/zinc/26/90/36/388269036.db2.gz PLTZHSRPUDAZBI-ZDUSSCGKSA-N 2 0 228.355 2.152 20 0 BEADRP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]CC1CCCCC1 ZINC000131997145 388354031 /nfs/dbraw/zinc/35/40/31/388354031.db2.gz GPLNZMMVGDJOCD-JSGCOSHPSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)[N@@H+]1CC[C@H](C[NH2+][C@@H]2CC[C@H]2C2CC2)C1 ZINC000572887574 388384379 /nfs/dbraw/zinc/38/43/79/388384379.db2.gz USSUOHFJZKCOKO-VHDGCEQUSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@H]([NH3+])[C@H]1CC[N@H+](C[C@H]2CCC(F)(F)C2)C1 ZINC000300924110 388386701 /nfs/dbraw/zinc/38/67/01/388386701.db2.gz LRFSLUTWBMJOTR-DCAQKATOSA-N 2 0 232.318 2.091 20 0 BEADRP CCOCCCC[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@@H]1C ZINC000165110969 388391429 /nfs/dbraw/zinc/39/14/29/388391429.db2.gz DMWNNKBDYCGZJE-MELADBBJSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H]1C[N@H+](C[C@@H]2CCC(F)(F)C2)CC[C@H]1[NH3+] ZINC000300785728 388393813 /nfs/dbraw/zinc/39/38/13/388393813.db2.gz BEBQREPYARJJFF-GMTAPVOTSA-N 2 0 232.318 2.091 20 0 BEADRP C[C@@H]1C[C@@H](C[NH3+])C[N@@H+]1C[C@@H]1CCC(F)(F)C1 ZINC000300799598 388394852 /nfs/dbraw/zinc/39/48/52/388394852.db2.gz CTRMBHOSIKMXJO-MXWKQRLJSA-N 2 0 232.318 2.091 20 0 BEADRP CCN(CC[NH3+])Cc1ccccc1C1CC1 ZINC000300803724 388396062 /nfs/dbraw/zinc/39/60/62/388396062.db2.gz JOLJGPKTSWRJMD-UHFFFAOYSA-N 2 0 218.344 2.345 20 0 BEADRP C[C@@H]1C[C@H]([NH3+])CC[N@@H+]1C[C@@H]1CCC(F)(F)C1 ZINC000300997948 388397792 /nfs/dbraw/zinc/39/77/92/388397792.db2.gz VHKLEWWKLKSFKN-GMTAPVOTSA-N 2 0 232.318 2.233 20 0 BEADRP Cc1ccc(CC[NH2+]C2CCC(C[NH3+])CC2)o1 ZINC000572990669 388403706 /nfs/dbraw/zinc/40/37/06/388403706.db2.gz ZSKINIPFGHIALB-UHFFFAOYSA-N 2 0 236.359 2.238 20 0 BEADRP Cc1cccnc1CC[NH2+][C@@H]1CCCC[C@@H]1C[NH3+] ZINC000405034073 388450227 /nfs/dbraw/zinc/45/02/27/388450227.db2.gz QHEGYZKHVJBSRS-UKRRQHHQSA-N 2 0 247.386 2.040 20 0 BEADRP CC[C@@H](C)[C@@H](C)[N@H+](CCC[NH2+]C)C1CC1 ZINC000336674219 388461381 /nfs/dbraw/zinc/46/13/81/388461381.db2.gz KBVBWKQULVASRN-VXGBXAGGSA-N 2 0 212.381 2.495 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H](c1ccccc1)C1CC1 ZINC000336688893 388463622 /nfs/dbraw/zinc/46/36/22/388463622.db2.gz VWUNXRXGOFEUTB-BXUZGUMPSA-N 2 0 218.344 2.322 20 0 BEADRP Cc1cccc(C[N@H+]2C[C@@H](C)[C@](C)(C[NH3+])C2)c1 ZINC000310384337 388481874 /nfs/dbraw/zinc/48/18/74/388481874.db2.gz QBFIYEGLMXMJOA-UKRRQHHQSA-N 2 0 232.371 2.412 20 0 BEADRP [NH3+]Cc1ccc(C[NH2+]C2CCCC2)cc1 ZINC000040408808 388414489 /nfs/dbraw/zinc/41/44/89/388414489.db2.gz VBDUOTYECNNCOC-UHFFFAOYSA-N 2 0 204.317 2.178 20 0 BEADRP CCc1cc(NC[C@@H](C)C[NH+](C)C)cc[nH+]1 ZINC000307817401 388427155 /nfs/dbraw/zinc/42/71/55/388427155.db2.gz NMIZXIPYEDXEOW-LLVKDONJSA-N 2 0 221.348 2.254 20 0 BEADRP CC(C)C[C@H]1CC[N@H+](CC[C@@H]2CC[NH2+]C2)C1 ZINC000307824517 388428104 /nfs/dbraw/zinc/42/81/04/388428104.db2.gz XIOYNJJQUXQFRW-UONOGXRCSA-N 2 0 224.392 2.354 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H]1CC[N@H+](CC)C1)C1CCC1 ZINC000322367549 388432740 /nfs/dbraw/zinc/43/27/40/388432740.db2.gz ILUDRGCICOCQMY-GXTWGEPZSA-N 2 0 224.392 2.497 20 0 BEADRP C/C(Cl)=C\CN1[C@@H]2CC[C@H]1CC[N@@H+](C)C2 ZINC000528508130 388537128 /nfs/dbraw/zinc/53/71/28/388537128.db2.gz LQTDRZCBVWQJKI-RGEGJOEESA-N 2 0 228.767 2.298 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@@H]([NH2+]CC2CC[NH2+]CC2)C1 ZINC000517122866 388538676 /nfs/dbraw/zinc/53/86/76/388538676.db2.gz LRJSFFWXMPJOEA-DYEKYZERSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H]([NH2+]CCC1CCCC1)[C@@H]1CCC[NH2+]1 ZINC000400668816 256795471 /nfs/dbraw/zinc/79/54/71/256795471.db2.gz UBUZJGIKZCGJPH-AAEUAGOBSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1CSC[C@@H]1[NH2+][C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000397864872 388507261 /nfs/dbraw/zinc/50/72/61/388507261.db2.gz ZPEYQIODACHKEI-HYNSBDGHSA-N 2 0 248.395 2.472 20 0 BEADRP C[C@@H]1C[C@@H](C)[NH+]1CCC[NH+]1CCCCC1 ZINC000548096655 388510902 /nfs/dbraw/zinc/51/09/02/388510902.db2.gz FFIZROGSFNYSAR-CHWSQXEVSA-N 2 0 210.365 2.345 20 0 BEADRP Cc1ccccc1C[NH2+]CC1=CC[N@H+](C)CC1 ZINC000345145916 388511314 /nfs/dbraw/zinc/51/13/14/388511314.db2.gz SPUXBCLBMADWNN-UHFFFAOYSA-N 2 0 230.355 2.347 20 0 BEADRP C[NH+](C)C[C@H]1CC[N@H+](CC2CC(C)(C)C2)C1 ZINC000528379303 388518516 /nfs/dbraw/zinc/51/85/16/388518516.db2.gz GGDOTSWMQWPLMK-GFCCVEGCSA-N 2 0 224.392 2.306 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]C[C@H]2CCC(F)(F)C2)C1 ZINC000516877924 388521593 /nfs/dbraw/zinc/52/15/93/388521593.db2.gz RAMYPWFOMRYABP-HBNTYKKESA-N 2 0 232.318 2.281 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@H](C)Cc1ccsc1 ZINC000516958067 388528256 /nfs/dbraw/zinc/52/82/56/388528256.db2.gz YNKHQQNHILPZAV-ZYHUDNBSSA-N 2 0 226.389 2.252 20 0 BEADRP CO[C@H](C[N@@H+]1CC[C@@H]([NH3+])[C@H](C)C1)c1ccccc1 ZINC000379181733 388595845 /nfs/dbraw/zinc/59/58/45/388595845.db2.gz GOZMZMXFSFDUDY-BPLDGKMQSA-N 2 0 248.370 2.043 20 0 BEADRP CC(C)[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)C1CC1 ZINC000401055231 388605307 /nfs/dbraw/zinc/60/53/07/388605307.db2.gz DIGZRSDIHXBIOA-XQLPTFJDSA-N 2 0 236.403 2.399 20 0 BEADRP C[C@@H]1C[N@H+](CC[C@H]2CCCC[NH+]2C)[C@H]1C ZINC000550307208 388605485 /nfs/dbraw/zinc/60/54/85/388605485.db2.gz RLLOCUSZKOQWCM-FRRDWIJNSA-N 2 0 210.365 2.201 20 0 BEADRP C[C@@H]1C[N@H+](CC[C@H]2CCCC[NH+]2C)[C@@H]1C ZINC000550307209 388605638 /nfs/dbraw/zinc/60/56/38/388605638.db2.gz RLLOCUSZKOQWCM-JHJVBQTASA-N 2 0 210.365 2.201 20 0 BEADRP CC(C)[C@H](C)[NH2+]Cc1cnc2n1CCCC2 ZINC000367439600 388565306 /nfs/dbraw/zinc/56/53/06/388565306.db2.gz VTXNYOYOYHVAKM-NSHDSACASA-N 2 0 221.348 2.354 20 0 BEADRP Cc1cncc([C@@H](C)[NH2+]CCN2CCCC2)c1 ZINC000184258475 388575637 /nfs/dbraw/zinc/57/56/37/388575637.db2.gz HMYMJMLJVHLKGJ-CYBMUJFWSA-N 2 0 233.359 2.136 20 0 BEADRP CCC[N@H+](C)C[C@H]1CC[NH+](CCCCOC)C1 ZINC000081571800 388584855 /nfs/dbraw/zinc/58/48/55/388584855.db2.gz ZNGSEFGLAIDATQ-CQSZACIVSA-N 2 0 242.407 2.077 20 0 BEADRP C[N@@H+]1CCC[C@@]2(CC[NH+](CC3(C)CC3)C2)C1 ZINC000552110890 388669454 /nfs/dbraw/zinc/66/94/54/388669454.db2.gz GINYSKWZYUUBTR-CQSZACIVSA-N 2 0 222.376 2.204 20 0 BEADRP CC[NH+](CC)CCC[N@@H+]1CC[C@H](C)[C@@H]1C ZINC000191804356 388670110 /nfs/dbraw/zinc/67/01/10/388670110.db2.gz DKRNZHFQAXQCHV-STQMWFEESA-N 2 0 212.381 2.449 20 0 BEADRP CC[C@@H](C)[N@@H+]1CC[C@@H](C[NH+](CC)CC)C1 ZINC000248373986 388677536 /nfs/dbraw/zinc/67/75/36/388677536.db2.gz NBMUDDKVYMFFPT-OLZOCXBDSA-N 2 0 212.381 2.449 20 0 BEADRP C[C@@H]1CCC[C@H]1[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000530176644 388621796 /nfs/dbraw/zinc/62/17/96/388621796.db2.gz DUTYDDDUOQFXQM-IJLUTSLNSA-N 2 0 208.349 2.049 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000530179167 388622201 /nfs/dbraw/zinc/62/22/01/388622201.db2.gz UVYVXXPSBXXJJZ-FRRDWIJNSA-N 2 0 222.376 2.439 20 0 BEADRP CC(C)C[C@H](C)[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000530179355 388623105 /nfs/dbraw/zinc/62/31/05/388623105.db2.gz XEDUQMXZMKZMSE-NWDGAFQWSA-N 2 0 210.365 2.295 20 0 BEADRP C([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000530212993 388627984 /nfs/dbraw/zinc/62/79/84/388627984.db2.gz TVIUHUXODJDBFN-ASWUJMJESA-N 2 0 234.387 2.295 20 0 BEADRP CC[C@@H]1C[N@H+](CC2CC(C)(C)C2)CC[C@H]1[NH3+] ZINC000530217917 388630079 /nfs/dbraw/zinc/63/00/79/388630079.db2.gz JCWDBKXJBDBPEG-CHWSQXEVSA-N 2 0 224.392 2.482 20 0 BEADRP C[C@H]([NH3+])[C@H]1CC[N@H+](CC2CC(C)(C)C2)C1 ZINC000530216404 388630511 /nfs/dbraw/zinc/63/05/11/388630511.db2.gz BHQYIMAWPYHNHG-JQWIXIFHSA-N 2 0 210.365 2.092 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CC2(CC)CC2)[C@H](C)C1 ZINC000246330059 388631159 /nfs/dbraw/zinc/63/11/59/388631159.db2.gz GAIUJVUPQZQEKY-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP [NH3+][C@H]1CCCCC[C@@H]1[NH2+]CC1CC=CC1 ZINC000530218781 388631320 /nfs/dbraw/zinc/63/13/20/388631320.db2.gz XEPGPYNNEVLWAH-STQMWFEESA-N 2 0 208.349 2.202 20 0 BEADRP C[C@H]1CC[N@H+](CC2CC(C)(C)C2)C[C@@H]1C[NH3+] ZINC000530222909 388633977 /nfs/dbraw/zinc/63/39/77/388633977.db2.gz IRNCGANPUMHQSV-AAEUAGOBSA-N 2 0 224.392 2.339 20 0 BEADRP C[C@H]1CC(F)(F)CC[N@@H+]1CC[C@H]1CCC[NH2+]C1 ZINC000530233559 388636252 /nfs/dbraw/zinc/63/62/52/388636252.db2.gz WYORXZBTEBOTBF-NWDGAFQWSA-N 2 0 246.345 2.496 20 0 BEADRP Cc1ccc(C[N@@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@@H]3C2)cc1 ZINC000261551913 388643984 /nfs/dbraw/zinc/64/39/84/388643984.db2.gz MOQZSFFIDQFTQJ-RRFJBIMHSA-N 2 0 230.355 2.164 20 0 BEADRP Cc1ccc(C[N@@H+]2C[C@@H]3CC[C@H]([NH3+])[C@H]3C2)cc1 ZINC000261551912 388644164 /nfs/dbraw/zinc/64/41/64/388644164.db2.gz MOQZSFFIDQFTQJ-KKUMJFAQSA-N 2 0 230.355 2.164 20 0 BEADRP Cc1ccc(C[N@@H+]2C[C@@H]3CC[C@H]([NH3+])[C@@H]3C2)cc1 ZINC000261551915 388644519 /nfs/dbraw/zinc/64/45/19/388644519.db2.gz MOQZSFFIDQFTQJ-ZNMIVQPWSA-N 2 0 230.355 2.164 20 0 BEADRP COCC[C@@H](C)[NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1 ZINC000247030554 388657507 /nfs/dbraw/zinc/65/75/07/388657507.db2.gz NOLJLDROLZGZEV-KGLIPLIRSA-N 2 0 242.407 2.121 20 0 BEADRP C1CC([NH2+][C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)C1 ZINC000250652510 388738332 /nfs/dbraw/zinc/73/83/32/388738332.db2.gz MRUGVJXLUDOKBZ-YNEHKIRRSA-N 2 0 208.349 2.049 20 0 BEADRP CC[C@H](C)[C@@H](C)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000251962164 388757963 /nfs/dbraw/zinc/75/79/63/388757963.db2.gz VTVODVMDYDBBOP-YNEHKIRRSA-N 2 0 212.381 2.352 20 0 BEADRP CC(C)Oc1ccc(C[NH2+][C@H](C)CC[NH3+])cc1 ZINC000066147959 388710323 /nfs/dbraw/zinc/71/03/23/388710323.db2.gz UFZKVGPTUVZZOY-GFCCVEGCSA-N 2 0 236.359 2.301 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]CCCC1CC1 ZINC000252730837 388776748 /nfs/dbraw/zinc/77/67/48/388776748.db2.gz NBLLYTJEBVIXJH-DGCLKSJQSA-N 2 0 210.365 2.106 20 0 BEADRP Cc1cc(F)ccc1CNC1CC([NH+](C)C)C1 ZINC000564226215 388790898 /nfs/dbraw/zinc/79/08/98/388790898.db2.gz QHDHDRVRYNIXDZ-UHFFFAOYSA-N 2 0 236.334 2.316 20 0 BEADRP CC[N@H+](CC1CCC1)C[C@@]1(C)CC[NH2+]C1 ZINC000230320742 388824104 /nfs/dbraw/zinc/82/41/04/388824104.db2.gz QQPCKLALTDCBNT-ZDUSSCGKSA-N 2 0 210.365 2.108 20 0 BEADRP C[NH2+]CCC[NH2+]C[C@@H]1CCCC(C)(C)C1 ZINC000565762633 388967842 /nfs/dbraw/zinc/96/78/42/388967842.db2.gz BHSHHYHBOCGAMK-GFCCVEGCSA-N 2 0 212.381 2.402 20 0 BEADRP CCCCN(C)C[C@@H](C)[NH2+][C@@H]1CCOC[C@H]1C ZINC000565510477 388950176 /nfs/dbraw/zinc/95/01/76/388950176.db2.gz FJISVXVKFYOBQT-MGPQQGTHSA-N 2 0 242.407 2.121 20 0 BEADRP COc1ccc(C[NH2+][C@H](C)C[C@H](C)[NH3+])c(C)c1 ZINC000565593362 388956054 /nfs/dbraw/zinc/95/60/54/388956054.db2.gz SRNHCQXACXKSRR-NWDGAFQWSA-N 2 0 236.359 2.219 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H](C)c1cccs1 ZINC000566088378 388986290 /nfs/dbraw/zinc/98/62/90/388986290.db2.gz YUNYXEVWJZPFTO-JTQLQIEISA-N 2 0 212.362 2.398 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+]CC1=CC[N@H+](C)CC1 ZINC000271836594 389026617 /nfs/dbraw/zinc/02/66/17/389026617.db2.gz GDKZBDAWOYJLRY-CYBMUJFWSA-N 2 0 248.370 2.452 20 0 BEADRP C[C@@H]([NH2+]CC1(C)CCCC1)[C@@H]1CCC[NH2+]1 ZINC000400422268 533355370 /nfs/dbraw/zinc/35/53/70/533355370.db2.gz XIRJLEUSBKHJRM-NEPJUHHUSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]([NH2+]CC1(C2CC2)CCC1)[C@H]1CCC[NH2+]1 ZINC000400359874 533357495 /nfs/dbraw/zinc/35/74/95/533357495.db2.gz PVOWQWDQDRHIGG-DGCLKSJQSA-N 2 0 222.376 2.297 20 0 BEADRP C(C[N@@H+]1CC[C@@H]2C[NH2+]C[C@@H]2C1)C1CCCC1 ZINC000261560714 533364599 /nfs/dbraw/zinc/36/45/99/533364599.db2.gz AEJADTCRJHQOOG-ZIAGYGMSSA-N 2 0 222.376 2.108 20 0 BEADRP C(C[N@@H+]1CC[C@@H]2C[NH2+]C[C@H]2C1)C1CCCCC1 ZINC000261542159 533365499 /nfs/dbraw/zinc/36/54/99/533365499.db2.gz BWNRPYWBTSMEOR-CABCVRRESA-N 2 0 236.403 2.498 20 0 BEADRP C[C@@H]([NH2+]CC1CCCCC1)[C@@H]1CCC[NH2+]1 ZINC000400635439 533367674 /nfs/dbraw/zinc/36/76/74/533367674.db2.gz MREBKPCYLHAFFX-YPMHNXCESA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]([NH2+]CCC1CCCC1)[C@@H]1CCC[NH2+]1 ZINC000400668833 533374789 /nfs/dbraw/zinc/37/47/89/533374789.db2.gz UBUZJGIKZCGJPH-YPMHNXCESA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CC2CC[NH+](C3CC3)CC2)[C@@H]1C ZINC000494984519 533644486 /nfs/dbraw/zinc/64/44/86/533644486.db2.gz GBNWVUQDXINGJN-LALPHHSUSA-N 2 0 236.403 2.495 20 0 BEADRP Cc1cc(N2CCC[C@H]3C[N@H+](C)CC[C@H]32)cc[nH+]1 ZINC000277063134 132207347 /nfs/dbraw/zinc/20/73/47/132207347.db2.gz RMBXCFNPINKRPV-DZGCQCFKSA-N 2 0 245.370 2.311 20 0 BEADRP Cc1cc(N2CCC[C@H]3C[N@H+](C)CC[C@@H]32)cc[nH+]1 ZINC000277063146 132207415 /nfs/dbraw/zinc/20/74/15/132207415.db2.gz RMBXCFNPINKRPV-ZFWWWQNUSA-N 2 0 245.370 2.311 20 0 BEADRP CC[N@H+](C)C[C@@H]1CC[NH+](CC[C@@H](C)F)C1 ZINC000352003344 134034725 /nfs/dbraw/zinc/03/47/25/134034725.db2.gz LLXTYQZFSNGIHB-NEPJUHHUSA-N 2 0 216.344 2.008 20 0 BEADRP c1nc2c([nH]1)C[C@@H]([NH2+][C@@H]1CCC13CCC3)CC2 ZINC000336003072 134048154 /nfs/dbraw/zinc/04/81/54/134048154.db2.gz OTIDYXKKXMOUKO-GXFFZTMASA-N 2 0 231.343 2.189 20 0 BEADRP C[C@@H](Cc1cccs1)[NH2+][C@H]1CCC[NH2+]CC1 ZINC000168723822 134247355 /nfs/dbraw/zinc/24/73/55/134247355.db2.gz ROZVKNNGDLVYSZ-RYUDHWBXSA-N 2 0 238.400 2.411 20 0 BEADRP CC1(C)C(C[NH2+][C@@H]2CCC[NH2+]CC2)C1(C)C ZINC000168768879 134247717 /nfs/dbraw/zinc/24/77/17/134247717.db2.gz QHEASJYWGFUMKE-LLVKDONJSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H]1CCC[NH+]1CCC[N@H+]1CCC[C@@H]1C ZINC000173989130 134277519 /nfs/dbraw/zinc/27/75/19/134277519.db2.gz FVXDOWTUIMMQKR-STQMWFEESA-N 2 0 210.365 2.345 20 0 BEADRP CC[N@H+](C)C[C@H]1CC[NH+](CCC(C)C)C1 ZINC000173884809 134278550 /nfs/dbraw/zinc/27/85/50/134278550.db2.gz RKOGXESOLJSIGM-CYBMUJFWSA-N 2 0 212.381 2.306 20 0 BEADRP C[C@@H](CC[NH3+])[NH2+]Cc1cc2ccccc2o1 ZINC000220489305 134305234 /nfs/dbraw/zinc/30/52/34/134305234.db2.gz QTEYVLYNKXTLAF-JTQLQIEISA-N 2 0 218.300 2.260 20 0 BEADRP CCc1ccc(C[NH2+][C@H](C)CC[NH3+])cc1 ZINC000220516354 134309753 /nfs/dbraw/zinc/30/97/53/134309753.db2.gz XAPXJJLDMJFHBG-LLVKDONJSA-N 2 0 206.333 2.076 20 0 BEADRP C[C@H](CC[NH3+])[NH2+]Cc1ccc(F)c(Cl)c1 ZINC000220545140 134309836 /nfs/dbraw/zinc/30/98/36/134309836.db2.gz LKRQGBRVENWSQU-MRVPVSSYSA-N 2 0 230.714 2.306 20 0 BEADRP COCCC[C@@H](C)[NH2+]CCC1CC[NH+](C)CC1 ZINC000178748052 134310968 /nfs/dbraw/zinc/31/09/68/134310968.db2.gz GRYUXDHAFHITBQ-CYBMUJFWSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@@H]1CCC[C@@H](C)[N@H+](CC2CC[NH2+]CC2)C1 ZINC000178974095 134314036 /nfs/dbraw/zinc/31/40/36/134314036.db2.gz MGFOVQNMAVNECR-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CC2CCCC2)[C@@H](C)C1 ZINC000222681847 134333518 /nfs/dbraw/zinc/33/35/18/134333518.db2.gz BZYHWXRVAGGKKO-GXTWGEPZSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1ccc([C@@H](C)[N@H+](C)CCC[NH3+])cc1 ZINC000227745179 134392126 /nfs/dbraw/zinc/39/21/26/134392126.db2.gz CITFBEVLVPERFW-GFCCVEGCSA-N 2 0 206.333 2.337 20 0 BEADRP CCC1([NH2+]C[C@@H]2CC[NH2+][C@@H](C)C2)CCC1 ZINC000233053684 134558252 /nfs/dbraw/zinc/55/82/52/134558252.db2.gz FZGICLPRCLWPMV-NWDGAFQWSA-N 2 0 210.365 2.297 20 0 BEADRP Cc1c[nH+]ccc1N[C@@H](C)CC[NH+](C)C ZINC000070047259 134908189 /nfs/dbraw/zinc/90/81/89/134908189.db2.gz HLDOVEOWTNFEMV-NSHDSACASA-N 2 0 207.321 2.142 20 0 BEADRP C[C@H]1CC[C@H]([NH2+]CC2CC[NH+](C)CC2)C1 ZINC000070643696 135001532 /nfs/dbraw/zinc/00/15/32/135001532.db2.gz YVWMRLHIXNECMJ-AAEUAGOBSA-N 2 0 210.365 2.106 20 0 BEADRP Cc1c[nH+]ccc1N1CC[C@@H]2[C@@H](CCC[N@H+]2C)C1 ZINC000248675212 135019165 /nfs/dbraw/zinc/01/91/65/135019165.db2.gz XXQOSNDLFQQKDO-DZGCQCFKSA-N 2 0 245.370 2.311 20 0 BEADRP CCOC(C)(C)C[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@H]1C ZINC000249173670 135035676 /nfs/dbraw/zinc/03/56/76/135035676.db2.gz YATGETYOJXOGMW-FRRDWIJNSA-N 2 0 242.407 2.120 20 0 BEADRP CC[C@H](C)C[N@@H+]1C[C@@H]2CCC[C@H]([NH3+])[C@@H]2C1 ZINC000163663395 135038386 /nfs/dbraw/zinc/03/83/86/135038386.db2.gz VOJJTLOLMKSIDR-RVMXOQNASA-N 2 0 210.365 2.092 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)C2CCCC2)C1 ZINC000249744383 135044638 /nfs/dbraw/zinc/04/46/38/135044638.db2.gz LZAIZORQRWKKMC-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)C2CCCC2)C1 ZINC000249744386 135044855 /nfs/dbraw/zinc/04/48/55/135044855.db2.gz LZAIZORQRWKKMC-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H]2CCC(C)(C)C2)C1 ZINC000250232133 135050512 /nfs/dbraw/zinc/05/05/12/135050512.db2.gz GHOCQOSCAARFEI-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)CCC[N@@H+]1CCC[C@H]([C@H](C)[NH3+])C1 ZINC000250508843 135055677 /nfs/dbraw/zinc/05/56/77/135055677.db2.gz AVYBVBKYXPLCCL-STQMWFEESA-N 2 0 212.381 2.482 20 0 BEADRP CC(C)(C)CN1CCC[N@@H+]2CCC[C@H]2C1 ZINC000250683026 135058029 /nfs/dbraw/zinc/05/80/29/135058029.db2.gz FIXLFXYBTNPMOK-LBPRGKRZSA-N 2 0 210.365 2.203 20 0 BEADRP CC(C)[C@H](C)C[NH2+][C@@H]1CCCC[C@H]1C[NH3+] ZINC000251285189 135068163 /nfs/dbraw/zinc/06/81/63/135068163.db2.gz FDQYHCSGRCLJME-FRRDWIJNSA-N 2 0 212.381 2.386 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@@H]1CCCC[C@H]1C ZINC000252096431 135083459 /nfs/dbraw/zinc/08/34/59/135083459.db2.gz FMZIHPBZNLKUQT-JHJVBQTASA-N 2 0 212.381 2.495 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)s1 ZINC000086403900 135083536 /nfs/dbraw/zinc/08/35/36/135083536.db2.gz AOUQYENQOIZUFK-WDEREUQCSA-N 2 0 224.373 2.416 20 0 BEADRP CC[C@H](C)C[N@H+](CC)CC[C@@H]1CC[NH2+]C1 ZINC000086440264 135085283 /nfs/dbraw/zinc/08/52/83/135085283.db2.gz OALCMGZWMITPMO-STQMWFEESA-N 2 0 212.381 2.354 20 0 BEADRP C[C@@H]1CCCN(Cc2ccc(F)cc2)[C@H]1C[NH3+] ZINC000252171283 135085475 /nfs/dbraw/zinc/08/54/75/135085475.db2.gz NZAHPVGIUWLFBT-RISCZKNCSA-N 2 0 236.334 2.385 20 0 BEADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+][C@H]1C[C@@H]1C ZINC000252162519 135085933 /nfs/dbraw/zinc/08/59/33/135085933.db2.gz PZSZSXXNEMHNQU-RNJOBUHISA-N 2 0 210.365 2.295 20 0 BEADRP CCCC[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000086494230 135086279 /nfs/dbraw/zinc/08/62/79/135086279.db2.gz INRLUCPVNUWPIV-XQQFMLRXSA-N 2 0 210.365 2.297 20 0 BEADRP C1CCC([NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)C1 ZINC000086494175 135086311 /nfs/dbraw/zinc/08/63/11/135086311.db2.gz UOQKBALSUKDNER-HZSPNIEDSA-N 2 0 222.376 2.439 20 0 BEADRP C[C@@H]1CCC[N@H+](CC[C@@H]2CC[NH2+]C2)[C@H]1C ZINC000252196666 135086432 /nfs/dbraw/zinc/08/64/32/135086432.db2.gz SMNWGLPOTAGPIU-AGIUHOORSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1CCC[N@H+](CC[C@H]2CC[NH2+]C2)[C@@H]1C ZINC000252196668 135086472 /nfs/dbraw/zinc/08/64/72/135086472.db2.gz SMNWGLPOTAGPIU-JHJVBQTASA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]1CCCCC[N@@H+]1C[C@H]1CCC[NH2+]C1 ZINC000252186070 135087019 /nfs/dbraw/zinc/08/70/19/135087019.db2.gz QVQFCDZOIQMHDA-STQMWFEESA-N 2 0 210.365 2.251 20 0 BEADRP C[C@H](C[C@H]1CCC[NH2+]1)[NH2+]C1CCCCC1 ZINC000086494729 135087362 /nfs/dbraw/zinc/08/73/62/135087362.db2.gz XAXBDPOENKOGLX-DGCLKSJQSA-N 2 0 210.365 2.439 20 0 BEADRP C([NH2+][C@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1)C1CC1 ZINC000086499924 135087596 /nfs/dbraw/zinc/08/75/96/135087596.db2.gz YQHOUZQDMVWJLZ-MJBXVCDLSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000252219229 135087821 /nfs/dbraw/zinc/08/78/21/135087821.db2.gz YOQHIUQNLZTACV-JWURUJNWSA-N 2 0 222.376 2.390 20 0 BEADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]CC1CC1 ZINC000086500508 135088252 /nfs/dbraw/zinc/08/82/52/135088252.db2.gz CHHJNZBQEZVYRN-YPMHNXCESA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]CC1CC1 ZINC000086500507 135088318 /nfs/dbraw/zinc/08/83/18/135088318.db2.gz CHHJNZBQEZVYRN-AAEUAGOBSA-N 2 0 210.365 2.297 20 0 BEADRP Oc1ccc(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)cc1 ZINC000252675203 135095408 /nfs/dbraw/zinc/09/54/08/135095408.db2.gz YBWMVOTYQJDMMG-KGLIPLIRSA-N 2 0 246.354 2.109 20 0 BEADRP C[C@@H]1C[N@H+](CCCCC(F)(F)F)CC[C@H]1[NH3+] ZINC000252706898 135097977 /nfs/dbraw/zinc/09/79/77/135097977.db2.gz VLNOUDCBJMRPLB-NXEZZACHSA-N 2 0 238.297 2.388 20 0 BEADRP C[C@H]1C[N@H+](CCCCC(F)(F)F)CC[C@H]1[NH3+] ZINC000252706899 135098117 /nfs/dbraw/zinc/09/81/17/135098117.db2.gz VLNOUDCBJMRPLB-VHSXEESVSA-N 2 0 238.297 2.388 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]CCc1ccsc1 ZINC000252713462 135100021 /nfs/dbraw/zinc/10/00/21/135100021.db2.gz PFBQWHJAOVUXTE-DGCLKSJQSA-N 2 0 238.400 2.220 20 0 BEADRP CC1CC([NH2+][C@@H]2C[C@@H](C)[N@H+](C)C[C@H]2C)C1 ZINC000252728834 135103454 /nfs/dbraw/zinc/10/34/54/135103454.db2.gz CZKKEYFJCCWXLD-MICYEWLZSA-N 2 0 210.365 2.103 20 0 BEADRP CCCCC[N@@H+]1C[C@@H]2CCC[C@H]([NH3+])[C@H]2C1 ZINC000252838324 135111663 /nfs/dbraw/zinc/11/16/63/135111663.db2.gz AGNNIWCLQKYANJ-AVGNSLFASA-N 2 0 210.365 2.236 20 0 BEADRP Cc1ccc([C@H](C)[NH2+]CCC[NH3+])cc1F ZINC000087284269 135117310 /nfs/dbraw/zinc/11/73/10/135117310.db2.gz DGXZCCUTAXJLNH-JTQLQIEISA-N 2 0 210.296 2.134 20 0 BEADRP CCC[C@H](O)C[NH2+][C@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000253009824 135119635 /nfs/dbraw/zinc/11/96/35/135119635.db2.gz BAPHXZMXAWXCAQ-MCIONIFRSA-N 2 0 242.407 2.048 20 0 BEADRP Cc1ccsc1C[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000087309992 135122228 /nfs/dbraw/zinc/12/22/28/135122228.db2.gz UZPMKFJIHFCMHK-NSHDSACASA-N 2 0 224.373 2.146 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CC[C@H]2CCC[NH2+]C2)C1 ZINC000253290150 135126283 /nfs/dbraw/zinc/12/62/83/135126283.db2.gz PNJMXLHMDUPUEO-JHJVBQTASA-N 2 0 210.365 2.154 20 0 BEADRP CCCCC[NH+]1CCC([C@H]2CC[NH2+]C2)CC1 ZINC000259138992 135137559 /nfs/dbraw/zinc/13/75/59/135137559.db2.gz DLXUUXJOVPXOJQ-AWEZNQCLSA-N 2 0 224.392 2.498 20 0 BEADRP CC(C)(C)[C@H]1CCC[N@@H+]1C[C@@H]1CCC[NH2+]C1 ZINC000257782415 135142013 /nfs/dbraw/zinc/14/20/13/135142013.db2.gz QLPVATVGLHXTPK-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@H](C)[NH+]1CCC([C@H]2CC[NH2+]C2)CC1 ZINC000259321270 135142660 /nfs/dbraw/zinc/14/26/60/135142660.db2.gz QUNYTQYOVSDZED-AAEUAGOBSA-N 2 0 210.365 2.106 20 0 BEADRP C[NH2+]CCCN(C)[C@H](C)c1ccc(F)cc1 ZINC000087472203 135142931 /nfs/dbraw/zinc/14/29/31/135142931.db2.gz CFBHNOFPISDGDM-LLVKDONJSA-N 2 0 224.323 2.428 20 0 BEADRP C[C@@H](c1ccccc1)N1C[C@@H](C)[C@H]([NH3+])C1 ZINC000261529508 135155750 /nfs/dbraw/zinc/15/57/50/135155750.db2.gz AWGQZEVMUZELRF-NTZNESFSSA-N 2 0 204.317 2.027 20 0 BEADRP CCC[N@H+](C[C@H]1CC[NH2+][C@H](C)C1)C1CC1 ZINC000261531467 135160514 /nfs/dbraw/zinc/16/05/14/135160514.db2.gz GPNZLNQFZJBTSS-NEPJUHHUSA-N 2 0 210.365 2.249 20 0 BEADRP CC1(C)CC[C@H]1[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000261531566 135160696 /nfs/dbraw/zinc/16/06/96/135160696.db2.gz HAZUMUGSLKMAEA-NWDGAFQWSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000087646034 135161396 /nfs/dbraw/zinc/16/13/96/135161396.db2.gz JUXZVNCDYBRTCN-UPJWGTAASA-N 2 0 210.365 2.154 20 0 BEADRP CC(C)(C)CC[NH2+][C@@H]1CC[NH2+]CC1(C)C ZINC000261531855 135161663 /nfs/dbraw/zinc/16/16/63/135161663.db2.gz IBNMQQXKXZGCHV-LLVKDONJSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[NH2+]C[C@H]1C)c1ccsc1 ZINC000261532225 135162897 /nfs/dbraw/zinc/16/28/97/135162897.db2.gz JRYRWXZGJWXDDE-JFGNBEQYSA-N 2 0 224.373 2.397 20 0 BEADRP C[C@@H]1CC[C@H](C)[N@H+](C[C@H]2CC[NH2+][C@@H](C)C2)C1 ZINC000261532752 135163606 /nfs/dbraw/zinc/16/36/06/135163606.db2.gz DWKNIUVZVJBHKL-RFGFWPKPSA-N 2 0 224.392 2.495 20 0 BEADRP CC[C@@H]1CCC[C@@H]([NH2+]C[C@H]2CCC[NH2+]2)C1 ZINC000261533592 135165271 /nfs/dbraw/zinc/16/52/71/135165271.db2.gz LAIOAKFFYIYTPX-JHJVBQTASA-N 2 0 210.365 2.297 20 0 BEADRP Cc1cccc(CN2C[C@@H](C)[C@H]([NH3+])C2)c1C ZINC000261534301 135167284 /nfs/dbraw/zinc/16/72/84/135167284.db2.gz PQMXPQAQYXAQCW-BXUZGUMPSA-N 2 0 218.344 2.082 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]CC1(C2CC2)CC1 ZINC000261535020 135168989 /nfs/dbraw/zinc/16/89/89/135168989.db2.gz VSPMZFKYJCZFRG-WCQYABFASA-N 2 0 222.376 2.284 20 0 BEADRP CC1(C)CCC(C[NH2+][C@H]2CC[NH2+]C2)CC1 ZINC000261537168 135174156 /nfs/dbraw/zinc/17/41/56/135174156.db2.gz VBJNUZTYXWOJDD-LBPRGKRZSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1CCCC[N@H+](C[C@H]2CCC[NH2+]C2)C1 ZINC000261539320 135177795 /nfs/dbraw/zinc/17/77/95/135177795.db2.gz CCRCMMGMJILHSB-OLZOCXBDSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@H]1CN(Cc2ccc(C3CC3)cc2)C[C@H]1[NH3+] ZINC000261539763 135178729 /nfs/dbraw/zinc/17/87/29/135178729.db2.gz BMMLDUQNORJTDE-XHDPSFHLSA-N 2 0 230.355 2.343 20 0 BEADRP C[C@@H]1CN(c2cc[nH+]c3ccccc32)C[C@H]1[NH3+] ZINC000261540279 135179380 /nfs/dbraw/zinc/17/93/80/135179380.db2.gz FOEYTZBFVYKWDI-ZYHUDNBSSA-N 2 0 227.311 2.018 20 0 BEADRP C[C@@H]1C[C@H](C[NH+](CC2CC2)CC2CC2)CC[NH2+]1 ZINC000261541922 135181734 /nfs/dbraw/zinc/18/17/34/135181734.db2.gz MOOKYWPFFGTPOI-IUODEOHRSA-N 2 0 236.403 2.497 20 0 BEADRP CC[N@H+](C[C@@H]1C[C@H]1C)[C@@H]1CCC[NH2+]CC1 ZINC000261542623 135183124 /nfs/dbraw/zinc/18/31/24/135183124.db2.gz GZMNZXBCCRRDJE-FRRDWIJNSA-N 2 0 210.365 2.106 20 0 BEADRP CC[N@H+](C[C@@H]1C[C@@H]1C)[C@@H]1CCC[NH2+]CC1 ZINC000261542624 135183420 /nfs/dbraw/zinc/18/34/20/135183420.db2.gz GZMNZXBCCRRDJE-RWMBFGLXSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1CC[C@@H]([N@H+](C)C[C@@]2(C)CC[NH2+]C2)C1 ZINC000261552341 135191165 /nfs/dbraw/zinc/19/11/65/135191165.db2.gz RDFBAFBXKNMERM-UPJWGTAASA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H](C[N@@H+]1CC[C@](C)(C[NH3+])C1)c1ccccc1 ZINC000261553593 135192751 /nfs/dbraw/zinc/19/27/51/135192751.db2.gz OBNHSEOTJIGQMB-UKRRQHHQSA-N 2 0 232.371 2.461 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]CC1CCCCC1 ZINC000084218730 135193297 /nfs/dbraw/zinc/19/32/97/135193297.db2.gz HAWQQMUODBFYJD-STQMWFEESA-N 2 0 210.365 2.284 20 0 BEADRP [NH3+]C1CCC([NH2+][C@H]2CC3CCC2CC3)CC1 ZINC000261558336 135199066 /nfs/dbraw/zinc/19/90/66/135199066.db2.gz YDKDLIQLFVTAEI-JVUSGKFHSA-N 2 0 222.376 2.425 20 0 BEADRP [NH3+]C1CCC([NH2+][C@@H]2CC3CCC2CC3)CC1 ZINC000261558335 135199075 /nfs/dbraw/zinc/19/90/75/135199075.db2.gz YDKDLIQLFVTAEI-GKJRHCAVSA-N 2 0 222.376 2.425 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[NH2+]C[C@H]1C)c1ccc(F)cc1 ZINC000261558431 135199306 /nfs/dbraw/zinc/19/93/06/135199306.db2.gz SJMSFSURCXEBPR-SUNKGSAMSA-N 2 0 236.334 2.474 20 0 BEADRP Cc1cccc(C[N@@H+]2CC[C@@H]3C[NH2+]C[C@@H]3C2)c1 ZINC000261561384 135202560 /nfs/dbraw/zinc/20/25/60/135202560.db2.gz VHFYVHGZICLGLM-HUUCEWRRSA-N 2 0 230.355 2.036 20 0 BEADRP C[C@H](c1ccccc1)[N@@H+]1C[C@@H]2CC[C@@H]([NH3+])[C@@H]2C1 ZINC000261562946 135204984 /nfs/dbraw/zinc/20/49/84/135204984.db2.gz WSZJTFIYZKVUHL-FAAHXZRKSA-N 2 0 230.355 2.417 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]1[NH2+]Cc1cccc(F)c1 ZINC000261562945 135205094 /nfs/dbraw/zinc/20/50/94/135205094.db2.gz WSVOOXALSWVKDT-ZDUSSCGKSA-N 2 0 236.334 2.303 20 0 BEADRP C[C@H]1C[C@@H](c2ccccc2F)N(CC[NH3+])C1 ZINC000261563797 135205284 /nfs/dbraw/zinc/20/52/84/135205284.db2.gz BZXIJBHHBIFYKN-GWCFXTLKSA-N 2 0 222.307 2.167 20 0 BEADRP Cc1cccc(C[NH2+][C@@H]2CC[NH2+]CC2(C)C)c1 ZINC000261564145 135206225 /nfs/dbraw/zinc/20/62/25/135206225.db2.gz XNCHYNQJSSRABR-CQSZACIVSA-N 2 0 232.371 2.473 20 0 BEADRP Cc1ccc(F)cc1C[N@@H+]1C[C@@H]2CC[C@@H]([NH3+])[C@@H]2C1 ZINC000261564736 135206749 /nfs/dbraw/zinc/20/67/49/135206749.db2.gz HLFFRXGXANSTNY-NILFDRSVSA-N 2 0 248.345 2.303 20 0 BEADRP Cc1cc(C)cc(C[N@@H+]2CC[C@@H]3C[NH2+]C[C@H]3C2)c1 ZINC000261564766 135207263 /nfs/dbraw/zinc/20/72/63/135207263.db2.gz HMOSLOKVLKLPNH-CVEARBPZSA-N 2 0 244.382 2.345 20 0 BEADRP Cc1ccccc1C[N@@H+]1C[C@@H]2CC[C@H]([NH3+])[C@@H]2C1 ZINC000261566585 135208905 /nfs/dbraw/zinc/20/89/05/135208905.db2.gz ZDDYZVFSBJPZBM-ZNMIVQPWSA-N 2 0 230.355 2.164 20 0 BEADRP C[C@H]1CCC[C@H](C[NH+]2CCC([NH3+])CC2)C1 ZINC000084344410 135210056 /nfs/dbraw/zinc/21/00/56/135210056.db2.gz XZOHCXNNXJSUOL-RYUDHWBXSA-N 2 0 210.365 2.236 20 0 BEADRP Cc1[nH+]ccc(N2CCC[C@H](C[NH3+])C2)c1Cl ZINC000261568752 135210490 /nfs/dbraw/zinc/21/04/90/135210490.db2.gz FVKHQKFDQCUPFE-SNVBAGLBSA-N 2 0 239.750 2.219 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](CC2CCCCCC2)C1 ZINC000084329944 135211412 /nfs/dbraw/zinc/21/14/12/135211412.db2.gz WMZGVHCKQCBDFF-AWEZNQCLSA-N 2 0 224.392 2.498 20 0 BEADRP CCSCCC[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000164012604 135211924 /nfs/dbraw/zinc/21/19/24/135211924.db2.gz KMJVVIQMIYHQLA-CHWSQXEVSA-N 2 0 242.432 2.346 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@@H]3[NH2+]CC[C@@H]3C2)cc1C ZINC000261572166 135213944 /nfs/dbraw/zinc/21/39/44/135213944.db2.gz LMSLJIOOTXITCN-CVEARBPZSA-N 2 0 244.382 2.487 20 0 BEADRP CC1(C)C[N@H+](CC[C@@H]2CCC[NH2+]C2)CCS1 ZINC000164180542 135214368 /nfs/dbraw/zinc/21/43/68/135214368.db2.gz RRTKNIATRDSCRD-LBPRGKRZSA-N 2 0 242.432 2.204 20 0 BEADRP Cc1ccsc1C[N@@H+]1C[C@@H]2CC[C@H]([NH3+])[C@H]2C1 ZINC000261575055 135216482 /nfs/dbraw/zinc/21/64/82/135216482.db2.gz JOKGIOXCQFFCGS-SRVKXCTJSA-N 2 0 236.384 2.226 20 0 BEADRP Cc1ccc(C[N@@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@@H]3C2)cc1F ZINC000261575513 135216593 /nfs/dbraw/zinc/21/65/93/135216593.db2.gz NDJLJECDSMWMIU-GZBFAFLISA-N 2 0 248.345 2.303 20 0 BEADRP C[C@H]([NH3+])[C@H](C)[NH2+][C@@H](c1ccccc1)C1CC1 ZINC000261575861 135216666 /nfs/dbraw/zinc/21/66/66/135216666.db2.gz JYGOBQLFRJOGFS-MJVIPROJSA-N 2 0 218.344 2.463 20 0 BEADRP C[C@@H]1CCC[C@H](C)[N@H+]1CC[C@@H]1CC[NH2+]C1 ZINC000084384580 135217861 /nfs/dbraw/zinc/21/78/61/135217861.db2.gz QOJGMBZILUXYAD-XQQFMLRXSA-N 2 0 210.365 2.249 20 0 BEADRP c1cc2c(s1)CC[N@@H+](CC[C@@H]1CC[NH2+]C1)C2 ZINC000084384475 135218317 /nfs/dbraw/zinc/21/83/17/135218317.db2.gz BDLVZPQVRPNTPG-NSHDSACASA-N 2 0 236.384 2.106 20 0 BEADRP Cc1[nH+]ccc(N2C[C@H](C)[NH2+]C[C@@H]2C)c1Cl ZINC000261576983 135218462 /nfs/dbraw/zinc/21/84/62/135218462.db2.gz KSFQLJPTZAUGSC-IUCAKERBSA-N 2 0 239.750 2.230 20 0 BEADRP C[C@H]([NH3+])[C@H](C)[NH2+][C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000261578271 135219146 /nfs/dbraw/zinc/21/91/46/135219146.db2.gz LQQKZMLEMUQVKO-AXTSPUMRSA-N 2 0 238.297 2.433 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@@H]([NH3+])c3ccccc32)CCO1 ZINC000261580990 135221698 /nfs/dbraw/zinc/22/16/98/135221698.db2.gz QGVDSYPBTDDYBZ-YIKOMLBNSA-N 2 0 246.354 2.288 20 0 BEADRP [NH3+]C1(C[NH2+]CCC2CCCCC2)CCC1 ZINC000261583020 135224412 /nfs/dbraw/zinc/22/44/12/135224412.db2.gz OTRXFBMOOVFPBO-UHFFFAOYSA-N 2 0 210.365 2.428 20 0 BEADRP CC1CCC(C[NH2+][C@@H]2CC[NH2+]C[C@@H]2C)CC1 ZINC000261582808 135224425 /nfs/dbraw/zinc/22/44/25/135224425.db2.gz OSIRHHWQUXRDMM-GNRIBBGQSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H](C[N@@H+]1C[C@@H]2CC[C@H]([NH3+])[C@@H]2C1)c1ccccc1 ZINC000261585222 135225702 /nfs/dbraw/zinc/22/57/02/135225702.db2.gz SWEFSVPLJLCQKM-BVUBDWEXSA-N 2 0 244.382 2.459 20 0 BEADRP COCc1cccc(C[N@@H+]2CC[C@](C)(C[NH3+])C2)c1 ZINC000261584607 135225896 /nfs/dbraw/zinc/22/58/96/135225896.db2.gz SKNXHTFUFDLAPF-OAHLLOKOSA-N 2 0 248.370 2.004 20 0 BEADRP Cc1cc(F)ccc1C[N@@H+]1C[C@@H]2CC[C@H]([NH3+])[C@@H]2C1 ZINC000261585270 135225908 /nfs/dbraw/zinc/22/59/08/135225908.db2.gz SYCOEISHVRGNQR-CFVMTHIKSA-N 2 0 248.345 2.303 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[NH2+]C[C@@H]2C)C[C@@H]1C ZINC000261586986 135228372 /nfs/dbraw/zinc/22/83/72/135228372.db2.gz RLOLMQJTJSSXLZ-IKOXMDCHSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@@H]([NH2+]C1C2CC3CC(C2)CC1C3)[C@H](C)[NH3+] ZINC000261589031 135228930 /nfs/dbraw/zinc/22/89/30/135228930.db2.gz SUWQYLJTWHUURA-HSVUYRNNSA-N 2 0 222.376 2.136 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@@H]3C[NH2+]C[C@H]3C2)c(C)c1 ZINC000261589547 135229911 /nfs/dbraw/zinc/22/99/11/135229911.db2.gz WIULJQVIKAIZNY-ZBFHGGJFSA-N 2 0 244.382 2.345 20 0 BEADRP [NH3+][C@@H]1CC[C@H]2C[N@H+](CCC3CCCC3)C[C@@H]12 ZINC000261589700 135230326 /nfs/dbraw/zinc/23/03/26/135230326.db2.gz UCSIQIRFKKDSBG-BFHYXJOUSA-N 2 0 222.376 2.236 20 0 BEADRP C[C@@H]1C[N@H+](CC(C)(C)[NH3+])[C@H]2CCCC[C@@H]12 ZINC000261590910 135231337 /nfs/dbraw/zinc/23/13/37/135231337.db2.gz UVGLJFXHTIZQTK-WOPDTQHZSA-N 2 0 210.365 2.234 20 0 BEADRP Cc1ccsc1C[N@@H+]1CC[C@@H]2[NH2+]CC[C@H]2C1 ZINC000261592429 135232821 /nfs/dbraw/zinc/23/28/21/135232821.db2.gz VWDSRHQUJQZJNW-RYUDHWBXSA-N 2 0 236.384 2.240 20 0 BEADRP C[NH2+]CCC1CC[NH+](Cc2cccnc2C)CC1 ZINC000261594211 135234082 /nfs/dbraw/zinc/23/40/82/135234082.db2.gz ZTPYJFUNCNSHGX-UHFFFAOYSA-N 2 0 247.386 2.212 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000261598532 135236839 /nfs/dbraw/zinc/23/68/39/135236839.db2.gz ZPXBDOZDKLLUPN-RKQHYHRCSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000261598529 135237148 /nfs/dbraw/zinc/23/71/48/135237148.db2.gz ZPXBDOZDKLLUPN-PEBLQZBPSA-N 2 0 222.376 2.295 20 0 BEADRP CC[C@@H]1C[C@H](C)C[N@@H+]1C[C@H]1CCC[NH2+]C1 ZINC000261546363 135238574 /nfs/dbraw/zinc/23/85/74/135238574.db2.gz KWYUBRNJUFHSOI-RWMBFGLXSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1CCC[C@H](C[N@@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@H]3C2)C1 ZINC000261547433 135240114 /nfs/dbraw/zinc/24/01/14/135240114.db2.gz IAFVTQCAASSGGK-CAEXGNQWSA-N 2 0 236.403 2.482 20 0 BEADRP C[C@H]1CCC[C@H](CC[N@@H+]2CCC[NH2+]CC2)C1 ZINC000078806684 135243223 /nfs/dbraw/zinc/24/32/23/135243223.db2.gz WYCZOPFJAUQWGY-UONOGXRCSA-N 2 0 224.392 2.498 20 0 BEADRP CC1(C)CCC[N@H+](CC[C@H]2CC[NH2+]C2)C1 ZINC000084386043 135244557 /nfs/dbraw/zinc/24/45/57/135244557.db2.gz YDABRZQDFMNXKU-GFCCVEGCSA-N 2 0 210.365 2.108 20 0 BEADRP C(C[NH+](CC1CC1)CC1CC1)[C@H]1CC[NH2+]C1 ZINC000084386074 135244712 /nfs/dbraw/zinc/24/47/12/135244712.db2.gz OFYROMIIQPLOGR-GFCCVEGCSA-N 2 0 222.376 2.108 20 0 BEADRP Clc1ccc(C[NH2+]CC[C@@H]2CC[NH2+]C2)s1 ZINC000084386076 135244725 /nfs/dbraw/zinc/24/47/25/135244725.db2.gz SXNGYVZPUGRXHO-VIFPVBQESA-N 2 0 244.791 2.491 20 0 BEADRP C[C@H]1C[N@H+](C[C@]2(C)CC[NH2+]C2)CC(C)(C)C1 ZINC000261714637 135247424 /nfs/dbraw/zinc/24/74/24/135247424.db2.gz FBDCNGKZOCFCTC-TZMCWYRMSA-N 2 0 224.392 2.354 20 0 BEADRP CC[N@H+](C)C[C@@H]1CC[NH+](Cc2cccc(N)c2)C1 ZINC000261748579 135249886 /nfs/dbraw/zinc/24/98/86/135249886.db2.gz VYYYQCKNYHUBMZ-AWEZNQCLSA-N 2 0 247.386 2.042 20 0 BEADRP Fc1cccc2c1CN(C[C@H]1CCC[NH2+]C1)CC2 ZINC000261760800 135250892 /nfs/dbraw/zinc/25/08/92/135250892.db2.gz CZCWZCCEKBNAGN-LBPRGKRZSA-N 2 0 248.345 2.183 20 0 BEADRP Cc1cc(F)cc2c1CN(CC(C)(C)[NH3+])CC2 ZINC000261799699 135254366 /nfs/dbraw/zinc/25/43/66/135254366.db2.gz GTYAMZXCANPQKF-UHFFFAOYSA-N 2 0 236.334 2.230 20 0 BEADRP C[NH2+]C[C@H]1CCCN1Cc1ccc(C)c(OC)c1 ZINC000261802051 135254794 /nfs/dbraw/zinc/25/47/94/135254794.db2.gz HANARDJYDJUVNE-CQSZACIVSA-N 2 0 248.370 2.187 20 0 BEADRP C[C@H]1CC[N@H+](C[C@@]2(C)CC[NH2+]C2)CC12CCC2 ZINC000261917403 135262589 /nfs/dbraw/zinc/26/25/89/135262589.db2.gz ZUHBSANXONROJQ-KBPBESRZSA-N 2 0 236.403 2.498 20 0 BEADRP C[C@@H]1C[C@H]1CN(CC[NH3+])Cc1ccccc1 ZINC000261943962 135265312 /nfs/dbraw/zinc/26/53/12/135265312.db2.gz NDDYWENBQGVLOO-OCCSQVGLSA-N 2 0 218.344 2.103 20 0 BEADRP CC(C)[C@H]1CCC[N@H+](C[C@@]2(C)CC[NH2+]C2)C1 ZINC000261984035 135270030 /nfs/dbraw/zinc/27/00/30/135270030.db2.gz JMJBEQXJISNDLP-KBPBESRZSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@H]1CC[N@H+](C[C@@H]2CCC[NH2+]C2)CC12CCC2 ZINC000262012351 135272115 /nfs/dbraw/zinc/27/21/15/135272115.db2.gz VEJYUCKSNDTXOY-UONOGXRCSA-N 2 0 236.403 2.498 20 0 BEADRP C[C@]1(C[N@H+](CC2CC2)C2CCC2)CC[NH2+]C1 ZINC000262064454 135277210 /nfs/dbraw/zinc/27/72/10/135277210.db2.gz RLCBZPNZLHLUKP-AWEZNQCLSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@H]1Cc2ccccc2C[N@@H+]1C[C@]1(C)CC[NH2+]C1 ZINC000262118912 135279554 /nfs/dbraw/zinc/27/95/54/135279554.db2.gz XDZSNOYQAKZAKZ-XJKSGUPXSA-N 2 0 244.382 2.433 20 0 BEADRP CCC1CC([NH2+]CCOCC[NH+](CC)CC)C1 ZINC000342578158 135292085 /nfs/dbraw/zinc/29/20/85/135292085.db2.gz NMZOLZUENMHTFV-UHFFFAOYSA-N 2 0 242.407 2.123 20 0 BEADRP [NH3+]CCN1CCC[C@]2(CCCc3ccccc32)C1 ZINC000262990142 135325528 /nfs/dbraw/zinc/32/55/28/135325528.db2.gz NOUSLCSHYOBKIR-MRXNPFEDSA-N 2 0 244.382 2.315 20 0 BEADRP C(C1CCCCC1)[N@H+]1C[C@@H]2[NH2+]CCC[C@H]2C1 ZINC000299892913 135380783 /nfs/dbraw/zinc/38/07/83/135380783.db2.gz FSANDADYTGBVNK-KBPBESRZSA-N 2 0 222.376 2.251 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+]CC1CCCC1 ZINC000084215932 135467626 /nfs/dbraw/zinc/46/76/26/135467626.db2.gz CPAVKGZWKZYTTC-CHWSQXEVSA-N 2 0 210.365 2.284 20 0 BEADRP C[C@H]1CN(c2cc[nH+]c3ccccc32)[C@@H](C)C[NH2+]1 ZINC000086471347 135492590 /nfs/dbraw/zinc/49/25/90/135492590.db2.gz MRUCMEQMCGIMFM-RYUDHWBXSA-N 2 0 241.338 2.421 20 0 BEADRP [NH3+]C1CCC([NH2+]CCc2cccs2)CC1 ZINC000086724841 135494880 /nfs/dbraw/zinc/49/48/80/135494880.db2.gz MFWISWRRYOOJQX-UHFFFAOYSA-N 2 0 224.373 2.150 20 0 BEADRP C1=C(CC[NH2+]C2CCCCC2)CC[NH2+]C1 ZINC000231462132 135603231 /nfs/dbraw/zinc/60/32/31/135603231.db2.gz BKTSBFAMVGKSAW-UHFFFAOYSA-N 2 0 208.349 2.219 20 0 BEADRP [NH3+][C@H]1CCC[C@@H](C[NH2+]C2Cc3ccccc3C2)C1 ZINC000334851123 135823452 /nfs/dbraw/zinc/82/34/52/135823452.db2.gz ZWSFFXFLSLQNCP-DOMZBBRYSA-N 2 0 244.382 2.261 20 0 BEADRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]C1CCC2(CC2)CC1 ZINC000335007136 135864059 /nfs/dbraw/zinc/86/40/59/135864059.db2.gz FOXSRJAFCZKDQA-DGCLKSJQSA-N 2 0 222.376 2.426 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]1[NH2+]CC12CCC(CC1)C2 ZINC000335024962 135866864 /nfs/dbraw/zinc/86/68/64/135866864.db2.gz RAGZAGWQWXGWKD-ZFQMDJOTSA-N 2 0 208.349 2.036 20 0 BEADRP C[C@H]1CC([NH2+]C2CCC(C[NH3+])CC2)C[C@H](C)O1 ZINC000335037710 135870658 /nfs/dbraw/zinc/87/06/58/135870658.db2.gz FBYBOPDQQQEXFL-ZSVAQUKISA-N 2 0 240.391 2.050 20 0 BEADRP [NH3+]CC1CCC([NH2+][C@@H]2CC23CCCC3)CC1 ZINC000335012344 135877217 /nfs/dbraw/zinc/87/72/17/135877217.db2.gz YGMMNBNCRNNBHN-WXRRBKDZSA-N 2 0 222.376 2.426 20 0 BEADRP C[C@H]([NH2+]C1CCC(C)(C)CC1)C1C[NH2+]C1 ZINC000335217478 135959855 /nfs/dbraw/zinc/95/98/55/135959855.db2.gz OIFSHMBTGXLBGI-JTQLQIEISA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)(C)[NH+]1CCC([NH2+][C@H]2CC23CC3)CC1 ZINC000335281844 136000376 /nfs/dbraw/zinc/00/03/76/136000376.db2.gz ZPAMCAPWMQZCGW-LBPRGKRZSA-N 2 0 222.376 2.391 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CCc3nc[nH]c3C2)s1 ZINC000335326088 136051891 /nfs/dbraw/zinc/05/18/91/136051891.db2.gz VYAWZMAGMSGFAP-SNVBAGLBSA-N 2 0 247.367 2.427 20 0 BEADRP Cc1ccccc1C[NH2+][C@H]1CCc2nc[nH]c2C1 ZINC000335325968 136051915 /nfs/dbraw/zinc/05/19/15/136051915.db2.gz MYVRAHVCWBNZEJ-ZDUSSCGKSA-N 2 0 241.338 2.365 20 0 BEADRP FC1(CC[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)CCC1 ZINC000348336940 136075792 /nfs/dbraw/zinc/07/57/92/136075792.db2.gz SPPNAIRNRHNKEM-OLZOCXBDSA-N 2 0 240.366 2.485 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CC[C@H](F)C2)[C@H]2CCC[C@@H]21 ZINC000348391220 136076218 /nfs/dbraw/zinc/07/62/18/136076218.db2.gz HUPQOSUVPLTAOD-ZSLBOAEBSA-N 2 0 240.366 2.339 20 0 BEADRP CC1(F)CC([NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)C1 ZINC000335373833 136084660 /nfs/dbraw/zinc/08/46/60/136084660.db2.gz OHBCBYZXPSWXOA-CQLXCSJHSA-N 2 0 226.339 2.093 20 0 BEADRP CC1(F)CC([NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)C1 ZINC000335373834 136084780 /nfs/dbraw/zinc/08/47/80/136084780.db2.gz OHBCBYZXPSWXOA-GMKTYKIGSA-N 2 0 226.339 2.093 20 0 BEADRP [NH3+]CC1CCC([NH2+][C@H]2CCC[C@H](F)C2)CC1 ZINC000335386992 136089207 /nfs/dbraw/zinc/08/92/07/136089207.db2.gz ORLOLBHOGMJUNL-MVKMKZAISA-N 2 0 228.355 2.374 20 0 BEADRP Cc1cccc(OCC[NH2+][C@H]2C[C@@H]([NH3+])C2(C)C)c1 ZINC000404785182 397732889 /nfs/dbraw/zinc/73/28/89/397732889.db2.gz PHAKUQZHTAPXMQ-KGLIPLIRSA-N 2 0 248.370 2.089 20 0 BEADRP COc1cccc([C@H]2CCC[N@@H+]2CCC[NH3+])c1 ZINC000414676913 398015773 /nfs/dbraw/zinc/01/57/73/398015773.db2.gz IEHATUYDDRQZQE-CQSZACIVSA-N 2 0 234.343 2.181 20 0 BEADRP C[C@@H](C[NH2+]C1CC[NH2+]CC1)Cc1ccccc1 ZINC000414774342 398033412 /nfs/dbraw/zinc/03/34/12/398033412.db2.gz AXYAQXMEXYYVPZ-CYBMUJFWSA-N 2 0 232.371 2.207 20 0 BEADRP C[C@H](C[N@H+](C)C[C@H]1CC[NH2+]C1)c1ccccc1 ZINC000382752862 397972422 /nfs/dbraw/zinc/97/24/22/397972422.db2.gz JDZDRUHLAKLCCE-KGLIPLIRSA-N 2 0 232.371 2.331 20 0 BEADRP C(C1CCCC1)[NH+]1CCC([C@@H]2CC[NH2+]C2)CC1 ZINC000357055400 397974447 /nfs/dbraw/zinc/97/44/47/397974447.db2.gz RCKPKUPGRKIADN-OAHLLOKOSA-N 2 0 236.403 2.498 20 0 BEADRP FC1(F)CCCN(CCCn2ccnc2)C1 ZINC000649695026 398043174 /nfs/dbraw/zinc/04/31/74/398043174.db2.gz FBWCVIZOFXYMQX-UHFFFAOYSA-N 2 0 229.274 2.004 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[C@@H](C)C1)[C@@H]1CCC[NH2+]C1 ZINC000414853996 398061969 /nfs/dbraw/zinc/06/19/69/398061969.db2.gz LSHPHKKEOGPEBM-XQHKEYJVSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H](Cc1cccs1)[NH2+]CC(C)(C)[NH3+] ZINC000389332743 398076277 /nfs/dbraw/zinc/07/62/77/398076277.db2.gz VOWPWKJFHOFUGY-VIFPVBQESA-N 2 0 212.362 2.006 20 0 BEADRP CC[C@H]1CN(CCC[NH+](CC)CC)[C@@H](C)CO1 ZINC000649735588 398076453 /nfs/dbraw/zinc/07/64/53/398076453.db2.gz NIXCWSYIPYWEEO-KBPBESRZSA-N 2 0 242.407 2.218 20 0 BEADRP CCSCC[C@H](C)[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000222254272 398095453 /nfs/dbraw/zinc/09/54/53/398095453.db2.gz MNLBAAQZLANUKR-QJPTWQEYSA-N 2 0 230.421 2.378 20 0 BEADRP c1ccc2c(c1)CC([NH2+]C1C[C@H]3CC[C@@H](C1)[NH2+]3)C2 ZINC000414829720 398050982 /nfs/dbraw/zinc/05/09/82/398050982.db2.gz OAIFYOQKSOVMFK-MZBDJJRSSA-N 2 0 242.366 2.026 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]Cc1ccc(C)c(F)c1 ZINC000414829482 398051023 /nfs/dbraw/zinc/05/10/23/398051023.db2.gz BCCMPUYOCDBEAL-JTQLQIEISA-N 2 0 224.323 2.079 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]Cc1ccc(Cl)c(F)c1 ZINC000414838135 398052055 /nfs/dbraw/zinc/05/20/55/398052055.db2.gz KWWNGURCQJNYIV-VIFPVBQESA-N 2 0 244.741 2.424 20 0 BEADRP C[N@H+](Cc1ccccc1C1CC1)C1CC([NH3+])C1 ZINC000384898134 398116331 /nfs/dbraw/zinc/11/63/31/398116331.db2.gz VWKANVUICXQJPU-UHFFFAOYSA-N 2 0 230.355 2.486 20 0 BEADRP CC[C@H]([NH2+]CCC[NH+](C)C)[C@@H]1CC1(C)C ZINC000397674530 398121241 /nfs/dbraw/zinc/12/12/41/398121241.db2.gz GSHPHXDCJJDEFW-RYUDHWBXSA-N 2 0 212.381 2.352 20 0 BEADRP CC[C@H](C)[C@@H](C)[NH2+]CC1CC[NH+](C)CC1 ZINC000044515970 171364943 /nfs/dbraw/zinc/36/49/43/171364943.db2.gz CUDWZPIFDGYTFJ-NWDGAFQWSA-N 2 0 212.381 2.352 20 0 BEADRP c1cncc(C[NH2+]CCCCC[NH+]2CCCC2)c1 ZINC000293143309 398113019 /nfs/dbraw/zinc/11/30/19/398113019.db2.gz UIFARLDHQQRRKG-UHFFFAOYSA-N 2 0 247.386 2.437 20 0 BEADRP CC[C@@H]1[C@@H](C)CC[N@@H+]1CCCc1cncn1C ZINC000572012407 398129314 /nfs/dbraw/zinc/12/93/14/398129314.db2.gz ZKRQKZOHQYAYPG-GXTWGEPZSA-N 2 0 235.375 2.473 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C[C@H]2CCCS2)CC1(C)C ZINC000623445463 398130816 /nfs/dbraw/zinc/13/08/16/398130816.db2.gz RVFLHRSGGUGWMJ-NWDGAFQWSA-N 2 0 242.432 2.344 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@@H]1CC[C@H](C)SC1 ZINC000655703340 487557257 /nfs/dbraw/zinc/55/72/57/487557257.db2.gz OLHXVUAVICBKTA-GRYCIOLGSA-N 2 0 230.421 2.200 20 0 BEADRP Cc1cccc(C[NH2+]CC[C@H]2CCC[NH2+]C2)c1 ZINC000259171696 322882317 /nfs/dbraw/zinc/88/23/17/322882317.db2.gz YTJQZQLUTXAFTI-CQSZACIVSA-N 2 0 232.371 2.474 20 0 BEADRP Cc1ccc(F)c(C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)c1 ZINC000334843192 487570335 /nfs/dbraw/zinc/57/03/35/487570335.db2.gz CSVWNXPCSNRFEN-QWHCGFSZSA-N 2 0 236.334 2.494 20 0 BEADRP Cc1ccc(F)cc1C[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000334845223 487572491 /nfs/dbraw/zinc/57/24/91/487572491.db2.gz KCHXTHNRQCHSET-KBPBESRZSA-N 2 0 236.334 2.494 20 0 BEADRP CC(C)OCCC[NH+]1CCC(C[NH+](C)C)CC1 ZINC000336715106 167211171 /nfs/dbraw/zinc/21/11/71/167211171.db2.gz TUBPZNSKRRZLDK-UHFFFAOYSA-N 2 0 242.407 2.075 20 0 BEADRP [NH3+]CCC1CC[NH+](CC2CC=CC2)CC1 ZINC000238554090 487586410 /nfs/dbraw/zinc/58/64/10/487586410.db2.gz QHSLPBLYIIFFGT-UHFFFAOYSA-N 2 0 208.349 2.013 20 0 BEADRP CC(C)OC[C@@H](C)[NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000337348556 167255997 /nfs/dbraw/zinc/25/59/97/167255997.db2.gz ZBPDHKAFFLOSDY-MGPQQGTHSA-N 2 0 242.407 2.262 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCC[NH+]2CCCCC2)CS1 ZINC000086934482 487591071 /nfs/dbraw/zinc/59/10/71/487591071.db2.gz XAKSNOVJLZIJKD-OLZOCXBDSA-N 2 0 242.432 2.346 20 0 BEADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+][C@H]2CS[C@H](C)C2)C1 ZINC000086935460 487592898 /nfs/dbraw/zinc/59/28/98/487592898.db2.gz XNXSLOZZELLKER-FRRDWIJNSA-N 2 0 242.432 2.200 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000668820995 487595595 /nfs/dbraw/zinc/59/55/95/487595595.db2.gz ZZCGQSMIIVMAOT-BPLDGKMQSA-N 2 0 236.403 2.354 20 0 BEADRP [NH3+]CCC[NH2+]CCOc1cccc2ccccc21 ZINC000349157560 487597175 /nfs/dbraw/zinc/59/71/75/487597175.db2.gz HGCBGZRGPYAYCR-UHFFFAOYSA-N 2 0 244.338 2.157 20 0 BEADRP CC1CCC([NH2+][C@@H]2CC[C@H]3C[N@H+](C)C[C@H]32)CC1 ZINC001651698333 1172976864 /nfs/dbraw/zinc/97/68/64/1172976864.db2.gz VIELEPHZLKWKGJ-FWJBWGTRSA-N 2 0 236.403 2.495 20 0 BEADRP CO[C@H](C[NH2+]CC1([NH3+])CCC1)C1CCCCC1 ZINC000662267229 409570619 /nfs/dbraw/zinc/57/06/19/409570619.db2.gz SYLATRMIGOSCNV-CYBMUJFWSA-N 2 0 240.391 2.053 20 0 BEADRP [NH3+]C[C@H]1CC[N@H+](CC[C@H]2CCc3ccccc32)C1 ZINC000662246137 409541727 /nfs/dbraw/zinc/54/17/27/409541727.db2.gz PUWOFEAAWOKKDJ-UKRRQHHQSA-N 2 0 244.382 2.387 20 0 BEADRP [NH3+]C[C@@H]1CC[N@H+](CC[C@H]2CCc3ccccc32)C1 ZINC000662246135 409541853 /nfs/dbraw/zinc/54/18/53/409541853.db2.gz PUWOFEAAWOKKDJ-DZGCQCFKSA-N 2 0 244.382 2.387 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](C[C@@H]3C[C@H]4C[C@H]4C3)C[C@H]21 ZINC000662267435 409569453 /nfs/dbraw/zinc/56/94/53/409569453.db2.gz VVAWXKRJMLLBPD-QAUDVVSPSA-N 2 0 234.387 2.092 20 0 BEADRP CC[C@H]1C[N@H+](CCC=C(C)C)CC[C@H]1[NH3+] ZINC000662269676 409572257 /nfs/dbraw/zinc/57/22/57/409572257.db2.gz CVFFTEVARRAWNN-QWHCGFSZSA-N 2 0 210.365 2.402 20 0 BEADRP C([C@@H]1CC[C@@H]2C[C@@H]2C1)[N@@H+]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC000662277866 409594048 /nfs/dbraw/zinc/59/40/48/409594048.db2.gz SIYZZLOOXXMYCZ-WCVJEAGWSA-N 2 0 248.414 2.498 20 0 BEADRP CO[C@H](C[N@@H+]1CC[C@@H]([NH3+])C[C@@H]1C)C1CCCC1 ZINC000662284273 409615130 /nfs/dbraw/zinc/61/51/30/409615130.db2.gz MJIRHMJSRGEEBY-IACUBPJLSA-N 2 0 240.391 2.003 20 0 BEADRP Cc1ccc(CC[NH2+][C@H]2CCC[C@H]2[NH3+])c(C)c1 ZINC000259119718 409733373 /nfs/dbraw/zinc/73/33/73/409733373.db2.gz TVLDIYPECVUTCX-CABCVRRESA-N 2 0 232.371 2.315 20 0 BEADRP C[C@@H](C[NH2+]Cc1cccc2c1CCC2)C[NH+](C)C ZINC000651967362 409807630 /nfs/dbraw/zinc/80/76/30/409807630.db2.gz CARGOTKDJQGYCR-ZDUSSCGKSA-N 2 0 246.398 2.463 20 0 BEADRP C[C@@H](C[N@H+]1CC[C@@H]([C@H](C)[NH3+])C1)C(C)(C)C ZINC000308778195 409904676 /nfs/dbraw/zinc/90/46/76/409904676.db2.gz BITYDJCGAZNBRK-SDDRHHMPSA-N 2 0 212.381 2.338 20 0 BEADRP CC1(C[NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)CC1 ZINC000663343769 410150503 /nfs/dbraw/zinc/15/05/03/410150503.db2.gz FAUITJXSTHSYOQ-AWEZNQCLSA-N 2 0 236.403 2.498 20 0 BEADRP Cc1cccc(C[NH2+]CC[C@@H]([NH3+])C(C)C)c1 ZINC000663498506 410276365 /nfs/dbraw/zinc/27/63/65/410276365.db2.gz OCINLIHUKVGFSQ-CQSZACIVSA-N 2 0 220.360 2.458 20 0 BEADRP CC(C)[NH+]1CCC(N(C)Cc2ccncc2)CC1 ZINC000266026574 487615046 /nfs/dbraw/zinc/61/50/46/487615046.db2.gz QQNUOGHSFPHPMC-UHFFFAOYSA-N 2 0 247.386 2.386 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]Cc2cccc3c2CCC3)CC[NH2+]1 ZINC000650703499 410332329 /nfs/dbraw/zinc/33/23/29/410332329.db2.gz CEIRMDPHZPCIQL-DOMZBBRYSA-N 2 0 244.382 2.405 20 0 BEADRP C[NH2+]C[C@H]1CC[N@H+](Cc2cccc3c2CCC3)C1 ZINC000650702788 410333234 /nfs/dbraw/zinc/33/32/34/410333234.db2.gz VAYHJRDYOSELLZ-CYBMUJFWSA-N 2 0 244.382 2.217 20 0 BEADRP [NH3+]CC1CC[NH+](Cc2cccc3c2CCC3)CC1 ZINC000650702605 410333447 /nfs/dbraw/zinc/33/34/47/410333447.db2.gz MJGVRRZCDWVKNO-UHFFFAOYSA-N 2 0 244.382 2.346 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]Cc1cccc2c1CCC2 ZINC000650704341 410334893 /nfs/dbraw/zinc/33/48/93/410334893.db2.gz USBMUZILFWTYGT-LBPRGKRZSA-N 2 0 232.371 2.392 20 0 BEADRP Cc1ccccc1C1([NH2+]CCC[NH3+])CCC1 ZINC000650704058 410336084 /nfs/dbraw/zinc/33/60/84/410336084.db2.gz FBOWILLPASOVCT-UHFFFAOYSA-N 2 0 218.344 2.313 20 0 BEADRP C[C@H]1C[C@H](C[NH3+])C[N@@H+]1Cc1cccc2c1CCC2 ZINC000650703186 410336420 /nfs/dbraw/zinc/33/64/20/410336420.db2.gz ORTMJTLUAYOFAR-QWHCGFSZSA-N 2 0 244.382 2.344 20 0 BEADRP Cc1cc(C[NH2+]CCC2(C[NH3+])CC2)ccc1F ZINC000650712695 410344546 /nfs/dbraw/zinc/34/45/46/410344546.db2.gz QCZWZVKLQGNVSV-UHFFFAOYSA-N 2 0 236.334 2.353 20 0 BEADRP [NH3+]CC1(CC[NH2+][C@H]2CCc3ccccc3C2)CC1 ZINC000650713932 410345104 /nfs/dbraw/zinc/34/51/04/410345104.db2.gz JIZNYTMUZWTRAQ-HNNXBMFYSA-N 2 0 244.382 2.263 20 0 BEADRP Cc1ccc(F)c(C[NH2+]CCC2(C[NH3+])CC2)c1 ZINC000650712842 410345787 /nfs/dbraw/zinc/34/57/87/410345787.db2.gz XBYLZZOWWDZHJI-UHFFFAOYSA-N 2 0 236.334 2.353 20 0 BEADRP C[C@H](C[NH2+]CCC1(C[NH3+])CC1)C(C)(C)C ZINC000650714216 410347483 /nfs/dbraw/zinc/34/74/83/410347483.db2.gz WFRNSXOMTWLSQD-LLVKDONJSA-N 2 0 212.381 2.387 20 0 BEADRP CC[C@@H](C)C[NH2+]Cc1ccc(C[NH3+])cc1F ZINC000650716833 410353479 /nfs/dbraw/zinc/35/34/79/410353479.db2.gz KSRZRNAJHNOWLJ-SNVBAGLBSA-N 2 0 224.323 2.420 20 0 BEADRP C[NH2+]Cc1ccccc1C[NH2+]CC1(C)CC1 ZINC000650720372 410358742 /nfs/dbraw/zinc/35/87/42/410358742.db2.gz MWAZYTXGEWLVQN-UHFFFAOYSA-N 2 0 218.344 2.296 20 0 BEADRP Cc1ccccc1[C@@H]1C[C@H]1[NH2+][C@@H]1CCC[C@H]1[NH3+] ZINC000650742324 410374290 /nfs/dbraw/zinc/37/42/90/410374290.db2.gz VWJOKSAXFZOFPW-GBJTYRQASA-N 2 0 230.355 2.320 20 0 BEADRP CC(C)(C)C[C@@H]1C[C@H]1[NH2+][C@@H]1CCC[C@H]1[NH3+] ZINC000650741959 410374572 /nfs/dbraw/zinc/37/45/72/410374572.db2.gz OOWQYITZTFDBKW-IRCOFANPSA-N 2 0 210.365 2.281 20 0 BEADRP CCc1cccnc1[C@H](C)[NH2+]CCC1(C[NH3+])CC1 ZINC000650745677 410382240 /nfs/dbraw/zinc/38/22/40/410382240.db2.gz LLBXGXAAUDUMFN-LBPRGKRZSA-N 2 0 247.386 2.424 20 0 BEADRP C[C@@H]([NH2+]CCC1(C[NH3+])CC1)[C@H]1CC1(C)C ZINC000650747090 410385175 /nfs/dbraw/zinc/38/51/75/410385175.db2.gz RIVUZJKZRLYNLB-GHMZBOCLSA-N 2 0 210.365 2.140 20 0 BEADRP CC[C@H]([NH2+]CCC1(C[NH3+])CC1)C1CCC1 ZINC000650747378 410386958 /nfs/dbraw/zinc/38/69/58/410386958.db2.gz YSZXAUNSNWMXDV-LBPRGKRZSA-N 2 0 210.365 2.284 20 0 BEADRP [NH3+]CC1(CC[NH2+][C@H]2CCC23CCCC3)CC1 ZINC000650746811 410387672 /nfs/dbraw/zinc/38/76/72/410387672.db2.gz LPYQYORUOWMGKN-LBPRGKRZSA-N 2 0 222.376 2.428 20 0 BEADRP [NH3+]CC1(CC[NH2+][C@H]2CC[C@H]2C2CCC2)CC1 ZINC000650747284 410388226 /nfs/dbraw/zinc/38/82/26/410388226.db2.gz WNSQXSYZBMMNCE-STQMWFEESA-N 2 0 222.376 2.284 20 0 BEADRP CC[C@H]([NH2+]CCC1(C[NH3+])CC1)[C@H]1C[C@H]1C ZINC000650748477 410390588 /nfs/dbraw/zinc/39/05/88/410390588.db2.gz VCNJTFWBMZTNKI-WOPDTQHZSA-N 2 0 210.365 2.140 20 0 BEADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H](C)[C@H]1CCCO1 ZINC000650756715 410405121 /nfs/dbraw/zinc/40/51/21/410405121.db2.gz IILRISZQFDFOFL-SWLSCSKDSA-N 2 0 248.370 2.063 20 0 BEADRP CC[C@H]([NH2+]CCC1CC[NH2+]CC1)[C@H]1C[C@@H]1C ZINC000650762246 410411855 /nfs/dbraw/zinc/41/18/55/410411855.db2.gz XXHPOIWHWXTMAE-UBHSHLNASA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H]([NH2+]CCC1CC[NH2+]CC1)[C@H]1CC1(C)C ZINC000650762875 410412822 /nfs/dbraw/zinc/41/28/22/410412822.db2.gz MRFIMEGAQMAPPK-WCQYABFASA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1C[C@H]([NH3+])CC[N@@H+]1Cc1cccc2c1CCC2 ZINC000653280256 410634338 /nfs/dbraw/zinc/63/43/38/410634338.db2.gz JFYJTMZPIDYIJT-IUODEOHRSA-N 2 0 244.382 2.487 20 0 BEADRP C[C@H]1C[C@H]([NH3+])CC[N@@H+]1Cc1cccc2c1CCC2 ZINC000653280257 410634519 /nfs/dbraw/zinc/63/45/19/410634519.db2.gz JFYJTMZPIDYIJT-SWLSCSKDSA-N 2 0 244.382 2.487 20 0 BEADRP CCC[C@H](C[NH2+][C@@H](C)C1CC[NH+](C)CC1)OC ZINC000393534669 410747295 /nfs/dbraw/zinc/74/72/95/410747295.db2.gz ZTKXEPJIFKLVAQ-GXTWGEPZSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]CC[C@@]1(C)CC1(F)F ZINC000665266715 410738993 /nfs/dbraw/zinc/73/89/93/410738993.db2.gz IDRLSBGNIMXKOW-UTUOFQBUSA-N 2 0 246.345 2.400 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]CCCC2CCC2)C1 ZINC000665266704 410739436 /nfs/dbraw/zinc/73/94/36/410739436.db2.gz HYZIAWDGAPAJDF-CHWSQXEVSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]CC[C@]1(C)CC1(F)F ZINC000665266714 410740029 /nfs/dbraw/zinc/74/00/29/410740029.db2.gz IDRLSBGNIMXKOW-IJLUTSLNSA-N 2 0 246.345 2.400 20 0 BEADRP C[NH2+]C[C@H](C)[NH2+]C1C2CC3CC(C2)CC1C3 ZINC000665294360 410783494 /nfs/dbraw/zinc/78/34/94/410783494.db2.gz NAPWQWGWJACTDL-FTPDJBBVSA-N 2 0 222.376 2.009 20 0 BEADRP C[NH2+]C[C@@H](C)N[C@H](C)c1sc(C)nc1C ZINC000665295675 410801071 /nfs/dbraw/zinc/80/10/71/410801071.db2.gz HQJSOVCGUFLJRX-HTQZYQBOSA-N 2 0 227.377 2.018 20 0 BEADRP C[NH2+]C[C@@H](C)[NH2+][C@@H]1CCCc2ccccc2C1 ZINC000665297450 410818487 /nfs/dbraw/zinc/81/84/87/410818487.db2.gz GBDVKVGJBFUKKI-IUODEOHRSA-N 2 0 232.371 2.132 20 0 BEADRP C[NH2+]C[C@@H](C)[NH2+][C@H]1CCCc2ccccc2C1 ZINC000665297449 410819086 /nfs/dbraw/zinc/81/90/86/410819086.db2.gz GBDVKVGJBFUKKI-DOMZBBRYSA-N 2 0 232.371 2.132 20 0 BEADRP CC(C)C[NH2+]CCCC[NH+]1C[C@H](C)O[C@@H](C)C1 ZINC000052380103 167003779 /nfs/dbraw/zinc/00/37/79/167003779.db2.gz JSSLNGAUHRZVNL-KBPBESRZSA-N 2 0 242.407 2.121 20 0 BEADRP CC(C)C[NH2+]C[C@H](C)C[NH+]1CCCCC1 ZINC000037997564 167006713 /nfs/dbraw/zinc/00/67/13/167006713.db2.gz HOFOWIJJLBUOSF-ZDUSSCGKSA-N 2 0 212.381 2.354 20 0 BEADRP CC(C)Oc1ccccc1C[NH2+]CCCC[NH3+] ZINC000037715394 167310266 /nfs/dbraw/zinc/31/02/66/167310266.db2.gz XEVRBIRKAUMSAF-UHFFFAOYSA-N 2 0 236.359 2.302 20 0 BEADRP CC(C)[C@@H](C)[N@H+](C)CCC1CC[NH2+]CC1 ZINC000036787479 167368472 /nfs/dbraw/zinc/36/84/72/167368472.db2.gz DKGNUDAEWGWEEQ-GFCCVEGCSA-N 2 0 212.381 2.352 20 0 BEADRP CC(C)[C@@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000020524081 167380682 /nfs/dbraw/zinc/38/06/82/167380682.db2.gz NYAKOTKWVZUILG-ODWCKFRGSA-N 2 0 210.365 2.246 20 0 BEADRP CC(C)[C@@H](C)[NH2+]C[C@@H](C)C[NH+]1CCCC1 ZINC000062077833 167382096 /nfs/dbraw/zinc/38/20/96/167382096.db2.gz LXJWVAASEMDHFG-CHWSQXEVSA-N 2 0 212.381 2.352 20 0 BEADRP CC[C@@H]([NH2+][C@@H](C)C1CC[NH+](C)CC1)C(F)F ZINC000651364330 410953626 /nfs/dbraw/zinc/95/36/26/410953626.db2.gz HFOZFYUMZXOCTQ-GXSJLCMTSA-N 2 0 234.334 2.350 20 0 BEADRP CC(C)c1ccc(C[N@H+]2C[C@H]3C[NH2+]C[C@H]3C2)cc1 ZINC000107573384 167597816 /nfs/dbraw/zinc/59/78/16/167597816.db2.gz HSGXPOGQUMUOHX-IYBDPMFKSA-N 2 0 244.382 2.461 20 0 BEADRP CC(C)C[N@H+](C)CCC[NH2+]CC1(C)CC1 ZINC000651865678 411147716 /nfs/dbraw/zinc/14/77/16/411147716.db2.gz DEJZUPRHBDQGLU-UHFFFAOYSA-N 2 0 212.381 2.354 20 0 BEADRP CC(C)C[N@H+](C)CCC[NH2+][C@@H]1CSC[C@H]1C ZINC000651865229 411148112 /nfs/dbraw/zinc/14/81/12/411148112.db2.gz RDKCXAAOHKVTSR-CHWSQXEVSA-N 2 0 244.448 2.305 20 0 BEADRP CC(C)[C@@H]1CCC[N@H+](C[C@@H]2CC[NH2+]C2)CC1 ZINC000070622067 411153610 /nfs/dbraw/zinc/15/36/10/411153610.db2.gz ZYULCDFUQHRBAL-ZIAGYGMSSA-N 2 0 224.392 2.354 20 0 BEADRP CC(C)(CCN1CC[C@@H]2CC[NH2+][C@H]2C1)C1CC1 ZINC000655940718 411160563 /nfs/dbraw/zinc/16/05/63/411160563.db2.gz GBKDZEPKCPAAMN-JSGCOSHPSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)C1CC1 ZINC000400993553 411168247 /nfs/dbraw/zinc/16/82/47/411168247.db2.gz ZPDMTCIWMVTUJI-YXCITZCRSA-N 2 0 222.376 2.010 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)C1CCC1 ZINC000400989535 411168462 /nfs/dbraw/zinc/16/84/62/411168462.db2.gz XIHPXBQJWWVQTJ-AHLTXXRQSA-N 2 0 222.376 2.153 20 0 BEADRP FC1(F)CC(C[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)C1 ZINC000401040860 411174567 /nfs/dbraw/zinc/17/45/67/411174567.db2.gz TYFXYXXGPJATSY-QJPTWQEYSA-N 2 0 244.329 2.009 20 0 BEADRP c1csc(C[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)c1 ZINC000401071186 411176531 /nfs/dbraw/zinc/17/65/31/411176531.db2.gz NCFASXAHJZENGW-QJPTWQEYSA-N 2 0 236.384 2.226 20 0 BEADRP Fc1ccc(C[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)cc1 ZINC000401074684 411176546 /nfs/dbraw/zinc/17/65/46/411176546.db2.gz OJLPJDXPFBCHFK-UMVBOHGHSA-N 2 0 248.345 2.303 20 0 BEADRP Cc1ccoc1C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000401120729 411177651 /nfs/dbraw/zinc/17/76/51/411177651.db2.gz JINJAUSTJQXHJH-FRRDWIJNSA-N 2 0 234.343 2.066 20 0 BEADRP C1=CC[C@H](C[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)CC1 ZINC000401124615 411177892 /nfs/dbraw/zinc/17/78/92/411177892.db2.gz KYPRISRERXNETL-LJISPDSOSA-N 2 0 234.387 2.320 20 0 BEADRP CCC(CC)(CCO)C[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000656193080 411198517 /nfs/dbraw/zinc/19/85/17/411198517.db2.gz MBIBRLDNEOWSQN-STQMWFEESA-N 2 0 242.407 2.035 20 0 BEADRP CCC(CC)(CCO)C[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000656193079 411198600 /nfs/dbraw/zinc/19/86/00/411198600.db2.gz MBIBRLDNEOWSQN-QWHCGFSZSA-N 2 0 242.407 2.035 20 0 BEADRP COC[C@H](CC(C)(C)C)[NH2+]C[C@H]([NH3+])CC(C)C ZINC000656193904 411199212 /nfs/dbraw/zinc/19/92/12/411199212.db2.gz XQGRBDAGEUXLOL-OLZOCXBDSA-N 2 0 244.423 2.401 20 0 BEADRP COC[C@H](CC(C)(C)C)[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000656193279 411200757 /nfs/dbraw/zinc/20/07/57/411200757.db2.gz DCFBXLKMKGVBHJ-XQQFMLRXSA-N 2 0 242.407 2.297 20 0 BEADRP COC[C@H](CC(C)(C)C)[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000656193278 411201077 /nfs/dbraw/zinc/20/10/77/411201077.db2.gz DCFBXLKMKGVBHJ-UPJWGTAASA-N 2 0 242.407 2.297 20 0 BEADRP Cc1cnc(CC[NH2+][C@H]2CCC[C@@H]([NH3+])C2)c(C)c1 ZINC000656200337 411204912 /nfs/dbraw/zinc/20/49/12/411204912.db2.gz LWEFXWQHSMUTQS-KGLIPLIRSA-N 2 0 247.386 2.100 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCC[C@@H]([NH3+])C1)[C@@H]1CCCCO1 ZINC000656201506 411206151 /nfs/dbraw/zinc/20/61/51/411206151.db2.gz QJDWSNIDWIQQFC-MQYQWHSLSA-N 2 0 240.391 2.194 20 0 BEADRP CC[C@H](C)[N@@H+]1CCC[C@H]([C@H]2C[C@@H]([NH3+])CCO2)C1 ZINC000652349532 411210940 /nfs/dbraw/zinc/21/09/40/411210940.db2.gz ROOFPXFKPUEHRV-XDQVBPFNSA-N 2 0 240.391 2.003 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H]2CCCC23CC3)C1 ZINC000658047263 411218035 /nfs/dbraw/zinc/21/80/35/411218035.db2.gz PUJULAUQLNODEH-XQQFMLRXSA-N 2 0 222.376 2.249 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H]2CCCSCC2)C1 ZINC000658048675 411218334 /nfs/dbraw/zinc/21/83/34/411218334.db2.gz WTAMRESYNHJQHS-UPJWGTAASA-N 2 0 242.432 2.202 20 0 BEADRP CCC[C@@H](C)[NH2+][C@@H](C)CN(C)CCC[NH+](C)C ZINC000658106864 411247439 /nfs/dbraw/zinc/24/74/39/411247439.db2.gz GDRDMAWVGMDCJU-KGLIPLIRSA-N 2 0 243.439 2.037 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CCCOC1CCCC1 ZINC000422827472 411232678 /nfs/dbraw/zinc/23/26/78/411232678.db2.gz MZNRJNUXAGGTCV-NWDGAFQWSA-N 2 0 228.380 2.051 20 0 BEADRP COCC[C@H](C)C[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000423173431 411236808 /nfs/dbraw/zinc/23/68/08/411236808.db2.gz YOQBHOOUKRDEHW-NILFDRSVSA-N 2 0 248.370 2.393 20 0 BEADRP C[C@@H]1CCC[C@@H]1C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000400880127 411165615 /nfs/dbraw/zinc/16/56/15/411165615.db2.gz ADODZBDEQZKZMT-KJWHEZOQSA-N 2 0 236.403 2.400 20 0 BEADRP C(C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)CC1CC1 ZINC000400950174 411166337 /nfs/dbraw/zinc/16/63/37/411166337.db2.gz FDEJGFDIDBDTJQ-MELADBBJSA-N 2 0 222.376 2.154 20 0 BEADRP C(C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)CC1CC1 ZINC000400950172 411166533 /nfs/dbraw/zinc/16/65/33/411166533.db2.gz FDEJGFDIDBDTJQ-BFHYXJOUSA-N 2 0 222.376 2.154 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@@H]2CCC[N@H+](C)C2)CS1 ZINC000655712162 411267276 /nfs/dbraw/zinc/26/72/76/411267276.db2.gz RHUFVXBGZRFKBJ-AGIUHOORSA-N 2 0 242.432 2.202 20 0 BEADRP CC(C)C[N@H+](C)CCCC1CC[NH2+]CC1 ZINC000050952580 411269845 /nfs/dbraw/zinc/26/98/45/411269845.db2.gz SFEIGNJCUWBKLN-UHFFFAOYSA-N 2 0 212.381 2.354 20 0 BEADRP CCCC[N@H+](C)CCCC1CC[NH2+]CC1 ZINC000050952354 411269881 /nfs/dbraw/zinc/26/98/81/411269881.db2.gz WNXPQZZTZIGDFY-UHFFFAOYSA-N 2 0 212.381 2.498 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+]CC2CC[NH+](C)CC2)CS1 ZINC000655716964 411273298 /nfs/dbraw/zinc/27/32/98/411273298.db2.gz QWUYCMVICAQYMI-WCQYABFASA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H]1CCC[C@@H]([N@H+](C)C[C@@H]2CC[NH2+]C2)C1 ZINC000051889673 411285225 /nfs/dbraw/zinc/28/52/25/411285225.db2.gz XABDLEAURPRWHR-JHJVBQTASA-N 2 0 210.365 2.106 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@]2(C)CC2(F)F)CC1 ZINC000658222939 411301891 /nfs/dbraw/zinc/30/18/91/411301891.db2.gz YVNBSVQHHWJJQH-NSHDSACASA-N 2 0 232.318 2.106 20 0 BEADRP C[C@H](c1ccncc1)[N@@H+]1C[C@@H]2CCC[C@]2(C[NH3+])C1 ZINC000311054583 411309538 /nfs/dbraw/zinc/30/95/38/411309538.db2.gz XVRULQZTEPBFFP-SNPRPXQTSA-N 2 0 245.370 2.203 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CCC2CC[NH+](C)CC2)CS1 ZINC000125129077 411349997 /nfs/dbraw/zinc/34/99/97/411349997.db2.gz SWPDCWRXWNGRKM-AAEUAGOBSA-N 2 0 242.432 2.202 20 0 BEADRP CC1(C[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)CC1 ZINC000300359374 168046759 /nfs/dbraw/zinc/04/67/59/168046759.db2.gz OVMULWGSSVCFKN-RYUDHWBXSA-N 2 0 208.349 2.003 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000656783361 411359692 /nfs/dbraw/zinc/35/96/92/411359692.db2.gz PWTFOTXWQBWWOT-VHDGCEQUSA-N 2 0 236.403 2.354 20 0 BEADRP Cc1ccc(C[NH2+]CC2([NH3+])CCCC2)cc1 ZINC000656788412 411367360 /nfs/dbraw/zinc/36/73/60/411367360.db2.gz OCNNYKDVUQTZLV-UHFFFAOYSA-N 2 0 218.344 2.356 20 0 BEADRP C[C@H](CC1CCOCC1)[NH2+]CC1([NH3+])CCCC1 ZINC000656788711 411367914 /nfs/dbraw/zinc/36/79/14/411367914.db2.gz BOPNWZQYMBTBNS-GFCCVEGCSA-N 2 0 240.391 2.053 20 0 BEADRP C[C@H]1CCC[C@H]([NH2+]CC2([NH3+])CCCC2)C1 ZINC000656789311 411368511 /nfs/dbraw/zinc/36/85/11/411368511.db2.gz MIPDNXYRKRVJRI-RYUDHWBXSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@H]1CCCC[C@@H]1[NH2+]CC1([NH3+])CCCC1 ZINC000656789587 411369156 /nfs/dbraw/zinc/36/91/56/411369156.db2.gz RQDULMDZWLSFPT-RYUDHWBXSA-N 2 0 210.365 2.426 20 0 BEADRP CC(C)[C@H]1C[C@@H]([NH2+]CC2([NH3+])CCCC2)CCO1 ZINC000656789277 411369442 /nfs/dbraw/zinc/36/94/42/411369442.db2.gz LEKDXBAPUSROAY-QWHCGFSZSA-N 2 0 240.391 2.051 20 0 BEADRP CC1(C)CCC[C@@H]1[NH2+]CC1([NH3+])CCCC1 ZINC000656789728 411371278 /nfs/dbraw/zinc/37/12/78/411371278.db2.gz WLQVWANYFYLCLI-NSHDSACASA-N 2 0 210.365 2.426 20 0 BEADRP CO[C@@]1(C)C[C@H]1[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000658332537 411341294 /nfs/dbraw/zinc/34/12/94/411341294.db2.gz RTFOBNKYMJRUFX-OCCSQVGLSA-N 2 0 240.391 2.016 20 0 BEADRP C[NH2+]CC1CC[NH+]([C@@H](C)c2ccncc2)CC1 ZINC000063158782 411344292 /nfs/dbraw/zinc/34/42/92/411344292.db2.gz UXGRLFWVVCFHTB-LBPRGKRZSA-N 2 0 233.359 2.074 20 0 BEADRP Cc1cc(NCC[N@H+]2CC=C(C)CC2)cc[nH+]1 ZINC000302390465 168111515 /nfs/dbraw/zinc/11/15/15/168111515.db2.gz FRPZWTZOLYEKRS-UHFFFAOYSA-N 2 0 231.343 2.454 20 0 BEADRP CC1=CC[C@@H]([NH2+]CC2=CC[N@H+](C)CC2)CC1 ZINC000285274567 168118149 /nfs/dbraw/zinc/11/81/49/168118149.db2.gz QZKKOIMNEFLQOR-CQSZACIVSA-N 2 0 220.360 2.337 20 0 BEADRP C[N@@H+]1CC[C@@]2(C1)CCC[NH+](CC1CC=CC1)C2 ZINC000660659645 411374477 /nfs/dbraw/zinc/37/44/77/411374477.db2.gz ACAKAYIWXYEGLH-OAHLLOKOSA-N 2 0 234.387 2.370 20 0 BEADRP C[C@@H]1C[C@H](C[NH3+])C[N@@H+]1CC1CCC(C)CC1 ZINC000228067515 168154414 /nfs/dbraw/zinc/15/44/14/168154414.db2.gz UGWOEEBBRLWTCZ-FKZOYECMSA-N 2 0 224.392 2.482 20 0 BEADRP CC1CCC([N@H+](C)C[C@@H]2CC[NH2+]C2)CC1 ZINC000051889636 168160150 /nfs/dbraw/zinc/16/01/50/168160150.db2.gz GQENONUDWHNNHU-OTTFEQOBSA-N 2 0 210.365 2.106 20 0 BEADRP CC1CCC([NH2+]CCCC[NH+](C)C)CC1 ZINC000045662944 168162858 /nfs/dbraw/zinc/16/28/58/168162858.db2.gz HCVLOHJXUBLXEE-UHFFFAOYSA-N 2 0 212.381 2.497 20 0 BEADRP CC[C@@H]1C[C@H]([NH2+]CC(C)(C)C[NH+](C)C)CCO1 ZINC000070343394 411389295 /nfs/dbraw/zinc/38/92/95/411389295.db2.gz KLCHLWWGZSBVCS-CHWSQXEVSA-N 2 0 242.407 2.121 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCC[C@@H](C)[C@@H]1CC[NH3+] ZINC000404324972 411390506 /nfs/dbraw/zinc/39/05/06/411390506.db2.gz UFVNWHBLXICAMD-XQQFMLRXSA-N 2 0 212.381 2.482 20 0 BEADRP CC[C@@H](C)[NH2+]Cc1cccc2c1CC[NH2+]C2 ZINC000125648590 411391489 /nfs/dbraw/zinc/39/14/89/411391489.db2.gz ZXVQXNMVPPPDDT-LLVKDONJSA-N 2 0 218.344 2.220 20 0 BEADRP CCC[C@H](C)C[N@@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC000366486235 411382206 /nfs/dbraw/zinc/38/22/06/411382206.db2.gz CYEZBPYVHDEVDI-KBPBESRZSA-N 2 0 224.392 2.450 20 0 BEADRP CCC(C)(C)C[NH2+][C@H]1CC[N@H+](C)C[C@@H]1C ZINC000336772615 168281923 /nfs/dbraw/zinc/28/19/23/168281923.db2.gz YEGKBODKTPCFPA-RYUDHWBXSA-N 2 0 212.381 2.352 20 0 BEADRP Cc1ccc(C[N@H+]2CCC[C@@H](C)[C@H]2CC[NH3+])nc1 ZINC000404407984 411394166 /nfs/dbraw/zinc/39/41/66/411394166.db2.gz AZRWPCPQFPQRID-UKRRQHHQSA-N 2 0 247.386 2.339 20 0 BEADRP Cc1ccncc1C[N@H+]1CCC[C@@H](C)[C@H]1CC[NH3+] ZINC000404410479 411395563 /nfs/dbraw/zinc/39/55/63/411395563.db2.gz CESGPANJFKOMOZ-UKRRQHHQSA-N 2 0 247.386 2.339 20 0 BEADRP CC(C)[C@@H]1C[C@H]1C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000647797878 411405221 /nfs/dbraw/zinc/40/52/21/411405221.db2.gz GFBVLELIQFEKAG-FQKPHLNHSA-N 2 0 236.403 2.256 20 0 BEADRP CN(C)c1cccc([C@@H]2CCC[N@@H+]2CCC[NH3+])c1 ZINC000414705057 411440800 /nfs/dbraw/zinc/44/08/00/411440800.db2.gz NGIIABVTPOTMQP-HNNXBMFYSA-N 2 0 247.386 2.238 20 0 BEADRP CCC(CC)[NH2+]Cc1cnc2n1CCC2 ZINC000657286833 411445497 /nfs/dbraw/zinc/44/54/97/411445497.db2.gz TUPCHXBKOUQDPT-UHFFFAOYSA-N 2 0 207.321 2.108 20 0 BEADRP CC[C@H]1C[C@H]([NH2+]CCC[NH+]2CCCCC2)CO1 ZINC000657296464 411454035 /nfs/dbraw/zinc/45/40/35/411454035.db2.gz VCQAYWBDWOLURM-KBPBESRZSA-N 2 0 240.391 2.020 20 0 BEADRP CC[C@@H]1C[C@H]([NH2+]CCC[NH+]2CCCCC2)CO1 ZINC000657296468 411454379 /nfs/dbraw/zinc/45/43/79/411454379.db2.gz VCQAYWBDWOLURM-UONOGXRCSA-N 2 0 240.391 2.020 20 0 BEADRP COC1CCC([NH2+][C@@H](C)CCCC[NH3+])CC1 ZINC000415011682 411488115 /nfs/dbraw/zinc/48/81/15/411488115.db2.gz HURKXOLOWWYBDE-HIFPTAJRSA-N 2 0 228.380 2.051 20 0 BEADRP CC1(C)C[C@H]([N@@H+]2CCC[C@H](c3ncc[nH]3)C2)CO1 ZINC000660077859 411534290 /nfs/dbraw/zinc/53/42/90/411534290.db2.gz QOWOZFALETTWOD-RYUDHWBXSA-N 2 0 249.358 2.157 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H]2CCC23CCC3)C1 ZINC000655803899 411518161 /nfs/dbraw/zinc/51/81/61/411518161.db2.gz HFBCWXUSZUNMAA-FRRDWIJNSA-N 2 0 222.376 2.249 20 0 BEADRP CC[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)C1CCC1 ZINC000655802735 411518799 /nfs/dbraw/zinc/51/87/99/411518799.db2.gz ILKVQLZNLGQPDJ-YUTCNCBUSA-N 2 0 224.392 2.495 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H]2CCC[C@H]3C[C@H]32)C1 ZINC000655803881 411518887 /nfs/dbraw/zinc/51/88/87/411518887.db2.gz GWYDYLYUVPDOJF-QNSTZXKLSA-N 2 0 222.376 2.105 20 0 BEADRP Cc1cncc([C@H](C)[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)c1 ZINC000655804939 411519038 /nfs/dbraw/zinc/51/90/38/411519038.db2.gz GRTZVJCXCIFQEE-KCQAQPDRSA-N 2 0 247.386 2.381 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H]2CCC2(C)C)C1 ZINC000655804424 411519260 /nfs/dbraw/zinc/51/92/60/411519260.db2.gz YLFZYJMLZOTEKG-TUAOUCFPSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@H]1CCC[C@H]1[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655805444 411519678 /nfs/dbraw/zinc/51/96/78/411519678.db2.gz HIQANMUBMMPGSW-WUHRBBMRSA-N 2 0 210.365 2.105 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H]2CC[C@H]2C2CCC2)C1 ZINC000655804433 411519750 /nfs/dbraw/zinc/51/97/50/411519750.db2.gz YNUXHNCBTRZEDL-PMOUVXMZSA-N 2 0 236.403 2.495 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H]2CCC(C)(C)C2)C1 ZINC000655805747 411520206 /nfs/dbraw/zinc/52/02/06/411520206.db2.gz RXDUINFRKKKVQB-RWMBFGLXSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H](CC1CCC1)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655806289 411520364 /nfs/dbraw/zinc/52/03/64/411520364.db2.gz UKSTWJFOGFGGAA-BNOWGMLFSA-N 2 0 224.392 2.495 20 0 BEADRP CC[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)C(C)C ZINC000655807251 411521883 /nfs/dbraw/zinc/52/18/83/411521883.db2.gz IZOMRBSJOWUPQZ-XQQFMLRXSA-N 2 0 212.381 2.351 20 0 BEADRP C[C@@H](F)CC[NH2+]Cc1ccnn1-c1cc[nH+]cc1 ZINC000657475214 411524909 /nfs/dbraw/zinc/52/49/09/411524909.db2.gz MBTLZJBNPCHIBV-LLVKDONJSA-N 2 0 248.305 2.105 20 0 BEADRP CCC[C@H](C)C[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655826508 411530060 /nfs/dbraw/zinc/53/00/60/411530060.db2.gz GRADXSKYHUZXGF-RWMBFGLXSA-N 2 0 212.381 2.352 20 0 BEADRP CC[C@H]1C[C@@H]([NH2+]CCCC[N@H+](C)C2CC2)CO1 ZINC000657486955 411530979 /nfs/dbraw/zinc/53/09/79/411530979.db2.gz CZBANEWYWZJAPV-OCCSQVGLSA-N 2 0 240.391 2.018 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)CC(C)C)C1 ZINC000037484233 170007822 /nfs/dbraw/zinc/00/78/22/170007822.db2.gz ORTXDMHKCCWORW-STQMWFEESA-N 2 0 212.381 2.352 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccccc2C)C1 ZINC000037643770 170008004 /nfs/dbraw/zinc/00/80/04/170008004.db2.gz LLTJYSAZRBTBAZ-AWEZNQCLSA-N 2 0 232.371 2.426 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCCCOC)C[C@H]1C ZINC000336718079 170009470 /nfs/dbraw/zinc/00/94/70/170009470.db2.gz ZPSYWRFCHCFCJP-ZIAGYGMSSA-N 2 0 242.407 2.218 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH+](C)CC2CC2)C[C@H]1C ZINC000336648178 170009984 /nfs/dbraw/zinc/00/99/84/170009984.db2.gz NRSAZOIPPIDPJF-DGCLKSJQSA-N 2 0 210.365 2.201 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(F)cc2)C1 ZINC000037643739 170015157 /nfs/dbraw/zinc/01/51/57/170015157.db2.gz UTQAFDPODBZMTB-CYBMUJFWSA-N 2 0 236.334 2.257 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)C2(C)CC2)C1 ZINC000037484292 170016085 /nfs/dbraw/zinc/01/60/85/170016085.db2.gz PVVZWCUMLHUSID-NWDGAFQWSA-N 2 0 210.365 2.106 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CC[C@H]2C2CCC2)C1 ZINC000337983867 170016785 /nfs/dbraw/zinc/01/67/85/170016785.db2.gz CHLOFLOWKSSAKB-VHDGCEQUSA-N 2 0 236.403 2.497 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H]2CCC2(C)C)C1 ZINC000308785935 170017337 /nfs/dbraw/zinc/01/73/37/170017337.db2.gz FNOTUNHGBBKSLK-NEPJUHHUSA-N 2 0 210.365 2.106 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH+](C)CCOC(C)C)C[C@H]1C ZINC000336689376 170018049 /nfs/dbraw/zinc/01/80/49/170018049.db2.gz HMLXROQIFOBNGX-KGLIPLIRSA-N 2 0 242.407 2.216 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CC2(C(F)F)CC2)[C@@H](C)C1 ZINC000355146724 170020090 /nfs/dbraw/zinc/02/00/90/170020090.db2.gz GTBURPPNQUIYEM-QWRGUYRKSA-N 2 0 246.345 2.352 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CCC2(C)CC2)[C@@H](C)C1 ZINC000309465822 170020529 /nfs/dbraw/zinc/02/05/29/170020529.db2.gz PGMQVWHAKVLQAX-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]C[C@@H]2CCSC2)[C@@H](C)C1 ZINC000336779017 170020826 /nfs/dbraw/zinc/02/08/26/170020826.db2.gz MZGUFMJUXDOLFG-AVGNSLFASA-N 2 0 242.432 2.059 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@H]2CCC2(C)C)[C@@H](C)C1 ZINC000336778034 170022388 /nfs/dbraw/zinc/02/23/88/170022388.db2.gz KFTMDVOLWASZIW-AVGNSLFASA-N 2 0 224.392 2.495 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@H]2CSC2(C)C)[C@H](C)C1 ZINC000336779648 170022880 /nfs/dbraw/zinc/02/28/80/170022880.db2.gz PABRWJZNXNEKRN-WOPDTQHZSA-N 2 0 242.432 2.200 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCN2C(C)(C)C)CCO1 ZINC000657524778 411542120 /nfs/dbraw/zinc/54/21/20/411542120.db2.gz LRPJGQVJVDUYMO-AGIUHOORSA-N 2 0 240.391 2.016 20 0 BEADRP CC[NH2+]CC1CC[NH+](Cc2cnccc2C)CC1 ZINC000135502151 170111644 /nfs/dbraw/zinc/11/16/44/170111644.db2.gz WJAYKVWPMRIITI-UHFFFAOYSA-N 2 0 247.386 2.212 20 0 BEADRP CC[NH2+]CC1CC[NH+]([C@@H](C)c2cccnc2)CC1 ZINC000131463166 170111817 /nfs/dbraw/zinc/11/18/17/170111817.db2.gz YGRYQHBTCVSWJR-ZDUSSCGKSA-N 2 0 247.386 2.464 20 0 BEADRP CC[NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000034819469 170141821 /nfs/dbraw/zinc/14/18/21/170141821.db2.gz WMOUEPBSGXJGNB-LBPRGKRZSA-N 2 0 236.359 2.298 20 0 BEADRP c1cc(CC[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)co1 ZINC000657653330 411570332 /nfs/dbraw/zinc/57/03/32/411570332.db2.gz JJZJZAPHNIFSGK-KGLIPLIRSA-N 2 0 234.343 2.039 20 0 BEADRP c1cc(CC[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)co1 ZINC000657653334 411570348 /nfs/dbraw/zinc/57/03/48/411570348.db2.gz JJZJZAPHNIFSGK-ZIAGYGMSSA-N 2 0 234.343 2.039 20 0 BEADRP CCC[NH+]1CCN(c2[nH+]ccc3[nH]ccc32)CC1 ZINC000663321941 411623962 /nfs/dbraw/zinc/62/39/62/411623962.db2.gz OMCLLFQBFMJAHG-UHFFFAOYSA-N 2 0 244.342 2.095 20 0 BEADRP C[NH2+]CCC[N@H+](C)C[C@@H]1CCOc2ccccc21 ZINC000162078511 487536100 /nfs/dbraw/zinc/53/61/00/487536100.db2.gz ANMMEJOYYLQXDX-ZDUSSCGKSA-N 2 0 248.370 2.094 20 0 BEADRP C[C@]1(C[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)CC1(F)F ZINC000657663457 411576687 /nfs/dbraw/zinc/57/66/87/411576687.db2.gz BOOHCBWMERGZBC-QJPTWQEYSA-N 2 0 244.329 2.248 20 0 BEADRP C1C[C@@H]2[C@H](C1)[C@@H]2[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000657734111 411587656 /nfs/dbraw/zinc/58/76/56/411587656.db2.gz FNPDESKYLFJAOM-XHJNMGKDSA-N 2 0 220.360 2.001 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H]1COC2(CCC2)C1 ZINC000657818674 411605766 /nfs/dbraw/zinc/60/57/66/411605766.db2.gz WSVJIVGSAPVBBB-ZDUSSCGKSA-N 2 0 240.391 2.020 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+][C@H]1CCCSCC1 ZINC000657858925 411612757 /nfs/dbraw/zinc/61/27/57/411612757.db2.gz MHAFNKJBSFTMRO-RYUDHWBXSA-N 2 0 230.421 2.202 20 0 BEADRP CC(C)CC[N@@H+]1CCC[C@@]2(CC[NH+](C)C2)C1 ZINC000660653566 411612967 /nfs/dbraw/zinc/61/29/67/411612967.db2.gz BNPCHSIBLAGYGS-AWEZNQCLSA-N 2 0 224.392 2.450 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCCSCC2)C1 ZINC000657875879 411615303 /nfs/dbraw/zinc/61/53/03/411615303.db2.gz IOJCBXXMDKMEIV-OLZOCXBDSA-N 2 0 242.432 2.204 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+]C2CC(CF)(CF)C2)C1 ZINC000657875876 411615406 /nfs/dbraw/zinc/61/54/06/411615406.db2.gz IODHSKAWOIWAGI-LLVKDONJSA-N 2 0 246.345 2.006 20 0 BEADRP C[N@@H+]1CC[C@]2(C1)CCC[NH+](CCCCF)C2 ZINC000660665140 411615457 /nfs/dbraw/zinc/61/54/57/411615457.db2.gz URKDKPSJZRPULA-ZDUSSCGKSA-N 2 0 228.355 2.154 20 0 BEADRP CC[C@@H](C)[N@@H+]1CCC[C@]2(CC[NH+](C)C2)C1 ZINC000660662366 411615943 /nfs/dbraw/zinc/61/59/43/411615943.db2.gz IXACTWLAMYJZHK-CHWSQXEVSA-N 2 0 210.365 2.203 20 0 BEADRP CC[C@@H](C)[N@@H+]1CCC[C@@]2(CC[NH+](C)C2)C1 ZINC000660662367 411616135 /nfs/dbraw/zinc/61/61/35/411616135.db2.gz IXACTWLAMYJZHK-OLZOCXBDSA-N 2 0 210.365 2.203 20 0 BEADRP C[C@H](c1cccc(F)c1)[N@H+](C)CCC[NH3+] ZINC000133223527 411659157 /nfs/dbraw/zinc/65/91/57/411659157.db2.gz ZWQMLSUWVDFYJN-SNVBAGLBSA-N 2 0 210.296 2.167 20 0 BEADRP CC[C@H](C)[NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000663470554 411668536 /nfs/dbraw/zinc/66/85/36/411668536.db2.gz VBRVOMHKTWJRJU-JSGCOSHPSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1ccc(C[NH2+]CC[C@@H]([NH3+])C(C)C)cc1 ZINC000663497555 411679401 /nfs/dbraw/zinc/67/94/01/411679401.db2.gz BYJBMFOKEBLTFI-CQSZACIVSA-N 2 0 220.360 2.458 20 0 BEADRP C[C@H](CC1CCCC1)[NH2+]CC12CC(C1)C[NH2+]2 ZINC000663497299 411679736 /nfs/dbraw/zinc/67/97/36/411679736.db2.gz CXLOKPZNAFEBQP-LMWSTFAQSA-N 2 0 222.376 2.297 20 0 BEADRP CCCC[C@@H](CC)[NH2+]CC12CC(C1)C[NH2+]2 ZINC000663498552 411681529 /nfs/dbraw/zinc/68/15/29/411681529.db2.gz PWFCBOQEWWUUDB-OTTFEQOBSA-N 2 0 210.365 2.297 20 0 BEADRP COc1cccc(C[NH2+]CC[C@@H]([NH3+])C(C)C)c1 ZINC000663499322 411682824 /nfs/dbraw/zinc/68/28/24/411682824.db2.gz YBGNEUQJCAGHNX-CQSZACIVSA-N 2 0 236.359 2.158 20 0 BEADRP COc1ccccc1C[NH2+]CC[C@@H]([NH3+])C(C)C ZINC000663499339 411683243 /nfs/dbraw/zinc/68/32/43/411683243.db2.gz YIWGXXFJYDEQLO-CYBMUJFWSA-N 2 0 236.359 2.158 20 0 BEADRP COc1ccsc1C[NH2+]CC[C@@H]([NH3+])C(C)C ZINC000663500815 411684078 /nfs/dbraw/zinc/68/40/78/411684078.db2.gz WGYKSCLIXHINCJ-SNVBAGLBSA-N 2 0 242.388 2.220 20 0 BEADRP C[NH2+]C[C@H](C)[NH2+]C[C@H]1CCCC(C)(C)C1 ZINC000663508781 411689387 /nfs/dbraw/zinc/68/93/87/411689387.db2.gz DKTRKYZICCPUJJ-RYUDHWBXSA-N 2 0 212.381 2.400 20 0 BEADRP CCC(CC)(CC)C[NH2+][C@H](C)C[NH2+]C ZINC000663510757 411691683 /nfs/dbraw/zinc/69/16/83/411691683.db2.gz SLBBSNIEKZBVDX-LLVKDONJSA-N 2 0 200.370 2.400 20 0 BEADRP C[C@@H]1C[C@H](C[N@H+](C)C[C@@H]2CC2(C)C)CC[NH2+]1 ZINC000663513127 411694673 /nfs/dbraw/zinc/69/46/73/411694673.db2.gz ILZBCPUDLDCFSU-UPJWGTAASA-N 2 0 224.392 2.352 20 0 BEADRP CC[N@@H+]1CCN(c2[nH+]ccc3[nH]ccc32)C[C@@H]1C ZINC000663743534 411736495 /nfs/dbraw/zinc/73/64/95/411736495.db2.gz BVHGHDBJOSZZDY-NSHDSACASA-N 2 0 244.342 2.093 20 0 BEADRP CC[C@@H](C)C[NH+]1CCC(C[NH+](C)C)CC1 ZINC000336643940 170703421 /nfs/dbraw/zinc/70/34/21/170703421.db2.gz FCNKTUAUUIOCHL-GFCCVEGCSA-N 2 0 212.381 2.306 20 0 BEADRP C(CC[N@@H+]1CC[C@@H]2C[C@@H]2C1)C[NH+]1CC[C@H]2C[C@H]2C1 ZINC000661969473 411926636 /nfs/dbraw/zinc/92/66/36/411926636.db2.gz JNOFWTSCLDFUBB-GEEKYZPCSA-N 2 0 248.414 2.450 20 0 BEADRP C(C[NH+]1CC[C@@H]2C[C@@H]2C1)C[N@@H+]1CC[C@H]2C[C@H]2C1 ZINC000661972374 411929218 /nfs/dbraw/zinc/92/92/18/411929218.db2.gz PVDFFOAKOJUVTO-NMWPEEMBSA-N 2 0 234.387 2.060 20 0 BEADRP CC(C)CC1([NH2+]C[C@H]2CCCN2C)CC1 ZINC000662067554 411969325 /nfs/dbraw/zinc/96/93/25/411969325.db2.gz ZBXNWHIRQFCKFG-GFCCVEGCSA-N 2 0 210.365 2.249 20 0 BEADRP C[NH2+]C[C@H]1CC[N@H+](CCCC2CCC2)C1 ZINC000662244145 412039744 /nfs/dbraw/zinc/03/97/44/412039744.db2.gz DHIFCVGZEZZVHG-CYBMUJFWSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@H]([NH3+])C1CC[NH+](C[C@@H]2C[C@H]3C[C@H]3C2)CC1 ZINC000662244763 412041755 /nfs/dbraw/zinc/04/17/55/412041755.db2.gz HGKWRRHHQRLNMQ-VTPLQMEGSA-N 2 0 222.376 2.092 20 0 BEADRP C[C@H]([NH3+])[C@H]1CCCN(Cc2cc(C3CC3)no2)C1 ZINC000662247416 412045361 /nfs/dbraw/zinc/04/53/61/412045361.db2.gz XVIKZPGJBBTJOT-JQWIXIFHSA-N 2 0 249.358 2.111 20 0 BEADRP CO[C@@H](C[NH2+][C@@](C)(C[NH3+])C(C)C)C1CCCC1 ZINC000662248708 412046693 /nfs/dbraw/zinc/04/66/93/412046693.db2.gz BLKOLIGCVNBZDZ-KBPBESRZSA-N 2 0 242.407 2.155 20 0 BEADRP CN(CC[C@H]1CCC[N@@H+]1C)CC1=CCSC1 ZINC000662262695 412052864 /nfs/dbraw/zinc/05/28/64/412052864.db2.gz CLLZXSALOBYPKK-CYBMUJFWSA-N 2 0 240.416 2.076 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+]C[C@H]1CC[N@H+](CC)C1 ZINC000308937986 171058485 /nfs/dbraw/zinc/05/84/85/171058485.db2.gz LKKPIDGUGLGYST-JHJVBQTASA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)=CCC[N@@H+]1CCC[C@@H](CC[NH3+])C1 ZINC000662272780 412064513 /nfs/dbraw/zinc/06/45/13/412064513.db2.gz POBGOYJCNKEADM-ZDUSSCGKSA-N 2 0 210.365 2.404 20 0 BEADRP C1=CCC(C[NH+]2CCC([C@@H]3CCC[NH2+]3)CC2)C1 ZINC000662274246 412065603 /nfs/dbraw/zinc/06/56/03/412065603.db2.gz GVAHOBWEJVYXPO-HNNXBMFYSA-N 2 0 234.387 2.417 20 0 BEADRP CC(C)=CCC[N@@H+]1CC[C@@H]2[NH2+]CC[C@@H]2C1 ZINC000662274740 412067429 /nfs/dbraw/zinc/06/74/29/412067429.db2.gz WPSLGAKCNXRNBY-OLZOCXBDSA-N 2 0 208.349 2.027 20 0 BEADRP C1=CCC(C[N@@H+]2CCC[C@@H]([C@H]3CC[NH2+]C3)C2)C1 ZINC000662275284 412067746 /nfs/dbraw/zinc/06/77/46/412067746.db2.gz YVTBUCACEUDQEM-LSDHHAIUSA-N 2 0 234.387 2.274 20 0 BEADRP C[NH2+]CCC[N@H+](C)C[C@H](OC)C1CCCCC1 ZINC000662280341 412070683 /nfs/dbraw/zinc/07/06/83/412070683.db2.gz COGZYOAMPPJVGR-AWEZNQCLSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)=CCC[NH+]1CCC(CC[NH3+])CC1 ZINC000662284998 412077845 /nfs/dbraw/zinc/07/78/45/412077845.db2.gz TVUQOUVTYQFOHA-UHFFFAOYSA-N 2 0 210.365 2.404 20 0 BEADRP C[C@@H]1CCC[N@H+](CC2CC=CC2)[C@@H]1CC[NH3+] ZINC000662285852 412077224 /nfs/dbraw/zinc/07/72/24/412077224.db2.gz NSCGGZTULOXDKW-TZMCWYRMSA-N 2 0 222.376 2.402 20 0 BEADRP C[C@@H]1C[C@H](C)[N@H+](CC2CC=CC2)C[C@@H]1C[NH3+] ZINC000662281969 412072000 /nfs/dbraw/zinc/07/20/00/412072000.db2.gz AHOSPJDAPAEIIT-DYEKYZERSA-N 2 0 222.376 2.258 20 0 BEADRP C[C@@H]1C[C@@H](C)[N@H+](CC2CC=CC2)C[C@@H]1C[NH3+] ZINC000662281967 412072147 /nfs/dbraw/zinc/07/21/47/412072147.db2.gz AHOSPJDAPAEIIT-BZPMIXESSA-N 2 0 222.376 2.258 20 0 BEADRP CC[C@@H](CC(F)F)C[N@H+](C)CCC[NH2+]C ZINC000662282452 412072588 /nfs/dbraw/zinc/07/25/88/412072588.db2.gz VHVQEGGIQIAKLC-JTQLQIEISA-N 2 0 222.323 2.209 20 0 BEADRP Cc1ccc2c(c1)C[N@@H+](CC[C@H]1CC[NH2+]C1)CC2 ZINC000662298807 412085668 /nfs/dbraw/zinc/08/56/68/412085668.db2.gz HEUPCZZYDOUCRB-CQSZACIVSA-N 2 0 244.382 2.353 20 0 BEADRP CCC[NH+]1CCC([C@H]2CCC[NH2+]C2)CC1 ZINC000662290496 412079945 /nfs/dbraw/zinc/07/99/45/412079945.db2.gz VVXGOYONSMFYRO-ZDUSSCGKSA-N 2 0 210.365 2.108 20 0 BEADRP CC[C@H](C)[C@@H](C)[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000037485308 171365861 /nfs/dbraw/zinc/36/58/61/171365861.db2.gz OZWIZDBLMKUSEG-XQQFMLRXSA-N 2 0 224.392 2.495 20 0 BEADRP CC[C@H](C)[C@@H](C)[NH2+]C[C@@H]1CC[N@H+](CC)C1 ZINC000037484271 171365960 /nfs/dbraw/zinc/36/59/60/171365960.db2.gz PPFDCIHSNHBGOP-XQQFMLRXSA-N 2 0 212.381 2.352 20 0 BEADRP CC[C@H](C)[C@@H](C[NH2+][C@H](C)CCCC[NH3+])OC ZINC000362976039 171369160 /nfs/dbraw/zinc/36/91/60/171369160.db2.gz IWSNXMWWMCQSCG-YNEHKIRRSA-N 2 0 230.396 2.155 20 0 BEADRP [NH3+]CC12CC(C1)CN2[C@H]1CCc2ccc(F)cc21 ZINC000662305061 412089325 /nfs/dbraw/zinc/08/93/25/412089325.db2.gz XTNNUNRYJXLJMH-CUMGRINNSA-N 2 0 246.329 2.236 20 0 BEADRP CC[N@@H+](Cc1ccc(C)cc1)C[C@@H]1CC[NH2+]C1 ZINC000662304068 412089701 /nfs/dbraw/zinc/08/97/01/412089701.db2.gz FAPGJGHAOHAYOF-OAHLLOKOSA-N 2 0 232.371 2.426 20 0 BEADRP C[C@@H]1CCCC[C@H]1C[N@@H+]1CC2CC1(C[NH3+])C2 ZINC000662306312 412090559 /nfs/dbraw/zinc/09/05/59/412090559.db2.gz QEZUUWLVEZLVRM-ZIHBUVQPSA-N 2 0 222.376 2.236 20 0 BEADRP CC[C@@H]1CCC[C@H](C)[N@@H+]1C[C@@H]1CC[NH2+]C1 ZINC000662318856 412097565 /nfs/dbraw/zinc/09/75/65/412097565.db2.gz HRBYOMJKJHCOBF-YNEHKIRRSA-N 2 0 210.365 2.249 20 0 BEADRP C(CC1CC[NH2+]CC1)C[N@@H+]1CC[C@H]2C[C@H]2C1 ZINC000662316303 412097757 /nfs/dbraw/zinc/09/77/57/412097757.db2.gz ZOJKMASOOSXINP-KBPBESRZSA-N 2 0 222.376 2.108 20 0 BEADRP C(C[N@@H+]1CCC[C@@H](C2CCC2)C1)[C@H]1CC[NH2+]C1 ZINC000662317275 412098456 /nfs/dbraw/zinc/09/84/56/412098456.db2.gz OBGLBTOOXMSJLK-UKRRQHHQSA-N 2 0 236.403 2.498 20 0 BEADRP C[C@@H]1CCC[N@H+](CC2CC2)[C@@H]1CCC[NH3+] ZINC000662316706 412098698 /nfs/dbraw/zinc/09/86/98/412098698.db2.gz MGPNIKJEYXWDSC-DGCLKSJQSA-N 2 0 210.365 2.236 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCO[C@@H](CCC[NH+](C)C)C1 ZINC000662319147 412099146 /nfs/dbraw/zinc/09/91/46/412099146.db2.gz FMIAHFDZJBGLFE-KBPBESRZSA-N 2 0 242.407 2.075 20 0 BEADRP [NH3+]CCC[N@@H+]1CCCC[C@H]1CC1CCC1 ZINC000662319954 412100394 /nfs/dbraw/zinc/10/03/94/412100394.db2.gz RFLPLXHPWOOUDO-ZDUSSCGKSA-N 2 0 210.365 2.380 20 0 BEADRP CC[C@H](COCC1CC1)[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000665236513 412175797 /nfs/dbraw/zinc/17/57/97/412175797.db2.gz OIVGIZYCBDEIEF-MGPQQGTHSA-N 2 0 240.391 2.051 20 0 BEADRP c1cc2cc(C[NH2+]C3CC[NH2+]CC3)ccc2o1 ZINC000665238295 412178367 /nfs/dbraw/zinc/17/83/67/412178367.db2.gz VKBYGWOZYRSXFE-UHFFFAOYSA-N 2 0 230.311 2.274 20 0 BEADRP CC[C@H](C)CC[NH2+][C@H]1CC[NH2+]CC[C@@H]1C ZINC000665238192 412178864 /nfs/dbraw/zinc/17/88/64/412178864.db2.gz SVKKCHKVNNVKOY-AVGNSLFASA-N 2 0 212.381 2.400 20 0 BEADRP Cc1ccncc1CC[NH2+]C1CCC(C[NH3+])CC1 ZINC000665239681 412179781 /nfs/dbraw/zinc/17/97/81/412179781.db2.gz XHLFGTZHDDEPBJ-UHFFFAOYSA-N 2 0 247.386 2.040 20 0 BEADRP Cc1ccncc1CC[NH2+][C@H]1CCCC[C@H]1C[NH3+] ZINC000665239754 412181212 /nfs/dbraw/zinc/18/12/12/412181212.db2.gz YNVZVJKNOIVKDU-ZFWWWQNUSA-N 2 0 247.386 2.040 20 0 BEADRP Cc1ccncc1CC[NH2+][C@@H]1CCCC[C@@H]1C[NH3+] ZINC000665239753 412181307 /nfs/dbraw/zinc/18/13/07/412181307.db2.gz YNVZVJKNOIVKDU-UKRRQHHQSA-N 2 0 247.386 2.040 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H]2CCC23CCC3)CCCC1 ZINC000665246367 412190563 /nfs/dbraw/zinc/19/05/63/412190563.db2.gz CTYDJGMRQWYLTL-LLVKDONJSA-N 2 0 208.349 2.180 20 0 BEADRP [NH3+]C1(C[NH2+][C@H]2CC[C@@H]2C2CCC2)CCCC1 ZINC000665246385 412191117 /nfs/dbraw/zinc/19/11/17/412191117.db2.gz CYZYWHRHZQJPDV-OLZOCXBDSA-N 2 0 222.376 2.426 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H]2CC[C@@H]2C2CCC2)CCCC1 ZINC000665246384 412191343 /nfs/dbraw/zinc/19/13/43/412191343.db2.gz CYZYWHRHZQJPDV-CHWSQXEVSA-N 2 0 222.376 2.426 20 0 BEADRP CC(C)[C@@H]([NH2+]CC1([NH3+])CCCC1)C1CC1 ZINC000665247613 412192578 /nfs/dbraw/zinc/19/25/78/412192578.db2.gz GCZNKLLCEZWJLA-GFCCVEGCSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)(F)CC[NH2+][C@@H]1CCCC[C@@H]1C[NH3+] ZINC000665261680 412204037 /nfs/dbraw/zinc/20/40/37/412204037.db2.gz JJTQZOQETHYUIR-GHMZBOCLSA-N 2 0 216.344 2.232 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]CCC(C)(C)F ZINC000665261538 412204871 /nfs/dbraw/zinc/20/48/71/412204871.db2.gz FNNYICOOCBCHCO-MNOVXSKESA-N 2 0 216.344 2.102 20 0 BEADRP c1ccc([C@H]2CC[C@H]2[NH2+]C2CC[NH2+]CC2)cc1 ZINC000665273828 412215370 /nfs/dbraw/zinc/21/53/70/412215370.db2.gz DYNZBXGDVPGNEJ-HUUCEWRRSA-N 2 0 230.355 2.274 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]C[C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000665263140 412205921 /nfs/dbraw/zinc/20/59/21/412205921.db2.gz GRTOIHAKMMHOSB-WJTVCTBASA-N 2 0 210.365 2.138 20 0 BEADRP C[C@H]([NH2+]CCC(C)(C)F)[C@H]1CCCC[NH2+]1 ZINC000665262237 412206133 /nfs/dbraw/zinc/20/61/33/412206133.db2.gz WTRYQWWNUNMERP-WDEREUQCSA-N 2 0 216.344 2.245 20 0 BEADRP C[C@@H]1CCC[C@H](C[NH2+][C@@H]2CCCC[C@H]2C[NH3+])O1 ZINC000665265182 412208368 /nfs/dbraw/zinc/20/83/68/412208368.db2.gz RMCLGTNGSZFTPN-XJFOESAGSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H]1CCC[C@H](C[NH2+][C@H]2CCCC[C@H]2C[NH3+])O1 ZINC000665265180 412209378 /nfs/dbraw/zinc/20/93/78/412209378.db2.gz RMCLGTNGSZFTPN-RQJABVFESA-N 2 0 240.391 2.051 20 0 BEADRP C[C@H]([NH2+]CC[C@@]1(C)CC1(F)F)[C@@H]1CCC[NH2+]1 ZINC000665267280 412210214 /nfs/dbraw/zinc/21/02/14/412210214.db2.gz TXKFEXDWFCFLPH-DCAQKATOSA-N 2 0 232.318 2.152 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+][C@@H](C)C1C[NH2+]C1)[C@@H](C)C2 ZINC000665272483 412213228 /nfs/dbraw/zinc/21/32/28/412213228.db2.gz GFSCIPORJXSFBF-MQIPJXDCSA-N 2 0 244.382 2.426 20 0 BEADRP COC1CC(CC[NH2+][C@@H]2CCCCC[C@H]2[NH3+])C1 ZINC000665229853 412167814 /nfs/dbraw/zinc/16/78/14/412167814.db2.gz DYQAVZQTQQNXGL-NWINJMCUSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@@H](C)c1ccccn1 ZINC000665232021 412170408 /nfs/dbraw/zinc/17/04/08/412170408.db2.gz DPANHXFLQXCWND-CHWSQXEVSA-N 2 0 235.375 2.292 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCCC[C@@H]1C[NH3+])c1ccccn1 ZINC000665232384 412170474 /nfs/dbraw/zinc/17/04/74/412170474.db2.gz MBXAMWFBBYHHHM-NFAWXSAZSA-N 2 0 247.386 2.292 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CCc1noc2ccccc12 ZINC000665231879 412170702 /nfs/dbraw/zinc/17/07/02/412170702.db2.gz ABCAZDPKJYFCDC-GHMZBOCLSA-N 2 0 247.342 2.086 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+]CC1=CCCC1 ZINC000665274165 412217242 /nfs/dbraw/zinc/21/72/42/412217242.db2.gz LHHOXQVAEMYHHW-CHWSQXEVSA-N 2 0 208.349 2.204 20 0 BEADRP CO[C@@H](C[NH2+][C@@H](C)CCCC[NH3+])C1CCCC1 ZINC000665275710 412219084 /nfs/dbraw/zinc/21/90/84/412219084.db2.gz PSUVFVPDEKRSLI-JSGCOSHPSA-N 2 0 242.407 2.299 20 0 BEADRP CC1(C)C[C@]1(C)[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000665275446 412219620 /nfs/dbraw/zinc/21/96/20/412219620.db2.gz KYCGBLPQBPLLGP-CZXHOFHRSA-N 2 0 222.376 2.153 20 0 BEADRP FC(F)C1CCC([NH2+]CC23CC(C2)C[NH2+]3)CC1 ZINC000665279725 412222770 /nfs/dbraw/zinc/22/27/70/412222770.db2.gz KLXAVSNKWVSHNK-UHFFFAOYSA-N 2 0 244.329 2.152 20 0 BEADRP C[C@H]1CC(C)(C)C[C@@H]1[NH2+]CC12CC(C1)C[NH2+]2 ZINC000665279708 412223182 /nfs/dbraw/zinc/22/31/82/412223182.db2.gz KHYUVWHGHPJYED-ATWGWHJKSA-N 2 0 222.376 2.153 20 0 BEADRP COCC[C@@H]1CCC[C@H]1[NH2+]CC[C@@H]([NH3+])C(C)C ZINC000665282233 412228084 /nfs/dbraw/zinc/22/80/84/412228084.db2.gz UCBTYBHGPSTFQW-BFHYXJOUSA-N 2 0 242.407 2.155 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CCCc1ccco1 ZINC000665283887 412229591 /nfs/dbraw/zinc/22/95/91/412229591.db2.gz WRWWWHOKCDRVGE-GFCCVEGCSA-N 2 0 224.348 2.319 20 0 BEADRP COc1cccc(C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)c1C ZINC000665294075 412238738 /nfs/dbraw/zinc/23/87/38/412238738.db2.gz HNEMULQUUMDAGG-UONOGXRCSA-N 2 0 248.370 2.363 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@@H]1CC[C@@H]1C1CCC1 ZINC000309909411 172428759 /nfs/dbraw/zinc/42/87/59/172428759.db2.gz LTJTVPRCEDSZIW-ZIAGYGMSSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)C1 ZINC000230402543 487625715 /nfs/dbraw/zinc/62/57/15/487625715.db2.gz NWRYZZCICDSAIN-YVECIDJPSA-N 2 0 210.365 2.282 20 0 BEADRP C[N@@H+]1CCC[C@@H]2C[NH+](CCC3CC3)CC[C@H]21 ZINC000335904939 173036376 /nfs/dbraw/zinc/03/63/76/173036376.db2.gz NYEYWFWAYBDVLA-ZIAGYGMSSA-N 2 0 222.376 2.203 20 0 BEADRP C[N@@H+]1CCC[C@]2(CC[NH+](CCCCF)C2)C1 ZINC000339441119 173061761 /nfs/dbraw/zinc/06/17/61/173061761.db2.gz OSHQBIGKXWBNBW-ZDUSSCGKSA-N 2 0 228.355 2.154 20 0 BEADRP C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cc2ccco2)C1 ZINC000290372145 173136874 /nfs/dbraw/zinc/13/68/74/173136874.db2.gz HMYDIICSMWIZDL-TZMCWYRMSA-N 2 0 234.343 2.196 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C[C@@H]2CC2(C)C)[C@@H]2CCC[C@@H]21 ZINC000353399067 173151596 /nfs/dbraw/zinc/15/15/96/173151596.db2.gz ANQSOZWLXUWSGI-XUXIUFHCSA-N 2 0 236.403 2.495 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CC(C)(C)C)[C@H]2CCC[C@H]21 ZINC000368600184 173152344 /nfs/dbraw/zinc/15/23/44/173152344.db2.gz AYLGWYYKZBCPIR-FRRDWIJNSA-N 2 0 224.392 2.495 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]Cc2cccnc2)[C@H]2CCC[C@H]21 ZINC000367620691 173152753 /nfs/dbraw/zinc/15/27/53/173152753.db2.gz QUGOVTIOUXRJRX-QLFBSQMISA-N 2 0 245.370 2.044 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]Cc2cccnc2)[C@@H]2CCC[C@@H]21 ZINC000367620690 173153167 /nfs/dbraw/zinc/15/31/67/173153167.db2.gz QUGOVTIOUXRJRX-KKUMJFAQSA-N 2 0 245.370 2.044 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]Cc2ccco2)[C@@H]2CCC[C@@H]21 ZINC000367619979 173153581 /nfs/dbraw/zinc/15/35/81/173153581.db2.gz XMQUOFYVMVJZKM-IHRRRGAJSA-N 2 0 234.343 2.242 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]Cc2ccoc2)[C@@H]2CCC[C@@H]21 ZINC000367527913 173153918 /nfs/dbraw/zinc/15/39/18/173153918.db2.gz UHCYEEHGFMMIJS-IHRRRGAJSA-N 2 0 234.343 2.242 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CC2(C)C)[C@H]2CCC[C@@H]21 ZINC000336726545 173155102 /nfs/dbraw/zinc/15/51/02/173155102.db2.gz CCSCJFYWAXFXHA-MROQNXINSA-N 2 0 222.376 2.247 20 0 BEADRP C[NH2+]C1CC[NH+](C[C@@H](C)CC(C)C)CC1 ZINC000300885462 173323062 /nfs/dbraw/zinc/32/30/62/173323062.db2.gz JISAGAPJBAVDGJ-LBPRGKRZSA-N 2 0 212.381 2.352 20 0 BEADRP C[NH2+]C1CC[NH+](C[C@H]2CCC[C@@H](C)C2)CC1 ZINC000234346216 173323219 /nfs/dbraw/zinc/32/32/19/173323219.db2.gz PNKGTKHDIOWYRG-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH2+]C1CC[NH+](C[C@@H]2CCCC[C@H]2C)CC1 ZINC000042864248 173323384 /nfs/dbraw/zinc/32/33/84/173323384.db2.gz SGTDZEQRHDGHTK-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH2+]CC1CC[NH+](CC2CCCC2)CC1 ZINC000051756249 173338568 /nfs/dbraw/zinc/33/85/68/173338568.db2.gz BWPUUQSYDAZBTE-UHFFFAOYSA-N 2 0 210.365 2.108 20 0 BEADRP C[NH2+]CCC[N@H+](C)[C@H]1CCc2ccccc2C1 ZINC000124798858 173346757 /nfs/dbraw/zinc/34/67/57/173346757.db2.gz MCSHONRMXBZQES-HNNXBMFYSA-N 2 0 232.371 2.085 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](CC2CCC(C)CC2)C1 ZINC000063145791 173369905 /nfs/dbraw/zinc/36/99/05/173369905.db2.gz IKBLZEIVXOJSKB-RUXDESIVSA-N 2 0 224.392 2.354 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@@H+]([C@H](C)c2ccccc2)C1 ZINC000251526907 173370446 /nfs/dbraw/zinc/37/04/46/173370446.db2.gz LZWHOWKJRAMZKN-OLZOCXBDSA-N 2 0 218.344 2.289 20 0 BEADRP C[NH2+]C[C@@H]1CCN(c2cc[nH+]c3ccccc32)C1 ZINC000071147881 173370747 /nfs/dbraw/zinc/37/07/47/173370747.db2.gz PHUNMXKKBGJOCG-LBPRGKRZSA-N 2 0 241.338 2.281 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](C[C@@H](C)CC(C)C)C1 ZINC000300965187 173370998 /nfs/dbraw/zinc/37/09/98/173370998.db2.gz RLIJABTYJGVGLW-STQMWFEESA-N 2 0 212.381 2.210 20 0 BEADRP C[NH2+]C[C@H]1CCC[N@H+](Cc2ccc(C)cc2)C1 ZINC000011888690 173378818 /nfs/dbraw/zinc/37/88/18/173378818.db2.gz NBDZLTAQQKGRPX-OAHLLOKOSA-N 2 0 232.371 2.426 20 0 BEADRP C[NH2+]C[C@H]1CC[N@@H+]([C@@H]2CCc3ccc(F)cc32)C1 ZINC000336578217 173382070 /nfs/dbraw/zinc/38/20/70/173382070.db2.gz XWAMORDMIVXZQN-IAQYHMDHSA-N 2 0 248.345 2.354 20 0 BEADRP C[NH2+]C[C@H]1CC[N@H+](Cc2ccc(C)cc2C)C1 ZINC000071142056 173382181 /nfs/dbraw/zinc/38/21/81/173382181.db2.gz HUAYMWCXJAUOTH-CQSZACIVSA-N 2 0 232.371 2.345 20 0 BEADRP COCCC(C)(C)C[NH2+][C@@H]1CCCC[C@@H]1C[NH3+] ZINC000234682331 174143900 /nfs/dbraw/zinc/14/39/00/174143900.db2.gz AGCYRJWHSURBTJ-CHWSQXEVSA-N 2 0 242.407 2.156 20 0 BEADRP COc1ccc(C)cc1C[N@@H+]1C[C@H](C[NH3+])C[C@@H]1C ZINC000131691691 175075459 /nfs/dbraw/zinc/07/54/59/175075459.db2.gz NYKAIWCVHBKNNN-STQMWFEESA-N 2 0 248.370 2.173 20 0 BEADRP COc1ccc(CC[NH2+]C2CCC([NH3+])CC2)cc1 ZINC000094074176 175091598 /nfs/dbraw/zinc/09/15/98/175091598.db2.gz IIUMWUWDIHYZRA-UHFFFAOYSA-N 2 0 248.370 2.097 20 0 BEADRP COc1ccc(C[N@@H+]2CCC[C@H]([C@@H](C)[NH3+])C2)cc1 ZINC000107954025 175099875 /nfs/dbraw/zinc/09/98/75/175099875.db2.gz LMXRJYXRGGDZGW-OCCSQVGLSA-N 2 0 248.370 2.254 20 0 BEADRP COc1ccc([C@H](C)[NH2+]C[C@H](C)C[NH3+])cc1F ZINC000310540339 175188020 /nfs/dbraw/zinc/18/80/20/175188020.db2.gz SJWOBOJQRKOYRD-ZJUUUORDSA-N 2 0 240.322 2.080 20 0 BEADRP COc1ccc([C@H](C)[NH2+]CCCC[NH3+])cc1F ZINC000037715113 175188548 /nfs/dbraw/zinc/18/85/48/175188548.db2.gz MDQXQAMJOGBGFY-JTQLQIEISA-N 2 0 240.322 2.224 20 0 BEADRP COc1cccc(CCC[NH2+]CC2([NH3+])CCC2)c1 ZINC000342097486 175251820 /nfs/dbraw/zinc/25/18/20/175251820.db2.gz HVLCWYRANSLSAZ-UHFFFAOYSA-N 2 0 248.370 2.099 20 0 BEADRP COc1cccc(C[N@@H+]2CC[C@@H](C)[C@@H](C[NH3+])C2)c1 ZINC000163440291 175260045 /nfs/dbraw/zinc/26/00/45/175260045.db2.gz NXWQVNKJBIOQMK-OCCSQVGLSA-N 2 0 248.370 2.112 20 0 BEADRP COc1cccc(C[N@@H+]2CC[C@H](C)[C@@H](C[NH3+])C2)c1 ZINC000163440407 175260619 /nfs/dbraw/zinc/26/06/19/175260619.db2.gz NXWQVNKJBIOQMK-JSGCOSHPSA-N 2 0 248.370 2.112 20 0 BEADRP COc1cccc(C[NH2+]CC2CC[NH+](C)CC2)c1 ZINC000044515295 175263480 /nfs/dbraw/zinc/26/34/80/175263480.db2.gz IZMCSXPHDACOBP-UHFFFAOYSA-N 2 0 248.370 2.127 20 0 BEADRP COc1cccc(C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)c1 ZINC000093214543 175266615 /nfs/dbraw/zinc/26/66/15/175266615.db2.gz SSJFJUWKCOAKFB-CHWSQXEVSA-N 2 0 234.343 2.055 20 0 BEADRP COc1cccc(C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)c1 ZINC000093214544 175267821 /nfs/dbraw/zinc/26/78/21/175267821.db2.gz SSJFJUWKCOAKFB-OLZOCXBDSA-N 2 0 234.343 2.055 20 0 BEADRP COc1cccc(C[NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)c1 ZINC000090720205 175267892 /nfs/dbraw/zinc/26/78/92/175267892.db2.gz CDCILXJLVUVTOC-JSGCOSHPSA-N 2 0 248.370 2.268 20 0 BEADRP COc1cccc([C@H](C)[N@@H+]2CC[C@H]([NH3+])[C@@H](C)C2)c1 ZINC000094338948 175292330 /nfs/dbraw/zinc/29/23/30/175292330.db2.gz VKZRCAVKEOWNQG-HUBLWGQQSA-N 2 0 248.370 2.425 20 0 BEADRP COc1cccc([C@H](C)[N@@H+]2CC[C@H]([NH3+])[C@H](C)C2)c1 ZINC000094338947 175292749 /nfs/dbraw/zinc/29/27/49/175292749.db2.gz VKZRCAVKEOWNQG-XUJVJEKNSA-N 2 0 248.370 2.425 20 0 BEADRP COc1ccccc1C[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000093209371 175330611 /nfs/dbraw/zinc/33/06/11/175330611.db2.gz FBMQDGFQGCOZEV-CHWSQXEVSA-N 2 0 234.343 2.055 20 0 BEADRP COc1ccccc1[C@@H](C)[NH2+]CC1CC[NH2+]CC1 ZINC000094009540 175344190 /nfs/dbraw/zinc/34/41/90/175344190.db2.gz PORUBJCIYQFLAY-GFCCVEGCSA-N 2 0 248.370 2.345 20 0 BEADRP CSC1(C[NH2+][C@H](C)CCCC[NH3+])CCC1 ZINC000308846272 175453729 /nfs/dbraw/zinc/45/37/29/175453729.db2.gz LLYBFOVXFIRVHT-LLVKDONJSA-N 2 0 230.421 2.379 20 0 BEADRP CSC1(C[NH2+][C@H]2CCC[NH2+]CC2)CCC1 ZINC000235117354 175454074 /nfs/dbraw/zinc/45/40/74/175454074.db2.gz DQZWXGIKJLAFHC-NSHDSACASA-N 2 0 228.405 2.004 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)CCCC[NH3+])c1ccncc1 ZINC000309252834 175663959 /nfs/dbraw/zinc/66/39/59/175663959.db2.gz AMPHVSAJWGBADS-NWDGAFQWSA-N 2 0 221.348 2.250 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@@H](C)Cc1cccs1 ZINC000336667708 175666431 /nfs/dbraw/zinc/66/64/31/175666431.db2.gz DVLVZVFIKPUURO-QWRGUYRKSA-N 2 0 226.389 2.396 20 0 BEADRP C[C@@H](C[NH2+]CCCC[NH3+])c1ccccc1 ZINC000037715142 175732123 /nfs/dbraw/zinc/73/21/23/175732123.db2.gz AGUUFHYHIXBTEJ-LBPRGKRZSA-N 2 0 206.333 2.119 20 0 BEADRP C[C@@H]([NH3+])[C@@H]1CCN(c2cc[nH+]c3ccccc32)C1 ZINC000162207192 175811408 /nfs/dbraw/zinc/81/14/08/175811408.db2.gz HHVHTRMAZJWUAE-VXGBXAGGSA-N 2 0 241.338 2.408 20 0 BEADRP C[N@H+](C[C@@H]1CC[NH2+]C1)C1CCC(C)(C)CC1 ZINC000087287466 487631859 /nfs/dbraw/zinc/63/18/59/487631859.db2.gz DILDPKCBDLHIKE-GFCCVEGCSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H](c1ccccc1)[N@@H+]1CC[C@@](C)(C[NH3+])C1 ZINC000238455247 176021670 /nfs/dbraw/zinc/02/16/70/176021670.db2.gz NKAROOLZORJQCJ-JSGCOSHPSA-N 2 0 218.344 2.418 20 0 BEADRP C[C@@H]([NH3+])C1CC[NH+]([C@@H](C)c2ccccn2)CC1 ZINC000104137723 176028127 /nfs/dbraw/zinc/02/81/27/176028127.db2.gz ODTFPNSIYJQEDM-NEPJUHHUSA-N 2 0 233.359 2.202 20 0 BEADRP C[C@@H]1CN(C)C[C@@H]1[NH2+][C@H]1CCCC[C@H]1C ZINC000336770774 176082018 /nfs/dbraw/zinc/08/20/18/176082018.db2.gz WZJZDPWMTVXXRJ-NDBYEHHHSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@@H]1CCCC[C@H]1C[NH2+]CCC[NH+](C)C ZINC000122588756 176084360 /nfs/dbraw/zinc/08/43/60/176084360.db2.gz VBUDBSQSGAORFM-OLZOCXBDSA-N 2 0 212.381 2.354 20 0 BEADRP C[C@@H]1CCC[C@@H](C)[NH+]1CC1CC[NH2+]CC1 ZINC000019487172 176115408 /nfs/dbraw/zinc/11/54/08/176115408.db2.gz ZTYJXSLBHSERQO-VXGBXAGGSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]C2CC[NH2+]CC2)[C@@H]1C ZINC000038040603 176122522 /nfs/dbraw/zinc/12/25/22/176122522.db2.gz GLILUBLVMICMFH-NQBHXWOUSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1CCC[C@H](CC[N@@H+]2CC[C@@H](C[NH3+])C2)C1 ZINC000226869778 176136427 /nfs/dbraw/zinc/13/64/27/176136427.db2.gz BNYFRJVVAAVKJT-MCIONIFRSA-N 2 0 224.392 2.483 20 0 BEADRP C[C@@H]1CCC[C@H]([N@H+](C)CC2CC[NH2+]CC2)C1 ZINC000042495694 176140751 /nfs/dbraw/zinc/14/07/51/176140751.db2.gz HUMOLXMHUWORFZ-OCCSQVGLSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CC[C@@H]2CCC[NH2+]C2)C1 ZINC000129458250 176213547 /nfs/dbraw/zinc/21/35/47/176213547.db2.gz PNJMXLHMDUPUEO-FRRDWIJNSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CC[C@@H]2CCC[NH2+]C2)C1 ZINC000129457776 176232933 /nfs/dbraw/zinc/23/29/33/176232933.db2.gz PNJMXLHMDUPUEO-AGIUHOORSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]C[C@H]1CCC(F)(F)C1 ZINC000302212516 176270097 /nfs/dbraw/zinc/27/00/97/176270097.db2.gz XWTJNLFAVVKOJY-WOPDTQHZSA-N 2 0 246.345 2.352 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]Cc1ccccc1 ZINC000242522352 176270446 /nfs/dbraw/zinc/27/04/46/176270446.db2.gz IOHGIIBXOUYHLW-TZMCWYRMSA-N 2 0 218.344 2.116 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+][C@@H]1CC[C@@H](F)C1 ZINC000309798614 176278483 /nfs/dbraw/zinc/27/84/83/176278483.db2.gz QSIZYOUBZNPJIM-VEGXAWMVSA-N 2 0 228.355 2.195 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]C1CC(F)(F)C1 ZINC000336781417 176279120 /nfs/dbraw/zinc/27/91/20/176279120.db2.gz UPZKXKVCIPUXBL-FXPVBKGRSA-N 2 0 232.318 2.102 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]CC1CCC1 ZINC000036908570 176279233 /nfs/dbraw/zinc/27/92/33/176279233.db2.gz JKIVNZGGCZWCHQ-WZRBSPASSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@@H]1C[N@H+](CCC2CCCC2)CC[C@H]1[NH3+] ZINC000251891950 176288202 /nfs/dbraw/zinc/28/82/02/176288202.db2.gz VQPPCRBHGUAXFG-DGCLKSJQSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@H]1C[N@H+](CC[C@@H]2CCC[NH+]2C)C[C@H]1C ZINC000336650835 176292860 /nfs/dbraw/zinc/29/28/60/176292860.db2.gz TYIXCIYRMDZWGD-XQQFMLRXSA-N 2 0 210.365 2.059 20 0 BEADRP C[C@@H]1CCCC[C@H]1C[N@@H+]1CC[C@H]([NH3+])[C@H](C)C1 ZINC000042864363 176297727 /nfs/dbraw/zinc/29/77/27/176297727.db2.gz FSQXNGIFBWULKA-MQYQWHSLSA-N 2 0 224.392 2.482 20 0 BEADRP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@@]1(C)C[NH3+] ZINC000307406153 176306694 /nfs/dbraw/zinc/30/66/94/176306694.db2.gz DCDLJOKASDKHAU-TZMCWYRMSA-N 2 0 218.344 2.103 20 0 BEADRP C[C@@H]1C[N@H+](Cc2cccs2)C[C@@]1(C)C[NH3+] ZINC000309029198 176307603 /nfs/dbraw/zinc/30/76/03/176307603.db2.gz ADWNLQYKYKYUDQ-ZYHUDNBSSA-N 2 0 224.373 2.165 20 0 BEADRP C[C@@H]1C[N@H+](Cc2ccccc2F)C[C@@]1(C)C[NH3+] ZINC000310412693 176307740 /nfs/dbraw/zinc/30/77/40/176307740.db2.gz XDIJBOUYBQIGSH-BXUZGUMPSA-N 2 0 236.334 2.242 20 0 BEADRP C[C@@H]1CSC[C@@H]1[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000297611113 176353016 /nfs/dbraw/zinc/35/30/16/176353016.db2.gz VCFGPLKNTMPXFV-MFKMUULPSA-N 2 0 247.367 2.175 20 0 BEADRP C[C@@H]1C[C@@H](C)C[NH+](CC[C@@H]2CCC[N@@H+]2C)C1 ZINC000124638032 176361482 /nfs/dbraw/zinc/36/14/82/176361482.db2.gz HNXRRYUWJZSYEN-MCIONIFRSA-N 2 0 224.392 2.449 20 0 BEADRP C[C@@H]1C[C@@H](C[NH+]2CCCCCC2)CC[NH2+]1 ZINC000235380928 176369348 /nfs/dbraw/zinc/36/93/48/176369348.db2.gz FVAWEZGWWQQVMN-OLZOCXBDSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@@H]1C[C@@H](C[NH2+]CC2(C)CCC2)CC[NH2+]1 ZINC000235384363 176370156 /nfs/dbraw/zinc/37/01/56/176370156.db2.gz DKVRTHJPIPJZMU-NEPJUHHUSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+]CCC[N@@H+]1CCCC[C@H]1C ZINC000309732274 176395582 /nfs/dbraw/zinc/39/55/82/176395582.db2.gz BLMSQLBBNLNNAT-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC000309506950 176395592 /nfs/dbraw/zinc/39/55/92/176395592.db2.gz WCUPNCZEXPWPDP-DUJLVANISA-N 2 0 222.376 2.247 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000336740522 176395781 /nfs/dbraw/zinc/39/57/81/176395781.db2.gz MIDNCOFZYYCSCA-IWMBGFJWSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+]CC(C)(C)C[NH+]1CCCC1 ZINC000336749555 176395868 /nfs/dbraw/zinc/39/58/68/176395868.db2.gz UDHZSZJALGGDAS-CHWSQXEVSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+][C@@H]1CC[N@H+](C)[C@@H]2CCC[C@@H]21 ZINC000309775593 176398182 /nfs/dbraw/zinc/39/81/82/176398182.db2.gz LPSZJWSLJCBQIJ-DHGKCCLASA-N 2 0 222.376 2.105 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CCCC(F)(F)F ZINC000308876223 176618878 /nfs/dbraw/zinc/61/88/78/176618878.db2.gz UOCUZXGWQAHDMW-SECBINFHSA-N 2 0 226.286 2.436 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H](C)c1cccc(O)c1 ZINC000336649790 176620608 /nfs/dbraw/zinc/62/06/08/176620608.db2.gz HBLUCWYFFVIUTH-GHMZBOCLSA-N 2 0 222.332 2.170 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H]1CCCc2occc21 ZINC000336676057 176621113 /nfs/dbraw/zinc/62/11/13/176621113.db2.gz VNAMMSZKFIPIRN-ZYHUDNBSSA-N 2 0 222.332 2.374 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCC1(C)C)C[NH+]1CCCC1 ZINC000336648480 176683200 /nfs/dbraw/zinc/68/32/00/176683200.db2.gz GEHLQYZNHRLLBE-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1ccccn1 ZINC000227495470 176835351 /nfs/dbraw/zinc/83/53/51/176835351.db2.gz AISNCAHDJMUBRA-ZDUSSCGKSA-N 2 0 247.386 2.464 20 0 BEADRP C[C@H]([NH2+]CCCC[NH+](C)C)c1cccnc1 ZINC000045663321 176843369 /nfs/dbraw/zinc/84/33/69/176843369.db2.gz HOGPEBPIQPEBBK-LBPRGKRZSA-N 2 0 221.348 2.074 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)c1cccnc1)C1CC[NH+](C)CC1 ZINC000037220823 176908772 /nfs/dbraw/zinc/90/87/72/176908772.db2.gz YKSYQNXTHXBJAC-OLZOCXBDSA-N 2 0 247.386 2.463 20 0 BEADRP C[C@H](c1ccccc1)[N@@H+]1CCC[C@H](C[NH3+])C1 ZINC000044527646 177038337 /nfs/dbraw/zinc/03/83/37/177038337.db2.gz NVTLGACRAYICGY-CHWSQXEVSA-N 2 0 218.344 2.418 20 0 BEADRP C[C@H](c1ccccc1)[N@@H+]1CCC[C@@H](C[NH3+])C1 ZINC000114410051 177039435 /nfs/dbraw/zinc/03/94/35/177039435.db2.gz NVTLGACRAYICGY-OLZOCXBDSA-N 2 0 218.344 2.418 20 0 BEADRP C[C@H](c1ccccc1)[N@@H+]1CC[C@@](C)(C[NH3+])C1 ZINC000238405695 177040359 /nfs/dbraw/zinc/04/03/59/177040359.db2.gz NKAROOLZORJQCJ-OCCSQVGLSA-N 2 0 218.344 2.418 20 0 BEADRP C[C@H](c1cccnc1)[N@H+](C)CC1CC[NH2+]CC1 ZINC000094010922 177044653 /nfs/dbraw/zinc/04/46/53/177044653.db2.gz NAMFRWOCWVLKGS-GFCCVEGCSA-N 2 0 233.359 2.074 20 0 BEADRP C[C@@H]1CCC[C@H](C)[N@H+]1CC1CC[NH2+]CC1 ZINC000019487174 177115884 /nfs/dbraw/zinc/11/58/84/177115884.db2.gz ZTYJXSLBHSERQO-TXEJJXNPSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@H]1CCC[C@H](C)[NH+]1CC1CC[NH2+]CC1 ZINC000019487177 177131708 /nfs/dbraw/zinc/13/17/08/177131708.db2.gz ZTYJXSLBHSERQO-RYUDHWBXSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@H]1CCC[C@H]1[NH2+]CC(C)(C)C[NH+](C)C ZINC000083389621 177142073 /nfs/dbraw/zinc/14/20/73/177142073.db2.gz FGSAQLGDUXHPGX-NWDGAFQWSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H]1CC[C@H](C)[N@H+](CCn2ccnc2)C1 ZINC000162117032 177198441 /nfs/dbraw/zinc/19/84/41/177198441.db2.gz UBMLJHCXSSHLNC-RYUDHWBXSA-N 2 0 207.321 2.004 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@@H]2C[C@H](C)[N@H+](C)C[C@@H]2C)C1 ZINC000128504969 177239436 /nfs/dbraw/zinc/23/94/36/177239436.db2.gz JXRCHDMRMSOKSP-IKOXMDCHSA-N 2 0 224.392 2.493 20 0 BEADRP C[C@H]1C[C@@H](C[N@H+](C)CC2CCC2)CC[NH2+]1 ZINC000235697255 177324066 /nfs/dbraw/zinc/32/40/66/177324066.db2.gz XXOBGIURTPNGSY-AAEUAGOBSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]1C[C@@H](C[N@@H+]2CCC(C)(C)C2)CC[NH2+]1 ZINC000235698649 177324291 /nfs/dbraw/zinc/32/42/91/177324291.db2.gz XFVUNXCSFJMTLP-RYUDHWBXSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CC2CCSCC2)CC[N@@H+]1C ZINC000133658516 177330359 /nfs/dbraw/zinc/33/03/59/177330359.db2.gz HSGPWRDXQASNIR-AAEUAGOBSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@H]1C[C@H](C)C[NH+](CCCCCC[NH3+])C1 ZINC000020073483 177358462 /nfs/dbraw/zinc/35/84/62/177358462.db2.gz GDQBXGRTHSJATN-STQMWFEESA-N 2 0 212.381 2.483 20 0 BEADRP C[C@H]1C[C@H](C)C[NH+](CCC2CC[NH2+]CC2)C1 ZINC000026515087 177358654 /nfs/dbraw/zinc/35/86/54/177358654.db2.gz ZFUSEAGMIYQSFG-STQMWFEESA-N 2 0 224.392 2.354 20 0 BEADRP C[C@H]1C[C@H](C[NH3+])C[N@@H+]1CCCC(C)(C)C ZINC000300958958 177361690 /nfs/dbraw/zinc/36/16/90/177361690.db2.gz YFAGVUXRAUIKNV-NWDGAFQWSA-N 2 0 212.381 2.482 20 0 BEADRP C[C@H]1C[C@H](C[NH+](CC2CC2)CC2CC2)CC[NH2+]1 ZINC000235696190 177361791 /nfs/dbraw/zinc/36/17/91/177361791.db2.gz MOOKYWPFFGTPOI-SWLSCSKDSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H]1C[C@H]([NH3+])CC[N@@H+]1CCc1ccccc1 ZINC000049708923 177364599 /nfs/dbraw/zinc/36/45/99/177364599.db2.gz NSBXMYHTQVVHAT-GXTWGEPZSA-N 2 0 218.344 2.041 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CC2CC(F)(F)C2)CC[N@@H+]1C ZINC000309810325 177368902 /nfs/dbraw/zinc/36/89/02/177368902.db2.gz UALWFRSSUWQBJF-GXSJLCMTSA-N 2 0 232.318 2.104 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CC2(C(F)F)CC2)CC[N@@H+]1C ZINC000309810343 177369660 /nfs/dbraw/zinc/36/96/60/177369660.db2.gz UAQJNIJKWHYLAO-VHSXEESVSA-N 2 0 232.318 2.104 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CCc2ccccc2)CC[N@@H+]1C ZINC000129596378 177371048 /nfs/dbraw/zinc/37/10/48/177371048.db2.gz PFOBTMUVZQNKRG-DZGCQCFKSA-N 2 0 232.371 2.301 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCN(C)[C@@H](C)C2)[C@@H]1C ZINC000336702962 177371821 /nfs/dbraw/zinc/37/18/21/177371821.db2.gz QEGHCHDQGXSKQL-MLGHIDQZSA-N 2 0 210.365 2.103 20 0 BEADRP C[C@H]1C[C@H]1C[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000336740521 177381368 /nfs/dbraw/zinc/38/13/68/177381368.db2.gz MIDNCOFZYYCSCA-FEPKRQSRSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@H]1C[C@H]1C[NH2+]C1CCC(C[NH+](C)C)CC1 ZINC000309452238 177381393 /nfs/dbraw/zinc/38/13/93/177381393.db2.gz MVBUFGZQEFOBOT-AHPWVWPOSA-N 2 0 224.392 2.352 20 0 BEADRP Cc1ccsc1C[N@H+]1CC[C@H]([NH3+])C[C@@H]1C ZINC000087310878 487639518 /nfs/dbraw/zinc/63/95/18/487639518.db2.gz CUYFBTRQWPWLET-QWRGUYRKSA-N 2 0 224.373 2.368 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CCC[C@H]1C)[C@@H]1CCC[NH2+]1 ZINC000400678494 224851833 /nfs/dbraw/zinc/85/18/33/224851833.db2.gz WGIWZWNGRBSHMD-LPWJVIDDSA-N 2 0 210.365 2.153 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H](C)[C@@H]2CC2(F)F)CC1 ZINC000666227572 487648239 /nfs/dbraw/zinc/64/82/39/487648239.db2.gz OOLXVPJXBGIWDE-PWSUYJOCSA-N 2 0 246.345 2.494 20 0 BEADRP COCC(C)(C)C[NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000494080718 226260526 /nfs/dbraw/zinc/26/05/26/226260526.db2.gz VJLNAFWSTOVKIU-CHWSQXEVSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H]([NH2+]C[C@]1(C)CCCS1)[C@@H]1CCC[NH2+]1 ZINC000400579510 226346778 /nfs/dbraw/zinc/34/67/78/226346778.db2.gz QGUVFBCZRQGKST-SRVKXCTJSA-N 2 0 228.405 2.002 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC2CCC1CC2)[C@@H]1CCC[NH2+]1 ZINC000400690085 226349648 /nfs/dbraw/zinc/34/96/48/226349648.db2.gz YVEBUJKQOROWDE-FDZXDKCCSA-N 2 0 222.376 2.295 20 0 BEADRP Cc1cccc(CCN[C@@H](C)[C@@H]2CCC[NH2+]2)c1 ZINC000400811999 226351931 /nfs/dbraw/zinc/35/19/31/226351931.db2.gz YSJXEKVUSFIBPO-ZFWWWQNUSA-N 2 0 232.371 2.268 20 0 BEADRP Cc1cccc([C@H](C)N[C@@H](C)[C@@H](C)[NH3+])c1 ZINC000309120137 229361659 /nfs/dbraw/zinc/36/16/59/229361659.db2.gz SVHSMZDENDYQCY-WOPDTQHZSA-N 2 0 206.333 2.381 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+]C[C@H](C)C(C)(C)C ZINC000163005305 487677576 /nfs/dbraw/zinc/67/75/76/487677576.db2.gz NGDZCINGBKVDGB-QWRGUYRKSA-N 2 0 200.370 2.242 20 0 BEADRP FCCCC[N@@H+]1CCC[C@@H](n2ccnc2)C1 ZINC000671680513 487686718 /nfs/dbraw/zinc/68/67/18/487686718.db2.gz IIHADWDXLJJCGX-GFCCVEGCSA-N 2 0 225.311 2.270 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)[C@@H]1C[C@H]1C1CC1 ZINC000527636760 262868086 /nfs/dbraw/zinc/86/80/86/262868086.db2.gz DPTFUOZMFVDAFT-APYUEPQZSA-N 2 0 248.414 2.495 20 0 BEADRP C[N@H+](CC[C@@H]1CC[NH2+]C1)Cc1ccsc1 ZINC000084384769 487706071 /nfs/dbraw/zinc/70/60/71/487706071.db2.gz MFVNTZRXJHHGFK-NSHDSACASA-N 2 0 224.373 2.180 20 0 BEADRP C[C@@H](c1ccncc1)[N@@H+]1CCC[C@@H](CC[NH3+])C1 ZINC000226325629 487711253 /nfs/dbraw/zinc/71/12/53/487711253.db2.gz LNVKLPADSXMBRT-STQMWFEESA-N 2 0 233.359 2.203 20 0 BEADRP CC[C@@H]1C[C@@H]([NH2+]CCC[N@H+](C)C(C)C)CCO1 ZINC000226340005 487714683 /nfs/dbraw/zinc/71/46/83/487714683.db2.gz JIAGANJGGRZTTH-UONOGXRCSA-N 2 0 242.407 2.264 20 0 BEADRP CC(C)C[N@@H+]1CCC[C@@H]([C@H]2CCC[NH2+]2)C1 ZINC000250607516 487735434 /nfs/dbraw/zinc/73/54/34/487735434.db2.gz XHWZSUKNMZALAZ-CHWSQXEVSA-N 2 0 210.365 2.106 20 0 BEADRP CC/C=C/C[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000384814459 487747962 /nfs/dbraw/zinc/74/79/62/487747962.db2.gz CWTLIVADHXJLHD-FYJFLYSWSA-N 2 0 210.365 2.273 20 0 BEADRP c1cc2cnccc2c(C[NH2+]C2CC[NH2+]CC2)c1 ZINC000206917217 487760142 /nfs/dbraw/zinc/76/01/42/487760142.db2.gz WPUNPXWNBMMABC-UHFFFAOYSA-N 2 0 241.338 2.076 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H]2C2CC2)CC[NH2+]1 ZINC000414951286 487773756 /nfs/dbraw/zinc/77/37/56/487773756.db2.gz PNLIRSVKZXACNB-FMKGYKFTSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@@H]2C2CC2)CC[NH2+]1 ZINC000414951289 487773639 /nfs/dbraw/zinc/77/36/39/487773639.db2.gz PNLIRSVKZXACNB-ZRJCITRHSA-N 2 0 222.376 2.295 20 0 BEADRP CCCC(CCC)[NH2+]C[C@]1(COC)CCC[NH2+]1 ZINC000414949505 487773723 /nfs/dbraw/zinc/77/37/23/487773723.db2.gz ZTHIWJSNGOHJKI-AWEZNQCLSA-N 2 0 242.407 2.313 20 0 BEADRP C[C@H](c1ccccc1)[N@H+](C)C[C@H]1CC[NH2+]C1 ZINC000251593337 487774480 /nfs/dbraw/zinc/77/44/80/487774480.db2.gz YAQVUKXLGVEJBT-OLZOCXBDSA-N 2 0 218.344 2.289 20 0 BEADRP C[N@@H+]1CCC[C@H](CC[NH2+][C@@H]2CC[C@@H]2C2CC2)C1 ZINC000459799665 487800218 /nfs/dbraw/zinc/80/02/18/487800218.db2.gz YVRRDOGOSXHFLN-BPLDGKMQSA-N 2 0 236.403 2.497 20 0 BEADRP CC[C@@H]1C[N@@H+]([C@@H](C)c2ccccn2)CC[C@H]1[NH3+] ZINC000251884538 487805566 /nfs/dbraw/zinc/80/55/66/487805566.db2.gz VMGMNDIWKUHLMT-YNEHKIRRSA-N 2 0 233.359 2.202 20 0 BEADRP CC[C@@H]1C[N@H+](Cc2cccc(OC)c2)CC[C@H]1[NH3+] ZINC000251922088 487807866 /nfs/dbraw/zinc/80/78/66/487807866.db2.gz YOBRXQPRMUSGAU-UKRRQHHQSA-N 2 0 248.370 2.254 20 0 BEADRP CC[C@@H]1C[N@H+](Cc2ccccc2OC)CC[C@H]1[NH3+] ZINC000251923471 487807971 /nfs/dbraw/zinc/80/79/71/487807971.db2.gz YQFJSYOITMWXLP-TZMCWYRMSA-N 2 0 248.370 2.254 20 0 BEADRP Cc1ccsc1C[N@H+]1CC[C@H]([NH3+])C[C@H]1C ZINC000227349366 487810361 /nfs/dbraw/zinc/81/03/61/487810361.db2.gz CUYFBTRQWPWLET-MNOVXSKESA-N 2 0 224.373 2.368 20 0 BEADRP [NH3+]CCC[NH2+]C1(c2cccc(Cl)c2)CC1 ZINC000414695396 487818043 /nfs/dbraw/zinc/81/80/43/487818043.db2.gz ALTBHIMRQFEFQY-UHFFFAOYSA-N 2 0 224.735 2.268 20 0 BEADRP CC[C@H](C)[N@H+](CC)CC[C@@H]1CCC[NH2+]C1 ZINC000051918979 487817612 /nfs/dbraw/zinc/81/76/12/487817612.db2.gz OSROTPFDVIGAMR-STQMWFEESA-N 2 0 212.381 2.497 20 0 BEADRP COc1cccc([C@H]2C[C@H](C)C[N@@H+]2CCC[NH3+])c1 ZINC000414740206 487820336 /nfs/dbraw/zinc/82/03/36/487820336.db2.gz KTPNDLRVHIOJJB-SWLSCSKDSA-N 2 0 248.370 2.427 20 0 BEADRP Cc1cccc([C@@H]2CC[N@H+](CCC[NH3+])C2)c1 ZINC000414739952 487820408 /nfs/dbraw/zinc/82/04/08/487820408.db2.gz CMRQNHSLHMBRKK-CQSZACIVSA-N 2 0 218.344 2.133 20 0 BEADRP C[C@H](c1ccncc1)[N@@H+]1C[C@@H]2CCC[C@H]([NH3+])[C@H]2C1 ZINC000252866668 487836910 /nfs/dbraw/zinc/83/69/10/487836910.db2.gz QMCRWCQNUWMDCQ-UNQGMJICSA-N 2 0 245.370 2.202 20 0 BEADRP Cc1ccc(C[N@@H+](C)C[C@@H]2CC[NH2+][C@@H](C)C2)nc1 ZINC000666693931 487861599 /nfs/dbraw/zinc/86/15/99/487861599.db2.gz JIUVLWMVVJYQBQ-UONOGXRCSA-N 2 0 247.386 2.210 20 0 BEADRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]Cc1cccc(F)c1F ZINC000666743844 487869864 /nfs/dbraw/zinc/86/98/64/487869864.db2.gz HAKRREHEDIKUJN-SKDRFNHKSA-N 2 0 240.297 2.182 20 0 BEADRP Cc1ccc(CCC[NH2+][C@@H]2CCC[NH2+]CC2)cn1 ZINC000666857855 487873512 /nfs/dbraw/zinc/87/35/12/487873512.db2.gz MLSWVSPOVXXBAL-OAHLLOKOSA-N 2 0 247.386 2.054 20 0 BEADRP C[C@@H](CC1CCC1)[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000666765796 487873646 /nfs/dbraw/zinc/87/36/46/487873646.db2.gz ZNZVVXIZTZHBPY-AAEUAGOBSA-N 2 0 210.365 2.154 20 0 BEADRP CC(C)CCC[N@@H+]1CC[C@@H](C[NH3+])[C@H](C)C1 ZINC000251664910 642881913 /nfs/dbraw/zinc/88/19/13/642881913.db2.gz HAPWFINZTKCUBV-OLZOCXBDSA-N 2 0 212.381 2.339 20 0 BEADRP c1ccc(C2CC2)c(CN[C@H]2CCC[NH2+]C2)c1 ZINC000666814161 487884647 /nfs/dbraw/zinc/88/46/47/487884647.db2.gz QQIMVEURDSBANP-AWEZNQCLSA-N 2 0 230.355 2.406 20 0 BEADRP C[C@@H](CC[NH3+])[NH2+]Cc1ccccc1C1CC1 ZINC000666831973 487887716 /nfs/dbraw/zinc/88/77/16/487887716.db2.gz XKPJJARTTMLOHA-NSHDSACASA-N 2 0 218.344 2.391 20 0 BEADRP C[C@H](CC[NH3+])[NH2+]Cc1ccc2cnccc2c1 ZINC000666833203 487887846 /nfs/dbraw/zinc/88/78/46/487887846.db2.gz QRPMQJLHHAGAPT-LLVKDONJSA-N 2 0 229.327 2.062 20 0 BEADRP CC(C)[C@@H]([NH3+])CC[N@H+](C)CC1(C)CCC1 ZINC000336713529 487888253 /nfs/dbraw/zinc/88/82/53/487888253.db2.gz VOGLLDVPUGCKLD-LBPRGKRZSA-N 2 0 212.381 2.482 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+][C@H]1CCC[NH2+]CC1 ZINC000666858017 487892360 /nfs/dbraw/zinc/89/23/60/487892360.db2.gz SVUPTBDQLGHCMX-ZJUUUORDSA-N 2 0 238.297 2.449 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]Cc1cccc2cnccc21 ZINC000666941521 487908339 /nfs/dbraw/zinc/90/83/39/487908339.db2.gz ZQRXDTGIMMICNR-LBPRGKRZSA-N 2 0 243.354 2.452 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]Cc1ccc2cnccc2c1 ZINC000666942088 487908473 /nfs/dbraw/zinc/90/84/73/487908473.db2.gz NDBNIYWNOSOQSW-GFCCVEGCSA-N 2 0 243.354 2.452 20 0 BEADRP CC(C)CCC[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000666953673 487915101 /nfs/dbraw/zinc/91/51/01/487915101.db2.gz DTLPJDRBUHICFG-GFCCVEGCSA-N 2 0 210.365 2.154 20 0 BEADRP CC1(C)CCC[C@@H]1[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000666954098 487916159 /nfs/dbraw/zinc/91/61/59/487916159.db2.gz PTLPIVWKFWKMTI-RYUDHWBXSA-N 2 0 222.376 2.297 20 0 BEADRP CC1CCC([NH2+][C@H]2CC23CC[NH2+]CC3)CC1 ZINC000666953912 487916199 /nfs/dbraw/zinc/91/61/99/487916199.db2.gz KVXBVGITJFUGLN-BPCQOVAHSA-N 2 0 222.376 2.297 20 0 BEADRP CC1(C)CCC[C@@H]1[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000666954097 487916218 /nfs/dbraw/zinc/91/62/18/487916218.db2.gz PTLPIVWKFWKMTI-NWDGAFQWSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H](C[NH2+][C@H]1CC[NH2+]C1(C)C)C(C)(C)C ZINC000666966505 487920024 /nfs/dbraw/zinc/92/00/24/487920024.db2.gz YNERLDFBCZPQFQ-QWRGUYRKSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@H](CC1CC1)[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000666995395 487924822 /nfs/dbraw/zinc/92/48/22/487924822.db2.gz MTKUJDDFJCPDBK-YPMHNXCESA-N 2 0 222.376 2.439 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2CC[C@H](C3CCC3)C2)CC[NH2+]1 ZINC000667060771 487935769 /nfs/dbraw/zinc/93/57/69/487935769.db2.gz YGSUZTHQOJNHTM-NFAWXSAZSA-N 2 0 236.403 2.497 20 0 BEADRP CC1=CCC[C@H](C)[C@@H]1C[NH+]1C[C@H]2C[NH2+]C[C@@H]2C1 ZINC000682404680 487947621 /nfs/dbraw/zinc/94/76/21/487947621.db2.gz HYVSTPZZCIFQRM-GBJTYRQASA-N 2 0 234.387 2.130 20 0 BEADRP COCC[C@H](C)[NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1 ZINC000125964043 323002397 /nfs/dbraw/zinc/00/23/97/323002397.db2.gz NOLJLDROLZGZEV-KBPBESRZSA-N 2 0 242.407 2.121 20 0 BEADRP CCN1CCC[C@H]([NH2+][C@@H]2CCCC23CC3)C1 ZINC000566500773 323003766 /nfs/dbraw/zinc/00/37/66/323003766.db2.gz QUUNUABATQKPNC-QWHCGFSZSA-N 2 0 222.376 2.393 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)C(C)(C)C)C1 ZINC000247050644 323012148 /nfs/dbraw/zinc/01/21/48/323012148.db2.gz NHGVLOTUEQJQHI-VXGBXAGGSA-N 2 0 212.381 2.352 20 0 BEADRP C[NH+]1CCC(CC[NH2+][C@@H]2CCC[C@H]3C[C@H]32)CC1 ZINC000302715748 323029146 /nfs/dbraw/zinc/02/91/46/323029146.db2.gz ZGSLAQCFDIVPMJ-RRFJBIMHSA-N 2 0 236.403 2.497 20 0 BEADRP CC(C)[NH2+]CCC[NH2+][C@H](C)C1CCSCC1 ZINC000562956251 323034942 /nfs/dbraw/zinc/03/49/42/323034942.db2.gz LZRAHENSOVEINJ-GFCCVEGCSA-N 2 0 244.448 2.496 20 0 BEADRP CC[C@@H]1CCC[C@H]1[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000562962795 323036719 /nfs/dbraw/zinc/03/67/19/323036719.db2.gz HBOOBOLVEACKFH-JHJVBQTASA-N 2 0 210.365 2.297 20 0 BEADRP CC[N@H+](CC[C@@H]1CCCC[NH+]1C)C[C@H](C)OC ZINC000569897531 323043652 /nfs/dbraw/zinc/04/36/52/323043652.db2.gz PASRFZRZWZUBOW-KBPBESRZSA-N 2 0 242.407 2.218 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]CC23CCC(CC2)C3)C1 ZINC000570226582 323053688 /nfs/dbraw/zinc/05/36/88/323053688.db2.gz OBADUXRTNNUTGF-CEUNDQEZSA-N 2 0 222.376 2.426 20 0 BEADRP Cc1ccc(OCC[NH2+][C@H]2CCC[C@H]([NH3+])C2)cc1 ZINC000570463197 323060158 /nfs/dbraw/zinc/06/01/58/323060158.db2.gz UTDJUFIUTGYASH-KBPBESRZSA-N 2 0 248.370 2.233 20 0 BEADRP COc1cc(C)ccc1[C@@H](C)[NH2+]C[C@@H](C)C[NH3+] ZINC000570561977 323063073 /nfs/dbraw/zinc/06/30/73/323063073.db2.gz CDDBNDMLUBFNOD-NWDGAFQWSA-N 2 0 236.359 2.249 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@H](C)c1cscn1 ZINC000570562627 323063095 /nfs/dbraw/zinc/06/30/95/323063095.db2.gz IEZBALPMFORWBE-NXEZZACHSA-N 2 0 227.377 2.311 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)CCCC[NH3+])c1cscn1 ZINC000570562629 323063153 /nfs/dbraw/zinc/06/31/53/323063153.db2.gz IEZBALPMFORWBE-VHSXEESVSA-N 2 0 227.377 2.311 20 0 BEADRP C[NH+](C)CCC1CC[NH+](CC2(C)CC2)CC1 ZINC000570775879 323069834 /nfs/dbraw/zinc/06/98/34/323069834.db2.gz CCUJSGRBKYYSKX-UHFFFAOYSA-N 2 0 224.392 2.450 20 0 BEADRP CO[C@H](C[NH2+][C@@H]1CCC[C@H]([NH3+])C1)c1ccccc1 ZINC000570815677 323071393 /nfs/dbraw/zinc/07/13/93/323071393.db2.gz CZRAQCQUOVNNMP-RRFJBIMHSA-N 2 0 248.370 2.234 20 0 BEADRP C[C@H]([NH2+]CC1CC[NH+](C)CC1)c1cscn1 ZINC000161190314 323075884 /nfs/dbraw/zinc/07/58/84/323075884.db2.gz NYMYSPCSXFLCBP-JTQLQIEISA-N 2 0 239.388 2.136 20 0 BEADRP C[C@@H]1CC[NH+](CCCC[N@H+]2CC[C@H](C)C2)C1 ZINC000536541730 323077409 /nfs/dbraw/zinc/07/74/09/323077409.db2.gz QMTQHOFMGVBTGA-OKILXGFUSA-N 2 0 224.392 2.450 20 0 BEADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]C(C)C)[C@H](C)C1 ZINC000151985464 323082856 /nfs/dbraw/zinc/08/28/56/323082856.db2.gz LNZCAAJHTOVZHE-ZIAGYGMSSA-N 2 0 242.407 2.121 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH2+]C[C@@H]2CC=CCC2)C1 ZINC000222314678 323086499 /nfs/dbraw/zinc/08/64/99/323086499.db2.gz XXCWCGMKENUIFH-KGLIPLIRSA-N 2 0 222.376 2.274 20 0 BEADRP COc1ccccc1/C=C/C[NH2+][C@H](C)C[C@@H](C)[NH3+] ZINC000563135342 323094527 /nfs/dbraw/zinc/09/45/27/323094527.db2.gz JHDYFYLATFTSRJ-ZYARKTQMSA-N 2 0 248.370 2.424 20 0 BEADRP CC(C)[C@@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)C1CC1 ZINC000571037685 323104344 /nfs/dbraw/zinc/10/43/44/323104344.db2.gz GQDCTTPLKDSUPP-GXTWGEPZSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)c1ccoc1 ZINC000563616067 323131558 /nfs/dbraw/zinc/13/15/58/323131558.db2.gz QNYRMMFSPIWNKF-CDGCEXEKSA-N 2 0 234.343 2.318 20 0 BEADRP CC(C)[C@@H]([NH2+]C[C@H]1CCC[NH2+]C1)C1CC1 ZINC000324209179 323136192 /nfs/dbraw/zinc/13/61/92/323136192.db2.gz CQGUHTDKGKSPFH-WCQYABFASA-N 2 0 210.365 2.010 20 0 BEADRP FC1(F)CC([NH2+]C2CC[NH+](CC3CC3)CC2)C1 ZINC000571235827 323139037 /nfs/dbraw/zinc/13/90/37/323139037.db2.gz PFOVDTZMNOSOQZ-UHFFFAOYSA-N 2 0 244.329 2.248 20 0 BEADRP CC[NH2+]CCCNc1nccc2c(C)cccc21 ZINC000571404301 323143684 /nfs/dbraw/zinc/14/36/84/323143684.db2.gz WREANTCFFZAVRJ-UHFFFAOYSA-N 2 0 243.354 2.377 20 0 BEADRP Cc1cc(C[NH2+][C@H]2CCC[C@H]([NH3+])C2)cc(C)n1 ZINC000571462081 323145519 /nfs/dbraw/zinc/14/55/19/323145519.db2.gz PIBSKGOGBVGHSO-KBPBESRZSA-N 2 0 233.359 2.058 20 0 BEADRP C[NH+]1CCC(CC[NH2+]C(C2CC2)C2CC2)CC1 ZINC000125316892 323173821 /nfs/dbraw/zinc/17/38/21/323173821.db2.gz MPYOSAQRLOFEAD-UHFFFAOYSA-N 2 0 236.403 2.497 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H](C)c1ccc2c(c1)COC2 ZINC000571669351 323177031 /nfs/dbraw/zinc/17/70/31/323177031.db2.gz IHGIMZFJAGSKRL-GFCCVEGCSA-N 2 0 248.370 2.367 20 0 BEADRP Cc1ccncc1CN[C@H](C)[C@H]1CCCC[NH2+]1 ZINC000395091960 323186979 /nfs/dbraw/zinc/18/69/79/323186979.db2.gz VFAIHQFWQRTACP-TZMCWYRMSA-N 2 0 233.359 2.010 20 0 BEADRP CC(C)(CO)CC[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000395120825 323187922 /nfs/dbraw/zinc/18/79/22/323187922.db2.gz GOKMNWXNKYQMNR-ZIAGYGMSSA-N 2 0 248.370 2.129 20 0 BEADRP C[C@H](CC(C)(C)C)[NH2+][C@H]1CC[NH2+]C[C@H]1C ZINC000395136331 323188773 /nfs/dbraw/zinc/18/87/73/323188773.db2.gz RTLRVQBKVZSEJH-UTUOFQBUSA-N 2 0 212.381 2.399 20 0 BEADRP COc1ccc(C[N@@H+]2C[C@H](C[NH3+])C[C@@H]2C)cc1C ZINC000216060160 323195245 /nfs/dbraw/zinc/19/52/45/323195245.db2.gz HVAODTRYECNVOX-JSGCOSHPSA-N 2 0 248.370 2.173 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]CC[C@@H]1CCCOC1 ZINC000530212690 323216332 /nfs/dbraw/zinc/21/63/32/323216332.db2.gz RXEGVFGUMRKCIN-MJBXVCDLSA-N 2 0 240.391 2.053 20 0 BEADRP C1CC1[C@H]([NH2+][C@@H]1CC[NH2+]C12CCC2)C1CCC1 ZINC000530214826 323216820 /nfs/dbraw/zinc/21/68/20/323216820.db2.gz CYWFIGSNQIGHJP-ZIAGYGMSSA-N 2 0 234.387 2.439 20 0 BEADRP Cc1ncccc1C[N@@H+]1C[C@H](C[NH3+])[C@@H](C)C[C@H]1C ZINC000397264299 323245074 /nfs/dbraw/zinc/24/50/74/323245074.db2.gz IOWKMBYEMAIDHS-ZOWXZIJZSA-N 2 0 247.386 2.195 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+][C@@H](C1CC1)C1CCC1 ZINC000324790579 323282792 /nfs/dbraw/zinc/28/27/92/323282792.db2.gz JURBLZZWGVVSIU-LERXQTSPSA-N 2 0 222.376 2.153 20 0 BEADRP C([NH2+][C@H](C1CC1)C1CCC1)[C@@H]1CCC[NH2+]C1 ZINC000324788294 323282803 /nfs/dbraw/zinc/28/28/03/323282803.db2.gz IYKBDOIRJGNIOF-RISCZKNCSA-N 2 0 222.376 2.154 20 0 BEADRP CCC[C@H]([NH2+]C[C@H]1CCC[NH2+]1)C1CCC1 ZINC000324929724 323306403 /nfs/dbraw/zinc/30/64/03/323306403.db2.gz NHHWMVXWFBSPLD-OLZOCXBDSA-N 2 0 210.365 2.297 20 0 BEADRP CC(C)[C@@H]1C[C@H]1C[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000571777088 323479358 /nfs/dbraw/zinc/47/93/58/323479358.db2.gz QWLDUUOZMLOCSK-RNJOBUHISA-N 2 0 210.365 2.138 20 0 BEADRP [NH3+]CCC1CC[NH+](CCCc2ccncc2)CC1 ZINC000572370303 323611087 /nfs/dbraw/zinc/61/10/87/323611087.db2.gz LQWVLZZYGKZZLE-UHFFFAOYSA-N 2 0 247.386 2.075 20 0 BEADRP C[C@H]([NH2+]CCC[NH+]1CCCC1)[C@@H]1CC12CC2 ZINC000527845024 323702944 /nfs/dbraw/zinc/70/29/44/323702944.db2.gz HPXHMLYYKOYRAV-STQMWFEESA-N 2 0 222.376 2.251 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@H](C)[C@H]2CC23CC3)CC1 ZINC000527859217 323712249 /nfs/dbraw/zinc/71/22/49/323712249.db2.gz NXTXMFZJFALOKQ-TZMCWYRMSA-N 2 0 236.403 2.497 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]C[C@@H]2CCCS2)[C@H](C)C1 ZINC000122918412 324062938 /nfs/dbraw/zinc/06/29/38/324062938.db2.gz BLRTYROITLZHRK-AGIUHOORSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H]1C[C@H](C)[N@H+](CC2CCCC2)C[C@@H]1C[NH3+] ZINC000397331360 324212132 /nfs/dbraw/zinc/21/21/32/324212132.db2.gz RBIVBSCRVIAOEI-DYEKYZERSA-N 2 0 224.392 2.482 20 0 BEADRP C[C@@H]([NH2+]CCC[NH+]1CCCC1)C1CC(F)(F)C1 ZINC000529541227 324331505 /nfs/dbraw/zinc/33/15/05/324331505.db2.gz HFFRLERYXKAEAI-LLVKDONJSA-N 2 0 246.345 2.496 20 0 BEADRP CCC[C@H](C[NH2+][C@@H]1CCCC[C@H]1C[NH3+])OCC ZINC000530206566 324523342 /nfs/dbraw/zinc/52/33/42/324523342.db2.gz APOIPLXOJUFKTD-BFHYXJOUSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@@H]([NH3+])C1CC[NH+](CC2CC(C)(C)C2)CC1 ZINC000530213109 324529265 /nfs/dbraw/zinc/52/92/65/324529265.db2.gz VCFYFIGKIPIBLD-LLVKDONJSA-N 2 0 224.392 2.482 20 0 BEADRP C[C@H](C[NH2+]C[C@@H]1CC[NH2+][C@H](C)C1)c1ccncc1 ZINC000530244369 324554954 /nfs/dbraw/zinc/55/49/54/324554954.db2.gz KPDBKKFQYBDFNN-MGPQQGTHSA-N 2 0 247.386 2.163 20 0 BEADRP C[C@H](CC1CC1)[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000130197320 325023062 /nfs/dbraw/zinc/02/30/62/325023062.db2.gz NCHMNIFHVAOTIW-MRVWCRGKSA-N 2 0 222.376 2.391 20 0 BEADRP COCc1cccc(C[N@@H+]2CC[C@H]([NH3+])C[C@@H]2C)c1 ZINC000131440512 325152001 /nfs/dbraw/zinc/15/20/01/325152001.db2.gz VVEDYSANBGIZTE-WFASDCNBSA-N 2 0 248.370 2.145 20 0 BEADRP CCC(C)(C)[C@H](C)[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000565710427 325946633 /nfs/dbraw/zinc/94/66/33/325946633.db2.gz RCAIZGXKQCXDAU-RYUDHWBXSA-N 2 0 212.381 2.400 20 0 BEADRP Cc1cc(F)ccc1C[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000565951146 325977373 /nfs/dbraw/zinc/97/73/73/325977373.db2.gz KRJKKJXFABFKHF-QWRGUYRKSA-N 2 0 224.323 2.350 20 0 BEADRP CC(C)[C@@H]([NH3+])CNCc1cccc(F)c1F ZINC000566961466 326097420 /nfs/dbraw/zinc/09/74/20/326097420.db2.gz UXVALRINKHSXRD-NSHDSACASA-N 2 0 228.286 2.038 20 0 BEADRP CCCC[N@H+](CCC[NH+]1CCCC1)CCOC ZINC000153657522 326105576 /nfs/dbraw/zinc/10/55/76/326105576.db2.gz GTZZLPOGHWYVBU-UHFFFAOYSA-N 2 0 242.407 2.221 20 0 BEADRP C([NH2+][C@H]1CCC[C@@H]1C1CC1)C1CC[NH2+]CC1 ZINC000567639023 326236286 /nfs/dbraw/zinc/23/62/86/326236286.db2.gz JPPGVHBYNPNLPK-KGLIPLIRSA-N 2 0 222.376 2.154 20 0 BEADRP CC(C)[C@@H]1CCC[C@@H]1[NH2+]CC1CC[NH2+]CC1 ZINC000567639131 326236393 /nfs/dbraw/zinc/23/63/93/326236393.db2.gz YCOZRGHRSHOPAK-KBPBESRZSA-N 2 0 224.392 2.400 20 0 BEADRP [NH3+]Cc1ccc(C[NH2+][C@@H]2CCCSC2)cc1 ZINC000567871128 326274127 /nfs/dbraw/zinc/27/41/27/326274127.db2.gz RKYRNHAQGWBIHT-CYBMUJFWSA-N 2 0 236.384 2.131 20 0 BEADRP COC[C@H](C)[NH2+]CCCC[N@@H+]1CCC[C@H](C)C1 ZINC000157955556 326301663 /nfs/dbraw/zinc/30/16/63/326301663.db2.gz NFMOQWFDYOLNLN-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP COC[C@H](C)[NH2+]CCCC[NH+]1CCC(C)CC1 ZINC000158206246 326311737 /nfs/dbraw/zinc/31/17/37/326311737.db2.gz HNGBBHUWSFRRTL-AWEZNQCLSA-N 2 0 242.407 2.123 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+][C@@H]2CCC[C@H]2OC(F)F)C1 ZINC000568248076 326334196 /nfs/dbraw/zinc/33/41/96/326334196.db2.gz GVHYLXGXGFDZRK-UKKRHICBSA-N 2 0 248.317 2.006 20 0 BEADRP c1ccc(C[C@H]2CC[C@@H]([NH2+][C@H]3CC[NH2+]C3)C2)cc1 ZINC000568260443 326336572 /nfs/dbraw/zinc/33/65/72/326336572.db2.gz SPDZRFKCYIEFBF-OAGGEKHMSA-N 2 0 244.382 2.349 20 0 BEADRP CC(C)C(C)(C)[NH2+]C[C@H]1CC[NH2+][C@@H](C)C1 ZINC000568727302 326373609 /nfs/dbraw/zinc/37/36/09/326373609.db2.gz RXXVXAXWZYYCAX-RYUDHWBXSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+]CC(C1CC1)C1CC1 ZINC000568749073 326374796 /nfs/dbraw/zinc/37/47/96/326374796.db2.gz UPUCSORANXLJAS-XHDPSFHLSA-N 2 0 236.403 2.400 20 0 BEADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@@H](C)[C@H](C)CC ZINC000165939997 326427288 /nfs/dbraw/zinc/42/72/88/326427288.db2.gz HOOIHZKBFAMATP-HZSPNIEDSA-N 2 0 244.423 2.367 20 0 BEADRP CC1(C[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)CCC1 ZINC000400964503 488012031 /nfs/dbraw/zinc/01/20/31/488012031.db2.gz JYPYJIBJUPGAPI-RWMBFGLXSA-N 2 0 222.376 2.154 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)C1 ZINC000400964851 488012296 /nfs/dbraw/zinc/01/22/96/488012296.db2.gz HEUYUPBNDSPMNW-GZBLMMOJSA-N 2 0 236.403 2.400 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC2=CCCC2)CC[N@@H+]1C ZINC000401173881 488017778 /nfs/dbraw/zinc/01/77/78/488017778.db2.gz UWKIDIDXDNCMFL-DGCLKSJQSA-N 2 0 208.349 2.169 20 0 BEADRP C[C@H]1CC[N@H+](Cc2ccnn2-c2ccncc2)C1 ZINC000667553812 488044008 /nfs/dbraw/zinc/04/40/08/488044008.db2.gz AIOXIJTVJLBOCT-LBPRGKRZSA-N 2 0 242.326 2.109 20 0 BEADRP [NH3+]C1CCC([NH2+][C@H]2CCCc3cccnc32)CC1 ZINC000091661523 488058032 /nfs/dbraw/zinc/05/80/32/488058032.db2.gz UBQYWNVNPQSELO-RUXDESIVSA-N 2 0 245.370 2.319 20 0 BEADRP CC(C)[N@@H+]1CC[C@H](C[NH2+][C@H]2CCC[C@@H]3C[C@@H]32)C1 ZINC000378960179 488113841 /nfs/dbraw/zinc/11/38/41/488113841.db2.gz POGJRQPEEFMITM-KBXIAJHMSA-N 2 0 236.403 2.495 20 0 BEADRP CC[NH+](CC)CCC[N@H+](CC)C[C@@H]1CCOC1 ZINC000683140698 488117495 /nfs/dbraw/zinc/11/74/95/488117495.db2.gz BQUCLAXTIKJGIF-AWEZNQCLSA-N 2 0 242.407 2.077 20 0 BEADRP C[C@@H]1C[N@H+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC[C@H]1[NH3+] ZINC000403448164 488124684 /nfs/dbraw/zinc/12/46/84/488124684.db2.gz XMBYBCVMRXEWDR-XGFWRYKXSA-N 2 0 222.376 2.092 20 0 BEADRP CC[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)C1 ZINC000667820179 488128795 /nfs/dbraw/zinc/12/87/95/488128795.db2.gz RJOHMYOFTQJNCL-APIJFGDWSA-N 2 0 236.403 2.497 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]1[NH2+]CCC1CCC1 ZINC000300828306 487538663 /nfs/dbraw/zinc/53/86/63/487538663.db2.gz JXELRXPQPULPCR-GFCCVEGCSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H](C[NH2+][C@H]1CCC[NH2+]CC1)C(C)(C)C ZINC000168781257 487540432 /nfs/dbraw/zinc/54/04/32/487540432.db2.gz CXXGZGWMBHMBAP-RYUDHWBXSA-N 2 0 212.381 2.400 20 0 BEADRP CC(C)[N@@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000662294307 487542610 /nfs/dbraw/zinc/54/26/10/487542610.db2.gz LFWKSGBQCJRQJC-ZDUSSCGKSA-N 2 0 210.365 2.106 20 0 BEADRP C[N@H+](CC[C@@H]1CC[NH2+]C1)CCC(C)(C)C ZINC000258883565 488141808 /nfs/dbraw/zinc/14/18/08/488141808.db2.gz BXVXLYGEXDEASA-LBPRGKRZSA-N 2 0 212.381 2.354 20 0 BEADRP CC(C)(CC[N@@H+]1CC[C@@]2(CC[NH2+]C2)C1)C1CC1 ZINC000406018896 487495198 /nfs/dbraw/zinc/49/51/98/487495198.db2.gz CPVFNGYRKKFBDH-OAHLLOKOSA-N 2 0 236.403 2.498 20 0 BEADRP C[NH2+]CCC1CC[NH+](CC2CC=CC2)CC1 ZINC000662266728 487503320 /nfs/dbraw/zinc/50/33/20/487503320.db2.gz OJGCOCWDEUDGGI-UHFFFAOYSA-N 2 0 222.376 2.274 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H]2[C@@H]3CCC[C@@H]32)CC1 ZINC000381321624 487505036 /nfs/dbraw/zinc/50/50/36/487505036.db2.gz OXXJQTYFGMUPAO-WDNDVIMCSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+][C@H]2CCC[C@H]([NH3+])C2)C1 ZINC000300242542 487505845 /nfs/dbraw/zinc/50/58/45/487505845.db2.gz NWRYZZCICDSAIN-VOAKCMCISA-N 2 0 210.365 2.282 20 0 BEADRP C[NH2+]C[C@@H]1CCC[N@H+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)C1 ZINC000403721642 488133712 /nfs/dbraw/zinc/13/37/12/488133712.db2.gz IDEXMOFOEYCDLJ-BARDWOONSA-N 2 0 236.403 2.354 20 0 BEADRP CC(C)C[C@H](C)[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000390083220 488135140 /nfs/dbraw/zinc/13/51/40/488135140.db2.gz SRYHHVVKUSYDOA-NWDGAFQWSA-N 2 0 210.365 2.153 20 0 BEADRP CCc1ccc(C[N@H+](C)C[C@H]2CC[NH2+]C2)cc1 ZINC000258795540 488136270 /nfs/dbraw/zinc/13/62/70/488136270.db2.gz CLKWJFXCOBBGDO-HNNXBMFYSA-N 2 0 232.371 2.290 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]1[NH2+]C[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000403789046 488138316 /nfs/dbraw/zinc/13/83/16/488138316.db2.gz ALMOREGQKFLGSC-MQYQWHSLSA-N 2 0 236.403 2.400 20 0 BEADRP [NH3+]CC[C@@H]1CCC[N@H+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)C1 ZINC000403788613 488138395 /nfs/dbraw/zinc/13/83/95/488138395.db2.gz ZWLKYKNHMYQPSF-YJNKXOJESA-N 2 0 236.403 2.483 20 0 BEADRP Cc1noc(C)c1[C@H](C)[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000223042704 488140107 /nfs/dbraw/zinc/14/01/07/488140107.db2.gz RXWFKMJEXYHAFC-XXILOJSOSA-N 2 0 237.347 2.212 20 0 BEADRP CCOC1CCC([NH2+][C@H](C)CC[NH+](C)C)CC1 ZINC000657859773 488152565 /nfs/dbraw/zinc/15/25/65/488152565.db2.gz XOOCXGIKQHXFDQ-IYXRBSQSSA-N 2 0 242.407 2.264 20 0 BEADRP CCOC1CCC([NH2+][C@@H](C)CC[NH+](C)C)CC1 ZINC000657859764 488153027 /nfs/dbraw/zinc/15/30/27/488153027.db2.gz XOOCXGIKQHXFDQ-HSBZDZAISA-N 2 0 242.407 2.264 20 0 BEADRP CC[C@](C)(C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)OC ZINC000322529328 488189450 /nfs/dbraw/zinc/18/94/50/488189450.db2.gz PCGXLKQPLHRQSK-WTUNAVPPSA-N 2 0 240.391 2.016 20 0 BEADRP Cc1ncc(C[N@@H+]2CCS[C@@H](C)CC2)n1C ZINC000668061481 488196534 /nfs/dbraw/zinc/19/65/34/488196534.db2.gz JDRHKIKSQSLGAN-JTQLQIEISA-N 2 0 239.388 2.056 20 0 BEADRP CC[C@H](C[NH+]1C[C@H]2C[NH2+]C[C@@H]2C1)c1ccccc1 ZINC000678342754 488243422 /nfs/dbraw/zinc/24/34/22/488243422.db2.gz GQUGJXMIQJGODG-FVQBIDKESA-N 2 0 244.382 2.331 20 0 BEADRP Cc1cccc(CCC[NH+]2C[C@H]3C[NH2+]C[C@@H]3C2)c1 ZINC000679214957 488317532 /nfs/dbraw/zinc/31/75/32/488317532.db2.gz VXEIWOGBXQTGCZ-HZPDHXFCSA-N 2 0 244.382 2.079 20 0 BEADRP C[C@@H]([NH2+]CC1(C(F)F)CC1)C1CC[NH+](C)CC1 ZINC000684559577 488327334 /nfs/dbraw/zinc/32/73/34/488327334.db2.gz ISHFIXTZZOFWFU-SNVBAGLBSA-N 2 0 246.345 2.352 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]CCCc1ccco1 ZINC000665283124 490096221 /nfs/dbraw/zinc/09/62/21/490096221.db2.gz HUBXCCCFQVXQMK-JSGCOSHPSA-N 2 0 236.359 2.319 20 0 BEADRP CC[C@@H]([NH2+]C[C@H]1CCC[N@H+](CC)C1)C1CC1 ZINC000121862695 490111836 /nfs/dbraw/zinc/11/18/36/490111836.db2.gz AYNYFHNCHHIAKD-TZMCWYRMSA-N 2 0 224.392 2.497 20 0 BEADRP c1ccc(CCCC[N@H+]2C[C@H]3C[NH2+]C[C@H]3C2)cc1 ZINC000122194009 490128518 /nfs/dbraw/zinc/12/85/18/490128518.db2.gz BUFPEFBIOZRFKX-IYBDPMFKSA-N 2 0 244.382 2.161 20 0 BEADRP COc1ccc(C[N@@H+]2CC[C@@H]([NH3+])C[C@H]2C)cc1C ZINC000252688238 490198275 /nfs/dbraw/zinc/19/82/75/490198275.db2.gz NPWDWYQKWPHRBG-TZMCWYRMSA-N 2 0 248.370 2.315 20 0 BEADRP CO[C@@H]1CCC[C@@H]([NH2+]CC(C)(C)C[NH+](C)C)C1 ZINC000070325465 490205918 /nfs/dbraw/zinc/20/59/18/490205918.db2.gz LDLPAUBQMZAVII-CHWSQXEVSA-N 2 0 242.407 2.121 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C(C)C)C1)C1CC1 ZINC000083055794 490318463 /nfs/dbraw/zinc/31/84/63/490318463.db2.gz KUBAUVWQDBVZGI-GXTWGEPZSA-N 2 0 224.392 2.495 20 0 BEADRP c1cc(N2CC[NH+](CC3CCCC3)CC2)cc[nH+]1 ZINC000125250373 490421595 /nfs/dbraw/zinc/42/15/95/490421595.db2.gz ACPHWWSQMBKMDN-UHFFFAOYSA-N 2 0 245.370 2.394 20 0 BEADRP C(CC1CC1)[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000128059572 490570883 /nfs/dbraw/zinc/57/08/83/490570883.db2.gz JWXWUZWMLFWAES-OLZOCXBDSA-N 2 0 208.349 2.003 20 0 BEADRP CN(C)c1ccccc1C[NH+]1CCC(C)([NH3+])CC1 ZINC000647531109 490673708 /nfs/dbraw/zinc/67/37/08/490673708.db2.gz BIFWAEZKZFEMOT-UHFFFAOYSA-N 2 0 247.386 2.066 20 0 BEADRP CC(C)(C)CC[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000400945314 491069192 /nfs/dbraw/zinc/06/91/92/491069192.db2.gz FIKGGUGATGOVSI-YNEHKIRRSA-N 2 0 224.392 2.400 20 0 BEADRP [NH3+]CC[C@@H]1CCC[N@H+](Cc2cc(C3CC3)no2)C1 ZINC000662271445 491085295 /nfs/dbraw/zinc/08/52/95/491085295.db2.gz GWDOYZVKHRCQBS-NSHDSACASA-N 2 0 249.358 2.113 20 0 BEADRP Cc1ncccc1C[N@H+]1CCC[C@@H](C)[C@H]1CC[NH3+] ZINC000404292488 491093604 /nfs/dbraw/zinc/09/36/04/491093604.db2.gz LVJHNICPMZWTLE-IUODEOHRSA-N 2 0 247.386 2.339 20 0 BEADRP CO[C@H](C[NH2+][C@H]1CCC[C@@H]1[NH3+])C1CCCCC1 ZINC000665282856 491107891 /nfs/dbraw/zinc/10/78/91/491107891.db2.gz CVXHHSYHAKOWLD-MELADBBJSA-N 2 0 240.391 2.051 20 0 BEADRP CC(C)[C@H]1CC[C@H]1[NH2+]CCC[NH+]1CCCC1 ZINC000309671284 491153599 /nfs/dbraw/zinc/15/35/99/491153599.db2.gz JXHSDEQPOKWFRC-ZIAGYGMSSA-N 2 0 224.392 2.497 20 0 BEADRP CSC[C@@H]1CCC[N@@H+]1C[C@H]([NH3+])CC(C)C ZINC000400010302 533749328 /nfs/dbraw/zinc/74/93/28/533749328.db2.gz VLFZEFHMCMCZIZ-NEPJUHHUSA-N 2 0 230.421 2.187 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC2CC[NH+](C3CC3)CC2)[C@H]1C ZINC000494984522 533945047 /nfs/dbraw/zinc/94/50/47/533945047.db2.gz GBNWVUQDXINGJN-XUJVJEKNSA-N 2 0 236.403 2.495 20 0 BEADRP CCC[C@H](C)C[N@@H+]1CCC[C@@H](CC[NH3+])C1 ZINC000224295684 535610221 /nfs/dbraw/zinc/61/02/21/535610221.db2.gz QWLXGMQOWMZGIR-STQMWFEESA-N 2 0 212.381 2.483 20 0 BEADRP C[C@@H]1C[C@H]1C[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000488326261 534018248 /nfs/dbraw/zinc/01/82/48/534018248.db2.gz LJOKAFPRSDFFGW-OCCSQVGLSA-N 2 0 224.392 2.306 20 0 BEADRP C[C@@H]1C[C@H]1C[NH2+]C1CCC(C[NH+](C)C)CC1 ZINC000309452247 518180855 /nfs/dbraw/zinc/18/08/55/518180855.db2.gz MVBUFGZQEFOBOT-ZIHBUVQPSA-N 2 0 224.392 2.352 20 0 BEADRP C[NH2+]C1CC[NH+](Cc2cccc(C)c2C)CC1 ZINC000261548085 536440294 /nfs/dbraw/zinc/44/02/94/536440294.db2.gz JBUHVUFYAXBXBW-UHFFFAOYSA-N 2 0 232.371 2.487 20 0 BEADRP CCC[N@H+](C)C[C@@H]1CC[NH+](C[C@H]2C[C@@H]2C)C1 ZINC000488321747 527837070 /nfs/dbraw/zinc/83/70/70/527837070.db2.gz NRIMXTQTWXXTBZ-MELADBBJSA-N 2 0 224.392 2.306 20 0 BEADRP CCC[C@H](C)C[NH2+][C@H](C)[C@H]1CCC[NH2+]C1 ZINC000414847541 528034038 /nfs/dbraw/zinc/03/40/38/528034038.db2.gz FSWLXOVYRCLVTL-XQQFMLRXSA-N 2 0 212.381 2.400 20 0 BEADRP CCC[NH+]1CCC([N@H+](C)C[C@H]2C[C@H]2C)CC1 ZINC000488314548 528195681 /nfs/dbraw/zinc/19/56/81/528195681.db2.gz OJEKVDUNRGUADH-CHWSQXEVSA-N 2 0 224.392 2.449 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000400982819 529033163 /nfs/dbraw/zinc/03/31/63/529033163.db2.gz SXCBFSXDMKWVLG-LPWJVIDDSA-N 2 0 222.376 2.153 20 0 BEADRP CC(C)[N@H+](CCC1CC[NH2+]CC1)C1CC1 ZINC000261547132 535053012 /nfs/dbraw/zinc/05/30/12/535053012.db2.gz LWVDNUUHFMDXGI-UHFFFAOYSA-N 2 0 210.365 2.249 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@@H]2CC23CC3)CC1 ZINC000335281913 535162087 /nfs/dbraw/zinc/16/20/87/535162087.db2.gz YYBXBQVEYIZVAJ-GFCCVEGCSA-N 2 0 208.349 2.001 20 0 BEADRP CC(C)([NH3+])C[N@@H+]1CCC2(C1)CCCCC2 ZINC000261531136 535197501 /nfs/dbraw/zinc/19/75/01/535197501.db2.gz FIAAVJWHLDWOPF-UHFFFAOYSA-N 2 0 210.365 2.380 20 0 BEADRP CC(C)([NH3+])C[NH2+]C1CCc2ccccc2CC1 ZINC000335595310 535209761 /nfs/dbraw/zinc/20/97/61/535209761.db2.gz AUDIGJPSFNJIHA-UHFFFAOYSA-N 2 0 232.371 2.261 20 0 BEADRP CC(C)[C@H]1C[C@H]([NH2+][C@H](C)CC[NH+](C)C)CCO1 ZINC000226592789 535266397 /nfs/dbraw/zinc/26/63/97/535266397.db2.gz GDCZFBDZZJVULH-MGPQQGTHSA-N 2 0 242.407 2.120 20 0 BEADRP CC[C@@H]1CCC[N@@H+]1C[C@H]1CC[NH2+][C@@H](C)C1 ZINC000261536480 535820482 /nfs/dbraw/zinc/82/04/82/535820482.db2.gz RWNYEXCVPFQXRV-RWMBFGLXSA-N 2 0 210.365 2.249 20 0 BEADRP CC[C@]1(C)CC[N@H+](C[C@@]2(C)CC[NH2+]C2)C1 ZINC000261557552 535910979 /nfs/dbraw/zinc/91/09/79/535910979.db2.gz XKGPJDLZNUOWIV-OLZOCXBDSA-N 2 0 210.365 2.108 20 0 BEADRP CCc1ccccc1C[N@@H+]1C[C@@H]2CC[C@H]([NH3+])[C@@H]2C1 ZINC000261565584 535935973 /nfs/dbraw/zinc/93/59/73/535935973.db2.gz HSZXYQZIMWVNBK-XHSDSOJGSA-N 2 0 244.382 2.418 20 0 BEADRP CCc1ccccc1C[N@@H+]1CC[C@H]2[NH2+]CC[C@@H]2C1 ZINC000261576448 535936908 /nfs/dbraw/zinc/93/69/08/535936908.db2.gz NQMWSZNUDYXOOT-HZPDHXFCSA-N 2 0 244.382 2.433 20 0 BEADRP CC[C@@]1(C)CCC[N@H+](C[C@@]2(C)CC[NH2+]C2)C1 ZINC000261918605 536038431 /nfs/dbraw/zinc/03/84/31/536038431.db2.gz ZZFDMFIRTSZNFN-KBPBESRZSA-N 2 0 224.392 2.498 20 0 BEADRP CCc1cc(OC)ccc1C[NH+]1CCC([NH3+])CC1 ZINC000261654114 536156617 /nfs/dbraw/zinc/15/66/17/536156617.db2.gz BFIDCIWWPASJSS-UHFFFAOYSA-N 2 0 248.370 2.181 20 0 BEADRP C[N@H+](CCC1CC[NH2+]CC1)CC1CCCC1 ZINC000082492468 536323361 /nfs/dbraw/zinc/32/33/61/536323361.db2.gz ZATNFWAXMSGGGO-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP C[N@H+](CCCCF)C[C@@H]1CCC[NH+](C)C1 ZINC000352045000 536334694 /nfs/dbraw/zinc/33/46/94/536334694.db2.gz IEOZGMNWINXVPT-LBPRGKRZSA-N 2 0 216.344 2.010 20 0 BEADRP C[N@H+](CCCCF)C[C@H]1CCC[NH+](C)C1 ZINC000352044538 536334981 /nfs/dbraw/zinc/33/49/81/536334981.db2.gz IEOZGMNWINXVPT-GFCCVEGCSA-N 2 0 216.344 2.010 20 0 BEADRP C[N@@H+]1CCC[C@H]1CC[NH+]1CC[C@@H](C2CC2)C1 ZINC000348072809 536390147 /nfs/dbraw/zinc/39/01/47/536390147.db2.gz KVDDBXDTMMDJRG-KGLIPLIRSA-N 2 0 222.376 2.203 20 0 BEADRP CC(C)[C@](C)(C[NH3+])[NH2+]CCC1SCCS1 ZINC000853023270 588716643 /nfs/dbraw/zinc/71/66/43/588716643.db2.gz RCJBLDLXHCBFPL-NSHDSACASA-N 2 0 248.461 2.146 20 0 BEADRP C[NH2+]C[C@H](C)[NH2+][C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000853248939 588728950 /nfs/dbraw/zinc/72/89/50/588728950.db2.gz LZUKKXGFSOBOBP-IVZWLZJFSA-N 2 0 238.297 2.305 20 0 BEADRP CC(C)[C@H]1CC[C@H]1[NH2+]CC1([NH3+])CCCC1 ZINC000854223496 588780257 /nfs/dbraw/zinc/78/02/57/588780257.db2.gz PZZRDJOXIXIXPY-VXGBXAGGSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)[C@H]1CC[C@@H]1[NH2+]CC1([NH3+])CCCC1 ZINC000854223193 588780387 /nfs/dbraw/zinc/78/03/87/588780387.db2.gz PZZRDJOXIXIXPY-NEPJUHHUSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H]2CC[C@@H]2C2CC2)CCCC1 ZINC000854224392 588780592 /nfs/dbraw/zinc/78/05/92/588780592.db2.gz VYRQZVXDYQGTIN-VXGBXAGGSA-N 2 0 208.349 2.036 20 0 BEADRP CC[C@H]1CC[N@H+](CC2CC[NH+](C)CC2)C1 ZINC000892222250 582809041 /nfs/dbraw/zinc/80/90/41/582809041.db2.gz QRNCGXABLWJVKY-LBPRGKRZSA-N 2 0 210.365 2.060 20 0 BEADRP COCCCC1(C[NH2+]CCC[NH+](C)C)CCC1 ZINC000892429983 582885740 /nfs/dbraw/zinc/88/57/40/582885740.db2.gz XFHRXFMHOVBEFJ-UHFFFAOYSA-N 2 0 242.407 2.125 20 0 BEADRP CC(C)[N@@H+]1CC[C@H](C[NH2+]CC2(C)CCC2)C1 ZINC000381538169 582900591 /nfs/dbraw/zinc/90/05/91/582900591.db2.gz HKIZLYPZVWEFGA-CYBMUJFWSA-N 2 0 224.392 2.497 20 0 BEADRP CCCSC[C@H](C)[NH2+]C[C@H]1CC[N@H+](CC)C1 ZINC000892612544 582929308 /nfs/dbraw/zinc/92/93/08/582929308.db2.gz ARTMWRMCVYPGGB-QWHCGFSZSA-N 2 0 244.448 2.450 20 0 BEADRP CC[C@@H]1CCC[C@H](C[NH+]2C[C@H]3C[NH2+]C[C@@H]3C2)C1 ZINC000394501533 582988994 /nfs/dbraw/zinc/98/89/94/582988994.db2.gz BHVMEHSVEQMXNE-LXTVHRRPSA-N 2 0 236.403 2.354 20 0 BEADRP CCCSC[C@@H](C)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000892946694 583015627 /nfs/dbraw/zinc/01/56/27/583015627.db2.gz KTVTYQGNBKVFRE-OLZOCXBDSA-N 2 0 244.448 2.450 20 0 BEADRP C[C@H]1CCCC[N@H+](CC2CC[NH+](C)CC2)C1 ZINC000893678568 583197833 /nfs/dbraw/zinc/19/78/33/583197833.db2.gz LEXIECRQXCPKCK-ZDUSSCGKSA-N 2 0 224.392 2.450 20 0 BEADRP CC[N@H+](C)C[C@@H]1CCN(Cc2cc(C)co2)C1 ZINC000894087232 583298453 /nfs/dbraw/zinc/29/84/53/583298453.db2.gz VYUSKVWHMLLLEX-ZDUSSCGKSA-N 2 0 236.359 2.362 20 0 BEADRP C[C@H]1C[C@@H]1C[NH+]1CCC2(CC[NH+](C)CC2)CC1 ZINC000877683906 583343060 /nfs/dbraw/zinc/34/30/60/583343060.db2.gz ARZMWMOWJNCXHK-UONOGXRCSA-N 2 0 236.403 2.450 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2C[C@@H](C3CC3)[C@@H]2C2CC2)CC1 ZINC000894735101 583514342 /nfs/dbraw/zinc/51/43/42/583514342.db2.gz GJHKNPOCVHWLLA-HOTGVXAUSA-N 2 0 248.414 2.449 20 0 BEADRP Cc1ncoc1C[N@H+](C)CCCn1ccnc1C ZINC000894776269 583516574 /nfs/dbraw/zinc/51/65/74/583516574.db2.gz FOUHLOHOGMDWFL-UHFFFAOYSA-N 2 0 248.330 2.010 20 0 BEADRP C[C@@H]1CC(C)(C)C[N@@H+]1CC1CC[NH+](C)CC1 ZINC000894924952 583556683 /nfs/dbraw/zinc/55/66/83/583556683.db2.gz FDZVCKRUMDRZFJ-GFCCVEGCSA-N 2 0 224.392 2.449 20 0 BEADRP C[C@@H]1CC[N@H+](CC2CC[NH+](C)CC2)[C@H](C)C1 ZINC000895009685 583567336 /nfs/dbraw/zinc/56/73/36/583567336.db2.gz HBRQOIGDVHWSCL-CHWSQXEVSA-N 2 0 224.392 2.449 20 0 BEADRP Cc1cc(C)cc(C[N@H+](C)C[C@@H]2CC[NH2+]C2)c1 ZINC000647990349 583582212 /nfs/dbraw/zinc/58/22/12/583582212.db2.gz OLKWGUDBRSKZMC-CQSZACIVSA-N 2 0 232.371 2.345 20 0 BEADRP COC1(C[C@H](C)[NH2+]CC[C@@H](C)[NH+](C)C)CCC1 ZINC000895294578 583638314 /nfs/dbraw/zinc/63/83/14/583638314.db2.gz RTRGIIKZZHEZSI-QWHCGFSZSA-N 2 0 242.407 2.264 20 0 BEADRP COC[C@H](CC(C)(C)C)[NH2+]CC[C@H](C)[NH+](C)C ZINC000895292594 583638818 /nfs/dbraw/zinc/63/88/18/583638818.db2.gz RAUGZAPBGNUZEZ-STQMWFEESA-N 2 0 244.423 2.367 20 0 BEADRP C[NH+]1CCC(C[NH2+]CCCc2ccco2)CC1 ZINC000895454161 583676496 /nfs/dbraw/zinc/67/64/96/583676496.db2.gz VRUKJJKFDNZSNJ-UHFFFAOYSA-N 2 0 236.359 2.144 20 0 BEADRP CCc1cc(N[C@@H]2CC[N@H+](C)[C@@H]2C)nc(CC)n1 ZINC000895734397 583716914 /nfs/dbraw/zinc/71/69/14/583716914.db2.gz LSONOUXOLLJVJJ-ZYHUDNBSSA-N 2 0 248.374 2.106 20 0 BEADRP CC1=CC[C@H]([NH2+][C@@H]2CCN(C)[C@@H]2C)CC1 ZINC000896555929 583811867 /nfs/dbraw/zinc/81/18/67/583811867.db2.gz SFECNPUGHGDLBH-FRRDWIJNSA-N 2 0 208.349 2.167 20 0 BEADRP C[NH+]1CCC(C[NH2+]C(C)(C)/C=C\Cl)CC1 ZINC000896747615 583830403 /nfs/dbraw/zinc/83/04/03/583830403.db2.gz NQGLWLPSUKJBOO-SREVYHEPSA-N 2 0 230.783 2.449 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC2CC[NH+](C)CC2)CCS1 ZINC000896951841 583864138 /nfs/dbraw/zinc/86/41/38/583864138.db2.gz LZHJRWQOMNGUTA-DGCLKSJQSA-N 2 0 242.432 2.202 20 0 BEADRP C1[C@H]2CCC[C@@H]2[C@H]1[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000897955451 584065078 /nfs/dbraw/zinc/06/50/78/584065078.db2.gz UVAGLQKMQOTMSJ-ZSAUSMIDSA-N 2 0 234.387 2.391 20 0 BEADRP C(CC1CC1)C[N@@H+]1CCC[C@@H]([C@@H]2CC[NH2+]C2)C1 ZINC000866666085 584121594 /nfs/dbraw/zinc/12/15/94/584121594.db2.gz NFJZEHRPFQNKHD-HUUCEWRRSA-N 2 0 236.403 2.498 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@@H]2CCC[C@H]2CCCF)C1 ZINC000873251867 584128104 /nfs/dbraw/zinc/12/81/04/584128104.db2.gz XNIYCGRFIGVLMD-WUHRBBMRSA-N 2 0 228.355 2.232 20 0 BEADRP C[C@@H]1CC[C@@H](C)[C@H]([NH2+]C[C@H]2C[C@H]([NH3+])C2)C1 ZINC000873255604 584128358 /nfs/dbraw/zinc/12/83/58/584128358.db2.gz ICHYFNYGVSPDFH-SYLRKERUSA-N 2 0 210.365 2.138 20 0 BEADRP C[N@@H+]1CCCC[C@H](C[NH2+][C@@H]2CC[C@@H]2C2CC2)C1 ZINC000858490870 588960026 /nfs/dbraw/zinc/96/00/26/588960026.db2.gz RILDURTXFMOXBB-BPLDGKMQSA-N 2 0 236.403 2.497 20 0 BEADRP [NH3+][C@H]1Cc2ccc(C3=C[C@H]4CC[C@@H](C3)[NH2+]4)cc2C1 ZINC000899327761 584197709 /nfs/dbraw/zinc/19/77/09/584197709.db2.gz FVUPZPCBOYMDOA-XHSDSOJGSA-N 2 0 240.350 2.020 20 0 BEADRP CCOCCCC[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000902315403 584555572 /nfs/dbraw/zinc/55/55/72/584555572.db2.gz KZGQIJOJELLHDK-CYBMUJFWSA-N 2 0 242.407 2.171 20 0 BEADRP CSC[C@H](C)[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000902331946 584563099 /nfs/dbraw/zinc/56/30/99/584563099.db2.gz WZTVKGSMGXHNFH-WDEREUQCSA-N 2 0 230.421 2.106 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]([NH2+]C2CC(F)(F)C2)C1 ZINC000902377191 584568769 /nfs/dbraw/zinc/56/87/69/584568769.db2.gz SONYZDCBASVUKT-SECBINFHSA-N 2 0 232.318 2.152 20 0 BEADRP Cc1ccccc1C[C@@H]([NH2+]CC1([NH3+])CC1)C1CC1 ZINC000902408233 584575701 /nfs/dbraw/zinc/57/57/01/584575701.db2.gz YLTLXMOKYSHYBJ-OAHLLOKOSA-N 2 0 244.382 2.397 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H](Cc2ccccc2)C2CC2)CC1 ZINC000902412838 584584509 /nfs/dbraw/zinc/58/45/09/584584509.db2.gz GLALJWSUHMHZKM-AWEZNQCLSA-N 2 0 230.355 2.089 20 0 BEADRP [NH3+]C1(C[NH2+][C@H]2CCC[C@H](C(F)(F)F)C2)CC1 ZINC000902405546 584589390 /nfs/dbraw/zinc/58/93/90/584589390.db2.gz ISIYHVAKYWWLDP-IUCAKERBSA-N 2 0 236.281 2.188 20 0 BEADRP CC(C)(C[NH2+][C@@H]1CC[NH2+]C12CCC2)C1CC1 ZINC000902429230 584594547 /nfs/dbraw/zinc/59/45/47/584594547.db2.gz COMOVQOCZNUFHZ-GFCCVEGCSA-N 2 0 222.376 2.297 20 0 BEADRP CC(C)(C[NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2)C1CC1 ZINC000902430884 584594950 /nfs/dbraw/zinc/59/49/50/584594950.db2.gz JKBTUYYQNRZWRY-KYYPQDQFSA-N 2 0 234.387 2.009 20 0 BEADRP CCC(C)(C)[C@H](C)[NH2+][C@H]1C[NH2+]CC1(C)C ZINC000902440906 584597686 /nfs/dbraw/zinc/59/76/86/584597686.db2.gz BEOYVNGAYPWNPJ-QWRGUYRKSA-N 2 0 212.381 2.399 20 0 BEADRP COc1ccc([C@H]([NH2+]CC2([NH3+])CC2)C(C)C)cc1 ZINC000902414140 584599457 /nfs/dbraw/zinc/59/94/57/584599457.db2.gz TYZKVMHYNRWNHH-CQSZACIVSA-N 2 0 248.370 2.473 20 0 BEADRP [NH3+]C1(C[NH2+][C@H](c2ccccc2)C2CC2)CC1 ZINC000902413136 584599715 /nfs/dbraw/zinc/59/97/15/584599715.db2.gz JEJPGPXSOUWHGD-CYBMUJFWSA-N 2 0 216.328 2.219 20 0 BEADRP CCO[C@@H]1C[C@@H]([NH2+]CC2([NH3+])CC2)C1(CC)CC ZINC000902414537 584600180 /nfs/dbraw/zinc/60/01/80/584600180.db2.gz WSYSMGYZKDLWIT-VXGBXAGGSA-N 2 0 240.391 2.051 20 0 BEADRP CC[C@@H](NCC1([NH3+])CC1)c1ccc(OC)cc1 ZINC000902414815 584600581 /nfs/dbraw/zinc/60/05/81/584600581.db2.gz CWGFYNLYSMJOGU-CYBMUJFWSA-N 2 0 234.343 2.227 20 0 BEADRP CC1(C)CCC([NH2+][C@@H]2C[C@@H]3CC[C@H]2[NH2+]3)CC1 ZINC000902472253 584601479 /nfs/dbraw/zinc/60/14/79/584601479.db2.gz ZLSRNOYOZDSONX-YNEHKIRRSA-N 2 0 222.376 2.438 20 0 BEADRP CC[C@@H]1CCC[C@H]1[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902476173 584602503 /nfs/dbraw/zinc/60/25/03/584602503.db2.gz MVPABWCNFDHBDF-NJMOYASZSA-N 2 0 208.349 2.048 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)S2 ZINC000902447307 584604553 /nfs/dbraw/zinc/60/45/53/584604553.db2.gz RYZCUXWCSZCSOL-FGNRJIRKSA-N 2 0 240.416 2.143 20 0 BEADRP C[C@H](CC1CCC1)[NH2+][C@H]1C[NH2+]CC1(C)C ZINC000902448112 584604595 /nfs/dbraw/zinc/60/45/95/584604595.db2.gz CHJHUMPZIHLBHU-PWSUYJOCSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)CC[C@H](C)[NH2+][C@@H]1C[NH2+]CC1(C)C ZINC000902447319 584604840 /nfs/dbraw/zinc/60/48/40/584604840.db2.gz SHEATWHJHNQJGA-NWDGAFQWSA-N 2 0 212.381 2.399 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1C[NH2+]CC1(C)C ZINC000902448116 584604898 /nfs/dbraw/zinc/60/48/98/584604898.db2.gz CJTNEHCTMGCTTM-GRYCIOLGSA-N 2 0 210.365 2.153 20 0 BEADRP CC1(C)C[NH2+]C[C@H]1[NH2+][C@H]1CCCC12CCC2 ZINC000902447565 584605144 /nfs/dbraw/zinc/60/51/44/584605144.db2.gz ZQWBILILAGTDCJ-NWDGAFQWSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@]12C[C@H]1CCC[C@H]2[NH2+][C@H]1C[NH2+]CC1(C)C ZINC000902447572 584605193 /nfs/dbraw/zinc/60/51/93/584605193.db2.gz ZRVCLWDEKIHHDW-NMKXLXIOSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCSC(C)(C)C1)[C@@H]1CCC[NH2+]1 ZINC000902450052 584606261 /nfs/dbraw/zinc/60/62/61/584606261.db2.gz CBWZHSFVSQGIST-WOPDTQHZSA-N 2 0 242.432 2.391 20 0 BEADRP C1[C@H]2CCC[C@@H]2[C@H]1[NH2+][C@H]1CC[NH2+]C12CCCC2 ZINC000902453071 584607864 /nfs/dbraw/zinc/60/78/64/584607864.db2.gz BZDAEOXBCSXJDQ-RFGFWPKPSA-N 2 0 234.387 2.439 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]CC[C@H]1CCC(F)(F)C1 ZINC000902452739 584607919 /nfs/dbraw/zinc/60/79/19/584607919.db2.gz AGFVGYMUXGJSTH-GMTAPVOTSA-N 2 0 232.318 2.281 20 0 BEADRP C1[C@H]2CCC[C@H]2[C@H]1[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000902453469 584607934 /nfs/dbraw/zinc/60/79/34/584607934.db2.gz DBZWMRDYUSKMJU-KYFQHEKYSA-N 2 0 234.387 2.153 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCCC2(CC2)C1)[C@@H]1CCC[NH2+]1 ZINC000902455216 584609666 /nfs/dbraw/zinc/60/96/66/584609666.db2.gz WWEKUBFVAFTXGF-AGIUHOORSA-N 2 0 222.376 2.439 20 0 BEADRP C1CC1[C@H]([NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2)C1CCCC1 ZINC000902461760 584611213 /nfs/dbraw/zinc/61/12/13/584611213.db2.gz RHYWBBQMKLBXKP-GBJTYRQASA-N 2 0 234.387 2.438 20 0 BEADRP C1CC1[C@H]1CCCC[C@@H]1[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902463637 584612091 /nfs/dbraw/zinc/61/20/91/584612091.db2.gz AERUVHRGIZAXCH-XPABHHOTSA-N 2 0 234.387 2.438 20 0 BEADRP C1C[C@@H]2[NH2+][C@H]1C[C@@H]2[NH2+]C1C2CC3CC(C2)CC1C3 ZINC000902464637 584612754 /nfs/dbraw/zinc/61/27/54/584612754.db2.gz BAUASSZKSUYNOJ-GGTCIGHJSA-N 2 0 246.398 2.294 20 0 BEADRP CC(C)CC[C@@H](C)[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902464741 584612885 /nfs/dbraw/zinc/61/28/85/584612885.db2.gz CJBRGNSRAWUFLU-YVECIDJPSA-N 2 0 210.365 2.294 20 0 BEADRP C[C@H]1CC(C)(C)C[C@@H]1[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902465096 584613392 /nfs/dbraw/zinc/61/33/92/584613392.db2.gz DCLJUSHROQSXBY-YYHQMBLXSA-N 2 0 222.376 2.294 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2)C1CCSCC1 ZINC000902468267 584614426 /nfs/dbraw/zinc/61/44/26/584614426.db2.gz SPAWFYYAJUDTTC-FOUMNBMASA-N 2 0 240.416 2.001 20 0 BEADRP C[C@@H]1CC[C@@H](C)[C@@H]([NH2+][C@@H]2C[C@H]3CC[C@@H]2[NH2+]3)C1 ZINC000902469162 584615641 /nfs/dbraw/zinc/61/56/41/584615641.db2.gz YLNXSWLIRCAFNO-IZMFDJJNSA-N 2 0 222.376 2.294 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+][C@@H]2C[C@@H]3CC[C@H]2[NH2+]3)C1 ZINC000902469285 584615697 /nfs/dbraw/zinc/61/56/97/584615697.db2.gz VUOXQZRVHZKHQU-UJPOAAIJSA-N 2 0 208.349 2.048 20 0 BEADRP C1CC(C([NH2+][C@@H]2C[C@@H]3CC[C@H]2[NH2+]3)C2CCC2)C1 ZINC000902470665 584616161 /nfs/dbraw/zinc/61/61/61/584616161.db2.gz ZKCITMMDLWSHNL-BFHYXJOUSA-N 2 0 234.387 2.438 20 0 BEADRP CC1(C)CCC[C@H]([NH2+][C@@H]2C[C@@H]3CC[C@H]2[NH2+]3)C1 ZINC000902472139 584617512 /nfs/dbraw/zinc/61/75/12/584617512.db2.gz XSDFSQOXSRAFFX-WUHRBBMRSA-N 2 0 222.376 2.438 20 0 BEADRP C[C@@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1ccccc1F ZINC000902489957 584617632 /nfs/dbraw/zinc/61/76/32/584617632.db2.gz SYRLRCHSQDDXHD-GMTAPVOTSA-N 2 0 222.307 2.214 20 0 BEADRP C[C@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1ccsc1 ZINC000902490579 584618201 /nfs/dbraw/zinc/61/82/01/584618201.db2.gz XQCGGBUGAJRUIV-QXEWZRGKSA-N 2 0 210.346 2.136 20 0 BEADRP CC[C@H]1CCC[C@@H]([NH2+][C@H]2C[C@H](C[NH3+])C2)C1 ZINC000902491807 584618306 /nfs/dbraw/zinc/61/83/06/584618306.db2.gz ZXVIRQSKWSXMJM-RVMXOQNASA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+][C@@H]2CCc3ccc(F)cc32)C1 ZINC000902490500 584618324 /nfs/dbraw/zinc/61/83/24/584618324.db2.gz VRIBWCSQHGEHID-GAJTVXKRSA-N 2 0 234.318 2.140 20 0 BEADRP C[C@@H]1CC=CC[C@H]1[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000902503859 584621691 /nfs/dbraw/zinc/62/16/91/584621691.db2.gz LIYUIYKSNGUNCF-KJWHEZOQSA-N 2 0 234.387 2.319 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC=CC[C@H]1C)[C@H]1CCC[NH2+]1 ZINC000902506163 584621829 /nfs/dbraw/zinc/62/18/29/584621829.db2.gz XFMDFHJWTGEGNC-FDYHWXHSSA-N 2 0 208.349 2.071 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC=CC[C@H]1C)[C@H]1CCC[NH2+]1 ZINC000902506170 584621953 /nfs/dbraw/zinc/62/19/53/584621953.db2.gz XFMDFHJWTGEGNC-YVECIDJPSA-N 2 0 208.349 2.071 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]C[C@@H]1CCCCC[NH2+]1 ZINC000902481178 584623498 /nfs/dbraw/zinc/62/34/98/584623498.db2.gz ARFCHFJSKMKHKR-AGIUHOORSA-N 2 0 210.365 2.297 20 0 BEADRP Cc1cc([C@H](C)[NH2+][C@H]2C[C@H](C[NH3+])C2)cs1 ZINC000902484140 584624639 /nfs/dbraw/zinc/62/46/39/584624639.db2.gz DMCDKSXWARZWLX-NHCYSSNCSA-N 2 0 224.373 2.444 20 0 BEADRP Cc1cc([C@@H](C)[NH2+][C@H]2C[C@H](C[NH3+])C2)cs1 ZINC000902484139 584624727 /nfs/dbraw/zinc/62/47/27/584624727.db2.gz DMCDKSXWARZWLX-CKYFFXLPSA-N 2 0 224.373 2.444 20 0 BEADRP C[C@H]1CC(C)(C)C[C@@H]1[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902484135 584624800 /nfs/dbraw/zinc/62/48/00/584624800.db2.gz DLEQPJVZSWNHNR-BJDJZHNGSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H](Cc1ccccc1F)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902485397 584624968 /nfs/dbraw/zinc/62/49/68/584624968.db2.gz KHOMBSJGOAJOSY-GVXVVHGQSA-N 2 0 236.334 2.084 20 0 BEADRP CCc1ccc([C@@H](C)[NH2+][C@H]2C[C@H](C[NH3+])C2)o1 ZINC000902486396 584625420 /nfs/dbraw/zinc/62/54/20/584625420.db2.gz GNHVTCUMIYOFFG-GMTAPVOTSA-N 2 0 222.332 2.230 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+][C@@H]2CCC[C@H]2CCCF)C1 ZINC000902485677 584625467 /nfs/dbraw/zinc/62/54/67/584625467.db2.gz MKYLGOBVUYJVRM-ZDEQEGDKSA-N 2 0 228.355 2.232 20 0 BEADRP C[C@@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1cccc(F)c1F ZINC000902485487 584625527 /nfs/dbraw/zinc/62/55/27/584625527.db2.gz LBDGSFXSQVEKCX-OPRDCNLKSA-N 2 0 240.297 2.353 20 0 BEADRP CCC1CCC([NH2+][C@H]2C[C@H](C[NH3+])C2)CC1 ZINC000902486807 584625770 /nfs/dbraw/zinc/62/57/70/584625770.db2.gz CCMMFFAGNYWOLX-FLWUZPLOSA-N 2 0 210.365 2.282 20 0 BEADRP CC[C@H]1CCCC[C@@H]1[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902487335 584626097 /nfs/dbraw/zinc/62/60/97/584626097.db2.gz SZMNLHCJUNHPLH-CYDGBPFRSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H](Cc1ccsc1)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902487120 584626102 /nfs/dbraw/zinc/62/61/02/584626102.db2.gz JUBBYPQWFALNQG-DLOVCJGASA-N 2 0 224.373 2.006 20 0 BEADRP C[C@@H](Cc1cccs1)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902488595 584627337 /nfs/dbraw/zinc/62/73/37/584627337.db2.gz NKFQFBXHYCYXSV-DCAQKATOSA-N 2 0 224.373 2.006 20 0 BEADRP C[C@H](CCc1ccccc1)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902488606 584627362 /nfs/dbraw/zinc/62/73/62/584627362.db2.gz NOGVAXKOIIIEKW-BPLDGKMQSA-N 2 0 232.371 2.335 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)CC2 ZINC000902489304 584627388 /nfs/dbraw/zinc/62/73/88/584627388.db2.gz OMPMLBYIZFXIHY-UXIGCNINSA-N 2 0 230.355 2.309 20 0 BEADRP CC(C)[C@@H]1CCC[C@H]1[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902489340 584627428 /nfs/dbraw/zinc/62/74/28/584627428.db2.gz PEKIKEZJZBEBFE-ZDEQEGDKSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+][C@H]2C[C@H](C[NH3+])C2)[C@@H]1C ZINC000902488675 584627543 /nfs/dbraw/zinc/62/75/43/584627543.db2.gz ZRSJKFNSUORSLW-SYLRKERUSA-N 2 0 210.365 2.138 20 0 BEADRP COc1cc(C)ccc1[C@@H](C)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902489381 584627638 /nfs/dbraw/zinc/62/76/38/584627638.db2.gz PVWGLGBBLQYNQT-JHJVBQTASA-N 2 0 248.370 2.392 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]C/C=C/Cl ZINC000902522042 584631311 /nfs/dbraw/zinc/63/13/11/584631311.db2.gz VPAJFKAIXCHDGE-BSPAPZMXSA-N 2 0 239.750 2.252 20 0 BEADRP Cl/C=C/C[NH2+][C@@H]1CC[NH2+]C[C@H]1C1CCCC1 ZINC000902522005 584631711 /nfs/dbraw/zinc/63/17/11/584631711.db2.gz VECBEQKBQQKNLE-XBFYPFSCSA-N 2 0 242.794 2.497 20 0 BEADRP C[NH+](C)CCC[NH2+][C@@H]1C[C@H]2CCC[C@H]2C1 ZINC000902721399 584660129 /nfs/dbraw/zinc/66/01/29/584660129.db2.gz ZYMBQBAFKHCAKV-CLLJXQQHSA-N 2 0 210.365 2.106 20 0 BEADRP C[N@H+]1CC=C(C[NH2+]C2C[C@H]3CCC[C@@H]3C2)CC1 ZINC000902896932 584691405 /nfs/dbraw/zinc/69/14/05/584691405.db2.gz NKSBWLJYQAYUOR-ZIAGYGMSSA-N 2 0 234.387 2.417 20 0 BEADRP C[N@@H+]1CCCC[C@@H]1CCN1CCC[C@H](F)C1 ZINC000903002141 584716546 /nfs/dbraw/zinc/71/65/46/584716546.db2.gz WUOVXZFABKJGLJ-QWHCGFSZSA-N 2 0 228.355 2.295 20 0 BEADRP C[C@H](C[NH2+]C1CC2(CCC2)C1)C[NH+](C)C ZINC000903174860 584732503 /nfs/dbraw/zinc/73/25/03/584732503.db2.gz NTAUCLMEKCZBDS-LLVKDONJSA-N 2 0 210.365 2.106 20 0 BEADRP CO[C@H]1CCC[C@@H]1[NH2+]CCC[N@H+](C)CC(C)C ZINC000903195061 584734258 /nfs/dbraw/zinc/73/42/58/584734258.db2.gz URXUWRZKWLZSLO-KBPBESRZSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@@H+]1CCC[C@@H]1C(C)(C)C ZINC000903435084 584762296 /nfs/dbraw/zinc/76/22/96/584762296.db2.gz NFUVHSAHIXMKSG-FRRDWIJNSA-N 2 0 224.392 2.352 20 0 BEADRP [NH3+]CC1CC[NH+](Cc2ccc3cc[nH]c3c2)CC1 ZINC000903420978 584763922 /nfs/dbraw/zinc/76/39/22/584763922.db2.gz IVXIDYYLIMIZBY-UHFFFAOYSA-N 2 0 243.354 2.339 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@H]1CC[C@@H](C)C[C@H]1C ZINC000903458926 584766181 /nfs/dbraw/zinc/76/61/81/584766181.db2.gz NFFDTUZHDNZNOR-POQQGIQPSA-N 2 0 224.392 2.256 20 0 BEADRP C[C@H]([NH3+])[C@H]1CC[N@H+](Cc2ccc3cc[nH]c3c2)C1 ZINC000903447137 584770887 /nfs/dbraw/zinc/77/08/87/584770887.db2.gz GOFGYSHYKISOQK-FZMZJTMJSA-N 2 0 243.354 2.337 20 0 BEADRP CC(F)(F)CCC[NH+]1CCC2(CC[NH2+]C2)CC1 ZINC000903452223 584771803 /nfs/dbraw/zinc/77/18/03/584771803.db2.gz JOHKKRGHGJUTKR-UHFFFAOYSA-N 2 0 246.345 2.497 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[N@@H+]2CCc3cccc(F)c3C2)C1 ZINC000903455109 584773473 /nfs/dbraw/zinc/77/34/73/584773473.db2.gz QDIXNDTVYVGYTH-WCQYABFASA-N 2 0 248.345 2.311 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[N@@H+]2CCC[C@@H]2c2ccncc2)C1 ZINC000903455496 584774360 /nfs/dbraw/zinc/77/43/60/584774360.db2.gz WUOLUNJDKIIWDN-NWANDNLSSA-N 2 0 245.370 2.346 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@@H+]1[C@@H](C)CCC1(C)C ZINC000903482323 584778821 /nfs/dbraw/zinc/77/88/21/584778821.db2.gz BRZYQWFYOQJJOA-WOPDTQHZSA-N 2 0 210.365 2.105 20 0 BEADRP C([NH2+][C@H]1CC[NH2+]C12CCCC2)C1CCC1 ZINC000903483035 584778984 /nfs/dbraw/zinc/77/89/84/584778984.db2.gz BLVYFQMTQHHSLC-LBPRGKRZSA-N 2 0 208.349 2.051 20 0 BEADRP CCCCC[NH2+][C@H]1CC[NH2+]C12CCCC2 ZINC000903487452 584779764 /nfs/dbraw/zinc/77/97/64/584779764.db2.gz ADMPOUMKUMMIBL-LBPRGKRZSA-N 2 0 210.365 2.441 20 0 BEADRP C[N@H+](C[C@@H]1CCCC[NH2+]C1)C(C1CC1)C1CC1 ZINC000903727313 584793038 /nfs/dbraw/zinc/79/30/38/584793038.db2.gz SGESEHOSKJGGQH-GFCCVEGCSA-N 2 0 236.403 2.497 20 0 BEADRP [NH3+]C[C@@H]1CCC[N@H+](Cc2ccccc2CF)C1 ZINC000903713159 584793566 /nfs/dbraw/zinc/79/35/66/584793566.db2.gz GKEMGSBPXDRWGG-LBPRGKRZSA-N 2 0 236.334 2.327 20 0 BEADRP CC1CC(C[NH+]2CCC([C@@H]3CC[NH2+]C3)CC2)C1 ZINC000903749196 584794620 /nfs/dbraw/zinc/79/46/20/584794620.db2.gz HZNRBYCQWXVVDQ-SSDMNJCBSA-N 2 0 236.403 2.354 20 0 BEADRP C[N@H+](Cc1ccccc1CF)C1CC([NH3+])C1 ZINC000903750367 584795535 /nfs/dbraw/zinc/79/55/35/584795535.db2.gz YYGJSRKQZVKSKD-UHFFFAOYSA-N 2 0 222.307 2.078 20 0 BEADRP C[C@@H]([NH3+])[C@H]1CC[N@H+](Cc2ccccc2CF)C1 ZINC000903744719 584796536 /nfs/dbraw/zinc/79/65/36/584796536.db2.gz XMXQSWWXBFPOSJ-YPMHNXCESA-N 2 0 236.334 2.325 20 0 BEADRP FCCC1CC[NH+](C[C@@H]2CCCC[NH2+]C2)CC1 ZINC000903777022 584799216 /nfs/dbraw/zinc/79/92/16/584799216.db2.gz ZBICLSQCLBVSBW-CQSZACIVSA-N 2 0 242.382 2.448 20 0 BEADRP COCCC[N@@H+]1CCCC[C@H]1C1(C[NH3+])CCC1 ZINC000903810717 584803599 /nfs/dbraw/zinc/80/35/99/584803599.db2.gz FZYZJIJLIFPBGC-ZDUSSCGKSA-N 2 0 240.391 2.006 20 0 BEADRP C[C@]12C[N@H+](CC[C@@H]3CC[NH2+]C3)C[C@H]1[C@H]1C=C[C@@H]2C1 ZINC000903826308 584805043 /nfs/dbraw/zinc/80/50/43/584805043.db2.gz HVFGFBVZIWBZOZ-ARKGTOAJSA-N 2 0 246.398 2.130 20 0 BEADRP C[C@]12C[N@H+](C[C@@H]3CCC[NH2+]C3)C[C@H]1[C@H]1C=C[C@@H]2C1 ZINC000903826532 584805082 /nfs/dbraw/zinc/80/50/82/584805082.db2.gz LICRVMQQHILQMK-DGADGQDISA-N 2 0 246.398 2.130 20 0 BEADRP CC1(C)CC(C[N@@H+]2CCC[C@@]23CC[NH2+]C3)C1 ZINC000903869321 584814538 /nfs/dbraw/zinc/81/45/38/584814538.db2.gz GXACRTFFIAOPTG-AWEZNQCLSA-N 2 0 222.376 2.251 20 0 BEADRP [NH3+][C@H](CC(F)F)CN1CC[C@H](C2CCC2)C1 ZINC000903929155 584824556 /nfs/dbraw/zinc/82/45/56/584824556.db2.gz AZYCGOWJADZVPY-WDEREUQCSA-N 2 0 232.318 2.091 20 0 BEADRP CC(C)([NH3+])CC[NH2+]CC1=Cc2ccccc2OC1 ZINC000903939086 584826376 /nfs/dbraw/zinc/82/63/76/584826376.db2.gz CUYNDXHDOCUHMW-UHFFFAOYSA-N 2 0 246.354 2.179 20 0 BEADRP CC1(C)CCC[C@H]1[NH2+]C[C@@H]1C[NH2+]CCC1(F)F ZINC000903957954 584827688 /nfs/dbraw/zinc/82/76/88/584827688.db2.gz UYTVHLHWWBMAKP-WDEREUQCSA-N 2 0 246.345 2.400 20 0 BEADRP Cc1ccccc1C[NH2+]CC[C@@H]1C[NH2+]C[C@H]1C ZINC000903973450 584832564 /nfs/dbraw/zinc/83/25/64/584832564.db2.gz DPEYEWXPSHTMAX-UKRRQHHQSA-N 2 0 232.371 2.330 20 0 BEADRP CCC[C@@H](C)C[NH2+]CC[C@@H]1C[NH2+]C[C@H]1C ZINC000903974145 584832623 /nfs/dbraw/zinc/83/26/23/584832623.db2.gz KCVOVWVNWVZKQY-JHJVBQTASA-N 2 0 212.381 2.258 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+]Cc1cccc(F)c1 ZINC000903975243 584832641 /nfs/dbraw/zinc/83/26/41/584832641.db2.gz ZSOCMISPTSFJKF-DGCLKSJQSA-N 2 0 236.334 2.161 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+][C@@H]1CCC[C@@H](C)C1 ZINC000903975090 584832712 /nfs/dbraw/zinc/83/27/12/584832712.db2.gz XBRAPMLRFROLAJ-AAVRWANBSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+][C@@H]1CCCC[C@H]1C1CC1 ZINC000903963591 584833567 /nfs/dbraw/zinc/83/35/67/584833567.db2.gz BQFXGNDWFPURBZ-YXCITZCRSA-N 2 0 222.376 2.153 20 0 BEADRP CC[C@H]1CCC[C@@H]([NH2+][C@@H]2C[NH2+]C[C@H]2C)C1 ZINC000903964093 584833851 /nfs/dbraw/zinc/83/38/51/584833851.db2.gz LHTFSQQFQJEZLJ-YVECIDJPSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]1C[C@@H](C[NH2+]C2CCC=CCC2)CC[NH2+]1 ZINC000903964564 584833977 /nfs/dbraw/zinc/83/39/77/584833977.db2.gz UGLXIAAHRHRKNL-STQMWFEESA-N 2 0 222.376 2.463 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC000903966733 584834429 /nfs/dbraw/zinc/83/44/29/584834429.db2.gz ALDDBHAFVAPXLK-OEAJRASXSA-N 2 0 244.382 2.235 20 0 BEADRP C[C@H](Cc1ccsc1)[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000903967361 584834949 /nfs/dbraw/zinc/83/49/49/584834949.db2.gz IHJDZLDZJUFXKN-WZRBSPASSA-N 2 0 238.400 2.124 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1C[NH2+]C[C@H]1C)C1CCCCC1 ZINC000903967704 584835002 /nfs/dbraw/zinc/83/50/02/584835002.db2.gz LFCLNCYWNUWLOX-DYEKYZERSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H](C[NH2+]C[C@@H]1C[NH2+]C[C@H]1C)Cc1ccccc1 ZINC000903968325 584835041 /nfs/dbraw/zinc/83/50/41/584835041.db2.gz SSBCUVQVTHMBTI-IIAWOOMASA-N 2 0 246.398 2.310 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@@H]1CCC[C@@H](C)C1 ZINC000903968396 584835061 /nfs/dbraw/zinc/83/50/61/584835061.db2.gz UYRZRRNUIYTUOR-FVCCEPFGSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@H]1CCC[C@H](C2CC2)C1 ZINC000903967514 584835076 /nfs/dbraw/zinc/83/50/76/584835076.db2.gz KDXYLPANKDEFSK-UNQGMJICSA-N 2 0 236.403 2.400 20 0 BEADRP COc1ccc([C@@H](C)[N@H+](C)C[C@H]2C[C@@H]([NH3+])C2)cc1 ZINC000904307098 584861677 /nfs/dbraw/zinc/86/16/77/584861677.db2.gz KXOABSFFAVZRFT-BZPMIXESSA-N 2 0 248.370 2.425 20 0 BEADRP C[N@H+](CCc1ccccc1F)C[C@H]1C[C@@H]([NH3+])C1 ZINC000904311788 584862919 /nfs/dbraw/zinc/86/29/19/584862919.db2.gz CEYXUQVTIGPLKI-BJHJDKERSA-N 2 0 236.334 2.037 20 0 BEADRP CC(C)(C)CC[C@@H]([NH3+])C[NH2+][C@H](CO)C(C)(C)C ZINC000904338557 584864812 /nfs/dbraw/zinc/86/48/12/584864812.db2.gz SXNBBEUECUTLEF-VXGBXAGGSA-N 2 0 244.423 2.137 20 0 BEADRP CCS[C@@H]1CC[C@@H]([N@H+](C)C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000904325961 584865319 /nfs/dbraw/zinc/86/53/19/584865319.db2.gz AAKKGWVSOXTOGV-YVECIDJPSA-N 2 0 242.432 2.330 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+]C2(c3ccccc3)CCC2)C1 ZINC000904327941 584865357 /nfs/dbraw/zinc/86/53/57/584865357.db2.gz JUUKFKILWRPQOS-XBXGTLAGSA-N 2 0 230.355 2.393 20 0 BEADRP CC[C@](C)(CCO)[NH2+]C[C@@H]([NH3+])CCC(C)(C)C ZINC000904329456 584865812 /nfs/dbraw/zinc/86/58/12/584865812.db2.gz NWHXJVAEHRXGJV-GXTWGEPZSA-N 2 0 244.423 2.281 20 0 BEADRP CCC[C@](C)(CO)[NH2+]C[C@H]([NH3+])CCC(C)(C)C ZINC000904330038 584866225 /nfs/dbraw/zinc/86/62/25/584866225.db2.gz XJNUHWJVHBFKKA-TZMCWYRMSA-N 2 0 244.423 2.281 20 0 BEADRP CC1CCC(C)([NH2+]C[C@H]2C[C@@H]([NH3+])C2)CC1 ZINC000904329426 584866281 /nfs/dbraw/zinc/86/62/81/584866281.db2.gz ZBTMXVMAVGWLOQ-UNTZMWQOSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[N@@H+]2CCC[C@H]2c2ccc(O)cc2)C1 ZINC000904335364 584866620 /nfs/dbraw/zinc/86/66/20/584866620.db2.gz CUWGBKYOZNGKNO-LNSITVRQSA-N 2 0 246.354 2.266 20 0 BEADRP C[N@H+](C[C@H]1C[C@@H]([NH3+])C1)CC1(c2ccccc2)CC1 ZINC000904342562 584867126 /nfs/dbraw/zinc/86/71/26/584867126.db2.gz KQNACPDUOXXIHG-OTVXOJSOSA-N 2 0 244.382 2.387 20 0 BEADRP Cc1cc(F)cc2c1C[N@H+](C[C@H]1C[C@@H]([NH3+])C1)CC2 ZINC000904344922 584867842 /nfs/dbraw/zinc/86/78/42/584867842.db2.gz BGULCBZEVHXYNF-VDISTLRHSA-N 2 0 248.345 2.230 20 0 BEADRP C[C@H]1CC[N@H+](C[C@H]2C[C@@H]([NH3+])C2)CC1(C)C ZINC000904345686 584868193 /nfs/dbraw/zinc/86/81/93/584868193.db2.gz IRJOHEPDCNASGL-SDDRHHMPSA-N 2 0 210.365 2.092 20 0 BEADRP CC(C)C1(C)CC[NH+](C[C@H]2C[C@@H]([NH3+])C2)CC1 ZINC000904348584 584868247 /nfs/dbraw/zinc/86/82/47/584868247.db2.gz SGJMHWSDDHWRLB-BETUJISGSA-N 2 0 224.392 2.482 20 0 BEADRP C[C@H]1COc2ccccc2C[N@@H+]1C[C@H]1C[C@@H]([NH3+])C1 ZINC000904345337 584868269 /nfs/dbraw/zinc/86/82/69/584868269.db2.gz CWHBYBDSPNVDHB-SGMGOOAPSA-N 2 0 246.354 2.007 20 0 BEADRP CCC1(CC)C[N@H+](C[C@H]2C[C@@H]([NH3+])C2)CCS1 ZINC000904347490 584868623 /nfs/dbraw/zinc/86/86/23/584868623.db2.gz HGSAAVUQMVACJG-TXEJJXNPSA-N 2 0 242.432 2.331 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@H]2C[C@@H]([NH3+])C2)CC1(C)C ZINC000904345687 584868662 /nfs/dbraw/zinc/86/86/62/584868662.db2.gz IRJOHEPDCNASGL-UTUOFQBUSA-N 2 0 210.365 2.092 20 0 BEADRP CC(C)C[C@@H](C[NH3+])NC[C@@H]([NH3+])CCC(C)(C)C ZINC000904353385 584869929 /nfs/dbraw/zinc/86/99/29/584869929.db2.gz LEODYFCZBNRQLW-STQMWFEESA-N 3 0 243.439 2.103 20 0 BEADRP C[C@H]1C[C@H]([NH2+]C2CC(C[NH3+])C2)C[C@@H](C)C1 ZINC000904360107 584871684 /nfs/dbraw/zinc/87/16/84/584871684.db2.gz HPXAVNKJRMYRAD-ZMFKDXALSA-N 2 0 210.365 2.138 20 0 BEADRP CC(C)(C)CC[C@@H]([NH3+])CN[C@H](C[NH3+])C(C)(C)C ZINC000904357690 584872144 /nfs/dbraw/zinc/87/21/44/584872144.db2.gz ADFLAMVBUQUDAB-VXGBXAGGSA-N 2 0 243.439 2.103 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@@H]2C[C@@H]2C2CCCCC2)C1 ZINC000904368392 584872930 /nfs/dbraw/zinc/87/29/30/584872930.db2.gz QYBBCOIQWURXLG-YXCITZCRSA-N 2 0 222.376 2.282 20 0 BEADRP CSc1ccc(C[NH2+]C[C@H]2C[C@@H]([NH3+])C2)cc1 ZINC000904368034 584872938 /nfs/dbraw/zinc/87/29/38/584872938.db2.gz GXMNNBREKVPMLI-TXEJJXNPSA-N 2 0 236.384 2.235 20 0 BEADRP COc1ccc(C)cc1[C@H](C)[NH2+]C1CC(C[NH3+])C1 ZINC000904371731 584873121 /nfs/dbraw/zinc/87/31/21/584873121.db2.gz SDTGCGWLXYMMFM-HIFPTAJRSA-N 2 0 248.370 2.392 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+]C[C@@H]([NH3+])CCC(C)(C)C)O1 ZINC000904370538 584873225 /nfs/dbraw/zinc/87/32/25/584873225.db2.gz AIGQTHGZHQCFPI-FRRDWIJNSA-N 2 0 242.407 2.297 20 0 BEADRP CC(C)[C@H](C[NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1cccnc1 ZINC000904364340 584874607 /nfs/dbraw/zinc/87/46/07/584874607.db2.gz VQZSGNWVISGOPU-CFVMTHIKSA-N 2 0 247.386 2.148 20 0 BEADRP CC1(F)CC[NH+](C[C@]2(C)CCC[NH2+]C2)CC1 ZINC000904384426 584877445 /nfs/dbraw/zinc/87/74/45/584877445.db2.gz KKVNUUILBXUVMN-GFCCVEGCSA-N 2 0 228.355 2.200 20 0 BEADRP CC1([NH2+]C[C@H]2C[C@@H]([NH3+])C2)CCC(F)(F)CC1 ZINC000904381594 584877472 /nfs/dbraw/zinc/87/74/72/584877472.db2.gz ZLDYZANRJDAASH-AOOOYVTPSA-N 2 0 232.318 2.281 20 0 BEADRP C[C@@H]1C[N@H+](Cc2ccsc2)CC[C@@H]1C[NH3+] ZINC000904410877 584879101 /nfs/dbraw/zinc/87/91/01/584879101.db2.gz HBLFFCDXSVGHKK-ZYHUDNBSSA-N 2 0 224.373 2.165 20 0 BEADRP C[N@@H+]1CCC[C@H](CC[NH2+]C[C@@H]2CCC=CO2)C1 ZINC000839181973 585096797 /nfs/dbraw/zinc/09/67/97/585096797.db2.gz KVZGWZUMVYZUQT-KGLIPLIRSA-N 2 0 238.375 2.001 20 0 BEADRP C[N@@H+]1CCC[C@H](CC[NH2+]C[C@H]2CCC=CO2)C1 ZINC000839181976 585096857 /nfs/dbraw/zinc/09/68/57/585096857.db2.gz KVZGWZUMVYZUQT-ZIAGYGMSSA-N 2 0 238.375 2.001 20 0 BEADRP CCCC[C@@H](COC)[NH2+]CCN1CCC[C@H]1C ZINC000766271337 585500126 /nfs/dbraw/zinc/50/01/26/585500126.db2.gz UEHSITNMLCLHAD-KGLIPLIRSA-N 2 0 242.407 2.266 20 0 BEADRP C[NH+]1CCC(C)(C[NH2+]C2CC(C(F)F)C2)CC1 ZINC000769550721 585559265 /nfs/dbraw/zinc/55/92/65/585559265.db2.gz DVLDFGXVYWTKID-UHFFFAOYSA-N 2 0 246.345 2.352 20 0 BEADRP CCCC[N@@H+]1CCC[C@H]2C[NH+](C)CC[C@@H]21 ZINC000769663942 585561504 /nfs/dbraw/zinc/56/15/04/585561504.db2.gz ZWRBHEANVHYNMM-STQMWFEESA-N 2 0 210.365 2.203 20 0 BEADRP CCC[C@@H](C)C[NH+]1CCC([NH+](C)C)CC1 ZINC000775654263 585682571 /nfs/dbraw/zinc/68/25/71/585682571.db2.gz WBYAPDNBBVQDNP-GFCCVEGCSA-N 2 0 212.381 2.449 20 0 BEADRP C[C@@H](C1CC1)[NH+]1CCC(C[NH+](C)C)CC1 ZINC000777691176 585718666 /nfs/dbraw/zinc/71/86/66/585718666.db2.gz VAGRDPQTFFIHMJ-NSHDSACASA-N 2 0 210.365 2.059 20 0 BEADRP C[C@@H](C1CC1)[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000777910271 585723663 /nfs/dbraw/zinc/72/36/63/585723663.db2.gz GNCJLRNTPGMZGT-LBPRGKRZSA-N 2 0 224.392 2.449 20 0 BEADRP C[C@H](CCO)[NH2+]CCCC[N@@H+]1CCCC[C@@H]1C ZINC000779341417 585751772 /nfs/dbraw/zinc/75/17/72/585751772.db2.gz MLIORNHSTDKUFO-KGLIPLIRSA-N 2 0 242.407 2.002 20 0 BEADRP C[C@@H](C1CC1)[NH+]1CCC(c2ncc[nH]2)CC1 ZINC000782180095 585809966 /nfs/dbraw/zinc/80/99/66/585809966.db2.gz DKZALHKYNBJOAO-JTQLQIEISA-N 2 0 219.332 2.388 20 0 BEADRP C[C@@H]([N@H+](C)CC1CC[NH+](C)CC1)C1(C)CC1 ZINC000782184100 585810776 /nfs/dbraw/zinc/81/07/76/585810776.db2.gz QVSQWNBIKBLKCX-GFCCVEGCSA-N 2 0 224.392 2.449 20 0 BEADRP C[C@H]1SCC[N@H+](CC2CC[NH+](C)CC2)[C@H]1C ZINC000788480476 585925182 /nfs/dbraw/zinc/92/51/82/585925182.db2.gz KCPRQYVYALVYRU-NWDGAFQWSA-N 2 0 242.432 2.154 20 0 BEADRP CCC[N@H+](CC1CC1)CC1CC[NH+](C)CC1 ZINC000788471395 585925333 /nfs/dbraw/zinc/92/53/33/585925333.db2.gz RUHXNXUOJGYKJC-UHFFFAOYSA-N 2 0 224.392 2.450 20 0 BEADRP C[C@H]1SCC[N@H+](CC2CC[NH+](C)CC2)[C@@H]1C ZINC000788480478 585925452 /nfs/dbraw/zinc/92/54/52/585925452.db2.gz KCPRQYVYALVYRU-VXGBXAGGSA-N 2 0 242.432 2.154 20 0 BEADRP C[C@@H]1SCC[N@H+](CC2CC[NH+](C)CC2)[C@H]1C ZINC000788480477 585925464 /nfs/dbraw/zinc/92/54/64/585925464.db2.gz KCPRQYVYALVYRU-RYUDHWBXSA-N 2 0 242.432 2.154 20 0 BEADRP CN1CC[C@H]([NH2+]Cc2ccc3c(c2)CCCC3)C1 ZINC000813771800 586606290 /nfs/dbraw/zinc/60/62/90/586606290.db2.gz HLWTUTYMVKTJLU-INIZCTEOSA-N 2 0 244.382 2.359 20 0 BEADRP CC[C@H](C)[N@@H+]1CC[C@]2(C1)CCC[NH+](C)C2 ZINC000815145979 586670411 /nfs/dbraw/zinc/67/04/11/586670411.db2.gz JQYNLQZIKSDWAC-QWHCGFSZSA-N 2 0 210.365 2.203 20 0 BEADRP CC[C@@H](C)[N@@H+]1CC[C@]2(C1)CCC[NH+](C)C2 ZINC000815145977 586670461 /nfs/dbraw/zinc/67/04/61/586670461.db2.gz JQYNLQZIKSDWAC-CHWSQXEVSA-N 2 0 210.365 2.203 20 0 BEADRP C[C@@H](C[NH2+][C@@H]1CCOC[C@H]1[C@H](C)[NH3+])C(C)(C)C ZINC000817893967 586834114 /nfs/dbraw/zinc/83/41/14/586834114.db2.gz JTOJKAKXRNSHFW-ZDEQEGDKSA-N 2 0 242.407 2.011 20 0 BEADRP CS[C@@H]1CC[C@@H]([NH2+][C@H](C)[C@@H]2CCCC[NH2+]2)C1 ZINC000817897223 586834675 /nfs/dbraw/zinc/83/46/75/586834675.db2.gz HGUTYKXJBXOMLM-LPWJVIDDSA-N 2 0 242.432 2.391 20 0 BEADRP CSC(C)(C)C[NH2+][C@H]1CC[NH2+]CC[C@@H]1C ZINC000817899295 586836090 /nfs/dbraw/zinc/83/60/90/586836090.db2.gz KVYLSWBWOOJYLP-QWRGUYRKSA-N 2 0 230.421 2.106 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+]CCNc1ccccc1 ZINC000817900074 586836176 /nfs/dbraw/zinc/83/61/76/586836176.db2.gz KCTFUGMOVDZONE-DZGCQCFKSA-N 2 0 247.386 2.076 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+]CCC1CCC1 ZINC000817906747 586837418 /nfs/dbraw/zinc/83/74/18/586837418.db2.gz FEBYWKPSRBGQTL-WCQYABFASA-N 2 0 210.365 2.154 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]CCC1CCC1 ZINC000817907874 586837422 /nfs/dbraw/zinc/83/74/22/586837422.db2.gz YBTPFUXVVYFQCQ-CHWSQXEVSA-N 2 0 210.365 2.426 20 0 BEADRP Cc1cccc(OCCC[NH2+][C@H]2CCC[C@H]2[NH3+])c1 ZINC000817907774 586837463 /nfs/dbraw/zinc/83/74/63/586837463.db2.gz WETJPPWQBRKENW-CABCVRRESA-N 2 0 248.370 2.233 20 0 BEADRP [NH3+]CCc1ccc(C[NH2+][C@H]2CC[C@H]2C2CC2)cc1 ZINC000817947597 586846849 /nfs/dbraw/zinc/84/68/49/586846849.db2.gz BTWWEKHCBKNAAX-HOTGVXAUSA-N 2 0 244.382 2.466 20 0 BEADRP Cc1ccc2c(c1)CC[C@H]2[NH2+]CC[C@H](C)[NH3+] ZINC000817951102 586847906 /nfs/dbraw/zinc/84/79/06/586847906.db2.gz BGIKKEGOHVAYCG-SMDDNHRTSA-N 2 0 218.344 2.309 20 0 BEADRP Cc1cc(F)ccc1[C@@H](C)[NH2+]C[C@H](C)C[NH3+] ZINC000817961618 586853440 /nfs/dbraw/zinc/85/34/40/586853440.db2.gz AZMVEYLYAZMDDD-MWLCHTKSSA-N 2 0 224.323 2.380 20 0 BEADRP Cc1ccc2c(c1)CC[C@H]2[NH2+]CC1=CC[NH2+]CC1 ZINC000817967200 586856220 /nfs/dbraw/zinc/85/62/20/586856220.db2.gz FMXYBQVJUIKKHG-MRXNPFEDSA-N 2 0 242.366 2.492 20 0 BEADRP C[C@H](CSC(C)(C)C)[NH2+][C@@H]1CC[NH2+]C[C@@H]1C ZINC000817972122 586859694 /nfs/dbraw/zinc/85/96/94/586859694.db2.gz TWQVAQQSGIGASU-QJPTWQEYSA-N 2 0 244.448 2.494 20 0 BEADRP C[C@H](CSC(C)(C)C)[NH2+][C@H](C)[C@@H](C)[NH3+] ZINC000817978013 586861535 /nfs/dbraw/zinc/86/15/35/586861535.db2.gz TVNAYRGQLURIHY-OPRDCNLKSA-N 2 0 218.410 2.232 20 0 BEADRP [NH3+]CCCCCCCOc1cccc(C[NH3+])c1 ZINC000818618835 586907262 /nfs/dbraw/zinc/90/72/62/586907262.db2.gz RAJQFCCHTISMTI-UHFFFAOYSA-N 2 0 236.359 2.433 20 0 BEADRP C[C@H](O)C[NH2+]CCCCCCC[NH+]1CCCC1 ZINC000818974325 586919557 /nfs/dbraw/zinc/91/95/57/586919557.db2.gz LDIYMFGVEHWCFS-AWEZNQCLSA-N 2 0 242.407 2.003 20 0 BEADRP CCCN1CCC[C@H]1C[NH2+][C@@H]1CSC[C@@H]1C ZINC000824377075 587268072 /nfs/dbraw/zinc/26/80/72/587268072.db2.gz SQTXMNBNZRFSHP-RWMBFGLXSA-N 2 0 242.432 2.202 20 0 BEADRP CCCN1CCC[C@H]1C[NH2+][C@H]1CSC[C@H]1C ZINC000824377072 587268136 /nfs/dbraw/zinc/26/81/36/587268136.db2.gz SQTXMNBNZRFSHP-AGIUHOORSA-N 2 0 242.432 2.202 20 0 BEADRP CCCN1CCC[C@H]1C[NH2+][C@@H]1CSC[C@H]1C ZINC000824377074 587268317 /nfs/dbraw/zinc/26/83/17/587268317.db2.gz SQTXMNBNZRFSHP-FRRDWIJNSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H]1CC[C@H]1[NH2+]CCCC[N@H+](C)C1CC1 ZINC000834909620 587770356 /nfs/dbraw/zinc/77/03/56/587770356.db2.gz SPQUITOBSMPDLN-DGCLKSJQSA-N 2 0 210.365 2.249 20 0 BEADRP CC[NH2+]CCNCc1cc2cccc(OC)c2o1 ZINC000841034786 587936904 /nfs/dbraw/zinc/93/69/04/587936904.db2.gz DLCHDRKJDKPDGZ-UHFFFAOYSA-N 2 0 248.326 2.141 20 0 BEADRP C[C@H]1CCC[C@@H]1[NH2+]Cc1ccc(CC[NH3+])cc1 ZINC000841032669 587937330 /nfs/dbraw/zinc/93/73/30/587937330.db2.gz VKTHRJBFTMFLOH-WFASDCNBSA-N 2 0 232.371 2.466 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]Cc1ccc2c(c1)CC(C)(C)O2 ZINC000841048691 587939720 /nfs/dbraw/zinc/93/97/20/587939720.db2.gz KXMSDRQITRRFGF-LLVKDONJSA-N 2 0 248.370 2.085 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]Cc1cccnc1Cl ZINC000841080529 587945206 /nfs/dbraw/zinc/94/52/06/587945206.db2.gz SDNIRZDRJIMLDJ-SNVBAGLBSA-N 2 0 241.766 2.342 20 0 BEADRP [NH3+]CCC[C@H]([NH2+][C@@H]1CCCOC1)c1ccccc1 ZINC000841088226 587945508 /nfs/dbraw/zinc/94/55/08/587945508.db2.gz YTFXCXRPVSUXJB-CABCVRRESA-N 2 0 248.370 2.235 20 0 BEADRP C([NH2+]C1CCCCCCC1)[C@@H]1C[NH2+]CCCO1 ZINC000841086916 587946038 /nfs/dbraw/zinc/94/60/38/587946038.db2.gz QNYCWSLSGCBGBX-AWEZNQCLSA-N 2 0 240.391 2.067 20 0 BEADRP C[C@H](C[N@@H+]1CC[C@@]2(CCC[NH2+]2)C1)C(C)(C)C ZINC000841105339 587946540 /nfs/dbraw/zinc/94/65/40/587946540.db2.gz KIRODYTYJBEPPE-OCCSQVGLSA-N 2 0 224.392 2.497 20 0 BEADRP CC[N@H+](CCCCCCC[NH3+])C[C@@H]1CCOC1 ZINC000842471690 588028933 /nfs/dbraw/zinc/02/89/33/588028933.db2.gz TUCATCIODVYGAN-AWEZNQCLSA-N 2 0 242.407 2.254 20 0 BEADRP CC(C)(C)[C@H](CN)[NH2+]CCc1cccs1 ZINC000842475217 588029171 /nfs/dbraw/zinc/02/91/71/588029171.db2.gz LLCQFSAQUSZBSB-NSHDSACASA-N 2 0 226.389 2.254 20 0 BEADRP CC(C)(C)[C@H](C[NH3+])NCc1cccc(Cl)n1 ZINC000842475297 588029135 /nfs/dbraw/zinc/02/91/35/588029135.db2.gz MPZQMFBWABSNRC-JTQLQIEISA-N 2 0 241.766 2.198 20 0 BEADRP CN(CCCCCCC[NH3+])Cc1ccon1 ZINC000842472742 588029300 /nfs/dbraw/zinc/02/93/00/588029300.db2.gz JVYZTXCXDULJFJ-UHFFFAOYSA-N 2 0 225.336 2.016 20 0 BEADRP C[C@@H]([NH2+]CCCCCCC[NH3+])[C@H]1CCCOC1 ZINC000842478673 588029894 /nfs/dbraw/zinc/02/98/94/588029894.db2.gz MHBXZDXTWGIVSF-KGLIPLIRSA-N 2 0 242.407 2.300 20 0 BEADRP C[C@@H]([NH2+]CCCCCCC[NH3+])[C@@H]1CCCOC1 ZINC000842478675 588030113 /nfs/dbraw/zinc/03/01/13/588030113.db2.gz MHBXZDXTWGIVSF-ZIAGYGMSSA-N 2 0 242.407 2.300 20 0 BEADRP COc1ccsc1C[NH2+]C1CCC([NH3+])CC1 ZINC000843105147 588081649 /nfs/dbraw/zinc/08/16/49/588081649.db2.gz RCFYKZDUKHVKEU-UHFFFAOYSA-N 2 0 240.372 2.116 20 0 BEADRP CC(C)n1nccc1C[NH2+]CCCCCC[NH3+] ZINC000843127072 588081991 /nfs/dbraw/zinc/08/19/91/588081991.db2.gz CAQNSSCRBPKHHY-UHFFFAOYSA-N 2 0 238.379 2.073 20 0 BEADRP CCn1cc([C@@H](C)[NH2+]CCCCCC[NH3+])cn1 ZINC000843341425 588100992 /nfs/dbraw/zinc/10/09/92/588100992.db2.gz DAMLGKZFIHXOBL-GFCCVEGCSA-N 2 0 238.379 2.073 20 0 BEADRP [NH3+]CCCCCC[NH2+][C@H]1CC[C@H]1C1CC1 ZINC000843340294 588101112 /nfs/dbraw/zinc/10/11/12/588101112.db2.gz ABTHIWKSLYBSED-STQMWFEESA-N 2 0 210.365 2.284 20 0 BEADRP C[C@@H]([NH2+]CCCCCC[NH3+])c1ccc(F)cn1 ZINC000843340750 588101173 /nfs/dbraw/zinc/10/11/73/588101173.db2.gz DUZQJHZZIWMKKN-LLVKDONJSA-N 2 0 239.338 2.390 20 0 BEADRP C[N@H+](CCCc1ccncc1)C1CCC([NH3+])CC1 ZINC000843355349 588103174 /nfs/dbraw/zinc/10/31/74/588103174.db2.gz SZAHPOSMYLYPSY-UHFFFAOYSA-N 2 0 247.386 2.216 20 0 BEADRP Cc1ccc(C[N@@H+](C)C2CCC([NH3+])CC2)c(C)n1 ZINC000843355647 588103371 /nfs/dbraw/zinc/10/33/71/588103371.db2.gz YZOCKPIYHFIHME-UHFFFAOYSA-N 2 0 247.386 2.400 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CC[C@@]1(C)C[C@@]1(F)Cl ZINC000844923582 588218846 /nfs/dbraw/zinc/21/88/46/588218846.db2.gz LMZAYSWTKXHATN-NAKRPEOUSA-N 2 0 236.762 2.407 20 0 BEADRP C[C@]1(CC[NH2+][C@@H]2CCC[C@@H]2C[NH3+])C[C@@]1(F)Cl ZINC000844926579 588219305 /nfs/dbraw/zinc/21/93/05/588219305.db2.gz YULIPSJORMGUFA-WYUUTHIRSA-N 2 0 248.773 2.408 20 0 BEADRP Cl/C=C/C[N@@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1 ZINC000846221251 588261239 /nfs/dbraw/zinc/26/12/39/588261239.db2.gz VICACEDIOOXPKE-HKJRJLCPSA-N 2 0 228.767 2.060 20 0 BEADRP C[C@H]1CC2(C[N@@H+]1C/C=C/Cl)CC[NH2+]CC2 ZINC000846224460 588261611 /nfs/dbraw/zinc/26/16/11/588261611.db2.gz XSVZKOZBQZQQDA-DGXRNCNBSA-N 2 0 228.767 2.203 20 0 BEADRP [NH3+]CCCCCC[N@@H+]1CCC[C@H]1c1ncc[nH]1 ZINC000846223724 588261795 /nfs/dbraw/zinc/26/17/95/588261795.db2.gz MRZVMZSIOFAEKO-LBPRGKRZSA-N 2 0 236.363 2.066 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000848557156 588397039 /nfs/dbraw/zinc/39/70/39/588397039.db2.gz FVOQTXBYRARQRS-CRWXNKLISA-N 2 0 224.392 2.351 20 0 BEADRP [NH3+]CCCCCC[NH2+]Cc1ccccc1F ZINC000107787686 588405890 /nfs/dbraw/zinc/40/58/90/588405890.db2.gz BKLUAUIJSZAPGN-UHFFFAOYSA-N 2 0 224.323 2.434 20 0 BEADRP c1cc(C[NH2+][C@H]2C=CCC2)n(-c2cc[nH+]cc2)n1 ZINC000850359757 588540072 /nfs/dbraw/zinc/54/00/72/588540072.db2.gz QNYKYKIVNODNNY-LBPRGKRZSA-N 2 0 240.310 2.076 20 0 BEADRP C[C@H]1CCCN1CC[NH2+][C@@H]1CCCSCC1 ZINC000850439225 588546757 /nfs/dbraw/zinc/54/67/57/588546757.db2.gz MDVOCWRGJOOVPG-QWHCGFSZSA-N 2 0 242.432 2.346 20 0 BEADRP C([C@@H]1CC[C@@H]2C[C@@H]2C1)[N@@H+]1CC[C@]2(CCC[NH2+]2)C1 ZINC000852751353 588700339 /nfs/dbraw/zinc/70/03/39/588700339.db2.gz YWQJNDUBAGVXGQ-APIJFGDWSA-N 2 0 234.387 2.251 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+]C1CCCCCCC1 ZINC000863486690 589292675 /nfs/dbraw/zinc/29/26/75/589292675.db2.gz CNTQPYKSFKFLPL-WCQYABFASA-N 2 0 210.365 2.439 20 0 BEADRP C[C@H]([NH3+])CN(C)CCSCc1ccccc1 ZINC000863652295 589307765 /nfs/dbraw/zinc/30/77/65/589307765.db2.gz RCEFNXKWPKVPOG-LBPRGKRZSA-N 2 0 238.400 2.199 20 0 BEADRP Cc1cc(C[NH2+][C@@H]2CC[NH2+]CC(C)(C)C2)ccn1 ZINC000864054758 589335902 /nfs/dbraw/zinc/33/59/02/589335902.db2.gz AJEJNMHAHTWXKF-CQSZACIVSA-N 2 0 247.386 2.258 20 0 BEADRP C[NH+](C)C1(C)CCC([NH2+]CC2(F)CC2)CC1 ZINC000865765230 589461449 /nfs/dbraw/zinc/46/14/49/589461449.db2.gz LVVURJZTKFBEOP-UHFFFAOYSA-N 2 0 228.355 2.341 20 0 BEADRP Cc1cc(N2CC[N@@H+](C)C(C)(C)CC2)cc[nH+]1 ZINC000866112680 589477299 /nfs/dbraw/zinc/47/72/99/589477299.db2.gz IQVVZPYQOBFRTL-UHFFFAOYSA-N 2 0 233.359 2.311 20 0 BEADRP Cc1cccc(C[C@@H](C)[NH2+]CCC[NH+](C)C)c1 ZINC000866215184 589481067 /nfs/dbraw/zinc/48/10/67/589481067.db2.gz VINMWJBXIGRBBQ-CQSZACIVSA-N 2 0 234.387 2.467 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@@H](C)CCc1cccnc1 ZINC000866250216 589482765 /nfs/dbraw/zinc/48/27/65/589482765.db2.gz WOBVRYJPWUCNNM-UONOGXRCSA-N 2 0 249.402 2.333 20 0 BEADRP CC1(F)CC[NH+](CCCCCC[NH3+])CC1 ZINC000866685221 589511621 /nfs/dbraw/zinc/51/16/21/589511621.db2.gz FLOKZLOYDUYAJZ-UHFFFAOYSA-N 2 0 216.344 2.330 20 0 BEADRP C[NH2+]CCC[N@H+](C)Cc1ccc2cc[nH]c2c1 ZINC000866717573 589514320 /nfs/dbraw/zinc/51/43/20/589514320.db2.gz JBIMVOAVIVTQAN-UHFFFAOYSA-N 2 0 231.343 2.209 20 0 BEADRP CC(C)(C)[C@@]1(C[NH3+])CC[N@H+](C/C=C\Cl)C1 ZINC000866709050 589514366 /nfs/dbraw/zinc/51/43/66/589514366.db2.gz VKOVQWUPUDWHBJ-TXNVCOODSA-N 2 0 230.783 2.436 20 0 BEADRP [NH3+]CCCCCC[N@@H+]1CC[C@H]2CSC[C@H]2C1 ZINC000866704867 589514556 /nfs/dbraw/zinc/51/45/56/589514556.db2.gz ZAFAXPRKSYZRKG-QWHCGFSZSA-N 2 0 242.432 2.190 20 0 BEADRP CCOCCC[N@@H+]1CC[C@](C[NH3+])(C(C)(C)C)C1 ZINC000866705532 589514797 /nfs/dbraw/zinc/51/47/97/589514797.db2.gz BVKZNHWTVNIJID-CQSZACIVSA-N 2 0 242.407 2.110 20 0 BEADRP Cc1cncc([C@@H]2CCC[N@@H+]2C[C@@H]2CC[NH2+]C2)c1 ZINC000866720417 589515534 /nfs/dbraw/zinc/51/55/34/589515534.db2.gz KXFDCEHTRCPLMI-HIFRSBDPSA-N 2 0 245.370 2.136 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCCC[C@@H]1C[NH3+])C1CCC1 ZINC000123939265 589864693 /nfs/dbraw/zinc/86/46/93/589864693.db2.gz RKPYDSVNVOOOGP-CYZMBNFOSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]([NH2+][C@H]1CCCC[C@@H]1C[NH3+])C1CCC1 ZINC000123939676 589865760 /nfs/dbraw/zinc/86/57/60/589865760.db2.gz RKPYDSVNVOOOGP-UHTWSYAYSA-N 2 0 210.365 2.282 20 0 BEADRP C[N@H+](CCCCCC[NH3+])Cc1cccc(N)c1 ZINC000872155555 589886571 /nfs/dbraw/zinc/88/65/71/589886571.db2.gz PZJHHUQQZVDUNC-UHFFFAOYSA-N 2 0 235.375 2.220 20 0 BEADRP c1cc(NCC[NH+]2CCCCC2)c(C2CC2)c[nH+]1 ZINC000872414474 589936495 /nfs/dbraw/zinc/93/64/95/589936495.db2.gz SXILDJWWFDJAAB-UHFFFAOYSA-N 2 0 245.370 2.279 20 0 BEADRP CC[N@@H+]1CCCN(c2cc[nH+]cc2C2CC2)CC1 ZINC000872448269 589940262 /nfs/dbraw/zinc/94/02/62/589940262.db2.gz MHIOPRUCRWETGJ-UHFFFAOYSA-N 2 0 245.370 2.491 20 0 BEADRP C[C@@H]1C[C@H](Nc2cc[nH+]cc2C2CC2)CC[N@@H+]1C ZINC000872463051 589942074 /nfs/dbraw/zinc/94/20/74/589942074.db2.gz HKKVXKVODPJSHG-DGCLKSJQSA-N 2 0 245.370 2.276 20 0 BEADRP F[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000873216060 589996912 /nfs/dbraw/zinc/99/69/12/589996912.db2.gz IEBDDWJCAFCDMD-QNSTZXKLSA-N 2 0 240.366 2.245 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+][C@@H]2CCCC[C@@H]2F)C1 ZINC000873217626 589997799 /nfs/dbraw/zinc/99/77/99/589997799.db2.gz MNCABZDSHFMZSD-FIQHERPVSA-N 2 0 214.328 2.127 20 0 BEADRP [NH3+][C@@H]1C[C@H]1c1ccc(N[C@H]2CCC[C@@H]([NH3+])C2)cc1 ZINC000873215653 589998336 /nfs/dbraw/zinc/99/83/36/589998336.db2.gz KKPWIHNPRZUTGO-UQOMUDLDSA-N 2 0 245.370 2.183 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@@H]1C)C1CC[NH2+]CC1 ZINC000873222147 589999493 /nfs/dbraw/zinc/99/94/93/589999493.db2.gz BVNWPNDAYIYWQZ-GMXVVIOVSA-N 2 0 210.365 2.153 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]CC[C@@H]1CCSC1 ZINC000873234392 590004112 /nfs/dbraw/zinc/00/41/12/590004112.db2.gz CGPIEOKCHNKTJZ-UPJWGTAASA-N 2 0 242.432 2.379 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CCCS1)[C@@H]1CCCC[NH2+]1 ZINC000873244352 590004641 /nfs/dbraw/zinc/00/46/41/590004641.db2.gz RGZDHSIRQFEBQA-UPJWGTAASA-N 2 0 242.432 2.392 20 0 BEADRP CC[C@H]([NH2+]CC[C@@H]1CCSC1)[C@@H]1CCC[NH2+]1 ZINC000873235513 590004730 /nfs/dbraw/zinc/00/47/30/590004730.db2.gz NIQUBURMSPTYOG-AGIUHOORSA-N 2 0 242.432 2.250 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CCCS1)[C@H]1CCCC[NH2+]1 ZINC000873244349 590004802 /nfs/dbraw/zinc/00/48/02/590004802.db2.gz RGZDHSIRQFEBQA-FRRDWIJNSA-N 2 0 242.432 2.392 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+][C@@H]1CCCC[C@@H]1F ZINC000873239404 590005552 /nfs/dbraw/zinc/00/55/52/590005552.db2.gz VLUIETFLJUKJDQ-ZDEQEGDKSA-N 2 0 228.355 2.245 20 0 BEADRP [NH3+]C[C@H]1CC[C@H]([NH2+][C@H]2CC[C@@H]2C2CC2)CC1 ZINC000873238866 590005765 /nfs/dbraw/zinc/00/57/65/590005765.db2.gz IJERLFTVFFPPFI-ZRJCITRHSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CCCS1)[C@@H]1CCC[NH2+]1 ZINC000873242990 590006891 /nfs/dbraw/zinc/00/68/91/590006891.db2.gz HNSOZSVWJBYUHH-WOPDTQHZSA-N 2 0 228.405 2.002 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@H]2CCCc3ccccc3C2)C1 ZINC000873249979 590007361 /nfs/dbraw/zinc/00/73/61/590007361.db2.gz OJQIBVTWFHPPGC-MAZHCROVSA-N 2 0 244.382 2.261 20 0 BEADRP C[C@@H]1CC[C@@H](C)[C@H]([NH2+]C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000873249074 590007384 /nfs/dbraw/zinc/00/73/84/590007384.db2.gz ICHYFNYGVSPDFH-NJMOYASZSA-N 2 0 210.365 2.138 20 0 BEADRP CC(C)(C)[C@@H]1CC[C@H]1[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873249233 590007501 /nfs/dbraw/zinc/00/75/01/590007501.db2.gz IYVYPYRDRDQZOZ-WRWGMCAJSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@@H]([NH2+]C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000873249072 590007521 /nfs/dbraw/zinc/00/75/21/590007521.db2.gz ICHYFNYGVSPDFH-FHUSYTEZSA-N 2 0 210.365 2.138 20 0 BEADRP CC1(C)CCCC[C@H]1[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873251391 590008087 /nfs/dbraw/zinc/00/80/87/590008087.db2.gz LYOLKQQXXASAJO-GRYCIOLGSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@@H](C2CC2)C2CCCC2)C1 ZINC000873250903 590008290 /nfs/dbraw/zinc/00/82/90/590008290.db2.gz RLGOABNWDPSFQW-DDTOSNHZSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@H]2C[C@@H]([NH3+])C2)C[C@@H]1C ZINC000873251667 590008495 /nfs/dbraw/zinc/00/84/95/590008495.db2.gz MXFCUJQKBXLGHR-FHUSYTEZSA-N 2 0 210.365 2.138 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@@H](c2cccnc2)C2CCC2)C1 ZINC000873252112 590008893 /nfs/dbraw/zinc/00/88/93/590008893.db2.gz ZXPOIDONMASEPN-BYCMXARLSA-N 2 0 245.370 2.250 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccccc1N(C)C ZINC000873252653 590008932 /nfs/dbraw/zinc/00/89/32/590008932.db2.gz USRGGKCXSHGGGY-RWMBFGLXSA-N 2 0 247.386 2.141 20 0 BEADRP C[C@@H]1Cc2ccccc2[C@@H]1[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873252831 590009075 /nfs/dbraw/zinc/00/90/75/590009075.db2.gz WEYSDJGPSPHSIF-UQFNBPPOSA-N 2 0 230.355 2.247 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1cccnc1Cl ZINC000873254321 590009371 /nfs/dbraw/zinc/00/93/71/590009371.db2.gz QOAAWZNZOZGLSL-BBBLOLIVSA-N 2 0 239.750 2.123 20 0 BEADRP Cc1ccccc1C[C@H](C)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873253723 590009669 /nfs/dbraw/zinc/00/96/69/590009669.db2.gz DARVMKJOKLXBOU-KCQAQPDRSA-N 2 0 232.371 2.253 20 0 BEADRP C[C@@H](CSC(C)(C)C)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873254002 590009718 /nfs/dbraw/zinc/00/97/18/590009718.db2.gz IWMWHQQSMSXVNC-GARJFASQSA-N 2 0 230.421 2.234 20 0 BEADRP COc1cccc2c1CC[C@@H]2[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873254447 590010009 /nfs/dbraw/zinc/01/00/09/590010009.db2.gz UCAFWGMEKWCMCT-WDMOLILDSA-N 2 0 246.354 2.009 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@@H]2CCCc3ccccc32)C1 ZINC000873254765 590010182 /nfs/dbraw/zinc/01/01/82/590010182.db2.gz BXJMVPBJXVUYHV-OSAQELSMSA-N 2 0 230.355 2.391 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1ccc2c(c1)COC2 ZINC000873255439 590010925 /nfs/dbraw/zinc/01/09/25/590010925.db2.gz GTXBIRLQFOKZSQ-UEKVPHQBSA-N 2 0 246.354 2.105 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+][C@@H]2CCCc3ccc(O)cc32)C1 ZINC000873256139 590011054 /nfs/dbraw/zinc/01/10/54/590011054.db2.gz KNHGRVWBMYWYBA-IXPVHAAZSA-N 2 0 246.354 2.097 20 0 BEADRP Cc1ccc([C@H](C)[NH2+]C[C@H]2C[C@H]([NH3+])C2)c(C)n1 ZINC000873255430 590011079 /nfs/dbraw/zinc/01/10/79/590011079.db2.gz GNBORFZZXCRNON-DRZSPHRISA-N 2 0 233.359 2.086 20 0 BEADRP Cc1cc([C@@H](C)[NH2+]C[C@H]2C[C@H]([NH3+])C2)c(C)o1 ZINC000873256738 590011417 /nfs/dbraw/zinc/01/14/17/590011417.db2.gz PVNFQOKHZGCGMP-YUSALJHKSA-N 2 0 222.332 2.284 20 0 BEADRP Cc1cc([C@H](C)[NH2+]C[C@H]2C[C@H]([NH3+])C2)c(C)o1 ZINC000873256737 590011483 /nfs/dbraw/zinc/01/14/83/590011483.db2.gz PVNFQOKHZGCGMP-DLOVCJGASA-N 2 0 222.332 2.284 20 0 BEADRP Cc1nc([C@H](C)[NH2+]C[C@H]2C[C@H]([NH3+])C2)c(C)s1 ZINC000873256734 590011770 /nfs/dbraw/zinc/01/17/70/590011770.db2.gz PTITZRARSJAUQI-SWPVVBRQSA-N 2 0 239.388 2.148 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C[C@H]2C[C@H]([NH3+])C2)C[C@@H]1C ZINC000873256474 590011819 /nfs/dbraw/zinc/01/18/19/590011819.db2.gz MXFCUJQKBXLGHR-NZEXEKPDSA-N 2 0 210.365 2.138 20 0 BEADRP CC[C@H]1CCC[C@@H]([NH2+]C[C@H]2C[C@H]([NH3+])C2)C1 ZINC000873256708 590011832 /nfs/dbraw/zinc/01/18/32/590011832.db2.gz PDOFKFPQWFHYQJ-ZDEQEGDKSA-N 2 0 210.365 2.282 20 0 BEADRP Cc1ccc2c(c1)CC[C@@H]2[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873257201 590011851 /nfs/dbraw/zinc/01/18/51/590011851.db2.gz FRWXMRMVQJOLMK-WHOFXGATSA-N 2 0 230.355 2.309 20 0 BEADRP C[C@H]1Cc2ccccc2[C@H]1[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873257968 590012299 /nfs/dbraw/zinc/01/22/99/590012299.db2.gz WEYSDJGPSPHSIF-UHXUCMFUSA-N 2 0 230.355 2.247 20 0 BEADRP Cc1ccccc1[C@@H](C)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873257830 590012331 /nfs/dbraw/zinc/01/23/31/590012331.db2.gz XTLWVVMBXRNGEJ-UPJWGTAASA-N 2 0 218.344 2.383 20 0 BEADRP C[C@H](CCc1ccccc1)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873258456 590012821 /nfs/dbraw/zinc/01/28/21/590012821.db2.gz QLNDHQJVCXOXDM-BPLDGKMQSA-N 2 0 232.371 2.335 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C[C@H]2C[C@H]([NH3+])C2)[C@@H](C)C1 ZINC000873258485 590012864 /nfs/dbraw/zinc/01/28/64/590012864.db2.gz RNQUMRGMMYZKEM-NZEXEKPDSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1ccc(F)c(F)c1 ZINC000873258953 590013131 /nfs/dbraw/zinc/01/31/31/590013131.db2.gz WRIKPUUEEVVQLJ-FXPVBKGRSA-N 2 0 240.297 2.353 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+][C@@H](c2cccnc2)C2CCC2)C1 ZINC000873259141 590013297 /nfs/dbraw/zinc/01/32/97/590013297.db2.gz ZXPOIDONMASEPN-KCPJHIHWSA-N 2 0 245.370 2.250 20 0 BEADRP Cc1ccsc1[C@H](C)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873259170 590013628 /nfs/dbraw/zinc/01/36/28/590013628.db2.gz YNPUKRBPBGDTCQ-DCAQKATOSA-N 2 0 224.373 2.444 20 0 BEADRP CC(C)[C@H]1CC[C@@H]1[NH2+][C@@H](C)C1CC[NH2+]CC1 ZINC000873271527 590015968 /nfs/dbraw/zinc/01/59/68/590015968.db2.gz IZBGYNPVXJIYDI-YUTCNCBUSA-N 2 0 224.392 2.399 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+][C@@H](C)C1CC[NH2+]CC1 ZINC000873271525 590016048 /nfs/dbraw/zinc/01/60/48/590016048.db2.gz IZBGYNPVXJIYDI-UBHSHLNASA-N 2 0 224.392 2.399 20 0 BEADRP CC[C@H]1CC[C@@H]1[NH2+][C@@H](C)C1CC[NH2+]CC1 ZINC000873272244 590016121 /nfs/dbraw/zinc/01/61/21/590016121.db2.gz QUMXYHLBELIVNK-GVXVVHGQSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)[C@H]1C[C@H]1C ZINC000873273167 590016941 /nfs/dbraw/zinc/01/69/41/590016941.db2.gz YRHGFCWHUWIQHL-XWUBHJNHSA-N 2 0 224.392 2.399 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+][C@@H](C)C1CC[NH2+]CC1 ZINC000873272934 590016948 /nfs/dbraw/zinc/01/69/48/590016948.db2.gz XLZUEKXRFBHTIC-STQMWFEESA-N 2 0 247.386 2.429 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@@H]1C[C@@H]2CCC[C@H]2O1 ZINC000873282170 590018491 /nfs/dbraw/zinc/01/84/91/590018491.db2.gz QZDDNVDCFHOEOK-ZOBORPQBSA-N 2 0 240.391 2.051 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+]Cc1cccc2ncccc12 ZINC000873283880 590019245 /nfs/dbraw/zinc/01/92/45/590019245.db2.gz LOVMACHSGMZTLO-DZGCQCFKSA-N 2 0 241.338 2.204 20 0 BEADRP CC[C@@H](C)C[NH2+]CCC[NH+](CC)CC ZINC000020090542 590073334 /nfs/dbraw/zinc/07/33/34/590073334.db2.gz DSIRHQQSEVXZKQ-GFCCVEGCSA-N 2 0 200.370 2.354 20 0 BEADRP CC[C@@H](C)[C@@H](C)[NH2+]CCC[NH+]1CCCC1 ZINC000020129209 590077038 /nfs/dbraw/zinc/07/70/38/590077038.db2.gz FZLSSQOESNOILK-CHWSQXEVSA-N 2 0 212.381 2.497 20 0 BEADRP C[NH+](C)C[C@@H]1CC[N@H+](CC2(C)CCCC2)C1 ZINC000876730078 590234388 /nfs/dbraw/zinc/23/43/88/590234388.db2.gz BOPUEPUHDYXIAQ-ZDUSSCGKSA-N 2 0 224.392 2.450 20 0 BEADRP CC[C@H](C)[C@H](C[NH2+]C[C@@H]1CCCN1CC)OC ZINC000876882027 590253054 /nfs/dbraw/zinc/25/30/54/590253054.db2.gz XPVXHUXSDOATPF-IHRRRGAJSA-N 2 0 242.407 2.121 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]CC2(C)CCCC2)C1 ZINC000877617210 590375213 /nfs/dbraw/zinc/37/52/13/590375213.db2.gz MVADCLCZRWDTKZ-BETUJISGSA-N 2 0 224.392 2.497 20 0 BEADRP C=C/C=C\CC[NH+]1CC[C@@H](C[N@@H+](C)CC)C1 ZINC000878167685 590514194 /nfs/dbraw/zinc/51/41/94/590514194.db2.gz XTAQYJGBDQPQLC-AFNCTOJWSA-N 2 0 222.376 2.392 20 0 BEADRP C=C/C=C\CC[NH+]1CC[C@@]2(CC[N@@H+](C)C2)C1 ZINC000878645266 590600666 /nfs/dbraw/zinc/60/06/66/590600666.db2.gz JEYUVGNBJYNHJE-ZRUQZJFASA-N 2 0 220.360 2.146 20 0 BEADRP CSC[C@H](C)[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000127337327 590623787 /nfs/dbraw/zinc/62/37/87/590623787.db2.gz ZEOFZEXEBFIPGS-QNWHQSFQSA-N 2 0 242.432 2.248 20 0 BEADRP CC[NH+](CC)CCC[N@@H+]1C[C@H](OC)CC[C@H]1C ZINC000879326840 590748087 /nfs/dbraw/zinc/74/80/87/590748087.db2.gz TZABLFFIELICBA-ZIAGYGMSSA-N 2 0 242.407 2.218 20 0 BEADRP CC[C@H](C)[N@@H+]1CCN(c2cc[nH+]cc2)[C@@H](C)C1 ZINC000880258907 590978607 /nfs/dbraw/zinc/97/86/07/590978607.db2.gz DTDKOFKGIJKAIV-STQMWFEESA-N 2 0 233.359 2.391 20 0 BEADRP CSCCC[NH+]1CCC(C)([NH+]2CCC2)CC1 ZINC000880473119 591054543 /nfs/dbraw/zinc/05/45/43/591054543.db2.gz PTZSKESVAHZPDF-UHFFFAOYSA-N 2 0 242.432 2.300 20 0 BEADRP C[N@H+](CCF)CCCC[NH+]1CCCCC1 ZINC000880517356 591083853 /nfs/dbraw/zinc/08/38/53/591083853.db2.gz OGICZECCJFRZLG-UHFFFAOYSA-N 2 0 216.344 2.154 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H](C)C1)C1CC[NH+](C)CC1 ZINC000128511936 591099335 /nfs/dbraw/zinc/09/93/35/591099335.db2.gz PMYPMQXMFGVOAF-MBNYWOFBSA-N 2 0 224.392 2.495 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+]C[C@@H]2C=CCC2)CC1(C)C ZINC000883236704 591582338 /nfs/dbraw/zinc/58/23/38/591582338.db2.gz IWGMXYIJANPITI-CHWSQXEVSA-N 2 0 222.376 2.415 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C[C@@H]2C=CCC2)[C@H]2CCC[C@H]21 ZINC000883245584 591586304 /nfs/dbraw/zinc/58/63/04/591586304.db2.gz NYJLBENQQMZIOY-APIJFGDWSA-N 2 0 234.387 2.415 20 0 BEADRP CN1CCC([NH2+]CC2(CC3CC3)CC2)CC1 ZINC000883249337 591589980 /nfs/dbraw/zinc/58/99/80/591589980.db2.gz CRNRJQOKNQFYNQ-UHFFFAOYSA-N 2 0 222.376 2.251 20 0 BEADRP [NH3+]C[C@H]1CCC[N@H+](CC[C@H]2CCCC2(F)F)C1 ZINC000883416017 591652691 /nfs/dbraw/zinc/65/26/91/591652691.db2.gz JWNBXQTZFQLHBA-VXGBXAGGSA-N 2 0 246.345 2.483 20 0 BEADRP CC(C)(C)[C@@H](CN)[NH2+]C[C@H]1CCCC(C)(C)O1 ZINC000883430428 591652771 /nfs/dbraw/zinc/65/27/71/591652771.db2.gz VEVRHXQGZUIWJW-VXGBXAGGSA-N 2 0 242.407 2.297 20 0 BEADRP [NH3+]C1(C[NH2+]CC[C@H]2CCCC2(F)F)CCC1 ZINC000883425398 591652853 /nfs/dbraw/zinc/65/28/53/591652853.db2.gz SSRPSNNJBDQCJE-SNVBAGLBSA-N 2 0 232.318 2.283 20 0 BEADRP [NH3+]C1(C[NH2+]CC[C@@H]2CCCC2(F)F)CCC1 ZINC000883425397 591653062 /nfs/dbraw/zinc/65/30/62/591653062.db2.gz SSRPSNNJBDQCJE-JTQLQIEISA-N 2 0 232.318 2.283 20 0 BEADRP C[C@@H]1C[N@H+](CC[C@H]2CCCC2(F)F)CC[C@@H]1[NH3+] ZINC000883417809 591654001 /nfs/dbraw/zinc/65/40/01/591654001.db2.gz NSFKDSANWZQVLX-UTUOFQBUSA-N 2 0 246.345 2.481 20 0 BEADRP C[C@H]([NH3+])[C@H]1CC[N@H+](CC[C@H]2CCCC2(F)F)C1 ZINC000883424100 591658969 /nfs/dbraw/zinc/65/89/69/591658969.db2.gz GBEXPGHCUCBGQQ-SDDRHHMPSA-N 2 0 246.345 2.481 20 0 BEADRP C=C/C=C\CC[N@@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1 ZINC000883429359 591660935 /nfs/dbraw/zinc/66/09/35/591660935.db2.gz SOXWCNWDZCMVTE-CGXNLCPXSA-N 2 0 234.387 2.440 20 0 BEADRP CC1(C)CCC[C@H](C[NH2+][C@@H]2CCCC[C@H]2[NH3+])O1 ZINC000883434599 591664113 /nfs/dbraw/zinc/66/41/13/591664113.db2.gz WNJHFIHXTBHZCH-JHJVBQTASA-N 2 0 240.391 2.194 20 0 BEADRP c1ccc2c(c1)CC[C@@H]([NH2+]C[C@H]1CCC[NH2+]C1)C2 ZINC000132241970 591695750 /nfs/dbraw/zinc/69/57/50/591695750.db2.gz KUATWQTZEKAICM-XJKSGUPXSA-N 2 0 244.382 2.133 20 0 BEADRP C[N@@H+]1CC[C@]2(CC[NH+](CC[C@@H]3C[C@H]3C3CC3)C2)C1 ZINC000886215558 592178675 /nfs/dbraw/zinc/17/86/75/592178675.db2.gz MQFQFQQYWYGVJX-PMPSAXMXSA-N 2 0 248.414 2.450 20 0 BEADRP CC1([NH+]2CCCC2)CCC([NH2+]CCF)CC1 ZINC000886604826 592272031 /nfs/dbraw/zinc/27/20/31/592272031.db2.gz DEBAXPHSJITABQ-UHFFFAOYSA-N 2 0 228.355 2.343 20 0 BEADRP CC[C@@H](C)C[N@@H+]1CCCC[C@]2(CC[NH2+]C2)C1 ZINC000886870198 592374844 /nfs/dbraw/zinc/37/48/44/592374844.db2.gz SFDLIPNFKVVMJK-ZIAGYGMSSA-N 2 0 224.392 2.498 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCCC[C@]2(CC[NH2+]C2)C1 ZINC000886870197 592375603 /nfs/dbraw/zinc/37/56/03/592375603.db2.gz SFDLIPNFKVVMJK-UONOGXRCSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H]1C[C@H]1C[N@@H+]1CCCC[C@]2(CC[NH2+]C2)C1 ZINC000886873925 592376684 /nfs/dbraw/zinc/37/66/84/592376684.db2.gz BOFYTCMINVOAHK-HZSPNIEDSA-N 2 0 222.376 2.108 20 0 BEADRP C[C@@H]1CN(c2cc[nH+]cc2)CC[N@@H+]1CC1CC1 ZINC000887132916 592448513 /nfs/dbraw/zinc/44/85/13/592448513.db2.gz QAVYXJWFYXUYSB-GFCCVEGCSA-N 2 0 231.343 2.002 20 0 BEADRP C[C@H]1CN(c2cc[nH+]cc2)CC[N@@H+]1CC1CCC1 ZINC000887132841 592449788 /nfs/dbraw/zinc/44/97/88/592449788.db2.gz OKITZONQYXIDDT-ZDUSSCGKSA-N 2 0 245.370 2.392 20 0 BEADRP CCCC[N@@H+]1CCN(c2cc[nH+]cc2)C[C@@H]1C ZINC000887130848 592449856 /nfs/dbraw/zinc/44/98/56/592449856.db2.gz LRPCIFLAXJDBNT-ZDUSSCGKSA-N 2 0 233.359 2.392 20 0 BEADRP C[NH+](C/C=C\C[N@H+](C)CCCF)CCCF ZINC000887141270 592457039 /nfs/dbraw/zinc/45/70/39/592457039.db2.gz MDQFDCZVZFFTBH-ARJAWSKDSA-N 2 0 234.334 2.125 20 0 BEADRP C[C@@H]([NH2+][C@H]1C[C@@H]([NH3+])C12CCC2)C(C)(C)C ZINC000925703449 634382448 /nfs/dbraw/zinc/38/24/48/634382448.db2.gz VDHWAOURLYALMO-MXWKQRLJSA-N 2 0 210.365 2.281 20 0 BEADRP Cc1noc(C)c1[C@@H](C)[NH2+]CC1=CC[N@H+](C)CC1 ZINC000925707324 634394083 /nfs/dbraw/zinc/39/40/83/634394083.db2.gz PEEQTFKTQFMLER-SNVBAGLBSA-N 2 0 249.358 2.204 20 0 BEADRP C[C@@]1(CC[NH2+][C@H]2CC[NH2+]C2(C)C)CC1(F)F ZINC000925707416 634396965 /nfs/dbraw/zinc/39/69/65/634396965.db2.gz IZCAMZMGEAOPFL-GXSJLCMTSA-N 2 0 232.318 2.152 20 0 BEADRP C[C@@]1(CC[NH2+][C@H]2CC[NH2+]C2(C)C)C[C@@]1(F)Cl ZINC000925713831 634416463 /nfs/dbraw/zinc/41/64/63/634416463.db2.gz UVEPWLSMKXWNPQ-WCQGTBRESA-N 2 0 248.773 2.421 20 0 BEADRP C1[C@H]2CC[C@@H]([NH2+][C@H]3CC[NH2+]C34CCC4)C[C@@H]12 ZINC000925713489 634417706 /nfs/dbraw/zinc/41/77/06/634417706.db2.gz UDGLUPLZZVQYMY-LPWJVIDDSA-N 2 0 220.360 2.049 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+]CC1CCC(F)CC1 ZINC000925713006 634417929 /nfs/dbraw/zinc/41/79/29/634417929.db2.gz RIYXKRFSGFCCNJ-MCIGGMRASA-N 2 0 228.355 2.245 20 0 BEADRP C1=C[C@H](CCC[NH2+][C@H]2[C@@H]3[NH2+]C[C@@H]4C[C@H]2C[C@@H]43)CC1 ZINC000925730800 634560068 /nfs/dbraw/zinc/56/00/68/634560068.db2.gz QBYDEKCFBNKQNS-OSLXHZNNSA-N 2 0 246.398 2.319 20 0 BEADRP CC[C@](C)(O)C[NH2+][C@@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000093516699 634560163 /nfs/dbraw/zinc/56/01/63/634560163.db2.gz OGXKOFLCXXDOJV-IHRRRGAJSA-N 2 0 242.407 2.048 20 0 BEADRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]CC1(CC2CC2)CC1 ZINC000925732456 634573779 /nfs/dbraw/zinc/57/37/79/634573779.db2.gz BEGUKURZNOSUFY-CHWSQXEVSA-N 2 0 222.376 2.284 20 0 BEADRP CC[C@H]([NH2+]C[C@H]1C=CCC1)[C@@H]1CCCC[NH2+]1 ZINC000925733159 634576021 /nfs/dbraw/zinc/57/60/21/634576021.db2.gz SXHHWQUMKHYJOP-IHRRRGAJSA-N 2 0 222.376 2.463 20 0 BEADRP CC(C)(C[NH2+][C@@H]1CC[NH2+]C1(C)C)CC(F)F ZINC000925734255 634583905 /nfs/dbraw/zinc/58/39/05/634583905.db2.gz PKEZTTDYDCTLIR-SECBINFHSA-N 2 0 234.334 2.398 20 0 BEADRP CCC[C@H](C)CC[NH2+][C@@H]1CCOC[C@H]1[C@@H](C)[NH3+] ZINC000925735001 634586647 /nfs/dbraw/zinc/58/66/47/634586647.db2.gz XAUXIRMOSBBRDF-RFQIPJPRSA-N 2 0 242.407 2.155 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+][C@@H]1CCC[C@@H]1CCF ZINC000925802032 635349454 /nfs/dbraw/zinc/34/94/54/635349454.db2.gz CSBOJYVVRFBUGR-AAVRWANBSA-N 2 0 242.382 2.350 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[C@H]1[C@@H]1C[C@H]1C)[C@H]1CCC[NH2+]C1 ZINC000925824389 635412255 /nfs/dbraw/zinc/41/22/55/635412255.db2.gz SIUPASGFAXNWGQ-IKKURHKOSA-N 2 0 222.376 2.009 20 0 BEADRP CC(C)C[C@H](O)C[NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000226076521 635421152 /nfs/dbraw/zinc/42/11/52/635421152.db2.gz PDQFXLZQKGGREX-GLQYFDAESA-N 2 0 248.370 2.128 20 0 BEADRP CCc1cnc(C[NH2+]CCCCCC[NH3+])s1 ZINC000234145766 635549537 /nfs/dbraw/zinc/54/95/37/635549537.db2.gz DLBJEDUIGTVUNG-UHFFFAOYSA-N 2 0 241.404 2.314 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@H]2CCC[NH2+]CC2)CCS1 ZINC000925861457 635556138 /nfs/dbraw/zinc/55/61/38/635556138.db2.gz PWERUKIRXDZCEE-WOPDTQHZSA-N 2 0 228.405 2.002 20 0 BEADRP COC[C@H](C[NH2+][C@@H](C)[C@@H]1CCCC[NH2+]1)C(C)C ZINC000925874406 635596423 /nfs/dbraw/zinc/59/64/23/635596423.db2.gz RKCNJGZZEZPBHY-IHRRRGAJSA-N 2 0 242.407 2.025 20 0 BEADRP C[C@@H]([NH2+]C[C@]12C[C@H]1CCC2)[C@@H]1CCC[NH2+]C1 ZINC000925881436 635610435 /nfs/dbraw/zinc/61/04/35/635610435.db2.gz RQDLEIWEQCCWAG-SYQHCUMBSA-N 2 0 222.376 2.154 20 0 BEADRP CC(C)C[NH+](CC(C)C)C[C@@H]1C[NH2+]C[C@H]1C ZINC000082560580 631407380 /nfs/dbraw/zinc/40/73/80/631407380.db2.gz UDIQWIKTXCAFRH-KGLIPLIRSA-N 2 0 226.408 2.456 20 0 BEADRP C[C@H]1C[NH+](CC2CC[NH+](C)CC2)C[C@H](C)S1 ZINC000891822056 631505564 /nfs/dbraw/zinc/50/55/64/631505564.db2.gz KZLMZSQMPRRMSC-RYUDHWBXSA-N 2 0 242.432 2.154 20 0 BEADRP C1=CC[C@@H]2C[N@@H+](CCC3CC[NH2+]CC3)C[C@@H]2C1 ZINC000310352919 635665781 /nfs/dbraw/zinc/66/57/81/635665781.db2.gz RBZHJQQGBWEIGS-GASCZTMLSA-N 2 0 234.387 2.274 20 0 BEADRP C[C@@H](C[N@@H+]1CCC[C@@H](C[NH3+])C1)C(C)(C)C ZINC000308839015 631678044 /nfs/dbraw/zinc/67/80/44/631678044.db2.gz XUZNTULKTWUHMB-RYUDHWBXSA-N 2 0 212.381 2.339 20 0 BEADRP CCCCCC[N@@H+]1CC[C@]2(CC[NH2+]C2)C1 ZINC000308890425 631714986 /nfs/dbraw/zinc/71/49/86/631714986.db2.gz XWVIZZMDRKBCKP-ZDUSSCGKSA-N 2 0 210.365 2.252 20 0 BEADRP Cc1ccc(CN(C)C[C@@H](C)[NH3+])cc1Cl ZINC000309031507 631806450 /nfs/dbraw/zinc/80/64/50/631806450.db2.gz BWNMARQEEPUDOO-SNVBAGLBSA-N 2 0 226.751 2.427 20 0 BEADRP Cc1cc(F)ccc1C[NH2+]C1CCC([NH3+])CC1 ZINC000051694481 631869769 /nfs/dbraw/zinc/86/97/69/631869769.db2.gz FNGPHHQUWIYVQP-UHFFFAOYSA-N 2 0 236.334 2.494 20 0 BEADRP CC[C@H]1CCC[N@@H+]1CC[C@@H]1CCC[NH2+]C1 ZINC000051919087 632012119 /nfs/dbraw/zinc/01/21/19/632012119.db2.gz XXHXHORAPOSYLZ-STQMWFEESA-N 2 0 210.365 2.251 20 0 BEADRP C[N@@H+](Cc1ccc(F)cc1)C[C@@H]1CC[C@H]([NH3+])C1 ZINC000091544810 632069842 /nfs/dbraw/zinc/06/98/42/632069842.db2.gz GNQYQQCCTPUMAT-OCCSQVGLSA-N 2 0 236.334 2.385 20 0 BEADRP C[C@@H](C[NH2+]C1[C@H](C)CC[C@H]1C)N(C)C1CC1 ZINC000924968501 635815759 /nfs/dbraw/zinc/81/57/59/635815759.db2.gz ZJNIZLLXBTVSJW-UTUOFQBUSA-N 2 0 224.392 2.493 20 0 BEADRP C[C@H](c1ccccn1)[N@@H+]1CCC[C@H]([C@H](C)[NH3+])C1 ZINC000251227930 632545444 /nfs/dbraw/zinc/54/54/44/632545444.db2.gz AKGQDDMJMODQML-XQQFMLRXSA-N 2 0 233.359 2.202 20 0 BEADRP CCC[C@H](C)[N@H+](C)C[C@@]1(C)CCC[NH2+]C1 ZINC000219755500 632565102 /nfs/dbraw/zinc/56/51/02/632565102.db2.gz LUXODJLMFNOTAY-STQMWFEESA-N 2 0 212.381 2.497 20 0 BEADRP CS[C@@H]1CCC[C@H]([NH2+][C@@H]2CCC[NH2+]CC2)C1 ZINC000235234199 632565345 /nfs/dbraw/zinc/56/53/45/632565345.db2.gz AFMCSOSOKCQECM-FRRDWIJNSA-N 2 0 242.432 2.392 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)C1(Cl)CC1 ZINC000926573781 632571484 /nfs/dbraw/zinc/57/14/84/632571484.db2.gz QBVPQSPIFUDYCR-VXGBXAGGSA-N 2 0 244.810 2.468 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH+]1[C@H](C)CCC[C@H]1C ZINC000235264907 632592198 /nfs/dbraw/zinc/59/21/98/632592198.db2.gz QEQLTEPAJONUCC-LPWJVIDDSA-N 2 0 210.365 2.105 20 0 BEADRP CC1(C)CCC[C@@H]1[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000086873403 632652574 /nfs/dbraw/zinc/65/25/74/632652574.db2.gz BWYNURIUZDFMIQ-TUAOUCFPSA-N 2 0 210.365 2.425 20 0 BEADRP CC(C)([NH3+])CC[NH2+][C@H]1CCc2ccccc2C1 ZINC000310285162 632718933 /nfs/dbraw/zinc/71/89/33/632718933.db2.gz IQEYCYSGZSLTPR-AWEZNQCLSA-N 2 0 232.371 2.261 20 0 BEADRP C[C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C[NH3+] ZINC000095917470 632726397 /nfs/dbraw/zinc/72/63/97/632726397.db2.gz FKMJKEQHUVZBJG-TZMCWYRMSA-N 2 0 218.344 2.103 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C2CCCCCC2)CC[NH2+]1 ZINC000235451393 632743111 /nfs/dbraw/zinc/74/31/11/632743111.db2.gz NYPFZJFPGKJMLM-DGCLKSJQSA-N 2 0 210.365 2.439 20 0 BEADRP C[C@]1(C[N@H+]2C[C@@H]3CCCC[C@@H]3C2)CCC[NH2+]C1 ZINC000310555055 632756570 /nfs/dbraw/zinc/75/65/70/632756570.db2.gz HUZBXPHKSZYJRG-ZNMIVQPWSA-N 2 0 236.403 2.498 20 0 BEADRP C[C@H]1C[C@H](C[N@@H+]2C[C@@H]3CCC[C@@H]3C2)CC[NH2+]1 ZINC000235697381 632816754 /nfs/dbraw/zinc/81/67/54/632816754.db2.gz VLRLSDLJSDDBBN-RFQIPJPRSA-N 2 0 222.376 2.106 20 0 BEADRP [NH3+]C1CCC([NH2+]Cc2cccc3c2NCC3)CC1 ZINC000163342147 633053153 /nfs/dbraw/zinc/05/31/53/633053153.db2.gz WXTOBXACOFHERH-UHFFFAOYSA-N 2 0 245.370 2.014 20 0 BEADRP C[N@@H+]1CC[C@@H]2CN(CC3CC(F)(F)C3)CC[C@H]21 ZINC000879578446 635866940 /nfs/dbraw/zinc/86/69/40/635866940.db2.gz FECSQPDFZCCFPC-VXGBXAGGSA-N 2 0 244.329 2.058 20 0 BEADRP CC(C)C[C@H]1CC[N@H+](C[C@@H]2C[NH2+]C[C@H]2C)C1 ZINC000307826090 633123676 /nfs/dbraw/zinc/12/36/76/633123676.db2.gz YTGGONKADYDMPQ-MCIONIFRSA-N 2 0 224.392 2.210 20 0 BEADRP CC1(C)C[N@H+](CCCCCC[NH3+])CCCO1 ZINC000309609357 633211275 /nfs/dbraw/zinc/21/12/75/633211275.db2.gz ZNLWAFMPLGGFDO-UHFFFAOYSA-N 2 0 228.380 2.006 20 0 BEADRP COCc1cccc(C[NH2+]CCC(C)(C)[NH3+])c1 ZINC000310179335 636005584 /nfs/dbraw/zinc/00/55/84/636005584.db2.gz WMMASMXKWHSKBT-UHFFFAOYSA-N 2 0 236.359 2.050 20 0 BEADRP C[C@H](CC[NH2+]C1CC(CF)(CF)C1)[NH+](C)C ZINC000895292240 636131470 /nfs/dbraw/zinc/13/14/70/636131470.db2.gz NVJDFJMHTBPHJT-SNVBAGLBSA-N 2 0 234.334 2.004 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@H]1[NH2+]CCCn1ccnc1 ZINC000309781259 633735925 /nfs/dbraw/zinc/73/59/25/633735925.db2.gz MYDJLUSQLHXPPY-ITGUQSILSA-N 2 0 221.348 2.297 20 0 BEADRP C(CC1CCCC1)[NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2 ZINC000328457872 633766305 /nfs/dbraw/zinc/76/63/05/633766305.db2.gz SGORSYOZBOVLFE-LXFSFDBISA-N 2 0 234.387 2.153 20 0 BEADRP C[C@@H]([NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23)C1CCCC1 ZINC000328549084 633773402 /nfs/dbraw/zinc/77/34/02/633773402.db2.gz QSSOWMZTGZBOHQ-KJCZUFAUSA-N 2 0 234.387 2.151 20 0 BEADRP C[C@@H]([NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2)C1CCCC1 ZINC000328549081 633774118 /nfs/dbraw/zinc/77/41/18/633774118.db2.gz QSSOWMZTGZBOHQ-BBAYZTIDSA-N 2 0 234.387 2.151 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@H]2[C@@H]3[NH2+]C[C@H]4C[C@H]2C[C@H]34)C[C@H]1C ZINC000328558579 633775737 /nfs/dbraw/zinc/77/57/37/633775737.db2.gz CSLWPJKATYPEHG-VSPOPZGASA-N 2 0 248.414 2.397 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+][C@H]1CCc2ccccc2C1 ZINC000925509924 633848932 /nfs/dbraw/zinc/84/89/32/633848932.db2.gz PYKKDBGWGQBQHD-GJZGRUSLSA-N 2 0 244.382 2.274 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+][C@H]1CCc2ccccc2C1 ZINC000925509926 633849162 /nfs/dbraw/zinc/84/91/62/633849162.db2.gz PYKKDBGWGQBQHD-LSDHHAIUSA-N 2 0 244.382 2.274 20 0 BEADRP CS[C@@H]1CC[C@@H]([NH2+][C@@H]2CC[NH2+]C2(C)C)C1 ZINC000925523672 633896514 /nfs/dbraw/zinc/89/65/14/633896514.db2.gz NKYHCQJTJBZKJJ-GMTAPVOTSA-N 2 0 228.405 2.001 20 0 BEADRP C[C@@H](C1CC1)[N@@H+]1CC[C@]2(C1)CCC[NH+](C)C2 ZINC000930575994 633905732 /nfs/dbraw/zinc/90/57/32/633905732.db2.gz AVXSLDMLKSYHIE-GXTWGEPZSA-N 2 0 222.376 2.203 20 0 BEADRP C[NH+]1CCC(C[NH+]2CC(Cc3ccco3)C2)CC1 ZINC000895599640 636164456 /nfs/dbraw/zinc/16/44/56/636164456.db2.gz SBVCNBZMSXFHQY-UHFFFAOYSA-N 2 0 248.370 2.096 20 0 BEADRP CS[C@H](C)C[NH2+][C@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925588609 634100629 /nfs/dbraw/zinc/10/06/29/634100629.db2.gz YHJRDOBRVCXPLM-MXWKQRLJSA-N 2 0 230.421 2.234 20 0 BEADRP C[N@H+]1C[C@H]2CC[C@@H](C1)C2[NH2+]CC1(C2CC2)CC1 ZINC000925613492 634154226 /nfs/dbraw/zinc/15/42/26/634154226.db2.gz RTWYTWOUKRSKAR-ONXXMXGDSA-N 2 0 234.387 2.106 20 0 BEADRP CC1(C)C[C@H]([NH3+])C[C@@H]([NH2+]C[C@H]2CCC=CO2)C1 ZINC000925642355 634192278 /nfs/dbraw/zinc/19/22/78/634192278.db2.gz GGFVHXQURZHRPJ-JHJVBQTASA-N 2 0 238.375 2.175 20 0 BEADRP CC[C@H]([NH2+][C@@H]1C[C@H]([NH3+])CC(C)(C)C1)C(C)(C)O ZINC000925674445 634259613 /nfs/dbraw/zinc/25/96/13/634259613.db2.gz JPZGAKPTHGUNHU-TUAOUCFPSA-N 2 0 242.407 2.032 20 0 BEADRP C[C@H](F)CC[NH2+][C@@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925676594 634265822 /nfs/dbraw/zinc/26/58/22/634265822.db2.gz KLNUTJLJMNTAFJ-GARJFASQSA-N 2 0 216.344 2.230 20 0 BEADRP CC/C=C\C[NH2+][C@@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925682144 634285752 /nfs/dbraw/zinc/28/57/52/634285752.db2.gz UDDHKBIFAICJPP-ABZJQCSKSA-N 2 0 210.365 2.448 20 0 BEADRP CC(C)C[C@@H]1C[C@H]1[NH2+][C@@H]1C[C@H]([NH3+])C12CCC2 ZINC000925696902 634358262 /nfs/dbraw/zinc/35/82/62/634358262.db2.gz VMAUUECTXDWPDB-FVCCEPFGSA-N 2 0 222.376 2.281 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2C[C@H]([NH3+])CC(C)(C)C2)CS1 ZINC000925697067 634361170 /nfs/dbraw/zinc/36/11/70/634361170.db2.gz MJXVSZGAXTYEFO-RHYQMDGZSA-N 2 0 242.432 2.376 20 0 BEADRP c1ccc2c(c1)OCC[C@@H]2[NH2+]CC1CC[NH2+]CC1 ZINC000094009987 635161680 /nfs/dbraw/zinc/16/16/80/635161680.db2.gz XAIDCJPUJZVLOE-AWEZNQCLSA-N 2 0 246.354 2.099 20 0 BEADRP C1CC2(C1)[NH2+]CC[C@H]2[NH2+][C@@H]1C[C@@H]2CCCC[C@H]12 ZINC000925764977 635170043 /nfs/dbraw/zinc/17/00/43/635170043.db2.gz LDESUPJCBZRINP-IGQOVBAYSA-N 2 0 234.387 2.439 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]C[C@H]1CCC2(CCC2)CO1 ZINC000925774212 635230620 /nfs/dbraw/zinc/23/06/20/635230620.db2.gz LJFQVAFXSXAIQH-RWMBFGLXSA-N 2 0 240.391 2.051 20 0 BEADRP FC1(F)CC[NH2+]C[C@@H]1C[NH2+][C@@H]1CCC12CCC2 ZINC000925775570 635246531 /nfs/dbraw/zinc/24/65/31/635246531.db2.gz HMUOKLZRYQMWGN-GHMZBOCLSA-N 2 0 244.329 2.154 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+]C[C@@H]1C[NH2+]CCC1(F)F ZINC000925777545 635259442 /nfs/dbraw/zinc/25/94/42/635259442.db2.gz POCKWJKBWBBGSV-OUAUKWLOSA-N 2 0 232.318 2.009 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+]CC[C@@H]1C[C@H]1C1CC1 ZINC000925802740 635350465 /nfs/dbraw/zinc/35/04/65/635350465.db2.gz QMMDQUGHGQGTQR-ATGSNQNLSA-N 2 0 236.403 2.400 20 0 BEADRP COC[C@@H](C[NH2+][C@@H](C)[C@@H]1CCCC[NH2+]1)C(C)C ZINC000925874429 635596081 /nfs/dbraw/zinc/59/60/81/635596081.db2.gz RKCNJGZZEZPBHY-MJBXVCDLSA-N 2 0 242.407 2.025 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@H](CC[NH3+])C2)cc1C ZINC000125534651 636024145 /nfs/dbraw/zinc/02/41/45/636024145.db2.gz MPGIDDMOXZUUOS-AWEZNQCLSA-N 2 0 232.371 2.474 20 0 BEADRP CC(C)[NH+](CCC[NH2+][C@@H]1COC[C@@H]1C)C(C)C ZINC000925197114 636376747 /nfs/dbraw/zinc/37/67/47/636376747.db2.gz QBOTWPZFSQEDEK-UONOGXRCSA-N 2 0 242.407 2.120 20 0 BEADRP CC(C)C1CC[NH+](C[C@H]2CCC[NH2+]C2)CC1 ZINC000226438968 636473479 /nfs/dbraw/zinc/47/34/79/636473479.db2.gz UAYCEHYBEIMXMZ-ZDUSSCGKSA-N 2 0 224.392 2.354 20 0 BEADRP CN(CC[NH3+])Cc1ccc2ccccc2c1 ZINC000054416860 636635601 /nfs/dbraw/zinc/63/56/01/636635601.db2.gz NFFSJWRXCKQWIF-UHFFFAOYSA-N 2 0 214.312 2.230 20 0 BEADRP CC1(C)CCC[N@H+](CC[C@H]2CC[NH2+]C2)CC1 ZINC000084386224 636875948 /nfs/dbraw/zinc/87/59/48/636875948.db2.gz XDHGCTPBSKFALH-CYBMUJFWSA-N 2 0 224.392 2.498 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)cc1 ZINC000086402137 636887355 /nfs/dbraw/zinc/88/73/55/636887355.db2.gz YESDVVAXAQIFGE-ZIAGYGMSSA-N 2 0 218.344 2.355 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@@H]([NH3+])C1)c1ccccn1 ZINC000088169755 636896767 /nfs/dbraw/zinc/89/67/67/636896767.db2.gz LGKOQUBDLUAPSB-TUAOUCFPSA-N 2 0 219.332 2.002 20 0 BEADRP C1=C[C@@H]2CC[C@H]1C[C@H]2[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000924650065 636974570 /nfs/dbraw/zinc/97/45/70/636974570.db2.gz POUNTDNKBLZQFX-DSJMHWKBSA-N 2 0 246.398 2.415 20 0 BEADRP CC[C@H](CSC)[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000902367218 637294161 /nfs/dbraw/zinc/29/41/61/637294161.db2.gz AQKXHOGJRJJBAA-VXGBXAGGSA-N 2 0 244.448 2.496 20 0 BEADRP CO[C@H]1CCC[C@@H]1[NH2+]CCCC[N@H+](C)C1CC1 ZINC000903182503 637352212 /nfs/dbraw/zinc/35/22/12/637352212.db2.gz CGVNWPIEHWFXFC-KBPBESRZSA-N 2 0 240.391 2.018 20 0 BEADRP CC1(C)CCC[C@H](C[NH2+]CC2([NH3+])CC2)C1 ZINC000904448558 637414219 /nfs/dbraw/zinc/41/42/19/637414219.db2.gz BEPZFKLVZDLJEJ-NSHDSACASA-N 2 0 210.365 2.284 20 0 BEADRP C[N@@H+]1CCCC[C@@H]1CCON=C(N)C1CCC1 ZINC000906507440 638179804 /nfs/dbraw/zinc/17/98/04/638179804.db2.gz CMJICRULQCPMQM-GFCCVEGCSA-N 2 0 239.363 2.159 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]Cc2cccc(C3CC3)c2)C1 ZINC000906517069 638188517 /nfs/dbraw/zinc/18/85/17/638188517.db2.gz DKKPXFSKWIJEEZ-HDJSIYSDSA-N 2 0 216.328 2.143 20 0 BEADRP CC(C)(C[NH2+][C@H]1C[C@H]([NH3+])C1)c1ccccc1 ZINC000906518305 638188611 /nfs/dbraw/zinc/18/86/11/638188611.db2.gz VOYXNYFXWHDYLH-JOCQHMNTSA-N 2 0 218.344 2.044 20 0 BEADRP CC1CC(C[N@@H+]2CC[C@]3(CC[NH+](C)C3)C2)C1 ZINC000930554449 639810298 /nfs/dbraw/zinc/81/02/98/639810298.db2.gz GZNAWOMTVWJPIV-RUXDESIVSA-N 2 0 222.376 2.060 20 0 BEADRP CC1CC(C[N@@H+]2CC[C@]3(C2)CCC[NH+](C)C3)C1 ZINC000930576024 639813153 /nfs/dbraw/zinc/81/31/53/639813153.db2.gz GZHCHLOLNFKVBK-YMAMQOFZSA-N 2 0 236.403 2.450 20 0 BEADRP C[C@H](c1cccc(F)c1)N1C[C@H]2[C@@H](C1)[C@@H]2[NH+](C)C ZINC000931280272 640133695 /nfs/dbraw/zinc/13/36/95/640133695.db2.gz VOJSIFCYQYUSBL-RABLLNBGSA-N 2 0 248.345 2.379 20 0 BEADRP C[NH+](C)C1(C)CC[NH+](CCCCF)CC1 ZINC000931352529 640158152 /nfs/dbraw/zinc/15/81/52/640158152.db2.gz NTSSZOIEYJMSBB-UHFFFAOYSA-N 2 0 216.344 2.152 20 0 BEADRP C[NH+](C)C1(C)CC[NH+](C[C@@H]2C[C@H]3C[C@H]3C2)CC1 ZINC000931354101 640168357 /nfs/dbraw/zinc/16/83/57/640168357.db2.gz JRJNGDFGRYQZRO-BTTYYORXSA-N 2 0 236.403 2.449 20 0 BEADRP C[C@H](C1CC1)[NH+]1CCC(C)([NH+](C)C)CC1 ZINC000931355015 640168401 /nfs/dbraw/zinc/16/84/01/640168401.db2.gz NXQUKTRGANMKIK-LLVKDONJSA-N 2 0 210.365 2.201 20 0 BEADRP Cc1cccc(C[NH+]2C[C@H]3CC[N@@H+](C)C[C@H]3C2)c1 ZINC000931428893 640196470 /nfs/dbraw/zinc/19/64/70/640196470.db2.gz BBDATAJRZVOKPO-CVEARBPZSA-N 2 0 244.382 2.379 20 0 BEADRP C[N@@H+]1CC[C@@H]2C[NH+](Cc3cccc(F)c3)C[C@@H]2C1 ZINC000931428674 640197476 /nfs/dbraw/zinc/19/74/76/640197476.db2.gz YQHGTZQSDNLKJE-KGLIPLIRSA-N 2 0 248.345 2.209 20 0 BEADRP C[N@@H+]1CC[C@@H]2C[NH+](CCc3ccccc3)C[C@@H]2C1 ZINC000931431404 640198777 /nfs/dbraw/zinc/19/87/77/640198777.db2.gz MPOCFUOUOITYON-CVEARBPZSA-N 2 0 244.382 2.113 20 0 BEADRP CC(C)SCC[N@@H+]1C[C@@H]2CC[NH+](C)C[C@@H]2C1 ZINC000931437204 640201871 /nfs/dbraw/zinc/20/18/71/640201871.db2.gz NGRNNSCHFWWQGM-QWHCGFSZSA-N 2 0 242.432 2.012 20 0 BEADRP CC(C)=CCC[NH+]1C[C@H]2CC[N@@H+](C)C[C@H]2C1 ZINC000931441901 640204959 /nfs/dbraw/zinc/20/49/59/640204959.db2.gz QGHJYAXRPSGMRE-KGLIPLIRSA-N 2 0 222.376 2.226 20 0 BEADRP C[N@@H+]1CC[C@@H]2C[NH+](CC3CC4(CCC4)C3)C[C@@H]2C1 ZINC000931442325 640208695 /nfs/dbraw/zinc/20/86/95/640208695.db2.gz CCXGDAWMBTXALF-CABCVRRESA-N 2 0 248.414 2.450 20 0 BEADRP CC[C@H](C[C@@](C)(O)CC)[NH2+][C@H](C)CC[NH+](C)C ZINC000924855142 640325696 /nfs/dbraw/zinc/32/56/96/640325696.db2.gz VNGIOBLONKAOJO-MCIONIFRSA-N 2 0 244.423 2.246 20 0 BEADRP CN1CC[C@@H]2CC[C@H](C1)[N@@H+]2CC1CC=CC1 ZINC000931718051 640337029 /nfs/dbraw/zinc/33/70/29/640337029.db2.gz IIEFEOQRJIWPMO-UONOGXRCSA-N 2 0 220.360 2.121 20 0 BEADRP C[C@@H](C1CC1)[N@@H+]1CCN(c2cc[nH+]cc2)C[C@H]1C ZINC000931764334 640356766 /nfs/dbraw/zinc/35/67/66/640356766.db2.gz PTIKMRHNJDXJOM-OLZOCXBDSA-N 2 0 245.370 2.391 20 0 BEADRP C[C@@H](C[NH2+]C1CCSCC1)C[NH+]1CCCC1 ZINC000057994430 640659506 /nfs/dbraw/zinc/65/95/06/640659506.db2.gz BXDDLXYFJXXKSU-LBPRGKRZSA-N 2 0 242.432 2.204 20 0 BEADRP C[C@H]1C[NH+](CCC2C[C@H]3CC[C@@H](C2)[NH2+]3)C[C@@H]1C ZINC000225245991 640677742 /nfs/dbraw/zinc/67/77/42/640677742.db2.gz UTROKQBBOIBDKS-UUQIVFDPSA-N 2 0 236.403 2.495 20 0 BEADRP [NH3+]C1CC([NH2+][C@H]2CCC[C@@H](C(F)(F)F)C2)C1 ZINC000087651573 640957238 /nfs/dbraw/zinc/95/72/38/640957238.db2.gz UXARPYILYBLTDX-RJQCTPFPSA-N 2 0 236.281 2.187 20 0 BEADRP C[C@H](C[NH2+][C@H](C)C1CC1)C[NH+]1CCCC1 ZINC000062077354 641017827 /nfs/dbraw/zinc/01/78/27/641017827.db2.gz IADIBYAEKCXQIV-VXGBXAGGSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]1CC[C@@H](C[NH2+]C2CCC([NH3+])CC2)C1 ZINC000230412525 641053085 /nfs/dbraw/zinc/05/30/85/641053085.db2.gz MWLCJROPNXIADJ-ZFDZMSFRSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H](Cc1cccnc1)[NH2+]CC[C@@H]1CCC[N@@H+]1C ZINC000934233018 641109697 /nfs/dbraw/zinc/10/96/97/641109697.db2.gz HNJYTATYGRGVSK-HIFRSBDPSA-N 2 0 247.386 2.087 20 0 BEADRP Cl/C=C/C[NH+]1CCC([C@H]2CCC[NH2+]2)CC1 ZINC000063200092 641146440 /nfs/dbraw/zinc/14/64/40/641146440.db2.gz IFEJWLIIBVHAGW-RDNKVPPGSA-N 2 0 228.767 2.203 20 0 BEADRP C[C@@H]1CC=CC[C@H]1[NH2+]CC[C@H]1CCC[N@@H+]1C ZINC000934621000 641218106 /nfs/dbraw/zinc/21/81/06/641218106.db2.gz OHEBBIPKJBGJQK-MGPQQGTHSA-N 2 0 222.376 2.415 20 0 BEADRP C[C@@H](CC1CCC1)[NH2+]CC[C@@H]1C[NH2+]C[C@H]1C ZINC000722560636 711498712 /nfs/dbraw/zinc/49/87/12/711498712.db2.gz HVTRVGCIBROFNR-MBNYWOFBSA-N 2 0 224.392 2.400 20 0 BEADRP CC(C)C1CC([NH2+]C2CCC([NH3+])CC2)C1 ZINC000232536268 641296744 /nfs/dbraw/zinc/29/67/44/641296744.db2.gz NBMIIQDAOGONGK-UHFFFAOYSA-N 2 0 210.365 2.281 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@H+](C)CCCCCC[NH3+] ZINC000723102355 711502353 /nfs/dbraw/zinc/50/23/53/711502353.db2.gz LGKKNHRIULYFKQ-OLZOCXBDSA-N 2 0 212.381 2.483 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+]C1C[C@H](C)C[C@@H](C)C1 ZINC000723827560 711503790 /nfs/dbraw/zinc/50/37/90/711503790.db2.gz CBLCGJXLNHPHSF-LPWJVIDDSA-N 2 0 224.392 2.256 20 0 BEADRP CC[C@@H]1CO[C@@H](C)C[N@@H+]1CCCCCC[NH3+] ZINC000042452029 641551377 /nfs/dbraw/zinc/55/13/77/641551377.db2.gz VJAPJVZTJPQNLF-QWHCGFSZSA-N 2 0 228.380 2.005 20 0 BEADRP CN(C)[C@@H](C[NH2+]CCc1ccccc1)C1CC1 ZINC000916838595 641980640 /nfs/dbraw/zinc/98/06/40/641980640.db2.gz XBKMBGYMOFNBTN-HNNXBMFYSA-N 2 0 232.371 2.159 20 0 BEADRP CCC1CC[NH+](C[C@H]2CC[NH2+][C@H](C)C2)CC1 ZINC000232899111 642216155 /nfs/dbraw/zinc/21/61/55/642216155.db2.gz QZZQNDADZFUXJA-OCCSQVGLSA-N 2 0 224.392 2.497 20 0 BEADRP CCC1CCC([NH2+]C[C@@H]2CCC[NH2+]2)CC1 ZINC000232909892 642286203 /nfs/dbraw/zinc/28/62/03/642286203.db2.gz BUKJEQKIEYRUKN-BPCQOVAHSA-N 2 0 210.365 2.297 20 0 BEADRP CCC1CCC([NH2+]C[C@H]2CCC[NH2+]2)CC1 ZINC000232910895 642286947 /nfs/dbraw/zinc/28/69/47/642286947.db2.gz BUKJEQKIEYRUKN-WXRRBKDZSA-N 2 0 210.365 2.297 20 0 BEADRP CC1(C[NH2+]C[C@]2(C)CCC[NH2+]C2)CCC1 ZINC000232915192 642301546 /nfs/dbraw/zinc/30/15/46/642301546.db2.gz BPJKYWHHAFEPOH-CYBMUJFWSA-N 2 0 210.365 2.156 20 0 BEADRP C(C[NH2+]C1CC1)C[NH+](CC1CC1)CC1CC1 ZINC000070064173 642416299 /nfs/dbraw/zinc/41/62/99/642416299.db2.gz LZZWEFYUPNVNQZ-UHFFFAOYSA-N 2 0 222.376 2.251 20 0 BEADRP CC[C@H](C)C[NH2+]C[C@H]1CCC[N@H+](CC)C1 ZINC000093066494 642455535 /nfs/dbraw/zinc/45/55/35/642455535.db2.gz KBXRDTDIEWVEPK-QWHCGFSZSA-N 2 0 212.381 2.354 20 0 BEADRP CCC1([NH2+]C[C@H]2CC[NH2+][C@@H](C)C2)CCC1 ZINC000233054358 642649263 /nfs/dbraw/zinc/64/92/63/642649263.db2.gz FZGICLPRCLWPMV-RYUDHWBXSA-N 2 0 210.365 2.297 20 0 BEADRP CCO[C@H]1C[C@H]([NH2+]CC([NH3+])(CC)CC)C1(C)C ZINC000233758867 642691887 /nfs/dbraw/zinc/69/18/87/642691887.db2.gz KRWKKMIULPQXPY-RYUDHWBXSA-N 2 0 242.407 2.297 20 0 BEADRP CC[C@@H]1CCC[C@H]([NH2+]C[C@@H]2CCC[NH2+]2)C1 ZINC000233917042 642706946 /nfs/dbraw/zinc/70/69/46/642706946.db2.gz LAIOAKFFYIYTPX-AGIUHOORSA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@@H]1CCC[N@H+](C[C@@H]2C[NH2+]C[C@H]2C)CC1 ZINC000233922408 642708683 /nfs/dbraw/zinc/70/86/83/642708683.db2.gz TZDNPELXSUSSRQ-MCIONIFRSA-N 2 0 224.392 2.354 20 0 BEADRP [NH3+]CCc1ccc(C[NH2+]Cc2ccccc2)cc1 ZINC000070542668 643032351 /nfs/dbraw/zinc/03/23/51/643032351.db2.gz BAARPEKWAGQVGZ-UHFFFAOYSA-N 2 0 240.350 2.478 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1ncc[nH]1 ZINC000049714544 643219964 /nfs/dbraw/zinc/21/99/64/643219964.db2.gz MTMLPZAROAEYDS-LBPRGKRZSA-N 2 0 238.379 2.010 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@@H+]1CCC2(C1)CCCCC2 ZINC000306071934 643288575 /nfs/dbraw/zinc/28/85/75/643288575.db2.gz WXGHWIAKFIILKH-KGLIPLIRSA-N 2 0 236.403 2.498 20 0 BEADRP C[NH2+]CC1CC[NH+](CCc2cccs2)CC1 ZINC000082602422 643354162 /nfs/dbraw/zinc/35/41/62/643354162.db2.gz FRZOQFAHVNCQJK-UHFFFAOYSA-N 2 0 238.400 2.222 20 0 BEADRP CC[C@H]1CC[C@@H](C)[N@@H+]1C[C@@H]1C[NH2+]C[C@H]1C ZINC000234051202 643358137 /nfs/dbraw/zinc/35/81/37/643358137.db2.gz ZQPDWNWZPNJULC-NDBYEHHHSA-N 2 0 210.365 2.105 20 0 BEADRP CCc1ccc(C[NH2+][C@@H]2CCC[C@H]2C[NH3+])cc1 ZINC000234144769 643519494 /nfs/dbraw/zinc/51/94/94/643519494.db2.gz YNCBUWBCNGHUSR-LSDHHAIUSA-N 2 0 232.371 2.466 20 0 BEADRP CCCC[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC000083846977 643544156 /nfs/dbraw/zinc/54/41/56/643544156.db2.gz TXYHQSYULVNWHS-YHWZYXNKSA-N 2 0 210.365 2.391 20 0 BEADRP C[C@@H]1CC[C@H](C)[N@H+](CCC[NH2+]C2CC2)C1 ZINC000084046558 643643352 /nfs/dbraw/zinc/64/33/52/643643352.db2.gz MXNKIBCQPHNFAG-NEPJUHHUSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCCC[C@@H]1C[NH3+] ZINC000084216793 643649899 /nfs/dbraw/zinc/64/98/99/643649899.db2.gz XNDMLUZBOMACPW-FVCCEPFGSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]CCC(F)(F)F ZINC000084216770 643649908 /nfs/dbraw/zinc/64/99/08/643649908.db2.gz ZXORTTFZPRVETQ-DTWKUNHWSA-N 2 0 224.270 2.046 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+][C@H]1CC=CCC1 ZINC000084217157 643649958 /nfs/dbraw/zinc/64/99/58/643649958.db2.gz RBKJUNLGYOPURY-RWMBFGLXSA-N 2 0 208.349 2.202 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]CCC(F)(F)F ZINC000084216767 643650209 /nfs/dbraw/zinc/65/02/09/643650209.db2.gz ZXORTTFZPRVETQ-IUCAKERBSA-N 2 0 224.270 2.046 20 0 BEADRP Cl/C=C\C[N@@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000846220065 643651308 /nfs/dbraw/zinc/65/13/08/643651308.db2.gz ABCIQJUHVCROQD-NAFLWYGVSA-N 2 0 242.794 2.451 20 0 BEADRP Cc1cc(C)c(C[N@@H+]2CC[C@@H](C[NH3+])C2)c(C)c1 ZINC000050245256 643661531 /nfs/dbraw/zinc/66/15/31/643661531.db2.gz ZLLSVMOMWMXVQC-AWEZNQCLSA-N 2 0 232.371 2.392 20 0 BEADRP C[C@@H]1CCC[N@H+](C[C@@H]2CC[C@H]([NH3+])C2)CC1 ZINC000085015935 643679066 /nfs/dbraw/zinc/67/90/66/643679066.db2.gz FZJVRFLNXRELIB-UPJWGTAASA-N 2 0 210.365 2.236 20 0 BEADRP CC1(C)CCC[N@H+](C[C@@H]2CC[C@H]([NH3+])C2)C1 ZINC000085016064 643680397 /nfs/dbraw/zinc/68/03/97/643680397.db2.gz PCZXLESGFBRRKZ-NEPJUHHUSA-N 2 0 210.365 2.236 20 0 BEADRP CC[C@@H](C)C[N@H+](CC)C[C@@H]1CC[C@H]([NH3+])C1 ZINC000086440174 644137449 /nfs/dbraw/zinc/13/74/49/644137449.db2.gz LPZOZHPUVBIUSX-UPJWGTAASA-N 2 0 212.381 2.482 20 0 BEADRP C([NH2+]C1CCCCC1)[C@H]1CCCCC[NH2+]1 ZINC000081003210 644302439 /nfs/dbraw/zinc/30/24/39/644302439.db2.gz XETVQFNBPHODBU-CYBMUJFWSA-N 2 0 210.365 2.441 20 0 BEADRP CCCCCC[C@H](O)C[N@H+](C)C1CC[NH2+]CC1 ZINC000923280368 644313411 /nfs/dbraw/zinc/31/34/11/644313411.db2.gz XXYSSBZAICTRBA-AWEZNQCLSA-N 2 0 242.407 2.002 20 0 BEADRP C[C@@]1(C[NH3+])CC[N@H+](CCc2cccc(F)c2)C1 ZINC000923355023 644371797 /nfs/dbraw/zinc/37/17/97/644371797.db2.gz DUQQDSRXFZCPNO-AWEZNQCLSA-N 2 0 236.334 2.039 20 0 BEADRP C[C@]12C[NH2+]C[C@H]1C[N@H+](CC1CCC3(CC3)CC1)C2 ZINC000923423310 644418410 /nfs/dbraw/zinc/41/84/10/644418410.db2.gz ANEAATKWYHOXTL-LSDHHAIUSA-N 2 0 248.414 2.498 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+]C1CCCCC1 ZINC000084215368 644419596 /nfs/dbraw/zinc/41/95/96/644419596.db2.gz UZWDNUCEGSYSIH-YPMHNXCESA-N 2 0 210.365 2.426 20 0 BEADRP Cc1ccccc1C[NH2+][C@@H]1CCC[C@H]1C[NH3+] ZINC000084219931 644420636 /nfs/dbraw/zinc/42/06/36/644420636.db2.gz BMHLNQXEHZJINE-GXTWGEPZSA-N 2 0 218.344 2.212 20 0 BEADRP CC[C@@H]1CCC[N@H+](CC[C@@H]2CC[NH2+]C2)C1 ZINC000084384846 644423362 /nfs/dbraw/zinc/42/33/62/644423362.db2.gz LSRKSKBSNXYOBT-OLZOCXBDSA-N 2 0 210.365 2.108 20 0 BEADRP CC(C)[C@H]1CCC[N@@H+]1C[C@@H]1CC[C@H]([NH3+])C1 ZINC000085016297 644434567 /nfs/dbraw/zinc/43/45/67/644434567.db2.gz MMDWAOAFCKDENK-FRRDWIJNSA-N 2 0 210.365 2.234 20 0 BEADRP [NH3+]CC[C@H]1CC[N@H+](CC[C@@H]2CCCC2(F)F)C1 ZINC000923480691 644459473 /nfs/dbraw/zinc/45/94/73/644459473.db2.gz ZLRFWHRQACVXHC-RYUDHWBXSA-N 2 0 246.345 2.483 20 0 BEADRP C[C@H](c1ccccn1)[N@@H+]1CC[C@H](C[NH3+])[C@H](C)C1 ZINC000923495972 644461421 /nfs/dbraw/zinc/46/14/21/644461421.db2.gz FMHPLDUQRAEAKO-JHJVBQTASA-N 2 0 233.359 2.059 20 0 BEADRP C[C@@H]1C[N@H+](CCC2CCC2)CC[C@H]1C[NH3+] ZINC000923488015 644463607 /nfs/dbraw/zinc/46/36/07/644463607.db2.gz CTMFUAXHURKRJK-YPMHNXCESA-N 2 0 210.365 2.093 20 0 BEADRP C[C@@H]1C[N@H+](CCCC(C)(F)F)CC[C@@H]1C[NH3+] ZINC000923490512 644465905 /nfs/dbraw/zinc/46/59/05/644465905.db2.gz DFJJVZFHTRINEH-GHMZBOCLSA-N 2 0 234.334 2.339 20 0 BEADRP C[C@H]1C[N@H+](CC=C(Cl)Cl)CC[C@@H]1C[NH3+] ZINC000923488755 644466002 /nfs/dbraw/zinc/46/60/02/644466002.db2.gz GEDLVMKOTBXFLQ-DTWKUNHWSA-N 2 0 237.174 2.222 20 0 BEADRP C[C@H]1C[N@H+](CCCC2CCC2)CC[C@@H]1C[NH3+] ZINC000923489755 644466432 /nfs/dbraw/zinc/46/64/32/644466432.db2.gz KQXDVSBYSVDLAU-GXTWGEPZSA-N 2 0 224.392 2.483 20 0 BEADRP C[C@H]1C[N@@H+]([C@@H]2C[C@H]2C(C)(C)C)CC[C@H]1C[NH3+] ZINC000923493260 644467768 /nfs/dbraw/zinc/46/77/68/644467768.db2.gz QZUBRFLZITWPMW-WUHRBBMRSA-N 2 0 224.392 2.338 20 0 BEADRP C[C@@H]1C[N@H+](CCc2cccs2)CC[C@@H]1C[NH3+] ZINC000923497852 644473277 /nfs/dbraw/zinc/47/32/77/644473277.db2.gz MTEMXQLBVYMSRT-VXGBXAGGSA-N 2 0 238.400 2.207 20 0 BEADRP C[C@@H](c1cccnc1)[N@@H+]1CC[C@@H](C[NH3+])[C@H](C)C1 ZINC000923501293 644474848 /nfs/dbraw/zinc/47/48/48/644474848.db2.gz PYLHVKMNDQBUGI-AGIUHOORSA-N 2 0 233.359 2.059 20 0 BEADRP CCC[NH+]1CCC([C@H]2CCC[NH2+]CC2)CC1 ZINC000923505919 644475452 /nfs/dbraw/zinc/47/54/52/644475452.db2.gz DKGRNZWYVZPTLV-ZDUSSCGKSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H]1C[N@H+](Cc2ccc(F)cc2)CC[C@@H]1C[NH3+] ZINC000923503678 644478238 /nfs/dbraw/zinc/47/82/38/644478238.db2.gz KTUJCNZISMZDIP-DGCLKSJQSA-N 2 0 236.334 2.242 20 0 BEADRP C[C@H](c1ccc(F)cc1)[N@@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1 ZINC000923517634 644479884 /nfs/dbraw/zinc/47/98/84/644479884.db2.gz GCOQTRXNNOHOSO-KWCYVHTRSA-N 2 0 248.345 2.428 20 0 BEADRP c1ccc([C@@H]2C[C@H]2[N@@H+]2C[C@@H]3CC[NH2+]C[C@@H]3C2)cc1 ZINC000923515609 644480274 /nfs/dbraw/zinc/48/02/74/644480274.db2.gz IJRQFGTUUUPCHL-XUWVNRHRSA-N 2 0 242.366 2.084 20 0 BEADRP C[C@H](c1ccccc1)[N@@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1 ZINC000923519732 644482893 /nfs/dbraw/zinc/48/28/93/644482893.db2.gz HBBZAEJCEGHSDR-VHDGCEQUSA-N 2 0 230.355 2.289 20 0 BEADRP C[C@@H]1CCCC[C@H]1C[N@@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1 ZINC000923518952 644483801 /nfs/dbraw/zinc/48/38/01/644483801.db2.gz HIWPOJOMFQZTPR-CBBWQLFWSA-N 2 0 236.403 2.354 20 0 BEADRP C(C[N@@H+]1C[C@H](C2CC2)C[C@@H]1C1CC1)[C@@H]1CC[NH2+]C1 ZINC000923526932 644484470 /nfs/dbraw/zinc/48/44/70/644484470.db2.gz WECWJRPAJNQXMH-APHBMKBZSA-N 2 0 248.414 2.497 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@@H+]1C[C@H](C2CC2)C[C@@H]1C1CC1 ZINC000923525939 644485215 /nfs/dbraw/zinc/48/52/15/644485215.db2.gz LNHRRKLTLXSFGL-BQDHKBFISA-N 2 0 248.414 2.352 20 0 BEADRP C[NH+](C)CCC[NH2+][C@@H](C1CC1)C(C)(C)C ZINC000324335675 644525497 /nfs/dbraw/zinc/52/54/97/644525497.db2.gz CGRSDIRMBWTAFI-LBPRGKRZSA-N 2 0 212.381 2.352 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccccc1F ZINC000089139622 644536283 /nfs/dbraw/zinc/53/62/83/644536283.db2.gz OUVFNDFJZTTXNJ-FZMZJTMJSA-N 2 0 236.334 2.433 20 0 BEADRP C[C@H](Cc1ccco1)[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000250981187 644788402 /nfs/dbraw/zinc/78/84/02/644788402.db2.gz IXQPFNUDQZJJIQ-MCIONIFRSA-N 2 0 248.370 2.427 20 0 BEADRP CCC[C@H](C)C[N@@H+]1CC[C@H](C[NH3+])[C@@H](C)C1 ZINC000251258883 644799504 /nfs/dbraw/zinc/79/95/04/644799504.db2.gz CNTOGWRHJYPMPP-RWMBFGLXSA-N 2 0 212.381 2.339 20 0 BEADRP C[C@@H]1CC[C@@H](C)[N@H+](CC[C@H]2CCC[NH2+]C2)C1 ZINC000251849012 644827234 /nfs/dbraw/zinc/82/72/34/644827234.db2.gz OURFWNYDKLTFAK-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@H+](C)[C@H]1CCC[C@@H](C)C1 ZINC000251944576 644832644 /nfs/dbraw/zinc/83/26/44/644832644.db2.gz WFQNINHMWRBAKM-MQYQWHSLSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@H]1C[C@H]([NH2+]C[C@H]2CCC[NH2+]C2)C[C@@H](C)C1 ZINC000252183795 644841112 /nfs/dbraw/zinc/84/11/12/644841112.db2.gz TZUOZLUVYYDJNY-RFQIPJPRSA-N 2 0 224.392 2.400 20 0 BEADRP CSCC[C@H](C)[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000252703300 644885750 /nfs/dbraw/zinc/88/57/50/644885750.db2.gz RONSUOKOILJVQF-AVGNSLFASA-N 2 0 242.432 2.344 20 0 BEADRP C(CC1CCC1)[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000252730992 644891869 /nfs/dbraw/zinc/89/18/69/644891869.db2.gz NVQOWWBZIZOMPD-KGLIPLIRSA-N 2 0 222.376 2.393 20 0 BEADRP C[C@H]1CC[N@H+](Cc2ccsc2)C[C@H]1C[NH3+] ZINC000253200967 644944255 /nfs/dbraw/zinc/94/42/55/644944255.db2.gz XKBUNVDUFAERAO-CMPLNLGQSA-N 2 0 224.373 2.165 20 0 BEADRP COc1cccc(C[NH2+]CCCCCC[NH3+])c1 ZINC000843129011 645266724 /nfs/dbraw/zinc/26/67/24/645266724.db2.gz OLSAQUNQGRZAJV-UHFFFAOYSA-N 2 0 236.359 2.304 20 0 BEADRP C([C@@H]1CC[NH2+]C1)[N@@H+]1CCCC2(CCCC2)C1 ZINC000843389199 645287854 /nfs/dbraw/zinc/28/78/54/645287854.db2.gz RTPDJXKGRYLPIP-CYBMUJFWSA-N 2 0 222.376 2.252 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H]2C[C@H]3C=C[C@@H]2CC3)C1 ZINC000926665426 645344232 /nfs/dbraw/zinc/34/42/32/645344232.db2.gz FDOURYDBSDDAAU-VQJWOFKYSA-N 2 0 234.387 2.271 20 0 BEADRP C[C@H]1CC[C@H](C)C1[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000926665537 645345981 /nfs/dbraw/zinc/34/59/81/645345981.db2.gz GTZYLVKGSUUFAH-ZDEQEGDKSA-N 2 0 224.392 2.351 20 0 BEADRP C/C=C\C[NH2+][C@@H]1CCCN2CCCC[C@@H]12 ZINC000926764229 645410479 /nfs/dbraw/zinc/41/04/79/645410479.db2.gz CIPXRLVCRTXPGW-FAQRPARDSA-N 2 0 208.349 2.169 20 0 BEADRP CCC[C@@H](O)CC[NH2+]C1CC[NH+](CCC)CC1 ZINC000927024381 645522800 /nfs/dbraw/zinc/52/28/00/645522800.db2.gz HBSIGWAUEUIVRO-CQSZACIVSA-N 2 0 242.407 2.002 20 0 BEADRP C[NH+](C)CCC[NH2+]C1CC2(C1)CCCC2 ZINC000924540659 646059085 /nfs/dbraw/zinc/05/90/85/646059085.db2.gz XNXDAXZODQWXST-UHFFFAOYSA-N 2 0 210.365 2.251 20 0 BEADRP CC(C)CC[NH+]1CCC([NH2+][C@@H]2C[C@@H]2C)CC1 ZINC000924952579 646139004 /nfs/dbraw/zinc/13/90/04/646139004.db2.gz XJJMTGSLYDGUFP-GXTWGEPZSA-N 2 0 224.392 2.495 20 0 BEADRP C1=C[C@@H]2CC[C@H]1C[C@H]2[NH2+][C@H]1CCN(CC2CC2)C1 ZINC000925009258 646157545 /nfs/dbraw/zinc/15/75/45/646157545.db2.gz BKOWTHHLGUAOSC-DRPJVOAASA-N 2 0 246.398 2.415 20 0 BEADRP C[C@@H]1CCC[C@H](C)[C@H]1[NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23 ZINC000925481346 646294708 /nfs/dbraw/zinc/29/47/08/646294708.db2.gz NLOYVXFJYWUIKU-LZXKGRQDSA-N 2 0 248.414 2.397 20 0 BEADRP CCOCCCC[NH2+][C@@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925482645 646295405 /nfs/dbraw/zinc/29/54/05/646295405.db2.gz WUZFEQSJXFCPPQ-QWHCGFSZSA-N 2 0 242.407 2.299 20 0 BEADRP CC1(C)C[C@@H]([NH3+])C[C@@H]([NH2+]CC2CCC2)C1 ZINC000925487538 646297596 /nfs/dbraw/zinc/29/75/96/646297596.db2.gz WTLCYRRMMOPUAA-NWDGAFQWSA-N 2 0 210.365 2.282 20 0 BEADRP CCC[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000925489106 646299397 /nfs/dbraw/zinc/29/93/97/646299397.db2.gz NJDIWJLSACMEDB-CYBMUJFWSA-N 2 0 206.333 2.466 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1NCCc1ccc(F)cc1 ZINC000925488231 646300348 /nfs/dbraw/zinc/30/03/48/646300348.db2.gz IOKDZOSDAUIWGJ-CYBMUJFWSA-N 2 0 236.334 2.098 20 0 BEADRP CC1(C)C[C@H]([NH3+])C[C@@H]([NH2+]C2CCCC2)C1 ZINC000925495980 646301159 /nfs/dbraw/zinc/30/11/59/646301159.db2.gz RHBYRDSTYUJBPQ-ZYHUDNBSSA-N 2 0 210.365 2.425 20 0 BEADRP CC1(C)C[C@@H]([NH3+])C[C@H]([NH2+]C2CCCC2)C1 ZINC000925495978 646302477 /nfs/dbraw/zinc/30/24/77/646302477.db2.gz RHBYRDSTYUJBPQ-JQWIXIFHSA-N 2 0 210.365 2.425 20 0 BEADRP COC[C@H]([NH2+][C@@H]1C[C@H]([NH3+])CC(C)(C)C1)C(C)C ZINC000925518491 646313617 /nfs/dbraw/zinc/31/36/17/646313617.db2.gz RATWSPIHQCKJMJ-XQQFMLRXSA-N 2 0 242.407 2.153 20 0 BEADRP CCO[C@H](CC[NH2+][C@H]1CC[NH2+]C1(C)C)C(C)C ZINC000925526703 646318178 /nfs/dbraw/zinc/31/81/78/646318178.db2.gz KDKLDZSHVNVRHO-OLZOCXBDSA-N 2 0 242.407 2.168 20 0 BEADRP C([NH2+][C@@H]1CC[NH2+]C[C@H]1C1CCCC1)C1CC1 ZINC000925535040 646321769 /nfs/dbraw/zinc/32/17/69/646321769.db2.gz BBCVLLJUXFRRNN-UONOGXRCSA-N 2 0 222.376 2.154 20 0 BEADRP CC1(C)C[C@@H]([NH3+])C[C@H]([NH2+]CCc2cccnc2)C1 ZINC000925536179 646322788 /nfs/dbraw/zinc/32/27/88/646322788.db2.gz OFFSCAHNDHGDFJ-KBPBESRZSA-N 2 0 247.386 2.120 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+]C[C@]1(C)CCCS1 ZINC000925553743 646331787 /nfs/dbraw/zinc/33/17/87/646331787.db2.gz VHECMVWAZSCCGR-PWSUYJOCSA-N 2 0 228.405 2.002 20 0 BEADRP CC1CC([NH2+][C@H]2[C@@H]3CCC[NH2+][C@@H]3C2(C)C)C1 ZINC000925574333 646342555 /nfs/dbraw/zinc/34/25/55/646342555.db2.gz ANDINMXUFFHFEZ-JCXRDGCHSA-N 2 0 222.376 2.151 20 0 BEADRP CC1(C)C[C@H]1C[NH2+][C@H]1CC[NH2+]C12CCCC2 ZINC000925593532 646349438 /nfs/dbraw/zinc/34/94/38/646349438.db2.gz CKVBUUZIXMRVHF-RYUDHWBXSA-N 2 0 222.376 2.297 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+]CC1Cc2ccccc2C1 ZINC000925602433 646353513 /nfs/dbraw/zinc/35/35/13/646353513.db2.gz SYCIJLWKZDWDTC-OAHLLOKOSA-N 2 0 244.382 2.132 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+]CCCC(F)(F)F ZINC000925606924 646357974 /nfs/dbraw/zinc/35/79/74/646357974.db2.gz ZFOKCOWGVLJLKP-QMMMGPOBSA-N 2 0 224.270 2.059 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C)C1 ZINC000929847669 646358195 /nfs/dbraw/zinc/35/81/95/646358195.db2.gz NAJZWNJBDDSNHV-CBBWQLFWSA-N 2 0 236.403 2.449 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+]C[C@@H]1CC=CCC1 ZINC000925614827 646362308 /nfs/dbraw/zinc/36/23/08/646362308.db2.gz CPTKDIAOOOXRJE-VXGBXAGGSA-N 2 0 208.349 2.073 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+]C[C@@H]1CC=CCC1 ZINC000925617020 646364675 /nfs/dbraw/zinc/36/46/75/646364675.db2.gz PEJJIQBMPLRTPR-DYALKNRASA-N 2 0 234.387 2.448 20 0 BEADRP C1=CC[C@H]([NH2+][C@H]2CC[NH2+]C23CCCC3)CC1 ZINC000925620692 646367008 /nfs/dbraw/zinc/36/70/08/646367008.db2.gz XGZIUCJMFFRFJK-STQMWFEESA-N 2 0 220.360 2.359 20 0 BEADRP C1=CC[C@@H]([NH2+][C@@H]2CC[NH2+]C23CCCC3)CC1 ZINC000925620689 646368184 /nfs/dbraw/zinc/36/81/84/646368184.db2.gz XGZIUCJMFFRFJK-CHWSQXEVSA-N 2 0 220.360 2.359 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+]CC12CCC(CC1)C2 ZINC000925624789 646369070 /nfs/dbraw/zinc/36/90/70/646369070.db2.gz CFDSIPHXWVVGEQ-MBHSVXNSSA-N 2 0 222.376 2.297 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]CC23CCC(CC2)C3)C12CCC2 ZINC000925627050 646373426 /nfs/dbraw/zinc/37/34/26/646373426.db2.gz VVOMWAKXGIMLGH-QPPOZKHWSA-N 2 0 234.387 2.426 20 0 BEADRP FC1(F)CCC([NH2+][C@H]2CC[NH2+]C23CCC3)CC1 ZINC000925629711 646374127 /nfs/dbraw/zinc/37/41/27/646374127.db2.gz NDAFWEKVSAICHH-NSHDSACASA-N 2 0 244.329 2.439 20 0 BEADRP CS[C@@H](C[NH2+][C@H]1CC[NH2+]C1(C)C)C(C)(C)C ZINC000925636140 646380024 /nfs/dbraw/zinc/38/00/24/646380024.db2.gz AETAZGNNYZHTIQ-QWRGUYRKSA-N 2 0 244.448 2.494 20 0 BEADRP CC1(C)C[C@H]([NH3+])C[C@@H]([NH2+][C@H]2CCCOCC2)C1 ZINC000925636480 646380103 /nfs/dbraw/zinc/38/01/03/646380103.db2.gz SRLLOTZNQRNNQP-FRRDWIJNSA-N 2 0 240.391 2.051 20 0 BEADRP CC(C)C(C)(C)C[NH2+][C@@H]1CC[NH2+]C1(C)C ZINC000925644998 646385101 /nfs/dbraw/zinc/38/51/01/646385101.db2.gz NLHHGFBCRPMACJ-LLVKDONJSA-N 2 0 212.381 2.399 20 0 BEADRP CC1(C)C[C@H]([NH3+])C[C@@H]([NH2+]C[C@H]2CCSC2)C1 ZINC000925652873 646391123 /nfs/dbraw/zinc/39/11/23/646391123.db2.gz HWQHPGLTCUWOFW-IJLUTSLNSA-N 2 0 242.432 2.235 20 0 BEADRP CC1(CC[NH2+][C@@H]2CC[NH2+]C23CCC3)CC1 ZINC000925653195 646392480 /nfs/dbraw/zinc/39/24/80/646392480.db2.gz KCWQTJBOXOWZOQ-LLVKDONJSA-N 2 0 208.349 2.051 20 0 BEADRP C[C@@H]1CCC[C@H]1C[NH2+][C@@H]1CC[NH2+]C1(C)C ZINC000925653005 646392708 /nfs/dbraw/zinc/39/27/08/646392708.db2.gz CIPYJVLUKSDKBC-GRYCIOLGSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H](F)CC[NH2+][C@H]1CC[NH2+]C[C@@H]1C1CCCC1 ZINC000925678178 646406624 /nfs/dbraw/zinc/40/66/24/646406624.db2.gz SJWZGBOLSZQDON-YUTCNCBUSA-N 2 0 242.382 2.492 20 0 BEADRP CC(C)C1([NH2+][C@H]2C[C@H]([NH3+])C23CCC3)CC1 ZINC000925677474 646407636 /nfs/dbraw/zinc/40/76/36/646407636.db2.gz QLVNMPHADHMHLD-QWRGUYRKSA-N 2 0 208.349 2.035 20 0 BEADRP Cc1ccncc1C[NH2+][C@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925689368 646415351 /nfs/dbraw/zinc/41/53/51/646415351.db2.gz IESRDSOOINPOQO-KGLIPLIRSA-N 2 0 247.386 2.386 20 0 BEADRP CC(C)[C@@H]1C[C@H]1C[NH2+][C@@H]1C[C@H]([NH3+])C12CCC2 ZINC000925693360 646417769 /nfs/dbraw/zinc/41/77/69/646417769.db2.gz RWXDLXMXCKEAJX-ZDEQEGDKSA-N 2 0 222.376 2.138 20 0 BEADRP CC1(C)C[C@H]([NH3+])C[C@@H]([NH2+][C@@H]2CC23CC3)C1 ZINC000925702444 646426351 /nfs/dbraw/zinc/42/63/51/646426351.db2.gz CZFMMEGWMAWLQF-GMTAPVOTSA-N 2 0 208.349 2.035 20 0 BEADRP C1[C@@H](N[C@@H]2CC[NH2+]C23CCC3)[C@@H]1C1CCC1 ZINC000925704145 646429183 /nfs/dbraw/zinc/42/91/83/646429183.db2.gz IJXOFMZNEYUYCW-YNEHKIRRSA-N 2 0 220.360 2.049 20 0 BEADRP CC1(C)[C@H](C[NH2+][C@@H]2C[C@H]([NH3+])C23CCC3)C1(F)F ZINC000925706542 646430646 /nfs/dbraw/zinc/43/06/46/646430646.db2.gz LLTUUONSHAUPFU-LPEHRKFASA-N 2 0 244.329 2.137 20 0 BEADRP Cc1cc(C[NH2+][C@@H]2C[C@@H]([NH3+])C23CCC3)cc(C)n1 ZINC000925706581 646431279 /nfs/dbraw/zinc/43/12/79/646431279.db2.gz MPQMVWYRPSUXFT-ZIAGYGMSSA-N 2 0 245.370 2.058 20 0 BEADRP C/C=C/C[NH2+][C@@H]1CC[NH2+]C[C@H]1C1CCCC1 ZINC000925720118 646443729 /nfs/dbraw/zinc/44/37/29/646443729.db2.gz WPZIOCUAPOHMQF-AZBIDPCXSA-N 2 0 222.376 2.320 20 0 BEADRP C([NH2+][C@H]1CC[NH2+]C12CCC2)[C@@H]1CCCC12CC2 ZINC000925719851 646444767 /nfs/dbraw/zinc/44/47/67/646444767.db2.gz VCOAQCMNTCYTKY-STQMWFEESA-N 2 0 234.387 2.441 20 0 BEADRP C(C[C@H]1CCCS1)[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000925723418 646448028 /nfs/dbraw/zinc/44/80/28/646448028.db2.gz UYAPHHLOMIXTGB-VXGBXAGGSA-N 2 0 240.416 2.146 20 0 BEADRP CCC[C@H](CN[C@H]1CC[NH2+]C12CCC2)OCC ZINC000925724024 646449942 /nfs/dbraw/zinc/44/99/42/646449942.db2.gz VRNYRNQJEOZAEL-OLZOCXBDSA-N 2 0 240.391 2.066 20 0 BEADRP CCC[C@@H](CN[C@@H]1CC[NH2+]C12CCC2)OCC ZINC000925724025 646450374 /nfs/dbraw/zinc/45/03/74/646450374.db2.gz VRNYRNQJEOZAEL-QWHCGFSZSA-N 2 0 240.391 2.066 20 0 BEADRP CC(C)(F)C[NH2+][C@@H]1CC[NH2+]C[C@@H]1C1CCCC1 ZINC000925725450 646450550 /nfs/dbraw/zinc/45/05/50/646450550.db2.gz UGOFIBOBWFQHJV-CHWSQXEVSA-N 2 0 242.382 2.492 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+]CCC[C@H]1C=CCC1 ZINC000925729653 646453222 /nfs/dbraw/zinc/45/32/22/646453222.db2.gz LGWNGMMLTCFGCN-QWHCGFSZSA-N 2 0 222.376 2.463 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+]CC2(CC3CC3)CC2)C12CCC2 ZINC000925733898 646458752 /nfs/dbraw/zinc/45/87/52/646458752.db2.gz MMXYDFHEUZTNNE-QWHCGFSZSA-N 2 0 234.387 2.426 20 0 BEADRP C[C@H]([NH2+]CC(C)(C)CC(F)F)[C@H]1CCC[NH2+]1 ZINC000925735330 646458881 /nfs/dbraw/zinc/45/88/81/646458881.db2.gz ZDKUGSGLWFJWGB-VHSXEESVSA-N 2 0 234.334 2.398 20 0 BEADRP CC(C)([NH3+])CC[NH2+][C@H]1CCCC12CCOCC2 ZINC000925739174 646462692 /nfs/dbraw/zinc/46/26/92/646462692.db2.gz UPIQIYGJKJRHSM-LBPRGKRZSA-N 2 0 240.391 2.053 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+][C@@H]1C[C@@H]2CCCC[C@H]12 ZINC000925763923 646467147 /nfs/dbraw/zinc/46/71/47/646467147.db2.gz DNZQDWXDGKXYHI-KIJLLGNVSA-N 2 0 208.349 2.035 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@H]1CC2(CCC2)CO1 ZINC000925772504 646470561 /nfs/dbraw/zinc/47/05/61/646470561.db2.gz IINRCFQYYHTZBJ-CHWSQXEVSA-N 2 0 240.391 2.053 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1C[C@H]1[C@H]1C[C@H]1C)[C@H]1CCCC[NH2+]1 ZINC000925771310 646471430 /nfs/dbraw/zinc/47/14/30/646471430.db2.gz ATAGNTRXLCHCLL-MNQBEEPXSA-N 2 0 236.403 2.399 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1C[NH2+]CCC1(F)F)C1CCC1 ZINC000925777412 646475797 /nfs/dbraw/zinc/47/57/97/646475797.db2.gz OWGRCMKUAOQWPT-RYUDHWBXSA-N 2 0 246.345 2.400 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+]C[C@H]1C[NH2+]CCC1(F)F ZINC000925776228 646476067 /nfs/dbraw/zinc/47/60/67/646476067.db2.gz KHYWCJHCTGYORS-GRYCIOLGSA-N 2 0 246.345 2.255 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H]1C[NH2+]CCC1(F)F)C1CCC1 ZINC000925777411 646476208 /nfs/dbraw/zinc/47/62/08/646476208.db2.gz OWGRCMKUAOQWPT-NWDGAFQWSA-N 2 0 246.345 2.400 20 0 BEADRP CC[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1C[NH2+]CCC1(F)F ZINC000925779969 646477203 /nfs/dbraw/zinc/47/72/03/646477203.db2.gz COYHMKRMQAUKKB-GRYCIOLGSA-N 2 0 246.345 2.400 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@@H](C1CC1)C1CCCC1 ZINC000925783477 646478825 /nfs/dbraw/zinc/47/88/25/646478825.db2.gz CMEPNGVIPKALPF-BYCMXARLSA-N 2 0 236.403 2.400 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@@H]1CCCc2occc21 ZINC000925784251 646480743 /nfs/dbraw/zinc/48/07/43/646480743.db2.gz IHWFBGCPMHSXEA-NTZNESFSSA-N 2 0 234.343 2.102 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+]C1[C@H](C)CCC[C@H]1C ZINC000925786108 646482368 /nfs/dbraw/zinc/48/23/68/646482368.db2.gz NYILBJNHHPPZDD-DDHJBXDOSA-N 2 0 210.365 2.009 20 0 BEADRP CCC[C@@H]([NH2+]C[C@@H]1C[NH2+]C[C@H]1C)C1CCC1 ZINC000925787172 646482649 /nfs/dbraw/zinc/48/26/49/646482649.db2.gz WQERTERVKJTKHL-KWCYVHTRSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@@H]1CC[C@H]1C(C)(C)C ZINC000925786352 646483772 /nfs/dbraw/zinc/48/37/72/646483772.db2.gz ROOFYJCLYALUIW-YVECIDJPSA-N 2 0 224.392 2.256 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1C[NH2+]C[C@H]1C)c1cncs1 ZINC000925800177 646486311 /nfs/dbraw/zinc/48/63/11/646486311.db2.gz WHBNTSUBENMXFG-GMTAPVOTSA-N 2 0 239.388 2.039 20 0 BEADRP CC[C@H]1CCC[C@@H]1[NH2+]CC[C@@H]1C[NH2+]C[C@H]1C ZINC000925795667 646486462 /nfs/dbraw/zinc/48/64/62/646486462.db2.gz HSYWLTLTDTYXDH-RQJABVFESA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+][C@@H]1CC[C@H]1C1CC1 ZINC000925802460 646487144 /nfs/dbraw/zinc/48/71/44/646487144.db2.gz HHBZWFGIEOTNQB-RUZUBIRVSA-N 2 0 222.376 2.010 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+][C@@H](C1CC1)C1CCC1 ZINC000925799092 646487482 /nfs/dbraw/zinc/48/74/82/646487482.db2.gz YDEYDYIEWHFRLM-KCPJHIHWSA-N 2 0 236.403 2.400 20 0 BEADRP CC(C)[C@H]1CC[C@H]1[NH2+]CC[C@@H]1C[NH2+]C[C@H]1C ZINC000925803628 646487896 /nfs/dbraw/zinc/48/78/96/646487896.db2.gz SFCWWGYSZRCKNX-AAVRWANBSA-N 2 0 224.392 2.256 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+]CC[C@@H]1CC[C@H]2C[C@H]21 ZINC000925805218 646488329 /nfs/dbraw/zinc/48/83/29/646488329.db2.gz RJSFQAZORRXSBH-CYDGBPFRSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@H]1[C@@H]1C[C@H]1C)[C@@H]1CCCC[NH2+]1 ZINC000925822990 646497182 /nfs/dbraw/zinc/49/71/82/646497182.db2.gz NFUFVRFMIBMXFC-QTJJRWQNSA-N 2 0 222.376 2.151 20 0 BEADRP Cc1cnc(C[NH2+][C@H]2CC[NH2+]CC[C@H]2C)c(C)c1 ZINC000925838563 646506160 /nfs/dbraw/zinc/50/61/60/646506160.db2.gz YUCAYRHKQNGVSM-OCCSQVGLSA-N 2 0 247.386 2.176 20 0 BEADRP C([NH2+][C@@H]1CCC12CCC2)[C@]12CCC[C@H]1[NH2+]CC2 ZINC000925840597 646507117 /nfs/dbraw/zinc/50/71/17/646507117.db2.gz MXDNXUUHWCLMIR-UMVBOHGHSA-N 2 0 234.387 2.441 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+][C@H]1CCSC2(CCC2)C1 ZINC000925860630 646512292 /nfs/dbraw/zinc/51/22/92/646512292.db2.gz IYOFYWDBPRZQAB-TUAOUCFPSA-N 2 0 240.416 2.274 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCSC2(CCC2)C1)C1C[NH2+]C1 ZINC000925862081 646514818 /nfs/dbraw/zinc/51/48/18/646514818.db2.gz XNYDVKRKQSGNPZ-ZYHUDNBSSA-N 2 0 240.416 2.002 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[NH2+]CC2)CCS1 ZINC000925861455 646514986 /nfs/dbraw/zinc/51/49/86/646514986.db2.gz PWERUKIRXDZCEE-IJLUTSLNSA-N 2 0 228.405 2.002 20 0 BEADRP COc1ccc([C@@H](C)[NH2+]C[C@@H]2CC[C@H]([NH3+])C2)cc1 ZINC000925877532 646527150 /nfs/dbraw/zinc/52/71/50/646527150.db2.gz RMNARTZOTQFLLT-BZPMIXESSA-N 2 0 248.370 2.473 20 0 BEADRP C[C@H]1CCCC[C@@H]1[NH2+]C[C@@H]1CC[C@H]([NH3+])C1 ZINC000925876511 646528017 /nfs/dbraw/zinc/52/80/17/646528017.db2.gz ADIJDTGBZBVZIX-RNJOBUHISA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]([NH2+]CC1CCC=CCC1)[C@H]1CC[NH2+]C1 ZINC000925882189 646530730 /nfs/dbraw/zinc/53/07/30/646530730.db2.gz ZAOBKIBRRGIIHT-OCCSQVGLSA-N 2 0 222.376 2.320 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+]C[C@]12C[C@H]1CCC2 ZINC000925882232 646530758 /nfs/dbraw/zinc/53/07/58/646530758.db2.gz ZWOBYHKENVCJPI-MQYQWHSLSA-N 2 0 222.376 2.284 20 0 BEADRP C1=CCCC(C[NH2+][C@@H]2[C@H]3C[C@H]4C[NH2+][C@H]2[C@H]4C3)CC1 ZINC000925880996 646531110 /nfs/dbraw/zinc/53/11/10/646531110.db2.gz PJPMUJOBKYOXRL-GVRJEKJASA-N 2 0 246.398 2.319 20 0 BEADRP CCN1C[C@H]([NH2+][C@H]2C[C@H]3C=C[C@@H]2CC3)[C@@H](C)C1 ZINC000925929241 646544610 /nfs/dbraw/zinc/54/46/10/646544610.db2.gz LGMPFIHNDFYKRX-RMEBNNNOSA-N 2 0 234.387 2.271 20 0 BEADRP C[N@H+]1C[C@H]2CC[C@@H](C1)C2[NH2+][C@@H]1CC12CCCC2 ZINC000926284491 646611753 /nfs/dbraw/zinc/61/17/53/646611753.db2.gz LYKUTIWGPKTACH-RBKKPWLPSA-N 2 0 234.387 2.249 20 0 BEADRP C[C@@H](C[NH2+][C@@H]1C[C@H]2C=C[C@@H]1CC2)C[NH+](C)C ZINC000926474043 646653313 /nfs/dbraw/zinc/65/33/13/646653313.db2.gz NQAKDHNFRMIUOQ-IGQOVBAYSA-N 2 0 222.376 2.128 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@@H](CC[NH3+])C2)s1 ZINC000723711799 711535782 /nfs/dbraw/zinc/53/57/82/711535782.db2.gz JCWLXFRARKVRSB-LLVKDONJSA-N 2 0 224.373 2.227 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]C[C@@H]2C[C@H]2C(F)(F)F)C1 ZINC000925833526 711759851 /nfs/dbraw/zinc/75/98/51/711759851.db2.gz SSMDIYSITHEIIO-QCLAVDOMSA-N 2 0 236.281 2.044 20 0 BEADRP C[N@H+](C[C@H]1CCCC[NH2+]C1)C1CCCC1 ZINC000700256731 711989218 /nfs/dbraw/zinc/98/92/18/711989218.db2.gz JHHDFOUQTFRSII-LBPRGKRZSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@@H](C[N@H+](C)C[C@H]1C[C@@H]([NH3+])C1)C(C)(C)C ZINC000703441031 712075397 /nfs/dbraw/zinc/07/53/97/712075397.db2.gz ZAXINSMIMCYVSX-SDDRHHMPSA-N 2 0 212.381 2.338 20 0 BEADRP C[C@@H]1CC[C@@H](C[N@H+](C)CCCCCC[NH3+])O1 ZINC000710749647 712255609 /nfs/dbraw/zinc/25/56/09/712255609.db2.gz IZTPWNCMKOAYQK-OLZOCXBDSA-N 2 0 228.380 2.005 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@H]1C[C@@H]2CC[C@@H](C2)C1 ZINC000711068525 712277893 /nfs/dbraw/zinc/27/78/93/712277893.db2.gz LQJWDDRAWKMTBX-WDNDVIMCSA-N 2 0 224.392 2.497 20 0 BEADRP FC[C@@H]1CCC[N@H+](CCCC2CC[NH2+]CC2)C1 ZINC000711444741 712300613 /nfs/dbraw/zinc/30/06/13/712300613.db2.gz VCDZQDPCDNWGMF-AWEZNQCLSA-N 2 0 242.382 2.448 20 0 BEADRP C(CC1CC1)C[N@@H+]1CC[NH2+]CCC12CCC2 ZINC000713240758 712456209 /nfs/dbraw/zinc/45/62/09/712456209.db2.gz DKUJPUSEHMOZFE-UHFFFAOYSA-N 2 0 222.376 2.395 20 0 BEADRP C[C@@]1(C[NH3+])CC[N@H+](C[C@@H]2CCCC(C)(C)O2)C1 ZINC000714375219 712484445 /nfs/dbraw/zinc/48/44/45/712484445.db2.gz SEHQGDIAUYSEIS-JSGCOSHPSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@@H]1OCC[C@@H]1[NH2+]C1CCC(C)([NH+](C)C)CC1 ZINC000715513595 712525103 /nfs/dbraw/zinc/52/51/03/712525103.db2.gz RPNNIWJXGSVGIX-AHPWVWPOSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@@H]2C[NH2+]CCC2(F)F)C1 ZINC000717307108 712646181 /nfs/dbraw/zinc/64/61/81/712646181.db2.gz RYFDXWHGAFICJW-VWYCJHECSA-N 2 0 232.318 2.009 20 0 BEADRP CCCC[C@@H](C)[NH2+]C[C@@H]1C[NH2+]CCC1(F)F ZINC000717303987 712645858 /nfs/dbraw/zinc/64/58/58/712645858.db2.gz LJTRTXVYEMPTDA-MNOVXSKESA-N 2 0 234.334 2.400 20 0 BEADRP CC[C@@H]([NH2+]C[C@H]1CC[N@H+](CC)C1)C(C)C ZINC000037484319 712650712 /nfs/dbraw/zinc/65/07/12/712650712.db2.gz VKYVUPSRQKSDCK-CHWSQXEVSA-N 2 0 212.381 2.352 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1CC[N@H+](CC)C1)C(C)C ZINC000037484316 712650741 /nfs/dbraw/zinc/65/07/41/712650741.db2.gz VKYVUPSRQKSDCK-STQMWFEESA-N 2 0 212.381 2.352 20 0 BEADRP CCCCCC[N@@H+]1CC[C@@H]2[NH2+]CC[C@@H]2C1 ZINC000389566977 712689564 /nfs/dbraw/zinc/68/95/64/712689564.db2.gz AINDVNALZLHTGO-OLZOCXBDSA-N 2 0 210.365 2.251 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+]C2CCC=CCC2)C12CCC2 ZINC000718132537 712747120 /nfs/dbraw/zinc/74/71/20/712747120.db2.gz BREHLTWLBPUADO-QWHCGFSZSA-N 2 0 220.360 2.345 20 0 BEADRP CC(F)(F)CCC[NH+]1CCC(CC[NH3+])CC1 ZINC000718577594 712775586 /nfs/dbraw/zinc/77/55/86/712775586.db2.gz FADJGPJVBHLXNC-UHFFFAOYSA-N 2 0 234.334 2.483 20 0 BEADRP COCC(C)(C)CC[NH2+][C@@H](C)CCCC[NH3+] ZINC000718649951 712776779 /nfs/dbraw/zinc/77/67/79/712776779.db2.gz XMVRBXNAFOKNSE-LBPRGKRZSA-N 2 0 230.396 2.156 20 0 BEADRP C[C@@H]([NH3+])C1CC[NH+](CCCC(C)(F)F)CC1 ZINC000718706505 712777928 /nfs/dbraw/zinc/77/79/28/712777928.db2.gz IBKCVWFGCISRNE-SNVBAGLBSA-N 2 0 234.334 2.481 20 0 BEADRP CO[C@@H]1CCC[C@@H]([NH2+]CC[C@H](C)[NH+](C)C)CC1 ZINC000718774408 712782254 /nfs/dbraw/zinc/78/22/54/712782254.db2.gz HUVLAJXYBAHQLK-BFHYXJOUSA-N 2 0 242.407 2.264 20 0 BEADRP CO[C@@H]1CCC[C@H]([NH2+]C[C@H](C)C[NH+](C)C)CC1 ZINC000718845831 712786057 /nfs/dbraw/zinc/78/60/57/712786057.db2.gz XJVJNUBIDHMDND-MELADBBJSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+][C@H]1C[C@H](C)C[C@H](C)C1 ZINC000719375880 712807124 /nfs/dbraw/zinc/80/71/24/712807124.db2.gz ICJJBQHLXTUZHK-RXGFPQBGSA-N 2 0 210.365 2.009 20 0 BEADRP CCCCCCN1CCC[C@H]2[NH2+]CC[C@@H]21 ZINC000720902203 712875988 /nfs/dbraw/zinc/87/59/88/712875988.db2.gz DVRFOCVNVHJZCV-OLZOCXBDSA-N 2 0 210.365 2.393 20 0 BEADRP CCC(CC)C[N@@H+]1CCC[C@H]2[NH2+]CC[C@H]21 ZINC000720905478 712876704 /nfs/dbraw/zinc/87/67/04/712876704.db2.gz YVLJQBCAOGWBMU-CHWSQXEVSA-N 2 0 210.365 2.249 20 0 BEADRP C1=CC[C@@H]2C[N@@H+](CCC[NH2+]C3CC3)C[C@@H]2C1 ZINC000381614858 710661827 /nfs/dbraw/zinc/66/18/27/710661827.db2.gz URVWAQSHSTWCON-BETUJISGSA-N 2 0 220.360 2.027 20 0 BEADRP CCO[C@@H]1CCC[C@@H]([NH2+]CC[C@H](C)[NH+](C)C)C1 ZINC000721238856 712900116 /nfs/dbraw/zinc/90/01/16/712900116.db2.gz LPLHYJAVYKNRPS-BFHYXJOUSA-N 2 0 242.407 2.264 20 0 BEADRP C[C@@]1(C[N@@H+]2CCC3(CCC3)C2)CCC[NH2+]C1 ZINC000380534488 712901226 /nfs/dbraw/zinc/90/12/26/712901226.db2.gz NAWZWCAYTRBMFD-CYBMUJFWSA-N 2 0 222.376 2.252 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1CCC[C@H]([C@H](C)[NH3+])C1 ZINC000723122323 710726411 /nfs/dbraw/zinc/72/64/11/710726411.db2.gz OPFPFUQLTAPWHT-RNJOBUHISA-N 2 0 210.365 2.092 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@H]1CCCC[C@H]1C ZINC000723829985 710733062 /nfs/dbraw/zinc/73/30/62/710733062.db2.gz WOQXKCBLPBWBSS-NDBYEHHHSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@@H]1CCCC[C@@H]1C ZINC000723829986 710733389 /nfs/dbraw/zinc/73/33/89/710733389.db2.gz WOQXKCBLPBWBSS-QNWHQSFQSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]1C[N@H+](Cc2cccc(F)c2)C[C@H]1CC[NH3+] ZINC000723909223 710734657 /nfs/dbraw/zinc/73/46/57/710734657.db2.gz NVOGTBORLXZZSY-DGCLKSJQSA-N 2 0 236.334 2.242 20 0 BEADRP C1CC1[N@H+]1[C@@H]2CC[C@H]1CC([NH2+]C1CCC1)C2 ZINC000903116535 710892693 /nfs/dbraw/zinc/89/26/93/710892693.db2.gz BCZQVRADKOYUFR-QXMXGUDHSA-N 2 0 220.360 2.286 20 0 BEADRP CC[C@H]1C[N@H+](C[C@]2(C)CCC[NH2+]C2)CCS1 ZINC000133049643 710968619 /nfs/dbraw/zinc/96/86/19/710968619.db2.gz AJRWQTOQBFZSTE-QWHCGFSZSA-N 2 0 242.432 2.204 20 0 BEADRP C[C@H](CC(C)(C)C)[NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23 ZINC000384575866 710994393 /nfs/dbraw/zinc/99/43/93/710994393.db2.gz VYLJMQVGKONMCA-QQOHENMQSA-N 2 0 236.403 2.397 20 0 BEADRP CSC(C)(C)CC[NH2+][C@@H](C)Cn1ccnc1 ZINC000385334759 711011225 /nfs/dbraw/zinc/01/12/25/711011225.db2.gz VSLFODQJTNHGEG-NSHDSACASA-N 2 0 241.404 2.393 20 0 BEADRP C1[NH2+][C@H]2[C@H]([NH2+][C@H]3CC4CCC3CC4)[C@H]3C[C@@H]1[C@@H]2C3 ZINC000385593119 711015672 /nfs/dbraw/zinc/01/56/72/711015672.db2.gz JCMODDPLYCWOHJ-BDGSTAKVSA-N 2 0 246.398 2.151 20 0 BEADRP C1[NH2+][C@@H]2[C@H]([NH2+][C@H]3CC4CCC3CC4)[C@H]3C[C@@H]1[C@@H]2C3 ZINC000385593122 711016676 /nfs/dbraw/zinc/01/66/76/711016676.db2.gz JCMODDPLYCWOHJ-HOMYALTASA-N 2 0 246.398 2.151 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@H]2CC23CCCC3)CC1 ZINC000387178856 711041316 /nfs/dbraw/zinc/04/13/16/711041316.db2.gz UWEONMCZFFIXSR-ZDUSSCGKSA-N 2 0 222.376 2.251 20 0 BEADRP CCCC[NH2+]C(C)(C)CCC[NH+](C)C ZINC000387383864 711042656 /nfs/dbraw/zinc/04/26/56/711042656.db2.gz YYTRSSSUKFIQDQ-UHFFFAOYSA-N 2 0 200.370 2.497 20 0 BEADRP C[N@H+](CCCCCF)C1CCC([NH3+])CC1 ZINC000389370861 711077417 /nfs/dbraw/zinc/07/74/17/711077417.db2.gz LESLDKXCCNTBFH-UHFFFAOYSA-N 2 0 216.344 2.328 20 0 BEADRP CCCCCC[N@@H+]1CC[C@H]2[NH2+]CC[C@@H]2C1 ZINC000389566975 711080180 /nfs/dbraw/zinc/08/01/80/711080180.db2.gz AINDVNALZLHTGO-CHWSQXEVSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1 ZINC000389618887 711083901 /nfs/dbraw/zinc/08/39/01/711083901.db2.gz HVAMZKZPMZIBPM-NDBYEHHHSA-N 2 0 210.365 2.247 20 0 BEADRP C[C@@H]1C[C@@H]([NH3+])CC[N@@H+]1CCCC(C)(F)F ZINC000390075492 711104644 /nfs/dbraw/zinc/10/46/44/711104644.db2.gz SMNJGKDMCGNMTO-ZJUUUORDSA-N 2 0 220.307 2.233 20 0 BEADRP C[C@H]([NH3+])CN(C)CC[C@H](C)c1ccccc1 ZINC000390257113 711110400 /nfs/dbraw/zinc/11/04/00/711110400.db2.gz XESDDBMZYRPISB-STQMWFEESA-N 2 0 220.360 2.459 20 0 BEADRP C[N@H+]1CC=C(C[NH2+][C@H]2CC3CCC2CC3)CC1 ZINC000392249314 711143837 /nfs/dbraw/zinc/14/38/37/711143837.db2.gz UCBAKWCEUFXHQO-ZALBZXLWSA-N 2 0 234.387 2.417 20 0 BEADRP CCCN1CCC[C@H]1C[NH2+][C@@H]1CC[C@H]1C ZINC000393604697 711165254 /nfs/dbraw/zinc/16/52/54/711165254.db2.gz CHSCZDAYULEIEB-FRRDWIJNSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H]1NCCC[C@@H]1[NH2+]CCCOc1ccccc1 ZINC000396633923 711360623 /nfs/dbraw/zinc/36/06/23/711360623.db2.gz JSWCECGBLQZVLB-ZFWWWQNUSA-N 2 0 248.370 2.186 20 0 BEADRP CC(C)(C)SCC[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000397432830 711382711 /nfs/dbraw/zinc/38/27/11/711382711.db2.gz FPPMSLJBLKJHMS-WDEREUQCSA-N 2 0 230.421 2.378 20 0 BEADRP CC[C@H]1C[C@@H](C)C[N@@H+]1CCC[NH2+]C1CC1 ZINC000399137197 711420705 /nfs/dbraw/zinc/42/07/05/711420705.db2.gz XPEFBDVWXYJPFC-YPMHNXCESA-N 2 0 210.365 2.249 20 0 BEADRP CC[C@@H]1[C@@H](C)CC[N@@H+]1CCC[NH2+]C1CC1 ZINC000383629485 710985047 /nfs/dbraw/zinc/98/50/47/710985047.db2.gz VPBUXESKMDTAMC-WCQYABFASA-N 2 0 210.365 2.249 20 0 BEADRP CC[C@H](C)CC[NH2+]CC1CC[NH+](C)CC1 ZINC000394397114 711190544 /nfs/dbraw/zinc/19/05/44/711190544.db2.gz CCRYPRAKKZODGB-LBPRGKRZSA-N 2 0 212.381 2.354 20 0 BEADRP CC[C@@H](C)CC[NH2+]CC1CC[NH+](C)CC1 ZINC000394397113 711190725 /nfs/dbraw/zinc/19/07/25/711190725.db2.gz CCRYPRAKKZODGB-GFCCVEGCSA-N 2 0 212.381 2.354 20 0 BEADRP C[NH2+]C[C@@H]1CCC[N@H+](CCCC2CC2)C1 ZINC000394481658 711194174 /nfs/dbraw/zinc/19/41/74/711194174.db2.gz DVLCNDLIHKUDQG-ZDUSSCGKSA-N 2 0 210.365 2.108 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]2C[N@H+](CCCC3CC3)C[C@H]21 ZINC000394594337 711194755 /nfs/dbraw/zinc/19/47/55/711194755.db2.gz GCIREFZQGXBDIT-BFHYXJOUSA-N 2 0 222.376 2.236 20 0 BEADRP C[C@@H]([NH3+])[C@@H]1CCC[N@H+](CCCC2CC2)C1 ZINC000394570133 711195320 /nfs/dbraw/zinc/19/53/20/711195320.db2.gz PQGKZNXIUAZUQK-DGCLKSJQSA-N 2 0 210.365 2.236 20 0 BEADRP Cc1cccc(OCCN[C@@H]2CCC[NH2+][C@H]2C)c1 ZINC000396693470 711365149 /nfs/dbraw/zinc/36/51/49/711365149.db2.gz LUNHBWMRLBKOIG-DZGCQCFKSA-N 2 0 248.370 2.104 20 0 BEADRP CC(C)C[C@@H]1CCC[N@@H+]1C[C@@H]1C[NH2+]C[C@H]1C ZINC000396756558 711368898 /nfs/dbraw/zinc/36/88/98/711368898.db2.gz BVEFMKYVMQDHSS-RDBSUJKOSA-N 2 0 224.392 2.352 20 0 BEADRP CC(C)(C)SCC[NH2+][C@H]1CCC[C@@H]1C[NH3+] ZINC000397464887 711382687 /nfs/dbraw/zinc/38/26/87/711382687.db2.gz SOXAYDYSDRGWOW-MNOVXSKESA-N 2 0 230.421 2.235 20 0 BEADRP C[C@@H]1C[C@H](C)[N@H+](CCCC2CC2)C[C@@H]1C[NH3+] ZINC000397476383 711384371 /nfs/dbraw/zinc/38/43/71/711384371.db2.gz HFQJAQPCDHNTBE-DYEKYZERSA-N 2 0 224.392 2.482 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+][C@@H]2C[C@@H]3CCCC[C@H]23)C1 ZINC000712370878 711448689 /nfs/dbraw/zinc/44/86/89/711448689.db2.gz ANJWLCCQJNMVLR-HTVCTNPSSA-N 2 0 222.376 2.425 20 0 BEADRP C[C@H]1CC[C@H]([NH2+][C@H]2[C@@H]3[NH2+]C[C@H]4C[C@H]2C[C@H]34)CC1 ZINC000383185657 711457408 /nfs/dbraw/zinc/45/74/08/711457408.db2.gz QSOQZMLDXXMURQ-NNWKIESISA-N 2 0 234.387 2.151 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH+]1CCC(CC[NH2+]C)CC1 ZINC000723086248 711501447 /nfs/dbraw/zinc/50/14/47/711501447.db2.gz CCSMMYOTDIIWSK-KGLIPLIRSA-N 2 0 224.392 2.354 20 0 BEADRP CO[C@H](C[N@@H+]1CCC[C@@H](C[NH3+])C1)c1ccccc1 ZINC000382366502 711503493 /nfs/dbraw/zinc/50/34/93/711503493.db2.gz XZADMMOQHNPRKP-DZGCQCFKSA-N 2 0 248.370 2.045 20 0 BEADRP CCOc1ccccc1C[N@@H+]1CC[C@H](CC[NH3+])C1 ZINC000723669045 711533192 /nfs/dbraw/zinc/53/31/92/711533192.db2.gz FJSJYSWVDNVTLT-ZDUSSCGKSA-N 2 0 248.370 2.256 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+]C1C[C@@H](C)C[C@H](C)C1 ZINC000723827562 711537655 /nfs/dbraw/zinc/53/76/55/711537655.db2.gz CBLCGJXLNHPHSF-RVMXOQNASA-N 2 0 224.392 2.256 20 0 BEADRP C[C@H](c1ccncc1)[N@@H+]1C[C@@H](C)[C@H](CC[NH3+])C1 ZINC000723890790 711544316 /nfs/dbraw/zinc/54/43/16/711544316.db2.gz IGELBUWASAUJSH-YRGRVCCFSA-N 2 0 233.359 2.059 20 0 BEADRP CCCCCC[N@@H+]1C[C@@H](C)[C@H](CC[NH3+])C1 ZINC000723899549 711544599 /nfs/dbraw/zinc/54/45/99/711544599.db2.gz DNZVUCPYIOSNMA-CHWSQXEVSA-N 2 0 212.381 2.483 20 0 BEADRP C[C@@H]1C[N@H+](CC2(C)CCC2)C[C@H]1CC[NH3+] ZINC000723902410 711544775 /nfs/dbraw/zinc/54/47/75/711544775.db2.gz XEGKEYWTRMDQLV-VXGBXAGGSA-N 2 0 210.365 2.093 20 0 BEADRP C[C@@H]1C[N@H+](CC2CCCC2)C[C@H]1CC[NH3+] ZINC000723901923 711544925 /nfs/dbraw/zinc/54/49/25/711544925.db2.gz TXXKJJQBNPDTHY-DGCLKSJQSA-N 2 0 210.365 2.093 20 0 BEADRP C[C@@H]1C[N@H+](Cc2ccsc2)C[C@H]1CC[NH3+] ZINC000723907382 711545082 /nfs/dbraw/zinc/54/50/82/711545082.db2.gz AYNMZDSQCHOCDA-ZYHUDNBSSA-N 2 0 224.373 2.165 20 0 BEADRP C[C@@H]([NH2+]CCC1CC=CC1)[C@@H]1CCCC[NH2+]1 ZINC000724202162 711569600 /nfs/dbraw/zinc/56/96/00/711569600.db2.gz KHSIIVFFKPGGOB-OCCSQVGLSA-N 2 0 222.376 2.463 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+]C[C@H]1C[NH2+]CCC1(F)F ZINC000717305472 711595854 /nfs/dbraw/zinc/59/58/54/711595854.db2.gz NVFCCPNPVNIXGJ-ZJUUUORDSA-N 2 0 232.318 2.009 20 0 BEADRP C[NH+](C)CCC[NH2+][C@H]1CCO[C@@H](C(C)(C)C)C1 ZINC000721552891 711624303 /nfs/dbraw/zinc/62/43/03/711624303.db2.gz VYXHAURLQKKUSK-QWHCGFSZSA-N 2 0 242.407 2.121 20 0 BEADRP CC(C)(C)C[NH2+]C[C@H](N)c1ccccc1 ZINC000040494966 711691977 /nfs/dbraw/zinc/69/19/77/711691977.db2.gz GIFQCMZMVPUIKX-LBPRGKRZSA-N 2 0 206.333 2.322 20 0 BEADRP CC(C)[C@H]1CC[C@@H]1[NH2+]C1CCC([NH3+])CC1 ZINC000335049125 711720077 /nfs/dbraw/zinc/72/00/77/711720077.db2.gz IYBNHBUWVJAWCN-TUUUFIMRSA-N 2 0 210.365 2.281 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+]CC[C@H]1CCCS1 ZINC000925722831 711726288 /nfs/dbraw/zinc/72/62/88/711726288.db2.gz NQNGSGXUJGGNEJ-GHMZBOCLSA-N 2 0 228.405 2.002 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+]CC[C@H]1CCCS1 ZINC000925722832 711726422 /nfs/dbraw/zinc/72/64/22/711726422.db2.gz NQNGSGXUJGGNEJ-MNOVXSKESA-N 2 0 228.405 2.002 20 0 BEADRP C1CC12CCC[C@@H]2[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000925723946 711727111 /nfs/dbraw/zinc/72/71/11/711727111.db2.gz FQVDVSMJRHRJCV-NWDGAFQWSA-N 2 0 220.360 2.193 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@@H]1CC[C@@H](C2CC2)O1 ZINC000722316085 711734836 /nfs/dbraw/zinc/73/48/36/711734836.db2.gz LGQYWENUHGKRHD-XBFCOCLRSA-N 2 0 240.391 2.051 20 0 BEADRP Cc1cccc(C[N@@H+]2CC[C@@H](CC[NH3+])C2)c1 ZINC000160042679 711775641 /nfs/dbraw/zinc/77/56/41/711775641.db2.gz AZHVIAQPDDHXMT-CYBMUJFWSA-N 2 0 218.344 2.166 20 0 BEADRP C[C@@]1(C[N@H+]2C[C@@H]3CC=CC[C@@H]3C2)CCC[NH2+]C1 ZINC000382942933 711834561 /nfs/dbraw/zinc/83/45/61/711834561.db2.gz JOESDMIVUSTGTC-QLFBSQMISA-N 2 0 234.387 2.274 20 0 BEADRP COC[C@H](C[N@H+](C)CC[C@@H]([NH3+])C(C)C)C(C)C ZINC000721959945 711948453 /nfs/dbraw/zinc/94/84/53/711948453.db2.gz IVTUIRIOILTHJF-UONOGXRCSA-N 2 0 244.423 2.210 20 0 BEADRP CCC[N@H+](CC1CC1)C[C@H]1CCCC[NH2+]C1 ZINC000700235677 711988538 /nfs/dbraw/zinc/98/85/38/711988538.db2.gz CTEPTHAEBCGXGR-AWEZNQCLSA-N 2 0 224.392 2.498 20 0 BEADRP CCC[C@H](C)[N@H+](C)C[C@H]1CCCC[NH2+]C1 ZINC000700256315 711989175 /nfs/dbraw/zinc/98/91/75/711989175.db2.gz GADDYEBBHZIUJL-STQMWFEESA-N 2 0 212.381 2.497 20 0 BEADRP CCC[C@@H](C)[N@H+](C)C[C@H]1CCCC[NH2+]C1 ZINC000700256313 711989315 /nfs/dbraw/zinc/98/93/15/711989315.db2.gz GADDYEBBHZIUJL-OLZOCXBDSA-N 2 0 212.381 2.497 20 0 BEADRP CSCC[C@H](C)[N@H+](C)C[C@@H]1CCCC[NH2+]C1 ZINC000700402474 711992026 /nfs/dbraw/zinc/99/20/26/711992026.db2.gz CFZNAAFXTJZHGK-QWHCGFSZSA-N 2 0 244.448 2.450 20 0 BEADRP CSC(C)(C)CC[NH2+]CC[C@@H](C)[NH+](C)C ZINC000700476522 711994283 /nfs/dbraw/zinc/99/42/83/711994283.db2.gz HGKOOIHSDGNNOP-LLVKDONJSA-N 2 0 232.437 2.448 20 0 BEADRP CCSC1(C[NH2+][C@@H]2CCCN[C@H]2C)CC1 ZINC000700796468 712005609 /nfs/dbraw/zinc/00/56/09/712005609.db2.gz WVDBGVFJOXGJQX-WDEREUQCSA-N 2 0 228.405 2.002 20 0 BEADRP CC[C@@](C)([NH2+]CC1CC[NH+](C)CC1)C1CC1 ZINC000701074787 712013740 /nfs/dbraw/zinc/01/37/40/712013740.db2.gz HYOSOIBCEMYUPD-CQSZACIVSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)CC1([NH2+]CC2CC[NH+](C)CC2)CC1 ZINC000701454116 712023575 /nfs/dbraw/zinc/02/35/75/712023575.db2.gz RFXVCLQDQXKEKM-UHFFFAOYSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@H](CC(F)F)C[N@@H+]1C[C@@H]2C[NH2+]C[C@]2(C)C1 ZINC000702049315 712037234 /nfs/dbraw/zinc/03/72/34/712037234.db2.gz PDCCVHOSZDDIIM-NTZNESFSSA-N 2 0 246.345 2.209 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)C2(Cl)CC2)C1 ZINC000702253980 712041431 /nfs/dbraw/zinc/04/14/31/712041431.db2.gz BGIQPIHZUGOVRB-WDEREUQCSA-N 2 0 230.783 2.078 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)C2(Cl)CC2)C1 ZINC000702253976 712041887 /nfs/dbraw/zinc/04/18/87/712041887.db2.gz BGIQPIHZUGOVRB-QWRGUYRKSA-N 2 0 230.783 2.078 20 0 BEADRP C[C@H]([NH2+]CCCC[NH+](C)C)C1(Cl)CC1 ZINC000702335948 712047760 /nfs/dbraw/zinc/04/77/60/712047760.db2.gz NQEMNAZMJUWGPB-JTQLQIEISA-N 2 0 218.772 2.078 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@@H](C)C1(Cl)CC1 ZINC000702361966 712048652 /nfs/dbraw/zinc/04/86/52/712048652.db2.gz VWJPXGZKYWXBCE-NSHDSACASA-N 2 0 232.799 2.466 20 0 BEADRP CC1C[C@H]2CC[C@@H](C1)[N@H+]2C[C@@H]1CC[C@H]([NH3+])C1 ZINC000703040158 712066007 /nfs/dbraw/zinc/06/60/07/712066007.db2.gz INVNAJJLEKJAAD-YUSLTOFOSA-N 2 0 222.376 2.377 20 0 BEADRP CCc1ccccc1C[N@@H+]1C[C@@H]2C[NH2+]C[C@]2(C)C1 ZINC000703589778 712079875 /nfs/dbraw/zinc/07/98/75/712079875.db2.gz RVMNCULYONJGNH-JKSUJKDBSA-N 2 0 244.382 2.290 20 0 BEADRP CCc1ccc(C[N@@H+]2C[C@@H]3C[NH2+]C[C@]3(C)C2)cc1 ZINC000703596369 712080327 /nfs/dbraw/zinc/08/03/27/712080327.db2.gz PLOZVSPWFUGRKA-JKSUJKDBSA-N 2 0 244.382 2.290 20 0 BEADRP FC1(F)CCC[N@H+](C[C@H]2CCCC[NH2+]C2)CC1 ZINC000705778103 712137161 /nfs/dbraw/zinc/13/71/61/712137161.db2.gz IESPMSQIPFJEIO-LBPRGKRZSA-N 2 0 246.345 2.497 20 0 BEADRP CC1(C)CC(C[NH2+][C@@H]2[C@H]3C[C@H]4C[NH2+][C@H]2[C@H]4C3)C1 ZINC000706525882 712149106 /nfs/dbraw/zinc/14/91/06/712149106.db2.gz PRVULDUNIZVYQY-YHQUGGNUSA-N 2 0 234.387 2.009 20 0 BEADRP C1=CC[C@H](CC[NH2+][C@H]2[C@@H]3[NH2+]C[C@@H]4C[C@H]2C[C@@H]43)CC1 ZINC000706841503 712157915 /nfs/dbraw/zinc/15/79/15/712157915.db2.gz CDMOTEXUUSROTO-OSLXHZNNSA-N 2 0 246.398 2.319 20 0 BEADRP CC(C)[C@@H]([NH3+])CC[N@H+](C)C[C@@H]1CC(C)(C)CO1 ZINC000708334757 712188490 /nfs/dbraw/zinc/18/84/90/712188490.db2.gz AHFNBHAANXHZAI-STQMWFEESA-N 2 0 242.407 2.107 20 0 BEADRP C[N@H+](CCCCCC[NH3+])CCc1nccs1 ZINC000708457185 712195209 /nfs/dbraw/zinc/19/52/09/712195209.db2.gz ILBSTHCGHNWPMJ-UHFFFAOYSA-N 2 0 241.404 2.137 20 0 BEADRP CC(C)(C)[C@@H]1CCC[N@H+](C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000708442346 712195243 /nfs/dbraw/zinc/19/52/43/712195243.db2.gz OXNRMGJIBVHLLR-UPJWGTAASA-N 2 0 224.392 2.482 20 0 BEADRP CCC[C@H]1C[N@H+](CCCCCC[NH3+])CCO1 ZINC000708921878 712203370 /nfs/dbraw/zinc/20/33/70/712203370.db2.gz HNJGAYJXDVKMET-ZDUSSCGKSA-N 2 0 228.380 2.006 20 0 BEADRP C[C@@H]1[C@H]2CC[C@@H](C[C@H]1[NH2+][C@@H]1CCC1(C)C)[NH2+]2 ZINC000709433555 712221790 /nfs/dbraw/zinc/22/17/90/712221790.db2.gz HEMYZISDQRNYFC-NZEXEKPDSA-N 2 0 222.376 2.294 20 0 BEADRP C([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)[C@@]12C[C@@H]1CCCC2 ZINC000709427186 712221854 /nfs/dbraw/zinc/22/18/54/712221854.db2.gz SNUZKEWXRADLQA-DFKRWLTFSA-N 2 0 234.387 2.439 20 0 BEADRP [NH3+][C@H]1C[C@H]2C[C@@H](C1)[N@H+](CCc1ccccc1)C2 ZINC000709835802 712229449 /nfs/dbraw/zinc/22/94/49/712229449.db2.gz LVORWJBLWHUUOT-KKUMJFAQSA-N 2 0 230.355 2.041 20 0 BEADRP [NH3+][C@@H]1C[C@H]2C[C@@H](C1)[N@H+](CCCC1CCC1)C2 ZINC000709871476 712230471 /nfs/dbraw/zinc/23/04/71/712230471.db2.gz NCSOHPNHDYUAMD-MJBXVCDLSA-N 2 0 222.376 2.378 20 0 BEADRP C[NH2+][C@H]1CCN(CC2CCC3(CC3)CC2)C1 ZINC000709994885 712238955 /nfs/dbraw/zinc/23/89/55/712238955.db2.gz BBEGETYXIOWLLF-ZDUSSCGKSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@H](CC1CCC1)[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000710276196 712250420 /nfs/dbraw/zinc/25/04/20/712250420.db2.gz GYVBWPJUKOHNKC-WZRBSPASSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]1CC[C@H](C[N@H+](C)CCCCCC[NH3+])O1 ZINC000710749646 712255248 /nfs/dbraw/zinc/25/52/48/712255248.db2.gz IZTPWNCMKOAYQK-CHWSQXEVSA-N 2 0 228.380 2.005 20 0 BEADRP Cc1noc(C)c1C[N@H+](C)CCCCCC[NH3+] ZINC000710715076 712255325 /nfs/dbraw/zinc/25/53/25/712255325.db2.gz YBPVZGJUUINVON-UHFFFAOYSA-N 2 0 239.363 2.242 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]C[C@]23C[C@H]2CCCC3)C1 ZINC000710593782 712264015 /nfs/dbraw/zinc/26/40/15/712264015.db2.gz QDRAOYRHGHUHJK-MQYQWHSLSA-N 2 0 222.376 2.426 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+][C@H]1C[C@@H]2CC[C@@H](C2)C1 ZINC000711071438 712279101 /nfs/dbraw/zinc/27/91/01/712279101.db2.gz RQZLGTYNXSELRR-IGQOVBAYSA-N 2 0 224.392 2.495 20 0 BEADRP C([NH2+]C(C1CC1)C1CC1)[C@]12CCC[C@H]1[NH2+]CC2 ZINC000711257190 712291958 /nfs/dbraw/zinc/29/19/58/712291958.db2.gz RXOCPJWTFNZMGG-UKRRQHHQSA-N 2 0 234.387 2.297 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2C=CCC2)CC[N@@H+]1C ZINC000711666893 712318588 /nfs/dbraw/zinc/31/85/88/712318588.db2.gz JGDDTCREHRTUFF-UPJWGTAASA-N 2 0 208.349 2.025 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@@H]2C=CCC2)CC[N@@H+]1C ZINC000711666892 712318607 /nfs/dbraw/zinc/31/86/07/712318607.db2.gz JGDDTCREHRTUFF-JHJVBQTASA-N 2 0 208.349 2.025 20 0 BEADRP C1=C[C@H](C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)CC1 ZINC000711790621 712330780 /nfs/dbraw/zinc/33/07/80/712330780.db2.gz ZKIPUQDUEIALNL-ZQDZILKHSA-N 2 0 234.387 2.463 20 0 BEADRP [NH3+]CC[C@@H]1CC[N@@H+]([C@@H]2C[C@@H]2c2ccccc2)C1 ZINC000923480394 712334972 /nfs/dbraw/zinc/33/49/72/712334972.db2.gz YATFFCCWMYOXCQ-BPLDGKMQSA-N 2 0 230.355 2.213 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@]2(C)CCC[NH2+]C2)CCS1 ZINC000379545345 712387479 /nfs/dbraw/zinc/38/74/79/712387479.db2.gz YOWUKECNSUZYDY-CHWSQXEVSA-N 2 0 242.432 2.204 20 0 BEADRP CC1(C)CCC[C@@H]1C[NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32 ZINC000388705660 712389679 /nfs/dbraw/zinc/38/96/79/712389679.db2.gz LKYAGSQPTOILSM-XDSHMYFISA-N 2 0 248.414 2.399 20 0 BEADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+][C@H]2CC[C@H]2C)C1 ZINC000379780120 712398922 /nfs/dbraw/zinc/39/89/22/712398922.db2.gz BVGPYLXRIIYPNG-AGIUHOORSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@@H]2CCCC[C@H]12)[C@H]1CCC[NH2+]1 ZINC000712473442 712430466 /nfs/dbraw/zinc/43/04/66/712430466.db2.gz WXPNEDPGBUCRQD-QSLWVIQJSA-N 2 0 222.376 2.295 20 0 BEADRP CC1(C)[C@H]([NH2+]CC[C@@H]2C[C@H]2C2CC2)C[C@@H]1[NH3+] ZINC000712751271 712449193 /nfs/dbraw/zinc/44/91/93/712449193.db2.gz RLGCJWRPCFXLEV-MROQNXINSA-N 2 0 222.376 2.138 20 0 BEADRP C=C/C=C/CC[N@@H+](C)C1CCC([NH3+])CC1 ZINC000713700932 712469402 /nfs/dbraw/zinc/46/94/02/712469402.db2.gz DQFLEKZRVHFDQX-SNAWJCMRSA-N 2 0 208.349 2.320 20 0 BEADRP C=C/C=C\CC[N@@H+]1CC[C@H]([NH3+])[C@H](CC)C1 ZINC000713700394 712469411 /nfs/dbraw/zinc/46/94/11/712469411.db2.gz AEDXMTZOFVOGJZ-QLQVPFRHSA-N 2 0 208.349 2.178 20 0 BEADRP C=C/C=C\CC[N@@H+](C)CC[C@@H]([NH3+])C(C)C ZINC000713736307 712470427 /nfs/dbraw/zinc/47/04/27/712470427.db2.gz TVYVSJCCSZIGSK-FMFIFOJESA-N 2 0 210.365 2.424 20 0 BEADRP C=C/C=C/CC[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000713742570 712471547 /nfs/dbraw/zinc/47/15/47/712471547.db2.gz ZIKRLWPUKSLLTE-JKWAOEONSA-N 2 0 220.360 2.335 20 0 BEADRP C=C/C=C\CC[N@@H+]1CC[C@@]2(C1)CCC[NH2+]C2 ZINC000713755446 712471730 /nfs/dbraw/zinc/47/17/30/712471730.db2.gz MZGCWFIZSJBIPL-NQHOJNORSA-N 2 0 220.360 2.194 20 0 BEADRP C=C/C=C/CC[NH2+]C1CC[NH+](CC)CC1 ZINC000713757621 712471928 /nfs/dbraw/zinc/47/19/28/712471928.db2.gz KJUXPUXKCVBKFB-AATRIKPKSA-N 2 0 208.349 2.193 20 0 BEADRP COCCCC[NH+]1CCC(C(C)(C)C[NH3+])CC1 ZINC000714444691 712489775 /nfs/dbraw/zinc/48/97/75/712489775.db2.gz DGCAVMATRPDGGT-UHFFFAOYSA-N 2 0 242.407 2.110 20 0 BEADRP CC(C)(C[NH3+])C1CC[NH+](Cc2cccnc2)CC1 ZINC000714454732 712490300 /nfs/dbraw/zinc/49/03/00/712490300.db2.gz IBTJRHAVYNPZRO-UHFFFAOYSA-N 2 0 247.386 2.279 20 0 BEADRP CC(C)[C@@H](C)[N@H+](C)CCCCCC[NH3+] ZINC000036787573 712495294 /nfs/dbraw/zinc/49/52/94/712495294.db2.gz KANUUVKIWHKYSK-GFCCVEGCSA-N 2 0 200.370 2.482 20 0 BEADRP C[NH2+]C[C@H]1CCC[N@H+](CC[C@@H]2C[C@H]2C2CC2)C1 ZINC000714932529 712500283 /nfs/dbraw/zinc/50/02/83/712500283.db2.gz PVSLYSYNIYFFQU-YUELXQCFSA-N 2 0 236.403 2.354 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]2C[N@H+](CC[C@@H]3C[C@H]3C3CC3)C[C@H]21 ZINC000714930385 712500610 /nfs/dbraw/zinc/50/06/10/712500610.db2.gz ARNQLCQEWQEYMJ-LYYZXLFJSA-N 2 0 248.414 2.482 20 0 BEADRP [NH3+]CC1CC[NH+](CC[C@@H]2C[C@H]2C2CC2)CC1 ZINC000714851852 712501576 /nfs/dbraw/zinc/50/15/76/712501576.db2.gz RIKHECGLMYWKKP-KGLIPLIRSA-N 2 0 222.376 2.093 20 0 BEADRP C(C[N@@H+]1CC[C@]2(CC[NH2+]C2)C1)[C@@H]1C[C@H]1C1CC1 ZINC000714850223 712501689 /nfs/dbraw/zinc/50/16/89/712501689.db2.gz MUVCARPJCXKQSI-ILXRZTDVSA-N 2 0 234.387 2.108 20 0 BEADRP C[NH+](C)C1(C)CCC([NH2+][C@H]2CCSC2)CC1 ZINC000715490385 712523111 /nfs/dbraw/zinc/52/31/11/712523111.db2.gz JNPSBZIZARYERE-CPCZMJQVSA-N 2 0 242.432 2.344 20 0 BEADRP C[C@H]1OCC[C@H]1[NH2+]C1CCC(C)([NH+](C)C)CC1 ZINC000715513598 712525042 /nfs/dbraw/zinc/52/50/42/712525042.db2.gz RPNNIWJXGSVGIX-NELGMTEASA-N 2 0 240.391 2.016 20 0 BEADRP Cc1c[nH+]ccc1NC1CCC(C)([NH+](C)C)CC1 ZINC000715585704 712527092 /nfs/dbraw/zinc/52/70/92/712527092.db2.gz NJSJOPBYSCYQLI-UHFFFAOYSA-N 2 0 247.386 2.487 20 0 BEADRP C[C@H](Cc1ccco1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000036993738 712528726 /nfs/dbraw/zinc/52/87/26/712528726.db2.gz MRJOUFIMPYYTRA-RLAWYHOSSA-N 2 0 248.370 2.425 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H]([NH+](C)C)C2)CS1 ZINC000715572724 712529407 /nfs/dbraw/zinc/52/94/07/712529407.db2.gz MVADITPXZXVCFP-NDBYEHHHSA-N 2 0 242.432 2.343 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CCCS1)[C@@H]1CCC[NH2+]1 ZINC000715656541 712529940 /nfs/dbraw/zinc/52/99/40/712529940.db2.gz HNSOZSVWJBYUHH-SRVKXCTJSA-N 2 0 228.405 2.002 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CC[C@@H]1CCCS1 ZINC000715753141 712531666 /nfs/dbraw/zinc/53/16/66/712531666.db2.gz JFBHJYHJZSGRDA-NEPJUHHUSA-N 2 0 230.421 2.379 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CC[C@@H]1CCCS1 ZINC000715753149 712531981 /nfs/dbraw/zinc/53/19/81/712531981.db2.gz JFBHJYHJZSGRDA-RYUDHWBXSA-N 2 0 230.421 2.379 20 0 BEADRP CCCC[NH+]1CCC([NH2+]CC(C)C)CC1 ZINC000037150062 712547640 /nfs/dbraw/zinc/54/76/40/712547640.db2.gz KULHPQSRDHWLFH-UHFFFAOYSA-N 2 0 212.381 2.497 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+]CCCCC2CC2)C12CCC2 ZINC000716369647 712556820 /nfs/dbraw/zinc/55/68/20/712556820.db2.gz LOHPIORDUXMESV-QWHCGFSZSA-N 2 0 222.376 2.426 20 0 BEADRP C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000716585104 712564697 /nfs/dbraw/zinc/56/46/97/712564697.db2.gz RHPSWZASMPNWOJ-ZAQNNHEOSA-N 2 0 236.403 2.351 20 0 BEADRP C(C[C@@H]1CC[C@@H]2C[C@@H]21)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000717005310 712604099 /nfs/dbraw/zinc/60/40/99/712604099.db2.gz ZZYVSHXOMDELMJ-AQSJMSBDSA-N 2 0 234.387 2.295 20 0 BEADRP CC(C)C[C@H](C)[NH2+]C[C@H]1C[NH2+]CCC1(F)F ZINC000717015808 712604612 /nfs/dbraw/zinc/60/46/12/712604612.db2.gz BQRUXEKCVOPOIO-WDEREUQCSA-N 2 0 234.334 2.255 20 0 BEADRP CC[NH+]1CCC([NH2+]CC[C@@H]2CC[C@@H]3C[C@@H]32)CC1 ZINC000717091794 712630179 /nfs/dbraw/zinc/63/01/79/712630179.db2.gz DAQLWIKJHHYWLX-GZBFAFLISA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C[C@@H]2C[NH2+]CCC2(F)F)C1 ZINC000717307105 712646328 /nfs/dbraw/zinc/64/63/28/712646328.db2.gz RYFDXWHGAFICJW-OUAUKWLOSA-N 2 0 232.318 2.009 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]C[C@H]2CCC=CO2)c2ccccc21 ZINC000380030303 712683532 /nfs/dbraw/zinc/68/35/32/712683532.db2.gz YVCMSVADYWBNMR-DFBGVHRSSA-N 2 0 244.338 2.414 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]C2CCC=CCC2)C12CCC2 ZINC000718132538 712747006 /nfs/dbraw/zinc/74/70/06/712747006.db2.gz BREHLTWLBPUADO-STQMWFEESA-N 2 0 220.360 2.345 20 0 BEADRP CC(F)(F)CCC[N@@H+]1CC[NH2+]CCC1(C)C ZINC000718611419 712772914 /nfs/dbraw/zinc/77/29/14/712772914.db2.gz MFCNWNGZZLVZBM-UHFFFAOYSA-N 2 0 234.334 2.496 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CCC[N@H+](CCCC(C)(F)F)C1 ZINC000718710783 712778348 /nfs/dbraw/zinc/77/83/48/712778348.db2.gz XXMGTYVCLJURJV-WDEREUQCSA-N 2 0 234.334 2.481 20 0 BEADRP CSCC1CC[NH+](C[C@@H]2CC[C@H]([NH3+])C2)CC1 ZINC000719308546 712804114 /nfs/dbraw/zinc/80/41/14/712804114.db2.gz VZBSTZBCYBKQQI-OLZOCXBDSA-N 2 0 242.432 2.189 20 0 BEADRP CCCCC[N@@H+]1C[C@@H](C[NH3+])[C@@H](C(F)(F)F)C1 ZINC000720809507 712867161 /nfs/dbraw/zinc/86/71/61/712867161.db2.gz ZVYWWTYZEJTZFG-ZJUUUORDSA-N 2 0 238.297 2.246 20 0 BEADRP CC[NH+]1CCC([NH2+]CC2(C)CC(F)(F)C2)CC1 ZINC000720934320 712880072 /nfs/dbraw/zinc/88/00/72/712880072.db2.gz GFZHBUDAVUWILL-UHFFFAOYSA-N 2 0 246.345 2.496 20 0 BEADRP CCO[C@@H]1CCC[C@@H]([NH2+]C[C@@H](C)C[NH+](C)C)C1 ZINC000721169348 712894281 /nfs/dbraw/zinc/89/42/81/712894281.db2.gz VUBCFCHTTMXQQO-MGPQQGTHSA-N 2 0 242.407 2.121 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH+]2CCC(C)(C)CC2)C1 ZINC001208606282 957091596 /nfs/dbraw/zinc/09/15/96/957091596.db2.gz DTDLEGKCYVRLMK-CYBMUJFWSA-N 2 0 224.392 2.450 20 0 BEADRP CC[C@H](CSC)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000217327797 958102123 /nfs/dbraw/zinc/10/21/23/958102123.db2.gz BFUGNZMCXBCIHO-ODWCKFRGSA-N 2 0 242.432 2.343 20 0 BEADRP Cc1c[nH+]c(N(C)CC2CC[NH+](C)CC2)cc1C ZINC001165043384 721938023 /nfs/dbraw/zinc/93/80/23/721938023.db2.gz VEIRQEOKNUPZME-UHFFFAOYSA-N 2 0 247.386 2.476 20 0 BEADRP CCCCOCC[N@@H+]1CCCC[C@@H]1CC[NH3+] ZINC000082594412 958497059 /nfs/dbraw/zinc/49/70/59/958497059.db2.gz VBEHNUCSYRUUFS-CYBMUJFWSA-N 2 0 228.380 2.006 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+][C@H]2CCCC(F)(F)C2)C12CCC2 ZINC000695112742 960106600 /nfs/dbraw/zinc/10/66/00/960106600.db2.gz MFHFMFWVCAXKOR-AXFHLTTASA-N 2 0 244.329 2.424 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)C1(Cl)CC1 ZINC000695654755 960329127 /nfs/dbraw/zinc/32/91/27/960329127.db2.gz JGADJIDWGKDPFY-QWRGUYRKSA-N 2 0 242.794 2.220 20 0 BEADRP Cc1ccc(C)c(NC(=[NH2+])SCC[NH3+])c1 ZINC001167914327 961094290 /nfs/dbraw/zinc/09/42/90/961094290.db2.gz KKGIFEYXICSNLU-UHFFFAOYSA-N 2 0 223.345 2.342 20 0 BEADRP CCC[N@H+](CCC[NH+](C)C)[C@@H]1C[C@H]2C[C@H]2C1 ZINC001167948470 962595815 /nfs/dbraw/zinc/59/58/15/962595815.db2.gz NFNHFWGWFNJEAB-BTTYYORXSA-N 2 0 224.392 2.449 20 0 BEADRP CC[C@H](C)[N@H+](CC)C[C@@H]1CCCC[NH2+]C1 ZINC000697040180 963668131 /nfs/dbraw/zinc/66/81/31/963668131.db2.gz HKEARXNAGHAXBQ-QWHCGFSZSA-N 2 0 212.381 2.497 20 0 BEADRP C[NH+](C)C1CCC([NH2+]C23CC(C2)C3)CC1 ZINC001168294965 964389374 /nfs/dbraw/zinc/38/93/74/964389374.db2.gz LFCLUJIUTZMEQM-UHFFFAOYSA-N 2 0 208.349 2.001 20 0 BEADRP C[N@H+](CC1CC1)C1CC[NH+](CC2CC2)CC1 ZINC001168370720 964925016 /nfs/dbraw/zinc/92/50/16/964925016.db2.gz FKDMACZPSNUVHR-UHFFFAOYSA-N 2 0 222.376 2.203 20 0 BEADRP CC1(CC[NH2+][C@@H]2C[C@@H]([NH3+])C23CCC3)CC1 ZINC000698118036 965017935 /nfs/dbraw/zinc/01/79/35/965017935.db2.gz ZPZHLJFJXWUKGQ-GHMZBOCLSA-N 2 0 208.349 2.036 20 0 BEADRP CCOC1CCC([NH2+]CC[C@@H](C)[NH+](C)C)CC1 ZINC000691136434 965964957 /nfs/dbraw/zinc/96/49/57/965964957.db2.gz IBCFJNIERQBRAW-IYXRBSQSSA-N 2 0 242.407 2.264 20 0 BEADRP C[NH+](C)[C@@H]1CCC[C@H]([NH2+][C@@H]2C[C@H]3C[C@H]3C2)C1 ZINC000715238073 965995187 /nfs/dbraw/zinc/99/51/87/965995187.db2.gz ZDKLQCZROABFFU-ZUWCUPBKSA-N 2 0 222.376 2.247 20 0 BEADRP C(CC[NH+]1CCCC1)C[NH2+]C1CCSCC1 ZINC000126173699 1165772326 /nfs/dbraw/zinc/77/23/26/1165772326.db2.gz HXTKNWJALMYCQH-UHFFFAOYSA-N 2 0 242.432 2.348 20 0 BEADRP C[C@H](C[N@@H+]1CCC[C@](C)([NH3+])CC1)C(F)(F)F ZINC001205255008 967441749 /nfs/dbraw/zinc/44/17/49/967441749.db2.gz DORUXEYVZNXBLV-ZJUUUORDSA-N 2 0 238.297 2.388 20 0 BEADRP CC(C)CC[N@@H+]1CCC[C@H](C[NH3+])[C@@H](C)C1 ZINC001205984001 967936144 /nfs/dbraw/zinc/93/61/44/967936144.db2.gz QUDZGQLMXXNTMC-QWHCGFSZSA-N 2 0 212.381 2.339 20 0 BEADRP C[NH+](C)CCC[NH2+][C@@H]1C[C@@H]2CC[C@@H](C2)C1 ZINC000711197480 967999614 /nfs/dbraw/zinc/99/96/14/967999614.db2.gz UPQWIXKHOGIQHM-CLLJXQQHSA-N 2 0 210.365 2.106 20 0 BEADRP Cc1cccnc1C[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000228834793 1166008638 /nfs/dbraw/zinc/00/86/38/1166008638.db2.gz JAQOUFOGWXLBQH-UHFFFAOYSA-N 2 0 247.386 2.212 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]C[C@@H]1C[C@@H]1C ZINC000389914036 1166053905 /nfs/dbraw/zinc/05/39/05/1166053905.db2.gz LTZJUFCOZNCNAV-AVGNSLFASA-N 2 0 212.381 2.352 20 0 BEADRP CC1CC([N@H+](C)CC(C)(C)C[NH+](C)C)C1 ZINC001207275979 968713606 /nfs/dbraw/zinc/71/36/06/968713606.db2.gz RRFLUAGWCGDGQB-UHFFFAOYSA-N 2 0 212.381 2.305 20 0 BEADRP C[C@@H]1CC([NH+]2CCC(C[NH3+])CC2)C[C@@H](C)C1 ZINC000082831468 1166079277 /nfs/dbraw/zinc/07/92/77/1166079277.db2.gz MHYZVWMGYMPRKE-RYUDHWBXSA-N 2 0 224.392 2.482 20 0 BEADRP C[C@@H](C[NH3+])C[N@H+](C)C1C[C@H](C)C[C@@H](C)C1 ZINC000082832690 1166079933 /nfs/dbraw/zinc/07/99/33/1166079933.db2.gz ICDZGGUMPGGCAR-UTUOFQBUSA-N 2 0 212.381 2.338 20 0 BEADRP C[NH+](C)CC(C)(C)C[NH+]1CCC(CF)CC1 ZINC001207285763 968717279 /nfs/dbraw/zinc/71/72/79/968717279.db2.gz NXEPRHDZRFMRJR-UHFFFAOYSA-N 2 0 230.371 2.256 20 0 BEADRP CCCO[C@H]1CC[N@H+](CC(C)(C)C[NH+](C)C)C1 ZINC001207285436 968717751 /nfs/dbraw/zinc/71/77/51/968717751.db2.gz KJPLWPKZLNPCOL-ZDUSSCGKSA-N 2 0 242.407 2.075 20 0 BEADRP C[NH+]1CCC(CC[N@@H+]2CCC[C@@H](F)C2)CC1 ZINC001207482364 968798462 /nfs/dbraw/zinc/79/84/62/968798462.db2.gz BOQFVOGEOYWDMG-CYBMUJFWSA-N 2 0 228.355 2.152 20 0 BEADRP C[C@@H]1CCC[N@H+](CCC2CC[NH+](C)CC2)C1 ZINC001207480263 968798965 /nfs/dbraw/zinc/79/89/65/968798965.db2.gz YZJATPZNKHXYRM-CYBMUJFWSA-N 2 0 224.392 2.450 20 0 BEADRP CC1CC([N@H+](C)CCC2CC[NH+](C)CC2)C1 ZINC001207480259 968797596 /nfs/dbraw/zinc/79/75/96/968797596.db2.gz YSKUMNGBPIKJCI-UHFFFAOYSA-N 2 0 224.392 2.449 20 0 BEADRP C([NH2+]C1CCCCC1)[C@H]1C[NH+]2CCC1CC2 ZINC001207723186 968869302 /nfs/dbraw/zinc/86/93/02/968869302.db2.gz CLLGJAREENCFTE-ZDUSSCGKSA-N 2 0 222.376 2.251 20 0 BEADRP Cc1cc(C)nc(C[N@H+]2CC[C@@H](C)[C@H](C[NH3+])C2)c1 ZINC000723877362 1166146978 /nfs/dbraw/zinc/14/69/78/1166146978.db2.gz TXKJBHIIYJTLGV-TZMCWYRMSA-N 2 0 247.386 2.115 20 0 BEADRP Cc1cc(C)nc(C[N@H+]2CC[C@H](C)[C@H](C[NH3+])C2)c1 ZINC000723877359 1166147090 /nfs/dbraw/zinc/14/70/90/1166147090.db2.gz TXKJBHIIYJTLGV-GXTWGEPZSA-N 2 0 247.386 2.115 20 0 BEADRP CCC[C@@H](O)C[NH2+]CCCCC[NH+]1CCCC1 ZINC001252804889 968990396 /nfs/dbraw/zinc/99/03/96/968990396.db2.gz ZEMQKWNTOJZOSN-CQSZACIVSA-N 2 0 242.407 2.003 20 0 BEADRP C[N@H+](CC1CC1)CC1(C)CC[NH+](C)CC1 ZINC001208102311 969004174 /nfs/dbraw/zinc/00/41/74/969004174.db2.gz DPKGXVIXEMQECZ-UHFFFAOYSA-N 2 0 210.365 2.060 20 0 BEADRP CS[C@@H](C)CC[NH+]1CCC([NH+](C)C)CC1 ZINC001208140778 969058215 /nfs/dbraw/zinc/05/82/15/969058215.db2.gz VPASACQRRGDYEA-NSHDSACASA-N 2 0 230.421 2.154 20 0 BEADRP CS[C@H](C)CC[N@@H+]1C[C@@H]2CCCN(C)[C@@H]2C1 ZINC001208151183 969071892 /nfs/dbraw/zinc/07/18/92/969071892.db2.gz SYVHKGRQADSZJL-FRRDWIJNSA-N 2 0 242.432 2.154 20 0 BEADRP CS[C@@H](C)CC[NH+]1CC2(C1)CC[NH+](C)CC2 ZINC001208155642 969079017 /nfs/dbraw/zinc/07/90/17/969079017.db2.gz RZCVTLXKOIVUIO-LBPRGKRZSA-N 2 0 242.432 2.156 20 0 BEADRP C[C@@H]1C[N@H+](C[C@@H]2CCC[NH+](C)C2)CCC1(F)F ZINC001208609276 969145855 /nfs/dbraw/zinc/14/58/55/969145855.db2.gz ZYJZLEJZRJHNIO-VXGBXAGGSA-N 2 0 246.345 2.305 20 0 BEADRP C[C@H]1[C@@H](C)[N@@H+](CCC[NH2+]C2CC2)C[C@H]1C ZINC000399667438 1166250928 /nfs/dbraw/zinc/25/09/28/1166250928.db2.gz MRNMZDUNXGKPEF-IJLUTSLNSA-N 2 0 210.365 2.105 20 0 BEADRP CC[C@@H]1CC[N@H+](C[C@H]2CCC[NH+](C)C2)C1 ZINC001208615756 969171169 /nfs/dbraw/zinc/17/11/69/969171169.db2.gz XYHYPWGVYYJECH-OLZOCXBDSA-N 2 0 210.365 2.060 20 0 BEADRP Cc1cc(C)[nH+]c(N2CCC[C@](C)(C[NH3+])C2)c1 ZINC000707981273 1166279534 /nfs/dbraw/zinc/27/95/34/1166279534.db2.gz VJLXVQBIFJAYKC-CQSZACIVSA-N 2 0 233.359 2.264 20 0 BEADRP CC(C)CCC[N@@H+]1C[C@H]2C[C@@]2(C[NH+](C)C)C1 ZINC001208736470 969228612 /nfs/dbraw/zinc/22/86/12/969228612.db2.gz HBVDCFOLWXMNHB-ZIAGYGMSSA-N 2 0 224.392 2.306 20 0 BEADRP [NH3+]C[C@@H]1CCC[N@@H+]([C@H]2CCc3c2cccc3F)C1 ZINC000250218962 1166304923 /nfs/dbraw/zinc/30/49/23/1166304923.db2.gz QUIIGZGLMSQFLK-NHYWBVRUSA-N 2 0 248.345 2.484 20 0 BEADRP C[C@@H]1C[C@@H]([N@H+](C)CCC[NH3+])CC(C)(C)C1 ZINC000227741928 1166307382 /nfs/dbraw/zinc/30/73/82/1166307382.db2.gz JKIWMZIRWASWGS-VXGBXAGGSA-N 2 0 212.381 2.482 20 0 BEADRP C/C(=C\C=C\N)[NH+]1C(C)(C)CC([NH3+])CC1(C)C ZINC001167624667 1166313241 /nfs/dbraw/zinc/31/32/41/1166313241.db2.gz DGOYMHADTGURHW-JMFBPXTISA-N 2 0 237.391 2.343 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]Cc2cccs2)C12CCC2 ZINC000405207786 1166403652 /nfs/dbraw/zinc/40/36/52/1166403652.db2.gz BDGTZVJIFLSLJQ-MNOVXSKESA-N 2 0 222.357 2.108 20 0 BEADRP CC[C@@H]1CCCC[N@@H+]1[C@H]1CC[NH2+][C@H](C)C1 ZINC000252935578 1166427741 /nfs/dbraw/zinc/42/77/41/1166427741.db2.gz FMAHAOQRSOBZIB-UPJWGTAASA-N 2 0 210.365 2.391 20 0 BEADRP C([C@H]1CC[NH2+]C1)[N@@H+]1CC[C@H]2CCCC[C@@H]2C1 ZINC000250883504 1166443923 /nfs/dbraw/zinc/44/39/23/1166443923.db2.gz VZZSTNBUJKBISN-BFHYXJOUSA-N 2 0 222.376 2.108 20 0 BEADRP C[C@@H]1CC[N@@H+]([C@@H]2CC[NH2+][C@@H](C)C2)[C@H](C)C1 ZINC000252961214 1166461019 /nfs/dbraw/zinc/46/10/19/1166461019.db2.gz VELJTGIBRWVDFS-YVECIDJPSA-N 2 0 210.365 2.247 20 0 BEADRP C[C@@H]1CC[N@@H+]([C@@H]2CC[NH2+][C@H](C)C2)[C@@H](C)C1 ZINC000252961213 1166461197 /nfs/dbraw/zinc/46/11/97/1166461197.db2.gz VELJTGIBRWVDFS-FVCCEPFGSA-N 2 0 210.365 2.247 20 0 BEADRP C1C[C@@H]2CCC[N@@H+]([C@@H]3CCC[NH2+]C3)[C@H]2C1 ZINC000250996828 1166465039 /nfs/dbraw/zinc/46/50/39/1166465039.db2.gz DBLMOVNQZLUWJV-UPJWGTAASA-N 2 0 208.349 2.003 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH2+]C(C)(C)C2CC2)CC1 ZINC001254497001 969658289 /nfs/dbraw/zinc/65/82/89/969658289.db2.gz CVHXUKMSVAOFCL-LBPRGKRZSA-N 2 0 210.365 2.249 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH+]2CCCCCC2)CC1 ZINC001254516021 969693388 /nfs/dbraw/zinc/69/33/88/969693388.db2.gz IPWLFGAPRFRCQZ-ZDUSSCGKSA-N 2 0 210.365 2.347 20 0 BEADRP [NH3+]C[C@H]1CCCC[N@@H+](C2CCCCC2)C1 ZINC000215782001 1166486871 /nfs/dbraw/zinc/48/68/71/1166486871.db2.gz YXCAXRCDVGQBGZ-GFCCVEGCSA-N 2 0 210.365 2.380 20 0 BEADRP C1CC[C@H]2[C@H](C1)CCC[N@@H+]2[C@@H]1CCC[NH2+]C1 ZINC000036827155 1166498027 /nfs/dbraw/zinc/49/80/27/1166498027.db2.gz HBTGAYJPEGRVRI-MCIONIFRSA-N 2 0 222.376 2.393 20 0 BEADRP CC[C@@H](C)[NH2+]CCCC[NH+](CC)CC ZINC000177961612 1166551535 /nfs/dbraw/zinc/55/15/35/1166551535.db2.gz DYWQGSTZANNDCW-GFCCVEGCSA-N 2 0 200.370 2.497 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@@H](C)C1(Cl)CC1 ZINC000695665915 1166663206 /nfs/dbraw/zinc/66/32/06/1166663206.db2.gz FFLQEXAOHNDWED-ZJUUUORDSA-N 2 0 218.772 2.076 20 0 BEADRP C[NH+](C)CCC(C)(C)[NH2+][C@@H]1CCOC(C)(C)C1 ZINC001255528495 970289556 /nfs/dbraw/zinc/28/95/56/970289556.db2.gz OOUGBBJIJSYJBL-GFCCVEGCSA-N 2 0 242.407 2.264 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCCC(F)(F)F)CC[NH2+]1 ZINC000709317849 1166692014 /nfs/dbraw/zinc/69/20/14/1166692014.db2.gz HKOODRKZLQFAAN-BDAKNGLRSA-N 2 0 224.270 2.059 20 0 BEADRP C[C@H]([NH2+]C1CC(C)(C)C1)[C@H]1CCCC[NH2+]1 ZINC000395166081 1166706592 /nfs/dbraw/zinc/70/65/92/1166706592.db2.gz CQCRBVLYXFYEJH-CMPLNLGQSA-N 2 0 210.365 2.295 20 0 BEADRP CC[NH+]1CCC(NC(=[NH2+])C(C)(C)C)CC1 ZINC000395705799 1166723578 /nfs/dbraw/zinc/72/35/78/1166723578.db2.gz JFGDLAKDIATWLU-UHFFFAOYSA-N 2 0 211.353 2.084 20 0 BEADRP CC(C)[C@H]1CCC[N@@H+]1[C@H]1CC[NH2+][C@H](C)C1 ZINC000252965021 1166760624 /nfs/dbraw/zinc/76/06/24/1166760624.db2.gz WWQYFFWTGKXLIQ-FRRDWIJNSA-N 2 0 210.365 2.247 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]CCCSC ZINC001255942086 970574862 /nfs/dbraw/zinc/57/48/62/970574862.db2.gz DFGYABGJJJNZAC-GFCCVEGCSA-N 2 0 232.437 2.450 20 0 BEADRP C[C@H]1CC[C@H]1[NH2+]CCC1CC[NH+](C)CC1 ZINC000379894871 1166809585 /nfs/dbraw/zinc/80/95/85/1166809585.db2.gz BQFUNVSECOBISQ-WCQYABFASA-N 2 0 210.365 2.106 20 0 BEADRP CCCC[NH2+][C@@H](C)CC[NH+](CC)CC ZINC001255941917 970577765 /nfs/dbraw/zinc/57/77/65/970577765.db2.gz ZLIHBLQLAYTQQZ-LBPRGKRZSA-N 2 0 200.370 2.497 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]C(C)(C)C(C)(C)O ZINC001255953893 970587551 /nfs/dbraw/zinc/58/75/51/970587551.db2.gz QMYWMRCJIPSQGE-LBPRGKRZSA-N 2 0 244.423 2.246 20 0 BEADRP CC(C)=CCC[C@@H](C)[NH2+][C@@H]1C[NH2+]C[C@H]1C ZINC000925786881 1166835855 /nfs/dbraw/zinc/83/58/55/1166835855.db2.gz QIDPAMYBIJQVHF-JHJVBQTASA-N 2 0 210.365 2.319 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[N@H+](CC)CC(C)(C)O ZINC001255968497 970601645 /nfs/dbraw/zinc/60/16/45/970601645.db2.gz ZUPBQIAOFHAHTO-ZDUSSCGKSA-N 2 0 244.423 2.200 20 0 BEADRP CSCC[C@H](C)[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000401025311 970652624 /nfs/dbraw/zinc/65/26/24/970652624.db2.gz NGHNGPMZJSSWRT-UMSGYPCISA-N 2 0 242.432 2.106 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2CCC3(CCCC3)C2)CC[NH2+]1 ZINC000304318479 1166911864 /nfs/dbraw/zinc/91/18/64/1166911864.db2.gz BWBHUZCCDWLWFP-CHWSQXEVSA-N 2 0 222.376 2.393 20 0 BEADRP CCC(CC)[NH+]1CCN(c2cc[nH+]cc2)CC1 ZINC000197109919 1166954063 /nfs/dbraw/zinc/95/40/63/1166954063.db2.gz UQALVBPSAWYXSV-UHFFFAOYSA-N 2 0 233.359 2.392 20 0 BEADRP CC[C@H](C)[N@@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001332425197 975114368 /nfs/dbraw/zinc/11/43/68/975114368.db2.gz XBVLBKQYPGCYJH-LBPRGKRZSA-N 2 0 210.365 2.251 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H]1COC[C@H]1C ZINC000688024899 1167014621 /nfs/dbraw/zinc/01/46/21/1167014621.db2.gz NHDFUYDRZSKKOT-HZSPNIEDSA-N 2 0 242.407 2.121 20 0 BEADRP CCSC[C@@H](C)[NH+]1CCC(C[NH+](C)C)CC1 ZINC001173306853 975209987 /nfs/dbraw/zinc/20/99/87/975209987.db2.gz YYEMBDBWIDTNRG-GFCCVEGCSA-N 2 0 244.448 2.402 20 0 BEADRP C[C@H]([NH2+]CCC1CC[NH+](C)CC1)c1ncco1 ZINC001332843577 975292685 /nfs/dbraw/zinc/29/26/85/975292685.db2.gz LGMODPGJDSTICI-NSHDSACASA-N 2 0 237.347 2.057 20 0 BEADRP C1CCC2(C1)CC[N@@H+]([C@H]1CCC[NH2+]C1)C2 ZINC000308955098 1167227940 /nfs/dbraw/zinc/22/79/40/1167227940.db2.gz YDUWCYWSKGBPRB-LBPRGKRZSA-N 2 0 208.349 2.005 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+][C@@H]1CC[C@@H]2[C@H](C1)C2(F)F ZINC001333599057 975880711 /nfs/dbraw/zinc/88/07/11/975880711.db2.gz VZLRGCYMKFRSRU-ZNSHCXBVSA-N 2 0 244.329 2.150 20 0 BEADRP C[NH+](C)CC1CC[NH+](CC(C)(C)C)CC1 ZINC000350146234 1167433129 /nfs/dbraw/zinc/43/31/29/1167433129.db2.gz KGVZIAMLWUXHEC-UHFFFAOYSA-N 2 0 212.381 2.306 20 0 BEADRP CCC[C@H](C)C[N@@H+]1C[C@@H](C[NH3+])CC[C@@H]1C ZINC000225342397 1167439620 /nfs/dbraw/zinc/43/96/20/1167439620.db2.gz ILTCSGLOPJDUCO-RWMBFGLXSA-N 2 0 212.381 2.482 20 0 BEADRP C[C@@H]1C[N@@H+]([C@H]2CCc3c2cccc3F)CC[C@@H]1[NH3+] ZINC000251617096 1167450260 /nfs/dbraw/zinc/45/02/60/1167450260.db2.gz DTEYCLRRZGABKQ-ONERCXAPSA-N 2 0 248.345 2.482 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]Cc1cc[nH]c1 ZINC000381346602 1167544559 /nfs/dbraw/zinc/54/45/59/1167544559.db2.gz ZGHWQQDRZXGBQN-LBPRGKRZSA-N 2 0 223.364 2.225 20 0 BEADRP C[C@H](CC[NH2+]C[C@@]1(C)CCCS1)[NH+](C)C ZINC000697886548 1167554435 /nfs/dbraw/zinc/55/44/35/1167554435.db2.gz IAPDAYUWPUOLLJ-VXGBXAGGSA-N 2 0 230.421 2.202 20 0 BEADRP C[C@@H](C[NH3+])C[N@H+](C)[C@H]1C[C@H](C)C[C@H](C)C1 ZINC000252098653 1167626448 /nfs/dbraw/zinc/62/64/48/1167626448.db2.gz ICDZGGUMPGGCAR-QNWHQSFQSA-N 2 0 212.381 2.338 20 0 BEADRP CCC(CC)C[N@H+](C)CC1CC[NH2+]CC1 ZINC000086701654 1167640675 /nfs/dbraw/zinc/64/06/75/1167640675.db2.gz JOHDUOGVMXENFZ-UHFFFAOYSA-N 2 0 212.381 2.354 20 0 BEADRP CC[N@@H+](Cc1ccoc1)CC1CC[NH2+]CC1 ZINC000086701780 1167640454 /nfs/dbraw/zinc/64/04/54/1167640454.db2.gz ZZHWDXDPHUEDFU-UHFFFAOYSA-N 2 0 222.332 2.101 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+][C@H]1CCc2cc(F)ccc2C1 ZINC001168419754 1167688286 /nfs/dbraw/zinc/68/82/86/1167688286.db2.gz DQPWXPYBQCYNPI-SOUVJXGZSA-N 2 0 248.345 2.152 20 0 BEADRP CCC1([NH2+]CC2CC[NH+](C)CC2)CCC1 ZINC000229482542 1167772840 /nfs/dbraw/zinc/77/28/40/1167772840.db2.gz BSBZNGASCLDYFL-UHFFFAOYSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@@H]1C[C@@H]([N@@H+]2CCC[C@@H](C)[C@@H]2C)CC[NH2+]1 ZINC000229546108 1167773003 /nfs/dbraw/zinc/77/30/03/1167773003.db2.gz BFFRSWMZRDXURF-NDBYEHHHSA-N 2 0 210.365 2.247 20 0 BEADRP C[C@H]1C[C@H]([NH2+]C[C@H]2CC[N@H+](C)C2)C[C@@H](C)C1 ZINC000252216065 1167774386 /nfs/dbraw/zinc/77/43/86/1167774386.db2.gz ZFMNGLIWODHPBE-RQJABVFESA-N 2 0 224.392 2.352 20 0 BEADRP CO[C@H]1CCC[C@@H]([N@H+](CCC[NH3+])C(C)C)C1 ZINC000069846605 978762693 /nfs/dbraw/zinc/76/26/93/978762693.db2.gz FCPFWIUHKPLWFT-OLZOCXBDSA-N 2 0 228.380 2.003 20 0 BEADRP CCc1cccc(C)c1C[N@H+](C)CCC[NH3+] ZINC001235435124 979047097 /nfs/dbraw/zinc/04/70/97/979047097.db2.gz APMBJXNAAPQJQQ-UHFFFAOYSA-N 2 0 220.360 2.338 20 0 BEADRP CC1(C[N@@H+]2C[C@H]3CC[C@@]3([NH3+])C2)CCCCC1 ZINC001235981994 979261216 /nfs/dbraw/zinc/26/12/16/979261216.db2.gz ZUAJVVIGKRLKEA-TZMCWYRMSA-N 2 0 222.376 2.380 20 0 BEADRP CCC1CCC([N@@H+]2C[C@@H]3CC[NH2+]C[C@H]3C2)CC1 ZINC000310528328 1168239587 /nfs/dbraw/zinc/23/95/87/1168239587.db2.gz NMNBTCYWFBRTIS-GQKFXUNGSA-N 2 0 236.403 2.497 20 0 BEADRP CCC[C@H](C)C[N@H+]1C[C@@H]2CC[NH2+]CC[C@@H]2C1 ZINC001236314457 979526088 /nfs/dbraw/zinc/52/60/88/979526088.db2.gz NGDLGQVBWKUJLC-MELADBBJSA-N 2 0 224.392 2.354 20 0 BEADRP Cc1ccc(N[C@H]2CCCC[C@@H]2[NH+](C)C)[nH+]c1N ZINC001168597211 1168306468 /nfs/dbraw/zinc/30/64/68/1168306468.db2.gz ZEHNBINZNKCWHM-RYUDHWBXSA-N 2 0 248.374 2.257 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCC[N@H+](C)CC1)c1cccnc1 ZINC000086817290 1168311298 /nfs/dbraw/zinc/31/12/98/1168311298.db2.gz CYDDIDRXYKEDOO-TZMCWYRMSA-N 2 0 233.359 2.217 20 0 BEADRP CCC[NH+]1CCC(CC2CC[NH2+]CC2)CC1 ZINC001236951622 979796644 /nfs/dbraw/zinc/79/66/44/979796644.db2.gz YGYZAFUYPHDPFI-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP CC(C)CC[C@H](C)[NH2+]C[C@@H]1CC[N@H+](C)C1 ZINC000037484737 1168418299 /nfs/dbraw/zinc/41/82/99/1168418299.db2.gz ARIUGHDZUNOUIH-STQMWFEESA-N 2 0 212.381 2.352 20 0 BEADRP CC(C)(C)C[N@@H+]1CCC[C@](F)(C[NH3+])CC1 ZINC001205537223 980905019 /nfs/dbraw/zinc/90/50/19/980905019.db2.gz GINDTEBRXHKIIO-GFCCVEGCSA-N 2 0 216.344 2.185 20 0 BEADRP [NH3+]C[C@@]1(F)CCC[N@@H+](C2CCSCC2)CC1 ZINC000257924848 1168586401 /nfs/dbraw/zinc/58/64/01/1168586401.db2.gz BBMRRPPRMRYJCB-GFCCVEGCSA-N 2 0 246.395 2.035 20 0 BEADRP CO[C@H]1CCC[C@@H]([NH2+]C(C)(C)CC[NH+](C)C)C1 ZINC001172921123 1168684221 /nfs/dbraw/zinc/68/42/21/1168684221.db2.gz VBKSLWGMAPDLTC-OLZOCXBDSA-N 2 0 242.407 2.264 20 0 BEADRP CO[C@H]1CCC[C@H]([NH2+]C(C)(C)CC[NH+](C)C)C1 ZINC001172921125 1168684490 /nfs/dbraw/zinc/68/44/90/1168684490.db2.gz VBKSLWGMAPDLTC-STQMWFEESA-N 2 0 242.407 2.264 20 0 BEADRP CCc1nc(C)c(CN2C[C@@H]3C[C@@H]3[C@H](F)C2)[nH]1 ZINC001203236185 1168777358 /nfs/dbraw/zinc/77/73/58/1168777358.db2.gz FHQWPSCUIURSJG-GARJFASQSA-N 2 0 237.322 2.070 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@@H](C)Cc1ccc(F)cc1 ZINC001326035817 982375360 /nfs/dbraw/zinc/37/53/60/982375360.db2.gz BTUAZUIIRJUTHN-RYUDHWBXSA-N 2 0 238.350 2.344 20 0 BEADRP CCC[C@H](C)C[NH+]1CCC2(C[NH+](C)C2)CC1 ZINC001201553978 983309405 /nfs/dbraw/zinc/30/94/05/983309405.db2.gz RNCFYXCJBIRXEI-ZDUSSCGKSA-N 2 0 224.392 2.450 20 0 BEADRP CCC[C@@H](C)C[N@H+]1C[C@H]2C[NH+](CC)C[C@H]2C1 ZINC001201563430 983330311 /nfs/dbraw/zinc/33/03/11/983330311.db2.gz PYCOVVOTZVQWJN-MCIONIFRSA-N 2 0 224.392 2.306 20 0 BEADRP CCc1cc(N[C@@H]2CCCC[C@H]2[NH+](C)C)cc[nH+]1 ZINC001326491155 1169064510 /nfs/dbraw/zinc/06/45/10/1169064510.db2.gz AXOISBUMNZODQJ-HUUCEWRRSA-N 2 0 247.386 2.351 20 0 BEADRP CCCC[NH+](CCCC)CC[C@H]1C[NH2+]CCO1 ZINC000059955213 1169158680 /nfs/dbraw/zinc/15/86/80/1169158680.db2.gz CPFWVTQCXDZPHF-AWEZNQCLSA-N 2 0 242.407 2.267 20 0 BEADRP CCC[C@@H](O)C[NH2+]CCC[N@@H+]1CCCC[C@@H]1C ZINC001252799431 983895309 /nfs/dbraw/zinc/89/53/09/983895309.db2.gz RUVOTADGHHSVMH-UONOGXRCSA-N 2 0 242.407 2.002 20 0 BEADRP CCC[C@H](O)C[NH2+]CCC[N@@H+]1CCCC[C@H]1C ZINC001252799430 983896182 /nfs/dbraw/zinc/89/61/82/983896182.db2.gz RUVOTADGHHSVMH-KGLIPLIRSA-N 2 0 242.407 2.002 20 0 BEADRP C[C@@H](C[C@H]1CCC[NH2+]1)[NH2+][C@@H]1C[C@H]1[C@@H]1C[C@H]1C ZINC001575941028 984136849 /nfs/dbraw/zinc/13/68/49/984136849.db2.gz HKNNBYSPOVQFKS-CLHCLYRXSA-N 2 0 222.376 2.151 20 0 BEADRP C[C@@H](C[C@@H]1CCC[NH2+]1)[NH2+][C@@H]1C[C@H]1[C@@H]1C[C@H]1C ZINC001575941029 984138913 /nfs/dbraw/zinc/13/89/13/984138913.db2.gz HKNNBYSPOVQFKS-GUDWOMEESA-N 2 0 222.376 2.151 20 0 BEADRP CCOCC[C@H](C)[N@H+](CC)C1CCN(C)CC1 ZINC001172426512 974703584 /nfs/dbraw/zinc/70/35/84/974703584.db2.gz YPNSUPVVOCGTHF-ZDUSSCGKSA-N 2 0 242.407 2.218 20 0 BEADRP CC(C)OCC[C@@H](C)[NH2+]CCCC[NH+](C)C ZINC001172429982 974710630 /nfs/dbraw/zinc/71/06/30/974710630.db2.gz BRKOLZJZRNFUPT-CYBMUJFWSA-N 2 0 230.396 2.121 20 0 BEADRP CCOC1CCC([NH2+]CC[C@H](C)[NH+](C)C)CC1 ZINC000691136433 1169290430 /nfs/dbraw/zinc/29/04/30/1169290430.db2.gz IBCFJNIERQBRAW-HSBZDZAISA-N 2 0 242.407 2.264 20 0 BEADRP CC(C)OCC[C@H](C)[NH2+]CC[C@H]1CCC[N@@H+]1C ZINC001172440655 974799180 /nfs/dbraw/zinc/79/91/80/974799180.db2.gz IHOPEHQWXLYPJK-UONOGXRCSA-N 2 0 242.407 2.264 20 0 BEADRP CC(C)OCC[C@@H](C)[NH2+]CC[C@@H]1CCC[N@@H+]1C ZINC001172447474 974809996 /nfs/dbraw/zinc/80/99/96/974809996.db2.gz IHOPEHQWXLYPJK-KGLIPLIRSA-N 2 0 242.407 2.264 20 0 BEADRP CC(C)([NH3+])CNc1cc[nH+]c(C2CC2)c1 ZINC001171195633 972851209 /nfs/dbraw/zinc/85/12/09/972851209.db2.gz YMYHQPWBTQGTSG-UHFFFAOYSA-N 2 0 205.305 2.108 20 0 BEADRP C[C@@]1(C[NH3+])CCCC[N@@H+]([C@H]2CCCSC2)C1 ZINC001246583912 972948504 /nfs/dbraw/zinc/94/85/04/972948504.db2.gz LRGMKILJWLNENE-STQMWFEESA-N 2 0 242.432 2.333 20 0 BEADRP [NH3+]C[C@H]1CCCC[N@H+](C[C@H]2CC=CCC2)C1 ZINC000402202319 970767689 /nfs/dbraw/zinc/76/76/89/970767689.db2.gz FFNWMHXUHCUFJO-UONOGXRCSA-N 2 0 222.376 2.404 20 0 BEADRP C[C@@H](Cc1ccccn1)[NH2+]C(C)(C)C(C)(C)[NH3+] ZINC001256406089 970812055 /nfs/dbraw/zinc/81/20/55/970812055.db2.gz SGHSNAFMLKXLCN-NSHDSACASA-N 2 0 235.375 2.118 20 0 BEADRP CCC[C@H](C)C[N@@H+]1CCC(F)(F)[C@@H](C[NH3+])C1 ZINC000403136477 970884003 /nfs/dbraw/zinc/88/40/03/970884003.db2.gz BWWZNONVSCAWDX-QWRGUYRKSA-N 2 0 234.334 2.339 20 0 BEADRP [NH3+]C[C@@H]1C[N@H+](CC2CCCC2)CCC1(F)F ZINC000403199491 970891839 /nfs/dbraw/zinc/89/18/39/970891839.db2.gz ZFGVHFLDKSCUBY-LLVKDONJSA-N 2 0 232.318 2.093 20 0 BEADRP CC(C)(C)CC[N@@H+]1CCC(F)(F)[C@@H](C[NH3+])C1 ZINC000403181268 970892832 /nfs/dbraw/zinc/89/28/32/970892832.db2.gz RBRZIEFQBIOASZ-JTQLQIEISA-N 2 0 234.334 2.339 20 0 BEADRP CC(C)(C)CC[N@@H+]1CCC(F)(F)[C@H](C[NH3+])C1 ZINC000403181269 970894561 /nfs/dbraw/zinc/89/45/61/970894561.db2.gz RBRZIEFQBIOASZ-SNVBAGLBSA-N 2 0 234.334 2.339 20 0 BEADRP C([NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23)[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000403392291 970929919 /nfs/dbraw/zinc/92/99/19/970929919.db2.gz QPXARSHGXNAMCL-AELAOQJQSA-N 2 0 246.398 2.009 20 0 BEADRP C([NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2)[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000403392307 970928780 /nfs/dbraw/zinc/92/87/80/970928780.db2.gz QPXARSHGXNAMCL-TVOASGPGSA-N 2 0 246.398 2.009 20 0 BEADRP C[NH2+]Cc1cccc(Nc2c[nH+]cn2C)c1F ZINC001216220967 970988497 /nfs/dbraw/zinc/98/84/97/970988497.db2.gz YGJCSLOYPLMHQL-UHFFFAOYSA-N 2 0 234.278 2.022 20 0 BEADRP C[NH2+]Cc1cccc(Nc2c[nH+]c(C)n2C)c1F ZINC001216223236 970995051 /nfs/dbraw/zinc/99/50/51/970995051.db2.gz NPIJYUFTBNTWRT-UHFFFAOYSA-N 2 0 248.305 2.331 20 0 BEADRP F[C@@H]1CC[N@@H+](C2CCN(c3cc[nH+]cc3)CC2)C1 ZINC001256856558 970995566 /nfs/dbraw/zinc/99/55/66/970995566.db2.gz JVOWZIQOWXXCLO-GFCCVEGCSA-N 2 0 249.333 2.094 20 0 BEADRP C[NH2+]Cc1cccc(Nc2c(C)[nH+]cn2C)c1F ZINC001216222155 970996168 /nfs/dbraw/zinc/99/61/68/970996168.db2.gz VLYZFCCOAVUVRE-UHFFFAOYSA-N 2 0 248.305 2.331 20 0 BEADRP CCC1CCC(NC(=[NH2+])SCC[NH3+])CC1 ZINC001256866306 971002259 /nfs/dbraw/zinc/00/22/59/971002259.db2.gz NRNXXHLXHZZOMV-UHFFFAOYSA-N 2 0 229.393 2.171 20 0 BEADRP CC[C@H]1C[N@H+](CCCCCC[NH3+])[C@@H](C)CO1 ZINC000403862639 971072906 /nfs/dbraw/zinc/07/29/06/971072906.db2.gz WJLPSIAEFMPDGK-STQMWFEESA-N 2 0 228.380 2.005 20 0 BEADRP CC[C@H]1C[N@H+](CCCCCC[NH3+])[C@H](C)CO1 ZINC000403862636 971075857 /nfs/dbraw/zinc/07/58/57/971075857.db2.gz WJLPSIAEFMPDGK-OLZOCXBDSA-N 2 0 228.380 2.005 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccccc2C[NH3+])C[C@H](C)O1 ZINC001257078379 971094230 /nfs/dbraw/zinc/09/42/30/971094230.db2.gz JTSIMKHSNBOTJN-JJLQDPRZSA-N 2 0 248.370 2.191 20 0 BEADRP CCN(c1[nH+]ccc2[nH]ccc21)[C@H]1CCC[NH2+]C1 ZINC001158199568 971096694 /nfs/dbraw/zinc/09/66/94/971096694.db2.gz BGJOUDFKISVJDF-NSHDSACASA-N 2 0 244.342 2.141 20 0 BEADRP CC(C)CSCC[NH2+][C@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405209860 971209592 /nfs/dbraw/zinc/20/95/92/971209592.db2.gz CCOAXHPZXYYHES-NEPJUHHUSA-N 2 0 242.432 2.235 20 0 BEADRP CC(C)(C)SCC[NH2+][C@H]1C[C@H]([NH3+])C12CCC2 ZINC000405199784 971209744 /nfs/dbraw/zinc/20/97/44/971209744.db2.gz CGQAGQHMYKJZHW-QWRGUYRKSA-N 2 0 242.432 2.378 20 0 BEADRP CC(C)(C)SCC[NH2+][C@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405199783 971210728 /nfs/dbraw/zinc/21/07/28/971210728.db2.gz CGQAGQHMYKJZHW-MNOVXSKESA-N 2 0 242.432 2.378 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]C[C@H]2CCCCS2)C12CCC2 ZINC000405237643 971212880 /nfs/dbraw/zinc/21/28/80/971212880.db2.gz FTWUESPRIBYKMF-IJLUTSLNSA-N 2 0 240.416 2.132 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]C[C@H]2CC=CCC2)C12CCC2 ZINC000405248123 971220181 /nfs/dbraw/zinc/22/01/81/971220181.db2.gz BISZGXXGXUDMMA-YNEHKIRRSA-N 2 0 220.360 2.202 20 0 BEADRP CS[C@@H]1CC[C@H]([NH2+][C@H]2C[C@@H]([NH3+])C23CCC3)C1 ZINC000405230982 971215072 /nfs/dbraw/zinc/21/50/72/971215072.db2.gz AUUJTZPENWOZMI-QCNOEVLYSA-N 2 0 240.416 2.130 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]C2Cc3ccccc3C2)C12CCC2 ZINC000405238169 971216638 /nfs/dbraw/zinc/21/66/38/971216638.db2.gz GFEBWCCTDGOVFR-GJZGRUSLSA-N 2 0 242.366 2.013 20 0 BEADRP Cc1ccccc1CC[NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405261109 971220911 /nfs/dbraw/zinc/22/09/11/971220911.db2.gz OUNQRHCUZLAVBK-HUUCEWRRSA-N 2 0 244.382 2.397 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]C[C@H]2CC=CCC2)C12CCC2 ZINC000405248122 971222677 /nfs/dbraw/zinc/22/26/77/971222677.db2.gz BISZGXXGXUDMMA-XQQFMLRXSA-N 2 0 220.360 2.202 20 0 BEADRP Cc1cccc(CC[NH2+][C@H]2C[C@H]([NH3+])C23CCC3)c1 ZINC000405277426 971225658 /nfs/dbraw/zinc/22/56/58/971225658.db2.gz XSQZRAUPZPFBKA-GJZGRUSLSA-N 2 0 244.382 2.397 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+]CCc2cccs2)C12CCC2 ZINC000405261659 971228470 /nfs/dbraw/zinc/22/84/70/971228470.db2.gz NLNSWSUMSVFBSK-NWDGAFQWSA-N 2 0 236.384 2.150 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2)C1CCCC1 ZINC000405356465 971240788 /nfs/dbraw/zinc/24/07/88/971240788.db2.gz RHXHTQRWDMFCEP-CYZMBNFOSA-N 2 0 222.376 2.425 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]CC2CCCCC2)C12CCC2 ZINC000405360456 971241028 /nfs/dbraw/zinc/24/10/28/971241028.db2.gz TYTIETDVRBAPEK-OLZOCXBDSA-N 2 0 222.376 2.426 20 0 BEADRP C[C@@H]1CCC[C@@H]1C[NH2+][C@@H]1C[C@H]([NH3+])C12CCC2 ZINC000405366797 971241882 /nfs/dbraw/zinc/24/18/82/971241882.db2.gz WZUUVKMGCVXQTM-FVCCEPFGSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+][C@@H]2C[C@H]([NH3+])C23CCC3)C1 ZINC000405348430 971242675 /nfs/dbraw/zinc/24/26/75/971242675.db2.gz MLUUHVPJTBUJQK-MROQNXINSA-N 2 0 222.376 2.282 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]CCC2CCCC2)C12CCC2 ZINC000405352583 971243022 /nfs/dbraw/zinc/24/30/22/971243022.db2.gz PEASADJSFIVYMN-CHWSQXEVSA-N 2 0 222.376 2.426 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+][C@H]1C[C@H]([NH3+])C12CCC2 ZINC000405516197 971267410 /nfs/dbraw/zinc/26/74/10/971267410.db2.gz UQJLCHUSVDKOIX-DCAQKATOSA-N 2 0 208.349 2.035 20 0 BEADRP CCC(CC)C[NH2+][C@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405465481 971260261 /nfs/dbraw/zinc/26/02/61/971260261.db2.gz JSVJGHXSOKNKQE-NEPJUHHUSA-N 2 0 210.365 2.282 20 0 BEADRP CC1(C[NH2+][C@H]2C[C@H]([NH3+])C23CCC3)CCC1 ZINC000405531747 971262808 /nfs/dbraw/zinc/26/28/08/971262808.db2.gz YICCTNBNAOTAEO-QWRGUYRKSA-N 2 0 208.349 2.036 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405509895 971266402 /nfs/dbraw/zinc/26/64/02/971266402.db2.gz SNJXBVHCCRGBPH-WRWGMCAJSA-N 2 0 208.349 2.035 20 0 BEADRP CC[NH+](CC)CCO[C@H](C)C[NH+](CC)CC ZINC001224927150 974076195 /nfs/dbraw/zinc/07/61/95/974076195.db2.gz DOIFCNQZYCKPFO-CYBMUJFWSA-N 2 0 230.396 2.075 20 0 BEADRP [NH3+]CCCCCCCO[C@@H]1C[NH2+]CCC[C@H]1F ZINC001217772370 971397231 /nfs/dbraw/zinc/39/72/31/971397231.db2.gz BHPIAWFYFXPEPH-CHWSQXEVSA-N 2 0 246.370 2.002 20 0 BEADRP [NH3+]CCCCCCO[C@@H]1CCC[C@]12CC[NH2+]C2 ZINC001217803916 971413307 /nfs/dbraw/zinc/41/33/07/971413307.db2.gz UEQZUHDVAPXRCA-ZIAGYGMSSA-N 2 0 240.391 2.054 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]1OCc1cccc(C[NH3+])c1 ZINC001217875742 971472898 /nfs/dbraw/zinc/47/28/98/971472898.db2.gz DGQMUMULEVUVMV-AWEZNQCLSA-N 2 0 248.370 2.050 20 0 BEADRP C[N@H+](CCC[NH+]1CCCC1)[C@@H]1CCCSC1 ZINC001257676556 971479107 /nfs/dbraw/zinc/47/91/07/971479107.db2.gz DDRKUOCLIKVRAF-CYBMUJFWSA-N 2 0 242.432 2.300 20 0 BEADRP [NH3+]CCCCCCCO[C@H]1C[NH2+]CCC12CC2 ZINC001217914044 971516475 /nfs/dbraw/zinc/51/64/75/971516475.db2.gz PHKPVGBMNNLJSQ-ZDUSSCGKSA-N 2 0 240.391 2.054 20 0 BEADRP CC(C)C[NH+]1CCC([NH2+]C2CC(F)C2)CC1 ZINC001258001438 971552067 /nfs/dbraw/zinc/55/20/67/971552067.db2.gz QMCNWJPFONFSKL-UHFFFAOYSA-N 2 0 228.355 2.197 20 0 BEADRP C[C@H]1C[NH2+]CCC[C@@H]1Oc1ccc2c(c1)C[NH2+]C2 ZINC001217989094 971562808 /nfs/dbraw/zinc/56/28/08/971562808.db2.gz LZCCFBIJPBUDBM-NHYWBVRUSA-N 2 0 246.354 2.057 20 0 BEADRP C[C@@H](Oc1cccc2c1C[NH2+]C2)C1CC[NH2+]CC1 ZINC001218005594 971570100 /nfs/dbraw/zinc/57/01/00/971570100.db2.gz KNOCALRIYYIRRW-LLVKDONJSA-N 2 0 246.354 2.057 20 0 BEADRP C[N@@H+]1CCC[C@H](Oc2cccc(C[NH3+])c2)CC1 ZINC001218211957 971631447 /nfs/dbraw/zinc/63/14/47/971631447.db2.gz NXZKIKOXWULAJD-ZDUSSCGKSA-N 2 0 234.343 2.008 20 0 BEADRP [NH3+]Cc1ccc(OC2CC3(C2)CCC[NH2+]C3)cc1 ZINC001218255268 971651503 /nfs/dbraw/zinc/65/15/03/971651503.db2.gz PXYATRDTWKMLKO-UHFFFAOYSA-N 2 0 246.354 2.056 20 0 BEADRP C[NH+](C)CCC[N@H+](C)[C@H]1C[C@@H]2[C@H](C1)C2(C)C ZINC001170737915 971683096 /nfs/dbraw/zinc/68/30/96/971683096.db2.gz DDWGZZOWHDSLOP-CLLJXQQHSA-N 2 0 224.392 2.305 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]1Oc1cccc2c1C[NH2+]C2 ZINC001218316059 971703755 /nfs/dbraw/zinc/70/37/55/971703755.db2.gz OMDXSYTZIQKTLB-AWEZNQCLSA-N 2 0 246.354 2.057 20 0 BEADRP [NH3+]Cc1cccc(O[C@H]2CC[NH2+]C3(CCC3)C2)c1 ZINC001218309226 971704057 /nfs/dbraw/zinc/70/40/57/971704057.db2.gz MISFVPGKRHRVIP-AWEZNQCLSA-N 2 0 246.354 2.199 20 0 BEADRP C[N@@H+]1CC[C@@]2(CC[NH+]([C@@H]3C[C@@H]4[C@H](C3)C4(C)C)C2)C1 ZINC001170763744 971750244 /nfs/dbraw/zinc/75/02/44/971750244.db2.gz CMBDVZHDGKKAGA-HGTKMLMNSA-N 2 0 248.414 2.449 20 0 BEADRP CC[N@H+]1C[C@@H]2C[NH+]([C@@H]3C[C@@H]4[C@H](C3)C4(C)C)C[C@@H]2C1 ZINC001170768001 971760772 /nfs/dbraw/zinc/76/07/72/971760772.db2.gz VSLFEPQIGTYMHH-CUZDEVPKSA-N 2 0 248.414 2.305 20 0 BEADRP C[C@H]([NH3+])c1ccc(O[C@H]2C[NH2+]CCC23CC3)cc1 ZINC001218408695 971782802 /nfs/dbraw/zinc/78/28/02/971782802.db2.gz LXXLNKGXELNETI-FZMZJTMJSA-N 2 0 246.354 2.227 20 0 BEADRP CC1(C)C[C@@H](Oc2ccc3c(c2)C[NH2+]C3)CC[NH2+]1 ZINC001218473390 971827360 /nfs/dbraw/zinc/82/73/60/971827360.db2.gz YDNNKUMAMUACQE-AWEZNQCLSA-N 2 0 246.354 2.199 20 0 BEADRP CC[C@@H](C)OCC[C@@H](C)[N@@H+]1CCC[C@H]1CN ZINC001172323267 974532446 /nfs/dbraw/zinc/53/24/46/974532446.db2.gz BPAHRCAQOGYXJF-UPJWGTAASA-N 2 0 228.380 2.003 20 0 BEADRP CC(C)[N@H+]([C@H]1COC(C)(C)C1)C(C)(C)C[NH3+] ZINC001172279524 974539694 /nfs/dbraw/zinc/53/96/94/974539694.db2.gz IFICCONDLHSNRU-LLVKDONJSA-N 2 0 228.380 2.002 20 0 BEADRP C[C@H]1CC[N@@H+]1Cc1cc(F)cc(C[NH+](C)C)c1 ZINC001232145041 1169682544 /nfs/dbraw/zinc/68/25/44/1169682544.db2.gz SLVFXMCDMHIPFX-NSHDSACASA-N 2 0 236.334 2.482 20 0 BEADRP CC[C@H](C)OCC[C@@H](C)[N@H+](C)CCC[NH+](C)C ZINC001172334377 974598588 /nfs/dbraw/zinc/59/85/88/974598588.db2.gz BPBPMQHVHDIOQW-KGLIPLIRSA-N 2 0 244.423 2.464 20 0 BEADRP COc1ccccc1C[N@@H+]1CCCC[C@H](C[NH3+])C1 ZINC000311002589 971990536 /nfs/dbraw/zinc/99/05/36/971990536.db2.gz IQFIFEVQOFPCKT-CYBMUJFWSA-N 2 0 248.370 2.256 20 0 BEADRP C[C@@H]([NH3+])CCNc1cc[nH+]c(C2CC2)c1 ZINC001170890804 972042526 /nfs/dbraw/zinc/04/25/26/972042526.db2.gz PVYCTMYUIGEJQK-SECBINFHSA-N 2 0 205.305 2.108 20 0 BEADRP [NH3+]CCC[C@H]([NH3+])Nc1cccc2c1CCCC2 ZINC001170900434 972066359 /nfs/dbraw/zinc/06/63/59/972066359.db2.gz UCBOHPYHESHRGY-CQSZACIVSA-N 2 0 233.359 2.001 20 0 BEADRP Cc1ccc(Cl)c(C)c1N[C@@H]([NH3+])CCC[NH3+] ZINC001170902516 972077908 /nfs/dbraw/zinc/07/79/08/972077908.db2.gz FJURYPLHLZUUHU-LLVKDONJSA-N 2 0 241.766 2.392 20 0 BEADRP CC[C@@H]1CC[C@H]([NH2+]CC2([NH3+])CCCC2)C1 ZINC001246076649 972127961 /nfs/dbraw/zinc/12/79/61/972127961.db2.gz QVTDODDFJIPRHR-NEPJUHHUSA-N 2 0 210.365 2.426 20 0 BEADRP [NH3+]CCCC[NH2+][C@H]1CCc2cccc(F)c2C1 ZINC001170957266 972155445 /nfs/dbraw/zinc/15/54/45/972155445.db2.gz NATMNNFCOXBLDQ-LBPRGKRZSA-N 2 0 236.334 2.012 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H](C[NH2+][C@H]2C[C@@H]3[C@H](C2)C3(C)C)C1 ZINC001246101304 972157387 /nfs/dbraw/zinc/15/73/87/972157387.db2.gz PKAMFRCNDRSEBJ-VJTDZRGJSA-N 2 0 236.403 2.256 20 0 BEADRP CC[C@@H]1CC[C@H]([NH2+]C[C@H]2C[NH2+]C[C@H](C)C2)C1 ZINC001246103870 972163534 /nfs/dbraw/zinc/16/35/34/972163534.db2.gz TZLCKVBNRJGOLZ-SYQHCUMBSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1[NH2+]CCC[C@H]1C[NH2+][C@@H]1C[C@@H]2[C@H](C1)C2(C)C ZINC001246112005 972176644 /nfs/dbraw/zinc/17/66/44/972176644.db2.gz QEZLZMJXUPUWBL-HTVCTNPSSA-N 2 0 236.403 2.399 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@H]2[C@@H]3C[C@H]2C[NH2+]C3)CC(C)(C)C1 ZINC001246145938 972193918 /nfs/dbraw/zinc/19/39/18/972193918.db2.gz GFYFXSDTJBDMMA-RGDJUOJXSA-N 2 0 236.403 2.399 20 0 BEADRP Cc1ccccc1OCC[NH2+][C@@H]1CC[NH2+][C@H](C)C1 ZINC001246168279 972202740 /nfs/dbraw/zinc/20/27/40/972202740.db2.gz JMJWXITZQOXZOE-ZIAGYGMSSA-N 2 0 248.370 2.104 20 0 BEADRP C(C[N@@H+]1C[C@H]2CC[C@@H]1C2)C[NH+]1CCCCC1 ZINC000193477996 972226067 /nfs/dbraw/zinc/22/60/67/972226067.db2.gz ZGWFTVVAKNYVMF-UONOGXRCSA-N 2 0 222.376 2.347 20 0 BEADRP Cc1c(F)cccc1C[NH2+][C@@H]1CC[NH2+][C@H](C)C1 ZINC001246228301 972233167 /nfs/dbraw/zinc/23/31/67/972233167.db2.gz XALGBHYKEIYBOR-ZWNOBZJWSA-N 2 0 236.334 2.364 20 0 BEADRP c1cc2cc(C[NH2+][C@H]3CCC[NH2+]CC3)ccc2[nH]1 ZINC001246232728 972237338 /nfs/dbraw/zinc/23/73/38/972237338.db2.gz ZCJRLVXZGYPYRO-AWEZNQCLSA-N 2 0 243.354 2.400 20 0 BEADRP C[C@H]1CCCC[N@H+](C[C@H]2CCC[NH+](C)C2)C1 ZINC001208607286 957095304 /nfs/dbraw/zinc/09/53/04/957095304.db2.gz LHZBQFMSYMRETG-KBPBESRZSA-N 2 0 224.392 2.450 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH+]2CCC[C@H](C(F)F)C2)C1 ZINC001208612795 957099007 /nfs/dbraw/zinc/09/90/07/957099007.db2.gz NZDJGQOJYFIZRE-RYUDHWBXSA-N 2 0 246.345 2.305 20 0 BEADRP C[NH+](C)CCC[N@H+](C)CCC1CCCC1 ZINC001208690896 957128937 /nfs/dbraw/zinc/12/89/37/957128937.db2.gz YCGRMNIUSFPRRC-UHFFFAOYSA-N 2 0 212.381 2.450 20 0 BEADRP Cc1c[nH+]ccc1N1CC[NH+](C[C@H]2C[C@H]2C)CC1 ZINC001209429315 957452248 /nfs/dbraw/zinc/45/22/48/957452248.db2.gz WJXYCNAGTDYTIF-TZMCWYRMSA-N 2 0 245.370 2.168 20 0 BEADRP Cc1c[nH+]ccc1N1CC[NH+](C[C@@H]2C[C@H]2C)CC1 ZINC001209429314 957453563 /nfs/dbraw/zinc/45/35/63/957453563.db2.gz WJXYCNAGTDYTIF-OCCSQVGLSA-N 2 0 245.370 2.168 20 0 BEADRP Cc1c[nH+]ccc1N1CC[NH+](C[C@H]2C[C@@H]2C)CC1 ZINC001209429310 957455369 /nfs/dbraw/zinc/45/53/69/957455369.db2.gz WJXYCNAGTDYTIF-GXTWGEPZSA-N 2 0 245.370 2.168 20 0 BEADRP CCCC[C@@H]1C[C@@H](NCC[C@@H]([NH3+])CC)CC[NH2+]1 ZINC001246308892 972271655 /nfs/dbraw/zinc/27/16/55/972271655.db2.gz SXJYMRBJMWSILC-MJBXVCDLSA-N 2 0 241.423 2.014 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@@H]1Cc2cccc(Cl)c2C1 ZINC001246316275 972278492 /nfs/dbraw/zinc/27/84/92/972278492.db2.gz YRMROBHFATUPOR-WDEREUQCSA-N 2 0 238.762 2.134 20 0 BEADRP C[N@@H+]1CC[C@H](Nc2ccc(C3([NH3+])CCC3)cc2)C1 ZINC001167278196 957625080 /nfs/dbraw/zinc/62/50/80/957625080.db2.gz BFGOTFKQLCWYNS-AWEZNQCLSA-N 2 0 245.370 2.141 20 0 BEADRP CO[C@@H](C[N@H+](C)CCCCCC[NH3+])C1CCC1 ZINC000692247780 957646661 /nfs/dbraw/zinc/64/66/61/957646661.db2.gz DQGOOSZVDMRNCZ-AWEZNQCLSA-N 2 0 242.407 2.252 20 0 BEADRP C[C@H]1CCN(Cc2ccc3c(c2)CCC3)CC[NH2+]1 ZINC001210476943 957764833 /nfs/dbraw/zinc/76/48/33/957764833.db2.gz ZGUHZWLYXZVNFR-ZDUSSCGKSA-N 2 0 244.382 2.359 20 0 BEADRP Cc1ccc(C[C@H](C)[NH2+]C[C@H]([NH3+])C(C)C)cc1 ZINC001246333506 972295904 /nfs/dbraw/zinc/29/59/04/972295904.db2.gz RABNKXOZUHFBTK-ZFWWWQNUSA-N 2 0 234.387 2.499 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]Cc2ccc3ocnc3c2)CC[NH2+]1 ZINC001246332466 972296561 /nfs/dbraw/zinc/29/65/61/972296561.db2.gz MGBPVLOFNZLYOK-ZYHUDNBSSA-N 2 0 245.326 2.058 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@]23C[C@H]2CCCC3)CC1 ZINC000693211589 957926066 /nfs/dbraw/zinc/92/60/66/957926066.db2.gz IAYFRWRQBOKXAB-ZIAGYGMSSA-N 2 0 222.376 2.251 20 0 BEADRP CC1(C)CCC[C@@H]([NH2+][C@H]2C[C@@](C)([NH3+])C2)C1 ZINC001246466009 972341029 /nfs/dbraw/zinc/34/10/29/972341029.db2.gz UTQVHDDLLZGIFM-WZRBSPASSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCc3sccc32)CC[NH2+]1 ZINC001246475197 972347423 /nfs/dbraw/zinc/34/74/23/972347423.db2.gz SLSPOPSQMMRRHO-JFGNBEQYSA-N 2 0 236.384 2.466 20 0 BEADRP C[C@H]1CC[C@@H](N(C)CCc2cccs2)C[NH2+]1 ZINC000398983359 958471607 /nfs/dbraw/zinc/47/16/07/958471607.db2.gz GZQPIKSYMXATID-NWDGAFQWSA-N 2 0 238.400 2.363 20 0 BEADRP C[C@H]1C[C@H]([N@@H+]2CCC23CCCC3)CC[NH2+]1 ZINC000707627661 958635381 /nfs/dbraw/zinc/63/53/81/958635381.db2.gz RRRVYQWPEYYIDB-NWDGAFQWSA-N 2 0 208.349 2.145 20 0 BEADRP C(C1CC[NH2+]CC1)[N@@H+]1CCC12CCCC2 ZINC000707642309 958645279 /nfs/dbraw/zinc/64/52/79/958645279.db2.gz SDRGPDXRGJFFSX-UHFFFAOYSA-N 2 0 208.349 2.005 20 0 BEADRP C1CC2(CCCCC2)[N@@H+]1[C@H]1CCC[NH2+]C1 ZINC000707663842 958657839 /nfs/dbraw/zinc/65/78/39/958657839.db2.gz XWYVEYQQTVJFGR-LBPRGKRZSA-N 2 0 208.349 2.147 20 0 BEADRP C(C1CC[NH2+]CC1)[N@@H+]1CCC12CCCCC2 ZINC000707663545 958659697 /nfs/dbraw/zinc/65/96/97/958659697.db2.gz VUUUHVURWPLNBO-UHFFFAOYSA-N 2 0 222.376 2.395 20 0 BEADRP CSCC[C@@H](C)[NH2+]CC[C@H]1CCC[N@@H+]1C ZINC000707909438 958812811 /nfs/dbraw/zinc/81/28/11/958812811.db2.gz HXMJSQJESRDPSZ-VXGBXAGGSA-N 2 0 230.421 2.202 20 0 BEADRP CC(C)CC[N@H+](C[C@H]1C[C@@H]([NH3+])C1)C1CC1 ZINC000693569381 958865036 /nfs/dbraw/zinc/86/50/36/958865036.db2.gz QGDQUBZPIRXSAJ-TXEJJXNPSA-N 2 0 210.365 2.234 20 0 BEADRP CCC1(CC)CC[N@H+](C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000693579904 958870294 /nfs/dbraw/zinc/87/02/94/958870294.db2.gz QOZXZZVKNIFPQX-TXEJJXNPSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@@H]1C[N@H+](C[C@H]2C[C@@H]([NH3+])C2)CCc2ccccc21 ZINC000693618760 959008769 /nfs/dbraw/zinc/00/87/69/959008769.db2.gz ZCYFLKMHBQSRBB-NFAWXSAZSA-N 2 0 244.382 2.386 20 0 BEADRP Cc1cc(F)ccc1C[N@@H+]1CC[C@H](CC[NH3+])C1 ZINC000690744620 959205694 /nfs/dbraw/zinc/20/56/94/959205694.db2.gz YPPMGYSAEXLXCL-LBPRGKRZSA-N 2 0 236.334 2.305 20 0 BEADRP COC(C)(C)CC[N@@H+]1CCC[C@@]12CCC[NH2+]C2 ZINC001222236884 972417808 /nfs/dbraw/zinc/41/78/08/972417808.db2.gz CMZOMXREEGATKU-CQSZACIVSA-N 2 0 240.391 2.020 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@H+](C)[C@@H]1CCC[C@H](C)C1 ZINC000300357225 959377189 /nfs/dbraw/zinc/37/71/89/959377189.db2.gz WFQNINHMWRBAKM-RFQIPJPRSA-N 2 0 224.392 2.352 20 0 BEADRP CC1(C[NH2+][C@@H]2C[C@@H]([NH3+])C23CCC3)CCCC1 ZINC000405355453 959446217 /nfs/dbraw/zinc/44/62/17/959446217.db2.gz QPTHUUZGNDDXMB-VXGBXAGGSA-N 2 0 222.376 2.426 20 0 BEADRP CCC[C@H](C)C[N@@H+]1CCCC[C@H](C[NH3+])C1 ZINC000308799152 959502304 /nfs/dbraw/zinc/50/23/04/959502304.db2.gz DFKZPGBYUUELOQ-QWHCGFSZSA-N 2 0 212.381 2.483 20 0 BEADRP C[NH+](C)C1CCC([NH2+]C2CC=CC2)CC1 ZINC000309031396 959559941 /nfs/dbraw/zinc/55/99/41/959559941.db2.gz DZZCHOIACRZSHU-UHFFFAOYSA-N 2 0 208.349 2.167 20 0 BEADRP CC1=C[C@@H](C)[C@H](C[NH+]2CC3(C2)CC[NH2+]C3)CC1 ZINC001222379691 972449618 /nfs/dbraw/zinc/44/96/18/972449618.db2.gz IKIFXQLGKVSDDW-KGLIPLIRSA-N 2 0 234.387 2.274 20 0 BEADRP CCCOC1CCC([N@@H+]2CC[C@](C)([NH3+])C2)CC1 ZINC001246532210 972450719 /nfs/dbraw/zinc/45/07/19/972450719.db2.gz VXIUUERCORYOMS-RUXDESIVSA-N 2 0 240.391 2.147 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2CCC[C@@H](C(F)F)C2)CC1 ZINC001207398238 959716252 /nfs/dbraw/zinc/71/62/52/959716252.db2.gz BNPPZTDICSYQGL-GFCCVEGCSA-N 2 0 246.345 2.305 20 0 BEADRP C[C@@H]1C[C@H]1C[N@@H+]1CCC[C@]2(CCCC[NH2+]2)C1 ZINC001222384809 972451400 /nfs/dbraw/zinc/45/14/00/972451400.db2.gz AALPXTKBUHDCHN-HZSPNIEDSA-N 2 0 222.376 2.251 20 0 BEADRP C([NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23)[C@H]1CCC[C@H]2C[C@H]21 ZINC000694274861 959816424 /nfs/dbraw/zinc/81/64/24/959816424.db2.gz ALPUVLITTNPRFG-FVEFAZKQSA-N 2 0 246.398 2.009 20 0 BEADRP CCCC(CCC)[N@@H+]1C[C@H](C)[C@H](C[NH3+])C1 ZINC000708862419 959986591 /nfs/dbraw/zinc/98/65/91/959986591.db2.gz GLEZRHOSVTUNAS-NWDGAFQWSA-N 2 0 212.381 2.482 20 0 BEADRP C1=C[C@@H]2C[C@H]1C[C@@H]2C[N@@H+]1CC[C@@]2(C1)CCCC[NH2+]2 ZINC001222422489 972471896 /nfs/dbraw/zinc/47/18/96/972471896.db2.gz VBLWAPXEEVNXIA-ZJIFWQFVSA-N 2 0 246.398 2.417 20 0 BEADRP C[C@H]([NH3+])c1ccc(O[C@@H]2CC[NH2+]C[C@H]2C)cc1 ZINC001218418807 960077502 /nfs/dbraw/zinc/07/75/02/960077502.db2.gz WSFOWHCEAHSYDY-UHIISALHSA-N 2 0 234.343 2.083 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](C)C2(Cl)CC2)C1 ZINC000695635918 960310942 /nfs/dbraw/zinc/31/09/42/960310942.db2.gz DVDWPICQYNDOAZ-VXGBXAGGSA-N 2 0 244.810 2.468 20 0 BEADRP [NH3+]C1(C[NH2+]CC2CCC3(CC3)CC2)CCC1 ZINC000695624623 960311902 /nfs/dbraw/zinc/31/19/02/960311902.db2.gz IWQYAJZZALTPRD-UHFFFAOYSA-N 2 0 222.376 2.428 20 0 BEADRP C1CC12CCC[C@H]([NH2+][C@H]1[C@@H]3[NH2+]C[C@H]4C[C@H]1C[C@H]34)C2 ZINC000695700214 960382869 /nfs/dbraw/zinc/38/28/69/960382869.db2.gz MFUYDCITWRGZLE-PMKSJIGOSA-N 2 0 246.398 2.295 20 0 BEADRP C[NH2+]C[C@H]1CC[N@H+](CC2CCC3(CC3)CC2)C1 ZINC000695717252 960400090 /nfs/dbraw/zinc/40/00/90/960400090.db2.gz IJSRBIPCVWANGJ-CQSZACIVSA-N 2 0 236.403 2.498 20 0 BEADRP C[NH+]1CCC2(CC1)CC[NH+](Cc1cc[nH]c1)CC2 ZINC001140708003 960524406 /nfs/dbraw/zinc/52/44/06/960524406.db2.gz MCFZXQCNTOFLJZ-UHFFFAOYSA-N 2 0 247.386 2.323 20 0 BEADRP C[C@H]([NH2+]CCCC[NH3+])c1ccc2c(c1)CCO2 ZINC000037715530 960616403 /nfs/dbraw/zinc/61/64/03/960616403.db2.gz FYXQCSJHQYXHOQ-NSHDSACASA-N 2 0 234.343 2.011 20 0 BEADRP CC(C)(C)CC[NH+]1CCC(F)(C[NH3+])CC1 ZINC001222528514 972520620 /nfs/dbraw/zinc/52/06/20/972520620.db2.gz WWYFILMCJTUWIN-UHFFFAOYSA-N 2 0 216.344 2.185 20 0 BEADRP [NH2+]=CNc1cc[nH+]c(N2CCCCC2)c1 ZINC001167869142 961369375 /nfs/dbraw/zinc/36/93/75/961369375.db2.gz SUFRMSQNNDWOAE-UHFFFAOYSA-N 2 0 204.277 2.091 20 0 BEADRP C[NH+](C)CCC(C)(C)[NH2+][C@@H]1C[C@H]2C[C@H]2C1 ZINC001167905465 961741507 /nfs/dbraw/zinc/74/15/07/961741507.db2.gz NADKVBYNZSUCCA-ZSBIGDGJSA-N 2 0 210.365 2.105 20 0 BEADRP C[NH+](C)[C@@H]1CCC[C@H]([NH2+][C@H]2C[C@H]3C[C@H]3C2)C1 ZINC001167914956 961839379 /nfs/dbraw/zinc/83/93/79/961839379.db2.gz ZDKLQCZROABFFU-MEBFFEOJSA-N 2 0 222.376 2.247 20 0 BEADRP CC[C@H](C)CC[NH2+][C@H]1C[C@@H]([NH3+])C12CCC2 ZINC000696212237 961868752 /nfs/dbraw/zinc/86/87/52/961868752.db2.gz BMQQRORQNITNLN-TUAOUCFPSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1CC[C@H]([NH+]2CCN(c3cc[nH+]cc3)CC2)C1 ZINC000092874346 961898175 /nfs/dbraw/zinc/89/81/75/961898175.db2.gz HMADQCBECSBUIZ-HIFRSBDPSA-N 2 0 245.370 2.392 20 0 BEADRP C[NH+](C)[C@H]1CC[C@H]([NH2+][C@H]2C[C@H]3C[C@H]3C2)CC1 ZINC001167918472 961909766 /nfs/dbraw/zinc/90/97/66/961909766.db2.gz UQMFDFXIMDBYII-RVOPOGNISA-N 2 0 222.376 2.247 20 0 BEADRP Cc1ccc(C[N@@H+]2CCCC[C@@H](C[NH3+])C2)c(C)n1 ZINC001206631880 962122396 /nfs/dbraw/zinc/12/23/96/962122396.db2.gz BWVPQMKGLSCCGO-AWEZNQCLSA-N 2 0 247.386 2.259 20 0 BEADRP Cc1ccc(C[N@@H+]2CCCC[C@H](C[NH3+])C2)cc1O ZINC001206632249 962127516 /nfs/dbraw/zinc/12/75/16/962127516.db2.gz HOCBAWZMAFLBKG-CQSZACIVSA-N 2 0 248.370 2.261 20 0 BEADRP Cc1cc(C[N@@H+]2CCCC[C@H](C[NH3+])C2)cc(C)n1 ZINC001206632865 962143391 /nfs/dbraw/zinc/14/33/91/962143391.db2.gz PJJSYOFMUBBCGL-CQSZACIVSA-N 2 0 247.386 2.259 20 0 BEADRP [NH3+]C[C@H]1CCCC[N@H+](CC2OC=CC2=S)C1 ZINC001206641184 962284818 /nfs/dbraw/zinc/28/48/18/962284818.db2.gz UCYLJTGPYDWPPX-SNVBAGLBSA-N 2 0 240.372 2.129 20 0 BEADRP CC[C@@H]1CCC[N@@H+]1C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000710790648 962473006 /nfs/dbraw/zinc/47/30/06/962473006.db2.gz FIWKPMFMTPGKME-DAAZQVBGSA-N 2 0 208.349 2.144 20 0 BEADRP c1cc2c(s1)C[N@H+](C1C[C@H]3CC[C@@H](C1)[NH2+]3)CC2 ZINC000711801336 962770436 /nfs/dbraw/zinc/77/04/36/962770436.db2.gz KOYRDIBZKUTMJL-FUNVUKJBSA-N 2 0 248.395 2.389 20 0 BEADRP Cc1cc(C)[nH+]c(NC[C@H]2C[NH2+][C@H](C)C2)c1 ZINC001155095995 962974382 /nfs/dbraw/zinc/97/43/82/962974382.db2.gz WKFGADSWBSAYGK-ZYHUDNBSSA-N 2 0 219.332 2.108 20 0 BEADRP Cc1c[nH+]c(N(CCC[NH3+])C(C)C)cc1C ZINC001156123771 963262670 /nfs/dbraw/zinc/26/26/70/963262670.db2.gz ARXFXFNLWIKXNA-UHFFFAOYSA-N 2 0 221.348 2.262 20 0 BEADRP C[C@@H]1C[N@H+](C[C@H]2CCC(F)(F)C2)CC[C@@H]1C[NH3+] ZINC000302389067 963365535 /nfs/dbraw/zinc/36/55/35/963365535.db2.gz IZSJTNIPULOJFQ-GRYCIOLGSA-N 2 0 246.345 2.339 20 0 BEADRP C[C@@H]1C[N@H+](C[C@H]2CCC(F)(F)C2)CC[C@H]1C[NH3+] ZINC000302389073 963365626 /nfs/dbraw/zinc/36/56/26/963365626.db2.gz IZSJTNIPULOJFQ-WOPDTQHZSA-N 2 0 246.345 2.339 20 0 BEADRP CN(c1cc2[nH]ccc2c[nH+]1)[C@]1(C)CCC[NH2+]C1 ZINC001156955282 963500197 /nfs/dbraw/zinc/50/01/97/963500197.db2.gz HTTZUJFNGAKFOF-CQSZACIVSA-N 2 0 244.342 2.141 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCCCCCC[NH3+])CCO1 ZINC001168086370 963655106 /nfs/dbraw/zinc/65/51/06/963655106.db2.gz FKANKVNNUOTNMX-CHWSQXEVSA-N 2 0 228.380 2.053 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCCCCCC[NH3+])CCO1 ZINC001168086372 963656727 /nfs/dbraw/zinc/65/67/27/963656727.db2.gz FKANKVNNUOTNMX-OLZOCXBDSA-N 2 0 228.380 2.053 20 0 BEADRP CC[C@H](C)C[N@H+](C)C[C@H]1CCCC[NH2+]C1 ZINC000697043920 963668817 /nfs/dbraw/zinc/66/88/17/963668817.db2.gz XPIYHECUAPIJEY-STQMWFEESA-N 2 0 212.381 2.354 20 0 BEADRP CC[C@H](C)C[N@H+](C)C[C@@H]1CCCC[NH2+]C1 ZINC000697043916 963669226 /nfs/dbraw/zinc/66/92/26/963669226.db2.gz XPIYHECUAPIJEY-QWHCGFSZSA-N 2 0 212.381 2.354 20 0 BEADRP CCC1(Nc2cc3[nH]ccc3c(C)[nH+]2)C[NH2+]C1 ZINC001157784509 963725820 /nfs/dbraw/zinc/72/58/20/963725820.db2.gz FARPHHURSYTFCR-UHFFFAOYSA-N 2 0 230.315 2.035 20 0 BEADRP Cc1[nH+]c(NCC[C@H]2CCC[NH2+]2)cc2[nH]ccc21 ZINC001158626765 963894916 /nfs/dbraw/zinc/89/49/16/963894916.db2.gz ALHVAJRPXJLBHV-LLVKDONJSA-N 2 0 244.342 2.425 20 0 BEADRP Cc1cc2[nH+]ccn2cc1NC1(C)CC[NH2+]CC1 ZINC001168186092 963943150 /nfs/dbraw/zinc/94/31/50/963943150.db2.gz RNEKZTSCIZNIKZ-UHFFFAOYSA-N 2 0 244.342 2.197 20 0 BEADRP C(=CC1CC[NH2+]CC1)Nc1cccc2c1C[NH2+]C2 ZINC001159767175 964186994 /nfs/dbraw/zinc/18/69/94/964186994.db2.gz MUUMANVDGOILDB-RMKNXTFCSA-N 2 0 243.354 2.215 20 0 BEADRP c1cc2c(cc[nH+]c2NC[C@@H]2CCCC[NH2+]2)[nH]1 ZINC001160146023 964259238 /nfs/dbraw/zinc/25/92/38/964259238.db2.gz YIEYCAFXGBNYHI-JTQLQIEISA-N 2 0 230.315 2.117 20 0 BEADRP Nc1cc[nH+]c(-n2ccc3cccc(C[NH3+])c32)c1 ZINC001160454335 964303290 /nfs/dbraw/zinc/30/32/90/964303290.db2.gz XDIZZJQEXDMJPG-UHFFFAOYSA-N 2 0 238.294 2.066 20 0 BEADRP Cc1[nH]c2ccc(NC3C[NH+](C(C)C)C3)cc2[nH+]1 ZINC001168315625 964421013 /nfs/dbraw/zinc/42/10/13/964421013.db2.gz UCBZFNBWBWQZEP-UHFFFAOYSA-N 2 0 244.342 2.376 20 0 BEADRP Cc1c2[nH+]c[nH]c2ccc1NC1C[NH+](C(C)C)C1 ZINC001168315427 964425291 /nfs/dbraw/zinc/42/52/91/964425291.db2.gz OGZQOCCQJIHPGB-UHFFFAOYSA-N 2 0 244.342 2.376 20 0 BEADRP C[NH+](C)C1CCC([N@@H+]2CCC[C@@H]2CF)CC1 ZINC001168330279 964465355 /nfs/dbraw/zinc/46/53/55/964465355.db2.gz ONOBEJLIUZAPKU-WXRRBKDZSA-N 2 0 228.355 2.293 20 0 BEADRP C[C@@H](CC[NH2+][C@@H]1CCC[C@@H]2C[C@@H]21)[NH+](C)C ZINC000697869831 964595002 /nfs/dbraw/zinc/59/50/02/964595002.db2.gz IXSHDOMEIHBGTQ-QNWHQSFQSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@@H](CC[NH2+]CCC(C)(C)C)[NH+](C)C ZINC000697870465 964595828 /nfs/dbraw/zinc/59/58/28/964595828.db2.gz LOBOEMVOVBBKPZ-NSHDSACASA-N 2 0 200.370 2.352 20 0 BEADRP CCC[C@@H](C)C[NH2+]CC[C@H](C)[NH+](C)C ZINC000697871971 964599441 /nfs/dbraw/zinc/59/94/41/964599441.db2.gz QGNXHFGYLYAAOF-NEPJUHHUSA-N 2 0 200.370 2.352 20 0 BEADRP [NH3+]CCc1cccn1C1CC[NH+](CC2CC2)CC1 ZINC001168363015 964655224 /nfs/dbraw/zinc/65/52/24/964655224.db2.gz QBFBSPUXLZKKNQ-UHFFFAOYSA-N 2 0 247.386 2.036 20 0 BEADRP C[NH+](C)CCNc1ccc([C@H]2CCC[NH2+]2)cc1 ZINC001161669099 964676555 /nfs/dbraw/zinc/67/65/55/964676555.db2.gz YNXYMISGWLGSGK-CQSZACIVSA-N 2 0 233.359 2.085 20 0 BEADRP Cc1cc(N(C)C)[nH+]cc1N[C@@H]1CCC[C@H]([NH3+])C1 ZINC001162395721 964955194 /nfs/dbraw/zinc/95/51/94/964955194.db2.gz FPZLABDDCJFFIS-NWDGAFQWSA-N 2 0 248.374 2.138 20 0 BEADRP CCc1cccc(N[C@H]2CCC[C@@H]([NH3+])C2)n1 ZINC001162401569 964959154 /nfs/dbraw/zinc/95/91/54/964959154.db2.gz LHQUZCDXSJRTCJ-PWSUYJOCSA-N 2 0 219.332 2.326 20 0 BEADRP [NH3+][C@@H]1CCC[C@H](Nc2cccn3c[nH+]cc23)C1 ZINC001162404468 964961825 /nfs/dbraw/zinc/96/18/25/964961825.db2.gz MVTXCIDELWVRIS-MNOVXSKESA-N 2 0 230.315 2.016 20 0 BEADRP Cc1cc(NC[C@H]2CCC[NH2+]C[C@@H]2C)cc(C)[nH+]1 ZINC001162457464 964983781 /nfs/dbraw/zinc/98/37/81/964983781.db2.gz PHOYEQQGDFQTMT-SMDDNHRTSA-N 2 0 247.386 2.168 20 0 BEADRP C[C@@H]1C[C@@H](CNc2cccc3c2CC[C@@H]3[NH3+])C[NH2+]1 ZINC001162559959 965051594 /nfs/dbraw/zinc/05/15/94/965051594.db2.gz URYLXUZEMGMHQK-GYSYKLTISA-N 2 0 245.370 2.043 20 0 BEADRP C[C@@H]1C[C@@H](CNc2cc[nH+]c(C3CC3)c2)C[NH2+]1 ZINC001162559362 965052435 /nfs/dbraw/zinc/05/24/35/965052435.db2.gz MUQOWWWFDQHVLD-GHMZBOCLSA-N 2 0 231.343 2.369 20 0 BEADRP Cc1c2[nH+]c[nH]c2ccc1N[C@@H]1CC[NH2+][C@@H]1C ZINC001162678129 965108480 /nfs/dbraw/zinc/10/84/80/965108480.db2.gz XJXKYUPQPBJCMY-MWLCHTKSSA-N 2 0 230.315 2.034 20 0 BEADRP [NH3+][C@H]1Cc2ccccc2N(c2cc[nH+]cc2)C1 ZINC001162841656 965191162 /nfs/dbraw/zinc/19/11/62/965191162.db2.gz LGQYHPOIVASWJW-LBPRGKRZSA-N 2 0 225.295 2.103 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@@H]1CCCC[C@H]1C1CC1 ZINC000696000835 965209193 /nfs/dbraw/zinc/20/91/93/965209193.db2.gz GHDGUOSKLJLVPF-UQOMUDLDSA-N 2 0 236.403 2.400 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@H]1CCCC[C@@H]1C1CC1 ZINC000696000821 965209366 /nfs/dbraw/zinc/20/93/66/965209366.db2.gz GHDGUOSKLJLVPF-BEAPCOKYSA-N 2 0 236.403 2.400 20 0 BEADRP CC(C)[N@@H+]1CC[C@@H](Nc2cc(N)cc[nH+]2)[C@H](C)C1 ZINC001163356961 965362203 /nfs/dbraw/zinc/36/22/03/965362203.db2.gz HQBRJADVCVMUEN-DGCLKSJQSA-N 2 0 248.374 2.195 20 0 BEADRP Cc1ccc(N[C@H](C)C[NH+](C)C)c(C[NH+](C)C)c1 ZINC001163785024 965590458 /nfs/dbraw/zinc/59/04/58/965590458.db2.gz ABLFFGWYFNVFTP-CYBMUJFWSA-N 2 0 249.402 2.419 20 0 BEADRP COc1cc(C)ccc1C[N@@H+]1CCC[C@H]([NH3+])CC1 ZINC001205094826 965731919 /nfs/dbraw/zinc/73/19/19/965731919.db2.gz QWQHJNNUGYBZJH-AWEZNQCLSA-N 2 0 248.370 2.317 20 0 BEADRP Cc1cc(O)cc(C)c1C[N@@H+]1CCC[C@H]([NH3+])CC1 ZINC001205102895 965805024 /nfs/dbraw/zinc/80/50/24/965805024.db2.gz VUSDNDJPJBRPOZ-ZDUSSCGKSA-N 2 0 248.370 2.322 20 0 BEADRP COc1ccc(C[N@@H+]2CCC[C@@H]([NH3+])CC2)c(C)c1 ZINC001205109696 965827724 /nfs/dbraw/zinc/82/77/24/965827724.db2.gz JLCMMIJMZAXLED-CQSZACIVSA-N 2 0 248.370 2.317 20 0 BEADRP Cc1cc(F)ccc1C[N@@H+]1CCC[C@@H]([NH3+])CC1 ZINC001205109544 965828690 /nfs/dbraw/zinc/82/86/90/965828690.db2.gz ICJIRGOMRKLWBL-CQSZACIVSA-N 2 0 236.334 2.447 20 0 BEADRP C([NH2+][C@H]1CCC[C@@H]2C[C@@H]21)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000699284098 965830293 /nfs/dbraw/zinc/83/02/93/965830293.db2.gz XMEPWQASRMEQCA-UGIFPKBASA-N 2 0 234.387 2.295 20 0 BEADRP Cc1cnc(C[N@@H+]2CCC[C@H]([NH3+])CC2)c(C)c1 ZINC001205124583 965896221 /nfs/dbraw/zinc/89/62/21/965896221.db2.gz VYLVMVWRHGEFDV-ZDUSSCGKSA-N 2 0 233.359 2.012 20 0 BEADRP C[N@H+](CCCCCC[NH3+])Cc1cncs1 ZINC000400364807 965948256 /nfs/dbraw/zinc/94/82/56/965948256.db2.gz PINFLLLRSWICMF-UHFFFAOYSA-N 2 0 227.377 2.094 20 0 BEADRP Cc1c[nH+]c(N2CC[C@]3(C2)CCC[NH2+]C3)cc1C ZINC001165244576 966008331 /nfs/dbraw/zinc/00/83/31/966008331.db2.gz SIVIRWCHDHATCH-OAHLLOKOSA-N 2 0 245.370 2.278 20 0 BEADRP c1ncc(C[NH+]2CCC([C@@H]3CCCC[NH2+]3)CC2)o1 ZINC001235230230 966032590 /nfs/dbraw/zinc/03/25/90/966032590.db2.gz TWHAKBSLCBGRIX-AWEZNQCLSA-N 2 0 249.358 2.029 20 0 BEADRP [NH3+][C@]12CC[C@H]1CN(CCCc1ccccc1F)C2 ZINC001235980511 966197716 /nfs/dbraw/zinc/19/77/16/966197716.db2.gz PSCGMKQKIQVFFI-ZFWWWQNUSA-N 2 0 248.345 2.181 20 0 BEADRP CC1=C[C@H](C)[C@H](C[N@H+]2CC[C@@H]([NH3+])[C@H]2C)CC1 ZINC001205171109 966203665 /nfs/dbraw/zinc/20/36/65/966203665.db2.gz KRNPMNNURRBRGZ-RFQIPJPRSA-N 2 0 222.376 2.400 20 0 BEADRP C[NH+]1CCC2(C[NH+](Cc3cccs3)C2)CC1 ZINC001204018316 966856233 /nfs/dbraw/zinc/85/62/33/966856233.db2.gz MFMYOVHQUSMWNA-UHFFFAOYSA-N 2 0 236.384 2.276 20 0 BEADRP CC(C)[C@@H]1CCC[N@@H+]1C[C@]1(C)CCC[NH2+]C1 ZINC000084127031 966929777 /nfs/dbraw/zinc/92/97/77/966929777.db2.gz IWKCFUXWOQMEID-UONOGXRCSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH+](C)C1CCC([NH2+]C[Si](C)(C)C)CC1 ZINC000715507449 966939474 /nfs/dbraw/zinc/93/94/74/966939474.db2.gz GWRNXUYYZOLXHQ-UHFFFAOYSA-N 2 0 228.456 2.326 20 0 BEADRP C[NH+](C)Cc1ccccc1-c1c[nH+]ccc1N ZINC001239681140 967075607 /nfs/dbraw/zinc/07/56/07/967075607.db2.gz ABMOTMWCWNGSBP-UHFFFAOYSA-N 2 0 227.311 2.223 20 0 BEADRP C[NH+](C)Cc1ccc(-c2ccc(C[NH3+])nc2)cc1 ZINC001204632112 967107162 /nfs/dbraw/zinc/10/71/62/967107162.db2.gz SSBFNVBQJBBNTM-UHFFFAOYSA-N 2 0 241.338 2.269 20 0 BEADRP CC(C)(C)[NH2+]Cc1ccc(-n2c[nH+]cc2N)cc1 ZINC001204684557 967129809 /nfs/dbraw/zinc/12/98/09/967129809.db2.gz ULJHAEOEAODOFU-UHFFFAOYSA-N 2 0 244.342 2.343 20 0 BEADRP C1=C(c2cc(N3CC[NH2+]CC3)cc[nH+]2)CCC1 ZINC001239787876 967179914 /nfs/dbraw/zinc/17/99/14/967179914.db2.gz BTEIOSXQKJHKLD-UHFFFAOYSA-N 2 0 229.327 2.059 20 0 BEADRP C[C@H]1CC[C@@H](C[NH3+])N1Cc1ccc2c(c1)CCC2 ZINC001205064068 967315681 /nfs/dbraw/zinc/31/56/81/967315681.db2.gz GGRAXHDBYMQCOP-LRDDRELGSA-N 2 0 244.382 2.487 20 0 BEADRP [NH3+][C@@H]1CCC[N@H+](Cc2ccc3c(c2)COC3)CC1 ZINC001205102933 967345913 /nfs/dbraw/zinc/34/59/13/967345913.db2.gz WRKWLVGPWNHADN-OAHLLOKOSA-N 2 0 246.354 2.030 20 0 BEADRP CNc1ccc(C[N@@H+]2CCC[C@H]([NH3+])CC2)cc1 ZINC001205123426 967369810 /nfs/dbraw/zinc/36/98/10/967369810.db2.gz AWNFMWWQLQLMPC-ZDUSSCGKSA-N 2 0 233.359 2.042 20 0 BEADRP [NH3+][C@@H]1CCC[N@H+](Cc2cccc3c2CCC3)CC1 ZINC001205131366 967376725 /nfs/dbraw/zinc/37/67/25/967376725.db2.gz WCCATBLSPLFULH-OAHLLOKOSA-N 2 0 244.382 2.489 20 0 BEADRP COc1cc(C)ccc1C[N@@H+]1C[C@H](C)[C@H](C[NH3+])C1 ZINC001205136081 967382876 /nfs/dbraw/zinc/38/28/76/967382876.db2.gz LVISNLAECUVBRZ-GXTWGEPZSA-N 2 0 248.370 2.030 20 0 BEADRP C[C@H]1C[N@H+](Cc2cc3ccccc3[nH]2)C[C@H]1C[NH3+] ZINC001205135912 967384762 /nfs/dbraw/zinc/38/47/62/967384762.db2.gz GBPQPJUJZOSZRY-WCQYABFASA-N 2 0 243.354 2.195 20 0 BEADRP C[C@H]1C[N@H+](Cc2ccc3[nH]ccc3c2)C[C@H]1C[NH3+] ZINC001205136334 967385158 /nfs/dbraw/zinc/38/51/58/967385158.db2.gz ZXEQBPCNTMMUHJ-SMDDNHRTSA-N 2 0 243.354 2.195 20 0 BEADRP COc1cccc(C)c1C[N@@H+]1C[C@H](C)[C@H](C[NH3+])C1 ZINC001205145863 967387487 /nfs/dbraw/zinc/38/74/87/967387487.db2.gz KTZBRQKMXLZXCO-QWHCGFSZSA-N 2 0 248.370 2.030 20 0 BEADRP Cc1cc(O)cc(C)c1C[N@H+]1C[C@H](C)[C@H](C[NH3+])C1 ZINC001205140137 967389478 /nfs/dbraw/zinc/38/94/78/967389478.db2.gz ANSWKYYPFMBQKM-QWHCGFSZSA-N 2 0 248.370 2.036 20 0 BEADRP C[C@]1([NH3+])CCC[N@H+](CC2CCSCC2)CC1 ZINC001205255441 967446683 /nfs/dbraw/zinc/44/66/83/967446683.db2.gz IYPXSZXBYFTKJF-ZDUSSCGKSA-N 2 0 242.432 2.333 20 0 BEADRP C[C@]1([NH3+])CCC[N@H+](CCCc2ccncc2)CC1 ZINC001205257522 967447305 /nfs/dbraw/zinc/44/73/05/967447305.db2.gz WFUIILQEJSQIHB-HNNXBMFYSA-N 2 0 247.386 2.218 20 0 BEADRP C[C@]1([NH3+])CCC[N@H+](CCc2cccs2)CC1 ZINC001205256610 967447956 /nfs/dbraw/zinc/44/79/56/967447956.db2.gz QBKMDZRIPSONPX-ZDUSSCGKSA-N 2 0 238.400 2.494 20 0 BEADRP CC/C=C\CC[N@@H+]1CCC[C@@](F)(C[NH3+])CC1 ZINC001205545680 967691730 /nfs/dbraw/zinc/69/17/30/967691730.db2.gz LRAUEKCSKLRDFR-SCOBNMCVSA-N 2 0 228.355 2.496 20 0 BEADRP Cc1[nH+]cn(C)c1Nc1ccc2c[nH+]cn2c1 ZINC001250330214 967715006 /nfs/dbraw/zinc/71/50/06/967715006.db2.gz SSTYCESFOINJBW-UHFFFAOYSA-N 2 0 227.271 2.120 20 0 BEADRP Cc1ncccc1C[N@H+]1CC[C@@H](C)[C@H](C[NH3+])CC1 ZINC001205618428 967727482 /nfs/dbraw/zinc/72/74/82/967727482.db2.gz VWFXTYUPXJKEDL-OCCSQVGLSA-N 2 0 247.386 2.197 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@@H](C)[C@@H](C[NH3+])CC2)[nH]1 ZINC001205618227 967730075 /nfs/dbraw/zinc/73/00/75/967730075.db2.gz SVGJCILYBLAVRH-DGCLKSJQSA-N 2 0 235.375 2.130 20 0 BEADRP Cc1ccc2c(c1)[nH+]ccc2-n1cnc(C[NH3+])c1 ZINC001162304734 967800717 /nfs/dbraw/zinc/80/07/17/967800717.db2.gz RKPVBQQRTMGBSF-UHFFFAOYSA-N 2 0 238.294 2.188 20 0 BEADRP CC/C=C\CC[N@@H+]1CCC(F)(F)[C@@H](C[NH3+])C1 ZINC001205735943 967809160 /nfs/dbraw/zinc/80/91/60/967809160.db2.gz SCXXNWBHHJOBKP-BYCRGOAPSA-N 2 0 232.318 2.259 20 0 BEADRP Cc1cc[nH+]c(N[C@H]2CCC[C@H]([NH3+])C2)c1C ZINC001162390942 967822690 /nfs/dbraw/zinc/82/26/90/967822690.db2.gz KCNYTORFAPBCGN-RYUDHWBXSA-N 2 0 219.332 2.380 20 0 BEADRP CS[C@H](C)CC[N@@H+]1CCC[C@@H](C[NH3+])[C@H](C)C1 ZINC001205981710 967901298 /nfs/dbraw/zinc/90/12/98/967901298.db2.gz FWRPTWBQSGLAHA-UPJWGTAASA-N 2 0 244.448 2.435 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCC[C@H](C[NH3+])[C@@H](C)C1 ZINC001205981471 967926786 /nfs/dbraw/zinc/92/67/86/967926786.db2.gz DHSOUPLQCVPADU-RWMBFGLXSA-N 2 0 212.381 2.339 20 0 BEADRP Cc1cncc(C[N@@H+]2CCC[C@H](C[NH3+])[C@@H](C)C2)c1 ZINC001205993507 967948092 /nfs/dbraw/zinc/94/80/92/967948092.db2.gz HZDXHXGFXVERKA-DZGCQCFKSA-N 2 0 247.386 2.197 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@H](C[NH3+])[C@H](C)C2)[nH]1 ZINC001205995475 967953609 /nfs/dbraw/zinc/95/36/09/967953609.db2.gz OIPQBBFNQYVEDB-DGCLKSJQSA-N 2 0 235.375 2.130 20 0 BEADRP Cc1c[nH]c(C[N@@H+]2CCC[C@H](C[NH3+])[C@H](C)C2)c1C ZINC001206004361 967963057 /nfs/dbraw/zinc/96/30/57/967963057.db2.gz RWSGPBFJRVLWJX-TZMCWYRMSA-N 2 0 249.402 2.438 20 0 BEADRP C[N@H+](CCOCC[NH3+])C1CCCCCCC1 ZINC000699527394 968086376 /nfs/dbraw/zinc/08/63/76/968086376.db2.gz HUABSAFCWDMMKG-UHFFFAOYSA-N 2 0 228.380 2.006 20 0 BEADRP CC[NH+]1CCC(C[NH+]2CC(C)(CC)C2)CC1 ZINC001206194289 968124568 /nfs/dbraw/zinc/12/45/68/968124568.db2.gz CQODWGCNNOUJPW-UHFFFAOYSA-N 2 0 224.392 2.450 20 0 BEADRP CC(C)C[C@@H](C)[NH2+]CC[C@@H](C)[NH+](C)C ZINC000697869430 968143186 /nfs/dbraw/zinc/14/31/86/968143186.db2.gz GXOSROIGSOJFEE-VXGBXAGGSA-N 2 0 200.370 2.351 20 0 BEADRP Cc1ccc(CN2CCC[NH2+]C[C@@H]2C)cc1C ZINC001206257290 968176954 /nfs/dbraw/zinc/17/69/54/968176954.db2.gz AGPDXEHZXGNJII-AWEZNQCLSA-N 2 0 232.371 2.487 20 0 BEADRP C[C@@H]1C[C@H]1C[N@@H+]1CCC[C@@](C)(C[NH3+])CC1 ZINC001206295305 968199954 /nfs/dbraw/zinc/19/99/54/968199954.db2.gz MKAHFTZPPDOLCF-FRRDWIJNSA-N 2 0 210.365 2.093 20 0 BEADRP Cc1ccc2c(c1)[nH+]ccc2N1CC[C@@H]([NH3+])C1 ZINC001164287316 968213852 /nfs/dbraw/zinc/21/38/52/968213852.db2.gz FYVBMKZJADFGNQ-LLVKDONJSA-N 2 0 227.311 2.081 20 0 BEADRP COC(C)(C)CC[N@@H+]1CCCC[C@@](C)(C[NH3+])C1 ZINC001206542085 968366253 /nfs/dbraw/zinc/36/62/53/968366253.db2.gz QZBFUMDVKPSBGJ-AWEZNQCLSA-N 2 0 242.407 2.252 20 0 BEADRP C[C@@]1(C[NH3+])CCCC[N@H+](Cc2ccc(O)cc2)C1 ZINC001206540132 968369603 /nfs/dbraw/zinc/36/96/03/968369603.db2.gz AKRXVNURBVSSSO-HNNXBMFYSA-N 2 0 248.370 2.343 20 0 BEADRP Cc1cc(C[N@@H+]2CCCC[C@@](C)(C[NH3+])C2)ccn1 ZINC001206550221 968375579 /nfs/dbraw/zinc/37/55/79/968375579.db2.gz XVGNZZWQMLDTJC-HNNXBMFYSA-N 2 0 247.386 2.341 20 0 BEADRP Cc1ccc(C[N@@H+]2CCCC[C@](C)(C[NH3+])C2)cn1 ZINC001206555985 968381099 /nfs/dbraw/zinc/38/10/99/968381099.db2.gz LMEOVODWTCRCMC-OAHLLOKOSA-N 2 0 247.386 2.341 20 0 BEADRP C[C@@]1(C[NH3+])CCCC[N@H+](Cc2ccccc2N)C1 ZINC001206575771 968393696 /nfs/dbraw/zinc/39/36/96/968393696.db2.gz YFNHFENTEPPMKS-HNNXBMFYSA-N 2 0 247.386 2.220 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+][C@@H]1CCC[C@H](F)C1 ZINC001119699099 968458873 /nfs/dbraw/zinc/45/88/73/968458873.db2.gz JBCFMADWUFBSHC-ZCENKTDUSA-N 2 0 240.366 2.373 20 0 BEADRP C[C@H]1CC[C@H]([N@H+](C)C2CCC([NH3+])CC2)C1 ZINC000085869182 968506242 /nfs/dbraw/zinc/50/62/42/968506242.db2.gz GLRZLXGJJPLQRQ-WTIISPKJSA-N 2 0 210.365 2.377 20 0 BEADRP C[NH+](C)CC(C)(C)C[NH+]1C[C@@H]2CCC[C@H]2C1 ZINC001207275245 968706675 /nfs/dbraw/zinc/70/66/75/968706675.db2.gz LELPIYTYORAEMQ-STQMWFEESA-N 2 0 224.392 2.306 20 0 BEADRP C[C@@H]1C[N@H+](CC(C)(C)C[NH+](C)C)C2(CC2)C1 ZINC001207288287 968715601 /nfs/dbraw/zinc/71/56/01/968715601.db2.gz MXLHNWUUZHPEEF-LBPRGKRZSA-N 2 0 224.392 2.449 20 0 BEADRP C[C@@H]1CCC[N@H+](CC2CC[NH2+]CC2)C[C@@H]1C ZINC001207437008 968767606 /nfs/dbraw/zinc/76/76/06/968767606.db2.gz ZNZVGPDXXGLBPT-OLZOCXBDSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H]1CCC[N@H+](CC2CC[NH2+]CC2)C[C@H]1C ZINC001207437007 968770835 /nfs/dbraw/zinc/77/08/35/968770835.db2.gz ZNZVGPDXXGLBPT-CHWSQXEVSA-N 2 0 224.392 2.354 20 0 BEADRP C[NH+]1CCC(CC[NH+]2CCC(F)CC2)CC1 ZINC001207479261 968792883 /nfs/dbraw/zinc/79/28/83/968792883.db2.gz DUVSCDNJCMOHRV-UHFFFAOYSA-N 2 0 228.355 2.152 20 0 BEADRP C[NH+]1CCC(CC[N@@H+]2C[C@H]3CC[C@@H]2C3)CC1 ZINC001207486005 968797826 /nfs/dbraw/zinc/79/78/26/968797826.db2.gz AQHRKQXHOLYTJN-UONOGXRCSA-N 2 0 222.376 2.203 20 0 BEADRP C[NH+]1CCC(CC[N@@H+]2C[C@@H]3CCC[C@@H]3C2)CC1 ZINC001207480199 968799615 /nfs/dbraw/zinc/79/96/15/968799615.db2.gz WUBAJAZFTHGDKS-GASCZTMLSA-N 2 0 236.403 2.450 20 0 BEADRP CC1(C)CCC[N@H+](C[C@@H]2CCCC[NH2+]C2)C1 ZINC000829276673 968829998 /nfs/dbraw/zinc/82/99/98/968829998.db2.gz WSGWTXHCGSLCCI-CYBMUJFWSA-N 2 0 224.392 2.498 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H](Nc2cc3[nH]ccc3c[nH+]2)C1 ZINC001154978353 968832341 /nfs/dbraw/zinc/83/23/41/968832341.db2.gz RILGWHWCORXFIX-GHMZBOCLSA-N 2 0 230.315 2.245 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@H]([NH2+]CC3(C)CCCC3)[C@H]2C1 ZINC001207843941 968899469 /nfs/dbraw/zinc/89/94/69/968899469.db2.gz JBODQXVWOWPHTJ-IHRRRGAJSA-N 2 0 236.403 2.497 20 0 BEADRP C[N@H+]1CC=C(c2cccc3c2CC[NH2+]C3)CC1 ZINC001241322860 968972013 /nfs/dbraw/zinc/97/20/13/968972013.db2.gz UIDDWDJIPNOUTQ-UHFFFAOYSA-N 2 0 228.339 2.051 20 0 BEADRP C[C@H]1CCC[N@@H+]1CC1(C)CC[NH+](C)CC1 ZINC001208102989 969000695 /nfs/dbraw/zinc/00/06/95/969000695.db2.gz JCQUORITNTZYQW-LBPRGKRZSA-N 2 0 210.365 2.203 20 0 BEADRP CC1CC([N@H+](C)CC2(C)CC[NH+](C)CC2)C1 ZINC001208106388 969002292 /nfs/dbraw/zinc/00/22/92/969002292.db2.gz DWTVSMPWQDYFHP-UHFFFAOYSA-N 2 0 224.392 2.449 20 0 BEADRP C[NH+]1CCC(C)(C[N@@H+]2C[C@@H]3C[C@H]2C[C@@H]3F)CC1 ZINC001208110085 969005988 /nfs/dbraw/zinc/00/59/88/969005988.db2.gz WOTQTKLWJTTWSV-AVGNSLFASA-N 2 0 240.366 2.151 20 0 BEADRP C[NH+]1CCC(C)(C[N@@H+]2C[C@@H]3C[C@@H]3[C@H](F)C2)CC1 ZINC001208110434 969008155 /nfs/dbraw/zinc/00/81/55/969008155.db2.gz RSPORCQFCDEAGD-RWMBFGLXSA-N 2 0 240.366 2.008 20 0 BEADRP CC[C@@H](C)[N@H+](C)CC1(C)CC[NH+](C)CC1 ZINC001208110578 969010438 /nfs/dbraw/zinc/01/04/38/969010438.db2.gz WFOYGZHMJOAEEC-GFCCVEGCSA-N 2 0 212.381 2.449 20 0 BEADRP CS[C@H](C)CC[N@H+](C)CCC[NH+](C)C ZINC001208136721 969043209 /nfs/dbraw/zinc/04/32/09/969043209.db2.gz CLOOSCBZDZFIPJ-LLVKDONJSA-N 2 0 218.410 2.012 20 0 BEADRP C[C@H]([NH3+])c1ccc(C2=CCC[N@H+](C)C2)cc1 ZINC001241570394 969060126 /nfs/dbraw/zinc/06/01/26/969060126.db2.gz JGWDBADCMCTEQJ-NSHDSACASA-N 2 0 216.328 2.425 20 0 BEADRP CS[C@H](C)CC[NH+]1CCC([NH+](C)C)CC1 ZINC001208140777 969062837 /nfs/dbraw/zinc/06/28/37/969062837.db2.gz VPASACQRRGDYEA-LLVKDONJSA-N 2 0 230.421 2.154 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2cccn2C2CC2)C1 ZINC001324424296 969079079 /nfs/dbraw/zinc/07/90/79/969079079.db2.gz JKDLCIUCHIRGIZ-ZDUSSCGKSA-N 2 0 247.386 2.254 20 0 BEADRP [NH3+]Cc1ccc(-c2ccc3c(c2)C[NH2+]C3)cc1 ZINC001241913976 969143429 /nfs/dbraw/zinc/14/34/29/969143429.db2.gz XUPANTBTLFBKAA-UHFFFAOYSA-N 2 0 224.307 2.416 20 0 BEADRP CCC1CC[NH+](C[C@@H]2CCC[N@H+](C)C2)CC1 ZINC001208608207 969148245 /nfs/dbraw/zinc/14/82/45/969148245.db2.gz RZJPWTZJOZBNDH-CQSZACIVSA-N 2 0 224.392 2.450 20 0 BEADRP CCC(CC)[N@H+](CC)C[C@H](O)C[NH2+]C(C)(C)C ZINC001253395025 969153830 /nfs/dbraw/zinc/15/38/30/969153830.db2.gz YBDHDYZBDASNJB-CYBMUJFWSA-N 2 0 244.423 2.246 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2C[C@@H]3C[C@H]2C[C@@H]3F)CC1 ZINC001208600978 969158911 /nfs/dbraw/zinc/15/89/11/969158911.db2.gz ILVCRDHPZJGQDP-IHRRRGAJSA-N 2 0 240.366 2.151 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH+]2C[C@@H]3CCCC[C@H]3C2)C1 ZINC001208608722 969163385 /nfs/dbraw/zinc/16/33/85/969163385.db2.gz WJGJKNNQKBKVAA-KKUMJFAQSA-N 2 0 236.403 2.450 20 0 BEADRP CC/C=C\CC[NH+]1CC2(C1)CC[NH+](C)CC2 ZINC001208729763 969218387 /nfs/dbraw/zinc/21/83/87/969218387.db2.gz JGLRJULJGHOCRF-PLNGDYQASA-N 2 0 222.376 2.370 20 0 BEADRP Cc1cnccc1C[N@@H+]1CCC[C@H](C[NH3+])[C@H](C)C1 ZINC001205995735 969262320 /nfs/dbraw/zinc/26/23/20/969262320.db2.gz PSICHOYFJPVYRV-ZIAGYGMSSA-N 2 0 247.386 2.197 20 0 BEADRP CC[N@H+](C[C@@H]1CCC=CO1)C1CCN(C)CC1 ZINC001208880131 969272633 /nfs/dbraw/zinc/27/26/33/969272633.db2.gz IVVMIGWXTDOWPJ-AWEZNQCLSA-N 2 0 238.375 2.095 20 0 BEADRP CC1C[NH+](C[C@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC001208946520 969312053 /nfs/dbraw/zinc/31/20/53/969312053.db2.gz HSGMGKVWQJZALZ-INIZCTEOSA-N 2 0 244.382 2.460 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]CC1CC(F)(F)C1)C2 ZINC001169092833 969385705 /nfs/dbraw/zinc/38/57/05/969385705.db2.gz CTYZVGAQJSZEOA-ZSBIGDGJSA-N 2 0 244.329 2.247 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+][C@H]1CC[C@@H](F)CC1)C2 ZINC001169079663 969399462 /nfs/dbraw/zinc/39/94/62/969399462.db2.gz KIRXHLZLGCJSQN-RVOPOGNISA-N 2 0 240.366 2.482 20 0 BEADRP CCCCC[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169081027 969403000 /nfs/dbraw/zinc/40/30/00/969403000.db2.gz PGPQZTMZWGGYQT-CLLJXQQHSA-N 2 0 210.365 2.391 20 0 BEADRP CC(C)[C@H](C)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169080947 969403238 /nfs/dbraw/zinc/40/32/38/969403238.db2.gz NYAKOTKWVZUILG-ZDEQEGDKSA-N 2 0 210.365 2.246 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]CC(C)(C)C)C2 ZINC001169081733 969404749 /nfs/dbraw/zinc/40/47/49/969404749.db2.gz VNILNLNNHYLYEX-CNDDSTCGSA-N 2 0 210.365 2.247 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]C1CCSCC1)C2 ZINC001169092213 969411922 /nfs/dbraw/zinc/41/19/22/969411922.db2.gz ZYBXHPOQEWPRAR-XYYAHUGASA-N 2 0 240.416 2.097 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+][C@@H]1C[C@@H]3CC[C@H]1C3)C2 ZINC001169119562 969414727 /nfs/dbraw/zinc/41/47/27/969414727.db2.gz UMDBHGFOFYKMFD-ZAQNNHEOSA-N 2 0 234.387 2.390 20 0 BEADRP CCCC[N@H+](C)[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169123378 969420182 /nfs/dbraw/zinc/42/01/82/969420182.db2.gz KKASQUFGLFUGLX-ITGUQSILSA-N 2 0 210.365 2.344 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CCC[C@H](F)CC1)C2 ZINC001169124920 969424123 /nfs/dbraw/zinc/42/41/23/969424123.db2.gz HDTROSXKIQMMOY-IGQOVBAYSA-N 2 0 240.366 2.436 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CCC(F)CC1)C2 ZINC001169126243 969433142 /nfs/dbraw/zinc/43/31/42/969433142.db2.gz QNUIMNGMSDQKSB-CLLJXQQHSA-N 2 0 226.339 2.046 20 0 BEADRP CC[C@@H](C)[N@H+](C)[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169130910 969437356 /nfs/dbraw/zinc/43/73/56/969437356.db2.gz PWAGAJCAABTMGH-NDBYEHHHSA-N 2 0 210.365 2.342 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CCC(C)(C)C1)C2 ZINC001169139378 969450220 /nfs/dbraw/zinc/45/02/20/969450220.db2.gz BNKRUECPPNNYTB-CLLJXQQHSA-N 2 0 222.376 2.344 20 0 BEADRP CN1[C@@H]2CC[C@H]1C[C@H]([N@H+](C)C(C)(C)C)C2 ZINC001169141824 969457951 /nfs/dbraw/zinc/45/79/51/969457951.db2.gz YBFSFECCXNSBCN-ZSBIGDGJSA-N 2 0 210.365 2.342 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1C[C@@H]3[C@H](C1)C3(C)C)C2 ZINC001169148804 969464688 /nfs/dbraw/zinc/46/46/88/969464688.db2.gz ZYEKXHQZHWDBHH-KYGRNUTJSA-N 2 0 234.387 2.199 20 0 BEADRP [NH3+]CCC[C@@H]1CCCC[N@@H+]([C@@H]2CCCOC2)C1 ZINC001254376268 969590774 /nfs/dbraw/zinc/59/07/74/969590774.db2.gz WSHQLFDGDASRQL-UONOGXRCSA-N 2 0 240.391 2.006 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH2+]CCc2cccc(O)c2)CC1 ZINC001254499327 969660307 /nfs/dbraw/zinc/66/03/07/969660307.db2.gz CSTFWHRAVDGQSD-AWEZNQCLSA-N 2 0 248.370 2.009 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH2+][C@@H]2C[C@H]3CC[C@@H]2C3)CC1 ZINC001254502596 969667534 /nfs/dbraw/zinc/66/75/34/969667534.db2.gz GSRQPTMSBXOFLW-RFQIPJPRSA-N 2 0 222.376 2.249 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH2+]CCc2ccccc2O)CC1 ZINC001254506021 969674965 /nfs/dbraw/zinc/67/49/65/969674965.db2.gz NOMATPGOACHDRN-CQSZACIVSA-N 2 0 248.370 2.009 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH+]2Cc3ccccc3C2)CC1 ZINC001254517287 969697809 /nfs/dbraw/zinc/69/78/09/969697809.db2.gz UAKUVHOZBPAMSB-OAHLLOKOSA-N 2 0 230.355 2.487 20 0 BEADRP C[N@H+](CC(C)(C)C)[C@H]1CCC[NH+](C)CC1 ZINC001254523687 969713416 /nfs/dbraw/zinc/71/34/16/969713416.db2.gz QVTYGWSSWCFDPA-LBPRGKRZSA-N 2 0 212.381 2.449 20 0 BEADRP C[NH2+]Cc1cccc(N[C@@H]2CCC[N@H+](C)CC2)c1 ZINC001254526998 969717499 /nfs/dbraw/zinc/71/74/99/969717499.db2.gz VJLRYGQSVZKQPM-CQSZACIVSA-N 2 0 247.386 2.302 20 0 BEADRP C1[NH+]([C@@H]2CC3CCN(CC3)C2)CC12CCCC2 ZINC001254855280 969807438 /nfs/dbraw/zinc/80/74/38/969807438.db2.gz MJLWFZJYFWJJSV-CQSZACIVSA-N 2 0 234.387 2.347 20 0 BEADRP Cc1ccc(-n2ccc(C[NH3+])c2)c(C[NH+](C)C)c1 ZINC001169726439 969819928 /nfs/dbraw/zinc/81/99/28/969819928.db2.gz XVUUJUKZEXDTCN-UHFFFAOYSA-N 2 0 243.354 2.306 20 0 BEADRP Cc1ccc(NC(C)(C)CC[NH+](C)C)[nH+]c1N ZINC001169716534 969830363 /nfs/dbraw/zinc/83/03/63/969830363.db2.gz ULYFHFVXCBTGCY-UHFFFAOYSA-N 2 0 236.363 2.114 20 0 BEADRP C[NH+](C)CCC(C)(C)Nc1cccn2c[nH+]cc12 ZINC001169718161 969832548 /nfs/dbraw/zinc/83/25/48/969832548.db2.gz RWQGMMBEAVOSPK-UHFFFAOYSA-N 2 0 246.358 2.477 20 0 BEADRP [NH3+]CCC[C@H]1CCCC[N@@H+](C2CCOCC2)C1 ZINC001255038247 969860180 /nfs/dbraw/zinc/86/01/80/969860180.db2.gz IRPMVIWHGYXELM-CYBMUJFWSA-N 2 0 240.391 2.006 20 0 BEADRP Cc1cc(NCC23CC[NH+](CC2)CC3)cc(C)[nH+]1 ZINC001169795633 969861496 /nfs/dbraw/zinc/86/14/96/969861496.db2.gz ARBNDKOOKMZNRP-UHFFFAOYSA-N 2 0 245.370 2.018 20 0 BEADRP CCC[N@H+](CCC[NH+](C)C)Cc1cc[nH]c1 ZINC000290492830 969884163 /nfs/dbraw/zinc/88/41/63/969884163.db2.gz ORUMJYHPSORNJV-UHFFFAOYSA-N 2 0 223.364 2.178 20 0 BEADRP Cc1ccc(N(C)C(C)(C)C[NH3+])c(C[NH+](C)C)c1 ZINC001170060889 970120912 /nfs/dbraw/zinc/12/09/12/970120912.db2.gz WHJIWUNHCBNXRU-UHFFFAOYSA-N 2 0 249.402 2.230 20 0 BEADRP C[NH2+]Cc1ccc(Nc2c[nH+]c(C)n2C)cc1 ZINC001211130533 970159429 /nfs/dbraw/zinc/15/94/29/970159429.db2.gz PZFJAJDSQFNEEE-UHFFFAOYSA-N 2 0 230.315 2.192 20 0 BEADRP C[N@@H+]1CCC[C@H](n2ccc3cccc(C[NH3+])c32)C1 ZINC001255474680 970206474 /nfs/dbraw/zinc/20/64/74/970206474.db2.gz HYMVWTKXLSWBOW-AWEZNQCLSA-N 2 0 243.354 2.367 20 0 BEADRP C[C@@H]([NH3+])c1nc2ccccc2n1-c1cc[nH+]cc1 ZINC000091692124 970255762 /nfs/dbraw/zinc/25/57/62/970255762.db2.gz LAVQQACTFVCDCG-SNVBAGLBSA-N 2 0 238.294 2.440 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3C)C1 ZINC001170098024 970269867 /nfs/dbraw/zinc/26/98/67/970269867.db2.gz JSPHJAIIQVNIML-XHJNMGKDSA-N 2 0 222.376 2.390 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CCCCC[NH+](C)C)C1 ZINC001170098583 970285760 /nfs/dbraw/zinc/28/57/60/970285760.db2.gz ULIAMVBQOKWNPA-OLZOCXBDSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+]CCCCC[NH+](C)C)C1 ZINC001170098584 970285960 /nfs/dbraw/zinc/28/59/60/970285960.db2.gz ULIAMVBQOKWNPA-QWHCGFSZSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@H]1CC[C@H]([NH2+]C[C@H]2CCC[N@H+](C)C2)C1 ZINC001170103232 970295429 /nfs/dbraw/zinc/29/54/29/970295429.db2.gz DSABJECGWJNNGA-XQQFMLRXSA-N 2 0 210.365 2.106 20 0 BEADRP CCC(CC)[NH+]1CCC([NH2+][C@H](C)COC)CC1 ZINC001255563266 970347244 /nfs/dbraw/zinc/34/72/44/970347244.db2.gz LAKHXHALVJBFJI-GFCCVEGCSA-N 2 0 242.407 2.264 20 0 BEADRP COCCC1([NH3+])CC[NH+]([C@@H]2CC[C@@H](C)C2)CC1 ZINC001170124272 970368208 /nfs/dbraw/zinc/36/82/08/970368208.db2.gz XARULVVURSTMBA-CHWSQXEVSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@H]([NH3+])c1ccn(C2C[C@H]3CCC[C@@H](C2)[N@H+]3C)n1 ZINC001255668891 970448921 /nfs/dbraw/zinc/44/89/21/970448921.db2.gz OUWSTKBOCHXQDI-ACJTYDJDSA-N 2 0 248.374 2.091 20 0 BEADRP C[C@@H]1CC[C@@H]([N@@H+]2C[C@H]3C[C@@]3(C[NH+](C)C)C2)C1 ZINC001170156343 970481086 /nfs/dbraw/zinc/48/10/86/970481086.db2.gz DJSWOKWRQIJQAF-AAVRWANBSA-N 2 0 222.376 2.059 20 0 BEADRP C(C1CC[NH2+]CC1)[NH+]1C[C@H]2CCCC[C@@H]2C1 ZINC000178973721 970486255 /nfs/dbraw/zinc/48/62/55/970486255.db2.gz FHMKDQXBRHBIIJ-ZIAGYGMSSA-N 2 0 222.376 2.108 20 0 BEADRP C[C@H](Cc1ccccc1F)[NH2+][C@@H]1CCC[C@@H]1[NH3+] ZINC001255841774 970510930 /nfs/dbraw/zinc/51/09/30/970510930.db2.gz KLHFRJCLWVYOIJ-DDTOSNHZSA-N 2 0 236.334 2.226 20 0 BEADRP Cc1ncc(C[N@H+](C)C[C@@H]2CC[C@H]([NH3+])C2)s1 ZINC000400031341 970543586 /nfs/dbraw/zinc/54/35/86/970543586.db2.gz FSZMWKXPMVUDHW-MNOVXSKESA-N 2 0 239.388 2.011 20 0 BEADRP CC[C@@H]1C[C@H]([N@H+](CCC[NH3+])C(C)C)CCO1 ZINC001170171044 970544912 /nfs/dbraw/zinc/54/49/12/970544912.db2.gz OOUKXELEWBAUAR-CHWSQXEVSA-N 2 0 228.380 2.003 20 0 BEADRP CSC[C@H]1CCC[N@@H+]1C[C@@]1(C)CCC[NH2+]C1 ZINC000400130855 970548097 /nfs/dbraw/zinc/54/80/97/970548097.db2.gz SBEGGUXVCUMSGP-OLZOCXBDSA-N 2 0 242.432 2.204 20 0 BEADRP CC[C@H]1C[C@@H]([NH2+]CCCCC[NH+](C)C)CCO1 ZINC001170170660 970548804 /nfs/dbraw/zinc/54/88/04/970548804.db2.gz MZDCAQJSYAYTBR-KBPBESRZSA-N 2 0 242.407 2.266 20 0 BEADRP CSC[C@@H]1CCC[N@@H+]1C[C@@]1(C)CCC[NH2+]C1 ZINC000400130861 970551384 /nfs/dbraw/zinc/55/13/84/970551384.db2.gz SBEGGUXVCUMSGP-STQMWFEESA-N 2 0 242.432 2.204 20 0 BEADRP CC[C@H]1C[C@@H]([NH2+]Cc2ccccc2C[NH3+])CCO1 ZINC001170181157 970554505 /nfs/dbraw/zinc/55/45/05/970554505.db2.gz DZOZLSDNRXZWRH-GJZGRUSLSA-N 2 0 248.370 2.193 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)n1ccc([C@@H](C)[NH3+])n1 ZINC001255947892 970563396 /nfs/dbraw/zinc/56/33/96/970563396.db2.gz YMRWSRDRONMRPH-VXGBXAGGSA-N 2 0 238.379 2.196 20 0 BEADRP CCC[N@H+](CCC[NH3+])[C@@H]1CCO[C@@H](CC)C1 ZINC001170172491 970565883 /nfs/dbraw/zinc/56/58/83/970565883.db2.gz ZQBJNKWRRPRBPD-OLZOCXBDSA-N 2 0 228.380 2.005 20 0 BEADRP CC[C@@H]1C[C@@H]([NH2+][C@@H]2CCC[N@H+](C)CC2)CCO1 ZINC001170171620 970565925 /nfs/dbraw/zinc/56/59/25/970565925.db2.gz UDTRZWWFLCSWJE-HZSPNIEDSA-N 2 0 240.391 2.018 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]CCc1cccnc1 ZINC001255940851 970568649 /nfs/dbraw/zinc/56/86/49/970568649.db2.gz HLUBXVFVWRPAIB-CQSZACIVSA-N 2 0 249.402 2.334 20 0 BEADRP CC[NH+](CC)CCN[C@@H](C)CC[NH+](CC)CC ZINC001255940206 970571608 /nfs/dbraw/zinc/57/16/08/970571608.db2.gz SRGPBQWLVIXZAF-AWEZNQCLSA-N 2 0 243.439 2.038 20 0 BEADRP C[C@H]([NH2+]Cc1ccc(F)cc1)C1CC[NH2+]CC1 ZINC000400341317 970576900 /nfs/dbraw/zinc/57/69/00/970576900.db2.gz IUHHZVHKEUSORG-NSHDSACASA-N 2 0 236.334 2.303 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]C[C@H]1CCCCO1 ZINC001255944173 970577216 /nfs/dbraw/zinc/57/72/16/970577216.db2.gz SHDFOJWMFGVXQZ-ZIAGYGMSSA-N 2 0 242.407 2.266 20 0 BEADRP CC[NH+](CC)CC[C@H](C)n1ccc([C@@H](C)[NH3+])n1 ZINC001255947890 970580834 /nfs/dbraw/zinc/58/08/34/970580834.db2.gz YMRWSRDRONMRPH-NWDGAFQWSA-N 2 0 238.379 2.196 20 0 BEADRP CS[C@@H]1CC[C@H]([NH2+][C@@H](C)[C@@H]2CCC[NH2+]2)C1 ZINC000400366535 970583247 /nfs/dbraw/zinc/58/32/47/970583247.db2.gz FHHCBLNXUUOLAC-YFKTTZPYSA-N 2 0 228.405 2.001 20 0 BEADRP CC[C@H]([NH2+][C@H](C)C1CC[NH2+]CC1)C(C)C ZINC000400451109 970593811 /nfs/dbraw/zinc/59/38/11/970593811.db2.gz ORCDOKUPSRDTCO-YPMHNXCESA-N 2 0 212.381 2.399 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)c1nccs1)C1CC[NH2+]CC1 ZINC000400463614 970593932 /nfs/dbraw/zinc/59/39/32/970593932.db2.gz SDZFHSDQVSREMH-ZJUUUORDSA-N 2 0 239.388 2.182 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)CC1CC1)C1CC[NH2+]CC1 ZINC000400501919 970595545 /nfs/dbraw/zinc/59/55/45/970595545.db2.gz CGHUXMILBJCRBL-WDEREUQCSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@H]1C[C@H]([N@H+](CC)CCC[NH+](C)C)CCO1 ZINC001170238946 970618024 /nfs/dbraw/zinc/61/80/24/970618024.db2.gz LJMXGNAMYNBNQR-KGLIPLIRSA-N 2 0 242.407 2.218 20 0 BEADRP CC(C)(C)C(=[NH2+])NC1CC[NH+](C2CC2)CC1 ZINC001256066593 970631341 /nfs/dbraw/zinc/63/13/41/970631341.db2.gz JCNAKHICBSFLEE-UHFFFAOYSA-N 2 0 223.364 2.226 20 0 BEADRP CSC(C)(C)C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000401025200 970653516 /nfs/dbraw/zinc/65/35/16/970653516.db2.gz NCYMTHCEAIPDFL-SDDRHHMPSA-N 2 0 242.432 2.106 20 0 BEADRP C[C@H]1CCCCC[N@@H+]1C1CCN(C)CC1 ZINC001256207927 970708859 /nfs/dbraw/zinc/70/88/59/970708859.db2.gz RVNGLNWCQFSYFQ-LBPRGKRZSA-N 2 0 210.365 2.345 20 0 BEADRP CCC[N@H+](CC(C)C)C1CCN(C)CC1 ZINC001256210518 970717160 /nfs/dbraw/zinc/71/71/60/970717160.db2.gz JMEHVJKMVDQUQJ-UHFFFAOYSA-N 2 0 212.381 2.449 20 0 BEADRP [NH3+]CCN1CCC2(CCCc3ccccc32)CC1 ZINC001222616205 972606161 /nfs/dbraw/zinc/60/61/61/972606161.db2.gz ZSWWZBNFGTXBDT-UHFFFAOYSA-N 2 0 244.382 2.315 20 0 BEADRP CCCCC[C@@H](C)[N@@H+]1CCC[C@](O)(C[NH3+])CC1 ZINC001246545987 972658927 /nfs/dbraw/zinc/65/89/27/972658927.db2.gz XUBJYZWDTIIYLM-ZIAGYGMSSA-N 2 0 242.407 2.131 20 0 BEADRP CCOCC[C@H](C)[N@@H+]1CCC[C@](C)([NH3+])CC1 ZINC001246548014 972678274 /nfs/dbraw/zinc/67/82/74/972678274.db2.gz DXPWUPNHGZJTIH-STQMWFEESA-N 2 0 228.380 2.005 20 0 BEADRP C[C@@H]1CC[C@@H]([N@@H+]2CCC[C@](C)([NH3+])CC2)C1 ZINC001246549979 972704420 /nfs/dbraw/zinc/70/44/20/972704420.db2.gz IXCDXLRHZATUQO-UPJWGTAASA-N 2 0 210.365 2.378 20 0 BEADRP C[C@@H]1CC([N@@H+]2CCC[C@@](C)([NH3+])CC2)C[C@@H](C)O1 ZINC001246550605 972709698 /nfs/dbraw/zinc/70/96/98/972709698.db2.gz JNKCTQURIROZRE-YRGRVCCFSA-N 2 0 240.391 2.146 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H]1CCCc2c(O)cccc21 ZINC001327841781 972753605 /nfs/dbraw/zinc/75/36/05/972753605.db2.gz ZMRFYFTZMOPSKS-RISCZKNCSA-N 2 0 248.370 2.357 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H](C)CCc1ccco1 ZINC001327840256 972753995 /nfs/dbraw/zinc/75/39/95/972753995.db2.gz NIHHZPSMZQRNJA-VXGBXAGGSA-N 2 0 224.348 2.188 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@@H]1CCCc2c(O)cccc21 ZINC001327841782 972754440 /nfs/dbraw/zinc/75/44/40/972754440.db2.gz ZMRFYFTZMOPSKS-SMDDNHRTSA-N 2 0 248.370 2.357 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H](C)CCc1ccco1 ZINC001327840253 972755174 /nfs/dbraw/zinc/75/51/74/972755174.db2.gz NIHHZPSMZQRNJA-NEPJUHHUSA-N 2 0 224.348 2.188 20 0 BEADRP CCC[C@H](C)[N@@H+]1CCC[C@H](C[NH3+])[C@H](C)C1 ZINC001246562885 972784921 /nfs/dbraw/zinc/78/49/21/972784921.db2.gz BQVAXCISEYNAQT-FRRDWIJNSA-N 2 0 212.381 2.482 20 0 BEADRP CCC[C@H](C)[N@@H+]1CCC[C@@H](C[NH3+])[C@@H](C)C1 ZINC001246562877 972789708 /nfs/dbraw/zinc/78/97/08/972789708.db2.gz BQVAXCISEYNAQT-AVGNSLFASA-N 2 0 212.381 2.482 20 0 BEADRP C[C@@]1(C[NH3+])CCC[N@@H+]([C@@H]2CCCOCC2)CC1 ZINC001246574621 972870061 /nfs/dbraw/zinc/87/00/61/972870061.db2.gz IIBSCVFZIZNWKB-ZIAGYGMSSA-N 2 0 240.391 2.006 20 0 BEADRP C[C@@H](Cc1ccncc1)[N@@H+]1CCCC[C@@H](C[NH3+])C1 ZINC001246590585 972997125 /nfs/dbraw/zinc/99/71/25/972997125.db2.gz HHTRHMIAFNEUCN-ZFWWWQNUSA-N 2 0 247.386 2.073 20 0 BEADRP C[C@@H]1CC[C@H](C[NH3+])C[N@@H+]1[C@H]1C[C@@H]2[C@H](C1)C2(C)C ZINC001246594971 973007036 /nfs/dbraw/zinc/00/70/36/973007036.db2.gz WWVVEEDDQJDVLW-XGFWRYKXSA-N 2 0 236.403 2.480 20 0 BEADRP C[NH2+]CC1C[NH+]([C@H]2C[C@@H](C)CC(C)(C)C2)C1 ZINC001246594805 973007743 /nfs/dbraw/zinc/00/77/43/973007743.db2.gz FGMMXBHXCDJCLU-YPMHNXCESA-N 2 0 224.392 2.352 20 0 BEADRP CC1(C)C[C@@H]([N@@H+]2CCCC[C@](C)(C[NH3+])C2)CO1 ZINC001246597878 973011572 /nfs/dbraw/zinc/01/15/72/973011572.db2.gz YODAFBONJYWHFO-TZMCWYRMSA-N 2 0 240.391 2.005 20 0 BEADRP C1[C@@H]2C[C@H]([N@@H+]3CCC[C@@]34CCC[NH2+]C4)C[C@H]12 ZINC001246605950 973023804 /nfs/dbraw/zinc/02/38/04/973023804.db2.gz CZAMZKQOJJLUEE-ZOBORPQBSA-N 2 0 220.360 2.003 20 0 BEADRP C[C@H]1CC([N@@H+]2C[C@H]3CCC[NH2+][C@H]3C2)C[C@H](C)C1 ZINC001246658232 973070210 /nfs/dbraw/zinc/07/02/10/973070210.db2.gz PTIXQQFTQWEXDV-BHPKHCPMSA-N 2 0 236.403 2.495 20 0 BEADRP COCC[C@@H]1CCCC[N@@H+]1[C@H]1CC[NH2+][C@H](C)C1 ZINC001246781045 973089138 /nfs/dbraw/zinc/08/91/38/973089138.db2.gz DBLNNVGKJGDULP-RDBSUJKOSA-N 2 0 240.391 2.018 20 0 BEADRP COCC[C@H]1CCCC[N@@H+]1[C@@H]1CC[NH2+][C@H](C)C1 ZINC001246781041 973092022 /nfs/dbraw/zinc/09/20/22/973092022.db2.gz DBLNNVGKJGDULP-MGPQQGTHSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2CC[C@@H](c3ccccn3)C2)CC[NH2+]1 ZINC001246791649 973093159 /nfs/dbraw/zinc/09/31/59/973093159.db2.gz HPVMTQRQRWKPPA-MGPQQGTHSA-N 2 0 245.370 2.011 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]Cc1cncc2ccccc21 ZINC001328677465 973261286 /nfs/dbraw/zinc/26/12/86/973261286.db2.gz OXYLNXWPOWQZQD-GFCCVEGCSA-N 2 0 243.354 2.180 20 0 BEADRP C[C@@H]1CC[C@@H]([NH+]2CC3CCC(CC3)C2)C[NH2+]1 ZINC001246881785 973283842 /nfs/dbraw/zinc/28/38/42/973283842.db2.gz JCNKGSVZDFHVCG-BLYZHGLHSA-N 2 0 222.376 2.249 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H]1CCc2c1cccc2OC ZINC001329024420 973433203 /nfs/dbraw/zinc/43/32/03/973433203.db2.gz RQNUPYZTVVYGAL-BXUZGUMPSA-N 2 0 248.370 2.270 20 0 BEADRP CCC[C@H](CC)[N@H+]1C[C@@H]2CC[NH2+]CC[C@@H]2C1 ZINC001246935409 973608599 /nfs/dbraw/zinc/60/85/99/973608599.db2.gz VDCBVLSCNVUNNM-MJBXVCDLSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CC2(C)CC(F)(F)C2)CC[NH2+]1 ZINC000720921528 973633976 /nfs/dbraw/zinc/63/39/76/973633976.db2.gz CTDCGGVNXWTWDL-UWVGGRQHSA-N 2 0 232.318 2.152 20 0 BEADRP Cc1cc2[nH+]ccn2cc1NC[C@H]1CCCC[NH2+]1 ZINC001171332965 973860336 /nfs/dbraw/zinc/86/03/36/973860336.db2.gz BFVMPLMNJNNWJV-GFCCVEGCSA-N 2 0 244.342 2.197 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+][C@H]1CCc2c(F)cccc2C1 ZINC001171418455 974031734 /nfs/dbraw/zinc/03/17/34/974031734.db2.gz KOESYJGXJQYCFT-TUKIKUTGSA-N 2 0 248.345 2.152 20 0 BEADRP Cc1cccc2c1CC[C@H]([NH2+]CCC[NH+](C)C)C2 ZINC001171550621 974094945 /nfs/dbraw/zinc/09/49/45/974094945.db2.gz XEOYVEACSWYRBU-HNNXBMFYSA-N 2 0 246.398 2.394 20 0 BEADRP COC1(C[NH2+]CCCNc2ccccn2)CCC1 ZINC001330625706 974372067 /nfs/dbraw/zinc/37/20/67/974372067.db2.gz RFQGGSCFJUGJAN-UHFFFAOYSA-N 2 0 249.358 2.042 20 0 BEADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H](n1ccc(C[NH3+])c1)C2 ZINC001172112242 974373564 /nfs/dbraw/zinc/37/35/64/974373564.db2.gz UMKYTUDZWQSTHY-BTTYYORXSA-N 2 0 233.359 2.135 20 0 BEADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]C[Si](C)(C)C)C2 ZINC001172110738 974375555 /nfs/dbraw/zinc/37/55/55/974375555.db2.gz ODMHITKRYISTLG-CLLJXQQHSA-N 2 0 240.467 2.469 20 0 BEADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H](n1ccc(C[NH3+])c1)C2 ZINC001172112243 974376622 /nfs/dbraw/zinc/37/66/22/974376622.db2.gz UMKYTUDZWQSTHY-WDNDVIMCSA-N 2 0 233.359 2.135 20 0 BEADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H](n1cccc1C[NH3+])C2 ZINC001172108342 974376801 /nfs/dbraw/zinc/37/68/01/974376801.db2.gz UWPGUHUPNOCERQ-DABQJJPHSA-N 2 0 233.359 2.135 20 0 BEADRP C[C@@H]1C[C@@H](F)C[N@@H+]1[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172120477 974380176 /nfs/dbraw/zinc/38/01/76/974380176.db2.gz KZXWAIWTQSFWRU-POQQGIQPSA-N 2 0 240.366 2.434 20 0 BEADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC[C@H](F)C1)C2 ZINC001172120899 974388984 /nfs/dbraw/zinc/38/89/84/974388984.db2.gz GZWXUWAHQONBCM-FQUUOJAGSA-N 2 0 240.366 2.436 20 0 BEADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC3(CC3)C1)C2 ZINC001172121473 974392161 /nfs/dbraw/zinc/39/21/61/974392161.db2.gz QUHFVADYVUYSHP-WDNDVIMCSA-N 2 0 234.387 2.488 20 0 BEADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC[C@@H](F)C1)C2 ZINC001172120902 974393578 /nfs/dbraw/zinc/39/35/78/974393578.db2.gz GZWXUWAHQONBCM-YIYPIFLZSA-N 2 0 240.366 2.436 20 0 BEADRP C[C@@H](C[NH+](C)C)Oc1ccc(C[NH+](C)C)cc1 ZINC001225335333 974412612 /nfs/dbraw/zinc/41/26/12/974412612.db2.gz ZSZLSTAACUCPDD-LBPRGKRZSA-N 2 0 236.359 2.077 20 0 BEADRP CC[NH+](CC)CCC[NH2+]C1C[C@H]2CC[C@@H](C1)O2 ZINC001172216694 974441459 /nfs/dbraw/zinc/44/14/59/974441459.db2.gz BBYVAYFJPWRZED-AGUYFDCRSA-N 2 0 240.391 2.018 20 0 BEADRP CC[NH+](CC)CCCC[NH2+][C@@H]1COC(C)(C)C1 ZINC001172270488 974486205 /nfs/dbraw/zinc/48/62/05/974486205.db2.gz MRZZVSTYGWBJCQ-ZDUSSCGKSA-N 2 0 242.407 2.266 20 0 BEADRP CC(C)[N@H+]([C@@H]1COC(C)(C)C1)C(C)(C)C[NH3+] ZINC001172279526 974539138 /nfs/dbraw/zinc/53/91/38/974539138.db2.gz IFICCONDLHSNRU-NSHDSACASA-N 2 0 228.380 2.002 20 0 BEADRP CCC[N@H+](CCC[NH+](C)C)[C@@H]1COC(C)(C)C1 ZINC001172295213 974563395 /nfs/dbraw/zinc/56/33/95/974563395.db2.gz QYDWJSGJXCHHNR-ZDUSSCGKSA-N 2 0 242.407 2.218 20 0 BEADRP CC[C@H](C)OCC[C@@H](C)[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC001172342116 974608271 /nfs/dbraw/zinc/60/82/71/974608271.db2.gz KGOQARZDIXJMSC-RFGFWPKPSA-N 2 0 242.407 2.440 20 0 BEADRP C[C@@H]1CC[C@H](NC(=[NH2+])SCC[NH3+])C[C@H]1C ZINC001172359451 974630305 /nfs/dbraw/zinc/63/03/05/974630305.db2.gz MSGRJSIYODHRNS-BBBLOLIVSA-N 2 0 229.393 2.027 20 0 BEADRP Cc1cc(N2C[C@@H]3CC[N@H+](C)CC[C@@H]3C2)cc[nH+]1 ZINC001277064197 974643116 /nfs/dbraw/zinc/64/31/16/974643116.db2.gz HNDVLTXWHRGMJI-OKILXGFUSA-N 2 0 245.370 2.168 20 0 BEADRP CCOCC[C@H](C)[NH2+]CCC1CC[NH+](C)CC1 ZINC001172406012 974660339 /nfs/dbraw/zinc/66/03/39/974660339.db2.gz FRRFWLFWEAJZRX-ZDUSSCGKSA-N 2 0 242.407 2.123 20 0 BEADRP CCOCC[C@@H](C)[NH+]1CCC(C[NH+](C)C)CC1 ZINC001172422847 974696234 /nfs/dbraw/zinc/69/62/34/974696234.db2.gz ABTODSOQUUJNPB-CYBMUJFWSA-N 2 0 242.407 2.075 20 0 BEADRP CCOCC[C@@H](C)[N@H+](C)CCC[NH+]1CCCC1 ZINC001172424078 974700947 /nfs/dbraw/zinc/70/09/47/974700947.db2.gz MQXZPCBSJBOARR-CQSZACIVSA-N 2 0 242.407 2.219 20 0 BEADRP CC(C)OCC[C@@H](C)[NH2+]CCC[NH+]1CCCC1 ZINC001172431217 974712188 /nfs/dbraw/zinc/71/21/88/974712188.db2.gz LEPZBKQNERROHO-CQSZACIVSA-N 2 0 242.407 2.266 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]Cc1ccc2ncccc2c1 ZINC001331419320 974713775 /nfs/dbraw/zinc/71/37/75/974713775.db2.gz QKTGMCQFVXPYBC-LBPRGKRZSA-N 2 0 243.354 2.322 20 0 BEADRP CC[C@H](CC(C)C)NC(=[NH2+])SCC[NH3+] ZINC001172389943 974736763 /nfs/dbraw/zinc/73/67/63/974736763.db2.gz QTSSPJJSEZSMIB-SECBINFHSA-N 2 0 217.382 2.027 20 0 BEADRP CC(C)OCC[C@@H](C)[NH2+][C@H]1CCC[N@H+](C)CC1 ZINC001172437789 974792798 /nfs/dbraw/zinc/79/27/98/974792798.db2.gz JGKDOPFLVYICLU-KGLIPLIRSA-N 2 0 242.407 2.264 20 0 BEADRP CC(C)OCC[C@H](C)[N@H+](C)CCC[NH+](C)C ZINC001172439649 974794844 /nfs/dbraw/zinc/79/48/44/974794844.db2.gz GBUPWDPCLNUAPX-ZDUSSCGKSA-N 2 0 230.396 2.074 20 0 BEADRP CC(C)OCC[C@@H](C)[NH+]1CCC([NH+](C)C)CC1 ZINC001172438913 974795154 /nfs/dbraw/zinc/79/51/54/974795154.db2.gz ATOPVDBMVAYJHR-CYBMUJFWSA-N 2 0 242.407 2.216 20 0 BEADRP CC(C)OCC[C@@H](C)[NH2+]C(C)(C)C(C)(C)[NH3+] ZINC001172441008 974798558 /nfs/dbraw/zinc/79/85/58/974798558.db2.gz KNGHOIZUQFKYHK-LLVKDONJSA-N 2 0 230.396 2.296 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]C1CCC2(CC2)CC1 ZINC001331836511 974831637 /nfs/dbraw/zinc/83/16/37/974831637.db2.gz WWAKCQHWRYFZHL-LLVKDONJSA-N 2 0 210.365 2.297 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H]1CC(C)(C)C[C@@H]1C ZINC001331836974 974831799 /nfs/dbraw/zinc/83/17/99/974831799.db2.gz YHEPXTGLEPLSEF-QJPTWQEYSA-N 2 0 212.381 2.399 20 0 BEADRP CC1(C)CC([NH2+][C@@H]2CCC[C@@H]2[NH3+])CC(C)(C)O1 ZINC001172654809 974898486 /nfs/dbraw/zinc/89/84/86/974898486.db2.gz KSJBIZYIXVOTNJ-NWDGAFQWSA-N 2 0 240.391 2.192 20 0 BEADRP Cc1[nH]c2ccc(NCC[C@@H](C)[NH3+])cc2[nH+]1 ZINC000258820086 975013499 /nfs/dbraw/zinc/01/34/99/975013499.db2.gz UECYEWDUKOXWDP-MRVPVSSYSA-N 2 0 218.304 2.021 20 0 BEADRP CC[NH+](CC)C1CCC([NH2+]CCCCO)CC1 ZINC001173103367 975022316 /nfs/dbraw/zinc/02/23/16/975022316.db2.gz AHHBTJRPBDNESL-UHFFFAOYSA-N 2 0 242.407 2.002 20 0 BEADRP CC[C@@H]1CC[C@@H]([NH2+][C@H]2CCC[C@H]([NH3+])C2)C1 ZINC001173274304 975156657 /nfs/dbraw/zinc/15/66/57/975156657.db2.gz PISDPAXZQOFEBA-MROQNXINSA-N 2 0 210.365 2.425 20 0 BEADRP CCC[N@H+](CCC[NH3+])[C@@H](C)CSCC ZINC001173292876 975168021 /nfs/dbraw/zinc/16/80/21/975168021.db2.gz SHRNVCNJNKFZHT-NSHDSACASA-N 2 0 218.410 2.189 20 0 BEADRP CCSC[C@@H](C)[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC001173293202 975168809 /nfs/dbraw/zinc/16/88/09/975168809.db2.gz YQNWEHVLURYLST-OLZOCXBDSA-N 2 0 244.448 2.450 20 0 BEADRP CCSC[C@@H](C)[NH2+]CC(C)(C)C[NH+](C)C ZINC001173292605 975169672 /nfs/dbraw/zinc/16/96/72/975169672.db2.gz ZTDUNQNOOQDSCI-LLVKDONJSA-N 2 0 232.437 2.305 20 0 BEADRP CC[C@H]1CC[C@H]([N@@H+]2C[C@H]3CC[NH+](C)C[C@H]3C2)C1 ZINC001173278794 975234286 /nfs/dbraw/zinc/23/42/86/975234286.db2.gz FPGXTCFGWRPXFZ-XGUBFFRZSA-N 2 0 236.403 2.449 20 0 BEADRP CC[C@@H]1CC[C@@H]([N@H+]2C[C@H]3C[NH+](CC)C[C@H]3C2)C1 ZINC001173282506 975239893 /nfs/dbraw/zinc/23/98/93/975239893.db2.gz GWSGTUNOXMNYNU-APIJFGDWSA-N 2 0 236.403 2.449 20 0 BEADRP CCSC[C@H](C)[NH2+]CCC1CC[NH+](C)CC1 ZINC001173288797 975255651 /nfs/dbraw/zinc/25/56/51/975255651.db2.gz ZURFFIBFAWRSDJ-LBPRGKRZSA-N 2 0 244.448 2.450 20 0 BEADRP CCSC[C@@H](C)[NH2+]C(C)(C)CC[NH+](C)C ZINC001173290883 975262168 /nfs/dbraw/zinc/26/21/68/975262168.db2.gz ITNWJYMRGHAFLO-LLVKDONJSA-N 2 0 232.437 2.448 20 0 BEADRP c1cc(C[NH2+]CC[C@@H]2CC[NH2+]C2)cc2c1CCC2 ZINC000258975645 975367808 /nfs/dbraw/zinc/36/78/08/975367808.db2.gz KQQDPFFRUQFEOD-ZDUSSCGKSA-N 2 0 244.382 2.265 20 0 BEADRP Cc1[nH]c2ccc(NCC[C@H]3CCC[NH2+]3)cc2[nH+]1 ZINC000259037351 975407854 /nfs/dbraw/zinc/40/78/54/975407854.db2.gz PEKHBKPEAAOLJV-LLVKDONJSA-N 2 0 244.342 2.425 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+][C@@H]1CC[C@H]2[C@@H](C1)C2(F)F ZINC001333599056 975882589 /nfs/dbraw/zinc/88/25/89/975882589.db2.gz VZLRGCYMKFRSRU-YTWAJWBKSA-N 2 0 244.329 2.150 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@@H]2CCC[C@@H](F)C2)CC1 ZINC001333835167 976114282 /nfs/dbraw/zinc/11/42/82/976114282.db2.gz WFXAMTLAQZSNON-CHWSQXEVSA-N 2 0 228.355 2.199 20 0 BEADRP C[NH+](C)[C@@H]1CC[C@@H]2C[N@H+](CC3(C)CC3)C[C@H]2C1 ZINC001335133588 976860611 /nfs/dbraw/zinc/86/06/11/976860611.db2.gz JLWNSWFLYXVDNE-MGPQQGTHSA-N 2 0 236.403 2.449 20 0 BEADRP CC1(C)C[C@@H]([NH2+]C/C=C\C2CC2)C[C@@H]([NH3+])C1 ZINC001335252892 976900483 /nfs/dbraw/zinc/90/04/83/976900483.db2.gz QOCASHRVWHHSCX-JXLSXLBDSA-N 2 0 222.376 2.448 20 0 BEADRP Cc1ccc2[nH+]c(N)n(C3=CCC[N@@H+](C)C3)c2c1 ZINC001175574071 977574829 /nfs/dbraw/zinc/57/48/29/977574829.db2.gz LPBCEQAVDPKSIE-UHFFFAOYSA-N 2 0 242.326 2.103 20 0 BEADRP C[C@H]1C[C@H](C)C[NH+](CCCNc2cc[nH+]cc2)C1 ZINC001336396530 977661366 /nfs/dbraw/zinc/66/13/66/977661366.db2.gz MGFZMQOLKOGGTC-KBPBESRZSA-N 2 0 247.386 2.283 20 0 BEADRP CCc1ccc(N2CC[C@H](C[N@@H+](C)CC)C2)nc1 ZINC001336544173 977763526 /nfs/dbraw/zinc/76/35/26/977763526.db2.gz PDXLVBJSNMSTGD-CQSZACIVSA-N 2 0 247.386 2.422 20 0 BEADRP CCC[N@H+](C)Cc1cc2c[nH+]ccc2[nH]1 ZINC001232012246 977838306 /nfs/dbraw/zinc/83/83/06/977838306.db2.gz WRGUWYLKKYPAKC-UHFFFAOYSA-N 2 0 203.289 2.405 20 0 BEADRP C[C@H]1CC[N@H+](Cc2cc3c[nH+]ccc3[nH]2)C1 ZINC001232011414 977841735 /nfs/dbraw/zinc/84/17/35/977841735.db2.gz JYWFNZXNLLYQLB-JTQLQIEISA-N 2 0 215.300 2.405 20 0 BEADRP c1c2c[nH+]ccc2[nH]c1C[NH+]1CC2CC(C2)C1 ZINC001232017509 977844330 /nfs/dbraw/zinc/84/43/30/977844330.db2.gz SYCGPXFTXVFMRJ-UHFFFAOYSA-N 2 0 227.311 2.405 20 0 BEADRP Cc1cc(Nc2[nH]cc[nH+]2)n(-c2cc[nH+]cc2)n1 ZINC001176082359 977881222 /nfs/dbraw/zinc/88/12/22/977881222.db2.gz HFEZCZDHUPFHSK-UHFFFAOYSA-N 2 0 240.270 2.042 20 0 BEADRP C[NH+](C)Cc1ccccc1Nc1[nH]cc[nH+]1 ZINC001176084680 977883805 /nfs/dbraw/zinc/88/38/05/977883805.db2.gz BAAHRQJKQRALBZ-UHFFFAOYSA-N 2 0 216.288 2.215 20 0 BEADRP Cc1cc(N(C)c2cc(N)cc[nH+]2)cc(C)[nH+]1 ZINC001176051274 977897686 /nfs/dbraw/zinc/89/76/86/977897686.db2.gz DETRMFNEHCCMIG-UHFFFAOYSA-N 2 0 228.299 2.444 20 0 BEADRP Nc1c[nH+]cn1-c1cccc(C[NH+]2CCCC2)c1 ZINC001176195368 977989112 /nfs/dbraw/zinc/98/91/12/977989112.db2.gz WAMXKETZGUXSEL-UHFFFAOYSA-N 2 0 242.326 2.050 20 0 BEADRP C[C@]1(C[NH3+])CCC[N@H+](CCC2CC2)CC1 ZINC001206293936 978292613 /nfs/dbraw/zinc/29/26/13/978292613.db2.gz HXUDHZROTPCHCR-ZDUSSCGKSA-N 2 0 210.365 2.237 20 0 BEADRP Cc1cc(C)c(CN(C)C2CC[NH+](C)CC2)cn1 ZINC001233006994 978398147 /nfs/dbraw/zinc/39/81/47/978398147.db2.gz GELDETDNEWMUJG-UHFFFAOYSA-N 2 0 247.386 2.224 20 0 BEADRP C[N@@H+]1Cc2ccccc2[C@H]1CNc1cc[nH+]cc1 ZINC001337726466 978473611 /nfs/dbraw/zinc/47/36/11/978473611.db2.gz ZUMHPHDBGZSPCS-OAHLLOKOSA-N 2 0 239.322 2.102 20 0 BEADRP CC(C)[N@@H+]1CCC[C@]2(CCC[NH+](C)C2)C1 ZINC001277796742 978653915 /nfs/dbraw/zinc/65/39/15/978653915.db2.gz ITANLRQEIQXFFR-ZDUSSCGKSA-N 2 0 210.365 2.203 20 0 BEADRP CC[C@H](C)[N@H+]1C[C@@H]2CC[NH+](C)CC[C@@H]2C1 ZINC001277808540 978702170 /nfs/dbraw/zinc/70/21/70/978702170.db2.gz YOYFMTMIZZZSBQ-RWMBFGLXSA-N 2 0 210.365 2.059 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@@H](NCc3ccccc3F)[C@@H]2C1 ZINC001179815690 978758959 /nfs/dbraw/zinc/75/89/59/978758959.db2.gz IVBQBFJPCIZAGB-GZBFAFLISA-N 2 0 248.345 2.256 20 0 BEADRP CC1=C[C@@H](C)[C@H](CN2CC[C@@H]3[NH2+]CC[C@@H]32)CC1 ZINC001235005056 978947956 /nfs/dbraw/zinc/94/79/56/978947956.db2.gz VWBYIUXOKAPWBI-QPSCCSFWSA-N 2 0 234.387 2.415 20 0 BEADRP C(CN1CC[C@H]2C[NH2+]C[C@H]21)C1CCCCC1 ZINC001235007758 978950738 /nfs/dbraw/zinc/95/07/38/978950738.db2.gz QWUNJIAIOVXQNH-UONOGXRCSA-N 2 0 222.376 2.251 20 0 BEADRP CCCC[C@H](CC)C[N@@H+]1CC[C@H]2[NH2+]C[C@H]2C1 ZINC001235026265 978955440 /nfs/dbraw/zinc/95/54/40/978955440.db2.gz LWMWPXYUCUXCLQ-MELADBBJSA-N 2 0 224.392 2.497 20 0 BEADRP CCc1cccc(C)c1C[N@@H+]1CCC2(C[NH2+]C2)C1 ZINC001235026752 978955465 /nfs/dbraw/zinc/95/54/65/978955465.db2.gz QOPLWVIKRYCMTL-UHFFFAOYSA-N 2 0 244.382 2.353 20 0 BEADRP Cc1cc(C)c(C[N@@H+]2CC[C@H]3[NH2+]C[C@H]3C2)c(C)c1 ZINC001235025995 978955918 /nfs/dbraw/zinc/95/59/18/978955918.db2.gz IYMHXMIZHNKLLH-GOEBONIOSA-N 2 0 244.382 2.406 20 0 BEADRP Cc1cc(C)c(C[N@@H+]2CCC3(C[NH2+]C3)C2)c(C)c1 ZINC001235024902 978956160 /nfs/dbraw/zinc/95/61/60/978956160.db2.gz RQWFPEIDRLADFY-UHFFFAOYSA-N 2 0 244.382 2.407 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+][C@@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC001340062640 978963654 /nfs/dbraw/zinc/96/36/54/978963654.db2.gz HIYWARVGHFWZQM-KXNHARMFSA-N 2 0 210.365 2.281 20 0 BEADRP C[C@@H]1C[C@H]1C[NH+]1CCC([C@@H]2CCCC[NH2+]2)CC1 ZINC001235231216 978999022 /nfs/dbraw/zinc/99/90/22/978999022.db2.gz DITYPRZQQJKYQK-SNPRPXQTSA-N 2 0 236.403 2.497 20 0 BEADRP Cc1ccc(CCCN2C[C@H]3CCC[C@@]3([NH3+])C2)o1 ZINC001235240103 979004187 /nfs/dbraw/zinc/00/41/87/979004187.db2.gz MNQRUTOFSYSRIS-UKRRQHHQSA-N 2 0 248.370 2.334 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@@H]2CSC2(C)C)CC1 ZINC001181204446 979014906 /nfs/dbraw/zinc/01/49/06/979014906.db2.gz DTZHHZLZSRTNDP-GFCCVEGCSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H]1[C@@H](C)CCC[N@@H+]1CC[C@H]1COC(C)(C)N1 ZINC001235694715 979124139 /nfs/dbraw/zinc/12/41/39/979124139.db2.gz ITAFKYVRPPQQCB-XQQFMLRXSA-N 2 0 240.391 2.221 20 0 BEADRP CC1(C[N@@H+]2C[C@@H]3CC[NH2+]C[C@@H]3C2)CCCCC1 ZINC001235929045 979210287 /nfs/dbraw/zinc/21/02/87/979210287.db2.gz GMTWGVKMPSBEQV-UONOGXRCSA-N 2 0 236.403 2.498 20 0 BEADRP CC[C@H]1CCC[N@H+](CC[C@H]2COC(C)(C)N2)C1 ZINC001235949287 979223093 /nfs/dbraw/zinc/22/30/93/979223093.db2.gz CMXRRNGZICWBBL-STQMWFEESA-N 2 0 240.391 2.223 20 0 BEADRP Cc1cccc(C)c1C[N@H+]1C[C@H]2CC[C@@H](C1)[C@@H]2[NH3+] ZINC001235958475 979227389 /nfs/dbraw/zinc/22/73/89/979227389.db2.gz FRYORMSBSYWLFV-MIFYACCESA-N 2 0 244.382 2.473 20 0 BEADRP CC[N@H+](CCCC[NH3+])Cc1ccc(F)cc1 ZINC001235963421 979236770 /nfs/dbraw/zinc/23/67/70/979236770.db2.gz SJOKGGLSTAODNF-UHFFFAOYSA-N 2 0 224.323 2.387 20 0 BEADRP CC1=C[C@H](C)[C@H](C[N@@H+]2C[C@@H]3CC[C@]3([NH3+])C2)CC1 ZINC001235977783 979245310 /nfs/dbraw/zinc/24/53/10/979245310.db2.gz HYKUKIJAQUAQFP-AJNGGQMLSA-N 2 0 234.387 2.402 20 0 BEADRP CC/C=C\CCC[N@@H+]1C[C@H]2CC[C@@]2([NH3+])C1 ZINC001235981102 979256006 /nfs/dbraw/zinc/25/60/06/979256006.db2.gz UNFQIVCJVABOMV-FGTRRKKMSA-N 2 0 208.349 2.156 20 0 BEADRP CCc1cccc(C)c1CN1C[C@@H](C)[C@@H]([NH3+])C1 ZINC001236093247 979385076 /nfs/dbraw/zinc/38/50/76/979385076.db2.gz IWWPWLIRUBQZHB-DOMZBBRYSA-N 2 0 232.371 2.336 20 0 BEADRP C[NH+](C)Cc1cccc(-c2c[nH+]ccc2N)c1 ZINC001236418634 979589900 /nfs/dbraw/zinc/58/99/00/979589900.db2.gz FZEYWYRRNDZKKO-UHFFFAOYSA-N 2 0 227.311 2.223 20 0 BEADRP COc1ccc2c(c1)C[N@@H+](CCCC[NH3+])CCC2 ZINC001236434310 979599304 /nfs/dbraw/zinc/59/93/04/979599304.db2.gz OHWAJEMDBXXZMB-UHFFFAOYSA-N 2 0 248.370 2.182 20 0 BEADRP C[C@@H]1C[C@H]1C[N@@H+]1CCCC[C@@](C)(C[NH3+])C1 ZINC001206542132 979649914 /nfs/dbraw/zinc/64/99/14/979649914.db2.gz SEOUNJNWKIDIHM-AGIUHOORSA-N 2 0 210.365 2.093 20 0 BEADRP C[C@@]1(C[NH3+])CCCC[N@H+](CCC(F)(F)F)C1 ZINC001206542348 979654030 /nfs/dbraw/zinc/65/40/30/979654030.db2.gz YTBNZXRKCBHXDY-JTQLQIEISA-N 2 0 238.297 2.390 20 0 BEADRP C[C@]1([NH3+])CCC[N@H+](C[C@@H]2C[C@H]3C=C[C@@H]2C3)CC1 ZINC001205257233 979756535 /nfs/dbraw/zinc/75/65/35/979756535.db2.gz UQGWMVJBVZGARO-XGUBFFRZSA-N 2 0 234.387 2.402 20 0 BEADRP C[C@H]([NH3+])C[N@H+](C)CC[C@@H](C)CCCC(C)(C)O ZINC001236884873 979780717 /nfs/dbraw/zinc/78/07/17/979780717.db2.gz UIXXVZVFBHBLRZ-STQMWFEESA-N 2 0 244.423 2.233 20 0 BEADRP Cc1ccnc2cccc(CN(C)C[C@H](C)[NH3+])c12 ZINC001236908552 979792322 /nfs/dbraw/zinc/79/23/22/979792322.db2.gz KWJULCBZYBLQLV-LBPRGKRZSA-N 2 0 243.354 2.322 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[NH+]2CCC1CC2)c1ccccn1 ZINC001184135718 979945170 /nfs/dbraw/zinc/94/51/70/979945170.db2.gz UOLFCHJFYYMJAH-JSGCOSHPSA-N 2 0 245.370 2.074 20 0 BEADRP [NH3+]C[C@@H]1CCC[N@H+](C[C@@H]2CC3CCC2CC3)C1 ZINC000691663206 980382255 /nfs/dbraw/zinc/38/22/55/980382255.db2.gz RRXRKPZOKDRZIB-SHWKFHJASA-N 2 0 236.403 2.483 20 0 BEADRP C[N@@H+]1CCc2cc(C3=CCC[NH2+]CC3)ccc2C1 ZINC001238948485 980386531 /nfs/dbraw/zinc/38/65/31/980386531.db2.gz WSSKPBXEZRCQHN-UHFFFAOYSA-N 2 0 242.366 2.441 20 0 BEADRP C[C@H]([NH3+])c1ccccc1C1=CCC[NH2+]CC1 ZINC001238948007 980386745 /nfs/dbraw/zinc/38/67/45/980386745.db2.gz UTNYSJDDUGGRNN-NSHDSACASA-N 2 0 216.328 2.473 20 0 BEADRP Nc1nc2ccccc2n1-c1cc[nH+]cc1 ZINC000075947517 980630272 /nfs/dbraw/zinc/63/02/72/980630272.db2.gz SPBSODOCVJNTFQ-UHFFFAOYSA-N 2 0 210.240 2.003 20 0 BEADRP C[NH+](C)Cc1ccccc1-c1ccnc(C[NH3+])c1 ZINC001239684853 980840480 /nfs/dbraw/zinc/84/04/80/980840480.db2.gz VDVVKWNBNBLQEQ-UHFFFAOYSA-N 2 0 241.338 2.269 20 0 BEADRP C[NH+](C)Cc1ccccc1-c1cccc(C[NH3+])n1 ZINC001239680300 980841155 /nfs/dbraw/zinc/84/11/55/980841155.db2.gz SYNCQFMSLMIPHR-UHFFFAOYSA-N 2 0 241.338 2.269 20 0 BEADRP C[NH+](C)Cc1ccc(-c2cncc(C[NH3+])c2)cc1 ZINC001239797395 980935467 /nfs/dbraw/zinc/93/54/67/980935467.db2.gz ADZYBNOCACRGGQ-UHFFFAOYSA-N 2 0 241.338 2.269 20 0 BEADRP [NH3+]Cc1cncc(-c2ccccc2C2([NH3+])CC2)c1 ZINC001239806301 980945427 /nfs/dbraw/zinc/94/54/27/980945427.db2.gz BMYHGINZXJIWMZ-UHFFFAOYSA-N 2 0 239.322 2.155 20 0 BEADRP [NH3+]Cc1cncc(-c2cccc(C3([NH3+])CC3)c2)c1 ZINC001239806371 980945521 /nfs/dbraw/zinc/94/55/21/980945521.db2.gz FKXXPCZYFKSFLF-UHFFFAOYSA-N 2 0 239.322 2.155 20 0 BEADRP CC(C)C[NH+]1CCC([NH2+][C@@H]2C[C@@H]2C2CC2)CC1 ZINC000716667517 981066142 /nfs/dbraw/zinc/06/61/42/981066142.db2.gz NRHJMWKJIVGDDX-HUUCEWRRSA-N 2 0 236.403 2.495 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]Cc1ccc(C)cc1 ZINC001348515043 981381384 /nfs/dbraw/zinc/38/13/84/981381384.db2.gz ISTYPMRGTLXLSY-LBPRGKRZSA-N 2 0 206.333 2.083 20 0 BEADRP Cc1c[nH+]c(-c2ccc3c(c2)CC[NH2+]C3)cc1N ZINC001240454780 981393109 /nfs/dbraw/zinc/39/31/09/981393109.db2.gz SZDNFCLNWNISJB-UHFFFAOYSA-N 2 0 239.322 2.285 20 0 BEADRP c1cc(C2=CC[NH2+]CC2)ncc1C[NH+]1CCCC1 ZINC001240465799 981396543 /nfs/dbraw/zinc/39/65/43/981396543.db2.gz IGRPDIQLNHDDFW-UHFFFAOYSA-N 2 0 243.354 2.054 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H]1CCC[C@@H]1C(C)C ZINC001348839627 981454535 /nfs/dbraw/zinc/45/45/35/981454535.db2.gz DJXCQEANTNKWKK-UPJWGTAASA-N 2 0 212.381 2.399 20 0 BEADRP C[N@@H+]1CCc2cc(C3=CCC[NH2+]C3)ccc2C1 ZINC001240668776 981577483 /nfs/dbraw/zinc/57/74/83/981577483.db2.gz AZQGCGKIEIEDGO-UHFFFAOYSA-N 2 0 228.339 2.051 20 0 BEADRP [NH3+]C1(c2cccc(C3=CCC[NH2+]C3)c2)CCC1 ZINC001240671396 981581827 /nfs/dbraw/zinc/58/18/27/981581827.db2.gz VLEUFXKVBCMSRC-UHFFFAOYSA-N 2 0 228.339 2.401 20 0 BEADRP C(c1ccc([C@H]2CCC[NH2+]2)cn1)=C1CC[NH2+]CC1 ZINC001240873343 981913033 /nfs/dbraw/zinc/91/30/33/981913033.db2.gz AZCSBCIBMJWUSL-OAHLLOKOSA-N 2 0 243.354 2.273 20 0 BEADRP Cn1ccc2c1cc[nH+]c2C=C1CC[NH2+]CC1 ZINC001240873397 981917024 /nfs/dbraw/zinc/91/70/24/981917024.db2.gz CPROMUFIVPUWQF-UHFFFAOYSA-N 2 0 227.311 2.340 20 0 BEADRP C[C@H]([NH3+])c1ccccc1C=C1CC[NH2+]CC1 ZINC001240878653 981933542 /nfs/dbraw/zinc/93/35/42/981933542.db2.gz LOARXPBEOPMKSM-NSHDSACASA-N 2 0 216.328 2.473 20 0 BEADRP [NH3+]Cc1c[nH]c2ccc(C=C3CC[NH2+]CC3)cc12 ZINC001240879670 981936177 /nfs/dbraw/zinc/93/61/77/981936177.db2.gz WNUWEENVSFZXST-UHFFFAOYSA-N 2 0 241.338 2.393 20 0 BEADRP Cc1cc(C[N@@H+]2CC[C@@H](C[NH3+])[C@H](C)C2)cs1 ZINC001350910559 982119845 /nfs/dbraw/zinc/11/98/45/982119845.db2.gz QKGUXDIZVFRXJM-MFKMUULPSA-N 2 0 238.400 2.473 20 0 BEADRP CC(C)C[N@@H+]1C[C@@H]2CC[C@H]([NH+](C)C)C[C@@H]2C1 ZINC001352113661 982473885 /nfs/dbraw/zinc/47/38/85/982473885.db2.gz TUJRLEINIGBMQF-MJBXVCDLSA-N 2 0 224.392 2.305 20 0 BEADRP C[NH2+]Cc1ccc(C2=CC[N@H+](C)CC2)cc1 ZINC001241330271 982490685 /nfs/dbraw/zinc/49/06/85/982490685.db2.gz NQOGRVKYQFGSAU-UHFFFAOYSA-N 2 0 216.328 2.125 20 0 BEADRP C[C@H]([NH3+])c1ccccc1C1=CC[N@H+](C)CC1 ZINC001241330493 982490897 /nfs/dbraw/zinc/49/08/97/982490897.db2.gz SXVOFSZSEBKEQR-NSHDSACASA-N 2 0 216.328 2.425 20 0 BEADRP C[N@H+]1CC=C(c2cccc3c2CC[C@@H]3[NH3+])CC1 ZINC001241330084 982492325 /nfs/dbraw/zinc/49/23/25/982492325.db2.gz IQJJZIIDMFTJJN-HNNXBMFYSA-N 2 0 228.339 2.352 20 0 BEADRP C[N@H+]1CC=C(c2ccc3c(c2)[C@H]([NH3+])CC3)CC1 ZINC001241331720 982496219 /nfs/dbraw/zinc/49/62/19/982496219.db2.gz BTNHQUURDNUUOC-OAHLLOKOSA-N 2 0 228.339 2.352 20 0 BEADRP C[C@@H]([NH3+])c1ccccc1C1=CC[N@H+](C)CC1 ZINC001241333207 982501477 /nfs/dbraw/zinc/50/14/77/982501477.db2.gz SXVOFSZSEBKEQR-LLVKDONJSA-N 2 0 216.328 2.425 20 0 BEADRP C[NH+]1CC2(C1)CC[NH+](C[C@H]1CC=CCC1)CC2 ZINC001201422082 983219313 /nfs/dbraw/zinc/21/93/13/983219313.db2.gz GPWCNJYIJKFTDF-AWEZNQCLSA-N 2 0 234.387 2.370 20 0 BEADRP CC[NH+]1C[C@@H]2C[NH+](C[C@H]3CC=CCC3)C[C@H]2C1 ZINC001201426246 983224320 /nfs/dbraw/zinc/22/43/20/983224320.db2.gz GHAVTSMFINVLCL-RRFJBIMHSA-N 2 0 234.387 2.226 20 0 BEADRP C[NH+](C)Cc1ccc(C2=C[C@H]3CC[C@@H](C2)[NH2+]3)nc1 ZINC001242022450 983233999 /nfs/dbraw/zinc/23/39/99/983233999.db2.gz SNGZLGXSARKEOC-KGLIPLIRSA-N 2 0 243.354 2.051 20 0 BEADRP [NH3+]CCc1ccccc1C1=C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC001242026200 983239295 /nfs/dbraw/zinc/23/92/95/983239295.db2.gz NGESNVZDEPHEGG-KGLIPLIRSA-N 2 0 228.339 2.096 20 0 BEADRP CCC[NH+]1C[C@H]2C[NH+](CC(C)(C)C)C[C@@H]2C1 ZINC001201441373 983244953 /nfs/dbraw/zinc/24/49/53/983244953.db2.gz CSEHLXVUYCDJJD-STQMWFEESA-N 2 0 224.392 2.306 20 0 BEADRP CCC[C@@H](C)C[N@H+](C)C1CCN(C)CC1 ZINC001201534744 983290684 /nfs/dbraw/zinc/29/06/84/983290684.db2.gz QKMRVUOXDPCRHC-GFCCVEGCSA-N 2 0 212.381 2.449 20 0 BEADRP CCC[C@H](C)C[N@H+]1C[C@H]2C[NH+](CC)C[C@H]2C1 ZINC001201563431 983332390 /nfs/dbraw/zinc/33/23/90/983332390.db2.gz PYCOVVOTZVQWJN-MELADBBJSA-N 2 0 224.392 2.306 20 0 BEADRP CC[N@@H+]1CC[C@H]2C[NH+](Cc3ccccc3)C[C@@H]2C1 ZINC001201587734 983351862 /nfs/dbraw/zinc/35/18/62/983351862.db2.gz XFDKMCLDPCNZCF-HOTGVXAUSA-N 2 0 244.382 2.460 20 0 BEADRP CC[N@H+](C1CCCC1)C1CCN(C)CC1 ZINC001201590359 983355251 /nfs/dbraw/zinc/35/52/51/983355251.db2.gz WRKJDGDBYRXKDW-UHFFFAOYSA-N 2 0 210.365 2.345 20 0 BEADRP CC[NH+]1C[C@H]2C[NH+](CCc3ccccc3)C[C@@H]2C1 ZINC001201609535 983370622 /nfs/dbraw/zinc/37/06/22/983370622.db2.gz GKOSGZYDNOUMJA-HOTGVXAUSA-N 2 0 244.382 2.113 20 0 BEADRP C/C=C(\NC=[NH2+])c1ccc(OCC[NH+](C)C)cc1 ZINC001242148146 983382925 /nfs/dbraw/zinc/38/29/25/983382925.db2.gz VPPGZVVXECHGTF-CPSFFCFKSA-N 2 0 247.342 2.184 20 0 BEADRP CCCCCN1CC[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001201737457 983446070 /nfs/dbraw/zinc/44/60/70/983446070.db2.gz NYSFALRNAMBHHF-OLZOCXBDSA-N 2 0 210.365 2.345 20 0 BEADRP CCCCC[NH+]1C[C@H]2C[NH+](CCC)C[C@@H]2C1 ZINC001201743955 983448200 /nfs/dbraw/zinc/44/82/00/983448200.db2.gz AZLAMSKOZHQDJD-ZIAGYGMSSA-N 2 0 224.392 2.450 20 0 BEADRP CCCCC[NH+]1C[C@H]2C[NH+](CC)C[C@@H]2C1 ZINC001201744295 983449806 /nfs/dbraw/zinc/44/98/06/983449806.db2.gz GFAUXWGPMLPOKI-CHWSQXEVSA-N 2 0 210.365 2.060 20 0 BEADRP CCCCCC[N@H+]1C[C@H]2C[NH+](CC)C[C@H]2C1 ZINC001201756311 983457409 /nfs/dbraw/zinc/45/74/09/983457409.db2.gz IHDYSOVHQQNHHG-OKILXGFUSA-N 2 0 224.392 2.450 20 0 BEADRP CCCC[C@H](O)C[NH2+]CCCC[NH+](CC)CC ZINC001252108407 983666037 /nfs/dbraw/zinc/66/60/37/983666037.db2.gz NZTNPJHOMYXTKB-AWEZNQCLSA-N 2 0 244.423 2.249 20 0 BEADRP Cc1c[nH+]c(-c2ccc3c(c2)C[NH2+]C3)cc1N ZINC001242673839 984041292 /nfs/dbraw/zinc/04/12/92/984041292.db2.gz JPOSFOYDCJVXJT-UHFFFAOYSA-N 2 0 225.295 2.242 20 0 BEADRP CC(C)C[NH+]1CCC([NH2+]C2CCC2)CC1 ZINC000223812256 984271424 /nfs/dbraw/zinc/27/14/24/984271424.db2.gz SNUNENQPOYPSGF-UHFFFAOYSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCCC[NH2+]C1)c1cccc(O)c1 ZINC001579485851 984281828 /nfs/dbraw/zinc/28/18/28/984281828.db2.gz ULCAVYXFMUKXDT-QWHCGFSZSA-N 2 0 248.370 2.433 20 0 BEADRP C[NH2+]Cc1ccc(-c2ncc(C)cc2C[NH3+])cc1 ZINC001242990414 984354258 /nfs/dbraw/zinc/35/42/58/984354258.db2.gz LXHOLIDZPGIKSI-UHFFFAOYSA-N 2 0 241.338 2.235 20 0 BEADRP C[NH2+]Cc1cccc(-c2cc(N)cc[nH+]2)c1 ZINC001242993699 984356341 /nfs/dbraw/zinc/35/63/41/984356341.db2.gz GEQVNBJVOTZHKC-UHFFFAOYSA-N 2 0 213.284 2.050 20 0 BEADRP C[NH2+]Cc1cccc(-c2[nH+]ccc(N)c2C)c1 ZINC001242995724 984358202 /nfs/dbraw/zinc/35/82/02/984358202.db2.gz UWEZIEMMTUOIDT-UHFFFAOYSA-N 2 0 227.311 2.359 20 0 BEADRP CC[NH+]1CCC2(C[NH+](C3CCCC3)C2)CC1 ZINC001275086858 984482123 /nfs/dbraw/zinc/48/21/23/984482123.db2.gz QXORZMYDQWGYEM-UHFFFAOYSA-N 2 0 222.376 2.347 20 0 BEADRP C[N@H+]1CC[C@H]2C[NH+](CC3CCC3)C[C@H]2CC1 ZINC001275180874 984514961 /nfs/dbraw/zinc/51/49/61/984514961.db2.gz NWXZZZMMKPDHCM-OKILXGFUSA-N 2 0 222.376 2.060 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+][C@@H]2CC[C@@H]3CCCC[C@@H]3C2)C1 ZINC001580423469 984535544 /nfs/dbraw/zinc/53/55/44/984535544.db2.gz ZYFXFHFRLAGJTJ-MEBFFEOJSA-N 2 0 222.376 2.425 20 0 BEADRP C1=C(c2ccc([C@@H]3CCC[NH2+]C3)cc2)C[NH2+]C1 ZINC001243110760 984569495 /nfs/dbraw/zinc/56/94/95/984569495.db2.gz JQROSZUVLKZSCM-CQSZACIVSA-N 2 0 228.339 2.140 20 0 BEADRP C1=C(c2ccc([C@H]3CCC[NH2+]C3)cc2)C[NH2+]C1 ZINC001243110759 984572572 /nfs/dbraw/zinc/57/25/72/984572572.db2.gz JQROSZUVLKZSCM-AWEZNQCLSA-N 2 0 228.339 2.140 20 0 BEADRP C[C@@H]1C[C@H]1C[N@@H+]1CCC[C@]2(CCC[NH+](C)C2)C1 ZINC001276032781 984789046 /nfs/dbraw/zinc/78/90/46/984789046.db2.gz LNLFTYNRKVMFDL-ILXRZTDVSA-N 2 0 236.403 2.450 20 0 BEADRP CC[NH2+]C1CC[NH+]([C@H]2C=CCCC2)CC1 ZINC001577818201 984803991 /nfs/dbraw/zinc/80/39/91/984803991.db2.gz BYJSYELSBOHXFC-ZDUSSCGKSA-N 2 0 208.349 2.169 20 0 BEADRP CCO[C@H]1CCC[C@@H]([NH2+][C@@H]2CCCC[C@H]2[NH3+])C1 ZINC001578098127 984848361 /nfs/dbraw/zinc/84/83/61/984848361.db2.gz SAAVJWNNDJMPJW-XJFOESAGSA-N 2 0 240.391 2.194 20 0 BEADRP CCC[C@H](CC)N(CC[NH3+])CC[NH+](CC)CC ZINC001257250138 984855575 /nfs/dbraw/zinc/85/55/75/984855575.db2.gz WKZSMKUUSLFCTJ-AWEZNQCLSA-N 2 0 243.439 2.168 20 0 BEADRP CCc1ccc(C[N@@H+]2CC[C@H](C[NH3+])[C@@H](C)C2)nc1 ZINC001578260054 984915799 /nfs/dbraw/zinc/91/57/99/984915799.db2.gz ZXIYFMNJBGNITB-GXTWGEPZSA-N 2 0 247.386 2.061 20 0 BEADRP CCC[C@@H](C)CC[C@@H](C)[NH2+]CCOCC[NH3+] ZINC001257469078 985089809 /nfs/dbraw/zinc/08/98/09/985089809.db2.gz SVQOTNOUCGPAJQ-CHWSQXEVSA-N 2 0 230.396 2.156 20 0 BEADRP C[N@H+](C1CC1)C1CC[NH+](CC2CCC2)CC1 ZINC001202775782 985084524 /nfs/dbraw/zinc/08/45/24/985084524.db2.gz JPLGHQMEBNSJEV-UHFFFAOYSA-N 2 0 222.376 2.345 20 0 BEADRP C[N@H+](CCC[NH3+])[C@H]1CCC[C@H]1C(C)(C)C ZINC001578466472 985097458 /nfs/dbraw/zinc/09/74/58/985097458.db2.gz OERWNFQHXZDKSS-NEPJUHHUSA-N 2 0 212.381 2.482 20 0 BEADRP C[N@H+](CCCCCC[NH3+])[C@@H](CO)CC(C)(C)C ZINC001578465752 985101874 /nfs/dbraw/zinc/10/18/74/985101874.db2.gz LOYRPDXNOVGLDD-CYBMUJFWSA-N 2 0 244.423 2.234 20 0 BEADRP CCC(C)(C)CC[NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2 ZINC000686307633 985105386 /nfs/dbraw/zinc/10/53/86/985105386.db2.gz ZAHOVVDQGWYJQX-YHQUGGNUSA-N 2 0 236.403 2.399 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@H]1C[C@@H]2CC[C@@H](C2)C1 ZINC001578572035 985203654 /nfs/dbraw/zinc/20/36/54/985203654.db2.gz ZUYDHGFEXUQMEJ-WUHRBBMRSA-N 2 0 210.365 2.153 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]Cc1cccc2ncccc12 ZINC001578571479 985211371 /nfs/dbraw/zinc/21/13/71/985211371.db2.gz PCZXZMCDEDWXGU-GFCCVEGCSA-N 2 0 243.354 2.322 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H]1COC[C@H]1C ZINC000688024902 985499643 /nfs/dbraw/zinc/49/96/43/985499643.db2.gz NHDFUYDRZSKKOT-RDBSUJKOSA-N 2 0 242.407 2.121 20 0 BEADRP C[N@@H+](Cc1cc2c(s1)CC[NH2+]C2)CC1CC1 ZINC000688038087 985508752 /nfs/dbraw/zinc/50/87/52/985508752.db2.gz IBWHPPAMJVOHOQ-UHFFFAOYSA-N 2 0 236.384 2.236 20 0 BEADRP CO[C@@]1(C)CCC[N@H+](CCC[NH2+]C2CC2)CC1 ZINC001578925085 985525949 /nfs/dbraw/zinc/52/59/49/985525949.db2.gz ZIQXLSUKPJRSHM-AWEZNQCLSA-N 2 0 240.391 2.020 20 0 BEADRP CO[C@@H]1CCC[C@H]([NH2+]CC[C@@H]([NH3+])C(C)C)CC1 ZINC001578936869 985543547 /nfs/dbraw/zinc/54/35/47/985543547.db2.gz HLNZDOJPVYDZGP-BFHYXJOUSA-N 2 0 242.407 2.297 20 0 BEADRP CO[C@H]1CCC[C@@H]([NH2+]CC[C@@H]([NH3+])C(C)C)CC1 ZINC001578936870 985544187 /nfs/dbraw/zinc/54/41/87/985544187.db2.gz HLNZDOJPVYDZGP-HZSPNIEDSA-N 2 0 242.407 2.297 20 0 BEADRP CO[C@@H]1CCC[C@@H]([NH2+]CCC[NH2+]C(C)C)CC1 ZINC001578936992 985547066 /nfs/dbraw/zinc/54/70/66/985547066.db2.gz HQJDNLGMVMNZFZ-ZIAGYGMSSA-N 2 0 242.407 2.312 20 0 BEADRP [NH3+]Cc1ccc(/C=C/C2CC[NH2+]CC2)cc1 ZINC001243891834 985559063 /nfs/dbraw/zinc/55/90/63/985559063.db2.gz CKZXTIKMACPTSA-OWOJBTEDSA-N 2 0 216.328 2.158 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[N@@H+]2CCC[C@@H]2C2CCC2)C1 ZINC000688148495 985571829 /nfs/dbraw/zinc/57/18/29/985571829.db2.gz OECYIUVFQQBJML-IACUBPJLSA-N 2 0 222.376 2.378 20 0 BEADRP [NH3+]CCc1ccccc1/C=C/C1CC[NH2+]CC1 ZINC001243895494 985580681 /nfs/dbraw/zinc/58/06/81/985580681.db2.gz DPCVKWAEFUKPAA-AATRIKPKSA-N 2 0 230.355 2.201 20 0 BEADRP COC[C@@H](CC(C)(C)C)[NH2+][C@@H](C)CCC[NH3+] ZINC001578960921 985582288 /nfs/dbraw/zinc/58/22/88/985582288.db2.gz QHDFCLXZWSXXTL-NWDGAFQWSA-N 2 0 230.396 2.155 20 0 BEADRP [NH3+]CCc1cccc(/C=C/C2CC[NH2+]CC2)c1 ZINC001243896983 985585908 /nfs/dbraw/zinc/58/59/08/985585908.db2.gz STJWBVZEMVEMNP-SNAWJCMRSA-N 2 0 230.355 2.201 20 0 BEADRP COC[C@@H]([NH2+]C[C@H]1CC[C@@H]([NH3+])C1)c1ccccc1 ZINC001578970563 985599024 /nfs/dbraw/zinc/59/90/24/985599024.db2.gz WXUKBJYUSNBPGA-NWANDNLSSA-N 2 0 248.370 2.091 20 0 BEADRP [NH3+]CC[C@@H]1CC[N@H+](CCCC2CCC2)C1 ZINC000688405153 985631042 /nfs/dbraw/zinc/63/10/42/985631042.db2.gz MHUCIVJZWVVNFO-CYBMUJFWSA-N 2 0 210.365 2.237 20 0 BEADRP C[NH+](C)Cc1ccccc1C1=C[NH2+]CCC1 ZINC001243949123 985639118 /nfs/dbraw/zinc/63/91/18/985639118.db2.gz IXHNFCGVXZTSJX-UHFFFAOYSA-N 2 0 216.328 2.473 20 0 BEADRP COCC[C@H]([NH3+])C[NH2+]CC(C)(C)C1=CCCC1 ZINC001579001086 985642490 /nfs/dbraw/zinc/64/24/90/985642490.db2.gz FNZLUNNOXSHXGZ-ZDUSSCGKSA-N 2 0 240.391 2.076 20 0 BEADRP COCC[C@H]([NH3+])C[NH2+][C@@H](C)CCC=C(C)C ZINC001579001084 985648027 /nfs/dbraw/zinc/64/80/27/985648027.db2.gz FMEDIQYITMIAPP-STQMWFEESA-N 2 0 228.380 2.075 20 0 BEADRP C[NH+](C)/C=C/c1ccncc1C1=C[NH2+]CCC1 ZINC001243954712 985669901 /nfs/dbraw/zinc/66/99/01/985669901.db2.gz WYFAYNHWAUQQET-RMKNXTFCSA-N 2 0 229.327 2.338 20 0 BEADRP CSCC1(CC[NH2+]CC(C)(C)C[NH3+])CC1 ZINC001579370675 985864555 /nfs/dbraw/zinc/86/45/55/985864555.db2.gz QSKKDXRHRHQDFW-UHFFFAOYSA-N 2 0 230.421 2.094 20 0 BEADRP CSCC[N@@H+]1CCCC[C@H]1C1(C[NH3+])CCC1 ZINC001579373859 985865142 /nfs/dbraw/zinc/86/51/42/985865142.db2.gz DXAOORSRRGQAJL-LBPRGKRZSA-N 2 0 242.432 2.333 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@H+](CC1CC1)CC1CCC1 ZINC001579454564 985944330 /nfs/dbraw/zinc/94/43/30/985944330.db2.gz LFKUAKFGCXMGQH-DOMZBBRYSA-N 2 0 236.403 2.354 20 0 BEADRP [NH3+]CCOc1cccc(-c2ccc(C[NH3+])cc2)c1 ZINC001244322507 985955565 /nfs/dbraw/zinc/95/55/65/985955565.db2.gz RJYXLOSMRMQWLA-UHFFFAOYSA-N 2 0 242.322 2.150 20 0 BEADRP C[C@H]1COC(C)(C)C[N@@H+]1CCCCCCC[NH3+] ZINC001579492559 986019315 /nfs/dbraw/zinc/01/93/15/986019315.db2.gz LJXLGXADODNEBF-ZDUSSCGKSA-N 2 0 242.407 2.395 20 0 BEADRP Cc1cc(C[NH2+][C@H]2C[C@@H]([NH3+])C2(C)C)cc(C)c1O ZINC001579601777 986120850 /nfs/dbraw/zinc/12/08/50/986120850.db2.gz ZXRFTGDEDAZULS-OLZOCXBDSA-N 2 0 248.370 2.224 20 0 BEADRP CC[C@@H](C)C[C@H](CC)[NH2+]CCC[N@H+](C)CCO ZINC001258786950 986201006 /nfs/dbraw/zinc/20/10/06/986201006.db2.gz DAZCZUFGDAPCPU-KGLIPLIRSA-N 2 0 244.423 2.105 20 0 BEADRP Cc1ccc(F)cc1CN[C@]12CCC[C@H]1C[NH2+]C2 ZINC001579708375 986202681 /nfs/dbraw/zinc/20/26/81/986202681.db2.gz PSQLEIVZCQSGFQ-ZFWWWQNUSA-N 2 0 248.345 2.366 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2CC[C@H](C)[C@H]2C)CC1 ZINC001461886970 986215228 /nfs/dbraw/zinc/21/52/28/986215228.db2.gz KMHMGFYPKRRJGE-QWHCGFSZSA-N 2 0 224.392 2.449 20 0 BEADRP CCC[N@H+]1C[C@@H]2C[NH+](CC3CCC3)C[C@@H]2C1 ZINC001202791913 986311671 /nfs/dbraw/zinc/31/16/71/986311671.db2.gz GVTMKXUVCUXMBR-OKILXGFUSA-N 2 0 222.376 2.060 20 0 BEADRP CC[N@H+](C)C1CC[NH+](CC2CCC2)CC1 ZINC001202793289 986312599 /nfs/dbraw/zinc/31/25/99/986312599.db2.gz VJOSQRVJKRDUOI-UHFFFAOYSA-N 2 0 210.365 2.203 20 0 BEADRP C[NH2+]Cc1cccc(-c2cccc(C[NH3+])n2)c1F ZINC001244856896 986400587 /nfs/dbraw/zinc/40/05/87/986400587.db2.gz FRNRVZASUOVZQX-UHFFFAOYSA-N 2 0 245.301 2.066 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+]C[C@@H]1C[NH+]2CCC1CC2 ZINC001462635600 986465262 /nfs/dbraw/zinc/46/52/62/986465262.db2.gz MHQWSMOQYMMCIG-YUELXQCFSA-N 2 0 236.403 2.497 20 0 BEADRP FCC[C@@H]1CCC[N@H+](C[C@H]2CCCC[NH2+]C2)C1 ZINC000689443480 986612084 /nfs/dbraw/zinc/61/20/84/986612084.db2.gz AVGCHCGNLPASQN-KBPBESRZSA-N 2 0 242.382 2.448 20 0 BEADRP [NH3+][C@]12CCC[C@@H]1CN(Cc1ccc(CF)cc1)C2 ZINC001580157745 986629528 /nfs/dbraw/zinc/62/95/28/986629528.db2.gz LRGJACPGFUAPFV-CABCVRRESA-N 2 0 248.345 2.469 20 0 BEADRP [NH3+]C1CC([NH2+]CC[C@@H]2C[C@H]2Cc2ccccc2)C1 ZINC001580163777 986638205 /nfs/dbraw/zinc/63/82/05/986638205.db2.gz PDPGIHJHRITRMK-WXLSXGNJSA-N 2 0 244.382 2.335 20 0 BEADRP [NH3+][C@H]1CC12CC([NH2+]CC[C@@H]1CC=CCC1)C2 ZINC001580164357 986638298 /nfs/dbraw/zinc/63/82/98/986638298.db2.gz HOSAMTXYTAZUMQ-ZIHBUVQPSA-N 2 0 220.360 2.202 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH+]2CC[C@@](C)(CF)C2)CC1 ZINC001254515987 986658289 /nfs/dbraw/zinc/65/82/89/986658289.db2.gz ICGJJGDNLROAPS-STQMWFEESA-N 2 0 228.355 2.152 20 0 BEADRP C[NH2+]Cc1ccc(N[C@H]2CCC[N@H+](C)CC2)cc1 ZINC001254522080 986666563 /nfs/dbraw/zinc/66/65/63/986666563.db2.gz BNWPXGWRAULGPE-AWEZNQCLSA-N 2 0 247.386 2.302 20 0 BEADRP [NH3+]CCC[N@H+]1C[C@H]2[C@H](C[C@@H]2c2ccccc2)C1 ZINC001580298620 986736764 /nfs/dbraw/zinc/73/67/64/986736764.db2.gz QYPUDEASDMDTRE-KFWWJZLASA-N 2 0 230.355 2.071 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[NH2+][C@H]2CC3CCC2CC3)C1 ZINC001580389179 986816704 /nfs/dbraw/zinc/81/67/04/986816704.db2.gz BSURNOWIEHQPKM-XTNFGFQESA-N 2 0 222.376 2.282 20 0 BEADRP C[NH+](C)Cc1ccccc1-c1ccncc1C[NH3+] ZINC001245557059 986942409 /nfs/dbraw/zinc/94/24/09/986942409.db2.gz AUDGQLSDRNTMEN-UHFFFAOYSA-N 2 0 241.338 2.269 20 0 BEADRP [NH3+]Cc1cnccc1-c1cccc2c1CC[C@@H]2[NH3+] ZINC001245559896 986952763 /nfs/dbraw/zinc/95/27/63/986952763.db2.gz IKBLMPWXPWFNRG-HNNXBMFYSA-N 2 0 239.322 2.153 20 0 BEADRP [NH3+]Cc1ccccc1-c1ccc2c[nH+]cn2c1 ZINC001245896345 987120042 /nfs/dbraw/zinc/12/00/42/987120042.db2.gz PNPDMTCRPLRXLG-UHFFFAOYSA-N 2 0 223.279 2.460 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@H]2CCCC[NH2+]C2)[C@@H]1C ZINC000697017865 987342404 /nfs/dbraw/zinc/34/24/04/987342404.db2.gz VAMPCPLXFRXPOG-UPJWGTAASA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@@H](C)OCC[C@H](C)[NH2+]CC1([NH3+])CCCC1 ZINC001246074547 987362806 /nfs/dbraw/zinc/36/28/06/987362806.db2.gz DPZWAXPEQGGGCO-QWHCGFSZSA-N 2 0 242.407 2.441 20 0 BEADRP CC(C)COCC[C@@H](C)[NH2+]CC1([NH3+])CCCC1 ZINC001246077722 987367800 /nfs/dbraw/zinc/36/78/00/987367800.db2.gz YAPUWZYJEJPFDU-CYBMUJFWSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]Cc2ccc3c(c2)CCC3)CC[NH2+]1 ZINC001246078953 987372990 /nfs/dbraw/zinc/37/29/90/987372990.db2.gz IKTMJHUHSVEDGH-LRDDRELGSA-N 2 0 244.382 2.405 20 0 BEADRP FC1CCC([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)CC1 ZINC001246082221 987378820 /nfs/dbraw/zinc/37/88/20/987378820.db2.gz ODEDGIPFRLJNFH-ACDMLXGOSA-N 2 0 226.339 2.140 20 0 BEADRP C[C@H]1CCC[C@H]([NH2+][C@H]2CC[C@H](C)NC2)C1 ZINC001246083814 987380979 /nfs/dbraw/zinc/38/09/79/987380979.db2.gz KHFMBHIDFPGSFM-CYDGBPFRSA-N 2 0 210.365 2.295 20 0 BEADRP Cc1ccc(CC[NH2+][C@H]2CC[NH2+][C@@H](C)C2)cc1 ZINC001246094068 987403153 /nfs/dbraw/zinc/40/31/53/987403153.db2.gz FORSHUAZPVABPG-ZFWWWQNUSA-N 2 0 232.371 2.268 20 0 BEADRP C[C@]1([NH2+]C2CCCCCCC2)CC[NH2+]C1 ZINC001246095902 987404589 /nfs/dbraw/zinc/40/45/89/987404589.db2.gz GWZAQQMIKVLJOJ-ZDUSSCGKSA-N 2 0 210.365 2.441 20 0 BEADRP CC(C)([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)C1CC1 ZINC001246096221 987408390 /nfs/dbraw/zinc/40/83/90/987408390.db2.gz IWMXPFFZLCHUDZ-FOSCPWQOSA-N 2 0 208.349 2.048 20 0 BEADRP CC1CCC([NH2+]C[C@@H]2C[NH2+]C[C@@H](C)C2)CC1 ZINC001246104849 987435236 /nfs/dbraw/zinc/43/52/36/987435236.db2.gz VLGGBABADRPQAF-QPPOZKHWSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H]1C[NH2+]C[C@@H]1[NH2+][C@@H]1C[C@@H](C)CC(C)(C)C1 ZINC001246108744 987440466 /nfs/dbraw/zinc/44/04/66/987440466.db2.gz MRTLBRBZQWCLME-XQHKEYJVSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]C[C@@H]2C[C@@H](F)CN2)CC(C)(C)C1 ZINC001246111879 987447257 /nfs/dbraw/zinc/44/72/57/987447257.db2.gz OSIJVSYVKMBJDW-LOWDOPEQSA-N 2 0 242.382 2.491 20 0 BEADRP C[C@H]1[NH2+]CCC[C@H]1C[NH2+]C1Cc2ccccc2C1 ZINC001246113146 987449360 /nfs/dbraw/zinc/44/93/60/987449360.db2.gz SJDUWSQLUOEJSM-DOMZBBRYSA-N 2 0 244.382 2.132 20 0 BEADRP CCC1CCC([NH2+][C@@H]2C[NH2+]C[C@@H]2C)CC1 ZINC001246115218 987454822 /nfs/dbraw/zinc/45/48/22/987454822.db2.gz GYCICCYRIUQONO-YWPUVAFDSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)[C@@H]1C[C@H]([NH2+]Cc2cccc(N)c2)CC[NH2+]1 ZINC001246119062 987462371 /nfs/dbraw/zinc/46/23/71/987462371.db2.gz ARBXXBTXRFKPII-CABCVRRESA-N 2 0 247.386 2.135 20 0 BEADRP CC(C)OCC[C@@H](C)[NH2+]C[C@@H]1C[NH2+]CC[C@H]1C ZINC001246118735 987462520 /nfs/dbraw/zinc/46/25/20/987462520.db2.gz ICJZXARGCPZBPW-MCIONIFRSA-N 2 0 242.407 2.025 20 0 BEADRP C[C@@H]1CC[NH2+]C[C@H]1C[NH2+][C@H]1C[C@@H]2[C@H](C1)C2(C)C ZINC001246121494 987468996 /nfs/dbraw/zinc/46/89/96/987468996.db2.gz RIKVQOMZWZZTJL-XHJNMGKDSA-N 2 0 236.403 2.256 20 0 BEADRP CC[C@@H](C)[NH2+][C@@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246123373 987471660 /nfs/dbraw/zinc/47/16/60/987471660.db2.gz AKSHBXPLXDYBMB-VXGBXAGGSA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@@H](CC(C)C)[NH2+][C@@H]1C[NH2+]CC12CC2 ZINC001246132903 987484782 /nfs/dbraw/zinc/48/47/82/987484782.db2.gz NGDGHAAUPZMWDP-NWDGAFQWSA-N 2 0 210.365 2.153 20 0 BEADRP C1[C@@H]2C[C@H]([NH2+][C@H]3CCC4(C3)CC[NH2+]CC4)C[C@H]12 ZINC001246134458 987488242 /nfs/dbraw/zinc/48/82/42/987488242.db2.gz SPBQRFSPJCMFIU-RFQIPJPRSA-N 2 0 234.387 2.297 20 0 BEADRP C1CC12C[NH2+]C[C@@H]2[NH2+]C1CCCCCC1 ZINC001246137164 987490242 /nfs/dbraw/zinc/49/02/42/987490242.db2.gz ZKOWSNMRURQFPB-LBPRGKRZSA-N 2 0 208.349 2.051 20 0 BEADRP CCCC[C@@H](CCC)[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001246144916 987502260 /nfs/dbraw/zinc/50/22/60/987502260.db2.gz BZUNSYDGWLAUQX-NDBYEHHHSA-N 2 0 210.365 2.153 20 0 BEADRP CCC[C@@H](C)CC[C@@H](C)[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001246147889 987504472 /nfs/dbraw/zinc/50/44/72/987504472.db2.gz LBHJASKSCWHGJJ-POQQGIQPSA-N 2 0 224.392 2.399 20 0 BEADRP CC[C@H](C[C@@H](C)CC)[NH2+][C@H]1[C@@H]2C[C@H]1C[NH2+]C2 ZINC001246151079 987512957 /nfs/dbraw/zinc/51/29/57/987512957.db2.gz VXDHFRHQBWDDPM-ODXJTPSBSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@H]1C[C@@H](n2ccc3ccc(C[NH3+])cc32)CC[NH2+]1 ZINC001246167307 987525998 /nfs/dbraw/zinc/52/59/98/987525998.db2.gz FHJDDARWABPVIP-FZMZJTMJSA-N 2 0 243.354 2.413 20 0 BEADRP CCCC[C@H]1C[C@H]([NH2+]CCCCC[NH3+])CC[NH2+]1 ZINC001246163496 987526306 /nfs/dbraw/zinc/52/63/06/987526306.db2.gz JJMWGLFQMKKJQV-UONOGXRCSA-N 3 0 241.423 2.016 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)c1cccc(N)c1 ZINC001246175245 987545094 /nfs/dbraw/zinc/54/50/94/987545094.db2.gz JECYUTRPXLBECJ-JTNHKYCSSA-N 2 0 233.359 2.060 20 0 BEADRP CC(C)CC(CC(C)C)[NH2+]C[C@H]1CC[NH2+]1 ZINC001246192244 987577330 /nfs/dbraw/zinc/57/73/30/987577330.db2.gz GTRSZNYPZKRYLT-GFCCVEGCSA-N 2 0 212.381 2.399 20 0 BEADRP CC[C@H](C)OCC[C@H](C)[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC001246198241 987590737 /nfs/dbraw/zinc/59/07/37/987590737.db2.gz OBJXNTOMAHAYRA-MELADBBJSA-N 2 0 242.407 2.169 20 0 BEADRP Cc1cc(F)cc(C)c1C[NH2+]C1CC[NH2+]CC1 ZINC001246197385 987591056 /nfs/dbraw/zinc/59/10/56/987591056.db2.gz AVEPYOBQUHSORB-UHFFFAOYSA-N 2 0 236.334 2.284 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[NH2+][C@@H](C)C1)c1ccc(O)cc1 ZINC001246205123 987600451 /nfs/dbraw/zinc/60/04/51/987600451.db2.gz RQCCQHWSPPBTIQ-GVXVVHGQSA-N 2 0 234.343 2.183 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@@H]2Cc3cccc(F)c3C2)C1 ZINC001246205272 987600709 /nfs/dbraw/zinc/60/07/09/987600709.db2.gz KMKDATUIJBEPIS-JHJVBQTASA-N 2 0 248.345 2.152 20 0 BEADRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc(O)cc1 ZINC001246203154 987600799 /nfs/dbraw/zinc/60/07/99/987600799.db2.gz LACCPTBISLCSIS-RAQOOLMWSA-N 2 0 246.354 2.326 20 0 BEADRP CC[C@H]1CC[C@H]([NH2+][C@@H]2CCC[C@@H]([NH3+])C2)C1 ZINC001246206454 987603618 /nfs/dbraw/zinc/60/36/18/987603618.db2.gz PISDPAXZQOFEBA-LOWDOPEQSA-N 2 0 210.365 2.425 20 0 BEADRP CCCC[C@H](CCC)[NH2+][C@@H]1CC[NH2+]C[C@H]1OC ZINC001246217375 987612966 /nfs/dbraw/zinc/61/29/66/987612966.db2.gz FVNGSBGYNAXZCE-BFHYXJOUSA-N 2 0 242.407 2.312 20 0 BEADRP C[C@H]1CC[C@H]([NH2+][C@H]2CC[C@@H]3CCC[C@@H]32)CN1 ZINC001246228867 987626973 /nfs/dbraw/zinc/62/69/73/987626973.db2.gz GYCLRYSFJHDAOT-PEDHHIEDSA-N 2 0 222.376 2.295 20 0 BEADRP C1C[C@H]2CC[C@H]([NH2+]C3C[C@H]4CC[C@@H](C3)[NH2+]4)[C@H]2C1 ZINC001246232645 987628345 /nfs/dbraw/zinc/62/83/45/987628345.db2.gz YGMUBVMHLPRSMN-REVZXKJASA-N 2 0 234.387 2.438 20 0 BEADRP CC(C)C([NH2+][C@H]1CC[NH2+][C@@H](C)C1)C(C)C ZINC001246237589 987634377 /nfs/dbraw/zinc/63/43/77/987634377.db2.gz PDQAQZMPOJCSAW-RYUDHWBXSA-N 2 0 212.381 2.397 20 0 BEADRP CC(C)C([NH2+][C@@H]1CC[NH2+][C@@H](C)C1)C(C)C ZINC001246237584 987634405 /nfs/dbraw/zinc/63/44/05/987634405.db2.gz PDQAQZMPOJCSAW-NWDGAFQWSA-N 2 0 212.381 2.397 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCCCc2ccccn2)CC[NH2+]1 ZINC001246237235 987635772 /nfs/dbraw/zinc/63/57/72/987635772.db2.gz HEMOWHIGAUBTBO-HIFRSBDPSA-N 2 0 247.386 2.134 20 0 BEADRP CC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1cccnc1 ZINC001246238374 987637562 /nfs/dbraw/zinc/63/75/62/987637562.db2.gz LQKUIPBFSJZWGN-IXXDHKBRSA-N 2 0 245.370 2.405 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[NH2+][C@@H](C)C1)c1cccnc1 ZINC001246240658 987640467 /nfs/dbraw/zinc/64/04/67/987640467.db2.gz SSGUVKUBVZBWMC-YUTCNCBUSA-N 2 0 233.359 2.263 20 0 BEADRP C[C@@H]1CC[C@@H](N2CC[C@H]([NH3+])c3ccccc32)C[NH2+]1 ZINC001246261852 987656408 /nfs/dbraw/zinc/65/64/08/987656408.db2.gz NMXLGPOOYGNFOB-BZPMIXESSA-N 2 0 245.370 2.037 20 0 BEADRP C[C@@H](C[NH2+][C@H]1CC[NH2+][C@H](C)C1)c1ccc(O)cc1 ZINC001246272962 987665183 /nfs/dbraw/zinc/66/51/83/987665183.db2.gz NCCXSMJIDDZPCC-SCRDCRAPSA-N 2 0 248.370 2.226 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)c1ccc(N)cc1 ZINC001246282244 987676175 /nfs/dbraw/zinc/67/61/75/987676175.db2.gz BCZHUSBJKRLQRR-JTNHKYCSSA-N 2 0 233.359 2.060 20 0 BEADRP CCCCC(CCCC)[NH2+]CCN(C)CC[NH3+] ZINC001246286444 987679790 /nfs/dbraw/zinc/67/97/90/987679790.db2.gz XYZWQQLWMDKIGZ-UHFFFAOYSA-N 2 0 243.439 2.216 20 0 BEADRP CC(C)[C@@H]1C[C@H]1[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC001474307658 987687973 /nfs/dbraw/zinc/68/79/73/987687973.db2.gz VIWHEQYGXKTHAN-FRRDWIJNSA-N 2 0 224.392 2.493 20 0 BEADRP CC[C@H]([NH3+])CCN[C@H]1C[C@@H](CC)[NH2+][C@@H](CC)C1 ZINC001246303943 987700606 /nfs/dbraw/zinc/70/06/06/987700606.db2.gz BMKGONXEVGHFFZ-IGQOVBAYSA-N 2 0 241.423 2.013 20 0 BEADRP Cc1cccc2c1CC[C@@H]([NH2+]CC[C@H](C)[NH3+])C2 ZINC001246305913 987702921 /nfs/dbraw/zinc/70/29/21/987702921.db2.gz PCDJMFLNYOZHTI-GXTWGEPZSA-N 2 0 232.371 2.179 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H]1CCc2cc(F)ccc2C1 ZINC001246305874 987704354 /nfs/dbraw/zinc/70/43/54/987704354.db2.gz OMVDLMYTWMATPA-IINYFYTJSA-N 2 0 236.334 2.010 20 0 BEADRP CC[NH+]1CCC(C[N@H+](C)[C@H]2CCSC2)CC1 ZINC001474401162 987710795 /nfs/dbraw/zinc/71/07/95/987710795.db2.gz HPTPIJMHFDOGHW-ZDUSSCGKSA-N 2 0 242.432 2.156 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@H]1CCc2ccc(C)cc2C1 ZINC001246312043 987712726 /nfs/dbraw/zinc/71/27/26/987712726.db2.gz FAJQUJUFSYRORH-CABCVRRESA-N 2 0 232.371 2.179 20 0 BEADRP CC[C@H]([NH3+])C[NH2+]C1CCC(OC(C)C)CC1 ZINC001246313668 987715457 /nfs/dbraw/zinc/71/54/57/987715457.db2.gz KAINRATUSWWEAX-HIFPTAJRSA-N 2 0 228.380 2.050 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@H]1CCc2c(C)cccc2C1 ZINC001246315722 987719615 /nfs/dbraw/zinc/71/96/15/987719615.db2.gz VPUGFHTVZIDSJU-KBPBESRZSA-N 2 0 232.371 2.179 20 0 BEADRP Cc1ccc2c(c1)C[C@@H]([NH2+]C[C@H]([NH3+])C(C)C)CC2 ZINC001246332570 987737553 /nfs/dbraw/zinc/73/75/53/987737553.db2.gz NPLXSJPKVPAWEB-HOTGVXAUSA-N 2 0 246.398 2.425 20 0 BEADRP CCCC[C@H](CCC)[NH2+][C@H]1CC[NH2+]C[C@H]1OC ZINC001246346753 987757340 /nfs/dbraw/zinc/75/73/40/987757340.db2.gz FVNGSBGYNAXZCE-MELADBBJSA-N 2 0 242.407 2.312 20 0 BEADRP CCCC[C@H]1C[C@H](NC(C)(C)CC[NH3+])CC[NH2+]1 ZINC001246357830 987763374 /nfs/dbraw/zinc/76/33/74/987763374.db2.gz ASTHAITYFFKGAQ-QWHCGFSZSA-N 2 0 241.423 2.014 20 0 BEADRP FC1(F)CCC2(C[C@@H]2[NH2+]C2CC[NH2+]CC2)CC1 ZINC001246386913 987780063 /nfs/dbraw/zinc/78/00/63/987780063.db2.gz PZFTYJHFYLJBAR-NSHDSACASA-N 2 0 244.329 2.296 20 0 BEADRP C[C@H]1C[C@H]([NH2+]C(C)(C)CC2CC2)CC[NH2+]1 ZINC001246396418 987782097 /nfs/dbraw/zinc/78/20/97/987782097.db2.gz ZQABMZRUPMOBFC-CMPLNLGQSA-N 2 0 210.365 2.295 20 0 BEADRP c1ccc([C@@H]2CC[C@H]([NH2+][C@@H]3CC34C[NH2+]C4)C2)cc1 ZINC001246446352 987806749 /nfs/dbraw/zinc/80/67/49/987806749.db2.gz RLGCVHFCUILFBC-QLFBSQMISA-N 2 0 242.366 2.274 20 0 BEADRP CCC[C@@]1(C[NH2+][C@@H]2CC[C@H](C)C2)CC[NH2+]1 ZINC001246455679 987810033 /nfs/dbraw/zinc/81/00/33/987810033.db2.gz IZPLLNVFEAYKCO-XQQFMLRXSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@H]2C[C@@](C)([NH3+])C2)C[C@H]1C ZINC001246460737 987819460 /nfs/dbraw/zinc/81/94/60/987819460.db2.gz MUCBLPDSXMTJLN-LBELIVKGSA-N 2 0 210.365 2.281 20 0 BEADRP C[NH2+][C@H]1C[C@H]([NH2+][C@H](C)CCC=C(C)C)C1 ZINC001246460490 987820224 /nfs/dbraw/zinc/82/02/24/987820224.db2.gz JCMQCZMQVGTARB-JHJVBQTASA-N 2 0 210.365 2.461 20 0 BEADRP C[NH2+][C@H]1C[C@H]([NH2+][C@H](C)Cc2ccc(C)cc2)C1 ZINC001246462415 987823745 /nfs/dbraw/zinc/82/37/45/987823745.db2.gz RLYQEELPIZHYRM-BPLDGKMQSA-N 2 0 232.371 2.266 20 0 BEADRP CC[C@H](CC(C)C)[NH2+]C[C@@H]1CC[NH2+]C[C@@H]1F ZINC001246478108 987835230 /nfs/dbraw/zinc/83/52/30/987835230.db2.gz SGDUWYSAQOEESE-XQQFMLRXSA-N 2 0 230.371 2.348 20 0 BEADRP CC[C@H]1CC[C@H]([NH2+][C@H]2CCCC[C@H]2[NH3+])C1 ZINC001246479895 987836590 /nfs/dbraw/zinc/83/65/90/987836590.db2.gz VSRVHAGHMYWQNG-RVMXOQNASA-N 2 0 210.365 2.425 20 0 BEADRP C[NH2+][C@H]1C[C@@H]([NH2+]C2CCc3ccccc3CC2)C1 ZINC001246497757 987853793 /nfs/dbraw/zinc/85/37/93/987853793.db2.gz QUQXUHVITPNICP-IYBDPMFKSA-N 2 0 244.382 2.274 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCc3ccncc32)CC[NH2+]1 ZINC001246501643 987857116 /nfs/dbraw/zinc/85/71/16/987857116.db2.gz BCJUWANASIIMGJ-OSAQELSMSA-N 2 0 245.370 2.189 20 0 BEADRP CCOC1CCC([N@@H+]2CCC[C@@H]([NH3+])CC2)CC1 ZINC001246540008 987904542 /nfs/dbraw/zinc/90/45/42/987904542.db2.gz DXIKQFKBRPEYKH-IYXRBSQSSA-N 2 0 240.391 2.147 20 0 BEADRP Cc1cccc2c1CC[C@H]([N@H+]1CC[C@@H]([NH3+])[C@H]1C)C2 ZINC001246542904 987913745 /nfs/dbraw/zinc/91/37/45/987913745.db2.gz MEHQNNZPAODHMQ-IVMMDQJWSA-N 2 0 244.382 2.274 20 0 BEADRP Cc1ccc2c(c1)C[N@H+]([C@@H]1CC[NH2+][C@@H](C)C1)CC2 ZINC001246547685 987925005 /nfs/dbraw/zinc/92/50/05/987925005.db2.gz MCZSYUFUBHUXES-XJKSGUPXSA-N 2 0 244.382 2.494 20 0 BEADRP C[C@H](CC1CC1)[N@@H+]1CCC[C@@](C)([NH3+])CC1 ZINC001246548364 987936705 /nfs/dbraw/zinc/93/67/05/987936705.db2.gz GIAITTQLRHXXJW-DGCLKSJQSA-N 2 0 210.365 2.378 20 0 BEADRP C[C@@H](CC1CC1)[N@@H+]1CCC[C@@](C)([NH3+])CC1 ZINC001246548365 987938972 /nfs/dbraw/zinc/93/89/72/987938972.db2.gz GIAITTQLRHXXJW-WCQYABFASA-N 2 0 210.365 2.378 20 0 BEADRP CC(C)OCC[C@@H](C)[N@@H+]1CCC[C@](C)([NH3+])CC1 ZINC001246552903 987949924 /nfs/dbraw/zinc/94/99/24/987949924.db2.gz QBZCPODKBJHSDY-KGLIPLIRSA-N 2 0 242.407 2.393 20 0 BEADRP CC(C)OCC[C@@H](C)[N@@H+]1CCC[C@@](C)([NH3+])CC1 ZINC001246552905 987953224 /nfs/dbraw/zinc/95/32/24/987953224.db2.gz QBZCPODKBJHSDY-ZIAGYGMSSA-N 2 0 242.407 2.393 20 0 BEADRP C[C@H](Cc1ccccn1)[N@@H+]1CCC[C@@](C)([NH3+])CC1 ZINC001246553091 987955586 /nfs/dbraw/zinc/95/55/86/987955586.db2.gz QWIAFTSRSYVGNQ-UKRRQHHQSA-N 2 0 247.386 2.216 20 0 BEADRP CCC[C@H](C)[N@@H+]1CCC[C@@](F)(C[NH3+])CC1 ZINC001246553602 987961902 /nfs/dbraw/zinc/96/19/02/987961902.db2.gz ZKEOBOMTQCNKBM-RYUDHWBXSA-N 2 0 216.344 2.328 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]Cc1ccc(Cl)cc1 ZINC001117953359 987966214 /nfs/dbraw/zinc/96/62/14/987966214.db2.gz FNHNSCUIWSHAOI-JTQLQIEISA-N 2 0 226.751 2.428 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]C[C@@H](C)c1ccccc1 ZINC001117954024 987966484 /nfs/dbraw/zinc/96/64/84/987966484.db2.gz XGXFJFZYAUAIRU-CHWSQXEVSA-N 2 0 220.360 2.378 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]Cc1cccc2cccnc21 ZINC001117953251 987969557 /nfs/dbraw/zinc/96/95/57/987969557.db2.gz CWVGHKBSCULFGL-GFCCVEGCSA-N 2 0 243.354 2.322 20 0 BEADRP CCSC[C@H](C)[N@H+]1CC[C@@H](C[NH3+])[C@@H](C)CC1 ZINC001246555735 987971353 /nfs/dbraw/zinc/97/13/53/987971353.db2.gz GAKMJGFCRLIZSJ-AVGNSLFASA-N 2 0 244.448 2.435 20 0 BEADRP CCSC[C@H](C)[N@@H+]1CCC[C@](F)(C[NH3+])CC1 ZINC001246557294 987972650 /nfs/dbraw/zinc/97/26/50/987972650.db2.gz KKUIOOFCGJDLNN-NWDGAFQWSA-N 2 0 248.411 2.281 20 0 BEADRP C[C@@H]1CC[N@@H+](C2CCCC2)CC[C@@H]1C[NH3+] ZINC001246558594 987972672 /nfs/dbraw/zinc/97/26/72/987972672.db2.gz MQPYQKBLGQPPRI-VXGBXAGGSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2CCC(F)(F)[C@H](C[NH3+])C2)C1 ZINC001246559831 987983642 /nfs/dbraw/zinc/98/36/42/987983642.db2.gz TZIRKJMWUMGSHA-MXWKQRLJSA-N 2 0 232.318 2.091 20 0 BEADRP CCCCC[C@@H](CCC)[N@@H+]1CC[C@@H]([NH3+])[C@H](O)C1 ZINC001246558719 987987162 /nfs/dbraw/zinc/98/71/62/987987162.db2.gz MPTLRZDIUDNXCD-MGPQQGTHSA-N 2 0 242.407 2.129 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]Cc1ccc2c(c1)CCC2 ZINC001118019156 987987446 /nfs/dbraw/zinc/98/74/46/987987446.db2.gz OEMUNEZCWMMKOZ-GFCCVEGCSA-N 2 0 232.371 2.120 20 0 BEADRP C[C@H](NCc1ccc2c(c1)CCC2)[C@H]1CCC[NH2+]1 ZINC001118057289 987990592 /nfs/dbraw/zinc/99/05/92/987990592.db2.gz CGOQPYMDHDSUQR-BLLLJJGKSA-N 2 0 244.382 2.405 20 0 BEADRP CCC[C@H](C)[N@@H+]1CC[C@@H](C)[C@@H](C[NH3+])CC1 ZINC001246561918 987995222 /nfs/dbraw/zinc/99/52/22/987995222.db2.gz USPCKZLEKUXPRL-FRRDWIJNSA-N 2 0 212.381 2.482 20 0 BEADRP C[C@@H]1CC[N@@H+]([C@@H]2CCCSC2)CC[C@H]1C[NH3+] ZINC001246564766 988013031 /nfs/dbraw/zinc/01/30/31/988013031.db2.gz ZVISTNWUKMFYAQ-FRRDWIJNSA-N 2 0 242.432 2.189 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@H](C)c1sc(C)nc1C ZINC001118121823 988027020 /nfs/dbraw/zinc/02/70/20/988027020.db2.gz JDZXKYFAQAXLTM-DTWKUNHWSA-N 2 0 241.404 2.409 20 0 BEADRP C[C@@H]1C[N@@H+](C2C[C@H]3CC[C@@H](C2)[NH2+]3)CCC1(F)F ZINC001246567671 988029853 /nfs/dbraw/zinc/02/98/53/988029853.db2.gz XJRKDIFYXKAAQR-YIBTVLSRSA-N 2 0 244.329 2.247 20 0 BEADRP Cc1cccc2c1C[N@H+]([C@@H]1CC[NH2+][C@@H](C)C1)C2 ZINC001246566653 988033609 /nfs/dbraw/zinc/03/36/09/988033609.db2.gz IPSNYJRUCORMBQ-GXTWGEPZSA-N 2 0 230.355 2.451 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2CCCC[C@@](C)(F)C2)CC[NH2+]1 ZINC001246571612 988048200 /nfs/dbraw/zinc/04/82/00/988048200.db2.gz DMCFKPUVUHPLSN-JHJVBQTASA-N 2 0 228.355 2.341 20 0 BEADRP CC(C)=CCC[C@@H](C)[N@@H+]1C[C@@H](C)[C@H]([NH3+])C1 ZINC001246570130 988054850 /nfs/dbraw/zinc/05/48/50/988054850.db2.gz ZOBKTRHWPMPPHV-JHJVBQTASA-N 2 0 210.365 2.400 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2CCC[C@H](C)[C@H](C)C2)CC[NH2+]1 ZINC001246578147 988087974 /nfs/dbraw/zinc/08/79/74/988087974.db2.gz YJQMPHGCOLYBLB-REWJHTLYSA-N 2 0 224.392 2.495 20 0 BEADRP CCSC[C@H](C)[N@@H+]1CCCC[C@H](C[NH3+])C1 ZINC001246582507 988110063 /nfs/dbraw/zinc/11/00/63/988110063.db2.gz NCWSZHBRWQODCA-NWDGAFQWSA-N 2 0 230.421 2.189 20 0 BEADRP C[C@@]1(C[NH3+])CCC[N@@H+]([C@@H]2CCCSC2)CC1 ZINC001246579956 988104660 /nfs/dbraw/zinc/10/46/60/988104660.db2.gz VOUGVAJGNLRLPA-CHWSQXEVSA-N 2 0 242.432 2.333 20 0 BEADRP C[C@@]1(C[NH3+])CCCC[N@@H+]([C@@H]2C[C@H]3C[C@H]3C2)C1 ZINC001246585011 988134678 /nfs/dbraw/zinc/13/46/78/988134678.db2.gz NRZXXXUJXNWLTQ-CRWXNKLISA-N 2 0 222.376 2.236 20 0 BEADRP C[C@@H]1C[C@@H]([N@@H+]2CCC(F)(F)C(C)(C)C2)CC[NH2+]1 ZINC001246593978 988186131 /nfs/dbraw/zinc/18/61/31/988186131.db2.gz CNLSZIJHYAFXDO-MNOVXSKESA-N 2 0 246.345 2.494 20 0 BEADRP C[C@]1(C[NH3+])CCCC[N@@H+]([C@@H]2CCCOCC2)C1 ZINC001246593919 988187854 /nfs/dbraw/zinc/18/78/54/988187854.db2.gz OTSZHERGZFZJFL-ZIAGYGMSSA-N 2 0 240.391 2.006 20 0 BEADRP C[C@H]1C[C@@H]([N@@H+]2CCCC[C@@](C)(C[NH3+])C2)CCO1 ZINC001246594245 988191532 /nfs/dbraw/zinc/19/15/32/988191532.db2.gz PIEDEAYFKWHYIY-IHRRRGAJSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@H]1C[C@@H]([N@@H+]2CCC(F)(F)C(C)(C)C2)CC[NH2+]1 ZINC001246593979 988191853 /nfs/dbraw/zinc/19/18/53/988191853.db2.gz CNLSZIJHYAFXDO-QWRGUYRKSA-N 2 0 246.345 2.494 20 0 BEADRP CCCCCC[C@H](C)[NH+]1CC(C[NH2+]C)C1 ZINC001246596704 988197927 /nfs/dbraw/zinc/19/79/27/988197927.db2.gz JUEJUTIDBZWFMU-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP CCCC[C@@H](CC(C)C)[NH+]1CC(C[NH3+])C1 ZINC001246598235 988199525 /nfs/dbraw/zinc/19/95/25/988199525.db2.gz UXNUFMUTWFBFAY-ZDUSSCGKSA-N 2 0 212.381 2.482 20 0 BEADRP Cc1ccc(C[C@@H](C)[NH+]2CC(C)(C[NH3+])C2)cc1 ZINC001246600479 988204368 /nfs/dbraw/zinc/20/43/68/988204368.db2.gz SWVGIZQLCJZSMJ-CYBMUJFWSA-N 2 0 232.371 2.207 20 0 BEADRP C[C@H]1C[C@H]([NH+]2CC(C)(C[NH3+])C2)CC(C)(C)C1 ZINC001246601273 988209287 /nfs/dbraw/zinc/20/92/87/988209287.db2.gz UNTSXLUKAHVPAW-RYUDHWBXSA-N 2 0 224.392 2.482 20 0 BEADRP CSCC[C@H](C)[N@@H+]1CCC[C@@]12CCC[NH2+]C2 ZINC001246609748 988233339 /nfs/dbraw/zinc/23/33/39/988233339.db2.gz NAGCSMWTWLXONL-QWHCGFSZSA-N 2 0 242.432 2.346 20 0 BEADRP CCOCC[C@H](C)[N@@H+]1CCC[C@@]12CCC[NH2+]C2 ZINC001246613407 988238844 /nfs/dbraw/zinc/23/88/44/988238844.db2.gz ZDXWKRBGOBWYOT-UONOGXRCSA-N 2 0 240.391 2.020 20 0 BEADRP C[C@@H]1CC([N@@H+]2CC[C@H]3C[NH2+]CC[C@H]32)C[C@@H](C)C1 ZINC001246625031 988287149 /nfs/dbraw/zinc/28/71/49/988287149.db2.gz QTZNGDUNHBQJRF-PWNZVWSESA-N 2 0 236.403 2.495 20 0 BEADRP CC1CCC([N@@H+]2CC[C@@H]3[NH2+]CC[C@H]32)CC1 ZINC001246628656 988300761 /nfs/dbraw/zinc/30/07/61/988300761.db2.gz CBSVSPMQVNDZDK-IFWUJCSASA-N 2 0 208.349 2.001 20 0 BEADRP C[C@H]1C[C@H]([N@@H+]2CC[C@@H]3[NH2+]CC[C@H]32)C[C@@H](C)C1 ZINC001246632916 988308486 /nfs/dbraw/zinc/30/84/86/988308486.db2.gz ISDJJFXQPGHPOI-MQLXINIDSA-N 2 0 222.376 2.247 20 0 BEADRP CCC1CCC([N@@H+]2CC[C@@H]3[NH2+]CC[C@H]32)CC1 ZINC001246628932 988311287 /nfs/dbraw/zinc/31/12/87/988311287.db2.gz CKELOYWNQKPCBC-CLRIEMFWSA-N 2 0 222.376 2.391 20 0 BEADRP CC[C@H](CC(C)C)[N@@H+]1CC[C@@]2(CC[NH2+]C2)C1 ZINC001246631786 988316221 /nfs/dbraw/zinc/31/62/21/988316221.db2.gz SIOPDWHSQXIUHE-ZIAGYGMSSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@H]1CC[C@H]([N@@H+]2CC[C@H]3[NH2+]CC[C@H]32)C1 ZINC001246640309 988337860 /nfs/dbraw/zinc/33/78/60/988337860.db2.gz SBRGLLAOYXLWIT-WUHRBBMRSA-N 2 0 208.349 2.001 20 0 BEADRP C[C@@H]1CC[C@@H]([N@@H+]2CC[C@H]3[NH2+]CC[C@H]32)C[C@H]1C ZINC001246642096 988344414 /nfs/dbraw/zinc/34/44/14/988344414.db2.gz ZEYVORMFGNMNBC-DHGKCCLASA-N 2 0 222.376 2.247 20 0 BEADRP CC[C@H](C[C@@H](C)CC)[N@@H+]1CC[C@H]2C[NH2+]C[C@H]21 ZINC001246643810 988356612 /nfs/dbraw/zinc/35/66/12/988356612.db2.gz DJBDXGRZCKIJRS-IGQOVBAYSA-N 2 0 224.392 2.495 20 0 BEADRP CC[C@@H](CC(C)C)[N@@H+]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC001246647326 988365694 /nfs/dbraw/zinc/36/56/94/988365694.db2.gz KLKSKHSCSZQZIG-RDBSUJKOSA-N 2 0 224.392 2.352 20 0 BEADRP CC1(C)CCC[C@@H]([N@@H+]2CC[C@@H]3C[NH2+]C[C@H]3C2)C1 ZINC001246648427 988371182 /nfs/dbraw/zinc/37/11/82/988371182.db2.gz PRUXAGQRCJKFBR-HZSPNIEDSA-N 2 0 236.403 2.497 20 0 BEADRP CCCCC[C@H](CC)[N@H+]1C[C@@H]2[C@@H]([NH3+])[C@@H]2C1 ZINC001246653892 988379014 /nfs/dbraw/zinc/37/90/14/988379014.db2.gz BMGXNDCTDAUABS-WUHRBBMRSA-N 2 0 210.365 2.234 20 0 BEADRP CCC[C@@H](C)CC[C@@H](C)[N@H+]1C[C@@H]2[C@@H]([NH3+])[C@@H]2C1 ZINC001246660591 988391426 /nfs/dbraw/zinc/39/14/26/988391426.db2.gz VOMDTPRPHJXJAN-POQQGIQPSA-N 2 0 224.392 2.480 20 0 BEADRP CC(C)C[C@H](C)C[C@@H](C)[N@H+]1C[C@@H]2[C@@H]([NH3+])[C@@H]2C1 ZINC001246661409 988398706 /nfs/dbraw/zinc/39/87/06/988398706.db2.gz WVMYHYMFPFBHBB-MEBFFEOJSA-N 2 0 224.392 2.336 20 0 BEADRP C[C@@H]1CC[C@@H]([N@@H+]2C[C@H]3CCC[NH2+][C@H]3C2)C[C@H]1C ZINC001246661417 988399449 /nfs/dbraw/zinc/39/94/49/988399449.db2.gz XDSBXHAHRYUXKM-RYPNDVFKSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@@H]1CC[C@@H]([N@@H+]2CC[C@@H]3C[NH2+]C[C@@H]3C2)C[C@H]1C ZINC001246667442 988408138 /nfs/dbraw/zinc/40/81/38/988408138.db2.gz KROHLJIPCZFNHG-KJWHEZOQSA-N 2 0 236.403 2.352 20 0 BEADRP CC[C@@H]1CC[C@@H]([N@@H+]2C[C@H]3CCC[C@@]3([NH3+])C2)C1 ZINC001246666798 988412377 /nfs/dbraw/zinc/41/23/77/988412377.db2.gz RTBDHAAIRCJBPT-AAVRWANBSA-N 2 0 222.376 2.378 20 0 BEADRP CC[C@H](C)C[C@H](CC)[N@@H+]1C[C@@H]2C[NH2+]CC[C@@H]21 ZINC001246678698 988420707 /nfs/dbraw/zinc/42/07/07/988420707.db2.gz YHNIMPGABQSGSR-XUXIUFHCSA-N 2 0 224.392 2.495 20 0 BEADRP CC[C@H](C)C[C@H](CC)[N@@H+]1C[C@H]2C[NH2+]CC[C@H]21 ZINC001246678696 988426361 /nfs/dbraw/zinc/42/63/61/988426361.db2.gz YHNIMPGABQSGSR-RFQIPJPRSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1CC[C@H](N2CC[C@H](c3ccncc3)C2)C[NH2+]1 ZINC001246775772 988456114 /nfs/dbraw/zinc/45/61/14/988456114.db2.gz LDLUTRWJNWSZJP-SNPRPXQTSA-N 2 0 245.370 2.011 20 0 BEADRP C[C@@H]1C[C@@H]([N@H+](C)CCOc2ccccc2)CC[NH2+]1 ZINC001246782718 988462809 /nfs/dbraw/zinc/46/28/09/988462809.db2.gz ULLLNXWVVYVOSL-KGLIPLIRSA-N 2 0 248.370 2.138 20 0 BEADRP C[NH2+]CC[C@@H](C)[N@H+](C)CCc1cccc(C)c1 ZINC001246815010 988494996 /nfs/dbraw/zinc/49/49/96/988494996.db2.gz UFVFFOUVJDCNQL-CQSZACIVSA-N 2 0 234.387 2.467 20 0 BEADRP CC[C@H](Cc1ccccc1)[N@@H+]1C[C@@H]2CC[C@]2([NH3+])C1 ZINC001246851724 988567999 /nfs/dbraw/zinc/56/79/99/988567999.db2.gz GSXIIWDIUCXZFA-XHSDSOJGSA-N 2 0 244.382 2.431 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2C[C@@H]3CC[C@]3([NH3+])C2)C[C@H]1C ZINC001246856421 988578785 /nfs/dbraw/zinc/57/87/85/988578785.db2.gz XCGMYMWJYUBWPS-DGTMBMJNSA-N 2 0 222.376 2.234 20 0 BEADRP CC(C)CC[C@H](C)[N@@H+]1C[C@H]2CC[C@@]2([NH3+])C1 ZINC001246862129 988599681 /nfs/dbraw/zinc/59/96/81/988599681.db2.gz QBMRWEPKEWYPEA-YNEHKIRRSA-N 2 0 210.365 2.234 20 0 BEADRP CCC1CCC([N@@H+]2C[C@H]3CC[C@@]3([NH3+])C2)CC1 ZINC001246860158 988604508 /nfs/dbraw/zinc/60/45/08/988604508.db2.gz MBBOTDGVSZQUBK-FKZOYECMSA-N 2 0 222.376 2.378 20 0 BEADRP CC[N@@H+]1CCC[C@H](C[NH2+][C@H](C)C(C)(C)OC)C1 ZINC001324240026 988765567 /nfs/dbraw/zinc/76/55/67/988765567.db2.gz QDNZPDFRQUSFLU-CHWSQXEVSA-N 2 0 242.407 2.121 20 0 BEADRP CCC[C@@H](C)[N@H+]1C[C@@H]2CC[NH2+]CC[C@@H]2C1 ZINC001246936752 988770340 /nfs/dbraw/zinc/77/03/40/988770340.db2.gz XAFFUMJKPHXISK-UPJWGTAASA-N 2 0 210.365 2.106 20 0 BEADRP CCCC[C@H](CC)[N@H+](C)[C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001246948447 988784711 /nfs/dbraw/zinc/78/47/11/988784711.db2.gz QIUWDPDRHQTZEM-WUHRBBMRSA-N 2 0 210.365 2.105 20 0 BEADRP c1cc(C[NH2+]CCCn2ccnc2)n(C2CC2)c1 ZINC001324366037 988815366 /nfs/dbraw/zinc/81/53/66/988815366.db2.gz VRAPNWRLDHDNSV-UHFFFAOYSA-N 2 0 244.342 2.199 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C/C=C\C2CC2)[C@@H]2CCC[C@@H]21 ZINC001324969393 989039453 /nfs/dbraw/zinc/03/94/53/989039453.db2.gz RAXSORIWVBRDJR-LSFZBXBFSA-N 2 0 234.387 2.415 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]Cc1ccc(SC)cc1 ZINC001325267034 989139621 /nfs/dbraw/zinc/13/96/21/989139621.db2.gz JGBPJPOPLPRSLX-LLVKDONJSA-N 2 0 238.400 2.496 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CCCC(F)F)CN1C1CC1 ZINC001119540981 989145395 /nfs/dbraw/zinc/14/53/95/989145395.db2.gz MTPLWZAGARGVQU-UWVGGRQHSA-N 2 0 232.318 2.247 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]Cc1cc(C)cc(C)c1 ZINC001325319017 989158443 /nfs/dbraw/zinc/15/84/43/989158443.db2.gz IXOKTXSGVFTHRX-CYBMUJFWSA-N 2 0 220.360 2.391 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]Cc1cccc2cnccc21 ZINC001325624284 989220714 /nfs/dbraw/zinc/22/07/14/989220714.db2.gz CXDRJQJXDHGGAB-LBPRGKRZSA-N 2 0 243.354 2.322 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H]1CC[C@H](C)[C@@H](C)C1 ZINC001325715351 989238645 /nfs/dbraw/zinc/23/86/45/989238645.db2.gz BOIBJIFEGRZBRM-WUHRBBMRSA-N 2 0 212.381 2.399 20 0 BEADRP CC[C@@H]([NH2+]CC[C@@H](C)[NH2+]C)c1ccncc1 ZINC001325723354 989242878 /nfs/dbraw/zinc/24/28/78/989242878.db2.gz RGPBKMFTAKDAJT-DGCLKSJQSA-N 2 0 221.348 2.120 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]C1C2CC3CC(C2)CC1C3 ZINC001325722913 989243777 /nfs/dbraw/zinc/24/37/77/989243777.db2.gz PIJWBLYJNOVPBM-GFSREQAASA-N 2 0 236.403 2.399 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@@H](C)c1cccc(OC)c1 ZINC001325742690 989246181 /nfs/dbraw/zinc/24/61/81/989246181.db2.gz GKLUOIIULGTJPC-RYUDHWBXSA-N 2 0 236.359 2.344 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H](C1CC1)C1CCC1 ZINC001325755723 989255603 /nfs/dbraw/zinc/25/56/03/989255603.db2.gz GONUSIWMBVRYEF-ZWNOBZJWSA-N 2 0 210.365 2.153 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H](C)Cc1cccs1 ZINC001326035941 989332517 /nfs/dbraw/zinc/33/25/17/989332517.db2.gz MTCBZRCFOWLFTF-MNOVXSKESA-N 2 0 226.389 2.124 20 0 BEADRP FCC[NH+]1CCC([C@@H]2CCC[NH2+]CC2)CC1 ZINC001119684320 989333422 /nfs/dbraw/zinc/33/34/22/989333422.db2.gz SSQZXWQGIPJKLB-GFCCVEGCSA-N 2 0 228.355 2.058 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H](C)Cc1cccs1 ZINC001326035943 989333356 /nfs/dbraw/zinc/33/33/56/989333356.db2.gz MTCBZRCFOWLFTF-WDEREUQCSA-N 2 0 226.389 2.124 20 0 BEADRP CCC1(CC)[C@H]([NH2+]CC[C@H](C)[NH2+]C)C[C@@H]1OC ZINC001326037032 989338231 /nfs/dbraw/zinc/33/82/31/989338231.db2.gz UPRDWGANCDBBQT-XQQFMLRXSA-N 2 0 242.407 2.168 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H]1CC[C@H](C)C[C@H]1C ZINC001326040433 989340901 /nfs/dbraw/zinc/34/09/01/989340901.db2.gz XXINOSBHBUILEK-UMSGYPCISA-N 2 0 212.381 2.399 20 0 BEADRP [NH3+]CC1CCC([NH2+]Cc2cc(C3CC3)no2)CC1 ZINC001119696797 989344580 /nfs/dbraw/zinc/34/45/80/989344580.db2.gz ZOFJWUFLONLFNZ-UHFFFAOYSA-N 2 0 249.358 2.159 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]Cc1ccc(C)cc1C ZINC001326076567 989366101 /nfs/dbraw/zinc/36/61/01/989366101.db2.gz OXKLIGWPZIDYJP-CYBMUJFWSA-N 2 0 220.360 2.391 20 0 BEADRP C[NH+](C)C[C@H]1CCN(CCCC(F)(F)F)C1 ZINC001119930629 989489215 /nfs/dbraw/zinc/48/92/15/989489215.db2.gz AUGLUAMLCFBTJY-SNVBAGLBSA-N 2 0 238.297 2.212 20 0 BEADRP CCOc1ccc(C[NH2+]CCCn2ccnc2)o1 ZINC001120019634 989568259 /nfs/dbraw/zinc/56/82/59/989568259.db2.gz GBZUPPSQQIOOGL-UHFFFAOYSA-N 2 0 249.314 2.055 20 0 BEADRP CCc1cc(N2CCC[N@@H+]3CCC[C@@H]3C2)cc[nH+]1 ZINC001326492223 989583940 /nfs/dbraw/zinc/58/39/40/989583940.db2.gz NVOXXDKOGDTOHY-OAHLLOKOSA-N 2 0 245.370 2.319 20 0 BEADRP Cc1cc(CNCC[C@H](C)[NH+](C)C)cc(C)n1 ZINC001308480027 991007484 /nfs/dbraw/zinc/00/74/84/991007484.db2.gz YNTBUQCUNSWASF-ZDUSSCGKSA-N 2 0 235.375 2.128 20 0 BEADRP C[C@H]1CC(NC(=[NH2+])SCC[NH3+])C[C@H](C)C1 ZINC001258151773 991031575 /nfs/dbraw/zinc/03/15/75/991031575.db2.gz NLCDALBIMQFMIJ-RKDXNWHRSA-N 2 0 229.393 2.027 20 0 BEADRP C[C@H](Cc1ccco1)[N@@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC001258194863 991106658 /nfs/dbraw/zinc/10/66/58/991106658.db2.gz LRTNSWINLFIYFC-UKRRQHHQSA-N 2 0 248.370 2.238 20 0 BEADRP C[C@@H](Cc1ccco1)[NH+]1CCC(N2CCC2)CC1 ZINC001258196804 991109881 /nfs/dbraw/zinc/10/98/81/991109881.db2.gz FPPNQAZUUKZPCE-ZDUSSCGKSA-N 2 0 248.370 2.381 20 0 BEADRP CSCC[C@@H](C)[N@H+](CCC[NH3+])C(C)C ZINC001258200047 991116102 /nfs/dbraw/zinc/11/61/02/991116102.db2.gz OMUVNRFJTADUCI-LLVKDONJSA-N 2 0 218.410 2.187 20 0 BEADRP CSCC[C@@H](C)[NH+]1CCC2(C[NH+](C)C2)CC1 ZINC001258223625 991150109 /nfs/dbraw/zinc/15/01/09/991150109.db2.gz FZIQKUINPUOARF-GFCCVEGCSA-N 2 0 242.432 2.156 20 0 BEADRP CSCC[C@H](C)[NH+]1CCC2(C[NH+](C)C2)CC1 ZINC001258223627 991153020 /nfs/dbraw/zinc/15/30/20/991153020.db2.gz FZIQKUINPUOARF-LBPRGKRZSA-N 2 0 242.432 2.156 20 0 BEADRP CSCC[C@H](C)[NH+]1CC2(C1)CC[NH+](C)CC2 ZINC001258226899 991156798 /nfs/dbraw/zinc/15/67/98/991156798.db2.gz SGUCYYRNLRXVSU-LBPRGKRZSA-N 2 0 242.432 2.156 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)[C@H](C)CCSC ZINC001258224064 991159080 /nfs/dbraw/zinc/15/90/80/991159080.db2.gz KFSBKJHPUADTQA-GFCCVEGCSA-N 2 0 232.437 2.402 20 0 BEADRP C[N@H+](CCO)CCC[NH2+]C1CCCCCCC1 ZINC001258236570 991170833 /nfs/dbraw/zinc/17/08/33/991170833.db2.gz IIJZHQKGLJBHOS-UHFFFAOYSA-N 2 0 242.407 2.003 20 0 BEADRP CCN1CCC[C@@H]([NH2+]CC[C@@]2(C)CC2(F)F)C1 ZINC001308868350 991190864 /nfs/dbraw/zinc/19/08/64/991190864.db2.gz ODRVOEFQBQZDKX-NEPJUHHUSA-N 2 0 246.345 2.496 20 0 BEADRP CC(C)SCC[NH2+][C@@H]1CC[C@@H]2C[N@H+](C)C[C@@H]12 ZINC001308984339 991237169 /nfs/dbraw/zinc/23/71/69/991237169.db2.gz HGSBODJXOVUNOB-JHJVBQTASA-N 2 0 242.432 2.058 20 0 BEADRP CC(C)C[C@H](C)[NH2+]C[C@H]1C[NH+]2CCC1CC2 ZINC001308966002 991241120 /nfs/dbraw/zinc/24/11/20/991241120.db2.gz KVGCQIDOJIZXCI-JSGCOSHPSA-N 2 0 224.392 2.352 20 0 BEADRP CSC(C)(C)C[C@@H](C)[NH2+]C[C@H]1CC[N@H+](C)C1 ZINC001258317017 991242146 /nfs/dbraw/zinc/24/21/46/991242146.db2.gz VFABOCYNBMXCEC-VXGBXAGGSA-N 2 0 244.448 2.448 20 0 BEADRP COc1ccc(CC[C@@H](C)[NH2+]C2CC([NH3+])C2)cc1 ZINC001258393482 991347902 /nfs/dbraw/zinc/34/79/02/991347902.db2.gz TVGDBMFKVFRLLJ-LMWSTFAQSA-N 2 0 248.370 2.096 20 0 BEADRP C[C@@H](CC1CC1)[NH2+][C@H]1CCN(C2CCC2)C1 ZINC001258453928 991403567 /nfs/dbraw/zinc/40/35/67/991403567.db2.gz HAAMQMQEHWTEJM-AAEUAGOBSA-N 2 0 222.376 2.391 20 0 BEADRP CC(C)CN1CC[C@H]([NH2+][C@@H](C)CC2CC2)C1 ZINC001258455261 991406376 /nfs/dbraw/zinc/40/63/76/991406376.db2.gz WQEPJZZPWSYUIE-JSGCOSHPSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[C@@H]2C[N@H+](C)C[C@@H]12 ZINC001560622564 991523308 /nfs/dbraw/zinc/52/33/08/991523308.db2.gz KSRMRUOLXDYHLW-XGFWRYKXSA-N 2 0 222.376 2.105 20 0 BEADRP C[C@H](Cc1cccnc1)[NH2+]CCCCC[NH+](C)C ZINC001258610670 991531455 /nfs/dbraw/zinc/53/14/55/991531455.db2.gz TZLQYTQABKCVRU-CQSZACIVSA-N 2 0 249.402 2.334 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2CC[C@@H](C)[C@@H](F)C2)CC1 ZINC001560708082 991569067 /nfs/dbraw/zinc/56/90/67/991569067.db2.gz BATLXMGYRLGXNN-OCCSQVGLSA-N 2 0 242.382 2.398 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CCSCC[NH3+])CC(C)(C)C1 ZINC001258690175 991620998 /nfs/dbraw/zinc/62/09/98/991620998.db2.gz PEXOVQATZCRBEV-NWDGAFQWSA-N 2 0 244.448 2.483 20 0 BEADRP C[C@H](CC1CCC1)[NH2+][C@@H]1CC[C@@H]2C[N@H+](C)C[C@H]12 ZINC001561052481 991705107 /nfs/dbraw/zinc/70/51/07/991705107.db2.gz BZENTAHWHLDEKX-REBRKWNGSA-N 2 0 236.403 2.495 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CC=CC1 ZINC001258906835 991894056 /nfs/dbraw/zinc/89/40/56/991894056.db2.gz BBIWBVPOHCYCMG-ZDUSSCGKSA-N 2 0 210.365 2.369 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[N@@H+](C)CC ZINC001258907007 991895082 /nfs/dbraw/zinc/89/50/82/991895082.db2.gz CQHZEIXXUFSSML-LBPRGKRZSA-N 2 0 200.370 2.449 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H]1C[C@H](OC)C1 ZINC001258900072 991896449 /nfs/dbraw/zinc/89/64/49/991896449.db2.gz ZOGUNUCGFJMPMO-MGPQQGTHSA-N 2 0 242.407 2.264 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H]1CCc2cc(C)ccc21 ZINC001261423934 992294126 /nfs/dbraw/zinc/29/41/26/992294126.db2.gz JBEAKDVOAZDMPV-DOMZBBRYSA-N 2 0 232.371 2.427 20 0 BEADRP C[C@@H](CSC(C)(C)C)[NH2+]CCCC[NH3+] ZINC001261423995 992293950 /nfs/dbraw/zinc/29/39/50/992293950.db2.gz KNYFAKIVUPIHRE-JTQLQIEISA-N 2 0 218.410 2.235 20 0 BEADRP Cc1csc(CCC[NH2+][C@H](C)C[C@H](C)[NH3+])n1 ZINC001261423317 992296721 /nfs/dbraw/zinc/29/67/21/992296721.db2.gz SXLDABMBUHXRGU-VHSXEESVSA-N 2 0 241.404 2.100 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+]C[C@H]1CCc2ccccc21 ZINC001262202569 992800337 /nfs/dbraw/zinc/80/03/37/992800337.db2.gz XACZCVSTOJTYLF-HIFRSBDPSA-N 2 0 244.382 2.447 20 0 BEADRP Cc1occc1C[NH+]1CCC([C@H]2C[C@H]2[NH3+])CC1 ZINC001574208000 992821774 /nfs/dbraw/zinc/82/17/74/992821774.db2.gz KKOUUCXTHDSPDE-ZIAGYGMSSA-N 2 0 234.343 2.147 20 0 BEADRP C[NH+](C)[C@@H]1CC[C@H]2C[N@H+](Cc3ccco3)C[C@@H]2C1 ZINC001262378400 992871819 /nfs/dbraw/zinc/87/18/19/992871819.db2.gz AULHWUJQRZADQH-MELADBBJSA-N 2 0 248.370 2.442 20 0 BEADRP C1=C[C@H]2CC[C@@H](C1)[N@H+]2CC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC001574774403 992903696 /nfs/dbraw/zinc/90/36/96/992903696.db2.gz MPYHVJZJAAQFQV-OLMTUDMXSA-N 2 0 232.371 2.310 20 0 BEADRP C(C[N@@H+]1CC[C@@H](C2CCC2)C1)[C@@H]1CC[NH2+]C1 ZINC001574773949 992904630 /nfs/dbraw/zinc/90/46/30/992904630.db2.gz HNPIXMNJYDCNHK-GXTWGEPZSA-N 2 0 222.376 2.108 20 0 BEADRP C([NH2+][C@@H]1C[C@H]2CCC[C@H]21)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC001574795358 992909236 /nfs/dbraw/zinc/90/92/36/992909236.db2.gz MJKOLJSNYYXOFH-ZSABPLCXSA-N 2 0 234.387 2.295 20 0 BEADRP C([NH2+][C@@]12CCC[C@@H]1[NH2+]CC2)[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC001574795109 992910197 /nfs/dbraw/zinc/91/01/97/992910197.db2.gz LCGKOWWMEVQSOA-NIFZNCRKSA-N 2 0 234.387 2.297 20 0 BEADRP C([NH2+][C@H]1C[C@@H]2CCC[C@@H]21)[C@H]1CCC[NH2+]CC1 ZINC001574801035 992915016 /nfs/dbraw/zinc/91/50/16/992915016.db2.gz MOUOKBUJCPVYIM-XUXIUFHCSA-N 2 0 222.376 2.154 20 0 BEADRP C=C/C=C\CC[NH2+][C@@H]1CC[NH2+]CC[C@H]1C ZINC001574887722 992935656 /nfs/dbraw/zinc/93/56/56/992935656.db2.gz ASRBXLRMFFLLAJ-DIABFLQPSA-N 2 0 208.349 2.096 20 0 BEADRP CC(C)(C)CC[C@H]([NH3+])C[NH2+][C@H]1CCCC[C@@H]1O ZINC001575131076 992994617 /nfs/dbraw/zinc/99/46/17/992994617.db2.gz SFJJPJQTKQXKSP-AVGNSLFASA-N 2 0 242.407 2.033 20 0 BEADRP CC(C)(C)C[C@@H]1C[C@H]1[NH2+]C1CC(C[NH3+])C1 ZINC001575134186 992995980 /nfs/dbraw/zinc/99/59/80/992995980.db2.gz DLESFCRYXZYALE-POSLAHMBSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@H](C[NH+]1CCC(C)CC1)Nc1cc[nH+]cc1 ZINC001262672910 993015931 /nfs/dbraw/zinc/01/59/31/993015931.db2.gz QVMZLNXSSALERB-CYBMUJFWSA-N 2 0 233.359 2.036 20 0 BEADRP CC(C)[C@@H]1CCC[C@H]1[NH2+][C@H]1CC[NH2+][C@@H]1C ZINC001575498646 993056061 /nfs/dbraw/zinc/05/60/61/993056061.db2.gz NESMMTZNWRKVQZ-MROQNXINSA-N 2 0 210.365 2.151 20 0 BEADRP CC(C)[C@@H]1CCC[C@@H]1[NH2+][C@H]1CC[NH2+][C@@H]1C ZINC001575498655 993056235 /nfs/dbraw/zinc/05/62/35/993056235.db2.gz NESMMTZNWRKVQZ-VOAKCMCISA-N 2 0 210.365 2.151 20 0 BEADRP CC(C)[C@H]1CCC[N@@H+]1C[C@H]1CC[C@@H]([NH3+])C1 ZINC001575500631 993060689 /nfs/dbraw/zinc/06/06/89/993060689.db2.gz MMDWAOAFCKDENK-YNEHKIRRSA-N 2 0 210.365 2.234 20 0 BEADRP CC(C)[C@H]1[N@H+](C[C@H]2C[C@@H]([NH3+])C2)CC12CCC2 ZINC001575519480 993061636 /nfs/dbraw/zinc/06/16/36/993061636.db2.gz CNTRXNRBJQXGTQ-FRRDWIJNSA-N 2 0 222.376 2.234 20 0 BEADRP CC(C)C[NH+]1CCC2(C[NH2+][C@@H]2C(C)C)CC1 ZINC001575599495 993080073 /nfs/dbraw/zinc/08/00/73/993080073.db2.gz CPJNTZCTBSJCHR-CYBMUJFWSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H](C[C@H]1CCC[NH2+]1)[NH2+]C[C@]12C[C@H]1CCC2 ZINC001575941719 993133175 /nfs/dbraw/zinc/13/31/75/993133175.db2.gz UFKISVWAWROACA-DGAVXFQQSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+]C/C=C\c1cccc(F)c1 ZINC001575987488 993152109 /nfs/dbraw/zinc/15/21/09/993152109.db2.gz HVBLPFQIEFKTEK-MZBZXASESA-N 2 0 222.307 2.023 20 0 BEADRP C[C@@H](CO)[N@H+](CCCCCC[NH3+])C1CCCC1 ZINC001576039276 993165160 /nfs/dbraw/zinc/16/51/60/993165160.db2.gz ZFHQRALFSOPKOO-ZDUSSCGKSA-N 2 0 242.407 2.131 20 0 BEADRP CC1(C)[C@H]([NH2+]Cc2cccc3[nH]ccc32)C[C@@H]1[NH3+] ZINC001576380646 993285842 /nfs/dbraw/zinc/28/58/42/993285842.db2.gz WBQSNJTZUDTSBI-UONOGXRCSA-N 2 0 243.354 2.383 20 0 BEADRP CC1(C)CC[C@@H](C[NH2+]C[C@@H]2CCSC2)[NH2+]C1 ZINC001576421067 993301175 /nfs/dbraw/zinc/30/11/75/993301175.db2.gz DSWDSVTVIQEPEG-RYUDHWBXSA-N 2 0 242.432 2.107 20 0 BEADRP CC[C@@H]1C[C@@H]([N@@H+]2CCCC[C@H](C[NH3+])C2)CCO1 ZINC000380075542 993310607 /nfs/dbraw/zinc/31/06/07/993310607.db2.gz RBXVCOGWQJIWAM-HZSPNIEDSA-N 2 0 240.391 2.005 20 0 BEADRP CC[C@@H]1C[C@H]([N@@H+]2CCCC[C@@H](C[NH3+])C2)CCO1 ZINC000380075539 993312435 /nfs/dbraw/zinc/31/24/35/993312435.db2.gz RBXVCOGWQJIWAM-BFHYXJOUSA-N 2 0 240.391 2.005 20 0 BEADRP CC1(C[N@@H+]2C[C@H]3CCC[C@@]3([NH3+])C2)CCCC1 ZINC001576503436 993326105 /nfs/dbraw/zinc/32/61/05/993326105.db2.gz STVWDSLMQGWRNU-TZMCWYRMSA-N 2 0 222.376 2.380 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH2+][C@@H]2C=CCCC2)CC1 ZINC000380360458 993329038 /nfs/dbraw/zinc/32/90/38/993329038.db2.gz YHHHNRMTSMSEEO-CHWSQXEVSA-N 2 0 208.349 2.169 20 0 BEADRP C[C@@]1(CNc2cc3c(c[nH+]2)CCCC3)CC[NH2+]C1 ZINC001576525565 993331099 /nfs/dbraw/zinc/33/10/99/993331099.db2.gz GHCUMHPNNAHFGE-OAHLLOKOSA-N 2 0 245.370 2.372 20 0 BEADRP C[C@]1(F)CCC[N@H+](CCC2CC[NH2+]CC2)C1 ZINC001576527916 993333755 /nfs/dbraw/zinc/33/37/55/993333755.db2.gz LNBXJXGNLRNHTN-ZDUSSCGKSA-N 2 0 228.355 2.200 20 0 BEADRP CC1(c2ccccc2)CC([NH2+]CC2(C[NH3+])CC2)C1 ZINC001576567161 993348111 /nfs/dbraw/zinc/34/81/11/993348111.db2.gz VAESDBJILHJLSU-UHFFFAOYSA-N 2 0 244.382 2.435 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2C[C@@H](C3CC3)[C@@H]2C2CC2)CC[NH2+]1 ZINC001576598528 993363735 /nfs/dbraw/zinc/36/37/35/993363735.db2.gz MGCDWEBVEFKCJJ-MPTQWLOMSA-N 2 0 248.414 2.495 20 0 BEADRP CC1CC(C[NH+]2CCC3(CC[NH2+]CC3)CC2)C1 ZINC001576599188 993364545 /nfs/dbraw/zinc/36/45/45/993364545.db2.gz QKQCQBICWBENMS-UHFFFAOYSA-N 2 0 236.403 2.498 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@H]([NH2+][C@H]2C[C@H]3CC[C@@H]2[NH2+]3)C1 ZINC001576648386 993384416 /nfs/dbraw/zinc/38/44/16/993384416.db2.gz YLNXSWLIRCAFNO-WZBKEBKWSA-N 2 0 222.376 2.294 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+][C@H]1CC[C@@H](C)SC1 ZINC001576670839 993389714 /nfs/dbraw/zinc/38/97/14/993389714.db2.gz MXYCVVPVLINIPR-GRYCIOLGSA-N 2 0 230.421 2.234 20 0 BEADRP C[C@H]1CCC[C@H]([NH2+][C@H]2C[C@H]3CC[C@@H]2[NH2+]3)C1 ZINC001576680894 993392933 /nfs/dbraw/zinc/39/29/33/993392933.db2.gz VUOXQZRVHZKHQU-WJTVCTBASA-N 2 0 208.349 2.048 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C/C=C\C2CC2)CC[N@@H+]1C ZINC000382312871 993448513 /nfs/dbraw/zinc/44/85/13/993448513.db2.gz QPCUKPDTDLLCIG-ZMQQHQCJSA-N 2 0 208.349 2.025 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+][C@H](C)C1CC1 ZINC000382356212 993452284 /nfs/dbraw/zinc/45/22/84/993452284.db2.gz IJGQKTAKXYVQMR-NWDGAFQWSA-N 2 0 212.381 2.495 20 0 BEADRP CC[C@@H](C)[C@@H](C[NH+]1CCC(CC[NH3+])CC1)OC ZINC001576960580 993468870 /nfs/dbraw/zinc/46/88/70/993468870.db2.gz GCNQXWIWULAHFG-TZMCWYRMSA-N 2 0 242.407 2.108 20 0 BEADRP CC[C@@H](C)[C@H](C[NH2+][C@@H](C)C1CC[NH2+]CC1)OC ZINC001576969253 993472900 /nfs/dbraw/zinc/47/29/00/993472900.db2.gz BDCLJGJPRLPMLN-DYEKYZERSA-N 2 0 242.407 2.025 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2CC[C@@H]3C[NH2+]C[C@H]3C2)C[C@H]1C ZINC000383574637 993499686 /nfs/dbraw/zinc/49/96/86/993499686.db2.gz KROHLJIPCZFNHG-ZSAUSMIDSA-N 2 0 236.403 2.352 20 0 BEADRP [NH3+]CCCC[N@@H+]1CC[C@H](OCc2ccccc2)C1 ZINC000383986454 993532524 /nfs/dbraw/zinc/53/25/24/993532524.db2.gz AUYLDGSUBBHUGY-HNNXBMFYSA-N 2 0 248.370 2.016 20 0 BEADRP CC[C@@H]1CCCC[C@H]1C[NH2+][C@H]1C[C@H]([NH3+])C1 ZINC001577254372 993566226 /nfs/dbraw/zinc/56/62/26/993566226.db2.gz JVGQQARKDPIACJ-YVECIDJPSA-N 2 0 210.365 2.282 20 0 BEADRP CC/C=C\CC[NH+]1CCC(OCCC[NH3+])CC1 ZINC001577312769 993585743 /nfs/dbraw/zinc/58/57/43/993585743.db2.gz MEKGYYQLZIPCCU-ARJAWSKDSA-N 2 0 240.391 2.173 20 0 BEADRP CCC[C@@H]([NH2+]C1CC(C[NH3+])C1)C1CCC1 ZINC001577365930 993623346 /nfs/dbraw/zinc/62/33/46/993623346.db2.gz PSVZRDYSLDSRLL-KGPNIALWSA-N 2 0 210.365 2.282 20 0 BEADRP CCCC[C@@H](CC)[NH2+]C[C@@H]1CCC2(C[NH2+]C2)O1 ZINC001577387954 993638813 /nfs/dbraw/zinc/63/88/13/993638813.db2.gz COUJQFSMOSUOMR-OLZOCXBDSA-N 2 0 240.391 2.066 20 0 BEADRP Cc1cccc(C[N@H+]2CC[NH2+]C[C@H](C)C2)c1C ZINC000385170639 993649858 /nfs/dbraw/zinc/64/98/58/993649858.db2.gz FRFXGLKYLQOONW-LBPRGKRZSA-N 2 0 232.371 2.345 20 0 BEADRP C1C[N@@H+](C2CCCCCCC2)[C@@H]2C[NH2+]C[C@H]12 ZINC000385379860 993659825 /nfs/dbraw/zinc/65/98/25/993659825.db2.gz NSWOINBDXRZPET-GXTWGEPZSA-N 2 0 222.376 2.393 20 0 BEADRP COc1ccc(C[N@@H+]2CCCC[C@@H](C[NH3+])C2)cc1 ZINC000386498469 993688218 /nfs/dbraw/zinc/68/82/18/993688218.db2.gz YRHCEPSOMOTCAM-AWEZNQCLSA-N 2 0 248.370 2.256 20 0 BEADRP CCCSC[C@H](C)[NH2+][C@@H]1CC[NH2+][C@H](C)C1 ZINC001577596949 993690178 /nfs/dbraw/zinc/69/01/78/993690178.db2.gz NSKBMHKCZGUWHU-GRYCIOLGSA-N 2 0 230.421 2.248 20 0 BEADRP C[N@H+](C[C@H]1CC1(C)C)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000700672775 993846122 /nfs/dbraw/zinc/84/61/22/993846122.db2.gz NJPMFUKPSUBXGJ-FKJOKYEKSA-N 2 0 222.376 2.247 20 0 BEADRP C[C@H]1C[C@H]([N@@H+]2CCCC(F)(F)CC2)CC[NH2+]1 ZINC000702795779 994049255 /nfs/dbraw/zinc/04/92/55/994049255.db2.gz CHWSYCCGNRHLSC-WDEREUQCSA-N 2 0 232.318 2.248 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H]2C[C@H]([NH3+])C23CCC3)cc1 ZINC001332877638 994380315 /nfs/dbraw/zinc/38/03/15/994380315.db2.gz IPQWTGWOGMJESN-LSDHHAIUSA-N 2 0 244.382 2.397 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H]2C[C@@H]([NH3+])C23CCC3)cc1 ZINC001332877637 994381466 /nfs/dbraw/zinc/38/14/66/994381466.db2.gz IPQWTGWOGMJESN-HUUCEWRRSA-N 2 0 244.382 2.397 20 0 BEADRP C[C@H]1CC[NH2+]C[C@@H]1C[NH2+]C1CCC(F)(F)CC1 ZINC000822168051 994420983 /nfs/dbraw/zinc/42/09/83/994420983.db2.gz JILYMGXKQOJEBG-WDEREUQCSA-N 2 0 246.345 2.400 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]([NH2+]C/C=C/C2CC2)C1 ZINC001334742593 994627615 /nfs/dbraw/zinc/62/76/15/994627615.db2.gz JQTRFVOKYMMJLA-ITDFMYJTSA-N 2 0 222.376 2.320 20 0 BEADRP C[NH+](C)[C@@H]1CC[C@@H]2C[N@H+](CC3CC3)C[C@@H]2C1 ZINC001335584623 994820559 /nfs/dbraw/zinc/82/05/59/994820559.db2.gz WXKFMLDIXIFISH-HZSPNIEDSA-N 2 0 222.376 2.059 20 0 BEADRP C[NH+](C)CC(C)(C)CNc1cc[nH+]cc1 ZINC000020547579 1170118637 /nfs/dbraw/zinc/11/86/37/1170118637.db2.gz ZAZFUYDHPMSGPE-UHFFFAOYSA-N 2 0 207.321 2.081 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@@H]([NH2+]C3CCCCC3)[C@@H]2C1 ZINC001621107915 1170716800 /nfs/dbraw/zinc/71/68/00/1170716800.db2.gz CQWDGDSIFGGARO-IACUBPJLSA-N 2 0 222.376 2.249 20 0 BEADRP C[NH+]1CCC(C)(C[NH2+][C@H]2C[C@@H]3CCC[C@@H]32)CC1 ZINC001621194468 1170736516 /nfs/dbraw/zinc/73/65/16/1170736516.db2.gz UTLCEOHUJZKOCL-IHRRRGAJSA-N 2 0 236.403 2.497 20 0 BEADRP CC[NH+]1CCC(C[N@H+](C)Cc2ccco2)CC1 ZINC001621205676 1170740112 /nfs/dbraw/zinc/74/01/12/1170740112.db2.gz UTDJGPMYGVMQKB-UHFFFAOYSA-N 2 0 236.359 2.443 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2CC[C@H]3C[C@H]3C2)CC1 ZINC001621452397 1170812250 /nfs/dbraw/zinc/81/22/50/1170812250.db2.gz UXTNUILVQQSWJK-KBPBESRZSA-N 2 0 222.376 2.060 20 0 BEADRP Cc1ccccc1C[NH2+]C[C@H]1C[NH+]2CCC1CC2 ZINC001621551824 1170846672 /nfs/dbraw/zinc/84/66/72/1170846672.db2.gz SHASLSPMCZNBSH-INIZCTEOSA-N 2 0 244.382 2.426 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@H]([NH2+][C@@H]3CCC(C)(C)C3)[C@H]2C1 ZINC001621569796 1170855993 /nfs/dbraw/zinc/85/59/93/1170855993.db2.gz FBDVZMFMTKOXJO-CRWXNKLISA-N 2 0 236.403 2.495 20 0 BEADRP CC(C)(C)C[N@@H+]1CCC[C@@]2(CCC[NH2+]C2)C1 ZINC000031994536 1170881591 /nfs/dbraw/zinc/88/15/91/1170881591.db2.gz DGSZIPDFMDDZIR-CQSZACIVSA-N 2 0 224.392 2.498 20 0 BEADRP CC(C)C[NH+](CCCC[NH3+])CC(C)C ZINC000036199049 1170913437 /nfs/dbraw/zinc/91/34/37/1170913437.db2.gz DRWPPPBQWZDUQC-UHFFFAOYSA-N 2 0 200.370 2.339 20 0 BEADRP CCC[NH+](CCC)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000040747656 1171151721 /nfs/dbraw/zinc/15/17/21/1171151721.db2.gz YIDHQNXWTWDJIG-FUNVUKJBSA-N 2 0 210.365 2.391 20 0 BEADRP CC[C@H]([NH3+])C[NH2+]C[C@H](C)Cc1ccccc1 ZINC000414994227 398137896 /nfs/dbraw/zinc/13/78/96/398137896.db2.gz UOFOSMXCIINPDO-OCCSQVGLSA-N 2 0 220.360 2.192 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@H](C)[C@H]2C[C@@H]2C)CC1 ZINC000321645041 398144006 /nfs/dbraw/zinc/14/40/06/398144006.db2.gz VCADHACBDOTYQR-SCRDCRAPSA-N 2 0 224.392 2.352 20 0 BEADRP CCC(CC)(CCO)[NH2+]CC[C@@H]1CCC[N@@H+]1C ZINC000338369533 168320460 /nfs/dbraw/zinc/32/04/60/168320460.db2.gz TUVHTVFRDFZDNH-ZDUSSCGKSA-N 2 0 242.407 2.002 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCCc2ccccc2C1 ZINC000062944542 349502443 /nfs/dbraw/zinc/50/24/43/349502443.db2.gz ABRWOZFRWJSOIW-UHFFFAOYSA-N 2 0 218.344 2.044 20 0 BEADRP COC1CCC([NH2+]C[C@H]2CCC[C@@H]([NH3+])C2)CC1 ZINC000415012469 398153440 /nfs/dbraw/zinc/15/34/40/398153440.db2.gz XHMRDXLEWDZWAX-MRFVTOPCSA-N 2 0 240.391 2.051 20 0 BEADRP CCOCCC1(C[NH2+][C@@H](C)C[C@@H](C)[NH3+])CCC1 ZINC000422942828 398159617 /nfs/dbraw/zinc/15/96/17/398159617.db2.gz QGJMBVDQQYPFRB-OLZOCXBDSA-N 2 0 242.407 2.299 20 0 BEADRP CC[C@H]([NH2+][C@H](C)C[C@H]1CCCO1)[C@@H]1CCC[NH2+]1 ZINC000422906993 398156978 /nfs/dbraw/zinc/15/69/78/398156978.db2.gz WCLMIDOJRUFDLB-MQYQWHSLSA-N 2 0 240.391 2.064 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]Cc1ccc(F)c(F)c1 ZINC000422907627 398157305 /nfs/dbraw/zinc/15/73/05/398157305.db2.gz XGTXIYADKKQZJB-BDAKNGLRSA-N 2 0 228.286 2.180 20 0 BEADRP CC[C@H](C)C[NH2+]C1CCC([NH+](C)C)CC1 ZINC000421376966 192323426 /nfs/dbraw/zinc/32/34/26/192323426.db2.gz SHUBHELYAZCMCY-HIFPTAJRSA-N 2 0 212.381 2.495 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H]1CCO[C@@H](C(C)(C)C)C1 ZINC000423023744 398163438 /nfs/dbraw/zinc/16/34/38/398163438.db2.gz KLUXWNUFJJHPBP-JHJVBQTASA-N 2 0 242.407 2.297 20 0 BEADRP Cc1cc(Cl)ccc1CN1CCC[NH2+]CC1 ZINC000228793024 178066936 /nfs/dbraw/zinc/06/69/36/178066936.db2.gz RAYXGXPAYIHRBE-UHFFFAOYSA-N 2 0 238.762 2.444 20 0 BEADRP c1ccc(C[C@@H]([NH2+]C[C@@H]2CCC[NH2+]2)C2CC2)cc1 ZINC000423233405 398165273 /nfs/dbraw/zinc/16/52/73/398165273.db2.gz JTFFZQSDLFVLBA-JKSUJKDBSA-N 2 0 244.382 2.349 20 0 BEADRP CC(C)C[C@H](C)C[N@@H+]1CC[C@H]([NH3+])C[C@@H]1C ZINC000301012144 349515144 /nfs/dbraw/zinc/51/51/44/349515144.db2.gz YZIPOXSYKJSEMR-AVGNSLFASA-N 2 0 212.381 2.480 20 0 BEADRP Cc1cc(F)ccc1C[N@H+]1C[C@H](C[NH3+])C[C@H]1C ZINC000228060308 178086177 /nfs/dbraw/zinc/08/61/77/178086177.db2.gz DMRVSFGPYCYWEG-NEPJUHHUSA-N 2 0 236.334 2.303 20 0 BEADRP C[C@H]([NH2+][C@H]1CN(C)C[C@H]1C)C1CCCCC1 ZINC000336747141 398190442 /nfs/dbraw/zinc/19/04/42/398190442.db2.gz RURVMIPOHKFHAO-DYEKYZERSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H]1C[C@H]([NH2+]C2CC([NH+](C)C)C2)C[C@@H](C)C1 ZINC000576240171 365534702 /nfs/dbraw/zinc/53/47/02/365534702.db2.gz UGWHFBADGWYEBF-NWFMMLNOSA-N 2 0 224.392 2.493 20 0 BEADRP C[C@H]1CC([NH2+]C2CC([NH+](C)C)C2)C[C@H](C)C1 ZINC000576240170 365535519 /nfs/dbraw/zinc/53/55/19/365535519.db2.gz UGWHFBADGWYEBF-IENTYSSBSA-N 2 0 224.392 2.493 20 0 BEADRP CC/C=C\CC[NH+]1CCC([NH+](C)C)CC1 ZINC000342275353 365542056 /nfs/dbraw/zinc/54/20/56/365542056.db2.gz QRJVZOZBYVZUGS-WAYWQWQTSA-N 2 0 210.365 2.369 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@H](CO)C1CCCCC1 ZINC000386276975 398204234 /nfs/dbraw/zinc/20/42/34/398204234.db2.gz QCVRBWGQTXRTLT-TZMCWYRMSA-N 2 0 242.407 2.035 20 0 BEADRP C[C@H](Cc1cccs1)[NH2+][C@H]1CC[NH2+]C[C@@H]1C ZINC000380746771 398206952 /nfs/dbraw/zinc/20/69/52/398206952.db2.gz SUURLBFAFWATPP-LOWVWBTDSA-N 2 0 238.400 2.267 20 0 BEADRP [NH3+]C[C@@H]1C[N@H+](CCC2CCCCC2)CCCO1 ZINC000313384187 398213871 /nfs/dbraw/zinc/21/38/71/398213871.db2.gz QWRQQNLKAIJEAX-CQSZACIVSA-N 2 0 240.391 2.006 20 0 BEADRP C[N@@H+]1CCC[C@H](CC[NH2+][C@H]2CCC[C@H]3C[C@H]32)C1 ZINC000576362788 365577799 /nfs/dbraw/zinc/57/77/99/365577799.db2.gz UOSBEYXVALMPSV-BARDWOONSA-N 2 0 236.403 2.497 20 0 BEADRP Cc1cc(NC2CC[NH+](C3CC3)CC2)cc[nH+]1 ZINC000274726991 178155295 /nfs/dbraw/zinc/15/52/95/178155295.db2.gz GLZFETSYONZRPP-UHFFFAOYSA-N 2 0 231.343 2.429 20 0 BEADRP Cc1cc(NCC2=CC[N@H+](C)CC2)cc[nH+]1 ZINC000274864465 178157715 /nfs/dbraw/zinc/15/77/15/178157715.db2.gz DLLKJMPNBJIFSU-UHFFFAOYSA-N 2 0 217.316 2.064 20 0 BEADRP CC(C)C[C@@H](C)[NH2+][C@H]1CCN(C2CC2)C1 ZINC000044684207 136221730 /nfs/dbraw/zinc/22/17/30/136221730.db2.gz RXOPLWJTDRXTAW-NEPJUHHUSA-N 2 0 210.365 2.247 20 0 BEADRP CC(C)(C[NH2+][C@@H]1CCC[C@H]([NH3+])C1)c1cccnc1 ZINC000584242206 398221630 /nfs/dbraw/zinc/22/16/30/398221630.db2.gz KYONCADIZWHUNZ-UONOGXRCSA-N 2 0 247.386 2.219 20 0 BEADRP CCC(CC)C[N@@H+]1CCC[C@H](C[NH2+]C)C1 ZINC000040591995 168350619 /nfs/dbraw/zinc/35/06/19/168350619.db2.gz QQYVXTPZADTXJB-CYBMUJFWSA-N 2 0 212.381 2.354 20 0 BEADRP Cc1cc(N[C@@H]2C[C@H](C)[N@@H+](C3CC3)C2)nc(C)n1 ZINC000275772851 178184280 /nfs/dbraw/zinc/18/42/80/178184280.db2.gz HEZKWKBBHHEDKD-CMPLNLGQSA-N 2 0 246.358 2.131 20 0 BEADRP CC[NH+](CC)CCC[N@H+](C)CCC1CC1 ZINC000173367991 259303076 /nfs/dbraw/zinc/30/30/76/259303076.db2.gz VYRLGTRCSYAJKM-UHFFFAOYSA-N 2 0 212.381 2.450 20 0 BEADRP Cc1ccccc1OCCC[N@H+](C)CCC[NH3+] ZINC000430568565 398228712 /nfs/dbraw/zinc/22/87/12/398228712.db2.gz HMPDOTYIYPMECI-UHFFFAOYSA-N 2 0 236.359 2.045 20 0 BEADRP CCC(CC)C[N@@H+]1CC[C@@H]2[NH2+]CC[C@@H]2C1 ZINC000336713139 168353146 /nfs/dbraw/zinc/35/31/46/168353146.db2.gz VJPYILLMAYXVGC-OLZOCXBDSA-N 2 0 210.365 2.106 20 0 BEADRP Cc1cccc(OCC[NH2+][C@](C)(C[NH3+])C2CC2)c1 ZINC000430576962 398229970 /nfs/dbraw/zinc/22/99/70/398229970.db2.gz NHIXGEXJOULXRO-OAHLLOKOSA-N 2 0 248.370 2.091 20 0 BEADRP Cc1cccc(CC[NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)n1 ZINC000280191513 538936886 /nfs/dbraw/zinc/93/68/86/538936886.db2.gz SGBNTLVGKBTOLG-UKRRQHHQSA-N 2 0 247.386 2.005 20 0 BEADRP Cc1cc([C@H](C)[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)no1 ZINC000333893846 178255587 /nfs/dbraw/zinc/25/55/87/178255587.db2.gz YROOBKCGEOCFRD-WUHRBBMRSA-N 2 0 249.358 2.022 20 0 BEADRP CCC(CC)C[NH2+][C@H]1CC[NH2+]CC1(C)C ZINC000300883112 168364600 /nfs/dbraw/zinc/36/46/00/168364600.db2.gz SQHFOJORNTXHBB-LBPRGKRZSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H]1CCC[C@H](C)[N@H+](C[C@H]2CC[NH2+]C2)C1 ZINC000381615838 398253992 /nfs/dbraw/zinc/25/39/92/398253992.db2.gz VEZKRZHDMVYNPY-AGIUHOORSA-N 2 0 210.365 2.106 20 0 BEADRP C(C1CCC1)[N@H+](C1CC1)C1CC[NH2+]CC1 ZINC000381423443 398257444 /nfs/dbraw/zinc/25/74/44/398257444.db2.gz XZFKCOMRZMTZJL-UHFFFAOYSA-N 2 0 208.349 2.003 20 0 BEADRP CC[NH+](CC)CCC[N@@H+]1CCSC[C@@H](C)C1 ZINC000191896817 361827435 /nfs/dbraw/zinc/82/74/35/361827435.db2.gz USNAKJMQYPXUJM-ZDUSSCGKSA-N 2 0 244.448 2.403 20 0 BEADRP C[C@@H]1CCC[C@@H](C)[N@H+](C[C@H]2CC[NH2+]C2)C1 ZINC000381615841 398266864 /nfs/dbraw/zinc/26/68/64/398266864.db2.gz VEZKRZHDMVYNPY-UPJWGTAASA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)[C@H](C)C[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000251282450 398268374 /nfs/dbraw/zinc/26/83/74/398268374.db2.gz DPVZYFJCQRJZFN-MCIONIFRSA-N 2 0 224.392 2.495 20 0 BEADRP CCC[C@H](C)[NH2+]CCC[N@H+](C)C(C)C ZINC000166564058 361852316 /nfs/dbraw/zinc/85/23/16/361852316.db2.gz OLEZZIJKLHVHHJ-LBPRGKRZSA-N 2 0 200.370 2.495 20 0 BEADRP CSC1(C[NH2+]C[C@H]2CCCC[N@H+](C)C2)CC1 ZINC000600191490 342698112 /nfs/dbraw/zinc/69/81/12/342698112.db2.gz PJULDOZPVUFNLO-GFCCVEGCSA-N 2 0 242.432 2.204 20 0 BEADRP Cc1ccc2c(c1)CC[C@@H]2[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000335602160 136235524 /nfs/dbraw/zinc/23/55/24/136235524.db2.gz XGJBEXOZYHLALW-NHYWBVRUSA-N 2 0 230.355 2.180 20 0 BEADRP CC(C)CCC[N@@H+]1CCC[C@H](CC[NH3+])C1 ZINC000165543713 361842296 /nfs/dbraw/zinc/84/22/96/361842296.db2.gz PFJSTGBXRXESFE-CYBMUJFWSA-N 2 0 212.381 2.483 20 0 BEADRP C[C@H]([NH2+]Cc1ccco1)C1CC[NH+](C)CC1 ZINC000037208432 538962015 /nfs/dbraw/zinc/96/20/15/538962015.db2.gz ASYZKBAXCIPCNA-NSHDSACASA-N 2 0 222.332 2.100 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@H](C)[C@@H](C[NH3+])C2)c(C)n1 ZINC000335614039 136237408 /nfs/dbraw/zinc/23/74/08/136237408.db2.gz NHXKWCRLSNABJM-NHYWBVRUSA-N 2 0 247.386 2.115 20 0 BEADRP C[C@@H]([NH2+]CC(C)(C)C)C1CC[NH+](C)CC1 ZINC000040492815 538971873 /nfs/dbraw/zinc/97/18/73/538971873.db2.gz PSVRGXWLCANASJ-LLVKDONJSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H]1CC[C@@H](C)[NH+]1CC[C@@H]1CCC[N@@H+]1C ZINC000162252474 349622259 /nfs/dbraw/zinc/62/22/59/349622259.db2.gz GTVWDZDQMYCWBA-UPJWGTAASA-N 2 0 210.365 2.344 20 0 BEADRP C[N@H+](CCC[NH3+])Cc1nccc2ccccc21 ZINC000381978204 398293508 /nfs/dbraw/zinc/29/35/08/398293508.db2.gz FKANLKSOGZFQAH-UHFFFAOYSA-N 2 0 229.327 2.015 20 0 BEADRP CCN(CC)C[C@H](C)[NH2+][C@@H](C)C(C)C ZINC000045690493 538992903 /nfs/dbraw/zinc/99/29/03/538992903.db2.gz NKJAQYJUORWCSY-RYUDHWBXSA-N 2 0 200.370 2.351 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[C@H]1C)C1CC[NH+](C)CC1 ZINC000379774161 538979828 /nfs/dbraw/zinc/97/98/28/538979828.db2.gz CCGPYMYBGXIEGR-MDZLAQPJSA-N 2 0 210.365 2.105 20 0 BEADRP CN1CCC[C@H]([NH2+][C@H]2CCC23CCCC3)C1 ZINC000381647620 539005707 /nfs/dbraw/zinc/00/57/07/539005707.db2.gz CASKNXNUNIVDPF-STQMWFEESA-N 2 0 222.376 2.393 20 0 BEADRP Cc1csc([C@H](C)[NH2+]CCCC[NH+](C)C)n1 ZINC000381750598 539006404 /nfs/dbraw/zinc/00/64/04/539006404.db2.gz RBFGSHDBHFWQDH-NSHDSACASA-N 2 0 241.404 2.444 20 0 BEADRP C[C@@H]([NH2+][C@H]1CSC[C@H]1C)C1CC[NH+](C)CC1 ZINC000381433356 539000681 /nfs/dbraw/zinc/00/06/81/539000681.db2.gz CAEHXCWCQNIAME-WZRBSPASSA-N 2 0 242.432 2.058 20 0 BEADRP C[C@H](C[NH2+]CC1(C)CC1)N1CCC(C)CC1 ZINC000390504876 539022791 /nfs/dbraw/zinc/02/27/91/539022791.db2.gz WOIKDSFQNDILJZ-CYBMUJFWSA-N 2 0 224.392 2.497 20 0 BEADRP CCC[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000134871884 342909111 /nfs/dbraw/zinc/90/91/11/342909111.db2.gz KUKRNAUGFUSGAA-TZMCWYRMSA-N 2 0 222.376 2.345 20 0 BEADRP CSC[C@@H](C)[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000134013988 398328568 /nfs/dbraw/zinc/32/85/68/398328568.db2.gz KCBFBOLVVVDJPH-MNOVXSKESA-N 2 0 230.421 2.058 20 0 BEADRP CC(C)CCC[NH2+]CCN(C)C(C)C ZINC000053344163 346886760 /nfs/dbraw/zinc/88/67/60/346886760.db2.gz HMBMBXPZVRXQII-UHFFFAOYSA-N 2 0 200.370 2.352 20 0 BEADRP C[C@@H](NCC[NH3+])c1ccc(Br)cc1 ZINC000037712342 342942515 /nfs/dbraw/zinc/94/25/15/342942515.db2.gz UYENUOREVSFEGF-MRVPVSSYSA-N 2 0 243.148 2.058 20 0 BEADRP CSCC[C@@H](C)[N@H+](C)CCC1CC[NH2+]CC1 ZINC000156910542 398339687 /nfs/dbraw/zinc/33/96/87/398339687.db2.gz ZIWWWCPNIHIGNO-GFCCVEGCSA-N 2 0 244.448 2.450 20 0 BEADRP CC[C@H](CSC)[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000162387444 349684176 /nfs/dbraw/zinc/68/41/76/349684176.db2.gz MRYSGFNAQBSGMJ-JHJVBQTASA-N 2 0 242.432 2.344 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H]1CC[C@@H]1C(C)(C)C ZINC000576814628 365691116 /nfs/dbraw/zinc/69/11/16/365691116.db2.gz FXMNNLJGFDILLL-NWDGAFQWSA-N 2 0 212.381 2.400 20 0 BEADRP CC(C)C[C@@H](C)[N@@H+]1CC[C@H](C[NH+](C)C)C1 ZINC000355693237 187212846 /nfs/dbraw/zinc/21/28/46/187212846.db2.gz VBYXETRAMKOWCI-CHWSQXEVSA-N 2 0 212.381 2.305 20 0 BEADRP Cc1ccc(C[NH2+]C[C@@H]2CCC[N@@H+](C)C2)s1 ZINC000044534339 343009008 /nfs/dbraw/zinc/00/90/08/343009008.db2.gz HLBWHADIAQDQGD-LBPRGKRZSA-N 2 0 238.400 2.488 20 0 BEADRP C([C@@H]1CC[N@@H+](C2CCCC2)C1)[NH+]1CCCC1 ZINC000120102058 187222565 /nfs/dbraw/zinc/22/25/65/187222565.db2.gz KJAHEQMMGPZNKL-ZDUSSCGKSA-N 2 0 222.376 2.347 20 0 BEADRP FC(F)(F)[C@H]1CCC[C@@H]([NH2+][C@H]2CC[NH2+]C2)C1 ZINC000521272157 259344602 /nfs/dbraw/zinc/34/46/02/259344602.db2.gz SJVXEZYSOZHYDR-AEJSXWLSSA-N 2 0 236.281 2.059 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C2CCCC2)[C@H]2CCC[C@@H]21 ZINC000367625810 187229267 /nfs/dbraw/zinc/22/92/67/187229267.db2.gz ZAJPPFXMGKLSJP-RDBSUJKOSA-N 2 0 222.376 2.391 20 0 BEADRP CC(C)[C@H](C)C[NH2+][C@H](C)[C@H]1CCCC[NH2+]1 ZINC000386597520 343079208 /nfs/dbraw/zinc/07/92/08/343079208.db2.gz TWAVFVOTNYPPMK-JHJVBQTASA-N 2 0 212.381 2.399 20 0 BEADRP CC(C)[C@H](C)C[NH2+][C@@H](C)[C@H]1CCCC[NH2+]1 ZINC000386597518 343079290 /nfs/dbraw/zinc/07/92/90/343079290.db2.gz TWAVFVOTNYPPMK-FRRDWIJNSA-N 2 0 212.381 2.399 20 0 BEADRP COCC[N@H+](C)CCC[NH2+]C1CCCCCC1 ZINC000119550111 343083722 /nfs/dbraw/zinc/08/37/22/343083722.db2.gz YSZAWPZBOVICJT-UHFFFAOYSA-N 2 0 242.407 2.267 20 0 BEADRP C[C@H]([NH2+]CCCC(F)(F)F)[C@@H]1CCCC[NH2+]1 ZINC000386593043 343078614 /nfs/dbraw/zinc/07/86/14/343078614.db2.gz RYXIFBASAVJXLA-UWVGGRQHSA-N 2 0 238.297 2.449 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@H](C)C2CCC2)CC1 ZINC000309938337 343099839 /nfs/dbraw/zinc/09/98/39/343099839.db2.gz AUGMEVJMYNVPQT-GFCCVEGCSA-N 2 0 224.392 2.497 20 0 BEADRP CCC(C)(C)[C@H](C)[NH2+]C[C@@H](C)C[NH2+]C ZINC000562956129 323034900 /nfs/dbraw/zinc/03/49/00/323034900.db2.gz GUHFQKHMQXIKHB-QWRGUYRKSA-N 2 0 200.370 2.256 20 0 BEADRP C(CC1CCCC1)[NH2+][C@H]1CCC[NH2+]CC1 ZINC000168730222 136269865 /nfs/dbraw/zinc/26/98/65/136269865.db2.gz SZYQSOXBDMDXHU-ZDUSSCGKSA-N 2 0 210.365 2.298 20 0 BEADRP C[C@@H]1CCC[N@H+](C[C@H]2CCC[NH2+]C2)[C@@H]1C ZINC000252111302 343125771 /nfs/dbraw/zinc/12/57/71/343125771.db2.gz HUHIKYFQIDCGHS-UPJWGTAASA-N 2 0 210.365 2.106 20 0 BEADRP Cc1cccc(CC[NH2+][C@H]2CCC[C@H]([NH3+])C2)c1 ZINC000093215804 343151291 /nfs/dbraw/zinc/15/12/91/343151291.db2.gz NDSSOEYVZJXMRE-GJZGRUSLSA-N 2 0 232.371 2.397 20 0 BEADRP CC[N@H+](CCCCCC[NH3+])Cc1ccccn1 ZINC000094918303 343154083 /nfs/dbraw/zinc/15/40/83/343154083.db2.gz HOJVXWVIFNOWJH-UHFFFAOYSA-N 2 0 235.375 2.423 20 0 BEADRP C[N@H+](CCC[NH3+])Cc1cc(F)cc2cccnc21 ZINC000123281088 343162317 /nfs/dbraw/zinc/16/23/17/343162317.db2.gz DVLBCVBQYGVLAH-UHFFFAOYSA-N 2 0 247.317 2.155 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]CCCC(F)(F)F)C1 ZINC000123990339 343166290 /nfs/dbraw/zinc/16/62/90/343166290.db2.gz UDCYSSTZDPOBOQ-RKDXNWHRSA-N 2 0 224.270 2.188 20 0 BEADRP C[C@@H]1C[C@H]1CN1CCC2(CCC[N@@H+]2C)CC1 ZINC000625291167 343223184 /nfs/dbraw/zinc/22/31/84/343223184.db2.gz XSLNPLORXUHXER-OLZOCXBDSA-N 2 0 222.376 2.203 20 0 BEADRP C[C@@H]1CCC[N@H+](CC2CC[NH2+]CC2)CC1 ZINC000082489422 136276788 /nfs/dbraw/zinc/27/67/88/136276788.db2.gz ZQSDYNJLFGOBEO-GFCCVEGCSA-N 2 0 210.365 2.108 20 0 BEADRP C([C@@H]1CCC[NH2+]C1)[N@@H+]1CC[C@@H]2CCCC[C@@H]21 ZINC000133881413 343186398 /nfs/dbraw/zinc/18/63/98/343186398.db2.gz FBMBTGOZXWCKOA-RDBSUJKOSA-N 2 0 222.376 2.251 20 0 BEADRP Cc1cc(C[N@H+](C)CCC[NH3+])c(C)s1 ZINC000133223964 343190294 /nfs/dbraw/zinc/19/02/94/343190294.db2.gz HGTBPAXGBCREGL-UHFFFAOYSA-N 2 0 212.362 2.146 20 0 BEADRP [NH3+]CCC[NH2+][C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000069381553 343277893 /nfs/dbraw/zinc/27/78/93/343277893.db2.gz IJAWRVGOGPHHBA-BDAKNGLRSA-N 2 0 224.270 2.046 20 0 BEADRP CCCCC[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@@H]1C ZINC000036907537 343327646 /nfs/dbraw/zinc/32/76/46/343327646.db2.gz YUXAOOKQNMXUKB-YNEHKIRRSA-N 2 0 212.381 2.495 20 0 BEADRP CC[NH+](CC)CCNc1cc[nH+]cc1C ZINC000070046535 343296956 /nfs/dbraw/zinc/29/69/56/343296956.db2.gz NGVODGXPDPDPOZ-UHFFFAOYSA-N 2 0 207.321 2.144 20 0 BEADRP Cc1nc(C[NH2+]C2CCC([NH3+])CC2)sc1C ZINC000335635762 136300548 /nfs/dbraw/zinc/30/05/48/136300548.db2.gz WSFDKYUTQKDEOA-UHFFFAOYSA-N 2 0 239.388 2.119 20 0 BEADRP C[C@@H]1CCC[C@H]1[NH2+]CCC[NH+]1CCCC1 ZINC000070829456 343341349 /nfs/dbraw/zinc/34/13/49/343341349.db2.gz VZDJMBHXFJTVMJ-CHWSQXEVSA-N 2 0 210.365 2.251 20 0 BEADRP c1ccc2c(c1)CC[C@@H]2C[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000335650856 136305134 /nfs/dbraw/zinc/30/51/34/136305134.db2.gz QSELBDNLLMWYPW-HUUCEWRRSA-N 2 0 244.382 2.448 20 0 BEADRP C([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)C1CCCC1 ZINC000335654548 136306069 /nfs/dbraw/zinc/30/60/69/136306069.db2.gz OUXBBELCPYOJAQ-FUNVUKJBSA-N 2 0 208.349 2.049 20 0 BEADRP Cc1ccccc1C[N@H+]1CC[C@@H]([C@@H](C)[NH3+])C1 ZINC000166214937 136309434 /nfs/dbraw/zinc/30/94/34/136309434.db2.gz HXBYFTYRGJLPQR-TZMCWYRMSA-N 2 0 218.344 2.164 20 0 BEADRP C1=CC[C@H](C[NH2+]CCC[NH+]2CCCC2)CC1 ZINC000020129168 187257359 /nfs/dbraw/zinc/25/73/59/187257359.db2.gz VWNOVTRBLICBHP-AWEZNQCLSA-N 2 0 222.376 2.418 20 0 BEADRP CCSCC[N@H+](CC)CCC[NH+](C)C ZINC000349422866 136345615 /nfs/dbraw/zinc/34/56/15/136345615.db2.gz VWRZCVRMQFJCKF-UHFFFAOYSA-N 2 0 218.410 2.013 20 0 BEADRP Cc1ccccc1C[N@H+](C)CC1CC[NH2+]CC1 ZINC000042436118 343437484 /nfs/dbraw/zinc/43/74/84/343437484.db2.gz JZLWVQZLDQZSQS-UHFFFAOYSA-N 2 0 232.371 2.426 20 0 BEADRP C[N@H+](CC1CCCC1)C[C@@]1(C)CC[NH2+]C1 ZINC000082493360 343442202 /nfs/dbraw/zinc/44/22/02/343442202.db2.gz NZHUSEDBVPAZKP-ZDUSSCGKSA-N 2 0 210.365 2.108 20 0 BEADRP CC(C)c1ccc(C[NH2+]C[C@@H](C)C[NH3+])cc1 ZINC000258739871 136373791 /nfs/dbraw/zinc/37/37/91/136373791.db2.gz KUFRQASWAWAQRK-LBPRGKRZSA-N 2 0 220.360 2.494 20 0 BEADRP CCCCC[NH+]1CCC2(CC[NH2+]C2)CC1 ZINC000084477028 343532042 /nfs/dbraw/zinc/53/20/42/343532042.db2.gz XORINUVMEKXICK-UHFFFAOYSA-N 2 0 210.365 2.252 20 0 BEADRP C[C@@H]1CC[N@H+](CCC2CCC2)C[C@H]1C[NH3+] ZINC000398701228 488222221 /nfs/dbraw/zinc/22/22/21/488222221.db2.gz KBUWTBZEIMGUGB-DGCLKSJQSA-N 2 0 210.365 2.093 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H](C)Cc1ccsc1 ZINC000570183455 323052177 /nfs/dbraw/zinc/05/21/77/323052177.db2.gz KJLVMLCYTRRWHO-WDEREUQCSA-N 2 0 226.389 2.124 20 0 BEADRP [NH3+]C1(C[NH2+]C(C2CC2)C2CC2)CCCCC1 ZINC000049237948 343595053 /nfs/dbraw/zinc/59/50/53/343595053.db2.gz HJVZAOIGRPOFNO-UHFFFAOYSA-N 2 0 222.376 2.426 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H](C)Cc1ccsc1 ZINC000379976748 365771949 /nfs/dbraw/zinc/77/19/49/365771949.db2.gz QVUALFNMFKZJMP-MNOVXSKESA-N 2 0 226.389 2.396 20 0 BEADRP CCC[C@H](C)[NH2+][C@H](C)C1CC[NH+](C)CC1 ZINC000037209014 537790947 /nfs/dbraw/zinc/79/09/47/537790947.db2.gz LQEHKJWGWAWLSZ-NWDGAFQWSA-N 2 0 212.381 2.495 20 0 BEADRP C[C@@H]1C[C@@H](C)[N@H+](CCC2CCC2)C[C@@H]1C[NH3+] ZINC000398899095 488225686 /nfs/dbraw/zinc/22/56/86/488225686.db2.gz HDQKYRDYWUNLJW-BZPMIXESSA-N 2 0 224.392 2.482 20 0 BEADRP Cc1ccc(C[NH2+][C@H](C)CC[NH+](C)C)cc1 ZINC000049551774 343601970 /nfs/dbraw/zinc/60/19/70/343601970.db2.gz JRXNQGRRTWIMOE-CYBMUJFWSA-N 2 0 220.360 2.425 20 0 BEADRP Cc1cc(C)c(C[N@H+](C)CCC[NH3+])c(C)c1 ZINC000053299898 343646470 /nfs/dbraw/zinc/64/64/70/343646470.db2.gz NMRXMDIFNAOZBD-UHFFFAOYSA-N 2 0 220.360 2.392 20 0 BEADRP CCC([NH3+])(CC)C[NH2+]C(C1CC1)C1CC1 ZINC000086814566 343630016 /nfs/dbraw/zinc/63/00/16/343630016.db2.gz YUWMDWMWMRGUMC-UHFFFAOYSA-N 2 0 210.365 2.282 20 0 BEADRP COc1ccc(CC[N@@H+]2CC[C@@H]([NH3+])C[C@H]2C)cc1 ZINC000049707591 187270432 /nfs/dbraw/zinc/27/04/32/187270432.db2.gz XRWCGEOGVYZXEM-TZMCWYRMSA-N 2 0 248.370 2.049 20 0 BEADRP CC(C)[NH2+]C1CC[NH+](CC2(C)CC2)CC1 ZINC000309082472 346960554 /nfs/dbraw/zinc/96/05/54/346960554.db2.gz RUDYGKTXSUHSLQ-UHFFFAOYSA-N 2 0 210.365 2.249 20 0 BEADRP CC/C=C\CC[N@@H+]1CC[C@@H](C[NH+](C)C)C1 ZINC000342251176 343726933 /nfs/dbraw/zinc/72/69/33/343726933.db2.gz RBWKHNLHBQMAJB-SZZPACECSA-N 2 0 210.365 2.226 20 0 BEADRP [NH3+][C@]12CCC[C@H]1C[N@H+](CCCc1ccccc1)C2 ZINC000621777906 343903404 /nfs/dbraw/zinc/90/34/04/343903404.db2.gz IOPNTWHDPAVJLJ-HOTGVXAUSA-N 2 0 244.382 2.432 20 0 BEADRP Cn1cncc1CC[N@@H+]1CCCC(F)(F)CC1 ZINC000625770120 344065669 /nfs/dbraw/zinc/06/56/69/344065669.db2.gz GNYZOWVTGZZYEJ-UHFFFAOYSA-N 2 0 243.301 2.084 20 0 BEADRP Cc1ccoc1CNC[C@H]1CCC[N@@H+](C)C1 ZINC000126789759 344103460 /nfs/dbraw/zinc/10/34/60/344103460.db2.gz ADQPUZYJJUHMPD-GFCCVEGCSA-N 2 0 222.332 2.019 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H](C)Cc1ccsc1 ZINC000573355048 344107577 /nfs/dbraw/zinc/10/75/77/344107577.db2.gz BARGFHMVQRZUIL-LLVKDONJSA-N 2 0 226.389 2.268 20 0 BEADRP C[C@@H]1C[C@H]1C[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000634733442 344113308 /nfs/dbraw/zinc/11/33/08/344113308.db2.gz FYIFOVKNAVEJGV-WOPDTQHZSA-N 2 0 210.365 2.010 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]([NH2+]C[C@@H]2CCSC2)C1 ZINC000634733551 344113977 /nfs/dbraw/zinc/11/39/77/344113977.db2.gz IFRUGNZJBBGVSD-RYUDHWBXSA-N 2 0 242.432 2.107 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)C1CC1 ZINC000093977908 344150532 /nfs/dbraw/zinc/15/05/32/344150532.db2.gz WFDMGXKNUNUYAG-WCFLWFBJSA-N 2 0 208.349 2.001 20 0 BEADRP CC1(C)CC[C@H]([NH2+]CC[C@@H]2CC[NH2+]C2)C1 ZINC000129537973 344213790 /nfs/dbraw/zinc/21/37/90/344213790.db2.gz LPLWZBQZGZJUEG-RYUDHWBXSA-N 2 0 210.365 2.154 20 0 BEADRP CC[C@@H](C)C[N@H+](C)CC[C@H]([NH3+])C(C)C ZINC000133306139 344317523 /nfs/dbraw/zinc/31/75/23/344317523.db2.gz YEMUEODYKFDVIA-NEPJUHHUSA-N 2 0 200.370 2.338 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+]C(C1CC1)C1CC1 ZINC000569567506 344319703 /nfs/dbraw/zinc/31/97/03/344319703.db2.gz WAHZOPKSZYZBGI-DOOHLRMFSA-N 2 0 234.387 2.281 20 0 BEADRP C[N@H+](C[C@H]1CCSC1)C[C@H]1CCC[NH+](C)C1 ZINC000495060198 529972384 /nfs/dbraw/zinc/97/23/84/529972384.db2.gz PZLZHIVKCRPXJB-QWHCGFSZSA-N 2 0 242.432 2.013 20 0 BEADRP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]CCC(C)(C)C ZINC000132721739 344307400 /nfs/dbraw/zinc/30/74/00/344307400.db2.gz DKIJWELMUNGWSK-RYUDHWBXSA-N 2 0 212.381 2.352 20 0 BEADRP Cc1cc(N2CCC[C@@H](C)[C@H]2CCC[NH3+])ncn1 ZINC000634811938 344396466 /nfs/dbraw/zinc/39/64/66/344396466.db2.gz VENGNXXOFCVYAE-DGCLKSJQSA-N 2 0 248.374 2.129 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CCc1ccc(F)cc1F ZINC000584285625 344419549 /nfs/dbraw/zinc/41/95/49/344419549.db2.gz VMPIVKFNKSBTDD-ZJUUUORDSA-N 2 0 242.313 2.223 20 0 BEADRP CC(C)C[N@H+](C[C@H]1CCC[NH2+]C1)C1CC1 ZINC000042559899 344458382 /nfs/dbraw/zinc/45/83/82/344458382.db2.gz RHKHNROQKDUASW-LBPRGKRZSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H](C[C@H]1CCCCC[NH2+]1)[NH2+]CCCF ZINC000389331098 344459851 /nfs/dbraw/zinc/45/98/51/344459851.db2.gz LSBQSZKBCBJWRI-NWDGAFQWSA-N 2 0 216.344 2.246 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[C@H]([NH3+])C1)c1cscn1 ZINC000570832112 323072260 /nfs/dbraw/zinc/07/22/60/323072260.db2.gz UDPRERXALFDIIF-AXFHLTTASA-N 2 0 239.388 2.311 20 0 BEADRP C[N@H+]1CC=C(C[NH2+][C@H]2CC[C@H]2C2CC2)CC1 ZINC000336775439 537846382 /nfs/dbraw/zinc/84/63/82/537846382.db2.gz ZARUZAPKYKPJOW-KBPBESRZSA-N 2 0 220.360 2.027 20 0 BEADRP C[N@H+]1CC=C(C[NH2+][C@H]2CC[C@@H]2C2CC2)CC1 ZINC000336775440 537847471 /nfs/dbraw/zinc/84/74/71/537847471.db2.gz ZARUZAPKYKPJOW-KGLIPLIRSA-N 2 0 220.360 2.027 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@H](F)C1)[C@H]1CCC[NH2+]C1 ZINC000573967521 344580250 /nfs/dbraw/zinc/58/02/50/344580250.db2.gz SOZKQKOMJUXOMT-ZDEQEGDKSA-N 2 0 228.355 2.245 20 0 BEADRP CC1(C)CC[C@H]1[NH2+]Cc1ccc(C[NH3+])cc1 ZINC000309435098 347061326 /nfs/dbraw/zinc/06/13/26/347061326.db2.gz MOFNQIVRGMBXQN-CYBMUJFWSA-N 2 0 218.344 2.424 20 0 BEADRP Fc1cnccc1NC[C@H]1CCCC[N@@H+]1C1CC1 ZINC000641538868 362488433 /nfs/dbraw/zinc/48/84/33/362488433.db2.gz UPGWAURAAXSRPK-GFCCVEGCSA-N 2 0 249.333 2.071 20 0 BEADRP Fc1cnccc1NC[C@@H]1CCCC[N@@H+]1C1CC1 ZINC000641538869 362489263 /nfs/dbraw/zinc/48/92/63/362489263.db2.gz UPGWAURAAXSRPK-LBPRGKRZSA-N 2 0 249.333 2.071 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+]C[C@H]1CC=CCC1 ZINC000049553547 344653271 /nfs/dbraw/zinc/65/32/71/344653271.db2.gz ZMLBAOYXPHHSGY-STQMWFEESA-N 2 0 210.365 2.273 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+]C2CC3(CCC3)C2)C1 ZINC000309970028 259378809 /nfs/dbraw/zinc/37/88/09/259378809.db2.gz PADGODGESXRASY-GFCCVEGCSA-N 2 0 222.376 2.251 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H]1[C@H](C)O[C@@H](C)[C@H]1C ZINC000625975927 344639908 /nfs/dbraw/zinc/63/99/08/344639908.db2.gz FRCUZDVTUIUZNZ-RFGFWPKPSA-N 2 0 242.407 2.120 20 0 BEADRP CSC[C@H]1CCC[N@@H+]1CC[C@@H]1CCC[NH2+]C1 ZINC000399997685 344748898 /nfs/dbraw/zinc/74/88/98/344748898.db2.gz LJDNHOMCPUFNNE-QWHCGFSZSA-N 2 0 242.432 2.204 20 0 BEADRP CSC1(C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)CCC1 ZINC000235092035 344782228 /nfs/dbraw/zinc/78/22/28/344782228.db2.gz NIZILLLCRWFDHJ-GHMZBOCLSA-N 2 0 228.405 2.132 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CCc2ccco2)[C@H](C)C1 ZINC000155952193 345116148 /nfs/dbraw/zinc/11/61/48/345116148.db2.gz OISFXISJZCXXBA-OCCSQVGLSA-N 2 0 236.359 2.142 20 0 BEADRP FC(F)(F)CC[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000156094127 345121953 /nfs/dbraw/zinc/12/19/53/345121953.db2.gz RZFHHEKWLBLFOH-NXEZZACHSA-N 2 0 236.281 2.155 20 0 BEADRP C[C@H]1CC[C@@]2(CC[N@H+](CC34CC(C3)C[NH2+]4)C2)C1 ZINC000634993342 345189681 /nfs/dbraw/zinc/18/96/81/345189681.db2.gz RGXBIWJSOMYDSP-FGZQJIAISA-N 2 0 234.387 2.251 20 0 BEADRP C[C@@H]1CC[C@]2(CC[N@H+](CC34CC(C3)C[NH2+]4)C2)C1 ZINC000634993343 345189685 /nfs/dbraw/zinc/18/96/85/345189685.db2.gz RGXBIWJSOMYDSP-JLVJUDLZSA-N 2 0 234.387 2.251 20 0 BEADRP C(C1CC1)[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000156528117 345176957 /nfs/dbraw/zinc/17/69/57/345176957.db2.gz FPSVKDIZUXOLBH-CQSZACIVSA-N 2 0 222.376 2.204 20 0 BEADRP Cc1cccc(C)c1CCNCC12CC(C1)C[NH2+]2 ZINC000634995358 345184634 /nfs/dbraw/zinc/18/46/34/345184634.db2.gz BQBLXSRAGFWKSG-UHFFFAOYSA-N 2 0 244.382 2.188 20 0 BEADRP CCC(C)(C)CC[NH2+][C@@H]1CCOC[C@H]1[C@H](C)[NH3+] ZINC000635021951 345224224 /nfs/dbraw/zinc/22/42/24/345224224.db2.gz QHQIXDIHJMQKOK-RWMBFGLXSA-N 2 0 242.407 2.155 20 0 BEADRP C1CC12CCC[C@@H]2[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000634997075 345193848 /nfs/dbraw/zinc/19/38/48/345193848.db2.gz CEDUWSXKJHUWAF-RQJABVFESA-N 2 0 234.387 2.297 20 0 BEADRP C/C=C\C[C@@H]1CCCN(CC23CC(C2)C[NH2+]3)C1 ZINC000634997044 345193974 /nfs/dbraw/zinc/19/39/74/345193974.db2.gz BOHQHWUXFLHQOD-IORDILMOSA-N 2 0 234.387 2.417 20 0 BEADRP Cc1ccc(F)c(C[N@@H+]2C[C@@H](C[NH3+])[C@H](C)C2)c1 ZINC000634998070 345197126 /nfs/dbraw/zinc/19/71/26/345197126.db2.gz AHFLQVFFPQKLAF-DGCLKSJQSA-N 2 0 236.334 2.161 20 0 BEADRP C[C@H](C[C@@H]1CCC[NH2+]1)[NH2+][C@@H]1CCCC12CC2 ZINC000634997610 345197394 /nfs/dbraw/zinc/19/73/94/345197394.db2.gz OZHRGDSBCCWAAX-FRRDWIJNSA-N 2 0 222.376 2.439 20 0 BEADRP Cc1ccc(F)c(C[N@H+]2C[C@H](C)[C@H](C[NH3+])C2)c1 ZINC000634998071 345197696 /nfs/dbraw/zinc/19/76/96/345197696.db2.gz AHFLQVFFPQKLAF-WCQYABFASA-N 2 0 236.334 2.161 20 0 BEADRP Cc1ccc(C[N@H+]2C[C@H](C)[C@H](C[NH3+])C2)s1 ZINC000634998707 345198506 /nfs/dbraw/zinc/19/85/06/345198506.db2.gz JNKPVLKOTDWMFG-GXSJLCMTSA-N 2 0 224.373 2.083 20 0 BEADRP C[C@@H]1C[C@H](C[NH2+][C@]23C[C@H]2CCCC3)CC[NH2+]1 ZINC000635001146 345202729 /nfs/dbraw/zinc/20/27/29/345202729.db2.gz IFJHLBGPOZYKMN-AAVRWANBSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)c1ccccn1 ZINC000635003670 345207065 /nfs/dbraw/zinc/20/70/65/345207065.db2.gz ARALWFUIFVXNDB-AVGNSLFASA-N 2 0 233.359 2.250 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCCC12CC2)[C@H]1CCC[NH2+]1 ZINC000635004141 345207137 /nfs/dbraw/zinc/20/71/37/345207137.db2.gz NIZKQMVSGFFRPZ-IJLUTSLNSA-N 2 0 208.349 2.049 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[NH2+]CC(C)(C)C1)[C@H]1C[C@H]1C ZINC000635004763 345208303 /nfs/dbraw/zinc/20/83/03/345208303.db2.gz DXGHRNMIGISELR-VOAKCMCISA-N 2 0 224.392 2.399 20 0 BEADRP C[C@H]([NH2+]CC[C@H]([NH3+])Cc1ccccc1)C1CC1 ZINC000635004676 345208633 /nfs/dbraw/zinc/20/86/33/345208633.db2.gz JWNZMHJFOVRCMR-WFASDCNBSA-N 2 0 232.371 2.335 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H]1CCCC12CC2 ZINC000635006055 345210447 /nfs/dbraw/zinc/21/04/47/345210447.db2.gz XGEYYWCHAYYBIT-NWDGAFQWSA-N 2 0 210.365 2.426 20 0 BEADRP CC(C)(F)C[NH2+][C@@H]1CCC[C@H]1[C@H]1CCC[NH2+]1 ZINC000635006496 345210480 /nfs/dbraw/zinc/21/04/80/345210480.db2.gz YWAONWNFLDVRLK-QJPTWQEYSA-N 2 0 228.355 2.245 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)c1cscn1 ZINC000635006407 345210614 /nfs/dbraw/zinc/21/06/14/345210614.db2.gz REVHKUBRQYPDQG-DCAQKATOSA-N 2 0 239.388 2.311 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)c1cscn1 ZINC000635006418 345210788 /nfs/dbraw/zinc/21/07/88/345210788.db2.gz REVHKUBRQYPDQG-GMTAPVOTSA-N 2 0 239.388 2.311 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CC[C@H]1CNc2ccccc21 ZINC000635010076 345212028 /nfs/dbraw/zinc/21/20/28/345212028.db2.gz XYXZJZPIJCJWOG-AVGNSLFASA-N 2 0 247.386 2.301 20 0 BEADRP Cc1c[nH+]ccc1N[C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000158368084 345327063 /nfs/dbraw/zinc/32/70/63/345327063.db2.gz QREUCTWCOMPDIR-QWHCGFSZSA-N 2 0 231.343 2.429 20 0 BEADRP C[C@H](CCC1CC1)[NH2+]C1CCC([NH3+])CC1 ZINC000336745085 187306988 /nfs/dbraw/zinc/30/69/88/187306988.db2.gz QNZWZOFJXRSBKG-QFWMXSHPSA-N 2 0 210.365 2.425 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+][C@H](C)[C@H]1CCC[NH2+]C1 ZINC000319086433 259384185 /nfs/dbraw/zinc/38/41/85/259384185.db2.gz CFDFSSKWACRCEZ-RVMXOQNASA-N 2 0 212.381 2.399 20 0 BEADRP C[C@H](C[N@@H+]1C[C@H](C[NH3+])C[C@@H]1C)c1ccccc1 ZINC000216056337 345743142 /nfs/dbraw/zinc/74/31/42/345743142.db2.gz VKIQLAPYQKBGDH-RDBSUJKOSA-N 2 0 232.371 2.459 20 0 BEADRP COCc1cccc(C[N@@H+]2C[C@H](C[NH3+])C[C@H]2C)c1 ZINC000216074666 345743797 /nfs/dbraw/zinc/74/37/97/345743797.db2.gz VZZIDNWGCVDTRL-DOMZBBRYSA-N 2 0 248.370 2.002 20 0 BEADRP CC[C@H](C)[C@@H](C)[NH2+]CCC1=CC[NH2+]CC1 ZINC000319178519 259386262 /nfs/dbraw/zinc/38/62/62/259386262.db2.gz NWQIZBGHABRZEF-NWDGAFQWSA-N 2 0 210.365 2.320 20 0 BEADRP C[C@H](C[NH2+][C@@H](C)Cc1ccsc1)C[NH+](C)C ZINC000381455935 345937149 /nfs/dbraw/zinc/93/71/49/345937149.db2.gz IJRPRCURNRACCP-NEPJUHHUSA-N 2 0 240.416 2.466 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)[C@@H]1CC1(C)C ZINC000381492588 346077380 /nfs/dbraw/zinc/07/73/80/346077380.db2.gz YTEWIFGUFMQDDG-AVGNSLFASA-N 2 0 224.392 2.352 20 0 BEADRP CC[NH+](CC)CCC[N@@H+]1CCC(C)(C)C1 ZINC000191801160 346064755 /nfs/dbraw/zinc/06/47/55/346064755.db2.gz GGTPEHRDJBZEEA-UHFFFAOYSA-N 2 0 212.381 2.450 20 0 BEADRP Cc1ccc(C[N@H+](C)CC2CC[NH+](C)CC2)cn1 ZINC000153850612 537952674 /nfs/dbraw/zinc/95/26/74/537952674.db2.gz KZWLUOTUKYAMDW-UHFFFAOYSA-N 2 0 247.386 2.164 20 0 BEADRP Cc1ccccc1[C@H](C)[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC000090320069 537956563 /nfs/dbraw/zinc/95/65/63/537956563.db2.gz NZDSDZBHTWOTNB-MELADBBJSA-N 2 0 230.355 2.207 20 0 BEADRP Cc1ncc(CN(C)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)o1 ZINC000628272863 346283692 /nfs/dbraw/zinc/28/36/92/346283692.db2.gz AMXRGBNKUPRWGP-FUNVUKJBSA-N 2 0 249.358 2.040 20 0 BEADRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCC[NH2+]C1 ZINC000669378416 537967107 /nfs/dbraw/zinc/96/71/07/537967107.db2.gz DOEIRAGADRROJI-CHWSQXEVSA-N 2 0 210.365 2.251 20 0 BEADRP Cc1cccc(C)c1C[N@H+]1CC[C@H]([C@H](C)[NH3+])C1 ZINC000228203952 179034840 /nfs/dbraw/zinc/03/48/40/179034840.db2.gz IPURWBODKIZTEQ-KBPBESRZSA-N 2 0 232.371 2.473 20 0 BEADRP Cc1cccc(C)c1CN1CCC[C@H]([NH3+])C1 ZINC000122155037 179036049 /nfs/dbraw/zinc/03/60/49/179036049.db2.gz OLQGZXCWBMSHGT-ZDUSSCGKSA-N 2 0 218.344 2.227 20 0 BEADRP CC(C)C[NH2+]CCCCC[NH+]1CCCC1 ZINC000052377519 346319655 /nfs/dbraw/zinc/31/96/55/346319655.db2.gz NHXIOYYVTGLJSF-UHFFFAOYSA-N 2 0 212.381 2.498 20 0 BEADRP Cc1cccc(C[N@H+](C)CCCC[NH3+])c1 ZINC000042435681 179066964 /nfs/dbraw/zinc/06/69/64/179066964.db2.gz MDUIFGXMSQPEPT-UHFFFAOYSA-N 2 0 206.333 2.166 20 0 BEADRP C[C@H]([NH3+])c1ccc(N[C@H]2CCC[C@@H]([NH3+])C2)cc1 ZINC000574927207 346415740 /nfs/dbraw/zinc/41/57/40/346415740.db2.gz AABRFTRHNPCYQS-SUHUHFCYSA-N 2 0 233.359 2.388 20 0 BEADRP Cc1cccc(C[N@H+]2CC[C@H]([NH3+])C[C@@H]2C)c1 ZINC000049713003 179081766 /nfs/dbraw/zinc/08/17/66/179081766.db2.gz OGAWICBJXCBKIG-JSGCOSHPSA-N 2 0 218.344 2.307 20 0 BEADRP Cc1cccc(CN2C[C@@H]3C[N@H+](C)C[C@@H]3C2)c1F ZINC000296774172 179085240 /nfs/dbraw/zinc/08/52/40/179085240.db2.gz LNFZFTDJXXLMET-OKILXGFUSA-N 2 0 248.345 2.128 20 0 BEADRP C[C@@H]1C[NH+](CC[C@@H]2CCC[NH2+]C2)C[C@@H](C)S1 ZINC000069908594 349968122 /nfs/dbraw/zinc/96/81/22/349968122.db2.gz MQHKKZVZXIQPKM-UPJWGTAASA-N 2 0 242.432 2.202 20 0 BEADRP Cc1ccc(F)cc1C[NH2+][C@@H]1C[C@H]([NH3+])C1(C)C ZINC000641802354 362760404 /nfs/dbraw/zinc/76/04/04/362760404.db2.gz JMMMLVJWBPDGMK-QWHCGFSZSA-N 2 0 236.334 2.350 20 0 BEADRP C[C@@H]1CC[C@H](CN)[N@H+](C[C@@H]2CCCCO2)[C@@H]1C ZINC000641806336 362765045 /nfs/dbraw/zinc/76/50/45/362765045.db2.gz QOZWLPCQGAMIGS-SYQHCUMBSA-N 2 0 240.391 2.003 20 0 BEADRP CC[N@@H+]1CCC[C@@H](C[NH+]2CCC(C)CC2)C1 ZINC000104949691 346548791 /nfs/dbraw/zinc/54/87/91/346548791.db2.gz PANSLSQRYWQEGU-CQSZACIVSA-N 2 0 224.392 2.450 20 0 BEADRP Cc1cccc(NCC2(C)CC[NH2+]CC2)[nH+]1 ZINC000160013025 179144590 /nfs/dbraw/zinc/14/45/90/179144590.db2.gz QXLILVPYISNHHK-UHFFFAOYSA-N 2 0 219.332 2.192 20 0 BEADRP C[C@H](c1ccccc1)[N@@H+]1C[C@@H](C[NH3+])C[C@H]1C ZINC000252699706 346780612 /nfs/dbraw/zinc/78/06/12/346780612.db2.gz VTIFYBOKHPLFSV-JHJVBQTASA-N 2 0 218.344 2.417 20 0 BEADRP C[C@@H]1CCC[N@H+](CCCc2cncn2C)CC1 ZINC000580657635 365852875 /nfs/dbraw/zinc/85/28/75/365852875.db2.gz SYYMLJOOXIUCDL-CYBMUJFWSA-N 2 0 235.375 2.475 20 0 BEADRP Cc1cccc(OCC[N@H+]2C[C@@H](C[NH3+])C[C@@H]2C)c1 ZINC000131785050 179168316 /nfs/dbraw/zinc/16/83/16/179168316.db2.gz WWLCIKSNBIPCTD-UONOGXRCSA-N 2 0 248.370 2.043 20 0 BEADRP Cc1cccc(OCC[N@H+]2C[C@@H](C[NH3+])C[C@H]2C)c1 ZINC000228081194 179168363 /nfs/dbraw/zinc/16/83/63/179168363.db2.gz WWLCIKSNBIPCTD-ZIAGYGMSSA-N 2 0 248.370 2.043 20 0 BEADRP CCC[C@H](C)C[N@@H+]1C[C@H]2CCC[C@@]2([NH3+])C1 ZINC000622004477 370655308 /nfs/dbraw/zinc/65/53/08/370655308.db2.gz PGYLMEFOGKNULV-YNEHKIRRSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@H](C[N@@H+]1C[C@H]2CCC[C@]2([NH3+])C1)C(C)(C)C ZINC000622004560 370655721 /nfs/dbraw/zinc/65/57/21/370655721.db2.gz QMBUBOVJDSBGKU-BZPMIXESSA-N 2 0 224.392 2.482 20 0 BEADRP Cc1cccc([C@H](C)[NH+]2CCC([NH3+])CC2)c1 ZINC000041046863 179193643 /nfs/dbraw/zinc/19/36/43/179193643.db2.gz MFJLRSBGDHTRRM-LBPRGKRZSA-N 2 0 218.344 2.479 20 0 BEADRP C1=CC[NH+](CCCC[N@H+]2CC=CCC2)CC1 ZINC000679323749 488336899 /nfs/dbraw/zinc/33/68/99/488336899.db2.gz JNUBJIJZSBESEK-UHFFFAOYSA-N 2 0 220.360 2.290 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000319245567 347340639 /nfs/dbraw/zinc/34/06/39/347340639.db2.gz WZTIUWXMZSDMDH-AVGNSLFASA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H](C[NH3+])N(C)Cc1ccc(Cl)cc1 ZINC000020226758 347430641 /nfs/dbraw/zinc/43/06/41/347430641.db2.gz JHCWPJAHEDDGDP-VIFPVBQESA-N 2 0 212.724 2.119 20 0 BEADRP C[C@H](C[NH3+])N(C)Cc1cccc(Cl)c1 ZINC000020226757 347430976 /nfs/dbraw/zinc/43/09/76/347430976.db2.gz KENOZOXJYUQORR-SECBINFHSA-N 2 0 212.724 2.119 20 0 BEADRP CC(C)CC[C@H](C)[NH2+][C@H]1CN(C)C[C@@H]1C ZINC000336768036 347442507 /nfs/dbraw/zinc/44/25/07/347442507.db2.gz UGCXGLXPXQNOEH-AVGNSLFASA-N 2 0 212.381 2.351 20 0 BEADRP [NH3+][C@H]1CCCCC[C@@H]1[NH2+]CCOCC1CCC1 ZINC000577214611 365884538 /nfs/dbraw/zinc/88/45/38/365884538.db2.gz PTUSFNQEOBHVDD-KBPBESRZSA-N 2 0 240.391 2.053 20 0 BEADRP C[C@H](C[NH2+]CC1(C)CC1)C[NH+]1CCCC1 ZINC000380105784 365881921 /nfs/dbraw/zinc/88/19/21/365881921.db2.gz NBJDHCBLDOYPSX-GFCCVEGCSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CC(C1CC1)C1CC1 ZINC000577214323 365883599 /nfs/dbraw/zinc/88/35/99/365883599.db2.gz AYZXYHNWBWRCOL-VHSXEESVSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CC(C1CC1)C1CC1 ZINC000577214324 365884038 /nfs/dbraw/zinc/88/40/38/365884038.db2.gz AYZXYHNWBWRCOL-ZJUUUORDSA-N 2 0 210.365 2.138 20 0 BEADRP Cc1nc(CN2CCC([C@H](C)[NH3+])CC2)cs1 ZINC000082474641 347614645 /nfs/dbraw/zinc/61/46/45/347614645.db2.gz LVGQCVDUFUPVKS-VIFPVBQESA-N 2 0 239.388 2.011 20 0 BEADRP Cc1ccccc1C[NH2+]CC1CC[NH+](C)CC1 ZINC000044515303 179281380 /nfs/dbraw/zinc/28/13/80/179281380.db2.gz RPNKXXPDLWBGMV-UHFFFAOYSA-N 2 0 232.371 2.426 20 0 BEADRP Cc1ccccc1C[N@H+]1CC[C@H]([NH3+])C[C@@H]1C ZINC000049712985 179276902 /nfs/dbraw/zinc/27/69/02/179276902.db2.gz PRFUTTUEDNVVQT-JSGCOSHPSA-N 2 0 218.344 2.307 20 0 BEADRP C[C@@H]([NH3+])[C@H](C)[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC000415009644 323152512 /nfs/dbraw/zinc/15/25/12/323152512.db2.gz GDPDHYFFKWDLCO-XWUBHJNHSA-N 2 0 218.344 2.115 20 0 BEADRP Cc1ccccc1C[NH2+][C@@H]1CC[N@@H+](C)C[C@@H]1C ZINC000105480760 179282144 /nfs/dbraw/zinc/28/21/44/179282144.db2.gz KZMIYWIKDADWTO-DZGCQCFKSA-N 2 0 232.371 2.425 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](CC)C2CC2)C1 ZINC000151137315 192371252 /nfs/dbraw/zinc/37/12/52/192371252.db2.gz ZWAFCOFRNMHMNP-OCCSQVGLSA-N 2 0 224.392 2.497 20 0 BEADRP CCS[C@@H]1CC[C@H]([N@H+](C)C[C@@H]2CC[NH2+]C2)C1 ZINC000592476756 347791489 /nfs/dbraw/zinc/79/14/89/347791489.db2.gz YQOSOLKYZUKUQU-FRRDWIJNSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H]1C[C@H]1C[NH2+]C(C)(C)CCC[NH+](C)C ZINC000449529812 201956422 /nfs/dbraw/zinc/95/64/22/201956422.db2.gz ZZSFSOVEFXURAK-NEPJUHHUSA-N 2 0 212.381 2.352 20 0 BEADRP Cc1ccccc1OCC[N@@H+]1CCC[C@@H](C[NH3+])C1 ZINC000011888568 179310928 /nfs/dbraw/zinc/31/09/28/179310928.db2.gz XAQGQQQDEWKYHO-AWEZNQCLSA-N 2 0 248.370 2.045 20 0 BEADRP CS[C@@H]1CC[C@@H]1[NH2+]CCC[N@H+](C)CC(C)C ZINC000593647110 347926036 /nfs/dbraw/zinc/92/60/36/347926036.db2.gz WJJXMMPBUDBPJV-QWHCGFSZSA-N 2 0 244.448 2.448 20 0 BEADRP Cc1ccccc1[C@H](C)[NH2+]C[C@H](C)C[NH3+] ZINC000309003980 179337454 /nfs/dbraw/zinc/33/74/54/179337454.db2.gz STIVIZNYQUKWGV-PWSUYJOCSA-N 2 0 206.333 2.240 20 0 BEADRP CSCC1(CC[NH2+][C@H]2CN(C)C[C@H]2C)CC1 ZINC000594963598 348145653 /nfs/dbraw/zinc/14/56/53/348145653.db2.gz RWULWNYIQQEDSV-NEPJUHHUSA-N 2 0 242.432 2.059 20 0 BEADRP C[C@H](CSCCF)[NH2+]CC1CC[NH+](C)CC1 ZINC000595009110 348159249 /nfs/dbraw/zinc/15/92/49/348159249.db2.gz AAJHLSPYVAKWJQ-LLVKDONJSA-N 2 0 248.411 2.009 20 0 BEADRP CCc1ccccc1C[N@H+](C)C1CC([NH3+])C1 ZINC000395023604 323185214 /nfs/dbraw/zinc/18/52/14/323185214.db2.gz NZEAXPZYEANEMW-UHFFFAOYSA-N 2 0 218.344 2.171 20 0 BEADRP Cc1cc[nH+]c(NC[C@H]2CCC[C@H]([NH3+])C2)c1 ZINC000227673135 179448659 /nfs/dbraw/zinc/44/86/59/179448659.db2.gz MOKGXEHAKHULOK-RYUDHWBXSA-N 2 0 219.332 2.319 20 0 BEADRP CCC(CC)[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000130223103 535081235 /nfs/dbraw/zinc/08/12/35/535081235.db2.gz AMBGMZFHRRFJPT-CHWSQXEVSA-N 2 0 210.365 2.391 20 0 BEADRP CC(C)=CC[NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1 ZINC000623505663 362930256 /nfs/dbraw/zinc/93/02/56/362930256.db2.gz LGFMWZUWWSDHOV-LBPRGKRZSA-N 2 0 210.365 2.415 20 0 BEADRP Cc1c[nH+]ccc1N(C)CCC[NH+]1CCCC1 ZINC000358664790 179704710 /nfs/dbraw/zinc/70/47/10/179704710.db2.gz MSWAOKVLZCJSTA-UHFFFAOYSA-N 2 0 233.359 2.312 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C[C@H]2CCSC2)CC1(C)C ZINC000623509997 362935276 /nfs/dbraw/zinc/93/52/76/362935276.db2.gz BJPLQZVDMYWHDQ-NEPJUHHUSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CC2CC[NH2+]CC2)C[C@H]1C ZINC000251591013 349188722 /nfs/dbraw/zinc/18/87/22/349188722.db2.gz CISCQNBHAADBOS-BZPMIXESSA-N 2 0 224.392 2.400 20 0 BEADRP COC(C)(C)[C@@H](C)[NH2+]C1CCC([NH+](C)C)CC1 ZINC000421881773 192399245 /nfs/dbraw/zinc/39/92/45/192399245.db2.gz RNJSPRVCMUKKDN-PNESKVBLSA-N 2 0 242.407 2.262 20 0 BEADRP COC1([C@@H](C)[NH2+]C[C@H](C)C[NH+](C)C)CCCC1 ZINC000421853145 192389740 /nfs/dbraw/zinc/38/97/40/192389740.db2.gz IPHBFUOETMMYHM-QWHCGFSZSA-N 2 0 242.407 2.121 20 0 BEADRP CC(C)[N@@H+]1CC[C@H](C[NH2+][C@H]2CC[C@@H](C)C2)C1 ZINC000251681045 349173181 /nfs/dbraw/zinc/17/31/81/349173181.db2.gz ALEZIGMLRIHGLW-MCIONIFRSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1CSC[C@@H]1[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623521706 362943454 /nfs/dbraw/zinc/94/34/54/362943454.db2.gz CJTQDWCIBSNVHW-WOPDTQHZSA-N 2 0 242.432 2.200 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CC(C)(C)C[NH+](C)C)C[C@H](C)O1 ZINC000252209167 349198829 /nfs/dbraw/zinc/19/88/29/349198829.db2.gz XSQMHGSKXFGXHL-CLLJXQQHSA-N 2 0 242.407 2.120 20 0 BEADRP CCc1ccc(C[N@@H+]2CC[C@H]([C@H](C)[NH3+])C2)s1 ZINC000252782509 349204277 /nfs/dbraw/zinc/20/42/77/349204277.db2.gz NJYPBLKGXSXSQP-QWRGUYRKSA-N 2 0 238.400 2.480 20 0 BEADRP CCC[NH+](CCC)C[C@H]1CCCC[NH2+]C1 ZINC000308816210 538036205 /nfs/dbraw/zinc/03/62/05/538036205.db2.gz IMJCJBXEOFIEBV-ZDUSSCGKSA-N 2 0 212.381 2.498 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000388623662 349274627 /nfs/dbraw/zinc/27/46/27/349274627.db2.gz HZXHLGKKUQGSRF-LPWJVIDDSA-N 2 0 210.365 2.425 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]C[C@H]1CCCSC1 ZINC000384029351 350124580 /nfs/dbraw/zinc/12/45/80/350124580.db2.gz BRQAFALETJUUNW-AGIUHOORSA-N 2 0 242.432 2.237 20 0 BEADRP C[C@H](C[NH2+][C@H](C)CC1CC1)C[NH+]1CCCC1 ZINC000132430049 191032858 /nfs/dbraw/zinc/03/28/58/191032858.db2.gz GKOBYFLVQYMMFP-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP COc1ccc(C[NH2+]C2CCC(C[NH3+])CC2)cc1 ZINC000422727679 192443662 /nfs/dbraw/zinc/44/36/62/192443662.db2.gz DAXJYQVUKKUWHD-UHFFFAOYSA-N 2 0 248.370 2.302 20 0 BEADRP C1[NH2+]C[C@H]2C[C@H]([NH2+]C3CCCCC3)CC[C@@H]12 ZINC000393425664 350175253 /nfs/dbraw/zinc/17/52/53/350175253.db2.gz PKZYBDWFAYUMJF-OUCADQQQSA-N 2 0 222.376 2.297 20 0 BEADRP Cc1ncc(C[NH2+][C@H](C)CCCC[NH3+])s1 ZINC000336686099 180156341 /nfs/dbraw/zinc/15/63/41/180156341.db2.gz KVVWPKJSWOUPGU-SECBINFHSA-N 2 0 227.377 2.059 20 0 BEADRP CC(C)C[C@H]([NH3+])C[N@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000309933927 191068515 /nfs/dbraw/zinc/06/85/15/191068515.db2.gz XLRJSRLKEFIXKN-MJBXVCDLSA-N 2 0 224.392 2.482 20 0 BEADRP C([NH2+]C1CCCCC1)[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000037408430 191069626 /nfs/dbraw/zinc/06/96/26/191069626.db2.gz GFESZKCNCXKDAE-LBPRGKRZSA-N 2 0 222.376 2.393 20 0 BEADRP CCc1cnc(C[NH2+]C2CCC([NH3+])CC2)s1 ZINC000220816222 350188405 /nfs/dbraw/zinc/18/84/05/350188405.db2.gz GOVIXQZYQYEZOW-UHFFFAOYSA-N 2 0 239.388 2.065 20 0 BEADRP Cc1ncc(C[NH2+]C[C@H]2CCC[C@@H]([NH3+])C2)s1 ZINC000070503293 180152633 /nfs/dbraw/zinc/15/26/33/180152633.db2.gz KQSPSYYFWRJPCM-WDEREUQCSA-N 2 0 239.388 2.059 20 0 BEADRP CC(C)[C@@H](C)C[NH2+]C1CCC(C[NH3+])CC1 ZINC000422773195 192462050 /nfs/dbraw/zinc/46/20/50/192462050.db2.gz TZRNAGNWXBUMMK-HIFPTAJRSA-N 2 0 212.381 2.386 20 0 BEADRP C[C@H](C[NH2+]C1CC[NH2+]CC1)c1ccccc1 ZINC000038040704 350302824 /nfs/dbraw/zinc/30/28/24/350302824.db2.gz MEGXRHSNYVQHTO-GFCCVEGCSA-N 2 0 218.344 2.132 20 0 BEADRP C[C@@H](Cc1cccs1)[NH2+]C1CC[NH2+]CC1 ZINC000038041066 350302905 /nfs/dbraw/zinc/30/29/05/350302905.db2.gz RVOMLLLDISPJQE-JTQLQIEISA-N 2 0 224.373 2.021 20 0 BEADRP C[C@@H](C[NH2+]C1CC[NH2+]CC1)c1ccccc1 ZINC000038040703 350302987 /nfs/dbraw/zinc/30/29/87/350302987.db2.gz MEGXRHSNYVQHTO-LBPRGKRZSA-N 2 0 218.344 2.132 20 0 BEADRP CC(C)(C[NH2+]CC1(C)CC1)C[NH+]1CCCC1 ZINC000309341609 350322399 /nfs/dbraw/zinc/32/23/99/350322399.db2.gz KLPKTACOGHAEDD-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@H](CCc1ccccc1)[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC000108265944 350347008 /nfs/dbraw/zinc/34/70/08/350347008.db2.gz DGNQKOXZPNHBLQ-BMFZPTHFSA-N 2 0 244.382 2.159 20 0 BEADRP C[C@@H](CCc1ccccc1)[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC000108265939 350347011 /nfs/dbraw/zinc/34/70/11/350347011.db2.gz DGNQKOXZPNHBLQ-CWRNSKLLSA-N 2 0 244.382 2.159 20 0 BEADRP Cc1ncsc1C[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000309423013 180320073 /nfs/dbraw/zinc/32/00/73/180320073.db2.gz BGKZPBWNXWWLRN-LLVKDONJSA-N 2 0 239.388 2.073 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CC(C)(C)C(F)(F)F ZINC000577482290 365963450 /nfs/dbraw/zinc/96/34/50/365963450.db2.gz PPTYLGNRXQQYBY-MRVPVSSYSA-N 2 0 226.286 2.292 20 0 BEADRP Fc1ccc(C[NH2+]CCC[NH2+]C2CC2)cc1 ZINC000163423684 350521716 /nfs/dbraw/zinc/52/17/16/350521716.db2.gz OYWDYCKMKUHDBL-UHFFFAOYSA-N 2 0 222.307 2.057 20 0 BEADRP CC1(C)CCC[N@@H+]1CC[C@H]1CCC[NH2+]C1 ZINC000063067290 350570425 /nfs/dbraw/zinc/57/04/25/350570425.db2.gz IHPJXHGWUUTBDR-GFCCVEGCSA-N 2 0 210.365 2.251 20 0 BEADRP CC[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)COC(C)C)C1 ZINC000337308024 350571999 /nfs/dbraw/zinc/57/19/99/350571999.db2.gz SSIFMHYNRPMPMM-KGLIPLIRSA-N 2 0 242.407 2.121 20 0 BEADRP COCC[C@@H](C)C[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623548949 362969939 /nfs/dbraw/zinc/96/99/39/362969939.db2.gz KAYCSAXXVSPELE-CHWSQXEVSA-N 2 0 242.407 2.121 20 0 BEADRP COCC[C@H](C)C[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623548952 362969662 /nfs/dbraw/zinc/96/96/62/362969662.db2.gz KAYCSAXXVSPELE-STQMWFEESA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CC[N@H+](C)C(C)(C)C2)CS1 ZINC000623549724 362969819 /nfs/dbraw/zinc/96/98/19/362969819.db2.gz MOSQMNFOWKTOSV-WOPDTQHZSA-N 2 0 242.432 2.343 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)C1CC1 ZINC000252703303 538099302 /nfs/dbraw/zinc/09/93/02/538099302.db2.gz SDFPXNQBIRETAY-XBFCOCLRSA-N 2 0 222.376 2.249 20 0 BEADRP C[N@H+](C[C@]1(C)CC[NH2+]C1)C1CC(C)(C)C1 ZINC000334620980 350726497 /nfs/dbraw/zinc/72/64/97/350726497.db2.gz HLFXYDNJFSFCJO-CYBMUJFWSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]([NH2+]C1CC[NH+](CC2CC2)CC1)C1CC1 ZINC000309561109 350776155 /nfs/dbraw/zinc/77/61/55/350776155.db2.gz LBOOLVCTKWWFPV-LLVKDONJSA-N 2 0 222.376 2.249 20 0 BEADRP CC[C@@H]1CCC[C@@H]([NH2+][C@H](C)C2C[NH2+]C2)C1 ZINC000422792510 192470417 /nfs/dbraw/zinc/47/04/17/192470417.db2.gz XCWLPRWYHOQTSU-NQBHXWOUSA-N 2 0 210.365 2.153 20 0 BEADRP CC1(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)CCC1 ZINC000252731752 535157154 /nfs/dbraw/zinc/15/71/54/535157154.db2.gz RJYGCKZYEQMESY-OLZOCXBDSA-N 2 0 222.376 2.393 20 0 BEADRP CC(C)C[C@H]([NH3+])C[NH+]1C[C@@H]2CCCC[C@H]2C1 ZINC000309933922 191128448 /nfs/dbraw/zinc/12/84/48/191128448.db2.gz XLRJSRLKEFIXKN-IHRRRGAJSA-N 2 0 224.392 2.482 20 0 BEADRP C[C@H]1CCC[C@H](C)C1[NH2+]CC1CC[NH2+]CC1 ZINC000571549994 351080433 /nfs/dbraw/zinc/08/04/33/351080433.db2.gz ZKABCJUIMISBRG-RYUDHWBXSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1CC[C@H](N(C)Cc2ccccc2)C[NH2+]1 ZINC000306987302 351403718 /nfs/dbraw/zinc/40/37/18/351403718.db2.gz YOHBDVNKHVUXCV-OCCSQVGLSA-N 2 0 218.344 2.259 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CCC[C@H]2C[NH3+])cc1F ZINC000414792919 351772987 /nfs/dbraw/zinc/77/29/87/351772987.db2.gz JIWLQKJZWVLZOB-JSGCOSHPSA-N 2 0 236.334 2.351 20 0 BEADRP c1c[nH]c(C2CC[NH+](Cc3ccns3)CC2)n1 ZINC000637984855 351859442 /nfs/dbraw/zinc/85/94/42/351859442.db2.gz BXBRLTKLCOKUQJ-UHFFFAOYSA-N 2 0 248.355 2.246 20 0 BEADRP CC(C)(O)C(C)(C)C[NH2+][C@H]1CCCCC[C@H]1[NH3+] ZINC000331953015 191145089 /nfs/dbraw/zinc/14/50/89/191145089.db2.gz JLSYXBPFZUQCES-NEPJUHHUSA-N 2 0 242.407 2.033 20 0 BEADRP Cc1scc(C[NH+]2C[C@@H]3C[NH2+]C[C@H]3C2)c1C ZINC000638185744 352050490 /nfs/dbraw/zinc/05/04/90/352050490.db2.gz AACAQCDBOVOTSZ-RYUDHWBXSA-N 2 0 236.384 2.016 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@@H](C)[C@@H]1CC1(F)F ZINC000638338244 352158115 /nfs/dbraw/zinc/15/81/15/352158115.db2.gz UOEFKCAMYATAKF-QWRGUYRKSA-N 2 0 234.334 2.350 20 0 BEADRP CO[C@@](C)(C[NH2+]CCC[N@H+](C)C(C)C)C1CC1 ZINC000638338520 352158780 /nfs/dbraw/zinc/15/87/80/352158780.db2.gz YALFBCWLRXMCAD-AWEZNQCLSA-N 2 0 242.407 2.121 20 0 BEADRP C([NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)[C@@H]1C[C@H]2C[C@H]2C1 ZINC000638376293 352186362 /nfs/dbraw/zinc/18/63/62/352186362.db2.gz JHSRVYWAXIVDSA-AIEDFZFUSA-N 2 0 234.387 2.249 20 0 BEADRP C([NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)[C@@H]1C[C@H]2C[C@H]2C1 ZINC000638376296 352186535 /nfs/dbraw/zinc/18/65/35/352186535.db2.gz JHSRVYWAXIVDSA-XLWJZTARSA-N 2 0 234.387 2.249 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+]CCc2ccc(C)cc2)C1 ZINC000638380691 352191194 /nfs/dbraw/zinc/19/11/94/352191194.db2.gz FDRIFCPBZLKPQA-MRXNPFEDSA-N 2 0 246.398 2.469 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)[C@@H]2CC2(F)F)C1 ZINC000638408352 352213992 /nfs/dbraw/zinc/21/39/92/352213992.db2.gz AHEYAVYEWULFAT-TUAOUCFPSA-N 2 0 246.345 2.352 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+]C[C@@H]2C[C@H]3C[C@H]3C2)C1 ZINC000638410236 352217615 /nfs/dbraw/zinc/21/76/15/352217615.db2.gz XRKAQNJBASTXQF-APIJFGDWSA-N 2 0 236.403 2.354 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CS[C@@H](C)C2)C1 ZINC000638409121 352218919 /nfs/dbraw/zinc/21/89/19/352218919.db2.gz JIAWTVFEPBANFB-XQQFMLRXSA-N 2 0 242.432 2.202 20 0 BEADRP CC[N@@H+]1CCC[C@H](C[NH2+]C[C@@](C)(CC)OC)C1 ZINC000638452317 352263360 /nfs/dbraw/zinc/26/33/60/352263360.db2.gz XCLAYRJMVFJIIB-ZIAGYGMSSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@H]1C[N@H+](Cc2cccc3c2CCC3)C[C@@H]1C[NH3+] ZINC000630074883 363158577 /nfs/dbraw/zinc/15/85/77/363158577.db2.gz BWSIEDPMSRPRGH-WFASDCNBSA-N 2 0 244.382 2.202 20 0 BEADRP C[C@@H]1C[N@H+](Cc2cccc3c2CCC3)C[C@H]1C[NH3+] ZINC000630074879 363159002 /nfs/dbraw/zinc/15/90/02/363159002.db2.gz BWSIEDPMSRPRGH-IUODEOHRSA-N 2 0 244.382 2.202 20 0 BEADRP C(=C\c1ccccc1)\C[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000414919668 352282537 /nfs/dbraw/zinc/28/25/37/352282537.db2.gz VOHJJPQDTGBFIK-UFRMUOTOSA-N 2 0 230.355 2.432 20 0 BEADRP CC[NH+]1CCC(CNc2ccccn2)CC1 ZINC000044526337 352351574 /nfs/dbraw/zinc/35/15/74/352351574.db2.gz QCAVLKVWDZSCHI-UHFFFAOYSA-N 2 0 219.332 2.225 20 0 BEADRP CC[C@H]([NH2+][C@H]1C[C@H]([NH3+])c2ccccc21)C(C)(C)O ZINC000394010664 259426621 /nfs/dbraw/zinc/42/66/21/259426621.db2.gz DPPKLRGRZOSJRD-IHRRRGAJSA-N 2 0 248.370 2.270 20 0 BEADRP C[C@@H]1C[C@H](C)C[N@H+]([C@H]2CC[NH2+][C@@H](C)C2)C1 ZINC000252958515 538103616 /nfs/dbraw/zinc/10/36/16/538103616.db2.gz SWIAYLRCUHHJGQ-RNJOBUHISA-N 2 0 210.365 2.105 20 0 BEADRP CC(C)[N@H+](CC1CC1)C[C@H]1CC[NH2+][C@H](C)C1 ZINC000300055815 352553842 /nfs/dbraw/zinc/55/38/42/352553842.db2.gz KLMGDXXPIXYCHO-OCCSQVGLSA-N 2 0 224.392 2.495 20 0 BEADRP CCSCCC[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000300901081 352578283 /nfs/dbraw/zinc/57/82/83/352578283.db2.gz IXOQKZDDDLNHRK-LBPRGKRZSA-N 2 0 244.448 2.450 20 0 BEADRP COC1([C@H](C)[NH2+]CC[C@@H]2CCC[N@@H+]2C)CCC1 ZINC000412026407 191239733 /nfs/dbraw/zinc/23/97/33/191239733.db2.gz SFFFXFRNNJKUTF-STQMWFEESA-N 2 0 240.391 2.018 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H](C)C1(OC)CCC1 ZINC000412025890 191240366 /nfs/dbraw/zinc/24/03/66/191240366.db2.gz QXYQEBLAKZUAFX-ZDUSSCGKSA-N 2 0 242.407 2.266 20 0 BEADRP CC(C)C[N@@H+]1CCCC12CC[NH+](C)CC2 ZINC000334194652 352786951 /nfs/dbraw/zinc/78/69/51/352786951.db2.gz JBEKRPYCODLCOK-UHFFFAOYSA-N 2 0 210.365 2.203 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]CC12CCC(CC1)C2 ZINC000334259856 352871295 /nfs/dbraw/zinc/87/12/95/352871295.db2.gz RBLGVXXGRQXHMC-FEWQNLEASA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]Cc1cccc(F)c1 ZINC000422805568 192474548 /nfs/dbraw/zinc/47/45/48/192474548.db2.gz JMLPLGGWTPRHRT-UWVGGRQHSA-N 2 0 210.296 2.041 20 0 BEADRP [NH3+]CC1CCC([NH2+]CCc2ccsc2)CC1 ZINC000422810029 192476723 /nfs/dbraw/zinc/47/67/23/192476723.db2.gz QVGUHFQHCASUJG-UHFFFAOYSA-N 2 0 238.400 2.398 20 0 BEADRP CC(C)N(C)CC[NH2+][C@@H](C)[C@H]1CC1(C)C ZINC000336755960 188000636 /nfs/dbraw/zinc/00/06/36/188000636.db2.gz JCURRPOCHQTJCC-NWDGAFQWSA-N 2 0 212.381 2.351 20 0 BEADRP CC(C)N(C)CC[NH2+][C@H](C)[C@H]1CC1(C)C ZINC000336755962 188000658 /nfs/dbraw/zinc/00/06/58/188000658.db2.gz JCURRPOCHQTJCC-VXGBXAGGSA-N 2 0 212.381 2.351 20 0 BEADRP CC(C)C[C@H](C)C[N@H+](C)C1CC[NH2+]CC1 ZINC000300969361 188001990 /nfs/dbraw/zinc/00/19/90/188001990.db2.gz RYNXHEKIAZEQEF-LBPRGKRZSA-N 2 0 212.381 2.352 20 0 BEADRP CC(C)(C[NH2+]Cc1cc[nH]c1)C[NH+]1CCCC1 ZINC000276604532 188029075 /nfs/dbraw/zinc/02/90/75/188029075.db2.gz CPWDSZFNYBAWDN-UHFFFAOYSA-N 2 0 235.375 2.226 20 0 BEADRP F[C@@H]1CCC[C@@H]1[NH2+]Cc1cccc2nccn21 ZINC000336332332 188055340 /nfs/dbraw/zinc/05/53/40/188055340.db2.gz VTQUFXNMMUTOJN-NEPJUHHUSA-N 2 0 233.290 2.315 20 0 BEADRP C[C@H]([NH2+]CC1(C)CC[NH+](C)CC1)[C@@H]1CC1(F)F ZINC000638956287 353169418 /nfs/dbraw/zinc/16/94/18/353169418.db2.gz HTTMKZTVXHFJKX-QWRGUYRKSA-N 2 0 246.345 2.352 20 0 BEADRP C[C@@H](CC[NH+](C)C)Nc1nc2ccccc2[nH]1 ZINC000049558501 353168455 /nfs/dbraw/zinc/16/84/55/353168455.db2.gz PYYHSARDVLBXPO-JTQLQIEISA-N 2 0 232.331 2.315 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+][C@@H]1CCCSC1 ZINC000422814727 192478962 /nfs/dbraw/zinc/47/89/62/192478962.db2.gz ACIPDDUGKRKPME-UTUOFQBUSA-N 2 0 228.405 2.132 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCCSC1)[C@@H]1CCC[NH2+]1 ZINC000422821149 192480256 /nfs/dbraw/zinc/48/02/56/192480256.db2.gz UOBPABRLCFKRIL-WOPDTQHZSA-N 2 0 228.405 2.002 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CCCOC1CCCC1 ZINC000422825798 192481961 /nfs/dbraw/zinc/48/19/61/192481961.db2.gz KJPIGZKWXWVWQM-ZDUSSCGKSA-N 2 0 242.407 2.443 20 0 BEADRP CSCCC[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@@H]1C ZINC000225980167 363211422 /nfs/dbraw/zinc/21/14/22/363211422.db2.gz IFWHOFPJBVBQDS-SDDRHHMPSA-N 2 0 230.421 2.058 20 0 BEADRP CC(C)C[C@@H](C)[NH+]1CCC([NH+](C)C)CC1 ZINC000355757826 188237316 /nfs/dbraw/zinc/23/73/16/188237316.db2.gz KOPKEYRHZUYTIB-GFCCVEGCSA-N 2 0 212.381 2.447 20 0 BEADRP CCCc1cccc(C[NH+]2C[C@@H]3C[NH2+]C[C@H]3C2)c1 ZINC000359475283 188242104 /nfs/dbraw/zinc/24/21/04/188242104.db2.gz RGHLAVPMMFGRBC-HOTGVXAUSA-N 2 0 244.382 2.290 20 0 BEADRP COCC[N@H+](CC[C@H]1CCC[NH+]1C)CC(C)C ZINC000119167251 188247709 /nfs/dbraw/zinc/24/77/09/188247709.db2.gz AZGOHUZNRVOBDQ-CQSZACIVSA-N 2 0 242.407 2.075 20 0 BEADRP C(C[NH2+][C@H]1CCC[C@@H]2C[C@@H]21)C[NH+]1CCCC1 ZINC000304582235 188250057 /nfs/dbraw/zinc/25/00/57/188250057.db2.gz OHZMBUHPQPZXNM-RDBSUJKOSA-N 2 0 222.376 2.251 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@H]2CSC[C@@H]2C)CC1 ZINC000304485090 188250876 /nfs/dbraw/zinc/25/08/76/188250876.db2.gz LTTRBGPCBJSDKB-AAEUAGOBSA-N 2 0 242.432 2.200 20 0 BEADRP CC(C)(C)[C@@H]1CC[N@H+](C[C@]2(C)CC[NH2+]C2)C1 ZINC000252849361 353311849 /nfs/dbraw/zinc/31/18/49/353311849.db2.gz HCTCUBLMJXWPCU-TZMCWYRMSA-N 2 0 224.392 2.354 20 0 BEADRP CC(C)C[C@H](C)[NH2+][C@H](C)Cn1ccnc1 ZINC000037157791 188279669 /nfs/dbraw/zinc/27/96/69/188279669.db2.gz NDPSPFHHUJWEAY-NWDGAFQWSA-N 2 0 209.337 2.296 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](C[C@H]2CCCC[C@@H]2C)C1 ZINC000252128733 353296880 /nfs/dbraw/zinc/29/68/80/353296880.db2.gz KLFHTYXLSZCLRG-MELADBBJSA-N 2 0 224.392 2.354 20 0 BEADRP C(C[N@@H+]1C[C@@H]2CCC[C@@H]2C1)[C@H]1CCC[NH2+]C1 ZINC000252701543 353303874 /nfs/dbraw/zinc/30/38/74/353303874.db2.gz DNFGVZUXGHICIJ-MCIONIFRSA-N 2 0 222.376 2.108 20 0 BEADRP CCc1ccccc1C[N@@H+]1CC[C@@H]([C@H](C)[NH3+])C1 ZINC000252755950 353304394 /nfs/dbraw/zinc/30/43/94/353304394.db2.gz BPGOMUXXMHZNTA-GXTWGEPZSA-N 2 0 232.371 2.418 20 0 BEADRP Cc1ccc(C[NH2+]CCCC[NH+](C)C)o1 ZINC000045598336 188325735 /nfs/dbraw/zinc/32/57/35/188325735.db2.gz WCRDGTVUNDJVLC-UHFFFAOYSA-N 2 0 210.321 2.019 20 0 BEADRP F[C@H]1CC[C@@H]([NH2+]Cc2cccc3nccn32)C1 ZINC000334502594 353342740 /nfs/dbraw/zinc/34/27/40/353342740.db2.gz FIFADGXPSAVRSQ-WDEREUQCSA-N 2 0 233.290 2.315 20 0 BEADRP CCCC[C@@H](CC)C[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC000085283173 538116145 /nfs/dbraw/zinc/11/61/45/538116145.db2.gz JKDGBULEUOPIDQ-MCIONIFRSA-N 2 0 224.392 2.354 20 0 BEADRP CC(C)(C[NH2+]CC1CC1)C[NH+]1CCCC1 ZINC000308883431 188341774 /nfs/dbraw/zinc/34/17/74/188341774.db2.gz UZNYFHYRODMNLC-UHFFFAOYSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]CCC1(F)CCC1 ZINC000336778901 188353766 /nfs/dbraw/zinc/35/37/66/188353766.db2.gz MQWBSIMREOTHHI-RYUDHWBXSA-N 2 0 228.355 2.199 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+][C@@H]2CCSC2)c2ccccc21 ZINC000231347940 353595346 /nfs/dbraw/zinc/59/53/46/353595346.db2.gz PVMIUVLZYTZYJK-WQAKAFBOSA-N 2 0 234.368 2.226 20 0 BEADRP CC[C@](C)(C[N@@H+]1CCC[C@H]([NH+](C)C)CC1)OC ZINC000639106207 353621154 /nfs/dbraw/zinc/62/11/54/353621154.db2.gz XBUPFOKVWHUAPX-UONOGXRCSA-N 2 0 242.407 2.218 20 0 BEADRP CO[C@H](C)C[N@H+](CCCn1ccnc1)C(C)C ZINC000343323209 353698282 /nfs/dbraw/zinc/69/82/82/353698282.db2.gz UGLZRJXLFOUZHP-CYBMUJFWSA-N 2 0 239.363 2.019 20 0 BEADRP Fc1cccc2c1C[N@H+](CCn1ccnc1)CC2 ZINC000157864824 181006394 /nfs/dbraw/zinc/00/63/94/181006394.db2.gz HTQJCFRSMKRMKY-UHFFFAOYSA-N 2 0 245.301 2.081 20 0 BEADRP Fc1ccccc1CC[NH2+][C@H]1CCC[NH2+]CC1 ZINC000128854402 181012247 /nfs/dbraw/zinc/01/22/47/181012247.db2.gz BZJCLIUJWDEHCT-ZDUSSCGKSA-N 2 0 236.334 2.100 20 0 BEADRP CC(C)C[N@H+](C[C@@H]1CC[NH2+][C@@H](C)C1)C1CC1 ZINC000232654620 353745699 /nfs/dbraw/zinc/74/56/99/353745699.db2.gz OTNOTEOISXTQPE-QWHCGFSZSA-N 2 0 224.392 2.495 20 0 BEADRP Cc1ccc(F)c(C[N@H+]2CC[C@H]([C@@H](C)[NH3+])C2)c1 ZINC000220340765 353830776 /nfs/dbraw/zinc/83/07/76/353830776.db2.gz MYNLWWMGHNEGSJ-NEPJUHHUSA-N 2 0 236.334 2.303 20 0 BEADRP C[N@H+](CCC[NH+]1CCCC1)C[C@H]1CCSC1 ZINC000343610059 353932891 /nfs/dbraw/zinc/93/28/91/353932891.db2.gz YHJFIHWMUYOESA-CYBMUJFWSA-N 2 0 242.432 2.157 20 0 BEADRP C[C@H]1C[C@@H]1C[N@H+](C)CCC[NH+]1CCCC1 ZINC000343614026 353933802 /nfs/dbraw/zinc/93/38/02/353933802.db2.gz IPDSJZKCPKORNS-QWHCGFSZSA-N 2 0 210.365 2.060 20 0 BEADRP CN1CCC[C@H]1C[NH2+][C@@H]1CCC(C)(C)C1 ZINC000230394215 363304674 /nfs/dbraw/zinc/30/46/74/363304674.db2.gz LVHWUHQRUHRZEM-NEPJUHHUSA-N 2 0 210.365 2.249 20 0 BEADRP CCC(CC)C[N@H+](C)[C@@H]1CCC[NH2+]CC1 ZINC000231465316 363343944 /nfs/dbraw/zinc/34/39/44/363343944.db2.gz JZEIDQMRWCVKAX-CYBMUJFWSA-N 2 0 212.381 2.497 20 0 BEADRP CCC[N@H+](CCC[C@H]1CCO1)CCC[NH+](C)C ZINC000639175105 354191476 /nfs/dbraw/zinc/19/14/76/354191476.db2.gz IOUNHPSAEUWHCM-AWEZNQCLSA-N 2 0 242.407 2.219 20 0 BEADRP C([NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)[C@@H]1C[C@H]1C1CC1 ZINC000449743392 202017161 /nfs/dbraw/zinc/01/71/61/202017161.db2.gz XFZJFYVDUMPKFH-XQLPTFJDSA-N 2 0 234.387 2.249 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)C[C@@](C)(OC)C1CC1 ZINC000639175766 354206427 /nfs/dbraw/zinc/20/64/27/354206427.db2.gz PSJJBXCHWBLLDR-CQSZACIVSA-N 2 0 242.407 2.075 20 0 BEADRP C[C@@H](Cc1ccncc1)[NH2+]C1CCC(C[NH3+])CC1 ZINC000422831291 192482669 /nfs/dbraw/zinc/48/26/69/192482669.db2.gz DMNKQFHYCXPKJG-GRTSSRMGSA-N 2 0 247.386 2.120 20 0 BEADRP CC[C@](C)(C[N@H+](C)[C@@H]1CCN(C)C[C@@H]1C)OC ZINC000639179541 354272417 /nfs/dbraw/zinc/27/24/17/354272417.db2.gz UCTSGLMUNNYPBY-BFHYXJOUSA-N 2 0 242.407 2.074 20 0 BEADRP C[C@@H]1C[N@H+](CC[C@@H]2CCC[NH+]2C)CCC1(F)F ZINC000334685093 354431029 /nfs/dbraw/zinc/43/10/29/354431029.db2.gz VNEDBJLLOZSNGF-NEPJUHHUSA-N 2 0 246.345 2.448 20 0 BEADRP C[C@@H]1CN(C)C[C@@H]1[NH2+]CC1=CCCCC1 ZINC000334654504 354448158 /nfs/dbraw/zinc/44/81/58/354448158.db2.gz VVJRHSQAPKLWBG-YPMHNXCESA-N 2 0 208.349 2.027 20 0 BEADRP C[C@@H](CC[NH3+])[NH2+]C[C@@H](C)c1ccccc1 ZINC000235086303 363436619 /nfs/dbraw/zinc/43/66/19/363436619.db2.gz HABCSHOUUAXSHL-NEPJUHHUSA-N 2 0 206.333 2.117 20 0 BEADRP C[C@H]([NH3+])c1ccc(N[C@H]2CCC[NH2+]CC2)cc1 ZINC000335178682 354964444 /nfs/dbraw/zinc/96/44/44/354964444.db2.gz ODZVUEDNZQTWOK-AAEUAGOBSA-N 2 0 233.359 2.260 20 0 BEADRP CCN1CCCC[C@@H]1C[NH2+][C@@H](C)[C@@H]1CCCO1 ZINC000346566071 354970215 /nfs/dbraw/zinc/97/02/15/354970215.db2.gz RNAOYIOAIHMMGE-MJBXVCDLSA-N 2 0 240.391 2.018 20 0 BEADRP COc1ccc([C@H](C)C[NH+]2CCC([NH3+])CC2)cc1 ZINC000346657060 355004812 /nfs/dbraw/zinc/00/48/12/355004812.db2.gz SXLVAPNKVKOAGA-GFCCVEGCSA-N 2 0 248.370 2.222 20 0 BEADRP Cc1cccc(C[NH+]2CCC(C[NH+](C)C)CC2)n1 ZINC000346637889 355014821 /nfs/dbraw/zinc/01/48/21/355014821.db2.gz DROJWPCYKQWYNM-UHFFFAOYSA-N 2 0 247.386 2.164 20 0 BEADRP C1CC1[C@@H]1CCCC[C@@H]1[NH2+]C1CC[NH2+]CC1 ZINC000335253587 355210718 /nfs/dbraw/zinc/21/07/18/355210718.db2.gz YJCOYMSYPQORNK-KBPBESRZSA-N 2 0 222.376 2.297 20 0 BEADRP CCC[C@@H]1CCC[N@H+](C[C@H]2CCC[NH2+]C2)C1 ZINC000346997593 355196150 /nfs/dbraw/zinc/19/61/50/355196150.db2.gz XMERJWBPIGIDBO-KGLIPLIRSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H]1CC[C@@]2(CC[N@H+](C[C@@H]3CCC[NH2+]C3)C2)C1 ZINC000347000069 355196770 /nfs/dbraw/zinc/19/67/70/355196770.db2.gz YKRJHKIOIJPCIJ-RBSFLKMASA-N 2 0 236.403 2.498 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCC[C@H]1c1ccccc1OC ZINC000435876426 191329306 /nfs/dbraw/zinc/32/93/06/191329306.db2.gz IMROIHWTRCOFQV-AWEZNQCLSA-N 2 0 248.370 2.442 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCCC[N@H+](C)C2CC2)CS1 ZINC000639244742 355248301 /nfs/dbraw/zinc/24/83/01/355248301.db2.gz OQLHIIMSVQKORD-NEPJUHHUSA-N 2 0 242.432 2.344 20 0 BEADRP C[C@@H]([NH2+]CCCC[N@H+](C)C1CC1)[C@H]1CC1(F)F ZINC000639245164 355241206 /nfs/dbraw/zinc/24/12/06/355241206.db2.gz STCMHMLOQKCQTF-ZYHUDNBSSA-N 2 0 246.345 2.494 20 0 BEADRP C[C@H]([NH2+]CCCC[N@H+](C)C1CC1)[C@H]1CC1(F)F ZINC000639245157 355241257 /nfs/dbraw/zinc/24/12/57/355241257.db2.gz STCMHMLOQKCQTF-CMPLNLGQSA-N 2 0 246.345 2.494 20 0 BEADRP C[C@H]1CC2(C[N@@H+]1Cc1ccccn1)CC[NH2+]CC2 ZINC000335280259 355244254 /nfs/dbraw/zinc/24/42/54/355244254.db2.gz LEQHCFKWNLKILQ-ZDUSSCGKSA-N 2 0 245.370 2.046 20 0 BEADRP CC[C@H](C[N@H+](C)[C@H]1CC[NH+](CC)C[C@H]1C)OC ZINC000412978749 191348337 /nfs/dbraw/zinc/34/83/37/191348337.db2.gz RAENIUXGXWCRLM-MCIONIFRSA-N 2 0 242.407 2.074 20 0 BEADRP C[NH+](C)C[C@@H]1CC[N@H+](CC2CCCC2)C1 ZINC000113512204 355247763 /nfs/dbraw/zinc/24/77/63/355247763.db2.gz XJTJOTUTOHMARC-ZDUSSCGKSA-N 2 0 210.365 2.060 20 0 BEADRP C[C@H]([NH2+][C@H](c1cccs1)C1CC1)C1C[NH2+]C1 ZINC000422789720 192485516 /nfs/dbraw/zinc/48/55/16/192485516.db2.gz BMKXHOXDJRSPNV-ZANVPECISA-N 2 0 236.384 2.397 20 0 BEADRP Cc1cc[nH+]c(NCCCC[N@@H+](C)C2CC2)c1 ZINC000413349227 191373234 /nfs/dbraw/zinc/37/32/34/191373234.db2.gz QZGCNNKTPAICRT-UHFFFAOYSA-N 2 0 233.359 2.098 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC[C@@H]2CCC[N@H+](C)C2)CS1 ZINC000639256766 355300161 /nfs/dbraw/zinc/30/01/61/355300161.db2.gz FQTDWRMVEBMJDF-AGIUHOORSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)[C@H]1CC1(F)F ZINC000639257180 355302011 /nfs/dbraw/zinc/30/20/11/355302011.db2.gz JYTZGNILVMPYGV-SDDRHHMPSA-N 2 0 246.345 2.352 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)[C@@H]1CC1(F)F ZINC000639257181 355302029 /nfs/dbraw/zinc/30/20/29/355302029.db2.gz JYTZGNILVMPYGV-SRVKXCTJSA-N 2 0 246.345 2.352 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@H]([NH+](C)C)C1)[C@H]1C[C@H]1C ZINC000414117316 191450340 /nfs/dbraw/zinc/45/03/40/191450340.db2.gz RVJGGNGKOPQGSN-QMVSFRDZSA-N 2 0 224.392 2.493 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)C1(C)CC1 ZINC000414202934 191460582 /nfs/dbraw/zinc/46/05/82/191460582.db2.gz ZONDGVKEAGMPBV-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)C[C@@H]1CCC[N@@H+]1C[C@@]1(C)CC[NH2+]C1 ZINC000261687660 535283712 /nfs/dbraw/zinc/28/37/12/535283712.db2.gz ASIQRXNYXNVFDM-KBPBESRZSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH+](C)C1CCC([NH2+]C[C@@H]2C[C@H]3C[C@H]3C2)CC1 ZINC000639274936 355350493 /nfs/dbraw/zinc/35/04/93/355350493.db2.gz GJCVYEBFOUCKBG-LDMWTAMHSA-N 2 0 236.403 2.495 20 0 BEADRP CC[NH+](CC)CCOCC[NH2+]C1CCCCC1 ZINC000349672494 355407711 /nfs/dbraw/zinc/40/77/11/355407711.db2.gz XVFBPWNUMCMQFZ-UHFFFAOYSA-N 2 0 242.407 2.267 20 0 BEADRP CC[NH+](CC)CCOCC[NH2+][C@H]1CCC[C@@H]1C ZINC000349674624 355408488 /nfs/dbraw/zinc/40/84/88/355408488.db2.gz ZLARWFKIYYGRHB-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP c1ccc2c(c1)CC[C@H]([NH2+]CC[C@@H]1CC[NH2+]C1)C2 ZINC000414834281 191594451 /nfs/dbraw/zinc/59/44/51/191594451.db2.gz QNQNCJCIINGDAM-BBRMVZONSA-N 2 0 244.382 2.133 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]Cc1ccc(F)cc1C ZINC000414843105 191597025 /nfs/dbraw/zinc/59/70/25/191597025.db2.gz PQCITACPNFKPER-SNVBAGLBSA-N 2 0 224.323 2.079 20 0 BEADRP C[NH2+]Cc1ccccc1NC[C@H]1CC[NH2+][C@@H](C)C1 ZINC000414861127 191604108 /nfs/dbraw/zinc/60/41/08/191604108.db2.gz FAZWBQNHDRPXIK-STQMWFEESA-N 2 0 247.386 2.206 20 0 BEADRP C[C@H](CC1CC1)[NH2+]C[C@@H]1CCC[C@H]([NH3+])C1 ZINC000415003605 191646442 /nfs/dbraw/zinc/64/64/42/191646442.db2.gz NIWGKIKHJYVGQD-RTXFEEFZSA-N 2 0 210.365 2.282 20 0 BEADRP [NH2+]=C(NCCC[NH+]1CCCC1)Nc1ccccc1 ZINC000060394394 181198399 /nfs/dbraw/zinc/19/83/99/181198399.db2.gz AJORPEFGNKJIDE-UHFFFAOYSA-N 2 0 246.358 2.109 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000415015227 191651272 /nfs/dbraw/zinc/65/12/72/191651272.db2.gz AOJGKIXOGGPOMZ-MCIONIFRSA-N 3 0 241.423 2.014 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H](C)Cc1ccccc1F ZINC000415020600 191654484 /nfs/dbraw/zinc/65/44/84/191654484.db2.gz JOSQRWCBOYTEJD-VXGBXAGGSA-N 2 0 238.350 2.474 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H](C)CCC(F)(F)F ZINC000415024576 191655413 /nfs/dbraw/zinc/65/54/13/191655413.db2.gz PDDZFFNBHJKHPV-RKDXNWHRSA-N 2 0 226.286 2.434 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H]1C[C@@H](c2ccccc2)[C@@H]1C ZINC000414869621 191608461 /nfs/dbraw/zinc/60/84/61/191608461.db2.gz AYVDMCVRONKYEU-AYRXBEOTSA-N 2 0 232.371 2.363 20 0 BEADRP COc1ccccc1C[NH2+]CC1(C)CC[NH2+]CC1 ZINC000414898089 191619478 /nfs/dbraw/zinc/61/94/78/191619478.db2.gz CZEJQSMIXUQGGT-UHFFFAOYSA-N 2 0 248.370 2.175 20 0 BEADRP Cc1ncccc1C[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000414963112 191634218 /nfs/dbraw/zinc/63/42/18/191634218.db2.gz CPICVALAQSYAHA-CQSZACIVSA-N 2 0 233.359 2.012 20 0 BEADRP [NH3+]CC1CCC([NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)CC1 ZINC000415104994 191681161 /nfs/dbraw/zinc/68/11/61/191681161.db2.gz FNCXEMJNGXKSRB-LNNYQDNLSA-N 2 0 222.376 2.282 20 0 BEADRP c1c[nH]c([C@H]2CCC[N@H+]2CC2CC[NH2+]CC2)c1 ZINC000335855801 355600652 /nfs/dbraw/zinc/60/06/52/355600652.db2.gz WJSVDCYSLVNGSV-CQSZACIVSA-N 2 0 233.359 2.151 20 0 BEADRP CC(C)CC[C@@H]1CCC[C@H]1[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000415034979 191658853 /nfs/dbraw/zinc/65/88/53/191658853.db2.gz KHIBRRHXGCQOQF-VQJWOFKYSA-N 2 0 236.403 2.399 20 0 BEADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@H]2CCC[C@@H]2C2CC2)C1 ZINC000415046370 191662513 /nfs/dbraw/zinc/66/25/13/191662513.db2.gz VCNCHVZLOGMRCL-CABNGKKXSA-N 2 0 222.376 2.282 20 0 BEADRP CCC[C@@H](C[NH2+]C[C@H]1CCN1C(C)(C)C)OC ZINC000639303220 355652778 /nfs/dbraw/zinc/65/27/78/355652778.db2.gz NYECCODFQCPNOW-OLZOCXBDSA-N 2 0 242.407 2.264 20 0 BEADRP Cc1ccc(C[NH+]2CCC(C[NH+](C)C)CC2)o1 ZINC000350178612 355620364 /nfs/dbraw/zinc/62/03/64/355620364.db2.gz YVOPTYHEUBIMPD-UHFFFAOYSA-N 2 0 236.359 2.362 20 0 BEADRP Cc1ccc(CC[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)cc1 ZINC000639313632 355692113 /nfs/dbraw/zinc/69/21/13/355692113.db2.gz ZUAAJEVFZFOINO-IYBDPMFKSA-N 2 0 246.398 2.467 20 0 BEADRP CC[C@H]([NH2+]CCC[N@H+](C)C(C)C)C1CC1 ZINC000166568668 355694393 /nfs/dbraw/zinc/69/43/93/355694393.db2.gz RDXWWSFBUCLKJF-ZDUSSCGKSA-N 2 0 212.381 2.495 20 0 BEADRP CCCN1CC[C@@H]([NH2+]C[C@@H](CC(C)C)OC)C1 ZINC000639330338 355746937 /nfs/dbraw/zinc/74/69/37/355746937.db2.gz NZGNPZHIDAMDSF-ZIAGYGMSSA-N 2 0 242.407 2.121 20 0 BEADRP CCCN1CC[C@H]([NH2+]C[C@@H](CC(C)C)OC)C1 ZINC000639330337 355747164 /nfs/dbraw/zinc/74/71/64/355747164.db2.gz NZGNPZHIDAMDSF-UONOGXRCSA-N 2 0 242.407 2.121 20 0 BEADRP CS[C@@H]1CC[C@@H]1[NH2+]CCCC[N@H+](C)C1CC1 ZINC000425340275 191811700 /nfs/dbraw/zinc/81/17/00/191811700.db2.gz ADDNZANJGNKEFR-QWHCGFSZSA-N 2 0 242.432 2.344 20 0 BEADRP C[N@@H+]1CCCC[C@H](C[NH2+]C[C@@H]2C[C@H]3C[C@H]3C2)C1 ZINC000639346655 355793089 /nfs/dbraw/zinc/79/30/89/355793089.db2.gz HUHHWKWZSLIQFD-APIJFGDWSA-N 2 0 236.403 2.354 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@@H]2CCC[C@H]2C)CC1 ZINC000084901967 355872178 /nfs/dbraw/zinc/87/21/78/355872178.db2.gz CFCZJTSLILIARJ-TZMCWYRMSA-N 2 0 224.392 2.497 20 0 BEADRP CCC1([NH+](C)C)CC[NH+](C[C@H]2C[C@@H]2C)CC1 ZINC000639378189 355911157 /nfs/dbraw/zinc/91/11/57/355911157.db2.gz FAHVPWONPKWEMS-QWHCGFSZSA-N 2 0 224.392 2.449 20 0 BEADRP CCC(C)(C)CC[N@@H+]1C[C@@H]2CC[C@H]([NH3+])[C@@H]2C1 ZINC000351494625 356001636 /nfs/dbraw/zinc/00/16/36/356001636.db2.gz OLTYAYQOPFGGGH-XQQFMLRXSA-N 2 0 224.392 2.482 20 0 BEADRP Cc1ccc(CC[N@@H+]2C[C@@H]3CC[C@H]([NH3+])[C@H]3C2)cc1 ZINC000351495959 356002490 /nfs/dbraw/zinc/00/24/90/356002490.db2.gz QISUVHKFVRAMGI-JYJNAYRXSA-N 2 0 244.382 2.207 20 0 BEADRP CN(C)Cc1cnc(CNc2ccccn2)s1 ZINC000351625053 356034110 /nfs/dbraw/zinc/03/41/10/356034110.db2.gz SCENSGBUIXVBPF-UHFFFAOYSA-N 2 0 248.355 2.212 20 0 BEADRP Cc1ccc(CC[N@@H+]2CC[C@H]3[NH2+]CC[C@@H]3C2)cc1 ZINC000335906400 356106036 /nfs/dbraw/zinc/10/60/36/356106036.db2.gz DDUNNXGGHUFYTG-HZPDHXFCSA-N 2 0 244.382 2.221 20 0 BEADRP CCc1ccc(CC[N@@H+]2CC[C@H]([C@H](C)[NH3+])C2)cc1 ZINC000351861573 356099123 /nfs/dbraw/zinc/09/91/23/356099123.db2.gz KRIDWAGZXOIVOM-BBRMVZONSA-N 2 0 246.398 2.461 20 0 BEADRP Cc1cccc2c(NCCCC[NH3+])c(C)c[nH+]c12 ZINC000420232422 192181081 /nfs/dbraw/zinc/18/10/81/192181081.db2.gz LXJXUVOATBBVIL-UHFFFAOYSA-N 2 0 243.354 2.424 20 0 BEADRP C[NH2+]C[C@H](C)CNc1cc[nH+]c2ccc(C)cc12 ZINC000420217904 192193519 /nfs/dbraw/zinc/19/35/19/192193519.db2.gz XUFBIKQGJNSTGO-LBPRGKRZSA-N 2 0 243.354 2.233 20 0 BEADRP Cc1cc(NCCCC[NH3+])c2cc(F)ccc2[nH+]1 ZINC000420240311 192183746 /nfs/dbraw/zinc/18/37/46/192183746.db2.gz UGYCWGJNFQDRSI-UHFFFAOYSA-N 2 0 247.317 2.255 20 0 BEADRP C[C@@H]([NH3+])C1CC[NH+](CCCc2ccncc2)CC1 ZINC000420295512 192203957 /nfs/dbraw/zinc/20/39/57/192203957.db2.gz PJFCGWMDXLDDBN-CYBMUJFWSA-N 2 0 247.386 2.073 20 0 BEADRP CCc1cccc(C[NH2+][C@](C)(C[NH3+])C2CC2)c1 ZINC000420297028 192204321 /nfs/dbraw/zinc/20/43/21/192204321.db2.gz YCPXQMFAIYAYSZ-OAHLLOKOSA-N 2 0 232.371 2.466 20 0 BEADRP C[C@@H]1C[N@H+](CCCc2ccsc2)CC[C@H]1[NH3+] ZINC000420296018 192204670 /nfs/dbraw/zinc/20/46/70/192204670.db2.gz WLBHZYFXJWROCO-DGCLKSJQSA-N 2 0 238.400 2.350 20 0 BEADRP CCc1ccccc1C[N@H+](C)C1CC[NH2+]CC1 ZINC000420278250 192198909 /nfs/dbraw/zinc/19/89/09/192198909.db2.gz VEUMJIMXHIWDTJ-UHFFFAOYSA-N 2 0 232.371 2.433 20 0 BEADRP [NH3+]CC[C@@H]1CCC[N@H+](CC[C@H]2CCCCO2)C1 ZINC000420321219 192199870 /nfs/dbraw/zinc/19/98/70/192199870.db2.gz ZSZYPPZYGPUWIU-UONOGXRCSA-N 2 0 240.391 2.006 20 0 BEADRP C[C@H]([NH3+])[C@H]1CCC[N@H+](CC[C@H]2CCCCO2)C1 ZINC000420281779 192200270 /nfs/dbraw/zinc/20/02/70/192200270.db2.gz AJWSCCZZTMMPFP-MELADBBJSA-N 2 0 240.391 2.005 20 0 BEADRP Cc1ccc(CN2CCC[C@@H](C)[C@@H]2C[NH3+])c(C)n1 ZINC000420289977 192201095 /nfs/dbraw/zinc/20/10/95/192201095.db2.gz LAHJBDOTOJACKL-ABAIWWIYSA-N 2 0 247.386 2.258 20 0 BEADRP CC(C)[C@H]([NH3+])CC[N@H+](C)CCCc1ccncc1 ZINC000420287068 192202131 /nfs/dbraw/zinc/20/21/31/192202131.db2.gz HJJJJQGBJVFVJR-OAHLLOKOSA-N 2 0 249.402 2.319 20 0 BEADRP C[C@H]([NH3+])[C@H]1CCC[N@H+](CCCc2ccncc2)C1 ZINC000420292679 192202513 /nfs/dbraw/zinc/20/25/13/192202513.db2.gz PVJXNQJUOOGUTD-ZFWWWQNUSA-N 2 0 247.386 2.073 20 0 BEADRP CC[C@H](C)[N@@H+]1CCC[C@@H]([C@H]2CC[NH2+]C2)C1 ZINC000420330940 192215136 /nfs/dbraw/zinc/21/51/36/192215136.db2.gz QIJUWGRVSDWWHN-RWMBFGLXSA-N 2 0 210.365 2.106 20 0 BEADRP CCCCC[N@@H+]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC000420351731 192218210 /nfs/dbraw/zinc/21/82/10/192218210.db2.gz AFUMPMNYLJTOKZ-ZDUSSCGKSA-N 2 0 210.365 2.252 20 0 BEADRP Cc1cnc([C@@H](C)[N@@H+]2CCC[C@@H](CC[NH3+])C2)o1 ZINC000420305464 192208808 /nfs/dbraw/zinc/20/88/08/192208808.db2.gz GKKKDZFDJFZYOU-NEPJUHHUSA-N 2 0 237.347 2.105 20 0 BEADRP [NH3+]CC[C@@H]1CCCC[N@@H+]1CC[C@H]1CCCCO1 ZINC000420307714 192209762 /nfs/dbraw/zinc/20/97/62/192209762.db2.gz CDTUGCHEWSGGHJ-UONOGXRCSA-N 2 0 240.391 2.149 20 0 BEADRP CCc1cccc(C[N@@H+]2C[C@@H]3CC[C@H]([NH3+])[C@@H]3C2)c1 ZINC000420311395 192210614 /nfs/dbraw/zinc/21/06/14/192210614.db2.gz RBDVXMNDVUEMCZ-XHSDSOJGSA-N 2 0 244.382 2.418 20 0 BEADRP Cc1ccc(C[N@@H+]2CCCC[C@H]2CC[NH3+])c(C)n1 ZINC000420308299 192211121 /nfs/dbraw/zinc/21/11/21/192211121.db2.gz CWUXTVUSNAMSGJ-HNNXBMFYSA-N 2 0 247.386 2.402 20 0 BEADRP Cc1ccccc1C[C@@H]1CCC[N@H+]1C[C@H](C)[NH3+] ZINC000420308410 192211179 /nfs/dbraw/zinc/21/11/79/192211179.db2.gz SCPNQXSVKDFUQO-ZFWWWQNUSA-N 2 0 232.371 2.349 20 0 BEADRP Cc1csc([C@H]2CCCCN2CCC[NH3+])n1 ZINC000420308641 192211578 /nfs/dbraw/zinc/21/15/78/192211578.db2.gz DEJOEJWIPFWYCL-LLVKDONJSA-N 2 0 239.388 2.327 20 0 BEADRP C[N@H+](CC[C@@H]1CC[NH2+]C1)C(C1CC1)C1CC1 ZINC000420311002 192211738 /nfs/dbraw/zinc/21/17/38/192211738.db2.gz VQEHAAFNGSTCGV-NSHDSACASA-N 2 0 222.376 2.106 20 0 BEADRP [NH3+]CC[C@H]1CCCC[N@@H+]1CCCc1ccncc1 ZINC000420314008 192212902 /nfs/dbraw/zinc/21/29/02/192212902.db2.gz KPVUCJCOSLERLT-OAHLLOKOSA-N 2 0 247.386 2.218 20 0 BEADRP C[C@@H]1OCC[C@@H]1C[N@@H+]1CCC[C@H](c2ncc[nH]2)C1 ZINC000639532161 356381751 /nfs/dbraw/zinc/38/17/51/356381751.db2.gz BIMFKAYCJCBTOX-XQQFMLRXSA-N 2 0 249.358 2.014 20 0 BEADRP c1cncc([C@@H]2CCC[N@H+]2CC[C@@H]2CC[NH2+]C2)c1 ZINC000420354798 192219823 /nfs/dbraw/zinc/21/98/23/192219823.db2.gz DKELWUYPNHISHL-ZFWWWQNUSA-N 2 0 245.370 2.218 20 0 BEADRP CCCC[N@@H+]1CCCC[C@@H]1[C@H]1CC[NH2+]C1 ZINC000420409531 192239237 /nfs/dbraw/zinc/23/92/37/192239237.db2.gz XFHIXICTTJSTMH-QWHCGFSZSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@@H]([NH2+]CCC1CC[NH2+]CC1)c1ccccn1 ZINC000420419836 192240847 /nfs/dbraw/zinc/24/08/47/192240847.db2.gz XVSJDRGRCSPFHF-GFCCVEGCSA-N 2 0 233.359 2.122 20 0 BEADRP CCCC[NH+]1CCC([C@@H]2OCCC[C@H]2[NH3+])CC1 ZINC000420374621 192231597 /nfs/dbraw/zinc/23/15/97/192231597.db2.gz HPWYUXWLPGTTHA-KGLIPLIRSA-N 2 0 240.391 2.005 20 0 BEADRP Cc1cc(NC2CCC([NH+](C)C)CC2)nc(C)n1 ZINC000420627967 192250994 /nfs/dbraw/zinc/25/09/94/192250994.db2.gz OJNOVCRAXAWXME-UHFFFAOYSA-N 2 0 248.374 2.378 20 0 BEADRP CCCC[N@@H+]1CCCN(c2cc[nH+]cc2)CC1 ZINC000639682114 356592776 /nfs/dbraw/zinc/59/27/76/356592776.db2.gz LDZZGDZKZWYQSG-UHFFFAOYSA-N 2 0 233.359 2.394 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]C[C@@H]1CCc2ccccc21 ZINC000422902099 192512570 /nfs/dbraw/zinc/51/25/70/192512570.db2.gz CXMONUHMHACGSC-JSGCOSHPSA-N 2 0 232.371 2.433 20 0 BEADRP COc1cc(F)cc(C[NH2+][C@H](C)C[C@@H](C)[NH3+])c1 ZINC000423015671 192540173 /nfs/dbraw/zinc/54/01/73/192540173.db2.gz LDYZBIUTJYEXMB-NXEZZACHSA-N 2 0 240.322 2.050 20 0 BEADRP Cc1cc(C[NH2+][C@@H](C)C2C[NH2+]C2)ccc1Cl ZINC000423029408 192545422 /nfs/dbraw/zinc/54/54/22/192545422.db2.gz AAWFZVUBBGMOLM-JTQLQIEISA-N 2 0 238.762 2.346 20 0 BEADRP CCC[NH+]1CCC([NH2+]CCCCOCC)CC1 ZINC000165070715 538464250 /nfs/dbraw/zinc/46/42/50/538464250.db2.gz KCRGHUCUEVJZEZ-UHFFFAOYSA-N 2 0 242.407 2.267 20 0 BEADRP Cc1cnc([C@@H](C)C[NH2+][C@@H](C)CCC[NH3+])s1 ZINC000423037651 192548025 /nfs/dbraw/zinc/54/80/25/192548025.db2.gz NHMVUKFOJYEEPH-UWVGGRQHSA-N 2 0 241.404 2.272 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]C1CCC2(CC2)CC1 ZINC000423077928 192561052 /nfs/dbraw/zinc/56/10/52/192561052.db2.gz USRGFPXLXZKTOK-LLVKDONJSA-N 2 0 210.365 2.426 20 0 BEADRP Cc1ccsc1C[N@H+]1CC[C@@H](C)[C@H](C[NH3+])C1 ZINC000167608103 134153043 /nfs/dbraw/zinc/15/30/43/134153043.db2.gz DSFLDCQYYBKWSA-ZYHUDNBSSA-N 2 0 238.400 2.473 20 0 BEADRP CCc1cc(N(C)C[C@H]2CCC[N@H+](C)C2)cc[nH+]1 ZINC000450333632 202132628 /nfs/dbraw/zinc/13/26/28/202132628.db2.gz QJLPMJXSXXSSDQ-ZDUSSCGKSA-N 2 0 247.386 2.422 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCc2ccc(F)cc21)C1C[NH2+]C1 ZINC000582235568 356651877 /nfs/dbraw/zinc/65/18/77/356651877.db2.gz FGOSZUYCMDHRCO-LKFCYVNXSA-N 2 0 234.318 2.011 20 0 BEADRP C[NH+]1CCC2(CC[N@H+](CC3CC=CC3)C2)CC1 ZINC000639754624 356656229 /nfs/dbraw/zinc/65/62/29/356656229.db2.gz DCHGJLMUIGNUHL-UHFFFAOYSA-N 2 0 234.387 2.370 20 0 BEADRP COCC1(CC[NH2+][C@@H](C)CCCC[NH3+])CCC1 ZINC000423126603 192576986 /nfs/dbraw/zinc/57/69/86/192576986.db2.gz BDRDVRJRFSVZEH-ZDUSSCGKSA-N 2 0 242.407 2.300 20 0 BEADRP CC[C@H]([NH2+]CC1CC[NH+](C)CC1)[C@H]1C[C@H]1C ZINC000321096238 259469007 /nfs/dbraw/zinc/46/90/07/259469007.db2.gz ODMMUELXAMYRND-XBFCOCLRSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000070828320 325036007 /nfs/dbraw/zinc/03/60/07/325036007.db2.gz PYOKJFOPPONBTB-FRRDWIJNSA-N 2 0 210.365 2.106 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]C[C@@H]1C[C@H]1C1CC1 ZINC000423170957 192605265 /nfs/dbraw/zinc/60/52/65/192605265.db2.gz ZCDNVKUFHBDXEZ-IGQOVBAYSA-N 2 0 222.376 2.282 20 0 BEADRP C1[C@@H]2[C@H]1CCC[C@@H]2[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000423169327 192605909 /nfs/dbraw/zinc/60/59/09/192605909.db2.gz JCMZPMOHIYPRLO-XOZLUIIUSA-N 2 0 220.360 2.048 20 0 BEADRP C[N@@H+]1CC[C@@H](NCc2cscn2)CC1(C)C ZINC000623387236 356917192 /nfs/dbraw/zinc/91/71/92/356917192.db2.gz RGBXVNSCGWKRRB-SNVBAGLBSA-N 2 0 239.388 2.106 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1)C1CC1 ZINC000623375493 356894647 /nfs/dbraw/zinc/89/46/47/356894647.db2.gz PZFTWUNHJZWXSK-DGCLKSJQSA-N 2 0 224.392 2.495 20 0 BEADRP CCC[C@@H](C)[C@H](CC)[NH2+]CCC[NH2+]C ZINC000423199116 192624237 /nfs/dbraw/zinc/62/42/37/192624237.db2.gz JCLPXYJJCYKJJV-NEPJUHHUSA-N 2 0 200.370 2.400 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1CCCNc2ccccc21 ZINC000423201470 192624805 /nfs/dbraw/zinc/62/48/05/192624805.db2.gz OVCJMJHLVHYYTF-CQSZACIVSA-N 2 0 233.359 2.133 20 0 BEADRP C[C@@H]1C[C@@H](C)C[NH+](C[C@@H]2CCCC[NH2+]C2)C1 ZINC000257786749 538765855 /nfs/dbraw/zinc/76/58/55/538765855.db2.gz MJNAFIYCSVUAGF-MGPQQGTHSA-N 2 0 224.392 2.354 20 0 BEADRP CC[C@@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1ccncc1 ZINC000423238420 192645658 /nfs/dbraw/zinc/64/56/58/192645658.db2.gz AGDSBWHSIUUETI-GXTWGEPZSA-N 2 0 233.359 2.122 20 0 BEADRP CCc1ccc([C@@H](C)[NH2+]CC[C@H]2CC[NH2+]C2)o1 ZINC000423243592 192648549 /nfs/dbraw/zinc/64/85/49/192648549.db2.gz GQUNFXLFCYNUED-VXGBXAGGSA-N 2 0 236.359 2.492 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+][C@H]1CCCC12CCC2 ZINC000423263871 192658252 /nfs/dbraw/zinc/65/82/52/192658252.db2.gz BHISAVZIAKFLJD-RYUDHWBXSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1cccs1 ZINC000423249051 192651217 /nfs/dbraw/zinc/65/12/17/192651217.db2.gz ODTVOCYOEXPODG-GHMZBOCLSA-N 2 0 224.373 2.398 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1cccs1 ZINC000423249054 192652032 /nfs/dbraw/zinc/65/20/32/192652032.db2.gz ODTVOCYOEXPODG-QWRGUYRKSA-N 2 0 224.373 2.398 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1ccccc1F ZINC000423253798 192652581 /nfs/dbraw/zinc/65/25/81/192652581.db2.gz WIGWCJZQKSHGGK-RYUDHWBXSA-N 2 0 236.334 2.476 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]CC2(C3CC3)CCC2)C1 ZINC000391456074 357129650 /nfs/dbraw/zinc/12/96/50/357129650.db2.gz JHTMPBHZVAIUHY-CHWSQXEVSA-N 2 0 222.376 2.426 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]CC2(C3CC3)CCC2)C1 ZINC000391456079 357129871 /nfs/dbraw/zinc/12/98/71/357129871.db2.gz JHTMPBHZVAIUHY-QWHCGFSZSA-N 2 0 222.376 2.426 20 0 BEADRP CCN(CC(C)=O)Cc1ccc(C[NH+](C)C)cc1 ZINC000639894285 357230249 /nfs/dbraw/zinc/23/02/49/357230249.db2.gz ANBWLUGJERBCGK-UHFFFAOYSA-N 2 0 248.370 2.159 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+][C@H](C)C1CCSCC1 ZINC000423269466 192662759 /nfs/dbraw/zinc/66/27/59/192662759.db2.gz HGPIHIDAHYBWSD-PWSUYJOCSA-N 2 0 230.421 2.091 20 0 BEADRP CCC1CC([NH2+]CC[C@@H]2CCC[NH2+]C2)C1 ZINC000423268690 192663373 /nfs/dbraw/zinc/66/33/73/192663373.db2.gz GFRZXYRVMZYSTQ-CPCZMJQVSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCCSC1)C1CC[NH+](C)CC1 ZINC000157133099 538810676 /nfs/dbraw/zinc/81/06/76/538810676.db2.gz BEULIQOQBJSEFS-DGCLKSJQSA-N 2 0 242.432 2.202 20 0 BEADRP C[N@@H+]1CCCC[C@H](C[NH2+]Cc2ccc(O)cc2)C1 ZINC000628425751 357253144 /nfs/dbraw/zinc/25/31/44/357253144.db2.gz UKPSBFRIJFSKGT-CQSZACIVSA-N 2 0 248.370 2.214 20 0 BEADRP C[N@@H+]1CCCC[C@@H](C[NH2+][C@H]2CCC[C@@H]3C[C@@H]32)C1 ZINC000628425710 357253548 /nfs/dbraw/zinc/25/35/48/357253548.db2.gz SNBGIOCXBXMITM-XGUBFFRZSA-N 2 0 236.403 2.497 20 0 BEADRP COC[C@@H]([NH2+]Cc1ccc([C@@H](C)[NH3+])cc1)C1CC1 ZINC000423293656 192684489 /nfs/dbraw/zinc/68/44/89/192684489.db2.gz RVAWMFKTZOYTER-IAQYHMDHSA-N 2 0 248.370 2.221 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@@H](C)c1cc2c(s1)CCC2 ZINC000423294812 192684492 /nfs/dbraw/zinc/68/44/92/192684492.db2.gz CUFCCGPWYUAFDK-UWVGGRQHSA-N 2 0 238.400 2.482 20 0 BEADRP CC(C)([NH3+])C[NH2+][C@H]1CCC[C@@H]1CCCF ZINC000423290180 192682464 /nfs/dbraw/zinc/68/24/64/192682464.db2.gz ZIJJRBFPKYTDOD-MNOVXSKESA-N 2 0 216.344 2.232 20 0 BEADRP C[C@@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)[C@@H]1CCCO1 ZINC000423289865 192682942 /nfs/dbraw/zinc/68/29/42/192682942.db2.gz BUJLNSRDIPLSRM-ZOWXZIJZSA-N 2 0 248.370 2.363 20 0 BEADRP Cc1cc(C[NH2+]CC[C@H]2CC[NH2+]C2)c(C)s1 ZINC000582653511 357364187 /nfs/dbraw/zinc/36/41/87/357364187.db2.gz LUJIHSQHPLZAIU-GFCCVEGCSA-N 2 0 238.400 2.454 20 0 BEADRP CCC([NH3+])(CC)CN[C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000423290027 192683133 /nfs/dbraw/zinc/68/31/33/192683133.db2.gz CABLLSCIVSBMSA-ZIAGYGMSSA-N 2 0 247.386 2.238 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@@H]2CC[C@H](C)C2)CC1 ZINC000230407064 357539385 /nfs/dbraw/zinc/53/93/85/357539385.db2.gz CNAYQKFNFDKNPK-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)CC[NH+]1CCC([C@@H]2CCC[NH2+]2)CC1 ZINC000063197539 357593095 /nfs/dbraw/zinc/59/30/95/357593095.db2.gz JBBVLXGGRYTXHK-AWEZNQCLSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH+](C)CCOCC[NH2+]CC1CCCCCC1 ZINC000231676466 357619971 /nfs/dbraw/zinc/61/99/71/357619971.db2.gz WTXDGCDBCXJYOG-UHFFFAOYSA-N 2 0 242.407 2.125 20 0 BEADRP CC[NH+](CC)CCC[N@H+](C)[C@@H](CO)C(C)(C)C ZINC000189930617 357677115 /nfs/dbraw/zinc/67/71/15/357677115.db2.gz LGTXDMMDFNTHKC-ZDUSSCGKSA-N 2 0 244.423 2.057 20 0 BEADRP CC[C@H]([NH2+]CCC[NH+](CC)CC)[C@H]1CCCO1 ZINC000191611562 357779006 /nfs/dbraw/zinc/77/90/06/357779006.db2.gz DYIQLGIZOCPFHD-UONOGXRCSA-N 2 0 242.407 2.266 20 0 BEADRP CC[C@H]([NH2+]CCC[NH+](CC)CC)[C@@H]1CCCO1 ZINC000191611534 357779095 /nfs/dbraw/zinc/77/90/95/357779095.db2.gz DYIQLGIZOCPFHD-KBPBESRZSA-N 2 0 242.407 2.266 20 0 BEADRP CC[C@H]1CCC[C@H]1[NH2+]CC1CC[NH+](C)CC1 ZINC000133336625 325287396 /nfs/dbraw/zinc/28/73/96/325287396.db2.gz AFWWZPJAKLOULK-UONOGXRCSA-N 2 0 224.392 2.497 20 0 BEADRP CCNCC[NH2+]C[C@@H]1CCCC(C)(C)C1 ZINC000583740373 357931696 /nfs/dbraw/zinc/93/16/96/357931696.db2.gz VQQDBMABFOEOTA-GFCCVEGCSA-N 2 0 212.381 2.402 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)C1CCC1 ZINC000133404954 325293478 /nfs/dbraw/zinc/29/34/78/325293478.db2.gz ZRLRJUMLAAGYPE-NWDGAFQWSA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+][C@H](C)CC2CC2)C1 ZINC000229692391 491119238 /nfs/dbraw/zinc/11/92/38/491119238.db2.gz HRPADKIECJKYNH-OCCSQVGLSA-N 2 0 224.392 2.495 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+]C(C2CC2)C2CC2)C1 ZINC000037484243 358072591 /nfs/dbraw/zinc/07/25/91/358072591.db2.gz UGRQIMHAELXZIR-NSHDSACASA-N 2 0 222.376 2.106 20 0 BEADRP [NH3+]Cc1ccc(OCCC[NH+]2CCCCC2)cc1 ZINC000037049945 358064866 /nfs/dbraw/zinc/06/48/66/358064866.db2.gz YNLCXDVEZOKNSY-UHFFFAOYSA-N 2 0 248.370 2.400 20 0 BEADRP C[C@]1(C[NH+]2CCc3ccccc3CC2)CC[NH2+]C1 ZINC000079574153 358107250 /nfs/dbraw/zinc/10/72/50/358107250.db2.gz XOYJRYXYCNNZFW-INIZCTEOSA-N 2 0 244.382 2.087 20 0 BEADRP C[C@@]1(C[NH+]2CCc3ccccc3CC2)CC[NH2+]C1 ZINC000079574156 358107472 /nfs/dbraw/zinc/10/74/72/358107472.db2.gz XOYJRYXYCNNZFW-MRXNPFEDSA-N 2 0 244.382 2.087 20 0 BEADRP CC(C)C[C@@H]([NH3+])C[NH2+][C@@H]1CCc2cc(N)ccc21 ZINC000578206656 366390575 /nfs/dbraw/zinc/39/05/75/366390575.db2.gz ZWOFAOMDHGHHLS-UKRRQHHQSA-N 2 0 247.386 2.219 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@H]1CCCC[C@@H]1C ZINC000219154585 134274634 /nfs/dbraw/zinc/27/46/34/134274634.db2.gz FMZIHPBZNLKUQT-XQQFMLRXSA-N 2 0 212.381 2.495 20 0 BEADRP C[C@H]([N@H+](C)C[C@@H]1CCC[NH2+]C1)C(C)(C)C ZINC000042781603 358358786 /nfs/dbraw/zinc/35/87/86/358358786.db2.gz HJRDZGYJMGOCRP-NWDGAFQWSA-N 2 0 212.381 2.352 20 0 BEADRP CC[C@@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)C(C)C ZINC000044533306 358389314 /nfs/dbraw/zinc/38/93/14/358389314.db2.gz TWUMGMMGQQATDM-CHWSQXEVSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1cccc(O)c1 ZINC000044534564 358389522 /nfs/dbraw/zinc/38/95/22/358389522.db2.gz ZXDUYUYVSOILOH-CHWSQXEVSA-N 2 0 248.370 2.385 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1ccncc1 ZINC000044535026 358390053 /nfs/dbraw/zinc/39/00/53/358390053.db2.gz IUUHDEBWQKNNHR-QWHCGFSZSA-N 2 0 233.359 2.074 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)C(C)C ZINC000044533302 358390171 /nfs/dbraw/zinc/39/01/71/358390171.db2.gz TWUMGMMGQQATDM-QWHCGFSZSA-N 2 0 212.381 2.352 20 0 BEADRP CCCCOCC[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000127999396 358568908 /nfs/dbraw/zinc/56/89/08/358568908.db2.gz XTPIKNBNZCNBEZ-ZIAGYGMSSA-N 2 0 240.391 2.020 20 0 BEADRP C([NH2+]C1CC[NH+](C2CCCC2)CC1)C1CC1 ZINC000131819879 358696091 /nfs/dbraw/zinc/69/60/91/358696091.db2.gz ATDHIDTWCWKALJ-UHFFFAOYSA-N 2 0 222.376 2.393 20 0 BEADRP CC[C@H](C)C[NH+]1CCC([NH2+]CC2CC2)CC1 ZINC000133231308 358748520 /nfs/dbraw/zinc/74/85/20/358748520.db2.gz RFVRDOPLGZFENV-LBPRGKRZSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)[C@@H]([NH3+])CC[N@H+](C)Cc1cccc(O)c1 ZINC000133339042 358751907 /nfs/dbraw/zinc/75/19/07/358751907.db2.gz LMWZSDMKWQEDNW-AWEZNQCLSA-N 2 0 236.359 2.197 20 0 BEADRP C[C@@H](CCc1ccco1)[NH2+]C1CCC([NH3+])CC1 ZINC000051692855 358758249 /nfs/dbraw/zinc/75/82/49/358758249.db2.gz ARRPPWGCSSGOQY-HIFPTAJRSA-N 2 0 236.359 2.460 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCCC(F)(F)F)CC[N@@H+]1C ZINC000132334274 358718856 /nfs/dbraw/zinc/71/88/56/358718856.db2.gz KESZLUBLUSPBQK-NXEZZACHSA-N 2 0 238.297 2.401 20 0 BEADRP Cc1cc(F)ccc1C[NH2+][C@@H]1CCN(C2CC2)C1 ZINC000050577702 358733400 /nfs/dbraw/zinc/73/34/00/358733400.db2.gz MFJYXHQTNZOVGK-CQSZACIVSA-N 2 0 248.345 2.460 20 0 BEADRP C[NH2+]CCC[N@@H+]1CC[C@@H](c2ccccc2)C1 ZINC000050600625 358734068 /nfs/dbraw/zinc/73/40/68/358734068.db2.gz TWLFPRBWCYLNLY-CQSZACIVSA-N 2 0 218.344 2.085 20 0 BEADRP C[C@H]1Cc2ccc(F)cc2[C@@H]1[NH2+]CCCC[NH3+] ZINC000423315379 192701212 /nfs/dbraw/zinc/70/12/12/192701212.db2.gz APBWAHXHTNWLGY-IINYFYTJSA-N 2 0 236.334 2.388 20 0 BEADRP Cc1c([C@H](C)[NH2+]CCCC[NH3+])cnn1C(C)C ZINC000423343561 192720143 /nfs/dbraw/zinc/72/01/43/192720143.db2.gz ZYGWIHGZPVHRMB-NSHDSACASA-N 2 0 238.379 2.162 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CC2=CC[NH2+]CC2)[C@@H](C)C1 ZINC000423345902 192722940 /nfs/dbraw/zinc/72/29/40/192722940.db2.gz OMOZJAIZPRRESD-DYEKYZERSA-N 2 0 222.376 2.320 20 0 BEADRP C1=C(C[NH2+][C@H]2CCCC[C@@H]2C2CC2)CC[NH2+]C1 ZINC000423349218 192723907 /nfs/dbraw/zinc/72/39/07/192723907.db2.gz WDFLBNAFCQYEFX-CABCVRRESA-N 2 0 234.387 2.465 20 0 BEADRP COC[C@H]([NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1)C(C)C ZINC000246919322 359174600 /nfs/dbraw/zinc/17/46/00/359174600.db2.gz GAFVXZXCPXCIJJ-MJBXVCDLSA-N 2 0 242.407 2.120 20 0 BEADRP C[N@@H+]1CCC[C@@H]2CN(C/C=C/Cl)CC[C@H]21 ZINC000248197941 359258781 /nfs/dbraw/zinc/25/87/81/359258781.db2.gz XRNXTWPJMRBORC-JKNNBXRXSA-N 2 0 228.767 2.155 20 0 BEADRP C[C@@H]([NH2+]CC1CC[NH2+]CC1)c1ccsc1 ZINC000086701099 359355344 /nfs/dbraw/zinc/35/53/44/359355344.db2.gz VOVUMBNFMNBAQM-SNVBAGLBSA-N 2 0 224.373 2.398 20 0 BEADRP CC[C@H]([NH2+][C@H]1CC[NH2+][C@@H](C)C1)C1CCC1 ZINC000423392095 192764232 /nfs/dbraw/zinc/76/42/32/192764232.db2.gz XLCQTPIPMGMLPB-DRZSPHRISA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[C@H]([NH3+])C1)[C@H]1C[C@H]1C ZINC000423461389 192778481 /nfs/dbraw/zinc/77/84/81/192778481.db2.gz CISOZPMWAAEDQD-FHUSYTEZSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](C)c1ccc(F)cn1 ZINC000423438358 192769123 /nfs/dbraw/zinc/76/91/23/192769123.db2.gz RIPJGUXWZMHJBJ-QWRGUYRKSA-N 2 0 239.338 2.389 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@H](C)C1C(C)(C)C1(C)C ZINC000423440669 192770013 /nfs/dbraw/zinc/77/00/13/192770013.db2.gz AVNGMKJFCFKRDI-NXEZZACHSA-N 2 0 212.381 2.384 20 0 BEADRP CC[C@@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)C(C)C ZINC000423440866 192770234 /nfs/dbraw/zinc/77/02/34/192770234.db2.gz PAKQXIWALPLVRE-BFHYXJOUSA-N 2 0 224.392 2.399 20 0 BEADRP CC(C)[C@H]1CC[C@H]1[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000423446567 192773109 /nfs/dbraw/zinc/77/31/09/192773109.db2.gz SPOXKRGNPHVPJF-LXTVHRRPSA-N 2 0 236.403 2.399 20 0 BEADRP CCO[C@@H]1C[C@H]([NH2+][C@H](C)[C@@H](C)[NH3+])C12CCCC2 ZINC000423453815 192776112 /nfs/dbraw/zinc/77/61/12/192776112.db2.gz YHCZLOGMNJERAV-FVCCEPFGSA-N 2 0 240.391 2.050 20 0 BEADRP CCc1cccnc1[C@@H](C)[NH2+][C@H](C)CCC[NH3+] ZINC000423454540 192776852 /nfs/dbraw/zinc/77/68/52/192776852.db2.gz LOZWETZSCCAHCH-VXGBXAGGSA-N 2 0 235.375 2.422 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[C@@H](C[NH3+])C1)c1ccccc1 ZINC000423492120 192793555 /nfs/dbraw/zinc/79/35/55/192793555.db2.gz LVGSUIXIWBTEQZ-SCRDCRAPSA-N 2 0 218.344 2.465 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@@H](c1ccccc1)C1CC1 ZINC000423470342 192784393 /nfs/dbraw/zinc/78/43/93/192784393.db2.gz PFTPWVSRNGPWAU-KBPBESRZSA-N 2 0 218.344 2.465 20 0 BEADRP CCN1CCC([NH2+][C@@H]2CCC[C@@H](OC)C2)CC1 ZINC000223816889 491140565 /nfs/dbraw/zinc/14/05/65/491140565.db2.gz LBYXVLIOFXMVBU-ZIAGYGMSSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)[C@H]1C[C@H]1C ZINC000423482672 192790022 /nfs/dbraw/zinc/79/00/22/192790022.db2.gz PNDLYVUITVUYNJ-LPWJVIDDSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)C1CC([NH2+][C@H]2CC[C@H](C[NH3+])C2)C1 ZINC000423520452 192800990 /nfs/dbraw/zinc/80/09/90/192800990.db2.gz WBETWZODGNHYED-QCXCNERSSA-N 2 0 210.365 2.138 20 0 BEADRP CCCC1(C[NH2+][C@@H](C)[C@@H]2CCC[NH2+]2)CC1 ZINC000400674380 359487550 /nfs/dbraw/zinc/48/75/50/359487550.db2.gz VFTBDRAHHSMWIQ-RYUDHWBXSA-N 2 0 210.365 2.297 20 0 BEADRP CCC1CC([NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)C1 ZINC000423541140 192808951 /nfs/dbraw/zinc/80/89/51/192808951.db2.gz FFEBLKWSRUAJBJ-DEULPLRUSA-N 2 0 222.376 2.153 20 0 BEADRP CC[C@@H]1C[C@@H]([NH2+][C@H](C)CCCC[NH3+])CCO1 ZINC000423543923 192809578 /nfs/dbraw/zinc/80/95/78/192809578.db2.gz IDFFOYGNJBGSBD-FRRDWIJNSA-N 2 0 228.380 2.051 20 0 BEADRP CCC(=O)CCC[N@@H+]1CCC[C@H]([NH+](C)C)CC1 ZINC000450852430 202290736 /nfs/dbraw/zinc/29/07/36/202290736.db2.gz FLAUGOCDYCMKDK-ZDUSSCGKSA-N 2 0 240.391 2.162 20 0 BEADRP CSCC[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000169241579 359878641 /nfs/dbraw/zinc/87/86/41/359878641.db2.gz NORLPCYEWBZECI-NWDGAFQWSA-N 2 0 222.357 2.084 20 0 BEADRP C[C@H]([NH2+]CCC1=CC[NH2+]CC1)c1cscn1 ZINC000578757539 366640571 /nfs/dbraw/zinc/64/05/71/366640571.db2.gz PEKPZAZECRQVRP-JTQLQIEISA-N 2 0 237.372 2.104 20 0 BEADRP C[C@H]([NH3+])[C@H]1COCC[C@H]1[NH2+]CCCC(C)(C)C ZINC000578878481 366664620 /nfs/dbraw/zinc/66/46/20/366664620.db2.gz UWRFQHHHEZIXIY-YNEHKIRRSA-N 2 0 242.407 2.155 20 0 BEADRP COCc1cccc(C[N@@H+]2CCC[C@@H](C[NH3+])C2)c1 ZINC000088555214 359966128 /nfs/dbraw/zinc/96/61/28/359966128.db2.gz HANJLFZRPXIHTB-HNNXBMFYSA-N 2 0 248.370 2.004 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+]CCc1ccc(O)cc1 ZINC000089145569 359993053 /nfs/dbraw/zinc/99/30/53/359993053.db2.gz YJNWSRBUINMXBC-HIFRSBDPSA-N 2 0 248.370 2.042 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCCC[C@@H]1C[NH3+])c1cccnc1 ZINC000089140097 359993117 /nfs/dbraw/zinc/99/31/17/359993117.db2.gz LKRGSACBTKPNEZ-OUCADQQQSA-N 2 0 233.359 2.250 20 0 BEADRP CCC(CC)[N@H+](CCOC)CC[C@H]1CC[NH2+]C1 ZINC000089749291 360037075 /nfs/dbraw/zinc/03/70/75/360037075.db2.gz PMEDPOWHTMISMZ-CYBMUJFWSA-N 2 0 242.407 2.123 20 0 BEADRP C[N@H+](CC[C@@H]1CC[NH2+]C1)Cc1cccc(F)c1 ZINC000089749131 360037322 /nfs/dbraw/zinc/03/73/22/360037322.db2.gz VUEBKAYJFRYCQO-LBPRGKRZSA-N 2 0 236.334 2.257 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]CCCOc1ccccc1 ZINC000089150544 359993845 /nfs/dbraw/zinc/99/38/45/359993845.db2.gz JERVFUSNRQGWOZ-ZFWWWQNUSA-N 2 0 248.370 2.173 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]Cc1cc(F)ccc1F ZINC000089150688 359994019 /nfs/dbraw/zinc/99/40/19/359994019.db2.gz BXNGBPTVFGXTGZ-ZANVPECISA-N 2 0 240.297 2.182 20 0 BEADRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]CCCOc1ccccc1 ZINC000089150542 359994026 /nfs/dbraw/zinc/99/40/26/359994026.db2.gz JERVFUSNRQGWOZ-HIFRSBDPSA-N 2 0 248.370 2.173 20 0 BEADRP COCc1ccccc1C[NH2+][C@H]1CCC[C@@H]1C[NH3+] ZINC000089149877 359994303 /nfs/dbraw/zinc/99/43/03/359994303.db2.gz ZCGAEWAIUHBVFQ-DOMZBBRYSA-N 2 0 248.370 2.050 20 0 BEADRP CCC1(C[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)CC1 ZINC000090219447 360065707 /nfs/dbraw/zinc/06/57/07/360065707.db2.gz VDXFCZBOUYYXFI-QWHCGFSZSA-N 2 0 222.376 2.393 20 0 BEADRP CCOCCC[NH2+][C@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000093496276 360251676 /nfs/dbraw/zinc/25/16/76/360251676.db2.gz XGNGKMLKAWRKNJ-ZIAGYGMSSA-N 2 0 242.407 2.313 20 0 BEADRP COCC[C@H](C)[NH2+][C@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000093516654 360255627 /nfs/dbraw/zinc/25/56/27/360255627.db2.gz BFGHGHSGWPHYNT-MJBXVCDLSA-N 2 0 242.407 2.312 20 0 BEADRP Cc1ccc(C[N@H+](C)CC2CC[NH+](C)CC2)o1 ZINC000093088813 360216890 /nfs/dbraw/zinc/21/68/90/360216890.db2.gz CIAOKTOGJAIHOT-UHFFFAOYSA-N 2 0 236.359 2.362 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+][C@H]1CCOC2(CCC2)C1 ZINC000094370484 360306045 /nfs/dbraw/zinc/30/60/45/360306045.db2.gz KMHDUSWRRFRUJW-STQMWFEESA-N 2 0 240.391 2.018 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@H]1CC(C)(C)OC1(C)C ZINC000094424253 360307558 /nfs/dbraw/zinc/30/75/58/360307558.db2.gz QDWPUGVKIYIYGX-LBPRGKRZSA-N 2 0 242.407 2.264 20 0 BEADRP Cc1ncc([C@@H](C)[NH2+]CCCC[NH+](C)C)s1 ZINC000309458730 491148676 /nfs/dbraw/zinc/14/86/76/491148676.db2.gz OEXUWONIWRWAGO-SNVBAGLBSA-N 2 0 241.404 2.444 20 0 BEADRP C[C@@H]1C[C@H](C)[N@H+](C/C=C/Cl)C[C@H]1C[NH3+] ZINC000306546855 360417808 /nfs/dbraw/zinc/41/78/08/360417808.db2.gz AQJLGTGIJXHSEB-DYSSWMIWSA-N 2 0 216.756 2.044 20 0 BEADRP C(CC[NH2+]C1CSC1)CC[NH+]1CCCCC1 ZINC000309585396 491151538 /nfs/dbraw/zinc/15/15/38/491151538.db2.gz VFRGVMDVIOSFJJ-UHFFFAOYSA-N 2 0 242.432 2.348 20 0 BEADRP Cc1cccc(C[NH2+]CCCC[NH3+])c1C ZINC000043314183 200685683 /nfs/dbraw/zinc/68/56/83/200685683.db2.gz LYPIUQXQJQTJFU-UHFFFAOYSA-N 2 0 206.333 2.132 20 0 BEADRP c1cn(CCC[NH2+][C@@H]2CC[C@H]2C2CC2)cn1 ZINC000309577996 491152047 /nfs/dbraw/zinc/15/20/47/491152047.db2.gz RAAZKNKTMVYXAA-QWHCGFSZSA-N 2 0 219.332 2.051 20 0 BEADRP C[C@@H](Cc1ccsc1)[NH2+]CC1([NH3+])CCC1 ZINC000578976476 366684297 /nfs/dbraw/zinc/68/42/97/366684297.db2.gz OWZHSMDCAKWTNS-JTQLQIEISA-N 2 0 224.373 2.150 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CC2CCCC2)CC[N@@H+]1C ZINC000155880727 360932223 /nfs/dbraw/zinc/93/22/23/360932223.db2.gz LRDUKCGLVODQIS-YPMHNXCESA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+][C@H]1CCC[C@@H](C)[C@H]1C ZINC000629407588 361055500 /nfs/dbraw/zinc/05/55/00/361055500.db2.gz FEKBEYQUKKYZEB-NAWOPXAZSA-N 2 0 210.365 2.151 20 0 BEADRP CCCC[C@H](CC)[NH2+]CC1([NH3+])CCOCC1 ZINC000629388771 361035737 /nfs/dbraw/zinc/03/57/37/361035737.db2.gz SVYGHZLVMGGYSD-LBPRGKRZSA-N 2 0 228.380 2.053 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1[NH2+][C@H](C)CCC(F)(F)F ZINC000629389595 361037065 /nfs/dbraw/zinc/03/70/65/361037065.db2.gz ZMVGQGQPGILUSV-KXUCPTDWSA-N 2 0 238.297 2.448 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1[NH2+][C@@H]1CCC[C@H](C)C1 ZINC000629390215 361037615 /nfs/dbraw/zinc/03/76/15/361037615.db2.gz ANRDGSIDMLDRBB-QNWHQSFQSA-N 2 0 210.365 2.295 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1[NH2+][C@H]1CCCC1(C)C ZINC000629390317 361038012 /nfs/dbraw/zinc/03/80/12/361038012.db2.gz NYJYNUFKNZOTCK-TUAOUCFPSA-N 2 0 210.365 2.295 20 0 BEADRP CC1(C)CCCC[C@@H]1[NH2+]CC1([NH3+])CCOCC1 ZINC000629387386 361038717 /nfs/dbraw/zinc/03/87/17/361038717.db2.gz IFFSMUOGJKBZTC-LBPRGKRZSA-N 2 0 240.391 2.053 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1[NH2+][C@@H]1CCC(C)(C)C1 ZINC000629387890 361040128 /nfs/dbraw/zinc/04/01/28/361040128.db2.gz IAXNYGDBUGCTTQ-GRYCIOLGSA-N 2 0 210.365 2.295 20 0 BEADRP C[NH2+]CCOCC[NH2+][C@@H]1CCC(C)(C)C[C@@H]1C ZINC000629404195 361050028 /nfs/dbraw/zinc/05/00/28/361050028.db2.gz LROGNINQQFUUFR-QWHCGFSZSA-N 2 0 242.407 2.027 20 0 BEADRP CC[C@@H]1CCC[C@H](C[NH2+]CCOCCC[NH3+])C1 ZINC000629399776 361050920 /nfs/dbraw/zinc/05/09/20/361050920.db2.gz BOIQOQIRBOOVLC-KGLIPLIRSA-N 2 0 242.407 2.158 20 0 BEADRP C[C@@H](CCC1CCCC1)[NH2+]CCOCCC[NH3+] ZINC000629400353 361052168 /nfs/dbraw/zinc/05/21/68/361052168.db2.gz VEXVUFURVBTHJL-ZDUSSCGKSA-N 2 0 242.407 2.300 20 0 BEADRP CC1(C)CCC(C[NH2+]CCOCCC[NH3+])CC1 ZINC000629402270 361052636 /nfs/dbraw/zinc/05/26/36/361052636.db2.gz YMSNJDKHUYTFSW-UHFFFAOYSA-N 2 0 242.407 2.158 20 0 BEADRP CCC1(C)CCC([NH2+]CCOCC[NH2+]C)CC1 ZINC000629404892 361054544 /nfs/dbraw/zinc/05/45/44/361054544.db2.gz SNOOQPOGAKTHMO-UHFFFAOYSA-N 2 0 242.407 2.171 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+]C[C@@H]1CCCC[C@@H]1C ZINC000629408690 361059788 /nfs/dbraw/zinc/05/97/88/361059788.db2.gz YQAPAEYPJJESOA-ZDEQEGDKSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)=CCC[C@H](C)[NH2+]CC1([NH3+])CCOCC1 ZINC000629520214 361116782 /nfs/dbraw/zinc/11/67/82/361116782.db2.gz DHUMZGBNJVLDKB-ZDUSSCGKSA-N 2 0 240.391 2.219 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1[NH2+][C@@H]1CCC[C@@H]2C[C@@]21C ZINC000629527932 361135435 /nfs/dbraw/zinc/13/54/35/361135435.db2.gz JVBYZJDPGTZXIV-ITGHMWBKSA-N 2 0 222.376 2.295 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1[NH2+][C@H]1CCCC12CCC2 ZINC000629528096 361135595 /nfs/dbraw/zinc/13/55/95/361135595.db2.gz PDVBKCBFQDMUNG-XQQFMLRXSA-N 2 0 222.376 2.439 20 0 BEADRP CC[C@@H]([NH2+]CCOCC[NH2+]C)c1ccsc1 ZINC000629530926 361145844 /nfs/dbraw/zinc/14/58/44/361145844.db2.gz VHPQNZDNFUMDDF-GFCCVEGCSA-N 2 0 242.388 2.025 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CC[C@@H]1CC=CCC1 ZINC000629531541 361149287 /nfs/dbraw/zinc/14/92/87/361149287.db2.gz OJDQRRKFLCFWSR-RWMBFGLXSA-N 2 0 210.365 2.448 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+]CC[C@@H]1CC=CCC1 ZINC000629531793 361150011 /nfs/dbraw/zinc/15/00/11/361150011.db2.gz YDUSNUIFDJRWIL-KGLIPLIRSA-N 2 0 240.391 2.076 20 0 BEADRP CC[C@H]([NH2+]CC1([NH3+])CCOCC1)c1ccccc1 ZINC000629523853 361122249 /nfs/dbraw/zinc/12/22/49/361122249.db2.gz JZXOSCMFRMOIJQ-AWEZNQCLSA-N 2 0 248.370 2.235 20 0 BEADRP CCCC[C@@H](C)[C@H](C)[NH2+]CC1([NH3+])CCOCC1 ZINC000629521794 361122284 /nfs/dbraw/zinc/12/22/84/361122284.db2.gz UNDWNAINDPRXOM-OLZOCXBDSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+]C1CSC1 ZINC000309747741 491155957 /nfs/dbraw/zinc/15/59/57/491155957.db2.gz GBEJWPNFRYQNCW-GFCCVEGCSA-N 2 0 242.432 2.346 20 0 BEADRP CC(C)OC1CC([NH2+]CCC[N@H+](C)C(C)C)C1 ZINC000428270484 201004582 /nfs/dbraw/zinc/00/45/82/201004582.db2.gz ZFQHOTVYLOIGJX-UHFFFAOYSA-N 2 0 242.407 2.262 20 0 BEADRP C[C@@H]([NH2+]CC1CC(C)C1)[C@H]1CCCC[NH2+]1 ZINC000622044868 370674282 /nfs/dbraw/zinc/67/42/82/370674282.db2.gz WGGDSEXHQAMGHZ-POOIEITISA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]CC[C@@H]1CC1(F)F ZINC000622043654 370674654 /nfs/dbraw/zinc/67/46/54/370674654.db2.gz HBERAUSNUKQYJT-GMTAPVOTSA-N 2 0 232.318 2.009 20 0 BEADRP CC1CC(C[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)C1 ZINC000622044317 370675576 /nfs/dbraw/zinc/67/55/76/370675576.db2.gz ARFJHSQZHCHSGC-YTPFDHIKSA-N 2 0 222.376 2.010 20 0 BEADRP CC[C@@H]([NH2+]CC[C@H]1CC1(F)F)[C@@H]1CCC[NH2+]1 ZINC000622044108 370675609 /nfs/dbraw/zinc/67/56/09/370675609.db2.gz VINMLNFUTVYFHD-AXFHLTTASA-N 2 0 232.318 2.152 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]CC[C@H]1CC1(F)F ZINC000622043738 370675651 /nfs/dbraw/zinc/67/56/51/370675651.db2.gz JSPIXLODUCLWOU-AXFHLTTASA-N 2 0 232.318 2.281 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CC[C@@H]1CC1(F)F ZINC000622043889 370675801 /nfs/dbraw/zinc/67/58/01/370675801.db2.gz OVEDPSYIISRFBJ-VHSXEESVSA-N 2 0 220.307 2.139 20 0 BEADRP CC[C@H](Cc1cccs1)[NH2+]CC[C@H](C)[NH3+] ZINC000622045618 370679513 /nfs/dbraw/zinc/67/95/13/370679513.db2.gz GMOWCNZCXVSJSM-WDEREUQCSA-N 2 0 226.389 2.396 20 0 BEADRP CC1(C)C[C@H]1[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000309819572 491157227 /nfs/dbraw/zinc/15/72/27/491157227.db2.gz WAGPCRMWGUPDGY-CYBMUJFWSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]C[C@]1(C)C[C@H]2C[C@H]2C1 ZINC000629539164 361404595 /nfs/dbraw/zinc/40/45/95/361404595.db2.gz QVUYOWHLRHKYAU-UXXRCYHCSA-N 2 0 236.403 2.400 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@H]1c1ccco1)[C@@H]1CCC[NH2+]C1 ZINC000579342030 366761848 /nfs/dbraw/zinc/76/18/48/366761848.db2.gz MXSYJWHIWASPGS-UMSGYPCISA-N 2 0 234.343 2.113 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[C@H]1c1ccco1)[C@@H]1CCC[NH2+]C1 ZINC000579342029 366761983 /nfs/dbraw/zinc/76/19/83/366761983.db2.gz MXSYJWHIWASPGS-FDYHWXHSSA-N 2 0 234.343 2.113 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]C[C@]1(C)C[C@H]2C[C@H]2C1 ZINC000629537699 361401521 /nfs/dbraw/zinc/40/15/21/361401521.db2.gz LKRPSDSCAAWKGZ-NWBUJAPZSA-N 2 0 210.365 2.138 20 0 BEADRP CCC[C@@H](C)CCC[N@@H+]1CCCO[C@H](C[NH3+])C1 ZINC000629535738 361410153 /nfs/dbraw/zinc/41/01/53/361410153.db2.gz DPVNBTPXQRBXDG-ZIAGYGMSSA-N 2 0 242.407 2.252 20 0 BEADRP C[C@]1(C[NH2+][C@@H]2CCC[C@@H]2C[NH3+])C[C@H]2C[C@H]2C1 ZINC000629539850 361412902 /nfs/dbraw/zinc/41/29/02/361412902.db2.gz RTAADEQEMGBWCC-RGDJUOJXSA-N 2 0 222.376 2.140 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+][C@H]1CCC12CCCC2 ZINC000629544956 361424691 /nfs/dbraw/zinc/42/46/91/361424691.db2.gz OKEXYPBWEBTXHM-TUAOUCFPSA-N 2 0 208.349 2.049 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+][C@@H]1C[C@H](C)CC[C@H]1C ZINC000629546809 361428962 /nfs/dbraw/zinc/42/89/62/361428962.db2.gz QBMTXZAWZOOYET-UJPOAAIJSA-N 2 0 210.365 2.151 20 0 BEADRP CC(C)=CCC[C@@H](C)[NH2+][C@@H]1CC[NH2+][C@H]1C ZINC000629549016 361435750 /nfs/dbraw/zinc/43/57/50/361435750.db2.gz UJQNYZFWILOUOC-FRRDWIJNSA-N 2 0 210.365 2.461 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]C[C@H]1CCCC12CC2 ZINC000629555065 361435928 /nfs/dbraw/zinc/43/59/28/361435928.db2.gz QUFKRCRIJKRNOK-QJPTWQEYSA-N 2 0 210.365 2.282 20 0 BEADRP CC[C@@H]1CC[C@@H](C)C[C@H]1[NH2+][C@@H]1CC[NH2+]C1 ZINC000629553178 361437731 /nfs/dbraw/zinc/43/77/31/361437731.db2.gz LVEJYLCQJPMURG-FDYHWXHSSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@@H]1C[C@@H](C)CC[C@@H]1[NH2+][C@@H]1CC[NH2+]C1 ZINC000629553318 361439003 /nfs/dbraw/zinc/43/90/03/361439003.db2.gz JCLYVLMQJXVSEH-LOWDOPEQSA-N 2 0 210.365 2.153 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]C[C@H]2CCCC23CC3)C1 ZINC000629554431 361440131 /nfs/dbraw/zinc/44/01/31/361440131.db2.gz ITRBPWJYTSOFRO-JHJVBQTASA-N 2 0 222.376 2.426 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]C[C@@H]2CCCC23CC3)C1 ZINC000629554434 361440155 /nfs/dbraw/zinc/44/01/55/361440155.db2.gz ITRBPWJYTSOFRO-XQQFMLRXSA-N 2 0 222.376 2.426 20 0 BEADRP FC1(F)C[C@H]2CC[C@@H](C1)[N@H+]2CC[C@H]1CC[NH2+]C1 ZINC000629551422 361444044 /nfs/dbraw/zinc/44/40/44/361444044.db2.gz VMGODAFTHBRWHO-UTUOFQBUSA-N 2 0 244.329 2.248 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CCC[C@@H](C)[C@H]1CCC[NH3+] ZINC000629544038 361417588 /nfs/dbraw/zinc/41/75/88/361417588.db2.gz DAQVGCIEWFGFJB-AAVRWANBSA-N 2 0 224.392 2.482 20 0 BEADRP C[C@@H]1C[C@H]1C[N@@H+]1CCC[C@@H](C)[C@H]1CCC[NH3+] ZINC000629544040 361418150 /nfs/dbraw/zinc/41/81/50/361418150.db2.gz DAQVGCIEWFGFJB-YIYPIFLZSA-N 2 0 224.392 2.482 20 0 BEADRP C(C[NH+](C1CC1)C1CC1)[C@@H]1CCC[NH2+]C1 ZINC000629567393 361458510 /nfs/dbraw/zinc/45/85/10/361458510.db2.gz KXJTVRKWAZPQMH-NSHDSACASA-N 2 0 208.349 2.003 20 0 BEADRP C[N@H+](CCOCC[NH3+])C[C@@H]1CCCCC1(C)C ZINC000629581274 361470889 /nfs/dbraw/zinc/47/08/89/361470889.db2.gz UKZAQYHJFURDFN-ZDUSSCGKSA-N 2 0 242.407 2.110 20 0 BEADRP CCC(CC)C[N@@H+]1C[C@@]2(C)C[NH2+]C[C@@]2(C)C1 ZINC000629595834 361484007 /nfs/dbraw/zinc/48/40/07/361484007.db2.gz REBBXVKSVWCSQG-OKILXGFUSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@]12C[NH2+]C[C@@]1(C)C[N@H+](C[C@@H]1CC[C@H]3C[C@H]3C1)C2 ZINC000629593125 361485101 /nfs/dbraw/zinc/48/51/01/361485101.db2.gz DQLZPGVYVNHDNQ-JKJDWNRSSA-N 2 0 248.414 2.354 20 0 BEADRP CCN(CC[NH3+])Cc1cccc(OC(F)F)c1 ZINC000629557398 361454855 /nfs/dbraw/zinc/45/48/55/361454855.db2.gz KZVIDHGDPNNTHY-UHFFFAOYSA-N 2 0 244.285 2.069 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H]2CC[C@H]2C(C)C)C1 ZINC000309966774 491158589 /nfs/dbraw/zinc/15/85/89/491158589.db2.gz NVEILGGYULBHNL-RDBSUJKOSA-N 2 0 224.392 2.352 20 0 BEADRP CC(C)C[C@H]([NH3+])C[NH2+]C[C@H](C)c1ccncc1 ZINC000629656142 361561402 /nfs/dbraw/zinc/56/14/02/361561402.db2.gz OBCYOXTVMCFQCZ-JSGCOSHPSA-N 2 0 235.375 2.148 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CC1=Cc2ccccc2OC1 ZINC000629649756 361546329 /nfs/dbraw/zinc/54/63/29/361546329.db2.gz FWTLRGPOHTYNRJ-VXGBXAGGSA-N 2 0 246.354 2.178 20 0 BEADRP C[C@@H](Cc1ccccc1)C[N@@H+]1CC[C@@H](C[NH3+])C1 ZINC000435378810 201264654 /nfs/dbraw/zinc/26/46/54/201264654.db2.gz KAPBGEUSQXXVEV-ZFWWWQNUSA-N 2 0 232.371 2.146 20 0 BEADRP CC[N@H+](Cc1cccc(O)c1)[C@H]1CCC[NH2+]CC1 ZINC000435391528 201268554 /nfs/dbraw/zinc/26/85/54/201268554.db2.gz STYMBTUXGZBJPL-AWEZNQCLSA-N 2 0 248.370 2.356 20 0 BEADRP C[C@H](Cc1ccccc1)C[NH+]1CCC([NH3+])CC1 ZINC000435398007 201269331 /nfs/dbraw/zinc/26/93/31/201269331.db2.gz LYGBNGNJQJDUGP-CYBMUJFWSA-N 2 0 232.371 2.288 20 0 BEADRP c1cc([C@@H]2CCC[NH2+]2)ccc1C1=CC[NH2+]CC1 ZINC000629723520 361664733 /nfs/dbraw/zinc/66/47/33/361664733.db2.gz NYWWRVKXMKMLQB-HNNXBMFYSA-N 2 0 228.339 2.488 20 0 BEADRP C[C@@H]([NH3+])c1ccc(C2=CC[NH2+]CC2)cc1 ZINC000629723963 361665813 /nfs/dbraw/zinc/66/58/13/361665813.db2.gz VBXOFWPSHCZRGR-SNVBAGLBSA-N 2 0 202.301 2.083 20 0 BEADRP Cc1cc2c(c(C3=CC[NH2+]CC3)c1)CC[NH2+]C2 ZINC000629723850 361666171 /nfs/dbraw/zinc/66/61/71/361666171.db2.gz SAXCPKBDWASLSE-UHFFFAOYSA-N 2 0 228.339 2.017 20 0 BEADRP CCCCOCC[N@H+](CC)[C@H]1CCC[NH2+]CC1 ZINC000435629572 201279396 /nfs/dbraw/zinc/27/93/96/201279396.db2.gz ULFPIWCRDUTBRZ-AWEZNQCLSA-N 2 0 242.407 2.267 20 0 BEADRP CC[N@H+](CCC[NH2+]C)CCc1ccccc1 ZINC000435876248 201291392 /nfs/dbraw/zinc/29/13/92/201291392.db2.gz HPSQFIRZBNGAJQ-UHFFFAOYSA-N 2 0 220.360 2.161 20 0 BEADRP [NH3+][C@H]1CSCc2ccc(C3=CC[NH2+]CC3)cc21 ZINC000629722882 361663848 /nfs/dbraw/zinc/66/38/48/361663848.db2.gz GKAZXVYLYCJGQM-AWEZNQCLSA-N 2 0 246.379 2.310 20 0 BEADRP C[NH2+]CCC[N@@H+]1CC[C@@H](c2ccccc2)[C@H]1C ZINC000435879358 201292774 /nfs/dbraw/zinc/29/27/74/201292774.db2.gz JPFYYYCEZVFKEA-UKRRQHHQSA-N 2 0 232.371 2.474 20 0 BEADRP C[NH2+]CCC[NH+]1CCC(c2ccc(O)cc2)CC1 ZINC000435872082 201293736 /nfs/dbraw/zinc/29/37/36/201293736.db2.gz MSDRXRISJXHTFA-UHFFFAOYSA-N 2 0 248.370 2.181 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCC[C@H]1c1cccc(OC)c1 ZINC000435872705 201294204 /nfs/dbraw/zinc/29/42/04/201294204.db2.gz QCHQMIOIWIQONU-HNNXBMFYSA-N 2 0 248.370 2.442 20 0 BEADRP C[NH2+]CCC[N@H+](C[C@@H]1CCCO1)C1CCCC1 ZINC000435881569 201295191 /nfs/dbraw/zinc/29/51/91/201295191.db2.gz VMTOSGCLSAVZDG-AWEZNQCLSA-N 2 0 240.391 2.020 20 0 BEADRP CCCC[C@@H](COC)[NH2+]C1CCC([NH3+])CC1 ZINC000437759395 201372836 /nfs/dbraw/zinc/37/28/36/201372836.db2.gz DFVMGCLXOGBBOI-BPCQOVAHSA-N 2 0 228.380 2.051 20 0 BEADRP [NH3+]CC1CC[NH+](C2CCCCCC2)CC1 ZINC000044511916 181365594 /nfs/dbraw/zinc/36/55/94/181365594.db2.gz ICMRXEJCOBDORP-UHFFFAOYSA-N 2 0 210.365 2.380 20 0 BEADRP COC1CCC(C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)CC1 ZINC000573696562 364889987 /nfs/dbraw/zinc/88/99/87/364889987.db2.gz JVQFQZAPCNVPAG-YIFLHPOLSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H](CCc1ccco1)[NH2+]CC1([NH3+])CCC1 ZINC000573675800 364885470 /nfs/dbraw/zinc/88/54/70/364885470.db2.gz LLDXWFNGROPIDF-NSHDSACASA-N 2 0 222.332 2.072 20 0 BEADRP CCC[N@H+](C)C[C@@H]1CC[NH+]([C@H](C)CCOC)C1 ZINC000446785324 541391335 /nfs/dbraw/zinc/39/13/35/541391335.db2.gz KYWFGCUGDAUKAW-KGLIPLIRSA-N 2 0 242.407 2.075 20 0 BEADRP CC[N@H+](C)C[C@H]1CCN(c2cc[nH+]cc2C)C1 ZINC000191981489 365005138 /nfs/dbraw/zinc/00/51/38/365005138.db2.gz SLQYGZNTRGAEBB-CYBMUJFWSA-N 2 0 233.359 2.168 20 0 BEADRP [NH3+]CCCN1CCc2c(Cl)cccc2C1 ZINC000082790931 181381189 /nfs/dbraw/zinc/38/11/89/181381189.db2.gz SRUBOEBXLNHUIV-UHFFFAOYSA-N 2 0 224.735 2.047 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1CCC12CCOCC2 ZINC000574392333 365051373 /nfs/dbraw/zinc/05/13/73/365051373.db2.gz OZBKNFLIMQXBFR-CHWSQXEVSA-N 2 0 240.391 2.053 20 0 BEADRP [NH3+]CCC[NH2+][C@H]1CCCCC12CCCC2 ZINC000336683197 181383720 /nfs/dbraw/zinc/38/37/20/181383720.db2.gz JPBHIDFZUHKVIP-LBPRGKRZSA-N 2 0 210.365 2.428 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H]2CCCC[C@@H]2C[NH3+])o1 ZINC000574563068 365087943 /nfs/dbraw/zinc/08/79/43/365087943.db2.gz NKRNUTSKEKENPO-TZMCWYRMSA-N 2 0 236.359 2.238 20 0 BEADRP CC(C)[NH2+]CCC(=O)Nc1ccc([C@@H](C)[NH3+])cc1 ZINC000574548552 365088093 /nfs/dbraw/zinc/08/80/93/365088093.db2.gz IOCJEOJRLPHYIZ-LLVKDONJSA-N 2 0 249.358 2.033 20 0 BEADRP NCC[NH2+][C@H]1CCCC[C@H]1c1ccccc1 ZINC000037712963 181397991 /nfs/dbraw/zinc/39/79/91/181397991.db2.gz WSIHFHHYIQOIDR-KBPBESRZSA-N 2 0 218.344 2.261 20 0 BEADRP C[C@@H]1CCCC[C@H]1C[N@@H+]1C[C@@H]2CCC[NH2+][C@@H]2C1 ZINC000574793026 365146309 /nfs/dbraw/zinc/14/63/09/365146309.db2.gz AJRHWVIPXWLCCF-CBBWQLFWSA-N 2 0 236.403 2.497 20 0 BEADRP Cc1ccc2[nH+]ccc(NC[C@@H](C)[NH+](C)C)c2c1 ZINC000443429273 193021248 /nfs/dbraw/zinc/02/12/48/193021248.db2.gz KRZHWKBLGYIBNJ-GFCCVEGCSA-N 2 0 243.354 2.327 20 0 BEADRP C[NH+](C)CCC[NH2+]Cc1ccc2c(c1)CCC2 ZINC000057521251 1172332331 /nfs/dbraw/zinc/33/23/31/1172332331.db2.gz LPFATBIJZYSNRA-UHFFFAOYSA-N 2 0 232.371 2.217 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@H]2CCCC(F)(F)C2)C1 ZINC000579614120 366909722 /nfs/dbraw/zinc/90/97/22/366909722.db2.gz RFPCPZNXOGYQBL-VWYCJHECSA-N 2 0 232.318 2.424 20 0 BEADRP C[N@@H+](C/C=C\c1ccc(F)cc1F)CCC[NH3+] ZINC000579711715 366979460 /nfs/dbraw/zinc/97/94/60/366979460.db2.gz GGHVXACHMBSYGF-RQOWECAXSA-N 2 0 240.297 2.259 20 0 BEADRP Cc1cncc([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](C)C2)c1 ZINC000184351260 367073298 /nfs/dbraw/zinc/07/32/98/367073298.db2.gz MGLHAOBNPGEYOL-ZIAGYGMSSA-N 2 0 247.386 2.382 20 0 BEADRP CC1(C[N@@H+]2CCC[C@@H]([C@H]3CC[NH2+]C3)C2)CC1 ZINC000579958582 367103636 /nfs/dbraw/zinc/10/36/36/367103636.db2.gz KMBWOKDXWBCQMK-QWHCGFSZSA-N 2 0 222.376 2.108 20 0 BEADRP C[C@H](Cc1ccsc1)[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000581178725 367284302 /nfs/dbraw/zinc/28/43/02/367284302.db2.gz IXUWFUQMPMRMML-VXGBXAGGSA-N 2 0 238.400 2.268 20 0 BEADRP C[C@@H](Cc1ccsc1)[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000581178724 367284317 /nfs/dbraw/zinc/28/43/17/367284317.db2.gz IXUWFUQMPMRMML-RYUDHWBXSA-N 2 0 238.400 2.268 20 0 BEADRP C[C@@H]1[C@@H](C)CC[N@@H+]1C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000380669952 367276497 /nfs/dbraw/zinc/27/64/97/367276497.db2.gz KXHAGPLNWSLCBW-UMSGYPCISA-N 2 0 210.365 2.105 20 0 BEADRP CCO[C@@H]1CCCC[C@H]1[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000581022555 367240144 /nfs/dbraw/zinc/24/01/44/367240144.db2.gz ZEMPGNOYTWMARP-AAVRWANBSA-N 2 0 240.391 2.194 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H](C)C(C)(C)CC ZINC000581185086 367285653 /nfs/dbraw/zinc/28/56/53/367285653.db2.gz LFFJESZIHLECOP-NSHDSACASA-N 2 0 200.370 2.400 20 0 BEADRP C[C@@H](C[NH2+]CC1(C)CC1)C[NH+]1CCCCC1 ZINC000381332297 367383366 /nfs/dbraw/zinc/38/33/66/367383366.db2.gz UHFJIRPHGFBZPC-ZDUSSCGKSA-N 2 0 224.392 2.498 20 0 BEADRP CC[C@@H]1CCC[C@H]1[NH2+]CC1=CC[N@H+](C)CC1 ZINC000381358013 367388075 /nfs/dbraw/zinc/38/80/75/367388075.db2.gz DTBPOCUVBJMZJG-ZIAGYGMSSA-N 2 0 222.376 2.417 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]C[C@H]1CCCC1(F)F ZINC000381833841 367461200 /nfs/dbraw/zinc/46/12/00/367461200.db2.gz GLFNUFFZEGEUEW-UTUOFQBUSA-N 2 0 246.345 2.352 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]C[C@@H]1CCCC1(F)F ZINC000381833234 367461225 /nfs/dbraw/zinc/46/12/25/367461225.db2.gz GLFNUFFZEGEUEW-GRYCIOLGSA-N 2 0 246.345 2.352 20 0 BEADRP CC[C@H]1CCC[C@H]1[NH2+]CCC[NH2+]C1CC1 ZINC000382526915 367533401 /nfs/dbraw/zinc/53/34/01/367533401.db2.gz BOXMJLABJLPPDS-WCQYABFASA-N 2 0 210.365 2.297 20 0 BEADRP CC(C)[C@H]([NH2+]CCC[NH2+]C1CC1)C1CC1 ZINC000382548865 367537230 /nfs/dbraw/zinc/53/72/30/367537230.db2.gz RPABIPHTZZBTEM-ZDUSSCGKSA-N 2 0 210.365 2.153 20 0 BEADRP COc1ccc([C@@H](C)[NH2+]CCC[NH2+]C2CC2)cc1 ZINC000382558704 367540154 /nfs/dbraw/zinc/54/01/54/367540154.db2.gz ONSYQTQKFVRQHJ-GFCCVEGCSA-N 2 0 248.370 2.488 20 0 BEADRP C[C@H]1CCC[C@H]([NH2+]CCC[NH2+]C2CC2)C1 ZINC000382604784 367548499 /nfs/dbraw/zinc/54/84/99/367548499.db2.gz VRIYZMDTRDOFGO-AAEUAGOBSA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@H]([NH2+]C1CC[NH2+]CC1)C1CCCC1 ZINC000382784986 367555930 /nfs/dbraw/zinc/55/59/30/367555930.db2.gz JVVPUYKJTVIBEC-ZDUSSCGKSA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCCNC1)C1CCCC1 ZINC000382789849 367557578 /nfs/dbraw/zinc/55/75/78/367557578.db2.gz OJCXLXBSJPKAGI-OLZOCXBDSA-N 2 0 210.365 2.297 20 0 BEADRP CC(C)OCCC[N@H+](C)CC[C@H]([NH3+])C(C)C ZINC000382801174 367559360 /nfs/dbraw/zinc/55/93/60/367559360.db2.gz KMKNUFGOAPBHKU-ZDUSSCGKSA-N 2 0 230.396 2.107 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]CC1CC(F)(F)C1 ZINC000383149440 367601011 /nfs/dbraw/zinc/60/10/11/367601011.db2.gz ODGSBXOOELDCEW-CKYFFXLPSA-N 2 0 246.345 2.350 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]CC1CC(F)(F)C1 ZINC000383199940 367605934 /nfs/dbraw/zinc/60/59/34/367605934.db2.gz YVAOEPOSPBAXHI-QWRGUYRKSA-N 2 0 232.318 2.139 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]CC2CC(F)(F)C2)CC1 ZINC000383119082 367597453 /nfs/dbraw/zinc/59/74/53/367597453.db2.gz JACCROTYDUITOU-UHFFFAOYSA-N 2 0 246.345 2.494 20 0 BEADRP CC[C@H]1[C@@H](C)CCN1CC[NH2+]C(C)(C)C ZINC000384009028 367667755 /nfs/dbraw/zinc/66/77/55/367667755.db2.gz KAGFZARRBRTRCG-RYUDHWBXSA-N 2 0 212.381 2.495 20 0 BEADRP CC[C@@H]1[C@H](C)CC[N@@H+]1CC[C@H]1CC[NH2+]C1 ZINC000384106596 367672281 /nfs/dbraw/zinc/67/22/81/367672281.db2.gz DRPMDANYDMCDFE-JHJVBQTASA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]C[C@@H]1CCCSC1 ZINC000384175987 367674301 /nfs/dbraw/zinc/67/43/01/367674301.db2.gz VNMJSDOKGNSFRH-RYUDHWBXSA-N 2 0 230.421 2.237 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCc2ccccc2C1 ZINC000227084604 181431979 /nfs/dbraw/zinc/43/19/79/181431979.db2.gz DUKTYZWRNQUQGG-XHSDSOJGSA-N 2 0 244.382 2.261 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+][C@@H]1CCOc2ccccc21 ZINC000227122371 181433177 /nfs/dbraw/zinc/43/31/77/181433177.db2.gz AWKWSYYSTOMYNW-IACUBPJLSA-N 2 0 246.354 2.227 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@H]2C[C@@H](C)O[C@H]2C)CC1 ZINC000384971930 367767971 /nfs/dbraw/zinc/76/79/71/367767971.db2.gz TWDUZEPHNBJHFC-DYEKYZERSA-N 2 0 240.391 2.015 20 0 BEADRP C[NH2+]CCC1CC[NH+](Cc2ccncc2C)CC1 ZINC000385053323 367780116 /nfs/dbraw/zinc/78/01/16/367780116.db2.gz RJKYCOLYBNMSRS-UHFFFAOYSA-N 2 0 247.386 2.212 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H]1CCC[C@@H]1C(C)C ZINC000581878550 367866177 /nfs/dbraw/zinc/86/61/77/367866177.db2.gz NYDVNYWJTDLHKD-OLZOCXBDSA-N 2 0 212.381 2.400 20 0 BEADRP CN(Cc1ccc(F)c(F)c1)C1(C[NH3+])CCC1 ZINC000385290144 367817964 /nfs/dbraw/zinc/81/79/64/367817964.db2.gz IDECZBVHCRZHFY-UHFFFAOYSA-N 2 0 240.297 2.278 20 0 BEADRP CSCC1CCC([NH2+]C[C@@H]2CCC[NH2+]2)CC1 ZINC000385353617 367822109 /nfs/dbraw/zinc/82/21/09/367822109.db2.gz FYDUWFLMHRRKQF-BPCQOVAHSA-N 2 0 242.432 2.250 20 0 BEADRP C[C@@H]1CCC[C@H](C[N@@H+]2CC[C@@H]3C[NH2+]C[C@@H]32)C1 ZINC000385373270 367823531 /nfs/dbraw/zinc/82/35/31/367823531.db2.gz LNRKSYFCUZJARV-RQJABVFESA-N 2 0 222.376 2.106 20 0 BEADRP C[C@@H]1C[C@@H](C[N@@H+]2CCSCC[C@@H]2C)CC[NH2+]1 ZINC000385411260 367826633 /nfs/dbraw/zinc/82/66/33/367826633.db2.gz UVBSIKWXLRAHRU-AGIUHOORSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@H](CCN1CC[C@@H]2C[NH2+]C[C@@H]21)c1ccccc1 ZINC000385409971 367826719 /nfs/dbraw/zinc/82/67/19/367826719.db2.gz YTYPXBYWUQUZCC-BMFZPTHFSA-N 2 0 244.382 2.474 20 0 BEADRP C[C@H](CN1CC[C@@H]2C[NH2+]C[C@@H]21)c1ccccc1 ZINC000385410145 367826788 /nfs/dbraw/zinc/82/67/88/367826788.db2.gz YUYBDAMMQFDELY-YUELXQCFSA-N 2 0 230.355 2.084 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CC1(C)C)[C@@H]1CCCC[NH2+]1 ZINC000386100087 367910860 /nfs/dbraw/zinc/91/08/60/367910860.db2.gz JQHZTZLVKPOQFY-SRVKXCTJSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[C@@H](C)C1)[C@H]1CCCC[NH2+]1 ZINC000386103616 367913029 /nfs/dbraw/zinc/91/30/29/367913029.db2.gz KFOXVTHZSOXRRX-FVCCEPFGSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CCCCO1)[C@@H]1CCCC[NH2+]1 ZINC000385958787 367890243 /nfs/dbraw/zinc/89/02/43/367890243.db2.gz DZGDQUWOSNSQHS-IHRRRGAJSA-N 2 0 240.391 2.066 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CC=CCC1)[C@@H]1CCCC[NH2+]1 ZINC000386013677 367897332 /nfs/dbraw/zinc/89/73/32/367897332.db2.gz NDNOJVJOBZDDPZ-IHRRRGAJSA-N 2 0 222.376 2.463 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CC=CCC1)[C@@H]1CCCC[NH2+]1 ZINC000386013680 367897858 /nfs/dbraw/zinc/89/78/58/367897858.db2.gz NDNOJVJOBZDDPZ-MJBXVCDLSA-N 2 0 222.376 2.463 20 0 BEADRP C[C@H]([NH2+]CC1CCSCC1)[C@H]1CCCC[NH2+]1 ZINC000386567244 367993607 /nfs/dbraw/zinc/99/36/07/367993607.db2.gz KNPUPANPQBIODX-WCQYABFASA-N 2 0 242.432 2.250 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]Cc2ccc(C[NH3+])cc2)[C@@H]1C ZINC000386310583 367948147 /nfs/dbraw/zinc/94/81/47/367948147.db2.gz WUBYWVCJZGWWMD-GYSYKLTISA-N 2 0 218.344 2.279 20 0 BEADRP CCCCOCCC[NH2+][C@H](C)[C@H]1CCCC[NH2+]1 ZINC000386367314 367956691 /nfs/dbraw/zinc/95/66/91/367956691.db2.gz AUKLDDMUSMSKOF-ZIAGYGMSSA-N 2 0 242.407 2.313 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+][C@H]1CC12CCCC2 ZINC000387155271 368072123 /nfs/dbraw/zinc/07/21/23/368072123.db2.gz QAVXEBPTMQLYIX-TUAOUCFPSA-N 2 0 208.349 2.036 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@@H]2CCC(F)(F)C2)CC1 ZINC000387443071 368194645 /nfs/dbraw/zinc/19/46/45/368194645.db2.gz SMSJUSBBZIHKQX-LLVKDONJSA-N 2 0 246.345 2.496 20 0 BEADRP C[NH+](C)CCCC(C)(C)[NH2+]Cc1cncs1 ZINC000387319867 368153193 /nfs/dbraw/zinc/15/31/93/368153193.db2.gz MPRDOMCNDAIVDS-UHFFFAOYSA-N 2 0 241.404 2.353 20 0 BEADRP [NH3+]CCC[N@H+](CC1CCCCC1)C1CC1 ZINC000036732056 368268023 /nfs/dbraw/zinc/26/80/23/368268023.db2.gz LOLVEVOLHBFIPH-UHFFFAOYSA-N 2 0 210.365 2.380 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CCC[NH+](C)C)C[C@H]1C ZINC000101635006 368377390 /nfs/dbraw/zinc/37/73/90/368377390.db2.gz HZVHIPHFEIJXIH-JHJVBQTASA-N 2 0 212.381 2.352 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H](C)CCCC[NH3+])cn1 ZINC000566791106 326082838 /nfs/dbraw/zinc/08/28/38/326082838.db2.gz QSKDVWOVGHNKID-LBPRGKRZSA-N 2 0 235.375 2.040 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]CCc2ccccc2)C1 ZINC000086401888 368879683 /nfs/dbraw/zinc/87/96/83/368879683.db2.gz QISVAEBUPQPFHA-UONOGXRCSA-N 2 0 218.344 2.089 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]CCc2ccccc2)C1 ZINC000086401889 368880201 /nfs/dbraw/zinc/88/02/01/368880201.db2.gz QISVAEBUPQPFHA-KBPBESRZSA-N 2 0 218.344 2.089 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CC2CC[NH2+]CC2)C[C@@H]1C ZINC000086701331 368883812 /nfs/dbraw/zinc/88/38/12/368883812.db2.gz CISCQNBHAADBOS-DYEKYZERSA-N 2 0 224.392 2.400 20 0 BEADRP Cc1cscc1C[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000087309625 368891780 /nfs/dbraw/zinc/89/17/80/368891780.db2.gz IAONOMPNFUEJHQ-NEPJUHHUSA-N 2 0 224.373 2.416 20 0 BEADRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]CC(C1CC1)C1CC1 ZINC000084223076 368850992 /nfs/dbraw/zinc/85/09/92/368850992.db2.gz PXJDILBAPPDSFW-OCCSQVGLSA-N 2 0 222.376 2.140 20 0 BEADRP Cc1cc(C)c(C[NH+]2CCC(C[NH3+])CC2)c(C)n1 ZINC000631821501 368971583 /nfs/dbraw/zinc/97/15/83/368971583.db2.gz ZWUUZJPNWOUCBG-UHFFFAOYSA-N 2 0 247.386 2.178 20 0 BEADRP Cc1cc(C)c(C[N@@H+]2CC[C@@H]([NH3+])[C@@H](C)C2)c(C)n1 ZINC000631821614 368973158 /nfs/dbraw/zinc/97/31/58/368973158.db2.gz DGOPOYZBPSHHRH-XHDPSFHLSA-N 2 0 247.386 2.176 20 0 BEADRP C[N@@H+]1CCCC[C@@H](C[NH2+]C[C@H]2CCSC2)C1 ZINC000623657109 368998119 /nfs/dbraw/zinc/99/81/19/368998119.db2.gz JWUZLTPSELDXBW-QWHCGFSZSA-N 2 0 242.432 2.061 20 0 BEADRP CC(C)OC[C@H](C)[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000459647639 203327877 /nfs/dbraw/zinc/32/78/77/203327877.db2.gz AZROLXRKYKMHLW-LBPRGKRZSA-N 2 0 247.342 2.237 20 0 BEADRP Cc1ccccc1OCCCN1C[C@H]([NH3+])C[C@@H]1C ZINC000631858544 369442703 /nfs/dbraw/zinc/44/27/03/369442703.db2.gz AAOUMPGBFZSKHA-UONOGXRCSA-N 2 0 248.370 2.185 20 0 BEADRP C[N@@H+]1CCC[C@H](CC[NH2+]C2CCCC2)C1 ZINC000459738680 203349314 /nfs/dbraw/zinc/34/93/14/203349314.db2.gz SCQVSLFKVWWFHP-GFCCVEGCSA-N 2 0 210.365 2.251 20 0 BEADRP CCC[C@@H](C)[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC000459742363 203350839 /nfs/dbraw/zinc/35/08/39/203350839.db2.gz VVIVBYGCKLAKNH-OLZOCXBDSA-N 2 0 212.381 2.497 20 0 BEADRP CC1(C[NH+]2CCC([C@H]3CC[NH2+]C3)CC2)CC1 ZINC000567871169 326274167 /nfs/dbraw/zinc/27/41/67/326274167.db2.gz VANNKGZULQYRQV-ZDUSSCGKSA-N 2 0 222.376 2.108 20 0 BEADRP CC[NH+]1CCC(CC[NH2+][C@@H](C)C2CC2)CC1 ZINC000165384715 203384029 /nfs/dbraw/zinc/38/40/29/203384029.db2.gz FYPHNOGLXDIWMS-LBPRGKRZSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1ccncc1C[NH2+]CC[C@@H]1CCC[N@@H+](C)C1 ZINC000459787781 203369580 /nfs/dbraw/zinc/36/95/80/203369580.db2.gz PYZXKVVUTDDLQU-AWEZNQCLSA-N 2 0 247.386 2.212 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)C1CCC1 ZINC000459787787 203371334 /nfs/dbraw/zinc/37/13/34/203371334.db2.gz PZDWDJMEJQYKSN-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP CCSCC[N@@H+]1CCC[C@@H]([C@H]2CCC[NH2+]2)C1 ZINC000252719757 370119491 /nfs/dbraw/zinc/11/94/91/370119491.db2.gz IVAVKVLVWCGJDV-CHWSQXEVSA-N 2 0 242.432 2.204 20 0 BEADRP COc1cccc([C@H](C)[N@@H+]2CC[C@@H]([C@H](C)[NH3+])C2)c1 ZINC000252763351 370125344 /nfs/dbraw/zinc/12/53/44/370125344.db2.gz HLUMIFWZKIFFGL-SGMGOOAPSA-N 2 0 248.370 2.425 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+]CCN1CC[C@@H](C)C1 ZINC000309676203 370242287 /nfs/dbraw/zinc/24/22/87/370242287.db2.gz LUQCSETVUVWRKV-HZSPNIEDSA-N 2 0 224.392 2.352 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+]CCN1CC[C@@H](C)C1 ZINC000309676209 370242705 /nfs/dbraw/zinc/24/27/05/370242705.db2.gz LUQCSETVUVWRKV-RDBSUJKOSA-N 2 0 224.392 2.352 20 0 BEADRP CC(C)[C@H]1CC[C@H]1[NH2+]CCN1CC[C@@H](C)C1 ZINC000309676207 370242852 /nfs/dbraw/zinc/24/28/52/370242852.db2.gz LUQCSETVUVWRKV-MGPQQGTHSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000309803230 370263250 /nfs/dbraw/zinc/26/32/50/370263250.db2.gz RONQYCUXIYPODQ-RISCZKNCSA-N 2 0 222.376 2.249 20 0 BEADRP CC[NH2+]CC1CC[NH+](Cc2ccnc(C)c2)CC1 ZINC000621774117 370519636 /nfs/dbraw/zinc/51/96/36/370519636.db2.gz KZBAKRCMIOKVEM-UHFFFAOYSA-N 2 0 247.386 2.212 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CC[C@H]2CC2(F)F)CC[N@@H+]1C ZINC000621770571 370512510 /nfs/dbraw/zinc/51/25/10/370512510.db2.gz TWRSSIHORPTSIH-VWYCJHECSA-N 2 0 232.318 2.104 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CC[C@H]2CC2(F)F)[C@@H](C)C1 ZINC000621734731 370491746 /nfs/dbraw/zinc/49/17/46/370491746.db2.gz VBKKYYBHNVFCTK-SRVKXCTJSA-N 2 0 246.345 2.352 20 0 BEADRP CCC(CC)C[N@@H+]1C[C@@H]2CCC[C@@]2([NH3+])C1 ZINC000621784132 370536522 /nfs/dbraw/zinc/53/65/22/370536522.db2.gz KIIBIYMXVHTOAC-QWHCGFSZSA-N 2 0 210.365 2.236 20 0 BEADRP [NH3+][C@@]12CCC[C@@H]1C[N@H+](CCc1ccccc1)C2 ZINC000621779043 370528439 /nfs/dbraw/zinc/52/84/39/370528439.db2.gz YXGQNIDZNHJHRW-HUUCEWRRSA-N 2 0 230.355 2.042 20 0 BEADRP [NH3+][C@@]12CCC[C@H]1C[N@H+](CCc1ccccc1)C2 ZINC000621779044 370528984 /nfs/dbraw/zinc/52/89/84/370528984.db2.gz YXGQNIDZNHJHRW-LSDHHAIUSA-N 2 0 230.355 2.042 20 0 BEADRP Cc1ccc(CC[N@@H+]2C[C@@H]3CCC[C@@]3([NH3+])C2)cc1 ZINC000621782846 370532595 /nfs/dbraw/zinc/53/25/95/370532595.db2.gz TVGOQMRIPVEGAX-JKSUJKDBSA-N 2 0 244.382 2.351 20 0 BEADRP [NH3+][C@]12CCC[C@@H]1C[N@H+](CCCC1CCC1)C2 ZINC000621783466 370534437 /nfs/dbraw/zinc/53/44/37/370534437.db2.gz BXRYMNLCFPGMPP-KGLIPLIRSA-N 2 0 222.376 2.380 20 0 BEADRP CC[C@H](CC(F)F)C[N@@H+]1C[C@@H]2CCC[C@@]2([NH3+])C1 ZINC000621784433 370535452 /nfs/dbraw/zinc/53/54/52/370535452.db2.gz OVRSSUCOFLPBTB-NTZNESFSSA-N 2 0 246.345 2.481 20 0 BEADRP CCC(CC)C[N@@H+]1C[C@H]2CCC[C@@]2([NH3+])C1 ZINC000621784130 370535614 /nfs/dbraw/zinc/53/56/14/370535614.db2.gz KIIBIYMXVHTOAC-CHWSQXEVSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@H]([NH2+]CC(C)(C)C[NH+](C)C)[C@H]1CCCCO1 ZINC000623849203 371123604 /nfs/dbraw/zinc/12/36/04/371123604.db2.gz YWZXEZLSBUQCQM-QWHCGFSZSA-N 2 0 242.407 2.121 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@@H](C)[C@H]1CCCCO1 ZINC000623858809 371129224 /nfs/dbraw/zinc/12/92/24/371129224.db2.gz WOMFMHBBQFCXKY-UONOGXRCSA-N 2 0 242.407 2.264 20 0 BEADRP CCC[C@H](C)[NH2+]C[C@@H]1CCCC[N@H+](C)C1 ZINC000624120036 371320107 /nfs/dbraw/zinc/32/01/07/371320107.db2.gz QEFGPVZCTRNONB-STQMWFEESA-N 2 0 212.381 2.497 20 0 BEADRP COCCC[C@@H](C)[NH2+]C[C@H]1CCCC[N@H+](C)C1 ZINC000624120524 371321533 /nfs/dbraw/zinc/32/15/33/371321533.db2.gz BBUYNTLIEVKNJV-ZIAGYGMSSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)C1CCC1 ZINC000624121368 371323032 /nfs/dbraw/zinc/32/30/32/371323032.db2.gz UTCUETFJAMOVIR-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP C[N@@H+]1CCCC[C@@H](C[NH2+][C@H]2CCC[C@H]3C[C@H]32)C1 ZINC000624123895 371324948 /nfs/dbraw/zinc/32/49/48/371324948.db2.gz SNBGIOCXBXMITM-XQLPTFJDSA-N 2 0 236.403 2.497 20 0 BEADRP C1CN2CCCC[C@@H]2[C@@H]1[NH2+]C1CCSCC1 ZINC000217698596 371998533 /nfs/dbraw/zinc/99/85/33/371998533.db2.gz ZEYQMBAQXSVVBQ-CHWSQXEVSA-N 2 0 240.416 2.098 20 0 BEADRP CC1([NH3+])CC[NH+](C[C@@H]2CCC(F)(F)C2)CC1 ZINC000631824819 372590699 /nfs/dbraw/zinc/59/06/99/372590699.db2.gz RANYKAJEHFNMBJ-SNVBAGLBSA-N 2 0 232.318 2.235 20 0 BEADRP [NH3+][C@H]1CCCCC[N@H+](CCCCCF)C1 ZINC000631834594 372621266 /nfs/dbraw/zinc/62/12/66/372621266.db2.gz BDAGNCNJBUNECL-LBPRGKRZSA-N 2 0 216.344 2.330 20 0 BEADRP CCc1cccc(C[N@H+]2C[C@@H](C[NH3+])[C@H](C)C2)c1 ZINC000631837949 372628746 /nfs/dbraw/zinc/62/87/46/372628746.db2.gz HMWBIJGXNDHXGY-IUODEOHRSA-N 2 0 232.371 2.276 20 0 BEADRP Cc1cc(C[N@H+]2C[C@H](C)[C@H](C[NH3+])C2)c(C)s1 ZINC000631838400 372632035 /nfs/dbraw/zinc/63/20/35/372632035.db2.gz NPRBZFSBAVAZSQ-TVQRCGJNSA-N 2 0 238.400 2.392 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]1[NH2+]Cc1ccccc1 ZINC000038458034 372642701 /nfs/dbraw/zinc/64/27/01/372642701.db2.gz CLMPJOHICGFIQG-CYBMUJFWSA-N 2 0 218.344 2.164 20 0 BEADRP c1ccc(CC[N@@H+]2CCC[C@@H]3C[NH2+]CC[C@@H]32)cc1 ZINC000631887132 372681136 /nfs/dbraw/zinc/68/11/36/372681136.db2.gz OCGUHYSEZDXCRR-CVEARBPZSA-N 2 0 244.382 2.303 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@H](C)CCC(F)(F)F ZINC000414958595 205793554 /nfs/dbraw/zinc/79/35/54/205793554.db2.gz PDZFZUPRGNOKGO-RKDXNWHRSA-N 2 0 226.286 2.305 20 0 BEADRP CCC1(C[NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)CC1 ZINC000181242728 206010288 /nfs/dbraw/zinc/01/02/88/206010288.db2.gz VQNWVSZGRLDZCM-VXGBXAGGSA-N 2 0 210.365 2.249 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+][C@@H]1C[C@H]1C1CCC1 ZINC000424381318 206038234 /nfs/dbraw/zinc/03/82/34/206038234.db2.gz YJXAVLUQEQUKPS-ZOBORPQBSA-N 2 0 222.376 2.282 20 0 BEADRP COCC[C@H]1CCC[C@H]1[NH2+][C@@H]1CCCC[C@H]1[NH3+] ZINC000424378984 206039109 /nfs/dbraw/zinc/03/91/09/206039109.db2.gz UUFJQBUOTYYZPN-AAVRWANBSA-N 2 0 240.391 2.051 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+][C@H]2CC23CC3)c2ccccc21 ZINC000424378109 206040441 /nfs/dbraw/zinc/04/04/41/206040441.db2.gz SCQKFUVMMFOPEF-AGIUHOORSA-N 2 0 214.312 2.273 20 0 BEADRP CC(C)CCC[N@@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC000429035629 206060858 /nfs/dbraw/zinc/06/08/58/206060858.db2.gz NMMTVYBJHPGRNH-CQSZACIVSA-N 2 0 224.392 2.450 20 0 BEADRP CCC[N@H+](CC1CC1)C[C@H]1CCC[NH2+]C1 ZINC000042491163 169137933 /nfs/dbraw/zinc/13/79/33/169137933.db2.gz BRTHZIPZORWRHM-ZDUSSCGKSA-N 2 0 210.365 2.108 20 0 BEADRP CCC[N@H+](Cc1cccc(O)c1)C1CC[NH2+]CC1 ZINC000094681893 169176945 /nfs/dbraw/zinc/17/69/45/169176945.db2.gz GMPGBZNTCFPRAP-UHFFFAOYSA-N 2 0 248.370 2.356 20 0 BEADRP CCC[N@H+](CC[C@@H]1CCC[NH2+]C1)C1CC1 ZINC000051918959 169170159 /nfs/dbraw/zinc/17/01/59/169170159.db2.gz KBNJLVLPCHUVST-LBPRGKRZSA-N 2 0 210.365 2.251 20 0 BEADRP CCC[NH+]1CCC([N@H+](C)CCOC(C)C)CC1 ZINC000109788326 169186992 /nfs/dbraw/zinc/18/69/92/169186992.db2.gz BHZBISXGZKHIPB-UHFFFAOYSA-N 2 0 242.407 2.218 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H]2CCCSC2)CC1 ZINC000061572205 169189837 /nfs/dbraw/zinc/18/98/37/169189837.db2.gz CQFZTHJXLOCVTO-CYBMUJFWSA-N 2 0 242.432 2.346 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H]2CC[C@@H]2C)CC1 ZINC000336656192 169189880 /nfs/dbraw/zinc/18/98/80/169189880.db2.gz AHRFHMUPABEXLD-AAEUAGOBSA-N 2 0 210.365 2.249 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H]2CCOC2(C)C)CC1 ZINC000328192792 169190032 /nfs/dbraw/zinc/19/00/32/169190032.db2.gz AYEWHAPSURSAHC-ZDUSSCGKSA-N 2 0 240.391 2.018 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H]2CC[C@@H](F)C2)CC1 ZINC000336742730 169190313 /nfs/dbraw/zinc/19/03/13/169190313.db2.gz SHCXHPXTZVDVGW-YPMHNXCESA-N 2 0 228.355 2.341 20 0 BEADRP c1c[nH]c([C@@H]2CCC[N@H+]2CCCn2ccnc2)c1 ZINC000271791803 183326495 /nfs/dbraw/zinc/32/64/95/183326495.db2.gz JDWLWLIINNHWDF-AWEZNQCLSA-N 2 0 244.342 2.438 20 0 BEADRP c1c[nH]c([C@@H]2CCC[N@@H+](CCOC3CCC3)C2)n1 ZINC000376521857 183328134 /nfs/dbraw/zinc/32/81/34/183328134.db2.gz AELSZZUSJOHXTO-GFCCVEGCSA-N 2 0 249.358 2.158 20 0 BEADRP CCC[N@H+](Cc1ccncc1)C1CC[NH2+]CC1 ZINC000037538939 169178474 /nfs/dbraw/zinc/17/84/74/169178474.db2.gz CUAMDJUJTRGQIC-UHFFFAOYSA-N 2 0 233.359 2.046 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)COC(C)C)C1 ZINC000337339612 169206223 /nfs/dbraw/zinc/20/62/23/169206223.db2.gz OSUIRJSHLPWNBR-KBPBESRZSA-N 2 0 242.407 2.121 20 0 BEADRP c1cc(C[NH2+]CCCCC[NH+]2CCCC2)ccn1 ZINC000293026946 183350722 /nfs/dbraw/zinc/35/07/22/183350722.db2.gz PJJSESJCHKMMQP-UHFFFAOYSA-N 2 0 247.386 2.437 20 0 BEADRP c1cc([C@H]2CCC[N@H+]2CC2CC[NH2+]CC2)ccn1 ZINC000132295107 183363894 /nfs/dbraw/zinc/36/38/94/183363894.db2.gz UKBGIKFQLIMVDL-OAHLLOKOSA-N 2 0 245.370 2.218 20 0 BEADRP c1cc2c(o1)CCC[C@@H]2[NH2+]CCN1CCCC1 ZINC000123909148 183372348 /nfs/dbraw/zinc/37/23/48/183372348.db2.gz GMQDXVPINSBIDJ-ZDUSSCGKSA-N 2 0 234.343 2.342 20 0 BEADRP c1ccc(CC[N@@H+]2CCC3(C2)CC[NH2+]CC3)cc1 ZINC000082552054 183391832 /nfs/dbraw/zinc/39/18/32/183391832.db2.gz RUJUYKHETAAQAZ-UHFFFAOYSA-N 2 0 244.382 2.305 20 0 BEADRP CCCOc1cccc(C[N@@H+]2CC[C@@H](C[NH3+])C2)c1 ZINC000052921814 169324645 /nfs/dbraw/zinc/32/46/45/169324645.db2.gz JNSAWJJWYGSGPY-AWEZNQCLSA-N 2 0 248.370 2.256 20 0 BEADRP CCCOc1cccc(C[NH2+]CCC[NH2+]C)c1 ZINC000020967329 169324831 /nfs/dbraw/zinc/32/48/31/169324831.db2.gz SQVXEBWQJMQYJE-UHFFFAOYSA-N 2 0 236.359 2.175 20 0 BEADRP CCCN(CC)CC[NH2+]C[C@@H]1CCSC1 ZINC000226383911 134364842 /nfs/dbraw/zinc/36/48/42/134364842.db2.gz VXAHVVBULYXJSZ-LBPRGKRZSA-N 2 0 230.421 2.061 20 0 BEADRP C[NH2+]C1CC[NH+](C[C@@H]2CCC(F)(F)C2)CC1 ZINC000301019917 383826121 /nfs/dbraw/zinc/82/61/21/383826121.db2.gz ZPNWYTKICVNANW-SNVBAGLBSA-N 2 0 232.318 2.106 20 0 BEADRP [NH3+]CC[C@H]1CCCC[N@@H+]1Cc1ccsc1 ZINC000069720684 383845687 /nfs/dbraw/zinc/84/56/87/383845687.db2.gz PPTAZJQTVZHGOA-GFCCVEGCSA-N 2 0 224.373 2.451 20 0 BEADRP CC1(C)CCC[N@H+](C[C@H]2CCC[NH2+]C2)C1 ZINC000069793371 383846174 /nfs/dbraw/zinc/84/61/74/383846174.db2.gz JFSSCGNQBVCDDO-LBPRGKRZSA-N 2 0 210.365 2.108 20 0 BEADRP CCC(CC)[NH2+][C@H]1C[C@@H](C)N(C2CC2)C1 ZINC000131944366 383907500 /nfs/dbraw/zinc/90/75/00/383907500.db2.gz AQQCETSLQMXRSY-PWSUYJOCSA-N 2 0 210.365 2.390 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)o1 ZINC000401109887 383933228 /nfs/dbraw/zinc/93/32/28/383933228.db2.gz GXLWTLVBTGYFQI-YNEHKIRRSA-N 2 0 234.343 2.066 20 0 BEADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]CCC[C@H](C)O ZINC000227591088 134385380 /nfs/dbraw/zinc/38/53/80/134385380.db2.gz KIBVOUWEJBCZPR-RDBSUJKOSA-N 2 0 242.407 2.048 20 0 BEADRP Cc1cccc([C@H](C)N2CC[C@H]([NH3+])[C@@H]2C)c1 ZINC000309353117 383906599 /nfs/dbraw/zinc/90/65/99/383906599.db2.gz XVYKIEUIHBJLPE-OBJOEFQTSA-N 2 0 218.344 2.478 20 0 BEADRP C[C@H](Cc1cccs1)[NH2+][C@H]1CC[C@H](C[NH3+])C1 ZINC000643542625 383981449 /nfs/dbraw/zinc/98/14/49/383981449.db2.gz SKNPIDJQVFTGRZ-WOPDTQHZSA-N 2 0 238.400 2.396 20 0 BEADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@@H]2CCCc3cccnc32)C1 ZINC000643542768 383984225 /nfs/dbraw/zinc/98/42/25/383984225.db2.gz XJPFCUFVWYPJRA-MRVWCRGKSA-N 2 0 245.370 2.176 20 0 BEADRP Cc1ncc([C@H](C)[NH2+][C@@H]2CC[C@@H](C[NH3+])C2)s1 ZINC000643542730 383984264 /nfs/dbraw/zinc/98/42/64/383984264.db2.gz LKZMUSQWJIFFFQ-JMJZKYOTSA-N 2 0 239.388 2.230 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1ccncc1 ZINC000037649298 383991385 /nfs/dbraw/zinc/99/13/85/383991385.db2.gz AQNAYYQJCDGLJG-OLZOCXBDSA-N 2 0 245.370 2.217 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1ccncc1 ZINC000037649300 383991942 /nfs/dbraw/zinc/99/19/42/383991942.db2.gz AQNAYYQJCDGLJG-CHWSQXEVSA-N 2 0 245.370 2.217 20 0 BEADRP CC[N@H+](CCC[NH+]1CCCC1)C[C@@H](C)COC ZINC000569410644 384000943 /nfs/dbraw/zinc/00/09/43/384000943.db2.gz DSPGDWMGKZMNGC-CQSZACIVSA-N 2 0 242.407 2.077 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)C1CC1 ZINC000643546098 384016351 /nfs/dbraw/zinc/01/63/51/384016351.db2.gz IHIXTCBPLMOQKZ-PWSUYJOCSA-N 2 0 208.349 2.049 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)[C@H]1C[C@H]1C ZINC000643549014 384038389 /nfs/dbraw/zinc/03/83/89/384038389.db2.gz YYMQXTFLMZFURU-XQHKEYJVSA-N 2 0 222.376 2.295 20 0 BEADRP CCC[C@H](C[NH2+][C@H]1CC[N@H+](CC)C[C@H]1C)OC ZINC000449379259 384078349 /nfs/dbraw/zinc/07/83/49/384078349.db2.gz SIXIEUORTKRGRO-MCIONIFRSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H](C[NH2+]Cc1ccn(C)c1)C[NH+]1CCCCC1 ZINC000091008675 384091616 /nfs/dbraw/zinc/09/16/16/384091616.db2.gz DYBVIJKIALEOIV-AWEZNQCLSA-N 2 0 249.402 2.237 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H]1CC[C@H](C)C1 ZINC000070748369 384136601 /nfs/dbraw/zinc/13/66/01/384136601.db2.gz CIAKVSYCOLMDBW-QWHCGFSZSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@@H]2C[C@H]2C2CC2)CC[N@@H+]1C ZINC000309661083 384194765 /nfs/dbraw/zinc/19/47/65/384194765.db2.gz AWEVJURBBLLHBG-CABNGKKXSA-N 2 0 222.376 2.105 20 0 BEADRP [NH3+]CCCC[NH2+][C@H]1CCC[C@@H](C2CC2)C1 ZINC000081635532 384194778 /nfs/dbraw/zinc/19/47/78/384194778.db2.gz MECRISAHVXUBEQ-OLZOCXBDSA-N 2 0 210.365 2.284 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H]1CO[C@H](C)C1 ZINC000401899767 384242703 /nfs/dbraw/zinc/24/27/03/384242703.db2.gz CTNQPRMCOCABBF-MJBXVCDLSA-N 2 0 242.407 2.264 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1Cc2ccccc21)[C@H]1CCC[NH2+]1 ZINC000400444309 384277329 /nfs/dbraw/zinc/27/73/29/384277329.db2.gz PEOKZEDOZXISFR-CORIIIEPSA-N 2 0 230.355 2.056 20 0 BEADRP CC[C@H]1CCC[C@H]([NH2+]C2CC[NH2+]CC2)C1 ZINC000082847463 384270852 /nfs/dbraw/zinc/27/08/52/384270852.db2.gz QPHIHXAIXWEZPP-AAEUAGOBSA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@@H]([NH2+]C[C@H]1CC[N@H+](CC)C1)C1CC1 ZINC000083055495 384278282 /nfs/dbraw/zinc/27/82/82/384278282.db2.gz UFFBWFOMBNABCF-DGCLKSJQSA-N 2 0 210.365 2.106 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H]1CO[C@@H](C)C1 ZINC000401899765 384241767 /nfs/dbraw/zinc/24/17/67/384241767.db2.gz CTNQPRMCOCABBF-IHRRRGAJSA-N 2 0 242.407 2.264 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CCc2cn(C)cn2)C[C@@H]1C ZINC000313300214 384241866 /nfs/dbraw/zinc/24/18/66/384241866.db2.gz OGUGQJXXFQJMRP-FRRDWIJNSA-N 2 0 235.375 2.377 20 0 BEADRP CCC[C@H](C)[N@H+](C)C[C@H]1CC[NH2+][C@H](C)C1 ZINC000300055977 384283327 /nfs/dbraw/zinc/28/33/27/384283327.db2.gz LWNBUPILRFOOJA-AGIUHOORSA-N 2 0 212.381 2.495 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CCC[C@@H]2C)C1 ZINC000083390556 384295020 /nfs/dbraw/zinc/29/50/20/384295020.db2.gz JFCSKVSNNWQWRT-YNEHKIRRSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCC[N@@H+]2CCCC[C@@H]2C)CO1 ZINC000401975653 384354800 /nfs/dbraw/zinc/35/48/00/384354800.db2.gz TYHVZPFCXWSQAL-MJBXVCDLSA-N 2 0 240.391 2.018 20 0 BEADRP Cc1ccc(NC(=O)CC[C@H]2CC[NH2+]C2)c(C)n1 ZINC000134587323 384370222 /nfs/dbraw/zinc/37/02/22/384370222.db2.gz UDLKHUMWTQHNFQ-LBPRGKRZSA-N 2 0 247.342 2.027 20 0 BEADRP CCC[C@H](C)C[N@H+](C)[C@H]1CCC[NH2+]CC1 ZINC000300215117 384332288 /nfs/dbraw/zinc/33/22/88/384332288.db2.gz KPBLXDDUQMBHBY-STQMWFEESA-N 2 0 212.381 2.497 20 0 BEADRP CCN(C)CC[NH2+]C[C@H]1CCC[C@H](C)C1 ZINC000084342739 384392920 /nfs/dbraw/zinc/39/29/20/384392920.db2.gz OHKRTDLXXXAIOO-STQMWFEESA-N 2 0 212.381 2.354 20 0 BEADRP C[NH+](C)CCCC[NH2+]Cc1cc(F)ccc1F ZINC000045598276 384399370 /nfs/dbraw/zinc/39/93/70/384399370.db2.gz SCMGNLNFUHKMNZ-UHFFFAOYSA-N 2 0 242.313 2.396 20 0 BEADRP CC1(C)[C@H]([NH3+])C[C@@H]1[NH2+]C[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000405530098 384406003 /nfs/dbraw/zinc/40/60/03/384406003.db2.gz XWUMECYPDCPHCV-LBELIVKGSA-N 2 0 222.376 2.138 20 0 BEADRP Cc1ccc(F)cc1C[N@H+]1C[C@@H](C[NH3+])C[C@H]1C ZINC000229060385 384416012 /nfs/dbraw/zinc/41/60/12/384416012.db2.gz GPUHAFLUPPMMJQ-VXGBXAGGSA-N 2 0 236.334 2.303 20 0 BEADRP CCCC[C@@H](COC)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000158198979 384420569 /nfs/dbraw/zinc/42/05/69/384420569.db2.gz WWMVQRXHQORWGW-KGLIPLIRSA-N 2 0 242.407 2.123 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]C2Cc3ccccc3C2)C1 ZINC000236295603 384376843 /nfs/dbraw/zinc/37/68/43/384376843.db2.gz BLTQVEPPMJVNQZ-KGLIPLIRSA-N 2 0 230.355 2.013 20 0 BEADRP CC(C)C1([NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)CC1 ZINC000334195353 384388328 /nfs/dbraw/zinc/38/83/28/384388328.db2.gz KFACJIPGTSLVCL-STQMWFEESA-N 2 0 222.376 2.391 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]C2Cc3ccccc3C2)C1 ZINC000236327361 384388501 /nfs/dbraw/zinc/38/85/01/384388501.db2.gz BLTQVEPPMJVNQZ-UONOGXRCSA-N 2 0 230.355 2.013 20 0 BEADRP C[C@@]1(C[N@@H+]2CCC[C@H]2c2ccccn2)CC[NH2+]C1 ZINC000647513934 384428275 /nfs/dbraw/zinc/42/82/75/384428275.db2.gz VFSUKTQOSUAQAF-LSDHHAIUSA-N 2 0 245.370 2.218 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]1[NH2+]CCc1ccc2[nH]ccc2c1 ZINC000569330262 384470851 /nfs/dbraw/zinc/47/08/51/384470851.db2.gz DYVQYGRAFVHQJS-ZFWWWQNUSA-N 2 0 243.354 2.180 20 0 BEADRP C[C@@H]([NH2+]CCC[NH+]1CCCC1)C1(C)CC1 ZINC000037468216 384499876 /nfs/dbraw/zinc/49/98/76/384499876.db2.gz HNTLMJNTOPOOON-GFCCVEGCSA-N 2 0 210.365 2.251 20 0 BEADRP C[N@H+](CCC[NH+]1CCCC1)CC1CCC1 ZINC000161799097 384527315 /nfs/dbraw/zinc/52/73/15/384527315.db2.gz PFPGZLYJMLXIAL-UHFFFAOYSA-N 2 0 210.365 2.204 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@@H](C[NH+](C)C)C2)cc1 ZINC000172197685 384549147 /nfs/dbraw/zinc/54/91/47/384549147.db2.gz LGNCCCZDXBVFCK-HNNXBMFYSA-N 2 0 232.371 2.379 20 0 BEADRP CC[C@@H]1CCCC[C@H]1C[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC000401436753 384550255 /nfs/dbraw/zinc/55/02/55/384550255.db2.gz JZYDKHNXRJFDNF-BARDWOONSA-N 2 0 236.403 2.354 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+][C@@H]1CCN2CCCC[C@@H]12 ZINC000449082836 384555128 /nfs/dbraw/zinc/55/51/28/384555128.db2.gz QEQXDSBBTJBWJZ-YUELXQCFSA-N 2 0 248.370 2.427 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+]C2CCC(F)(F)CC2)C1 ZINC000647181546 384561261 /nfs/dbraw/zinc/56/12/61/384561261.db2.gz GOPHUMKFHGWHGN-LLVKDONJSA-N 2 0 246.345 2.496 20 0 BEADRP C[NH2+]C[C@@H]1CCC[N@H+](C[C@@H]2CCC(F)(F)C2)C1 ZINC000306049646 384570494 /nfs/dbraw/zinc/57/04/94/384570494.db2.gz VVGLVEWRQQBXLB-NEPJUHHUSA-N 2 0 246.345 2.353 20 0 BEADRP CC[C@](C)(C[NH2+]C[C@@H]1CC[N@@H+](C(C)C)C1)OC ZINC000319894246 384572668 /nfs/dbraw/zinc/57/26/68/384572668.db2.gz PJQSRSISNFXFPI-UONOGXRCSA-N 2 0 242.407 2.121 20 0 BEADRP CS[C@H](C)C[NH2+][C@@H]1CC[N@H+](C)[C@H]2CCC[C@H]21 ZINC000309721406 384566240 /nfs/dbraw/zinc/56/62/40/384566240.db2.gz WCJIQIRQHSKRIO-XQHKEYJVSA-N 2 0 242.432 2.200 20 0 BEADRP CCN(C)CC[NH2+]C[C@H](C)CC(C)C ZINC000300867683 384608151 /nfs/dbraw/zinc/60/81/51/384608151.db2.gz HFPVVECHBKBZCO-GFCCVEGCSA-N 2 0 200.370 2.210 20 0 BEADRP CSCCC[N@H+](C)C[C@H]1CC[NH2+][C@H](C)C1 ZINC000300855841 384611467 /nfs/dbraw/zinc/61/14/67/384611467.db2.gz OKYQYOAACCPFOJ-NEPJUHHUSA-N 2 0 230.421 2.059 20 0 BEADRP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccncc1 ZINC000020523962 384618604 /nfs/dbraw/zinc/61/86/04/384618604.db2.gz NMYGGOLFSINENC-JZIBPQBNSA-N 2 0 245.370 2.357 20 0 BEADRP CCC[NH+]1CCC([NH2+]C[C@@H]2CCCCO2)CC1 ZINC000042225564 384633865 /nfs/dbraw/zinc/63/38/65/384633865.db2.gz DSTZCKFAOZXSPJ-AWEZNQCLSA-N 2 0 240.391 2.020 20 0 BEADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+]CC(C)(C)C)C1 ZINC000041051478 384595677 /nfs/dbraw/zinc/59/56/77/384595677.db2.gz HBOUDVZSGHDZKQ-LBPRGKRZSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCC12CCCC2)C[NH+](C)C ZINC000309769737 384598323 /nfs/dbraw/zinc/59/83/23/384598323.db2.gz OJQTYSWHZLNCBE-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CCOC1CCCC1 ZINC000336654094 384638567 /nfs/dbraw/zinc/63/85/67/384638567.db2.gz JYORVRDMYGEAQI-GFCCVEGCSA-N 2 0 228.380 2.053 20 0 BEADRP C[N@H+]1CC=C(C[NH2+]C[C@H]2CC=CCC2)CC1 ZINC000271809419 384647372 /nfs/dbraw/zinc/64/73/72/384647372.db2.gz KQHDQUCDKQEUKN-ZDUSSCGKSA-N 2 0 220.360 2.194 20 0 BEADRP CC[C@H](C)C[N@H+](CC)C[C@@H]1CCC[NH2+]C1 ZINC000086437719 384651720 /nfs/dbraw/zinc/65/17/20/384651720.db2.gz LYOJSVUYWGMXOV-QWHCGFSZSA-N 2 0 212.381 2.354 20 0 BEADRP C[N@H+](CCC[NH+]1CCCC1)CCC1CC1 ZINC000162616153 384653010 /nfs/dbraw/zinc/65/30/10/384653010.db2.gz RTBCQYJNNVWVAT-UHFFFAOYSA-N 2 0 210.365 2.204 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]C2CCSCC2)[C@@H](C)C1 ZINC000246981607 384655862 /nfs/dbraw/zinc/65/58/62/384655862.db2.gz IWSORUZLIYYQOS-AAEUAGOBSA-N 2 0 242.432 2.202 20 0 BEADRP COc1ccc(C[NH2+]C[C@@H]2CCC[N@H+](C)C2)cc1 ZINC000044535837 384657618 /nfs/dbraw/zinc/65/76/18/384657618.db2.gz LFWHBDPHFJIDBB-AWEZNQCLSA-N 2 0 248.370 2.127 20 0 BEADRP Cc1ccccc1C[NH2+]C[C@H]1CCC[N@@H+](C)C1 ZINC000044535118 384658507 /nfs/dbraw/zinc/65/85/07/384658507.db2.gz SCBSJXNDMCUQFA-CQSZACIVSA-N 2 0 232.371 2.426 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CCCCC1(C)C ZINC000556933996 384661445 /nfs/dbraw/zinc/66/14/45/384661445.db2.gz BFLAAUHXNHKLPV-NWDGAFQWSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+]C[C@@H]1CCCC(C)(C)C1 ZINC000556932272 384661820 /nfs/dbraw/zinc/66/18/20/384661820.db2.gz NEOSOOUHKHOTIB-NWDGAFQWSA-N 2 0 212.381 2.387 20 0 BEADRP CC(C)C[C@H]([NH3+])C[NH+]1C[C@H]2CCCC[C@@H]2C1 ZINC000309933924 384725227 /nfs/dbraw/zinc/72/52/27/384725227.db2.gz XLRJSRLKEFIXKN-MCIONIFRSA-N 2 0 224.392 2.482 20 0 BEADRP CC(F)(F)CC[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000357718317 384683687 /nfs/dbraw/zinc/68/36/87/384683687.db2.gz VUOHEWMHNYBVDU-MNOVXSKESA-N 2 0 232.318 2.248 20 0 BEADRP [NH3+]C1(C[NH2+][C@H]2CC[C@@H]2C2CC2)CCCCC1 ZINC000423174575 384689589 /nfs/dbraw/zinc/68/95/89/384689589.db2.gz BDCDVXBVOAMRIG-OLZOCXBDSA-N 2 0 222.376 2.426 20 0 BEADRP [NH3+]C[C@@H]1CCC[N@H+](CCCc2ccccc2)C1 ZINC000011888460 384707481 /nfs/dbraw/zinc/70/74/81/384707481.db2.gz TYMOOFGSAIJCFV-HNNXBMFYSA-N 2 0 232.371 2.290 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H](C)c1nccs1 ZINC000336662365 384714427 /nfs/dbraw/zinc/71/44/27/384714427.db2.gz CKAAWGCLKWEHFE-ZJUUUORDSA-N 2 0 227.377 2.311 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000423220342 384778024 /nfs/dbraw/zinc/77/80/24/384778024.db2.gz YCQYVZZYHGJRFX-FRRDWIJNSA-N 2 0 210.365 2.010 20 0 BEADRP Cc1cccc(C2([NH2+]CCC[NH3+])CCC2)c1 ZINC000647552952 384778654 /nfs/dbraw/zinc/77/86/54/384778654.db2.gz BUTVSQAYDFPWBD-UHFFFAOYSA-N 2 0 218.344 2.313 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)C1CCCC1 ZINC000054081315 384730345 /nfs/dbraw/zinc/73/03/45/384730345.db2.gz AQVGAELORJIDAU-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP CC[NH2+]Cc1cccc(N[C@@H]2C[NH2+]C[C@@H](C)C2)c1 ZINC000647546388 384731400 /nfs/dbraw/zinc/73/14/00/384731400.db2.gz HXZFYWWPLDIPEL-WFASDCNBSA-N 2 0 247.386 2.206 20 0 BEADRP C1[C@@H]2[C@H]1CCC[C@@H]2[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000647551799 384753192 /nfs/dbraw/zinc/75/31/92/384753192.db2.gz MIWOMBZPZKFAFU-TVDPOAAXSA-N 2 0 234.387 2.153 20 0 BEADRP C1[C@@H]2[C@H]1CCC[C@@H]2[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000647551798 384754467 /nfs/dbraw/zinc/75/44/67/384754467.db2.gz MIWOMBZPZKFAFU-QFEQQRJNSA-N 2 0 234.387 2.153 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]Cc1cccc2cnccc21 ZINC000647552024 384757020 /nfs/dbraw/zinc/75/70/20/384757020.db2.gz AOADMBAAVFLLTI-VXGBXAGGSA-N 2 0 243.354 2.450 20 0 BEADRP C[C@H]1C[C@H](C[NH2+]CC2CCC(F)CC2)CC[NH2+]1 ZINC000647553115 384765115 /nfs/dbraw/zinc/76/51/15/384765115.db2.gz BLZNABIQLGMAHM-RJZJGCCBSA-N 2 0 242.382 2.492 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]Cc1ccc(C[NH3+])cc1 ZINC000647553377 384768656 /nfs/dbraw/zinc/76/86/56/384768656.db2.gz XYIWMGLOFHMYSR-NSHDSACASA-N 2 0 218.344 2.424 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@H]([C@@H](C)[NH3+])C2)c(C)c1 ZINC000126793014 384829365 /nfs/dbraw/zinc/82/93/65/384829365.db2.gz LLTNFRPXZNJWMF-HIFRSBDPSA-N 2 0 232.371 2.473 20 0 BEADRP CN1CCC[C@@H]1C[NH2+]Cc1ccc2cc[nH]c2c1 ZINC000226013939 384831001 /nfs/dbraw/zinc/83/10/01/384831001.db2.gz HXGYAJZAQWJKMO-CQSZACIVSA-N 2 0 243.354 2.352 20 0 BEADRP CCC1CC([NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)C1 ZINC000310013059 384783654 /nfs/dbraw/zinc/78/36/54/384783654.db2.gz JMTKCPPXYJJJGY-GNRIBBGQSA-N 2 0 222.376 2.391 20 0 BEADRP C[C@H](C[NH2+]C[C@H]1C[C@H]1C)C[NH+]1CCCCC1 ZINC000309740514 384784214 /nfs/dbraw/zinc/78/42/14/384784214.db2.gz HPMAKNMFHDYIJA-MGPQQGTHSA-N 2 0 224.392 2.354 20 0 BEADRP CCC1CC([NH2+][C@H]2C[C@@H](C)N(C3CC3)C2)C1 ZINC000310023782 384789134 /nfs/dbraw/zinc/78/91/34/384789134.db2.gz OLHJBMQJQDOVPN-XVSSEFHLSA-N 2 0 222.376 2.390 20 0 BEADRP CCSCC[NH+]1CCC([C@H]2CC[NH2+]C2)CC1 ZINC000357092499 384799230 /nfs/dbraw/zinc/79/92/30/384799230.db2.gz XEOGIPUUXQPVNW-ZDUSSCGKSA-N 2 0 242.432 2.061 20 0 BEADRP C[C@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)N2C)C1CC1 ZINC000083846961 384804448 /nfs/dbraw/zinc/80/44/48/384804448.db2.gz UBNLTTQUHWZOGZ-HLVVYCRESA-N 2 0 222.376 2.390 20 0 BEADRP CC(C)[C@H]1CC[C@@H]1[NH2+]CC1(C)CC[NH2+]CC1 ZINC000423322937 384806168 /nfs/dbraw/zinc/80/61/68/384806168.db2.gz HONHFLIZPQOOTG-OLZOCXBDSA-N 2 0 224.392 2.400 20 0 BEADRP CC(C)[C@H](C)C[NH2+][C@H](C)CCCC[NH3+] ZINC000308637293 384882400 /nfs/dbraw/zinc/88/24/00/384882400.db2.gz BKDBDQRAXGTSCX-VXGBXAGGSA-N 2 0 200.370 2.386 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@H]([NH3+])C1)c1cccc(CO)c1 ZINC000423376901 384848580 /nfs/dbraw/zinc/84/85/80/384848580.db2.gz JFWWSVNWHWOYPO-TUKIKUTGSA-N 2 0 248.370 2.099 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+]C[C@@H]2CC[C@H]3C[C@H]3C2)C1 ZINC000403676244 384848985 /nfs/dbraw/zinc/84/89/85/384848985.db2.gz PBWZYZUYTGOSHZ-APIJFGDWSA-N 2 0 236.403 2.354 20 0 BEADRP Cc1ccoc1CN[C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000127005908 384852736 /nfs/dbraw/zinc/85/27/36/384852736.db2.gz BRUKTBUCYFGOLY-VXGBXAGGSA-N 2 0 222.332 2.160 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CCCC[C@H]2C[NH3+])nc1C ZINC000314214882 384858978 /nfs/dbraw/zinc/85/89/78/384858978.db2.gz UAQORMYYJXKYKL-ZFWWWQNUSA-N 2 0 247.386 2.306 20 0 BEADRP Fc1ccccc1C[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000259056056 384950586 /nfs/dbraw/zinc/95/05/86/384950586.db2.gz QPSCWSCYDQFIMK-LBPRGKRZSA-N 2 0 236.334 2.305 20 0 BEADRP COc1ccc(C)cc1CNC[C@H]1CCC[NH2+]C1 ZINC000258926485 384951457 /nfs/dbraw/zinc/95/14/57/384951457.db2.gz GRXLMZWNXYCRKR-ZDUSSCGKSA-N 2 0 248.370 2.093 20 0 BEADRP Fc1ccc(F)c(C[NH2+]CC[C@@H]2CC[NH2+]C2)c1 ZINC000258967279 384955959 /nfs/dbraw/zinc/95/59/59/384955959.db2.gz JZZHYDNWWJNBDC-JTQLQIEISA-N 2 0 240.297 2.054 20 0 BEADRP CC[C@H](c1ccccc1)[N@@H+]1C[C@@H](C)[C@@H]([NH3+])C1 ZINC000233894731 384899728 /nfs/dbraw/zinc/89/97/28/384899728.db2.gz RHULSGUGHGXAJQ-KWCYVHTRSA-N 2 0 218.344 2.417 20 0 BEADRP C[C@@H]([NH3+])[C@H]1CCC[N@H+](Cc2cccc(F)c2)C1 ZINC000111763718 384900943 /nfs/dbraw/zinc/90/09/43/384900943.db2.gz HUMWVAHQAOEDDW-YPMHNXCESA-N 2 0 236.334 2.385 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]C[C@](C)(CC)OC)[C@@H](C)C1 ZINC000449474812 384921221 /nfs/dbraw/zinc/92/12/21/384921221.db2.gz KJFNBGKITQRKFO-IHRRRGAJSA-N 2 0 242.407 2.121 20 0 BEADRP Cc1ccc2[nH+]ccc(N[C@@H](C)C[NH3+])c2c1 ZINC000257761428 384925471 /nfs/dbraw/zinc/92/54/71/384925471.db2.gz WNBMKRMMZYYGJD-JTQLQIEISA-N 2 0 215.300 2.302 20 0 BEADRP C[C@@H](C[NH2+][C@H]1CC(C)(C)OC1(C)C)C[NH+](C)C ZINC000310254473 384927566 /nfs/dbraw/zinc/92/75/66/384927566.db2.gz OWADLSAUFKUFKO-RYUDHWBXSA-N 2 0 242.407 2.120 20 0 BEADRP CC(C)Oc1ccc(C[NH2+]C[C@@H](C)C[NH3+])cc1 ZINC000258753307 384940813 /nfs/dbraw/zinc/94/08/13/384940813.db2.gz MGXKBIKGKWOSPQ-LBPRGKRZSA-N 2 0 236.359 2.158 20 0 BEADRP C[N@H+]1CC=C(C[NH2+]Cc2ccc(Cl)o2)CC1 ZINC000336759457 384944739 /nfs/dbraw/zinc/94/47/39/384944739.db2.gz JAFFDPISTDVHLK-UHFFFAOYSA-N 2 0 240.734 2.285 20 0 BEADRP C(C[C@H]1CC[NH2+]C1)[NH2+]CC1CCCCC1 ZINC000258909610 384944762 /nfs/dbraw/zinc/94/47/62/384944762.db2.gz FBZMJHSUIPACEY-ZDUSSCGKSA-N 2 0 210.365 2.156 20 0 BEADRP C[C@@H]([NH3+])[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000058041120 384980375 /nfs/dbraw/zinc/98/03/75/384980375.db2.gz IMUMZPSUQCFIOJ-OCCSQVGLSA-N 2 0 218.344 2.246 20 0 BEADRP CC[C@@H](C)[NH2+]CC(C)(C)C[NH+]1CCCC1 ZINC000309088026 384985759 /nfs/dbraw/zinc/98/57/59/384985759.db2.gz BFALUAVBQGMRQW-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP CCC[C@H](CC)[NH2+]C[C@@H](C)C[NH+](C)C ZINC000336681164 384994562 /nfs/dbraw/zinc/99/45/62/384994562.db2.gz HIMKVSUGUHINFC-NEPJUHHUSA-N 2 0 200.370 2.352 20 0 BEADRP [NH3+][C@@H]1CCC[C@H](C[NH2+][C@@H]2CC[C@H]2C2CC2)C1 ZINC000423482535 385004804 /nfs/dbraw/zinc/00/48/04/385004804.db2.gz XYFDNBSUZCVXON-AHLTXXRQSA-N 2 0 222.376 2.282 20 0 BEADRP CCN1CCC[C@H]([NH2+][C@@H](C(C)C)C2CC2)C1 ZINC000222590591 384962796 /nfs/dbraw/zinc/96/27/96/384962796.db2.gz BYDCILIPQINVBB-KBPBESRZSA-N 2 0 224.392 2.495 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]CCc1ccc(Cl)s1 ZINC000259152437 384963442 /nfs/dbraw/zinc/96/34/42/384963442.db2.gz VDAZURWAQQZTTB-ZJUUUORDSA-N 2 0 244.791 2.413 20 0 BEADRP CC1(C)CC(C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)C1 ZINC000518396290 385048359 /nfs/dbraw/zinc/04/83/59/385048359.db2.gz BTNVCBJTQYUILV-VXGBXAGGSA-N 2 0 210.365 2.282 20 0 BEADRP CC1(C)CC(C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)C1 ZINC000518396286 385049542 /nfs/dbraw/zinc/04/95/42/385049542.db2.gz BTNVCBJTQYUILV-NEPJUHHUSA-N 2 0 210.365 2.282 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+][C@H]1C[C@H](C)C[C@H](C)C1 ZINC000300023293 385055967 /nfs/dbraw/zinc/05/59/67/385055967.db2.gz DVGSJFCKLVMNAF-RFQIPJPRSA-N 2 0 242.407 2.155 20 0 BEADRP Cc1cccc(C[NH2+][C@@H]2C[C@H]([NH3+])C2(C)C)c1 ZINC000404781581 385059475 /nfs/dbraw/zinc/05/94/75/385059475.db2.gz NKGGWAXUSVIZLX-QWHCGFSZSA-N 2 0 218.344 2.210 20 0 BEADRP CC1(C)[C@H]([NH3+])C[C@H]1[NH2+]CC1CCCCC1 ZINC000404783219 385064483 /nfs/dbraw/zinc/06/44/83/385064483.db2.gz DGZLXPPDWDQTFS-VXGBXAGGSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)[C@H]1CC[C@H]1[NH2+]CCC[NH2+]C1CC1 ZINC000423550994 385024249 /nfs/dbraw/zinc/02/42/49/385024249.db2.gz IZQVWLCTPCVOSM-CHWSQXEVSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@H]1CCC[C@@H]1[NH2+]CCn1ccnc1C ZINC000309326016 385027089 /nfs/dbraw/zinc/02/70/89/385027089.db2.gz HYSMVXPDBPOAQH-STQMWFEESA-N 2 0 221.348 2.360 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+]CCC1=CC[NH2+]CC1 ZINC000423540919 385030790 /nfs/dbraw/zinc/03/07/90/385030790.db2.gz RDISZQNPILSETO-KBPBESRZSA-N 2 0 222.376 2.320 20 0 BEADRP C[NH+](C)CCC[NH2+][C@H]1CCC12CCCC2 ZINC000189035605 385117676 /nfs/dbraw/zinc/11/76/76/385117676.db2.gz ZRIYLDMNNNLPQQ-LBPRGKRZSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CCc1ccc(O)cc1 ZINC000310504562 385098636 /nfs/dbraw/zinc/09/86/36/385098636.db2.gz IUIHUSGUQMOQSB-GFCCVEGCSA-N 2 0 236.359 2.042 20 0 BEADRP C[C@]1(C[N@@H+]2CCC[C@@H]3CCC[C@@H]32)CC[NH2+]C1 ZINC000227170337 385099514 /nfs/dbraw/zinc/09/95/14/385099514.db2.gz OQVPWCOLWYBJOC-IHRRRGAJSA-N 2 0 222.376 2.251 20 0 BEADRP Cc1cc[nH+]c(NC[C@H]2CCC[C@@H]([NH3+])C2)c1 ZINC000227673128 385197377 /nfs/dbraw/zinc/19/73/77/385197377.db2.gz MOKGXEHAKHULOK-NWDGAFQWSA-N 2 0 219.332 2.319 20 0 BEADRP Cc1ccc(C[NH2+]C[C@H](C)C[NH+](C)C)cc1 ZINC000291666351 385200014 /nfs/dbraw/zinc/20/00/14/385200014.db2.gz FWADYTAJKVGSOH-ZDUSSCGKSA-N 2 0 220.360 2.282 20 0 BEADRP CC(C)C[C@@H](C)[NH2+]CCC1=CC[NH2+]CC1 ZINC000336687126 385144033 /nfs/dbraw/zinc/14/40/33/385144033.db2.gz LFVDSZPFHFVTPO-GFCCVEGCSA-N 2 0 210.365 2.320 20 0 BEADRP CC1(C[N@@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]3)C2)CC1 ZINC000647479733 385156952 /nfs/dbraw/zinc/15/69/52/385156952.db2.gz RLARNLZFIJOVHU-OLZOCXBDSA-N 2 0 222.376 2.251 20 0 BEADRP C1CCC([NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)C1 ZINC000106868882 385158482 /nfs/dbraw/zinc/15/84/82/385158482.db2.gz ZTUBPWUGZCJWMQ-QWHCGFSZSA-N 2 0 208.349 2.145 20 0 BEADRP C[C@H](c1ccncc1)N1CC[C@]2(CC[N@H+](C)C2)C1 ZINC000644784181 385170408 /nfs/dbraw/zinc/17/04/08/385170408.db2.gz IRRRTCSORHGISY-HIFRSBDPSA-N 2 0 245.370 2.170 20 0 BEADRP CCC[C@H](C)C[N@@H+]1CC[C@H]2[NH2+]CC[C@@H]2C1 ZINC000308805510 385170705 /nfs/dbraw/zinc/17/07/05/385170705.db2.gz AVLRAZSJEVCDLX-YNEHKIRRSA-N 2 0 210.365 2.106 20 0 BEADRP Cc1nc(C[NH2+][C@H](C)CCCC[NH3+])cs1 ZINC000308811192 385179115 /nfs/dbraw/zinc/17/91/15/385179115.db2.gz HFVGMXHAVKUIIW-SECBINFHSA-N 2 0 227.377 2.059 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CC[N@H+](C[C@H]2CCCC[C@H]2C)C1 ZINC000346663857 385256189 /nfs/dbraw/zinc/25/61/89/385256189.db2.gz XDRUCEFOGTUPED-XJFOESAGSA-N 2 0 224.392 2.482 20 0 BEADRP FC(F)(F)CC[NH+]1CCC2(CC[NH2+]C2)CC1 ZINC000335742270 385213326 /nfs/dbraw/zinc/21/33/26/385213326.db2.gz MRVYHEIPPQZEKR-UHFFFAOYSA-N 2 0 236.281 2.014 20 0 BEADRP CC(C)C[C@@H](C)C[N@@H+]1CC[C@@](C)(C[NH3+])C1 ZINC000300986631 385222423 /nfs/dbraw/zinc/22/24/23/385222423.db2.gz UXKYYFSLGMFCAQ-OLZOCXBDSA-N 2 0 212.381 2.339 20 0 BEADRP C[C@H]1CC[N@H+](CC2CCCCC2)C[C@@H]1C[NH3+] ZINC000164647260 385226997 /nfs/dbraw/zinc/22/69/97/385226997.db2.gz OWAHAIVCQBLUKP-JSGCOSHPSA-N 2 0 224.392 2.483 20 0 BEADRP C[C@H](C[NH2+][C@H](C)[C@H]1CC1(C)C)C[NH+](C)C ZINC000308881016 385235744 /nfs/dbraw/zinc/23/57/44/385235744.db2.gz UJVFUTQTIYIFQT-IJLUTSLNSA-N 2 0 212.381 2.208 20 0 BEADRP C[C@H](C[NH2+][C@H](C)[C@@H]1CC1(C)C)C[NH+](C)C ZINC000308881018 385236093 /nfs/dbraw/zinc/23/60/93/385236093.db2.gz UJVFUTQTIYIFQT-UTUOFQBUSA-N 2 0 212.381 2.208 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@@H](C)CCC1CC1 ZINC000308874023 385239141 /nfs/dbraw/zinc/23/91/41/385239141.db2.gz RVYACOQPMFJNJB-NWDGAFQWSA-N 2 0 212.381 2.495 20 0 BEADRP Cc1ccc([C@H](C)[NH2+][C@@H](C)CCC[NH3+])o1 ZINC000308895990 385250661 /nfs/dbraw/zinc/25/06/61/385250661.db2.gz ZJFNEFCDBRXVRS-ONGXEEELSA-N 2 0 210.321 2.366 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)C1(C)CC1 ZINC000037485300 385302873 /nfs/dbraw/zinc/30/28/73/385302873.db2.gz BTKOKAVPNQUBFC-VXGBXAGGSA-N 2 0 222.376 2.249 20 0 BEADRP Cc1ccc(C)c(C[N@@H+]2CCC[C@@H](C[NH3+])C2)c1 ZINC000049256942 385308365 /nfs/dbraw/zinc/30/83/65/385308365.db2.gz BWYHOZAOONDVNR-AWEZNQCLSA-N 2 0 232.371 2.474 20 0 BEADRP CN1CCC([NH2+][C@H]2CCC23CCC3)CC1 ZINC000308950202 385311264 /nfs/dbraw/zinc/31/12/64/385311264.db2.gz OVLXXNFZQNYFSJ-LBPRGKRZSA-N 2 0 208.349 2.003 20 0 BEADRP [NH3+]C[C@H]1CC[N@H+](Cc2cccc3cnccc32)C1 ZINC000647490890 385283247 /nfs/dbraw/zinc/28/32/47/385283247.db2.gz WZPHRBDLOQOUKY-GFCCVEGCSA-N 2 0 241.338 2.015 20 0 BEADRP C[C@@H]([NH2+]C1CC[NH2+]CC1)C1CCCCC1 ZINC000052334201 385288477 /nfs/dbraw/zinc/28/84/77/385288477.db2.gz GJQNFHQWNKCNOR-LLVKDONJSA-N 2 0 210.365 2.297 20 0 BEADRP CCC[NH+]1CCC([NH2+]CC2(OC)CCC2)CC1 ZINC000162221615 385298347 /nfs/dbraw/zinc/29/83/47/385298347.db2.gz FZQCOJLTZVXRDH-UHFFFAOYSA-N 2 0 240.391 2.020 20 0 BEADRP C[C@H]([NH3+])C1CC[NH+](CCCCCF)CC1 ZINC000308931457 385301546 /nfs/dbraw/zinc/30/15/46/385301546.db2.gz NYMFIGKWDCSZPR-NSHDSACASA-N 2 0 216.344 2.185 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@@H]1CCC12CCC2 ZINC000309045575 385389112 /nfs/dbraw/zinc/38/91/12/385389112.db2.gz OICOGHCYTUESIO-GFCCVEGCSA-N 2 0 210.365 2.251 20 0 BEADRP Cc1c[nH+]ccc1NCC[NH+]1[C@H](C)CCC[C@H]1C ZINC000359478840 385369378 /nfs/dbraw/zinc/36/93/78/385369378.db2.gz GHVYGMONLJANBK-ZIAGYGMSSA-N 2 0 247.386 2.487 20 0 BEADRP CC(C)OCCCC[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000180456037 385391583 /nfs/dbraw/zinc/39/15/83/385391583.db2.gz WPXOVBAQPRWDRA-UONOGXRCSA-N 2 0 242.407 2.264 20 0 BEADRP Cc1cc(C[N@H+](C)CCC[NH3+])cc2cccnc12 ZINC000647497033 385398449 /nfs/dbraw/zinc/39/84/49/385398449.db2.gz XLGLSIZPHVDJNT-UHFFFAOYSA-N 2 0 243.354 2.324 20 0 BEADRP C[C@@H](C[N@H+]1C[C@H]2C[NH+](C)C[C@H]2C1)c1ccccc1 ZINC000193610394 385403434 /nfs/dbraw/zinc/40/34/34/385403434.db2.gz WQARIAAQBJSDAW-CWRNSKLLSA-N 2 0 244.382 2.284 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC2(C3CC3)CC2)CC[N@@H+]1C ZINC000181654242 385412134 /nfs/dbraw/zinc/41/21/34/385412134.db2.gz XFYIUYVTOMURKT-DGCLKSJQSA-N 2 0 222.376 2.249 20 0 BEADRP CCCCN(C)C[C@@H](C)[NH2+][C@@H](C)C1CC1 ZINC000309172067 385448431 /nfs/dbraw/zinc/44/84/31/385448431.db2.gz LOEORWAWVVRYAX-NEPJUHHUSA-N 2 0 212.381 2.495 20 0 BEADRP C[C@@H]1[C@H]([NH2+][C@H]2CCC2(C)C)CCCN1C ZINC000309144297 385434058 /nfs/dbraw/zinc/43/40/58/385434058.db2.gz URDQASBANGIECO-UTUOFQBUSA-N 2 0 210.365 2.247 20 0 BEADRP CC(C)=CCC[NH2+][C@@H]1CC[N@@H+](C)C[C@@H]1C ZINC000309145776 385437812 /nfs/dbraw/zinc/43/78/12/385437812.db2.gz VCOQMJZTAISERF-QWHCGFSZSA-N 2 0 210.365 2.273 20 0 BEADRP COCCC(C)(C)C[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000183934450 385483252 /nfs/dbraw/zinc/48/32/52/385483252.db2.gz GNTQCZBBKZQHNI-QWHCGFSZSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H]([NH3+])[C@@H](C)[NH2+][C@H](C)CCc1ccccc1 ZINC000309247899 385497570 /nfs/dbraw/zinc/49/75/70/385497570.db2.gz NWXLMYVFWXSMOX-JHJVBQTASA-N 2 0 220.360 2.333 20 0 BEADRP CC[C@H](CSC)[NH2+]C1CCN(C2CC2)CC1 ZINC000309293314 385514035 /nfs/dbraw/zinc/51/40/35/385514035.db2.gz WKHZONBVUUQROV-LLVKDONJSA-N 2 0 242.432 2.344 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@@H]1CCCc2ccccc21 ZINC000309338809 385538768 /nfs/dbraw/zinc/53/87/68/385538768.db2.gz KOJPZVQLOAFOAC-SMDDNHRTSA-N 2 0 218.344 2.248 20 0 BEADRP C[C@H](C[NH2+][C@@H]1C[C@@H](C)[C@H]1C)C[NH+]1CCCC1 ZINC000309346834 385546222 /nfs/dbraw/zinc/54/62/22/385546222.db2.gz MJJFXJNICYTMFC-AAVRWANBSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CC[C@@H]1CCCCO1 ZINC000309356527 385547587 /nfs/dbraw/zinc/54/75/87/385547587.db2.gz NLFLWETVPPJVBG-OLZOCXBDSA-N 2 0 228.380 2.053 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@@H](C)c1cccc(O)c1 ZINC000336649817 385594699 /nfs/dbraw/zinc/59/46/99/385594699.db2.gz HBLUCWYFFVIUTH-QWRGUYRKSA-N 2 0 222.332 2.170 20 0 BEADRP C[N@@H+](CCc1ccncc1)CC[C@H]1CCC[NH+]1C ZINC000181497601 385581830 /nfs/dbraw/zinc/58/18/30/385581830.db2.gz VGKNTIKTAWIGSF-OAHLLOKOSA-N 2 0 247.386 2.040 20 0 BEADRP CCSCC[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000309441495 385582341 /nfs/dbraw/zinc/58/23/41/385582341.db2.gz IRMXGNYAXLKANJ-UHFFFAOYSA-N 2 0 242.432 2.346 20 0 BEADRP [NH3+][C@@H]1CCCC[C@H]1NCc1ccsc1 ZINC000334615754 385589142 /nfs/dbraw/zinc/58/91/42/385589142.db2.gz NKQYCWLXVWBERZ-GHMZBOCLSA-N 2 0 210.346 2.108 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]Cc1cc(F)ccc1F ZINC000309488593 385609919 /nfs/dbraw/zinc/60/99/19/385609919.db2.gz XRMWZWWFTDEPAY-VIFPVBQESA-N 2 0 228.286 2.182 20 0 BEADRP CC(C)CCC[N@@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000309484904 385610355 /nfs/dbraw/zinc/61/03/55/385610355.db2.gz XQQVBNZJKQINJK-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H]1C[C@H](C)C[C@H](C)C1 ZINC000414850970 385646298 /nfs/dbraw/zinc/64/62/98/385646298.db2.gz ZWPSPBILWPUERV-QNWHQSFQSA-N 2 0 212.381 2.256 20 0 BEADRP CC[C@H](C)[NH+]1CCN(c2cc[nH+]cc2OC)CC1 ZINC000337462744 385672267 /nfs/dbraw/zinc/67/22/67/385672267.db2.gz LBCLJCGOEGSKNR-LBPRGKRZSA-N 2 0 249.358 2.011 20 0 BEADRP COCC[C@H]1CCC[C@@H]1[NH2+]CCCC[NH+](C)C ZINC000337500031 385693420 /nfs/dbraw/zinc/69/34/20/385693420.db2.gz AOKMYXNIOAUHRT-KGLIPLIRSA-N 2 0 242.407 2.123 20 0 BEADRP CCC(CC)(CC)C[NH2+]CCC[NH2+]C ZINC000391330799 385697308 /nfs/dbraw/zinc/69/73/08/385697308.db2.gz MPOPMLGYPBIBBH-UHFFFAOYSA-N 2 0 200.370 2.402 20 0 BEADRP C[C@H]([NH2+]CC1=CC[N@H+](C)CC1)c1cncs1 ZINC000309561754 385699167 /nfs/dbraw/zinc/69/91/67/385699167.db2.gz LEWCCBSVPGTQPC-JTQLQIEISA-N 2 0 237.372 2.056 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H](c1ccccc1)C1CC1 ZINC000336688913 385707157 /nfs/dbraw/zinc/70/71/57/385707157.db2.gz VWUNXRXGOFEUTB-RISCZKNCSA-N 2 0 218.344 2.322 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@H]2CCC[C@H]21)C1CC1 ZINC000309576752 385708925 /nfs/dbraw/zinc/70/89/25/385708925.db2.gz PEBXKBQERWLNBE-DEQVHRJGSA-N 2 0 222.376 2.247 20 0 BEADRP C[C@@H](C[NH2+]C[C@@H]1CC=CCC1)C[NH+](C)C ZINC000336688590 385710222 /nfs/dbraw/zinc/71/02/22/385710222.db2.gz LTWAWQVPIFLVHR-QWHCGFSZSA-N 2 0 210.365 2.130 20 0 BEADRP C[C@H](C[NH2+]C[C@@H]1CC=CCC1)C[NH+](C)C ZINC000336688569 385710291 /nfs/dbraw/zinc/71/02/91/385710291.db2.gz LTWAWQVPIFLVHR-CHWSQXEVSA-N 2 0 210.365 2.130 20 0 BEADRP C[C@@H](C[NH2+]C[C@H]1CC=CCC1)C[NH+](C)C ZINC000336688591 385711658 /nfs/dbraw/zinc/71/16/58/385711658.db2.gz LTWAWQVPIFLVHR-STQMWFEESA-N 2 0 210.365 2.130 20 0 BEADRP C[NH2+]CCC[NH2+]CC[C@H](C)c1ccccc1 ZINC000414857560 385729291 /nfs/dbraw/zinc/72/92/91/385729291.db2.gz DZAWXANVBWDUPX-ZDUSSCGKSA-N 2 0 220.360 2.379 20 0 BEADRP Cc1ccc(C[NH2+][C@@H](C)[C@H]2CCC[NH2+]C2)cc1 ZINC000414858582 385735882 /nfs/dbraw/zinc/73/58/82/385735882.db2.gz SAVIIHZESYJWGW-ZFWWWQNUSA-N 2 0 232.371 2.473 20 0 BEADRP CC(C)CSCC[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000309608941 385740616 /nfs/dbraw/zinc/74/06/16/385740616.db2.gz MBKQQQBOXFRGLF-QWHCGFSZSA-N 2 0 244.448 2.448 20 0 BEADRP C[NH2+]CCC[NH2+]C[C@H](C)Cc1ccccc1 ZINC000414862056 385750303 /nfs/dbraw/zinc/75/03/03/385750303.db2.gz UMOYOZIBICCJSV-CYBMUJFWSA-N 2 0 220.360 2.064 20 0 BEADRP C[NH2+]CCC[NH2+][C@H](C)CCCC(C)C ZINC000414861376 385751565 /nfs/dbraw/zinc/75/15/65/385751565.db2.gz SCYOVCSVZPDRDT-GFCCVEGCSA-N 2 0 200.370 2.400 20 0 BEADRP C[NH2+]CCC[NH2+]C[C@@H](C)CCc1ccccc1 ZINC000414861634 385751580 /nfs/dbraw/zinc/75/15/80/385751580.db2.gz SLZFSNRIMZIWDA-AWEZNQCLSA-N 2 0 234.387 2.454 20 0 BEADRP CC(C)C[C@H](C)[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000336697917 385755054 /nfs/dbraw/zinc/75/50/54/385755054.db2.gz OLNSSCLEFZDSOX-QWHCGFSZSA-N 2 0 212.381 2.400 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1C[C@@H](c2ccccc2)[C@@H]1C ZINC000414864695 385763801 /nfs/dbraw/zinc/76/38/01/385763801.db2.gz ZTXLLUGLWLVKKR-NWANDNLSSA-N 2 0 232.371 2.378 20 0 BEADRP C[NH2+]CCC[NH2+][C@H]1CCC[C@H](C2CC2)C1 ZINC000414856880 385719462 /nfs/dbraw/zinc/71/94/62/385719462.db2.gz BENJJTNYAJBOFR-STQMWFEESA-N 2 0 210.365 2.154 20 0 BEADRP C[NH2+]CCC[NH2+]C[C@@H](C)c1ccc(F)cc1 ZINC000414857974 385726981 /nfs/dbraw/zinc/72/69/81/385726981.db2.gz GYQKLMLREONKLB-LLVKDONJSA-N 2 0 224.323 2.128 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+]Cc1ccc(C(F)(F)F)cc1 ZINC000336691050 385727249 /nfs/dbraw/zinc/72/72/49/385727249.db2.gz HLSBAXFOWOYFTF-VIFPVBQESA-N 2 0 246.276 2.390 20 0 BEADRP CC(C)C[C@@H]1C[C@H]1[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000647799881 385800187 /nfs/dbraw/zinc/80/01/87/385800187.db2.gz RZFPJHANUXSTKE-UXXRCYHCSA-N 2 0 236.403 2.399 20 0 BEADRP F[C@@H]1CCC[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000647799636 385800480 /nfs/dbraw/zinc/80/04/80/385800480.db2.gz NHLLTWVJQJOADL-UCEQBCCISA-N 2 0 226.339 2.140 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@H]2CCc3ccccc3C2)CC[NH2+]1 ZINC000414947434 385803534 /nfs/dbraw/zinc/80/35/34/385803534.db2.gz KVBFWHLEHRSJIX-KCXAZCMYSA-N 2 0 244.382 2.274 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCC(C)(C)C1)C[NH+](C)C ZINC000336713390 385806481 /nfs/dbraw/zinc/80/64/81/385806481.db2.gz VLRRGEPZQAKKME-VXGBXAGGSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC[NH2+]CC[C@@H]1C)CC(F)F ZINC000647801452 385812067 /nfs/dbraw/zinc/81/20/67/385812067.db2.gz WDLZWMHOBGPAAW-DCAQKATOSA-N 2 0 234.334 2.255 20 0 BEADRP C[C@@H]([NH2+]CCC[NH+](C)C)C1CCSCC1 ZINC000186913366 385812039 /nfs/dbraw/zinc/81/20/39/385812039.db2.gz VERARTPFSZGRHM-LLVKDONJSA-N 2 0 230.421 2.059 20 0 BEADRP C[C@@H](C[NH2+][C@@H](C)[C@@H]1CCC[NH2+]1)CC(F)F ZINC000647801560 385812811 /nfs/dbraw/zinc/81/28/11/385812811.db2.gz YHJIKSWIJOICPY-UTLUCORTSA-N 2 0 220.307 2.008 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]Cc1ccc(Cl)c(F)c1 ZINC000414869163 385833707 /nfs/dbraw/zinc/83/37/07/385833707.db2.gz AFJWXSHPAOANHP-MRVPVSSYSA-N 2 0 230.714 2.164 20 0 BEADRP Cc1cc(C[NH2+]C[C@H](C)C[NH3+])ccc1Cl ZINC000414869645 385838960 /nfs/dbraw/zinc/83/89/60/385838960.db2.gz BBDBRPCTJTZJPO-SECBINFHSA-N 2 0 226.751 2.333 20 0 BEADRP C[NH2+]Cc1cccc(N[C@@H](C)C[C@@H]2CCC[NH2+]2)c1 ZINC000414869481 385839802 /nfs/dbraw/zinc/83/98/02/385839802.db2.gz QXCUYJXLRYQRHH-JSGCOSHPSA-N 2 0 247.386 2.349 20 0 BEADRP C[C@@H]1SCC[C@@H]1[NH2+][C@H]1CCCCC[C@H]1[NH3+] ZINC000647804206 385840515 /nfs/dbraw/zinc/84/05/15/385840515.db2.gz LJLAVHQDEVUWHI-USZNOCQGSA-N 2 0 228.405 2.130 20 0 BEADRP C[C@@H]([NH2+]CC1CCC(F)CC1)[C@@H]1CCC[NH2+]1 ZINC000647804262 385840936 /nfs/dbraw/zinc/84/09/36/385840936.db2.gz MXEYPLSZVRMUNS-XVSSEFHLSA-N 2 0 228.355 2.245 20 0 BEADRP C[C@H]([NH2+]CC1CCC(F)CC1)[C@@H]1CCC[NH2+]1 ZINC000647804261 385841202 /nfs/dbraw/zinc/84/12/02/385841202.db2.gz MXEYPLSZVRMUNS-WTIISPKJSA-N 2 0 228.355 2.245 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+]Cc1ccccc1OCC1CC1 ZINC000414870752 385847411 /nfs/dbraw/zinc/84/74/11/385847411.db2.gz CHUPAAXUXFKLQN-LBPRGKRZSA-N 2 0 248.370 2.160 20 0 BEADRP CC[C@H](Cc1ccccc1)[NH2+][C@H]1CCCNC1 ZINC000414870298 385849692 /nfs/dbraw/zinc/84/96/92/385849692.db2.gz SFJVIAZQXIDHDA-CABCVRRESA-N 2 0 232.371 2.349 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+]Cc1cnc(C2CCC2)s1 ZINC000414871575 385853498 /nfs/dbraw/zinc/85/34/98/385853498.db2.gz DGBVJRWEGOGEFZ-VIFPVBQESA-N 2 0 239.388 2.095 20 0 BEADRP CCC[NH2+]CC[NH2+][C@@H]1CCC[C@@H](C)[C@H]1C ZINC000414871021 385855646 /nfs/dbraw/zinc/85/56/46/385855646.db2.gz NIWACVXKPLQDDL-JHJVBQTASA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CCC[N@H+](CCCCCF)C1 ZINC000336706141 385792344 /nfs/dbraw/zinc/79/23/44/385792344.db2.gz RIDGGTQFTFPFKG-NWDGAFQWSA-N 2 0 216.344 2.185 20 0 BEADRP C[C@H](CC[NH3+])[NH2+]Cc1cnc(C(C)(C)C)s1 ZINC000414877880 385928638 /nfs/dbraw/zinc/92/86/38/385928638.db2.gz GNVHDJIETXMAJY-SECBINFHSA-N 2 0 241.404 2.268 20 0 BEADRP C[C@@H](C[NH2+]Cc1cccs1)C[NH+](C)C ZINC000291713851 385892643 /nfs/dbraw/zinc/89/26/43/385892643.db2.gz LTRLNWJJKKXYBD-JTQLQIEISA-N 2 0 212.362 2.035 20 0 BEADRP CCCCC[N@H+](C)CC[C@@H]([NH3+])C(C)C ZINC000123649156 385899335 /nfs/dbraw/zinc/89/93/35/385899335.db2.gz YKQAFECUDOOMIC-GFCCVEGCSA-N 2 0 200.370 2.482 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H]1CCC[C@H](C2CC2)C1 ZINC000414875694 385899467 /nfs/dbraw/zinc/89/94/67/385899467.db2.gz KHHKDUSDHNHNSP-KGYLQXTDSA-N 2 0 210.365 2.140 20 0 BEADRP CC[C@H](Cc1ccccc1)[NH2+]CC1([NH3+])CCC1 ZINC000414876186 385904380 /nfs/dbraw/zinc/90/43/80/385904380.db2.gz KWVFFNKVXYQWIX-CQSZACIVSA-N 2 0 232.371 2.479 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]Cc1cc(Cl)cs1 ZINC000414876188 385905090 /nfs/dbraw/zinc/90/50/90/385905090.db2.gz KXHCWEPEDMVHOW-SSDOTTSWSA-N 2 0 218.753 2.086 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCSc2ccccc21)C1C[NH2+]C1 ZINC000335037967 385929442 /nfs/dbraw/zinc/92/94/42/385929442.db2.gz JURKQJKZKBFICW-MFKMUULPSA-N 2 0 248.395 2.421 20 0 BEADRP COC[C@]1(C[NH2+]C[C@H](C)CC(C)C)CCC[NH2+]1 ZINC000414965504 385906026 /nfs/dbraw/zinc/90/60/26/385906026.db2.gz ZORDNHXXOCNVJC-ZIAGYGMSSA-N 2 0 242.407 2.027 20 0 BEADRP CCC[NH2+]CC[NH2+][C@@H]1CCC[C@@H]1C(C)C ZINC000414876380 385907275 /nfs/dbraw/zinc/90/72/75/385907275.db2.gz VTHFQUSULYUELM-CHWSQXEVSA-N 2 0 212.381 2.400 20 0 BEADRP COCC1(C[NH2+]CCC(C)(C)C)CC[NH2+]CC1 ZINC000414966482 385919525 /nfs/dbraw/zinc/91/95/25/385919525.db2.gz CGUGVMFZTICMCH-UHFFFAOYSA-N 2 0 242.407 2.028 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]C1Cc2ccccc2C1 ZINC000335040047 385930129 /nfs/dbraw/zinc/93/01/29/385930129.db2.gz OCCJYDYSFUIFSA-HZPDHXFCSA-N 2 0 244.382 2.403 20 0 BEADRP C([NH2+]C1CCC2(CC2)CC1)[C@H]1CCC[NH2+]1 ZINC000335034839 385923026 /nfs/dbraw/zinc/92/30/26/385923026.db2.gz ZEXHFUVDUHCDFQ-GFCCVEGCSA-N 2 0 208.349 2.051 20 0 BEADRP CCC[NH2+]CC[NH2+]C[C@@H](C)CC(C)C ZINC000414877319 385924032 /nfs/dbraw/zinc/92/40/32/385924032.db2.gz XOBBIGIOZSPIPC-LBPRGKRZSA-N 2 0 200.370 2.258 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]Cc1cc2cc(F)ccc2o1 ZINC000414878139 385927398 /nfs/dbraw/zinc/92/73/98/385927398.db2.gz NTQBBTSPCJDBGQ-SECBINFHSA-N 2 0 236.290 2.256 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@@H]2CC[C@H]2C2CCC2)CC1 ZINC000337990806 385870095 /nfs/dbraw/zinc/87/00/95/385870095.db2.gz CSKVOGGJGWTKCS-LSDHHAIUSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H]1CCC(C)(C)C[C@@H]1C ZINC000414872900 385871428 /nfs/dbraw/zinc/87/14/28/385871428.db2.gz GMSYFQZRABWBKM-WOPDTQHZSA-N 2 0 212.381 2.386 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+]C/C=C\c1ccc(F)cc1F ZINC000414873338 385876061 /nfs/dbraw/zinc/87/60/61/385876061.db2.gz HBALOOYPVPGHLD-ZMWSMAPVSA-N 2 0 240.297 2.162 20 0 BEADRP C[C@@H]1CCC[C@H]1[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000414967255 385928290 /nfs/dbraw/zinc/92/82/90/385928290.db2.gz HFWIZSNUGQWSNB-FRRDWIJNSA-N 2 0 210.365 2.297 20 0 BEADRP c1ccc([C@@H]2CC[N@@H+](CC[C@H]3CC[NH2+]C3)C2)cc1 ZINC000250825000 385928388 /nfs/dbraw/zinc/92/83/88/385928388.db2.gz WEHQXUMYSGVZNU-GDBMZVCRSA-N 2 0 244.382 2.476 20 0 BEADRP CC1(C)CCC[C@@H]([NH2+]CC2([NH3+])CCC2)C1 ZINC000335021765 385982256 /nfs/dbraw/zinc/98/22/56/385982256.db2.gz FBCOECIWLYFVQJ-LLVKDONJSA-N 2 0 210.365 2.426 20 0 BEADRP CC1([NH3+])CC[NH+](CCCc2ccccc2)CC1 ZINC000647926681 385982718 /nfs/dbraw/zinc/98/27/18/385982718.db2.gz IKVMGFSPRMTVIW-UHFFFAOYSA-N 2 0 232.371 2.432 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]C1CCCCC1 ZINC000335023350 385984870 /nfs/dbraw/zinc/98/48/70/385984870.db2.gz GTFDJBWASBJQJE-DGCLKSJQSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H]1CCCC[C@@H]1C1CC1 ZINC000414881052 385988711 /nfs/dbraw/zinc/98/87/11/385988711.db2.gz RWDUEMARWQFVED-RTXFEEFZSA-N 2 0 210.365 2.140 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H]1CCCC[C@H]1C1CC1 ZINC000414881058 385988874 /nfs/dbraw/zinc/98/88/74/385988874.db2.gz RWDUEMARWQFVED-WXHSDQCUSA-N 2 0 210.365 2.140 20 0 BEADRP C[C@H]([NH2+]CC1CC[NH+](C)CC1)[C@@H]1CC1(C)C ZINC000336749001 385990293 /nfs/dbraw/zinc/99/02/93/385990293.db2.gz TUVQBZBOIJSGCN-AAEUAGOBSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]Cc1ccc(F)cc1 ZINC000335039078 385930976 /nfs/dbraw/zinc/93/09/76/385930976.db2.gz LWVKLXAGZJMOPS-RISCZKNCSA-N 2 0 236.334 2.303 20 0 BEADRP Cc1cccc2c1CC[C@@H]2[NH2+]CC(C)(C)[NH3+] ZINC000335039255 385931480 /nfs/dbraw/zinc/93/14/80/385931480.db2.gz BJCGFDLMANAQRS-ZDUSSCGKSA-N 2 0 218.344 2.309 20 0 BEADRP CC[NH2+][C@H](C)CNCc1ccccc1C ZINC000414968161 385936280 /nfs/dbraw/zinc/93/62/80/385936280.db2.gz YAVQZWFWBJTWNV-GFCCVEGCSA-N 2 0 206.333 2.083 20 0 BEADRP Cc1ccc2c(c1)[C@@H]([NH2+]CC(C)(C)[NH3+])CC2 ZINC000335043102 385936175 /nfs/dbraw/zinc/93/61/75/385936175.db2.gz NDAWMVLTGAODMP-ZDUSSCGKSA-N 2 0 218.344 2.309 20 0 BEADRP C[C@H]1CCC[C@H]1[NH2+]C1CCC(C[NH3+])CC1 ZINC000335046138 385942392 /nfs/dbraw/zinc/94/23/92/385942392.db2.gz ZSCWNVGPPUHOEK-YWPUVAFDSA-N 2 0 210.365 2.282 20 0 BEADRP CCCC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[NH2+]C1 ZINC000414878889 385943046 /nfs/dbraw/zinc/94/30/46/385943046.db2.gz HYVASTXUDFQHRO-UPJWGTAASA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@H](C)C[C@H](CC)[NH2+]C[C@@H](C)C[NH3+] ZINC000414879114 385948158 /nfs/dbraw/zinc/94/81/58/385948158.db2.gz PCGDSXCIRFPUNY-SRVKXCTJSA-N 2 0 200.370 2.386 20 0 BEADRP C[C@@H](CC[NH3+])[NH2+]Cc1ccccc1OCC1CC1 ZINC000414879370 385949968 /nfs/dbraw/zinc/94/99/68/385949968.db2.gz IMPCGLHCFGSUIP-LBPRGKRZSA-N 2 0 248.370 2.302 20 0 BEADRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]CCCC(F)(F)F ZINC000123931703 385950135 /nfs/dbraw/zinc/95/01/35/385950135.db2.gz IEXGJXYRDXFCCP-BDAKNGLRSA-N 2 0 224.270 2.046 20 0 BEADRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]CCCC(F)(F)F ZINC000123931301 385950150 /nfs/dbraw/zinc/95/01/50/385950150.db2.gz IEXGJXYRDXFCCP-RKDXNWHRSA-N 2 0 224.270 2.046 20 0 BEADRP CC[NH+](CC)CCC[NH+]1C[C@@H](C)[C@H](C)C1 ZINC000338305349 385953373 /nfs/dbraw/zinc/95/33/73/385953373.db2.gz KIDHSIWIIFOLOH-CHWSQXEVSA-N 2 0 212.381 2.306 20 0 BEADRP CC(C)[C@H]1CCC[C@H]1[NH2+]CC1([NH3+])CCC1 ZINC000414880036 385957891 /nfs/dbraw/zinc/95/78/91/385957891.db2.gz QJEBWVIKTQTKDN-VXGBXAGGSA-N 2 0 210.365 2.282 20 0 BEADRP CCN(C)CC[NH2+][C@H]1CCC[C@H]1CCF ZINC000336768484 385958178 /nfs/dbraw/zinc/95/81/78/385958178.db2.gz UHVXBEYYDNXKMZ-RYUDHWBXSA-N 2 0 216.344 2.056 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC2([NH3+])CCCCCC2)CCO1 ZINC000335057519 385959043 /nfs/dbraw/zinc/95/90/43/385959043.db2.gz FKAPLZHXMZQQOL-CHWSQXEVSA-N 2 0 240.391 2.195 20 0 BEADRP Fc1cccc2c1CC[C@H]2[NH2+]CC1=CC[NH2+]CC1 ZINC000335059763 385961703 /nfs/dbraw/zinc/96/17/03/385961703.db2.gz OXXYDLDACBBHLX-OAHLLOKOSA-N 2 0 246.329 2.322 20 0 BEADRP C[C@@H]([NH2+]CCC[C@H]1CCC[NH2+]1)C1CCC1 ZINC000414970569 385962579 /nfs/dbraw/zinc/96/25/79/385962579.db2.gz VDDZDBYUIYSHSO-YPMHNXCESA-N 2 0 210.365 2.297 20 0 BEADRP CC[NH+](CC)CCC[N@H+](C[C@H](C)OC)C(C)C ZINC000338312364 385964346 /nfs/dbraw/zinc/96/43/46/385964346.db2.gz ICASEHYLYPZRCZ-AWEZNQCLSA-N 2 0 244.423 2.464 20 0 BEADRP [NH3+]CC1CCC([NH2+][C@H]2CC23CCCC3)CC1 ZINC000335012341 385969633 /nfs/dbraw/zinc/96/96/33/385969633.db2.gz YGMMNBNCRNNBHN-BPCQOVAHSA-N 2 0 222.376 2.426 20 0 BEADRP C[C@@H]1CCC[C@@H](C[NH2+]CC2([NH3+])CCC2)C1 ZINC000414880825 385971393 /nfs/dbraw/zinc/97/13/93/385971393.db2.gz RCJKZVWPJOOGJF-VXGBXAGGSA-N 2 0 210.365 2.284 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCC[C@H]2C[C@]21C)C[NH+](C)C ZINC000336747383 385972285 /nfs/dbraw/zinc/97/22/85/385972285.db2.gz RYDYURLONHGEHM-XJFOESAGSA-N 2 0 224.392 2.352 20 0 BEADRP CC[C@@H](C)[N@@H+]1CCC[C@H](c2ncc[nH]2)C1 ZINC000273133990 385973032 /nfs/dbraw/zinc/97/30/32/385973032.db2.gz VLBDSGGTNJABFH-MNOVXSKESA-N 2 0 207.321 2.388 20 0 BEADRP Fc1ccccc1C[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000414971488 385973270 /nfs/dbraw/zinc/97/32/70/385973270.db2.gz LKFVZSVSOHKAAE-CYBMUJFWSA-N 2 0 236.334 2.448 20 0 BEADRP CC[C@@H]1CCC[C@H]([NH2+]CC2([NH3+])CCC2)C1 ZINC000414881481 386000073 /nfs/dbraw/zinc/00/00/73/386000073.db2.gz SJKWVQOLRGBWPJ-NEPJUHHUSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)c1ccncc1 ZINC000414168736 386014426 /nfs/dbraw/zinc/01/44/26/386014426.db2.gz ALBZJVPCLYPJRD-KBPBESRZSA-N 2 0 247.386 2.464 20 0 BEADRP CC[C@@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)C1CC1 ZINC000414170855 386016828 /nfs/dbraw/zinc/01/68/28/386016828.db2.gz CLEMYGLHPYKZFM-TZMCWYRMSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]([NH2+][C@H]1CCCc2sccc21)C1C[NH2+]C1 ZINC000335062193 386029907 /nfs/dbraw/zinc/02/99/07/386029907.db2.gz YUVAADFOVVIXOG-CABZTGNLSA-N 2 0 236.384 2.323 20 0 BEADRP C[NH2+][C@@H]1CCN(c2cc(C)[nH+]c3ccccc32)C1 ZINC000129124295 386030909 /nfs/dbraw/zinc/03/09/09/386030909.db2.gz IOAUEYUPBAHNRG-GFCCVEGCSA-N 2 0 241.338 2.341 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]CC2([NH3+])CCC2)[C@@H]1C ZINC000414883536 386032801 /nfs/dbraw/zinc/03/28/01/386032801.db2.gz VIWVJKSEZQJIGU-IJLUTSLNSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]Cc1cccc(Cl)c1F ZINC000414884245 386045771 /nfs/dbraw/zinc/04/57/71/386045771.db2.gz VYEXCRVLTYRVQT-MRVPVSSYSA-N 2 0 230.714 2.164 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCC[C@H]1C1CC1)C[NH+](C)C ZINC000336749620 385996692 /nfs/dbraw/zinc/99/66/92/385996692.db2.gz UIGXOOCJHJODND-KWCYVHTRSA-N 2 0 224.392 2.352 20 0 BEADRP CC(C)=CC[N@H+]1CCC[C@@H]([NH+](C)C)CC1 ZINC000335992349 386103997 /nfs/dbraw/zinc/10/39/97/386103997.db2.gz QUERXQZJXJSUCN-CYBMUJFWSA-N 2 0 210.365 2.369 20 0 BEADRP Cc1c[nH+]ccc1N1C[C@@H]([NH+]2CCCC2)C[C@H]1C ZINC000334455341 386105331 /nfs/dbraw/zinc/10/53/31/386105331.db2.gz OCOSGPUQOJNGBN-KGLIPLIRSA-N 2 0 245.370 2.453 20 0 BEADRP C[C@H]([NH3+])[C@H]1CC[N@H+](C[C@@H]2C[C@H]2c2ccccc2)C1 ZINC000414665783 386113027 /nfs/dbraw/zinc/11/30/27/386113027.db2.gz VXUYPEYEBPPIFM-TUUVXOQKSA-N 2 0 244.382 2.459 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@@H]1CCC[C@@H](C2CC2)C1 ZINC000414986715 386114684 /nfs/dbraw/zinc/11/46/84/386114684.db2.gz YCQPCAQVNAKKKY-FRRDWIJNSA-N 2 0 210.365 2.282 20 0 BEADRP Fc1ccc(C[N@H+](C[C@@H]2CC[NH2+]C2)C2CC2)cc1 ZINC000647873528 386121086 /nfs/dbraw/zinc/12/10/86/386121086.db2.gz WOPOZGRIOAFZBD-CYBMUJFWSA-N 2 0 248.345 2.400 20 0 BEADRP C(C[NH2+][C@H]1CCCSC1)C[C@H]1CCC[NH2+]1 ZINC000414982080 386063244 /nfs/dbraw/zinc/06/32/44/386063244.db2.gz YIIPNNFSKMPHQH-NEPJUHHUSA-N 2 0 228.405 2.004 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCCC(C)(C)C1)C1C[NH2+]C1 ZINC000335030503 386064826 /nfs/dbraw/zinc/06/48/26/386064826.db2.gz QCSYZEHNMGILLR-ZYHUDNBSSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]1C[C@H]([NH2+]C[C@@H]([NH3+])C2CC2)C[C@@H](C)C1 ZINC000414885962 386066697 /nfs/dbraw/zinc/06/66/97/386066697.db2.gz GXFAIWMVYLXHAM-RSLMWUCJSA-N 2 0 210.365 2.138 20 0 BEADRP CCC[NH+]1CCC([NH2+]C[C@@H](C)CCOC)CC1 ZINC000414212550 386068196 /nfs/dbraw/zinc/06/81/96/386068196.db2.gz WUIUCYHPJAVWFE-ZDUSSCGKSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+][C@H]1CC1(C)C ZINC000414227776 386077338 /nfs/dbraw/zinc/07/73/38/386077338.db2.gz XOLBYBXNFITZAE-KXNHARMFSA-N 2 0 210.365 2.103 20 0 BEADRP [NH3+]C[C@H]1CC[N@H+](C[C@@H]2C[C@H]2c2ccccc2)C1 ZINC000414659440 386088923 /nfs/dbraw/zinc/08/89/23/386088923.db2.gz SLNZADHNUGWEPX-SNPRPXQTSA-N 2 0 230.355 2.071 20 0 BEADRP CC[C@@H]([NH3+])CNCc1ccccc1Cl ZINC000414987918 386122876 /nfs/dbraw/zinc/12/28/76/386122876.db2.gz ZLGJRQRWHRFKSD-SNVBAGLBSA-N 2 0 212.724 2.167 20 0 BEADRP Cc1cnccc1C[NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000295819751 386090590 /nfs/dbraw/zinc/09/05/90/386090590.db2.gz UOGFYQMSCBEJDJ-LSDHHAIUSA-N 2 0 247.386 2.352 20 0 BEADRP C[C@H]([NH2+]CC1=CC[N@H+](C)CC1)c1ccncc1F ZINC000340530527 386144663 /nfs/dbraw/zinc/14/46/63/386144663.db2.gz HCUUOOHISIVRSO-NSHDSACASA-N 2 0 249.333 2.133 20 0 BEADRP CC[N@@H+](Cc1ccccc1C)C[C@@H]1CC[NH2+]C1 ZINC000647877336 386147270 /nfs/dbraw/zinc/14/72/70/386147270.db2.gz NZWYNFBCZCQPTQ-CQSZACIVSA-N 2 0 232.371 2.426 20 0 BEADRP C[C@H](CCc1ccsc1)[NH2+]C[C@@H]([NH3+])C1CC1 ZINC000414891868 386149141 /nfs/dbraw/zinc/14/91/41/386149141.db2.gz OTDSKJMVJCQRJE-ZWNOBZJWSA-N 2 0 238.400 2.396 20 0 BEADRP C[C@@H](CC[NH3+])[NH2+]Cc1cc2cc(F)ccc2o1 ZINC000414892650 386153354 /nfs/dbraw/zinc/15/33/54/386153354.db2.gz XEGQXNDVKSJUNE-VIFPVBQESA-N 2 0 236.290 2.399 20 0 BEADRP c1coc([C@@H]2C[C@H]2[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)c1 ZINC000414352178 386154152 /nfs/dbraw/zinc/15/41/52/386154152.db2.gz SZXNZIBDTAVEJF-AAVRWANBSA-N 2 0 246.354 2.352 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@H]1CCCC[C@@H]1C1CC1 ZINC000414992986 386160552 /nfs/dbraw/zinc/16/05/52/386160552.db2.gz SKIYDFOUOTVBBX-XQQFMLRXSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+][C@H](C[NH2+][C@H]1CCCC[C@@H]1C1CC1)C1CC1 ZINC000414894262 386171198 /nfs/dbraw/zinc/17/11/98/386171198.db2.gz SQJSBYRHXKTXDW-MCIONIFRSA-N 2 0 222.376 2.282 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@H](C)Cc1ccccc1C ZINC000414996330 386181100 /nfs/dbraw/zinc/18/11/00/386181100.db2.gz XNDGJVZJCJDJHN-OCCSQVGLSA-N 2 0 220.360 2.253 20 0 BEADRP CO[C@@H](C)C[N@H+](C[C@H]([NH3+])CC(C)C)C(C)C ZINC000414691395 386187346 /nfs/dbraw/zinc/18/73/46/386187346.db2.gz BOJXCHARHXUBSJ-QWHCGFSZSA-N 2 0 230.396 2.105 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H]2C[C@H]2c2ccco2)[C@H](C)C1 ZINC000414335096 386128108 /nfs/dbraw/zinc/12/81/08/386128108.db2.gz IZMKKGFLGZRAAZ-YIYPIFLZSA-N 2 0 248.370 2.455 20 0 BEADRP Cc1cncc([C@H](C)[NH2+]CCCC[NH+](C)C)c1 ZINC000274633399 386132001 /nfs/dbraw/zinc/13/20/01/386132001.db2.gz RVWJHCMFDVKVJL-ZDUSSCGKSA-N 2 0 235.375 2.382 20 0 BEADRP Cc1ccccc1[C@@H]1CCC[N@@H+]1CCC[NH3+] ZINC000414669955 386134497 /nfs/dbraw/zinc/13/44/97/386134497.db2.gz CHAOAULEQAIYDW-AWEZNQCLSA-N 2 0 218.344 2.481 20 0 BEADRP Cc1ccc(C[NH2+]C[C@@H]2CCCN2C)s1 ZINC000163685067 386139823 /nfs/dbraw/zinc/13/98/23/386139823.db2.gz QMKBEWGYMPKIMB-NSHDSACASA-N 2 0 224.373 2.240 20 0 BEADRP C[N@H+](C[C@@H]1CC[NH2+]C1)[C@@H]1CCc2ccccc21 ZINC000647874664 386142122 /nfs/dbraw/zinc/14/21/22/386142122.db2.gz KUMBBEGGYWAXCY-IUODEOHRSA-N 2 0 230.355 2.215 20 0 BEADRP C[C@H](CC[NH3+])[NH2+][C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000414891527 386143028 /nfs/dbraw/zinc/14/30/28/386143028.db2.gz ILSJYNNAPOKQIJ-UTLUCORTSA-N 2 0 238.297 2.434 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@](C)(C[NH3+])C2)cc1C ZINC000235887595 386201996 /nfs/dbraw/zinc/20/19/96/386201996.db2.gz AVNCUALOUOMKAV-OAHLLOKOSA-N 2 0 232.371 2.474 20 0 BEADRP CC[N@H+](CCc1ccccc1)C[C@H]1CC[NH2+]C1 ZINC000647880972 386202458 /nfs/dbraw/zinc/20/24/58/386202458.db2.gz KJVNAPZZPRXAMN-HNNXBMFYSA-N 2 0 232.371 2.161 20 0 BEADRP CC(C)C[C@H]([NH3+])CN1CCc2ccsc2C1 ZINC000414700063 386204031 /nfs/dbraw/zinc/20/40/31/386204031.db2.gz KCYCSLBHLHVHQE-LBPRGKRZSA-N 2 0 238.400 2.480 20 0 BEADRP Cc1ccc2cc(C[NH2+][C@H](C)CC[NH3+])ccc2n1 ZINC000414896927 386210778 /nfs/dbraw/zinc/21/07/78/386210778.db2.gz QBHNUZTXWCMJHG-LLVKDONJSA-N 2 0 243.354 2.370 20 0 BEADRP C[C@@H]1C[C@H](c2ccccc2)C[N@@H+]1CCC[NH3+] ZINC000414702796 386211288 /nfs/dbraw/zinc/21/12/88/386211288.db2.gz LXCUNFJNPDJMBZ-OCCSQVGLSA-N 2 0 218.344 2.213 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CCC[NH2+]C1)c1cccc(O)c1 ZINC000132167774 386227650 /nfs/dbraw/zinc/22/76/50/386227650.db2.gz DKXHJSHHDLEMAY-VXGBXAGGSA-N 2 0 234.343 2.042 20 0 BEADRP C[C@@H]1[C@H](C)SCC[N@@H+]1CCC1CC[NH2+]CC1 ZINC000132525697 386241082 /nfs/dbraw/zinc/24/10/82/386241082.db2.gz YPQKENNBTPTURS-NEPJUHHUSA-N 2 0 242.432 2.202 20 0 BEADRP COc1c(C)cc(C[N@@H+]2CC[C@H](C[NH3+])C2)cc1C ZINC000347096013 386247010 /nfs/dbraw/zinc/24/70/10/386247010.db2.gz ITAJNOKAPPUJFS-CYBMUJFWSA-N 2 0 248.370 2.093 20 0 BEADRP C[C@@H]1C[N@H+](CCC[NH3+])CC[C@H]1c1ccccc1 ZINC000414718844 386250231 /nfs/dbraw/zinc/25/02/31/386250231.db2.gz ZTOKFJGVMVMGRD-UKRRQHHQSA-N 2 0 232.371 2.461 20 0 BEADRP CC[N@H+](C[C@H]1CC[NH2+]C1)[C@H](C)c1cccc(O)c1 ZINC000647880366 386196144 /nfs/dbraw/zinc/19/61/44/386196144.db2.gz NSWXFNYNFLZJHY-OLZOCXBDSA-N 2 0 248.370 2.385 20 0 BEADRP CC[C@H]([NH2+][C@H]1CN(C2CC2)C[C@H]1C)C(C)C ZINC000336730915 386301531 /nfs/dbraw/zinc/30/15/31/386301531.db2.gz IOGFHMYQAPHWMA-XBFCOCLRSA-N 2 0 224.392 2.493 20 0 BEADRP CC[C@@H]1Cc2ccccc2C[N@@H+]1CCC[NH3+] ZINC000414735079 386308112 /nfs/dbraw/zinc/30/81/12/386308112.db2.gz FONHTJUGFVQVLM-CQSZACIVSA-N 2 0 218.344 2.172 20 0 BEADRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]CC1(C2CC2)CCC1 ZINC000391466621 386325128 /nfs/dbraw/zinc/32/51/28/386325128.db2.gz QJAWKAMHTIVXGP-DGCLKSJQSA-N 2 0 222.376 2.284 20 0 BEADRP Cn1cncc1CC[N@H+](C)CCc1ccccc1 ZINC000297661073 386270071 /nfs/dbraw/zinc/27/00/71/386270071.db2.gz JODSUNSJOZBOGG-UHFFFAOYSA-N 2 0 243.354 2.137 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+]Cc1cccc(F)c1 ZINC000335278315 386347074 /nfs/dbraw/zinc/34/70/74/386347074.db2.gz MUXRDAAMQRHTFN-AVJIGQEQSA-N 2 0 248.345 2.431 20 0 BEADRP Cc1ccnc([C@H](C)[NH2+]CC2CC[NH+](C)CC2)c1 ZINC000353520646 386351023 /nfs/dbraw/zinc/35/10/23/386351023.db2.gz OHOCNHSOSJWPNX-ZDUSSCGKSA-N 2 0 247.386 2.382 20 0 BEADRP C[C@@H]([NH3+])[C@H](C)[NH2+]CCSCc1ccccc1 ZINC000415007411 386361312 /nfs/dbraw/zinc/36/13/12/386361312.db2.gz CSEGCGISVAZURS-NEPJUHHUSA-N 2 0 238.400 2.245 20 0 BEADRP CCC[C@H](C)C[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000415008133 386376051 /nfs/dbraw/zinc/37/60/51/386376051.db2.gz MMSOHFGTZMMYPH-FPMFFAJLSA-N 2 0 224.392 2.400 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccc(F)cc3)C[C@@H]21 ZINC000230045724 386336677 /nfs/dbraw/zinc/33/66/77/386336677.db2.gz CJUGFXOBRUGASE-VHDGCEQUSA-N 2 0 248.345 2.385 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@@H]1CCC[C@H]2C[C@]21C ZINC000336776016 386391361 /nfs/dbraw/zinc/39/13/61/386391361.db2.gz DJCQYDUOVJUTRG-BFHYXJOUSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1CCCC[C@H]1[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000414907696 386392427 /nfs/dbraw/zinc/39/24/27/386392427.db2.gz QWGAFWOKLPBYHC-YNEHKIRRSA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@@H]([NH2+][C@@H](C)CC[NH+](C)C)c1ccncc1 ZINC000347419473 386397442 /nfs/dbraw/zinc/39/74/42/386397442.db2.gz NKPZSTPEEPSDIQ-GXTWGEPZSA-N 2 0 235.375 2.463 20 0 BEADRP COc1cc(C[NH2+][C@H]2CCC[C@H]([NH3+])C2)ccc1C ZINC000414908479 386398617 /nfs/dbraw/zinc/39/86/17/386398617.db2.gz BKXOZDUKMBFKHT-KBPBESRZSA-N 2 0 248.370 2.363 20 0 BEADRP [NH3+]CCCC[NH2+]Cc1cnc(C2CCC2)s1 ZINC000414909485 386410391 /nfs/dbraw/zinc/41/03/91/386410391.db2.gz RIBRJDSBIVSIDK-UHFFFAOYSA-N 2 0 239.388 2.239 20 0 BEADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]C[C@@H]1CCCO1 ZINC000093496300 386416122 /nfs/dbraw/zinc/41/61/22/386416122.db2.gz BOFCXGWBJPMSTJ-RDBSUJKOSA-N 2 0 240.391 2.066 20 0 BEADRP Cc1cc(C)c2c(c1)C[N@@H+](C[C@@H]1CC[NH2+]C1)CC2 ZINC000647991292 386421708 /nfs/dbraw/zinc/42/17/08/386421708.db2.gz WSSJSTJHFBFDHW-CQSZACIVSA-N 2 0 244.382 2.271 20 0 BEADRP CC[NH+](CC)CC1CC[NH+](C[C@H](C)OC)CC1 ZINC000336715096 386434471 /nfs/dbraw/zinc/43/44/71/386434471.db2.gz SVJNQRQRIZOZKZ-ZDUSSCGKSA-N 2 0 242.407 2.075 20 0 BEADRP Cc1cc(C[NH2+][C@@H]2C[C@@H](C)N(C3CC3)C2)ccn1 ZINC000391182048 386468149 /nfs/dbraw/zinc/46/81/49/386468149.db2.gz KPVGHJOBXZBYAF-TZMCWYRMSA-N 2 0 245.370 2.105 20 0 BEADRP CC1(C[N@@H+]2CCC[C@@H]([C@H]3CC[NH2+]C3)C2)CCC1 ZINC000414775191 386469224 /nfs/dbraw/zinc/46/92/24/386469224.db2.gz GGSQITKINANGRQ-UONOGXRCSA-N 2 0 236.403 2.498 20 0 BEADRP CC[C@H]1C[N@H+](Cc2ccc(C)nc2C)CC[C@@H]1[NH3+] ZINC000647934382 386472315 /nfs/dbraw/zinc/47/23/15/386472315.db2.gz CQEPVKNIAQYODB-ZFWWWQNUSA-N 2 0 247.386 2.258 20 0 BEADRP C[C@H](CN(C)C)[NH2+][C@@H](C)C1CCSCC1 ZINC000336742166 386475264 /nfs/dbraw/zinc/47/52/64/386475264.db2.gz WOPIUVZEZVCQSK-MNOVXSKESA-N 2 0 230.421 2.058 20 0 BEADRP C[C@@H]1CCC[C@@H](C)C1[NH2+]C1CC[NH2+]CC1 ZINC000335425448 386477016 /nfs/dbraw/zinc/47/70/16/386477016.db2.gz LPWGWWSCFFHHCV-GHMZBOCLSA-N 2 0 210.365 2.153 20 0 BEADRP [NH3+]CCCC[NH2+]CCSCc1ccccc1 ZINC000414912896 386480433 /nfs/dbraw/zinc/48/04/33/386480433.db2.gz VEKHJFCPGQMJCR-UHFFFAOYSA-N 2 0 238.400 2.248 20 0 BEADRP C([NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)[C@H]1CC12CC2 ZINC000417345926 386488163 /nfs/dbraw/zinc/48/81/63/386488163.db2.gz YMAJJKXIYJALCK-FRRDWIJNSA-N 2 0 220.360 2.003 20 0 BEADRP CC1(C)CCC[C@@H]1[NH2+][C@@H]1CC[C@@H](C[NH3+])C1 ZINC000415042825 386529542 /nfs/dbraw/zinc/52/95/42/386529542.db2.gz RGPCBEMXCBLHED-UTUOFQBUSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)(CCC[NH3+])[NH2+]Cc1cc(O)cc(F)c1 ZINC000415014524 386500535 /nfs/dbraw/zinc/50/05/35/386500535.db2.gz MMWNNOUYNJNZOQ-UHFFFAOYSA-N 2 0 240.322 2.138 20 0 BEADRP C[C@@H]([NH3+])[C@H](C)[NH2+]C[C@@H](C)Cc1ccccc1 ZINC000415014684 386501257 /nfs/dbraw/zinc/50/12/57/386501257.db2.gz MEGADJGJGPQQMX-XQQFMLRXSA-N 2 0 220.360 2.191 20 0 BEADRP CCCc1cccc(CN[C@@H](C)[C@@H](C)[NH3+])c1 ZINC000415016649 386502463 /nfs/dbraw/zinc/50/24/63/386502463.db2.gz OISHPWUDBVHMRP-NEPJUHHUSA-N 2 0 220.360 2.464 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]C/C=C/c1ccccc1 ZINC000414787880 386529700 /nfs/dbraw/zinc/52/97/00/386529700.db2.gz CVORLGAERQDORQ-QKNOVVFDSA-N 2 0 230.355 2.417 20 0 BEADRP C[C@H](CCc1ccccc1)C[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000415021656 386510795 /nfs/dbraw/zinc/51/07/95/386510795.db2.gz CHUUTTVOLYCEQR-OJLVUWQFSA-N 2 0 244.382 2.063 20 0 BEADRP c1ccc([C@@H]2CCC[C@H]2[NH2+][C@@H]2[C@H]3C[NH2+]C[C@H]32)cc1 ZINC000415029291 386516127 /nfs/dbraw/zinc/51/61/27/386516127.db2.gz CMFLEJKPDFSBGC-AALSBFMBSA-N 2 0 242.366 2.130 20 0 BEADRP Cc1ccc(CCC[NH2+][C@H]2CC[C@@H](C[NH3+])C2)cn1 ZINC000415027597 386517243 /nfs/dbraw/zinc/51/72/43/386517243.db2.gz BFYNOOJUHXUYPE-CABCVRRESA-N 2 0 247.386 2.040 20 0 BEADRP C[C@@H](CN1CCC[C@H]2C[NH2+]C[C@H]21)c1ccccc1 ZINC000414784889 386517898 /nfs/dbraw/zinc/51/78/98/386517898.db2.gz IDSXDVGHRJMCCU-CWRNSKLLSA-N 2 0 244.382 2.474 20 0 BEADRP COc1ccc(C)cc1C[NH2+][C@H]1CC[C@H](C[NH3+])C1 ZINC000415031128 386519277 /nfs/dbraw/zinc/51/92/77/386519277.db2.gz GMHFIIRHLJNYFK-JSGCOSHPSA-N 2 0 248.370 2.221 20 0 BEADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+]C/C=C/c2ccccc2)C1 ZINC000415032342 386519805 /nfs/dbraw/zinc/51/98/05/386519805.db2.gz IAJWTYTUFAKXBJ-HYBGQWMJSA-N 2 0 230.355 2.417 20 0 BEADRP [NH3+]C[C@H]1CC[C@H]([NH2+]Cc2cc(F)cc(F)c2)C1 ZINC000415034702 386521911 /nfs/dbraw/zinc/52/19/11/386521911.db2.gz KDNSOLMGGQRMNK-ZANVPECISA-N 2 0 240.297 2.182 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+][C@@H]1CCc2ccccc2C1 ZINC000414786467 386525755 /nfs/dbraw/zinc/52/57/55/386525755.db2.gz BHBPFGFGMCGDCL-CABCVRRESA-N 2 0 232.371 2.117 20 0 BEADRP C[C@H]1CCC[C@H]([NH2+]CC[C@H]2CCC[NH2+]2)C1 ZINC000414911623 386458116 /nfs/dbraw/zinc/45/81/16/386458116.db2.gz WYLWEBQTRLVCAW-XQQFMLRXSA-N 2 0 210.365 2.297 20 0 BEADRP CO[C@@H]1CCCC[C@H]1[NH2+]C1CCC(C[NH3+])CC1 ZINC000415074378 386574452 /nfs/dbraw/zinc/57/44/52/386574452.db2.gz CKUGCHMTHJCION-NWINJMCUSA-N 2 0 240.391 2.051 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@@H]1CCC[C@@H]1C(C)C ZINC000414799083 386574809 /nfs/dbraw/zinc/57/48/09/386574809.db2.gz RBHIHPVOVWAWOY-JHJVBQTASA-N 2 0 212.381 2.384 20 0 BEADRP CC(C)[C@H]([NH3+])CNCc1cccc(Cl)c1 ZINC000414797947 386582133 /nfs/dbraw/zinc/58/21/33/386582133.db2.gz PVRMXYQQZIMZGZ-GFCCVEGCSA-N 2 0 226.751 2.413 20 0 BEADRP C[C@@H](Cc1ccccc1F)[NH2+]CC(C)(C)[NH3+] ZINC000414800331 386586448 /nfs/dbraw/zinc/58/64/48/386586448.db2.gz HPNIMANFMGWWMM-JTQLQIEISA-N 2 0 224.323 2.084 20 0 BEADRP C[C@H]1C[C@H](C[NH2+]CCc2ccccc2)CC[NH2+]1 ZINC000415078735 386589555 /nfs/dbraw/zinc/58/95/55/386589555.db2.gz GWHAWWBSUBFZCM-DZGCQCFKSA-N 2 0 232.371 2.207 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+]C[C@H](C)Cc1ccccc1 ZINC000414801015 386591443 /nfs/dbraw/zinc/59/14/43/386591443.db2.gz SUNLWVPYHZRKPB-HIFRSBDPSA-N 2 0 234.387 2.438 20 0 BEADRP Cc1cccc(C)c1CC[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000415081588 386592312 /nfs/dbraw/zinc/59/23/12/386592312.db2.gz KKODZDHSCCUDNY-HNNXBMFYSA-N 2 0 246.398 2.435 20 0 BEADRP CC(C)([NH3+])C[NH2+]CCc1cccc(Cl)c1 ZINC000415083842 386595814 /nfs/dbraw/zinc/59/58/14/386595814.db2.gz FWKAEOWFEMORGK-UHFFFAOYSA-N 2 0 226.751 2.209 20 0 BEADRP CC[C@H](C)C[C@H](CC)[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000415045075 386532451 /nfs/dbraw/zinc/53/24/51/386532451.db2.gz VSRVTJDVWDMJPV-JZRPKSSGSA-N 2 0 210.365 2.009 20 0 BEADRP CC[C@H](C[C@@H](C)CC)[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000415045077 386532483 /nfs/dbraw/zinc/53/24/83/386532483.db2.gz VSRVTJDVWDMJPV-OBPIAQAESA-N 2 0 210.365 2.009 20 0 BEADRP CCOc1cccc(CNC[C@H]([NH3+])C(C)C)c1 ZINC000414802771 386596841 /nfs/dbraw/zinc/59/68/41/386596841.db2.gz VXCQERBGFIMXEQ-AWEZNQCLSA-N 2 0 236.359 2.158 20 0 BEADRP CC(C)C[C@H](C)C[NH2+]CCC[NH2+]C1CC1 ZINC000415064550 386543263 /nfs/dbraw/zinc/54/32/63/386543263.db2.gz CVOAQARYCMUQBO-LBPRGKRZSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)C1CCC1 ZINC000414918541 386546561 /nfs/dbraw/zinc/54/65/61/386546561.db2.gz UTTMZOABGIYFFC-DGCLKSJQSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H]1CC[C@H]([NH2+]CC2C[NH2+]C2)c2sccc21 ZINC000335463604 386547533 /nfs/dbraw/zinc/54/75/33/386547533.db2.gz YSOLHXNEMFQVFA-CABZTGNLSA-N 2 0 236.384 2.496 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCCC[C@H]1[C@H]1CC[NH2+]C1 ZINC000415053104 386553491 /nfs/dbraw/zinc/55/34/91/386553491.db2.gz NZOOVTCGKDKULK-IHRRRGAJSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H](CCC1CC1)[NH2+][C@@H]1CCCC[NH2+]C1 ZINC000415070317 386554999 /nfs/dbraw/zinc/55/49/99/386554999.db2.gz IFEDAHNWTXPLKG-WCQYABFASA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@@H]([NH2+]C1CCC(C[NH3+])CC1)[C@@H]1CCCO1 ZINC000415074629 386567180 /nfs/dbraw/zinc/56/71/80/386567180.db2.gz DAOQGSVKBNVUHZ-PQAZSJQKSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@H](CC1CCCCC1)[NH2+][C@@H]1CC[NH2+]C1 ZINC000415113012 386619870 /nfs/dbraw/zinc/61/98/70/386619870.db2.gz WAQKPITYUPOCQI-DGCLKSJQSA-N 2 0 210.365 2.297 20 0 BEADRP CCC1CCC([NH2+][C@@H](CN)C2CC2)CC1 ZINC000414809856 386620285 /nfs/dbraw/zinc/62/02/85/386620285.db2.gz URRQUVIITBEEMJ-GDKBPFBDSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1C[C@@H](C[NH2+][C@]2(C)CC=CCC2)CC[NH2+]1 ZINC000415103043 386623780 /nfs/dbraw/zinc/62/37/80/386623780.db2.gz BVFPMLPXDLSXAA-HZSPNIEDSA-N 2 0 222.376 2.463 20 0 BEADRP [NH3+]C1CCC([NH2+][C@@H]2CC[C@@H]2C2CC2)CC1 ZINC000335498783 386625386 /nfs/dbraw/zinc/62/53/86/386625386.db2.gz VSXXVXZKONRONQ-FIYWTHMPSA-N 2 0 208.349 2.035 20 0 BEADRP C[C@H]([NH2+]C1CCC([NH3+])CC1)C1CCSCC1 ZINC000335499412 386625473 /nfs/dbraw/zinc/62/54/73/386625473.db2.gz DOAAROJRPLNHSP-PKSQDBQZSA-N 2 0 242.432 2.378 20 0 BEADRP C1=C(C[NH2+]C2CCC3(CC3)CC2)CC[NH2+]C1 ZINC000335501370 386629649 /nfs/dbraw/zinc/62/96/49/386629649.db2.gz SCEACRFWBZFSAQ-UHFFFAOYSA-N 2 0 220.360 2.219 20 0 BEADRP C[NH2+]CCC[N@H+](C)C[C@@H]1C[C@H]1c1ccccc1 ZINC000415121519 386632530 /nfs/dbraw/zinc/63/25/30/386632530.db2.gz IJNQUQJOXFRXAN-GJZGRUSLSA-N 2 0 232.371 2.331 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CC[NH2+][C@@H](C)C1)c1cccc(O)c1 ZINC000415120494 386633617 /nfs/dbraw/zinc/63/36/17/386633617.db2.gz YGYLBVNMOIPSAQ-XQQFMLRXSA-N 2 0 248.370 2.431 20 0 BEADRP C[C@@H](C[NH2+][C@@H]1CCC12CCC2)C[NH+](C)C ZINC000336758915 386644276 /nfs/dbraw/zinc/64/42/76/386644276.db2.gz KXQGXZKTUSBWMS-NWDGAFQWSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCCc2c(F)cccc21)C1C[NH2+]C1 ZINC000335511439 386647333 /nfs/dbraw/zinc/64/73/33/386647333.db2.gz HXYRJXSWRKPBAB-ZUZCIYMTSA-N 2 0 248.345 2.401 20 0 BEADRP CCC([NH3+])(CC)C[NH2+][C@@H](COC)CC(C)C ZINC000414816251 386651652 /nfs/dbraw/zinc/65/16/52/386651652.db2.gz ZQPQRURSTJDGAV-GFCCVEGCSA-N 2 0 230.396 2.155 20 0 BEADRP CCC([NH3+])(CC)C[NH2+][C@H](COC)CC(C)C ZINC000414816252 386651794 /nfs/dbraw/zinc/65/17/94/386651794.db2.gz ZQPQRURSTJDGAV-LBPRGKRZSA-N 2 0 230.396 2.155 20 0 BEADRP CCc1ccccc1C[NH2+]C[C@]1(C)CC[NH2+]C1 ZINC000415082031 386599239 /nfs/dbraw/zinc/59/92/39/386599239.db2.gz LEOYVOMBYDZZGK-OAHLLOKOSA-N 2 0 232.371 2.338 20 0 BEADRP Cc1ccc(CC[NH2+][C@H](C)[C@H]2CC[NH2+]C2)c(C)c1 ZINC000415085437 386601201 /nfs/dbraw/zinc/60/12/01/386601201.db2.gz IEQUUNLPLJOHHA-ZBFHGGJFSA-N 2 0 246.398 2.434 20 0 BEADRP CC(C)C[NH2+]Cc1ccc([C@@H](C)[NH3+])cc1 ZINC000414801669 386602501 /nfs/dbraw/zinc/60/25/01/386602501.db2.gz AKFLQOSHRLCZMU-LLVKDONJSA-N 2 0 206.333 2.452 20 0 BEADRP CC(C)C[C@@H]([NH3+])C[NH2+]CCc1ccccc1F ZINC000415086640 386603959 /nfs/dbraw/zinc/60/39/59/386603959.db2.gz JVVHPSPVAQORJL-CYBMUJFWSA-N 2 0 238.350 2.331 20 0 BEADRP FCCC[N@@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000647978564 386606741 /nfs/dbraw/zinc/60/67/41/386606741.db2.gz UWORQOSCYUECBA-CHWSQXEVSA-N 2 0 228.355 2.058 20 0 BEADRP C[NH+](C)C1CCC([NH2+][C@@H]2COC(C)(C)C2)CC1 ZINC000335491993 386610434 /nfs/dbraw/zinc/61/04/34/386610434.db2.gz RAIBSARBFMLWIM-CPCZMJQVSA-N 2 0 240.391 2.016 20 0 BEADRP COc1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000414807759 386611372 /nfs/dbraw/zinc/61/13/72/386611372.db2.gz DCCOYKDBIKHULI-PBWFPOADSA-N 2 0 246.354 2.068 20 0 BEADRP CCOC[C@@H]([NH2+][C@H](C)CCCC[NH3+])C(C)C ZINC000336645493 386612417 /nfs/dbraw/zinc/61/24/17/386612417.db2.gz DCEWDNJSXMNSRB-CHWSQXEVSA-N 2 0 230.396 2.155 20 0 BEADRP C1CC2(CCCC2)[C@H]1[NH2+][C@H]1CCCC[NH2+]C1 ZINC000335493638 386614023 /nfs/dbraw/zinc/61/40/23/386614023.db2.gz BLIKMVGSHNTIKB-STQMWFEESA-N 2 0 222.376 2.441 20 0 BEADRP C[C@H]([NH2+]C1CCC(C[NH3+])CC1)c1ccccn1 ZINC000415096248 386614533 /nfs/dbraw/zinc/61/45/33/386614533.db2.gz ARALWFUIFVXNDB-HIFPTAJRSA-N 2 0 233.359 2.250 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CC[NH2+][C@H](C)C1)c1ccccn1 ZINC000415107419 386615993 /nfs/dbraw/zinc/61/59/93/386615993.db2.gz NYVMSLGNBBZDAF-AGIUHOORSA-N 2 0 233.359 2.120 20 0 BEADRP CC(C)([NH3+])C[NH2+][C@@H]1C[C@H]1C1CCCCC1 ZINC000415108047 386617418 /nfs/dbraw/zinc/61/74/18/386617418.db2.gz ONZJMJUVTPYVLH-NWDGAFQWSA-N 2 0 210.365 2.282 20 0 BEADRP C([NH2+][C@@H]1CCC12CCCC2)[C@H]1CCC[NH2+]C1 ZINC000335519372 386657051 /nfs/dbraw/zinc/65/70/51/386657051.db2.gz ORFCYKRNHMUYAR-QWHCGFSZSA-N 2 0 222.376 2.298 20 0 BEADRP Cc1ccc(CN2CC[C@@]3(CC[N@@H+](C)C3)C2)o1 ZINC000292691864 386709560 /nfs/dbraw/zinc/70/95/60/386709560.db2.gz BMVUYVOCJORSFN-CQSZACIVSA-N 2 0 234.343 2.116 20 0 BEADRP CSCC[C@@H](C)[N@H+](C)CC[C@@H]1CC[NH2+]C1 ZINC000156878845 386710928 /nfs/dbraw/zinc/71/09/28/386710928.db2.gz PBTJEQDQHUXRTC-NEPJUHHUSA-N 2 0 230.421 2.059 20 0 BEADRP Fc1cccc(F)c1C[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000414824551 386683657 /nfs/dbraw/zinc/68/36/57/386683657.db2.gz AVRDTEOLALPFCC-SNVBAGLBSA-N 2 0 240.297 2.054 20 0 BEADRP C[C@H](CCc1ccc(F)cc1)[NH2+]CC[C@H](C)[NH3+] ZINC000414823335 386685218 /nfs/dbraw/zinc/68/52/18/386685218.db2.gz OEBXHKWPAGSLDC-NWDGAFQWSA-N 2 0 238.350 2.474 20 0 BEADRP Cc1ccc(C[NH2+]CC[C@H](C)[NH3+])cc1Cl ZINC000414827812 386693791 /nfs/dbraw/zinc/69/37/91/386693791.db2.gz YLBLTPLSAPOMNZ-JTQLQIEISA-N 2 0 226.751 2.475 20 0 BEADRP COC[C@H](CC(C)C)[NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1 ZINC000414826204 386693831 /nfs/dbraw/zinc/69/38/31/386693831.db2.gz VDYFEDVHYVIHMY-MJBXVCDLSA-N 2 0 242.407 2.025 20 0 BEADRP Clc1ccsc1C[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000414826185 386695745 /nfs/dbraw/zinc/69/57/45/386695745.db2.gz DZGTXGSBHNONGF-VIFPVBQESA-N 2 0 244.791 2.491 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@@H](C)c1nccs1 ZINC000336648752 386698248 /nfs/dbraw/zinc/69/82/48/386698248.db2.gz GPXYATAARUKJPL-GHMZBOCLSA-N 2 0 241.404 2.354 20 0 BEADRP CCOc1cccc(C[NH2+]CC[C@H]2CC[NH2+]C2)c1 ZINC000414831677 386713733 /nfs/dbraw/zinc/71/37/33/386713733.db2.gz NKVLTLGSXSFKTQ-CYBMUJFWSA-N 2 0 248.370 2.175 20 0 BEADRP C(C[C@H]1CC[NH2+]C1)[NH2+][C@H]1CCC[C@@H]1C1CC1 ZINC000414833750 386714440 /nfs/dbraw/zinc/71/44/40/386714440.db2.gz QAXOQTVIMOEPTI-BNOWGMLFSA-N 2 0 222.376 2.154 20 0 BEADRP Cc1ccc(C[NH2+]C2CC[NH2+]CC2)cc1Cl ZINC000335484934 386715390 /nfs/dbraw/zinc/71/53/90/386715390.db2.gz XSOAKQQALARFBP-UHFFFAOYSA-N 2 0 238.762 2.490 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CCC[C@H]1C1CC1 ZINC000414832180 386716717 /nfs/dbraw/zinc/71/67/17/386716717.db2.gz FAFCOMXZRHJONC-WCFLWFBJSA-N 2 0 210.365 2.010 20 0 BEADRP CC(C)CC[C@@H]1CCCC[N@@H+]1CCOCC[NH3+] ZINC000357099865 386716793 /nfs/dbraw/zinc/71/67/93/386716793.db2.gz DOZINYJNENRKLK-AWEZNQCLSA-N 2 0 242.407 2.252 20 0 BEADRP C1CC1[C@H]1CCC[C@@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000414831928 386717196 /nfs/dbraw/zinc/71/71/96/386717196.db2.gz QJWSLNRTYNZUIC-WQGXVZNYSA-N 2 0 234.387 2.438 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CC[C@@H]2CC[NH2+]C2)C[C@@H](C)C1 ZINC000414832262 386718188 /nfs/dbraw/zinc/71/81/88/386718188.db2.gz OGUIDLYWPUWSJZ-RFQIPJPRSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C2CCC3(CC3)CC2)CC[NH2+]1 ZINC000335540279 386721076 /nfs/dbraw/zinc/72/10/76/386721076.db2.gz ZZWWUXWHZMFRNT-DGCLKSJQSA-N 2 0 222.376 2.439 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H](C)CCC(F)(F)F ZINC000414839740 386746571 /nfs/dbraw/zinc/74/65/71/386746571.db2.gz MOWRJAMVIJLKOF-IUCAKERBSA-N 2 0 226.286 2.163 20 0 BEADRP CC[C@H](Cc1ccccc1)[NH2+]C[C@@H]1CCC[NH2+]1 ZINC000414841881 386747742 /nfs/dbraw/zinc/74/77/42/386747742.db2.gz IFSIESOFPUGREP-CABCVRRESA-N 2 0 232.371 2.349 20 0 BEADRP c1ccc([C@@H]2C[C@H]2C[NH2+]C[C@@H]2CCC[NH2+]2)cc1 ZINC000414841328 386753712 /nfs/dbraw/zinc/75/37/12/386753712.db2.gz HURDCLIMVVYCSP-KKUMJFAQSA-N 2 0 230.355 2.132 20 0 BEADRP Cc1ncn(Cc2cnccc2C)c1C ZINC000334155492 386755365 /nfs/dbraw/zinc/75/53/65/386755365.db2.gz VMBRSPRXHSTSRJ-UHFFFAOYSA-N 2 0 201.273 2.252 20 0 BEADRP C[C@@H]1C[C@H]1C[N@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000348869825 386762830 /nfs/dbraw/zinc/76/28/30/386762830.db2.gz PLSOTKJEAXKTNY-ZBBUEOHVSA-N 2 0 222.376 2.199 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CCC[NH2+]C1)C1CCC1 ZINC000414842627 386763080 /nfs/dbraw/zinc/76/30/80/386763080.db2.gz PFRIMCCHLWDATN-VXGBXAGGSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCC[NH2+]C1)C1CCC1 ZINC000414842623 386763410 /nfs/dbraw/zinc/76/34/10/386763410.db2.gz PFRIMCCHLWDATN-NWDGAFQWSA-N 2 0 210.365 2.154 20 0 BEADRP CC(C)C1CC([NH2+][C@H]2CC[NH2+][C@H](C)C2)C1 ZINC000335537780 386741367 /nfs/dbraw/zinc/74/13/67/386741367.db2.gz FGWZNHNNXHASTD-IGJPJIBNSA-N 2 0 210.365 2.151 20 0 BEADRP Cc1ccc(C[N@H+]2C[C@@H](C[NH3+])C[C@@H]2C)cc1 ZINC000122317198 386741699 /nfs/dbraw/zinc/74/16/99/386741699.db2.gz VYKQNWNZIKLTBF-GXTWGEPZSA-N 2 0 218.344 2.164 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+]C[C@@H](N)c1ccccc1 ZINC000414839304 386741818 /nfs/dbraw/zinc/74/18/18/386741818.db2.gz VYQOOWUMTRCRPP-BNOWGMLFSA-N 2 0 218.344 2.465 20 0 BEADRP [NH3+]C[C@H]1CCC[N@@H+]([C@H]2CCc3ccc(F)cc32)C1 ZINC000334143455 386742107 /nfs/dbraw/zinc/74/21/07/386742107.db2.gz RPLZIDFDKHDAFR-ABAIWWIYSA-N 2 0 248.345 2.484 20 0 BEADRP C[C@@H]1CCC[C@H]1[NH2+]C[C@H](N)c1ccccc1 ZINC000414839308 386742247 /nfs/dbraw/zinc/74/22/47/386742247.db2.gz VYQOOWUMTRCRPP-KWCYVHTRSA-N 2 0 218.344 2.465 20 0 BEADRP COc1ccc(C[N@H+](C)CC(C)(C)C[NH3+])cc1 ZINC000051253270 386778808 /nfs/dbraw/zinc/77/88/08/386778808.db2.gz HRKFXVOPHIJYQZ-UHFFFAOYSA-N 2 0 236.359 2.112 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCCC[C@H]1C)C[NH+](C)C ZINC000336668030 386785065 /nfs/dbraw/zinc/78/50/65/386785065.db2.gz DZHODBGSMGUHAD-UPJWGTAASA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+][C@@H]1CC[NH2+]C[C@H]1C ZINC000414933274 386787256 /nfs/dbraw/zinc/78/72/56/386787256.db2.gz DLNKPLWWVPATLC-OPRDCNLKSA-N 2 0 238.297 2.305 20 0 BEADRP COc1cc(C[NH2+][C@H]2CC[NH2+]C[C@H]2C)ccc1C ZINC000414933239 386787797 /nfs/dbraw/zinc/78/77/97/386787797.db2.gz DJXUDISQLUHSTQ-OCCSQVGLSA-N 2 0 248.370 2.091 20 0 BEADRP CC(C)(C)[NH+]1CCC([NH2+]CCCCCO)CC1 ZINC000192923155 386797265 /nfs/dbraw/zinc/79/72/65/386797265.db2.gz WJVPCISPLJOUQX-UHFFFAOYSA-N 2 0 242.407 2.002 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+]C[C@@H](C)CC1CCOCC1 ZINC000414935147 386806597 /nfs/dbraw/zinc/80/65/97/386806597.db2.gz AODNPXWOZNQGCK-QWHCGFSZSA-N 2 0 242.407 2.027 20 0 BEADRP CC(C)c1nccc(NC[C@@H]2CCC[N@H+](C)C2)n1 ZINC000301286596 386831440 /nfs/dbraw/zinc/83/14/40/386831440.db2.gz VKLGEBZTTQPWOW-LBPRGKRZSA-N 2 0 248.374 2.354 20 0 BEADRP CC[C@H]([NH2+]C1CC[NH2+]CC1)c1ccccc1 ZINC000051627186 386835625 /nfs/dbraw/zinc/83/56/25/386835625.db2.gz PPBHFODBIZQQTB-AWEZNQCLSA-N 2 0 218.344 2.479 20 0 BEADRP CCCC[N@H+](C)C[C@@H](C)Nc1cc[nH+]c(C)c1 ZINC000341117301 386839943 /nfs/dbraw/zinc/83/99/43/386839943.db2.gz JTRJVKKXJBGBIW-CYBMUJFWSA-N 2 0 235.375 2.344 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H]2CC[C@@H]2SC)C1 ZINC000425339401 386840225 /nfs/dbraw/zinc/84/02/25/386840225.db2.gz CMWXOWQZOJUBOP-AGIUHOORSA-N 2 0 242.432 2.202 20 0 BEADRP [NH3+][C@H]1CCN([C@H]2CCCc3ccc(F)cc32)C1 ZINC000334783774 386842312 /nfs/dbraw/zinc/84/23/12/386842312.db2.gz BTNOPDFOIVJMJX-JSGCOSHPSA-N 2 0 234.318 2.236 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C/C=C/c2ccccc2)CC[NH2+]1 ZINC000414942460 386891617 /nfs/dbraw/zinc/89/16/17/386891617.db2.gz DNAQQCYVDJKOBX-IEOKHJKGSA-N 2 0 230.355 2.430 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C/C=C\c2ccccc2)CC[NH2+]1 ZINC000414942462 386891798 /nfs/dbraw/zinc/89/17/98/386891798.db2.gz DNAQQCYVDJKOBX-VZFGUZNESA-N 2 0 230.355 2.430 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCCC[C@@H]1C[NH3+])C1CC1 ZINC000324313614 386871816 /nfs/dbraw/zinc/87/18/16/386871816.db2.gz NASPJRMKEDEWDP-FRRDWIJNSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)C[C@H](C)C[NH2+][C@@H]1CC[NH2+]C[C@@H]1C ZINC000414940183 386877631 /nfs/dbraw/zinc/87/76/31/386877631.db2.gz JYXYXAAPVRMMKC-RWMBFGLXSA-N 2 0 212.381 2.256 20 0 BEADRP CC(C)C[C@H](C)C[NH2+][C@H]1CC[NH2+]C[C@@H]1C ZINC000414940181 386877692 /nfs/dbraw/zinc/87/76/92/386877692.db2.gz JYXYXAAPVRMMKC-AVGNSLFASA-N 2 0 212.381 2.256 20 0 BEADRP CC1CCC([NH2+][C@@H]2CC[C@H](C[NH3+])C2)CC1 ZINC000334863382 386917626 /nfs/dbraw/zinc/91/76/26/386917626.db2.gz MWKQCUKLDSPZTG-PYNQCMFNSA-N 2 0 210.365 2.282 20 0 BEADRP Cc1cc(C)cc(C[NH2+][C@H]2CC[NH2+]C[C@@H]2C)c1 ZINC000334858378 386911021 /nfs/dbraw/zinc/91/10/21/386911021.db2.gz SDBFCFCLHZKOOS-ZFWWWQNUSA-N 2 0 232.371 2.391 20 0 BEADRP Cc1ccc(F)cc1C[NH2+][C@@H]1CC[NH2+]C[C@H]1C ZINC000334859676 386913131 /nfs/dbraw/zinc/91/31/31/386913131.db2.gz ZXHQTXOXTWHVNW-BXUZGUMPSA-N 2 0 236.334 2.222 20 0 BEADRP C[C@H]([NH2+]CC1=CC[N@H+](C)CC1)C(C)(C)C ZINC000336762211 386920798 /nfs/dbraw/zinc/92/07/98/386920798.db2.gz NXYWDZLJYGTDLC-NSHDSACASA-N 2 0 210.365 2.273 20 0 BEADRP C[C@H]1C[C@@H](C[N@@H+]2CCCC23CCC3)CC[NH2+]1 ZINC000334816834 386943875 /nfs/dbraw/zinc/94/38/75/386943875.db2.gz BXKZKMZPOMJAIM-STQMWFEESA-N 2 0 222.376 2.393 20 0 BEADRP C[N@H+](CCCCCF)C[C@@H]1CCC[NH+](C)C1 ZINC000341883277 386986014 /nfs/dbraw/zinc/98/60/14/386986014.db2.gz NUFWCLGHQZKPSB-ZDUSSCGKSA-N 2 0 230.371 2.400 20 0 BEADRP Cc1ccc(CN[C@@H]2CC[N@@H+](C)C[C@H]2C)nc1C ZINC000314760255 386997879 /nfs/dbraw/zinc/99/78/79/386997879.db2.gz KASJLUQPKGJINY-IUODEOHRSA-N 2 0 247.386 2.128 20 0 BEADRP [NH3+]CC[C@H]1CCC[N@H+](CCc2ccccc2)C1 ZINC000070074085 387043828 /nfs/dbraw/zinc/04/38/28/387043828.db2.gz BVNPENLXFKTULE-OAHLLOKOSA-N 2 0 232.371 2.290 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@@H]([C@@H](C)[NH3+])C2)c(C)c1 ZINC000126793270 387049060 /nfs/dbraw/zinc/04/90/60/387049060.db2.gz LLTNFRPXZNJWMF-UKRRQHHQSA-N 2 0 232.371 2.473 20 0 BEADRP [NH3+]CC[C@H]1CCC[N@H+](CCOc2ccccc2)C1 ZINC000070533448 387067175 /nfs/dbraw/zinc/06/71/75/387067175.db2.gz VPJKLIRPBAFYLU-CQSZACIVSA-N 2 0 248.370 2.126 20 0 BEADRP c1ccc2[nH]c(NCC[C@@H]3CCC[NH2+]C3)nc2c1 ZINC000110793433 387068752 /nfs/dbraw/zinc/06/87/52/387068752.db2.gz OADWVPUMJQVGHY-NSHDSACASA-N 2 0 244.342 2.365 20 0 BEADRP C[N@H+](CCC1CC[NH2+]CC1)C(C1CC1)C1CC1 ZINC000359224888 387069280 /nfs/dbraw/zinc/06/92/80/387069280.db2.gz TXJFZVICBZICFM-UHFFFAOYSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]([NH3+])[C@@H]1CC[N@H+](CCCc2ccccc2)C1 ZINC000165980508 387072508 /nfs/dbraw/zinc/07/25/08/387072508.db2.gz XEVXFIWERNPMFQ-UKRRQHHQSA-N 2 0 232.371 2.288 20 0 BEADRP COCc1cccc(C[N@@H+]2CC[C@@H]([C@H](C)[NH3+])C2)c1 ZINC000126929612 387074451 /nfs/dbraw/zinc/07/44/51/387074451.db2.gz SABPAEWTOLOIJM-SWLSCSKDSA-N 2 0 248.370 2.002 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H]1CCCNc2ccccc21 ZINC000423299537 387130368 /nfs/dbraw/zinc/13/03/68/387130368.db2.gz BUEHPTDVMVUDME-BXUZGUMPSA-N 2 0 233.359 2.118 20 0 BEADRP CC[C@H](COC)[NH2+]CCC[N@@H+]1CCCC[C@H]1C ZINC000246366416 387079874 /nfs/dbraw/zinc/07/98/74/387079874.db2.gz LUMXGLFRGMPURO-ZIAGYGMSSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H]1CCC[C@H]1CCCF ZINC000423298520 387130736 /nfs/dbraw/zinc/13/07/36/387130736.db2.gz AJUMHPXKAGJQEG-GRYCIOLGSA-N 2 0 216.344 2.089 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](Cc3cccc(F)c3)C[C@H]21 ZINC000228476401 387087777 /nfs/dbraw/zinc/08/77/77/387087777.db2.gz WBTDBTBXAMNBMC-BPLDGKMQSA-N 2 0 248.345 2.385 20 0 BEADRP CC[C@@H]1CC[C@H](C)C[C@@H]1[NH2+]C[C@H](C)C[NH3+] ZINC000423299909 387131338 /nfs/dbraw/zinc/13/13/38/387131338.db2.gz CQHQTWTXEIYSNU-LOWDOPEQSA-N 2 0 212.381 2.386 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+]CC1=CCCCC1 ZINC000335004787 387099446 /nfs/dbraw/zinc/09/94/46/387099446.db2.gz GAXYEUKHVRWNLV-GXTWGEPZSA-N 2 0 222.376 2.465 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]C1CC(F)(F)C1 ZINC000335006089 387099775 /nfs/dbraw/zinc/09/97/75/387099775.db2.gz ANDKQAQMGQQJLG-NXEZZACHSA-N 2 0 218.291 2.034 20 0 BEADRP c1ccc(CC[NH+]2CCC3(CC[NH2+]3)CC2)cc1 ZINC000335006665 387100604 /nfs/dbraw/zinc/10/06/04/387100604.db2.gz MFMQVKBIWQIBGE-UHFFFAOYSA-N 2 0 230.355 2.057 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]C1CCC2(CC2)CC1 ZINC000335007135 387101283 /nfs/dbraw/zinc/10/12/83/387101283.db2.gz FOXSRJAFCZKDQA-AAEUAGOBSA-N 2 0 222.376 2.426 20 0 BEADRP CC[C@H]1CC[C@H]1[NH2+]CC1CC[NH+](C)CC1 ZINC000336766196 387102487 /nfs/dbraw/zinc/10/24/87/387102487.db2.gz RKOSTJQRYWNFKZ-QWHCGFSZSA-N 2 0 210.365 2.106 20 0 BEADRP CO[C@@H]1CC[C@@H]([NH2+]C2CC[NH+](C(C)C)CC2)C1 ZINC000188799385 387104270 /nfs/dbraw/zinc/10/42/70/387104270.db2.gz XYWUTYSOLVQBGF-ZIAGYGMSSA-N 2 0 240.391 2.016 20 0 BEADRP C1CC12CCC([NH2+][C@@H]1CCC[NH2+]CC1)CC2 ZINC000335010794 387105932 /nfs/dbraw/zinc/10/59/32/387105932.db2.gz PPWYEGVZKVHRKJ-GFCCVEGCSA-N 2 0 222.376 2.441 20 0 BEADRP C1CC2(CCCC2)[C@H]1[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000335011842 387106884 /nfs/dbraw/zinc/10/68/84/387106884.db2.gz VXMTVMDPVLDCJX-OLZOCXBDSA-N 2 0 222.376 2.441 20 0 BEADRP CC[C@@H]1CC[C@H](C)C[C@H]1[NH2+]C[C@@H](C)C[NH3+] ZINC000423299912 387131760 /nfs/dbraw/zinc/13/17/60/387131760.db2.gz CQHQTWTXEIYSNU-WUHRBBMRSA-N 2 0 212.381 2.386 20 0 BEADRP CC[C@@H]1CCCCN1CC[NH2+]C1CCOCC1 ZINC000062767648 387115231 /nfs/dbraw/zinc/11/52/31/387115231.db2.gz PBPPVYZAHWEPQZ-CQSZACIVSA-N 2 0 240.391 2.020 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]CC12CCC(CC1)C2 ZINC000335024961 387115709 /nfs/dbraw/zinc/11/57/09/387115709.db2.gz RAGZAGWQWXGWKD-QZQSVVMZSA-N 2 0 208.349 2.036 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]Cc1ccccc1 ZINC000335024914 387117303 /nfs/dbraw/zinc/11/73/03/387117303.db2.gz PMGFEVZELPQVIY-TZMCWYRMSA-N 2 0 218.344 2.164 20 0 BEADRP C[C@H]1CC(C)(C)C[C@H]1[NH2+]CC1([NH3+])CCC1 ZINC000335026113 387119249 /nfs/dbraw/zinc/11/92/49/387119249.db2.gz XBLSMWFWSCGTIS-WDEREUQCSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]C1CCC(F)(F)CC1 ZINC000335028649 387122088 /nfs/dbraw/zinc/12/20/88/387122088.db2.gz XTVUNFJAGIUUKQ-MWLCHTKSSA-N 2 0 232.318 2.281 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]C[C@@H]2CC2(C)C)CC1 ZINC000228821500 387122589 /nfs/dbraw/zinc/12/25/89/387122589.db2.gz JLZJNAXSRYRCCP-LBPRGKRZSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCCC(C)(C)C1)C1C[NH2+]C1 ZINC000335030497 387124994 /nfs/dbraw/zinc/12/49/94/387124994.db2.gz QCSYZEHNMGILLR-CMPLNLGQSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@H]([NH2+]C[C@@H](C)C[NH3+])c1ccccc1F ZINC000423299012 387128853 /nfs/dbraw/zinc/12/88/53/387128853.db2.gz BGSGCSSTIBNKHJ-GWCFXTLKSA-N 2 0 224.323 2.461 20 0 BEADRP Cc1csc(C[NH2+]C[C@H]2CCC[C@H]([NH3+])C2)n1 ZINC000070503303 387067619 /nfs/dbraw/zinc/06/76/19/387067619.db2.gz BNLPELABTYDWGD-QWRGUYRKSA-N 2 0 239.388 2.059 20 0 BEADRP CC(C)CC[C@H]([NH2+]C[C@@H](C)C[NH3+])C1CC1 ZINC000423306061 387141511 /nfs/dbraw/zinc/14/15/11/387141511.db2.gz LDAFPLXTWKVSNE-AAEUAGOBSA-N 2 0 212.381 2.386 20 0 BEADRP Cc1ccc(C)c([C@@H](C)[NH2+]CC2C[NH2+]C2)c1 ZINC000423306700 387141586 /nfs/dbraw/zinc/14/15/86/387141586.db2.gz UFPXCMBQAZSUQP-GFCCVEGCSA-N 2 0 218.344 2.173 20 0 BEADRP C[C@H](Cc1ccc(Cl)cc1)[NH2+]CC1C[NH2+]C1 ZINC000423306141 387142180 /nfs/dbraw/zinc/14/21/80/387142180.db2.gz SCBNWHIYMONQRZ-SNVBAGLBSA-N 2 0 238.762 2.080 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@@H](C1CC1)C1CCCC1 ZINC000423308533 387144036 /nfs/dbraw/zinc/14/40/36/387144036.db2.gz OREDLPKICYYART-GXFFZTMASA-N 2 0 210.365 2.140 20 0 BEADRP CC[C@H]1CCCC[C@@H]1[NH2+]CC1=CC[NH2+]CC1 ZINC000423344380 387192457 /nfs/dbraw/zinc/19/24/57/387192457.db2.gz MSKSSUVTSBHVJH-KBPBESRZSA-N 2 0 222.376 2.465 20 0 BEADRP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[NH2+]1)C1CCCC1 ZINC000400378477 387149918 /nfs/dbraw/zinc/14/99/18/387149918.db2.gz JMFGYNGFYSLMHM-GVXVVHGQSA-N 2 0 210.365 2.295 20 0 BEADRP CCC[NH2+]CC[NH2+][C@@H](C1CC1)C1CCC1 ZINC000423315813 387156537 /nfs/dbraw/zinc/15/65/37/387156537.db2.gz XPFODFKEPVDJSI-CYBMUJFWSA-N 2 0 210.365 2.154 20 0 BEADRP CCC[C@H]([NH2+]CC1([NH3+])CCC1)C1CCC1 ZINC000423317479 387159261 /nfs/dbraw/zinc/15/92/61/387159261.db2.gz BMZRFWKPFAQTFZ-LBPRGKRZSA-N 2 0 210.365 2.426 20 0 BEADRP [NH3+][C@@H](C[NH2+][C@@H](C1CC1)C1CCCC1)C1CC1 ZINC000423320662 387162302 /nfs/dbraw/zinc/16/23/02/387162302.db2.gz MJOROROILCQEGO-UONOGXRCSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]Cc1cc(F)c(F)c(F)c1 ZINC000571762296 387163296 /nfs/dbraw/zinc/16/32/96/387163296.db2.gz GGMPURCQBQJZEU-SFYZADRCSA-N 2 0 246.276 2.319 20 0 BEADRP C[C@@H]([NH2+]CCCC[NH3+])c1cc(F)c(F)c(F)c1 ZINC000423321798 387166013 /nfs/dbraw/zinc/16/60/13/387166013.db2.gz GBDBUMSEZBMCMN-MRVPVSSYSA-N 2 0 246.276 2.493 20 0 BEADRP C[C@@H]([NH2+]CCCC[NH3+])c1ccccc1N(C)C ZINC000423321829 387166159 /nfs/dbraw/zinc/16/61/59/387166159.db2.gz HQJXFPQAKWSXCB-GFCCVEGCSA-N 2 0 235.375 2.142 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H]([NH3+])C1CC1)c1ccccc1 ZINC000423329457 387171985 /nfs/dbraw/zinc/17/19/85/387171985.db2.gz SVBLGIZMMOAARL-ZIAGYGMSSA-N 2 0 218.344 2.465 20 0 BEADRP Cc1c[nH+]ccc1NC[C@@H]1[N@H+](C)CCCC1(C)C ZINC000359835367 387174363 /nfs/dbraw/zinc/17/43/63/387174363.db2.gz JKRYCIIZJIHIFA-AWEZNQCLSA-N 2 0 247.386 2.344 20 0 BEADRP [NH3+]C1(C[NH2+][C@H]2CCC[C@H]2CCCF)CCC1 ZINC000423330700 387174742 /nfs/dbraw/zinc/17/47/42/387174742.db2.gz PSXYDQUJOKDLMT-RYUDHWBXSA-N 2 0 228.355 2.376 20 0 BEADRP CC(C)[C@@H]([NH2+]CC1=CC[NH2+]CC1)c1cccnc1 ZINC000423331928 387177356 /nfs/dbraw/zinc/17/73/56/387177356.db2.gz DEKVTTXAPUAAJX-OAHLLOKOSA-N 2 0 245.370 2.288 20 0 BEADRP Cc1cc(N[C@H]2CC[N@H+](C)[C@@H](C)C2)cc[nH+]1 ZINC000229570615 387178790 /nfs/dbraw/zinc/17/87/90/387178790.db2.gz QNOOKMGNGHWKDP-AAEUAGOBSA-N 2 0 219.332 2.285 20 0 BEADRP [NH3+]C1(C[NH2+]C2C3CC4CC(C3)CC2C4)CCC1 ZINC000423332030 387179149 /nfs/dbraw/zinc/17/91/49/387179149.db2.gz QLPUTFHEUFMQPI-UHFFFAOYSA-N 2 0 234.387 2.282 20 0 BEADRP C[C@@H](CCC1CC1)[NH2+]CC1=CC[NH2+]CC1 ZINC000423344496 387193751 /nfs/dbraw/zinc/19/37/51/387193751.db2.gz MZKOJDPIHZICPR-NSHDSACASA-N 2 0 208.349 2.074 20 0 BEADRP Cc1cc(N[C@@H]2CC[N@H+](C)[C@H](C)C2)cc[nH+]1 ZINC000229570591 387179718 /nfs/dbraw/zinc/17/97/18/387179718.db2.gz QNOOKMGNGHWKDP-DGCLKSJQSA-N 2 0 219.332 2.285 20 0 BEADRP CCC1CC([NH2+]CC2(C)CC[NH2+]CC2)C1 ZINC000423333532 387181052 /nfs/dbraw/zinc/18/10/52/387181052.db2.gz QAIRAIDCCILIMO-UHFFFAOYSA-N 2 0 210.365 2.154 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H](C)c1ccccc1N(C)C ZINC000571872866 387183301 /nfs/dbraw/zinc/18/33/01/387183301.db2.gz HTNVLZWCDVMBQD-ZDUSSCGKSA-N 2 0 249.402 2.403 20 0 BEADRP COc1ccc([C@@H](C)[NH2+]CCCC[NH3+])c(C)c1 ZINC000423337426 387184970 /nfs/dbraw/zinc/18/49/70/387184970.db2.gz VOUXFNUQVUYFQD-GFCCVEGCSA-N 2 0 236.359 2.393 20 0 BEADRP C[C@H](CCCc1cccnc1)[NH2+]CCCC[NH3+] ZINC000423337424 387186058 /nfs/dbraw/zinc/18/60/58/387186058.db2.gz VOPGILDCQOCHPU-CYBMUJFWSA-N 2 0 235.375 2.121 20 0 BEADRP C[C@@H]1CCC[C@H](C)[C@H]1[NH2+]C[C@@H]([NH3+])C1CC1 ZINC000423339282 387187147 /nfs/dbraw/zinc/18/71/47/387187147.db2.gz ZMEMOJQURZFHJW-DNIRFERGSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@H]([NH2+]CC1=CC[NH2+]CC1)c1ccccc1F ZINC000423338631 387187176 /nfs/dbraw/zinc/18/71/76/387187176.db2.gz IEBHAVUSJLYHHO-NSHDSACASA-N 2 0 234.318 2.396 20 0 BEADRP CC[C@@H]1CC[C@@H](C)C[C@H]1[NH2+]CC1C[NH2+]C1 ZINC000423339203 387188031 /nfs/dbraw/zinc/18/80/31/387188031.db2.gz ZIZDSPBOUYEDGA-RAIGVLPGSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@H]([NH2+]CC1(C)CC[NH2+]CC1)[C@@H]1CC1(C)C ZINC000423341596 387189575 /nfs/dbraw/zinc/18/95/75/387189575.db2.gz WNDACFGUWWSBRO-RYUDHWBXSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H]([NH2+]CC1(C)CC[NH2+]CC1)[C@H]1CC1(C)C ZINC000423341595 387190856 /nfs/dbraw/zinc/19/08/56/387190856.db2.gz WNDACFGUWWSBRO-NWDGAFQWSA-N 2 0 224.392 2.400 20 0 BEADRP CCCC[C@@H]1CCC[C@H]1[NH2+]CC1C[NH2+]C1 ZINC000423301271 387133132 /nfs/dbraw/zinc/13/31/32/387133132.db2.gz HBIPVSNNTQHOGL-CHWSQXEVSA-N 2 0 210.365 2.154 20 0 BEADRP CC(C)[C@@H]1CC[C@H]([NH2+]CC2C[NH2+]C2)C[C@H]1C ZINC000423302464 387134752 /nfs/dbraw/zinc/13/47/52/387134752.db2.gz JPFFPZAIMOHQJT-XBFCOCLRSA-N 2 0 224.392 2.256 20 0 BEADRP CC(C)[C@H](Cc1ccccc1)[NH2+]CC1C[NH2+]C1 ZINC000423302752 387135155 /nfs/dbraw/zinc/13/51/55/387135155.db2.gz KGZHNATZTNZEQR-HNNXBMFYSA-N 2 0 232.371 2.063 20 0 BEADRP Clc1ccc2c(c1)[C@@H]([NH2+]CC1C[NH2+]C1)CC2 ZINC000423302759 387135275 /nfs/dbraw/zinc/13/52/75/387135275.db2.gz KHSFHOGDIGMXCD-ZDUSSCGKSA-N 2 0 236.746 2.136 20 0 BEADRP Cc1cccc(CC[C@H](C)[NH2+]CC2C[NH2+]C2)c1 ZINC000423302139 387135462 /nfs/dbraw/zinc/13/54/62/387135462.db2.gz IXQIHOYGAPRNDZ-ZDUSSCGKSA-N 2 0 232.371 2.125 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]([NH2+]CC2C[NH2+]C2)C[C@H]1C ZINC000423302462 387135559 /nfs/dbraw/zinc/13/55/59/387135559.db2.gz JPFFPZAIMOHQJT-BNOWGMLFSA-N 2 0 224.392 2.256 20 0 BEADRP CCc1ccc([C@@H](C)[NH2+]CC2C[NH2+]C2)s1 ZINC000423304287 387136815 /nfs/dbraw/zinc/13/68/15/387136815.db2.gz NTQKEIHDKSFNMQ-SECBINFHSA-N 2 0 224.373 2.181 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+]C[C@@H](C)C[NH3+])[C@@H](C)C2 ZINC000423302987 387137415 /nfs/dbraw/zinc/13/74/15/387137415.db2.gz IGLUTSJYWZEFKX-SLEUVZQESA-N 2 0 232.371 2.413 20 0 BEADRP C[C@@H]([NH2+]CC1C[NH2+]C1)c1ccc2c(c1)CCCC2 ZINC000423305251 387139102 /nfs/dbraw/zinc/13/91/02/387139102.db2.gz QFOLQPNNZXLDCV-GFCCVEGCSA-N 2 0 244.382 2.435 20 0 BEADRP CCC[NH2+]CC[NH2+][C@@H](C)CC(C)(C)C ZINC000423305065 387140200 /nfs/dbraw/zinc/14/02/00/387140200.db2.gz AUOLTMFHHMLUDF-NSHDSACASA-N 2 0 200.370 2.400 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@H](c1ccc(F)cc1)C1CC1 ZINC000423304357 387140632 /nfs/dbraw/zinc/14/06/32/387140632.db2.gz YLEVYPPEJCRYPM-HZMBPMFUSA-N 2 0 236.334 2.461 20 0 BEADRP C[C@@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)c1cccnc1 ZINC000423351170 387203329 /nfs/dbraw/zinc/20/33/29/387203329.db2.gz YQHMLPQYSROWQJ-TZMCWYRMSA-N 2 0 233.359 2.122 20 0 BEADRP C1=C(C[NH2+][C@@H](C2CC2)C2CCC2)CC[NH2+]C1 ZINC000423351769 387203517 /nfs/dbraw/zinc/20/35/17/387203517.db2.gz IZRQVQGRKGPNTE-CQSZACIVSA-N 2 0 220.360 2.074 20 0 BEADRP C1=C(C[NH2+][C@H]2CC[C@H]2C2CCC2)CC[NH2+]C1 ZINC000423356408 387207371 /nfs/dbraw/zinc/20/73/71/387207371.db2.gz QOQIOLLPBBPMIM-KBPBESRZSA-N 2 0 220.360 2.074 20 0 BEADRP FCC[C@H]1CCC[C@H]1[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000423359017 387209541 /nfs/dbraw/zinc/20/95/41/387209541.db2.gz OPJTXJUGVCGZGO-JHJVBQTASA-N 2 0 228.355 2.246 20 0 BEADRP C[C@@H](CC(C)(C)C)[NH2+]CC1=CC[NH2+]CC1 ZINC000423362111 387213993 /nfs/dbraw/zinc/21/39/93/387213993.db2.gz XLVDGEQJEBBWHT-NSHDSACASA-N 2 0 210.365 2.320 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CCC23CCC3)CC[NH2+]1 ZINC000423367301 387217935 /nfs/dbraw/zinc/21/79/35/387217935.db2.gz ADJVCKYKFPPFDF-UTUOFQBUSA-N 2 0 208.349 2.049 20 0 BEADRP CC[C@@H](Cc1cccs1)[NH2+]CCC[NH3+] ZINC000643496683 387217936 /nfs/dbraw/zinc/21/79/36/387217936.db2.gz AFXKDERSJQAVMU-JTQLQIEISA-N 2 0 212.362 2.008 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)[C@@H]1CC1(C)C ZINC000423368974 387220281 /nfs/dbraw/zinc/22/02/81/387220281.db2.gz BMMPSGBDYIQTDR-KKOKHZNYSA-N 2 0 210.365 2.151 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)[C@@H]1C[C@H]1C ZINC000423368513 387220525 /nfs/dbraw/zinc/22/05/25/387220525.db2.gz BANWUWMLPXQWMB-VEGXAWMVSA-N 2 0 210.365 2.151 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)[C@@H]1C[C@@H]1C ZINC000423368509 387221074 /nfs/dbraw/zinc/22/10/74/387221074.db2.gz BANWUWMLPXQWMB-CLPYTZEMSA-N 2 0 210.365 2.151 20 0 BEADRP COCCC[C@@H](C)[NH2+]C[C@H]1CC[C@H](C[NH3+])CC1 ZINC000423427959 387253016 /nfs/dbraw/zinc/25/30/16/387253016.db2.gz QXFRZISSCBHDAW-MGPQQGTHSA-N 2 0 242.407 2.156 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@@H]([NH3+])[C@H](C)C2)c(C)c1 ZINC000094338950 387222991 /nfs/dbraw/zinc/22/29/91/387222991.db2.gz LTOCQTFKTFIULR-UKRRQHHQSA-N 2 0 232.371 2.473 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@@H]1CC[C@H]1C(C)(C)C ZINC000423372966 387226414 /nfs/dbraw/zinc/22/64/14/387226414.db2.gz BREVZXPPVIMERZ-IJLUTSLNSA-N 2 0 212.381 2.399 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+]C1[C@@H](C)CCC[C@@H]1C ZINC000423373515 387227346 /nfs/dbraw/zinc/22/73/46/387227346.db2.gz HBSMDUZADGBYGU-SDDRHHMPSA-N 2 0 212.381 2.399 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@@H]1CC[C@@H]1C(C)(C)C ZINC000423372965 387227494 /nfs/dbraw/zinc/22/74/94/387227494.db2.gz BREVZXPPVIMERZ-GRYCIOLGSA-N 2 0 212.381 2.399 20 0 BEADRP CO[C@H](c1ccccc1)[C@H](C)[NH2+]CCCC[NH3+] ZINC000423325247 387229334 /nfs/dbraw/zinc/22/93/34/387229334.db2.gz LHJXHHSDUVIRCH-JSGCOSHPSA-N 2 0 236.359 2.091 20 0 BEADRP CC(C)N(C)C[C@@H](C)[NH2+][C@H](C)[C@H]1CCCOC1 ZINC000353578852 387232107 /nfs/dbraw/zinc/23/21/07/387232107.db2.gz TUDYZPCAZPMTJP-MCIONIFRSA-N 2 0 242.407 2.120 20 0 BEADRP CC(C)[C@H]([NH2+][C@H]1CC[NH2+]C[C@H]1C)c1cccnc1 ZINC000423399466 387234373 /nfs/dbraw/zinc/23/43/73/387234373.db2.gz PNWHEKSVUGJKKQ-SNPRPXQTSA-N 2 0 247.386 2.366 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@@H]1CCc2c1cccc2F ZINC000423400919 387234650 /nfs/dbraw/zinc/23/46/50/387234650.db2.gz QNBYBZCZXAYEDD-WKPIXPDZSA-N 2 0 248.345 2.401 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@H]1CCc2c1cccc2F ZINC000423400915 387235021 /nfs/dbraw/zinc/23/50/21/387235021.db2.gz QNBYBZCZXAYEDD-ONERCXAPSA-N 2 0 248.345 2.401 20 0 BEADRP CC(C)[C@H]([NH2+][C@H]1CC[NH2+]C[C@@H]1C)c1cccnc1 ZINC000423399465 387235068 /nfs/dbraw/zinc/23/50/68/387235068.db2.gz PNWHEKSVUGJKKQ-QEJZJMRPSA-N 2 0 247.386 2.366 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C2CC(F)(F)C2)[C@@H]2CCC[C@@H]21 ZINC000353589578 387236808 /nfs/dbraw/zinc/23/68/08/387236808.db2.gz QPASCCIQXJCPGO-SRVKXCTJSA-N 2 0 244.329 2.247 20 0 BEADRP COC[C@@]1(C[NH2+][C@@H](C)CC(C)(C)C)CCC[NH2+]1 ZINC000423413429 387245809 /nfs/dbraw/zinc/24/58/09/387245809.db2.gz KLIVBZCUPXNOFZ-JSGCOSHPSA-N 2 0 242.407 2.169 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)[C@@H]1C[C@H]1C ZINC000423419039 387247894 /nfs/dbraw/zinc/24/78/94/387247894.db2.gz IHNWFKOMZWFCOH-DHGKCCLASA-N 2 0 224.392 2.386 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]Cc1cccc2c1CCCN2 ZINC000423416944 387249122 /nfs/dbraw/zinc/24/91/22/387249122.db2.gz RRCNFFUGEGUFMZ-GFCCVEGCSA-N 2 0 247.386 2.262 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000423346503 387194943 /nfs/dbraw/zinc/19/49/43/387194943.db2.gz PVOGTQFMKQEYFK-JHJVBQTASA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H]([NH2+]CC1=CC[NH2+]CC1)C1CCCC1 ZINC000423345381 387194959 /nfs/dbraw/zinc/19/49/59/387194959.db2.gz NVLVHYMSGINOHX-NSHDSACASA-N 2 0 208.349 2.074 20 0 BEADRP C[C@@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)C(C)(C)C ZINC000423346358 387195348 /nfs/dbraw/zinc/19/53/48/387195348.db2.gz ZZQFNROFPMBOIM-DGCLKSJQSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H](Cc1ccoc1)[NH2+]CC1(C)CC[NH2+]CC1 ZINC000423344778 387195722 /nfs/dbraw/zinc/19/57/22/387195722.db2.gz XZEGEUKGRXZGMC-LBPRGKRZSA-N 2 0 236.359 2.190 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)c1ccncc1 ZINC000423426067 387252280 /nfs/dbraw/zinc/25/22/80/387252280.db2.gz OYXATUMAJCFADH-MGPQQGTHSA-N 2 0 247.386 2.497 20 0 BEADRP Cc1nc([C@H](C)[NH2+]CC2=CC[NH2+]CC2)cs1 ZINC000423345257 387195996 /nfs/dbraw/zinc/19/59/96/387195996.db2.gz FYBGXAXFHLNEQG-VIFPVBQESA-N 2 0 237.372 2.022 20 0 BEADRP CC(C)(C)[C@H]1CC[C@H]1[NH2+]CC1([NH3+])CCC1 ZINC000423345713 387196148 /nfs/dbraw/zinc/19/61/48/387196148.db2.gz YWLBWLLRRFDAIZ-WDEREUQCSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]([NH2+]CCCC[NH3+])c1ccc2c(c1)COC2 ZINC000423347245 387196507 /nfs/dbraw/zinc/19/65/07/387196507.db2.gz ZYTIJUYOEXUUCJ-LLVKDONJSA-N 2 0 234.343 2.106 20 0 BEADRP CCC[C@@H]([NH2+]CC1=CC[NH2+]CC1)c1cccnc1 ZINC000423347770 387198331 /nfs/dbraw/zinc/19/83/31/387198331.db2.gz RBHUNGANTHHVPQ-OAHLLOKOSA-N 2 0 245.370 2.432 20 0 BEADRP CCC[C@H]([NH2+]CC1=CC[NH2+]CC1)c1ccccn1 ZINC000423349606 387200341 /nfs/dbraw/zinc/20/03/41/387200341.db2.gz XCQJAABNAHVRBI-AWEZNQCLSA-N 2 0 245.370 2.432 20 0 BEADRP Cc1cc([C@H](C)[NH2+]C[C@@H]2CCC[C@H]([NH3+])C2)no1 ZINC000423463431 387311224 /nfs/dbraw/zinc/31/12/24/387311224.db2.gz FYJSUAZZTHOCMI-TUAOUCFPSA-N 2 0 237.347 2.151 20 0 BEADRP Cc1cc([C@H](C)[NH2+]C[C@H]2CCC[C@@H]([NH3+])C2)no1 ZINC000423463427 387311334 /nfs/dbraw/zinc/31/13/34/387311334.db2.gz FYJSUAZZTHOCMI-SDDRHHMPSA-N 2 0 237.347 2.151 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[C@H]([NH3+])C1)c1ccco1 ZINC000423464312 387313008 /nfs/dbraw/zinc/31/30/08/387313008.db2.gz QTYWZPOWWQXNGX-TUAOUCFPSA-N 2 0 222.332 2.448 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H](C)c1ccc2c(c1)COC2 ZINC000423463836 387313085 /nfs/dbraw/zinc/31/30/85/387313085.db2.gz VMHOLSIVZIKOAH-NEPJUHHUSA-N 2 0 248.370 2.495 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[C@H]([NH3+])C1)c1ccco1 ZINC000423464311 387313605 /nfs/dbraw/zinc/31/36/05/387313605.db2.gz QTYWZPOWWQXNGX-SRVKXCTJSA-N 2 0 222.332 2.448 20 0 BEADRP CCCC[NH+]1CCC([NH2+][C@@H]2CCO[C@H]2C)CC1 ZINC000120659087 387262691 /nfs/dbraw/zinc/26/26/91/387262691.db2.gz KKTSYRFGLFLFPN-GXTWGEPZSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@H]([NH3+])[C@H](C)[NH2+][C@@H](C1CC1)C1CCCC1 ZINC000423469485 387317375 /nfs/dbraw/zinc/31/73/75/387317375.db2.gz PBAYPRYJMXSLOT-OUJBWJOFSA-N 2 0 210.365 2.281 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@H]1CC(C)(C)C[C@H]1C ZINC000423388058 387270808 /nfs/dbraw/zinc/27/08/08/387270808.db2.gz SXNZOYBEXPKXOP-UTUOFQBUSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+][C@H]1CCC12CCCC2 ZINC000423389759 387273186 /nfs/dbraw/zinc/27/31/86/387273186.db2.gz JQMOGUDYFBUPFX-UPJWGTAASA-N 2 0 222.376 2.297 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@@H]1CCC12CCCC2 ZINC000423390420 387275800 /nfs/dbraw/zinc/27/58/00/387275800.db2.gz WADRCIQLPIDWGI-VXGBXAGGSA-N 2 0 210.365 2.297 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@@H]1C[C@@H](C)CC[C@H]1C ZINC000423391062 387276727 /nfs/dbraw/zinc/27/67/27/387276727.db2.gz PDFVNZQBNQGNOD-UMSGYPCISA-N 2 0 212.381 2.399 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+][C@H]1CC[NH2+]C[C@@H]1C ZINC000423393211 387279099 /nfs/dbraw/zinc/27/90/99/387279099.db2.gz MAOGMEDVYFHVPO-OBJOEFQTSA-N 2 0 233.359 2.039 20 0 BEADRP C[C@H]([NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21)C1CCCCCC1 ZINC000423434109 387286804 /nfs/dbraw/zinc/28/68/04/387286804.db2.gz NVJDHXUQUQXTJY-SCUASFONSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)[C@H]1C[C@H]1C ZINC000423435521 387286822 /nfs/dbraw/zinc/28/68/22/387286822.db2.gz OTSDAEFSAFPAFZ-NGKICAJHSA-N 2 0 222.376 2.009 20 0 BEADRP C1CCC2(C1)CCCC[C@H]2[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000423435163 387286915 /nfs/dbraw/zinc/28/69/15/387286915.db2.gz QWLXVYLPCUONJY-RQJABVFESA-N 2 0 234.387 2.297 20 0 BEADRP CCC[C@@H]([NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21)C1CCCC1 ZINC000423437543 387287728 /nfs/dbraw/zinc/28/77/28/387287728.db2.gz UIDXNJBAQSNVQX-RQJABVFESA-N 2 0 222.376 2.153 20 0 BEADRP CC(C)[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000423440047 387290342 /nfs/dbraw/zinc/29/03/42/387290342.db2.gz SVYNLYWINRDJGE-PDWCTOEPSA-N 2 0 222.376 2.009 20 0 BEADRP C[C@H](CCC(C)(C)C)[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000423442554 387292212 /nfs/dbraw/zinc/29/22/12/387292212.db2.gz ZEQUWEBVUDBNII-WYUUTHIRSA-N 2 0 210.365 2.009 20 0 BEADRP CCCCO[C@@H]1C[C@H]([NH2+][C@@H](C)[C@@H](C)[NH3+])C1(C)C ZINC000423444713 387295314 /nfs/dbraw/zinc/29/53/14/387295314.db2.gz LYWQAJTWBOWGSP-MROQNXINSA-N 2 0 242.407 2.296 20 0 BEADRP Cc1ccc(CCC[NH2+]C[C@@H]2CCCO2)cn1 ZINC000353915028 387296623 /nfs/dbraw/zinc/29/66/23/387296623.db2.gz MAOHZOQHIRUPCT-AWEZNQCLSA-N 2 0 234.343 2.091 20 0 BEADRP C[C@H]([NH3+])[C@H](C)[NH2+][C@@H](Cc1ccccc1)C1CC1 ZINC000423450161 387299160 /nfs/dbraw/zinc/29/91/60/387299160.db2.gz SOFPJQYXDKNSSG-HUBLWGQQSA-N 2 0 232.371 2.333 20 0 BEADRP CO[C@@H](C)[C@@H](C)[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000360500746 387301102 /nfs/dbraw/zinc/30/11/02/387301102.db2.gz OJLZJTSUFCFHSP-NEPJUHHUSA-N 2 0 240.391 2.016 20 0 BEADRP CCc1cccnc1[C@H](C)[NH2+][C@@H](C)CCC[NH3+] ZINC000423454539 387301733 /nfs/dbraw/zinc/30/17/33/387301733.db2.gz LOZWETZSCCAHCH-RYUDHWBXSA-N 2 0 235.375 2.422 20 0 BEADRP CC(C)[C@H]1CCC[C@@H]([NH2+][C@@H]2[C@H]3C[NH2+]C[C@H]32)C1 ZINC000423453517 387302179 /nfs/dbraw/zinc/30/21/79/387302179.db2.gz KSUATGJIRZMREP-MEBFFEOJSA-N 2 0 222.376 2.009 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@H](C1CC1)C1CCCC1 ZINC000423456605 387304817 /nfs/dbraw/zinc/30/48/17/387304817.db2.gz DSIQSEMJRRCKNN-STQMWFEESA-N 2 0 210.365 2.282 20 0 BEADRP Cc1ccncc1[C@@H](C)[NH2+][C@H](C)CCC[NH3+] ZINC000423459195 387306714 /nfs/dbraw/zinc/30/67/14/387306714.db2.gz QXKNVJJLZOHJKX-VXGBXAGGSA-N 2 0 221.348 2.168 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+][C@@H]1CCC12CCC2 ZINC000423457578 387307023 /nfs/dbraw/zinc/30/70/23/387307023.db2.gz IMYRGBCHSDQABG-NFMDPKQHSA-N 2 0 234.387 2.425 20 0 BEADRP C[C@@H]1C[NH+](CC[C@@H]2CCC[N@@H+]2C)C[C@@H](C)S1 ZINC000162061188 387308854 /nfs/dbraw/zinc/30/88/54/387308854.db2.gz VNOFLIJHDVSIMK-UPJWGTAASA-N 2 0 242.432 2.297 20 0 BEADRP CCC(CC)C[N@H+]1CC[C@H]2C[NH2+]C[C@H]2CC1 ZINC000393775891 387309231 /nfs/dbraw/zinc/30/92/31/387309231.db2.gz XJSQXLUFTSVREQ-OKILXGFUSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[C@@H]([NH3+])C1)[C@H]1C[C@H]1C ZINC000423461393 387309370 /nfs/dbraw/zinc/30/93/70/387309370.db2.gz CISOZPMWAAEDQD-SJHCENCUSA-N 2 0 210.365 2.138 20 0 BEADRP C1=C(CC[NH2+][C@H]2CCC[C@H]2C2CC2)CC[NH2+]C1 ZINC000423535035 387360469 /nfs/dbraw/zinc/36/04/69/387360469.db2.gz BQTAFYNMHXPQAK-GJZGRUSLSA-N 2 0 234.387 2.465 20 0 BEADRP CC[C@@H]([NH2+]CCC1=CC[NH2+]CC1)C1CC1 ZINC000423535598 387360842 /nfs/dbraw/zinc/36/08/42/387360842.db2.gz DNOBOGSHXMYWJO-CYBMUJFWSA-N 2 0 208.349 2.074 20 0 BEADRP C[C@@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)C1(C)CC1 ZINC000423480858 387360983 /nfs/dbraw/zinc/36/09/83/387360983.db2.gz NPYPZDTVJOAXIP-VXGBXAGGSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)C1(C)CC1 ZINC000423538516 387363305 /nfs/dbraw/zinc/36/33/05/387363305.db2.gz GNMMLCMXVCIXHV-ZDEQEGDKSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H](CC1CC1)[NH2+]CCC1=CC[NH2+]CC1 ZINC000423542050 387365490 /nfs/dbraw/zinc/36/54/90/387365490.db2.gz SRINUPDGDPXTEK-LLVKDONJSA-N 2 0 208.349 2.074 20 0 BEADRP CC[C@@H]1C[C@H]([NH2+][C@@H](C)CCCC[NH3+])CCO1 ZINC000423543928 387368944 /nfs/dbraw/zinc/36/89/44/387368944.db2.gz IDFFOYGNJBGSBD-YNEHKIRRSA-N 2 0 228.380 2.051 20 0 BEADRP CC[C@@H]([NH2+][C@H]1CCO[C@H](CC)C1)[C@@H]1CCC[NH2+]1 ZINC000423546234 387369668 /nfs/dbraw/zinc/36/96/68/387369668.db2.gz KMBBFUFGOWGYDZ-DGAVXFQQSA-N 2 0 240.391 2.064 20 0 BEADRP C(C[NH2+]C1CC1)C[NH2+][C@H]1CC[C@H]1C1CCC1 ZINC000423547388 387369677 /nfs/dbraw/zinc/36/96/77/387369677.db2.gz GBVZUBKTQIPHPM-KBPBESRZSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]C[C@@H]1CC12CCSCC2 ZINC000423547212 387371401 /nfs/dbraw/zinc/37/14/01/387371401.db2.gz LEWAGNPDBZOVDQ-RYUDHWBXSA-N 2 0 242.432 2.237 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1Cc2ccccc21)[C@@H]1CCCC[NH2+]1 ZINC000643453505 387371600 /nfs/dbraw/zinc/37/16/00/387371600.db2.gz IQMQTKVHEMHWBL-XPKDYRNWSA-N 2 0 244.382 2.447 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCCC[NH2+]C1)[C@@H]1C[C@@H]1C ZINC000423557693 387376043 /nfs/dbraw/zinc/37/60/43/387376043.db2.gz NNWLFXHMKXNBQH-LOWDOPEQSA-N 2 0 210.365 2.153 20 0 BEADRP Cc1ccc(C[NH+]2CCC(C[NH+](C)C)CC2)cn1 ZINC000360975246 387378405 /nfs/dbraw/zinc/37/84/05/387378405.db2.gz TTXYAMVQMKZPRX-UHFFFAOYSA-N 2 0 247.386 2.164 20 0 BEADRP C1CC([C@@H]2CC[C@@H]2[NH2+][C@H]2CCCC[NH2+]C2)C1 ZINC000423568604 387380505 /nfs/dbraw/zinc/38/05/05/387380505.db2.gz VQVXIVYWPIMVQO-IHRRRGAJSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[C@H]([NH3+])C1)c1cccnc1 ZINC000423474921 387321288 /nfs/dbraw/zinc/32/12/88/387321288.db2.gz PHPMCQNYVSFTOW-OBJOEFQTSA-N 2 0 233.359 2.250 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@@H](C)CCCc1cccnc1 ZINC000423478937 387326935 /nfs/dbraw/zinc/32/69/35/387326935.db2.gz UXUMQVZZWWQIGU-JSGCOSHPSA-N 2 0 235.375 2.120 20 0 BEADRP CCC1CC([NH2+]C[C@@H]2CCC[C@@H]([NH3+])C2)C1 ZINC000423481955 387327887 /nfs/dbraw/zinc/32/78/87/387327887.db2.gz XDOFUQMQGJTULY-QZQSVVMZSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])C1)c1cccc(O)c1 ZINC000423484813 387330791 /nfs/dbraw/zinc/33/07/91/387330791.db2.gz AIGWSCKEVDDIRU-GVXVVHGQSA-N 2 0 234.343 2.170 20 0 BEADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@@H]2CCc3ccccc32)C1 ZINC000423492014 387335948 /nfs/dbraw/zinc/33/59/48/387335948.db2.gz LDIMTPDCBHXMIY-UXIGCNINSA-N 2 0 230.355 2.391 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CCN(C)[C@H](C)C2)C[C@H](C)O1 ZINC000515125240 387338142 /nfs/dbraw/zinc/33/81/42/387338142.db2.gz KCGJRBXBXVGYOR-DGTMBMJNSA-N 2 0 240.391 2.015 20 0 BEADRP COc1cccc([C@H](C)[NH2+][C@@H]2CC[C@H](C[NH3+])C2)c1 ZINC000423496341 387338909 /nfs/dbraw/zinc/33/89/09/387338909.db2.gz WKVMDOKKNXKOEJ-SGMGOOAPSA-N 2 0 248.370 2.473 20 0 BEADRP COc1cccc([C@H](C)[NH2+][C@H]2CC[C@@H](C[NH3+])C2)c1 ZINC000423496340 387339374 /nfs/dbraw/zinc/33/93/74/387339374.db2.gz WKVMDOKKNXKOEJ-SCRDCRAPSA-N 2 0 248.370 2.473 20 0 BEADRP Cc1ccnc([C@H](C)[NH2+][C@H]2CC[C@H](C[NH3+])C2)c1 ZINC000423501309 387340435 /nfs/dbraw/zinc/34/04/35/387340435.db2.gz JKDCLTHCUWRBIX-AVGNSLFASA-N 2 0 233.359 2.168 20 0 BEADRP Cc1ccnc([C@H](C)[NH2+][C@@H]2CC[C@H](C[NH3+])C2)c1 ZINC000423501310 387340760 /nfs/dbraw/zinc/34/07/60/387340760.db2.gz JKDCLTHCUWRBIX-RWMBFGLXSA-N 2 0 233.359 2.168 20 0 BEADRP CCc1cccnc1[C@H](C)[NH2+][C@@H]1CC[C@@H](C[NH3+])C1 ZINC000423498711 387340855 /nfs/dbraw/zinc/34/08/55/387340855.db2.gz HGWGGFCQWYEMRW-OUCADQQQSA-N 2 0 247.386 2.422 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@H](C)[C@@H]1C[C@H]1C ZINC000321989891 387343842 /nfs/dbraw/zinc/34/38/42/387343842.db2.gz DWWGNUCUHUVTGH-JHJVBQTASA-N 2 0 212.381 2.351 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H](C[NH3+])C1)[C@@H]1CC1(C)C ZINC000423520885 387353038 /nfs/dbraw/zinc/35/30/38/387353038.db2.gz WPQWVAMBQOPTKH-QCNOEVLYSA-N 2 0 210.365 2.138 20 0 BEADRP CCC[C@H](C)[C@@H](CC)[NH2+]C[C@@H]1C[NH2+]CCCO1 ZINC000423520034 387353985 /nfs/dbraw/zinc/35/39/85/387353985.db2.gz PMGYUFITMUDPSJ-MELADBBJSA-N 2 0 242.407 2.169 20 0 BEADRP Cn1ccnc1[C@@H]1CCC[N@H+](CCCCF)C1 ZINC000367133764 387437393 /nfs/dbraw/zinc/43/73/93/387437393.db2.gz PXFIDQDOOWWCLJ-GFCCVEGCSA-N 2 0 239.338 2.349 20 0 BEADRP C[C@]12C[C@H]1CCC[C@@H]2[NH2+]CC1CC[NH2+]CC1 ZINC000516044555 387449394 /nfs/dbraw/zinc/44/93/94/387449394.db2.gz GNYVDSCEYZFQIX-RDBSUJKOSA-N 2 0 222.376 2.154 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CC(C)(C)[C@H]1CCCCO1 ZINC000643466832 387388864 /nfs/dbraw/zinc/38/88/64/387388864.db2.gz PTCAOPJZMLWNHQ-YNEHKIRRSA-N 2 0 242.407 2.297 20 0 BEADRP Cc1ncc([C@H](C)[NH2+]C2CCC([NH3+])CC2)s1 ZINC000643503589 387393740 /nfs/dbraw/zinc/39/37/40/387393740.db2.gz HOAJLUISHNCLIG-PUSIOWJLSA-N 2 0 239.388 2.372 20 0 BEADRP C[C@H]([NH2+]C1(c2ccc(F)cc2)CCC1)C1C[NH2+]C1 ZINC000643467791 387406729 /nfs/dbraw/zinc/40/67/29/387406729.db2.gz KNKRRXUOYQRLSF-NSHDSACASA-N 2 0 248.345 2.402 20 0 BEADRP C[C@@H](C[NH2+]C(C1CCC1)C1CCC1)N(C)C ZINC000304312857 387460894 /nfs/dbraw/zinc/46/08/94/387460894.db2.gz KPMUAUSUKIOEJE-NSHDSACASA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[NH2+]CC[C@H]1C)C1CC1 ZINC000643468335 387418970 /nfs/dbraw/zinc/41/89/70/387418970.db2.gz QLXGMZYGROJWIK-NQBHXWOUSA-N 2 0 210.365 2.010 20 0 BEADRP CC[NH+](CC)CCC[N@H+](CC)C[C@@H](C)OC ZINC000361570465 387495548 /nfs/dbraw/zinc/49/55/48/387495548.db2.gz WOIJZZLLVLCDOQ-CYBMUJFWSA-N 2 0 230.396 2.075 20 0 BEADRP C[C@@H](CCc1ccco1)[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000643509292 387501003 /nfs/dbraw/zinc/50/10/03/387501003.db2.gz UWCIHJSVMTXPLR-QWHCGFSZSA-N 2 0 236.359 2.190 20 0 BEADRP CC(C)OC1CCC([NH2+][C@@H](C)C[C@H](C)[NH3+])CC1 ZINC000643475971 387512782 /nfs/dbraw/zinc/51/27/82/387512782.db2.gz ZFPITISCIWAIKN-FEPKRQSRSA-N 2 0 242.407 2.438 20 0 BEADRP CCC[C@@]1([NH2+]CCC[NH+](CC)CC)CCOC1 ZINC000352825246 387528305 /nfs/dbraw/zinc/52/83/05/387528305.db2.gz OSFXXTIUQGNDNA-CQSZACIVSA-N 2 0 242.407 2.267 20 0 BEADRP CO[C@@H]1CCCC[C@@H]1[NH2+]CC[C@@H]1CCC[N@@H+]1C ZINC000361748987 387529544 /nfs/dbraw/zinc/52/95/44/387529544.db2.gz CRUKYFZISLRMCM-MELADBBJSA-N 2 0 240.391 2.018 20 0 BEADRP Cc1occc1C[NH2+][C@H](C)CCCC[NH3+] ZINC000643472156 387484798 /nfs/dbraw/zinc/48/47/98/387484798.db2.gz AHEUWIYKRGXPBP-SNVBAGLBSA-N 2 0 210.321 2.195 20 0 BEADRP CC(C)C[C@@H]1CCC[N@@H+]1CC[C@H]1CC[NH2+]C1 ZINC000396780027 387492812 /nfs/dbraw/zinc/49/28/12/387492812.db2.gz URZICZSHJUQPIL-KGLIPLIRSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)C[C@H]([NH3+])C[N@@H+]1CCSC[C@@H](C)C1 ZINC000379553237 387586048 /nfs/dbraw/zinc/58/60/48/387586048.db2.gz VUEYIAAWISJDKH-RYUDHWBXSA-N 2 0 230.421 2.045 20 0 BEADRP CC(C)C[C@@H]([NH3+])C[N@@H+]1CCSC[C@@H](C)C1 ZINC000379553236 387586191 /nfs/dbraw/zinc/58/61/91/387586191.db2.gz VUEYIAAWISJDKH-NWDGAFQWSA-N 2 0 230.421 2.045 20 0 BEADRP CCC([NH3+])(CC)C[NH2+][C@H]1CCC[C@H](OC)C1 ZINC000643513774 387597754 /nfs/dbraw/zinc/59/77/54/387597754.db2.gz MSGDSLJOMVDWGB-RYUDHWBXSA-N 2 0 228.380 2.051 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+]CCCC(F)(F)F ZINC000123893402 387598186 /nfs/dbraw/zinc/59/81/86/387598186.db2.gz SMJKDMUMNOPJIX-ZJUUUORDSA-N 2 0 238.297 2.436 20 0 BEADRP CC(C)OCCC[N@@H+]1C[C@H](C[NH3+])[C@@H](C)C[C@H]1C ZINC000422639443 387611697 /nfs/dbraw/zinc/61/16/97/387611697.db2.gz STWJQDBILPSPEE-MJBXVCDLSA-N 2 0 242.407 2.107 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CCc1c(F)cccc1F ZINC000422692610 387613334 /nfs/dbraw/zinc/61/33/34/387613334.db2.gz KLHXHAFAZMADKS-UWVGGRQHSA-N 2 0 242.313 2.223 20 0 BEADRP CCC(CC)[C@H](O)C[NH2+][C@@H]1CCCCC[C@@H]1[NH3+] ZINC000422700751 387615353 /nfs/dbraw/zinc/61/53/53/387615353.db2.gz ANCRXIVQAYBNEK-BFHYXJOUSA-N 2 0 242.407 2.033 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]Cc1ccc2ccccc2n1 ZINC000422702916 387618513 /nfs/dbraw/zinc/61/85/13/387618513.db2.gz LSMNIJOWKPYJFS-VXGBXAGGSA-N 2 0 243.354 2.450 20 0 BEADRP Clc1cccc2c1CC[C@H]2[NH2+]CC1C[NH2+]C1 ZINC000643516034 387619986 /nfs/dbraw/zinc/61/99/86/387619986.db2.gz PPCBTGFRACLZEN-CYBMUJFWSA-N 2 0 236.746 2.136 20 0 BEADRP Cc1cc(C[N@H+](C)CC2CC[NH+](C)CC2)ccn1 ZINC000527531755 387621932 /nfs/dbraw/zinc/62/19/32/387621932.db2.gz BSOYHYXLQPRGQY-UHFFFAOYSA-N 2 0 247.386 2.164 20 0 BEADRP C[C@H](Cc1cccs1)[NH2+]C[C@@H]([NH3+])C1CC1 ZINC000643516558 387626847 /nfs/dbraw/zinc/62/68/47/387626847.db2.gz SBOJZXAVVLYRSO-BXKDBHETSA-N 2 0 224.373 2.006 20 0 BEADRP COCC(C)(C)C[NH2+]C1CCC([NH+](C)C)CC1 ZINC000426296040 387554243 /nfs/dbraw/zinc/55/42/43/387554243.db2.gz PGPIVLKMDWRNMD-UHFFFAOYSA-N 2 0 242.407 2.121 20 0 BEADRP Cn1ccc(CNC2CC([NH+]3CCCCC3)C2)c1 ZINC000355579470 387555053 /nfs/dbraw/zinc/55/50/53/387555053.db2.gz DVMKMMFTQHDISN-UHFFFAOYSA-N 2 0 247.386 2.132 20 0 BEADRP CC[C@H](C[NH2+][C@@H](C)C1C[NH2+]C1)c1ccccc1 ZINC000422716453 387627610 /nfs/dbraw/zinc/62/76/10/387627610.db2.gz NEFLZPJNLFSJNR-QWHCGFSZSA-N 2 0 232.371 2.378 20 0 BEADRP Cc1ccccc1C[NH2+][C@](C)(C[NH3+])C1CC1 ZINC000430586928 387631114 /nfs/dbraw/zinc/63/11/14/387631114.db2.gz XQMSYORXXHVKKH-CQSZACIVSA-N 2 0 218.344 2.212 20 0 BEADRP CCc1ccc(C[NH2+][C@](C)(C[NH3+])C2CC2)cc1 ZINC000430599375 387632198 /nfs/dbraw/zinc/63/21/98/387632198.db2.gz PYJMGLGAQAQZES-OAHLLOKOSA-N 2 0 232.371 2.466 20 0 BEADRP CC(C)[C@@H]1CCC[C@H]([NH2+][C@H]2CC[NH2+]C2)C1 ZINC000422719357 387632934 /nfs/dbraw/zinc/63/29/34/387632934.db2.gz QWCMMFGDBNGKSZ-AGIUHOORSA-N 2 0 210.365 2.153 20 0 BEADRP CCc1ccc(CC[N@@H+]2CCC[C@@H](C[NH3+])C2)cc1 ZINC000430610690 387633950 /nfs/dbraw/zinc/63/39/50/387633950.db2.gz LJIKLRCNLFBMFW-INIZCTEOSA-N 2 0 246.398 2.462 20 0 BEADRP C[NH+](C)[C@@H]1CCC[N@H+](C[C@@H]2CCC=CO2)CC1 ZINC000376475692 387638150 /nfs/dbraw/zinc/63/81/50/387638150.db2.gz BPNLQFIYHSROMQ-KGLIPLIRSA-N 2 0 238.375 2.095 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CCc1c[nH]c2ccccc12 ZINC000422732986 387640998 /nfs/dbraw/zinc/64/09/98/387640998.db2.gz PYRVXJHJTPAPFB-RYUDHWBXSA-N 2 0 245.370 2.426 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CCc1ccc(F)cc1 ZINC000422735456 387642985 /nfs/dbraw/zinc/64/29/85/387642985.db2.gz UVMPOXMCBDQTGX-QWRGUYRKSA-N 2 0 224.323 2.084 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CCc1ccc(F)cc1 ZINC000422735455 387643798 /nfs/dbraw/zinc/64/37/98/387643798.db2.gz UVMPOXMCBDQTGX-MNOVXSKESA-N 2 0 224.323 2.084 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@@H](C)Cc1ccccc1F ZINC000422739696 387645171 /nfs/dbraw/zinc/64/51/71/387645171.db2.gz LZHXNHACBVJSQH-TUAOUCFPSA-N 2 0 238.350 2.472 20 0 BEADRP CCOc1ccccc1C[NH2+][C@@H]1CCC[C@H]1C[NH3+] ZINC000422740512 387648498 /nfs/dbraw/zinc/64/84/98/387648498.db2.gz NQZNOJUCUCTGGG-GXTWGEPZSA-N 2 0 248.370 2.302 20 0 BEADRP CC1(C)CCC[C@H]([NH2+]C2CC[NH2+]CC2)C1 ZINC000149500092 387651318 /nfs/dbraw/zinc/65/13/18/387651318.db2.gz UULGWAPPQIVTJV-LBPRGKRZSA-N 2 0 210.365 2.297 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+]CCc1ccccc1Cl ZINC000422788514 387653914 /nfs/dbraw/zinc/65/39/14/387653914.db2.gz VMARNGRWBIDXOS-QWHCGFSZSA-N 2 0 238.762 2.352 20 0 BEADRP Cc1ccc(OCC[NH2+][C@H](C)C[C@@H](C)[NH3+])cc1 ZINC000422753886 387657805 /nfs/dbraw/zinc/65/78/05/387657805.db2.gz IYUAUAYUFSUAAD-CHWSQXEVSA-N 2 0 236.359 2.089 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])N[C@H](CC[NH+](C)C)C(C)(C)C ZINC000422756224 387658799 /nfs/dbraw/zinc/65/87/99/387658799.db2.gz HLFAORZFNLTDBU-YNEHKIRRSA-N 2 0 243.439 2.068 20 0 BEADRP Cc1ccc(OCC[NH2+][C@@H](C)C[C@@H](C)[NH3+])cc1 ZINC000422753887 387659309 /nfs/dbraw/zinc/65/93/09/387659309.db2.gz IYUAUAYUFSUAAD-OLZOCXBDSA-N 2 0 236.359 2.089 20 0 BEADRP Cc1ccc(C[NH2+][C@@H](C)C[C@@H](C)[NH3+])cc1 ZINC000422756409 387659458 /nfs/dbraw/zinc/65/94/58/387659458.db2.gz IQYPDOLVNHZAAU-NEPJUHHUSA-N 2 0 206.333 2.210 20 0 BEADRP C[C@H]([NH2+]CCCNc1ccccc1)[C@@H]1CCC[NH2+]1 ZINC000422758690 387660086 /nfs/dbraw/zinc/66/00/86/387660086.db2.gz OFESJAAXBVYZGA-ZFWWWQNUSA-N 2 0 247.386 2.219 20 0 BEADRP CS[C@@H]1CCC[C@@H]([NH2+][C@@H](C)[C@@H]2CCC[NH2+]2)C1 ZINC000422758840 387660253 /nfs/dbraw/zinc/66/02/53/387660253.db2.gz KDMVPOLFLCCCOR-LOWDOPEQSA-N 2 0 242.432 2.391 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)[C@@H]1C[C@H]1C1CC1 ZINC000527656711 387662168 /nfs/dbraw/zinc/66/21/68/387662168.db2.gz JBDSYYVYTCHZHH-NEBZKDRISA-N 2 0 236.403 2.352 20 0 BEADRP C[C@@H]([NH2+]CC1CC[NH+](C)CC1)[C@@H]1C[C@H]1C1CC1 ZINC000527653931 387662455 /nfs/dbraw/zinc/66/24/55/387662455.db2.gz NLSFVQZSNLMUTD-UGFHNGPFSA-N 2 0 236.403 2.352 20 0 BEADRP CCc1ccc(CC[N@@H+]2CC[C@@H](C[NH2+]C)C2)cc1 ZINC000430927760 387662614 /nfs/dbraw/zinc/66/26/14/387662614.db2.gz RPGNKVPAWAFSMM-INIZCTEOSA-N 2 0 246.398 2.333 20 0 BEADRP C[C@@H](CCC(C)(C)C)[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000422760533 387662670 /nfs/dbraw/zinc/66/26/70/387662670.db2.gz QFYSLEAESZJTTH-QWRGUYRKSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@H]1CCc2ccccc2C1 ZINC000422759477 387662753 /nfs/dbraw/zinc/66/27/53/387662753.db2.gz PGHQQDXYZSLXCJ-HUBLWGQQSA-N 2 0 232.371 2.259 20 0 BEADRP CCc1ccc(CC[N@@H+]2CC[C@H](C[NH2+]C)C2)cc1 ZINC000430927761 387662895 /nfs/dbraw/zinc/66/28/95/387662895.db2.gz RPGNKVPAWAFSMM-MRXNPFEDSA-N 2 0 246.398 2.333 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)CCC(C)(C)C)C1C[NH2+]C1 ZINC000422760535 387662888 /nfs/dbraw/zinc/66/28/88/387662888.db2.gz QFYSLEAESZJTTH-WDEREUQCSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H](CC[NH+](C)C)C(C)(C)C ZINC000422760056 387663137 /nfs/dbraw/zinc/66/31/37/387663137.db2.gz LMISRIDRBMPSST-CHWSQXEVSA-N 3 0 243.439 2.070 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CCc1cccs1 ZINC000422759458 387663435 /nfs/dbraw/zinc/66/34/35/387663435.db2.gz PCBKIXVGQJIRGA-ZJUUUORDSA-N 2 0 212.362 2.006 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+][C@H]1CCc2ccccc2C1 ZINC000422761421 387663554 /nfs/dbraw/zinc/66/35/54/387663554.db2.gz RHLBSTJGDFSORN-RRFJBIMHSA-N 2 0 230.355 2.013 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@H]1CCc2ccccc2C1 ZINC000422759480 387663706 /nfs/dbraw/zinc/66/37/06/387663706.db2.gz PGHQQDXYZSLXCJ-ZOWXZIJZSA-N 2 0 232.371 2.259 20 0 BEADRP C[C@@H]1CCC[C@H](C[NH2+][C@H]2CCC[C@H]2[NH3+])C1 ZINC000422765639 387664740 /nfs/dbraw/zinc/66/47/40/387664740.db2.gz QZNDPTWWBPRSIL-XQHKEYJVSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CCOC1CCCCCC1 ZINC000422770004 387669645 /nfs/dbraw/zinc/66/96/45/387669645.db2.gz WCQSOUVFDBECCR-STQMWFEESA-N 2 0 242.407 2.441 20 0 BEADRP CS[C@@H]1CCC[C@H]([NH2+][C@H]2CCC[C@H]2[NH3+])C1 ZINC000422770717 387670413 /nfs/dbraw/zinc/67/04/13/387670413.db2.gz XAMVGQVREDIVBB-QCNOEVLYSA-N 2 0 228.405 2.130 20 0 BEADRP CC(C)[C@@H](C)C[NH2+][C@H](C)[C@H]1CCCC[NH2+]1 ZINC000422773173 387670760 /nfs/dbraw/zinc/67/07/60/387670760.db2.gz TWAVFVOTNYPPMK-YNEHKIRRSA-N 2 0 212.381 2.399 20 0 BEADRP CC[C@H](COC)[NH2+][C@H](CC[NH+](C)C)C(C)(C)C ZINC000125997803 387671416 /nfs/dbraw/zinc/67/14/16/387671416.db2.gz KYNWBZZUHHIEKF-CHWSQXEVSA-N 2 0 244.423 2.367 20 0 BEADRP CC[C@H](COC)[NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1 ZINC000125971374 387671532 /nfs/dbraw/zinc/67/15/32/387671532.db2.gz MIOZSOGTWIPLKV-UONOGXRCSA-N 2 0 242.407 2.121 20 0 BEADRP COc1cc(CC[NH2+][C@H]2CCC[C@@H]2[NH3+])ccc1C ZINC000422775112 387672457 /nfs/dbraw/zinc/67/24/57/387672457.db2.gz ACSQLWNKLLLWRN-KBPBESRZSA-N 2 0 248.370 2.016 20 0 BEADRP CCO[C@@H]1C[C@H]([NH2+][C@H](C)C[C@H](C)[NH3+])C12CCC2 ZINC000422777107 387674086 /nfs/dbraw/zinc/67/40/86/387674086.db2.gz FFLGLHAAIDSROU-QNWHQSFQSA-N 2 0 240.391 2.050 20 0 BEADRP Cc1cc(C[NH2+]CC[C@H]2CCC[N@@H+](C)C2)ccn1 ZINC000527720039 387674957 /nfs/dbraw/zinc/67/49/57/387674957.db2.gz KWTXUDRRMNSWHW-CQSZACIVSA-N 2 0 247.386 2.212 20 0 BEADRP CC[C@H]([NH2+][C@@H](C)C1C[NH2+]C1)c1ccccc1 ZINC000422777899 387675950 /nfs/dbraw/zinc/67/59/50/387675950.db2.gz GQABXBBBVFYHPT-FZMZJTMJSA-N 2 0 218.344 2.335 20 0 BEADRP CC[C@H]([NH2+][C@H](C)C[C@H](C)[NH3+])c1ccncc1 ZINC000422782378 387680421 /nfs/dbraw/zinc/68/04/21/387680421.db2.gz LWIVASRYAJXYJD-LOWVWBTDSA-N 2 0 221.348 2.248 20 0 BEADRP CC[C@H]([NH2+][C@@H](C)C[C@@H](C)[NH3+])c1ccncc1 ZINC000422782379 387680629 /nfs/dbraw/zinc/68/06/29/387680629.db2.gz LWIVASRYAJXYJD-MDZLAQPJSA-N 2 0 221.348 2.248 20 0 BEADRP Cc1ccc(O[C@H](C)C[NH2+][C@@H]2CCC[C@@H]2[NH3+])cc1 ZINC000422781118 387680770 /nfs/dbraw/zinc/68/07/70/387680770.db2.gz DREJBZWSMXWKBY-VHDGCEQUSA-N 2 0 248.370 2.232 20 0 BEADRP Cc1cc(C)cc(CC[NH2+][C@H](C)C2C[NH2+]C2)c1 ZINC000422785139 387684833 /nfs/dbraw/zinc/68/48/33/387684833.db2.gz OZMDDISLIOUSIW-CYBMUJFWSA-N 2 0 232.371 2.043 20 0 BEADRP C[C@H]([NH2+]CC1CC[NH+](C)CC1)c1ccncc1 ZINC000044515591 387685435 /nfs/dbraw/zinc/68/54/35/387685435.db2.gz USSWGNXEVAJQDE-LBPRGKRZSA-N 2 0 233.359 2.074 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CCCOC1CCCCC1 ZINC000422786930 387687532 /nfs/dbraw/zinc/68/75/32/387687532.db2.gz PHUIBKAGDFKOKW-QWHCGFSZSA-N 2 0 242.407 2.441 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)C[C@H](C)[NH3+])c1ccccc1 ZINC000422742902 387691279 /nfs/dbraw/zinc/69/12/79/387691279.db2.gz HFMFHXXJCVJXHV-SDDRHHMPSA-N 2 0 206.333 2.463 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CCCOc1ccccc1 ZINC000422791263 387693921 /nfs/dbraw/zinc/69/39/21/387693921.db2.gz QBENKJURDASRPA-OLZOCXBDSA-N 2 0 236.359 2.171 20 0 BEADRP CCc1ccccc1C[NH2+][C@@H](C)C[C@@H](C)[NH3+] ZINC000422790574 387693935 /nfs/dbraw/zinc/69/39/35/387693935.db2.gz VBGKFUMGDQOELI-NEPJUHHUSA-N 2 0 220.360 2.464 20 0 BEADRP Cc1ccc(OCCC[NH2+][C@H]2CCC[C@@H]2[NH3+])cc1 ZINC000422860460 387743629 /nfs/dbraw/zinc/74/36/29/387743629.db2.gz MKBRHGMIVQSKFR-GJZGRUSLSA-N 2 0 248.370 2.233 20 0 BEADRP C[C@@H](Cc1cccs1)[NH2+][C@H]1CC[NH2+][C@H](C)C1 ZINC000643525502 387746498 /nfs/dbraw/zinc/74/64/98/387746498.db2.gz YXOWWLGUEKBPKA-WOPDTQHZSA-N 2 0 238.400 2.409 20 0 BEADRP CC[C@H]([NH2+][C@@H](C)[C@H]1CC[NH2+]C1)C(C)(C)C ZINC000422865612 387746514 /nfs/dbraw/zinc/74/65/14/387746514.db2.gz YTYKUMRDLFDCSW-SRVKXCTJSA-N 2 0 212.381 2.399 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+][C@@H](C)C2C[NH2+]C2)cc1F ZINC000422870445 387748892 /nfs/dbraw/zinc/74/88/92/387748892.db2.gz BRCSRXGONMUBBT-MNOVXSKESA-N 2 0 236.334 2.393 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+][C@H](C)C2C[NH2+]C2)cc1F ZINC000422870444 387749120 /nfs/dbraw/zinc/74/91/20/387749120.db2.gz BRCSRXGONMUBBT-GHMZBOCLSA-N 2 0 236.334 2.393 20 0 BEADRP C[C@@H]([NH2+]C[C@@]1(C)CCCS1)[C@@H]1CCCC[NH2+]1 ZINC000422870739 387750417 /nfs/dbraw/zinc/75/04/17/387750417.db2.gz CBVUJVZQMCDJAY-FRRDWIJNSA-N 2 0 242.432 2.392 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]C[C@@]1(C)CCCS1 ZINC000422873738 387752408 /nfs/dbraw/zinc/75/24/08/387752408.db2.gz LYNRNHDQBWKHIV-FRRDWIJNSA-N 2 0 242.432 2.250 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]C[C@@H]1CCCS1 ZINC000422873775 387752708 /nfs/dbraw/zinc/75/27/08/387752708.db2.gz MFCKZYINCKUHQT-QJPTWQEYSA-N 2 0 228.405 2.132 20 0 BEADRP C[C@@]1(C[NH2+]C2CCC(C[NH3+])CC2)CCCS1 ZINC000422874142 387753369 /nfs/dbraw/zinc/75/33/69/387753369.db2.gz MZXQOGASJQKDRD-BPCQOVAHSA-N 2 0 242.432 2.379 20 0 BEADRP C[C@H](C[NH2+][C@@H](C)[C@H]1CC12CC2)C[NH+]1CCCC1 ZINC000527852495 387754314 /nfs/dbraw/zinc/75/43/14/387754314.db2.gz RHGMGTVKSALWHE-HZSPNIEDSA-N 2 0 236.403 2.497 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[C@H]2CCC[C@@H]2C1 ZINC000422796205 387699591 /nfs/dbraw/zinc/69/95/91/387699591.db2.gz XSIHVGSLRODTEE-KSTCHIGDSA-N 2 0 222.376 2.425 20 0 BEADRP Cc1cccc(C[NH2+][C@@H](C)C[C@H](C)[NH3+])c1 ZINC000422801499 387703129 /nfs/dbraw/zinc/70/31/29/387703129.db2.gz FOTKQBFYUHLZKG-RYUDHWBXSA-N 2 0 206.333 2.210 20 0 BEADRP CO[C@H](C[NH2+][C@H]1CC[NH2+]CC[C@@H]1C)C(C)(C)C ZINC000422808615 387706893 /nfs/dbraw/zinc/70/68/93/387706893.db2.gz LGJMLRIAUNQJPB-RWMBFGLXSA-N 2 0 242.407 2.025 20 0 BEADRP CCO[C@H](CC[NH2+][C@@H](C)C[C@H](C)[NH3+])C(C)C ZINC000422810824 387707146 /nfs/dbraw/zinc/70/71/46/387707146.db2.gz NYJSDEVNFYZRCQ-RWMBFGLXSA-N 2 0 230.396 2.153 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]CC1(c2ccccc2)CC1 ZINC000422808428 387707314 /nfs/dbraw/zinc/70/73/14/387707314.db2.gz LDKNQQHAVSBAAC-KGLIPLIRSA-N 2 0 230.355 2.188 20 0 BEADRP CC[C@@H]1CCCC[C@@H]1[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000422812163 387712107 /nfs/dbraw/zinc/71/21/07/387712107.db2.gz QBMLRZBXOLTTSF-LOWVWBTDSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]([NH2+]CC1(c2ccccc2)CCC1)C1C[NH2+]C1 ZINC000422814468 387715238 /nfs/dbraw/zinc/71/52/38/387715238.db2.gz UZOUVLGAPSYHLC-CYBMUJFWSA-N 2 0 244.382 2.306 20 0 BEADRP Cc1ncc([C@@H](C)[NH2+][C@@H]2CCC[NH2+]CC2)s1 ZINC000643521743 387715766 /nfs/dbraw/zinc/71/57/66/387715766.db2.gz APMOTZWMAOBBSG-MWLCHTKSSA-N 2 0 239.388 2.244 20 0 BEADRP CC(C)Oc1ccc(C[NH2+][C@H](C)C2C[NH2+]C2)cc1 ZINC000422823488 387720962 /nfs/dbraw/zinc/72/09/62/387720962.db2.gz DKBLGXHOYMZOMR-GFCCVEGCSA-N 2 0 248.370 2.171 20 0 BEADRP C1CC2(C1)CCC[C@@H]2[NH2+][C@H]1CCC[NH2+]CC1 ZINC000643522772 387721871 /nfs/dbraw/zinc/72/18/71/387721871.db2.gz FFZMVVYBMYRENG-STQMWFEESA-N 2 0 222.376 2.441 20 0 BEADRP C[C@H](Cc1ccncc1)[NH2+]C1CCC(C[NH3+])CC1 ZINC000422831292 387723183 /nfs/dbraw/zinc/72/31/83/387723183.db2.gz DMNKQFHYCXPKJG-LRVUVFPRSA-N 2 0 247.386 2.120 20 0 BEADRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]CCCOC1CCCC1 ZINC000422834757 387726764 /nfs/dbraw/zinc/72/67/64/387726764.db2.gz XKQANKHVNIBJFS-TZMCWYRMSA-N 2 0 240.391 2.053 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)[C@@H]2CC23CC3)C1 ZINC000527849186 387755817 /nfs/dbraw/zinc/75/58/17/387755817.db2.gz KSDOVBIZQVIOMC-XQQFMLRXSA-N 2 0 222.376 2.106 20 0 BEADRP COC1CCC(C[NH2+][C@@H](C)CCCC[NH3+])CC1 ZINC000422842899 387733013 /nfs/dbraw/zinc/73/30/13/387733013.db2.gz ZMQMOCZKIHDYHY-HSBZDZAISA-N 2 0 242.407 2.299 20 0 BEADRP C([NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)[C@@H]1CCCS1 ZINC000128073865 387734598 /nfs/dbraw/zinc/73/45/98/387734598.db2.gz RUXARMORPGJVPC-UPJWGTAASA-N 2 0 240.416 2.098 20 0 BEADRP Cc1cccc(CC[NH2+][C@@H](C)C[C@H](C)[NH3+])c1 ZINC000422853524 387737398 /nfs/dbraw/zinc/73/73/98/387737398.db2.gz YZQSOPVBLLIKMC-STQMWFEESA-N 2 0 220.360 2.253 20 0 BEADRP C[C@H](CC[NH2+][C@@H](C)C1C[NH2+]C1)c1ccccc1 ZINC000422856584 387740525 /nfs/dbraw/zinc/74/05/25/387740525.db2.gz WZNGIVGOFRCUKD-OLZOCXBDSA-N 2 0 232.371 2.378 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]C[C@H](C)N(C)c1ccccc1 ZINC000422856202 387740829 /nfs/dbraw/zinc/74/08/29/387740829.db2.gz FTEYQYVKLZPGSS-IHRRRGAJSA-N 2 0 249.402 2.227 20 0 BEADRP C[C@@H]([NH2+]CC[C@H](C)c1ccccc1)C1C[NH2+]C1 ZINC000422856585 387742449 /nfs/dbraw/zinc/74/24/49/387742449.db2.gz WZNGIVGOFRCUKD-QWHCGFSZSA-N 2 0 232.371 2.378 20 0 BEADRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)[C@H]1CC12CC2 ZINC000527905326 387762169 /nfs/dbraw/zinc/76/21/69/387762169.db2.gz NJIRALPBUZSAAA-APYLGABCSA-N 2 0 234.387 2.390 20 0 BEADRP Cc1ccc(C[NH2+][C@H](C)C[C@H](C)[NH3+])s1 ZINC000422896093 387766296 /nfs/dbraw/zinc/76/62/96/387766296.db2.gz XJNLBLWWXBGMJV-DTWKUNHWSA-N 2 0 212.362 2.272 20 0 BEADRP C[C@@H]([NH3+])C[NH2+][C@H](C)CCc1ccccc1F ZINC000643528323 387767222 /nfs/dbraw/zinc/76/72/22/387767222.db2.gz HAUVSKVRIFENCT-GHMZBOCLSA-N 2 0 224.323 2.084 20 0 BEADRP Cc1ccc([C@@H]([NH2+]C[C@@H](C)[NH3+])C2CC2)cc1 ZINC000643528245 387768667 /nfs/dbraw/zinc/76/86/67/387768667.db2.gz FZFFWKRAPAWVCP-BXUZGUMPSA-N 2 0 218.344 2.383 20 0 BEADRP C[C@@H]([NH3+])C[NH2+][C@@H](C)CCc1cccc(F)c1 ZINC000643528556 387770031 /nfs/dbraw/zinc/77/00/31/387770031.db2.gz LJPLUEOYCJDFLM-MNOVXSKESA-N 2 0 224.323 2.084 20 0 BEADRP CC[C@@H](COC)[NH2+]CC1(C[NH+](C)C)CCCC1 ZINC000129475216 387770598 /nfs/dbraw/zinc/77/05/98/387770598.db2.gz RZFHBUQCVLMMOH-ZDUSSCGKSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CCCc1cccc(F)c1 ZINC000422912916 387770768 /nfs/dbraw/zinc/77/07/68/387770768.db2.gz XJEXNRZPAFNZBK-NEPJUHHUSA-N 2 0 238.350 2.474 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CCCc1cccc(F)c1 ZINC000422912919 387770945 /nfs/dbraw/zinc/77/09/45/387770945.db2.gz XJEXNRZPAFNZBK-VXGBXAGGSA-N 2 0 238.350 2.474 20 0 BEADRP C[C@H]([NH2+][C@H](Cc1ccccc1)C1CC1)C1C[NH2+]C1 ZINC000422914462 387771665 /nfs/dbraw/zinc/77/16/65/387771665.db2.gz UHVSOIBVGFFPLC-BLLLJJGKSA-N 2 0 244.382 2.205 20 0 BEADRP C[C@H]([NH3+])C[NH2+][C@H]1CCC[C@@H]1c1ccccc1 ZINC000643529024 387771749 /nfs/dbraw/zinc/77/17/49/387771749.db2.gz SUURVMGGPLSQCF-YUTCNCBUSA-N 2 0 218.344 2.260 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CC1(C)CC1 ZINC000422917128 387773530 /nfs/dbraw/zinc/77/35/30/387773530.db2.gz CNGUGESCOUFINH-SNVBAGLBSA-N 2 0 233.359 2.299 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]CCc1cc2ccccc2o1 ZINC000422915265 387773571 /nfs/dbraw/zinc/77/35/71/387773571.db2.gz AORKAWMXSKYFAF-KGLIPLIRSA-N 2 0 244.338 2.445 20 0 BEADRP CC(C)C1(C[NH2+][C@@H]2CC[NH2+]CC[C@H]2C)CC1 ZINC000422921473 387775156 /nfs/dbraw/zinc/77/51/56/387775156.db2.gz QANUJSFTBZQRPO-CHWSQXEVSA-N 2 0 224.392 2.400 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+][C@@H]1C[C@@H]1C1CCCCC1 ZINC000422919663 387776080 /nfs/dbraw/zinc/77/60/80/387776080.db2.gz KTGHUBJLSMKSGY-YIYPIFLZSA-N 2 0 222.376 2.425 20 0 BEADRP [NH3+][C@H]1CCCCC[C@@H]1[NH2+]CCC(F)(F)F ZINC000422919585 387776236 /nfs/dbraw/zinc/77/62/36/387776236.db2.gz KCFFSQCVIZGKFF-IUCAKERBSA-N 2 0 224.270 2.188 20 0 BEADRP COc1ccc([C@H](C)[C@@H](C)[NH2+]C[C@@H](C)[NH3+])cc1 ZINC000643529431 387776979 /nfs/dbraw/zinc/77/69/79/387776979.db2.gz ZRUFPEVGTFDJDB-IJLUTSLNSA-N 2 0 236.359 2.124 20 0 BEADRP C[C@@H]([NH3+])[C@H](Cc1ccccc1)[NH2+]CC1(C)CC1 ZINC000422922149 387777665 /nfs/dbraw/zinc/77/76/65/387777665.db2.gz SCHLNKVVWGXRFM-OCCSQVGLSA-N 2 0 232.371 2.335 20 0 BEADRP C[C@H]([NH2+][C@H]1C[C@@H]1C1CCCCC1)C1C[NH2+]C1 ZINC000422922023 387778225 /nfs/dbraw/zinc/77/82/25/387778225.db2.gz PLIGPVUQYCPUPH-GDLCADMTSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@H]1C[C@@H]1Cc1ccccc1 ZINC000422926661 387780229 /nfs/dbraw/zinc/78/02/29/387780229.db2.gz XGPPJCQSYMDSDG-JURCDPSOSA-N 2 0 232.371 2.333 20 0 BEADRP CC(C)CC1(C[NH2+][C@@H](C)C2C[NH2+]C2)CC1 ZINC000422926719 387780247 /nfs/dbraw/zinc/78/02/47/387780247.db2.gz DQIYLNYLNMFLFK-NSHDSACASA-N 2 0 210.365 2.010 20 0 BEADRP CC(C)CC1(C[NH2+][C@H](C)C2C[NH2+]C2)CC1 ZINC000422926718 387780459 /nfs/dbraw/zinc/78/04/59/387780459.db2.gz DQIYLNYLNMFLFK-LLVKDONJSA-N 2 0 210.365 2.010 20 0 BEADRP CC[C@@H]([NH2+]CC1(C2CC2)CC1)[C@@H]1CCC[NH2+]1 ZINC000422932428 387781148 /nfs/dbraw/zinc/78/11/48/387781148.db2.gz FSHDLNSLYKVJLR-OLZOCXBDSA-N 2 0 222.376 2.297 20 0 BEADRP Cc1cc(C)cc(OCC[NH2+][C@H]2CCC[C@@H]2[NH3+])c1 ZINC000422944356 387784919 /nfs/dbraw/zinc/78/49/19/387784919.db2.gz MBRHIDDFTPBZSP-GJZGRUSLSA-N 2 0 248.370 2.152 20 0 BEADRP CC[C@@H](C)C[NH2+]CCC[N@@H+]1CCCO[C@H](C)C1 ZINC000432355722 387785245 /nfs/dbraw/zinc/78/52/45/387785245.db2.gz FRBJMOZQWFEERC-ZIAGYGMSSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+]CCC(C)(C)C ZINC000422945024 387785239 /nfs/dbraw/zinc/78/52/39/387785239.db2.gz SYMRZDWZPXWVTN-NWDGAFQWSA-N 2 0 212.381 2.400 20 0 BEADRP CC[C@@H](C)C[NH2+]CCC[N@@H+]1CCCO[C@@H](C)C1 ZINC000432355720 387785406 /nfs/dbraw/zinc/78/54/06/387785406.db2.gz FRBJMOZQWFEERC-KGLIPLIRSA-N 2 0 242.407 2.123 20 0 BEADRP Cc1cccc(C)c1CC[NH2+][C@@H]1CCC[C@@H]1[NH3+] ZINC000422945103 387785560 /nfs/dbraw/zinc/78/55/60/387785560.db2.gz UAKVLSMLBQBKPN-LSDHHAIUSA-N 2 0 232.371 2.315 20 0 BEADRP Cc1cccc(C)c1CC[NH2+][C@@H]1CCC[C@H]1[NH3+] ZINC000422945102 387785615 /nfs/dbraw/zinc/78/56/15/387785615.db2.gz UAKVLSMLBQBKPN-HUUCEWRRSA-N 2 0 232.371 2.315 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+]CCC(C)(C)C ZINC000422945025 387785673 /nfs/dbraw/zinc/78/56/73/387785673.db2.gz SYMRZDWZPXWVTN-RYUDHWBXSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H](C[C@H]1CCCO1)[NH2+]C1CCC(C[NH3+])CC1 ZINC000422901673 387787196 /nfs/dbraw/zinc/78/71/96/387787196.db2.gz LMIISWKSJPZOSW-GFJIZPEISA-N 2 0 240.391 2.051 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]C[C@@H]1CCc2ccccc21 ZINC000422902100 387787219 /nfs/dbraw/zinc/78/72/19/387787219.db2.gz CXMONUHMHACGSC-OCCSQVGLSA-N 2 0 232.371 2.433 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)[C@@H]1CC12CC2 ZINC000527918348 387787997 /nfs/dbraw/zinc/78/79/97/387787997.db2.gz WDLKUYWBIJRZNZ-MJBXVCDLSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@H]1CCc2c1cccc2O ZINC000422980839 387791477 /nfs/dbraw/zinc/79/14/77/387791477.db2.gz RHPNZVOBKJHJFU-RISCZKNCSA-N 2 0 248.370 2.487 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1CCc2c1cccc2O ZINC000422980836 387792225 /nfs/dbraw/zinc/79/22/25/387792225.db2.gz RHPNZVOBKJHJFU-BXUZGUMPSA-N 2 0 248.370 2.487 20 0 BEADRP CCC[C@@H](C[NH2+]C1CC[NH+](CC)CC1)OCC ZINC000527928502 387793468 /nfs/dbraw/zinc/79/34/68/387793468.db2.gz FRBFTPGMLPKYOV-AWEZNQCLSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@@H](C)Cc1ccc(O)cc1 ZINC000422982961 387794120 /nfs/dbraw/zinc/79/41/20/387794120.db2.gz YHIQSLKAFJNKEN-TUAOUCFPSA-N 2 0 236.359 2.039 20 0 BEADRP CCC[C@H](C[NH2+][C@@H]1CC[N@H+](C)C[C@H]1C)OCC ZINC000527931945 387794675 /nfs/dbraw/zinc/79/46/75/387794675.db2.gz ONFWXFBPOPPQRD-MGPQQGTHSA-N 2 0 242.407 2.121 20 0 BEADRP CCC[C@H](C[NH2+][C@H]1CC[N@H+](C)C[C@@H]1C)OCC ZINC000527931948 387795188 /nfs/dbraw/zinc/79/51/88/387795188.db2.gz ONFWXFBPOPPQRD-MJBXVCDLSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+][C@H](C)c1ccccc1 ZINC000422986725 387795268 /nfs/dbraw/zinc/79/52/68/387795268.db2.gz HFMFHXXJCVJXHV-IJLUTSLNSA-N 2 0 206.333 2.463 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@H]1CCCC(F)(F)C1 ZINC000422985918 387796317 /nfs/dbraw/zinc/79/63/17/387796317.db2.gz BAJLYLBUKMCFSZ-GUBZILKMSA-N 2 0 220.307 2.280 20 0 BEADRP CCC(CC)[C@H](CC[NH2+][C@@H]1CCC[C@H]1[NH3+])OC ZINC000422991534 387799371 /nfs/dbraw/zinc/79/93/71/387799371.db2.gz BLWFJPORXGOSSB-MCIONIFRSA-N 2 0 242.407 2.297 20 0 BEADRP CC(C)(CCCO)C[NH2+][C@@H]1CCCCC[C@H]1[NH3+] ZINC000422992008 387800766 /nfs/dbraw/zinc/80/07/66/387800766.db2.gz PLGBLVXQBKMBBG-CHWSQXEVSA-N 2 0 242.407 2.035 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC=CCC1)[C@@H]1CCC[NH2+]1 ZINC000422997681 387801775 /nfs/dbraw/zinc/80/17/75/387801775.db2.gz VHFJSTCRFOQMQE-AGIUHOORSA-N 2 0 208.349 2.215 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H](C)[C@@H]1COc2ccccc21 ZINC000422997762 387803388 /nfs/dbraw/zinc/80/33/88/387803388.db2.gz BVSNBXOSJCIWQY-DYEKYZERSA-N 2 0 248.370 2.268 20 0 BEADRP C[NH+](C)CC1(C[NH2+]CC2(C)CC2)CCCC1 ZINC000309482671 387803859 /nfs/dbraw/zinc/80/38/59/387803859.db2.gz UGEAZVSLYMSYPJ-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP CC1CC([NH2+]C[C@H]2CCN2C2CCCC2)C1 ZINC000527999171 387805132 /nfs/dbraw/zinc/80/51/32/387805132.db2.gz FPEUGFHGJPFLIQ-ORHYLEIMSA-N 2 0 222.376 2.391 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]C[C@H]1CC1(C)C ZINC000422954361 387808795 /nfs/dbraw/zinc/80/87/95/387808795.db2.gz IJTQIKNFZXAKBJ-UTUOFQBUSA-N 2 0 210.365 2.010 20 0 BEADRP COC[C@H]([NH2+][C@@H](C)C[C@H](C)[NH3+])c1ccccc1 ZINC000422954310 387809086 /nfs/dbraw/zinc/80/90/86/387809086.db2.gz HYFXDZAUCMFGCT-OBJOEFQTSA-N 2 0 236.359 2.090 20 0 BEADRP Cc1ccccc1C[C@@H]([NH2+]C[C@@H](C)[NH3+])C1CC1 ZINC000643526677 387756823 /nfs/dbraw/zinc/75/68/23/387756823.db2.gz DRVAAQSQCCPPOU-IUODEOHRSA-N 2 0 232.371 2.253 20 0 BEADRP COc1cccc2c1CC[C@@H]2[NH2+][C@@H](C)C[C@@H](C)[NH3+] ZINC000422888911 387759248 /nfs/dbraw/zinc/75/92/48/387759248.db2.gz OGVQRTPEQZTOCX-SUNKGSAMSA-N 2 0 248.370 2.398 20 0 BEADRP C[C@@H]([NH3+])C[NH2+][C@@H](C)C1CCC(F)(F)CC1 ZINC000643526942 387760218 /nfs/dbraw/zinc/76/02/18/387760218.db2.gz HUMPIUVBZZEBCB-BDAKNGLRSA-N 2 0 220.307 2.137 20 0 BEADRP CC(C)[C@H]1CC[C@@H](C)C[C@@H]1[NH2+]C[C@H](C)[NH3+] ZINC000643526738 387760605 /nfs/dbraw/zinc/76/06/05/387760605.db2.gz FQHJREMIYXVZHA-XQHKEYJVSA-N 2 0 212.381 2.384 20 0 BEADRP Cc1nc(C)c(CC[NH2+][C@H](C)C[C@H](C)[NH3+])s1 ZINC000422885575 387761287 /nfs/dbraw/zinc/76/12/87/387761287.db2.gz HAWHDSGJYLVQTN-DTWKUNHWSA-N 2 0 241.404 2.018 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+]CCCCc1ccccc1 ZINC000643458314 387822987 /nfs/dbraw/zinc/82/29/87/387822987.db2.gz IUBXJFPFLVZPID-LSDHHAIUSA-N 2 0 232.371 2.479 20 0 BEADRP CCOc1ccc([C@@H](C)[NH2+][C@@H](C)C2C[NH2+]C2)cc1 ZINC000643458350 387824017 /nfs/dbraw/zinc/82/40/17/387824017.db2.gz PTRAGXIPSOKZSI-NEPJUHHUSA-N 2 0 248.370 2.344 20 0 BEADRP CC(C)[NH+](CCC[NH2+][C@@H](C)CCC[NH3+])C(C)C ZINC000423004069 387825689 /nfs/dbraw/zinc/82/56/89/387825689.db2.gz JATFDFQOSQJRMJ-AWEZNQCLSA-N 3 0 243.439 2.212 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]1[NH2+]CC1(C2CC2)CCC1 ZINC000423005636 387827871 /nfs/dbraw/zinc/82/78/71/387827871.db2.gz SPAPQHPRYQMPFF-RYUDHWBXSA-N 2 0 208.349 2.036 20 0 BEADRP CCCC[C@H]([NH3+])C(=O)Nc1ccc([C@H](C)[NH3+])cc1 ZINC000442722564 387828367 /nfs/dbraw/zinc/82/83/67/387828367.db2.gz XQEBQPKIZJUNTH-GWCFXTLKSA-N 2 0 249.358 2.162 20 0 BEADRP COc1cc(C)cc(C[NH2+][C@@H](C)CCC[NH3+])c1 ZINC000423007675 387829419 /nfs/dbraw/zinc/82/94/19/387829419.db2.gz YGEKOGAGWKMELC-LBPRGKRZSA-N 2 0 236.359 2.221 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1 ZINC000423008703 387832039 /nfs/dbraw/zinc/83/20/39/387832039.db2.gz UDEMXTDHNINPCA-MBNYWOFBSA-N 2 0 236.359 2.188 20 0 BEADRP CC[C@H]([NH2+]CCSCC(C)C)[C@@H]1CCC[NH2+]1 ZINC000423010565 387833281 /nfs/dbraw/zinc/83/32/81/387833281.db2.gz GYLUFGBSYQHZKT-STQMWFEESA-N 2 0 244.448 2.496 20 0 BEADRP CC[C@H]([NH2+][C@@H](C)C[C@H](C)[NH3+])c1c(C)noc1C ZINC000423015248 387838261 /nfs/dbraw/zinc/83/82/61/387838261.db2.gz QOFGEFJVXCXNJQ-AUTRQRHGSA-N 2 0 239.363 2.458 20 0 BEADRP COc1cc(F)cc(C[NH2+][C@@H](C)C[C@H](C)[NH3+])c1 ZINC000423015673 387839370 /nfs/dbraw/zinc/83/93/70/387839370.db2.gz LDYZBIUTJYEXMB-UWVGGRQHSA-N 2 0 240.322 2.050 20 0 BEADRP Cc1ccsc1CC[NH2+][C@@H]1CCC[C@H]1C[NH3+] ZINC000423015007 387839660 /nfs/dbraw/zinc/83/96/60/387839660.db2.gz JVAZFKSSVDVEKB-NWDGAFQWSA-N 2 0 238.400 2.316 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@@H](c1cccnc1)C1CC1 ZINC000423017032 387840526 /nfs/dbraw/zinc/84/05/26/387840526.db2.gz VHSJCMDYMBKXNJ-SMDDNHRTSA-N 2 0 233.359 2.250 20 0 BEADRP CCCNc1ccc(C[NH2+][C@H]2CCC[C@@H]2[NH3+])cc1 ZINC000423073474 387873621 /nfs/dbraw/zinc/87/36/21/387873621.db2.gz ITFBOAINROSKPA-GJZGRUSLSA-N 2 0 247.386 2.478 20 0 BEADRP [NH3+]CC1CCC([NH2+]C[C@@H]2CCCCS2)CC1 ZINC000423025991 387842748 /nfs/dbraw/zinc/84/27/48/387842748.db2.gz AKFFUWPVBSBMPR-BPCQOVAHSA-N 2 0 242.432 2.379 20 0 BEADRP Cc1cnc([C@H](C)C[NH2+][C@@H]2CCC[C@@H]2[NH3+])s1 ZINC000423031790 387846139 /nfs/dbraw/zinc/84/61/39/387846139.db2.gz DQTBHZQJOVIAQO-DVVUODLYSA-N 2 0 239.388 2.024 20 0 BEADRP COCCC(C)(C)C[NH2+][C@H]1CC[NH2+]CC[C@@H]1C ZINC000423030339 387846495 /nfs/dbraw/zinc/84/64/95/387846495.db2.gz BIDZIYZIBICQPI-STQMWFEESA-N 2 0 242.407 2.027 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@H](CO)CC1CCCC1 ZINC000423031106 387847072 /nfs/dbraw/zinc/84/70/72/387847072.db2.gz WPILXFTZUAGVAY-JSGCOSHPSA-N 2 0 242.407 2.035 20 0 BEADRP Cc1ccc([C@H](C)[NH2+][C@H]2CC23CC[NH2+]CC3)o1 ZINC000643533742 387849109 /nfs/dbraw/zinc/84/91/09/387849109.db2.gz CPKZAQMNLLKCKO-AAEUAGOBSA-N 2 0 234.343 2.381 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1ccccc1 ZINC000643533692 387849171 /nfs/dbraw/zinc/84/91/71/387849171.db2.gz BTSKUESEHQJEHF-TZMCWYRMSA-N 2 0 230.355 2.479 20 0 BEADRP C[C@@H](CCc1ccco1)[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000643533996 387850261 /nfs/dbraw/zinc/85/02/61/387850261.db2.gz JGCHSKUPZGIWPX-GXTWGEPZSA-N 2 0 248.370 2.332 20 0 BEADRP CC[C@@H]([NH2+][C@H]1CC12CC[NH2+]CC2)C(C)C ZINC000643533806 387850363 /nfs/dbraw/zinc/85/03/63/387850363.db2.gz FEOZRFAEYWSZEK-NEPJUHHUSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@@H](CC(F)(F)F)[NH2+][C@@H](C)CCC[NH3+] ZINC000423035404 387851726 /nfs/dbraw/zinc/85/17/26/387851726.db2.gz JHZWKDZEGOXULS-IUCAKERBSA-N 2 0 226.286 2.434 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[C@@H](C)[C@H](C)C1)C1C[NH2+]C1 ZINC000423040757 387852532 /nfs/dbraw/zinc/85/25/32/387852532.db2.gz VCBOQZMLLBIDSY-UZWSLXQKSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@H]([NH2+]C1CCC(C[NH3+])CC1)[C@H]1CCCCO1 ZINC000423041003 387852577 /nfs/dbraw/zinc/85/25/77/387852577.db2.gz IHVSVMMKNFOHCG-GFJIZPEISA-N 2 0 240.391 2.051 20 0 BEADRP CS[C@@H](C[NH2+][C@H](C)CCC[NH3+])C(C)(C)C ZINC000423038683 387853151 /nfs/dbraw/zinc/85/31/51/387853151.db2.gz YZHHXXKWHIBYRK-MNOVXSKESA-N 2 0 232.437 2.481 20 0 BEADRP CC[C@@H]([NH2+]CC[C@@H]1CCCCO1)[C@@H]1CCC[NH2+]1 ZINC000423043314 387854713 /nfs/dbraw/zinc/85/47/13/387854713.db2.gz OHKKOTZKFCLRHP-MJBXVCDLSA-N 2 0 240.391 2.066 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCCC[C@@H]1C[NH3+])c1ccncc1 ZINC000643460395 387874280 /nfs/dbraw/zinc/87/42/80/387874280.db2.gz YUNBEFQZZJMEBC-YUELXQCFSA-N 2 0 247.386 2.292 20 0 BEADRP CSCCCCC[NH2+][C@@H]1CNCC[C@H]1C ZINC000423049092 387857451 /nfs/dbraw/zinc/85/74/51/387857451.db2.gz IVVXBFMYAZZTCX-VXGBXAGGSA-N 2 0 230.421 2.107 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1cncc(F)c1 ZINC000643534756 387860428 /nfs/dbraw/zinc/86/04/28/387860428.db2.gz CHOPXEQYJQEBHT-GXFFZTMASA-N 2 0 249.333 2.013 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC[NH2+]CC[C@H]1C)C(F)(F)F ZINC000423052050 387860950 /nfs/dbraw/zinc/86/09/50/387860950.db2.gz OYUHSVCZIIFHOA-BBBLOLIVSA-N 2 0 238.297 2.163 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCCCC[C@@H]1[NH3+])C(F)(F)F ZINC000423052227 387861099 /nfs/dbraw/zinc/86/10/99/387861099.db2.gz PFUSZPBAOHIJNZ-UTLUCORTSA-N 2 0 238.297 2.434 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1cccc(O)c1 ZINC000643534943 387861737 /nfs/dbraw/zinc/86/17/37/387861737.db2.gz GEFTZIXJRFRUBN-BXUZGUMPSA-N 2 0 246.354 2.185 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCCC[C@H]1C[NH3+])C(F)(F)F ZINC000423056962 387863365 /nfs/dbraw/zinc/86/33/65/387863365.db2.gz YMNWYHWVEPYEAV-KXUCPTDWSA-N 2 0 238.297 2.292 20 0 BEADRP CC(C)[C@@H](CC(F)(F)F)[NH2+][C@H](C)C1C[NH2+]C1 ZINC000423059049 387864098 /nfs/dbraw/zinc/86/40/98/387864098.db2.gz KUYVBRBDQYZXGB-PSASIEDQSA-N 2 0 238.297 2.161 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@@H]2CCCCC[C@H]2[NH3+])C1 ZINC000423059625 387864469 /nfs/dbraw/zinc/86/44/69/387864469.db2.gz GDFCTCYXBUHPPX-YVECIDJPSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@@H](C)CC1)C1C[NH2+]C1 ZINC000423059925 387864894 /nfs/dbraw/zinc/86/48/94/387864894.db2.gz NFDZTTAOEFXORV-MDZLAQPJSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1ccc(F)cn1 ZINC000643535845 387865458 /nfs/dbraw/zinc/86/54/58/387865458.db2.gz PKTVXTJLMYOJDS-GXFFZTMASA-N 2 0 249.333 2.013 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCC[C@@H](C)CC1)C1C[NH2+]C1 ZINC000423059928 387865768 /nfs/dbraw/zinc/86/57/68/387865768.db2.gz NFDZTTAOEFXORV-WZRBSPASSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H](C[NH2+]C1CCC(C[NH3+])CC1)c1ccncc1 ZINC000643460359 387874628 /nfs/dbraw/zinc/87/46/28/387874628.db2.gz VUKOWRNXWQMWQR-DNOWBOINSA-N 2 0 247.386 2.292 20 0 BEADRP CC(C)[C@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)C1CC1 ZINC000643536169 387867006 /nfs/dbraw/zinc/86/70/06/387867006.db2.gz RZSVDKBUFWMUBJ-OLZOCXBDSA-N 2 0 222.376 2.153 20 0 BEADRP CO[C@H](C)[C@H](C)[NH2+][C@@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000423064976 387867199 /nfs/dbraw/zinc/86/71/99/387867199.db2.gz AKZUMSHHSGBLFG-IGQOVBAYSA-N 2 0 242.407 2.310 20 0 BEADRP C[C@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1ccoc1 ZINC000643536165 387867978 /nfs/dbraw/zinc/86/79/78/387867978.db2.gz RZFBKWTVSKCGLS-JQWIXIFHSA-N 2 0 220.316 2.072 20 0 BEADRP CO[C@H](C)[C@H](C)[NH2+][C@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000423064977 387868016 /nfs/dbraw/zinc/86/80/16/387868016.db2.gz AKZUMSHHSGBLFG-RQJABVFESA-N 2 0 242.407 2.310 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)C(C)(C)C ZINC000643536498 387869236 /nfs/dbraw/zinc/86/92/36/387869236.db2.gz UKQGDVIWQYPBAY-GHMZBOCLSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)C(C[NH2+][C@H]1CCC[C@@H]1[NH3+])C(C)C ZINC000423068348 387870582 /nfs/dbraw/zinc/87/05/82/387870582.db2.gz JVCONBBQWJWBHW-STQMWFEESA-N 2 0 212.381 2.384 20 0 BEADRP CCC(O)(CC)CC[NH2+][C@@H]1CCCC[C@@H]1C[NH3+] ZINC000423067094 387870672 /nfs/dbraw/zinc/87/06/72/387870672.db2.gz GHZAGFNQDFNGIQ-CHWSQXEVSA-N 2 0 242.407 2.035 20 0 BEADRP CCCNc1ccc(C[NH2+][C@H]2CCC[C@H]2[NH3+])cc1 ZINC000423073472 387874805 /nfs/dbraw/zinc/87/48/05/387874805.db2.gz ITFBOAINROSKPA-CABCVRRESA-N 2 0 247.386 2.478 20 0 BEADRP C[C@@H]([NH3+])C[N@@H+]1CCC[C@@H]1Cc1ccccc1 ZINC000442662742 387814694 /nfs/dbraw/zinc/81/46/94/387814694.db2.gz IEIHQQZPXRPMPT-TZMCWYRMSA-N 2 0 218.344 2.041 20 0 BEADRP COc1ccccc1C[C@H]1CCCN1C[C@H](C)[NH3+] ZINC000442656099 387815408 /nfs/dbraw/zinc/81/54/08/387815408.db2.gz DOCQMWPUBFETBO-GXTWGEPZSA-N 2 0 248.370 2.049 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000422967862 387816295 /nfs/dbraw/zinc/81/62/95/387816295.db2.gz UOSKPIPMNLOPRQ-HABKJSAYSA-N 2 0 248.370 2.473 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+][C@H]1C[C@H](c2ccccc2)C1 ZINC000422970230 387818058 /nfs/dbraw/zinc/81/80/58/387818058.db2.gz VZMNMPHSWGCCRV-KBUPBQIOSA-N 2 0 230.355 2.402 20 0 BEADRP COc1ccccc1[C@H]1CCCN1C[C@H](C)[NH3+] ZINC000442667197 387818802 /nfs/dbraw/zinc/81/88/02/387818802.db2.gz YOKIRYKCWWZKKJ-WCQYABFASA-N 2 0 234.343 2.179 20 0 BEADRP Cc1cnccc1CC[N@@H+](C)C[C@H]1CCC[C@@H]1O ZINC000564081155 387819424 /nfs/dbraw/zinc/81/94/24/387819424.db2.gz ZDVPRGORBQBCTH-CABCVRRESA-N 2 0 248.370 2.025 20 0 BEADRP COc1ccccc1[C@@H]1CCCN1C[C@H](C)[NH3+] ZINC000442667194 387819525 /nfs/dbraw/zinc/81/95/25/387819525.db2.gz YOKIRYKCWWZKKJ-AAEUAGOBSA-N 2 0 234.343 2.179 20 0 BEADRP Cc1cc([C@H](C)[NH2+][C@@H](C)CCCC[NH3+])no1 ZINC000423105775 387891170 /nfs/dbraw/zinc/89/11/70/387891170.db2.gz CKEOWQAIBZONSW-ONGXEEELSA-N 2 0 225.336 2.151 20 0 BEADRP C[C@@H]1CC(CC[NH2+][C@@H]2CCC[C@@H]2[NH3+])C[C@@H](C)O1 ZINC000423106837 387892078 /nfs/dbraw/zinc/89/20/78/387892078.db2.gz DLVCCCPPJLKORV-MHDGFBEUSA-N 2 0 240.391 2.050 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[C@H]1C)[C@@H]1CCC[NH2+]1 ZINC000423110912 387892373 /nfs/dbraw/zinc/89/23/73/387892373.db2.gz WGIWZWNGRBSHMD-VOAKCMCISA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[C@H]1C)[C@H]1CCC[NH2+]1 ZINC000423110910 387892385 /nfs/dbraw/zinc/89/23/85/387892385.db2.gz WGIWZWNGRBSHMD-MROQNXINSA-N 2 0 210.365 2.153 20 0 BEADRP CC1=CCC[C@@H](C)[C@@H]1C[N@H+]1C[C@H]2C[NH+](C)C[C@H]2C1 ZINC000194543049 387893142 /nfs/dbraw/zinc/89/31/42/387893142.db2.gz ADKJSMTXAOIOAS-LVQVYYBASA-N 2 0 248.414 2.472 20 0 BEADRP Cc1cc2cc(C[NH2+][C@@H](C)C3C[NH2+]C3)ccc2[nH]1 ZINC000423109602 387893353 /nfs/dbraw/zinc/89/33/53/387893353.db2.gz NWYKQDOQMNBDRE-NSHDSACASA-N 2 0 243.354 2.174 20 0 BEADRP C[C@@H]([NH2+]CC1CC(c2ccccc2)C1)C1C[NH2+]C1 ZINC000423110406 387893866 /nfs/dbraw/zinc/89/38/66/387893866.db2.gz HXZMRTLIZAENAV-DNOWBOINSA-N 2 0 244.382 2.378 20 0 BEADRP COCC1(C[NH2+][C@@H]2CCCCC[C@@H]2[NH3+])CCC1 ZINC000423110672 387894008 /nfs/dbraw/zinc/89/40/08/387894008.db2.gz IGLPQMJBCVOMIC-QWHCGFSZSA-N 2 0 240.391 2.053 20 0 BEADRP C[C@H]1CCC[C@H]1C[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000423109820 387894229 /nfs/dbraw/zinc/89/42/29/387894229.db2.gz VBLCZLOSMADGMP-CSHRUCKSSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+][C@H]1CCC1(C)C ZINC000423113346 387896819 /nfs/dbraw/zinc/89/68/19/387896819.db2.gz UDWKQGYHGQOPCP-UTUOFQBUSA-N 2 0 210.365 2.153 20 0 BEADRP CCSCCC[NH2+][C@@H](CC)[C@@H]1CCC[NH2+]1 ZINC000423115073 387896962 /nfs/dbraw/zinc/89/69/62/387896962.db2.gz MRIJEUBMHLXPLM-RYUDHWBXSA-N 2 0 230.421 2.250 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H]1CCC12CCCC2 ZINC000423077821 387875989 /nfs/dbraw/zinc/87/59/89/387875989.db2.gz URYXGSABJVWXEI-SDDRHHMPSA-N 2 0 210.365 2.425 20 0 BEADRP CCCNc1ccc(C[NH2+][C@H](C)C2C[NH2+]C2)cc1 ZINC000423076280 387876032 /nfs/dbraw/zinc/87/60/32/387876032.db2.gz QTARGDQBFNPZFG-GFCCVEGCSA-N 2 0 247.386 2.206 20 0 BEADRP CC(C)C1CC([NH2+][C@H](C)[C@@H]2CCC[NH2+]C2)C1 ZINC000423077636 387876698 /nfs/dbraw/zinc/87/66/98/387876698.db2.gz MLQRICWFRCOTRN-IWMBGFJWSA-N 2 0 224.392 2.399 20 0 BEADRP CSC1(C[NH2+][C@@H]2CC[NH2+]CC[C@@H]2C)CCC1 ZINC000423086186 387880345 /nfs/dbraw/zinc/88/03/45/387880345.db2.gz LMOKRNSDDNXTCR-NWDGAFQWSA-N 2 0 242.432 2.250 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@@H](C)Cc1cccs1 ZINC000643540247 387880909 /nfs/dbraw/zinc/88/09/09/387880909.db2.gz LJBQMNUNXBDCIC-UWVGGRQHSA-N 2 0 212.362 2.006 20 0 BEADRP CC[C@H](Cc1cccs1)[NH2+][C@H](C)[C@H](C)[NH3+] ZINC000643539944 387881681 /nfs/dbraw/zinc/88/16/81/387881681.db2.gz YEJBDATZTGDBQM-HBNTYKKESA-N 2 0 226.389 2.395 20 0 BEADRP CSC1(C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)CCC1 ZINC000423090594 387882396 /nfs/dbraw/zinc/88/23/96/387882396.db2.gz VSXPFVNNLLDUAM-FOSCPWQOSA-N 2 0 240.416 2.145 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CCCc1ccccc1F ZINC000423095431 387884571 /nfs/dbraw/zinc/88/45/71/387884571.db2.gz MDLLCPIJBMXXPA-NWDGAFQWSA-N 2 0 238.350 2.474 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[N@@H+]1CCC[C@@]2(CCSC2)C1 ZINC000423163723 387898679 /nfs/dbraw/zinc/89/86/79/387898679.db2.gz RNTWLLBWAVDEEM-RWMBFGLXSA-N 2 0 242.432 2.331 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](CO)CCC(C)(C)C ZINC000423098817 387887500 /nfs/dbraw/zinc/88/75/00/387887500.db2.gz SMSRWKNDEQBZCF-QWHCGFSZSA-N 2 0 244.423 2.281 20 0 BEADRP C[C@H]1CC[C@H](C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000423101255 387888872 /nfs/dbraw/zinc/88/88/72/387888872.db2.gz VSAYZIWPVNFSRC-CSHRUCKSSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@@H]1CC2CCC1CC2 ZINC000423124201 387903289 /nfs/dbraw/zinc/90/32/89/387903289.db2.gz GCZXDYQFCQDLGT-RQRKLZJJSA-N 2 0 210.365 2.281 20 0 BEADRP C=Cc1ccc(CC[NH2+][C@H](C)[C@H]2CC[NH2+]C2)cc1 ZINC000423125553 387905369 /nfs/dbraw/zinc/90/53/69/387905369.db2.gz ADXJHSFMMJABKE-CJNGLKHVSA-N 2 0 244.382 2.460 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]1[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC000423126546 387905474 /nfs/dbraw/zinc/90/54/74/387905474.db2.gz AVTYFZJRPLYGSL-AJNGGQMLSA-N 2 0 230.355 2.260 20 0 BEADRP COCC1(C[NH2+][C@@H]2CCC[C@H]2[NH3+])CCCCC1 ZINC000423134196 387911364 /nfs/dbraw/zinc/91/13/64/387911364.db2.gz DNVKHDMYPBEVJT-CHWSQXEVSA-N 2 0 240.391 2.053 20 0 BEADRP C1C[C@H]2CC([NH2+][C@@H]3CC4CCC3CC4)C[C@@H]1[NH2+]2 ZINC000423134827 387912288 /nfs/dbraw/zinc/91/22/88/387912288.db2.gz SFXVKSZETIQYDG-NAZAYILJSA-N 2 0 234.387 2.438 20 0 BEADRP Cc1cccnc1CC[NH2+][C@H]1CCCCC[C@@H]1[NH3+] ZINC000423151969 387929593 /nfs/dbraw/zinc/92/95/93/387929593.db2.gz LAJIHAIZTSXXRZ-ZFWWWQNUSA-N 2 0 247.386 2.182 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]C[C@@H]1CCCC1(F)F ZINC000423156383 387937349 /nfs/dbraw/zinc/93/73/49/387937349.db2.gz SILLMZKOBQILJP-GRYCIOLGSA-N 2 0 246.345 2.400 20 0 BEADRP C[C@H](CC(C)(C)C)[NH2+][C@@H]1CCOC[C@@H]1[C@H](C)[NH3+] ZINC000423157656 387936167 /nfs/dbraw/zinc/93/61/67/387936167.db2.gz BKNZWJQKWIZFAK-YVECIDJPSA-N 2 0 242.407 2.153 20 0 BEADRP Cc1cccc2c1OC[C@H]([NH2+][C@H](C)C[C@H](C)[NH3+])C2 ZINC000423144411 387920169 /nfs/dbraw/zinc/92/01/69/387920169.db2.gz YWIZXVORNITQEH-OUCADQQQSA-N 2 0 248.370 2.014 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CSc2ccccc21 ZINC000423142907 387921583 /nfs/dbraw/zinc/92/15/83/387921583.db2.gz BPHRLAIRYCANDY-RTXFEEFZSA-N 2 0 248.395 2.345 20 0 BEADRP CC[C@@H]([NH2+][C@@H](C)CCCC[NH3+])C(F)F ZINC000423145998 387923683 /nfs/dbraw/zinc/92/36/83/387923683.db2.gz NKKYCAAHYFAZFO-DTWKUNHWSA-N 2 0 208.296 2.137 20 0 BEADRP F[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000423148180 387924027 /nfs/dbraw/zinc/92/40/27/387924027.db2.gz UTIXIQNJSHIZQA-KSTCHIGDSA-N 2 0 240.366 2.387 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]C[C@H]1CCCC1(F)F ZINC000423146645 387924886 /nfs/dbraw/zinc/92/48/86/387924886.db2.gz BAGKFZYVMDYAIM-IVZWLZJFSA-N 2 0 220.307 2.137 20 0 BEADRP CC[C@H]([NH2+]CC1(N(C)C)CCC1)[C@H]1C[C@H]1C ZINC000321153027 387952151 /nfs/dbraw/zinc/95/21/51/387952151.db2.gz WLISNLOWYLUVIV-AGIUHOORSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]C[C@@H]1C[C@H]1C1CCC1 ZINC000424288177 387952068 /nfs/dbraw/zinc/95/20/68/387952068.db2.gz IGLOJIYQASLAGX-CYUUQNCZSA-N 2 0 236.403 2.352 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]CC(C)(C)C1(O)CCCC1 ZINC000423169517 387955564 /nfs/dbraw/zinc/95/55/64/387955564.db2.gz WEGTWKDVCNLPAA-LBPRGKRZSA-N 2 0 242.407 2.035 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)C1(C)CC1 ZINC000044533948 387938064 /nfs/dbraw/zinc/93/80/64/387938064.db2.gz HQTBDDFTVQZHTD-RYUDHWBXSA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H]1C[C@H]1CC)[C@@H]1CCC[NH2+]1 ZINC000423158626 387938115 /nfs/dbraw/zinc/93/81/15/387938115.db2.gz WWGMUSRKVMJTTH-XQHKEYJVSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@]1(C(C)C)C[C@@H]1[NH2+][C@@H]1CCC[C@@H]1[NH3+] ZINC000423160763 387940678 /nfs/dbraw/zinc/94/06/78/387940678.db2.gz HULSAPNJPIRPMA-QNWHQSFQSA-N 2 0 210.365 2.281 20 0 BEADRP CC[C@H]([NH2+][C@@H](C)C1C[NH2+]C1)C1CCCC1 ZINC000423162462 387942790 /nfs/dbraw/zinc/94/27/90/387942790.db2.gz PILCVAHVKMSHSI-GWCFXTLKSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@]1(C(C)C)C[C@H]1[NH2+]C1CC[NH2+]CC1 ZINC000423162124 387942818 /nfs/dbraw/zinc/94/28/18/387942818.db2.gz KNFSGTQRJQWPHD-CHWSQXEVSA-N 2 0 210.365 2.153 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]C[C@@H]1C[C@H]1C1CC1 ZINC000423162398 387944537 /nfs/dbraw/zinc/94/45/37/387944537.db2.gz LAHCWWPJWNOWLQ-XUXIUFHCSA-N 2 0 222.376 2.140 20 0 BEADRP CCC1([NH2+][C@H](C)c2ccc(C[NH3+])nc2C)CC1 ZINC000423163981 387946657 /nfs/dbraw/zinc/94/66/57/387946657.db2.gz WIOSOXVAQQAHAJ-LLVKDONJSA-N 2 0 233.359 2.442 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1CC[N@H+](CC)C1)[C@@H]1C[C@H]1C ZINC000321096413 387946819 /nfs/dbraw/zinc/94/68/19/387946819.db2.gz OGMGPKLYCBCSQK-RQJABVFESA-N 2 0 224.392 2.352 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+][C@H](C)CCC=C(C)C ZINC000423165038 387947717 /nfs/dbraw/zinc/94/77/17/387947717.db2.gz XPOQJJOKYLIBKC-ZIAGYGMSSA-N 2 0 242.407 2.465 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+][C@H](C)CCC=C(C)C ZINC000423165035 387947737 /nfs/dbraw/zinc/94/77/37/387947737.db2.gz XPOQJJOKYLIBKC-KGLIPLIRSA-N 2 0 242.407 2.465 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1CC[N@H+](CC)C1)[C@H]1C[C@@H]1C ZINC000321096415 387947855 /nfs/dbraw/zinc/94/78/55/387947855.db2.gz OGMGPKLYCBCSQK-XUXIUFHCSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H](CCCC[NH3+])[N@@H+]1CCC[C@]2(CCOC2)C1 ZINC000423164542 387948056 /nfs/dbraw/zinc/94/80/56/387948056.db2.gz SWPKWSCJPLBVBM-KBPBESRZSA-N 2 0 240.391 2.006 20 0 BEADRP CCO[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)CCC[NH3+] ZINC000423165370 387948088 /nfs/dbraw/zinc/94/80/88/387948088.db2.gz PWGYJRKIMWNWNK-YNEHKIRRSA-N 2 0 228.380 2.051 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)[C@H]1C[C@H]1C ZINC000321097752 387948157 /nfs/dbraw/zinc/94/81/57/387948157.db2.gz OKQWFHGOOLBSSH-DHMWGJHJSA-N 2 0 236.403 2.495 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]CC1(C2CCC2)CCC1 ZINC000423164441 387948776 /nfs/dbraw/zinc/94/87/76/387948776.db2.gz OQWCZHBKBUPTIA-OLZOCXBDSA-N 2 0 222.376 2.426 20 0 BEADRP [NH3+]C[C@H]1CCC[C@H]1[NH2+][C@@H]1C[C@H]1c1ccccc1F ZINC000423166820 387950746 /nfs/dbraw/zinc/95/07/46/387950746.db2.gz DLJNNQQSYAIAJO-DZGBDDFRSA-N 2 0 248.345 2.399 20 0 BEADRP CC(C)=CCC[C@@H](C)[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000423165962 387950818 /nfs/dbraw/zinc/95/08/18/387950818.db2.gz YOCXXKPHTVUIDI-NEPJUHHUSA-N 2 0 210.365 2.319 20 0 BEADRP C[C@@H](Cc1ccoc1)[NH2+]CC1([NH3+])CCCCC1 ZINC000423175065 387962346 /nfs/dbraw/zinc/96/23/46/387962346.db2.gz CSWKIJRZLPUNON-LBPRGKRZSA-N 2 0 236.359 2.462 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCC[C@H]1[NH3+])CC(F)(F)F ZINC000423175257 387962622 /nfs/dbraw/zinc/96/26/22/387962622.db2.gz DNTZOEWUBHUZGD-YIZRAAEISA-N 2 0 224.270 2.044 20 0 BEADRP CC[C@H]([NH2+]CC1([NH3+])CCCCC1)[C@@H]1CCOC1 ZINC000423178137 387964261 /nfs/dbraw/zinc/96/42/61/387964261.db2.gz KGOJAMQWGIYEJO-OLZOCXBDSA-N 2 0 240.391 2.053 20 0 BEADRP CC[C@H]1CC[N@H+](CC[C@H]2CCC[NH+]2C)C1 ZINC000245594211 387964674 /nfs/dbraw/zinc/96/46/74/387964674.db2.gz HBBJFUQGDKIZKQ-QWHCGFSZSA-N 2 0 210.365 2.203 20 0 BEADRP CC[C@@H]([NH2+]CC1([NH3+])CCCCC1)[C@H]1CCOC1 ZINC000423178138 387965006 /nfs/dbraw/zinc/96/50/06/387965006.db2.gz KGOJAMQWGIYEJO-QWHCGFSZSA-N 2 0 240.391 2.053 20 0 BEADRP C[C@H]([NH2+]CC1([NH3+])CCCCC1)C1CCOCC1 ZINC000423187545 387971715 /nfs/dbraw/zinc/97/17/15/387971715.db2.gz YDYJOMXLZFIVCC-LBPRGKRZSA-N 2 0 240.391 2.053 20 0 BEADRP [NH3+]CCC[NH2+][C@H]1CCC[C@H](c2cccnc2)C1 ZINC000423194866 387979518 /nfs/dbraw/zinc/97/95/18/387979518.db2.gz RYPLXRBIBGKWJF-JSGCOSHPSA-N 2 0 233.359 2.046 20 0 BEADRP COc1ccc([C@H]([NH2+]CCC[NH3+])C(C)C)cc1 ZINC000423195437 387979663 /nfs/dbraw/zinc/97/96/63/387979663.db2.gz SNCCVWYZBITARD-CQSZACIVSA-N 2 0 236.359 2.331 20 0 BEADRP [NH3+]CCC[NH2+]C1CCC(OC2CCCC2)CC1 ZINC000423196208 387981474 /nfs/dbraw/zinc/98/14/74/387981474.db2.gz UVKUNQINMJTHLT-UHFFFAOYSA-N 2 0 240.391 2.195 20 0 BEADRP C[NH+](C)CCC[NH2+]C1CCc2ccccc2CC1 ZINC000453052666 387973482 /nfs/dbraw/zinc/97/34/82/387973482.db2.gz DBGJVIDRJITNFN-UHFFFAOYSA-N 2 0 246.398 2.475 20 0 BEADRP CC[C@H](C)[NH2+][C@@H]1CC[N@H+](C)[C@H]2CCC[C@H]21 ZINC000453051381 387973766 /nfs/dbraw/zinc/97/37/66/387973766.db2.gz BEVUKRLPUUTTCY-RVMXOQNASA-N 2 0 210.365 2.247 20 0 BEADRP C[NH2+]CCC[NH2+][C@H](C)CCC(C)(C)C ZINC000423201689 387987324 /nfs/dbraw/zinc/98/73/24/387987324.db2.gz POWYNTGTXXWYJV-LLVKDONJSA-N 2 0 200.370 2.400 20 0 BEADRP C[C@@H]([NH2+]CC1([NH3+])CCCCCC1)[C@H]1CCOC1 ZINC000423201434 387987507 /nfs/dbraw/zinc/98/75/07/387987507.db2.gz ORFQPDLOSHWBOY-OLZOCXBDSA-N 2 0 240.391 2.053 20 0 BEADRP Cc1ccc(C[C@@H](N[C@@H]2CC[NH2+]C2)C2CC2)cc1 ZINC000423211980 387995868 /nfs/dbraw/zinc/99/58/68/387995868.db2.gz ZICMUJODDAVIRI-HZPDHXFCSA-N 2 0 244.382 2.268 20 0 BEADRP C[C@@H]1CC(C)(C)C[C@H]1[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000423202645 387989622 /nfs/dbraw/zinc/98/96/22/387989622.db2.gz BIDKTDBFGDOCNU-FRRDWIJNSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CC2([NH3+])CCCCCC2)[C@H](C)O1 ZINC000423204551 387990024 /nfs/dbraw/zinc/99/00/24/387990024.db2.gz URJYHAJBJJWZTG-FRRDWIJNSA-N 2 0 240.391 2.194 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1c2cc(C)ccc2C[C@H]1C ZINC000423203679 387990147 /nfs/dbraw/zinc/99/01/47/387990147.db2.gz SXQLMVMCEJDHQI-DOMZBBRYSA-N 2 0 232.371 2.427 20 0 BEADRP Cc1cncc([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[NH2+]C2)c1 ZINC000423206825 387990672 /nfs/dbraw/zinc/99/06/72/387990672.db2.gz CEAMMNCCHPPIBK-IHRRRGAJSA-N 2 0 247.386 2.429 20 0 BEADRP CC[C@@H]1C[C@@H](C)CC[C@H]1[NH2+]CCC[NH2+]C ZINC000423205042 387991013 /nfs/dbraw/zinc/99/10/13/387991013.db2.gz VBYYVRYGRDSEFL-YNEHKIRRSA-N 2 0 212.381 2.400 20 0 BEADRP CC(C)(C)[C@@H]1CC[C@@H]1[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000423208366 387992941 /nfs/dbraw/zinc/99/29/41/387992941.db2.gz HTRPWSVCKICAHC-UPJWGTAASA-N 2 0 224.392 2.400 20 0 BEADRP [NH3+]CCC[NH2+][C@H]1CCCc2cc(F)ccc21 ZINC000423196874 387982131 /nfs/dbraw/zinc/98/21/31/387982131.db2.gz WTOHAXPTHIOTSA-ZDUSSCGKSA-N 2 0 222.307 2.142 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1C[C@@H](OCC(C)C)C1(C)C ZINC000423198062 387983213 /nfs/dbraw/zinc/98/32/13/387983213.db2.gz CUIFOYQCGAXFIM-CHWSQXEVSA-N 2 0 242.407 2.025 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1CCc2cc(F)ccc21 ZINC000423198019 387983688 /nfs/dbraw/zinc/98/36/88/387983688.db2.gz COIYUMYGRVSUAU-CYBMUJFWSA-N 2 0 222.307 2.012 20 0 BEADRP C[NH2+]CCC[NH2+][C@H](C)c1ccc(C)s1 ZINC000423198806 387984611 /nfs/dbraw/zinc/98/46/11/387984611.db2.gz IAWYRWAADXAONI-SNVBAGLBSA-N 2 0 212.362 2.317 20 0 BEADRP CCC[C@H]([NH2+]CCC[NH2+]C)C(C)(C)C ZINC000423198894 387985376 /nfs/dbraw/zinc/98/53/76/387985376.db2.gz IOGGPLFHEKTMGB-NSHDSACASA-N 2 0 200.370 2.400 20 0 BEADRP CCC[C@H](C)[C@@H](CC)[NH2+]CCC[NH2+]C ZINC000423199117 387986078 /nfs/dbraw/zinc/98/60/78/387986078.db2.gz JCLPXYJJCYKJJV-NWDGAFQWSA-N 2 0 200.370 2.400 20 0 BEADRP C[NH2+]CCC[NH2+][C@H](c1ccc(F)cc1)C1CC1 ZINC000423199186 387986740 /nfs/dbraw/zinc/98/67/40/387986740.db2.gz JMIDWJJTYXLNGC-AWEZNQCLSA-N 2 0 236.334 2.476 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H](Cc1ccccc1)C1CC1 ZINC000423226808 388010952 /nfs/dbraw/zinc/01/09/52/388010952.db2.gz SKJAAHZTZANQRF-WFASDCNBSA-N 2 0 232.371 2.335 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+][C@@H](C)[C@H]1CCC[NH2+]C1 ZINC000423214309 387998256 /nfs/dbraw/zinc/99/82/56/387998256.db2.gz LDNGBPZCILXVKQ-IHRRRGAJSA-N 2 0 247.386 2.429 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+][C@H](C)[C@@H]1CCC[NH2+]C1 ZINC000423216867 387999459 /nfs/dbraw/zinc/99/94/59/387999459.db2.gz PFUIWXFGHZXKSF-LPWJVIDDSA-N 2 0 210.365 2.153 20 0 BEADRP CCC1CC([NH2+][C@@H](C)[C@H]2CCC[NH2+]C2)C1 ZINC000423218004 387999968 /nfs/dbraw/zinc/99/99/68/387999968.db2.gz QYJLLYUGHZNOOR-QCXCNERSSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC12CCC2)[C@H]1CCC[NH2+]C1 ZINC000423221094 388002523 /nfs/dbraw/zinc/00/25/23/388002523.db2.gz WFNAUWOCNFVBDM-RWMBFGLXSA-N 2 0 222.376 2.297 20 0 BEADRP CC(C)[C@H]([NH2+]CC[C@H](C)[NH3+])c1cccnc1 ZINC000423222490 388004694 /nfs/dbraw/zinc/00/46/94/388004694.db2.gz BHEOVMOSZXZSTM-AAEUAGOBSA-N 2 0 221.348 2.106 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]CCC(C)(C)C ZINC000252709648 135099159 /nfs/dbraw/zinc/09/91/59/135099159.db2.gz DKIJWELMUNGWSK-VXGBXAGGSA-N 2 0 212.381 2.352 20 0 BEADRP Cc1ccc([C@H](C)[NH2+]CC[C@H](C)[NH3+])s1 ZINC000423226473 388008822 /nfs/dbraw/zinc/00/88/22/388008822.db2.gz QVYJKVFJAHIDNR-WPRPVWTQSA-N 2 0 212.362 2.444 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H](C)C1C(C)(C)C1(C)C ZINC000423226317 388009908 /nfs/dbraw/zinc/00/99/08/388009908.db2.gz QGINQTLUWZPOLH-UWVGGRQHSA-N 2 0 212.381 2.384 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+][C@@H](C1CC1)C1CCC1 ZINC000423269835 388010820 /nfs/dbraw/zinc/01/08/20/388010820.db2.gz HQSLACDSTLUIBT-QWHCGFSZSA-N 2 0 210.365 2.138 20 0 BEADRP Cc1ccc(C[C@H](N[C@H]2CC[NH2+]C2)C2CC2)cc1 ZINC000423211979 387996146 /nfs/dbraw/zinc/99/61/46/387996146.db2.gz ZICMUJODDAVIRI-HOTGVXAUSA-N 2 0 244.382 2.268 20 0 BEADRP CC[C@H]([NH2+]CC[C@@H]1CC[NH2+]C1)[C@@H]1C[C@@H]1C ZINC000423239972 388023695 /nfs/dbraw/zinc/02/36/95/388023695.db2.gz BYNUYKGTHBYVPU-RVMXOQNASA-N 2 0 210.365 2.010 20 0 BEADRP CC[C@H]([NH2+]CC[C@@H]1CC[NH2+]C1)[C@H]1C[C@@H]1C ZINC000423239970 388024558 /nfs/dbraw/zinc/02/45/58/388024558.db2.gz BYNUYKGTHBYVPU-CYDGBPFRSA-N 2 0 210.365 2.010 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+]CC[C@H](C)[NH3+])cc1 ZINC000423241483 388024734 /nfs/dbraw/zinc/02/47/34/388024734.db2.gz XVZWGZJCUDZONU-NWDGAFQWSA-N 2 0 206.333 2.383 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1ccsc1 ZINC000423243112 388026234 /nfs/dbraw/zinc/02/62/34/388026234.db2.gz GFYUPFUGZDHEPI-WDEREUQCSA-N 2 0 224.373 2.398 20 0 BEADRP C[C@@H](CCCc1cccnc1)[NH2+]C[C@@H]1CCC[NH2+]1 ZINC000423229773 388014827 /nfs/dbraw/zinc/01/48/27/388014827.db2.gz BZXUZKMIIFDCQQ-ZFWWWQNUSA-N 2 0 247.386 2.134 20 0 BEADRP CC(=O)Nc1cccc([C@@H](C)[NH2+]CC[C@H](C)[NH3+])c1 ZINC000423232083 388016513 /nfs/dbraw/zinc/01/65/13/388016513.db2.gz MHQFUYBBUZNFSP-WDEREUQCSA-N 2 0 249.358 2.033 20 0 BEADRP CC[C@H](C)C[N@@H+]1CC[C@@H](C[NH+](C)CC)C1 ZINC000246182603 388016638 /nfs/dbraw/zinc/01/66/38/388016638.db2.gz HDNZWWZZVXWBII-STQMWFEESA-N 2 0 212.381 2.306 20 0 BEADRP Cc1cncc([C@H](C)[NH2+]CC[C@H]2CC[NH2+]C2)c1 ZINC000423238442 388022273 /nfs/dbraw/zinc/02/22/73/388022273.db2.gz AJKYWOONZNVBRN-QWHCGFSZSA-N 2 0 233.359 2.040 20 0 BEADRP CC[C@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1ccncc1 ZINC000423238421 388022647 /nfs/dbraw/zinc/02/26/47/388022647.db2.gz AGDSBWHSIUUETI-JSGCOSHPSA-N 2 0 233.359 2.122 20 0 BEADRP CC[C@H]([NH2+]CC[C@H]1CC[NH2+]C1)C1CCC1 ZINC000423254355 388035198 /nfs/dbraw/zinc/03/51/98/388035198.db2.gz XTAYSXIFAJEFCZ-YPMHNXCESA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1ccccc1F ZINC000423253796 388035479 /nfs/dbraw/zinc/03/54/79/388035479.db2.gz WIGWCJZQKSHGGK-NEPJUHHUSA-N 2 0 236.334 2.476 20 0 BEADRP Cc1ccnc([C@@H](C)[NH2+]CC[C@H]2CCC[NH2+]C2)c1 ZINC000423256608 388036423 /nfs/dbraw/zinc/03/64/23/388036423.db2.gz CEFOUGZWQGGADI-ZIAGYGMSSA-N 2 0 247.386 2.430 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H]1CCc2c1cccc2OC ZINC000423256425 388036645 /nfs/dbraw/zinc/03/66/45/388036645.db2.gz BXKWSHQMMGQBAD-FZMZJTMJSA-N 2 0 248.370 2.128 20 0 BEADRP C(C[C@H]1CC[NH2+]C1)[NH2+][C@H]1CC[C@H]1C1CCC1 ZINC000423254659 388037024 /nfs/dbraw/zinc/03/70/24/388037024.db2.gz ZAUPHIXDTWQPGL-XBFCOCLRSA-N 2 0 222.376 2.154 20 0 BEADRP Cc1ccc([C@H](C)[NH2+]CC[C@@H]2CC[NH2+]C2)o1 ZINC000423254670 388037217 /nfs/dbraw/zinc/03/72/17/388037217.db2.gz ZBZPXVPZPMOUID-RYUDHWBXSA-N 2 0 222.332 2.238 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)C1(C)CC1 ZINC000423255538 388037265 /nfs/dbraw/zinc/03/72/65/388037265.db2.gz CCVVBXIWMLJLIY-RYUDHWBXSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CCC[NH2+]C1)c1ccco1 ZINC000423255433 388037523 /nfs/dbraw/zinc/03/75/23/388037523.db2.gz CBRLDXCQFSXJGX-VXGBXAGGSA-N 2 0 222.332 2.320 20 0 BEADRP Cc1cncc([C@H](C)[NH2+]CC[C@H]2CCC[NH2+]C2)c1 ZINC000423258440 388037937 /nfs/dbraw/zinc/03/79/37/388037937.db2.gz MCQHRUBUCOERDO-UONOGXRCSA-N 2 0 247.386 2.430 20 0 BEADRP CSCCCC[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000159982784 388042682 /nfs/dbraw/zinc/04/26/82/388042682.db2.gz BVZGTHZHIBGPLJ-QWHCGFSZSA-N 2 0 242.432 2.346 20 0 BEADRP CC[C@H]([NH2+]C[C@H](C)C[NH+]1CCCC1)C1CC1 ZINC000083056516 388043985 /nfs/dbraw/zinc/04/39/85/388043985.db2.gz GOIMDCYUHFDILZ-JSGCOSHPSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1cccc(O)c1 ZINC000423244174 388028286 /nfs/dbraw/zinc/02/82/86/388028286.db2.gz HJULLOHJBBONJR-NEPJUHHUSA-N 2 0 234.343 2.042 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CC[NH2+]C1)[C@H]1CC1(C)C ZINC000423248042 388030804 /nfs/dbraw/zinc/03/08/04/388030804.db2.gz MGHKQHOSXMAFHK-SDDRHHMPSA-N 2 0 210.365 2.010 20 0 BEADRP C(C[C@H]1CC[NH2+]C1)[NH2+][C@H]1CCC12CCCC2 ZINC000423249318 388031535 /nfs/dbraw/zinc/03/15/35/388031535.db2.gz OQDYFABIYFDMJD-OLZOCXBDSA-N 2 0 222.376 2.298 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H](C)CC(C)(C)C ZINC000423271967 388051318 /nfs/dbraw/zinc/05/13/18/388051318.db2.gz JMZVNNMWNVPPRE-WDEREUQCSA-N 2 0 200.370 2.256 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H](C)CC(C)(C)C ZINC000423271965 388052073 /nfs/dbraw/zinc/05/20/73/388052073.db2.gz JMZVNNMWNVPPRE-MNOVXSKESA-N 2 0 200.370 2.256 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H]1CC(C)(C)C[C@@H]1C ZINC000423273274 388053656 /nfs/dbraw/zinc/05/36/56/388053656.db2.gz KNOLHKKIHJPQJX-SRVKXCTJSA-N 2 0 212.381 2.256 20 0 BEADRP CC(C)[C@@H]1C[C@H]1C[NH2+][C@H]1CC[N@H+](C)C[C@H]1C ZINC000453350584 388054608 /nfs/dbraw/zinc/05/46/08/388054608.db2.gz LOJOATCZCYOPRJ-RFGFWPKPSA-N 2 0 224.392 2.208 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H]1CCc2ccc(C)cc21 ZINC000423274633 388055143 /nfs/dbraw/zinc/05/51/43/388055143.db2.gz MEPKJRWQZXOMBW-WFASDCNBSA-N 2 0 232.371 2.427 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@@H]1C[C@H](C)CC[C@@H]1C ZINC000423276326 388056097 /nfs/dbraw/zinc/05/60/97/388056097.db2.gz OINRAWBGDKLEMJ-YVECIDJPSA-N 2 0 212.381 2.384 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H](C)c1ccc(F)c(F)c1 ZINC000423277613 388058463 /nfs/dbraw/zinc/05/84/63/388058463.db2.gz QCMZHGZEQSYTOW-ZJUUUORDSA-N 2 0 242.313 2.471 20 0 BEADRP CC(C)[C@@H]1C[C@H]1C[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000453362262 388059471 /nfs/dbraw/zinc/05/94/71/388059471.db2.gz QYNAGTXDMHYPFM-RQJABVFESA-N 2 0 224.392 2.351 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H](C)CCCc1cccnc1 ZINC000423278530 388059950 /nfs/dbraw/zinc/05/99/50/388059950.db2.gz RHZYNFGVWCYULC-KBPBESRZSA-N 2 0 249.402 2.238 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CCCC[N@H+](C)C2CC2)CCO1 ZINC000453387788 388060612 /nfs/dbraw/zinc/06/06/12/388060612.db2.gz BFQXRSHIUUJALD-STQMWFEESA-N 2 0 240.391 2.018 20 0 BEADRP CCC[C@@H]1CCC[C@@H]1[NH2+]C[C@H](C)C[NH2+]C ZINC000423279094 388060752 /nfs/dbraw/zinc/06/07/52/388060752.db2.gz RXNRSHAJPXJUJX-UPJWGTAASA-N 2 0 212.381 2.400 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H](C)CCCc1cccnc1 ZINC000423278531 388060769 /nfs/dbraw/zinc/06/07/69/388060769.db2.gz RHZYNFGVWCYULC-KGLIPLIRSA-N 2 0 249.402 2.238 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H](C)c1cccc(OC)c1 ZINC000423279682 388061689 /nfs/dbraw/zinc/06/16/89/388061689.db2.gz SSKKMPMYBJRUSI-NWDGAFQWSA-N 2 0 236.359 2.201 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+][C@@H]1CCCC[C@@H]1C[NH3+] ZINC000423279565 388062085 /nfs/dbraw/zinc/06/20/85/388062085.db2.gz RNEYPUVCNWQOJC-MRVWCRGKSA-N 2 0 236.359 2.318 20 0 BEADRP CCC[C@H]([NH2+]C[C@H](C)C[NH2+]C)C1CCC1 ZINC000423280640 388062617 /nfs/dbraw/zinc/06/26/17/388062617.db2.gz VAPKRCHQNGAOLU-YPMHNXCESA-N 2 0 212.381 2.400 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CCc2c1cccc2F ZINC000423282053 388063395 /nfs/dbraw/zinc/06/33/95/388063395.db2.gz WHQCHIPEHUSWLJ-IINYFYTJSA-N 2 0 236.334 2.258 20 0 BEADRP FCC[C@@H]1CCC[C@H]1[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000423283618 388065865 /nfs/dbraw/zinc/06/58/65/388065865.db2.gz XPQHXWPVUOVYJQ-MELADBBJSA-N 2 0 242.382 2.494 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCCC[N@H+](C)C2CC2)CCO1 ZINC000453387786 388067682 /nfs/dbraw/zinc/06/76/82/388067682.db2.gz BFQXRSHIUUJALD-OLZOCXBDSA-N 2 0 240.391 2.018 20 0 BEADRP CC1CC([NH2+]CCCC[N@H+](C)C2CC2)C1 ZINC000453400387 388072587 /nfs/dbraw/zinc/07/25/87/388072587.db2.gz LYRWGNCOXLDAJH-UHFFFAOYSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H]([NH2+]CC(C)(C)[NH3+])C1C(C)(C)C1(C)C ZINC000423288544 388073063 /nfs/dbraw/zinc/07/30/63/388073063.db2.gz SRPXJLOPNZCLNI-SECBINFHSA-N 2 0 212.381 2.384 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]Cc1ccccc1 ZINC000084215454 388073914 /nfs/dbraw/zinc/07/39/14/388073914.db2.gz AQVMHPUPDGCRMP-UONOGXRCSA-N 2 0 218.344 2.294 20 0 BEADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H](C)CCCC[NH3+])cc1 ZINC000423290714 388073962 /nfs/dbraw/zinc/07/39/62/388073962.db2.gz FDHKYNDYBYMOGS-STQMWFEESA-N 3 0 249.402 2.313 20 0 BEADRP CC(C)([NH3+])C[NH2+][C@H]1CCC[C@H]1CCCF ZINC000423290181 388074294 /nfs/dbraw/zinc/07/42/94/388074294.db2.gz ZIJJRBFPKYTDOD-QWRGUYRKSA-N 2 0 216.344 2.232 20 0 BEADRP CC(C)CO[C@H]1C[C@H]([NH2+]CC(C)(C)[NH3+])C1(C)C ZINC000423290371 388074555 /nfs/dbraw/zinc/07/45/55/388074555.db2.gz ZVPBVTYNUZSPEP-RYUDHWBXSA-N 2 0 242.407 2.153 20 0 BEADRP CC(C)([NH3+])C[NH2+][C@@H]1CCC[C@@H]1CCCF ZINC000423290179 388074807 /nfs/dbraw/zinc/07/48/07/388074807.db2.gz ZIJJRBFPKYTDOD-GHMZBOCLSA-N 2 0 216.344 2.232 20 0 BEADRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]Cc1ccc(F)cc1 ZINC000084217741 388074987 /nfs/dbraw/zinc/07/49/87/388074987.db2.gz ADVNANUONCYZQX-DGCLKSJQSA-N 2 0 222.307 2.043 20 0 BEADRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]Cc1ccccc1F ZINC000084217778 388075133 /nfs/dbraw/zinc/07/51/33/388075133.db2.gz DNDLVQMIDTWDET-MFKMUULPSA-N 2 0 222.307 2.043 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]Cc1cccc(F)c1 ZINC000084218474 388075162 /nfs/dbraw/zinc/07/51/62/388075162.db2.gz ILKOPSIHLNOYFY-AAEUAGOBSA-N 2 0 222.307 2.043 20 0 BEADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H](C)[C@H]2CCOC2)cc1 ZINC000423292775 388076376 /nfs/dbraw/zinc/07/63/76/388076376.db2.gz OJOAYWXUFSZLET-HUBLWGQQSA-N 2 0 248.370 2.221 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H](C)c1cc2c(s1)CCC2 ZINC000423294811 388077366 /nfs/dbraw/zinc/07/73/66/388077366.db2.gz CUFCCGPWYUAFDK-NXEZZACHSA-N 2 0 238.400 2.482 20 0 BEADRP CCc1nc(C)c([C@@H](C)[NH2+]C[C@@H](C)C[NH3+])s1 ZINC000423295548 388077449 /nfs/dbraw/zinc/07/74/49/388077449.db2.gz FCRMAJBFRHSWLK-DTWKUNHWSA-N 2 0 241.404 2.259 20 0 BEADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@H]2CCOC[C@@H]2C)cc1 ZINC000423296455 388078767 /nfs/dbraw/zinc/07/87/67/388078767.db2.gz ZHNRDBPMJMFMON-HUBLWGQQSA-N 2 0 248.370 2.221 20 0 BEADRP Cc1ccc(C[N@@H+](C)C2CC[NH2+]CC2)c(C)c1 ZINC000084517097 388079297 /nfs/dbraw/zinc/07/92/97/388079297.db2.gz WRKVBCDKDPVTDS-UHFFFAOYSA-N 2 0 232.371 2.487 20 0 BEADRP CC(C)C[C@@H]([NH2+]C[C@H](C)C[NH3+])c1ccccn1 ZINC000423297678 388079773 /nfs/dbraw/zinc/07/97/73/388079773.db2.gz LHVDADHWIYOOLN-TZMCWYRMSA-N 2 0 235.375 2.353 20 0 BEADRP COc1ccc2c(c1)CCC[C@@H]2[NH2+]C[C@@H](C)C[NH3+] ZINC000423297643 388080255 /nfs/dbraw/zinc/08/02/55/388080255.db2.gz LDDUONMPNRSWGX-NHYWBVRUSA-N 2 0 248.370 2.257 20 0 BEADRP [NH3+]CCCC[NH2+]C1CCC(C(F)(F)F)CC1 ZINC000084837227 388081065 /nfs/dbraw/zinc/08/10/65/388081065.db2.gz PYAVOXDIDZRMCW-UHFFFAOYSA-N 2 0 238.297 2.436 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)CCC[NH3+])c1ccccc1 ZINC000336659057 388083332 /nfs/dbraw/zinc/08/33/32/388083332.db2.gz BMCHECFBNHFIKW-NWDGAFQWSA-N 2 0 206.333 2.465 20 0 BEADRP CC(C)[C@@H]([NH2+][C@@H]1CCC[NH2+]CC1)C1CC1 ZINC000324262460 388115355 /nfs/dbraw/zinc/11/53/55/388115355.db2.gz LXTTZTYLJAWNKJ-CHWSQXEVSA-N 2 0 210.365 2.153 20 0 BEADRP CCO[C@@H]1C[C@@H]([NH2+]CCCC[NH3+])C12CCCC2 ZINC000085679971 388094088 /nfs/dbraw/zinc/09/40/88/388094088.db2.gz VVOPJGPEZDUQSJ-CHWSQXEVSA-N 2 0 240.391 2.053 20 0 BEADRP C[C@@H](C[C@@H]1CCC[NH2+]1)[NH2+]CCc1cccs1 ZINC000086494979 388103198 /nfs/dbraw/zinc/10/31/98/388103198.db2.gz XBJGKLGOFMTUGY-RYUDHWBXSA-N 2 0 238.400 2.411 20 0 BEADRP CC(C)[C@H]1CC[C@@H](C)C[C@H]1[NH2+][C@@H]1CC[NH2+]C1 ZINC000086727233 388107457 /nfs/dbraw/zinc/10/74/57/388107457.db2.gz XDURAUDPZJQLCS-AAVRWANBSA-N 2 0 224.392 2.399 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@H]2CS[C@@H](C)C2)CC1 ZINC000086934589 388110969 /nfs/dbraw/zinc/11/09/69/388110969.db2.gz FHDANSFJEHFFIG-WCQYABFASA-N 2 0 242.432 2.343 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H]2CS[C@H](C)C2)CC1 ZINC000086934593 388111123 /nfs/dbraw/zinc/11/11/23/388111123.db2.gz CBMIBYMUMQTBAY-YPMHNXCESA-N 2 0 242.432 2.344 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H]1c2ccccc2C[C@@H]1C ZINC000423267430 388045303 /nfs/dbraw/zinc/04/53/03/388045303.db2.gz DZEGAAHELRUIEK-SLEUVZQESA-N 2 0 232.371 2.365 20 0 BEADRP CC/C=C/C[NH2+][C@@H]1CC[N@H+](C)[C@@H]2CCC[C@H]21 ZINC000453332240 388048693 /nfs/dbraw/zinc/04/86/93/388048693.db2.gz VTNFZKLMTDQAFK-DACWGTRXSA-N 2 0 222.376 2.415 20 0 BEADRP C1CC1[C@H]([NH2+][C@@H]1CCC[NH2+]CC1)C1CCC1 ZINC000324843458 388125055 /nfs/dbraw/zinc/12/50/55/388125055.db2.gz XESHORAVMSBKMS-ZIAGYGMSSA-N 2 0 222.376 2.297 20 0 BEADRP CC[C@H]([NH2+][C@H]1CCC[NH2+]CC1)C1CCC1 ZINC000324875049 388125378 /nfs/dbraw/zinc/12/53/78/388125378.db2.gz CPDSLZNPEKIOKM-STQMWFEESA-N 2 0 210.365 2.297 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)Cc2ccoc2)C1 ZINC000449089318 388141592 /nfs/dbraw/zinc/14/15/92/388141592.db2.gz JWELQWYAMXSTDC-GXTWGEPZSA-N 2 0 236.359 2.142 20 0 BEADRP COCC1CCC([NH2+][C@H](C)CC[NH+](C)C)CC1 ZINC000449106471 388143097 /nfs/dbraw/zinc/14/30/97/388143097.db2.gz HUSODTCNAFTOPT-IYXRBSQSSA-N 2 0 242.407 2.121 20 0 BEADRP CCC[NH2+][C@@H](C)C(=O)Nc1ccc([C@@H](C)[NH3+])cc1 ZINC000449124153 388145333 /nfs/dbraw/zinc/14/53/33/388145333.db2.gz FSTBTXRWDFTCGE-MNOVXSKESA-N 2 0 249.358 2.033 20 0 BEADRP C[C@H](CCCC(F)(F)F)[NH2+]CCC[NH3+] ZINC000166663917 388255046 /nfs/dbraw/zinc/25/50/46/388255046.db2.gz BPEMVRAAUAUBHF-MRVPVSSYSA-N 2 0 212.259 2.046 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+][C@H](C)C2CC2)[C@H](C)C1 ZINC000449440039 388207036 /nfs/dbraw/zinc/20/70/36/388207036.db2.gz KAAVRKKGRUQBIK-NQBHXWOUSA-N 2 0 210.365 2.105 20 0 BEADRP C[N@H+](CC[C@@H]1CCC[NH+]1C)[C@@H]1CC1(C)C ZINC000489515941 388219404 /nfs/dbraw/zinc/21/94/04/388219404.db2.gz PEKPTJVOGGHHIO-NWDGAFQWSA-N 2 0 210.365 2.201 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000449561257 388233030 /nfs/dbraw/zinc/23/30/30/388233030.db2.gz TWGOTNVPZXUEOL-JZIBPQBNSA-N 2 0 248.370 2.425 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000449561479 388233044 /nfs/dbraw/zinc/23/30/44/388233044.db2.gz VNWBGGMUHYIRLH-JWURUJNWSA-N 2 0 222.376 2.390 20 0 BEADRP C[C@H]1CC[N@H+](CCC(C)(C)C)C[C@@H]1C[NH3+] ZINC000164665351 388242157 /nfs/dbraw/zinc/24/21/57/388242157.db2.gz SBIHQKKKMLLHFJ-RYUDHWBXSA-N 2 0 212.381 2.339 20 0 BEADRP CC(C)CCC[N@@H+]1CC[C@@H](C)[C@@H](C[NH3+])C1 ZINC000164659520 388242303 /nfs/dbraw/zinc/24/23/03/388242303.db2.gz VLLGTZBBXFOEDW-OLZOCXBDSA-N 2 0 212.381 2.339 20 0 BEADRP Cc1ccc(CCC[NH2+][C@H]2COCC2(C)C)cn1 ZINC000449624384 388245273 /nfs/dbraw/zinc/24/52/73/388245273.db2.gz OGLSEQHZLIONFV-AWEZNQCLSA-N 2 0 248.370 2.337 20 0 BEADRP CC[NH+](CC)CCC[N@@H+]1CC[C@@H](SC)C1 ZINC000451327004 388263649 /nfs/dbraw/zinc/26/36/49/388263649.db2.gz RUKJOBWXVILEET-GFCCVEGCSA-N 2 0 230.421 2.156 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H]1C[C@@H](OC)C1(C)C ZINC000451491154 388277331 /nfs/dbraw/zinc/27/73/31/388277331.db2.gz ILQPVIXFVSZTAH-QWHCGFSZSA-N 2 0 242.407 2.121 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H]1C[C@@H](OC)C1(C)C ZINC000451491152 388277563 /nfs/dbraw/zinc/27/75/63/388277563.db2.gz ILQPVIXFVSZTAH-CHWSQXEVSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H](CN)[NH2+]CC[C@H](C)c1ccccc1 ZINC000235131935 388365231 /nfs/dbraw/zinc/36/52/31/388365231.db2.gz IYPBDLLXAHPNQN-RYUDHWBXSA-N 2 0 206.333 2.117 20 0 BEADRP C[N@H+](CCCC[NH2+]CC1(C)CC1)C1CC1 ZINC000572813603 388377704 /nfs/dbraw/zinc/37/77/04/388377704.db2.gz CWENBZQRSVVCFQ-UHFFFAOYSA-N 2 0 210.365 2.251 20 0 BEADRP C[NH+]1CCC(C)(C[NH2+][C@@H]2CCCSC2)CC1 ZINC000228808637 388388166 /nfs/dbraw/zinc/38/81/66/388388166.db2.gz VVFAPSHODZWBRG-GFCCVEGCSA-N 2 0 242.432 2.204 20 0 BEADRP C[C@@H]1C[N@H+](C[C@@H]2CCC(F)(F)C2)CC[C@@H]1[NH3+] ZINC000300785730 388393838 /nfs/dbraw/zinc/39/38/38/388393838.db2.gz BEBQREPYARJJFF-MXWKQRLJSA-N 2 0 232.318 2.091 20 0 BEADRP [NH3+]CC1CC[NH+](C[C@@H]2CCC(F)(F)C2)CC1 ZINC000300817518 388394637 /nfs/dbraw/zinc/39/46/37/388394637.db2.gz FYVICRCDZRMPAL-LLVKDONJSA-N 2 0 232.318 2.093 20 0 BEADRP CCN(CC[NH3+])Cc1cc(C)c(C)cc1C ZINC000300802053 388396331 /nfs/dbraw/zinc/39/63/31/388396331.db2.gz JGIZOOKFZNOWQJ-UHFFFAOYSA-N 2 0 220.360 2.392 20 0 BEADRP CCC[C@H]([NH2+]CCN(C)CCOC)C1CCC1 ZINC000322720779 388444707 /nfs/dbraw/zinc/44/47/07/388444707.db2.gz SXPQLPZPQPGORU-AWEZNQCLSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CCCC(F)(F)F ZINC000336696435 388463872 /nfs/dbraw/zinc/46/38/72/388463872.db2.gz TWGPZRZBKNJZSW-MRVPVSSYSA-N 2 0 212.259 2.046 20 0 BEADRP C[C@@H](C[NH2+][C@@H](C)C1CCSCC1)C[NH+](C)C ZINC000336725245 388469764 /nfs/dbraw/zinc/46/97/64/388469764.db2.gz BKNZYWTYRZXGBA-RYUDHWBXSA-N 2 0 244.448 2.305 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@H]1COc2ccccc2C1 ZINC000336887905 388429944 /nfs/dbraw/zinc/42/99/44/388429944.db2.gz DOMQDECYEBYOGZ-TZMCWYRMSA-N 2 0 248.370 2.097 20 0 BEADRP CC(C)n1cc([C@@H](C)[NH2+][C@H](C)C[C@H](C)[NH3+])cn1 ZINC000514854735 256722876 /nfs/dbraw/zinc/72/28/76/256722876.db2.gz HMZXWPVKGHZMHX-QJPTWQEYSA-N 2 0 238.379 2.240 20 0 BEADRP CC[C@H]([NH2+]CCCC[NH+](C)C)C1CCC1 ZINC000322500318 388436638 /nfs/dbraw/zinc/43/66/38/388436638.db2.gz CCSLYIABXGZLHM-ZDUSSCGKSA-N 2 0 212.381 2.497 20 0 BEADRP CC[C@](C)(C[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@@H]1C)OC ZINC000322511802 388437080 /nfs/dbraw/zinc/43/70/80/388437080.db2.gz JBNQTNIHAQSPDG-REWJHTLYSA-N 2 0 242.407 2.120 20 0 BEADRP CC[C@](C)(C[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@H]1C)OC ZINC000322511800 388437267 /nfs/dbraw/zinc/43/72/67/388437267.db2.gz JBNQTNIHAQSPDG-AAVRWANBSA-N 2 0 242.407 2.120 20 0 BEADRP F[C@@H]1CCC[C@@H]1N[C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000340529462 388492526 /nfs/dbraw/zinc/49/25/26/388492526.db2.gz JVIAENNPGYMVAX-LOWDOPEQSA-N 2 0 226.339 2.093 20 0 BEADRP CC1(C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)CCCC1 ZINC000086404236 256792278 /nfs/dbraw/zinc/79/22/78/256792278.db2.gz JWTCIMSZIBUOQC-NWDGAFQWSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+][C@@H]1C[C@H]2C[C@H]2C1 ZINC000397721441 388494948 /nfs/dbraw/zinc/49/49/48/388494948.db2.gz WJBJNPIBMHQKIH-YOVYLDAJSA-N 2 0 222.376 2.103 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[NH2+]C1)[C@H]1CC1(C)C ZINC000397789619 388499498 /nfs/dbraw/zinc/49/94/98/388499498.db2.gz KSYJMSKCIOUJTN-QJPTWQEYSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@H]([NH2+]CCC[NH2+]C1CC1)[C@H]1CC1(C)C ZINC000397867825 388507226 /nfs/dbraw/zinc/50/72/26/388507226.db2.gz ZHGCHGBBQHNUBG-CMPLNLGQSA-N 2 0 210.365 2.153 20 0 BEADRP c1ccc([C@H]2CCC[N@H+]2CC[C@H]2CC[NH2+]C2)nc1 ZINC000516973477 388530168 /nfs/dbraw/zinc/53/01/68/388530168.db2.gz UMTBJOILTKSCND-UKRRQHHQSA-N 2 0 245.370 2.218 20 0 BEADRP COC(C)(C)C[N@H+](C)CCC[NH+]1CCCCC1 ZINC000548394717 388533360 /nfs/dbraw/zinc/53/33/60/388533360.db2.gz UKUNDSKNDGSUSD-UHFFFAOYSA-N 2 0 242.407 2.219 20 0 BEADRP C[C@@H]1CC[N@H+](CC[C@H]2CCC[NH+]2C)C[C@H]1C ZINC000245558749 388589315 /nfs/dbraw/zinc/58/93/15/388589315.db2.gz BHAIOBIZDVCTJN-MGPQQGTHSA-N 2 0 224.392 2.449 20 0 BEADRP CCC[C@H](C)C[N@@H+]1CC[C@@H](C[NH+](C)C)C1 ZINC000245634791 388595003 /nfs/dbraw/zinc/59/50/03/388595003.db2.gz BSTWGJPXWSPUKG-STQMWFEESA-N 2 0 212.381 2.306 20 0 BEADRP CO[C@H](C[N@@H+]1CC[C@@H]([C@@H](C)[NH3+])C1)c1ccccc1 ZINC000379232142 388599534 /nfs/dbraw/zinc/59/95/34/388599534.db2.gz STVCTTYVGSLHTR-BPLDGKMQSA-N 2 0 248.370 2.043 20 0 BEADRP CO[C@H](C[N@@H+]1CC[C@H]([C@@H](C)[NH3+])C1)c1ccccc1 ZINC000379232144 388599616 /nfs/dbraw/zinc/59/96/16/388599616.db2.gz STVCTTYVGSLHTR-VHDGCEQUSA-N 2 0 248.370 2.043 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCC(C)(F)F)CC[N@@H+]1C ZINC000357715625 388553094 /nfs/dbraw/zinc/55/30/94/388553094.db2.gz YFXHLOLOXMWKNZ-NXEZZACHSA-N 2 0 220.307 2.104 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H](C[NH3+])C1)c1ccoc1 ZINC000517553981 388553286 /nfs/dbraw/zinc/55/32/86/388553286.db2.gz LCSQLDZCXSSHIL-HOSYDEDBSA-N 2 0 208.305 2.058 20 0 BEADRP CCOc1cccc(C[N@H+](C)C2CC([NH3+])C2)c1 ZINC000385062081 388573481 /nfs/dbraw/zinc/57/34/81/388573481.db2.gz UXPWPQCFAYOKIL-UHFFFAOYSA-N 2 0 234.343 2.007 20 0 BEADRP CCSCCC[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000164030703 135212700 /nfs/dbraw/zinc/21/27/00/135212700.db2.gz UUSDBDCPOYMSRM-VXGBXAGGSA-N 2 0 230.421 2.202 20 0 BEADRP Cc1cncc([C@H](C)[NH2+]CCN2CCCC2)c1 ZINC000184258488 388576214 /nfs/dbraw/zinc/57/62/14/388576214.db2.gz HMYMJMLJVHLKGJ-ZDUSSCGKSA-N 2 0 233.359 2.136 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCCSC)[C@@H](C)C1 ZINC000245423589 388577861 /nfs/dbraw/zinc/57/78/61/388577861.db2.gz JOGBDUCKUMMYFF-QWHCGFSZSA-N 2 0 244.448 2.402 20 0 BEADRP CCCC[N@H+](C)[C@@H]1CC[NH+](CC)C[C@H]1C ZINC000245412384 388577952 /nfs/dbraw/zinc/57/79/52/388577952.db2.gz ALXVSQKROVXQKK-CHWSQXEVSA-N 2 0 212.381 2.449 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCC[C@H]2C[NH3+])C[C@H](C)O1 ZINC000521983283 388672645 /nfs/dbraw/zinc/67/26/45/388672645.db2.gz NTEBJVOAECPJMX-ZUWCUPBKSA-N 2 0 240.391 2.050 20 0 BEADRP C[C@H](CC1CCC1)[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000530176289 388620409 /nfs/dbraw/zinc/62/04/09/388620409.db2.gz AKINQRPZNMKSAE-YPMHNXCESA-N 2 0 222.376 2.439 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000530179166 388621913 /nfs/dbraw/zinc/62/19/13/388621913.db2.gz UVYVXXPSBXXJJZ-AGIUHOORSA-N 2 0 222.376 2.439 20 0 BEADRP C1CC1[C@H]1CCC[C@@H]1[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000530177348 388622168 /nfs/dbraw/zinc/62/21/68/388622168.db2.gz GKAQNJUFTXKSKE-HZSPNIEDSA-N 2 0 234.387 2.439 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]CC1CC=CC1 ZINC000530215990 388628748 /nfs/dbraw/zinc/62/87/48/388628748.db2.gz LKHRGPUYSXWMOP-QWHCGFSZSA-N 2 0 208.349 2.060 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+]CC1CC=CC1 ZINC000530215988 388629183 /nfs/dbraw/zinc/62/91/83/388629183.db2.gz LKHRGPUYSXWMOP-CHWSQXEVSA-N 2 0 208.349 2.060 20 0 BEADRP C[C@@H]([NH3+])[C@H]1CC[N@H+](CC2CC(C)(C)C2)C1 ZINC000530216405 388629926 /nfs/dbraw/zinc/62/99/26/388629926.db2.gz BHQYIMAWPYHNHG-PWSUYJOCSA-N 2 0 210.365 2.092 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CC[N@H+](CC2CC(C)(C)C2)C1 ZINC000530216402 388630694 /nfs/dbraw/zinc/63/06/94/388630694.db2.gz BHQYIMAWPYHNHG-CMPLNLGQSA-N 2 0 210.365 2.092 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CC=CCC1)[C@@H]1CCC[NH2+]1 ZINC000530217555 388630790 /nfs/dbraw/zinc/63/07/90/388630790.db2.gz HXBMABMNCBNPFG-MJBXVCDLSA-N 2 0 222.376 2.463 20 0 BEADRP CC1(C)CC(C[N@@H+]2CC[C@@H]3[NH2+]CC[C@@H]3C2)C1 ZINC000530220174 388632183 /nfs/dbraw/zinc/63/21/83/388632183.db2.gz LUBUQLGBXQZEDN-OLZOCXBDSA-N 2 0 222.376 2.106 20 0 BEADRP CC1(C)CC(C[NH+]2CCC(CC[NH3+])CC2)C1 ZINC000530223644 388634147 /nfs/dbraw/zinc/63/41/47/388634147.db2.gz OIRVLLXOMKDCAE-UHFFFAOYSA-N 2 0 224.392 2.483 20 0 BEADRP C[C@@H](C[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccncc1 ZINC000530223363 388634608 /nfs/dbraw/zinc/63/46/08/388634608.db2.gz UMZACTKWUVGOFL-YXQSOJMXSA-N 2 0 245.370 2.058 20 0 BEADRP C1CCC([NH2+][C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)C1 ZINC000251459679 388643467 /nfs/dbraw/zinc/64/34/67/388643467.db2.gz UOQKBALSUKDNER-BFHYXJOUSA-N 2 0 222.376 2.439 20 0 BEADRP C[N@H+](CC1CC[NH2+]CC1)C1(C)CCCC1 ZINC000261551671 388643437 /nfs/dbraw/zinc/64/34/37/388643437.db2.gz QTZNKVVHIMXALF-UHFFFAOYSA-N 2 0 210.365 2.251 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)C(C)(C)C)C1 ZINC000247050637 388657519 /nfs/dbraw/zinc/65/75/19/388657519.db2.gz NHGVLOTUEQJQHI-NEPJUHHUSA-N 2 0 212.381 2.352 20 0 BEADRP COC[C@@H](C)[NH2+]CCCC[N@@H+]1CCC[C@H](C)C1 ZINC000247049953 388657618 /nfs/dbraw/zinc/65/76/18/388657618.db2.gz NFMOQWFDYOLNLN-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](C)C(C)C)C1 ZINC000247056024 388657690 /nfs/dbraw/zinc/65/76/90/388657690.db2.gz NMLVNUJEHIOCNI-CHWSQXEVSA-N 2 0 212.381 2.352 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)C2CCC2)C1 ZINC000247183474 388660112 /nfs/dbraw/zinc/66/01/12/388660112.db2.gz VIUJXJAPEZGCBH-NEPJUHHUSA-N 2 0 210.365 2.106 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@H](C)C2CC2)[C@H](C)C1 ZINC000247311433 388662503 /nfs/dbraw/zinc/66/25/03/388662503.db2.gz KAAVRKKGRUQBIK-WZRBSPASSA-N 2 0 210.365 2.105 20 0 BEADRP C[N@H+](Cc1ccc2c(c1)C[NH2+]CC2)C1CCC1 ZINC000143852938 388738599 /nfs/dbraw/zinc/73/85/99/388738599.db2.gz HARXBOJQLZFTRO-UHFFFAOYSA-N 2 0 230.355 2.317 20 0 BEADRP c1ccc(CC[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)cc1 ZINC000248755681 388693602 /nfs/dbraw/zinc/69/36/02/388693602.db2.gz IONPZCPSSSCTFZ-HOTGVXAUSA-N 2 0 244.382 2.446 20 0 BEADRP CCC[C@H](C)[N@@H+]1CC[C@@H](C[NH+](C)CC)C1 ZINC000249396021 388719536 /nfs/dbraw/zinc/71/95/36/388719536.db2.gz SUOIYUUXAWCDRU-STQMWFEESA-N 2 0 212.381 2.449 20 0 BEADRP C[N@H+](CCC(C)(C)C)[C@@H]1CCC[NH2+]CC1 ZINC000226448846 388719987 /nfs/dbraw/zinc/71/99/87/388719987.db2.gz XTZBEMOJDLYEEF-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP FC(F)[C@H]1C[C@@H]1[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000554094640 388799090 /nfs/dbraw/zinc/79/90/90/388799090.db2.gz IKMXHFNLLDVOIX-RYUDHWBXSA-N 2 0 244.329 2.104 20 0 BEADRP CC[C@H](C)C[NH2+]C[C@H]1CC[C@H](C[NH3+])CC1 ZINC000253134661 388805368 /nfs/dbraw/zinc/80/53/68/388805368.db2.gz QULVLTCGCGLZED-AVGNSLFASA-N 2 0 212.381 2.387 20 0 BEADRP C[C@H](C1CC1)[N@H+](C)CC[C@H]1CCC[NH+]1C ZINC000252656619 388770431 /nfs/dbraw/zinc/77/04/31/388770431.db2.gz KKOOLZVGFCUJIQ-DGCLKSJQSA-N 2 0 210.365 2.201 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](CC)C2CC2)C1 ZINC000252717145 388775671 /nfs/dbraw/zinc/77/56/71/388775671.db2.gz ZWAFCOFRNMHMNP-TZMCWYRMSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]CCCC1CC1 ZINC000252730838 388777215 /nfs/dbraw/zinc/77/72/15/388777215.db2.gz NBLLYTJEBVIXJH-WCQYABFASA-N 2 0 210.365 2.106 20 0 BEADRP CCC[C@H](C)C[N@@H+]1CC[C@@H](C)[C@@H](C[NH3+])C1 ZINC000228987609 388778268 /nfs/dbraw/zinc/77/82/68/388778268.db2.gz JFLMCKHONSKUBU-XQQFMLRXSA-N 2 0 212.381 2.339 20 0 BEADRP CC(C)C1CC([NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)C1 ZINC000232551257 388852456 /nfs/dbraw/zinc/85/24/56/388852456.db2.gz HLSZLZWEXAHREH-IYXRBSQSSA-N 2 0 236.403 2.495 20 0 BEADRP CC(C)C1CC([NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)C1 ZINC000232551236 388853033 /nfs/dbraw/zinc/85/30/33/388853033.db2.gz HLSZLZWEXAHREH-HSBZDZAISA-N 2 0 236.403 2.495 20 0 BEADRP CCn1ccnc1CNc1cc2c(c[nH+]1)CCC2 ZINC000555636891 388858209 /nfs/dbraw/zinc/85/82/09/388858209.db2.gz CSMRHFFJJONHGB-UHFFFAOYSA-N 2 0 242.326 2.399 20 0 BEADRP COC[C@H](C)C[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000129607057 388858366 /nfs/dbraw/zinc/85/83/66/388858366.db2.gz XZMMGQDKWYWGIC-GFCCVEGCSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CC2CCC1CC2)C1C[NH2+]C1 ZINC000564988686 388905459 /nfs/dbraw/zinc/90/54/59/388905459.db2.gz NSYDROGYTNPUTO-YWPUVAFDSA-N 2 0 222.376 2.010 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+][C@@H]2CCCC[C@H]2F)C1 ZINC000565313674 388936909 /nfs/dbraw/zinc/93/69/09/388936909.db2.gz MNCABZDSHFMZSD-NNYUYHANSA-N 2 0 214.328 2.127 20 0 BEADRP CCc1ccc(C[NH2+]CCn2ccnc2C)o1 ZINC000268527722 389002902 /nfs/dbraw/zinc/00/29/02/389002902.db2.gz WKNAPZNXNRUDMA-UHFFFAOYSA-N 2 0 233.315 2.137 20 0 BEADRP C[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)c1cncc(F)c1 ZINC000271883887 389025451 /nfs/dbraw/zinc/02/54/51/389025451.db2.gz QDUNSTBJQADAAP-LLVKDONJSA-N 2 0 249.333 2.133 20 0 BEADRP CC[NH+]1CCC([NH2+]CC[C@H]2CCCCO2)CC1 ZINC000227503722 535474188 /nfs/dbraw/zinc/47/41/88/535474188.db2.gz FVJDAJOSFRPKDW-CQSZACIVSA-N 2 0 240.391 2.020 20 0 BEADRP C[C@@H]([NH2+]CC1C(C)(C)C1(C)C)[C@H]1CCC[NH2+]1 ZINC000400498315 533366784 /nfs/dbraw/zinc/36/67/84/533366784.db2.gz BKDBCILJGCFVQW-GHMZBOCLSA-N 2 0 224.392 2.399 20 0 BEADRP C([NH2+][C@@H]1CCC[NH2+]CC1)C1CCCCC1 ZINC000168717318 533368969 /nfs/dbraw/zinc/36/89/69/533368969.db2.gz IKIYLCALZSZWAU-CYBMUJFWSA-N 2 0 210.365 2.298 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CC[C@@H](C)C1)[C@@H]1CCC[NH2+]1 ZINC000400482276 533434034 /nfs/dbraw/zinc/43/40/34/533434034.db2.gz CIDSBBVCWATRED-NDBYEHHHSA-N 2 0 210.365 2.153 20 0 BEADRP Cc1cc(N2CC[NH2+][C@H](C)C2)c2ccccc2[nH+]1 ZINC000052783496 132229521 /nfs/dbraw/zinc/22/95/21/132229521.db2.gz DWZGWZISVZYJBI-GFCCVEGCSA-N 2 0 241.338 2.341 20 0 BEADRP Cc1c[nH+]ccc1N1CCC([NH2+]CC2CC2)CC1 ZINC000130257170 132234563 /nfs/dbraw/zinc/23/45/63/132234563.db2.gz IULIZJDTLLMMAQ-UHFFFAOYSA-N 2 0 245.370 2.358 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]CC2CC[NH2+]CC2)[C@H]1C ZINC000252154011 133649033 /nfs/dbraw/zinc/64/90/33/133649033.db2.gz MZTMHQJBPGWXOD-MBNYWOFBSA-N 2 0 224.392 2.400 20 0 BEADRP CCC[NH+](CCC)CCC[NH2+]C1CC(OC)C1 ZINC000347179072 133811309 /nfs/dbraw/zinc/81/13/09/133811309.db2.gz ABLGAASKPUINJU-UHFFFAOYSA-N 2 0 242.407 2.266 20 0 BEADRP C([C@H]1CCC[NH2+]C1)[N@@H+]1CCC[C@H]1C1CCC1 ZINC000336197081 134127095 /nfs/dbraw/zinc/12/70/95/134127095.db2.gz KGEHHXQTCKIYLX-JSGCOSHPSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[NH2+]CC1)c1ccccc1 ZINC000168693555 134242437 /nfs/dbraw/zinc/24/24/37/134242437.db2.gz KFZULCLPVQNGFO-JSGCOSHPSA-N 2 0 218.344 2.479 20 0 BEADRP C[C@@H]1CCCC[C@H]1[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000168702509 134246464 /nfs/dbraw/zinc/24/64/64/134246464.db2.gz XMAXGFPILDAGTE-JHJVBQTASA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H](Cc1cccs1)[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000168723640 134247318 /nfs/dbraw/zinc/24/73/18/134247318.db2.gz ROZVKNNGDLVYSZ-NWDGAFQWSA-N 2 0 238.400 2.411 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]CC2CC2)c2ccccc21 ZINC000169232480 134250249 /nfs/dbraw/zinc/25/02/49/134250249.db2.gz MUEQIPSIOVLDGY-STQMWFEESA-N 2 0 202.301 2.131 20 0 BEADRP CC[C@@H]1CCCC[C@@H]1[NH2+]CCOCC[NH+](C)C ZINC000219319125 134281498 /nfs/dbraw/zinc/28/14/98/134281498.db2.gz ADUSIJYVSWWVMT-KGLIPLIRSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@H](CC[NH3+])[NH2+]Cc1cccc(Cl)c1 ZINC000220483030 134305275 /nfs/dbraw/zinc/30/52/75/134305275.db2.gz HRENNMFHQNCNNC-SECBINFHSA-N 2 0 212.724 2.167 20 0 BEADRP Cc1cccc(C[NH2+][C@@H](C)CC[NH3+])c1C ZINC000220528625 134309767 /nfs/dbraw/zinc/30/97/67/134309767.db2.gz MLXULTKRLHTUQM-NSHDSACASA-N 2 0 206.333 2.130 20 0 BEADRP CCN(C)CC[NH2+][C@@H]1CC[C@@H](C)[C@@H](C)C1 ZINC000220677328 134311652 /nfs/dbraw/zinc/31/16/52/134311652.db2.gz VNKPUXKAJDSMJM-FRRDWIJNSA-N 2 0 212.381 2.352 20 0 BEADRP C[N@@H+]1CCC[C@@H]2C[NH+](C[Si](C)(C)C)CC[C@@H]21 ZINC000178629255 134312129 /nfs/dbraw/zinc/31/21/29/134312129.db2.gz FWVDWNAGQWSCES-OLZOCXBDSA-N 2 0 240.467 2.280 20 0 BEADRP CC(C)[C@@H]1CCCC[N@@H+]1CC1CC[NH2+]CC1 ZINC000178973764 134313853 /nfs/dbraw/zinc/31/38/53/134313853.db2.gz UVKOWESIIKSBQR-AWEZNQCLSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)C1CC[NH+](CC2CC[NH2+]CC2)CC1 ZINC000178975403 134314006 /nfs/dbraw/zinc/31/40/06/134314006.db2.gz HXVXOWZDFMRJOT-UHFFFAOYSA-N 2 0 224.392 2.354 20 0 BEADRP CC[N@H+](CC[C@@H]1CCC[NH+]1C)CC(C)C ZINC000179308064 134319509 /nfs/dbraw/zinc/31/95/09/134319509.db2.gz TUMVKMUVFGPVMH-ZDUSSCGKSA-N 2 0 212.381 2.449 20 0 BEADRP CC[C@@H](C)C[N@H+](C)CCC[NH+]1CCCC1 ZINC000179309684 134320107 /nfs/dbraw/zinc/32/01/07/134320107.db2.gz ZKORIVSUVXKBSW-CYBMUJFWSA-N 2 0 212.381 2.450 20 0 BEADRP C[C@H](CC1CC1)[NH2+][C@@H]1CCN2CCCC[C@@H]12 ZINC000222020922 134329434 /nfs/dbraw/zinc/32/94/34/134329434.db2.gz SIYXPCRGCOCYCW-BNOWGMLFSA-N 2 0 222.376 2.391 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]CC1(C)CC1 ZINC000222191613 134330082 /nfs/dbraw/zinc/33/00/82/134330082.db2.gz MNCPLLRIZULHKZ-WOPDTQHZSA-N 2 0 210.365 2.105 20 0 BEADRP CC(C)C1(C[NH2+][C@@H]2CC[N@H+](C)C[C@@H]2C)CC1 ZINC000222221377 134330723 /nfs/dbraw/zinc/33/07/23/134330723.db2.gz SNUDHVCQFKJEFK-QWHCGFSZSA-N 2 0 224.392 2.352 20 0 BEADRP CCC[NH+]1CCC([NH2+]C[C@](C)(O)CCC)CC1 ZINC000223487594 134339832 /nfs/dbraw/zinc/33/98/32/134339832.db2.gz NYEOYDMWBYHTKV-CQSZACIVSA-N 2 0 242.407 2.002 20 0 BEADRP CCC[NH+]1CCC([NH2+]C[C@@](C)(O)CCC)CC1 ZINC000223487544 134340186 /nfs/dbraw/zinc/34/01/86/134340186.db2.gz NYEOYDMWBYHTKV-AWEZNQCLSA-N 2 0 242.407 2.002 20 0 BEADRP [NH3+]C[C@H]1CC[N@H+](CCCC2CCCC2)C1 ZINC000226419705 134365918 /nfs/dbraw/zinc/36/59/18/134365918.db2.gz NDAGZHGCYBWEQL-CYBMUJFWSA-N 2 0 210.365 2.237 20 0 BEADRP CC[C@H](C)C[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@@H]1C ZINC000227204261 134375947 /nfs/dbraw/zinc/37/59/47/134375947.db2.gz HTLOIIFJKSVNMK-WUHRBBMRSA-N 2 0 212.381 2.351 20 0 BEADRP COC[C@H](C)C[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000227540160 134382883 /nfs/dbraw/zinc/38/28/83/134382883.db2.gz UKTPNPCHGRIBIU-LERXQTSPSA-N 2 0 234.343 2.003 20 0 BEADRP CCC[NH+](CCC)C[C@@H]1CC[NH2+][C@@H](C)C1 ZINC000233022115 134557810 /nfs/dbraw/zinc/55/78/10/134557810.db2.gz JAUFTGQMFWOCSB-QWHCGFSZSA-N 2 0 212.381 2.497 20 0 BEADRP CC[NH+](CC)[C@H]1CCN(c2cc[nH+]cc2C)C1 ZINC000192636020 134586401 /nfs/dbraw/zinc/58/64/01/134586401.db2.gz RTORFRRYXNUFNO-ZDUSSCGKSA-N 2 0 233.359 2.311 20 0 BEADRP C[C@@H]([NH2+]C1CCC([NH3+])CC1)[C@@H]1CC1(C)C ZINC000335652522 134852150 /nfs/dbraw/zinc/85/21/50/134852150.db2.gz IZRJQBCLPYDFQU-YYJSSNLHSA-N 2 0 210.365 2.281 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+]CCC[NH+]1CCCCC1 ZINC000163630189 135022671 /nfs/dbraw/zinc/02/26/71/135022671.db2.gz YPHVMPSRDRPHIK-CHWSQXEVSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@@H]1C[C@H]1C[NH2+]CCC[NH+]1CCCCC1 ZINC000163630400 135022977 /nfs/dbraw/zinc/02/29/77/135022977.db2.gz YPHVMPSRDRPHIK-OLZOCXBDSA-N 2 0 210.365 2.108 20 0 BEADRP CCOC(C)(C)C[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@H]1C ZINC000249173675 135036163 /nfs/dbraw/zinc/03/61/63/135036163.db2.gz YATGETYOJXOGMW-JHJVBQTASA-N 2 0 242.407 2.120 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)C2(C)CC2)C1 ZINC000249380221 135037852 /nfs/dbraw/zinc/03/78/52/135037852.db2.gz PVVZWCUMLHUSID-VXGBXAGGSA-N 2 0 210.365 2.106 20 0 BEADRP CCCCOCC[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000249904779 135047843 /nfs/dbraw/zinc/04/78/43/135047843.db2.gz XTPIKNBNZCNBEZ-KBPBESRZSA-N 2 0 240.391 2.020 20 0 BEADRP CCC[C@H](C)[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000251327677 135068110 /nfs/dbraw/zinc/06/81/10/135068110.db2.gz MUAWYPUPNOEPCQ-XQQFMLRXSA-N 2 0 210.365 2.391 20 0 BEADRP C[C@H](CC[NH+]1C[C@@H]2C[NH2+]C[C@H]2C1)c1ccccc1 ZINC000251280334 135068171 /nfs/dbraw/zinc/06/81/71/135068171.db2.gz ZBRDSZZLKCOBMI-KBMXLJTQSA-N 2 0 244.382 2.331 20 0 BEADRP CC[C@H](C)C[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000252028708 135082474 /nfs/dbraw/zinc/08/24/74/135082474.db2.gz YVGHZDKCZGZPLW-XQQFMLRXSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C[C@H]2CCCCS2)CC[N@@H+]1C ZINC000252148266 135085776 /nfs/dbraw/zinc/08/57/76/135085776.db2.gz OGCPYAHJXZQHBB-FRRDWIJNSA-N 2 0 242.432 2.344 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000252175278 135086011 /nfs/dbraw/zinc/08/60/11/135086011.db2.gz OUXRQVDXXIDWEB-RFGFWPKPSA-N 2 0 222.376 2.391 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+]C[C@H]1CC[N@H+](CC)C1 ZINC000252439516 135089193 /nfs/dbraw/zinc/08/91/93/135089193.db2.gz PPFDCIHSNHBGOP-RWMBFGLXSA-N 2 0 212.381 2.352 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1Nc1ccncc1Cl ZINC000086840120 135098664 /nfs/dbraw/zinc/09/86/64/135098664.db2.gz UDZUFQMNSZBVSU-WCBMZHEXSA-N 2 0 225.723 2.274 20 0 BEADRP CCC1(C[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)CC1 ZINC000252732460 135104775 /nfs/dbraw/zinc/10/47/75/135104775.db2.gz VDXFCZBOUYYXFI-STQMWFEESA-N 2 0 222.376 2.393 20 0 BEADRP C[C@H](O)C[C@H](C)[NH2+][C@@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000252751543 135107623 /nfs/dbraw/zinc/10/76/23/135107623.db2.gz GRXBOFOXLFVHJM-XDQVBPFNSA-N 2 0 242.407 2.046 20 0 BEADRP C[C@@H]1CCCC[C@H]1[NH2+][C@H]1CCC[NH2+]CC1 ZINC000252793615 135110943 /nfs/dbraw/zinc/11/09/43/135110943.db2.gz XMAXGFPILDAGTE-FRRDWIJNSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]Cc1ccc(F)cc1 ZINC000252894789 135116546 /nfs/dbraw/zinc/11/65/46/135116546.db2.gz WQPXUVKWDCBGPF-SMDDNHRTSA-N 2 0 236.334 2.256 20 0 BEADRP CSCC[C@@H](C)[N@H+](C)CC[C@H]1CC[NH2+]C1 ZINC000253073767 135120370 /nfs/dbraw/zinc/12/03/70/135120370.db2.gz PBTJEQDQHUXRTC-VXGBXAGGSA-N 2 0 230.421 2.059 20 0 BEADRP CSCC[C@H](C)[N@H+](C)CC[C@H]1CC[NH2+]C1 ZINC000253073766 135120401 /nfs/dbraw/zinc/12/04/01/135120401.db2.gz PBTJEQDQHUXRTC-NWDGAFQWSA-N 2 0 230.421 2.059 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@H]2CCC[C@@H]([NH3+])C2)C1 ZINC000253199542 135123927 /nfs/dbraw/zinc/12/39/27/135123927.db2.gz AOVLIHADRRDYJF-XQHKEYJVSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]1CC[N@H+](Cc2cccc(F)c2)C[C@H]1C[NH3+] ZINC000253199035 135124185 /nfs/dbraw/zinc/12/41/85/135124185.db2.gz WCKKLOUOPSZFKP-WCQYABFASA-N 2 0 236.334 2.242 20 0 BEADRP CC1(C)CC[C@H]([NH2+][C@@H]2CCC[C@H]2C[NH3+])C1 ZINC000253234649 135124897 /nfs/dbraw/zinc/12/48/97/135124897.db2.gz DIFWHHWQDABYPI-SDDRHHMPSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+][C@@H]1CCCC[C@H]1[NH2+]CC1CCCCC1 ZINC000258822703 135134584 /nfs/dbraw/zinc/13/45/84/135134584.db2.gz CWGLNPXOGBSXOV-CHWSQXEVSA-N 2 0 210.365 2.426 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@@]3(CC[NH2+]C3)C2)s1 ZINC000257645074 135137748 /nfs/dbraw/zinc/13/77/48/135137748.db2.gz BVSSXABOMLFLMZ-CYBMUJFWSA-N 2 0 236.384 2.242 20 0 BEADRP Fc1ccc(C[NH+]2CCC3(CC[NH2+]C3)CC2)cc1 ZINC000257695709 135139745 /nfs/dbraw/zinc/13/97/45/135139745.db2.gz OTFITLZYXYCSGI-UHFFFAOYSA-N 2 0 248.345 2.401 20 0 BEADRP C[C@@H](c1cccnc1)[NH+]1CCC2(CC[NH2+]C2)CC1 ZINC000257751463 135141791 /nfs/dbraw/zinc/14/17/91/135141791.db2.gz UWXNQHFHTOXNMX-ZDUSSCGKSA-N 2 0 245.370 2.218 20 0 BEADRP CCCC[NH+]1CCC([C@@H]2CC[NH2+]C2)CC1 ZINC000259267178 135142810 /nfs/dbraw/zinc/14/28/10/135142810.db2.gz NKACCPKYROODCP-CYBMUJFWSA-N 2 0 210.365 2.108 20 0 BEADRP CC[C@@H](C)[NH+]1CCC([C@@H]2CC[NH2+]C2)CC1 ZINC000259321275 135142843 /nfs/dbraw/zinc/14/28/43/135142843.db2.gz QUNYTQYOVSDZED-DGCLKSJQSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[NH2+]C[C@H]1CCC[NH2+]1 ZINC000261529824 135156261 /nfs/dbraw/zinc/15/62/61/135156261.db2.gz BMAPOBYHKKYUOD-JHJVBQTASA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+][C@H]1CCCC1(C)C ZINC000261530602 135158458 /nfs/dbraw/zinc/15/84/58/135158458.db2.gz CUFCAXXKWVDTMV-UTUOFQBUSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]1C[C@@H](C[NH3+])C[N@@H+]1CCC1CCCC1 ZINC000261531587 135160949 /nfs/dbraw/zinc/16/09/49/135160949.db2.gz HEGSHJVHWVDGEM-AAEUAGOBSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@@H]1C[C@@H](C[NH3+])C[N@@H+]1CCC1CCCC1 ZINC000261531590 135161186 /nfs/dbraw/zinc/16/11/86/135161186.db2.gz HEGSHJVHWVDGEM-YPMHNXCESA-N 2 0 210.365 2.236 20 0 BEADRP C[C@@H]1C[N@H+](C[C@H]2CCC[C@@H](C)C2)C[C@@H]1[NH3+] ZINC000261531841 135161861 /nfs/dbraw/zinc/16/18/61/135161861.db2.gz IALMBPNPHJGOON-NDBYEHHHSA-N 2 0 210.365 2.092 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2CC[C@@H](C)[C@H](C)C2)CC[NH2+]1 ZINC000261532388 135162266 /nfs/dbraw/zinc/16/22/66/135162266.db2.gz ARXCWQRKBJWRAI-AAVRWANBSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]C[C@@H]1CCCS1 ZINC000087667826 135162732 /nfs/dbraw/zinc/16/27/32/135162732.db2.gz GQOHRAQPBBWBEP-NDBYEHHHSA-N 2 0 242.432 2.200 20 0 BEADRP Cc1cc(CN(C)[C@@H](C)C[NH3+])ccc1Cl ZINC000261532347 135162916 /nfs/dbraw/zinc/16/29/16/135162916.db2.gz AHDGKWWPWPJJQT-JTQLQIEISA-N 2 0 226.751 2.427 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+][C@H]1CCCC[C@H]1C[NH3+] ZINC000261532863 135163368 /nfs/dbraw/zinc/16/33/68/135163368.db2.gz KLGWZNIDTULJDQ-SRVKXCTJSA-N 2 0 210.365 2.282 20 0 BEADRP C1C[NH2+][C@H]([C@@H]2CCC[C@H]2[NH2+][C@@H]2CCSC2)C1 ZINC000261532731 135163603 /nfs/dbraw/zinc/16/36/03/135163603.db2.gz DILAQRVEAXCFPM-MROQNXINSA-N 2 0 240.416 2.002 20 0 BEADRP C[C@H]1C[C@@H](C[N@H+](C)CCC2CC2)CC[NH2+]1 ZINC000261533286 135164756 /nfs/dbraw/zinc/16/47/56/135164756.db2.gz KQAGFIPUOKFHDR-AAEUAGOBSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1CC[N@H+](CCC2CC[NH2+]CC2)[C@H]1C ZINC000261533510 135164852 /nfs/dbraw/zinc/16/48/52/135164852.db2.gz BEUSTCWIWJNKHW-NEPJUHHUSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H](CN1C[C@@H](C)[C@H]([NH3+])C1)c1ccccc1 ZINC000261533334 135165095 /nfs/dbraw/zinc/16/50/95/135165095.db2.gz GPMHLKIBQHNTNL-YRGRVCCFSA-N 2 0 218.344 2.069 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2CCC[C@@H](C)[C@H]2C)CC[NH2+]1 ZINC000261533909 135165687 /nfs/dbraw/zinc/16/56/87/135165687.db2.gz LDGOYXDXDFYFRM-AAVRWANBSA-N 2 0 224.392 2.495 20 0 BEADRP CS[C@@H]1CCC[C@H]([NH2+][C@H]2CCC[C@H]2C[NH3+])C1 ZINC000261534119 135165904 /nfs/dbraw/zinc/16/59/04/135165904.db2.gz NIVIQGCIOSYNSZ-RVMXOQNASA-N 2 0 242.432 2.378 20 0 BEADRP CC(C)C[N@H+](C[C@@H]1CC[NH2+][C@H](C)C1)C1CC1 ZINC000261534209 135166450 /nfs/dbraw/zinc/16/64/50/135166450.db2.gz OTNOTEOISXTQPE-CHWSQXEVSA-N 2 0 224.392 2.495 20 0 BEADRP C[N@H+](C[C@H]1CCC[NH2+]C1)[C@H]1CCC(C)(C)C1 ZINC000261534482 135166900 /nfs/dbraw/zinc/16/69/00/135166900.db2.gz RDPKKIHJHGFTRL-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@@H]2CCC(C)(C)C2)CC1 ZINC000087771473 135167456 /nfs/dbraw/zinc/16/74/56/135167456.db2.gz SLHNSDQZMROXKJ-CYBMUJFWSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@H]2CC[NH2+]C[C@@H]2C)C1 ZINC000261535655 135170254 /nfs/dbraw/zinc/17/02/54/135170254.db2.gz OXJXYFMMSDRMFP-VOAKCMCISA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[NH2+]C[C@@H]2C)C1 ZINC000261535653 135170469 /nfs/dbraw/zinc/17/04/69/135170469.db2.gz OXJXYFMMSDRMFP-MROQNXINSA-N 2 0 210.365 2.153 20 0 BEADRP Cc1[nH+]ccc(NC[C@@H]2CCC[NH2+]2)c1Cl ZINC000261537092 135173242 /nfs/dbraw/zinc/17/32/42/135173242.db2.gz UVRCRAILTQRUEO-VIFPVBQESA-N 2 0 225.723 2.207 20 0 BEADRP CC[C@@H]1CC[N@H+](C[C@H]2CC[NH2+][C@H](C)C2)C1 ZINC000261538470 135176249 /nfs/dbraw/zinc/17/62/49/135176249.db2.gz YFKGEZUVMPFYGK-UPJWGTAASA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@H]1C[C@H](C)C[N@@H+]1CC1CC[NH2+]CC1 ZINC000261539018 135176903 /nfs/dbraw/zinc/17/69/03/135176903.db2.gz BJONZPNEMNGSHX-AAEUAGOBSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]1C[N@H+](CCC2CCCCC2)C[C@H]1[NH3+] ZINC000261538910 135177496 /nfs/dbraw/zinc/17/74/96/135177496.db2.gz ZTDWQJFLWKRRLN-WCQYABFASA-N 2 0 210.365 2.236 20 0 BEADRP CC[C@@H]1C[C@H](C)C[N@@H+]1CC1CC[NH2+]CC1 ZINC000261539020 135177510 /nfs/dbraw/zinc/17/75/10/135177510.db2.gz BJONZPNEMNGSHX-WCQYABFASA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1CN(Cc2ccc(C3CC3)cc2)C[C@H]1[NH3+] ZINC000261539761 135178772 /nfs/dbraw/zinc/17/87/72/135178772.db2.gz BMMLDUQNORJTDE-IAQYHMDHSA-N 2 0 230.355 2.343 20 0 BEADRP CC[C@@H]1[C@@H](C)CC[N@@H+]1C[C@H]1CCC[NH2+]C1 ZINC000261548324 135187028 /nfs/dbraw/zinc/18/70/28/135187028.db2.gz NKKWLYVOQIBZHK-RWMBFGLXSA-N 2 0 210.365 2.106 20 0 BEADRP Cc1ncsc1C[N@H+]1CCC[C@H]([C@@H](C)[NH3+])C1 ZINC000084149535 135188076 /nfs/dbraw/zinc/18/80/76/135188076.db2.gz MYGYFDWLGYLNFM-KOLCDFICSA-N 2 0 239.388 2.011 20 0 BEADRP C[C@@H]1CCCC[N@H+](C[C@@]2(C)CC[NH2+]C2)C1 ZINC000261551332 135189807 /nfs/dbraw/zinc/18/98/07/135189807.db2.gz QJGAGMVXVZPUCP-OLZOCXBDSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@@H]1CCCC[N@H+](C[C@]2(C)CC[NH2+]C2)C1 ZINC000261551331 135190117 /nfs/dbraw/zinc/19/01/17/135190117.db2.gz QJGAGMVXVZPUCP-CHWSQXEVSA-N 2 0 210.365 2.108 20 0 BEADRP Cc1cccc(C[N@@H+]2CC[C@@H]3[NH2+]CC[C@@H]3C2)c1C ZINC000261553059 135191648 /nfs/dbraw/zinc/19/16/48/135191648.db2.gz ABOOVRFOPLPRTJ-CVEARBPZSA-N 2 0 244.382 2.487 20 0 BEADRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]CCc1cccs1 ZINC000084217773 135193058 /nfs/dbraw/zinc/19/30/58/135193058.db2.gz DZMLAVGRKJTVIB-PWSUYJOCSA-N 2 0 224.373 2.008 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]CCc1cccs1 ZINC000084217774 135193319 /nfs/dbraw/zinc/19/33/19/135193319.db2.gz DZMLAVGRKJTVIB-CMPLNLGQSA-N 2 0 224.373 2.008 20 0 BEADRP Cc1ccc(C)c(C[N@@H+]2C[C@@H]3CC[C@H]([NH3+])[C@@H]3C2)c1 ZINC000261556909 135197012 /nfs/dbraw/zinc/19/70/12/135197012.db2.gz CFRTWQJWHXLSGL-IMJJTQAJSA-N 2 0 244.382 2.473 20 0 BEADRP C[C@@H]1[C@@H]([NH3+])CCN1c1cc[nH+]c2ccccc21 ZINC000261556770 135197180 /nfs/dbraw/zinc/19/71/80/135197180.db2.gz RAJLZYZSAUFQMG-PWSUYJOCSA-N 2 0 227.311 2.161 20 0 BEADRP CCOc1ccc(CN2CC[C@@H]([NH3+])[C@H]2C)cc1 ZINC000261558404 135199519 /nfs/dbraw/zinc/19/95/19/135199519.db2.gz SHXRZSDQJYXLIH-BXUZGUMPSA-N 2 0 234.343 2.007 20 0 BEADRP C[C@@H]([NH3+])CN(C)Cc1ccc(OC(F)F)cc1 ZINC000261558469 135199536 /nfs/dbraw/zinc/19/95/36/135199536.db2.gz SMZWXFPXUMSLPZ-SECBINFHSA-N 2 0 244.285 2.067 20 0 BEADRP CCOc1ccc(CN2CC[C@H]([NH3+])[C@H]2C)cc1 ZINC000261558406 135199558 /nfs/dbraw/zinc/19/95/58/135199558.db2.gz SHXRZSDQJYXLIH-RISCZKNCSA-N 2 0 234.343 2.007 20 0 BEADRP CCC1(C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)CCOCC1 ZINC000261560187 135201038 /nfs/dbraw/zinc/20/10/38/135201038.db2.gz UJEIPOZHPSIFEM-OLZOCXBDSA-N 2 0 240.391 2.053 20 0 BEADRP Cc1ccccc1C[N@@H+]1CC[C@@H]2[NH2+]CC[C@@H]2C1 ZINC000261561678 135202525 /nfs/dbraw/zinc/20/25/25/135202525.db2.gz VPESSKODPJYVGW-CABCVRRESA-N 2 0 230.355 2.179 20 0 BEADRP Cc1nc(C)c(C[NH2+][C@H]2CCC[C@H]([NH3+])C2)s1 ZINC000261562666 135204002 /nfs/dbraw/zinc/20/40/02/135204002.db2.gz BMIOJCCBDGOZQC-QWRGUYRKSA-N 2 0 239.388 2.119 20 0 BEADRP Cc1nc(C)c(C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)s1 ZINC000261562660 135204246 /nfs/dbraw/zinc/20/42/46/135204246.db2.gz BMIOJCCBDGOZQC-GHMZBOCLSA-N 2 0 239.388 2.119 20 0 BEADRP Fc1cccc(CN2CC[C@H]3[NH2+]CC[C@H]3C2)c1 ZINC000261563397 135205116 /nfs/dbraw/zinc/20/51/16/135205116.db2.gz XBCRYJORSRBKLU-GXTWGEPZSA-N 2 0 234.318 2.010 20 0 BEADRP Cc1ccc(F)cc1C[N@@H+]1C[C@@H]2CC[C@H]([NH3+])[C@H]2C1 ZINC000261564734 135206654 /nfs/dbraw/zinc/20/66/54/135206654.db2.gz HLFFRXGXANSTNY-CQDKDKBSSA-N 2 0 248.345 2.303 20 0 BEADRP Cc1cc(C)cc(C[N@@H+]2CC[C@H]3C[NH2+]C[C@H]3C2)c1 ZINC000261564767 135207267 /nfs/dbraw/zinc/20/72/67/135207267.db2.gz HMOSLOKVLKLPNH-HOTGVXAUSA-N 2 0 244.382 2.345 20 0 BEADRP CCSCCC[NH2+]C1CC[NH+](CC)CC1 ZINC000163817569 135208242 /nfs/dbraw/zinc/20/82/42/135208242.db2.gz IRGMUZLAXCNWAA-UHFFFAOYSA-N 2 0 230.421 2.204 20 0 BEADRP CS[C@@H](C)C[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000163891565 135209526 /nfs/dbraw/zinc/20/95/26/135209526.db2.gz BIWOZRXFTWBWMD-NSHDSACASA-N 2 0 230.421 2.200 20 0 BEADRP Cc1ccccc1C[C@H](C)[NH2+]CC(C)(C)[NH3+] ZINC000261567034 135209606 /nfs/dbraw/zinc/20/96/06/135209606.db2.gz DVGGBLZYXULRHG-LBPRGKRZSA-N 2 0 220.360 2.253 20 0 BEADRP Cc1[nH+]ccc(N2CCC[C@@H](C[NH3+])C2)c1Cl ZINC000261568751 135210053 /nfs/dbraw/zinc/21/00/53/135210053.db2.gz FVKHQKFDQCUPFE-JTQLQIEISA-N 2 0 239.750 2.219 20 0 BEADRP C[C@@H]([NH3+])[C@@H](C)[NH2+]C1CCC(C(F)(F)F)CC1 ZINC000261568936 135211079 /nfs/dbraw/zinc/21/10/79/135211079.db2.gz FZRAZBAQRLAIOS-LGUIWLBCSA-N 2 0 238.297 2.433 20 0 BEADRP C[C@@H]1CCC[C@@H](C[N@@H+]2CC[C@](C)(C[NH3+])C2)C1 ZINC000261571040 135213263 /nfs/dbraw/zinc/21/32/63/135213263.db2.gz HILKKQXIYFMPLT-MGPQQGTHSA-N 2 0 224.392 2.483 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@H]3[NH2+]CC[C@@H]3C2)cc1C ZINC000261572170 135213680 /nfs/dbraw/zinc/21/36/80/135213680.db2.gz LMSLJIOOTXITCN-HZPDHXFCSA-N 2 0 244.382 2.487 20 0 BEADRP C[C@@H]([NH3+])[C@H](C)[NH2+][C@H](C)Cc1ccc(F)cc1 ZINC000261572840 135214945 /nfs/dbraw/zinc/21/49/45/135214945.db2.gz IJKRPGZGKQCBNE-MXWKQRLJSA-N 2 0 224.323 2.082 20 0 BEADRP CCOc1cccc(C[NH2+][C@@H]2CC[NH2+]C[C@@H]2C)c1 ZINC000261572567 135215243 /nfs/dbraw/zinc/21/52/43/135215243.db2.gz LSPMPVJPXHKCLD-SWLSCSKDSA-N 2 0 248.370 2.173 20 0 BEADRP C[C@@H]([NH2+][C@@H](c1ccccc1)C1CC1)[C@H](C)[NH3+] ZINC000261575863 135216715 /nfs/dbraw/zinc/21/67/15/135216715.db2.gz JYGOBQLFRJOGFS-WDMOLILDSA-N 2 0 218.344 2.463 20 0 BEADRP Cc1ccc(C[N@@H+]2C[C@@H]3CC[C@H]([NH3+])[C@H]3C2)cc1F ZINC000261575515 135216985 /nfs/dbraw/zinc/21/69/85/135216985.db2.gz NDJLJECDSMWMIU-YDHLFZDLSA-N 2 0 248.345 2.303 20 0 BEADRP Cc1[nH+]ccc(N2C[C@H](C)[NH2+]C[C@H]2C)c1Cl ZINC000261576982 135218737 /nfs/dbraw/zinc/21/87/37/135218737.db2.gz KSFQLJPTZAUGSC-DTWKUNHWSA-N 2 0 239.750 2.230 20 0 BEADRP C[C@H](Cc1ccc(F)cc1)[NH2+]CC(C)(C)[NH3+] ZINC000261579153 135219601 /nfs/dbraw/zinc/21/96/01/135219601.db2.gz MCDNTNHKMYHUBB-SNVBAGLBSA-N 2 0 224.323 2.084 20 0 BEADRP Cc1ccoc1C[NH2+][C@H]1CCCC[C@H]1C[NH3+] ZINC000261579551 135220494 /nfs/dbraw/zinc/22/04/94/135220494.db2.gz MHMYHGZACUBKOJ-RYUDHWBXSA-N 2 0 222.332 2.195 20 0 BEADRP Cc1cccc(C)c1C[N@@H+]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000261583456 135223944 /nfs/dbraw/zinc/22/39/44/135223944.db2.gz RUAYTSLCBHWOSE-GJZGRUSLSA-N 2 0 244.382 2.345 20 0 BEADRP Cc1cccc(C)c1C[N@@H+]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000261583457 135224143 /nfs/dbraw/zinc/22/41/43/135224143.db2.gz RUAYTSLCBHWOSE-HUUCEWRRSA-N 2 0 244.382 2.345 20 0 BEADRP CC(C)([NH3+])C[NH2+][C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000261584330 135225356 /nfs/dbraw/zinc/22/53/56/135225356.db2.gz PQBKTUVSYJDLDW-DTWKUNHWSA-N 2 0 238.297 2.434 20 0 BEADRP CC(C)([NH3+])C[NH2+][C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000261584332 135225429 /nfs/dbraw/zinc/22/54/29/135225429.db2.gz PQBKTUVSYJDLDW-RKDXNWHRSA-N 2 0 238.297 2.434 20 0 BEADRP Cc1ccc(C)c(C[N@@H+]2CC[C@@H]3C[NH2+]C[C@@H]3C2)c1 ZINC000261585619 135226848 /nfs/dbraw/zinc/22/68/48/135226848.db2.gz TYCRLJLTKXELAM-GDBMZVCRSA-N 2 0 244.382 2.345 20 0 BEADRP COc1cccc([C@H](C)[NH2+][C@@H]2CC[NH2+]C[C@@H]2C)c1 ZINC000261585532 135227147 /nfs/dbraw/zinc/22/71/47/135227147.db2.gz SZFKQRKXAGJVRU-SLEUVZQESA-N 2 0 248.370 2.344 20 0 BEADRP C[C@@H]([NH3+])[C@H](C)[NH2+]C1C2CC3CC(C2)CC1C3 ZINC000261589030 135229368 /nfs/dbraw/zinc/22/93/68/135229368.db2.gz SUWQYLJTWHUURA-GCORVOKCSA-N 2 0 222.376 2.136 20 0 BEADRP Cc1cccc(C[NH2+][C@@](C)(C[NH3+])C(C)C)c1 ZINC000261591388 135231941 /nfs/dbraw/zinc/23/19/41/135231941.db2.gz VELCNSHHETYFIO-AWEZNQCLSA-N 2 0 220.360 2.458 20 0 BEADRP C[C@H]1CCC[C@H](C[N@H+](C)C2CC[NH2+]CC2)C1 ZINC000261592014 135233065 /nfs/dbraw/zinc/23/30/65/135233065.db2.gz VQTSRFLOSWNUPG-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000261598524 135236507 /nfs/dbraw/zinc/23/65/07/135236507.db2.gz ZPXBDOZDKLLUPN-IKOXMDCHSA-N 2 0 222.376 2.295 20 0 BEADRP COc1ccc(C[NH2+][C@](C)(C[NH3+])C(C)C)cc1 ZINC000261548073 135241668 /nfs/dbraw/zinc/24/16/68/135241668.db2.gz JBKQAGNJVTZCKB-CQSZACIVSA-N 2 0 236.359 2.158 20 0 BEADRP C(C1CC1)[N@H+](C[C@@H]1CCC[NH2+]C1)C1CCC1 ZINC000261790078 135253558 /nfs/dbraw/zinc/25/35/58/135253558.db2.gz GBYGOTALQXPDSS-CYBMUJFWSA-N 2 0 222.376 2.251 20 0 BEADRP Cc1nc2ccc(CN(C)[C@@H](C)C[NH3+])cc2s1 ZINC000261803569 135254650 /nfs/dbraw/zinc/25/46/50/135254650.db2.gz HCHDWPXEZGRNJX-VIFPVBQESA-N 2 0 249.383 2.384 20 0 BEADRP C[C@]1(C[N@@H+]2CCC[C@@H]2C2CCC2)CC[NH2+]C1 ZINC000261866176 135257836 /nfs/dbraw/zinc/25/78/36/135257836.db2.gz NVPDWSBMSHJHAD-KGLIPLIRSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@]1(C[N@@H+]2CCC[C@H]2c2ccc[nH]2)CC[NH2+]C1 ZINC000261878414 135259323 /nfs/dbraw/zinc/25/93/23/135259323.db2.gz QJZOMRMSMUUOLH-KBPBESRZSA-N 2 0 233.359 2.151 20 0 BEADRP C[C@@H]1C[C@H]1C[NH+]1CCC([NH2+]CC2CC2)CC1 ZINC000261948518 135265185 /nfs/dbraw/zinc/26/51/85/135265185.db2.gz NNXTWXZFEUVSCU-YPMHNXCESA-N 2 0 222.376 2.106 20 0 BEADRP CC[C@@H]1CCC[C@H](C[N@@H+]2C[C@@H](C)[C@@H]([NH3+])C2)C1 ZINC000261961715 135267333 /nfs/dbraw/zinc/26/73/33/135267333.db2.gz HJGBMLNDKDXVHO-MQYQWHSLSA-N 2 0 224.392 2.482 20 0 BEADRP c1cc(C[N@@H+]2CCC3(C2)CC[NH2+]CC3)cs1 ZINC000261986647 135269644 /nfs/dbraw/zinc/26/96/44/135269644.db2.gz JUMHUSUIGHLWQY-UHFFFAOYSA-N 2 0 236.384 2.324 20 0 BEADRP C[C@@H]1C[N@H+](C[C@H]2CCC[NH2+]C2)CC(C)(C)C1 ZINC000261985113 135269725 /nfs/dbraw/zinc/26/97/25/135269725.db2.gz RVGZBQXHIWFXSL-STQMWFEESA-N 2 0 224.392 2.354 20 0 BEADRP CO[C@H](C[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21)C1CC1 ZINC000262002034 135271044 /nfs/dbraw/zinc/27/10/44/135271044.db2.gz PXVLFXJALXIERM-RRFJBIMHSA-N 2 0 246.354 2.146 20 0 BEADRP C[C@@H]1C[C@H](C)CC[N@H+](C[C@]2(C)CC[NH2+]C2)C1 ZINC000262018970 135272837 /nfs/dbraw/zinc/27/28/37/135272837.db2.gz MZAIOAJVQDWRDN-MGPQQGTHSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H]1CCC[C@@H](C)[N@H+](C[C@]2(C)CC[NH2+]C2)C1 ZINC000262043237 135276065 /nfs/dbraw/zinc/27/60/65/135276065.db2.gz PJMDZKLQCWQFGX-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@]1(C[N@H+](CC2CC2)C2CCC2)CC[NH2+]C1 ZINC000262064459 135276521 /nfs/dbraw/zinc/27/65/21/135276521.db2.gz RLCBZPNZLHLUKP-CQSZACIVSA-N 2 0 222.376 2.251 20 0 BEADRP C[N@H+](C[C@@]1(C)CC[NH2+]C1)C(C1CC1)C1CC1 ZINC000262089380 135278563 /nfs/dbraw/zinc/27/85/63/135278563.db2.gz URSZFVNIMPLKOP-AWEZNQCLSA-N 2 0 222.376 2.106 20 0 BEADRP C[C@H]1SCCN(CC[NH3+])[C@@H]1c1ccccc1 ZINC000262952180 135324945 /nfs/dbraw/zinc/32/49/45/135324945.db2.gz JTWNYDGYAHEMCB-YPMHNXCESA-N 2 0 236.384 2.124 20 0 BEADRP CC(C)(C)CC[N@@H+]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC000334357192 135372361 /nfs/dbraw/zinc/37/23/61/135372361.db2.gz PKVGWNDIYMADCN-AWEZNQCLSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H]1CCC[C@H](C[N@H+]2C[C@@H]3[NH2+]CCC[C@H]3C2)C1 ZINC000299916049 135381570 /nfs/dbraw/zinc/38/15/70/135381570.db2.gz GXQFRDSJRVWWGQ-QPSCCSFWSA-N 2 0 236.403 2.497 20 0 BEADRP C[NH+](C)CCC[NH2+][C@@H]1CCC[C@@H](C2CC2)C1 ZINC000081624257 135388554 /nfs/dbraw/zinc/38/85/54/135388554.db2.gz VTVATOHGEBIAKP-ZIAGYGMSSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1ncsc1C[NH2+][C@@H]1CCCC[C@@H]1C[NH3+] ZINC000084216801 135467344 /nfs/dbraw/zinc/46/73/44/135467344.db2.gz NTNYQFDCGIOWMU-GHMZBOCLSA-N 2 0 239.388 2.059 20 0 BEADRP Cc1ccc2cc(C[NH2+]CCCC[NH3+])ccc2n1 ZINC000097861477 135632315 /nfs/dbraw/zinc/63/23/15/135632315.db2.gz FZAAXWARVGOORQ-UHFFFAOYSA-N 2 0 243.354 2.372 20 0 BEADRP [NH3+][C@H]1CCC[C@H](C[NH2+]C2Cc3ccccc3C2)C1 ZINC000334851129 135823443 /nfs/dbraw/zinc/82/34/43/135823443.db2.gz ZWSFFXFLSLQNCP-WFASDCNBSA-N 2 0 244.382 2.261 20 0 BEADRP CC[C@H]1CCC[N@H+](CCc2cncn2C)C1 ZINC000347738918 136004968 /nfs/dbraw/zinc/00/49/68/136004968.db2.gz WZBJNCCLHZSNMP-LBPRGKRZSA-N 2 0 221.348 2.085 20 0 BEADRP C[C@@H]1CN(C2CC2)C[C@@H]1[NH2+][C@H]1CC[C@H]1C1CC1 ZINC000348086565 136034808 /nfs/dbraw/zinc/03/48/08/136034808.db2.gz PWJOFWVDNJNBMT-KJEVXHAQSA-N 2 0 234.387 2.247 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]C2CC(C)(F)C2)[C@@H](C)C1 ZINC000335373321 136084495 /nfs/dbraw/zinc/08/44/95/136084495.db2.gz HXQCGKVKYSFLMR-GMKTYKIGSA-N 2 0 228.355 2.197 20 0 BEADRP Cc1cc(N)cc(C[NH2+][C@H]2CCCCC[C@@H]2[NH3+])c1 ZINC000335364714 136095254 /nfs/dbraw/zinc/09/52/54/136095254.db2.gz WDNQNOWSTWYLEE-GJZGRUSLSA-N 2 0 247.386 2.327 20 0 BEADRP Cc1cccc2c1[C@H](C)C[C@H]2[NH2+]CC1C[NH2+]C1 ZINC000335551537 136098132 /nfs/dbraw/zinc/09/81/32/136098132.db2.gz HKYVJVUJEWOGIN-BXUZGUMPSA-N 2 0 230.355 2.352 20 0 BEADRP Cc1ccccc1C[NH+]1CCC2(CC[NH2+]2)CC1 ZINC000335562356 136106699 /nfs/dbraw/zinc/10/66/99/136106699.db2.gz SYOINNOSBSUIML-UHFFFAOYSA-N 2 0 230.355 2.323 20 0 BEADRP COc1ccc2c(c1)[C@@H]([NH2+]C1CC[NH2+]CC1)CC2 ZINC000335566997 136107947 /nfs/dbraw/zinc/10/79/47/136107947.db2.gz HTNCDIRNTIRWDM-HNNXBMFYSA-N 2 0 246.354 2.024 20 0 BEADRP Cc1ccc(C[NH2+]CC[C@H]2CCC[NH2+]2)s1 ZINC000050226786 322848617 /nfs/dbraw/zinc/84/86/17/322848617.db2.gz GJAZESKPABICNN-LLVKDONJSA-N 2 0 224.373 2.288 20 0 BEADRP C[N@H+](CCCC1CC[NH2+]CC1)C(C)(C)C ZINC000381958694 397851068 /nfs/dbraw/zinc/85/10/68/397851068.db2.gz FHJLPCWYFKZANX-UHFFFAOYSA-N 2 0 212.381 2.497 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000388106832 397871757 /nfs/dbraw/zinc/87/17/57/397871757.db2.gz XVXHKKGSJKJTOS-RQJABVFESA-N 2 0 222.376 2.249 20 0 BEADRP Cc1c[nH+]ccc1NCC[N@@H+]1CCCC(C)(C)C1 ZINC000358915564 397943074 /nfs/dbraw/zinc/94/30/74/397943074.db2.gz ORVWZODECCHYQQ-UHFFFAOYSA-N 2 0 247.386 2.346 20 0 BEADRP Cc1c[nH+]ccc1NC[C@@H]1CCCC[N@@H+]1C1CC1 ZINC000358916103 397943306 /nfs/dbraw/zinc/94/33/06/397943306.db2.gz RBQKJCGCOVEYDS-AWEZNQCLSA-N 2 0 245.370 2.241 20 0 BEADRP CCc1cc(NCC[N@H+]2CC=C(C)CC2)cc[nH+]1 ZINC000450442421 397963785 /nfs/dbraw/zinc/96/37/85/397963785.db2.gz WYBGZNRQRGFQOT-UHFFFAOYSA-N 2 0 245.370 2.130 20 0 BEADRP C[C@H]([NH2+]CCC[NH+]1CCCC1)[C@@H]1CCCCO1 ZINC000383087824 397998678 /nfs/dbraw/zinc/99/86/78/397998678.db2.gz KPPLKLDYCSGGMG-KBPBESRZSA-N 2 0 240.391 2.020 20 0 BEADRP C[N@H+](CCCc1ccccc1)C[C@H]1CC[NH2+]C1 ZINC000382761521 397972288 /nfs/dbraw/zinc/97/22/88/397972288.db2.gz YZLIJIJRQVRIQO-HNNXBMFYSA-N 2 0 232.371 2.161 20 0 BEADRP CC(C)CCC[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000054243378 397972752 /nfs/dbraw/zinc/97/27/52/397972752.db2.gz PQNMIEHKVPVSFJ-ZDUSSCGKSA-N 2 0 212.381 2.354 20 0 BEADRP C[C@@H]1C[C@@H](C)[N@H+](CC2CCC2)C[C@@H]1C[NH3+] ZINC000397321480 397976638 /nfs/dbraw/zinc/97/66/38/397976638.db2.gz SXUIMHBGRVDDCH-WZRBSPASSA-N 2 0 210.365 2.092 20 0 BEADRP C[C@H](CSCCF)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000595046323 397979679 /nfs/dbraw/zinc/97/96/79/397979679.db2.gz KXLWJYNAVPMCIU-UTUOFQBUSA-N 2 0 248.411 2.007 20 0 BEADRP CC(C)[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000414858849 398066037 /nfs/dbraw/zinc/06/60/37/398066037.db2.gz SPZPIOXXLOHYNH-RDBSUJKOSA-N 2 0 224.392 2.400 20 0 BEADRP CC[C@H](C)C[NH2+]CCC1CC[NH+](C)CC1 ZINC000093067172 398093759 /nfs/dbraw/zinc/09/37/59/398093759.db2.gz KKXQGVUGXWIIDT-LBPRGKRZSA-N 2 0 212.381 2.354 20 0 BEADRP CC[C@@H]1CN(CCC[NH+](CC)CC)[C@@H](C)CO1 ZINC000649735590 398076486 /nfs/dbraw/zinc/07/64/86/398076486.db2.gz NIXCWSYIPYWEEO-UONOGXRCSA-N 2 0 242.407 2.218 20 0 BEADRP CC[NH+](CC)CCC[N@H+](CC)[C@H]1CCCOC1 ZINC000649755394 398086686 /nfs/dbraw/zinc/08/66/86/398086686.db2.gz MVAKSJBRKKCUFD-AWEZNQCLSA-N 2 0 242.407 2.219 20 0 BEADRP CCC(CC)(C[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1)OC ZINC000383993537 398055056 /nfs/dbraw/zinc/05/50/56/398055056.db2.gz NMHJWAJLKZOGPY-CHWSQXEVSA-N 2 0 242.407 2.264 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@H]2CSC[C@@H]2C)CC1 ZINC000304354304 398114976 /nfs/dbraw/zinc/11/49/76/398114976.db2.gz CWBQIOBMXGBZNN-AAEUAGOBSA-N 2 0 242.432 2.059 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@@H]2CSC[C@@H]2C)CC1 ZINC000304354306 398115065 /nfs/dbraw/zinc/11/50/65/398115065.db2.gz CWBQIOBMXGBZNN-WCQYABFASA-N 2 0 242.432 2.059 20 0 BEADRP CC[C@H]1C[N@H+](CC2(C)CCC2)CC[C@H]1[NH3+] ZINC000389693478 398125219 /nfs/dbraw/zinc/12/52/19/398125219.db2.gz IFOAPNIPAXYCBQ-NWDGAFQWSA-N 2 0 210.365 2.236 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+]C[C@H]2CCCS2)CC1(C)C ZINC000623445465 398130898 /nfs/dbraw/zinc/13/08/98/398130898.db2.gz RVFLHRSGGUGWMJ-VXGBXAGGSA-N 2 0 242.432 2.344 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1ccccc1 ZINC000258632727 322875669 /nfs/dbraw/zinc/87/56/69/322875669.db2.gz DBRYBGPBRLSUSX-STQMWFEESA-N 2 0 218.344 2.337 20 0 BEADRP C([C@@H]1C[C@H]2C[C@H]2C1)[N@@H+]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC000662275968 487529099 /nfs/dbraw/zinc/52/90/99/487529099.db2.gz GGDDWJIBHALNNH-XGUBFFRZSA-N 2 0 234.387 2.108 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000668782163 487529179 /nfs/dbraw/zinc/52/91/79/487529179.db2.gz AIDZUKLDTRDFCO-IUODEOHRSA-N 2 0 236.403 2.354 20 0 BEADRP C([C@@H]1C[C@H]2C[C@H]2C1)[N@@H+]1CCC[C@]2(CC[NH2+]C2)C1 ZINC000662275966 487529409 /nfs/dbraw/zinc/52/94/09/487529409.db2.gz GGDDWJIBHALNNH-LXTVHRRPSA-N 2 0 234.387 2.108 20 0 BEADRP Cc1ccc(C)c(C[NH2+]C[C@@H]2CCC[NH2+]C2)c1 ZINC000259009703 322880845 /nfs/dbraw/zinc/88/08/45/322880845.db2.gz MYDJLAMWWOFKLN-CQSZACIVSA-N 2 0 232.371 2.393 20 0 BEADRP Cc1ccc(C[NH2+]CC[C@@H]2CC[NH2+]C2)c(C)c1 ZINC000259160119 322882316 /nfs/dbraw/zinc/88/23/16/322882316.db2.gz YASYSMWSDWRNSX-AWEZNQCLSA-N 2 0 232.371 2.393 20 0 BEADRP Cc1cc(F)ccc1C[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000334843087 487569912 /nfs/dbraw/zinc/56/99/12/487569912.db2.gz BGMFTFAXTLQPJN-KGLIPLIRSA-N 2 0 236.334 2.494 20 0 BEADRP Cc1cc(F)ccc1C[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000334843086 487570316 /nfs/dbraw/zinc/57/03/16/487570316.db2.gz BGMFTFAXTLQPJN-KBPBESRZSA-N 2 0 236.334 2.494 20 0 BEADRP CC(C)OCCCC[NH2+][C@H]1CC[N@H+](C)C[C@@H]1C ZINC000341277149 167207498 /nfs/dbraw/zinc/20/74/98/167207498.db2.gz KFIIORXNPSJKSN-KBPBESRZSA-N 2 0 242.407 2.121 20 0 BEADRP CC(C)OC[C@H](C)[NH2+]CCC1CC[NH+](C)CC1 ZINC000337322897 167263610 /nfs/dbraw/zinc/26/36/10/167263610.db2.gz ADUXNFLFHYBNPW-ZDUSSCGKSA-N 2 0 242.407 2.121 20 0 BEADRP CC(C)SCC[N@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000336667912 167320379 /nfs/dbraw/zinc/32/03/79/167320379.db2.gz PRHKWWLWECCHJF-CYBMUJFWSA-N 2 0 244.448 2.402 20 0 BEADRP C[C@@H]([NH3+])C1CC[NH+](CC2CC=CC2)CC1 ZINC000662244755 409533619 /nfs/dbraw/zinc/53/36/19/409533619.db2.gz HAFAIGODNSODKO-LLVKDONJSA-N 2 0 208.349 2.012 20 0 BEADRP C[C@@H]1CCC[N@H+](C[C@@H]2C[C@H]3C[C@H]3C2)[C@H]1CC[NH3+] ZINC000662285839 409618944 /nfs/dbraw/zinc/61/89/44/409618944.db2.gz NPKQNJLDNOPVGV-QMIVOQANSA-N 2 0 236.403 2.482 20 0 BEADRP [NH3+]CC[C@@H]1CCC[N@H+](C[C@@H]2C[C@H]3C[C@H]3C2)C1 ZINC000662270975 409571750 /nfs/dbraw/zinc/57/17/50/409571750.db2.gz CYBCLAYQEHRRMO-FQUUOJAGSA-N 2 0 222.376 2.093 20 0 BEADRP C([C@@H]1CC[C@H]2C[C@H]2C1)[NH+]1CCC2(CC[NH2+]C2)CC1 ZINC000662273774 409582798 /nfs/dbraw/zinc/58/27/98/409582798.db2.gz OTCIOTPUUDHTCX-QLFBSQMISA-N 2 0 248.414 2.498 20 0 BEADRP C1=CCC(C[N@@H+]2CCC[C@]3(CC[NH2+]C3)C2)C1 ZINC000662277647 409593841 /nfs/dbraw/zinc/59/38/41/409593841.db2.gz RGKZAFRQGYXUSH-CQSZACIVSA-N 2 0 220.360 2.028 20 0 BEADRP [NH3+]CCC[N@@H+]1CCC[C@H](c2ccccc2)C1 ZINC000662285106 409614302 /nfs/dbraw/zinc/61/43/02/409614302.db2.gz WQVYCUYMPLETEB-AWEZNQCLSA-N 2 0 218.344 2.215 20 0 BEADRP C[C@@H]1C[C@H]([NH3+])CC[N@@H+]1CCCC1CCC1 ZINC000662284750 409615290 /nfs/dbraw/zinc/61/52/90/409615290.db2.gz PGFADEHBDLHCQR-DGCLKSJQSA-N 2 0 210.365 2.378 20 0 BEADRP C[N@H+](CC1CCCC1)[C@@H]1CCC[NH2+]CC1 ZINC000082666922 409848435 /nfs/dbraw/zinc/84/84/35/409848435.db2.gz VOOIBAXPYDGMOR-CYBMUJFWSA-N 2 0 210.365 2.251 20 0 BEADRP CC[C@@H]1C[N@H+](CCCCCF)CC[C@H]1[NH3+] ZINC000308916725 409936323 /nfs/dbraw/zinc/93/63/23/409936323.db2.gz INEBBGKPIJBPOK-VXGBXAGGSA-N 2 0 216.344 2.185 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@@H]2C[C@@H]21)C1CC[NH+](C)CC1 ZINC000396445410 487613889 /nfs/dbraw/zinc/61/38/89/487613889.db2.gz DKQLUYHHQOMBBZ-ATGSNQNLSA-N 2 0 236.403 2.495 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+][C@H]1CCO[C@@H](C(C)C)C1 ZINC000663498379 410275447 /nfs/dbraw/zinc/27/54/47/410275447.db2.gz BJLOIJJDMLCQQE-BFHYXJOUSA-N 2 0 242.407 2.153 20 0 BEADRP CC1([NH3+])CC[NH+](Cc2cccc3c2CCC3)CC1 ZINC000650703093 410332248 /nfs/dbraw/zinc/33/22/48/410332248.db2.gz KLKIMSZKCSSTRV-UHFFFAOYSA-N 2 0 244.382 2.489 20 0 BEADRP C[N@H+](Cc1cccc2c1CCC2)C1CC[NH2+]CC1 ZINC000650702810 410332302 /nfs/dbraw/zinc/33/23/02/410332302.db2.gz WGKGKDZBCIDZCS-UHFFFAOYSA-N 2 0 244.382 2.359 20 0 BEADRP C[C@@H](CC[NH3+])[NH2+]Cc1cccc2c1CCC2 ZINC000650703614 410332702 /nfs/dbraw/zinc/33/27/02/410332702.db2.gz IUHMLGGJWTVVDD-NSHDSACASA-N 2 0 218.344 2.002 20 0 BEADRP C[C@H](CC[NH3+])[NH2+]Cc1cccc2c1CCC2 ZINC000650703613 410333645 /nfs/dbraw/zinc/33/36/45/410333645.db2.gz IUHMLGGJWTVVDD-LLVKDONJSA-N 2 0 218.344 2.002 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]Cc2cccc3c2CCC3)CC[NH2+]1 ZINC000650703500 410333683 /nfs/dbraw/zinc/33/36/83/410333683.db2.gz CEIRMDPHZPCIQL-IUODEOHRSA-N 2 0 244.382 2.405 20 0 BEADRP C[C@H]1C[C@@H](C[NH3+])C[N@@H+]1Cc1cccc2c1CCC2 ZINC000650703187 410334657 /nfs/dbraw/zinc/33/46/57/410334657.db2.gz ORTMJTLUAYOFAR-STQMWFEESA-N 2 0 244.382 2.344 20 0 BEADRP C[C@@]1(c2cccc(F)c2)CC[N@H+](CCC[NH3+])C1 ZINC000650708787 410338945 /nfs/dbraw/zinc/33/89/45/410338945.db2.gz MIBCLTJSTVPQJG-CQSZACIVSA-N 2 0 236.334 2.138 20 0 BEADRP Cc1ccc(C[NH2+]CCC2(C[NH3+])CC2)cc1 ZINC000650712106 410341912 /nfs/dbraw/zinc/34/19/12/410341912.db2.gz QSFOMEIIFZPCSF-UHFFFAOYSA-N 2 0 218.344 2.214 20 0 BEADRP [NH3+]CC1(CC[NH2+]Cc2ccccc2F)CC1 ZINC000650712101 410342939 /nfs/dbraw/zinc/34/29/39/410342939.db2.gz QPAJGFLYVCKTED-UHFFFAOYSA-N 2 0 222.307 2.044 20 0 BEADRP Cc1ccc(C[NH2+]CCC2(C[NH3+])CC2)s1 ZINC000650711868 410343028 /nfs/dbraw/zinc/34/30/28/410343028.db2.gz GVFUHPBOPYVFRI-UHFFFAOYSA-N 2 0 224.373 2.275 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+]CCC1(C[NH3+])CC1 ZINC000650713057 410344870 /nfs/dbraw/zinc/34/48/70/410344870.db2.gz CNSZOJCUEQZDJR-NEPJUHHUSA-N 2 0 210.365 2.284 20 0 BEADRP CC(C)C[C@@H](C)C[NH2+]CCC1(C[NH3+])CC1 ZINC000650713889 410345122 /nfs/dbraw/zinc/34/51/22/410345122.db2.gz IGGUTRQHEQIFOK-GFCCVEGCSA-N 2 0 212.381 2.387 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+]CCC1(C[NH3+])CC1 ZINC000650714267 410347581 /nfs/dbraw/zinc/34/75/81/410347581.db2.gz XUGWNCYZPWNCQV-SECBINFHSA-N 2 0 238.297 2.436 20 0 BEADRP C[C@@H](C[NH2+]CCC1(C[NH3+])CC1)C(C)(C)C ZINC000650714217 410348756 /nfs/dbraw/zinc/34/87/56/410348756.db2.gz WFRNSXOMTWLSQD-NSHDSACASA-N 2 0 212.381 2.387 20 0 BEADRP COc1cc(C[NH2+]CCC2(C[NH3+])CC2)ccc1C ZINC000650714233 410348785 /nfs/dbraw/zinc/34/87/85/410348785.db2.gz WODAZKIVDMVJND-UHFFFAOYSA-N 2 0 248.370 2.222 20 0 BEADRP CC[C@@H]([NH2+]CCC1CC[NH2+]CC1)C1CC1 ZINC000650763549 410415112 /nfs/dbraw/zinc/41/51/12/410415112.db2.gz DFRZWMLNQMLOJO-CYBMUJFWSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H]([NH2+]CCC1CC[NH2+]CC1)c1ccoc1 ZINC000650763508 410415213 /nfs/dbraw/zinc/41/52/13/410415213.db2.gz CEIIGDBVISTJOJ-NSHDSACASA-N 2 0 222.332 2.320 20 0 BEADRP C[NH2+]Cc1ccccc1C[NH2+]C[C@H]1C[C@H]1C ZINC000650720308 410357601 /nfs/dbraw/zinc/35/76/01/410357601.db2.gz LEPLBIUSAKMETE-BXUZGUMPSA-N 2 0 218.344 2.152 20 0 BEADRP C[NH2+]Cc1ccccc1C[NH2+]C[C@H]1C[C@@H]1C ZINC000650720311 410357766 /nfs/dbraw/zinc/35/77/66/410357766.db2.gz LEPLBIUSAKMETE-SMDDNHRTSA-N 2 0 218.344 2.152 20 0 BEADRP CC(C)C[N@@H+]1CCCC[C@@H]1[C@@H]1C[C@H]([NH3+])CCO1 ZINC000650724048 410360034 /nfs/dbraw/zinc/36/00/34/410360034.db2.gz XNCZEOTWMJVPCQ-MCIONIFRSA-N 2 0 240.391 2.003 20 0 BEADRP C[C@@H]1C[C@@H](C[N@@H+]2CC[C@@]3(CC3(F)F)C2)CC[NH2+]1 ZINC000650725378 410360149 /nfs/dbraw/zinc/36/01/49/410360149.db2.gz ZJNLOTMJFQCMPU-GRYCIOLGSA-N 2 0 244.329 2.106 20 0 BEADRP C[C@H]1C[N@H+](CCC[NH3+])CCc2ccc(F)cc21 ZINC000650725136 410360822 /nfs/dbraw/zinc/36/08/22/410360822.db2.gz UFJVQLMOOKFDRX-NSHDSACASA-N 2 0 236.334 2.136 20 0 BEADRP C[C@H]([NH2+]CCC1(C[NH3+])CC1)c1cncc(F)c1 ZINC000650744105 410380278 /nfs/dbraw/zinc/38/02/78/410380278.db2.gz GIPBURKFGJILSZ-JTQLQIEISA-N 2 0 237.322 2.000 20 0 BEADRP C[C@@H]([NH2+]CCC1(C[NH3+])CC1)[C@@H]1CC1(C)C ZINC000650747091 410384226 /nfs/dbraw/zinc/38/42/26/410384226.db2.gz RIVUZJKZRLYNLB-MNOVXSKESA-N 2 0 210.365 2.140 20 0 BEADRP Cc1nc([C@@H](C)[NH2+]CCC2(C[NH3+])CC2)cs1 ZINC000650748119 410388245 /nfs/dbraw/zinc/38/82/45/410388245.db2.gz NJFLWEQPWZUULW-SECBINFHSA-N 2 0 239.388 2.231 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(C[NH3+])cc2F)[C@H]1C ZINC000650755591 410403187 /nfs/dbraw/zinc/40/31/87/410403187.db2.gz IJUDNPHNKKEECP-ISTVAULSSA-N 2 0 236.334 2.419 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)C(C)(C)C ZINC000650760429 410407749 /nfs/dbraw/zinc/40/77/49/410407749.db2.gz CVGDWUYQCLWXQT-FVCCEPFGSA-N 2 0 224.392 2.399 20 0 BEADRP CC(C)[C@@H]([NH2+]CCC1CC[NH2+]CC1)C1CC1 ZINC000650764439 410414185 /nfs/dbraw/zinc/41/41/85/410414185.db2.gz YSAFLINLKOPILK-CQSZACIVSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H](CCNc1[nH+]ccc2[nH]ccc21)[NH+](C)C ZINC000664243350 410529508 /nfs/dbraw/zinc/52/95/08/410529508.db2.gz DXQVRDXBDAGKKO-JTQLQIEISA-N 2 0 232.331 2.315 20 0 BEADRP CCC[C@@H](C[NH2+][C@@H](C)C1CC[NH+](C)CC1)OC ZINC000393534670 410746559 /nfs/dbraw/zinc/74/65/59/410746559.db2.gz ZTKXEPJIFKLVAQ-JSGCOSHPSA-N 2 0 242.407 2.121 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]CCCC2CCC2)C1 ZINC000665266705 410738946 /nfs/dbraw/zinc/73/89/46/410738946.db2.gz HYZIAWDGAPAJDF-OLZOCXBDSA-N 2 0 210.365 2.426 20 0 BEADRP CCC[C@H](C[NH2+][C@H](C)C1CC[NH+](C)CC1)OC ZINC000393534673 410745245 /nfs/dbraw/zinc/74/52/45/410745245.db2.gz ZTKXEPJIFKLVAQ-TZMCWYRMSA-N 2 0 242.407 2.121 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+]CC[C@@H]([NH3+])C(C)C ZINC000665281331 410758652 /nfs/dbraw/zinc/75/86/52/410758652.db2.gz ZSRCXCRUPXNQFQ-GXTWGEPZSA-N 2 0 235.375 2.414 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]CCCc2ccco2)C1 ZINC000665283613 410765099 /nfs/dbraw/zinc/76/50/99/410765099.db2.gz QTASPWLDAXWSLE-RYUDHWBXSA-N 2 0 222.332 2.072 20 0 BEADRP C[NH2+]C[C@H](C)N[C@H]1CCCOc2cc(C)ccc21 ZINC000665296151 410805740 /nfs/dbraw/zinc/80/57/40/410805740.db2.gz NNQJHJSHGKZRGS-JSGCOSHPSA-N 2 0 248.370 2.406 20 0 BEADRP CC(C)[NH2+]C1CC[NH+](C[C@H]2C[C@H]2C)CC1 ZINC000336769578 167093974 /nfs/dbraw/zinc/09/39/74/167093974.db2.gz VTUGTKBJSZYKBO-VXGBXAGGSA-N 2 0 210.365 2.105 20 0 BEADRP CC(C)[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C ZINC000125571186 167131829 /nfs/dbraw/zinc/13/18/29/167131829.db2.gz JAMXLLJVCLKZBU-NSHDSACASA-N 2 0 200.370 2.351 20 0 BEADRP CC(C)OCCC[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@H]1C ZINC000036908372 167223003 /nfs/dbraw/zinc/22/30/03/167223003.db2.gz IZZXJKQGTQMQAL-MGPQQGTHSA-N 2 0 242.407 2.120 20 0 BEADRP CC(C)OC[C@@H](C)[NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000337348554 167258126 /nfs/dbraw/zinc/25/81/26/167258126.db2.gz ZBPDHKAFFLOSDY-HZSPNIEDSA-N 2 0 242.407 2.262 20 0 BEADRP CC(C)Oc1cccc(C[N@@H+]2CC[C@H](C[NH3+])C2)c1 ZINC000050245506 167306549 /nfs/dbraw/zinc/30/65/49/167306549.db2.gz IQNVEIYWDYYUNX-CQSZACIVSA-N 2 0 248.370 2.254 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@@H]([NH3+])C1)[C@@H]1CC1(C)C ZINC000397837527 410937116 /nfs/dbraw/zinc/93/71/16/410937116.db2.gz SZYOVEOKBZXBAW-QCNOEVLYSA-N 2 0 210.365 2.281 20 0 BEADRP CC(C)[C@@H](C)[NH2+]CCN(C)C1CCCC1 ZINC000053377039 167380170 /nfs/dbraw/zinc/38/01/70/167380170.db2.gz HFISOKPUWWRNOW-GFCCVEGCSA-N 2 0 212.381 2.495 20 0 BEADRP CC(C)[C@@H](C)[NH2+]CCC1CC[NH+](C)CC1 ZINC000122136449 167380663 /nfs/dbraw/zinc/38/06/63/167380663.db2.gz ARFXKSGUIYKGPJ-GFCCVEGCSA-N 2 0 212.381 2.352 20 0 BEADRP CC(C)[C@@H](C)[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000336652104 167381151 /nfs/dbraw/zinc/38/11/51/167381151.db2.gz FLBGEPHZCYVJOJ-GFCCVEGCSA-N 2 0 224.392 2.495 20 0 BEADRP CC[C@@](C)(C[NH2+]C1CCC([NH+](C)C)CC1)OC ZINC000651420230 411001594 /nfs/dbraw/zinc/00/15/94/411001594.db2.gz PQKVZDURNSNZII-RUXDESIVSA-N 2 0 242.407 2.264 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1C[C@H]1C1CC1)C1CC[NH+](C)CC1 ZINC000651475348 411057858 /nfs/dbraw/zinc/05/78/58/411057858.db2.gz OPNTXBNMVCRLHL-UGFHNGPFSA-N 2 0 236.403 2.352 20 0 BEADRP COC[C@@H](CC(C)(C)C)[NH2+]CCCC[NH+](C)C ZINC000651691850 411136847 /nfs/dbraw/zinc/13/68/47/411136847.db2.gz JISPWUPPEUTMHJ-CYBMUJFWSA-N 2 0 244.423 2.369 20 0 BEADRP CC(C)[C@H]1CCCC[N@@H+]1C[C@@H]1CC[NH2+]C1 ZINC000108324134 411144329 /nfs/dbraw/zinc/14/43/29/411144329.db2.gz NYNXRHISTOGBHF-CHWSQXEVSA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)C[N@H+](C)CCC[NH2+][C@H]1CCCOCC1 ZINC000651865661 411148049 /nfs/dbraw/zinc/14/80/49/411148049.db2.gz CPJMPUGYXHSJBW-AWEZNQCLSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)(CCN1CC[C@H]2CC[NH2+][C@H]2C1)C1CC1 ZINC000655940719 411160551 /nfs/dbraw/zinc/16/05/51/411160551.db2.gz GBKDZEPKCPAAMN-OCCSQVGLSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H]1CCCCC[C@H]1[NH2+]CCOCC[NH+](C)C ZINC000652193086 411168807 /nfs/dbraw/zinc/16/88/07/411168807.db2.gz VLYIQPVSULRGMD-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP COC[C@@H](CC(C)(C)C)[NH2+]C[C@H](C)C[NH+](C)C ZINC000652201031 411170653 /nfs/dbraw/zinc/17/06/53/411170653.db2.gz RFWRLBNXXAWREZ-QWHCGFSZSA-N 2 0 244.423 2.225 20 0 BEADRP CC(F)(F)CC[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000401027206 411173490 /nfs/dbraw/zinc/17/34/90/411173490.db2.gz NZVAWLCIOGCTGE-HBNTYKKESA-N 2 0 232.318 2.009 20 0 BEADRP CC(F)(F)CC[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000401027204 411173642 /nfs/dbraw/zinc/17/36/42/411173642.db2.gz NZVAWLCIOGCTGE-GARJFASQSA-N 2 0 232.318 2.009 20 0 BEADRP Fc1ccc(C[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)cc1 ZINC000401074683 411176295 /nfs/dbraw/zinc/17/62/95/411176295.db2.gz OJLPJDXPFBCHFK-KCQAQPDRSA-N 2 0 248.345 2.303 20 0 BEADRP C1=CC[C@H](C[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)CC1 ZINC000401124612 411178156 /nfs/dbraw/zinc/17/81/56/411178156.db2.gz KYPRISRERXNETL-GBJTYRQASA-N 2 0 234.387 2.320 20 0 BEADRP CCC(CC)C[N@@H+]1CC[C@@H]2CC[NH2+][C@H]2C1 ZINC000309996335 411194041 /nfs/dbraw/zinc/19/40/41/411194041.db2.gz CFFQNSQPOZXMIB-STQMWFEESA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCC[C@H]([NH3+])C1)c1ccncc1 ZINC000656197194 411202034 /nfs/dbraw/zinc/20/20/34/411202034.db2.gz MSSTVDNJGTXELP-KWCYVHTRSA-N 2 0 233.359 2.045 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCC[C@@H]([NH3+])C1)c1ccncc1 ZINC000656197193 411202131 /nfs/dbraw/zinc/20/21/31/411202131.db2.gz MSSTVDNJGTXELP-BNOWGMLFSA-N 2 0 233.359 2.045 20 0 BEADRP COC[C@H](CC(C)(C)C)[NH2+][C@H](C)C[C@@H](C)[NH3+] ZINC000656200935 411206436 /nfs/dbraw/zinc/20/64/36/411206436.db2.gz GKAGVWFMSIVVSP-UTUOFQBUSA-N 2 0 230.396 2.153 20 0 BEADRP COC[C@H](CC(C)(C)C)[NH2+][C@@H](C)C[C@@H](C)[NH3+] ZINC000656200937 411206692 /nfs/dbraw/zinc/20/66/92/411206692.db2.gz GKAGVWFMSIVVSP-WOPDTQHZSA-N 2 0 230.396 2.153 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCC[C@@H]1CCC(C)C ZINC000652343453 411208127 /nfs/dbraw/zinc/20/81/27/411208127.db2.gz CAILQHPOIBSEGB-CYBMUJFWSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+]CC(C)(C)C[NH+](C)C)CS1 ZINC000655679747 411222769 /nfs/dbraw/zinc/22/27/69/411222769.db2.gz GBPJESPLUFOKGL-NWDGAFQWSA-N 2 0 244.448 2.448 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1)c1ccccn1 ZINC000658064214 411229655 /nfs/dbraw/zinc/22/96/55/411229655.db2.gz MLMRGAKYBRSXMV-MCIONIFRSA-N 2 0 247.386 2.257 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1)c1ccccn1 ZINC000658064216 411229748 /nfs/dbraw/zinc/22/97/48/411229748.db2.gz MLMRGAKYBRSXMV-RDBSUJKOSA-N 2 0 247.386 2.257 20 0 BEADRP Cc1noc(C)c1[C@H](C)[NH2+][C@H](C)CCCC[NH3+] ZINC000310262097 411231689 /nfs/dbraw/zinc/23/16/89/411231689.db2.gz MBBFHFCYCIFFBL-ZJUUUORDSA-N 2 0 239.363 2.460 20 0 BEADRP COCCCCC[NH2+][C@@H]1CCCCC[C@H]1[NH3+] ZINC000422826943 411232855 /nfs/dbraw/zinc/23/28/55/411232855.db2.gz RPQNDQFHNJTEBA-CHWSQXEVSA-N 2 0 228.380 2.053 20 0 BEADRP Cc1nc([C@H](C)[NH2+][C@@H](C)CCC[NH3+])cs1 ZINC000422883430 411233843 /nfs/dbraw/zinc/23/38/43/411233843.db2.gz BZNHQZSFVBYZER-IUCAKERBSA-N 2 0 227.377 2.230 20 0 BEADRP CCCC(O)(CCC)C[NH2+][C@@H](C)C[C@@H](C)[NH3+] ZINC000422976184 411234427 /nfs/dbraw/zinc/23/44/27/411234427.db2.gz HZQNJSFXLHQVEV-NEPJUHHUSA-N 2 0 230.396 2.033 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)Cc1ccc(O)cc1)[C@H]1CCC[NH2+]1 ZINC000422976105 411234645 /nfs/dbraw/zinc/23/46/45/411234645.db2.gz UQISMFQKNZFOSB-YWPYICTPSA-N 2 0 248.370 2.053 20 0 BEADRP CCCC(O)(CCC)C[NH2+][C@H](C)CCC[NH3+] ZINC000422976468 411236728 /nfs/dbraw/zinc/23/67/28/411236728.db2.gz IHPFQMSPEDFMJV-GFCCVEGCSA-N 2 0 230.396 2.035 20 0 BEADRP CC1(C)[C@H]([NH2+]CC2C[NH2+]C2)C[C@H]1c1ccccc1 ZINC000423306713 411238240 /nfs/dbraw/zinc/23/82/40/411238240.db2.gz UGPXSHLPFQSSGY-LSDHHAIUSA-N 2 0 244.382 2.378 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H]1CCC[C@H](c2cccnc2)C1 ZINC000423307132 411238671 /nfs/dbraw/zinc/23/86/71/411238671.db2.gz MMZLZRVGLLBHLI-VNHYZAJKSA-N 2 0 247.386 2.292 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H]2CC[C@H](C)SC2)C1 ZINC000655693955 411240026 /nfs/dbraw/zinc/24/00/26/411240026.db2.gz BIQKVFOAOLXVQU-XQQFMLRXSA-N 2 0 242.432 2.202 20 0 BEADRP CCCCC[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000400907622 411165599 /nfs/dbraw/zinc/16/55/99/411165599.db2.gz CFGKZSGEZMFKOU-YNEHKIRRSA-N 2 0 210.365 2.154 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)cc1 ZINC000400960635 411167266 /nfs/dbraw/zinc/16/72/66/411167266.db2.gz BMVQQTDJGRJFPO-OWCLPIDISA-N 2 0 244.382 2.473 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C[C@@H]2CCC[N@H+](C)C2)CS1 ZINC000655712163 411266633 /nfs/dbraw/zinc/26/66/33/411266633.db2.gz RHUFVXBGZRFKBJ-FRRDWIJNSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CC2CC[NH+](C)CC2)CS1 ZINC000655716965 411273178 /nfs/dbraw/zinc/27/31/78/411273178.db2.gz QWUYCMVICAQYMI-YPMHNXCESA-N 2 0 242.432 2.202 20 0 BEADRP CCO[C@H]1C[C@H]([NH2+]C2CC[NH+](C(C)C)CC2)C1 ZINC000658161065 411273775 /nfs/dbraw/zinc/27/37/75/411273775.db2.gz IXBYNWRVFXZZAA-HDJSIYSDSA-N 2 0 240.391 2.016 20 0 BEADRP c1cnc2c(c1)CCC[C@@H]2[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000643509387 411279753 /nfs/dbraw/zinc/27/97/53/411279753.db2.gz KWVIBUFGROXQAQ-JSGCOSHPSA-N 2 0 245.370 2.048 20 0 BEADRP CC[NH+]1CCC([NH2+]CCCOC(C)(C)C)CC1 ZINC000658185753 411284326 /nfs/dbraw/zinc/28/43/26/411284326.db2.gz PJGFVRLJFJMAOV-UHFFFAOYSA-N 2 0 242.407 2.266 20 0 BEADRP c1ccc([C@@H]2CC[N@@H+](C[C@@H]3CC[NH2+]C3)C2)cc1 ZINC000051890178 411284478 /nfs/dbraw/zinc/28/44/78/411284478.db2.gz GVPORTGQBXZZQJ-UKRRQHHQSA-N 2 0 230.355 2.085 20 0 BEADRP CCC1CCC([N@H+](C)C[C@@H]2CC[NH2+]C2)CC1 ZINC000051889681 411284764 /nfs/dbraw/zinc/28/47/64/411284764.db2.gz OKSCAFOTVJMFSJ-ROKHWSDSSA-N 2 0 224.392 2.497 20 0 BEADRP CC[NH+]1CCC([NH2+]CCC(C)(C)F)CC1 ZINC000658193002 411288239 /nfs/dbraw/zinc/28/82/39/411288239.db2.gz QZIFIYFPVBTFOE-UHFFFAOYSA-N 2 0 216.344 2.199 20 0 BEADRP Cc1[nH+]ccc(N[C@H]2CCC[C@H]([NH3+])C2)c1Cl ZINC000382452467 411290578 /nfs/dbraw/zinc/29/05/78/411290578.db2.gz NYZCYJUFSMXAEV-UWVGGRQHSA-N 2 0 239.750 2.147 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CCc2ccoc2)[C@@H](C)C1 ZINC000658202193 411290830 /nfs/dbraw/zinc/29/08/30/411290830.db2.gz VGODWZBLQMKEJB-GXTWGEPZSA-N 2 0 236.359 2.142 20 0 BEADRP CC1(C)CC[C@@H]([NH2+]C[C@H]2CCC[NH2+]C2)C1 ZINC000128571510 167930373 /nfs/dbraw/zinc/93/03/73/167930373.db2.gz HZQXYCXIUNJGBC-NWDGAFQWSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CCCC[NH+](C)C)CS1 ZINC000655703022 411253326 /nfs/dbraw/zinc/25/33/26/411253326.db2.gz IWNWOEKZWLNYHK-VXGBXAGGSA-N 2 0 230.421 2.202 20 0 BEADRP CC[NH+]1CCC([NH2+]CCc2cnccc2C)CC1 ZINC000658127315 411254059 /nfs/dbraw/zinc/25/40/59/411254059.db2.gz VKEXVTXPBUWKHO-UHFFFAOYSA-N 2 0 247.386 2.006 20 0 BEADRP Cc1ccncc1CC[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000658127169 411254102 /nfs/dbraw/zinc/25/41/02/411254102.db2.gz SEFHSWLNTFSASC-UKRRQHHQSA-N 2 0 247.386 2.005 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]Cc2cccc(N)c2)[C@@H](C)C1 ZINC000656785305 411359853 /nfs/dbraw/zinc/35/98/53/411359853.db2.gz NCSWBHUFVCBKCT-SWLSCSKDSA-N 2 0 247.386 2.089 20 0 BEADRP C[C@@H](C[NH2+]C1CCC([NH3+])CC1)c1ccccn1 ZINC000656783048 411360537 /nfs/dbraw/zinc/36/05/37/411360537.db2.gz MTUPHMTXHOWGJB-HIFPTAJRSA-N 2 0 233.359 2.045 20 0 BEADRP C(C1CC1)[N@@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000656784730 411361647 /nfs/dbraw/zinc/36/16/47/411361647.db2.gz GNDWHVUYALPZFZ-AWEZNQCLSA-N 2 0 222.376 2.108 20 0 BEADRP C(C1CC1)[NH+]1CCC([C@H]2CCC[NH2+]C2)CC1 ZINC000656785900 411364359 /nfs/dbraw/zinc/36/43/59/411364359.db2.gz MZCAOADUHREXTF-AWEZNQCLSA-N 2 0 222.376 2.108 20 0 BEADRP C[C@@H](CC1CCOCC1)[NH2+]CC1([NH3+])CCCC1 ZINC000656788713 411368044 /nfs/dbraw/zinc/36/80/44/411368044.db2.gz BOPNWZQYMBTBNS-LBPRGKRZSA-N 2 0 240.391 2.053 20 0 BEADRP CC1(C)CCC[C@H]1[NH2+]CC1([NH3+])CCCC1 ZINC000656789727 411370512 /nfs/dbraw/zinc/37/05/12/411370512.db2.gz WLQVWANYFYLCLI-LLVKDONJSA-N 2 0 210.365 2.426 20 0 BEADRP CC1(C[NH2+]Cc2ccccc2)CC[NH2+]CC1 ZINC000062841761 168044504 /nfs/dbraw/zinc/04/45/04/168044504.db2.gz RQNMRSATAWAHBG-UHFFFAOYSA-N 2 0 218.344 2.166 20 0 BEADRP CC1=CC[C@@H]([NH2+]CC2CC[NH+](C)CC2)CC1 ZINC000335600545 168117286 /nfs/dbraw/zinc/11/72/86/168117286.db2.gz NKWWAGJZGPXWGI-CQSZACIVSA-N 2 0 222.376 2.417 20 0 BEADRP CC1=C[C@H](C)C[C@H](C[NH+]2C[C@@H]3C[NH+](C)C[C@H]3C2)C1 ZINC000356392095 168130940 /nfs/dbraw/zinc/13/09/40/168130940.db2.gz JRXNXWFSZXHSLI-TUUVXOQKSA-N 2 0 248.414 2.472 20 0 BEADRP CC1CC([NH2+]CCN2CCCC(C)(C)C2)C1 ZINC000309744100 168145051 /nfs/dbraw/zinc/14/50/51/168145051.db2.gz FBAKSEIDKPONOM-UHFFFAOYSA-N 2 0 224.392 2.497 20 0 BEADRP CC1CCC(C[N@@H+]2CC[C@@H]([NH3+])[C@@H](C)C2)CC1 ZINC000221097714 168153879 /nfs/dbraw/zinc/15/38/79/168153879.db2.gz MKTSOJLVKAKZHW-GNRIBBGQSA-N 2 0 224.392 2.482 20 0 BEADRP CC1CCC([N@H+](C)C[C@H]2CCC[NH2+]C2)CC1 ZINC000042488230 168159981 /nfs/dbraw/zinc/15/99/81/168159981.db2.gz ZWLVDNURTGPVTO-MOKVOYLWSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1C[C@H]1C[NH2+]CCC[NH+]1CCC(C)CC1 ZINC000336777964 168178735 /nfs/dbraw/zinc/17/87/35/168178735.db2.gz JZVDVVXEVOOXNL-KBPBESRZSA-N 2 0 224.392 2.354 20 0 BEADRP CC1CC[NH+](CCC[NH2+]Cc2ccn(C)c2)CC1 ZINC000091007313 168178920 /nfs/dbraw/zinc/17/89/20/168178920.db2.gz UHOICEUSYBYKFG-UHFFFAOYSA-N 2 0 249.402 2.237 20 0 BEADRP CC1CC[NH+](CCC[NH2+]CC2CC2)CC1 ZINC000036882469 168179086 /nfs/dbraw/zinc/17/90/86/168179086.db2.gz NOKLHXVKTLDXKQ-UHFFFAOYSA-N 2 0 210.365 2.108 20 0 BEADRP CC(C)CC[N@@H+]1CCC[C@H](C)[C@@H]1CC[NH3+] ZINC000404321813 411391061 /nfs/dbraw/zinc/39/10/61/411391061.db2.gz RFYCWGKIGNNWMX-STQMWFEESA-N 2 0 212.381 2.482 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCC[C@H](C)[C@@H]1CC[NH3+] ZINC000404324969 411391073 /nfs/dbraw/zinc/39/10/73/411391073.db2.gz UFVNWHBLXICAMD-AVGNSLFASA-N 2 0 212.381 2.482 20 0 BEADRP CC[C@@H]1C[C@@H]([NH2+]CCC[NH+](CC)CC)CCO1 ZINC000070344708 411391816 /nfs/dbraw/zinc/39/18/16/411391816.db2.gz DJJDPTRXGMARQR-UONOGXRCSA-N 2 0 242.407 2.266 20 0 BEADRP CCC(C)(C)[NH2+][C@@H](C)C(=O)Nc1ccnc(C)c1 ZINC000274683854 168300844 /nfs/dbraw/zinc/30/08/44/168300844.db2.gz NNZWBYGRSSXBFP-NSHDSACASA-N 2 0 249.358 2.495 20 0 BEADRP C[C@H]1CCC[N@H+](Cc2cccnc2)[C@@H]1CC[NH3+] ZINC000404379081 411392914 /nfs/dbraw/zinc/39/29/14/411392914.db2.gz LOKHHMAWBSLIDR-GXTWGEPZSA-N 2 0 233.359 2.031 20 0 BEADRP Cc1ccc(C[N@H+]2CCC[C@H](C)[C@H]2CC[NH3+])cn1 ZINC000404431447 411396722 /nfs/dbraw/zinc/39/67/22/411396722.db2.gz OTYRJTZEUWDYRR-SWLSCSKDSA-N 2 0 247.386 2.339 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCc2ccccc2[C@@H](C)C1 ZINC000405004784 411413629 /nfs/dbraw/zinc/41/36/29/411413629.db2.gz JADAFVCSOCOAHA-ZDUSSCGKSA-N 2 0 232.371 2.258 20 0 BEADRP C[N@@H+]1CCC[C@H](CC[NH2+]Cc2ccc(O)cc2)C1 ZINC000657182749 411416610 /nfs/dbraw/zinc/41/66/10/411416610.db2.gz NLEKJDUFOUPLPR-CQSZACIVSA-N 2 0 248.370 2.214 20 0 BEADRP C[N@@H+]1CCC[C@@H](CC[NH2+]Cc2ccc(O)cc2)C1 ZINC000657182746 411417284 /nfs/dbraw/zinc/41/72/84/411417284.db2.gz NLEKJDUFOUPLPR-AWEZNQCLSA-N 2 0 248.370 2.214 20 0 BEADRP CC[C@H]1C[N@H+](Cc2ccccc2OC)CC[C@@H]1[NH3+] ZINC000122273833 411426707 /nfs/dbraw/zinc/42/67/07/411426707.db2.gz YQFJSYOITMWXLP-JSGCOSHPSA-N 2 0 248.370 2.254 20 0 BEADRP CCC(CC)C[N@@H+]1CC[C@H]([NH3+])[C@H](CC)C1 ZINC000122325575 411426804 /nfs/dbraw/zinc/42/68/04/411426804.db2.gz FJKAHHHSIBICOW-OLZOCXBDSA-N 2 0 212.381 2.482 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+]CC2=CC[N@H+](C)CC2)CS1 ZINC000655738196 411444496 /nfs/dbraw/zinc/44/44/96/411444496.db2.gz JJDJDSLKKHHUNQ-WCQYABFASA-N 2 0 240.416 2.122 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CC2=CC[N@H+](C)CC2)CS1 ZINC000655738197 411445010 /nfs/dbraw/zinc/44/50/10/411445010.db2.gz JJDJDSLKKHHUNQ-YPMHNXCESA-N 2 0 240.416 2.122 20 0 BEADRP CC[C@H]1C[C@@H]([NH2+]CCC[NH+]2CCCCC2)CO1 ZINC000657296466 411454767 /nfs/dbraw/zinc/45/47/67/411454767.db2.gz VCQAYWBDWOLURM-KGLIPLIRSA-N 2 0 240.391 2.020 20 0 BEADRP C[NH+](C)C1CC[NH+](C[C@@H]2C[C@H]3C[C@H]3C2)CC1 ZINC000659837615 411471352 /nfs/dbraw/zinc/47/13/52/411471352.db2.gz GSEMOPGKDUVUIM-CLLJXQQHSA-N 2 0 222.376 2.059 20 0 BEADRP Cc1ccc(C[NH2+][C@H](C)C2CC[NH+](C)CC2)o1 ZINC000053036258 411475391 /nfs/dbraw/zinc/47/53/91/411475391.db2.gz CDYWPRCXZSWZLK-GFCCVEGCSA-N 2 0 236.359 2.408 20 0 BEADRP CCC[C@@H](C)[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000415003711 411482304 /nfs/dbraw/zinc/48/23/04/411482304.db2.gz GMAHPEBNTPCZQB-KGYLQXTDSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@@H]1OCC[C@H]1[NH2+]CC[C@H]1CCCC[N@@H+]1C ZINC000657369580 411483639 /nfs/dbraw/zinc/48/36/39/411483639.db2.gz FASFIZPQJIBVCX-MCIONIFRSA-N 2 0 240.391 2.018 20 0 BEADRP C[NH+](C)[C@@H]1CCC[N@H+](CC2CC=CC2)CC1 ZINC000660415811 411488901 /nfs/dbraw/zinc/48/89/01/411488901.db2.gz JAJZPIPNMCZNNW-CQSZACIVSA-N 2 0 222.376 2.369 20 0 BEADRP CC[NH+]1CCC(CC[NH2+]C[C@@H]2C[C@@H]2C)CC1 ZINC000309957765 169951429 /nfs/dbraw/zinc/95/14/29/169951429.db2.gz JIWYGLFVBBGCCR-JSGCOSHPSA-N 2 0 224.392 2.354 20 0 BEADRP C[NH+](C)C[C@@H]1CC[N@H+](CCC2CCC2)C1 ZINC000659926164 411500594 /nfs/dbraw/zinc/50/05/94/411500594.db2.gz MFANXSIZSWMNBU-ZDUSSCGKSA-N 2 0 210.365 2.060 20 0 BEADRP C1=CCC(C[N@H+]2CC[C@H](C[NH+]3CCCC3)C2)C1 ZINC000659949049 411508328 /nfs/dbraw/zinc/50/83/28/411508328.db2.gz UGAOXFNKWQNQFY-OAHLLOKOSA-N 2 0 234.387 2.370 20 0 BEADRP CC[C@@H]1C[C@H]([NH2+]C2CCC([NH+](C)C)CC2)CO1 ZINC000657493463 411534789 /nfs/dbraw/zinc/53/47/89/411534789.db2.gz DIRPNJUYQCOAOH-GNRIBBGQSA-N 2 0 240.391 2.016 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H]2CC[C@@H]2C2CCC2)C1 ZINC000655804431 411519120 /nfs/dbraw/zinc/51/91/20/411519120.db2.gz YNUXHNCBTRZEDL-FAAHXZRKSA-N 2 0 236.403 2.495 20 0 BEADRP CC[C@H]1CCC[C@H]1[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655805416 411519123 /nfs/dbraw/zinc/51/91/23/411519123.db2.gz NLPWLSHHLDTFQR-IGQOVBAYSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)[C@H]1CC1(C)C ZINC000655803938 411519237 /nfs/dbraw/zinc/51/92/37/411519237.db2.gz IWWIINXNMQPXGK-FVCCEPFGSA-N 2 0 224.392 2.351 20 0 BEADRP C[C@@H](CCC1CC1)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655804427 411519653 /nfs/dbraw/zinc/51/96/53/411519653.db2.gz YLPRHKXNZFKFCW-FPMFFAJLSA-N 2 0 224.392 2.495 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655804109 411519851 /nfs/dbraw/zinc/51/98/51/411519851.db2.gz PTIKRTWWBGKMFP-NDBYEHHHSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)C1 ZINC000655805874 411520563 /nfs/dbraw/zinc/52/05/63/411520563.db2.gz MRQDEJNWCYPTPE-NDBYEHHHSA-N 2 0 210.365 2.105 20 0 BEADRP Cc1ccsc1C[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655825519 411527277 /nfs/dbraw/zinc/52/72/77/411527277.db2.gz GEMMZUIQCXGLGL-TXEJJXNPSA-N 2 0 238.400 2.486 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]Cc2cccs2)C1 ZINC000655825686 411527324 /nfs/dbraw/zinc/52/73/24/411527324.db2.gz MEHKFDYGHCJARF-PHIMTYICSA-N 2 0 224.373 2.178 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]C[C@@H]2CC=CCC2)C1 ZINC000655825329 411527348 /nfs/dbraw/zinc/52/73/48/411527348.db2.gz DTRSHUBMWGASFQ-MCIONIFRSA-N 2 0 222.376 2.273 20 0 BEADRP Cc1ccccc1C[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655825235 411527531 /nfs/dbraw/zinc/52/75/31/411527531.db2.gz AAVSHFCFSQWSSS-OTVXOJSOSA-N 2 0 232.371 2.425 20 0 BEADRP CC[C@H]1C[C@H]([NH2+]CCCC[N@H+](C)C2CC2)CO1 ZINC000657486954 411531241 /nfs/dbraw/zinc/53/12/41/411531241.db2.gz CZBANEWYWZJAPV-JSGCOSHPSA-N 2 0 240.391 2.018 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cnccc2C)C1 ZINC000271373839 170007405 /nfs/dbraw/zinc/00/74/05/170007405.db2.gz HKLJGFMTGFBFFR-KBPBESRZSA-N 2 0 247.386 2.382 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(F)cc2)C1 ZINC000037643740 170007474 /nfs/dbraw/zinc/00/74/74/170007474.db2.gz UTQAFDPODBZMTB-ZDUSSCGKSA-N 2 0 236.334 2.257 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+]C[C@H]2CC=CCC2)C1 ZINC000037484275 170007538 /nfs/dbraw/zinc/00/75/38/170007538.db2.gz MHZUPRZVHCWLDL-KBPBESRZSA-N 2 0 222.376 2.274 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+]C2Cc3ccccc3C2)C1 ZINC000037644340 170007979 /nfs/dbraw/zinc/00/79/79/170007979.db2.gz GEFJXUDRFAQSQY-ZDUSSCGKSA-N 2 0 244.382 2.085 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CC2(C(F)F)CC2)[C@H](C)C1 ZINC000355146719 170010976 /nfs/dbraw/zinc/01/09/76/170010976.db2.gz GTBURPPNQUIYEM-GHMZBOCLSA-N 2 0 246.345 2.352 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CC2(C)CC2)[C@@H](C)C1 ZINC000309054339 170011188 /nfs/dbraw/zinc/01/11/88/170011188.db2.gz SSWVVRAKGVDXIG-NWDGAFQWSA-N 2 0 210.365 2.106 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)CC(C)C)C1 ZINC000037484232 170015998 /nfs/dbraw/zinc/01/59/98/170015998.db2.gz ORTXDMHKCCWORW-QWHCGFSZSA-N 2 0 212.381 2.352 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccncc2)C1 ZINC000037644019 170017374 /nfs/dbraw/zinc/01/73/74/170017374.db2.gz OJIFYRBJJVRVRB-QWHCGFSZSA-N 2 0 233.359 2.074 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2cnccc2C)C1 ZINC000271375136 170017468 /nfs/dbraw/zinc/01/74/68/170017468.db2.gz HKLJGFMTGFBFFR-ZIAGYGMSSA-N 2 0 247.386 2.382 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH+](C)CCCF)C[C@@H]1C ZINC000361531317 170018006 /nfs/dbraw/zinc/01/80/06/170018006.db2.gz QMBOCIBSSPMMAH-RYUDHWBXSA-N 2 0 216.344 2.151 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccn(C)c2)[C@H](C)C1 ZINC000093638985 170018323 /nfs/dbraw/zinc/01/83/23/170018323.db2.gz UMMAGAUKJDAYPU-HIFRSBDPSA-N 2 0 249.402 2.187 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CCCCF)[C@H](C)C1 ZINC000309063943 170020197 /nfs/dbraw/zinc/02/01/97/170020197.db2.gz YHLQEGPPODKSSE-NEPJUHHUSA-N 2 0 216.344 2.056 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CC[C@H](C)F)[C@@H](C)C1 ZINC000340463547 170021253 /nfs/dbraw/zinc/02/12/53/170021253.db2.gz QZLHYIHRLQPKFO-SRVKXCTJSA-N 2 0 216.344 2.054 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@H](C)CSC)[C@@H](C)C1 ZINC000336759664 170021760 /nfs/dbraw/zinc/02/17/60/170021760.db2.gz KYOSYHILFYPIDC-TUAOUCFPSA-N 2 0 230.421 2.058 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H]2CCC2(C)C)[C@H](C)C1 ZINC000336778035 170022745 /nfs/dbraw/zinc/02/27/45/170022745.db2.gz KFTMDVOLWASZIW-FRRDWIJNSA-N 2 0 224.392 2.495 20 0 BEADRP CO[C@H](C)[C@H](C)[NH2+][C@H]1CCCN2CCCC[C@H]12 ZINC000655849444 411537763 /nfs/dbraw/zinc/53/77/63/411537763.db2.gz UYFXQPXKTFHPSG-RFQIPJPRSA-N 2 0 240.391 2.016 20 0 BEADRP CCOC1CC([NH2+]C2CCC([NH+](C)C)CC2)C1 ZINC000353668934 170327635 /nfs/dbraw/zinc/32/76/35/170327635.db2.gz GTULDWLYGQBXDX-UHFFFAOYSA-N 2 0 240.391 2.016 20 0 BEADRP CCOCC(C)(C)C[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000310183469 170352123 /nfs/dbraw/zinc/35/21/23/170352123.db2.gz ODYOOODAMDWANH-STQMWFEESA-N 2 0 242.407 2.121 20 0 BEADRP CCOCC(C)(C)[NH2+]CCC[NH+]1CCCCC1 ZINC000339378663 170354118 /nfs/dbraw/zinc/35/41/18/170354118.db2.gz OJYKKRCMXNIQHG-UHFFFAOYSA-N 2 0 242.407 2.267 20 0 BEADRP CCOCCC[N@H+](C)C1CC[NH+](C(C)C)CC1 ZINC000336715078 170370549 /nfs/dbraw/zinc/37/05/49/170370549.db2.gz STOVVQZUIFTLIW-UHFFFAOYSA-N 2 0 242.407 2.218 20 0 BEADRP CCOCCC[N@H+](C)[C@H]1CC[NH+](CC)C[C@H]1C ZINC000336704646 170370557 /nfs/dbraw/zinc/37/05/57/170370557.db2.gz NGDYDAGNDIHZIE-KGLIPLIRSA-N 2 0 242.407 2.075 20 0 BEADRP CCOCCC[N@H+](C)[C@@H]1CC[NH+](CC)C[C@@H]1C ZINC000336704647 170370759 /nfs/dbraw/zinc/37/07/59/170370759.db2.gz NGDYDAGNDIHZIE-UONOGXRCSA-N 2 0 242.407 2.075 20 0 BEADRP CCOCCC[N@H+](C)[C@H]1CC[NH+](CC)[C@H](C)C1 ZINC000336708418 170371296 /nfs/dbraw/zinc/37/12/96/170371296.db2.gz HYBIOIAXSRUMFK-KGLIPLIRSA-N 2 0 242.407 2.218 20 0 BEADRP C[C@]1(C[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)CC1(F)F ZINC000657663461 411576371 /nfs/dbraw/zinc/57/63/71/411576371.db2.gz BOOHCBWMERGZBC-SDDRHHMPSA-N 2 0 244.329 2.248 20 0 BEADRP c1cc(C[NH2+]CC2CC[NH+](CC3CC3)CC2)c[nH]1 ZINC000657813629 411603990 /nfs/dbraw/zinc/60/39/90/411603990.db2.gz UZYVHVYWYKBCAQ-UHFFFAOYSA-N 2 0 247.386 2.226 20 0 BEADRP C[N@@H+]1CC[C@]2(CC[NH+](C[C@@H]3CC[C@H]4C[C@H]4C3)C2)C1 ZINC000660616152 411608469 /nfs/dbraw/zinc/60/84/69/411608469.db2.gz HMUGPRNTJQJCBI-QXSJWSMHSA-N 2 0 248.414 2.450 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@@H]1COC2(CCC2)C1 ZINC000657831379 411609158 /nfs/dbraw/zinc/60/91/58/411609158.db2.gz WTCVWWPNJGJVTI-ZDUSSCGKSA-N 2 0 240.391 2.018 20 0 BEADRP C[N@@H+]1CCC[C@@]2(CC[NH+](CC3CC=CC3)C2)C1 ZINC000660639333 411610800 /nfs/dbraw/zinc/61/08/00/411610800.db2.gz FGDYSOVFGGKTCC-OAHLLOKOSA-N 2 0 234.387 2.370 20 0 BEADRP CC(C)C[N@@H+]1CCC[C@@]2(CC[NH+](C)C2)C1 ZINC000660656824 411614503 /nfs/dbraw/zinc/61/45/03/411614503.db2.gz VCUDTBZRHGLEDV-ZDUSSCGKSA-N 2 0 210.365 2.060 20 0 BEADRP CC[C@H](c1ccccc1)[N@H+](C)CCC[NH3+] ZINC000133205711 411655422 /nfs/dbraw/zinc/65/54/22/411655422.db2.gz YMVPUMNMZBQZQB-CYBMUJFWSA-N 2 0 206.333 2.418 20 0 BEADRP C[C@@H](CC[NH+](C)C)Nc1[nH+]ccc2[nH]ccc21 ZINC000663451510 411660142 /nfs/dbraw/zinc/66/01/42/411660142.db2.gz CKSHNUCOEHYMEI-JTQLQIEISA-N 2 0 232.331 2.315 20 0 BEADRP C([NH2+][C@@H]1CCCC[C@H]1C1CC1)C12CC(C1)C[NH2+]2 ZINC000663497285 411679268 /nfs/dbraw/zinc/67/92/68/411679268.db2.gz CSWLDTULWRSCTL-PIBLMLOJSA-N 2 0 234.387 2.297 20 0 BEADRP C[C@H](Cc1ccc(F)cc1)[NH2+]CC12CC(C1)C[NH2+]2 ZINC000663497548 411679878 /nfs/dbraw/zinc/67/98/78/411679878.db2.gz HEEWQDWVWCUBEM-NUYPLMSZSA-N 2 0 248.345 2.098 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+]Cc1ccccc1F ZINC000663497614 411680032 /nfs/dbraw/zinc/68/00/32/411680032.db2.gz CYRXCUWQKBQXIQ-CYBMUJFWSA-N 2 0 224.323 2.289 20 0 BEADRP C[C@]1(C[N@@H+]2CCC[C@@H](C3CCC3)C2)CC[NH2+]C1 ZINC000663499122 411682203 /nfs/dbraw/zinc/68/22/03/411682203.db2.gz ATONQDZBJMPTJG-CABCVRRESA-N 2 0 236.403 2.498 20 0 BEADRP C[NH2+]C[C@H](C)[NH2+][C@@H]1CCCC[C@H]1C1CC1 ZINC000663510731 411693134 /nfs/dbraw/zinc/69/31/34/411693134.db2.gz RTFRFRVOQGBFHO-WCFLWFBJSA-N 2 0 210.365 2.153 20 0 BEADRP CCC(C)(C)[C@@H](C)[NH2+]C[C@H](O)C[N@H+](C)C(C)C ZINC000661231551 411737115 /nfs/dbraw/zinc/73/71/15/411737115.db2.gz NXAZCLHHNYMOSO-OLZOCXBDSA-N 2 0 244.423 2.102 20 0 BEADRP CN(CC[N@H+](C)C1CC1)c1[nH+]ccc2[nH]ccc21 ZINC000663811020 411751924 /nfs/dbraw/zinc/75/19/24/411751924.db2.gz SAXTUHJEZDBMSD-UHFFFAOYSA-N 2 0 244.342 2.093 20 0 BEADRP Cc1cc[nH+]c(NCC[C@H](C)[NH+](C)C)c1 ZINC000664242683 411894924 /nfs/dbraw/zinc/89/49/24/411894924.db2.gz GCDNXVQEHNUAAP-NSHDSACASA-N 2 0 207.321 2.142 20 0 BEADRP Cc1[nH+]ccc(N(C)CC2C[NH+](C)C2)c1Cl ZINC000664330191 411922525 /nfs/dbraw/zinc/92/25/25/411922525.db2.gz KAKQXWRFZXSGOF-UHFFFAOYSA-N 2 0 239.750 2.041 20 0 BEADRP C(C[NH+]1CCCCC1)C[N@@H+]1CC[C@H]2C[C@H]2C1 ZINC000661967157 411923783 /nfs/dbraw/zinc/92/37/83/411923783.db2.gz CDCKGPWMMAJREF-KBPBESRZSA-N 2 0 222.376 2.204 20 0 BEADRP Cc1cc(N[C@@H](C)C[NH+]2CCC(C)CC2)cc[nH+]1 ZINC000664454241 411961474 /nfs/dbraw/zinc/96/14/74/411961474.db2.gz FCLSFCKVUTYKCM-AWEZNQCLSA-N 2 0 247.386 2.344 20 0 BEADRP Cc1c[nH+]ccc1N[C@H](C)C[NH+]1CCC(C)CC1 ZINC000664455284 411963276 /nfs/dbraw/zinc/96/32/76/411963276.db2.gz WXKIRILFASHUQQ-CQSZACIVSA-N 2 0 247.386 2.344 20 0 BEADRP c1ccc2c(c1)CC[C@@H]2CC[N@@H+]1CCC[NH2+]CC1 ZINC000662240792 412037202 /nfs/dbraw/zinc/03/72/02/412037202.db2.gz MSAGLSJTQKATJY-OAHLLOKOSA-N 2 0 244.382 2.402 20 0 BEADRP C[C@@H]([NH3+])[C@@H]1CCCN(Cc2cc(C3CC3)no2)C1 ZINC000662247420 412045288 /nfs/dbraw/zinc/04/52/88/412045288.db2.gz XVIKZPGJBBTJOT-ZYHUDNBSSA-N 2 0 249.358 2.111 20 0 BEADRP CO[C@H](C[N@H+](C)CC[C@@H]([NH3+])C(C)C)C1CCC1 ZINC000662248035 412046507 /nfs/dbraw/zinc/04/65/07/412046507.db2.gz RFBVAEXMZFUHHX-ZIAGYGMSSA-N 2 0 242.407 2.107 20 0 BEADRP C[C@@H]1C[C@@H](C[NH3+])C[N@@H+]1CCCC1CCC1 ZINC000662265503 412055892 /nfs/dbraw/zinc/05/58/92/412055892.db2.gz PRZLWABROQEWKW-YPMHNXCESA-N 2 0 210.365 2.236 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]CCN1CCC[C@H](C)C1 ZINC000310038234 171041601 /nfs/dbraw/zinc/04/16/01/171041601.db2.gz VWZQMZUVRFARGB-MJBXVCDLSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]C[C@H](C)C[NH+]1CCCC1 ZINC000309448325 171043531 /nfs/dbraw/zinc/04/35/31/171043531.db2.gz KLIBXGDXHUCYLI-MJBXVCDLSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]C[C@@H]1CCC[N@H+](CC)C1 ZINC000310036769 171043715 /nfs/dbraw/zinc/04/37/15/171043715.db2.gz UNXCJDIKDNUZMF-MJBXVCDLSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H]1CC[C@H](C)[N@@H+]1CC[C@@H]1CC[NH2+]C1 ZINC000136234143 171053709 /nfs/dbraw/zinc/05/37/09/171053709.db2.gz PPSWVQXXPHDNNZ-RWMBFGLXSA-N 2 0 210.365 2.249 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+]C[C@H](C)C[NH+]1CCCC1 ZINC000309448319 171059146 /nfs/dbraw/zinc/05/91/46/171059146.db2.gz KLIBXGDXHUCYLI-BFHYXJOUSA-N 2 0 224.392 2.497 20 0 BEADRP C(CC1CCC1)C[N@H+]1CC[C@H]2C[NH2+]C[C@H]2CC1 ZINC000662273274 412065682 /nfs/dbraw/zinc/06/56/82/412065682.db2.gz KYKLOSWVFDPILJ-GASCZTMLSA-N 2 0 236.403 2.498 20 0 BEADRP CC(C)=CCC[N@@H+]1CC[C@H]2[NH2+]CC[C@H]2C1 ZINC000662274741 412067517 /nfs/dbraw/zinc/06/75/17/412067517.db2.gz WPSLGAKCNXRNBY-QWHCGFSZSA-N 2 0 208.349 2.027 20 0 BEADRP C1=CCC(C[N@@H+]2CCC[C@H]([C@H]3CC[NH2+]C3)C2)C1 ZINC000662275282 412068262 /nfs/dbraw/zinc/06/82/62/412068262.db2.gz YVTBUCACEUDQEM-GJZGRUSLSA-N 2 0 234.387 2.274 20 0 BEADRP CC[C@H](CC(F)F)C[N@H+](C)CCC[NH2+]C ZINC000662282453 412073172 /nfs/dbraw/zinc/07/31/72/412073172.db2.gz VHVQEGGIQIAKLC-SNVBAGLBSA-N 2 0 222.323 2.209 20 0 BEADRP C(C[NH+]1CCC2(CC[NH2+]2)CC1)C1CCC1 ZINC000662283380 412074355 /nfs/dbraw/zinc/07/43/55/412074355.db2.gz NCRZDXMDNXOVRP-UHFFFAOYSA-N 2 0 208.349 2.005 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCC[C@H]([NH+](C)C)CC1 ZINC000372992405 171281260 /nfs/dbraw/zinc/28/12/60/171281260.db2.gz WYOSFVZSHGKXMG-STQMWFEESA-N 2 0 212.381 2.449 20 0 BEADRP C[N@H+](CCCc1ccsc1)CC(C)(C)[NH3+] ZINC000662293714 412082766 /nfs/dbraw/zinc/08/27/66/412082766.db2.gz IGTPUJPFVCTGMK-UHFFFAOYSA-N 2 0 226.389 2.350 20 0 BEADRP CC[C@H](C)[N@H+](C)CCNC(=[NH2+])Nc1ccccc1 ZINC000103338648 171304779 /nfs/dbraw/zinc/30/47/79/171304779.db2.gz SVNDJFPHKAEBEQ-LBPRGKRZSA-N 2 0 248.374 2.353 20 0 BEADRP CCCC[N@@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000662295418 412084785 /nfs/dbraw/zinc/08/47/85/412084785.db2.gz REBHKENGRRUFOC-AWEZNQCLSA-N 2 0 224.392 2.498 20 0 BEADRP CC[C@H](C)[NH2+]C[C@@H]1CCCCN1C1CC1 ZINC000309197190 171341349 /nfs/dbraw/zinc/34/13/49/171341349.db2.gz QSZWUAOPFTZQNQ-AAEUAGOBSA-N 2 0 210.365 2.391 20 0 BEADRP CC[C@H](C)[NH2+]C[C@@H](C(C)C)N1CCCC1 ZINC000020200918 171341546 /nfs/dbraw/zinc/34/15/46/171341546.db2.gz NBIHCCSZXUWTQJ-STQMWFEESA-N 2 0 212.381 2.495 20 0 BEADRP CC[C@@H](C)[N@@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000662294073 412082028 /nfs/dbraw/zinc/08/20/28/412082028.db2.gz OSDQDVFDNJQEMX-TZMCWYRMSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)C[C@@H](C)C[N@@H+]1CC2CC1(C[NH3+])C2 ZINC000662306337 412091500 /nfs/dbraw/zinc/09/15/00/412091500.db2.gz QOOCJWUIEMKLCJ-PNESKVBLSA-N 2 0 210.365 2.092 20 0 BEADRP C[C@@H]1CCC[N@H+](Cc2ccno2)[C@@H]1CCC[NH3+] ZINC000662312017 412094785 /nfs/dbraw/zinc/09/47/85/412094785.db2.gz FSCXKKDSXKWBFA-DGCLKSJQSA-N 2 0 237.347 2.014 20 0 BEADRP CC(C)C[N@@H+]1CCC[C@@H](C)[C@H]1CCC[NH3+] ZINC000662312933 412094888 /nfs/dbraw/zinc/09/48/88/412094888.db2.gz BEUPXIQNABSKBG-CHWSQXEVSA-N 2 0 212.381 2.482 20 0 BEADRP CC1C[C@H]2CC[C@@H](C1)[N@H+]2CC[C@H]1CC[NH2+]C1 ZINC000662319058 412098661 /nfs/dbraw/zinc/09/86/61/412098661.db2.gz JVDPYRKMNCCBGD-CPIKKWJDSA-N 2 0 222.376 2.249 20 0 BEADRP C[N@H+](C[C@H]1CC[NH2+]C1)C[C@H]1CCc2ccccc21 ZINC000662322541 412101151 /nfs/dbraw/zinc/10/11/51/412101151.db2.gz NAFDBNYXEDMZFS-DZGCQCFKSA-N 2 0 244.382 2.258 20 0 BEADRP C[N@H+](CCC1CC[NH2+]CC1)C[C@H]1CC1(C)C ZINC000662330244 412105108 /nfs/dbraw/zinc/10/51/08/412105108.db2.gz CUVDQWCSIGWQLR-CYBMUJFWSA-N 2 0 224.392 2.354 20 0 BEADRP C[N@H+](CC[C@@H]1CCC[NH+]1C)C[C@H]1CC1(C)C ZINC000662345687 412116899 /nfs/dbraw/zinc/11/68/99/412116899.db2.gz LCEFZRZFNCCBPN-OLZOCXBDSA-N 2 0 224.392 2.449 20 0 BEADRP C[NH+](C)Cc1cc(-c2ncc[nH]2)ccc1F ZINC000665199620 412131673 /nfs/dbraw/zinc/13/16/73/412131673.db2.gz PPQYFXROVDLCMC-UHFFFAOYSA-N 2 0 219.263 2.277 20 0 BEADRP CC[C@H](C)CC[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000665238382 412178293 /nfs/dbraw/zinc/17/82/93/412178293.db2.gz XGCZGQJMJXBMTN-IGQOVBAYSA-N 2 0 224.392 2.400 20 0 BEADRP CC[C@H](C)CC[NH2+][C@@H]1CC[NH2+]CC[C@@H]1C ZINC000665238193 412178745 /nfs/dbraw/zinc/17/87/45/412178745.db2.gz SVKKCHKVNNVKOY-RWMBFGLXSA-N 2 0 212.381 2.400 20 0 BEADRP CC[C@H]([NH2+]CC1([NH3+])CCCC1)[C@H]1C[C@@H]1C ZINC000665246423 412190533 /nfs/dbraw/zinc/19/05/33/412190533.db2.gz FLLBUJPWUDLUET-SRVKXCTJSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]([NH2+]CCC(C)(C)F)[C@@H]1CCCC[NH2+]1 ZINC000665262235 412206042 /nfs/dbraw/zinc/20/60/42/412206042.db2.gz WTRYQWWNUNMERP-MNOVXSKESA-N 2 0 216.344 2.245 20 0 BEADRP COCc1csc(C[NH2+][C@@H](C)C[C@@H](C)[NH3+])c1 ZINC000665263457 412206071 /nfs/dbraw/zinc/20/60/71/412206071.db2.gz MLCXYXHZRCZNBV-ZJUUUORDSA-N 2 0 242.388 2.110 20 0 BEADRP C[C@@H]([NH2+]CCC(C)(C)F)[C@H]1CCCC[NH2+]1 ZINC000665262234 412206264 /nfs/dbraw/zinc/20/62/64/412206264.db2.gz WTRYQWWNUNMERP-GHMZBOCLSA-N 2 0 216.344 2.245 20 0 BEADRP CC(C)(F)CC[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000665262352 412206350 /nfs/dbraw/zinc/20/63/50/412206350.db2.gz ZAPNRTYXHFRHCO-SDDRHHMPSA-N 2 0 228.355 2.102 20 0 BEADRP C[C@H]1CCC[C@@H](C[NH2+]C2CCC(C[NH3+])CC2)O1 ZINC000665265378 412208995 /nfs/dbraw/zinc/20/89/95/412208995.db2.gz WQQKZHSVXXUBPR-ABXWRUBCSA-N 2 0 240.391 2.051 20 0 BEADRP [NH3+][C@H]1CCCCC[C@@H]1[NH2+]CC1=CCCC1 ZINC000665274041 412215514 /nfs/dbraw/zinc/21/55/14/412215514.db2.gz IMEQJYQTHFWTDO-STQMWFEESA-N 2 0 208.349 2.346 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]C[C@]1(C)CC1(F)F ZINC000665266979 412210261 /nfs/dbraw/zinc/21/02/61/412210261.db2.gz NENHYUCKILBLIZ-UWVGGRQHSA-N 2 0 220.307 2.139 20 0 BEADRP C[C@]1(CC[NH2+][C@@H]2CCC[C@@H]2C[NH3+])CC1(F)F ZINC000665266822 412210401 /nfs/dbraw/zinc/21/04/01/412210401.db2.gz KIWVYMVKOIAFAC-MXWKQRLJSA-N 2 0 232.318 2.139 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CC[C@@]1(C)CC1(F)F ZINC000665266913 412210497 /nfs/dbraw/zinc/21/04/97/412210497.db2.gz LTQLQQNPADMTMK-GUBZILKMSA-N 2 0 220.307 2.137 20 0 BEADRP C[C@]1(C[NH2+][C@@H]2CCCCC[C@H]2[NH3+])CC1(F)F ZINC000665266803 412210593 /nfs/dbraw/zinc/21/05/93/412210593.db2.gz KCAZIQOFVCKVRM-GMTAPVOTSA-N 2 0 232.318 2.281 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@H]1CCc2cc(N)ccc21 ZINC000665272062 412213386 /nfs/dbraw/zinc/21/33/86/412213386.db2.gz XFCLFYSMRJGVCC-ABAIWWIYSA-N 2 0 247.386 2.363 20 0 BEADRP CC1(C)[C@H](C[NH2+][C@H]2CCC[C@H]([NH3+])C2)C1(F)F ZINC000665274801 412213509 /nfs/dbraw/zinc/21/35/09/412213509.db2.gz YOYFCEQJVGPCNP-GUBZILKMSA-N 2 0 232.318 2.137 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]C[C@H](C)c1ccccn1 ZINC000665232024 412167770 /nfs/dbraw/zinc/16/77/70/412167770.db2.gz DPANHXFLQXCWND-STQMWFEESA-N 2 0 235.375 2.292 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]1[NH2+][C@@H]1CC[C@@H]1c1ccccc1 ZINC000665274021 412216081 /nfs/dbraw/zinc/21/60/81/412216081.db2.gz ICUJSGBQJRROHZ-BARDWOONSA-N 2 0 230.355 2.402 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1C(C)(C)C1(F)F)[C@@H]1CCC[NH2+]1 ZINC000665274690 412216981 /nfs/dbraw/zinc/21/69/81/412216981.db2.gz WFTVIBZHCBVDML-GARJFASQSA-N 2 0 246.345 2.398 20 0 BEADRP CC(C)(C)[C@H]1CC[C@@H]1[NH2+]CC12CC(C1)C[NH2+]2 ZINC000665279530 412221417 /nfs/dbraw/zinc/22/14/17/412221417.db2.gz FSKGIXKNCCSKMZ-ATJQQHLPSA-N 2 0 222.376 2.153 20 0 BEADRP C([NH2+][C@@H](C1CC1)C1CCCC1)C12CC(C1)C[NH2+]2 ZINC000665279872 412224970 /nfs/dbraw/zinc/22/49/70/412224970.db2.gz NZDGKCBVNHNCMD-XGTXGMFGSA-N 2 0 234.387 2.297 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+][C@H]1CCC12CCC2 ZINC000665282053 412225842 /nfs/dbraw/zinc/22/58/42/412225842.db2.gz PSFYQRVCXLJUQT-NEPJUHHUSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H](C[NH2+][C@@H](C)C1C[NH2+]C1)C1CCCCC1 ZINC000665283640 412228649 /nfs/dbraw/zinc/22/86/49/412228649.db2.gz RMVCEAHFWJBPHW-NEPJUHHUSA-N 2 0 224.392 2.400 20 0 BEADRP CCc1ccc(C[NH+]2CCC(C[NH3+])CC2)s1 ZINC000019843449 171797337 /nfs/dbraw/zinc/79/73/37/171797337.db2.gz GQGGKJUETLDSPQ-UHFFFAOYSA-N 2 0 238.400 2.481 20 0 BEADRP CCc1nccn1Cc1cn2c(cccc2C)n1 ZINC000158348488 172027807 /nfs/dbraw/zinc/02/78/07/172027807.db2.gz HZSJRHSDXCMXBK-UHFFFAOYSA-N 2 0 240.310 2.450 20 0 BEADRP C[NH+](C)CCC[NH2+][C@H]1CCC[C@@H]1CCCF ZINC000309957369 172444007 /nfs/dbraw/zinc/44/40/07/172444007.db2.gz JBHNIPNPAOFXJI-OLZOCXBDSA-N 2 0 230.371 2.446 20 0 BEADRP C[N@@H+]1CCCC[C@@H]1CC[NH2+][C@H]1CCOC1(C)C ZINC000328278707 173004145 /nfs/dbraw/zinc/00/41/45/173004145.db2.gz YSBNICBXVQCCNC-OLZOCXBDSA-N 2 0 240.391 2.018 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+]C2CCCCC2)C1 ZINC000044535571 173042734 /nfs/dbraw/zinc/04/27/34/173042734.db2.gz JTHOFPLIKVTEIP-GFCCVEGCSA-N 2 0 210.365 2.251 20 0 BEADRP CN1CCC[C@H]([NH2+]C2CCCCCC2)C1 ZINC000040671726 173046727 /nfs/dbraw/zinc/04/67/27/173046727.db2.gz PJSOSTJBONCFLN-ZDUSSCGKSA-N 2 0 210.365 2.393 20 0 BEADRP C[N@@H+]1CCC[C@H]1CC[NH+]1CCC(C(F)F)CC1 ZINC000336678618 173050766 /nfs/dbraw/zinc/05/07/66/173050766.db2.gz BQIQSBVWFCLAJC-LBPRGKRZSA-N 2 0 246.345 2.448 20 0 BEADRP C[N@@H+]1CCC[C@H]2C[NH+](CCCCF)CC[C@@H]21 ZINC000367158592 173060512 /nfs/dbraw/zinc/06/05/12/173060512.db2.gz TVEVJMHEDBUNRN-STQMWFEESA-N 2 0 228.355 2.152 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CCc2ccco2)[C@@H]2CCC[C@@H]21 ZINC000353432131 173152505 /nfs/dbraw/zinc/15/25/05/173152505.db2.gz AQNCMAZFNAOPQE-KKUMJFAQSA-N 2 0 248.370 2.285 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CCC[C@@H]2F)[C@H]2CCC[C@H]21 ZINC000340525609 173154246 /nfs/dbraw/zinc/15/42/46/173154246.db2.gz WVMNOXKPDVJCNZ-MBJXGIAVSA-N 2 0 240.366 2.339 20 0 BEADRP C[N@H+]1C[C@@H]2C[NH+](CC3CCCCC3)C[C@@H]2C1 ZINC000039348989 173196612 /nfs/dbraw/zinc/19/66/12/173196612.db2.gz QMFPYABVUNXCHB-OKILXGFUSA-N 2 0 222.376 2.060 20 0 BEADRP C[NH2+]CC1CC[NH+](CCC(C)(C)C)CC1 ZINC000051756301 173338433 /nfs/dbraw/zinc/33/84/33/173338433.db2.gz UGVYHUNWTCLMRP-UHFFFAOYSA-N 2 0 212.381 2.354 20 0 BEADRP C[NH2+]CCC1CC[NH+](C[C@@H]2CCSC2)CC1 ZINC000224614333 173342652 /nfs/dbraw/zinc/34/26/52/173342652.db2.gz SLNOSMWDQBDKIJ-ZDUSSCGKSA-N 2 0 242.432 2.061 20 0 BEADRP C[NH2+]CCC1CC[NH+](C[C@H]2CCSC2)CC1 ZINC000224614381 173342762 /nfs/dbraw/zinc/34/27/62/173342762.db2.gz SLNOSMWDQBDKIJ-CYBMUJFWSA-N 2 0 242.432 2.061 20 0 BEADRP C[NH2+]CCC1CC[NH+](Cc2cnccc2C)CC1 ZINC000135500478 173343245 /nfs/dbraw/zinc/34/32/45/173343245.db2.gz WFXYMLFJDXQMOR-UHFFFAOYSA-N 2 0 247.386 2.212 20 0 BEADRP C[NH2+]CCC[N@H+](C)Cc1ccc2ncccc2c1 ZINC000124782953 173346271 /nfs/dbraw/zinc/34/62/71/173346271.db2.gz AMSXUOLMZQDKMO-UHFFFAOYSA-N 2 0 243.354 2.276 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCC[C@@H]1c1cccs1 ZINC000336714506 173346734 /nfs/dbraw/zinc/34/67/34/173346734.db2.gz VCKSKNYTEHSHHA-LLVKDONJSA-N 2 0 224.373 2.495 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCCC[C@H]1CC(C)C ZINC000336709862 173346978 /nfs/dbraw/zinc/34/69/78/173346978.db2.gz RJCYTJNUVDBYIC-ZDUSSCGKSA-N 2 0 212.381 2.497 20 0 BEADRP C[NH2+]CCC[NH2+]Cc1ccc(C(F)(F)F)cc1 ZINC000083375071 173348632 /nfs/dbraw/zinc/34/86/32/173348632.db2.gz WSLHVLBIMKYCGC-UHFFFAOYSA-N 2 0 246.276 2.405 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](CCCC(C)(C)C)C1 ZINC000300886145 173369568 /nfs/dbraw/zinc/36/95/68/173369568.db2.gz PDQIULHKIQIYCF-LBPRGKRZSA-N 2 0 212.381 2.354 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@@H+]([C@H](C)c2cccc(OC)c2)C1 ZINC000251563612 173370708 /nfs/dbraw/zinc/37/07/08/173370708.db2.gz SSYYRUZYGDJCRT-OLZOCXBDSA-N 2 0 248.370 2.298 20 0 BEADRP C[NH2+]C[C@H]1CCC[N@H+](CC2CCCCC2)C1 ZINC000011888655 173379098 /nfs/dbraw/zinc/37/90/98/173379098.db2.gz AJWAQCQDRDZESL-CQSZACIVSA-N 2 0 224.392 2.498 20 0 BEADRP C[NH2+]C[C@H]1CCCN1c1cc[nH+]c2ccccc21 ZINC000053704015 173380942 /nfs/dbraw/zinc/38/09/42/173380942.db2.gz MHOGUYNAGCJBIT-GFCCVEGCSA-N 2 0 241.338 2.423 20 0 BEADRP C[NH2+]C[C@H]1CC[N@H+](Cc2sccc2C)C1 ZINC000070798632 173381443 /nfs/dbraw/zinc/38/14/43/173381443.db2.gz PXCIQRYYTAQEFO-LLVKDONJSA-N 2 0 224.373 2.098 20 0 BEADRP C[NH2+]C[C@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC000053012238 173381797 /nfs/dbraw/zinc/38/17/97/173381797.db2.gz LZWHOWKJRAMZKN-QWHCGFSZSA-N 2 0 218.344 2.289 20 0 BEADRP CC(C)C1(C[NH2+]CC2CC[NH+](C)CC2)CC1 ZINC000232662782 487627421 /nfs/dbraw/zinc/62/74/21/487627421.db2.gz QFEAPFVSPQNBJB-UHFFFAOYSA-N 2 0 224.392 2.354 20 0 BEADRP COCCCC[N@H+](CCC[NH3+])CC1CCCC1 ZINC000352520053 174189703 /nfs/dbraw/zinc/18/97/03/174189703.db2.gz UTZUYXPFCYFOPK-UHFFFAOYSA-N 2 0 242.407 2.254 20 0 BEADRP COCC[C@@H](C)[NH2+]CCC[NH+]1CCC(C)CC1 ZINC000045018620 174382721 /nfs/dbraw/zinc/38/27/21/174382721.db2.gz WXSPTYNRTIWMTI-CQSZACIVSA-N 2 0 242.407 2.123 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+][C@@H]1CC[C@H](C)[C@H](C)C1 ZINC000300023901 174562277 /nfs/dbraw/zinc/56/22/77/174562277.db2.gz ITTNISJUAFSAHK-DGAVXFQQSA-N 2 0 242.407 2.155 20 0 BEADRP COc1ccc(C)cc1C[NH+]1CCC(C[NH3+])CC1 ZINC000044513678 175075138 /nfs/dbraw/zinc/07/51/38/175075138.db2.gz LCPQGBDJBMMFNO-UHFFFAOYSA-N 2 0 248.370 2.174 20 0 BEADRP COc1ccc(C[NH2+]CCCC[NH+](C)C)cc1 ZINC000045598359 175106670 /nfs/dbraw/zinc/10/66/70/175106670.db2.gz GJFZBNIXPXJZCN-UHFFFAOYSA-N 2 0 236.359 2.127 20 0 BEADRP COc1cccc(C[N@@H+]2CCC[C@H]([C@H](C)[NH3+])C2)c1 ZINC000111695792 175257965 /nfs/dbraw/zinc/25/79/65/175257965.db2.gz GUWXPNDUXZQJOC-JSGCOSHPSA-N 2 0 248.370 2.254 20 0 BEADRP COc1cccc([C@@H](C)[NH2+]Cc2cnc[nH]2)c1 ZINC000054765031 175287084 /nfs/dbraw/zinc/28/70/84/175287084.db2.gz ZYHIJRSFBDHISN-SNVBAGLBSA-N 2 0 231.299 2.269 20 0 BEADRP COc1cccc([C@H](C)[NH2+]CC2CC[NH2+]CC2)c1 ZINC000094010234 175292725 /nfs/dbraw/zinc/29/27/25/175292725.db2.gz XPHVBASPMWNZCU-LBPRGKRZSA-N 2 0 248.370 2.345 20 0 BEADRP COc1cccc([C@H](C)[NH2+][C@@H]2CCN(C)C2)c1 ZINC000042544290 175293332 /nfs/dbraw/zinc/29/33/32/175293332.db2.gz WTEMZKXLENHNSN-WCQYABFASA-N 2 0 234.343 2.050 20 0 BEADRP COc1cccc([C@H](C)[NH2+]C[C@H]2CCC[NH2+]C2)c1 ZINC000132187105 175293588 /nfs/dbraw/zinc/29/35/88/175293588.db2.gz LMYCQUOWSZKLPV-STQMWFEESA-N 2 0 248.370 2.345 20 0 BEADRP COc1cccc([C@H](C)[NH2+][C@@H]2CN(C)C[C@H]2C)c1 ZINC000358407126 175293780 /nfs/dbraw/zinc/29/37/80/175293780.db2.gz SOYCXQGWPQFZHU-TYNCELHUSA-N 2 0 248.370 2.296 20 0 BEADRP COc1ccccc1[C@@H](C)[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000128878529 175345862 /nfs/dbraw/zinc/34/58/62/175345862.db2.gz CQOLCLDPLXWAOA-CHWSQXEVSA-N 2 0 248.370 2.488 20 0 BEADRP COc1ccccc1[C@H](C)[NH2+][C@H]1CCC[NH2+]CC1 ZINC000128878768 175352111 /nfs/dbraw/zinc/35/21/11/175352111.db2.gz CQOLCLDPLXWAOA-STQMWFEESA-N 2 0 248.370 2.488 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@H]1COc2ccccc2C1 ZINC000336887900 175663975 /nfs/dbraw/zinc/66/39/75/175663975.db2.gz DOMQDECYEBYOGZ-GXTWGEPZSA-N 2 0 248.370 2.097 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+][C@@H](C)CCC[NH3+] ZINC000336683783 175666026 /nfs/dbraw/zinc/66/60/26/175666026.db2.gz ZKRLYFZCKNGGGU-NWDGAFQWSA-N 2 0 224.348 2.318 20 0 BEADRP C[C@@H]([NH2+]CCC[NH3+])[C@@H](C)c1ccccc1 ZINC000309376650 176023367 /nfs/dbraw/zinc/02/33/67/176023367.db2.gz CTKALDBATMGIKM-VXGBXAGGSA-N 2 0 206.333 2.117 20 0 BEADRP C[C@@H](c1cccnc1)[N@@H+]1CCC[C@@H](CC[NH3+])C1 ZINC000226326734 176028933 /nfs/dbraw/zinc/02/89/33/176028933.db2.gz GDEORWNAMOOVFX-STQMWFEESA-N 2 0 233.359 2.203 20 0 BEADRP C[C@@H]1CCCCC[N@@H+]1CC1CC[NH2+]CC1 ZINC000069944969 176063180 /nfs/dbraw/zinc/06/31/80/176063180.db2.gz ZKYBDANLMGFETA-GFCCVEGCSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@@H]1CN(C)C[C@@H]1[NH2+]C[C@H]1CCCC[C@H]1C ZINC000336780466 176077391 /nfs/dbraw/zinc/07/73/91/176077391.db2.gz RKHCSCQJSKLXQZ-SYQHCUMBSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1CCC[N@H+](CC[C@@H]2CCC[NH2+]C2)[C@@H]1C ZINC000051919682 176098934 /nfs/dbraw/zinc/09/89/34/176098934.db2.gz OGSNQQZUAJLEKT-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CCC[C@@H](CC[N@H+]2C[C@H]3C[NH2+]C[C@H]3C2)C1 ZINC000359294833 176117406 /nfs/dbraw/zinc/11/74/06/176117406.db2.gz AUVFLLAFSVICSF-BARDWOONSA-N 2 0 236.403 2.354 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]C2CC[NH2+]CC2)CC1 ZINC000235300204 176122680 /nfs/dbraw/zinc/12/26/80/176122680.db2.gz ULBIUFNMPDAOQF-VXGBXAGGSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]CCCC[NH+](C)C)C1 ZINC000045662982 176143284 /nfs/dbraw/zinc/14/32/84/176143284.db2.gz BDTUZCHOXWBJHO-OLZOCXBDSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H]1CC[N@H+](CCCCCF)C[C@@H]1C[NH3+] ZINC000336695459 176169062 /nfs/dbraw/zinc/16/90/62/176169062.db2.gz NWIANVCSFZTACX-NEPJUHHUSA-N 2 0 216.344 2.043 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]CCC1(F)CCC1 ZINC000336778899 176268228 /nfs/dbraw/zinc/26/82/28/176268228.db2.gz MQWBSIMREOTHHI-NEPJUHHUSA-N 2 0 228.355 2.199 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC000302212515 176269049 /nfs/dbraw/zinc/26/90/49/176269049.db2.gz XWTJNLFAVVKOJY-UTUOFQBUSA-N 2 0 246.345 2.352 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]CC1=CCCCC1 ZINC000336236005 176270808 /nfs/dbraw/zinc/27/08/08/176270808.db2.gz GIPIORSPFUVUOC-TZMCWYRMSA-N 2 0 222.376 2.417 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+][C@H]1CSC1(C)C ZINC000309823376 176280962 /nfs/dbraw/zinc/28/09/62/176280962.db2.gz WVTQGNGZADXBRE-KKOKHZNYSA-N 2 0 242.432 2.199 20 0 BEADRP C[C@@H]1C[N@H+](Cc2ccc3c(c2)CCC3)CC[C@@H]1[NH3+] ZINC000094341410 176304229 /nfs/dbraw/zinc/30/42/29/176304229.db2.gz QBTLNIVLAUZURD-WBMJQRKESA-N 2 0 244.382 2.344 20 0 BEADRP C[C@@H]1C[N@H+](Cc2ccc(F)cc2)C[C@@]1(C)C[NH3+] ZINC000335263328 176304628 /nfs/dbraw/zinc/30/46/28/176304628.db2.gz VSHBLEJABKIPPC-BXUZGUMPSA-N 2 0 236.334 2.242 20 0 BEADRP C[C@@H]1CSC[C@@H]1[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000304538739 176352527 /nfs/dbraw/zinc/35/25/27/176352527.db2.gz RYEVCDITLVYMNL-NEPJUHHUSA-N 2 0 242.432 2.059 20 0 BEADRP C[C@@H]1C[C@@H](C)C[NH+](CCC2CC[NH2+]CC2)C1 ZINC000026515083 176360777 /nfs/dbraw/zinc/36/07/77/176360777.db2.gz ZFUSEAGMIYQSFG-CHWSQXEVSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H]1C[C@@H](C[NH+]2Cc3ccccc3C2)CC[NH2+]1 ZINC000235414130 176368965 /nfs/dbraw/zinc/36/89/65/176368965.db2.gz CVOGTYIDIURRIJ-OLZOCXBDSA-N 2 0 230.355 2.390 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCCSC2)CC[N@@H+]1C ZINC000304332837 176376242 /nfs/dbraw/zinc/37/62/42/176376242.db2.gz AOMXGNCCYIVOQJ-AGIUHOORSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@H](CC[NH2+]C[C@H]1C[C@H]1C)[NH+]1CCCCC1 ZINC000309757143 176396517 /nfs/dbraw/zinc/39/65/17/176396517.db2.gz LURZBBUMBMFANN-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@H]1CC=CCC1 ZINC000309024659 176618278 /nfs/dbraw/zinc/61/82/78/176618278.db2.gz XFMMCRRLIUQHDY-OLZOCXBDSA-N 2 0 210.365 2.450 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H](C)CCc1ccco1 ZINC000336683788 176620881 /nfs/dbraw/zinc/62/08/81/176620881.db2.gz ZKRLYFZCKNGGGU-VXGBXAGGSA-N 2 0 224.348 2.318 20 0 BEADRP C[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)C1CC1 ZINC000309587804 176838749 /nfs/dbraw/zinc/83/87/49/176838749.db2.gz SPTDZIZTZVRUMA-NSHDSACASA-N 2 0 222.376 2.249 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@H]1[C@H]1CCC[NH2+]1)C1CC1 ZINC000251533381 176897913 /nfs/dbraw/zinc/89/79/13/176897913.db2.gz KKGABOSSRUNFIV-SCUASFONSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@H](c1ccccn1)[N@@H+]1C[C@@H]2CCC[C@@H]([NH3+])[C@@H]2C1 ZINC000228473406 177044217 /nfs/dbraw/zinc/04/42/17/177044217.db2.gz NZZGOCAJVWEUFJ-XJFOESAGSA-N 2 0 245.370 2.202 20 0 BEADRP C[C@H](c1ccccn1)[N@@H+]1CCC[C@@H](CC[NH3+])C1 ZINC000226325932 177044270 /nfs/dbraw/zinc/04/42/70/177044270.db2.gz WWMCKIQIONJJKV-OLZOCXBDSA-N 2 0 233.359 2.203 20 0 BEADRP C[C@H](c1ccncc1)[N@H+](C)CCc1cncn1C ZINC000289505059 177050255 /nfs/dbraw/zinc/05/02/55/177050255.db2.gz DUCNINUYUNMISR-GFCCVEGCSA-N 2 0 244.342 2.051 20 0 BEADRP C[C@H]1CCCCC[N@@H+]1C[C@]1(C)CC[NH2+]C1 ZINC000069945352 177070464 /nfs/dbraw/zinc/07/04/64/177070464.db2.gz QIMBGJFXRMUIGM-QWHCGFSZSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@H]1CCCC[N@@H+]1CCC[NH2+]CC1CC1 ZINC000037118285 177076016 /nfs/dbraw/zinc/07/60/16/177076016.db2.gz HPYDKFSJZGFPJY-LBPRGKRZSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@H]1CCCC[C@@H]1[N@H+](C)CC1CC[NH2+]CC1 ZINC000042610997 177080710 /nfs/dbraw/zinc/08/07/10/177080710.db2.gz JBVPRWCQBUWEBS-JSGCOSHPSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1CCCC[C@H]1[NH2+]CC1CC[NH+](C)CC1 ZINC000044515351 177088584 /nfs/dbraw/zinc/08/85/84/177088584.db2.gz YDMOFCIBMUJTAE-GXTWGEPZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1CC[N@H+](CC[C@@H]2CCCC[NH+]2C)C1 ZINC000336347247 177159897 /nfs/dbraw/zinc/15/98/97/177159897.db2.gz AXBYJNWFTCSNGK-STQMWFEESA-N 2 0 210.365 2.203 20 0 BEADRP C[C@@H]1CCC[C@@H]1C[NH2+][C@@H]1CC[N@H+](C)C[C@@H]1C ZINC000336775790 177234257 /nfs/dbraw/zinc/23/42/57/177234257.db2.gz CRNNJBUSBORSKR-XJFOESAGSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1C[N@@H+](CCCCCCC[NH3+])C[C@H](C)O1 ZINC000020071874 177248115 /nfs/dbraw/zinc/24/81/15/177248115.db2.gz GOROZGHHSNVMQW-BETUJISGSA-N 2 0 228.380 2.005 20 0 BEADRP C[C@H]1C[N@H+](CC[C@@H]2CCC[NH2+]C2)C(C)(C)C1 ZINC000335664602 177254767 /nfs/dbraw/zinc/25/47/67/177254767.db2.gz UIYFUXVTSOJEHF-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1C[NH2+]CC[C@@H]1[NH2+]C1CCC2(CC2)CC1 ZINC000335007600 177284547 /nfs/dbraw/zinc/28/45/47/177284547.db2.gz PARVQYVPHSYBED-AAEUAGOBSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H]1CSC[C@@H]1[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000297611109 177306526 /nfs/dbraw/zinc/30/65/26/177306526.db2.gz VCFGPLKNTMPXFV-GWCFXTLKSA-N 2 0 247.367 2.175 20 0 BEADRP C[C@@H]1C[C@H](C)C[N@@H+](CC[C@@H]2CCC[NH+]2C)C1 ZINC000124637588 177313357 /nfs/dbraw/zinc/31/33/57/177313357.db2.gz HNXRRYUWJZSYEN-MJBXVCDLSA-N 2 0 224.392 2.449 20 0 BEADRP C[C@@H]1C[C@H](C)[N@H+](CC[C@@H]2CCC[NH2+]C2)C1 ZINC000164188390 177317580 /nfs/dbraw/zinc/31/75/80/177317580.db2.gz GIYRGRDOZNJLRL-AGIUHOORSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]1C[C@@H](C[NH+]2Cc3ccccc3C2)CC[NH2+]1 ZINC000235744146 177324360 /nfs/dbraw/zinc/32/43/60/177324360.db2.gz CVOGTYIDIURRIJ-STQMWFEESA-N 2 0 230.355 2.390 20 0 BEADRP C[C@H]1C[C@@H](C[NH2+]Cc2cccs2)CC[NH2+]1 ZINC000235705050 177324956 /nfs/dbraw/zinc/32/49/56/177324956.db2.gz XVMKWCNWBIPQJO-QWRGUYRKSA-N 2 0 224.373 2.226 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@H]2CCC[NH2+]C2)C[C@@H]1C ZINC000251525181 177332246 /nfs/dbraw/zinc/33/22/46/177332246.db2.gz ACNARBXHXSZUKL-RFGFWPKPSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H]1C[C@@H]1C[NH2+]C1CCC(C[NH+](C)C)CC1 ZINC000309452244 177345225 /nfs/dbraw/zinc/34/52/25/177345225.db2.gz MVBUFGZQEFOBOT-RJZJGCCBSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CC2CC[NH2+]CC2)[C@@H](C)C1 ZINC000226367521 177357035 /nfs/dbraw/zinc/35/70/35/177357035.db2.gz VMBMDUPHVVPXNB-MBNYWOFBSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H]1C[C@H]1C[NH2+]CC1(C[NH+](C)C)CCCC1 ZINC000336778622 177381605 /nfs/dbraw/zinc/38/16/05/177381605.db2.gz LUUPQNBYTFZQTO-STQMWFEESA-N 2 0 224.392 2.354 20 0 BEADRP C[C@H]1Cc2ccccc2[C@H]1[NH2+]CCn1ccnc1 ZINC000155679068 177391642 /nfs/dbraw/zinc/39/16/42/177391642.db2.gz WAGKWOUINUJUMC-WFASDCNBSA-N 2 0 241.338 2.406 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CC2(C)CC[NH+](C)CC2)[C@H]1C ZINC000309275794 177432264 /nfs/dbraw/zinc/43/22/64/177432264.db2.gz DSSGMGNLLUGMEJ-FRRDWIJNSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2CC[C@@H](C3CC3)C2)CC[NH2+]1 ZINC000400041237 225345470 /nfs/dbraw/zinc/34/54/70/225345470.db2.gz PANXYSCYJMOLHQ-YRGRVCCFSA-N 2 0 222.376 2.106 20 0 BEADRP C[C@H]1C[C@H]1C[NH+]1CCC([NH+]2CCCC2)CC1 ZINC000488310164 225366840 /nfs/dbraw/zinc/36/68/40/225366840.db2.gz PQCORMYVNHRIFI-STQMWFEESA-N 2 0 222.376 2.203 20 0 BEADRP C[C@H]([NH2+][C@H]1CCCC[C@H]1C)[C@H]1CCC[NH2+]1 ZINC000400368642 226342010 /nfs/dbraw/zinc/34/20/10/226342010.db2.gz GAMKZSUXASMUTL-MROQNXINSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@@H](C)C1)[C@@H]1CCC[NH2+]1 ZINC000400630252 226348173 /nfs/dbraw/zinc/34/81/73/226348173.db2.gz LPLFJCSAWJOUJS-VOAKCMCISA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)C(C)(C)C ZINC000400941003 226352368 /nfs/dbraw/zinc/35/23/68/226352368.db2.gz CVGDWUYQCLWXQT-UMSGYPCISA-N 2 0 224.392 2.399 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)[C@H]1CC1(C)C ZINC000401171449 226353198 /nfs/dbraw/zinc/35/31/98/226353198.db2.gz WXRWJAAEBLVMLT-MEBFFEOJSA-N 2 0 236.403 2.399 20 0 BEADRP Cc1cc(C)cc(C[NH2+][C@H]2CN(C)C[C@@H]2C)c1 ZINC000674913006 487653287 /nfs/dbraw/zinc/65/32/87/487653287.db2.gz UFPHQMPSBYREFB-ZFWWWQNUSA-N 2 0 232.371 2.343 20 0 BEADRP C[C@H](c1ccncc1)[N@@H+]1C[C@@H]2CCC[C@@H]([NH3+])[C@@H]2C1 ZINC000228474606 487655160 /nfs/dbraw/zinc/65/51/60/487655160.db2.gz QMCRWCQNUWMDCQ-FAAHXZRKSA-N 2 0 245.370 2.202 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+]C[C@]2(C)CCCS2)C1 ZINC000087792729 487686644 /nfs/dbraw/zinc/68/66/44/487686644.db2.gz YUTMPNUTEHAENN-OLZOCXBDSA-N 2 0 242.432 2.204 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CC2(C)CC[NH+](C)CC2)CS1 ZINC000226343844 487714366 /nfs/dbraw/zinc/71/43/66/487714366.db2.gz HKDZTSSTQHXRKG-VXGBXAGGSA-N 2 0 242.432 2.202 20 0 BEADRP CC[C@H]1C[C@H]([NH2+]CCC[N@H+](C)C(C)C)CCO1 ZINC000226340024 487714719 /nfs/dbraw/zinc/71/47/19/487714719.db2.gz JIAGANJGGRZTTH-KGLIPLIRSA-N 2 0 242.407 2.264 20 0 BEADRP CC[NH+](CC)CCC[NH2+]C[C@@](C)(CC)OC ZINC000233455088 487716405 /nfs/dbraw/zinc/71/64/05/487716405.db2.gz BPWBGVWSXSAWIV-CYBMUJFWSA-N 2 0 230.396 2.123 20 0 BEADRP CC(C)(CC[N@@H+]1CCC[C@H]([NH3+])C1)C1CC1 ZINC000328573719 487716450 /nfs/dbraw/zinc/71/64/50/487716450.db2.gz WDIRIWGXBIJBOU-LBPRGKRZSA-N 2 0 210.365 2.236 20 0 BEADRP C[NH+](C)C1CCC([NH2+]Cc2ccc(O)cc2)CC1 ZINC000671745247 487719802 /nfs/dbraw/zinc/71/98/02/487719802.db2.gz FCYHTZSZPFDCSB-UHFFFAOYSA-N 2 0 248.370 2.355 20 0 BEADRP CC(C)CC[N@@H+]1CCC[C@@H]([C@H]2CCC[NH2+]2)C1 ZINC000250543448 487734421 /nfs/dbraw/zinc/73/44/21/487734421.db2.gz CHFWAZGVJCVBOG-ZIAGYGMSSA-N 2 0 224.392 2.497 20 0 BEADRP c1cc(N2CC[NH+](CCC3CC3)CC2)cc[nH+]1 ZINC000675500460 487742494 /nfs/dbraw/zinc/74/24/94/487742494.db2.gz VFPRFKAITMBJLZ-UHFFFAOYSA-N 2 0 231.343 2.004 20 0 BEADRP CC[C@](C)(C[NH2+]CCC[NH+]1CCCCC1)OC ZINC000234097638 487760548 /nfs/dbraw/zinc/76/05/48/487760548.db2.gz XWDJAQDFYGCMTG-CQSZACIVSA-N 2 0 242.407 2.267 20 0 BEADRP C[NH+](C)CCC[NH2+][C@@H]1CCCC(C)(C)C1 ZINC000070682648 487796643 /nfs/dbraw/zinc/79/66/43/487796643.db2.gz AGJGKTPBXDKEBA-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP CC[C@H]1C[N@H+](CC2CCCC2)CC[C@H]1[NH3+] ZINC000251784115 487798433 /nfs/dbraw/zinc/79/84/33/487798433.db2.gz NFNSFCFEEKOLCQ-QWHCGFSZSA-N 2 0 210.365 2.236 20 0 BEADRP Cc1cccc(C(C)(C)[NH2+]CCC[NH3+])c1 ZINC000414706226 487819182 /nfs/dbraw/zinc/81/91/82/487819182.db2.gz LCRXQYPPZXJZKI-UHFFFAOYSA-N 2 0 206.333 2.169 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@H](C)C(C)(C)OC)CC1 ZINC000302338180 487818981 /nfs/dbraw/zinc/81/89/81/487818981.db2.gz DUFBFDNCAJOQMH-GFCCVEGCSA-N 2 0 242.407 2.121 20 0 BEADRP COc1cccc([C@@H]2C[C@H](C)C[N@@H+]2CCC[NH3+])c1 ZINC000414740207 487819834 /nfs/dbraw/zinc/81/98/34/487819834.db2.gz KTPNDLRVHIOJJB-WFASDCNBSA-N 2 0 248.370 2.427 20 0 BEADRP Cc1ccc(CCC[NH2+][C@@H]2CCC[C@H]([NH3+])C2)cn1 ZINC000414932893 487830377 /nfs/dbraw/zinc/83/03/77/487830377.db2.gz WDMANDTWGROWHG-LSDHHAIUSA-N 2 0 247.386 2.182 20 0 BEADRP COc1ccsc1C[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000414936642 487831196 /nfs/dbraw/zinc/83/11/96/487831196.db2.gz ZIVLUQQKEGYQKK-ZJUUUORDSA-N 2 0 240.372 2.116 20 0 BEADRP CC(C)(C[NH2+]CCC[NH3+])Cc1ccccc1 ZINC000415084289 487836798 /nfs/dbraw/zinc/83/67/98/487836798.db2.gz ORZUHIXLUQRGHR-UHFFFAOYSA-N 2 0 220.360 2.194 20 0 BEADRP C[C@@H](C[NH2+]CCC[NH3+])c1ccc(F)cc1F ZINC000415099672 487837154 /nfs/dbraw/zinc/83/71/54/487837154.db2.gz GYIATNFOQMWSQW-VIFPVBQESA-N 2 0 228.286 2.007 20 0 BEADRP C[C@@H]1c2ccc(F)cc2CCN1CCC[NH3+] ZINC000666642772 487847134 /nfs/dbraw/zinc/84/71/34/487847134.db2.gz OKNXDQGJHUSGCS-SNVBAGLBSA-N 2 0 222.307 2.094 20 0 BEADRP [NH3+]CCC[NH2+]Cc1ccccc1OC1CCCC1 ZINC000437789634 487848917 /nfs/dbraw/zinc/84/89/17/487848917.db2.gz RVNBWBLBIURIGT-UHFFFAOYSA-N 2 0 248.370 2.446 20 0 BEADRP c1cc2cc(CN[C@H]3CCC[NH2+]C3)ccc2cn1 ZINC000666814497 487867548 /nfs/dbraw/zinc/86/75/48/487867548.db2.gz CWYRXQICSDRAJK-HNNXBMFYSA-N 2 0 241.338 2.076 20 0 BEADRP CC(C)([NH3+])C[NH2+]Cc1cccc2cnccc21 ZINC000666751885 487872011 /nfs/dbraw/zinc/87/20/11/487872011.db2.gz RENNHGZDWWQBHT-UHFFFAOYSA-N 2 0 229.327 2.062 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC[NH2+]C[C@H]1C)C(C)(C)C ZINC000379943462 487874631 /nfs/dbraw/zinc/87/46/31/487874631.db2.gz CPMSHDHIYYEHRC-UTUOFQBUSA-N 2 0 212.381 2.256 20 0 BEADRP CC(C)(C[NH2+]C[C@@H]([NH3+])C1CC1)c1ccccc1 ZINC000666834260 487883171 /nfs/dbraw/zinc/88/31/71/487883171.db2.gz LOPSKEFVNJAJAE-CQSZACIVSA-N 2 0 232.371 2.291 20 0 BEADRP CC1C[NH+](Cc2ccc(OCC[NH+](C)C)cc2)C1 ZINC000670270627 487886861 /nfs/dbraw/zinc/88/68/61/487886861.db2.gz CRXKVPSDNWYZAG-UHFFFAOYSA-N 2 0 248.370 2.079 20 0 BEADRP C[C@@H](CC[NH3+])[NH2+]Cc1ccc2cnccc2c1 ZINC000666833204 487888082 /nfs/dbraw/zinc/88/80/82/487888082.db2.gz QRPMQJLHHAGAPT-NSHDSACASA-N 2 0 229.327 2.062 20 0 BEADRP COCCC1(C[NH2+][C@H]2CCC[C@H]([NH3+])C2)CCC1 ZINC000666853122 487890729 /nfs/dbraw/zinc/89/07/29/487890729.db2.gz MXKPQFPIBHHGQE-STQMWFEESA-N 2 0 240.391 2.053 20 0 BEADRP C[C@@H](C[NH2+][C@H]1CC[NH2+][C@H](C)C1)C(C)(C)C ZINC000666874264 487895662 /nfs/dbraw/zinc/89/56/62/487895662.db2.gz VZACDGQTFBRLQF-TUAOUCFPSA-N 2 0 212.381 2.399 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+]C[C@H](C)C(C)(C)C ZINC000666878585 487896014 /nfs/dbraw/zinc/89/60/14/487896014.db2.gz OYQOWEDPXLOFNO-WDEREUQCSA-N 2 0 200.370 2.256 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CC23CC[NH2+]CC3)cc1 ZINC000666950685 487913334 /nfs/dbraw/zinc/91/33/34/487913334.db2.gz BAPMGEBOPPZRPA-AWEZNQCLSA-N 2 0 230.355 2.227 20 0 BEADRP C[C@@H]1CCC[N@H+](CC[C@@H]2CCCO2)[C@H]1CC[NH3+] ZINC000404296875 487916973 /nfs/dbraw/zinc/91/69/73/487916973.db2.gz OBYNMRCZALQCJE-RDBSUJKOSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@@H]1CCC[N@H+](Cc2cccc(O)c2)[C@@H]1CC[NH3+] ZINC000404294060 487917049 /nfs/dbraw/zinc/91/70/49/487917049.db2.gz MROAIQNFCHFBPZ-IUODEOHRSA-N 2 0 248.370 2.342 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCC(C)(F)F)CN1C1CC1 ZINC000357710362 487917253 /nfs/dbraw/zinc/91/72/53/487917253.db2.gz OOXMTNZJJNAXMA-ZJUUUORDSA-N 2 0 232.318 2.247 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[C@@H](C[NH3+])C1)C(C)(C)C ZINC000666964031 487920162 /nfs/dbraw/zinc/92/01/62/487920162.db2.gz CSUHJNXSLXWQBD-IJLUTSLNSA-N 2 0 212.381 2.386 20 0 BEADRP C([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)[C@H]1CCSC1 ZINC000666993957 487923416 /nfs/dbraw/zinc/92/34/16/487923416.db2.gz WMIKMHCQNXIAOZ-VXGBXAGGSA-N 2 0 240.416 2.004 20 0 BEADRP C([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)[C@@H]1CCSC1 ZINC000666993955 487923726 /nfs/dbraw/zinc/92/37/26/487923726.db2.gz WMIKMHCQNXIAOZ-NWDGAFQWSA-N 2 0 240.416 2.004 20 0 BEADRP C1CC2(C1)C[C@H]([NH2+][C@H]1CCCSC1)CC[NH2+]2 ZINC000666995662 487924533 /nfs/dbraw/zinc/92/45/33/487924533.db2.gz VPUHEODVETWDBB-NEPJUHHUSA-N 2 0 240.416 2.146 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000666995574 487924548 /nfs/dbraw/zinc/92/45/48/487924548.db2.gz SHPPVWJEGYJTOH-UPJWGTAASA-N 2 0 222.376 2.439 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)C1 ZINC000666995313 487924676 /nfs/dbraw/zinc/92/46/76/487924676.db2.gz JZCIDWIAWPSZJL-JHJVBQTASA-N 2 0 222.376 2.439 20 0 BEADRP C[C@@H]([NH3+])CN1CCc2ccc(F)cc2[C@@H](C)C1 ZINC000652363294 487933292 /nfs/dbraw/zinc/93/32/92/487933292.db2.gz ACBPZOJQYCIBOG-WDEREUQCSA-N 2 0 236.334 2.135 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCC[C@@H]2C[C@@H]21)C1CC[NH+](C)CC1 ZINC000396445557 487933298 /nfs/dbraw/zinc/93/32/98/487933298.db2.gz DKQLUYHHQOMBBZ-REBRKWNGSA-N 2 0 236.403 2.495 20 0 BEADRP CC1(C)CCC[C@@H](C[NH2+][C@@H]2[C@H]3C[NH2+]C[C@H]32)C1 ZINC000560973652 322993760 /nfs/dbraw/zinc/99/37/60/322993760.db2.gz CIMHUOINLYVBNX-NDBYEHHHSA-N 2 0 222.376 2.010 20 0 BEADRP CC[C@@H](C)N(C)CC[NH2+][C@H]1C[C@@H](C)O[C@@H](C)C1 ZINC000562518993 323022689 /nfs/dbraw/zinc/02/26/89/323022689.db2.gz SXECNNROCKQDSX-MQYQWHSLSA-N 2 0 242.407 2.262 20 0 BEADRP C[NH+]1CCC(C)(C[NH2+][C@@H]2CCC[C@H]3C[C@H]32)CC1 ZINC000302633693 323027506 /nfs/dbraw/zinc/02/75/06/323027506.db2.gz DJNZQBJFIXTRPO-BFHYXJOUSA-N 2 0 236.403 2.497 20 0 BEADRP C[NH+]1CCC(C)(C[NH2+][C@H]2CCC[C@H]3C[C@H]32)CC1 ZINC000302633702 323027541 /nfs/dbraw/zinc/02/75/41/323027541.db2.gz DJNZQBJFIXTRPO-MJBXVCDLSA-N 2 0 236.403 2.497 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H](C)c1cccc(F)c1 ZINC000562956184 323034935 /nfs/dbraw/zinc/03/49/35/323034935.db2.gz LGVMQXNBQSVPJI-LLVKDONJSA-N 2 0 224.323 2.476 20 0 BEADRP C[NH+](C)C1CC([NH2+]C[C@H]2CC=CCC2)C1 ZINC000569987608 323046708 /nfs/dbraw/zinc/04/67/08/323046708.db2.gz CEKBWNBKPIHXOH-HIFPTAJRSA-N 2 0 208.349 2.025 20 0 BEADRP C[C@H](Cc1ccc(O)cc1)[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000570107601 323050229 /nfs/dbraw/zinc/05/02/29/323050229.db2.gz XURHFGCJIMBPDJ-KWCYVHTRSA-N 2 0 248.370 2.183 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C[C@H]2CCCC2(F)F)CC[N@@H+]1C ZINC000394491617 323055469 /nfs/dbraw/zinc/05/54/69/323055469.db2.gz CPDFKCAMEVZNRW-UTUOFQBUSA-N 2 0 246.345 2.494 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]Cc2cnc3n2CCCC3)[C@H]1C ZINC000570775943 323069825 /nfs/dbraw/zinc/06/98/25/323069825.db2.gz NZASTMZPOYDQIK-NTZNESFSSA-N 2 0 233.359 2.354 20 0 BEADRP Cc1ccc(C[NH2+][C@@H](C)CCCC[NH3+])nc1C ZINC000314200227 323080695 /nfs/dbraw/zinc/08/06/95/323080695.db2.gz RBOLJJIDCORJLV-LBPRGKRZSA-N 2 0 235.375 2.306 20 0 BEADRP Cc1ccccc1OCCC[NH+]1CCC([NH3+])CC1 ZINC000020266874 323084668 /nfs/dbraw/zinc/08/46/68/323084668.db2.gz OTFPXEBEOIEBTG-UHFFFAOYSA-N 2 0 248.370 2.187 20 0 BEADRP CCC1(C[NH2+][C@H]2C[C@H]([NH3+])c3ccccc32)COC1 ZINC000393961072 323098938 /nfs/dbraw/zinc/09/89/38/323098938.db2.gz DYKJLIPAHIAQCP-KBPBESRZSA-N 2 0 246.354 2.147 20 0 BEADRP Cc1cnc([C@H](C)[NH+]2CCC(CC[NH3+])CC2)o1 ZINC000563275222 323107457 /nfs/dbraw/zinc/10/74/57/323107457.db2.gz JMDGWZJOQMXSFM-NSHDSACASA-N 2 0 237.347 2.105 20 0 BEADRP CC(C)[C@@H]([NH2+][C@H]1CC[NH2+][C@H](C)C1)C1CC1 ZINC000563348529 323119921 /nfs/dbraw/zinc/11/99/21/323119921.db2.gz BTFIMBDCIPTINL-KGYLQXTDSA-N 2 0 210.365 2.151 20 0 BEADRP C[C@@H](C[NH2+][C@@H]1CCC[C@H]2C[C@H]21)C[NH+]1CCCC1 ZINC000408510380 323120524 /nfs/dbraw/zinc/12/05/24/323120524.db2.gz NFIWDWRFZSIXOJ-BYNSBNAKSA-N 2 0 236.403 2.497 20 0 BEADRP CCOCCC1(C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)CC1 ZINC000563423084 323124289 /nfs/dbraw/zinc/12/42/89/323124289.db2.gz DBIKTNWZZXFJIB-QWHCGFSZSA-N 2 0 240.391 2.053 20 0 BEADRP Nc1ccc2c(c1)CC[C@@H]2[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000563430467 323124983 /nfs/dbraw/zinc/12/49/83/323124983.db2.gz CKHSPLSZLODUBH-KYOSRNDESA-N 2 0 245.370 2.116 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CC[C@H]3C[C@H]3C2)CC[N@@H+]1C ZINC000403838011 323128251 /nfs/dbraw/zinc/12/82/51/323128251.db2.gz OQUSEYLSOIFDGP-UXXRCYHCSA-N 2 0 236.403 2.495 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+]CCC[N@H+](C)CCOC ZINC000531940477 323156034 /nfs/dbraw/zinc/15/60/34/323156034.db2.gz ABPVOGTWFPBYOT-KGLIPLIRSA-N 2 0 242.407 2.123 20 0 BEADRP CC[C@@H]([NH2+]CCCC[NH+](C)C)C1CCOCC1 ZINC000531963253 323158794 /nfs/dbraw/zinc/15/87/94/323158794.db2.gz GJTNTRPSJONUNV-CQSZACIVSA-N 2 0 242.407 2.123 20 0 BEADRP CCCCC[N@@H+]1CC[C@H](c2nccn2C)C1 ZINC000541892866 323162071 /nfs/dbraw/zinc/16/20/71/323162071.db2.gz ODQDUIWEYJDMIC-LBPRGKRZSA-N 2 0 221.348 2.400 20 0 BEADRP C[C@H](CC(C)(C)C)[NH2+][C@@H]1CC[NH2+]C[C@H]1C ZINC000395136324 323188855 /nfs/dbraw/zinc/18/88/55/323188855.db2.gz RTLRVQBKVZSEJH-IJLUTSLNSA-N 2 0 212.381 2.399 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]CC[C@H]1CC=CCC1 ZINC000530217073 323217153 /nfs/dbraw/zinc/21/71/53/323217153.db2.gz FCFVPJNMQIDJIK-MELADBBJSA-N 2 0 222.376 2.450 20 0 BEADRP C([NH2+][C@@H](C1CC1)C1CCC1)[C@@H]1CCC[NH2+]C1 ZINC000324788292 323282731 /nfs/dbraw/zinc/28/27/31/323282731.db2.gz IYKBDOIRJGNIOF-BXUZGUMPSA-N 2 0 222.376 2.154 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[NH2+]C[C@H]1C)C1CCC1 ZINC000324908067 323301688 /nfs/dbraw/zinc/30/16/88/323301688.db2.gz ITUBURVQVSBEJV-KGYLQXTDSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H]1CCC[NH2+]C1)C1CCC1 ZINC000324921613 323304210 /nfs/dbraw/zinc/30/42/10/323304210.db2.gz LLTHUWYZQWHDTO-DGCLKSJQSA-N 2 0 210.365 2.154 20 0 BEADRP COC[C@H](C)[NH2+]CCC[NH+](C(C)C)C(C)C ZINC000122290826 324033774 /nfs/dbraw/zinc/03/37/74/324033774.db2.gz HJFMNOAPAXUHQS-ZDUSSCGKSA-N 2 0 230.396 2.120 20 0 BEADRP CC1(C)CC(C[NH2+][C@H]2CC[NH2+]CC2(C)C)C1 ZINC000530225815 324546871 /nfs/dbraw/zinc/54/68/71/324546871.db2.gz NTONHGNNKRROPY-LBPRGKRZSA-N 2 0 224.392 2.400 20 0 BEADRP CO[C@H](C)C[NH+]1CCC(C[N@H+](C)C(C)C)CC1 ZINC000542923895 325063564 /nfs/dbraw/zinc/06/35/64/325063564.db2.gz MTXBRWPBBRMWLP-CYBMUJFWSA-N 2 0 242.407 2.074 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H](C)C1CCOCC1 ZINC000131472587 325154784 /nfs/dbraw/zinc/15/47/84/325154784.db2.gz PJJHNFWGCKUZLM-CYBMUJFWSA-N 2 0 242.407 2.123 20 0 BEADRP COCCCC[N@H+](C)CC[C@@H]1CCCC[NH+]1C ZINC000075860426 325318251 /nfs/dbraw/zinc/31/82/51/325318251.db2.gz XOEFTJGPHATTAO-AWEZNQCLSA-N 2 0 242.407 2.219 20 0 BEADRP CC[NH+](CC)C[C@@H]1CC[N@H+](CCCCOC)C1 ZINC000076002680 325324872 /nfs/dbraw/zinc/32/48/72/325324872.db2.gz KDTMMKNZZKWSAT-AWEZNQCLSA-N 2 0 242.407 2.077 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H](C)CSC)CC1 ZINC000133932440 325332027 /nfs/dbraw/zinc/33/20/27/325332027.db2.gz YNCIIFORJGKJGO-LLVKDONJSA-N 2 0 230.421 2.202 20 0 BEADRP CC[C@@H](C)[NH2+]CC1(C[NH+](C)C)CCCC1 ZINC000135016014 325388832 /nfs/dbraw/zinc/38/88/32/325388832.db2.gz ZCUBYCULMWVBKO-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H]([NH2+]CC1(C[NH+](C)C)CCCC1)C1CC1 ZINC000135016080 325388837 /nfs/dbraw/zinc/38/88/37/325388837.db2.gz KGKMMOLCOMTWLN-GFCCVEGCSA-N 2 0 224.392 2.497 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@H](C)C(C)C)CC1 ZINC000081047636 325489706 /nfs/dbraw/zinc/48/97/06/325489706.db2.gz WDJYQAUNLCDNTP-LBPRGKRZSA-N 2 0 212.381 2.352 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H]2CCCC[C@H]2F)C1 ZINC000565313675 325895941 /nfs/dbraw/zinc/89/59/41/325895941.db2.gz MNCABZDSHFMZSD-WRWGMCAJSA-N 2 0 214.328 2.127 20 0 BEADRP COC[C@@H](C)C[NH2+]Cc1ccc([C@H](C)[NH3+])cc1 ZINC000565762695 325952954 /nfs/dbraw/zinc/95/29/54/325952954.db2.gz CXBKYTPNCPKYKJ-RYUDHWBXSA-N 2 0 236.359 2.078 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCC[C@@H]([NH3+])C1)C(F)(F)F ZINC000566481335 326051055 /nfs/dbraw/zinc/05/10/55/326051055.db2.gz HFOXFYKQQASXJW-IWSPIJDZSA-N 2 0 224.270 2.044 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCC[C@@H]([NH3+])C1)Oc1ccccc1 ZINC000567249497 326150509 /nfs/dbraw/zinc/15/05/09/326150509.db2.gz ICYIUSVSDIRJMI-MGPQQGTHSA-N 2 0 248.370 2.313 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H](C1CC1)C1CCC1 ZINC000567462610 326197493 /nfs/dbraw/zinc/19/74/93/326197493.db2.gz WQWKOLOJQFSMHA-ZDUSSCGKSA-N 2 0 210.365 2.154 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H]2CCCCC[C@@H]2[NH3+])o1 ZINC000567579781 326221333 /nfs/dbraw/zinc/22/13/33/326221333.db2.gz CBTSXSXGCOWFJV-UONOGXRCSA-N 2 0 236.359 2.380 20 0 BEADRP COc1ccc(C[NH2+][C@@H](C)CCC[NH3+])c(C)c1 ZINC000567646056 326237271 /nfs/dbraw/zinc/23/72/71/326237271.db2.gz RJZZNBSNBFWGFI-LBPRGKRZSA-N 2 0 236.359 2.221 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+][C@@H](C)C[C@@H](C)[NH3+])CO2 ZINC000567648432 326238530 /nfs/dbraw/zinc/23/85/30/326238530.db2.gz QJVJSFRGARDJIB-NTZNESFSSA-N 2 0 234.343 2.144 20 0 BEADRP Cc1ccc(F)c(C[NH2+][C@@H](C)C[C@@H](C)[NH3+])c1 ZINC000567871138 326274205 /nfs/dbraw/zinc/27/42/05/326274205.db2.gz SBNPFWMKQISYAS-MNOVXSKESA-N 2 0 224.323 2.350 20 0 BEADRP CC[C@H](C)[C@@H](C)[NH2+]CCCC[NH+]1CCOCC1 ZINC000158739643 326341336 /nfs/dbraw/zinc/34/13/36/326341336.db2.gz GFVOZJSLPNZGNM-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP CC[NH2+]CCC[NH2+]C1C[C@@H](C)C[C@H](C)C1 ZINC000568617077 326367958 /nfs/dbraw/zinc/36/79/58/326367958.db2.gz BDBWUSZJBPOXGS-RYUDHWBXSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H](c1ccccn1)N1[C@@H]2CC[C@H]1CC[N@@H+](C)C2 ZINC000568828151 326378176 /nfs/dbraw/zinc/37/81/76/326378176.db2.gz PMLBDHWQKPPUSD-HZSPNIEDSA-N 2 0 245.370 2.311 20 0 BEADRP C[C@@H](CCC(F)(F)F)[NH2+]CC1CC[NH2+]CC1 ZINC000568974322 326384157 /nfs/dbraw/zinc/38/41/57/326384157.db2.gz CTNPDPFNCIQMAR-VIFPVBQESA-N 2 0 238.297 2.307 20 0 BEADRP CCC(C)(C)[C@@H](C)[NH2+]CCC[NH+](C)C ZINC000569190879 326394357 /nfs/dbraw/zinc/39/43/57/326394357.db2.gz IMFOITSKWLLPCY-LLVKDONJSA-N 2 0 200.370 2.352 20 0 BEADRP C1=C(C[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)CCC1 ZINC000401027251 488000176 /nfs/dbraw/zinc/00/01/76/488000176.db2.gz KOZRYILJPMTYTG-KBPBESRZSA-N 2 0 220.360 2.313 20 0 BEADRP C1=C(C[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)CCC1 ZINC000401027254 488000196 /nfs/dbraw/zinc/00/01/96/488000196.db2.gz KOZRYILJPMTYTG-UONOGXRCSA-N 2 0 220.360 2.313 20 0 BEADRP CC(C)=CCC[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000400962600 488011912 /nfs/dbraw/zinc/01/19/12/488011912.db2.gz AZVQTONEWKUFIA-HZSPNIEDSA-N 2 0 222.376 2.320 20 0 BEADRP CC[NH+]1CCC([NH2+]CC2=CCCC2)CC1 ZINC000401144773 488015377 /nfs/dbraw/zinc/01/53/77/488015377.db2.gz IIDQRHJLQLVTAT-UHFFFAOYSA-N 2 0 208.349 2.171 20 0 BEADRP C[C@H]1C[C@H]([NH3+])CC[N@@H+]1CCOCc1ccccc1 ZINC000309705104 488034570 /nfs/dbraw/zinc/03/45/70/488034570.db2.gz HLCFKZKLZJRKSF-DZGCQCFKSA-N 2 0 248.370 2.015 20 0 BEADRP C[C@H]1C[C@@H]([NH3+])CC[N@@H+]1CCOCc1ccccc1 ZINC000309705109 488034638 /nfs/dbraw/zinc/03/46/38/488034638.db2.gz HLCFKZKLZJRKSF-ZFWWWQNUSA-N 2 0 248.370 2.015 20 0 BEADRP Cc1ncc(CN(C)Cc2ccoc2C)n1C ZINC000667551620 488042308 /nfs/dbraw/zinc/04/23/08/488042308.db2.gz RYHUNKOIWFHVBQ-UHFFFAOYSA-N 2 0 233.315 2.262 20 0 BEADRP C[C@@H]1CC[N@H+](Cc2ccnn2-c2ccncc2)C1 ZINC000667553811 488043484 /nfs/dbraw/zinc/04/34/84/488043484.db2.gz AIOXIJTVJLBOCT-GFCCVEGCSA-N 2 0 242.326 2.109 20 0 BEADRP C[C@@H]([NH2+]CC1CC(F)(F)C1)C1CC[NH+](C)CC1 ZINC000394729772 488048227 /nfs/dbraw/zinc/04/82/27/488048227.db2.gz KFORILKNNIZCAM-SNVBAGLBSA-N 2 0 246.345 2.352 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C2CCCC2)CC1(C)C ZINC000084477027 488053854 /nfs/dbraw/zinc/05/38/54/488053854.db2.gz VVCSDTXYKGFAGZ-LBPRGKRZSA-N 2 0 210.365 2.391 20 0 BEADRP COc1c(C)cccc1C[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000656200809 488067078 /nfs/dbraw/zinc/06/70/78/488067078.db2.gz QZEJWNANYCYLTA-RYUDHWBXSA-N 2 0 236.359 2.219 20 0 BEADRP Cc1cc(C[N@H+](C)CCC[NH3+])c2ccccc2n1 ZINC000092347455 488090147 /nfs/dbraw/zinc/09/01/47/488090147.db2.gz QVOWXKBQYHQNND-UHFFFAOYSA-N 2 0 243.354 2.324 20 0 BEADRP CC[C@@]1([NH2+]CCC[NH+]2CCCCC2)CCOC1 ZINC000683043034 488102959 /nfs/dbraw/zinc/10/29/59/488102959.db2.gz JXEAKZDGDHPJOW-CQSZACIVSA-N 2 0 240.391 2.021 20 0 BEADRP [NH3+]CCC[NH+]1CCC(c2ccccc2F)CC1 ZINC000057527904 488106042 /nfs/dbraw/zinc/10/60/42/488106042.db2.gz COUJNOQEBNUSMI-UHFFFAOYSA-N 2 0 236.334 2.354 20 0 BEADRP Cc1ncc([C@@H](C)[NH2+]CCC2(C[NH3+])CC2)s1 ZINC000650745882 488119496 /nfs/dbraw/zinc/11/94/96/488119496.db2.gz QBWSBSHGKKQIRG-SECBINFHSA-N 2 0 239.388 2.231 20 0 BEADRP Cc1ncc([C@H](C)[NH2+]CCC2(C[NH3+])CC2)s1 ZINC000650745883 488119551 /nfs/dbraw/zinc/11/95/51/488119551.db2.gz QBWSBSHGKKQIRG-VIFPVBQESA-N 2 0 239.388 2.231 20 0 BEADRP C[C@@H]1C[C@H]([NH3+])CC[N@@H+]1C[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000403375565 488122009 /nfs/dbraw/zinc/12/20/09/488122009.db2.gz KEHPKZWJWUMXPE-XGFWRYKXSA-N 2 0 222.376 2.234 20 0 BEADRP CC(C)([NH3+])C[NH2+]CC(C)(C)c1ccccc1 ZINC000258677497 488127281 /nfs/dbraw/zinc/12/72/81/488127281.db2.gz ANTFBZUACJERGP-UHFFFAOYSA-N 2 0 220.360 2.291 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H]2CC[C@@H]3C[C@@H]3C2)C1 ZINC000403592340 488128395 /nfs/dbraw/zinc/12/83/95/488128395.db2.gz DLLRZCZSIVOGNU-NJMOYASZSA-N 2 0 208.349 2.035 20 0 BEADRP CCc1ccc(C[NH2+][C@@H]2CCC[NH2+]CC2)cc1 ZINC000234144018 488129442 /nfs/dbraw/zinc/12/94/42/488129442.db2.gz TVPSGQNYXTYJRG-OAHLLOKOSA-N 2 0 232.371 2.481 20 0 BEADRP CC[C@@H]1C[N@H+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC[C@H]1[NH3+] ZINC000403627704 488129523 /nfs/dbraw/zinc/12/95/23/488129523.db2.gz MITJONIZFSLLQQ-ARILJUKYSA-N 2 0 236.403 2.482 20 0 BEADRP C[NH2+]CC1CC[NH+](C[C@@H]2CC[C@H]3C[C@H]3C2)CC1 ZINC000403696124 488132150 /nfs/dbraw/zinc/13/21/50/488132150.db2.gz BDHYBZBEJSWDPW-QLFBSQMISA-N 2 0 236.403 2.354 20 0 BEADRP CCOc1ccc(C[N@H+](C)C[C@@H]2CC[NH2+]C2)cc1 ZINC000258778964 488133243 /nfs/dbraw/zinc/13/32/43/488133243.db2.gz BEWAAKBGSLTVEE-CQSZACIVSA-N 2 0 248.370 2.127 20 0 BEADRP CC(C)[N@@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000662294306 487542211 /nfs/dbraw/zinc/54/22/11/487542211.db2.gz LFWKSGBQCJRQJC-CYBMUJFWSA-N 2 0 210.365 2.106 20 0 BEADRP C[NH+]1CCC([C@H]2CC[N@H+](CC3(F)CC3)C2)CC1 ZINC000685462853 487530627 /nfs/dbraw/zinc/53/06/27/487530627.db2.gz UAJIXMIBCRQEIB-ZDUSSCGKSA-N 2 0 240.366 2.152 20 0 BEADRP C[NH+]1CCC([C@@H]2CC[N@H+](CC3(F)CC3)C2)CC1 ZINC000685462852 487530366 /nfs/dbraw/zinc/53/03/66/487530366.db2.gz UAJIXMIBCRQEIB-CYBMUJFWSA-N 2 0 240.366 2.152 20 0 BEADRP CCc1ccccc1CN(CC)CC[NH3+] ZINC000231819390 487477320 /nfs/dbraw/zinc/47/73/20/487477320.db2.gz STPCMZSWDODKBL-UHFFFAOYSA-N 2 0 206.333 2.030 20 0 BEADRP CCN(CC[NH3+])Cc1ccccc1SC ZINC000231818976 487477367 /nfs/dbraw/zinc/47/73/67/487477367.db2.gz PCJMTRFLASUBET-UHFFFAOYSA-N 2 0 224.373 2.189 20 0 BEADRP CCN(CC[NH3+])Cc1ccc(Cl)c(C)c1 ZINC000231819407 487477488 /nfs/dbraw/zinc/47/74/88/487477488.db2.gz FINITUDWJJBBOW-UHFFFAOYSA-N 2 0 226.751 2.429 20 0 BEADRP C[C@H](CC[NH3+])[NH2+]CC(C)(C)c1ccccc1 ZINC000220521055 487513692 /nfs/dbraw/zinc/51/36/92/487513692.db2.gz TUQSWORRRBRNEI-GFCCVEGCSA-N 2 0 220.360 2.291 20 0 BEADRP C[N@@H+]1CCC[C@H](CC[NH2+][C@H]2CCC[C@@H]3C[C@@H]32)C1 ZINC000668236711 487518602 /nfs/dbraw/zinc/51/86/02/487518602.db2.gz UOSBEYXVALMPSV-KBXIAJHMSA-N 2 0 236.403 2.497 20 0 BEADRP CN(Cc1ccc(F)c(F)c1)C[C@@H]1CC[NH2+]C1 ZINC000259033018 488147720 /nfs/dbraw/zinc/14/77/20/488147720.db2.gz ZUGJJVKYLVYADI-LLVKDONJSA-N 2 0 240.297 2.006 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]Cc2cccc3c2NCC3)C1 ZINC000334849099 487573526 /nfs/dbraw/zinc/57/35/26/487573526.db2.gz VDIVYAJWHMIKGE-UONOGXRCSA-N 2 0 245.370 2.014 20 0 BEADRP CC[C@H](C)CC[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000394413137 487679370 /nfs/dbraw/zinc/67/93/70/487679370.db2.gz RNQDJJQAYLLJBD-YNEHKIRRSA-N 2 0 212.381 2.495 20 0 BEADRP C(=C\c1ccccc1)\CC[NH+]1C[C@@H]2C[NH2+]C[C@H]2C1 ZINC000323665575 487799608 /nfs/dbraw/zinc/79/96/08/487799608.db2.gz DMKRXWINOLZRMX-YDULJECNSA-N 2 0 242.366 2.241 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCC[C@H]([C@H]2CCC[NH2+]2)C1 ZINC000252417671 487824060 /nfs/dbraw/zinc/82/40/60/487824060.db2.gz SUSIWNCPSNUWKN-MELADBBJSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]CCOCC[NH+](C)C)CC1 ZINC000235269637 488134204 /nfs/dbraw/zinc/13/42/04/488134204.db2.gz ZEQBXCGKKDZRQM-KGLIPLIRSA-N 2 0 242.407 2.123 20 0 BEADRP c1cc(C[NH2+]C2CC=CC2)n(-c2cc[nH+]cc2)n1 ZINC000667907790 488153324 /nfs/dbraw/zinc/15/33/24/488153324.db2.gz ZQOWBICUTVKVTH-UHFFFAOYSA-N 2 0 240.310 2.076 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CCC[N@H+](CCC2CCC2)C1 ZINC000398799009 488224591 /nfs/dbraw/zinc/22/45/91/488224591.db2.gz NDJLOEGAYJAMKA-WCQYABFASA-N 2 0 210.365 2.236 20 0 BEADRP C[C@@H]([NH3+])[C@H]1CCC[N@H+](CCC2CCC2)C1 ZINC000398799010 488224718 /nfs/dbraw/zinc/22/47/18/488224718.db2.gz NDJLOEGAYJAMKA-YPMHNXCESA-N 2 0 210.365 2.236 20 0 BEADRP [NH3+]CCCOC1CC[NH+](CCC2CCC2)CC1 ZINC000398940103 488225213 /nfs/dbraw/zinc/22/52/13/488225213.db2.gz VSWNQONOWINJBM-UHFFFAOYSA-N 2 0 240.391 2.006 20 0 BEADRP C/C(=C/c1ccccc1)C[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC000678343290 488243179 /nfs/dbraw/zinc/24/31/79/488243179.db2.gz PBPJUZAWZYWQDZ-MXYRBXQYSA-N 2 0 242.366 2.241 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@H]2CCC(F)(F)C2)[C@@H](C)C1 ZINC000679073688 488306140 /nfs/dbraw/zinc/30/61/40/488306140.db2.gz NFROUMNEVSRKOK-SRVKXCTJSA-N 2 0 246.345 2.494 20 0 BEADRP Cc1cccc(CCC[NH+]2C[C@@H]3C[NH2+]C[C@H]3C2)c1 ZINC000679214956 488317315 /nfs/dbraw/zinc/31/73/15/488317315.db2.gz VXEIWOGBXQTGCZ-HOTGVXAUSA-N 2 0 244.382 2.079 20 0 BEADRP C1=CCC([NH2+]C2CC[NH+](CC3CC3)CC2)C1 ZINC000122001958 490117929 /nfs/dbraw/zinc/11/79/29/490117929.db2.gz XKJIJFHCHATGQA-UHFFFAOYSA-N 2 0 220.360 2.169 20 0 BEADRP C[NH+](C)CCC[NH2+]Cc1cccc2c1CCC2 ZINC000651666520 490129436 /nfs/dbraw/zinc/12/94/36/490129436.db2.gz FUKVSEPLAZHQIY-UHFFFAOYSA-N 2 0 232.371 2.217 20 0 BEADRP C[N@@H+]1CCC[C@@H](CC[NH2+]CC2(C)CCC2)C1 ZINC000459726324 490132880 /nfs/dbraw/zinc/13/28/80/490132880.db2.gz BQMLYWFNXLRPPQ-ZDUSSCGKSA-N 2 0 224.392 2.498 20 0 BEADRP c1oc2ccccc2c1C[NH+]1C[C@H]2C[NH2+]C[C@@H]2C1 ZINC000131044142 490471068 /nfs/dbraw/zinc/47/10/68/490471068.db2.gz AYMKZOJLWSBREJ-VXGBXAGGSA-N 2 0 242.322 2.084 20 0 BEADRP C(C1CC1)[NH+]1CCC([NH2+][C@H]2[C@@H]3CCC[C@@H]32)CC1 ZINC000668669442 490496971 /nfs/dbraw/zinc/49/69/71/490496971.db2.gz SXWKYFOUWLVQIB-FICVDOATSA-N 2 0 234.387 2.249 20 0 BEADRP C[C@]1(C[NH3+])CC[N@H+](C[C@H]2CCC(F)(F)C2)C1 ZINC000300802358 490569118 /nfs/dbraw/zinc/56/91/18/490569118.db2.gz DCTPNDQNNGXZQK-WDEREUQCSA-N 2 0 232.318 2.093 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH+](CC)CC ZINC000077951820 490618148 /nfs/dbraw/zinc/61/81/48/490618148.db2.gz XMBQTWCKXSGBGX-GFCCVEGCSA-N 2 0 200.370 2.449 20 0 BEADRP C[C@H]([NH2+]CC1(C)CC1)C1CC[NH+](C)CC1 ZINC000222192420 490619871 /nfs/dbraw/zinc/61/98/71/490619871.db2.gz JJSXGTMTZSPHIU-NSHDSACASA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@H](C)[N@H+](CC)CCC1CC[NH2+]CC1 ZINC000037113338 491078619 /nfs/dbraw/zinc/07/86/19/491078619.db2.gz TVDVLKIQNXTURS-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]CCCc1ccco1 ZINC000665282902 491107935 /nfs/dbraw/zinc/10/79/35/491107935.db2.gz DORVYRBLNKTLGN-TZMCWYRMSA-N 2 0 236.359 2.190 20 0 BEADRP CC[C@H](C)CC[NH2+]C1CC[NH+](CC)CC1 ZINC000394449127 491111256 /nfs/dbraw/zinc/11/12/56/491111256.db2.gz KUHYVCMOMCHWKA-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP CCC[NH2+]CC[NH2+][C@@H]1CC[C@H](C)C[C@@H]1C ZINC000414862856 491111402 /nfs/dbraw/zinc/11/14/02/491111402.db2.gz BCFVMNUQTCHANT-RWMBFGLXSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H]([NH2+]CC1(C)CCC1)C1CC[NH+](C)CC1 ZINC000090220118 491123895 /nfs/dbraw/zinc/12/38/95/491123895.db2.gz BELZUOYOSOJHCG-GFCCVEGCSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H](Cc1ccc(F)cc1)[NH2+]CCC[NH+](C)C ZINC000151935265 491128358 /nfs/dbraw/zinc/12/83/58/491128358.db2.gz QLIKXJQPIIOPEO-GFCCVEGCSA-N 2 0 238.350 2.298 20 0 BEADRP C[NH+](C)CC1CCC([NH2+]CC2(C)CC2)CC1 ZINC000309411683 491148887 /nfs/dbraw/zinc/14/88/87/491148887.db2.gz BXNBUYSIYQPMCD-UHFFFAOYSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C)C1 ZINC000488310707 533721911 /nfs/dbraw/zinc/72/19/11/533721911.db2.gz HJMONTNTFAWEAR-XJFOESAGSA-N 2 0 222.376 2.059 20 0 BEADRP CSC[C@@H]1CCC[N@@H+]1C[C@H]1CC[NH2+][C@@H](C)C1 ZINC000400115083 533748989 /nfs/dbraw/zinc/74/89/89/533748989.db2.gz JDWCSERQAQQCNM-AVGNSLFASA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000400987790 533795058 /nfs/dbraw/zinc/79/50/58/533795058.db2.gz WIRCYEOTEMFWCJ-RGDJUOJXSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C2CC[NH+](CC3CC3)CC2)[C@@H]1C ZINC000494889565 533942787 /nfs/dbraw/zinc/94/27/87/533942787.db2.gz BUZXYLHWXNHPFE-JMSVASOKSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@H]([NH2+][C@H]1CCc2ccccc21)[C@H]1CC[NH2+]C1 ZINC000400342039 534013289 /nfs/dbraw/zinc/01/32/89/534013289.db2.gz GALZRROUMOETGW-WHOFXGATSA-N 2 0 230.355 2.262 20 0 BEADRP C[C@@H]1CC[C@@H](C)[NH+]1CC1CC[NH+](C)CC1 ZINC000892224573 582810270 /nfs/dbraw/zinc/81/02/70/582810270.db2.gz XSPSXUNVTSYELF-VXGBXAGGSA-N 2 0 210.365 2.201 20 0 BEADRP C[N@H+](Cc1ccc(Cl)cc1)C1CC([NH3+])C1 ZINC000087653303 536468679 /nfs/dbraw/zinc/46/86/79/536468679.db2.gz QOUGSYDBTUKSMA-UHFFFAOYSA-N 2 0 224.735 2.262 20 0 BEADRP CC(C)C(C[NH2+]CCOCC[NH+](C)C)C(C)C ZINC000302549988 527587781 /nfs/dbraw/zinc/58/77/81/527587781.db2.gz JURSEBYNGRORRY-UHFFFAOYSA-N 2 0 244.423 2.082 20 0 BEADRP CC[N@H+](C)C[C@@H]1CC[NH+](C[C@H]2CCSC2)C1 ZINC000494960060 527816904 /nfs/dbraw/zinc/81/69/04/527816904.db2.gz XPQLSXMEVCJQLA-QWHCGFSZSA-N 2 0 242.432 2.013 20 0 BEADRP CCCC[N@H+](C)[C@H]1CC[NH+](CC)C[C@@H]1C ZINC000174773439 528368018 /nfs/dbraw/zinc/36/80/18/528368018.db2.gz ALXVSQKROVXQKK-STQMWFEESA-N 2 0 212.381 2.449 20 0 BEADRP CC(C)C[C@H](C)[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000401044803 528475398 /nfs/dbraw/zinc/47/53/98/528475398.db2.gz LNSHHZCVCIVQIA-RFQIPJPRSA-N 2 0 224.392 2.399 20 0 BEADRP CO[C@H]1CCC[C@@H]([NH2+]CC[C@H]2CCC[N@@H+]2C)C1 ZINC001172927770 974973533 /nfs/dbraw/zinc/97/35/33/974973533.db2.gz ZVVKNMNPDNLSKX-MCIONIFRSA-N 2 0 240.391 2.018 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000401163573 529242378 /nfs/dbraw/zinc/24/23/78/529242378.db2.gz PMVFOOWVJFEGOH-ODXJTPSBSA-N 2 0 224.392 2.399 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+][C@H](C)[C@H]1CCC[NH2+]1 ZINC000400461628 529312252 /nfs/dbraw/zinc/31/22/52/529312252.db2.gz RSAIEVRAIFJBHI-LPWJVIDDSA-N 2 0 210.365 2.295 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+][C@@H](C)[C@@H]1CCC[NH2+]1 ZINC000400461630 529312277 /nfs/dbraw/zinc/31/22/77/529312277.db2.gz RSAIEVRAIFJBHI-RNJOBUHISA-N 2 0 210.365 2.295 20 0 BEADRP CC(C)C[N@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000335313150 535023748 /nfs/dbraw/zinc/02/37/48/535023748.db2.gz NFWFIHGJHDRVBL-FUNVUKJBSA-N 2 0 210.365 2.199 20 0 BEADRP CC(C)[C@@H](C)[N@H+](C)CC[C@@H]1CCC[NH+]1C ZINC000348078406 535159319 /nfs/dbraw/zinc/15/93/19/535159319.db2.gz LAMJCSXKBSYTJB-OLZOCXBDSA-N 2 0 212.381 2.447 20 0 BEADRP CC(C)[C@H]1CC[C@@H](C)C[C@@H]1[NH2+]CCC[NH3+] ZINC000225140344 535204878 /nfs/dbraw/zinc/20/48/78/535204878.db2.gz VKULFCBPUSIAEE-UPJWGTAASA-N 2 0 212.381 2.386 20 0 BEADRP CC(C)[C@H]1C[N@H+](C[C@]2(C)CC[NH2+]C2)CCS1 ZINC000261729279 535238851 /nfs/dbraw/zinc/23/88/51/535238851.db2.gz GZBJBWCMIQPTKL-CHWSQXEVSA-N 2 0 242.432 2.059 20 0 BEADRP CC[NH+]1CCC([NH2+]CC[C@@H]2CCCCO2)CC1 ZINC000227503717 535473529 /nfs/dbraw/zinc/47/35/29/535473529.db2.gz FVJDAJOSFRPKDW-AWEZNQCLSA-N 2 0 240.391 2.020 20 0 BEADRP CC[NH+](CC)CCC[N@H+](C)[C@H]1CCSC1 ZINC000179568555 535503780 /nfs/dbraw/zinc/50/37/80/535503780.db2.gz ORTWGCXFUJAFHO-LBPRGKRZSA-N 2 0 230.421 2.156 20 0 BEADRP CC[NH+](CC)C[C@@H]1CC[N@H+](CC2CCC2)C1 ZINC000174211816 535584818 /nfs/dbraw/zinc/58/48/18/535584818.db2.gz NJWJGVTXSIZUGP-AWEZNQCLSA-N 2 0 224.392 2.450 20 0 BEADRP CCOC[C@@H]([NH2+]CC[C@H]1CCC[N@@H+]1C)C(C)C ZINC000348481046 535669982 /nfs/dbraw/zinc/66/99/82/535669982.db2.gz SXWCOHUZHMGNOO-ZIAGYGMSSA-N 2 0 242.407 2.121 20 0 BEADRP CCc1ccccc1C[N@@H+]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000261554052 535936260 /nfs/dbraw/zinc/93/62/60/535936260.db2.gz AOXVSQNJHNTAEQ-HOCLYGCPSA-N 2 0 244.382 2.290 20 0 BEADRP CC[C@H](O)CC[NH2+][C@@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000253020149 535978208 /nfs/dbraw/zinc/97/82/08/535978208.db2.gz JNZOXZPTWHZEHK-MJBXVCDLSA-N 2 0 242.407 2.048 20 0 BEADRP CC[C@@]1(C)CCC[N@H+](C[C@]2(C)CC[NH2+]C2)C1 ZINC000261918607 536038329 /nfs/dbraw/zinc/03/83/29/536038329.db2.gz ZZFDMFIRTSZNFN-UONOGXRCSA-N 2 0 224.392 2.498 20 0 BEADRP CCc1ccc(C[N@@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@H]3C2)cc1 ZINC000261587432 536180169 /nfs/dbraw/zinc/18/01/69/536180169.db2.gz VBPDECJCQVLOEJ-HRCADAONSA-N 2 0 244.382 2.418 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[C@@H]1C1CC1)C[NH+]1CCCC1 ZINC000348106936 566264780 /nfs/dbraw/zinc/26/47/80/566264780.db2.gz PQFUWEFDFVFNCE-BPLDGKMQSA-N 2 0 236.403 2.497 20 0 BEADRP C([NH2+][C@H]1CC[C@H]1C1CC1)[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000348072191 566261474 /nfs/dbraw/zinc/26/14/74/566261474.db2.gz ABIZOJKEJDVDJJ-CQDKDKBSSA-N 2 0 234.387 2.249 20 0 BEADRP CCc1ccccc1CN(C)[C@@H](C[NH3+])C1CC1 ZINC000159724687 566318529 /nfs/dbraw/zinc/31/85/29/566318529.db2.gz SCNCPAVKNVTSEA-HNNXBMFYSA-N 2 0 232.371 2.418 20 0 BEADRP CC1(C[NH2+][C@@H]2CCc3nc[nH]c3C2)CCC1 ZINC000335606857 566405224 /nfs/dbraw/zinc/40/52/24/566405224.db2.gz YTLUIUVGADJDRZ-SNVBAGLBSA-N 2 0 219.332 2.047 20 0 BEADRP CC(C)C(N)=[NH+]OC[C@H]1CCCC[N@H+]1C(C)C ZINC000853684944 588755983 /nfs/dbraw/zinc/75/59/83/588755983.db2.gz NCEQJLVDKFTTLL-GFCCVEGCSA-N 2 0 241.379 2.404 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+][C@@H]1CC[C@@H]1C(C)C ZINC000854229933 588781051 /nfs/dbraw/zinc/78/10/51/588781051.db2.gz ARQQKANOQRCKRZ-JHJVBQTASA-N 2 0 212.381 2.384 20 0 BEADRP C[C@H]1CCC[N@H+](CC2CC[NH+](C)CC2)CC1 ZINC000891820864 582726825 /nfs/dbraw/zinc/72/68/25/582726825.db2.gz CEJJCORMFZRZRM-ZDUSSCGKSA-N 2 0 224.392 2.450 20 0 BEADRP C[C@@H]1[C@@H](C)CCC[N@@H+]1CC1CC[NH+](C)CC1 ZINC000891860927 582730731 /nfs/dbraw/zinc/73/07/31/582730731.db2.gz DUIDBGMWSPUHQF-QWHCGFSZSA-N 2 0 224.392 2.449 20 0 BEADRP CC[C@H]1C[C@H](C)C[N@@H+]1CC1CC[NH+](C)CC1 ZINC000892068938 582784274 /nfs/dbraw/zinc/78/42/74/582784274.db2.gz WPFSVMAEUONXSZ-JSGCOSHPSA-N 2 0 224.392 2.449 20 0 BEADRP CC[N@H+](CC1CC[NH+](C)CC1)C1CCC1 ZINC000892086902 582788398 /nfs/dbraw/zinc/78/83/98/582788398.db2.gz WNWYOJHDQQGIHD-UHFFFAOYSA-N 2 0 210.365 2.203 20 0 BEADRP C[N@H+](CCCCCCC[NH3+])CC1CCOCC1 ZINC000104201290 582792676 /nfs/dbraw/zinc/79/26/76/582792676.db2.gz HENQMFHGPHWBMR-UHFFFAOYSA-N 2 0 242.407 2.254 20 0 BEADRP CC[C@@H]1C[C@@H](C[NH2+]CC2([NH3+])CCCC2)CCO1 ZINC000849349563 582849432 /nfs/dbraw/zinc/84/94/32/582849432.db2.gz AGYUFFFULSZEHO-QWHCGFSZSA-N 2 0 240.391 2.053 20 0 BEADRP C[NH+](C)CCC[NH2+]C[C@@H]1CCc2ccccc21 ZINC000892427678 582884677 /nfs/dbraw/zinc/88/46/77/582884677.db2.gz SXDNOSYPJAWXAV-AWEZNQCLSA-N 2 0 232.371 2.258 20 0 BEADRP C(CC1CCCCC1)C[NH+]1C[C@@H]2C[NH2+]C[C@H]2C1 ZINC000395115361 583042739 /nfs/dbraw/zinc/04/27/39/583042739.db2.gz IREDKDHZTHIYSU-GJZGRUSLSA-N 2 0 236.403 2.498 20 0 BEADRP Cc1occc1C[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000396455736 583082179 /nfs/dbraw/zinc/08/21/79/583082179.db2.gz MMSKSPLAQDKHHN-NSHDSACASA-N 2 0 236.359 2.408 20 0 BEADRP CC(C)CCCC[N@H+]1C[C@H]2C[NH+](C)C[C@H]2C1 ZINC000894084737 583295899 /nfs/dbraw/zinc/29/58/99/583295899.db2.gz VHIHBXIFVCWVPO-OKILXGFUSA-N 2 0 224.392 2.306 20 0 BEADRP CC(C)(CC[N@@H+]1CC[C@@H](C[NH3+])C1)C1CC1 ZINC000328546365 583415013 /nfs/dbraw/zinc/41/50/13/583415013.db2.gz NRJILYPQDYKFNW-NSHDSACASA-N 2 0 210.365 2.093 20 0 BEADRP C[C@H]1C[N@H+](CC2CC[NH+](C)CC2)CCC1(F)F ZINC000894533320 583479036 /nfs/dbraw/zinc/47/90/36/583479036.db2.gz FWDVYXLZZKVMOR-NSHDSACASA-N 2 0 246.345 2.305 20 0 BEADRP C[NH+]1CCC(CNc2cc3c(c[nH+]2)CCC3)CC1 ZINC000894642220 583498138 /nfs/dbraw/zinc/49/81/38/583498138.db2.gz LZVVUHRVYNTWOF-UHFFFAOYSA-N 2 0 245.370 2.324 20 0 BEADRP C[NH+]1CCC(C[NH+]2CC(C(C)(C)C)C2)CC1 ZINC000894843989 583530456 /nfs/dbraw/zinc/53/04/56/583530456.db2.gz SYNLAIIXWJMWRO-UHFFFAOYSA-N 2 0 224.392 2.306 20 0 BEADRP C(=C\c1ccccc1)\CC[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC000323665569 583532389 /nfs/dbraw/zinc/53/23/89/583532389.db2.gz DMKRXWINOLZRMX-KQLXTKLJSA-N 2 0 242.366 2.241 20 0 BEADRP C[N@H+](CC1CC[NH+](C)CC1)C1CC(C)(C)C1 ZINC000894861075 583534212 /nfs/dbraw/zinc/53/42/12/583534212.db2.gz OTIZZIIWFJBDFA-UHFFFAOYSA-N 2 0 224.392 2.449 20 0 BEADRP C[C@H]1CC(C)(C)C[N@@H+]1CC1CC[NH+](C)CC1 ZINC000894924956 583556688 /nfs/dbraw/zinc/55/66/88/583556688.db2.gz FDZVCKRUMDRZFJ-LBPRGKRZSA-N 2 0 224.392 2.449 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@@H]2C[C@H]2C2CCC2)CC1 ZINC000895009227 583567310 /nfs/dbraw/zinc/56/73/10/583567310.db2.gz VCKGWKIJHJVMIW-UONOGXRCSA-N 2 0 222.376 2.106 20 0 BEADRP CC[N@H+](CCSC)CC1CC[NH+](C)CC1 ZINC000895123798 583596757 /nfs/dbraw/zinc/59/67/57/583596757.db2.gz ILCRJAREVADYMV-UHFFFAOYSA-N 2 0 230.421 2.013 20 0 BEADRP COC1(C[C@@H](C)[NH2+]CC[C@@H](C)[NH+](C)C)CCC1 ZINC000895294576 583638437 /nfs/dbraw/zinc/63/84/37/583638437.db2.gz RTRGIIKZZHEZSI-CHWSQXEVSA-N 2 0 242.407 2.264 20 0 BEADRP CC(C)[C@@H]1C[C@H]([NH2+]CC[C@@H](C)[NH+](C)C)CS1 ZINC000895293727 583639558 /nfs/dbraw/zinc/63/95/58/583639558.db2.gz KPPKZNQVOXOVQW-AGIUHOORSA-N 2 0 244.448 2.446 20 0 BEADRP C[C@H](CC[NH2+]CC1CCSCC1)[NH+](C)C ZINC000895293143 583639761 /nfs/dbraw/zinc/63/97/61/583639761.db2.gz VFZDIJIHTVEUAL-LLVKDONJSA-N 2 0 230.421 2.059 20 0 BEADRP Cc1ccc(CCC[NH2+][C@@H]2CCN(C)[C@H]2C)cn1 ZINC000896555941 583811547 /nfs/dbraw/zinc/81/15/47/583811547.db2.gz SKIMVAFFDBRXHJ-DZGCQCFKSA-N 2 0 247.386 2.005 20 0 BEADRP Cc1ccc(CCC[NH2+][C@H]2CCN(C)[C@@H]2C)cn1 ZINC000896555942 583811808 /nfs/dbraw/zinc/81/18/08/583811808.db2.gz SKIMVAFFDBRXHJ-HIFRSBDPSA-N 2 0 247.386 2.005 20 0 BEADRP CC1=CC[C@H]([NH2+][C@H]2CCN(C)[C@@H]2C)CC1 ZINC000896555927 583812072 /nfs/dbraw/zinc/81/20/72/583812072.db2.gz SFECNPUGHGDLBH-AGIUHOORSA-N 2 0 208.349 2.167 20 0 BEADRP C[NH+]1CCC(C[NH2+]C(C)(C)/C=C/Cl)CC1 ZINC000896747616 583830358 /nfs/dbraw/zinc/83/03/58/583830358.db2.gz NQGLWLPSUKJBOO-VOTSOKGWSA-N 2 0 230.783 2.449 20 0 BEADRP CC[C@H]([NH2+]CCN1CCC[C@@H]1C)[C@@H]1C[C@@H]1C ZINC000840725403 583934213 /nfs/dbraw/zinc/93/42/13/583934213.db2.gz AFLXCSBUCLNGSD-FQUUOJAGSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1CN(C)C[C@H]1[NH2+][C@@H]1CCSC(C)(C)C1 ZINC000897797223 584049312 /nfs/dbraw/zinc/04/93/12/584049312.db2.gz FGKUMHXWDBSREG-IJLUTSLNSA-N 2 0 242.432 2.200 20 0 BEADRP C[C@@H]1CN(C)C[C@@H]1[NH2+][C@H]1CCSC(C)(C)C1 ZINC000897797294 584049319 /nfs/dbraw/zinc/04/93/19/584049319.db2.gz FGKUMHXWDBSREG-WOPDTQHZSA-N 2 0 242.432 2.200 20 0 BEADRP Cc1ncccc1CC[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000898251638 584100396 /nfs/dbraw/zinc/10/03/96/584100396.db2.gz GPYPNBCTTCQVPS-IUODEOHRSA-N 2 0 247.386 2.005 20 0 BEADRP COCC(C)(C)C[N@H+](C)CC(C)(C)C[NH+](C)C ZINC000898308170 584109433 /nfs/dbraw/zinc/10/94/33/584109433.db2.gz QSAAPCKYGXLMKL-UHFFFAOYSA-N 2 0 244.423 2.179 20 0 BEADRP C[NH+](C)CC(C)(C)C[N@H+](C)CC1(C)CC1 ZINC000898308082 584109726 /nfs/dbraw/zinc/10/97/26/584109726.db2.gz NGFDNFGENRLQQT-UHFFFAOYSA-N 2 0 212.381 2.306 20 0 BEADRP CCC[C@@H](C[N@H+](C)CC(C)(C)C[NH+](C)C)OC ZINC000898308251 584109862 /nfs/dbraw/zinc/10/98/62/584109862.db2.gz VBGXHUWMNAYODY-ZDUSSCGKSA-N 2 0 244.423 2.321 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@H+](C)CC(C)(C)C[NH+](C)C ZINC000898307734 584109901 /nfs/dbraw/zinc/10/99/01/584109901.db2.gz GHZFSZFXTLSHEB-VXGBXAGGSA-N 2 0 212.381 2.162 20 0 BEADRP CCC[C@H](C[N@H+](C)CC(C)(C)C[NH+](C)C)OC ZINC000898308250 584110006 /nfs/dbraw/zinc/11/00/06/584110006.db2.gz VBGXHUWMNAYODY-CYBMUJFWSA-N 2 0 244.423 2.321 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@H]2CCC[C@H]2CCCF)C1 ZINC000873251856 584127996 /nfs/dbraw/zinc/12/79/96/584127996.db2.gz XNIYCGRFIGVLMD-RVMXOQNASA-N 2 0 228.355 2.232 20 0 BEADRP CCc1cccnc1[C@@H](C)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873249693 584128075 /nfs/dbraw/zinc/12/80/75/584128075.db2.gz CAARQDCMYLBCEW-WZRBSPASSA-N 2 0 233.359 2.032 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]CCC[C@H]1C=CCC1 ZINC000873282307 584129025 /nfs/dbraw/zinc/12/90/25/584129025.db2.gz SYOMZMQSLIKMDE-MELADBBJSA-N 2 0 222.376 2.450 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]([NH2+]CC2CCC2)C1 ZINC000902321098 584552096 /nfs/dbraw/zinc/55/20/96/584552096.db2.gz ULUTUBUSDKNELB-GFCCVEGCSA-N 2 0 210.365 2.154 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]([NH2+]CCC(F)(F)F)C1 ZINC000902345185 584558359 /nfs/dbraw/zinc/55/83/59/584558359.db2.gz AQBWZRJPEPGAOO-VIFPVBQESA-N 2 0 238.297 2.307 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]([NH2+]C[C@H]2CCC=CO2)C1 ZINC000902376019 584567827 /nfs/dbraw/zinc/56/78/27/584567827.db2.gz GNCWGDSTFGSEAY-QWHCGFSZSA-N 2 0 238.375 2.047 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]([NH2+]CCc2ccco2)C1 ZINC000902359894 584571206 /nfs/dbraw/zinc/57/12/06/584571206.db2.gz HZHHLKAZVPBPCP-GFCCVEGCSA-N 2 0 236.359 2.190 20 0 BEADRP C[C@@H]([NH2+]CC1([NH3+])CC1)[C@H]1CCCC[C@H]1C ZINC000902406105 584574217 /nfs/dbraw/zinc/57/42/17/584574217.db2.gz LMMOPQLJEHVUGK-UTUOFQBUSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+]C1(C[NH2+][C@H]2CCCC23CCCC3)CC1 ZINC000902408230 584575272 /nfs/dbraw/zinc/57/52/72/584575272.db2.gz YLRCNOHJNNVNES-NSHDSACASA-N 2 0 208.349 2.180 20 0 BEADRP CCSCCC[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000902383772 584577231 /nfs/dbraw/zinc/57/72/31/584577231.db2.gz DUNSBLKOYVWUFE-LBPRGKRZSA-N 2 0 244.448 2.497 20 0 BEADRP CCSCCC[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000902383771 584577429 /nfs/dbraw/zinc/57/74/29/584577429.db2.gz DUNSBLKOYVWUFE-GFCCVEGCSA-N 2 0 244.448 2.497 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]([NH2+]CCCCF)C1 ZINC000902386874 584578956 /nfs/dbraw/zinc/57/89/56/584578956.db2.gz HFMJPVSIPLCDTD-LLVKDONJSA-N 2 0 216.344 2.104 20 0 BEADRP CC/C=C\C[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000902387427 584579512 /nfs/dbraw/zinc/57/95/12/584579512.db2.gz KSKOEYCUFALQLT-FJOGCWAESA-N 2 0 210.365 2.320 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]([NH2+]CC2CC(F)(F)C2)C1 ZINC000902387718 584579762 /nfs/dbraw/zinc/57/97/62/584579762.db2.gz LIJTWTQCNXAFEO-LLVKDONJSA-N 2 0 246.345 2.400 20 0 BEADRP C[C@H](F)CC[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000902389130 584580636 /nfs/dbraw/zinc/58/06/36/584580636.db2.gz SDFJNGFAGQXRNM-QWRGUYRKSA-N 2 0 216.344 2.102 20 0 BEADRP C[C@@H](F)CC[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000902389127 584580731 /nfs/dbraw/zinc/58/07/31/584580731.db2.gz SDFJNGFAGQXRNM-GHMZBOCLSA-N 2 0 216.344 2.102 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]([NH2+]CCc2ccoc2)C1 ZINC000902401033 584587694 /nfs/dbraw/zinc/58/76/94/584587694.db2.gz ZUVAUBHRXONKRO-CYBMUJFWSA-N 2 0 236.359 2.190 20 0 BEADRP CC(C)[C@@H]1CCC[C@H]([NH2+]CC2([NH3+])CC2)C1 ZINC000902403810 584588323 /nfs/dbraw/zinc/58/83/23/584588323.db2.gz BNYFXYBUIJBJIZ-NEPJUHHUSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H]2CCC[C@H](C(F)(F)F)C2)CC1 ZINC000902405545 584589769 /nfs/dbraw/zinc/58/97/69/584589769.db2.gz ISIYHVAKYWWLDP-DTWKUNHWSA-N 2 0 236.281 2.188 20 0 BEADRP [NH3+]C1(C[NH2+][C@H]2CCC[C@@H](C(F)(F)F)C2)CC1 ZINC000902405543 584589983 /nfs/dbraw/zinc/58/99/83/584589983.db2.gz ISIYHVAKYWWLDP-BDAKNGLRSA-N 2 0 236.281 2.188 20 0 BEADRP C[C@@H]([NH2+]CC(C)(C)C1CC1)[C@@H]1CCC[NH2+]1 ZINC000902430907 584595687 /nfs/dbraw/zinc/59/56/87/584595687.db2.gz JSJQPCLKMZIXFC-PWSUYJOCSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)(C[NH2+][C@@H]1CCC[C@@H]([NH3+])C1)C1CC1 ZINC000902434566 584595942 /nfs/dbraw/zinc/59/59/42/584595942.db2.gz XMYMKLHKIJANFU-VXGBXAGGSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)(C[NH2+][C@@H]1CC[NH2+]C1(C)C)C1CC1 ZINC000902433971 584596216 /nfs/dbraw/zinc/59/62/16/584596216.db2.gz WNHYSIMKTVOZIQ-LLVKDONJSA-N 2 0 210.365 2.153 20 0 BEADRP CC1(C)C[NH2+]C[C@@H]1[NH2+][C@H]1CCC[C@H]1CCCF ZINC000902440835 584597091 /nfs/dbraw/zinc/59/70/91/584597091.db2.gz ARSOZOOVUFRAOL-AVGNSLFASA-N 2 0 242.382 2.492 20 0 BEADRP CCC(C)(C)[C@@H](C)[NH2+][C@H]1C[NH2+]CC1(C)C ZINC000902440904 584597852 /nfs/dbraw/zinc/59/78/52/584597852.db2.gz BEOYVNGAYPWNPJ-MNOVXSKESA-N 2 0 212.381 2.399 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+][C@H]1C[NH2+]CC1(C)C ZINC000902444143 584598097 /nfs/dbraw/zinc/59/80/97/584598097.db2.gz MRBBCGGXUQAUJK-TUAOUCFPSA-N 2 0 210.365 2.009 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+][C@@H]1C[NH2+]CC1(C)C ZINC000902444137 584598155 /nfs/dbraw/zinc/59/81/55/584598155.db2.gz MRBBCGGXUQAUJK-SDDRHHMPSA-N 2 0 210.365 2.009 20 0 BEADRP CC1(C)CC[C@@H]([NH2+][C@H]2C[NH2+]CC2(C)C)C1 ZINC000902443924 584598279 /nfs/dbraw/zinc/59/82/79/584598279.db2.gz MOMUUDFVONAMHK-MNOVXSKESA-N 2 0 210.365 2.153 20 0 BEADRP CCCC[C@@H]1CCC[C@H]1[NH2+]CC1(N)CC1 ZINC000902414734 584600631 /nfs/dbraw/zinc/60/06/31/584600631.db2.gz ZWOITHJQOWGZHB-VXGBXAGGSA-N 2 0 210.365 2.426 20 0 BEADRP CCCC(CCC)[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902472505 584600967 /nfs/dbraw/zinc/60/09/67/584600967.db2.gz BROQYWFVMGUVFH-FRRDWIJNSA-N 2 0 210.365 2.438 20 0 BEADRP C[C@H](CC1CCC1)[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902476831 584602643 /nfs/dbraw/zinc/60/26/43/584602643.db2.gz PVNIUNKRARNTIQ-FOUMNBMASA-N 2 0 208.349 2.048 20 0 BEADRP CC1(C)C[C@H]([NH2+][C@H]2CCC[C@H]2[NH3+])CCS1 ZINC000902449984 584606483 /nfs/dbraw/zinc/60/64/83/584606483.db2.gz AZTVZIPUNFACQS-MXWKQRLJSA-N 2 0 228.405 2.130 20 0 BEADRP CC(C)[C@H]([NH2+][C@@H]1C[NH2+]CC1(C)C)C1CC1 ZINC000902450509 584606602 /nfs/dbraw/zinc/60/66/02/584606602.db2.gz SSWIOJVZMAXVNK-NEPJUHHUSA-N 2 0 210.365 2.009 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+][C@@H]2C[C@@H]3CCC[C@@H]23)C12CCC2 ZINC000902452730 584607921 /nfs/dbraw/zinc/60/79/21/584607921.db2.gz AEIVYXGISBFGHQ-CLPYTZEMSA-N 2 0 220.360 2.035 20 0 BEADRP C[C@@H]1[C@H]2CC[C@@H](C[C@@H]1[NH2+][C@@H]1C[C@H]3CCC[C@@H]31)[NH2+]2 ZINC000902453025 584608218 /nfs/dbraw/zinc/60/82/18/584608218.db2.gz BPULQWQDPXJHGW-BXPKWHOZSA-N 2 0 234.387 2.294 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+][C@@H]2C[C@@H]3CCC[C@H]23)C12CCC2 ZINC000902452733 584608273 /nfs/dbraw/zinc/60/82/73/584608273.db2.gz AEIVYXGISBFGHQ-YYHQMBLXSA-N 2 0 220.360 2.035 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H]2C[C@H]3CCC[C@@H]32)C1 ZINC000902455433 584609358 /nfs/dbraw/zinc/60/93/58/584609358.db2.gz LZZUHZBATFXQKN-NAWOPXAZSA-N 2 0 208.349 2.035 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC=CCCC1)C1C[NH2+]C1 ZINC000902454812 584609361 /nfs/dbraw/zinc/60/93/61/584609361.db2.gz IKKBDDIHQOGTPM-QWHCGFSZSA-N 2 0 222.376 2.320 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+][C@@H]1CCCC2(CC2)C1 ZINC000902455777 584609689 /nfs/dbraw/zinc/60/96/89/584609689.db2.gz YYWDZILGKGLGOC-NEPJUHHUSA-N 2 0 222.376 2.439 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1C[C@H]2CCC[C@@H]21 ZINC000902459120 584610656 /nfs/dbraw/zinc/61/06/56/584610656.db2.gz XGRDUTMVBIHHPB-IKOXMDCHSA-N 2 0 222.376 2.282 20 0 BEADRP CC1(C)CCC[C@H](C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)O1 ZINC000902461205 584611420 /nfs/dbraw/zinc/61/14/20/584611420.db2.gz LXEHLFWVZSHEQL-YNEHKIRRSA-N 2 0 240.391 2.194 20 0 BEADRP CCCC[C@H](CC)[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902465296 584612924 /nfs/dbraw/zinc/61/29/24/584612924.db2.gz FELSKFYJAMIZST-WUHRBBMRSA-N 2 0 210.365 2.438 20 0 BEADRP C1CC1[C@@H]([NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2)C1CCC1 ZINC000902464802 584613116 /nfs/dbraw/zinc/61/31/16/584613116.db2.gz CXGWZVDBZQNZDB-RQJABVFESA-N 2 0 220.360 2.048 20 0 BEADRP CC[C@@H]1CCC[C@@H]([NH2+][C@@H]2C[C@@H]3CC[C@H]2[NH2+]3)C1 ZINC000902465011 584613225 /nfs/dbraw/zinc/61/32/25/584613225.db2.gz FOPVYEHJMIKGJA-RKQHYHRCSA-N 2 0 222.376 2.438 20 0 BEADRP CC1CCC([NH2+][C@@H]2C[C@@H]3CC[C@H]2[NH2+]3)CC1 ZINC000902467282 584614476 /nfs/dbraw/zinc/61/44/76/584614476.db2.gz OQRGGPUPSCZBSX-FQLQODGNSA-N 2 0 208.349 2.048 20 0 BEADRP CC1(C)CC[C@H]([NH2+][C@@H]2C[C@@H]3CC[C@H]2[NH2+]3)C1 ZINC000902468168 584614979 /nfs/dbraw/zinc/61/49/79/584614979.db2.gz MARUIGRLMZNOEO-NNYUYHANSA-N 2 0 208.349 2.048 20 0 BEADRP CCC(C)(C)[C@H](C)[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902469010 584615793 /nfs/dbraw/zinc/61/57/93/584615793.db2.gz NMQXRZQUDPBDFZ-NNYUYHANSA-N 2 0 210.365 2.294 20 0 BEADRP CCC(C)(C)[C@@H](C)[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902469011 584615802 /nfs/dbraw/zinc/61/58/02/584615802.db2.gz NMQXRZQUDPBDFZ-WRWGMCAJSA-N 2 0 210.365 2.294 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+][C@@H]2C[C@@H]3CC[C@H]2[NH2+]3)C[C@H]1C ZINC000902470451 584616716 /nfs/dbraw/zinc/61/67/16/584616716.db2.gz XTIBGRPLYHGERE-YOVYLDAJSA-N 2 0 222.376 2.294 20 0 BEADRP C1CC2(C1)CCC[C@@H]2[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902469929 584616754 /nfs/dbraw/zinc/61/67/54/584616754.db2.gz SWNKBHHGQFPTLM-LOWDOPEQSA-N 2 0 220.360 2.192 20 0 BEADRP C1CC1[C@H]1CCC[C@H]([NH2+][C@@H]2C[C@@H]3CC[C@H]2[NH2+]3)C1 ZINC000902471772 584617582 /nfs/dbraw/zinc/61/75/82/584617582.db2.gz SKGNNNLFNCFHHC-BTFPBAQTSA-N 2 0 234.387 2.438 20 0 BEADRP C[C@@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1ccsc1 ZINC000902490578 584617940 /nfs/dbraw/zinc/61/79/40/584617940.db2.gz XQCGGBUGAJRUIV-FXPVBKGRSA-N 2 0 210.346 2.136 20 0 BEADRP C[C@@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1ccnc(Cl)c1 ZINC000902491693 584618241 /nfs/dbraw/zinc/61/82/41/584618241.db2.gz YLCKVVDCQLDQAR-FXPVBKGRSA-N 2 0 239.750 2.123 20 0 BEADRP C[C@@H]1CC=CC[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000902503198 584620771 /nfs/dbraw/zinc/62/07/71/584620771.db2.gz HPNVMKDPTCSOIT-SYCZCVCYSA-N 2 0 220.360 2.214 20 0 BEADRP CO[C@@H]1CCC[C@@H]([NH2+]C[C@@H]2CCCCC[NH2+]2)C1 ZINC000902482422 584623872 /nfs/dbraw/zinc/62/38/72/584623872.db2.gz LDVCYJWBJIRZEM-HZSPNIEDSA-N 2 0 240.391 2.066 20 0 BEADRP C[C@H](Cc1ccccc1F)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902485399 584625169 /nfs/dbraw/zinc/62/51/69/584625169.db2.gz KHOMBSJGOAJOSY-NQBHXWOUSA-N 2 0 236.334 2.084 20 0 BEADRP CC(C)(C)[C@@H]1CC[C@@H]1[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902485698 584625187 /nfs/dbraw/zinc/62/51/87/584625187.db2.gz MWZZQMHMOIOVBS-KKOKHZNYSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@H]1Cc2ccccc2[C@@H]1[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902485616 584625549 /nfs/dbraw/zinc/62/55/49/584625549.db2.gz BRWIANFTIPXGNU-TZQJONAQSA-N 2 0 230.355 2.247 20 0 BEADRP CCC[C@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1ccccn1 ZINC000902487159 584625942 /nfs/dbraw/zinc/62/59/42/584625942.db2.gz KDUSVLYHLOMSLK-OBJOEFQTSA-N 2 0 233.359 2.250 20 0 BEADRP CCC[C@@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1ccccn1 ZINC000902487162 584626070 /nfs/dbraw/zinc/62/60/70/584626070.db2.gz KDUSVLYHLOMSLK-YRGRVCCFSA-N 2 0 233.359 2.250 20 0 BEADRP Cc1cccc([C@H](C)[NH2+][C@H]2C[C@H](C[NH3+])C2)c1 ZINC000902487518 584626390 /nfs/dbraw/zinc/62/63/90/584626390.db2.gz IGIKCEJRTPXHMH-OBJOEFQTSA-N 2 0 218.344 2.383 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+][C@@H](Cc2ccccc2)C2CC2)C1 ZINC000902487637 584626453 /nfs/dbraw/zinc/62/64/53/584626453.db2.gz LHYJZBMLQSYDLO-BPUTZDHNSA-N 2 0 244.382 2.335 20 0 BEADRP CCC[C@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1cccnc1 ZINC000902487800 584626952 /nfs/dbraw/zinc/62/69/52/584626952.db2.gz USEXARZAGDURMI-UBHSHLNASA-N 2 0 233.359 2.250 20 0 BEADRP Cc1ccc2c(c1)CC[C@H]2[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902489348 584627224 /nfs/dbraw/zinc/62/72/24/584627224.db2.gz PGXCBMCTUKAYJV-UXIGCNINSA-N 2 0 230.355 2.309 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@H]2C[C@H](C[NH3+])C2)[C@@H]1C ZINC000902488676 584627372 /nfs/dbraw/zinc/62/73/72/584627372.db2.gz ZRSJKFNSUORSLW-VEGXAWMVSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+][C@H]2C[C@H](C[NH3+])C2)[C@H]1C ZINC000902488674 584627702 /nfs/dbraw/zinc/62/77/02/584627702.db2.gz ZRSJKFNSUORSLW-NZEXEKPDSA-N 2 0 210.365 2.138 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@H](c2ccncc2)C2CC2)C1 ZINC000902513925 584629527 /nfs/dbraw/zinc/62/95/27/584629527.db2.gz IZDMQKKIRLXMGB-ILXRZTDVSA-N 2 0 245.370 2.392 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@@H](c1ccncc1)C1CC1 ZINC000902515184 584629614 /nfs/dbraw/zinc/62/96/14/584629614.db2.gz UAJWNLUYCQKQJC-MISXGVKJSA-N 2 0 233.359 2.248 20 0 BEADRP CC1(C)C[C@@H]([NH2+]C/C=C\Cl)C[C@@H]([NH3+])C1 ZINC000902517470 584630191 /nfs/dbraw/zinc/63/01/91/584630191.db2.gz HZJWOXNOWALPMO-QKMQQOOLSA-N 2 0 216.756 2.235 20 0 BEADRP CC1(C)C[C@H]([NH3+])C[C@@H]([NH2+]C/C=C/Cl)C1 ZINC000902517467 584630276 /nfs/dbraw/zinc/63/02/76/584630276.db2.gz HZJWOXNOWALPMO-HIHHVFROSA-N 2 0 216.756 2.235 20 0 BEADRP C[NH+](C)CCCC[NH2+]C1C[C@H]2CCC[C@@H]2C1 ZINC000902780180 584669648 /nfs/dbraw/zinc/66/96/48/584669648.db2.gz BQEYHILVCQEIGS-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP C1CC1N1CC[C@@H]([NH2+][C@@H]2C[C@H]3CCC[C@H]3C2)C1 ZINC000902793941 584673420 /nfs/dbraw/zinc/67/34/20/584673420.db2.gz OYPUCVLISKNVQI-XJFOESAGSA-N 2 0 234.387 2.391 20 0 BEADRP C[C@@H](C[NH2+][C@@H]1C[C@H]2CCC[C@H]2C1)C[NH+](C)C ZINC000902999213 584714772 /nfs/dbraw/zinc/71/47/72/584714772.db2.gz MRAKNVWDEAUTNQ-FQUUOJAGSA-N 2 0 224.392 2.352 20 0 BEADRP CSCC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C1CC1 ZINC000903058765 584722982 /nfs/dbraw/zinc/72/29/82/584722982.db2.gz SUCATJQQRAICHO-VGPLMAKISA-N 2 0 240.416 2.097 20 0 BEADRP C/C=C\C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C1CC1 ZINC000903206142 584736648 /nfs/dbraw/zinc/73/66/48/584736648.db2.gz HQCJFERODGNZHV-NYZQYHEQSA-N 2 0 220.360 2.310 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[C@H]1[C@@H]1C[C@H]1C)C1CC[NH+](C)CC1 ZINC000903252133 584738894 /nfs/dbraw/zinc/73/88/94/584738894.db2.gz AUHCAFDJWVHHHM-SOMZYNEFSA-N 2 0 236.403 2.351 20 0 BEADRP C[C@@H]1C[C@H]1[C@@H]1C[C@H]1[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1 ZINC000903254042 584739412 /nfs/dbraw/zinc/73/94/12/584739412.db2.gz PBKHMKHMBYPXPS-XHJNMGKDSA-N 2 0 236.403 2.493 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+][C@@H]2C[C@H]2[C@@H]2C[C@H]2C)[C@H](C)C1 ZINC000903255666 584739963 /nfs/dbraw/zinc/73/99/63/584739963.db2.gz YSZZSTBPMUCYSR-PLJUSGQGSA-N 2 0 236.403 2.351 20 0 BEADRP COC(C)(C)[C@@H](C)[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1 ZINC000903330424 584753848 /nfs/dbraw/zinc/75/38/48/584753848.db2.gz JZYHAKHGSSAZBV-NEPJUHHUSA-N 2 0 242.407 2.262 20 0 BEADRP C[C@@H](C1CC1)[N@H+](C[C@@H]1CC[C@H]([NH3+])C1)C1CC1 ZINC000903431059 584761764 /nfs/dbraw/zinc/76/17/64/584761764.db2.gz KYQNNFWPUZEMLD-LOWVWBTDSA-N 2 0 222.376 2.377 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]C[C@H]2CCC[NH2+]2)[C@@H]1C ZINC000903458562 584765438 /nfs/dbraw/zinc/76/54/38/584765438.db2.gz DFSJYTCDCBXGBU-FDYHWXHSSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1C[C@H]([NH3+])CC[N@@H+]1Cc1ccc2cc[nH]c2c1 ZINC000903460838 584766554 /nfs/dbraw/zinc/76/65/54/584766554.db2.gz JRHZYIGKZXBHQC-BXUZGUMPSA-N 2 0 243.354 2.480 20 0 BEADRP C[C@H]1C[C@@H]([NH3+])CC[N@@H+]1Cc1ccc2cc[nH]c2c1 ZINC000903460839 584766744 /nfs/dbraw/zinc/76/67/44/584766744.db2.gz JRHZYIGKZXBHQC-FZMZJTMJSA-N 2 0 243.354 2.480 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@@H+]1CCC[C@@H]1c1ccccn1 ZINC000903442207 584767264 /nfs/dbraw/zinc/76/72/64/584767264.db2.gz KIWWNHANWCGOHU-VNHYZAJKSA-N 2 0 245.370 2.074 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C/C=C/Cl)[C@@H]2CCC[C@H]21 ZINC000903443514 584768631 /nfs/dbraw/zinc/76/86/31/584768631.db2.gz HSZBAFZEITXKRQ-CDOOCROKSA-N 2 0 228.767 2.201 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C/C=C/Cl)[C@@H]2CCC[C@@H]21 ZINC000903443517 584768651 /nfs/dbraw/zinc/76/86/51/584768651.db2.gz HSZBAFZEITXKRQ-ZILVEVEJSA-N 2 0 228.767 2.201 20 0 BEADRP CC(F)(F)CCC[N@@H+]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC000903454149 584773624 /nfs/dbraw/zinc/77/36/24/584773624.db2.gz VXOWCXFFFGGPGW-ZDUSSCGKSA-N 2 0 246.345 2.497 20 0 BEADRP C1=CCC(C[NH2+][C@H]2CC[NH2+]C23CCCC3)C1 ZINC000903481570 584777868 /nfs/dbraw/zinc/77/78/68/584777868.db2.gz GNNDMQVZEIVYNA-ZDUSSCGKSA-N 2 0 220.360 2.217 20 0 BEADRP Cc1ccc(CC[N@H+]2C[C@@H](C)[C@H](CC[NH3+])C2)cc1 ZINC000903497236 584781157 /nfs/dbraw/zinc/78/11/57/584781157.db2.gz QVTNRRFIVPWLNH-GDBMZVCRSA-N 2 0 246.398 2.454 20 0 BEADRP CC(C)C[N@@H+](Cc1ccccn1)C[C@H]1CC[NH2+]C1 ZINC000903575200 584783926 /nfs/dbraw/zinc/78/39/26/584783926.db2.gz HOMJRHJJJJOSDB-AWEZNQCLSA-N 2 0 247.386 2.149 20 0 BEADRP CC1CC(C[N@H+](C2CC2)C2CC[NH2+]CC2)C1 ZINC000903713583 584793780 /nfs/dbraw/zinc/79/37/80/584793780.db2.gz WTNBEPFARSLJDN-UHFFFAOYSA-N 2 0 222.376 2.249 20 0 BEADRP CC1CC(C[N@@H+]2CCC[C@H]([C@@H]3CC[NH2+]C3)C2)C1 ZINC000903748903 584794829 /nfs/dbraw/zinc/79/48/29/584794829.db2.gz CUUQQBJNKKENCY-CVSAEHQPSA-N 2 0 236.403 2.354 20 0 BEADRP CC1CC(C[N@@H+]2CCC[C@@H]([C@@H]3CC[NH2+]C3)C2)C1 ZINC000903748904 584795103 /nfs/dbraw/zinc/79/51/03/584795103.db2.gz CUUQQBJNKKENCY-NEXFUWMNSA-N 2 0 236.403 2.354 20 0 BEADRP CC1(F)CC[NH+](C[C@H]2CCCC[NH2+]C2)CC1 ZINC000903778174 584799485 /nfs/dbraw/zinc/79/94/85/584799485.db2.gz JZWOMSIKWIEFDF-LBPRGKRZSA-N 2 0 228.355 2.200 20 0 BEADRP CCC[N@@H+]1CCCC[C@@H]1C1(C[NH3+])CCC1 ZINC000903811888 584803543 /nfs/dbraw/zinc/80/35/43/584803543.db2.gz POVGHXXFYYYSSV-GFCCVEGCSA-N 2 0 210.365 2.380 20 0 BEADRP CC1(C)C[NH2+]C[C@@H]1[NH2+]CC1CCCCC1 ZINC000903821694 584804163 /nfs/dbraw/zinc/80/41/63/584804163.db2.gz PYQJCXWDWCOKHD-LBPRGKRZSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@]12C[N@H+](C[C@H]3CCC[NH2+]3)C[C@H]1[C@H]1CC[C@@H]2C1 ZINC000903825648 584804611 /nfs/dbraw/zinc/80/46/11/584804611.db2.gz BZWFVIGNWJPBBY-VYDRJRHOSA-N 2 0 234.387 2.106 20 0 BEADRP [NH3+][C@H]1C[C@H]2C[C@@H](C1)[N@H+](CCc1cccs1)C2 ZINC000903843243 584807582 /nfs/dbraw/zinc/80/75/82/584807582.db2.gz GNNGGQSOCBFYNW-SRVKXCTJSA-N 2 0 236.384 2.102 20 0 BEADRP C[C@@H]1CC=CC[C@H]1[NH2+]CCCCCC[NH3+] ZINC000903850070 584807933 /nfs/dbraw/zinc/80/79/33/584807933.db2.gz JPVAGIREVIMIGR-CHWSQXEVSA-N 2 0 210.365 2.450 20 0 BEADRP Cc1cc(C)nc(CN2CC[C@@H]3CC[C@]32C[NH3+])c1 ZINC000903862625 584813285 /nfs/dbraw/zinc/81/32/85/584813285.db2.gz AUHYGBABKRSADG-ZFWWWQNUSA-N 2 0 245.370 2.012 20 0 BEADRP CC(C)C[C@@H](C)C[N@@H+]1CCC[C@@]12CC[NH2+]C2 ZINC000903872280 584815634 /nfs/dbraw/zinc/81/56/34/584815634.db2.gz YGSBZOAJFBGTFW-KGLIPLIRSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)[N@H+](CC1C[C@H]2CC[C@@H](C1)[NH2+]2)C1CC1 ZINC000903884352 584818685 /nfs/dbraw/zinc/81/86/85/584818685.db2.gz XPYZIXCMBUVSPC-YHWZYXNKSA-N 2 0 222.376 2.390 20 0 BEADRP C[C@H]1C[C@H]([NH2+]C[C@@H]([NH3+])CC(F)F)C[C@@H](C)C1 ZINC000903922127 584823415 /nfs/dbraw/zinc/82/34/15/584823415.db2.gz VEHXOBNBEJVSOC-ZRUFSTJUSA-N 2 0 234.334 2.383 20 0 BEADRP [NH3+][C@@H](C[NH2+]CC1CCCCC1)CC(F)F ZINC000903925912 584823698 /nfs/dbraw/zinc/82/36/98/584823698.db2.gz JAONXPOTWZYUPM-SNVBAGLBSA-N 2 0 220.307 2.139 20 0 BEADRP Cc1ccc(CCC[NH2+]CCC(C)(C)[NH3+])cn1 ZINC000903939001 584824857 /nfs/dbraw/zinc/82/48/57/584824857.db2.gz AVBZTURBTXCLIC-UHFFFAOYSA-N 2 0 235.375 2.040 20 0 BEADRP C[C@H](CC1CC1)[NH2+]C[C@H]1C[NH2+]CCC1(F)F ZINC000903958339 584827914 /nfs/dbraw/zinc/82/79/14/584827914.db2.gz XYIURHMQIWYAHQ-MWLCHTKSSA-N 2 0 232.318 2.009 20 0 BEADRP CCC[C@H](CC)[NH2+]C[C@H]1C[NH2+]CCC1(F)F ZINC000903955937 584832017 /nfs/dbraw/zinc/83/20/17/584832017.db2.gz CHUBLZXKNQTOGF-MNOVXSKESA-N 2 0 234.334 2.400 20 0 BEADRP CCC[C@H](C)C[NH2+]C[C@H]1C[NH2+]CCC1(F)F ZINC000903955773 584832238 /nfs/dbraw/zinc/83/22/38/584832238.db2.gz YPKOCPJPAGZDMO-WDEREUQCSA-N 2 0 234.334 2.257 20 0 BEADRP CC(C)CCC[NH2+]CC[C@@H]1C[NH2+]C[C@H]1C ZINC000903979193 584832883 /nfs/dbraw/zinc/83/28/83/584832883.db2.gz YFBHPSCABAJWNG-CHWSQXEVSA-N 2 0 212.381 2.258 20 0 BEADRP CCC(CC)(CC)C[NH2+][C@@H]1C[NH2+]C[C@H]1C ZINC000903963586 584833466 /nfs/dbraw/zinc/83/34/66/584833466.db2.gz BLUUUCPFQYQDKC-VXGBXAGGSA-N 2 0 212.381 2.400 20 0 BEADRP CC[C@H](C)C[C@H](CC)[NH2+][C@@H]1C[NH2+]C[C@H]1C ZINC000903963607 584833472 /nfs/dbraw/zinc/83/34/72/584833472.db2.gz BZPHTLXVGIGPLH-QNWHQSFQSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+][C@H]1CCC[C@@H](C)[C@@H]1C ZINC000903964107 584833932 /nfs/dbraw/zinc/83/39/32/584833932.db2.gz LXPUGVWQDGQARB-NAWOPXAZSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@@H](CCc1ccccc1)C[NH2+][C@@H]1C[NH2+]C[C@H]1C ZINC000903965097 584834396 /nfs/dbraw/zinc/83/43/96/584834396.db2.gz ZZXWVKFHKNDOIS-SQWLQELKSA-N 2 0 246.398 2.453 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+][C@H]1CCC[C@H](C2CC2)C1 ZINC000903965094 584834441 /nfs/dbraw/zinc/83/44/41/584834441.db2.gz ZWNMIGZRUZIJRT-VZZFWQQMSA-N 2 0 222.376 2.153 20 0 BEADRP Cc1ccc(C[NH2+]C[C@@H]2C[NH2+]C[C@H]2C)cc1C ZINC000903964757 584834451 /nfs/dbraw/zinc/83/44/51/584834451.db2.gz PWKBVJLWZUPQQT-HIFRSBDPSA-N 2 0 232.371 2.249 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+][C@H]1CC[C@@H](C)C[C@H]1C ZINC000903964939 584834548 /nfs/dbraw/zinc/83/45/48/584834548.db2.gz YHXJEIJDYIDYDB-NJMOYASZSA-N 2 0 210.365 2.009 20 0 BEADRP CC[C@H]1CCC[C@H]([NH2+]C[C@@H]2C[NH2+]C[C@H]2C)C1 ZINC000903967050 584834722 /nfs/dbraw/zinc/83/47/22/584834722.db2.gz FONGHLKMWMPSAU-RFGFWPKPSA-N 2 0 224.392 2.400 20 0 BEADRP CCCC[C@@H](CC)[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000903968057 584835174 /nfs/dbraw/zinc/83/51/74/584835174.db2.gz QQNVUTRKLCDMFS-FRRDWIJNSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H](CCc1ccccc1)[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000903967344 584835218 /nfs/dbraw/zinc/83/52/18/584835218.db2.gz HUJONFWOMWFCLJ-FMKPAKJESA-N 2 0 246.398 2.453 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[N@@H+]2CCC[C@H]2Cc2ccccc2)C1 ZINC000904307929 584862691 /nfs/dbraw/zinc/86/26/91/584862691.db2.gz YZUUQFLOLUVSEI-XHSDSOJGSA-N 2 0 244.382 2.431 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[N@@H+]2CCCc3sccc3C2)C1 ZINC000904318082 584863879 /nfs/dbraw/zinc/86/38/79/584863879.db2.gz LHIGQKXSRWPFFK-KLPPZKSPSA-N 2 0 236.384 2.234 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+]C2(c3ccc(F)cc3)CC2)C1 ZINC000904329121 584865866 /nfs/dbraw/zinc/86/58/66/584865866.db2.gz WBICDWDYOFTNRG-GSJFWJNXSA-N 2 0 234.318 2.142 20 0 BEADRP CCC[C@](C)(CO)[NH2+]C[C@@H]([NH3+])CCC(C)(C)C ZINC000904330035 584865879 /nfs/dbraw/zinc/86/58/79/584865879.db2.gz XJNUHWJVHBFKKA-GXTWGEPZSA-N 2 0 244.423 2.281 20 0 BEADRP CC(C)(C)CC[C@H]([NH3+])C[NH2+]C1(C)CCOCC1 ZINC000904329185 584866267 /nfs/dbraw/zinc/86/62/67/584866267.db2.gz MDWUAAXLLLFCGX-LBPRGKRZSA-N 2 0 242.407 2.299 20 0 BEADRP CC(C)(C)CC[C@H]([NH3+])C[NH2+][C@@H](CO)C(C)(C)C ZINC000904341509 584867175 /nfs/dbraw/zinc/86/71/75/584867175.db2.gz SXNBBEUECUTLEF-RYUDHWBXSA-N 2 0 244.423 2.137 20 0 BEADRP C[C@H]1C[N@H+](C[C@H]2C[C@@H]([NH3+])C2)CC(C)(C)C1 ZINC000904341847 584867533 /nfs/dbraw/zinc/86/75/33/584867533.db2.gz XJFXFOQVFDQZJN-UTUOFQBUSA-N 2 0 210.365 2.092 20 0 BEADRP C[C@@H]1C[C@@H](c2cccnc2)[N@H+](C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000904341785 584867565 /nfs/dbraw/zinc/86/75/65/584867565.db2.gz VXVXBZCPKMRNAY-UXOAXIEHSA-N 2 0 245.370 2.202 20 0 BEADRP Cc1cc(C)cc(C[N@H+](C)C[C@H]2C[C@@H]([NH3+])C2)c1 ZINC000904346610 584868504 /nfs/dbraw/zinc/86/85/04/584868504.db2.gz WHDOERUFKQFSIV-GASCZTMLSA-N 2 0 232.371 2.473 20 0 BEADRP Cc1cc(C)c2c(c1)C[N@@H+](C[C@H]1C[C@@H]([NH3+])C1)CC2 ZINC000904348558 584868523 /nfs/dbraw/zinc/86/85/23/584868523.db2.gz RVCYJWOBGAYBOJ-OTVXOJSOSA-N 2 0 244.382 2.399 20 0 BEADRP CC(C)C[C@@H](C[NH3+])NC[C@H]([NH3+])CCC(C)(C)C ZINC000904353383 584869946 /nfs/dbraw/zinc/86/99/46/584869946.db2.gz LEODYFCZBNRQLW-OLZOCXBDSA-N 3 0 243.439 2.103 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+]Cc1ccc(C(F)F)c(F)c1 ZINC000904353622 584870156 /nfs/dbraw/zinc/87/01/56/584870156.db2.gz OWQVIDSRAWCMMJ-QMMMGPOBSA-N 2 0 246.276 2.448 20 0 BEADRP C[NH2+]Cc1cccc(NC[C@]2(C)CCC[NH2+]C2)c1 ZINC000904353648 584870129 /nfs/dbraw/zinc/87/01/29/584870129.db2.gz PWMDIXQYONICEV-OAHLLOKOSA-N 2 0 247.386 2.208 20 0 BEADRP COc1cccc2c1CC[C@@H]2[NH2+]C1CC(C[NH3+])C1 ZINC000904360453 584871635 /nfs/dbraw/zinc/87/16/35/584871635.db2.gz KVOVJIRUTAAXIR-MGULZYLOSA-N 2 0 246.354 2.009 20 0 BEADRP COc1cccc2c1CC[C@H]2[NH2+]C1CC(C[NH3+])C1 ZINC000904360454 584871665 /nfs/dbraw/zinc/87/16/65/584871665.db2.gz KVOVJIRUTAAXIR-QIMFLAQGSA-N 2 0 246.354 2.009 20 0 BEADRP C[C@H](Cc1cccs1)[NH2+]C1CC(C[NH3+])C1 ZINC000904362446 584871986 /nfs/dbraw/zinc/87/19/86/584871986.db2.gz NKFQFBXHYCYXSV-KPPDAEKUSA-N 2 0 224.373 2.006 20 0 BEADRP CC[C@@H]([NH2+]C1CC(C[NH3+])C1)c1c(C)noc1C ZINC000904360835 584872148 /nfs/dbraw/zinc/87/21/48/584872148.db2.gz PVSOATDUJXZTAJ-HTAVTVPLSA-N 2 0 237.347 2.069 20 0 BEADRP CC[N@H+](C[C@H]1C[C@@H]([NH3+])C1)C1CC(C)(C)C1 ZINC000904373519 584873774 /nfs/dbraw/zinc/87/37/74/584873774.db2.gz SEABTWCJHMXDCR-PHIMTYICSA-N 2 0 210.365 2.234 20 0 BEADRP C[C@@H]([NH2+]C1CC(C[NH3+])C1)C1CCCCC1 ZINC000904374502 584874085 /nfs/dbraw/zinc/87/40/85/584874085.db2.gz SBQZGRKMPCDUCC-XSRFYTQQSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)[C@H](C[NH2+]C1CC(C[NH3+])C1)c1cccnc1 ZINC000904363520 584874532 /nfs/dbraw/zinc/87/45/32/584874532.db2.gz HKXREPQCUZXRQP-ZALBZXLWSA-N 2 0 247.386 2.148 20 0 BEADRP Cc1cccc(C)c1CC[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000904365334 584874884 /nfs/dbraw/zinc/87/48/84/584874884.db2.gz ZVXAEOZUZRENMW-OKILXGFUSA-N 2 0 232.371 2.173 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[N@H+](CCC2CC2)CC2CC2)C1 ZINC000904379970 584876744 /nfs/dbraw/zinc/87/67/44/584876744.db2.gz YQTLTPQOXMDISO-OKILXGFUSA-N 2 0 222.376 2.236 20 0 BEADRP C/C=C/C[C@H]1CCC[N@H+](C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000904381649 584877496 /nfs/dbraw/zinc/87/74/96/584877496.db2.gz QRVGJGHZWPZDOR-KAAMAIQLSA-N 2 0 222.376 2.402 20 0 BEADRP CC1(C)Nc2ccccc2[C@H]1[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000904385907 584877952 /nfs/dbraw/zinc/87/79/52/584877952.db2.gz JLJXGORZKAHQFV-UHIISALHSA-N 2 0 245.370 2.259 20 0 BEADRP C[C@H]1C[N@H+](CC2(C)CCC2)CC[C@@H]1C[NH3+] ZINC000904409385 584879375 /nfs/dbraw/zinc/87/93/75/584879375.db2.gz ASWKSAOBKIMVPI-NWDGAFQWSA-N 2 0 210.365 2.093 20 0 BEADRP COc1ccccc1C[N@@H+]1CC[C@@H](C[NH3+])[C@@H](C)C1 ZINC000904411859 584879699 /nfs/dbraw/zinc/87/96/99/584879699.db2.gz OLYMYHISTWAKOF-STQMWFEESA-N 2 0 248.370 2.112 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+]CC2(C)CCC2)C1 ZINC000234339953 584929193 /nfs/dbraw/zinc/92/91/93/584929193.db2.gz YGSRHMSNRNWKAO-GFCCVEGCSA-N 2 0 210.365 2.108 20 0 BEADRP Cc1ccc(C[NH2+]C2CCC([NH3+])CC2)cc1F ZINC000104327863 584956546 /nfs/dbraw/zinc/95/65/46/584956546.db2.gz JQIBPXLCGCXFSJ-UHFFFAOYSA-N 2 0 236.334 2.494 20 0 BEADRP Cc1ccc2c(c1)CC[C@@H]2[NH2+]C[C@@H](C)C[NH3+] ZINC000817962451 584992116 /nfs/dbraw/zinc/99/21/16/584992116.db2.gz MJLITHKGROVINV-FZMZJTMJSA-N 2 0 218.344 2.167 20 0 BEADRP C[NH+](C)CC1CCC([NH2+]Cc2ccoc2)CC1 ZINC000749824372 585206968 /nfs/dbraw/zinc/20/69/68/585206968.db2.gz XLKHGIAUEMITCP-UHFFFAOYSA-N 2 0 236.359 2.490 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]C2CC(C(F)F)C2)CC1 ZINC000768675022 585541536 /nfs/dbraw/zinc/54/15/36/585541536.db2.gz VSMKWAYIUQHWRK-UHFFFAOYSA-N 2 0 246.345 2.493 20 0 BEADRP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+]C2CC(C(F)F)C2)C1 ZINC000769528250 585558815 /nfs/dbraw/zinc/55/88/15/585558815.db2.gz UVNQZSGLPGKCLI-RUJICJSRSA-N 2 0 246.345 2.493 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]1[NH2+]CCc1cccs1 ZINC000300806303 585681906 /nfs/dbraw/zinc/68/19/06/585681906.db2.gz GJRCTDOCMYRRFZ-LBPRGKRZSA-N 2 0 238.400 2.268 20 0 BEADRP CCC[N@H+](C)C[C@H]1CC[NH+]([C@@H](C)C2CC2)C1 ZINC000782185546 585810178 /nfs/dbraw/zinc/81/01/78/585810178.db2.gz HGSNFLPSTGCFKQ-QWHCGFSZSA-N 2 0 224.392 2.449 20 0 BEADRP CCC[C@H](C)[N@H+](C)CC1CC[NH+](C)CC1 ZINC000782185117 585811048 /nfs/dbraw/zinc/81/10/48/585811048.db2.gz WXJVZLFSHZAKJY-LBPRGKRZSA-N 2 0 212.381 2.449 20 0 BEADRP C[C@@H]1C[C@@H](C)C[NH+](CC2CC[NH+](C)CC2)C1 ZINC000788471715 585925436 /nfs/dbraw/zinc/92/54/36/585925436.db2.gz YVABGPKDJVUHNZ-CHWSQXEVSA-N 2 0 224.392 2.306 20 0 BEADRP CC[C@@H](C)[N@@H+]1CC[C@@]2(C1)CCC[NH+](C)C2 ZINC000815145978 586670571 /nfs/dbraw/zinc/67/05/71/586670571.db2.gz JQYNLQZIKSDWAC-OLZOCXBDSA-N 2 0 210.365 2.203 20 0 BEADRP CC(C)Oc1cccc(C[NH2+][C@@H](C)C2C[NH2+]C2)c1 ZINC000817888968 586832094 /nfs/dbraw/zinc/83/20/94/586832094.db2.gz QLNFACVEAMKAQW-LBPRGKRZSA-N 2 0 248.370 2.171 20 0 BEADRP CSC(C)(C)C[NH2+][C@@H]1CCCCC[C@H]1[NH3+] ZINC000817900311 586835876 /nfs/dbraw/zinc/83/58/76/586835876.db2.gz ODHXNDRQGVGNSF-GHMZBOCLSA-N 2 0 230.421 2.378 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]C[C@@]1(C)CC1(Cl)Cl ZINC000817937603 586844302 /nfs/dbraw/zinc/84/43/02/586844302.db2.gz SRHIGGCGZODMHT-XHNCKOQMSA-N 2 0 239.190 2.286 20 0 BEADRP C[NH2+]CCC[NH2+][C@H]1CCc2cc(C)ccc21 ZINC000817942171 586844976 /nfs/dbraw/zinc/84/49/76/586844976.db2.gz YBWMAZLIQTWQGN-AWEZNQCLSA-N 2 0 218.344 2.181 20 0 BEADRP C[C@@H](CSC(C)(C)C)[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000817945541 586846120 /nfs/dbraw/zinc/84/61/20/586846120.db2.gz FWYQBJNSKOGRQD-RYUDHWBXSA-N 2 0 244.448 2.496 20 0 BEADRP CC[C@H]1CC[C@H]1[NH2+]Cc1ccc(CC[NH3+])cc1 ZINC000817947865 586847027 /nfs/dbraw/zinc/84/70/27/586847027.db2.gz DCIQZOUNHGIYMY-LSDHHAIUSA-N 2 0 232.371 2.466 20 0 BEADRP C[C@H](CSC(C)(C)C)[NH2+]C[C@@H](C)C[NH3+] ZINC000817961995 586852326 /nfs/dbraw/zinc/85/23/26/586852326.db2.gz GBDSOPBGXLQTGQ-VHSXEESVSA-N 2 0 218.410 2.091 20 0 BEADRP Cc1cc(F)ccc1[C@@H](C)[NH2+]C[C@@H](C)C[NH3+] ZINC000817961616 586852494 /nfs/dbraw/zinc/85/24/94/586852494.db2.gz AZMVEYLYAZMDDD-GXSJLCMTSA-N 2 0 224.323 2.380 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H](C)CSC(C)(C)C ZINC000817961996 586853422 /nfs/dbraw/zinc/85/34/22/586853422.db2.gz GBDSOPBGXLQTGQ-ZJUUUORDSA-N 2 0 218.410 2.091 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@@H](C)CSC(C)(C)C ZINC000817961994 586853461 /nfs/dbraw/zinc/85/34/61/586853461.db2.gz GBDSOPBGXLQTGQ-UWVGGRQHSA-N 2 0 218.410 2.091 20 0 BEADRP C[C@@H](CSC(C)(C)C)[NH2+]C[C@H]([NH3+])C1CC1 ZINC000817965646 586855291 /nfs/dbraw/zinc/85/52/91/586855291.db2.gz SRDMAZXFGHCDJB-ONGXEEELSA-N 2 0 230.421 2.234 20 0 BEADRP C1CC1[C@@H]1CC[C@@H]1[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000817984813 586862783 /nfs/dbraw/zinc/86/27/83/586862783.db2.gz AIYODOFAJSOFAU-RDBSUJKOSA-N 2 0 234.387 2.439 20 0 BEADRP C1CC1[C@H]1CC[C@H]1[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000817984812 586862809 /nfs/dbraw/zinc/86/28/09/586862809.db2.gz AIYODOFAJSOFAU-MGPQQGTHSA-N 2 0 234.387 2.439 20 0 BEADRP CC[N@@H+]1CCC[C@H](C[NH2+][C@H]2CSC[C@@H]2C)C1 ZINC000823736912 587238605 /nfs/dbraw/zinc/23/86/05/587238605.db2.gz OPBQWUZRPJEWLH-XQQFMLRXSA-N 2 0 242.432 2.059 20 0 BEADRP CN1CC[C@H]([NH2+]C2CCc3ccccc3CC2)C1 ZINC000834566072 587759609 /nfs/dbraw/zinc/75/96/09/587759609.db2.gz BCMXTKWOWMPEJR-INIZCTEOSA-N 2 0 244.382 2.228 20 0 BEADRP CC[C@@H]([NH3+])CNCc1ccc2c(c1)CC(C)(C)O2 ZINC000841073509 587943896 /nfs/dbraw/zinc/94/38/96/587943896.db2.gz YCOOHSQLSKRSOR-CYBMUJFWSA-N 2 0 248.370 2.227 20 0 BEADRP [NH3+]CCC[C@@H]([NH2+][C@H]1CCCOC1)c1ccccc1 ZINC000841088239 587946105 /nfs/dbraw/zinc/94/61/05/587946105.db2.gz YTFXCXRPVSUXJB-LSDHHAIUSA-N 2 0 248.370 2.235 20 0 BEADRP C[C@@H](C[N@@H+]1CC[C@@]2(CCC[NH2+]2)C1)C(C)(C)C ZINC000841105338 587946823 /nfs/dbraw/zinc/94/68/23/587946823.db2.gz KIRODYTYJBEPPE-JSGCOSHPSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1cc(CN(C)CCCCCCC[NH3+])no1 ZINC000842471782 588028838 /nfs/dbraw/zinc/02/88/38/588028838.db2.gz ZOGCDUNSZLGNTI-UHFFFAOYSA-N 2 0 239.363 2.324 20 0 BEADRP Cc1cc([C@@H]2CCC[N@@H+]2CC[C@H]2CC[NH2+]C2)no1 ZINC000842471443 588029268 /nfs/dbraw/zinc/02/92/68/588029268.db2.gz BJRKOSCIOVSKER-OCCSQVGLSA-N 2 0 249.358 2.120 20 0 BEADRP C[C@@H](C[NH2+]C[C@@H]1CCC[NH2+]1)Cc1cccs1 ZINC000843125890 588084488 /nfs/dbraw/zinc/08/44/88/588084488.db2.gz KDTKPZXZZJUTKS-NEPJUHHUSA-N 2 0 238.400 2.268 20 0 BEADRP Cc1cc(C[NH2+][C@H](C)C[C@H](C)[NH3+])cnc1Cl ZINC000843126844 588084796 /nfs/dbraw/zinc/08/47/96/588084796.db2.gz AGIVVRSEZAEMEJ-VHSXEESVSA-N 2 0 241.766 2.259 20 0 BEADRP CC(C)n1cc(C[NH2+]CCCCCC[NH3+])cn1 ZINC000843127964 588084983 /nfs/dbraw/zinc/08/49/83/588084983.db2.gz SGJMWVXZBKBJOJ-UHFFFAOYSA-N 2 0 238.379 2.073 20 0 BEADRP C[C@H]([NH2+]CCCCCC[NH3+])c1cncs1 ZINC000843340360 588101132 /nfs/dbraw/zinc/10/11/32/588101132.db2.gz BMFXJLWITBFXJW-JTQLQIEISA-N 2 0 227.377 2.313 20 0 BEADRP COCC1CCC([NH2+]CCCCCC[NH3+])CC1 ZINC000843342419 588101608 /nfs/dbraw/zinc/10/16/08/588101608.db2.gz QLJGEUZVRISELZ-UHFFFAOYSA-N 2 0 242.407 2.300 20 0 BEADRP COCCCCC[N@H+](C)C1CCC([NH3+])CC1 ZINC000843355444 588102985 /nfs/dbraw/zinc/10/29/85/588102985.db2.gz OZESAKPYTWGTCG-UHFFFAOYSA-N 2 0 228.380 2.005 20 0 BEADRP C[C@@H]1C[N@H+](C[C@@H]2CC[NH2+]C2)Cc2ccccc21 ZINC000843356217 588103289 /nfs/dbraw/zinc/10/32/89/588103289.db2.gz HTVRRHIWVARPAI-CHWSQXEVSA-N 2 0 230.355 2.215 20 0 BEADRP C[N@H+](C[C@H]1CC[NH2+]C1)[C@@H]1CCc2ccccc2C1 ZINC000843358335 588103619 /nfs/dbraw/zinc/10/36/19/588103619.db2.gz KYGNBVCLBFKWFG-XJKSGUPXSA-N 2 0 244.382 2.085 20 0 BEADRP Cc1ccc(OCC[NH2+][C@](C)(C[NH3+])C2CC2)cc1 ZINC000843356674 588103672 /nfs/dbraw/zinc/10/36/72/588103672.db2.gz ZXCBWIXWBLOAOB-OAHLLOKOSA-N 2 0 248.370 2.091 20 0 BEADRP CC(C)CC1CC[NH+](C[C@@H]2CC[NH2+]C2)CC1 ZINC000843359723 588104268 /nfs/dbraw/zinc/10/42/68/588104268.db2.gz WXGMGFMJXDHKDY-CQSZACIVSA-N 2 0 224.392 2.354 20 0 BEADRP CCc1cccc(C[NH2+][C@@H]2CCN(C)C2)c1 ZINC000845935782 588250751 /nfs/dbraw/zinc/25/07/51/588250751.db2.gz SUHBVRNBOJCHGC-CQSZACIVSA-N 2 0 218.344 2.043 20 0 BEADRP CC(C)C[N@H+](C)CCC[NH2+]C[C@@H]1CCC=CO1 ZINC000845996033 588252787 /nfs/dbraw/zinc/25/27/87/588252787.db2.gz JJVZFLAZDWOLPL-AWEZNQCLSA-N 2 0 240.391 2.247 20 0 BEADRP [NH3+]CCCCCC[N@@H+]1CCC[C@@H]2COCC[C@@H]21 ZINC000846219037 588260742 /nfs/dbraw/zinc/26/07/42/588260742.db2.gz DFPBIWTYDBQHEH-KGLIPLIRSA-N 2 0 240.391 2.006 20 0 BEADRP C[C@@H]1C[C@H]([NH3+])CC[N@@H+]1Cc1ccc2c(c1)COC2 ZINC000846699875 588283522 /nfs/dbraw/zinc/28/35/22/588283522.db2.gz YBKFBJUEHSMURG-IAQYHMDHSA-N 2 0 246.354 2.028 20 0 BEADRP C[C@H]1C[C@@H]([NH3+])CC[N@@H+]1Cc1ccc2c(c1)COC2 ZINC000846699878 588283539 /nfs/dbraw/zinc/28/35/39/588283539.db2.gz YBKFBJUEHSMURG-NHYWBVRUSA-N 2 0 246.354 2.028 20 0 BEADRP CC[C@H]([NH2+]CCN1CCCC1)[C@@H]1CCCCO1 ZINC000847089855 588305724 /nfs/dbraw/zinc/30/57/24/588305724.db2.gz LJZPEALHZUSGGI-KBPBESRZSA-N 2 0 240.391 2.020 20 0 BEADRP CC(C)(C)[NH2+]CCCNC(=[NH2+])Nc1ccccc1 ZINC000848994028 588428203 /nfs/dbraw/zinc/42/82/03/588428203.db2.gz IUDJBSRKHUVUSQ-UHFFFAOYSA-N 2 0 248.374 2.401 20 0 BEADRP C[C@@H]1CCCN1CC[NH2+]C1CC(CF)(CF)C1 ZINC000850440238 588546584 /nfs/dbraw/zinc/54/65/84/588546584.db2.gz YWEUKUULTBLZTD-LLVKDONJSA-N 2 0 246.345 2.148 20 0 BEADRP C[C@H]1CC[C@H]1[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000850583361 588561833 /nfs/dbraw/zinc/56/18/33/588561833.db2.gz NPHQSRJHXCQBSU-SWLSCSKDSA-N 2 0 236.403 2.497 20 0 BEADRP CC[C@@H]([NH2+]CCOCC[NH2+]C)C1CCCCC1 ZINC000863542007 589297196 /nfs/dbraw/zinc/29/71/96/589297196.db2.gz DEVFNHXIPPWNOQ-CQSZACIVSA-N 2 0 242.407 2.171 20 0 BEADRP [NH3+]CCC[N@@H+]1C[C@@H]2C[C@@H](c3ccccc3)[C@@H]2C1 ZINC000863557766 589298935 /nfs/dbraw/zinc/29/89/35/589298935.db2.gz QYPUDEASDMDTRE-SOUVJXGZSA-N 2 0 230.355 2.071 20 0 BEADRP C[C@H]([NH3+])CN(C)CCCc1cccc(F)c1 ZINC000863568654 589299961 /nfs/dbraw/zinc/29/99/61/589299961.db2.gz NFWUPOYRZRAPRZ-NSHDSACASA-N 2 0 224.323 2.037 20 0 BEADRP COC1(C[NH2+]CCCCCC[NH3+])CCCC1 ZINC000863641955 589306574 /nfs/dbraw/zinc/30/65/74/589306574.db2.gz GVXMZTONNNHMMH-UHFFFAOYSA-N 2 0 228.380 2.054 20 0 BEADRP CCc1cc(N2CC[C@@H]3[C@@H](CC[N@@H+]3C)C2)cc[nH+]1 ZINC000866206197 589480224 /nfs/dbraw/zinc/48/02/24/589480224.db2.gz BYVAPYLYPSMFKE-SWLSCSKDSA-N 2 0 245.370 2.174 20 0 BEADRP CC(C)C[N@@H+]1CC[C@@](C[NH3+])(C(C)(C)C)C1 ZINC000866704183 589513905 /nfs/dbraw/zinc/51/39/05/589513905.db2.gz RNGXSVWXLVRMTO-ZDUSSCGKSA-N 2 0 212.381 2.339 20 0 BEADRP Cc1cncc([C@@H]2CCC[N@@H+]2C[C@H]2CC[NH2+]C2)c1 ZINC000866720421 589515357 /nfs/dbraw/zinc/51/53/57/589515357.db2.gz KXFDCEHTRCPLMI-ZFWWWQNUSA-N 2 0 245.370 2.136 20 0 BEADRP CC[C@@H]([NH2+]CCOCC[NH+](C)C)C(C)(C)CC ZINC000872064836 589863462 /nfs/dbraw/zinc/86/34/62/589863462.db2.gz MWLPLQFARCIHGF-CYBMUJFWSA-N 2 0 244.423 2.369 20 0 BEADRP CCc1cccc(C[N@@H+]2C[C@@H]3C[NH2+]C[C@]3(C)C2)c1 ZINC000872154141 589885884 /nfs/dbraw/zinc/88/58/84/589885884.db2.gz OPFLLQKVVMFSBB-JKSUJKDBSA-N 2 0 244.382 2.290 20 0 BEADRP CC(C)([NH3+])C[N@@H+]1CCC[C@H](OC2CCC2)CC1 ZINC000872257567 589901057 /nfs/dbraw/zinc/90/10/57/589901057.db2.gz TVIQUBNDECWVCI-ZDUSSCGKSA-N 2 0 240.391 2.147 20 0 BEADRP CC(C)CC[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000872254319 589901383 /nfs/dbraw/zinc/90/13/83/589901383.db2.gz ZLNCBQMLFNHJBH-LBPRGKRZSA-N 2 0 212.381 2.400 20 0 BEADRP C[NH+](C)C1CCN(c2cc[nH+]cc2C2CC2)CC1 ZINC000872408629 589936338 /nfs/dbraw/zinc/93/63/38/589936338.db2.gz CQEAALDDWVNTJS-UHFFFAOYSA-N 2 0 245.370 2.489 20 0 BEADRP c1cc(N2CC[NH+](C3CC3)CC2)c(C2CC2)c[nH+]1 ZINC000872428372 589939050 /nfs/dbraw/zinc/93/90/50/589939050.db2.gz CCVXIGXBIMMHMT-UHFFFAOYSA-N 2 0 243.354 2.243 20 0 BEADRP C[C@@H](CC[NH+](C)C)Nc1cc[nH+]cc1C1CC1 ZINC000872429700 589939085 /nfs/dbraw/zinc/93/90/85/589939085.db2.gz NQINWASAUMKSJQ-NSHDSACASA-N 2 0 233.359 2.133 20 0 BEADRP C[NH+](C)[C@@H](CNc1cc[nH+]cc1C1CC1)C1CC1 ZINC000872443469 589939924 /nfs/dbraw/zinc/93/99/24/589939924.db2.gz QXBZHQLYLDZYTI-HNNXBMFYSA-N 2 0 245.370 2.133 20 0 BEADRP C[C@@H]1CN(c2cc[nH+]cc2C2CC2)C[C@H](C)[N@H+]1C ZINC000872554026 589949576 /nfs/dbraw/zinc/94/95/76/589949576.db2.gz GLVJPLDKELEAPP-TXEJJXNPSA-N 2 0 245.370 2.488 20 0 BEADRP C([N@@H+]1CCCC2(CCCC2)C1)C12CC(C1)C[NH2+]2 ZINC000873208921 589995493 /nfs/dbraw/zinc/99/54/93/589995493.db2.gz YAUXWIMQPGERAH-UHFFFAOYSA-N 2 0 234.387 2.395 20 0 BEADRP [NH3+][C@@H]1C[C@H]1c1ccc(N[C@H]2CCC[C@H]([NH3+])C2)cc1 ZINC000873215650 589997979 /nfs/dbraw/zinc/99/79/79/589997979.db2.gz KKPWIHNPRZUTGO-CYUUQNCZSA-N 2 0 245.370 2.183 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCC[C@@H]1C)C1CC[NH2+]CC1 ZINC000873219926 589998549 /nfs/dbraw/zinc/99/85/49/589998549.db2.gz BVNWPNDAYIYWQZ-LOWVWBTDSA-N 2 0 210.365 2.153 20 0 BEADRP CCC[C@@H](C)C[NH2+][C@H](C)C1CC[NH2+]CC1 ZINC000873220304 589998880 /nfs/dbraw/zinc/99/88/80/589998880.db2.gz IZISTMWYKPYASK-VXGBXAGGSA-N 2 0 212.381 2.400 20 0 BEADRP CCCC[C@@H](COC)[NH2+][C@@H](C)C1CC[NH2+]CC1 ZINC000873220087 589999087 /nfs/dbraw/zinc/99/90/87/589999087.db2.gz JBBGZMZNDPYKOD-JSGCOSHPSA-N 2 0 242.407 2.169 20 0 BEADRP Cn1ccc(C[N@@H+]2CC[C@](C[NH3+])(C(C)(C)C)C2)c1 ZINC000873223924 590000533 /nfs/dbraw/zinc/00/05/33/590000533.db2.gz UUWGTQXMCJSUGW-OAHLLOKOSA-N 2 0 249.402 2.222 20 0 BEADRP CCC(CC)C[NH2+][C@@]12CCC[C@H]1[NH2+]CC2 ZINC000873229810 590001920 /nfs/dbraw/zinc/00/19/20/590001920.db2.gz GJORUKXVMMZFSP-CHWSQXEVSA-N 2 0 210.365 2.297 20 0 BEADRP C([NH2+][C@]12CCC[C@@H]1[NH2+]CC2)C1CCCCC1 ZINC000873229644 590002286 /nfs/dbraw/zinc/00/22/86/590002286.db2.gz DGGWYXYZDJWCDC-KBPBESRZSA-N 2 0 222.376 2.441 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]CC[C@H]1CCSC1 ZINC000873235972 590004688 /nfs/dbraw/zinc/00/46/88/590004688.db2.gz SBSDUSMOFMYDFZ-FRRDWIJNSA-N 2 0 242.432 2.107 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]CC[C@@H]1CCCS1 ZINC000873243265 590006613 /nfs/dbraw/zinc/00/66/13/590006613.db2.gz KIRLUYYXGUDBRZ-AGIUHOORSA-N 2 0 242.432 2.250 20 0 BEADRP CCC[C@@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccccn1 ZINC000873250085 590007344 /nfs/dbraw/zinc/00/73/44/590007344.db2.gz DJXBKIDFSMYRHN-FRRDWIJNSA-N 2 0 233.359 2.250 20 0 BEADRP C[C@H]1CC(C)(C)C[C@H]1[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873248846 590007498 /nfs/dbraw/zinc/00/74/98/590007498.db2.gz FMQBQXHCGRBNAY-NNYUYHANSA-N 2 0 210.365 2.138 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@H]2CCCc3c(O)cccc32)C1 ZINC000873250337 590007949 /nfs/dbraw/zinc/00/79/49/590007949.db2.gz PBYULBNBFOPQEK-WDMOLILDSA-N 2 0 246.354 2.097 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@H](c2ccccc2)C2CC2)C1 ZINC000873251404 590007972 /nfs/dbraw/zinc/00/79/72/590007972.db2.gz MKLZTHIRUASVRA-BYCMXARLSA-N 2 0 230.355 2.465 20 0 BEADRP C[C@H](CCCc1cccnc1)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873251109 590008593 /nfs/dbraw/zinc/00/85/93/590008593.db2.gz SZZFRGAJAYIILO-YUELXQCFSA-N 2 0 247.386 2.120 20 0 BEADRP Cc1cc([C@@H](C)[NH2+]C[C@H]2C[C@@H]([NH3+])C2)c(C)o1 ZINC000873252192 590009172 /nfs/dbraw/zinc/00/91/72/590009172.db2.gz PVNFQOKHZGCGMP-JLLWLGSASA-N 2 0 222.332 2.284 20 0 BEADRP CCc1ccc([C@@H](C)[NH2+]C[C@H]2C[C@@H]([NH3+])C2)o1 ZINC000873253536 590009469 /nfs/dbraw/zinc/00/94/69/590009469.db2.gz ADLCRZGNMRKGGS-MXWKQRLJSA-N 2 0 222.332 2.230 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccsc1 ZINC000873253606 590009576 /nfs/dbraw/zinc/00/95/76/590009576.db2.gz BCGFBOQSOXIULL-KKZNHRDASA-N 2 0 210.346 2.136 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@@H](Cc2ccccc2)C2CC2)C1 ZINC000873254068 590009673 /nfs/dbraw/zinc/00/96/73/590009673.db2.gz KDYIJZQTAAUSPA-IMJJTQAJSA-N 2 0 244.382 2.335 20 0 BEADRP CC[C@H]1CCCC[C@H]1[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873253172 590009680 /nfs/dbraw/zinc/00/96/80/590009680.db2.gz ZPZVJLJEDOIAMP-WUHRBBMRSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H](Cc1ccc(F)cc1)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873254137 590009827 /nfs/dbraw/zinc/00/98/27/590009827.db2.gz LQLPUOVMMJWWCI-QKCSRTOESA-N 2 0 236.334 2.084 20 0 BEADRP CC[C@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccc(OC)cc1 ZINC000873254685 590010132 /nfs/dbraw/zinc/01/01/32/590010132.db2.gz AKJYZDZHQBZMJF-LNSITVRQSA-N 2 0 248.370 2.473 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@H]2CCCc3ccccc32)C1 ZINC000873254764 590010332 /nfs/dbraw/zinc/01/03/32/590010332.db2.gz BXJMVPBJXVUYHV-LNSITVRQSA-N 2 0 230.355 2.391 20 0 BEADRP CCc1cccnc1[C@H](C)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873254944 590010431 /nfs/dbraw/zinc/01/04/31/590010431.db2.gz CAARQDCMYLBCEW-GVXVVHGQSA-N 2 0 233.359 2.032 20 0 BEADRP CC1(C)CCC[C@@H]([NH2+]C[C@H]2C[C@H]([NH3+])C2)C1 ZINC000873256298 590010635 /nfs/dbraw/zinc/01/06/35/590010635.db2.gz MXYJCLAYLPCGAG-IJLUTSLNSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+][C@H]2CCCc3ccc(O)cc32)C1 ZINC000873256141 590011042 /nfs/dbraw/zinc/01/10/42/590011042.db2.gz KNHGRVWBMYWYBA-WBIUFABUSA-N 2 0 246.354 2.097 20 0 BEADRP COc1cc(C)ccc1[C@H](C)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873256248 590011268 /nfs/dbraw/zinc/01/12/68/590011268.db2.gz NCKCQZHCMGFLCY-RWMBFGLXSA-N 2 0 248.370 2.392 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+][C@H]2CCCc3sccc32)C1 ZINC000873257053 590011733 /nfs/dbraw/zinc/01/17/33/590011733.db2.gz DQFGGAUPSWKVGU-NHCYSSNCSA-N 2 0 236.384 2.452 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1cc(F)ccc1F ZINC000873257059 590011823 /nfs/dbraw/zinc/01/18/23/590011823.db2.gz DTKURWLVYMBUGN-QXEWZRGKSA-N 2 0 240.297 2.353 20 0 BEADRP Cc1cccc([C@H](C)[NH2+]C[C@H]2C[C@H]([NH3+])C2)c1 ZINC000873257867 590012167 /nfs/dbraw/zinc/01/21/67/590012167.db2.gz LHWBYDMOIXIYJK-OBJOEFQTSA-N 2 0 218.344 2.383 20 0 BEADRP CC1(C)CCC([NH2+]C[C@H]2C[C@H]([NH3+])C2)CC1 ZINC000873257514 590012340 /nfs/dbraw/zinc/01/23/40/590012340.db2.gz TWVYYYQZOVRVJY-XYPYZODXSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H](CCc1ccsc1)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873259086 590012870 /nfs/dbraw/zinc/01/28/70/590012870.db2.gz YSSXUTZYQRUWLT-RAIGVLPGSA-N 2 0 238.400 2.396 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+]C2C3CC4CC(C3)CC2C4)C1 ZINC000873258506 590012873 /nfs/dbraw/zinc/01/28/73/590012873.db2.gz QOWLLKLHLMSNSD-JJAJUMEASA-N 2 0 234.387 2.138 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+][C@H]2CCc3cc(F)ccc32)C1 ZINC000873258757 590012907 /nfs/dbraw/zinc/01/29/07/590012907.db2.gz UFPRCEQPDFSFDD-WFBYXXMGSA-N 2 0 234.318 2.140 20 0 BEADRP COc1cccc([C@@H](C)[NH2+]C[C@H]2C[C@H]([NH3+])C2)c1 ZINC000873258950 590013080 /nfs/dbraw/zinc/01/30/80/590013080.db2.gz WOYCDPADLAYVPV-NQBHXWOUSA-N 2 0 234.343 2.083 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+][C@@H]2CCc3ccccc32)C1 ZINC000873258986 590013191 /nfs/dbraw/zinc/01/31/91/590013191.db2.gz XNTNGMIFHFMION-MPKXVKKWSA-N 2 0 216.328 2.001 20 0 BEADRP C[C@H]1CC[C@H]([NH2+]C[C@H]2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000873259664 590013378 /nfs/dbraw/zinc/01/33/78/590013378.db2.gz JDZGVEDESPXGLI-YHQUGGNUSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@H]1CCC[C@H]1[NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000873260418 590013397 /nfs/dbraw/zinc/01/33/97/590013397.db2.gz ZZJKJANNTOKETI-PDWCTOEPSA-N 2 0 222.376 2.295 20 0 BEADRP Cc1cc([C@@H](C)[NH2+]C[C@H]2C[C@H]3CC[C@@H](C2)[NH2+]3)no1 ZINC000873260494 590013667 /nfs/dbraw/zinc/01/36/67/590013667.db2.gz BRXGQXQIWCYWLU-FVCCEPFGSA-N 2 0 249.358 2.164 20 0 BEADRP C([NH2+][C@H]1CCCSC1)[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000873264736 590014643 /nfs/dbraw/zinc/01/46/43/590014643.db2.gz QVSGFTKZSUXKBJ-RNJOBUHISA-N 2 0 240.416 2.002 20 0 BEADRP CC[C@@H](C)[C@@H](C)[NH2+][C@H](C)C1CC[NH2+]CC1 ZINC000873264515 590015145 /nfs/dbraw/zinc/01/51/45/590015145.db2.gz FYIWMLOGRPXATH-IJLUTSLNSA-N 2 0 212.381 2.399 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+][C@H](C)C1CC[NH2+]CC1 ZINC000873269517 590015292 /nfs/dbraw/zinc/01/52/92/590015292.db2.gz QUMXYHLBELIVNK-NQBHXWOUSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)[C@H]1CC[C@H]1[NH2+][C@H](C)C1CC[NH2+]CC1 ZINC000873268945 590015530 /nfs/dbraw/zinc/01/55/30/590015530.db2.gz IZBGYNPVXJIYDI-MRVWCRGKSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[C@@H]1C1CC1)C1CC[NH2+]CC1 ZINC000873269148 590015602 /nfs/dbraw/zinc/01/56/02/590015602.db2.gz MSEIFWBPFLXYLD-HONMWMINSA-N 2 0 222.376 2.153 20 0 BEADRP Cc1cncc([C@@H](C)[NH2+][C@H](C)C2CC[NH2+]CC2)c1 ZINC000873269206 590015680 /nfs/dbraw/zinc/01/56/80/590015680.db2.gz NQDBZYHYTKKZHC-CHWSQXEVSA-N 2 0 247.386 2.429 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+][C@H](C)C1CC[NH2+]CC1 ZINC000873268946 590015691 /nfs/dbraw/zinc/01/56/91/590015691.db2.gz IZBGYNPVXJIYDI-XBFCOCLRSA-N 2 0 224.392 2.399 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+][C@@H](C)C1CC[NH2+]CC1 ZINC000873272242 590015963 /nfs/dbraw/zinc/01/59/63/590015963.db2.gz QUMXYHLBELIVNK-DMDPSCGWSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC12CCC2)C1CC[NH2+]CC1 ZINC000873272271 590016177 /nfs/dbraw/zinc/01/61/77/590016177.db2.gz RFCJVYCSNKIPGQ-WCQYABFASA-N 2 0 222.376 2.297 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+]C1CC(Nc2ccccc2)C1 ZINC000873295323 590024033 /nfs/dbraw/zinc/02/40/33/590024033.db2.gz FRYUMYSBLRYALE-PFSRBDOWSA-N 2 0 245.370 2.099 20 0 BEADRP C[C@@H](CC1CCCC1)[NH2+][C@H]1CCN(C)C1 ZINC000125586628 590171949 /nfs/dbraw/zinc/17/19/49/590171949.db2.gz AIWHJZRENOYRIG-AAEUAGOBSA-N 2 0 210.365 2.249 20 0 BEADRP CSC(C)(C)CC[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000877618575 590375477 /nfs/dbraw/zinc/37/54/77/590375477.db2.gz ZOSBTBZKIOBKDH-TXEJJXNPSA-N 2 0 244.448 2.448 20 0 BEADRP CC(C)C1(C[N@@H+]2CC[C@H]3[C@H](CC[NH+]3C)C2)CC1 ZINC000877738844 590407111 /nfs/dbraw/zinc/40/71/11/590407111.db2.gz MOAAABAGEOMOJB-KGLIPLIRSA-N 2 0 236.403 2.449 20 0 BEADRP C=C/C=C\CC[N@@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000878125828 590501810 /nfs/dbraw/zinc/50/18/10/590501810.db2.gz SFJWRLCOASDRLS-GEXIGZQTSA-N 2 0 222.376 2.392 20 0 BEADRP C=C/C=C\CC[N@@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000878125830 590501830 /nfs/dbraw/zinc/50/18/30/590501830.db2.gz SFJWRLCOASDRLS-GXMNPTEKSA-N 2 0 222.376 2.392 20 0 BEADRP C=C/C=C\CC[NH+]1CCN(c2cc[nH+]cc2)CC1 ZINC000878190095 590520330 /nfs/dbraw/zinc/52/03/30/590520330.db2.gz DFPLFVWUQKSYLS-ARJAWSKDSA-N 2 0 243.354 2.336 20 0 BEADRP Cc1ccccc1OCC[N@H+]1CC[C@H]([C@@H](C)[NH3+])C1 ZINC000127210304 590593787 /nfs/dbraw/zinc/59/37/87/590593787.db2.gz NFOWNJQPUDWWPD-KGLIPLIRSA-N 2 0 248.370 2.043 20 0 BEADRP CC[NH+](CC)CCC[N@@H+]1CCC[C@H](CF)C1 ZINC000880236828 590968170 /nfs/dbraw/zinc/96/81/70/590968170.db2.gz JYZHMANYQBOEPT-CYBMUJFWSA-N 2 0 230.371 2.400 20 0 BEADRP C[N@@H+]1CCCC[C@H]1CC[NH+]1CCC(F)CC1 ZINC000880242482 590975838 /nfs/dbraw/zinc/97/58/38/590975838.db2.gz AUBZGOKOUBFUKS-ZDUSSCGKSA-N 2 0 228.355 2.295 20 0 BEADRP CC[C@@H](C)[N@@H+]1CCN(c2cc[nH+]cc2)[C@H](C)C1 ZINC000880258895 590979381 /nfs/dbraw/zinc/97/93/81/590979381.db2.gz DTDKOFKGIJKAIV-CHWSQXEVSA-N 2 0 233.359 2.391 20 0 BEADRP C[C@@H]1C[N@H+](CCC2CC2)CCN1c1cc[nH+]cc1 ZINC000880260684 590980476 /nfs/dbraw/zinc/98/04/76/590980476.db2.gz RESHBHAEZDDIAW-CYBMUJFWSA-N 2 0 245.370 2.392 20 0 BEADRP CC1([NH+]2CCC2)CC[NH+](C2CCCC2)CC1 ZINC000880473252 591053171 /nfs/dbraw/zinc/05/31/71/591053171.db2.gz ALRXBODMFYXCDW-UHFFFAOYSA-N 2 0 222.376 2.489 20 0 BEADRP c1ccc2c(c1)CC[C@@H]2[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000128895317 591176307 /nfs/dbraw/zinc/17/63/07/591176307.db2.gz NAURYGMRUPFCLB-HIFRSBDPSA-N 2 0 230.355 2.406 20 0 BEADRP C[C@@H]1[C@@H]([NH2+]C2CC2)CCN1Cc1ccccc1 ZINC000211491444 591177251 /nfs/dbraw/zinc/17/72/51/591177251.db2.gz ZTHHDIVOPLDQQO-DOMZBBRYSA-N 2 0 230.355 2.401 20 0 BEADRP Cc1cc(N2CCC(C)([NH+]3CCC3)CC2)cc[nH+]1 ZINC000882964128 591486842 /nfs/dbraw/zinc/48/68/42/591486842.db2.gz UAQAAWNQLMBGEF-UHFFFAOYSA-N 2 0 245.370 2.455 20 0 BEADRP Cl/C=C\C[NH+]1CCC([C@@H]2CCC[NH2+]2)CC1 ZINC000214377260 591554102 /nfs/dbraw/zinc/55/41/02/591554102.db2.gz IFEJWLIIBVHAGW-DWMUBGRBSA-N 2 0 228.767 2.203 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]C[C@@H]2C=CCC2)[C@H](C)C1 ZINC000883247011 591587985 /nfs/dbraw/zinc/58/79/85/591587985.db2.gz XHBYMRZJMNKGCK-MCIONIFRSA-N 2 0 222.376 2.273 20 0 BEADRP CCN1CC[C@@H]1C[NH2+]C1CC(OC(C)(C)C)C1 ZINC000883355072 591626562 /nfs/dbraw/zinc/62/65/62/591626562.db2.gz IJYPPHIFSIRBDP-OTTFEQOBSA-N 2 0 240.391 2.016 20 0 BEADRP FC1(F)CCC[C@@H]1CCN1CCC[NH2+]CC1 ZINC000883415501 591652505 /nfs/dbraw/zinc/65/25/05/591652505.db2.gz WYXQEFBFPDGBNG-LLVKDONJSA-N 2 0 232.318 2.107 20 0 BEADRP CC(C)(C)[C@H](CN)[NH2+]C[C@@H]1CCCC(C)(C)O1 ZINC000883430427 591652575 /nfs/dbraw/zinc/65/25/75/591652575.db2.gz VEVRHXQGZUIWJW-RYUDHWBXSA-N 2 0 242.407 2.297 20 0 BEADRP [NH3+]C1CC[NH+](CC[C@H]2CCCC2(F)F)CC1 ZINC000883414960 591653167 /nfs/dbraw/zinc/65/31/67/591653167.db2.gz KIZKGIBHRDLRRJ-SNVBAGLBSA-N 2 0 232.318 2.235 20 0 BEADRP C[NH2+]C[C@H]1CCCN1CC[C@H]1CCCC1(F)F ZINC000883418135 591654274 /nfs/dbraw/zinc/65/42/74/591654274.db2.gz YOLZRQINHATEOF-VXGBXAGGSA-N 2 0 246.345 2.496 20 0 BEADRP C=C/C=C/CC[NH+]1CCC([C@H]2CC[NH2+]C2)CC1 ZINC000883427769 591660880 /nfs/dbraw/zinc/66/08/80/591660880.db2.gz BQRQXQMKTCIETN-BWPKMQGJSA-N 2 0 234.387 2.440 20 0 BEADRP C[N@H+](CC[C@H]1CCCC1(F)F)C1CC([NH3+])C1 ZINC000883429156 591661006 /nfs/dbraw/zinc/66/10/06/591661006.db2.gz NDBGVGFEITVNKA-KPPDAEKUSA-N 2 0 232.318 2.233 20 0 BEADRP C=C/C=C/CC[N@@H+]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC000883429911 591661729 /nfs/dbraw/zinc/66/17/29/591661729.db2.gz HZRJEFBBPYKIBK-XGACYXMMSA-N 2 0 220.360 2.194 20 0 BEADRP C[C@H]1CC[C@H]([NH2+]Cc2ccc(CC[NH3+])cc2)C1 ZINC000133101196 591764623 /nfs/dbraw/zinc/76/46/23/591764623.db2.gz YRECSQCWAXJVOH-WFASDCNBSA-N 2 0 232.371 2.466 20 0 BEADRP CSCC[C@H](C)[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000134076086 591882426 /nfs/dbraw/zinc/88/24/26/591882426.db2.gz SPTILQUSTNTHCY-RYUDHWBXSA-N 2 0 244.448 2.448 20 0 BEADRP CCC[NH+]1CCC(CC)([NH+]2CCC2)CC1 ZINC000886709440 592308216 /nfs/dbraw/zinc/30/82/16/592308216.db2.gz QSEGRZQLRIJSKD-UHFFFAOYSA-N 2 0 210.365 2.347 20 0 BEADRP C[C@H]1CN(C)C[C@H]1[NH2+][C@H]1CCc2c1cccc2F ZINC000886792421 592323816 /nfs/dbraw/zinc/32/38/16/592323816.db2.gz YVFBDDHZJQUKCO-NZVBXONLSA-N 2 0 248.345 2.353 20 0 BEADRP C(C[NH+]1CCC2(CC[NH2+]C2)CC1)[C@@H]1C[C@H]1C1CC1 ZINC000886837655 592359028 /nfs/dbraw/zinc/35/90/28/592359028.db2.gz LFOSUSQXBZCSGV-CABCVRRESA-N 2 0 248.414 2.498 20 0 BEADRP C(C[N@@H+]1CCC[C@]2(CC[NH2+]C2)C1)[C@@H]1C[C@H]1C1CC1 ZINC000886840149 592360050 /nfs/dbraw/zinc/36/00/50/592360050.db2.gz USGDZIHKHJGHSW-OWCLPIDISA-N 2 0 248.414 2.498 20 0 BEADRP [NH3+][C@]12CCC[C@H]1C[N@H+](CC[C@@H]1C[C@H]1C1CC1)C2 ZINC000886841411 592362044 /nfs/dbraw/zinc/36/20/44/592362044.db2.gz KNYZBHWIQPQYDY-QPSCCSFWSA-N 2 0 234.387 2.236 20 0 BEADRP C[C@@H]1CC[N@H+](CCC[NH3+])[C@@H]1c1ccccc1 ZINC000886857792 592369676 /nfs/dbraw/zinc/36/96/76/592369676.db2.gz ADBFLKNMYIMBQP-OCCSQVGLSA-N 2 0 218.344 2.418 20 0 BEADRP CC(C)CC[N@@H+]1CCCC[C@@]2(CC[NH2+]C2)C1 ZINC000886865162 592374483 /nfs/dbraw/zinc/37/44/83/592374483.db2.gz BZWYFOLTVDSAKE-AWEZNQCLSA-N 2 0 224.392 2.498 20 0 BEADRP CC[C@@H](C)[N@@H+]1CCCC[C@]2(CC[NH2+]C2)C1 ZINC000886874557 592377934 /nfs/dbraw/zinc/37/79/34/592377934.db2.gz QGGITXSBTYCGGS-CHWSQXEVSA-N 2 0 210.365 2.251 20 0 BEADRP CC[C@@H](C)[N@@H+]1CCN(c2cc[nH+]cc2)C[C@@H]1C ZINC000887134912 592449096 /nfs/dbraw/zinc/44/90/96/592449096.db2.gz SGHDYNFTKFLCNZ-OLZOCXBDSA-N 2 0 233.359 2.391 20 0 BEADRP CC(C)[N@@H+]1CCN(c2cc[nH+]cc2)C[C@@H]1C ZINC000887131183 592450006 /nfs/dbraw/zinc/45/00/06/592450006.db2.gz SCQXCLSYZFLMOY-LBPRGKRZSA-N 2 0 219.332 2.001 20 0 BEADRP C[C@H]([NH2+]CC1=CC[N@H+](C)CC1)c1ccns1 ZINC000925703420 634379865 /nfs/dbraw/zinc/37/98/65/634379865.db2.gz DSZBFTMJXNKSAI-JTQLQIEISA-N 2 0 237.372 2.056 20 0 BEADRP C[C@]1(CC[NH2+][C@H]2CC[NH2+]C2(C)C)CC1(F)F ZINC000925707419 634395442 /nfs/dbraw/zinc/39/54/42/634395442.db2.gz IZCAMZMGEAOPFL-ONGXEEELSA-N 2 0 232.318 2.152 20 0 BEADRP C[C@]1(CC[NH2+][C@@H]2CC[NH2+]C23CCC3)CC1(F)F ZINC000925709005 634404020 /nfs/dbraw/zinc/40/40/20/634404020.db2.gz NFABHHGITHXFHG-MNOVXSKESA-N 2 0 244.329 2.296 20 0 BEADRP [NH3+]C1C[C@H]2CCC[C@@H](C1)C2[NH2+][C@H]1C=CCC1 ZINC000925709465 634405057 /nfs/dbraw/zinc/40/50/57/634405057.db2.gz FHNOWVKVUXLMKH-VZANTVGXSA-N 2 0 220.360 2.201 20 0 BEADRP C[C@@]1(CC[NH2+][C@@H]2CC[NH2+]C23CCC3)CC1(F)F ZINC000925709004 634405248 /nfs/dbraw/zinc/40/52/48/634405248.db2.gz NFABHHGITHXFHG-GHMZBOCLSA-N 2 0 244.329 2.296 20 0 BEADRP C[C@@H]1SCC[C@@H]1[NH2+][C@@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925713382 634417622 /nfs/dbraw/zinc/41/76/22/634417622.db2.gz RKWYQTZEAOKJIF-YFKTTZPYSA-N 2 0 242.432 2.376 20 0 BEADRP CC(C)(C)CCC[NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32 ZINC000313247865 634458396 /nfs/dbraw/zinc/45/83/96/634458396.db2.gz ABFXLUVWZMQWEE-QSLWVIQJSA-N 2 0 236.403 2.399 20 0 BEADRP [NH3+]CC[C@H]1CC[N@H+](Cc2ccc(F)c(F)c2)C1 ZINC000125552616 634541676 /nfs/dbraw/zinc/54/16/76/634541676.db2.gz KGTSSJOJBNDCKF-JTQLQIEISA-N 2 0 240.297 2.136 20 0 BEADRP C[C@H](C[C@@H]1CCC[NH2+]1)[NH2+]Cc1cccc(F)c1 ZINC000093462928 634546856 /nfs/dbraw/zinc/54/68/56/634546856.db2.gz OEHBDKCXHHKGNG-RISCZKNCSA-N 2 0 236.334 2.446 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]C[C@@H]1C=CCC1 ZINC000925733213 634579665 /nfs/dbraw/zinc/57/96/65/634579665.db2.gz UIBHSFPEFOJOFR-JHJVBQTASA-N 2 0 208.349 2.202 20 0 BEADRP C[C@@H]1C[C@H]1[C@@H]1C[C@H]1[NH2+][C@H]1CCCC[C@@H]1C[NH3+] ZINC000925823009 635407151 /nfs/dbraw/zinc/40/71/51/635407151.db2.gz NNEVJDBMQBXZNT-IZMFDJJNSA-N 2 0 222.376 2.138 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCS[C@H](C)C1)[C@H]1CCCC[NH2+]1 ZINC000925861585 635555540 /nfs/dbraw/zinc/55/55/40/635555540.db2.gz QJQXRVLDKSDYJN-FVCCEPFGSA-N 2 0 242.432 2.391 20 0 BEADRP COC[C@H](C[NH2+][C@@H]1CCCCC[C@@H]1[NH3+])C(C)C ZINC000925874235 635593375 /nfs/dbraw/zinc/59/33/75/635593375.db2.gz QASXSWNSYHKFPE-MELADBBJSA-N 2 0 242.407 2.155 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+]C[C@]12C[C@H]1CCC2 ZINC000925881822 635611118 /nfs/dbraw/zinc/61/11/18/635611118.db2.gz VFOILPVEAJCCCD-DGAVXFQQSA-N 2 0 222.376 2.154 20 0 BEADRP C[C@@H]([NH2+][C@H]1C[C@@](C[NH3+])(c2ccccc2)C1)C1CC1 ZINC000925887435 635614534 /nfs/dbraw/zinc/61/45/34/635614534.db2.gz CXJRPOLTTFYEHB-WQVCFCJDSA-N 2 0 244.382 2.434 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@@H](CC[NH3+])C2)cc1 ZINC000083008656 631418301 /nfs/dbraw/zinc/41/83/01/631418301.db2.gz JKIIACLVIPOKPQ-CQSZACIVSA-N 2 0 218.344 2.166 20 0 BEADRP C[N@H+]1C[C@H]2CC[C@@H](C1)C2[NH2+][C@H]1CCC(F)(F)C1 ZINC000925928610 635641566 /nfs/dbraw/zinc/64/15/66/635641566.db2.gz FHBYDEWJMGHRHL-PSIUFMSWSA-N 2 0 244.329 2.104 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+]CCC[NH+]1CCCCC1 ZINC000308838039 631677570 /nfs/dbraw/zinc/67/75/70/631677570.db2.gz XAHFEMKBBRJPHU-OLZOCXBDSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@@H](Cc1ccsc1)[NH2+]CCC(C)(C)[NH3+] ZINC000308989658 631781564 /nfs/dbraw/zinc/78/15/64/631781564.db2.gz VPALHCRVODNVMK-JTQLQIEISA-N 2 0 226.389 2.396 20 0 BEADRP CCOc1ccc(C[NH2+]C2CCC([NH3+])CC2)cc1 ZINC000051693393 631869224 /nfs/dbraw/zinc/86/92/24/631869224.db2.gz AEGHVOMKIIEDOQ-UHFFFAOYSA-N 2 0 248.370 2.445 20 0 BEADRP [NH3+]CCCCCC[NH2+]C(C1CC1)C1CC1 ZINC000049237870 631870656 /nfs/dbraw/zinc/87/06/56/631870656.db2.gz NKECVSJJZYDGJB-UHFFFAOYSA-N 2 0 210.365 2.284 20 0 BEADRP C[C@H]1CC[C@H]1[NH2+]C1CCC([NH+](C)C)CC1 ZINC000309101284 631882969 /nfs/dbraw/zinc/88/29/69/631882969.db2.gz FVMHNJSRUIPPRE-YWPUVAFDSA-N 2 0 210.365 2.247 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+]CC2(C)CCCC2)C1 ZINC000309372360 632024461 /nfs/dbraw/zinc/02/44/61/632024461.db2.gz PPCMUMIGCRFXDA-CYBMUJFWSA-N 2 0 224.392 2.498 20 0 BEADRP CC[N@@H+]1CCC[C@@H]1CNC(=[NH2+])Nc1ccccc1 ZINC000052046947 632056075 /nfs/dbraw/zinc/05/60/75/632056075.db2.gz BSBXNJPPUNTWFM-CYBMUJFWSA-N 2 0 246.358 2.107 20 0 BEADRP C[C@@H](CN1CCC[C@@H](C)C1)[NH2+][C@@H]1CC[C@@H]1C ZINC000309559212 632494846 /nfs/dbraw/zinc/49/48/46/632494846.db2.gz KNCXWROZMDEORD-ZOBORPQBSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+][C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000252971247 632565372 /nfs/dbraw/zinc/56/53/72/632565372.db2.gz XTFLNGUQWDDFDI-JYILRKAJSA-N 2 0 216.328 2.377 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)C1(Cl)CC1 ZINC000926573778 632571367 /nfs/dbraw/zinc/57/13/67/632571367.db2.gz QBVPQSPIFUDYCR-NEPJUHHUSA-N 2 0 244.810 2.468 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000309033007 632619142 /nfs/dbraw/zinc/61/91/42/632619142.db2.gz CVRCDGXCERIIBY-NEPJUHHUSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]1CC[C@H]1[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000309033008 632619539 /nfs/dbraw/zinc/61/95/39/632619539.db2.gz CVRCDGXCERIIBY-NWDGAFQWSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]1CC[C@H]1[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000309659486 632624892 /nfs/dbraw/zinc/62/48/92/632624892.db2.gz AOOMPMSHUJRNGS-SMDDNHRTSA-N 2 0 222.376 2.391 20 0 BEADRP [NH3+][C@H](CC(F)F)C[N@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000309711910 632656198 /nfs/dbraw/zinc/65/61/98/632656198.db2.gz KIAMIWNVFQOLKM-OUAUKWLOSA-N 2 0 232.318 2.091 20 0 BEADRP CC(C)([NH3+])CC[NH2+][C@@H]1CCc2ccccc2C1 ZINC000310285163 632717851 /nfs/dbraw/zinc/71/78/51/632717851.db2.gz IQEYCYSGZSLTPR-CQSZACIVSA-N 2 0 232.371 2.261 20 0 BEADRP C[N@H+]1C[C@H]2CC[C@@H](C1)C2[NH2+]CCc1ccccc1 ZINC000924541537 632790282 /nfs/dbraw/zinc/79/02/82/632790282.db2.gz CRIXWTKCQAUATO-XYPWUTKMSA-N 2 0 244.382 2.159 20 0 BEADRP C[C@@H]1CC[C@H]1[NH2+]CCC[NH+]1CCC(C)CC1 ZINC000309300975 632912190 /nfs/dbraw/zinc/91/21/90/632912190.db2.gz LZMSBCKYXHHEJL-ZIAGYGMSSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H](C)Cc1ccco1 ZINC000309352111 632961721 /nfs/dbraw/zinc/96/17/21/632961721.db2.gz MQHJDMCBJNITIU-NEPJUHHUSA-N 2 0 224.348 2.318 20 0 BEADRP C(C[N@@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1)C1CCCCC1 ZINC000310407066 635983628 /nfs/dbraw/zinc/98/36/28/635983628.db2.gz OKNLORWCPXABKS-LSDHHAIUSA-N 2 0 236.403 2.498 20 0 BEADRP C[NH+]1CCC(C[NH2+]C[C@@H]2C(C)(C)C2(F)F)CC1 ZINC000895438940 636143139 /nfs/dbraw/zinc/14/31/39/636143139.db2.gz UOFGAOOTXIQRQL-LLVKDONJSA-N 2 0 246.345 2.209 20 0 BEADRP CCC(CC)C[NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32 ZINC000328471686 633768127 /nfs/dbraw/zinc/76/81/27/633768127.db2.gz ADXJWOYQMHSVQI-QSLWVIQJSA-N 2 0 222.376 2.009 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@H]2[C@@H]3[NH2+]C[C@H]4C[C@H]2C[C@H]34)[C@H](C)C1 ZINC000328469810 633768864 /nfs/dbraw/zinc/76/88/64/633768864.db2.gz ZAWTWYUMUKVEOY-VSPOPZGASA-N 2 0 248.414 2.397 20 0 BEADRP CCC[C@H](CC)[NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32 ZINC000328522010 633770389 /nfs/dbraw/zinc/77/03/89/633770389.db2.gz HLFORLNECHWHLP-SNIKSBKOSA-N 2 0 222.376 2.151 20 0 BEADRP C[C@@H]([NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32)C1CCCC1 ZINC000328549085 633774399 /nfs/dbraw/zinc/77/43/99/633774399.db2.gz QSSOWMZTGZBOHQ-PCTWNACOSA-N 2 0 234.387 2.151 20 0 BEADRP CC1(C[NH2+][C@@H]2[C@H]3C[C@H]4C[NH2+][C@H]2[C@H]4C3)CCCC1 ZINC000328573050 633778593 /nfs/dbraw/zinc/77/85/93/633778593.db2.gz VJNJXWIRCXEVJZ-YHQUGGNUSA-N 2 0 234.387 2.153 20 0 BEADRP C[C@H]1C[C@H]([NH2+][C@H]2[C@@H]3[NH2+]C[C@H]4C[C@H]2C[C@H]34)C[C@@H](C)C1 ZINC000328576958 633779228 /nfs/dbraw/zinc/77/92/28/633779228.db2.gz ZSFZWHFUHQUNMY-FVEFAZKQSA-N 2 0 248.414 2.397 20 0 BEADRP C[C@@H]1CC[C@H]1[NH2+]CC1(C[NH+](C)C)CCCC1 ZINC000309819608 633785309 /nfs/dbraw/zinc/78/53/09/633785309.db2.gz WAXVVIAZHZTLAZ-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP CSCCCC[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000925503050 633826674 /nfs/dbraw/zinc/82/66/74/633826674.db2.gz JQRCWPWUZHGURF-NSHDSACASA-N 2 0 228.405 2.004 20 0 BEADRP C[C@H](C[NH2+]CC1CC[NH+](C)CC1)c1ccncc1 ZINC000893096958 633832597 /nfs/dbraw/zinc/83/25/97/633832597.db2.gz CHHOZGMXIVARSO-CYBMUJFWSA-N 2 0 247.386 2.117 20 0 BEADRP CS[C@@H]1CCC[C@H]([NH2+][C@H]2CC[NH2+]C2(C)C)C1 ZINC000925507595 633840424 /nfs/dbraw/zinc/84/04/24/633840424.db2.gz ZFQAYUISYCCJQU-TUAOUCFPSA-N 2 0 242.432 2.391 20 0 BEADRP CS[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[NH2+]C2(C)C)C1 ZINC000925507593 633840905 /nfs/dbraw/zinc/84/09/05/633840905.db2.gz ZFQAYUISYCCJQU-QJPTWQEYSA-N 2 0 242.432 2.391 20 0 BEADRP C[C@H](N)[C@@H]([NH2+]CCCC[NH+](C)C)c1ccccc1 ZINC000925522789 633896821 /nfs/dbraw/zinc/89/68/21/633896821.db2.gz USVRWROFZALYSA-DZGCQCFKSA-N 2 0 249.402 2.006 20 0 BEADRP C[NH2+]CCC[NH+]1CCC(CC(C)C)CC1 ZINC000309641943 633981944 /nfs/dbraw/zinc/98/19/44/633981944.db2.gz OWPMQJIUFGQEQF-UHFFFAOYSA-N 2 0 212.381 2.354 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[NH2+]C12CCCC2)C1CC1 ZINC000925585313 634091023 /nfs/dbraw/zinc/09/10/23/634091023.db2.gz TUALFIQQZBGTIL-PWSUYJOCSA-N 2 0 208.349 2.049 20 0 BEADRP CCC(CC)(C[NH2+]CC1CC[NH+](C)CC1)OC ZINC000310553733 634161817 /nfs/dbraw/zinc/16/18/17/634161817.db2.gz VIWWNADEMBYCQN-UHFFFAOYSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[C@H]([NH3+])CC(C)(C)C1)C1CC1 ZINC000925679431 634277406 /nfs/dbraw/zinc/27/74/06/634277406.db2.gz CGQORXPWNNTIAZ-ADEWGFFLSA-N 2 0 210.365 2.281 20 0 BEADRP COC1(C[N@H+](C)C2CCC([NH3+])CC2)CCCC1 ZINC000319443525 634280766 /nfs/dbraw/zinc/28/07/66/634280766.db2.gz LXTZYKQFEDPMGS-UHFFFAOYSA-N 2 0 240.391 2.147 20 0 BEADRP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+]C(C)C)C1 ZINC000053655368 634283098 /nfs/dbraw/zinc/28/30/98/634283098.db2.gz BBEMWUVCCKVSRN-ZDUSSCGKSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H](CC(C)(C)O)[NH2+][C@@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925682759 634288204 /nfs/dbraw/zinc/28/82/04/634288204.db2.gz ZRMXQAWCJZRGQZ-GRYCIOLGSA-N 2 0 242.407 2.032 20 0 BEADRP CC1(C)C[C@@H]1[NH2+][C@@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925686367 634298753 /nfs/dbraw/zinc/29/87/53/634298753.db2.gz SGFKGORMAOLFTK-MXWKQRLJSA-N 2 0 210.365 2.281 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+][C@@H]2CCCC[C@H]2F)C12CCC2 ZINC000925692837 634321807 /nfs/dbraw/zinc/32/18/07/634321807.db2.gz RJQSTMYYKJTBPJ-KKOKHZNYSA-N 2 0 226.339 2.127 20 0 BEADRP CC(C)([NH3+])CC[NH2+]Cc1ccc(F)c(F)c1 ZINC000258798077 635204399 /nfs/dbraw/zinc/20/43/99/635204399.db2.gz CRUVVUUPCIFZAF-UHFFFAOYSA-N 2 0 228.286 2.182 20 0 BEADRP CCOc1ccc(C[NH2+]CCC(C)(C)[NH3+])cc1 ZINC000258813247 635206326 /nfs/dbraw/zinc/20/63/26/635206326.db2.gz DTTBWTBIGLQDBV-UHFFFAOYSA-N 2 0 236.359 2.302 20 0 BEADRP C[C@@H]1C[C@@H]1[C@H]1C[C@H]1C[NH2+][C@H]1CC[NH2+]CC[C@H]1C ZINC000925771822 635211435 /nfs/dbraw/zinc/21/14/35/635211435.db2.gz DFZVEXHNEBRPSA-UMBPPFEGSA-N 2 0 236.403 2.256 20 0 BEADRP C[C@H]1C[C@H]1[C@H]1C[C@H]1C[NH2+][C@H]1CC[NH2+]CC[C@H]1C ZINC000925771820 635211745 /nfs/dbraw/zinc/21/17/45/635211745.db2.gz DFZVEXHNEBRPSA-GHRCFYLDSA-N 2 0 236.403 2.256 20 0 BEADRP C[NH2+]CCC[NH2+]Cc1cc(C)c(OC)c(C)c1 ZINC000258837176 635212299 /nfs/dbraw/zinc/21/22/99/635212299.db2.gz VVDJTSOMMAKZPO-UHFFFAOYSA-N 2 0 236.359 2.011 20 0 BEADRP C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000925772525 635213413 /nfs/dbraw/zinc/21/34/13/635213413.db2.gz IKFQXXZRABMWBB-RGDJUOJXSA-N 2 0 234.387 2.153 20 0 BEADRP FC1(F)CC[NH2+]C[C@H]1C[NH2+][C@H]1CCC12CCC2 ZINC000925775572 635247740 /nfs/dbraw/zinc/24/77/40/635247740.db2.gz HMUOKLZRYQMWGN-QWRGUYRKSA-N 2 0 244.329 2.154 20 0 BEADRP FC1(F)CC[NH2+]C[C@@H]1C[NH2+][C@H]1CC[C@@H]1C1CC1 ZINC000925778186 635265088 /nfs/dbraw/zinc/26/50/88/635265088.db2.gz RWNCMSKWMMCJRZ-UTUOFQBUSA-N 2 0 244.329 2.009 20 0 BEADRP COc1ccc(C[N@@H+]2CC[C@@H]([NH3+])[C@H](C)C2)cc1C ZINC000094338850 635299815 /nfs/dbraw/zinc/29/98/15/635299815.db2.gz MANXCNSPESYZGM-TZMCWYRMSA-N 2 0 248.370 2.173 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@H]1C[C@H](C)CC[C@H]1C ZINC000925785854 635302033 /nfs/dbraw/zinc/30/20/33/635302033.db2.gz PFQNJIOHAJARBD-POQQGIQPSA-N 2 0 224.392 2.256 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@@H]1C[C@H](C)CC[C@H]1C ZINC000925785855 635303468 /nfs/dbraw/zinc/30/34/68/635303468.db2.gz PFQNJIOHAJARBD-XGFWRYKXSA-N 2 0 224.392 2.256 20 0 BEADRP COc1ccc([C@H](C)[NH2+]C[C@@H]2C[NH2+]C[C@H]2C)cc1 ZINC000925793317 635324217 /nfs/dbraw/zinc/32/42/17/635324217.db2.gz XYFSAEHPRZKSNK-DYEKYZERSA-N 2 0 248.370 2.201 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CC1C[C@H]2CC[C@@H](C1)S2 ZINC000925800321 635343223 /nfs/dbraw/zinc/34/32/23/635343223.db2.gz FKLHQSLKDJALRP-KTCIRNNBSA-N 2 0 242.432 2.376 20 0 BEADRP [NH3+]C[C@@H]1CC[N@H+](Cc2ccc(C3CC3)cc2)C1 ZINC000094522064 635371206 /nfs/dbraw/zinc/37/12/06/635371206.db2.gz HQOYIMIWLOXQBC-ZDUSSCGKSA-N 2 0 230.355 2.345 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CC[C@H]([NH3+])C1)c1ccoc1 ZINC000925874986 635595296 /nfs/dbraw/zinc/59/52/96/635595296.db2.gz AVTRYHXGHCUKPT-UMNHJUIQSA-N 2 0 208.305 2.058 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc(F)cc1 ZINC000089139598 636904629 /nfs/dbraw/zinc/90/46/29/636904629.db2.gz YXLYJNRXNWEPQH-OCCSQVGLSA-N 2 0 236.334 2.433 20 0 BEADRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]CCc1ccc(F)cc1 ZINC000089147129 636904641 /nfs/dbraw/zinc/90/46/41/636904641.db2.gz NOBBYMZAKNGVTO-TZMCWYRMSA-N 2 0 236.334 2.085 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]CCc1ccc(F)cc1 ZINC000089147132 636904912 /nfs/dbraw/zinc/90/49/12/636904912.db2.gz NOBBYMZAKNGVTO-GXTWGEPZSA-N 2 0 236.334 2.085 20 0 BEADRP COCC[C@@H](C)[N@@H+]1CC[C@](C[NH3+])(C(C)(C)C)C1 ZINC000866707738 636930473 /nfs/dbraw/zinc/93/04/73/636930473.db2.gz VSFVKUPGYMOCQR-TZMCWYRMSA-N 2 0 242.407 2.108 20 0 BEADRP CC[NH+](CC)CCC[NH2+]CC(C)(C)C ZINC000041051120 636955959 /nfs/dbraw/zinc/95/59/59/636955959.db2.gz BGTRKLRYMRQYLF-UHFFFAOYSA-N 2 0 200.370 2.354 20 0 BEADRP CC1(C)C[C@@H]1C[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000902363313 637298731 /nfs/dbraw/zinc/29/87/31/637298731.db2.gz KUBYCEHYNWQBHS-VXGBXAGGSA-N 2 0 224.392 2.400 20 0 BEADRP CC(C)[N@H+](C[C@@H]1CCCC[NH2+]C1)C1CC1 ZINC000903721635 637378579 /nfs/dbraw/zinc/37/85/79/637378579.db2.gz CCDXPMPYJCPJQJ-GFCCVEGCSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@]1(C[N@@H+]2C[C@@H]3[C@@H]4CC[C@@H](C4)[C@]3(C)C2)CC[NH2+]C1 ZINC000904465295 637408492 /nfs/dbraw/zinc/40/84/92/637408492.db2.gz ZDDOAYMULAFAKJ-LEOABGAYSA-N 2 0 248.414 2.354 20 0 BEADRP CC[C@H]1CCC[C@@H](C[NH2+]CC2([NH3+])CC2)C1 ZINC000904449086 637414479 /nfs/dbraw/zinc/41/44/79/637414479.db2.gz FZSBZEKJNYGODB-NWDGAFQWSA-N 2 0 210.365 2.284 20 0 BEADRP CSCC(C)(C)[NH2+]C[C@H]1CC[NH2+][C@@H](C)C1 ZINC000904476335 637426083 /nfs/dbraw/zinc/42/60/83/637426083.db2.gz QMNWYZYCCXGCAF-QWRGUYRKSA-N 2 0 230.421 2.106 20 0 BEADRP CC(C)([NH3+])c1ccc(NC2CC[NH2+]CC2)cc1 ZINC000904477429 637427012 /nfs/dbraw/zinc/42/70/12/637427012.db2.gz WIFJTZBVATWCEZ-UHFFFAOYSA-N 2 0 233.359 2.044 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]Cc2cc3ccccc3s2)C1 ZINC000906508377 638178417 /nfs/dbraw/zinc/17/84/17/638178417.db2.gz QEDCKVNIZORFBC-XYPYZODXSA-N 2 0 232.352 2.481 20 0 BEADRP C[N@@H+]1CCCC[C@H]1CCON=C(N)C1CCC1 ZINC000906507441 638179109 /nfs/dbraw/zinc/17/91/09/638179109.db2.gz CMJICRULQCPMQM-LBPRGKRZSA-N 2 0 239.363 2.159 20 0 BEADRP [NH3+]C1CC([NH2+][C@H]2CC[C@@H](Cc3ccccc3)C2)C1 ZINC000906511069 638183171 /nfs/dbraw/zinc/18/31/71/638183171.db2.gz RTHCOXLWLZVHKK-UIDBIOKJSA-N 2 0 244.382 2.477 20 0 BEADRP CC1(C)CCC(C[NH2+][C@H]2C[C@H]([NH3+])C2)CC1 ZINC000906516657 638186139 /nfs/dbraw/zinc/18/61/39/638186139.db2.gz GDQIEGNTPLYURA-HAQNSBGRSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]CCCC2CCCCC2)C1 ZINC000906518848 638187082 /nfs/dbraw/zinc/18/70/82/638187082.db2.gz RXLCUPLHFBJNFI-JOCQHMNTSA-N 2 0 210.365 2.426 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]Cc2coc3ccccc23)C1 ZINC000906517747 638187666 /nfs/dbraw/zinc/18/76/66/638187666.db2.gz OPIWFXABXUGNGC-XYPYZODXSA-N 2 0 216.284 2.012 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+][C@H]2CC[C@H](Cc3ccccc3)C2)C1 ZINC000906518844 638187999 /nfs/dbraw/zinc/18/79/99/638187999.db2.gz RTHCOXLWLZVHKK-LVQVYYBASA-N 2 0 244.382 2.477 20 0 BEADRP CCCC[NH2+]C[C@@H]1CCCCN1C1CC1 ZINC000906527431 638191398 /nfs/dbraw/zinc/19/13/98/638191398.db2.gz JMYIZKRNHVTQNK-ZDUSSCGKSA-N 2 0 210.365 2.393 20 0 BEADRP CCSCC[C@H](C)[NH2+]CC1CC[NH+](C)CC1 ZINC000133799861 711469783 /nfs/dbraw/zinc/46/97/83/711469783.db2.gz JCNRRORLSJEFCI-LBPRGKRZSA-N 2 0 244.448 2.450 20 0 BEADRP C[C@@H](C1CC1)[N@@H+]1CCCN(c2cc[nH+]cc2)CC1 ZINC000930805016 639910373 /nfs/dbraw/zinc/91/03/73/639910373.db2.gz NLQPZCOVEQODIT-ZDUSSCGKSA-N 2 0 245.370 2.392 20 0 BEADRP C[N@@H+]1CC[C@@H]2C[NH+](CCCC(C)(F)F)C[C@@H]2C1 ZINC000931442343 640205088 /nfs/dbraw/zinc/20/50/88/640205088.db2.gz CXSGJVGHDQXUHR-NEPJUHHUSA-N 2 0 246.345 2.305 20 0 BEADRP CCCCCC[N@@H+]1C[C@@H]2CC[NH+](C)C[C@@H]2C1 ZINC000931440351 640207090 /nfs/dbraw/zinc/20/70/90/640207090.db2.gz WOVWKFWADODSEJ-UONOGXRCSA-N 2 0 224.392 2.450 20 0 BEADRP C[N@@H+]1CC[C@@H]2C[NH+](CCC(C)(C)C)C[C@@H]2C1 ZINC000931440322 640208776 /nfs/dbraw/zinc/20/87/76/640208776.db2.gz VMYCNKRVUXOTTG-OLZOCXBDSA-N 2 0 224.392 2.306 20 0 BEADRP CC1CC(C[N@@H+]2[C@@H]3CC[C@H]2CN(C)CC3)C1 ZINC000931717601 640334610 /nfs/dbraw/zinc/33/46/10/640334610.db2.gz KHGZKECBLTURFO-PQAZSJQKSA-N 2 0 222.376 2.201 20 0 BEADRP C[NH+]1CCC(C[NH2+]Cc2ccccc2)CC1 ZINC000044515850 640399061 /nfs/dbraw/zinc/39/90/61/640399061.db2.gz URAVYRLADDNHNS-UHFFFAOYSA-N 2 0 218.344 2.118 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@@H+]1CC[C@@H](c2ccccc2)C1 ZINC000223934678 640594159 /nfs/dbraw/zinc/59/41/59/640594159.db2.gz PKWWZGNWRHWLPC-BMFZPTHFSA-N 2 0 244.382 2.331 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000166811880 640679846 /nfs/dbraw/zinc/67/98/46/640679846.db2.gz XTFLNGUQWDDFDI-XYHOJCAOSA-N 2 0 216.328 2.377 20 0 BEADRP CC/C=C/CC[N@@H+]1C[C@@H]2C[NH+](C)C[C@]2(C)C1 ZINC000933735228 640761609 /nfs/dbraw/zinc/76/16/09/640761609.db2.gz GXAYAEISPKGERA-BUHQSOCUSA-N 2 0 222.376 2.226 20 0 BEADRP Cc1cccc(C[NH+]2C[C@H]3C[N@@H+](C)C[C@@]3(C)C2)c1 ZINC000933745239 640762287 /nfs/dbraw/zinc/76/22/87/640762287.db2.gz MKCFAXAQFMPMHO-CVEARBPZSA-N 2 0 244.382 2.379 20 0 BEADRP Cc1cc(C)cc(C[N@@H+]2CC[C@H]([NH3+])[C@@H](C)C2)c1 ZINC000227056380 640814375 /nfs/dbraw/zinc/81/43/75/640814375.db2.gz ZMRSGTGXXAFISQ-ZFWWWQNUSA-N 2 0 232.371 2.473 20 0 BEADRP CCCCCC[N@@H+]1CC[C@@H](C[NH+](C)C)C1 ZINC000158147834 640819733 /nfs/dbraw/zinc/81/97/33/640819733.db2.gz KJRUKXHXZRQFLR-ZDUSSCGKSA-N 2 0 212.381 2.450 20 0 BEADRP [NH3+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C[C@@H]1CCSC1 ZINC000228612236 640885818 /nfs/dbraw/zinc/88/58/18/640885818.db2.gz XQAXZPDYJYRJCR-WODVXLOZSA-N 2 0 240.416 2.084 20 0 BEADRP CCCCCC[N@@H+]1CC[C@H](C)[C@@H](C[NH3+])C1 ZINC000228986611 640909932 /nfs/dbraw/zinc/90/99/32/640909932.db2.gz JHSGXEFDUZQBCQ-STQMWFEESA-N 2 0 212.381 2.483 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+]CC2CC[NH+](C)CC2)C1 ZINC000230411997 641052334 /nfs/dbraw/zinc/05/23/34/641052334.db2.gz ANRJPGYCJHOIOI-OCCSQVGLSA-N 2 0 224.392 2.354 20 0 BEADRP Cl/C=C/C[NH+]1CCC([C@@H]2CCC[NH2+]2)CC1 ZINC000063200095 641146148 /nfs/dbraw/zinc/14/61/48/641146148.db2.gz IFEJWLIIBVHAGW-QSLRECBCSA-N 2 0 228.767 2.203 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@H]1C[NH3+])c1ccccc1 ZINC000088161947 641318953 /nfs/dbraw/zinc/31/89/53/641318953.db2.gz RQALVUIAUHFWBW-UBHSHLNASA-N 2 0 218.344 2.465 20 0 BEADRP COc1ccc(C[NH2+][C@@H]2CCCC[C@H]2C[NH3+])cc1 ZINC000089139323 641464401 /nfs/dbraw/zinc/46/44/01/641464401.db2.gz QWIFDXBIIXHNKU-DZGCQCFKSA-N 2 0 248.370 2.302 20 0 BEADRP COc1cccc([C@H](C)[NH2+][C@@H]2CCC[C@@H]2C[NH3+])c1 ZINC000089149920 641477157 /nfs/dbraw/zinc/47/71/57/641477157.db2.gz ADQABIYVQWQTQO-NJZAAPMLSA-N 2 0 248.370 2.473 20 0 BEADRP [NH3+]CC[C@H]1CC[N@H+](Cc2c(F)cccc2F)C1 ZINC000076685508 641820201 /nfs/dbraw/zinc/82/02/01/641820201.db2.gz WBPXJQAICUOCLP-JTQLQIEISA-N 2 0 240.297 2.136 20 0 BEADRP C[N@H+](CC1CCCC1)CC1CC[NH+](C)CC1 ZINC000154689241 642184026 /nfs/dbraw/zinc/18/40/26/642184026.db2.gz NKMPEFGWMQZTOX-UHFFFAOYSA-N 2 0 224.392 2.450 20 0 BEADRP CCC(C)(C)C[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000232900567 642220061 /nfs/dbraw/zinc/22/00/61/642220061.db2.gz FLHPKQCMIPVEEQ-CYBMUJFWSA-N 2 0 212.381 2.402 20 0 BEADRP CC(C)C[C@@H]1CC[N@H+](C[C@@H]2CC[C@H]([NH3+])C2)C1 ZINC000307818763 642315761 /nfs/dbraw/zinc/31/57/61/642315761.db2.gz SUQVWHLKUYOVHV-RDBSUJKOSA-N 2 0 224.392 2.482 20 0 BEADRP C(C1CCCC1)[N@@H+]1CCC[C@]12CC[NH2+]C2 ZINC000257682164 642499135 /nfs/dbraw/zinc/49/91/35/642499135.db2.gz LIQAHCSFAKFSRQ-CYBMUJFWSA-N 2 0 208.349 2.005 20 0 BEADRP CCCC1(C[NH2+][C@H]2CCC[NH2+]CC2)CC1 ZINC000233041726 642646873 /nfs/dbraw/zinc/64/68/73/642646873.db2.gz DMVPVXCRTHKPAO-LBPRGKRZSA-N 2 0 210.365 2.298 20 0 BEADRP C[C@@H]([NH3+])[C@@H]1CCC[N@H+](CCc2cccs2)C1 ZINC000069626985 642885467 /nfs/dbraw/zinc/88/54/67/642885467.db2.gz WXLONXVLPHPZOP-VXGBXAGGSA-N 2 0 238.400 2.350 20 0 BEADRP C[C@@H]([NH3+])[C@H]1CCC[N@H+](CCc2cccs2)C1 ZINC000069626990 642886335 /nfs/dbraw/zinc/88/63/35/642886335.db2.gz WXLONXVLPHPZOP-NEPJUHHUSA-N 2 0 238.400 2.350 20 0 BEADRP C[C@H]([NH3+])[C@H]1CCC[N@H+](CCc2cccs2)C1 ZINC000069626987 642886922 /nfs/dbraw/zinc/88/69/22/642886922.db2.gz WXLONXVLPHPZOP-RYUDHWBXSA-N 2 0 238.400 2.350 20 0 BEADRP C(CC1CCC1)[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000090233287 643077569 /nfs/dbraw/zinc/07/75/69/643077569.db2.gz NVQOWWBZIZOMPD-UONOGXRCSA-N 2 0 222.376 2.393 20 0 BEADRP [NH3+]CC[C@H]1CC[N@H+](Cc2cc(F)cc(F)c2)C1 ZINC000097918782 643214187 /nfs/dbraw/zinc/21/41/87/643214187.db2.gz IOZDSSHQKFRSNE-JTQLQIEISA-N 2 0 240.297 2.136 20 0 BEADRP CC1(C)CCC[N@H+](CC[C@H]2CCC[NH2+]C2)C1 ZINC000069793396 643223138 /nfs/dbraw/zinc/22/31/38/643223138.db2.gz CCCGHPUHSXHGKX-CYBMUJFWSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+]C1CCCCCC1 ZINC000082560494 643342123 /nfs/dbraw/zinc/34/21/23/643342123.db2.gz BLVAOTXRTWKBLB-NEPJUHHUSA-N 2 0 210.365 2.154 20 0 BEADRP CCCC[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000120975244 643414447 /nfs/dbraw/zinc/41/44/47/643414447.db2.gz KHCMPNQYVBKMLZ-UHFFFAOYSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@@H]2CC[C@H]([NH3+])C2)[C@H](C)C1 ZINC000085015677 643523746 /nfs/dbraw/zinc/52/37/46/643523746.db2.gz NFOBDSMKXOMTLP-LPWJVIDDSA-N 2 0 210.365 2.234 20 0 BEADRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]C1CCCCCC1 ZINC000084218023 643551196 /nfs/dbraw/zinc/55/11/96/643551196.db2.gz FWRCVRNRZGGPKZ-DGCLKSJQSA-N 2 0 210.365 2.426 20 0 BEADRP C[NH2+]CCC[N@H+](C)[C@H]1C[C@@H]1c1ccccc1 ZINC000846222425 643651359 /nfs/dbraw/zinc/65/13/59/643651359.db2.gz OIEXAJXZUMXAEG-KGLIPLIRSA-N 2 0 218.344 2.084 20 0 BEADRP CC[NH+](CC)C[C@@H]([NH3+])CCC(C)(C)C ZINC000074212917 643657971 /nfs/dbraw/zinc/65/79/71/643657971.db2.gz JYMKTXBZZSDYDZ-NSHDSACASA-N 2 0 200.370 2.482 20 0 BEADRP C[C@@H](C[N@@H+]1CC[C@H](C[NH3+])C1)c1ccccc1 ZINC000050245504 643660953 /nfs/dbraw/zinc/66/09/53/643660953.db2.gz AXCCSGLZYHMTOD-QWHCGFSZSA-N 2 0 218.344 2.071 20 0 BEADRP Cc1ccc(C)c(C[N@@H+]2CC[C@H](C[NH3+])C2)c1 ZINC000050245567 643661413 /nfs/dbraw/zinc/66/14/13/643661413.db2.gz GYMXVSVUCVJFTA-CYBMUJFWSA-N 2 0 218.344 2.084 20 0 BEADRP Cc1ccc(C[NH2+]C2CC[NH2+]CC2)cc1C ZINC000084487060 643663946 /nfs/dbraw/zinc/66/39/46/643663946.db2.gz PFAXDISYISYKBU-UHFFFAOYSA-N 2 0 218.344 2.145 20 0 BEADRP C[C@@H]1CCC[C@H](C)[N@H+]1C[C@@H]1CC[C@H]([NH3+])C1 ZINC000085014429 643680350 /nfs/dbraw/zinc/68/03/50/643680350.db2.gz URFQBDLLKUTDQI-XQHKEYJVSA-N 2 0 210.365 2.377 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[NH+](CC2CC2)CC2CC2)C1 ZINC000085016092 643680813 /nfs/dbraw/zinc/68/08/13/643680813.db2.gz FFNLTSRDKXBJDR-UONOGXRCSA-N 2 0 222.376 2.236 20 0 BEADRP CS[C@@H]1CCC[C@H]([NH2+]C[C@H](C)C[NH+](C)C)C1 ZINC000922140086 643870542 /nfs/dbraw/zinc/87/05/42/643870542.db2.gz NKCNZJDKEHEOEX-RWMBFGLXSA-N 2 0 244.448 2.448 20 0 BEADRP CS[C@@H]1CCC[C@@H]([NH2+]C[C@@H](C)C[NH+](C)C)C1 ZINC000922140085 643870801 /nfs/dbraw/zinc/87/08/01/643870801.db2.gz NKCNZJDKEHEOEX-JHJVBQTASA-N 2 0 244.448 2.448 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)s1 ZINC000086403905 644131108 /nfs/dbraw/zinc/13/11/08/644131108.db2.gz AOUQYENQOIZUFK-MNOVXSKESA-N 2 0 224.373 2.416 20 0 BEADRP C[C@@H]1C[C@@H]1[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCCC[NH2+]1 ZINC000086500063 644144658 /nfs/dbraw/zinc/14/46/58/644144658.db2.gz WCXHMKNOIHJRNU-RGDJUOJXSA-N 2 0 222.376 2.295 20 0 BEADRP CC(C)[NH2+]C1CC[NH+](C[Si](C)(C)C)CC1 ZINC000171740947 644177146 /nfs/dbraw/zinc/17/71/46/644177146.db2.gz NJQOMCMASCPUIS-UHFFFAOYSA-N 2 0 228.456 2.326 20 0 BEADRP C([NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)[C@]12C[C@H]1CCC2 ZINC000922962952 644204658 /nfs/dbraw/zinc/20/46/58/644204658.db2.gz OLRPGPXNYVXLTG-BARDWOONSA-N 2 0 234.387 2.393 20 0 BEADRP C[C@@H](C1CC1)[N@H+](CCC[NH2+]C1CC1)C1CC1 ZINC000923305251 644341031 /nfs/dbraw/zinc/34/10/31/644341031.db2.gz LOLBATYFJSXILX-NSHDSACASA-N 2 0 222.376 2.391 20 0 BEADRP c1n[nH]cc1[C@H]1CCCCN1CCC[NH2+]C1CC1 ZINC000923324183 644352670 /nfs/dbraw/zinc/35/26/70/644352670.db2.gz DDKGXJFFUDZKKU-CQSZACIVSA-N 2 0 248.374 2.079 20 0 BEADRP [NH3+][C@@H]1CC[C@H]2C[N@H+](CCc3cccc(F)c3)C[C@H]12 ZINC000923331774 644360216 /nfs/dbraw/zinc/36/02/16/644360216.db2.gz ICQRRIFGFUIMFO-AEGPPILISA-N 2 0 248.345 2.037 20 0 BEADRP C(C1CCC2(CC2)CC1)[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC000923348317 644360400 /nfs/dbraw/zinc/36/04/00/644360400.db2.gz CIULPWQZHASRAO-OKILXGFUSA-N 2 0 234.387 2.108 20 0 BEADRP [NH3+][C@@H]1CC[C@@H]2C[N@H+](CCc3cccc(F)c3)C[C@@H]12 ZINC000923331776 644361117 /nfs/dbraw/zinc/36/11/17/644361117.db2.gz ICQRRIFGFUIMFO-BPLDGKMQSA-N 2 0 248.345 2.037 20 0 BEADRP CCCCCC[C@H](O)C[N@@H+]1CC[C@@H]([NH3+])C[C@H]1C ZINC000923392203 644399777 /nfs/dbraw/zinc/39/97/77/644399777.db2.gz IIOZYAKZXCMRGU-MCIONIFRSA-N 2 0 242.407 2.129 20 0 BEADRP C[C@@H]1CC[C@H](C)N(CC[NH2+]C(C)(C)C)C1 ZINC000084047057 644415585 /nfs/dbraw/zinc/41/55/85/644415585.db2.gz IKXIBSPLKGSXMV-NEPJUHHUSA-N 2 0 212.381 2.495 20 0 BEADRP CCCCC[NH+]1CCC2(CO[C@H](C[NH3+])C2)CC1 ZINC000923457809 644437320 /nfs/dbraw/zinc/43/73/20/644437320.db2.gz KDVXGBMHUQTIMD-ZDUSSCGKSA-N 2 0 240.391 2.006 20 0 BEADRP CCO[C@H]1C[C@H]([NH2+]C2CCC([NH3+])CC2)C1(C)C ZINC000085398250 644440532 /nfs/dbraw/zinc/44/05/32/644440532.db2.gz BMFWILSUFCRWET-TYUFSLCMSA-N 2 0 240.391 2.050 20 0 BEADRP C[C@H]1C[N@H+](CCCCCCC[NH3+])C[C@H]1C ZINC000086015349 644457241 /nfs/dbraw/zinc/45/72/41/644457241.db2.gz GFBFXYKTJXXZPH-BETUJISGSA-N 2 0 212.381 2.483 20 0 BEADRP C[NH+]1CCC(C[NH2+]C2C(C)(C)C2(C)C)CC1 ZINC000086239610 644459422 /nfs/dbraw/zinc/45/94/22/644459422.db2.gz DBDRBZZFAHPNLF-UHFFFAOYSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1C[N@H+](CCCCCF)CC[C@@H]1C[NH3+] ZINC000923495302 644460994 /nfs/dbraw/zinc/46/09/94/644460994.db2.gz BGEOUJUQBIWVCF-VXGBXAGGSA-N 2 0 216.344 2.043 20 0 BEADRP C[C@H]1C[N@H+](CCC2CCC2)CC[C@H]1C[NH3+] ZINC000923488011 644462583 /nfs/dbraw/zinc/46/25/83/644462583.db2.gz CTMFUAXHURKRJK-AAEUAGOBSA-N 2 0 210.365 2.093 20 0 BEADRP C[C@H]1C[N@H+](CCCC(C)(F)F)CC[C@H]1C[NH3+] ZINC000923490522 644464849 /nfs/dbraw/zinc/46/48/49/644464849.db2.gz DFJJVZFHTRINEH-QWRGUYRKSA-N 2 0 234.334 2.339 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@H]([NH3+])C1)c1ccccn1 ZINC000086402272 644465663 /nfs/dbraw/zinc/46/56/63/644465663.db2.gz LGKOQUBDLUAPSB-SRVKXCTJSA-N 2 0 219.332 2.002 20 0 BEADRP Cc1cccc(C[NH2+][C@H]2CCC[C@H]([NH3+])C2)c1 ZINC000086402334 644466520 /nfs/dbraw/zinc/46/65/20/644466520.db2.gz JSINSVLNEQRIHX-KBPBESRZSA-N 2 0 218.344 2.355 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]Cc2cccs2)C1 ZINC000086402362 644466650 /nfs/dbraw/zinc/46/66/50/644466650.db2.gz OOMHDUHLHGEJSH-ZJUUUORDSA-N 2 0 210.346 2.108 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@H](C[NH3+])[C@@H](C)C2)c(C)n1 ZINC000923494916 644470818 /nfs/dbraw/zinc/47/08/18/644470818.db2.gz QMGWSQYMFXMAAQ-SMDDNHRTSA-N 2 0 247.386 2.115 20 0 BEADRP COc1cccc(C[N@@H+]2CC[C@@H](C[NH3+])[C@H](C)C2)c1 ZINC000923498551 644474002 /nfs/dbraw/zinc/47/40/02/644474002.db2.gz OTXWEAPOSASSOA-OCCSQVGLSA-N 2 0 248.370 2.112 20 0 BEADRP C[C@@H]1C[N@H+](Cc2cccc(F)c2)CC[C@H]1C[NH3+] ZINC000923498343 644474251 /nfs/dbraw/zinc/47/42/51/644474251.db2.gz HICJHAOKZXJCIE-YPMHNXCESA-N 2 0 236.334 2.242 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@@H](C[NH3+])[C@H](C)C2)cc1 ZINC000923505094 644474672 /nfs/dbraw/zinc/47/46/72/644474672.db2.gz YEKFYGGMDFKZSR-HIFRSBDPSA-N 2 0 232.371 2.412 20 0 BEADRP Cc1ccccc1C[N@@H+]1CC[C@@H](C[NH3+])[C@H](C)C1 ZINC000923505107 644474941 /nfs/dbraw/zinc/47/49/41/644474941.db2.gz YMOLSVUNATYSFB-KGLIPLIRSA-N 2 0 232.371 2.412 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@H](C[NH3+])[C@@H](C)C2)cc1 ZINC000923505093 644474952 /nfs/dbraw/zinc/47/49/52/644474952.db2.gz YEKFYGGMDFKZSR-DZGCQCFKSA-N 2 0 232.371 2.412 20 0 BEADRP Cc1ccccc1C[N@@H+]1CC[C@H](C[NH3+])[C@H](C)C1 ZINC000923505109 644475222 /nfs/dbraw/zinc/47/52/22/644475222.db2.gz YMOLSVUNATYSFB-ZIAGYGMSSA-N 2 0 232.371 2.412 20 0 BEADRP C[C@H](c1cccnc1)[N@@H+]1CC[C@H](C[NH3+])[C@H](C)C1 ZINC000923501295 644475858 /nfs/dbraw/zinc/47/58/58/644475858.db2.gz PYLHVKMNDQBUGI-JHJVBQTASA-N 2 0 233.359 2.059 20 0 BEADRP c1ccc([C@H]2C[C@H]2[N@@H+]2C[C@@H]3CC[NH2+]C[C@@H]3C2)cc1 ZINC000923515610 644480585 /nfs/dbraw/zinc/48/05/85/644480585.db2.gz IJRQFGTUUUPCHL-ZJIFWQFVSA-N 2 0 242.366 2.084 20 0 BEADRP Cc1cccc(C)c1C[N@@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1 ZINC000923517916 644481576 /nfs/dbraw/zinc/48/15/76/644481576.db2.gz HKHICIMQSMOFHC-LSDHHAIUSA-N 2 0 244.382 2.345 20 0 BEADRP Cc1ccc(C[N@@H+]2C[C@@H]3CC[NH2+]C[C@@H]3C2)c(C)c1 ZINC000923518156 644483944 /nfs/dbraw/zinc/48/39/44/644483944.db2.gz ALYRIJYFPCWGQZ-JKSUJKDBSA-N 2 0 244.382 2.345 20 0 BEADRP CC[C@@H](C)C[N@@H+]1CC[C@@]2(C1)CCCC[NH2+]2 ZINC000923534208 644489943 /nfs/dbraw/zinc/48/99/43/644489943.db2.gz RNVGWFNPDIKXFZ-CHWSQXEVSA-N 2 0 210.365 2.251 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]CCOC1CCCC1 ZINC000089146430 644536935 /nfs/dbraw/zinc/53/69/35/644536935.db2.gz YYNFGMLVKSRGTA-JSGCOSHPSA-N 2 0 240.391 2.053 20 0 BEADRP CC[NH+](CC)CC1CC[NH+](CCF)CC1 ZINC000759337650 644639298 /nfs/dbraw/zinc/63/92/98/644639298.db2.gz DQJXUTVBEWQNOE-UHFFFAOYSA-N 2 0 216.344 2.010 20 0 BEADRP CC[N@@H+]1CC[C@H](N(C)C/C=C/Cl)[C@@H](C)C1 ZINC000247348425 644633427 /nfs/dbraw/zinc/63/34/27/644633427.db2.gz XZFBJBAKORTTNV-YILIYONBSA-N 2 0 230.783 2.401 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+][C@H]1CCCc2occc21 ZINC000250154451 644747207 /nfs/dbraw/zinc/74/72/07/644747207.db2.gz CCYUQOXJJFPZIR-UHTWSYAYSA-N 2 0 234.343 2.374 20 0 BEADRP CC[C@H]1C[N@H+](CCc2cccs2)CC[C@H]1[NH3+] ZINC000251572975 644810621 /nfs/dbraw/zinc/81/06/21/644810621.db2.gz BYLXOVIVYIJYOQ-WCQYABFASA-N 2 0 238.400 2.350 20 0 BEADRP C[C@@H]1CCCC[N@@H+]1CCC[NH2+][C@H]1CCSC1 ZINC000252196659 644841951 /nfs/dbraw/zinc/84/19/51/644841951.db2.gz SMJFOKQZKVIBGJ-OLZOCXBDSA-N 2 0 242.432 2.346 20 0 BEADRP C[C@@H]1C[C@@H]1[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCCC[NH2+]1 ZINC000252200062 644842023 /nfs/dbraw/zinc/84/20/23/644842023.db2.gz WCXHMKNOIHJRNU-HTOAHKCRSA-N 2 0 222.376 2.295 20 0 BEADRP CSC(C)(C)C[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000252703080 644885285 /nfs/dbraw/zinc/88/52/85/644885285.db2.gz FIDBJERYUMMKLC-NEPJUHHUSA-N 2 0 242.432 2.344 20 0 BEADRP C(C[NH2+]C1CC1)C[N@@H+]1CCC2(CCCC2)C1 ZINC000304397731 644900789 /nfs/dbraw/zinc/90/07/89/644900789.db2.gz NOAACSAJJIRYJW-UHFFFAOYSA-N 2 0 222.376 2.395 20 0 BEADRP CSC[C@H](C)[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000252918620 644925454 /nfs/dbraw/zinc/92/54/54/644925454.db2.gz ZEOFZEXEBFIPGS-UMSGYPCISA-N 2 0 242.432 2.248 20 0 BEADRP C[C@@H]1SCC[N@H+](CC[C@H]2CCC[NH2+]C2)[C@H]1C ZINC000253081555 644934834 /nfs/dbraw/zinc/93/48/34/644934834.db2.gz WKCYGPCGWMNDGQ-RWMBFGLXSA-N 2 0 242.432 2.202 20 0 BEADRP [NH3+]C1(C[NH2+]CC[C@H]2CC2(Cl)Cl)CCC1 ZINC000843367705 645284918 /nfs/dbraw/zinc/28/49/18/645284918.db2.gz JWMOPRSNOJORML-QMMMGPOBSA-N 2 0 237.174 2.041 20 0 BEADRP [NH3+]C1(C[NH2+]CC[C@@H]2CC2(Cl)Cl)CCC1 ZINC000843367704 645286369 /nfs/dbraw/zinc/28/63/69/645286369.db2.gz JWMOPRSNOJORML-MRVPVSSYSA-N 2 0 237.174 2.041 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+]CCC1CC[NH2+]CC1 ZINC000844922860 645347533 /nfs/dbraw/zinc/34/75/33/645347533.db2.gz BYXOPFFQUMZPTQ-KBPBESRZSA-N 2 0 224.392 2.400 20 0 BEADRP CC(C)[C@H]1CC[C@H]1[NH2+]CCC1(C[NH3+])CC1 ZINC000844920185 645349256 /nfs/dbraw/zinc/34/92/56/645349256.db2.gz KQHPAUVGEUXNGO-VXGBXAGGSA-N 2 0 210.365 2.140 20 0 BEADRP C[N@H+]1C[C@H]2CC[C@@H](C1)C2[NH2+]CCC(C)(C)F ZINC000926702918 645369454 /nfs/dbraw/zinc/36/94/54/645369454.db2.gz RFQIQIIDTVDGRG-FOSCPWQOSA-N 2 0 228.355 2.054 20 0 BEADRP C[C@H]([NH2+]C1CCC([NH3+])CC1)c1ccc(F)cn1 ZINC000134008390 645870050 /nfs/dbraw/zinc/87/00/50/645870050.db2.gz WJOAHBXHKHZRLH-GCVQQVDUSA-N 2 0 237.322 2.141 20 0 BEADRP C[C@@H](C[NH2+][C@H](CCC[NH3+])c1ccccc1)N(C)C ZINC000925494599 645924142 /nfs/dbraw/zinc/92/41/42/645924142.db2.gz KPXMDYGPIKHYNU-DZGCQCFKSA-N 2 0 249.402 2.006 20 0 BEADRP CC(C)CC[NH+]1CCC([NH2+][C@@H]2C[C@H]2C)CC1 ZINC000924952582 646140263 /nfs/dbraw/zinc/14/02/63/646140263.db2.gz XJJMTGSLYDGUFP-TZMCWYRMSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+][C@@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925478965 646292518 /nfs/dbraw/zinc/29/25/18/646292518.db2.gz FPXVRQAWGSAFQR-WISYIIOYSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H]1CCC[C@H](C)[C@H]1[NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2 ZINC000925481345 646294315 /nfs/dbraw/zinc/29/43/15/646294315.db2.gz NLOYVXFJYWUIKU-JJZOZOEJSA-N 2 0 248.414 2.397 20 0 BEADRP CC1(C)C[C@@H]([NH2+]CC2CCC2)C[C@@H]([NH3+])C1 ZINC000925487536 646297628 /nfs/dbraw/zinc/29/76/28/646297628.db2.gz WTLCYRRMMOPUAA-NEPJUHHUSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)C[NH2+][C@H]1CC[NH2+]C[C@@H]1C1CCCC1 ZINC000925492069 646299309 /nfs/dbraw/zinc/29/93/09/646299309.db2.gz FGZJGNXGXAAVML-KGLIPLIRSA-N 2 0 224.392 2.400 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1NCCc1ccc(F)cc1 ZINC000925488232 646299679 /nfs/dbraw/zinc/29/96/79/646299679.db2.gz IOKDZOSDAUIWGJ-ZDUSSCGKSA-N 2 0 236.334 2.098 20 0 BEADRP CC(C)C[NH2+][C@H]1CC[NH2+]C[C@H]1C1CCCC1 ZINC000925492066 646300018 /nfs/dbraw/zinc/30/00/18/646300018.db2.gz FGZJGNXGXAAVML-KBPBESRZSA-N 2 0 224.392 2.400 20 0 BEADRP CC1(C)C[C@@H]([NH2+]C2CCCC2)C[C@@H]([NH3+])C1 ZINC000925495979 646301402 /nfs/dbraw/zinc/30/14/02/646301402.db2.gz RHBYRDSTYUJBPQ-PWSUYJOCSA-N 2 0 210.365 2.425 20 0 BEADRP CSCC[NH2+][C@@H]1CC[NH2+]C[C@@H]1C1CCCC1 ZINC000925501772 646303802 /nfs/dbraw/zinc/30/38/02/646303802.db2.gz CATFKPUCQAAHJL-CHWSQXEVSA-N 2 0 242.432 2.107 20 0 BEADRP CSC[C@H](C)[NH2+][C@@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925505293 646305245 /nfs/dbraw/zinc/30/52/45/646305245.db2.gz QFTLKPJJICWUMD-HBNTYKKESA-N 2 0 230.421 2.234 20 0 BEADRP CC[NH+](CC)CCN[C@H](c1ccccc1)[C@H](C)[NH3+] ZINC000925505488 646305966 /nfs/dbraw/zinc/30/59/66/646305966.db2.gz UJINXFYTBFFBDC-ZFWWWQNUSA-N 2 0 249.402 2.006 20 0 BEADRP CC1(C)C[C@H]([NH3+])C[C@@H]([NH2+][C@@H]2CCCSC2)C1 ZINC000925530670 646318898 /nfs/dbraw/zinc/31/88/98/646318898.db2.gz LGVHAODPAXKEMH-IJLUTSLNSA-N 2 0 242.432 2.378 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@H]([NH3+])CC(C)(C)C1)[C@H]1CCCO1 ZINC000925538301 646322855 /nfs/dbraw/zinc/32/28/55/646322855.db2.gz TZNGWWFFEYEEQY-WUHRBBMRSA-N 2 0 240.391 2.050 20 0 BEADRP CC1(C)C[C@@H]([NH2+]CCC2CC2)C[C@@H]([NH3+])C1 ZINC000925572227 646340039 /nfs/dbraw/zinc/34/00/39/646340039.db2.gz HHPQKCWIMSDUMK-NEPJUHHUSA-N 2 0 210.365 2.282 20 0 BEADRP CC1(C)[C@@H]([NH2+]CCC2CC2)[C@@H]2CCC[NH2+][C@@H]21 ZINC000925575251 646341874 /nfs/dbraw/zinc/34/18/74/646341874.db2.gz YSDZQSPPURFADK-AGIUHOORSA-N 2 0 222.376 2.153 20 0 BEADRP CC[C@H](O)CCC[NH2+][C@@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925582718 646346994 /nfs/dbraw/zinc/34/69/94/646346994.db2.gz ZCIXVYCZBPMZEG-XQQFMLRXSA-N 2 0 242.407 2.033 20 0 BEADRP C[C@@H](C[NH2+][C@@H]1CC[NH2+]C12CCCC2)C1CC1 ZINC000925583416 646347252 /nfs/dbraw/zinc/34/72/52/646347252.db2.gz FFZQTFNHJGHMFB-WCQYABFASA-N 2 0 222.376 2.297 20 0 BEADRP CC1(C)[C@@H]([NH2+]CCc2ccco2)[C@@H]2CCC[NH2+][C@@H]21 ZINC000925611976 646360641 /nfs/dbraw/zinc/36/06/41/646360641.db2.gz OZPCXETZOWVMCC-RDBSUJKOSA-N 2 0 248.370 2.188 20 0 BEADRP FCCC[NH2+][C@H]1CC[NH2+]C[C@@H]1C1CCCC1 ZINC000925621067 646367228 /nfs/dbraw/zinc/36/72/28/646367228.db2.gz YHEWPQARQHKHSR-OLZOCXBDSA-N 2 0 228.355 2.104 20 0 BEADRP FC1(F)CCC([NH2+][C@@H]2CC[NH2+]C23CCC3)CC1 ZINC000925629710 646374909 /nfs/dbraw/zinc/37/49/09/646374909.db2.gz NDAFWEKVSAICHH-LLVKDONJSA-N 2 0 244.329 2.439 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@@H]([NH3+])CC(C)(C)C2)CCO1 ZINC000925632202 646376041 /nfs/dbraw/zinc/37/60/41/646376041.db2.gz VPRVQWRGANJTTL-FDYHWXHSSA-N 2 0 240.391 2.050 20 0 BEADRP CC(C)C(C)(C)C[NH2+][C@H]1CC[NH2+]C1(C)C ZINC000925645000 646384355 /nfs/dbraw/zinc/38/43/55/646384355.db2.gz NLHHGFBCRPMACJ-NSHDSACASA-N 2 0 212.381 2.399 20 0 BEADRP CC1(C)CC(C[NH2+][C@H]2CC[NH2+]C2(C)C)C1 ZINC000925645371 646387685 /nfs/dbraw/zinc/38/76/85/646387685.db2.gz PYSHPLMSXBHJAU-NSHDSACASA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[NH2+]C23CCCC3)C1 ZINC000925645353 646387913 /nfs/dbraw/zinc/38/79/13/646387913.db2.gz PXMVEHXUXOAJPJ-FRRDWIJNSA-N 2 0 222.376 2.439 20 0 BEADRP CC1(C)C[C@@H]([NH2+]C2CC(F)(F)C2)C[C@@H]([NH3+])C1 ZINC000925651482 646391256 /nfs/dbraw/zinc/39/12/56/646391256.db2.gz DKHKASJHYIMKGR-BDAKNGLRSA-N 2 0 232.318 2.280 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+][C@H]1CC12CCCC2 ZINC000925651475 646391478 /nfs/dbraw/zinc/39/14/78/646391478.db2.gz DGMDRLDBXKHGPZ-VZANTVGXSA-N 2 0 234.387 2.425 20 0 BEADRP CSC1(C[NH2+][C@H]2CC[NH2+]C2(C)C)CCC1 ZINC000925656198 646393805 /nfs/dbraw/zinc/39/38/05/646393805.db2.gz IPLKJRZZBKCKNC-JTQLQIEISA-N 2 0 228.405 2.002 20 0 BEADRP CC(C)(C)C1CC([NH2+][C@H]2[C@@H]3[NH2+]C[C@@H]4C[C@H]2C[C@@H]43)C1 ZINC000925677082 646405050 /nfs/dbraw/zinc/40/50/50/646405050.db2.gz NRPOPUXAFPRETF-BFKHZNPWSA-N 2 0 248.414 2.397 20 0 BEADRP CC1(C)C[C@@H]([NH3+])C[C@H]([NH2+]CCCCF)C1 ZINC000925678061 646406376 /nfs/dbraw/zinc/40/63/76/646406376.db2.gz ZLOLKBZXTBSXNL-QWRGUYRKSA-N 2 0 216.344 2.232 20 0 BEADRP CC1(C)C[C@@H]([NH2+]CCCCF)C[C@@H]([NH3+])C1 ZINC000925678060 646407493 /nfs/dbraw/zinc/40/74/93/646407493.db2.gz ZLOLKBZXTBSXNL-MNOVXSKESA-N 2 0 216.344 2.232 20 0 BEADRP CC/C=C/C[NH2+][C@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C ZINC000925679026 646407792 /nfs/dbraw/zinc/40/77/92/646407792.db2.gz BNLWSIMJJCNHEV-HJMNKLKPSA-N 2 0 222.376 2.319 20 0 BEADRP C[C@H](F)CC[NH2+][C@H]1CC[NH2+]C[C@H]1C1CCCC1 ZINC000925678177 646407825 /nfs/dbraw/zinc/40/78/25/646407825.db2.gz SJWZGBOLSZQDON-UBHSHLNASA-N 2 0 242.382 2.492 20 0 BEADRP CC[C@@H]1OCC[C@H]1[NH2+][C@@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925684428 646411264 /nfs/dbraw/zinc/41/12/64/646411264.db2.gz AYBCDKDPJOSGLR-LPWJVIDDSA-N 2 0 240.391 2.050 20 0 BEADRP CC(C)[C@@H]1C[C@H]1C[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000925689225 646414318 /nfs/dbraw/zinc/41/43/18/646414318.db2.gz HLJBOKSXAJHBEC-RWMBFGLXSA-N 2 0 222.376 2.153 20 0 BEADRP CC(C)[C@@H]1C[C@H]1C[NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2 ZINC000925693359 646418394 /nfs/dbraw/zinc/41/83/94/646418394.db2.gz RWXDLXMXCKEAJX-WUHRBBMRSA-N 2 0 222.376 2.138 20 0 BEADRP CC(C)[C@@H]1C[C@H]1C[NH2+][C@H]1C[C@H]([NH3+])C12CCC2 ZINC000925693357 646418545 /nfs/dbraw/zinc/41/85/45/646418545.db2.gz RWXDLXMXCKEAJX-CYDGBPFRSA-N 2 0 222.376 2.138 20 0 BEADRP C1CC12C[C@H]2[NH2+][C@@H]1CC[NH2+]C[C@H]1C1CCCC1 ZINC000925703477 646427393 /nfs/dbraw/zinc/42/73/93/646427393.db2.gz GEJBGHPKNCCJOV-BFHYXJOUSA-N 2 0 234.387 2.297 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+]C[C@@H]1C[C@H]1C1CCC1 ZINC000925705594 646430876 /nfs/dbraw/zinc/43/08/76/646430876.db2.gz LEFWTPZCTXYDHZ-AVGNSLFASA-N 2 0 222.376 2.153 20 0 BEADRP CC1(C)C[C@@H]([NH2+][C@@H]2C[C@H]3C[C@H]3C2)C[C@@H]([NH3+])C1 ZINC000925706067 646431481 /nfs/dbraw/zinc/43/14/81/646431481.db2.gz LAYXWSNLMIRDOR-MLGHIDQZSA-N 2 0 222.376 2.281 20 0 BEADRP CC1(C)[C@H]([NH2+][C@@H]2C=CCC2)[C@@H]2CCC[NH2+][C@@H]21 ZINC000925708111 646432750 /nfs/dbraw/zinc/43/27/50/646432750.db2.gz CWFNQHBJMZAQQM-FVCCEPFGSA-N 2 0 220.360 2.071 20 0 BEADRP C1=C[C@H]([NH2+][C@@H]2CC[NH2+]C[C@@H]2C2CCCC2)CC1 ZINC000925708679 646432835 /nfs/dbraw/zinc/43/28/35/646432835.db2.gz CZMUKHXBKTXYQL-RRFJBIMHSA-N 2 0 234.387 2.463 20 0 BEADRP CC1(C)C[C@@H]([NH2+][C@@H]2C=CCC2)C[C@@H]([NH3+])C1 ZINC000925710195 646434742 /nfs/dbraw/zinc/43/47/42/646434742.db2.gz HYXSQSIJBIMUSY-UTUOFQBUSA-N 2 0 208.349 2.201 20 0 BEADRP C([NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2)[C@@H]1C[C@H]1C1CCC1 ZINC000925711097 646437221 /nfs/dbraw/zinc/43/72/21/646437221.db2.gz WUEVZGNLMULSAK-ZNHNDWKLSA-N 2 0 246.398 2.009 20 0 BEADRP CC(C)[C@H]([NH3+])CCN[C@@H](c1ccccc1)[C@@H](C)[NH3+] ZINC000925715792 646440245 /nfs/dbraw/zinc/44/02/45/646440245.db2.gz MERUTFAAGIXRAR-BPLDGKMQSA-N 2 0 249.402 2.038 20 0 BEADRP CCC[C@H](CCO)[NH2+][C@@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925725197 646450774 /nfs/dbraw/zinc/45/07/74/646450774.db2.gz RRAINFGFWROSFT-YNEHKIRRSA-N 2 0 242.407 2.033 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CC1(CC2CC2)CC1 ZINC000925733129 646451528 /nfs/dbraw/zinc/45/15/28/646451528.db2.gz GAAUAQOVXQWUCJ-WDEREUQCSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CC1(CC2CC2)CC1 ZINC000925733127 646451828 /nfs/dbraw/zinc/45/18/28/646451828.db2.gz GAAUAQOVXQWUCJ-QWRGUYRKSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+]CC1(CC2CC2)CC1 ZINC000925734534 646452689 /nfs/dbraw/zinc/45/26/89/646452689.db2.gz SCLHBRKSQWPAPJ-NWDGAFQWSA-N 2 0 208.349 2.036 20 0 BEADRP CC1(C)[C@@H]([NH2+]C[C@@H]2C=CCC2)[C@@H]2CCC[NH2+][C@@H]21 ZINC000925731011 646453256 /nfs/dbraw/zinc/45/32/56/646453256.db2.gz IURIOVSCAXCGHD-MQYQWHSLSA-N 2 0 234.387 2.319 20 0 BEADRP [NH3+]C1C[C@H]2CCC[C@@H](C1)C2[NH2+]C[C@@H]1C=CCC1 ZINC000925729879 646453681 /nfs/dbraw/zinc/45/36/81/646453681.db2.gz ACVDKLFJHSTBTA-DYALKNRASA-N 2 0 234.387 2.448 20 0 BEADRP CC1(C)C[C@@]1(C)C[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000925733356 646455522 /nfs/dbraw/zinc/45/55/22/646455522.db2.gz HGSDDFFXJLZTFL-AAEUAGOBSA-N 2 0 222.376 2.297 20 0 BEADRP CC1(C)C[C@]1(C)C[NH2+][C@@H]1CC[NH2+]C1(C)C ZINC000925733418 646455581 /nfs/dbraw/zinc/45/55/81/646455581.db2.gz IQQMPFOPLTWPIY-ZWNOBZJWSA-N 2 0 210.365 2.153 20 0 BEADRP CC1(C)C[C@]1(C)C[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000925733358 646455782 /nfs/dbraw/zinc/45/57/82/646455782.db2.gz HGSDDFFXJLZTFL-WCQYABFASA-N 2 0 222.376 2.297 20 0 BEADRP CC(C)(C[NH2+]C1CC[NH2+]CC1)CC(F)F ZINC000925733391 646456627 /nfs/dbraw/zinc/45/66/27/646456627.db2.gz HWFOTCIWAPINGX-UHFFFAOYSA-N 2 0 220.307 2.009 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]C[C@@]1(C)CC1(C)C ZINC000925734955 646457843 /nfs/dbraw/zinc/45/78/43/646457843.db2.gz WDXNLKOHBKGEQH-YRGRVCCFSA-N 2 0 224.392 2.400 20 0 BEADRP C([NH2+][C@@H]1CCC[NH2+]CC1)C1(CC2CC2)CC1 ZINC000925735341 646458068 /nfs/dbraw/zinc/45/80/68/646458068.db2.gz ZHEBLMCWGPCDFS-CYBMUJFWSA-N 2 0 222.376 2.298 20 0 BEADRP C[C@@H]([NH2+]CC1(CC2CC2)CC1)[C@@H]1CC[NH2+]C1 ZINC000925734772 646458359 /nfs/dbraw/zinc/45/83/59/646458359.db2.gz ULQYAGSBJKCRBV-DGCLKSJQSA-N 2 0 222.376 2.154 20 0 BEADRP C[C@H]([NH2+]CC(C)(C)CC(F)F)[C@@H]1CC[NH2+]C1 ZINC000925735354 646458783 /nfs/dbraw/zinc/45/87/83/646458783.db2.gz ZIXMDGPTOCVIMA-VHSXEESVSA-N 2 0 234.334 2.255 20 0 BEADRP CC(C)([NH3+])CC[NH2+][C@H]1CCCC12CCC2 ZINC000925736869 646460091 /nfs/dbraw/zinc/46/00/91/646460091.db2.gz DURLIZCYYBMHHT-NSHDSACASA-N 2 0 210.365 2.426 20 0 BEADRP CC(C)([NH3+])CC[NH2+][C@@H]1CCC[C@@H]1CCF ZINC000925736835 646460116 /nfs/dbraw/zinc/46/01/16/646460116.db2.gz CVYIJPNLVIMBHS-GHMZBOCLSA-N 2 0 216.344 2.232 20 0 BEADRP CO[C@H]1C[C@H](C[NH2+][C@@H](c2ccccc2)[C@H](C)N)C1 ZINC000925735466 646460302 /nfs/dbraw/zinc/46/03/02/646460302.db2.gz GGSGAWWFUCDFCO-NZBPQXDJSA-N 2 0 248.370 2.090 20 0 BEADRP C[C@H]([NH2+]CCC(C)(C)[NH3+])C1CCSCC1 ZINC000925737808 646461160 /nfs/dbraw/zinc/46/11/60/646461160.db2.gz LNWMRLJZOHTFNU-JTQLQIEISA-N 2 0 230.421 2.235 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+]CCC(C)(C)[NH3+])c(C)n1 ZINC000925742529 646461808 /nfs/dbraw/zinc/46/18/08/646461808.db2.gz VTCCOEFSZAJNOK-LLVKDONJSA-N 2 0 235.375 2.476 20 0 BEADRP CCC1([NH3+])CC[NH+]([C@H](C)[C@H]2CCCOC2)CC1 ZINC000925760067 646466125 /nfs/dbraw/zinc/46/61/25/646466125.db2.gz NYPZGDLOKZACRF-OLZOCXBDSA-N 2 0 240.391 2.005 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+][C@@H]1C[C@@H]2CCCC[C@H]12 ZINC000925763922 646466310 /nfs/dbraw/zinc/46/63/10/646466310.db2.gz DNZQDWXDGKXYHI-JZRPKSSGSA-N 2 0 208.349 2.035 20 0 BEADRP CC1(C)C[C@@H]([NH3+])C[C@H]([NH2+]CC[C@H]2CCCO2)C1 ZINC000925776733 646476194 /nfs/dbraw/zinc/47/61/94/646476194.db2.gz ZYPYMOBCBXRZJK-RWMBFGLXSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@@H]1CCCC(C)(C)C1 ZINC000925785895 646481593 /nfs/dbraw/zinc/48/15/93/646481593.db2.gz PYEZZNQHHHXZHC-FRRDWIJNSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+]C1CCc2ccccc2CC1 ZINC000925784278 646481808 /nfs/dbraw/zinc/48/18/08/646481808.db2.gz LUAWEGRJBNDMPR-MLGOLLRUSA-N 2 0 244.382 2.132 20 0 BEADRP CC[C@@H]([NH2+][C@@H]1C[NH2+]C[C@H]1C)C1CCCC1 ZINC000925787610 646482338 /nfs/dbraw/zinc/48/23/38/646482338.db2.gz YVWHUIUXDIOORA-RAIGVLPGSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@@H]1CCC[C@@H]1CCCF ZINC000925786522 646482785 /nfs/dbraw/zinc/48/27/85/646482785.db2.gz SXEAPMUTDJAXSM-YIYPIFLZSA-N 2 0 242.382 2.350 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H]1C[NH2+]C[C@H]1C)C1CCCC1 ZINC000925786504 646482942 /nfs/dbraw/zinc/48/29/42/646482942.db2.gz SWPPVBZMNQAFSD-KWCYVHTRSA-N 2 0 224.392 2.400 20 0 BEADRP Cc1ccc2c(c1)CC[C@H]2[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000925793203 646485113 /nfs/dbraw/zinc/48/51/13/646485113.db2.gz XRHBLBUTDYUKRM-IVMMDQJWSA-N 2 0 244.382 2.427 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000925788870 646485334 /nfs/dbraw/zinc/48/53/34/646485334.db2.gz CQACSVIGYBDTKV-UPJWGTAASA-N 2 0 236.359 2.046 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+]CC[C@@H]1C[C@H]1C1CC1 ZINC000925801004 646486919 /nfs/dbraw/zinc/48/69/19/646486919.db2.gz IENVJCCJEKRWDT-AGIUHOORSA-N 2 0 222.376 2.153 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]CC1C[C@H]2CC[C@@H](C1)S2 ZINC000925801499 646487349 /nfs/dbraw/zinc/48/73/49/646487349.db2.gz KNUMQFBKDBSGNB-LLUNPGSJSA-N 2 0 240.416 2.130 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1C[NH2+]C[C@H]1C)c1ccoc1 ZINC000925796771 646487421 /nfs/dbraw/zinc/48/74/21/646487421.db2.gz DQFRBLZRBAOCTO-GRYCIOLGSA-N 2 0 222.332 2.176 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+]CC[C@@H]1C[NH2+]C[C@H]1C ZINC000925803631 646488031 /nfs/dbraw/zinc/48/80/31/646488031.db2.gz SFCWWGYSZRCKNX-YIYPIFLZSA-N 2 0 224.392 2.256 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+]CC[C@@H]1C[NH2+]C[C@H]1C ZINC000925803629 646488889 /nfs/dbraw/zinc/48/88/89/646488889.db2.gz SFCWWGYSZRCKNX-MQYQWHSLSA-N 2 0 224.392 2.256 20 0 BEADRP C[C@@H]1C[C@H]1[C@@H]1C[C@H]1[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000925825205 646497892 /nfs/dbraw/zinc/49/78/92/646497892.db2.gz YAKYDZMXLJNWKT-PIFWCUCSSA-N 2 0 234.387 2.009 20 0 BEADRP CC1(C)CC[C@H]1[NH2+]C[C@]12CCC[C@H]1[NH2+]CC2 ZINC000925840038 646506272 /nfs/dbraw/zinc/50/62/72/646506272.db2.gz JXZOCQHJDRUBEN-YRGRVCCFSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C[C@]23CCC[C@H]2[NH2+]CC3)C1 ZINC000925842327 646508605 /nfs/dbraw/zinc/50/86/05/646508605.db2.gz IYGVWFPYIKAIMZ-AAVRWANBSA-N 2 0 222.376 2.297 20 0 BEADRP CCC[C@H](O)CC[NH2+][C@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925856094 646510712 /nfs/dbraw/zinc/51/07/12/646510712.db2.gz JEZGXRAYDTXMDA-AGIUHOORSA-N 2 0 242.407 2.033 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[NH2+]C2(C)C)CCS1 ZINC000925862035 646514163 /nfs/dbraw/zinc/51/41/63/646514163.db2.gz WKJKAGFQBWWDKN-GMTAPVOTSA-N 2 0 228.405 2.001 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCS[C@H](C)C1)[C@@H]1CCC[NH2+]1 ZINC000925862235 646514655 /nfs/dbraw/zinc/51/46/55/646514655.db2.gz YPARFCYHLDQACE-KKOKHZNYSA-N 2 0 228.405 2.001 20 0 BEADRP C[C@H]([NH2+][C@H]1CCS[C@H](C)C1)[C@H]1CCC[NH2+]1 ZINC000925862237 646514827 /nfs/dbraw/zinc/51/48/27/646514827.db2.gz YPARFCYHLDQACE-NOOOWODRSA-N 2 0 228.405 2.001 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@H]1CCS[C@H](C)C1 ZINC000925861196 646515472 /nfs/dbraw/zinc/51/54/72/646515472.db2.gz OFLBOZKUQSDFIB-UTUOFQBUSA-N 2 0 230.421 2.378 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+][C@H]1CCCc2cccnc21 ZINC000925871677 646522130 /nfs/dbraw/zinc/52/21/30/646522130.db2.gz DKFLBYSPMJICBX-MDZLAQPJSA-N 2 0 233.359 2.174 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CC[C@H]([NH3+])C1)c1ccco1 ZINC000925877119 646527914 /nfs/dbraw/zinc/52/79/14/646527914.db2.gz LTOWLMFGTGQADF-AXFHLTTASA-N 2 0 208.305 2.058 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[NH2+][C@H]2CCCc3occc32)C1 ZINC000925882471 646530803 /nfs/dbraw/zinc/53/08/03/646530803.db2.gz MVRXVAYXZOGRGO-LOWVWBTDSA-N 2 0 234.343 2.374 20 0 BEADRP C1=CCCC(C[NH2+]C2CC[NH2+]CC2)CC1 ZINC000925882104 646530942 /nfs/dbraw/zinc/53/09/42/646530942.db2.gz WSSSZNNQSIUKRO-UHFFFAOYSA-N 2 0 208.349 2.074 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[NH2+][C@@H]2CCC[C@@H]2CCF)C1 ZINC000925881149 646531348 /nfs/dbraw/zinc/53/13/48/646531348.db2.gz YECFMCUCLLOXDM-UMSGYPCISA-N 2 0 228.355 2.232 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[NH2+][C@H]2CC[C@@H]2C2CCC2)C1 ZINC000925880610 646531414 /nfs/dbraw/zinc/53/14/14/646531414.db2.gz UONFVHAPIMJPRV-ASEORRQLSA-N 2 0 222.376 2.282 20 0 BEADRP CCc1cccnc1[C@@H](C)[NH2+]C[C@@H]1CC[C@H]([NH3+])C1 ZINC000925883758 646532420 /nfs/dbraw/zinc/53/24/20/646532420.db2.gz XGKMSFKJQNFMPH-BZPMIXESSA-N 2 0 247.386 2.422 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C1([C@H]2CCCCO2)CC1 ZINC000925893919 646534586 /nfs/dbraw/zinc/53/45/86/646534586.db2.gz SFYFNOJYZGQAIJ-CHWSQXEVSA-N 2 0 240.391 2.195 20 0 BEADRP c1nc2c([nH]1)C[C@@H]([NH2+][C@H]1CC3CCC1CC3)CC2 ZINC000926451080 646642110 /nfs/dbraw/zinc/64/21/10/646642110.db2.gz VUODOMIYDIWTNI-BUCSNLDVSA-N 2 0 245.370 2.435 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCc2nc[nH]c2C1)c1ccns1 ZINC000926451160 646642507 /nfs/dbraw/zinc/64/25/07/646642507.db2.gz WPBOFRKQLDPJQW-DTWKUNHWSA-N 2 0 248.355 2.074 20 0 BEADRP CC[C@H]([NH2+][C@@H](C)CCCC[NH3+])[C@H]1CCCOC1 ZINC000724008805 711555111 /nfs/dbraw/zinc/55/51/11/711555111.db2.gz MKPRTJDYRLBESJ-IHRRRGAJSA-N 2 0 242.407 2.299 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]CCC2CC=CC2)C1 ZINC000724201121 711569031 /nfs/dbraw/zinc/56/90/31/711569031.db2.gz STROWWKLOHOURW-OLZOCXBDSA-N 2 0 208.349 2.202 20 0 BEADRP C[NH2+]C[C@@H]1CCC[N@H+](CCCC(C)(F)F)C1 ZINC000718570221 711661294 /nfs/dbraw/zinc/66/12/94/711661294.db2.gz JCHYXXJKYSYPRX-NSHDSACASA-N 2 0 234.334 2.353 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+][C@H]1CC[NH2+]CC1(C)C ZINC000387667645 711764734 /nfs/dbraw/zinc/76/47/34/711764734.db2.gz JAJKJHMPTAPNNZ-WOPDTQHZSA-N 2 0 210.365 2.010 20 0 BEADRP C[NH+]1CCC(C[NH2+]C[C@H]2CCC(F)(F)C2)CC1 ZINC000390711346 711791640 /nfs/dbraw/zinc/79/16/40/711791640.db2.gz XLBYDIPDHUAFPV-LBPRGKRZSA-N 2 0 246.345 2.353 20 0 BEADRP Cc1cccc(C[NH2+]CC[C@H](C)[NH+](C)C)c1 ZINC000700606248 711849146 /nfs/dbraw/zinc/84/91/46/711849146.db2.gz WLALGECNHIPUHO-ZDUSSCGKSA-N 2 0 220.360 2.425 20 0 BEADRP CCCCC[C@H](C)[NH2+]C[C@@]1(COC)CCC[NH2+]1 ZINC000701282062 711858043 /nfs/dbraw/zinc/85/80/43/711858043.db2.gz BYRYDNFQTHFDFL-UONOGXRCSA-N 2 0 242.407 2.313 20 0 BEADRP C[C@]12C[NH2+]C[C@H]1C[N@H+](CCCC1CCC1)C2 ZINC000702128204 712039640 /nfs/dbraw/zinc/03/96/40/712039640.db2.gz UGXQYZPDMFKUTE-UONOGXRCSA-N 2 0 222.376 2.108 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@H](C)C1(Cl)CC1 ZINC000702361963 712048335 /nfs/dbraw/zinc/04/83/35/712048335.db2.gz VWJPXGZKYWXBCE-LLVKDONJSA-N 2 0 232.799 2.466 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[N@@H+]2CCCC3(CC3)CC2)C1 ZINC000702524651 712054181 /nfs/dbraw/zinc/05/41/81/712054181.db2.gz HPPBEXDFAIENMR-QWHCGFSZSA-N 2 0 222.376 2.380 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCSC1)[C@@H]1CCC[NH2+]C1 ZINC000704810569 712118570 /nfs/dbraw/zinc/11/85/70/712118570.db2.gz BVJYLNBTCSCION-RWMBFGLXSA-N 2 0 242.432 2.107 20 0 BEADRP C[C@@H]1CC[C@@H](C)[NH+]1C[C@H]1CCCC[NH2+]C1 ZINC000706428794 712145853 /nfs/dbraw/zinc/14/58/53/712145853.db2.gz AQLYKZISHOXWTA-UPJWGTAASA-N 2 0 210.365 2.249 20 0 BEADRP CC1(C)CO[C@H](C[N@@H+]2CCCC[C@H]2CC[NH3+])C1 ZINC000708326005 712186929 /nfs/dbraw/zinc/18/69/29/712186929.db2.gz ZBTPOEPRXBBSNA-STQMWFEESA-N 2 0 240.391 2.005 20 0 BEADRP CC(C)[C@H]([NH3+])CC[N@H+](C)C[C@H]1CC(C)(C)CO1 ZINC000708334748 712188393 /nfs/dbraw/zinc/18/83/93/712188393.db2.gz AHFNBHAANXHZAI-CHWSQXEVSA-N 2 0 242.407 2.107 20 0 BEADRP CC(C)(C)[C@H]1CCC[N@H+](C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000708442343 712194732 /nfs/dbraw/zinc/19/47/32/712194732.db2.gz OXNRMGJIBVHLLR-RWMBFGLXSA-N 2 0 224.392 2.482 20 0 BEADRP C[N@H+](C[C@@H]1CC(C)(C)OC1(C)C)C1CC([NH3+])C1 ZINC000709702365 712216074 /nfs/dbraw/zinc/21/60/74/712216074.db2.gz MZSVBXPEYHYKGS-UNXYVOJBSA-N 2 0 240.391 2.002 20 0 BEADRP C[C@@H]1[C@H]2CC[C@@H](C[C@@H]1[NH2+][C@@H]1CCC1(C)C)[NH2+]2 ZINC000709433558 712221678 /nfs/dbraw/zinc/22/16/78/712221678.db2.gz HEMYZISDQRNYFC-RXGFPQBGSA-N 2 0 222.376 2.294 20 0 BEADRP Cc1cncc(C[N@H+](C)CCCCCC[NH3+])c1 ZINC000710706703 712254815 /nfs/dbraw/zinc/25/48/15/712254815.db2.gz XJDALMAEWPYMJN-UHFFFAOYSA-N 2 0 235.375 2.341 20 0 BEADRP FC[C@H]1CCC[N@H+](C[C@H]2CCCC[NH2+]C2)C1 ZINC000711440734 712301003 /nfs/dbraw/zinc/30/10/03/712301003.db2.gz FCTQBAYWJPTYNG-OLZOCXBDSA-N 2 0 228.355 2.058 20 0 BEADRP C[C@H]1CC[N@H+](C[C@]2(C)CCC[NH2+]C2)CCS1 ZINC000379545347 712387842 /nfs/dbraw/zinc/38/78/42/712387842.db2.gz YOWUKECNSUZYDY-QWHCGFSZSA-N 2 0 242.432 2.204 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1C[C@@H]2CCCC[C@H]12 ZINC000712378708 712428679 /nfs/dbraw/zinc/42/86/79/712428679.db2.gz RHUPXNVQXLIWRY-HTVCTNPSSA-N 2 0 222.376 2.282 20 0 BEADRP C=C/C=C/CC[N@H+]1CCC[C@@H](C[NH2+]C)C1 ZINC000713737164 712470647 /nfs/dbraw/zinc/47/06/47/712470647.db2.gz ZSNTWEOBNXZUKP-IHVVCDCBSA-N 2 0 208.349 2.050 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]CC[C@@H]2CCCS2)C12CCC2 ZINC000715659321 712529769 /nfs/dbraw/zinc/52/97/69/712529769.db2.gz NXFRDKYZUUKENN-TUAOUCFPSA-N 2 0 240.416 2.132 20 0 BEADRP CCC[C@H](C[NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1)OC ZINC000715532487 712526282 /nfs/dbraw/zinc/52/62/82/712526282.db2.gz MLNDFDKCAGEFDD-BFHYXJOUSA-N 2 0 242.407 2.264 20 0 BEADRP CC1(C)CC[C@@H]([NH2+]C[C@@H]2C[NH2+]CCC2(F)F)C1 ZINC000717317981 712646530 /nfs/dbraw/zinc/64/65/30/712646530.db2.gz UHNUJEAHBRWBCP-WDEREUQCSA-N 2 0 246.345 2.400 20 0 BEADRP C[C@H](CCC1CC1)[NH2+]C[C@H]1C[NH2+]CCC1(F)F ZINC000717348734 712650028 /nfs/dbraw/zinc/65/00/28/712650028.db2.gz JPOSAUOUTYKQNB-ZYHUDNBSSA-N 2 0 246.345 2.400 20 0 BEADRP CC(C)C[C@@H](C)[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000037485327 712650919 /nfs/dbraw/zinc/65/09/19/712650919.db2.gz LVIOGPRFNAMSPW-OLZOCXBDSA-N 2 0 224.392 2.495 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)C(C)C ZINC000037485281 712650962 /nfs/dbraw/zinc/65/09/62/712650962.db2.gz PMMGYGRRPBRKBX-JSGCOSHPSA-N 2 0 224.392 2.495 20 0 BEADRP C1=CCCC([NH2+]CC2CC[NH2+]CC2)CC1 ZINC000718068996 712740524 /nfs/dbraw/zinc/74/05/24/712740524.db2.gz YAPMTHKUONVXMX-UHFFFAOYSA-N 2 0 208.349 2.074 20 0 BEADRP CC(F)(F)CCC[NH+]1CCC(C[NH3+])CC1 ZINC000718572042 712775134 /nfs/dbraw/zinc/77/51/34/712775134.db2.gz QUKMLVFDERSXBT-UHFFFAOYSA-N 2 0 220.307 2.093 20 0 BEADRP CO[C@H]1CCC[C@H]([NH2+]CCCC[NH+](C)C)CC1 ZINC000718843270 712786078 /nfs/dbraw/zinc/78/60/78/712786078.db2.gz PXZZQQWTOFXKCS-KBPBESRZSA-N 2 0 242.407 2.266 20 0 BEADRP [NH3+]CCCCCC[NH2+]Cc1ncc(Cl)s1 ZINC000719410886 712807341 /nfs/dbraw/zinc/80/73/41/712807341.db2.gz XJZNZAIQKWCLTB-UHFFFAOYSA-N 2 0 247.795 2.405 20 0 BEADRP C[NH+](C)CCC[N@H+](C)CCc1ccc(F)cc1 ZINC000265243570 1166425267 /nfs/dbraw/zinc/42/52/67/1166425267.db2.gz LYEHALDDZWWFAY-UHFFFAOYSA-N 2 0 238.350 2.252 20 0 BEADRP CCO[C@@H]1CCC[C@H]([NH2+]CC[C@@H](C)[NH+](C)C)C1 ZINC000721238857 712900053 /nfs/dbraw/zinc/90/00/53/712900053.db2.gz LPLHYJAVYKNRPS-HZSPNIEDSA-N 2 0 242.407 2.264 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CC[C@@H]2C[NH2+]C[C@H]2C)C1 ZINC000722506944 710713657 /nfs/dbraw/zinc/71/36/57/710713657.db2.gz BKHOEIDBRBZLAU-LPWJVIDDSA-N 2 0 210.365 2.010 20 0 BEADRP CC[C@H]([NH2+][C@@H](C)CC[NH+](C)C)[C@@H]1CCCOC1 ZINC000723957651 710734456 /nfs/dbraw/zinc/73/44/56/710734456.db2.gz DNRKOYKPJHREGM-MJBXVCDLSA-N 2 0 242.407 2.121 20 0 BEADRP CC/C=C\C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000384830622 710998890 /nfs/dbraw/zinc/99/88/90/710998890.db2.gz GTVIBDOPYJZRDY-XQENQYBNSA-N 2 0 208.349 2.167 20 0 BEADRP CC[C@@H]1[C@@H](C)CC[N@@H+]1C[C@]1(C)CCC[NH2+]C1 ZINC000383994982 710988218 /nfs/dbraw/zinc/98/82/18/710988218.db2.gz AATPGSLGIGAVAH-BFHYXJOUSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CCC[C@H](C[NH2+][C@@H]2[C@H]3C[C@H]4C[NH2+][C@H]2[C@H]4C3)C1 ZINC000385545747 711014527 /nfs/dbraw/zinc/01/45/27/711014527.db2.gz VPEIMWPIDQVPMU-TYSGWJLXSA-N 2 0 248.414 2.399 20 0 BEADRP CC1CCC(C[NH2+][C@@H]2[C@H]3C[C@H]4C[NH2+][C@H]2[C@H]4C3)CC1 ZINC000385514714 711015401 /nfs/dbraw/zinc/01/54/01/711015401.db2.gz NXSGCMTXMTUIAX-OTSVQJDGSA-N 2 0 248.414 2.399 20 0 BEADRP [NH3+][C@H](CC(F)F)C[N@@H+]1CC[C@@H]2CCCC[C@@H]21 ZINC000380747780 712902747 /nfs/dbraw/zinc/90/27/47/712902747.db2.gz SZKMGAHVRQWZDP-AXFHLTTASA-N 2 0 232.318 2.233 20 0 BEADRP CCc1ccc(CN2C[C@H]([NH3+])C(C)(C)C2)cc1 ZINC000388025980 711050207 /nfs/dbraw/zinc/05/02/07/711050207.db2.gz CFPQRXZHGXNRTG-AWEZNQCLSA-N 2 0 232.371 2.418 20 0 BEADRP CCCN(CC)C[C@H](C)[NH2+][C@H]1CC[C@@H]1C ZINC000389869001 711093453 /nfs/dbraw/zinc/09/34/53/711093453.db2.gz IIDFIMMUBBCNDG-AVGNSLFASA-N 2 0 212.381 2.495 20 0 BEADRP CCCN(CC)C[C@H](C)[NH2+][C@@H]1CC[C@@H]1C ZINC000389869003 711094263 /nfs/dbraw/zinc/09/42/63/711094263.db2.gz IIDFIMMUBBCNDG-RWMBFGLXSA-N 2 0 212.381 2.495 20 0 BEADRP C[C@@H]1C[N@H+](CCCC(C)(F)F)CC[C@H]1[NH3+] ZINC000390067677 711104662 /nfs/dbraw/zinc/10/46/62/711104662.db2.gz DIHZGKAVIFLIAG-NXEZZACHSA-N 2 0 220.307 2.091 20 0 BEADRP CC(F)(F)CCC[NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23 ZINC000390106192 711105935 /nfs/dbraw/zinc/10/59/35/711105935.db2.gz SUYXYXWFVZLEGI-RNWYCLNJSA-N 2 0 244.329 2.008 20 0 BEADRP CC(F)(F)CCC[NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32 ZINC000390106189 711106592 /nfs/dbraw/zinc/10/65/92/711106592.db2.gz SUYXYXWFVZLEGI-KKJSVHSVSA-N 2 0 244.329 2.008 20 0 BEADRP C[NH+](C)CCCC[NH2+]C[C@H]1CC1(Cl)Cl ZINC000390302258 711111199 /nfs/dbraw/zinc/11/11/99/711111199.db2.gz AKQWLZMATXWIAB-SECBINFHSA-N 2 0 239.190 2.112 20 0 BEADRP C([NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23)C1(C2CC2)CCC1 ZINC000391420728 711138776 /nfs/dbraw/zinc/13/87/76/711138776.db2.gz DBSRRJZQBTWQAE-WPTOEGHWSA-N 2 0 246.398 2.153 20 0 BEADRP C[C@H](C[NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32)C(C)(C)C ZINC000392940023 711155276 /nfs/dbraw/zinc/15/52/76/711155276.db2.gz ZVXFSTBTWMBYRK-BBMNEWJDSA-N 2 0 236.403 2.255 20 0 BEADRP C1[NH2+][C@@H]2[C@H]([NH2+]C3CCCCCC3)[C@H]3C[C@@H]1[C@@H]2C3 ZINC000392980156 711155319 /nfs/dbraw/zinc/15/53/19/711155319.db2.gz ZRDJTCPUMGSHSK-RCZQDCHWSA-N 2 0 234.387 2.295 20 0 BEADRP C[NH2+]C[C@H]1CCC[N@H+](CCCC2CC2)C1 ZINC000394481656 711192481 /nfs/dbraw/zinc/19/24/81/711192481.db2.gz DVLCNDLIHKUDQG-CYBMUJFWSA-N 2 0 210.365 2.108 20 0 BEADRP CC[C@@H]1C[C@@H](C)C[N@@H+]1C[C@H]([NH3+])CC(F)F ZINC000399143543 711421871 /nfs/dbraw/zinc/42/18/71/711421871.db2.gz CNVXJPQJMMCOLJ-OPRDCNLKSA-N 2 0 220.307 2.089 20 0 BEADRP C[C@@H]([NH2+]C/C=C/Cl)C1CC[NH+](C)CC1 ZINC000396500010 711222693 /nfs/dbraw/zinc/22/26/93/711222693.db2.gz VFNUJBQLXIAZJM-QLCVYAKKSA-N 2 0 216.756 2.059 20 0 BEADRP Cc1cccc(OCCN[C@@H]2CCC[NH2+][C@@H]2C)c1 ZINC000396693474 711364322 /nfs/dbraw/zinc/36/43/22/711364322.db2.gz LUNHBWMRLBKOIG-UKRRQHHQSA-N 2 0 248.370 2.104 20 0 BEADRP CC(C)(C)SCC[NH2+][C@@H]1CCC[C@H]1C[NH3+] ZINC000397464891 711382134 /nfs/dbraw/zinc/38/21/34/711382134.db2.gz SOXAYDYSDRGWOW-WDEREUQCSA-N 2 0 230.421 2.235 20 0 BEADRP CC(C)(C)SCC[NH2+][C@@H]1CCC[C@@H]1C[NH3+] ZINC000397464886 711383225 /nfs/dbraw/zinc/38/32/25/711383225.db2.gz SOXAYDYSDRGWOW-GHMZBOCLSA-N 2 0 230.421 2.235 20 0 BEADRP CC(C)(C)SCC[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000397432828 711383233 /nfs/dbraw/zinc/38/32/33/711383233.db2.gz FPPMSLJBLKJHMS-MNOVXSKESA-N 2 0 230.421 2.378 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1CC[NH2+]CCC12CCC2 ZINC000723105596 711503250 /nfs/dbraw/zinc/50/32/50/711503250.db2.gz FOZJTOYLAOWCMO-OLZOCXBDSA-N 2 0 222.376 2.251 20 0 BEADRP CO[C@@H](C[N@@H+]1CCC[C@H](C[NH3+])C1)c1ccccc1 ZINC000382366503 711503349 /nfs/dbraw/zinc/50/33/49/711503349.db2.gz XZADMMOQHNPRKP-HIFRSBDPSA-N 2 0 248.370 2.045 20 0 BEADRP Cc1cccc(C[N@@H+]2CC[C@@H](CC[NH3+])C2)c1C ZINC000723670467 711532995 /nfs/dbraw/zinc/53/29/95/711532995.db2.gz SNMFTLVJICEKDX-CQSZACIVSA-N 2 0 232.371 2.474 20 0 BEADRP COCc1cccc(C[N@@H+]2CC[C@H](CC[NH3+])C2)c1 ZINC000723690526 711533860 /nfs/dbraw/zinc/53/38/60/711533860.db2.gz QVSBAXMNTQOUDZ-ZDUSSCGKSA-N 2 0 248.370 2.004 20 0 BEADRP [NH3+]CC[C@@H]1CC[N@H+](C/C=C\c2ccccc2)C1 ZINC000723713935 711535532 /nfs/dbraw/zinc/53/55/32/711535532.db2.gz XSYUVDCQQFZHEX-IJVDHGTGSA-N 2 0 230.355 2.371 20 0 BEADRP CCC(CC)C[N@@H+]1C[C@@H](C)[C@H](CC[NH3+])C1 ZINC000723902693 711544903 /nfs/dbraw/zinc/54/49/03/711544903.db2.gz YQOMVMRLDGLYPN-DGCLKSJQSA-N 2 0 212.381 2.339 20 0 BEADRP CC(C)CCC[N@@H+]1C[C@@H](C)[C@H](CC[NH3+])C1 ZINC000723902417 711544930 /nfs/dbraw/zinc/54/49/30/711544930.db2.gz XQCBAUOTMHZQTN-CHWSQXEVSA-N 2 0 212.381 2.339 20 0 BEADRP Cc1cccc(C[N@H+]2C[C@@H](C)[C@H](CC[NH3+])C2)c1 ZINC000723908860 711545173 /nfs/dbraw/zinc/54/51/73/711545173.db2.gz LBMDHYYFDLQOQJ-UKRRQHHQSA-N 2 0 232.371 2.412 20 0 BEADRP CO[C@@H]1CC[C@@H]1[N@H+](C)CCCCCCC[NH3+] ZINC000724205275 711569360 /nfs/dbraw/zinc/56/93/60/711569360.db2.gz ADUPICYPVHOILN-QWHCGFSZSA-N 2 0 228.380 2.005 20 0 BEADRP C[NH+](C)CCC[NH2+][C@@H]1CCO[C@H](C(C)(C)C)C1 ZINC000721552890 711624368 /nfs/dbraw/zinc/62/43/68/711624368.db2.gz VYXHAURLQKKUSK-OLZOCXBDSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC2CCC1CC2)C[NH+](C)C ZINC000382229753 711643448 /nfs/dbraw/zinc/64/34/48/711643448.db2.gz GTHQVJKOIQDLBG-BLYZHGLHSA-N 2 0 224.392 2.352 20 0 BEADRP CC(C)[C@H]1CC[N@H+](CC[C@H]2CCC[NH2+]C2)C1 ZINC000252868839 711651139 /nfs/dbraw/zinc/65/11/39/711651139.db2.gz RRBARWFKRLEQNM-KGLIPLIRSA-N 2 0 224.392 2.354 20 0 BEADRP CC(C)(C)CC[N@@H+]1CC[C@]2(CCC[NH2+]2)C1 ZINC000335265168 711721700 /nfs/dbraw/zinc/72/17/00/711721700.db2.gz GEPPBOMLESHETG-CYBMUJFWSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@@H](c1ccncc1)[N@@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000257662241 711724976 /nfs/dbraw/zinc/72/49/76/711724976.db2.gz CCFJQVFDZZJLNH-ZDUSSCGKSA-N 2 0 245.370 2.218 20 0 BEADRP CC(C)([NH2+]C[C@@H]1CC[C@H]([NH3+])C1)c1nccs1 ZINC000232564759 711760794 /nfs/dbraw/zinc/76/07/94/711760794.db2.gz OISDCLMDGVEZIK-ZJUUUORDSA-N 2 0 239.388 2.095 20 0 BEADRP Cc1nc([C@@H](C)[NH2+]C[C@@H]2CC[C@H]([NH3+])C2)cs1 ZINC000925879941 711761876 /nfs/dbraw/zinc/76/18/76/711761876.db2.gz MSCFIAXCTLASLV-IEBDPFPHSA-N 2 0 239.388 2.230 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]C2CC(SC)C2)[C@@H](C)C1 ZINC000925170340 711786483 /nfs/dbraw/zinc/78/64/83/711786483.db2.gz MPAZCTVLTBBWCJ-WTIISPKJSA-N 2 0 242.432 2.200 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000530216025 711937798 /nfs/dbraw/zinc/93/77/98/711937798.db2.gz LYDPGWVAMMGFGG-AVGNSLFASA-N 2 0 222.376 2.295 20 0 BEADRP CSC[C@@H]1CCC[N@@H+]1C[C@H]1CCCC[NH2+]C1 ZINC000700271378 711988803 /nfs/dbraw/zinc/98/88/03/711988803.db2.gz AVROYTOTEGKLJQ-STQMWFEESA-N 2 0 242.432 2.204 20 0 BEADRP FC1CC[NH+](Cc2cccc3c2CC[NH2+]C3)CC1 ZINC000701885218 712031820 /nfs/dbraw/zinc/03/18/20/712031820.db2.gz VXJFPPMJNGBZRU-UHFFFAOYSA-N 2 0 248.345 2.266 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C[C@]2(C)CC2(C)C)CC[N@@H+]1C ZINC000701980776 712034383 /nfs/dbraw/zinc/03/43/83/712034383.db2.gz JZWZZYPDMXUBJA-DYEKYZERSA-N 2 0 224.392 2.495 20 0 BEADRP CC1(C)C[C@]1(C)C[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000701986310 712034948 /nfs/dbraw/zinc/03/49/48/712034948.db2.gz NWLFNIWKRXJCNJ-NTZNESFSSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)[C@H]1CCCC[N@@H+]1C[C@H]1C[C@@H]([NH3+])C1 ZINC000703487090 712076821 /nfs/dbraw/zinc/07/68/21/712076821.db2.gz JHDNJNWIOFSCOQ-FRRDWIJNSA-N 2 0 210.365 2.234 20 0 BEADRP Cc1ccc(C[N@@H+]2C[C@@H]3C[NH2+]C[C@]3(C)C2)s1 ZINC000703538438 712077853 /nfs/dbraw/zinc/07/78/53/712077853.db2.gz JWCVWNIRVQHWNI-WCQYABFASA-N 2 0 236.384 2.098 20 0 BEADRP Cc1cccc(C[N@@H+]2C[C@@H]3C[NH2+]C[C@]3(C)C2)c1 ZINC000703548590 712078849 /nfs/dbraw/zinc/07/88/49/712078849.db2.gz AHSJPWCKPVBOBZ-LSDHHAIUSA-N 2 0 230.355 2.036 20 0 BEADRP CC1(C)CCC[N@@H+]1CC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000703796753 712087447 /nfs/dbraw/zinc/08/74/47/712087447.db2.gz KQWOLCLOCISIJA-YHWZYXNKSA-N 2 0 222.376 2.391 20 0 BEADRP C[C@H]1CCCC[N@H+](C[C@]2(C)CCC[NH2+]C2)C1 ZINC000705575810 712133452 /nfs/dbraw/zinc/13/34/52/712133452.db2.gz DXSJJZKYPKTLQJ-UONOGXRCSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@H]1CCCC[N@H+](C[C@@]2(C)CCC[NH2+]C2)C1 ZINC000705575804 712133477 /nfs/dbraw/zinc/13/34/77/712133477.db2.gz DXSJJZKYPKTLQJ-KBPBESRZSA-N 2 0 224.392 2.498 20 0 BEADRP C([NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23)[C@H]1CCCC12CC2 ZINC000706262960 712142949 /nfs/dbraw/zinc/14/29/49/712142949.db2.gz ITIZEWDWAICLRD-MZHQWRCYSA-N 2 0 246.398 2.153 20 0 BEADRP CC[N@H+](C[C@@H]1C[NH2+]C[C@H]1C)[C@H](C)C(C)C ZINC000706480997 712147393 /nfs/dbraw/zinc/14/73/93/712147393.db2.gz NVXUFOSJNOKPMN-UPJWGTAASA-N 2 0 212.381 2.208 20 0 BEADRP C([NH2+][C@H]1CCCC12CC2)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000706995021 712164283 /nfs/dbraw/zinc/16/42/83/712164283.db2.gz BUJGCCJDMJJIGP-GSPSYOTPSA-N 2 0 234.387 2.439 20 0 BEADRP CCC[C@@H]1C[N@H+](CCCCCC[NH3+])CCO1 ZINC000708921876 712203454 /nfs/dbraw/zinc/20/34/54/712203454.db2.gz HNJGAYJXDVKMET-CYBMUJFWSA-N 2 0 228.380 2.006 20 0 BEADRP CC1(C)C[C@@H](C[NH2+]CC2([NH3+])CCC2)C(C)(C)O1 ZINC000709756501 712217618 /nfs/dbraw/zinc/21/76/18/712217618.db2.gz USXYNIRTADBWGN-NSHDSACASA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H]1[C@H]2CC[C@@H](C[C@H]1[NH2+][C@H]1CCCSC1)[NH2+]2 ZINC000709284553 712218974 /nfs/dbraw/zinc/21/89/74/712218974.db2.gz NQPFJNVLCNOAQH-KSSYENDESA-N 2 0 240.416 2.001 20 0 BEADRP C[C@@H]1[C@H]2CC[C@@H](C[C@@H]1[NH2+][C@H]1CC=CCC1)[NH2+]2 ZINC000709436638 712222120 /nfs/dbraw/zinc/22/21/20/712222120.db2.gz MEXTWBRWVZWUTQ-HTOAHKCRSA-N 2 0 220.360 2.214 20 0 BEADRP C[C@]1(C(F)(F)F)CCN(CC23CC(C2)C[NH2+]3)C1 ZINC000709637722 712226253 /nfs/dbraw/zinc/22/62/53/712226253.db2.gz KPXYEPNVADPXIF-YVNMAJEFSA-N 2 0 248.292 2.013 20 0 BEADRP [NH3+][C@H]1C[C@H]2C[C@@H](C1)[N@H+](CCC1CCCC1)C2 ZINC000709824925 712228835 /nfs/dbraw/zinc/22/88/35/712228835.db2.gz GWDOSLWLFZKUML-IHRRRGAJSA-N 2 0 222.376 2.378 20 0 BEADRP [NH3+][C@@H]1C[C@H]2C[C@@H](C1)[N@H+](CCCc1ccccc1)C2 ZINC000709842179 712229281 /nfs/dbraw/zinc/22/92/81/712229281.db2.gz KMIKMPRUHUCJQS-XHSDSOJGSA-N 2 0 244.382 2.431 20 0 BEADRP [NH3+][C@H]1C[C@H]2C[C@@H](C1)[N@H+](C[C@@H]1CCC(F)(F)C1)C2 ZINC000709843664 712229347 /nfs/dbraw/zinc/22/93/47/712229347.db2.gz NKROAILBWKIFON-RHYQMDGZSA-N 2 0 244.329 2.233 20 0 BEADRP [NH3+][C@@H]1C[C@H]2C[C@@H](C1)[N@H+](C[C@H]1CCC(F)(F)C1)C2 ZINC000709843669 712229486 /nfs/dbraw/zinc/22/94/86/712229486.db2.gz NKROAILBWKIFON-YFKTTZPYSA-N 2 0 244.329 2.233 20 0 BEADRP C[N@H+](CCCCCC[NH3+])CC[C@H]1CCCCO1 ZINC000710800739 712257466 /nfs/dbraw/zinc/25/74/66/712257466.db2.gz XUBXIKAWYKFHOI-CQSZACIVSA-N 2 0 242.407 2.397 20 0 BEADRP FC[C@@H]1CCC[N@H+](CCC2CC[NH2+]CC2)C1 ZINC000711442780 712300547 /nfs/dbraw/zinc/30/05/47/712300547.db2.gz JNHYNIUMURYHCL-ZDUSSCGKSA-N 2 0 228.355 2.058 20 0 BEADRP FC[C@H]1CCC[N@H+](CC[C@H]2CCC[NH2+]C2)C1 ZINC000711444804 712300903 /nfs/dbraw/zinc/30/09/03/712300903.db2.gz RBAGMAGMPGNHIT-CHWSQXEVSA-N 2 0 228.355 2.058 20 0 BEADRP FC[C@@H]1CCC[N@H+](C[C@@H]2CCCC[NH2+]C2)C1 ZINC000711440735 712300926 /nfs/dbraw/zinc/30/09/26/712300926.db2.gz FCTQBAYWJPTYNG-QWHCGFSZSA-N 2 0 228.355 2.058 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]C[C@@H]1C=CCC1 ZINC000711670434 712315679 /nfs/dbraw/zinc/31/56/79/712315679.db2.gz VGTOVEJDAHSAHF-FRRDWIJNSA-N 2 0 208.349 2.060 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]C[C@@H]2C=CCC2)CC1 ZINC000711733348 712320999 /nfs/dbraw/zinc/32/09/99/712320999.db2.gz VDZSFORXUDZJAB-CYBMUJFWSA-N 2 0 222.376 2.415 20 0 BEADRP CC1(C)CCC[C@@H]1C[NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23 ZINC000388705657 712389730 /nfs/dbraw/zinc/38/97/30/712389730.db2.gz LKYAGSQPTOILSM-MZHQWRCYSA-N 2 0 248.414 2.399 20 0 BEADRP CC1(C)CCC[C@@H]1C[NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2 ZINC000388705659 712389993 /nfs/dbraw/zinc/38/99/93/712389993.db2.gz LKYAGSQPTOILSM-UJOWSUJOSA-N 2 0 248.414 2.399 20 0 BEADRP CC[N@@H+]1CC[C@@H]1CNc1cc[nH+]c2ccccc12 ZINC000712594796 712436345 /nfs/dbraw/zinc/43/63/45/712436345.db2.gz MIXQZSRHFHXZSW-GFCCVEGCSA-N 2 0 241.338 2.163 20 0 BEADRP CC1(C)[C@H]([NH3+])C[C@@H]1[NH2+]CC[C@@H]1C[C@H]1C1CC1 ZINC000712675861 712440665 /nfs/dbraw/zinc/44/06/65/712440665.db2.gz RLGCJWRPCFXLEV-XQHKEYJVSA-N 2 0 222.376 2.138 20 0 BEADRP CC1(C)CC[NH2+]CCN1CCOc1ccccc1 ZINC000712560330 712446006 /nfs/dbraw/zinc/44/60/06/712446006.db2.gz AWKYGLHPPIBVLC-UHFFFAOYSA-N 2 0 248.370 2.139 20 0 BEADRP C(C[N@@H+]1CC[NH2+]CCC12CCC2)C1CCC1 ZINC000713265336 712457245 /nfs/dbraw/zinc/45/72/45/712457245.db2.gz YNUAVGPZXYLIKM-UHFFFAOYSA-N 2 0 222.376 2.395 20 0 BEADRP C=C/C=C/CC[NH2+][C@@H]1CC[NH2+]CC1(C)C ZINC000713464405 712460620 /nfs/dbraw/zinc/46/06/20/712460620.db2.gz JSGYHVNZIVNYSQ-BTDICHCPSA-N 2 0 208.349 2.096 20 0 BEADRP CC1(C)CCC[C@H](C[N@@H+]2CC[C@@H](CC[NH3+])C2)O1 ZINC000714339378 712482679 /nfs/dbraw/zinc/48/26/79/712482679.db2.gz SHVLJHFDPXOIEG-CHWSQXEVSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@@H]1C[N@H+](C[C@@H]2CCCC(C)(C)O2)CC[C@H]1[NH3+] ZINC000714368282 712483799 /nfs/dbraw/zinc/48/37/99/712483799.db2.gz LXBMOZOZVGYZEX-FRRDWIJNSA-N 2 0 240.391 2.003 20 0 BEADRP CC1(C)CCC[C@H](C[NH+]2CCC(C[NH3+])CC2)O1 ZINC000714376180 712485297 /nfs/dbraw/zinc/48/52/97/712485297.db2.gz XSEGAKCDQCTQPX-CYBMUJFWSA-N 2 0 240.391 2.005 20 0 BEADRP CC(C)[C@H](C)[N@H+](C)CCCCCC[NH3+] ZINC000036787574 712495418 /nfs/dbraw/zinc/49/54/18/712495418.db2.gz KANUUVKIWHKYSK-LBPRGKRZSA-N 2 0 200.370 2.482 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](CC[C@@H]3C[C@H]3C3CC3)C[C@H]21 ZINC000714856066 712502047 /nfs/dbraw/zinc/50/20/47/712502047.db2.gz ARNQLCQEWQEYMJ-IBEHDNSVSA-N 2 0 248.414 2.482 20 0 BEADRP CSC1CC([NH2+][C@@H]2CCC[C@H]([NH+](C)C)C2)C1 ZINC000715545640 712527303 /nfs/dbraw/zinc/52/73/03/712527303.db2.gz ZSKPAEYAKUIIOJ-IGJPJIBNSA-N 2 0 242.432 2.343 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]CC[C@@H]1CCCS1 ZINC000715600097 712527726 /nfs/dbraw/zinc/52/77/26/712527726.db2.gz ICKMLSBPIRKXSS-RWMBFGLXSA-N 2 0 242.432 2.379 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CC[C@@H]2CCCS2)CC[N@@H+]1C ZINC000715603375 712527855 /nfs/dbraw/zinc/52/78/55/712527855.db2.gz PZIIYVAFCABIHT-AGIUHOORSA-N 2 0 242.432 2.344 20 0 BEADRP CC[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@H]([NH+](C)C)C2)CO1 ZINC000715560757 712528710 /nfs/dbraw/zinc/52/87/10/712528710.db2.gz DSWDTWUOPPHTQA-XDQVBPFNSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C2CCC(C)([NH+](C)C)CC2)CO1 ZINC000715569347 712529471 /nfs/dbraw/zinc/52/94/71/712529471.db2.gz APVRRMDCMLLDDL-NELGMTEASA-N 2 0 240.391 2.016 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCCS1)[C@H]1CCC[NH2+]1 ZINC000715656538 712529801 /nfs/dbraw/zinc/52/98/01/712529801.db2.gz HNSOZSVWJBYUHH-QJPTWQEYSA-N 2 0 228.405 2.002 20 0 BEADRP C(CCC1CC1)C[NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2 ZINC000716340229 712555576 /nfs/dbraw/zinc/55/55/76/712555576.db2.gz CUMWHIKFYYHHGQ-LXFSFDBISA-N 2 0 234.387 2.153 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@@H]2C[C@@H]2[C@H]2C[C@@H]2C)CC1 ZINC000716584501 712564182 /nfs/dbraw/zinc/56/41/82/712564182.db2.gz PPJSCKJWIBAUSO-JURCDPSOSA-N 2 0 236.403 2.352 20 0 BEADRP C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000716639560 712568354 /nfs/dbraw/zinc/56/83/54/712568354.db2.gz VZPXEEGEBCECHF-VJQRDGCPSA-N 2 0 248.414 2.495 20 0 BEADRP C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C[NH2+][C@@H]1C[C@H]([NH3+])C12CCC2 ZINC000716668935 712568971 /nfs/dbraw/zinc/56/89/71/712568971.db2.gz SZVBGRLPSHOWDF-IKKURHKOSA-N 2 0 234.387 2.138 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+]C[C@@H]1C[NH2+]CCC1(F)F ZINC000717047335 712625135 /nfs/dbraw/zinc/62/51/35/712625135.db2.gz LOTMYCPUKDDKMO-WOPDTQHZSA-N 2 0 246.345 2.400 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C[C@H]2C[NH2+]CCC2(F)F)C1 ZINC000717307097 712646241 /nfs/dbraw/zinc/64/62/41/712646241.db2.gz RYFDXWHGAFICJW-GMTAPVOTSA-N 2 0 232.318 2.009 20 0 BEADRP CC(C)(C)[NH2+]CC[NH2+]C1CCC=CCC1 ZINC000718068189 712740494 /nfs/dbraw/zinc/74/04/94/712740494.db2.gz NUPPCQWSSWLIGI-UHFFFAOYSA-N 2 0 210.365 2.463 20 0 BEADRP CC[C@@H]1CCCC[C@H]1[NH2+]C1CC[NH2+]CC1 ZINC000038041118 712801430 /nfs/dbraw/zinc/80/14/30/712801430.db2.gz VANCXQXZPWKDJR-DGCLKSJQSA-N 2 0 210.365 2.297 20 0 BEADRP c1ccc2c(c1)CCC[C@H]2[NH2+]C1CC[NH2+]CC1 ZINC000038040694 712801681 /nfs/dbraw/zinc/80/16/81/712801681.db2.gz SLMOEIHSDMSXIJ-OAHLLOKOSA-N 2 0 230.355 2.406 20 0 BEADRP C[C@H]1C[C@H]([NH2+]C[C@H]2C[C@H]([NH3+])C2)C[C@@H](C)C1 ZINC000719376295 712806883 /nfs/dbraw/zinc/80/68/83/712806883.db2.gz GHVQZSADHVUGSC-YOTBANQPSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@H]1C[C@H]([NH2+]C[C@H]2C[C@@H]([NH3+])C2)C[C@@H](C)C1 ZINC000719376283 712807022 /nfs/dbraw/zinc/80/70/22/712807022.db2.gz GHVQZSADHVUGSC-CXYFJQCHSA-N 2 0 210.365 2.138 20 0 BEADRP c1ccc([C@@H]2CC[N@@H+](C[C@H]3CCC[NH2+]C3)C2)cc1 ZINC000250803532 712834957 /nfs/dbraw/zinc/83/49/57/712834957.db2.gz GMSNDDHMMIXEQL-GOEBONIOSA-N 2 0 244.382 2.476 20 0 BEADRP C[C@@H]1CCCC[C@H]1C[N@@H+]1C[C@@H]2C[NH2+]C[C@]2(C)C1 ZINC000720658021 712860863 /nfs/dbraw/zinc/86/08/63/712860863.db2.gz QXZQGFANMWHGIB-CBBWQLFWSA-N 2 0 236.403 2.354 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1C[NH2+]CC1(C)C ZINC000720775849 712864667 /nfs/dbraw/zinc/86/46/67/712864667.db2.gz ALRRFOZDAJYPEO-GRYCIOLGSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1CCCC[C@H]1[NH2+][C@H]1C[NH2+]CC1(C)C ZINC000720775851 712864722 /nfs/dbraw/zinc/86/47/22/712864722.db2.gz ALRRFOZDAJYPEO-UTUOFQBUSA-N 2 0 210.365 2.153 20 0 BEADRP [NH3+]C[C@@H]1C[N@H+](CC2CC=CC2)C[C@@H]1C(F)(F)F ZINC000720878442 712873030 /nfs/dbraw/zinc/87/30/30/712873030.db2.gz SRFYJVGKYQQGQN-MNOVXSKESA-N 2 0 248.292 2.022 20 0 BEADRP CC1(C[NH2+][C@@H]2C[C@H]([NH3+])C23CCC3)CC(F)(F)C1 ZINC000720900590 712875130 /nfs/dbraw/zinc/87/51/30/712875130.db2.gz ODXNAWZYZVVONG-VHSXEESVSA-N 2 0 244.329 2.281 20 0 BEADRP CCCCCCN1CCC[C@@H]2[NH2+]CC[C@@H]21 ZINC000720902210 712875962 /nfs/dbraw/zinc/87/59/62/712875962.db2.gz DVRFOCVNVHJZCV-STQMWFEESA-N 2 0 210.365 2.393 20 0 BEADRP CC1(C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)CC(F)(F)C1 ZINC000720914198 712878049 /nfs/dbraw/zinc/87/80/49/712878049.db2.gz ZURGAUDYIOXEOR-ZJUUUORDSA-N 2 0 232.318 2.281 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+]CC[C@@H]1C[NH2+]C[C@H]1C ZINC000721088722 712890509 /nfs/dbraw/zinc/89/05/09/712890509.db2.gz JEOYRDSGIBWUIK-QNWHQSFQSA-N 2 0 212.381 2.256 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH+]2CCC(CF)CC2)C1 ZINC001208612290 957099255 /nfs/dbraw/zinc/09/92/55/957099255.db2.gz MEUNVUVOUOVVNO-CYBMUJFWSA-N 2 0 228.355 2.010 20 0 BEADRP C[C@H]1C[N@H+](C)[C@@H](C)CN1c1[nH+]ccc2[nH]ccc21 ZINC000663763900 719155785 /nfs/dbraw/zinc/15/57/85/719155785.db2.gz ITUMRTUHPBBCCF-QWRGUYRKSA-N 2 0 244.342 2.092 20 0 BEADRP C1C[NH2+]C[C@H]([NH+]2C3CCCC2CCC3)C1 ZINC000707100363 958375714 /nfs/dbraw/zinc/37/57/14/958375714.db2.gz OKPZPRLQKXXDJS-WXRRBKDZSA-N 2 0 208.349 2.145 20 0 BEADRP C[NH+](C)C1CCC([NH2+][C@H]2CC2(C)C)CC1 ZINC000309045212 959569232 /nfs/dbraw/zinc/56/92/32/959569232.db2.gz OBSMWZXRCHKNBV-MCIGGMRASA-N 2 0 210.365 2.247 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)C1(Cl)CC1 ZINC000695655877 960327786 /nfs/dbraw/zinc/32/77/86/960327786.db2.gz OCLSTRVJNWHJLR-TUAOUCFPSA-N 2 0 242.794 2.363 20 0 BEADRP [NH3+]CCC1CCC([NH2+][C@@H]2C[C@H]3C[C@H]3C2)CC1 ZINC001167914434 961185759 /nfs/dbraw/zinc/18/57/59/961185759.db2.gz VJUAQVUZRMCUSW-RLILJNEXSA-N 2 0 222.376 2.282 20 0 BEADRP CCC[N@H+](CCC[NH+](C)C)[C@@H]1CCO[C@@H](C)C1 ZINC001168141953 963847833 /nfs/dbraw/zinc/84/78/33/963847833.db2.gz KNPYWDCFKWTLDR-UONOGXRCSA-N 2 0 242.407 2.218 20 0 BEADRP C[N@@H+]1CCC[C@@H]1CC[NH2+]C1CCCCC1 ZINC000822123798 963939366 /nfs/dbraw/zinc/93/93/66/963939366.db2.gz FKEVXQBYXGVUAV-CYBMUJFWSA-N 2 0 210.365 2.393 20 0 BEADRP Cc1ncn(C2CCC(C)CC2)c1CC[NH3+] ZINC001168196749 963965456 /nfs/dbraw/zinc/96/54/56/963965456.db2.gz PXUQCQHWMHNXQT-UHFFFAOYSA-N 2 0 221.348 2.444 20 0 BEADRP C[C@H](CC[NH2+]C1CCC(C)CC1)[NH+](C)C ZINC000697878157 964604262 /nfs/dbraw/zinc/60/42/62/964604262.db2.gz JJVZHYZIADGDAR-OTTFEQOBSA-N 2 0 212.381 2.495 20 0 BEADRP CC1(CC[NH2+][C@H]2C[C@H]([NH3+])C23CCC3)CC1 ZINC000698118046 965018057 /nfs/dbraw/zinc/01/80/57/965018057.db2.gz ZPZHLJFJXWUKGQ-QWRGUYRKSA-N 2 0 208.349 2.036 20 0 BEADRP C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC[C@H](C)SC ZINC000253028900 1165836017 /nfs/dbraw/zinc/83/60/17/1165836017.db2.gz PQRCJFNXDVEZJB-WODVXLOZSA-N 2 0 242.432 2.343 20 0 BEADRP COc1ccsc1C[N@@H+]1CCC[C@@H]([NH3+])CC1 ZINC001205110268 967360082 /nfs/dbraw/zinc/36/00/82/967360082.db2.gz QLUPPDGYUOBMOS-SNVBAGLBSA-N 2 0 240.372 2.070 20 0 BEADRP C1CC([NH2+]C23CC4CC(CC(C4)C2)C3)CC[NH2+]1 ZINC000038040479 1165890322 /nfs/dbraw/zinc/89/03/22/1165890322.db2.gz OYZYNWFVWWQPAN-UHFFFAOYSA-N 2 0 234.387 2.297 20 0 BEADRP C[N@@H+]1CC[C@@H](C[NH2+]C2CCC(C)(C)CC2)C1 ZINC000070623085 1165937452 /nfs/dbraw/zinc/93/74/52/1165937452.db2.gz BCYVNKREUTVDAG-LBPRGKRZSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH+]1CCC(n2cc(C[NH3+])c3ccccc32)CC1 ZINC000084848276 1165960478 /nfs/dbraw/zinc/96/04/78/1165960478.db2.gz BYKDHTHJBXVCTC-UHFFFAOYSA-N 2 0 243.354 2.367 20 0 BEADRP C[C@H]1CCC[C@H]([NH2+][C@@H]2CCC[C@H]([NH3+])C2)C1 ZINC000086402696 1166006442 /nfs/dbraw/zinc/00/64/42/1166006442.db2.gz BWEDVWQSUBGHHW-ZDEQEGDKSA-N 2 0 210.365 2.425 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+]CC1(C)COC1 ZINC000079472650 1166018295 /nfs/dbraw/zinc/01/82/95/1166018295.db2.gz FLUUIWIMUWZOPM-ZDUSSCGKSA-N 2 0 242.407 2.123 20 0 BEADRP C[NH+](C)CC(C)(C)C[N@@H+]1CCC[C@@H](CF)C1 ZINC001207286921 968718377 /nfs/dbraw/zinc/71/83/77/968718377.db2.gz WJDRBTJZKBCBES-LBPRGKRZSA-N 2 0 230.371 2.256 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C[C@H]2C[NH2+]C[C@@H](C)C2)C1 ZINC000398777312 1166090323 /nfs/dbraw/zinc/09/03/23/1166090323.db2.gz HCNLDBWWCRWZKH-YVECIDJPSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]1C[C@@H](C)CC[N@@H+]1CC1CC[NH+](C)CC1 ZINC001207398310 968752008 /nfs/dbraw/zinc/75/20/08/968752008.db2.gz HBRQOIGDVHWSCL-QWHCGFSZSA-N 2 0 224.392 2.449 20 0 BEADRP C(C1CC[NH2+]CC1)[N@@H+]1CC[C@@H]2CCC[C@H]2C1 ZINC001207436015 968769586 /nfs/dbraw/zinc/76/95/86/968769586.db2.gz RZNCDFWHZQUDPA-KBPBESRZSA-N 2 0 222.376 2.108 20 0 BEADRP C[NH+]1CCC(C)(C[N@@H+]2CCC[C@@H]2CF)CC1 ZINC001208116213 969009492 /nfs/dbraw/zinc/00/94/92/969009492.db2.gz QXAIFLHJDJVYFE-GFCCVEGCSA-N 2 0 228.355 2.152 20 0 BEADRP CC[NH+]1C[C@@H]2C[NH+](CC[C@H](C)SC)C[C@H]2C1 ZINC001208151101 969074004 /nfs/dbraw/zinc/07/40/04/969074004.db2.gz JHFYEGMFTXKUHZ-YNEHKIRRSA-N 2 0 242.432 2.012 20 0 BEADRP CCCC(CCC)[NH2+]C[C@H](O)C[NH+](CC)CC ZINC001253206500 969112776 /nfs/dbraw/zinc/11/27/76/969112776.db2.gz OBXIKOUDZYLEDA-AWEZNQCLSA-N 2 0 244.423 2.248 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2C[C@H]3CC[C@@H]2C3)CC1 ZINC001208598585 969150637 /nfs/dbraw/zinc/15/06/37/969150637.db2.gz UAXUYWJEINLQNV-UONOGXRCSA-N 2 0 222.376 2.203 20 0 BEADRP C[C@@H]1[C@@H](C)[C@H](C)C[N@@H+]1CCC1CC[NH2+]CC1 ZINC000399640130 1166249144 /nfs/dbraw/zinc/24/91/44/1166249144.db2.gz XFCSWCROQSJSNW-FRRDWIJNSA-N 2 0 224.392 2.352 20 0 BEADRP C/C=C(\NC=[NH2+])N1C(C)(C)CC([NH3+])CC1(C)C ZINC001167624605 1166313747 /nfs/dbraw/zinc/31/37/47/1166313747.db2.gz ZIQSQYQKAOOPIR-IZZDOVSWSA-N 2 0 238.379 2.025 20 0 BEADRP CCOC(C)(C)C[NH+]1CCC(C[NH+](C)C)CC1 ZINC001209073905 969346559 /nfs/dbraw/zinc/34/65/59/969346559.db2.gz ASVPBLPLVCFUCE-UHFFFAOYSA-N 2 0 242.407 2.075 20 0 BEADRP CC[C@H](C)[C@H](C)[N@@H+]1CC[C@H](C)[C@H](C[NH3+])C1 ZINC000167604750 1166382940 /nfs/dbraw/zinc/38/29/40/1166382940.db2.gz SWOANKSCHUHPSS-ZDEQEGDKSA-N 2 0 212.381 2.338 20 0 BEADRP CCC(CC)C[N@@H+]1C[C@H](C[NH3+])CC[C@H]1C ZINC000250384066 1166394961 /nfs/dbraw/zinc/39/49/61/1166394961.db2.gz FNYHYLIXGJYPNF-YPMHNXCESA-N 2 0 212.381 2.482 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH2+][C@@H]2CCC[C@@H](F)C2)CC1 ZINC001254497178 969656820 /nfs/dbraw/zinc/65/68/20/969656820.db2.gz HPJFAEOHMLAYAD-JHJVBQTASA-N 2 0 228.355 2.341 20 0 BEADRP Cc1cc(C[N@@H+]2CC[C@H]([NH3+])[C@H](C)C2)cs1 ZINC000309054192 1166471554 /nfs/dbraw/zinc/47/15/54/1166471554.db2.gz RSWHDBQUYQVLCT-SKDRFNHKSA-N 2 0 224.373 2.226 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH+]2CCC(C)(C)C2)CC1 ZINC001254522614 969713528 /nfs/dbraw/zinc/71/35/28/969713528.db2.gz HSIOWBZMHLIUJF-LBPRGKRZSA-N 2 0 210.365 2.203 20 0 BEADRP C[C@@H]([NH3+])c1ccc(O[C@H]2CCCC[NH2+]C2)cc1 ZINC001217972957 1166503204 /nfs/dbraw/zinc/50/32/04/1166503204.db2.gz RVPHFMRWGLQYHO-RISCZKNCSA-N 2 0 234.343 2.227 20 0 BEADRP C[C@@H]([NH3+])c1ccc(O[C@@H]2CCCC[NH2+]C2)cc1 ZINC001217972952 1166503396 /nfs/dbraw/zinc/50/33/96/1166503396.db2.gz RVPHFMRWGLQYHO-BXUZGUMPSA-N 2 0 234.343 2.227 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH+]2CCC[C@H](C(F)F)C2)CC1 ZINC001254525427 969722945 /nfs/dbraw/zinc/72/29/45/969722945.db2.gz IETKYSJNCQSNSZ-RYUDHWBXSA-N 2 0 246.345 2.448 20 0 BEADRP C[NH+](C)C1CCC([NH2+]CC2(F)CCC2)CC1 ZINC000393802288 1166534114 /nfs/dbraw/zinc/53/41/14/1166534114.db2.gz TXIGBYYQPWRQGK-UHFFFAOYSA-N 2 0 228.355 2.341 20 0 BEADRP CC(C)[NH+]1CCC(C[NH2+][C@H]2CCSC2)CC1 ZINC001255269665 970020759 /nfs/dbraw/zinc/02/07/59/970020759.db2.gz NSLXBDWWLSIHIO-ZDUSSCGKSA-N 2 0 242.432 2.202 20 0 BEADRP C1=C[C@@H]2C[C@H]1C[C@@H]2C[N@@H+]1CCC[C@@]2(CCC[NH2+]2)C1 ZINC001222345267 1166698841 /nfs/dbraw/zinc/69/88/41/1166698841.db2.gz KHSIMOJMQSYODL-JJXSEGSLSA-N 2 0 246.398 2.417 20 0 BEADRP CC(C)[C@H]1CCC[N@@H+]1[C@@H]1CC[NH2+][C@H](C)C1 ZINC000252965022 1166760113 /nfs/dbraw/zinc/76/01/13/1166760113.db2.gz WWQYFFWTGKXLIQ-JHJVBQTASA-N 2 0 210.365 2.247 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]CC1CCC1 ZINC001255940899 970567965 /nfs/dbraw/zinc/56/79/65/970567965.db2.gz IHOKCIGGDYEGOF-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP CCCCOCCC[NH2+][C@H]1CCC[N@H+](C)CC1 ZINC000160803051 1166803251 /nfs/dbraw/zinc/80/32/51/1166803251.db2.gz LSEVGPIEEMVWSS-AWEZNQCLSA-N 2 0 242.407 2.267 20 0 BEADRP CCCN(CCC[NH3+])[C@H](C)CC[NH+](CC)CC ZINC001255942432 970576737 /nfs/dbraw/zinc/57/67/37/970576737.db2.gz GJXUMZMFYZYBPM-CQSZACIVSA-N 2 0 243.439 2.168 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]CCSC ZINC001255942007 970578423 /nfs/dbraw/zinc/57/84/23/970578423.db2.gz CWKFHVYTWIHBLH-LLVKDONJSA-N 2 0 218.410 2.059 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)n1ccc([C@H](C)[NH3+])n1 ZINC001255947889 970581088 /nfs/dbraw/zinc/58/10/88/970581088.db2.gz YMRWSRDRONMRPH-NEPJUHHUSA-N 2 0 238.379 2.196 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+][C@H](CCO)C(C)C ZINC001255953167 970587441 /nfs/dbraw/zinc/58/74/41/970587441.db2.gz XVKUOPQZJYXGKJ-UONOGXRCSA-N 2 0 244.423 2.103 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+][C@H](CCO)C(C)C ZINC001255953168 970589019 /nfs/dbraw/zinc/58/90/19/970589019.db2.gz XVKUOPQZJYXGKJ-ZIAGYGMSSA-N 2 0 244.423 2.103 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[N@@H+]1CC[C@H](COC)C1 ZINC001255957072 970595625 /nfs/dbraw/zinc/59/56/25/970595625.db2.gz OQVBVLZDVBZQJB-KGLIPLIRSA-N 2 0 242.407 2.075 20 0 BEADRP CC[C@@H]1C[N@H+](Cc2ccc(C[NH3+])cc2)CCCO1 ZINC000380263341 1166849214 /nfs/dbraw/zinc/84/92/14/1166849214.db2.gz YEZJGVNXNUNBRX-OAHLLOKOSA-N 2 0 248.370 2.146 20 0 BEADRP C[N@@H+]1CC[C@H](c2ccc(NC=[NH2+])cc2)C1 ZINC001167871651 1166878826 /nfs/dbraw/zinc/87/88/26/1166878826.db2.gz UGKNGAGZDFQLIE-NSHDSACASA-N 2 0 203.289 2.125 20 0 BEADRP C[C@]1([NH3+])CC[N@@H+](C2CCC(C)(C)CC2)C1 ZINC000405857185 1166888402 /nfs/dbraw/zinc/88/84/02/1166888402.db2.gz OOIOJLWFIOERNB-ZDUSSCGKSA-N 2 0 210.365 2.378 20 0 BEADRP [NH3+]CC1CC[NH+](C[C@@H]2CC=CCC2)CC1 ZINC000238548433 1166907466 /nfs/dbraw/zinc/90/74/66/1166907466.db2.gz URPJCIPMCPCHSU-CYBMUJFWSA-N 2 0 208.349 2.013 20 0 BEADRP C[C@@H]1C[C@@H]([N@@H+]2CCC3(CCCC3)C2)CC[NH2+]1 ZINC000304318481 1166910310 /nfs/dbraw/zinc/91/03/10/1166910310.db2.gz BWBHUZCCDWLWFP-OLZOCXBDSA-N 2 0 222.376 2.393 20 0 BEADRP CC[C@@H]1CC[C@H](C)[N@H+](C[C@@]2(C)CC[NH2+]C2)C1 ZINC000304412150 1166915431 /nfs/dbraw/zinc/91/54/31/1166915431.db2.gz YHBPBYOPSRVIBY-MJBXVCDLSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1cnccc1CC[N@@H+](C)CC[C@@H]([NH3+])C(C)C ZINC000397484494 1166994895 /nfs/dbraw/zinc/99/48/95/1166994895.db2.gz AWQUZNKLDHIDTG-OAHLLOKOSA-N 2 0 249.402 2.238 20 0 BEADRP CCc1ccc(C[C@H](C)[NH2+]C[C@@H](C)C[NH3+])cc1 ZINC001173241580 975162842 /nfs/dbraw/zinc/16/28/42/975162842.db2.gz OJKYVVIHYXRRLU-STQMWFEESA-N 2 0 234.387 2.364 20 0 BEADRP CCSC[C@H](C)[N@@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC001173311912 975225816 /nfs/dbraw/zinc/22/58/16/975225816.db2.gz QZDQVNBTCOLVNS-STQMWFEESA-N 2 0 242.432 2.156 20 0 BEADRP CCC[C@@H](C)[N@H+](C)C[C@H](C[NH3+])C(C)C ZINC000251355468 1167133954 /nfs/dbraw/zinc/13/39/54/1167133954.db2.gz RLLBTDJMDAJQOX-NEPJUHHUSA-N 2 0 200.370 2.338 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]CC(C)C ZINC000308508811 1167185661 /nfs/dbraw/zinc/18/56/61/1167185661.db2.gz JXIBPNWZUSXHDV-GFCCVEGCSA-N 2 0 200.370 2.352 20 0 BEADRP CCC[N@H+](CC(C)C)[C@H]1CC[NH2+][C@H](C)C1 ZINC000308804535 1167201287 /nfs/dbraw/zinc/20/12/87/1167201287.db2.gz AGLFTHMQEWJUPQ-OLZOCXBDSA-N 2 0 212.381 2.495 20 0 BEADRP CC[N@H+](CCNc1cc[nH+]cc1)C(C)C ZINC000309039392 1167241405 /nfs/dbraw/zinc/24/14/05/1167241405.db2.gz KIIAHOZDBJDISM-UHFFFAOYSA-N 2 0 207.321 2.224 20 0 BEADRP C[NH2+]CC1CC[NH+](Cc2csc(C)c2)CC1 ZINC000309256050 1167275013 /nfs/dbraw/zinc/27/50/13/1167275013.db2.gz CIYYDDBPZRXLSD-UHFFFAOYSA-N 2 0 238.400 2.488 20 0 BEADRP CC(C)CCC[C@H](C)[N@@H+]1C[C@@H](C)[C@@H]([NH3+])C1 ZINC000309374810 1167299071 /nfs/dbraw/zinc/29/90/71/1167299071.db2.gz CLHOWJJINWMKNQ-AGIUHOORSA-N 2 0 212.381 2.480 20 0 BEADRP C[C@H]1CC([N@@H+]2CC[C@@]3(CC[NH2+]C3)C2)C[C@H](C)C1 ZINC000310143895 1167423658 /nfs/dbraw/zinc/42/36/58/1167423658.db2.gz DUSUNTAUQCIRJV-UMVBOHGHSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2CCC[C@H]3CCC[C@H]32)C[NH2+]1 ZINC000251929550 1167464832 /nfs/dbraw/zinc/46/48/32/1167464832.db2.gz VEUCWUGYRDUPKE-YIYPIFLZSA-N 2 0 222.376 2.391 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@@H+]([C@@H]2CC[C@H](C)[C@@H](C)C2)C1 ZINC000251990286 1167468596 /nfs/dbraw/zinc/46/85/96/1167468596.db2.gz ZGUMAYXONPMNFO-XDQVBPFNSA-N 2 0 224.392 2.352 20 0 BEADRP FC[C@H]1[C@@H]2C[N@H+](Cc3cc4c[nH+]ccc4[nH]3)C[C@H]12 ZINC001232015937 1167669242 /nfs/dbraw/zinc/66/92/42/1167669242.db2.gz OQUBHWCOJVAFQE-XYYAHUGASA-N 2 0 245.301 2.210 20 0 BEADRP C[NH2+]C[C@H]1CC[N@@H+]([C@H]2C[C@H](C)C[C@H](C)C2)C1 ZINC000252125812 1167706107 /nfs/dbraw/zinc/70/61/07/1167706107.db2.gz LJFCAASBHKVCLA-RQJABVFESA-N 2 0 224.392 2.352 20 0 BEADRP CCC[C@@H](C[N@H+](C)C1C[C@H]2CC[C@@H](C1)[NH2+]2)OC ZINC000386447794 1167710519 /nfs/dbraw/zinc/71/05/19/1167710519.db2.gz NOQPGYYVJCPPHF-PIGZVRMJSA-N 2 0 240.391 2.016 20 0 BEADRP CC1([NH2+]C2CC[NH+](CC3CC3)CC2)CCC1 ZINC000134519544 1167746533 /nfs/dbraw/zinc/74/65/33/1167746533.db2.gz WDTUMKNFQUTTCB-UHFFFAOYSA-N 2 0 222.376 2.393 20 0 BEADRP C[C@H]1C[C@H]([N@@H+]2C[C@@H]3CC[NH2+]C[C@@H]3C2)C[C@@H](C)C1 ZINC000310489191 1167783917 /nfs/dbraw/zinc/78/39/17/1167783917.db2.gz FNVFLWZCHCGECK-XPABHHOTSA-N 2 0 236.403 2.352 20 0 BEADRP C[C@H]1C[C@H]([N@@H+]2C[C@@H]3CC[NH2+]C[C@H]3C2)C[C@@H](C)C1 ZINC000310489183 1167784384 /nfs/dbraw/zinc/78/43/84/1167784384.db2.gz FNVFLWZCHCGECK-AIEDFZFUSA-N 2 0 236.403 2.352 20 0 BEADRP CC/C=C\CCC[N@@H+]1C[C@H](C)C[C@H]([NH3+])C1 ZINC001236043961 979335052 /nfs/dbraw/zinc/33/50/52/979335052.db2.gz HBNDFKIVQOTBMG-CIUCYMIDSA-N 2 0 210.365 2.402 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH2+]CCOc2ccccc2)CC1 ZINC000086818956 1168310383 /nfs/dbraw/zinc/31/03/83/1168310383.db2.gz KJAUJRVMOFZSEE-CQSZACIVSA-N 2 0 248.370 2.139 20 0 BEADRP CC[C@H](C)C[C@H](CC)[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC000085282121 1168324470 /nfs/dbraw/zinc/32/44/70/1168324470.db2.gz JTUSFFHWBKBKNJ-FQUUOJAGSA-N 2 0 224.392 2.352 20 0 BEADRP CC[C@@H]1CC[C@H]([NH2+][C@@H]2CCC[C@@H]([NH3+])C2)C1 ZINC000414927728 1168361477 /nfs/dbraw/zinc/36/14/77/1168361477.db2.gz PISDPAXZQOFEBA-LPWJVIDDSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@H](C[NH2+][C@H]1C[C@@H]([NH3+])C12CCC2)CC(F)F ZINC000697705448 1168410066 /nfs/dbraw/zinc/41/00/66/1168410066.db2.gz DCXNBXSLJVUXRW-AEJSXWLSSA-N 2 0 232.318 2.137 20 0 BEADRP CCCCC[C@H](C)[NH2+]C[C@H]1CC[N@H+](C)C1 ZINC000037484757 1168418943 /nfs/dbraw/zinc/41/89/43/1168418943.db2.gz LJHQVZKYEOBUPH-QWHCGFSZSA-N 2 0 212.381 2.497 20 0 BEADRP [NH3+]CC1CCC([NH2+]CCC2CCC2)CC1 ZINC001119070370 1168428867 /nfs/dbraw/zinc/42/88/67/1168428867.db2.gz DGSQDUQTOKWKDF-UHFFFAOYSA-N 2 0 210.365 2.284 20 0 BEADRP CSCC[N@H+](C)Cc1cccc2c[nH+]cn21 ZINC001238111773 980160747 /nfs/dbraw/zinc/16/07/47/980160747.db2.gz XSYIPCRCYDUYGL-UHFFFAOYSA-N 2 0 235.356 2.129 20 0 BEADRP CC[NH+](CC)C1CC[NH+](CC2CC2)CC1 ZINC000155614469 980531990 /nfs/dbraw/zinc/53/19/90/980531990.db2.gz KBZSWLIYVRJCCZ-UHFFFAOYSA-N 2 0 210.365 2.203 20 0 BEADRP COc1cc(C[NH2+][C@H](C)CCC[NH3+])ccc1F ZINC001345105727 980549811 /nfs/dbraw/zinc/54/98/11/980549811.db2.gz SSCMFEQNEXMXDK-SNVBAGLBSA-N 2 0 240.322 2.051 20 0 BEADRP C[C@H]1C[C@@H]([N@@H+]2C[C@@H]3CC[NH2+][C@@H]3C2)CC(C)(C)C1 ZINC001246651489 1168657952 /nfs/dbraw/zinc/65/79/52/1168657952.db2.gz LTCHPNJDYNGZNY-IGQOVBAYSA-N 2 0 236.403 2.495 20 0 BEADRP C[NH2+][C@@]12CC[C@@]([NH2+]C[C@@H]3C[C@H]3C)(C1)CCC2 ZINC001276034044 1169065055 /nfs/dbraw/zinc/06/50/55/1169065055.db2.gz QFKSNLKVDXOEKZ-ZOBORPQBSA-N 2 0 222.376 2.297 20 0 BEADRP CC(C)OCC[C@@H](C)[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC001172442814 974801209 /nfs/dbraw/zinc/80/12/09/974801209.db2.gz NNCUHMFVFCEZKN-AGIUHOORSA-N 2 0 228.380 2.050 20 0 BEADRP CC(C)COCC[C@@H](C)[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC001172463798 974828170 /nfs/dbraw/zinc/82/81/70/974828170.db2.gz TZAHHOSLBXQLDV-RDBSUJKOSA-N 2 0 242.407 2.297 20 0 BEADRP C[C@@H]1C[C@@H]([N@@H+]2CCC[C@](C)([NH3+])CC2)C[C@H](C)O1 ZINC001246550588 972710281 /nfs/dbraw/zinc/71/02/81/972710281.db2.gz JNKCTQURIROZRE-CRWXNKLISA-N 2 0 240.391 2.146 20 0 BEADRP CC(C)C[NH2+]Cc1ccc(-n2c[nH+]cc2N)cc1 ZINC001215744067 970827029 /nfs/dbraw/zinc/82/70/29/970827029.db2.gz OVKMWEMNKGFBKM-UHFFFAOYSA-N 2 0 244.342 2.200 20 0 BEADRP CCC[N@H+](CCC[NH3+])C1CCC(OCC)CC1 ZINC001256429385 970833108 /nfs/dbraw/zinc/83/31/08/970833108.db2.gz JHQWZFHHZFAZPA-UHFFFAOYSA-N 2 0 242.407 2.395 20 0 BEADRP CC1CC([N@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)C1 ZINC001256623436 970886400 /nfs/dbraw/zinc/88/64/00/970886400.db2.gz PVYJTFAQSVDXSE-HPCMXSDISA-N 2 0 222.376 2.342 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@@H]2CC[C@H]3C[C@H]3C2)CC1 ZINC000403401829 970933059 /nfs/dbraw/zinc/93/30/59/970933059.db2.gz SGTMILYNLVJISD-MELADBBJSA-N 2 0 222.376 2.106 20 0 BEADRP C[C@H](Cc1ccncc1)[NH2+]CCC[NH+]1CCCC1 ZINC001256716553 970933292 /nfs/dbraw/zinc/93/32/92/970933292.db2.gz TWWYHKJWFGRUEU-CQSZACIVSA-N 2 0 247.386 2.088 20 0 BEADRP CC(C)[N@H+](CCC[NH3+])[C@@H](C)Cc1ccncc1 ZINC001256718422 970935774 /nfs/dbraw/zinc/93/57/74/970935774.db2.gz IPJVXKSDKPNBMT-ZDUSSCGKSA-N 2 0 235.375 2.072 20 0 BEADRP FC1CC([NH2+]C2CCN(c3cc[nH+]cc3)CC2)C1 ZINC001256848795 970997224 /nfs/dbraw/zinc/99/72/24/970997224.db2.gz GJHWCBMXFGNEMM-UHFFFAOYSA-N 2 0 249.333 2.141 20 0 BEADRP C[N@H+](C1CC1)C1CCN(c2cc[nH+]cc2)CC1 ZINC001256855133 970995667 /nfs/dbraw/zinc/99/56/67/970995667.db2.gz FBLXMKLSVSDDHN-UHFFFAOYSA-N 2 0 231.343 2.145 20 0 BEADRP F[C@H]1C[C@@H]([NH2+]C2CCN(c3cc[nH+]cc3)CC2)C1 ZINC001256849564 970997358 /nfs/dbraw/zinc/99/73/58/970997358.db2.gz GJHWCBMXFGNEMM-BJHJDKERSA-N 2 0 249.333 2.141 20 0 BEADRP CC1(C)C[NH+](C2CCN(c3cc[nH+]cc3)CC2)C1 ZINC001256855814 970998595 /nfs/dbraw/zinc/99/85/95/970998595.db2.gz XBYLRIXHJVKSTK-UHFFFAOYSA-N 2 0 245.370 2.392 20 0 BEADRP CC(C)N(c1cc2[nH]ccc2c[nH+]1)[C@@H]1CC[NH2+]C1 ZINC001158020579 971023088 /nfs/dbraw/zinc/02/30/88/971023088.db2.gz AAJZKPCJIAJNDL-GFCCVEGCSA-N 2 0 244.342 2.140 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]C23CC(C2)C3)CC1 ZINC001257204645 971123430 /nfs/dbraw/zinc/12/34/30/971123430.db2.gz NOBTVBPQXAATMO-UHFFFAOYSA-N 2 0 208.349 2.001 20 0 BEADRP CCc1cc(N[C@H](C)C[NH+](C)C)cc[nH+]1 ZINC000307778483 971175758 /nfs/dbraw/zinc/17/57/58/971175758.db2.gz VWYPXDXHPHRLDV-SNVBAGLBSA-N 2 0 207.321 2.006 20 0 BEADRP COc1ccc(C[NH2+][C@@H]2C[C@H]([NH3+])C23CCC3)cc1 ZINC000405208526 971206800 /nfs/dbraw/zinc/20/68/00/971206800.db2.gz HFDIVVGTVNEVAV-UONOGXRCSA-N 2 0 246.354 2.055 20 0 BEADRP COc1ccc(C[NH2+][C@H]2C[C@@H]([NH3+])C23CCC3)cc1 ZINC000405208524 971209372 /nfs/dbraw/zinc/20/93/72/971209372.db2.gz HFDIVVGTVNEVAV-KGLIPLIRSA-N 2 0 246.354 2.055 20 0 BEADRP CS[C@@H]1CC[C@H]([NH2+][C@@H]2C[C@H]([NH3+])C23CCC3)C1 ZINC000405230984 971212253 /nfs/dbraw/zinc/21/22/53/971212253.db2.gz AUUJTZPENWOZMI-WHOHXGKFSA-N 2 0 240.416 2.130 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]CCc2cccc(F)c2)C12CCC2 ZINC000405234154 971215415 /nfs/dbraw/zinc/21/54/15/971215415.db2.gz RZSFDTJANNSJGO-KBPBESRZSA-N 2 0 248.345 2.228 20 0 BEADRP CC(F)(F)CCC[NH2+][C@H]1C[C@H]([NH3+])C1(C)C ZINC000405223954 971216014 /nfs/dbraw/zinc/21/60/14/971216014.db2.gz NSPRIRDDRNJZOA-IUCAKERBSA-N 2 0 220.307 2.137 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+]CCc2ccsc2)C12CCC2 ZINC000405227243 971216462 /nfs/dbraw/zinc/21/64/62/971216462.db2.gz DRRDIZXAZFHNGX-NWDGAFQWSA-N 2 0 236.384 2.150 20 0 BEADRP Cc1cc(C)c(C[NH2+][C@@H]2C[C@@H]([NH3+])C23CCC3)cn1 ZINC000405245383 971218649 /nfs/dbraw/zinc/21/86/49/971218649.db2.gz ZNYQMULKRXUBJN-ZIAGYGMSSA-N 2 0 245.370 2.058 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1C[C@H]([NH3+])C12CCC2 ZINC000405265058 971223035 /nfs/dbraw/zinc/22/30/35/971223035.db2.gz PCSPCOPVOJCMJF-MROQNXINSA-N 2 0 222.376 2.425 20 0 BEADRP Cc1cccc(CC[NH2+][C@H]2C[C@@H]([NH3+])C23CCC3)c1 ZINC000405277424 971227956 /nfs/dbraw/zinc/22/79/56/971227956.db2.gz XSQZRAUPZPFBKA-CABCVRRESA-N 2 0 244.382 2.397 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]C[C@@H]2Cc3ccccc32)C12CCC2 ZINC000405275581 971228319 /nfs/dbraw/zinc/22/83/19/971228319.db2.gz WVLGBYYVFPQGNZ-NWANDNLSSA-N 2 0 242.366 2.186 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+]Cc2cccc(F)c2)C12CCC2 ZINC000405326110 971236572 /nfs/dbraw/zinc/23/65/72/971236572.db2.gz UKALJMZXFHUZII-QWHCGFSZSA-N 2 0 234.318 2.185 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+][C@H]2CC3CCC2CC3)C12CCC2 ZINC000405332911 971237425 /nfs/dbraw/zinc/23/74/25/971237425.db2.gz XKFMONOQKZGRBU-PNKMZZHYSA-N 2 0 234.387 2.425 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2)C1CCCC1 ZINC000405356468 971240456 /nfs/dbraw/zinc/24/04/56/971240456.db2.gz RHXHTQRWDMFCEP-RAIGVLPGSA-N 2 0 222.376 2.425 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]CCC2CCCC2)C12CCC2 ZINC000405352588 971240804 /nfs/dbraw/zinc/24/08/04/971240804.db2.gz PEASADJSFIVYMN-STQMWFEESA-N 2 0 222.376 2.426 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@H]2C[C@@H]([NH3+])C23CCC3)C1 ZINC000405350717 971244609 /nfs/dbraw/zinc/24/46/09/971244609.db2.gz NXSCOTFMBMVREK-XQHKEYJVSA-N 2 0 222.376 2.425 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@H]2C[C@H]([NH3+])C23CCC3)C1 ZINC000405443666 971252874 /nfs/dbraw/zinc/25/28/74/971252874.db2.gz FFOPFBZZUUYUDF-RHYQMDGZSA-N 2 0 208.349 2.035 20 0 BEADRP CCC(C)(C)C[NH2+][C@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405437918 971256086 /nfs/dbraw/zinc/25/60/86/971256086.db2.gz CSSGQADGYHJOEP-MNOVXSKESA-N 2 0 210.365 2.282 20 0 BEADRP CCCC[C@H](CC)NC(=[NH2+])SCC[NH3+] ZINC001257411249 971307196 /nfs/dbraw/zinc/30/71/96/971307196.db2.gz SQJNJAIDRJUXIQ-VIFPVBQESA-N 2 0 217.382 2.171 20 0 BEADRP CC[C@@H](C)[NH+]1CCC([NH3+])(CC2CC2)CC1 ZINC001257434593 971342564 /nfs/dbraw/zinc/34/25/64/971342564.db2.gz SAIXVLPFLSCVSK-LLVKDONJSA-N 2 0 210.365 2.378 20 0 BEADRP C[C@@H](OCCCCCCC[NH3+])C1CC[NH2+]CC1 ZINC001217777417 971386801 /nfs/dbraw/zinc/38/68/01/971386801.db2.gz KTXCPQFKWBIATB-CYBMUJFWSA-N 2 0 242.407 2.300 20 0 BEADRP [NH3+]CCCCCCCO[C@H]1C[NH2+]CCC[C@H]1F ZINC001217772372 971397015 /nfs/dbraw/zinc/39/70/15/971397015.db2.gz BHPIAWFYFXPEPH-OLZOCXBDSA-N 2 0 246.370 2.002 20 0 BEADRP [NH3+]CCCCCCCO[C@H]1C[NH2+]CCC[C@@H]1F ZINC001217772374 971398233 /nfs/dbraw/zinc/39/82/33/971398233.db2.gz BHPIAWFYFXPEPH-STQMWFEESA-N 2 0 246.370 2.002 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1OCc1cccc(C[NH3+])c1 ZINC001217779306 971399122 /nfs/dbraw/zinc/39/91/22/971399122.db2.gz CYWJGWFLMKBJPP-IUODEOHRSA-N 2 0 248.370 2.050 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1OCc1ccc(C[NH3+])cc1 ZINC001217783074 971404540 /nfs/dbraw/zinc/40/45/40/971404540.db2.gz UOTBQSZGAVSHOQ-IUODEOHRSA-N 2 0 248.370 2.050 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1OCc1ccc(C[NH3+])cc1 ZINC001217783076 971403360 /nfs/dbraw/zinc/40/33/60/971403360.db2.gz UOTBQSZGAVSHOQ-SWLSCSKDSA-N 2 0 248.370 2.050 20 0 BEADRP C[NH+](C)CC[C@H](O[C@H]1CC[NH2+]C1)c1ccccc1 ZINC001217822871 971419845 /nfs/dbraw/zinc/41/98/45/971419845.db2.gz QPXJSOLQSUOYTD-GJZGRUSLSA-N 2 0 248.370 2.058 20 0 BEADRP C[NH+](C)CC[C@@H](O[C@H]1CC[NH2+]C1)c1ccccc1 ZINC001217822872 971420370 /nfs/dbraw/zinc/42/03/70/971420370.db2.gz QPXJSOLQSUOYTD-LSDHHAIUSA-N 2 0 248.370 2.058 20 0 BEADRP [NH3+]CCC1CCC([NH2+][C@H]2CCCSC2)CC1 ZINC001257664910 971462012 /nfs/dbraw/zinc/46/20/12/971462012.db2.gz RIIFPTGNIAJSGU-BPCQOVAHSA-N 2 0 242.432 2.379 20 0 BEADRP CC(C)C[NH+]1CCC([NH+]2CC(C)C2)CC1 ZINC001258011677 971551561 /nfs/dbraw/zinc/55/15/61/971551561.db2.gz OCCZFYPTDPXICD-UHFFFAOYSA-N 2 0 210.365 2.059 20 0 BEADRP CC(C)C[NH+]1CCC([NH2+][C@H]2C[C@@H](F)C2)CC1 ZINC001258002966 971552594 /nfs/dbraw/zinc/55/25/94/971552594.db2.gz QMCNWJPFONFSKL-BJHJDKERSA-N 2 0 228.355 2.197 20 0 BEADRP C[C@H]([NH3+])c1ccc(O[C@@H]2CCC[NH2+]CC2)cc1 ZINC001217998820 971563764 /nfs/dbraw/zinc/56/37/64/971563764.db2.gz FKPWAEWDSMMQDW-WCQYABFASA-N 2 0 234.343 2.227 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1Oc1cccc2c1C[NH2+]C2 ZINC001218027897 971578367 /nfs/dbraw/zinc/57/83/67/971578367.db2.gz BHIJZWQXCLRKKY-BXUZGUMPSA-N 2 0 246.354 2.057 20 0 BEADRP [NH3+]Cc1cccc(O[C@@H]2CCC23CC[NH2+]CC3)c1 ZINC001218079499 971598046 /nfs/dbraw/zinc/59/80/46/971598046.db2.gz HGEPVUVWZLTIGO-CQSZACIVSA-N 2 0 246.354 2.056 20 0 BEADRP [NH3+]Cc1ccc(O[C@H]2CCC[C@@]23CC[NH2+]C3)cc1 ZINC001218091184 971598704 /nfs/dbraw/zinc/59/87/04/971598704.db2.gz DEUVBESRKXPDDQ-GJZGRUSLSA-N 2 0 246.354 2.056 20 0 BEADRP CC[NH+]1CCC(Oc2cccc(C[NH3+])c2)CC1 ZINC001218202861 971627424 /nfs/dbraw/zinc/62/74/24/971627424.db2.gz VLDJSLXZBUTKIF-UHFFFAOYSA-N 2 0 234.343 2.008 20 0 BEADRP CC1(C)[C@@H]2C[C@@H]([NH2+]CC34CC[NH+](CC3)CC4)C[C@@H]21 ZINC001170724562 971657732 /nfs/dbraw/zinc/65/77/32/971657732.db2.gz MKZROEZSZCQEDT-ZSOGYDGISA-N 2 0 248.414 2.497 20 0 BEADRP CC1(C)[C@@H]2C[C@@H]([NH2+][C@H]3CCC[C@H]([NH3+])C3)C[C@@H]21 ZINC001170729305 971666984 /nfs/dbraw/zinc/66/69/84/971666984.db2.gz CDWUZRJZGFAUHU-PJSNJIKXSA-N 2 0 222.376 2.281 20 0 BEADRP C[C@H](c1cccc(O[C@H]2CCC[NH2+]C2)c1)[NH+](C)C ZINC001218282951 971675305 /nfs/dbraw/zinc/67/53/05/971675305.db2.gz DMRUUBUJZHSMIJ-DOMZBBRYSA-N 2 0 248.370 2.440 20 0 BEADRP C[NH+](C)C1CC[NH+]([C@H]2C[C@@H]3[C@H](C2)C3(C)C)CC1 ZINC001170742127 971696868 /nfs/dbraw/zinc/69/68/68/971696868.db2.gz YQZGUAUEDOBPNU-BTTYYORXSA-N 2 0 236.403 2.447 20 0 BEADRP CC[N@@H+]1CCC[C@@H](Oc2cccc(C[NH3+])c2)C1 ZINC001218348458 971720981 /nfs/dbraw/zinc/72/09/81/971720981.db2.gz QQALXIFQXCEMEM-CQSZACIVSA-N 2 0 234.343 2.008 20 0 BEADRP CC(C)[N@@H+]1CCC[C@@H](Oc2cccc(C[NH3+])c2)C1 ZINC001218349141 971720371 /nfs/dbraw/zinc/72/03/71/971720371.db2.gz XXIPRRVKFLQBDN-OAHLLOKOSA-N 2 0 248.370 2.397 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+][C@H](C)[C@H](C)OC ZINC000309676111 971753345 /nfs/dbraw/zinc/75/33/45/971753345.db2.gz XSMZELCBZXOQBB-XQQFMLRXSA-N 2 0 230.396 2.120 20 0 BEADRP C[C@@H]([NH3+])c1ccc(O[C@@H]2C[NH2+]CCC23CC3)cc1 ZINC001218408694 971783493 /nfs/dbraw/zinc/78/34/93/971783493.db2.gz LXXLNKGXELNETI-BXUZGUMPSA-N 2 0 246.354 2.227 20 0 BEADRP CC1(C)C[C@@H](Oc2cccc(C[NH3+])c2)CC[NH2+]1 ZINC001218477762 971828100 /nfs/dbraw/zinc/82/81/00/971828100.db2.gz FULLXYXKSDAXDW-ZDUSSCGKSA-N 2 0 234.343 2.055 20 0 BEADRP CC1(C)C[C@H](Oc2ccc(CC[NH3+])cc2)CC[NH2+]1 ZINC001218475971 971828549 /nfs/dbraw/zinc/82/85/49/971828549.db2.gz OPACOUUOJRQAGE-CQSZACIVSA-N 2 0 248.370 2.097 20 0 BEADRP CC1(C)C[C@@H](Oc2ccc(C[NH3+])cc2)CC[NH2+]1 ZINC001218478864 971828710 /nfs/dbraw/zinc/82/87/10/971828710.db2.gz PSIFTRDVYJURHQ-ZDUSSCGKSA-N 2 0 234.343 2.055 20 0 BEADRP C[C@@H]([NH3+])c1ccc(O[C@H]2C[NH2+]CC[C@H]2C)cc1 ZINC001218482638 971831161 /nfs/dbraw/zinc/83/11/61/971831161.db2.gz BVXZVIVYQILJEX-GYSYKLTISA-N 2 0 234.343 2.083 20 0 BEADRP [NH3+]CCC1CCC([NH2+][C@H]2CCCOCC2)CC1 ZINC001170792217 971832271 /nfs/dbraw/zinc/83/22/71/971832271.db2.gz IUABRUIEJLWDMV-MOKVOYLWSA-N 2 0 240.391 2.053 20 0 BEADRP CC/C=C\CC[NH+]1CCC(F)(C[NH3+])CC1 ZINC001222527020 972542931 /nfs/dbraw/zinc/54/29/31/972542931.db2.gz HRMOSMFIFFPXDT-ARJAWSKDSA-N 2 0 214.328 2.106 20 0 BEADRP CC[C@H](C)OCC[C@@H](C)[NH2+][C@@H]1CCC[C@@H]1[NH3+] ZINC001172326709 974536319 /nfs/dbraw/zinc/53/63/19/974536319.db2.gz BFXFVBIXDUZUOO-MROQNXINSA-N 2 0 228.380 2.050 20 0 BEADRP C[NH+](C)[C@@H]1CCCC[C@H]1Nc1cc[nH+]cc1 ZINC000309953676 971893820 /nfs/dbraw/zinc/89/38/20/971893820.db2.gz HGHUMXAEMQXMAE-CHWSQXEVSA-N 2 0 219.332 2.366 20 0 BEADRP CC(C)(C[NH3+])c1ccc(NC2=CC[NH2+]CC2)cc1 ZINC001159580608 971972723 /nfs/dbraw/zinc/97/27/23/971972723.db2.gz SOECUJPRBICZIX-UHFFFAOYSA-N 2 0 245.370 2.212 20 0 BEADRP [NH3+]C[C@H]1CCCC[N@H+](Cc2cccc(F)c2)C1 ZINC000310567357 971975860 /nfs/dbraw/zinc/97/58/60/971975860.db2.gz YCHLTTFHXNSNJI-CYBMUJFWSA-N 2 0 236.334 2.387 20 0 BEADRP Cc1c[nH+]c(NCC[C@@H](C)[NH3+])c2[nH]ccc21 ZINC001170888796 972043141 /nfs/dbraw/zinc/04/31/41/972043141.db2.gz CYNQCRFVAUQFMA-SECBINFHSA-N 2 0 218.304 2.021 20 0 BEADRP [NH3+]CCC[C@H]([NH3+])Nc1cc(F)c2ccccc2c1 ZINC001170904311 972077810 /nfs/dbraw/zinc/07/78/10/972077810.db2.gz NTVFLZUIOQGUOC-CQSZACIVSA-N 2 0 247.317 2.415 20 0 BEADRP [NH3+]CCC[C@@H]([NH3+])Nc1cc(F)c2ccccc2c1 ZINC001170904310 972078515 /nfs/dbraw/zinc/07/85/15/972078515.db2.gz NTVFLZUIOQGUOC-AWEZNQCLSA-N 2 0 247.317 2.415 20 0 BEADRP CCc1cccc(CC)c1N[C@@H]([NH3+])CCC[NH3+] ZINC001170906946 972081468 /nfs/dbraw/zinc/08/14/68/972081468.db2.gz ZADBUWJQQKEANZ-CYBMUJFWSA-N 2 0 235.375 2.247 20 0 BEADRP C[C@@H]([NH3+])CC[NH2+]C(C)(C)c1ccnc(Cl)c1 ZINC001159780376 972109564 /nfs/dbraw/zinc/10/95/64/972109564.db2.gz ZEVIEJPYSCQXGD-SECBINFHSA-N 2 0 241.766 2.297 20 0 BEADRP F[C@H]1CC[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)CC1 ZINC001246089000 972142114 /nfs/dbraw/zinc/14/21/14/972142114.db2.gz ODEDGIPFRLJNFH-HTYKTIJTSA-N 2 0 226.339 2.140 20 0 BEADRP CC1(C)[C@@H]2C[C@H]([NH2+][C@@H]3CCCC[NH2+]C3)C[C@@H]21 ZINC001246089281 972144351 /nfs/dbraw/zinc/14/43/51/972144351.db2.gz BXGYQIFFZOUUMM-FVCCEPFGSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]1C[NH2+]C[C@@H](C[NH2+][C@H]2C[C@@H]3[C@H](C2)C3(C)C)C1 ZINC001246101316 972156652 /nfs/dbraw/zinc/15/66/52/972156652.db2.gz PKAMFRCNDRSEBJ-YHQUGGNUSA-N 2 0 236.403 2.256 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]C[C@H]1CC[C@@H](C)C[NH2+]1 ZINC001246106361 972170057 /nfs/dbraw/zinc/17/00/57/972170057.db2.gz PPHNKCQJZVKRFW-NTZNESFSSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H](CC1CC1)[NH2+]C[C@H]1CC[C@@H](C)C[NH2+]1 ZINC001246106357 972170222 /nfs/dbraw/zinc/17/02/22/972170222.db2.gz PPHNKCQJZVKRFW-NQBHXWOUSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H](CC1CC1)[NH2+]C[C@H]1CCC[NH2+][C@@H]1C ZINC001246104979 972165922 /nfs/dbraw/zinc/16/59/22/972165922.db2.gz AHJLHNOECIPFFY-NQBHXWOUSA-N 2 0 210.365 2.153 20 0 BEADRP C[NH+]1CCc2ccc(C3=CCC[N@@H+](C)C3)cc2C1 ZINC001241571739 1169730748 /nfs/dbraw/zinc/73/07/48/1169730748.db2.gz HLNHRRRDBGRFOZ-UHFFFAOYSA-N 2 0 242.366 2.393 20 0 BEADRP CCCC(CCC)[NH2+][C@@H]1C[NH2+]CC12CC2 ZINC001246136364 972190919 /nfs/dbraw/zinc/19/09/19/972190919.db2.gz WMPOUODSHDVEDS-GFCCVEGCSA-N 2 0 210.365 2.297 20 0 BEADRP C[NH+](C)Cc1ccc(C2=CCC[N@H+](C)C2)cc1 ZINC001241571305 1169733662 /nfs/dbraw/zinc/73/36/62/1169733662.db2.gz WZDZYYFVRNHYNU-UHFFFAOYSA-N 2 0 230.355 2.467 20 0 BEADRP CC[C@@H]1C[C@H]([NH2+][C@H](C)c2cccc(N)c2)CC[NH2+]1 ZINC001246177994 972209011 /nfs/dbraw/zinc/20/90/11/972209011.db2.gz XLBRBSPIVDGALI-KCPJHIHWSA-N 2 0 247.386 2.450 20 0 BEADRP CC(C)COCC[C@H](C)[NH2+]C[C@H]1CCC[NH2+]C1 ZINC001246199571 972214235 /nfs/dbraw/zinc/21/42/35/972214235.db2.gz XFZHUXCMNWYPDO-KBPBESRZSA-N 2 0 242.407 2.027 20 0 BEADRP CS[C@@H](C)CC[NH+]1CCC2(C[NH+](C)C2)CC1 ZINC001208155993 957034641 /nfs/dbraw/zinc/03/46/41/957034641.db2.gz USMFHAZGALPGSU-LBPRGKRZSA-N 2 0 242.432 2.156 20 0 BEADRP C[C@@H]1CC(C[N@@H+]2CCC[C@H]([NH3+])CC2)C[C@@H](C)O1 ZINC000724507934 957317973 /nfs/dbraw/zinc/31/79/73/957317973.db2.gz JKLWLUYTUFTJCB-BZPMIXESSA-N 2 0 240.391 2.003 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H]1Cc2cccc(Cl)c2C1 ZINC001246307359 972269493 /nfs/dbraw/zinc/26/94/93/972269493.db2.gz XCDPETCFYIUASD-GXSJLCMTSA-N 2 0 238.762 2.134 20 0 BEADRP CCC[N@H+]1C[C@H]2CN(Cc3ccc(C)[nH]3)C[C@H]2C1 ZINC001209576563 957514424 /nfs/dbraw/zinc/51/44/24/957514424.db2.gz YNDACPAQPULEFI-OKILXGFUSA-N 2 0 247.386 2.097 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@H]1CCc2cc(F)ccc2C1 ZINC001246313811 972274248 /nfs/dbraw/zinc/27/42/48/972274248.db2.gz LNXWBDBAUSOIIT-KGLIPLIRSA-N 2 0 236.334 2.010 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@H]1CCc2cc(F)ccc2C1 ZINC001246313807 972275850 /nfs/dbraw/zinc/27/58/50/972275850.db2.gz LNXWBDBAUSOIIT-KBPBESRZSA-N 2 0 236.334 2.010 20 0 BEADRP [NH3+]CCCCCCC[NH2+][C@@H]1C[C@H]2C[C@H]2C1 ZINC000397634402 957740385 /nfs/dbraw/zinc/74/03/85/957740385.db2.gz OLHOGIVDZGFZQP-CLLJXQQHSA-N 2 0 210.365 2.284 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C2CC3(C2)CC(F)(F)C3)CC[NH2+]1 ZINC001246336300 972298069 /nfs/dbraw/zinc/29/80/69/972298069.db2.gz UNWIFSUPZWPXDQ-NXEZZACHSA-N 2 0 244.329 2.294 20 0 BEADRP C[NH2+]CC[C@@H](C)[NH2+]C[C@H]1CCc2ccccc2N1 ZINC001246353204 972301397 /nfs/dbraw/zinc/30/13/97/972301397.db2.gz QDQHLWMNCZIWBJ-TZMCWYRMSA-N 2 0 247.386 2.001 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CC2CC(C)(C)C2)CC[NH2+]1 ZINC000706561390 958008503 /nfs/dbraw/zinc/00/85/03/958008503.db2.gz XKYUWMNLRVZWJV-PWSUYJOCSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H](Cc1ccco1)[NH2+]CC1CC[NH+](C)CC1 ZINC000054241424 958037995 /nfs/dbraw/zinc/03/79/95/958037995.db2.gz VDLYDPRYZLDWJX-LBPRGKRZSA-N 2 0 236.359 2.142 20 0 BEADRP CC[C@]1([NH2+]C2CCCCCC2)CC[NH2+]C1 ZINC001246459087 972332033 /nfs/dbraw/zinc/33/20/33/972332033.db2.gz JCTFGSDBTHNJDD-ZDUSSCGKSA-N 2 0 210.365 2.441 20 0 BEADRP Cc1ccc2c(c1)C[C@@H]([NH2+][C@H]1C[C@@](C)([NH3+])C1)CC2 ZINC001246459062 972334019 /nfs/dbraw/zinc/33/40/19/972334019.db2.gz IWKPSAVUUGZHTH-HRCADAONSA-N 2 0 244.382 2.322 20 0 BEADRP CC1(C)CCC([NH2+]C[C@@H]2CC[NH2+]C[C@@H]2F)CC1 ZINC001246475398 972349130 /nfs/dbraw/zinc/34/91/30/972349130.db2.gz DVLOKZPEHRBXSB-AAEUAGOBSA-N 2 0 242.382 2.492 20 0 BEADRP CC1(C)CC[C@H]([NH2+]C[C@@H]2CC[NH2+]C[C@@H]2F)C1 ZINC001246474625 972349262 /nfs/dbraw/zinc/34/92/62/972349262.db2.gz ADDXWHNLKBLHLN-SRVKXCTJSA-N 2 0 228.355 2.102 20 0 BEADRP C[C@@H]1C[C@@H]([N@@H+]2CCC23CCCC3)CC[NH2+]1 ZINC000707627660 958638008 /nfs/dbraw/zinc/63/80/08/958638008.db2.gz RRRVYQWPEYYIDB-NEPJUHHUSA-N 2 0 208.349 2.145 20 0 BEADRP C[C@H](c1cccs1)[N@H+](C)C[C@H]1C[C@@H]([NH3+])C1 ZINC000693593229 958907044 /nfs/dbraw/zinc/90/70/44/958907044.db2.gz UTMYMIMRGPJGOV-MXWKQRLJSA-N 2 0 224.373 2.478 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+][C@H]2CCCC[C@@H]2C2CC2)C1 ZINC000693602696 958932929 /nfs/dbraw/zinc/93/29/29/958932929.db2.gz MVTOLCGDNQXQTK-ZRJCITRHSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@]1([NH3+])CCN([C@H]2CSc3ccccc3C2)C1 ZINC001246526828 972397548 /nfs/dbraw/zinc/39/75/48/972397548.db2.gz BUTATDPEAJJRNS-OCCSQVGLSA-N 2 0 248.395 2.127 20 0 BEADRP CC[C@@H](C)C[N@@H+]1CCC[C@@]12CCC[NH2+]C2 ZINC001222232896 972413682 /nfs/dbraw/zinc/41/36/82/972413682.db2.gz YKXBGZNFJAGNPV-CHWSQXEVSA-N 2 0 210.365 2.251 20 0 BEADRP C(C1CCC1)[N@@H+]1CCC[C@]12CCC[NH2+]C2 ZINC001222231151 972416252 /nfs/dbraw/zinc/41/62/52/972416252.db2.gz JZBUBCHFRFBDPS-ZDUSSCGKSA-N 2 0 208.349 2.005 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@@H+]1CCC[C@H]2CCC[C@H]21 ZINC000300356501 959376004 /nfs/dbraw/zinc/37/60/04/959376004.db2.gz MMMVVORZNAAQQD-YIYPIFLZSA-N 2 0 222.376 2.106 20 0 BEADRP C[C@]1(C[NH2+][C@@H]2C[C@H]([NH3+])C23CCC3)CCCS1 ZINC000405275587 959432415 /nfs/dbraw/zinc/43/24/15/959432415.db2.gz WVQBTLJLHDZGDQ-QJPTWQEYSA-N 2 0 240.416 2.132 20 0 BEADRP [NH3+]C[C@@H]1CCCC[N@H+](Cc2cccs2)C1 ZINC000308790755 959503660 /nfs/dbraw/zinc/50/36/60/959503660.db2.gz AYRBKWWPRPLTNP-NSHDSACASA-N 2 0 224.373 2.309 20 0 BEADRP CC(C)CCC[N@@H+]1CCCC[C@@H](C[NH3+])C1 ZINC000308885274 959537239 /nfs/dbraw/zinc/53/72/39/959537239.db2.gz WQMLDPACRUZCBQ-ZDUSSCGKSA-N 2 0 212.381 2.483 20 0 BEADRP C[NH+](C)C1CCC([NH2+]C2(C)CCC2)CC1 ZINC000309036694 959568325 /nfs/dbraw/zinc/56/83/25/959568325.db2.gz INLSNOZOPQIALJ-UHFFFAOYSA-N 2 0 210.365 2.391 20 0 BEADRP C[C@@H]1C[NH2+]CCC[C@@H]1OCCCCCCC[NH3+] ZINC001217776060 959585806 /nfs/dbraw/zinc/58/58/06/959585806.db2.gz FDHXIOSMNPRMCX-KGLIPLIRSA-N 2 0 242.407 2.300 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@@H](C)Cc1ccccc1Cl ZINC000309276433 959823591 /nfs/dbraw/zinc/82/35/91/959823591.db2.gz DVGGTMLYSYYFHR-QWRGUYRKSA-N 2 0 240.778 2.455 20 0 BEADRP CCCCC(CCCC)[N@@H+]1C[C@H](N)C[C@@H](O)C1 ZINC001246537074 972474681 /nfs/dbraw/zinc/47/46/81/972474681.db2.gz AYQSKEREGIMGIM-TZMCWYRMSA-N 2 0 242.407 2.129 20 0 BEADRP C[NH2+]CCNc1ccc2c(c1)[nH]c1cc[nH+]cc12 ZINC001167725985 960245215 /nfs/dbraw/zinc/24/52/15/960245215.db2.gz QGQYNKXJAYRBQB-UHFFFAOYSA-N 2 0 240.310 2.347 20 0 BEADRP C[NH2+]CCNc1cc[nH+]c2cc(C)ccc12 ZINC001167726373 960249104 /nfs/dbraw/zinc/24/91/04/960249104.db2.gz DGCGTTGEHOXVLD-UHFFFAOYSA-N 2 0 215.300 2.175 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCCC2(CC2)C1 ZINC000695765019 960443316 /nfs/dbraw/zinc/44/33/16/960443316.db2.gz SJMJIVGBCPSFMD-XQQFMLRXSA-N 2 0 222.376 2.426 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[NH2+][C@@H](C)C1)C1CCCC1 ZINC000709264531 960463683 /nfs/dbraw/zinc/46/36/83/960463683.db2.gz IFNUUSONVZECMX-GMXVVIOVSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@@H]1C[C@@H]([N@@H+]2CCC3(CCC3)C2)CC[NH2+]1 ZINC000709451157 960612958 /nfs/dbraw/zinc/61/29/58/960612958.db2.gz WRKZAKOIWTZMSD-NEPJUHHUSA-N 2 0 208.349 2.003 20 0 BEADRP [NH3+]CC[C@@H]1CC[N@H+](CCCOc2ccccc2)C1 ZINC000125535386 960836480 /nfs/dbraw/zinc/83/64/80/960836480.db2.gz IUMDFRGEPOEWNO-CQSZACIVSA-N 2 0 248.370 2.126 20 0 BEADRP CCCC[C@H](CC)C[N@@H+]1C[C@@H](C)[C@H]([NH3+])C1 ZINC000300048482 960873834 /nfs/dbraw/zinc/87/38/34/960873834.db2.gz KMWXUIZMOBEUDE-FRRDWIJNSA-N 2 0 212.381 2.482 20 0 BEADRP CC(C)CC[C@H](C)[NH+]1CC2(C1)CCC[NH2+]C2 ZINC000709791084 961578927 /nfs/dbraw/zinc/57/89/27/961578927.db2.gz SXFNENHRJUTLEF-ZDUSSCGKSA-N 2 0 224.392 2.497 20 0 BEADRP [NH3+]CCCCCCC[NH2+][C@H]1C[C@H]2C[C@H]2C1 ZINC001167909580 961812914 /nfs/dbraw/zinc/81/29/14/961812914.db2.gz OLHOGIVDZGFZQP-ITGUQSILSA-N 2 0 210.365 2.284 20 0 BEADRP C[NH+](C)CC1CCC([NH2+][C@H]2C[C@H]3C[C@H]3C2)CC1 ZINC001167923449 961986183 /nfs/dbraw/zinc/98/61/83/961986183.db2.gz DMGLPQLPQLERQE-AFRBZQCXSA-N 2 0 236.403 2.495 20 0 BEADRP Cc1ccc(C[N@@H+]2CCCC[C@H](C[NH3+])C2)c(C)n1 ZINC001206631881 962128082 /nfs/dbraw/zinc/12/80/82/962128082.db2.gz BWVPQMKGLSCCGO-CQSZACIVSA-N 2 0 247.386 2.259 20 0 BEADRP C[N@H+](CCC[NH+]1CCCC1)[C@@H]1C[C@H]2C[C@H]2C1 ZINC001167941349 962196287 /nfs/dbraw/zinc/19/62/87/962196287.db2.gz XCQZPXFABNMXHQ-BTTYYORXSA-N 2 0 222.376 2.203 20 0 BEADRP C1C[C@H]2CC([NH+]3C[C@H]4CCCC[C@@H]4C3)C[C@@H]1[NH2+]2 ZINC000710749515 962457987 /nfs/dbraw/zinc/45/79/87/962457987.db2.gz RRUCPMGSFQACKQ-ARJVPZMDSA-N 2 0 234.387 2.391 20 0 BEADRP CC[C@H]1CCC[N@@H+]1C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000710790654 962472825 /nfs/dbraw/zinc/47/28/25/962472825.db2.gz FIWKPMFMTPGKME-FXJUQPSGSA-N 2 0 208.349 2.144 20 0 BEADRP Cc1c[nH+]c(N[C@H]2CCC[C@@H]([NH3+])C2)cc1C ZINC001154987724 962933281 /nfs/dbraw/zinc/93/32/81/962933281.db2.gz NBSALJLBFSGDHO-NEPJUHHUSA-N 2 0 219.332 2.380 20 0 BEADRP Cc1c[nH+]c(N[C@H]2CC[C@@H]3C[NH2+]C[C@@H]32)cc1C ZINC001155587678 963117743 /nfs/dbraw/zinc/11/77/43/963117743.db2.gz AJPBCKXFSRYKMF-AGIUHOORSA-N 2 0 231.343 2.108 20 0 BEADRP c1cc2c[nH+]c(N[C@H]3C[NH+]4CCC3CC4)cc2[nH]1 ZINC001155662599 963149173 /nfs/dbraw/zinc/14/91/73/963149173.db2.gz KUELEBCJHWDEAI-ZDUSSCGKSA-N 2 0 242.326 2.069 20 0 BEADRP CC(C)(C[NH2+][C@H]1CCC[C@@H]1C[NH3+])C(C)(F)F ZINC000696621529 963299595 /nfs/dbraw/zinc/29/95/95/963299595.db2.gz RJYLEFCIUUIXJE-ZJUUUORDSA-N 2 0 234.334 2.385 20 0 BEADRP Cc1c[nH+]c(NCC[C@@H]2CCC[N@@H+](C)C2)c(N)c1 ZINC001156390430 963330003 /nfs/dbraw/zinc/33/00/03/963330003.db2.gz YIYQILNQCXAXNK-LBPRGKRZSA-N 2 0 248.374 2.116 20 0 BEADRP CN(c1cc2[nH]ccc2c[nH+]1)[C@@]1(C)CCC[NH2+]C1 ZINC001156955281 963499441 /nfs/dbraw/zinc/49/94/41/963499441.db2.gz HTTZUJFNGAKFOF-AWEZNQCLSA-N 2 0 244.342 2.141 20 0 BEADRP CC[NH+](CC)CCCC[NH2+][C@H]1CCO[C@H](C)C1 ZINC001168072525 963606887 /nfs/dbraw/zinc/60/68/87/963606887.db2.gz SWNIQTKOQLWWNN-KGLIPLIRSA-N 2 0 242.407 2.266 20 0 BEADRP Cc1cccnc1C[N@H+](C)CC1CC[NH+](C)CC1 ZINC000093173490 963629269 /nfs/dbraw/zinc/62/92/69/963629269.db2.gz RKGDLLCBLMMRRG-UHFFFAOYSA-N 2 0 247.386 2.164 20 0 BEADRP CC(C)[C@@H](C)[N@H+](C)C[C@H]1CCCC[NH2+]C1 ZINC000697038390 963665759 /nfs/dbraw/zinc/66/57/59/963665759.db2.gz CJHIPYOXYNVMFA-OLZOCXBDSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H]1C[C@@H]([NH2+][C@H]2CC[C@@H]([NH+](C)C)CC2)CCO1 ZINC001168100452 963705168 /nfs/dbraw/zinc/70/51/68/963705168.db2.gz CRQOQLCAKZPSIV-XDQVBPFNSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@H]1C[C@H]([NH2+][C@H]2CC[C@@H]([NH+](C)C)CC2)CCO1 ZINC001168100449 963707032 /nfs/dbraw/zinc/70/70/32/963707032.db2.gz CRQOQLCAKZPSIV-IGQOVBAYSA-N 2 0 240.391 2.016 20 0 BEADRP Cc1[nH+]c(N2C[C@@H](C)[NH2+][C@@H](C)C2)cc2[nH]ccc21 ZINC001158178398 963820324 /nfs/dbraw/zinc/82/03/24/963820324.db2.gz PUTJGHOZAQVUSL-AOOOYVTPSA-N 2 0 244.342 2.058 20 0 BEADRP CCC[N@H+](CCC[NH+](C)C)[C@H]1CCO[C@@H](C)C1 ZINC001168141951 963847341 /nfs/dbraw/zinc/84/73/41/963847341.db2.gz KNPYWDCFKWTLDR-KBPBESRZSA-N 2 0 242.407 2.218 20 0 BEADRP Cc1c[nH+]c(NC(C)(C)CC[NH+](C)C)c(N)c1 ZINC001158760926 963917017 /nfs/dbraw/zinc/91/70/17/963917017.db2.gz RXJQTPFWZGIJHE-UHFFFAOYSA-N 2 0 236.363 2.114 20 0 BEADRP C[C@H](CC1CC1)[NH2+]CC[C@@H]1CCC[N@@H+]1C ZINC000822123674 963938622 /nfs/dbraw/zinc/93/86/22/963938622.db2.gz ABJLJEBALCUXQJ-YPMHNXCESA-N 2 0 210.365 2.249 20 0 BEADRP Cc1cc2[nH]ccc2c(N(C)C(C)(C)C[NH3+])[nH+]1 ZINC001159055790 963988415 /nfs/dbraw/zinc/98/84/15/963988415.db2.gz VQVPPBULBWFFAF-UHFFFAOYSA-N 2 0 232.331 2.045 20 0 BEADRP c1cc(=[NH+]C2=CCC[NH2+]CC2)cc2[nH]snc1-2 ZINC001159446745 964095387 /nfs/dbraw/zinc/09/53/87/964095387.db2.gz FTLPQFCHSMYXBU-UHFFFAOYSA-N 2 0 246.339 2.371 20 0 BEADRP C(Nc1ccc2c(c1)CC[NH2+]C2)=C1CC[NH2+]CC1 ZINC001159601106 964129023 /nfs/dbraw/zinc/12/90/23/964129023.db2.gz UCSWJNNBYXLTOA-UHFFFAOYSA-N 2 0 243.354 2.012 20 0 BEADRP [NH3+]Cc1ccccc1Nc1ccc2c(c1)C[NH2+]C2 ZINC001159735536 964170257 /nfs/dbraw/zinc/17/02/57/964170257.db2.gz VZAPOWLCFPROPH-UHFFFAOYSA-N 2 0 239.322 2.492 20 0 BEADRP CC(C)Oc1cc[nH+]c(NCC[C@@H](C)[NH3+])c1 ZINC001159772425 964172346 /nfs/dbraw/zinc/17/23/46/964172346.db2.gz BGKKFDJTDYHFPX-SNVBAGLBSA-N 2 0 223.320 2.018 20 0 BEADRP c1cc([C@H]2CC[NH2+]C2)ccc1NC1=C[NH2+]CCC1 ZINC001159776746 964189889 /nfs/dbraw/zinc/18/98/89/964189889.db2.gz HOOMDVYVQKALET-ZDUSSCGKSA-N 2 0 243.354 2.400 20 0 BEADRP C[NH+](C)C1CCC([NH2+]C2(C)CCOCC2)CC1 ZINC001168290395 964382984 /nfs/dbraw/zinc/38/29/84/964382984.db2.gz JRRXFWHKBMTYRX-UHFFFAOYSA-N 2 0 240.391 2.018 20 0 BEADRP C[NH+](C)C1CCC(n2cccc2CC[NH3+])CC1 ZINC001168304056 964397095 /nfs/dbraw/zinc/39/70/95/964397095.db2.gz NAMSKXKJNDMOLB-UHFFFAOYSA-N 2 0 235.375 2.035 20 0 BEADRP C[C@@H]1C[C@H](F)C[N@@H+]1C1CCC([NH+](C)C)CC1 ZINC001168313434 964420000 /nfs/dbraw/zinc/42/00/00/964420000.db2.gz CTAIUTUCLVFTOY-IALDZJHCSA-N 2 0 228.355 2.292 20 0 BEADRP CN(C)c1cc[nH+]c(NCC[C@H]2CCC[N@@H+]2C)c1 ZINC001160964341 964460563 /nfs/dbraw/zinc/46/05/63/964460563.db2.gz MAHVQSFFKXCLCB-GFCCVEGCSA-N 2 0 248.374 2.044 20 0 BEADRP CC(C)[C@@H]1C[C@@H]([NH2+]CC[C@@H](C)[NH+](C)C)CCO1 ZINC000697824950 964546565 /nfs/dbraw/zinc/54/65/65/964546565.db2.gz DKGLEQFJOPLZNX-RDBSUJKOSA-N 2 0 242.407 2.120 20 0 BEADRP CCC[C@H](C)C[NH2+]CC[C@@H](C)[NH+](C)C ZINC000697871973 964600118 /nfs/dbraw/zinc/60/01/18/964600118.db2.gz QGNXHFGYLYAAOF-NWDGAFQWSA-N 2 0 200.370 2.352 20 0 BEADRP C[C@@H](CC[NH2+]CC1CCCCC1)[NH+](C)C ZINC000697878821 964602950 /nfs/dbraw/zinc/60/29/50/964602950.db2.gz MIINVJFSJKYKFU-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP Cc1sccc1CNCC[C@@H](C)[NH+](C)C ZINC000697887109 964632554 /nfs/dbraw/zinc/63/25/54/964632554.db2.gz DGIKYJPBRCDTPM-SNVBAGLBSA-N 2 0 226.389 2.486 20 0 BEADRP Cc1ccsc1C[NH2+]CC[C@H](C)[NH+](C)C ZINC000697888964 964639588 /nfs/dbraw/zinc/63/95/88/964639588.db2.gz JXVPATZDHHQHOJ-NSHDSACASA-N 2 0 226.389 2.486 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)c1cscn1)C1CC[NH2+]CC1 ZINC000697892764 964652575 /nfs/dbraw/zinc/65/25/75/964652575.db2.gz QTYXYHZGBUOPDO-ZJUUUORDSA-N 2 0 239.388 2.182 20 0 BEADRP C(C1CC1)[NH+]1CCC([NH2+][C@H]2C[C@@H]2C2CC2)CC1 ZINC001168370742 964926515 /nfs/dbraw/zinc/92/65/15/964926515.db2.gz GCAHIJUXBHSNST-CABCVRRESA-N 2 0 234.387 2.249 20 0 BEADRP C[C@@]1([NH3+])C[C@H](Nc2ccc3c([nH+]2)CCCC3)C1 ZINC001162328124 964931060 /nfs/dbraw/zinc/93/10/60/964931060.db2.gz IWIYINYOGUKBHK-VDISTLRHSA-N 2 0 231.343 2.252 20 0 BEADRP Cc1cc2[nH+]ccn2cc1N[C@H]1CCC[C@@H]([NH3+])C1 ZINC001162400123 964958958 /nfs/dbraw/zinc/95/89/58/964958958.db2.gz GJZOCKBJBPKWDF-NEPJUHHUSA-N 2 0 244.342 2.325 20 0 BEADRP [NH3+][C@H]1CCC[C@@H](Nc2cccn3c[nH+]cc23)C1 ZINC001162404470 964962733 /nfs/dbraw/zinc/96/27/33/964962733.db2.gz MVTXCIDELWVRIS-WDEREUQCSA-N 2 0 230.315 2.016 20 0 BEADRP C[C@@H]1C[NH2+]CCC[C@@H]1CNc1cccc(C[NH3+])c1 ZINC001162457132 964985974 /nfs/dbraw/zinc/98/59/74/964985974.db2.gz MVMJKLZOJRRYGC-TZMCWYRMSA-N 2 0 247.386 2.193 20 0 BEADRP CCc1cc(NC[C@H]2CCC[NH2+]C[C@H]2C)cc[nH+]1 ZINC001162471977 964987191 /nfs/dbraw/zinc/98/71/91/964987191.db2.gz RZABEZOVYUPLGY-CHWSQXEVSA-N 2 0 247.386 2.114 20 0 BEADRP Cc1cc2[nH+]ccn2cc1NC[C@H]1C[NH2+][C@H](C)C1 ZINC001162556484 965047869 /nfs/dbraw/zinc/04/78/69/965047869.db2.gz FOPSVSRPIAWQIK-VXGBXAGGSA-N 2 0 244.342 2.053 20 0 BEADRP C[C@@H]1C[C@@H](CNc2ccccc2C(C)(C)[NH3+])C[NH2+]1 ZINC001162559977 965054434 /nfs/dbraw/zinc/05/44/34/965054434.db2.gz VIOGXZVXDUAGFU-VXGBXAGGSA-N 2 0 247.386 2.290 20 0 BEADRP C/C=C(\NC=[NH2+])n1c2ccccc2nc1[C@@H](C)[NH3+] ZINC001162759980 965153723 /nfs/dbraw/zinc/15/37/23/965153723.db2.gz VEHNKLKRXIEDEP-PXNHAVTGSA-N 2 0 243.314 2.071 20 0 BEADRP CC(C)[N@@H+]1CC[C@H](Nc2cccc(N)[nH+]2)[C@@H](C)C1 ZINC001163365412 965368932 /nfs/dbraw/zinc/36/89/32/965368932.db2.gz ZVKAJMURYHKZIO-RYUDHWBXSA-N 2 0 248.374 2.195 20 0 BEADRP C[C@@H]([NH2+]C(C1CC1)C1CC1)C1CC[NH2+]CC1 ZINC000400326434 965477585 /nfs/dbraw/zinc/47/75/85/965477585.db2.gz BMQRXAWDBMGHNP-SNVBAGLBSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]([NH2+]Cc1cccc(F)c1)C1CC[NH2+]CC1 ZINC000400362712 965480337 /nfs/dbraw/zinc/48/03/37/965480337.db2.gz QNYHNMMGEARGRA-LLVKDONJSA-N 2 0 236.334 2.303 20 0 BEADRP Cc1cc2[nH+]ccn2cc1N[C@@H](C)C[NH+](C)C ZINC001163777513 965582709 /nfs/dbraw/zinc/58/27/09/965582709.db2.gz XATIBQNVNSSEMQ-NSHDSACASA-N 2 0 232.331 2.005 20 0 BEADRP C[C@@H](C[NH+](C)C)Nc1ccc2c(N)cc[nH+]c2c1 ZINC001163783030 965590737 /nfs/dbraw/zinc/59/07/37/965590737.db2.gz XETIVEGAABZITI-JTQLQIEISA-N 2 0 244.342 2.179 20 0 BEADRP C[NH+](C)Cc1cccc(CNc2cc[nH+]cc2)c1 ZINC001163988192 965682289 /nfs/dbraw/zinc/68/22/89/965682289.db2.gz JVIUDRAPWPVUHY-UHFFFAOYSA-N 2 0 241.338 2.177 20 0 BEADRP Cc1c(F)cccc1C[N@@H+]1CCC[C@@H]([NH3+])CC1 ZINC001205093660 965717897 /nfs/dbraw/zinc/71/78/97/965717897.db2.gz DIPTWDYKOJHNRW-CYBMUJFWSA-N 2 0 236.334 2.447 20 0 BEADRP COc1cc[nH+]c(N2CCC[C@](C)(C[NH3+])CC2)c1 ZINC001164243131 965808270 /nfs/dbraw/zinc/80/82/70/965808270.db2.gz XIKHUJMBKWFLDG-AWEZNQCLSA-N 2 0 249.358 2.046 20 0 BEADRP COc1cccc(C[NH2+][C@H](C)C2CC[NH2+]CC2)c1 ZINC000400393461 965949364 /nfs/dbraw/zinc/94/93/64/965949364.db2.gz JJBYAAUBBCBCFK-GFCCVEGCSA-N 2 0 248.370 2.173 20 0 BEADRP COC1(C[NH2+][C@H]2CCC[C@H]([NH+](C)C)C2)CCC1 ZINC000715202149 965950997 /nfs/dbraw/zinc/95/09/97/965950997.db2.gz NKDDMZPTKKPWIG-STQMWFEESA-N 2 0 240.391 2.018 20 0 BEADRP CN(CC[NH+]1CCCC1)c1[nH+]ccc2[nH]ccc21 ZINC001165139923 965969223 /nfs/dbraw/zinc/96/92/23/965969223.db2.gz NXJHBQQVEKTXDI-UHFFFAOYSA-N 2 0 244.342 2.095 20 0 BEADRP C[N@@H+]1CCC[C@@H](CCNc2cccc(C[NH3+])c2)C1 ZINC001165279823 966025470 /nfs/dbraw/zinc/02/54/70/966025470.db2.gz ZDLHMHYNRSEKCZ-ZDUSSCGKSA-N 2 0 247.386 2.289 20 0 BEADRP [NH3+][C@@H]1[C@H]2C[N@@H+](CCCCCc3ccccc3)C[C@H]21 ZINC001235209513 966029719 /nfs/dbraw/zinc/02/97/19/966029719.db2.gz AXYWWWAZLVSHCG-ZSHCYNCHSA-N 2 0 244.382 2.288 20 0 BEADRP CCCCCC[N@H+]1C[C@H]2CC[C@@H](C1)[C@@H]2[NH3+] ZINC001235959473 966177832 /nfs/dbraw/zinc/17/78/32/966177832.db2.gz QAYPAFKUOHWDEZ-CLLJXQQHSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@H](C[NH+]1CC(C)(C[NH3+])C1)c1ccccc1 ZINC001206711033 966184311 /nfs/dbraw/zinc/18/43/11/966184311.db2.gz DHKMLZKWPXIWKI-GFCCVEGCSA-N 2 0 218.344 2.071 20 0 BEADRP CC1=C[C@@H](C)[C@H](C[NH+]2CC(C)(C[NH3+])C2)CC1 ZINC001206711326 966196977 /nfs/dbraw/zinc/19/69/77/966196977.db2.gz IOANHGYCDOROCD-OLZOCXBDSA-N 2 0 222.376 2.259 20 0 BEADRP Fc1ccccc1C[N@H+]1C[C@@H]2CC[NH2+]CC[C@@H]2C1 ZINC001236314899 966367088 /nfs/dbraw/zinc/36/70/88/966367088.db2.gz SGRLQVSAEMMTJJ-BETUJISGSA-N 2 0 248.345 2.257 20 0 BEADRP CC[C@@H]1CC[C@H](C)[N@@H+]1CCC[NH2+]C1CC1 ZINC000136085590 966373521 /nfs/dbraw/zinc/37/35/21/966373521.db2.gz BPMBZLJZZDIQJM-WCQYABFASA-N 2 0 210.365 2.391 20 0 BEADRP C[NH+]1CCC2(C[NH+](Cc3ccsc3)C2)CC1 ZINC001204042647 966865277 /nfs/dbraw/zinc/86/52/77/966865277.db2.gz KHAVMYNSBRGEHQ-UHFFFAOYSA-N 2 0 236.384 2.276 20 0 BEADRP CC[N@H+](C)C1CCN(Cc2ccc(O)cc2)CC1 ZINC001204098849 966895040 /nfs/dbraw/zinc/89/50/40/966895040.db2.gz KXONBSXJLQUZRZ-UHFFFAOYSA-N 2 0 248.370 2.308 20 0 BEADRP C[NH+](C)C1CCC([NH2+]CC2CC(F)(F)C2)CC1 ZINC000715500642 966919004 /nfs/dbraw/zinc/91/90/04/966919004.db2.gz KTEPSXIRDFCPHJ-UHFFFAOYSA-N 2 0 246.345 2.494 20 0 BEADRP CCC1(Nc2ccc(C3([NH3+])CCC3)cc2)C[NH2+]C1 ZINC001168582890 966927763 /nfs/dbraw/zinc/92/77/63/966927763.db2.gz BOFMNLGTWRKTAC-UHFFFAOYSA-N 2 0 245.370 2.188 20 0 BEADRP C[NH+](C)[C@H]1CCCC[C@@H]1Nc1cccc(C[NH3+])c1 ZINC001168601019 966965449 /nfs/dbraw/zinc/96/54/49/966965449.db2.gz GRDXRAVTNXJSBI-GJZGRUSLSA-N 2 0 247.386 2.430 20 0 BEADRP Cc1cc(N[C@H]2CCCC[C@@H]2[NH+](C)C)cc(C)[nH+]1 ZINC001168600987 966969609 /nfs/dbraw/zinc/96/96/09/966969609.db2.gz GGNCBDWGVSKKFY-GJZGRUSLSA-N 2 0 247.386 2.405 20 0 BEADRP Cc1cc(C[NH+]2CC3(C2)CC[NH+](C)CC3)oc1C ZINC001204539091 967043797 /nfs/dbraw/zinc/04/37/97/967043797.db2.gz LFAXTPOYSRZNQD-UHFFFAOYSA-N 2 0 248.370 2.424 20 0 BEADRP CCCC[C@H](CC)C[N@@H+]1CCO[C@H](CC[NH3+])C1 ZINC001204748757 967144875 /nfs/dbraw/zinc/14/48/75/967144875.db2.gz SYTXQQLRBHCOHR-UONOGXRCSA-N 2 0 242.407 2.252 20 0 BEADRP C[C@]1([NH3+])CCCN(Cc2ccc3c(c2)CCC3)C1 ZINC001204937597 967242114 /nfs/dbraw/zinc/24/21/14/967242114.db2.gz FVZKKZQTIJNIJX-INIZCTEOSA-N 2 0 244.382 2.489 20 0 BEADRP Cc1ccsc1CN1[C@@H](C)CC[C@H]1C[NH3+] ZINC001205064096 967313948 /nfs/dbraw/zinc/31/39/48/967313948.db2.gz HNEFBNRZNVSHQB-QWRGUYRKSA-N 2 0 224.373 2.368 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@H]([NH3+])CC2)c(C)n1 ZINC001205117127 967367381 /nfs/dbraw/zinc/36/73/81/967367381.db2.gz LGNSFOVESSWRPE-AWEZNQCLSA-N 2 0 233.359 2.012 20 0 BEADRP [NH3+][C@H]1CCC[N@H+](Cc2cccc3c2CCC3)CC1 ZINC001205131365 967375124 /nfs/dbraw/zinc/37/51/24/967375124.db2.gz WCCATBLSPLFULH-HNNXBMFYSA-N 2 0 244.382 2.489 20 0 BEADRP C[C@H]1C[N@H+](Cc2cccc3cc[nH]c32)C[C@H]1C[NH3+] ZINC001205145854 967389159 /nfs/dbraw/zinc/38/91/59/967389159.db2.gz KMYOHXGJAMLDLV-SMDDNHRTSA-N 2 0 243.354 2.195 20 0 BEADRP C[C@]1([NH3+])CCC[N@H+](CC2CCCC2)CC1 ZINC001205255086 967440323 /nfs/dbraw/zinc/44/03/23/967440323.db2.gz GJYSUNJZJUGJOC-ZDUSSCGKSA-N 2 0 210.365 2.380 20 0 BEADRP Cc1cncc(C[N@@H+]2CCC[C@@](C)([NH3+])CC2)c1 ZINC001205265248 967455448 /nfs/dbraw/zinc/45/54/48/967455448.db2.gz OZNKPHUCMMRIEO-CQSZACIVSA-N 2 0 233.359 2.093 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@@](C)([NH3+])CC2)nc1 ZINC001205273155 967466164 /nfs/dbraw/zinc/46/61/64/967466164.db2.gz GIKWPBGQAFHKAB-CQSZACIVSA-N 2 0 233.359 2.093 20 0 BEADRP C[N@H+]1CC=C(CC[NH+]2CCCCC2)CC1 ZINC001250241560 967551726 /nfs/dbraw/zinc/55/17/26/967551726.db2.gz GAFMDXMVVUUOAK-UHFFFAOYSA-N 2 0 208.349 2.124 20 0 BEADRP Cc1c[nH+]ccc1Nc1ccc2c[nH+]cn2c1 ZINC001250323544 967701923 /nfs/dbraw/zinc/70/19/23/967701923.db2.gz ZIAIOJZZOHFKIB-UHFFFAOYSA-N 2 0 224.267 2.203 20 0 BEADRP C[C@@H]1CC[N@H+](CC2CCCC2)CC[C@@H]1C[NH3+] ZINC001205603037 967719178 /nfs/dbraw/zinc/71/91/78/967719178.db2.gz NDLGWDRBHQXXMY-TZMCWYRMSA-N 2 0 224.392 2.483 20 0 BEADRP Cc1cc(C)c(C[N@H+]2CC[C@@H](C)[C@@H](C[NH3+])CC2)[nH]1 ZINC001205617710 967727067 /nfs/dbraw/zinc/72/70/67/967727067.db2.gz MPXODMMQUGBPDJ-BXUZGUMPSA-N 2 0 249.402 2.438 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@@H](C)[C@@H](C[NH3+])CC2)nc1 ZINC001205626752 967736005 /nfs/dbraw/zinc/73/60/05/967736005.db2.gz IVWSSYLWYITVOC-ZIAGYGMSSA-N 2 0 247.386 2.197 20 0 BEADRP C[C@H]1CC[N@H+](Cc2ccccc2N)CC[C@H]1C[NH3+] ZINC001205653356 967742542 /nfs/dbraw/zinc/74/25/42/967742542.db2.gz SVVZKTXARLWYFJ-STQMWFEESA-N 2 0 247.386 2.076 20 0 BEADRP C[C@H]1[C@H](C[NH3+])CCC[N@@H+]1CCC(C)(C)C ZINC001205902203 967874573 /nfs/dbraw/zinc/87/45/73/967874573.db2.gz IPVCJWQKXORWNY-RYUDHWBXSA-N 2 0 212.381 2.482 20 0 BEADRP CNc1ccc(C[N@@H+]2CCC[C@H](C[NH3+])[C@@H]2C)cc1 ZINC001205915859 967883771 /nfs/dbraw/zinc/88/37/71/967883771.db2.gz RBYAWNMQBBDWMW-GXTWGEPZSA-N 2 0 247.386 2.288 20 0 BEADRP CS[C@H](C)CC[N@@H+]1CCC[C@@H](C[NH3+])[C@@H](C)C1 ZINC001205981711 967898991 /nfs/dbraw/zinc/89/89/91/967898991.db2.gz FWRPTWBQSGLAHA-XQQFMLRXSA-N 2 0 244.448 2.435 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@H](C[NH3+])[C@@H](C)C2)cn1 ZINC001206003528 967960207 /nfs/dbraw/zinc/96/02/07/967960207.db2.gz IZYZPZBPWCOLCK-SWLSCSKDSA-N 2 0 247.386 2.197 20 0 BEADRP CSC1CC[NH+](C[C@H]2CCCC[NH2+]C2)CC1 ZINC000697057583 967989613 /nfs/dbraw/zinc/98/96/13/967989613.db2.gz KWAZJWHEHODNFS-LBPRGKRZSA-N 2 0 242.432 2.204 20 0 BEADRP C[C@]1(C[NH3+])CCC[N@H+](Cc2ccoc2)CC1 ZINC001206296742 968205566 /nfs/dbraw/zinc/20/55/66/968205566.db2.gz UJMJKAYXENEDJQ-ZDUSSCGKSA-N 2 0 222.332 2.231 20 0 BEADRP Cc1ncccc1C[N@@H+]1CCC[C@](C)(C[NH3+])CC1 ZINC001206304621 968210259 /nfs/dbraw/zinc/21/02/59/968210259.db2.gz NLYMULMZDJNRMT-HNNXBMFYSA-N 2 0 247.386 2.341 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@H]1CCc2ccccc2C1 ZINC001331820729 968245869 /nfs/dbraw/zinc/24/58/69/968245869.db2.gz ILULFXUGRZWWIP-WFASDCNBSA-N 2 0 232.371 2.132 20 0 BEADRP Cc1cccc(C[N@@H+]2CCCC[C@@](C)(C[NH3+])C2)n1 ZINC001206542319 968368825 /nfs/dbraw/zinc/36/88/25/968368825.db2.gz YFTYPBRCYXAIHO-HNNXBMFYSA-N 2 0 247.386 2.341 20 0 BEADRP CC[NH+]1CCC(C[NH+]2CC(CC3CC3)C2)CC1 ZINC001206780466 968455198 /nfs/dbraw/zinc/45/51/98/968455198.db2.gz PRFUMDACSGAPAO-UHFFFAOYSA-N 2 0 236.403 2.450 20 0 BEADRP C[NH2+][C@@]12CC[C@@]([NH2+]CCC3CC3)(C1)CCC2 ZINC001276514325 968688654 /nfs/dbraw/zinc/68/86/54/968688654.db2.gz YERZOSIFMFBXHV-UONOGXRCSA-N 2 0 222.376 2.441 20 0 BEADRP C[NH+](C)CC(C)(C)C[N@H+]1C[C@H]2[C@H](CC2(F)F)C1 ZINC001207279591 968711144 /nfs/dbraw/zinc/71/11/44/968711144.db2.gz LPOUMTOXWRQDFE-MNOVXSKESA-N 2 0 246.345 2.161 20 0 BEADRP C[NH+](C)CC(C)(C)C[N@H+](C)CCc1ccncc1 ZINC001207285182 968715692 /nfs/dbraw/zinc/71/56/92/968715692.db2.gz BQVYZNDOUAKXTE-UHFFFAOYSA-N 2 0 249.402 2.144 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2CC[C@@H]3CCC[C@@H]3C2)CC1 ZINC001207395511 968749507 /nfs/dbraw/zinc/74/95/07/968749507.db2.gz SHCHXBZWVTZPKJ-LSDHHAIUSA-N 2 0 236.403 2.450 20 0 BEADRP C(C1CC[NH2+]CC1)[NH+]1CC2CCC(CC2)C1 ZINC001207441189 968772326 /nfs/dbraw/zinc/77/23/26/968772326.db2.gz VXOGHLBFXOWRED-UHFFFAOYSA-N 2 0 222.376 2.108 20 0 BEADRP CC[C@H](C)[N@H+](C)CCC1CC[NH+](C)CC1 ZINC001207482592 968776947 /nfs/dbraw/zinc/77/69/47/968776947.db2.gz YNMUIAQWGKIDJP-LBPRGKRZSA-N 2 0 212.381 2.449 20 0 BEADRP CC(C)C[N@H+](C)CCC1CC[NH+](C)CC1 ZINC001207479037 968792391 /nfs/dbraw/zinc/79/23/91/968792391.db2.gz BGBARZDSWFITFP-UHFFFAOYSA-N 2 0 212.381 2.306 20 0 BEADRP C[NH+]1CCC(CC[NH+]2C[C@@H]3CCC[C@H]3C2)CC1 ZINC001207480200 968798664 /nfs/dbraw/zinc/79/86/64/968798664.db2.gz WUBAJAZFTHGDKS-GJZGRUSLSA-N 2 0 236.403 2.450 20 0 BEADRP C[NH+](C)CC1CC[NH+](C[C@@H]2C[C@H]3C=C[C@@H]2C3)CC1 ZINC001207627285 968846142 /nfs/dbraw/zinc/84/61/42/968846142.db2.gz VELBGVRDMHUOEX-XHSDSOJGSA-N 2 0 248.414 2.472 20 0 BEADRP CC[C@H](C)[C@@H](C)[NH2+]C[C@@H]1C[NH+]2CCC1CC2 ZINC001207723695 968868073 /nfs/dbraw/zinc/86/80/73/968868073.db2.gz MUPSPEHMLSTJOB-OUCADQQQSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1C[C@@H](CNc2ccc3c([nH+]2)CCCC3)C[NH2+]1 ZINC001155101385 968893298 /nfs/dbraw/zinc/89/32/98/968893298.db2.gz WFFRNFQUVFTLCI-VXGBXAGGSA-N 2 0 245.370 2.370 20 0 BEADRP CCCC[C@H](C)[NH2+][C@@H]1CC[C@@H]2C[N@H+](C)C[C@@H]12 ZINC001207836121 968897473 /nfs/dbraw/zinc/89/74/73/968897473.db2.gz GUTOINZQDWKYHI-REWJHTLYSA-N 2 0 224.392 2.495 20 0 BEADRP CCC[C@@H](O)C[NH2+][C@@H](C)CCC[NH+](CC)CC ZINC001252801007 968986305 /nfs/dbraw/zinc/98/63/05/968986305.db2.gz SFFNUVSRVUWLTL-UONOGXRCSA-N 2 0 244.423 2.248 20 0 BEADRP C[N@H+](CC1(C)CC[NH+](C)CC1)C1CC(F)(F)C1 ZINC001208105648 969002570 /nfs/dbraw/zinc/00/25/70/969002570.db2.gz YQKLVROJHWBQLX-UHFFFAOYSA-N 2 0 246.345 2.448 20 0 BEADRP C[N@@H+]1CCC=C(c2cccc3cncn32)C1 ZINC001241570108 969064725 /nfs/dbraw/zinc/06/47/25/969064725.db2.gz DIKDMDFHUQMLHF-UHFFFAOYSA-N 2 0 213.284 2.053 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2C[C@@H]3C[C@@H]3[C@@H](F)C2)CC1 ZINC001208592302 969145669 /nfs/dbraw/zinc/14/56/69/969145669.db2.gz HIYRMEPPADRBLZ-IHRRRGAJSA-N 2 0 240.366 2.008 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2C[C@@H]3C[C@@H]3[C@H](F)C2)CC1 ZINC001208592308 969145718 /nfs/dbraw/zinc/14/57/18/969145718.db2.gz HIYRMEPPADRBLZ-MELADBBJSA-N 2 0 240.366 2.008 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2CC[C@H](C)C2)CC1 ZINC001208592894 969149412 /nfs/dbraw/zinc/14/94/12/969149412.db2.gz LWUNOXNJKQDWSO-LBPRGKRZSA-N 2 0 210.365 2.060 20 0 BEADRP CC[NH+]1CCC(C[N@H+](C)CCSC)CC1 ZINC001208603262 969149461 /nfs/dbraw/zinc/14/94/61/969149461.db2.gz YFSPCNUAVGWAIM-UHFFFAOYSA-N 2 0 230.421 2.013 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2CCn3cccc3C2)CC1 ZINC001208599971 969151799 /nfs/dbraw/zinc/15/17/99/969151799.db2.gz NIOKYVMSCIGIIZ-UHFFFAOYSA-N 2 0 247.386 2.036 20 0 BEADRP CC[NH+]1CCC(C[N@H+](C)CC2CCC2)CC1 ZINC001208599414 969151860 /nfs/dbraw/zinc/15/18/60/969151860.db2.gz HDSPAVYJUACGLF-UHFFFAOYSA-N 2 0 224.392 2.450 20 0 BEADRP C[N@H+](C[C@H]1CC1(C)C)C[C@@H]1CCC[NH+](C)C1 ZINC001208607572 969161797 /nfs/dbraw/zinc/16/17/97/969161797.db2.gz DDHQDWOCYUXIQC-CHWSQXEVSA-N 2 0 224.392 2.306 20 0 BEADRP CCC[NH+]1C[C@@H]2C[NH+](CCC3CC3)C[C@H]2C1 ZINC001208687128 969195593 /nfs/dbraw/zinc/19/55/93/969195593.db2.gz PRRQCDORRIQYAU-ZIAGYGMSSA-N 2 0 222.376 2.060 20 0 BEADRP Cc1cc(C[N@@H+]2CCC[C@H](C[NH3+])[C@H](C)C2)ccn1 ZINC001205991618 969210744 /nfs/dbraw/zinc/21/07/44/969210744.db2.gz BCMLJZUQJNZGKH-IUODEOHRSA-N 2 0 247.386 2.197 20 0 BEADRP Cc1cc(N(CC[NH3+])c2cccnc2)cc(C)[nH+]1 ZINC001168835729 969231917 /nfs/dbraw/zinc/23/19/17/969231917.db2.gz DPEVXJRTJRXGHK-UHFFFAOYSA-N 2 0 242.326 2.190 20 0 BEADRP CC(C)OCCC[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169098410 969389023 /nfs/dbraw/zinc/38/90/23/969389023.db2.gz HPIIGXYXKKDYJQ-ZSOGYDGISA-N 2 0 240.391 2.016 20 0 BEADRP CCC[C@@H](C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169099618 969392021 /nfs/dbraw/zinc/39/20/21/969392021.db2.gz CPXDLEUJNIEIRU-FVCCEPFGSA-N 2 0 210.365 2.390 20 0 BEADRP CCCOCCC[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169099486 969393250 /nfs/dbraw/zinc/39/32/50/969393250.db2.gz SYBTTWWTBOUXEW-BTTYYORXSA-N 2 0 240.391 2.018 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+][C@@H]1CCC(F)(F)C1)C2 ZINC001169081776 969404655 /nfs/dbraw/zinc/40/46/55/969404655.db2.gz WHIMNTJBEJATAL-KKOKHZNYSA-N 2 0 244.329 2.389 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]C[C@@H]1CC[C@@H](F)C1)C2 ZINC001169081537 969404767 /nfs/dbraw/zinc/40/47/67/969404767.db2.gz SRJIUSUQRHWHPA-XGFWRYKXSA-N 2 0 240.366 2.339 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]C[C@@H]1CCC[C@H]1F)C2 ZINC001169080379 969405231 /nfs/dbraw/zinc/40/52/31/969405231.db2.gz MWUXDOJWBLKYPA-QSLWVIQJSA-N 2 0 240.366 2.339 20 0 BEADRP CC(C)C[N@H+](C)[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169123853 969420518 /nfs/dbraw/zinc/42/05/18/969420518.db2.gz NFWFIHGJHDRVBL-ITGUQSILSA-N 2 0 210.365 2.199 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1C[C@@H]3CCC[C@H]3C1)C2 ZINC001169126544 969430363 /nfs/dbraw/zinc/43/03/63/969430363.db2.gz WCSDJRGANQPYBN-BTFPBAQTSA-N 2 0 234.387 2.344 20 0 BEADRP CC1(C)C[C@H](Nc2cc[nH+]cc2)C[C@@](C)(C[NH3+])C1 ZINC001169138652 969437113 /nfs/dbraw/zinc/43/71/13/969437113.db2.gz RYOFDORUCMPHAG-DZGCQCFKSA-N 2 0 247.386 2.459 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+][C@@H]1CC=CCC1)C2 ZINC001169115632 969452187 /nfs/dbraw/zinc/45/21/87/969452187.db2.gz LSDHQZBBRRRMPY-YIYPIFLZSA-N 2 0 220.360 2.310 20 0 BEADRP CC[NH+]1CCC([NH2+]CCCc2cccnc2)CC1 ZINC001169231328 969509052 /nfs/dbraw/zinc/50/90/52/969509052.db2.gz YDOYJFLKCBNGGU-UHFFFAOYSA-N 2 0 247.386 2.088 20 0 BEADRP [NH3+]CCC[C@H]1CCCC[N@@H+]([C@@H]2CCCOC2)C1 ZINC001254376269 969593177 /nfs/dbraw/zinc/59/31/77/969593177.db2.gz WSHQLFDGDASRQL-ZIAGYGMSSA-N 2 0 240.391 2.006 20 0 BEADRP CC[NH+](CC)Cc1ccc(-n2c[nH+]cc2N)cc1 ZINC001209822550 969640439 /nfs/dbraw/zinc/64/04/39/969640439.db2.gz LNVCPLRCZKRMSF-UHFFFAOYSA-N 2 0 244.342 2.296 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH2+][C@H]2CC[C@@H](F)CC2)CC1 ZINC001254496962 969657944 /nfs/dbraw/zinc/65/79/44/969657944.db2.gz BKNQMQOUYUNDFD-UPJWGTAASA-N 2 0 228.355 2.341 20 0 BEADRP C[N@@H+]1CCC[C@@H](Nc2cccc(C[NH3+])c2)CC1 ZINC001254500146 969661992 /nfs/dbraw/zinc/66/19/92/969661992.db2.gz GFKAUMZVRKFAOA-CYBMUJFWSA-N 2 0 233.359 2.042 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH2+][C@H]2CCc3ncccc32)CC1 ZINC001254506945 969676453 /nfs/dbraw/zinc/67/64/53/969676453.db2.gz DDUCEFOKQIXHGV-WFASDCNBSA-N 2 0 245.370 2.143 20 0 BEADRP Cc1cccc(C(=[NH2+])N[C@H]2CCC[N@@H+](C)CC2)c1 ZINC001254509087 969679989 /nfs/dbraw/zinc/67/99/89/969679989.db2.gz VWGMMSRFYFEABF-AWEZNQCLSA-N 2 0 245.370 2.394 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH+]2CCC(C)(F)CC2)CC1 ZINC001254516164 969691366 /nfs/dbraw/zinc/69/13/66/969691366.db2.gz JKXPPGKGGDFKLX-GFCCVEGCSA-N 2 0 228.355 2.295 20 0 BEADRP Cc1c[nH+]c(NCC[C@H]2CCC[NH2+]2)c2[nH]ccc21 ZINC001169562928 969759201 /nfs/dbraw/zinc/75/92/01/969759201.db2.gz LXHSXYWRBNKZRN-LLVKDONJSA-N 2 0 244.342 2.425 20 0 BEADRP CCC[N@H+](CCC[NH3+])C1Cc2ccccc2C1 ZINC001255011928 969841971 /nfs/dbraw/zinc/84/19/71/969841971.db2.gz HBSUYABCNUSASP-UHFFFAOYSA-N 2 0 232.371 2.215 20 0 BEADRP CC(C)([NH3+])C(C)(C)[NH2+]C1Cc2ccccc2C1 ZINC001255014662 969847342 /nfs/dbraw/zinc/84/73/42/969847342.db2.gz FTMHGRGCYYYOAR-UHFFFAOYSA-N 2 0 232.371 2.259 20 0 BEADRP Cc1c[nH+]c(NCC[C@H]2CCC[N@@H+](C)C2)cc1N ZINC001156388524 969872989 /nfs/dbraw/zinc/87/29/89/969872989.db2.gz LINICUZGBRRDAN-GFCCVEGCSA-N 2 0 248.374 2.116 20 0 BEADRP CC/C=C\CCC[N@@H+]1CC[NH2+][C@@H](C)CC1 ZINC001210474242 969898981 /nfs/dbraw/zinc/89/89/81/969898981.db2.gz FFHXXWUDPURPLT-ZFDPJTLLSA-N 2 0 210.365 2.417 20 0 BEADRP C[NH2+]CC1C[NH+](C[C@H]2CCC(C)=C[C@H]2C)C1 ZINC001210560884 969942330 /nfs/dbraw/zinc/94/23/30/969942330.db2.gz BNUHSIDPNVHUSM-TZMCWYRMSA-N 2 0 222.376 2.130 20 0 BEADRP [NH3+]CCc1cn([C@H]2CCSC2)c2cc[nH+]cc12 ZINC001255273691 970026698 /nfs/dbraw/zinc/02/66/98/970026698.db2.gz CZHBDXQDZBEHFH-NSHDSACASA-N 2 0 247.367 2.216 20 0 BEADRP CC1(C)CCC([NH2+]CCSCC[NH3+])CC1 ZINC001255301787 970066088 /nfs/dbraw/zinc/06/60/88/970066088.db2.gz QGPUVKOWIRBFAK-UHFFFAOYSA-N 2 0 230.421 2.237 20 0 BEADRP Cc1c2[nH+]c[nH]c2ccc1N(C)C(C)(C)C[NH3+] ZINC001170058913 970107743 /nfs/dbraw/zinc/10/77/43/970107743.db2.gz HPLAHGGCAXNCKC-UHFFFAOYSA-N 2 0 232.331 2.045 20 0 BEADRP C[NH2+]Cc1ccc(Nc2cc[nH+]cc2C)cc1 ZINC001211127455 970156583 /nfs/dbraw/zinc/15/65/83/970156583.db2.gz IUGTUNFBQXWXJX-UHFFFAOYSA-N 2 0 227.311 2.275 20 0 BEADRP CC1(Nc2cc3[nH]ccc3c[nH+]2)CC[NH2+]CC1 ZINC001157396647 970244293 /nfs/dbraw/zinc/24/42/93/970244293.db2.gz BZQAVTAIOMXBOP-UHFFFAOYSA-N 2 0 230.315 2.117 20 0 BEADRP CC1(C)C[C@@H]([NH2+]CCCCCCC[NH3+])CCO1 ZINC001255529680 970295058 /nfs/dbraw/zinc/29/50/58/970295058.db2.gz NXLDLULARALEDR-ZDUSSCGKSA-N 2 0 242.407 2.443 20 0 BEADRP CC1(C)C[C@H]([NH2+]CCCCCCC[NH3+])CCO1 ZINC001255529679 970295716 /nfs/dbraw/zinc/29/57/16/970295716.db2.gz NXLDLULARALEDR-CYBMUJFWSA-N 2 0 242.407 2.443 20 0 BEADRP C[C@H]1CC[C@H]([NH2+]CC[C@H]2CCC[N@@H+]2C)C1 ZINC001170114039 970330602 /nfs/dbraw/zinc/33/06/02/970330602.db2.gz ZTNXAKBDJYQRAY-RWMBFGLXSA-N 2 0 210.365 2.249 20 0 BEADRP COC[C@H](C)[NH+]1C(C)(C)CC([NH3+])CC1(C)C ZINC001255557445 970335549 /nfs/dbraw/zinc/33/55/49/970335549.db2.gz UGTPZWFLGYGURC-JTQLQIEISA-N 2 0 228.380 2.002 20 0 BEADRP COC[C@H](C)[NH2+][C@H]1CC(C)(C)C[C@@](C)(C[NH3+])C1 ZINC001255559968 970340935 /nfs/dbraw/zinc/34/09/35/970340935.db2.gz LAONCNLQOUOAPX-OBJOEFQTSA-N 2 0 242.407 2.155 20 0 BEADRP COCCC1([NH3+])CC[NH+]([C@H]2CC[C@H](C)C2)CC1 ZINC001170124280 970367686 /nfs/dbraw/zinc/36/76/86/970367686.db2.gz XARULVVURSTMBA-STQMWFEESA-N 2 0 240.391 2.005 20 0 BEADRP Cc1ccc(C[C@H](C)[NH2+]C[C@@H]2CC[N@H+](C)C2)cc1 ZINC001255773957 970479724 /nfs/dbraw/zinc/47/97/24/970479724.db2.gz SHSVAGDAKJAAGA-HOCLYGCPSA-N 2 0 246.398 2.467 20 0 BEADRP CCC[N@H+]1C[C@@H]2C[NH+]([C@@H]3CC[C@@H](C)C3)C[C@@H]2C1 ZINC001170159240 970487452 /nfs/dbraw/zinc/48/74/52/970487452.db2.gz RTQGBAPBCMRDDT-APIJFGDWSA-N 2 0 236.403 2.449 20 0 BEADRP CC[C@H]1C[C@H]([NH2+]CCCCC[NH+](C)C)CCO1 ZINC001170170661 970546436 /nfs/dbraw/zinc/54/64/36/970546436.db2.gz MZDCAQJSYAYTBR-KGLIPLIRSA-N 2 0 242.407 2.266 20 0 BEADRP C[NH2+]C1CC[NH+](C[C@H]2CC3CCC2CC3)CC1 ZINC000400124193 970549180 /nfs/dbraw/zinc/54/91/80/970549180.db2.gz RAMXOWAWFSGAEZ-JXQTWKCFSA-N 2 0 236.403 2.497 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]C1CC(F)C1 ZINC001255940595 970568854 /nfs/dbraw/zinc/56/88/54/970568854.db2.gz DWCNAPJHOLCWNE-UNXYVOJBSA-N 2 0 216.344 2.197 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)c1ccccn1 ZINC000400317500 970572739 /nfs/dbraw/zinc/57/27/39/970572739.db2.gz ANFRKGIOBDOARF-NWDGAFQWSA-N 2 0 233.359 2.120 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]CCc1ccncc1 ZINC001255939737 970573146 /nfs/dbraw/zinc/57/31/46/970573146.db2.gz INTVIRGWSKGCIV-CQSZACIVSA-N 2 0 249.402 2.334 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)c1ccco1 ZINC000400325919 970573637 /nfs/dbraw/zinc/57/36/37/970573637.db2.gz AHZJFLDICDRAML-WDEREUQCSA-N 2 0 222.332 2.318 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]CCCCCCO ZINC001255943657 970578317 /nfs/dbraw/zinc/57/83/17/970578317.db2.gz PPOUGFNDVYFKCF-AWEZNQCLSA-N 2 0 244.423 2.249 20 0 BEADRP C[C@H]([NH2+]C1Cc2ccccc2C1)C1CC[NH2+]CC1 ZINC000400370790 970583359 /nfs/dbraw/zinc/58/33/59/970583359.db2.gz AIPCZCDBJPWMJV-LBPRGKRZSA-N 2 0 244.382 2.132 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)c1cccnc1 ZINC000400390767 970584434 /nfs/dbraw/zinc/58/44/34/970584434.db2.gz ZXEZDLLDEVCCJW-NWDGAFQWSA-N 2 0 233.359 2.120 20 0 BEADRP CC(C)[C@@H]([NH2+][C@H](C)C1CC[NH2+]CC1)C1CC1 ZINC000400433582 970589060 /nfs/dbraw/zinc/58/90/60/970589060.db2.gz LXPUYHRZHKZQFQ-BXUZGUMPSA-N 2 0 224.392 2.399 20 0 BEADRP CC(C)[C@@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)C1CC1 ZINC000400433585 970589186 /nfs/dbraw/zinc/58/91/86/970589186.db2.gz LXPUYHRZHKZQFQ-SMDDNHRTSA-N 2 0 224.392 2.399 20 0 BEADRP CC(C)[C@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)C1CC1 ZINC000400433583 970590266 /nfs/dbraw/zinc/59/02/66/970590266.db2.gz LXPUYHRZHKZQFQ-FZMZJTMJSA-N 2 0 224.392 2.399 20 0 BEADRP CC[C@@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)C(C)C ZINC000400451107 970593254 /nfs/dbraw/zinc/59/32/54/970593254.db2.gz ORCDOKUPSRDTCO-WCQYABFASA-N 2 0 212.381 2.399 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCC[C@H]1C)C1CC[NH2+]CC1 ZINC000400500186 970596719 /nfs/dbraw/zinc/59/67/19/970596719.db2.gz BVNWPNDAYIYWQZ-NQBHXWOUSA-N 2 0 210.365 2.153 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[N@@H+]1C[C@H]2[C@H](CF)[C@H]2C1 ZINC001255966000 970600991 /nfs/dbraw/zinc/60/09/91/970600991.db2.gz IYDYPDMOSBLEIG-XDQVBPFNSA-N 2 0 242.382 2.254 20 0 BEADRP CC[NH+](CC)CC[C@H](C)n1ccc2c1CC[NH2+]C2 ZINC001255972342 970606872 /nfs/dbraw/zinc/60/68/72/970606872.db2.gz PSDRFQSBJITPBX-ZDUSSCGKSA-N 2 0 249.402 2.427 20 0 BEADRP C(CC1CCC1)[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000400961326 970649437 /nfs/dbraw/zinc/64/94/37/970649437.db2.gz ISLRZWQQFPOTBT-MGPQQGTHSA-N 2 0 222.376 2.154 20 0 BEADRP C[C@@H]1CCC[N@@H+](C2CCN(C)CC2)C[C@H]1C ZINC001256202664 970705723 /nfs/dbraw/zinc/70/57/23/970705723.db2.gz KIUSKNXULFYMNS-CHWSQXEVSA-N 2 0 224.392 2.449 20 0 BEADRP CN1CCC([N@@H+]2CCC[C@H]2c2ccccn2)CC1 ZINC001256207222 970714073 /nfs/dbraw/zinc/71/40/73/970714073.db2.gz CXEPKBPVBASMRA-HNNXBMFYSA-N 2 0 245.370 2.313 20 0 BEADRP CCCCCC[C@H](CC)[N@@H+]1C[C@H](N)C[C@H](O)C1 ZINC001246542446 972576585 /nfs/dbraw/zinc/57/65/85/972576585.db2.gz QIPSQXLMDLGGSY-RDBSUJKOSA-N 2 0 242.407 2.129 20 0 BEADRP C[C@@H](Cc1ccccc1F)N1CC[C@@H]([NH3+])[C@H]1C ZINC001246549629 972694881 /nfs/dbraw/zinc/69/48/81/972694881.db2.gz LMVOOJSIJGUNNK-MISXGVKJSA-N 2 0 236.334 2.178 20 0 BEADRP C[C@H](C[C@H]1CCCCC[NH2+]1)[NH2+]C1(C)CC1 ZINC001327837748 972747212 /nfs/dbraw/zinc/74/72/12/972747212.db2.gz BKAPGOSCLNPDDR-VXGBXAGGSA-N 2 0 210.365 2.439 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H](C)CCCc1cccnc1 ZINC001327840122 972754099 /nfs/dbraw/zinc/75/40/99/972754099.db2.gz MSBNIDSBLMMHAO-ZIAGYGMSSA-N 2 0 249.402 2.380 20 0 BEADRP C[C@@H](CC1CC1)[N@@H+]1CCC[C@@H](C[NH3+])[C@H](C)C1 ZINC001246566895 972817210 /nfs/dbraw/zinc/81/72/10/972817210.db2.gz JVMNQNOJMLNGTE-DYEKYZERSA-N 2 0 224.392 2.482 20 0 BEADRP C[C@@]1(C[NH3+])CCC[N@@H+](C2CCSCC2)CC1 ZINC001246577306 972882646 /nfs/dbraw/zinc/88/26/46/972882646.db2.gz NYRMYENGDNOGEQ-CYBMUJFWSA-N 2 0 242.432 2.333 20 0 BEADRP C[C@]1(C[NH3+])CCCC[N@@H+]([C@H]2CCCSC2)C1 ZINC001246583910 972953138 /nfs/dbraw/zinc/95/31/38/972953138.db2.gz LRGMKILJWLNENE-QWHCGFSZSA-N 2 0 242.432 2.333 20 0 BEADRP C[C@@H]1CC[C@H](C[NH3+])C[N@@H+]1[C@@H]1C[C@@H]2[C@H](C1)C2(C)C ZINC001246594970 973002032 /nfs/dbraw/zinc/00/20/32/973002032.db2.gz WWVVEEDDQJDVLW-KSTCHIGDSA-N 2 0 236.403 2.480 20 0 BEADRP CCCCCC[C@H](C)[N@H+]1C[C@@H]2[C@@H]([NH3+])[C@@H]2C1 ZINC001246660527 973076376 /nfs/dbraw/zinc/07/63/76/973076376.db2.gz UWBIDIIGXDPMIA-WUHRBBMRSA-N 2 0 210.365 2.234 20 0 BEADRP CCCC[N@H+](CCC)[C@@H]1CSC2(C[NH2+]C2)C1 ZINC001246776641 973088798 /nfs/dbraw/zinc/08/87/98/973088798.db2.gz LLVZMLLBBDKXBS-LBPRGKRZSA-N 2 0 242.432 2.346 20 0 BEADRP CCCC[N@H+](CCC)[C@H]1CSC2(C[NH2+]C2)C1 ZINC001246776640 973091049 /nfs/dbraw/zinc/09/10/49/973091049.db2.gz LLVZMLLBBDKXBS-GFCCVEGCSA-N 2 0 242.432 2.346 20 0 BEADRP CC1(C)CCC[C@H]([N@H+]2C[C@H]3C[NH2+]CC[C@@H]3C2)C1 ZINC001246848421 973147288 /nfs/dbraw/zinc/14/72/88/973147288.db2.gz VIAJSSHAJFGBNE-MCIONIFRSA-N 2 0 236.403 2.497 20 0 BEADRP CSC(C)(C)C[C@H](C)[N@@H+]1C[C@H]2CC[C@@]2([NH3+])C1 ZINC001246854703 973168997 /nfs/dbraw/zinc/16/89/97/973168997.db2.gz QQWKUJGHLLWIBQ-DMDPSCGWSA-N 2 0 242.432 2.330 20 0 BEADRP C1[NH2+][C@@H]2C[N@@H+](C3CCC4(CCCC4)CC3)C[C@@H]12 ZINC001246913960 973442869 /nfs/dbraw/zinc/44/28/69/973442869.db2.gz BQANWVOZPFQZJG-TZMCWYRMSA-N 2 0 234.387 2.393 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2C[C@H]3C[NH2+]C[C@H]32)CC(C)(C)C1 ZINC001246919605 973485071 /nfs/dbraw/zinc/48/50/71/973485071.db2.gz NPXLIWBUVIXESV-FVCCEPFGSA-N 2 0 222.376 2.105 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@@H]2C=CCCC2)CC1 ZINC000234315322 973526073 /nfs/dbraw/zinc/52/60/73/973526073.db2.gz AUCKYQAAKYRPOE-CYBMUJFWSA-N 2 0 208.349 2.027 20 0 BEADRP CCCC[C@H](C)N(CCOC)[C@@H]1CCC[NH2+]C1 ZINC001246927745 973541673 /nfs/dbraw/zinc/54/16/73/973541673.db2.gz IAJQVYWOROSQFF-UONOGXRCSA-N 2 0 242.407 2.266 20 0 BEADRP CC[NH+](CC)C[C@H](C)OCC1CC[NH+](C)CC1 ZINC001224449353 973653834 /nfs/dbraw/zinc/65/38/34/973653834.db2.gz FQYQRHSQLKJPOM-ZDUSSCGKSA-N 2 0 242.407 2.075 20 0 BEADRP CC[NH+](CC)C[C@@H](C)OCC1CC[NH+](C)CC1 ZINC001224449350 973654892 /nfs/dbraw/zinc/65/48/92/973654892.db2.gz FQYQRHSQLKJPOM-CYBMUJFWSA-N 2 0 242.407 2.075 20 0 BEADRP F[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)C1 ZINC001329499110 973800558 /nfs/dbraw/zinc/80/05/58/973800558.db2.gz ONQLGWRDYWNVCG-RQJABVFESA-N 2 0 240.366 2.484 20 0 BEADRP C[C@H]([NH3+])c1ccc(NC[C@H]2CCCC[NH2+]2)cc1 ZINC001171335066 973868171 /nfs/dbraw/zinc/86/81/71/973868171.db2.gz SALNNTWCWOUEHK-SMDDNHRTSA-N 2 0 233.359 2.260 20 0 BEADRP C[NH+]1C(C)(C)CC([NH2+]C2CC2)CC1(C)C ZINC001171617695 974112536 /nfs/dbraw/zinc/11/25/36/974112536.db2.gz PQRHJVHYBOKMNH-UHFFFAOYSA-N 2 0 210.365 2.390 20 0 BEADRP Cc1ccc(CC[C@H](C)[NH2+][C@@H]2C[C@H]2N)cc1 ZINC001171660654 974125070 /nfs/dbraw/zinc/12/50/70/974125070.db2.gz NNTRVHJGIUPZCV-IACUBPJLSA-N 2 0 218.344 2.005 20 0 BEADRP CCOCCC[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172099520 974344724 /nfs/dbraw/zinc/34/47/24/974344724.db2.gz JAMNPKOTZZTJDW-ZSOGYDGISA-N 2 0 240.391 2.018 20 0 BEADRP CSCCC[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172103100 974361959 /nfs/dbraw/zinc/36/19/59/974361959.db2.gz RVOAEWQSKWBUJH-XYYAHUGASA-N 2 0 242.432 2.344 20 0 BEADRP C[C@@H]([NH3+])c1ccn([C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)n1 ZINC001172106281 974365320 /nfs/dbraw/zinc/36/53/20/974365320.db2.gz OUWSTKBOCHXQDI-FVCCEPFGSA-N 2 0 248.374 2.091 20 0 BEADRP CC[C@@H](C)OCC[C@@H](C)[NH+]1CCC(C)([NH3+])CC1 ZINC001172327059 974535727 /nfs/dbraw/zinc/53/57/27/974535727.db2.gz CQBGYWPLZCMOAO-CHWSQXEVSA-N 2 0 242.407 2.393 20 0 BEADRP CC[C@H](C)OCC[C@H](C)[NH2+][C@@H]1CCC[C@@H]1[NH3+] ZINC001172326720 974536506 /nfs/dbraw/zinc/53/65/06/974536506.db2.gz BFXFVBIXDUZUOO-ZDEQEGDKSA-N 2 0 228.380 2.050 20 0 BEADRP CC[C@H](C)OCC[C@@H](C)[NH+]1CCC(C)([NH3+])CC1 ZINC001172327060 974537541 /nfs/dbraw/zinc/53/75/41/974537541.db2.gz CQBGYWPLZCMOAO-OLZOCXBDSA-N 2 0 242.407 2.393 20 0 BEADRP CCC[N@H+](CCC[NH+](C)C)[C@H]1COC(C)(C)C1 ZINC001172295211 974566495 /nfs/dbraw/zinc/56/64/95/974566495.db2.gz QYDWJSGJXCHHNR-CYBMUJFWSA-N 2 0 242.407 2.218 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H](C)CCOCC)CC1 ZINC001172407880 974665300 /nfs/dbraw/zinc/66/53/00/974665300.db2.gz BZZXBOHOJUZKLU-CYBMUJFWSA-N 2 0 242.407 2.266 20 0 BEADRP CCOCC[C@H](C)[NH2+]CC1CC[NH+](CC)CC1 ZINC001172409762 974670379 /nfs/dbraw/zinc/67/03/79/974670379.db2.gz BNLTYIBWNHUYSR-ZDUSSCGKSA-N 2 0 242.407 2.123 20 0 BEADRP CCOCC[C@@H](C)[NH2+]CCC[NH+]1CCCCC1 ZINC001172412261 974677124 /nfs/dbraw/zinc/67/71/24/974677124.db2.gz SALFPIHUTPONMF-CQSZACIVSA-N 2 0 242.407 2.267 20 0 BEADRP CCOCC[C@@H](C)[NH2+]C1CCC(CC[NH3+])CC1 ZINC001172414201 974680406 /nfs/dbraw/zinc/68/04/06/974680406.db2.gz FBUFGGOXGBFMEZ-IYXRBSQSSA-N 2 0 242.407 2.299 20 0 BEADRP CC1([NH2+]Cc2ccc3c(c2)CCC3)CC[NH2+]CC1 ZINC001331419174 974712406 /nfs/dbraw/zinc/71/24/06/974712406.db2.gz OAGYSWLOZDTWIG-UHFFFAOYSA-N 2 0 244.382 2.407 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]Cc1cncc2ccccc21 ZINC001331420131 974712541 /nfs/dbraw/zinc/71/25/41/974712541.db2.gz UWBLNHPJIBERKB-GFCCVEGCSA-N 2 0 243.354 2.322 20 0 BEADRP CC(C)OCC[C@@H](C)[NH2+]CC1CC[NH+](C)CC1 ZINC001172431264 974713042 /nfs/dbraw/zinc/71/30/42/974713042.db2.gz MKCSAMYKCXXADE-CYBMUJFWSA-N 2 0 242.407 2.121 20 0 BEADRP CC(C)OCC[C@H](C)[NH2+]CC[C@@H]1CCC[N@@H+]1C ZINC001172447467 974810127 /nfs/dbraw/zinc/81/01/27/974810127.db2.gz IHOPEHQWXLYPJK-KBPBESRZSA-N 2 0 242.407 2.264 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@H]([NH2+]Cc3ccccc3)[C@@H]2C1 ZINC001204089098 974865211 /nfs/dbraw/zinc/86/52/11/974865211.db2.gz KSBIZZKVSZCIAG-ZNMIVQPWSA-N 2 0 230.355 2.116 20 0 BEADRP C[C@@H]1CC[C@H]1[NH2+][C@@H]1CC[NH2+]C12CCCC2 ZINC001332421407 975094718 /nfs/dbraw/zinc/09/47/18/975094718.db2.gz PREMKJCDHOMIFY-IJLUTSLNSA-N 2 0 208.349 2.049 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+][C@@H]1CC[NH2+]C12CCCC2 ZINC001332421406 975108802 /nfs/dbraw/zinc/10/88/02/975108802.db2.gz PREMKJCDHOMIFY-GRYCIOLGSA-N 2 0 208.349 2.049 20 0 BEADRP C(C1CCC1)[N@@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001332424678 975113992 /nfs/dbraw/zinc/11/39/92/975113992.db2.gz PFSMKABAVRIMSD-UHFFFAOYSA-N 2 0 222.376 2.252 20 0 BEADRP CC[C@@H](C)[N@@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001332425194 975114975 /nfs/dbraw/zinc/11/49/75/975114975.db2.gz XBVLBKQYPGCYJH-GFCCVEGCSA-N 2 0 210.365 2.251 20 0 BEADRP CCSC[C@H](C)[NH2+]CCCCC[NH+](C)C ZINC001173293023 975167724 /nfs/dbraw/zinc/16/77/24/975167724.db2.gz VGBNJTYETQARGB-LBPRGKRZSA-N 2 0 232.437 2.450 20 0 BEADRP CCSC[C@H](C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001173292819 975169500 /nfs/dbraw/zinc/16/95/00/975169500.db2.gz RHGGAQYLFPGFIU-RVMXOQNASA-N 2 0 242.432 2.343 20 0 BEADRP CCSC[C@@H](C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001173292817 975170794 /nfs/dbraw/zinc/17/07/94/975170794.db2.gz RHGGAQYLFPGFIU-FVCCEPFGSA-N 2 0 242.432 2.343 20 0 BEADRP CC[C@H]1CC[C@@H]([N@@H+]2C[C@H]3CC[NH+](C)C[C@H]3C2)C1 ZINC001173278793 975235163 /nfs/dbraw/zinc/23/51/63/975235163.db2.gz FPGXTCFGWRPXFZ-LJISPDSOSA-N 2 0 236.403 2.449 20 0 BEADRP CCSC[C@@H](C)[NH2+]CCC[NH+](CC)CC ZINC001173284605 975244804 /nfs/dbraw/zinc/24/48/04/975244804.db2.gz HVIRZTCTVFKCFP-GFCCVEGCSA-N 2 0 232.437 2.450 20 0 BEADRP CCSC[C@H](C)[NH2+]CC1CC[NH+](CC)CC1 ZINC001173289344 975256170 /nfs/dbraw/zinc/25/61/70/975256170.db2.gz UPXWLRZTJURFJN-LBPRGKRZSA-N 2 0 244.448 2.450 20 0 BEADRP CC[N@@H+]1CC[C@@H](n2ccc3c2cccc3C[NH3+])C1 ZINC001173347545 975287622 /nfs/dbraw/zinc/28/76/22/975287622.db2.gz DPZSSQWTOJCQAF-CYBMUJFWSA-N 2 0 243.354 2.367 20 0 BEADRP CC[N@@H+]1CC[C@@H](n2cc(C[NH3+])c3ccccc32)C1 ZINC001173348858 975292362 /nfs/dbraw/zinc/29/23/62/975292362.db2.gz UHZTVIAADQJGJR-CYBMUJFWSA-N 2 0 243.354 2.367 20 0 BEADRP CC[N@@H+]1CC[C@@H](n2ccc3cccc(C[NH3+])c32)C1 ZINC001173356506 975313152 /nfs/dbraw/zinc/31/31/52/975313152.db2.gz DLTPIVQJKSDUKU-CQSZACIVSA-N 2 0 243.354 2.367 20 0 BEADRP c1cc(C[NH2+]CC[C@H]2CC[NH2+]C2)cc2c1CCC2 ZINC000258975640 975365385 /nfs/dbraw/zinc/36/53/85/975365385.db2.gz KQQDPFFRUQFEOD-CYBMUJFWSA-N 2 0 244.382 2.265 20 0 BEADRP CCC[C@@H](C)[N@@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC000429015166 976977713 /nfs/dbraw/zinc/97/77/13/976977713.db2.gz XGDYMJUCCIUBIY-CHWSQXEVSA-N 2 0 210.365 2.203 20 0 BEADRP Cc1cccc2c1[nH+]c(N)n2C1=CCC[N@@H+](C)C1 ZINC001175574403 977573599 /nfs/dbraw/zinc/57/35/99/977573599.db2.gz VCBQAEGGVGCHKQ-UHFFFAOYSA-N 2 0 242.326 2.103 20 0 BEADRP C[NH+](C)Cc1ccc(NC2=CCC[N@H+](C)C2)cc1 ZINC001175576764 977592107 /nfs/dbraw/zinc/59/21/07/977592107.db2.gz SQCLEPNLTPGCOQ-UHFFFAOYSA-N 2 0 245.370 2.380 20 0 BEADRP C[C@H]1COCC[N@H+](Cc2cc3c[nH+]ccc3[nH]2)C1 ZINC001232011411 977838535 /nfs/dbraw/zinc/83/85/35/977838535.db2.gz JXYKWSLOCMNGQH-LLVKDONJSA-N 2 0 245.326 2.031 20 0 BEADRP CC[N@H+](CCOC)Cc1cc2c[nH+]ccc2[nH]1 ZINC001232012340 977839786 /nfs/dbraw/zinc/83/97/86/977839786.db2.gz ZEUMCFCCOIUSLN-UHFFFAOYSA-N 2 0 233.315 2.031 20 0 BEADRP COC[C@H]1CCC[N@@H+]1Cc1cc2c[nH+]ccc2[nH]1 ZINC001232010853 977839799 /nfs/dbraw/zinc/83/97/99/977839799.db2.gz DZIMNEPUQPPAAS-CYBMUJFWSA-N 2 0 245.326 2.174 20 0 BEADRP CCC[N@H+](CCOC)Cc1cc2c[nH+]ccc2[nH]1 ZINC001232011431 977840136 /nfs/dbraw/zinc/84/01/36/977840136.db2.gz KIEYBSYBTZEPPC-UHFFFAOYSA-N 2 0 247.342 2.421 20 0 BEADRP COC1CC[NH+](Cc2cc3c[nH+]ccc3[nH]2)CC1 ZINC001232012244 977841028 /nfs/dbraw/zinc/84/10/28/977841028.db2.gz WQCSYFZBANFSDJ-UHFFFAOYSA-N 2 0 245.326 2.174 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CCCC(F)F)CC1(C)C ZINC001336776532 977948699 /nfs/dbraw/zinc/94/86/99/977948699.db2.gz GNNPKGVTQMANAT-JTQLQIEISA-N 2 0 234.334 2.494 20 0 BEADRP CC/C=C\CCC[N@@H+]1CC[NH2+]C[C@@H](C)C1 ZINC001206269519 978013464 /nfs/dbraw/zinc/01/34/64/978013464.db2.gz POKNZHHJIQSWKS-DSYXLKISSA-N 2 0 210.365 2.274 20 0 BEADRP C[C@H]1C[C@@H]([NH+]2CCCC2)CN1c1cc[nH+]cc1 ZINC001336908695 978050087 /nfs/dbraw/zinc/05/00/87/978050087.db2.gz GVRINRUBFFVBER-GXTWGEPZSA-N 2 0 231.343 2.145 20 0 BEADRP Cc1ccnc(N[C@@H]2CC[C@H]3C[N@@H+](C)C[C@H]32)c1 ZINC001337432179 978334804 /nfs/dbraw/zinc/33/48/04/978334804.db2.gz QNETWCAWPSZYDO-YNEHKIRRSA-N 2 0 231.343 2.142 20 0 BEADRP Cc1cc(F)cc(N[C@@H]2CC[C@H]3C[N@@H+](C)C[C@@H]32)n1 ZINC001337431703 978336059 /nfs/dbraw/zinc/33/60/59/978336059.db2.gz LURLWJIBIUMBAM-WCFLWFBJSA-N 2 0 249.333 2.281 20 0 BEADRP Cc1cc(C[N@@H+]2CCC[C@](C)(C[NH3+])CC2)ccn1 ZINC001206305095 978384632 /nfs/dbraw/zinc/38/46/32/978384632.db2.gz SVCYLTSQBAEGFT-HNNXBMFYSA-N 2 0 247.386 2.341 20 0 BEADRP CN(CC[C@@H]1CCCC[N@@H+]1C)c1cc[nH+]cc1 ZINC001337710268 978471432 /nfs/dbraw/zinc/47/14/32/978471432.db2.gz SNKHOSSDMHCELL-ZDUSSCGKSA-N 2 0 233.359 2.392 20 0 BEADRP CCC[N@H+](CCC[NH3+])[C@@H]1CCC[C@H](OC)C1 ZINC000069846601 978763176 /nfs/dbraw/zinc/76/31/76/978763176.db2.gz QBEYDSJLKQOUCJ-OLZOCXBDSA-N 2 0 228.380 2.005 20 0 BEADRP c1cc(NC[C@H]2CCC[N@H+](CC3CC3)C2)cc[nH+]1 ZINC001339463825 978854940 /nfs/dbraw/zinc/85/49/40/978854940.db2.gz FLWVQARIYUYPAX-CQSZACIVSA-N 2 0 245.370 2.037 20 0 BEADRP CCN1CCC[C@@H]([NH2+]CC[C@@H]2CCCCO2)C1 ZINC001180311045 978855807 /nfs/dbraw/zinc/85/58/07/978855807.db2.gz WPDCZTDOKVJGGY-KGLIPLIRSA-N 2 0 240.391 2.020 20 0 BEADRP CC[NH+]1CCC(C[NH+]2C3CCC2CC3)CC1 ZINC001180524128 978895689 /nfs/dbraw/zinc/89/56/89/978895689.db2.gz WTJWPNYWCMIEAM-UHFFFAOYSA-N 2 0 222.376 2.345 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+][C@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC001340062644 978960517 /nfs/dbraw/zinc/96/05/17/978960517.db2.gz HIYWARVGHFWZQM-WYUUTHIRSA-N 2 0 210.365 2.281 20 0 BEADRP F[C@@H]1CCC[C@@H]([NH2+][C@H]2CC[NH2+]C23CCC3)C1 ZINC001340065400 978963509 /nfs/dbraw/zinc/96/35/09/978963509.db2.gz TYUYCBBEEQMATC-UTUOFQBUSA-N 2 0 226.339 2.141 20 0 BEADRP C[C@@H]1C[C@H]1C[N@@H+]1CCCC[C@]12CCC[NH2+]C2 ZINC001235176296 978989169 /nfs/dbraw/zinc/98/91/69/978989169.db2.gz ZYZGNYNNUMFXQZ-HZSPNIEDSA-N 2 0 222.376 2.251 20 0 BEADRP CC(C)(C)c1cccc(C[N@H+]2C[C@@H]3[C@@H]([NH3+])[C@@H]3C2)c1 ZINC001235210592 978998388 /nfs/dbraw/zinc/99/83/88/978998388.db2.gz NXGLQPKBJUXSKA-FICVDOATSA-N 2 0 244.382 2.373 20 0 BEADRP CCC[C@@H](C)C[N@@H+]1C[C@H]2CCC[NH2+][C@H]2C1 ZINC001235210330 979001145 /nfs/dbraw/zinc/00/11/45/979001145.db2.gz XXZBUSFFINEQTL-UPJWGTAASA-N 2 0 210.365 2.106 20 0 BEADRP [NH3+][C@@]12CCC[C@@H]1C[N@H+](C[C@H]1CC=CCC1)C2 ZINC001235240041 979004388 /nfs/dbraw/zinc/00/43/88/979004388.db2.gz KAVAMMOMVMXVKL-BFHYXJOUSA-N 2 0 220.360 2.156 20 0 BEADRP CCCC[C@@H](CC)C[N@H+]1C[C@@H]2[C@H]([NH3+])[C@@H]2C1 ZINC001235283252 979016922 /nfs/dbraw/zinc/01/69/22/979016922.db2.gz LUBSBRGFOTUZPH-FVCCEPFGSA-N 2 0 210.365 2.092 20 0 BEADRP C[C@@H](CC[N@H+]1C[C@@H]2[C@H]([NH3+])[C@@H]2C1)CC(C)(C)C ZINC001235284474 979017841 /nfs/dbraw/zinc/01/78/41/979017841.db2.gz XLWWUBYWJDUQTE-RVMXOQNASA-N 2 0 224.392 2.338 20 0 BEADRP CC(C)CCC[N@@H+]1CC[C@@]2(C1)C[NH2+]CC[C@H]2F ZINC001235410499 979041134 /nfs/dbraw/zinc/04/11/34/979041134.db2.gz YGCVCCVTOMHDNB-KGLIPLIRSA-N 2 0 242.382 2.446 20 0 BEADRP CC[NH2+]CCN1CCC[C@H](c2ccccc2)C1 ZINC001235666505 979110741 /nfs/dbraw/zinc/11/07/41/979110741.db2.gz SEHOWOMBHOSBMU-HNNXBMFYSA-N 2 0 232.371 2.476 20 0 BEADRP [NH3+]CCCC[N@@H+]1CCCC[C@H]1c1cccnc1 ZINC001235680249 979119421 /nfs/dbraw/zinc/11/94/21/979119421.db2.gz SJWYMJOLMIWVGF-AWEZNQCLSA-N 2 0 233.359 2.348 20 0 BEADRP CCCCCC[N@@H+]1CCCC2(C[NH2+]C2)C1 ZINC001235712034 979127317 /nfs/dbraw/zinc/12/73/17/979127317.db2.gz YFUFLKBDDMHOJK-UHFFFAOYSA-N 2 0 210.365 2.252 20 0 BEADRP [NH3+]CCCC[N@@H+]1CC[C@@H](Cc2ccccc2)C1 ZINC001235713440 979130730 /nfs/dbraw/zinc/13/07/30/979130730.db2.gz AHDANAPFQMAREO-HNNXBMFYSA-N 2 0 232.371 2.290 20 0 BEADRP Cc1cccc(C[N@@H+]2CCCC3(C[NH2+]C3)C2)c1C ZINC001235710817 979130859 /nfs/dbraw/zinc/13/08/59/979130859.db2.gz GMCWPOXLTCGFGG-UHFFFAOYSA-N 2 0 244.382 2.489 20 0 BEADRP [NH3+]CCCC[N@@H+]1CC[C@@H]1c1ccccc1 ZINC001235949850 979218499 /nfs/dbraw/zinc/21/84/99/979218499.db2.gz VAWUEZKPAQEHLN-CYBMUJFWSA-N 2 0 204.317 2.172 20 0 BEADRP C(CN1C[C@H]2CC[C@@H](C1)[NH2+]C2)C1CCCC1 ZINC001236059363 979349815 /nfs/dbraw/zinc/34/98/15/979349815.db2.gz GOPBURCXRVSBEE-KBPBESRZSA-N 2 0 222.376 2.251 20 0 BEADRP CCC(CC)C[N@@H+]1C[C@H]2CC[C@@H](C1)[NH2+]C2 ZINC001236061011 979354306 /nfs/dbraw/zinc/35/43/06/979354306.db2.gz URJXLTKJIYHOQG-STQMWFEESA-N 2 0 210.365 2.106 20 0 BEADRP CCC[C@@H](C)C[N@@H+]1C[C@H]2CC[C@@H](C1)[NH2+]C2 ZINC001236060421 979354406 /nfs/dbraw/zinc/35/44/06/979354406.db2.gz QDVLEQTXOQYKFW-AGIUHOORSA-N 2 0 210.365 2.106 20 0 BEADRP C[NH2+]C1CCC([N@H+](C)Cc2cccc(N)c2)CC1 ZINC001236215228 979453188 /nfs/dbraw/zinc/45/31/88/979453188.db2.gz LHSLHKATLJJSFA-UHFFFAOYSA-N 2 0 247.386 2.231 20 0 BEADRP c1csc(C[N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)c1 ZINC001236313978 979524492 /nfs/dbraw/zinc/52/44/92/979524492.db2.gz CVDKNLNWJUMPFF-TXEJJXNPSA-N 2 0 236.384 2.180 20 0 BEADRP CCc1ccc(C[N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)o1 ZINC001236317140 979529450 /nfs/dbraw/zinc/52/94/50/979529450.db2.gz UHJRTWMNLJUOPB-BETUJISGSA-N 2 0 248.370 2.273 20 0 BEADRP C[NH+](C)Cc1cccc(-c2cc(C[NH3+])ccn2)c1 ZINC001236416071 979589562 /nfs/dbraw/zinc/58/95/62/979589562.db2.gz YFFZKUANJPTCHH-UHFFFAOYSA-N 2 0 241.338 2.269 20 0 BEADRP C[C@@H]1C[C@H]1C[N@@H+]1CCCC[C@](C)(C[NH3+])C1 ZINC001206542133 979647973 /nfs/dbraw/zinc/64/79/73/979647973.db2.gz SEOUNJNWKIDIHM-FRRDWIJNSA-N 2 0 210.365 2.093 20 0 BEADRP C[C@@]1([NH3+])CCC[N@H+](CCc2ccccc2)CC1 ZINC001205257162 979754878 /nfs/dbraw/zinc/75/48/78/979754878.db2.gz SWFAARYPYKHJKR-OAHLLOKOSA-N 2 0 232.371 2.432 20 0 BEADRP CS[C@H](C)CC[N@@H+]1CC[C@H]2[NH2+]CCC[C@@H]2C1 ZINC001237383615 979881602 /nfs/dbraw/zinc/88/16/02/979881602.db2.gz QQAIOHKBXDQBBJ-JHJVBQTASA-N 2 0 242.432 2.202 20 0 BEADRP CC[C@H]([NH2+]C[C@H]1C[NH+]2CCC1CC2)C1CCC1 ZINC001184135096 979947803 /nfs/dbraw/zinc/94/78/03/979947803.db2.gz KRJMJUPTUZTPQY-GJZGRUSLSA-N 2 0 236.403 2.497 20 0 BEADRP C[NH+]1CCC(C[NH2+]C2CC3(CC3(F)F)C2)CC1 ZINC001343204401 980038353 /nfs/dbraw/zinc/03/83/53/980038353.db2.gz KUXQAUZHKKTJKW-UHFFFAOYSA-N 2 0 244.329 2.106 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+][C@@H]1CC[C@H]2C[N@H+](C)C[C@@H]21 ZINC001184386308 980057271 /nfs/dbraw/zinc/05/72/71/980057271.db2.gz BRKGZNJAWKPDFQ-HTVCTNPSSA-N 2 0 224.392 2.351 20 0 BEADRP Cc1ccc(O)cc1C[N@@H+](C)C1CCN(C)CC1 ZINC001238094662 980145977 /nfs/dbraw/zinc/14/59/77/980145977.db2.gz AMIPAMZALDEWQK-UHFFFAOYSA-N 2 0 248.370 2.227 20 0 BEADRP C([C@H]1CC2CCC1CC2)[N@@H+]1CC[C@@]2(CC[NH2+]C2)C1 ZINC000691659591 980379106 /nfs/dbraw/zinc/37/91/06/980379106.db2.gz GYRRWGCKKZFABC-QDIHITRGSA-N 2 0 248.414 2.498 20 0 BEADRP [NH3+]CC1CC[NH+](C[C@H]2CC3CCC2CC3)CC1 ZINC000691660057 980379998 /nfs/dbraw/zinc/37/99/98/980379998.db2.gz ISPFOYIOKLMCFJ-PESDSKBTSA-N 2 0 236.403 2.483 20 0 BEADRP [NH3+]CCC[N@@H+]1Cc2ccccc2C2(CCC2)C1 ZINC000334970131 980499982 /nfs/dbraw/zinc/49/99/82/980499982.db2.gz QBMKTMJWKHEVLC-UHFFFAOYSA-N 2 0 230.355 2.273 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]C[C@@H]1CCC[C@H](C)C1 ZINC001345105264 980545280 /nfs/dbraw/zinc/54/52/80/980545280.db2.gz RKBNYBXSZTVLTR-YNEHKIRRSA-N 2 0 212.381 2.400 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]C[C@H]1CCC[C@H](C)C1 ZINC001345105262 980546245 /nfs/dbraw/zinc/54/62/45/980546245.db2.gz RKBNYBXSZTVLTR-XQQFMLRXSA-N 2 0 212.381 2.400 20 0 BEADRP Cc1ccc(NC(=[NH2+])NC[C@@H](C)C[NH+](C)C)cc1 ZINC001346588294 980865649 /nfs/dbraw/zinc/86/56/49/980865649.db2.gz DJEUQAFMPHDZCG-GFCCVEGCSA-N 2 0 248.374 2.129 20 0 BEADRP [NH3+]C[C@@]1(F)CCC[N@H+](Cc2cccs2)CC1 ZINC001205545269 980945241 /nfs/dbraw/zinc/94/52/41/980945241.db2.gz BOJIFIOAUJKAGB-GFCCVEGCSA-N 2 0 242.363 2.401 20 0 BEADRP CC(C)CC[N@@H+]1CC[C@H](C)[C@@H](C[NH3+])CC1 ZINC001205601378 981161531 /nfs/dbraw/zinc/16/15/31/981161531.db2.gz DYELBMKBBNTSGJ-QWHCGFSZSA-N 2 0 212.381 2.339 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]Cc1cc(C)ccc1C ZINC001348515763 981381516 /nfs/dbraw/zinc/38/15/16/981381516.db2.gz PIMAAHNSZFSQGD-ZDUSSCGKSA-N 2 0 220.360 2.391 20 0 BEADRP [NH3+]CCCCCC[NH2+]Cc1cccc2c[nH]nc21 ZINC001349325833 981533653 /nfs/dbraw/zinc/53/36/53/981533653.db2.gz RIGYZRSEGWBDLR-UHFFFAOYSA-N 2 0 246.358 2.172 20 0 BEADRP C[C@@H]([NH3+])c1ccc(C2=CCC[NH2+]C2)cc1 ZINC001240664512 981573062 /nfs/dbraw/zinc/57/30/62/981573062.db2.gz JOQUFSVMYXUMEQ-SNVBAGLBSA-N 2 0 202.301 2.083 20 0 BEADRP c1cc([C@@H]2CCC[NH2+]2)ccc1C1=CCC[NH2+]C1 ZINC001240663973 981573081 /nfs/dbraw/zinc/57/30/81/981573081.db2.gz FBCIDLLSFYBYID-HNNXBMFYSA-N 2 0 228.339 2.488 20 0 BEADRP C[NH+](C)Cc1cccc(C2=CCC[NH2+]C2)c1 ZINC001240664636 981574175 /nfs/dbraw/zinc/57/41/75/981574175.db2.gz MVTMKRZPHCZFOA-UHFFFAOYSA-N 2 0 216.328 2.125 20 0 BEADRP CC(C)([NH3+])c1cccc(C2=CCC[NH2+]C2)c1 ZINC001240670712 981579980 /nfs/dbraw/zinc/57/99/80/981579980.db2.gz KGSOKTLJJLLRDQ-UHFFFAOYSA-N 2 0 216.328 2.257 20 0 BEADRP [NH3+]Cc1c[nH]c2ccc(C3=CCC[NH2+]C3)cc12 ZINC001240670077 981580087 /nfs/dbraw/zinc/58/00/87/981580087.db2.gz DZOGTAPHQSDSKM-UHFFFAOYSA-N 2 0 227.311 2.003 20 0 BEADRP C[NH+](C)Cc1cc(C2=CCC[NH2+]C2)ccc1F ZINC001240670613 981580897 /nfs/dbraw/zinc/58/08/97/981580897.db2.gz KJKZQDWBVMYMSQ-UHFFFAOYSA-N 2 0 234.318 2.264 20 0 BEADRP C[NH+]1CC2(C1)CC[NH+](Cc1cccc(F)c1)CC2 ZINC001203790213 981598738 /nfs/dbraw/zinc/59/87/38/981598738.db2.gz OTXQJRPCLPVCAP-UHFFFAOYSA-N 2 0 248.345 2.353 20 0 BEADRP c1cc2c(cc1C[NH2+][C@H]1[C@@H]3CCC[C@@H]31)C[NH2+]CC2 ZINC001580890686 981716746 /nfs/dbraw/zinc/71/67/46/981716746.db2.gz NFMIHILTFIJKRK-ZSHCYNCHSA-N 2 0 242.366 2.220 20 0 BEADRP [NH3+]C1(c2cccc(C=C3CC[NH2+]CC3)c2)CC1 ZINC001240877405 981927949 /nfs/dbraw/zinc/92/79/49/981927949.db2.gz IURHNYVFKMGOQV-UHFFFAOYSA-N 2 0 228.339 2.401 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CCCC(F)F)[C@H]2CCC[C@@H]21 ZINC001350635595 982037967 /nfs/dbraw/zinc/03/79/67/982037967.db2.gz DWOVKILKRADBJP-WOPDTQHZSA-N 2 0 246.345 2.494 20 0 BEADRP Cc1cc(C[N@@H+]2C[C@@H]3CC[NH2+]C[C@@H]3C2)cs1 ZINC001350911543 982121645 /nfs/dbraw/zinc/12/16/45/982121645.db2.gz ZUXNDVJVGICTIV-QWHCGFSZSA-N 2 0 236.384 2.098 20 0 BEADRP CO[C@@H]1CC[C@H]([NH2+][C@@H]2C[C@H]([NH3+])CC(C)(C)C2)C1 ZINC001350955159 982132951 /nfs/dbraw/zinc/13/29/51/982132951.db2.gz GSNVDRTZKXVUMO-WUHRBBMRSA-N 2 0 240.391 2.050 20 0 BEADRP C[C@@H]1[C@H]2CC[C@@H](C[C@@H]1[NH2+][C@@H]1CCC[C@H](F)C1)[NH2+]2 ZINC001350959279 982136990 /nfs/dbraw/zinc/13/69/90/982136990.db2.gz XNODQIRSFIWCIY-WZBKEBKWSA-N 2 0 240.366 2.386 20 0 BEADRP C[N@H+]1CC=C(c2ccc3c[nH+]cn3c2)CC1 ZINC001241319127 982472705 /nfs/dbraw/zinc/47/27/05/982472705.db2.gz CTAPRCAHHAQCNS-UHFFFAOYSA-N 2 0 213.284 2.053 20 0 BEADRP C[NH+](C)Cc1ccc(C2=CC[N@H+](C)CC2)cc1 ZINC001241328040 982487214 /nfs/dbraw/zinc/48/72/14/982487214.db2.gz VZCVUXTWJFBPFW-UHFFFAOYSA-N 2 0 230.355 2.467 20 0 BEADRP Cc1cccc(CN2C[C@H]3C[C@@]3(C[NH+](C)C)C2)c1 ZINC001203893098 982649418 /nfs/dbraw/zinc/64/94/18/982649418.db2.gz VBSUEIGGTOLCCP-HZPDHXFCSA-N 2 0 244.382 2.379 20 0 BEADRP C[N@@H+]1CCC=C(c2cccc(C3([NH3+])CC3)c2)C1 ZINC001241569941 982818499 /nfs/dbraw/zinc/81/84/99/982818499.db2.gz DBADREPTLVYNRE-UHFFFAOYSA-N 2 0 228.339 2.353 20 0 BEADRP C[N@@H+]1CCC=C(c2cccc(C[NH3+])c2F)C1 ZINC001241570872 982822557 /nfs/dbraw/zinc/82/25/57/982822557.db2.gz PHGIHNONEOSEEN-UHFFFAOYSA-N 2 0 220.291 2.003 20 0 BEADRP C[C@@H]([NH3+])c1ccc(C2=CCC[N@H+](C)C2)cc1 ZINC001241570524 982823992 /nfs/dbraw/zinc/82/39/92/982823992.db2.gz JGWDBADCMCTEQJ-LLVKDONJSA-N 2 0 216.328 2.425 20 0 BEADRP Fc1ccc(C[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000037408210 982942619 /nfs/dbraw/zinc/94/26/19/982942619.db2.gz INAOTRDGMAUPPL-ZDUSSCGKSA-N 2 0 248.345 2.400 20 0 BEADRP C[NH+](C)Cc1cncc(-c2ccc(C[NH3+])cc2)c1 ZINC001241915479 983134386 /nfs/dbraw/zinc/13/43/86/983134386.db2.gz YVQPNEIUSAYGQK-UHFFFAOYSA-N 2 0 241.338 2.269 20 0 BEADRP C[NH+](C)Cc1ccnc(C2=C[C@H]3CC[C@@H](C2)[NH2+]3)c1 ZINC001242022535 983232600 /nfs/dbraw/zinc/23/26/00/983232600.db2.gz WXMZUSPLIOSPAH-KGLIPLIRSA-N 2 0 243.354 2.051 20 0 BEADRP [NH3+]Cc1cccc(C2=C[C@H]3CC[C@@H](C2)[NH2+]3)c1F ZINC001242026774 983237920 /nfs/dbraw/zinc/23/79/20/983237920.db2.gz ZCZFZWFVFFVROJ-NEPJUHHUSA-N 2 0 232.302 2.192 20 0 BEADRP CCC(CC)C[NH+]1CC2(C1)CC[NH+](C)CC2 ZINC001201534949 983290202 /nfs/dbraw/zinc/29/02/02/983290202.db2.gz FOOCPURMTYRYDI-UHFFFAOYSA-N 2 0 224.392 2.450 20 0 BEADRP CCC[C@H](C)C[NH+]1C[C@@H]2C[NH+](CC)C[C@H]2C1 ZINC001201563429 983330120 /nfs/dbraw/zinc/33/01/20/983330120.db2.gz PYCOVVOTZVQWJN-IHRRRGAJSA-N 2 0 224.392 2.306 20 0 BEADRP CC[N@@H+]1CC[C@@H]2C[NH+](Cc3ccccc3)C[C@@H]2C1 ZINC001201587732 983349874 /nfs/dbraw/zinc/34/98/74/983349874.db2.gz XFDKMCLDPCNZCF-CVEARBPZSA-N 2 0 244.382 2.460 20 0 BEADRP CCC[N@H+](C)CC1CC[NH+](C(C)C)CC1 ZINC001201643475 983397694 /nfs/dbraw/zinc/39/76/94/983397694.db2.gz MSGVFCQVBNZINX-UHFFFAOYSA-N 2 0 212.381 2.449 20 0 BEADRP CCCC[NH+]1CCN(c2cc[nH+]c(C)c2)CC1 ZINC001201723273 983428050 /nfs/dbraw/zinc/42/80/50/983428050.db2.gz VGPQEBAWRANZQX-UHFFFAOYSA-N 2 0 233.359 2.312 20 0 BEADRP CCCCCC[N@@H+]1C[C@H]2CC[NH+](C)C[C@H]2C1 ZINC001201747170 983456191 /nfs/dbraw/zinc/45/61/91/983456191.db2.gz WOVWKFWADODSEJ-KGLIPLIRSA-N 2 0 224.392 2.450 20 0 BEADRP CC(C)[NH+]1CCC(C[N@H+](C)CC2CC2)CC1 ZINC001201932792 983504241 /nfs/dbraw/zinc/50/42/41/983504241.db2.gz QFDAOJYUVPPIMK-UHFFFAOYSA-N 2 0 224.392 2.449 20 0 BEADRP CN1CCC[C@H]2C[N@H+](CCC(C)(C)C)C[C@@H]21 ZINC001202114630 983563357 /nfs/dbraw/zinc/56/33/57/983563357.db2.gz BWIUILIIOMWULD-STQMWFEESA-N 2 0 224.392 2.449 20 0 BEADRP FC(F)(F)CCC[N@H+]1CCc2nccn2CC1 ZINC001202432984 983674617 /nfs/dbraw/zinc/67/46/17/983674617.db2.gz DQZGNYZJLKXGLM-UHFFFAOYSA-N 2 0 247.264 2.084 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CC[C@H]3C[N@@H+](C)C[C@H]32)cc1 ZINC001474302671 983903170 /nfs/dbraw/zinc/90/31/70/983903170.db2.gz CKULLGIGSYMHSY-ARFHVFGLSA-N 2 0 244.382 2.425 20 0 BEADRP CN(C)c1cc[nH+]c(-c2ccc3c(c2)C[NH2+]C3)c1 ZINC001242673458 984040416 /nfs/dbraw/zinc/04/04/16/984040416.db2.gz BTVRVQLHKQBGPB-UHFFFAOYSA-N 2 0 239.322 2.418 20 0 BEADRP Cc1cnc(-c2ccc3c(c2)C[NH2+]C3)c(C[NH3+])c1 ZINC001242673796 984043091 /nfs/dbraw/zinc/04/30/91/984043091.db2.gz HQZGLIADMCREDY-UHFFFAOYSA-N 2 0 239.322 2.119 20 0 BEADRP c1[nH+]c(NCC2CC[NH2+]CC2)cc2c1CCCC2 ZINC001574439818 984113038 /nfs/dbraw/zinc/11/30/38/984113038.db2.gz GXPKAROTNGWWKE-UHFFFAOYSA-N 2 0 245.370 2.372 20 0 BEADRP CC1(C)CCC[C@@H]([NH2+]C[C@H]2[C@@H]3C[NH2+]C[C@H]23)CC1 ZINC001576427119 984170907 /nfs/dbraw/zinc/17/09/07/984170907.db2.gz RSVCXKFVYKQSTK-MQYQWHSLSA-N 2 0 236.403 2.400 20 0 BEADRP C[C@H]1CCC(C)(C)C[C@H]1[NH2+][C@H]1C[C@@H]([NH3+])C1 ZINC001576647941 984179813 /nfs/dbraw/zinc/17/98/13/984179813.db2.gz VPPVAFJXEUYUTN-NNYUYHANSA-N 2 0 210.365 2.281 20 0 BEADRP C[C@H]1C[N@H+](CC2CCC2)CCC[C@H]1C[NH3+] ZINC001205983882 984214422 /nfs/dbraw/zinc/21/44/22/984214422.db2.gz PVOLCLPQHRVRIP-AAEUAGOBSA-N 2 0 210.365 2.093 20 0 BEADRP [NH3+]C1(c2ccc(C3=CC[NH2+]CC3)cc2)CC1 ZINC001240467021 984302020 /nfs/dbraw/zinc/30/20/20/984302020.db2.gz PTOWFJUVPWWZNI-UHFFFAOYSA-N 2 0 214.312 2.011 20 0 BEADRP C[NH+]1CCC2(CCC[N@H+](Cc3ccc[nH]3)C2)CC1 ZINC001275044661 984448909 /nfs/dbraw/zinc/44/89/09/984448909.db2.gz CWOKPKXARWSKJU-UHFFFAOYSA-N 2 0 247.386 2.323 20 0 BEADRP CC[C@H](C)C[N@H+]1C[C@@H]2CC[NH+](C)CC[C@@H]2C1 ZINC001275061850 984454661 /nfs/dbraw/zinc/45/46/61/984454661.db2.gz LSYZBOJXHLWSFH-MELADBBJSA-N 2 0 224.392 2.306 20 0 BEADRP CC[N@H+]1C[C@@H]2CC[NH+](Cc3ccc[nH]3)CC[C@@H]2C1 ZINC001275084979 984477106 /nfs/dbraw/zinc/47/71/06/984477106.db2.gz KBQCMRLTZBXRLT-OKILXGFUSA-N 2 0 247.386 2.178 20 0 BEADRP CSCCC[NH+]1CCC2(CC[N@H+](C)C2)CC1 ZINC001275109832 984492990 /nfs/dbraw/zinc/49/29/90/984492990.db2.gz QUTPOOGPDLJUDS-UHFFFAOYSA-N 2 0 242.432 2.157 20 0 BEADRP C1=C(c2cccc(C3=[NH+]CCC3)c2)C[NH2+]C1 ZINC001243110587 984569987 /nfs/dbraw/zinc/56/99/87/984569987.db2.gz BTEUBPCUZBIRAG-UHFFFAOYSA-N 2 0 212.296 2.256 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH+]1CCC2(CC[N@H+](C)C2)CC1 ZINC001276031481 984788857 /nfs/dbraw/zinc/78/88/57/984788857.db2.gz HRLNDIDBRFKFLV-CHWSQXEVSA-N 2 0 222.376 2.060 20 0 BEADRP C[NH+](C)CCC[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000925500803 984826784 /nfs/dbraw/zinc/82/67/84/984826784.db2.gz FSIXWSWLRCGJOU-HNNXBMFYSA-N 3 0 249.402 2.008 20 0 BEADRP [NH3+]CCC[C@@H]([NH2+]C[C@H]1CCCO1)c1ccccc1 ZINC000925500807 984827312 /nfs/dbraw/zinc/82/73/12/984827312.db2.gz FSKFXNJYHRDJHC-HUUCEWRRSA-N 2 0 248.370 2.235 20 0 BEADRP [NH3+]CCC[C@H]([NH2+]C[C@@H]1CCCO1)c1ccccc1 ZINC000925500806 984827861 /nfs/dbraw/zinc/82/78/61/984827861.db2.gz FSKFXNJYHRDJHC-GJZGRUSLSA-N 2 0 248.370 2.235 20 0 BEADRP CCS[C@H]1CCC[C@@H]1[NH2+]C[C@H]1CC[C@@H]([NH3+])C1 ZINC001578216716 984868728 /nfs/dbraw/zinc/86/87/28/984868728.db2.gz PUNLSMBMVQGIFD-RNJOBUHISA-N 2 0 242.432 2.378 20 0 BEADRP CCS[C@@H]1CCCC[C@@H]1[NH2+]C[C@H]1CCC[NH2+]1 ZINC001578217079 984869614 /nfs/dbraw/zinc/86/96/14/984869614.db2.gz YXTSNXITQOIOPW-FRRDWIJNSA-N 2 0 242.432 2.392 20 0 BEADRP CCC[C@@H](C)[N@H+]1C[C@H]2C[NH+](CC)C[C@H]2C1 ZINC001257326532 984895556 /nfs/dbraw/zinc/89/55/56/984895556.db2.gz BITQQQYMGOOJSK-UPJWGTAASA-N 2 0 210.365 2.059 20 0 BEADRP CCc1ccc(C[N@@H+]2CC[C@H](C[NH3+])[C@H](C)C2)nc1 ZINC001578260057 984913733 /nfs/dbraw/zinc/91/37/33/984913733.db2.gz ZXIYFMNJBGNITB-TZMCWYRMSA-N 2 0 247.386 2.061 20 0 BEADRP C[NH2+]CCC[N@@H+]1CC=CC12CCCCC2 ZINC001578687354 985295086 /nfs/dbraw/zinc/29/50/86/985295086.db2.gz WDPHAWBRFIMIOG-UHFFFAOYSA-N 2 0 208.349 2.171 20 0 BEADRP CC(C)C[NH2+]Cc1cc2c(s1)CC[NH2+]C2 ZINC000688038066 985505943 /nfs/dbraw/zinc/50/59/43/985505943.db2.gz HWZHHEKVHLLJHY-UHFFFAOYSA-N 2 0 224.373 2.139 20 0 BEADRP CO[C@H]1CCC[C@@H]([NH2+]CCCCCC[NH3+])CC1 ZINC001578938368 985557341 /nfs/dbraw/zinc/55/73/41/985557341.db2.gz SKMXMHJTHBKNQM-KGLIPLIRSA-N 2 0 242.407 2.443 20 0 BEADRP [NH3+]Cc1ccccc1/C=C/C1CC[NH2+]CC1 ZINC001243897427 985585006 /nfs/dbraw/zinc/58/50/06/985585006.db2.gz WYGOJWHJGSJLGJ-AATRIKPKSA-N 2 0 216.328 2.158 20 0 BEADRP COCC1(C[NH2+]CC(C)(C)C[NH3+])CCCCC1 ZINC001578982990 985604675 /nfs/dbraw/zinc/60/46/75/985604675.db2.gz VHTYMJLBVZMODA-UHFFFAOYSA-N 2 0 242.407 2.158 20 0 BEADRP [NH3+]C[C@@H]1CCC[N@H+](CCCC2CCC2)C1 ZINC000688370554 985626143 /nfs/dbraw/zinc/62/61/43/985626143.db2.gz HNHYNMRSJHDYLZ-ZDUSSCGKSA-N 2 0 210.365 2.237 20 0 BEADRP CSCC[C@@H](C)[NH2+]C(C)(C)C(C)(C)[NH3+] ZINC001258207781 985631681 /nfs/dbraw/zinc/63/16/81/985631681.db2.gz JEQGUBRBZODAGT-SECBINFHSA-N 2 0 218.410 2.234 20 0 BEADRP [NH3+][C@@H]1CCc2c1cccc2C1=C[NH2+]CCC1 ZINC001243951408 985658411 /nfs/dbraw/zinc/65/84/11/985658411.db2.gz GLNDACGLKQTWOT-CQSZACIVSA-N 2 0 214.312 2.357 20 0 BEADRP CO[C@H]1C[C@@H](C[NH2+]C[C@H]([NH3+])CCC(C)(C)C)C1 ZINC001579130081 985806984 /nfs/dbraw/zinc/80/69/84/985806984.db2.gz YIRGMEPBMDZVGC-UPJWGTAASA-N 2 0 242.407 2.155 20 0 BEADRP CSC1(C[N@@H+]2CC[C@H](C[NH3+])[C@H](C)C2)CCC1 ZINC001579364908 985861420 /nfs/dbraw/zinc/86/14/20/985861420.db2.gz FOYLHZOBKRYPLE-VXGBXAGGSA-N 2 0 242.432 2.189 20 0 BEADRP C[C@@H](CC1CC1)[N@@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC001258473543 985936122 /nfs/dbraw/zinc/93/61/22/985936122.db2.gz NKSKXIOMMNKXRW-JSGCOSHPSA-N 2 0 222.376 2.203 20 0 BEADRP [NH3+]C[C@@H]1CCCC[N@H+](CCCc2cccnc2)C1 ZINC001206607142 985957367 /nfs/dbraw/zinc/95/73/67/985957367.db2.gz WOAHOUZQWWIUBN-HNNXBMFYSA-N 2 0 247.386 2.075 20 0 BEADRP Cc1cc(C)c(/C=C\C[NH2+]CC2C[NH2+]C2)c(C)c1 ZINC001579572312 986092892 /nfs/dbraw/zinc/09/28/92/986092892.db2.gz XEVTUHRXBMUOMM-PLNGDYQASA-N 2 0 244.382 2.434 20 0 BEADRP Cc1ccc(CC[N@@H+](C)C2CC([NH3+])C2)cc1C ZINC001579685303 986176749 /nfs/dbraw/zinc/17/67/49/986176749.db2.gz JFFVRGMSDYVVJT-UHFFFAOYSA-N 2 0 232.371 2.267 20 0 BEADRP C[NH2+]Cc1cccc(-c2ccnc(C[NH3+])c2)c1F ZINC001244861611 986405045 /nfs/dbraw/zinc/40/50/45/986405045.db2.gz JNDVAACZVSPIRU-UHFFFAOYSA-N 2 0 245.301 2.066 20 0 BEADRP F[C@@]1(c2ccccc2)C[C@@H]1[NH2+]CC1CC[NH2+]CC1 ZINC001580026278 986427454 /nfs/dbraw/zinc/42/74/54/986427454.db2.gz BJEWLFCTGLFALQ-LSDHHAIUSA-N 2 0 248.345 2.213 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@H]([NH2+][C@@H]3CC[C@@H]3C3CCC3)[C@@H]2C1 ZINC001462674639 986500204 /nfs/dbraw/zinc/50/02/04/986500204.db2.gz YXXHIYMLCXKQJR-GCSSGZNBSA-N 2 0 248.414 2.495 20 0 BEADRP C[C@]1(C[N@@H+]2CCC[C@@H](CCF)C2)CCC[NH2+]C1 ZINC000689421673 986579084 /nfs/dbraw/zinc/57/90/84/986579084.db2.gz MGZCUYDGDYBFFS-KBPBESRZSA-N 2 0 242.382 2.448 20 0 BEADRP C[C@@H](C[NH2+][C@@H]1CCCOC1)CC(C)(C)CC[NH3+] ZINC001254369906 986600244 /nfs/dbraw/zinc/60/02/44/986600244.db2.gz MDIRYJXEFLPRHR-CHWSQXEVSA-N 2 0 242.407 2.156 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCCOC1)CC(C)(C)CC[NH3+] ZINC001254369908 986600336 /nfs/dbraw/zinc/60/03/36/986600336.db2.gz MDIRYJXEFLPRHR-QWHCGFSZSA-N 2 0 242.407 2.156 20 0 BEADRP [NH3+][C@@H]1CC12CC([NH2+][C@@H]1C[C@@H]3CCCC[C@H]13)C2 ZINC001580166754 986641024 /nfs/dbraw/zinc/64/10/24/986641024.db2.gz RNPZEOYYHZPDKW-KXRJTCLESA-N 2 0 220.360 2.035 20 0 BEADRP C[C@H]1C[N@@H+]([C@H]2CCC[NH+](C)CC2)CCC1(F)F ZINC001254516814 986657385 /nfs/dbraw/zinc/65/73/85/986657385.db2.gz QAYPYOGYXZBCRG-RYUDHWBXSA-N 2 0 246.345 2.448 20 0 BEADRP C[C@@H]1CCCC[N@@H+]1[C@@H]1CCC[NH+](C)CC1 ZINC001254515816 986666960 /nfs/dbraw/zinc/66/69/60/986666960.db2.gz DKZZQTDVHDGXDD-CHWSQXEVSA-N 2 0 210.365 2.345 20 0 BEADRP [NH3+]CC1(C[NH+]2CC(Cc3ccccc3)C2)CCC1 ZINC001580243493 986698767 /nfs/dbraw/zinc/69/87/67/986698767.db2.gz ILTLAKDHEDQEIT-UHFFFAOYSA-N 2 0 244.382 2.290 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]Cc1cccn1C1CC1 ZINC001580262196 986720707 /nfs/dbraw/zinc/72/07/07/986720707.db2.gz QJSJNSUNWJUCON-SWLSCSKDSA-N 2 0 247.386 2.430 20 0 BEADRP [NH3+]C/C=C/C[NH2+]C1CC(Sc2ccccc2)C1 ZINC001580280214 986729061 /nfs/dbraw/zinc/72/90/61/986729061.db2.gz AGXLLYMQHNNKME-SNAWJCMRSA-N 2 0 248.395 2.414 20 0 BEADRP [NH3+]CCC[N@@H+]1CCCC[C@@H]1Cc1ccc(O)cc1 ZINC001580298693 986738367 /nfs/dbraw/zinc/73/83/67/986738367.db2.gz YIRRYLTWRHGKKN-CQSZACIVSA-N 2 0 248.370 2.138 20 0 BEADRP Cc1cc(C)c(C[NH+]2C[C@H]3CC[N@@H+](C)C[C@H]3C2)[nH]1 ZINC001137323926 986773453 /nfs/dbraw/zinc/77/34/53/986773453.db2.gz DAEBLUOZRNFUME-KGLIPLIRSA-N 2 0 247.386 2.015 20 0 BEADRP [NH3+]C[C@H]1CC[C@H]([NH2+]Cc2cccn2C2CC2)CC1 ZINC001580332345 986775180 /nfs/dbraw/zinc/77/51/80/986775180.db2.gz BFBWGMNRXVRBAA-JOCQHMNTSA-N 2 0 247.386 2.430 20 0 BEADRP C[N@@H+]1CC[C@H](n2c(C[NH3+])cc3cccc(F)c32)C1 ZINC001255426292 986947560 /nfs/dbraw/zinc/94/75/60/986947560.db2.gz MSBUDZBIMHDIEE-NSHDSACASA-N 2 0 247.317 2.116 20 0 BEADRP C[NH2+]Cc1ccc2c(ccn2[C@H]2CC[N@H+](C)C2)c1 ZINC001255432827 986952297 /nfs/dbraw/zinc/95/22/97/986952297.db2.gz UQPCWBAKYSTSJF-AWEZNQCLSA-N 2 0 243.354 2.237 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]CCn1cccc1 ZINC001255940350 987077386 /nfs/dbraw/zinc/07/73/86/987077386.db2.gz ABMUICMSEUXQGO-CQSZACIVSA-N 2 0 237.391 2.198 20 0 BEADRP C/C=C(\NC=[NH2+])c1ccc(C(C)(C)[NH3+])cc1 ZINC001245908208 987138699 /nfs/dbraw/zinc/13/86/99/987138699.db2.gz JMCXQEOTQKMZDW-QCDXTXTGSA-N 2 0 217.316 2.438 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H](C)C1(Cl)CC1 ZINC000695684472 987332927 /nfs/dbraw/zinc/33/29/27/987332927.db2.gz GADXNVUWOWDXRG-LLVKDONJSA-N 2 0 232.799 2.468 20 0 BEADRP CC[C@@H]1[C@@H](C)CC[N@@H+]1C[C@@H]1CCCC[NH2+]C1 ZINC000697017470 987342525 /nfs/dbraw/zinc/34/25/25/987342525.db2.gz SPJYCACUJLJFEM-BFHYXJOUSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H]1[C@H](C)CC[N@@H+]1C[C@H]1CCCC[NH2+]C1 ZINC000697017471 987344522 /nfs/dbraw/zinc/34/45/22/987344522.db2.gz SPJYCACUJLJFEM-HZSPNIEDSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H]1CC[N@H+](C[C@@H]2CCCC[NH2+]C2)C1 ZINC000697044069 987346586 /nfs/dbraw/zinc/34/65/86/987346586.db2.gz ZEMJLSWVOCGFDM-CHWSQXEVSA-N 2 0 210.365 2.108 20 0 BEADRP CC[C@]1(C)CC[N@H+](C[C@H]2CCCC[NH2+]C2)C1 ZINC000697036856 987346965 /nfs/dbraw/zinc/34/69/65/987346965.db2.gz MSSRCJHNDAUIHS-UONOGXRCSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H]1C[N@@H+](C[C@H]2CCCC[NH2+]C2)C[C@H](C)S1 ZINC000697059076 987347481 /nfs/dbraw/zinc/34/74/81/987347481.db2.gz WMHVRXFLUFJBDV-XQQFMLRXSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@H]2CCCC[NH2+]C2)[C@H]1C ZINC000697017858 987347544 /nfs/dbraw/zinc/34/75/44/987347544.db2.gz VAMPCPLXFRXPOG-AGIUHOORSA-N 2 0 210.365 2.106 20 0 BEADRP C[N@H+](C[C@@H]1CCCC[NH2+]C1)CC(C)(C)C ZINC000697050642 987347629 /nfs/dbraw/zinc/34/76/29/987347629.db2.gz FAYQBNNNYTVKNS-GFCCVEGCSA-N 2 0 212.381 2.354 20 0 BEADRP CC[C@@H]1C[N@H+](C[C@@H]2CCCC[NH2+]C2)CCS1 ZINC000697054783 987347884 /nfs/dbraw/zinc/34/78/84/987347884.db2.gz FZCGTSYJMJSPRA-CHWSQXEVSA-N 2 0 242.432 2.204 20 0 BEADRP C[C@@H](CC[NH2+]CC1(C)CCCC1)[NH+](C)C ZINC000697823886 987364802 /nfs/dbraw/zinc/36/48/02/987364802.db2.gz JLKXBZPTDOUSQC-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H](C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)CC(F)F ZINC000697713463 987365746 /nfs/dbraw/zinc/36/57/46/987365746.db2.gz GWHNVSWJNUNKHA-WAAKLRNESA-N 2 0 246.345 2.493 20 0 BEADRP Cc1ccccc1CCN[C@@H]1CCCC[NH2+]C1 ZINC001246076613 987367150 /nfs/dbraw/zinc/36/71/50/987367150.db2.gz QSNOIKWNSYEXIQ-OAHLLOKOSA-N 2 0 232.371 2.269 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C2(C)CCCCC2)CC[NH2+]1 ZINC001246080743 987377348 /nfs/dbraw/zinc/37/73/48/987377348.db2.gz JQASRWZKMWPGNU-NEPJUHHUSA-N 2 0 210.365 2.439 20 0 BEADRP CCC[C@H](CC)[NH2+]C[C@@H]1C[NH2+]C[C@H](C)C1 ZINC001246105733 987431470 /nfs/dbraw/zinc/43/14/70/987431470.db2.gz WPSXYEUDHYDKAZ-AGIUHOORSA-N 2 0 212.381 2.400 20 0 BEADRP CC[C@H](C)C[C@H](CC)[NH2+][C@H]1C[NH2+]C[C@@H]1C ZINC001246105666 987432660 /nfs/dbraw/zinc/43/26/60/987432660.db2.gz BZPHTLXVGIGPLH-CYDGBPFRSA-N 2 0 212.381 2.399 20 0 BEADRP CC(C)OCC[C@@H](C)[NH2+]C[C@@H]1CC[C@@H](C)C[NH2+]1 ZINC001246106240 987436060 /nfs/dbraw/zinc/43/60/60/987436060.db2.gz OROGYVYEPMNFJI-MCIONIFRSA-N 2 0 242.407 2.168 20 0 BEADRP C[C@@H]1CC[C@@H](n2cc(C[NH3+])c3ccccc32)C[NH2+]1 ZINC001246109277 987441743 /nfs/dbraw/zinc/44/17/43/987441743.db2.gz NDQNMEDHIDIKDG-DGCLKSJQSA-N 2 0 243.354 2.413 20 0 BEADRP C[C@H]1C[C@H](n2cc(C[NH3+])c3ccccc32)CC[NH2+]1 ZINC001246110087 987442063 /nfs/dbraw/zinc/44/20/63/987442063.db2.gz QMBJBKCBSXPOBP-WCQYABFASA-N 2 0 243.354 2.413 20 0 BEADRP CC[C@@H](C)C[C@H](CC)[NH2+][C@@H]1C[NH2+]C[C@@H]1C ZINC001246113521 987450180 /nfs/dbraw/zinc/45/01/80/987450180.db2.gz BZPHTLXVGIGPLH-MROQNXINSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@@H]1CC[C@@H](n2ccc3c2cccc3C[NH3+])C[NH2+]1 ZINC001246114388 987456452 /nfs/dbraw/zinc/45/64/52/987456452.db2.gz MBZBIHKNNMWKOG-DGCLKSJQSA-N 2 0 243.354 2.413 20 0 BEADRP CC(C)C1CCC([NH2+]C2CC([NH3+])C2)CC1 ZINC001246116769 987458063 /nfs/dbraw/zinc/45/80/63/987458063.db2.gz WTCWKBFHLHNFJS-UHFFFAOYSA-N 2 0 210.365 2.281 20 0 BEADRP CCCCC[C@@H](CCC)[NH2+]CCC1(O)C[NH2+]C1 ZINC001246118058 987465583 /nfs/dbraw/zinc/46/55/83/987465583.db2.gz OHYWCNKKGNVLDP-CYBMUJFWSA-N 2 0 242.407 2.049 20 0 BEADRP Cc1ccc(CCC[NH2+]C2CC[NH2+]CC2)s1 ZINC001246130027 987475159 /nfs/dbraw/zinc/47/51/59/987475159.db2.gz RFWICZIBKAXUPY-UHFFFAOYSA-N 2 0 238.400 2.331 20 0 BEADRP C1CC12C[NH2+]C[C@H]2[NH2+]C1CCCCCCC1 ZINC001246131459 987484622 /nfs/dbraw/zinc/48/46/22/987484622.db2.gz KCRBWNYESLJRAY-CYBMUJFWSA-N 2 0 222.376 2.441 20 0 BEADRP CCC[C@H](C)CC[C@@H](C)[NH2+][C@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001246147115 987502145 /nfs/dbraw/zinc/50/21/45/987502145.db2.gz LBHJASKSCWHGJJ-VJTDZRGJSA-N 2 0 224.392 2.399 20 0 BEADRP CCC[C@@H](C)CC[C@@H](C)[NH2+][C@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001246147116 987503060 /nfs/dbraw/zinc/50/30/60/987503060.db2.gz LBHJASKSCWHGJJ-XGFWRYKXSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@H]1C[C@@H](n2c(C[NH3+])cc3ccccc32)CC[NH2+]1 ZINC001246164795 987527532 /nfs/dbraw/zinc/52/75/32/987527532.db2.gz BKOUPDQUXQWDBC-AAEUAGOBSA-N 2 0 243.354 2.413 20 0 BEADRP C[C@@H]1CC[C@H](n2c(C[NH3+])cc3ccccc32)C[NH2+]1 ZINC001246164763 987529075 /nfs/dbraw/zinc/52/90/75/987529075.db2.gz BCZQQWCTOJVMMM-YPMHNXCESA-N 2 0 243.354 2.413 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H]2CC[NH2+][C@H](C)C2)s1 ZINC001246167112 987529535 /nfs/dbraw/zinc/52/95/35/987529535.db2.gz CQPHSZFBPKWITB-ZYHUDNBSSA-N 2 0 238.400 2.329 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCCc2cccs2)CC[NH2+]1 ZINC001246171510 987536248 /nfs/dbraw/zinc/53/62/48/987536248.db2.gz WHLQINKITSLFKF-NEPJUHHUSA-N 2 0 238.400 2.411 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]23)C[C@H]1C ZINC001246178494 987551441 /nfs/dbraw/zinc/55/14/41/987551441.db2.gz OUBHXAJDEAXXHB-PMXAPFLYSA-N 2 0 236.403 2.399 20 0 BEADRP CCCOC1CCC([NH2+]C[C@H]2CCC[NH2+]2)CC1 ZINC001246185453 987561438 /nfs/dbraw/zinc/56/14/38/987561438.db2.gz AIXDWHRMMKDNBB-ROKHWSDSSA-N 2 0 240.391 2.066 20 0 BEADRP CSC(C)(C)C[C@H](C)[NH2+]C[C@H]1CCC[NH2+]1 ZINC001246186705 987566254 /nfs/dbraw/zinc/56/62/54/987566254.db2.gz GVBUICGXVBOQSD-WDEREUQCSA-N 2 0 230.421 2.248 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C[C@H]2CCC[NH2+]2)C[C@H]1C ZINC001246188338 987573850 /nfs/dbraw/zinc/57/38/50/987573850.db2.gz WFELSUDSWVFUSN-FDYHWXHSSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]1C[C@@H]([NH2+][C@@H]2CCc3ccccc32)CC[NH2+]1 ZINC001246189706 987578056 /nfs/dbraw/zinc/57/80/56/987578056.db2.gz JHXCZYYSHXFYTG-CORIIIEPSA-N 2 0 230.355 2.404 20 0 BEADRP CC(C)CC(CC(C)C)[NH2+]C[C@@H]1CC[NH2+]1 ZINC001246192245 987579574 /nfs/dbraw/zinc/57/95/74/987579574.db2.gz GTRSZNYPZKRYLT-LBPRGKRZSA-N 2 0 212.381 2.399 20 0 BEADRP CC1(C)[C@@H]2C[C@@H]([NH2+]C[C@H]3CCC[NH2+]C3)C[C@@H]21 ZINC001246199642 987595185 /nfs/dbraw/zinc/59/51/85/987595185.db2.gz YDALLTRUGBPJNN-ZDEQEGDKSA-N 2 0 222.376 2.010 20 0 BEADRP CCCCCC[C@H](C)[NH2+][C@@H]1CC[NH2+]C[C@H]1OC ZINC001246217178 987613707 /nfs/dbraw/zinc/61/37/07/987613707.db2.gz FLAHNLOJDASICT-BFHYXJOUSA-N 2 0 242.407 2.312 20 0 BEADRP CC(C)C[C@@H](C)C[C@H](C)[NH2+]C[C@@H]1CC[NH2+]1 ZINC001246217495 987615052 /nfs/dbraw/zinc/61/50/52/987615052.db2.gz KWDZQHXNPYTIAG-AGIUHOORSA-N 2 0 212.381 2.399 20 0 BEADRP Cc1ccc(CN[C@H]2CC[NH2+][C@H](C)C2)c(F)c1 ZINC001246229573 987625206 /nfs/dbraw/zinc/62/52/06/987625206.db2.gz DJRYTQIPPNGYOA-YPMHNXCESA-N 2 0 236.334 2.364 20 0 BEADRP C[C@@H]1CC[C@H](N[C@@H]2CCNc3ccccc32)C[NH2+]1 ZINC001246229911 987625336 /nfs/dbraw/zinc/62/53/36/987625336.db2.gz LWTPRBXLSTYHSA-TYNCELHUSA-N 2 0 245.370 2.273 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@H]2CC[C@@H]3CCC[C@@H]32)CC[NH2+]1 ZINC001246232779 987628818 /nfs/dbraw/zinc/62/88/18/987628818.db2.gz ZRSXQOGTKRSLIJ-QMVSFRDZSA-N 2 0 222.376 2.295 20 0 BEADRP CC[C@H]([NH2+][C@H]1CC[NH2+][C@@H](C)C1)c1cccnc1 ZINC001246240656 987641839 /nfs/dbraw/zinc/64/18/39/987641839.db2.gz SSGUVKUBVZBWMC-UBHSHLNASA-N 2 0 233.359 2.263 20 0 BEADRP C[C@@H]1C[C@@H](N2CC[C@H]([NH3+])c3ccccc32)CC[NH2+]1 ZINC001246259599 987654843 /nfs/dbraw/zinc/65/48/43/987654843.db2.gz BERRZBUYIRMPQK-DYEKYZERSA-N 2 0 245.370 2.037 20 0 BEADRP C[C@@H]1CC[C@H](N2CC[C@@H]([NH3+])c3ccccc32)C[NH2+]1 ZINC001246261854 987655596 /nfs/dbraw/zinc/65/55/96/987655596.db2.gz NMXLGPOOYGNFOB-MBNYWOFBSA-N 2 0 245.370 2.037 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2C[C@H]2c2ccccc2)CC[NH2+]1 ZINC001246263634 987660806 /nfs/dbraw/zinc/66/08/06/987660806.db2.gz KHETVUGRBYWJAI-UQOMUDLDSA-N 2 0 230.355 2.273 20 0 BEADRP C[C@@H](C[NH2+][C@@H]1CC[NH2+][C@H](C)C1)c1ccc(O)cc1 ZINC001246272961 987666296 /nfs/dbraw/zinc/66/62/96/987666296.db2.gz NCCXSMJIDDZPCC-OUCADQQQSA-N 2 0 248.370 2.226 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[NH2+][C@H](C)C1)c1ccc(N)cc1 ZINC001246282248 987675236 /nfs/dbraw/zinc/67/52/36/987675236.db2.gz BCZHUSBJKRLQRR-SUNKGSAMSA-N 2 0 233.359 2.060 20 0 BEADRP CCC[C@@H](C)CC[C@H](C)[NH2+]CCN(C)CC[NH3+] ZINC001246284517 987677799 /nfs/dbraw/zinc/67/77/99/987677799.db2.gz OEIBQLBXCRPIFY-KGLIPLIRSA-N 2 0 243.439 2.071 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@@H]2c2ccc(F)cc2)CC[NH2+]1 ZINC001246283663 987678592 /nfs/dbraw/zinc/67/85/92/987678592.db2.gz XENXYSUKPLCSPY-JUDXGUMMSA-N 2 0 248.345 2.412 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@H]2c2ccc(F)cc2)CC[NH2+]1 ZINC001246283665 987679905 /nfs/dbraw/zinc/67/99/05/987679905.db2.gz XENXYSUKPLCSPY-QPKOPYBWSA-N 2 0 248.345 2.412 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[NH2+][C@@H](C)C1)c1cccc(N)c1 ZINC001246296710 987689554 /nfs/dbraw/zinc/68/95/54/987689554.db2.gz JECYUTRPXLBECJ-MJVIPROJSA-N 2 0 233.359 2.060 20 0 BEADRP CC[NH+](CC)C1CC[NH+](C[C@@H]2C[C@H]2C)CC1 ZINC001116758679 987697876 /nfs/dbraw/zinc/69/78/76/987697876.db2.gz YYDJJEUGVLXKNQ-OLZOCXBDSA-N 2 0 224.392 2.449 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@H]1CCc2cccc(F)c2C1 ZINC001246303265 987700567 /nfs/dbraw/zinc/70/05/67/987700567.db2.gz FSFRIJWRAPYGFN-JQWIXIFHSA-N 2 0 236.334 2.010 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H]1CCc2c(F)cccc2C1 ZINC001246303288 987701019 /nfs/dbraw/zinc/70/10/19/987701019.db2.gz GLKFWWYUUAGZCH-CMPLNLGQSA-N 2 0 236.334 2.010 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@H]1CCc2c(F)cccc2C1 ZINC001246303290 987702091 /nfs/dbraw/zinc/70/20/91/987702091.db2.gz GLKFWWYUUAGZCH-JQWIXIFHSA-N 2 0 236.334 2.010 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@H](C)Cc1ccc(C)cc1 ZINC001246315111 987720376 /nfs/dbraw/zinc/72/03/76/987720376.db2.gz HFYGSEBLQLLDDY-TZMCWYRMSA-N 2 0 220.360 2.253 20 0 BEADRP C[C@@H]1C[C@H](n2ccc3cccc(C[NH3+])c32)CC[NH2+]1 ZINC001246325897 987730720 /nfs/dbraw/zinc/73/07/20/987730720.db2.gz KISDGNYIKRWDEW-BXUZGUMPSA-N 2 0 243.354 2.413 20 0 BEADRP CC(C)([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccncc1 ZINC001246327028 987735752 /nfs/dbraw/zinc/73/57/52/987735752.db2.gz HMZACSGXSYGHOD-PBWFPOADSA-N 2 0 245.370 2.189 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC2(c3ccccc3)CC2)CC[NH2+]1 ZINC001246332556 987737180 /nfs/dbraw/zinc/73/71/80/987737180.db2.gz NHYSUHWANAFJHT-UKRRQHHQSA-N 2 0 244.382 2.448 20 0 BEADRP c1cc2ccc(C[NH2+]C3CC[NH2+]CC3)cc2o1 ZINC001246330667 987737898 /nfs/dbraw/zinc/73/78/98/987737898.db2.gz XIGGZUGVDDGYLW-UHFFFAOYSA-N 2 0 230.311 2.274 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCCCCCCCO)CC[NH2+]1 ZINC001246340596 987747566 /nfs/dbraw/zinc/74/75/66/987747566.db2.gz IWBZJKRDZQPOMG-ZIAGYGMSSA-N 2 0 242.407 2.049 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+][C@@H]2CC[NH2+][C@@H](C)C2)CC1 ZINC001246358634 987769048 /nfs/dbraw/zinc/76/90/48/987769048.db2.gz GAZAVGXSJNBHAV-WUHRBBMRSA-N 2 0 210.365 2.295 20 0 BEADRP C[NH2+]CC[C@@H](C)[NH2+]CCc1ccc2[nH]ccc2c1 ZINC001246365276 987770200 /nfs/dbraw/zinc/77/02/00/987770200.db2.gz OXHJCIWVTZOCSF-GFCCVEGCSA-N 2 0 245.370 2.298 20 0 BEADRP C[NH2+]CC[C@H](C)[NH2+]CCc1ccc2[nH]ccc2c1 ZINC001246365279 987773187 /nfs/dbraw/zinc/77/31/87/987773187.db2.gz OXHJCIWVTZOCSF-LBPRGKRZSA-N 2 0 245.370 2.298 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CC2Cc3ccccc3C2)CC[NH2+]1 ZINC001246378643 987777304 /nfs/dbraw/zinc/77/73/04/987777304.db2.gz XXVHFXVHSSFDOW-BLLLJJGKSA-N 2 0 244.382 2.132 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]C(C)(C)CC2CC2)CC[NH2+]1 ZINC001246396419 987784488 /nfs/dbraw/zinc/78/44/88/987784488.db2.gz ZQABMZRUPMOBFC-JQWIXIFHSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C[C@H]2CCC(C)(C)C2)C[NH2+]1 ZINC001246437247 987799661 /nfs/dbraw/zinc/79/96/61/987799661.db2.gz UMQDKCHMZIZFBS-GRYCIOLGSA-N 2 0 210.365 2.153 20 0 BEADRP CCCC[C@H](CCC)[NH2+][C@@H]1CC12C[NH2+]C2 ZINC001246444277 987801500 /nfs/dbraw/zinc/80/15/00/987801500.db2.gz JUZZDLDQXSYVRS-NWDGAFQWSA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@H](C)C[C@H](CC)[NH2+][C@@H]1CC12C[NH2+]C2 ZINC001246445289 987802180 /nfs/dbraw/zinc/80/21/80/987802180.db2.gz NSVMTLAYDUHRQA-SDDRHHMPSA-N 2 0 210.365 2.153 20 0 BEADRP CCCC[C@@H](CCC)[NH2+][C@H]1CC12C[NH2+]C2 ZINC001246444276 987803329 /nfs/dbraw/zinc/80/33/29/987803329.db2.gz JUZZDLDQXSYVRS-NEPJUHHUSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@H]2CC23C[NH2+]C3)CC(C)(C)C1 ZINC001246446374 987806314 /nfs/dbraw/zinc/80/63/14/987806314.db2.gz RVUOZNJFFHKOGN-UTUOFQBUSA-N 2 0 222.376 2.153 20 0 BEADRP CC[C@@]1(C[NH2+]C2Cc3ccccc3C2)CCC[NH2+]1 ZINC001246454199 987809395 /nfs/dbraw/zinc/80/93/95/987809395.db2.gz ALKQZAMUADKRQL-INIZCTEOSA-N 2 0 244.382 2.276 20 0 BEADRP C[NH2+][C@H]1C[C@H]([NH2+][C@@H](C)Cc2ccc(C)cc2)C1 ZINC001246462417 987822587 /nfs/dbraw/zinc/82/25/87/987822587.db2.gz RLYQEELPIZHYRM-QEJZJMRPSA-N 2 0 232.371 2.266 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCc3sccc32)CC[NH2+]1 ZINC001246475191 987830871 /nfs/dbraw/zinc/83/08/71/987830871.db2.gz SLSPOPSQMMRRHO-CKYFFXLPSA-N 2 0 236.384 2.466 20 0 BEADRP C[C@@H]1CC([NH2+]C[C@@H]2CC[NH2+]C[C@@H]2F)C[C@@H](C)C1 ZINC001246477337 987834509 /nfs/dbraw/zinc/83/45/09/987834509.db2.gz OIRZUGRAXYRXCR-MNXVOIDGSA-N 2 0 242.382 2.348 20 0 BEADRP CCC[C@@H](CC)[NH2+]C[C@@H]1CC[NH2+]C[C@@H]1F ZINC001246477841 987835355 /nfs/dbraw/zinc/83/53/55/987835355.db2.gz QUFYUBXACWUXCI-TUAOUCFPSA-N 2 0 216.344 2.102 20 0 BEADRP CCCC[C@H](C)[NH2+]C[C@@H]1CC[NH2+]C[C@@H]1F ZINC001246478144 987835728 /nfs/dbraw/zinc/83/57/28/987835728.db2.gz SVTZAPGMORWTKC-SRVKXCTJSA-N 2 0 216.344 2.102 20 0 BEADRP C[C@H]1CCC[C@H]([NH2+][C@H]2CCCC[C@H]2[NH3+])C1 ZINC001246478299 987838032 /nfs/dbraw/zinc/83/80/32/987838032.db2.gz NVQUPGQWFQHGHG-RVMXOQNASA-N 2 0 210.365 2.425 20 0 BEADRP [NH3+]Cc1cc2cccc(F)c2n1[C@H]1CCC[NH2+]C1 ZINC001246479450 987838104 /nfs/dbraw/zinc/83/81/04/987838104.db2.gz SQDXUGACJYDQQQ-NSHDSACASA-N 2 0 247.317 2.164 20 0 BEADRP C[C@H]1CCC[C@@H]([NH2+][C@H]2CCCC[C@H]2[NH3+])C1 ZINC001246478297 987839276 /nfs/dbraw/zinc/83/92/76/987839276.db2.gz NVQUPGQWFQHGHG-LOWDOPEQSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@H]1[NH2+][C@@H]1CC[NH2+][C@H](C)C1 ZINC001246493607 987848143 /nfs/dbraw/zinc/84/81/43/987848143.db2.gz ILPDFIFQCOYMSG-MLGHIDQZSA-N 2 0 210.365 2.151 20 0 BEADRP C[NH2+][C@H]1C[C@@H]([NH2+]C2CCC(C)(C)CC2)C1 ZINC001246499075 987854651 /nfs/dbraw/zinc/85/46/51/987854651.db2.gz SBAIVIGAKZCHDU-TXEJJXNPSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H]1C[C@H]([NH2+]C23CC([NH3+])(C2)C3)CC(C)(C)C1 ZINC001246506507 987858753 /nfs/dbraw/zinc/85/87/53/987858753.db2.gz WMUPNWIZAFHLDU-BCVKRFQSSA-N 2 0 222.376 2.425 20 0 BEADRP CCCCCC[C@@H](C)[N@@H+]1CCO[C@H](CC[NH3+])C1 ZINC001246536660 987894710 /nfs/dbraw/zinc/89/47/10/987894710.db2.gz VULAOWJBJXVVDT-ZIAGYGMSSA-N 2 0 242.407 2.395 20 0 BEADRP CC[C@@H](C)OCC[C@H](C)[N@@H+]1C[C@H](C)[C@H](C[NH3+])C1 ZINC001246538453 987898264 /nfs/dbraw/zinc/89/82/64/987898264.db2.gz CCUVMRDCXGJJMG-IGQOVBAYSA-N 2 0 242.407 2.107 20 0 BEADRP C[C@H]1c2ccccc2CC[N@@H+]1C1CC[NH2+]CC1 ZINC001246547770 987930509 /nfs/dbraw/zinc/93/05/09/987930509.db2.gz NPZLGYJUTKSJAF-LBPRGKRZSA-N 2 0 230.355 2.358 20 0 BEADRP CCC(CC)[N@@H+]1CCC[C@](F)(C[NH3+])CC1 ZINC001246549380 987936016 /nfs/dbraw/zinc/93/60/16/987936016.db2.gz MFFFJNKNWGKWEY-GFCCVEGCSA-N 2 0 216.344 2.328 20 0 BEADRP C[C@@H](CC(F)(F)F)[N@@H+]1CCC[C@H]([NH3+])CC1 ZINC001246548208 987938114 /nfs/dbraw/zinc/93/81/14/987938114.db2.gz SUJLEHKQVXJYME-IUCAKERBSA-N 2 0 224.270 2.141 20 0 BEADRP C[C@H](Cc1ccco1)[N@@H+]1CCC[C@@](C)([NH3+])CC1 ZINC001246547899 987940392 /nfs/dbraw/zinc/94/03/92/987940392.db2.gz CZWUYTFNVDVXFN-TZMCWYRMSA-N 2 0 236.359 2.414 20 0 BEADRP C[NH2+]C[C@H]1CCC[N@@H+]([C@@H]2C[C@@H]3[C@H](C2)C3(C)C)C1 ZINC001246549959 987947469 /nfs/dbraw/zinc/94/74/69/987947469.db2.gz LAQBWAJWQVJKGT-SYQHCUMBSA-N 2 0 236.403 2.352 20 0 BEADRP CCSC[C@H](C)[N@@H+]1CC[C@H](C)[C@@H](C[NH3+])CC1 ZINC001246555737 987964484 /nfs/dbraw/zinc/96/44/84/987964484.db2.gz GAKMJGFCRLIZSJ-RWMBFGLXSA-N 2 0 244.448 2.435 20 0 BEADRP CCSC[C@@H](C)[N@@H+]1CCC[C@@](C)([NH3+])CC1 ZINC001246556423 987966678 /nfs/dbraw/zinc/96/66/78/987966678.db2.gz ZRJCJXVVEBJJOO-VXGBXAGGSA-N 2 0 230.421 2.331 20 0 BEADRP CSCC[C@H](C)[N@@H+]1CC[C@@H](C)[C@@H](C[NH3+])CC1 ZINC001246555390 987968034 /nfs/dbraw/zinc/96/80/34/987968034.db2.gz DVSIYTSHRDEUAG-FRRDWIJNSA-N 2 0 244.448 2.435 20 0 BEADRP CCSC[C@@H](C)[N@@H+]1CCC[C@@](F)(C[NH3+])CC1 ZINC001246557293 987973622 /nfs/dbraw/zinc/97/36/22/987973622.db2.gz KKUIOOFCGJDLNN-NEPJUHHUSA-N 2 0 248.411 2.281 20 0 BEADRP CCOCC[C@H](C)[N@@H+]1CC[C@@H](C)[C@H](C[NH3+])CC1 ZINC001246557353 987977538 /nfs/dbraw/zinc/97/75/38/987977538.db2.gz KQYSUULNKBPTPX-RDBSUJKOSA-N 2 0 242.407 2.108 20 0 BEADRP C[C@@H]1CC[N@@H+](C2CCCC2)CC[C@H]1C[NH3+] ZINC001246558591 987978399 /nfs/dbraw/zinc/97/83/99/987978399.db2.gz MQPYQKBLGQPPRI-NEPJUHHUSA-N 2 0 210.365 2.236 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H](C)CCC(F)(F)F ZINC001118057452 987994319 /nfs/dbraw/zinc/99/43/19/987994319.db2.gz QVJOGXRAZMXNLL-RKDXNWHRSA-N 2 0 226.286 2.305 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@@H](C)c1ccc(C)nc1C ZINC001118058475 987997505 /nfs/dbraw/zinc/99/75/05/987997505.db2.gz KONKVPAVUFVXRY-JQWIXIFHSA-N 2 0 235.375 2.347 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H]1CCC[C@H]2C[C@]21C ZINC001118060110 987999039 /nfs/dbraw/zinc/99/90/39/987999039.db2.gz WAQUTABPSOTCKY-YVECIDJPSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1C[C@@H]([N@@H+]2CCC(F)(F)[C@@H](C)C2)CC[NH2+]1 ZINC001246562936 988008901 /nfs/dbraw/zinc/00/89/01/988008901.db2.gz IKNHWNOWWILWQV-AXFHLTTASA-N 2 0 232.318 2.104 20 0 BEADRP [NH3+]CCCC[NH2+][C@@H]1CCc2c1cc(F)cc2F ZINC001118121208 988019522 /nfs/dbraw/zinc/01/95/22/988019522.db2.gz BPMRCGTWSHLFKD-CYBMUJFWSA-N 2 0 240.297 2.281 20 0 BEADRP F[C@@H]1CCCC[N@@H+](C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC001246568999 988036285 /nfs/dbraw/zinc/03/62/85/988036285.db2.gz ULALOPODSKWINL-FKJOKYEKSA-N 2 0 226.339 2.093 20 0 BEADRP CSC(C)(C)C[C@@H](C)[N@@H+]1C[C@@H](C)[C@H]([NH3+])C1 ZINC001246569030 988041996 /nfs/dbraw/zinc/04/19/96/988041996.db2.gz UQJRYHFFWGSONC-GMTAPVOTSA-N 2 0 230.421 2.186 20 0 BEADRP CCOCC[C@H](C)[N@@H+]1CCC[C@@](C)(C[NH3+])CC1 ZINC001246571265 988061029 /nfs/dbraw/zinc/06/10/29/988061029.db2.gz AREYRNVZLFEHKS-UONOGXRCSA-N 2 0 242.407 2.252 20 0 BEADRP C[C@]1(C[NH3+])CCC[N@@H+]([C@H]2CCCSC2)CC1 ZINC001246579961 988096910 /nfs/dbraw/zinc/09/69/10/988096910.db2.gz VOUGVAJGNLRLPA-STQMWFEESA-N 2 0 242.432 2.333 20 0 BEADRP C[C@]1(C[NH3+])CCC[N@@H+](C2CCCC2)CC1 ZINC001246581075 988111081 /nfs/dbraw/zinc/11/10/81/988111081.db2.gz XOLCNYMXUPWAMY-ZDUSSCGKSA-N 2 0 210.365 2.380 20 0 BEADRP C[C@@H]1C[C@@H]([N@@H+]2CCCC[C@@](C)(C[NH3+])C2)CCO1 ZINC001246585589 988131132 /nfs/dbraw/zinc/13/11/32/988131132.db2.gz PIEDEAYFKWHYIY-RDBSUJKOSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@@H](Cc1ccccn1)[N@@H+]1CCCC[C@@H](C[NH3+])C1 ZINC001246592529 988179802 /nfs/dbraw/zinc/17/98/02/988179802.db2.gz KBGCQTOZJRHHAP-KBPBESRZSA-N 2 0 247.386 2.073 20 0 BEADRP CC[C@@H](Cc1ccccc1)[NH+]1CC(C[NH2+]C)C1 ZINC001246598691 988197520 /nfs/dbraw/zinc/19/75/20/988197520.db2.gz OJLHXNKTYOITGK-HNNXBMFYSA-N 2 0 232.371 2.159 20 0 BEADRP CSC(C)(C)C[C@@H](C)[NH+]1CC(C)(C[NH3+])C1 ZINC001246601455 988202428 /nfs/dbraw/zinc/20/24/28/988202428.db2.gz VJZIGWPEXQZRND-SNVBAGLBSA-N 2 0 230.421 2.187 20 0 BEADRP Cc1ccc(C[C@H](C)[NH+]2CC(C)(C[NH3+])C2)cc1 ZINC001246600491 988209560 /nfs/dbraw/zinc/20/95/60/988209560.db2.gz SWVGIZQLCJZSMJ-ZDUSSCGKSA-N 2 0 232.371 2.207 20 0 BEADRP CC1(C[NH3+])C[NH+](C2CCCCCCC2)C1 ZINC001246603435 988216024 /nfs/dbraw/zinc/21/60/24/988216024.db2.gz YLXKXWYWRKULCG-UHFFFAOYSA-N 2 0 210.365 2.380 20 0 BEADRP CSCC[C@@H](C)[N@@H+]1CCC[C@]12CCC[NH2+]C2 ZINC001246609746 988227641 /nfs/dbraw/zinc/22/76/41/988227641.db2.gz NAGCSMWTWLXONL-OLZOCXBDSA-N 2 0 242.432 2.346 20 0 BEADRP CCOCC[C@@H](C)[N@@H+]1CCC[C@@]12CCC[NH2+]C2 ZINC001246613408 988241274 /nfs/dbraw/zinc/24/12/74/988241274.db2.gz ZDXWKRBGOBWYOT-ZIAGYGMSSA-N 2 0 240.391 2.020 20 0 BEADRP C[C@H](CC1CC1)[N@@H+]1CCC[C@]12CCC[NH2+]C2 ZINC001246613397 988243636 /nfs/dbraw/zinc/24/36/36/988243636.db2.gz YWYDPKQYAJYZID-OCCSQVGLSA-N 2 0 222.376 2.393 20 0 BEADRP CCOCC[C@H](C)[N@@H+]1CCC[C@]12CCC[NH2+]C2 ZINC001246613405 988243803 /nfs/dbraw/zinc/24/38/03/988243803.db2.gz ZDXWKRBGOBWYOT-KBPBESRZSA-N 2 0 240.391 2.020 20 0 BEADRP CCCC[C@H](C)[NH+]1CCC(F)(C[NH3+])CC1 ZINC001246629840 988302048 /nfs/dbraw/zinc/30/20/48/988302048.db2.gz QCRGRRHTYVLMGM-NSHDSACASA-N 2 0 216.344 2.328 20 0 BEADRP C[C@H]1CCC[C@@H]([N@@H+]2CC[C@@H]3[NH2+]CC[C@H]32)C1 ZINC001246629656 988302722 /nfs/dbraw/zinc/30/27/22/988302722.db2.gz FQPZPGIEUVFHPP-QNWHQSFQSA-N 2 0 208.349 2.001 20 0 BEADRP CC[C@H](CC(C)C)[N@@H+]1CC[C@]2(CC[NH2+]C2)C1 ZINC001246631782 988313078 /nfs/dbraw/zinc/31/30/78/988313078.db2.gz SIOPDWHSQXIUHE-KGLIPLIRSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2CC[C@@H]3CC[NH2+][C@@H]3C2)C[C@@H]1C ZINC001246633932 988313369 /nfs/dbraw/zinc/31/33/69/988313369.db2.gz FQOUEQOTGNGDOG-CAEXGNQWSA-N 2 0 236.403 2.495 20 0 BEADRP CC1(C)CC[C@@H]([N@@H+]2CC[C@@H]3[NH2+]CC[C@H]32)C1 ZINC001246633725 988319378 /nfs/dbraw/zinc/31/93/78/988319378.db2.gz LXMAQSREJVZZSX-GRYCIOLGSA-N 2 0 208.349 2.001 20 0 BEADRP CCCCC[C@@H](C)N1CC[C@@H]2[NH2+]CC[C@H]21 ZINC001246635543 988332995 /nfs/dbraw/zinc/33/29/95/988332995.db2.gz SOXZOOXOMPSSCJ-FRRDWIJNSA-N 2 0 210.365 2.391 20 0 BEADRP CC1(C)CC[C@@H]([N@@H+]2CC[C@H]3[NH2+]CC[C@H]32)C1 ZINC001246638516 988340452 /nfs/dbraw/zinc/34/04/52/988340452.db2.gz LXMAQSREJVZZSX-IJLUTSLNSA-N 2 0 208.349 2.001 20 0 BEADRP C[C@@H]1CC[C@@H]([N@@H+]2CC[C@@H]3[NH2+]CC[C@H]32)C[C@@H]1C ZINC001246647146 988366019 /nfs/dbraw/zinc/36/60/19/988366019.db2.gz ZEYVORMFGNMNBC-XHJNMGKDSA-N 2 0 222.376 2.247 20 0 BEADRP CCCC[C@H](CC)[N@@H+]1C[C@@H]2CC[NH2+][C@@H]2C1 ZINC001246654928 988375634 /nfs/dbraw/zinc/37/56/34/988375634.db2.gz XRPPFQXSFHRTQZ-RWMBFGLXSA-N 2 0 210.365 2.249 20 0 BEADRP CC1(C)[C@@H]2C[C@H]([N@@H+]3C[C@H]4CCC[NH2+][C@H]4C3)C[C@@H]21 ZINC001246655389 988381997 /nfs/dbraw/zinc/38/19/97/988381997.db2.gz HPOUQBDEMLCUHL-RGDJUOJXSA-N 2 0 234.387 2.105 20 0 BEADRP CCCC[C@H](CC(C)C)[N@H+]1C[C@@H]2[C@@H]([NH3+])[C@@H]2C1 ZINC001246657456 988387331 /nfs/dbraw/zinc/38/73/31/988387331.db2.gz MHCHQAMZUXPSLY-MQYQWHSLSA-N 2 0 224.392 2.480 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2C[C@H]3CCC[NH2+][C@H]3C2)C[C@H]1C ZINC001246661420 988397974 /nfs/dbraw/zinc/39/79/74/988397974.db2.gz XDSBXHAHRYUXKM-ZSAUSMIDSA-N 2 0 236.403 2.495 20 0 BEADRP CC[C@H]1CC[C@@H]([N@@H+]2C[C@H]3CCC[NH2+][C@H]3C2)C1 ZINC001246662295 988400998 /nfs/dbraw/zinc/40/09/98/988400998.db2.gz ZJCUOSUOCJVSCZ-DGAVXFQQSA-N 2 0 222.376 2.249 20 0 BEADRP CC[C@H]1CC[C@@H]([N@@H+]2C[C@H]3CCC[C@@]3([NH3+])C2)C1 ZINC001246666799 988410102 /nfs/dbraw/zinc/41/01/02/988410102.db2.gz RTBDHAAIRCJBPT-REWJHTLYSA-N 2 0 222.376 2.378 20 0 BEADRP CC[C@H](C)C[C@H](CC)[N@@H+]1C[C@H]2C[NH2+]CC[C@@H]21 ZINC001246678695 988427176 /nfs/dbraw/zinc/42/71/76/988427176.db2.gz YHNIMPGABQSGSR-CRWXNKLISA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1C[C@@H]([N@@H+]2CC[C@@H](c3ccncc3)C2)CC[NH2+]1 ZINC001246774105 988453779 /nfs/dbraw/zinc/45/37/79/988453779.db2.gz COTYVIFTYIEHGP-YUELXQCFSA-N 2 0 245.370 2.011 20 0 BEADRP C[C@H]1C[C@H]([N@H+](C)CCOc2ccccc2)CC[NH2+]1 ZINC001246782722 988461785 /nfs/dbraw/zinc/46/17/85/988461785.db2.gz ULLLNXWVVYVOSL-UONOGXRCSA-N 2 0 248.370 2.138 20 0 BEADRP C[C@@H]1C[C@@H]([N@@H+]2CC[C@@H](c3cccnc3)C2)CC[NH2+]1 ZINC001246790774 988466819 /nfs/dbraw/zinc/46/68/19/988466819.db2.gz HMDUONJATYGBMD-YUELXQCFSA-N 2 0 245.370 2.011 20 0 BEADRP CCCOC1CC[NH+]([C@@H]2CC[NH2+][C@H](C)C2)CC1 ZINC001246788743 988467268 /nfs/dbraw/zinc/46/72/68/988467268.db2.gz ILBKGFYXUYPZJH-CHWSQXEVSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2CC[C@@H](c3cccnc3)C2)CC[NH2+]1 ZINC001246790549 988468438 /nfs/dbraw/zinc/46/84/38/988468438.db2.gz HMDUONJATYGBMD-BPLDGKMQSA-N 2 0 245.370 2.011 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2CC[C@H](c3ccccn3)C2)CC[NH2+]1 ZINC001246791639 988470163 /nfs/dbraw/zinc/47/01/63/988470163.db2.gz HPVMTQRQRWKPPA-HZSPNIEDSA-N 2 0 245.370 2.011 20 0 BEADRP C[C@@H]1C[C@@H]([N@@H+]2CCC[C@H](C(F)F)C2)CC[NH2+]1 ZINC001246810672 988489104 /nfs/dbraw/zinc/48/91/04/988489104.db2.gz YOMQIUPEFALBEJ-VWYCJHECSA-N 2 0 232.318 2.104 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2CCC[C@H](C(F)F)C2)CC[NH2+]1 ZINC001246810671 988490636 /nfs/dbraw/zinc/49/06/36/988490636.db2.gz YOMQIUPEFALBEJ-OUAUKWLOSA-N 2 0 232.318 2.104 20 0 BEADRP C[C@H]1C[C@@H](N2Cc3cccc(F)c3C2)CC[NH2+]1 ZINC001246822647 988511560 /nfs/dbraw/zinc/51/15/60/988511560.db2.gz MHQYRXXJVDGHES-JQWIXIFHSA-N 2 0 234.318 2.282 20 0 BEADRP Fc1cccc([C@@H]2CC[N@@H+](C3CC[NH2+]CC3)C2)c1 ZINC001246832788 988528263 /nfs/dbraw/zinc/52/82/63/988528263.db2.gz IURXZCAWELLNCH-CYBMUJFWSA-N 2 0 248.345 2.367 20 0 BEADRP C[C@H]1C[C@@H]([N@@H+]2CCC[C@@H]2c2cccnc2)CC[NH2+]1 ZINC001246834768 988535486 /nfs/dbraw/zinc/53/54/86/988535486.db2.gz GRIWUJRGCQAVSH-AEGPPILISA-N 2 0 245.370 2.359 20 0 BEADRP C[C@H]1C[C@H]([N@@H+]2C[C@H]3CC[C@@]3([NH3+])C2)C[C@@H](C)C1 ZINC001246852233 988571354 /nfs/dbraw/zinc/57/13/54/988571354.db2.gz ICDFBZXQVJUZAV-XHJNMGKDSA-N 2 0 222.376 2.234 20 0 BEADRP Cc1ccc([C@H]2CCC[N@@H+]2C2CC[NH2+]CC2)cn1 ZINC001246862667 988599839 /nfs/dbraw/zinc/59/98/39/988599839.db2.gz MLEPOGRKNVRYDT-OAHLLOKOSA-N 2 0 245.370 2.279 20 0 BEADRP [NH3+][C@]12CC[C@H]1C[N@@H+](C1CCCCCC1)C2 ZINC001246862765 988601935 /nfs/dbraw/zinc/60/19/35/988601935.db2.gz RHYPIDMGCSDFNF-AAEUAGOBSA-N 2 0 208.349 2.132 20 0 BEADRP CCC[C@H](CC)[N@@H+]1C[C@H]2CC[C@@H](C1)[NH2+]C2 ZINC001246862805 988612864 /nfs/dbraw/zinc/61/28/64/988612864.db2.gz DRGCVQCDCYOLRA-AVGNSLFASA-N 2 0 210.365 2.249 20 0 BEADRP C[C@H]1C[C@H]([N@@H+]2C[C@H]3CC[C@@H](C2)[NH2+]C3)C[C@@H](C)C1 ZINC001246867366 988618757 /nfs/dbraw/zinc/61/87/57/988618757.db2.gz OEVQJGQZKMAOAK-AIEDFZFUSA-N 2 0 236.403 2.495 20 0 BEADRP CC1(C)CC[C@@H]([N@@H+]2C[C@H]3CC[C@@H](C2)[NH2+]C3)C1 ZINC001246869139 988627217 /nfs/dbraw/zinc/62/72/17/988627217.db2.gz UDPABTPUZJSKJE-RWMBFGLXSA-N 2 0 222.376 2.249 20 0 BEADRP CC[C@@H]1CC[C@H]([N@@H+]2C[C@H]3CC[C@@H](C2)[NH2+]C3)C1 ZINC001246869914 988627606 /nfs/dbraw/zinc/62/76/06/988627606.db2.gz XKPSIEJAOZTTIT-RFGFWPKPSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@@H]1C[N@H+]([C@H]2CC[C@@H](C)[NH2+]C2)C2(CC2)C1 ZINC001246893434 988656943 /nfs/dbraw/zinc/65/69/43/988656943.db2.gz KUHBMHPBTLFWDA-TUAOUCFPSA-N 2 0 208.349 2.001 20 0 BEADRP C[C@H]1C[N@H+]([C@H]2CC[NH2+][C@H](C)C2)C2(CC2)C1 ZINC001246895961 988671460 /nfs/dbraw/zinc/67/14/60/988671460.db2.gz RKWFQJWLQWPNCK-UTUOFQBUSA-N 2 0 208.349 2.001 20 0 BEADRP COc1cccc(C[C@@H](C)N2CCC[C@@H]2C[NH3+])c1 ZINC001246916708 988720993 /nfs/dbraw/zinc/72/09/93/988720993.db2.gz OXXCMJUCQIUHJM-TZMCWYRMSA-N 2 0 248.370 2.049 20 0 BEADRP CC1(C)CC[C@@H]([N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)C1 ZINC001246931932 988761666 /nfs/dbraw/zinc/76/16/66/988761666.db2.gz NYPDDDOTYZQJDM-HZSPNIEDSA-N 2 0 236.403 2.497 20 0 BEADRP CC[C@@H]1CC[C@@H]([N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)C1 ZINC001246941954 988773006 /nfs/dbraw/zinc/77/30/06/988773006.db2.gz MVMVGWALVRBVLB-APIJFGDWSA-N 2 0 236.403 2.497 20 0 BEADRP CC(C)C1CCC([N@H+](C)[C@@H]2[C@H]3C[NH2+]C[C@H]32)CC1 ZINC001246950372 988784902 /nfs/dbraw/zinc/78/49/02/988784902.db2.gz WZLOFXMWJMVQMX-QSCRHYGLSA-N 2 0 236.403 2.351 20 0 BEADRP C[C@@H]1C[C@@H]([N@H+](C)[C@@H]2[C@H]3C[NH2+]C[C@H]32)CC(C)(C)C1 ZINC001246951118 988785256 /nfs/dbraw/zinc/78/52/56/988785256.db2.gz ZPUXOAYWKXMCEZ-POQQGIQPSA-N 2 0 236.403 2.351 20 0 BEADRP CC(C)CCC[C@@H](C)[N@H+](C)[C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001246947499 988786437 /nfs/dbraw/zinc/78/64/37/988786437.db2.gz LETQSPRTROQNEE-MQYQWHSLSA-N 2 0 224.392 2.351 20 0 BEADRP C[C@H]1CC[C@H]([N@H+](C)C2CC[NH2+]CC2)CC1 ZINC001246994796 988827993 /nfs/dbraw/zinc/82/79/93/988827993.db2.gz CTWAHFAJADYRJB-HAQNSBGRSA-N 2 0 210.365 2.249 20 0 BEADRP CC1(C)[C@@H]2C[C@@H](N3CC[C@@H]4[NH2+]CCC[C@H]4C3)C[C@@H]21 ZINC001247016732 988843695 /nfs/dbraw/zinc/84/36/95/988843695.db2.gz XNSNGCQBUWHFIX-LXFSFDBISA-N 2 0 248.414 2.495 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]C[C@@H](C)CC(C)C ZINC001325267205 989139127 /nfs/dbraw/zinc/13/91/27/989139127.db2.gz KHAAIIFBUXMTCU-NWDGAFQWSA-N 2 0 200.370 2.256 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H](C)CSC(C)(C)C ZINC001325743317 989250688 /nfs/dbraw/zinc/25/06/88/989250688.db2.gz LBMNBQSDHQHNJB-QWRGUYRKSA-N 2 0 232.437 2.352 20 0 BEADRP CC[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)C2(Cl)CC2)C1 ZINC001119623187 989253778 /nfs/dbraw/zinc/25/37/78/989253778.db2.gz FWZKVHVFIQLMFM-NWDGAFQWSA-N 2 0 244.810 2.468 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@H](C)c1ccsc1 ZINC001326036645 989324226 /nfs/dbraw/zinc/32/42/26/989324226.db2.gz SCEGVVGEDFYBBS-VHSXEESVSA-N 2 0 212.362 2.397 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@H]1CCCc2ccc(O)cc21 ZINC001326037494 989337017 /nfs/dbraw/zinc/33/70/17/989337017.db2.gz XETCPMPZNUKOCA-NHYWBVRUSA-N 2 0 248.370 2.357 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]Cc1cccc2c1CCC2 ZINC001326414419 989550332 /nfs/dbraw/zinc/55/03/32/989550332.db2.gz RBBKEXHYQVVUIS-LBPRGKRZSA-N 2 0 232.371 2.263 20 0 BEADRP C[NH+](C)CCCC[NH2+]Cc1cccn1C1CC1 ZINC001326431642 989554149 /nfs/dbraw/zinc/55/41/49/989554149.db2.gz YXWQDQXDUVRXAN-UHFFFAOYSA-N 2 0 235.375 2.254 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]Cc1ccc2c(c1)CCC2 ZINC001326459424 989569814 /nfs/dbraw/zinc/56/98/14/989569814.db2.gz OIUNSCVMIMNJSE-NEPJUHHUSA-N 2 0 232.371 2.391 20 0 BEADRP C[C@@H]([NH2+]Cc1cccc(C(F)F)c1)C1C[NH2+]C1 ZINC001326472843 989572132 /nfs/dbraw/zinc/57/21/32/989572132.db2.gz DWFNNNXLMXONJP-SECBINFHSA-N 2 0 240.297 2.322 20 0 BEADRP C[NH+](C)CC1(CNc2cc[nH+]cc2)CCCC1 ZINC001120779291 989875155 /nfs/dbraw/zinc/87/51/55/989875155.db2.gz DAFFTXLDYIZXGI-UHFFFAOYSA-N 2 0 233.359 2.037 20 0 BEADRP c1cc(N2CC[C@H]([NH+]3CCCCC3)C2)cc[nH+]1 ZINC001120860691 989932506 /nfs/dbraw/zinc/93/25/06/989932506.db2.gz RDCPVTOUBRPDLI-AWEZNQCLSA-N 2 0 231.343 2.146 20 0 BEADRP [NH3+]Cc1cccc(-c2ccc3c(c2)C[C@@H]([NH3+])C3)c1 ZINC001526676645 990169169 /nfs/dbraw/zinc/16/91/69/990169169.db2.gz OTXQYCNXDSVLNK-INIZCTEOSA-N 2 0 238.334 2.238 20 0 BEADRP C[C@H](Cc1ccco1)[N@H+](C)CCC[NH+](C)C ZINC001258184534 991089120 /nfs/dbraw/zinc/08/91/20/991089120.db2.gz DTEUEHRMLVARGH-GFCCVEGCSA-N 2 0 224.348 2.094 20 0 BEADRP CSCC[C@H](C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001258202721 991119971 /nfs/dbraw/zinc/11/99/71/991119971.db2.gz SLYIQRRSMKKALE-RVMXOQNASA-N 2 0 242.432 2.343 20 0 BEADRP C[C@H]1CC[N@@H+]1Cc1ccc(-n2ccnc2)cc1 ZINC001139355770 991228643 /nfs/dbraw/zinc/22/86/43/991228643.db2.gz APOIBIDXCBUTBG-LBPRGKRZSA-N 2 0 227.311 2.467 20 0 BEADRP CSC(C)(C)C[C@H](C)NC(=[NH2+])SCC[NH3+] ZINC001258321093 991236794 /nfs/dbraw/zinc/23/67/94/991236794.db2.gz GMJDZBKBGKMZBA-QMMMGPOBSA-N 2 0 249.449 2.123 20 0 BEADRP CC(C)C1CC([NH2+]C[C@H]2C[NH+]3CCC2CC3)C1 ZINC001308966713 991240519 /nfs/dbraw/zinc/24/05/19/991240519.db2.gz YRJJEEJZPKSMDS-SLTAFYQDSA-N 2 0 236.403 2.352 20 0 BEADRP CSC(C)(C)C[C@H](C)[N@@H+]1CCC[C@@H]([NH3+])C1 ZINC001258321846 991246655 /nfs/dbraw/zinc/24/66/55/991246655.db2.gz RYQNWXGVYYURQU-WDEREUQCSA-N 2 0 230.421 2.330 20 0 BEADRP CSC(C)(C)C[C@@H](C)NC(=[NH2+])SCC[NH3+] ZINC001258321092 991248263 /nfs/dbraw/zinc/24/82/63/991248263.db2.gz GMJDZBKBGKMZBA-MRVPVSSYSA-N 2 0 249.449 2.123 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@H]([NH2+]C3CC4(CCC4)C3)[C@H]2C1 ZINC001308983730 991252649 /nfs/dbraw/zinc/25/26/49/991252649.db2.gz AVYILQVSOFLQMX-UBHSHLNASA-N 2 0 234.387 2.249 20 0 BEADRP COc1ccc(CC[C@H](C)[NH2+]C2CC([NH3+])C2)cc1 ZINC001258393483 991346053 /nfs/dbraw/zinc/34/60/53/991346053.db2.gz TVGDBMFKVFRLLJ-XGNXJENSSA-N 2 0 248.370 2.096 20 0 BEADRP CCCCC[C@@H](CC)NC(=[NH2+])NCCCC[NH3+] ZINC001258429604 991356130 /nfs/dbraw/zinc/35/61/30/991356130.db2.gz ZUPKSAXTZUBNEU-GFCCVEGCSA-N 2 0 242.411 2.198 20 0 BEADRP C[C@H](CC1CC1)[N@@H+]1C[C@H]2C[C@@]2(C[NH+](C)C)C1 ZINC001258474602 991445519 /nfs/dbraw/zinc/44/55/19/991445519.db2.gz VBRJFJTZLWGLMH-MRVWCRGKSA-N 2 0 222.376 2.059 20 0 BEADRP C1[C@H]2CCC[C@H]([NH2+][C@H]3CC[N@@H+]4CCC[C@H]4C3)[C@@H]12 ZINC001560500813 991488322 /nfs/dbraw/zinc/48/83/22/991488322.db2.gz DNFJOCUWIWKGKC-QTVXIADOSA-N 2 0 234.387 2.391 20 0 BEADRP C[C@H](Cc1cccnc1)[N@H+](C)C1CCC([NH3+])CC1 ZINC001258612447 991534892 /nfs/dbraw/zinc/53/48/92/991534892.db2.gz WYOZJSHDQZBAIX-LRVUVFPRSA-N 2 0 247.386 2.214 20 0 BEADRP C[C@@H](Cc1cccnc1)[NH2+][C@H]1CCC[N@H+](C)CC1 ZINC001258613200 991536427 /nfs/dbraw/zinc/53/64/27/991536427.db2.gz LFBKMGKZFBDRFR-ZFWWWQNUSA-N 2 0 247.386 2.087 20 0 BEADRP CCC[C@@H](Cc1ccccc1)[NH2+]C1CC([NH3+])C1 ZINC001258650725 991585412 /nfs/dbraw/zinc/58/54/12/991585412.db2.gz BUSYIXUUDLWSQH-SLTAFYQDSA-N 2 0 232.371 2.477 20 0 BEADRP C[NH+](C)[C@@H](CNc1cc[nH+]cc1)c1ccccc1 ZINC001318998031 991761808 /nfs/dbraw/zinc/76/18/08/991761808.db2.gz XBSGBVOVNDCDTP-HNNXBMFYSA-N 2 0 241.338 2.218 20 0 BEADRP CC(C)CC(CC(C)C)[NH2+]CCOCC[NH3+] ZINC001258831213 991863067 /nfs/dbraw/zinc/86/30/67/991863067.db2.gz DFAKBNONALTJID-UHFFFAOYSA-N 2 0 230.396 2.012 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)n1ccnc1C[NH3+] ZINC001258897266 991890576 /nfs/dbraw/zinc/89/05/76/991890576.db2.gz HCQXEJZYIKCXFB-LBPRGKRZSA-N 2 0 238.379 2.025 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]C(C)(C)C(C)=O ZINC001258898479 991891511 /nfs/dbraw/zinc/89/15/11/991891511.db2.gz YEKPMQBVNLTFOF-GFCCVEGCSA-N 2 0 242.407 2.454 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1ccno1 ZINC001258897989 991891977 /nfs/dbraw/zinc/89/19/77/991891977.db2.gz QPIWNLNVOPTEOH-LBPRGKRZSA-N 2 0 239.363 2.275 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]CC[C@@H](C)CO ZINC001258903588 991893849 /nfs/dbraw/zinc/89/38/49/991893849.db2.gz UYGKWKLSNNNUIU-ZIAGYGMSSA-N 2 0 244.423 2.105 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H]1C[C@@H](OC)C1 ZINC001258900070 991894443 /nfs/dbraw/zinc/89/44/43/991894443.db2.gz ZOGUNUCGFJMPMO-MCIONIFRSA-N 2 0 242.407 2.264 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+]CCC1COC1 ZINC001258900118 991895764 /nfs/dbraw/zinc/89/57/64/991895764.db2.gz CXWBAOARZOBFFH-ZDUSSCGKSA-N 2 0 242.407 2.123 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@]1(C)CCOC1 ZINC001258904891 991896890 /nfs/dbraw/zinc/89/68/90/991896890.db2.gz MNBSTKUKSMZHOX-KGLIPLIRSA-N 2 0 242.407 2.266 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]Cc1cc(F)ccc1C ZINC001261370934 992277273 /nfs/dbraw/zinc/27/72/73/992277273.db2.gz ZENPRGWCOMLQIR-LLVKDONJSA-N 2 0 224.323 2.222 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@@H](C)c1cccs1 ZINC001261423760 992294330 /nfs/dbraw/zinc/29/43/30/992294330.db2.gz DAHIXXYBOXLDNM-UWVGGRQHSA-N 2 0 212.362 2.397 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H]1CCC12CCCC2 ZINC001261424065 992295162 /nfs/dbraw/zinc/29/51/62/992295162.db2.gz MGQXDUNXMQJFPR-VXGBXAGGSA-N 2 0 210.365 2.297 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+]CCCOCc1ccccc1 ZINC001261423440 992296354 /nfs/dbraw/zinc/29/63/54/992296354.db2.gz WFVPEWXVPGLZTO-LSDHHAIUSA-N 2 0 248.370 2.063 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CCc2cc(C)ccc21 ZINC001261423936 992296975 /nfs/dbraw/zinc/29/69/75/992296975.db2.gz JBEAKDVOAZDMPV-SWLSCSKDSA-N 2 0 232.371 2.427 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@H]([NH2+]CCC(C)(C)C)[C@@H]2C1 ZINC001474757050 992522841 /nfs/dbraw/zinc/52/28/41/992522841.db2.gz OTAHFWVGBKLQIC-XQQFMLRXSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]([NH3+])CN[C@@H](C)c1ccc(C(F)(F)F)nc1 ZINC001261891039 992565054 /nfs/dbraw/zinc/56/50/54/992565054.db2.gz WVHOLXPXNWASGR-SFYZADRCSA-N 2 0 247.264 2.098 20 0 BEADRP CC1=CCC[C@H](C)[C@@H]1C[NH2+][C@]1(C)CC[NH2+]C1 ZINC001573624537 992652199 /nfs/dbraw/zinc/65/21/99/992652199.db2.gz DFANJODFGQYOCM-BFHYXJOUSA-N 2 0 222.376 2.320 20 0 BEADRP C(C[N@@H+]1CC[C@H](C2CCC2)C1)[C@@H]1CC[NH2+]C1 ZINC001574773960 992898516 /nfs/dbraw/zinc/89/85/16/992898516.db2.gz HNPIXMNJYDCNHK-JSGCOSHPSA-N 2 0 222.376 2.108 20 0 BEADRP C(C[C@H]1CC[NH2+]C1)[NH2+][C@H]1C[C@@H]2CC[C@@H](C2)C1 ZINC001574774294 992898938 /nfs/dbraw/zinc/89/89/38/992898938.db2.gz KUFUGIUCDKMFFD-MQYQWHSLSA-N 2 0 222.376 2.154 20 0 BEADRP C1=C[C@H]2CC[C@@H](C1)[N@H+]2C[C@@H]1CCCC[NH2+]C1 ZINC001574774690 992903554 /nfs/dbraw/zinc/90/35/54/992903554.db2.gz PFUYORRKZXLQMX-HZSPNIEDSA-N 2 0 220.360 2.169 20 0 BEADRP C1=C[C@@H](C[NH2+]Cc2cccc3c2CC[NH2+]C3)CC1 ZINC001574773920 992903949 /nfs/dbraw/zinc/90/39/49/992903949.db2.gz GQWYOCPSWMTYJL-CYBMUJFWSA-N 2 0 242.366 2.388 20 0 BEADRP C1[C@@H]([NH2+]C2CC3(C2)CCCC3)C12CC[NH2+]CC2 ZINC001574798996 992908976 /nfs/dbraw/zinc/90/89/76/992908976.db2.gz BVFCHXWXECGCOT-CYBMUJFWSA-N 2 0 234.387 2.441 20 0 BEADRP C=C/C=C\CC[NH2+][C@@H]1CC[NH2+]CC[C@@H]1C ZINC001574887727 992935238 /nfs/dbraw/zinc/93/52/38/992935238.db2.gz ASRBXLRMFFLLAJ-OEFFGFFESA-N 2 0 208.349 2.096 20 0 BEADRP CC(C)(C)OC1CC([NH2+]CCCCCC[NH3+])C1 ZINC001575245944 993002228 /nfs/dbraw/zinc/00/22/28/993002228.db2.gz FMMMLVPPNFVEDN-UHFFFAOYSA-N 2 0 242.407 2.441 20 0 BEADRP C[NH+](C)[C@@H]1CCCN(c2cc[nH+]cc2)CC1 ZINC001262671687 993014041 /nfs/dbraw/zinc/01/40/41/993014041.db2.gz PFFDJTPBZDAPKA-GFCCVEGCSA-N 2 0 219.332 2.002 20 0 BEADRP CC(C)(C[NH2+]C[C@@H]1CCC[NH2+]C1)CC(F)F ZINC001575334098 993015098 /nfs/dbraw/zinc/01/50/98/993015098.db2.gz CYIDJGZFILSHEV-SNVBAGLBSA-N 2 0 234.334 2.257 20 0 BEADRP CC(C)[C@@H]1CCC[C@H]1[NH2+][C@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC001575497224 993056758 /nfs/dbraw/zinc/05/67/58/993056758.db2.gz CWNZDDBPJWBSJM-BJJPWKGXSA-N 2 0 222.376 2.294 20 0 BEADRP CC(C)[C@H]1[NH2+]CC12CC[NH+](CCCCF)CC2 ZINC001575525489 993061537 /nfs/dbraw/zinc/06/15/37/993061537.db2.gz ZWYNYQWJDAIDIP-CYBMUJFWSA-N 2 0 242.382 2.446 20 0 BEADRP CC(C)[C@H]1CC[N@@H+]1C[C@]1(C)CCC[NH2+]C1 ZINC001575508346 993062913 /nfs/dbraw/zinc/06/29/13/993062913.db2.gz SIFOZKDQKXBLQP-CHWSQXEVSA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)Oc1ccc(C[NH2+]C[C@H]2C[C@H]([NH3+])C2)cc1 ZINC001575806668 993105961 /nfs/dbraw/zinc/10/59/61/993105961.db2.gz RPPIEBQYOZQTLR-HDJSIYSDSA-N 2 0 248.370 2.301 20 0 BEADRP C[C@@H](C1CC1)[N@H+](C[C@H]1CC[C@@H]([NH3+])C1)C1CC1 ZINC001575911883 993124137 /nfs/dbraw/zinc/12/41/37/993124137.db2.gz KYQNNFWPUZEMLD-GMXVVIOVSA-N 2 0 222.376 2.377 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@H]1C[C@@H]2CC[C@@H](C2)C1 ZINC001575952868 993135822 /nfs/dbraw/zinc/13/58/22/993135822.db2.gz SUPZWLKMIWNBHI-WUHRBBMRSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]Cc1cccn1C1CC1 ZINC001575943231 993136563 /nfs/dbraw/zinc/13/65/63/993136563.db2.gz RTLBVLKLMYJVBF-LBPRGKRZSA-N 2 0 235.375 2.430 20 0 BEADRP C[C@@H](CCc1ccc(O)cc1)[NH2+]CC1([NH3+])CCC1 ZINC001575965864 993142709 /nfs/dbraw/zinc/14/27/09/993142709.db2.gz IFLGNALKKXSDJC-LBPRGKRZSA-N 2 0 248.370 2.184 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@H](C)[C@@H]1C[C@H]1C1CC1 ZINC001576152471 993190529 /nfs/dbraw/zinc/19/05/29/993190529.db2.gz IIYTVUUWYMKTIA-MMUTTWDGSA-N 2 0 210.365 2.136 20 0 BEADRP CC(C)[C@H](C[NH2+]C[C@H](C)[NH3+])c1ccccc1 ZINC001576159240 993199212 /nfs/dbraw/zinc/19/92/12/993199212.db2.gz OAYYXVKEVKHPMO-JSGCOSHPSA-N 2 0 220.360 2.363 20 0 BEADRP COc1ccc(C)cc1C[N@@H+]1CCC[C@H]([NH3+])CC1 ZINC000378788704 993204161 /nfs/dbraw/zinc/20/41/61/993204161.db2.gz MJYKBHDFJMFDSX-AWEZNQCLSA-N 2 0 248.370 2.317 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@H]([NH3+])C1(C)C)C1CCSCC1 ZINC001576234860 993225022 /nfs/dbraw/zinc/22/50/22/993225022.db2.gz ATOZAKASHFUDKE-ZMLRMANQSA-N 2 0 242.432 2.234 20 0 BEADRP C[C@@H]1CC([N@@H+]2CCCC[C@@H](C[NH3+])C2)C[C@@H](C)O1 ZINC000379928234 993299647 /nfs/dbraw/zinc/29/96/47/993299647.db2.gz TVMHHFDHKHFVSX-UPJWGTAASA-N 2 0 240.391 2.003 20 0 BEADRP C[NH+](C)C1CCC([NH2+]CCC2CC2)CC1 ZINC000379945260 993300054 /nfs/dbraw/zinc/30/00/54/993300054.db2.gz QJNWWMDJNIDLBN-UHFFFAOYSA-N 2 0 210.365 2.249 20 0 BEADRP CC1(C)[C@H]([NH3+])C[C@H]1[NH2+]C[C@@]1(C)C[C@H]2C[C@H]2C1 ZINC001576519045 993330945 /nfs/dbraw/zinc/33/09/45/993330945.db2.gz ITGQASGDCGPHLA-OJROKELRSA-N 2 0 222.376 2.138 20 0 BEADRP C[C@@]1(F)CCC[N@H+](CCC2CC[NH2+]CC2)C1 ZINC001576527915 993333367 /nfs/dbraw/zinc/33/33/67/993333367.db2.gz LNBXJXGNLRNHTN-CYBMUJFWSA-N 2 0 228.355 2.200 20 0 BEADRP CC1=CC[C@@H]([NH2+][C@H](C)C2CC[NH2+]CC2)CC1 ZINC001576555061 993343602 /nfs/dbraw/zinc/34/36/02/993343602.db2.gz CWURHLFXZWTIJW-TZMCWYRMSA-N 2 0 222.376 2.463 20 0 BEADRP C[C@H]1CC(C)(C)C[N@@H+]1CCC[NH2+]C1CC1 ZINC001576590141 993354580 /nfs/dbraw/zinc/35/45/80/993354580.db2.gz ZDJIAUAKLMTLSY-NSHDSACASA-N 2 0 210.365 2.249 20 0 BEADRP C[C@H]1CC(C)(C)CC[C@@H]1[NH2+][C@H]1C[C@@H]([NH3+])C1 ZINC001576588579 993357977 /nfs/dbraw/zinc/35/79/77/993357977.db2.gz BUKAKPVVHFVGJM-YFKTTZPYSA-N 2 0 210.365 2.281 20 0 BEADRP C[C@@H]1C[C@H](C[NH2+]CC[C@@H]2CCCS2)CC[NH2+]1 ZINC001576596922 993361104 /nfs/dbraw/zinc/36/11/04/993361104.db2.gz CASDAQZDUZWSBU-UPJWGTAASA-N 2 0 242.432 2.250 20 0 BEADRP C[C@@H]1C[C@H]1[C@@H]1C[C@H]1[NH2+]C[C@@H]1CC[NH2+][C@@H](C)C1 ZINC001576597212 993361372 /nfs/dbraw/zinc/36/13/72/993361372.db2.gz DMSMNVUYZDZXBS-CLHCLYRXSA-N 2 0 222.376 2.009 20 0 BEADRP C[C@@H]1C[C@@H](C[N@@H+]2CC[C@H](c3ccco3)C2)CC[NH2+]1 ZINC001576598830 993363820 /nfs/dbraw/zinc/36/38/20/993363820.db2.gz OMKDBGBLWYLWNI-RDBSUJKOSA-N 2 0 248.370 2.457 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]CCC2C[NH2+]C2)[C@H]1C ZINC001576679988 993381863 /nfs/dbraw/zinc/38/18/63/993381863.db2.gz HCVUNTLONSEQTO-NTZNESFSSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]CCC2C[NH2+]C2)[C@@H]1C ZINC001576679987 993382263 /nfs/dbraw/zinc/38/22/63/993382263.db2.gz HCVUNTLONSEQTO-NQBHXWOUSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]1CC[C@@H](C)[C@H]([NH2+][C@H]2C[C@H]3CC[C@@H]2[NH2+]3)C1 ZINC001576648383 993383934 /nfs/dbraw/zinc/38/39/34/993383934.db2.gz YLNXSWLIRCAFNO-HUXGKSLCSA-N 2 0 222.376 2.294 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@H]2C[C@@H]2C2CC2)CC1 ZINC000381521473 993403291 /nfs/dbraw/zinc/40/32/91/993403291.db2.gz UUYAJXYOOYODGT-KGLIPLIRSA-N 2 0 222.376 2.247 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@H]2CC[C@@H]([NH3+])C2)C[C@@H]1C ZINC001576732439 993409560 /nfs/dbraw/zinc/40/95/60/993409560.db2.gz UHEVJINALQQPCX-MROQNXINSA-N 2 0 210.365 2.092 20 0 BEADRP C[C@H]1C[N@H+](CCSC(C)(C)C)CC[C@H]1C[NH3+] ZINC001576807269 993428448 /nfs/dbraw/zinc/42/84/48/993428448.db2.gz OZUNNOSCAGXQDD-RYUDHWBXSA-N 2 0 244.448 2.435 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+][C@H](C)C1CC1 ZINC000382356216 993444664 /nfs/dbraw/zinc/44/46/64/993444664.db2.gz IJGQKTAKXYVQMR-VXGBXAGGSA-N 2 0 212.381 2.495 20 0 BEADRP CCOc1cccnc1N[C@H]1CCC[C@@H]([NH3+])C1 ZINC000382407078 993459169 /nfs/dbraw/zinc/45/91/69/993459169.db2.gz BMPUBWOEWXPDLJ-MNOVXSKESA-N 2 0 235.331 2.162 20 0 BEADRP CCC(C)(C)OCC[NH2+][C@@H]1CC[NH2+]CC[C@@H]1C ZINC001576948418 993461511 /nfs/dbraw/zinc/46/15/11/993461511.db2.gz PWANKMBNMWVHSD-QWHCGFSZSA-N 2 0 242.407 2.169 20 0 BEADRP CC[C@H](C)[N@H+](CCO)C[C@H]([NH3+])CCC(C)(C)C ZINC001576996834 993482766 /nfs/dbraw/zinc/48/27/66/993482766.db2.gz XQSDYQWDRIYWGW-QWHCGFSZSA-N 2 0 244.423 2.233 20 0 BEADRP CCC(CC)(C[NH3+])C[NH2+]Cc1cnccc1C ZINC001577052544 993489956 /nfs/dbraw/zinc/48/99/56/993489956.db2.gz WNTQZFNZIFKUMW-UHFFFAOYSA-N 2 0 235.375 2.245 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2CC[C@@H]3C[NH2+]C[C@@H]3C2)C[C@H]1C ZINC000383574634 993499036 /nfs/dbraw/zinc/49/90/36/993499036.db2.gz KROHLJIPCZFNHG-RYPNDVFKSA-N 2 0 236.403 2.352 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2CC[C@@H]3C[NH2+]C[C@H]3C2)C[C@@H]1C ZINC000383574635 993500150 /nfs/dbraw/zinc/50/01/50/993500150.db2.gz KROHLJIPCZFNHG-SEBNEYGDSA-N 2 0 236.403 2.352 20 0 BEADRP CCC[N@H+](CC(C)C)C[C@H](O)C[NH+](CC)CC ZINC000383645809 993509230 /nfs/dbraw/zinc/50/92/30/993509230.db2.gz HYRVBGAAXMWJQU-CQSZACIVSA-N 2 0 244.423 2.057 20 0 BEADRP CC[C@H]1CCCC[N@@H+]1C[C@H]1CC[C@@H]([NH3+])C1 ZINC001577253740 993563296 /nfs/dbraw/zinc/56/32/96/993563296.db2.gz FRXXXTIBVSWYTK-XQQFMLRXSA-N 2 0 210.365 2.378 20 0 BEADRP CC[C@@H]1CCCC[C@@H]1C[NH2+]C[C@@]12C[C@@H]1C[NH2+]C2 ZINC001577255089 993564994 /nfs/dbraw/zinc/56/49/94/993564994.db2.gz RFOJHOALKPTIBB-KBUPBQIOSA-N 2 0 236.403 2.402 20 0 BEADRP C[C@H](Cc1ccco1)[NH2+]C[C@@H]1CCC[NH2+][C@H]1C ZINC000384501864 993596212 /nfs/dbraw/zinc/59/62/12/993596212.db2.gz XGZFJQHKJRMXJW-AGIUHOORSA-N 2 0 236.359 2.188 20 0 BEADRP CCC[C@H](C[NH2+]C1(C[NH3+])CCCCC1)OC ZINC001577358123 993614119 /nfs/dbraw/zinc/61/41/19/993614119.db2.gz PZOMJEAUMPRENC-GFCCVEGCSA-N 2 0 228.380 2.053 20 0 BEADRP CCC[C@@H]1CCCC[C@H]1[NH2+]C[C@H]([NH3+])CCOC ZINC001577377180 993634011 /nfs/dbraw/zinc/63/40/11/993634011.db2.gz IBCZWXSPJRLRQH-MGPQQGTHSA-N 2 0 242.407 2.299 20 0 BEADRP CCCCOc1ccccc1C[NH2+]C/C=C\C[NH3+] ZINC001577473285 993669743 /nfs/dbraw/zinc/66/97/43/993669743.db2.gz VAGAEEAYQJVNSW-SREVYHEPSA-N 2 0 248.370 2.470 20 0 BEADRP CCCOc1cccc(C[NH2+]C[C@H]2C[C@@H]([NH3+])C2)c1 ZINC001577590919 993691070 /nfs/dbraw/zinc/69/10/70/993691070.db2.gz YCVVQWBLVVGALQ-OKILXGFUSA-N 2 0 248.370 2.302 20 0 BEADRP C[C@H]1CC[C@@H](N2CC3CCC2CC3)C[NH2+]1 ZINC000389717393 993759963 /nfs/dbraw/zinc/75/99/63/993759963.db2.gz OJHMESBQGBKMML-YWPUVAFDSA-N 2 0 208.349 2.001 20 0 BEADRP CC(C)(C)CC[N@@H+]1CCCC[C@@H](C[NH3+])C1 ZINC000389740154 993764727 /nfs/dbraw/zinc/76/47/27/993764727.db2.gz VPCWOGZOTXRWRF-LBPRGKRZSA-N 2 0 212.381 2.483 20 0 BEADRP [NH3+]C[C@H]1CCCC[N@H+](CCCC(F)(F)F)C1 ZINC000390495848 993793344 /nfs/dbraw/zinc/79/33/44/993793344.db2.gz RFFXGKREZDHTBX-SNVBAGLBSA-N 2 0 238.297 2.390 20 0 BEADRP C[N@@H+]1CC[C@@H](C[NH2+]C2CCC3(CC3)CC2)C1 ZINC000390470475 993793690 /nfs/dbraw/zinc/79/36/90/993793690.db2.gz JCERMHZNRUMCNO-LBPRGKRZSA-N 2 0 222.376 2.251 20 0 BEADRP [NH3+][C@H]1CCC[N@H+](CCCc2ccccc2)CC1 ZINC000393181012 993911475 /nfs/dbraw/zinc/91/14/75/993911475.db2.gz BUHYVEYYJDCCCG-HNNXBMFYSA-N 2 0 232.371 2.432 20 0 BEADRP Cc1nc(C[N@@H+]2CC3CCC2CC3)c[nH]1 ZINC000724780991 994075767 /nfs/dbraw/zinc/07/57/67/994075767.db2.gz YOADNYAQPMBNLZ-UHFFFAOYSA-N 2 0 205.305 2.093 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCC2CCCC2)CC[NH2+]1 ZINC000821987593 994417941 /nfs/dbraw/zinc/41/79/41/994417941.db2.gz FKPLGBWADRRZNP-YPMHNXCESA-N 2 0 210.365 2.297 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]([NH2+]C/C=C\C2CC2)C1 ZINC001334742628 994627783 /nfs/dbraw/zinc/62/77/83/994627783.db2.gz JQTRFVOKYMMJLA-SCOBNMCVSA-N 2 0 222.376 2.320 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2CC[C@H](SC)C2)CC1 ZINC001621360140 1170119709 /nfs/dbraw/zinc/11/97/09/1170119709.db2.gz WODFPGMAGFJTLE-ZDUSSCGKSA-N 2 0 242.432 2.156 20 0 BEADRP CCCC[N@H+](C)C[C@H](N)Cc1ccccc1 ZINC000020072695 1170141632 /nfs/dbraw/zinc/14/16/32/1170141632.db2.gz DIAMVPDFBCNHSG-CQSZACIVSA-N 2 0 220.360 2.288 20 0 BEADRP CC(C)CC[NH2+]CCC[NH+]1CCCCC1 ZINC000020128739 1170143516 /nfs/dbraw/zinc/14/35/16/1170143516.db2.gz BZZCVTJYXRYGLF-UHFFFAOYSA-N 2 0 212.381 2.498 20 0 BEADRP CC[C@@H]1CC[N@H+](CC2CC[NH+](C)CC2)[C@@H]1C ZINC001621270276 1170758707 /nfs/dbraw/zinc/75/87/07/1170758707.db2.gz QYSAKBDPOZMOLB-TZMCWYRMSA-N 2 0 224.392 2.449 20 0 BEADRP CC[C@@H]1CC[N@H+](CC2CC[NH+](C)CC2)[C@H]1C ZINC001621270273 1170758372 /nfs/dbraw/zinc/75/83/72/1170758372.db2.gz QYSAKBDPOZMOLB-GXTWGEPZSA-N 2 0 224.392 2.449 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@@H]2CC[C@H]3C[C@H]3C2)CC1 ZINC001621424470 1170806810 /nfs/dbraw/zinc/80/68/10/1170806810.db2.gz YAAMPPZXZXHSPE-SOUVJXGZSA-N 2 0 236.403 2.497 20 0 BEADRP Cc1ccccc1C[NH2+]C[C@@H]1C[NH+]2CCC1CC2 ZINC001621551825 1170845039 /nfs/dbraw/zinc/84/50/39/1170845039.db2.gz SHASLSPMCZNBSH-MRXNPFEDSA-N 2 0 244.382 2.426 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@H]([NH2+][C@@H]3CCC34CCC4)[C@@H]2C1 ZINC001621570235 1170857299 /nfs/dbraw/zinc/85/72/99/1170857299.db2.gz NZOXIQQEMNPGEH-RFQIPJPRSA-N 2 0 234.387 2.249 20 0 BEADRP C([C@@H]1CCC[NH2+]1)[N@@H+]1CCC[C@H]2CCCC[C@@H]21 ZINC000036827223 1170918866 /nfs/dbraw/zinc/91/88/66/1170918866.db2.gz RYYKXPYZNYPFLF-RDBSUJKOSA-N 2 0 222.376 2.393 20 0 BEADRP C[NH+]1C(C)(C)CC(OCCC[NH3+])CC1(C)C ZINC000039111079 1171115229 /nfs/dbraw/zinc/11/52/29/1171115229.db2.gz YQAJEVJZXJWJJN-UHFFFAOYSA-N 2 0 228.380 2.003 20 0 BEADRP CCCCC[C@@H](C)[NH2+]C[C@@H](O)C[NH+](CC)CC ZINC000042229488 1171215966 /nfs/dbraw/zinc/21/59/66/1171215966.db2.gz RUXDSMYUOFBAHQ-ZIAGYGMSSA-N 2 0 244.423 2.248 20 0 BEADRP [NH3+]CC1CC[NH+](Cc2c[nH]c3ccccc23)CC1 ZINC000044512272 1171389534 /nfs/dbraw/zinc/38/95/34/1171389534.db2.gz NTCMKSLZZUAACB-UHFFFAOYSA-N 2 0 243.354 2.339 20 0 BEADRP Cc1cccc(CC[N@H+]2CC[NH2+]C[C@@H](C)C2)c1 ZINC000051670991 1171909123 /nfs/dbraw/zinc/90/91/23/1171909123.db2.gz AUZHUQHRUBGPHH-CQSZACIVSA-N 2 0 232.371 2.079 20 0 BEADRP CC(C)C[C@@H](C)C[N@@H+]1CCC[C@@H](C[NH3+])C1 ZINC000300932631 349452592 /nfs/dbraw/zinc/45/25/92/349452592.db2.gz NYEIBRCAASJISC-OLZOCXBDSA-N 2 0 212.381 2.339 20 0 BEADRP CC(C)C[C@H](C)C[N@@H+]1CCC[C@H](C[NH3+])C1 ZINC000300932633 349452717 /nfs/dbraw/zinc/45/27/17/349452717.db2.gz NYEIBRCAASJISC-QWHCGFSZSA-N 2 0 212.381 2.339 20 0 BEADRP C[C@@H]([NH2+]C1CCSCC1)C1CC[NH+](C)CC1 ZINC000161586176 538917144 /nfs/dbraw/zinc/91/71/44/538917144.db2.gz RSSFRBZEUCQWJD-LLVKDONJSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@]1(C[NH2+]C(C2CC2)C2CC2)CCC[NH2+]C1 ZINC000062862636 349493490 /nfs/dbraw/zinc/49/34/90/349493490.db2.gz KAFKHUJZGKPLKD-CQSZACIVSA-N 2 0 222.376 2.154 20 0 BEADRP Cc1cccnc1CN(C)CC[C@H]([NH3+])C(C)C ZINC000161861806 349507323 /nfs/dbraw/zinc/50/73/23/349507323.db2.gz DOZWGSVYOPDWKP-ZDUSSCGKSA-N 2 0 235.375 2.195 20 0 BEADRP Cc1cc(C[N@H+]2CC[C@H]([C@@H](C)[NH3+])C2)ccc1F ZINC000126909177 178002692 /nfs/dbraw/zinc/00/26/92/178002692.db2.gz HIWVPSGJCIQHNE-YPMHNXCESA-N 2 0 236.334 2.303 20 0 BEADRP Cc1cc(C[N@H+]2CC[C@H]([C@H](C)[NH3+])C2)ccc1F ZINC000228152208 178003943 /nfs/dbraw/zinc/00/39/43/178003943.db2.gz HIWVPSGJCIQHNE-AAEUAGOBSA-N 2 0 236.334 2.303 20 0 BEADRP CC(C)C[C@H](C)C[N@@H+]1CC[C@@H]([NH3+])C[C@H]1C ZINC000301012147 349516131 /nfs/dbraw/zinc/51/61/31/349516131.db2.gz YZIPOXSYKJSEMR-YNEHKIRRSA-N 2 0 212.381 2.480 20 0 BEADRP Cc1ccoc1C[NH2+][C@H](C)C1CC[NH+](C)CC1 ZINC000380031763 398180431 /nfs/dbraw/zinc/18/04/31/398180431.db2.gz GPBMSCHXMORHOL-GFCCVEGCSA-N 2 0 236.359 2.408 20 0 BEADRP Cc1ccccc1OCC[NH2+][C@H]1CCC[C@@H]1C[NH3+] ZINC000422943961 398160326 /nfs/dbraw/zinc/16/03/26/398160326.db2.gz LSNUCHAEAFPQTP-KGLIPLIRSA-N 2 0 248.370 2.091 20 0 BEADRP CC(C)([NH3+])CN1CCCc2sccc2C1 ZINC000390140652 398161759 /nfs/dbraw/zinc/16/17/59/398161759.db2.gz ONFLTVXZYMVZHU-UHFFFAOYSA-N 2 0 224.373 2.234 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H]1CC1(C)C ZINC000423021289 398161923 /nfs/dbraw/zinc/16/19/23/398161923.db2.gz BPAJCQQKFLNXGJ-GXFFZTMASA-N 2 0 233.359 2.298 20 0 BEADRP CC(C)C[C@H]([NH3+])C[NH2+][C@H]1CCC[C@@H]2C[C@@H]21 ZINC000415118356 398163123 /nfs/dbraw/zinc/16/31/23/398163123.db2.gz YBHXJBXROLAKFY-VOAKCMCISA-N 2 0 210.365 2.138 20 0 BEADRP COCC1CCC([NH2+]C2CCC([NH3+])CC2)CC1 ZINC000423174116 398164028 /nfs/dbraw/zinc/16/40/28/398164028.db2.gz BIJLAWQYBZDOSQ-UHFFFAOYSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CCC[NH2+]1)C1C(C)(C)C1(C)C ZINC000423233164 398165331 /nfs/dbraw/zinc/16/53/31/398165331.db2.gz JIBRNIHBPCBFJL-MNOVXSKESA-N 2 0 224.392 2.399 20 0 BEADRP C[C@@H]1CC([NH2+]C2CC([NH+](C)C)C2)C[C@@H](C)C1 ZINC000576240169 365535588 /nfs/dbraw/zinc/53/55/88/365535588.db2.gz UGWHFBADGWYEBF-BCVKRFQSSA-N 2 0 224.392 2.493 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1Cc2ccccc21)[C@@H]1CCCC[NH2+]1 ZINC000386094529 398197797 /nfs/dbraw/zinc/19/77/97/398197797.db2.gz IQMQTKVHEMHWBL-NOLJZWGESA-N 2 0 244.382 2.447 20 0 BEADRP FC1(CC[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)CCC1 ZINC000647796772 398201509 /nfs/dbraw/zinc/20/15/09/398201509.db2.gz NBIZHHULIBHZAH-YNEHKIRRSA-N 2 0 240.366 2.246 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](CO)C1CCCCC1 ZINC000386276973 398204231 /nfs/dbraw/zinc/20/42/31/398204231.db2.gz QCVRBWGQTXRTLT-JSGCOSHPSA-N 2 0 242.407 2.035 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]Cc2cccc3c2CC[NH2+]C3)[C@H]1C ZINC000386302701 398205108 /nfs/dbraw/zinc/20/51/08/398205108.db2.gz VRPBRQCVSJMVGW-WQGACYEGSA-N 2 0 244.382 2.466 20 0 BEADRP CC(C)CCC[N@@H+]1C[C@@H]2CC[C@@H]([NH3+])[C@H]2C1 ZINC000336712917 398205252 /nfs/dbraw/zinc/20/52/52/398205252.db2.gz VHQWXCVFGQJFDM-RWMBFGLXSA-N 2 0 210.365 2.092 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCCC[C@H]1C[NH3+])CC(F)F ZINC000647801220 398207750 /nfs/dbraw/zinc/20/77/50/398207750.db2.gz RPGXYIBZMATDBU-GARJFASQSA-N 2 0 234.334 2.385 20 0 BEADRP C[C@H](C[NH2+]C1CCC(C[NH3+])CC1)CC(F)F ZINC000647801270 398207799 /nfs/dbraw/zinc/20/77/99/398207799.db2.gz TZHFJSYCAAFKCD-WHXUTIOJSA-N 2 0 234.334 2.385 20 0 BEADRP [NH3+]C[C@H]1C[N@H+](CCC2CCCCC2)CCCO1 ZINC000313384185 398213609 /nfs/dbraw/zinc/21/36/09/398213609.db2.gz QWRQQNLKAIJEAX-AWEZNQCLSA-N 2 0 240.391 2.006 20 0 BEADRP C[C@@H]([NH2+]C1CCC([NH3+])CC1)c1cccc(O)c1 ZINC000051693267 398213735 /nfs/dbraw/zinc/21/37/35/398213735.db2.gz CRJVNXXERGUWMW-QFWMXSHPSA-N 2 0 234.343 2.313 20 0 BEADRP Cc1ccc(CCC[N@@H+](C)CC(C)(C)C[NH3+])cn1 ZINC000339405899 187330156 /nfs/dbraw/zinc/33/01/56/187330156.db2.gz DCPVPSBZSHADSH-UHFFFAOYSA-N 2 0 249.402 2.239 20 0 BEADRP Cc1cc(NC[C@@H]2CCC[C@@H]([NH3+])C2)cc[nH+]1 ZINC000227669856 178166903 /nfs/dbraw/zinc/16/69/03/178166903.db2.gz GIDCZFWPCZKDLD-VXGBXAGGSA-N 2 0 219.332 2.319 20 0 BEADRP Cc1cc(NC[C@]2(C)CCC[NH2+]C2)cc[nH+]1 ZINC000229577416 178169981 /nfs/dbraw/zinc/16/99/81/178169981.db2.gz IGIMJZRSNZNLMP-CYBMUJFWSA-N 2 0 219.332 2.192 20 0 BEADRP CC(C)(C[NH2+][C@H]1CCC[C@@H]([NH3+])C1)c1cccnc1 ZINC000584242205 398221745 /nfs/dbraw/zinc/22/17/45/398221745.db2.gz KYONCADIZWHUNZ-KGLIPLIRSA-N 2 0 247.386 2.219 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@@H]2CC[NH2+]C2)[C@H]2CCCC[C@@H]12 ZINC000647880341 398223416 /nfs/dbraw/zinc/22/34/16/398223416.db2.gz JSMBQFLJUPNZAR-KBXIAJHMSA-N 2 0 236.403 2.497 20 0 BEADRP Cc1cc(N[C@H]2CCCC[C@@H]2C[NH3+])cc[nH+]1 ZINC000229576037 178188780 /nfs/dbraw/zinc/18/87/80/178188780.db2.gz QUIYZYGGVDKSGH-YPMHNXCESA-N 2 0 219.332 2.319 20 0 BEADRP CCC(CC)C[N@@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000309408442 168349854 /nfs/dbraw/zinc/34/98/54/168349854.db2.gz FQFJQNMAKCSHMY-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP Cc1cccc(CC[NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)n1 ZINC000280191518 538937173 /nfs/dbraw/zinc/93/71/73/538937173.db2.gz SGBNTLVGKBTOLG-ZFWWWQNUSA-N 2 0 247.386 2.005 20 0 BEADRP Cc1cccc(CCNc2cc(C)nc(C)n2)n1 ZINC000280556010 538937712 /nfs/dbraw/zinc/93/77/12/538937712.db2.gz UGXFXQOIURCRNY-UHFFFAOYSA-N 2 0 242.326 2.451 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]C[C@H]2CCCCO2)c2ccccc21 ZINC000252790957 136226896 /nfs/dbraw/zinc/22/68/96/136226896.db2.gz SWEPYNYPJLXDLL-DFBGVHRSSA-N 2 0 246.354 2.290 20 0 BEADRP CCC(CC)C[NH2+]CC1CC[NH+](C)CC1 ZINC000044515397 168359546 /nfs/dbraw/zinc/35/95/46/168359546.db2.gz VNISODFYINUBRQ-UHFFFAOYSA-N 2 0 212.381 2.354 20 0 BEADRP C[C@@H]1C[C@H]([N@H+](C)C2CCCCC2)CC[NH2+]1 ZINC000229539128 538939586 /nfs/dbraw/zinc/93/95/86/538939586.db2.gz PZHBMFMTNTYDNX-DGCLKSJQSA-N 2 0 210.365 2.391 20 0 BEADRP Cc1cc([C@H](C)[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)no1 ZINC000333893847 178255420 /nfs/dbraw/zinc/25/54/20/178255420.db2.gz YROOBKCGEOCFRD-ZDEQEGDKSA-N 2 0 249.358 2.022 20 0 BEADRP CCC(CC)C[NH2+]C[C@H](C)C[NH+](C)C ZINC000308590181 168361364 /nfs/dbraw/zinc/36/13/64/168361364.db2.gz UVUKFPXSZYNRPP-NSHDSACASA-N 2 0 200.370 2.210 20 0 BEADRP CCC(CC)C[NH2+]C[C@H]1CC[N@H+](CC)C1 ZINC000037484203 168361953 /nfs/dbraw/zinc/36/19/53/168361953.db2.gz RYZVBBIRIGTSLU-CYBMUJFWSA-N 2 0 212.381 2.354 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCN(CC3CC3)C2)[C@H]1C ZINC000381227307 398253085 /nfs/dbraw/zinc/25/30/85/398253085.db2.gz KDERKWIDSKNLRA-WVWOOGAGSA-N 2 0 222.376 2.105 20 0 BEADRP CC(C)[NH2+]CCC[NH2+][C@@H](C)[C@@H]1CC1(C)C ZINC000576694690 365658630 /nfs/dbraw/zinc/65/86/30/365658630.db2.gz MSHXZBIVKSFWLE-RYUDHWBXSA-N 2 0 212.381 2.399 20 0 BEADRP C([C@@H]1CC[NH2+]C1)[N@@H+]1CCCC[C@@H]1C1CCC1 ZINC000647997472 398255396 /nfs/dbraw/zinc/25/53/96/398255396.db2.gz GSDREJCESFMAGR-TZMCWYRMSA-N 2 0 222.376 2.251 20 0 BEADRP CCC[C@@H](C[NH2+]CCC[N@H+](C)C(C)C)OC ZINC000385947784 398262857 /nfs/dbraw/zinc/26/28/57/398262857.db2.gz CDKXWGUFIIFSRO-ZDUSSCGKSA-N 2 0 230.396 2.121 20 0 BEADRP c1cc(C[NH2+][C@@H]2CCCSC2)cc2c1C[NH2+]C2 ZINC000335065008 136232555 /nfs/dbraw/zinc/23/25/55/136232555.db2.gz ZQQXNAZFLISIHE-CQSZACIVSA-N 2 0 248.395 2.275 20 0 BEADRP C[C@H](C[N@@H+]1CC[C@H]2[NH2+]CC[C@@H]2C1)C(C)(C)C ZINC000381595577 398265161 /nfs/dbraw/zinc/26/51/61/398265161.db2.gz JRISTSNIMWOORZ-JHJVBQTASA-N 2 0 224.392 2.352 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]C[C@@H]1CCCC[N@H+](C)C1 ZINC000624124197 346853504 /nfs/dbraw/zinc/85/35/04/346853504.db2.gz ZSSHLMDDESGQDW-MJBXVCDLSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H](Cc1ccsc1)[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000519349505 488178298 /nfs/dbraw/zinc/17/82/98/488178298.db2.gz HNKUQBWLBRSNJA-WCQYABFASA-N 2 0 238.400 2.411 20 0 BEADRP CC(C)OCCC[NH2+][C@H](C)C1CC[NH+](C)CC1 ZINC000037221632 538962056 /nfs/dbraw/zinc/96/20/56/538962056.db2.gz KFXGVFDBYBCWQJ-CYBMUJFWSA-N 2 0 242.407 2.121 20 0 BEADRP CCC(CC)[NH2+]CCN(C)[C@H](C)CC ZINC000053377522 168387000 /nfs/dbraw/zinc/38/70/00/168387000.db2.gz BVIZMKHEMAGEAJ-LLVKDONJSA-N 2 0 200.370 2.495 20 0 BEADRP CCC(CC)[NH2+]C[C@H](C)C[NH+]1CCCC1 ZINC000062077324 168389005 /nfs/dbraw/zinc/38/90/05/168389005.db2.gz BHGMLSNUJZCATK-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP CC1(C)CCC[C@@H]1[NH2+][C@@H]1CCc2nc[nH]c2C1 ZINC000336479885 342807544 /nfs/dbraw/zinc/80/75/44/342807544.db2.gz UAXSQQANBZSOBY-MFKMUULPSA-N 2 0 233.359 2.435 20 0 BEADRP CCN(CC)C[C@H](C)[NH2+][C@H](C)C(C)C ZINC000045690498 538992677 /nfs/dbraw/zinc/99/26/77/538992677.db2.gz NKJAQYJUORWCSY-NWDGAFQWSA-N 2 0 200.370 2.351 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCC(F)(F)C1)C1CC[NH+](C)CC1 ZINC000379918907 538981358 /nfs/dbraw/zinc/98/13/58/538981358.db2.gz PPYAFLGEUZIOAH-ZYHUDNBSSA-N 2 0 246.345 2.494 20 0 BEADRP C[C@H]1C[C@H]([NH+]2CCC(C)(C)CC2)CC[NH2+]1 ZINC000197532336 539012407 /nfs/dbraw/zinc/01/24/07/539012407.db2.gz YJADHPWJQNQDBK-NWDGAFQWSA-N 2 0 210.365 2.249 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+]CC1CC[NH+](C)CC1 ZINC000381177200 538995724 /nfs/dbraw/zinc/99/57/24/538995724.db2.gz VJPBIMQZZLQPHR-KBPBESRZSA-N 2 0 224.392 2.352 20 0 BEADRP CC(C)C1CC([NH2+]C[C@@H]2CCC[N@H+](C)C2)C1 ZINC000232537413 342856624 /nfs/dbraw/zinc/85/66/24/342856624.db2.gz SQOQEQDBSVVAEM-HSBZDZAISA-N 2 0 224.392 2.352 20 0 BEADRP CC[C@H]1CCC[C@H]1[NH2+]CCN(C)C(C)C ZINC000133146356 398310750 /nfs/dbraw/zinc/31/07/50/398310750.db2.gz XUWFBJPFQFZKTA-QWHCGFSZSA-N 2 0 212.381 2.495 20 0 BEADRP CCCC1(C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)CC1 ZINC000233034781 342894158 /nfs/dbraw/zinc/89/41/58/342894158.db2.gz IUFFVMRGJQZGMO-VXGBXAGGSA-N 2 0 210.365 2.426 20 0 BEADRP CCC1(C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)CCC1 ZINC000233089436 342894914 /nfs/dbraw/zinc/89/49/14/342894914.db2.gz RNHRJRVJKBCELJ-NWDGAFQWSA-N 2 0 210.365 2.426 20 0 BEADRP CSC[C@H](C)[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000134013789 398328584 /nfs/dbraw/zinc/32/85/84/398328584.db2.gz KCBFBOLVVVDJPH-QWRGUYRKSA-N 2 0 230.421 2.058 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@@]2(C)CCCOC2)CC1 ZINC000336321401 398330606 /nfs/dbraw/zinc/33/06/06/398330606.db2.gz PPTNDQHATVYEFY-AWEZNQCLSA-N 2 0 240.391 2.018 20 0 BEADRP COCCC[C@H](C)[NH2+]CCC[NH+]1CCCCC1 ZINC000178411060 536665525 /nfs/dbraw/zinc/66/55/25/536665525.db2.gz DTWUGWQCJKSEES-AWEZNQCLSA-N 2 0 242.407 2.267 20 0 BEADRP Cc1ccc(C[NH2+]CCCC[NH3+])cc1C ZINC000037715509 342943819 /nfs/dbraw/zinc/94/38/19/342943819.db2.gz FXKYTFIPPYBDBO-UHFFFAOYSA-N 2 0 206.333 2.132 20 0 BEADRP CC[C@H](c1ccccc1)[N@@H+]1CCCO[C@@H](C[NH3+])C1 ZINC000313350935 259333715 /nfs/dbraw/zinc/33/37/15/259333715.db2.gz LDLYUAKFCZJNSB-LSDHHAIUSA-N 2 0 248.370 2.187 20 0 BEADRP C[C@H]1C[NH+](Cc2ccc3c(c2)C[NH2+]CC3)C[C@@H]1C ZINC000211967356 343017290 /nfs/dbraw/zinc/01/72/90/343017290.db2.gz RSSAORPTRDZZSI-STQMWFEESA-N 2 0 244.382 2.420 20 0 BEADRP C[C@H]([NH2+]C1CC[NH+](CC2CC2)CC1)C1CC1 ZINC000309561110 259343795 /nfs/dbraw/zinc/34/37/95/259343795.db2.gz LBOOLVCTKWWFPV-NSHDSACASA-N 2 0 222.376 2.249 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)C(C)C ZINC000400937301 529660088 /nfs/dbraw/zinc/66/00/88/529660088.db2.gz BHXORWNSIDXYOL-RQJABVFESA-N 2 0 224.392 2.399 20 0 BEADRP CC(C)C[C@@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000336702785 187231166 /nfs/dbraw/zinc/23/11/66/187231166.db2.gz QBWIBCNBQQWSCN-FKJOKYEKSA-N 2 0 210.365 2.294 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]CC2(C3CC3)CC2)C1 ZINC000236327367 343091721 /nfs/dbraw/zinc/09/17/21/343091721.db2.gz OEGYZXMAGRTABU-NWDGAFQWSA-N 2 0 208.349 2.036 20 0 BEADRP CC(C)CC[C@H](C)[NH2+][C@H]1CC[NH2+]C[C@H]1C ZINC000308846771 346924223 /nfs/dbraw/zinc/92/42/23/346924223.db2.gz LPLUATDLUAEKDU-AGIUHOORSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@@H]1CCC[N@H+](CC2CC[NH2+]CC2)[C@H]1C ZINC000252126390 343126116 /nfs/dbraw/zinc/12/61/16/343126116.db2.gz KCSAISMNIWUKGG-NEPJUHHUSA-N 2 0 210.365 2.106 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]CCCc2ccccc2)C1 ZINC000093210095 343151179 /nfs/dbraw/zinc/15/11/79/343151179.db2.gz MJSZYFRIPVKXIC-HUUCEWRRSA-N 2 0 232.371 2.479 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]CCc2ccc(F)cc2)C1 ZINC000093209413 343151278 /nfs/dbraw/zinc/15/12/78/343151278.db2.gz AUUPBNPVJDPSPD-KBPBESRZSA-N 2 0 236.334 2.228 20 0 BEADRP Cc1ccccc1CC[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000094183062 343152523 /nfs/dbraw/zinc/15/25/23/343152523.db2.gz AOPJMCQKPRLAMH-CABCVRRESA-N 2 0 232.371 2.397 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]CCCC(F)(F)F)C1 ZINC000123990589 343166708 /nfs/dbraw/zinc/16/67/08/343166708.db2.gz UDCYSSTZDPOBOQ-IUCAKERBSA-N 2 0 224.270 2.188 20 0 BEADRP CCCOc1cccc(C[N@H+](C)CCC[NH3+])c1 ZINC000133722232 343186415 /nfs/dbraw/zinc/18/64/15/343186415.db2.gz YMVLAOWYWFFRPP-UHFFFAOYSA-N 2 0 236.359 2.256 20 0 BEADRP COC[C@H]([NH2+][C@H]1C[C@H]([NH3+])c2ccccc21)C(C)C ZINC000132145734 343187623 /nfs/dbraw/zinc/18/76/23/343187623.db2.gz QLNLWLKGTYEBDZ-KKUMJFAQSA-N 2 0 248.370 2.392 20 0 BEADRP C[NH2+]CCC[N@H+](C)Cc1cc(C)cc(C)c1 ZINC000087472165 136281633 /nfs/dbraw/zinc/28/16/33/136281633.db2.gz JPFUSERNOQXZEV-UHFFFAOYSA-N 2 0 220.360 2.345 20 0 BEADRP CC[NH+](CC)CCC[NH2+]C1CCSCC1 ZINC000035120804 343285347 /nfs/dbraw/zinc/28/53/47/343285347.db2.gz FBWXXFVBCMWIBH-UHFFFAOYSA-N 2 0 230.421 2.204 20 0 BEADRP C[C@H](CC1CC1)[NH2+]CC1CC[NH+](C)CC1 ZINC000069662476 343288154 /nfs/dbraw/zinc/28/81/54/343288154.db2.gz JPEQKXOTPZNKGM-LLVKDONJSA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)[C@H](C)[N@H+](C)CCC1CC[NH2+]CC1 ZINC000036787480 187254403 /nfs/dbraw/zinc/25/44/03/187254403.db2.gz DKGNUDAEWGWEEQ-LBPRGKRZSA-N 2 0 212.381 2.352 20 0 BEADRP CCC1([NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)CC1 ZINC000335626660 136299732 /nfs/dbraw/zinc/29/97/32/136299732.db2.gz VYUCOWCTGSNKEO-NWDGAFQWSA-N 2 0 208.349 2.145 20 0 BEADRP Cc1cc(C[NH2+][C@H]2CC[NH2+][C@H](C)C2)ccc1F ZINC000335635973 136300820 /nfs/dbraw/zinc/30/08/20/136300820.db2.gz BJZZDWDSYWTHTB-YPMHNXCESA-N 2 0 236.334 2.364 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CCC[NH+]2CCCC2)C1 ZINC000070642865 343337278 /nfs/dbraw/zinc/33/72/78/343337278.db2.gz CWRAWKUEJBAWOA-OLZOCXBDSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+]CCC[NH+]1CCCC1 ZINC000070829450 343341406 /nfs/dbraw/zinc/34/14/06/343341406.db2.gz VZDJMBHXFJTVMJ-OLZOCXBDSA-N 2 0 210.365 2.251 20 0 BEADRP Cc1cc(Cl)ccc1CN[C@H]1CC[NH2+]C1 ZINC000335642370 136308991 /nfs/dbraw/zinc/30/89/91/136308991.db2.gz JCFSQNXBTIVXQF-LBPRGKRZSA-N 2 0 224.735 2.100 20 0 BEADRP Fc1cccc(CN[C@@H]2CCCC[NH2+]C2)c1 ZINC000335642387 136309153 /nfs/dbraw/zinc/30/91/53/136309153.db2.gz JJRZZNUOGGVHFG-CYBMUJFWSA-N 2 0 222.307 2.057 20 0 BEADRP C[C@@H]1CCC[N@@H+]1CC[C@@H]1CCCC[NH+]1C ZINC000335698428 136327916 /nfs/dbraw/zinc/32/79/16/136327916.db2.gz NYVUYONZBKVEBD-OLZOCXBDSA-N 2 0 210.365 2.345 20 0 BEADRP CC[C@H]([NH2+]CCC[NH3+])c1ccc(F)cc1F ZINC000349161526 136328574 /nfs/dbraw/zinc/32/85/74/136328574.db2.gz UONDZTIGQJIUHF-LBPRGKRZSA-N 2 0 228.286 2.354 20 0 BEADRP CCC[N@H+](CCC[NH+](C)C)C[C@H]1C[C@H]1C ZINC000349344216 136342858 /nfs/dbraw/zinc/34/28/58/136342858.db2.gz HMEYGUMVPNKDNJ-CHWSQXEVSA-N 2 0 212.381 2.306 20 0 BEADRP CC(C)C[C@H]([NH3+])C[N@@H+]1CC[C@H](C(C)C)C1 ZINC000166313070 136345471 /nfs/dbraw/zinc/34/54/71/136345471.db2.gz QERJDOVKCVVVFU-STQMWFEESA-N 2 0 212.381 2.338 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]CCC1CCCC1 ZINC000166530326 136357873 /nfs/dbraw/zinc/35/78/73/136357873.db2.gz FURIRQNBNMOQRP-OCCSQVGLSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH2+]C[C@@H]1CCC[N@H+](CCC2CCC2)C1 ZINC000398610777 488220460 /nfs/dbraw/zinc/22/04/60/488220460.db2.gz AVOZYRFECOVHSI-ZDUSSCGKSA-N 2 0 210.365 2.108 20 0 BEADRP CCN1C[C@H]([NH2+]C[C@H](C)C(C)C)[C@@H](C)C1 ZINC000379948010 365760040 /nfs/dbraw/zinc/76/00/40/365760040.db2.gz RRSAXNBVTYVVSY-AVGNSLFASA-N 2 0 212.381 2.208 20 0 BEADRP C[NH2+]CCC1CC[NH+](CC2CCC2)CC1 ZINC000083839992 343504299 /nfs/dbraw/zinc/50/42/99/343504299.db2.gz LCHDYHDEQDVAGD-UHFFFAOYSA-N 2 0 210.365 2.108 20 0 BEADRP CC1(C)CC(C[NH2+][C@@H]2CCC[C@@H]2C[NH3+])C1 ZINC000577054382 365795302 /nfs/dbraw/zinc/79/53/02/365795302.db2.gz GASLCIZQOCQJLO-VXGBXAGGSA-N 2 0 210.365 2.140 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC[NH2+]C1)C1CCCCCC1 ZINC000088163225 343709769 /nfs/dbraw/zinc/70/97/69/343709769.db2.gz DIOBXSJRNXCDBG-DGCLKSJQSA-N 2 0 210.365 2.297 20 0 BEADRP CCC1(C[NH2+][C@H]2CC[N@H+](C)C[C@@H]2C)CC1 ZINC000090219469 343750365 /nfs/dbraw/zinc/75/03/65/343750365.db2.gz OAQAORWHXKEUOQ-RYUDHWBXSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1C[C@H]1C[N@@H+]1CCC[C@]2(CC[NH+](C)C2)C1 ZINC000625450600 343777704 /nfs/dbraw/zinc/77/77/04/343777704.db2.gz QNIJEONGNVVCGL-HZSPNIEDSA-N 2 0 222.376 2.060 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CCC[C@@]2(CC[NH+](C)C2)C1 ZINC000625450601 343777723 /nfs/dbraw/zinc/77/77/23/343777723.db2.gz QNIJEONGNVVCGL-MCIONIFRSA-N 2 0 222.376 2.060 20 0 BEADRP CC1(C)CCC[C@H](C[N@@H+]2CC[C@@H]3C[NH2+]C[C@@H]32)C1 ZINC000576804884 343759452 /nfs/dbraw/zinc/75/94/52/343759452.db2.gz AIJPGQHXPQBVEY-MJBXVCDLSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H]([NH2+]CC1CCC1)C1CC[NH+](C)CC1 ZINC000037222302 537818495 /nfs/dbraw/zinc/81/84/95/537818495.db2.gz KXRVARXKXCFXMO-NSHDSACASA-N 2 0 210.365 2.106 20 0 BEADRP C[NH+](CCC[N@@H+](C)C1CCC1)C1CCC1 ZINC000173617759 529885735 /nfs/dbraw/zinc/88/57/35/529885735.db2.gz CVLXLFVAFXMJJN-UHFFFAOYSA-N 2 0 210.365 2.345 20 0 BEADRP C(C[NH2+][C@H]1CC[C@@H]1C1CC1)C[NH+]1CCCC1 ZINC000336650620 537820188 /nfs/dbraw/zinc/82/01/88/537820188.db2.gz DTUXKSVRIRVOSE-KGLIPLIRSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@@H]([NH2+]CC1CC(C)C1)C1CC[NH+](C)CC1 ZINC000621771267 343894811 /nfs/dbraw/zinc/89/48/11/343894811.db2.gz AHMVUSOLTXHMFJ-OTTFEQOBSA-N 2 0 224.392 2.352 20 0 BEADRP CCc1cc(N[C@@H](C)C2CC[NH+](C)CC2)cc[nH+]1 ZINC000396445493 347008591 /nfs/dbraw/zinc/00/85/91/347008591.db2.gz ZJTUXSYGJNZCOI-LBPRGKRZSA-N 2 0 247.386 2.208 20 0 BEADRP Cc1ccoc1CNC[C@@H]1CCC[N@@H+](C)C1 ZINC000126789515 344103433 /nfs/dbraw/zinc/10/34/33/344103433.db2.gz ADQPUZYJJUHMPD-LBPRGKRZSA-N 2 0 222.332 2.019 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]([NH2+][C@H]2CCCSC2)C1 ZINC000634732595 344106602 /nfs/dbraw/zinc/10/66/02/344106602.db2.gz KANCFADFESWRDK-NEPJUHHUSA-N 2 0 242.432 2.250 20 0 BEADRP C(C1CC1)[NH+](CC1CC1)C[C@H]1CCC[NH2+]C1 ZINC000070064248 187358523 /nfs/dbraw/zinc/35/85/23/187358523.db2.gz GBPRPXOUKIZFER-AWEZNQCLSA-N 2 0 222.376 2.108 20 0 BEADRP CC(C)(C)CC[NH2+][C@]12CCC[C@@H]1C[NH2+]C2 ZINC000634733961 344114661 /nfs/dbraw/zinc/11/46/61/344114661.db2.gz SQQLPTYNZXOVIK-YPMHNXCESA-N 2 0 210.365 2.154 20 0 BEADRP C(CC1CC1)[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000128059831 187285840 /nfs/dbraw/zinc/28/58/40/187285840.db2.gz JWXWUZWMLFWAES-QWHCGFSZSA-N 2 0 208.349 2.003 20 0 BEADRP CC(C)N(C)CC[NH2+][C@H]1CC[C@@H]1C1CC1 ZINC000336748711 537840785 /nfs/dbraw/zinc/84/07/85/537840785.db2.gz DOJZZCHRIYYPAE-OLZOCXBDSA-N 2 0 210.365 2.105 20 0 BEADRP CC(C)CCC[N@@H+]1C[C@@H]2CCC[C@]2([NH3+])C1 ZINC000622003960 344181518 /nfs/dbraw/zinc/18/15/18/344181518.db2.gz IGJPUIZTOJRVPK-STQMWFEESA-N 2 0 210.365 2.236 20 0 BEADRP CC(C)CCC[NH2+][C@H]1CC[N@H+](C)C[C@H]1C ZINC000132292796 344297555 /nfs/dbraw/zinc/29/75/55/344297555.db2.gz VEYBWBHZRZJHAJ-OLZOCXBDSA-N 2 0 212.381 2.352 20 0 BEADRP Nc1ccc2c(c1)CC[C@@H]2[NH2+]C1CCC([NH3+])CC1 ZINC000094088722 344325834 /nfs/dbraw/zinc/32/58/34/344325834.db2.gz CGUIVRHWIQEJIG-HGMXIMQMSA-N 2 0 245.370 2.116 20 0 BEADRP Nc1ccc2c(c1)CC[C@H]2[NH2+]C1CCC([NH3+])CC1 ZINC000094088724 344325926 /nfs/dbraw/zinc/32/59/26/344325926.db2.gz CGUIVRHWIQEJIG-ABIUDSBCSA-N 2 0 245.370 2.116 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]CCC(C)(C)C ZINC000132721537 344307319 /nfs/dbraw/zinc/30/73/19/344307319.db2.gz DKIJWELMUNGWSK-NEPJUHHUSA-N 2 0 212.381 2.352 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]C[C@@H]2C[C@H]2C)CC1 ZINC000132821017 344308469 /nfs/dbraw/zinc/30/84/69/344308469.db2.gz GCSCAFANFWBAIW-NEPJUHHUSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[C@@H]([NH3+])C1)c1cscn1 ZINC000570832116 323072233 /nfs/dbraw/zinc/07/22/33/323072233.db2.gz UDPRERXALFDIIF-GARJFASQSA-N 2 0 239.388 2.311 20 0 BEADRP C[C@@H]1CSC[C@H]1[NH2+]CC[C@H]1CCCC[N@@H+]1C ZINC000381039296 344472862 /nfs/dbraw/zinc/47/28/62/344472862.db2.gz BWNSUVUOUOLXLE-JHJVBQTASA-N 2 0 242.432 2.202 20 0 BEADRP CC[C@@H]1CCCC[C@@H]1[NH2+][C@H](CCC[NH3+])COC ZINC000300025144 344513938 /nfs/dbraw/zinc/51/39/38/344513938.db2.gz QSVJVBPQHAWNKJ-MCIONIFRSA-N 2 0 242.407 2.299 20 0 BEADRP CC(C)(C)CC[NH2+][C@@H]1CCN(C2CC2)C1 ZINC000044721359 344544948 /nfs/dbraw/zinc/54/49/48/344544948.db2.gz KWIPZVMVMUPDJI-LLVKDONJSA-N 2 0 210.365 2.249 20 0 BEADRP CC(C)C[C@@H](C)[NH2+][C@@H](C)CC[NH+](C)C ZINC000049553077 344652963 /nfs/dbraw/zinc/65/29/63/344652963.db2.gz UGCFMHVVXIVWGS-NWDGAFQWSA-N 2 0 200.370 2.351 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+]C[C@@H]1CC=CCC1 ZINC000049553550 344653143 /nfs/dbraw/zinc/65/31/43/344653143.db2.gz ZMLBAOYXPHHSGY-CHWSQXEVSA-N 2 0 210.365 2.273 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]CCCC1CC1 ZINC000161717466 323076407 /nfs/dbraw/zinc/07/64/07/323076407.db2.gz JXOHPAMIXXVZAG-MBNYWOFBSA-N 2 0 224.392 2.495 20 0 BEADRP C[N@H+](CC1CC[NH+](C)CC1)CC1(C)CCC1 ZINC000432832862 537869118 /nfs/dbraw/zinc/86/91/18/537869118.db2.gz SOXZSYQGCNAEHE-UHFFFAOYSA-N 2 0 224.392 2.450 20 0 BEADRP Cc1cccc([C@H](C)[NH+]2C[C@@H]3C[NH2+]C[C@H]3C2)c1 ZINC000394356643 344898789 /nfs/dbraw/zinc/89/87/89/344898789.db2.gz XBPHPELGIVYRHC-QEJZJMRPSA-N 2 0 230.355 2.207 20 0 BEADRP CC(C)=CC[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000249518018 537878901 /nfs/dbraw/zinc/87/89/01/537878901.db2.gz KNSGBVISOHONSM-STQMWFEESA-N 2 0 208.349 2.169 20 0 BEADRP C[NH+]1CCC(C)(C[NH2+][C@H]2CC[C@H]2C2CC2)CC1 ZINC000348377522 537879115 /nfs/dbraw/zinc/87/91/15/537879115.db2.gz NDOWMLYBPPPPJC-KBPBESRZSA-N 2 0 236.403 2.497 20 0 BEADRP CO[C@H]1CCC[C@@H]([NH2+]CCC[N@H+](C)C(C)C)C1 ZINC000234892869 537881240 /nfs/dbraw/zinc/88/12/40/537881240.db2.gz YZCYVKTWFCDCSX-KGLIPLIRSA-N 2 0 242.407 2.264 20 0 BEADRP CCC[N@H+](CC)C[C@H](C)Nc1ccncc1F ZINC000641621803 362552964 /nfs/dbraw/zinc/55/29/64/362552964.db2.gz HPKPSAPSMNOADR-NSHDSACASA-N 2 0 239.338 2.175 20 0 BEADRP C[NH2+]CCC1CC[NH+](Cc2ccc(C)cn2)CC1 ZINC000156601405 345189763 /nfs/dbraw/zinc/18/97/63/345189763.db2.gz KLIPZSKGVJUZDB-UHFFFAOYSA-N 2 0 247.386 2.212 20 0 BEADRP CC[NH2+]Cc1cccc(NC[C@H](C[NH3+])C(C)C)c1 ZINC000634995455 345185205 /nfs/dbraw/zinc/18/52/05/345185205.db2.gz FKQPOQMJGNGBMR-AWEZNQCLSA-N 2 0 249.402 2.439 20 0 BEADRP C[NH2+]Cc1ccc(NC[C@H](C[NH3+])C(C)C)cc1 ZINC000634996104 345186723 /nfs/dbraw/zinc/18/67/23/345186723.db2.gz ZJKHYWKQDGQKLN-ZDUSSCGKSA-N 2 0 235.375 2.049 20 0 BEADRP C1=CC[C@H]([NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)CC1 ZINC000156130256 345130074 /nfs/dbraw/zinc/13/00/74/345130074.db2.gz BDPAISBURWTYQS-IHRRRGAJSA-N 2 0 220.360 2.312 20 0 BEADRP CC(F)(F)CCC[NH2+][C@@H]1CCC[C@H]1C[NH3+] ZINC000390230673 259383014 /nfs/dbraw/zinc/38/30/14/259383014.db2.gz GQEXCQOICCQCFD-VHSXEESVSA-N 2 0 220.307 2.139 20 0 BEADRP C[C@H]1CCCCCN1CC12CC(C1)C[NH2+]2 ZINC000634992796 345187794 /nfs/dbraw/zinc/18/77/94/345187794.db2.gz BBTUCOGPHCDICB-HIFPTAJRSA-N 2 0 208.349 2.003 20 0 BEADRP C[C@H]1CCCC[C@@]1(C)[NH2+]CC12CC(C1)C[NH2+]2 ZINC000634996574 345189044 /nfs/dbraw/zinc/18/90/44/345189044.db2.gz OERJCNYONGASKY-RJZJGCCBSA-N 2 0 222.376 2.297 20 0 BEADRP CC1([NH2+]CC23CC(C2)C[NH2+]3)CCCCC1 ZINC000634993026 345189053 /nfs/dbraw/zinc/18/90/53/345189053.db2.gz JCBCFUNBCPVBOL-UHFFFAOYSA-N 2 0 208.349 2.051 20 0 BEADRP CCC(C)(C)CC[NH2+][C@@H]1CCOC[C@H]1[C@@H](C)[NH3+] ZINC000635021949 345224150 /nfs/dbraw/zinc/22/41/50/345224150.db2.gz QHQIXDIHJMQKOK-FRRDWIJNSA-N 2 0 242.407 2.155 20 0 BEADRP CCC(C)(C)CC[NH2+][C@@H]1CCOC[C@@H]1[C@@H](C)[NH3+] ZINC000635021950 345224169 /nfs/dbraw/zinc/22/41/69/345224169.db2.gz QHQIXDIHJMQKOK-JHJVBQTASA-N 2 0 242.407 2.155 20 0 BEADRP CCC(C)(C)CC[NH2+][C@H](CCC[NH3+])COC ZINC000635024235 345224927 /nfs/dbraw/zinc/22/49/27/345224927.db2.gz USGPAJQEDGIFDP-GFCCVEGCSA-N 2 0 230.396 2.156 20 0 BEADRP CC[C@@H]1CCC[N@H+](C[C@@]2(C)CC[NH2+]C2)CC1 ZINC000226993522 345245776 /nfs/dbraw/zinc/24/57/76/345245776.db2.gz VCLMMGRARILWOS-KGLIPLIRSA-N 2 0 224.392 2.498 20 0 BEADRP CCc1ccc(C[N@@H+]2CC[C@@H]([NH3+])[C@@H](C)C2)cc1 ZINC000227057917 345246162 /nfs/dbraw/zinc/24/61/62/345246162.db2.gz UHSCNENIZQZPMG-SWLSCSKDSA-N 2 0 232.371 2.418 20 0 BEADRP CCOc1cccc(C[N@@H+]2CC[C@@H]([NH3+])[C@@H](C)C2)c1 ZINC000227057996 345246375 /nfs/dbraw/zinc/24/63/75/345246375.db2.gz QJMRYCNSBGAUPI-SWLSCSKDSA-N 2 0 248.370 2.254 20 0 BEADRP C[C@H]1CN(CC23CC(C2)C[NH2+]3)CC(C)(C)C1 ZINC000634993814 345192027 /nfs/dbraw/zinc/19/20/27/345192027.db2.gz HGDKLISMDVJPHK-LKSINWNRSA-N 2 0 222.376 2.106 20 0 BEADRP C/C=C\C[C@H]1CCCN(CC23CC(C2)C[NH2+]3)C1 ZINC000634997043 345194031 /nfs/dbraw/zinc/19/40/31/345194031.db2.gz BOHQHWUXFLHQOD-DQUHXPLVSA-N 2 0 234.387 2.417 20 0 BEADRP C(N1CCCC2(CC2)CC1)C12CC(C1)C[NH2+]2 ZINC000634997096 345194202 /nfs/dbraw/zinc/19/42/02/345194202.db2.gz CTPJLIGOVMBNKO-UHFFFAOYSA-N 2 0 220.360 2.005 20 0 BEADRP C[C@]1(C[NH+]2CCC(CCF)CC2)CC[NH2+]C1 ZINC000634998278 345198005 /nfs/dbraw/zinc/19/80/05/345198005.db2.gz CVOVGCJXJTZDIN-ZDUSSCGKSA-N 2 0 228.355 2.058 20 0 BEADRP C[C@@H]1C[C@H](C[NH+]2CCC(CCF)CC2)CC[NH2+]1 ZINC000634998468 345198111 /nfs/dbraw/zinc/19/81/11/345198111.db2.gz GBBCKDFSQFJXIA-TZMCWYRMSA-N 2 0 242.382 2.446 20 0 BEADRP CC(C)C[C@@H]([NH3+])C[NH2+][C@H]1CCCC12CC2 ZINC000634998770 345199030 /nfs/dbraw/zinc/19/90/30/345199030.db2.gz KQXIGUZYHYECNR-NEPJUHHUSA-N 2 0 210.365 2.282 20 0 BEADRP CC[C@@](C)([NH2+]CCC[NH3+])c1ccc(F)cc1 ZINC000634999154 345199216 /nfs/dbraw/zinc/19/92/16/345199216.db2.gz QSKLURAHMFGSAJ-CYBMUJFWSA-N 2 0 224.323 2.389 20 0 BEADRP C[C@@H]1C[N@H+](CC(C)(C)c2ccccc2)C[C@H]1C[NH3+] ZINC000634998958 345199453 /nfs/dbraw/zinc/19/94/53/345199453.db2.gz NMMOAAJGRCWMJB-ZIAGYGMSSA-N 2 0 246.398 2.491 20 0 BEADRP Cc1cccc(C[N@@H+]2C[C@@H](C[NH3+])[C@H](C)C2)c1C ZINC000634999870 345201263 /nfs/dbraw/zinc/20/12/63/345201263.db2.gz BKPQJXSXFCFNIB-IUODEOHRSA-N 2 0 232.371 2.330 20 0 BEADRP CCOc1cccc(C[N@H+]2C[C@@H](C[NH3+])[C@H](C)C2)c1 ZINC000634999902 345201871 /nfs/dbraw/zinc/20/18/71/345201871.db2.gz BWSUAAWMLIYNOP-TZMCWYRMSA-N 2 0 248.370 2.112 20 0 BEADRP C1CC12CCC[C@@H]2[NH2+][C@H]1CCC[NH2+]CC1 ZINC000634998048 345203014 /nfs/dbraw/zinc/20/30/14/345203014.db2.gz ZTRVOEFXMQDBJV-RYUDHWBXSA-N 2 0 208.349 2.051 20 0 BEADRP Cc1ncc([C@H](C)[NH2+][C@H](C)C[C@@H](C)[NH3+])s1 ZINC000635006333 345210549 /nfs/dbraw/zinc/21/05/49/345210549.db2.gz MDFABEYSOMKLKH-HLTSFMKQSA-N 2 0 227.377 2.228 20 0 BEADRP Cc1ncc([C@H](C)[NH2+][C@@H](C)C[C@H](C)[NH3+])s1 ZINC000635006308 345210673 /nfs/dbraw/zinc/21/06/73/345210673.db2.gz MDFABEYSOMKLKH-CIUDSAMLSA-N 2 0 227.377 2.228 20 0 BEADRP CC1CC([NH2+]CC[C@H]([NH3+])Cc2ccccc2)C1 ZINC000635010120 345212035 /nfs/dbraw/zinc/21/20/35/345212035.db2.gz YLNKXHBDFLKIDF-BLZCZZARSA-N 2 0 232.371 2.335 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]Cc1cccc2[nH]ccc21 ZINC000635011326 345213594 /nfs/dbraw/zinc/21/35/94/345213594.db2.gz DTQGNLQGLGWGRB-QWRGUYRKSA-N 2 0 231.343 2.383 20 0 BEADRP CC(C)[C@H](C)[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000635012632 345214634 /nfs/dbraw/zinc/21/46/34/345214634.db2.gz UUFYOVUJMJSHED-RYUDHWBXSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CC[C@H](C[NH3+])CC2)[C@H]1C ZINC000635007686 345215096 /nfs/dbraw/zinc/21/50/96/345215096.db2.gz XDQRHVCFEWBHAL-MLGHIDQZSA-N 2 0 210.365 2.138 20 0 BEADRP CC(C)N(C)C[C@H](C)[NH2+][C@H]1CCC[C@@H]1C ZINC000380276426 345265339 /nfs/dbraw/zinc/26/53/39/345265339.db2.gz XUKGIPBJGZGTAK-AVGNSLFASA-N 2 0 212.381 2.493 20 0 BEADRP CCOC(C)(C)C[NH2+][C@@H]1C[C@@H](C)N(C2CC2)C1 ZINC000159251100 345419856 /nfs/dbraw/zinc/41/98/56/345419856.db2.gz RFMNJKHZLCRSRZ-VXGBXAGGSA-N 2 0 240.391 2.016 20 0 BEADRP c1cnc2c(c1)cccc2CN[C@@H]1CCC[NH2+]C1 ZINC000159316922 345423864 /nfs/dbraw/zinc/42/38/64/345423864.db2.gz PRDZRKJIZGRHLR-CQSZACIVSA-N 2 0 241.338 2.076 20 0 BEADRP CN(CC[NH+](C)C)c1cc[nH+]c2cc(F)ccc21 ZINC000080685362 345429640 /nfs/dbraw/zinc/42/96/40/345429640.db2.gz LVTMJJKZRCDFCT-UHFFFAOYSA-N 2 0 247.317 2.372 20 0 BEADRP CC(C)C[C@H](C)C[N@@H+]1C[C@@H]2CC[C@@H]([NH3+])[C@H]2C1 ZINC000336653169 187305266 /nfs/dbraw/zinc/30/52/66/187305266.db2.gz FZYLVRLPFGTQPB-XDQVBPFNSA-N 2 0 224.392 2.338 20 0 BEADRP C([NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)C1(C2CC2)CC1 ZINC000090772698 345575664 /nfs/dbraw/zinc/57/56/64/345575664.db2.gz VUZHWDSIQVJVQA-KBPBESRZSA-N 2 0 234.387 2.393 20 0 BEADRP C1C[C@@H]2C[C@H]([NH2+]C3CCSCC3)CC[N@@H+]2C1 ZINC000106868993 187308106 /nfs/dbraw/zinc/30/81/06/187308106.db2.gz IRSLVGSOGWWFBB-CHWSQXEVSA-N 2 0 240.416 2.098 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+][C@@H](C)[C@H]1CCC[NH2+]C1 ZINC000319086429 259384253 /nfs/dbraw/zinc/38/42/53/259384253.db2.gz CFDFSSKWACRCEZ-CYDGBPFRSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@H]1C[C@H]([N@H+](C)C2CCCCC2)CC[NH2+]1 ZINC000229539137 537908678 /nfs/dbraw/zinc/90/86/78/537908678.db2.gz PZHBMFMTNTYDNX-WCQYABFASA-N 2 0 210.365 2.391 20 0 BEADRP CC(C)[NH2+][C@@H]1CCCN(CC2CCC2)C1 ZINC000070585040 345789053 /nfs/dbraw/zinc/78/90/53/345789053.db2.gz PKTIPDWJQNRTMV-CYBMUJFWSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H]1C[C@H](NCc2cnc(C3CC3)o2)CC[N@@H+]1C ZINC000628223413 345964238 /nfs/dbraw/zinc/96/42/38/345964238.db2.gz CYPPSQQJZIHXGW-ZYHUDNBSSA-N 2 0 249.358 2.124 20 0 BEADRP CC[C@H](CSC)[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000401008664 346030958 /nfs/dbraw/zinc/03/09/58/346030958.db2.gz FVLNTVPPICRYKC-UMSGYPCISA-N 2 0 242.432 2.106 20 0 BEADRP CCCCC[N@@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC000366481847 537953515 /nfs/dbraw/zinc/95/35/15/537953515.db2.gz LWBIVBLZERWHBI-CYBMUJFWSA-N 2 0 210.365 2.204 20 0 BEADRP CCC1(C[NH2+][C@@H](C)C2CC[NH+](C)CC2)CC1 ZINC000090219715 537955884 /nfs/dbraw/zinc/95/58/84/537955884.db2.gz TYDQRCPVOJRPDE-LBPRGKRZSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1cccc(C[N@@H+]2CC[C@@H](C[NH3+])C2)c1C ZINC000050245536 179078443 /nfs/dbraw/zinc/07/84/43/179078443.db2.gz HAHXYLPZNSHCMZ-ZDUSSCGKSA-N 2 0 218.344 2.084 20 0 BEADRP Cc1ccc(CN(C)[C@H](C[NH3+])C2CC2)cc1F ZINC000159676039 346427312 /nfs/dbraw/zinc/42/73/12/346427312.db2.gz HIPLUELNYXMBKG-CQSZACIVSA-N 2 0 236.334 2.303 20 0 BEADRP Cc1cccc(C[N@H+]2CC[C@H]([C@H](C)[NH3+])C2)c1C ZINC000228151548 179082783 /nfs/dbraw/zinc/08/27/83/179082783.db2.gz ZFEKOWXRNGNBGA-ZFWWWQNUSA-N 2 0 232.371 2.473 20 0 BEADRP C[C@H](C1CC1)[N@H+](C)CCC[NH+]1CCCC1 ZINC000170794146 346451930 /nfs/dbraw/zinc/45/19/30/346451930.db2.gz TVHVQENCRVACLD-GFCCVEGCSA-N 2 0 210.365 2.203 20 0 BEADRP Cc1c[nH+]ccc1NC[C@@H]1CCC[N@@H+](C)C1 ZINC000070047283 349965641 /nfs/dbraw/zinc/96/56/41/349965641.db2.gz COZQPSTVNICZHU-LBPRGKRZSA-N 2 0 219.332 2.144 20 0 BEADRP Cc1cccc(C[NH2+][C@H]2CC[N@@H+](C)C[C@@H]2C)c1 ZINC000105480771 179101346 /nfs/dbraw/zinc/10/13/46/179101346.db2.gz HSGQEBFLXRMXIJ-ZFWWWQNUSA-N 2 0 232.371 2.425 20 0 BEADRP Cc1ccc(CC[NH2+][C@H]2C[C@H]([NH3+])C2(C)C)cc1 ZINC000641802608 362754804 /nfs/dbraw/zinc/75/48/04/362754804.db2.gz NRLCTDJBUFCHLZ-KBPBESRZSA-N 2 0 232.371 2.253 20 0 BEADRP CC1(C)c2ccccc2CC[N@H+]1C[C@H]1CC[NH2+]C1 ZINC000641802132 362758127 /nfs/dbraw/zinc/75/81/27/362758127.db2.gz XWTHCGPRIHCHHY-ZDUSSCGKSA-N 2 0 244.382 2.389 20 0 BEADRP Cc1cccnc1CN1[C@@H](C)[C@H](C)CC[C@H]1C[NH3+] ZINC000641809492 362766496 /nfs/dbraw/zinc/76/64/96/362766496.db2.gz QQADHQOFYCWAET-XBFCOCLRSA-N 2 0 247.386 2.338 20 0 BEADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+][C@@H]1CO[C@@H](C)C1 ZINC000402170012 349975392 /nfs/dbraw/zinc/97/53/92/349975392.db2.gz UVDCBERDHIHEAS-RFGFWPKPSA-N 2 0 240.391 2.064 20 0 BEADRP Cc1cccc(OCC[N@H+]2CC[C@H]([NH3+])C[C@@H]2C)c1 ZINC000042896903 179167483 /nfs/dbraw/zinc/16/74/83/179167483.db2.gz NECPUYJBHXJNAD-KBPBESRZSA-N 2 0 248.370 2.185 20 0 BEADRP CN(C[C@@H]1CCC2(CCCC2)O1)CC(C)(C)[NH3+] ZINC000641825535 362775078 /nfs/dbraw/zinc/77/50/78/362775078.db2.gz YTRLWHYUBRMEDZ-LBPRGKRZSA-N 2 0 240.391 2.147 20 0 BEADRP Cc1cccc([C@@H](C)[N@H+]2C[C@H]3C[NH2+]C[C@H]3C2)c1 ZINC000203597023 179181142 /nfs/dbraw/zinc/18/11/42/179181142.db2.gz XBPHPELGIVYRHC-YUELXQCFSA-N 2 0 230.355 2.207 20 0 BEADRP Cc1cccc2c1C[N@H+](CCn1ccnc1)CC2 ZINC000277406291 179216864 /nfs/dbraw/zinc/21/68/64/179216864.db2.gz ZTSBUTWGULPZOV-UHFFFAOYSA-N 2 0 241.338 2.250 20 0 BEADRP CCc1ccc(C[N@@H+]2CC[C@H]([NH3+])[C@@H](C)C2)cc1 ZINC000227057923 136730267 /nfs/dbraw/zinc/73/02/67/136730267.db2.gz UHSCNENIZQZPMG-WFASDCNBSA-N 2 0 232.371 2.418 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1CCC[NH2+]1)C1CCCC1 ZINC000382792381 347418822 /nfs/dbraw/zinc/41/88/22/347418822.db2.gz QCLBXFIHWKPFNT-STQMWFEESA-N 2 0 210.365 2.297 20 0 BEADRP CC1(C)CC[C@H]1[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000336769188 347446768 /nfs/dbraw/zinc/44/67/68/347446768.db2.gz VIQWLZCMOKQWQJ-NWDGAFQWSA-N 2 0 210.365 2.297 20 0 BEADRP C[N@H+]1CC=C(C[NH2+]C[C@@]2(C)CCCS2)CC1 ZINC000392185349 347503665 /nfs/dbraw/zinc/50/36/65/347503665.db2.gz DAXPZWYIXUYCHY-CYBMUJFWSA-N 2 0 240.416 2.124 20 0 BEADRP Cc1ccccc1CC[NH2+]CC1CC[NH2+]CC1 ZINC000094183100 179265807 /nfs/dbraw/zinc/26/58/07/179265807.db2.gz JUJMSUVKLMASGC-UHFFFAOYSA-N 2 0 232.371 2.127 20 0 BEADRP Cc1ccccc1C[NH2+]C1CCC([NH3+])CC1 ZINC000051692863 179281073 /nfs/dbraw/zinc/28/10/73/179281073.db2.gz SYCBVMAJHVHPLJ-UHFFFAOYSA-N 2 0 218.344 2.355 20 0 BEADRP Cc1ccccc1C[NH2+]C[C@H](C)C[NH+](C)C ZINC000309766839 179281420 /nfs/dbraw/zinc/28/14/20/179281420.db2.gz NVLVMCDFXXGOST-LBPRGKRZSA-N 2 0 220.360 2.282 20 0 BEADRP Cc1ccccc1C[NH2+][C@H](C)CCC[NH3+] ZINC000308877445 179283996 /nfs/dbraw/zinc/28/39/96/179283996.db2.gz USMBEEJACDSPGR-GFCCVEGCSA-N 2 0 206.333 2.212 20 0 BEADRP Cc1ccccc1C[C@@H](C)[NH2+]C[C@@H](C)C[NH3+] ZINC000309396113 179289300 /nfs/dbraw/zinc/28/93/00/179289300.db2.gz UMINDUQADLDYRK-WCQYABFASA-N 2 0 220.360 2.110 20 0 BEADRP CCS[C@H]1CCCC[N@H+](C[C@H]2CC[NH2+]C2)C1 ZINC000592477068 347791620 /nfs/dbraw/zinc/79/16/20/347791620.db2.gz QYLYNUMHGZSOEE-STQMWFEESA-N 2 0 242.432 2.204 20 0 BEADRP Cc1ccccc1OCCC[NH2+]CC1([NH3+])CCC1 ZINC000342120193 179309038 /nfs/dbraw/zinc/30/90/38/179309038.db2.gz HLMZDTKGLOSZIY-UHFFFAOYSA-N 2 0 248.370 2.235 20 0 BEADRP C[C@H](Cc1ccco1)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000054241421 1172096893 /nfs/dbraw/zinc/09/68/93/1172096893.db2.gz FVKWUGHAEUDXPK-OLZOCXBDSA-N 2 0 236.359 2.142 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH2+][C@H]2CCC2(C)C)C1 ZINC000389388654 537994853 /nfs/dbraw/zinc/99/48/53/537994853.db2.gz UOQFGUXMWOHZBJ-RYUDHWBXSA-N 2 0 210.365 2.106 20 0 BEADRP Cc1ccccc1[C@@H]1CCC[N@H+]1C[C@@H](C)[NH3+] ZINC000336405946 179329152 /nfs/dbraw/zinc/32/91/52/179329152.db2.gz DSLRHJMTZVLHKH-OCCSQVGLSA-N 2 0 218.344 2.479 20 0 BEADRP CC[C@H](C)C[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@@H]1C ZINC000054468132 348023080 /nfs/dbraw/zinc/02/30/80/348023080.db2.gz HTLOIIFJKSVNMK-ZDEQEGDKSA-N 2 0 212.381 2.351 20 0 BEADRP C[C@@H](CSCCF)[NH2+]CC1CC[NH+](C)CC1 ZINC000595009111 348159294 /nfs/dbraw/zinc/15/92/94/348159294.db2.gz AAJHLSPYVAKWJQ-NSHDSACASA-N 2 0 248.411 2.009 20 0 BEADRP C[C@H](c1cccnc1)[N@@H+]1CC[C@@H](C)[C@H](C[NH3+])C1 ZINC000253176867 348228963 /nfs/dbraw/zinc/22/89/63/348228963.db2.gz ALZILMHMUQIRFN-YRGRVCCFSA-N 2 0 233.359 2.059 20 0 BEADRP CSCC1(CC[NH2+][C@@H]2CCC[C@H]2C[NH3+])CC1 ZINC000596648941 348604416 /nfs/dbraw/zinc/60/44/16/348604416.db2.gz BOEUWFLMZBKRME-NWDGAFQWSA-N 2 0 242.432 2.237 20 0 BEADRP CCSC1(C[NH2+][C@H]2CCCC[C@H]2C[NH3+])CC1 ZINC000596649016 348605383 /nfs/dbraw/zinc/60/53/83/348605383.db2.gz ACGDEQWQABVQRJ-RYUDHWBXSA-N 2 0 242.432 2.379 20 0 BEADRP CSCC1(CC[NH2+][C@H]2CCC[C@@H]([NH3+])C2)CC1 ZINC000596651878 348605895 /nfs/dbraw/zinc/60/58/95/348605895.db2.gz RHODEEIGOCFSHP-NEPJUHHUSA-N 2 0 242.432 2.379 20 0 BEADRP CSCC1(CC[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)CC1 ZINC000596651882 348605981 /nfs/dbraw/zinc/60/59/81/348605981.db2.gz RHODEEIGOCFSHP-VXGBXAGGSA-N 2 0 242.432 2.379 20 0 BEADRP CCSC1(C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)CC1 ZINC000596652890 348607117 /nfs/dbraw/zinc/60/71/17/348607117.db2.gz QNRCQODGEVXXOY-MNOVXSKESA-N 2 0 228.405 2.132 20 0 BEADRP Cc1c[nH+]ccc1N1CC[C@H](C[NH+]2CCCC2)C1 ZINC000336372188 179706434 /nfs/dbraw/zinc/70/64/34/179706434.db2.gz VVBHDRWGTXRZMH-CQSZACIVSA-N 2 0 245.370 2.312 20 0 BEADRP C(C[C@@H]1CCC[NH2+]C1)[NH2+]C(C1CC1)C1CC1 ZINC000054309193 348975183 /nfs/dbraw/zinc/97/51/83/348975183.db2.gz GSQFFFCQRSEGCU-NSHDSACASA-N 2 0 222.376 2.154 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+]C[C@@H]2CCSC2)CC1(C)C ZINC000623509998 362934968 /nfs/dbraw/zinc/93/49/68/362934968.db2.gz BJPLQZVDMYWHDQ-NWDGAFQWSA-N 2 0 242.432 2.202 20 0 BEADRP COC1([C@H](C)[NH2+]C[C@@H](C)C[NH+](C)C)CCCC1 ZINC000421853143 192389915 /nfs/dbraw/zinc/38/99/15/192389915.db2.gz IPHBFUOETMMYHM-OLZOCXBDSA-N 2 0 242.407 2.121 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+][C@@H]2CSC2(C)C)CC1(C)C ZINC000623516292 362940926 /nfs/dbraw/zinc/94/09/26/362940926.db2.gz LVMNBSJQJPTDOK-GHMZBOCLSA-N 2 0 242.432 2.343 20 0 BEADRP CC(C)[N@@H+]1CC[C@H](C[NH2+][C@H]2CCCSC2)C1 ZINC000250483673 349171251 /nfs/dbraw/zinc/17/12/51/349171251.db2.gz DEMWUSNSSPWNMW-OLZOCXBDSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@H]1CC[C@H]([NH2+][C@@H]2CCC[C@@H]([NH3+])C2)CC1 ZINC000253117810 349224034 /nfs/dbraw/zinc/22/40/34/349224034.db2.gz GUBGSODFOXBQMU-FDYHWXHSSA-N 2 0 210.365 2.425 20 0 BEADRP CCC[C@H](C[NH2+][C@H]1CCCCC[C@H]1[NH3+])OCC ZINC000530212959 323216365 /nfs/dbraw/zinc/21/63/65/323216365.db2.gz SHMQOPDYGWYGKS-MCIONIFRSA-N 2 0 242.407 2.441 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000388590904 349203141 /nfs/dbraw/zinc/20/31/41/349203141.db2.gz APCXIVGVPWIAGY-UPJWGTAASA-N 2 0 210.365 2.154 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000388590905 349203574 /nfs/dbraw/zinc/20/35/74/349203574.db2.gz APCXIVGVPWIAGY-XQQFMLRXSA-N 2 0 210.365 2.154 20 0 BEADRP Cc1ccccc1[C@H](C)[NH+]1C[C@@H]2C[NH2+]C[C@H]2C1 ZINC000251168185 538036291 /nfs/dbraw/zinc/03/62/91/538036291.db2.gz NZDSDZBHTWOTNB-IHRRRGAJSA-N 2 0 230.355 2.207 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000388623663 349274603 /nfs/dbraw/zinc/27/46/03/349274603.db2.gz HZXHLGKKUQGSRF-NDBYEHHHSA-N 2 0 210.365 2.425 20 0 BEADRP CC[C@@H]([NH2+]CCC[NH+](CC)CC)[C@H]1CCOC1 ZINC000131454064 191014805 /nfs/dbraw/zinc/01/48/05/191014805.db2.gz NNVUWGQZUIUAIU-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]Cc1ccc2ccccc2n1 ZINC000422702813 192434903 /nfs/dbraw/zinc/43/49/03/192434903.db2.gz LSMNIJOWKPYJFS-NEPJUHHUSA-N 2 0 243.354 2.450 20 0 BEADRP Cc1ncsc1C[NH2+]Cc1ccc(C[NH3+])cc1 ZINC000071213761 350092635 /nfs/dbraw/zinc/09/26/35/350092635.db2.gz ZEMMVXIAMJQGMT-UHFFFAOYSA-N 2 0 247.367 2.200 20 0 BEADRP CC[C@H]([NH2+]CCC[NH+](CC)CC)[C@@H]1CCOC1 ZINC000131453476 191015480 /nfs/dbraw/zinc/01/54/80/191015480.db2.gz NNVUWGQZUIUAIU-KGLIPLIRSA-N 2 0 242.407 2.123 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)CC2CC2)C1 ZINC000132427268 191032863 /nfs/dbraw/zinc/03/28/63/191032863.db2.gz WUOLIKCKIWIPNN-WCQYABFASA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@H]1C[N@H+](CCOCCC(C)C)CC[C@@H]1[NH3+] ZINC000147517896 538057063 /nfs/dbraw/zinc/05/70/63/538057063.db2.gz CLAJCXVFQVBKOT-KBPBESRZSA-N 2 0 242.407 2.108 20 0 BEADRP CSC1(C[NH2+]C[C@@H]2CC[N@@H+](C(C)C)C2)CC1 ZINC000304248333 350150606 /nfs/dbraw/zinc/15/06/06/350150606.db2.gz GLOBHMGINKUYAG-LBPRGKRZSA-N 2 0 242.432 2.202 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CCC[C@H]([NH3+])C2)nc1C ZINC000313915501 350166237 /nfs/dbraw/zinc/16/62/37/350166237.db2.gz JPXMPFYUZYVRIL-STQMWFEESA-N 2 0 233.359 2.058 20 0 BEADRP Cc1c[nH+]ccc1Nc1ccc2c(c1)C[NH2+]CC2 ZINC000420190345 192172497 /nfs/dbraw/zinc/17/24/97/192172497.db2.gz QMVAKEGGOCKHJS-UHFFFAOYSA-N 2 0 239.322 2.201 20 0 BEADRP C[C@H]([NH2+]CCC[NH+]1CCCCC1)[C@H]1CCCO1 ZINC000154413854 191076801 /nfs/dbraw/zinc/07/68/01/191076801.db2.gz HTCLUIDSMNLLHL-UONOGXRCSA-N 2 0 240.391 2.020 20 0 BEADRP Cc1nccn1CC[C@@H]1CCCC[N@H+]1C ZINC000230201916 180262529 /nfs/dbraw/zinc/26/25/29/180262529.db2.gz IBBOSNNDVUJHOG-LBPRGKRZSA-N 2 0 207.321 2.066 20 0 BEADRP C(CC1CCCCC1)[NH2+]C1CC[NH2+]CC1 ZINC000038041473 350302804 /nfs/dbraw/zinc/30/28/04/350302804.db2.gz PVYQYFUUXLPJOX-UHFFFAOYSA-N 2 0 210.365 2.298 20 0 BEADRP [NH3+][C@@H]1CCN(Cc2ccc3ccccc3c2)C1 ZINC000050227776 350315527 /nfs/dbraw/zinc/31/55/27/350315527.db2.gz ULQUIJXXQLXMTQ-OAHLLOKOSA-N 2 0 226.323 2.373 20 0 BEADRP CC(C)C[C@@H](CN(C)C)[NH2+]C[C@@H]1CCSC1 ZINC000224376994 350319821 /nfs/dbraw/zinc/31/98/21/350319821.db2.gz WWMZDIYBTDJMJP-STQMWFEESA-N 2 0 244.448 2.305 20 0 BEADRP CCC[C@H](C[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1)OC ZINC000623535260 362954319 /nfs/dbraw/zinc/95/43/19/362954319.db2.gz SARGAMSPGZTZGI-QWHCGFSZSA-N 2 0 242.407 2.264 20 0 BEADRP CC[C@@H]([NH2+]C1CCC([NH3+])CC1)c1ccncc1 ZINC000422785934 192466833 /nfs/dbraw/zinc/46/68/33/192466833.db2.gz PTHDFZHRAHTBKK-JXQTWKCFSA-N 2 0 233.359 2.392 20 0 BEADRP CCC1([NH2+][C@H]2CC[N@H+](C)C(C)(C)C2)CC1 ZINC000623536832 362955846 /nfs/dbraw/zinc/95/58/46/362955846.db2.gz DKPLNJHQNXUHMM-NSHDSACASA-N 2 0 210.365 2.391 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+][C@@H]2CCOC2(C)C)CC1(C)C ZINC000623537454 362956991 /nfs/dbraw/zinc/95/69/91/362956991.db2.gz YKSCGTVDUBYYDO-VXGBXAGGSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@@H]1C[NH+](CCC2CC[NH2+]CC2)C[C@@H](C)S1 ZINC000069910110 350443365 /nfs/dbraw/zinc/44/33/65/350443365.db2.gz SNRBWXQYTPMIJT-VXGBXAGGSA-N 2 0 242.432 2.202 20 0 BEADRP CCCN1CCC[C@@H]1C[NH2+]CC(C)(C)C ZINC000336758880 350502671 /nfs/dbraw/zinc/50/26/71/350502671.db2.gz KFIOMUNBMIJCQS-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP Cc1ccccc1C[NH2+]CCC[NH2+]C1CC1 ZINC000163439960 350521578 /nfs/dbraw/zinc/52/15/78/350521578.db2.gz PPULIGVPPVTICJ-UHFFFAOYSA-N 2 0 218.344 2.227 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]CCCC(F)(F)F)C1 ZINC000123990864 350676919 /nfs/dbraw/zinc/67/69/19/350676919.db2.gz UDCYSSTZDPOBOQ-BDAKNGLRSA-N 2 0 224.270 2.188 20 0 BEADRP CCO[C@H]1C[C@H]([NH2+][C@@H]2CC[N@H+](C)C(C)(C)C2)C1 ZINC000623564115 362990692 /nfs/dbraw/zinc/99/06/92/362990692.db2.gz SKCAYAIUBGUULX-JHJVBQTASA-N 2 0 240.391 2.016 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C[C@]2(C)CC2(F)F)CC1(C)C ZINC000623570153 362999456 /nfs/dbraw/zinc/99/94/56/362999456.db2.gz JEADXLFZSUGSDX-JQWIXIFHSA-N 2 0 246.345 2.494 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@H]2[C@@H]3CCC[C@@H]32)CC1(C)C ZINC000623572202 363002274 /nfs/dbraw/zinc/00/22/74/363002274.db2.gz USPUTNMZZPVBDO-WUHRBBMRSA-N 2 0 222.376 2.247 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CC[C@H]2CC2(F)F)CC1(C)C ZINC000623575977 363005964 /nfs/dbraw/zinc/00/59/64/363005964.db2.gz YIPCNDXYUCEMRE-QWRGUYRKSA-N 2 0 246.345 2.494 20 0 BEADRP C[C@@H]1CCC[C@@H](C)C1[NH2+]CC1CC[NH2+]CC1 ZINC000571549995 351080104 /nfs/dbraw/zinc/08/01/04/351080104.db2.gz ZKABCJUIMISBRG-VXGBXAGGSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1CCC[C@H](C)[C@H]1[NH2+]CC1CC[NH2+]CC1 ZINC000571549993 351080513 /nfs/dbraw/zinc/08/05/13/351080513.db2.gz ZKABCJUIMISBRG-IMRBUKKESA-N 2 0 224.392 2.400 20 0 BEADRP CSCC[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCCC[NH2+]1 ZINC000086500069 351165811 /nfs/dbraw/zinc/16/58/11/351165811.db2.gz CHRDHUPQJFZAFH-RWMBFGLXSA-N 2 0 242.432 2.250 20 0 BEADRP CSCC[NH2+][C@@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000086501071 351166225 /nfs/dbraw/zinc/16/62/25/351166225.db2.gz KDGUJAZBECZYMI-RYUDHWBXSA-N 2 0 230.421 2.250 20 0 BEADRP Cc1cccc(CN[C@H](C)[C@H]2CCCC[NH2+]2)n1 ZINC000386552810 363013435 /nfs/dbraw/zinc/01/34/35/363013435.db2.gz HHCSDRGHUWSMML-TZMCWYRMSA-N 2 0 233.359 2.010 20 0 BEADRP CC(C)[C@@H](C)[N@H+](C)C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000261530860 535161605 /nfs/dbraw/zinc/16/16/05/535161605.db2.gz DIDRAFOUPUORSR-JHJVBQTASA-N 2 0 212.381 2.351 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+]CCCC1CC1 ZINC000577740196 366049220 /nfs/dbraw/zinc/04/92/20/366049220.db2.gz NKPUCYADLDSTIU-WCQYABFASA-N 2 0 210.365 2.154 20 0 BEADRP c1ccc(C[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)cc1 ZINC000307298462 351912216 /nfs/dbraw/zinc/91/22/16/351912216.db2.gz AJKXLOLBWRVZPN-SOUVJXGZSA-N 2 0 230.355 2.164 20 0 BEADRP Cc1scc(C[NH+]2C[C@H]3C[NH2+]C[C@@H]3C2)c1C ZINC000638185746 352050254 /nfs/dbraw/zinc/05/02/54/352050254.db2.gz AACAQCDBOVOTSZ-VXGBXAGGSA-N 2 0 236.384 2.016 20 0 BEADRP CCCCC[NH2+]C1CC[NH+](CC(C)(C)O)CC1 ZINC000638289127 352124334 /nfs/dbraw/zinc/12/43/34/352124334.db2.gz DMYBNBXJWSKIPG-UHFFFAOYSA-N 2 0 242.407 2.002 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@@H](C)[C@H]1CC1(F)F ZINC000638338245 352158208 /nfs/dbraw/zinc/15/82/08/352158208.db2.gz UOEFKCAMYATAKF-WDEREUQCSA-N 2 0 234.334 2.350 20 0 BEADRP C([NH2+]C1CC[NH+](CC2CC2)CC1)[C@@H]1C[C@H]2C[C@H]2C1 ZINC000638384407 352195256 /nfs/dbraw/zinc/19/52/56/352195256.db2.gz VCUCZKBTNHOPKN-QDMKHBRRSA-N 2 0 248.414 2.497 20 0 BEADRP Cc1cccc(C[NH2+][C@H](C)C[C@H](C)[NH3+])c1 ZINC000422801498 192473363 /nfs/dbraw/zinc/47/33/63/192473363.db2.gz FOTKQBFYUHLZKG-NWDGAFQWSA-N 2 0 206.333 2.210 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+]C[C@](C)(CC)OC)C1 ZINC000638408450 352214570 /nfs/dbraw/zinc/21/45/70/352214570.db2.gz BBOPGDHXXBXYLV-KGLIPLIRSA-N 2 0 242.407 2.123 20 0 BEADRP CC[N@@H+]1CCC[C@@H](C[NH2+]C[C@@H]2C[C@H]3C[C@H]3C2)C1 ZINC000638452128 352262034 /nfs/dbraw/zinc/26/20/34/352262034.db2.gz VEEOBYDUOOGSTM-XQLPTFJDSA-N 2 0 236.403 2.354 20 0 BEADRP C[C@H](CCc1ccccc1F)[NH2+]CCCC[NH3+] ZINC000414915324 352262437 /nfs/dbraw/zinc/26/24/37/352262437.db2.gz ZCCGVHZZLXNQBX-GFCCVEGCSA-N 2 0 238.350 2.475 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000414918230 352273212 /nfs/dbraw/zinc/27/32/12/352273212.db2.gz TWEWCEVDACGCRO-FRRDWIJNSA-N 2 0 210.365 2.154 20 0 BEADRP COc1cc(C[NH2+][C@@H]2CCC[NH2+]CC2)ccc1C ZINC000414918285 352273819 /nfs/dbraw/zinc/27/38/19/352273819.db2.gz RVCFHEAZVWFVSI-CQSZACIVSA-N 2 0 248.370 2.235 20 0 BEADRP COC[C@@H](CC(C)C)[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000414919521 352281670 /nfs/dbraw/zinc/28/16/70/352281670.db2.gz XFOOTZBQZNHTGY-ZIAGYGMSSA-N 2 0 242.407 2.027 20 0 BEADRP CCc1cc(NCC2CC[NH+](CC)CC2)ncn1 ZINC000044526321 352351341 /nfs/dbraw/zinc/35/13/41/352351341.db2.gz PWBRNQSPOPFLAQ-UHFFFAOYSA-N 2 0 248.374 2.183 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc(F)cc2)C1 ZINC000044535823 352351919 /nfs/dbraw/zinc/35/19/19/352351919.db2.gz UGFRGTAIOXYTNA-CYBMUJFWSA-N 2 0 236.334 2.257 20 0 BEADRP CC[NH+]1CCC([NH2+]Cc2cc(C)cc(N)c2)CC1 ZINC000414957888 352378696 /nfs/dbraw/zinc/37/86/96/352378696.db2.gz CCKRJRWACNBSGO-UHFFFAOYSA-N 2 0 247.386 2.151 20 0 BEADRP CCCCN(C)CC[NH2+][C@@H]1CS[C@@H](C)C1 ZINC000638586885 352418600 /nfs/dbraw/zinc/41/86/00/352418600.db2.gz XBPJMNSXWSSBKJ-RYUDHWBXSA-N 2 0 230.421 2.202 20 0 BEADRP CCCCN(C)CC[NH2+][C@H]1CS[C@H](C)C1 ZINC000638586886 352418649 /nfs/dbraw/zinc/41/86/49/352418649.db2.gz XBPJMNSXWSSBKJ-VXGBXAGGSA-N 2 0 230.421 2.202 20 0 BEADRP CC[C@@H]([NH2+][C@@H](C)CCCC[NH3+])C1CCOCC1 ZINC000422804575 192475681 /nfs/dbraw/zinc/47/56/81/192475681.db2.gz FPJDEGFKHLZTEW-GXTWGEPZSA-N 2 0 242.407 2.299 20 0 BEADRP CC(C)[C@H](C)[NH2+]C[C@H](C)C[NH+]1CCCC1 ZINC000062077839 188013354 /nfs/dbraw/zinc/01/33/54/188013354.db2.gz LXJWVAASEMDHFG-STQMWFEESA-N 2 0 212.381 2.352 20 0 BEADRP C1=CO[C@H](C[NH2+]CCC[NH+]2CCCCC2)CC1 ZINC000050267582 188046011 /nfs/dbraw/zinc/04/60/11/188046011.db2.gz NPUDJERZKHUVCW-AWEZNQCLSA-N 2 0 238.375 2.145 20 0 BEADRP C(C[NH+]1C[C@@H]2CCC[C@H]2C1)C1CC[NH2+]CC1 ZINC000126264630 188046677 /nfs/dbraw/zinc/04/66/77/188046677.db2.gz TVXBEYFWKNUNMU-KBPBESRZSA-N 2 0 222.376 2.108 20 0 BEADRP C([NH2+][C@@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1)C1CC1 ZINC000250896421 188047855 /nfs/dbraw/zinc/04/78/55/188047855.db2.gz YQHOUZQDMVWJLZ-BFHYXJOUSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]([NH3+])C1CC1)C1CCCCC1 ZINC000414895221 259435151 /nfs/dbraw/zinc/43/51/51/259435151.db2.gz WBTUVBQPWKZLTL-ZWNOBZJWSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]([NH2+]CC1(C)CC[NH+](C)CC1)[C@@H]1CC1(F)F ZINC000638956286 353169438 /nfs/dbraw/zinc/16/94/38/353169438.db2.gz HTTMKZTVXHFJKX-MNOVXSKESA-N 2 0 246.345 2.352 20 0 BEADRP C[C@H]([NH2+]CC1(C)CC[NH+](C)CC1)[C@H]1CC1(F)F ZINC000638956288 353169590 /nfs/dbraw/zinc/16/95/90/353169590.db2.gz HTTMKZTVXHFJKX-WDEREUQCSA-N 2 0 246.345 2.352 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCCSC1)C1CC[NH+](C)CC1 ZINC000157133346 538111193 /nfs/dbraw/zinc/11/11/93/538111193.db2.gz BEULIQOQBJSEFS-YPMHNXCESA-N 2 0 242.432 2.202 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)C1CC1 ZINC000159978686 538111505 /nfs/dbraw/zinc/11/15/05/538111505.db2.gz SDFPXNQBIRETAY-MRVWCRGKSA-N 2 0 222.376 2.249 20 0 BEADRP CC[C@H]([NH2+]CCCC[NH3+])c1ccc(OC)cc1 ZINC000037714969 358476624 /nfs/dbraw/zinc/47/66/24/358476624.db2.gz CPEJORLNGMIUOQ-AWEZNQCLSA-N 2 0 236.359 2.475 20 0 BEADRP CC[C@@H]1CCC[N@H+](C[C@@H]2CCC[NH2+]C2)CC1 ZINC000070613545 353260739 /nfs/dbraw/zinc/26/07/39/353260739.db2.gz QFISPLDUTYATLE-ZIAGYGMSSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H]1CCC[C@H](C[N@@H+]2CC[C@H]([NH3+])[C@@H](C)C2)C1 ZINC000251718408 353287994 /nfs/dbraw/zinc/28/79/94/353287994.db2.gz ILBOPLDSZVRMND-RFGFWPKPSA-N 2 0 224.392 2.482 20 0 BEADRP C[N@H+](CC1CC1)C[C@H]1CC[NH+](CCCF)C1 ZINC000361529303 188243870 /nfs/dbraw/zinc/24/38/70/188243870.db2.gz DNBWJHJAFFKENV-CYBMUJFWSA-N 2 0 228.355 2.010 20 0 BEADRP CC(C)C[C@H](C)C[N@@H+]1CC[C@@]2(CC[NH2+]C2)C1 ZINC000304514167 188250133 /nfs/dbraw/zinc/25/01/33/188250133.db2.gz DSHXKISDGOSVPJ-UONOGXRCSA-N 2 0 224.392 2.354 20 0 BEADRP CC(C)C[C@@H](C)C[N@@H+]1CC[C@]2(CC[NH2+]C2)C1 ZINC000304514163 188250580 /nfs/dbraw/zinc/25/05/80/188250580.db2.gz DSHXKISDGOSVPJ-KGLIPLIRSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]CC2CC[NH2+]CC2)[C@H]1C ZINC000252154009 353296924 /nfs/dbraw/zinc/29/69/24/353296924.db2.gz MZTMHQJBPGWXOD-DYEKYZERSA-N 2 0 224.392 2.400 20 0 BEADRP C[NH+]1CCC(CC[NH2+][C@H]2CCCSC2)CC1 ZINC000122416119 324044134 /nfs/dbraw/zinc/04/41/34/324044134.db2.gz BLRQBXVSEBZRGC-ZDUSSCGKSA-N 2 0 242.432 2.204 20 0 BEADRP C1CCCC([NH2+][C@@H]2CCCC[NH2+]C2)CC1 ZINC000129804934 188318024 /nfs/dbraw/zinc/31/80/24/188318024.db2.gz SKSMBUYAKVAVBJ-CYBMUJFWSA-N 2 0 210.365 2.441 20 0 BEADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+]Cc2cc[nH]c2)C1 ZINC000086252923 188318377 /nfs/dbraw/zinc/31/83/77/188318377.db2.gz CYDBNXSONJUZMV-AWEZNQCLSA-N 2 0 235.375 2.225 20 0 BEADRP CC(C)(CCO)C[NH2+][C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000227904912 188330915 /nfs/dbraw/zinc/33/09/15/188330915.db2.gz QBNPWQQSKLCIHN-KBPBESRZSA-N 2 0 248.370 2.129 20 0 BEADRP CC(C)C[C@H](C)C[N@@H+]1CC[C@@H]([C@@H](C)[NH3+])C1 ZINC000301013747 188335984 /nfs/dbraw/zinc/33/59/84/188335984.db2.gz ZEZNXFMIMGGYOE-YNEHKIRRSA-N 2 0 212.381 2.338 20 0 BEADRP CCCC[C@H](CC)C[NH+]1C[C@H]2C[NH2+]C[C@@H]2C1 ZINC000085283182 538116259 /nfs/dbraw/zinc/11/62/59/538116259.db2.gz JKDGBULEUOPIDQ-BFHYXJOUSA-N 2 0 224.392 2.354 20 0 BEADRP CC[N@@H+]1CCC[C@@H](C[NH2+]C[C@H]2CCSC2)C1 ZINC000336773922 353420552 /nfs/dbraw/zinc/42/05/52/353420552.db2.gz WLNLAMAGYRFKIQ-QWHCGFSZSA-N 2 0 242.432 2.061 20 0 BEADRP C(CN1CCCC1)[NH2+]C1CCC2(CC2)CC1 ZINC000336648482 188358515 /nfs/dbraw/zinc/35/85/15/188358515.db2.gz CQULTBGYQXOFLS-UHFFFAOYSA-N 2 0 222.376 2.395 20 0 BEADRP C([NH2+][C@@H]1CCC12CCC2)[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000337399690 188362521 /nfs/dbraw/zinc/36/25/21/188362521.db2.gz PEZLIFTZOIISPA-GXTWGEPZSA-N 2 0 234.387 2.393 20 0 BEADRP CC(C)(O)C(C)(C)C[NH2+][C@@H]1CCCCC[C@H]1[NH3+] ZINC000331953069 188368816 /nfs/dbraw/zinc/36/88/16/188368816.db2.gz JLSYXBPFZUQCES-VXGBXAGGSA-N 2 0 242.407 2.033 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)CC1(C)CCC1 ZINC000349372468 538117085 /nfs/dbraw/zinc/11/70/85/538117085.db2.gz UXMOXBAUUUZMNW-UHFFFAOYSA-N 2 0 212.381 2.450 20 0 BEADRP C1CNC[C@@H]([NH2+]C2C3CC4CC(C3)CC2C4)C1 ZINC000043326493 188396876 /nfs/dbraw/zinc/39/68/76/188396876.db2.gz JISHDCGEGUZBPX-BPHCLYMKSA-N 2 0 234.387 2.153 20 0 BEADRP c1[nH+]cn2cc(C[NH2+]C[C@H]3CCC=CO3)ccc12 ZINC000297587547 188394530 /nfs/dbraw/zinc/39/45/30/188394530.db2.gz SNRHVLHXBSBEBW-CQSZACIVSA-N 2 0 243.310 2.117 20 0 BEADRP C[NH+](C)[C@@H]1CCC[C@H]([NH2+]C[C@H]2CCSC2)C1 ZINC000336778956 353530113 /nfs/dbraw/zinc/53/01/13/353530113.db2.gz MVFBLAUCWFHLCD-FRRDWIJNSA-N 2 0 242.432 2.202 20 0 BEADRP CC(C)[C@H]1C[N@H+](C[C@@]2(C)CC[NH2+]C2)CCS1 ZINC000261729281 535237141 /nfs/dbraw/zinc/23/71/41/535237141.db2.gz GZBJBWCMIQPTKL-OLZOCXBDSA-N 2 0 242.432 2.059 20 0 BEADRP C1C[NH2+][C@H]([C@@H]2CCC[C@@H]2[NH2+][C@@H]2CCSC2)C1 ZINC000231347361 353595550 /nfs/dbraw/zinc/59/55/50/353595550.db2.gz DILAQRVEAXCFPM-VOAKCMCISA-N 2 0 240.416 2.002 20 0 BEADRP CC[N@@H+](Cc1ccccn1)C[C@H]1CC[NH2+][C@@H](C)C1 ZINC000233528821 353826955 /nfs/dbraw/zinc/82/69/55/353826955.db2.gz BTXUGWRIYUOHEO-KBPBESRZSA-N 2 0 247.386 2.292 20 0 BEADRP Cc1ccc(F)c(C[N@H+]2CC[C@@H]([C@@H](C)[NH3+])C2)c1 ZINC000220340696 353830788 /nfs/dbraw/zinc/83/07/88/353830788.db2.gz MYNLWWMGHNEGSJ-VXGBXAGGSA-N 2 0 236.334 2.303 20 0 BEADRP C[C@@H](c1ccncc1)N(C)C[C@@H]1CCC[NH2+]C1 ZINC000220425171 353836358 /nfs/dbraw/zinc/83/63/58/353836358.db2.gz LUNNIFRTPGFKIL-QWHCGFSZSA-N 2 0 233.359 2.074 20 0 BEADRP C[NH+](C)CCC[N@H+](C)C[C@@H]1CC[C@H]2C[C@H]2C1 ZINC000639167192 354048434 /nfs/dbraw/zinc/04/84/34/354048434.db2.gz BNISTLICHCKKLE-HZSPNIEDSA-N 2 0 224.392 2.306 20 0 BEADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+]C[C@@H]2C[C@H]3C[C@H]3C2)C1 ZINC000639170027 354096934 /nfs/dbraw/zinc/09/69/34/354096934.db2.gz OGBFBLISKRDBMK-XQLPTFJDSA-N 2 0 236.403 2.352 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]C[C@@H]2C[C@H]2C2CC2)[C@@H](C)C1 ZINC000449742831 202018989 /nfs/dbraw/zinc/01/89/89/202018989.db2.gz RMVGRGVCRSRSRX-MXAVVETBSA-N 2 0 236.403 2.352 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)C[C@@H]1C[C@H]2C[C@H]2C1 ZINC000639176717 354201926 /nfs/dbraw/zinc/20/19/26/354201926.db2.gz ZZNVPYDDVGUIDL-BTTYYORXSA-N 2 0 224.392 2.306 20 0 BEADRP C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C[C@@H]2C[C@H]3C[C@H]3C2)C1 ZINC000639178514 354254313 /nfs/dbraw/zinc/25/43/13/354254313.db2.gz LJIOFKFQHNVKFY-IBEHDNSVSA-N 2 0 248.414 2.449 20 0 BEADRP CC1CC([NH2+]CCC2CC[NH+](C)CC2)C1 ZINC000231788117 363353886 /nfs/dbraw/zinc/35/38/86/363353886.db2.gz SAYKWJBHLBPOPR-UHFFFAOYSA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)[C@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)C1CC1 ZINC000578005414 366172780 /nfs/dbraw/zinc/17/27/80/366172780.db2.gz DUYXZDFYDUKSKO-ZNMIVQPWSA-N 2 0 236.403 2.399 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H](C)CCC(F)(F)F ZINC000578062671 366209772 /nfs/dbraw/zinc/20/97/72/366209772.db2.gz KCMVPEIAWDZMOR-SECBINFHSA-N 2 0 226.286 2.307 20 0 BEADRP C[C@H]1CN(C)C[C@H]1[NH2+]C1CCC(C(F)F)CC1 ZINC000334702082 354495267 /nfs/dbraw/zinc/49/52/67/354495267.db2.gz ILAOVNQNCUQJSQ-WNYYMSAVSA-N 2 0 246.345 2.350 20 0 BEADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH+]1CCCC1 ZINC000335132827 354779422 /nfs/dbraw/zinc/77/94/22/354779422.db2.gz AKUHFMINFYUFLV-UHFFFAOYSA-N 2 0 242.326 2.172 20 0 BEADRP COc1cc(C)ccc1C[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000578083164 366231453 /nfs/dbraw/zinc/23/14/53/366231453.db2.gz NMPHJPFFPNPTTR-UONOGXRCSA-N 2 0 248.370 2.363 20 0 BEADRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@H](C)C1(C)CC1 ZINC000166033013 354871602 /nfs/dbraw/zinc/87/16/02/354871602.db2.gz NWQMAKFTGQUJOR-OLZOCXBDSA-N 2 0 242.407 2.121 20 0 BEADRP CC(C)C1CC([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000335173950 354940585 /nfs/dbraw/zinc/94/05/85/354940585.db2.gz LAXLPQKANAPNAJ-HPCMXSDISA-N 2 0 222.376 2.294 20 0 BEADRP CC[C@H](C[NH2+][C@@H](C)[C@@H]1CCCO1)N1CCCC1 ZINC000346468357 354954556 /nfs/dbraw/zinc/95/45/56/354954556.db2.gz AISDELLJPJYLDX-MJBXVCDLSA-N 2 0 240.391 2.018 20 0 BEADRP CC[C@@H]1C[C@H](C[N@H+](C)CC(C)(C)C[NH3+])CCO1 ZINC000346679941 355011019 /nfs/dbraw/zinc/01/10/19/355011019.db2.gz MKZUBORYWRXTRF-CHWSQXEVSA-N 2 0 242.407 2.108 20 0 BEADRP CC[C@@H]1C[C@@H](C[N@H+](C)CC(C)(C)C[NH3+])CCO1 ZINC000346679947 355011025 /nfs/dbraw/zinc/01/10/25/355011025.db2.gz MKZUBORYWRXTRF-QWHCGFSZSA-N 2 0 242.407 2.108 20 0 BEADRP Cc1noc(C)c1CN[C@H]1CCCCC[C@@H]1[NH3+] ZINC000335193018 355025847 /nfs/dbraw/zinc/02/58/47/355025847.db2.gz HMRCPCJNTNPNTI-STQMWFEESA-N 2 0 237.347 2.041 20 0 BEADRP C[C@H]([NH3+])CN1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000335229453 355071846 /nfs/dbraw/zinc/07/18/46/355071846.db2.gz FGOHWTAKSAVABB-JQWIXIFHSA-N 2 0 238.762 2.477 20 0 BEADRP C[C@@H]1C[C@H](C)CC[N@H+](C[C@H]2CCC[NH2+]C2)C1 ZINC000346972749 355208343 /nfs/dbraw/zinc/20/83/43/355208343.db2.gz HXPYBTDNWFWDFX-MCIONIFRSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H]1CCC[C@@H](C)[N@H+](C[C@@H]2CCC[NH2+]C2)C1 ZINC000346965934 355173083 /nfs/dbraw/zinc/17/30/83/355173083.db2.gz CELFRZSTANHTBY-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[N@H+](CC2CC[NH2+]CC2)[C@@H]2CCCC[C@H]21 ZINC000347000581 355198137 /nfs/dbraw/zinc/19/81/37/355198137.db2.gz GMIODMFGYKLEMG-VHDGCEQUSA-N 2 0 236.403 2.497 20 0 BEADRP CCc1cc(NCCCC[N@H+](C)C2CC2)cc[nH+]1 ZINC000413350934 191374179 /nfs/dbraw/zinc/37/41/79/191374179.db2.gz YOEGLJBDXBQPTC-UHFFFAOYSA-N 2 0 247.386 2.352 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc3c[nH+]cn3c2)CS1 ZINC000639257224 355302478 /nfs/dbraw/zinc/30/24/78/355302478.db2.gz RPHUHHZVBHULPW-ZYHUDNBSSA-N 2 0 247.367 2.318 20 0 BEADRP CC[NH+](CC)CCOCC[NH2+][C@H](C)C1CCC1 ZINC000349725610 355420672 /nfs/dbraw/zinc/42/06/72/355420672.db2.gz XRUCBBXNGSSHKE-CYBMUJFWSA-N 2 0 242.407 2.123 20 0 BEADRP C[N@H+]1C[C@@H]2C[NH+](CCC3CCCCC3)C[C@@H]2C1 ZINC000335789388 355440755 /nfs/dbraw/zinc/44/07/55/355440755.db2.gz XNSCOKMBWXPISE-GASCZTMLSA-N 2 0 236.403 2.450 20 0 BEADRP C[C@@H]1CCC[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000414833892 191592163 /nfs/dbraw/zinc/59/21/63/191592163.db2.gz RUFXIJYFRLKPCC-OCIKQUFWSA-N 2 0 208.349 2.048 20 0 BEADRP CC1CCC([NH2+]CC[C@@H]2CC[NH2+]C2)CC1 ZINC000414834241 191593864 /nfs/dbraw/zinc/59/38/64/191593864.db2.gz QMQDYUJEYJKVAB-CPCZMJQVSA-N 2 0 210.365 2.154 20 0 BEADRP CC1CCC([NH2+]CC[C@H]2CC[NH2+]C2)CC1 ZINC000414834243 191594546 /nfs/dbraw/zinc/59/45/46/191594546.db2.gz QMQDYUJEYJKVAB-OTTFEQOBSA-N 2 0 210.365 2.154 20 0 BEADRP c1ccc2c(c1)CC([NH2+]CC[C@@H]1CCC[NH2+]C1)C2 ZINC000414842600 191598259 /nfs/dbraw/zinc/59/82/59/191598259.db2.gz PFDOBEBWBSYSGJ-ZDUSSCGKSA-N 2 0 244.382 2.133 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H]1CCC[C@@H]1C1CC1 ZINC000415015126 191651261 /nfs/dbraw/zinc/65/12/61/191651261.db2.gz AERWFIJDEIFFRX-RAIGVLPGSA-N 2 0 210.365 2.282 20 0 BEADRP Cc1cccc(C[NH2+][C@@H]2C[C@H]2C2CC[NH2+]CC2)c1 ZINC000415015717 191651737 /nfs/dbraw/zinc/65/17/37/191651737.db2.gz ZATGOCOUNNQSCV-JKSUJKDBSA-N 2 0 244.382 2.473 20 0 BEADRP CC(C)n1nccc1C[NH2+][C@@H](C)CCCC[NH3+] ZINC000415017575 191653424 /nfs/dbraw/zinc/65/34/24/191653424.db2.gz SLCAJLTUFUMNRK-LBPRGKRZSA-N 2 0 238.379 2.071 20 0 BEADRP COc1ccc(C)cc1C[NH2+][C@H](C)CCC[NH3+] ZINC000415026169 191656217 /nfs/dbraw/zinc/65/62/17/191656217.db2.gz SSLFPUJOLUWMMT-GFCCVEGCSA-N 2 0 236.359 2.221 20 0 BEADRP CC[NH2+]Cc1cccc(NC[C@]2(C)CC[NH2+]C2)c1 ZINC000414874408 191611102 /nfs/dbraw/zinc/61/11/02/191611102.db2.gz YCXUIFQEEPVAJV-OAHLLOKOSA-N 2 0 247.386 2.208 20 0 BEADRP C[C@@H](C[NH2+]C[C@@H](C)C[NH3+])c1ccc(F)cc1 ZINC000414877738 191612622 /nfs/dbraw/zinc/61/26/22/191612622.db2.gz NEHZRLSKBPIVTB-QWRGUYRKSA-N 2 0 224.323 2.114 20 0 BEADRP Cc1cc(C[NH2+][C@H]2CC[C@@H](C[NH3+])C2)ccc1F ZINC000415027014 191656770 /nfs/dbraw/zinc/65/67/70/191656770.db2.gz APEMPNHTHVSNKN-YPMHNXCESA-N 2 0 236.334 2.351 20 0 BEADRP Cc1ncccc1C[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000414963110 191633861 /nfs/dbraw/zinc/63/38/61/191633861.db2.gz CPICVALAQSYAHA-AWEZNQCLSA-N 2 0 233.359 2.012 20 0 BEADRP C(C[NH2+][C@H]1CCCSC1)C[C@@H]1CCC[NH2+]1 ZINC000414982083 191640372 /nfs/dbraw/zinc/64/03/72/191640372.db2.gz YIIPNNFSKMPHQH-RYUDHWBXSA-N 2 0 228.405 2.004 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CC[C@@H](C[NH3+])C2)s1 ZINC000415036872 191658801 /nfs/dbraw/zinc/65/88/01/191658801.db2.gz LSWIXHMMCRQWET-GHMZBOCLSA-N 2 0 224.373 2.274 20 0 BEADRP CC1(C)CCC[C@@H]1[NH2+][C@H]1CC[C@@H](C[NH3+])C1 ZINC000415042827 191661363 /nfs/dbraw/zinc/66/13/63/191661363.db2.gz RGPCBEMXCBLHED-WOPDTQHZSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(F)cc2)C1 ZINC000415047826 191662151 /nfs/dbraw/zinc/66/21/51/191662151.db2.gz WFVCOSABCSHRQY-DGCLKSJQSA-N 2 0 222.307 2.043 20 0 BEADRP CC(C)[C@H]1C[N@H+](C[C@@H]2CCC[NH2+]C2)CCS1 ZINC000335837719 355566637 /nfs/dbraw/zinc/56/66/37/355566637.db2.gz NYCBVLMCRPBMAQ-CHWSQXEVSA-N 2 0 242.432 2.059 20 0 BEADRP Cc1ccc(F)cc1C[NH2+][C@H]1CC[C@@H](C[NH3+])C1 ZINC000415046835 191662587 /nfs/dbraw/zinc/66/25/87/191662587.db2.gz VJGGMDDBGBTBLE-RISCZKNCSA-N 2 0 236.334 2.351 20 0 BEADRP CC1(C[NH2+]C2CCC(C[NH3+])CC2)CCC1 ZINC000415086434 191673814 /nfs/dbraw/zinc/67/38/14/191673814.db2.gz SEZVGGMDRISEOI-UHFFFAOYSA-N 2 0 210.365 2.284 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCN1C(C)(C)C)[C@H]1CC1(F)F ZINC000639302789 355650160 /nfs/dbraw/zinc/65/01/60/355650160.db2.gz ITPPYNBYSDEHCR-GARJFASQSA-N 2 0 246.345 2.493 20 0 BEADRP Cc1cc(C[N@H+]2C[C@H](C[NH3+])C[C@@H]2C)ccc1F ZINC000215959925 355620196 /nfs/dbraw/zinc/62/01/96/355620196.db2.gz VVVJAAIQBYLOBH-AAEUAGOBSA-N 2 0 236.334 2.303 20 0 BEADRP CCCN1CCC[C@@H]1C[NH2+][C@@H](C)CCCOC ZINC000353986614 355748021 /nfs/dbraw/zinc/74/80/21/355748021.db2.gz JZTGXDZHBUIQAE-UONOGXRCSA-N 2 0 242.407 2.266 20 0 BEADRP Cc1cccc(C[N@H+]2C[C@@H](C[NH3+])C[C@@H]2C)c1C ZINC000216010477 355795915 /nfs/dbraw/zinc/79/59/15/355795915.db2.gz USOJHFQEAMHYFS-GXTWGEPZSA-N 2 0 232.371 2.473 20 0 BEADRP C[C@H](C[N@@H+]1C[C@@H](C[NH3+])C[C@@H]1C)c1ccccc1 ZINC000216056242 355804507 /nfs/dbraw/zinc/80/45/07/355804507.db2.gz VKIQLAPYQKBGDH-HZSPNIEDSA-N 2 0 232.371 2.459 20 0 BEADRP Cc1cccc2c1CC[C@H]2[NH2+][C@H](C)C1C[NH2+]C1 ZINC000583625047 355894112 /nfs/dbraw/zinc/89/41/12/355894112.db2.gz AHPUFHWMKFOAFA-IAQYHMDHSA-N 2 0 230.355 2.180 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+]CC2(C)CC2)C1 ZINC000309063706 355988994 /nfs/dbraw/zinc/98/89/94/355988994.db2.gz YEFRHUOXKZKEBR-GFCCVEGCSA-N 2 0 210.365 2.108 20 0 BEADRP Cc1ccc(CC[N@@H+]2C[C@@H]3CC[C@H]([NH3+])[C@@H]3C2)cc1 ZINC000351495960 356002738 /nfs/dbraw/zinc/00/27/38/356002738.db2.gz QISUVHKFVRAMGI-XHSDSOJGSA-N 2 0 244.382 2.207 20 0 BEADRP C[C@H](F)CC[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C)C1 ZINC000351882137 356119869 /nfs/dbraw/zinc/11/98/69/356119869.db2.gz PAWWWSODHUGBPX-YNEHKIRRSA-N 2 0 228.355 2.151 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@@H]2CSC[C@@H]2C)CC1 ZINC000304485096 192016192 /nfs/dbraw/zinc/01/61/92/192016192.db2.gz LTTRBGPCBJSDKB-WCQYABFASA-N 2 0 242.432 2.200 20 0 BEADRP Cc1cccnc1[C@@H]([NH2+]CCC[NH3+])C(C)C ZINC000420319578 192194877 /nfs/dbraw/zinc/19/48/77/192194877.db2.gz PHPKWSODAVYJMJ-LBPRGKRZSA-N 2 0 221.348 2.026 20 0 BEADRP CC[N@H+](CCOCC(C)C)[C@@H]1CCC[NH2+]CC1 ZINC000420319552 192195114 /nfs/dbraw/zinc/19/51/14/192195114.db2.gz XRXUTRAEALSINY-CQSZACIVSA-N 2 0 242.407 2.123 20 0 BEADRP CCc1cccc(C[N@@H+]2CC[C@@H](C[NH3+])C2)c1 ZINC000420298744 192204175 /nfs/dbraw/zinc/20/41/75/192204175.db2.gz SMZFYNVKNNNXND-AWEZNQCLSA-N 2 0 218.344 2.030 20 0 BEADRP CCCC[N@H+](CCOC)CC[C@@H]1CCC[NH2+]C1 ZINC000420298175 192204703 /nfs/dbraw/zinc/20/47/03/192204703.db2.gz GYDTYAUQUFRVCB-AWEZNQCLSA-N 2 0 242.407 2.125 20 0 BEADRP CCc1cccc(C[NH2+][C@@](C)(C[NH3+])C2CC2)c1 ZINC000420297027 192205351 /nfs/dbraw/zinc/20/53/51/192205351.db2.gz YCPXQMFAIYAYSZ-HNNXBMFYSA-N 2 0 232.371 2.466 20 0 BEADRP C[C@@H]1C[N@H+](CCCc2ccsc2)CC[C@@H]1[NH3+] ZINC000420296022 192205800 /nfs/dbraw/zinc/20/58/00/192205800.db2.gz WLBHZYFXJWROCO-YPMHNXCESA-N 2 0 238.400 2.350 20 0 BEADRP C[C@H]([NH3+])C1CC[NH+](CC[C@H]2CCCCO2)CC1 ZINC000420281923 192199860 /nfs/dbraw/zinc/19/98/60/192199860.db2.gz ATUNEAKVPDPYFF-GXTWGEPZSA-N 2 0 240.391 2.005 20 0 BEADRP CC(C)[C@@H]([NH3+])CC[N@H+](C)CC[C@@H]1CCCCO1 ZINC000420289679 192201085 /nfs/dbraw/zinc/20/10/85/192201085.db2.gz KSOJGSFBBMKUJV-KBPBESRZSA-N 2 0 242.407 2.251 20 0 BEADRP Cc1ccc(CN2CCC[C@@H](C)[C@H]2C[NH3+])c(C)n1 ZINC000420289979 192201832 /nfs/dbraw/zinc/20/18/32/192201832.db2.gz LAHJBDOTOJACKL-IAQYHMDHSA-N 2 0 247.386 2.258 20 0 BEADRP CCc1cccc(C[N@@H+]2CC[C@H]3[NH2+]CC[C@H]3C2)c1 ZINC000420313980 192213374 /nfs/dbraw/zinc/21/33/74/192213374.db2.gz KODAWDBFNKVBBB-JKSUJKDBSA-N 2 0 244.382 2.433 20 0 BEADRP C[C@@H]1CCCC[C@H]1OCC[N@H+](C)C1CC([NH3+])C1 ZINC000420331888 192213848 /nfs/dbraw/zinc/21/38/48/192213848.db2.gz MSHPCCSPRHOZGO-BLYZHGLHSA-N 2 0 240.391 2.003 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCC[C@H](Nc2ccccc2)C1 ZINC000420355337 192218894 /nfs/dbraw/zinc/21/88/94/192218894.db2.gz FHRCLQPXIFXNBH-HNNXBMFYSA-N 2 0 247.386 2.172 20 0 BEADRP C[NH+](C)CCCC(C)(C)[NH2+]Cc1ccco1 ZINC000395645372 356359382 /nfs/dbraw/zinc/35/93/82/356359382.db2.gz NDMGZAWIUFUAQA-UHFFFAOYSA-N 2 0 224.348 2.490 20 0 BEADRP COc1ccccc1CCC[NH2+]CC1([NH3+])CCC1 ZINC000420312124 192210260 /nfs/dbraw/zinc/21/02/60/192210260.db2.gz RQBLPJHOLAFYAQ-UHFFFAOYSA-N 2 0 248.370 2.099 20 0 BEADRP CC(C)[N@H+](CC[C@@H]1CC[NH2+]C1)C1CCC1 ZINC000420310444 192210563 /nfs/dbraw/zinc/21/05/63/192210563.db2.gz UYYYLTWSVSWCMS-LBPRGKRZSA-N 2 0 210.365 2.249 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@H](CC[NH3+])C2)c(C)n1 ZINC000420314245 192212206 /nfs/dbraw/zinc/21/22/06/192212206.db2.gz QKPFAOIPDDRRJR-CQSZACIVSA-N 2 0 247.386 2.259 20 0 BEADRP C[N@H+](CCCC1CCCC1)C1CC([NH3+])C1 ZINC000420323982 192227867 /nfs/dbraw/zinc/22/78/67/192227867.db2.gz BVONTCIPPKGKHR-UHFFFAOYSA-N 2 0 210.365 2.378 20 0 BEADRP C[C@@H]1C[C@@H](C[NH3+])C[N@@H+]1CCCCC(F)(F)F ZINC000420326099 192228811 /nfs/dbraw/zinc/22/88/11/192228811.db2.gz XAWZREKVUNHOHL-ZJUUUORDSA-N 2 0 238.297 2.388 20 0 BEADRP Cc1cc([C@H]2CCC[N@@H+]2CC[C@@H]2CC[NH2+]C2)on1 ZINC000420326823 192228873 /nfs/dbraw/zinc/22/88/73/192228873.db2.gz XVHBZAZAYFFEOZ-QWHCGFSZSA-N 2 0 249.358 2.120 20 0 BEADRP C[C@@H]1OCC[C@H]1C[N@@H+]1CCC[C@H](c2ncc[nH]2)C1 ZINC000639532157 356381683 /nfs/dbraw/zinc/38/16/83/356381683.db2.gz BIMFKAYCJCBTOX-AVGNSLFASA-N 2 0 249.358 2.014 20 0 BEADRP CCC(C)(C)[C@@H]1CCC[N@@H+]1CCC[NH2+]C ZINC000420363130 192223213 /nfs/dbraw/zinc/22/32/13/192223213.db2.gz BEVLNIVDFSKRQH-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP CC[C@H](C)[NH+]1CCC([C@@H]2C[C@@H]([NH3+])CCO2)CC1 ZINC000420389463 192234646 /nfs/dbraw/zinc/23/46/46/192234646.db2.gz MCQKOGSXPHOJJT-UBHSHLNASA-N 2 0 240.391 2.003 20 0 BEADRP CC[C@@H](C)N1C[C@@H](c2ccccc2F)[C@H]([NH3+])C1 ZINC000420392618 192237579 /nfs/dbraw/zinc/23/75/79/192237579.db2.gz WDESQPRNOYGZEE-SCDSUCTJSA-N 2 0 236.334 2.351 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000420403567 192238418 /nfs/dbraw/zinc/23/84/18/192238418.db2.gz LDXNZPQPCIIMHZ-UPJWGTAASA-N 2 0 210.365 2.154 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000420403569 192238636 /nfs/dbraw/zinc/23/86/36/192238636.db2.gz LDXNZPQPCIIMHZ-XQQFMLRXSA-N 2 0 210.365 2.154 20 0 BEADRP CCCC[NH+]1CCC([C@@H]2OCCC[C@@H]2[NH3+])CC1 ZINC000420374619 192231913 /nfs/dbraw/zinc/23/19/13/192231913.db2.gz HPWYUXWLPGTTHA-KBPBESRZSA-N 2 0 240.391 2.005 20 0 BEADRP CC[C@H](C)[NH+]1CCC([C@H]2OCCC[C@H]2[NH3+])CC1 ZINC000420379795 192233178 /nfs/dbraw/zinc/23/31/78/192233178.db2.gz NPIBVYCVEVXRKC-IACUBPJLSA-N 2 0 240.391 2.003 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)c1cccnc1 ZINC000420379293 192233635 /nfs/dbraw/zinc/23/36/35/192233635.db2.gz VAKWARVCVAYKRB-OLZOCXBDSA-N 2 0 233.359 2.122 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CCc2ccccc21)[C@H]1CCC[NH2+]1 ZINC000422909020 192502499 /nfs/dbraw/zinc/50/24/99/192502499.db2.gz NITNSTQYKYTYMU-XNRPHZJLSA-N 2 0 244.382 2.447 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@H](C)C[C@@H]1CCCO1 ZINC000422899727 192513154 /nfs/dbraw/zinc/51/31/54/192513154.db2.gz IDURCOONUSERTA-UPJWGTAASA-N 2 0 228.380 2.051 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]C[C@@H]1[C@@H]2Cc3ccccc3[C@H]12 ZINC000422992867 192520774 /nfs/dbraw/zinc/52/07/74/192520774.db2.gz RVAXOEOZMRQXMD-QYPKEOEOSA-N 2 0 244.382 2.288 20 0 BEADRP C[C@@H]1C[C@H]1C[N@@H+]1CCCN(c2cc[nH+]cc2)CC1 ZINC000639685931 356601676 /nfs/dbraw/zinc/60/16/76/356601676.db2.gz ZEQBKHTXIBPSGD-KGLIPLIRSA-N 2 0 245.370 2.250 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@@H]2CCC[C@@H]2[NH3+])C[C@@H]1C ZINC000423033769 192546168 /nfs/dbraw/zinc/54/61/68/192546168.db2.gz GVVMRKSATKDHTQ-QNWJLWSRSA-N 2 0 210.365 2.281 20 0 BEADRP CC[C@@H](CC(F)(F)F)[NH2+][C@H](C)CCC[NH3+] ZINC000423035396 192546171 /nfs/dbraw/zinc/54/61/71/192546171.db2.gz JHZWKDZEGOXULS-BDAKNGLRSA-N 2 0 226.286 2.434 20 0 BEADRP C[C@@H]([NH2+]C1CCC(C[NH3+])CC1)[C@H]1CCCCO1 ZINC000423041002 192549551 /nfs/dbraw/zinc/54/95/51/192549551.db2.gz IHVSVMMKNFOHCG-BLYZHGLHSA-N 2 0 240.391 2.051 20 0 BEADRP CCOC1CC(CC[NH2+][C@@H](C)CCCC[NH3+])C1 ZINC000423072182 192559728 /nfs/dbraw/zinc/55/97/28/192559728.db2.gz PHKUDQARBIWUNE-HSBZDZAISA-N 2 0 242.407 2.299 20 0 BEADRP CCCC[N@H+](C)CCNc1cc[nH+]c(CC)c1 ZINC000450333018 202128631 /nfs/dbraw/zinc/12/86/31/202128631.db2.gz WBPDELGQFIEXOT-UHFFFAOYSA-N 2 0 235.375 2.210 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCc2ccc(F)cc21)C1C[NH2+]C1 ZINC000582235571 356651882 /nfs/dbraw/zinc/65/18/82/356651882.db2.gz FGOSZUYCMDHRCO-YMTOWFKASA-N 2 0 234.318 2.011 20 0 BEADRP C[C@H]([NH2+][C@H]1CCc2ccc(F)cc21)C1C[NH2+]C1 ZINC000582235570 356652208 /nfs/dbraw/zinc/65/22/08/356652208.db2.gz FGOSZUYCMDHRCO-XPTSAGLGSA-N 2 0 234.318 2.011 20 0 BEADRP C[C@@H]1C[C@H]1C[N@@H+]1CCC2(C1)CC[NH+](C)CC2 ZINC000639757068 356664060 /nfs/dbraw/zinc/66/40/60/356664060.db2.gz FANOKISXSYABJS-OLZOCXBDSA-N 2 0 222.376 2.060 20 0 BEADRP C[NH+]1CCC2(CC[N@H+](CCCCF)C2)CC1 ZINC000639755780 356659021 /nfs/dbraw/zinc/65/90/21/356659021.db2.gz MUIGGFBNTIDSJE-UHFFFAOYSA-N 2 0 228.355 2.154 20 0 BEADRP FC1(F)CC[C@H](C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000423096409 192565856 /nfs/dbraw/zinc/56/58/56/192565856.db2.gz OUNKAVMQADGMRH-WSMDXJOWSA-N 2 0 244.329 2.294 20 0 BEADRP CCc1cc(N[C@@H](C)C(C)(C)C[NH+](C)C)cc[nH+]1 ZINC000450351560 202140810 /nfs/dbraw/zinc/14/08/10/202140810.db2.gz VLJSRUADHYIUHP-LBPRGKRZSA-N 2 0 249.402 2.454 20 0 BEADRP CC[C@H]1CC[C@H]([NH2+][C@H]2CCC[C@H]2[NH3+])CC1 ZINC000423137676 192583136 /nfs/dbraw/zinc/58/31/36/192583136.db2.gz WTXPNXIDXJDJRV-LPWJVIDDSA-N 2 0 210.365 2.425 20 0 BEADRP CC(C)C[N@@H+]1CCC2(C1)CC[NH+](C)CC2 ZINC000639758025 356667226 /nfs/dbraw/zinc/66/72/26/356667226.db2.gz OMOZDCLFCPHWHZ-UHFFFAOYSA-N 2 0 210.365 2.060 20 0 BEADRP CCc1cc(N[C@H]2C[C@H](C)[N@@H+](C3CC3)C2)cc[nH+]1 ZINC000450373551 202144721 /nfs/dbraw/zinc/14/47/21/202144721.db2.gz CSHDLHDSVVURMK-FZMZJTMJSA-N 2 0 245.370 2.103 20 0 BEADRP C[NH+](C)C[C@@H]1CC[N@H+](C[C@@H]2CCC(F)(F)C2)C1 ZINC000450408139 202156226 /nfs/dbraw/zinc/15/62/26/202156226.db2.gz VFBVJJBRAKYHHP-NEPJUHHUSA-N 2 0 246.345 2.305 20 0 BEADRP C(C[NH+]1CCCCC1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000086573161 538557334 /nfs/dbraw/zinc/55/73/34/538557334.db2.gz AWSLDFGXCGAQGF-AGUYFDCRSA-N 2 0 222.376 2.393 20 0 BEADRP CCC[NH+](C)[C@@H](C)CC[N@@H+](C)CCC ZINC000153331453 538568478 /nfs/dbraw/zinc/56/84/78/538568478.db2.gz CLEUYPOQRBDAEB-LBPRGKRZSA-N 2 0 200.370 2.449 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1)C1CC1 ZINC000623341413 356741976 /nfs/dbraw/zinc/74/19/76/356741976.db2.gz AVRJWNSLIMUOCG-ZYHUDNBSSA-N 2 0 210.365 2.247 20 0 BEADRP CC(C)OCCC[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623338225 356732835 /nfs/dbraw/zinc/73/28/35/356732835.db2.gz QNRWQNFOCNROSI-ZDUSSCGKSA-N 2 0 242.407 2.264 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H]1CC[C@H](C)[C@@H](C)C1 ZINC000578185297 366367767 /nfs/dbraw/zinc/36/77/67/366367767.db2.gz YCPYTFOHHZHZDG-RWMBFGLXSA-N 2 0 212.381 2.400 20 0 BEADRP CCOCCCC[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623362609 356812557 /nfs/dbraw/zinc/81/25/57/356812557.db2.gz BCBAZDSTCIFUJC-CYBMUJFWSA-N 2 0 242.407 2.266 20 0 BEADRP CCc1cc(N2CC[N@H+](C)[C@@H](C(C)C)C2)cc[nH+]1 ZINC000450479462 202180182 /nfs/dbraw/zinc/18/01/82/202180182.db2.gz OIKIJCXSPODXET-OAHLLOKOSA-N 2 0 247.386 2.420 20 0 BEADRP C[C@H]([NH2+]CCC1CC(F)(F)C1)[C@@H]1CCC[NH2+]1 ZINC000423167609 192604648 /nfs/dbraw/zinc/60/46/48/192604648.db2.gz SPRRMTUAEJWCEH-ONGXEEELSA-N 2 0 232.318 2.152 20 0 BEADRP COCCCCC[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623385283 356911270 /nfs/dbraw/zinc/91/12/70/356911270.db2.gz AJQFGDQIWKFENM-ZDUSSCGKSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@@H](NC1CC[NH+](C2CCC2)CC1)c1ncc[nH]1 ZINC000353499245 538745846 /nfs/dbraw/zinc/74/58/46/538745846.db2.gz CNZQSXOJFJGKPY-LLVKDONJSA-N 2 0 248.374 2.077 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C[C@@H]2CCCCO2)CC1(C)C ZINC000623377441 356896609 /nfs/dbraw/zinc/89/66/09/356896609.db2.gz ZAARRMJNQDBTMJ-STQMWFEESA-N 2 0 240.391 2.018 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H](C)c1sccc1C ZINC000423198967 192623044 /nfs/dbraw/zinc/62/30/44/192623044.db2.gz IWBHFLZLSKRWEQ-JTQLQIEISA-N 2 0 212.362 2.317 20 0 BEADRP CCC(C)(C)CC[N@@H+]1CC[C@@H]([C@H](C)[NH3+])C1 ZINC000261550460 535351044 /nfs/dbraw/zinc/35/10/44/535351044.db2.gz PLYFTMNKMOBEGE-NWDGAFQWSA-N 2 0 212.381 2.482 20 0 BEADRP FCCC[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000423204735 192625898 /nfs/dbraw/zinc/62/58/98/192625898.db2.gz DQAUTQNQFMKAAC-IHRRRGAJSA-N 2 0 242.382 2.494 20 0 BEADRP CC[NH+](CC)CCSCC[NH+](CC)CC ZINC000001584361 356953331 /nfs/dbraw/zinc/95/33/31/356953331.db2.gz LYFNBXZVKYDWNX-UHFFFAOYSA-N 2 0 232.437 2.403 20 0 BEADRP C[C@H](C[NH2+]C1CCC(C)CC1)C[NH+](C)C ZINC000389641877 357008139 /nfs/dbraw/zinc/00/81/39/357008139.db2.gz QVXWOAZULLXRDX-OTTFEQOBSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H]([NH2+]C1CCC([NH3+])CC1)c1cccc(CO)c1 ZINC000423217854 192631975 /nfs/dbraw/zinc/63/19/75/192631975.db2.gz QSFNMAVKNDPEFV-VCANKDNSSA-N 2 0 248.370 2.099 20 0 BEADRP CCC[C@@H](C)C[NH2+]CCN1CC[C@H](C)C1 ZINC000389904832 357064855 /nfs/dbraw/zinc/06/48/55/357064855.db2.gz GFIMNPBGDKSXFU-OLZOCXBDSA-N 2 0 212.381 2.354 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C2CCSCC2)CC1(C)C ZINC000623404903 357140216 /nfs/dbraw/zinc/14/02/16/357140216.db2.gz PRUYWRNYGDFPPR-LBPRGKRZSA-N 2 0 242.432 2.344 20 0 BEADRP CC(C)(C)[C@@H]1CC[C@@H]1[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000423249692 192651838 /nfs/dbraw/zinc/65/18/38/192651838.db2.gz PKWHXURPXJHPMG-UPJWGTAASA-N 2 0 224.392 2.400 20 0 BEADRP Fc1ccc2c(c1)CC[C@@H]2[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000423249258 192652369 /nfs/dbraw/zinc/65/23/69/192652369.db2.gz OITSFVJRALOYFC-ABAIWWIYSA-N 2 0 248.345 2.402 20 0 BEADRP CC[C@@H]1CCC[C@H]1[NH2+]CCC1=CC[NH2+]CC1 ZINC000583687704 357120232 /nfs/dbraw/zinc/12/02/32/357120232.db2.gz JMYZXYQJGVFSOP-ZIAGYGMSSA-N 2 0 222.376 2.465 20 0 BEADRP C(C[C@@H]1CCC[NH2+]C1)[NH2+][C@H]1CC[C@@H]1C1CC1 ZINC000423268349 192661487 /nfs/dbraw/zinc/66/14/87/192661487.db2.gz GCCRSVQQIOKGCK-YUTCNCBUSA-N 2 0 222.376 2.154 20 0 BEADRP CC[C@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)[C@@H]1C[C@H]1C ZINC000423284339 192676927 /nfs/dbraw/zinc/67/69/27/192676927.db2.gz YDGAFRZSNCBTJU-RQJABVFESA-N 2 0 224.392 2.400 20 0 BEADRP CCC1(CC)[C@H]([NH2+]C[C@H]([NH3+])C(C)C)C[C@@H]1OC ZINC000423277651 192670031 /nfs/dbraw/zinc/67/00/31/192670031.db2.gz PPUPOWQEZQOPNN-XQQFMLRXSA-N 2 0 242.407 2.153 20 0 BEADRP C[N@@H+]1CCCC[C@@H](C[NH2+]Cc2ccc(O)cc2)C1 ZINC000628425750 357253444 /nfs/dbraw/zinc/25/34/44/357253444.db2.gz UKPSBFRIJFSKGT-AWEZNQCLSA-N 2 0 248.370 2.214 20 0 BEADRP C[C@@H]1CSC[C@@H]1[NH2+]C[C@@H]1CCCC[N@H+](C)C1 ZINC000628425915 357254553 /nfs/dbraw/zinc/25/45/53/357254553.db2.gz ZCZQTAQWMOVJPQ-AGIUHOORSA-N 2 0 242.432 2.059 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H](C)c1ccc(F)c(F)c1 ZINC000423277612 192670714 /nfs/dbraw/zinc/67/07/14/192670714.db2.gz QCMZHGZEQSYTOW-VHSXEESVSA-N 2 0 242.313 2.471 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@@H](C)O[C@@H](C)C1)[C@H]1CCCC[NH2+]1 ZINC000582480738 357316548 /nfs/dbraw/zinc/31/65/48/357316548.db2.gz SPPVTESGEFCQHW-ZUWCUPBKSA-N 2 0 240.391 2.063 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000423285368 192678382 /nfs/dbraw/zinc/67/83/82/192678382.db2.gz ZLMSDOPXOHPATC-MELADBBJSA-N 2 0 224.392 2.400 20 0 BEADRP CC1(C)CCC[C@@H](C[N@H+]2C[C@H]3C[NH2+]C[C@H]3C2)C1 ZINC000582606258 357349295 /nfs/dbraw/zinc/34/92/95/357349295.db2.gz LSFGOOQRUQKHMI-MCIONIFRSA-N 2 0 236.403 2.354 20 0 BEADRP C[C@@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)[C@@H]1CCOC1 ZINC000423292777 192682182 /nfs/dbraw/zinc/68/21/82/192682182.db2.gz OJOAYWXUFSZLET-YWPYICTPSA-N 2 0 248.370 2.221 20 0 BEADRP Cc1cnccc1C[N@@H+]1CCCC[C@@H]1CC[NH3+] ZINC000395370588 357434503 /nfs/dbraw/zinc/43/45/03/357434503.db2.gz NEMXQKUTPCFWBQ-CQSZACIVSA-N 2 0 233.359 2.093 20 0 BEADRP CC(C)CSCC[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000397364323 357513510 /nfs/dbraw/zinc/51/35/10/357513510.db2.gz YOBOWTSRLPYYAW-RYUDHWBXSA-N 2 0 230.421 2.235 20 0 BEADRP Cc1cnccc1C[N@@H+]1C[C@H](C[NH3+])[C@H](C)C[C@@H]1C ZINC000397487378 357515751 /nfs/dbraw/zinc/51/57/51/357515751.db2.gz WHIJTFVAPMHXQS-ZLDLUXBVSA-N 2 0 247.386 2.195 20 0 BEADRP CC[C@@H](C)C[NH+]1CCC([C@H]2CCC[NH2+]2)CC1 ZINC000063197479 357593195 /nfs/dbraw/zinc/59/31/95/357593195.db2.gz FCZPLLBWCNOFFE-TZMCWYRMSA-N 2 0 224.392 2.497 20 0 BEADRP CCOC(C)(C)C[NH2+][C@H](C)C1CC[NH+](C)CC1 ZINC000159178189 538874978 /nfs/dbraw/zinc/87/49/78/538874978.db2.gz YCFFJIIYKLIPTE-GFCCVEGCSA-N 2 0 242.407 2.121 20 0 BEADRP CC[NH+](CC)CCC[NH+]1C[C@@H]2CCC[C@H]2C1 ZINC000191545790 357784165 /nfs/dbraw/zinc/78/41/65/357784165.db2.gz GGCUZXIREOCWQQ-KBPBESRZSA-N 2 0 224.392 2.450 20 0 BEADRP CSC1(C[NH2+]CCC[NH+]2CCCC2)CCC1 ZINC000235228372 357858056 /nfs/dbraw/zinc/85/80/56/357858056.db2.gz BUZWEXMBIUOBRZ-UHFFFAOYSA-N 2 0 242.432 2.348 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+][C@@H]1CCCCC1(C)C ZINC000234806098 357830763 /nfs/dbraw/zinc/83/07/63/357830763.db2.gz AGOPRHCJHJJYRG-QWHCGFSZSA-N 2 0 242.407 2.299 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+][C@@H](C)c1ccccc1 ZINC000234803342 357831325 /nfs/dbraw/zinc/83/13/25/357831325.db2.gz GKSCJGJMMBHNJM-JSGCOSHPSA-N 2 0 236.359 2.091 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+][C@@H]1CCc2ccccc21 ZINC000234746103 357834266 /nfs/dbraw/zinc/83/42/66/357834266.db2.gz NTEKBXWYHYLCMO-UKRRQHHQSA-N 2 0 248.370 2.017 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+]C[C@@H]2CC2(C)C)CC1(C)C ZINC000623417043 357869130 /nfs/dbraw/zinc/86/91/30/357869130.db2.gz QKKMFYJFBRKAKS-NWDGAFQWSA-N 2 0 224.392 2.495 20 0 BEADRP CC(C)[NH2+]CCC[NH2+][C@@H]1CC[C@@H]1C(C)C ZINC000583316290 357898733 /nfs/dbraw/zinc/89/87/33/357898733.db2.gz FOGQWMHTUOMUTO-CHWSQXEVSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CC[N@H+](C/C=C\c2ccccc2)C1 ZINC000382678824 357923135 /nfs/dbraw/zinc/92/31/35/357923135.db2.gz HPRVDICNGHPYNR-SYFOGONKSA-N 2 0 230.355 2.369 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]C[C@@H]2C[C@H]2C2CCC2)C1 ZINC000584479862 357996603 /nfs/dbraw/zinc/99/66/03/357996603.db2.gz KAGOQDYEWBIYRC-DGAVXFQQSA-N 2 0 222.376 2.282 20 0 BEADRP C(C[N@H+](C1CC1)C1CCCC1)[C@@H]1CC[NH2+]C1 ZINC000584520221 358030256 /nfs/dbraw/zinc/03/02/56/358030256.db2.gz KDMRYOKDEVQDLF-LBPRGKRZSA-N 2 0 222.376 2.393 20 0 BEADRP Cc1cc(CN2CCC[C@H]2C[NH3+])ccc1F ZINC000168797346 134247582 /nfs/dbraw/zinc/24/75/82/134247582.db2.gz CDJZQKMRQRUBLQ-LBPRGKRZSA-N 2 0 222.307 2.057 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CCC[NH2+]CC2)cc1 ZINC000168705972 134246441 /nfs/dbraw/zinc/24/64/41/134246441.db2.gz YGWSMDJAUFOYJS-AWEZNQCLSA-N 2 0 218.344 2.227 20 0 BEADRP C[C@H]([NH2+]CC1(C)CC[NH+](C)CC1)[C@H]1C[C@H]1C ZINC000321621600 259476743 /nfs/dbraw/zinc/47/67/43/259476743.db2.gz SEEWARAHKMMGKF-AGIUHOORSA-N 2 0 224.392 2.352 20 0 BEADRP [NH3+]Cc1cccc(OCCC[NH+]2CCCCC2)c1 ZINC000037049942 358065121 /nfs/dbraw/zinc/06/51/21/358065121.db2.gz FJLKLYXIWUXJIZ-UHFFFAOYSA-N 2 0 248.370 2.400 20 0 BEADRP CC1(C)C(C[NH2+][C@H]2CCC[NH2+]CC2)C1(C)C ZINC000168768961 134248066 /nfs/dbraw/zinc/24/80/66/134248066.db2.gz QHEASJYWGFUMKE-NSHDSACASA-N 2 0 224.392 2.400 20 0 BEADRP CS[C@H](C)C[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000090726321 363597510 /nfs/dbraw/zinc/59/75/10/363597510.db2.gz SGNCVLZVJYFPNS-MNOVXSKESA-N 2 0 230.421 2.058 20 0 BEADRP CC(C)C[C@@H]1C[C@H]1[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000583882365 358117354 /nfs/dbraw/zinc/11/73/54/358117354.db2.gz DLJQDDXYFLUMFU-MROQNXINSA-N 2 0 210.365 2.281 20 0 BEADRP CCc1ccc(C[NH2+]CC[C@H]2CC[NH2+]C2)s1 ZINC000225370930 358240506 /nfs/dbraw/zinc/24/05/06/358240506.db2.gz XTNOKFWEEBXPBO-LLVKDONJSA-N 2 0 238.400 2.400 20 0 BEADRP CC(C)C[C@H]([NH3+])C[NH2+][C@@H]1CCc2cc(N)ccc21 ZINC000578206654 366390502 /nfs/dbraw/zinc/39/05/02/366390502.db2.gz ZWOFAOMDHGHHLS-DZGCQCFKSA-N 2 0 247.386 2.219 20 0 BEADRP CC[NH+]1CCC(C[NH2+]Cc2ccco2)CC1 ZINC000044517398 358388997 /nfs/dbraw/zinc/38/89/97/358388997.db2.gz LCPIVPAPMAIDBJ-UHFFFAOYSA-N 2 0 222.332 2.101 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)C(C)C ZINC000044533300 358389866 /nfs/dbraw/zinc/38/98/66/358389866.db2.gz TWUMGMMGQQATDM-STQMWFEESA-N 2 0 212.381 2.352 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+]C[C@H]2CC=CCC2)C1 ZINC000044534328 358390149 /nfs/dbraw/zinc/39/01/49/358390149.db2.gz XXCWCGMKENUIFH-UONOGXRCSA-N 2 0 222.376 2.274 20 0 BEADRP CCN1CCC[C@@H]([NH2+]C2CCC(OC)CC2)C1 ZINC000130028445 358605481 /nfs/dbraw/zinc/60/54/81/358605481.db2.gz KJLPXEGTZUUSLN-ROKHWSDSSA-N 2 0 240.391 2.018 20 0 BEADRP C1CC1C([NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)C1CC1 ZINC000130152874 358610637 /nfs/dbraw/zinc/61/06/37/358610637.db2.gz WPRNTUTZTOAJER-KGLIPLIRSA-N 2 0 234.387 2.391 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)CC2CCC2)C1 ZINC000132427041 491136000 /nfs/dbraw/zinc/13/60/00/491136000.db2.gz CAFGXXFNXDRBOX-JSGCOSHPSA-N 2 0 224.392 2.497 20 0 BEADRP CCc1ccc(C[NH2+]CC2CC[NH+](C)CC2)o1 ZINC000051724948 358760742 /nfs/dbraw/zinc/76/07/42/358760742.db2.gz XJGVNBBVWVHLTL-UHFFFAOYSA-N 2 0 236.359 2.273 20 0 BEADRP CC[C@H](COC)[NH2+][C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000132126903 358708516 /nfs/dbraw/zinc/70/85/16/358708516.db2.gz IWTSGAQXHPDFOA-SWHYSGLUSA-N 2 0 234.343 2.146 20 0 BEADRP COCC[C@H](C)[NH2+][C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000132137373 358708721 /nfs/dbraw/zinc/70/87/21/358708721.db2.gz PGHKVUVKERTPKP-BPNCWPANSA-N 2 0 234.343 2.146 20 0 BEADRP CCCC[C@H](COC)[NH2+]CC(C)(C)C[NH+](C)C ZINC000132149585 358708818 /nfs/dbraw/zinc/70/88/18/358708818.db2.gz YKOBSCAXKBTULU-CYBMUJFWSA-N 2 0 244.423 2.369 20 0 BEADRP C[C@@H]1CCCC[C@H]1C[NH2+]CCN1CCCC1 ZINC000134841671 358807698 /nfs/dbraw/zinc/80/76/98/358807698.db2.gz NMAZHTIALYSFNM-KGLIPLIRSA-N 2 0 224.392 2.498 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]CC(C2CC2)C2CC2)C1 ZINC000086404702 358968567 /nfs/dbraw/zinc/96/85/67/358968567.db2.gz SXPHMFZZMFGWJD-QWHCGFSZSA-N 2 0 222.376 2.282 20 0 BEADRP Cc1c[nH+]ccc1NCC1CC[NH+](C)CC1 ZINC000070047281 359040218 /nfs/dbraw/zinc/04/02/18/359040218.db2.gz YHECCZPXTYJXHX-UHFFFAOYSA-N 2 0 219.332 2.144 20 0 BEADRP Cc1c[nH+]ccc1NCC(C)(C)C[NH+](C)C ZINC000070046576 359040262 /nfs/dbraw/zinc/04/02/62/359040262.db2.gz VZONFYJTXOBMTJ-UHFFFAOYSA-N 2 0 221.348 2.390 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H]2CCO[C@H](C)C2)CC1 ZINC000070347248 359050558 /nfs/dbraw/zinc/05/05/58/359050558.db2.gz HSPSEYKEAZKTQS-TZMCWYRMSA-N 2 0 240.391 2.018 20 0 BEADRP CC[C@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)C(C)C ZINC000423318663 192702712 /nfs/dbraw/zinc/70/27/12/192702712.db2.gz CUIGTRSULLEHIS-QWHCGFSZSA-N 2 0 212.381 2.400 20 0 BEADRP [NH3+][C@@H](C[NH2+][C@H]1CCC12CCCC2)C1CC1 ZINC000423318369 192702957 /nfs/dbraw/zinc/70/29/57/192702957.db2.gz KXEDPNPXRLUECB-RYUDHWBXSA-N 2 0 208.349 2.036 20 0 BEADRP [NH3+]CCCC[NH2+][C@@H](C1CC1)C1CCCC1 ZINC000423319361 192704865 /nfs/dbraw/zinc/70/48/65/192704865.db2.gz FCJGGIZVAPPSGI-CYBMUJFWSA-N 2 0 210.365 2.284 20 0 BEADRP CCC1CC([NH2+]C[C@]2(C)CCC[NH2+]C2)C1 ZINC000423332260 192712677 /nfs/dbraw/zinc/71/26/77/192712677.db2.gz HEZFBJBIEYAVLH-WXRRBKDZSA-N 2 0 210.365 2.154 20 0 BEADRP CCCCO[C@@H]1C[C@H]([NH2+]CCCC[NH3+])C1(C)C ZINC000423322883 192705542 /nfs/dbraw/zinc/70/55/42/192705542.db2.gz JANFVDVZVUAYFI-QWHCGFSZSA-N 2 0 242.407 2.299 20 0 BEADRP COCC[N@H+](CCC[NH3+])[C@@H](C)c1ccccc1 ZINC000070376042 359051944 /nfs/dbraw/zinc/05/19/44/359051944.db2.gz UBCJUSKUCIBRCJ-ZDUSSCGKSA-N 2 0 236.359 2.045 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)C1 ZINC000070643343 359060519 /nfs/dbraw/zinc/06/05/19/359060519.db2.gz AQBRMURSNBXWDD-AGIUHOORSA-N 2 0 222.376 2.249 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CCCCCOC)[C@@H](C)C1 ZINC000246940815 359175595 /nfs/dbraw/zinc/17/55/95/359175595.db2.gz HQKOAIOWVOXRMZ-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP CCCC[N@@H+]1CC[C@@H](C[NH+](CC)CC)C1 ZINC000076002749 359255495 /nfs/dbraw/zinc/25/54/95/359255495.db2.gz CMHKRCKRTWIVDU-ZDUSSCGKSA-N 2 0 212.381 2.450 20 0 BEADRP C[C@@H](Cc1ccsc1)[NH2+]CC1CC[NH2+]CC1 ZINC000086700875 359355524 /nfs/dbraw/zinc/35/55/24/359355524.db2.gz USYYWUSQFXEPPY-NSHDSACASA-N 2 0 238.400 2.268 20 0 BEADRP CO[C@H](C[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1)C(C)C ZINC000623436964 359330271 /nfs/dbraw/zinc/33/02/71/359330271.db2.gz LSXRXXOVEQABHH-CHWSQXEVSA-N 2 0 242.407 2.120 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+][C@@H](C)CCC[NH3+] ZINC000423459194 192779012 /nfs/dbraw/zinc/77/90/12/192779012.db2.gz QXKNVJJLZOHJKX-RYUDHWBXSA-N 2 0 221.348 2.168 20 0 BEADRP C[C@@H](Cc1ccoc1)[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000423432691 192767668 /nfs/dbraw/zinc/76/76/68/192767668.db2.gz MPTMLPNKAOQOBI-TUKIKUTGSA-N 2 0 248.370 2.188 20 0 BEADRP Cc1cncc([C@H](C)[NH2+][C@H](C)CCC[NH3+])c1 ZINC000423466300 192782548 /nfs/dbraw/zinc/78/25/48/192782548.db2.gz XCSBOXWAYOEECJ-NEPJUHHUSA-N 2 0 221.348 2.168 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000423483055 192790032 /nfs/dbraw/zinc/79/00/32/192790032.db2.gz PSFQPXUMGHZIHS-JHJVBQTASA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H](Cc1ccoc1)[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000423487336 192790980 /nfs/dbraw/zinc/79/09/80/192790980.db2.gz UDKGYHYYLYAPSR-GXTWGEPZSA-N 2 0 236.359 2.332 20 0 BEADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@H]2CCc3ccccc32)C1 ZINC000423492012 192794459 /nfs/dbraw/zinc/79/44/59/192794459.db2.gz LDIMTPDCBHXMIY-KYOSRNDESA-N 2 0 230.355 2.391 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+]CCC1=CC[NH2+]CC1 ZINC000423540921 192808900 /nfs/dbraw/zinc/80/89/00/192808900.db2.gz RDISZQNPILSETO-UONOGXRCSA-N 2 0 222.376 2.320 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]CC1=CCCCC1 ZINC000379586398 359560530 /nfs/dbraw/zinc/56/05/30/359560530.db2.gz JMEUAZXHBHJUEH-QWHCGFSZSA-N 2 0 208.349 2.204 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+]CCC1=CC[NH2+]CC1 ZINC000423567168 192814977 /nfs/dbraw/zinc/81/49/77/192814977.db2.gz UXEDHUSUYNIONL-OCCSQVGLSA-N 2 0 222.376 2.465 20 0 BEADRP CC(C)[C@H]1CC[C@@H]1[NH2+]CCCC[NH+](C)C ZINC000308997545 491142094 /nfs/dbraw/zinc/14/20/94/491142094.db2.gz MYZDZIOBEDCPER-OLZOCXBDSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1)C1CC1 ZINC000132913457 491142568 /nfs/dbraw/zinc/14/25/68/491142568.db2.gz PDOAAVCEEHRMJR-MDZLAQPJSA-N 2 0 210.365 2.105 20 0 BEADRP C[N@H+](CCC[NH+]1CCCC1)CC1CC(F)(F)C1 ZINC000450913151 202309169 /nfs/dbraw/zinc/30/91/69/202309169.db2.gz YNBOXPZQBGZLQO-UHFFFAOYSA-N 2 0 246.345 2.449 20 0 BEADRP Cc1ccc(CC[NH2+]C2CCC(C[NH3+])CC2)cn1 ZINC000578433861 366567060 /nfs/dbraw/zinc/56/70/60/366567060.db2.gz NBWKETBCXJVNDX-UHFFFAOYSA-N 2 0 247.386 2.040 20 0 BEADRP C[C@@H](CC1CCC1)[NH2+]CCCC[NH+](C)C ZINC000132995102 491145177 /nfs/dbraw/zinc/14/51/77/491145177.db2.gz FONCWLTWBJFXAH-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP CCC1(CC)CC[N@H+](C[C@]2(C)CC[NH2+]C2)C1 ZINC000087255323 359904468 /nfs/dbraw/zinc/90/44/68/359904468.db2.gz RHFJMOYJTULALP-CYBMUJFWSA-N 2 0 224.392 2.498 20 0 BEADRP CCO[C@@H]1C[C@H]([NH2+]CCC[NH3+])C12CCCCC2 ZINC000087298412 359906169 /nfs/dbraw/zinc/90/61/69/359906169.db2.gz NEZTVAFQEUMWLY-QWHCGFSZSA-N 2 0 240.391 2.053 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCCC[C@H]1C[NH3+])c1ccco1 ZINC000088169554 359939478 /nfs/dbraw/zinc/93/94/78/359939478.db2.gz GAMGJRLKUVMGSE-SDDRHHMPSA-N 2 0 222.332 2.448 20 0 BEADRP C[C@H]([NH2+][C@H]1CCCC[C@@H]1C[NH3+])c1ccncc1 ZINC000089139917 359991506 /nfs/dbraw/zinc/99/15/06/359991506.db2.gz OOERCCOLKHSXKL-YUTCNCBUSA-N 2 0 233.359 2.250 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]CCOC1CCCCC1 ZINC000089150696 359993728 /nfs/dbraw/zinc/99/37/28/359993728.db2.gz WLEMJNDWGGERBG-JSGCOSHPSA-N 2 0 240.391 2.053 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]CCc1ccccc1 ZINC000089139566 359992137 /nfs/dbraw/zinc/99/21/37/359992137.db2.gz JVHGYNWOXVOSFF-GJZGRUSLSA-N 2 0 232.371 2.336 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]CCCc1ccccc1 ZINC000089147662 359993773 /nfs/dbraw/zinc/99/37/73/359993773.db2.gz QCDFXZQLANPMIM-LSDHHAIUSA-N 2 0 232.371 2.336 20 0 BEADRP CC(C)COCCC[NH2+][C@H]1CCCC[C@H]1C[NH3+] ZINC000089140454 359993176 /nfs/dbraw/zinc/99/31/76/359993176.db2.gz OWIPJBZMQJSRIS-KBPBESRZSA-N 2 0 242.407 2.156 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]CCCc1ccccc1 ZINC000089147663 359994092 /nfs/dbraw/zinc/99/40/92/359994092.db2.gz QCDFXZQLANPMIM-GJZGRUSLSA-N 2 0 232.371 2.336 20 0 BEADRP CCOc1cccc(C[NH2+][C@@H]2CCC[C@H]2C[NH3+])c1 ZINC000089149830 359994232 /nfs/dbraw/zinc/99/42/32/359994232.db2.gz KMKUVOFNLRWKEV-DZGCQCFKSA-N 2 0 248.370 2.302 20 0 BEADRP COC[C@H](C)C[NH2+][C@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000093516223 360255834 /nfs/dbraw/zinc/25/58/34/360255834.db2.gz WNXBFUHQRUSFIV-MCIONIFRSA-N 2 0 242.407 2.169 20 0 BEADRP CC1(C)CCC[C@H]([NH2+][C@H]2CCCNC2)C1 ZINC000149299468 360615266 /nfs/dbraw/zinc/61/52/66/360615266.db2.gz ADNXMSXBNJLJIT-RYUDHWBXSA-N 2 0 210.365 2.297 20 0 BEADRP C([NH2+]C1CC2(CCC2)C1)[C@H]1CC[N@@H+](C2CC2)C1 ZINC000448062286 200697195 /nfs/dbraw/zinc/69/71/95/200697195.db2.gz APNDRGSUWXNBKW-GFCCVEGCSA-N 2 0 234.387 2.393 20 0 BEADRP CC(C)[N@H+](C[C@@H]1CC[NH2+][C@@H](C)C1)C1CC1 ZINC000414677458 200758251 /nfs/dbraw/zinc/75/82/51/200758251.db2.gz OVADFTHQSJGXPT-NWDGAFQWSA-N 2 0 210.365 2.247 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]C[C@@H]2CC[NH2+]C2)[C@H]1C ZINC000414901514 200778802 /nfs/dbraw/zinc/77/88/02/200778802.db2.gz GBTTVJUPKBTFPE-XQHKEYJVSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@H]2CC[NH2+]C2)[C@@H](C)C1 ZINC000414902732 200779497 /nfs/dbraw/zinc/77/94/97/200779497.db2.gz HLRDWZFHKPCFOQ-VOAKCMCISA-N 2 0 210.365 2.010 20 0 BEADRP [NH3+]CC1CCC([NH2+]CCc2ccccc2)CC1 ZINC000415089392 200793203 /nfs/dbraw/zinc/79/32/03/200793203.db2.gz WMPIJBYRBLNNLM-UHFFFAOYSA-N 2 0 232.371 2.336 20 0 BEADRP CC[C@H]1CCC[C@H]([NH2+]CC2([NH3+])CCOCC2)C1 ZINC000629388763 361035812 /nfs/dbraw/zinc/03/58/12/361035812.db2.gz SPIJJXWFQXXCBE-STQMWFEESA-N 2 0 240.391 2.053 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1[NH2+][C@@H](C)CCC(F)(F)F ZINC000629389596 361036312 /nfs/dbraw/zinc/03/63/12/361036312.db2.gz ZMVGQGQPGILUSV-LPEHRKFASA-N 2 0 238.297 2.448 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1[NH2+][C@@H](C)CC1CCC1 ZINC000629389278 361036432 /nfs/dbraw/zinc/03/64/32/361036432.db2.gz UGXWZSQWUWUGBY-WCFLWFBJSA-N 2 0 210.365 2.295 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1[NH2+][C@@H]1CCCC[C@H]1C ZINC000629390397 361037947 /nfs/dbraw/zinc/03/79/47/361037947.db2.gz DXGNJMGBZWWQMZ-YVECIDJPSA-N 2 0 210.365 2.295 20 0 BEADRP CC[C@@H](C)C[C@H](CC)[NH2+]CC1([NH3+])CCOCC1 ZINC000629388037 361040323 /nfs/dbraw/zinc/04/03/23/361040323.db2.gz PXABDFBEGHTWBW-OLZOCXBDSA-N 2 0 242.407 2.299 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1[NH2+][C@H]1CCC(C)(C)C1 ZINC000629387891 361040443 /nfs/dbraw/zinc/04/04/43/361040443.db2.gz IAXNYGDBUGCTTQ-SDDRHHMPSA-N 2 0 210.365 2.295 20 0 BEADRP CCC1CCC([NH2+]CC2([NH3+])CCOCC2)CC1 ZINC000629388467 361041340 /nfs/dbraw/zinc/04/13/40/361041340.db2.gz RLLDFBUDDQAZCN-UHFFFAOYSA-N 2 0 240.391 2.053 20 0 BEADRP CC1(C)CCC[C@H](C[NH2+]CCOCCC[NH3+])C1 ZINC000629399177 361046646 /nfs/dbraw/zinc/04/66/46/361046646.db2.gz NMTHMBWCWRVILJ-ZDUSSCGKSA-N 2 0 242.407 2.158 20 0 BEADRP CC(C)C1CCC([NH2+]CCOCCC[NH3+])CC1 ZINC000629399347 361050106 /nfs/dbraw/zinc/05/01/06/361050106.db2.gz QFUPEKRWHLDBHK-UHFFFAOYSA-N 2 0 242.407 2.156 20 0 BEADRP CCC1(C)CCC([NH2+]CCOCCC[NH3+])CC1 ZINC000629400274 361050633 /nfs/dbraw/zinc/05/06/33/361050633.db2.gz SLKFJCNMPUYOBL-UHFFFAOYSA-N 2 0 242.407 2.300 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+]C[C@@H]1CCCC[C@H]1C ZINC000629408684 361059133 /nfs/dbraw/zinc/05/91/33/361059133.db2.gz YQAPAEYPJJESOA-MROQNXINSA-N 2 0 210.365 2.153 20 0 BEADRP Cc1cccc2c1C[C@H]([NH2+][C@H](C)C[C@H](C)[NH3+])CO2 ZINC000629513167 361110081 /nfs/dbraw/zinc/11/00/81/361110081.db2.gz FMJCENGYULFGEW-XQQFMLRXSA-N 2 0 248.370 2.014 20 0 BEADRP CCC[C@H](C)CCCN1CCO[C@@H]([C@H](C)[NH3+])C1 ZINC000629515995 361110229 /nfs/dbraw/zinc/11/02/29/361110229.db2.gz YUEYLDTZTDDQKC-MELADBBJSA-N 2 0 242.407 2.251 20 0 BEADRP CCC[C@H](C)CCCN1CCO[C@@H]([C@@H](C)[NH3+])C1 ZINC000629515993 361110413 /nfs/dbraw/zinc/11/04/13/361110413.db2.gz YUEYLDTZTDDQKC-BFHYXJOUSA-N 2 0 242.407 2.251 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1[NH2+][C@@H](C)[C@@H]1CC1(C)C ZINC000629527485 361130982 /nfs/dbraw/zinc/13/09/82/361130982.db2.gz WYNDXVURJKPHEE-FIQHERPVSA-N 2 0 210.365 2.151 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1[NH2+][C@@H]1CC[C@H]1C1CCC1 ZINC000629528287 361135728 /nfs/dbraw/zinc/13/57/28/361135728.db2.gz VVQAIZPXSAQQIA-IGQOVBAYSA-N 2 0 222.376 2.295 20 0 BEADRP CC[C@H]([NH2+]CCOCC[NH2+]C)c1cccs1 ZINC000629529311 361138311 /nfs/dbraw/zinc/13/83/11/361138311.db2.gz ZCJJMYPPEWACCV-NSHDSACASA-N 2 0 242.388 2.025 20 0 BEADRP CC[C@@H]1C[C@H](C)CC[C@H]1[NH2+]CCOCC[NH2+]C ZINC000629529552 361143278 /nfs/dbraw/zinc/14/32/78/361143278.db2.gz GTEIKJKUDKXVDD-MGPQQGTHSA-N 2 0 242.407 2.027 20 0 BEADRP C[NH2+]CCOCC[NH2+][C@H](C)[C@H]1CCCC[C@@H]1C ZINC000629530764 361145849 /nfs/dbraw/zinc/14/58/49/361145849.db2.gz QLPUHDOVFDNHLS-MJBXVCDLSA-N 2 0 242.407 2.027 20 0 BEADRP CC[C@H]([NH2+]CCOCC[NH2+]C)c1ccsc1 ZINC000629530927 361145852 /nfs/dbraw/zinc/14/58/52/361145852.db2.gz VHPQNZDNFUMDDF-LBPRGKRZSA-N 2 0 242.388 2.025 20 0 BEADRP C[NH2+]CCOCC[NH2+][C@H](C)CCC(C)(C)C ZINC000629530799 361145887 /nfs/dbraw/zinc/14/58/87/361145887.db2.gz RPBZNGWBHOMPAM-GFCCVEGCSA-N 2 0 230.396 2.027 20 0 BEADRP C[C@H](CCC(C)(C)C)[NH2+]CC1([NH3+])CCOCC1 ZINC000629521781 361122124 /nfs/dbraw/zinc/12/21/24/361122124.db2.gz UIGDECPBZZNTLC-GFCCVEGCSA-N 2 0 242.407 2.299 20 0 BEADRP Cc1ccc(C(C)(C)C[NH2+][C@@H](C)C[C@H](C)[NH3+])nc1 ZINC000629524618 361125643 /nfs/dbraw/zinc/12/56/43/361125643.db2.gz UAPZYZPNVOJJMI-STQMWFEESA-N 2 0 249.402 2.383 20 0 BEADRP Cc1ccc(C(C)(C)C[NH2+][C@H]2CCC[C@@H]2[NH3+])nc1 ZINC000629525224 361126119 /nfs/dbraw/zinc/12/61/19/361126119.db2.gz WWWIYSOPGNXZNT-STQMWFEESA-N 2 0 247.386 2.137 20 0 BEADRP Cc1ccc(CNCCC[NH+]2CCC2)c(F)c1 ZINC000631105933 361166832 /nfs/dbraw/zinc/16/68/32/361166832.db2.gz XLFBSIOQQUQVOQ-UHFFFAOYSA-N 2 0 236.334 2.320 20 0 BEADRP CSCC[C@@H](C)[N@H+](C)C[C@@H]1CCC[NH2+]C1 ZINC000158593718 361205439 /nfs/dbraw/zinc/20/54/39/361205439.db2.gz TWDQYWZOJIZKNF-VXGBXAGGSA-N 2 0 230.421 2.059 20 0 BEADRP CC1CC(C[NH2+][C@@H]2CCCC[C@@H]2C[NH3+])C1 ZINC000622044341 370672565 /nfs/dbraw/zinc/67/25/65/370672565.db2.gz BHYIOSHLSYMADQ-FIYWTHMPSA-N 2 0 210.365 2.140 20 0 BEADRP CC1CC(C[NH2+][C@H]2CCCC[C@H]2C[NH3+])C1 ZINC000622044344 370672639 /nfs/dbraw/zinc/67/26/39/370672639.db2.gz BHYIOSHLSYMADQ-TYUFSLCMSA-N 2 0 210.365 2.140 20 0 BEADRP CC[C@@H]([NH2+]CC[C@@H]1CC1(F)F)[C@@H]1CCC[NH2+]1 ZINC000622044110 370675738 /nfs/dbraw/zinc/67/57/38/370675738.db2.gz VINMLNFUTVYFHD-MXWKQRLJSA-N 2 0 232.318 2.152 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]CC[C@H]1CC1(F)F ZINC000622043844 370675812 /nfs/dbraw/zinc/67/58/12/370675812.db2.gz NNAKMAUQVPWRGI-GARJFASQSA-N 2 0 232.318 2.139 20 0 BEADRP CC[C@@H]([NH2+]CC1CC(C)C1)[C@@H]1CCC[NH2+]1 ZINC000622044491 370677182 /nfs/dbraw/zinc/67/71/82/370677182.db2.gz HYXYHYYVUOFMEU-TUUUFIMRSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H](Cc1cccs1)[NH2+]CC[C@H](C)[NH3+] ZINC000622045753 370679776 /nfs/dbraw/zinc/67/97/76/370679776.db2.gz UXIHWOYSOHEGHP-VHSXEESVSA-N 2 0 212.362 2.006 20 0 BEADRP CC[C@@H]1CC[C@@H](C)C[C@@H]1[NH2+]CCOCCC[NH3+] ZINC000629536293 361398707 /nfs/dbraw/zinc/39/87/07/361398707.db2.gz GBHLIFCZEXBAAZ-MCIONIFRSA-N 2 0 242.407 2.156 20 0 BEADRP CC[C@@H]1CC[C@H](C)C[C@H]1[NH2+]CCOCCC[NH3+] ZINC000629536286 361398788 /nfs/dbraw/zinc/39/87/88/361398788.db2.gz GBHLIFCZEXBAAZ-BFHYXJOUSA-N 2 0 242.407 2.156 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+]CCOCCC[NH3+])s1 ZINC000629536967 361399565 /nfs/dbraw/zinc/39/95/65/361399565.db2.gz HYWHEENOWMXXMN-LLVKDONJSA-N 2 0 242.388 2.073 20 0 BEADRP CC(C)[C@H]1CCC[C@H]([NH2+]CCOCCC[NH3+])C1 ZINC000629536516 361399685 /nfs/dbraw/zinc/39/96/85/361399685.db2.gz GNQMOUOGPWFFCT-KBPBESRZSA-N 2 0 242.407 2.156 20 0 BEADRP C[C@H]([NH2+]C[C@]1(C)C[C@H]2C[C@H]2C1)[C@H]1CCC[NH2+]1 ZINC000629538102 361402363 /nfs/dbraw/zinc/40/23/63/361402363.db2.gz NIAGFBHKFYABOT-QNSTZXKLSA-N 2 0 222.376 2.153 20 0 BEADRP Cc1cccc([C@H](C)[NH2+]CCOCCC[NH3+])c1 ZINC000629538766 361403657 /nfs/dbraw/zinc/40/36/57/361403657.db2.gz LFVALDOGOIRWQU-ZDUSSCGKSA-N 2 0 236.359 2.011 20 0 BEADRP C/C=C\C[NH2+][C@H](C)c1ccc(C[NH3+])nc1C ZINC000629535346 361410277 /nfs/dbraw/zinc/41/02/77/361410277.db2.gz DDFAWQUMHGFSLA-UMCURTJPSA-N 2 0 219.332 2.075 20 0 BEADRP C/C=C\C[NH2+][C@@H](C)c1ccc(C[NH3+])nc1C ZINC000629535343 361410352 /nfs/dbraw/zinc/41/03/52/361410352.db2.gz DDFAWQUMHGFSLA-LWTINBJPSA-N 2 0 219.332 2.075 20 0 BEADRP CC[C@H](C)[C@@H]([NH3+])C(=O)Nc1ccc([C@@H](C)[NH3+])cc1 ZINC000429581589 201117220 /nfs/dbraw/zinc/11/72/20/201117220.db2.gz USDHWQPKHDGZCK-OPQQBVKSSA-N 2 0 249.358 2.018 20 0 BEADRP C[C@H](CCC(C)(C)C)[NH2+]CCOCCC[NH3+] ZINC000629540082 361414126 /nfs/dbraw/zinc/41/41/26/361414126.db2.gz SUUMUKLMDAAPHA-GFCCVEGCSA-N 2 0 230.396 2.156 20 0 BEADRP CCC[C@@H](C)CCC[N@@H+]1CCCO[C@@H](C[NH3+])C1 ZINC000629535732 361409735 /nfs/dbraw/zinc/40/97/35/361409735.db2.gz DPVNBTPXQRBXDG-KGLIPLIRSA-N 2 0 242.407 2.252 20 0 BEADRP CCC[C@H](C)CCC[N@@H+]1CCCO[C@@H](C[NH3+])C1 ZINC000629535706 361409760 /nfs/dbraw/zinc/40/97/60/361409760.db2.gz DPVNBTPXQRBXDG-KBPBESRZSA-N 2 0 242.407 2.252 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+][C@@H](C1CC1)C1CCCC1 ZINC000629544274 361422993 /nfs/dbraw/zinc/42/29/93/361422993.db2.gz HGTVOESKEOTSKD-ZLKJLUDKSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+]C1C2CC3CC(C2)CC1C3 ZINC000629544928 361424390 /nfs/dbraw/zinc/42/43/90/361424390.db2.gz HNZTWWPTBJNTDJ-ROZWMTPISA-N 2 0 234.387 2.151 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+][C@@H]1CCCC12CCCC2 ZINC000629546895 361428877 /nfs/dbraw/zinc/42/88/77/361428877.db2.gz QINCDNTTYOTUDW-YNEHKIRRSA-N 2 0 222.376 2.439 20 0 BEADRP C[C@H](N[C@@H]1CC[NH2+][C@H]1C)c1cc(F)cc(F)c1 ZINC000629547101 361430977 /nfs/dbraw/zinc/43/09/77/361430977.db2.gz GFVDPHXGENNCNV-MWODSPESSA-N 2 0 240.297 2.366 20 0 BEADRP C[C@@H]1C[NH+](C[C@@H]2CCC[NH2+]C2)C[C@@H](C)C1(F)F ZINC000629553171 361437720 /nfs/dbraw/zinc/43/77/20/361437720.db2.gz VJIZYJRUUSYQBX-IJLUTSLNSA-N 2 0 246.345 2.209 20 0 BEADRP CC(C)[C@@H]1CCCC[C@H]1[NH2+]CCOCCC[NH3+] ZINC000629541477 361416395 /nfs/dbraw/zinc/41/63/95/361416395.db2.gz PEXZPMKJPMLTGF-UONOGXRCSA-N 2 0 242.407 2.156 20 0 BEADRP C[C@@H]1C[N@@H+]([C@H]2CCc3ccc(F)cc32)CC[C@@H]1[NH3+] ZINC000430941314 201158875 /nfs/dbraw/zinc/15/88/75/201158875.db2.gz VPRCWGIJHVLZDR-ONERCXAPSA-N 2 0 248.345 2.482 20 0 BEADRP Cc1ccc(C[N@@H+]2C[C@@]3(C)C[NH2+]C[C@@]3(C)C2)cc1 ZINC000629583535 361468143 /nfs/dbraw/zinc/46/81/43/361468143.db2.gz CBBYYYFNQCTOHA-IYBDPMFKSA-N 2 0 244.382 2.426 20 0 BEADRP Cc1ccccc1C[N@@H+]1C[C@@]2(C)C[NH2+]C[C@@]2(C)C1 ZINC000629584025 361469277 /nfs/dbraw/zinc/46/92/77/361469277.db2.gz JORXOFOSILRIJJ-IYBDPMFKSA-N 2 0 244.382 2.426 20 0 BEADRP Cc1ccccc1CCC[N@@H+]1CC[C@@H](C[NH3+])C1 ZINC000430940335 201159521 /nfs/dbraw/zinc/15/95/21/201159521.db2.gz JRXRFECUGATDOJ-AWEZNQCLSA-N 2 0 232.371 2.208 20 0 BEADRP Cc1ccccc1CCC[N@@H+]1CC[C@H](C[NH3+])C1 ZINC000430940337 201159538 /nfs/dbraw/zinc/15/95/38/201159538.db2.gz JRXRFECUGATDOJ-CQSZACIVSA-N 2 0 232.371 2.208 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](CCCc2ccccc2C)C1 ZINC000430941212 201159802 /nfs/dbraw/zinc/15/98/02/201159802.db2.gz VABODEPXKUPEEZ-HNNXBMFYSA-N 2 0 246.398 2.469 20 0 BEADRP COc1cccc2c1C[N@H+](CC[C@H]1CC[NH2+]C1)C2 ZINC000629581876 361472965 /nfs/dbraw/zinc/47/29/65/361472965.db2.gz IVSBJNUJTFEPFO-GFCCVEGCSA-N 2 0 246.354 2.010 20 0 BEADRP C([C@H]1CCC[NH2+]C1)[N@@H+]1CCCC2(CC2)CC1 ZINC000629586134 361475464 /nfs/dbraw/zinc/47/54/64/361475464.db2.gz LCZXUFMAKBDFDR-ZDUSSCGKSA-N 2 0 222.376 2.252 20 0 BEADRP C(C[N@@H+]1CCCC2(CC2)CC1)[C@H]1CC[NH2+]C1 ZINC000629587076 361475907 /nfs/dbraw/zinc/47/59/07/361475907.db2.gz XOCSIHQXIIQDOK-CYBMUJFWSA-N 2 0 222.376 2.252 20 0 BEADRP C[C@]12C[NH2+]C[C@@]1(C)C[N@H+](C[C@@H]1CC[C@@H]3C[C@@H]3C1)C2 ZINC000629593126 361485046 /nfs/dbraw/zinc/48/50/46/361485046.db2.gz DQLZPGVYVNHDNQ-LJIZCISZSA-N 2 0 248.414 2.354 20 0 BEADRP CC[C@H](C)[N@@H+]1CC[C@H](C(F)(F)F)[C@@H](C[NH3+])C1 ZINC000629562476 361456180 /nfs/dbraw/zinc/45/61/80/361456180.db2.gz NJTGPKHQWSSJMX-GUBZILKMSA-N 2 0 238.297 2.244 20 0 BEADRP Cn1ccc(C[N@H+](CCC[NH3+])CC2CCCC2)c1 ZINC000629654447 361558272 /nfs/dbraw/zinc/55/82/72/361558272.db2.gz OWWPJNBDEDIKFE-UHFFFAOYSA-N 2 0 249.402 2.366 20 0 BEADRP CCCC[C@@H](C[NH3+])NCc1ccc(COC)o1 ZINC000629647638 361537417 /nfs/dbraw/zinc/53/74/17/361537417.db2.gz CMZXJOYRZICTGG-NSHDSACASA-N 2 0 240.347 2.033 20 0 BEADRP C[C@]1(C[N@@H+]2CCCC(F)(F)CC2)CC[NH2+]C1 ZINC000629655216 361560697 /nfs/dbraw/zinc/56/06/97/361560697.db2.gz UKMINWLJQPPENA-NSHDSACASA-N 2 0 232.318 2.107 20 0 BEADRP COC1(C[NH2+]CC2([NH3+])CCCCC2)CCCC1 ZINC000629648113 361539276 /nfs/dbraw/zinc/53/92/76/361539276.db2.gz OQYGRNQRIDMEIO-UHFFFAOYSA-N 2 0 240.391 2.197 20 0 BEADRP COC1(C[NH2+]CCC[C@H]2CCC[NH2+]2)CCCC1 ZINC000629649152 361543655 /nfs/dbraw/zinc/54/36/55/361543655.db2.gz JPCCDPNAWFCGBX-ZDUSSCGKSA-N 2 0 240.391 2.067 20 0 BEADRP CC[C@H](C)[NH2+]C1CC[NH+](CC(C)C)CC1 ZINC000152153653 201191682 /nfs/dbraw/zinc/19/16/82/201191682.db2.gz LFGDNZPXDQHNFC-LBPRGKRZSA-N 2 0 212.381 2.495 20 0 BEADRP C[C@@]1(C[N@@H+]2CCCC3(CC3)CC2)CC[NH2+]C1 ZINC000629669571 361589787 /nfs/dbraw/zinc/58/97/87/361589787.db2.gz YEZVUCMDZIVDBG-CYBMUJFWSA-N 2 0 222.376 2.252 20 0 BEADRP CC[N@H+](Cc1cccnc1C)[C@@H]1CCC[NH2+]CC1 ZINC000435381595 201264727 /nfs/dbraw/zinc/26/47/27/201264727.db2.gz UVLBIJJPKUGWSZ-OAHLLOKOSA-N 2 0 247.386 2.354 20 0 BEADRP CC[N@H+](Cc1ncccc1C)[C@H]1CCC[NH2+]CC1 ZINC000435378945 201265072 /nfs/dbraw/zinc/26/50/72/201265072.db2.gz HDTMFFRFMHBKRT-AWEZNQCLSA-N 2 0 247.386 2.354 20 0 BEADRP [NH3+]C1CCC([NH2+]C[C@H]2CCCCS2)CC1 ZINC000087683682 181341539 /nfs/dbraw/zinc/34/15/39/181341539.db2.gz SFNKDDOVEJLRHL-HTAVTVPLSA-N 2 0 228.405 2.132 20 0 BEADRP [NH3+]C1CCC([NH2+]CCc2cccc(F)c2)CC1 ZINC000094076700 181341556 /nfs/dbraw/zinc/34/15/56/181341556.db2.gz YVPNOVJNDJJAAA-UHFFFAOYSA-N 2 0 236.334 2.228 20 0 BEADRP CC[N@H+](CCCOC(C)C)[C@@H]1CCC[NH2+]CC1 ZINC000435615276 201280286 /nfs/dbraw/zinc/28/02/86/201280286.db2.gz PCKWINQKMTZFBF-CQSZACIVSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@H]1Cc2ccc(C3=CC[NH2+]CC3)cc2C[NH2+]1 ZINC000629722592 361662698 /nfs/dbraw/zinc/66/26/98/361662698.db2.gz CSUPUQOPCZSKCU-NSHDSACASA-N 2 0 228.339 2.098 20 0 BEADRP C[NH2+]CCCN(Cc1ccccc1OC)C1CC1 ZINC000435874813 201291590 /nfs/dbraw/zinc/29/15/90/201291590.db2.gz OAPZDIRPXNBGRZ-UHFFFAOYSA-N 2 0 248.370 2.269 20 0 BEADRP C[NH2+]CCC[N@@H+]1C[C@@H](c2ccccc2)C[C@H]1C ZINC000435871731 201293976 /nfs/dbraw/zinc/29/39/76/201293976.db2.gz LJDMVYQHYQLNOR-HIFRSBDPSA-N 2 0 232.371 2.474 20 0 BEADRP [NH3+]CCC[NH2+][C@H]1CCC[C@@H]1c1ccc(F)cc1 ZINC000437793044 201373811 /nfs/dbraw/zinc/37/38/11/201373811.db2.gz MSIDOQKCNOZYRK-KGLIPLIRSA-N 2 0 236.334 2.400 20 0 BEADRP C[C@H](CC1CCOCC1)[NH2+]C1CCC([NH3+])CC1 ZINC000437797168 201374085 /nfs/dbraw/zinc/37/40/85/201374085.db2.gz IFBJZIIWDDTZDI-LMWSTFAQSA-N 2 0 240.391 2.051 20 0 BEADRP CN(C)c1ccccc1C[NH2+]C1CCC([NH3+])CC1 ZINC000437774426 201370882 /nfs/dbraw/zinc/37/08/82/201370882.db2.gz NJMRZSAANYYLMW-UHFFFAOYSA-N 2 0 247.386 2.112 20 0 BEADRP C[C@@H]1[C@H]([NH2+]CCC[NH3+])C[C@@H]1c1ccccc1 ZINC000437759643 201372217 /nfs/dbraw/zinc/37/22/17/201372217.db2.gz DOAWTWQHKXQQMK-FPMFFAJLSA-N 2 0 218.344 2.117 20 0 BEADRP Cc1ncc(C[NH2+][C@@H](C)C2CCCC2)n1C ZINC000573506038 364851189 /nfs/dbraw/zinc/85/11/89/364851189.db2.gz JFCJSGLTTSTFGT-JTQLQIEISA-N 2 0 221.348 2.397 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCc2nc[nH]c2C1)c1cncs1 ZINC000573530071 364855289 /nfs/dbraw/zinc/85/52/89/364855289.db2.gz QPTRFJOIXBEKNR-BDAKNGLRSA-N 2 0 248.355 2.074 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CCc1ccc(F)c(F)c1 ZINC000573711444 364899013 /nfs/dbraw/zinc/89/90/13/364899013.db2.gz TVWKJGYTLMDADS-NXEZZACHSA-N 2 0 242.313 2.223 20 0 BEADRP [NH3+]CCCC[NH2+]C(C1CCC1)C1CCC1 ZINC000336686267 181377928 /nfs/dbraw/zinc/37/79/28/181377928.db2.gz KYKKXBSJOPVNLC-UHFFFAOYSA-N 2 0 210.365 2.284 20 0 BEADRP [NH3+]CCCC[NH2+][C@@H]1CCc2ccccc21 ZINC000003936612 181377572 /nfs/dbraw/zinc/37/75/72/181377572.db2.gz ZCTVHWPVISYHOJ-CYBMUJFWSA-N 2 0 204.317 2.002 20 0 BEADRP CC[N@H+](C)C[C@@H]1CCN(c2cc[nH+]cc2C)C1 ZINC000191981482 365005180 /nfs/dbraw/zinc/00/51/80/365005180.db2.gz SLQYGZNTRGAEBB-ZDUSSCGKSA-N 2 0 233.359 2.168 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[NH2+][C@@H](C)C1 ZINC000574191057 365007027 /nfs/dbraw/zinc/00/70/27/365007027.db2.gz ALMNGMSDWKCLKF-LOWDOPEQSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H]1CCC12CCOCC2 ZINC000574392335 365046788 /nfs/dbraw/zinc/04/67/88/365046788.db2.gz OZBKNFLIMQXBFR-QWHCGFSZSA-N 2 0 240.391 2.053 20 0 BEADRP C[C@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1ccoc1 ZINC000574269158 365022871 /nfs/dbraw/zinc/02/28/71/365022871.db2.gz LBQXRGUQMFZJHX-AAEUAGOBSA-N 2 0 222.332 2.462 20 0 BEADRP C[C@@H](C[N@H+](C)CCC[NH3+])c1ccc(F)cc1 ZINC000574277869 365026173 /nfs/dbraw/zinc/02/61/73/365026173.db2.gz VDEGMHSNZZHNBV-NSHDSACASA-N 2 0 224.323 2.210 20 0 BEADRP NCC[NH2+][C@H]1CCCC[C@@H]1c1ccccc1 ZINC000037712964 181397763 /nfs/dbraw/zinc/39/77/63/181397763.db2.gz WSIHFHHYIQOIDR-KGLIPLIRSA-N 2 0 218.344 2.261 20 0 BEADRP Cc1ccc2[nH+]ccc(NC[C@H](C)[NH+](C)C)c2c1 ZINC000443429275 193020326 /nfs/dbraw/zinc/02/03/26/193020326.db2.gz KRZHWKBLGYIBNJ-LBPRGKRZSA-N 2 0 243.354 2.327 20 0 BEADRP C[C@H]1C[NH+](CCC[NH+]2CCCCC2)C[C@@H]1C ZINC000444602662 193052035 /nfs/dbraw/zinc/05/20/35/193052035.db2.gz LGZLDLLNXRRXLF-KBPBESRZSA-N 2 0 224.392 2.450 20 0 BEADRP CC1(C)C[C@@H]1[NH2+]C1CCN(C2CC2)CC1 ZINC000335566919 365292282 /nfs/dbraw/zinc/29/22/82/365292282.db2.gz MTPGQVJCZDGLHA-LBPRGKRZSA-N 2 0 208.349 2.001 20 0 BEADRP COc1cc(C)ccc1[C@@H](C)[NH2+]CC[C@H](C)[NH3+] ZINC000575795080 365363251 /nfs/dbraw/zinc/36/32/51/365363251.db2.gz KXAVWKVGWJCQMX-NWDGAFQWSA-N 2 0 236.359 2.392 20 0 BEADRP CC[C@@H]([NH3+])CNCc1ccnc2ccccc12 ZINC000576009989 365448497 /nfs/dbraw/zinc/44/84/97/365448497.db2.gz AUJRQFCYPBEQBH-GFCCVEGCSA-N 2 0 229.327 2.062 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H]1C[C@H](C)CC[C@H]1C ZINC000576099194 365483338 /nfs/dbraw/zinc/48/33/38/365483338.db2.gz HEHUBINCOWDRDZ-JHJVBQTASA-N 2 0 212.381 2.400 20 0 BEADRP CC1(C[NH+]2CCC([C@@H]3CCC[NH2+]3)CC2)CC1 ZINC000564969101 325837286 /nfs/dbraw/zinc/83/72/86/325837286.db2.gz QTSNDCMUUWOAFM-ZDUSSCGKSA-N 2 0 222.376 2.251 20 0 BEADRP [NH3+]C[C@H]1CCC[N@H+](CCCc2ccsc2)C1 ZINC000579712576 366989219 /nfs/dbraw/zinc/98/92/19/366989219.db2.gz RXGFIOPISDBOFU-CYBMUJFWSA-N 2 0 238.400 2.351 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000381128754 367353359 /nfs/dbraw/zinc/35/33/59/367353359.db2.gz KCKMBZCRXPGSDU-RDBSUJKOSA-N 2 0 224.392 2.352 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@@H]2C[C@@H](C)[C@H]2C)CC1 ZINC000381382788 367391325 /nfs/dbraw/zinc/39/13/25/367391325.db2.gz LDMOLYZDDDTLHL-YRGRVCCFSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@H](Cc1ccsc1)[NH2+][C@@H]1CN(C)C[C@H]1C ZINC000381460710 367408928 /nfs/dbraw/zinc/40/89/28/367408928.db2.gz KXOWYZCELDWCJU-NQBHXWOUSA-N 2 0 238.400 2.219 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)NCc1noc2ccccc12 ZINC000581440238 367473140 /nfs/dbraw/zinc/47/31/40/367473140.db2.gz ZJAHTOHVSZWSQW-ZJUUUORDSA-N 2 0 233.315 2.043 20 0 BEADRP Cc1csc(C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)c1 ZINC000382080722 367484365 /nfs/dbraw/zinc/48/43/65/367484365.db2.gz IFOZBXQRNJDMGO-MNOVXSKESA-N 2 0 224.373 2.416 20 0 BEADRP Cc1csc(C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)c1 ZINC000382080726 367484591 /nfs/dbraw/zinc/48/45/91/367484591.db2.gz IFOZBXQRNJDMGO-WDEREUQCSA-N 2 0 224.373 2.416 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]C[C@H]1CCCC1(F)F ZINC000381833839 367460528 /nfs/dbraw/zinc/46/05/28/367460528.db2.gz GLFNUFFZEGEUEW-IJLUTSLNSA-N 2 0 246.345 2.352 20 0 BEADRP c1ccc2c(c1)CC[C@@H]2[NH2+]CCC[NH2+]C1CC1 ZINC000382548822 367537259 /nfs/dbraw/zinc/53/72/59/367537259.db2.gz RKTITAWTPWMARC-HNNXBMFYSA-N 2 0 230.355 2.406 20 0 BEADRP COCc1cccc(C[NH2+]CCC[NH2+]C2CC2)c1 ZINC000382556235 367538882 /nfs/dbraw/zinc/53/88/82/367538882.db2.gz JSMLHNAHWWVIQT-UHFFFAOYSA-N 2 0 248.370 2.065 20 0 BEADRP CC[C@@H]([NH2+]CCC[NH2+]C1CC1)C1CCC1 ZINC000382587889 367544693 /nfs/dbraw/zinc/54/46/93/367544693.db2.gz VZRYRLUZRYBFGY-CYBMUJFWSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]([NH2+]CC1CC[NH2+]CC1)C1CCSCC1 ZINC000581542456 367563935 /nfs/dbraw/zinc/56/39/35/367563935.db2.gz XGFUPUXBHSENRE-NSHDSACASA-N 2 0 242.432 2.107 20 0 BEADRP CCC[NH2+]CC[NH2+]C[C@H]1CCC[C@@H](C)C1 ZINC000383112717 367598303 /nfs/dbraw/zinc/59/83/03/367598303.db2.gz IDESIYQXLOEIHT-OLZOCXBDSA-N 2 0 212.381 2.402 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]CC1CC(F)(F)C1 ZINC000383149443 367601052 /nfs/dbraw/zinc/60/10/52/367601052.db2.gz ODGSBXOOELDCEW-SCVCMEIPSA-N 2 0 246.345 2.350 20 0 BEADRP CC(C)[C@H]([NH2+]CC[C@H]1CCC[NH2+]1)C1CC1 ZINC000581661522 367662784 /nfs/dbraw/zinc/66/27/84/367662784.db2.gz MZVVYCXHNPMPFW-OLZOCXBDSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@@H]1[C@H](C)CC[N@@H+]1CC[C@H]1CCC[NH2+]C1 ZINC000384027841 367670250 /nfs/dbraw/zinc/67/02/50/367670250.db2.gz ZECUUGQBEKPSEW-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H](CC(C)(C)C)[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000384512704 367695383 /nfs/dbraw/zinc/69/53/83/367695383.db2.gz HOXLCTAGFRESIV-NWDGAFQWSA-N 2 0 212.381 2.400 20 0 BEADRP CSCCC[NH2+][C@H](C)C1CC[NH+](C)CC1 ZINC000068998336 370870829 /nfs/dbraw/zinc/87/08/29/370870829.db2.gz KELWGPKINRNHAU-LLVKDONJSA-N 2 0 230.421 2.059 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H]2C[C@H](C)O[C@@H]2C)CC1 ZINC000384940040 367761068 /nfs/dbraw/zinc/76/10/68/367761068.db2.gz QSJQFYDBEXNQBJ-OUCADQQQSA-N 2 0 240.391 2.016 20 0 BEADRP CCCOc1ccc(C[N@H+](C)C2CC([NH3+])C2)cc1 ZINC000385258535 367813552 /nfs/dbraw/zinc/81/35/52/367813552.db2.gz YAQMUBUNGZRDFT-UHFFFAOYSA-N 2 0 248.370 2.397 20 0 BEADRP Cc1ccc(C)c(C[N@@H+](C)C2CC([NH3+])C2)c1 ZINC000385095046 367788317 /nfs/dbraw/zinc/78/83/17/367788317.db2.gz YRSKHQYCUQHCNE-UHFFFAOYSA-N 2 0 218.344 2.225 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H]1CCC[C@@H]1C(C)C ZINC000581878549 367866122 /nfs/dbraw/zinc/86/61/22/367866122.db2.gz NYDVNYWJTDLHKD-CHWSQXEVSA-N 2 0 212.381 2.400 20 0 BEADRP COc1ccc(C)cc1CN(C)C1(C[NH3+])CCC1 ZINC000385306154 367818197 /nfs/dbraw/zinc/81/81/97/367818197.db2.gz KTBQVWGKNQXXNQ-UHFFFAOYSA-N 2 0 248.370 2.317 20 0 BEADRP C[C@H]([N@H+](C)C[C@@H]1CC[NH2+][C@H](C)C1)C1(C)CC1 ZINC000385481899 367835164 /nfs/dbraw/zinc/83/51/64/367835164.db2.gz YUGXCMWLKUZVIN-FRRDWIJNSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H]([N@H+](C)CC[C@@H]1CC[NH2+]C1)C1(C)CC1 ZINC000385524033 367840319 /nfs/dbraw/zinc/84/03/19/367840319.db2.gz WANLMNUJDXXFEQ-RYUDHWBXSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@@]2(C)CCC[NH2+]C2)[C@@H]1C ZINC000386090844 367911107 /nfs/dbraw/zinc/91/11/07/367911107.db2.gz FVSQYSOAOFXZSM-NDBYEHHHSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H](NCCc1ccccc1)[C@@H]1CCCC[NH2+]1 ZINC000386612494 368001495 /nfs/dbraw/zinc/00/14/95/368001495.db2.gz WVZWSYKKDJXZSA-HIFRSBDPSA-N 2 0 232.371 2.349 20 0 BEADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+][C@@H]2CCC[C@H]2C)C1 ZINC000083390742 368771868 /nfs/dbraw/zinc/77/18/68/368771868.db2.gz HEWSJGGECOMNGV-HZSPNIEDSA-N 2 0 224.392 2.495 20 0 BEADRP CC1CCC([NH2+]CC2CC[NH2+]CC2)CC1 ZINC000086700196 368883913 /nfs/dbraw/zinc/88/39/13/368883913.db2.gz OLQOAPMSRSUIRU-UHFFFAOYSA-N 2 0 210.365 2.154 20 0 BEADRP CCc1ccc(C[N@@H+]2CC[C@@H]([NH3+])[C@H](C)C2)s1 ZINC000086884435 368886614 /nfs/dbraw/zinc/88/66/14/368886614.db2.gz BPPVLRLHXLUTFQ-ZWNOBZJWSA-N 2 0 238.400 2.480 20 0 BEADRP c1ccc2c(c1)CC[NH+](CC[C@@H]1CC[NH2+]C1)CC2 ZINC000089749516 368952790 /nfs/dbraw/zinc/95/27/90/368952790.db2.gz TUOGDPMQIHBWAX-AWEZNQCLSA-N 2 0 244.382 2.087 20 0 BEADRP CC(C)OC[C@@H](C)[NH2+]C[C@H]1CCCC[N@H+](C)C1 ZINC000623657096 368997975 /nfs/dbraw/zinc/99/79/75/368997975.db2.gz JRBYVINUVSXNDU-ZIAGYGMSSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)C1CC1 ZINC000623655837 368991167 /nfs/dbraw/zinc/99/11/67/368991167.db2.gz GZPJSKKWKHMYDS-RYUDHWBXSA-N 2 0 210.365 2.106 20 0 BEADRP C[N@@H+]1CCCC[C@H](C[NH2+]CC(C)(C)C)C1 ZINC000623656519 368993349 /nfs/dbraw/zinc/99/33/49/368993349.db2.gz VYVWTDRIHWTFJI-GFCCVEGCSA-N 2 0 212.381 2.354 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CCCC[N@H+](C)C1 ZINC000623656345 368993528 /nfs/dbraw/zinc/99/35/28/368993528.db2.gz SFHFTFUTXJPCJT-RDBSUJKOSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH+](C)CCOc1ccc(C[NH2+]C2CCC2)cc1 ZINC000107322805 369342415 /nfs/dbraw/zinc/34/24/15/369342415.db2.gz USLGHOZGJPIDES-UHFFFAOYSA-N 2 0 248.370 2.269 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]Cc2ccc3c[nH+]cn3c2)[C@H]1C ZINC000459658444 203330844 /nfs/dbraw/zinc/33/08/44/203330844.db2.gz KILSAFUVWOLYPR-SUNKGSAMSA-N 2 0 229.327 2.468 20 0 BEADRP Cc1ccccc1OCCCN1C[C@@H]([NH3+])C[C@@H]1C ZINC000631858542 369442798 /nfs/dbraw/zinc/44/27/98/369442798.db2.gz AAOUMPGBFZSKHA-KBPBESRZSA-N 2 0 248.370 2.185 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CC[C@H]2CCC[N@H+](C)C2)C1 ZINC000459732732 203344416 /nfs/dbraw/zinc/34/44/16/203344416.db2.gz MSQMRISNRYGPIN-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)[C@H](C)[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC000459736646 203347925 /nfs/dbraw/zinc/34/79/25/203347925.db2.gz QEFSUWFEHVGBHT-QWHCGFSZSA-N 2 0 212.381 2.352 20 0 BEADRP CCC(CC)[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC000459800612 203374748 /nfs/dbraw/zinc/37/47/48/203374748.db2.gz ZVGCOYVOTVYEAH-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@H](CC1CC1)[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC000459795987 203372657 /nfs/dbraw/zinc/37/26/57/203372657.db2.gz VRKWLJLPCUYNJB-TZMCWYRMSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]([NH2+]C[C@@H](C1CC1)N(C)C)C1CCCC1 ZINC000166319248 203387190 /nfs/dbraw/zinc/38/71/90/203387190.db2.gz WZTGERVXOBRHLU-FZMZJTMJSA-N 2 0 224.392 2.495 20 0 BEADRP CSCC[NH2+][C@@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1 ZINC000250930091 369622536 /nfs/dbraw/zinc/62/25/36/369622536.db2.gz CHRDHUPQJFZAFH-YNEHKIRRSA-N 2 0 242.432 2.250 20 0 BEADRP CCCc1ccc(C[NH+]2C[C@@H]3C[NH2+]C[C@H]3C2)cc1 ZINC000620278347 369794351 /nfs/dbraw/zinc/79/43/51/369794351.db2.gz NVKHDLAONOFRHR-HOTGVXAUSA-N 2 0 244.382 2.290 20 0 BEADRP C[C@H]1CC[C@H]1[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000309803235 370263744 /nfs/dbraw/zinc/26/37/44/370263744.db2.gz RONQYCUXIYPODQ-SMDDNHRTSA-N 2 0 222.376 2.249 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CC[C@H]2CC2(F)F)[C@H](C)C1 ZINC000621734734 370491896 /nfs/dbraw/zinc/49/18/96/370491896.db2.gz VBKKYYBHNVFCTK-WOPDTQHZSA-N 2 0 246.345 2.352 20 0 BEADRP Cc1cc(CN2CCCC[C@H]2[C@@H](C)[NH3+])ccn1 ZINC000621773963 370519003 /nfs/dbraw/zinc/51/90/03/370519003.db2.gz HDOABOUUNYZBDA-OCCSQVGLSA-N 2 0 233.359 2.092 20 0 BEADRP Cc1cc(C[N@H+]2CCC[C@H](C)[C@H]2CC[NH3+])ccn1 ZINC000621776327 370524054 /nfs/dbraw/zinc/52/40/54/370524054.db2.gz JCDVDBSOLBTJKP-SWLSCSKDSA-N 2 0 247.386 2.339 20 0 BEADRP [NH3+][C@]12CCC[C@@H]1C[N@H+](CC1CCCCC1)C2 ZINC000621777650 370526759 /nfs/dbraw/zinc/52/67/59/370526759.db2.gz DJBVHYATJHXSHZ-KGLIPLIRSA-N 2 0 222.376 2.380 20 0 BEADRP CCC(CC)C[N@@H+]1C[C@@H]2CCC[C@]2([NH3+])C1 ZINC000621784133 370535288 /nfs/dbraw/zinc/53/52/88/370535288.db2.gz KIIBIYMXVHTOAC-STQMWFEESA-N 2 0 210.365 2.236 20 0 BEADRP [NH3+][C@]12CCC[C@@H]1C[N@H+](C[C@@H]1CC[C@@H]3C[C@@H]3C1)C2 ZINC000621784342 370535596 /nfs/dbraw/zinc/53/55/96/370535596.db2.gz NMHIZCRZBGGINZ-QMIVOQANSA-N 2 0 234.387 2.236 20 0 BEADRP C/C=C/C[NH2+]Cc1cn(-c2cc[nH+]cc2)nc1C ZINC000623739931 371074680 /nfs/dbraw/zinc/07/46/80/371074680.db2.gz KDKSGGUGEUNJQN-ONEGZZNKSA-N 2 0 242.326 2.241 20 0 BEADRP CC1CC([NH2+]C[C@H]2CCCC[N@H+](C)C2)C1 ZINC000624121672 371322914 /nfs/dbraw/zinc/32/29/14/371322914.db2.gz ARLKEHGZLFFORK-OTTFEQOBSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)c1ccncc1 ZINC000624122646 371322994 /nfs/dbraw/zinc/32/29/94/371322994.db2.gz XNAKRCPUCLYEIP-UONOGXRCSA-N 2 0 247.386 2.464 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@]2(C)C[C@H]3C[C@H]3C2)CC1 ZINC000624198990 371388974 /nfs/dbraw/zinc/38/89/74/371388974.db2.gz DAYLOHKYCYZYAV-AGGWBTHJSA-N 2 0 236.403 2.497 20 0 BEADRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@H](CC)C(C)C ZINC000166017395 326427533 /nfs/dbraw/zinc/42/75/33/326427533.db2.gz YQDGLPSQOUULMJ-UONOGXRCSA-N 2 0 244.423 2.367 20 0 BEADRP Cc1cc(C)c(C[N@@H+]2CC[C@@](C)(C[NH3+])C2)c(C)n1 ZINC000631825155 372603601 /nfs/dbraw/zinc/60/36/01/372603601.db2.gz APRJKFAUDNVIKA-HNNXBMFYSA-N 2 0 247.386 2.178 20 0 BEADRP [NH3+][C@@H]1CCCCC[N@H+](CCCCCF)C1 ZINC000631834593 372621289 /nfs/dbraw/zinc/62/12/89/372621289.db2.gz BDAGNCNJBUNECL-GFCCVEGCSA-N 2 0 216.344 2.330 20 0 BEADRP FCCC1CC[NH+](CC[C@@H]2CCC[NH2+]C2)CC1 ZINC000631836676 372624778 /nfs/dbraw/zinc/62/47/78/372624778.db2.gz DYYMELYDFXCFAY-AWEZNQCLSA-N 2 0 242.382 2.448 20 0 BEADRP Cc1ccc(C)c(C[N@H+]2C[C@H](C)[C@H](C[NH3+])C2)c1 ZINC000631842734 372641193 /nfs/dbraw/zinc/64/11/93/372641193.db2.gz FBSGSNLGATZWEH-DZGCQCFKSA-N 2 0 232.371 2.330 20 0 BEADRP C([C@@H]1CC[NH2+]C1)[N@@H+]1CCC[C@@H](C2CCC2)CC1 ZINC000631873778 372675436 /nfs/dbraw/zinc/67/54/36/372675436.db2.gz WBCADJVWECMQBS-UKRRQHHQSA-N 2 0 236.403 2.498 20 0 BEADRP CC[C@@H](C[NH+]1CCC(CC[NH+](C)C)CC1)OC ZINC000412980993 205754261 /nfs/dbraw/zinc/75/42/61/205754261.db2.gz ZIVWVKGXRWSDCR-AWEZNQCLSA-N 2 0 242.407 2.075 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1C[C@H]1C1CCC1 ZINC000424381316 206039662 /nfs/dbraw/zinc/03/96/62/206039662.db2.gz YJXAVLUQEQUKPS-XDQVBPFNSA-N 2 0 222.376 2.282 20 0 BEADRP [NH3+]CC1CCC([NH2+][C@@H]2C[C@H]2C2CCC2)CC1 ZINC000424381690 206040082 /nfs/dbraw/zinc/04/00/82/206040082.db2.gz ZJQYUVIVLZPDLR-AKUTZHFWSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@@H]1[C@H]([NH2+]CCC[NH3+])C[C@H]1c1ccccc1 ZINC000437759644 206070588 /nfs/dbraw/zinc/07/05/88/206070588.db2.gz DOAWTWQHKXQQMK-IACUBPJLSA-N 2 0 218.344 2.117 20 0 BEADRP CCSCC[C@@H](C)[N@H+](C)CC1CC[NH2+]CC1 ZINC000178976801 134314277 /nfs/dbraw/zinc/31/42/77/134314277.db2.gz MGNWOQZJCMTOGY-GFCCVEGCSA-N 2 0 244.448 2.450 20 0 BEADRP C[C@@H]1CCC[C@H](C)C[N@H+]1CC1CC[NH2+]CC1 ZINC000178974102 134314279 /nfs/dbraw/zinc/31/42/79/134314279.db2.gz MGFOVQNMAVNECR-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP CCCC[C@@H](C)[NH2+]CCCC[NH+](C)C ZINC000045664034 168948690 /nfs/dbraw/zinc/94/86/90/168948690.db2.gz ZCYAFRACKSSCKC-GFCCVEGCSA-N 2 0 200.370 2.497 20 0 BEADRP CCCC[C@H](COC)[NH2+][C@H](C)Cn1ccnc1 ZINC000360044653 169004225 /nfs/dbraw/zinc/00/42/25/169004225.db2.gz GXJKXCBDHCRSHD-CHWSQXEVSA-N 2 0 239.363 2.066 20 0 BEADRP CCC[N@H+](CC)C[C@@H](C)Nc1cc[nH+]c(C)c1 ZINC000357773364 169125082 /nfs/dbraw/zinc/12/50/82/169125082.db2.gz GJWNCXOERBATPA-CYBMUJFWSA-N 2 0 235.375 2.344 20 0 BEADRP CCC[NH+]1CCC(C[NH2+]C[C@H]2C[C@H]2C)CC1 ZINC000336783190 169186407 /nfs/dbraw/zinc/18/64/07/169186407.db2.gz ZQXYQPPXAPHEFL-TZMCWYRMSA-N 2 0 224.392 2.354 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H]2CCC[C@H]2OC)CC1 ZINC000050368986 169189265 /nfs/dbraw/zinc/18/92/65/169189265.db2.gz VOOSSYBQRGGZPM-ZIAGYGMSSA-N 2 0 240.391 2.018 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H](C)C(C)(C)OC)CC1 ZINC000302322686 169190236 /nfs/dbraw/zinc/19/02/36/169190236.db2.gz CIZINFYFZQAXFO-LBPRGKRZSA-N 2 0 242.407 2.264 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H]2CCOC2(C)C)CC1 ZINC000328192790 169190434 /nfs/dbraw/zinc/19/04/34/169190434.db2.gz AYEWHAPSURSAHC-CYBMUJFWSA-N 2 0 240.391 2.018 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+]CCC(C)C)C1 ZINC000076453762 169206168 /nfs/dbraw/zinc/20/61/68/169206168.db2.gz QETFLROOSXLZSY-CYBMUJFWSA-N 2 0 212.381 2.354 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+]C[C@@H]2CCSC2)C1 ZINC000309942948 169206432 /nfs/dbraw/zinc/20/64/32/169206432.db2.gz CGXZLYTYHQSSOW-OLZOCXBDSA-N 2 0 242.432 2.061 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H]2CCC2(C)C)C1 ZINC000309946607 169207285 /nfs/dbraw/zinc/20/72/85/169207285.db2.gz DOXOSQANLWWOOE-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H]2C[C@@H](C)[C@@H]2C)C1 ZINC000309976881 169209432 /nfs/dbraw/zinc/20/94/32/169209432.db2.gz UBJWWFHJAFZJFP-XJFOESAGSA-N 2 0 224.392 2.352 20 0 BEADRP c1cc(C[NH2+]CCC[C@H]2CCC[NH2+]2)cs1 ZINC000336754638 183351004 /nfs/dbraw/zinc/35/10/04/183351004.db2.gz ILFYBDMADIWZKB-LBPRGKRZSA-N 2 0 224.373 2.370 20 0 BEADRP c1ccc(CCC[N@@H+]2CC[C@H]3C[NH2+]C[C@@H]3C2)cc1 ZINC000336786239 183392286 /nfs/dbraw/zinc/39/22/86/183392286.db2.gz BLSBULBRIMFOLM-JKSUJKDBSA-N 2 0 244.382 2.161 20 0 BEADRP CCCOc1cccc(C[NH2+]CCCC[NH3+])c1 ZINC000038038359 169324786 /nfs/dbraw/zinc/32/47/86/169324786.db2.gz KWMQXSDIGVFQMV-UHFFFAOYSA-N 2 0 236.359 2.304 20 0 BEADRP CCC[C@@H](C)[NH+]1CCC(C[NH+](C)C)CC1 ZINC000337342802 169366047 /nfs/dbraw/zinc/36/60/47/169366047.db2.gz WNSANXGJCKOXDO-GFCCVEGCSA-N 2 0 212.381 2.449 20 0 BEADRP CCC[C@@H](C)[NH2+]CC(C)(C)C[NH+](C)C ZINC000019905924 169369580 /nfs/dbraw/zinc/36/95/80/169369580.db2.gz DVSNGTXMEDYWGE-LLVKDONJSA-N 2 0 200.370 2.352 20 0 BEADRP CCC[C@@H](CC)[NH2+]C[C@@H]1CC[N@H+](CC)C1 ZINC000125230459 169379492 /nfs/dbraw/zinc/37/94/92/169379492.db2.gz DOHFINOLJHAOKA-QWHCGFSZSA-N 2 0 212.381 2.497 20 0 BEADRP CC[N@H+](CCC[NH+]1CCCC1)CC(C)C ZINC000179308131 134319106 /nfs/dbraw/zinc/31/91/06/134319106.db2.gz IETHLZHURMTCJT-UHFFFAOYSA-N 2 0 212.381 2.450 20 0 BEADRP CCC[C@@H](CC)[NH2+][C@H](C)CC[NH+](C)C ZINC000224613956 134349556 /nfs/dbraw/zinc/34/95/56/134349556.db2.gz WDWHDYDSAFOFPF-VXGBXAGGSA-N 2 0 200.370 2.495 20 0 BEADRP [NH3+]C[C@@H]1CC[N@H+](CCCC2CCCC2)C1 ZINC000226419700 134365755 /nfs/dbraw/zinc/36/57/55/134365755.db2.gz NDAGZHGCYBWEQL-ZDUSSCGKSA-N 2 0 210.365 2.237 20 0 BEADRP C[C@H]1CC[C@H]([NH2+]CC2(C)CC[NH+](C)CC2)C1 ZINC000227328963 134378000 /nfs/dbraw/zinc/37/80/00/134378000.db2.gz KLOCHTRTLXIZOI-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP C[NH2+]C1CC[NH+](C[C@H]2CCC(F)(F)C2)CC1 ZINC000301019916 383826935 /nfs/dbraw/zinc/82/69/35/383826935.db2.gz ZPNWYTKICVNANW-JTQLQIEISA-N 2 0 232.318 2.106 20 0 BEADRP [NH3+]CC[C@@H]1CCC[N@H+](Cc2ccsc2)C1 ZINC000069723901 383840877 /nfs/dbraw/zinc/84/08/77/383840877.db2.gz BFYOWBLOLJIMSU-NSHDSACASA-N 2 0 224.373 2.309 20 0 BEADRP [NH3+]CC[C@H]1CCC[N@H+](Cc2ccsc2)C1 ZINC000069723898 383841284 /nfs/dbraw/zinc/84/12/84/383841284.db2.gz BFYOWBLOLJIMSU-LLVKDONJSA-N 2 0 224.373 2.309 20 0 BEADRP C[C@]1(C[N@@H+]2CCCC(C)(C)C2)CC[NH2+]C1 ZINC000069794526 383844912 /nfs/dbraw/zinc/84/49/12/383844912.db2.gz GWRRDFXIQNEKCQ-ZDUSSCGKSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[NH2+]C1)c1cccs1 ZINC000087646196 383856425 /nfs/dbraw/zinc/85/64/25/383856425.db2.gz INIYIAWWOFTMKA-QWRGUYRKSA-N 2 0 224.373 2.398 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[NH2+]C1)c1cccs1 ZINC000087646191 383857375 /nfs/dbraw/zinc/85/73/75/383857375.db2.gz INIYIAWWOFTMKA-WDEREUQCSA-N 2 0 224.373 2.398 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CCc1cccs1 ZINC000308643655 383874285 /nfs/dbraw/zinc/87/42/85/383874285.db2.gz FSBGCQOBAJMLOC-SNVBAGLBSA-N 2 0 212.362 2.008 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+]C2CC[NH2+]CC2)s1 ZINC000049161921 383875528 /nfs/dbraw/zinc/87/55/28/383875528.db2.gz OUXNKJICTGUSJV-SNVBAGLBSA-N 2 0 224.373 2.459 20 0 BEADRP C[NH+](C)CC(C)(C)C[NH2+]C1CCSCC1 ZINC000035120821 383830168 /nfs/dbraw/zinc/83/01/68/383830168.db2.gz FFMDGDJJZCKWTC-UHFFFAOYSA-N 2 0 230.421 2.059 20 0 BEADRP [NH3+]CC[C@H]1CCC[N@H+](CC2CCCC2)C1 ZINC000070533446 383934607 /nfs/dbraw/zinc/93/46/07/383934607.db2.gz LNAOIVGFHGQXQY-CYBMUJFWSA-N 2 0 210.365 2.237 20 0 BEADRP C[C@H]1OCC[C@@H]1[NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000119892414 383913344 /nfs/dbraw/zinc/91/33/44/383913344.db2.gz KZUBRNOTIIBNDQ-PWSUYJOCSA-N 2 0 240.391 2.063 20 0 BEADRP CC1(C)CC([NH2+]CCC[NH+]2CCCC2)C1 ZINC000309127018 383932735 /nfs/dbraw/zinc/93/27/35/383932735.db2.gz QCETUEUQIOZJNC-UHFFFAOYSA-N 2 0 210.365 2.251 20 0 BEADRP Cc1cnccc1CC[NH2+][C@@H]1C[C@@H](C)O[C@@H](C)C1 ZINC000560113870 383905300 /nfs/dbraw/zinc/90/53/00/383905300.db2.gz NJXFTOUGEBYKGT-AGGWBTHJSA-N 2 0 248.370 2.478 20 0 BEADRP CO[C@@H]1CCC[C@@H]([NH2+]CCC[C@H]2CCC[NH2+]2)C1 ZINC000643541885 383941550 /nfs/dbraw/zinc/94/15/50/383941550.db2.gz KRPBQSSJBHQWAM-MGPQQGTHSA-N 2 0 240.391 2.066 20 0 BEADRP CO[C@@H]1CCC[C@H]([NH2+]CCC[C@H]2CCC[NH2+]2)C1 ZINC000643541883 383941676 /nfs/dbraw/zinc/94/16/76/383941676.db2.gz KRPBQSSJBHQWAM-HZSPNIEDSA-N 2 0 240.391 2.066 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CC[C@H]2C[C@H]2C1 ZINC000403339377 383948363 /nfs/dbraw/zinc/94/83/63/383948363.db2.gz IMDLCRGKSADQRM-HTOAHKCRSA-N 2 0 222.376 2.140 20 0 BEADRP Cc1ccc([C@H](C)[NH2+]CCC[NH2+]C2CC2)c(C)n1 ZINC000643545098 384008003 /nfs/dbraw/zinc/00/80/03/384008003.db2.gz PQKFJXBCLPMRAL-LBPRGKRZSA-N 2 0 247.386 2.491 20 0 BEADRP CC[C@@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)C1CC1 ZINC000643545970 384013663 /nfs/dbraw/zinc/01/36/63/384013663.db2.gz GOMWVZDBCXCGIX-QWHCGFSZSA-N 2 0 222.376 2.439 20 0 BEADRP C[C@@H]([NH3+])[C@@H]1CCC[N@H+](Cc2ccsc2)C1 ZINC000069627034 384051305 /nfs/dbraw/zinc/05/13/05/384051305.db2.gz ACIPRISQWRHXBB-ZYHUDNBSSA-N 2 0 224.373 2.307 20 0 BEADRP C[C@@H](Cc1ccoc1)[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000643547397 384033852 /nfs/dbraw/zinc/03/38/52/384033852.db2.gz DTWINHLYJVGBFH-JSGCOSHPSA-N 2 0 248.370 2.475 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000643549042 384038422 /nfs/dbraw/zinc/03/84/22/384038422.db2.gz ZJEOUXFIOBDNFN-UPJWGTAASA-N 2 0 222.376 2.439 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H]1CC[C@H](C)C1 ZINC000070748371 384135944 /nfs/dbraw/zinc/13/59/44/384135944.db2.gz CIAKVSYCOLMDBW-STQMWFEESA-N 2 0 212.381 2.497 20 0 BEADRP CC(C)CC[N@H+](C)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000040746517 384125654 /nfs/dbraw/zinc/12/56/54/384125654.db2.gz VZUHFPVHQGQLGI-FUNVUKJBSA-N 2 0 210.365 2.247 20 0 BEADRP C[C@H]([NH3+])C1CC[NH+](C[C@H]2CCC(F)(F)C2)CC1 ZINC000302377897 384152636 /nfs/dbraw/zinc/15/26/36/384152636.db2.gz HYIXJUNLOULTFB-QWRGUYRKSA-N 2 0 246.345 2.481 20 0 BEADRP Cc1ccc(C[NH2+]C[C@H]2CCC[NH2+]C2)s1 ZINC000050226769 384170164 /nfs/dbraw/zinc/17/01/64/384170164.db2.gz YZUKZCRYOOMNCL-NSHDSACASA-N 2 0 224.373 2.146 20 0 BEADRP C[C@H]([NH2+]C1CC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000132627330 384241390 /nfs/dbraw/zinc/24/13/90/384241390.db2.gz INAWFOBLRVKIOT-LBPRGKRZSA-N 2 0 248.370 2.440 20 0 BEADRP C[C@@H]([NH3+])[C@H](Cc1ccccc1)[NH2+]CCC1CC1 ZINC000422921991 384215782 /nfs/dbraw/zinc/21/57/82/384215782.db2.gz ROOWJUKWKDNAEV-DOMZBBRYSA-N 2 0 232.371 2.335 20 0 BEADRP CSCCC[N@H+](C)[C@H]1CCN(C)[C@@H](C)C1 ZINC000173527597 384225733 /nfs/dbraw/zinc/22/57/33/384225733.db2.gz FXDIFAZOSYUKDS-RYUDHWBXSA-N 2 0 230.421 2.154 20 0 BEADRP Cc1ccsc1C[NH2+]C[C@@H]1CCCN1C ZINC000163684549 384247590 /nfs/dbraw/zinc/24/75/90/384247590.db2.gz YNGCMOHJZUOENC-NSHDSACASA-N 2 0 224.373 2.240 20 0 BEADRP C[C@@H]1C[C@H](N(C)Cc2cccc(O)c2)CC[N@@H+]1C ZINC000093644761 384253143 /nfs/dbraw/zinc/25/31/43/384253143.db2.gz XOWUZAYHCKPZIB-TZMCWYRMSA-N 2 0 248.370 2.307 20 0 BEADRP C[C@@H]([NH3+])[C@H]1CCC[N@H+](CC2CCCC2)C1 ZINC000082645633 384253841 /nfs/dbraw/zinc/25/38/41/384253841.db2.gz YACRAAHCUORGQV-YPMHNXCESA-N 2 0 210.365 2.236 20 0 BEADRP CC[C@@](C)(C[NH2+]C[C@@H](C)C[NH+]1CCCC1)OC ZINC000319536617 384254606 /nfs/dbraw/zinc/25/46/06/384254606.db2.gz AXNBFQLWKBSQPC-KGLIPLIRSA-N 2 0 242.407 2.123 20 0 BEADRP COC1(C[N@@H+]2CCC[C@H](CC[NH3+])C2)CCCC1 ZINC000319509348 384256601 /nfs/dbraw/zinc/25/66/01/384256601.db2.gz XHWZKAIHUANNJL-CYBMUJFWSA-N 2 0 240.391 2.006 20 0 BEADRP C[C@H](NC[C@H]1CCC[NH2+]1)c1ccc(F)cc1 ZINC000235516152 384258395 /nfs/dbraw/zinc/25/83/95/384258395.db2.gz DHPRGVVCQDGMFA-GXFFZTMASA-N 2 0 222.307 2.228 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccc(F)cc3)C[C@H]21 ZINC000228471959 384258420 /nfs/dbraw/zinc/25/84/20/384258420.db2.gz CJUGFXOBRUGASE-NWANDNLSSA-N 2 0 248.345 2.385 20 0 BEADRP Cc1ccc(C[NH2+]C[C@H](C)C[NH+](C)C)s1 ZINC000291630797 384262005 /nfs/dbraw/zinc/26/20/05/384262005.db2.gz ANCFOIHVBZJIDX-JTQLQIEISA-N 2 0 226.389 2.344 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccsc3)C[C@H]21 ZINC000228537569 384274669 /nfs/dbraw/zinc/27/46/69/384274669.db2.gz XBSFAUXONVIAPO-JHJVBQTASA-N 2 0 236.384 2.307 20 0 BEADRP CCC[N@H+](CC[C@@H]1CCC[NH+]1C)C1CC1 ZINC000179422367 384289971 /nfs/dbraw/zinc/28/99/71/384289971.db2.gz VZPCDRCBSABSDQ-LBPRGKRZSA-N 2 0 210.365 2.345 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCC[N@@H+]2CCCC[C@H]2C)CO1 ZINC000401975651 384355597 /nfs/dbraw/zinc/35/55/97/384355597.db2.gz TYHVZPFCXWSQAL-MCIONIFRSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@@H]1CN(C)C[C@@H]1[NH2+]CC1CCCCCC1 ZINC000309736245 384357255 /nfs/dbraw/zinc/35/72/55/384357255.db2.gz CKOMRZAQUNXFRC-OCCSQVGLSA-N 2 0 224.392 2.497 20 0 BEADRP C[N@H+](CC[C@H]1CCC[NH+]1C)CC(C)(C)C ZINC000120497813 384357882 /nfs/dbraw/zinc/35/78/82/384357882.db2.gz FIXNWEYKALBDPE-GFCCVEGCSA-N 2 0 212.381 2.449 20 0 BEADRP CC(C)C[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000075835953 384358033 /nfs/dbraw/zinc/35/80/33/384358033.db2.gz IXGJBPWTMYVJNX-AWEZNQCLSA-N 2 0 224.392 2.450 20 0 BEADRP COc1cc(CN2CC[C@H]([NH3+])C[C@@H]2C)ccc1C ZINC000569619095 384364147 /nfs/dbraw/zinc/36/41/47/384364147.db2.gz OKUMDCDACQSCHM-JSGCOSHPSA-N 2 0 248.370 2.315 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@@H]2CC[C@H]2C)CC1 ZINC000308827255 384326602 /nfs/dbraw/zinc/32/66/02/384326602.db2.gz SMVXJYZLIVOENE-DGCLKSJQSA-N 2 0 210.365 2.247 20 0 BEADRP CCC[N@H+](CC[C@@H]1CC[NH2+]C1)CC1CC1 ZINC000084385210 384393120 /nfs/dbraw/zinc/39/31/20/384393120.db2.gz QSAFMYYGSGZHMB-LBPRGKRZSA-N 2 0 210.365 2.108 20 0 BEADRP Cc1cccc(NC[C@@]2(C)CCC[NH2+]C2)[nH+]1 ZINC000160005291 384375422 /nfs/dbraw/zinc/37/54/22/384375422.db2.gz WCHGANKDWLNLLP-ZDUSSCGKSA-N 2 0 219.332 2.192 20 0 BEADRP CC(C)[C@@H]1CCC[N@@H+]1CC[C@@H]1CC[NH2+]C1 ZINC000084386267 384391362 /nfs/dbraw/zinc/39/13/62/384391362.db2.gz DHVUDBOQQPPAHM-STQMWFEESA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@]1(C[N@@H+]2CCC[C@@H]2c2ccccn2)CC[NH2+]C1 ZINC000647513933 384428192 /nfs/dbraw/zinc/42/81/92/384428192.db2.gz VFSUKTQOSUAQAF-HUUCEWRRSA-N 2 0 245.370 2.218 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)CC(F)F ZINC000647227016 384437937 /nfs/dbraw/zinc/43/79/37/384437937.db2.gz MHPXLQQJUSHISC-QJPTWQEYSA-N 2 0 246.345 2.494 20 0 BEADRP CCCN(CC)CC[NH2+][C@H](C)C1(C)CC1 ZINC000122321793 384474738 /nfs/dbraw/zinc/47/47/38/384474738.db2.gz POUYLDCWXLJFKR-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP Cc1cc(C[NH2+]CCC[NH2+]C2CC2)ccc1F ZINC000228407875 134415012 /nfs/dbraw/zinc/41/50/12/134415012.db2.gz VTOBHFYBXBJNMN-UHFFFAOYSA-N 2 0 236.334 2.366 20 0 BEADRP COC(C)(C)[C@@H](C)[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000306054371 384513987 /nfs/dbraw/zinc/51/39/87/384513987.db2.gz XAQZVUJOQIIIHY-GFCCVEGCSA-N 2 0 242.407 2.262 20 0 BEADRP C[C@H]([NH2+]CC1=CC[N@H+](C)CC1)[C@H]1CC1(C)C ZINC000309568676 384527081 /nfs/dbraw/zinc/52/70/81/384527081.db2.gz MZZWRWWWEZDYFM-WCQYABFASA-N 2 0 222.376 2.273 20 0 BEADRP c1cncc(C[NH2+][C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)c1 ZINC000249919504 384530556 /nfs/dbraw/zinc/53/05/56/384530556.db2.gz UXJSDQVKUJMCPM-RRFJBIMHSA-N 2 0 245.370 2.092 20 0 BEADRP CN1CCC([NH2+]CC(C2CC2)C2CC2)CC1 ZINC000083894181 384542336 /nfs/dbraw/zinc/54/23/36/384542336.db2.gz NWGCRGCQKFYNEY-UHFFFAOYSA-N 2 0 222.376 2.106 20 0 BEADRP CCN(CC[NH3+])Cc1ccc(OC(C)C)cc1 ZINC000305914518 384551111 /nfs/dbraw/zinc/55/11/11/384551111.db2.gz APNDXNYRZMKSEI-UHFFFAOYSA-N 2 0 236.359 2.254 20 0 BEADRP C[NH+](C)CC(C)(C)C[NH2+]Cc1ccccc1 ZINC000019905902 384555429 /nfs/dbraw/zinc/55/54/29/384555429.db2.gz HWHYXMUGFHPMIM-UHFFFAOYSA-N 2 0 220.360 2.364 20 0 BEADRP CSC1(C[NH2+][C@H]2CCC[C@@H]([NH+](C)C)C2)CC1 ZINC000309728986 384560523 /nfs/dbraw/zinc/56/05/23/384560523.db2.gz ZABOWUIHRNPWNX-NWDGAFQWSA-N 2 0 242.432 2.344 20 0 BEADRP CC(C)[C@H](C)[NH2+]C[C@H]1CC[N@@H+](C(C)C)C1 ZINC000040621553 384590771 /nfs/dbraw/zinc/59/07/71/384590771.db2.gz AFXVSPFALRJPHW-QWHCGFSZSA-N 2 0 212.381 2.351 20 0 BEADRP CC(C)CC[C@@H](C)[NH2+]CCC[NH+](C)C ZINC000019959235 384564175 /nfs/dbraw/zinc/56/41/75/384564175.db2.gz BRVMVMCXQAVHRZ-GFCCVEGCSA-N 2 0 200.370 2.352 20 0 BEADRP CS[C@H](C)C[NH2+][C@@H]1CC[N@H+](C)[C@@H]2CCC[C@@H]21 ZINC000309721404 384567120 /nfs/dbraw/zinc/56/71/20/384567120.db2.gz WCJIQIRQHSKRIO-FDYHWXHSSA-N 2 0 242.432 2.200 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@H]2CCC[C@@H]3C[C@@H]32)C1 ZINC000568248684 384620887 /nfs/dbraw/zinc/62/08/87/384620887.db2.gz XWIVASLKZZZUOQ-BNDIWNMDSA-N 2 0 208.349 2.035 20 0 BEADRP CCC[C@@H]1[C@H](C)CCC[N@@H+]1CCC[NH2+]C ZINC000309852653 384671233 /nfs/dbraw/zinc/67/12/33/384671233.db2.gz YQEKRGJPOBHMKI-CHWSQXEVSA-N 2 0 212.381 2.497 20 0 BEADRP CCC[NH+]1CCC([NH2+]C[C@H]2CCCCO2)CC1 ZINC000042225567 384635636 /nfs/dbraw/zinc/63/56/36/384635636.db2.gz DSTZCKFAOZXSPJ-CQSZACIVSA-N 2 0 240.391 2.020 20 0 BEADRP C[NH+](C)C1CC[NH+](CC2(C)CCC2)CC1 ZINC000334482979 384638099 /nfs/dbraw/zinc/63/80/99/384638099.db2.gz XNFDRWXEVNOTCN-UHFFFAOYSA-N 2 0 210.365 2.203 20 0 BEADRP C([NH2+]C[C@@H]1CC[C@@H]2C[C@@H]2C1)[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000403385773 384644044 /nfs/dbraw/zinc/64/40/44/384644044.db2.gz QZCKMRSNDYFGMZ-BARDWOONSA-N 2 0 248.414 2.497 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[N@@H+]1CC[C@H]2CC[NH2+][C@@H]2C1 ZINC000647534854 384646329 /nfs/dbraw/zinc/64/63/29/384646329.db2.gz YAAYCYPJVHIZHV-KBUPBQIOSA-N 2 0 236.403 2.497 20 0 BEADRP C([NH2+]C[C@H]1CC[C@@H]2C[C@@H]2C1)[C@H]1CC[N@@H+](C2CC2)C1 ZINC000403385781 384647660 /nfs/dbraw/zinc/64/76/60/384647660.db2.gz QZCKMRSNDYFGMZ-YJNKXOJESA-N 2 0 248.414 2.497 20 0 BEADRP CC(C)[NH+](CCC[NH2+][C@H]1CO[C@@H](C)C1)C(C)C ZINC000647188931 384648582 /nfs/dbraw/zinc/64/85/82/384648582.db2.gz SAMRRBJUBPVUSJ-UONOGXRCSA-N 2 0 242.407 2.262 20 0 BEADRP CCC(CC)[N@H+](CCC[NH3+])CC(C)C ZINC000086453403 384650563 /nfs/dbraw/zinc/65/05/63/384650563.db2.gz TZKHHUMJMGLIIW-UHFFFAOYSA-N 2 0 200.370 2.482 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H]1CCCCC1(C)C ZINC000556934003 384661917 /nfs/dbraw/zinc/66/19/17/384661917.db2.gz BFLAAUHXNHKLPV-VXGBXAGGSA-N 2 0 212.381 2.400 20 0 BEADRP Cc1ccsc1C[N@H+]1CC[C@@H](C[NH+](C)C)C1 ZINC000125494675 384723789 /nfs/dbraw/zinc/72/37/89/384723789.db2.gz YQFBOLTZIWAPPZ-LBPRGKRZSA-N 2 0 238.400 2.440 20 0 BEADRP CC(F)(F)CC[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000357718319 384681887 /nfs/dbraw/zinc/68/18/87/384681887.db2.gz VUOHEWMHNYBVDU-WDEREUQCSA-N 2 0 232.318 2.248 20 0 BEADRP CC1(C[N@@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]C3)C2)CC1 ZINC000647542820 384703699 /nfs/dbraw/zinc/70/36/99/384703699.db2.gz CKOIFMOWLOMTAG-ZIAGYGMSSA-N 2 0 236.403 2.498 20 0 BEADRP C[N@H+](CCCC(C)(C)C)C1CC[NH2+]CC1 ZINC000300919804 384712675 /nfs/dbraw/zinc/71/26/75/384712675.db2.gz SYYNMZCQIRTWPQ-UHFFFAOYSA-N 2 0 212.381 2.497 20 0 BEADRP CC(C)(C)[C@H]1CCCC[C@@H]1[NH2+]CCOCC[NH3+] ZINC000357067666 384774395 /nfs/dbraw/zinc/77/43/95/384774395.db2.gz CVNJNTIBVDDFTD-STQMWFEESA-N 2 0 242.407 2.156 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)C1CCCC1 ZINC000054081319 384730828 /nfs/dbraw/zinc/73/08/28/384730828.db2.gz AQVGAELORJIDAU-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]([NH3+])c1ccc(N[C@H]2C[NH2+]C[C@@H](C)C2)cc1 ZINC000647546603 384732853 /nfs/dbraw/zinc/73/28/53/384732853.db2.gz RIPHRRMZVFBEOE-COPLHBTASA-N 2 0 233.359 2.116 20 0 BEADRP CC(C)C[C@H](CN)[NH2+][C@@H](C)CC(C)C ZINC000308457474 384733241 /nfs/dbraw/zinc/73/32/41/384733241.db2.gz FFHDFSNZBZLHPK-NWDGAFQWSA-N 2 0 200.370 2.384 20 0 BEADRP C[C@H]([NH3+])c1ccc(N[C@@H]2C[NH2+]C[C@@H](C)C2)cc1 ZINC000647546605 384734171 /nfs/dbraw/zinc/73/41/71/384734171.db2.gz RIPHRRMZVFBEOE-MJVIPROJSA-N 2 0 233.359 2.116 20 0 BEADRP CC[N@H+](CCCC[NH3+])Cc1ccccc1 ZINC000011953200 384734831 /nfs/dbraw/zinc/73/48/31/384734831.db2.gz IHNNFZLXVHEHIV-UHFFFAOYSA-N 2 0 206.333 2.247 20 0 BEADRP C[C@@H]([NH2+]C1CCCCCC1)[C@H]1CCC[NH2+]1 ZINC000335037242 384779331 /nfs/dbraw/zinc/77/93/31/384779331.db2.gz BSCWARQBJXOYQX-DGCLKSJQSA-N 2 0 210.365 2.439 20 0 BEADRP C[NH+](C)CCc1ccc(NCc2ncc[nH]2)cc1 ZINC000125720222 384745515 /nfs/dbraw/zinc/74/55/15/384745515.db2.gz IOMIAMGACZYQLZ-UHFFFAOYSA-N 2 0 244.342 2.126 20 0 BEADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](C)CC1 ZINC000103142833 384752677 /nfs/dbraw/zinc/75/26/77/384752677.db2.gz YWLVTWWCBLNMRN-UHFFFAOYSA-N 2 0 232.371 2.460 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]Cc1ccc2cnccc2c1 ZINC000647552277 384756678 /nfs/dbraw/zinc/75/66/78/384756678.db2.gz ORAZQCJKKCLVJT-RYUDHWBXSA-N 2 0 243.354 2.450 20 0 BEADRP C[NH+](C)CCC[NH2+][C@H]1CS[C@H](C(C)(C)C)C1 ZINC000309980457 384759773 /nfs/dbraw/zinc/75/97/73/384759773.db2.gz VYEUZAWHSGVHNM-NEPJUHHUSA-N 2 0 244.448 2.448 20 0 BEADRP C[NH+](C)CCC[NH2+]CCc1cccc(Cl)c1 ZINC000103269950 384760786 /nfs/dbraw/zinc/76/07/86/384760786.db2.gz LDCWGJAOHHWVNM-UHFFFAOYSA-N 2 0 240.778 2.424 20 0 BEADRP C[NH+](C)CCC[NH2+]Cc1cccc2cc[nH]c21 ZINC000083358360 384762542 /nfs/dbraw/zinc/76/25/42/384762542.db2.gz KFXZHUOSHQXACA-UHFFFAOYSA-N 2 0 231.343 2.209 20 0 BEADRP CC[NH+](CC)C[C@@H]1CCN(Cc2cccnc2)C1 ZINC000174208321 384766822 /nfs/dbraw/zinc/76/68/22/384766822.db2.gz ORHOFMVONSDQBI-HNNXBMFYSA-N 2 0 247.386 2.245 20 0 BEADRP CC[NH+](CC)C[C@H]1CCN(Cc2cccnc2)C1 ZINC000174208503 384767742 /nfs/dbraw/zinc/76/77/42/384767742.db2.gz ORHOFMVONSDQBI-OAHLLOKOSA-N 2 0 247.386 2.245 20 0 BEADRP CC(C)CC[NH2+][C@@H]1CC[N@H+](C)[C@H]2CCC[C@H]21 ZINC000375852034 384825086 /nfs/dbraw/zinc/82/50/86/384825086.db2.gz NBBOPOWNCLCSCR-MJBXVCDLSA-N 2 0 224.392 2.495 20 0 BEADRP COCC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000423359618 384831417 /nfs/dbraw/zinc/83/14/17/384831417.db2.gz DNBMDZLTHMHZQA-DGAVXFQQSA-N 2 0 240.391 2.051 20 0 BEADRP CCC([NH3+])(CC)C[NH2+][C@H]1CC[C@H]1C1CC1 ZINC000423289295 384781664 /nfs/dbraw/zinc/78/16/64/384781664.db2.gz ATJLNOUUCMEXHS-RYUDHWBXSA-N 2 0 210.365 2.282 20 0 BEADRP CCCC[C@H](COC)[NH2+]C[C@@H]1CC[N@H+](CC)C1 ZINC000163276673 384781739 /nfs/dbraw/zinc/78/17/39/384781739.db2.gz TVZCUCTWOKOXMN-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000423243973 384783825 /nfs/dbraw/zinc/78/38/25/384783825.db2.gz HAHPVDAOXQVEHR-AGIUHOORSA-N 2 0 210.365 2.010 20 0 BEADRP CCC1CC([NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)C1 ZINC000310013058 384784091 /nfs/dbraw/zinc/78/40/91/384784091.db2.gz JMTKCPPXYJJJGY-FKZOYECMSA-N 2 0 222.376 2.391 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000423243976 384785190 /nfs/dbraw/zinc/78/51/90/384785190.db2.gz HAHPVDAOXQVEHR-RWMBFGLXSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@]1(C[NH2+][C@H]2CC[C@@H]2C2CC2)CCC[NH2+]C1 ZINC000423332192 384801472 /nfs/dbraw/zinc/80/14/72/384801472.db2.gz HBTRLQJPUUISQR-RDBSUJKOSA-N 2 0 222.376 2.154 20 0 BEADRP CC(C)[C@H]1CC[C@H]1[NH2+]CC1(C)CC[NH2+]CC1 ZINC000423322936 384805886 /nfs/dbraw/zinc/80/58/86/384805886.db2.gz HONHFLIZPQOOTG-CHWSQXEVSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H]1CCSc2ccccc21 ZINC000309254522 384805979 /nfs/dbraw/zinc/80/59/79/384805979.db2.gz AFHWYLJEXYVGQC-PWSUYJOCSA-N 2 0 236.384 2.408 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+]CC1(C)CC[NH2+]CC1 ZINC000423322938 384807680 /nfs/dbraw/zinc/80/76/80/384807680.db2.gz HONHFLIZPQOOTG-QWHCGFSZSA-N 2 0 224.392 2.400 20 0 BEADRP C1CC1[C@@H]1CC[C@H]1[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000423437612 384871976 /nfs/dbraw/zinc/87/19/76/384871976.db2.gz MLNZXOKQJQKWKO-BYNSBNAKSA-N 2 0 234.387 2.153 20 0 BEADRP CS[C@@H]1CC[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000309843861 384873054 /nfs/dbraw/zinc/87/30/54/384873054.db2.gz FRZJGCDKIVRGRC-ZLOUSURVSA-N 2 0 240.416 2.095 20 0 BEADRP CC1CCC([NH2+]CCCN2CCC2)CC1 ZINC000516877808 384879549 /nfs/dbraw/zinc/87/95/49/384879549.db2.gz NKQRWDORRWCYIB-UHFFFAOYSA-N 2 0 210.365 2.251 20 0 BEADRP Fc1ccc2c(c1)[C@@H]([NH2+]C[C@H]1CCC[NH2+]C1)CC2 ZINC000335516219 384883170 /nfs/dbraw/zinc/88/31/70/384883170.db2.gz JEWCTRRVQBTQLG-NHYWBVRUSA-N 2 0 248.345 2.402 20 0 BEADRP C[C@@H]([NH2+]C[C@H](C)C[NH+](C)C)C(C)(C)C ZINC000308645540 384886754 /nfs/dbraw/zinc/88/67/54/384886754.db2.gz HJJUQGCDDDEWEE-WDEREUQCSA-N 2 0 200.370 2.208 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@@H]2C[C@@H](C)[C@H]2C)CC1 ZINC000309279147 384887273 /nfs/dbraw/zinc/88/72/73/384887273.db2.gz FFXSFYMFCPPWDM-YRGRVCCFSA-N 2 0 224.392 2.493 20 0 BEADRP C[C@@H](CCC1CC1)[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000398197582 384838994 /nfs/dbraw/zinc/83/89/94/384838994.db2.gz DFYCISKINUNFDU-WCQYABFASA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@H]([NH3+])C1)c1ccc(F)cn1 ZINC000423366752 384843059 /nfs/dbraw/zinc/84/30/59/384843059.db2.gz CFLGJIVJRLMHNO-ZMLRMANQSA-N 2 0 237.322 2.141 20 0 BEADRP C[N@H+]1CC=C(C[NH2+]C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC000403677727 384850531 /nfs/dbraw/zinc/85/05/31/384850531.db2.gz PLNXXFYURNBWPU-KFWWJZLASA-N 2 0 234.387 2.274 20 0 BEADRP CC[C@@H](C)[C@H](C[NH2+]C1CC[NH+](CC)CC1)OC ZINC000362976821 384862093 /nfs/dbraw/zinc/86/20/93/384862093.db2.gz MFJBAPFFUKWDSE-OCCSQVGLSA-N 2 0 242.407 2.121 20 0 BEADRP COc1ccc(C)cc1C[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000258950973 384956007 /nfs/dbraw/zinc/95/60/07/384956007.db2.gz IPFXHJDEXKLMTO-CYBMUJFWSA-N 2 0 248.370 2.093 20 0 BEADRP CC[C@@H](O)C[NH2+]CCCCC[NH+]1CCCCC1 ZINC000644558841 384957355 /nfs/dbraw/zinc/95/73/55/384957355.db2.gz JSIDMVVGGDSLME-CQSZACIVSA-N 2 0 242.407 2.003 20 0 BEADRP CCSCCC[NH2+][C@@H](C)CCCC[NH3+] ZINC000308646536 384894907 /nfs/dbraw/zinc/89/49/07/384894907.db2.gz HQZOXTOTGDQSBJ-NSHDSACASA-N 2 0 218.410 2.237 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@H]([NH3+])C[C@@H]2C)cc1 ZINC000049708893 384897327 /nfs/dbraw/zinc/89/73/27/384897327.db2.gz MMYZMMWCQQINKD-JSGCOSHPSA-N 2 0 218.344 2.307 20 0 BEADRP COc1ccc(C[N@@H+]2CC[C@@H]([NH3+])C[C@H]2C)cc1 ZINC000049707620 384898466 /nfs/dbraw/zinc/89/84/66/384898466.db2.gz DJYGJKUQAAIGTJ-DGCLKSJQSA-N 2 0 234.343 2.007 20 0 BEADRP COc1ccc(C)cc1CC[NH2+][C@@H]1CCC[C@@H]1[NH3+] ZINC000259239214 384958661 /nfs/dbraw/zinc/95/86/61/384958661.db2.gz YHQADCDHTLTGKP-UONOGXRCSA-N 2 0 248.370 2.016 20 0 BEADRP CC[C@H]([NH2+][C@@H](C)CN(C)C(C)C)[C@@H]1CCOC1 ZINC000310236584 384916832 /nfs/dbraw/zinc/91/68/32/384916832.db2.gz AJENJELJLLXGHH-MJBXVCDLSA-N 2 0 242.407 2.120 20 0 BEADRP CC[C@@H](O)C[NH2+]CCCC[N@@H+]1CCCC[C@H]1C ZINC000644522376 384927965 /nfs/dbraw/zinc/92/79/65/384927965.db2.gz QXRZLJLVOVPQAK-ZIAGYGMSSA-N 2 0 242.407 2.002 20 0 BEADRP CC[C@H]([NH2+]CCC[N@H+](C)C(C)C)[C@@H]1CCOC1 ZINC000336677884 384930080 /nfs/dbraw/zinc/93/00/80/384930080.db2.gz ACJJZFMAPUDDDQ-KGLIPLIRSA-N 2 0 242.407 2.121 20 0 BEADRP CSCC[C@@H](C)[N@H+](C)CC[C@@H]1CCC[NH2+]C1 ZINC000164183215 384935567 /nfs/dbraw/zinc/93/55/67/384935567.db2.gz IBLBEKZCDIDESR-OLZOCXBDSA-N 2 0 244.448 2.450 20 0 BEADRP C[NH+]1CCC(C)(C[NH2+][C@@H]2CCC2(C)C)CC1 ZINC000309302000 384946672 /nfs/dbraw/zinc/94/66/72/384946672.db2.gz MFSJYTRRZOFDIW-GFCCVEGCSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1cccc(C[NH2+]CC[C@@H]2CC[NH2+]C2)c1 ZINC000258875749 384947959 /nfs/dbraw/zinc/94/79/59/384947959.db2.gz BEJOVPAZAVCXIO-ZDUSSCGKSA-N 2 0 218.344 2.084 20 0 BEADRP C[C@H]([NH3+])C1CC[NH+](Cc2ccccc2)CC1 ZINC000058041088 384978020 /nfs/dbraw/zinc/97/80/20/384978020.db2.gz UJMMXMMSMIZNAX-LBPRGKRZSA-N 2 0 218.344 2.246 20 0 BEADRP Cc1ccc(C[NH2+]C[C@@H]2CCCN2C)cc1 ZINC000107778285 385000845 /nfs/dbraw/zinc/00/08/45/385000845.db2.gz BQIPHVHVXTYSQO-AWEZNQCLSA-N 2 0 218.344 2.179 20 0 BEADRP [NH3+][C@@H]1CCC[C@H](C[NH2+][C@H]2CC[C@@H]2C2CC2)C1 ZINC000423482537 385005391 /nfs/dbraw/zinc/00/53/91/385005391.db2.gz XYFDNBSUZCVXON-ASEORRQLSA-N 2 0 222.376 2.282 20 0 BEADRP [NH3+][C@@H]1CCC[C@H](C[NH2+][C@H]2CC[C@H]2C2CC2)C1 ZINC000423482539 385006576 /nfs/dbraw/zinc/00/65/76/385006576.db2.gz XYFDNBSUZCVXON-GHYVTOPFSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CCC(F)(F)F ZINC000308703849 385013225 /nfs/dbraw/zinc/01/32/25/385013225.db2.gz VXZYDHBCPKMJLI-MRVPVSSYSA-N 2 0 212.259 2.046 20 0 BEADRP C[C@H]([NH2+]C1CCCCC1)[C@H]1CCC[NH2+]C1 ZINC000129792237 385013712 /nfs/dbraw/zinc/01/37/12/385013712.db2.gz QZAHXWCKDGAGDS-RYUDHWBXSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CCCOc1ccccc1 ZINC000310303773 384962103 /nfs/dbraw/zinc/96/21/03/384962103.db2.gz UXTXTCQBVDFXCB-CYBMUJFWSA-N 2 0 236.359 2.173 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]1[NH2+]CCc1ccc(Cl)s1 ZINC000259152432 384963464 /nfs/dbraw/zinc/96/34/64/384963464.db2.gz VDAZURWAQQZTTB-UWVGGRQHSA-N 2 0 244.791 2.413 20 0 BEADRP COCc1cccc(C[NH2+][C@@H]2C[C@H]([NH3+])C2(C)C)c1 ZINC000404758039 385052592 /nfs/dbraw/zinc/05/25/92/385052592.db2.gz APZJHAXAENVOJD-UONOGXRCSA-N 2 0 248.370 2.048 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CCc1ccc(F)cc1 ZINC000310442621 385064339 /nfs/dbraw/zinc/06/43/39/385064339.db2.gz WDDVFTXWGKWVTQ-GFCCVEGCSA-N 2 0 238.350 2.475 20 0 BEADRP CC1(C)[C@H]([NH3+])C[C@@H]1[NH2+]CC1CCCCC1 ZINC000404783212 385064472 /nfs/dbraw/zinc/06/44/72/385064472.db2.gz DGZLXPPDWDQTFS-NEPJUHHUSA-N 2 0 210.365 2.282 20 0 BEADRP CC1(C)[C@H]([NH3+])C[C@@H]1[NH2+]CCCOc1ccccc1 ZINC000404784583 385064942 /nfs/dbraw/zinc/06/49/42/385064942.db2.gz PAFIFGKAVUOHQS-KGLIPLIRSA-N 2 0 248.370 2.171 20 0 BEADRP CCOc1ccc(C[N@@H+]2CC[C@H]([NH3+])[C@@H](C)C2)cc1 ZINC000227055208 385084860 /nfs/dbraw/zinc/08/48/60/385084860.db2.gz BTFFKLRFYNDOMV-WFASDCNBSA-N 2 0 248.370 2.254 20 0 BEADRP C[C@@H]1C[C@H](C[NH3+])CN1Cc1cc(F)cc(F)c1 ZINC000157114582 385079151 /nfs/dbraw/zinc/07/91/51/385079151.db2.gz LMVGBAQASXHWRH-MWLCHTKSSA-N 2 0 240.297 2.134 20 0 BEADRP CC[C@H](C)C[N@@H+]1C[C@H](C[NH3+])[C@@H](C)C[C@H]1C ZINC000397324450 385082443 /nfs/dbraw/zinc/08/24/43/385082443.db2.gz OFGFDTAYXTZXAB-RVMXOQNASA-N 2 0 212.381 2.338 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+][C@@H]1CCCC[NH2+]C1 ZINC000423567888 385028770 /nfs/dbraw/zinc/02/87/70/385028770.db2.gz VGLMBZKCAPEEFQ-FRRDWIJNSA-N 2 0 210.365 2.153 20 0 BEADRP C[N@H+](CCCF)[C@@H]1CCC[NH+](CCCF)CC1 ZINC000156986736 385038174 /nfs/dbraw/zinc/03/81/74/385038174.db2.gz PRIPDAVVWRXXJE-CYBMUJFWSA-N 2 0 248.361 2.492 20 0 BEADRP CO[C@H](C)[C@H](C)[NH2+]C[C@H](C)C[NH+]1CCCCC1 ZINC000129200348 385119475 /nfs/dbraw/zinc/11/94/75/385119475.db2.gz TWTNUQJEWRGBNN-MELADBBJSA-N 2 0 242.407 2.121 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+][C@@H]1CCC[C@H](C)[C@H]1C ZINC000300025267 385092848 /nfs/dbraw/zinc/09/28/48/385092848.db2.gz RASCYZZXWDVDSY-RFQIPJPRSA-N 2 0 242.407 2.155 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]CC1(C2CC2)CC1 ZINC000090773017 385093274 /nfs/dbraw/zinc/09/32/74/385093274.db2.gz FOXCHWRXMNTXEQ-MBNYWOFBSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@@H]([NH3+])[C@@H]1CC[N@H+](C[C@@H](C)c2ccccc2)C1 ZINC000227200527 385106609 /nfs/dbraw/zinc/10/66/09/385106609.db2.gz WAJVGTQPDLBEFU-UMVBOHGHSA-N 2 0 232.371 2.459 20 0 BEADRP Cc1ccoc1C[NH2+][C@H](C)CCCC[NH3+] ZINC000308821350 385192150 /nfs/dbraw/zinc/19/21/50/385192150.db2.gz GRPDCVSNNQXOFH-LLVKDONJSA-N 2 0 210.321 2.195 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]2)C1 ZINC000647479296 385150621 /nfs/dbraw/zinc/15/06/21/385150621.db2.gz AVRCXUDKDQWCCJ-SYQHCUMBSA-N 2 0 222.376 2.106 20 0 BEADRP [NH3+][C@@H]1CCCC[C@H]1[NH2+][C@H]1CC[C@H]1C1CC1 ZINC000424370895 385151384 /nfs/dbraw/zinc/15/13/84/385151384.db2.gz DXZOTCXVPJKDLM-QNWHQSFQSA-N 2 0 208.349 2.035 20 0 BEADRP C[C@H](C[C@H]1CCCCC[NH2+]1)[NH2+][C@@H]1CC12CC2 ZINC000424373918 385153667 /nfs/dbraw/zinc/15/36/67/385153667.db2.gz KFICGXOWJWLBKU-JHJVBQTASA-N 2 0 222.376 2.439 20 0 BEADRP C[C@@H]([NH2+]C[C@H](C)C[NH+]1CCCC1)c1ccncc1 ZINC000062077887 385154015 /nfs/dbraw/zinc/15/40/15/385154015.db2.gz GCOLSOMOVMLPGT-UONOGXRCSA-N 2 0 247.386 2.464 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H]2CC23CC3)CC1 ZINC000424331608 385168585 /nfs/dbraw/zinc/16/85/85/385168585.db2.gz VNIVZLSDFVWKFD-GFCCVEGCSA-N 2 0 208.349 2.003 20 0 BEADRP CCOC[C@@H](C)[NH2+]CCC[N@@H+]1CCCC[C@H]1C ZINC000252709043 385178511 /nfs/dbraw/zinc/17/85/11/385178511.db2.gz BWEAWHYGZOGJIB-ZIAGYGMSSA-N 2 0 242.407 2.266 20 0 BEADRP CCCC[C@H](C)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000044533294 385208954 /nfs/dbraw/zinc/20/89/54/385208954.db2.gz HGYXWFGDEOULSL-STQMWFEESA-N 2 0 212.381 2.497 20 0 BEADRP C[C@H](C[NH2+][C@@H](C)[C@H]1CC1(C)C)C[NH+](C)C ZINC000308881014 385235488 /nfs/dbraw/zinc/23/54/88/385235488.db2.gz UJVFUTQTIYIFQT-GRYCIOLGSA-N 2 0 212.381 2.208 20 0 BEADRP C[N@H+]1CC=C(C[NH2+][C@@H]2CCC2(C)C)CC1 ZINC000308950226 385311987 /nfs/dbraw/zinc/31/19/87/385311987.db2.gz OWUPLNSRBKJBKC-GFCCVEGCSA-N 2 0 208.349 2.027 20 0 BEADRP C[NH+](C)CCCC[NH2+]C[C@@H]1CC=CCC1 ZINC000045663777 385274117 /nfs/dbraw/zinc/27/41/17/385274117.db2.gz LASKBHAUEPNWNI-CYBMUJFWSA-N 2 0 210.365 2.274 20 0 BEADRP C[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000034264455 385275359 /nfs/dbraw/zinc/27/53/59/385275359.db2.gz FOSNQWWFKGJNOZ-AWEZNQCLSA-N 2 0 218.344 2.070 20 0 BEADRP CC(C)N(C)CC[NH2+]C1CC2(CCC2)C1 ZINC000308980620 385322740 /nfs/dbraw/zinc/32/27/40/385322740.db2.gz IAOYMAPLNLZRLW-UHFFFAOYSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)C1(C)CC1 ZINC000037485298 385302216 /nfs/dbraw/zinc/30/22/16/385302216.db2.gz BTKOKAVPNQUBFC-NEPJUHHUSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H]1CCCc2sccc21 ZINC000308976459 385329181 /nfs/dbraw/zinc/32/91/81/385329181.db2.gz IPUOYGCWHAPBCK-KOLCDFICSA-N 2 0 224.373 2.310 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@@H]([C@H](C)[NH3+])C2)c(C)c1 ZINC000228149002 385347492 /nfs/dbraw/zinc/34/74/92/385347492.db2.gz LLTNFRPXZNJWMF-DZGCQCFKSA-N 2 0 232.371 2.473 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@@H]([C@H](C)[NH3+])C2)cc1C ZINC000228152727 385348914 /nfs/dbraw/zinc/34/89/14/385348914.db2.gz PRCNGZXCSUWUII-DZGCQCFKSA-N 2 0 232.371 2.473 20 0 BEADRP C[NH+](C)CCC[NH2+][C@@H]1CCCNc2ccccc21 ZINC000192593044 385364639 /nfs/dbraw/zinc/36/46/39/385364639.db2.gz ZCIHTLFBUXAXNH-OAHLLOKOSA-N 2 0 247.386 2.475 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]C[C@]1(C)CCCS1 ZINC000309019305 385372577 /nfs/dbraw/zinc/37/25/77/385372577.db2.gz STLMVNQUEMKNNU-RYUDHWBXSA-N 2 0 230.421 2.379 20 0 BEADRP CC(C)C1(C[NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)CC1 ZINC000181263086 385404475 /nfs/dbraw/zinc/40/44/75/385404475.db2.gz DKPQENVAVJJFCJ-QWHCGFSZSA-N 2 0 224.392 2.495 20 0 BEADRP CC(C)C1(C[NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)CC1 ZINC000181263099 385405320 /nfs/dbraw/zinc/40/53/20/385405320.db2.gz DKPQENVAVJJFCJ-OLZOCXBDSA-N 2 0 224.392 2.495 20 0 BEADRP COCCC(C)(C)C[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000183934435 385483313 /nfs/dbraw/zinc/48/33/13/385483313.db2.gz GNTQCZBBKZQHNI-CHWSQXEVSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H]([NH2+]CCC1CC[NH+](C)CC1)c1ccncc1 ZINC000156611637 385460112 /nfs/dbraw/zinc/46/01/12/385460112.db2.gz ZYODZQDIFWKBIC-CYBMUJFWSA-N 2 0 247.386 2.464 20 0 BEADRP CC(C)(C)CCC[N@@H+]1CC[C@H]2[NH2+]CC[C@H]2C1 ZINC000309290353 385515209 /nfs/dbraw/zinc/51/52/09/385515209.db2.gz PZVUZXYRHMXSLG-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)(C)CCC[N@@H+]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000309339104 385538972 /nfs/dbraw/zinc/53/89/72/385538972.db2.gz KGRPNFROILTXGK-STQMWFEESA-N 2 0 224.392 2.354 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CC[C@H]1CCCCO1 ZINC000309356526 385547974 /nfs/dbraw/zinc/54/79/74/385547974.db2.gz NLFLWETVPPJVBG-CHWSQXEVSA-N 2 0 228.380 2.053 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H](C)c1cccc(O)c1 ZINC000336649816 385594734 /nfs/dbraw/zinc/59/47/34/385594734.db2.gz HBLUCWYFFVIUTH-MNOVXSKESA-N 2 0 222.332 2.170 20 0 BEADRP C[C@@H]([NH2+]CCC[NH+]1CCCC1)[C@@H]1CC1(C)C ZINC000309444123 385584304 /nfs/dbraw/zinc/58/43/04/385584304.db2.gz KXKPWEVJLZHUNY-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H](C[NH2+]C[C@@H]1CCC[NH2+]1)Cc1ccccc1 ZINC000414849125 385614478 /nfs/dbraw/zinc/61/44/78/385614478.db2.gz QQQKQQVYSCCJSL-HIFRSBDPSA-N 2 0 232.371 2.207 20 0 BEADRP C[C@H](C[NH2+]C[C@@H]1CCC[NH2+]1)Cc1ccccc1 ZINC000414849128 385614655 /nfs/dbraw/zinc/61/46/55/385614655.db2.gz QQQKQQVYSCCJSL-ZFWWWQNUSA-N 2 0 232.371 2.207 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H](C)CCC(C)C ZINC000414849301 385624935 /nfs/dbraw/zinc/62/49/35/385624935.db2.gz XYWVNZCDJZGWSU-NEPJUHHUSA-N 2 0 200.370 2.256 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]Cc1ccc(F)c(C)c1 ZINC000414849680 385628100 /nfs/dbraw/zinc/62/81/00/385628100.db2.gz YADWQMRVYLHYPW-JTQLQIEISA-N 2 0 224.323 2.079 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CCC[C@@H](C)[C@H]1C ZINC000414849768 385629193 /nfs/dbraw/zinc/62/91/93/385629193.db2.gz YNPNLMCOVZJLQZ-UMSGYPCISA-N 2 0 212.381 2.256 20 0 BEADRP C(C[NH2+][C@H]1CCC12CCC2)C[NH+]1CCCC1 ZINC000336683581 385647711 /nfs/dbraw/zinc/64/77/11/385647711.db2.gz SJQJNYQYBWHMQO-ZDUSSCGKSA-N 2 0 222.376 2.395 20 0 BEADRP CC[C@@H](C)C[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000336734246 385662171 /nfs/dbraw/zinc/66/21/71/385662171.db2.gz KRZICLDNYSAEQH-GFCCVEGCSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]CCC1CCCCC1 ZINC000414852345 385675336 /nfs/dbraw/zinc/67/53/36/385675336.db2.gz RAJOUOTYZMMAPE-GFCCVEGCSA-N 2 0 212.381 2.402 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]C[C@@H](C)CC(C)C ZINC000414853097 385681676 /nfs/dbraw/zinc/68/16/76/385681676.db2.gz RTDPPQPTILGKGH-NWDGAFQWSA-N 2 0 200.370 2.114 20 0 BEADRP C([NH2+][C@H]1CCCC[C@@H]1C1CC1)[C@@H]1CCC[NH2+]1 ZINC000414853787 385690448 /nfs/dbraw/zinc/69/04/48/385690448.db2.gz YCKAIYSETACBFS-MJBXVCDLSA-N 2 0 222.376 2.297 20 0 BEADRP Cc1occc1C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000647793096 385700352 /nfs/dbraw/zinc/70/03/52/385700352.db2.gz KMMAGVUBJUFSMV-BFHYXJOUSA-N 2 0 234.343 2.066 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@H](c1ccccc1)C1CC1 ZINC000336688914 385706648 /nfs/dbraw/zinc/70/66/48/385706648.db2.gz VWUNXRXGOFEUTB-SMDDNHRTSA-N 2 0 218.344 2.322 20 0 BEADRP CC(C)OC[C@@H](C)[NH2+]CCC[N@H+](C)C(C)C ZINC000309579221 385711446 /nfs/dbraw/zinc/71/14/46/385711446.db2.gz PWEWSLGBHJYDJE-CYBMUJFWSA-N 2 0 230.396 2.120 20 0 BEADRP CCCC[C@H](COC)[NH2+][C@H](CN)CC(C)C ZINC000414856405 385711690 /nfs/dbraw/zinc/71/16/90/385711690.db2.gz YXUULHHYEOLDFX-OLZOCXBDSA-N 2 0 230.396 2.155 20 0 BEADRP CC[N@H+](CCCn1ccnc1C)C(C)C ZINC000270712261 385732059 /nfs/dbraw/zinc/73/20/59/385732059.db2.gz ZYEXMQOLYMXPEV-UHFFFAOYSA-N 2 0 209.337 2.312 20 0 BEADRP COc1ccc(C[NH2+][C@H](C)[C@@H]2CCC[NH2+]C2)cc1 ZINC000414858354 385734375 /nfs/dbraw/zinc/73/43/75/385734375.db2.gz RMXJDRWSTUXOOQ-TZMCWYRMSA-N 2 0 248.370 2.173 20 0 BEADRP COc1ccc(C[NH2+][C@@H](C)[C@@H]2CCC[NH2+]C2)cc1 ZINC000414858351 385735086 /nfs/dbraw/zinc/73/50/86/385735086.db2.gz RMXJDRWSTUXOOQ-GXTWGEPZSA-N 2 0 248.370 2.173 20 0 BEADRP [NH3+]C1(C[NH2+]C[C@@H]2CCCOC2)CCCCCC1 ZINC000414858921 385735164 /nfs/dbraw/zinc/73/51/64/385735164.db2.gz LNYKTTXFUQQXKB-ZDUSSCGKSA-N 2 0 240.391 2.054 20 0 BEADRP Cc1ccc(C[NH2+][C@H](C)[C@H]2CCC[NH2+]C2)cc1 ZINC000414858579 385736212 /nfs/dbraw/zinc/73/62/12/385736212.db2.gz SAVIIHZESYJWGW-HIFRSBDPSA-N 2 0 232.371 2.473 20 0 BEADRP CC(C)C[C@@H]([NH3+])CNCC1([NH3+])CCCCCC1 ZINC000414858455 385736340 /nfs/dbraw/zinc/73/63/40/385736340.db2.gz JKTPIFBAODUGJG-CYBMUJFWSA-N 2 0 241.423 2.001 20 0 BEADRP CC[NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185709240 385736468 /nfs/dbraw/zinc/73/64/68/385736468.db2.gz AGFMLAUXFKWXCB-NWDGAFQWSA-N 2 0 210.365 2.249 20 0 BEADRP CC[C@@H]1CCC[C@@H](C[NH2+]CCC[NH2+]C)C1 ZINC000414859802 385738394 /nfs/dbraw/zinc/73/83/94/385738394.db2.gz NXECSKXEWXHLQI-CHWSQXEVSA-N 2 0 212.381 2.402 20 0 BEADRP FC(F)CN(CCCn1ccnc1)C1CC1 ZINC000183176643 385739737 /nfs/dbraw/zinc/73/97/37/385739737.db2.gz LWWCFYCGWOLIOX-UHFFFAOYSA-N 2 0 229.274 2.003 20 0 BEADRP CC1(C)CC(C[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)C1 ZINC000647794999 385742120 /nfs/dbraw/zinc/74/21/20/385742120.db2.gz HNAPOYJXRVIWKK-HZSPNIEDSA-N 2 0 236.403 2.400 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)CCC2CC2)C1 ZINC000186255261 385751638 /nfs/dbraw/zinc/75/16/38/385751638.db2.gz HRAVQMJECHFJET-GXTWGEPZSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H](C)CCCC(C)C ZINC000414861591 385753233 /nfs/dbraw/zinc/75/32/33/385753233.db2.gz SCYOVCSVZPDRDT-LBPRGKRZSA-N 2 0 200.370 2.400 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+]CC1([NH3+])CCCCCC1 ZINC000414862564 385756305 /nfs/dbraw/zinc/75/63/05/385756305.db2.gz VJXFDHWXSVQZLG-VXGBXAGGSA-N 2 0 210.365 2.284 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1C[C@H](C)CC(C)(C)C1 ZINC000414864533 385763621 /nfs/dbraw/zinc/76/36/21/385763621.db2.gz ZJQCHLXNUPZNCA-NWDGAFQWSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H](C[NH2+][C@@H]1CCC[C@@H](C)C1)C[NH+](C)C ZINC000336655853 385766970 /nfs/dbraw/zinc/76/69/70/385766970.db2.gz ABWPWNHMHVEWOJ-FRRDWIJNSA-N 2 0 212.381 2.352 20 0 BEADRP CC(C)[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[NH2+]C[C@@H]1C ZINC000414944867 385784086 /nfs/dbraw/zinc/78/40/86/385784086.db2.gz QORUWWDPXWGEBD-FQUUOJAGSA-N 2 0 224.392 2.399 20 0 BEADRP CC(C)[C@@H]1CCC[C@@H]1[NH2+][C@H]1CC[NH2+]C[C@@H]1C ZINC000414944872 385785027 /nfs/dbraw/zinc/78/50/27/385785027.db2.gz QORUWWDPXWGEBD-XUXIUFHCSA-N 2 0 224.392 2.399 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1CCC[C@@H](C2CC2)C1 ZINC000414856877 385719050 /nfs/dbraw/zinc/71/90/50/385719050.db2.gz BENJJTNYAJBOFR-CHWSQXEVSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@@H](C)CC(F)F ZINC000647800459 385806513 /nfs/dbraw/zinc/80/65/13/385806513.db2.gz BNLSTIFIFHXZAH-VHSXEESVSA-N 2 0 222.323 2.385 20 0 BEADRP C[C@@H](C[NH2+][C@H]1CCC(C)(C)C1)C[NH+](C)C ZINC000336713389 385806568 /nfs/dbraw/zinc/80/65/68/385806568.db2.gz VLRRGEPZQAKKME-RYUDHWBXSA-N 2 0 212.381 2.352 20 0 BEADRP CC[C@H]([NH2+]C[C@H](C)CC(F)F)[C@@H]1CCC[NH2+]1 ZINC000647801126 385811112 /nfs/dbraw/zinc/81/11/12/385811112.db2.gz OQRRPFJTOQDGBI-VWYCJHECSA-N 2 0 234.334 2.398 20 0 BEADRP CC[C@H]([NH2+]C[C@@H](C)CC(F)F)[C@@H]1CCC[NH2+]1 ZINC000647801124 385811555 /nfs/dbraw/zinc/81/15/55/385811555.db2.gz OQRRPFJTOQDGBI-DCAQKATOSA-N 2 0 234.334 2.398 20 0 BEADRP C[C@@H]([NH2+]C[C@@H](C)CC(F)F)[C@H]1CCC[NH2+]1 ZINC000647801556 385811721 /nfs/dbraw/zinc/81/17/21/385811721.db2.gz YHJIKSWIJOICPY-IVZWLZJFSA-N 2 0 220.307 2.008 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[NH2+]CC[C@H]1C)CC(F)F ZINC000647801454 385811833 /nfs/dbraw/zinc/81/18/33/385811833.db2.gz WDLZWMHOBGPAAW-HBNTYKKESA-N 2 0 234.334 2.255 20 0 BEADRP CCC[NH2+]CC[NH2+]C[C@H]1CCCC[C@H]1C ZINC000414868188 385814520 /nfs/dbraw/zinc/81/45/20/385814520.db2.gz JPZJPBUPOPFFFN-CHWSQXEVSA-N 2 0 212.381 2.402 20 0 BEADRP C[C@@H]1C[C@H]1C[NH2+]Cc1ccc(C[NH+](C)C)cc1 ZINC000340172932 385819131 /nfs/dbraw/zinc/81/91/31/385819131.db2.gz DHFCSXUJOLOFSA-DOMZBBRYSA-N 2 0 232.371 2.494 20 0 BEADRP CC(C)[N@@H+]1CC[C@@H](C)[C@H](n2ccnc2)C1 ZINC000271346849 385819936 /nfs/dbraw/zinc/81/99/36/385819936.db2.gz XVOVMQNCEHJZQP-VXGBXAGGSA-N 2 0 207.321 2.174 20 0 BEADRP Cc1sccc1CN1C[C@@H]2C[N@H+](C)C[C@@H]2C1 ZINC000294246911 385828066 /nfs/dbraw/zinc/82/80/66/385828066.db2.gz AELMVDDNDOLXIX-BETUJISGSA-N 2 0 236.384 2.050 20 0 BEADRP COc1ccccc1C1([NH2+][C@@H](C)C[C@@H](C)[NH3+])CC1 ZINC000647802045 385834236 /nfs/dbraw/zinc/83/42/36/385834236.db2.gz CMCJAQVUYDANRC-NEPJUHHUSA-N 2 0 248.370 2.400 20 0 BEADRP COc1cc(C[NH2+][C@H]2CC[NH2+][C@H](C)C2)ccc1C ZINC000414954132 385835124 /nfs/dbraw/zinc/83/51/24/385835124.db2.gz SIATZFMATPXACP-OCCSQVGLSA-N 2 0 248.370 2.234 20 0 BEADRP C[NH2+]Cc1cccc(NC2CCC([NH3+])CC2)c1 ZINC000414869489 385836485 /nfs/dbraw/zinc/83/64/85/385836485.db2.gz QKGMNEXYOUATJA-UHFFFAOYSA-N 2 0 233.359 2.088 20 0 BEADRP C[C@@H](CCC(F)(F)F)[NH2+][C@@H]1CC[NH2+][C@H](C)C1 ZINC000414955467 385836641 /nfs/dbraw/zinc/83/66/41/385836641.db2.gz UHYKELUTEWLRJY-IVZWLZJFSA-N 2 0 238.297 2.448 20 0 BEADRP C[C@@H](CCC(F)(F)F)[NH2+][C@H]1CC[NH2+][C@H](C)C1 ZINC000414955464 385837046 /nfs/dbraw/zinc/83/70/46/385837046.db2.gz UHYKELUTEWLRJY-AEJSXWLSSA-N 2 0 238.297 2.448 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H]1C[C@H](c2ccccc2)[C@H]1C ZINC000414869626 385838388 /nfs/dbraw/zinc/83/83/88/385838388.db2.gz AYVDMCVRONKYEU-RJZRQDKASA-N 2 0 232.371 2.363 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+][C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000647804800 385838539 /nfs/dbraw/zinc/83/85/39/385838539.db2.gz ZNWYDMPJDZWSRL-KSTCHIGDSA-N 2 0 222.376 2.153 20 0 BEADRP CO[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(C[NH3+])cc2)C1 ZINC000647803232 385839234 /nfs/dbraw/zinc/83/92/34/385839234.db2.gz OVUYGXMHPNSSKD-HUUCEWRRSA-N 2 0 248.370 2.193 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+]CC1CCC(F)CC1 ZINC000647804639 385839278 /nfs/dbraw/zinc/83/92/78/385839278.db2.gz WHYGTOXMOPHGRS-GFJIZPEISA-N 2 0 242.382 2.492 20 0 BEADRP CC[C@H]([NH2+][C@H]1CCS[C@@H]1C)[C@@H]1CCC[NH2+]1 ZINC000647804568 385840251 /nfs/dbraw/zinc/84/02/51/385840251.db2.gz UZQRBUMVNPNLTJ-RHYQMDGZSA-N 2 0 228.405 2.001 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H](C)CCc1ccc(F)cc1 ZINC000414869852 385840378 /nfs/dbraw/zinc/84/03/78/385840378.db2.gz BHNHYHFEAUOYHZ-VXGBXAGGSA-N 2 0 238.350 2.331 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[C@H]2C[C@H]2C1)[C@@H]1CCC[NH2+]1 ZINC000647804007 385840395 /nfs/dbraw/zinc/84/03/95/385840395.db2.gz HOYGYSGSYQFBFD-HPCHECBXSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@H]([NH2+]CCN1CCCCC1)[C@@H]1CC1(C)C ZINC000336741042 385846658 /nfs/dbraw/zinc/84/66/58/385846658.db2.gz MVSGRZQHDYYGDL-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP CCC[C@H](C[N@H+](C)[C@@H]1CCN(C)[C@@H](C)C1)OC ZINC000638115760 385851947 /nfs/dbraw/zinc/85/19/47/385851947.db2.gz FYYOFSZPRHDMAM-BFHYXJOUSA-N 2 0 242.407 2.216 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CC2([NH3+])CCC2)C[C@H]1C ZINC000414870848 385852713 /nfs/dbraw/zinc/85/27/13/385852713.db2.gz CREZVGNJRXDANR-UTUOFQBUSA-N 2 0 210.365 2.282 20 0 BEADRP CSCCCCC[NH2+][C@@H]1CC[N@H+](C)C[C@@H]1C ZINC000309689610 385791591 /nfs/dbraw/zinc/79/15/91/385791591.db2.gz ISMFLIFWMSACGS-QWHCGFSZSA-N 2 0 244.448 2.450 20 0 BEADRP CC[C@H](COC)[NH2+]CCCCC[NH+]1CCCC1 ZINC000340476550 385886121 /nfs/dbraw/zinc/88/61/21/385886121.db2.gz RZSPDQBGXYBFKT-CQSZACIVSA-N 2 0 242.407 2.267 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+]C1C[C@@H](C)C[C@H](C)C1 ZINC000414962900 385888181 /nfs/dbraw/zinc/88/81/81/385888181.db2.gz SUMOAJJIMCUDMP-SDDRHHMPSA-N 2 0 212.381 2.399 20 0 BEADRP CCc1cccc(F)c1C[NH2+]C[C@H](C)C[NH3+] ZINC000414874787 385889555 /nfs/dbraw/zinc/88/95/55/385889555.db2.gz JEABFHSONIPVGU-SNVBAGLBSA-N 2 0 224.323 2.073 20 0 BEADRP CC[NH2+]Cc1cccc(NC2CCC([NH3+])CC2)c1 ZINC000414874505 385890097 /nfs/dbraw/zinc/89/00/97/385890097.db2.gz YJESQOFTYCMPLR-UHFFFAOYSA-N 2 0 247.386 2.478 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+]C/C=C\c1ccc(F)cc1 ZINC000414964269 385904218 /nfs/dbraw/zinc/90/42/18/385904218.db2.gz UQGMCOZCQFWLTN-IZIWTHDTSA-N 2 0 248.345 2.427 20 0 BEADRP C[C@@H](Cc1ccccc1F)[NH2+]CC1([NH3+])CCC1 ZINC000414876394 385906661 /nfs/dbraw/zinc/90/66/61/385906661.db2.gz LHZXDJVSSXOSOB-NSHDSACASA-N 2 0 236.334 2.228 20 0 BEADRP C[C@H](CC[NH3+])[NH2+]Cc1ccc(F)c2cccnc12 ZINC000414876796 385916105 /nfs/dbraw/zinc/91/61/05/385916105.db2.gz DXWKHSYDJYJOOE-SNVBAGLBSA-N 2 0 247.317 2.201 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@@H]1CC[C@H](C)[C@@H](C)C1 ZINC000414966321 385919967 /nfs/dbraw/zinc/91/99/67/385919967.db2.gz WIEMTSDYAROIND-WUHRBBMRSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CC2([NH3+])CCC2)[C@@H](C)C1 ZINC000414877728 385929968 /nfs/dbraw/zinc/92/99/68/385929968.db2.gz NCVVMVCGGUNXIT-GRYCIOLGSA-N 2 0 210.365 2.282 20 0 BEADRP Fc1ccc(C[NH2+]CCC[C@H]2CCC[NH2+]2)cc1 ZINC000414966563 385921983 /nfs/dbraw/zinc/92/19/83/385921983.db2.gz GTDQGPHCFYPDOJ-AWEZNQCLSA-N 2 0 236.334 2.448 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+]CC1(C)CCC1 ZINC000335034027 385923033 /nfs/dbraw/zinc/92/30/33/385923033.db2.gz STUAYAFNUJSHHW-RYUDHWBXSA-N 2 0 210.365 2.154 20 0 BEADRP C([NH2+][C@@H]1CCC12CCCC2)[C@H]1CCC[NH2+]1 ZINC000335034820 385923063 /nfs/dbraw/zinc/92/30/63/385923063.db2.gz YMGOIHHGCVJRMY-VXGBXAGGSA-N 2 0 208.349 2.051 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+][C@H]1CCc2ccccc2C1 ZINC000250840166 385926892 /nfs/dbraw/zinc/92/68/92/385926892.db2.gz DUKTYZWRNQUQGG-JYJNAYRXSA-N 2 0 244.382 2.261 20 0 BEADRP CC1(C[NH2+][C@H]2CCCCC[C@H]2[NH3+])CCOCC1 ZINC000335038134 385927648 /nfs/dbraw/zinc/92/76/48/385927648.db2.gz HCAZAQJUWDEHRI-OLZOCXBDSA-N 2 0 240.391 2.053 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+]Cc1ccsc1 ZINC000335037575 385927885 /nfs/dbraw/zinc/92/78/85/385927885.db2.gz FDLJJAVYSOIFOF-CMPLNLGQSA-N 2 0 224.373 2.226 20 0 BEADRP C[N@H+]1CC=C(C[NH2+][C@H]2CC[C@H]2C2CCC2)CC1 ZINC000337990050 385870140 /nfs/dbraw/zinc/87/01/40/385870140.db2.gz SCMPCQRTMJSBTG-GJZGRUSLSA-N 2 0 234.387 2.417 20 0 BEADRP C[N@H+]1CC=C(C[NH2+][C@H]2CC[C@@H]2C2CCC2)CC1 ZINC000337990048 385870428 /nfs/dbraw/zinc/87/04/28/385870428.db2.gz SCMPCQRTMJSBTG-CABCVRRESA-N 2 0 234.387 2.417 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]C/C=C\c1ccc(F)cc1F ZINC000414873333 385873059 /nfs/dbraw/zinc/87/30/59/385873059.db2.gz HBALOOYPVPGHLD-MXQLGCADSA-N 2 0 240.297 2.162 20 0 BEADRP C[C@@H](C[NH2+]C[C@H]([NH3+])C1CC1)Cc1ccccc1 ZINC000414881355 385990655 /nfs/dbraw/zinc/99/06/55/385990655.db2.gz AHNVKGFZHBMUBF-DOMZBBRYSA-N 2 0 232.371 2.192 20 0 BEADRP C[C@H](CCCC(F)(F)F)[NH2+][C@@H]1CC[NH2+]C1 ZINC000414881448 385992277 /nfs/dbraw/zinc/99/22/77/385992277.db2.gz KZULKNWMIJSKHV-RKDXNWHRSA-N 2 0 224.270 2.059 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@H]1CCC[C@@H]1C1CC1 ZINC000414967622 385931119 /nfs/dbraw/zinc/93/11/19/385931119.db2.gz XWHKVTAUWJPBHA-RTXFEEFZSA-N 2 0 210.365 2.153 20 0 BEADRP Cc1cnccc1C[N@H+](C)CC1CC[NH+](C)CC1 ZINC000294989537 385935375 /nfs/dbraw/zinc/93/53/75/385935375.db2.gz YAVGFLZJNVHFLG-UHFFFAOYSA-N 2 0 247.386 2.164 20 0 BEADRP CCC[NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000335042666 385936242 /nfs/dbraw/zinc/93/62/42/385936242.db2.gz UHCRMSIDNWSARO-DZGCQCFKSA-N 2 0 246.354 2.242 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+]C1Cc2ccccc2C1 ZINC000335044236 385938946 /nfs/dbraw/zinc/93/89/46/385938946.db2.gz XWUARBRLFUUIBF-BLLLJJGKSA-N 2 0 244.382 2.132 20 0 BEADRP C[C@H]([NH2+]C1CCC([NH3+])CC1)c1ccncc1F ZINC000335048089 385943192 /nfs/dbraw/zinc/94/31/92/385943192.db2.gz AVZFEYFGNPXBML-WHXUTIOJSA-N 2 0 237.322 2.141 20 0 BEADRP CCc1ccc(CC[NH2+]CC2([NH3+])CCC2)cc1 ZINC000342140868 385944291 /nfs/dbraw/zinc/94/42/91/385944291.db2.gz QZFVPLXGQXXPHJ-UHFFFAOYSA-N 2 0 232.371 2.263 20 0 BEADRP CC1(C[NH2+][C@@H]2CCC[C@H]2[NH3+])CCCCC1 ZINC000335056048 385955723 /nfs/dbraw/zinc/95/57/23/385955723.db2.gz ANIWLGJELLEZCI-VXGBXAGGSA-N 2 0 210.365 2.426 20 0 BEADRP Cn1cccc1[C@@H]1CCC[N@@H+]1CCn1ccnc1 ZINC000272998537 385958303 /nfs/dbraw/zinc/95/83/03/385958303.db2.gz RRFUEAPOUSQYGC-AWEZNQCLSA-N 2 0 244.342 2.059 20 0 BEADRP CC[NH+](CC)CCC[N@H+](CC)CC1CC1 ZINC000338298085 385960538 /nfs/dbraw/zinc/96/05/38/385960538.db2.gz YSTUYJSHDGPBCJ-UHFFFAOYSA-N 2 0 212.381 2.450 20 0 BEADRP Fc1cccc2c1CC[C@@H]2[NH2+]CC1=CC[NH2+]CC1 ZINC000335059762 385960844 /nfs/dbraw/zinc/96/08/44/385960844.db2.gz OXXYDLDACBBHLX-HNNXBMFYSA-N 2 0 246.329 2.322 20 0 BEADRP C[C@H]1COCC[C@H]1[NH2+]CC1([NH3+])CCCCCC1 ZINC000335058883 385961611 /nfs/dbraw/zinc/96/16/11/385961611.db2.gz MDLVWXOVQDSBDL-QWHCGFSZSA-N 2 0 240.391 2.053 20 0 BEADRP CC(C)C1CC([NH2+][C@@H]2CCC[C@H]([NH3+])C2)C1 ZINC000335015539 385970661 /nfs/dbraw/zinc/97/06/61/385970661.db2.gz ZDMBAUQENDMVDX-CMOBGSAGSA-N 2 0 210.365 2.281 20 0 BEADRP CC[NH+](CC)CCCN1C[C@H](C)O[C@H](C)[C@@H]1C ZINC000338345512 385973507 /nfs/dbraw/zinc/97/35/07/385973507.db2.gz ANNRYJILEXETLB-MELADBBJSA-N 2 0 242.407 2.216 20 0 BEADRP CC[NH+](CC)CCCN1C[C@H](C)O[C@H](C)[C@H]1C ZINC000338345479 385973652 /nfs/dbraw/zinc/97/36/52/385973652.db2.gz ANNRYJILEXETLB-BFHYXJOUSA-N 2 0 242.407 2.216 20 0 BEADRP CCN1CCCC[C@@H]1C[NH2+][C@H](C)[C@H]1C[C@H]1C ZINC000414111675 386006028 /nfs/dbraw/zinc/00/60/28/386006028.db2.gz JDHQPLQNDFNEKP-SYQHCUMBSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H](C)CCCC(F)(F)F ZINC000414882295 386011642 /nfs/dbraw/zinc/01/16/42/386011642.db2.gz TXWAMIURNVDRHG-BDAKNGLRSA-N 2 0 226.286 2.292 20 0 BEADRP CC[C@H]([NH3+])CNCc1ccccc1OC(C)C ZINC000414976120 386014770 /nfs/dbraw/zinc/01/47/70/386014770.db2.gz HKSVXDLBUNQOBW-ZDUSSCGKSA-N 2 0 236.359 2.301 20 0 BEADRP CC[C@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)C1CC1 ZINC000414170854 386015816 /nfs/dbraw/zinc/01/58/16/386015816.db2.gz CLEMYGLHPYKZFM-OCCSQVGLSA-N 2 0 224.392 2.497 20 0 BEADRP COCC[C@H](C)C[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000414181683 386022413 /nfs/dbraw/zinc/02/24/13/386022413.db2.gz AETCRWAPNBFVCX-ZDUSSCGKSA-N 2 0 242.407 2.121 20 0 BEADRP CC(C)N(C)CC[NH2+][C@@H]1CCC12CCC2 ZINC000336753346 386024468 /nfs/dbraw/zinc/02/44/68/386024468.db2.gz HOROMAINDQUIRO-GFCCVEGCSA-N 2 0 210.365 2.249 20 0 BEADRP c1ccc2c(c1)CC[C@H]2[NH2+]CC1=CC[NH2+]CC1 ZINC000335061532 386026876 /nfs/dbraw/zinc/02/68/76/386026876.db2.gz YITURQPKQRWRQB-OAHLLOKOSA-N 2 0 228.339 2.183 20 0 BEADRP COCCC[C@@H](C)[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC000414201710 386036739 /nfs/dbraw/zinc/03/67/39/386036739.db2.gz YIGAOKKZAOLQSX-KGLIPLIRSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)C1CC([NH2+][C@@H]2CCCC[C@H]2[NH3+])C1 ZINC000335075205 386041888 /nfs/dbraw/zinc/04/18/88/386041888.db2.gz DIGAAQKBCZEEHE-FIYWTHMPSA-N 2 0 210.365 2.281 20 0 BEADRP COC[C@H]([NH2+]Cc1ccc2c[nH+]cn2c1)C(C)C ZINC000414162070 386046106 /nfs/dbraw/zinc/04/61/06/386046106.db2.gz CUZGGMKWXJLKCS-AWEZNQCLSA-N 2 0 247.342 2.095 20 0 BEADRP C[C@H]([NH2+][C@H]1CCc2nc[nH]c2C1)c1cscn1 ZINC000334432468 386049542 /nfs/dbraw/zinc/04/95/42/386049542.db2.gz WVYUERJSKXESID-IUCAKERBSA-N 2 0 248.355 2.074 20 0 BEADRP F[C@@H]1CCCC[C@H]1[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000414291492 386102064 /nfs/dbraw/zinc/10/20/64/386102064.db2.gz UKOXHEIBSBABER-AAVRWANBSA-N 2 0 240.366 2.484 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@@H]([NH3+])C2CC2)[C@@H](C)C1 ZINC000414889125 386103234 /nfs/dbraw/zinc/10/32/34/386103234.db2.gz KVQZPCJTPGDDTG-DNIRFERGSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@H]([NH3+])C2CC2)[C@@H](C)C1 ZINC000414889128 386103603 /nfs/dbraw/zinc/10/36/03/386103603.db2.gz KVQZPCJTPGDDTG-URBCHYCLSA-N 2 0 210.365 2.138 20 0 BEADRP c1ccc(C[C@@H]2CC[C@H]([NH2+][C@H]3CC[NH2+]C3)C2)cc1 ZINC000414889085 386106111 /nfs/dbraw/zinc/10/61/11/386106111.db2.gz SPDZRFKCYIEFBF-JYJNAYRXSA-N 2 0 244.382 2.349 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@@H](C)CCc1ccccc1F ZINC000414981886 386063512 /nfs/dbraw/zinc/06/35/12/386063512.db2.gz CKDGMYSKLQFRNZ-AAEUAGOBSA-N 2 0 238.350 2.474 20 0 BEADRP CCSc1cccc(C[NH2+]C[C@@H](C)C[NH3+])c1 ZINC000414885784 386070384 /nfs/dbraw/zinc/07/03/84/386070384.db2.gz XKOHVIXHMFAWPG-NSHDSACASA-N 2 0 238.400 2.483 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+][C@H]2CC2(C)C)[C@H](C)C1 ZINC000414221861 386075835 /nfs/dbraw/zinc/07/58/35/386075835.db2.gz MUAGHNVKEZFJBD-UTUOFQBUSA-N 2 0 210.365 2.105 20 0 BEADRP Cc1cnccc1C[NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000295819746 386089671 /nfs/dbraw/zinc/08/96/71/386089671.db2.gz UOGFYQMSCBEJDJ-HUUCEWRRSA-N 2 0 247.386 2.352 20 0 BEADRP [NH3+][C@@H]1CCC[C@H](C[NH2+]Cc2ccc(F)cc2)C1 ZINC000414990285 386145610 /nfs/dbraw/zinc/14/56/10/386145610.db2.gz IEOPSCMJUAXCMC-GXTWGEPZSA-N 2 0 236.334 2.433 20 0 BEADRP CCC1CCC([NH2+]C[C@H]([NH3+])C2CC2)CC1 ZINC000414892078 386146095 /nfs/dbraw/zinc/14/60/95/386146095.db2.gz PGOPHCJITNMXNL-GDKBPFBDSA-N 2 0 210.365 2.282 20 0 BEADRP COC(C)(C)[C@H](C)[NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000340260988 386148817 /nfs/dbraw/zinc/14/88/17/386148817.db2.gz UDZNQAUVUAVVIO-YNEHKIRRSA-N 2 0 242.407 2.262 20 0 BEADRP CC(C)C[C@H](C)C[C@@H](C)[NH2+][C@@H]1CC[NH2+]C1 ZINC000414892770 386151327 /nfs/dbraw/zinc/15/13/27/386151327.db2.gz YIYUXJRZJZTJPX-YNEHKIRRSA-N 2 0 212.381 2.399 20 0 BEADRP Cc1ccc(OC2CC[NH+](CCC[NH3+])CC2)cc1 ZINC000414677067 386152713 /nfs/dbraw/zinc/15/27/13/386152713.db2.gz OFETYSPSMBMCBR-UHFFFAOYSA-N 2 0 248.370 2.187 20 0 BEADRP CC[C@H]([NH3+])C[NH2+]C[C@@H](C)c1ccccc1 ZINC000414991472 386153758 /nfs/dbraw/zinc/15/37/58/386153758.db2.gz QEZBNIRZFQQXGO-YPMHNXCESA-N 2 0 206.333 2.117 20 0 BEADRP CC1(C)CCC([NH2+]C[C@@H]([NH3+])C2CC2)CC1 ZINC000414893046 386156186 /nfs/dbraw/zinc/15/61/86/386156186.db2.gz QWNCPFIWAJCIHA-GFCCVEGCSA-N 2 0 210.365 2.282 20 0 BEADRP COc1ccccc1C[NH2+]C[C@@H]1CCC[C@H]([NH3+])C1 ZINC000414992336 386156813 /nfs/dbraw/zinc/15/68/13/386156813.db2.gz KHUNJYFOVNQMCW-OCCSQVGLSA-N 2 0 248.370 2.302 20 0 BEADRP CC(C)[N@H+](C[C@H]1CC[NH2+][C@H](C)C1)C1CC1 ZINC000414677457 386157151 /nfs/dbraw/zinc/15/71/51/386157151.db2.gz OVADFTHQSJGXPT-NEPJUHHUSA-N 2 0 210.365 2.247 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@@H]1Cc2ccc(Cl)cc2C1 ZINC000414992841 386158395 /nfs/dbraw/zinc/15/83/95/386158395.db2.gz SCJRTMGRNRGKBO-CHWSQXEVSA-N 2 0 238.762 2.134 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@H]1Cc2ccc(Cl)cc2C1 ZINC000414992845 386159170 /nfs/dbraw/zinc/15/91/70/386159170.db2.gz SCJRTMGRNRGKBO-OLZOCXBDSA-N 2 0 238.762 2.134 20 0 BEADRP CC[C@@H](F)CN1CC[C@@H](C[NH+](CC)CC)C1 ZINC000440801725 386160930 /nfs/dbraw/zinc/16/09/30/386160930.db2.gz RIVSTJOXFILKJI-QWHCGFSZSA-N 2 0 230.371 2.398 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@H](C)Cc1ccc(F)cc1 ZINC000414994093 386164545 /nfs/dbraw/zinc/16/45/45/386164545.db2.gz UFFILWIGJPRQQJ-ZWNOBZJWSA-N 2 0 224.323 2.084 20 0 BEADRP COc1ccccc1C[C@@H]1CCC[N@@H+]1CCC[NH3+] ZINC000414683805 386167718 /nfs/dbraw/zinc/16/77/18/386167718.db2.gz BXTRAVWZWYWANS-AWEZNQCLSA-N 2 0 248.370 2.051 20 0 BEADRP [NH3+][C@H](C[NH2+][C@H]1CCCC[C@H]1C1CC1)C1CC1 ZINC000414894266 386171024 /nfs/dbraw/zinc/17/10/24/386171024.db2.gz SQJSBYRHXKTXDW-MJBXVCDLSA-N 2 0 222.376 2.282 20 0 BEADRP [NH3+]CCC[N@H+](C1CC1)[C@H]1CCc2ccccc21 ZINC000414685951 386173996 /nfs/dbraw/zinc/17/39/96/386173996.db2.gz FJBBFDKQJKUQMZ-HNNXBMFYSA-N 2 0 230.355 2.487 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@@H](C)CCc1cccc(F)c1 ZINC000414995877 386179771 /nfs/dbraw/zinc/17/97/71/386179771.db2.gz WTTSEMXIDZKLSC-FZMZJTMJSA-N 2 0 238.350 2.474 20 0 BEADRP C[C@H](CC[NH3+])[NH2+]C/C=C\c1ccccc1 ZINC000414890638 386131791 /nfs/dbraw/zinc/13/17/91/386131791.db2.gz UKQGSOOBOCNTCU-VVEJJEBESA-N 2 0 204.317 2.027 20 0 BEADRP C[C@@H](CC[NH3+])[NH2+]C/C=C\c1ccccc1 ZINC000414890637 386132031 /nfs/dbraw/zinc/13/20/31/386132031.db2.gz UKQGSOOBOCNTCU-JECSTDCCSA-N 2 0 204.317 2.027 20 0 BEADRP Cc1ccccc1[C@H]1CCC[N@@H+]1CCC[NH3+] ZINC000414669957 386134279 /nfs/dbraw/zinc/13/42/79/386134279.db2.gz CHAOAULEQAIYDW-CQSZACIVSA-N 2 0 218.344 2.481 20 0 BEADRP C[C@H](CC1CCCC1)[NH2+]C[C@H]([NH3+])C1CC1 ZINC000414891357 386140295 /nfs/dbraw/zinc/14/02/95/386140295.db2.gz NXFMCBFDRFXBKX-MFKMUULPSA-N 2 0 210.365 2.282 20 0 BEADRP c1ccc(C[C@@H]2CCC[N@H+]2C[C@@H]2CC[NH2+]C2)cc1 ZINC000647874683 386142808 /nfs/dbraw/zinc/14/28/08/386142808.db2.gz MQURZDAIBZDRQO-CVEARBPZSA-N 2 0 244.382 2.303 20 0 BEADRP C[C@@H](CC[NH3+])[NH2+]C[C@@H](C)c1ccc(F)cc1 ZINC000414896772 386208058 /nfs/dbraw/zinc/20/80/58/386208058.db2.gz PUWPHBFCOIWFSQ-MNOVXSKESA-N 2 0 224.323 2.256 20 0 BEADRP C[C@@H]1C[C@@H](c2ccccc2)C[N@@H+]1CCC[NH3+] ZINC000414702799 386209858 /nfs/dbraw/zinc/20/98/58/386209858.db2.gz LXCUNFJNPDJMBZ-TZMCWYRMSA-N 2 0 218.344 2.213 20 0 BEADRP Cc1cccc(CN(C2CC2)[C@@H]2CC[NH2+]C2)c1 ZINC000347142659 386259641 /nfs/dbraw/zinc/25/96/41/386259641.db2.gz XAGRWAZVLKGETJ-OAHLLOKOSA-N 2 0 230.355 2.321 20 0 BEADRP C[C@H](CC[NH3+])[NH2+]Cc1ccc(OCC2CC2)cc1 ZINC000414897563 386211540 /nfs/dbraw/zinc/21/15/40/386211540.db2.gz RPCXVVRORTZNKX-GFCCVEGCSA-N 2 0 248.370 2.302 20 0 BEADRP C[C@@H]1C[C@H](C[NH3+])C[N@@H+]1Cc1ccc2c(c1)CCC2 ZINC000131759970 386214830 /nfs/dbraw/zinc/21/48/30/386214830.db2.gz OXGZFWVRIBTNJD-TZMCWYRMSA-N 2 0 244.382 2.344 20 0 BEADRP CCOc1ccc(C[NH2+][C@@H](C)CC[NH3+])cc1F ZINC000414897262 386215915 /nfs/dbraw/zinc/21/59/15/386215915.db2.gz QXILYHKCNQQBGA-JTQLQIEISA-N 2 0 240.322 2.051 20 0 BEADRP C[C@@H]1[C@@H](c2ccccc2)CC[N@@H+]1CCC[NH3+] ZINC000414707053 386216744 /nfs/dbraw/zinc/21/67/44/386216744.db2.gz NJOIFMFQZSCKFU-OCCSQVGLSA-N 2 0 218.344 2.213 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCC[C@@H]1c1ccc(O)cc1 ZINC000647882004 386217348 /nfs/dbraw/zinc/21/73/48/386217348.db2.gz ARCYLVWUUCBSHD-CQSZACIVSA-N 2 0 234.343 2.139 20 0 BEADRP C[C@H](C[NH2+]C[C@@H]1CCC[NH2+]C1)c1ccccc1 ZINC000132020423 386219083 /nfs/dbraw/zinc/21/90/83/386219083.db2.gz ZBZUNAZLFPKGCF-ZIAGYGMSSA-N 2 0 232.371 2.379 20 0 BEADRP c1ccc2c(c1)CC[C@H]2[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000132016425 386220383 /nfs/dbraw/zinc/22/03/83/386220383.db2.gz PENMQFUCTYRLGJ-SWLSCSKDSA-N 2 0 230.355 2.263 20 0 BEADRP CC[C@@H](C[N@@H+]1CC[C@H](C[NH3+])C1)c1ccccc1 ZINC000347028710 386220785 /nfs/dbraw/zinc/22/07/85/386220785.db2.gz VWDBSXWWFHBUOT-KGLIPLIRSA-N 2 0 232.371 2.461 20 0 BEADRP CC[C@@H](C[N@@H+]1CC[C@@H](C[NH3+])C1)c1ccccc1 ZINC000347028708 386220940 /nfs/dbraw/zinc/22/09/40/386220940.db2.gz VWDBSXWWFHBUOT-KBPBESRZSA-N 2 0 232.371 2.461 20 0 BEADRP CCC(O)(CC)C[NH2+][C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000132147036 386221459 /nfs/dbraw/zinc/22/14/59/386221459.db2.gz WVNRRMKMQACGDR-KBPBESRZSA-N 2 0 248.370 2.272 20 0 BEADRP CCC(O)(CC)C[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000132146829 386221515 /nfs/dbraw/zinc/22/15/15/386221515.db2.gz WVNRRMKMQACGDR-UONOGXRCSA-N 2 0 248.370 2.272 20 0 BEADRP [NH3+]CCC[N@@H+]1CC[C@@H](Cc2ccc(F)cc2)C1 ZINC000414708641 386225333 /nfs/dbraw/zinc/22/53/33/386225333.db2.gz QGSPBAKFTQZRJI-ZDUSSCGKSA-N 2 0 236.334 2.039 20 0 BEADRP CC[C@H](C)[C@H](C)[N@H+](C[C@@H]1CC[NH2+]C1)C1CC1 ZINC000647884520 386260254 /nfs/dbraw/zinc/26/02/54/386260254.db2.gz ZECYVXSBODGPAU-RWMBFGLXSA-N 2 0 224.392 2.495 20 0 BEADRP CO[C@@H](C)CN(CC[NH2+]C(C)(C)C)C(C)C ZINC000414716638 386237463 /nfs/dbraw/zinc/23/74/63/386237463.db2.gz XIQMFHWKYHINMM-LBPRGKRZSA-N 2 0 230.396 2.120 20 0 BEADRP CC(C)C[C@H]([NH3+])CN(C)[C@@H](C)c1cccnc1 ZINC000414716703 386239341 /nfs/dbraw/zinc/23/93/41/386239341.db2.gz SQOXSTVWZQBTTP-JSGCOSHPSA-N 2 0 235.375 2.448 20 0 BEADRP COc1cccc(C[NH2+]C[C@@H]2CCC[C@H]([NH3+])C2)c1 ZINC000415003492 386254083 /nfs/dbraw/zinc/25/40/83/386254083.db2.gz XICNRPCTZUFEDC-OCCSQVGLSA-N 2 0 248.370 2.302 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H]1CO[C@H](C)C1 ZINC000401899764 386280523 /nfs/dbraw/zinc/28/05/23/386280523.db2.gz CTNQPRMCOCABBF-BFHYXJOUSA-N 2 0 242.407 2.264 20 0 BEADRP C[NH+](C)CCC1CC[NH+](CCC2CC2)CC1 ZINC000336663205 386281340 /nfs/dbraw/zinc/28/13/40/386281340.db2.gz FKCRJXXIJVPGBT-UHFFFAOYSA-N 2 0 224.392 2.450 20 0 BEADRP CC[N@H+](C)C[C@H]1CC[NH+](CCSC(C)C)C1 ZINC000336663029 386281399 /nfs/dbraw/zinc/28/13/99/386281399.db2.gz AGRDFTLLEZUWOB-CYBMUJFWSA-N 2 0 244.448 2.402 20 0 BEADRP CCC[C@@]1(C)CCC[N@H+](C[C@@H]2CC[NH2+]C2)C1 ZINC000647886126 386294105 /nfs/dbraw/zinc/29/41/05/386294105.db2.gz XKWLNKGAINCQJF-KGLIPLIRSA-N 2 0 224.392 2.498 20 0 BEADRP CCCC[C@H](COC)[NH2+]C[C@H]1CCC[C@H]([NH3+])C1 ZINC000415005117 386297036 /nfs/dbraw/zinc/29/70/36/386297036.db2.gz OYBOGVUARCLIBU-MELADBBJSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@@H]1CC[C@H]([N@H+](C)C[C@@H]2CC[NH2+][C@@H](C)C2)C1 ZINC000414737035 386305963 /nfs/dbraw/zinc/30/59/63/386305963.db2.gz IFTNPZXSIFWRBR-RQJABVFESA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]([NH3+])[C@H](C)[NH2+]CCCCOc1ccccc1 ZINC000415005881 386311403 /nfs/dbraw/zinc/31/14/03/386311403.db2.gz AXEJZDLHBCIQBI-OLZOCXBDSA-N 2 0 236.359 2.171 20 0 BEADRP Cc1ccncc1C[N@@H+](C)C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000414738295 386316684 /nfs/dbraw/zinc/31/66/84/386316684.db2.gz JAWYYYCAMWOYLV-ZIAGYGMSSA-N 2 0 247.386 2.210 20 0 BEADRP C[C@H](CC1CC1)[NH2+]C[C@H]1CCC[C@@H]([NH3+])C1 ZINC000415003600 386261906 /nfs/dbraw/zinc/26/19/06/386261906.db2.gz NIWGKIKHJYVGQD-KGYLQXTDSA-N 2 0 210.365 2.282 20 0 BEADRP c1cc2c(s1)CCC[N@@H+](C[C@@H]1CC[NH2+]C1)C2 ZINC000647884609 386263558 /nfs/dbraw/zinc/26/35/58/386263558.db2.gz OBUXZNSJBCMYEF-LLVKDONJSA-N 2 0 236.384 2.106 20 0 BEADRP C[N@H+](CC[C@H]1CCCC[NH+]1C)CC1CC1 ZINC000336652058 386265732 /nfs/dbraw/zinc/26/57/32/386265732.db2.gz WFKANKVNJCPTMR-CYBMUJFWSA-N 2 0 210.365 2.203 20 0 BEADRP C[C@@H]1C[C@@H]2CCCC[C@H]2[N@@H+]1C[C@H]1CC[NH2+]C1 ZINC000647884997 386271718 /nfs/dbraw/zinc/27/17/18/386271718.db2.gz VJZIPQPXLXQQED-ZOBORPQBSA-N 2 0 222.376 2.249 20 0 BEADRP Cc1ccc(CN[C@@H](C)[C@@H](C)[NH3+])cc1C ZINC000415004303 386276258 /nfs/dbraw/zinc/27/62/58/386276258.db2.gz HNNFJJRUUPGXBE-NEPJUHHUSA-N 2 0 206.333 2.129 20 0 BEADRP C[C@@H](CC[NH3+])[NH2+]Cc1cc(Cl)cs1 ZINC000414900691 386279937 /nfs/dbraw/zinc/27/99/37/386279937.db2.gz WKKGLIPPRPPSTR-ZETCQYMHSA-N 2 0 218.753 2.228 20 0 BEADRP CC(C)C[C@@H]1CCCC[N@@H+]1C[C@@H]1CC[NH2+]C1 ZINC000647888167 386341947 /nfs/dbraw/zinc/34/19/47/386341947.db2.gz VEMHKBDLASNELL-KGLIPLIRSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)C[C@H]1CCCC[N@@H+]1C[C@H]1CC[NH2+]C1 ZINC000647888168 386341980 /nfs/dbraw/zinc/34/19/80/386341980.db2.gz VEMHKBDLASNELL-UONOGXRCSA-N 2 0 224.392 2.497 20 0 BEADRP CCC[C@@H](C)C[NH2+]CC1(C)CC[NH2+]CC1 ZINC000414903892 386343587 /nfs/dbraw/zinc/34/35/87/386343587.db2.gz MPSUMVXIMKIJJJ-GFCCVEGCSA-N 2 0 212.381 2.402 20 0 BEADRP C[C@@H]1Cc2ccccc2C[N@@H+]1C[C@H]1CC[NH2+]C1 ZINC000647888079 386344738 /nfs/dbraw/zinc/34/47/38/386344738.db2.gz JXJPGAKMBMLJAO-OLZOCXBDSA-N 2 0 230.355 2.043 20 0 BEADRP C[C@@H]1Cc2ccccc2C[N@@H+]1C[C@@H]1CC[NH2+]C1 ZINC000647888078 386345458 /nfs/dbraw/zinc/34/54/58/386345458.db2.gz JXJPGAKMBMLJAO-CHWSQXEVSA-N 2 0 230.355 2.043 20 0 BEADRP COc1ccc(C[NH2+]CC2(C)CC[NH2+]CC2)cc1 ZINC000414905395 386362482 /nfs/dbraw/zinc/36/24/82/386362482.db2.gz OEGBWRZQOVNUQQ-UHFFFAOYSA-N 2 0 248.370 2.175 20 0 BEADRP CC(C)C[C@@H]1CCC[N@H+](C[C@H]2CC[NH2+]C2)C1 ZINC000647890130 386367052 /nfs/dbraw/zinc/36/70/52/386367052.db2.gz TWIFOQDGLBBYHH-KBPBESRZSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@H]1[C@H](Cc2ccccc2)CC[N@@H+]1CCC[NH3+] ZINC000414740232 386330411 /nfs/dbraw/zinc/33/04/11/386330411.db2.gz JRCHLIUSXOGVSI-ZFWWWQNUSA-N 2 0 232.371 2.288 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]2C[N@H+](CCc3ccccc3)C[C@@H]21 ZINC000230045712 386336590 /nfs/dbraw/zinc/33/65/90/386336590.db2.gz JJPZCAXYXGHNLE-HRCADAONSA-N 2 0 244.382 2.288 20 0 BEADRP C[C@H]([NH2+]CC1(C)CC[NH2+]CC1)C1CCC1 ZINC000414910803 386438475 /nfs/dbraw/zinc/43/84/75/386438475.db2.gz SSPPRZTYVAMCCV-NSHDSACASA-N 2 0 210.365 2.154 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+]CC(C)(C)CC(C)C ZINC000391133700 386443610 /nfs/dbraw/zinc/44/36/10/386443610.db2.gz OHVQJDOCGGFNHS-ZDUSSCGKSA-N 2 0 244.423 2.402 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH+](C)C[C@H](C)COC)C[C@H]1C ZINC000527366091 386446259 /nfs/dbraw/zinc/44/62/59/386446259.db2.gz FQKANPPILBFWEV-MJBXVCDLSA-N 2 0 242.407 2.074 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH+](C)C[C@@H](C)COC)C[C@@H]1C ZINC000527366092 386448158 /nfs/dbraw/zinc/44/81/58/386448158.db2.gz FQKANPPILBFWEV-RDBSUJKOSA-N 2 0 242.407 2.074 20 0 BEADRP COc1cc(C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)ccc1C ZINC000414908485 386399449 /nfs/dbraw/zinc/39/94/49/386399449.db2.gz BKXOZDUKMBFKHT-UONOGXRCSA-N 2 0 248.370 2.363 20 0 BEADRP [NH3+]C[C@H]1CC[N@H+](CCCCOc2ccccc2)C1 ZINC000339409278 386415906 /nfs/dbraw/zinc/41/59/06/386415906.db2.gz FYTNTYMAZGTPPD-CQSZACIVSA-N 2 0 248.370 2.126 20 0 BEADRP CC(C)[N@H+](CC1CCC1)C[C@H]1CC[NH2+]C1 ZINC000647991648 386420010 /nfs/dbraw/zinc/42/00/10/386420010.db2.gz WFRCRPTWBKWODP-ZDUSSCGKSA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)C[C@@H]([NH3+])C[N@@H+]1CCCC12CCC2 ZINC000414762663 386425994 /nfs/dbraw/zinc/42/59/94/386425994.db2.gz WKDCILUERNWBHH-GFCCVEGCSA-N 2 0 210.365 2.378 20 0 BEADRP CC[C@H]1C[C@H](C)C[N@@H+]1CCC1CC[NH2+]CC1 ZINC000399164028 386427211 /nfs/dbraw/zinc/42/72/11/386427211.db2.gz LUZQSENITHRGKH-JSGCOSHPSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H]1C[C@H](C)C[N@@H+]1CCC1CC[NH2+]CC1 ZINC000399164025 386427699 /nfs/dbraw/zinc/42/76/99/386427699.db2.gz LUZQSENITHRGKH-GXTWGEPZSA-N 2 0 224.392 2.497 20 0 BEADRP C[N@H+](Cc1ccc2c(c1)CCO2)CC(C)(C)C[NH3+] ZINC000093873191 386429844 /nfs/dbraw/zinc/42/98/44/386429844.db2.gz KDAMSCZQPVZFQO-UHFFFAOYSA-N 2 0 248.370 2.038 20 0 BEADRP C[C@H](CN(C)C)[NH2+][C@@H]1CC[C@H]1C1CCC1 ZINC000336742076 386475049 /nfs/dbraw/zinc/47/50/49/386475049.db2.gz WGWHEOLDKVOOJT-KGYLQXTDSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@H](C[NH2+]CCCC[NH3+])c1ccc(F)cc1 ZINC000414913031 386478622 /nfs/dbraw/zinc/47/86/22/386478622.db2.gz VNTOIIPRNHNVOB-LLVKDONJSA-N 2 0 224.323 2.258 20 0 BEADRP CC[C@@H]1C[N@H+](CCCc2ccncc2)CC[C@H]1[NH3+] ZINC000647934484 386479735 /nfs/dbraw/zinc/47/97/35/386479735.db2.gz GXQUJUQYYXROGD-HUUCEWRRSA-N 2 0 247.386 2.073 20 0 BEADRP CC(C)(C)[C@H]1CC[C@H]1[NH2+]C1CC[NH2+]CC1 ZINC000335453496 386528986 /nfs/dbraw/zinc/52/89/86/386528986.db2.gz WCBVSGQJGSXFMG-NWDGAFQWSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1ccncc1 ZINC000227498296 386486273 /nfs/dbraw/zinc/48/62/73/386486273.db2.gz XLQRXVIKGCRDIO-ZDUSSCGKSA-N 2 0 247.386 2.464 20 0 BEADRP C[C@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1cccnc1 ZINC000227496771 386486626 /nfs/dbraw/zinc/48/66/26/386486626.db2.gz JJTWXHANXPGDGG-ZDUSSCGKSA-N 2 0 247.386 2.464 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000415015230 386499513 /nfs/dbraw/zinc/49/95/13/386499513.db2.gz AOJGKIXOGGPOMZ-RDBSUJKOSA-N 3 0 241.423 2.014 20 0 BEADRP C[C@H](C[NH2+][C@@H](C)[C@H](C)[NH3+])Cc1ccccc1 ZINC000415014682 386500495 /nfs/dbraw/zinc/50/04/95/386500495.db2.gz MEGADJGJGPQQMX-AVGNSLFASA-N 2 0 220.360 2.191 20 0 BEADRP CC(C)[C@H]1C[C@H]([NH2+][C@H](C)CCCC[NH3+])CCO1 ZINC000415017565 386502154 /nfs/dbraw/zinc/50/21/54/386502154.db2.gz SKHZBWLVSVWEIG-MGPQQGTHSA-N 2 0 242.407 2.297 20 0 BEADRP CC(C)[C@@H]1C[C@H]([NH2+][C@H](C)CCCC[NH3+])CCO1 ZINC000415017564 386502813 /nfs/dbraw/zinc/50/28/13/386502813.db2.gz SKHZBWLVSVWEIG-MCIONIFRSA-N 2 0 242.407 2.297 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]C/C=C/c1ccccc1 ZINC000415018012 386503841 /nfs/dbraw/zinc/50/38/41/386503841.db2.gz GDJGLBCOFWDJOH-PPOCWRSBSA-N 2 0 218.344 2.417 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+]CC1CCCCC1 ZINC000415049797 386505297 /nfs/dbraw/zinc/50/52/97/386505297.db2.gz YEAJADQCBFEPIQ-GFCCVEGCSA-N 2 0 210.365 2.297 20 0 BEADRP CC(C)C[C@@H](C)C[NH2+][C@@H]1CC[NH2+]C1(C)C ZINC000415050434 386505547 /nfs/dbraw/zinc/50/55/47/386505547.db2.gz YRZGXQANNBBQKH-VXGBXAGGSA-N 2 0 212.381 2.399 20 0 BEADRP CCc1ccc(C[NH2+][C@H]2CC[C@@H](C[NH3+])C2)cc1 ZINC000415049234 386506313 /nfs/dbraw/zinc/50/63/13/386506313.db2.gz XNTVGWABNVVLRS-CABCVRRESA-N 2 0 232.371 2.466 20 0 BEADRP CC[C@H](C[C@@H](C)CC)[NH2+]C[C@H]1C[NH2+]CCCO1 ZINC000415049415 386506619 /nfs/dbraw/zinc/50/66/19/386506619.db2.gz YCAOZBGDADRHLD-BFHYXJOUSA-N 2 0 242.407 2.169 20 0 BEADRP COc1cc(C[NH2+][C@H](C)CCC[NH3+])ccc1C ZINC000415022319 386512179 /nfs/dbraw/zinc/51/21/79/386512179.db2.gz LHDYDXOCWPSBLG-GFCCVEGCSA-N 2 0 236.359 2.221 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]Cc1cc(F)c(F)cc1F ZINC000415026264 386513834 /nfs/dbraw/zinc/51/38/34/386513834.db2.gz SZJLABIDNLHDDN-QMMMGPOBSA-N 2 0 246.276 2.321 20 0 BEADRP COCc1cccc(C[NH2+][C@H]2CC[C@@H](C[NH3+])C2)c1 ZINC000415029186 386516232 /nfs/dbraw/zinc/51/62/32/386516232.db2.gz DNEQTNBYIJWJNI-DOMZBBRYSA-N 2 0 248.370 2.050 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]Cc1ncc(Cl)s1 ZINC000415027053 386516493 /nfs/dbraw/zinc/51/64/93/386516493.db2.gz VTTREVJLSRYJSS-SSDOTTSWSA-N 2 0 233.768 2.014 20 0 BEADRP CCc1cc(OC)ccc1CN1CC[C@@H]([NH3+])[C@H]1C ZINC000414784785 386517970 /nfs/dbraw/zinc/51/79/70/386517970.db2.gz LIFCMEKNIVLGBE-IAQYHMDHSA-N 2 0 248.370 2.179 20 0 BEADRP CCC(CC)(CC)C[NH2+]C[C@@H]1C[NH2+]CCCO1 ZINC000415036983 386523351 /nfs/dbraw/zinc/52/33/51/386523351.db2.gz KUIOHLNXGSDVSR-ZDUSSCGKSA-N 2 0 242.407 2.171 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+]C[C@H](C)CC1CCOCC1 ZINC000414786436 386526151 /nfs/dbraw/zinc/52/61/51/386526151.db2.gz BEDBGPNPNGLEKC-OCCSQVGLSA-N 2 0 242.407 2.012 20 0 BEADRP CCCC[C@@H]1CCC[C@H]1[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000415039696 386526292 /nfs/dbraw/zinc/52/62/92/386526292.db2.gz PLWYHOSRWJJDDB-RGDJUOJXSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+][C@H]1CC[C@H](C[NH3+])C1 ZINC000415039900 386527710 /nfs/dbraw/zinc/52/77/10/386527710.db2.gz OPKXUPCHOMCGED-UTLUCORTSA-N 2 0 238.297 2.434 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@H]([NH3+])[C@H](C)C2)cc1C ZINC000094338839 386457581 /nfs/dbraw/zinc/45/75/81/386457581.db2.gz NWERWQIKMPZRGH-HIFRSBDPSA-N 2 0 232.371 2.473 20 0 BEADRP C[C@H]1CCC[C@@H]([NH2+]CC[C@H]2CCC[NH2+]2)C1 ZINC000414911624 386458322 /nfs/dbraw/zinc/45/83/22/386458322.db2.gz WYLWEBQTRLVCAW-YNEHKIRRSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]CC[C@H]2CCC[NH2+]2)C1 ZINC000414911621 386459215 /nfs/dbraw/zinc/45/92/15/386459215.db2.gz WYLWEBQTRLVCAW-JHJVBQTASA-N 2 0 210.365 2.297 20 0 BEADRP Cc1cc(F)ccc1C[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000414912017 386465605 /nfs/dbraw/zinc/46/56/05/386465605.db2.gz XNIQKRZXMYFEBC-CQSZACIVSA-N 2 0 236.334 2.366 20 0 BEADRP C(C1CCCC1)[NH+]1CCC2(CC[NH2+]2)CC1 ZINC000335413094 386576894 /nfs/dbraw/zinc/57/68/94/386576894.db2.gz KIMJFLQUKKAHJW-UHFFFAOYSA-N 2 0 208.349 2.005 20 0 BEADRP CC[C@H](C)[N@@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000647977780 386577740 /nfs/dbraw/zinc/57/77/40/386577740.db2.gz HNSXPYOXGFAIQT-MJBXVCDLSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@H](C)[N@@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC000647977779 386578991 /nfs/dbraw/zinc/57/89/91/386578991.db2.gz HNSXPYOXGFAIQT-MELADBBJSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1C[C@@H](C[NH2+]CCc2cccs2)CC[NH2+]1 ZINC000415079999 386584168 /nfs/dbraw/zinc/58/41/68/386584168.db2.gz IZBBLDOJDQHLSG-RYUDHWBXSA-N 2 0 238.400 2.268 20 0 BEADRP Cc1ccccc1C[C@H](C)[NH2+]C[C@H]([NH3+])C(C)C ZINC000414800599 386587032 /nfs/dbraw/zinc/58/70/32/386587032.db2.gz SEXYALYYPMQVNC-ZFWWWQNUSA-N 2 0 234.387 2.499 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](C)c1ccccn1 ZINC000336644143 386588287 /nfs/dbraw/zinc/58/82/87/386588287.db2.gz BUURXPOQQGXHLM-RYUDHWBXSA-N 2 0 221.348 2.250 20 0 BEADRP c1ccc2c(c1)CC[C@H]2C[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000415081654 386590390 /nfs/dbraw/zinc/59/03/90/386590390.db2.gz NBSFGMNTRZANOQ-ZFWWWQNUSA-N 2 0 244.382 2.306 20 0 BEADRP c1ccc2c(c1)CC[C@H]2C[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000415081650 386590792 /nfs/dbraw/zinc/59/07/92/386590792.db2.gz NBSFGMNTRZANOQ-HIFRSBDPSA-N 2 0 244.382 2.306 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+][C@@H](CN)C1CC1 ZINC000414799998 386593000 /nfs/dbraw/zinc/59/30/00/386593000.db2.gz FKMOHXKESBMQOC-APPZFPTMSA-N 2 0 224.270 2.044 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@@H]1CC[C@H](C)[C@H](C)C1 ZINC000414802373 386596287 /nfs/dbraw/zinc/59/62/87/386596287.db2.gz VOPJLLUAVNJKEV-UMSGYPCISA-N 2 0 212.381 2.384 20 0 BEADRP Cc1ccccc1C[NH2+][C@@H]1CC[C@H](C[NH3+])C1 ZINC000415044500 386530992 /nfs/dbraw/zinc/53/09/92/386530992.db2.gz STQDSMSVOOCWFQ-GXTWGEPZSA-N 2 0 218.344 2.212 20 0 BEADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+]CC2CCCCC2)C1 ZINC000415046331 386532298 /nfs/dbraw/zinc/53/22/98/386532298.db2.gz UZPIGGYHVFIZLJ-CHWSQXEVSA-N 2 0 210.365 2.284 20 0 BEADRP C[C@H](CCc1ccsc1)[NH2+][C@H](CN)C1CC1 ZINC000414803038 386596651 /nfs/dbraw/zinc/59/66/51/386596651.db2.gz IYSOZUZHGRPCHC-ZWNOBZJWSA-N 2 0 238.400 2.396 20 0 BEADRP [NH3+]C[C@H]1CC[C@@H]([NH2+]Cc2ccc(F)cc2)C1 ZINC000415047827 386533745 /nfs/dbraw/zinc/53/37/45/386533745.db2.gz WFVCOSABCSHRQY-WCQYABFASA-N 2 0 222.307 2.043 20 0 BEADRP CCC1(C)CC[NH+](CC2CC[NH2+]CC2)CC1 ZINC000062954059 386534750 /nfs/dbraw/zinc/53/47/50/386534750.db2.gz UPYFCMDBDQNYBZ-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP CCC1(C)CC[NH+](C[C@@H]2CCC[NH2+]C2)CC1 ZINC000062953995 386535675 /nfs/dbraw/zinc/53/56/75/386535675.db2.gz PEZRWIOKHNSKOF-CYBMUJFWSA-N 2 0 224.392 2.498 20 0 BEADRP Nc1cc(C[N@@H+]2CCC[C@H]3CCC[C@H]32)ccn1 ZINC000228053163 386535796 /nfs/dbraw/zinc/53/57/96/386535796.db2.gz BCVLDQAFDUAHQT-CHWSQXEVSA-N 2 0 231.343 2.428 20 0 BEADRP C[C@@H]1C[N@@H+]([C@@H]2CCC[C@H]2C2CC2)C[C@@]1(C)C[NH3+] ZINC000415060102 386540120 /nfs/dbraw/zinc/54/01/20/386540120.db2.gz TYVVEGCICQJTNV-FAAHXZRKSA-N 2 0 236.403 2.482 20 0 BEADRP CC(C)(C)CC[NH2+][C@@H](CN)C(C)(C)C ZINC000415059797 386540700 /nfs/dbraw/zinc/54/07/00/386540700.db2.gz ZDNCSIIKELYYPF-JTQLQIEISA-N 2 0 200.370 2.386 20 0 BEADRP C(C[NH2+]C1CC1)C[NH2+][C@@H]1CCC[C@H]1C1CC1 ZINC000415064263 386543906 /nfs/dbraw/zinc/54/39/06/386543906.db2.gz CDUMNPHXWGDTAG-UONOGXRCSA-N 2 0 222.376 2.297 20 0 BEADRP C(=C/c1ccccc1)\C[NH2+]CCC[NH2+]C1CC1 ZINC000415063610 386544670 /nfs/dbraw/zinc/54/46/70/386544670.db2.gz APTUHVOCROJRIW-XBXARRHUSA-N 2 0 230.355 2.432 20 0 BEADRP CCCC[C@H]1CCC[C@@H]1[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000415063856 386545579 /nfs/dbraw/zinc/54/55/79/386545579.db2.gz PLWYHOSRWJJDDB-PDWCTOEPSA-N 2 0 222.376 2.153 20 0 BEADRP CCC([NH3+])(CC)C[NH2+][C@H]1CCO[C@H](C(C)C)C1 ZINC000414802538 386597125 /nfs/dbraw/zinc/59/71/25/386597125.db2.gz BVUFOQMXCDCQJP-STQMWFEESA-N 2 0 242.407 2.297 20 0 BEADRP C[C@H]([NH3+])C[N@@H+]1CC[C@H]([C@@H]2CCCC2(C)C)C1 ZINC000647995265 386546876 /nfs/dbraw/zinc/54/68/76/386546876.db2.gz KBDZTNJYZDNYPV-AVGNSLFASA-N 2 0 224.392 2.482 20 0 BEADRP Cc1ccc(CCC[NH2+]CCC[NH2+]C2CC2)cn1 ZINC000415067059 386546981 /nfs/dbraw/zinc/54/69/81/386546981.db2.gz JXMTUAPNACKUKK-UHFFFAOYSA-N 2 0 247.386 2.054 20 0 BEADRP CCCC[N@@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC000647975303 386549018 /nfs/dbraw/zinc/54/90/18/386549018.db2.gz VNNXJHPPAJRXTC-UONOGXRCSA-N 2 0 224.392 2.498 20 0 BEADRP CC(C)C1CCC([NH2+][C@@H]2CCN(C)C2)CC1 ZINC000054556396 386556738 /nfs/dbraw/zinc/55/67/38/386556738.db2.gz XOLZPLLUGQOKJW-JXQTWKCFSA-N 2 0 224.392 2.495 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@@H]1CCC[C@H](C)[C@@H]1C ZINC000414794291 386557740 /nfs/dbraw/zinc/55/77/40/386557740.db2.gz LSVJAZJEJIXQTK-WUHRBBMRSA-N 2 0 212.381 2.384 20 0 BEADRP CC(C)([NH3+])C[NH2+][C@@H]1CCCC[C@@H]1C1CC1 ZINC000414796795 386569567 /nfs/dbraw/zinc/56/95/67/386569567.db2.gz CIPSBXBYLFYYJD-VXGBXAGGSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)([NH3+])C[NH2+][C@@H]1CCCC[C@H]1C1CC1 ZINC000414796788 386570920 /nfs/dbraw/zinc/57/09/20/386570920.db2.gz CIPSBXBYLFYYJD-NWDGAFQWSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)C[C@@H]([NH3+])CNc1ccc([C@H](C)[NH3+])cc1 ZINC000414809664 386621194 /nfs/dbraw/zinc/62/11/94/386621194.db2.gz VYSVDNWQCIOKNZ-WCQYABFASA-N 2 0 235.375 2.492 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCCC[NH2+]C1)C1CCCC1 ZINC000335497951 386624263 /nfs/dbraw/zinc/62/42/63/386624263.db2.gz BTPZLZUFFOAPGY-YPMHNXCESA-N 2 0 210.365 2.297 20 0 BEADRP CC1(C)CCC[C@H]([NH2+]CC2=CC[NH2+]CC2)C1 ZINC000335499431 386625097 /nfs/dbraw/zinc/62/50/97/386625097.db2.gz FBUHJQJQKYCPDK-ZDUSSCGKSA-N 2 0 222.376 2.465 20 0 BEADRP CC(C)(C)[C@@H]1CCC[C@@H]1[NH2+][C@H]1CC[NH2+]C1 ZINC000415123492 386626719 /nfs/dbraw/zinc/62/67/19/386626719.db2.gz NAAQURRZVSJOMF-TUAOUCFPSA-N 2 0 210.365 2.153 20 0 BEADRP CC[N@H+](C[C@]1(C)CC[NH2+]C1)C1CC(C)(C)C1 ZINC000415122795 386627373 /nfs/dbraw/zinc/62/73/73/386627373.db2.gz LXMXBHBWZCVSPK-CQSZACIVSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)(C)[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[NH2+]C1 ZINC000415123493 386628072 /nfs/dbraw/zinc/62/80/72/386628072.db2.gz NAAQURRZVSJOMF-UTUOFQBUSA-N 2 0 210.365 2.153 20 0 BEADRP C[NH2+]CCCN(C)Cc1cnc(C(C)C)s1 ZINC000415139952 386638758 /nfs/dbraw/zinc/63/87/58/386638758.db2.gz YCZSEVNCWYHMKB-UHFFFAOYSA-N 2 0 241.404 2.308 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]C[C@@H]2CC23CC3)[C@H](C)C1 ZINC000417372115 386643520 /nfs/dbraw/zinc/64/35/20/386643520.db2.gz WNMBSRCMFOYHCV-AGIUHOORSA-N 2 0 222.376 2.106 20 0 BEADRP C[C@@H]([NH3+])c1ccc(C[NH2+]CC[C@H]2CCOC2)cc1 ZINC000414815382 386649845 /nfs/dbraw/zinc/64/98/45/386649845.db2.gz PGJVJSNQMLQWHP-OCCSQVGLSA-N 2 0 248.370 2.223 20 0 BEADRP C[C@@H]([NH3+])c1ccc(NCC2CC[NH2+]CC2)cc1 ZINC000414816113 386653449 /nfs/dbraw/zinc/65/34/49/386653449.db2.gz WDHHOCBXWJENAR-LLVKDONJSA-N 2 0 233.359 2.118 20 0 BEADRP Fc1cccc(CCC[NH2+]C2CC[NH2+]CC2)c1 ZINC000415086248 386599592 /nfs/dbraw/zinc/59/95/92/386599592.db2.gz JIPCEGGCTZXLQV-UHFFFAOYSA-N 2 0 236.334 2.100 20 0 BEADRP C[C@H](C[NH2+][C@H]1CNCC[C@@H]1C)Cc1ccccc1 ZINC000414922964 386602223 /nfs/dbraw/zinc/60/22/23/386602223.db2.gz GPHDQXSXADLLOA-DZKIICNBSA-N 2 0 246.398 2.453 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+][C@@H](C)CCC(F)(F)F ZINC000414803861 386605928 /nfs/dbraw/zinc/60/59/28/386605928.db2.gz WYAKXFVDUZSYTR-IUCAKERBSA-N 2 0 226.286 2.290 20 0 BEADRP COC1CCC([NH2+][C@H]2CCCC[C@@H]2C[NH3+])CC1 ZINC000414805371 386612499 /nfs/dbraw/zinc/61/24/99/386612499.db2.gz POZSNNNWDOPWOB-RYSNWHEDSA-N 2 0 240.391 2.051 20 0 BEADRP C1CC2(C1)CC[C@H]2[NH2+][C@@H]1CCCC[NH2+]C1 ZINC000335495440 386616125 /nfs/dbraw/zinc/61/61/25/386616125.db2.gz IYSYJGYMVOFAGN-VXGBXAGGSA-N 2 0 208.349 2.051 20 0 BEADRP CC(C)([NH3+])C[NH2+][C@H]1C[C@@H]1C1CCCCC1 ZINC000415108045 386616893 /nfs/dbraw/zinc/61/68/93/386616893.db2.gz ONZJMJUVTPYVLH-NEPJUHHUSA-N 2 0 210.365 2.282 20 0 BEADRP C([NH2+][C@@H]1CCC[C@@H](C2CC2)C1)[C@@H]1CCC[NH2+]1 ZINC000414820061 386663518 /nfs/dbraw/zinc/66/35/18/386663518.db2.gz ACQVPDXUPYJIQA-MCIONIFRSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[NH2+]C1)c1ccccc1 ZINC000041231971 386666328 /nfs/dbraw/zinc/66/63/28/386666328.db2.gz QNXFKBXEIYLNOW-QWHCGFSZSA-N 2 0 218.344 2.337 20 0 BEADRP Fc1cccc(F)c1C[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000414824549 386682422 /nfs/dbraw/zinc/68/24/22/386682422.db2.gz AVRDTEOLALPFCC-JTQLQIEISA-N 2 0 240.297 2.054 20 0 BEADRP CC(C)[C@@H]1CCC[N@@H+]1C[C@@]1(C)CC[NH2+]C1 ZINC000226558047 386677568 /nfs/dbraw/zinc/67/75/68/386677568.db2.gz DGFYXAXNYDSJPT-STQMWFEESA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]([NH3+])CC[NH2+]C/C=C/c1ccc(F)cc1F ZINC000414821805 386678300 /nfs/dbraw/zinc/67/83/00/386678300.db2.gz LXEKUEQZABOICQ-PBKGFPTLSA-N 2 0 240.297 2.305 20 0 BEADRP CCCC[C@H](COC)[NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1 ZINC000414823774 386681073 /nfs/dbraw/zinc/68/10/73/386681073.db2.gz PJOHSRSCFPTQPO-BFHYXJOUSA-N 2 0 242.407 2.169 20 0 BEADRP CO[C@H](C[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1)CC(C)C ZINC000417379452 386656982 /nfs/dbraw/zinc/65/69/82/386656982.db2.gz UOIPWPRXNZVQHU-IHRRRGAJSA-N 2 0 242.407 2.120 20 0 BEADRP CN(C)c1ccccc1C[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000414927721 386709784 /nfs/dbraw/zinc/70/97/84/386709784.db2.gz PGOGHSIOPQRAEY-KGLIPLIRSA-N 2 0 247.386 2.112 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]C/C=C\c1ccccc1 ZINC000414830760 386709878 /nfs/dbraw/zinc/70/98/78/386709878.db2.gz CKGODURFDLENPY-XURPKSDJSA-N 2 0 218.344 2.145 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]C/C=C/c1ccc(F)cc1 ZINC000414830686 386710146 /nfs/dbraw/zinc/71/01/46/386710146.db2.gz CGQLAUARAJEWEB-PCAWENJQSA-N 2 0 236.334 2.284 20 0 BEADRP C[C@H](C[NH2+]C[C@H]1CCC[NH2+]C1)Cc1ccccc1 ZINC000414831008 386711156 /nfs/dbraw/zinc/71/11/56/386711156.db2.gz PBRBLCAFMCIHOU-HOCLYGCPSA-N 2 0 246.398 2.454 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CC[C@@H]2CC[NH2+]C2)C[C@H]1C ZINC000414824535 386683244 /nfs/dbraw/zinc/68/32/44/386683244.db2.gz AUVWIUYUHOVFCD-MQYQWHSLSA-N 2 0 224.392 2.400 20 0 BEADRP CC[C@H](Cc1ccccc1)[NH2+]CC[C@H](C)[NH3+] ZINC000414823409 386685021 /nfs/dbraw/zinc/68/50/21/386685021.db2.gz OMXAKGCGZQXINE-GXTWGEPZSA-N 2 0 220.360 2.335 20 0 BEADRP Fc1ccc(/C=C\C[NH2+]C[C@@H]2CCC[NH2+]C2)cc1 ZINC000414826928 386686392 /nfs/dbraw/zinc/68/63/92/386686392.db2.gz KASMKRLUWOIBMC-VXYRWZGASA-N 2 0 248.345 2.428 20 0 BEADRP Fc1ccc(/C=C/C[NH2+]C[C@H]2CCC[NH2+]C2)cc1 ZINC000414826929 386688354 /nfs/dbraw/zinc/68/83/54/386688354.db2.gz KASMKRLUWOIBMC-XYHHVPKHSA-N 2 0 248.345 2.428 20 0 BEADRP Cc1ccc([C@H]2CCC[N@@H+]2CCOCC[NH3+])cc1 ZINC000357022790 386691112 /nfs/dbraw/zinc/69/11/12/386691112.db2.gz CCUZZZLOYAEDEC-OAHLLOKOSA-N 2 0 248.370 2.107 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@H]1Cc2ccc(Cl)cc2C1 ZINC000414825411 386691499 /nfs/dbraw/zinc/69/14/99/386691499.db2.gz SPZKNPCLVZIWMU-ZANVPECISA-N 2 0 238.762 2.134 20 0 BEADRP CC[C@@H](C)[N@@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000337256637 386692171 /nfs/dbraw/zinc/69/21/71/386692171.db2.gz SMVXTMXOIQISSJ-TZMCWYRMSA-N 2 0 224.392 2.449 20 0 BEADRP CCCC[C@@H](COC)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000414829124 386701299 /nfs/dbraw/zinc/70/12/99/386701299.db2.gz NDKLEEAIWZIFEB-WJLOJVBCSA-N 2 0 240.391 2.064 20 0 BEADRP CNCC[NH2+]C[C@H](C)CCc1ccccc1 ZINC000414836821 386732003 /nfs/dbraw/zinc/73/20/03/386732003.db2.gz WLQXXSOTXFBUNL-CYBMUJFWSA-N 2 0 220.360 2.064 20 0 BEADRP Cc1ccc(CC[N@@H+]2CC[C@@H]3C[NH2+]C[C@H]3C2)cc1 ZINC000334141478 386739825 /nfs/dbraw/zinc/73/98/25/386739825.db2.gz HMNOKLIRGOARLQ-CVEARBPZSA-N 2 0 244.382 2.079 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]Cc1ccc(Cl)cc1 ZINC000414833738 386712869 /nfs/dbraw/zinc/71/28/69/386712869.db2.gz GSYZHOVHZHYXQL-JTQLQIEISA-N 2 0 226.751 2.285 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CCC[C@H]1C(C)C ZINC000414833683 386713047 /nfs/dbraw/zinc/71/30/47/386713047.db2.gz GQACPMYDYDOSFD-RWMBFGLXSA-N 2 0 212.381 2.256 20 0 BEADRP CC[C@H](C[N@@H+]1C[C@H](C)[C@H]([NH3+])C1)c1ccccc1 ZINC000340692946 386713868 /nfs/dbraw/zinc/71/38/68/386713868.db2.gz WNSMXQITFCZKTH-GZBFAFLISA-N 2 0 232.371 2.459 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H](C)CC1CCCC1 ZINC000414833087 386714068 /nfs/dbraw/zinc/71/40/68/386714068.db2.gz GCGBQZBLHZZGIT-VXGBXAGGSA-N 2 0 212.381 2.400 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]C/C=C/c1ccccc1OC ZINC000414833104 386714946 /nfs/dbraw/zinc/71/49/46/386714946.db2.gz GDEWUTMFHNMDDA-STMXVASLSA-N 2 0 248.370 2.154 20 0 BEADRP C[C@H]1CC([NH2+]CC[C@H]2CC[NH2+]C2)C[C@H](C)C1 ZINC000414832261 386716240 /nfs/dbraw/zinc/71/62/40/386716240.db2.gz OGUIDLYWPUWSJZ-JHJVBQTASA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H]1CCC[C@@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000414833894 386717255 /nfs/dbraw/zinc/71/72/55/386717255.db2.gz RUFXIJYFRLKPCC-UVYIHGJDSA-N 2 0 208.349 2.048 20 0 BEADRP Cc1cc(C[NH+]2CCC(C[NH3+])CC2)ccc1F ZINC000050559342 386727453 /nfs/dbraw/zinc/72/74/53/386727453.db2.gz SPTWGDITPMSKSJ-UHFFFAOYSA-N 2 0 236.334 2.305 20 0 BEADRP CCCC[C@@H](CC)[NH2+]C[C@@H](C)C[NH2+]C ZINC000414840838 386752263 /nfs/dbraw/zinc/75/22/63/386752263.db2.gz NPPCPPDOCSEUPT-NWDGAFQWSA-N 2 0 200.370 2.400 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]Cc1ccc(C)cc1C ZINC000414844003 386769611 /nfs/dbraw/zinc/76/96/11/386769611.db2.gz QVJSPZJGCOBICA-GFCCVEGCSA-N 2 0 220.360 2.249 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000414841250 386754562 /nfs/dbraw/zinc/75/45/62/386754562.db2.gz ZBUQDSDYOROJFI-KZKMVBDOSA-N 2 0 208.349 2.048 20 0 BEADRP CCSCC[C@@H](C)[N@H+](C)C[C@]1(C)CC[NH2+]C1 ZINC000340712586 386761504 /nfs/dbraw/zinc/76/15/04/386761504.db2.gz PNEKRJAQTYOIDQ-CHWSQXEVSA-N 2 0 244.448 2.450 20 0 BEADRP CCC(CC)C[NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1 ZINC000414842558 386763351 /nfs/dbraw/zinc/76/33/51/386763351.db2.gz BKHOABKXGVYNQH-WCQYABFASA-N 2 0 212.381 2.400 20 0 BEADRP CSC1(C[NH2+][C@H](C)C(C)C)CC[NH+](C)CC1 ZINC000336664452 386765011 /nfs/dbraw/zinc/76/50/11/386765011.db2.gz DWAVJQLAAPYDPB-GFCCVEGCSA-N 2 0 244.448 2.448 20 0 BEADRP CC1(C)CCC[C@H]1[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000414839376 386741019 /nfs/dbraw/zinc/74/10/19/386741019.db2.gz WGDGBJUUYAKZJJ-NWDGAFQWSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+]C[C@H](N)c1ccccc1 ZINC000414839312 386743659 /nfs/dbraw/zinc/74/36/59/386743659.db2.gz VYQOOWUMTRCRPP-XBFCOCLRSA-N 2 0 218.344 2.465 20 0 BEADRP [NH3+]C[C@@H]1CCCN1Cc1ccc2ncccc2c1 ZINC000020248445 386789456 /nfs/dbraw/zinc/78/94/56/386789456.db2.gz IJBPLWVOZBVUKG-AWEZNQCLSA-N 2 0 241.338 2.158 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]Cc1cc(F)ccc1C ZINC000414845304 386791611 /nfs/dbraw/zinc/79/16/11/386791611.db2.gz SDASFVGPXILAKG-JTQLQIEISA-N 2 0 224.323 2.079 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@H]1CC2CCC1CC2 ZINC000336744049 386795684 /nfs/dbraw/zinc/79/56/84/386795684.db2.gz YUZQGSGXEZPPLU-WTIISPKJSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@@H]1CCC1(C)C ZINC000336666502 386780481 /nfs/dbraw/zinc/78/04/81/386780481.db2.gz DLOASOGNUXHFFU-GFCCVEGCSA-N 2 0 212.381 2.495 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+][C@H]1CC[NH2+]C[C@@H]1C ZINC000414933271 386787078 /nfs/dbraw/zinc/78/70/78/386787078.db2.gz DLNKPLWWVPATLC-AEJSXWLSSA-N 2 0 238.297 2.305 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]Cc1ccc(C)c(C)c1 ZINC000414845865 386803648 /nfs/dbraw/zinc/80/36/48/386803648.db2.gz TXNPVADIXPTBEA-NSHDSACASA-N 2 0 220.360 2.249 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCc2ccccc21)C[NH+](C)C ZINC000293303827 386812453 /nfs/dbraw/zinc/81/24/53/386812453.db2.gz DURDTMUZBCXRBN-DOMZBBRYSA-N 2 0 232.371 2.461 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]Cc1cc(C)ccc1C ZINC000414847237 386831246 /nfs/dbraw/zinc/83/12/46/386831246.db2.gz VTJUJPYOVSJCNN-GFCCVEGCSA-N 2 0 220.360 2.249 20 0 BEADRP CCC[C@H](C)C[NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1 ZINC000414847539 386838331 /nfs/dbraw/zinc/83/83/31/386838331.db2.gz FSWLXOVYRCLVTL-RWMBFGLXSA-N 2 0 212.381 2.400 20 0 BEADRP CS[C@@H]1CC[C@@H]1[NH2+]C[C@H](C)C[NH+]1CCCC1 ZINC000425340152 386838856 /nfs/dbraw/zinc/83/88/56/386838856.db2.gz DLYDFDFLBIASPX-RWMBFGLXSA-N 2 0 242.432 2.202 20 0 BEADRP CS[C@@H]1CC[C@@H]1[NH2+]C[C@@H](C)C[NH+]1CCCC1 ZINC000425340150 386839408 /nfs/dbraw/zinc/83/94/08/386839408.db2.gz DLYDFDFLBIASPX-FRRDWIJNSA-N 2 0 242.432 2.202 20 0 BEADRP CC[C@H](C[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21)OC ZINC000336674146 386842481 /nfs/dbraw/zinc/84/24/81/386842481.db2.gz BVPHRXYUJSGEOA-LERXQTSPSA-N 2 0 234.343 2.146 20 0 BEADRP CC[C@H](C[NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21)OC ZINC000336674145 386843109 /nfs/dbraw/zinc/84/31/09/386843109.db2.gz BVPHRXYUJSGEOA-HONMWMINSA-N 2 0 234.343 2.146 20 0 BEADRP CCSCCC[NH2+][C@H](C)[C@H]1CCCC[NH2+]1 ZINC000395078391 386847732 /nfs/dbraw/zinc/84/77/32/386847732.db2.gz NMPHQRODYMNBGT-VXGBXAGGSA-N 2 0 230.421 2.250 20 0 BEADRP CCSCC[NH2+]CCN1CCCC(C)(C)C1 ZINC000336674494 386853052 /nfs/dbraw/zinc/85/30/52/386853052.db2.gz AVKYMWVAEVJZHW-UHFFFAOYSA-N 2 0 244.448 2.451 20 0 BEADRP CCc1cc(N2CC[C@H]3CC[N@H+](C)C[C@H]32)cc[nH+]1 ZINC000334790251 386854657 /nfs/dbraw/zinc/85/46/57/386854657.db2.gz MJNXZWLNSIKTCV-IUODEOHRSA-N 2 0 245.370 2.174 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@@H]1CC[C@H](C)C[C@@H]1C ZINC000414937895 386856594 /nfs/dbraw/zinc/85/65/94/386856594.db2.gz CTFAYSLCCXFWMZ-WUHRBBMRSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@@H](CCC1CC1)[NH2+]C1CCC([NH3+])CC1 ZINC000336745081 386894047 /nfs/dbraw/zinc/89/40/47/386894047.db2.gz QNZWZOFJXRSBKG-PKSQDBQZSA-N 2 0 210.365 2.425 20 0 BEADRP Cc1c[nH+]ccc1N1CC[C@@H]([NH+]2CCCCC2)C1 ZINC000335749659 386874703 /nfs/dbraw/zinc/87/47/03/386874703.db2.gz FPEFIEJAELCBAQ-CQSZACIVSA-N 2 0 245.370 2.455 20 0 BEADRP CC(C)C[C@H](C)C[NH2+][C@H]1CC[NH2+]C[C@H]1C ZINC000414940186 386876367 /nfs/dbraw/zinc/87/63/67/386876367.db2.gz JYXYXAAPVRMMKC-XQQFMLRXSA-N 2 0 212.381 2.256 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+]Cc1cc(Cl)cs1 ZINC000334839794 386884817 /nfs/dbraw/zinc/88/48/17/386884817.db2.gz BCIYHYLTXHFBCE-LDYMZIIASA-N 2 0 244.791 2.489 20 0 BEADRP Cc1ccc(C[NH2+]C2(C)CC[NH2+]CC2)s1 ZINC000334842120 386889256 /nfs/dbraw/zinc/88/92/56/386889256.db2.gz KTEHAAMQJCJGHZ-UHFFFAOYSA-N 2 0 224.373 2.288 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CC[NH2+]C[C@@H]2C)c(C)c1 ZINC000334853605 386904724 /nfs/dbraw/zinc/90/47/24/386904724.db2.gz FAKOIAUYVCNPIO-DZGCQCFKSA-N 2 0 232.371 2.391 20 0 BEADRP Cc1cc(F)ccc1C[NH2+][C@H]1CC[NH2+]C[C@H]1C ZINC000334859672 386912385 /nfs/dbraw/zinc/91/23/85/386912385.db2.gz ZWOXBBQUGZXNCL-RISCZKNCSA-N 2 0 236.334 2.222 20 0 BEADRP C[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)C(C)(C)C ZINC000336762210 386920475 /nfs/dbraw/zinc/92/04/75/386920475.db2.gz NXYWDZLJYGTDLC-LLVKDONJSA-N 2 0 210.365 2.273 20 0 BEADRP C[C@]1(C[NH2+][C@@H]2CCc3ccccc32)CC[NH2+]C1 ZINC000334865161 386921543 /nfs/dbraw/zinc/92/15/43/386921543.db2.gz RALDCXZVLJRHPB-CABCVRRESA-N 2 0 230.355 2.263 20 0 BEADRP Cc1cc(F)ccc1C[NH2+][C@H]1CC[NH2+][C@H](C)C1 ZINC000334865323 386922040 /nfs/dbraw/zinc/92/20/40/386922040.db2.gz SIVQNLGDMOOZNW-RISCZKNCSA-N 2 0 236.334 2.364 20 0 BEADRP Fc1cccc2c1CC[C@H]2[NH2+]C1CC[NH2+]CC1 ZINC000334865383 386922532 /nfs/dbraw/zinc/92/25/32/386922532.db2.gz UBPPFUGKNNLSNF-CQSZACIVSA-N 2 0 234.318 2.155 20 0 BEADRP Cc1ccccc1C[NH2+][C@@H]1CC[NH2+][C@@H](C)C1 ZINC000334866451 386924593 /nfs/dbraw/zinc/92/45/93/386924593.db2.gz WNJMFFPKSNPTAV-GXTWGEPZSA-N 2 0 218.344 2.225 20 0 BEADRP CC(C)C[N@@H+]1CCCC[C@@H]1[C@@H]1CC[NH2+]C1 ZINC000334866851 386924694 /nfs/dbraw/zinc/92/46/94/386924694.db2.gz CVXUKJKHQOJTEK-CHWSQXEVSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H](O)CC(C)(C)C[NH2+][C@@H]1CCCCC[C@@H]1[NH3+] ZINC000331968558 386932339 /nfs/dbraw/zinc/93/23/39/386932339.db2.gz LEQGSNVSKSGETK-RWMBFGLXSA-N 2 0 242.407 2.033 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+]C1CCCC1 ZINC000334875985 386936091 /nfs/dbraw/zinc/93/60/91/386936091.db2.gz PZFDTMHDEJVPLN-UYVFGJEYSA-N 2 0 208.349 2.035 20 0 BEADRP C[C@@H]1C[C@@H](C[N@@H+]2CCCC23CCC3)CC[NH2+]1 ZINC000334816832 386942703 /nfs/dbraw/zinc/94/27/03/386942703.db2.gz BXKZKMZPOMJAIM-OLZOCXBDSA-N 2 0 222.376 2.393 20 0 BEADRP CS[C@@H]1CC[C@@H]1[NH2+]CCC[NH+]1CCCCC1 ZINC000425363011 386970907 /nfs/dbraw/zinc/97/09/07/386970907.db2.gz WFKKQDPTYQOXTJ-QWHCGFSZSA-N 2 0 242.432 2.346 20 0 BEADRP CS[C@H]1CC[C@H]1[NH2+]CCC1CC[NH+](C)CC1 ZINC000425361167 386980404 /nfs/dbraw/zinc/98/04/04/386980404.db2.gz TVBSXPPUCVKOFQ-OLZOCXBDSA-N 2 0 242.432 2.202 20 0 BEADRP c1ccc2c(c1)CCC[C@H]2[N@@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC000107856104 387036786 /nfs/dbraw/zinc/03/67/86/387036786.db2.gz PUJHUFLTTXDVAQ-IJEWVQPXSA-N 2 0 242.366 2.215 20 0 BEADRP Cc1cc(NC2CCC([NH+](C)C)CC2)cc[nH+]1 ZINC000334966316 387049402 /nfs/dbraw/zinc/04/94/02/387049402.db2.gz HOBWZQGISVFABM-UHFFFAOYSA-N 2 0 233.359 2.097 20 0 BEADRP CC[C@H]1CCC[N@H+](C[C@@H]2CCC[NH2+]C2)CC1 ZINC000070613546 387070117 /nfs/dbraw/zinc/07/01/17/387070117.db2.gz QFISPLDUTYATLE-UONOGXRCSA-N 2 0 224.392 2.498 20 0 BEADRP COCc1cccc(C[N@@H+]2CC[C@H]([C@H](C)[NH3+])C2)c1 ZINC000126930092 387074737 /nfs/dbraw/zinc/07/47/37/387074737.db2.gz SABPAEWTOLOIJM-WFASDCNBSA-N 2 0 248.370 2.002 20 0 BEADRP CC[C@@H]([NH2+]C[C@H](C)C[NH3+])c1ccccc1F ZINC000423299015 387130868 /nfs/dbraw/zinc/13/08/68/387130868.db2.gz BGSGCSSTIBNKHJ-ZWNOBZJWSA-N 2 0 224.323 2.461 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CCC[NH2+]C1)c1nccs1 ZINC000070733437 387090165 /nfs/dbraw/zinc/09/01/65/387090165.db2.gz URUNTABGTHJDTF-GHMZBOCLSA-N 2 0 239.388 2.183 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H]1c2ccccc2C[C@H]1C ZINC000423299935 387131329 /nfs/dbraw/zinc/13/13/29/387131329.db2.gz QODDEZIJDQBZIP-GYSYKLTISA-N 2 0 218.344 2.104 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+]Cc1cccc(F)c1 ZINC000335010110 387105042 /nfs/dbraw/zinc/10/50/42/387105042.db2.gz NNVVDZIXKWMKLC-SMDDNHRTSA-N 2 0 236.334 2.303 20 0 BEADRP COCC[N@H+](CC[C@@H]1CCC[NH+]1C)CC(C)C ZINC000119167131 387105148 /nfs/dbraw/zinc/10/51/48/387105148.db2.gz AZGOHUZNRVOBDQ-AWEZNQCLSA-N 2 0 242.407 2.075 20 0 BEADRP CCCc1cccc(C[N@H+]2C[C@H]3C[NH2+]C[C@H]3C2)c1 ZINC000359475288 387107837 /nfs/dbraw/zinc/10/78/37/387107837.db2.gz RGHLAVPMMFGRBC-IYBDPMFKSA-N 2 0 244.382 2.290 20 0 BEADRP CCc1ccccc1C[N@@H+]1CC[C@@H](C[NH2+]C)C1 ZINC000112706341 387109678 /nfs/dbraw/zinc/10/96/78/387109678.db2.gz IEFHJPYMZNTKOK-ZDUSSCGKSA-N 2 0 232.371 2.290 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]C1CCC(F)(F)CC1 ZINC000335028048 387120288 /nfs/dbraw/zinc/12/02/88/387120288.db2.gz VUGFMIXHXYJRNF-NXEZZACHSA-N 2 0 218.291 2.034 20 0 BEADRP CCC1CC([NH2+]CCC[N@H+](C)C(C)C)C1 ZINC000336767182 387121982 /nfs/dbraw/zinc/12/19/82/387121982.db2.gz SIZFHJVAEHAUKK-UHFFFAOYSA-N 2 0 212.381 2.495 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H]1c2ccccc2C[C@@H]1C ZINC000423299937 387132248 /nfs/dbraw/zinc/13/22/48/387132248.db2.gz QODDEZIJDQBZIP-SUNKGSAMSA-N 2 0 218.344 2.104 20 0 BEADRP C[C@H](C[NH2+][C@@H](C)[C@H]1CCC[NH2+]C1)C(F)(F)F ZINC000643482103 387128176 /nfs/dbraw/zinc/12/81/76/387128176.db2.gz FIKZPXIHJZBSTD-UTLUCORTSA-N 2 0 238.297 2.163 20 0 BEADRP CC[C@H]([NH2+]C[C@H](C)C[NH3+])c1ccccc1F ZINC000423299014 387129671 /nfs/dbraw/zinc/12/96/71/387129671.db2.gz BGSGCSSTIBNKHJ-MFKMUULPSA-N 2 0 224.323 2.461 20 0 BEADRP CC(C)CC[C@H]1CCC[C@H]1[NH2+]CC1C[NH2+]C1 ZINC000423305817 387141713 /nfs/dbraw/zinc/14/17/13/387141713.db2.gz RSEMBBVLXUFDED-ZIAGYGMSSA-N 2 0 224.392 2.400 20 0 BEADRP CCC[NH2+]CC[NH2+]C1CCC(C(F)F)CC1 ZINC000423307525 387143870 /nfs/dbraw/zinc/14/38/70/387143870.db2.gz GXQLEFQJDPQWMG-UHFFFAOYSA-N 2 0 234.334 2.400 20 0 BEADRP CC[C@H]([NH2+]CC1C[NH2+]C1)c1cccc(F)c1 ZINC000423308032 387143983 /nfs/dbraw/zinc/14/39/83/387143983.db2.gz XBGZNEZPFUQISF-ZDUSSCGKSA-N 2 0 222.307 2.086 20 0 BEADRP CC[C@@H]1CCCC[C@H]1[NH2+]C[C@@H]([NH3+])C1CC1 ZINC000423310662 387145651 /nfs/dbraw/zinc/14/56/51/387145651.db2.gz APDJGHVLDVYFFX-RAIGVLPGSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)[C@@H](Cc1ccccc1)[NH2+]C[C@H](C)C[NH3+] ZINC000423312776 387151561 /nfs/dbraw/zinc/15/15/61/387151561.db2.gz VSFXWEFRBNKUSP-UKRRQHHQSA-N 2 0 234.387 2.438 20 0 BEADRP [NH3+][C@@H](C[NH2+]C1CCc2ccccc2CC1)C1CC1 ZINC000423314393 387153183 /nfs/dbraw/zinc/15/31/83/387153183.db2.gz GYLBROFQCXYGAU-INIZCTEOSA-N 2 0 244.382 2.261 20 0 BEADRP [NH3+][C@H](C[NH2+]C1CCc2ccccc2CC1)C1CC1 ZINC000423314394 387153880 /nfs/dbraw/zinc/15/38/80/387153880.db2.gz GYLBROFQCXYGAU-MRXNPFEDSA-N 2 0 244.382 2.261 20 0 BEADRP Cc1ccc(CN2CC[C@H](C[NH+](C)C)C2)c(C)n1 ZINC000187037462 387154154 /nfs/dbraw/zinc/15/41/54/387154154.db2.gz NVKADUDPOILNBD-CQSZACIVSA-N 2 0 247.386 2.082 20 0 BEADRP [NH3+][C@H](C[NH2+][C@@H]1CCC12CCCC2)C1CC1 ZINC000423318371 387159421 /nfs/dbraw/zinc/15/94/21/387159421.db2.gz KXEDPNPXRLUECB-VXGBXAGGSA-N 2 0 208.349 2.036 20 0 BEADRP CCc1ccc([C@@H](C)[NH2+]CCCC[NH3+])o1 ZINC000423321776 387164492 /nfs/dbraw/zinc/16/44/92/387164492.db2.gz FYCMPXGBQHAOIN-SNVBAGLBSA-N 2 0 210.321 2.232 20 0 BEADRP CC1(C)CCC[C@@H]([NH2+]C[C@H]([NH3+])C2CC2)C1 ZINC000423322655 387165299 /nfs/dbraw/zinc/16/52/99/387165299.db2.gz OBZBUDDLNNZOSK-NEPJUHHUSA-N 2 0 210.365 2.282 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000423324195 387168555 /nfs/dbraw/zinc/16/85/55/387168555.db2.gz AUCHGCAISRRIRV-DZGCQCFKSA-N 2 0 247.386 2.430 20 0 BEADRP C[C@@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)c1ccncc1 ZINC000423328485 387170329 /nfs/dbraw/zinc/17/03/29/387170329.db2.gz DSHDMUDFWMWQMJ-OCCSQVGLSA-N 2 0 233.359 2.122 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000423330710 387175101 /nfs/dbraw/zinc/17/51/01/387175101.db2.gz GAWBWIARFOCWBV-OCCSQVGLSA-N 2 0 236.359 2.190 20 0 BEADRP CCC[C@@H]([NH2+]C[C@@H]1CC[NH2+]C1)C(C)(C)C ZINC000423330727 387175945 /nfs/dbraw/zinc/17/59/45/387175945.db2.gz GBVQJSJGBLFEDY-VXGBXAGGSA-N 2 0 212.381 2.400 20 0 BEADRP Cc1cncc([C@H](C)[NH2+]C[C@]2(C)CCC[NH2+]C2)c1 ZINC000423334938 387181110 /nfs/dbraw/zinc/18/11/10/387181110.db2.gz IMBIJDJYDVYNRN-DZGCQCFKSA-N 2 0 247.386 2.430 20 0 BEADRP C[C@H]([NH2+]CC1(C)CC[NH2+]CC1)C1(C)CC1 ZINC000423337058 387184414 /nfs/dbraw/zinc/18/44/14/387184414.db2.gz SWTPUDSBYUVELH-NSHDSACASA-N 2 0 210.365 2.154 20 0 BEADRP CC(C)[C@@H]1CCC[C@H]1[NH2+]CC1=CC[NH2+]CC1 ZINC000423337978 387185905 /nfs/dbraw/zinc/18/59/05/387185905.db2.gz HWMLHEZSSDAHQD-UONOGXRCSA-N 2 0 222.376 2.320 20 0 BEADRP C[C@H]([NH2+]CC1=CC[NH2+]CC1)c1ccc(F)cc1 ZINC000423337026 387186483 /nfs/dbraw/zinc/18/64/83/387186483.db2.gz HCAPBNHNUUDCGG-NSHDSACASA-N 2 0 234.318 2.396 20 0 BEADRP CC[C@H]([NH2+]C1CCC([NH3+])CC1)C1CCC1 ZINC000322396646 259706094 /nfs/dbraw/zinc/70/60/94/259706094.db2.gz QKEHUPGWDDZCLL-BPCQOVAHSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@H]([NH2+]CC1=CC[NH2+]CC1)C1CCSCC1 ZINC000423341707 387190149 /nfs/dbraw/zinc/19/01/49/387190149.db2.gz KERUJMSSCDHMKA-NSHDSACASA-N 2 0 240.416 2.027 20 0 BEADRP CC[C@@H]1CCC[C@@H]([NH2+]CC2=CC[NH2+]CC2)C1 ZINC000423340332 387191104 /nfs/dbraw/zinc/19/11/04/387191104.db2.gz JJXJVMVNJNHWMJ-TZMCWYRMSA-N 2 0 222.376 2.465 20 0 BEADRP CC(=O)Nc1ccc([C@H](C)[NH2+]CCCC[NH3+])cc1 ZINC000423343179 387191703 /nfs/dbraw/zinc/19/17/03/387191703.db2.gz ZIURNGVDJTTZJR-NSHDSACASA-N 2 0 249.358 2.035 20 0 BEADRP COc1ccc([C@@H](C)[NH2+]CC2=CC[NH2+]CC2)cc1 ZINC000423344367 387192029 /nfs/dbraw/zinc/19/20/29/387192029.db2.gz MPUDGVRZGQSDTP-GFCCVEGCSA-N 2 0 246.354 2.266 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@H](Cc1ccccc1)C1CC1 ZINC000423302870 387134746 /nfs/dbraw/zinc/13/47/46/387134746.db2.gz WDRWGJOWWFVCHZ-SWLSCSKDSA-N 2 0 232.371 2.192 20 0 BEADRP CCC[C@H]([NH2+]C[C@H](C)C[NH3+])C(C)(C)C ZINC000423302340 387135315 /nfs/dbraw/zinc/13/53/15/387135315.db2.gz HDYSKEBIIOAASR-MNOVXSKESA-N 2 0 200.370 2.386 20 0 BEADRP Cc1cc([C@@H](C)[NH2+]C[C@@H](C)C[NH3+])oc1C ZINC000423302390 387135507 /nfs/dbraw/zinc/13/55/07/387135507.db2.gz HIAIRMNXBXMWHE-WCBMZHEXSA-N 2 0 210.321 2.142 20 0 BEADRP CC[C@@H]([NH2+]CC1C[NH2+]C1)c1cccs1 ZINC000423304704 387140252 /nfs/dbraw/zinc/14/02/52/387140252.db2.gz OVOSVBPYZAXRKM-SNVBAGLBSA-N 2 0 210.346 2.008 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+]CC2=CC[NH2+]CC2)o1 ZINC000423350557 387202421 /nfs/dbraw/zinc/20/24/21/387202421.db2.gz ZRIGZYGGGBKSNN-LLVKDONJSA-N 2 0 220.316 2.158 20 0 BEADRP C[C@H](CC1CCCC1)[NH2+]CC1=CC[NH2+]CC1 ZINC000423350615 387202612 /nfs/dbraw/zinc/20/26/12/387202612.db2.gz ZXPARBWYYQTQAC-GFCCVEGCSA-N 2 0 222.376 2.465 20 0 BEADRP Cc1c[nH+]ccc1N1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000336372187 387203777 /nfs/dbraw/zinc/20/37/77/387203777.db2.gz VVBHDRWGTXRZMH-AWEZNQCLSA-N 2 0 245.370 2.312 20 0 BEADRP FCCC[C@@H]1CCC[C@H]1[NH2+]CC1=CC[NH2+]CC1 ZINC000423352887 387205680 /nfs/dbraw/zinc/20/56/80/387205680.db2.gz KYQMHFZWJCWOSC-UONOGXRCSA-N 2 0 240.366 2.414 20 0 BEADRP CC[C@@H]([NH2+]CC[C@H]1CCC[NH2+]1)C1CCC1 ZINC000423353407 387206309 /nfs/dbraw/zinc/20/63/09/387206309.db2.gz DBHBTIRTZYPMBC-CHWSQXEVSA-N 2 0 210.365 2.297 20 0 BEADRP C1=C(C[NH2+][C@@H]2CC[C@H]2C2CCC2)CC[NH2+]C1 ZINC000423356410 387208820 /nfs/dbraw/zinc/20/88/20/387208820.db2.gz QOQIOLLPBBPMIM-UONOGXRCSA-N 2 0 220.360 2.074 20 0 BEADRP C[C@]12C[C@H]1CCC[C@@H]2[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000423357895 387209464 /nfs/dbraw/zinc/20/94/64/387209464.db2.gz IWFCCJGOZKHZQK-MQYQWHSLSA-N 2 0 222.376 2.297 20 0 BEADRP COc1ccc([C@H](C)[NH2+]CC[C@H]2CCC[NH2+]2)cc1 ZINC000423357847 387210330 /nfs/dbraw/zinc/21/03/30/387210330.db2.gz IRJFJDGTDBGNRY-GXTWGEPZSA-N 2 0 248.370 2.488 20 0 BEADRP CC[C@@H](C)C[NH+]1CCC([NH2+]C(C)C)CC1 ZINC000120206984 387211243 /nfs/dbraw/zinc/21/12/43/387211243.db2.gz JFBZSXOSEOSVQV-GFCCVEGCSA-N 2 0 212.381 2.495 20 0 BEADRP Cc1cncc([C@H](C)[NH2+][C@@H]2CC[NH2+]C[C@@H]2C)c1 ZINC000423363220 387215493 /nfs/dbraw/zinc/21/54/93/387215493.db2.gz BOJGTQKOUJTPJJ-SGMGOOAPSA-N 2 0 233.359 2.039 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[NH2+]C[C@H]1C)C1CCSCC1 ZINC000423365096 387215702 /nfs/dbraw/zinc/21/57/02/387215702.db2.gz CVEVEBBQKUUCRF-WZRBSPASSA-N 2 0 242.432 2.106 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CCC[NH2+]1)[C@H]1CC1(C)C ZINC000423362672 387216696 /nfs/dbraw/zinc/21/66/96/387216696.db2.gz NIEUJAMJEGXAAG-IJLUTSLNSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@@H](C)C[N@H+](C)CC1CC[NH+](C)CC1 ZINC000120266241 387217424 /nfs/dbraw/zinc/21/74/24/387217424.db2.gz ACFQZXOQVFZYOH-GFCCVEGCSA-N 2 0 212.381 2.306 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@H]2CCC23CCC3)CC[NH2+]1 ZINC000423367302 387217531 /nfs/dbraw/zinc/21/75/31/387217531.db2.gz ADJVCKYKFPPFDF-WOPDTQHZSA-N 2 0 208.349 2.049 20 0 BEADRP CC(C)C1CC([NH2+][C@@H]2CCC[NH2+]CC2)C1 ZINC000643485089 387219925 /nfs/dbraw/zinc/21/99/25/387219925.db2.gz RTCRRPLYFBOYLF-OTTFEQOBSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)c1ccccc1 ZINC000423368281 387220603 /nfs/dbraw/zinc/22/06/03/387220603.db2.gz FCPUWTXTUUUBFP-YRGRVCCFSA-N 2 0 218.344 2.478 20 0 BEADRP [NH3+]CCC[N@@H+](Cc1ccccc1)CC1CC1 ZINC000230004502 387222476 /nfs/dbraw/zinc/22/24/76/387222476.db2.gz MNNSCKMYPHDBFL-UHFFFAOYSA-N 2 0 218.344 2.247 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000423369351 387223060 /nfs/dbraw/zinc/22/30/60/387223060.db2.gz OKRJDZUFSVUMDP-RTXFEEFZSA-N 2 0 222.332 2.070 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000423369349 387224837 /nfs/dbraw/zinc/22/48/37/387224837.db2.gz OKRJDZUFSVUMDP-KGYLQXTDSA-N 2 0 222.332 2.070 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@H]1[C@H](C)CCC[C@@H]1C ZINC000423373516 387226210 /nfs/dbraw/zinc/22/62/10/387226210.db2.gz HBSMDUZADGBYGU-XQHKEYJVSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)C1CCCC1 ZINC000423372287 387227776 /nfs/dbraw/zinc/22/77/76/387227776.db2.gz IFNUUSONVZECMX-NQBHXWOUSA-N 2 0 210.365 2.295 20 0 BEADRP CO[C@@H](c1ccccc1)[C@@H](C)[NH2+]CCCC[NH3+] ZINC000423325250 387229814 /nfs/dbraw/zinc/22/98/14/387229814.db2.gz LHJXHHSDUVIRCH-TZMCWYRMSA-N 2 0 236.359 2.091 20 0 BEADRP [NH3+]CCCC[NH2+][C@@H](c1cncc(F)c1)C1CC1 ZINC000423326845 387231744 /nfs/dbraw/zinc/23/17/44/387231744.db2.gz MMRNXTVYTXDHDH-CYBMUJFWSA-N 2 0 237.322 2.000 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@@H]1CCC[C@H]1CCCF ZINC000423403748 387239584 /nfs/dbraw/zinc/23/95/84/387239584.db2.gz ZMDUSNWGNZGMEB-FRRDWIJNSA-N 2 0 230.371 2.492 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000423346502 387195669 /nfs/dbraw/zinc/19/56/69/387195669.db2.gz PVOGTQFMKQEYFK-FRRDWIJNSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)C(C)(C)C ZINC000423346357 387195972 /nfs/dbraw/zinc/19/59/72/387195972.db2.gz ZZQFNROFPMBOIM-AAEUAGOBSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)[C@H]1CC1(C)C ZINC000423346761 387196699 /nfs/dbraw/zinc/19/66/99/387196699.db2.gz QCTGHGVOVXIATH-SCRDCRAPSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CC2=CC[NH2+]CC2)C[C@H]1C ZINC000423348182 387197850 /nfs/dbraw/zinc/19/78/50/387197850.db2.gz SCDQYSDEWFJVJE-YRGRVCCFSA-N 2 0 222.376 2.320 20 0 BEADRP CC[C@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)[C@H]1C[C@H]1C ZINC000423348060 387198264 /nfs/dbraw/zinc/19/82/64/387198264.db2.gz SJXDOBDJSZELOR-ZOBORPQBSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[C@@H]([NH3+])C1)c1ccncc1 ZINC000423465847 387312315 /nfs/dbraw/zinc/31/23/15/387312315.db2.gz HYDHLFMIVWVNMD-OUCADQQQSA-N 2 0 233.359 2.250 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[C@@H]([NH3+])C1)c1ccco1 ZINC000423464308 387312346 /nfs/dbraw/zinc/31/23/46/387312346.db2.gz QTYWZPOWWQXNGX-QJPTWQEYSA-N 2 0 222.332 2.448 20 0 BEADRP CC[C@H]([NH2+]C[C@H]1CCC[C@@H]([NH3+])C1)C1CC1 ZINC000423463995 387312442 /nfs/dbraw/zinc/31/24/42/387312442.db2.gz GHMUMNNDPKIMME-UHTWSYAYSA-N 2 0 210.365 2.282 20 0 BEADRP CC[C@H]([NH2+]C[C@H]1CCC[C@H]([NH3+])C1)C1CC1 ZINC000423463992 387312874 /nfs/dbraw/zinc/31/28/74/387312874.db2.gz GHMUMNNDPKIMME-DRZSPHRISA-N 2 0 210.365 2.282 20 0 BEADRP Cc1ccnc([C@@H](C)[NH2+][C@H](C)CCC[NH3+])c1 ZINC000423465542 387313360 /nfs/dbraw/zinc/31/33/60/387313360.db2.gz WOLHCBWZBGMWDJ-VXGBXAGGSA-N 2 0 221.348 2.168 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H]1CCC12CCC2 ZINC000423428122 387254288 /nfs/dbraw/zinc/25/42/88/387254288.db2.gz JCIWNQLZXCTJJF-NWDGAFQWSA-N 2 0 210.365 2.426 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@H]2CC[C@@H]2C2CC2)C1 ZINC000423374929 387254549 /nfs/dbraw/zinc/25/45/49/387254549.db2.gz UCTBTNVHIILGEC-XQHKEYJVSA-N 2 0 208.349 2.035 20 0 BEADRP CC[C@@H]1C[C@H](C)CC[C@H]1[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000423429719 387254569 /nfs/dbraw/zinc/25/45/69/387254569.db2.gz KJGQPUPLHRULNS-HUXGKSLCSA-N 2 0 222.376 2.009 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H](C)c1ccncc1F ZINC000423428901 387255165 /nfs/dbraw/zinc/25/51/65/387255165.db2.gz JRVXMRCEORLYCX-MNOVXSKESA-N 2 0 239.338 2.389 20 0 BEADRP CC[C@@H]1C[C@H](C)CC[C@@H]1[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000423429720 387255355 /nfs/dbraw/zinc/25/53/55/387255355.db2.gz KJGQPUPLHRULNS-TVQXOTEMSA-N 2 0 222.376 2.009 20 0 BEADRP C(C[C@H]1CCC[NH2+]1)[NH2+][C@H]1CCC12CCCC2 ZINC000423375709 387256938 /nfs/dbraw/zinc/25/69/38/387256938.db2.gz XVNXGWAYPURPEC-OLZOCXBDSA-N 2 0 222.376 2.441 20 0 BEADRP C(C[C@H]1CCC[NH2+]1)[NH2+][C@@H]1CCC12CCCC2 ZINC000423375707 387257619 /nfs/dbraw/zinc/25/76/19/387257619.db2.gz XVNXGWAYPURPEC-CHWSQXEVSA-N 2 0 222.376 2.441 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@H]([NH3+])C1)c1cncc(F)c1 ZINC000423385074 387266947 /nfs/dbraw/zinc/26/69/47/387266947.db2.gz LLYQSTHQCCNJFS-TVYUQYBPSA-N 2 0 237.322 2.141 20 0 BEADRP Cc1ccc([C@H](C)[NH2+]CC2CC[NH2+]CC2)c(C)n1 ZINC000643497622 387267603 /nfs/dbraw/zinc/26/76/03/387267603.db2.gz ITXUWLALDZTKRI-LBPRGKRZSA-N 2 0 247.386 2.349 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@@H](C)[C@@H]2C[C@H]2C)CC1 ZINC000321513472 387267958 /nfs/dbraw/zinc/26/79/58/387267958.db2.gz IAFFSCQSGBGVEE-MBNYWOFBSA-N 2 0 224.392 2.493 20 0 BEADRP C[C@@H]1CC(C)(C)C[C@H]1[NH2+][C@H]1CC[NH2+]C[C@H]1C ZINC000423384411 387267922 /nfs/dbraw/zinc/26/79/22/387267922.db2.gz FXGFCNFPEGTXAJ-FVCCEPFGSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@H]2CCCC23CCC3)CC[NH2+]1 ZINC000423387716 387272195 /nfs/dbraw/zinc/27/21/95/387272195.db2.gz SXGHAGWDAKVCBN-AGIUHOORSA-N 2 0 222.376 2.439 20 0 BEADRP Cn1ccnc1[C@H]1CC[N@H+](Cc2cccs2)C1 ZINC000336446159 387275805 /nfs/dbraw/zinc/27/58/05/387275805.db2.gz YMFHQNGMISKHOX-NSHDSACASA-N 2 0 247.367 2.471 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H](C)Cc1cccs1 ZINC000643498926 387277439 /nfs/dbraw/zinc/27/74/39/387277439.db2.gz XFFKPSCWLCAUMH-LLVKDONJSA-N 2 0 226.389 2.268 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@H]([NH2+][C@@H]2CC[NH2+]C[C@@H]2C)C1 ZINC000423394076 387279806 /nfs/dbraw/zinc/27/98/06/387279806.db2.gz MRIQIWDODFCIOO-MBJXGIAVSA-N 2 0 224.392 2.399 20 0 BEADRP CC[C@@H](C)[C@@H](C)[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000423432765 387283717 /nfs/dbraw/zinc/28/37/17/387283717.db2.gz JHRVCHJRTBCBJZ-MHDGFBEUSA-N 2 0 224.392 2.399 20 0 BEADRP CCC1CC([NH2+][C@@H]2C[C@H]2C2CC[NH2+]CC2)C1 ZINC000423434892 387285682 /nfs/dbraw/zinc/28/56/82/387285682.db2.gz KRJNBDQHMSSVJH-AKUTZHFWSA-N 2 0 222.376 2.153 20 0 BEADRP c1ccc([C@@H]2CC[C@H]([NH2+][C@@H]3[C@H]4C[NH2+]C[C@H]43)C2)cc1 ZINC000423438302 387288521 /nfs/dbraw/zinc/28/85/21/387288521.db2.gz RCTSXJJJGFWJLV-LEOABGAYSA-N 2 0 242.366 2.130 20 0 BEADRP CC1CC([NH2+]CC[C@H]2CCC[N@H+](C)C2)C1 ZINC000459790942 387297435 /nfs/dbraw/zinc/29/74/35/387297435.db2.gz RCBPQPDTCZZUSA-OTTFEQOBSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]([NH3+])[C@H](C)[NH2+][C@H](Cc1ccccc1)C1CC1 ZINC000423450163 387299149 /nfs/dbraw/zinc/29/91/49/387299149.db2.gz SOFPJQYXDKNSSG-SLEUVZQESA-N 2 0 232.371 2.333 20 0 BEADRP c1coc(C[NH+]2CCC(c3c[nH]cn3)CC2)c1 ZINC000336471712 387300949 /nfs/dbraw/zinc/30/09/49/387300949.db2.gz YIXHCNIYNYHQCJ-UHFFFAOYSA-N 2 0 231.299 2.382 20 0 BEADRP CC(C)CO[C@@H]1C[C@H]([NH2+][C@H](C)[C@H](C)[NH3+])C1(C)C ZINC000423454121 387302354 /nfs/dbraw/zinc/30/23/54/387302354.db2.gz YPJZIHBIKQARQG-QNWHQSFQSA-N 2 0 242.407 2.151 20 0 BEADRP CC(C)CO[C@@H]1C[C@H]([NH2+][C@H](C)[C@@H](C)[NH3+])C1(C)C ZINC000423454119 387302598 /nfs/dbraw/zinc/30/25/98/387302598.db2.gz YPJZIHBIKQARQG-FVCCEPFGSA-N 2 0 242.407 2.151 20 0 BEADRP COc1ccc2c(c1)[C@H]([NH2+][C@@H](C)CCC[NH3+])CC2 ZINC000423460987 387309152 /nfs/dbraw/zinc/30/91/52/387309152.db2.gz SIYJBYUCGKYNES-XHDPSFHLSA-N 2 0 248.370 2.400 20 0 BEADRP CC[C@H]([NH2+]CCC1=CC[NH2+]CC1)C1CC1 ZINC000423535599 387360804 /nfs/dbraw/zinc/36/08/04/387360804.db2.gz DNOBOGSHXMYWJO-ZDUSSCGKSA-N 2 0 208.349 2.074 20 0 BEADRP C[C@H]([NH2+]CCC1=CC[NH2+]CC1)[C@H]1CC1(C)C ZINC000423535182 387362201 /nfs/dbraw/zinc/36/22/01/387362201.db2.gz CGJIYIMQIZBLCH-WCQYABFASA-N 2 0 222.376 2.320 20 0 BEADRP C[NH+](C)[C@H]1CCC[N@@H+](C2CCCC2)CC1 ZINC000336541591 387362765 /nfs/dbraw/zinc/36/27/65/387362765.db2.gz BIGVRUNQJFCVLB-LBPRGKRZSA-N 2 0 210.365 2.345 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+]CCC1=CC[NH2+]CC1 ZINC000423541464 387365734 /nfs/dbraw/zinc/36/57/34/387365734.db2.gz RWYIYZQPIATAOA-LBPRGKRZSA-N 2 0 208.349 2.074 20 0 BEADRP CC[C@@H]1C[C@H]([NH2+][C@H](C)CCCC[NH3+])CCO1 ZINC000423543925 387367519 /nfs/dbraw/zinc/36/75/19/387367519.db2.gz IDFFOYGNJBGSBD-JHJVBQTASA-N 2 0 228.380 2.051 20 0 BEADRP CCC[C@@H](N[C@@H](C)C1C[NH2+]C1)c1ccccn1 ZINC000643453406 387369179 /nfs/dbraw/zinc/36/91/79/387369179.db2.gz QFBGVMYKUVGYQZ-SMDDNHRTSA-N 2 0 233.359 2.120 20 0 BEADRP CC[C@@H]1C[C@@H]([NH2+][C@H](C)[C@@H]2CCCC[NH2+]2)CCO1 ZINC000423545643 387370351 /nfs/dbraw/zinc/37/03/51/387370351.db2.gz JTDVKFWQQZYODZ-RQJABVFESA-N 2 0 240.391 2.064 20 0 BEADRP C(C[NH2+]C1CC1)C[NH2+][C@H]1CC[C@@H]1C1CCC1 ZINC000423547389 387370917 /nfs/dbraw/zinc/37/09/17/387370917.db2.gz GBVZUBKTQIPHPM-KGLIPLIRSA-N 2 0 222.376 2.297 20 0 BEADRP C(C[NH2+]C1CC1)C[NH2+][C@H]1CCC12CCCC2 ZINC000423547113 387371244 /nfs/dbraw/zinc/37/12/44/387371244.db2.gz FTFVTOKMZLFJQJ-ZDUSSCGKSA-N 2 0 222.376 2.441 20 0 BEADRP CC[C@@H]([NH2+][C@@H]1CCO[C@H](CC)C1)[C@@H]1CCC[NH2+]1 ZINC000423546236 387371331 /nfs/dbraw/zinc/37/13/31/387371331.db2.gz KMBBFUFGOWGYDZ-SYQHCUMBSA-N 2 0 240.391 2.064 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]C[C@H]1Cc2ccccc21 ZINC000643453645 387371521 /nfs/dbraw/zinc/37/15/21/387371521.db2.gz OVLJGZUXLVNJDY-DMDPSCGWSA-N 2 0 218.344 2.042 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]C[C@@H]1Cc2ccccc21 ZINC000643453598 387371572 /nfs/dbraw/zinc/37/15/72/387371572.db2.gz KLFCZWAZRPEQKU-INWMFGNUSA-N 2 0 244.382 2.304 20 0 BEADRP CC(C)C1CC([NH2+]CCC[NH2+]C2CC2)C1 ZINC000423551688 387372089 /nfs/dbraw/zinc/37/20/89/387372089.db2.gz JJSPCIHWDJDMDD-UHFFFAOYSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)C1CC([NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)C1 ZINC000423555583 387374836 /nfs/dbraw/zinc/37/48/36/387374836.db2.gz XZQWRJAURBBOHG-WQNPGBKJSA-N 2 0 236.403 2.399 20 0 BEADRP C[C@H]([NH2+]CCC1=CC[NH2+]CC1)c1ccco1 ZINC000423561094 387375326 /nfs/dbraw/zinc/37/53/26/387375326.db2.gz PRDMPQVUMJQTQA-NSHDSACASA-N 2 0 220.316 2.240 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]C[C@@H]1CC12CCSCC2 ZINC000423564699 387377845 /nfs/dbraw/zinc/37/78/45/387377845.db2.gz YADHTHRCLWTXAS-TUAOUCFPSA-N 2 0 242.432 2.235 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+]CCC2=CC[NH2+]CC2)C1 ZINC000423561853 387378327 /nfs/dbraw/zinc/37/83/27/387378327.db2.gz QHGGBVBPRJHVMR-WCQYABFASA-N 2 0 208.349 2.074 20 0 BEADRP C[C@@H]1CCCC[C@H]1[NH2+][C@H]1CCCC[NH2+]C1 ZINC000423569255 387380363 /nfs/dbraw/zinc/38/03/63/387380363.db2.gz VZEMLTIMEVHOFB-FRRDWIJNSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CCCC[NH2+]C1 ZINC000423569254 387381005 /nfs/dbraw/zinc/38/10/05/387381005.db2.gz VZEMLTIMEVHOFB-AGIUHOORSA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@H]1c2ccccc2C[C@H]1C ZINC000423478382 387324445 /nfs/dbraw/zinc/32/44/45/387324445.db2.gz UNLUCFRVKDJROG-SCDSUCTJSA-N 2 0 218.344 2.247 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H](C[NH2+][C@H]2CCC23CCC3)C1 ZINC000423479254 387327812 /nfs/dbraw/zinc/32/78/12/387327812.db2.gz UVJSAHSYHWNFNZ-UPJWGTAASA-N 2 0 222.376 2.426 20 0 BEADRP CC(C)CC[C@H]([NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21)C1CC1 ZINC000423430495 387328005 /nfs/dbraw/zinc/32/80/05/387328005.db2.gz MTFWQQWIDMNJEE-RFQIPJPRSA-N 2 0 222.376 2.009 20 0 BEADRP [NH3+][C@@H]1CCN(Cc2ccc(-c3ccccc3)o2)C1 ZINC000336503054 387328608 /nfs/dbraw/zinc/32/86/08/387328608.db2.gz AAJBXNAZXWRAKF-CYBMUJFWSA-N 2 0 242.322 2.480 20 0 BEADRP CC[C@H]([NH2+]CC1=CC[N@H+](C)CC1)[C@H]1C[C@@H]1C ZINC000321951512 387329963 /nfs/dbraw/zinc/32/99/63/387329963.db2.gz WXPPKSGZQDMQBF-UBHSHLNASA-N 2 0 222.376 2.273 20 0 BEADRP CCC1CC([NH2+]CCC[C@H]2CCC[NH2+]2)C1 ZINC000423484912 387331460 /nfs/dbraw/zinc/33/14/60/387331460.db2.gz RHPBJGGLPMRUKJ-OTTFEQOBSA-N 2 0 210.365 2.297 20 0 BEADRP Cc1cc(N)cc(C[NH2+][C@H]2CCCC[C@H]2C[NH3+])c1 ZINC000423486344 387333535 /nfs/dbraw/zinc/33/35/35/387333535.db2.gz WJCILUSUNVTIKH-ZFWWWQNUSA-N 2 0 247.386 2.184 20 0 BEADRP C[C@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1cncs1 ZINC000423489041 387333785 /nfs/dbraw/zinc/33/37/85/387333785.db2.gz VTBGBZGUUKUFDM-WDEREUQCSA-N 2 0 239.388 2.326 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@@H](C)CCc1ccco1 ZINC000515053157 387334764 /nfs/dbraw/zinc/33/47/64/387334764.db2.gz DHRHAHUQLPCVDO-WCQYABFASA-N 2 0 224.348 2.174 20 0 BEADRP COc1ccccc1[C@H](C)[NH2+][C@@H]1CC[C@H](C[NH3+])C1 ZINC000423491651 387336199 /nfs/dbraw/zinc/33/61/99/387336199.db2.gz KEJGVJJCBAPXEL-RWMBFGLXSA-N 2 0 248.370 2.473 20 0 BEADRP CC[C@H]([NH2+][C@H]1CC[C@@H](C[NH3+])C1)C1CCC1 ZINC000423499186 387341276 /nfs/dbraw/zinc/34/12/76/387341276.db2.gz HNVYOVCXHUDRMY-WXHSDQCUSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)=CCC[C@@H](C)[NH2+]C[C@@H]1C[NH2+]CCCO1 ZINC000423506460 387346282 /nfs/dbraw/zinc/34/62/82/387346282.db2.gz GXSKKGYTBKSPPE-KGLIPLIRSA-N 2 0 240.391 2.089 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H](C)CC1)[C@H]1CCC[NH2+]1 ZINC000400639244 387348363 /nfs/dbraw/zinc/34/83/63/387348363.db2.gz NPTFXRSKFJPSGI-ZDEQEGDKSA-N 2 0 210.365 2.295 20 0 BEADRP CC[C@H]([NH2+]C1CCC([NH3+])CC1)[C@@H]1C[C@H]1C ZINC000322006401 387350112 /nfs/dbraw/zinc/35/01/12/387350112.db2.gz HRQRJIVNKMTLCS-IIBVRRFFSA-N 2 0 210.365 2.281 20 0 BEADRP Cc1ccnc([C@@H](C)[N@@H+]2C[C@@H](C)[C@](C)(C[NH3+])C2)c1 ZINC000423516234 387351281 /nfs/dbraw/zinc/35/12/81/387351281.db2.gz WGIUOJWPTNCIFF-UMVBOHGHSA-N 2 0 247.386 2.368 20 0 BEADRP CSC1(C[NH2+]CCC2CC[NH+](C)CC2)CC1 ZINC000304288159 387460122 /nfs/dbraw/zinc/46/01/22/387460122.db2.gz NEEBORQZHOTKAJ-UHFFFAOYSA-N 2 0 242.432 2.204 20 0 BEADRP Cc1ccc(CCC[NH2+]CC2(CO)CCC2)cn1 ZINC000354669003 387415223 /nfs/dbraw/zinc/41/52/23/387415223.db2.gz TZIXQXSIIGWBJT-UHFFFAOYSA-N 2 0 248.370 2.075 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCCCC[C@H]1[NH3+])C1CC1 ZINC000643468290 387418057 /nfs/dbraw/zinc/41/80/57/387418057.db2.gz IYGIPPILIMDYQG-RTXFEEFZSA-N 2 0 210.365 2.282 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H](C)C1CC1)[C@@H]1CCC[NH2+]1 ZINC000643468350 387419443 /nfs/dbraw/zinc/41/94/43/387419443.db2.gz SYEDNKKBLJKCDK-RTXFEEFZSA-N 2 0 210.365 2.153 20 0 BEADRP Cc1n[nH]cc1[C@H](C)NC[C@H]([NH3+])c1ccccc1 ZINC000643508849 387499135 /nfs/dbraw/zinc/49/91/35/387499135.db2.gz JAPOXYAENZSWBM-HZMBPMFUSA-N 2 0 244.342 2.069 20 0 BEADRP Cc1ncc([C@H](C)[NH2+]CC[C@@H]2CC[NH2+]C2)s1 ZINC000643509312 387504195 /nfs/dbraw/zinc/50/41/95/387504195.db2.gz XTKAZJPAICFORS-ONGXEEELSA-N 2 0 239.388 2.102 20 0 BEADRP CC(C)OC1CCC([NH2+][C@@H]2CCC[C@H]2[NH3+])CC1 ZINC000643475923 387513321 /nfs/dbraw/zinc/51/33/21/387513321.db2.gz XMQVEDDQNQALEH-NWINJMCUSA-N 2 0 240.391 2.192 20 0 BEADRP CC(C)OC1CCC([NH2+][C@H]2CCC[C@@H]2[NH3+])CC1 ZINC000643475921 387513862 /nfs/dbraw/zinc/51/38/62/387513862.db2.gz XMQVEDDQNQALEH-HOAMVYINSA-N 2 0 240.391 2.192 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]C[C@@H](C)CC(F)(F)F ZINC000396922145 387515120 /nfs/dbraw/zinc/51/51/20/387515120.db2.gz GSFTUUXWYWCTFP-DTWKUNHWSA-N 2 0 226.286 2.292 20 0 BEADRP NC[C@@H]1CCC[N@@H+]1CCCCC1CCOCC1 ZINC000310065487 387534482 /nfs/dbraw/zinc/53/44/82/387534482.db2.gz PUFIUIVXNANTFD-AWEZNQCLSA-N 2 0 240.391 2.006 20 0 BEADRP CO[C@H](C)[C@@H](C)[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C ZINC000361523832 387479424 /nfs/dbraw/zinc/47/94/24/387479424.db2.gz GWDQUHHTTJKQAR-UPJWGTAASA-N 2 0 244.423 2.366 20 0 BEADRP C[C@@H](CCc1ccsc1)[NH2+]CCNC1CC1 ZINC000643507812 387480672 /nfs/dbraw/zinc/48/06/72/387480672.db2.gz PXZYQXMWKHNSQL-NSHDSACASA-N 2 0 238.400 2.411 20 0 BEADRP Cc1occc1C[NH2+][C@H]1CC[NH2+]CC[C@@H]1C ZINC000643472162 387484079 /nfs/dbraw/zinc/48/40/79/387484079.db2.gz CADONYGCKAKZKT-GWCFXTLKSA-N 2 0 222.332 2.066 20 0 BEADRP Cc1occc1C[NH2+]C1CCC(C[NH3+])CC1 ZINC000643472230 387484366 /nfs/dbraw/zinc/48/43/66/387484366.db2.gz KAAIPIUVHIOSRB-UHFFFAOYSA-N 2 0 222.332 2.195 20 0 BEADRP c1ccc2c(c1)CCC[C@H]([NH2+]CCNC1CC1)C2 ZINC000643507466 387486580 /nfs/dbraw/zinc/48/65/80/387486580.db2.gz FQDUKGLLNBOBOJ-INIZCTEOSA-N 2 0 244.382 2.276 20 0 BEADRP CC[C@H](Cc1cccs1)[NH2+]CC(C)(C)[NH3+] ZINC000643513119 387596108 /nfs/dbraw/zinc/59/61/08/387596108.db2.gz ISHFNKREZWVGJW-SNVBAGLBSA-N 2 0 226.389 2.396 20 0 BEADRP CC(C)([NH3+])C[NH2+][C@@H]1CCCc2ccccc2C1 ZINC000643513395 387596300 /nfs/dbraw/zinc/59/63/00/387596300.db2.gz NRFHVYPYXNMSOK-CQSZACIVSA-N 2 0 232.371 2.261 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]CCCC(F)(F)F ZINC000123892962 387598070 /nfs/dbraw/zinc/59/80/70/387598070.db2.gz SMJKDMUMNOPJIX-UWVGGRQHSA-N 2 0 238.297 2.436 20 0 BEADRP CCC[C@@H](C)C[NH+]1CCC2(CC[NH2+]2)CC1 ZINC000422564344 387602760 /nfs/dbraw/zinc/60/27/60/387602760.db2.gz VSIORXXJLPNEQH-GFCCVEGCSA-N 2 0 210.365 2.251 20 0 BEADRP CC(C)OCCC[N@@H+]1C[C@H](C[NH3+])[C@H](C)C[C@H]1C ZINC000422639442 387610452 /nfs/dbraw/zinc/61/04/52/387610452.db2.gz STWJQDBILPSPEE-MCIONIFRSA-N 2 0 242.407 2.107 20 0 BEADRP C[C@@H]1C[C@H](C)[N@H+](Cc2cccc(N)c2)C[C@@H]1C[NH3+] ZINC000422641332 387610951 /nfs/dbraw/zinc/61/09/51/387610951.db2.gz XQUJCNFXBUZMJN-DYEKYZERSA-N 2 0 247.386 2.074 20 0 BEADRP CC[C@H](Cc1ccccc1)[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000422702868 387619097 /nfs/dbraw/zinc/61/90/97/387619097.db2.gz GDYOIUUUYSWLHQ-SWLSCSKDSA-N 2 0 232.371 2.205 20 0 BEADRP C[C@@H]([NH2+]C1CCC(C[NH3+])CC1)C1CCC1 ZINC000643476309 387547736 /nfs/dbraw/zinc/54/77/36/387547736.db2.gz DTRRWJOQQISLOG-XSRFYTQQSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@]1(C[NH2+][C@H]2C[C@@H]([NH3+])c3ccccc32)CCOC1 ZINC000397153310 387547911 /nfs/dbraw/zinc/54/79/11/387547911.db2.gz LIENLMBGBQGXIZ-QLFBSQMISA-N 2 0 246.354 2.147 20 0 BEADRP C[C@]1(C[NH2+][C@@H]2C[C@@H]([NH3+])c3ccccc32)CCOC1 ZINC000397153311 387548391 /nfs/dbraw/zinc/54/83/91/387548391.db2.gz LIENLMBGBQGXIZ-RBSFLKMASA-N 2 0 246.354 2.147 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H](CN(C)C)c1ccccc1 ZINC000336789916 387574175 /nfs/dbraw/zinc/57/41/75/387574175.db2.gz KDUGFJDPLSSHSZ-HIFRSBDPSA-N 2 0 249.402 2.006 20 0 BEADRP CC(C)[C@@H]1CCCC[C@@H]1[NH2+][C@H](C)C1C[NH2+]C1 ZINC000422717674 387631232 /nfs/dbraw/zinc/63/12/32/387631232.db2.gz OVACZOYAWPRRQR-XBFCOCLRSA-N 2 0 224.392 2.399 20 0 BEADRP CCC1CCC(C[NH2+][C@@H](C)C2C[NH2+]C2)CC1 ZINC000422722750 387634172 /nfs/dbraw/zinc/63/41/72/387634172.db2.gz YWTDHNGHKSCNSJ-HIFPTAJRSA-N 2 0 224.392 2.400 20 0 BEADRP Cc1ccc(CC[N@@H+]2CCC[C@H](C[NH3+])C2)cc1 ZINC000430648743 387635568 /nfs/dbraw/zinc/63/55/68/387635568.db2.gz HKQDIROZCNVLGT-OAHLLOKOSA-N 2 0 232.371 2.208 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]C1CCCC1 ZINC000422727677 387635861 /nfs/dbraw/zinc/63/58/61/387635861.db2.gz DAMSHUBFJIZOHL-JTQLQIEISA-N 2 0 233.359 2.442 20 0 BEADRP CCCC[NH2+][C@H](C)c1ccc(C[NH3+])nc1C ZINC000422728087 387636184 /nfs/dbraw/zinc/63/61/84/387636184.db2.gz FASCSZXOIZFSGY-SNVBAGLBSA-N 2 0 221.348 2.299 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCCC[C@H]1C)[C@@H]1CCC[NH2+]1 ZINC000422726825 387636341 /nfs/dbraw/zinc/63/63/41/387636341.db2.gz GAMKZSUXASMUTL-XQHKEYJVSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CCc1c[nH]c2ccccc12 ZINC000422732983 387641197 /nfs/dbraw/zinc/64/11/97/387641197.db2.gz PYRVXJHJTPAPFB-NEPJUHHUSA-N 2 0 245.370 2.426 20 0 BEADRP CCOc1ccccc1C[NH2+][C@@H](C)C[C@@H](C)[NH3+] ZINC000422745426 387648810 /nfs/dbraw/zinc/64/88/10/387648810.db2.gz XQWDWGCYKZTSEJ-NEPJUHHUSA-N 2 0 236.359 2.301 20 0 BEADRP Cc1ccccc1OCCC[NH2+][C@H]1CCC[C@H]1[NH3+] ZINC000422740800 387649214 /nfs/dbraw/zinc/64/92/14/387649214.db2.gz NFLFJMHOJBTKEL-KGLIPLIRSA-N 2 0 248.370 2.233 20 0 BEADRP Cc1ccccc1C[C@H](C)[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000422746496 387650870 /nfs/dbraw/zinc/65/08/70/387650870.db2.gz WQWNPQJRPCZTOK-STQMWFEESA-N 2 0 232.371 2.124 20 0 BEADRP Cc1ccccc1CC[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000422749867 387655150 /nfs/dbraw/zinc/65/51/50/387655150.db2.gz BFSQIZBMBUCPOP-STQMWFEESA-N 2 0 220.360 2.253 20 0 BEADRP CSCCCC[NH2+][C@H]1CCCCC[C@H]1[NH3+] ZINC000422754423 387658298 /nfs/dbraw/zinc/65/82/98/387658298.db2.gz JOTUEVUACKETMW-NEPJUHHUSA-N 2 0 230.421 2.379 20 0 BEADRP COc1cc(C[NH2+][C@@H](C)C[C@@H](C)[NH3+])ccc1C ZINC000422753122 387658732 /nfs/dbraw/zinc/65/87/32/387658732.db2.gz DQGKNGBSBMZICD-NEPJUHHUSA-N 2 0 236.359 2.219 20 0 BEADRP Cc1ccc(C[NH2+][C@H](C)C[C@@H](C)[NH3+])cc1 ZINC000422756416 387659026 /nfs/dbraw/zinc/65/90/26/387659026.db2.gz IQYPDOLVNHZAAU-VXGBXAGGSA-N 2 0 206.333 2.210 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]1[NH2+]CCc1cccc(Cl)c1 ZINC000422758393 387660459 /nfs/dbraw/zinc/66/04/59/387660459.db2.gz IYIXGXRXXGDAKT-STQMWFEESA-N 2 0 238.762 2.352 20 0 BEADRP CS[C@@H]1CCC[C@@H]([NH2+][C@H](C)[C@@H]2CCC[NH2+]2)C1 ZINC000422758841 387660494 /nfs/dbraw/zinc/66/04/94/387660494.db2.gz KDMVPOLFLCCCOR-LPWJVIDDSA-N 2 0 242.432 2.391 20 0 BEADRP C[C@H]([NH2+]CCCNc1ccccc1)[C@H]1CCC[NH2+]1 ZINC000422758680 387661014 /nfs/dbraw/zinc/66/10/14/387661014.db2.gz OFESJAAXBVYZGA-DZGCQCFKSA-N 2 0 247.386 2.219 20 0 BEADRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]CCCNc1ccccc1 ZINC000422758299 387661290 /nfs/dbraw/zinc/66/12/90/387661290.db2.gz NTUWHNNAOOTXKS-UKRRQHHQSA-N 2 0 247.386 2.206 20 0 BEADRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]CCCNc1ccccc1 ZINC000422758298 387661327 /nfs/dbraw/zinc/66/13/27/387661327.db2.gz NTUWHNNAOOTXKS-HIFRSBDPSA-N 2 0 247.386 2.206 20 0 BEADRP [NH3+]CC1CCC([NH2+]CCOc2ccccc2)CC1 ZINC000422757339 387661484 /nfs/dbraw/zinc/66/14/84/387661484.db2.gz MMPMVIUWJDZSGK-UHFFFAOYSA-N 2 0 248.370 2.173 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+]CCc1cccc(Cl)c1 ZINC000422758392 387661563 /nfs/dbraw/zinc/66/15/63/387661563.db2.gz IYIXGXRXXGDAKT-QWHCGFSZSA-N 2 0 238.762 2.352 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)[C@@H]1C[C@H]1C1CC1 ZINC000527656709 387662511 /nfs/dbraw/zinc/66/25/11/387662511.db2.gz JBDSYYVYTCHZHH-DHMWGJHJSA-N 2 0 236.403 2.352 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CCc1ccccc1F ZINC000422766367 387664938 /nfs/dbraw/zinc/66/49/38/387664938.db2.gz PXNOUENBSNTSED-WDEREUQCSA-N 2 0 224.323 2.084 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+]CC1(c2cccc(F)c2)CC1 ZINC000422765729 387665741 /nfs/dbraw/zinc/66/57/41/387665741.db2.gz LAQWPUKYGSZISK-UONOGXRCSA-N 2 0 248.345 2.327 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]Cc1ccccc1F ZINC000422771604 387669761 /nfs/dbraw/zinc/66/97/61/387669761.db2.gz XLLIERXGFDBVSV-ZJUUUORDSA-N 2 0 210.296 2.041 20 0 BEADRP COC[C@H]([NH2+]CCC[NH+]1CCCCC1)C(C)C ZINC000126037073 387670065 /nfs/dbraw/zinc/67/00/65/387670065.db2.gz KRZWZZSFZCTDAY-AWEZNQCLSA-N 2 0 242.407 2.123 20 0 BEADRP CS[C@@H]1CCC[C@H]([NH2+][C@H]2CCC[C@@H]2[NH3+])C1 ZINC000422770718 387670582 /nfs/dbraw/zinc/67/05/82/387670582.db2.gz XAMVGQVREDIVBB-USZNOCQGSA-N 2 0 228.405 2.130 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CCCN(C)c1ccccc1 ZINC000422771205 387671031 /nfs/dbraw/zinc/67/10/31/387671031.db2.gz XEHNNMNWXLPJCO-KBPBESRZSA-N 2 0 249.402 2.228 20 0 BEADRP C[C@H]([NH2+]CC1(c2cccc(F)c2)CC1)C1C[NH2+]C1 ZINC000422770930 387671144 /nfs/dbraw/zinc/67/11/44/387671144.db2.gz QTFQRVNAPGOIEW-NSHDSACASA-N 2 0 248.345 2.055 20 0 BEADRP CS[C@@H]1CCC[C@H]([NH2+][C@@H]2CCC[C@@H]2[NH3+])C1 ZINC000422770719 387671417 /nfs/dbraw/zinc/67/14/17/387671417.db2.gz XAMVGQVREDIVBB-WHOHXGKFSA-N 2 0 228.405 2.130 20 0 BEADRP CC(C)[C@@H](C)C[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000422774350 387672020 /nfs/dbraw/zinc/67/20/20/387672020.db2.gz WRSBQVPAACCVCE-ACJTYDJDSA-N 2 0 210.365 2.151 20 0 BEADRP CC[C@@H]([NH2+][C@H]1CCC[NH2+]CC1)c1ccncc1 ZINC000422775774 387673031 /nfs/dbraw/zinc/67/30/31/387673031.db2.gz CGXRBJLRVIKLMZ-UONOGXRCSA-N 2 0 233.359 2.264 20 0 BEADRP CC[C@H]([NH2+]CCCOCC(C)C)[C@@H]1CCC[NH2+]1 ZINC000422779615 387677220 /nfs/dbraw/zinc/67/72/20/387677220.db2.gz GABFOVDKBFDIFV-KBPBESRZSA-N 2 0 242.407 2.169 20 0 BEADRP [NH3+][C@H]1CCCCC[C@H]1[NH2+]CCCOCC1CC1 ZINC000422780031 387678469 /nfs/dbraw/zinc/67/84/69/387678469.db2.gz GQSIKYSVFIMZNE-UONOGXRCSA-N 2 0 240.391 2.053 20 0 BEADRP C[C@@H](Cc1cccs1)[NH2+]CC1=CC[NH2+]CC1 ZINC000643520130 387679822 /nfs/dbraw/zinc/67/98/22/387679822.db2.gz FTSYXWRISVIPNR-NSHDSACASA-N 2 0 236.384 2.188 20 0 BEADRP C1=CCC(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)C1 ZINC000527742480 387686440 /nfs/dbraw/zinc/68/64/40/387686440.db2.gz BQNDOLTUBLAUGA-KGLIPLIRSA-N 2 0 220.360 2.169 20 0 BEADRP CC[C@H](F)CN(C)[C@H]1CC[N@H+](CC)C[C@H]1C ZINC000440770704 387689841 /nfs/dbraw/zinc/68/98/41/387689841.db2.gz KSZSYUCCHGMPGZ-AGIUHOORSA-N 2 0 230.371 2.397 20 0 BEADRP Cc1ncc([C@H](C)[NH2+]CC2=CC[NH2+]CC2)s1 ZINC000643520334 387690676 /nfs/dbraw/zinc/69/06/76/387690676.db2.gz PBTGCUKHJDADOL-VIFPVBQESA-N 2 0 237.372 2.022 20 0 BEADRP CC[C@@H](F)CN1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000440771964 387690801 /nfs/dbraw/zinc/69/08/01/387690801.db2.gz SWAQDLJBPFVJAZ-QWHCGFSZSA-N 2 0 228.355 2.152 20 0 BEADRP CO[C@H](C[NH2+][C@@H](C)C[C@@H](C)[NH3+])c1ccccc1 ZINC000422743325 387690924 /nfs/dbraw/zinc/69/09/24/387690924.db2.gz TYGDYDWCDJZCDO-MBNYWOFBSA-N 2 0 236.359 2.090 20 0 BEADRP Cc1cccc(C(C)(C)C[NH2+][C@@H](C)C2C[NH2+]C2)c1 ZINC000422792425 387691966 /nfs/dbraw/zinc/69/19/66/387691966.db2.gz ZDNPQPSTKNQKPD-ZDUSSCGKSA-N 2 0 246.398 2.470 20 0 BEADRP CC[C@H]([NH2+][C@H](C)CCC[NH3+])c1ccncc1 ZINC000422792451 387692729 /nfs/dbraw/zinc/69/27/29/387692729.db2.gz XANIAUASQWFTGW-YPMHNXCESA-N 2 0 221.348 2.250 20 0 BEADRP Cc1ccccc1O[C@H](C)C[NH2+][C@H]1CCC[C@@H]1[NH3+] ZINC000422795549 387696696 /nfs/dbraw/zinc/69/66/96/387696696.db2.gz VYCUWKIIKOHHGF-RDBSUJKOSA-N 2 0 248.370 2.232 20 0 BEADRP Cc1cc(F)ccc1CC[NH2+][C@H](C)C[C@H](C)[NH3+] ZINC000422867937 387748820 /nfs/dbraw/zinc/74/88/20/387748820.db2.gz TWSMJRNFZJBVBF-NWDGAFQWSA-N 2 0 238.350 2.392 20 0 BEADRP CO[C@@H](C)[C@@H](C)[NH2+]CCC[NH+]1CCC(C)CC1 ZINC000128593135 387749240 /nfs/dbraw/zinc/74/92/40/387749240.db2.gz SBKDAWBAJXUAMZ-KGLIPLIRSA-N 2 0 242.407 2.121 20 0 BEADRP COc1cc(C)ccc1C[NH2+][C@H]1CCC[C@H]1C[NH3+] ZINC000422872255 387750185 /nfs/dbraw/zinc/75/01/85/387750185.db2.gz GINHAFOZPLQMLI-JSGCOSHPSA-N 2 0 248.370 2.221 20 0 BEADRP CCSCC[C@@H](C)[NH2+][C@@H](C)[C@H]1CCC[NH2+]1 ZINC000422802554 387701392 /nfs/dbraw/zinc/70/13/92/387701392.db2.gz DQFCKCXPSBTGKL-GRYCIOLGSA-N 2 0 230.421 2.248 20 0 BEADRP C(CC1CCCC1)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000422802959 387701619 /nfs/dbraw/zinc/70/16/19/387701619.db2.gz ICXDJODWPCJQFB-PBWFPOADSA-N 2 0 222.376 2.439 20 0 BEADRP CO[C@H](C[NH2+][C@H]1CCCCC[C@@H]1[NH3+])C(C)(C)C ZINC000422805391 387704887 /nfs/dbraw/zinc/70/48/87/387704887.db2.gz GPGPHUBJWJUNFY-RWMBFGLXSA-N 2 0 242.407 2.297 20 0 BEADRP COCc1ccc(C[NH2+][C@H](C)C[C@H](C)[NH3+])cc1 ZINC000422807007 387705033 /nfs/dbraw/zinc/70/50/33/387705033.db2.gz LOMJRABGOLZIOT-NWDGAFQWSA-N 2 0 236.359 2.048 20 0 BEADRP C[C@H]([NH2+]CCCC1CCCC1)C1C[NH2+]C1 ZINC000422809239 387707842 /nfs/dbraw/zinc/70/78/42/387707842.db2.gz RMYMXOHIKKEUQK-NSHDSACASA-N 2 0 210.365 2.154 20 0 BEADRP CC[C@@H]1CCC[C@H]1[NH2+][C@H](C)[C@@H]1CCC[NH2+]1 ZINC000422877795 387755184 /nfs/dbraw/zinc/75/51/84/387755184.db2.gz RSAIEVRAIFJBHI-FVCCEPFGSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]CC1(c2ccccc2)CC1 ZINC000422810559 387708357 /nfs/dbraw/zinc/70/83/57/387708357.db2.gz NQJLNCDRCMEADT-ZDUSSCGKSA-N 2 0 232.371 2.435 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CCc1ccsc1 ZINC000422811102 387708958 /nfs/dbraw/zinc/70/89/58/387708958.db2.gz TZYBHQXODGAJQV-NXEZZACHSA-N 2 0 212.362 2.006 20 0 BEADRP CC(C)CCC[NH2+][C@@H]1CC[NH2+]CC[C@H]1C ZINC000422812911 387712267 /nfs/dbraw/zinc/71/22/67/387712267.db2.gz YIOYZIYDPVJBBU-CHWSQXEVSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC(C)(C)C[C@H]1C)C1C[NH2+]C1 ZINC000422819919 387717902 /nfs/dbraw/zinc/71/79/02/387717902.db2.gz OJULRAXHLHMGNQ-NTZNESFSSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@@H]([NH2+]CCCOC1CCCC1)[C@H]1CCC[NH2+]1 ZINC000422822893 387718563 /nfs/dbraw/zinc/71/85/63/387718563.db2.gz BSTMORMGLDEYGK-TZMCWYRMSA-N 2 0 240.391 2.066 20 0 BEADRP C1CC2(C1)CC[C@H]2[NH2+][C@H]1CCC[NH2+]CC1 ZINC000643522288 387719690 /nfs/dbraw/zinc/71/96/90/387719690.db2.gz KVCNRJHSZNLIGS-NWDGAFQWSA-N 2 0 208.349 2.051 20 0 BEADRP Cc1cncc([C@H](C)[NH2+][C@H]2CCC[NH2+]CC2)c1 ZINC000643523304 387720846 /nfs/dbraw/zinc/72/08/46/387720846.db2.gz ZYTZSDZAFUNRCJ-JSGCOSHPSA-N 2 0 233.359 2.183 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+][C@H]1CCC[NH2+]CC1 ZINC000643521886 387722367 /nfs/dbraw/zinc/72/23/67/387722367.db2.gz DUWRCDITCLYARB-STQMWFEESA-N 2 0 233.359 2.183 20 0 BEADRP CCS[C@@H]1CCCC[C@@H]1[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000422831272 387723904 /nfs/dbraw/zinc/72/39/04/387723904.db2.gz DHLYJHJWIRAQOC-WCFLWFBJSA-N 2 0 242.432 2.248 20 0 BEADRP c1coc(CC[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)c1 ZINC000127807420 387725605 /nfs/dbraw/zinc/72/56/05/387725605.db2.gz OUOOAHJYDHTKBJ-QWHCGFSZSA-N 2 0 234.343 2.039 20 0 BEADRP Cn1ccc(C[NH2+]C[C@@H]2CCN2C2CCCC2)c1 ZINC000527805809 387728606 /nfs/dbraw/zinc/72/86/06/387728606.db2.gz IFTWGZOYNKQCOL-HNNXBMFYSA-N 2 0 247.386 2.132 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCCC1(C)C)[C@H]1CCC[NH2+]1 ZINC000422839645 387729193 /nfs/dbraw/zinc/72/91/93/387729193.db2.gz RAVSBGBICMONQP-UTUOFQBUSA-N 2 0 210.365 2.295 20 0 BEADRP Cc1cc(C[NH2+][C@@H](C)C[C@@H](C)[NH3+])ccc1F ZINC000422789684 387730711 /nfs/dbraw/zinc/73/07/11/387730711.db2.gz BKZLHXBQMLPSON-MNOVXSKESA-N 2 0 224.323 2.350 20 0 BEADRP Cc1cccc(O[C@H](C)C[NH2+][C@@H]2CCC[C@@H]2[NH3+])c1 ZINC000422790164 387734267 /nfs/dbraw/zinc/73/42/67/387734267.db2.gz PDXRIZOZJGRXPG-VHDGCEQUSA-N 2 0 248.370 2.232 20 0 BEADRP Cc1cc(F)ccc1CC[NH2+][C@@H]1CCC[C@H]1[NH3+] ZINC000422849229 387734679 /nfs/dbraw/zinc/73/46/79/387734679.db2.gz BPUVUJXOHIQSLQ-ZIAGYGMSSA-N 2 0 236.334 2.146 20 0 BEADRP CC[C@@H]1CCC[C@H]1[NH2+][C@@H](C)[C@H]1CCC[NH2+]1 ZINC000422877798 387755908 /nfs/dbraw/zinc/75/59/08/387755908.db2.gz RSAIEVRAIFJBHI-UMSGYPCISA-N 2 0 210.365 2.295 20 0 BEADRP CO[C@H]1CCCC[C@@H]1[NH2+]CC[C@@H]1CCC[N@@H+]1C ZINC000441223261 387738053 /nfs/dbraw/zinc/73/80/53/387738053.db2.gz CRUKYFZISLRMCM-IHRRRGAJSA-N 2 0 240.391 2.018 20 0 BEADRP CO[C@@H]1C[C@H]([NH2+][C@H]2CCCCC[C@@H]2[NH3+])C1(C)C ZINC000422856063 387742304 /nfs/dbraw/zinc/74/23/04/387742304.db2.gz WMSLSBMXFVJWDQ-ZDEQEGDKSA-N 2 0 240.391 2.050 20 0 BEADRP CO[C@H](C)[C@@H](C)[NH2+]C[C@H](C)C[NH+]1CCCCC1 ZINC000129200814 387763413 /nfs/dbraw/zinc/76/34/13/387763413.db2.gz TWTNUQJEWRGBNN-BFHYXJOUSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1CCC[C@H]2OCC[C@H]21 ZINC000422890118 387763396 /nfs/dbraw/zinc/76/33/96/387763396.db2.gz RFXMTTFTFNJWRM-XJFOESAGSA-N 2 0 240.391 2.051 20 0 BEADRP CCC1(C[NH2+][C@H]2CCC[C@@H]2[NH3+])CCCC1 ZINC000422891227 387763706 /nfs/dbraw/zinc/76/37/06/387763706.db2.gz UVSJWHLXZBIDDE-RYUDHWBXSA-N 2 0 210.365 2.426 20 0 BEADRP CC(C)c1csc(C[NH2+][C@H](C)CCC[NH3+])n1 ZINC000422893747 387764378 /nfs/dbraw/zinc/76/43/78/387764378.db2.gz RDKGWKDOQFRXDF-SNVBAGLBSA-N 2 0 241.404 2.484 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1CCc2ccccc21 ZINC000422910694 387769323 /nfs/dbraw/zinc/76/93/23/387769323.db2.gz RJOOOBGUSGJSIO-OFQRWUPVSA-N 2 0 244.382 2.433 20 0 BEADRP Cc1cccc(C[C@H]([NH2+]C[C@@H](C)[NH3+])C2CC2)c1 ZINC000643528657 387770437 /nfs/dbraw/zinc/77/04/37/387770437.db2.gz MORVMGXQTJWMLT-DOMZBBRYSA-N 2 0 232.371 2.253 20 0 BEADRP CC[C@@H](Cc1ccc(C)cc1)[NH2+]C[C@@H](C)[NH3+] ZINC000643528561 387770458 /nfs/dbraw/zinc/77/04/58/387770458.db2.gz LLLGZSHSIXNOJW-OCCSQVGLSA-N 2 0 220.360 2.253 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+]CCCc1cccc(F)c1 ZINC000422912259 387771284 /nfs/dbraw/zinc/77/12/84/387771284.db2.gz VRIFESDIXJTHIQ-UONOGXRCSA-N 2 0 236.334 2.228 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]([NH2+]C[C@H](C)[NH3+])C[C@@H]1C ZINC000643529173 387771986 /nfs/dbraw/zinc/77/19/86/387771986.db2.gz WMCWQEBZJUULCR-RVMXOQNASA-N 2 0 212.381 2.384 20 0 BEADRP CCC1(C[NH2+][C@@H]2CCCCC[C@H]2[NH3+])CC1 ZINC000422918615 387773562 /nfs/dbraw/zinc/77/35/62/387773562.db2.gz HUICXQIOTIJKFQ-VXGBXAGGSA-N 2 0 210.365 2.426 20 0 BEADRP CC(C)C1(C[NH2+][C@@H]2CC[NH2+]CC[C@@H]2C)CC1 ZINC000422921475 387776098 /nfs/dbraw/zinc/77/60/98/387776098.db2.gz QANUJSFTBZQRPO-QWHCGFSZSA-N 2 0 224.392 2.400 20 0 BEADRP Cc1cccc(CC[C@H](C)[NH2+]C[C@@H](C)[NH3+])c1 ZINC000643529380 387777347 /nfs/dbraw/zinc/77/73/47/387777347.db2.gz ZBXOFGVXRLTGHV-OLZOCXBDSA-N 2 0 220.360 2.253 20 0 BEADRP CC(C)[C@@H]1OCCC[C@@H]1C[NH2+][C@H](C)CCC[NH3+] ZINC000422924947 387778108 /nfs/dbraw/zinc/77/81/08/387778108.db2.gz ZKXOTTRFYYOXFF-MCIONIFRSA-N 2 0 242.407 2.155 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CC2CC=CC2)CC[N@@H+]1C ZINC000527945551 387781590 /nfs/dbraw/zinc/78/15/90/387781590.db2.gz SGIYLIYGBRAERS-YPMHNXCESA-N 2 0 208.349 2.025 20 0 BEADRP COc1ccc(C[NH2+][C@H](C)C[C@@H](C)[NH3+])c(F)c1 ZINC000422932352 387782014 /nfs/dbraw/zinc/78/20/14/387782014.db2.gz ZBHZTNILNHGJDU-NXEZZACHSA-N 2 0 240.322 2.050 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]C1(c2ccccc2)CC1 ZINC000422931190 387782032 /nfs/dbraw/zinc/78/20/32/387782032.db2.gz AXYALOWREMOMSO-LBPRGKRZSA-N 2 0 218.344 2.393 20 0 BEADRP CC[C@@H]([NH2+][C@@H](C)C1C[NH2+]C1)c1cccs1 ZINC000422935790 387782716 /nfs/dbraw/zinc/78/27/16/387782716.db2.gz DRJXLPKKLBUGNK-GXSJLCMTSA-N 2 0 224.373 2.397 20 0 BEADRP C[C@@H]1C[N@H+](CCC[NH2+]CC(C)(C)C)CCCO1 ZINC000432363079 387785332 /nfs/dbraw/zinc/78/53/32/387785332.db2.gz SBCMHUSSKVNNIM-CYBMUJFWSA-N 2 0 242.407 2.123 20 0 BEADRP Cc1ccccc1OCC[NH2+][C@H](C)C[C@H](C)[NH3+] ZINC000422944479 387786398 /nfs/dbraw/zinc/78/63/98/387786398.db2.gz MHXPAWOGHSUCNM-QWHCGFSZSA-N 2 0 236.359 2.089 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]C[C@H](C)Oc1ccccc1 ZINC000422980906 387790668 /nfs/dbraw/zinc/79/06/68/387790668.db2.gz MRKACFCMAKKCQA-AVGNSLFASA-N 2 0 236.359 2.169 20 0 BEADRP C[C@H](Cc1ccc(O)cc1)[NH2+][C@H](C)C[C@H](C)[NH3+] ZINC000422982958 387793313 /nfs/dbraw/zinc/79/33/13/387793313.db2.gz YHIQSLKAFJNKEN-QJPTWQEYSA-N 2 0 236.359 2.039 20 0 BEADRP CCC[C@H](C[NH2+][C@H]1CC[N@H+](C)C[C@H]1C)OCC ZINC000527931943 387794998 /nfs/dbraw/zinc/79/49/98/387794998.db2.gz ONFWXFBPOPPQRD-MCIONIFRSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CCCC(F)(F)F ZINC000422962462 387813131 /nfs/dbraw/zinc/81/31/31/387813131.db2.gz CORPZFHWZQCSLH-JGVFFNPUSA-N 2 0 212.259 2.044 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+]CC1(Cc2ccccc2)CC1 ZINC000422991281 387800345 /nfs/dbraw/zinc/80/03/45/387800345.db2.gz ASQGUNJLCSAEBL-LSDHHAIUSA-N 2 0 244.382 2.479 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CCC[C@@H]1CCCC[C@H]1O ZINC000422991655 387800635 /nfs/dbraw/zinc/80/06/35/387800635.db2.gz PYPCZMNEYKYUNQ-XDQVBPFNSA-N 2 0 242.407 2.033 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CCC[C@H]1CCCC[C@@H]1O ZINC000422991650 387800869 /nfs/dbraw/zinc/80/08/69/387800869.db2.gz PYPCZMNEYKYUNQ-FQUUOJAGSA-N 2 0 242.407 2.033 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]C[C@@H]1CC1(C)C ZINC000422954362 387809217 /nfs/dbraw/zinc/80/92/17/387809217.db2.gz IJTQIKNFZXAKBJ-WOPDTQHZSA-N 2 0 210.365 2.010 20 0 BEADRP CC1(C)C[C@@H]1C[NH2+][C@H]1CCCCC[C@H]1[NH3+] ZINC000422956272 387809626 /nfs/dbraw/zinc/80/96/26/387809626.db2.gz OZFNUNBRVGNVCS-UTUOFQBUSA-N 2 0 210.365 2.282 20 0 BEADRP COC[C@H]([NH2+][C@H](C)CCC[NH3+])c1ccccc1 ZINC000422956675 387809697 /nfs/dbraw/zinc/80/96/97/387809697.db2.gz QDXBSYQYOAOUNM-OCCSQVGLSA-N 2 0 236.359 2.091 20 0 BEADRP Cc1ccc2c(c1C)OC[C@@H]2[NH2+][C@H](C)C[C@@H](C)[NH3+] ZINC000422958081 387810189 /nfs/dbraw/zinc/81/01/89/387810189.db2.gz OMXXVVQNTPRNMA-GYSYKLTISA-N 2 0 248.370 2.452 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)[C@H]2CC23CC3)C1 ZINC000527855957 387757349 /nfs/dbraw/zinc/75/73/49/387757349.db2.gz XKJUXRAHAQPYRP-BFHYXJOUSA-N 2 0 236.403 2.497 20 0 BEADRP CCOc1cccc(C[NH2+][C@H](C)C[C@@H](C)[NH3+])c1 ZINC000422882724 387758186 /nfs/dbraw/zinc/75/81/86/387758186.db2.gz SUUZKDWFRSFKIK-VXGBXAGGSA-N 2 0 236.359 2.301 20 0 BEADRP C[C@@H]([NH3+])C[NH2+][C@H](C)C1CCC(F)(F)CC1 ZINC000643526949 387760586 /nfs/dbraw/zinc/76/05/86/387760586.db2.gz HUMPIUVBZZEBCB-RKDXNWHRSA-N 2 0 220.307 2.137 20 0 BEADRP Cc1ccc(C[C@@H](C)[NH2+][C@@H](C)C2C[NH2+]C2)c(C)c1 ZINC000422886254 387761235 /nfs/dbraw/zinc/76/12/35/387761235.db2.gz INVWIWMMJBINOT-KGLIPLIRSA-N 2 0 246.398 2.432 20 0 BEADRP C[C@H]([NH2+]CC1CC[NH+](C)CC1)C1CCCC1 ZINC000054081305 387825189 /nfs/dbraw/zinc/82/51/89/387825189.db2.gz MXSOFSIJINBKEJ-LBPRGKRZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CC1Cc2ccccc2C1 ZINC000422976013 387825851 /nfs/dbraw/zinc/82/58/51/387825851.db2.gz CRWOEWDARUYNML-NEPJUHHUSA-N 2 0 232.371 2.117 20 0 BEADRP CC(C)[NH+](CCCN[C@@H](C)C[C@H](C)[NH3+])C(C)C ZINC000423003549 387826529 /nfs/dbraw/zinc/82/65/29/387826529.db2.gz HWCOTVPWYGAWOM-KBPBESRZSA-N 2 0 243.439 2.211 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+]CC1(C2CC2)CCC1 ZINC000423005635 387828314 /nfs/dbraw/zinc/82/83/14/387828314.db2.gz SPAPQHPRYQMPFF-NWDGAFQWSA-N 2 0 208.349 2.036 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CC12CCC(CC1)C2 ZINC000423013657 387835487 /nfs/dbraw/zinc/83/54/87/387835487.db2.gz NECBQBBCEUAYRY-IALDZJHCSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)CSCC[NH2+][C@H](C)C[C@@H](C)[NH3+] ZINC000423012168 387835882 /nfs/dbraw/zinc/83/58/82/387835882.db2.gz KEPWUQMNBSBKCT-GHMZBOCLSA-N 2 0 218.410 2.091 20 0 BEADRP CC(C)CSCCC[NH2+][C@@H]1CCC[C@H]1[NH3+] ZINC000423013903 387836179 /nfs/dbraw/zinc/83/61/79/387836179.db2.gz NTKMIJJOXLLKKG-VXGBXAGGSA-N 2 0 230.421 2.235 20 0 BEADRP CC(C)CSCCC[NH2+][C@H]1CCC[C@H]1C[NH3+] ZINC000423012191 387836542 /nfs/dbraw/zinc/83/65/42/387836542.db2.gz KGAXVWBRZURPLX-STQMWFEESA-N 2 0 244.448 2.483 20 0 BEADRP CC(C)CSCCC[NH2+][C@H](C)C[C@H](C)[NH3+] ZINC000423014866 387838099 /nfs/dbraw/zinc/83/80/99/387838099.db2.gz PYEQKZWFPSIPSP-NWDGAFQWSA-N 2 0 232.437 2.481 20 0 BEADRP CC(C)CSCCC[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000423014867 387838423 /nfs/dbraw/zinc/83/84/23/387838423.db2.gz PYEQKZWFPSIPSP-RYUDHWBXSA-N 2 0 232.437 2.481 20 0 BEADRP CC[C@H]([NH2+][C@H](C)C[C@@H](C)[NH3+])c1c(C)noc1C ZINC000423015249 387838490 /nfs/dbraw/zinc/83/84/90/387838490.db2.gz QOFGEFJVXCXNJQ-LNLATYFQSA-N 2 0 239.363 2.458 20 0 BEADRP Cc1cnccc1CC[NH2+][C@H]1CCCCC[C@H]1[NH3+] ZINC000423016235 387839741 /nfs/dbraw/zinc/83/97/41/387839741.db2.gz SKRYVDXFQVOXOG-CABCVRRESA-N 3 0 247.386 2.182 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H]1CCC12CCCC2 ZINC000423073260 387873640 /nfs/dbraw/zinc/87/36/40/387873640.db2.gz IICBVBKIZXCZIA-NEPJUHHUSA-N 2 0 210.365 2.426 20 0 BEADRP [NH3+]CC1CCC([NH2+]C[C@H]2CCCCS2)CC1 ZINC000423025993 387842926 /nfs/dbraw/zinc/84/29/26/387842926.db2.gz AKFFUWPVBSBMPR-WXRRBKDZSA-N 2 0 242.432 2.379 20 0 BEADRP CS[C@H](C[NH2+][C@@H](C)[C@@H]1CCC[NH2+]1)C(C)(C)C ZINC000423025907 387843815 /nfs/dbraw/zinc/84/38/15/387843815.db2.gz AGIKMNRPPJPYJF-SDDRHHMPSA-N 2 0 244.448 2.494 20 0 BEADRP CS[C@H](C[NH2+][C@H](C)[C@H]1CCC[NH2+]1)C(C)(C)C ZINC000423025904 387844025 /nfs/dbraw/zinc/84/40/25/387844025.db2.gz AGIKMNRPPJPYJF-IJLUTSLNSA-N 2 0 244.448 2.494 20 0 BEADRP Cc1cc(C[NH+](C)C)cc(N[C@@H]2CCC[C@H]2[NH3+])c1 ZINC000423028483 387845911 /nfs/dbraw/zinc/84/59/11/387845911.db2.gz QYJREODTLLXBNJ-HUUCEWRRSA-N 2 0 247.386 2.348 20 0 BEADRP Cc1cc(C[NH2+][C@H](C)C2C[NH2+]C2)ccc1Cl ZINC000423029409 387846173 /nfs/dbraw/zinc/84/61/73/387846173.db2.gz AAWFZVUBBGMOLM-SNVBAGLBSA-N 2 0 238.762 2.346 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]CCC[C@@H]1CCCCO1 ZINC000423029445 387846555 /nfs/dbraw/zinc/84/65/55/387846555.db2.gz AHTMFABTBLGJMZ-IHRRRGAJSA-N 2 0 240.391 2.053 20 0 BEADRP Cc1cnc([C@H](C)C[NH2+][C@@H]2CCC[C@H]2[NH3+])s1 ZINC000423031791 387847035 /nfs/dbraw/zinc/84/70/35/387847035.db2.gz DQTBHZQJOVIAQO-FBIMIBRVSA-N 2 0 239.388 2.024 20 0 BEADRP CS[C@H](C[NH2+][C@H]1CCC[C@H]1[NH3+])C(C)(C)C ZINC000423031923 387848554 /nfs/dbraw/zinc/84/85/54/387848554.db2.gz LQTSCSQGIJZZAO-OUAUKWLOSA-N 2 0 230.421 2.234 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]CCC[C@H]1CCCCO1 ZINC000423031796 387849005 /nfs/dbraw/zinc/84/90/05/387849005.db2.gz DQTBSLSLLRGQQD-QWHCGFSZSA-N 2 0 228.380 2.053 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CCC[C@H]1CCCCO1 ZINC000423031794 387849105 /nfs/dbraw/zinc/84/91/05/387849105.db2.gz DQTBSLSLLRGQQD-CHWSQXEVSA-N 2 0 228.380 2.053 20 0 BEADRP Cc1csc([C@H](C)C[NH2+][C@H]2CCC[C@@H]2[NH3+])n1 ZINC000423034323 387849265 /nfs/dbraw/zinc/84/92/65/387849265.db2.gz HSNPNTIUTDYMRN-MIMYLULJSA-N 2 0 239.388 2.024 20 0 BEADRP Cc1csc([C@H](C)C[NH2+][C@H](C)CCC[NH3+])n1 ZINC000423036362 387851679 /nfs/dbraw/zinc/85/16/79/387851679.db2.gz KWJMPGWXNPTXGL-NXEZZACHSA-N 2 0 241.404 2.272 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1ccco1 ZINC000643534515 387852209 /nfs/dbraw/zinc/85/22/09/387852209.db2.gz WQUYDBJIIYEGJB-ZYHUDNBSSA-N 2 0 220.316 2.072 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1ccco1 ZINC000643534512 387852656 /nfs/dbraw/zinc/85/26/56/387852656.db2.gz WQUYDBJIIYEGJB-CMPLNLGQSA-N 2 0 220.316 2.072 20 0 BEADRP C[C@H]([NH2+]CCC[C@@H]1CCCCO1)[C@H]1CCC[NH2+]1 ZINC000423041671 387854568 /nfs/dbraw/zinc/85/45/68/387854568.db2.gz XQHTYDSSVUKAPC-MELADBBJSA-N 2 0 240.391 2.066 20 0 BEADRP C[N@H+]1C[C@@H]2C[NH+](CCCc3ccccc3)C[C@@H]2C1 ZINC000193604554 387856317 /nfs/dbraw/zinc/85/63/17/387856317.db2.gz UBLWNEUTTNEUNH-IYBDPMFKSA-N 2 0 244.382 2.113 20 0 BEADRP CC(C)C[C@@H]1C[C@H]([NH2+][C@H](C)C[C@H](C)[NH3+])CCO1 ZINC000423046269 387857943 /nfs/dbraw/zinc/85/79/43/387857943.db2.gz TUQKOTXIRCUDFT-REWJHTLYSA-N 2 0 242.407 2.296 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]C1(Cc2ccccc2)CC1 ZINC000423046049 387858299 /nfs/dbraw/zinc/85/82/99/387858299.db2.gz CXYNUEPZABRKJH-CYBMUJFWSA-N 2 0 232.371 2.479 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]C1(Cc2ccccc2)CC1 ZINC000423046050 387858678 /nfs/dbraw/zinc/85/86/78/387858678.db2.gz CXYNUEPZABRKJH-ZDUSSCGKSA-N 2 0 232.371 2.479 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)CCCC(F)(F)F)C1C[NH2+]C1 ZINC000423074913 387874350 /nfs/dbraw/zinc/87/43/50/387874350.db2.gz NDUVVVJKIMZCRQ-DTWKUNHWSA-N 2 0 238.297 2.305 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1cccc(O)c1 ZINC000643534945 387861952 /nfs/dbraw/zinc/86/19/52/387861952.db2.gz GEFTZIXJRFRUBN-RISCZKNCSA-N 2 0 246.354 2.185 20 0 BEADRP C[C@@H](C[NH2+]C1CCC([NH3+])CC1)c1ccncc1 ZINC000643460312 387874486 /nfs/dbraw/zinc/87/44/86/387874486.db2.gz OJDMSEMBGUKTGD-XGNXJENSSA-N 2 0 233.359 2.045 20 0 BEADRP CSCCCCC[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000423055018 387862471 /nfs/dbraw/zinc/86/24/71/387862471.db2.gz VHPXBPIHMSLSJR-FUNVUKJBSA-N 2 0 242.432 2.392 20 0 BEADRP C1[C@H]([NH2+][C@@H]2CCC23CCC3)C12CC[NH2+]CC2 ZINC000643535377 387863158 /nfs/dbraw/zinc/86/31/58/387863158.db2.gz CXBTWFPBZDIGRJ-NEPJUHHUSA-N 2 0 220.360 2.051 20 0 BEADRP CC(C)C(C)(C)C[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000423060314 387864491 /nfs/dbraw/zinc/86/44/91/387864491.db2.gz OEJPINXTEWDOLP-QWRGUYRKSA-N 2 0 200.370 2.384 20 0 BEADRP CC(C)[C@@H](CC(F)(F)F)[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000423059051 387865506 /nfs/dbraw/zinc/86/55/06/387865506.db2.gz KUYVBRBDQYZXGB-WCBMZHEXSA-N 2 0 238.297 2.161 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1ccoc1 ZINC000643536166 387867444 /nfs/dbraw/zinc/86/74/44/387867444.db2.gz RZFBKWTVSKCGLS-PWSUYJOCSA-N 2 0 220.316 2.072 20 0 BEADRP CC(C)C1CC([NH2+][C@@H]2CCC[C@@H]2C[NH3+])C1 ZINC000423067845 387870255 /nfs/dbraw/zinc/87/02/55/387870255.db2.gz AHQREBRYQCPVSP-IKWCTNDRSA-N 2 0 210.365 2.138 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+][C@H]1CCC12CCCC2 ZINC000423074532 387874776 /nfs/dbraw/zinc/87/47/76/387874776.db2.gz LYDNUDURPHPXOY-OLZOCXBDSA-N 2 0 240.391 2.053 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]Cc1ccc2c(n1)CCCC2 ZINC000423072053 387872037 /nfs/dbraw/zinc/87/20/37/387872037.db2.gz GOBLCTOFBYJIAP-NWDGAFQWSA-N 2 0 247.386 2.176 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]C[C@](C)(O)C1CCCCC1 ZINC000423072304 387872461 /nfs/dbraw/zinc/87/24/61/387872461.db2.gz JCPPQCIPZGFPGW-JSGCOSHPSA-N 2 0 242.407 2.035 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+][C@H](C)C[C@H](C)[NH3+] ZINC000422965065 387813797 /nfs/dbraw/zinc/81/37/97/387813797.db2.gz NMGZTJKERPNXLN-QJPTWQEYSA-N 2 0 224.348 2.316 20 0 BEADRP COc1ccccc1C[C@@H]1CCCN1C[C@@H](C)[NH3+] ZINC000442656102 387815225 /nfs/dbraw/zinc/81/52/25/387815225.db2.gz DOCQMWPUBFETBO-OCCSQVGLSA-N 2 0 248.370 2.049 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]CCc1ccccc1O ZINC000422966919 387816974 /nfs/dbraw/zinc/81/69/74/387816974.db2.gz AVQHWUUMFWRBSO-KGLIPLIRSA-N 2 0 248.370 2.184 20 0 BEADRP COc1ccccc1[C@@H]1CCCN1C[C@@H](C)[NH3+] ZINC000442667199 387819361 /nfs/dbraw/zinc/81/93/61/387819361.db2.gz YOKIRYKCWWZKKJ-YPMHNXCESA-N 2 0 234.343 2.179 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[C@@H](C)[C@@H]1C)C1C[NH2+]C1 ZINC000423101642 387889875 /nfs/dbraw/zinc/88/98/75/387889875.db2.gz WEFRXSNJZQOQKI-MROQNXINSA-N 2 0 224.392 2.256 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]C[C@H]1CCCC(F)(F)C1 ZINC000423103428 387889887 /nfs/dbraw/zinc/88/98/87/387889887.db2.gz AKLCYSLOVMEJNB-HBNTYKKESA-N 2 0 232.318 2.281 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+][C@H]2CC[NH2+]CC[C@@H]2C)C1 ZINC000423101934 387890041 /nfs/dbraw/zinc/89/00/41/387890041.db2.gz WOJZJTZIKKLENX-RFGFWPKPSA-N 2 0 224.392 2.400 20 0 BEADRP CC(C)SCC[NH2+][C@@H]1CCCCC[C@@H]1[NH3+] ZINC000423105357 387890334 /nfs/dbraw/zinc/89/03/34/387890334.db2.gz IFPNUQOBKBFBLC-NWDGAFQWSA-N 2 0 230.421 2.378 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]CC1(C(F)(F)F)CCC1 ZINC000423106999 387891282 /nfs/dbraw/zinc/89/12/82/387891282.db2.gz KFLIFQYPUJUOLO-BDAKNGLRSA-N 2 0 236.281 2.188 20 0 BEADRP Cc1cc([C@@H](C)[NH2+][C@H](C)CCCC[NH3+])no1 ZINC000423105774 387891777 /nfs/dbraw/zinc/89/17/77/387891777.db2.gz CKEOWQAIBZONSW-MWLCHTKSSA-N 2 0 225.336 2.151 20 0 BEADRP C[C@@H]([NH2+]CCC1(F)CCC1)[C@@H]1CCCC[NH2+]1 ZINC000423105844 387892106 /nfs/dbraw/zinc/89/21/06/387892106.db2.gz IXOZLRFUJLTKPD-NEPJUHHUSA-N 2 0 228.355 2.389 20 0 BEADRP CC(C)SCC[NH2+][C@@H]1CCCCC[C@H]1[NH3+] ZINC000423105359 387892186 /nfs/dbraw/zinc/89/21/86/387892186.db2.gz IFPNUQOBKBFBLC-VXGBXAGGSA-N 2 0 230.421 2.378 20 0 BEADRP COCC[C@H]([NH2+][C@H](C)C[C@@H](C)[NH3+])C(C)(C)C ZINC000423116777 387898907 /nfs/dbraw/zinc/89/89/07/387898907.db2.gz RLSNJDIKOVNTKM-UTUOFQBUSA-N 2 0 230.396 2.153 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]CC1(C(F)(F)F)CC1 ZINC000423108381 387892628 /nfs/dbraw/zinc/89/26/28/387892628.db2.gz LZZFRZGXYIUYHE-QMMMGPOBSA-N 2 0 224.270 2.046 20 0 BEADRP C[C@H]([NH2+]CC1CC(c2ccccc2)C1)C1C[NH2+]C1 ZINC000423110407 387893282 /nfs/dbraw/zinc/89/32/82/387893282.db2.gz HXZMRTLIZAENAV-OPFPJEHXSA-N 2 0 244.382 2.378 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCC1(C)C)[C@H]1CCCC[NH2+]1 ZINC000423109976 387893627 /nfs/dbraw/zinc/89/36/27/387893627.db2.gz OHHNMWGJKIJTPJ-UTUOFQBUSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]CC1(c2ccccn2)CCC1 ZINC000423113953 387896237 /nfs/dbraw/zinc/89/62/37/387896237.db2.gz VBOSKWWIHQHYPE-ZDUSSCGKSA-N 2 0 247.386 2.220 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CCC1C[C@@H](C)O[C@H](C)C1 ZINC000423116316 387898333 /nfs/dbraw/zinc/89/83/33/387898333.db2.gz PIIZLFZBBGJJBT-JHJVBQTASA-N 2 0 242.407 2.297 20 0 BEADRP CC[C@H]([NH2+]C[C@@H](C)c1ccncc1)[C@@H]1CCC[NH2+]1 ZINC000643460376 387875264 /nfs/dbraw/zinc/87/52/64/387875264.db2.gz WRCJABCCGDEGPR-SNPRPXQTSA-N 2 0 247.386 2.305 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@@H]1CCC12CCCC2 ZINC000423077820 387876083 /nfs/dbraw/zinc/87/60/83/387876083.db2.gz URYXGSABJVWXEI-QJPTWQEYSA-N 2 0 210.365 2.425 20 0 BEADRP CC1(CC[NH2+][C@H]2CCCC[C@H]2C[NH3+])CC1 ZINC000423083673 387878129 /nfs/dbraw/zinc/87/81/29/387878129.db2.gz GFYREANMORHCIA-RYUDHWBXSA-N 2 0 210.365 2.284 20 0 BEADRP CC1(CC[NH2+][C@@H]2CCCCC[C@@H]2[NH3+])CC1 ZINC000423084724 387879537 /nfs/dbraw/zinc/87/95/37/387879537.db2.gz IQBRHWVEJROOBO-NWDGAFQWSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H]1CCCc2cccnc21 ZINC000643539332 387879953 /nfs/dbraw/zinc/87/99/53/387879953.db2.gz MYBKSWPHTPJCRB-YPMHNXCESA-N 2 0 233.359 2.176 20 0 BEADRP CSC1(C[NH2+][C@@H]2CC[NH2+]CC[C@H]2C)CCC1 ZINC000423086188 387880907 /nfs/dbraw/zinc/88/09/07/387880907.db2.gz LMOKRNSDDNXTCR-VXGBXAGGSA-N 2 0 242.432 2.250 20 0 BEADRP CC1(CC[NH2+]C2CCC(C[NH3+])CC2)CC1 ZINC000423087578 387881036 /nfs/dbraw/zinc/88/10/36/387881036.db2.gz PWCVSIRQPSRYBJ-UHFFFAOYSA-N 2 0 210.365 2.284 20 0 BEADRP CSC1(C[NH2+][C@H]2CC[NH2+]CC[C@@H]2C)CCC1 ZINC000423086187 387881652 /nfs/dbraw/zinc/88/16/52/387881652.db2.gz LMOKRNSDDNXTCR-RYUDHWBXSA-N 2 0 242.432 2.250 20 0 BEADRP COCC[C@@H]([NH2+][C@@H]1CCC[NH2+]CC1)C(C)(C)C ZINC000423117232 387898640 /nfs/dbraw/zinc/89/86/40/387898640.db2.gz UIRYAUYCLAEEGZ-CHWSQXEVSA-N 2 0 242.407 2.169 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CCC(F)(F)C1)[C@@H]1CCC[NH2+]1 ZINC000423095216 387885387 /nfs/dbraw/zinc/88/53/87/387885387.db2.gz LQGHJTMTNXFDSL-VWYCJHECSA-N 2 0 232.318 2.152 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CC[C@H]1C1CC1 ZINC000423095867 387886005 /nfs/dbraw/zinc/88/60/05/387886005.db2.gz NHHROIYZSRSNOA-XDQVBPFNSA-N 2 0 222.376 2.282 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H]1CC[C@@H]1C ZINC000423116156 387898712 /nfs/dbraw/zinc/89/87/12/387898712.db2.gz ZRTPHBCBTMPAGT-CHIMOYNISA-N 2 0 233.359 2.298 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]CCCc1ccccc1F ZINC000423097888 387886552 /nfs/dbraw/zinc/88/65/52/387886552.db2.gz RIUUFAXDKIRNCA-KGLIPLIRSA-N 2 0 236.334 2.228 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H](CO)CCC(C)(C)C ZINC000423098615 387886628 /nfs/dbraw/zinc/88/66/28/387886628.db2.gz SMSRWKNDEQBZCF-CHWSQXEVSA-N 2 0 244.423 2.281 20 0 BEADRP CC[C@H]([NH2+]CCC1(F)CCC1)[C@@H]1CCC[NH2+]1 ZINC000423101129 387887017 /nfs/dbraw/zinc/88/70/17/387887017.db2.gz CLOLVCMMVKYCJJ-RYUDHWBXSA-N 2 0 228.355 2.389 20 0 BEADRP FC(F)(F)C1(C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)CC1 ZINC000423100128 387887459 /nfs/dbraw/zinc/88/74/59/387887459.db2.gz BNGUVECYEZEUAG-ULKQDVFKSA-N 2 0 248.292 2.202 20 0 BEADRP C[C@@H]1CCC[C@@H]1C[NH2+][C@@H]1CC[NH2+]CC[C@H]1C ZINC000423098107 387887580 /nfs/dbraw/zinc/88/75/80/387887580.db2.gz KGFUOJPHXGRNSK-AAVRWANBSA-N 2 0 224.392 2.400 20 0 BEADRP Cc1cccc(CCC[NH2+][C@H](C)CCC[NH3+])n1 ZINC000423102356 387889393 /nfs/dbraw/zinc/88/93/93/387889393.db2.gz KAMJIFMRVDWOSK-GFCCVEGCSA-N 2 0 235.375 2.040 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CCC1CC(F)(F)C1 ZINC000423163808 387918233 /nfs/dbraw/zinc/91/82/33/387918233.db2.gz NLXQBXBTRLBQGZ-SECBINFHSA-N 2 0 220.307 2.139 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CC[C@H](C)F ZINC000423140128 387918435 /nfs/dbraw/zinc/91/84/35/387918435.db2.gz XKMIXFZUIAEWPZ-VHSXEESVSA-N 2 0 239.338 2.247 20 0 BEADRP C[C@H]([NH2+]C1CC(C(F)(F)F)C1)[C@@H]1CCC[NH2+]1 ZINC000423121042 387900108 /nfs/dbraw/zinc/90/01/08/387900108.db2.gz HUNSGYKVOXDFLQ-NFTFJBJSSA-N 2 0 236.281 2.057 20 0 BEADRP FC1(CC[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)CCC1 ZINC000423118769 387901022 /nfs/dbraw/zinc/90/10/22/387901022.db2.gz CEWZMKCUUWJANV-FOSCPWQOSA-N 2 0 226.339 2.141 20 0 BEADRP C[C@@H]([NH2+]C1CC(C(F)(F)F)C1)[C@@H]1CCC[NH2+]1 ZINC000423121044 387901519 /nfs/dbraw/zinc/90/15/19/387901519.db2.gz HUNSGYKVOXDFLQ-WOOKNIGNSA-N 2 0 236.281 2.057 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC000423126548 387904691 /nfs/dbraw/zinc/90/46/91/387904691.db2.gz AVTYFZJRPLYGSL-XQLPTFJDSA-N 2 0 230.355 2.260 20 0 BEADRP C=Cc1ccc(CC[NH2+][C@H](C)[C@@H]2CC[NH2+]C2)cc1 ZINC000423125554 387905851 /nfs/dbraw/zinc/90/58/51/387905851.db2.gz ADXJHSFMMJABKE-CZUORRHYSA-N 2 0 244.382 2.460 20 0 BEADRP C([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)[C@@H]1CCCSC1 ZINC000423134571 387911486 /nfs/dbraw/zinc/91/14/86/387911486.db2.gz WXWCCBCTGRMQSS-ACJTYDJDSA-N 2 0 240.416 2.002 20 0 BEADRP COCC1(C[NH2+][C@@H]2CCC[C@@H]2[NH3+])CCCCC1 ZINC000423134198 387911974 /nfs/dbraw/zinc/91/19/74/387911974.db2.gz DNVKHDMYPBEVJT-QWHCGFSZSA-N 2 0 240.391 2.053 20 0 BEADRP C([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)[C@H]1CCCSC1 ZINC000423134572 387912639 /nfs/dbraw/zinc/91/26/39/387912639.db2.gz WXWCCBCTGRMQSS-FKJOKYEKSA-N 2 0 240.416 2.002 20 0 BEADRP COCC1(C[NH2+][C@H]2CCC[C@H]2[NH3+])CCCCC1 ZINC000423134197 387912697 /nfs/dbraw/zinc/91/26/97/387912697.db2.gz DNVKHDMYPBEVJT-OLZOCXBDSA-N 2 0 240.391 2.053 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CCCCF ZINC000423139475 387915937 /nfs/dbraw/zinc/91/59/37/387915937.db2.gz KVOUWFBOBZYXAB-SNVBAGLBSA-N 2 0 239.338 2.249 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CC(C)(C)c1ccccn1 ZINC000423150808 387929369 /nfs/dbraw/zinc/92/93/69/387929369.db2.gz ZGCYVVMPKQUCRE-ZDUSSCGKSA-N 2 0 249.402 2.466 20 0 BEADRP Cc1cccnc1CC[NH2+][C@@H]1CCCCC[C@H]1[NH3+] ZINC000423151968 387929770 /nfs/dbraw/zinc/92/97/70/387929770.db2.gz LAJIHAIZTSXXRZ-UKRRQHHQSA-N 2 0 247.386 2.182 20 0 BEADRP FC1(F)CCC[C@@H]1C[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000423153917 387933022 /nfs/dbraw/zinc/93/30/22/387933022.db2.gz OCIQJMLLDYWSHA-YIBTVLSRSA-N 2 0 244.329 2.294 20 0 BEADRP C[C@@H]([NH2+]C1(Cc2ccc(F)cc2)CC1)C1C[NH2+]C1 ZINC000423155835 387935054 /nfs/dbraw/zinc/93/50/54/387935054.db2.gz LUAYFHSSZXUING-LLVKDONJSA-N 2 0 248.345 2.098 20 0 BEADRP Cc1cccnc1CCC[NH2+][C@H](C)CCC[NH3+] ZINC000423155872 387935401 /nfs/dbraw/zinc/93/54/01/387935401.db2.gz RINQDPLOESWXNJ-CYBMUJFWSA-N 2 0 235.375 2.040 20 0 BEADRP Cc1cccc2c1OC[C@H]([NH2+][C@@H](C)C[C@@H](C)[NH3+])C2 ZINC000423144410 387920090 /nfs/dbraw/zinc/92/00/90/387920090.db2.gz YWIZXVORNITQEH-MBNYWOFBSA-N 2 0 248.370 2.014 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCCCC1(F)F)C1C[NH2+]C1 ZINC000423144744 387920272 /nfs/dbraw/zinc/92/02/72/387920272.db2.gz HUZGAHDPZSVEES-ONGXEEELSA-N 2 0 232.318 2.009 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]C[C@@H]1CSc2ccccc21 ZINC000423142906 387920763 /nfs/dbraw/zinc/92/07/63/387920763.db2.gz BPHRLAIRYCANDY-RAIGVLPGSA-N 2 0 248.395 2.345 20 0 BEADRP CCC[C@H](C[NH2+][C@@H]1CCCCC[C@H]1[NH3+])OC ZINC000423144613 387921264 /nfs/dbraw/zinc/92/12/64/387921264.db2.gz HNAXCDXNLUJMLK-JHJVBQTASA-N 2 0 228.380 2.051 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCc2ccccc21)C1C[NH2+]C1 ZINC000423142707 387921513 /nfs/dbraw/zinc/92/15/13/387921513.db2.gz BHJMHTCIGBJTLS-GXTWGEPZSA-N 2 0 244.382 2.304 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1C[C@H]1C(C)C)[C@@H]1CCC[NH2+]1 ZINC000423148448 387924779 /nfs/dbraw/zinc/92/47/79/387924779.db2.gz GBDVYZCUGFGNNT-XUXIUFHCSA-N 2 0 224.392 2.399 20 0 BEADRP F[C@H]1CCC[C@H]1[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000423148187 387925659 /nfs/dbraw/zinc/92/56/59/387925659.db2.gz UTIXIQNJSHIZQA-XVIXHAIJSA-N 2 0 240.366 2.387 20 0 BEADRP CCn1ccnc1[C@@H](C)[NH2+][C@@H](C)CCCC[NH3+] ZINC000423146889 387926245 /nfs/dbraw/zinc/92/62/45/387926245.db2.gz BNJMASAVFPJBFA-NWDGAFQWSA-N 2 0 238.379 2.071 20 0 BEADRP F[C@H]1CCC[C@H]1[NH2+][C@@H]1CCC[C@H]1[C@H]1CCC[NH2+]1 ZINC000423148183 387926280 /nfs/dbraw/zinc/92/62/80/387926280.db2.gz UTIXIQNJSHIZQA-ODXJTPSBSA-N 2 0 240.366 2.387 20 0 BEADRP Cc1cccnc1CCC[NH2+][C@H](C)[C@H]1CCC[NH2+]1 ZINC000423147086 387926315 /nfs/dbraw/zinc/92/63/15/387926315.db2.gz CBRIDKZPZXXSEM-UKRRQHHQSA-N 2 0 247.386 2.053 20 0 BEADRP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]C[C@@H]1C[C@H]1C1CCC1 ZINC000424288178 387952109 /nfs/dbraw/zinc/95/21/09/387952109.db2.gz IGLOJIYQASLAGX-MXAVVETBSA-N 2 0 236.403 2.352 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]C1(C2CCC2)CCC1 ZINC000423168393 387952608 /nfs/dbraw/zinc/95/26/08/387952608.db2.gz HDYJZLFLIORYBZ-NSHDSACASA-N 2 0 210.365 2.426 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2ccncc2)C1 ZINC000245514866 387952886 /nfs/dbraw/zinc/95/28/86/387952886.db2.gz GOEDZZMCOMJCIJ-ZIAGYGMSSA-N 2 0 247.386 2.464 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccncc2)C1 ZINC000245514865 387953914 /nfs/dbraw/zinc/95/39/14/387953914.db2.gz GOEDZZMCOMJCIJ-KGLIPLIRSA-N 2 0 247.386 2.464 20 0 BEADRP CC(C)C[C@@H]1C[C@H]1[NH2+][C@@H]1CCC[C@@H]1C[NH3+] ZINC000423169740 387954398 /nfs/dbraw/zinc/95/43/98/387954398.db2.gz KJJMILUNTKEYAG-FDYHWXHSSA-N 2 0 210.365 2.138 20 0 BEADRP CCO[C@@H]1CCCC[C@H]1[NH2+][C@H](C)C[C@@H](C)[NH3+] ZINC000423169233 387955702 /nfs/dbraw/zinc/95/57/02/387955702.db2.gz VTXIMCHZDGVGIY-FDYHWXHSSA-N 2 0 228.380 2.050 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CC(C)(C)C1(O)CCCC1 ZINC000423169516 387955729 /nfs/dbraw/zinc/95/57/29/387955729.db2.gz WEGTWKDVCNLPAA-GFCCVEGCSA-N 2 0 242.407 2.035 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+]CC2CCCCC2)C1 ZINC000044535275 387937914 /nfs/dbraw/zinc/93/79/14/387937914.db2.gz SGEVKUMOJBZSJO-CQSZACIVSA-N 2 0 224.392 2.498 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+]C(C2CC2)C2CC2)C1 ZINC000044534432 387938627 /nfs/dbraw/zinc/93/86/27/387938627.db2.gz VNFMKHHNONJAKW-LLVKDONJSA-N 2 0 222.376 2.106 20 0 BEADRP CC[C@@H](C)[C@H](C[NH2+]C1CCC(C[NH3+])CC1)OC ZINC000423158658 387939220 /nfs/dbraw/zinc/93/92/20/387939220.db2.gz OLJNBTKZMBCGOG-RYSNWHEDSA-N 2 0 242.407 2.155 20 0 BEADRP C[C@@H]([NH2+]CC(C)(C)C1=CCCC1)C1C[NH2+]C1 ZINC000423160998 387940454 /nfs/dbraw/zinc/94/04/54/387940454.db2.gz IHJBRYZLYHMFMO-LLVKDONJSA-N 2 0 222.376 2.320 20 0 BEADRP C[NH2+]CCC[N@H+](C)C[C@@H]1CCCC[C@@H]1C ZINC000394834724 387942452 /nfs/dbraw/zinc/94/24/52/387942452.db2.gz QDKDOBKEPNTEEC-STQMWFEESA-N 2 0 212.381 2.354 20 0 BEADRP CC[C@@]1(C(C)C)C[C@@H]1[NH2+]C1CC[NH2+]CC1 ZINC000423162127 387943680 /nfs/dbraw/zinc/94/36/80/387943680.db2.gz KNFSGTQRJQWPHD-STQMWFEESA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)O[C@H]1C[C@@H]([NH2+][C@H]2CCCCC[C@H]2[NH3+])C1 ZINC000423161546 387944016 /nfs/dbraw/zinc/94/40/16/387944016.db2.gz JBEPBHDGROGZPK-RQJABVFESA-N 2 0 240.391 2.192 20 0 BEADRP CC[C@H]([NH2+]CC1CC[NH+](C)CC1)[C@@H]1C[C@H]1C ZINC000321096236 387946844 /nfs/dbraw/zinc/94/68/44/387946844.db2.gz ODMMUELXAMYRND-BNOWGMLFSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)[C@H]1C[C@H]1C ZINC000321098381 387947062 /nfs/dbraw/zinc/94/70/62/387947062.db2.gz ONXSTUJIIKINSD-CZXHOFHRSA-N 2 0 222.376 2.105 20 0 BEADRP CC[N@H+](C[C@@H]1CCC[NH2+]C1)[C@@H](C)C(C)C ZINC000226437207 387947821 /nfs/dbraw/zinc/94/78/21/387947821.db2.gz UPBZWXISNFUCNT-QWHCGFSZSA-N 2 0 212.381 2.352 20 0 BEADRP CC[C@@H]1CCC[C@H]1C[NH2+][C@H](CCC[NH3+])COC ZINC000423164609 387948715 /nfs/dbraw/zinc/94/87/15/387948715.db2.gz XEXMABMJGWPACN-HZSPNIEDSA-N 2 0 242.407 2.156 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CCC1CC(F)(F)C1 ZINC000423166181 387949560 /nfs/dbraw/zinc/94/95/60/387949560.db2.gz QUMGSJWFUBCCJZ-RKDXNWHRSA-N 2 0 220.307 2.137 20 0 BEADRP CC[C@@H]1OCC[C@H]1[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000423166480 387950003 /nfs/dbraw/zinc/95/00/03/387950003.db2.gz CSVKKRJCNDOKLI-TUVASFSCSA-N 2 0 246.354 2.288 20 0 BEADRP COc1ccc([C@H](C)[NH2+]C2CC[NH2+]CC2)c(C)c1 ZINC000423177016 387961743 /nfs/dbraw/zinc/96/17/43/387961743.db2.gz DKQJCCUOSFBYKZ-LBPRGKRZSA-N 2 0 248.370 2.406 20 0 BEADRP COc1ccc([C@H](C)[C@@H](C)[NH2+]CCC[NH3+])cc1 ZINC000423179438 387965127 /nfs/dbraw/zinc/96/51/27/387965127.db2.gz DFHQYHJNPQYZRM-VXGBXAGGSA-N 2 0 236.359 2.126 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+]CCC[NH3+])[C@@H](C)C2 ZINC000423179954 387965212 /nfs/dbraw/zinc/96/52/12/387965212.db2.gz DOUCHXGZAQTHSF-SMDDNHRTSA-N 2 0 218.344 2.167 20 0 BEADRP C[C@H]([NH2+]CCC[NH3+])c1cc2c(s1)CCC2 ZINC000423180531 387965736 /nfs/dbraw/zinc/96/57/36/387965736.db2.gz FDASYYGSZFTUTI-VIFPVBQESA-N 2 0 224.373 2.236 20 0 BEADRP CCC1CC([NH2+]CC2([NH3+])CCCCC2)C1 ZINC000423181341 387967205 /nfs/dbraw/zinc/96/72/05/387967205.db2.gz OXHGQRIZIDLJBT-UHFFFAOYSA-N 2 0 210.365 2.426 20 0 BEADRP CCc1nc(C)c([C@@H](C)[NH2+]CCC[NH3+])s1 ZINC000423183846 387970375 /nfs/dbraw/zinc/97/03/75/387970375.db2.gz IAGKDKDSHDIXIS-MRVPVSSYSA-N 2 0 227.377 2.013 20 0 BEADRP CC[C@H](C[NH2+][C@H](C)C1C[NH2+]C1)CC(F)(F)F ZINC000423185552 387970529 /nfs/dbraw/zinc/97/05/29/387970529.db2.gz NYNWPLNYDRYOKM-BDAKNGLRSA-N 2 0 238.297 2.163 20 0 BEADRP C[C@H](Cc1coc2ccccc12)[NH2+]CCC[NH3+] ZINC000423187623 387970679 /nfs/dbraw/zinc/97/06/79/387970679.db2.gz KXVWTXHXBOCETO-LLVKDONJSA-N 2 0 232.327 2.302 20 0 BEADRP C[NH2+]CCC[NH2+][C@H](C)c1cccc(C)c1 ZINC000423194942 387980342 /nfs/dbraw/zinc/98/03/42/387980342.db2.gz ZQYFKOZPCXWWKZ-GFCCVEGCSA-N 2 0 206.333 2.255 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+][C@@H]1CCCC[C@H]1F ZINC000423193220 387977631 /nfs/dbraw/zinc/97/76/31/387977631.db2.gz VLUIETFLJUKJDQ-UMSGYPCISA-N 2 0 228.355 2.245 20 0 BEADRP C[C@H]([NH2+]CC1([NH3+])CCCCCC1)[C@@H]1CCOC1 ZINC000423201435 387987446 /nfs/dbraw/zinc/98/74/46/387987446.db2.gz ORFQPDLOSHWBOY-QWHCGFSZSA-N 2 0 240.391 2.053 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H](C)CCC(C)(C)C ZINC000423201690 387987889 /nfs/dbraw/zinc/98/78/89/387987889.db2.gz POWYNTGTXXWYJV-NSHDSACASA-N 2 0 200.370 2.400 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H](C)c1ccc(OC)cc1C ZINC000423203318 387989643 /nfs/dbraw/zinc/98/96/43/387989643.db2.gz SKOCGHBZURQLDO-LBPRGKRZSA-N 2 0 236.359 2.264 20 0 BEADRP C[C@H](CC1CCOCC1)[NH2+][C@@H]1CCCC[C@H]1[NH3+] ZINC000424366474 387991791 /nfs/dbraw/zinc/99/17/91/387991791.db2.gz IZJKGRKZNPCJFT-MRVWCRGKSA-N 2 0 240.391 2.051 20 0 BEADRP CC[C@H]1C[C@H](C[NH2+][C@@H]2CCCC[C@H]2[NH3+])CCO1 ZINC000424365884 387992135 /nfs/dbraw/zinc/99/21/35/387992135.db2.gz HXAXIQZJVVYTFH-XJFOESAGSA-N 2 0 240.391 2.051 20 0 BEADRP CC[C@@H]1C[C@H](C)CC[C@@H]1[NH2+]CCC[NH2+]C ZINC000423205040 387992221 /nfs/dbraw/zinc/99/22/21/387992221.db2.gz VBYYVRYGRDSEFL-UPJWGTAASA-N 2 0 212.381 2.400 20 0 BEADRP CC(C)(C)[C@@H]1CC[C@H]1[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000423208365 387993475 /nfs/dbraw/zinc/99/34/75/387993475.db2.gz HTRPWSVCKICAHC-JHJVBQTASA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+][C@@H]1C[C@H]1C1CCC1 ZINC000424369730 387993776 /nfs/dbraw/zinc/99/37/76/387993776.db2.gz CFXQFNJODNOIHF-YXCITZCRSA-N 2 0 222.376 2.153 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1CCc2c1cccc2C ZINC000423208513 387993843 /nfs/dbraw/zinc/99/38/43/387993843.db2.gz YVZVVENWKUJSHT-CQSZACIVSA-N 2 0 218.344 2.181 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000423208858 387993929 /nfs/dbraw/zinc/99/39/29/387993929.db2.gz IBUIDRBIPOMKGG-STQMWFEESA-N 2 0 233.359 2.040 20 0 BEADRP CCC1(C[NH2+][C@H](C)[C@@H]2CCC[NH2+]2)CCC1 ZINC000400501356 387982163 /nfs/dbraw/zinc/98/21/63/387982163.db2.gz FZXGDQUOHJLBPU-NEPJUHHUSA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@H]([NH2+]CCCC[NH+](C)C)c1ccncc1 ZINC000453090552 387982798 /nfs/dbraw/zinc/98/27/98/387982798.db2.gz PENIXYUUPZTVNR-AWEZNQCLSA-N 2 0 235.375 2.464 20 0 BEADRP C[C@H]([NH2+]CC1([NH3+])CCCCCC1)[C@H]1CCCO1 ZINC000423198820 387983182 /nfs/dbraw/zinc/98/31/82/387983182.db2.gz ICHQBGINITYKHA-QWHCGFSZSA-N 2 0 240.391 2.195 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1CCCC12CCCC2 ZINC000423198599 387983945 /nfs/dbraw/zinc/98/39/45/387983945.db2.gz GSCXDPBRLFHWFH-GFCCVEGCSA-N 2 0 210.365 2.298 20 0 BEADRP CCO[C@@H]1C[C@@H]([NH2+]CCC[NH2+]C)C1(CC)CC ZINC000423198087 387984770 /nfs/dbraw/zinc/98/47/70/387984770.db2.gz CZWZJNACGOBRBD-CHWSQXEVSA-N 2 0 242.407 2.169 20 0 BEADRP C[NH2+]CCC[NH2+][C@H]1CCC[C@@H](c2cccnc2)C1 ZINC000423198917 387985840 /nfs/dbraw/zinc/98/58/40/387985840.db2.gz IQVRSKMZULYAAL-HIFRSBDPSA-N 2 0 247.386 2.307 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1CCC[C@H](C(C)C)C1 ZINC000423198878 387986149 /nfs/dbraw/zinc/98/61/49/387986149.db2.gz IKJXCWCWDIXKRE-QWHCGFSZSA-N 2 0 212.381 2.400 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1CCC[C@H](c2cccnc2)C1 ZINC000423198916 387986481 /nfs/dbraw/zinc/98/64/81/387986481.db2.gz IQVRSKMZULYAAL-DZGCQCFKSA-N 2 0 247.386 2.307 20 0 BEADRP CCCCO[C@@H]1C[C@@H]([NH2+]CCC[NH2+]C)C1(C)C ZINC000423200343 387986793 /nfs/dbraw/zinc/98/67/93/387986793.db2.gz LXVJLUUHBZJCRI-CHWSQXEVSA-N 2 0 242.407 2.169 20 0 BEADRP CC[C@H]([NH2+][C@H](C)[C@@H]1CCC[NH2+]C1)[C@H]1C[C@H]1C ZINC000423215940 387997603 /nfs/dbraw/zinc/99/76/03/387997603.db2.gz NUWIJEVQRSGBFO-POQQGIQPSA-N 2 0 224.392 2.399 20 0 BEADRP CCO[C@H]1C[C@H]([NH2+][C@@H]2CCCC[C@H]2[NH3+])C1(C)C ZINC000424372126 387997803 /nfs/dbraw/zinc/99/78/03/387997803.db2.gz HCEWVMIPPHOBAK-NDBYEHHHSA-N 2 0 240.391 2.050 20 0 BEADRP CC[C@H]([NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1)C1CC1 ZINC000423215283 387998426 /nfs/dbraw/zinc/99/84/26/387998426.db2.gz MVYLCEYVQKNHOP-UHTWSYAYSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H]1C[C@]1(F)c1ccccc1 ZINC000424375322 387999842 /nfs/dbraw/zinc/99/98/42/387999842.db2.gz MUJJTVOLNUKRQD-BNOWGMLFSA-N 2 0 236.334 2.341 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1C[C@H]1C1CCC1 ZINC000424382235 388001316 /nfs/dbraw/zinc/00/13/16/388001316.db2.gz RXIWRTXCSBYYOH-XUXIUFHCSA-N 2 0 222.376 2.140 20 0 BEADRP CC(C)C1CC([NH2+]C[C@H]2CCC[NH2+]C2)C1 ZINC000423221228 388002123 /nfs/dbraw/zinc/00/21/23/388002123.db2.gz ZKLNMWFNKNYWAD-HIFPTAJRSA-N 2 0 210.365 2.010 20 0 BEADRP CC(C)[C@@H]([NH2+]CC[C@H](C)[NH3+])c1cccnc1 ZINC000423222492 388004167 /nfs/dbraw/zinc/00/41/67/388004167.db2.gz BHEOVMOSZXZSTM-WCQYABFASA-N 2 0 221.348 2.106 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H]1CCC[C@@H](c2cccnc2)C1 ZINC000423222633 388004767 /nfs/dbraw/zinc/00/47/67/388004767.db2.gz BXQZYKYFDAJPDR-GZBFAFLISA-N 2 0 247.386 2.435 20 0 BEADRP C[C@@H]([NH2+]CC[C@H](C)[NH3+])c1ccc(F)c(F)c1 ZINC000423224556 388005414 /nfs/dbraw/zinc/00/54/14/388005414.db2.gz CLVGCFVFESTQHY-DTWKUNHWSA-N 2 0 228.286 2.353 20 0 BEADRP Cc1cc([C@@H](C)[NH2+]CC[C@H](C)[NH3+])cs1 ZINC000423224708 388005722 /nfs/dbraw/zinc/00/57/22/388005722.db2.gz JZRKQASIZZVULL-WCBMZHEXSA-N 2 0 212.362 2.444 20 0 BEADRP CCc1cccnc1[C@H](C)[NH2+]CC[C@H](C)[NH3+] ZINC000423223959 388006353 /nfs/dbraw/zinc/00/63/53/388006353.db2.gz IBUOPJRDMAXGCQ-QWRGUYRKSA-N 2 0 221.348 2.032 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H]1CCCc2c(O)cccc21 ZINC000423225194 388007179 /nfs/dbraw/zinc/00/71/79/388007179.db2.gz LRHDLCCCJDWLJW-GXFFZTMASA-N 2 0 234.343 2.097 20 0 BEADRP Cc1nc2c(s1)[C@@H]([NH2+]CC[C@H](C)[NH3+])CCC2 ZINC000423225656 388007826 /nfs/dbraw/zinc/00/78/26/388007826.db2.gz NRATZRUEGKOQLM-WPRPVWTQSA-N 2 0 239.388 2.156 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[NH2+]C1)[C@H]1CCCC[C@H]1C ZINC000423163899 387996584 /nfs/dbraw/zinc/99/65/84/387996584.db2.gz WCBMGJYZCRCOOK-VOAKCMCISA-N 2 0 210.365 2.153 20 0 BEADRP Cc1nc([C@H](C)[NH2+]CC[C@H]2CC[NH2+]C2)cs1 ZINC000423240722 388023936 /nfs/dbraw/zinc/02/39/36/388023936.db2.gz CRDWUFCCAZXSQE-GXSJLCMTSA-N 2 0 239.388 2.102 20 0 BEADRP COc1ccc([C@@H](C)[NH2+]CC[C@@H]2CC[NH2+]C2)cc1 ZINC000423240573 388024643 /nfs/dbraw/zinc/02/46/43/388024643.db2.gz CJOVUSZHBXRQHQ-OLZOCXBDSA-N 2 0 248.370 2.345 20 0 BEADRP c1cc2c(o1)CCC[C@H]2[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000423241112 388025013 /nfs/dbraw/zinc/02/50/13/388025013.db2.gz DBBSIJVMQSGEJB-WCQYABFASA-N 2 0 234.343 2.246 20 0 BEADRP CCC[C@@H]([NH2+]CCOCC[NH+](C)C)C(C)(C)C ZINC000453211969 388011855 /nfs/dbraw/zinc/01/18/55/388011855.db2.gz FXYATLSMSFXOCL-CYBMUJFWSA-N 2 0 244.423 2.369 20 0 BEADRP CNCC[NH2+][C@H]1CC[C@@H](c2ccccc2)C1 ZINC000423235443 388019552 /nfs/dbraw/zinc/01/95/52/388019552.db2.gz AZHRNDYUHOCEAL-KGLIPLIRSA-N 2 0 218.344 2.132 20 0 BEADRP CCOc1ccccc1[C@@H](C)[NH2+]CC[C@H](C)[NH3+] ZINC000423235753 388020230 /nfs/dbraw/zinc/02/02/30/388020230.db2.gz RLRXEKVPYUZGHF-NWDGAFQWSA-N 2 0 236.359 2.473 20 0 BEADRP COc1ccccc1[C@H](C)[NH2+]CC[C@H](C)[NH3+] ZINC000423238022 388022486 /nfs/dbraw/zinc/02/24/86/388022486.db2.gz UUWXDOBPTYBOGL-QWRGUYRKSA-N 2 0 222.332 2.083 20 0 BEADRP C[C@@H]1CCC[C@H](C)[C@H]1[NH2+]C[C@H]1CCC[NH2+]1 ZINC000423239579 388022587 /nfs/dbraw/zinc/02/25/87/388022587.db2.gz SHILLKFPUJWPMD-XQHKEYJVSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@@H]([NH2+]CC[C@H]1CC[NH2+]C1)C1CCC1 ZINC000423254353 388035088 /nfs/dbraw/zinc/03/50/88/388035088.db2.gz XTAYSXIFAJEFCZ-DGCLKSJQSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1ccccc1F ZINC000423253799 388035533 /nfs/dbraw/zinc/03/55/33/388035533.db2.gz WIGWCJZQKSHGGK-VXGBXAGGSA-N 2 0 236.334 2.476 20 0 BEADRP Cc1cccc(NCC[C@@H]2CCC[NH2+]C2)[nH+]1 ZINC000082486984 388035988 /nfs/dbraw/zinc/03/59/88/388035988.db2.gz UBAIRUPRWHRVMV-LBPRGKRZSA-N 2 0 219.332 2.192 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCC[NH2+]C1)C1(C)CC1 ZINC000423255537 388037580 /nfs/dbraw/zinc/03/75/80/388037580.db2.gz CCVVBXIWMLJLIY-NWDGAFQWSA-N 2 0 210.365 2.154 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@H]1c2ccccc2C[C@@H]1C ZINC000423264525 388041992 /nfs/dbraw/zinc/04/19/92/388041992.db2.gz CDXDHYJCRURPRR-NILFDRSVSA-N 2 0 232.371 2.493 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H]1CCC12CCCC2 ZINC000423266130 388043404 /nfs/dbraw/zinc/04/34/04/388043404.db2.gz CWQPXDZAIASFHS-RYUDHWBXSA-N 2 0 210.365 2.154 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000423243540 388026858 /nfs/dbraw/zinc/02/68/58/388026858.db2.gz GLWJSLUVFVYBBL-QWHCGFSZSA-N 2 0 233.359 2.040 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CC[NH2+]C1)[C@H]1CC1(C)C ZINC000423248041 388029574 /nfs/dbraw/zinc/02/95/74/388029574.db2.gz MGHKQHOSXMAFHK-QJPTWQEYSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]1CC(C)(C)C[C@H]1[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000423249247 388031661 /nfs/dbraw/zinc/03/16/61/388031661.db2.gz OHYKXSQAHZOSHR-FRRDWIJNSA-N 2 0 224.392 2.400 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H](C)c1ccsc1 ZINC000423273925 388053329 /nfs/dbraw/zinc/05/33/29/388053329.db2.gz LMIBAPPWPBQCBS-ZJUUUORDSA-N 2 0 212.362 2.254 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]CC[NH2+]C1CCCCCC1 ZINC000423275011 388055225 /nfs/dbraw/zinc/05/52/25/388055225.db2.gz LGZBCVLHZLXMGE-ZDUSSCGKSA-N 3 0 241.423 2.016 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H](C)c1ccc(F)c(F)c1 ZINC000423277610 388058990 /nfs/dbraw/zinc/05/89/90/388058990.db2.gz QCMZHGZEQSYTOW-NXEZZACHSA-N 2 0 242.313 2.471 20 0 BEADRP CC[C@H]([NH2+]C[C@H](C)C[NH2+]C)C(C)(C)C ZINC000423278205 388060026 /nfs/dbraw/zinc/06/00/26/388060026.db2.gz QUIOKXFBJHGOFH-MNOVXSKESA-N 2 0 200.370 2.256 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H](C)CCCc1cccnc1 ZINC000423278532 388060138 /nfs/dbraw/zinc/06/01/38/388060138.db2.gz RHZYNFGVWCYULC-UONOGXRCSA-N 2 0 249.402 2.238 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H](C)CCCc1cccnc1 ZINC000423278533 388060317 /nfs/dbraw/zinc/06/03/17/388060317.db2.gz RHZYNFGVWCYULC-ZIAGYGMSSA-N 2 0 249.402 2.238 20 0 BEADRP CCC[C@@H]1CCC[C@H]1[NH2+]C[C@H](C)C[NH2+]C ZINC000423279093 388060326 /nfs/dbraw/zinc/06/03/26/388060326.db2.gz RXNRSHAJPXJUJX-JHJVBQTASA-N 2 0 212.381 2.400 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+]C1CCC(C(F)F)CC1 ZINC000423279521 388060465 /nfs/dbraw/zinc/06/04/65/388060465.db2.gz SEVBTFLWNNCSHE-ILDUYXDCSA-N 2 0 234.334 2.383 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000423278796 388060657 /nfs/dbraw/zinc/06/06/57/388060657.db2.gz ROROXPYLLZZZQA-OLZOCXBDSA-N 2 0 236.359 2.190 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H](C)c1cccc(OC)c1 ZINC000423279683 388061505 /nfs/dbraw/zinc/06/15/05/388061505.db2.gz SSKKMPMYBJRUSI-RYUDHWBXSA-N 2 0 236.359 2.201 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)[C@@H]1CC1(C)C ZINC000423280043 388062148 /nfs/dbraw/zinc/06/21/48/388062148.db2.gz UEKPTWDEHQGJEX-AVGNSLFASA-N 2 0 224.392 2.400 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H]1CCCC(C)(C)C1 ZINC000423280281 388062411 /nfs/dbraw/zinc/06/24/11/388062411.db2.gz UISHVJHHUHJQTF-RYUDHWBXSA-N 2 0 212.381 2.400 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CCC[C@H]1CCCF ZINC000423281019 388063349 /nfs/dbraw/zinc/06/33/49/388063349.db2.gz VHUIDXIUOZLWBV-RWMBFGLXSA-N 2 0 230.371 2.350 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+][C@@H]1CCC12CCCC2 ZINC000423281149 388063401 /nfs/dbraw/zinc/06/34/01/388063401.db2.gz UZDOQVGEMVPQSY-NWDGAFQWSA-N 2 0 210.365 2.282 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CCC[C@@H]1CCCF ZINC000423281021 388063768 /nfs/dbraw/zinc/06/37/68/388063768.db2.gz VHUIDXIUOZLWBV-YNEHKIRRSA-N 2 0 230.371 2.350 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCCC[N@H+](C)C2CC2)[C@@H](C)O1 ZINC000453389448 388067317 /nfs/dbraw/zinc/06/73/17/388067317.db2.gz CKGXFVVMLJCCNM-YRGRVCCFSA-N 2 0 240.391 2.016 20 0 BEADRP C(C[C@H]1CCC[NH2+]C1)[NH2+][C@H]1CCC12CCC2 ZINC000423285071 388069866 /nfs/dbraw/zinc/06/98/66/388069866.db2.gz ZGDLNYKPMUHUCZ-OLZOCXBDSA-N 2 0 222.376 2.298 20 0 BEADRP CCO[C@H]1C[C@@H]([NH2+]CC(C)(C)[NH3+])C1(CC)CC ZINC000423286905 388070727 /nfs/dbraw/zinc/07/07/27/388070727.db2.gz JJFWQRNYHGVTQN-NEPJUHHUSA-N 2 0 242.407 2.297 20 0 BEADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@H]2C[C@@H](C)O[C@@H]2C)cc1 ZINC000423289896 388074201 /nfs/dbraw/zinc/07/42/01/388074201.db2.gz BXUABONHVNKOKS-ZAZJYDDPSA-N 2 0 248.370 2.362 20 0 BEADRP C[C@H]([NH2+]CCCC[N@H+](C)C1CC1)[C@H]1CCCO1 ZINC000453404808 388074954 /nfs/dbraw/zinc/07/49/54/388074954.db2.gz PYVSDSJOSBWNOL-GXTWGEPZSA-N 2 0 240.391 2.018 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CCC[C@@H]2C[NH3+])cc1 ZINC000084217905 388075108 /nfs/dbraw/zinc/07/51/08/388075108.db2.gz SZHJUTMGBIUKFH-KGLIPLIRSA-N 2 0 218.344 2.212 20 0 BEADRP Cc1cccc(C[NH2+][C@H]2CCC[C@H]2C[NH3+])c1 ZINC000084218113 388075430 /nfs/dbraw/zinc/07/54/30/388075430.db2.gz AVZBYRCZTWTJEO-KBPBESRZSA-N 2 0 218.344 2.212 20 0 BEADRP CCC([NH3+])(CC)C[NH2+][C@H]1CCC[C@@H]1CCOC ZINC000423292281 388076417 /nfs/dbraw/zinc/07/64/17/388076417.db2.gz MILDJLDMRDCUPT-OLZOCXBDSA-N 2 0 242.407 2.299 20 0 BEADRP COC[C@@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)C1CC1 ZINC000423293659 388076513 /nfs/dbraw/zinc/07/65/13/388076513.db2.gz RVAWMFKTZOYTER-XHDPSFHLSA-N 2 0 248.370 2.221 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@@H](C)c1cc(F)c(F)c(F)c1 ZINC000423295205 388077188 /nfs/dbraw/zinc/07/71/88/388077188.db2.gz DPCYLEPVHNKSKG-YUMQZZPRSA-N 2 0 246.276 2.349 20 0 BEADRP CCC([NH3+])(CC)C[NH2+]C1CCC(COC)CC1 ZINC000423295323 388077228 /nfs/dbraw/zinc/07/72/28/388077228.db2.gz WMSPSAHXHYAEBK-UHFFFAOYSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@@H](C)c1ccc2ccccc2n1 ZINC000423294648 388077254 /nfs/dbraw/zinc/07/72/54/388077254.db2.gz CMXLWPJKSFMCJI-RYUDHWBXSA-N 2 0 243.354 2.480 20 0 BEADRP C(C[N@@H+]1CCC[C@H]2CCC[C@H]21)[C@@H]1CC[NH2+]C1 ZINC000084386227 388078163 /nfs/dbraw/zinc/07/81/63/388078163.db2.gz OAUDKEJYPNAFMB-BFHYXJOUSA-N 2 0 222.376 2.251 20 0 BEADRP Cc1ccc2c(c1)OCCC[C@@H]2[NH2+]C[C@@H](C)C[NH3+] ZINC000423298388 388079441 /nfs/dbraw/zinc/07/94/41/388079441.db2.gz OGAFVDWBLDBRED-JSGCOSHPSA-N 2 0 248.370 2.393 20 0 BEADRP CC(C)[C@H]([NH2+][C@@H]1CCC[C@H]([NH3+])C1)C1CC1 ZINC000324224232 388115198 /nfs/dbraw/zinc/11/51/98/388115198.db2.gz FXFZDSNPFXYDOE-XQQFMLRXSA-N 2 0 210.365 2.281 20 0 BEADRP C[N@H+](CCCC[NH2+]CC(C)(C)C)C1CC1 ZINC000453597541 388089828 /nfs/dbraw/zinc/08/98/28/388089828.db2.gz OBBDYHYEVDYSOP-UHFFFAOYSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H]1C[NH2+][C@@H](C)CN1c1cc[nH+]c2ccccc21 ZINC000086471346 388103808 /nfs/dbraw/zinc/10/38/08/388103808.db2.gz MRUCMEQMCGIMFM-NWDGAFQWSA-N 2 0 241.338 2.421 20 0 BEADRP C[C@H](c1cccnc1)[N@H+](C)CC(C)(C)C[NH3+] ZINC000086637102 388105684 /nfs/dbraw/zinc/10/56/84/388105684.db2.gz JMHKZQPHZVUAER-LLVKDONJSA-N 2 0 221.348 2.059 20 0 BEADRP C[C@H](CCN[C@H]1CC[NH2+]C1)c1ccccc1 ZINC000086729955 388107523 /nfs/dbraw/zinc/10/75/23/388107523.db2.gz BCXJVEYGINOXNH-OCCSQVGLSA-N 2 0 218.344 2.132 20 0 BEADRP CCCCC[NH+]1CCC(OCCC[NH3+])CC1 ZINC000086723459 388107933 /nfs/dbraw/zinc/10/79/33/388107933.db2.gz HUPWIYNADDOHNP-UHFFFAOYSA-N 2 0 228.380 2.006 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@@H]2CS[C@@H](C)C2)CC1 ZINC000086934587 388110711 /nfs/dbraw/zinc/11/07/11/388110711.db2.gz FHDANSFJEHFFIG-AAEUAGOBSA-N 2 0 242.432 2.343 20 0 BEADRP c1ccc(C[N@H+]2CC[C@H]3C[NH2+]C[C@H]3CC2)cc1 ZINC000083072561 388044819 /nfs/dbraw/zinc/04/48/19/388044819.db2.gz UWPJLDHMLQLZTA-GASCZTMLSA-N 2 0 230.355 2.118 20 0 BEADRP Cc1ccncc1C[NH2+]C1CCC([NH+](C)C)CC1 ZINC000453319853 388045003 /nfs/dbraw/zinc/04/50/03/388045003.db2.gz DUHCHIFFBVEQRA-UHFFFAOYSA-N 2 0 247.386 2.352 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]C1CCC2(CC2)CC1 ZINC000423268778 388047108 /nfs/dbraw/zinc/04/71/08/388047108.db2.gz GKUHXQLXJHQKQB-LLVKDONJSA-N 2 0 210.365 2.154 20 0 BEADRP CC/C=C\C[NH2+][C@@H]1CC[N@H+](C)[C@@H]2CCC[C@H]21 ZINC000453332242 388049082 /nfs/dbraw/zinc/04/90/82/388049082.db2.gz VTNFZKLMTDQAFK-TXTSOVJRSA-N 2 0 222.376 2.415 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H](C2CC2)C2CCC2)C1 ZINC000324824575 388124797 /nfs/dbraw/zinc/12/47/97/388124797.db2.gz SZEVDBNOFIJYAI-HZSPNIEDSA-N 2 0 222.376 2.425 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@H](C2CC2)C2CCC2)C1 ZINC000324824576 388125049 /nfs/dbraw/zinc/12/50/49/388125049.db2.gz SZEVDBNOFIJYAI-MCIONIFRSA-N 2 0 222.376 2.425 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+]CCc2cccc(C)c2)C1 ZINC000449089290 388140978 /nfs/dbraw/zinc/14/09/78/388140978.db2.gz JSYONNPVYLXHHP-MRXNPFEDSA-N 2 0 246.398 2.469 20 0 BEADRP CC[NH+]1C[C@@H]2C[NH+](Cc3ccccc3)C[C@H]2C1 ZINC000409439191 256601620 /nfs/dbraw/zinc/60/16/20/256601620.db2.gz QEWCPQVDZXGIBS-HUUCEWRRSA-N 2 0 230.355 2.070 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H]1C[C@H](OC)C1(C)C ZINC000451491153 388277514 /nfs/dbraw/zinc/27/75/14/388277514.db2.gz ILQPVIXFVSZTAH-OLZOCXBDSA-N 2 0 242.407 2.121 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+]C2CC(C(C)C)C2)C1 ZINC000233515535 388347661 /nfs/dbraw/zinc/34/76/61/388347661.db2.gz SRMMEEFEZKWIJU-IYXRBSQSSA-N 2 0 224.392 2.352 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+]CC(C(C)C)C(C)C ZINC000234778353 388360290 /nfs/dbraw/zinc/36/02/90/388360290.db2.gz LNCGOGOUYODECR-ZDUSSCGKSA-N 2 0 244.423 2.258 20 0 BEADRP C[C@@H](C[NH3+])N[C@@H](C)c1ccccc1Cl ZINC000235145868 388364993 /nfs/dbraw/zinc/36/49/93/388364993.db2.gz OMQLTOPIIIIVIW-IUCAKERBSA-N 2 0 212.724 2.338 20 0 BEADRP C[C@@H](C[NH3+])N[C@@H](C)c1cc2ccccc2o1 ZINC000235146460 388365260 /nfs/dbraw/zinc/36/52/60/388365260.db2.gz GQICDCXOSFCUDQ-UWVGGRQHSA-N 2 0 218.300 2.431 20 0 BEADRP Cc1sccc1C[NH2+]C[C@H]1CCCN1C ZINC000293460242 388389981 /nfs/dbraw/zinc/38/99/81/388389981.db2.gz DCCRFYJLCYZYPK-GFCCVEGCSA-N 2 0 224.373 2.240 20 0 BEADRP CC[NH+]1CCC([NH2+]CCOC(C)(C)CC)CC1 ZINC000308552490 388442398 /nfs/dbraw/zinc/44/23/98/388442398.db2.gz ZXLRGZWXHOJMPL-UHFFFAOYSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)C1(C)CC1 ZINC000322716441 388444613 /nfs/dbraw/zinc/44/46/13/388444613.db2.gz PTXLPQXXCZJNDE-ODWCKFRGSA-N 2 0 222.376 2.390 20 0 BEADRP COCC[C@H](C)[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C ZINC000176078628 388449991 /nfs/dbraw/zinc/44/99/91/388449991.db2.gz WXLBYJNPRLYMDV-STQMWFEESA-N 2 0 244.423 2.367 20 0 BEADRP Cc1cccnc1CC[NH2+][C@H]1CCCC[C@H]1C[NH3+] ZINC000405034075 388450321 /nfs/dbraw/zinc/45/03/21/388450321.db2.gz QHEGYZKHVJBSRS-ZFWWWQNUSA-N 2 0 247.386 2.040 20 0 BEADRP COCC[C@H](C)[NH2+][C@H](CC[NH+](C)C)C(C)(C)C ZINC000176078657 388450363 /nfs/dbraw/zinc/45/03/63/388450363.db2.gz WXLBYJNPRLYMDV-QWHCGFSZSA-N 2 0 244.423 2.367 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CCc1cccs1 ZINC000336659931 388460124 /nfs/dbraw/zinc/46/01/24/388460124.db2.gz BRBSCLIFWXHNTK-LLVKDONJSA-N 2 0 226.389 2.398 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCN(C)[C@H](C)C2)[C@@H]1C ZINC000336702975 388464980 /nfs/dbraw/zinc/46/49/80/388464980.db2.gz QEGHCHDQGXSKQL-VEGXAWMVSA-N 2 0 210.365 2.103 20 0 BEADRP CCC[C@H](C)C[N@@H+]1C[C@@H]2CC[C@H]([NH3+])[C@H]2C1 ZINC000336712247 388466716 /nfs/dbraw/zinc/46/67/16/388466716.db2.gz UXNXDUWPIJSGEL-CYDGBPFRSA-N 2 0 210.365 2.092 20 0 BEADRP CCO[C@@H]1C[C@@H]([NH2+][C@@H](C)CCCC[NH3+])C1(C)C ZINC000336731445 388471046 /nfs/dbraw/zinc/47/10/46/388471046.db2.gz YVKANEPVOAWDRV-YNEHKIRRSA-N 2 0 242.407 2.297 20 0 BEADRP CCc1cc(NCC[N@H+]2CC=CCC2)cc[nH+]1 ZINC000307772025 388425712 /nfs/dbraw/zinc/42/57/12/388425712.db2.gz ONNSNUBNWMTJAO-UHFFFAOYSA-N 2 0 231.343 2.318 20 0 BEADRP CCc1cc(NCC[NH+](CC)CC)cc[nH+]1 ZINC000307817313 388427272 /nfs/dbraw/zinc/42/72/72/388427272.db2.gz NESBBHNZRRZAON-UHFFFAOYSA-N 2 0 221.348 2.398 20 0 BEADRP CC[C@H]([NH2+]C[C@H]1CC[N@H+](CC)C1)C1CCC1 ZINC000322367551 388432181 /nfs/dbraw/zinc/43/21/81/388432181.db2.gz ILUDRGCICOCQMY-OCCSQVGLSA-N 2 0 224.392 2.497 20 0 BEADRP CCC[C@H](C[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)OC ZINC000356333472 388548280 /nfs/dbraw/zinc/54/82/80/388548280.db2.gz KYNXDFPWMLXFCU-HZSPNIEDSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@H](CCO)CC[NH2+][C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000397616103 388484610 /nfs/dbraw/zinc/48/46/10/388484610.db2.gz FFVFISZJZVLREW-CQDKDKBSSA-N 2 0 248.370 2.129 20 0 BEADRP C(C1CCCCC1)[N@H+]1CC[C@H]2C[NH2+]C[C@H]2CC1 ZINC000310536007 388484742 /nfs/dbraw/zinc/48/47/42/388484742.db2.gz ATUJENBPZOFEDW-GASCZTMLSA-N 2 0 236.403 2.498 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H](C)[C@H]1CCCCO1 ZINC000356693289 388550791 /nfs/dbraw/zinc/55/07/91/388550791.db2.gz IZDVAKCMCNAZGN-FRRDWIJNSA-N 2 0 228.380 2.051 20 0 BEADRP CCCC(CCC)[NH2+]CC1(O)CC[NH+](C)CC1 ZINC000341268598 388495160 /nfs/dbraw/zinc/49/51/60/388495160.db2.gz GIDMAVRWOLMUDD-UHFFFAOYSA-N 2 0 242.407 2.002 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[NH2+]C1)[C@@H]1CC1(C)C ZINC000397789627 388499610 /nfs/dbraw/zinc/49/96/10/388499610.db2.gz KSYJMSKCIOUJTN-SRVKXCTJSA-N 2 0 210.365 2.010 20 0 BEADRP CCc1cc(N[C@H](CC)C[NH+]2CCCC2)cc[nH+]1 ZINC000649279237 388507672 /nfs/dbraw/zinc/50/76/72/388507672.db2.gz ZXYMXBPYTSWHSU-CQSZACIVSA-N 2 0 247.386 2.352 20 0 BEADRP CC(C)=CCC[NH2+][C@H]1CCCC[C@@H]1C[NH3+] ZINC000397883432 388508258 /nfs/dbraw/zinc/50/82/58/388508258.db2.gz PAENZUPQOJKEAF-OLZOCXBDSA-N 2 0 210.365 2.450 20 0 BEADRP Cc1csc(C[NH2+][C@@H]2CCC[C@@H]2C[NH3+])c1 ZINC000344647032 388508725 /nfs/dbraw/zinc/50/87/25/388508725.db2.gz WRUFZZUWJUCIIE-ZYHUDNBSSA-N 2 0 224.373 2.274 20 0 BEADRP CC(C)=CCC[NH2+][C@@H]1CCCC[C@H]1C[NH3+] ZINC000397883434 388509025 /nfs/dbraw/zinc/50/90/25/388509025.db2.gz PAENZUPQOJKEAF-QWHCGFSZSA-N 2 0 210.365 2.450 20 0 BEADRP Cc1cccc(C[NH2+]CC2(N(C)C)CC2)c1C ZINC000398000431 388514941 /nfs/dbraw/zinc/51/49/41/388514941.db2.gz SMCHBQUGIMFFOQ-UHFFFAOYSA-N 2 0 232.371 2.487 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[N@@H+]1C[C@@H]2CC[C@H]([NH3+])[C@@H]2C1 ZINC000346842703 388521247 /nfs/dbraw/zinc/52/12/47/388521247.db2.gz IKDRWOKRBYQDHF-QMIVOQANSA-N 2 0 236.403 2.482 20 0 BEADRP CC[C@@H]1CCC[C@@H](C[N@@H+]2CC[C@H](C[NH3+])C2)C1 ZINC000347093880 388521823 /nfs/dbraw/zinc/52/18/23/388521823.db2.gz GUQGYRUDRCRMGF-MGPQQGTHSA-N 2 0 224.392 2.483 20 0 BEADRP C[C@@H]1CC[C@@H](C)[C@H]([NH2+]CC2CC[NH2+]CC2)C1 ZINC000517122869 256815659 /nfs/dbraw/zinc/81/56/59/256815659.db2.gz LRJSFFWXMPJOEA-YRGRVCCFSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1CCC[C@@H](C[N@@H+]2C[C@@H]3CCC[NH2+][C@@H]3C2)C1 ZINC000220396841 388604380 /nfs/dbraw/zinc/60/43/80/388604380.db2.gz GXQFRDSJRVWWGQ-APIJFGDWSA-N 2 0 236.403 2.497 20 0 BEADRP CC[C@H](O)C[NH2+]CCCC[N@@H+]1CCCC[C@H]1C ZINC000521029777 388559372 /nfs/dbraw/zinc/55/93/72/388559372.db2.gz QXRZLJLVOVPQAK-KGLIPLIRSA-N 2 0 242.407 2.002 20 0 BEADRP CCSCC[N@H+](C)[C@@H]1CC[NH+](CC)C[C@@H]1C ZINC000245445641 388580663 /nfs/dbraw/zinc/58/06/63/388580663.db2.gz ZBRAWCMEJDBGLS-QWHCGFSZSA-N 2 0 244.448 2.402 20 0 BEADRP CC[C@H]1CC[N@H+](CCC[NH+](CC)CC)C1 ZINC000191806958 388670496 /nfs/dbraw/zinc/67/04/96/388670496.db2.gz DEMSMHYOZLQUGP-ZDUSSCGKSA-N 2 0 212.381 2.450 20 0 BEADRP CC[NH+](CC)CCC[N@H+](CC)C(C)C ZINC000191777246 388671017 /nfs/dbraw/zinc/67/10/17/388671017.db2.gz ORYDVBGCCXAVHJ-UHFFFAOYSA-N 2 0 200.370 2.449 20 0 BEADRP CC[C@@H](C)[NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1 ZINC000125895789 388681118 /nfs/dbraw/zinc/68/11/18/388681118.db2.gz ZCIVWZNNYHPMRO-CHWSQXEVSA-N 2 0 212.381 2.495 20 0 BEADRP CC[C@H](C)[NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1 ZINC000125896027 388681406 /nfs/dbraw/zinc/68/14/06/388681406.db2.gz ZCIVWZNNYHPMRO-QWHCGFSZSA-N 2 0 212.381 2.495 20 0 BEADRP CCCC[C@@H](C)[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000530176693 388621118 /nfs/dbraw/zinc/62/11/18/388621118.db2.gz JWALNLYBTVJDKM-VXGBXAGGSA-N 2 0 210.365 2.439 20 0 BEADRP C[C@@H]1CCCC[C@H]1[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000530179168 388621677 /nfs/dbraw/zinc/62/16/77/388621677.db2.gz UVYVXXPSBXXJJZ-JHJVBQTASA-N 2 0 222.376 2.439 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[NH2+]C23CCC3)C1 ZINC000530179676 388622385 /nfs/dbraw/zinc/62/23/85/388622385.db2.gz ZUJMZHFLQZCKPP-FRRDWIJNSA-N 2 0 222.376 2.439 20 0 BEADRP CC(C)C[C@H](C)[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000530179356 388623254 /nfs/dbraw/zinc/62/32/54/388623254.db2.gz XEDUQMXZMKZMSE-RYUDHWBXSA-N 2 0 210.365 2.295 20 0 BEADRP C[NH2+]C[C@H]1CCC[N@H+](CC2CC(C)(C)C2)C1 ZINC000530209321 388627396 /nfs/dbraw/zinc/62/73/96/388627396.db2.gz IWZWHMZYLBSAPM-GFCCVEGCSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CCCC1(C)C)C1C[NH2+]C1 ZINC000530210030 388627613 /nfs/dbraw/zinc/62/76/13/388627613.db2.gz KIJLVLLOFDPYBS-YPMHNXCESA-N 2 0 224.392 2.400 20 0 BEADRP CCC[C@H](C[NH2+][C@H]1CC[NH2+]CC[C@@H]1C)OCC ZINC000530212614 388628225 /nfs/dbraw/zinc/62/82/25/388628225.db2.gz RDBPGNMVAGONMS-MJBXVCDLSA-N 2 0 242.407 2.169 20 0 BEADRP CCC[C@H](C[NH2+][C@@H]1CCC[C@@H]([NH3+])C1)OCC ZINC000530214337 388629170 /nfs/dbraw/zinc/62/91/70/388629170.db2.gz XXNLDLBVCMBSHV-JHJVBQTASA-N 2 0 228.380 2.051 20 0 BEADRP COCCC1CC[NH+]([C@@H](C)CCCC[NH3+])CC1 ZINC000530213738 388629307 /nfs/dbraw/zinc/62/93/07/388629307.db2.gz VYVUFQVEGWJTLJ-ZDUSSCGKSA-N 2 0 242.407 2.252 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CC=CCC1)[C@H]1CCC[NH2+]1 ZINC000530217554 388630114 /nfs/dbraw/zinc/63/01/14/388630114.db2.gz HXBMABMNCBNPFG-MGPQQGTHSA-N 2 0 222.376 2.463 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CC=CCC1)[C@H]1CCC[NH2+]1 ZINC000530217549 388630121 /nfs/dbraw/zinc/63/01/21/388630121.db2.gz HXBMABMNCBNPFG-BFHYXJOUSA-N 2 0 222.376 2.463 20 0 BEADRP C1CC([C@@H]2CC[C@H]2[NH2+][C@@H]2CC[NH2+]C23CCC3)C1 ZINC000530217700 388630137 /nfs/dbraw/zinc/63/01/37/388630137.db2.gz VRYOIYBVXHVECZ-BFHYXJOUSA-N 2 0 234.387 2.439 20 0 BEADRP CC1(C)CC(C[NH+]2CCC(C)([NH3+])CC2)C1 ZINC000530222358 388632846 /nfs/dbraw/zinc/63/28/46/388632846.db2.gz ZPUCGTKQQPFNBW-UHFFFAOYSA-N 2 0 210.365 2.236 20 0 BEADRP CC1(C)CC(C[N@@H+]2CCC[C@@]3(CC[NH2+]C3)C2)C1 ZINC000530223920 388634444 /nfs/dbraw/zinc/63/44/44/388634444.db2.gz IXZSQOAVQVNLET-HNNXBMFYSA-N 2 0 236.403 2.498 20 0 BEADRP CC1(C)CC(C[NH2+][C@@H]2CC[NH2+]CC2(C)C)C1 ZINC000530225814 388635622 /nfs/dbraw/zinc/63/56/22/388635622.db2.gz NTONHGNNKRROPY-GFCCVEGCSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1CC(F)(F)CC[N@@H+]1CC[C@H]1CCC[NH2+]C1 ZINC000530233561 388636261 /nfs/dbraw/zinc/63/62/61/388636261.db2.gz WYORXZBTEBOTBF-VXGBXAGGSA-N 2 0 246.345 2.496 20 0 BEADRP C[C@H]1CC(F)(F)CC[N@@H+]1CCC1CC[NH2+]CC1 ZINC000530233601 388636680 /nfs/dbraw/zinc/63/66/80/388636680.db2.gz YKGQSHXOEXZHOT-NSHDSACASA-N 2 0 246.345 2.496 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC[NH2+]C12CCC2)C1CCC1 ZINC000530244975 388639221 /nfs/dbraw/zinc/63/92/21/388639221.db2.gz RLHLYPLSHTUOKB-ZYHUDNBSSA-N 2 0 208.349 2.049 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]C[C@H]2CCCS2)[C@@H](C)C1 ZINC000246838245 388653087 /nfs/dbraw/zinc/65/30/87/388653087.db2.gz BLRTYROITLZHRK-XQQFMLRXSA-N 2 0 242.432 2.202 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CCCCSC)[C@@H](C)C1 ZINC000223738264 388657882 /nfs/dbraw/zinc/65/78/82/388657882.db2.gz YGWJQASXJPGHBT-STQMWFEESA-N 2 0 244.448 2.450 20 0 BEADRP CCCCOCCC[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000128011726 388736383 /nfs/dbraw/zinc/73/63/83/388736383.db2.gz WCAQOSVYICPHND-ZIAGYGMSSA-N 2 0 242.407 2.266 20 0 BEADRP c1ccc(CC[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)cc1 ZINC000248755677 388693494 /nfs/dbraw/zinc/69/34/94/388693494.db2.gz IONPZCPSSSCTFZ-CVEARBPZSA-N 2 0 244.382 2.446 20 0 BEADRP C[C@H](C[NH2+]Cc1ccccc1)Cn1ccnc1 ZINC000195251158 388702512 /nfs/dbraw/zinc/70/25/12/388702512.db2.gz UVZQXDIHWDRSHS-CYBMUJFWSA-N 2 0 229.327 2.309 20 0 BEADRP C[C@H]([N@H+](C)C[C@@H]1CCC[NH2+]C1)C1(C)CC1 ZINC000226439206 388719853 /nfs/dbraw/zinc/71/98/53/388719853.db2.gz CURNQZUKQFPNCM-NWDGAFQWSA-N 2 0 210.365 2.106 20 0 BEADRP CSCCCC[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000252703048 388772020 /nfs/dbraw/zinc/77/20/20/388772020.db2.gz BVZGTHZHIBGPLJ-OLZOCXBDSA-N 2 0 242.432 2.346 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]C[C@H]1CC=CCC1 ZINC000252711976 388773723 /nfs/dbraw/zinc/77/37/23/388773723.db2.gz LCPZSQVASYECBE-HZSPNIEDSA-N 2 0 222.376 2.273 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]C[C@@H]1CC=CCC1 ZINC000252711977 388773988 /nfs/dbraw/zinc/77/39/88/388773988.db2.gz LCPZSQVASYECBE-MGPQQGTHSA-N 2 0 222.376 2.273 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+][C@H]2CCCC[C@@H]2O)c2ccccc21 ZINC000252771846 388782610 /nfs/dbraw/zinc/78/26/10/388782610.db2.gz IOQNHHSXIVDSAY-QPSCCSFWSA-N 2 0 246.354 2.024 20 0 BEADRP CC[N@@H+]1CCC[C@H](C[NH2+]Cc2ccncc2C)C1 ZINC000556155989 388869726 /nfs/dbraw/zinc/86/97/26/388869726.db2.gz WXAYMNNGGWADEI-CQSZACIVSA-N 2 0 247.386 2.212 20 0 BEADRP C[NH2+]CCC[N@@H+]1CC[C@H](C)[C@H]2CCCC[C@@H]21 ZINC000564989824 388906156 /nfs/dbraw/zinc/90/61/56/388906156.db2.gz IPAUNGXKZNNPLS-MJBXVCDLSA-N 2 0 224.392 2.497 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]CCC2CC(F)(F)C2)C1 ZINC000565226873 388929510 /nfs/dbraw/zinc/92/95/10/388929510.db2.gz OSVUKDXUMKVVAC-GHMZBOCLSA-N 2 0 232.318 2.281 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]CCC2CC(F)(F)C2)C1 ZINC000565226874 388929721 /nfs/dbraw/zinc/92/97/21/388929721.db2.gz OSVUKDXUMKVVAC-MNOVXSKESA-N 2 0 232.318 2.281 20 0 BEADRP c1ccc([C@H]2CCC[N@H+]2C[C@@H]2CCC[NH2+]C2)nc1 ZINC000564975602 388904229 /nfs/dbraw/zinc/90/42/29/388904229.db2.gz LEXJVSDCZHSTDN-UKRRQHHQSA-N 2 0 245.370 2.218 20 0 BEADRP C[C@H]1C[C@@H]([NH3+])CC[N@@H+]1CCCc1ccsc1 ZINC000565665148 388961238 /nfs/dbraw/zinc/96/12/38/388961238.db2.gz FWEXLQPMARMTTE-AAEUAGOBSA-N 2 0 238.400 2.492 20 0 BEADRP C[C@@H]1C[C@@H]([NH3+])CC[N@@H+]1CCCc1ccsc1 ZINC000565665152 388962320 /nfs/dbraw/zinc/96/23/20/388962320.db2.gz FWEXLQPMARMTTE-YPMHNXCESA-N 2 0 238.400 2.492 20 0 BEADRP CCC(C)(C)[C@@H](C)[NH2+]C[C@@]1(COC)CCC[NH2+]1 ZINC000566062623 388984441 /nfs/dbraw/zinc/98/44/41/388984441.db2.gz RZWVZGUKXMPBGG-TZMCWYRMSA-N 2 0 242.407 2.169 20 0 BEADRP C[C@@H]([NH2+]CCCC(F)(F)F)[C@@H]1CCC[NH2+]1 ZINC000400607295 533376018 /nfs/dbraw/zinc/37/60/18/533376018.db2.gz XUVRAHYPFRJQNL-BDAKNGLRSA-N 2 0 224.270 2.059 20 0 BEADRP C[C@@H]([NH2+]CCCC(C)(F)F)[C@@H]1CCC[NH2+]1 ZINC000400323999 533376435 /nfs/dbraw/zinc/37/64/35/533376435.db2.gz BYKMRIRSHDUKTF-ZJUUUORDSA-N 2 0 220.307 2.152 20 0 BEADRP C[C@@H]([NH2+]CCCc1ccccc1)[C@@H]1CCC[NH2+]1 ZINC000400785093 533390154 /nfs/dbraw/zinc/39/01/54/533390154.db2.gz QNKJYQNOFKCVPG-HIFRSBDPSA-N 2 0 232.371 2.349 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCCC[C@H]1C)[C@H]1CCC[NH2+]1 ZINC000400368641 533540920 /nfs/dbraw/zinc/54/09/20/533540920.db2.gz GAMKZSUXASMUTL-FVCCEPFGSA-N 2 0 210.365 2.295 20 0 BEADRP CC[N@@H+]1C[C@@H](C)N(c2cc[nH+]c(C)c2)C[C@@H]1C ZINC000357701761 132274728 /nfs/dbraw/zinc/27/47/28/132274728.db2.gz XNDFOTDPSARFNU-QWHCGFSZSA-N 2 0 233.359 2.309 20 0 BEADRP C[C@@H]1CC[C@H]1[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000334317523 132296141 /nfs/dbraw/zinc/29/61/41/132296141.db2.gz VAOUZCKDNVAKTM-IUODEOHRSA-N 2 0 245.370 2.439 20 0 BEADRP CCCC[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000036960336 132343106 /nfs/dbraw/zinc/34/31/06/132343106.db2.gz MAZYANBTBPQOAU-UHFFFAOYSA-N 2 0 233.359 2.440 20 0 BEADRP c1cc(N2CCC([NH2+]C3CCC3)CC2)cc[nH+]1 ZINC000052207810 132362107 /nfs/dbraw/zinc/36/21/07/132362107.db2.gz ILOSXDKJCWFRGK-UHFFFAOYSA-N 2 0 231.343 2.193 20 0 BEADRP CC(C)(C)CC[N@@H+]1CC[C@@]2(C1)CCC[NH2+]C2 ZINC000336161040 134111206 /nfs/dbraw/zinc/11/12/06/134111206.db2.gz WLWZSFHMBIIMIK-AWEZNQCLSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@H](c1ccccc1F)[N@@H+]1CC[C@@H](C[NH3+])C1 ZINC000219122205 134274696 /nfs/dbraw/zinc/27/46/96/134274696.db2.gz DCZNYNSJWHXWJD-MNOVXSKESA-N 2 0 222.307 2.167 20 0 BEADRP COCCC[C@@H](C)[NH2+]C[C@@H](C)C[NH+]1CCCC1 ZINC000178244192 134305334 /nfs/dbraw/zinc/30/53/34/134305334.db2.gz HISJLBWNRKXGEN-ZIAGYGMSSA-N 2 0 242.407 2.123 20 0 BEADRP Cc1cc(C[NH2+][C@H](C)CC[NH3+])ccc1Cl ZINC000220484732 134305357 /nfs/dbraw/zinc/30/53/57/134305357.db2.gz KGLNXMSATDCRQT-SNVBAGLBSA-N 2 0 226.751 2.475 20 0 BEADRP C[N@H+](CC1CC[NH2+]CC1)C(C1CC1)C1CC1 ZINC000178969428 134314007 /nfs/dbraw/zinc/31/40/07/134314007.db2.gz QZLIYOGJQRQSMH-UHFFFAOYSA-N 2 0 222.376 2.106 20 0 BEADRP C[C@H]1Cc2ccccc2C[N@@H+]1CC1CC[NH2+]CC1 ZINC000178975108 134314331 /nfs/dbraw/zinc/31/43/31/134314331.db2.gz XXLNPWDHQAXGBC-ZDUSSCGKSA-N 2 0 244.382 2.433 20 0 BEADRP CSCC[C@H](C)[N@H+](C)C[C@@]1(C)CC[NH2+]C1 ZINC000222338544 134328828 /nfs/dbraw/zinc/32/88/28/134328828.db2.gz SHEVVPZFANWOON-RYUDHWBXSA-N 2 0 230.421 2.059 20 0 BEADRP C[C@H]([NH2+][C@H]1CCN2CCCC[C@@H]12)C1CCC1 ZINC000222017669 134329059 /nfs/dbraw/zinc/32/90/59/134329059.db2.gz PCFDYXAUDCLCGS-UBHSHLNASA-N 2 0 222.376 2.391 20 0 BEADRP CC[C@H](C)C[N@H+](C)CC[C@@H]([NH3+])C(C)C ZINC000226431057 134365843 /nfs/dbraw/zinc/36/58/43/134365843.db2.gz YEMUEODYKFDVIA-NWDGAFQWSA-N 2 0 200.370 2.338 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000227327047 134378209 /nfs/dbraw/zinc/37/82/09/134378209.db2.gz AGHNBXYNPYNMAK-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1CCC[C@@H]1[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000227327053 134378279 /nfs/dbraw/zinc/37/82/79/134378279.db2.gz AGHNBXYNPYNMAK-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H](C[N@H+](C)CCC[NH3+])c1ccccc1 ZINC000227742045 134392616 /nfs/dbraw/zinc/39/26/16/134392616.db2.gz LBMIKNACGRZQEA-LBPRGKRZSA-N 2 0 206.333 2.071 20 0 BEADRP Cc1cc(N[C@H]2CC[N@H+](C)[C@H](C)C2)cc[nH+]1 ZINC000229570605 134457817 /nfs/dbraw/zinc/45/78/17/134457817.db2.gz QNOOKMGNGHWKDP-YPMHNXCESA-N 2 0 219.332 2.285 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+][C@H]1CCCCC1(C)C ZINC000234700562 134582983 /nfs/dbraw/zinc/58/29/83/134582983.db2.gz AGOPRHCJHJJYRG-STQMWFEESA-N 2 0 242.407 2.299 20 0 BEADRP CCC(CC)C[NH2+][C@@H](C)CC[NH+](C)C ZINC000049551920 134633896 /nfs/dbraw/zinc/63/38/96/134633896.db2.gz RKDOTCRJESLXQW-NSHDSACASA-N 2 0 200.370 2.352 20 0 BEADRP CC[C@H](C)[C@@H](C)[NH2+][C@@H](C)CC[NH+](C)C ZINC000049553672 134634429 /nfs/dbraw/zinc/63/44/29/134634429.db2.gz ZSKOACMGGWVAJB-SDDRHHMPSA-N 2 0 200.370 2.351 20 0 BEADRP [NH3+]CCCC[NH2+][C@@H]1CCc2c1cccc2F ZINC000214684151 134790482 /nfs/dbraw/zinc/79/04/82/134790482.db2.gz ABZQDQPSNAHBOZ-CYBMUJFWSA-N 2 0 222.307 2.142 20 0 BEADRP C[C@H]1C[C@H]1C[NH2+]CCC[NH+]1CCCCC1 ZINC000163630523 135022701 /nfs/dbraw/zinc/02/27/01/135022701.db2.gz YPHVMPSRDRPHIK-STQMWFEESA-N 2 0 210.365 2.108 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H]2CC[C@H](C)C2)C1 ZINC000250330348 135052924 /nfs/dbraw/zinc/05/29/24/135052924.db2.gz OKIIXYJIHKVQRS-XQQFMLRXSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)C1(C)CC1 ZINC000251699888 135074293 /nfs/dbraw/zinc/07/42/93/135074293.db2.gz XFXDIWCKFYAMSY-AVGNSLFASA-N 2 0 222.376 2.391 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)C1CC1 ZINC000251687354 135074758 /nfs/dbraw/zinc/07/47/58/135074758.db2.gz WFDMGXKNUNUYAG-UHTWSYAYSA-N 2 0 208.349 2.001 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]C[C@H]2CCC[NH2+]C2)C1 ZINC000251733692 135075454 /nfs/dbraw/zinc/07/54/54/135075454.db2.gz JACKSXYTNGWUCF-AGIUHOORSA-N 2 0 210.365 2.154 20 0 BEADRP CC[C@H](C)C[N@H+](C)CC[C@H]1CCC[NH2+]C1 ZINC000251774400 135076438 /nfs/dbraw/zinc/07/64/38/135076438.db2.gz IPCIKTZFFFEEJE-QWHCGFSZSA-N 2 0 212.381 2.354 20 0 BEADRP CC[C@H]1CCCC[N@@H+]1CC[C@H]1CC[NH2+]C1 ZINC000251782416 135077508 /nfs/dbraw/zinc/07/75/08/135077508.db2.gz NEBSOIGYISMSQM-OLZOCXBDSA-N 2 0 210.365 2.251 20 0 BEADRP CC[C@@H]1CCCC[N@@H+]1CC[C@H]1CC[NH2+]C1 ZINC000251782414 135077813 /nfs/dbraw/zinc/07/78/13/135077813.db2.gz NEBSOIGYISMSQM-CHWSQXEVSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000252175277 135085332 /nfs/dbraw/zinc/08/53/32/135085332.db2.gz OUXRQVDXXIDWEB-MQYQWHSLSA-N 2 0 222.376 2.391 20 0 BEADRP COC[C@@H]([NH2+]CCN1CCCC[C@H]1C)C(C)C ZINC000246985083 135085745 /nfs/dbraw/zinc/08/57/45/135085745.db2.gz JYRGQOPVLOLYOH-ZIAGYGMSSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H]1CCCCC[N@@H+]1C[C@H]1CCC[NH2+]C1 ZINC000252186069 135086566 /nfs/dbraw/zinc/08/65/66/135086566.db2.gz QVQFCDZOIQMHDA-OLZOCXBDSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@@H]1CCC[C@@H](C)[NH+]1CC[C@H]1CC[NH2+]C1 ZINC000252184355 135086768 /nfs/dbraw/zinc/08/67/68/135086768.db2.gz QOJGMBZILUXYAD-JHJVBQTASA-N 2 0 210.365 2.249 20 0 BEADRP C[C@H]1CCC[N@H+](C[C@H]2CCC[NH2+]C2)CC1 ZINC000252205671 135086781 /nfs/dbraw/zinc/08/67/81/135086781.db2.gz VBELMGPTCORLOO-STQMWFEESA-N 2 0 210.365 2.108 20 0 BEADRP C[C@@H]1CC[C@H]([N@H+](C)CC2CC[NH2+]CC2)C1 ZINC000086701586 135094189 /nfs/dbraw/zinc/09/41/89/135094189.db2.gz DRZJUWLMSHKWQF-YPMHNXCESA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]CC1CCSCC1 ZINC000252712999 135100157 /nfs/dbraw/zinc/10/01/57/135100157.db2.gz NZWHJVMLTLSMDL-WCQYABFASA-N 2 0 242.432 2.059 20 0 BEADRP CCCC1(C[NH2+][C@@H]2CC[N@H+](C)C[C@H]2C)CC1 ZINC000252729581 135103947 /nfs/dbraw/zinc/10/39/47/135103947.db2.gz HHUHOUJKNOHLQW-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP CCCC1(C[NH2+][C@H]2CC[N@H+](C)C[C@H]2C)CC1 ZINC000252729582 135104025 /nfs/dbraw/zinc/10/40/25/135104025.db2.gz HHUHOUJKNOHLQW-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]CC1(C2CC2)CC1 ZINC000252733536 135104972 /nfs/dbraw/zinc/10/49/72/135104972.db2.gz ZWZJXOPAANFGGM-DGCLKSJQSA-N 2 0 222.376 2.106 20 0 BEADRP CCSCCC[NH2+][C@H]1CC[N@H+](C)C[C@H]1C ZINC000252806711 135110766 /nfs/dbraw/zinc/11/07/66/135110766.db2.gz CIMDOSMHFSGGJD-NEPJUHHUSA-N 2 0 230.421 2.059 20 0 BEADRP CCc1cccc(F)c1C[N@@H+]1CC[C@H](C[NH3+])C1 ZINC000261658809 135111462 /nfs/dbraw/zinc/11/14/62/135111462.db2.gz BMGQTLCQYPASEQ-LLVKDONJSA-N 2 0 236.334 2.169 20 0 BEADRP CCC[C@H](C)C[N@@H+]1C[C@@H]2CCC[C@H]([NH3+])[C@H]2C1 ZINC000252848007 135112617 /nfs/dbraw/zinc/11/26/17/135112617.db2.gz GIJVFFVYVVHYIS-XUXIUFHCSA-N 2 0 224.392 2.482 20 0 BEADRP CCC[N@H+](CC[C@@H]1CCCO1)C1CC[NH2+]CC1 ZINC000087266357 135116530 /nfs/dbraw/zinc/11/65/30/135116530.db2.gz WFXNFGIBVOUTFY-AWEZNQCLSA-N 2 0 240.391 2.020 20 0 BEADRP CSCC[C@@H](C)[N@H+](C)CC[C@H]1CCC[NH2+]C1 ZINC000253065095 135120538 /nfs/dbraw/zinc/12/05/38/135120538.db2.gz IBLBEKZCDIDESR-CHWSQXEVSA-N 2 0 244.448 2.450 20 0 BEADRP Cc1cscc1C[NH2+]C1CCC([NH3+])CC1 ZINC000087309510 135121676 /nfs/dbraw/zinc/12/16/76/135121676.db2.gz VJIYMJCYEQKQML-UHFFFAOYSA-N 2 0 224.373 2.416 20 0 BEADRP Cc1cscc1C[NH2+][C@H]1CCC[C@@H]1C[NH3+] ZINC000087309288 135122005 /nfs/dbraw/zinc/12/20/05/135122005.db2.gz QCAVPNNNLJUQGG-PWSUYJOCSA-N 2 0 224.373 2.274 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]Cc1sccc1C ZINC000087310028 135122609 /nfs/dbraw/zinc/12/26/09/135122609.db2.gz KLDFSRAYRHBMOL-SECBINFHSA-N 2 0 212.362 2.002 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@H]2CCC[C@H]([NH3+])C2)C1 ZINC000253199541 135123997 /nfs/dbraw/zinc/12/39/97/135123997.db2.gz AOVLIHADRRDYJF-VOAKCMCISA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)C1 ZINC000253278757 135125541 /nfs/dbraw/zinc/12/55/41/135125541.db2.gz JSPHJAIIQVNIML-DUJLVANISA-N 2 0 222.376 2.390 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@@H]2C[C@@H](C)[N@H+](C)C[C@H]2C)C1 ZINC000253279353 135125560 /nfs/dbraw/zinc/12/55/60/135125560.db2.gz JXRCHDMRMSOKSP-XGFWRYKXSA-N 2 0 224.392 2.493 20 0 BEADRP Cc1csc(C[NH+]2CCC([C@@H](C)[NH3+])CC2)n1 ZINC000087393582 135127822 /nfs/dbraw/zinc/12/78/22/135127822.db2.gz VLQSPACUCLLBRA-SNVBAGLBSA-N 2 0 239.388 2.011 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]Cc1ccc(Cl)cc1 ZINC000258869047 135135803 /nfs/dbraw/zinc/13/58/03/135135803.db2.gz ZMTOUDGYOWRXJB-SECBINFHSA-N 2 0 212.724 2.024 20 0 BEADRP C(C1CCCC1)[N@@H+]1CC[C@@]2(C1)CCC[NH2+]C2 ZINC000257703390 135140056 /nfs/dbraw/zinc/14/00/56/135140056.db2.gz QRUQXZVRHHYQEQ-AWEZNQCLSA-N 2 0 222.376 2.252 20 0 BEADRP C(C1CCCC1)[N@@H+]1CCC[C@]2(CC[NH2+]C2)C1 ZINC000257747713 135142010 /nfs/dbraw/zinc/14/20/10/135142010.db2.gz ZXZVCFHIHGTLHG-CQSZACIVSA-N 2 0 222.376 2.252 20 0 BEADRP C[C@H]([NH3+])CN1CCC[C@@H]1c1ccsc1 ZINC000261529060 135154725 /nfs/dbraw/zinc/15/47/25/135154725.db2.gz AFUAFBCHHIXVQG-GXSJLCMTSA-N 2 0 210.346 2.232 20 0 BEADRP C[C@@H]1CCCC[C@H]1C[NH2+]C[C@H]1CCC[NH2+]1 ZINC000261529823 135156798 /nfs/dbraw/zinc/15/67/98/135156798.db2.gz BMAPOBYHKKYUOD-FRRDWIJNSA-N 2 0 210.365 2.154 20 0 BEADRP CC[C@H]([NH2+][C@@H](C)[C@H](C)[NH3+])c1ccccc1 ZINC000261530264 135157313 /nfs/dbraw/zinc/15/73/13/135157313.db2.gz CDCRCTIXXRHFIV-GVXVVHGQSA-N 2 0 206.333 2.463 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CC[NH2+]C[C@@H]1C ZINC000261530651 135158160 /nfs/dbraw/zinc/15/81/60/135158160.db2.gz CYYRJSOLBOGOQU-VOAKCMCISA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CCC[NH2+]C1)c1ccsc1 ZINC000087647143 135160641 /nfs/dbraw/zinc/16/06/41/135160641.db2.gz NXOQPCAYDCRWMB-GHMZBOCLSA-N 2 0 224.373 2.398 20 0 BEADRP CC1CCC(C[NH2+]C[C@@H]2CCC[NH2+]C2)CC1 ZINC000087647176 135160757 /nfs/dbraw/zinc/16/07/57/135160757.db2.gz BADKRDQLPBFRFX-JXQTWKCFSA-N 2 0 224.392 2.402 20 0 BEADRP C[C@H]1C[N@H+](C[C@H]2CCC[C@@H](C)C2)C[C@H]1[NH3+] ZINC000261531840 135161769 /nfs/dbraw/zinc/16/17/69/135161769.db2.gz IALMBPNPHJGOON-MROQNXINSA-N 2 0 210.365 2.092 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CC[NH2+]C[C@H]2C)s1 ZINC000261531942 135162048 /nfs/dbraw/zinc/16/20/48/135162048.db2.gz ILRXSYUARHTXEA-BXKDBHETSA-N 2 0 224.373 2.144 20 0 BEADRP CC(C)(C)CC[N@@H+]1C[C@@H]2CC[C@@H]([NH3+])[C@H]2C1 ZINC000261532247 135162844 /nfs/dbraw/zinc/16/28/44/135162844.db2.gz JTHYWZKNPJBADQ-SDDRHHMPSA-N 2 0 210.365 2.092 20 0 BEADRP CC(C)(C)CC[N@@H+]1C[C@@H]2CC[C@H]([NH3+])[C@@H]2C1 ZINC000261532249 135162890 /nfs/dbraw/zinc/16/28/90/135162890.db2.gz JTHYWZKNPJBADQ-TUAOUCFPSA-N 2 0 210.365 2.092 20 0 BEADRP CC[C@@H]1CCC[N@H+](C[C@H]2CC[NH2+][C@H](C)C2)C1 ZINC000261532727 135163067 /nfs/dbraw/zinc/16/30/67/135163067.db2.gz DIKLLNDKUDNXFW-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP C1C[NH2+][C@H]([C@@H]2CCC[C@@H]2[NH2+][C@H]2CCSC2)C1 ZINC000261532730 135163348 /nfs/dbraw/zinc/16/33/48/135163348.db2.gz DILAQRVEAXCFPM-CYDGBPFRSA-N 2 0 240.416 2.002 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000261532598 135163359 /nfs/dbraw/zinc/16/33/59/135163359.db2.gz JXNUEOUCORBLLO-AAEUAGOBSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H]1C[C@H](C[N@H+](C)CCC2CC2)CC[NH2+]1 ZINC000261533288 135165155 /nfs/dbraw/zinc/16/51/55/135165155.db2.gz KQAGFIPUOKFHDR-WCQYABFASA-N 2 0 210.365 2.106 20 0 BEADRP CC1CCC([NH2+][C@H]2CC[NH2+]C[C@H]2C)CC1 ZINC000261534825 135168263 /nfs/dbraw/zinc/16/82/63/135168263.db2.gz NCCFOCSYULLSJT-KPFVRQRISA-N 2 0 210.365 2.153 20 0 BEADRP CC1CCC([NH2+][C@@H]2CC[NH2+]C[C@@H]2C)CC1 ZINC000261534831 135168341 /nfs/dbraw/zinc/16/83/41/135168341.db2.gz NCCFOCSYULLSJT-PYNQCMFNSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[NH2+]C[C@@H]1C)c1cccs1 ZINC000261535067 135168422 /nfs/dbraw/zinc/16/84/22/135168422.db2.gz NRIIARWNIVDMOJ-DCAQKATOSA-N 2 0 224.373 2.397 20 0 BEADRP C[C@@H](c1ccc(F)cc1)N1C[C@@H](C)[C@H]([NH3+])C1 ZINC000261535005 135168618 /nfs/dbraw/zinc/16/86/18/135168618.db2.gz VLYTXDAUVIBVIK-GBIKHYSHSA-N 2 0 222.307 2.166 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@H]2CC[NH2+]C[C@H]2C)C1 ZINC000261535654 135170697 /nfs/dbraw/zinc/17/06/97/135170697.db2.gz OXJXYFMMSDRMFP-NDBYEHHHSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@]1(C[NH2+]C2CCC([NH3+])CC2)CCCS1 ZINC000087793165 135172266 /nfs/dbraw/zinc/17/22/66/135172266.db2.gz SCRSPABUTSCFJA-HTAVTVPLSA-N 2 0 228.405 2.132 20 0 BEADRP CC[N@H+](CC(C)C)C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000261536881 135172767 /nfs/dbraw/zinc/17/27/67/135172767.db2.gz UBVWLVHWMKHXQM-CHWSQXEVSA-N 2 0 212.381 2.352 20 0 BEADRP CC[C@@H]1CCCC[C@@H]1[NH2+]C[C@H]1CCC[NH2+]1 ZINC000261537123 135172998 /nfs/dbraw/zinc/17/29/98/135172998.db2.gz UXMBZFHWTXMKMS-UPJWGTAASA-N 2 0 210.365 2.297 20 0 BEADRP CC(C)(C)CC[N@@H+]1CC[C@@H]2[NH2+]CC[C@H]2C1 ZINC000261537104 135173173 /nfs/dbraw/zinc/17/31/73/135173173.db2.gz UWSOULUHYKMPJQ-RYUDHWBXSA-N 2 0 210.365 2.106 20 0 BEADRP CC1(C)CCC(C[NH2+][C@@H]2CC[NH2+]C2)CC1 ZINC000261537167 135174127 /nfs/dbraw/zinc/17/41/27/135174127.db2.gz VBJNUZTYXWOJDD-GFCCVEGCSA-N 2 0 210.365 2.154 20 0 BEADRP CCC[C@@H]1C[C@@H]1[NH2+][C@H]1CCCC[C@H]1C[NH3+] ZINC000261537909 135175061 /nfs/dbraw/zinc/17/50/61/135175061.db2.gz WQFKQQDPDDADMJ-VOAKCMCISA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)SCC[NH2+][C@H]1CCCC[C@@H]1C[NH3+] ZINC000261538718 135176073 /nfs/dbraw/zinc/17/60/73/135176073.db2.gz ZBJRIAHAIQSIKJ-NEPJUHHUSA-N 2 0 230.421 2.235 20 0 BEADRP C[C@@H]([NH3+])[C@@H]1CCC[N@H+](CC2(C)CCC2)C1 ZINC000261538375 135176630 /nfs/dbraw/zinc/17/66/30/135176630.db2.gz XWGFWHCZJIHZGQ-VXGBXAGGSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@H]1CCCC[N@H+](C[C@@H]2CCC[NH2+]C2)C1 ZINC000261539321 135177823 /nfs/dbraw/zinc/17/78/23/135177823.db2.gz CCRCMMGMJILHSB-QWHCGFSZSA-N 2 0 210.365 2.108 20 0 BEADRP CC[C@@H]1[C@@H](C)CC[N@@H+]1C[C@@]1(C)CC[NH2+]C1 ZINC000261539801 135178412 /nfs/dbraw/zinc/17/84/12/135178412.db2.gz DEPZGYNZQVWNCI-XQQFMLRXSA-N 2 0 210.365 2.106 20 0 BEADRP C(C[N@@H+]1CC[C@H]2C[NH2+]C[C@H]2C1)C1CCCCC1 ZINC000261542160 135182810 /nfs/dbraw/zinc/18/28/10/135182810.db2.gz BWNRPYWBTSMEOR-GJZGRUSLSA-N 2 0 236.403 2.498 20 0 BEADRP CC[N@H+](C[C@@H]1C[C@@H]1C)[C@H]1CCC[NH2+]CC1 ZINC000261542622 135183034 /nfs/dbraw/zinc/18/30/34/135183034.db2.gz GZMNZXBCCRRDJE-AVGNSLFASA-N 2 0 210.365 2.106 20 0 BEADRP CC[N@H+](C[C@@H]1C[C@H]1C)[C@H]1CCC[NH2+]CC1 ZINC000261542621 135183071 /nfs/dbraw/zinc/18/30/71/135183071.db2.gz GZMNZXBCCRRDJE-AGIUHOORSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1C[N@H+](C[C@H]2CCC[NH2+]C2)C(C)(C)C1 ZINC000261549144 135187538 /nfs/dbraw/zinc/18/75/38/135187538.db2.gz OGHKUTZUFXUHPX-RYUDHWBXSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]1C[C@H](C[N@H+]2C[C@@H]3CCCC[C@@H]3C2)CC[NH2+]1 ZINC000261550986 135190465 /nfs/dbraw/zinc/19/04/65/135190465.db2.gz LRQUZASCMFDBTJ-LJISPDSOSA-N 2 0 236.403 2.497 20 0 BEADRP C(C1CC[NH2+]CC1)[N@@H+]1[C@H]2CC[C@@H]1CCC2 ZINC000261556205 135196116 /nfs/dbraw/zinc/19/61/16/135196116.db2.gz VRPZFOUMAOZNHT-BETUJISGSA-N 2 0 208.349 2.003 20 0 BEADRP C[C@H]1[C@H]([NH3+])CCN1c1cc[nH+]c2ccccc21 ZINC000261556766 135197264 /nfs/dbraw/zinc/19/72/64/135197264.db2.gz RAJLZYZSAUFQMG-CMPLNLGQSA-N 2 0 227.311 2.161 20 0 BEADRP C1CC2CCC1C[C@H]2[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000261558906 135199381 /nfs/dbraw/zinc/19/93/81/135199381.db2.gz YQCDSFYXNNVSEG-NWINJMCUSA-N 2 0 222.376 2.297 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@H]3[NH2+]CC[C@H]3C2)c(C)c1 ZINC000261562774 135204649 /nfs/dbraw/zinc/20/46/49/135204649.db2.gz GQAOJNDEPBCGAN-JKSUJKDBSA-N 2 0 244.382 2.487 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[NH2+][C@H]1CC[NH2+]C[C@@H]1C ZINC000261562834 135204725 /nfs/dbraw/zinc/20/47/25/135204725.db2.gz BQJMWPCPNFEZPE-RQJABVFESA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[NH2+][C@H]1CC[NH2+]C[C@H]1C ZINC000261562835 135204800 /nfs/dbraw/zinc/20/48/00/135204800.db2.gz BQJMWPCPNFEZPE-SYQHCUMBSA-N 2 0 224.392 2.400 20 0 BEADRP COc1cccc([C@H](C)[N@@H+]2CC[C@@](C)(C[NH3+])C2)c1 ZINC000261563965 135206379 /nfs/dbraw/zinc/20/63/79/135206379.db2.gz HDIKRDYLWVKQSC-WFASDCNBSA-N 2 0 248.370 2.427 20 0 BEADRP Cc1cc(C)cc(C[N@@H+]2CC[C@H]3C[NH2+]C[C@@H]3C2)c1 ZINC000261564769 135206822 /nfs/dbraw/zinc/20/68/22/135206822.db2.gz HMOSLOKVLKLPNH-JKSUJKDBSA-N 2 0 244.382 2.345 20 0 BEADRP Cc1cccc(C[N@@H+]2C[C@@H]3CC[C@H]([NH3+])[C@H]3C2)c1C ZINC000261565666 135208158 /nfs/dbraw/zinc/20/81/58/135208158.db2.gz HXAQDRVUJNSRLH-JYJNAYRXSA-N 2 0 244.382 2.473 20 0 BEADRP CS[C@H](C)C[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000163891453 135209710 /nfs/dbraw/zinc/20/97/10/135209710.db2.gz BIWOZRXFTWBWMD-LLVKDONJSA-N 2 0 230.421 2.200 20 0 BEADRP [NH3+]C[C@H]1CC[N@H+](CC2CCCCCC2)C1 ZINC000084329933 135211757 /nfs/dbraw/zinc/21/17/57/135211757.db2.gz HOIPREYUBPDENA-CYBMUJFWSA-N 2 0 210.365 2.237 20 0 BEADRP C[C@@H]1CCC[C@H](C[N@@H+]2CC[C@@](C)(C[NH3+])C2)C1 ZINC000261571041 135212845 /nfs/dbraw/zinc/21/28/45/135212845.db2.gz HILKKQXIYFMPLT-RDBSUJKOSA-N 2 0 224.392 2.483 20 0 BEADRP Cc1csc(CNCCC[N@@H+](C)C(C)C)n1 ZINC000164133868 135213332 /nfs/dbraw/zinc/21/33/32/135213332.db2.gz SQGAQCDMDAWDPW-UHFFFAOYSA-N 2 0 241.404 2.271 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@@H]3[NH2+]CC[C@H]3C2)cc1C ZINC000261572168 135213696 /nfs/dbraw/zinc/21/36/96/135213696.db2.gz LMSLJIOOTXITCN-HOTGVXAUSA-N 2 0 244.382 2.487 20 0 BEADRP C[C@H](Cc1ccc(F)cc1)[NH2+][C@H](C)[C@H](C)[NH3+] ZINC000261572841 135214592 /nfs/dbraw/zinc/21/45/92/135214592.db2.gz IJKRPGZGKQCBNE-OUAUKWLOSA-N 2 0 224.323 2.082 20 0 BEADRP Cc1ccsc1C[N@@H+]1C[C@@H]2CC[C@@H]([NH3+])[C@@H]2C1 ZINC000261575053 135216758 /nfs/dbraw/zinc/21/67/58/135216758.db2.gz JOKGIOXCQFFCGS-QJPTWQEYSA-N 2 0 236.384 2.226 20 0 BEADRP C[C@H]1C[C@H]([NH2+][C@H]2CC[NH2+]C[C@@H]2C)C[C@@H](C)C1 ZINC000261576032 135217490 /nfs/dbraw/zinc/21/74/90/135217490.db2.gz KBEUSITWVORGFM-VJTDZRGJSA-N 2 0 224.392 2.399 20 0 BEADRP Cc1cc(F)ccc1CN1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000261576470 135217712 /nfs/dbraw/zinc/21/77/12/135217712.db2.gz NQXHUKXOXULNQA-JSGCOSHPSA-N 2 0 248.345 2.175 20 0 BEADRP CCC1CC[NH+](CC[C@@H]2CC[NH2+]C2)CC1 ZINC000084385100 135217815 /nfs/dbraw/zinc/21/78/15/135217815.db2.gz QFCGLCZNHXMXOL-ZDUSSCGKSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@@H]1CCC[C@@H](C)[NH+]1CC[C@@H]1CC[NH2+]C1 ZINC000084384588 135217937 /nfs/dbraw/zinc/21/79/37/135217937.db2.gz QOJGMBZILUXYAD-UPJWGTAASA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H]1CCC[C@H]([N@H+](C)CC[C@@H]2CC[NH2+]C2)C1 ZINC000084385240 135218049 /nfs/dbraw/zinc/21/80/49/135218049.db2.gz IRNIRGJUUPXTHA-RDBSUJKOSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CCC[C@@H]([N@H+](C)CC[C@@H]2CC[NH2+]C2)C1 ZINC000084385245 135218061 /nfs/dbraw/zinc/21/80/61/135218061.db2.gz IRNIRGJUUPXTHA-HZSPNIEDSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)C[N@H+](CC[C@H]1CC[NH2+]C1)C(C)C ZINC000084385410 135218138 /nfs/dbraw/zinc/21/81/38/135218138.db2.gz KZRZTLCPRCZAAL-CYBMUJFWSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+]Cc1cccc(Cl)c1 ZINC000261578212 135219034 /nfs/dbraw/zinc/21/90/34/135219034.db2.gz LOOKKXWRUKCZRG-ZWNOBZJWSA-N 2 0 238.762 2.428 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@@H]1CCC[C@H](C)[C@@H]1C ZINC000261579862 135220481 /nfs/dbraw/zinc/22/04/81/135220481.db2.gz MMOFBQOOYKBZPI-ZUWCUPBKSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@@H](C[N@@H+]1CC[C@@]2(CC[NH2+]C2)C1)c1ccccc1 ZINC000261581613 135222143 /nfs/dbraw/zinc/22/21/43/135222143.db2.gz QUQXQJTYSSOGPQ-GOEBONIOSA-N 2 0 244.382 2.476 20 0 BEADRP C[C@H](C[N@@H+]1CC[C@@H]2C[NH2+]C[C@@H]2C1)c1ccccc1 ZINC000261581334 135222223 /nfs/dbraw/zinc/22/22/23/135222223.db2.gz QPBQNOXPLLRNRL-FVQBIDKESA-N 2 0 244.382 2.331 20 0 BEADRP C[C@H](C[N@@H+]1CC[C@@]2(CC[NH2+]C2)C1)c1ccccc1 ZINC000261581612 135222614 /nfs/dbraw/zinc/22/26/14/135222614.db2.gz QUQXQJTYSSOGPQ-GDBMZVCRSA-N 2 0 244.382 2.476 20 0 BEADRP Cc1cc(C)cc(C[N@@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@@H]3C2)c1 ZINC000261583184 135224198 /nfs/dbraw/zinc/22/41/98/135224198.db2.gz RQZSOLQXXCRMCT-ARFHVFGLSA-N 2 0 244.382 2.473 20 0 BEADRP C[C@H](C[N@@H+]1C[C@@H]2CC[C@@H]([NH3+])[C@H]2C1)c1ccccc1 ZINC000261585225 135226200 /nfs/dbraw/zinc/22/62/00/135226200.db2.gz SWEFSVPLJLCQKM-SYAUCNOPSA-N 2 0 244.382 2.459 20 0 BEADRP Cc1cc(F)ccc1C[N@@H+]1C[C@@H]2CC[C@@H]([NH3+])[C@@H]2C1 ZINC000261585271 135226288 /nfs/dbraw/zinc/22/62/88/135226288.db2.gz SYCOEISHVRGNQR-NWANDNLSSA-N 2 0 248.345 2.303 20 0 BEADRP CC(C)CCC[N@@H+]1C[C@@H]2CCC[C@H]([NH3+])[C@@H]2C1 ZINC000164399909 135227034 /nfs/dbraw/zinc/22/70/34/135227034.db2.gz NSIDJBWTQFTMLK-MJBXVCDLSA-N 2 0 224.392 2.482 20 0 BEADRP C[NH2+]C[C@H]1CCC[N@H+](CCC2CCCC2)C1 ZINC000261587661 135228304 /nfs/dbraw/zinc/22/83/04/135228304.db2.gz RXSJOIAOGBJNGT-CQSZACIVSA-N 2 0 224.392 2.498 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@H]3C[NH2+]C[C@@H]3C2)c(C)c1 ZINC000261589545 135230394 /nfs/dbraw/zinc/23/03/94/135230394.db2.gz WIULJQVIKAIZNY-GOEBONIOSA-N 2 0 244.382 2.345 20 0 BEADRP [NH3+][C@@H]1CC[C@H]2C[N@H+](CCC3CCCC3)C[C@H]12 ZINC000261589702 135230419 /nfs/dbraw/zinc/23/04/19/135230419.db2.gz UCSIQIRFKKDSBG-MELADBBJSA-N 2 0 222.376 2.236 20 0 BEADRP Cc1cc(C)cc(C[N@@H+]2CC[C@H]3[NH2+]CC[C@@H]3C2)c1 ZINC000261589789 135230557 /nfs/dbraw/zinc/23/05/57/135230557.db2.gz WMYTWLLGLFKGKP-HZPDHXFCSA-N 2 0 244.382 2.487 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@@H]3C[NH2+]C[C@H]3C2)cc1C ZINC000261590722 135230842 /nfs/dbraw/zinc/23/08/42/135230842.db2.gz XEPPAELUYCIUJT-CVEARBPZSA-N 2 0 244.382 2.345 20 0 BEADRP Cc1ccc(F)c(C[N@@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@H]3C2)c1 ZINC000261591017 135232061 /nfs/dbraw/zinc/23/20/61/135232061.db2.gz XJACCEMKZAKCRO-CORIIIEPSA-N 2 0 248.345 2.303 20 0 BEADRP Cc1ccc(F)c(C[N@@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@@H]3C2)c1 ZINC000261591019 135232177 /nfs/dbraw/zinc/23/21/77/135232177.db2.gz XJACCEMKZAKCRO-NJZAAPMLSA-N 2 0 248.345 2.303 20 0 BEADRP Cc1[nH+]ccc(N2C[C@H](C[NH3+])C[C@@H]2C)c1Cl ZINC000261592001 135232805 /nfs/dbraw/zinc/23/28/05/135232805.db2.gz VQDOZLMQYSZORV-WPRPVWTQSA-N 2 0 239.750 2.217 20 0 BEADRP C(C1CCCCC1)[N@@H+]1CC[C@@H]2[NH2+]CC[C@@H]2C1 ZINC000261597532 135237175 /nfs/dbraw/zinc/23/71/75/135237175.db2.gz ZEUMRFFJIRUTRN-KGLIPLIRSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@@H]1CCC[C@H](C[N@@H+]2C[C@@H]3CC[C@H]([NH3+])[C@H]3C2)C1 ZINC000261547436 135240323 /nfs/dbraw/zinc/24/03/23/135240323.db2.gz IAFVTQCAASSGGK-QTVXIADOSA-N 2 0 236.403 2.482 20 0 BEADRP COc1cc(C[N@@H+]2C[C@@H](C[NH3+])C[C@H]2C)ccc1C ZINC000261787635 135252772 /nfs/dbraw/zinc/25/27/72/135252772.db2.gz FYYJGFKQUCXKPM-TZMCWYRMSA-N 2 0 248.370 2.173 20 0 BEADRP CC(C)[C@H]1CCC[N@H+](C[C@]2(C)CC[NH2+]C2)C1 ZINC000261984042 135269959 /nfs/dbraw/zinc/26/99/59/135269959.db2.gz JMJBEQXJISNDLP-UONOGXRCSA-N 2 0 224.392 2.354 20 0 BEADRP CC[N@H+](C[C@H]1CCSC1)[C@H]1CCC[NH2+]CC1 ZINC000261995542 135270897 /nfs/dbraw/zinc/27/08/97/135270897.db2.gz SULOQBLFOQKYPQ-OLZOCXBDSA-N 2 0 242.432 2.204 20 0 BEADRP COc1cc(C[N@@H+]2CC[C@@](C)(C[NH3+])C2)ccc1C ZINC000262022161 135274161 /nfs/dbraw/zinc/27/41/61/135274161.db2.gz WHMDAVQPTWFBAL-HNNXBMFYSA-N 2 0 248.370 2.174 20 0 BEADRP CC(C)C[C@H]1CC[N@H+](C[C@@]2(C)CC[NH2+]C2)C1 ZINC000262149960 135282274 /nfs/dbraw/zinc/28/22/74/135282274.db2.gz ZVCRQDHQDAAVBI-KGLIPLIRSA-N 2 0 224.392 2.354 20 0 BEADRP [NH3+]CCN1CCC[C@H]1Cc1ccccc1Cl ZINC000262991615 135325964 /nfs/dbraw/zinc/32/59/64/135325964.db2.gz NVUYQLNYJCDEQC-LBPRGKRZSA-N 2 0 238.762 2.306 20 0 BEADRP C[NH+](C)C1CCC([NH2+]C2CCCC2)CC1 ZINC000334376945 135377596 /nfs/dbraw/zinc/37/75/96/135377596.db2.gz FPYQHFFKRMUMEJ-UHFFFAOYSA-N 2 0 210.365 2.391 20 0 BEADRP C[C@@H]1CCC[C@H](C[N@@H+]2C[C@H]3CCC[NH2+][C@@H]3C2)C1 ZINC000299916046 135381610 /nfs/dbraw/zinc/38/16/10/135381610.db2.gz GXQFRDSJRVWWGQ-LXTVHRRPSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H]([NH2+][C@H]1CCc2nc[nH]c2C1)c1ccccn1 ZINC000334405935 135394400 /nfs/dbraw/zinc/39/44/00/135394400.db2.gz HOJPAJTUFDPULV-QWRGUYRKSA-N 2 0 242.326 2.013 20 0 BEADRP CC(C)CCC[NH+]1CCC([C@@H](C)[NH3+])CC1 ZINC000165033051 135455301 /nfs/dbraw/zinc/45/53/01/135455301.db2.gz ISIBBJSKJFVWPG-GFCCVEGCSA-N 2 0 212.381 2.482 20 0 BEADRP [NH3+]C1CCC([NH2+]CCC2CCCC2)CC1 ZINC000086728363 135495219 /nfs/dbraw/zinc/49/52/19/135495219.db2.gz DQVFPWAPTQXPAV-UHFFFAOYSA-N 2 0 210.365 2.426 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CC[NH2+][C@@H](C)C2)s1 ZINC000334863369 135826706 /nfs/dbraw/zinc/82/67/06/135826706.db2.gz NUQWBBMKPNWXQA-ONGXEEELSA-N 2 0 224.373 2.287 20 0 BEADRP C[NH+](C)C1CCC([NH2+][C@H]2CCOC2(C)C)CC1 ZINC000334894769 135836915 /nfs/dbraw/zinc/83/69/15/135836915.db2.gz HBKUHRUJPRVCST-BPCQOVAHSA-N 2 0 240.391 2.016 20 0 BEADRP CC1(C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)CCCC1 ZINC000335044965 135872321 /nfs/dbraw/zinc/87/23/21/135872321.db2.gz WGHMGVNDCZFNHY-FUNVUKJBSA-N 2 0 222.376 2.439 20 0 BEADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@@H](C)C(C)(C)C ZINC000166032128 135914060 /nfs/dbraw/zinc/91/40/60/135914060.db2.gz NHOSZUCDULHSNH-QWHCGFSZSA-N 2 0 244.423 2.367 20 0 BEADRP CC(C)[C@H](C)[N@H+](C)CC[C@H]1CCC[NH+]1C ZINC000348078408 136034668 /nfs/dbraw/zinc/03/46/68/136034668.db2.gz LAMJCSXKBSYTJB-QWHCGFSZSA-N 2 0 212.381 2.447 20 0 BEADRP [NH3+]C[C@@H]1CC[N@@H+]([C@H]2CCc3ccc(F)cc32)C1 ZINC000335335940 136055686 /nfs/dbraw/zinc/05/56/86/136055686.db2.gz RDSYXZRREBGUHA-HZMBPMFUSA-N 2 0 234.318 2.094 20 0 BEADRP [NH3+]C[C@H]1CC[N@@H+]([C@@H]2CCc3ccc(F)cc32)C1 ZINC000335335942 136055748 /nfs/dbraw/zinc/05/57/48/136055748.db2.gz RDSYXZRREBGUHA-QMTHXVAHSA-N 2 0 234.318 2.094 20 0 BEADRP [NH3+]C[C@@H]1CC[N@@H+]([C@@H]2CCc3ccc(F)cc32)C1 ZINC000335335941 136055906 /nfs/dbraw/zinc/05/59/06/136055906.db2.gz RDSYXZRREBGUHA-IINYFYTJSA-N 2 0 234.318 2.094 20 0 BEADRP Cc1cc(N)cc(C[NH2+][C@@H]2CC[N@@H+](C)C[C@@H]2C)c1 ZINC000335356516 136062096 /nfs/dbraw/zinc/06/20/96/136062096.db2.gz DKUGESOVWICPHD-SWLSCSKDSA-N 2 0 247.386 2.007 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CCC2(F)CCC2)CN1C1CC1 ZINC000348324694 136069860 /nfs/dbraw/zinc/06/98/60/136069860.db2.gz KYWMWKFQRNIYFW-NWDGAFQWSA-N 2 0 240.366 2.484 20 0 BEADRP FC1(CC[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)CCC1 ZINC000348336939 136075627 /nfs/dbraw/zinc/07/56/27/136075627.db2.gz SPPNAIRNRHNKEM-CHWSQXEVSA-N 2 0 240.366 2.485 20 0 BEADRP [NH3+]CC1CCC([NH2+][C@@H]2CCC[C@@H](F)C2)CC1 ZINC000335386993 136089205 /nfs/dbraw/zinc/08/92/05/136089205.db2.gz ORLOLBHOGMJUNL-POOIEITISA-N 2 0 228.355 2.374 20 0 BEADRP C[C@H]([NH2+]C1CC[NH2+]CC1)c1ccc2c(c1)COC2 ZINC000335570046 136109470 /nfs/dbraw/zinc/10/94/70/136109470.db2.gz YKPJTEJDFWIKJJ-NSHDSACASA-N 2 0 246.354 2.119 20 0 BEADRP C[C@H]([NH2+][C@H]1C[C@@H]([NH3+])C1(C)C)c1ccccc1 ZINC000404806259 397734457 /nfs/dbraw/zinc/73/44/57/397734457.db2.gz YNXQUBXJMXKOQW-UHTWSYAYSA-N 2 0 218.344 2.463 20 0 BEADRP C[NH2+]C[C@@H]1C[C@H](F)CN1C[C@H](C)CC(C)C ZINC000647540479 397782382 /nfs/dbraw/zinc/78/23/82/397782382.db2.gz UVBODJKEKBSTQW-AGIUHOORSA-N 2 0 230.371 2.300 20 0 BEADRP CC(C)=CCC[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000309101979 397851237 /nfs/dbraw/zinc/85/12/37/397851237.db2.gz GGCCJUQHYBKFPF-CHWSQXEVSA-N 2 0 210.365 2.415 20 0 BEADRP C[C@@H]([NH2+]CCC[NH+]1CCCC1)[C@H]1CCCCO1 ZINC000383087827 397998770 /nfs/dbraw/zinc/99/87/70/397998770.db2.gz KPPLKLDYCSGGMG-ZIAGYGMSSA-N 2 0 240.391 2.020 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H](C)Cc1ccc(F)cc1 ZINC000414829691 398050281 /nfs/dbraw/zinc/05/02/81/398050281.db2.gz BHYOYGSMQPJXRL-NEPJUHHUSA-N 2 0 238.350 2.202 20 0 BEADRP C[C@H]1C[C@H](C[N@H+](C)C(C2CC2)C2CC2)CC[NH2+]1 ZINC000414689751 398019672 /nfs/dbraw/zinc/01/96/72/398019672.db2.gz GVFHWZLLHGMGDN-NWDGAFQWSA-N 2 0 236.403 2.495 20 0 BEADRP C(C1CCCC1)[N@@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1 ZINC000414777370 398035906 /nfs/dbraw/zinc/03/59/06/398035906.db2.gz IENQWQOEBYKJOS-GJZGRUSLSA-N 2 0 236.403 2.498 20 0 BEADRP Cc1ccoc1CN1CC[C@@H]2CC[N@@H+](C)C[C@H]21 ZINC000272625692 397980768 /nfs/dbraw/zinc/98/07/68/397980768.db2.gz MNNJFUBWGPABCX-QWHCGFSZSA-N 2 0 234.343 2.114 20 0 BEADRP CCOC[C@H](C)[NH2+]CC1([NH3+])CCCCCC1 ZINC000414857722 398065851 /nfs/dbraw/zinc/06/58/51/398065851.db2.gz FLGDADSHCRXJKL-LBPRGKRZSA-N 2 0 228.380 2.053 20 0 BEADRP [NH3+]Cc1ccc(NC2CCC(C[NH3+])CC2)cc1 ZINC000414917866 398093522 /nfs/dbraw/zinc/09/35/22/398093522.db2.gz XIICELSKRMSMHA-UHFFFAOYSA-N 2 0 233.359 2.075 20 0 BEADRP C[C@H](Cc1cccs1)[NH2+]CC(C)(C)[NH3+] ZINC000389332742 398076360 /nfs/dbraw/zinc/07/63/60/398076360.db2.gz VOWPWKJFHOFUGY-SECBINFHSA-N 2 0 212.362 2.006 20 0 BEADRP CCC1(C[NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)CC1 ZINC000222206633 398095108 /nfs/dbraw/zinc/09/51/08/398095108.db2.gz VQNWVSZGRLDZCM-RYUDHWBXSA-N 2 0 210.365 2.249 20 0 BEADRP Cc1ccsc1C[N@@H+](C)CC(C)(C)C[NH3+] ZINC000086637446 398056167 /nfs/dbraw/zinc/05/61/67/398056167.db2.gz JSZCAOQPTQPGEY-UHFFFAOYSA-N 2 0 226.389 2.473 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]C[C@@H](C)Cc1ccccc1 ZINC000414850663 398058112 /nfs/dbraw/zinc/05/81/12/398058112.db2.gz ZRCNABHJIVZELA-KBPBESRZSA-N 2 0 234.387 2.310 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)Cc2ccoc2)C1 ZINC000449089321 398058395 /nfs/dbraw/zinc/05/83/95/398058395.db2.gz JWELQWYAMXSTDC-OCCSQVGLSA-N 2 0 236.359 2.142 20 0 BEADRP Cc1cc(C)cc(OCC[N@@H+](C)C2CC([NH3+])C2)c1 ZINC000384910200 398116841 /nfs/dbraw/zinc/11/68/41/398116841.db2.gz PTBRLUHWUARHSF-UHFFFAOYSA-N 2 0 248.370 2.104 20 0 BEADRP C[NH2+]Cc1ccc(NCC[NH2+]C(C)(C)C)cc1 ZINC000414979568 398134177 /nfs/dbraw/zinc/13/41/77/398134177.db2.gz UNIIOPGXJPVZNG-UHFFFAOYSA-N 2 0 235.375 2.206 20 0 BEADRP C[C@H](CCC1CC1)[NH2+][C@@H]1CC[NH2+]C[C@H]1C ZINC000398111061 322864214 /nfs/dbraw/zinc/86/42/14/322864214.db2.gz XETCOIZCYZINFU-NQBHXWOUSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H](c1ccccn1)[N@@H+]1C[C@H]2CC[NH+](C)C[C@H]2C1 ZINC001647978159 1172785139 /nfs/dbraw/zinc/78/51/39/1172785139.db2.gz YNZAYMWZQSUWNM-MJBXVCDLSA-N 2 0 245.370 2.026 20 0 BEADRP Cc1cccc(C[NH2+]CC[C@H]2CC[NH2+]C2)c1 ZINC000258875746 322879332 /nfs/dbraw/zinc/87/93/32/322879332.db2.gz BEJOVPAZAVCXIO-CYBMUJFWSA-N 2 0 218.344 2.084 20 0 BEADRP COc1ccc(C[NH2+]CC[C@H]2CCC[NH2+]C2)cc1 ZINC000259107921 322881664 /nfs/dbraw/zinc/88/16/64/322881664.db2.gz VADMUAVYPGLTSV-CYBMUJFWSA-N 2 0 248.370 2.175 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@@H]1CC[C@@H](C)SC1 ZINC000655703342 487557504 /nfs/dbraw/zinc/55/75/04/487557504.db2.gz OLHXVUAVICBKTA-IJLUTSLNSA-N 2 0 230.421 2.200 20 0 BEADRP CCOc1ccc(C[NH2+]CC[C@H]2CC[NH2+]C2)cc1 ZINC000259156187 322882263 /nfs/dbraw/zinc/88/22/63/322882263.db2.gz XTCUKHGOJBASPK-AWEZNQCLSA-N 2 0 248.370 2.175 20 0 BEADRP Cc1cc(F)ccc1C[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000334843089 487569934 /nfs/dbraw/zinc/56/99/34/487569934.db2.gz BGMFTFAXTLQPJN-ZIAGYGMSSA-N 2 0 236.334 2.494 20 0 BEADRP CC(C)OCCC[N@@H+]1CCC[C@H]([NH+](C)C)CC1 ZINC000365402015 167211141 /nfs/dbraw/zinc/21/11/41/167211141.db2.gz IJHXWXXPGJHLTB-AWEZNQCLSA-N 2 0 242.407 2.218 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H]1CS[C@H](C)C1 ZINC000086934274 487589336 /nfs/dbraw/zinc/58/93/36/487589336.db2.gz VCPYSZORGYMAER-VXGBXAGGSA-N 2 0 230.421 2.202 20 0 BEADRP C[C@@H](Cc1cccc(F)c1)[N@H+](C)CCC[NH3+] ZINC000162599188 487591387 /nfs/dbraw/zinc/59/13/87/487591387.db2.gz LCBDFTVEUUQATM-NSHDSACASA-N 2 0 224.323 2.037 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@@H]2CS[C@@H](C)C2)CC1 ZINC000086935663 487593568 /nfs/dbraw/zinc/59/35/68/487593568.db2.gz ATSRSMYXMXLHEX-AAEUAGOBSA-N 2 0 242.432 2.202 20 0 BEADRP Cc1cc(C)c(C[NH2+]CCC[NH3+])c(C)c1 ZINC000037713089 487600057 /nfs/dbraw/zinc/60/00/57/487600057.db2.gz ADLGJCPVQNEJIK-UHFFFAOYSA-N 2 0 206.333 2.050 20 0 BEADRP CC(C)SCC[N@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000336667913 167324460 /nfs/dbraw/zinc/32/44/60/167324460.db2.gz PRHKWWLWECCHJF-ZDUSSCGKSA-N 2 0 244.448 2.402 20 0 BEADRP CO[C@H](C[NH+]1CCC([NH3+])CC1)C1CCCCC1 ZINC000662241285 409529777 /nfs/dbraw/zinc/52/97/77/409529777.db2.gz RSMGBSPDTKQBGL-CQSZACIVSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@@H]([NH3+])[C@H]1CCC[N@H+](CC2CC=CC2)C1 ZINC000662244510 409533391 /nfs/dbraw/zinc/53/33/91/409533391.db2.gz HUDMYJSGVJZGNW-YPMHNXCESA-N 2 0 208.349 2.012 20 0 BEADRP [NH3+]C[C@H]1CC[N@H+](CC[C@@H]2CCc3ccccc32)C1 ZINC000662246136 409541308 /nfs/dbraw/zinc/54/13/08/409541308.db2.gz PUWOFEAAWOKKDJ-HIFRSBDPSA-N 2 0 244.382 2.387 20 0 BEADRP CC(C)[C@H]([NH2+]CCC[NH3+])c1ccccc1F ZINC000662303289 409628453 /nfs/dbraw/zinc/62/84/53/409628453.db2.gz VBULWWXOCDYWOB-ZDUSSCGKSA-N 2 0 224.323 2.461 20 0 BEADRP C([C@@H]1CCC[NH2+]C1)[N@@H+]1CCC[C@H](C2CCC2)C1 ZINC000662318398 409637400 /nfs/dbraw/zinc/63/74/00/409637400.db2.gz ZQUHWOWGAVSRIQ-HIFRSBDPSA-N 2 0 236.403 2.498 20 0 BEADRP CC[C@@H](CC(F)F)C[N@@H+]1CC[C@](C)(C[NH3+])C1 ZINC000662272868 409577495 /nfs/dbraw/zinc/57/74/95/409577495.db2.gz JNKHIPRRSUWAOL-CMPLNLGQSA-N 2 0 234.334 2.339 20 0 BEADRP CC(C)SCC[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000336685108 167331937 /nfs/dbraw/zinc/33/19/37/167331937.db2.gz KNZAKNAAAHXDGF-NWDGAFQWSA-N 2 0 230.421 2.200 20 0 BEADRP CC(C)SCC[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@H]1C ZINC000309408769 167331945 /nfs/dbraw/zinc/33/19/45/167331945.db2.gz VGUWPJDESYXNGT-FRRDWIJNSA-N 2 0 244.448 2.446 20 0 BEADRP C[N@H+](CC1CCCC1)[C@H]1CCC[NH2+]CC1 ZINC000082666927 409848999 /nfs/dbraw/zinc/84/89/99/409848999.db2.gz VOOIBAXPYDGMOR-ZDUSSCGKSA-N 2 0 210.365 2.251 20 0 BEADRP Cc1ccc(C[N@H+](C)C[C@H]2CC[NH2+]C2)cc1 ZINC000051889914 409936788 /nfs/dbraw/zinc/93/67/88/409936788.db2.gz ABGGVDFTHNHVJK-AWEZNQCLSA-N 2 0 218.344 2.036 20 0 BEADRP C[C@H]1CCC[C@@H](C[NH2+]CC23CC(C2)C[NH2+]3)C1 ZINC000663501532 410278712 /nfs/dbraw/zinc/27/87/12/410278712.db2.gz XJXPHQPFQHGPPL-MRFVTOPCSA-N 2 0 222.376 2.154 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+]Cc1ccc(C[NH3+])cc1F ZINC000650717070 410355258 /nfs/dbraw/zinc/35/52/58/410355258.db2.gz QZSVQCSUMACINP-BXKDBHETSA-N 2 0 222.307 2.030 20 0 BEADRP C[NH2+]Cc1ccccc1C[NH2+]Cc1ccccn1 ZINC000650718359 410355402 /nfs/dbraw/zinc/35/54/02/410355402.db2.gz IKAGTFHWXGZZMD-UHFFFAOYSA-N 2 0 241.338 2.091 20 0 BEADRP c1cc2c(c(C[NH2+][C@@H]3CCC[NH2+]CC3)c1)CCC2 ZINC000650703691 410334971 /nfs/dbraw/zinc/33/49/71/410334971.db2.gz LYUHYCVPYPGYRZ-OAHLLOKOSA-N 2 0 244.382 2.407 20 0 BEADRP c1cc2c(c(C[NH2+][C@H]3CCC[NH2+]CC3)c1)CCC2 ZINC000650703690 410336733 /nfs/dbraw/zinc/33/67/33/410336733.db2.gz LYUHYCVPYPGYRZ-HNNXBMFYSA-N 2 0 244.382 2.407 20 0 BEADRP C[C@@H]1C[N@H+](Cc2cccc3c2CCC3)CC[C@@H]1[NH3+] ZINC000650703248 410336921 /nfs/dbraw/zinc/33/69/21/410336921.db2.gz QYZUBTWLWWUKFV-WBMJQRKESA-N 2 0 244.382 2.344 20 0 BEADRP CC[C@@H](OCC[NH2+]CCC[NH3+])c1ccccc1 ZINC000650710366 410340258 /nfs/dbraw/zinc/34/02/58/410340258.db2.gz NTYAYDQCNRZOAW-CQSZACIVSA-N 2 0 236.359 2.093 20 0 BEADRP Cc1cccc(C[NH2+]CCC2(C[NH3+])CC2)c1 ZINC000650712311 410342959 /nfs/dbraw/zinc/34/29/59/410342959.db2.gz ZXKUYFSLCAWJNM-UHFFFAOYSA-N 2 0 218.344 2.214 20 0 BEADRP [NH3+]CC1(CC[NH2+]Cc2cc(F)cc(F)c2)CC1 ZINC000650712365 410343207 /nfs/dbraw/zinc/34/32/07/410343207.db2.gz BNRGVXVUJNFRIM-UHFFFAOYSA-N 2 0 240.297 2.183 20 0 BEADRP C[C@H](Cc1ccsc1)[NH2+]CCC1(C[NH3+])CC1 ZINC000650713537 410344767 /nfs/dbraw/zinc/34/47/67/410344767.db2.gz VZGPFNGFPBNSRG-LLVKDONJSA-N 2 0 238.400 2.398 20 0 BEADRP C[C@H]1CCCC[C@@H]1[NH2+]CCC1(C[NH3+])CC1 ZINC000650713059 410345234 /nfs/dbraw/zinc/34/52/34/410345234.db2.gz CNSZOJCUEQZDJR-RYUDHWBXSA-N 2 0 210.365 2.284 20 0 BEADRP C[C@H]1CCC[C@@H]([NH2+]CCC2(C[NH3+])CC2)C1 ZINC000650713316 410351740 /nfs/dbraw/zinc/35/17/40/410351740.db2.gz OGSWNRHXQHKCHH-NWDGAFQWSA-N 2 0 210.365 2.284 20 0 BEADRP C[N@H+](CCC[NH3+])Cc1cccc(C(F)F)c1 ZINC000124800299 410310335 /nfs/dbraw/zinc/31/03/35/410310335.db2.gz ROUGCOBCQJSPIS-UHFFFAOYSA-N 2 0 228.286 2.405 20 0 BEADRP CC(C)C[N@@H+]1CCCC[C@@H]1[C@H]1C[C@H]([NH3+])CCO1 ZINC000650724049 410359368 /nfs/dbraw/zinc/35/93/68/410359368.db2.gz XNCZEOTWMJVPCQ-MGPQQGTHSA-N 2 0 240.391 2.003 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]Cc2ccc(C[NH3+])cc2)C1 ZINC000129446634 410371710 /nfs/dbraw/zinc/37/17/10/410371710.db2.gz IVTUHJFMQDFVBT-RISCZKNCSA-N 2 0 218.344 2.424 20 0 BEADRP C[C@H]([NH2+]CCC1(C[NH3+])CC1)c1ccco1 ZINC000650743035 410378744 /nfs/dbraw/zinc/37/87/44/410378744.db2.gz KVWAIMWGKPFLTD-JTQLQIEISA-N 2 0 208.305 2.059 20 0 BEADRP Cc1ccc([C@H](C)[NH2+]CCC2(C[NH3+])CC2)c(C)n1 ZINC000650746086 410385047 /nfs/dbraw/zinc/38/50/47/410385047.db2.gz VVIFTABRIDGKHG-LBPRGKRZSA-N 2 0 247.386 2.478 20 0 BEADRP [NH3+]CC1(CC[NH2+][C@@H]2CCCc3cccnc32)CC1 ZINC000650746677 410385986 /nfs/dbraw/zinc/38/59/86/410385986.db2.gz IGOXYFOYIMSIIU-CYBMUJFWSA-N 2 0 245.370 2.178 20 0 BEADRP [NH3+]CC1(CC[NH2+][C@@H]2CC[C@@H]2C2CCC2)CC1 ZINC000650747281 410386658 /nfs/dbraw/zinc/38/66/58/410386658.db2.gz WNSQXSYZBMMNCE-CHWSQXEVSA-N 2 0 222.376 2.284 20 0 BEADRP C[C@H]([NH2+]CCC1CC[NH2+]CC1)[C@@H]1CC1(C)C ZINC000650762873 410412302 /nfs/dbraw/zinc/41/23/02/410412302.db2.gz MRFIMEGAQMAPPK-AAEUAGOBSA-N 2 0 224.392 2.400 20 0 BEADRP Cc1cncc([C@H](C)[NH2+]CCC2CC[NH2+]CC2)c1 ZINC000650762473 410412481 /nfs/dbraw/zinc/41/24/81/410412481.db2.gz BEUUWOOLVZZQJN-ZDUSSCGKSA-N 2 0 247.386 2.430 20 0 BEADRP C[C@@H]1C[C@H](C)[N@H+](Cc2cccc(O)c2)C[C@H]1C[NH3+] ZINC000397251757 410535728 /nfs/dbraw/zinc/53/57/28/410535728.db2.gz CWFMYBCJYQGPAS-MBNYWOFBSA-N 2 0 248.370 2.197 20 0 BEADRP CC(C)(C)[NH+]1CCC([NH2+][C@@H]2CCSC2)CC1 ZINC000037786314 166609620 /nfs/dbraw/zinc/60/96/20/166609620.db2.gz HHRRTRSDTTWQBT-GFCCVEGCSA-N 2 0 242.432 2.344 20 0 BEADRP Nc1cccc(C[NH2+][C@H]2CCCCC[C@H]2[NH3+])c1 ZINC000665232821 410724232 /nfs/dbraw/zinc/72/42/32/410724232.db2.gz VCDSEOMOOZVRAP-KGLIPLIRSA-N 2 0 233.359 2.018 20 0 BEADRP CC[C@H](C)CC[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000665237982 410730553 /nfs/dbraw/zinc/73/05/53/410730553.db2.gz OAROAMBFAHULAA-ACJTYDJDSA-N 2 0 210.365 2.295 20 0 BEADRP CC1(C[N@@H+]2C[C@@H]3CCC[C@]3(C[NH3+])C2)CCC1 ZINC000393768389 410759505 /nfs/dbraw/zinc/75/95/05/410759505.db2.gz IDBVNVTVKPWHIT-JSGCOSHPSA-N 2 0 222.376 2.237 20 0 BEADRP CO[C@H](C[NH2+][C@@H]1CCC[C@H]1[NH3+])C1CCCCC1 ZINC000665282857 410762283 /nfs/dbraw/zinc/76/22/83/410762283.db2.gz CVXHHSYHAKOWLD-MGPQQGTHSA-N 2 0 240.391 2.051 20 0 BEADRP CC(C)CC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000020523871 166857083 /nfs/dbraw/zinc/85/70/83/166857083.db2.gz HPDLMMYBHNDDBF-YHWZYXNKSA-N 2 0 210.365 2.247 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+]C(C)C ZINC000019915116 169776699 /nfs/dbraw/zinc/77/66/99/169776699.db2.gz PSDFDIBRBOBBIJ-LBPRGKRZSA-N 2 0 200.370 2.495 20 0 BEADRP CC[C@@H]1CC[C@H](C)C[C@H]1[NH2+][C@H](C)C[NH2+]C ZINC000665297632 410818161 /nfs/dbraw/zinc/81/81/61/410818161.db2.gz JBDIVHPLYZLPHC-UMSGYPCISA-N 2 0 212.381 2.399 20 0 BEADRP CC(C)[NH2+]CCC[NH+]1C[C@H](C)C[C@@H](C)C1 ZINC000037480275 167102079 /nfs/dbraw/zinc/10/20/79/167102079.db2.gz AWKYYQYWSFEXRM-CHWSQXEVSA-N 2 0 212.381 2.352 20 0 BEADRP CC(C)OC[C@H](C)[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000337348894 167263788 /nfs/dbraw/zinc/26/37/88/167263788.db2.gz ZOUZMSAHCWZVNO-ZDUSSCGKSA-N 2 0 242.407 2.262 20 0 BEADRP CC(C)SCC[NH2+][C@H]1CC[N@H+](C)C[C@@H]1C ZINC000308837582 167333567 /nfs/dbraw/zinc/33/35/67/167333567.db2.gz XDZATKQUDSQGQH-RYUDHWBXSA-N 2 0 230.421 2.058 20 0 BEADRP C[N@H+](CCC(C)(C)C)C[C@]1(C)CC[NH2+]C1 ZINC000399794553 411065587 /nfs/dbraw/zinc/06/55/87/411065587.db2.gz VSSFUSIHUKQOGK-CYBMUJFWSA-N 2 0 212.381 2.354 20 0 BEADRP COC[C@H](CC(C)(C)C)[NH2+]CCCC[NH+](C)C ZINC000651691851 411136830 /nfs/dbraw/zinc/13/68/30/411136830.db2.gz JISPWUPPEUTMHJ-ZDUSSCGKSA-N 2 0 244.423 2.369 20 0 BEADRP CCSCC[N@@H+]1C[C@H](C[NH3+])[C@H](C)C[C@H]1C ZINC000397298430 411143325 /nfs/dbraw/zinc/14/33/25/411143325.db2.gz CLOHBHRCMMEOEC-UTUOFQBUSA-N 2 0 230.421 2.045 20 0 BEADRP CC(C)C[N@H+](C)CCC[NH2+]C[C@@H]1C[C@@H]1C ZINC000651865871 411147708 /nfs/dbraw/zinc/14/77/08/411147708.db2.gz KQLCMTSALPHJOK-STQMWFEESA-N 2 0 212.381 2.210 20 0 BEADRP CC(C)C[N@H+](C)CCC[NH2+][C@@H](C)C1CC1 ZINC000651865838 411147951 /nfs/dbraw/zinc/14/79/51/411147951.db2.gz JHYCUFAFQDGMKL-LBPRGKRZSA-N 2 0 212.381 2.352 20 0 BEADRP CC(C)C[N@H+](C)CCC[NH2+][C@@H]1C[C@@H](C)O[C@H]1C ZINC000651864702 411148120 /nfs/dbraw/zinc/14/81/20/411148120.db2.gz BCUGSUZRCUOKDO-HZSPNIEDSA-N 2 0 242.407 2.120 20 0 BEADRP CC(C)C[N@H+](C)CCC[NH2+][C@H](C)C1CC1 ZINC000651865837 411148131 /nfs/dbraw/zinc/14/81/31/411148131.db2.gz JHYCUFAFQDGMKL-GFCCVEGCSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H]([NH3+])C[N@@H+]1CCC[C@H]1CC1CCCC1 ZINC000655949009 411161274 /nfs/dbraw/zinc/16/12/74/411161274.db2.gz KFEUEVRXIMYWLY-AAEUAGOBSA-N 2 0 210.365 2.378 20 0 BEADRP [NH3+]CCOCC[N@@H+]1CCC[C@@H]1CC1CCCC1 ZINC000655949294 411161459 /nfs/dbraw/zinc/16/14/59/411161459.db2.gz SLEKQDAGRWUAIB-CQSZACIVSA-N 2 0 240.391 2.006 20 0 BEADRP CC1([NH3+])CC[NH+](CC2CCCCC2)CC1 ZINC000309384836 411120756 /nfs/dbraw/zinc/12/07/56/411120756.db2.gz DYCVKFDEUHXAGO-UHFFFAOYSA-N 2 0 210.365 2.380 20 0 BEADRP CCSCCC[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000401001769 411162636 /nfs/dbraw/zinc/16/26/36/411162636.db2.gz BUDIUFFGIGYKAL-YNEHKIRRSA-N 2 0 242.432 2.107 20 0 BEADRP C([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)C(C1CC1)C1CC1 ZINC000401020678 411173266 /nfs/dbraw/zinc/17/32/66/411173266.db2.gz KQOXETPTBOKVQR-RBSFLKMASA-N 2 0 248.414 2.400 20 0 BEADRP c1ccc(CC[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)cc1 ZINC000401036494 411173658 /nfs/dbraw/zinc/17/36/58/411173658.db2.gz ZCYSZCNTZSEVKD-HRCADAONSA-N 2 0 244.382 2.207 20 0 BEADRP Cc1ccoc1C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000401120732 411178249 /nfs/dbraw/zinc/17/82/49/411178249.db2.gz JINJAUSTJQXHJH-YNEHKIRRSA-N 2 0 234.343 2.066 20 0 BEADRP COC[C@@H](CC(C)(C)C)[NH2+]C[C@H]([NH3+])CC(C)C ZINC000656193903 411199382 /nfs/dbraw/zinc/19/93/82/411199382.db2.gz XQGRBDAGEUXLOL-CHWSQXEVSA-N 2 0 244.423 2.401 20 0 BEADRP COC[C@H](CC(C)(C)C)[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000656193277 411199385 /nfs/dbraw/zinc/19/93/85/411199385.db2.gz DCFBXLKMKGVBHJ-AVGNSLFASA-N 2 0 242.407 2.297 20 0 BEADRP C[C@@H](Cc1ccccn1)[NH2+]C1CCC(C[NH3+])CC1 ZINC000656193830 411199813 /nfs/dbraw/zinc/19/98/13/411199813.db2.gz VHRZSBQBJYSGKZ-HSBZDZAISA-N 2 0 247.386 2.120 20 0 BEADRP C[C@H](Cc1ccccn1)[NH2+][C@@H](C)C[C@H]1CCC[NH2+]1 ZINC000656193320 411200764 /nfs/dbraw/zinc/20/07/64/411200764.db2.gz GCGODLMABMJLTI-VNHYZAJKSA-N 2 0 247.386 2.133 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCC[C@H]([NH3+])C1)C1CCOCC1 ZINC000656197068 411201685 /nfs/dbraw/zinc/20/16/85/411201685.db2.gz BBEPFJGDOUUTOT-MJBXVCDLSA-N 2 0 240.391 2.051 20 0 BEADRP CCOC1CC(CC[NH2+][C@@H]2CCC[C@H]([NH3+])C2)C1 ZINC000656198664 411203099 /nfs/dbraw/zinc/20/30/99/411203099.db2.gz BVIUKVDUMYHSMH-YIFLHPOLSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCC[C@@H]([NH3+])C1)c1ccncc1 ZINC000656197195 411203159 /nfs/dbraw/zinc/20/31/59/411203159.db2.gz MSSTVDNJGTXELP-MRVWCRGKSA-N 2 0 233.359 2.045 20 0 BEADRP Cc1ccc(C[NH+]2CCC(C)([NH3+])CC2)cc1 ZINC000049816972 411245373 /nfs/dbraw/zinc/24/53/73/411245373.db2.gz SWSCTICVDDWRJO-UHFFFAOYSA-N 2 0 218.344 2.308 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCC[C@H]([NH3+])C1)[C@H]1CCCCO1 ZINC000656201507 411206063 /nfs/dbraw/zinc/20/60/63/411206063.db2.gz QJDWSNIDWIQQFC-RFQIPJPRSA-N 2 0 240.391 2.194 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCC[C@H]1CCC(C)C ZINC000652343454 411208183 /nfs/dbraw/zinc/20/81/83/411208183.db2.gz CAILQHPOIBSEGB-ZDUSSCGKSA-N 2 0 212.381 2.497 20 0 BEADRP C[N@H+](CCOC(C)(C)C)CC[C@@H]1CCC[NH2+]C1 ZINC000652343746 411208488 /nfs/dbraw/zinc/20/84/88/411208488.db2.gz RMDVGQGBGUWJTF-ZDUSSCGKSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@@H]1CN(CC[NH3+])CCc2ccc(Cl)cc21 ZINC000652353594 411212501 /nfs/dbraw/zinc/21/25/01/411212501.db2.gz UGUJWRJOOLXSPO-SNVBAGLBSA-N 2 0 238.762 2.260 20 0 BEADRP CC(C)OCCC[N@@H+]1CCC[C@H](C)[C@H]1CC[NH3+] ZINC000652355012 411215525 /nfs/dbraw/zinc/21/55/25/411215525.db2.gz MRFVCJVZZFABEV-UONOGXRCSA-N 2 0 242.407 2.251 20 0 BEADRP Cc1nccc(N[C@H]2CCC[N@@H+]3CCCC[C@H]23)n1 ZINC000656226191 411215655 /nfs/dbraw/zinc/21/56/55/411215655.db2.gz LLZXDBHCPNDIMN-QWHCGFSZSA-N 2 0 246.358 2.214 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H]2CCCSCC2)C1 ZINC000658048673 411218196 /nfs/dbraw/zinc/21/81/96/411218196.db2.gz WTAMRESYNHJQHS-RWMBFGLXSA-N 2 0 242.432 2.202 20 0 BEADRP C(CC1CC[NH2+]CC1)[NH2+]C(C1CC1)C1CC1 ZINC000049237887 411229613 /nfs/dbraw/zinc/22/96/13/411229613.db2.gz MPLUGUSHRSVCCU-UHFFFAOYSA-N 2 0 222.376 2.154 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@@H]1Cc2ccccc21 ZINC000310272091 411231774 /nfs/dbraw/zinc/23/17/74/411231774.db2.gz NQUXHGOUWRGMIX-OCCSQVGLSA-N 2 0 232.371 2.433 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CCCOC1CCCC1 ZINC000422826965 411232731 /nfs/dbraw/zinc/23/27/31/411232731.db2.gz MDDJJZSOVJBEPB-GFCCVEGCSA-N 2 0 228.380 2.053 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)Cc1ccc(O)cc1)[C@@H]1CCC[NH2+]1 ZINC000422976106 411234566 /nfs/dbraw/zinc/23/45/66/411234566.db2.gz UQISMFQKNZFOSB-ZOWXZIJZSA-N 2 0 248.370 2.053 20 0 BEADRP CC(C)[C@@H]1CCCC[C@H]1[NH2+]CC1C[NH2+]C1 ZINC000423307027 411238582 /nfs/dbraw/zinc/23/85/82/411238582.db2.gz UZKLMJWBWFGPAN-QWHCGFSZSA-N 2 0 210.365 2.010 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000400880756 411165637 /nfs/dbraw/zinc/16/56/37/411165637.db2.gz ANEQHHFHHSUBPN-IKOXMDCHSA-N 2 0 222.376 2.010 20 0 BEADRP CCC(CC)C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000400969777 411166587 /nfs/dbraw/zinc/16/65/87/411166587.db2.gz OTVSBKPRWGPZMY-BFHYXJOUSA-N 2 0 224.392 2.400 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)cc1 ZINC000400960633 411167622 /nfs/dbraw/zinc/16/76/22/411167622.db2.gz BMVQQTDJGRJFPO-HRCADAONSA-N 2 0 244.382 2.473 20 0 BEADRP CC(C)C[NH+](CC(C)C)C[C@H]1CC[NH2+]C1 ZINC000051889595 411284657 /nfs/dbraw/zinc/28/46/57/411284657.db2.gz NFJJCXRWLCVPEW-ZDUSSCGKSA-N 2 0 212.381 2.210 20 0 BEADRP CC[C@@H]1CCC[N@H+](C[C@@H]2CC[NH2+]C2)CC1 ZINC000070652737 411284784 /nfs/dbraw/zinc/28/47/84/411284784.db2.gz KDPTYCOQBZDIDX-CHWSQXEVSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@H]1CC[C@H]([NH2+]Cc2ccc(C[NH3+])cc2)C1 ZINC000129446885 411287811 /nfs/dbraw/zinc/28/78/11/411287811.db2.gz IVTUHJFMQDFVBT-FZMZJTMJSA-N 2 0 218.344 2.424 20 0 BEADRP C[C@@H]([NH2+]CCC(C)(C)F)C1CC[NH+](C)CC1 ZINC000658193020 411288371 /nfs/dbraw/zinc/28/83/71/411288371.db2.gz RQRXWIMGPCCSGV-LLVKDONJSA-N 2 0 230.371 2.445 20 0 BEADRP Cc1[nH+]ccc(N[C@H]2CCC[C@@H]([NH3+])C2)c1Cl ZINC000382452469 411290461 /nfs/dbraw/zinc/29/04/61/411290461.db2.gz NYZCYJUFSMXAEV-ZJUUUORDSA-N 2 0 239.750 2.147 20 0 BEADRP C[C@H]([NH2+]C[C@@]1(C)CC1(F)F)C1CC[NH+](C)CC1 ZINC000658217291 411296772 /nfs/dbraw/zinc/29/67/72/411296772.db2.gz FXIDYWJEBMWCRN-CMPLNLGQSA-N 2 0 246.345 2.352 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC[C@@]2(C)CC2(F)F)CC[N@@H+]1C ZINC000658223090 411302447 /nfs/dbraw/zinc/30/24/47/411302447.db2.gz SKGZFQSBBJGRJY-UTUOFQBUSA-N 2 0 246.345 2.494 20 0 BEADRP [NH3+]C[C@]12CCC[C@H]1C[N@H+](CC1CCCC1)C2 ZINC000309411638 411306890 /nfs/dbraw/zinc/30/68/90/411306890.db2.gz GFCLDGVTJNZSPP-KBPBESRZSA-N 2 0 222.376 2.237 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@H]2C(C)(C)C2(F)F)CC1 ZINC000658282067 411321740 /nfs/dbraw/zinc/32/17/40/411321740.db2.gz DTHSQJLSIUATEJ-NSHDSACASA-N 2 0 246.345 2.352 20 0 BEADRP Cc1ccncc1CC[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000658127168 411254242 /nfs/dbraw/zinc/25/42/42/411254242.db2.gz SEFHSWLNTFSASC-HIFRSBDPSA-N 2 0 247.386 2.005 20 0 BEADRP C[C@H](C[C@@H]1CCC[NH2+]1)[NH2+]C[C@@H](C)c1ccccn1 ZINC000656782019 411360129 /nfs/dbraw/zinc/36/01/29/411360129.db2.gz CQPFEEXOGQDTOR-MCIONIFRSA-N 2 0 247.386 2.305 20 0 BEADRP C[C@@H](C[NH2+]C[C@H]1CC[NH2+][C@H](C)C1)c1ccccn1 ZINC000656783645 411360990 /nfs/dbraw/zinc/36/09/90/411360990.db2.gz SDQVNSYKGNLUSH-MJBXVCDLSA-N 2 0 247.386 2.163 20 0 BEADRP Cc1ccc2c(c1)C[N@@H+](C[C@H]1CCC[NH2+]C1)CC2 ZINC000656786896 411366568 /nfs/dbraw/zinc/36/65/68/411366568.db2.gz CZBSWJSDWHXYNN-AWEZNQCLSA-N 2 0 244.382 2.353 20 0 BEADRP Cc1ccccc1C[NH2+]CC1([NH3+])CCCC1 ZINC000656788089 411368142 /nfs/dbraw/zinc/36/81/42/411368142.db2.gz BDYALYOHNOLLLE-UHFFFAOYSA-N 2 0 218.344 2.356 20 0 BEADRP CC(C)[C@@H]1C[C@H]([NH2+]CC2([NH3+])CCCC2)CCO1 ZINC000656789276 411369207 /nfs/dbraw/zinc/36/92/07/411369207.db2.gz LEKDXBAPUSROAY-OLZOCXBDSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2CCC[C@H](CCF)C2)CC[NH2+]1 ZINC000656790833 411369977 /nfs/dbraw/zinc/36/99/77/411369977.db2.gz BITBVESPENEHOB-MGPQQGTHSA-N 2 0 242.382 2.446 20 0 BEADRP CC1(C)CC[N@H+](CCC[NH3+])CC(C)(C)C1 ZINC000656790740 411370986 /nfs/dbraw/zinc/37/09/86/411370986.db2.gz MRUOMLVKZHEJSB-UHFFFAOYSA-N 2 0 212.381 2.483 20 0 BEADRP COc1cccc([C@]2(C)CC[N@H+](CCC[NH3+])C2)c1 ZINC000656791421 411371262 /nfs/dbraw/zinc/37/12/62/411371262.db2.gz GACHHSWXKYBLAA-OAHLLOKOSA-N 2 0 248.370 2.007 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CCCc2ccco2)CC[N@@H+]1C ZINC000658327782 411336132 /nfs/dbraw/zinc/33/61/32/411336132.db2.gz RKCPLCCSXOPDOO-STQMWFEESA-N 2 0 236.359 2.285 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CC[C@H]2C[C@H]2C1 ZINC000403423587 411345385 /nfs/dbraw/zinc/34/53/85/411345385.db2.gz WQPFKCGNXXQKDQ-YHQUGGNUSA-N 2 0 222.376 2.282 20 0 BEADRP CC1=C[C@@H](C)C[C@@H](C[N@H+]2C[C@H]3C[NH+](C)C[C@H]3C2)C1 ZINC000368122138 168124325 /nfs/dbraw/zinc/12/43/25/168124325.db2.gz JRXNXWFSZXHSLI-MIGQKNRLSA-N 2 0 248.414 2.472 20 0 BEADRP CC1CCC([N@H+](C)C[C@@H]2CCC[NH2+]C2)CC1 ZINC000042488229 168158294 /nfs/dbraw/zinc/15/82/94/168158294.db2.gz ZWLVDNURTGPVTO-ROKHWSDSSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1cccnc1C[N@H+]1CCC[C@H](C)[C@@H]1CC[NH3+] ZINC000404286481 411388637 /nfs/dbraw/zinc/38/86/37/411388637.db2.gz IFRGYDIYQKEJGH-ZFWWWQNUSA-N 2 0 247.386 2.339 20 0 BEADRP CC[C@@H]1C[C@@H]([NH2+]CC(C)(C)C[NH+](C)C)CCO1 ZINC000070343396 411389805 /nfs/dbraw/zinc/38/98/05/411389805.db2.gz KLCHLWWGZSBVCS-QWHCGFSZSA-N 2 0 242.407 2.121 20 0 BEADRP CCN1CCC[C@@H]([NH2+][C@@H]2CCOC(C)(C)C2)C1 ZINC000070359361 411411454 /nfs/dbraw/zinc/41/14/54/411411454.db2.gz GPUBIGUXCZIKMP-CHWSQXEVSA-N 2 0 240.391 2.018 20 0 BEADRP FC1(F)CC12CC[NH+](CC1CC[NH2+]CC1)CC2 ZINC000405048535 411414390 /nfs/dbraw/zinc/41/43/90/411414390.db2.gz GOOKGEVGOBHSHG-UHFFFAOYSA-N 2 0 244.329 2.107 20 0 BEADRP C[C@H](CCc1ccccc1F)[NH2+]CC[C@H](C)[NH3+] ZINC000414823049 411448550 /nfs/dbraw/zinc/44/85/50/411448550.db2.gz OCVJSKPGTWPYFB-NWDGAFQWSA-N 2 0 238.350 2.474 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H](C)CCc1ccccc1F ZINC000414823051 411448829 /nfs/dbraw/zinc/44/88/29/411448829.db2.gz OCVJSKPGTWPYFB-RYUDHWBXSA-N 2 0 238.350 2.474 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H]2CO[C@H](CC)C2)CC1 ZINC000657294024 411450719 /nfs/dbraw/zinc/45/07/19/411450719.db2.gz AHVGVGGPEYOXSV-ZIAGYGMSSA-N 2 0 240.391 2.018 20 0 BEADRP CC[C@@H]1C[C@@H]([NH2+]CCC[NH+]2CCCCC2)CO1 ZINC000657296470 411454169 /nfs/dbraw/zinc/45/41/69/411454169.db2.gz VCQAYWBDWOLURM-ZIAGYGMSSA-N 2 0 240.391 2.020 20 0 BEADRP Fc1cccc(C[NH2+]CCC[C@@H]2CCC[NH2+]2)c1 ZINC000414970177 411476700 /nfs/dbraw/zinc/47/67/00/411476700.db2.gz KCLWJGGIXZSCBF-CQSZACIVSA-N 2 0 236.334 2.448 20 0 BEADRP C[C@@H](CC1CC1)[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000415011673 411488099 /nfs/dbraw/zinc/48/80/99/411488099.db2.gz RFOSTJNMCACCSP-LEWSCRJBSA-N 2 0 222.376 2.153 20 0 BEADRP C[NH+](C)[C@H]1CCC[N@H+](Cc2cccc(N)c2)CC1 ZINC000660415696 411489296 /nfs/dbraw/zinc/48/92/96/411489296.db2.gz IAZCUIFDEUOELQ-HNNXBMFYSA-N 2 0 247.386 2.185 20 0 BEADRP C[NH+](C)C[C@@H]1CC[N@H+](CCCC2CCC2)C1 ZINC000659927376 411500636 /nfs/dbraw/zinc/50/06/36/411500636.db2.gz QDFDQBYIIFWQOO-AWEZNQCLSA-N 2 0 224.392 2.450 20 0 BEADRP CC(C)C1CC([NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)C1 ZINC000655803635 411518894 /nfs/dbraw/zinc/51/88/94/411518894.db2.gz APKHKOJMAHKGGQ-AJNFDDFZSA-N 2 0 224.392 2.351 20 0 BEADRP CC[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)C1CC1 ZINC000655805376 411519682 /nfs/dbraw/zinc/51/96/82/411519682.db2.gz GWTUGBPQYPEDMX-KGYLQXTDSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1cccnc1 ZINC000655804938 411519787 /nfs/dbraw/zinc/51/97/87/411519787.db2.gz GRMSXZOZEIPZQD-SGMGOOAPSA-N 2 0 233.359 2.072 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1cncs1 ZINC000655805777 411520265 /nfs/dbraw/zinc/52/02/65/411520265.db2.gz LAFBGVLKURWYNJ-MXWKQRLJSA-N 2 0 239.388 2.134 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1ccoc1 ZINC000655806252 411520391 /nfs/dbraw/zinc/52/03/91/411520391.db2.gz SQQCIMQWNYWPNT-GMXVVIOVSA-N 2 0 222.332 2.270 20 0 BEADRP C[C@@H](CC1CCC1)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655806290 411520669 /nfs/dbraw/zinc/52/06/69/411520669.db2.gz UKSTWJFOGFGGAA-FPMFFAJLSA-N 2 0 224.392 2.495 20 0 BEADRP CC[C@@H]1C[C@@H]([NH2+]CCCC[N@H+](C)C2CC2)CO1 ZINC000657486956 411530880 /nfs/dbraw/zinc/53/08/80/411530880.db2.gz CZBANEWYWZJAPV-TZMCWYRMSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@H](Cc1ccccn1)[NH2+][C@@H]1CCN(C)[C@@H](C)C1 ZINC000655836749 411532274 /nfs/dbraw/zinc/53/22/74/411532274.db2.gz NXLOXLSDMFTHBI-VNHYZAJKSA-N 2 0 247.386 2.085 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+]C2Cc3ccccc3C2)C1 ZINC000037644339 170015038 /nfs/dbraw/zinc/01/50/38/170015038.db2.gz GEFJXUDRFAQSQY-CYBMUJFWSA-N 2 0 244.382 2.085 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H]2CC[C@H]2C2CCC2)C1 ZINC000337983866 170016335 /nfs/dbraw/zinc/01/63/35/170016335.db2.gz CHLOFLOWKSSAKB-SNPRPXQTSA-N 2 0 236.403 2.497 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2ccncc2)C1 ZINC000249379253 170016450 /nfs/dbraw/zinc/01/64/50/170016450.db2.gz OJIFYRBJJVRVRB-CHWSQXEVSA-N 2 0 233.359 2.074 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2cccnc2)C1 ZINC000249374139 170016645 /nfs/dbraw/zinc/01/66/45/170016645.db2.gz HHPYPQBUVMMREZ-CHWSQXEVSA-N 2 0 233.359 2.074 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH+](C)CCCF)C[C@H]1C ZINC000361531315 170018792 /nfs/dbraw/zinc/01/87/92/170018792.db2.gz QMBOCIBSSPMMAH-NEPJUHHUSA-N 2 0 216.344 2.151 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CC[C@@H](C)F)[C@@H](C)C1 ZINC000340463549 170020260 /nfs/dbraw/zinc/02/02/60/170020260.db2.gz QZLHYIHRLQPKFO-TUAOUCFPSA-N 2 0 216.344 2.054 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CCSC(C)C)[C@@H](C)C1 ZINC000336780278 170020427 /nfs/dbraw/zinc/02/04/27/170020427.db2.gz QTCMVVZOZIOSDP-STQMWFEESA-N 2 0 244.448 2.448 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CC[C@@H](C)F)[C@H](C)C1 ZINC000340463551 170020724 /nfs/dbraw/zinc/02/07/24/170020724.db2.gz QZLHYIHRLQPKFO-UTUOFQBUSA-N 2 0 216.344 2.054 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H]2CC[C@H]2C)[C@@H](C)C1 ZINC000336746414 170022916 /nfs/dbraw/zinc/02/29/16/170022916.db2.gz BKLBCAXYAGYYME-XQHKEYJVSA-N 2 0 210.365 2.105 20 0 BEADRP CC[N@@H+]1C[C@@H]2CC[NH+](Cc3ccccc3)C[C@@H]2C1 ZINC000307624119 170040932 /nfs/dbraw/zinc/04/09/32/170040932.db2.gz FJTSJNSPVZSZPB-HOTGVXAUSA-N 2 0 244.382 2.460 20 0 BEADRP CCOCCC[N@H+](C)[C@H]1CC[NH+](CC)C[C@@H]1C ZINC000336704644 170370103 /nfs/dbraw/zinc/37/01/03/170370103.db2.gz NGDYDAGNDIHZIE-KBPBESRZSA-N 2 0 242.407 2.075 20 0 BEADRP CCOCCC[N@H+](C)[C@@H]1CC[NH+](CC)[C@@H](C)C1 ZINC000336708425 170370274 /nfs/dbraw/zinc/37/02/74/170370274.db2.gz HYBIOIAXSRUMFK-UONOGXRCSA-N 2 0 242.407 2.218 20 0 BEADRP CCOCCC[N@H+](C)[C@@H]1CC[NH+](CC)C[C@H]1C ZINC000336704649 170370367 /nfs/dbraw/zinc/37/03/67/170370367.db2.gz NGDYDAGNDIHZIE-ZIAGYGMSSA-N 2 0 242.407 2.075 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)C1CC1 ZINC000663346265 411634221 /nfs/dbraw/zinc/63/42/21/411634221.db2.gz RUJBOCFBQVTNAD-OCCSQVGLSA-N 2 0 236.403 2.497 20 0 BEADRP Cc1ncc(C[NH2+]C(C)(C2CC2)C2CC2)n1C ZINC000657754733 411590399 /nfs/dbraw/zinc/59/03/99/411590399.db2.gz CNHDENJQWPWMHD-UHFFFAOYSA-N 2 0 233.359 2.397 20 0 BEADRP C[NH+](C)CCC[NH2+][C@H]1[C@@H]2CCC[C@@H]2C1(C)C ZINC000657818333 411605849 /nfs/dbraw/zinc/60/58/49/411605849.db2.gz SNDCAIUXFFAPNR-AGIUHOORSA-N 2 0 224.392 2.352 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H]1COC2(CCC2)C1 ZINC000657818671 411605981 /nfs/dbraw/zinc/60/59/81/411605981.db2.gz WSVJIVGSAPVBBB-CYBMUJFWSA-N 2 0 240.391 2.020 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+]C1CC(CF)(CF)C1 ZINC000657857645 411612690 /nfs/dbraw/zinc/61/26/90/411612690.db2.gz AZFAJEFVPGOBFT-JTQLQIEISA-N 2 0 234.334 2.004 20 0 BEADRP CCC1CCC([NH2+]CC23CC(C2)C[NH2+]3)CC1 ZINC000663497115 411674835 /nfs/dbraw/zinc/67/48/35/411674835.db2.gz BYOVPAQMBMKDRP-UHFFFAOYSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H](CCC(F)(F)F)[NH2+]CC12CC(C1)C[NH2+]2 ZINC000663497590 411679541 /nfs/dbraw/zinc/67/95/41/411679541.db2.gz HTFNFLVERWUXNM-IDKOKCKLSA-N 2 0 236.281 2.059 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]CC23CC(C2)C[NH2+]3)[C@H]1C ZINC000663497078 411679865 /nfs/dbraw/zinc/67/98/65/411679865.db2.gz BDMVKBJVQPCNAQ-IGYKFCIQSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CC23CC(C2)C[NH2+]3)C[C@@H]1C ZINC000663498140 411680779 /nfs/dbraw/zinc/68/07/79/411680779.db2.gz MHYQOJRPTLDHSS-IGYKFCIQSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CC23CC(C2)C[NH2+]3)C[C@@H](C)C1 ZINC000663498336 411681745 /nfs/dbraw/zinc/68/17/45/411681745.db2.gz OURDELYRLSLSEO-KWPGZKHISA-N 2 0 222.376 2.153 20 0 BEADRP CC(C)C[C@@H](C)[NH2+]CC[C@@H]([NH3+])C(C)C ZINC000663500372 411682988 /nfs/dbraw/zinc/68/29/88/411682988.db2.gz QKIBUJUTZXLMPU-VXGBXAGGSA-N 2 0 200.370 2.384 20 0 BEADRP C[C@@H](C[NH2+]CC12CC(C1)C[NH2+]2)C(C)(C)C ZINC000663501493 411686201 /nfs/dbraw/zinc/68/62/01/411686201.db2.gz WMSCHKBDXFZGSX-ZBOXLXRLSA-N 2 0 210.365 2.010 20 0 BEADRP CC[C@@H]1CCC[C@H](C[NH2+][C@@H](C)C[NH2+]C)C1 ZINC000663509431 411689918 /nfs/dbraw/zinc/68/99/18/411689918.db2.gz KJZZZCXZHMZLNL-XQQFMLRXSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H](CNc1[nH+]ccc2[nH]ccc21)C[NH+](C)C ZINC000663931098 411780459 /nfs/dbraw/zinc/78/04/59/411780459.db2.gz HWMAKBFGQPEQTL-JTQLQIEISA-N 2 0 232.331 2.173 20 0 BEADRP CC[C@@H](C)[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000309092772 170750572 /nfs/dbraw/zinc/75/05/72/170750572.db2.gz CSIRHZNFWZESMV-LLVKDONJSA-N 2 0 210.365 2.249 20 0 BEADRP CC[C@@H]([NH2+]CCCC[NH+](C)C)C(C)C ZINC000045664037 170893771 /nfs/dbraw/zinc/89/37/71/170893771.db2.gz TVZLLLKBPUGYMD-GFCCVEGCSA-N 2 0 200.370 2.352 20 0 BEADRP CO[C@@H](CN1CCC[C@@H]([NH3+])C1)C1CCCCC1 ZINC000662235336 412033701 /nfs/dbraw/zinc/03/37/01/412033701.db2.gz QOFLJDLDHOEXEU-KGLIPLIRSA-N 2 0 240.391 2.005 20 0 BEADRP CO[C@H](CN1CCC[C@H]([NH3+])C1)C1CCCCC1 ZINC000662235337 412034178 /nfs/dbraw/zinc/03/41/78/412034178.db2.gz QOFLJDLDHOEXEU-UONOGXRCSA-N 2 0 240.391 2.005 20 0 BEADRP CC[C@H](CC(F)F)C[N@@H+]1CC[C@H](C[NH2+]C)C1 ZINC000662244105 412038953 /nfs/dbraw/zinc/03/89/53/412038953.db2.gz BUEQYIWFVWSILS-GHMZBOCLSA-N 2 0 234.334 2.209 20 0 BEADRP CC(C)=CCC[NH+]1CCC([C@@H](C)[NH3+])CC1 ZINC000662246808 412042871 /nfs/dbraw/zinc/04/28/71/412042871.db2.gz SAFXRZJMQJWFGM-GFCCVEGCSA-N 2 0 210.365 2.402 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CCCN(Cc2cc(C3CC3)no2)C1 ZINC000662247414 412044793 /nfs/dbraw/zinc/04/47/93/412044793.db2.gz XVIKZPGJBBTJOT-CMPLNLGQSA-N 2 0 249.358 2.111 20 0 BEADRP C[C@@H]([NH3+])[C@H]1CCCN(Cc2cc(C3CC3)no2)C1 ZINC000662247418 412045150 /nfs/dbraw/zinc/04/51/50/412045150.db2.gz XVIKZPGJBBTJOT-PWSUYJOCSA-N 2 0 249.358 2.111 20 0 BEADRP C[N@H+](CCC[NH3+])CC[C@@H]1CCc2ccccc21 ZINC000662247467 412045315 /nfs/dbraw/zinc/04/53/15/412045315.db2.gz ZGIPODSWMJCCGY-AWEZNQCLSA-N 2 0 232.371 2.387 20 0 BEADRP CO[C@H](C[NH2+][C@](C)(C[NH3+])C(C)C)C1CCCC1 ZINC000662248711 412046423 /nfs/dbraw/zinc/04/64/23/412046423.db2.gz BLKOLIGCVNBZDZ-ZIAGYGMSSA-N 2 0 242.407 2.155 20 0 BEADRP CC(C)[C@H]([NH3+])CC[N@H+](C)C[C@@H]1C[C@H]2C[C@H]2C1 ZINC000662248015 412047705 /nfs/dbraw/zinc/04/77/05/412047705.db2.gz QWTGXOVNRDPFHI-XJFOESAGSA-N 2 0 224.392 2.338 20 0 BEADRP C[N@H+](C[C@@H]1C[C@H]2C[C@H]2C1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000662263761 412055633 /nfs/dbraw/zinc/05/56/33/412055633.db2.gz DTVFTZAYSQBTMK-YZIJQKGNSA-N 2 0 234.387 2.247 20 0 BEADRP CC[C@H](CC(F)F)C[N@@H+]1C[C@@H](C[NH3+])C[C@H]1C ZINC000662263447 412056197 /nfs/dbraw/zinc/05/61/97/412056197.db2.gz BHSBLUQHHPYEKX-GMTAPVOTSA-N 2 0 234.334 2.337 20 0 BEADRP CC[C@@H]1CC[C@@H](C)[N@@H+]1CC[C@@H]1CC[NH2+]C1 ZINC000136234206 171038482 /nfs/dbraw/zinc/03/84/82/171038482.db2.gz PPSWVQXXPHDNNZ-FRRDWIJNSA-N 2 0 210.365 2.249 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]CCCn1ccnc1C ZINC000310010550 171042030 /nfs/dbraw/zinc/04/20/30/171042030.db2.gz ILIXYWFWFMLTJU-OLZOCXBDSA-N 2 0 221.348 2.360 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]C[C@@H](C)C[NH+]1CCCC1 ZINC000309448321 171043849 /nfs/dbraw/zinc/04/38/49/171043849.db2.gz KLIBXGDXHUCYLI-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000309612746 171044909 /nfs/dbraw/zinc/04/49/09/171044909.db2.gz AQWVQYUFZYSFPU-MQYQWHSLSA-N 2 0 222.376 2.391 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000309612750 171045491 /nfs/dbraw/zinc/04/54/91/171045491.db2.gz AQWVQYUFZYSFPU-RQJABVFESA-N 2 0 222.376 2.391 20 0 BEADRP CC1([NH3+])CC[NH+](C[C@@H]2CC[C@H]3C[C@H]3C2)CC1 ZINC000662271536 412063792 /nfs/dbraw/zinc/06/37/92/412063792.db2.gz VZZYLULZDNKIOI-FRRDWIJNSA-N 2 0 222.376 2.236 20 0 BEADRP C[C@@H]1CC[N@H+](CCCC2CCC2)C[C@@H]1C[NH3+] ZINC000662280468 412071078 /nfs/dbraw/zinc/07/10/78/412071078.db2.gz FBDDGEJABNCNTD-OCCSQVGLSA-N 2 0 224.392 2.483 20 0 BEADRP C[C@H]1C[C@@H]([NH3+])CC[N@@H+]1CCCC1CCC1 ZINC000662284749 412076695 /nfs/dbraw/zinc/07/66/95/412076695.db2.gz PGFADEHBDLHCQR-AAEUAGOBSA-N 2 0 210.365 2.378 20 0 BEADRP CO[C@@H](C[NH2+][C@@H]1CCCC[C@H]1[NH3+])C1CCCC1 ZINC000662283074 412074722 /nfs/dbraw/zinc/07/47/22/412074722.db2.gz KIRVDLRDRTVVLY-MCIONIFRSA-N 2 0 240.391 2.051 20 0 BEADRP CC[C@H](C)C[C@@H](C)[NH2+][C@H](CCC[NH3+])COC ZINC000300024074 171295293 /nfs/dbraw/zinc/29/52/93/171295293.db2.gz JVNOBQFSYGXVFK-YNEHKIRRSA-N 2 0 230.396 2.155 20 0 BEADRP CC[C@H](C[C@@H](C)CC)[NH2+]CCN(C)C ZINC000019266307 171295894 /nfs/dbraw/zinc/29/58/94/171295894.db2.gz VSOZEDLIDKKJEG-NWDGAFQWSA-N 2 0 200.370 2.352 20 0 BEADRP C[C@H]1CCC[N@H+](CC2CC=CC2)[C@H]1CC[NH3+] ZINC000662285850 412078568 /nfs/dbraw/zinc/07/85/68/412078568.db2.gz NSCGGZTULOXDKW-JSGCOSHPSA-N 2 0 222.376 2.402 20 0 BEADRP CC[C@H](C)[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000309092773 171340277 /nfs/dbraw/zinc/34/02/77/171340277.db2.gz CSIRHZNFWZESMV-NSHDSACASA-N 2 0 210.365 2.249 20 0 BEADRP C[N@H+](CCCc1cccc(F)c1)CC(C)(C)[NH3+] ZINC000662294228 412081325 /nfs/dbraw/zinc/08/13/25/412081325.db2.gz JSFJUQUOCMRWJW-UHFFFAOYSA-N 2 0 238.350 2.427 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+]C[C@@H](C)C[NH+](C)C ZINC000336681996 171388978 /nfs/dbraw/zinc/38/89/78/171388978.db2.gz HZZLKXLCXJBUOL-WOPDTQHZSA-N 2 0 200.370 2.208 20 0 BEADRP c1coc(C2CC[NH+](C[C@H]3CC[NH2+]C3)CC2)c1 ZINC000662299248 412086556 /nfs/dbraw/zinc/08/65/56/412086556.db2.gz WAKBEKORNFEQNY-LBPRGKRZSA-N 2 0 234.343 2.069 20 0 BEADRP C([C@@H]1CC[NH2+]C1)[NH+]1CCC(C2CCC2)CC1 ZINC000662298722 412086709 /nfs/dbraw/zinc/08/67/09/412086709.db2.gz FUBFIMSOULDARW-GFCCVEGCSA-N 2 0 222.376 2.108 20 0 BEADRP C[NH2+]CCC[NH+]1CCC(C2CCC2)CC1 ZINC000662298781 412087559 /nfs/dbraw/zinc/08/75/59/412087559.db2.gz GQLTXEABTOMEFQ-UHFFFAOYSA-N 2 0 210.365 2.108 20 0 BEADRP COc1cccc([C@H](C)N2CC3CC2(C[NH3+])C3)c1 ZINC000662304392 412089379 /nfs/dbraw/zinc/08/93/79/412089379.db2.gz QPGPEXSQUIKTLY-BZUNDVKYSA-N 2 0 246.354 2.179 20 0 BEADRP FCC[C@H]1CCC[N@H+](CCC2CC[NH2+]CC2)C1 ZINC000662310625 412094689 /nfs/dbraw/zinc/09/46/89/412094689.db2.gz LSYHKHFZOQLDIG-CQSZACIVSA-N 2 0 242.382 2.448 20 0 BEADRP C(CC1CC[NH2+]CC1)C[N@@H+]1CC[C@@H]2C[C@@H]2C1 ZINC000662316309 412098578 /nfs/dbraw/zinc/09/85/78/412098578.db2.gz ZOJKMASOOSXINP-ZIAGYGMSSA-N 2 0 222.376 2.108 20 0 BEADRP CCC[C@@H](C)[N@@H+]1CCO[C@@H](CCC[NH+](C)C)C1 ZINC000662322521 412101027 /nfs/dbraw/zinc/10/10/27/412101027.db2.gz ILIBASPUKWGJOT-KGLIPLIRSA-N 2 0 242.407 2.218 20 0 BEADRP CCc1ccccc1CN1CC[C@@H](F)[C@H]([NH3+])C1 ZINC000662325223 412103826 /nfs/dbraw/zinc/10/38/26/412103826.db2.gz DCSCYPVAGDZBLG-ZIAGYGMSSA-N 2 0 236.334 2.120 20 0 BEADRP C[N@H+](CCC1CC[NH2+]CC1)C[C@@H]1CC1(C)C ZINC000662330246 412104324 /nfs/dbraw/zinc/10/43/24/412104324.db2.gz CUVDQWCSIGWQLR-ZDUSSCGKSA-N 2 0 224.392 2.354 20 0 BEADRP C[NH2+]CCC[N@@H+]1CC2CC1(c1ccccc1)C2 ZINC000662326999 412104427 /nfs/dbraw/zinc/10/44/27/412104427.db2.gz CZODAPKYVSYPER-UHFFFAOYSA-N 2 0 230.355 2.217 20 0 BEADRP C[N@H+](CC[C@@H]1CCC[NH2+]C1)C[C@H]1CC1(C)C ZINC000662331578 412105319 /nfs/dbraw/zinc/10/53/19/412105319.db2.gz NRLNLXGRGYMEPO-QWHCGFSZSA-N 2 0 224.392 2.354 20 0 BEADRP CCC(C)(C)[C@@H](C)[NH2+][C@@H](CCC[NH3+])COC ZINC000665235858 412175126 /nfs/dbraw/zinc/17/51/26/412175126.db2.gz BELHRKFYSDBIMF-NEPJUHHUSA-N 2 0 230.396 2.155 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)C1CCC(F)CC1)C1C[NH2+]C1 ZINC000665274647 412214473 /nfs/dbraw/zinc/21/44/73/412214473.db2.gz VCXNTVYCGVGDMI-KIENENRBSA-N 2 0 228.355 2.101 20 0 BEADRP C[C@@H]([NH2+]Cc1ccc2occc2c1)C1C[NH2+]C1 ZINC000665238448 412179197 /nfs/dbraw/zinc/17/91/97/412179197.db2.gz YSYBTJBUJBEQTA-SNVBAGLBSA-N 2 0 230.311 2.130 20 0 BEADRP Cc1ccncc1CC[NH2+][C@@H]1CCCC[C@H]1C[NH3+] ZINC000665239751 412179707 /nfs/dbraw/zinc/17/97/07/412179707.db2.gz YNVZVJKNOIVKDU-DZGCQCFKSA-N 2 0 247.386 2.040 20 0 BEADRP Cc1ccncc1CC[NH2+][C@H]1CCCCC[C@@H]1[NH3+] ZINC000665239019 412181577 /nfs/dbraw/zinc/18/15/77/412181577.db2.gz KGJYFWYXDDQNTO-GJZGRUSLSA-N 2 0 247.386 2.182 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[NH2+]C1)[C@@H]1CCCC[C@H]1C ZINC000665241684 412184872 /nfs/dbraw/zinc/18/48/72/412184872.db2.gz WCBMGJYZCRCOOK-MROQNXINSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]([NH2+][C@@H]1Cc2ccccc2[C@@H]1C)[C@H]1CCC[NH2+]1 ZINC000665244151 412186940 /nfs/dbraw/zinc/18/69/40/412186940.db2.gz HHLMCWWZTPDTQX-UAXWRAGISA-N 2 0 244.382 2.445 20 0 BEADRP C[C@@H](Cc1ccoc1)[NH2+]CC1([NH3+])CCCC1 ZINC000665246344 412190497 /nfs/dbraw/zinc/19/04/97/412190497.db2.gz CHDHISTVMJKHAY-NSHDSACASA-N 2 0 222.332 2.072 20 0 BEADRP CC[C@H]([NH2+]CC1([NH3+])CCCC1)[C@H]1C[C@H]1C ZINC000665246426 412191519 /nfs/dbraw/zinc/19/15/19/412191519.db2.gz FLLBUJPWUDLUET-WOPDTQHZSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+]C1(C[NH2+][C@H](C2CC2)C2CCC2)CCCC1 ZINC000665247176 412193265 /nfs/dbraw/zinc/19/32/65/412193265.db2.gz XFUCTNHASCSZDK-ZDUSSCGKSA-N 2 0 222.376 2.426 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+]CC1([NH3+])CCCC1 ZINC000665249277 412195126 /nfs/dbraw/zinc/19/51/26/412195126.db2.gz MKUZLENVDJAEBS-NEPJUHHUSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@H]([NH2+]CC1([NH3+])CCCC1)C1CCCC1 ZINC000665249784 412195477 /nfs/dbraw/zinc/19/54/77/412195477.db2.gz ZFCAIGHOTSQQTH-NSHDSACASA-N 2 0 210.365 2.426 20 0 BEADRP CC[C@H]([NH2+]CCC(C)(C)F)[C@@H]1CCC[NH2+]1 ZINC000665262312 412205028 /nfs/dbraw/zinc/20/50/28/412205028.db2.gz YHZGTWNAGKNKCL-QWRGUYRKSA-N 2 0 216.344 2.245 20 0 BEADRP CC(C)(F)CC[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000665262350 412205440 /nfs/dbraw/zinc/20/54/40/412205440.db2.gz ZAPNRTYXHFRHCO-IJLUTSLNSA-N 2 0 228.355 2.102 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]CCc1ccoc1 ZINC000665262276 412205563 /nfs/dbraw/zinc/20/55/63/412205563.db2.gz XWDQSOBEVWTHIV-OLZOCXBDSA-N 2 0 222.332 2.072 20 0 BEADRP C[C@@H]1CCC[C@H](C[NH2+][C@H]2CCCC[C@@H]2C[NH3+])O1 ZINC000665265181 412208541 /nfs/dbraw/zinc/20/85/41/412208541.db2.gz RMCLGTNGSZFTPN-SYQHCUMBSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@]1(C[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)CC1(F)F ZINC000665266500 412208971 /nfs/dbraw/zinc/20/89/71/412208971.db2.gz CLMNOPYDIPPOHY-NNYUYHANSA-N 2 0 244.329 2.009 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]C[C@@]1(C)CC1(F)F ZINC000665266980 412209870 /nfs/dbraw/zinc/20/98/70/412209870.db2.gz NENHYUCKILBLIZ-VHSXEESVSA-N 2 0 220.307 2.139 20 0 BEADRP C[C@]1(CC[NH2+][C@H]2CCC[C@H]([NH3+])C2)CC1(F)F ZINC000665266856 412211082 /nfs/dbraw/zinc/21/10/82/412211082.db2.gz KXFMJNLRLAOIBK-DCAQKATOSA-N 2 0 232.318 2.281 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]C[C@H]1C(C)(C)C1(F)F ZINC000665273814 412215535 /nfs/dbraw/zinc/21/55/35/412215535.db2.gz DRXQSZFSIMHKJJ-MXWKQRLJSA-N 2 0 246.345 2.255 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]CC1=CCCC1 ZINC000665274038 412215543 /nfs/dbraw/zinc/21/55/43/412215543.db2.gz IMEQJYQTHFWTDO-CHWSQXEVSA-N 2 0 208.349 2.346 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1CCc2cc(N)ccc21 ZINC000665272063 412214000 /nfs/dbraw/zinc/21/40/00/412214000.db2.gz XFCLFYSMRJGVCC-IAQYHMDHSA-N 2 0 247.386 2.363 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+][C@@H]2C[C@H]3CC[C@@H]2O3)c2ccccc21 ZINC000422748068 412173429 /nfs/dbraw/zinc/17/34/29/412173429.db2.gz RTYGUKJOYLNZBO-CEVLRCNZSA-N 2 0 244.338 2.041 20 0 BEADRP CC1(C)[C@H](C[NH2+]C2CCC(C[NH3+])CC2)C1(F)F ZINC000665273826 412216162 /nfs/dbraw/zinc/21/61/62/412216162.db2.gz DYHOJZNCNOAXNQ-ILDUYXDCSA-N 2 0 246.345 2.385 20 0 BEADRP CC1(C)[C@H](C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)C1(F)F ZINC000665274800 412216815 /nfs/dbraw/zinc/21/68/15/412216815.db2.gz YOYFCEQJVGPCNP-BBBLOLIVSA-N 2 0 232.318 2.137 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)C1C[NH2+]C1)C1CCC(F)CC1 ZINC000665274645 412216907 /nfs/dbraw/zinc/21/69/07/412216907.db2.gz VCXNTVYCGVGDMI-CFGSLIKFSA-N 2 0 228.355 2.101 20 0 BEADRP C1=C(C[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)CCC1 ZINC000665274622 412217296 /nfs/dbraw/zinc/21/72/96/412217296.db2.gz UQSJRPKCTZDIIN-MELADBBJSA-N 2 0 220.360 2.074 20 0 BEADRP CC1(C)[C@H](C[NH2+][C@H]2CCCC[C@H]2C[NH3+])C1(F)F ZINC000665274098 412217942 /nfs/dbraw/zinc/21/79/42/412217942.db2.gz JMOVZXYTSIZFRJ-DCAQKATOSA-N 2 0 246.345 2.385 20 0 BEADRP CC1(C)C[C@]1(C)[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000665275447 412218532 /nfs/dbraw/zinc/21/85/32/412218532.db2.gz KYCGBLPQBPLLGP-FMSGJZPZSA-N 2 0 222.376 2.153 20 0 BEADRP C([NH2+][C@@H]1CCCC12CCCC2)C12CC(C1)C[NH2+]2 ZINC000665279659 412222797 /nfs/dbraw/zinc/22/27/97/412222797.db2.gz IOGKBFUHXDRXNP-JVWICGRDSA-N 2 0 234.387 2.441 20 0 BEADRP CCC[C@H]([NH2+]CC12CC(C1)C[NH2+]2)C1CCC1 ZINC000665280276 412225092 /nfs/dbraw/zinc/22/50/92/412225092.db2.gz XSJXHOQUHFJVLD-QRMWWUJWSA-N 2 0 222.376 2.297 20 0 BEADRP Cc1cncc([C@H](C)[NH2+]CC[C@@H]([NH3+])C(C)C)c1 ZINC000665282131 412225833 /nfs/dbraw/zinc/22/58/33/412225833.db2.gz RHOPDTYOIAMCFY-GXTWGEPZSA-N 2 0 235.375 2.414 20 0 BEADRP C[NH2+]C[C@H](C)[NH2+][C@H](C)[C@H]1CCCC[C@@H]1C ZINC000665297311 412237305 /nfs/dbraw/zinc/23/73/05/412237305.db2.gz CYIHLQWSMVYRMH-RVMXOQNASA-N 2 0 212.381 2.399 20 0 BEADRP C[NH2+]C[C@H](C)[NH2+][C@H](C)[C@H]1CCCC[C@H]1C ZINC000665297313 412237828 /nfs/dbraw/zinc/23/78/28/412237828.db2.gz CYIHLQWSMVYRMH-XQHKEYJVSA-N 2 0 212.381 2.399 20 0 BEADRP COc1cccc(C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)c1C ZINC000665294074 412239695 /nfs/dbraw/zinc/23/96/95/412239695.db2.gz HNEMULQUUMDAGG-KGLIPLIRSA-N 2 0 248.370 2.363 20 0 BEADRP C[NH2+]C[C@H](C)[NH2+][C@@H]1CCCC[C@H]1C(C)C ZINC000665295466 412243193 /nfs/dbraw/zinc/24/31/93/412243193.db2.gz DTIRZASTWYVXRH-RWMBFGLXSA-N 2 0 212.381 2.399 20 0 BEADRP CCc1ccc(C[NH2+]CC2CC[NH+](C)CC2)cn1 ZINC000352765628 171804757 /nfs/dbraw/zinc/80/47/57/171804757.db2.gz QETCOSDNMCIKJR-UHFFFAOYSA-N 2 0 247.386 2.075 20 0 BEADRP CCc1ccccc1C[NH+]1CCC(C[NH3+])CC1 ZINC000052204661 171878427 /nfs/dbraw/zinc/87/84/27/171878427.db2.gz JMIRTIRPTWMYIX-UHFFFAOYSA-N 2 0 232.371 2.420 20 0 BEADRP CCc1nccn1Cc1cc(OC)cc(C)n1 ZINC000168880694 172028160 /nfs/dbraw/zinc/02/81/60/172028160.db2.gz PREWHEUMCWQVKA-UHFFFAOYSA-N 2 0 231.299 2.206 20 0 BEADRP C[NH+](C)CCCC[NH2+]C[C@H]1CC=CCC1 ZINC000045663776 172429306 /nfs/dbraw/zinc/42/93/06/172429306.db2.gz LASKBHAUEPNWNI-ZDUSSCGKSA-N 2 0 210.365 2.274 20 0 BEADRP CC[C@H]([NH2+][C@H](C)C1CC[NH+](C)CC1)C1CC1 ZINC000324512981 487625216 /nfs/dbraw/zinc/62/52/16/487625216.db2.gz USTKKLNBXCSWQX-RISCZKNCSA-N 2 0 224.392 2.495 20 0 BEADRP C[N@@H+]1CCC[C@H]1CC[NH+]1CCC[C@H]1C1CC1 ZINC000371205636 173050641 /nfs/dbraw/zinc/05/06/41/173050641.db2.gz UFPOVXQRKAGYNL-KBPBESRZSA-N 2 0 222.376 2.345 20 0 BEADRP C[N@@H+]1CCC[C@]2(CC[NH+](CC3CCC3)C2)C1 ZINC000336581152 173062290 /nfs/dbraw/zinc/06/22/90/173062290.db2.gz LLYQVGJQMKKXGZ-AWEZNQCLSA-N 2 0 222.376 2.204 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C[C@@H]2CC2(C)C)[C@@H]2CCC[C@H]21 ZINC000353399066 173151529 /nfs/dbraw/zinc/15/15/29/173151529.db2.gz ANQSOZWLXUWSGI-XDQVBPFNSA-N 2 0 236.403 2.495 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CC2CCC2)[C@H]2CCC[C@H]21 ZINC000309501062 173152656 /nfs/dbraw/zinc/15/26/56/173152656.db2.gz ZTNQMCHRWHERJX-HZSPNIEDSA-N 2 0 222.376 2.249 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CCc2ccco2)[C@H]2CCC[C@H]21 ZINC000353432132 173153304 /nfs/dbraw/zinc/15/33/04/173153304.db2.gz AQNCMAZFNAOPQE-QLFBSQMISA-N 2 0 248.370 2.285 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]Cc2ccoc2)[C@H]2CCC[C@@H]21 ZINC000367527915 173154943 /nfs/dbraw/zinc/15/49/43/173154943.db2.gz UHCYEEHGFMMIJS-RDBSUJKOSA-N 2 0 234.343 2.242 20 0 BEADRP C[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2Cc2ccco2)C1 ZINC000290372136 173161908 /nfs/dbraw/zinc/16/19/08/173161908.db2.gz HMYDIICSMWIZDL-JSGCOSHPSA-N 2 0 234.343 2.196 20 0 BEADRP C[N@@H+]1CC[C@]2(CC[NH+](CCCCCF)C2)C1 ZINC000366495526 173167887 /nfs/dbraw/zinc/16/78/87/173167887.db2.gz GUOBPGGUJDLJRQ-ZDUSSCGKSA-N 2 0 228.355 2.154 20 0 BEADRP C[NH2+]C1CC[NH+](CCCC(C)(C)C)CC1 ZINC000300857119 173322966 /nfs/dbraw/zinc/32/29/66/173322966.db2.gz MYOXEHACHPEGAX-UHFFFAOYSA-N 2 0 212.381 2.497 20 0 BEADRP C[NH2+]CCC[N@H+](C)Cc1cccc(C)c1 ZINC000042435874 173345872 /nfs/dbraw/zinc/34/58/72/173345872.db2.gz MYBDYNFVQCTSIO-UHFFFAOYSA-N 2 0 206.333 2.036 20 0 BEADRP C[NH2+]CCC[N@H+](C)C[C@H](C)CC(C)C ZINC000300853043 173346438 /nfs/dbraw/zinc/34/64/38/173346438.db2.gz FOFNWCRBMMIDRO-GFCCVEGCSA-N 2 0 200.370 2.210 20 0 BEADRP C[NH2+]C[C@@H]1CCCN1CCOc1ccc(C)cc1 ZINC000019933445 173368676 /nfs/dbraw/zinc/36/86/76/173368676.db2.gz NIKJKFKLDMKTCM-AWEZNQCLSA-N 2 0 248.370 2.058 20 0 BEADRP C[NH2+]C[C@@H]1CCC[N@@H+]1C[C@H](C)CC(C)C ZINC000300967072 173368852 /nfs/dbraw/zinc/36/88/52/173368852.db2.gz RPZLXPUGISVTFU-OLZOCXBDSA-N 2 0 212.381 2.352 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](CCC2CCCC2)C1 ZINC000053031454 173369775 /nfs/dbraw/zinc/36/97/75/173369775.db2.gz IQULHYFLHXGSDS-ZDUSSCGKSA-N 2 0 210.365 2.108 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](C[C@@H]2CCCC[C@@H]2C)C1 ZINC000226638595 173370507 /nfs/dbraw/zinc/37/05/07/173370507.db2.gz KLFHTYXLSZCLRG-IHRRRGAJSA-N 2 0 224.392 2.354 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](Cc2ccc(C)cc2C)C1 ZINC000071142058 173370762 /nfs/dbraw/zinc/37/07/62/173370762.db2.gz HUAYMWCXJAUOTH-AWEZNQCLSA-N 2 0 232.371 2.345 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](Cc2ccc(C)c(C)c2)C1 ZINC000071142431 173371290 /nfs/dbraw/zinc/37/12/90/173371290.db2.gz YGZAODWEBWHMLD-HNNXBMFYSA-N 2 0 232.371 2.345 20 0 BEADRP C[NH2+]C[C@H]1CCCN1CCCc1ccc(C)nc1 ZINC000339409460 173379844 /nfs/dbraw/zinc/37/98/44/173379844.db2.gz MHAZDRKOPDSXRU-OAHLLOKOSA-N 2 0 247.386 2.006 20 0 BEADRP C[NH2+]C[C@H]1CC[N@H+](C[C@H](C)c2ccccc2)C1 ZINC000071142560 173381313 /nfs/dbraw/zinc/38/13/13/173381313.db2.gz GCKDVGNWRPGYLR-UONOGXRCSA-N 2 0 232.371 2.331 20 0 BEADRP COCCC(C)(C)C[NH2+][C@H](C)CCCC[NH3+] ZINC000309375075 174144233 /nfs/dbraw/zinc/14/42/33/174144233.db2.gz PZYWHXLOKDMRJP-GFCCVEGCSA-N 2 0 230.396 2.156 20 0 BEADRP COCCCCC[N@@H+]1CCC[C@H]([NH+](C)C)CC1 ZINC000365405606 174177783 /nfs/dbraw/zinc/17/77/83/174177783.db2.gz TUSFMYPETDQRGB-AWEZNQCLSA-N 2 0 242.407 2.219 20 0 BEADRP COCCC[C@H](C)[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000363546410 174264405 /nfs/dbraw/zinc/26/44/05/174264405.db2.gz RKZOAPLDPKJKKU-IHRRRGAJSA-N 2 0 240.391 2.018 20 0 BEADRP COCC[C@@H](C)[NH2+]C[C@H](C)C[NH+]1CCCCC1 ZINC000045037484 174383058 /nfs/dbraw/zinc/38/30/58/174383058.db2.gz ABVYPXZFGVKVDP-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+][C@@H]1CC[C@H](C)[C@@H](C)C1 ZINC000300023902 174562434 /nfs/dbraw/zinc/56/24/34/174562434.db2.gz ITTNISJUAFSAHK-FQUUOJAGSA-N 2 0 242.407 2.155 20 0 BEADRP COC[C@H]([NH2+]C1CCC([NH+](C)C)CC1)C(C)C ZINC000353528616 174578848 /nfs/dbraw/zinc/57/88/48/174578848.db2.gz OBNGTTKHGFRQOL-RUXDESIVSA-N 2 0 242.407 2.120 20 0 BEADRP COc1ccc(C)cc1C[N@@H+]1C[C@@H](C[NH3+])C[C@@H]1C ZINC000131691893 175075022 /nfs/dbraw/zinc/07/50/22/175075022.db2.gz NYKAIWCVHBKNNN-QWHCGFSZSA-N 2 0 248.370 2.173 20 0 BEADRP COc1ccc(C[N@@H+]2CCC[C@H](CC[NH3+])C2)cc1 ZINC000070533450 175099668 /nfs/dbraw/zinc/09/96/68/175099668.db2.gz RWFPAYTWSTWHSG-CYBMUJFWSA-N 2 0 248.370 2.256 20 0 BEADRP COc1ccc(C[NH2+][C@H]2CCC[C@H]([NH3+])C2)cc1 ZINC000093209641 175111935 /nfs/dbraw/zinc/11/19/35/175111935.db2.gz DIOOHLZCSWWPID-STQMWFEESA-N 2 0 234.343 2.055 20 0 BEADRP CC(C)C[NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000053658198 487630221 /nfs/dbraw/zinc/63/02/21/487630221.db2.gz MQCINLQPCDKFQP-AWEZNQCLSA-N 2 0 224.392 2.354 20 0 BEADRP COc1ccc([C@H](C)[NH2+]CCCC[NH3+])cc1 ZINC000037714837 175188569 /nfs/dbraw/zinc/18/85/69/175188569.db2.gz REGZDXSUXFISIE-NSHDSACASA-N 2 0 222.332 2.085 20 0 BEADRP COc1cccc(C[N@@H+]2CC[C@H]([NH3+])C[C@H]2C)c1 ZINC000049713133 175260688 /nfs/dbraw/zinc/26/06/88/175260688.db2.gz PPNDBIXHMNCWLQ-YPMHNXCESA-N 2 0 234.343 2.007 20 0 BEADRP COc1cccc([C@H](C)[NH2+]C[C@@H]2CCCN2C)c1 ZINC000177253540 175293747 /nfs/dbraw/zinc/29/37/47/175293747.db2.gz PEQFXBUCOAWLQW-JSGCOSHPSA-N 2 0 248.370 2.440 20 0 BEADRP COc1ccccc1C[N@@H+]1CC[C@H](C)[C@@H](C[NH3+])C1 ZINC000163488288 175326961 /nfs/dbraw/zinc/32/69/61/175326961.db2.gz WKBONDJEZHGZOB-JSGCOSHPSA-N 2 0 248.370 2.112 20 0 BEADRP COc1ccccc1C[N@@H+]1CCC[C@H]([C@H](C)[NH3+])C1 ZINC000113655519 175327471 /nfs/dbraw/zinc/32/74/71/175327471.db2.gz KWZVMWUXGYEKGM-STQMWFEESA-N 2 0 248.370 2.254 20 0 BEADRP CSCCCC[NH2+][C@H](C)CCCC[NH3+] ZINC000308652320 175475678 /nfs/dbraw/zinc/47/56/78/175475678.db2.gz LBRUBIQMLIUFHR-LLVKDONJSA-N 2 0 218.410 2.237 20 0 BEADRP CSCCC[N@H+](C)C[C@@H]1CC[NH2+][C@@H](C)C1 ZINC000300855843 175478486 /nfs/dbraw/zinc/47/84/86/175478486.db2.gz OKYQYOAACCPFOJ-NWDGAFQWSA-N 2 0 230.421 2.059 20 0 BEADRP CS[C@@H]1CCC[C@@H]([NH2+][C@@H](C)CCC[NH3+])C1 ZINC000336675007 175548104 /nfs/dbraw/zinc/54/81/04/175548104.db2.gz HECAWENVHJQVOK-QJPTWQEYSA-N 2 0 230.421 2.378 20 0 BEADRP CS[C@@H]1CC[C@@H]1[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000309848186 175551303 /nfs/dbraw/zinc/55/13/03/175551303.db2.gz HSFXPLZOMWPDPG-QWHCGFSZSA-N 2 0 242.432 2.343 20 0 BEADRP C[C@@H]([NH3+])C1CC[NH+](Cc2ccccc2)CC1 ZINC000058041091 175801387 /nfs/dbraw/zinc/80/13/87/175801387.db2.gz UJMMXMMSMIZNAX-GFCCVEGCSA-N 2 0 218.344 2.246 20 0 BEADRP C[C@@H](c1ccccc1)[NH+]1CCC(C[NH3+])CC1 ZINC000044511692 176020202 /nfs/dbraw/zinc/02/02/02/176020202.db2.gz NXCMPFSESDRDOU-LBPRGKRZSA-N 2 0 218.344 2.418 20 0 BEADRP C[C@@H](c1cccnc1)[N@H+](C)CC1CC[NH2+]CC1 ZINC000094010921 176029345 /nfs/dbraw/zinc/02/93/45/176029345.db2.gz NAMFRWOCWVLKGS-LBPRGKRZSA-N 2 0 233.359 2.074 20 0 BEADRP C[C@@H](c1cccnc1)N(C)C[C@H]1CCC[N@H+](C)C1 ZINC000265915993 176029353 /nfs/dbraw/zinc/02/93/53/176029353.db2.gz BISOGZVZYBOYSU-KBPBESRZSA-N 2 0 247.386 2.416 20 0 BEADRP C[C@@H]1CCCC[N@@H+]1CCC[NH2+]Cc1ccn(C)c1 ZINC000091007082 176072016 /nfs/dbraw/zinc/07/20/16/176072016.db2.gz BJHJTBSOCFXTQP-CQSZACIVSA-N 2 0 249.402 2.379 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[NH2+]C1CC[NH2+]CC1 ZINC000042859659 176076442 /nfs/dbraw/zinc/07/64/42/176076442.db2.gz ZPZJICWFVVSSJU-VXGBXAGGSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+]C1CCC([NH3+])CC1 ZINC000051692903 176081018 /nfs/dbraw/zinc/08/10/18/176081018.db2.gz XBJSBKWDCYGEQI-XVSSEFHLSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@@H]1CCC[C@@H](C[NH2+]C[C@@H]2CCC[NH2+]C2)C1 ZINC000235298580 176118256 /nfs/dbraw/zinc/11/82/56/176118256.db2.gz PVNWYCUYEUDGIX-MGPQQGTHSA-N 2 0 224.392 2.402 20 0 BEADRP C[C@@H]1CCC[C@@H]([N@H+](C)CC2CC[NH2+]CC2)C1 ZINC000042495698 176121334 /nfs/dbraw/zinc/12/13/34/176121334.db2.gz HUMOLXMHUWORFZ-TZMCWYRMSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+]CC1(C)CC[NH2+]CC1 ZINC000334863177 176131291 /nfs/dbraw/zinc/13/12/91/176131291.db2.gz MNADEMAWNYTTLA-NEPJUHHUSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1CCC[C@H](CC[NH+]2C[C@@H]3C[NH2+]C[C@H]3C2)C1 ZINC000359294841 176136117 /nfs/dbraw/zinc/13/61/17/176136117.db2.gz AUVFLLAFSVICSF-KBXIAJHMSA-N 2 0 236.403 2.354 20 0 BEADRP C[C@@H]1CCNC[C@H]1[NH2+]CC1CCC(F)(F)CC1 ZINC000335024128 176186369 /nfs/dbraw/zinc/18/63/69/176186369.db2.gz WEOSWJKCXDAJAO-ZYHUDNBSSA-N 2 0 246.345 2.400 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CCC2CC[NH+](C)CC2)C1 ZINC000122000717 176211926 /nfs/dbraw/zinc/21/19/26/176211926.db2.gz KWFFJIRLPRZMRV-TZMCWYRMSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C2CC[NH2+]CC2)[C@H](C)C1 ZINC000069675262 176212261 /nfs/dbraw/zinc/21/22/61/176212261.db2.gz VPWYBMUIIVTFQE-NQBHXWOUSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C[C@@]2(C)CCC[NH2+]C2)C1 ZINC000228981558 176213393 /nfs/dbraw/zinc/21/33/93/176213393.db2.gz GKFHYUGQQKIDFD-UPJWGTAASA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000336717140 176218228 /nfs/dbraw/zinc/21/82/28/176218228.db2.gz XUVHLWQQVGGQPA-LPWJVIDDSA-N 2 0 208.349 2.001 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CC2([NH3+])CCCCC2)C1 ZINC000129454376 176232902 /nfs/dbraw/zinc/23/29/02/176232902.db2.gz MCGCXODUHPXTSL-NEPJUHHUSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]CCc1ccccc1 ZINC000128188641 176269816 /nfs/dbraw/zinc/26/98/16/176269816.db2.gz IFKNTQHOSCZARD-HIFRSBDPSA-N 2 0 232.371 2.159 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]CCC1(F)CCC1 ZINC000336778902 176270397 /nfs/dbraw/zinc/27/03/97/176270397.db2.gz MQWBSIMREOTHHI-VXGBXAGGSA-N 2 0 228.355 2.199 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]CCCCF ZINC000336713679 176277942 /nfs/dbraw/zinc/27/79/42/176277942.db2.gz VSEKDGSSWCAMSE-IJLUTSLNSA-N 2 0 216.344 2.054 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]C1CC(F)(F)C1 ZINC000336781418 176278454 /nfs/dbraw/zinc/27/84/54/176278454.db2.gz UPZKXKVCIPUXBL-KKZNHRDASA-N 2 0 232.318 2.102 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]CC1(C(F)F)CC1 ZINC000359003341 176278750 /nfs/dbraw/zinc/27/87/50/176278750.db2.gz QTAMMOKJHFZPCH-MXWKQRLJSA-N 2 0 246.345 2.350 20 0 BEADRP C[C@@H]1C[N@H+](CCCC(C)(C)C)CC[C@H]1[NH3+] ZINC000300836082 176287595 /nfs/dbraw/zinc/28/75/95/176287595.db2.gz INTNPPMNVQNEMS-VXGBXAGGSA-N 2 0 212.381 2.482 20 0 BEADRP C[C@@H]1CSC[C@H]1[NH2+]C1CCC([NH+](C)C)CC1 ZINC000309817769 176355040 /nfs/dbraw/zinc/35/50/40/176355040.db2.gz VQUSSSKAIQDQMC-IKWCTNDRSA-N 2 0 242.432 2.200 20 0 BEADRP C[C@@H]1C[C@@H](C[N@H+](C)CC2CCCC2)CC[NH2+]1 ZINC000235378969 176368242 /nfs/dbraw/zinc/36/82/42/176368242.db2.gz XGJOYLGVOMIHRI-OCCSQVGLSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[C@@H](C[N@@H+]2CCC(C)(C)C2)CC[NH2+]1 ZINC000235380658 176368503 /nfs/dbraw/zinc/36/85/03/176368503.db2.gz XFVUNXCSFJMTLP-NEPJUHHUSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCC2CC[NH+](C)CC2)[C@@H]1C ZINC000336686220 176375231 /nfs/dbraw/zinc/37/52/31/176375231.db2.gz UQHMKAMHOCYEAI-YRGRVCCFSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCc2ccccc2O)CC[N@@H+]1C ZINC000154920170 176376571 /nfs/dbraw/zinc/37/65/71/176376571.db2.gz IHAAYCHBXCUWIN-OCCSQVGLSA-N 2 0 248.370 2.007 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+]CCCCC[NH+]1CCCC1 ZINC000354235439 176396292 /nfs/dbraw/zinc/39/62/92/176396292.db2.gz GDKPETCAGNPGFQ-ZIAGYGMSSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CC1CCSCC1 ZINC000308889693 176618426 /nfs/dbraw/zinc/61/84/26/176618426.db2.gz XTAHAIYLUQEPQR-LLVKDONJSA-N 2 0 230.421 2.237 20 0 BEADRP C[C@H]([NH2+]CC1CC[NH+](C)CC1)c1cccc(O)c1 ZINC000044515725 176838374 /nfs/dbraw/zinc/83/83/74/176838374.db2.gz JEZNXLYWAKRSKY-LBPRGKRZSA-N 2 0 248.370 2.385 20 0 BEADRP C[C@H]([NH2+]CCCC[NH3+])c1cccc(F)c1 ZINC000037715049 176843729 /nfs/dbraw/zinc/84/37/29/176843729.db2.gz MNJBADJGDLCDLQ-JTQLQIEISA-N 2 0 210.296 2.215 20 0 BEADRP C[C@H]([NH2+]CCC[NH+]1CCCC1)[C@]1(C)CCCO1 ZINC000340178854 176844748 /nfs/dbraw/zinc/84/47/48/176844748.db2.gz AVAMBBISYJFEBE-KBPBESRZSA-N 2 0 240.391 2.020 20 0 BEADRP C[C@H]1CCCC[N@@H+]1CCC[NH2+]Cc1cc[nH]c1 ZINC000080773211 177075197 /nfs/dbraw/zinc/07/51/97/177075197.db2.gz JNRSRWGBLCEWQO-ZDUSSCGKSA-N 2 0 235.375 2.369 20 0 BEADRP C[C@H]1CCCC[N@@H+]1CC[C@@H]1CCC[NH+]1C ZINC000124656712 177077820 /nfs/dbraw/zinc/07/78/20/177077820.db2.gz CAJNOULRPRSQJJ-STQMWFEESA-N 2 0 210.365 2.345 20 0 BEADRP C[C@H]1CCCC[C@@H]1[NH2+]C1CCC([NH3+])CC1 ZINC000051692905 177082973 /nfs/dbraw/zinc/08/29/73/177082973.db2.gz XBJSBKWDCYGEQI-WTIISPKJSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@H]1CCCC[C@H]1OCC[NH2+]CC1([NH3+])CCC1 ZINC000342106204 177089650 /nfs/dbraw/zinc/08/96/50/177089650.db2.gz PFKNFBYXZVDPCO-QWHCGFSZSA-N 2 0 240.391 2.053 20 0 BEADRP C[C@H]1CCC[C@@H]([NH2+]CCCC[NH+](C)C)C1 ZINC000045662987 177122969 /nfs/dbraw/zinc/12/29/69/177122969.db2.gz BDTUZCHOXWBJHO-QWHCGFSZSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@H]1CCC[C@H]([NH2+]CC2CC[NH+](C)CC2)C1 ZINC000044515363 177137069 /nfs/dbraw/zinc/13/70/69/177137069.db2.gz ZSHWUEAKMWSPOC-JSGCOSHPSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1CC[N@H+](CC[C@H]2CCCC[NH+]2C)C1 ZINC000336347246 177160272 /nfs/dbraw/zinc/16/02/72/177160272.db2.gz AXBYJNWFTCSNGK-QWHCGFSZSA-N 2 0 210.365 2.203 20 0 BEADRP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]CC1=CCCCC1 ZINC000336236002 177234222 /nfs/dbraw/zinc/23/42/22/177234222.db2.gz GIPIORSPFUVUOC-GXTWGEPZSA-N 2 0 222.376 2.417 20 0 BEADRP C[C@H]1C[N@H+](CCC2CCCC2)CC[C@@H]1[NH3+] ZINC000049713034 177246980 /nfs/dbraw/zinc/24/69/80/177246980.db2.gz VQPPCRBHGUAXFG-AAEUAGOBSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@H]1CSC[C@@H]1[NH2+]C1CCC([NH+](C)C)CC1 ZINC000309817771 177306152 /nfs/dbraw/zinc/30/61/52/177306152.db2.gz VQUSSSKAIQDQMC-WTIISPKJSA-N 2 0 242.432 2.200 20 0 BEADRP C[C@@H]1C[C@H](C)C[N@@H+](CC[C@@H]2CCC[NH2+]C2)C1 ZINC000051918882 177312707 /nfs/dbraw/zinc/31/27/07/177312707.db2.gz DTTPXXKDUUTOLF-MJBXVCDLSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H]1C[C@H](C)[N@H+](CC[C@H]2CCC[NH+]2C)C1 ZINC000336651732 177317164 /nfs/dbraw/zinc/31/71/64/177317164.db2.gz VSKQNTXYMCAYLV-FRRDWIJNSA-N 2 0 210.365 2.201 20 0 BEADRP C[C@H]1C[C@@H](C[NH+](CC2CC2)CC2CC2)CC[NH2+]1 ZINC000235742175 177323608 /nfs/dbraw/zinc/32/36/08/177323608.db2.gz MOOKYWPFFGTPOI-WFASDCNBSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H]1C[C@@H](C[NH3+])C[N@@H+]1CC1CCCCC1 ZINC000122312936 177323962 /nfs/dbraw/zinc/32/39/62/177323962.db2.gz CGUUJETWSSGYCW-AAEUAGOBSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@H]1C[C@@H](C[N@@H+]2CCCC(C)(C)C2)CC[NH2+]1 ZINC000235698762 177324306 /nfs/dbraw/zinc/32/43/06/177324306.db2.gz VJSXXZBHWXUWCE-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1C[C@@H](C[NH+]2CCCCCC2)CC[NH2+]1 ZINC000235698852 177324514 /nfs/dbraw/zinc/32/45/14/177324514.db2.gz FVAWEZGWWQQVMN-STQMWFEESA-N 2 0 210.365 2.251 20 0 BEADRP C[C@H]1C[C@@H](C[NH3+])CN1c1cc[nH+]c2ccccc21 ZINC000216234841 177324687 /nfs/dbraw/zinc/32/46/87/177324687.db2.gz UCJQQOSKTCHTGQ-RYUDHWBXSA-N 2 0 241.338 2.408 20 0 BEADRP C[C@H]1C[C@@H](C[N@@H+]2CCSC(C)(C)C2)CC[NH2+]1 ZINC000235699479 177325015 /nfs/dbraw/zinc/32/50/15/177325015.db2.gz SIMNHEALXOFQPG-RYUDHWBXSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@H]1C[C@@H]([NH3+])CC[N@@H+]1Cc1cccs1 ZINC000049712692 177327901 /nfs/dbraw/zinc/32/79/01/177327901.db2.gz RPMZHVZUTQBWJA-UWVGGRQHSA-N 2 0 210.346 2.060 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CC2(C(F)F)CC2)CC[N@@H+]1C ZINC000309810341 177330773 /nfs/dbraw/zinc/33/07/73/177330773.db2.gz UAQJNIJKWHYLAO-UWVGGRQHSA-N 2 0 232.318 2.104 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]C1CCCC1 ZINC000036907484 177331370 /nfs/dbraw/zinc/33/13/70/177331370.db2.gz DPAJTUCYATWMFY-NTZNESFSSA-N 2 0 210.365 2.247 20 0 BEADRP C[C@H](C[NH2+][C@@H]1C[C@H](C)[C@H]1C)C[NH+]1CCCC1 ZINC000309346835 177332775 /nfs/dbraw/zinc/33/27/75/177332775.db2.gz MJJFXJNICYTMFC-XJFOESAGSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+][C@@H]1C[C@H](C)N(C2CC2)C1 ZINC000352811023 177333187 /nfs/dbraw/zinc/33/31/87/177333187.db2.gz RGENIGKACDGMLY-MBNYWOFBSA-N 2 0 248.370 2.425 20 0 BEADRP C[C@H](CN1CCCCC1)[NH2+][C@@H]1C[C@H](C)[C@@H]1C ZINC000309415423 177333898 /nfs/dbraw/zinc/33/38/98/177333898.db2.gz XHGOQNHXRXFECN-RFQIPJPRSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1C[C@H](C)[N@H+](C[C@@H]2CC[NH2+][C@@H](C)C2)C1 ZINC000235405883 177362041 /nfs/dbraw/zinc/36/20/41/177362041.db2.gz DAOGTQJETADWAV-MROQNXINSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@H]1C[C@H]([NH3+])CC[N@@H+]1CCc1cccs1 ZINC000049712298 177364386 /nfs/dbraw/zinc/36/43/86/177364386.db2.gz DDKJDMUDZFHXEL-WDEREUQCSA-N 2 0 224.373 2.102 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CCC2CC2)CN1C1CC1 ZINC000120226479 177369542 /nfs/dbraw/zinc/36/95/42/177369542.db2.gz PPRBJNYBPCVHKQ-JQWIXIFHSA-N 2 0 208.349 2.001 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCc2ccccc21)[C@H]1CC[NH2+]C1 ZINC000400342027 225017720 /nfs/dbraw/zinc/01/77/20/225017720.db2.gz GALZRROUMOETGW-CORIIIEPSA-N 2 0 230.355 2.262 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C/C=C/c2ccncc2)CC[N@@H+]1C ZINC000487321408 225299601 /nfs/dbraw/zinc/29/96/01/225299601.db2.gz RMAGFDVJMFTMLE-PRXHZCDDSA-N 2 0 245.370 2.167 20 0 BEADRP C[C@@H]1C[C@H]1C[NH2+][C@@H]1CCN(CC2CCCC2)C1 ZINC000488443247 225398645 /nfs/dbraw/zinc/39/86/45/225398645.db2.gz GIEADNHWCORHJV-VHDGCEQUSA-N 2 0 236.403 2.497 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@@H](C)[C@H]2CC2(F)F)CC1 ZINC000666226649 487645389 /nfs/dbraw/zinc/64/53/89/487645389.db2.gz BQADOJZPLAFUCQ-CMPLNLGQSA-N 2 0 246.345 2.493 20 0 BEADRP C[NH+](C)CC1CC[NH+](C[C@@H]2CCSC2)CC1 ZINC000495088247 226276669 /nfs/dbraw/zinc/27/66/69/226276669.db2.gz USEQCWQQAQMGNR-ZDUSSCGKSA-N 2 0 242.432 2.013 20 0 BEADRP CSCCCCC[NH2+][C@@H](C)[C@H]1CCC[NH2+]1 ZINC000400356947 226341876 /nfs/dbraw/zinc/34/18/76/226341876.db2.gz AVXNCUOTIDDBSV-NWDGAFQWSA-N 2 0 230.421 2.250 20 0 BEADRP C[NH+](C)CCCC(C)(C)[NH2+]CC[C@@H]1CCOC1 ZINC000400575035 226346507 /nfs/dbraw/zinc/34/65/07/226346507.db2.gz DZZBQSGOCAPTGS-CYBMUJFWSA-N 2 0 242.407 2.123 20 0 BEADRP Cc1cccc(CCN[C@@H](C)[C@H]2CCC[NH2+]2)c1 ZINC000400811996 226352070 /nfs/dbraw/zinc/35/20/70/226352070.db2.gz YSJXEKVUSFIBPO-DZGCQCFKSA-N 2 0 232.371 2.268 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)c1ccccn1 ZINC000400996301 226352530 /nfs/dbraw/zinc/35/25/30/226352530.db2.gz DYKGCZLYJLWKFG-REWJHTLYSA-N 2 0 245.370 2.120 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]CC1CC(C)(C)C1 ZINC000564826481 322934007 /nfs/dbraw/zinc/93/40/07/322934007.db2.gz PUBIMJFDICXKJZ-YPMHNXCESA-N 2 0 224.392 2.400 20 0 BEADRP C[NH+](C)C[C@@H]1CC[N@H+](CCCOC(C)(C)C)C1 ZINC000674909266 487651981 /nfs/dbraw/zinc/65/19/81/487651981.db2.gz ZNTOTKGVDOKYLP-ZDUSSCGKSA-N 2 0 242.407 2.075 20 0 BEADRP CC1(C[NH2+]Cc2ccc(C[NH3+])cc2)CCC1 ZINC000232932673 487671459 /nfs/dbraw/zinc/67/14/59/487671459.db2.gz AVPNHYYOPXJYHP-UHFFFAOYSA-N 2 0 218.344 2.425 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)c1ccco1 ZINC000401018250 229168776 /nfs/dbraw/zinc/16/87/76/229168776.db2.gz BHJKCKUCMRJZFR-QNWHQSFQSA-N 2 0 234.343 2.318 20 0 BEADRP C[NH2+]C[C@H]1CC[N@H+](C[C@@H](C)C(C)(C)C)C1 ZINC000162989477 487676785 /nfs/dbraw/zinc/67/67/85/487676785.db2.gz RXFKURYNWJQPFN-VXGBXAGGSA-N 2 0 212.381 2.210 20 0 BEADRP CCC[NH2+]CC[NH2+]C[C@@H](C)C(C)(C)C ZINC000162996797 487677858 /nfs/dbraw/zinc/67/78/58/487677858.db2.gz NFSJVCAJLMYGLT-LLVKDONJSA-N 2 0 200.370 2.258 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH2+]C[C@@]2(C)CCCS2)C1 ZINC000087792726 487686528 /nfs/dbraw/zinc/68/65/28/487686528.db2.gz YUTMPNUTEHAENN-QWHCGFSZSA-N 2 0 242.432 2.204 20 0 BEADRP CC[N@H+](CC1CC[NH2+]CC1)C1CC(C)(C)C1 ZINC000395289908 262785946 /nfs/dbraw/zinc/78/59/46/262785946.db2.gz JPHVYNWVGURALX-UHFFFAOYSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H](CCC1CC1)[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000398043903 262942787 /nfs/dbraw/zinc/94/27/87/262942787.db2.gz AESVLYRUNXIUIZ-DGCLKSJQSA-N 2 0 210.365 2.154 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@@H]1CS[C@@H](C)C1 ZINC000226330589 487713223 /nfs/dbraw/zinc/71/32/23/487713223.db2.gz ZQSKJOLMSWIVDA-RYUDHWBXSA-N 2 0 230.421 2.200 20 0 BEADRP CC1(C[NH2+]CCC[C@H]2CCC[NH2+]2)CCC1 ZINC000336750462 487721867 /nfs/dbraw/zinc/72/18/67/487721867.db2.gz FWKBIGWRYLJYKC-LBPRGKRZSA-N 2 0 210.365 2.298 20 0 BEADRP CCO[C@H]1C[C@H]([NH2+]CC[C@@H]([NH3+])C(C)C)C1(C)C ZINC000233762027 487740267 /nfs/dbraw/zinc/74/02/67/487740267.db2.gz MGGQGSVJZRPOFW-AGIUHOORSA-N 2 0 242.407 2.153 20 0 BEADRP c1ccc([C@@H]2CC[N@@H+](C[C@H]3CC[NH2+]C3)C2)cc1 ZINC000250804228 487741350 /nfs/dbraw/zinc/74/13/50/487741350.db2.gz GVPORTGQBXZZQJ-DZGCQCFKSA-N 2 0 230.355 2.085 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCC[C@H]1C[NH3+])C(C)(C)C ZINC000251138863 487749219 /nfs/dbraw/zinc/74/92/19/487749219.db2.gz VYRIYRFLOCZPJD-GRYCIOLGSA-N 2 0 212.381 2.386 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1)c1ccncc1 ZINC000675926988 487793304 /nfs/dbraw/zinc/79/33/04/487793304.db2.gz KAAQCZPAILROKT-UMVBOHGHSA-N 2 0 247.386 2.257 20 0 BEADRP C[N@H+](CCC(C)(C)C)C[C@@H]1CCC[NH2+]C1 ZINC000234288847 487793415 /nfs/dbraw/zinc/79/34/15/487793415.db2.gz UGKUOSXWTQCFPD-GFCCVEGCSA-N 2 0 212.381 2.354 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[N@H+](C)C[C@H]1CC[NH2+]C1 ZINC000252126012 487816827 /nfs/dbraw/zinc/81/68/27/487816827.db2.gz KBOIENMSRJEDCI-AGIUHOORSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@]1(c2ccc(F)cc2)CC[N@H+](CCC[NH3+])C1 ZINC000414740122 487820023 /nfs/dbraw/zinc/82/00/23/487820023.db2.gz JKZUTDHQKFBQRJ-AWEZNQCLSA-N 2 0 236.334 2.138 20 0 BEADRP C[C@]1(Cc2ccccc2)CCC[N@@H+]1CCC[NH3+] ZINC000414751417 487822255 /nfs/dbraw/zinc/82/22/55/487822255.db2.gz AKUZWHAUYDJRTF-OAHLLOKOSA-N 2 0 232.371 2.432 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCC2CC[NH2+]CC2)[C@@H]1C ZINC000386135596 487830073 /nfs/dbraw/zinc/83/00/73/487830073.db2.gz PLAITAHGQHYWDP-NQBHXWOUSA-N 2 0 210.365 2.010 20 0 BEADRP CCC[C@H](C)[NH+]1CCN(c2cc[nH+]cc2)CC1 ZINC000681643600 487830113 /nfs/dbraw/zinc/83/01/13/487830113.db2.gz FAWHHJHSPJKBAV-ZDUSSCGKSA-N 2 0 233.359 2.392 20 0 BEADRP CCC1CC([NH2+]C[C@H]2CCC[N@H+](C)C2)C1 ZINC000389941814 487847538 /nfs/dbraw/zinc/84/75/38/487847538.db2.gz OUWWFDBVOVSBEU-OTTFEQOBSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H](c1ccncc1)[N@@H+]1CC[C@@H](C)[C@H](C[NH3+])C1 ZINC000253188691 487857741 /nfs/dbraw/zinc/85/77/41/487857741.db2.gz JYLRZAJAQQIHCS-MBNYWOFBSA-N 2 0 233.359 2.059 20 0 BEADRP CCc1ccc(C[NH2+][C@@H]2CC[NH2+]C[C@@H]2C)s1 ZINC000309331795 487867522 /nfs/dbraw/zinc/86/75/22/487867522.db2.gz IYPGJGPJIAKXAB-GXFFZTMASA-N 2 0 238.400 2.398 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+]Cc1cccc2cnccc21 ZINC000666741387 487867921 /nfs/dbraw/zinc/86/79/21/487867921.db2.gz ICPWCPTZIDVDKN-OAHLLOKOSA-N 2 0 243.354 2.308 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+]Cc1cccc2cnccc21 ZINC000666741386 487869815 /nfs/dbraw/zinc/86/98/15/487869815.db2.gz ICPWCPTZIDVDKN-HNNXBMFYSA-N 2 0 243.354 2.308 20 0 BEADRP CC1(C)CC[C@H]([NH2+]C[C@@H]2CCC[NH2+]C2)C1 ZINC000128570828 487874036 /nfs/dbraw/zinc/87/40/36/487874036.db2.gz HZQXYCXIUNJGBC-NEPJUHHUSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H](CC1CCC1)[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000666765799 487874087 /nfs/dbraw/zinc/87/40/87/487874087.db2.gz ZNZVVXIZTZHBPY-YPMHNXCESA-N 2 0 210.365 2.154 20 0 BEADRP CC1(C)CC[C@H]([NH2+]C[C@H]2CCC[NH2+]C2)C1 ZINC000128571288 487873874 /nfs/dbraw/zinc/87/38/74/487873874.db2.gz HZQXYCXIUNJGBC-RYUDHWBXSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H](CC1CCC1)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000666762247 487874476 /nfs/dbraw/zinc/87/44/76/487874476.db2.gz IIAXRUCEVPELCT-BKQLOGFTSA-N 2 0 222.376 2.438 20 0 BEADRP CCC[NH+]1CCC(C[NH2+]Cc2cc[nH]c2)CC1 ZINC000086252898 322962223 /nfs/dbraw/zinc/96/22/23/322962223.db2.gz AUVMNXKZHFUTLB-UHFFFAOYSA-N 2 0 235.375 2.226 20 0 BEADRP CC(C)C[N@@H+]1CC[C@H](C2CC[NH+](C)CC2)C1 ZINC000334458392 487884266 /nfs/dbraw/zinc/88/42/66/487884266.db2.gz QZCCCSLVJGHSCM-AWEZNQCLSA-N 2 0 224.392 2.306 20 0 BEADRP C[C@@H](Cc1ccsc1)[NH2+]C[C@@H]([NH3+])C1CC1 ZINC000666835093 487883759 /nfs/dbraw/zinc/88/37/59/487883759.db2.gz ZNUMTQKNACCAGG-JOYOIKCWSA-N 2 0 224.373 2.006 20 0 BEADRP C[C@H](C[N@H+]1C[C@H]2C[NH+](C)C[C@H]2C1)C(C)(C)C ZINC000670270312 487887648 /nfs/dbraw/zinc/88/76/48/487887648.db2.gz RYTABQYMGDAEMI-UPJWGTAASA-N 2 0 224.392 2.162 20 0 BEADRP C[C@H](CC[NH3+])[NH2+]Cc1ccccc1C1CC1 ZINC000666831972 487888299 /nfs/dbraw/zinc/88/82/99/487888299.db2.gz XKPJJARTTMLOHA-LLVKDONJSA-N 2 0 218.344 2.391 20 0 BEADRP C[C@H](CC1CCC1)[NH2+][C@@H]1CC[NH2+]C[C@H]1C ZINC000666880450 487895810 /nfs/dbraw/zinc/89/58/10/487895810.db2.gz NCSSKPYCEMXRIP-NQBHXWOUSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H](C[NH2+]C1(C)CC[NH2+]CC1)C(C)(C)C ZINC000666882280 487895869 /nfs/dbraw/zinc/89/58/69/487895869.db2.gz VZQRJFRMJLUQAT-NSHDSACASA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H](C[NH2+][C@@H]1CC[NH2+][C@H](C)C1)C(C)(C)C ZINC000666874263 487896087 /nfs/dbraw/zinc/89/60/87/487896087.db2.gz VZACDGQTFBRLQF-QJPTWQEYSA-N 2 0 212.381 2.399 20 0 BEADRP CC1(C[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)CCC1 ZINC000666993917 487902061 /nfs/dbraw/zinc/90/20/61/487902061.db2.gz SSOCSWGZEFCAOH-GFCCVEGCSA-N 2 0 222.376 2.441 20 0 BEADRP Cc1cccc(C[NH2+][C@H]2CC23CC[NH2+]CC3)c1 ZINC000666950958 487913451 /nfs/dbraw/zinc/91/34/51/487913451.db2.gz UALKRJUTKJTVIW-AWEZNQCLSA-N 2 0 230.355 2.227 20 0 BEADRP Cc1cc(F)ccc1C[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000666952298 487914130 /nfs/dbraw/zinc/91/41/30/487914130.db2.gz PMIWKFZTLVXJCF-AWEZNQCLSA-N 2 0 248.345 2.366 20 0 BEADRP C(=C\c1ccccc1)\C[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000666952440 487914398 /nfs/dbraw/zinc/91/43/98/487914398.db2.gz WRDBHKRPTGLZAO-IJVDHGTGSA-N 2 0 242.366 2.432 20 0 BEADRP CC(C)(C)CC[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000666953616 487915079 /nfs/dbraw/zinc/91/50/79/487915079.db2.gz CAGROUDXGBCGGE-NSHDSACASA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC23CC[NH2+]CC3)C1 ZINC000666954073 487916155 /nfs/dbraw/zinc/91/61/55/487916155.db2.gz PCQXMQXUNNQPLT-FRRDWIJNSA-N 2 0 222.376 2.297 20 0 BEADRP [NH3+]C[C@@H]1CC[C@H]([NH2+]Cc2cccc(F)c2F)C1 ZINC000666962228 487920002 /nfs/dbraw/zinc/92/00/02/487920002.db2.gz UDDCNUICJHPROH-KOLCDFICSA-N 2 0 240.297 2.182 20 0 BEADRP C1CC2(C1)C[C@H]([NH2+]C1CCSCC1)CC[NH2+]2 ZINC000666995208 487920865 /nfs/dbraw/zinc/92/08/65/487920865.db2.gz GJQMRVAHVVBPAN-GFCCVEGCSA-N 2 0 240.416 2.146 20 0 BEADRP C[C@@H](CC1CCC1)[NH2+][C@H]1CCCC[NH2+]C1 ZINC000666993014 487923517 /nfs/dbraw/zinc/92/35/17/487923517.db2.gz WSLBDZGRPHPNFX-AAEUAGOBSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H](CC1CCC1)[NH2+][C@@H]1CCCC[NH2+]C1 ZINC000666993016 487923572 /nfs/dbraw/zinc/92/35/72/487923572.db2.gz WSLBDZGRPHPNFX-WCQYABFASA-N 2 0 210.365 2.297 20 0 BEADRP C([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)[C@H]1CCSC1 ZINC000666993954 487923803 /nfs/dbraw/zinc/92/38/03/487923803.db2.gz WMIKMHCQNXIAOZ-NEPJUHHUSA-N 2 0 240.416 2.004 20 0 BEADRP CC1(C[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)CC1 ZINC000666993838 487923954 /nfs/dbraw/zinc/92/39/54/487923954.db2.gz NTTGLDXBIZLQSV-LLVKDONJSA-N 2 0 208.349 2.051 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000666995571 487924831 /nfs/dbraw/zinc/92/48/31/487924831.db2.gz SHPPVWJEGYJTOH-AGIUHOORSA-N 2 0 222.376 2.439 20 0 BEADRP C[C@@H]1C[C@H](C)C[N@H+]1CCCC1CC[NH2+]CC1 ZINC000157983398 487931988 /nfs/dbraw/zinc/93/19/88/487931988.db2.gz PZDUFOJIIZFIPY-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]([NH3+])CN1CCc2ccc(F)cc2[C@H](C)C1 ZINC000652363292 487932515 /nfs/dbraw/zinc/93/25/15/487932515.db2.gz ACBPZOJQYCIBOG-MNOVXSKESA-N 2 0 236.334 2.135 20 0 BEADRP COCC1(CC[NH2+][C@@H]2CCC[C@H]([NH3+])C2)CCC1 ZINC000566480836 323000994 /nfs/dbraw/zinc/00/09/94/323000994.db2.gz BBVGCRDWOYDSJY-QWHCGFSZSA-N 2 0 240.391 2.053 20 0 BEADRP CCC[C@@H](C)[N@@H+]1CC[C@@H](c2nccn2C)C1 ZINC000564736288 323014430 /nfs/dbraw/zinc/01/44/30/323014430.db2.gz NQRFKYRAPDDCRK-VXGBXAGGSA-N 2 0 221.348 2.398 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000133407836 323018885 /nfs/dbraw/zinc/01/88/85/323018885.db2.gz PNXCHEIBBIVVKW-MJBXVCDLSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@H]([NH2+]CCC[NH2+]C(C)C)[C@@H]1C[C@H]1C ZINC000562956422 323034856 /nfs/dbraw/zinc/03/48/56/323034856.db2.gz SUMPYHRWEXDVAL-UPJWGTAASA-N 2 0 212.381 2.399 20 0 BEADRP Fc1ccc2c(c1)CC[C@@H]2[NH2+]CC1CC[NH2+]CC1 ZINC000572712683 323035369 /nfs/dbraw/zinc/03/53/69/323035369.db2.gz QPSVOKCHTQBTTI-HNNXBMFYSA-N 2 0 248.345 2.402 20 0 BEADRP CC[C@H]1CCC[C@H]1[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000562962798 323036713 /nfs/dbraw/zinc/03/67/13/323036713.db2.gz HBOOBOLVEACKFH-YNEHKIRRSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)c1ccoc1 ZINC000569833803 323042368 /nfs/dbraw/zinc/04/23/68/323042368.db2.gz AENDGVUMUWHBCK-NEPJUHHUSA-N 2 0 222.332 2.320 20 0 BEADRP C[C@@H]1C[C@H](C)[N@H+](C[C@H]2CCSC2)C[C@H]1C[NH3+] ZINC000397252918 323043100 /nfs/dbraw/zinc/04/31/00/323043100.db2.gz DHOZJYSHRXSKHC-YVECIDJPSA-N 2 0 242.432 2.045 20 0 BEADRP CC(C)[C@@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)C1CC1 ZINC000152473173 323046933 /nfs/dbraw/zinc/04/69/33/323046933.db2.gz CBAQYHSGINJPBW-IUODEOHRSA-N 2 0 236.403 2.495 20 0 BEADRP C([NH2+][C@@H]1CCC[C@H]2C[C@H]21)[C@H]1CC[N@@H+](C2CC2)C1 ZINC000408510475 323047100 /nfs/dbraw/zinc/04/71/00/323047100.db2.gz PVMWLGVKMFPXLZ-AYRXBEOTSA-N 2 0 234.387 2.249 20 0 BEADRP C[C@@H]1C[C@H](C)[N@H+](CCC(F)(F)F)C[C@H]1C[NH3+] ZINC000397358747 323048647 /nfs/dbraw/zinc/04/86/47/323048647.db2.gz FXCHDWFJEAYAJK-KXUCPTDWSA-N 2 0 238.297 2.244 20 0 BEADRP Cc1ccc(OCC[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)cc1 ZINC000570463200 323060152 /nfs/dbraw/zinc/06/01/52/323060152.db2.gz UTDJUFIUTGYASH-ZIAGYGMSSA-N 2 0 248.370 2.233 20 0 BEADRP CC(C)[C@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)C1CC1 ZINC000570562622 323063133 /nfs/dbraw/zinc/06/31/33/323063133.db2.gz HYLGVVWJPCIRHO-UONOGXRCSA-N 2 0 224.392 2.400 20 0 BEADRP COC[C@H]([NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21)C1CC1 ZINC000397299472 323087413 /nfs/dbraw/zinc/08/74/13/323087413.db2.gz CTTVNRIDWFBGHJ-ZNMIVQPWSA-N 2 0 246.354 2.146 20 0 BEADRP C[NH2+]CCSCc1ccc(C)nc1C ZINC000563081326 323088612 /nfs/dbraw/zinc/08/86/12/323088612.db2.gz PZFUBDKUAYMCJP-UHFFFAOYSA-N 2 0 210.346 2.151 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]Cc1cnc(C2CC2)s1 ZINC000563135907 323094895 /nfs/dbraw/zinc/09/48/95/323094895.db2.gz VYQHOZXYYOHHPS-IUCAKERBSA-N 2 0 239.388 2.236 20 0 BEADRP CC[NH2+]Cc1cccc(N[C@H]2CCC[C@@H]([NH3+])C2)c1 ZINC000563423379 323124219 /nfs/dbraw/zinc/12/42/19/323124219.db2.gz GVRHHOFPMCQHAM-HIFRSBDPSA-N 2 0 247.386 2.478 20 0 BEADRP Cc1ncc(CNc2cnccc2C)n1C ZINC000563433175 323125267 /nfs/dbraw/zinc/12/52/67/323125267.db2.gz RCXIQHZZFZFPTJ-UHFFFAOYSA-N 2 0 216.288 2.044 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)c1ccoc1 ZINC000563616068 323131525 /nfs/dbraw/zinc/13/15/25/323131525.db2.gz QNYRMMFSPIWNKF-OIMNJJJWSA-N 2 0 234.343 2.318 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)c1ccoc1 ZINC000563616069 323131534 /nfs/dbraw/zinc/13/15/34/323131534.db2.gz QNYRMMFSPIWNKF-UZGDPCLZSA-N 2 0 234.343 2.318 20 0 BEADRP Cc1cccc(CC[NH2+][C@H]2CCC[C@@H]2[NH3+])c1 ZINC000258956165 323146545 /nfs/dbraw/zinc/14/65/45/323146545.db2.gz KTCDBUYOWJEIHJ-KBPBESRZSA-N 2 0 218.344 2.007 20 0 BEADRP COc1ccc(C[NH2+]C[C@]2(C)CCC[NH2+]C2)cc1 ZINC000414900709 323151913 /nfs/dbraw/zinc/15/19/13/323151913.db2.gz IMMXPBQMENLJDS-OAHLLOKOSA-N 2 0 248.370 2.175 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+]C/C=C\c1ccccc1 ZINC000414956078 323152267 /nfs/dbraw/zinc/15/22/67/323152267.db2.gz MZHDQHASTMSHAA-VZFGUZNESA-N 2 0 230.355 2.287 20 0 BEADRP CC[NH+]1CCC([NH2+]CCc2ccc(C)o2)CC1 ZINC000531939861 323155444 /nfs/dbraw/zinc/15/54/44/323155444.db2.gz LFTYEWUPJQRXCB-UHFFFAOYSA-N 2 0 236.359 2.204 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H](c1cccnc1)C(C)C ZINC000571669300 323177044 /nfs/dbraw/zinc/17/70/44/323177044.db2.gz FGHDCOYLJSRMPO-CQSZACIVSA-N 2 0 235.375 2.368 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CCN2CC[C@@H](C)C2)C1 ZINC000308824572 323179326 /nfs/dbraw/zinc/17/93/26/323179326.db2.gz DGYBHMZVWBAVEN-JHJVBQTASA-N 2 0 210.365 2.106 20 0 BEADRP CCC1CC([NH2+]CCN2CC[C@H](C)C2)C1 ZINC000308970602 323182833 /nfs/dbraw/zinc/18/28/33/323182833.db2.gz ZDPUPJKZXDJSPP-HIFPTAJRSA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)[C@H]([NH2+][C@H]1CC[NH2+]C[C@@H]1C)C1CC1 ZINC000323953514 323188403 /nfs/dbraw/zinc/18/84/03/323188403.db2.gz AAYXGQJTRYINKS-DRZSPHRISA-N 2 0 210.365 2.009 20 0 BEADRP C[C@H](CC(C)(C)C)[NH2+][C@H]1CC[NH2+]C[C@@H]1C ZINC000395136329 323188828 /nfs/dbraw/zinc/18/88/28/323188828.db2.gz RTLRVQBKVZSEJH-TUAOUCFPSA-N 2 0 212.381 2.399 20 0 BEADRP CC[C@]1(C)CC[N@H+](C[C@H]([NH3+])CC(C)C)C1 ZINC000399422494 323205988 /nfs/dbraw/zinc/20/59/88/323205988.db2.gz VKEABJNQPGHWIN-CHWSQXEVSA-N 2 0 212.381 2.482 20 0 BEADRP COCC[C@H]1CCC[C@@H]1[NH2+]CCC[NH2+]C(C)C ZINC000563951261 323330301 /nfs/dbraw/zinc/33/03/01/323330301.db2.gz UKRWGQOIHXGRAY-KGLIPLIRSA-N 2 0 242.407 2.169 20 0 BEADRP CC(C)[C@@H]([NH2+]CCC[NH+]1CCCC1)C1CC1 ZINC000309375059 323348996 /nfs/dbraw/zinc/34/89/96/323348996.db2.gz RAIDHGOVLJMJLW-CQSZACIVSA-N 2 0 224.392 2.497 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H](C)c1ccccc1N(C)C ZINC000571872865 323491215 /nfs/dbraw/zinc/49/12/15/323491215.db2.gz HTNVLZWCDVMBQD-CYBMUJFWSA-N 2 0 249.402 2.403 20 0 BEADRP Cc1cc(C[NH2+][C@@H](C)CC[NH3+])c(C)s1 ZINC000572224073 323570051 /nfs/dbraw/zinc/57/00/51/323570051.db2.gz IITHWOYVLWVRQP-QMMMGPOBSA-N 2 0 212.362 2.192 20 0 BEADRP C[C@@H]([NH2+]CCC1CC[NH+](C)CC1)[C@H]1CC12CC2 ZINC000527857899 323711024 /nfs/dbraw/zinc/71/10/24/323711024.db2.gz FIFWLDHAAQFNOF-TZMCWYRMSA-N 2 0 236.403 2.497 20 0 BEADRP FCCC[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCCC[NH2+]1 ZINC000304297945 324199619 /nfs/dbraw/zinc/19/96/19/324199619.db2.gz ZXUDQOOKNJUUQR-JHJVBQTASA-N 2 0 228.355 2.246 20 0 BEADRP C[C@@H](CCC1CC1)[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000398105716 324217838 /nfs/dbraw/zinc/21/78/38/324217838.db2.gz VNABIGHLEMQGTR-WCQYABFASA-N 2 0 210.365 2.297 20 0 BEADRP CO[C@@H](C)C[NH+]1CCC(C[N@H+](C)C(C)C)CC1 ZINC000542923920 325063803 /nfs/dbraw/zinc/06/38/03/325063803.db2.gz MTXBRWPBBRMWLP-ZDUSSCGKSA-N 2 0 242.407 2.074 20 0 BEADRP CC(C)C[N@H+](C)CC[C@@H]1CCCC[NH+]1C ZINC000075860864 325317930 /nfs/dbraw/zinc/31/79/30/325317930.db2.gz FGQQGMNLEXDXDA-ZDUSSCGKSA-N 2 0 212.381 2.449 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)C(C)(C)C ZINC000133321653 325286581 /nfs/dbraw/zinc/28/65/81/325286581.db2.gz UFNNQNMKVZLSJX-NEPJUHHUSA-N 2 0 212.381 2.352 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H](C)CSC)CC1 ZINC000133932234 325332007 /nfs/dbraw/zinc/33/20/07/325332007.db2.gz YNCIIFORJGKJGO-NSHDSACASA-N 2 0 230.421 2.202 20 0 BEADRP C[C@@H]1C[C@H](C)[N@H+]1CC[C@H]1CCCC[NH+]1C ZINC000547769858 325394944 /nfs/dbraw/zinc/39/49/44/325394944.db2.gz UQGAMNQTQFQKPM-FRRDWIJNSA-N 2 0 210.365 2.344 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]CCC2CCCC2)C1 ZINC000086403286 325614329 /nfs/dbraw/zinc/61/43/29/325614329.db2.gz WDQFDVNLLKGOGP-OLZOCXBDSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)N[C@@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000566009785 325983981 /nfs/dbraw/zinc/98/39/81/325983981.db2.gz LPCWZMVINIWHGU-XUXIUFHCSA-N 2 0 241.423 2.013 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCC[C@H]([NH3+])C1)C(F)(F)F ZINC000566481334 326055700 /nfs/dbraw/zinc/05/57/00/326055700.db2.gz HFOXFYKQQASXJW-HRDYMLBCSA-N 2 0 224.270 2.044 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@@H]2C[C@H]2C2CCC2)C1 ZINC000566630580 326070540 /nfs/dbraw/zinc/07/05/40/326070540.db2.gz XLBWRYQSSDPHKZ-FVCCEPFGSA-N 2 0 208.349 2.035 20 0 BEADRP CC(C)(C[NH2+][C@@H]1CCC[C@@H]1[NH3+])C(F)(F)F ZINC000567226694 326140195 /nfs/dbraw/zinc/14/01/95/326140195.db2.gz JZHWNQDOTWNEHV-JGVFFNPUSA-N 2 0 224.270 2.044 20 0 BEADRP CC(C)(C[NH2+][C@H]1CCC[C@@H]1[NH3+])C(F)(F)F ZINC000567226696 326140263 /nfs/dbraw/zinc/14/02/63/326140263.db2.gz JZHWNQDOTWNEHV-YUMQZZPRSA-N 2 0 224.270 2.044 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CC[C@@H]2C2CC2)C1 ZINC000309987666 326178082 /nfs/dbraw/zinc/17/80/82/326178082.db2.gz ZEXSSEKPTANXGG-MRVWCRGKSA-N 2 0 222.376 2.106 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+][C@H](C)C[C@H](C)[NH3+])CO2 ZINC000567648429 326238708 /nfs/dbraw/zinc/23/87/08/326238708.db2.gz QJVJSFRGARDJIB-DMDPSCGWSA-N 2 0 234.343 2.144 20 0 BEADRP C[NH+](CCC[N@@H+](C)CC1CC1)CC1CC1 ZINC000157599612 326285694 /nfs/dbraw/zinc/28/56/94/326285694.db2.gz JIOGAWPYAGYGII-UHFFFAOYSA-N 2 0 210.365 2.060 20 0 BEADRP CC1CC[NH+](CCSCC[NH+](C)C)CC1 ZINC000157920030 326300151 /nfs/dbraw/zinc/30/01/51/326300151.db2.gz GFYWNLRKDZWQQJ-UHFFFAOYSA-N 2 0 230.421 2.013 20 0 BEADRP COC[C@@H](C)[NH2+]CCCC[NH+]1CCC(C)CC1 ZINC000158206394 326311823 /nfs/dbraw/zinc/31/18/23/326311823.db2.gz HNGBBHUWSFRRTL-CQSZACIVSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)C1CC1 ZINC000158250576 326312982 /nfs/dbraw/zinc/31/29/82/326312982.db2.gz DXKZCFSBKURKSH-GXTWGEPZSA-N 2 0 224.392 2.352 20 0 BEADRP CC[C@@H]([NH2+]CCCC[NH+]1CCOCC1)C(C)C ZINC000158807779 326344057 /nfs/dbraw/zinc/34/40/57/326344057.db2.gz DDCCJRRXUAAGKB-CQSZACIVSA-N 2 0 242.407 2.123 20 0 BEADRP CCc1cccc(C[N@@H+]2CCC[C@@H](C[NH3+])C2)c1 ZINC000568630903 326369392 /nfs/dbraw/zinc/36/93/92/326369392.db2.gz VEBMTIHIBBOZCR-HNNXBMFYSA-N 2 0 232.371 2.420 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]CC(C1CC1)C1CC1 ZINC000568749061 326374648 /nfs/dbraw/zinc/37/46/48/326374648.db2.gz UPUCSORANXLJAS-ABAIWWIYSA-N 2 0 236.403 2.400 20 0 BEADRP COC[C@H]([NH2+]CCC[NH2+]C(C)C)C1CCCC1 ZINC000568974363 326384182 /nfs/dbraw/zinc/38/41/82/326384182.db2.gz JWXJMBNOLUDDLW-AWEZNQCLSA-N 2 0 242.407 2.169 20 0 BEADRP Cc1ccc(F)cc1C[NH2+][C@H](C)C[C@@H](C)[NH3+] ZINC000569002497 326386096 /nfs/dbraw/zinc/38/60/96/326386096.db2.gz BXRQKQBANDQAKS-GHMZBOCLSA-N 2 0 224.323 2.350 20 0 BEADRP Cn1ccnc1[C@H]1CC[N@H+](CC2CCC2)C1 ZINC000569235843 326396906 /nfs/dbraw/zinc/39/69/06/326396906.db2.gz ZWEPABXFLNUYBA-LBPRGKRZSA-N 2 0 219.332 2.010 20 0 BEADRP CC(C)(C[NH2+][C@H]1CCC[NH2+]CC1)C(F)(F)F ZINC000572989749 326423338 /nfs/dbraw/zinc/42/33/38/326423338.db2.gz FCYZANSDBJZPPA-VIFPVBQESA-N 2 0 238.297 2.307 20 0 BEADRP CC[C@@H]1CCC[C@H]1[NH2+][C@H]1CCC[NH2+]CC1 ZINC000388621077 487972506 /nfs/dbraw/zinc/97/25/06/487972506.db2.gz HGSIIDFDJUXJJO-FRRDWIJNSA-N 2 0 210.365 2.297 20 0 BEADRP CC[NH+](CC)Cc1cccc2c1CC[NH2+]C2 ZINC000142705569 487982699 /nfs/dbraw/zinc/98/26/99/487982699.db2.gz RFMGAPJNPUPEFV-UHFFFAOYSA-N 2 0 218.344 2.174 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@H+](C)CC[C@H]1CCCC[NH+]1C ZINC000488336108 533713692 /nfs/dbraw/zinc/71/36/92/533713692.db2.gz SYXMAGKAVCJLJL-MGPQQGTHSA-N 2 0 224.392 2.449 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)C1 ZINC000400964860 488011840 /nfs/dbraw/zinc/01/18/40/488011840.db2.gz HEUYUPBNDSPMNW-XLWJZTARSA-N 2 0 236.403 2.400 20 0 BEADRP CCCC[N@H+](C)Cc1ccnn1-c1cc[nH+]cc1 ZINC000667472261 488016648 /nfs/dbraw/zinc/01/66/48/488016648.db2.gz AIQRSRAYMPTVKK-UHFFFAOYSA-N 2 0 244.342 2.499 20 0 BEADRP CC[N@H+](Cc1ccnn1-c1cc[nH+]cc1)C1CC1 ZINC000667501280 488031927 /nfs/dbraw/zinc/03/19/27/488031927.db2.gz SWAMPCFQKKBJCH-UHFFFAOYSA-N 2 0 242.326 2.252 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CCCC[C@@H]2C[NH3+])o1 ZINC000084216717 488037605 /nfs/dbraw/zinc/03/76/05/488037605.db2.gz HGWHQHJMYNQJCY-YPMHNXCESA-N 2 0 222.332 2.195 20 0 BEADRP CC(C)[C@@H](C)[NH2+]Cc1ccc(C[NH3+])cc1F ZINC000319022199 488038834 /nfs/dbraw/zinc/03/88/34/488038834.db2.gz RBODIUSNGHBORC-SNVBAGLBSA-N 2 0 224.323 2.419 20 0 BEADRP C[N@@H+](Cc1ccnn1-c1cc[nH+]cc1)CC1CC1 ZINC000667534248 488040475 /nfs/dbraw/zinc/04/04/75/488040475.db2.gz RQKDTKNIKYNECI-UHFFFAOYSA-N 2 0 242.326 2.109 20 0 BEADRP CC[C@@H]1CCC[N@@H+]1Cc1cnc(C)n1C ZINC000667544388 488041273 /nfs/dbraw/zinc/04/12/73/488041273.db2.gz FTSZUUMRMPONQD-LLVKDONJSA-N 2 0 207.321 2.103 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CCC[C@H]2C[NH3+])C1 ZINC000251975509 488066438 /nfs/dbraw/zinc/06/64/38/488066438.db2.gz YJQHBJYHXIZKCU-MROQNXINSA-N 2 0 210.365 2.282 20 0 BEADRP CC1(C)CCC[N@H+](C[C@@H]2CCC[NH2+]C2)CC1 ZINC000083680579 488071382 /nfs/dbraw/zinc/07/13/82/488071382.db2.gz JLAKXLNUTQUAGH-CYBMUJFWSA-N 2 0 224.392 2.498 20 0 BEADRP c1csc(C[N@@H+]2CC[C@]3(C2)CCC[NH2+]C3)c1 ZINC000257699610 488082621 /nfs/dbraw/zinc/08/26/21/488082621.db2.gz PSFVQROPKBHESG-CYBMUJFWSA-N 2 0 236.384 2.324 20 0 BEADRP CC(C)C[N@H+](CCC[NH3+])CC(C)(C)C ZINC000414711330 488082747 /nfs/dbraw/zinc/08/27/47/488082747.db2.gz SGXWQMQOZSYUGB-UHFFFAOYSA-N 2 0 200.370 2.339 20 0 BEADRP CC[C@]1([NH2+]CCC[NH+]2CCCCC2)CCOC1 ZINC000683043033 488103130 /nfs/dbraw/zinc/10/31/30/488103130.db2.gz JXEAKZDGDHPJOW-AWEZNQCLSA-N 2 0 240.391 2.021 20 0 BEADRP C([C@H]1CC[NH2+]C1)[N@@H+]1CCC[C@@H]2CCCC[C@@H]21 ZINC000225983648 488105147 /nfs/dbraw/zinc/10/51/47/488105147.db2.gz VREHMDIWTGXLNE-IHRRRGAJSA-N 2 0 222.376 2.251 20 0 BEADRP C([NH2+][C@@H]1CCC[C@@H]2C[C@@H]21)[C@H]1CC[N@@H+](C2CC2)C1 ZINC000378890530 488110202 /nfs/dbraw/zinc/11/02/02/488110202.db2.gz PVMWLGVKMFPXLZ-RJZRQDKASA-N 2 0 234.387 2.249 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CCC[N@H+](C[C@@H]2CC[C@H]3C[C@H]3C2)C1 ZINC000403637628 488131255 /nfs/dbraw/zinc/13/12/55/488131255.db2.gz OQKDMFNBXQTYKB-XPABHHOTSA-N 2 0 236.403 2.482 20 0 BEADRP C[NH2+]C1CC[NH+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC000403335004 488132868 /nfs/dbraw/zinc/13/28/68/488132868.db2.gz BBFUUWIFKZNHTD-UPJWGTAASA-N 2 0 222.376 2.106 20 0 BEADRP CC(C)(C)CC[N@@H+]1C[C@@H]2CCC[C@]2(C[NH3+])C1 ZINC000381556648 487539943 /nfs/dbraw/zinc/53/99/43/487539943.db2.gz OZDAVDZLORCZIK-JSGCOSHPSA-N 2 0 224.392 2.483 20 0 BEADRP C[N@H+](CCC[NH3+])C[C@H]1CCCCC1(C)C ZINC000382065918 487529935 /nfs/dbraw/zinc/52/99/35/487529935.db2.gz QCMMLPJBFODWQS-GFCCVEGCSA-N 2 0 212.381 2.483 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@H]1c1ccco1)C1CC[NH+](C)CC1 ZINC000666266948 487547705 /nfs/dbraw/zinc/54/77/05/487547705.db2.gz KKLMTQHILXENED-IACUBPJLSA-N 2 0 248.370 2.455 20 0 BEADRP CCN(CC[NH3+])Cc1nccc2ccccc21 ZINC000231819330 487477432 /nfs/dbraw/zinc/47/74/32/487477432.db2.gz BJVPIVMPWPJPJT-UHFFFAOYSA-N 2 0 229.327 2.015 20 0 BEADRP C[C@@H]([NH3+])[C@H]1CC[N@H+](CCC(C)(C)C2CC2)C1 ZINC000405986319 487495532 /nfs/dbraw/zinc/49/55/32/487495532.db2.gz CFSYSZQOHFTZDA-NEPJUHHUSA-N 2 0 224.392 2.482 20 0 BEADRP CC(C)(CC[NH+]1CCC(C[NH3+])CC1)C1CC1 ZINC000406061477 487498950 /nfs/dbraw/zinc/49/89/50/487498950.db2.gz MQIZBTUDHBHJSK-UHFFFAOYSA-N 2 0 224.392 2.483 20 0 BEADRP CC[C@@H](C[NH2+]CC1([NH3+])CCC1)CC(F)F ZINC000662266478 487502626 /nfs/dbraw/zinc/50/26/26/487502626.db2.gz MKGNIAZNLQFFKA-SECBINFHSA-N 2 0 220.307 2.139 20 0 BEADRP C[N@H+](CCC[NH3+])CCSc1ccc(F)cc1 ZINC000227747373 487512608 /nfs/dbraw/zinc/51/26/08/487512608.db2.gz OEYCHKHJRDZNGW-UHFFFAOYSA-N 2 0 242.363 2.198 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)CC1 ZINC000304615076 487512755 /nfs/dbraw/zinc/51/27/55/487512755.db2.gz SGCSWCBTGIFUOZ-HZSPNIEDSA-N 2 0 222.376 2.106 20 0 BEADRP CC[C@H](C)[NH+]1CCN(c2cc[nH+]cc2)CC1 ZINC000680010334 487516809 /nfs/dbraw/zinc/51/68/09/487516809.db2.gz MOCRTACAALJLML-LBPRGKRZSA-N 2 0 219.332 2.002 20 0 BEADRP C(CC1CCC1)C[N@@H+]1CC[C@@H]2[NH2+]CC[C@@H]2C1 ZINC000662274478 487522784 /nfs/dbraw/zinc/52/27/84/487522784.db2.gz UPXDSNJUUCTVHL-KGLIPLIRSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@]1(C[NH3+])CC[N@H+](CCCC2CCC2)C1 ZINC000662274039 487522851 /nfs/dbraw/zinc/52/28/51/487522851.db2.gz SMCXRVCAQXRUKN-CYBMUJFWSA-N 2 0 210.365 2.237 20 0 BEADRP C[C@@H](C[NH2+][C@@H]1CC[NH2+]C[C@H]1C)C(C)(C)C ZINC000379943451 488162413 /nfs/dbraw/zinc/16/24/13/488162413.db2.gz CPMSHDHIYYEHRC-GRYCIOLGSA-N 2 0 212.381 2.256 20 0 BEADRP Cc1cc(C)cc(C[NH2+][C@@H]2CN(C)C[C@@H]2C)c1 ZINC000674912997 487653183 /nfs/dbraw/zinc/65/31/83/487653183.db2.gz UFPHQMPSBYREFB-DZGCQCFKSA-N 2 0 232.371 2.343 20 0 BEADRP [NH3+]CCC1CC[NH+](C[C@@H]2CC[C@H]3C[C@H]3C2)CC1 ZINC000403750732 488136479 /nfs/dbraw/zinc/13/64/79/488136479.db2.gz OXYOWKJTRNDVSS-QLFBSQMISA-N 2 0 236.403 2.483 20 0 BEADRP [NH3+]C[C@]12CCC[C@H]1C[N@H+](Cc1ccsc1)C2 ZINC000390261171 488145206 /nfs/dbraw/zinc/14/52/06/488145206.db2.gz NVDVFULYYBQXBH-STQMWFEESA-N 2 0 236.384 2.309 20 0 BEADRP CN(CCC[NH+](C)C)Cc1ccc2c(c1)CCO2 ZINC000683367869 488153896 /nfs/dbraw/zinc/15/38/96/488153896.db2.gz IGETWMLWDFUOMS-UHFFFAOYSA-N 2 0 248.370 2.005 20 0 BEADRP Cc1ccccc1C[C@H](C)[N@H+](C)CCC[NH3+] ZINC000435383467 488170620 /nfs/dbraw/zinc/17/06/20/488170620.db2.gz GXNDHYWERKRBHJ-ZDUSSCGKSA-N 2 0 220.360 2.207 20 0 BEADRP CC(C)(C[NH2+]CCC[NH3+])c1ccccc1F ZINC000258702353 488193727 /nfs/dbraw/zinc/19/37/27/488193727.db2.gz GZVCOBGMMNQZCY-UHFFFAOYSA-N 2 0 224.323 2.042 20 0 BEADRP C[N@@H+]1CCCC[C@H]1CC[NH+]1CC[C@@H](C(F)F)C1 ZINC000677729297 488204559 /nfs/dbraw/zinc/20/45/59/488204559.db2.gz BUNUNYHOHPUMGE-NEPJUHHUSA-N 2 0 246.345 2.448 20 0 BEADRP C[NH2+]CCC1CC[NH+](CCC2CCC2)CC1 ZINC000398675495 488222845 /nfs/dbraw/zinc/22/28/45/488222845.db2.gz UVYPZLZYPGOQBR-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP CC[C@H]1C[N@H+](CCC2CCC2)CC[C@@H]1[NH3+] ZINC000398751680 488223810 /nfs/dbraw/zinc/22/38/10/488223810.db2.gz BYSHWFOIHCZORA-STQMWFEESA-N 2 0 210.365 2.236 20 0 BEADRP CO[C@@H](C)[C@@H](C)[NH2+]C1CCC(C[NH+](C)C)CC1 ZINC000678604018 488270331 /nfs/dbraw/zinc/27/03/31/488270331.db2.gz VLDYBNZAOYULOZ-KBHBFKLGSA-N 2 0 242.407 2.120 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H]2CCC(F)(F)C2)[C@H](C)C1 ZINC000679073690 488304482 /nfs/dbraw/zinc/30/44/82/488304482.db2.gz NFROUMNEVSRKOK-UTUOFQBUSA-N 2 0 246.345 2.494 20 0 BEADRP CCC1([NH2+][C@H]2CCN(C)[C@@H](C)C2)CCOCC1 ZINC000679152026 488313649 /nfs/dbraw/zinc/31/36/49/488313649.db2.gz XPBSZAUGHZZREQ-STQMWFEESA-N 2 0 240.391 2.018 20 0 BEADRP C[N@@H+]1CCCC[C@@H]1CC[NH+]1CC=CCC1 ZINC000679323816 488337786 /nfs/dbraw/zinc/33/77/86/488337786.db2.gz LWLGGUUAECEBGR-CYBMUJFWSA-N 2 0 208.349 2.123 20 0 BEADRP CC(C[NH+]1CC=CCC1)C[N@H+]1CC=CCC1 ZINC000679323945 488337845 /nfs/dbraw/zinc/33/78/45/488337845.db2.gz WCRVJZQTPJZWCF-UHFFFAOYSA-N 2 0 220.360 2.146 20 0 BEADRP C[NH2+]C[C@@H]1CCN(C/C=C\c2ccccc2)C1 ZINC000214449357 490113154 /nfs/dbraw/zinc/11/31/54/490113154.db2.gz PNVHGPMKHOVKRV-KKTNHOPESA-N 2 0 230.355 2.241 20 0 BEADRP CO[C@H]1CCC[C@H]([NH2+]CC(C)(C)C[NH+](C)C)C1 ZINC000070325463 490205848 /nfs/dbraw/zinc/20/58/48/490205848.db2.gz LDLPAUBQMZAVII-STQMWFEESA-N 2 0 242.407 2.121 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCC[C@H]3C[C@]32C)C1 ZINC000558621437 490282203 /nfs/dbraw/zinc/28/22/03/490282203.db2.gz MWRCRLXLBNEOAH-LXTVHRRPSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H](C[NH2+]CCC[NH+](C)C)C(C)(C)C ZINC000125774382 490441978 /nfs/dbraw/zinc/44/19/78/490441978.db2.gz RRXVXMAZLNQTOG-NSHDSACASA-N 2 0 200.370 2.210 20 0 BEADRP C[NH+](C)CC1CC[NH+](Cc2ccc(O)cc2)CC1 ZINC000131427293 490638238 /nfs/dbraw/zinc/63/82/38/490638238.db2.gz FVVSUVABUZNENS-UHFFFAOYSA-N 2 0 248.370 2.166 20 0 BEADRP C[N@@H+](Cc1ccc(O)cc1)CC1CC[NH+](C)CC1 ZINC000131442393 490640068 /nfs/dbraw/zinc/64/00/68/490640068.db2.gz GYUYBTUIIWVRFQ-UHFFFAOYSA-N 2 0 248.370 2.166 20 0 BEADRP C([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)C1CCCC1 ZINC000400942757 491069117 /nfs/dbraw/zinc/06/91/17/491069117.db2.gz BUGRDFCOCMYNSD-HZSPNIEDSA-N 2 0 222.376 2.154 20 0 BEADRP C([C@@H]1C[C@H]2C[C@H]2C1)[N@@H+]1CCCC[C@H]1[C@@H]1CC[NH2+]C1 ZINC000662275367 491085695 /nfs/dbraw/zinc/08/56/95/491085695.db2.gz BIORHJFHZDXEDQ-LJIZCISZSA-N 2 0 248.414 2.497 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CCSC1)C1CC[NH+](C)CC1 ZINC000228552522 491095514 /nfs/dbraw/zinc/09/55/14/491095514.db2.gz VBXBIPPJPXSPMY-NEPJUHHUSA-N 2 0 242.432 2.059 20 0 BEADRP CCCN1CC[C@H]([NH2+][C@@H]2C[C@H](C)[C@H]2C)C1 ZINC000395093428 491125224 /nfs/dbraw/zinc/12/52/24/491125224.db2.gz CZTJNRPKEWMIEE-QNWHQSFQSA-N 2 0 210.365 2.105 20 0 BEADRP CCCN1CC[C@H]([NH2+][C@@H]2C[C@@H](C)[C@H]2C)C1 ZINC000395093424 491125237 /nfs/dbraw/zinc/12/52/37/491125237.db2.gz CZTJNRPKEWMIEE-FVCCEPFGSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@@H]([NH2+]C1CC(F)(F)C1)C1CC[NH+](C)CC1 ZINC000309390574 491147878 /nfs/dbraw/zinc/14/78/78/491147878.db2.gz FSSBKHZAKUKJCC-SECBINFHSA-N 2 0 232.318 2.104 20 0 BEADRP C[C@@H]1C[C@H](C)C[N@@H+](CCC[NH2+]C2CSC2)C1 ZINC000309763981 491155993 /nfs/dbraw/zinc/15/59/93/491155993.db2.gz JFRARMAGXFQZOK-TXEJJXNPSA-N 2 0 242.432 2.059 20 0 BEADRP CC1(C)CCC(C[NH+]2C[C@@H]3C[NH2+]C[C@H]3C2)CC1 ZINC000310147503 491160554 /nfs/dbraw/zinc/16/05/54/491160554.db2.gz OGTZZHDLIRRYIY-KBPBESRZSA-N 2 0 236.403 2.354 20 0 BEADRP CSC[C@@H]1CCC[N@@H+]1C[C@H]1CC[NH2+][C@H](C)C1 ZINC000400115082 533749369 /nfs/dbraw/zinc/74/93/69/533749369.db2.gz JDWCSERQAQQCNM-AGIUHOORSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@H](CC1CC1)[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000400940942 533768071 /nfs/dbraw/zinc/76/80/71/533768071.db2.gz BEUXOMBTGKPRMC-RUZUBIRVSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H](CCC1CC1)[NH2+][C@@H](C)[C@H]1CCC[NH2+]1 ZINC000400332963 533824878 /nfs/dbraw/zinc/82/48/78/533824878.db2.gz DIWLZQQWPBFXJY-NTZNESFSSA-N 2 0 210.365 2.295 20 0 BEADRP CC[C@@H](C)C[N@H+](CC)[C@@H]1CCC[NH2+]CC1 ZINC000086439148 535512479 /nfs/dbraw/zinc/51/24/79/535512479.db2.gz KHIXURKDGLDEJI-CHWSQXEVSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC2CC[NH+](C3CC3)CC2)[C@@H]1C ZINC000494984518 533944776 /nfs/dbraw/zinc/94/47/76/533944776.db2.gz GBNWVUQDXINGJN-JMSVASOKSA-N 2 0 236.403 2.495 20 0 BEADRP CS[C@@H]1CCC[C@H]([NH2+][C@H](C)[C@@H]2CCC[NH2+]2)C1 ZINC000400345499 533961332 /nfs/dbraw/zinc/96/13/32/533961332.db2.gz KDMVPOLFLCCCOR-XQHKEYJVSA-N 2 0 242.432 2.391 20 0 BEADRP CS[C@@H]1CCC[C@H]([NH2+][C@@H](C)[C@H]2CCC[NH2+]2)C1 ZINC000400345498 533961406 /nfs/dbraw/zinc/96/14/06/533961406.db2.gz KDMVPOLFLCCCOR-WUHRBBMRSA-N 2 0 242.432 2.391 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H](C)CC1)[C@@H]1CCC[NH2+]1 ZINC000400639239 534012142 /nfs/dbraw/zinc/01/21/42/534012142.db2.gz NPTFXRSKFJPSGI-CYDGBPFRSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)C1 ZINC000400960199 534257654 /nfs/dbraw/zinc/25/76/54/534257654.db2.gz IKEQGJMBRZOPER-IKOXMDCHSA-N 2 0 222.376 2.153 20 0 BEADRP C[N@H+](CCC(C)(C)C)CC(C)(C)C[NH3+] ZINC000086637599 536314418 /nfs/dbraw/zinc/31/44/18/536314418.db2.gz PGOGFPHTJWIEFY-UHFFFAOYSA-N 2 0 200.370 2.339 20 0 BEADRP C[NH2+][C@@H](C)CNc1cc[nH+]c(C)c1Cl ZINC000261529371 536344979 /nfs/dbraw/zinc/34/49/79/536344979.db2.gz RQTMAQICZMETET-ZETCQYMHSA-N 2 0 213.712 2.063 20 0 BEADRP CC[N@H+](C)C[C@H]1CC[NH+](C[C@H]2CCSC2)C1 ZINC000494960058 527836602 /nfs/dbraw/zinc/83/66/02/527836602.db2.gz XPQLSXMEVCJQLA-CHWSQXEVSA-N 2 0 242.432 2.013 20 0 BEADRP CCC[NH+]1CCC([N@H+](C)C[C@@H]2C[C@H]2C)CC1 ZINC000488314550 528195074 /nfs/dbraw/zinc/19/50/74/528195074.db2.gz OJEKVDUNRGUADH-OLZOCXBDSA-N 2 0 224.392 2.449 20 0 BEADRP CC(C)C[N@@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000261629655 535141043 /nfs/dbraw/zinc/14/10/43/535141043.db2.gz DUIXZRPXWBRNMR-CABCVRRESA-N 2 0 232.371 2.317 20 0 BEADRP CCC[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCCC[NH2+]1 ZINC000086499891 535186683 /nfs/dbraw/zinc/18/66/83/535186683.db2.gz YJHUGCGXKOIEGL-FRRDWIJNSA-N 2 0 210.365 2.297 20 0 BEADRP CCC1(C[NH2+][C@@H]2CC[N@H+](C)C[C@H]2C)CC1 ZINC000252731049 535296483 /nfs/dbraw/zinc/29/64/83/535296483.db2.gz OAQAORWHXKEUOQ-VXGBXAGGSA-N 2 0 210.365 2.106 20 0 BEADRP CC[NH+](CC)C[C@@H]1CC[N@H+](CCCCF)C1 ZINC000352005088 535584433 /nfs/dbraw/zinc/58/44/33/535584433.db2.gz QGWNKAUGUAJTIW-ZDUSSCGKSA-N 2 0 230.371 2.400 20 0 BEADRP CC[NH+](CC)C[C@H]1CC[N@H+](CCCCF)C1 ZINC000352005087 535597688 /nfs/dbraw/zinc/59/76/88/535597688.db2.gz QGWNKAUGUAJTIW-CYBMUJFWSA-N 2 0 230.371 2.400 20 0 BEADRP CCC[C@H](C)[N@H+](C)CC[C@@H]1CCC[NH2+]C1 ZINC000051919029 535630057 /nfs/dbraw/zinc/63/00/57/535630057.db2.gz PYEUMORPPLPSMQ-STQMWFEESA-N 2 0 212.381 2.497 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CC2CCCC2)[C@@H](C)C1 ZINC000222681915 535768387 /nfs/dbraw/zinc/76/83/87/535768387.db2.gz BZYHWXRVAGGKKO-JSGCOSHPSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H]1CCC[N@@H+]1C[C@H]1CC[NH2+][C@H](C)C1 ZINC000261536478 535820528 /nfs/dbraw/zinc/82/05/28/535820528.db2.gz RWNYEXCVPFQXRV-FRRDWIJNSA-N 2 0 210.365 2.249 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+][C@H](C)CC[NH+](C)C ZINC000252033280 535942677 /nfs/dbraw/zinc/94/26/77/535942677.db2.gz ZSKOACMGGWVAJB-TUAOUCFPSA-N 2 0 200.370 2.351 20 0 BEADRP CC[C@@]1(C)CC[N@H+](C[C@@]2(C)CC[NH2+]C2)C1 ZINC000261557554 536048494 /nfs/dbraw/zinc/04/84/94/536048494.db2.gz XKGPJDLZNUOWIV-STQMWFEESA-N 2 0 210.365 2.108 20 0 BEADRP CC[C@H](CCO)C[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000227542257 536091352 /nfs/dbraw/zinc/09/13/52/536091352.db2.gz MBRODTKYPCJFLK-KCPJHIHWSA-N 2 0 248.370 2.129 20 0 BEADRP CC[C@H]1CC[C@@H]([NH2+]CC2CC[NH+](C)CC2)C1 ZINC000070643694 536093476 /nfs/dbraw/zinc/09/34/76/536093476.db2.gz KBWOQPWHNNAUAO-GXTWGEPZSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@H](COC)[NH2+]CCC[NH+]1CCC(C)CC1 ZINC000079707391 536121706 /nfs/dbraw/zinc/12/17/06/536121706.db2.gz QPTZJFQFFMUUIA-CQSZACIVSA-N 2 0 242.407 2.123 20 0 BEADRP CCc1ccc(C[N@@H+]2C[C@@H]3CC[C@H]([NH3+])[C@@H]3C2)cc1 ZINC000261587434 536179721 /nfs/dbraw/zinc/17/97/21/536179721.db2.gz VBPDECJCQVLOEJ-XHSDSOJGSA-N 2 0 244.382 2.418 20 0 BEADRP C[NH2+][C@@H]1CCCN(c2cc[nH+]c(C)c2Cl)C1 ZINC000261571608 536365963 /nfs/dbraw/zinc/36/59/63/536365963.db2.gz HPBDPVGBUUPJAC-SNVBAGLBSA-N 2 0 239.750 2.232 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+]CC1(C)CCCCC1 ZINC000234712800 536593641 /nfs/dbraw/zinc/59/36/41/536593641.db2.gz HORUOLUUVNSFOS-CYBMUJFWSA-N 2 0 242.407 2.300 20 0 BEADRP COc1cc(C[N@@H+]2CCC[C@H](C[NH3+])C2)ccc1C ZINC000261782251 536757162 /nfs/dbraw/zinc/75/71/62/536757162.db2.gz FOQOHDMNSYFFBO-CQSZACIVSA-N 2 0 248.370 2.174 20 0 BEADRP COc1cc(C[N@@H+]2CC[C@H]([NH3+])[C@@H](C)C2)ccc1C ZINC000262016358 536769807 /nfs/dbraw/zinc/76/98/07/536769807.db2.gz VSZYROQXOODIGO-JSGCOSHPSA-N 2 0 248.370 2.173 20 0 BEADRP COCC[C@@H](C)[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000347120403 536778249 /nfs/dbraw/zinc/77/82/49/536778249.db2.gz ZRJHQSJDYDTSJA-GFCCVEGCSA-N 2 0 240.391 2.018 20 0 BEADRP COc1ccc(C[NH2+][C@@H]2CC[N@H+](C)C[C@@H]2C)cc1 ZINC000222075266 536897965 /nfs/dbraw/zinc/89/79/65/536897965.db2.gz DXMIZAQHJGFTMO-SWLSCSKDSA-N 2 0 248.370 2.125 20 0 BEADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1C[NH3+] ZINC000145838489 537824598 /nfs/dbraw/zinc/82/45/98/537824598.db2.gz WMERLLDQCPOUQM-OCCSQVGLSA-N 2 0 218.344 2.103 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]C[C@@H](C)C2CC2)[C@H](C)C1 ZINC000166993463 538060417 /nfs/dbraw/zinc/06/04/17/538060417.db2.gz BFKMJMZKCAWKPO-BZPMIXESSA-N 2 0 224.392 2.352 20 0 BEADRP Cc1cc2[nH]ccc2c(N2CCC[C@@H]([NH3+])[C@@H]2C)[nH+]1 ZINC001157740991 970763502 /nfs/dbraw/zinc/76/35/02/970763502.db2.gz JDQYQBNFJDWLDV-CMPLNLGQSA-N 2 0 244.342 2.187 20 0 BEADRP CCCSC[C@@H](C)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000892946693 583015553 /nfs/dbraw/zinc/01/55/53/583015553.db2.gz KTVTYQGNBKVFRE-CHWSQXEVSA-N 2 0 244.448 2.450 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@H]2C[C@@H](O)c3ccccc32)C1 ZINC000854228998 588781095 /nfs/dbraw/zinc/78/10/95/588781095.db2.gz FRVLBMLQOPHIKZ-FDRIWYBQSA-N 2 0 246.354 2.024 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+]CC1([NH3+])CCCC1 ZINC000854223494 588780348 /nfs/dbraw/zinc/78/03/48/588780348.db2.gz PZZRDJOXIXIXPY-NWDGAFQWSA-N 2 0 210.365 2.282 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2CC[C@@H](c3ccco3)C2)CC1 ZINC000892019618 582762634 /nfs/dbraw/zinc/76/26/34/582762634.db2.gz NDJGDDNIXUNGAZ-CQSZACIVSA-N 2 0 248.370 2.411 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2CCC(C)(C)C2)CC1 ZINC000892022452 582763477 /nfs/dbraw/zinc/76/34/77/582763477.db2.gz YTPDWMWGMXEGLS-UHFFFAOYSA-N 2 0 210.365 2.060 20 0 BEADRP C[C@H]1CC[N@H+](CC2CC[NH+](C)CC2)C[C@H]1C ZINC000892066935 582782771 /nfs/dbraw/zinc/78/27/71/582782771.db2.gz ZRLYIJGNCUPQJM-QWHCGFSZSA-N 2 0 224.392 2.306 20 0 BEADRP C[C@@H]1CC[C@H](C)C[N@H+]1CC1CC[NH+](C)CC1 ZINC000892069316 582784413 /nfs/dbraw/zinc/78/44/13/582784413.db2.gz HWQYRMNCUJPWDC-QWHCGFSZSA-N 2 0 224.392 2.449 20 0 BEADRP C[C@@H]1CC[C@H](C)[N@H+]1CC1CC[NH+](C)CC1 ZINC000892224572 582810299 /nfs/dbraw/zinc/81/02/99/582810299.db2.gz XSPSXUNVTSYELF-TXEJJXNPSA-N 2 0 210.365 2.201 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCCC1(F)F)C1CC[NH+](C)CC1 ZINC000398040141 583118240 /nfs/dbraw/zinc/11/82/40/583118240.db2.gz RNPONMQWCNOUPF-ZYHUDNBSSA-N 2 0 246.345 2.494 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CC[C@@H]1CC1(Cl)Cl ZINC000857253850 583136730 /nfs/dbraw/zinc/13/67/30/583136730.db2.gz TYHFFQVUQRVXFD-DJLDLDEBSA-N 2 0 239.190 2.286 20 0 BEADRP CCCCCC[N@@H+]1C[C@H]2CCC[C@]2([NH3+])C1 ZINC000857086985 588886788 /nfs/dbraw/zinc/88/67/88/588886788.db2.gz OZSAIIDWCOHLON-OLZOCXBDSA-N 2 0 210.365 2.380 20 0 BEADRP CC[N@H+](CC1CCC1)CC1CC[NH+](C)CC1 ZINC000894175687 583326934 /nfs/dbraw/zinc/32/69/34/583326934.db2.gz DQBPDRJJVYPGEB-UHFFFAOYSA-N 2 0 224.392 2.450 20 0 BEADRP CC(C)[NH+]1CCC(CC[NH2+]C2CSC2)CC1 ZINC000877698274 583343759 /nfs/dbraw/zinc/34/37/59/583343759.db2.gz WGKUILDJSHXOAT-UHFFFAOYSA-N 2 0 242.432 2.202 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]CC[C@@H]1CC1(Cl)Cl ZINC000857253693 588901315 /nfs/dbraw/zinc/90/13/15/588901315.db2.gz RLGKADOSOZJDRI-IWSPIJDZSA-N 2 0 237.174 2.040 20 0 BEADRP CC(C)CCCC[NH2+][C@@H]1CCCN(C)C1 ZINC000147386792 583486417 /nfs/dbraw/zinc/48/64/17/583486417.db2.gz UDCSKCVINVCKHB-CYBMUJFWSA-N 2 0 212.381 2.497 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2C[C@H](C3CC3)[C@@H]2C2CC2)CC1 ZINC000894735100 583514102 /nfs/dbraw/zinc/51/41/02/583514102.db2.gz GJHKNPOCVHWLLA-CVEARBPZSA-N 2 0 248.414 2.449 20 0 BEADRP Cc1ncoc1C[NH2+]C(C)(C)CCC[NH+](C)C ZINC000894904217 583552827 /nfs/dbraw/zinc/55/28/27/583552827.db2.gz GUYHUNNLXBVCLW-UHFFFAOYSA-N 2 0 239.363 2.193 20 0 BEADRP C[NH+]1CCC(C[NH2+]C[C@@H]2C[C@H]2C2CCC2)CC1 ZINC000895006396 583566205 /nfs/dbraw/zinc/56/62/05/583566205.db2.gz PMADFHXELKJJDE-GJZGRUSLSA-N 2 0 236.403 2.354 20 0 BEADRP Cc1ccncc1CCC[NH2+]CC[C@@H](C)[NH+](C)C ZINC000895294475 583638109 /nfs/dbraw/zinc/63/81/09/583638109.db2.gz QCQUHPHQIUOGOM-CQSZACIVSA-N 2 0 249.402 2.252 20 0 BEADRP COC[C@@H](CC(C)(C)C)[NH2+]CC[C@H](C)[NH+](C)C ZINC000895292593 583639103 /nfs/dbraw/zinc/63/91/03/583639103.db2.gz RAUGZAPBGNUZEZ-QWHCGFSZSA-N 2 0 244.423 2.367 20 0 BEADRP CCCC[C@H](COC)[NH2+]CC[C@@H](C)[NH+](C)C ZINC000895293032 583638980 /nfs/dbraw/zinc/63/89/80/583638980.db2.gz FUDRPXMKKULNSM-CHWSQXEVSA-N 2 0 230.396 2.121 20 0 BEADRP C[C@H](CC[NH2+][C@@H](C)CC1CCOCC1)[NH+](C)C ZINC000895292942 583639263 /nfs/dbraw/zinc/63/92/63/583639263.db2.gz DZDCXYDTVQNHRT-QWHCGFSZSA-N 2 0 242.407 2.121 20 0 BEADRP CSC1CC[NH+](CC2CC[NH+](C)CC2)CC1 ZINC000895691057 583707510 /nfs/dbraw/zinc/70/75/10/583707510.db2.gz AYLPQWIJQHCHGR-UHFFFAOYSA-N 2 0 242.432 2.156 20 0 BEADRP CC[NH+](CC)CC1CC[NH+](CCC(C)=O)CC1 ZINC000728927514 583937230 /nfs/dbraw/zinc/93/72/30/583937230.db2.gz CUAZMMMYXYLFCN-UHFFFAOYSA-N 2 0 240.391 2.019 20 0 BEADRP CN1CCC([NH2+][C@H]2CCSC(C)(C)C2)CC1 ZINC000897797304 584049279 /nfs/dbraw/zinc/04/92/79/584049279.db2.gz FNMVNYLXZKQZLT-LBPRGKRZSA-N 2 0 242.432 2.344 20 0 BEADRP Cc1ncccc1CC[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000898251637 584100526 /nfs/dbraw/zinc/10/05/26/584100526.db2.gz GPYPNBCTTCQVPS-DOMZBBRYSA-N 2 0 247.386 2.005 20 0 BEADRP CCN1CCC[C@@H]1C[NH2+]Cc1ccccc1NC ZINC000902033612 584518928 /nfs/dbraw/zinc/51/89/28/584518928.db2.gz GEYHUTLBMWWPFF-CQSZACIVSA-N 2 0 247.386 2.302 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]([NH2+]C[C@@H]2CCCS2)C1 ZINC000902346750 584559462 /nfs/dbraw/zinc/55/94/62/584559462.db2.gz POHNMBZDMAGIIX-RYUDHWBXSA-N 2 0 242.432 2.250 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]([NH2+]CCC2CC2)C1 ZINC000902348047 584559477 /nfs/dbraw/zinc/55/94/77/584559477.db2.gz QLDQQLXZVHFVIV-GFCCVEGCSA-N 2 0 210.365 2.154 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]([NH2+]C2CC(F)(F)C2)C1 ZINC000902377192 584568440 /nfs/dbraw/zinc/56/84/40/584568440.db2.gz SONYZDCBASVUKT-VIFPVBQESA-N 2 0 232.318 2.152 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC[NH2+]CC(C)(C)C1)C1CC1 ZINC000902350862 584569164 /nfs/dbraw/zinc/56/91/64/584569164.db2.gz BXKRKZFRDLXVNG-YPMHNXCESA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H](C[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1)C1CC1 ZINC000902350861 584569281 /nfs/dbraw/zinc/56/92/81/584569281.db2.gz BXKRKZFRDLXVNG-WCQYABFASA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H]([NH2+]CC1([NH3+])CC1)[C@@H]1CCCC[C@H]1C ZINC000902406101 584574184 /nfs/dbraw/zinc/57/41/84/584574184.db2.gz LMMOPQLJEHVUGK-GRYCIOLGSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]([NH2+]CC1([NH3+])CC1)[C@H]1CCCC[C@H]1C ZINC000902406107 584574379 /nfs/dbraw/zinc/57/43/79/584574379.db2.gz LMMOPQLJEHVUGK-WOPDTQHZSA-N 2 0 210.365 2.282 20 0 BEADRP Cc1ccc2c(c1)[C@@H]([NH2+]CC1([NH3+])CC1)[C@H](C)C2 ZINC000902412520 584576184 /nfs/dbraw/zinc/57/61/84/584576184.db2.gz CGQCYNFTZQEQHF-RISCZKNCSA-N 2 0 230.355 2.309 20 0 BEADRP CC(C)[C@@H]1CCCC[C@@H]1[NH2+]CC1([NH3+])CC1 ZINC000902412545 584576416 /nfs/dbraw/zinc/57/64/16/584576416.db2.gz CUHIYSXKKZSHHW-RYUDHWBXSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)(F)C[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000902398388 584585820 /nfs/dbraw/zinc/58/58/20/584585820.db2.gz OZQKLEIFVJXYBH-SNVBAGLBSA-N 2 0 216.344 2.102 20 0 BEADRP C[C@]1(C[NH2+][C@@H]2CC[NH2+]CC(C)(C)C2)CC1(F)F ZINC000902400960 584587664 /nfs/dbraw/zinc/58/76/64/584587664.db2.gz YNVUEIOHUWZOMK-ZYHUDNBSSA-N 2 0 246.345 2.400 20 0 BEADRP [NH3+]C1(C[NH2+][C@H]2CCC[C@H](c3cccnc3)C2)CC1 ZINC000902405494 584588734 /nfs/dbraw/zinc/58/87/34/584588734.db2.gz IFCZLNSRRWGIOX-JSGCOSHPSA-N 2 0 245.370 2.189 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H]2CC[C@H]3CCCC[C@H]3C2)CC1 ZINC000902415548 584589502 /nfs/dbraw/zinc/58/95/02/584589502.db2.gz IKKJRYSHNZHFME-FRRDWIJNSA-N 2 0 222.376 2.426 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CC[C@H]1CCC(C)(C)CO1 ZINC000902428683 584594618 /nfs/dbraw/zinc/59/46/18/584594618.db2.gz GCLDVCMIOBXGLE-YNEHKIRRSA-N 2 0 242.407 2.297 20 0 BEADRP CC(C)(C[NH2+][C@H]1CCC[C@@H]1C[NH3+])C1CC1 ZINC000902432804 584595552 /nfs/dbraw/zinc/59/55/52/584595552.db2.gz PZGBYRIPPIXPBP-PWSUYJOCSA-N 2 0 210.365 2.140 20 0 BEADRP CC1(C)C[NH2+]C[C@@H]1[NH2+][C@H]1CCC[C@@H]1CCCF ZINC000902440834 584596921 /nfs/dbraw/zinc/59/69/21/584596921.db2.gz ARSOZOOVUFRAOL-AGIUHOORSA-N 2 0 242.382 2.492 20 0 BEADRP CCC[C@H](Cc1ccccc1)[NH2+]CC1([NH3+])CC1 ZINC000902414049 584599861 /nfs/dbraw/zinc/59/98/61/584599861.db2.gz RCAUWJAHEWMYBF-CQSZACIVSA-N 2 0 232.371 2.479 20 0 BEADRP CC[C@@H]([NH2+]CC1([NH3+])CC1)C1CCCCC1 ZINC000902415113 584601021 /nfs/dbraw/zinc/60/10/21/584601021.db2.gz AXNQONISSOMKGY-GFCCVEGCSA-N 2 0 210.365 2.426 20 0 BEADRP CC(C)[C@H]1CCC[C@@H]1[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902474141 584602001 /nfs/dbraw/zinc/60/20/01/584602001.db2.gz CWNZDDBPJWBSJM-PEBLQZBPSA-N 2 0 222.376 2.294 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)S2 ZINC000902447308 584604468 /nfs/dbraw/zinc/60/44/68/584604468.db2.gz RYZCUXWCSZCSOL-YATPEIPISA-N 2 0 240.416 2.143 20 0 BEADRP C[C@@H](CC1CCC1)[NH2+][C@H]1C[NH2+]CC1(C)C ZINC000902448111 584604772 /nfs/dbraw/zinc/60/47/72/584604772.db2.gz CHJHUMPZIHLBHU-JQWIXIFHSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)(C)[C@@H]1CC[C@@H]1[NH2+][C@@H]1C[NH2+]CC1(C)C ZINC000902447500 584605132 /nfs/dbraw/zinc/60/51/32/584605132.db2.gz YPSXDOJMFFMBFA-GRYCIOLGSA-N 2 0 224.392 2.399 20 0 BEADRP CC1CCC([NH2+][C@@H]2C[NH2+]CC2(C)C)CC1 ZINC000902447731 584605186 /nfs/dbraw/zinc/60/51/86/584605186.db2.gz VGWPYZXQLPXZGA-HTAVTVPLSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCSC(C)(C)C1)[C@@H]1CCC[NH2+]1 ZINC000902450050 584606503 /nfs/dbraw/zinc/60/65/03/584606503.db2.gz CBWZHSFVSQGIST-TUAOUCFPSA-N 2 0 242.432 2.391 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+][C@@H]2C[C@H]3CCC[C@@H]32)C12CCC2 ZINC000902452731 584607845 /nfs/dbraw/zinc/60/78/45/584607845.db2.gz AEIVYXGISBFGHQ-MLGHIDQZSA-N 2 0 220.360 2.035 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+][C@H]1CCSC(C)(C)C1 ZINC000902453251 584608117 /nfs/dbraw/zinc/60/81/17/584608117.db2.gz OGZDIPJFTIDBFL-QWRGUYRKSA-N 2 0 242.432 2.391 20 0 BEADRP C1CC2(C1)[NH2+]CC[C@@H]2[NH2+][C@H]1C[C@H]2CCC[C@@H]21 ZINC000902453081 584608322 /nfs/dbraw/zinc/60/83/22/584608322.db2.gz CCZDWXCZWPQYNP-VOAKCMCISA-N 2 0 220.360 2.049 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H]1CCSC(C)(C)C1 ZINC000902454281 584608422 /nfs/dbraw/zinc/60/84/22/584608422.db2.gz SCYFOEFHTPSLLA-GARJFASQSA-N 2 0 230.421 2.376 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@H]1CCSC(C)(C)C1 ZINC000902454279 584608709 /nfs/dbraw/zinc/60/87/09/584608709.db2.gz SCYFOEFHTPSLLA-AXFHLTTASA-N 2 0 230.421 2.376 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+][C@@H]1CCCC2(CC2)C1 ZINC000902455796 584609283 /nfs/dbraw/zinc/60/92/83/584609283.db2.gz YYWDZILGKGLGOC-VXGBXAGGSA-N 2 0 222.376 2.439 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2)C1CCCC1 ZINC000902466584 584613744 /nfs/dbraw/zinc/61/37/44/584613744.db2.gz MCDQKRZFIAYQOP-FTYKPCCVSA-N 2 0 208.349 2.048 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2)C1CCCC1 ZINC000902466586 584613956 /nfs/dbraw/zinc/61/39/56/584613956.db2.gz MCDQKRZFIAYQOP-GWNIPJSYSA-N 2 0 208.349 2.048 20 0 BEADRP C[C@H](CC(C)(C)C)[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902466069 584613965 /nfs/dbraw/zinc/61/39/65/584613965.db2.gz IPVYOWTWWOLWAK-WRWGMCAJSA-N 2 0 210.365 2.294 20 0 BEADRP CC(C)(C)[C@@H]1CC[C@H]1[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902466796 584614007 /nfs/dbraw/zinc/61/40/07/584614007.db2.gz MVJZKIJXKGQQQX-NJMOYASZSA-N 2 0 222.376 2.294 20 0 BEADRP C[C@@H]1CCCC[C@H]1[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902465476 584614027 /nfs/dbraw/zinc/61/40/27/584614027.db2.gz GFJVSAVZOJHVKI-NZEXEKPDSA-N 2 0 208.349 2.048 20 0 BEADRP C[C@H](CC(C)(C)C)[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902465729 584614192 /nfs/dbraw/zinc/61/41/92/584614192.db2.gz IPVYOWTWWOLWAK-WISYIIOYSA-N 2 0 210.365 2.294 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2)C1CCCCC1 ZINC000902466064 584614261 /nfs/dbraw/zinc/61/42/61/584614261.db2.gz JJULLSJBYGLZFO-SCUASFONSA-N 2 0 222.376 2.438 20 0 BEADRP CC(C)(C)[C@@H]1CC[C@@H]1[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902466795 584614298 /nfs/dbraw/zinc/61/42/98/584614298.db2.gz MVJZKIJXKGQQQX-NAWOPXAZSA-N 2 0 222.376 2.294 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2)C1CCSCC1 ZINC000902468268 584614950 /nfs/dbraw/zinc/61/49/50/584614950.db2.gz SPAWFYYAJUDTTC-ZBAXXZLZSA-N 2 0 240.416 2.001 20 0 BEADRP CCC[C@@H](N[C@@H]1C[C@H]2CC[C@@H]1[NH2+]2)c1cccnc1 ZINC000902468778 584615462 /nfs/dbraw/zinc/61/54/62/584615462.db2.gz VIOCDYZTYWZASW-APIJFGDWSA-N 2 0 245.370 2.405 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@@H]2C[C@H]3CC[C@@H]2[NH2+]3)[C@@H](C)C1 ZINC000902469171 584615711 /nfs/dbraw/zinc/61/57/11/584615711.db2.gz YOXYJNCGPKQTEZ-QTJJRWQNSA-N 2 0 222.376 2.294 20 0 BEADRP CC[C@H]([NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2)C1CCCC1 ZINC000902470275 584616370 /nfs/dbraw/zinc/61/63/70/584616370.db2.gz VWLLOAITOWCRTP-IGQOVBAYSA-N 2 0 222.376 2.438 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2)C1CCSCC1 ZINC000902469914 584616701 /nfs/dbraw/zinc/61/67/01/584616701.db2.gz SPAWFYYAJUDTTC-GWNIPJSYSA-N 2 0 240.416 2.001 20 0 BEADRP C[C@@H]1CCC[C@H](C)[C@H]1[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902470739 584616777 /nfs/dbraw/zinc/61/67/77/584616777.db2.gz GFSBCSXKHDJQJH-XADZXUCXSA-N 2 0 222.376 2.294 20 0 BEADRP CC[C@@H]([NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2)C1CCC1 ZINC000902470442 584616831 /nfs/dbraw/zinc/61/68/31/584616831.db2.gz XNLQRWCRSAIUBM-UMSGYPCISA-N 2 0 208.349 2.048 20 0 BEADRP C[C@H]1CC([NH2+][C@@H]2C[C@@H]3CC[C@H]2[NH2+]3)C[C@H](C)C1 ZINC000902471514 584617218 /nfs/dbraw/zinc/61/72/18/584617218.db2.gz PVZJMBYHYYMXLZ-KHQUWSPVSA-N 2 0 222.376 2.294 20 0 BEADRP C[C@@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1ccc(Cl)nc1 ZINC000902491408 584618025 /nfs/dbraw/zinc/61/80/25/584618025.db2.gz XBMCCGNPRJNPIW-FXPVBKGRSA-N 2 0 239.750 2.123 20 0 BEADRP C[C@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1cccs1 ZINC000902490932 584618311 /nfs/dbraw/zinc/61/83/11/584618311.db2.gz YRSIXNTVPRHSCA-GUBZILKMSA-N 2 0 210.346 2.136 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+][C@H]2C[C@H](C[NH3+])C2)cc1 ZINC000902490923 584618461 /nfs/dbraw/zinc/61/84/61/584618461.db2.gz YODCLHJMGXOMIR-YRGRVCCFSA-N 2 0 218.344 2.383 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H]1CC=CC[C@H]1C ZINC000902504333 584621686 /nfs/dbraw/zinc/62/16/86/584621686.db2.gz OASPKCLBHKJASM-FRRDWIJNSA-N 2 0 210.365 2.448 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+]C[C@H]1CCCCC[NH2+]1 ZINC000902481180 584623173 /nfs/dbraw/zinc/62/31/73/584623173.db2.gz ARFCHFJSKMKHKR-JHJVBQTASA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@H]2C[C@H](C[NH3+])C2)C[C@H]1C ZINC000902484182 584624737 /nfs/dbraw/zinc/62/47/37/584624737.db2.gz FFXANTVCNRIMKD-NJMOYASZSA-N 2 0 210.365 2.138 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+]C2CCC3(CC3)CC2)C1 ZINC000902486042 584625241 /nfs/dbraw/zinc/62/52/41/584625241.db2.gz OCWVKSCJDCVJMR-UMSPYCQHSA-N 2 0 208.349 2.036 20 0 BEADRP CC(C)C[C@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1ccccn1 ZINC000902485619 584625522 /nfs/dbraw/zinc/62/55/22/584625522.db2.gz BSJZTOXWYCOSFH-YDHLFZDLSA-N 2 0 247.386 2.496 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+][C@@H]2CCCc3sccc32)C1 ZINC000902487476 584626585 /nfs/dbraw/zinc/62/65/85/584626585.db2.gz HGJDJVYUMUWARF-CKYFFXLPSA-N 2 0 236.384 2.452 20 0 BEADRP C[C@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1ccc2c(c1)CCO2 ZINC000902487485 584626779 /nfs/dbraw/zinc/62/67/79/584626779.db2.gz HJYUCAKSNQGVIN-MJVIPROJSA-N 2 0 246.354 2.009 20 0 BEADRP CCOc1ccccc1[C@H](C)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902488045 584626814 /nfs/dbraw/zinc/62/68/14/584626814.db2.gz IVSFMXQLHAHSSA-AVGNSLFASA-N 2 0 248.370 2.473 20 0 BEADRP Cc1cccc([C@@H](C)[NH2+][C@H]2C[C@H](C[NH3+])C2)c1 ZINC000902487519 584626821 /nfs/dbraw/zinc/62/68/21/584626821.db2.gz IGIKCEJRTPXHMH-YRGRVCCFSA-N 2 0 218.344 2.383 20 0 BEADRP C[C@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)C1CCCCC1 ZINC000902489496 584627189 /nfs/dbraw/zinc/62/71/89/584627189.db2.gz SBQZGRKMPCDUCC-GVXVVHGQSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1cc(F)ccc1F ZINC000902489442 584627217 /nfs/dbraw/zinc/62/72/17/584627217.db2.gz QYVZZNOMHPOVKB-QXEWZRGKSA-N 2 0 240.297 2.353 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@H]2C[C@H](C[NH3+])C2)[C@H]1C ZINC000902488673 584627489 /nfs/dbraw/zinc/62/74/89/584627489.db2.gz ZRSJKFNSUORSLW-MLGHIDQZSA-N 2 0 210.365 2.138 20 0 BEADRP Cc1ccc2c(c1)[C@@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)CC2 ZINC000902489305 584627602 /nfs/dbraw/zinc/62/76/02/584627602.db2.gz OMPMLBYIZFXIHY-WHOFXGATSA-N 2 0 230.355 2.309 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@H](c1ccncc1)C1CC1 ZINC000902515186 584629378 /nfs/dbraw/zinc/62/93/78/584629378.db2.gz UAJWNLUYCQKQJC-WDMOLILDSA-N 2 0 233.359 2.248 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]([NH2+]C/C=C/Cl)C1 ZINC000902521774 584631469 /nfs/dbraw/zinc/63/14/69/584631469.db2.gz UOMAPLIFVKIEKL-RXNUUUNCSA-N 2 0 216.756 2.107 20 0 BEADRP C[C@H]([NH2+]C1(C)C(C)(C)C1(C)C)C1C[NH2+]C1 ZINC000902521002 584631585 /nfs/dbraw/zinc/63/15/85/584631585.db2.gz QPKFCMHPFPHHPJ-VIFPVBQESA-N 2 0 210.365 2.009 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+]C2C[C@@H]3CCC[C@H]3C2)C1 ZINC000902796983 584674901 /nfs/dbraw/zinc/67/49/01/584674901.db2.gz SARCGRACNOVHRP-RDBSUJKOSA-N 2 0 236.403 2.497 20 0 BEADRP C[N@H+]1CC=C(C[NH2+][C@@H]2C[C@H]3CCC[C@H]3C2)CC1 ZINC000902896931 584691396 /nfs/dbraw/zinc/69/13/96/584691396.db2.gz NKSBWLJYQAYUOR-QDMKHBRRSA-N 2 0 234.387 2.417 20 0 BEADRP C[C@@H]1C[C@H]1C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C1CC1 ZINC000903079323 584724631 /nfs/dbraw/zinc/72/46/31/584724631.db2.gz LXSOTDNWKYVAEN-AAQXDXKCSA-N 2 0 234.387 2.390 20 0 BEADRP CCCSC[C@@H](C)[NH2+]C[C@@H](C)C[NH+](C)C ZINC000903174900 584732826 /nfs/dbraw/zinc/73/28/26/584732826.db2.gz OQKNOANJNSIIQI-VXGBXAGGSA-N 2 0 232.437 2.305 20 0 BEADRP CCCSC[C@H](C)[NH2+]C[C@H](C)C[NH+](C)C ZINC000903174899 584732830 /nfs/dbraw/zinc/73/28/30/584732830.db2.gz OQKNOANJNSIIQI-RYUDHWBXSA-N 2 0 232.437 2.305 20 0 BEADRP CCCSC[C@H](C)[NH2+]C[C@@H](C)C[NH+](C)C ZINC000903174897 584732842 /nfs/dbraw/zinc/73/28/42/584732842.db2.gz OQKNOANJNSIIQI-NEPJUHHUSA-N 2 0 232.437 2.305 20 0 BEADRP C1=C[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C2CC2)CC1 ZINC000903199671 584734624 /nfs/dbraw/zinc/73/46/24/584734624.db2.gz LSYGVCMARNSSBH-IKKMQULASA-N 2 0 232.371 2.452 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@@H]2C[C@H]2[C@@H]2C[C@H]2C)CC1 ZINC000903253108 584738996 /nfs/dbraw/zinc/73/89/96/584738996.db2.gz JGSUHPGVBJZUBD-REBRKWNGSA-N 2 0 236.403 2.493 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H]2C[C@H]2[C@@H]2C[C@H]2C)[C@H](C)C1 ZINC000903255667 584739796 /nfs/dbraw/zinc/73/97/96/584739796.db2.gz YSZZSTBPMUCYSR-PMXAPFLYSA-N 2 0 236.403 2.351 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H]2C[C@H]2[C@@H]2C[C@H]2C)[C@@H](C)C1 ZINC000903255665 584739998 /nfs/dbraw/zinc/73/99/98/584739998.db2.gz YSZZSTBPMUCYSR-BYGOPZEFSA-N 2 0 236.403 2.351 20 0 BEADRP C[C@@H]1C[N@H+](Cc2ccc3cc[nH]c3c2)CC[C@@H]1[NH3+] ZINC000903425254 584760927 /nfs/dbraw/zinc/76/09/27/584760927.db2.gz YNMIEXWSIYVZSE-RISCZKNCSA-N 2 0 243.354 2.337 20 0 BEADRP C[C@](C[NH3+])([NH2+]Cc1ccc2cc[nH]c2c1)C1CC1 ZINC000903426069 584761276 /nfs/dbraw/zinc/76/12/76/584761276.db2.gz DXXKWXCPOMRSGG-OAHLLOKOSA-N 2 0 243.354 2.385 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@@H+]1CCc2ccccc2[C@@H]1C ZINC000903434867 584762116 /nfs/dbraw/zinc/76/21/16/584762116.db2.gz LVQGWFVZZYXVEW-IPYPFGDCSA-N 2 0 244.382 2.461 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@@H+]1C[C@H](C)CCC[C@H]1C ZINC000903440172 584763163 /nfs/dbraw/zinc/76/31/63/584763163.db2.gz VIHVLHLIIJHKFT-SYQHCUMBSA-N 2 0 224.392 2.352 20 0 BEADRP CC[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1CC[C@H]([NH3+])C1 ZINC000903458511 584765437 /nfs/dbraw/zinc/76/54/37/584765437.db2.gz BTHZIXRYABQUQI-FVCCEPFGSA-N 2 0 210.365 2.282 20 0 BEADRP Cc1ccccc1C1([NH2+]C[C@@H]2C[NH2+]C[C@H]2C)CC1 ZINC000903460662 584766662 /nfs/dbraw/zinc/76/66/62/584766662.db2.gz HDHVWBIVNARHJV-KGLIPLIRSA-N 2 0 244.382 2.429 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1CC2(C[C@@H]1C)CC[NH2+]CC2 ZINC000903459846 584766690 /nfs/dbraw/zinc/76/66/90/584766690.db2.gz OQRYVAVKLKWLRD-MJBXVCDLSA-N 2 0 236.403 2.497 20 0 BEADRP CC1([NH3+])CC[NH+](C[C@H]2C[C@@H]3[C@H](C2)C3(F)F)CC1 ZINC000903449526 584771126 /nfs/dbraw/zinc/77/11/26/584771126.db2.gz GDOMVXIZTNZXOJ-JGPRNRPPSA-N 2 0 244.329 2.091 20 0 BEADRP CC1([NH3+])CC[NH+](Cc2ccc3cc[nH]c3c2)CC1 ZINC000903449859 584771577 /nfs/dbraw/zinc/77/15/77/584771577.db2.gz IZELDAKHFUBAEP-UHFFFAOYSA-N 2 0 243.354 2.481 20 0 BEADRP [NH3+]CCC[N@H+](CCOC1CC1)CC1CCCC1 ZINC000903453129 584772901 /nfs/dbraw/zinc/77/29/01/584772901.db2.gz ZZRIZJKGUQWOPO-UHFFFAOYSA-N 2 0 240.391 2.006 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@@H+]1CCC[C@@H]1c1cccnc1 ZINC000903454643 584773414 /nfs/dbraw/zinc/77/34/14/584773414.db2.gz GWOFIFIRWOCLNA-VHDGCEQUSA-N 2 0 245.370 2.074 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[N@@H+]2CCc3ccc(F)cc3C2)C1 ZINC000903455370 584774226 /nfs/dbraw/zinc/77/42/26/584774226.db2.gz WAAUWEBQDJIIOQ-XHDPSFHLSA-N 2 0 248.345 2.311 20 0 BEADRP C(C[NH2+][C@@H]1CC[NH2+]C12CCC2)CC1CCC1 ZINC000903471442 584775342 /nfs/dbraw/zinc/77/53/42/584775342.db2.gz JBDMKAPUKOGHPY-CYBMUJFWSA-N 2 0 222.376 2.441 20 0 BEADRP FC1(F)CC[C@@H](C[NH2+][C@@H]2CC[NH2+]C23CCC3)C1 ZINC000903472318 584775870 /nfs/dbraw/zinc/77/58/70/584775870.db2.gz RWEIUCGEDHCVME-GHMZBOCLSA-N 2 0 244.329 2.296 20 0 BEADRP FC1(F)CC[C@@H](C[NH2+][C@H]2CC[NH2+]C23CCC3)C1 ZINC000903472319 584775900 /nfs/dbraw/zinc/77/59/00/584775900.db2.gz RWEIUCGEDHCVME-MNOVXSKESA-N 2 0 244.329 2.296 20 0 BEADRP C([NH2+][C@H]1CC[NH2+]C12CCCC2)[C@@H]1C[C@H]2C[C@H]2C1 ZINC000903481923 584778843 /nfs/dbraw/zinc/77/88/43/584778843.db2.gz QLVCRPOFBZVETE-CRWXNKLISA-N 2 0 234.387 2.297 20 0 BEADRP COCCCCC[NH2+][C@@H]1CC[NH2+]C12CCCC2 ZINC000903482972 584778942 /nfs/dbraw/zinc/77/89/42/584778942.db2.gz ALTNDMVZZJZLPH-CYBMUJFWSA-N 2 0 240.391 2.067 20 0 BEADRP C[C@@H]([NH3+])[C@@H]1CCC[N@H+](CC2CC(C)C2)C1 ZINC000903716266 584794332 /nfs/dbraw/zinc/79/43/32/584794332.db2.gz LESVNSHWTXHJCB-POOIEITISA-N 2 0 210.365 2.092 20 0 BEADRP CC1CC(C[N@@H+]2CCC[C@@]3(CC[NH2+]C3)C2)C1 ZINC000903751211 584795670 /nfs/dbraw/zinc/79/56/70/584795670.db2.gz FTKYSOJGLFOXSX-RUXDESIVSA-N 2 0 222.376 2.108 20 0 BEADRP CC1CC(C[NH+]2CCC(CC[NH3+])CC2)C1 ZINC000903768197 584798359 /nfs/dbraw/zinc/79/83/59/584798359.db2.gz LWCNLQCRUDUPFY-UHFFFAOYSA-N 2 0 210.365 2.093 20 0 BEADRP C[C@@H](C[NH2+][C@H]1C[NH2+]CC1(C)C)C(C)(C)C ZINC000903821642 584803808 /nfs/dbraw/zinc/80/38/08/584803808.db2.gz OLUXVRVWVAWKLL-QWRGUYRKSA-N 2 0 212.381 2.256 20 0 BEADRP C[C@]12C[N@H+](C[C@H]3CCC[NH2+]C3)C[C@H]1[C@H]1CC[C@@H]2C1 ZINC000903827767 584804898 /nfs/dbraw/zinc/80/48/98/584804898.db2.gz WRIGUBBUYLXCDW-ARKGTOAJSA-N 2 0 248.414 2.354 20 0 BEADRP Cc1cccc(C)c1C[N@H+](C)C[C@@H]1CC[NH2+]C1 ZINC000903827477 584805184 /nfs/dbraw/zinc/80/51/84/584805184.db2.gz UFPFDNVVNQVVHT-CQSZACIVSA-N 2 0 232.371 2.345 20 0 BEADRP C[C@]12C[N@H+](C[C@@H]3CC[C@H]([NH3+])C3)C[C@H]1[C@H]1C=C[C@@H]2C1 ZINC000903827443 584805201 /nfs/dbraw/zinc/80/52/01/584805201.db2.gz SVYFXSWOYXRAQP-YUDUXTHKSA-N 2 0 246.398 2.258 20 0 BEADRP CC(C)([NH3+])CC[NH2+]C/C=C/c1ccccc1 ZINC000903938437 584826137 /nfs/dbraw/zinc/82/61/37/584826137.db2.gz ALUIROFNHAVJJS-RMKNXTFCSA-N 2 0 218.344 2.417 20 0 BEADRP C[C@H]([NH3+])c1ccc(NC[C@@H]([NH3+])CC(F)F)cc1 ZINC000903918168 584827030 /nfs/dbraw/zinc/82/70/30/584827030.db2.gz UDFYFTWZOUNRDZ-WPRPVWTQSA-N 2 0 243.301 2.101 20 0 BEADRP CC(C)C[C@@H](C)C[NH2+]CCC(C)(C)[NH3+] ZINC000903939597 584828895 /nfs/dbraw/zinc/82/88/95/584828895.db2.gz JVUOQZXIGPIGDE-LLVKDONJSA-N 2 0 200.370 2.386 20 0 BEADRP CCCC(CCC)[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000903968445 584834897 /nfs/dbraw/zinc/83/48/97/584834897.db2.gz WNKYUAGOFJRZBQ-NEPJUHHUSA-N 2 0 212.381 2.400 20 0 BEADRP Cc1cccc(C[NH2+]CC[C@@H]2C[NH2+]C[C@H]2C)c1 ZINC000903973189 584832657 /nfs/dbraw/zinc/83/26/57/584832657.db2.gz AXLHEMCIONTBIP-UKRRQHHQSA-N 2 0 232.371 2.330 20 0 BEADRP CC(C)CCC[C@@H](C)[NH2+][C@@H]1C[NH2+]C[C@H]1C ZINC000903963861 584833497 /nfs/dbraw/zinc/83/34/97/584833497.db2.gz IABXRPMSTQARBD-JHJVBQTASA-N 2 0 212.381 2.399 20 0 BEADRP CCOc1ccc(C[NH2+]C[C@@H]2C[NH2+]C[C@H]2C)cc1 ZINC000903964346 584834163 /nfs/dbraw/zinc/83/41/63/584834163.db2.gz JWEBNNKFSXZDEM-OCCSQVGLSA-N 2 0 248.370 2.030 20 0 BEADRP CC[C@H]1CCC[C@H]([NH2+][C@@H]2C[NH2+]C[C@H]2C)C1 ZINC000903964092 584834170 /nfs/dbraw/zinc/83/41/70/584834170.db2.gz LHTFSQQFQJEZLJ-MROQNXINSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H](CCC(F)(F)F)[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000903967017 584834634 /nfs/dbraw/zinc/83/46/34/584834634.db2.gz DDYUOHBQNJTPJI-UTLUCORTSA-N 2 0 238.297 2.163 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+][C@@H]1CCC[C@H](C2CC2)C1 ZINC000903965095 584834646 /nfs/dbraw/zinc/83/46/46/584834646.db2.gz ZWNMIGZRUZIJRT-YXCITZCRSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+]CCC1CCCCC1 ZINC000903964822 584834707 /nfs/dbraw/zinc/83/47/07/584834707.db2.gz WOLVQBYPRUCWJG-DGCLKSJQSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+]C[C@H]1CCCC[C@H]1C ZINC000903967068 584835210 /nfs/dbraw/zinc/83/52/10/584835210.db2.gz GDMGLJRADQUVBC-SYQHCUMBSA-N 2 0 224.392 2.258 20 0 BEADRP C[N@@H+](Cc1ccc(F)cc1F)C[C@H]1C[C@@H]([NH3+])C1 ZINC000904306567 584862058 /nfs/dbraw/zinc/86/20/58/584862058.db2.gz ABSCUKXMARJFRU-WVSHTKLVSA-N 2 0 240.297 2.134 20 0 BEADRP C[N@H+](CCCc1ccccc1)C[C@H]1C[C@@H]([NH3+])C1 ZINC000904307832 584862731 /nfs/dbraw/zinc/86/27/31/584862731.db2.gz GPDMENYUMSTNAR-GASCZTMLSA-N 2 0 232.371 2.288 20 0 BEADRP CC(C)(C)CC[C@H]([NH3+])C[NH2+][C@H](CO)C(C)(C)C ZINC000904338556 584864989 /nfs/dbraw/zinc/86/49/89/584864989.db2.gz SXNBBEUECUTLEF-NWDGAFQWSA-N 2 0 244.423 2.137 20 0 BEADRP CC(C)C[C@H]1CCC[N@H+](C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000904325292 584865208 /nfs/dbraw/zinc/86/52/08/584865208.db2.gz VFVNUMKYOWYUBU-MCIONIFRSA-N 2 0 224.392 2.482 20 0 BEADRP CCS[C@H]1CC[C@@H]([N@H+](C)C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000904325960 584865576 /nfs/dbraw/zinc/86/55/76/584865576.db2.gz AAKKGWVSOXTOGV-XQHKEYJVSA-N 2 0 242.432 2.330 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+]C2(c3cccc(F)c3)CC2)C1 ZINC000904329957 584866125 /nfs/dbraw/zinc/86/61/25/584866125.db2.gz VNBVIJGNAZYBSC-GSJFWJNXSA-N 2 0 234.318 2.142 20 0 BEADRP C[C@@H]1C[N@H+](C[C@H]2C[C@@H]([NH3+])C2)[C@H]2CCCC[C@H]12 ZINC000904330686 584866237 /nfs/dbraw/zinc/86/62/37/584866237.db2.gz AKVGUKXDOOBUCG-RGDJUOJXSA-N 2 0 222.376 2.234 20 0 BEADRP CCCC[C@@H](C[NH3+])NC[C@H]([NH3+])CCC(C)(C)C ZINC000904350887 584869459 /nfs/dbraw/zinc/86/94/59/584869459.db2.gz RXARTPBFROFUIA-OLZOCXBDSA-N 2 0 243.439 2.247 20 0 BEADRP C[NH2+]CCCNCc1ccc(C(F)F)c(F)c1 ZINC000904353185 584869738 /nfs/dbraw/zinc/86/97/38/584869738.db2.gz HVLFPVVCLMDJRK-UHFFFAOYSA-N 2 0 246.276 2.462 20 0 BEADRP [NH3+]CC1CC(Nc2ccc3c(c2)CCCN3)C1 ZINC000904354463 584870285 /nfs/dbraw/zinc/87/02/85/584870285.db2.gz ZCIQPBPALVBVOF-UHFFFAOYSA-N 2 0 231.343 2.194 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]C[C@H]([NH3+])CCC(C)(C)C ZINC000904354842 584870905 /nfs/dbraw/zinc/87/09/05/584870905.db2.gz JOXBXAPQGHUIRP-QWHCGFSZSA-N 3 0 243.439 2.247 20 0 BEADRP Cc1ccc(NC2CC(C[NH3+])C2)c(C[NH+](C)C)c1 ZINC000904359131 584871737 /nfs/dbraw/zinc/87/17/37/584871737.db2.gz DJVHOEFKRHMIAH-UHFFFAOYSA-N 2 0 247.386 2.206 20 0 BEADRP C[C@@H](Cc1cccs1)[NH2+]C1CC(C[NH3+])C1 ZINC000904362447 584871981 /nfs/dbraw/zinc/87/19/81/584871981.db2.gz NKFQFBXHYCYXSV-WHXUTIOJSA-N 2 0 224.373 2.006 20 0 BEADRP CC(C)(C)CC[C@@H]([NH3+])C[NH2+]CCc1ccccn1 ZINC000904368406 584872737 /nfs/dbraw/zinc/87/27/37/584872737.db2.gz RHEHAHVPMPIPMS-CYBMUJFWSA-N 2 0 249.402 2.367 20 0 BEADRP C[C@@H]1CC[C@@H](C[NH2+]C[C@@H]([NH3+])CCC(C)(C)C)O1 ZINC000904370537 584873069 /nfs/dbraw/zinc/87/30/69/584873069.db2.gz AIGQTHGZHQCFPI-AGIUHOORSA-N 2 0 242.407 2.297 20 0 BEADRP Cc1ccccc1[C@@H](C)[NH2+]C1CC(C[NH3+])C1 ZINC000904363661 584874306 /nfs/dbraw/zinc/87/43/06/584874306.db2.gz APNTZENVTRHOER-PNESKVBLSA-N 2 0 218.344 2.383 20 0 BEADRP Cc1cccc(OC[C@@H](C)[NH2+]C2CC(C[NH3+])C2)c1 ZINC000904362991 584874340 /nfs/dbraw/zinc/87/43/40/584874340.db2.gz VRLYUIHYAGYHIQ-IYXRBSQSSA-N 2 0 248.370 2.089 20 0 BEADRP C[C@@]1(C[NH2+]CCc2cccs2)CCC[NH2+]C1 ZINC000904363970 584874545 /nfs/dbraw/zinc/87/45/45/584874545.db2.gz HFWUSWIQLPSTCK-CYBMUJFWSA-N 2 0 238.400 2.270 20 0 BEADRP COc1ccc([C@H](C)[NH2+]C2CC(C[NH3+])C2)cc1C ZINC000904389121 584874834 /nfs/dbraw/zinc/87/48/34/584874834.db2.gz HTPLSIOOCDYISR-DCBWTQNWSA-N 2 0 248.370 2.392 20 0 BEADRP Cc1ccccc1C1(C[NH2+]C[C@H]2C[C@@H]([NH3+])C2)CC1 ZINC000904365953 584875058 /nfs/dbraw/zinc/87/50/58/584875058.db2.gz CHPIIBSQHSUFIG-OKILXGFUSA-N 2 0 244.382 2.354 20 0 BEADRP C[C@@]1(C[NH2+]CCc2ccccc2)CCC[NH2+]C1 ZINC000904364689 584875076 /nfs/dbraw/zinc/87/50/76/584875076.db2.gz ORMNZSOVGXASNF-OAHLLOKOSA-N 2 0 232.371 2.208 20 0 BEADRP CC(C)(C)CC[C@@H]([NH3+])C[NH2+][C@@H]1C=CCC1 ZINC000904377791 584876150 /nfs/dbraw/zinc/87/61/50/584876150.db2.gz YUKVBXLKCXOKHL-VXGBXAGGSA-N 2 0 210.365 2.448 20 0 BEADRP Cc1ccc2c(c1)C[N@@H+](C[C@H]1C[C@@H]([NH3+])C1)CC2 ZINC000904377466 584876166 /nfs/dbraw/zinc/87/61/66/584876166.db2.gz PYWJABNDEIFTIK-JNSHFYNHSA-N 2 0 230.355 2.090 20 0 BEADRP C[C@@]1(C[N@@H+]2CC[C@]3(CC3(F)F)C2)CCC[NH2+]C1 ZINC000904376391 584876388 /nfs/dbraw/zinc/87/63/88/584876388.db2.gz QZXLEBZYUFDQND-NEPJUHHUSA-N 2 0 244.329 2.107 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+]C1CC(C[NH3+])C1)CC2 ZINC000904376304 584876411 /nfs/dbraw/zinc/87/64/11/584876411.db2.gz OMPMLBYIZFXIHY-ABIUDSBCSA-N 2 0 230.355 2.309 20 0 BEADRP Cc1ccsc1C[N@@H+]1CC[C@H](C[NH3+])[C@H](C)C1 ZINC000904411815 584879690 /nfs/dbraw/zinc/87/96/90/584879690.db2.gz NPSQALISNHPADP-VXGBXAGGSA-N 2 0 238.400 2.473 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@H](C[NH3+])[C@H](C)C2)s1 ZINC000904412780 584879738 /nfs/dbraw/zinc/87/97/38/584879738.db2.gz XPOVGVRLOZEMHS-ZYHUDNBSSA-N 2 0 238.400 2.473 20 0 BEADRP Cc1ccc(C[N@@H+]2C[C@@H]3CC[NH2+]C[C@@H]3C2)s1 ZINC000904420619 584881963 /nfs/dbraw/zinc/88/19/63/584881963.db2.gz BQKLIKLHGGSQKN-NWDGAFQWSA-N 2 0 236.384 2.098 20 0 BEADRP C(=C\c1ccccc1)\C[N@@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1 ZINC000904420662 584882413 /nfs/dbraw/zinc/88/24/13/584882413.db2.gz DCGNNVGEXMVEBG-CGXDKWGCSA-N 2 0 242.366 2.241 20 0 BEADRP Cc1cc(C[NH2+]CCn2ccnc2C)c(C)o1 ZINC000767364897 585517680 /nfs/dbraw/zinc/51/76/80/585517680.db2.gz WPQIUBFIHRKNJY-UHFFFAOYSA-N 2 0 233.315 2.191 20 0 BEADRP CC[N@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC000768238364 585533420 /nfs/dbraw/zinc/53/34/20/585533420.db2.gz YSPZQOCKYZUKJG-UHFFFAOYSA-N 2 0 206.333 2.200 20 0 BEADRP C[C@H]([NH2+][C@@H](C)C1CC[NH+](C)CC1)c1ccc[nH]1 ZINC000773118797 585631900 /nfs/dbraw/zinc/63/19/00/585631900.db2.gz QJEKMNOEUMTJCY-RYUDHWBXSA-N 2 0 235.375 2.396 20 0 BEADRP CC[N@@H+]1CCC[C@H](C[NH2+]C[C@H]2CCC=CO2)C1 ZINC000774988689 585670157 /nfs/dbraw/zinc/67/01/57/585670157.db2.gz FNNIGHGXKYCZPY-ZIAGYGMSSA-N 2 0 238.375 2.001 20 0 BEADRP CC[NH+](CC)CCSCC[NH+]1CCCC1 ZINC000776433087 585698657 /nfs/dbraw/zinc/69/86/57/585698657.db2.gz NAIFWKRFNFPDDR-UHFFFAOYSA-N 2 0 230.421 2.157 20 0 BEADRP C[C@@H](C1CC1)[NH+]1CCN(c2cc[nH+]cc2)CC1 ZINC000777446448 585712374 /nfs/dbraw/zinc/71/23/74/585712374.db2.gz LWCCRFHTBZCMTG-LBPRGKRZSA-N 2 0 231.343 2.002 20 0 BEADRP CCc1cc(NCC[N@@H+]2CCC[C@H]2C)nc(C)n1 ZINC000782148158 585808527 /nfs/dbraw/zinc/80/85/27/585808527.db2.gz LBMIVFRHNKSIQF-LLVKDONJSA-N 2 0 248.374 2.244 20 0 BEADRP C[C@H](C1CC1)[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C)C1 ZINC000782192940 585811442 /nfs/dbraw/zinc/81/14/42/585811442.db2.gz XDIGJUWYUZZWBJ-BNOWGMLFSA-N 2 0 222.376 2.201 20 0 BEADRP CCC[NH+](CCC)CC1CC[NH+](C)CC1 ZINC000788476110 585925279 /nfs/dbraw/zinc/92/52/79/585925279.db2.gz ZMWDMTGDUNLCEN-UHFFFAOYSA-N 2 0 212.381 2.450 20 0 BEADRP C[NH+](C)CCCCCCC[NH2+]CC1(C)COC1 ZINC000796276413 586099864 /nfs/dbraw/zinc/09/98/64/586099864.db2.gz MAHCRIIOFZAJDM-UHFFFAOYSA-N 2 0 242.407 2.125 20 0 BEADRP C[C@H]1C[C@H]1C[N@@H+]1CCCC2(CC[NH+](C)CC2)C1 ZINC000798956977 586154104 /nfs/dbraw/zinc/15/41/04/586154104.db2.gz SECRWKPFDCMKQF-KBPBESRZSA-N 2 0 236.403 2.450 20 0 BEADRP C(C[N@@H+]1CCC[C@@]12CC[NH2+]C2)C1CCC1 ZINC000757134231 586427077 /nfs/dbraw/zinc/42/70/77/586427077.db2.gz MDOLPJAWRXJTDW-ZDUSSCGKSA-N 2 0 208.349 2.005 20 0 BEADRP C(C[N@@H+]1CCC[C@]12CC[NH2+]C2)C1CCC1 ZINC000757134230 586427287 /nfs/dbraw/zinc/42/72/87/586427287.db2.gz MDOLPJAWRXJTDW-CYBMUJFWSA-N 2 0 208.349 2.005 20 0 BEADRP C[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2Cc2ccoc2)C1 ZINC000809767222 586518729 /nfs/dbraw/zinc/51/87/29/586518729.db2.gz HTRWFMUTCUUMKN-KGLIPLIRSA-N 2 0 234.343 2.196 20 0 BEADRP C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cc2ccoc2)C1 ZINC000809767223 586518843 /nfs/dbraw/zinc/51/88/43/586518843.db2.gz HTRWFMUTCUUMKN-UONOGXRCSA-N 2 0 234.343 2.196 20 0 BEADRP CS[C@@H]1CC[C@@H]([NH2+][C@@H](C)[C@@H]2CCC[NH2+]2)C1 ZINC000817897107 586831359 /nfs/dbraw/zinc/83/13/59/586831359.db2.gz FHHCBLNXUUOLAC-QCNOEVLYSA-N 2 0 228.405 2.001 20 0 BEADRP CCC(CC)(C[NH2+][C@H]1CCC[C@@H]1[NH3+])SC ZINC000817898429 586834683 /nfs/dbraw/zinc/83/46/83/586834683.db2.gz FOSMBZCTZRYCNB-QWRGUYRKSA-N 2 0 230.421 2.378 20 0 BEADRP Cc1cccc(F)c1C[NH2+][C@H]1CCC[C@H]1C[NH3+] ZINC000817897157 586834742 /nfs/dbraw/zinc/83/47/42/586834742.db2.gz GJAAPYQWROCPFA-FZMZJTMJSA-N 2 0 236.334 2.351 20 0 BEADRP Cc1cccc(C)c1C[NH2+][C@H]1CCC[C@H]1[NH3+] ZINC000817909093 586837343 /nfs/dbraw/zinc/83/73/43/586837343.db2.gz XQTMCYBEZJNHLA-KGLIPLIRSA-N 2 0 218.344 2.273 20 0 BEADRP Cc1cccc(C)c1C[NH2+][C@@H]1CCC[C@H]1[NH3+] ZINC000817909096 586837458 /nfs/dbraw/zinc/83/74/58/586837458.db2.gz XQTMCYBEZJNHLA-ZIAGYGMSSA-N 2 0 218.344 2.273 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H](C)c1ccc2c(c1)CCO2 ZINC000817944010 586845989 /nfs/dbraw/zinc/84/59/89/586845989.db2.gz VREZQYRNWKMHFL-GFCCVEGCSA-N 2 0 248.370 2.272 20 0 BEADRP C[C@H](CSC(C)(C)C)[NH2+]C[C@H]([NH3+])C1CC1 ZINC000817965640 586854838 /nfs/dbraw/zinc/85/48/38/586854838.db2.gz SRDMAZXFGHCDJB-KOLCDFICSA-N 2 0 230.421 2.234 20 0 BEADRP CN1CC[C@@H]([NH2+]C2CCc3ccccc3CC2)C1 ZINC000834566073 587759564 /nfs/dbraw/zinc/75/95/64/587759564.db2.gz BCMXTKWOWMPEJR-MRXNPFEDSA-N 2 0 244.382 2.228 20 0 BEADRP C[C@H](CCCc1cccnc1)[NH2+][C@H]1CCN(C)C1 ZINC000834566691 587759576 /nfs/dbraw/zinc/75/95/76/587759576.db2.gz QHAQKAHDUCKMMJ-HIFRSBDPSA-N 2 0 247.386 2.087 20 0 BEADRP C[N@H+](CCC[NH2+][C@H]1CCOC1)C1CCCCC1 ZINC000104064891 587929945 /nfs/dbraw/zinc/92/99/45/587929945.db2.gz RQGGDWVDYWKZGQ-ZDUSSCGKSA-N 2 0 240.391 2.020 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc(CC[NH3+])cc1 ZINC000841032663 587937087 /nfs/dbraw/zinc/93/70/87/587937087.db2.gz VKTHRJBFTMFLOH-DOMZBBRYSA-N 2 0 232.371 2.466 20 0 BEADRP [NH3+][C@H](C[NH2+]C1CCCCCCC1)C1CC1 ZINC000841050668 587939725 /nfs/dbraw/zinc/93/97/25/587939725.db2.gz KBGYNYBEPDWQCF-CYBMUJFWSA-N 2 0 210.365 2.426 20 0 BEADRP CC[C@H]([NH3+])CNCc1cnc2ccccc2c1 ZINC000841073541 587943918 /nfs/dbraw/zinc/94/39/18/587943918.db2.gz YUZBVYFNKZQZES-ZDUSSCGKSA-N 2 0 229.327 2.062 20 0 BEADRP [NH3+]CCC[C@@H]([NH2+][C@@H]1CCCOC1)c1ccccc1 ZINC000841088235 587945393 /nfs/dbraw/zinc/94/53/93/587945393.db2.gz YTFXCXRPVSUXJB-HUUCEWRRSA-N 2 0 248.370 2.235 20 0 BEADRP C[C@H]([NH2+]CCCCCCC[NH3+])[C@H]1CCCOC1 ZINC000842478672 588029942 /nfs/dbraw/zinc/02/99/42/588029942.db2.gz MHBXZDXTWGIVSF-KBPBESRZSA-N 2 0 242.407 2.300 20 0 BEADRP Cc1cccc2c1CC[N@H+](C[C@@H]1CCC[NH2+]C1)C2 ZINC000843064551 588078305 /nfs/dbraw/zinc/07/83/05/588078305.db2.gz XDMARQWSIWMTEU-CQSZACIVSA-N 2 0 244.382 2.353 20 0 BEADRP CC[C@@H]1C[C@H](C[NH+]2CCC(C)([NH3+])CC2)CCO1 ZINC000843108456 588081773 /nfs/dbraw/zinc/08/17/73/588081773.db2.gz SVVYMMRASSMVMI-CHWSQXEVSA-N 2 0 240.391 2.005 20 0 BEADRP CC(C)[C@@H]1C[C@H]([NH2+]CCCCCC[NH3+])CCO1 ZINC000843128183 588083084 /nfs/dbraw/zinc/08/30/84/588083084.db2.gz VEHNXNBHDLVEPE-KGLIPLIRSA-N 2 0 242.407 2.299 20 0 BEADRP CN(C)c1ccccc1C[NH2+]CCCCCC[NH3+] ZINC000843126462 588084855 /nfs/dbraw/zinc/08/48/55/588084855.db2.gz GBRGLQSDOUNKPF-UHFFFAOYSA-N 2 0 249.402 2.361 20 0 BEADRP [NH3+]CCCCCC[NH2+]Cc1ccc2c[nH]nc2c1 ZINC000843127545 588084885 /nfs/dbraw/zinc/08/48/85/588084885.db2.gz PZLCPBWRZRGEPY-UHFFFAOYSA-N 2 0 246.358 2.172 20 0 BEADRP CC[C@@H]1C[C@H](C[NH2+]CCCCCC[NH3+])CCO1 ZINC000843127997 588085014 /nfs/dbraw/zinc/08/50/14/588085014.db2.gz SNNPNCPPAAJNRN-ZIAGYGMSSA-N 2 0 242.407 2.300 20 0 BEADRP [NH3+]CCCCCC[NH2+][C@@H]1CC[C@H]1C1CC1 ZINC000843340293 588100862 /nfs/dbraw/zinc/10/08/62/588100862.db2.gz ABTHIWKSLYBSED-QWHCGFSZSA-N 2 0 210.365 2.284 20 0 BEADRP Cc1cc([C@H](C)[NH2+]CCCCCC[NH3+])no1 ZINC000843340809 588101068 /nfs/dbraw/zinc/10/10/68/588101068.db2.gz FFQOXOMPJNTQLZ-NSHDSACASA-N 2 0 225.336 2.153 20 0 BEADRP CO[C@@H]1CCC[C@H]([NH2+]CCCCCC[NH3+])C1 ZINC000843341950 588101217 /nfs/dbraw/zinc/10/12/17/588101217.db2.gz LZDCOSXKZBOBEE-QWHCGFSZSA-N 2 0 228.380 2.053 20 0 BEADRP COCC[C@@H]1CCC[C@H]1[NH2+]CCCCCC[NH3+] ZINC000843342914 588101241 /nfs/dbraw/zinc/10/12/41/588101241.db2.gz VCYRYHAYGAIKRQ-UONOGXRCSA-N 2 0 242.407 2.300 20 0 BEADRP C[C@@H]([NH2+]CCCCCC[NH3+])c1ccoc1 ZINC000843343702 588101584 /nfs/dbraw/zinc/10/15/84/588101584.db2.gz WUBXMABWFLVQHR-LLVKDONJSA-N 2 0 210.321 2.449 20 0 BEADRP C[C@@H](N)[C@@H]1CCCC[N@@H+]1CCCCCCC[NH3+] ZINC000843347950 588102759 /nfs/dbraw/zinc/10/27/59/588102759.db2.gz YXEAJFDMSLKFBW-KGLIPLIRSA-N 2 0 241.423 2.097 20 0 BEADRP Cc1ccc(OCC[NH2+][C@@](C)(C[NH3+])C2CC2)cc1 ZINC000843356672 588103838 /nfs/dbraw/zinc/10/38/38/588103838.db2.gz ZXCBWIXWBLOAOB-HNNXBMFYSA-N 2 0 248.370 2.091 20 0 BEADRP Cc1cccc(NC(=[NH2+])NC[C@@H](C)C[NH+](C)C)c1 ZINC000849030736 588442573 /nfs/dbraw/zinc/44/25/73/588442573.db2.gz VXAZTGTWXSVOGN-GFCCVEGCSA-N 2 0 248.374 2.129 20 0 BEADRP C[NH+](C)CC(C)(C)C[NH2+]C1CC(CF)(CF)C1 ZINC000850420193 588544900 /nfs/dbraw/zinc/54/49/00/588544900.db2.gz IRBOAKFPGIFBFW-UHFFFAOYSA-N 2 0 248.361 2.252 20 0 BEADRP ClC(Cl)=CC[NH+]1CCC2(CC[NH2+]C2)CC1 ZINC000852748751 588699656 /nfs/dbraw/zinc/69/96/56/588699656.db2.gz CGBFFSPKKYMWPQ-UHFFFAOYSA-N 2 0 249.185 2.381 20 0 BEADRP C[N@H+](CCCCCC[NH3+])CC1=CCSC1 ZINC000852762350 588701092 /nfs/dbraw/zinc/70/10/92/588701092.db2.gz KSPMIDABTBAGGE-UHFFFAOYSA-N 2 0 228.405 2.111 20 0 BEADRP C[NH+](C)C1CC[NH+](C[C@@]2(C)CCCS2)CC1 ZINC000862223422 589195738 /nfs/dbraw/zinc/19/57/38/589195738.db2.gz PLWFHKFCUFDOMB-CYBMUJFWSA-N 2 0 242.432 2.298 20 0 BEADRP CCCCCC[C@@H](C)[NH2+]CC1([NH3+])CCOCC1 ZINC000863481183 589292737 /nfs/dbraw/zinc/29/27/37/589292737.db2.gz BJPKETWZSNBTCV-CYBMUJFWSA-N 2 0 242.407 2.443 20 0 BEADRP CS[C@H]1C[C@H]([NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)C1 ZINC000865733262 589459276 /nfs/dbraw/zinc/45/92/76/589459276.db2.gz GSQRQQHTWZHUQP-FVCCEPFGSA-N 2 0 240.416 2.097 20 0 BEADRP Cc1cc(N2CC[N@@H+](C)C(C)(C)CC2)nc(C)n1 ZINC000866115136 589477261 /nfs/dbraw/zinc/47/72/61/589477261.db2.gz VVZWIMCWKGQQGU-UHFFFAOYSA-N 2 0 248.374 2.014 20 0 BEADRP C[C@@H](CCc1cccnc1)[NH2+]CCCC[NH+](C)C ZINC000866248205 589482804 /nfs/dbraw/zinc/48/28/04/589482804.db2.gz BBNZTHNVEVJIGU-AWEZNQCLSA-N 2 0 249.402 2.334 20 0 BEADRP CC(C)[NH2+]CCC1CC[NH+](C(C)C)CC1 ZINC000866468050 589495096 /nfs/dbraw/zinc/49/50/96/589495096.db2.gz YRBYBQRKHREHQI-UHFFFAOYSA-N 2 0 212.381 2.495 20 0 BEADRP CS[C@H]1C[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)C1 ZINC000866486951 589496288 /nfs/dbraw/zinc/49/62/88/589496288.db2.gz RWDZSBYDLCSNKY-IVXLTEJVSA-N 2 0 240.416 2.095 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CCC(C)(C)OC)[C@@H](C)C1 ZINC000866503732 589498021 /nfs/dbraw/zinc/49/80/21/589498021.db2.gz VTACXWYQWOGZQB-STQMWFEESA-N 2 0 242.407 2.121 20 0 BEADRP Cc1cc(C)c(C[N@@H+]2CCC[C@H](C[NH3+])C2)c(C)n1 ZINC000866659834 589508262 /nfs/dbraw/zinc/50/82/62/589508262.db2.gz VRUKLPXOZYTMER-CQSZACIVSA-N 2 0 247.386 2.178 20 0 BEADRP CC[C@@H](C)[N@@H+]1CC[C@](C[NH3+])(C(C)(C)C)C1 ZINC000866708240 589514723 /nfs/dbraw/zinc/51/47/23/589514723.db2.gz QGQNRHSHGFKIAT-DGCLKSJQSA-N 2 0 212.381 2.482 20 0 BEADRP Cc1cncc([C@H]2CCC[N@@H+]2C[C@H]2CC[NH2+]C2)c1 ZINC000866720416 589515420 /nfs/dbraw/zinc/51/54/20/589515420.db2.gz KXFDCEHTRCPLMI-DZGCQCFKSA-N 2 0 245.370 2.136 20 0 BEADRP CC[NH+]1CCN(c2cc[nH+]cc2C2CC2)CC1 ZINC000872386143 589930094 /nfs/dbraw/zinc/93/00/94/589930094.db2.gz CAYLJXNUQQMEGH-UHFFFAOYSA-N 2 0 231.343 2.101 20 0 BEADRP CC[N@@H+]1CCC[C@H]1CNc1cc[nH+]cc1C1CC1 ZINC000872388505 589931347 /nfs/dbraw/zinc/93/13/47/589931347.db2.gz RQVNVDRCWURHFV-ZDUSSCGKSA-N 2 0 245.370 2.277 20 0 BEADRP CN(C[C@H]1CCC[N@@H+]1C)c1cc[nH+]cc1C1CC1 ZINC000872574062 589953818 /nfs/dbraw/zinc/95/38/18/589953818.db2.gz XUOXJMCTXYKPJO-CYBMUJFWSA-N 2 0 245.370 2.489 20 0 BEADRP [NH3+][C@@H]1C[C@H]1c1ccc(N[C@@H]2CCC[C@@H]([NH3+])C2)cc1 ZINC000873215652 589998283 /nfs/dbraw/zinc/99/82/83/589998283.db2.gz KKPWIHNPRZUTGO-REBRKWNGSA-N 2 0 245.370 2.183 20 0 BEADRP COC[C@H](CC(C)C)[NH2+][C@@H](C)C1CC[NH2+]CC1 ZINC000873220677 589998988 /nfs/dbraw/zinc/99/89/88/589998988.db2.gz RAPAOKMHEMLGJS-JSGCOSHPSA-N 2 0 242.407 2.025 20 0 BEADRP CC(C)(C)[NH2+]CCN1CC[C@H]2CSC[C@@H]2C1 ZINC000873221919 590000036 /nfs/dbraw/zinc/00/00/36/590000036.db2.gz TYOKECOOZIEUIP-RYUDHWBXSA-N 2 0 242.432 2.059 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]CC[C@H]1CCSC1 ZINC000873234393 590003835 /nfs/dbraw/zinc/00/38/35/590003835.db2.gz CGPIEOKCHNKTJZ-XQQFMLRXSA-N 2 0 242.432 2.379 20 0 BEADRP CC[C@@H]([NH2+]CC[C@H]1CCSC1)[C@@H]1CCC[NH2+]1 ZINC000873235516 590003963 /nfs/dbraw/zinc/00/39/63/590003963.db2.gz NIQUBURMSPTYOG-XQQFMLRXSA-N 2 0 242.432 2.250 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]CC[C@H]1CCSC1 ZINC000873235971 590004199 /nfs/dbraw/zinc/00/41/99/590004199.db2.gz SBSDUSMOFMYDFZ-AGIUHOORSA-N 2 0 242.432 2.107 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@H]2CCCc3ccc(O)cc32)C1 ZINC000873249302 590007358 /nfs/dbraw/zinc/00/73/58/590007358.db2.gz KNHGRVWBMYWYBA-NVBFEUDRSA-N 2 0 246.354 2.097 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]C[C@H]2C[C@H]([NH3+])C2)[C@@H]1C ZINC000873258442 590007393 /nfs/dbraw/zinc/00/73/93/590007393.db2.gz QUEDTSSNUPEGCL-VEGXAWMVSA-N 2 0 210.365 2.138 20 0 BEADRP CC[C@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)C1CCCC1 ZINC000873250020 590007678 /nfs/dbraw/zinc/00/76/78/590007678.db2.gz OSKOBLVGVBUVOI-UHTWSYAYSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1CC(C)(C)C[C@@H]1[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873248848 590007701 /nfs/dbraw/zinc/00/77/01/590007701.db2.gz FMQBQXHCGRBNAY-WYUUTHIRSA-N 2 0 210.365 2.138 20 0 BEADRP CCC[C@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)C1CCC1 ZINC000873250340 590007945 /nfs/dbraw/zinc/00/79/45/590007945.db2.gz PECIZHDJZAHPBX-UHTWSYAYSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccccn1 ZINC000873253134 590008802 /nfs/dbraw/zinc/00/88/02/590008802.db2.gz ZMSFYKIHALQRCU-VNHYZAJKSA-N 2 0 247.386 2.496 20 0 BEADRP CC(C)[C@H]1CCC[C@@H]1[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873253022 590008828 /nfs/dbraw/zinc/00/88/28/590008828.db2.gz XRBMTWWQDZWWDO-XQHKEYJVSA-N 2 0 210.365 2.138 20 0 BEADRP Cc1nc([C@H](C)[NH2+]C[C@H]2C[C@@H]([NH3+])C2)c(C)s1 ZINC000873252154 590009032 /nfs/dbraw/zinc/00/90/32/590009032.db2.gz PTITZRARSJAUQI-BKDNQFJXSA-N 2 0 239.388 2.148 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1cccnc1Cl ZINC000873254322 590009343 /nfs/dbraw/zinc/00/93/43/590009343.db2.gz QOAAWZNZOZGLSL-LPEHRKFASA-N 2 0 239.750 2.123 20 0 BEADRP C[C@H](CSC(C)(C)C)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873255723 590010827 /nfs/dbraw/zinc/01/08/27/590010827.db2.gz IWMWHQQSMSXVNC-GMTAPVOTSA-N 2 0 230.421 2.234 20 0 BEADRP CCC1CCC([NH2+]C[C@H]2C[C@@H]([NH3+])C2)CC1 ZINC000873255608 590010928 /nfs/dbraw/zinc/01/09/28/590010928.db2.gz ICWQHJDOIGTWRF-UNTZMWQOSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+][C@H](c2ccccc2)C2CC2)C1 ZINC000873256275 590011215 /nfs/dbraw/zinc/01/12/15/590011215.db2.gz MKLZTHIRUASVRA-KCPJHIHWSA-N 2 0 230.355 2.465 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccccc1F ZINC000873256422 590011239 /nfs/dbraw/zinc/01/12/39/590011239.db2.gz NLXXHKRBFYMRHH-MXWKQRLJSA-N 2 0 222.307 2.214 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+][C@@H]2CCCc3c(O)cccc32)C1 ZINC000873256841 590011486 /nfs/dbraw/zinc/01/14/86/590011486.db2.gz PBYULBNBFOPQEK-JTNHKYCSSA-N 2 0 246.354 2.097 20 0 BEADRP CC[C@H]1CCC[C@H]([NH2+]C[C@H]2C[C@H]([NH3+])C2)C1 ZINC000873256705 590011563 /nfs/dbraw/zinc/01/15/63/590011563.db2.gz PDOFKFPQWFHYQJ-CYDGBPFRSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@H]2C[C@H]([NH3+])C2)C[C@@H]1C ZINC000873256472 590011672 /nfs/dbraw/zinc/01/16/72/590011672.db2.gz MXFCUJQKBXLGHR-MLGHIDQZSA-N 2 0 210.365 2.138 20 0 BEADRP Cc1ccc([C@H](C)[NH2+]C[C@H]2C[C@H]([NH3+])C2)s1 ZINC000873257054 590011926 /nfs/dbraw/zinc/01/19/26/590011926.db2.gz DQULAIFTEUVYNH-DCAQKATOSA-N 2 0 224.373 2.444 20 0 BEADRP Cc1nc([C@@H](C)[NH2+]C[C@H]2C[C@H]([NH3+])C2)c(C)s1 ZINC000873256733 590011958 /nfs/dbraw/zinc/01/19/58/590011958.db2.gz PTITZRARSJAUQI-AVPPRXQKSA-N 2 0 239.388 2.148 20 0 BEADRP COc1cccc([C@@H](C)[NH2+]C[C@H]2C[C@@H]([NH3+])C2)c1 ZINC000873257692 590012362 /nfs/dbraw/zinc/01/23/62/590012362.db2.gz WOYCDPADLAYVPV-WZRBSPASSA-N 2 0 234.343 2.083 20 0 BEADRP C[C@@H](CCCc1cccnc1)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873257356 590012523 /nfs/dbraw/zinc/01/25/23/590012523.db2.gz SZZFRGAJAYIILO-QEJZJMRPSA-N 2 0 247.386 2.120 20 0 BEADRP Cc1ccc([C@H](C)[NH2+]C[C@H]2C[C@H]([NH3+])C2)cc1 ZINC000873258081 590012575 /nfs/dbraw/zinc/01/25/75/590012575.db2.gz MEZOTVJROQFAJS-OBJOEFQTSA-N 2 0 218.344 2.383 20 0 BEADRP CC(C)C[C@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1ccccn1 ZINC000873258290 590012672 /nfs/dbraw/zinc/01/26/72/590012672.db2.gz ZMSFYKIHALQRCU-YDHLFZDLSA-N 2 0 247.386 2.496 20 0 BEADRP C[C@@H](CCc1ccsc1)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873259085 590012933 /nfs/dbraw/zinc/01/29/33/590012933.db2.gz YSSXUTZYQRUWLT-DRZSPHRISA-N 2 0 238.400 2.396 20 0 BEADRP COc1ccc2c(c1)[C@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)CC2 ZINC000873258817 590013108 /nfs/dbraw/zinc/01/31/08/590013108.db2.gz VKQMSSYDFGHENY-IXPVHAAZSA-N 2 0 246.354 2.009 20 0 BEADRP COc1ccc2c(c1)[C@@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)CC2 ZINC000873258818 590013151 /nfs/dbraw/zinc/01/31/51/590013151.db2.gz VKQMSSYDFGHENY-WBIUFABUSA-N 2 0 246.354 2.009 20 0 BEADRP CC[C@@H](Cc1cccs1)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873258242 590013231 /nfs/dbraw/zinc/01/32/31/590013231.db2.gz YVGYRSHTLXGXSK-SRVKXCTJSA-N 2 0 238.400 2.396 20 0 BEADRP C[C@@H]1CCC[C@H]1[NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000873260420 590013735 /nfs/dbraw/zinc/01/37/35/590013735.db2.gz ZZJKJANNTOKETI-RKQHYHRCSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@H](CC1CC1)[NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000873259499 590013848 /nfs/dbraw/zinc/01/38/48/590013848.db2.gz GASVNUKGRFYZFQ-RUZUBIRVSA-N 2 0 222.376 2.295 20 0 BEADRP C([NH2+]C(C1CC1)C1CC1)[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000873265053 590014713 /nfs/dbraw/zinc/01/47/13/590014713.db2.gz SLNHJJYDEBLLCI-ZOZIMZAQSA-N 2 0 234.387 2.295 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccncc1 ZINC000873264414 590015034 /nfs/dbraw/zinc/01/50/34/590015034.db2.gz OZSASFAXPHRXCJ-VIRABCJISA-N 2 0 245.370 2.263 20 0 BEADRP Cc1cncc([C@H](C)[NH2+][C@H](C)C2CC[NH2+]CC2)c1 ZINC000873269207 590015381 /nfs/dbraw/zinc/01/53/81/590015381.db2.gz NQDBZYHYTKKZHC-OLZOCXBDSA-N 2 0 247.386 2.429 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)c1cncs1 ZINC000873272879 590016581 /nfs/dbraw/zinc/01/65/81/590016581.db2.gz WWZSYIFWLUGVDU-VHSXEESVSA-N 2 0 239.388 2.182 20 0 BEADRP COCC(C)(C)CC[NH2+][C@H]1CCCCC[C@@H]1[NH3+] ZINC000873281456 590018328 /nfs/dbraw/zinc/01/83/28/590018328.db2.gz JGBJQJBMCATYAT-STQMWFEESA-N 2 0 242.407 2.299 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]Cc1cccc2ncccc12 ZINC000873282340 590018676 /nfs/dbraw/zinc/01/86/76/590018676.db2.gz CGSJKANKBVUZTQ-VXGBXAGGSA-N 2 0 243.354 2.450 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]1[NH2+]Cc1cccc2ncccc12 ZINC000873283883 590019765 /nfs/dbraw/zinc/01/97/65/590019765.db2.gz LOVMACHSGMZTLO-ZFWWWQNUSA-N 2 0 241.338 2.204 20 0 BEADRP CC(C)[N@H+](C)Cc1cccc2c1CC[NH2+]C2 ZINC000125646488 590176230 /nfs/dbraw/zinc/17/62/30/590176230.db2.gz HKQXUUJJHYOLRT-UHFFFAOYSA-N 2 0 218.344 2.173 20 0 BEADRP CC[C@H](C)[C@@H](C[NH+]1CCC([NH+](C)C)CC1)OC ZINC000876596486 590219883 /nfs/dbraw/zinc/21/98/83/590219883.db2.gz RGBUPVIQBLDEAD-GXTWGEPZSA-N 2 0 242.407 2.074 20 0 BEADRP Cc1cc(C)cc(CC[NH2+]CCC[NH+](C)C)c1 ZINC000876887137 590254159 /nfs/dbraw/zinc/25/41/59/590254159.db2.gz LMYAHZWGSRTDGI-UHFFFAOYSA-N 2 0 234.387 2.387 20 0 BEADRP COCC[N@H+](C)CCC[NH2+]CC1(C)CCCC1 ZINC000876928471 590258258 /nfs/dbraw/zinc/25/82/58/590258258.db2.gz GAPSLMFLAHKCGF-UHFFFAOYSA-N 2 0 242.407 2.125 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1)[C@H]1CC1(F)F ZINC000877073694 590278123 /nfs/dbraw/zinc/27/81/23/590278123.db2.gz QRGYZRBQUYSKBE-IRCOFANPSA-N 2 0 246.345 2.493 20 0 BEADRP C[NH+](C)[C@@H]1CCC[C@H]([NH2+]CCC[C@@H]2CCO2)C1 ZINC000877074127 590278342 /nfs/dbraw/zinc/27/83/42/590278342.db2.gz ZSTBVNOCRSZXFP-BFHYXJOUSA-N 2 0 240.391 2.018 20 0 BEADRP CC(C)C1(C[N@@H+]2CC[C@@H]3[C@H](CC[NH+]3C)C2)CC1 ZINC000877738848 590406278 /nfs/dbraw/zinc/40/62/78/590406278.db2.gz MOAAABAGEOMOJB-ZIAGYGMSSA-N 2 0 236.403 2.449 20 0 BEADRP Cc1ccccc1OCC[N@H+]1CC[C@@H]([C@@H](C)[NH3+])C1 ZINC000127210555 590594270 /nfs/dbraw/zinc/59/42/70/590594270.db2.gz NFOWNJQPUDWWPD-ZIAGYGMSSA-N 2 0 248.370 2.043 20 0 BEADRP CC[NH+](CC)CCC[N@@H+]1C[C@@H](OC)CC[C@@H]1C ZINC000879326836 590748316 /nfs/dbraw/zinc/74/83/16/590748316.db2.gz TZABLFFIELICBA-KBPBESRZSA-N 2 0 242.407 2.218 20 0 BEADRP C[C@@H]1C[N@H+](CC2CC2)CCN1c1cc[nH+]cc1 ZINC000880262964 590979893 /nfs/dbraw/zinc/97/98/93/590979893.db2.gz UPELAKCIZJIEFA-GFCCVEGCSA-N 2 0 231.343 2.002 20 0 BEADRP CC(C)[N@@H+]1CCN(c2cc[nH+]cc2)[C@@H](C)C1 ZINC000880260380 590980079 /nfs/dbraw/zinc/98/00/79/590980079.db2.gz BYXRQBBJINCDFN-LBPRGKRZSA-N 2 0 219.332 2.001 20 0 BEADRP CC(C)C[N@@H+]1CCN(c2cc[nH+]cc2)[C@@H](C)C1 ZINC000880261079 590980122 /nfs/dbraw/zinc/98/01/22/590980122.db2.gz HVGCZWIWJRSAEF-ZDUSSCGKSA-N 2 0 233.359 2.248 20 0 BEADRP C[N@@H+]1CCCC[C@@H]1CC[NH+]1CC[C@@H](CF)C1 ZINC000880295313 590989271 /nfs/dbraw/zinc/98/92/71/590989271.db2.gz JWBVFNTVTPONEU-QWHCGFSZSA-N 2 0 228.355 2.152 20 0 BEADRP CC[NH+](CC)CCC[N@@H+]1CC[C@@H](CF)C1 ZINC000880298730 590992217 /nfs/dbraw/zinc/99/22/17/590992217.db2.gz JCLGAOYDOYBREA-LBPRGKRZSA-N 2 0 216.344 2.010 20 0 BEADRP c1ccc2c(c1)OCC[C@H]2[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000129045918 591224660 /nfs/dbraw/zinc/22/46/60/591224660.db2.gz YWETUUGZXQICEB-TZMCWYRMSA-N 2 0 246.354 2.242 20 0 BEADRP c1ccc2c(c1)CC[C@H]([NH2+][C@@H]1CCC[NH2+]CC1)C2 ZINC000129220363 591270544 /nfs/dbraw/zinc/27/05/44/591270544.db2.gz AESJTXFICXVWMF-CVEARBPZSA-N 2 0 244.382 2.276 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C[C@@H]2C=CCC2)[C@@H]2CCC[C@@H]21 ZINC000883245587 591585630 /nfs/dbraw/zinc/58/56/30/591585630.db2.gz NYJLBENQQMZIOY-QPSCCSFWSA-N 2 0 234.387 2.415 20 0 BEADRP CCN1CC[C@H]1C[NH2+][C@H](C)CCC(F)(F)F ZINC000883354822 591625522 /nfs/dbraw/zinc/62/55/22/591625522.db2.gz CSBOWVTUDUKVRI-ZJUUUORDSA-N 2 0 238.297 2.401 20 0 BEADRP CCN1CC[C@@H]1C[NH2+][C@@H](C)CCC(F)(F)F ZINC000883354821 591626375 /nfs/dbraw/zinc/62/63/75/591626375.db2.gz CSBOWVTUDUKVRI-VHSXEESVSA-N 2 0 238.297 2.401 20 0 BEADRP [NH3+]CC1CC[NH+](CC[C@H]2CCCC2(F)F)CC1 ZINC000883416545 591652517 /nfs/dbraw/zinc/65/25/17/591652517.db2.gz XVBLXCXXKVGJRI-GFCCVEGCSA-N 2 0 246.345 2.483 20 0 BEADRP C[C@@H]1c2ccccc2CCN1C[C@@H]1C[C@H](F)C[NH2+]1 ZINC000883421082 591655991 /nfs/dbraw/zinc/65/59/91/591655991.db2.gz BCFXUYOYPLKPSG-XBFCOCLRSA-N 2 0 248.345 2.306 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CC[N@H+](CC[C@@H]2CCCC2(F)F)C1 ZINC000883424102 591658294 /nfs/dbraw/zinc/65/82/94/591658294.db2.gz GBEXPGHCUCBGQQ-TUAOUCFPSA-N 2 0 246.345 2.481 20 0 BEADRP C[C@H]1[C@@H]([NH3+])CC[N@@H+]1C[C@H]1CC(C)(C)OC1(C)C ZINC000883429845 591662130 /nfs/dbraw/zinc/66/21/30/591662130.db2.gz GFSTXTXNBNSZLP-TUAOUCFPSA-N 2 0 240.391 2.002 20 0 BEADRP C[N@H+](CCCCCC[NH3+])C1(CN)CCCCC1 ZINC000883455100 591672852 /nfs/dbraw/zinc/67/28/52/591672852.db2.gz TUGXKXFRKJATKQ-UHFFFAOYSA-N 2 0 241.423 2.099 20 0 BEADRP Cc1ccccc1OCC[N@H+]1CC[C@@H]([NH3+])C[C@@H]1C ZINC000131970314 591680408 /nfs/dbraw/zinc/68/04/08/591680408.db2.gz BOKZDPXUVZSEBS-UONOGXRCSA-N 2 0 248.370 2.185 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[NH2+]C1)c1cccc(F)c1 ZINC000132026849 591683942 /nfs/dbraw/zinc/68/39/42/591683942.db2.gz QPXXIGZAUWEOEX-NWDGAFQWSA-N 2 0 236.334 2.476 20 0 BEADRP C[NH2+][C@H]1CCN([C@H](C)c2cccc(C)c2)C1 ZINC000133195861 591776299 /nfs/dbraw/zinc/77/62/99/591776299.db2.gz HPSFYDGFZGLEGP-OCCSQVGLSA-N 2 0 218.344 2.350 20 0 BEADRP c1ccc2c(NC[C@H]3CC[NH2+]C3)cc[nH+]c2c1 ZINC000133796558 591858308 /nfs/dbraw/zinc/85/83/08/591858308.db2.gz FRKYBGMXLGMGFZ-NSHDSACASA-N 2 0 227.311 2.256 20 0 BEADRP Cc1cc(C[NH2+][C@@H]2CCN(C)C2)ccc1Cl ZINC000134653045 591945266 /nfs/dbraw/zinc/94/52/66/591945266.db2.gz YOLVAWURWHHCDO-GFCCVEGCSA-N 2 0 238.762 2.442 20 0 BEADRP C[N@@H+]1CC[C@@]2(CC[NH+](CC[C@@H]3C[C@H]3C3CC3)C2)C1 ZINC000886215557 592177859 /nfs/dbraw/zinc/17/78/59/592177859.db2.gz MQFQFQQYWYGVJX-OWCLPIDISA-N 2 0 248.414 2.450 20 0 BEADRP C[NH+](CCF)[C@H]1CC[C@H]([N@H+](C)CCF)CC1 ZINC000886389748 592222225 /nfs/dbraw/zinc/22/22/25/592222225.db2.gz WJGBMHJDAAJJPB-HAQNSBGRSA-N 2 0 234.334 2.100 20 0 BEADRP C[C@@H]1CC[N@H+](CCOCC[NH3+])[C@@H]1c1ccccc1 ZINC000886858261 592369893 /nfs/dbraw/zinc/36/98/93/592369893.db2.gz UAJGODNDOHIWCP-HIFRSBDPSA-N 2 0 248.370 2.045 20 0 BEADRP C[C@H]1CC[N@H+](CCOCC[NH3+])[C@H]1c1ccccc1 ZINC000886858260 592370398 /nfs/dbraw/zinc/37/03/98/592370398.db2.gz UAJGODNDOHIWCP-DZGCQCFKSA-N 2 0 248.370 2.045 20 0 BEADRP CC[C@@H](C)C[N@@H+]1CCCC[C@@]2(CC[NH2+]C2)C1 ZINC000886870196 592375031 /nfs/dbraw/zinc/37/50/31/592375031.db2.gz SFDLIPNFKVVMJK-KGLIPLIRSA-N 2 0 224.392 2.498 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCCC[C@@]2(CC[NH2+]C2)C1 ZINC000886870195 592375518 /nfs/dbraw/zinc/37/55/18/592375518.db2.gz SFDLIPNFKVVMJK-KBPBESRZSA-N 2 0 224.392 2.498 20 0 BEADRP C([C@@H]1C[C@H]2C[C@H]2C1)[N@@H+]1CCCC[C@]2(CC[NH2+]C2)C1 ZINC000886874851 592377064 /nfs/dbraw/zinc/37/70/64/592377064.db2.gz YFZVXTBWYFHQHT-QKPAOTATSA-N 2 0 248.414 2.498 20 0 BEADRP CC(C)[N@@H+]1CCN(c2cc[nH+]cc2)C[C@H]1C ZINC000887131182 592449506 /nfs/dbraw/zinc/44/95/06/592449506.db2.gz SCQXCLSYZFLMOY-GFCCVEGCSA-N 2 0 219.332 2.001 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[NH2+]C[C@H]1C)c1ccccc1 ZINC000223645458 592537411 /nfs/dbraw/zinc/53/74/11/592537411.db2.gz ZYJNXGDTPNCJHR-MBNYWOFBSA-N 2 0 218.344 2.335 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]C[C@H](C)CC(C)C ZINC001325267200 989136106 /nfs/dbraw/zinc/13/61/06/989136106.db2.gz KHAAIIFBUXMTCU-NEPJUHHUSA-N 2 0 200.370 2.256 20 0 BEADRP Cc1cc2[nH]ccc2c(N2CCC[C@@H]([NH3+])[C@H]2C)[nH+]1 ZINC001157740996 970763845 /nfs/dbraw/zinc/76/38/45/970763845.db2.gz JDQYQBNFJDWLDV-ZYHUDNBSSA-N 2 0 244.342 2.187 20 0 BEADRP C[C@@]1(CC[NH2+][C@H]2CC[NH2+]C23CCC3)CC1(F)F ZINC000925709007 634405815 /nfs/dbraw/zinc/40/58/15/634405815.db2.gz NFABHHGITHXFHG-WDEREUQCSA-N 2 0 244.329 2.296 20 0 BEADRP C[C@H]1CC[C@H](C)C1[NH2+]CC1=CC[N@H+](C)CC1 ZINC000925712394 634414306 /nfs/dbraw/zinc/41/43/06/634414306.db2.gz UHWACPWZMRYHEK-RYUDHWBXSA-N 2 0 222.376 2.273 20 0 BEADRP C[C@]1(CC[NH2+][C@H]2CC[NH2+]C2(C)C)C[C@]1(F)Cl ZINC000925713832 634415970 /nfs/dbraw/zinc/41/59/70/634415970.db2.gz UVEPWLSMKXWNPQ-ZMLRMANQSA-N 2 0 248.773 2.421 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H](CCC[NH3+])c2ccccc2)CO1 ZINC000925712946 634416793 /nfs/dbraw/zinc/41/67/93/634416793.db2.gz QNBLBWDKLUSHSP-VHDGCEQUSA-N 2 0 248.370 2.234 20 0 BEADRP C[C@@H]1SCC[C@@H]1[NH2+][C@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925713023 634417261 /nfs/dbraw/zinc/41/72/61/634417261.db2.gz RKWYQTZEAOKJIF-BJDJZHNGSA-N 2 0 242.432 2.376 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+]C[C@@H]1CCCC12CC2 ZINC000925716638 634449905 /nfs/dbraw/zinc/44/99/05/634449905.db2.gz BICNLMBUZYBVRP-NWDGAFQWSA-N 2 0 222.376 2.297 20 0 BEADRP [NH3+]CC[C@H]1CC[N@H+](Cc2ccc(F)cc2F)C1 ZINC000125546461 634539843 /nfs/dbraw/zinc/53/98/43/634539843.db2.gz LZXFCZHVMWBTOP-JTQLQIEISA-N 2 0 240.297 2.136 20 0 BEADRP C[C@@H](C[C@H]1CCC[NH2+]1)[NH2+]Cc1cccc(F)c1 ZINC000093462929 634547561 /nfs/dbraw/zinc/54/75/61/634547561.db2.gz OEHBDKCXHHKGNG-SMDDNHRTSA-N 2 0 236.334 2.446 20 0 BEADRP CC[C@H]([NH2+]C[C@H]1C=CCC1)[C@@H]1CCC[NH2+]1 ZINC000925731451 634562654 /nfs/dbraw/zinc/56/26/54/634562654.db2.gz KSEGKQQYKIEFDB-AVGNSLFASA-N 2 0 208.349 2.073 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1C=CCC1)[C@@H]1CCCC[NH2+]1 ZINC000925733164 634576702 /nfs/dbraw/zinc/57/67/02/634576702.db2.gz SXHHWQUMKHYJOP-RDBSUJKOSA-N 2 0 222.376 2.463 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+]CC1(CC2CC2)CC1 ZINC000925734812 634585954 /nfs/dbraw/zinc/58/59/54/634585954.db2.gz VEJJPIYVOZNYJT-GFCCVEGCSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+][C@@H]1CC[C@H]1C(C)(C)C ZINC000925786254 635304966 /nfs/dbraw/zinc/30/49/66/635304966.db2.gz SZKBQQVGKMABRN-DDHJBXDOSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@@H]1C[C@H]1[C@@H]1C[C@H]1[NH2+][C@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C ZINC000925821677 635399021 /nfs/dbraw/zinc/39/90/21/635399021.db2.gz HNRLNZBDFFQXFB-VVRFCBCGSA-N 2 0 248.414 2.397 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2C[C@H]([NH3+])C23CCC3)CCS1 ZINC000925857575 635549734 /nfs/dbraw/zinc/54/97/34/635549734.db2.gz HNMQXSJGEZPXDO-WYUUTHIRSA-N 2 0 240.416 2.130 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCS[C@H](C)C1)[C@H]1CCC[NH2+]C1 ZINC000925862252 635559015 /nfs/dbraw/zinc/55/90/15/635559015.db2.gz ZDLQRAXBIWOTMY-FVCCEPFGSA-N 2 0 242.432 2.248 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+]C[C@]12C[C@H]1CCC2 ZINC000925880472 635609243 /nfs/dbraw/zinc/60/92/43/635609243.db2.gz LCRQQCHUYOWUTR-JOPBPUBCSA-N 2 0 234.387 2.282 20 0 BEADRP CC[C@@H]([NH2+]C[C@]12C[C@H]1CCC2)[C@@H]1CCC[NH2+]1 ZINC000925881811 635610428 /nfs/dbraw/zinc/61/04/28/635610428.db2.gz VDBAYRUPNZSCTB-MQYQWHSLSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]Cc2cccc(C[NH+](C)C)c2)CO1 ZINC000647169850 631291102 /nfs/dbraw/zinc/29/11/02/631291102.db2.gz DHYMAJCLNAJWAM-SWLSCSKDSA-N 2 0 248.370 2.015 20 0 BEADRP C[C@@H]1C[C@@H](N(C)C/C=C\Cl)CC[N@@H+]1C ZINC000255341199 631303052 /nfs/dbraw/zinc/30/30/52/631303052.db2.gz MPBGZMLXLDAIIC-FPNIURKZSA-N 2 0 216.756 2.153 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+]C[C@H]1CCCC[NH2+]C1 ZINC000319465489 635677529 /nfs/dbraw/zinc/67/75/29/635677529.db2.gz VQGUEGPCLTXSBO-AVGNSLFASA-N 2 0 212.381 2.400 20 0 BEADRP C[N@H+](CCC1CC1)C[C@]1(C)CCC[NH2+]C1 ZINC000308810327 631664147 /nfs/dbraw/zinc/66/41/47/631664147.db2.gz CCVVCUSVWSKDJS-CYBMUJFWSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@H]1CC[C@@H]1[NH2+]CCC[NH+]1CCCCC1 ZINC000308838041 631677401 /nfs/dbraw/zinc/67/74/01/631677401.db2.gz XAHFEMKBBRJPHU-STQMWFEESA-N 2 0 210.365 2.251 20 0 BEADRP CS[C@H]1CCC[C@@H]([NH2+]CCC[NH+](C)C)C1 ZINC000235078525 631918962 /nfs/dbraw/zinc/91/89/62/631918962.db2.gz MGLKCEMYSKLBBO-NEPJUHHUSA-N 2 0 230.421 2.202 20 0 BEADRP C[N@H+]1C[C@H]2CC[C@@H](C1)C2[NH2+][C@H]1CCC1(C)C ZINC000926421140 631965271 /nfs/dbraw/zinc/96/52/71/631965271.db2.gz LBWXKOSAVDAEPY-FXJUQPSGSA-N 2 0 222.376 2.105 20 0 BEADRP CS[C@H]1CCC[C@@H]([NH2+]C2CC[NH2+]CC2)C1 ZINC000235134593 631985666 /nfs/dbraw/zinc/98/56/66/631985666.db2.gz WYYOEWLPOHLWOH-NEPJUHHUSA-N 2 0 228.405 2.002 20 0 BEADRP CSC1(C[NH2+][C@H]2CCCC[C@H]2C[NH3+])CCC1 ZINC000235116631 632008771 /nfs/dbraw/zinc/00/87/71/632008771.db2.gz JRPPMSVVLUEXAI-RYUDHWBXSA-N 2 0 242.432 2.379 20 0 BEADRP C[C@@H]1C[C@H](C[N@H+](C)CC(C)(C)C)CC[NH2+]1 ZINC000235274159 632015749 /nfs/dbraw/zinc/01/57/49/632015749.db2.gz FCYPYXKPLZXTPS-VXGBXAGGSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CCC[NH2+]1)C1CCCCC1 ZINC000235188185 632509453 /nfs/dbraw/zinc/50/94/53/632509453.db2.gz IOJVZDKMAPNRCJ-YPMHNXCESA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@H]1CC[N@H+](CC[C@H]2CCC[NH2+]C2)C1 ZINC000251555192 632548583 /nfs/dbraw/zinc/54/85/83/632548583.db2.gz BHADWANLCZZVIL-QWHCGFSZSA-N 2 0 210.365 2.108 20 0 BEADRP c1cc(CN[C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)co1 ZINC000252982647 632564445 /nfs/dbraw/zinc/56/44/45/632564445.db2.gz XIUDNNALRBGVMI-MGPQQGTHSA-N 2 0 234.343 2.290 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+][C@@H]1CCC[C@H]1[C@H]1CCC[NH2+]1 ZINC000252958075 632565362 /nfs/dbraw/zinc/56/53/62/632565362.db2.gz KYSFZPHFDBSNKX-RKQHYHRCSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]1CCC[C@@H](C[N@@H+]2CC[C@H](C[NH3+])C2)C1 ZINC000084344527 632637624 /nfs/dbraw/zinc/63/76/24/632637624.db2.gz KXQMSPQWDLBSJD-JHJVBQTASA-N 2 0 210.365 2.093 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H]2CCCC[C@H]2C)C1 ZINC000252439761 632645683 /nfs/dbraw/zinc/64/56/83/632645683.db2.gz SHRLFQISWGSLBP-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+]C1Cc2ccccc2C1 ZINC000236238070 632769151 /nfs/dbraw/zinc/76/91/51/632769151.db2.gz QJJCELYJVZYYEX-GDBMZVCRSA-N 2 0 244.382 2.261 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@H+](C)[C@H]1CCCC[C@@H]1C ZINC000235547176 632781485 /nfs/dbraw/zinc/78/14/85/632781485.db2.gz OCIMHMAJFFCUSX-CRWXNKLISA-N 2 0 224.392 2.352 20 0 BEADRP C[C@H]1CC[C@H]1[NH2+]CC(C)(C)C[NH+]1CCCC1 ZINC000309761835 633243304 /nfs/dbraw/zinc/24/33/04/633243304.db2.gz IVMRXQJOHKBYEF-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H](CC[NH2+][C@@H](C)C1CC(F)(F)C1)[NH+](C)C ZINC000895291031 636132347 /nfs/dbraw/zinc/13/23/47/636132347.db2.gz YQDMKQXVHUGFLS-UWVGGRQHSA-N 2 0 234.334 2.350 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+][C@H]2[C@@H]3[NH2+]C[C@H]4C[C@H]2C[C@H]34)C1 ZINC000328420704 633762459 /nfs/dbraw/zinc/76/24/59/633762459.db2.gz JVHYNKGRAPVNNE-CAJFQKGDSA-N 2 0 234.387 2.009 20 0 BEADRP CCC(C)(C)C[NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32 ZINC000328460801 633765611 /nfs/dbraw/zinc/76/56/11/633765611.db2.gz UNMIBZFSQFCIHR-JZRPKSSGSA-N 2 0 222.376 2.009 20 0 BEADRP C(CC1CCCC1)[NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32 ZINC000328457870 633766155 /nfs/dbraw/zinc/76/61/55/633766155.db2.gz SGORSYOZBOVLFE-BTFPBAQTSA-N 2 0 234.387 2.153 20 0 BEADRP CC(C)CC[C@H](C)[NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23 ZINC000328466396 633768900 /nfs/dbraw/zinc/76/89/00/633768900.db2.gz XIIMRIUWHVZLDD-XDSHMYFISA-N 2 0 236.403 2.397 20 0 BEADRP C[C@H]([NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2)C1CCCC1 ZINC000328549086 633773966 /nfs/dbraw/zinc/77/39/66/633773966.db2.gz QSSOWMZTGZBOHQ-SVJDTZHWSA-N 2 0 234.387 2.151 20 0 BEADRP CC(C)C1(C[NH2+][C@H]2[C@@H]3[NH2+]C[C@@H]4C[C@H]2C[C@@H]43)CC1 ZINC000328566537 633776937 /nfs/dbraw/zinc/77/69/37/633776937.db2.gz MVMWBBCQEKNTNF-QSLWVIQJSA-N 2 0 234.387 2.009 20 0 BEADRP CSCCC[NH2+][C@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925503466 633828614 /nfs/dbraw/zinc/82/86/14/633828614.db2.gz KLJRITHDHIYRFV-QWRGUYRKSA-N 2 0 230.421 2.235 20 0 BEADRP CSCCCC[NH2+][C@@H]1CC[NH2+]C12CCCC2 ZINC000925503613 633830126 /nfs/dbraw/zinc/83/01/26/633830126.db2.gz KQVVUJOFDNHGPW-GFCCVEGCSA-N 2 0 242.432 2.394 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@H]([NH3+])CC(C)(C)C1)C1CC1 ZINC000925586322 634090879 /nfs/dbraw/zinc/09/08/79/634090879.db2.gz CGQORXPWNNTIAZ-ZMLRMANQSA-N 2 0 210.365 2.281 20 0 BEADRP CO[C@H](C)C[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000925646312 634201618 /nfs/dbraw/zinc/20/16/18/634201618.db2.gz UWMOGFHKICNCJL-TZMCWYRMSA-N 2 0 236.359 2.091 20 0 BEADRP CSC1(C[NH2+][C@H]2C[C@H]([NH3+])CC(C)(C)C2)CC1 ZINC000925657295 634220384 /nfs/dbraw/zinc/22/03/84/634220384.db2.gz MOCRTJLLMOCJIA-QWRGUYRKSA-N 2 0 242.432 2.378 20 0 BEADRP CC1(C)SC[C@@H]1[NH2+][C@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925666863 634241029 /nfs/dbraw/zinc/24/10/29/634241029.db2.gz OKOCBEQWMGOCJI-VWYCJHECSA-N 2 0 242.432 2.376 20 0 BEADRP C1CC2(C1)[NH2+]CC[C@H]2[NH2+][C@H]1CC2CCC1CC2 ZINC000925675900 634263025 /nfs/dbraw/zinc/26/30/25/634263025.db2.gz HDWFSKYGQBKRSC-CLRIEMFWSA-N 2 0 234.387 2.439 20 0 BEADRP C[C@H](F)CC[NH2+][C@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925676592 634265033 /nfs/dbraw/zinc/26/50/33/634265033.db2.gz KLNUTJLJMNTAFJ-DCAQKATOSA-N 2 0 216.344 2.230 20 0 BEADRP FC1(F)CC(CC[NH2+][C@H]2CC[NH2+]C23CCC3)C1 ZINC000925684979 634294795 /nfs/dbraw/zinc/29/47/95/634294795.db2.gz KARURDWAVCVFTH-NSHDSACASA-N 2 0 244.329 2.296 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]C[C@@H]1CCC2(CCC2)CO1 ZINC000925774210 635231806 /nfs/dbraw/zinc/23/18/06/635231806.db2.gz LJFQVAFXSXAIQH-AVGNSLFASA-N 2 0 240.391 2.051 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+]C[C@H]1C[NH2+]CCC1(F)F ZINC000925777538 635259488 /nfs/dbraw/zinc/25/94/88/635259488.db2.gz POCKWJKBWBBGSV-GMTAPVOTSA-N 2 0 232.318 2.009 20 0 BEADRP CC[C@H]1CCCC[C@@H]1[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000925783758 635291934 /nfs/dbraw/zinc/29/19/34/635291934.db2.gz GSSOXVKQIXDYML-RFGFWPKPSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+][C@@H]1CC[C@@H]1C(C)(C)C ZINC000925786257 635304597 /nfs/dbraw/zinc/30/45/97/635304597.db2.gz SZKBQQVGKMABRN-WRWGMCAJSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+][C@H]1CC[C@H]1C(C)(C)C ZINC000925786256 635305074 /nfs/dbraw/zinc/30/50/74/635305074.db2.gz SZKBQQVGKMABRN-WISYIIOYSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1C[NH2+]C[C@H]1C)c1ccc(F)cc1 ZINC000925790151 635313974 /nfs/dbraw/zinc/31/39/74/635313974.db2.gz GLSNSSIGQTWMCJ-MDZLAQPJSA-N 2 0 236.334 2.332 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CC1C[C@H]2CC[C@@H](C1)S2 ZINC000925800320 635341606 /nfs/dbraw/zinc/34/16/06/635341606.db2.gz FKLHQSLKDJALRP-GJHMDTBVSA-N 2 0 242.432 2.376 20 0 BEADRP [NH3+]C[C@@H]1CC[N@H+](Cc2cccc(C3CC3)c2)C1 ZINC000094522062 635367341 /nfs/dbraw/zinc/36/73/41/635367341.db2.gz VJBMVZVMOBFTNT-ZDUSSCGKSA-N 2 0 230.355 2.345 20 0 BEADRP COC[C@@H](C[NH2+][C@@H](C)CCCC[NH3+])C(C)C ZINC000925873891 635595342 /nfs/dbraw/zinc/59/53/42/635595342.db2.gz MVDACPMRFWJTDK-QWHCGFSZSA-N 2 0 230.396 2.012 20 0 BEADRP Cc1ccc(C[NH2+]C2CCC([NH3+])CC2)cc1 ZINC000051692865 636659746 /nfs/dbraw/zinc/65/97/46/636659746.db2.gz FXIYNHDDIIOWCV-UHFFFAOYSA-N 2 0 218.344 2.355 20 0 BEADRP C[C@H]1CCC[C@H](C[N@@H+]2C[C@@H]3CC[NH2+]C[C@@H]3C2)C1 ZINC000928997895 636698094 /nfs/dbraw/zinc/69/80/94/636698094.db2.gz PBRSWLKYCIBWOR-ZQDZILKHSA-N 2 0 236.403 2.354 20 0 BEADRP CCC[C@@H](C)C[N@@H+]1C[C@@H]2C[NH+](C)C[C@]2(C)C1 ZINC000897621546 636826493 /nfs/dbraw/zinc/82/64/93/636826493.db2.gz HVZCBCHSXNRICU-HZSPNIEDSA-N 2 0 224.392 2.306 20 0 BEADRP C[N@@H+]1C[C@@H]2C[NH+](C[C@@H]3CC=CCC3)C[C@]2(C)C1 ZINC000897621939 636827566 /nfs/dbraw/zinc/82/75/66/636827566.db2.gz ZTRUHFCIUVKKDK-KFWWJZLASA-N 2 0 234.387 2.226 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@@H]([NH3+])C1)c1ccccn1 ZINC000088169754 636897848 /nfs/dbraw/zinc/89/78/48/636897848.db2.gz LGKOQUBDLUAPSB-QJPTWQEYSA-N 2 0 219.332 2.002 20 0 BEADRP C[C@H]1C[N@H+](CCCCCC[NH3+])CC(C)(C)O1 ZINC000041681573 637017398 /nfs/dbraw/zinc/01/73/98/637017398.db2.gz RUDQWPYWCIAORB-LBPRGKRZSA-N 2 0 228.380 2.005 20 0 BEADRP [NH3+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2CC1CCC1 ZINC000054601955 637034864 /nfs/dbraw/zinc/03/48/64/637034864.db2.gz PENNOLDOASLXTQ-YHWZYXNKSA-N 2 0 208.349 2.131 20 0 BEADRP CCCCC[C@H](C)[NH2+]C[C@@H](O)C[NH+]1CCCC1 ZINC000042238390 637090384 /nfs/dbraw/zinc/09/03/84/637090384.db2.gz XDDMXMRMFTYOEK-UONOGXRCSA-N 2 0 242.407 2.002 20 0 BEADRP CCO[C@H]1CCC[N@H+](CCCCCCC[NH3+])C1 ZINC000042425577 637243853 /nfs/dbraw/zinc/24/38/53/637243853.db2.gz CUSORLYUPGWVEM-AWEZNQCLSA-N 2 0 242.407 2.397 20 0 BEADRP CCCSC[C@@H](C)[NH2+]CCc1cncn1C ZINC000903154472 637348699 /nfs/dbraw/zinc/34/86/99/637348699.db2.gz YRUHLVUBMRYNKT-LLVKDONJSA-N 2 0 241.404 2.084 20 0 BEADRP [NH3+][C@@H]1C[C@H]2C[C@@H](C1)[N@H+](CCc1cccc(F)c1)C2 ZINC000903841641 637385165 /nfs/dbraw/zinc/38/51/65/637385165.db2.gz YXKSLJXENFAEGE-CFVMTHIKSA-N 2 0 248.345 2.180 20 0 BEADRP C(C[N@@H+]1CCC[C@@]12CC[NH2+]C2)C1CCCC1 ZINC000903866638 637386915 /nfs/dbraw/zinc/38/69/15/637386915.db2.gz WEABICYEYWRBDF-AWEZNQCLSA-N 2 0 222.376 2.395 20 0 BEADRP N[C@@H]1c2ccccc2C[C@H]1[NH2+]Cc1cccs1 ZINC000904462579 637405927 /nfs/dbraw/zinc/40/59/27/637405927.db2.gz WQGTUDNZQJNYJD-ZIAGYGMSSA-N 2 0 244.363 2.462 20 0 BEADRP CSCC(C)(C)[NH2+]C[C@@H]1CC[NH2+][C@@H](C)C1 ZINC000904476336 637425697 /nfs/dbraw/zinc/42/56/97/637425697.db2.gz QMNWYZYCCXGCAF-WDEREUQCSA-N 2 0 230.421 2.106 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]Cc2ccc3ccccc3c2)C1 ZINC000906507577 638178844 /nfs/dbraw/zinc/17/88/44/638178844.db2.gz AMCZJIUOJPXHQG-SHTZXODSSA-N 2 0 226.323 2.419 20 0 BEADRP [NH3+]C1CC(NCc2ccccc2OCC2CC2)C1 ZINC000906509560 638181532 /nfs/dbraw/zinc/18/15/32/638181532.db2.gz JMUDFUZFYFGHQL-UHFFFAOYSA-N 2 0 246.354 2.055 20 0 BEADRP Cc1oc2ccccc2c1C[NH2+]C1CC([NH3+])C1 ZINC000906509198 638181751 /nfs/dbraw/zinc/18/17/51/638181751.db2.gz ACPVNWUIVWAQTA-UHFFFAOYSA-N 2 0 230.311 2.321 20 0 BEADRP CC(C)Oc1ccc(C[NH2+][C@H]2C[C@H]([NH3+])C2)cc1 ZINC000906508730 638181875 /nfs/dbraw/zinc/18/18/75/638181875.db2.gz WWEFBDYTKPETQH-JOCQHMNTSA-N 2 0 234.343 2.053 20 0 BEADRP C[C@H](CCc1ccccc1)C[NH2+]C1CC([NH3+])C1 ZINC000906510787 638184333 /nfs/dbraw/zinc/18/43/33/638184333.db2.gz XDDSTAHYIAENGA-LRVUVFPRSA-N 2 0 232.371 2.335 20 0 BEADRP C[C@H](CCc1ccccc1)C[NH2+][C@H]1C[C@H]([NH3+])C1 ZINC000906518351 638186979 /nfs/dbraw/zinc/18/69/79/638186979.db2.gz XDDSTAHYIAENGA-BPLDGKMQSA-N 2 0 232.371 2.335 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]CC2C3CC4CC(C3)CC2C4)C1 ZINC000906517553 638188313 /nfs/dbraw/zinc/18/83/13/638188313.db2.gz GZQGMRDZYOHYRW-ZEVCUBLFSA-N 2 0 234.387 2.138 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1CCC[C@@]2(CC[NH+](C)C2)C1 ZINC000930601076 639816988 /nfs/dbraw/zinc/81/69/88/639816988.db2.gz CUXQJJJZVWZYIP-ILXRZTDVSA-N 2 0 236.403 2.450 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@@H]2CCCCC[NH2+]2)C1 ZINC000129393494 639986095 /nfs/dbraw/zinc/98/60/95/639986095.db2.gz UDXLALDOCZBSJW-AGIUHOORSA-N 2 0 210.365 2.297 20 0 BEADRP CN1C[C@]2(C)C[NH+](Cc3ccccc3)C[C@@]2(C)C1 ZINC000931213534 640105901 /nfs/dbraw/zinc/10/59/01/640105901.db2.gz BKUDRQRPXYWSKT-HZPDHXFCSA-N 2 0 244.382 2.460 20 0 BEADRP CN1C[C@]2(C)C[N@@H+]([C@H]3C=CCCC3)C[C@]2(C)C1 ZINC000931310721 640148016 /nfs/dbraw/zinc/14/80/16/640148016.db2.gz MMEUWTRTHTYHIN-SOUVJXGZSA-N 2 0 234.387 2.369 20 0 BEADRP CC(C)CC[NH+]1CCC(C)([NH+](C)C)CC1 ZINC000931349771 640167990 /nfs/dbraw/zinc/16/79/90/640167990.db2.gz KNCPGVSIDAYTDZ-UHFFFAOYSA-N 2 0 212.381 2.449 20 0 BEADRP COCCCCC[NH+]1CCC(C)([NH+](C)C)CC1 ZINC000931350709 640168373 /nfs/dbraw/zinc/16/83/73/640168373.db2.gz VAUHVQYOPZKIMG-UHFFFAOYSA-N 2 0 242.407 2.219 20 0 BEADRP C[N@@H+]1CC[C@@H]2C[NH+](CC34CCC(CC3)C4)C[C@@H]2C1 ZINC000931437042 640202197 /nfs/dbraw/zinc/20/21/97/640202197.db2.gz MMQNSZPEGVYXON-FYRZTWFESA-N 2 0 248.414 2.450 20 0 BEADRP C[N@@H+]1CC[C@@H]2C[NH+](Cc3ccsc3)C[C@@H]2C1 ZINC000931438814 640203516 /nfs/dbraw/zinc/20/35/16/640203516.db2.gz PNYBBUVZGQPLHK-OLZOCXBDSA-N 2 0 236.384 2.132 20 0 BEADRP C[C@@H](C1CC1)[N@@H+]1CCN(c2cc[nH+]cc2)C[C@@H]1C ZINC000931764336 640356908 /nfs/dbraw/zinc/35/69/08/640356908.db2.gz PTIKMRHNJDXJOM-STQMWFEESA-N 2 0 245.370 2.391 20 0 BEADRP CC(C)C[C@H](C)[NH2+]CC1CC[NH+](C)CC1 ZINC000044515585 640399333 /nfs/dbraw/zinc/39/93/33/640399333.db2.gz MTKHAYHBEZVXGG-LBPRGKRZSA-N 2 0 212.381 2.352 20 0 BEADRP CC[N@@H+]1CCC[C@@H](C[NH2+]C2CCCC2)C1 ZINC000163726817 640414064 /nfs/dbraw/zinc/41/40/64/640414064.db2.gz NQNZUNQUHXQBKY-LBPRGKRZSA-N 2 0 210.365 2.251 20 0 BEADRP CC[C@@H]1C[N@H+](C[C@@]2(C)CCC[NH2+]C2)CCS1 ZINC000222152946 640457980 /nfs/dbraw/zinc/45/79/80/640457980.db2.gz AJRWQTOQBFZSTE-OLZOCXBDSA-N 2 0 242.432 2.204 20 0 BEADRP CSCC[C@@H](C)[N@H+](C)C[C@]1(C)CCC[NH2+]C1 ZINC000156903975 640516652 /nfs/dbraw/zinc/51/66/52/640516652.db2.gz CITRJNVQDBHUGK-CHWSQXEVSA-N 2 0 244.448 2.450 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[N@@H+]2CCc3ccccc3C2)C1 ZINC000165260916 640550612 /nfs/dbraw/zinc/55/06/12/640550612.db2.gz RUZUBDSFSWSDPX-SWLSCSKDSA-N 2 0 230.355 2.172 20 0 BEADRP CC[C@@H](c1ccccc1)[N@@H+]1CC[C@@H](C[NH3+])C1 ZINC000224195912 640602276 /nfs/dbraw/zinc/60/22/76/640602276.db2.gz DQIKBATVYWXJMY-JSGCOSHPSA-N 2 0 218.344 2.418 20 0 BEADRP C=C/C=C\CC[NH+]1C[C@H]2C[N@@H+](C)C[C@@]2(C)C1 ZINC000933734462 640759401 /nfs/dbraw/zinc/75/94/01/640759401.db2.gz QGZHAVSAPAARFQ-QJTIAFMVSA-N 2 0 220.360 2.002 20 0 BEADRP C[C@@H]1C[NH+](C[C@@]2(C)CCC[NH2+]C2)C[C@@H](C)S1 ZINC000226682745 640788641 /nfs/dbraw/zinc/78/86/41/640788641.db2.gz WCFJTWBLMOOWIT-UPJWGTAASA-N 2 0 242.432 2.202 20 0 BEADRP Cc1ccc(C)c(C[N@@H+]2CC[C@H]([NH3+])[C@@H](C)C2)c1 ZINC000227055712 640813677 /nfs/dbraw/zinc/81/36/77/640813677.db2.gz CNATUTXXMAPJHG-ZFWWWQNUSA-N 2 0 232.371 2.473 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]C[C@@H]1CC=CCC1 ZINC000227126923 640816427 /nfs/dbraw/zinc/81/64/27/640816427.db2.gz BZASSFVPXIYXQK-RDBSUJKOSA-N 2 0 222.376 2.450 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCCc2occc21 ZINC000227129171 640816781 /nfs/dbraw/zinc/81/67/81/640816781.db2.gz CCYUQOXJJFPZIR-WCFLWFBJSA-N 2 0 234.343 2.374 20 0 BEADRP C[NH+]1CCC(C)(C[NH2+]Cc2ccoc2)CC1 ZINC000227328244 640827930 /nfs/dbraw/zinc/82/79/30/640827930.db2.gz ZWCVGETVRMMQQZ-UHFFFAOYSA-N 2 0 222.332 2.101 20 0 BEADRP CCC[C@H](C)C[N@@H+]1CC[C@@H](C[NH3+])[C@@H](C)C1 ZINC000227768182 640848119 /nfs/dbraw/zinc/84/81/19/640848119.db2.gz CNTOGWRHJYPMPP-AVGNSLFASA-N 2 0 212.381 2.339 20 0 BEADRP Cc1ccc(OCC[N@H+]2CC[C@@H]([C@H](C)[NH3+])C2)cc1 ZINC000228202463 640866742 /nfs/dbraw/zinc/86/67/42/640866742.db2.gz LLBUTRIDTFBXIY-UONOGXRCSA-N 2 0 248.370 2.043 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[C@@H](C)C1)C1CC[NH+](C)CC1 ZINC000228909707 640904711 /nfs/dbraw/zinc/90/47/11/640904711.db2.gz PMYPMQXMFGVOAF-BZPMIXESSA-N 2 0 224.392 2.495 20 0 BEADRP CC[N@H+](CC1CCC1)C[C@]1(C)CCC[NH2+]C1 ZINC000230321329 641047392 /nfs/dbraw/zinc/04/73/92/641047392.db2.gz RSZNYUIVEAMPQU-CQSZACIVSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+][C@@H]2CCC[NH2+]CC2)C1 ZINC000230412224 641053055 /nfs/dbraw/zinc/05/30/55/641053055.db2.gz KZYQOWMVQMICMK-FRRDWIJNSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@]1(C[NH2+]C2CCCCC2)CCC[NH2+]C1 ZINC000062862196 641100806 /nfs/dbraw/zinc/10/08/06/641100806.db2.gz BFKGDUNWFLGRCR-CYBMUJFWSA-N 2 0 210.365 2.298 20 0 BEADRP COC(C)(C)CC[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000231026198 641133029 /nfs/dbraw/zinc/13/30/29/641133029.db2.gz QTJUNDPTUFDZHM-QWHCGFSZSA-N 2 0 240.391 2.018 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]CCSC(F)(F)F)C1 ZINC000231938000 641217679 /nfs/dbraw/zinc/21/76/79/641217679.db2.gz DQKBVOCMSUDGCY-JGVFFNPUSA-N 2 0 242.310 2.099 20 0 BEADRP CSCC(C)(C)[NH2+]CC[C@H]1CCC[N@@H+]1C ZINC000934670617 641241192 /nfs/dbraw/zinc/24/11/92/641241192.db2.gz VGVLYHIYGXSJQK-LLVKDONJSA-N 2 0 230.421 2.202 20 0 BEADRP C[NH+](C)C[C@H]1CC[N@H+](CCCC(C)(F)F)C1 ZINC000929637612 641382781 /nfs/dbraw/zinc/38/27/81/641382781.db2.gz LKHOCHGLGIKXTO-LLVKDONJSA-N 2 0 234.334 2.305 20 0 BEADRP COc1ccccc1[C@H](C)[NH2+][C@H]1CCC[C@@H]1C[NH3+] ZINC000089147630 641465579 /nfs/dbraw/zinc/46/55/79/641465579.db2.gz MVYNUZRJFZVPOY-SCRDCRAPSA-N 2 0 248.370 2.473 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]CCc1ccc(F)cc1 ZINC000089147134 641465923 /nfs/dbraw/zinc/46/59/23/641465923.db2.gz NOBBYMZAKNGVTO-JSGCOSHPSA-N 2 0 236.334 2.085 20 0 BEADRP Cc1cccc(OCC[NH2+][C@H]2CCC[C@H]2C[NH3+])c1 ZINC000089150418 641477148 /nfs/dbraw/zinc/47/71/48/641477148.db2.gz QWXINCUIBFGYNY-ZFWWWQNUSA-N 2 0 248.370 2.091 20 0 BEADRP COc1cccc([C@H](C)[NH2+][C@H]2CCC[C@@H]2C[NH3+])c1 ZINC000089149922 641477297 /nfs/dbraw/zinc/47/72/97/641477297.db2.gz ADQABIYVQWQTQO-LNSITVRQSA-N 2 0 248.370 2.473 20 0 BEADRP C[C@H](CSC(C)(C)C)[NH2+]CCC[NH+](C)C ZINC000151930868 641483119 /nfs/dbraw/zinc/48/31/19/641483119.db2.gz AQRVENYDONKGPE-LLVKDONJSA-N 2 0 232.437 2.448 20 0 BEADRP CC[C@H](C)[C@@H](C)[NH2+]C[C@@H]1CCCC[NH2+]C1 ZINC000319465492 641604436 /nfs/dbraw/zinc/60/44/36/641604436.db2.gz VQGUEGPCLTXSBO-YNEHKIRRSA-N 2 0 212.381 2.400 20 0 BEADRP Cl/C=C\C[NH+]1CCC([C@H]2CCC[NH2+]2)CC1 ZINC000214377206 641673382 /nfs/dbraw/zinc/67/33/82/641673382.db2.gz IFEJWLIIBVHAGW-DBGMKRSLSA-N 2 0 228.767 2.203 20 0 BEADRP CCC[N@H+](C)C[C@H]1CCN(CCC(=O)CC)C1 ZINC000190263573 641854743 /nfs/dbraw/zinc/85/47/43/641854743.db2.gz MFOKSQLPTMIQIS-CYBMUJFWSA-N 2 0 240.391 2.019 20 0 BEADRP CC1(C[NH2+]C2CC[NH2+]CC2)CCCCC1 ZINC000232848082 641870945 /nfs/dbraw/zinc/87/09/45/641870945.db2.gz UHEXOXRDMSQXQV-UHFFFAOYSA-N 2 0 210.365 2.298 20 0 BEADRP CSC(C)(C)C[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000154215114 641982697 /nfs/dbraw/zinc/98/26/97/641982697.db2.gz LFTDLDLMKHMDRY-MNOVXSKESA-N 2 0 230.421 2.200 20 0 BEADRP CSC(C)(C)C[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000154215027 641982185 /nfs/dbraw/zinc/98/21/85/641982185.db2.gz LFTDLDLMKHMDRY-WDEREUQCSA-N 2 0 230.421 2.200 20 0 BEADRP CC(C)C[C@H]1CC[N@H+](CCC[NH2+]C2CC2)C1 ZINC000307814701 642315703 /nfs/dbraw/zinc/31/57/03/642315703.db2.gz LFTODWSNWCWBTB-CYBMUJFWSA-N 2 0 224.392 2.497 20 0 BEADRP CCC[NH+](CCC)C[C@H]1CC[NH2+][C@@H](C)C1 ZINC000233023919 642643192 /nfs/dbraw/zinc/64/31/92/642643192.db2.gz JAUFTGQMFWOCSB-STQMWFEESA-N 2 0 212.381 2.497 20 0 BEADRP CCC1([NH2+]C[C@@H]2CC[NH2+][C@H](C)C2)CCC1 ZINC000233053698 642649865 /nfs/dbraw/zinc/64/98/65/642649865.db2.gz FZGICLPRCLWPMV-VXGBXAGGSA-N 2 0 210.365 2.297 20 0 BEADRP CCC1(C[NH2+][C@@H]2CCC[NH2+]CC2)CCC1 ZINC000233088495 642652061 /nfs/dbraw/zinc/65/20/61/642652061.db2.gz IIJRDHPOZWMCQF-GFCCVEGCSA-N 2 0 210.365 2.298 20 0 BEADRP CC[N@H+](CC[C@H]1CCC[NH2+]C1)CC1CC1 ZINC000068947153 642813851 /nfs/dbraw/zinc/81/38/51/642813851.db2.gz WRIIXVKBDGGLKT-GFCCVEGCSA-N 2 0 210.365 2.108 20 0 BEADRP CC[N@H+](CC[C@@H]1CCC[NH2+]C1)CC1CC1 ZINC000068947152 642814722 /nfs/dbraw/zinc/81/47/22/642814722.db2.gz WRIIXVKBDGGLKT-LBPRGKRZSA-N 2 0 210.365 2.108 20 0 BEADRP CC[C@@H](C)[NH2+]Cc1ccc(CC[NH3+])cc1 ZINC000070533133 643034762 /nfs/dbraw/zinc/03/47/62/643034762.db2.gz LKERCSYZZDJKLI-LLVKDONJSA-N 2 0 206.333 2.076 20 0 BEADRP CC[C@@H]1C[C@H](C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)CCO1 ZINC000414910525 643084520 /nfs/dbraw/zinc/08/45/20/643084520.db2.gz DBWJVNFIWZCMPH-XJFOESAGSA-N 2 0 240.391 2.051 20 0 BEADRP Cc1ccc(C[NH2+]CCC(C)(C)[NH3+])s1 ZINC000082773307 643525332 /nfs/dbraw/zinc/52/53/32/643525332.db2.gz GXSSSACNUBVEGL-UHFFFAOYSA-N 2 0 212.362 2.274 20 0 BEADRP CC1(C[NH2+][C@@H]2CCC[C@H]2C[NH3+])CCCC1 ZINC000084222019 643649917 /nfs/dbraw/zinc/64/99/17/643649917.db2.gz WTFHSDCPEGQPSB-NWDGAFQWSA-N 2 0 210.365 2.284 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]C1CCCCCC1 ZINC000084218029 643651955 /nfs/dbraw/zinc/65/19/55/643651955.db2.gz FWRCVRNRZGGPKZ-AAEUAGOBSA-N 2 0 210.365 2.426 20 0 BEADRP Cl/C=C\C[N@@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC000846220064 643652356 /nfs/dbraw/zinc/65/23/56/643652356.db2.gz ABCIQJUHVCROQD-MEJFOKSDSA-N 2 0 242.794 2.451 20 0 BEADRP CC[C@@H](c1ccccc1)[N@@H+]1CC[C@H](C[NH3+])C1 ZINC000050245128 643658155 /nfs/dbraw/zinc/65/81/55/643658155.db2.gz DQIKBATVYWXJMY-OCCSQVGLSA-N 2 0 218.344 2.418 20 0 BEADRP CC1CCC([N@H+](C)CC[C@@H]2CC[NH2+]C2)CC1 ZINC000084385171 643659431 /nfs/dbraw/zinc/65/94/31/643659431.db2.gz NMUFDYLITGTMSI-MOKVOYLWSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1ccc(C[NH2+]C2CC[NH2+]CC2)c(C)c1 ZINC000084487065 643663388 /nfs/dbraw/zinc/66/33/88/643663388.db2.gz WXMMDWJHJZUUGX-UHFFFAOYSA-N 2 0 218.344 2.145 20 0 BEADRP C[N@H+](C[C@@H]1CC[C@H]([NH3+])C1)C1CCCCC1 ZINC000085014351 643680071 /nfs/dbraw/zinc/68/00/71/643680071.db2.gz CBOBZULVAUMQFR-NEPJUHHUSA-N 2 0 210.365 2.378 20 0 BEADRP C[N@H+](CCC1C[C@H]2CC[C@@H](C1)[NH2+]2)CC1CC1 ZINC000086573171 644152373 /nfs/dbraw/zinc/15/23/73/644152373.db2.gz PERDZYCTDAMQEP-AGUYFDCRSA-N 2 0 222.376 2.249 20 0 BEADRP FC(F)(F)[C@H]1CCC[C@H]([NH2+][C@@H]2CC[NH2+]C2)C1 ZINC000086727886 644167151 /nfs/dbraw/zinc/16/71/51/644167151.db2.gz SJVXEZYSOZHYDR-LPEHRKFASA-N 2 0 236.281 2.059 20 0 BEADRP c1ccc2c(c1)CC[NH+](CCC[NH2+]C1CC1)CC2 ZINC000079571676 644192145 /nfs/dbraw/zinc/19/21/45/644192145.db2.gz HFSPGJSAHNGGOY-UHFFFAOYSA-N 2 0 244.382 2.229 20 0 BEADRP C([NH2+]C(C1CC1)C1CC1)[C@@H]1CCCCC[NH2+]1 ZINC000081080942 644307686 /nfs/dbraw/zinc/30/76/86/644307686.db2.gz GZDFDLWUBNZPTC-ZDUSSCGKSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@]1(C[NH3+])CC[N@H+](CCc2cccc(F)c2)C1 ZINC000923355024 644371161 /nfs/dbraw/zinc/37/11/61/644371161.db2.gz DUQQDSRXFZCPNO-CQSZACIVSA-N 2 0 236.334 2.039 20 0 BEADRP c1cncc([C@H]2CC[N@@H+](CCC[NH2+]C3CC3)C2)c1 ZINC000923383562 644395444 /nfs/dbraw/zinc/39/54/44/644395444.db2.gz KASPCZARRDINCO-AWEZNQCLSA-N 2 0 245.370 2.013 20 0 BEADRP C(C[NH2+]C1CC1)C[N@@H+]1CCC[C@H]2CCC[C@H]21 ZINC000083700362 644407373 /nfs/dbraw/zinc/40/73/73/644407373.db2.gz SAQRORBVPUHVOC-TZMCWYRMSA-N 2 0 222.376 2.393 20 0 BEADRP CC1CCC([NH2+][C@@H]2CCC[C@@H]2C[NH3+])CC1 ZINC000084217593 644420108 /nfs/dbraw/zinc/42/01/08/644420108.db2.gz HAOOSEZGYOBHKQ-POOIEITISA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1CC[C@H](C)[N@H+](CC[C@@H]2CC[NH2+]C2)C1 ZINC000084386250 644423424 /nfs/dbraw/zinc/42/34/24/644423424.db2.gz QWZKGKFWHLKVCX-AGIUHOORSA-N 2 0 210.365 2.106 20 0 BEADRP C[N@H+](CC[C@@H]1CC[NH2+]C1)Cc1cccs1 ZINC000084384763 644423900 /nfs/dbraw/zinc/42/39/00/644423900.db2.gz PMDYIFJVUQRDBD-NSHDSACASA-N 2 0 224.373 2.180 20 0 BEADRP [NH3+]C1CC[NH+](Cc2coc3ccccc23)CC1 ZINC000084511015 644426266 /nfs/dbraw/zinc/42/62/66/644426266.db2.gz CPDNXWUPDIHYPE-UHFFFAOYSA-N 2 0 230.311 2.356 20 0 BEADRP [NH3+]CC[C@H]1CC[N@@H+]([C@H]2CCc3ccc(F)cc32)C1 ZINC000923482573 644459657 /nfs/dbraw/zinc/45/96/57/644459657.db2.gz RJKCTYCVPRIXOG-NHYWBVRUSA-N 2 0 248.345 2.484 20 0 BEADRP [NH3+]CC[C@H]1CC[N@@H+]([C@@H]2CCc3ccc(F)cc32)C1 ZINC000923482574 644460148 /nfs/dbraw/zinc/46/01/48/644460148.db2.gz RJKCTYCVPRIXOG-XHDPSFHLSA-N 2 0 248.345 2.484 20 0 BEADRP CC(C)=CCC[N@@H+]1CC[C@@H](C[NH3+])[C@H](C)C1 ZINC000923490972 644464856 /nfs/dbraw/zinc/46/48/56/644464856.db2.gz PLBHVZLLVNZGJM-OLZOCXBDSA-N 2 0 210.365 2.259 20 0 BEADRP C[C@@H]1C[N@@H+]([C@@H]2C[C@H]2C(C)(C)C)CC[C@@H]1C[NH3+] ZINC000923492889 644467536 /nfs/dbraw/zinc/46/75/36/644467536.db2.gz QZUBRFLZITWPMW-FDYHWXHSSA-N 2 0 224.392 2.338 20 0 BEADRP COc1ccc(C[N@@H+]2CC[C@@H](C[NH3+])[C@@H](C)C2)cc1 ZINC000923499598 644472663 /nfs/dbraw/zinc/47/26/63/644472663.db2.gz TWWMEEUONJVDHO-JSGCOSHPSA-N 2 0 248.370 2.112 20 0 BEADRP C[C@H]1C[N@H+](CCc2cccs2)CC[C@@H]1C[NH3+] ZINC000923497849 644472853 /nfs/dbraw/zinc/47/28/53/644472853.db2.gz MTEMXQLBVYMSRT-NWDGAFQWSA-N 2 0 238.400 2.207 20 0 BEADRP Cc1ccccc1C[N@@H+]1CC[C@@H](C[NH3+])[C@@H](C)C1 ZINC000923505106 644475766 /nfs/dbraw/zinc/47/57/66/644475766.db2.gz YMOLSVUNATYSFB-KBPBESRZSA-N 2 0 232.371 2.412 20 0 BEADRP c1ccc([C@H]2C[C@@H]2[N@@H+]2C[C@@H]3CC[NH2+]C[C@@H]3C2)cc1 ZINC000923515608 644479376 /nfs/dbraw/zinc/47/93/76/644479376.db2.gz IJRQFGTUUUPCHL-JJXSEGSLSA-N 2 0 242.366 2.084 20 0 BEADRP CC(C)C[C@@H](C)C[N@@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1 ZINC000923522655 644486365 /nfs/dbraw/zinc/48/63/65/644486365.db2.gz XFCSFKOTGOBXHV-HZSPNIEDSA-N 2 0 224.392 2.210 20 0 BEADRP C1=CCC(C[N@@H+]2CC[C@@]3(C2)CCCC[NH2+]3)C1 ZINC000923532354 644489199 /nfs/dbraw/zinc/48/91/99/644489199.db2.gz CLRADAHNNYPGII-CQSZACIVSA-N 2 0 220.360 2.171 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc(F)cc1 ZINC000089139603 644536246 /nfs/dbraw/zinc/53/62/46/644536246.db2.gz YXLYJNRXNWEPQH-JSGCOSHPSA-N 2 0 236.334 2.433 20 0 BEADRP C[N@H+](CC[C@H]1CC[NH2+]C1)Cc1ccccc1F ZINC000089749194 644564704 /nfs/dbraw/zinc/56/47/04/644564704.db2.gz MHJPPKKOIWHZNJ-GFCCVEGCSA-N 2 0 236.334 2.257 20 0 BEADRP COc1ccc(C[N@H+](C)CC[C@@H]2CC[NH2+]C2)cc1 ZINC000089749227 644565688 /nfs/dbraw/zinc/56/56/88/644565688.db2.gz OAMMWTLRRLWVRU-ZDUSSCGKSA-N 2 0 248.370 2.127 20 0 BEADRP C[C@@H]1C[N@H+](CC2CCCCC2)CC[C@H]1C[NH3+] ZINC000251624979 644812965 /nfs/dbraw/zinc/81/29/65/644812965.db2.gz FCPMWKGCNOGEJL-OCCSQVGLSA-N 2 0 224.392 2.483 20 0 BEADRP C[C@H]1C[N@H+](CCc2cccc(F)c2)CC[C@H]1[NH3+] ZINC000251913656 644830630 /nfs/dbraw/zinc/83/06/30/644830630.db2.gz XJIIIDAGCBVIMP-SMDDNHRTSA-N 2 0 236.334 2.037 20 0 BEADRP CC(C)C[C@@H](C)C[N@@H+]1CC[C@@]2(CCC[NH2+]2)C1 ZINC000415141988 644883520 /nfs/dbraw/zinc/88/35/20/644883520.db2.gz QFBKYCGTCAATEG-KGLIPLIRSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)CCCN1CC[C@]2(CCC[NH2+]2)C1 ZINC000415141707 644886788 /nfs/dbraw/zinc/88/67/88/644886788.db2.gz PVFQUILZVABVJT-CYBMUJFWSA-N 2 0 210.365 2.251 20 0 BEADRP CCC[C@H](C)C[N@@H+]1CC[C@@]2(CCC[NH2+]2)C1 ZINC000415135604 644886815 /nfs/dbraw/zinc/88/68/15/644886815.db2.gz GJNRDVJHXIPHDI-STQMWFEESA-N 2 0 210.365 2.251 20 0 BEADRP C(C[N@@H+]1CCC2(CCCC2)C1)[C@H]1CC[NH2+]C1 ZINC000304349934 644895148 /nfs/dbraw/zinc/89/51/48/644895148.db2.gz GIQALAPOGHJAQM-CYBMUJFWSA-N 2 0 222.376 2.252 20 0 BEADRP CSC[C@H](C)[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000252918622 644925285 /nfs/dbraw/zinc/92/52/85/644925285.db2.gz ZEOFZEXEBFIPGS-ZDEQEGDKSA-N 2 0 242.432 2.248 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000252958074 644927160 /nfs/dbraw/zinc/92/71/60/644927160.db2.gz KYSFZPHFDBSNKX-PEBLQZBPSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H]([NH2+]C1CCC([NH+](C)C)CC1)c1ncco1 ZINC000926606014 645312700 /nfs/dbraw/zinc/31/27/00/645312700.db2.gz HPBPDZOWJNVVAS-UNXYVOJBSA-N 2 0 237.347 2.198 20 0 BEADRP C[C@]1(CC[NH2+][C@@H]2CCC[C@H]2C[NH3+])C[C@]1(F)Cl ZINC000844926577 645350094 /nfs/dbraw/zinc/35/00/94/645350094.db2.gz YULIPSJORMGUFA-WHOHXGKFSA-N 2 0 248.773 2.408 20 0 BEADRP C[N@H+]1C[C@H]2CC[C@@H](C1)C2[NH2+][C@@H]1CCCC12CC2 ZINC000926778895 645425744 /nfs/dbraw/zinc/42/57/44/645425744.db2.gz SOVARTYSYYKMMD-RBKKPWLPSA-N 2 0 234.387 2.249 20 0 BEADRP C[C@@H]1C[C@H]1[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000925488161 645503760 /nfs/dbraw/zinc/50/37/60/645503760.db2.gz BRPDDJUPBHZCDH-KWCYVHTRSA-N 2 0 218.344 2.465 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]C[C@]23C[C@H]2CCC3)[C@H](C)C1 ZINC000927119011 645555280 /nfs/dbraw/zinc/55/52/80/645555280.db2.gz IOLOFGPWTKYOJT-TUVASFSCSA-N 2 0 236.403 2.497 20 0 BEADRP [NH3+]CCC[C@H]([NH2+]C1CC1)c1ccccc1 ZINC000925494893 645926208 /nfs/dbraw/zinc/92/62/08/645926208.db2.gz RVTIGDUVPLCQJO-ZDUSSCGKSA-N 2 0 204.317 2.219 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH+]1CCC([NH+](C)C)CC1 ZINC000929264823 646046840 /nfs/dbraw/zinc/04/68/40/646046840.db2.gz VLYUHKFSQAAYOO-NEPJUHHUSA-N 2 0 210.365 2.059 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H](C)Cc1ccccn1 ZINC000924530067 646051241 /nfs/dbraw/zinc/05/12/41/646051241.db2.gz ZIEABMYNCPCFNP-AWEZNQCLSA-N 2 0 249.402 2.334 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@H]1[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000924646781 646083484 /nfs/dbraw/zinc/08/34/84/646083484.db2.gz HGBYFLNIJIGYAC-COMQUAJESA-N 2 0 236.403 2.495 20 0 BEADRP CC1(C)C[C@H]([NH3+])C[C@@H]([NH2+]CC2CCC2)C1 ZINC000925487540 646296959 /nfs/dbraw/zinc/29/69/59/646296959.db2.gz WTLCYRRMMOPUAA-VXGBXAGGSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1C[C@@H]1[NH2+][C@H]1CC[NH2+]C[C@H]1C1CCCC1 ZINC000925493397 646299387 /nfs/dbraw/zinc/29/93/87/646299387.db2.gz XMMJOLSBMOSNJY-SAXRGWBVSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]1C[C@@H]1[NH2+][C@H]1CC[NH2+]C[C@@H]1C1CCCC1 ZINC000925493400 646299998 /nfs/dbraw/zinc/29/99/98/646299998.db2.gz XMMJOLSBMOSNJY-ZZVYKPCYSA-N 2 0 222.376 2.153 20 0 BEADRP CC1(C)C[C@@H]([NH3+])C[C@@H]([NH2+]Cc2ccco2)C1 ZINC000925506029 646306540 /nfs/dbraw/zinc/30/65/40/646306540.db2.gz WSPVOBXMFJMFPU-WDEREUQCSA-N 2 0 222.332 2.275 20 0 BEADRP COC[C@H]([NH2+][C@H]1C[C@@H]([NH3+])CC(C)(C)C1)C(C)C ZINC000925518481 646313227 /nfs/dbraw/zinc/31/32/27/646313227.db2.gz RATWSPIHQCKJMJ-AGIUHOORSA-N 2 0 242.407 2.153 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1CC[C@H](C[NH+](C)CC)C1 ZINC000929791584 646321179 /nfs/dbraw/zinc/32/11/79/646321179.db2.gz UBGVYPLTJLJZAM-MCIONIFRSA-N 2 0 224.392 2.306 20 0 BEADRP CCC1(C[NH2+][C@H]2CC[NH2+]C23CCC3)CCC1 ZINC000925543607 646324882 /nfs/dbraw/zinc/32/48/82/646324882.db2.gz VPTLYNILSMONPV-LBPRGKRZSA-N 2 0 222.376 2.441 20 0 BEADRP CC1(C)C[C@@H]([NH2+]C[C@@H]2CCCS2)C[C@@H]([NH3+])C1 ZINC000925552619 646328777 /nfs/dbraw/zinc/32/87/77/646328777.db2.gz LIQLQWQWRYHKET-WOPDTQHZSA-N 2 0 242.432 2.378 20 0 BEADRP CC(C)[N@H+](C)CCN[C@H](c1ccccc1)[C@H](C)[NH3+] ZINC000925560617 646336358 /nfs/dbraw/zinc/33/63/58/646336358.db2.gz WTBKTMLJXGEJFE-ZFWWWQNUSA-N 2 0 249.402 2.005 20 0 BEADRP CC1(C)C[C@@H]([NH3+])C[C@@H]([NH2+]CCC2CC2)C1 ZINC000925572229 646340582 /nfs/dbraw/zinc/34/05/82/646340582.db2.gz HHPQKCWIMSDUMK-NWDGAFQWSA-N 2 0 210.365 2.282 20 0 BEADRP CCCC1(C[NH2+][C@@H]2CC[NH2+]C23CCC3)CC1 ZINC000925586340 646346744 /nfs/dbraw/zinc/34/67/44/646346744.db2.gz CMVUHKAREUFXFW-GFCCVEGCSA-N 2 0 222.376 2.441 20 0 BEADRP CC1(C)C[C@H]([NH3+])C[C@@H]([NH2+]C2CCSCC2)C1 ZINC000925592909 646348986 /nfs/dbraw/zinc/34/89/86/646348986.db2.gz ZNFLNYAIRSJMIV-ZYHUDNBSSA-N 2 0 242.432 2.378 20 0 BEADRP CC1(C)C[C@@H]1C[NH2+][C@H]1CC[NH2+]C12CCCC2 ZINC000925593529 646350952 /nfs/dbraw/zinc/35/09/52/646350952.db2.gz CKVBUUZIXMRVHF-NEPJUHHUSA-N 2 0 222.376 2.297 20 0 BEADRP CC1(C)C[C@H]([NH3+])C[C@@H]([NH2+]CCc2ccco2)C1 ZINC000925611293 646359865 /nfs/dbraw/zinc/35/98/65/646359865.db2.gz LUICVKWAQFABPO-VXGBXAGGSA-N 2 0 236.359 2.318 20 0 BEADRP CC1(C)C[C@@H]([NH3+])C[C@@H]([NH2+]CCc2ccncc2)C1 ZINC000925614362 646362594 /nfs/dbraw/zinc/36/25/94/646362594.db2.gz IIVJUGHQEBYOGN-UONOGXRCSA-N 2 0 247.386 2.120 20 0 BEADRP C[C@H]([NH2+][C@H]1CCOC1)c1cccc(C[NH+](C)C)c1 ZINC000925614798 646363149 /nfs/dbraw/zinc/36/31/49/646363149.db2.gz CKHUEWBNMCLBLK-WFASDCNBSA-N 2 0 248.370 2.188 20 0 BEADRP CC1(C)C[C@H]([NH3+])C[C@@H]([NH2+]Cc2ccoc2)C1 ZINC000925613828 646363437 /nfs/dbraw/zinc/36/34/37/646363437.db2.gz SVSQENVVJDKNKW-VXGBXAGGSA-N 2 0 222.332 2.275 20 0 BEADRP FCCC[NH2+][C@@H]1CC[NH2+]C[C@H]1C1CCCC1 ZINC000925621068 646367696 /nfs/dbraw/zinc/36/76/96/646367696.db2.gz YHEWPQARQHKHSR-QWHCGFSZSA-N 2 0 228.355 2.104 20 0 BEADRP CC(C)=CC[NH2+][C@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925659070 646396787 /nfs/dbraw/zinc/39/67/87/646396787.db2.gz SWFIEZLBCDGDMR-RYUDHWBXSA-N 2 0 210.365 2.448 20 0 BEADRP CC(C)=CC[NH2+][C@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925659067 646397023 /nfs/dbraw/zinc/39/70/23/646397023.db2.gz SWFIEZLBCDGDMR-NEPJUHHUSA-N 2 0 210.365 2.448 20 0 BEADRP C[C@@H]1CSC[C@@H]1[NH2+][C@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925671085 646400592 /nfs/dbraw/zinc/40/05/92/646400592.db2.gz QEXAJBPIFOYDTK-RHYQMDGZSA-N 2 0 242.432 2.234 20 0 BEADRP C[C@H](CCCCO)[NH2+][C@@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925678616 646407241 /nfs/dbraw/zinc/40/72/41/646407241.db2.gz DQBPKEKJAILHII-FRRDWIJNSA-N 2 0 242.407 2.033 20 0 BEADRP CC[C@@H]1OCC[C@H]1[NH2+][C@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925684430 646410695 /nfs/dbraw/zinc/41/06/95/646410695.db2.gz AYBCDKDPJOSGLR-XQHKEYJVSA-N 2 0 240.391 2.050 20 0 BEADRP CO[C@@H]1CCC[C@H]1[NH2+][C@@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925683547 646410859 /nfs/dbraw/zinc/41/08/59/646410859.db2.gz SIDUUBIDLJZJAL-UMSGYPCISA-N 2 0 240.391 2.050 20 0 BEADRP CC(C)C[C@@H]1C[C@H]1[NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2 ZINC000925690980 646417192 /nfs/dbraw/zinc/41/71/92/646417192.db2.gz HNRLFGUSKCEOSG-JPVAKHQASA-N 2 0 234.387 2.007 20 0 BEADRP C[C@@H](C[NH2+][C@@H]1CC[NH2+]C1(C)C)CC(F)(F)F ZINC000925693376 646418514 /nfs/dbraw/zinc/41/85/14/646418514.db2.gz BMSISIRECDTRIC-RKDXNWHRSA-N 2 0 238.297 2.305 20 0 BEADRP C1CC12C[C@@H]2[NH2+][C@@H]1CC[NH2+]C[C@H]1C1CCCC1 ZINC000925703480 646427473 /nfs/dbraw/zinc/42/74/73/646427473.db2.gz GEJBGHPKNCCJOV-MJBXVCDLSA-N 2 0 234.387 2.297 20 0 BEADRP C1[C@@H](N[C@H]2CC[NH2+]C23CCC3)[C@@H]1C1CCC1 ZINC000925704144 646428585 /nfs/dbraw/zinc/42/85/85/646428585.db2.gz IJXOFMZNEYUYCW-XQQFMLRXSA-N 2 0 220.360 2.049 20 0 BEADRP CC1(C)C[C@H]([NH3+])C[C@@H]([NH2+]CCCCCC[NH3+])C1 ZINC000925707227 646432084 /nfs/dbraw/zinc/43/20/84/646432084.db2.gz DKXGPCBATDXLBV-CHWSQXEVSA-N 3 0 241.423 2.001 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+][C@@H]1CC[C@H]2C[C@H]2C1 ZINC000925707204 646433204 /nfs/dbraw/zinc/43/32/04/646433204.db2.gz DALXZWHVLYDQCF-FAYSNVKESA-N 2 0 234.387 2.281 20 0 BEADRP C1[C@@H]2CC[C@@H]([NH2+][C@H]3CC[NH2+]C34CCCC4)C[C@H]12 ZINC000925712830 646436598 /nfs/dbraw/zinc/43/65/98/646436598.db2.gz PXLRZQPAPITWQF-FQUUOJAGSA-N 2 0 234.387 2.439 20 0 BEADRP C[C@@H](N)[C@@H]([NH2+]CCCCCC[NH3+])c1ccccc1 ZINC000925713407 646439694 /nfs/dbraw/zinc/43/96/94/646439694.db2.gz RVWBYZXSLGEPPO-UKRRQHHQSA-N 2 0 249.402 2.184 20 0 BEADRP CC1(C)C[C@]1(C)[NH2+][C@H]1C[C@@H]([NH3+])C12CCC2 ZINC000925716879 646440701 /nfs/dbraw/zinc/44/07/01/646440701.db2.gz RNXWKDPQJZVJPT-SCVCMEIPSA-N 2 0 208.349 2.035 20 0 BEADRP Cc1ncccc1C[NH2+][C@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925718991 646442440 /nfs/dbraw/zinc/44/24/40/646442440.db2.gz PBHUBFGODSDBBO-KGLIPLIRSA-N 2 0 247.386 2.386 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+]CC[C@@H]1CC=CCC1 ZINC000925718089 646442789 /nfs/dbraw/zinc/44/27/89/646442789.db2.gz GJPWPRBEKPANCZ-CHWSQXEVSA-N 2 0 222.376 2.463 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+]CC[C@H]1CC=CCC1 ZINC000925718093 646443330 /nfs/dbraw/zinc/44/33/30/646443330.db2.gz GJPWPRBEKPANCZ-STQMWFEESA-N 2 0 222.376 2.463 20 0 BEADRP CC(C)(F)C[NH2+][C@H]1CC[NH2+]C[C@@H]1C1CCCC1 ZINC000925725451 646449874 /nfs/dbraw/zinc/44/98/74/646449874.db2.gz UGOFIBOBWFQHJV-OLZOCXBDSA-N 2 0 242.382 2.492 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+][C@@H]2CCCC[C@@H]2F)C12CCC2 ZINC000925726339 646451576 /nfs/dbraw/zinc/45/15/76/646451576.db2.gz RJQSTMYYKJTBPJ-IRCOFANPSA-N 2 0 226.339 2.127 20 0 BEADRP CC(C)(C[NH2+][C@@H]1CCC[C@@H]1C[NH3+])CC(F)F ZINC000925735361 646453347 /nfs/dbraw/zinc/45/33/47/646453347.db2.gz ZMIVAINKEQEYGS-NXEZZACHSA-N 2 0 234.334 2.385 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1C=CCC1)[C@H]1CCCC[NH2+]1 ZINC000925733156 646455819 /nfs/dbraw/zinc/45/58/19/646455819.db2.gz SXHHWQUMKHYJOP-HZSPNIEDSA-N 2 0 222.376 2.463 20 0 BEADRP CCC[C@H](C)CC[NH2+][C@H](C)[C@H]1CC[NH2+]C1 ZINC000925735247 646458580 /nfs/dbraw/zinc/45/85/80/646458580.db2.gz XVXLJCVSQMVVKC-XQQFMLRXSA-N 2 0 212.381 2.400 20 0 BEADRP CC(C)(C[NH2+][C@@H]1CCC[C@@H]1[NH3+])CC(F)F ZINC000925733905 646459091 /nfs/dbraw/zinc/45/90/91/646459091.db2.gz MUXAVZIMWOAAPR-DTWKUNHWSA-N 2 0 220.307 2.137 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCCC1(F)F)[C@@H]1CC[NH2+]C1 ZINC000925736279 646460469 /nfs/dbraw/zinc/46/04/69/646460469.db2.gz LDMKKKPMJLVIPF-QJPTWQEYSA-N 2 0 246.345 2.400 20 0 BEADRP CCO[C@@H]1C[C@H]([NH2+]CCC(C)(C)[NH3+])C12CCC2 ZINC000925741821 646461995 /nfs/dbraw/zinc/46/19/95/646461995.db2.gz NQCFZMDBNFHPOA-NWDGAFQWSA-N 2 0 240.391 2.051 20 0 BEADRP COc1ccc2c(c1)[C@@H]([NH2+]CCC(C)(C)[NH3+])CC2 ZINC000925741509 646462560 /nfs/dbraw/zinc/46/25/60/646462560.db2.gz TYYVXXNJJRAFRT-AWEZNQCLSA-N 2 0 248.370 2.400 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+]CC[C@H]2CCCO2)c2ccccc21 ZINC000925775709 646475029 /nfs/dbraw/zinc/47/50/29/646475029.db2.gz RMIQFRCFJJALNI-BYCMXARLSA-N 2 0 246.354 2.290 20 0 BEADRP CCC[C@H](C)[C@@H](CC)[NH2+][C@@H]1C[NH2+]C[C@H]1C ZINC000925782229 646479078 /nfs/dbraw/zinc/47/90/78/646479078.db2.gz ITYCLHHQZYSIEA-UMSGYPCISA-N 2 0 212.381 2.399 20 0 BEADRP CCC[C@@H](C)[C@@H](CC)[NH2+][C@@H]1C[NH2+]C[C@H]1C ZINC000925782226 646479489 /nfs/dbraw/zinc/47/94/89/646479489.db2.gz ITYCLHHQZYSIEA-FDYHWXHSSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@H]1CC[C@H]1C(C)(C)C ZINC000925786351 646480723 /nfs/dbraw/zinc/48/07/23/646480723.db2.gz ROOFYJCLYALUIW-XQHKEYJVSA-N 2 0 224.392 2.256 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@@H]1CC[C@@H]1C1CCC1 ZINC000925785390 646481097 /nfs/dbraw/zinc/48/10/97/646481097.db2.gz NCTXTDUAJGSSQO-YXCITZCRSA-N 2 0 222.376 2.010 20 0 BEADRP CCC[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000925785253 646481816 /nfs/dbraw/zinc/48/18/16/646481816.db2.gz MHZLUEIQBOVWNK-YIYPIFLZSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+][C@H]1[C@H](C)CCC[C@@H]1C ZINC000925786109 646483410 /nfs/dbraw/zinc/48/34/10/646483410.db2.gz NYILBJNHHPPZDD-MLGHIDQZSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@H]1[C@H](C)CCC[C@@H]1C ZINC000925792135 646484941 /nfs/dbraw/zinc/48/49/41/646484941.db2.gz TZWUMYRGEHURIT-BJJPWKGXSA-N 2 0 224.392 2.256 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1C[NH2+]C[C@H]1C)c1ccco1 ZINC000925797344 646486320 /nfs/dbraw/zinc/48/63/20/646486320.db2.gz GGLXZDHITZORPP-IJLUTSLNSA-N 2 0 222.332 2.176 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+][C@@H]1CC[C@@H]1C1CC1 ZINC000925802459 646486577 /nfs/dbraw/zinc/48/65/77/646486577.db2.gz HHBZWFGIEOTNQB-FMKGYKFTSA-N 2 0 222.376 2.010 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+]C[C@@]12C[C@@H]1CCCC2 ZINC000925801326 646486873 /nfs/dbraw/zinc/48/68/73/646486873.db2.gz IQRGMKDRGVGCNU-SGMGOOAPSA-N 2 0 222.376 2.297 20 0 BEADRP CC(C)[C@H]([NH2+]CC[C@@H]1C[NH2+]C[C@H]1C)C1CC1 ZINC000925797388 646486898 /nfs/dbraw/zinc/48/68/98/646486898.db2.gz NUGAXDBMQLGNEG-BNOWGMLFSA-N 2 0 224.392 2.256 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]1[NH2+]CC1C[C@H]2CC[C@@H](C1)S2 ZINC000925801498 646486948 /nfs/dbraw/zinc/48/69/48/646486948.db2.gz KNUMQFBKDBSGNB-DMGDTADUSA-N 2 0 240.416 2.130 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1C[NH2+]C[C@H]1C)c1ccoc1 ZINC000925796772 646487122 /nfs/dbraw/zinc/48/71/22/646487122.db2.gz DQFRBLZRBAOCTO-IJLUTSLNSA-N 2 0 222.332 2.176 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CC[C@H]2C[C@H]21)[C@H]1CCC[NH2+]1 ZINC000925805489 646488267 /nfs/dbraw/zinc/48/82/67/646488267.db2.gz UIUJZJPCTHXSDB-HTVCTNPSSA-N 2 0 222.376 2.153 20 0 BEADRP C([NH2+][C@H]1CC[NH2+]C12CCC2)[C@@]12C[C@@H]1CCCC2 ZINC000925802642 646488530 /nfs/dbraw/zinc/48/85/30/646488530.db2.gz PIKWHFJOGRRFBW-MELADBBJSA-N 2 0 234.387 2.441 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@H](c1ccccn1)C1CC1 ZINC000925824138 646496982 /nfs/dbraw/zinc/49/69/82/646496982.db2.gz VOLVHXPTWSSEKH-WDMOLILDSA-N 2 0 233.359 2.248 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@H]1[C@@H]1C[C@H]1C)[C@H]1CCCC[NH2+]1 ZINC000925822989 646497223 /nfs/dbraw/zinc/49/72/23/646497223.db2.gz NFUFVRFMIBMXFC-QQOHENMQSA-N 2 0 222.376 2.151 20 0 BEADRP CC[C@H]([NH2+]CCC1CC=CC1)[C@@H]1CCC[NH2+]1 ZINC000925831263 646500810 /nfs/dbraw/zinc/50/08/10/646500810.db2.gz IMDMVQPRNYNBSO-KBPBESRZSA-N 2 0 222.376 2.463 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+]CCC1CC=CC1 ZINC000925830310 646501023 /nfs/dbraw/zinc/50/10/23/646501023.db2.gz CMCHGISUZHZGAR-JSGCOSHPSA-N 2 0 222.376 2.320 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]C[C@@H]1C[C@H]1C(F)(F)F ZINC000925830992 646501623 /nfs/dbraw/zinc/50/16/23/646501623.db2.gz HSUYVPSSXWNSOS-LPEHRKFASA-N 2 0 238.297 2.292 20 0 BEADRP C1=CCC(CC[NH2+][C@H]2CC[NH2+]C23CCC3)C1 ZINC000925834597 646503044 /nfs/dbraw/zinc/50/30/44/646503044.db2.gz ZERHZPCZRZBNQV-ZDUSSCGKSA-N 2 0 220.360 2.217 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+]CCC1CC=CC1 ZINC000925833656 646503477 /nfs/dbraw/zinc/50/34/77/646503477.db2.gz VEMPAZNXJIVLGU-DGKWVBSXSA-N 2 0 234.387 2.448 20 0 BEADRP C[C@H]1CCC[C@H]1[NH2+]C[C@]12CCC[C@H]1[NH2+]CC2 ZINC000925840060 646506025 /nfs/dbraw/zinc/50/60/25/646506025.db2.gz GRCSSNXCSOQXNY-REWJHTLYSA-N 2 0 222.376 2.297 20 0 BEADRP C([NH2+][C@H]1CCC12CCC2)[C@]12CCC[C@H]1[NH2+]CC2 ZINC000925840600 646506860 /nfs/dbraw/zinc/50/68/60/646506860.db2.gz MXDNXUUHWCLMIR-VNHYZAJKSA-N 2 0 234.387 2.441 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@H]2CC[NH2+]C2(C)C)CCS1 ZINC000925862038 646514299 /nfs/dbraw/zinc/51/42/99/646514299.db2.gz WKJKAGFQBWWDKN-VWYCJHECSA-N 2 0 228.405 2.001 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CC[NH2+]CC[C@H]2C)CCS1 ZINC000925860887 646514560 /nfs/dbraw/zinc/51/45/60/646514560.db2.gz LMJRXPFFIQWVRL-LPWJVIDDSA-N 2 0 242.432 2.248 20 0 BEADRP C1CC2(C1)C[C@H]([NH2+]C1CC[NH2+]CC1)CCS2 ZINC000925861819 646514705 /nfs/dbraw/zinc/51/47/05/646514705.db2.gz TYQOITCQOQSPPX-GFCCVEGCSA-N 2 0 240.416 2.146 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CC[NH2+]CC[C@@H]2C)CCS1 ZINC000925860886 646515309 /nfs/dbraw/zinc/51/53/09/646515309.db2.gz LMJRXPFFIQWVRL-LOWDOPEQSA-N 2 0 242.432 2.248 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CC[NH2+]C2(C)C)CCS1 ZINC000925862037 646515371 /nfs/dbraw/zinc/51/53/71/646515371.db2.gz WKJKAGFQBWWDKN-OUAUKWLOSA-N 2 0 228.405 2.001 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+][C@@H]1CCCc2cccnc21 ZINC000925871678 646522539 /nfs/dbraw/zinc/52/25/39/646522539.db2.gz DKFLBYSPMJICBX-NQBHXWOUSA-N 2 0 233.359 2.174 20 0 BEADRP C[C@@H](Cc1ccsc1)[NH2+]C[C@@H]1CC[C@H]([NH3+])C1 ZINC000925876078 646525729 /nfs/dbraw/zinc/52/57/29/646525729.db2.gz QODWHKNKUQQCAI-LOWVWBTDSA-N 2 0 238.400 2.396 20 0 BEADRP COC[C@H](C[NH2+][C@@H]1CCCC[C@H]1C[NH3+])C(C)C ZINC000925875111 646525929 /nfs/dbraw/zinc/52/59/29/646525929.db2.gz ZRAWAQILYCUPEK-MELADBBJSA-N 2 0 242.407 2.012 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CC[C@H]([NH3+])C2)o1 ZINC000925877316 646527566 /nfs/dbraw/zinc/52/75/66/646527566.db2.gz OGKWVMKMZSYYKH-UTUOFQBUSA-N 2 0 222.332 2.366 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+]C[C@@H]1CC[C@H]([NH3+])C1 ZINC000925877527 646527820 /nfs/dbraw/zinc/52/78/20/646527820.db2.gz RJLABWAWJVDRAY-UPJWGTAASA-N 2 0 236.359 2.318 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[NH2+][C@H]2CCC[C@@H]2CCF)C1 ZINC000925881147 646531373 /nfs/dbraw/zinc/53/13/73/646531373.db2.gz YECFMCUCLLOXDM-LOWDOPEQSA-N 2 0 228.355 2.232 20 0 BEADRP C[C@H]([NH2+]CC1CCC=CCC1)[C@H]1CCC[NH2+]1 ZINC000925881767 646531621 /nfs/dbraw/zinc/53/16/21/646531621.db2.gz UUPNLRKDQFILBX-GXTWGEPZSA-N 2 0 222.376 2.463 20 0 BEADRP c1nc2c([nH]1)C[C@H]([NH2+][C@@H]1CC3CCC1CC3)CC2 ZINC000926451085 646641725 /nfs/dbraw/zinc/64/17/25/646641725.db2.gz VUODOMIYDIWTNI-UAKHECDHSA-N 2 0 245.370 2.435 20 0 BEADRP C[C@H]([NH2+][C@H]1CCc2nc[nH]c2C1)c1ccns1 ZINC000926451161 646641737 /nfs/dbraw/zinc/64/17/37/646641737.db2.gz WPBOFRKQLDPJQW-IUCAKERBSA-N 2 0 248.355 2.074 20 0 BEADRP c1nc2c([nH]1)C[C@@H]([NH2+][C@@H]1CC3CCC1CC3)CC2 ZINC000926451082 646641744 /nfs/dbraw/zinc/64/17/44/646641744.db2.gz VUODOMIYDIWTNI-CXHDDBMJSA-N 2 0 245.370 2.435 20 0 BEADRP C[C@H](C[NH2+]C1CC2(C1)CCCC2)C[NH+](C)C ZINC000926473624 646653789 /nfs/dbraw/zinc/65/37/89/646653789.db2.gz MKYSAYGICRPJLU-GFCCVEGCSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH+](C)CCC[NH2+][C@H]1CC2CCC1CC2 ZINC000308898350 711574173 /nfs/dbraw/zinc/57/41/73/711574173.db2.gz BFQVBEZBONZCAY-BPCQOVAHSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC[C@@H]1C)C[NH+]1CCCC1 ZINC000393727808 711676680 /nfs/dbraw/zinc/67/66/80/711676680.db2.gz APFGDIIJNQNMRP-AGIUHOORSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1C[N@H+](CCCC(C)(F)F)C[C@H]1CC[NH3+] ZINC000723887072 711731236 /nfs/dbraw/zinc/73/12/36/711731236.db2.gz PWQNXFSGUCUIQY-GHMZBOCLSA-N 2 0 234.334 2.339 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@H]1CC[C@@H](C2CC2)O1 ZINC000722316082 711735074 /nfs/dbraw/zinc/73/50/74/711735074.db2.gz LGQYWENUHGKRHD-BNOWGMLFSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@H]([NH2+]C[C@]12C[C@H]1CCC2)[C@H]1CCCC[NH2+]1 ZINC000925879808 711761838 /nfs/dbraw/zinc/76/18/38/711761838.db2.gz CNLCJTIYFZOPSW-DGAVXFQQSA-N 2 0 222.376 2.297 20 0 BEADRP C[NH+](C)CCCC(C)(C)[NH2+]C[C@@H]1CCC=CO1 ZINC000387280521 711786685 /nfs/dbraw/zinc/78/66/85/711786685.db2.gz GALLGATVYWZCEL-ZDUSSCGKSA-N 2 0 240.391 2.389 20 0 BEADRP CCCCC[C@@H](C)[NH2+]C[C@]1(COC)CCC[NH2+]1 ZINC000701282059 711857937 /nfs/dbraw/zinc/85/79/37/711857937.db2.gz BYRYDNFQTHFDFL-KGLIPLIRSA-N 2 0 242.407 2.313 20 0 BEADRP [NH3+]CCC1CC[NH+](CCc2cccs2)CC1 ZINC000071548990 711899103 /nfs/dbraw/zinc/89/91/03/711899103.db2.gz WHTGFDSAXDQCIL-UHFFFAOYSA-N 2 0 238.400 2.351 20 0 BEADRP CCC[N@H+](CC1CC1)C[C@@H]1CCCC[NH2+]C1 ZINC000700235694 711988220 /nfs/dbraw/zinc/98/82/20/711988220.db2.gz CTEPTHAEBCGXGR-CQSZACIVSA-N 2 0 224.392 2.498 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]CCCC2CCC2)C12CCC2 ZINC000701771978 712028919 /nfs/dbraw/zinc/02/89/19/712028919.db2.gz LSUNUKKPDAVTEG-CHWSQXEVSA-N 2 0 222.376 2.426 20 0 BEADRP CC(C)C[C@@H]1CCC[N@@H+]1C[C@H]1C[C@@H]([NH3+])C1 ZINC000703614536 712081021 /nfs/dbraw/zinc/08/10/21/712081021.db2.gz BNFCCMLWQUSDSD-XQQFMLRXSA-N 2 0 210.365 2.234 20 0 BEADRP CC[N@H+](CC1C[C@H]2CC[C@@H](C1)[NH2+]2)C1CCC1 ZINC000706869936 712157501 /nfs/dbraw/zinc/15/75/01/712157501.db2.gz JAGNKBYUKFPVIV-YHWZYXNKSA-N 2 0 222.376 2.391 20 0 BEADRP CSC1CC([NH2+][C@@H]2CC[N@@H+]3CCCC[C@@H]23)C1 ZINC000706929183 712161368 /nfs/dbraw/zinc/16/13/68/712161368.db2.gz OTPLVKLXKORXCO-TUUUFIMRSA-N 2 0 240.416 2.097 20 0 BEADRP CSC1CC([NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)C1 ZINC000706927321 712161655 /nfs/dbraw/zinc/16/16/55/712161655.db2.gz GSQRQQHTWZHUQP-QCXCNERSSA-N 2 0 240.416 2.097 20 0 BEADRP CCC[C@H]1CCC[N@H+](C[C@@H]2C[NH2+]C[C@H]2C)C1 ZINC000708511934 712212074 /nfs/dbraw/zinc/21/20/74/712212074.db2.gz XCPLGCPFILZMHB-RDBSUJKOSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+][C@@H]1C[C@@H]2CC[C@@H](C2)C1 ZINC000711071432 712279011 /nfs/dbraw/zinc/27/90/11/712279011.db2.gz RQZLGTYNXSELRR-FQUUOJAGSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]C[C@@H]1CCC(C)(C)CO1 ZINC000711389469 712296683 /nfs/dbraw/zinc/29/66/83/712296683.db2.gz IYXPHVZTYOGQJE-STQMWFEESA-N 2 0 242.407 2.299 20 0 BEADRP [NH3+]CCCCCCC[N@@H+]1C[C@@H]2CSC[C@@H]2C1 ZINC000711600628 712311752 /nfs/dbraw/zinc/31/17/52/712311752.db2.gz QBJFQXIIRJIYHI-BETUJISGSA-N 2 0 242.432 2.190 20 0 BEADRP [NH3+]CC[C@@H]1CC[N@H+](CCCCC(F)(F)F)C1 ZINC000923479646 712334306 /nfs/dbraw/zinc/33/43/06/712334306.db2.gz AJLQUOZNWILBBY-SNVBAGLBSA-N 2 0 238.297 2.390 20 0 BEADRP C[C@@H]1CCCN1CC[NH2+][C@H]1CC[C@H]1C1CC1 ZINC000390436038 712417313 /nfs/dbraw/zinc/41/73/13/712417313.db2.gz SDWLKFGTJPNAOF-XBFCOCLRSA-N 2 0 222.376 2.249 20 0 BEADRP C=C/C=C/CC[NH2+]CC1CC[NH+](C)CC1 ZINC000713697866 712469365 /nfs/dbraw/zinc/46/93/65/712469365.db2.gz YCPGVBNASMZVFQ-SNAWJCMRSA-N 2 0 208.349 2.050 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH+]1CCC(C(C)(C)C[NH3+])CC1 ZINC000714415675 712485762 /nfs/dbraw/zinc/48/57/62/712485762.db2.gz XQQBYPUXMGIFPS-VXGBXAGGSA-N 2 0 224.392 2.339 20 0 BEADRP C[C@@H]([NH2+]CCCC[NH+](C)C)c1ccns1 ZINC000716022653 712546883 /nfs/dbraw/zinc/54/68/83/712546883.db2.gz NZWFSINEPXMRJC-SNVBAGLBSA-N 2 0 227.377 2.136 20 0 BEADRP CCC[NH2+]C1CC[NH+](CCC(C)C)CC1 ZINC000037240446 712556622 /nfs/dbraw/zinc/55/66/22/712556622.db2.gz FJCWISAOUQSWAH-UHFFFAOYSA-N 2 0 212.381 2.497 20 0 BEADRP CC(C)C1CC([NH2+]C[C@H]2C[NH2+]CCC2(F)F)C1 ZINC000717361979 712652209 /nfs/dbraw/zinc/65/22/09/712652209.db2.gz LFSTTZPWIUOJEG-MOENNCHZSA-N 2 0 246.345 2.255 20 0 BEADRP CC(C)C1CC([NH2+]C[C@@H]2C[NH2+]CCC2(F)F)C1 ZINC000717361977 712652254 /nfs/dbraw/zinc/65/22/54/712652254.db2.gz LFSTTZPWIUOJEG-CXQJBGSLSA-N 2 0 246.345 2.255 20 0 BEADRP CC[C@H]1[C@@H](C)CC[N@@H+]1C[C@@H]1CC[C@H]([NH3+])C1 ZINC000717936761 712734773 /nfs/dbraw/zinc/73/47/73/712734773.db2.gz ZADJYYRMRJDQRX-RNJOBUHISA-N 2 0 210.365 2.234 20 0 BEADRP C[NH+]1CCC(C[NH2+]C2CCC=CCC2)CC1 ZINC000718083456 712741780 /nfs/dbraw/zinc/74/17/80/712741780.db2.gz RXVXXNKJHKKWLH-UHFFFAOYSA-N 2 0 222.376 2.417 20 0 BEADRP C[C@@H]([NH3+])[C@@H]1CC[N@H+](CCCC(C)(F)F)C1 ZINC000718569757 712775240 /nfs/dbraw/zinc/77/52/40/712775240.db2.gz HMUWOMKMJAXMFJ-NXEZZACHSA-N 2 0 220.307 2.091 20 0 BEADRP COCC(C)(C)CC[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000718662701 712776799 /nfs/dbraw/zinc/77/67/99/712776799.db2.gz AOJCHHBGBCNLRM-CHWSQXEVSA-N 2 0 242.407 2.121 20 0 BEADRP CO[C@@H]1CCC[C@@H]([NH2+][C@@H](C)CC[NH+](C)C)CC1 ZINC000718838907 712785214 /nfs/dbraw/zinc/78/52/14/712785214.db2.gz BZQLMEKTMDCAIO-BFHYXJOUSA-N 2 0 242.407 2.264 20 0 BEADRP CO[C@@H]1CCC[C@@H]([NH2+]C[C@@H](C)C[NH+](C)C)CC1 ZINC000718845834 712785966 /nfs/dbraw/zinc/78/59/66/712785966.db2.gz XJVJNUBIDHMDND-MGPQQGTHSA-N 2 0 242.407 2.121 20 0 BEADRP CSCC1CC[NH+](C[C@@H]2CCC[NH2+]C2)CC1 ZINC000719266156 712802186 /nfs/dbraw/zinc/80/21/86/712802186.db2.gz JOJRXNYENSCAEZ-CYBMUJFWSA-N 2 0 242.432 2.061 20 0 BEADRP CC(C)[C@@H]1CCC[N@@H+]1[C@H]1CC[NH2+][C@H](C)C1 ZINC000252965020 1166760243 /nfs/dbraw/zinc/76/02/43/1166760243.db2.gz WWQYFFWTGKXLIQ-AGIUHOORSA-N 2 0 210.365 2.247 20 0 BEADRP C[C@H]1CC[C@@H]1[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000381318689 710622450 /nfs/dbraw/zinc/62/24/50/710622450.db2.gz NYQQCAIKKDGFMD-ABXWRUBCSA-N 2 0 222.376 2.391 20 0 BEADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H]2CC[C@H]2C)C1 ZINC000381531624 710651415 /nfs/dbraw/zinc/65/14/15/710651415.db2.gz ZIPXNWAKXMKKGR-MCIONIFRSA-N 2 0 224.392 2.495 20 0 BEADRP CCC[NH+]1CCC(C[NH2+][C@@H]2CC[C@H]2C)CC1 ZINC000381712191 710682800 /nfs/dbraw/zinc/68/28/00/710682800.db2.gz KLTUXOCQCHHBQI-TZMCWYRMSA-N 2 0 224.392 2.497 20 0 BEADRP CCO[C@@H]1CCC[C@H]([NH2+]CC[C@H](C)[NH+](C)C)C1 ZINC000721238858 712900070 /nfs/dbraw/zinc/90/00/70/712900070.db2.gz LPLHYJAVYKNRPS-MELADBBJSA-N 2 0 242.407 2.264 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1CC[C@@H]([NH3+])[C@H](CC)C1 ZINC000723081857 710726549 /nfs/dbraw/zinc/72/65/49/710726549.db2.gz WPJIOWAVRJUGPP-FVCCEPFGSA-N 2 0 210.365 2.092 20 0 BEADRP C[C@@H]1C[N@H+](C[C@@H]2CCC[C@@H](C)C2)C[C@H]1[NH3+] ZINC000723469761 710727987 /nfs/dbraw/zinc/72/79/87/710727987.db2.gz IALMBPNPHJGOON-FDYHWXHSSA-N 2 0 210.365 2.092 20 0 BEADRP CC(C)C(C)(C)C[NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23 ZINC000383308272 710979961 /nfs/dbraw/zinc/97/99/61/710979961.db2.gz NBHWITJQSAUHBO-MEBFFEOJSA-N 2 0 236.403 2.255 20 0 BEADRP CC(C)C(C)(C)C[NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32 ZINC000383308274 710980308 /nfs/dbraw/zinc/98/03/08/710980308.db2.gz NBHWITJQSAUHBO-QSLWVIQJSA-N 2 0 236.403 2.255 20 0 BEADRP CC1(C)C[N@H+](CCCCCCC[NH3+])CCCO1 ZINC000384019367 710987968 /nfs/dbraw/zinc/98/79/68/710987968.db2.gz PQAJHBWHZWFSGQ-UHFFFAOYSA-N 2 0 242.407 2.397 20 0 BEADRP C[C@@H](Cc1ccc(F)cc1)[NH2+]CCC(C)(C)[NH3+] ZINC000384092127 710988640 /nfs/dbraw/zinc/98/86/40/710988640.db2.gz ZDTFBKICYAPYCH-NSHDSACASA-N 2 0 238.350 2.474 20 0 BEADRP C[C@H](CC(C)(C)C)[NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2 ZINC000384575868 710994402 /nfs/dbraw/zinc/99/44/02/710994402.db2.gz VYLJMQVGKONMCA-WFQJECDVSA-N 2 0 236.403 2.397 20 0 BEADRP C[C@H]([N@H+](C)CCC[NH2+]C1CC1)C1(C)CC1 ZINC000385301950 711009755 /nfs/dbraw/zinc/00/97/55/711009755.db2.gz NCWRSOBUHYJHEI-NSHDSACASA-N 2 0 210.365 2.249 20 0 BEADRP CC[N@H+](CCC1CC1)C[C@@]1(C)CCC[NH2+]C1 ZINC000385490481 711012690 /nfs/dbraw/zinc/01/26/90/711012690.db2.gz DZLNRYNRNUWMHW-AWEZNQCLSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23 ZINC000385486676 711013583 /nfs/dbraw/zinc/01/35/83/711013583.db2.gz HETWZSJHWLNYBP-GBIHRFPISA-N 2 0 248.414 2.399 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@]2(C)CCC[NH2+]C2)[C@H]1C ZINC000380702824 712902529 /nfs/dbraw/zinc/90/25/29/712902529.db2.gz XSIZJJVEFUAALL-FRRDWIJNSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@H]2[C@@H]3[NH2+]C[C@H]4C[C@H]2C[C@H]34)[C@@H]1C ZINC000385667813 711016263 /nfs/dbraw/zinc/01/62/63/711016263.db2.gz YSVWIGMYPGDVSZ-VSPOPZGASA-N 2 0 248.414 2.397 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+][C@H]1CCC[C@H]([NH+](C)C)C1 ZINC000389618888 711082476 /nfs/dbraw/zinc/08/24/76/711082476.db2.gz HVAMZKZPMZIBPM-VOAKCMCISA-N 2 0 210.365 2.247 20 0 BEADRP C[C@H]1C[C@H]([NH3+])CC[N@@H+]1CCCC(C)(F)F ZINC000390075491 711104586 /nfs/dbraw/zinc/10/45/86/711104586.db2.gz SMNJGKDMCGNMTO-VHSXEESVSA-N 2 0 220.307 2.233 20 0 BEADRP C[C@H]1C[C@@H]([NH3+])CC[N@@H+]1CCCC(C)(F)F ZINC000390075490 711104949 /nfs/dbraw/zinc/10/49/49/711104949.db2.gz SMNJGKDMCGNMTO-UWVGGRQHSA-N 2 0 220.307 2.233 20 0 BEADRP CC(C)C[C@H](C)[NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32 ZINC000392871601 711153461 /nfs/dbraw/zinc/15/34/61/711153461.db2.gz JLNYROZZTTZURR-SNIKSBKOSA-N 2 0 222.376 2.007 20 0 BEADRP CCCN1CCC[C@H]1C[NH2+][C@H]1CC[C@H]1C ZINC000393604695 711164927 /nfs/dbraw/zinc/16/49/27/711164927.db2.gz CHSCZDAYULEIEB-AGIUHOORSA-N 2 0 210.365 2.249 20 0 BEADRP CCCN1CCC[C@H]1C[NH2+][C@@H]1CC[C@@H]1C ZINC000393604698 711165115 /nfs/dbraw/zinc/16/51/15/711165115.db2.gz CHSCZDAYULEIEB-RWMBFGLXSA-N 2 0 210.365 2.249 20 0 BEADRP C[NH2+]CCC1CC[NH+](CCCC2CC2)CC1 ZINC000394556156 711193538 /nfs/dbraw/zinc/19/35/38/711193538.db2.gz KHEMOKRIXURMIJ-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP CC[C@@H]1C[C@H](C)C[N@@H+]1C[C@@H]([NH3+])CC(F)F ZINC000399143541 711421780 /nfs/dbraw/zinc/42/17/80/711421780.db2.gz CNVXJPQJMMCOLJ-LPEHRKFASA-N 2 0 220.307 2.089 20 0 BEADRP CC[C@@]1(C)CC[N@H+](CCC[NH2+]C2CC2)C1 ZINC000399386793 711428740 /nfs/dbraw/zinc/42/87/40/711428740.db2.gz RJOVBKCXQDLUER-ZDUSSCGKSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@H]1CC[C@H]1[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000381258191 710613611 /nfs/dbraw/zinc/61/36/11/710613611.db2.gz RHYIIIWNWLGUQG-SMDDNHRTSA-N 2 0 222.376 2.249 20 0 BEADRP Cc1nc(C)c(C[NH2+]CC[C@@H]([NH3+])C(C)C)s1 ZINC000381278772 710616522 /nfs/dbraw/zinc/61/65/22/710616522.db2.gz XOXOGWCDUSEAJN-LLVKDONJSA-N 2 0 241.404 2.223 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1CC[C@H]([NH3+])[C@H](CC)C1 ZINC000723081858 710725985 /nfs/dbraw/zinc/72/59/85/710725985.db2.gz WPJIOWAVRJUGPP-NDBYEHHHSA-N 2 0 210.365 2.092 20 0 BEADRP [NH3+]C1CC([NH2+]Cc2ccccc2C(F)(F)F)C1 ZINC000133279734 710969413 /nfs/dbraw/zinc/96/94/13/710969413.db2.gz LFMJVEBJURYPKR-UHFFFAOYSA-N 2 0 244.260 2.285 20 0 BEADRP CC[C@H]1[C@H](C)CC[N@@H+]1CCC[NH2+]C1CC1 ZINC000383629486 710984965 /nfs/dbraw/zinc/98/49/65/710984965.db2.gz VPBUXESKMDTAMC-YPMHNXCESA-N 2 0 210.365 2.249 20 0 BEADRP CS[C@@H]1CC[C@H]([NH2+][C@@H](C)[C@H]2CCCC[NH2+]2)C1 ZINC000386552791 711033131 /nfs/dbraw/zinc/03/31/31/711033131.db2.gz HGUTYKXJBXOMLM-WUHRBBMRSA-N 2 0 242.432 2.391 20 0 BEADRP C[C@H]([NH2+]C/C=C/Cl)C1CC[NH+](C)CC1 ZINC000396500012 711222904 /nfs/dbraw/zinc/22/29/04/711222904.db2.gz VFNUJBQLXIAZJM-YVGDHZEHSA-N 2 0 216.756 2.059 20 0 BEADRP Cc1cc(C)c(C[NH2+]CC2CC[NH+](C)CC2)cn1 ZINC000397122574 711376552 /nfs/dbraw/zinc/37/65/52/711376552.db2.gz ZNJLYVBFFIEPPE-UHFFFAOYSA-N 2 0 247.386 2.130 20 0 BEADRP C[C@@H]1C[C@@H](C)[N@H+](CCCC2CC2)C[C@@H]1C[NH3+] ZINC000397476380 711384535 /nfs/dbraw/zinc/38/45/35/711384535.db2.gz HFQJAQPCDHNTBE-BZPMIXESSA-N 2 0 224.392 2.482 20 0 BEADRP C([NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2)C1CCCCC1 ZINC000383232509 711481611 /nfs/dbraw/zinc/48/16/11/711481611.db2.gz BNUYGRPQEJXIQG-LXFSFDBISA-N 2 0 234.387 2.153 20 0 BEADRP C=C/C=C/CC[N@H+]1CCCC[C@H]1CC[NH3+] ZINC000713734693 711494446 /nfs/dbraw/zinc/49/44/46/711494446.db2.gz LGWNHINBKOSNGU-OOPCZODUSA-N 2 0 208.349 2.322 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH+]1CCC([C@@H]2CCC[NH2+]2)CC1 ZINC000723087466 711501470 /nfs/dbraw/zinc/50/14/70/711501470.db2.gz FRWZLGUZCBYLAC-SNPRPXQTSA-N 2 0 236.403 2.497 20 0 BEADRP C([NH2+][C@@H]1CC[C@@H]2CCCC[C@@H]2C1)C1C[NH2+]C1 ZINC000723659714 711531925 /nfs/dbraw/zinc/53/19/25/711531925.db2.gz VMXVIGOOHJIIJV-BFHYXJOUSA-N 2 0 222.376 2.154 20 0 BEADRP CCOc1ccccc1C[N@@H+]1CC[C@@H](CC[NH3+])C1 ZINC000723669044 711533403 /nfs/dbraw/zinc/53/34/03/711533403.db2.gz FJSJYSWVDNVTLT-CYBMUJFWSA-N 2 0 248.370 2.256 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@H](CC[NH3+])C2)cc1F ZINC000723668761 711533513 /nfs/dbraw/zinc/53/35/13/711533513.db2.gz BUGPODAMVMEUAG-LBPRGKRZSA-N 2 0 236.334 2.305 20 0 BEADRP CCOc1cccc(C[N@@H+]2CC[C@@H](CC[NH3+])C2)c1 ZINC000723690147 711533683 /nfs/dbraw/zinc/53/36/83/711533683.db2.gz MLQPVVYUKPPMGI-CYBMUJFWSA-N 2 0 248.370 2.256 20 0 BEADRP Cc1cc(C)nc(C[NH+]2CCC([C@@H](C)[NH3+])CC2)c1 ZINC000723845989 711539064 /nfs/dbraw/zinc/53/90/64/711539064.db2.gz MWFBWGUNGSMUDF-CYBMUJFWSA-N 2 0 247.386 2.258 20 0 BEADRP C[C@@H]1C[N@H+](Cc2cccs2)C[C@H]1CC[NH3+] ZINC000723910184 711544995 /nfs/dbraw/zinc/54/49/95/711544995.db2.gz SYBMHUZCHZUTEJ-GHMZBOCLSA-N 2 0 224.373 2.165 20 0 BEADRP COc1ccc(C[N@@H+]2C[C@@H](C)[C@H](CC[NH3+])C2)cc1 ZINC000723902691 711545123 /nfs/dbraw/zinc/54/51/23/711545123.db2.gz YPPHTUCGDWFZNT-TZMCWYRMSA-N 2 0 248.370 2.112 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCC[C@@H]([NH3+])C1)[C@H]1CCCOC1 ZINC000723986896 711550863 /nfs/dbraw/zinc/55/08/63/711550863.db2.gz LXDNEZGPUBYMJK-DGAVXFQQSA-N 2 0 240.391 2.051 20 0 BEADRP CC[C@@H]([NH2+]CCCC[NH+](C)C)[C@H]1CCCOC1 ZINC000724006214 711554590 /nfs/dbraw/zinc/55/45/90/711554590.db2.gz JRUMKVVNSBAQOG-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@@H]([NH2+]CCC1CC=CC1)[C@H]1CCC[NH2+]1 ZINC000724127733 711563320 /nfs/dbraw/zinc/56/33/20/711563320.db2.gz ARGAEWGESUKRQY-DGCLKSJQSA-N 2 0 208.349 2.073 20 0 BEADRP CO[C@H]1CC[C@H]1[N@H+](C)CCCCCCC[NH3+] ZINC000724205274 711569627 /nfs/dbraw/zinc/56/96/27/711569627.db2.gz ADUPICYPVHOILN-OLZOCXBDSA-N 2 0 228.380 2.005 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+]C1CCC([NH3+])CC1 ZINC000335049124 711719977 /nfs/dbraw/zinc/71/99/77/711719977.db2.gz IYBNHBUWVJAWCN-IFWUJCSASA-N 2 0 210.365 2.281 20 0 BEADRP C1CC12CCC[C@H]2[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000925723948 711727125 /nfs/dbraw/zinc/72/71/25/711727125.db2.gz FQVDVSMJRHRJCV-VXGBXAGGSA-N 2 0 220.360 2.193 20 0 BEADRP CC[C@@H]1C[C@@H](C)C[N@@H+]1CCC[NH2+]C1CC1 ZINC000399137194 711744334 /nfs/dbraw/zinc/74/43/34/711744334.db2.gz XPEFBDVWXYJPFC-DGCLKSJQSA-N 2 0 210.365 2.249 20 0 BEADRP [NH3+]C1(CNCc2ccc3ccccc3c2)CC1 ZINC000258967099 711745807 /nfs/dbraw/zinc/74/58/07/711745807.db2.gz BGGITGDLJRFHJN-UHFFFAOYSA-N 2 0 226.323 2.421 20 0 BEADRP CN(Cc1ccc2c(c1)CCCO2)CC(C)(C)[NH3+] ZINC000258967232 711745814 /nfs/dbraw/zinc/74/58/14/711745814.db2.gz YOBIKBCJALIKSV-UHFFFAOYSA-N 2 0 248.370 2.181 20 0 BEADRP CC(C)[C@H]1CCCC[C@H]1[NH2+][C@@H]1C[NH2+]C[C@H]1C ZINC000925781146 711748203 /nfs/dbraw/zinc/74/82/03/711748203.db2.gz DCBDVVNHPUTGNE-AAVRWANBSA-N 2 0 224.392 2.399 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H](c2ccccn2)C2CC2)C1 ZINC000925821465 711756282 /nfs/dbraw/zinc/75/62/82/711756282.db2.gz JGYRCOZNAFYDMZ-VNHYZAJKSA-N 2 0 245.370 2.392 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]C2CC(SC)C2)[C@@H](C)C1 ZINC000925170343 711786473 /nfs/dbraw/zinc/78/64/73/711786473.db2.gz MPAZCTVLTBBWCJ-YWPUVAFDSA-N 2 0 242.432 2.200 20 0 BEADRP CCCCOCCC[NH2+]CC1CC[NH+](C)CC1 ZINC000160250494 711806239 /nfs/dbraw/zinc/80/62/39/711806239.db2.gz YNIQEYIPCVSTET-UHFFFAOYSA-N 2 0 242.407 2.125 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+]C1C[C@@H](C)C[C@H](C)C1 ZINC000721903357 711813336 /nfs/dbraw/zinc/81/33/36/711813336.db2.gz ICJJBQHLXTUZHK-MEWQQHAOSA-N 2 0 210.365 2.009 20 0 BEADRP COC[C@@H](C[N@H+](C)CC[C@@H]([NH3+])C(C)C)C(C)C ZINC000721959949 711948464 /nfs/dbraw/zinc/94/84/64/711948464.db2.gz IVTUIRIOILTHJF-ZIAGYGMSSA-N 2 0 244.423 2.210 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000423373357 711957779 /nfs/dbraw/zinc/95/77/79/711957779.db2.gz RXTIOIBODATGPW-NDBYEHHHSA-N 2 0 210.365 2.281 20 0 BEADRP C[C@H](C[N@@H+]1CCCO[C@H](C[NH3+])C1)CC(C)(C)C ZINC000709179887 711978043 /nfs/dbraw/zinc/97/80/43/711978043.db2.gz VCHZTLBBVNVQNA-QWHCGFSZSA-N 2 0 242.407 2.108 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+]C[C@H]1CCCC[N@H+](C)C1 ZINC000700799736 712005773 /nfs/dbraw/zinc/00/57/73/712005773.db2.gz LLUCWCFAKHKZPA-UPJWGTAASA-N 2 0 210.365 2.106 20 0 BEADRP CCSC1(C[NH2+][C@H]2CCCN[C@H]2C)CC1 ZINC000700796465 712005985 /nfs/dbraw/zinc/00/59/85/712005985.db2.gz WVDBGVFJOXGJQX-QWRGUYRKSA-N 2 0 228.405 2.002 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@]2(C)CC2(C)C)CC[N@@H+]1C ZINC000701980773 712034301 /nfs/dbraw/zinc/03/43/01/712034301.db2.gz JZWZZYPDMXUBJA-BZPMIXESSA-N 2 0 224.392 2.495 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@]2(C)CC2(C)C)CC1 ZINC000701982473 712034827 /nfs/dbraw/zinc/03/48/27/712034827.db2.gz RFSOOFNWJINESX-AWEZNQCLSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@]12C[NH2+]C[C@H]1C[N@H+](CC1CCCCC1)C2 ZINC000702048612 712037283 /nfs/dbraw/zinc/03/72/83/712037283.db2.gz KLNBRFYFRSPVIK-UONOGXRCSA-N 2 0 222.376 2.108 20 0 BEADRP C[C@@H]1CCCC[N@H+](C[C@@H]2CC[C@H]([NH3+])C2)C1 ZINC000703201469 712067579 /nfs/dbraw/zinc/06/75/79/712067579.db2.gz IMMSKIBAOKVUFT-UPJWGTAASA-N 2 0 210.365 2.236 20 0 BEADRP Cc1ccc(C[N@@H+]2C[C@@H]3C[NH2+]C[C@]3(C)C2)c(C)c1 ZINC000703589372 712079657 /nfs/dbraw/zinc/07/96/57/712079657.db2.gz KYIWLIUBKLZHMJ-JKSUJKDBSA-N 2 0 244.382 2.345 20 0 BEADRP Cc1cccc(C[N@@H+]2C[C@@H]3C[NH2+]C[C@]3(C)C2)c1C ZINC000703589322 712079823 /nfs/dbraw/zinc/07/98/23/712079823.db2.gz JLLPGJZNBDQFSW-JKSUJKDBSA-N 2 0 244.382 2.345 20 0 BEADRP CC(C)C[C@@H]1CC[N@H+](C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000703614662 712081091 /nfs/dbraw/zinc/08/10/91/712081091.db2.gz CZJUEZCJNPMPLZ-RWMBFGLXSA-N 2 0 210.365 2.092 20 0 BEADRP COCCC1CC[NH+](CCCCCC[NH3+])CC1 ZINC000704178928 712099786 /nfs/dbraw/zinc/09/97/86/712099786.db2.gz NGQPTQPDYMFXRV-UHFFFAOYSA-N 2 0 242.407 2.254 20 0 BEADRP C[C@@H]1CC[C@H](C)[N@H+]1C[C@@H]1CCCC[NH2+]C1 ZINC000706428791 712146182 /nfs/dbraw/zinc/14/61/82/712146182.db2.gz AQLYKZISHOXWTA-FRRDWIJNSA-N 2 0 210.365 2.249 20 0 BEADRP CC[N@H+](C[C@@H]1CCCC[NH2+]C1)C1CCC1 ZINC000706816823 712156639 /nfs/dbraw/zinc/15/66/39/712156639.db2.gz HKCPHYICHHWDAU-GFCCVEGCSA-N 2 0 210.365 2.251 20 0 BEADRP CSC1CC([NH2+]CCC[NH+]2CCCCC2)C1 ZINC000706916722 712158156 /nfs/dbraw/zinc/15/81/56/712158156.db2.gz JPCUFYYDHPVNHI-UHFFFAOYSA-N 2 0 242.432 2.346 20 0 BEADRP CSC1CC([NH2+][C@@H]2CCN(C(C)(C)C)C2)C1 ZINC000706931823 712161930 /nfs/dbraw/zinc/16/19/30/712161930.db2.gz UBUKGMQJPBJFDX-VOMCLLRMSA-N 2 0 242.432 2.343 20 0 BEADRP CC(C)[C@H]1C[N@H+](CCCCCCC[NH3+])CCO1 ZINC000709019472 712206249 /nfs/dbraw/zinc/20/62/49/712206249.db2.gz MQJCIZOTSARXET-CQSZACIVSA-N 2 0 242.407 2.252 20 0 BEADRP C[C@@H]1[C@H]2CC[C@@H](C[C@H]1[NH2+][C@@H]1CCCSC1)[NH2+]2 ZINC000709284560 712219048 /nfs/dbraw/zinc/21/90/48/712219048.db2.gz NQPFJNVLCNOAQH-NZEXEKPDSA-N 2 0 240.416 2.001 20 0 BEADRP CS[C@H]1CC[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000709413485 712221437 /nfs/dbraw/zinc/22/14/37/712221437.db2.gz FQWNQOJGZIFCOP-WUUNYJKSSA-N 2 0 240.416 2.143 20 0 BEADRP [NH3+][C@@H]1C[C@H]2C[C@@H](C1)[N@H+](CCc1ccccc1)C2 ZINC000709835804 712229222 /nfs/dbraw/zinc/22/92/22/712229222.db2.gz LVORWJBLWHUUOT-ZNMIVQPWSA-N 2 0 230.355 2.041 20 0 BEADRP C(CC1CC1)C[N@@H+]1CC[C@]2(C1)CCC[NH2+]C2 ZINC000709848318 712229249 /nfs/dbraw/zinc/22/92/49/712229249.db2.gz GUVBKSGKYGRATG-CQSZACIVSA-N 2 0 222.376 2.252 20 0 BEADRP [NH3+][C@H]1C[C@H]2C[C@@H](C1)[N@H+](CCCC1CCC1)C2 ZINC000709871475 712230592 /nfs/dbraw/zinc/23/05/92/712230592.db2.gz NCSOHPNHDYUAMD-IHRRRGAJSA-N 2 0 222.376 2.378 20 0 BEADRP CC(C)=CCC[N@@H+]1CC[C@@]2(C1)CCC[NH2+]C2 ZINC000709922214 712233705 /nfs/dbraw/zinc/23/37/05/712233705.db2.gz YXYDQIAUGGXVQD-AWEZNQCLSA-N 2 0 222.376 2.418 20 0 BEADRP Cc1ccncc1C[N@H+](C)CCCCCC[NH3+] ZINC000710715152 712255744 /nfs/dbraw/zinc/25/57/44/712255744.db2.gz ZQTZAPVKSRCOLY-UHFFFAOYSA-N 2 0 235.375 2.341 20 0 BEADRP C[C@H]1CC[C@@H](C[N@H+](C)CCCCCC[NH3+])O1 ZINC000710749652 712256648 /nfs/dbraw/zinc/25/66/48/712256648.db2.gz IZTPWNCMKOAYQK-STQMWFEESA-N 2 0 228.380 2.005 20 0 BEADRP C[C@@H]1CCC[N@@H+]1Cc1cc2c(s1)CC[NH2+]C2 ZINC000710945047 712267105 /nfs/dbraw/zinc/26/71/05/712267105.db2.gz UWRHUJWSRSWKCQ-SNVBAGLBSA-N 2 0 236.384 2.378 20 0 BEADRP FC[C@@H]1CCC[N@H+](CC[C@H]2CCC[NH2+]C2)C1 ZINC000711444807 712300535 /nfs/dbraw/zinc/30/05/35/712300535.db2.gz RBAGMAGMPGNHIT-OLZOCXBDSA-N 2 0 228.355 2.058 20 0 BEADRP FC[C@H]1CC[N@H+](CCCC2CC[NH2+]CC2)C1 ZINC000711454914 712304333 /nfs/dbraw/zinc/30/43/33/712304333.db2.gz OSCAFIMHHZXQCK-CYBMUJFWSA-N 2 0 228.355 2.058 20 0 BEADRP FC[C@H]1CC[N@H+](CCC2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000711507111 712308225 /nfs/dbraw/zinc/30/82/25/712308225.db2.gz IHLARTCAIRHOIB-CPIKKWJDSA-N 2 0 240.366 2.199 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1C=CCC1)C1CC[NH+](C)CC1 ZINC000711725530 712322597 /nfs/dbraw/zinc/32/25/97/712322597.db2.gz AWOXHUWLBLFUKF-QWHCGFSZSA-N 2 0 222.376 2.273 20 0 BEADRP [NH3+]CC[C@@H]1CC[N@H+](CCCc2ccsc2)C1 ZINC000923479839 712334708 /nfs/dbraw/zinc/33/47/08/712334708.db2.gz DGNWBVRJDZWJCM-GFCCVEGCSA-N 2 0 238.400 2.351 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]1[NH2+]CC[C@@H]1C[C@H]1C1CC1 ZINC000712642612 712439147 /nfs/dbraw/zinc/43/91/47/712439147.db2.gz NDMSPCXXLAIFDJ-RDBSUJKOSA-N 2 0 236.403 2.400 20 0 BEADRP CC[NH+]1CCC([NH2+]CC[C@@H]2C[C@H]2C2CC2)CC1 ZINC000712646361 712439963 /nfs/dbraw/zinc/43/99/63/712439963.db2.gz UVKOUVRICUQEOO-HIFRSBDPSA-N 2 0 236.403 2.497 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]CC[C@@H]2C[C@H]2C2CC2)C1 ZINC000712747521 712448706 /nfs/dbraw/zinc/44/87/06/712448706.db2.gz CUDMOCQYPABHJG-SYQHCUMBSA-N 2 0 222.376 2.282 20 0 BEADRP CC1(C)[C@@H]([NH3+])C[C@@H]1[NH2+]CC[C@@H]1C[C@H]1C1CC1 ZINC000712751275 712449133 /nfs/dbraw/zinc/44/91/33/712449133.db2.gz RLGCJWRPCFXLEV-VOAKCMCISA-N 2 0 222.376 2.138 20 0 BEADRP C(C[C@@H]1C[C@H]1C1CC1)[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000712763803 712449159 /nfs/dbraw/zinc/44/91/59/712449159.db2.gz LBNAIDGTHYCZSR-QCODTGAPSA-N 2 0 248.414 2.400 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]CC[C@@H]2C[C@H]2C2CC2)C12CCC2 ZINC000712751228 712449502 /nfs/dbraw/zinc/44/95/02/712449502.db2.gz QYVANTNBBVZFFC-RFGFWPKPSA-N 2 0 234.387 2.282 20 0 BEADRP C=C/C=C\CC[N@@H+](C)CC[C@H]([NH3+])C(C)C ZINC000713736308 712470374 /nfs/dbraw/zinc/47/03/74/712470374.db2.gz TVYVSJCCSZIGSK-FWWRYZNZSA-N 2 0 210.365 2.424 20 0 BEADRP C=C/C=C/CC[N@H+]1CCCC[C@@H]1CC[NH3+] ZINC000713734691 712470396 /nfs/dbraw/zinc/47/03/96/712470396.db2.gz LGWNHINBKOSNGU-ITDFMYJTSA-N 2 0 208.349 2.322 20 0 BEADRP C=C/C=C\CC[NH+]1CCC(C[NH2+]C)CC1 ZINC000713735114 712470512 /nfs/dbraw/zinc/47/05/12/712470512.db2.gz MJCSCQAZRPJMOZ-PLNGDYQASA-N 2 0 208.349 2.050 20 0 BEADRP C=C/C=C\CC[N@H+]1CCC[C@@H](C[NH2+]C)C1 ZINC000713737166 712470784 /nfs/dbraw/zinc/47/07/84/712470784.db2.gz ZSNTWEOBNXZUKP-ZFDPJTLLSA-N 2 0 208.349 2.050 20 0 BEADRP C=C/C=C/CC[N@H+]1CC[C@H](C)[C@H](C[NH3+])C1 ZINC000713735225 712470820 /nfs/dbraw/zinc/47/08/20/712470820.db2.gz NIMNBNQVYKRJBF-QITAHTHBSA-N 2 0 208.349 2.035 20 0 BEADRP C=C/C=C\CC[N@@H+]1C[C@H](C(F)(F)F)[C@@H](C[NH3+])C1 ZINC000713757105 712471809 /nfs/dbraw/zinc/47/18/09/712471809.db2.gz FPZHTRUUYRGFLX-WZQADMAKSA-N 2 0 248.292 2.188 20 0 BEADRP CC1(C)CCC[C@H](C[N@@H+]2CCC[C@H](C[NH3+])C2)O1 ZINC000714373030 712484419 /nfs/dbraw/zinc/48/44/19/712484419.db2.gz BDIZJUPVVNTPEK-CHWSQXEVSA-N 2 0 240.391 2.005 20 0 BEADRP C[N@H+](C[C@H]1CCCC(C)(C)O1)C1CC[NH2+]CC1 ZINC000714374255 712484416 /nfs/dbraw/zinc/48/44/16/712484416.db2.gz HMRRHXYLSGQGMW-CYBMUJFWSA-N 2 0 240.391 2.018 20 0 BEADRP CC[C@@H]1C[N@H+](CC[C@@H]2C[C@H]2C2CC2)CC[C@@H]1[NH3+] ZINC000714813020 712498345 /nfs/dbraw/zinc/49/83/45/712498345.db2.gz RZKKEVAVSHJDMS-RZFFKMDDSA-N 2 0 236.403 2.482 20 0 BEADRP C(C[N@@H+]1[C@@H]2CC[C@H]1C[NH2+]CC2)[C@@H]1C[C@H]1C1CC1 ZINC000714800099 712498368 /nfs/dbraw/zinc/49/83/68/712498368.db2.gz KOGIXAAFAGOMIN-KBXIAJHMSA-N 2 0 234.387 2.249 20 0 BEADRP C[C@H]1CC[N@H+](CC[C@@H]2C[C@H]2C2CC2)C[C@@H]1C[NH3+] ZINC000714918428 712499885 /nfs/dbraw/zinc/49/98/85/712499885.db2.gz CSIHCHRKEMKQOI-ATGSNQNLSA-N 2 0 236.403 2.339 20 0 BEADRP C[C@@H]([NH3+])[C@@H]1CCC[N@H+](CC[C@@H]2C[C@H]2C2CC2)C1 ZINC000714835775 712501305 /nfs/dbraw/zinc/50/13/05/712501305.db2.gz YYAJOPGHISXIEK-NGFQHRJXSA-N 2 0 236.403 2.482 20 0 BEADRP C[NH+](C)C1(C)CCC([NH2+][C@@H]2CCSC2)CC1 ZINC000715490386 712522667 /nfs/dbraw/zinc/52/26/67/712522667.db2.gz JNPSBZIZARYERE-OTTFEQOBSA-N 2 0 242.432 2.344 20 0 BEADRP C[C@H]1C[C@H]1C[NH2+]C1CCC(C)([NH+](C)C)CC1 ZINC000715491932 712522874 /nfs/dbraw/zinc/52/28/74/712522874.db2.gz RIBJFLZSAVSULW-FEPKRQSRSA-N 2 0 224.392 2.495 20 0 BEADRP CCOC[C@H](C)[NH2+]C1CCC(C)([NH+](C)C)CC1 ZINC000715506507 712524123 /nfs/dbraw/zinc/52/41/23/712524123.db2.gz AKKMYTPHGYHDNH-HSBZDZAISA-N 2 0 242.407 2.264 20 0 BEADRP Cn1ccc(C[NH2+]C2CCC(C)([NH+](C)C)CC2)c1 ZINC000715509568 712524259 /nfs/dbraw/zinc/52/42/59/712524259.db2.gz NBCXKDKAFXMYKU-UHFFFAOYSA-N 2 0 249.402 2.378 20 0 BEADRP C[NH+](C)C1(C)CCC([NH2+][C@@H]2CCCOC2)CC1 ZINC000715512669 712524278 /nfs/dbraw/zinc/52/42/78/712524278.db2.gz ONOOFWYVCAYUSA-ROKHWSDSSA-N 2 0 240.391 2.018 20 0 BEADRP CCCC[NH+]1CCC([NH2+]CC2CC2)CC1 ZINC000037150501 712547863 /nfs/dbraw/zinc/54/78/63/712547863.db2.gz KBVPVVWARZVWRF-UHFFFAOYSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C[NH2+]CC1CC[NH+](C)CC1 ZINC000716580239 712564088 /nfs/dbraw/zinc/56/40/88/712564088.db2.gz GHQBPYHCQFGLOE-REBRKWNGSA-N 2 0 236.403 2.210 20 0 BEADRP C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000716585102 712564535 /nfs/dbraw/zinc/56/45/35/712564535.db2.gz RHPSWZASMPNWOJ-LWGJEFJTSA-N 2 0 236.403 2.351 20 0 BEADRP C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000716546524 712567658 /nfs/dbraw/zinc/56/76/58/712567658.db2.gz PTMZAUSDWZPSMY-NKTODWNOSA-N 2 0 222.376 2.138 20 0 BEADRP C[C@@H]1C[C@@H]1[C@H]1C[C@@H]1C[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000716648568 712568466 /nfs/dbraw/zinc/56/84/66/712568466.db2.gz DZEWDZFVIMTNBB-STDWZQKUSA-N 2 0 234.387 2.151 20 0 BEADRP C(C[C@@H]1CC[C@@H]2C[C@@H]21)[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000717027455 712609421 /nfs/dbraw/zinc/60/94/21/712609421.db2.gz NPNQBIDAHMDJEG-VNAATALASA-N 2 0 248.414 2.400 20 0 BEADRP C[NH+](C)CCCC[NH2+]CC1(C)CCCC1 ZINC000379999540 712651736 /nfs/dbraw/zinc/65/17/36/712651736.db2.gz JOZLAUHMDDTUTF-UHFFFAOYSA-N 2 0 212.381 2.498 20 0 BEADRP CC(C)C[C@H]1CC[N@H+](C[C@@H]2CC[C@H]([NH3+])C2)C1 ZINC000717963209 712736093 /nfs/dbraw/zinc/73/60/93/712736093.db2.gz SUQVWHLKUYOVHV-MCIONIFRSA-N 2 0 224.392 2.482 20 0 BEADRP CC[NH+]1CCC(C[NH2+]Cc2cc(C)co2)CC1 ZINC000718026374 712736401 /nfs/dbraw/zinc/73/64/01/712736401.db2.gz OLYJHISIVXGWFX-UHFFFAOYSA-N 2 0 236.359 2.410 20 0 BEADRP CC(F)(F)CCC[N@@H+]1CCC[C@H](CC[NH3+])C1 ZINC000718568315 712774459 /nfs/dbraw/zinc/77/44/59/712774459.db2.gz ATBKWNAMVPEMSP-LLVKDONJSA-N 2 0 234.334 2.483 20 0 BEADRP c1ccc2c(c1)CCC[C@@H]2[NH2+]C1CC[NH2+]CC1 ZINC000038040693 712801182 /nfs/dbraw/zinc/80/11/82/712801182.db2.gz SLMOEIHSDMSXIJ-HNNXBMFYSA-N 2 0 230.355 2.406 20 0 BEADRP CC[C@H]1CCCC[C@@H]1[NH2+]C1CC[NH2+]CC1 ZINC000038041117 712801419 /nfs/dbraw/zinc/80/14/19/712801419.db2.gz VANCXQXZPWKDJR-AAEUAGOBSA-N 2 0 210.365 2.297 20 0 BEADRP CSCC1CC[NH+](CC[C@H]2CC[NH2+]C2)CC1 ZINC000719298159 712803957 /nfs/dbraw/zinc/80/39/57/712803957.db2.gz GZLLIQBJOLGRBE-GFCCVEGCSA-N 2 0 242.432 2.061 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+][C@H]1C[NH2+]CC1(C)C ZINC000720775852 712864608 /nfs/dbraw/zinc/86/46/08/712864608.db2.gz ALRRFOZDAJYPEO-WOPDTQHZSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1CCC[C@@H](C[N@@H+]2C[C@@H]3C[NH2+]C[C@]3(C)C2)C1 ZINC000720795158 712865720 /nfs/dbraw/zinc/86/57/20/712865720.db2.gz MVRIKWFWDWIGGG-APIJFGDWSA-N 2 0 236.403 2.354 20 0 BEADRP CCO[C@@H]1CCC[C@@H]([NH2+]CCCC[NH+](C)C)C1 ZINC000721170041 712894663 /nfs/dbraw/zinc/89/46/63/712894663.db2.gz XFWRHAJYMVLNML-ZIAGYGMSSA-N 2 0 242.407 2.266 20 0 BEADRP COc1ccc(NC(=[NH2+])SCC[NH3+])c(C)c1 ZINC001167912358 956876055 /nfs/dbraw/zinc/87/60/55/956876055.db2.gz CQTORFOQJXKDIS-UHFFFAOYSA-N 2 0 239.344 2.042 20 0 BEADRP C[C@@H]1CCCC[N@H+](C[C@@H]2CCC[NH+](C)C2)C1 ZINC001208607296 957092160 /nfs/dbraw/zinc/09/21/60/957092160.db2.gz LHZBQFMSYMRETG-ZIAGYGMSSA-N 2 0 224.392 2.450 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH+]2CC[C@]3(CC3(F)F)C2)C1 ZINC001208608036 957094117 /nfs/dbraw/zinc/09/41/17/957094117.db2.gz FFWLNUVBWLTUMV-RYUDHWBXSA-N 2 0 244.329 2.059 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)CN1c1cc2[nH]ccc2c[nH+]1 ZINC001164633106 719162375 /nfs/dbraw/zinc/16/23/75/719162375.db2.gz GQCPUZRVXALSJZ-GHMZBOCLSA-N 2 0 244.342 2.092 20 0 BEADRP C[NH+](C)[C@H]1CCCN(c2cc3[nH]ccc3c[nH+]2)C1 ZINC001165034497 721887123 /nfs/dbraw/zinc/88/71/23/721887123.db2.gz GOMWHMRSWFCTMA-LBPRGKRZSA-N 2 0 244.342 2.093 20 0 BEADRP Cc1ccc(CC[NH2+]CC2CC[NH+](C)CC2)o1 ZINC000689845598 959306155 /nfs/dbraw/zinc/30/61/55/959306155.db2.gz PEVRFPWQOXPMQH-UHFFFAOYSA-N 2 0 236.359 2.062 20 0 BEADRP CC[C@H]1CC[C@H]([NH+]2CCC(C)([NH3+])CC2)C1 ZINC000309517384 959899128 /nfs/dbraw/zinc/89/91/28/959899128.db2.gz ZAMQIZUWKCYYKI-RYUDHWBXSA-N 2 0 210.365 2.378 20 0 BEADRP N=C(Nc1ccc2ccoc2c1)SCC[NH3+] ZINC001167914746 961827201 /nfs/dbraw/zinc/82/72/01/961827201.db2.gz PHWOGCCGKUATOS-UHFFFAOYSA-N 2 0 235.312 2.471 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CCCCCCC[NH3+])CCO1 ZINC001168086373 963655715 /nfs/dbraw/zinc/65/57/15/963655715.db2.gz FKANKVNNUOTNMX-QWHCGFSZSA-N 2 0 228.380 2.053 20 0 BEADRP F[C@H]1C[C@H](C[NH2+]C2CC[NH+](CC3CC3)CC2)C1 ZINC001168358300 964530534 /nfs/dbraw/zinc/53/05/34/964530534.db2.gz QJXZVBJCDCDZTC-JOCQHMNTSA-N 2 0 240.366 2.199 20 0 BEADRP CC(C)C[C@H](C)[NH2+]CC[C@H](C)[NH+](C)C ZINC000697869429 964594283 /nfs/dbraw/zinc/59/42/83/964594283.db2.gz GXOSROIGSOJFEE-RYUDHWBXSA-N 2 0 200.370 2.351 20 0 BEADRP C[C@H](CC[NH2+][C@H]1CCC[C@@H](C)C1)[NH+](C)C ZINC000697878758 964605125 /nfs/dbraw/zinc/60/51/25/964605125.db2.gz LMQCEVGFNWGBSM-UPJWGTAASA-N 2 0 212.381 2.495 20 0 BEADRP CC(C)[N@H+](C)C1CC[NH+](CC2CC2)CC1 ZINC001168370971 964934326 /nfs/dbraw/zinc/93/43/26/964934326.db2.gz JERHWEPPDBVGEZ-UHFFFAOYSA-N 2 0 210.365 2.201 20 0 BEADRP Cc1ncc(C[NH2+]CCCCCC[NH3+])s1 ZINC000049538865 1165742482 /nfs/dbraw/zinc/74/24/82/1165742482.db2.gz NQAXTORYGPTJIH-UHFFFAOYSA-N 2 0 227.377 2.060 20 0 BEADRP C[NH+]1CC2(C1)CC[NH+](Cc1cccs1)CC2 ZINC001204018747 966853823 /nfs/dbraw/zinc/85/38/23/966853823.db2.gz RTLIXZQORPHCMD-UHFFFAOYSA-N 2 0 236.384 2.276 20 0 BEADRP CCC(=O)C(C)(C)C[N@@H+]1CCC[C@](C)([NH3+])CC1 ZINC001205256828 967443037 /nfs/dbraw/zinc/44/30/37/967443037.db2.gz QMTRJWYXBMMASJ-AWEZNQCLSA-N 2 0 240.391 2.195 20 0 BEADRP CC(C)CC[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000336675166 1165864627 /nfs/dbraw/zinc/86/46/27/1165864627.db2.gz PIIQNYLIWAMXEX-UHFFFAOYSA-N 2 0 224.392 2.497 20 0 BEADRP CC[NH+](CC)C[C@@H](C)OCC[NH+]1CCCCC1 ZINC001206700834 968437766 /nfs/dbraw/zinc/43/77/66/968437766.db2.gz HHHKZPXXMZQLKK-CQSZACIVSA-N 2 0 242.407 2.219 20 0 BEADRP C[C@H]1CCC[C@@H]([NH2+][C@@H]2CCC[C@H]([NH3+])C2)C1 ZINC000086402699 1166007089 /nfs/dbraw/zinc/00/70/89/1166007089.db2.gz BWEDVWQSUBGHHW-WUHRBBMRSA-N 2 0 210.365 2.425 20 0 BEADRP [NH3+]C1(c2ccc(C3=CCC[NH2+]C3)cc2)CC1 ZINC001240664917 968629293 /nfs/dbraw/zinc/62/92/93/968629293.db2.gz QKPOCIRSRQDOJA-UHFFFAOYSA-N 2 0 214.312 2.011 20 0 BEADRP [NH3+]CCCC[N@@H+]1CCc2ccc(Cl)cc2C1 ZINC000082790927 1166080323 /nfs/dbraw/zinc/08/03/23/1166080323.db2.gz NCJJYMLSVRAJJR-UHFFFAOYSA-N 2 0 238.762 2.437 20 0 BEADRP C[C@H]1C[N@H+](CC(C)(C)C[NH+](C)C)C2(CC2)C1 ZINC001207288286 968718224 /nfs/dbraw/zinc/71/82/24/968718224.db2.gz MXLHNWUUZHPEEF-GFCCVEGCSA-N 2 0 224.392 2.449 20 0 BEADRP C1C[C@@H]2[C@@H](C1)CCC[N@H+]2[C@@H]1CCC[NH2+]C1 ZINC000083701103 1166115225 /nfs/dbraw/zinc/11/52/25/1166115225.db2.gz DBLMOVNQZLUWJV-YNEHKIRRSA-N 2 0 208.349 2.003 20 0 BEADRP Cc1cc(C)nc(C[N@H+]2CC[C@H](C)[C@@H](C[NH3+])C2)c1 ZINC000723877360 1166146133 /nfs/dbraw/zinc/14/61/33/1166146133.db2.gz TXKJBHIIYJTLGV-JSGCOSHPSA-N 2 0 247.386 2.115 20 0 BEADRP CC[C@@]1(C[NH2+][C@@H]2CC[C@H](C)C2)CCC[NH2+]1 ZINC000129396308 1166182853 /nfs/dbraw/zinc/18/28/53/1166182853.db2.gz GJZNXGNGASXMAK-XQQFMLRXSA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@H](C)[C@H](C)[N@@H+]1CC[C@@H](C)[C@H](C[NH3+])C1 ZINC000253196561 1166230064 /nfs/dbraw/zinc/23/00/64/1166230064.db2.gz SWOANKSCHUHPSS-QNWHQSFQSA-N 2 0 212.381 2.338 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2CCC3(CC3)C2)CC1 ZINC001208592435 969147655 /nfs/dbraw/zinc/14/76/55/969147655.db2.gz HSWUPGXFHDGVHO-UHFFFAOYSA-N 2 0 222.376 2.204 20 0 BEADRP CC[N@H+](CC1CC[NH+](CC)CC1)C1CC1 ZINC001208596018 969150748 /nfs/dbraw/zinc/15/07/48/969150748.db2.gz ZITUXJIADVOROM-UHFFFAOYSA-N 2 0 210.365 2.203 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2CCC[C@@H](C)C2)CC1 ZINC001208595503 969150785 /nfs/dbraw/zinc/15/07/85/969150785.db2.gz UWZYUOWSPKPYGF-CYBMUJFWSA-N 2 0 224.392 2.450 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH+]2CCC[C@H](F)CC2)C1 ZINC001208608849 969163183 /nfs/dbraw/zinc/16/31/83/969163183.db2.gz XCVFBYCEANEECL-STQMWFEESA-N 2 0 228.355 2.152 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH+]2CC[C@](C)(CF)C2)C1 ZINC001208607257 969166557 /nfs/dbraw/zinc/16/65/57/969166557.db2.gz KXMLWNWMGAYRBL-CHWSQXEVSA-N 2 0 228.355 2.010 20 0 BEADRP CC[N@H+](C)C1CC[NH+](CCC2CC2)CC1 ZINC001208687284 969196053 /nfs/dbraw/zinc/19/60/53/969196053.db2.gz SBBUTCXKCCQUSD-UHFFFAOYSA-N 2 0 210.365 2.203 20 0 BEADRP [NH3+]C[C@@H]1CC[N@@H+]([C@H]2CCc3c2cccc3F)C1 ZINC000250219185 1166304824 /nfs/dbraw/zinc/30/48/24/1166304824.db2.gz RCZIRNLHDVEKAT-HZMBPMFUSA-N 2 0 234.318 2.094 20 0 BEADRP CC(C)(C)C[NH+]1CCN(c2cc[nH+]cc2)CC1 ZINC000120862276 1166317281 /nfs/dbraw/zinc/31/72/81/1166317281.db2.gz MZJKOSMGFXMZAH-UHFFFAOYSA-N 2 0 233.359 2.250 20 0 BEADRP C[C@H]1C[C@H]([N@@H+]2C[C@H]3CCC[NH2+][C@H]3C2)C[C@@H](C)C1 ZINC000299921310 1166333088 /nfs/dbraw/zinc/33/30/88/1166333088.db2.gz PTIXQQFTQWEXDV-SEBNEYGDSA-N 2 0 236.403 2.495 20 0 BEADRP CC(C)OCCC[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169098409 969388729 /nfs/dbraw/zinc/38/87/29/969388729.db2.gz HPIIGXYXKKDYJQ-BTTYYORXSA-N 2 0 240.391 2.016 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]CC1(C)CCC1)C2 ZINC001169091846 969410276 /nfs/dbraw/zinc/41/02/76/969410276.db2.gz WDPWZMMFRQNXNS-CLLJXQQHSA-N 2 0 222.376 2.391 20 0 BEADRP C[C@]1(C[N@@H+]2CC[C@H]3CCCC[C@H]3C2)CC[NH2+]C1 ZINC000250793549 1166430001 /nfs/dbraw/zinc/43/00/01/1166430001.db2.gz KRKXMBZXTGFWRU-ILXRZTDVSA-N 2 0 236.403 2.498 20 0 BEADRP C[C@H]([NH3+])c1ccc(O[C@@H]2CCCC[NH2+]C2)cc1 ZINC001217972959 1166503293 /nfs/dbraw/zinc/50/32/93/1166503293.db2.gz RVPHFMRWGLQYHO-SMDDNHRTSA-N 2 0 234.343 2.227 20 0 BEADRP C[N@H+](CCC1CC1)[C@H]1CCC[NH+](C)CC1 ZINC001254530569 969729806 /nfs/dbraw/zinc/72/98/06/969729806.db2.gz YSAYPVWCOHNUFA-ZDUSSCGKSA-N 2 0 210.365 2.203 20 0 BEADRP C(=C\C1CC1)\C[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000378861344 1166563555 /nfs/dbraw/zinc/56/35/55/1166563555.db2.gz QVVGXEKHXSEPPN-DJQANFQHSA-N 2 0 220.360 2.169 20 0 BEADRP C[C@@H]1C[C@@H]([N@H+](C)CC2CC(F)(F)C2)CC[NH2+]1 ZINC000394748724 1166614086 /nfs/dbraw/zinc/61/40/86/1166614086.db2.gz ZMYXJFDBTQJAJP-KOLCDFICSA-N 2 0 232.318 2.104 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@H](C)C1(Cl)CC1 ZINC000695665889 1166663455 /nfs/dbraw/zinc/66/34/55/1166663455.db2.gz FFLQEXAOHNDWED-NXEZZACHSA-N 2 0 218.772 2.076 20 0 BEADRP C[C@H]1CC[C@H]([N@H+](C)C2CCN(C)CC2)C1 ZINC001170124227 970369717 /nfs/dbraw/zinc/36/97/17/970369717.db2.gz FVPPQXYIYHLJOA-AAEUAGOBSA-N 2 0 210.365 2.201 20 0 BEADRP CC[C@@H]1CCC[N@@H+]([C@H]2CC[NH2+][C@H](C)C2)C1 ZINC000252968676 1166774097 /nfs/dbraw/zinc/77/40/97/1166774097.db2.gz YSHLPAJQSFDQCS-UPJWGTAASA-N 2 0 210.365 2.249 20 0 BEADRP CC[NH+](CC)CC[C@H](C)n1ccc([C@H](C)[NH3+])n1 ZINC001255947891 970564559 /nfs/dbraw/zinc/56/45/59/970564559.db2.gz YMRWSRDRONMRPH-RYUDHWBXSA-N 2 0 238.379 2.196 20 0 BEADRP CCOCCC[NH2+][C@H](C)CC[NH+](CC)CC ZINC001255939842 970572465 /nfs/dbraw/zinc/57/24/65/970572465.db2.gz KTLQMIMYDOFQJE-CYBMUJFWSA-N 2 0 230.396 2.123 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]C(C)(C)COC ZINC001255944114 970579068 /nfs/dbraw/zinc/57/90/68/970579068.db2.gz RJAFVYLNXOOUMU-GFCCVEGCSA-N 2 0 230.396 2.121 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+][C@H]1CC1(C)C ZINC001255948177 970582337 /nfs/dbraw/zinc/58/23/37/970582337.db2.gz GRJUMIRHSWVGTJ-NEPJUHHUSA-N 2 0 212.381 2.495 20 0 BEADRP CCC[N@H+](C)[C@@H](C)CC[NH+](CC)CC ZINC001255955461 970587407 /nfs/dbraw/zinc/58/74/07/970587407.db2.gz UMHBMVILJJPYNZ-LBPRGKRZSA-N 2 0 200.370 2.449 20 0 BEADRP CCC[C@@H](CCO)[NH2+][C@H](C)CC[NH+](CC)CC ZINC001255953192 970590009 /nfs/dbraw/zinc/59/00/09/970590009.db2.gz YMVPOHCNYVIYSP-KGLIPLIRSA-N 2 0 244.423 2.248 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]C(C)(C)C(C)(C)O ZINC001255953892 970591345 /nfs/dbraw/zinc/59/13/45/970591345.db2.gz QMYWMRCJIPSQGE-GFCCVEGCSA-N 2 0 244.423 2.246 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]Cc1ccc2c(c1)C[C@H](C)O2 ZINC000925829548 1166879286 /nfs/dbraw/zinc/87/92/86/1166879286.db2.gz CKSVZUYSRFPBBL-TUAOUCFPSA-N 2 0 248.370 2.225 20 0 BEADRP Cc1csc(C[NH+]2CCC(C[NH3+])CC2)c1 ZINC000238498767 1166888765 /nfs/dbraw/zinc/88/87/65/1166888765.db2.gz NHUNTEXUTWMZIY-UHFFFAOYSA-N 2 0 224.373 2.227 20 0 BEADRP C[NH+]1CCC([N@@H+]2CC[C@@H]3CCC[C@@H]3C2)CC1 ZINC001256205056 970700147 /nfs/dbraw/zinc/70/01/47/970700147.db2.gz VKGULSPKSARELR-QWHCGFSZSA-N 2 0 222.376 2.203 20 0 BEADRP C[C@@H]1C[C@@H](C)CC[N@H+]1C1CCN(C)CC1 ZINC001256207263 970713707 /nfs/dbraw/zinc/71/37/07/970713707.db2.gz FNLVBRDAKALFDE-NWDGAFQWSA-N 2 0 210.365 2.201 20 0 BEADRP C[C@@H]1CC[C@H]([NH+]2CCC(C[NH3+])CC2)C[C@H]1C ZINC000251634188 1166954265 /nfs/dbraw/zinc/95/42/65/1166954265.db2.gz DWJSHRFMKXXRCY-BZPMIXESSA-N 2 0 224.392 2.482 20 0 BEADRP CC[NH+](CC)C1CCC([N@H+](C)CCOC)CC1 ZINC001173108418 975024120 /nfs/dbraw/zinc/02/41/20/975024120.db2.gz JWIGMSUCJYWLME-UHFFFAOYSA-N 2 0 242.407 2.218 20 0 BEADRP C[N@H+](C1CC1)C1CC[NH+]([C@@H]2C[C@H]3C[C@H]3C2)CC1 ZINC001167956817 1167018574 /nfs/dbraw/zinc/01/85/74/1167018574.db2.gz UPCOIZNDHZWMHK-JJLQDPRZSA-N 2 0 234.387 2.344 20 0 BEADRP CCSC[C@H](C)[N@@H+]1C[C@H]2CC[NH+](C)C[C@H]2C1 ZINC001173302522 975203889 /nfs/dbraw/zinc/20/38/89/975203889.db2.gz SPVKOJDMMAJKLF-XQQFMLRXSA-N 2 0 242.432 2.012 20 0 BEADRP [NH3+]CCCO[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000211333626 1167067073 /nfs/dbraw/zinc/06/70/73/1167067073.db2.gz LJGCIXLPUZYBJN-HNNXBMFYSA-N 2 0 248.370 2.016 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2C[C@@H]3CC[C@H]([NH3+])[C@@H]3C2)C[C@@H]1C ZINC000310463323 1167157112 /nfs/dbraw/zinc/15/71/12/1167157112.db2.gz YNNCZNPMVCRISH-DBWOOVFOSA-N 2 0 236.403 2.480 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[C@@H]([NH3+])C1)c1nccs1 ZINC000227114913 1167158963 /nfs/dbraw/zinc/15/89/63/1167158963.db2.gz HXQWISHEQFXPIS-HBNTYKKESA-N 2 0 239.388 2.311 20 0 BEADRP C[C@@H]1[C@H]([NH3+])CC[N@@H+]1C1CCC(C)(C)CC1 ZINC000308855081 1167208052 /nfs/dbraw/zinc/20/80/52/1167208052.db2.gz SRSQMWVBWWBHAH-ZYHUDNBSSA-N 2 0 210.365 2.377 20 0 BEADRP C[C@@H](CC(F)(F)F)[NH2+]CCCC[NH+](C)C ZINC000308893814 1167215909 /nfs/dbraw/zinc/21/59/09/1167215909.db2.gz YSYZATYEOVWBRF-VIFPVBQESA-N 2 0 226.286 2.259 20 0 BEADRP CC[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)[C@H]2CC2(F)F)C1 ZINC001333338325 975678534 /nfs/dbraw/zinc/67/85/34/975678534.db2.gz OHEPKJYQWQFTHC-QJPTWQEYSA-N 2 0 246.345 2.352 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+][C@H]1CCSC1 ZINC000309044781 1167244785 /nfs/dbraw/zinc/24/47/85/1167244785.db2.gz NSHHPLAJFGSSND-RYUDHWBXSA-N 2 0 230.421 2.202 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H](C)Cc1cccc(Cl)c1 ZINC000309322876 1167290769 /nfs/dbraw/zinc/29/07/69/1167290769.db2.gz HKZYHKIQAJSOCM-MNOVXSKESA-N 2 0 240.778 2.455 20 0 BEADRP C[C@@H]1C[C@H](C)C[N@H+](C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000309348288 1167293684 /nfs/dbraw/zinc/29/36/84/1167293684.db2.gz MTYKLAZXLVDAAH-VEDUHTKKSA-N 2 0 222.376 2.247 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H]2C[C@@H]2C2CC2)CC1 ZINC000309589125 1167328564 /nfs/dbraw/zinc/32/85/64/1167328564.db2.gz UCWMHELTYIUDBT-KGLIPLIRSA-N 2 0 222.376 2.249 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H]2C[C@@H]2C2CC2)CC1 ZINC000309589128 1167328361 /nfs/dbraw/zinc/32/83/61/1167328361.db2.gz UCWMHELTYIUDBT-ZIAGYGMSSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@@H](CC[NH2+]C[C@@]1(C)CCCS1)[NH+](C)C ZINC000697886542 1167554220 /nfs/dbraw/zinc/55/42/20/1167554220.db2.gz IAPDAYUWPUOLLJ-NWDGAFQWSA-N 2 0 230.421 2.202 20 0 BEADRP C[C@H](C[NH3+])C[N@H+](C)C1C[C@H](C)C[C@@H](C)C1 ZINC000252098652 1167626368 /nfs/dbraw/zinc/62/63/68/1167626368.db2.gz ICDZGGUMPGGCAR-IJLUTSLNSA-N 2 0 212.381 2.338 20 0 BEADRP CCC[N@H+](C)C[C@H]1CCN(c2cc[nH+]cc2)C1 ZINC001120779003 1167699111 /nfs/dbraw/zinc/69/91/11/1167699111.db2.gz WTFYGLGUGDPGER-CYBMUJFWSA-N 2 0 233.359 2.250 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@@H+]([C@H]2C[C@H](C)C[C@H](C)C2)C1 ZINC000252125810 1167706071 /nfs/dbraw/zinc/70/60/71/1167706071.db2.gz LJFCAASBHKVCLA-RFQIPJPRSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H](Cc1cccc(F)c1)[NH2+][C@@H]1CCC[C@@H]1[NH3+] ZINC001168475858 1167766269 /nfs/dbraw/zinc/76/62/69/1167766269.db2.gz QLNBQXCZFCQVBR-LEWSCRJBSA-N 2 0 236.334 2.226 20 0 BEADRP Cc1cc(C)c(C[N@@H+]2CCC[C@@H]([NH3+])CC2)cn1 ZINC001205117682 1167771613 /nfs/dbraw/zinc/77/16/13/1167771613.db2.gz RPUXDLGYPMVLHZ-CQSZACIVSA-N 2 0 233.359 2.012 20 0 BEADRP CC(C)[C@@H](C[NH3+])C[N@@H+]1CCCCC[C@H]1C ZINC000252219485 1167774627 /nfs/dbraw/zinc/77/46/27/1167774627.db2.gz YQKXHYYFMKHFOQ-OLZOCXBDSA-N 2 0 212.381 2.482 20 0 BEADRP C[C@H]1C[C@H]([N@@H+]2C[C@H]3CC[NH2+]C[C@H]3C2)C[C@@H](C)C1 ZINC000310489187 1167784636 /nfs/dbraw/zinc/78/46/36/1167784636.db2.gz FNVFLWZCHCGECK-SEBNEYGDSA-N 2 0 236.403 2.352 20 0 BEADRP C1CC[C@@H]2C[N@@H+]([C@H]3CCC[NH2+]C3)CC[C@H]2C1 ZINC000252372284 1167826007 /nfs/dbraw/zinc/82/60/07/1167826007.db2.gz ICLNTGGGMVODTQ-MCIONIFRSA-N 2 0 222.376 2.251 20 0 BEADRP CCCCCC[N@H+]1C[C@@H]2CC[NH2+]CC[C@@H]2C1 ZINC001236314455 979523075 /nfs/dbraw/zinc/52/30/75/979523075.db2.gz NFQNPJAVBDCRAL-OKILXGFUSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCC[N@H+](C)CC1)c1cccnc1 ZINC000086817292 1168312639 /nfs/dbraw/zinc/31/26/39/1168312639.db2.gz CYDDIDRXYKEDOO-OCCSQVGLSA-N 2 0 233.359 2.217 20 0 BEADRP CCCCC[C@@H](C)[NH2+]C[C@H]1CC[N@H+](C)C1 ZINC000037484756 1168418715 /nfs/dbraw/zinc/41/87/15/1168418715.db2.gz LJHQVZKYEOBUPH-CHWSQXEVSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]C[C@@H]2CC[N@H+](C)C2)C1 ZINC000037484635 1168418204 /nfs/dbraw/zinc/41/82/04/1168418204.db2.gz BBTVVGXGKRDVLS-FRRDWIJNSA-N 2 0 210.365 2.106 20 0 BEADRP C[NH2+]CCN(c1[nH+]ccc2[nH]ccc21)C(C)(C)C ZINC001157825584 1168532479 /nfs/dbraw/zinc/53/24/79/1168532479.db2.gz LDAOGRLTARQEAH-UHFFFAOYSA-N 2 0 246.358 2.387 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@@H]1C[C@@H]2[C@H](C1)C2(C)C ZINC001170711209 1168579661 /nfs/dbraw/zinc/57/96/61/1168579661.db2.gz HYAQFXQYNFLAST-XYYAHUGASA-N 2 0 224.392 2.352 20 0 BEADRP [NH3+]C[C@]1(F)CCC[N@@H+](C2CCSCC2)CC1 ZINC000257924855 1168585885 /nfs/dbraw/zinc/58/58/85/1168585885.db2.gz BBMRRPPRMRYJCB-LBPRGKRZSA-N 2 0 246.395 2.035 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CCCC(F)F)[C@H]2CCC[C@H]21 ZINC001350635585 982039147 /nfs/dbraw/zinc/03/91/47/982039147.db2.gz DWOVKILKRADBJP-GRYCIOLGSA-N 2 0 246.345 2.494 20 0 BEADRP CC[NH+](CC)C1CC[NH+]([C@H](C)CCOC)CC1 ZINC000088510966 1168920947 /nfs/dbraw/zinc/92/09/47/1168920947.db2.gz JNOHAFMDEQANLM-CYBMUJFWSA-N 2 0 242.407 2.218 20 0 BEADRP c1csc(C[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)c1 ZINC000037408331 982943238 /nfs/dbraw/zinc/94/32/38/982943238.db2.gz VJDJVKPNJQLTSI-LLVKDONJSA-N 2 0 236.384 2.322 20 0 BEADRP CCC[C@@H](C)C[N@@H+]1C[C@H]2C[C@@]2(C[NH+](C)C)C1 ZINC001201553702 983310536 /nfs/dbraw/zinc/31/05/36/983310536.db2.gz OVTBOMXPRKHYNJ-MGPQQGTHSA-N 2 0 224.392 2.306 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH+]1CCC2(CCC[N@H+](C)C2)CC1 ZINC001276034164 1169064550 /nfs/dbraw/zinc/06/45/50/1169064550.db2.gz RFFDYTGSCGCPMB-ZIAGYGMSSA-N 2 0 236.403 2.450 20 0 BEADRP CC[NH+]1C[C@@H]2C[NH+](CC3CCCC3)C[C@H]2C1 ZINC001202190307 983594967 /nfs/dbraw/zinc/59/49/67/983594967.db2.gz NUDUMSVKVOOYBV-ZIAGYGMSSA-N 2 0 222.376 2.060 20 0 BEADRP C[NH+](C)CCC[N@H+](C)CCCC(F)(F)F ZINC001202368937 983641901 /nfs/dbraw/zinc/64/19/01/983641901.db2.gz YZQRIMQQSUHMKX-UHFFFAOYSA-N 2 0 226.286 2.212 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[N@@H+]1CCC[C@H](OC)C1 ZINC001255954438 1169272449 /nfs/dbraw/zinc/27/24/49/1169272449.db2.gz DOQOVZANTXYCGZ-KGLIPLIRSA-N 2 0 242.407 2.218 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@@H]([NH3+])[C@@H](F)CC2)s1 ZINC001206165322 974829675 /nfs/dbraw/zinc/82/96/75/974829675.db2.gz NISARWPKDXUQBF-NWDGAFQWSA-N 2 0 242.363 2.318 20 0 BEADRP CCOc1cc[nH+]c(N[C@@H]2CCC[C@@H]([NH3+])C2)c1 ZINC001154986618 1169417728 /nfs/dbraw/zinc/41/77/28/1169417728.db2.gz UGRIIGPRIALIMN-GHMZBOCLSA-N 2 0 235.331 2.162 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@H](C)c1ccccc1 ZINC001329024944 973409171 /nfs/dbraw/zinc/40/91/71/973409171.db2.gz WLLHOGFDGYJRAB-NWDGAFQWSA-N 2 0 206.333 2.335 20 0 BEADRP C[C@@H](Cc1ccccn1)[NH2+]CCCCC[NH+](C)C ZINC001256397045 970802556 /nfs/dbraw/zinc/80/25/56/970802556.db2.gz NXYRPXAILYZTCT-AWEZNQCLSA-N 2 0 249.402 2.334 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)[C@@H]1CCOC(C)(C)C1 ZINC000351918934 970822657 /nfs/dbraw/zinc/82/26/57/970822657.db2.gz LAKMYMSSPPIFHL-CYBMUJFWSA-N 2 0 242.407 2.218 20 0 BEADRP CC(C)(C)[NH+]1CCC([NH2+][C@@]2(C)CCOC2)CC1 ZINC001256566158 970863807 /nfs/dbraw/zinc/86/38/07/970863807.db2.gz IUQDEXLODTWERZ-AWEZNQCLSA-N 2 0 240.391 2.018 20 0 BEADRP CC[N@H+](CCOC)C1CC[NH+](C(C)(C)C)CC1 ZINC001256568763 970867938 /nfs/dbraw/zinc/86/79/38/970867938.db2.gz CQKKUKVSJQXVHC-UHFFFAOYSA-N 2 0 242.407 2.218 20 0 BEADRP CCCCC[N@@H+]1CCC(F)(F)[C@H](C[NH3+])C1 ZINC000403233199 970895871 /nfs/dbraw/zinc/89/58/71/970895871.db2.gz NHQXOBKTNCSHFD-SNVBAGLBSA-N 2 0 220.307 2.093 20 0 BEADRP CC[C@H](C)[NH2+]C1CCC([NH+]2CCOCC2)CC1 ZINC001256679051 970917545 /nfs/dbraw/zinc/91/75/45/970917545.db2.gz AIENKDXAUWTTET-HSBZDZAISA-N 2 0 240.391 2.018 20 0 BEADRP C[C@H](Cc1ccncc1)[NH2+][C@@H]1CCC[N@H+](C)CC1 ZINC001256721752 970940126 /nfs/dbraw/zinc/94/01/26/970940126.db2.gz UTTNUTXIDOGEHI-UKRRQHHQSA-N 2 0 247.386 2.087 20 0 BEADRP C[C@H](Cc1ccncc1)[NH2+]CC[C@@H]1CCC[N@@H+]1C ZINC001256722947 970944724 /nfs/dbraw/zinc/94/47/24/970944724.db2.gz LZGOOLKVGVOWEH-HIFRSBDPSA-N 2 0 247.386 2.087 20 0 BEADRP C[C@H](Cc1ccncc1)[N@H+](C)C1CCC([NH3+])CC1 ZINC001256723708 970944803 /nfs/dbraw/zinc/94/48/03/970944803.db2.gz ZRMWJBHRSDNBLW-LRVUVFPRSA-N 2 0 247.386 2.214 20 0 BEADRP COc1cc[nH+]c(NCC(C)(C)C[NH+](C)C)c1 ZINC001157940679 970961369 /nfs/dbraw/zinc/96/13/69/970961369.db2.gz VCJSRYVOGLRBQW-UHFFFAOYSA-N 2 0 237.347 2.090 20 0 BEADRP Cn1c[nH+]cc1Nc1cccc(C[NH+](C)C)c1F ZINC001216227775 970995268 /nfs/dbraw/zinc/99/52/68/970995268.db2.gz JVBLWGAMDKMLEQ-UHFFFAOYSA-N 2 0 248.305 2.364 20 0 BEADRP CC1C[NH+](C2CCN(c3cc[nH+]cc3)CC2)C1 ZINC001256855840 970996318 /nfs/dbraw/zinc/99/63/18/970996318.db2.gz YBAXIJAOOASWIJ-UHFFFAOYSA-N 2 0 231.343 2.002 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+]C1C[C@H]2CC[C@@H](C1)S2 ZINC000403650705 971006332 /nfs/dbraw/zinc/00/63/32/971006332.db2.gz UPHYIVYTKULVPU-WODVXLOZSA-N 2 0 242.432 2.343 20 0 BEADRP CCCC[C@H](C)[N@H+](C)CCC[NH+](C)C ZINC000352414551 971028082 /nfs/dbraw/zinc/02/80/82/971028082.db2.gz IIAZRYPPEZFFHT-LBPRGKRZSA-N 2 0 200.370 2.449 20 0 BEADRP C[C@H]([NH3+])c1ccccc1C1=C[NH2+]CCC1 ZINC001243953216 971049961 /nfs/dbraw/zinc/04/99/61/971049961.db2.gz YXXSVSYIIYFDPO-JTQLQIEISA-N 2 0 202.301 2.431 20 0 BEADRP c1cc(C2=C[NH2+]CCC2)ccc1O[C@H]1CC[NH2+]C1 ZINC001243952414 971050551 /nfs/dbraw/zinc/05/05/51/971050551.db2.gz OYEQLXYYNJNVDW-HNNXBMFYSA-N 2 0 244.338 2.152 20 0 BEADRP CNc1cc(Nc2c[nH+]ccc2N(C)C)cc[nH+]1 ZINC001216333026 971046872 /nfs/dbraw/zinc/04/68/72/971046872.db2.gz CCMZJKNTNOOWRW-UHFFFAOYSA-N 2 0 243.314 2.328 20 0 BEADRP CC(C)[N@H+](CCC[NH3+])C1C[C@H](C)O[C@@H](C)C1 ZINC001257073826 971088060 /nfs/dbraw/zinc/08/80/60/971088060.db2.gz WIZZKVSGXAHAQB-RYUDHWBXSA-N 2 0 228.380 2.002 20 0 BEADRP C[C@@H]1C[C@H]1C[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000166915479 1169521565 /nfs/dbraw/zinc/52/15/65/1169521565.db2.gz YNUBAZMRWJEOOP-YPMHNXCESA-N 2 0 222.376 2.106 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]C[C@@H]2CC(C)(C)O2)CC1 ZINC001257207779 971130035 /nfs/dbraw/zinc/13/00/35/971130035.db2.gz JFYXBIICVWOJMP-ZDUSSCGKSA-N 2 0 240.391 2.016 20 0 BEADRP CCC[C@H](CC)NC(=[NH2+])NCC[NH+](CC)CC ZINC001257252974 971149859 /nfs/dbraw/zinc/14/98/59/971149859.db2.gz JZKLZXQRRVYLBA-LBPRGKRZSA-N 2 0 242.411 2.021 20 0 BEADRP CCC[C@@H](CC)[NH+]1CCC([NH3+])(CCOC)CC1 ZINC001257252851 971150690 /nfs/dbraw/zinc/15/06/90/971150690.db2.gz IGWAYRDWWUGFMF-CYBMUJFWSA-N 2 0 242.407 2.395 20 0 BEADRP CCC[C@@H](CC)[N@H+](C)CCC[NH+](C)C ZINC001257257428 971154974 /nfs/dbraw/zinc/15/49/74/971154974.db2.gz QOEYLIJGZSIVGX-GFCCVEGCSA-N 2 0 200.370 2.449 20 0 BEADRP CCC(CC)[NH2+]CC12CC[NH+](CC1)CC2 ZINC001257290317 971175014 /nfs/dbraw/zinc/17/50/14/971175014.db2.gz SBBYBDJNKXJOCA-UHFFFAOYSA-N 2 0 210.365 2.251 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]C2CCCCC2)C12CCC2 ZINC000404751812 971179621 /nfs/dbraw/zinc/17/96/21/971179621.db2.gz JFFMDPVMCWVFQR-NEPJUHHUSA-N 2 0 208.349 2.179 20 0 BEADRP C[C@@H]1C[C@H](C[NH+]2CCC(F)(F)CC2)CC[NH2+]1 ZINC000405013334 971187324 /nfs/dbraw/zinc/18/73/24/971187324.db2.gz GHRFXDYGMWTHAK-GHMZBOCLSA-N 2 0 232.318 2.106 20 0 BEADRP C[C@@H]1C[C@@H](C[NH+]2CCC(F)(F)CC2)CC[NH2+]1 ZINC000405013366 971188787 /nfs/dbraw/zinc/18/87/87/971188787.db2.gz GHRFXDYGMWTHAK-MNOVXSKESA-N 2 0 232.318 2.106 20 0 BEADRP CCC(CC)[NH+]1CCC(C[NH+](C)C)CC1 ZINC001257300436 971188853 /nfs/dbraw/zinc/18/88/53/971188853.db2.gz VAWDISSJMONHNB-UHFFFAOYSA-N 2 0 212.381 2.449 20 0 BEADRP CCC[C@H](C)[NH2+]CCCCC[NH+](C)C ZINC001257306238 971196034 /nfs/dbraw/zinc/19/60/34/971196034.db2.gz OGUMUSVTKVBAIL-LBPRGKRZSA-N 2 0 200.370 2.497 20 0 BEADRP CC(C)CSCC[NH2+][C@H]1C[C@H]([NH3+])C12CCC2 ZINC000405209862 971206922 /nfs/dbraw/zinc/20/69/22/971206922.db2.gz CCOAXHPZXYYHES-RYUDHWBXSA-N 2 0 242.432 2.235 20 0 BEADRP CC(C)(C)SCC[NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405199782 971207151 /nfs/dbraw/zinc/20/71/51/971207151.db2.gz CGQAGQHMYKJZHW-GHMZBOCLSA-N 2 0 242.432 2.378 20 0 BEADRP CCC[C@H](C)[NH+]1CCC2(C[NH+](C)C2)CC1 ZINC001257324208 971219696 /nfs/dbraw/zinc/21/96/96/971219696.db2.gz KRVMMMLYPVYNGD-LBPRGKRZSA-N 2 0 210.365 2.203 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]CC2=CCCCC2)C12CCC2 ZINC000405257360 971220807 /nfs/dbraw/zinc/22/08/07/971220807.db2.gz LKAUNZBIGAYWRC-CHWSQXEVSA-N 2 0 220.360 2.346 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2C[C@H]([NH3+])C23CCC3)s1 ZINC000405247857 971222212 /nfs/dbraw/zinc/22/22/12/971222212.db2.gz GQQFWZNKGUPBPE-NWDGAFQWSA-N 2 0 236.384 2.416 20 0 BEADRP Cc1cccc(C[NH2+][C@@H]2C[C@H]([NH3+])C23CCC3)c1 ZINC000405256272 971223319 /nfs/dbraw/zinc/22/33/19/971223319.db2.gz MLIMGADDYRHEQO-UONOGXRCSA-N 2 0 230.355 2.355 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]C[C@@H]2Cc3ccccc32)C12CCC2 ZINC000405275580 971226811 /nfs/dbraw/zinc/22/68/11/971226811.db2.gz WVLGBYYVFPQGNZ-CFVMTHIKSA-N 2 0 242.366 2.186 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+][C@H]2CC23CCCC3)C12CCC2 ZINC000405302377 971232413 /nfs/dbraw/zinc/23/24/13/971232413.db2.gz JERNBFITEPTBLP-WOPDTQHZSA-N 2 0 220.360 2.179 20 0 BEADRP Cc1cscc1C[NH2+][C@H]1C[C@H]([NH3+])C12CCC2 ZINC000405293350 971231609 /nfs/dbraw/zinc/23/16/09/971231609.db2.gz ZGLDRFBPNLVNME-RYUDHWBXSA-N 2 0 236.384 2.416 20 0 BEADRP CC(C)=CCC[NH2+][C@H]1C[C@H]([NH3+])C12CCC2 ZINC000405380320 971247163 /nfs/dbraw/zinc/24/71/63/971247163.db2.gz IVSKCVHPYXSRNM-RYUDHWBXSA-N 2 0 208.349 2.202 20 0 BEADRP CCCC(CCC)[NH2+]C1(CO)CCN(C)CC1 ZINC001257334192 971239532 /nfs/dbraw/zinc/23/95/32/971239532.db2.gz NGRIMDVEOFSWML-UHFFFAOYSA-N 2 0 242.407 2.002 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]CC2CCCCC2)C12CCC2 ZINC000405360469 971239942 /nfs/dbraw/zinc/23/99/42/971239942.db2.gz TYTIETDVRBAPEK-STQMWFEESA-N 2 0 222.376 2.426 20 0 BEADRP CC1(C)CCC[C@@H]1[NH2+][C@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405355873 971241471 /nfs/dbraw/zinc/24/14/71/971241471.db2.gz QVSPKSDTPYLEKO-WOPDTQHZSA-N 2 0 222.376 2.425 20 0 BEADRP CC(C)=CCC[NH2+][C@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405380318 971247375 /nfs/dbraw/zinc/24/73/75/971247375.db2.gz IVSKCVHPYXSRNM-NEPJUHHUSA-N 2 0 208.349 2.202 20 0 BEADRP CCCC1(C[NH2+][C@@H]2C[C@H]([NH3+])C23CCC3)CC1 ZINC000405345780 971243352 /nfs/dbraw/zinc/24/33/52/971243352.db2.gz KUZRGLMODPQWMR-NWDGAFQWSA-N 2 0 222.376 2.426 20 0 BEADRP [NH3+]CCCCCCO[C@H]1C[NH2+]Cc2ccccc21 ZINC001217940954 1169547946 /nfs/dbraw/zinc/54/79/46/1169547946.db2.gz MQCCXXXWWZWVIO-HNNXBMFYSA-N 2 0 248.370 2.367 20 0 BEADRP Cc1csc(C[NH2+][C@H]2C[C@H]([NH3+])C23CCC3)c1 ZINC000405378823 971249013 /nfs/dbraw/zinc/24/90/13/971249013.db2.gz CGJVRXBLSQMYDT-RYUDHWBXSA-N 2 0 236.384 2.416 20 0 BEADRP CC(C)(C)CC[NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405439407 971253465 /nfs/dbraw/zinc/25/34/65/971253465.db2.gz DGFVGPJOXZRWNE-GHMZBOCLSA-N 2 0 210.365 2.282 20 0 BEADRP CCC[NH+]1C[C@@H]2C[NH+]([C@@H](C)CC)C[C@H]2C1 ZINC001257446913 971361633 /nfs/dbraw/zinc/36/16/33/971361633.db2.gz SKLOZVKLGMYVQC-YNEHKIRRSA-N 2 0 210.365 2.059 20 0 BEADRP CCC[N@H+]1C[C@@H]2C[NH+]([C@H](C)CC)C[C@@H]2C1 ZINC001257446912 971363051 /nfs/dbraw/zinc/36/30/51/971363051.db2.gz SKLOZVKLGMYVQC-UPJWGTAASA-N 2 0 210.365 2.059 20 0 BEADRP CCC[N@H+]1C[C@@H]2C[NH+]([C@@H](C)CC)C[C@@H]2C1 ZINC001257446911 971364151 /nfs/dbraw/zinc/36/41/51/971364151.db2.gz SKLOZVKLGMYVQC-RWMBFGLXSA-N 2 0 210.365 2.059 20 0 BEADRP C([NH2+]C1CCCCC1)C12CC[NH+](CC1)CC2 ZINC001257451081 971372080 /nfs/dbraw/zinc/37/20/80/971372080.db2.gz CVJFERHQNBQJLL-UHFFFAOYSA-N 2 0 222.376 2.395 20 0 BEADRP [NH3+]CCCCCCO[C@@H]1CCC[C@@]12CC[NH2+]C2 ZINC001217803914 971415075 /nfs/dbraw/zinc/41/50/75/971415075.db2.gz UEQZUHDVAPXRCA-KGLIPLIRSA-N 2 0 240.391 2.054 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1OCCCCCCC[NH3+] ZINC001217792153 971409605 /nfs/dbraw/zinc/40/96/05/971409605.db2.gz ZPEMJTZPDKSNFY-UONOGXRCSA-N 2 0 242.407 2.300 20 0 BEADRP C[C@@H]1C[C@H]([NH+]2CC3(C2)CC[NH2+]C3)CC(C)(C)C1 ZINC000724057018 971436224 /nfs/dbraw/zinc/43/62/24/971436224.db2.gz OLHOREFDXVWTPD-OLZOCXBDSA-N 2 0 236.403 2.497 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]1OCc1ccccc1C[NH3+] ZINC001217876356 971470746 /nfs/dbraw/zinc/47/07/46/971470746.db2.gz GAGXWZWXHJYCOY-CQSZACIVSA-N 2 0 248.370 2.050 20 0 BEADRP C[NH+](C)[C@H]1CC[C@@H]([NH2+][C@@H]2CCCSC2)CC1 ZINC001257669046 971472554 /nfs/dbraw/zinc/47/25/54/971472554.db2.gz XCGXEGGVMVMTAD-UPJWGTAASA-N 2 0 242.432 2.344 20 0 BEADRP C[N@H+](CCC[NH+]1CCCC1)[C@H]1CCCSC1 ZINC001257676557 971477216 /nfs/dbraw/zinc/47/72/16/971477216.db2.gz DDRKUOCLIKVRAF-ZDUSSCGKSA-N 2 0 242.432 2.300 20 0 BEADRP CC(C)C[NH+]1CCC([N@H+](C)C(C)C)CC1 ZINC001258011779 971552668 /nfs/dbraw/zinc/55/26/68/971552668.db2.gz QHACOJOWEXCGIK-UHFFFAOYSA-N 2 0 212.381 2.447 20 0 BEADRP CC(C)C[NH+]1CCC([N@@H+]2C[C@@H]3C[C@@H]3C2)CC1 ZINC001258013865 971556461 /nfs/dbraw/zinc/55/64/61/971556461.db2.gz YKQOKAGVMGPZAN-BETUJISGSA-N 2 0 222.376 2.059 20 0 BEADRP CSCC[N@H+](C)C1CC[NH+](CC(C)C)CC1 ZINC001258018528 971558145 /nfs/dbraw/zinc/55/81/45/971558145.db2.gz OTEYVTWFALLXES-UHFFFAOYSA-N 2 0 244.448 2.402 20 0 BEADRP C[C@H]([NH3+])c1ccc(O[C@@H]2CCC[NH2+]C[C@@H]2C)cc1 ZINC001217996151 971565198 /nfs/dbraw/zinc/56/51/98/971565198.db2.gz QPSOROSLPFKVLO-SLEUVZQESA-N 2 0 248.370 2.473 20 0 BEADRP C[C@@H]([NH3+])c1ccc(O[C@@H](C)C2CC[NH2+]CC2)cc1 ZINC001218005970 971568253 /nfs/dbraw/zinc/56/82/53/971568253.db2.gz PDUGETKFRFVXMV-NEPJUHHUSA-N 2 0 248.370 2.473 20 0 BEADRP C[C@@H](Oc1ccc([C@H](C)[NH3+])cc1)C1CC[NH2+]CC1 ZINC001218005972 971570463 /nfs/dbraw/zinc/57/04/63/971570463.db2.gz PDUGETKFRFVXMV-NWDGAFQWSA-N 2 0 248.370 2.473 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1Oc1ccc2c(c1)C[NH2+]C2 ZINC001218028375 971578800 /nfs/dbraw/zinc/57/88/00/971578800.db2.gz FORGIQDPBXLDQC-ABAIWWIYSA-N 2 0 246.354 2.057 20 0 BEADRP C[C@H]([NH3+])c1ccc(O[C@H]2CC[NH2+][C@H](C)C2)cc1 ZINC001218053435 971590174 /nfs/dbraw/zinc/59/01/74/971590174.db2.gz QVFGWSXOILTLHI-SUNKGSAMSA-N 2 0 234.343 2.226 20 0 BEADRP C[C@@H]([NH3+])c1ccc(O[C@@H]2CC[NH2+][C@H](C)C2)cc1 ZINC001218053434 971591743 /nfs/dbraw/zinc/59/17/43/971591743.db2.gz QVFGWSXOILTLHI-JTNHKYCSSA-N 2 0 234.343 2.226 20 0 BEADRP [NH3+]Cc1ccc(O[C@H]2CCC23CC[NH2+]CC3)cc1 ZINC001218079074 971596948 /nfs/dbraw/zinc/59/69/48/971596948.db2.gz CMQVOOJDJLYNEI-AWEZNQCLSA-N 2 0 246.354 2.056 20 0 BEADRP CCC[N@H+](CCC[NH3+])[C@@H]1C[C@@H]2[C@H](C1)C2(C)C ZINC001170715257 971632985 /nfs/dbraw/zinc/63/29/85/971632985.db2.gz FGOHLHUTUWZJQM-XYYAHUGASA-N 2 0 224.392 2.482 20 0 BEADRP C[N@@H+]1CCC[C@H]1CC[NH2+][C@@H]1C[C@@H]2[C@H](C1)C2(C)C ZINC001170724411 971654767 /nfs/dbraw/zinc/65/47/67/971654767.db2.gz JIVZODBRRWHDKH-XDQVBPFNSA-N 2 0 236.403 2.495 20 0 BEADRP N[C@@H]1CC[N@H+](CCC2CCCC2)CC[C@@H]1F ZINC001206156911 974335082 /nfs/dbraw/zinc/33/50/82/974335082.db2.gz UFCPOKZPPHJIOO-QWHCGFSZSA-N 2 0 228.355 2.328 20 0 BEADRP CC1(C)[C@@H]2C[C@@H]([NH2+][C@H]3CCN(CC4CC4)C3)C[C@@H]21 ZINC001170732300 971675429 /nfs/dbraw/zinc/67/54/29/971675429.db2.gz XXBSGBRUUZQYFU-ZQDZILKHSA-N 2 0 248.414 2.495 20 0 BEADRP C[C@H](c1cccc(O[C@@H]2CCC[NH2+]C2)c1)[NH+](C)C ZINC001218283062 971676801 /nfs/dbraw/zinc/67/68/01/971676801.db2.gz DMRUUBUJZHSMIJ-IUODEOHRSA-N 2 0 248.370 2.440 20 0 BEADRP Nc1cc(Nc2cccc3c2CC[NH2+]C3)cc[nH+]1 ZINC001159113469 971685840 /nfs/dbraw/zinc/68/58/40/971685840.db2.gz HAQCZSCLCDICCR-UHFFFAOYSA-N 2 0 240.310 2.053 20 0 BEADRP [NH3+]Cc1ccccc1O[C@@H]1CC[NH2+]C2(CCC2)C1 ZINC001218309262 971702890 /nfs/dbraw/zinc/70/28/90/971702890.db2.gz OYVFPIQWLPVHRV-CYBMUJFWSA-N 2 0 246.354 2.199 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]1Oc1ccc2c(c1)C[NH2+]C2 ZINC001218316333 971703330 /nfs/dbraw/zinc/70/33/30/971703330.db2.gz PXRIGLKCGSIDDM-CQSZACIVSA-N 2 0 246.354 2.057 20 0 BEADRP CC[N@@H+]1CCC[C@@H](C[NH2+][C@@H]2CCC2(C)C)C1 ZINC000309681684 971761826 /nfs/dbraw/zinc/76/18/26/971761826.db2.gz ZPYFOHOAOZKXCT-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CC[C@H](Oc2ccc([C@@H]3C[C@H]3[NH3+])cc2)C[NH2+]1 ZINC001218410418 971783039 /nfs/dbraw/zinc/78/30/39/971783039.db2.gz ZTSGULMYQFCCTR-SDJAHQOYSA-N 2 0 246.354 2.021 20 0 BEADRP C[C@H]1CC[C@@H](Oc2ccc([C@@H]3C[C@H]3[NH3+])cc2)C[NH2+]1 ZINC001218410416 971783786 /nfs/dbraw/zinc/78/37/86/971783786.db2.gz ZTSGULMYQFCCTR-OADPDTJPSA-N 2 0 246.354 2.021 20 0 BEADRP CC[C@@H](CSC)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000217327796 971787562 /nfs/dbraw/zinc/78/75/62/971787562.db2.gz BFUGNZMCXBCIHO-WODVXLOZSA-N 2 0 242.432 2.343 20 0 BEADRP C[C@H]([NH3+])c1ccc(O[C@@H]2CC[C@@H]3C[NH2+]C[C@@H]23)cc1 ZINC001218461836 971823832 /nfs/dbraw/zinc/82/38/32/971823832.db2.gz AZEULKGMQMOMNV-QMGNLALYSA-N 2 0 246.354 2.083 20 0 BEADRP C[C@H]([NH3+])c1ccc(O[C@@H]2CC[C@H]3C[NH2+]C[C@@H]32)cc1 ZINC001218461831 971823994 /nfs/dbraw/zinc/82/39/94/971823994.db2.gz AZEULKGMQMOMNV-HQRZJTNHSA-N 2 0 246.354 2.083 20 0 BEADRP Cc1cc(-c2ccc3[nH]c(N)[nH+]c3c2)cnc1N ZINC001245537939 971851937 /nfs/dbraw/zinc/85/19/37/971851937.db2.gz HWGOJWJOISGERA-UHFFFAOYSA-N 2 0 239.282 2.098 20 0 BEADRP C[NH+](C)[C@H]1CCCC[C@@H]1Nc1cc[nH+]cc1 ZINC000309953679 971893440 /nfs/dbraw/zinc/89/34/40/971893440.db2.gz HGHUMXAEMQXMAE-STQMWFEESA-N 2 0 219.332 2.366 20 0 BEADRP C[NH2+]C1C[C@H]2CC[C@@H](C1)N2Cc1[nH]c(C)cc1C ZINC001276798672 971963681 /nfs/dbraw/zinc/96/36/81/971963681.db2.gz WDCDNPPKFPHHOH-AGUYFDCRSA-N 2 0 247.386 2.346 20 0 BEADRP [NH3+]CCc1ccc(NC2=C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC001159640032 971998565 /nfs/dbraw/zinc/99/85/65/971998565.db2.gz KVQIEICYAQQAGF-KGLIPLIRSA-N 2 0 243.354 2.008 20 0 BEADRP C[C@@H]([NH3+])CCNc1ccc(C2([NH3+])CCC2)cc1 ZINC001170891027 972044139 /nfs/dbraw/zinc/04/41/39/972044139.db2.gz MAGIGJQUVHVYHV-LLVKDONJSA-N 2 0 233.359 2.174 20 0 BEADRP C[C@@H]([NH3+])CCNc1cc[nH+]cc1-c1ccccc1 ZINC001170891131 972046188 /nfs/dbraw/zinc/04/61/88/972046188.db2.gz UENUPJYURHSYCX-GFCCVEGCSA-N 2 0 241.338 2.320 20 0 BEADRP [NH3+]CCC[C@@H]([NH3+])Nc1ccc(F)c2ccccc12 ZINC001170898528 972055878 /nfs/dbraw/zinc/05/58/78/972055878.db2.gz CWPCGARFFKINMZ-AWEZNQCLSA-N 2 0 247.317 2.415 20 0 BEADRP Cc1cc(Cl)cc(N[C@H]([NH3+])CCC[NH3+])c1 ZINC001170900276 972063889 /nfs/dbraw/zinc/06/38/89/972063889.db2.gz JWMCQTFZBXMCHW-NSHDSACASA-N 2 0 227.739 2.084 20 0 BEADRP CC[C@H]1CC[C@@H]([NH2+]CC2([NH3+])CCCC2)C1 ZINC001246076650 972127659 /nfs/dbraw/zinc/12/76/59/972127659.db2.gz QVTDODDFJIPRHR-NWDGAFQWSA-N 2 0 210.365 2.426 20 0 BEADRP CC(C)COCC[C@H](C)[NH2+][C@@H]1CCCC[NH2+]C1 ZINC001246091939 972146197 /nfs/dbraw/zinc/14/61/97/972146197.db2.gz RAXPWJZIJVDOFN-UONOGXRCSA-N 2 0 242.407 2.169 20 0 BEADRP C[C@@H]1C[NH2+]C[C@@H]1C[NH2+]C1CCC(C)(C)CC1 ZINC001246113599 972176807 /nfs/dbraw/zinc/17/68/07/972176807.db2.gz XAJGYXRZCJFXKY-VXGBXAGGSA-N 2 0 224.392 2.400 20 0 BEADRP CC(C)[C@H]1C[C@H]([NH2+]Cc2cccc(N)c2)CC[NH2+]1 ZINC001246119064 972181712 /nfs/dbraw/zinc/18/17/12/972181712.db2.gz ARBXXBTXRFKPII-HUUCEWRRSA-N 2 0 247.386 2.135 20 0 BEADRP Cl/C=C/C[N@@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000692954049 957047480 /nfs/dbraw/zinc/04/74/80/957047480.db2.gz GNOLVKQRLPFNFF-ZABGRMTBSA-N 2 0 242.794 2.451 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH+]2CCC[C@@H](CF)C2)C1 ZINC001208613672 957103933 /nfs/dbraw/zinc/10/39/33/957103933.db2.gz XORMEPLPFXMULV-QWHCGFSZSA-N 2 0 228.355 2.010 20 0 BEADRP CC(C)C([NH2+][C@H]1CCCC[NH2+]C1)C(C)C ZINC001246236604 972242539 /nfs/dbraw/zinc/24/25/39/972242539.db2.gz MRJOMJZXTJCFHO-LBPRGKRZSA-N 2 0 212.381 2.399 20 0 BEADRP CC/C=C\CC[N@@H+]1C[C@H]2C[C@@]2(C[NH+](C)C)C1 ZINC001208734186 957145211 /nfs/dbraw/zinc/14/52/11/957145211.db2.gz OCKDHNNOYGPWGP-HLMASZERSA-N 2 0 222.376 2.226 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]Cc1cccc2c1OCC2 ZINC000692968333 957160614 /nfs/dbraw/zinc/16/06/14/957160614.db2.gz XCDANVPWQPOHPB-LBPRGKRZSA-N 2 0 248.370 2.229 20 0 BEADRP C[C@H]([NH3+])[C@H]1CCC[N@H+](CC[C@@H]2C[C@H]2C2CC2)C1 ZINC000714835774 957425959 /nfs/dbraw/zinc/42/59/59/957425959.db2.gz YYAJOPGHISXIEK-ATGSNQNLSA-N 2 0 236.403 2.482 20 0 BEADRP C[C@H](Cc1cccc(F)c1)[NH2+]CC[C@H](C)[NH3+] ZINC001246306973 972267099 /nfs/dbraw/zinc/26/70/99/972267099.db2.gz UNVSZZWTVLXAHS-WDEREUQCSA-N 2 0 224.323 2.084 20 0 BEADRP Cc1cc(N2CC[NH+](C[C@@H]3C[C@H]3C)CC2)cc[nH+]1 ZINC001209426249 957449715 /nfs/dbraw/zinc/44/97/15/957449715.db2.gz JSWOKBWMTZICGK-OCCSQVGLSA-N 2 0 245.370 2.168 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@H]1CCc2cccc(F)c2C1 ZINC001246313162 972272550 /nfs/dbraw/zinc/27/25/50/972272550.db2.gz JELPRQPPPPJQMM-RYUDHWBXSA-N 2 0 236.334 2.010 20 0 BEADRP Cc1cc(N)[nH+]cc1Nc1c[nH+]ccc1N(C)C ZINC001209968654 957591723 /nfs/dbraw/zinc/59/17/23/957591723.db2.gz XDYFUILRNYEKJY-UHFFFAOYSA-N 2 0 243.314 2.177 20 0 BEADRP C[C@H](Cc1ccco1)[NH2+]C[C@H]1CC[C@@H](C)[NH2+]C1 ZINC000397523303 957663972 /nfs/dbraw/zinc/66/39/72/957663972.db2.gz FZOUKTXISBNQFP-UPJWGTAASA-N 2 0 236.359 2.188 20 0 BEADRP CO[C@@H](C[N@@H+]1CC[C@H](CC[NH3+])C1)c1ccccc1 ZINC000386019284 957777626 /nfs/dbraw/zinc/77/76/26/957777626.db2.gz WRTCWLMSDQTGSF-ZFWWWQNUSA-N 2 0 248.370 2.045 20 0 BEADRP CC(C)C[NH+]1CCC([NH2+][C@@H]2C[C@H]3C[C@H]3C2)CC1 ZINC000397776321 957815392 /nfs/dbraw/zinc/81/53/92/957815392.db2.gz XEDVCXMRHYEGMN-AGGWBTHJSA-N 2 0 236.403 2.495 20 0 BEADRP CCOCC[C@H](C)[NH2+]CCC[NH+](CC)CC ZINC001172406988 974664174 /nfs/dbraw/zinc/66/41/74/974664174.db2.gz RNEFPNHBCNKWDA-ZDUSSCGKSA-N 2 0 230.396 2.123 20 0 BEADRP [NH3+]C1CC([NH2+]CC2C3CC4CC(C3)CC2C4)C1 ZINC000693223947 957947208 /nfs/dbraw/zinc/94/72/08/957947208.db2.gz GZQGMRDZYOHYRW-UHFFFAOYSA-N 2 0 234.387 2.138 20 0 BEADRP CCCCC[C@@H](CC)[NH2+][C@H]1CC12C[NH2+]C2 ZINC001246441925 972314056 /nfs/dbraw/zinc/31/40/56/972314056.db2.gz ATXQZUFWQQCWSQ-NEPJUHHUSA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1CCC[C@@H]([C@H](C)[NH3+])C1 ZINC000723122318 958163905 /nfs/dbraw/zinc/16/39/05/958163905.db2.gz OPFPFUQLTAPWHT-LOWDOPEQSA-N 2 0 210.365 2.092 20 0 BEADRP C[N@H+](C[C@H]1C[C@@H]2[C@H](C1)C2(F)F)CC(C)(C)C[NH3+] ZINC000693296826 958186051 /nfs/dbraw/zinc/18/60/51/958186051.db2.gz NLDAYRNNZRMFKY-JGPRNRPPSA-N 2 0 246.345 2.194 20 0 BEADRP Cc1ccc2c(c1)C[C@H]([NH2+][C@H]1C[C@@](C)([NH3+])C1)CC2 ZINC001246459070 972332249 /nfs/dbraw/zinc/33/22/49/972332249.db2.gz IWKPSAVUUGZHTH-OAGGEKHMSA-N 2 0 244.382 2.322 20 0 BEADRP CC[C@@H](CC(C)C)[NH2+]CC[NH2+]C(C)C ZINC001246461284 972335613 /nfs/dbraw/zinc/33/56/13/972335613.db2.gz OONBISMFGFAAGB-LBPRGKRZSA-N 2 0 200.370 2.399 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@@H]2CC[NH2+]C[C@@H]2F)C[C@@H]1C ZINC001246475443 972347924 /nfs/dbraw/zinc/34/79/24/972347924.db2.gz FTTNYWKZDGMJSN-QMVSFRDZSA-N 2 0 242.382 2.348 20 0 BEADRP COc1cccc([C@H](C)C[NH2+]C2CC[NH2+]CC2)c1 ZINC001246502193 972357573 /nfs/dbraw/zinc/35/75/73/972357573.db2.gz UMZSMXWRLMZWNL-GFCCVEGCSA-N 2 0 248.370 2.140 20 0 BEADRP CCOCC[C@H](C)[NH2+]C1CC[NH+](C(C)C)CC1 ZINC001172408689 974668252 /nfs/dbraw/zinc/66/82/52/974668252.db2.gz KYCYOBOMOAXENB-ZDUSSCGKSA-N 2 0 242.407 2.264 20 0 BEADRP C[NH+](C)CC(C)(C)C[NH2+][C@H]1CCC[C@@H]2C[C@@H]21 ZINC000382395266 958890535 /nfs/dbraw/zinc/89/05/35/958890535.db2.gz NMFYGGCVCSODGM-AGIUHOORSA-N 2 0 224.392 2.352 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+][C@H]2CCCC[C@H]2C2CC2)C1 ZINC000693602695 958934426 /nfs/dbraw/zinc/93/44/26/958934426.db2.gz MVTOLCGDNQXQTK-PYJNHQTQSA-N 2 0 222.376 2.282 20 0 BEADRP CC1(C[NH2+][C@@H]2[C@@H]3CCC[NH2+][C@@H]3C2(C)C)CC1 ZINC000693755406 959268677 /nfs/dbraw/zinc/26/86/77/959268677.db2.gz FPEMWAVFXCAGQH-GRYCIOLGSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CCC1SCCS1 ZINC000693778677 959279540 /nfs/dbraw/zinc/27/95/40/959279540.db2.gz ZWSMNPIOEIOLRI-SNVBAGLBSA-N 2 0 248.461 2.290 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]Cc2ccc(F)cc2)C12CCC2 ZINC000405325417 959438487 /nfs/dbraw/zinc/43/84/87/959438487.db2.gz UCIDWZYOXJHMME-OLZOCXBDSA-N 2 0 234.318 2.185 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[NH2+][C@H]2CCC23CCCC3)C1 ZINC000693888142 959479147 /nfs/dbraw/zinc/47/91/47/959479147.db2.gz OZAPXHGZQNSZNL-XQQFMLRXSA-N 2 0 222.376 2.426 20 0 BEADRP CC(C)C[C@H](C)C[N@@H+]1CC[C@@H](CC[NH3+])C1 ZINC000300993777 959489404 /nfs/dbraw/zinc/48/94/04/959489404.db2.gz WAEHFIHHWDFJQL-QWHCGFSZSA-N 2 0 212.381 2.339 20 0 BEADRP [NH3+]C[C@H]1CCCC[N@H+](Cc2cccs2)C1 ZINC000308790748 959501545 /nfs/dbraw/zinc/50/15/45/959501545.db2.gz AYRBKWWPRPLTNP-LLVKDONJSA-N 2 0 224.373 2.309 20 0 BEADRP CCC[C@@H](C)C[N@@H+]1CCCC[C@@H](C[NH3+])C1 ZINC000308799151 959503511 /nfs/dbraw/zinc/50/35/11/959503511.db2.gz DFKZPGBYUUELOQ-OLZOCXBDSA-N 2 0 212.381 2.483 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1OCc1ccccc1C[NH3+] ZINC001217781437 959594234 /nfs/dbraw/zinc/59/42/34/959594234.db2.gz LAMBCTMCSJKPMM-IUODEOHRSA-N 2 0 248.370 2.050 20 0 BEADRP [NH3+]CCCCCCCO[C@H]1CC[C@]12CC[NH2+]C2 ZINC001217808562 959618601 /nfs/dbraw/zinc/61/86/01/959618601.db2.gz MTEWFGIUHZCCRT-UONOGXRCSA-N 2 0 240.391 2.054 20 0 BEADRP Cc1cccc2c1CC[C@H]([N@@H+]1CC[C@@](C)([NH3+])C1)C2 ZINC001246532153 972445362 /nfs/dbraw/zinc/44/53/62/972445362.db2.gz UMHJDLRHOHQENJ-GOEBONIOSA-N 2 0 244.382 2.275 20 0 BEADRP CC1=C[C@H](C)[C@@H](C[NH+]2CC3(C2)CC[NH2+]C3)CC1 ZINC001222379692 972449281 /nfs/dbraw/zinc/44/92/81/972449281.db2.gz IKIFXQLGKVSDDW-UONOGXRCSA-N 2 0 234.387 2.274 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2CCC[C@H](C(F)F)C2)CC1 ZINC001207398239 959715020 /nfs/dbraw/zinc/71/50/20/959715020.db2.gz BNPPZTDICSYQGL-LBPRGKRZSA-N 2 0 246.345 2.305 20 0 BEADRP C[C@H](Cc1ccccc1Cl)[NH2+]C[C@@H](C)C[NH3+] ZINC000309276438 959824918 /nfs/dbraw/zinc/82/49/18/959824918.db2.gz DVGGTMLYSYYFHR-WDEREUQCSA-N 2 0 240.778 2.455 20 0 BEADRP C[C@H]1C[N@H+](CC2(C)CCCCC2)C[C@H]1C[NH3+] ZINC000708826001 959857158 /nfs/dbraw/zinc/85/71/58/959857158.db2.gz SBFNDZORYLJORS-QWHCGFSZSA-N 2 0 224.392 2.483 20 0 BEADRP C[C@H]([NH3+])c1ccc(O[C@H]2CC[C@]23CC[NH2+]C3)cc1 ZINC001218126145 959870919 /nfs/dbraw/zinc/87/09/19/959870919.db2.gz YVPLRBDGKWYPFK-TUKIKUTGSA-N 2 0 246.354 2.227 20 0 BEADRP C[C@H]1C[N@H+](Cc2c[nH]c3ccccc23)C[C@H]1C[NH3+] ZINC000708898985 960091730 /nfs/dbraw/zinc/09/17/30/960091730.db2.gz BWNHHJGQCYFECX-NWDGAFQWSA-N 2 0 243.354 2.195 20 0 BEADRP C(C1CC[NH2+]CC1)[N@@H+]1CCCCC12CC2 ZINC001207438980 960098249 /nfs/dbraw/zinc/09/82/49/960098249.db2.gz GTOLUZOCBLANMK-UHFFFAOYSA-N 2 0 208.349 2.005 20 0 BEADRP C[C@@H]([NH2+]C1CCCCCCC1)C1C[NH2+]C1 ZINC000686254815 960241876 /nfs/dbraw/zinc/24/18/76/960241876.db2.gz RERNEDAJRNWRPX-LLVKDONJSA-N 2 0 210.365 2.297 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)C2(Cl)CC2)C1 ZINC000695635917 960311824 /nfs/dbraw/zinc/31/18/24/960311824.db2.gz DVDWPICQYNDOAZ-RYUDHWBXSA-N 2 0 244.810 2.468 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)C1(Cl)CC1 ZINC000695655871 960329490 /nfs/dbraw/zinc/32/94/90/960329490.db2.gz OCLSTRVJNWHJLR-SDDRHHMPSA-N 2 0 242.794 2.363 20 0 BEADRP CCCC[N@H+](C)CCC1CC[NH+](C)CC1 ZINC001207479434 960354070 /nfs/dbraw/zinc/35/40/70/960354070.db2.gz ITCWGCFJWLQGJB-UHFFFAOYSA-N 2 0 212.381 2.450 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@@H](C)C2(Cl)CC2)CC1 ZINC000695694662 960377491 /nfs/dbraw/zinc/37/74/91/960377491.db2.gz BKSLXRLOIXICQY-NSHDSACASA-N 2 0 244.810 2.468 20 0 BEADRP [NH3+][C@@H]1CCC[N@H+](CC2CCC3(CC3)CC2)C1 ZINC000695761929 960431451 /nfs/dbraw/zinc/43/14/51/960431451.db2.gz KHKHOFVVRZPMFG-CYBMUJFWSA-N 2 0 222.376 2.380 20 0 BEADRP C1CC12CCC([NH2+][C@H]1[C@@H]3[NH2+]C[C@H]4C[C@H]1C[C@H]34)CC2 ZINC000695766821 960442441 /nfs/dbraw/zinc/44/24/41/960442441.db2.gz CWWZODHHJOFCCG-WPTOEGHWSA-N 2 0 246.398 2.295 20 0 BEADRP C[N@H+](CCC1CC1)CCC1CC[NH+](C)CC1 ZINC001207487225 960478719 /nfs/dbraw/zinc/47/87/19/960478719.db2.gz UKSVFPVEVPTLAJ-UHFFFAOYSA-N 2 0 224.392 2.450 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CCCOc2ccccc2)CC[NH2+]1 ZINC000709358884 960532007 /nfs/dbraw/zinc/53/20/07/960532007.db2.gz WJKHQLLHHHGBOD-KBPBESRZSA-N 2 0 248.370 2.186 20 0 BEADRP C[C@@H]1C[C@H]([N@H+](CC2CC2)C2CC2)CC[NH2+]1 ZINC000709465062 960604558 /nfs/dbraw/zinc/60/45/58/960604558.db2.gz NTKHILQHDOVNNL-ZWNOBZJWSA-N 2 0 208.349 2.001 20 0 BEADRP C[C@H]1C[C@H]([N@H+](CC2CC2)C2CC2)CC[NH2+]1 ZINC000709465054 960606179 /nfs/dbraw/zinc/60/61/79/960606179.db2.gz NTKHILQHDOVNNL-GXFFZTMASA-N 2 0 208.349 2.001 20 0 BEADRP COc1ccc(C)cc1C[N@@H+]1CC[C@@H](CC[NH3+])C1 ZINC000125561876 960847271 /nfs/dbraw/zinc/84/72/71/960847271.db2.gz LTPQHUUPCQUJNT-CYBMUJFWSA-N 2 0 248.370 2.174 20 0 BEADRP C[N@@H+]1CC[C@@]2(CC[NH+](C[C@H]3C[C@H]4C=C[C@@H]3C4)C2)C1 ZINC001207631438 961393464 /nfs/dbraw/zinc/39/34/64/961393464.db2.gz HQBPBKHHLRZSMD-ZJIFWQFVSA-N 2 0 246.398 2.226 20 0 BEADRP Cc1cc(C)[nH+]c(N[C@@H]2CCC[C@@H]([NH3+])C2)c1 ZINC000709762409 961486118 /nfs/dbraw/zinc/48/61/18/961486118.db2.gz STPZQWDJVDQFNI-VXGBXAGGSA-N 2 0 219.332 2.380 20 0 BEADRP CC(C)[NH+]1CCC(C[NH2+][C@@H]2C[C@H]3C[C@H]3C2)CC1 ZINC001167899091 961535470 /nfs/dbraw/zinc/53/54/70/961535470.db2.gz WUDQODPLDSGEBO-QDMKHBRRSA-N 2 0 236.403 2.495 20 0 BEADRP CC[C@H](C)CC[NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2 ZINC000696212216 961868543 /nfs/dbraw/zinc/86/85/43/961868543.db2.gz BMQQRORQNITNLN-QJPTWQEYSA-N 2 0 210.365 2.282 20 0 BEADRP CC[C@H](C)CC[NH2+][C@H]1C[C@H]([NH3+])C12CCC2 ZINC000696212232 961869297 /nfs/dbraw/zinc/86/92/97/961869297.db2.gz BMQQRORQNITNLN-SRVKXCTJSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]1CC[C@@H]([NH+]2CCN(c3cc[nH+]cc3)CC2)C1 ZINC000092874349 961897265 /nfs/dbraw/zinc/89/72/65/961897265.db2.gz HMADQCBECSBUIZ-DZGCQCFKSA-N 2 0 245.370 2.392 20 0 BEADRP [NH3+]C[C@@H]1CCCC[N@H+](CC2OC=CC2=S)C1 ZINC001206641183 962284551 /nfs/dbraw/zinc/28/45/51/962284551.db2.gz UCYLJTGPYDWPPX-JTQLQIEISA-N 2 0 240.372 2.129 20 0 BEADRP C[N@@H+]1CCC[C@@H]1CC[NH2+][C@H]1CCOC(C)(C)C1 ZINC000710384750 962373496 /nfs/dbraw/zinc/37/34/96/962373496.db2.gz MZFQKCYTDGAPSI-QWHCGFSZSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@H]1CCCC[N@@H+]1C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000710797192 962474591 /nfs/dbraw/zinc/47/45/91/962474591.db2.gz ZWBJYYMCMSTLDQ-ACJTYDJDSA-N 2 0 208.349 2.144 20 0 BEADRP C([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)C1CC1 ZINC001167958034 962824094 /nfs/dbraw/zinc/82/40/94/962824094.db2.gz BCLFJIKEWQCUJH-GOOCMWNKSA-N 2 0 234.387 2.391 20 0 BEADRP CC(C)Oc1cc[nH+]c(NC[C@H]2C[NH2+][C@H](C)C2)c1 ZINC001155102042 962977859 /nfs/dbraw/zinc/97/78/59/962977859.db2.gz QHCZAHKZMHGSHO-VXGBXAGGSA-N 2 0 249.358 2.279 20 0 BEADRP Cc1cc(N(CCC[NH3+])C(C)C)cc(C)[nH+]1 ZINC000304453344 963093431 /nfs/dbraw/zinc/09/34/31/963093431.db2.gz WJHZAYUKKPMUGW-UHFFFAOYSA-N 2 0 221.348 2.262 20 0 BEADRP CC(C)(C[NH2+][C@@H]1CCC[C@@H]1C[NH3+])C(C)(F)F ZINC000696621525 963297767 /nfs/dbraw/zinc/29/77/67/963297767.db2.gz RJYLEFCIUUIXJE-NXEZZACHSA-N 2 0 234.334 2.385 20 0 BEADRP CC[C@]1(C)CC[N@H+](C[C@@H]2CCCC[NH2+]C2)C1 ZINC000697036857 963664698 /nfs/dbraw/zinc/66/46/98/963664698.db2.gz MSSRCJHNDAUIHS-ZIAGYGMSSA-N 2 0 224.392 2.498 20 0 BEADRP CC(C)[C@H](C)[N@H+](C)C[C@@H]1CCCC[NH2+]C1 ZINC000697038392 963665876 /nfs/dbraw/zinc/66/58/76/963665876.db2.gz CJHIPYOXYNVMFA-QWHCGFSZSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H]1C[C@@H](C)[N@H+](C[C@@H]2CCCC[NH2+]C2)C1 ZINC000697043520 963667918 /nfs/dbraw/zinc/66/79/18/963667918.db2.gz WPHMLVHMZILBKJ-JHJVBQTASA-N 2 0 210.365 2.106 20 0 BEADRP CCCC[N@H+](CC)C[C@@H]1CCCC[NH2+]C1 ZINC000697049718 963680711 /nfs/dbraw/zinc/68/07/11/963680711.db2.gz BPRXVDFHPGJABU-CYBMUJFWSA-N 2 0 212.381 2.498 20 0 BEADRP Cc1c[nH+]c(N2CCC[C@](C)(C[NH3+])C2)cc1C ZINC001158684772 963903044 /nfs/dbraw/zinc/90/30/44/963903044.db2.gz TUTAIIKPGIUNKP-CQSZACIVSA-N 2 0 233.359 2.264 20 0 BEADRP CC1(Nc2cccc3c2CC[C@@H]3[NH3+])CC[NH2+]CC1 ZINC001168188283 963947919 /nfs/dbraw/zinc/94/79/19/963947919.db2.gz QQONLKPPRUDQIB-ZDUSSCGKSA-N 2 0 245.370 2.187 20 0 BEADRP CC1=CC(=O)C[NH+]=C1NC=CC1CC[NH2+]CC1 ZINC001159124420 964002443 /nfs/dbraw/zinc/00/24/43/964002443.db2.gz WFEIBMJWAYUPJH-QPJJXVBHSA-N 2 0 233.315 2.021 20 0 BEADRP CC[NH+]1C[C@@H]2C[NH+](C3CCC(C)CC3)C[C@H]2C1 ZINC001168225413 964004805 /nfs/dbraw/zinc/00/48/05/964004805.db2.gz ZPOKIWKYAHDBCE-PIOWNMBXSA-N 2 0 236.403 2.449 20 0 BEADRP C(=CC1CC[NH2+]CC1)Nc1c[nH+]c2ccccn12 ZINC001159203628 964015619 /nfs/dbraw/zinc/01/56/19/964015619.db2.gz HBYQJXVIWUIKLC-RMKNXTFCSA-N 2 0 242.326 2.260 20 0 BEADRP c1c(NC2=C[NH2+]CCC2)onc1[C@@H]1CCCC[NH2+]1 ZINC001159313938 964059626 /nfs/dbraw/zinc/05/96/26/964059626.db2.gz VUTJDDOIRXCJCT-NSHDSACASA-N 2 0 248.330 2.126 20 0 BEADRP [NH3+]C1(c2ccc(NC3=CC[NH2+]CC3)cc2)CCC1 ZINC001159722169 964163926 /nfs/dbraw/zinc/16/39/26/964163926.db2.gz SZNCPKQUIUNOQT-UHFFFAOYSA-N 2 0 243.354 2.314 20 0 BEADRP Cc1cc2[nH]ccc2c(NCC(C)(C)[NH3+])[nH+]1 ZINC001160031965 964242320 /nfs/dbraw/zinc/24/23/20/964242320.db2.gz HQKXMKVMOQSEGS-UHFFFAOYSA-N 2 0 218.304 2.021 20 0 BEADRP C[NH+](C)C1CCC([NH2+]C[C@H]2C[C@H](F)C2)CC1 ZINC001168297743 964393033 /nfs/dbraw/zinc/39/30/33/964393033.db2.gz ILOHHCKKKGXAOL-KETTVSFTSA-N 2 0 228.355 2.197 20 0 BEADRP C[NH+](C)C1CCC([N@@H+]2C[C@@H]3C[C@@H]3[C@@H](F)C2)CC1 ZINC001168313629 964416083 /nfs/dbraw/zinc/41/60/83/964416083.db2.gz FMYDRNFXJYHTFC-ASUPZPJHSA-N 2 0 240.366 2.149 20 0 BEADRP C[NH+](C)C1CCC([N@@H+]2Cc3cccnc3C2)CC1 ZINC001168315717 964421601 /nfs/dbraw/zinc/42/16/01/964421601.db2.gz LOXJSPKTZMBJII-UHFFFAOYSA-N 2 0 245.370 2.270 20 0 BEADRP C[NH+](C)C1CCC([NH+]2CCC(F)CC2)CC1 ZINC001168314001 964422064 /nfs/dbraw/zinc/42/20/64/964422064.db2.gz IBSQYPDVQBKTIR-UHFFFAOYSA-N 2 0 228.355 2.293 20 0 BEADRP C[NH+](C)C1CCC([N@@H+]2Cc3ccncc3C2)CC1 ZINC001168324009 964450572 /nfs/dbraw/zinc/45/05/72/964450572.db2.gz GHVLDAFWTNOFKN-UHFFFAOYSA-N 2 0 245.370 2.270 20 0 BEADRP C[NH+](C)C1CCC([N@@H+]2CCC[C@H]3C[C@H]32)CC1 ZINC001168329510 964460519 /nfs/dbraw/zinc/46/05/19/964460519.db2.gz WDOKBRLIPLZOIP-GFJIZPEISA-N 2 0 222.376 2.344 20 0 BEADRP C[N@@H+]1CCC[C@@H]1CCNc1[nH+]ccc2[nH]ccc21 ZINC001160966673 964462178 /nfs/dbraw/zinc/46/21/78/964462178.db2.gz WMZZDCVQWUILML-LLVKDONJSA-N 2 0 244.342 2.459 20 0 BEADRP CC[C@H]([NH2+]CC[C@@H](C)[NH+](C)C)C1CCC1 ZINC000697824828 964545427 /nfs/dbraw/zinc/54/54/27/964545427.db2.gz MGNANTMEDBIDTH-YPMHNXCESA-N 2 0 212.381 2.495 20 0 BEADRP C[C@H](CC[NH2+][C@H]1CCCSCC1)[NH+](C)C ZINC000697846250 964565311 /nfs/dbraw/zinc/56/53/11/964565311.db2.gz BZIIGUOBLCEKMP-NEPJUHHUSA-N 2 0 230.421 2.202 20 0 BEADRP C[C@H](CC[NH2+][C@H]1CCc2ccccc2C1)[NH+](C)C ZINC000697858920 964573442 /nfs/dbraw/zinc/57/34/42/964573442.db2.gz PENDIEZLDOQNAH-CJNGLKHVSA-N 2 0 246.398 2.474 20 0 BEADRP C[C@@H](CC[NH2+][C@H]1CCc2ccccc2C1)[NH+](C)C ZINC000697858918 964573621 /nfs/dbraw/zinc/57/36/21/964573621.db2.gz PENDIEZLDOQNAH-BBRMVZONSA-N 2 0 246.398 2.474 20 0 BEADRP CSC1(C[NH2+]CC[C@@H](C)[NH+](C)C)CCC1 ZINC000697888633 964635529 /nfs/dbraw/zinc/63/55/29/964635529.db2.gz PKCBMJMDIWLJQU-LLVKDONJSA-N 2 0 230.421 2.202 20 0 BEADRP CC/C=C/[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC001168363239 964674138 /nfs/dbraw/zinc/67/41/38/964674138.db2.gz WNXKKKRALKDIJJ-FPYGCLRLSA-N 2 0 208.349 2.374 20 0 BEADRP Cc1ccc(C)c(NCCCC[NH+](C)C)[nH+]1 ZINC001161724437 964716920 /nfs/dbraw/zinc/71/69/20/964716920.db2.gz IOTYGTPEUNRYPL-UHFFFAOYSA-N 2 0 221.348 2.452 20 0 BEADRP C[NH+](C)CCCCNc1cccc2c1CC[C@@H]2[NH3+] ZINC001161730618 964718705 /nfs/dbraw/zinc/71/87/05/964718705.db2.gz MMVYLHSFPMNPJR-AWEZNQCLSA-N 2 0 247.386 2.386 20 0 BEADRP CCc1cccc(N[C@H]2CCC[C@H]([NH3+])C2)n1 ZINC001162401567 964958630 /nfs/dbraw/zinc/95/86/30/964958630.db2.gz LHQUZCDXSJRTCJ-JQWIXIFHSA-N 2 0 219.332 2.326 20 0 BEADRP [NH3+][C@@H]1CCC[C@H](Nc2cccc3c2C[NH2+]CC3)C1 ZINC001162402582 964961934 /nfs/dbraw/zinc/96/19/34/964961934.db2.gz UISXVVYIUVWMOI-OLZOCXBDSA-N 2 0 245.370 2.014 20 0 BEADRP C[C@H]1C[NH2+]CCC[C@H]1CNc1cccc(C[NH3+])c1 ZINC001162457130 964983381 /nfs/dbraw/zinc/98/33/81/964983381.db2.gz MVMJKLZOJRRYGC-JSGCOSHPSA-N 2 0 247.386 2.193 20 0 BEADRP Cc1cc2cc[nH]c2c(NC[C@H]2C[NH2+][C@H](C)C2)[nH+]1 ZINC001162554831 965042196 /nfs/dbraw/zinc/04/21/96/965042196.db2.gz JVTLHZYYLUPVJA-MWLCHTKSSA-N 2 0 244.342 2.281 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@@H+]([C@H]2CCc3c2cccc3F)C1 ZINC000250730857 965043571 /nfs/dbraw/zinc/04/35/71/965043571.db2.gz KLKVZEBDSNWECR-NHYWBVRUSA-N 2 0 248.345 2.354 20 0 BEADRP CC(C)(C)C(=[NH2+])Nc1ccc2c(n1)C[NH2+]CC2 ZINC001162661678 965097360 /nfs/dbraw/zinc/09/73/60/965097360.db2.gz GVKMYDDYXDBRAM-UHFFFAOYSA-N 2 0 232.331 2.163 20 0 BEADRP CC[NH+](CC)CCO[C@H]1CC[C@H]([NH+](C)C)CC1 ZINC001224926778 965103612 /nfs/dbraw/zinc/10/36/12/965103612.db2.gz AOONSFGPQFTUCM-HDJSIYSDSA-N 2 0 242.407 2.218 20 0 BEADRP C[C@H]1[NH2+]CC[C@H]1Nc1cccc(C2=[NH+]CCC2)c1 ZINC001162676514 965109631 /nfs/dbraw/zinc/10/96/31/965109631.db2.gz RKRZTUSJZJVZOI-BXUZGUMPSA-N 2 0 243.354 2.432 20 0 BEADRP C[C@H]([NH3+])c1ccc(N[C@H]2C[NH+]3CCC2CC3)cc1 ZINC001163393215 965395749 /nfs/dbraw/zinc/39/57/49/965395749.db2.gz QIFXIUDJBBDXJV-NHYWBVRUSA-N 2 0 245.370 2.212 20 0 BEADRP Cc1c2[nH+]c[nH]c2ccc1N[C@@H](C)C[NH+](C)C ZINC001163777287 965580805 /nfs/dbraw/zinc/58/08/05/965580805.db2.gz VFQQGKZHEPTUBH-VIFPVBQESA-N 2 0 232.331 2.233 20 0 BEADRP C[C@H](C[NH+](C)C)Nc1ccccc1C(C)(C)[NH3+] ZINC001163782943 965591078 /nfs/dbraw/zinc/59/10/78/965591078.db2.gz VAOOBPALAMSQRJ-LLVKDONJSA-N 2 0 235.375 2.242 20 0 BEADRP C[C@@H]1CC[C@H](C[NH3+])N(c2cc3[nH]ccc3c[nH+]2)C1 ZINC001164060843 965723641 /nfs/dbraw/zinc/72/36/41/965723641.db2.gz CGNXTXPWJIRNDS-ZYHUDNBSSA-N 2 0 244.342 2.127 20 0 BEADRP COc1ccc(C[N@@H+]2CCC[C@H]([NH3+])CC2)cc1C ZINC001205095477 965746345 /nfs/dbraw/zinc/74/63/45/965746345.db2.gz YCUSOEBIWOZDIG-AWEZNQCLSA-N 2 0 248.370 2.317 20 0 BEADRP CC(C)N(CCC[NH3+])c1cccc2c1CC[C@@H]2[NH3+] ZINC001164128711 965750318 /nfs/dbraw/zinc/75/03/18/965750318.db2.gz DOWNPSAWWHBXSE-AWEZNQCLSA-N 2 0 247.386 2.196 20 0 BEADRP Cc1cc(C[N@@H+]2CCC[C@H]([NH3+])CC2)c(C)cc1O ZINC001205110301 965837282 /nfs/dbraw/zinc/83/72/82/965837282.db2.gz RECAWZPLLLURDK-AWEZNQCLSA-N 2 0 248.370 2.322 20 0 BEADRP COc1ccc(C)c(C[N@@H+]2CCC[C@@H]([NH3+])CC2)c1 ZINC001205124669 965895883 /nfs/dbraw/zinc/89/58/83/965895883.db2.gz XPOJWCAKZBHZIJ-CQSZACIVSA-N 2 0 248.370 2.317 20 0 BEADRP Cc1cnc(C[N@@H+]2CCC[C@@H]([NH3+])CC2)c(C)c1 ZINC001205124582 965898702 /nfs/dbraw/zinc/89/87/02/965898702.db2.gz VYLVMVWRHGEFDV-CYBMUJFWSA-N 2 0 233.359 2.012 20 0 BEADRP COC1(C[NH2+][C@@H]2CCC[C@@H]([NH+](C)C)C2)CCC1 ZINC000715202143 965951024 /nfs/dbraw/zinc/95/10/24/965951024.db2.gz NKDDMZPTKKPWIG-CHWSQXEVSA-N 2 0 240.391 2.018 20 0 BEADRP Cc1cc2[nH]ccc2c(N2CC(C)([NH+](C)C)C2)[nH+]1 ZINC001165118019 965962436 /nfs/dbraw/zinc/96/24/36/965962436.db2.gz ODDSJKZBMPQKAZ-UHFFFAOYSA-N 2 0 244.342 2.012 20 0 BEADRP CC1=C[C@@H](C)[C@@H](CN2CC[C@@H]3[NH2+]CC[C@H]32)CC1 ZINC001235039595 965990517 /nfs/dbraw/zinc/99/05/17/965990517.db2.gz VWBYIUXOKAPWBI-APIJFGDWSA-N 2 0 234.387 2.415 20 0 BEADRP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+][C@@H]2C[C@H]3C[C@H]3C2)C1 ZINC000715238065 965991102 /nfs/dbraw/zinc/99/11/02/965991102.db2.gz ZDKLQCZROABFFU-XVIXHAIJSA-N 2 0 222.376 2.247 20 0 BEADRP CC(C)CCC[N@H+]1C[C@H]2CC[C@@H](C1)[C@@H]2[NH3+] ZINC001235958500 966175813 /nfs/dbraw/zinc/17/58/13/966175813.db2.gz GOXOMTWJIUUTLU-CLLJXQQHSA-N 2 0 210.365 2.092 20 0 BEADRP C1=C[C@@H]2C[C@H]1C[C@H]2C[N@H+]1C[C@@H]2CC[NH2+]CC[C@@H]2C1 ZINC001236314186 966364555 /nfs/dbraw/zinc/36/45/55/966364555.db2.gz JRHCZXFJVHDUKD-NPJQDHAYSA-N 2 0 246.398 2.130 20 0 BEADRP Cc1cnc(C)c(Nc2c[nH+]cn2C)c1 ZINC001203656271 966719076 /nfs/dbraw/zinc/71/90/76/966719076.db2.gz OZWZPEWWLCJKHV-UHFFFAOYSA-N 2 0 202.261 2.176 20 0 BEADRP CCC1(Nc2cccc(C3=[NH+]CCC3)c2)C[NH2+]C1 ZINC001168586464 966943942 /nfs/dbraw/zinc/94/39/42/966943942.db2.gz JJCYLIBXGJOHER-UHFFFAOYSA-N 2 0 243.354 2.433 20 0 BEADRP C[C@H](CCN(C)CC[NH3+])CC(C)(C)C ZINC000162911993 967170792 /nfs/dbraw/zinc/17/07/92/967170792.db2.gz HCOUAELLXZRHSS-LLVKDONJSA-N 2 0 200.370 2.339 20 0 BEADRP Cc1cccnc1C[NH2+]C1CCC([NH+](C)C)CC1 ZINC000715585250 967194115 /nfs/dbraw/zinc/19/41/15/967194115.db2.gz USLMDNFCPVJAAC-UHFFFAOYSA-N 2 0 247.386 2.352 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[N@@H+]2CCC[C@@H]2C2CCCC2)C1 ZINC000693594503 967272600 /nfs/dbraw/zinc/27/26/00/967272600.db2.gz BHEJXARGKAQJQB-KWCYVHTRSA-N 2 0 222.376 2.378 20 0 BEADRP [NH3+]CC1CC[NH+](Cc2cccc3cc[nH]c32)CC1 ZINC001205046723 967302132 /nfs/dbraw/zinc/30/21/32/967302132.db2.gz JYAZNMRRUKBHKL-UHFFFAOYSA-N 2 0 243.354 2.339 20 0 BEADRP Cc1cc(F)cc(C[NH+]2CCC(C[NH3+])CC2)c1 ZINC001205047024 967305037 /nfs/dbraw/zinc/30/50/37/967305037.db2.gz MSXWLRVPHZDLGU-UHFFFAOYSA-N 2 0 236.334 2.305 20 0 BEADRP COc1c(C)cccc1C[NH+]1CCC(C[NH3+])CC1 ZINC001205053927 967307595 /nfs/dbraw/zinc/30/75/95/967307595.db2.gz VOPRGDNIDGDDAP-UHFFFAOYSA-N 2 0 248.370 2.174 20 0 BEADRP Cc1csc(C[N@@H+]2CCC[C@H]([NH3+])CC2)c1 ZINC001205102632 967345005 /nfs/dbraw/zinc/34/50/05/967345005.db2.gz UWUBOUPYXSNAAX-NSHDSACASA-N 2 0 224.373 2.370 20 0 BEADRP Cc1cc(C[N@@H+]2CCC[C@@H]([NH3+])CC2)cc(C)c1O ZINC001205109159 967351483 /nfs/dbraw/zinc/35/14/83/967351483.db2.gz BREWFHNQDBEIHN-CQSZACIVSA-N 2 0 248.370 2.322 20 0 BEADRP Cc1ccc(O)cc1C[N@@H+]1CCC[C@H]([NH3+])CC1 ZINC001205123662 967370887 /nfs/dbraw/zinc/37/08/87/967370887.db2.gz DQQMMZJGHMGMGA-ZDUSSCGKSA-N 2 0 234.343 2.014 20 0 BEADRP CC1(C[N@@H+]2CCC[C@](C)([NH3+])CC2)CCOCC1 ZINC001205255021 967443305 /nfs/dbraw/zinc/44/33/05/967443305.db2.gz DVYXUCYTIQATIO-AWEZNQCLSA-N 2 0 240.391 2.006 20 0 BEADRP Cc1cc(C)c(C[N@@H+]2CCC[C@@](C)([NH3+])CC2)[nH]1 ZINC001205264790 967457233 /nfs/dbraw/zinc/45/72/33/967457233.db2.gz MLKIBCCHLODNGU-CQSZACIVSA-N 2 0 235.375 2.335 20 0 BEADRP Cc1cccc(C[N@@H+]2CCC[C@@](C)([NH3+])CC2)n1 ZINC001205263632 967457793 /nfs/dbraw/zinc/45/77/93/967457793.db2.gz AYQPIZZFEYKWLI-CQSZACIVSA-N 2 0 233.359 2.093 20 0 BEADRP Cc1cc(C)c(C[N@@H+]2CCC[C@@](C)([NH3+])CC2)cn1 ZINC001205289215 967479674 /nfs/dbraw/zinc/47/96/74/967479674.db2.gz UZOILGKDWRIMOF-OAHLLOKOSA-N 2 0 247.386 2.402 20 0 BEADRP Cc1ccc(O)cc1C[N@@H+]1CCC[C@@](C)([NH3+])CC1 ZINC001205296025 967496429 /nfs/dbraw/zinc/49/64/29/967496429.db2.gz DWPANXAHJJLRGJ-OAHLLOKOSA-N 2 0 248.370 2.404 20 0 BEADRP Cc1cc2[nH+]ccn2cc1NCCCC[NH+](C)C ZINC001161730767 967618004 /nfs/dbraw/zinc/61/80/04/967618004.db2.gz GEEISMATYDRIQM-UHFFFAOYSA-N 2 0 246.358 2.396 20 0 BEADRP CSCCC[N@@H+]1CC[C@@H](C)[C@@H](C[NH3+])CC1 ZINC001205603586 967717135 /nfs/dbraw/zinc/71/71/35/967717135.db2.gz QOUFCKSHKPOONP-VXGBXAGGSA-N 2 0 230.421 2.046 20 0 BEADRP C[C@H]1CC[N@H+](CCC(F)(F)F)CC[C@@H]1C[NH3+] ZINC001205601788 967717244 /nfs/dbraw/zinc/71/72/44/967717244.db2.gz GKLZGIBPLFDCLZ-VHSXEESVSA-N 2 0 238.297 2.246 20 0 BEADRP C[C@@H]1CC[N@H+](CC2CCCC2)CC[C@H]1C[NH3+] ZINC001205603036 967717619 /nfs/dbraw/zinc/71/76/19/967717619.db2.gz NDLGWDRBHQXXMY-OCCSQVGLSA-N 2 0 224.392 2.483 20 0 BEADRP C[C@H]1CC[N@H+](CC(C)(C)C)CC[C@H]1C[NH3+] ZINC001205599964 967719116 /nfs/dbraw/zinc/71/91/16/967719116.db2.gz ATMOFOCWWZEMDQ-RYUDHWBXSA-N 2 0 212.381 2.339 20 0 BEADRP CS[C@H](C)CC[N@@H+]1CC[C@@H](C)[C@H](C[NH3+])CC1 ZINC001205602587 967720206 /nfs/dbraw/zinc/72/02/06/967720206.db2.gz KBRQRGRPMILCNH-UPJWGTAASA-N 2 0 244.448 2.435 20 0 BEADRP COC(C)(C)CC[N@@H+]1CCC[C@@H](C[NH3+])[C@@H](C)C1 ZINC001205981916 967919085 /nfs/dbraw/zinc/91/90/85/967919085.db2.gz JBPQENOEYBIOTN-STQMWFEESA-N 2 0 242.407 2.108 20 0 BEADRP Cc1ncccc1C[N@@H+]1CCC[C@H](C[NH3+])[C@@H](C)C1 ZINC001205991431 967938536 /nfs/dbraw/zinc/93/85/36/967938536.db2.gz ASKJQXBHIASASS-GXTWGEPZSA-N 2 0 247.386 2.197 20 0 BEADRP C[C@@H]1CC[N@H+](CCCCCC[NH3+])C[C@H](C)O1 ZINC000694905250 967965953 /nfs/dbraw/zinc/96/59/53/967965953.db2.gz OFTVODGLFRMXLF-OLZOCXBDSA-N 2 0 228.380 2.005 20 0 BEADRP C[C@@H]1C[N@H+](Cc2cccc(N)c2)CCC[C@H]1C[NH3+] ZINC001206013476 967966485 /nfs/dbraw/zinc/96/64/85/967966485.db2.gz ROHKQXXPBVZDSF-OCCSQVGLSA-N 2 0 247.386 2.076 20 0 BEADRP C[C@H]1CCC[C@H]([N@H+](C)C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000693579981 968093121 /nfs/dbraw/zinc/09/31/21/968093121.db2.gz RJVFKKJWQKFCJX-RVMXOQNASA-N 2 0 210.365 2.234 20 0 BEADRP C[C@H](C[NH+](C)C)Nc1ccc([C@H](C)[NH3+])cc1 ZINC001163776849 968117834 /nfs/dbraw/zinc/11/78/34/968117834.db2.gz MVMIZTPBDOHZCQ-MNOVXSKESA-N 2 0 221.348 2.068 20 0 BEADRP Cc1cccc(C)c1C[N@H+]1CCC[NH2+]C[C@@H]1C ZINC001206258350 968180402 /nfs/dbraw/zinc/18/04/02/968180402.db2.gz WWEAEPREZPXZSD-AWEZNQCLSA-N 2 0 232.371 2.487 20 0 BEADRP Cc1cncc(C[N@@H+]2CCC[C@@](C)(C[NH3+])CC2)c1 ZINC001206304977 968215027 /nfs/dbraw/zinc/21/50/27/968215027.db2.gz SJSNMFATYFVCFG-OAHLLOKOSA-N 2 0 247.386 2.341 20 0 BEADRP C[C@]1(C[NH3+])CCC[N@H+](Cc2cccc(N)c2)CC1 ZINC001206317234 968221766 /nfs/dbraw/zinc/22/17/66/968221766.db2.gz DGBVWSGSQSZAMU-HNNXBMFYSA-N 2 0 247.386 2.220 20 0 BEADRP C[C@@]1(C[NH3+])CCC[N@H+](Cc2cnsc2)CC1 ZINC001206318535 968226255 /nfs/dbraw/zinc/22/62/55/968226255.db2.gz QYXPWAHZTNCHAL-GFCCVEGCSA-N 2 0 239.388 2.094 20 0 BEADRP C[C@@]1(C[NH3+])CCC[N@H+](Cc2ccns2)CC1 ZINC001206318563 968226712 /nfs/dbraw/zinc/22/67/12/968226712.db2.gz RHNZKOWRWNYXIZ-GFCCVEGCSA-N 2 0 239.388 2.094 20 0 BEADRP Cc1cnccc1C[N@@H+]1CCCC[C@@](C)(C[NH3+])C1 ZINC001206549589 968374432 /nfs/dbraw/zinc/37/44/32/968374432.db2.gz OZHSEOGGMSPLRZ-HNNXBMFYSA-N 2 0 247.386 2.341 20 0 BEADRP Cc1cnccc1C[N@@H+]1CCCC[C@](C)(C[NH3+])C1 ZINC001206549590 968374680 /nfs/dbraw/zinc/37/46/80/968374680.db2.gz OZHSEOGGMSPLRZ-OAHLLOKOSA-N 2 0 247.386 2.341 20 0 BEADRP Cc1ccnc(C[N@@H+]2CCCC[C@@](C)(C[NH3+])C2)c1 ZINC001206549643 968376261 /nfs/dbraw/zinc/37/62/61/968376261.db2.gz PNKCJMQDRJQDAZ-HNNXBMFYSA-N 2 0 247.386 2.341 20 0 BEADRP C[NH+]1CCC(C[NH+]2C[C@H]3CCCC[C@@H]3C2)CC1 ZINC001207391354 968744931 /nfs/dbraw/zinc/74/49/31/968744931.db2.gz HPHIPUKTJULXPK-HUUCEWRRSA-N 2 0 236.403 2.450 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2CC[C@H]3CCC[C@@H]3C2)CC1 ZINC001207395510 968752091 /nfs/dbraw/zinc/75/20/91/968752091.db2.gz SHCHXBZWVTZPKJ-HUUCEWRRSA-N 2 0 236.403 2.450 20 0 BEADRP C[NH+]1CCC(CC[N@@H+]2C[C@@H]3C[C@@H]3[C@H](F)C2)CC1 ZINC001207481507 968794346 /nfs/dbraw/zinc/79/43/46/968794346.db2.gz JMFFQUXYMSTKJH-MELADBBJSA-N 2 0 240.366 2.008 20 0 BEADRP C[NH+]1CCC(CC[N@@H+]2CCn3cccc3C2)CC1 ZINC001207483097 968799219 /nfs/dbraw/zinc/79/92/19/968799219.db2.gz CZVCVNFVWWXDSV-UHFFFAOYSA-N 2 0 247.386 2.036 20 0 BEADRP CC1(C)CCC[N@H+](C[C@H]2CCCC[NH2+]C2)C1 ZINC000829276674 968830464 /nfs/dbraw/zinc/83/04/64/968830464.db2.gz WSGWTXHCGSLCCI-ZDUSSCGKSA-N 2 0 224.392 2.498 20 0 BEADRP [NH3+][C@H]1CCC[C@H](Nc2cc3[nH]ccc3c[nH+]2)C1 ZINC001154978500 968833011 /nfs/dbraw/zinc/83/30/11/968833011.db2.gz RILGWHWCORXFIX-QWRGUYRKSA-N 2 0 230.315 2.245 20 0 BEADRP C[N@@H+]1CC[C@@H]2C[NH+](C[C@H]3C[C@H]4C=C[C@@H]3C4)C[C@@H]2C1 ZINC001207620063 968836381 /nfs/dbraw/zinc/83/63/81/968836381.db2.gz HMJCRRCXOUHDCZ-GCSSGZNBSA-N 2 0 246.398 2.082 20 0 BEADRP C[NH+](C)CCC[N@H+](C)C[C@@H]1C[C@H]2C=C[C@@H]1C2 ZINC001207616191 968837174 /nfs/dbraw/zinc/83/71/74/968837174.db2.gz UHRJAZNSVAYTQX-MJBXVCDLSA-N 2 0 222.376 2.082 20 0 BEADRP C[NH+](C)CCC[N@H+](C)C[C@H]1C[C@H]2C=C[C@@H]1C2 ZINC001207616190 968838700 /nfs/dbraw/zinc/83/87/00/968838700.db2.gz UHRJAZNSVAYTQX-BFHYXJOUSA-N 2 0 222.376 2.082 20 0 BEADRP C[N@H+](C[C@@H]1C[C@H]2C=C[C@@H]1C2)CC1CC[NH+](C)CC1 ZINC001207626419 968841742 /nfs/dbraw/zinc/84/17/42/968841742.db2.gz FCCXXHNSCUBALW-XHSDSOJGSA-N 2 0 248.414 2.472 20 0 BEADRP CC[N@H+]1C[C@@H]2C[NH+](C[C@@H]3C[C@H]4C=C[C@@H]3C4)C[C@@H]2C1 ZINC001207633791 968851040 /nfs/dbraw/zinc/85/10/40/968851040.db2.gz AHMDPMKVRROYAA-XFIYOXNOSA-N 2 0 246.398 2.082 20 0 BEADRP CC[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)C2CC2)C1 ZINC000165277919 968867547 /nfs/dbraw/zinc/86/75/47/968867547.db2.gz HZTREZVDQLQLLN-RYUDHWBXSA-N 2 0 210.365 2.106 20 0 BEADRP Cc1ccc(CCC[N@@H+](C)CCC[NH+](C)C)o1 ZINC001207937454 968937479 /nfs/dbraw/zinc/93/74/79/968937479.db2.gz KCFKSDPPOOHCOV-UHFFFAOYSA-N 2 0 238.375 2.404 20 0 BEADRP C[N@H+]1CC=C(c2ccc3[nH]cc(C[NH3+])c3c2)CC1 ZINC001241331378 968977846 /nfs/dbraw/zinc/97/78/46/968977846.db2.gz ADYNSWHQAKNMDD-UHFFFAOYSA-N 2 0 241.338 2.346 20 0 BEADRP CC(C)C[N@H+](C)CC1(C)CC[NH+](C)CC1 ZINC001208105515 969000492 /nfs/dbraw/zinc/00/04/92/969000492.db2.gz WGUQRBPCMSXABB-UHFFFAOYSA-N 2 0 212.381 2.306 20 0 BEADRP c1cc(N2CC[NH2+]CC2)cc(C2=CCCCC2)[nH+]1 ZINC001241716146 969095712 /nfs/dbraw/zinc/09/57/12/969095712.db2.gz BSSVJBCYCBIKRH-UHFFFAOYSA-N 2 0 243.354 2.449 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH+]2CCCC(F)(F)CC2)C1 ZINC001208604160 969155362 /nfs/dbraw/zinc/15/53/62/969155362.db2.gz LTBXETHRTYDYNW-GFCCVEGCSA-N 2 0 246.345 2.449 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH+]2CC[C@@H]3CCC[C@@H]3C2)C1 ZINC001208605181 969156905 /nfs/dbraw/zinc/15/69/05/969156905.db2.gz AJMCXDZMFNZIRN-SOUVJXGZSA-N 2 0 236.403 2.450 20 0 BEADRP CSC1CC[NH+](C[C@@H]2CCC[N@H+](C)C2)CC1 ZINC001208608005 969161909 /nfs/dbraw/zinc/16/19/09/969161909.db2.gz FAZZEKWGUOECHP-GFCCVEGCSA-N 2 0 242.432 2.156 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH+]2C[C@@H]3CCCC[C@@H]3C2)C1 ZINC001208608728 969163330 /nfs/dbraw/zinc/16/33/30/969163330.db2.gz WJGJKNNQKBKVAA-SOUVJXGZSA-N 2 0 236.403 2.450 20 0 BEADRP CCC[N@H+](CCC[NH+](C)C)CCC1CC1 ZINC001208686647 969195601 /nfs/dbraw/zinc/19/56/01/969195601.db2.gz ONVVNKVBKLBQAW-UHFFFAOYSA-N 2 0 212.381 2.450 20 0 BEADRP Cc1cccc2c1[nH+]c(N)n2C1=CC[N@H+](C)CC1 ZINC001208717933 969203936 /nfs/dbraw/zinc/20/39/36/969203936.db2.gz HVNZQUXQFNMQMD-UHFFFAOYSA-N 2 0 242.326 2.103 20 0 BEADRP Cc1cc(C[N@@H+]2CCC[C@@H](C[NH3+])[C@H](C)C2)ccn1 ZINC001205991616 969209221 /nfs/dbraw/zinc/20/92/21/969209221.db2.gz BCMLJZUQJNZGKH-DOMZBBRYSA-N 2 0 247.386 2.197 20 0 BEADRP CC(C)CCC[NH+]1CCC2(C[NH+](C)C2)CC1 ZINC001208736162 969229182 /nfs/dbraw/zinc/22/91/82/969229182.db2.gz DDWAEECYECZSEL-UHFFFAOYSA-N 2 0 224.392 2.450 20 0 BEADRP C[C@H]1C[N@H+](Cc2cccc(O)c2)CCC[C@H]1C[NH3+] ZINC001205994860 969251184 /nfs/dbraw/zinc/25/11/84/969251184.db2.gz MRXXEWXQTKUXRF-JSGCOSHPSA-N 2 0 248.370 2.199 20 0 BEADRP CCC[N@H+](CCC[NH+](C)C)C[C@H](O)C(C)(C)C ZINC001253731965 969353900 /nfs/dbraw/zinc/35/39/00/969353900.db2.gz ZNXKXPCDBUPNNZ-ZDUSSCGKSA-N 2 0 244.423 2.057 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]C[C@@H]1CCC[C@H]1F)C2 ZINC001169080378 969403025 /nfs/dbraw/zinc/40/30/25/969403025.db2.gz MWUXDOJWBLKYPA-PDWCTOEPSA-N 2 0 240.366 2.339 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+][C@@H]1CCC(F)(F)C1)C2 ZINC001169081777 969403164 /nfs/dbraw/zinc/40/31/64/969403164.db2.gz WHIMNTJBEJATAL-WISYIIOYSA-N 2 0 244.329 2.389 20 0 BEADRP C[C@@H]1CCC[N@@H+]([C@H]2C[C@H]3CC[C@@H](C2)[NH+]3C)C1 ZINC001169123421 969422156 /nfs/dbraw/zinc/42/21/56/969422156.db2.gz LGOKUHAUQIJXDM-MQYQWHSLSA-N 2 0 222.376 2.344 20 0 BEADRP CC1CC([N@H+](C)[C@@H]2C[C@H]3CC[C@@H](C2)[NH+]3C)C1 ZINC001169126119 969428008 /nfs/dbraw/zinc/42/80/08/969428008.db2.gz PVYJTFAQSVDXSE-RLILJNEXSA-N 2 0 222.376 2.342 20 0 BEADRP CC[C@H](C)[N@H+](C)[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169130911 969439592 /nfs/dbraw/zinc/43/95/92/969439592.db2.gz PWAGAJCAABTMGH-RVMXOQNASA-N 2 0 210.365 2.342 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CC3(C1)CCCC3)C2 ZINC001169129860 969439846 /nfs/dbraw/zinc/43/98/46/969439846.db2.gz KYWOUGLHXMCYIC-WDNDVIMCSA-N 2 0 234.387 2.488 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+][C@@H]1C=CCCC1)C2 ZINC001169115281 969455343 /nfs/dbraw/zinc/45/53/43/969455343.db2.gz ICHMIQQWVOQYMS-SYQHCUMBSA-N 2 0 220.360 2.310 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1C[C@H]3CC[C@@H]1C3)C2 ZINC001169148088 969463329 /nfs/dbraw/zinc/46/33/29/969463329.db2.gz YJLZGUKQTQBEGS-ODXJTPSBSA-N 2 0 220.360 2.096 20 0 BEADRP CCN1CCC([NH+]2C[C@H]3CCC[C@@H]3C2)CC1 ZINC001169246677 969536981 /nfs/dbraw/zinc/53/69/81/969536981.db2.gz UOVRTILIAQFLPG-CHWSQXEVSA-N 2 0 222.376 2.203 20 0 BEADRP CCN1CCC([N@H+]2C[C@H](C)C[C@H](C)C2)CC1 ZINC001169261193 969546175 /nfs/dbraw/zinc/54/61/75/969546175.db2.gz COGMJGNCZWRSPO-BETUJISGSA-N 2 0 224.392 2.449 20 0 BEADRP C[N@H+]1C[C@@H]2C[NH+](C3CCC(F)(F)CC3)C[C@@H]2C1 ZINC001254224780 969549226 /nfs/dbraw/zinc/54/92/26/969549226.db2.gz AIXUGROFIWHNPH-PHIMTYICSA-N 2 0 244.329 2.058 20 0 BEADRP Cc1ccc(C[N@H+]2CCC3(C2)CC[NH+](C)CC3)[nH]1 ZINC001209574805 969558519 /nfs/dbraw/zinc/55/85/19/969558519.db2.gz VNJMOAZQEAPTAR-UHFFFAOYSA-N 2 0 247.386 2.241 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH2+][C@H]2CC[C@@H](F)CC2)CC1 ZINC001254496961 969659324 /nfs/dbraw/zinc/65/93/24/969659324.db2.gz BKNQMQOUYUNDFD-RWMBFGLXSA-N 2 0 228.355 2.341 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH2+]C[C@@H]2CC[C@@H](F)C2)CC1 ZINC001254497632 969660008 /nfs/dbraw/zinc/66/00/08/969660008.db2.gz LUQLVJDLVBIWTK-UPJWGTAASA-N 2 0 228.355 2.199 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH2+]C[C@@H]2CCC(F)(F)C2)CC1 ZINC001254499210 969660088 /nfs/dbraw/zinc/66/00/88/969660088.db2.gz COOIREBYZWWATD-VXGBXAGGSA-N 2 0 246.345 2.496 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH2+]C(C)(C)c2cccnc2)CC1 ZINC001254498159 969661114 /nfs/dbraw/zinc/66/11/14/969661114.db2.gz TXYZGSVAIPFSED-AWEZNQCLSA-N 2 0 247.386 2.391 20 0 BEADRP C[N@H+](C1CC(F)(F)C1)[C@H]1CCC[NH+](C)CC1 ZINC001254515840 969688424 /nfs/dbraw/zinc/68/84/24/969688424.db2.gz DXEIFRFNCRHOJY-JTQLQIEISA-N 2 0 232.318 2.200 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH+]2CCC(C)(F)CC2)CC1 ZINC001254516165 969689001 /nfs/dbraw/zinc/68/90/01/969689001.db2.gz JKXPPGKGGDFKLX-LBPRGKRZSA-N 2 0 228.355 2.295 20 0 BEADRP CC1CC([N@H+](C)[C@H]2CCC[NH+](C)CC2)C1 ZINC001254517238 969696748 /nfs/dbraw/zinc/69/67/48/969696748.db2.gz SOFLMXVDLFWUNY-CPCZMJQVSA-N 2 0 210.365 2.201 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH+]2CCC23CCCC3)CC1 ZINC001254520688 969703326 /nfs/dbraw/zinc/70/33/26/969703326.db2.gz PGFFFOPLYLCTIX-ZDUSSCGKSA-N 2 0 222.376 2.489 20 0 BEADRP C[N@H+](CC1CCC1)[C@H]1CCC[NH+](C)CC1 ZINC001254522189 969706425 /nfs/dbraw/zinc/70/64/25/969706425.db2.gz DOBKPESONSXYBD-ZDUSSCGKSA-N 2 0 210.365 2.203 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH+]2C3CCC2CC3)CC1 ZINC001254523361 969712622 /nfs/dbraw/zinc/71/26/22/969712622.db2.gz OLVLLZXVEPZPAK-PNESKVBLSA-N 2 0 208.349 2.098 20 0 BEADRP Cc1cc(N(C)C)[nH+]cc1NCC[C@H]1CCC[NH2+]1 ZINC001169564577 969763192 /nfs/dbraw/zinc/76/31/92/969763192.db2.gz RGLZSHAACQAYNB-GFCCVEGCSA-N 2 0 248.374 2.010 20 0 BEADRP [NH3+]Cc1cccc(N[C@@H]2CC3CC[NH+](CC3)C2)c1 ZINC001254836899 969798638 /nfs/dbraw/zinc/79/86/38/969798638.db2.gz PRWZUXGCFWRTDP-OAHLLOKOSA-N 2 0 245.370 2.042 20 0 BEADRP Cc1cc(NC(C)(C)CC[NH+](C)C)cc(C)[nH+]1 ZINC001169717418 969832539 /nfs/dbraw/zinc/83/25/39/969832539.db2.gz FMIGSIGLMWDUEA-UHFFFAOYSA-N 2 0 235.375 2.263 20 0 BEADRP C[C@H](C[NH2+]C1CCOCC1)CC(C)(C)CC[NH3+] ZINC001255036366 969850359 /nfs/dbraw/zinc/85/03/59/969850359.db2.gz YKDUFCUHRMZIGY-LBPRGKRZSA-N 2 0 242.407 2.156 20 0 BEADRP CC(C)[N@H+](C1CCOCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001255034693 969857975 /nfs/dbraw/zinc/85/79/75/969857975.db2.gz LIKOVRXMFUDXPL-JOCQHMNTSA-N 2 0 240.391 2.146 20 0 BEADRP C[NH+](C)CC1CC[NH+](C2CCSCC2)CC1 ZINC001255093524 969928424 /nfs/dbraw/zinc/92/84/24/969928424.db2.gz UXAJHEBMTYCCIY-UHFFFAOYSA-N 2 0 242.432 2.156 20 0 BEADRP C[C@@H](C[NH2+][C@H]1CCSC1)CC(C)(C)CC[NH3+] ZINC001255275600 970024695 /nfs/dbraw/zinc/02/46/95/970024695.db2.gz ZSYROAXYRUBFPH-NEPJUHHUSA-N 2 0 244.448 2.483 20 0 BEADRP [NH3+]CCC[C@H]1CCCC[N@@H+]([C@H]2CCSC2)C1 ZINC001255280325 970032218 /nfs/dbraw/zinc/03/22/18/970032218.db2.gz YYUDMKSOSWSDCI-OLZOCXBDSA-N 2 0 242.432 2.333 20 0 BEADRP Cc1cc2cc(C[NH3+])ccc2n1[C@H]1CC[N@@H+](C)C1 ZINC001255414126 970133845 /nfs/dbraw/zinc/13/38/45/970133845.db2.gz QLBXUFAQEQESJX-AWEZNQCLSA-N 2 0 243.354 2.285 20 0 BEADRP C[NH2+]Cc1cccc(Nc2cc[nH+]cc2C)c1 ZINC001211134284 970159245 /nfs/dbraw/zinc/15/92/45/970159245.db2.gz HSWMHAGKXMWJGD-UHFFFAOYSA-N 2 0 227.311 2.275 20 0 BEADRP C[N@@H+]1CCC[C@H](n2ccc3ccc(C[NH3+])cc32)C1 ZINC001255470712 970198601 /nfs/dbraw/zinc/19/86/01/970198601.db2.gz OXFNCMLGWJMFGJ-AWEZNQCLSA-N 2 0 243.354 2.367 20 0 BEADRP COc1c[nH+]ccc1Nc1ccc(C)nc1C ZINC001211258256 970202529 /nfs/dbraw/zinc/20/25/29/970202529.db2.gz WJOAMVWDZNHWPL-UHFFFAOYSA-N 2 0 229.283 2.268 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3C)C1 ZINC001170098023 970269401 /nfs/dbraw/zinc/26/94/01/970269401.db2.gz JSPHJAIIQVNIML-XGFWRYKXSA-N 2 0 222.376 2.390 20 0 BEADRP C[NH+](C)CCC(C)(C)[NH2+][C@H]1CCOC(C)(C)C1 ZINC001255528497 970291716 /nfs/dbraw/zinc/29/17/16/970291716.db2.gz OOUGBBJIJSYJBL-LBPRGKRZSA-N 2 0 242.407 2.264 20 0 BEADRP Fc1cc(C2=CC[NH2+]C2)ccc1[C@H]1CCC[NH2+]1 ZINC001243111519 970354980 /nfs/dbraw/zinc/35/49/80/970354980.db2.gz QOSDFRCRDVIHAP-CQSZACIVSA-N 2 0 232.302 2.237 20 0 BEADRP COC[C@@H](C)[N@H+](C(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001255563787 970355493 /nfs/dbraw/zinc/35/54/93/970355493.db2.gz YIERISSPWMMSOO-JHJVBQTASA-N 2 0 228.380 2.002 20 0 BEADRP C[C@@H](CC(F)(F)F)[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC001255632986 970404167 /nfs/dbraw/zinc/40/41/67/970404167.db2.gz HHWRWHNIUYVHAH-XHNCKOQMSA-N 2 0 224.270 2.187 20 0 BEADRP C[C@@H](CC(F)(F)F)[NH2+]C(C)(C)C(C)(C)[NH3+] ZINC001255639360 970413548 /nfs/dbraw/zinc/41/35/48/970413548.db2.gz KKGAVJFXBZBZEH-ZETCQYMHSA-N 2 0 226.286 2.433 20 0 BEADRP C[C@@H](C[NH3+])C[N@H+](C)[C@@H](C)Cc1ccccc1F ZINC001255841327 970510247 /nfs/dbraw/zinc/51/02/47/970510247.db2.gz RTIAIMVEZPOHGW-RYUDHWBXSA-N 2 0 238.350 2.283 20 0 BEADRP C[C@H](C[NH3+])C[N@H+](C)[C@@H](C)Cc1ccccc1F ZINC001255841325 970514043 /nfs/dbraw/zinc/51/40/43/970514043.db2.gz RTIAIMVEZPOHGW-NEPJUHHUSA-N 2 0 238.350 2.283 20 0 BEADRP CSC[C@@H]1CCC[N@@H+]1C[C@]1(C)CCC[NH2+]C1 ZINC000400130858 970548653 /nfs/dbraw/zinc/54/86/53/970548653.db2.gz SBEGGUXVCUMSGP-QWHCGFSZSA-N 2 0 242.432 2.204 20 0 BEADRP [NH3+]C[C@H]1CC[N@H+](C[C@H]2CC3CCC2CC3)C1 ZINC000400131570 970552347 /nfs/dbraw/zinc/55/23/47/970552347.db2.gz VGFZHIKAIFMQNU-FKZOYECMSA-N 2 0 222.376 2.093 20 0 BEADRP CC[C@@H]1C[C@H]([NH2+]C(C)(C)C(C)(C)[NH3+])CCO1 ZINC001170183389 970560691 /nfs/dbraw/zinc/56/06/91/970560691.db2.gz RIXNQZBNKMOOBA-GHMZBOCLSA-N 2 0 228.380 2.050 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]CCc1ccncc1 ZINC001255939736 970569927 /nfs/dbraw/zinc/56/99/27/970569927.db2.gz INTVIRGWSKGCIV-AWEZNQCLSA-N 2 0 249.402 2.334 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]CCc1cccnc1 ZINC001255940850 970571565 /nfs/dbraw/zinc/57/15/65/970571565.db2.gz HLUBXVFVWRPAIB-AWEZNQCLSA-N 2 0 249.402 2.334 20 0 BEADRP C[C@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)c1ccco1 ZINC000400325917 970572179 /nfs/dbraw/zinc/57/21/79/970572179.db2.gz AHZJFLDICDRAML-QWRGUYRKSA-N 2 0 222.332 2.318 20 0 BEADRP C[C@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)c1ccccn1 ZINC000400317502 970574929 /nfs/dbraw/zinc/57/49/29/970574929.db2.gz ANFRKGIOBDOARF-RYUDHWBXSA-N 2 0 233.359 2.120 20 0 BEADRP CC[C@H](C)[C@@H](C)[NH2+][C@H](C)C1CC[NH2+]CC1 ZINC000400335791 970576603 /nfs/dbraw/zinc/57/66/03/970576603.db2.gz FYIWMLOGRPXATH-QJPTWQEYSA-N 2 0 212.381 2.399 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]CC1(CC)COC1 ZINC001255944913 970577385 /nfs/dbraw/zinc/57/73/85/970577385.db2.gz HWHCZIXORWQYLD-CYBMUJFWSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@@H]([NH2+][C@H](C)C1CC[NH2+]CC1)C1CCC1 ZINC000400335976 970578913 /nfs/dbraw/zinc/57/89/13/970578913.db2.gz AFSIUSSOHYEWBC-GHMZBOCLSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@@H]([NH2+][C@H](C)C1CC[NH2+]CC1)C1CC1 ZINC000400357175 970581479 /nfs/dbraw/zinc/58/14/79/970581479.db2.gz BSZRKEOMWADBLR-ZWNOBZJWSA-N 2 0 210.365 2.153 20 0 BEADRP COc1ccccc1C[NH2+][C@H](C)C1CC[NH2+]CC1 ZINC000400440314 970588458 /nfs/dbraw/zinc/58/84/58/970588458.db2.gz MHTOJMGRWYATDR-GFCCVEGCSA-N 2 0 248.370 2.173 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCC[C@H]1C)C1CC[NH2+]CC1 ZINC000400500190 970595822 /nfs/dbraw/zinc/59/58/22/970595822.db2.gz BVNWPNDAYIYWQZ-WZRBSPASSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H](C[NH2+][C@@H](C)[C@H]1CCC[NH2+]1)C(C)(C)C ZINC000400480480 970596887 /nfs/dbraw/zinc/59/68/87/970596887.db2.gz FMSLVYFCBGGEGV-SDDRHHMPSA-N 2 0 212.381 2.399 20 0 BEADRP CC[C@@H]1C[C@@H]([N@H+](CC)CCC[NH+](C)C)CCO1 ZINC001170238947 970615523 /nfs/dbraw/zinc/61/55/23/970615523.db2.gz LJMXGNAMYNBNQR-UONOGXRCSA-N 2 0 242.407 2.218 20 0 BEADRP C[NH+]1CC(CNc2ccc([C@@H]3CCC[NH2+]3)cc2)C1 ZINC001170253927 970659381 /nfs/dbraw/zinc/65/93/81/970659381.db2.gz FJWYTDHXYJXYCB-HNNXBMFYSA-N 2 0 245.370 2.085 20 0 BEADRP C[NH+]1CCC([NH+]2CCC3(CC(F)C3)CC2)CC1 ZINC001256202478 970702651 /nfs/dbraw/zinc/70/26/51/970702651.db2.gz FIPKWYVSFWWXPP-UHFFFAOYSA-N 2 0 240.366 2.295 20 0 BEADRP Cc1sccc1C[NH+]1CCC(F)(C[NH3+])CC1 ZINC001222552629 972563165 /nfs/dbraw/zinc/56/31/65/972563165.db2.gz HFEXFOVTMNVHFB-UHFFFAOYSA-N 2 0 242.363 2.319 20 0 BEADRP C[C@@H]1CC[C@@H]([N@@H+]2CCC[C@@](C)([NH3+])CC2)C1 ZINC001246549972 972701416 /nfs/dbraw/zinc/70/14/16/972701416.db2.gz IXCDXLRHZATUQO-JHJVBQTASA-N 2 0 210.365 2.378 20 0 BEADRP Cc1cccc2c1CC[N@@H+]([C@@H]1CC[NH2+][C@H](C)C1)C2 ZINC001246550316 972704826 /nfs/dbraw/zinc/70/48/26/972704826.db2.gz VIXGTXCIWCJFAA-UKRRQHHQSA-N 2 0 244.382 2.494 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@@H](C)CCc1ccco1 ZINC001327840255 972753135 /nfs/dbraw/zinc/75/31/35/972753135.db2.gz NIHHZPSMZQRNJA-RYUDHWBXSA-N 2 0 224.348 2.188 20 0 BEADRP C[C@H](CC1CC1)[N@@H+]1CCC[C@@H](C[NH3+])[C@H](C)C1 ZINC001246566885 972817871 /nfs/dbraw/zinc/81/78/71/972817871.db2.gz JVMNQNOJMLNGTE-BZPMIXESSA-N 2 0 224.392 2.482 20 0 BEADRP CC(C)([NH3+])CNc1cc[nH+]cc1-c1ccccc1 ZINC001171193401 972845024 /nfs/dbraw/zinc/84/50/24/972845024.db2.gz XHHSNRUBBDQCND-UHFFFAOYSA-N 2 0 241.338 2.320 20 0 BEADRP CC(C)([NH3+])CNc1ccc([C@@H]2CCC[NH2+]C2)cc1 ZINC001171194424 972847355 /nfs/dbraw/zinc/84/73/55/972847355.db2.gz MKQRIWANUDQIMG-CYBMUJFWSA-N 2 0 247.386 2.303 20 0 BEADRP CC(C)([NH3+])CNc1cc[nH+]c(N2CCCCC2)c1 ZINC001171196114 972853334 /nfs/dbraw/zinc/85/33/34/972853334.db2.gz RTCXBLIQPMLAQL-UHFFFAOYSA-N 2 0 248.374 2.221 20 0 BEADRP C[C@]1(C[NH3+])CCC[N@@H+]([C@H]2C[C@H]3C[C@H]3C2)CC1 ZINC001246577790 972894302 /nfs/dbraw/zinc/89/43/02/972894302.db2.gz PPYPWULJAVSTJH-DGAVXFQQSA-N 2 0 222.376 2.236 20 0 BEADRP C[C@]1(C[NH3+])CCCC[N@@H+]([C@@H]2CCCSC2)C1 ZINC001246583905 972950581 /nfs/dbraw/zinc/95/05/81/972950581.db2.gz LRGMKILJWLNENE-CHWSQXEVSA-N 2 0 242.432 2.333 20 0 BEADRP C[C@H](Cc1ccncc1)[N@@H+]1CCCC[C@H](C[NH3+])C1 ZINC001246590584 973000085 /nfs/dbraw/zinc/00/00/85/973000085.db2.gz HHTRHMIAFNEUCN-UKRRQHHQSA-N 2 0 247.386 2.073 20 0 BEADRP CCC[C@@H](C)CC[C@H](C)[N@H+]1C[C@@H]2[C@H]([NH3+])[C@@H]2C1 ZINC001246665976 973074854 /nfs/dbraw/zinc/07/48/54/973074854.db2.gz VOMDTPRPHJXJAN-XHJNMGKDSA-N 2 0 224.392 2.480 20 0 BEADRP CCc1ccc(C[C@@H](C)[N@H+]2C[C@@H]3[C@@H]([NH3+])[C@@H]3C2)cc1 ZINC001246661455 973075457 /nfs/dbraw/zinc/07/54/57/973075457.db2.gz XPUHYORMDQDULT-FWYOQMDTSA-N 2 0 244.382 2.069 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[C@H]2[C@@H](C1)C2(F)F ZINC001328614219 973192774 /nfs/dbraw/zinc/19/27/74/973192774.db2.gz CIUCDBGMAXYPJK-MJDLHHQISA-N 2 0 244.329 2.137 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]C[C@@H]1CCCC[C@@H]1C ZINC001328676850 973222844 /nfs/dbraw/zinc/22/28/44/973222844.db2.gz HVBMQZMTSGLGTQ-XQQFMLRXSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H]1CC[C@@H]([N@@H+]2C[C@H]3CC[C@@H](C2)[NH2+]C3)C[C@H]1C ZINC001246870042 973243875 /nfs/dbraw/zinc/24/38/75/973243875.db2.gz YDIUWPDLKVJLOP-NIFZNCRKSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2C[C@H]3CC[C@@H](C2)[NH2+]C3)C[C@H]1C ZINC001246870040 973244360 /nfs/dbraw/zinc/24/43/60/973244360.db2.gz YDIUWPDLKVJLOP-MRLBHPIUSA-N 2 0 236.403 2.495 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]Cc1ccc(C)s1 ZINC001328677711 973261374 /nfs/dbraw/zinc/26/13/74/973261374.db2.gz STXMSOZUOHITEE-VIFPVBQESA-N 2 0 212.362 2.144 20 0 BEADRP C[C@@H]1CC[C@H]([NH+]2CC3CCC(CC3)C2)C[NH2+]1 ZINC001246881787 973290039 /nfs/dbraw/zinc/29/00/39/973290039.db2.gz JCNKGSVZDFHVCG-RYSNWHEDSA-N 2 0 222.376 2.249 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H](C)c1ccc2c(c1)CCO2 ZINC001329022302 973435316 /nfs/dbraw/zinc/43/53/16/973435316.db2.gz CZSGLWPFAORSAK-RYUDHWBXSA-N 2 0 248.370 2.128 20 0 BEADRP C[C@H]([NH2+]CCCC[NH3+])c1ccc(Cl)nc1 ZINC001329025145 973439586 /nfs/dbraw/zinc/43/95/86/973439586.db2.gz ZFQRGCCRUKLKME-VIFPVBQESA-N 2 0 227.739 2.125 20 0 BEADRP C1[NH2+][C@H]2C[N@@H+](C3CCC4(CCCC4)CC3)C[C@H]12 ZINC001246913952 973443082 /nfs/dbraw/zinc/44/30/82/973443082.db2.gz BQANWVOZPFQZJG-JSGCOSHPSA-N 2 0 234.387 2.393 20 0 BEADRP CCC[C@@H](CC)[N@H+]1C[C@@H]2CC[NH2+]CC[C@@H]2C1 ZINC001246935408 973612380 /nfs/dbraw/zinc/61/23/80/973612380.db2.gz VDCBVLSCNVUNNM-HZSPNIEDSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC2(C)CC(F)(F)C2)CC[NH2+]1 ZINC000720921527 973637650 /nfs/dbraw/zinc/63/76/50/973637650.db2.gz CTDCGGVNXWTWDL-NXEZZACHSA-N 2 0 232.318 2.152 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+]C[C@@H](C)C(C)(C)C ZINC000234787615 973758298 /nfs/dbraw/zinc/75/82/98/973758298.db2.gz BNNIEYHEPRVQCF-NEPJUHHUSA-N 2 0 230.396 2.012 20 0 BEADRP [NH3+]CC1CCC([NH2+]CC[C@@H]2CCCS2)CC1 ZINC001329799833 973940032 /nfs/dbraw/zinc/94/00/32/973940032.db2.gz KTPFHNQHOZRWRD-BPCQOVAHSA-N 2 0 242.432 2.379 20 0 BEADRP CC(C)[N@@H+]1CCC[C@H](OCCCC[NH+](C)C)C1 ZINC001224991613 974122453 /nfs/dbraw/zinc/12/24/53/974122453.db2.gz XIBNKMZKUBVVLM-AWEZNQCLSA-N 2 0 242.407 2.218 20 0 BEADRP C[NH+](C)CCCCOC1CCC([NH+](C)C)CC1 ZINC001224991697 974122677 /nfs/dbraw/zinc/12/26/77/974122677.db2.gz YXGGZHCEEHOEPW-UHFFFAOYSA-N 2 0 242.407 2.218 20 0 BEADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]CCc1ccco1)C2 ZINC001172103749 974368557 /nfs/dbraw/zinc/36/85/57/974368557.db2.gz XGRRFIUXNAWAET-ZSOGYDGISA-N 2 0 248.370 2.427 20 0 BEADRP CN1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCCCC1)C2 ZINC001172109426 974373781 /nfs/dbraw/zinc/37/37/81/974373781.db2.gz DCDOFSFFAWXRSA-BTTYYORXSA-N 2 0 222.376 2.488 20 0 BEADRP C[C@@H]1C[N@@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3C)C[C@@H]1F ZINC001172117374 974382695 /nfs/dbraw/zinc/38/26/95/974382695.db2.gz GMUVBRSUCUXINJ-RGDJUOJXSA-N 2 0 240.366 2.292 20 0 BEADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CC3(CCC3)C1)C2 ZINC001172121432 974391579 /nfs/dbraw/zinc/39/15/79/974391579.db2.gz QMYGBPWIAFJEHS-BTTYYORXSA-N 2 0 234.387 2.488 20 0 BEADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC[C@@H](F)C1)C2 ZINC001172120901 974391611 /nfs/dbraw/zinc/39/16/11/974391611.db2.gz GZWXUWAHQONBCM-MQYQWHSLSA-N 2 0 240.366 2.436 20 0 BEADRP CC1(C)C[C@@H]([NH2+]CCCC[NH+]2CCCC2)CO1 ZINC001172269823 974486708 /nfs/dbraw/zinc/48/67/08/974486708.db2.gz IHNUCNDMCJFZDD-CYBMUJFWSA-N 2 0 240.391 2.020 20 0 BEADRP CCOCC[C@@H](C)[NH2+][C@H]1CC[C@H]([NH+](C)C)CC1 ZINC001172413597 974680123 /nfs/dbraw/zinc/68/01/23/974680123.db2.gz BMDHQKSAFQCBGY-MGPQQGTHSA-N 2 0 242.407 2.264 20 0 BEADRP CCOCC[C@H](C)[N@H+](CC)CCn1ccnc1 ZINC001172426903 974704380 /nfs/dbraw/zinc/70/43/80/974704380.db2.gz JKIYZZOWGLUDTL-ZDUSSCGKSA-N 2 0 239.363 2.020 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+]CCc1ccc(F)cc1F ZINC001331419314 974712488 /nfs/dbraw/zinc/71/24/88/974712488.db2.gz QCUMDANPKUOMEV-CYBMUJFWSA-N 2 0 242.313 2.080 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]Cc1cccc(C)c1 ZINC001331417479 974713282 /nfs/dbraw/zinc/71/32/82/974713282.db2.gz BJDUPXGPDCDXAW-GFCCVEGCSA-N 2 0 206.333 2.083 20 0 BEADRP CC(C)OCC[C@H](C)[NH2+]CCC[NH+]1CCCC1 ZINC001172431216 974713679 /nfs/dbraw/zinc/71/36/79/974713679.db2.gz LEPZBKQNERROHO-AWEZNQCLSA-N 2 0 242.407 2.266 20 0 BEADRP CC[C@H](CC(C)C)[N@H+](C)C[C@H](C)C[NH3+] ZINC001172394490 974746673 /nfs/dbraw/zinc/74/66/73/974746673.db2.gz VKQXHTTWFXWJOA-VXGBXAGGSA-N 2 0 200.370 2.338 20 0 BEADRP CC[C@H](CC(C)C)[N@H+](C)C[C@@H](C)C[NH3+] ZINC001172394488 974747811 /nfs/dbraw/zinc/74/78/11/974747811.db2.gz VKQXHTTWFXWJOA-NWDGAFQWSA-N 2 0 200.370 2.338 20 0 BEADRP CC(C)OCC[C@@H](C)[NH2+]CC[C@H]1CCC[N@@H+]1C ZINC001172440656 974798307 /nfs/dbraw/zinc/79/83/07/974798307.db2.gz IHOPEHQWXLYPJK-ZIAGYGMSSA-N 2 0 242.407 2.264 20 0 BEADRP C[C@H]([NH3+])C[N@@H+]1CC[C@@H](C)[C@@H]1c1ccccc1 ZINC001331707934 974799739 /nfs/dbraw/zinc/79/97/39/974799739.db2.gz XVOMXVDFVVOXKI-MBNYWOFBSA-N 2 0 218.344 2.417 20 0 BEADRP C[C@H]([NH3+])C[N@@H+]1CC[C@@H](C)[C@H]1c1ccccc1 ZINC001331707933 974800151 /nfs/dbraw/zinc/80/01/51/974800151.db2.gz XVOMXVDFVVOXKI-DYEKYZERSA-N 2 0 218.344 2.417 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)[C@H](C)CCOC(C)C ZINC001172455563 974819334 /nfs/dbraw/zinc/81/93/34/974819334.db2.gz VPZAICIFSHCOEK-CQSZACIVSA-N 2 0 244.423 2.464 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@H]([NH3+])[C@@H](F)CC2)s1 ZINC001206165323 974831253 /nfs/dbraw/zinc/83/12/53/974831253.db2.gz NISARWPKDXUQBF-RYUDHWBXSA-N 2 0 242.363 2.318 20 0 BEADRP [NH3+]C1CC([NH2+][C@@H]2CC[C@@H](c3ccccc3)C2)C1 ZINC001172561686 974869324 /nfs/dbraw/zinc/86/93/24/974869324.db2.gz XXWGUSYPGTWCGP-FEWQNLEASA-N 2 0 230.355 2.402 20 0 BEADRP CC(C)(C[NH3+])[NH2+]C1CC(C)(C)OC(C)(C)C1 ZINC001172644560 974893836 /nfs/dbraw/zinc/89/38/36/974893836.db2.gz TZLLFHGPTMEASK-UHFFFAOYSA-N 2 0 228.380 2.050 20 0 BEADRP COc1cc(C[NH2+]CCC(C)(C)[NH3+])ccc1F ZINC001331982062 974902041 /nfs/dbraw/zinc/90/20/41/974902041.db2.gz VYCPDPQYICALTC-UHFFFAOYSA-N 2 0 240.322 2.051 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH2+][C@@H]2CC23CCC3)CC1 ZINC000721159602 974930073 /nfs/dbraw/zinc/93/00/73/974930073.db2.gz CVSMYIDIYPVLJN-NWDGAFQWSA-N 2 0 208.349 2.003 20 0 BEADRP CO[C@H]1CCC[C@@H]([NH2+]CCCCC[NH+](C)C)C1 ZINC001172917517 974966552 /nfs/dbraw/zinc/96/65/52/974966552.db2.gz NINMRWKJFJDKAZ-KGLIPLIRSA-N 2 0 242.407 2.266 20 0 BEADRP CO[C@@H]1CCC[C@H]([NH2+][C@H]2CCC[N@H+](C)CC2)C1 ZINC001172923980 974971230 /nfs/dbraw/zinc/97/12/30/974971230.db2.gz OWKCIVFUIUJUFF-MELADBBJSA-N 2 0 240.391 2.018 20 0 BEADRP CO[C@H]1CCC[C@H]([NH2+]C(C)(C)C(C)(C)[NH3+])C1 ZINC001172926267 974971285 /nfs/dbraw/zinc/97/12/85/974971285.db2.gz PCOGHHSRRCDYCU-QWRGUYRKSA-N 2 0 228.380 2.050 20 0 BEADRP CCCOC1CCC([NH2+][C@@H]2CCC[C@@H]2[NH3+])CC1 ZINC001173096398 975020474 /nfs/dbraw/zinc/02/04/74/975020474.db2.gz OKTPYXXLEOUUEP-CLRIEMFWSA-N 2 0 240.391 2.194 20 0 BEADRP CC[NH+](CC)C1CCC([NH2+][C@@H]2CCOC2)CC1 ZINC001173101538 975022552 /nfs/dbraw/zinc/02/25/52/975022552.db2.gz JPBGEOUSCXPMTI-ROKHWSDSSA-N 2 0 240.391 2.018 20 0 BEADRP CC[NH+](CC)C1CCC([N@H+](C)CC(C)=O)CC1 ZINC001173109411 975025010 /nfs/dbraw/zinc/02/50/10/975025010.db2.gz ILHLOFDDZLSHPO-UHFFFAOYSA-N 2 0 240.391 2.160 20 0 BEADRP CCOCC[NH2+]C1CCC([NH+](CC)CC)CC1 ZINC001173105202 975025124 /nfs/dbraw/zinc/02/51/24/975025124.db2.gz HGXUAIKJAWEFMO-UHFFFAOYSA-N 2 0 242.407 2.266 20 0 BEADRP COc1cccc2c1CC[C@@H]2[NH2+]CCC(C)(C)[NH3+] ZINC001332402817 975094025 /nfs/dbraw/zinc/09/40/25/975094025.db2.gz SNXBCBHGKYKCOY-ZDUSSCGKSA-N 2 0 248.370 2.400 20 0 BEADRP CCc1ccc(C[C@H](C)[NH2+]C[C@H](C)C[NH3+])cc1 ZINC001173241575 975166632 /nfs/dbraw/zinc/16/66/32/975166632.db2.gz OJKYVVIHYXRRLU-OLZOCXBDSA-N 2 0 234.387 2.364 20 0 BEADRP Cc1c[nH+]ccc1Nc1cc[nH+]c(N(C)C)c1 ZINC001174535961 976813156 /nfs/dbraw/zinc/81/31/56/976813156.db2.gz DMXJKPGJVSOQJM-UHFFFAOYSA-N 2 0 228.299 2.017 20 0 BEADRP Cc1c[nH+]ccc1Nc1cc[nH+]c2c1CCC2 ZINC001174536810 976822358 /nfs/dbraw/zinc/82/23/58/976822358.db2.gz WHXXDDRZPWEZTF-UHFFFAOYSA-N 2 0 225.295 2.439 20 0 BEADRP CC1CC(C[N@@H+]2CCCC3(CC[NH2+]CC3)C2)C1 ZINC001336276472 977614921 /nfs/dbraw/zinc/61/49/21/977614921.db2.gz JLBYQBHDZHPPRI-UHFFFAOYSA-N 2 0 236.403 2.498 20 0 BEADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCNc2cc[nH+]cc2)C1 ZINC001336396532 977658844 /nfs/dbraw/zinc/65/88/44/977658844.db2.gz MGFZMQOLKOGGTC-OKILXGFUSA-N 2 0 247.386 2.283 20 0 BEADRP Cc1cc(C)[nH+]c(N[C@H]2CCC[C@H]([NH3+])C2)c1 ZINC000721838724 978049548 /nfs/dbraw/zinc/04/95/48/978049548.db2.gz STPZQWDJVDQFNI-RYUDHWBXSA-N 2 0 219.332 2.380 20 0 BEADRP C[C@]1(C[NH3+])CCC[N@H+](Cc2ccncc2)CC1 ZINC001206292887 978286488 /nfs/dbraw/zinc/28/64/88/978286488.db2.gz FKJFAMSPMJIIBW-AWEZNQCLSA-N 2 0 233.359 2.033 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@](C)(C[NH3+])CC2)[nH]1 ZINC001206304807 978373010 /nfs/dbraw/zinc/37/30/10/978373010.db2.gz PUAUBGSVBKQAEQ-AWEZNQCLSA-N 2 0 235.375 2.274 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@@](C)(C[NH3+])CC2)cn1 ZINC001206312033 978495065 /nfs/dbraw/zinc/49/50/65/978495065.db2.gz YEWJQJUOXJWSMR-OAHLLOKOSA-N 2 0 247.386 2.341 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@@H](NCc3ccccc3F)[C@H]2C1 ZINC001179815692 978757815 /nfs/dbraw/zinc/75/78/15/978757815.db2.gz IVBQBFJPCIZAGB-KCQAQPDRSA-N 2 0 248.345 2.256 20 0 BEADRP CC[C@H]1CC[C@@H]([NH2+]C[C@@H]2CC[N@H+](C)C2)C1 ZINC000070643338 978861605 /nfs/dbraw/zinc/86/16/05/978861605.db2.gz DBURVKNRIMMDND-RWMBFGLXSA-N 2 0 210.365 2.106 20 0 BEADRP CCc1cccc(C)c1CN1CC2CC1(C[NH3+])C2 ZINC001235007350 978950667 /nfs/dbraw/zinc/95/06/67/978950667.db2.gz MICYEKWUPZIQKS-UHFFFAOYSA-N 2 0 244.382 2.481 20 0 BEADRP [NH3+]CC1CCC([NH2+]C[C@]23C[C@H]2CCC3)CC1 ZINC001340065865 978965708 /nfs/dbraw/zinc/96/57/08/978965708.db2.gz XWTYUDCSKVRLDP-HHTDUIENSA-N 2 0 222.376 2.284 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CCCC[C@@]12CCC[NH2+]C2 ZINC001235176297 978990345 /nfs/dbraw/zinc/99/03/45/978990345.db2.gz ZYZGNYNNUMFXQZ-MCIONIFRSA-N 2 0 222.376 2.251 20 0 BEADRP CC1=C[C@@H](C)[C@H](C[N@@H+]2C[C@@H]3CC[NH2+][C@@H]3C2)CC1 ZINC001235189206 978992512 /nfs/dbraw/zinc/99/25/12/978992512.db2.gz XSGUAPZLSMQTMR-CBBWQLFWSA-N 2 0 234.387 2.273 20 0 BEADRP CCCC[C@H](CC)C[N@@H+]1C[C@H]2C[NH2+]CC[C@@H]21 ZINC001235256726 979011635 /nfs/dbraw/zinc/01/16/35/979011635.db2.gz GKKHGQNUBMECQU-MJBXVCDLSA-N 2 0 224.392 2.497 20 0 BEADRP CC1=CC[C@H](CC[N@H+]2C[C@@H]3[C@H]([NH3+])[C@@H]3C2)C1(C)C ZINC001235282682 979016644 /nfs/dbraw/zinc/01/66/44/979016644.db2.gz GTSSRNQIZOKSQN-YIYPIFLZSA-N 2 0 234.387 2.258 20 0 BEADRP C[NH2+]CCC[N@H+](C)CCc1ccccc1Cl ZINC001235838911 979152671 /nfs/dbraw/zinc/15/26/71/979152671.db2.gz FGGFATCOQWMBOU-UHFFFAOYSA-N 2 0 240.778 2.424 20 0 BEADRP [NH3+][C@@H]1[C@@H]2CC[C@H]1C[N@@H+](CC1CCCCC1)C2 ZINC001235960074 979225657 /nfs/dbraw/zinc/22/56/57/979225657.db2.gz VMQQQGYNZPKCDU-BTTYYORXSA-N 2 0 222.376 2.236 20 0 BEADRP [NH3+][C@@]12CC[C@H]1C[N@H+](CCCC1CCCC1)C2 ZINC001235979957 979233939 /nfs/dbraw/zinc/23/39/39/979233939.db2.gz OWEGJMGHCIYZIY-UONOGXRCSA-N 2 0 222.376 2.380 20 0 BEADRP [NH3+][C@@]12CC[C@@H]1C[N@H+](CCCC1CCCC1)C2 ZINC001235979958 979235732 /nfs/dbraw/zinc/23/57/32/979235732.db2.gz OWEGJMGHCIYZIY-ZIAGYGMSSA-N 2 0 222.376 2.380 20 0 BEADRP CC/C=C\CCC[N@@H+]1C[C@@H]2CC[C@@]2([NH3+])C1 ZINC001235981105 979256796 /nfs/dbraw/zinc/25/67/96/979256796.db2.gz UNFQIVCJVABOMV-RSNNXLNZSA-N 2 0 208.349 2.156 20 0 BEADRP Cc1ccc([C@H]2CCC[N@@H+]2CCCC[NH3+])cn1 ZINC001236042556 979332849 /nfs/dbraw/zinc/33/28/49/979332849.db2.gz QGCXRBJNIQKHJW-CQSZACIVSA-N 2 0 233.359 2.266 20 0 BEADRP C[N@@H+]1CCC[C@H](CC[NH2+][C@H]2C[C@@H]3CCC[C@@H]32)C1 ZINC001182250411 979482269 /nfs/dbraw/zinc/48/22/69/979482269.db2.gz JKLBVZIULVVZSE-QPSCCSFWSA-N 2 0 236.403 2.497 20 0 BEADRP Cc1ccc(C[N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)o1 ZINC001236314995 979524205 /nfs/dbraw/zinc/52/42/05/979524205.db2.gz UNYHQVNVEBPCTB-BETUJISGSA-N 2 0 234.343 2.019 20 0 BEADRP CC(C)CCC[N@H+]1C[C@@H]2CC[NH2+]CC[C@@H]2C1 ZINC001236314233 979524307 /nfs/dbraw/zinc/52/43/07/979524307.db2.gz MAVFJPOSVRVTNW-OKILXGFUSA-N 2 0 224.392 2.354 20 0 BEADRP C1=CC[C@@H](C[N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)CC1 ZINC001236314036 979525628 /nfs/dbraw/zinc/52/56/28/979525628.db2.gz GXZGXLGSQQEOMR-KFWWJZLASA-N 2 0 234.387 2.274 20 0 BEADRP C[NH2+]CCC[NH+]1CCC(c2ccc(N)cc2)CC1 ZINC001236336720 979537434 /nfs/dbraw/zinc/53/74/34/979537434.db2.gz VFZFLLHPMBGIGL-UHFFFAOYSA-N 2 0 247.386 2.058 20 0 BEADRP C[N@H+](CCCC1CCCC1)[C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001236410147 979585810 /nfs/dbraw/zinc/58/58/10/979585810.db2.gz DTULPKHYFQDOBW-WDNDVIMCSA-N 2 0 222.376 2.106 20 0 BEADRP Cc1ncccc1C[N@@H+]1CCCC[C@](C)(C[NH3+])C1 ZINC001206548967 979677783 /nfs/dbraw/zinc/67/77/83/979677783.db2.gz LERHUQOSYBPJSN-OAHLLOKOSA-N 2 0 247.386 2.341 20 0 BEADRP C[C@H](CCCC(C)(C)O)CC[N@@H+](C)C[C@H](C)[NH3+] ZINC001236884871 979784264 /nfs/dbraw/zinc/78/42/64/979784264.db2.gz UIXXVZVFBHBLRZ-OLZOCXBDSA-N 2 0 244.423 2.233 20 0 BEADRP CCc1cccc(C)c1CN(C)C[C@H](C)[NH3+] ZINC001236908510 979791022 /nfs/dbraw/zinc/79/10/22/979791022.db2.gz JQAPXGHHCNBHRY-LBPRGKRZSA-N 2 0 220.360 2.336 20 0 BEADRP Cc1ccc2c(CN(C)C[C@H](C)[NH3+])cccc2n1 ZINC001236907564 979793455 /nfs/dbraw/zinc/79/34/55/979793455.db2.gz BFXFOEATKRDLHZ-NSHDSACASA-N 2 0 243.354 2.322 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@@](C)([NH3+])CC2)c(C)n1 ZINC001205281646 979889796 /nfs/dbraw/zinc/88/97/96/979889796.db2.gz WWCGDUXZTLZYFR-OAHLLOKOSA-N 2 0 247.386 2.402 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1C[NH+]2CCC1CC2)c1ccccn1 ZINC001184135720 979945012 /nfs/dbraw/zinc/94/50/12/979945012.db2.gz UOLFCHJFYYMJAH-TZMCWYRMSA-N 2 0 245.370 2.074 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+][C@H]1COC(C)(C)C1 ZINC001184417507 980080889 /nfs/dbraw/zinc/08/08/89/980080889.db2.gz DZIZSBVRDFQWNK-CHWSQXEVSA-N 2 0 242.407 2.264 20 0 BEADRP c1ncn2c1cccc2C[N@@H+]1CCCC12CC2 ZINC001238104805 980157720 /nfs/dbraw/zinc/15/77/20/980157720.db2.gz ZYWWWBQTZCVDJZ-UHFFFAOYSA-N 2 0 227.311 2.463 20 0 BEADRP C([C@@H]1CC2CCC1CC2)[N@@H+]1CC[C@@]2(CC[NH2+]C2)C1 ZINC000691659592 980378317 /nfs/dbraw/zinc/37/83/17/980378317.db2.gz GYRRWGCKKZFABC-SSHXOBKSSA-N 2 0 248.414 2.498 20 0 BEADRP C([C@H]1CC2CCC1CC2)[N@@H+]1CC[C@]2(CC[NH2+]C2)C1 ZINC000691659524 980379297 /nfs/dbraw/zinc/37/92/97/980379297.db2.gz GYRRWGCKKZFABC-FJBKBRRZSA-N 2 0 248.414 2.498 20 0 BEADRP c1cc2c(c(C3=CCC[NH2+]CC3)c1)CC[NH2+]C2 ZINC001238942070 980380889 /nfs/dbraw/zinc/38/08/89/980380889.db2.gz YEIAOFAHDVQDRI-UHFFFAOYSA-N 2 0 228.339 2.099 20 0 BEADRP C([C@@H]1CC2CCC1CC2)N1CC[C@H]2[NH2+]CC[C@@H]2C1 ZINC000691658358 980382293 /nfs/dbraw/zinc/38/22/93/980382293.db2.gz BZTYKHRDJBCZQD-MTERUZRBSA-N 2 0 248.414 2.497 20 0 BEADRP c1[nH+]cn2c1cccc2C1=CCC[NH2+]CC1 ZINC001238945770 980384028 /nfs/dbraw/zinc/38/40/28/980384028.db2.gz DVZKKSKQROKVEK-UHFFFAOYSA-N 2 0 213.284 2.101 20 0 BEADRP c1[nH+]cn2cccc(C3=CCC[NH2+]CC3)c12 ZINC001238947250 980385347 /nfs/dbraw/zinc/38/53/47/980385347.db2.gz WLDRMFNEGIBWDZ-UHFFFAOYSA-N 2 0 213.284 2.101 20 0 BEADRP [NH3+][C@H]1CCc2ccc(C3=CCC[NH2+]CC3)cc21 ZINC001238951031 980389388 /nfs/dbraw/zinc/38/93/88/980389388.db2.gz RYIAGAVXAPFJIL-HNNXBMFYSA-N 2 0 228.339 2.399 20 0 BEADRP C[C@@H]([NH3+])c1cccc(C2=CCC[NH2+]CC2)c1 ZINC001238948604 980389466 /nfs/dbraw/zinc/38/94/66/980389466.db2.gz ZRHOUOXLRQNULC-LLVKDONJSA-N 2 0 216.328 2.473 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H](C)c1ccccc1N(C)C ZINC001345484653 980617541 /nfs/dbraw/zinc/61/75/41/980617541.db2.gz YQCGWCLGEFIUFQ-CHWSQXEVSA-N 2 0 249.402 2.401 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H](C)c1ccc(C)nc1C ZINC001345483532 980618754 /nfs/dbraw/zinc/61/87/54/980618754.db2.gz SPSPIODCMLASNZ-CMPLNLGQSA-N 2 0 235.375 2.205 20 0 BEADRP C[C@H]1CC[N@H+](CCC2CC2)CC[C@H]1C[NH3+] ZINC001205600445 981155990 /nfs/dbraw/zinc/15/59/90/981155990.db2.gz BSVWGBBXAWSABE-AAEUAGOBSA-N 2 0 210.365 2.093 20 0 BEADRP Cc1cccc(C[N@@H+]2CC[C@@H](C[NH3+])[C@@H](C)CC2)n1 ZINC001205602649 981164447 /nfs/dbraw/zinc/16/44/47/981164447.db2.gz KXUPRQMEQNUAEM-JSGCOSHPSA-N 2 0 247.386 2.197 20 0 BEADRP Cc1cccc(C[N@H+]2CC[C@H](C)[C@@H](C[NH3+])CC2)n1 ZINC001205602648 981166024 /nfs/dbraw/zinc/16/60/24/981166024.db2.gz KXUPRQMEQNUAEM-GXTWGEPZSA-N 2 0 247.386 2.197 20 0 BEADRP C[C@H](CNc1cc[nH+]cc1)[N@@H+]1CCC[C@H](C)C1 ZINC001347773129 981168442 /nfs/dbraw/zinc/16/84/42/981168442.db2.gz UBXIWHSLLFJHHY-QWHCGFSZSA-N 2 0 233.359 2.036 20 0 BEADRP CC(C)([NH3+])c1ccc(C2=CC[NH2+]CC2)cc1 ZINC001240469541 981406137 /nfs/dbraw/zinc/40/61/37/981406137.db2.gz BJZDSLJAATVGOI-UHFFFAOYSA-N 2 0 216.328 2.257 20 0 BEADRP c1cc([C@@H]2CC[NH2+]C2)ccc1C1=CC[NH2+]CC1 ZINC001240469900 981407621 /nfs/dbraw/zinc/40/76/21/981407621.db2.gz PEFSBKFETWERLH-OAHLLOKOSA-N 2 0 228.339 2.140 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H](C)c1ccc2c(c1)CCO2 ZINC001348852453 981461151 /nfs/dbraw/zinc/46/11/51/981461151.db2.gz MJIUJLHUGPLTPZ-NEPJUHHUSA-N 2 0 248.370 2.270 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@H](C)c1ccc2c(c1)CCO2 ZINC001348852454 981461625 /nfs/dbraw/zinc/46/16/25/981461625.db2.gz MJIUJLHUGPLTPZ-NWDGAFQWSA-N 2 0 248.370 2.270 20 0 BEADRP C(c1ccc2c[nH+]cn2c1)=C1CC[NH2+]CC1 ZINC001240875040 981920745 /nfs/dbraw/zinc/92/07/45/981920745.db2.gz BKQWWWXTSYGDSB-UHFFFAOYSA-N 2 0 213.284 2.101 20 0 BEADRP [NH3+][C@@H]1CCc2c1cccc2C=C1CC[NH2+]CC1 ZINC001240878352 981932721 /nfs/dbraw/zinc/93/27/21/981932721.db2.gz FVQSVCOWQHCADX-OAHLLOKOSA-N 2 0 228.339 2.399 20 0 BEADRP [NH3+][C@@H]1CCc2ccc(C=C3CC[NH2+]CC3)cc21 ZINC001240879460 981935891 /nfs/dbraw/zinc/93/58/91/981935891.db2.gz RNTHMTLLTQCAHN-OAHLLOKOSA-N 2 0 228.339 2.399 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CCCC(F)F)[C@@H]2CCC[C@@H]21 ZINC001350635594 982035609 /nfs/dbraw/zinc/03/56/09/982035609.db2.gz DWOVKILKRADBJP-SRVKXCTJSA-N 2 0 246.345 2.494 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CCCC(F)F)[C@@H]2CCC[C@H]21 ZINC001350635592 982037639 /nfs/dbraw/zinc/03/76/39/982037639.db2.gz DWOVKILKRADBJP-SDDRHHMPSA-N 2 0 246.345 2.494 20 0 BEADRP Cc1cc(C[N@@H+]2CC[C@H](C[NH3+])[C@H](C)C2)cs1 ZINC001350910563 982117185 /nfs/dbraw/zinc/11/71/85/982117185.db2.gz QKGUXDIZVFRXJM-ZWNOBZJWSA-N 2 0 238.400 2.473 20 0 BEADRP [NH3+]CC[C@@H]1CC[N@H+](C[C@@H]2CC3CCC2CC3)C1 ZINC000691700865 982225240 /nfs/dbraw/zinc/22/52/40/982225240.db2.gz KXVHQTBGQPHYSR-JYVUQVBGSA-N 2 0 236.403 2.483 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1C[C@@H]2CC[C@@H]([NH+](C)C)C[C@H]2C1 ZINC001352110510 982475372 /nfs/dbraw/zinc/47/53/72/982475372.db2.gz COIRXVSKMMVWBF-QKGCVVFFSA-N 2 0 236.403 2.305 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1C[C@@H]2CC[C@H]([NH+](C)C)C[C@@H]2C1 ZINC001352110499 982476059 /nfs/dbraw/zinc/47/60/59/982476059.db2.gz COIRXVSKMMVWBF-KHMAMNHCSA-N 2 0 236.403 2.305 20 0 BEADRP CC[C@H](C)[C@H](C)[N@@H+]1C[C@H]2CN(C)C[C@@]2(C)C1 ZINC001198271597 982690708 /nfs/dbraw/zinc/69/07/08/982690708.db2.gz WYVCKAZKYCUFNZ-FQUUOJAGSA-N 2 0 224.392 2.305 20 0 BEADRP CC[C@@H](C)[C@@H](C)[N@@H+]1C[C@H]2CN(C)C[C@@]2(C)C1 ZINC001198271599 982692852 /nfs/dbraw/zinc/69/28/52/982692852.db2.gz WYVCKAZKYCUFNZ-SYQHCUMBSA-N 2 0 224.392 2.305 20 0 BEADRP C[NH+](C)Cc1cccc(C2=CCC[N@H+](C)C2)c1 ZINC001241570206 982820029 /nfs/dbraw/zinc/82/00/29/982820029.db2.gz XBGNGUCJPHYWKO-UHFFFAOYSA-N 2 0 230.355 2.467 20 0 BEADRP C[N@@H+]1CCCC(C)(C)[C@H]1CNc1cc[nH+]cc1 ZINC001354019909 983118548 /nfs/dbraw/zinc/11/85/48/983118548.db2.gz XTOBXIRDLMNPDX-CYBMUJFWSA-N 2 0 233.359 2.036 20 0 BEADRP Cc1cc(C)[nH+]c(Nc2ccc(N)nc2)c1 ZINC001201272248 983173868 /nfs/dbraw/zinc/17/38/68/983173868.db2.gz KZACENWAIPOVAG-UHFFFAOYSA-N 2 0 214.272 2.419 20 0 BEADRP CS[C@H]1CCC[C@H]([NH2+]CCCN2CCC2)C1 ZINC001354171430 983182841 /nfs/dbraw/zinc/18/28/41/983182841.db2.gz QSEPLSNSTJCZRN-STQMWFEESA-N 2 0 242.432 2.346 20 0 BEADRP CCC(CC)C[NH+]1CCC2(C[NH+](C)C2)CC1 ZINC001201534856 983291564 /nfs/dbraw/zinc/29/15/64/983291564.db2.gz ADSGZJDJMJFVML-UHFFFAOYSA-N 2 0 224.392 2.450 20 0 BEADRP C[NH+](C)C[C@@]12C[C@@H]1C[N@H+](CCc1ccccc1)C2 ZINC001201606313 983371032 /nfs/dbraw/zinc/37/10/32/983371032.db2.gz XHDLZWCQRNQITJ-HZPDHXFCSA-N 2 0 244.382 2.113 20 0 BEADRP CN1CCC[C@@H]2C[N@H+](CCc3ccccc3)C[C@H]21 ZINC001201606094 983372825 /nfs/dbraw/zinc/37/28/25/983372825.db2.gz IJZYYHDXBSEGEN-HZPDHXFCSA-N 2 0 244.382 2.255 20 0 BEADRP CC(C)CC[NH+]1CCC2(C[NH+](C)C2)CC1 ZINC001201626285 983379976 /nfs/dbraw/zinc/37/99/76/983379976.db2.gz DJOLWTWYHBNPRL-UHFFFAOYSA-N 2 0 210.365 2.060 20 0 BEADRP CCC[NH+]1CCC([NH+]2CCC(F)CC2)CC1 ZINC001201645983 983396648 /nfs/dbraw/zinc/39/66/48/983396648.db2.gz LXIVYPZYDDHKJO-UHFFFAOYSA-N 2 0 228.355 2.295 20 0 BEADRP CN1CCC[C@@H]2C[N@H+](CCC(C)(C)C)C[C@@H]21 ZINC001202114628 983567155 /nfs/dbraw/zinc/56/71/55/983567155.db2.gz BWIUILIIOMWULD-OLZOCXBDSA-N 2 0 224.392 2.449 20 0 BEADRP C[NH+](C)C[C@@]12C[C@@H]1C[N@H+](CC1CCCC1)C2 ZINC001202177907 983583614 /nfs/dbraw/zinc/58/36/14/983583614.db2.gz FUGCATJSVZVCRP-ZIAGYGMSSA-N 2 0 222.376 2.060 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CC[C@@H]3C[N@@H+](C)C[C@@H]23)cc1 ZINC001474302672 983903967 /nfs/dbraw/zinc/90/39/67/983903967.db2.gz CKULLGIGSYMHSY-BZUAXINKSA-N 2 0 244.382 2.425 20 0 BEADRP [NH3+]Cc1cccc(-c2ccc3c(c2)C[NH2+]C3)c1 ZINC001242677015 984045842 /nfs/dbraw/zinc/04/58/42/984045842.db2.gz XKXLFEKSSKOXGA-UHFFFAOYSA-N 2 0 224.307 2.416 20 0 BEADRP C[C@H]([NH3+])c1ccc(-c2ccc3c(c2)C[NH2+]C3)cn1 ZINC001242677605 984048039 /nfs/dbraw/zinc/04/80/39/984048039.db2.gz KNICKWOENUXXGZ-JTQLQIEISA-N 2 0 239.322 2.372 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CC[C@@H]([NH3+])C1)c1ccccc1 ZINC001576244539 984162636 /nfs/dbraw/zinc/16/26/36/984162636.db2.gz LHTDYTSJARXWOS-MBNYWOFBSA-N 2 0 218.344 2.465 20 0 BEADRP CC1(C)[C@H]([NH3+])C[C@H]1[NH2+]Cc1cccc2[nH]ccc21 ZINC001576380647 984169779 /nfs/dbraw/zinc/16/97/79/984169779.db2.gz WBQSNJTZUDTSBI-ZIAGYGMSSA-N 2 0 243.354 2.383 20 0 BEADRP C[C@H]1CCC(C)(C)C[C@@H]1[NH2+][C@H]1C[C@@H]([NH3+])C1 ZINC001576647944 984178661 /nfs/dbraw/zinc/17/86/61/984178661.db2.gz VPPVAFJXEUYUTN-YFKTTZPYSA-N 2 0 210.365 2.281 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@H](C)Cc1cccc(C)c1 ZINC001577124510 984189482 /nfs/dbraw/zinc/18/94/82/984189482.db2.gz FKISSNVOKIJUKB-OCCSQVGLSA-N 2 0 220.360 2.253 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@@H](CC)CCC(F)(F)F ZINC001577124760 984190101 /nfs/dbraw/zinc/19/01/01/984190101.db2.gz PJJRGYQYYLHDJH-BDAKNGLRSA-N 2 0 226.286 2.434 20 0 BEADRP CCC[C@H]([NH2+]C[C@H]1[C@@H]2C[NH2+]C[C@H]12)C1CCC1 ZINC001577365207 984192640 /nfs/dbraw/zinc/19/26/40/984192640.db2.gz BTHUKIKCXZRXIU-DGAVXFQQSA-N 2 0 222.376 2.010 20 0 BEADRP C[NH2+]Cc1ccc(-c2ccc([C@H](C)[NH3+])nc2)cc1 ZINC001242993776 984355140 /nfs/dbraw/zinc/35/51/40/984355140.db2.gz JWJOARMYITXBJY-NSHDSACASA-N 2 0 241.338 2.488 20 0 BEADRP c1ccc(CC2C[NH+](C[C@@H]3CCC[NH2+]C3)C2)cc1 ZINC001580893083 984625364 /nfs/dbraw/zinc/62/53/64/984625364.db2.gz RUIQLOVDLSTHLJ-OAHLLOKOSA-N 2 0 244.382 2.161 20 0 BEADRP C[NH2+][C@@]12CC[C@@]([NH2+]Cc3cccnc3)(C1)CCC2 ZINC001275884848 984714202 /nfs/dbraw/zinc/71/42/02/984714202.db2.gz MCIHXDJFKBCICH-LSDHHAIUSA-N 2 0 245.370 2.236 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H]1CCO[C@H](c2ccccc2)C1 ZINC001256799570 984840807 /nfs/dbraw/zinc/84/08/07/984840807.db2.gz VFPQOPOZDXYIDU-YUELXQCFSA-N 2 0 248.370 2.091 20 0 BEADRP CCC[C@@H](CC)[N@H+]1C[C@H]2C[NH+](CC)C[C@H]2C1 ZINC001257270833 984867325 /nfs/dbraw/zinc/86/73/25/984867325.db2.gz QMVXRXRHSLNCSP-HZSPNIEDSA-N 2 0 224.392 2.449 20 0 BEADRP CCC[C@H](C)[NH2+]C(C)(C)CC[NH+](C)C ZINC001257309443 984883586 /nfs/dbraw/zinc/88/35/86/984883586.db2.gz STQUHKRPLPNSHM-NSHDSACASA-N 2 0 200.370 2.495 20 0 BEADRP CCC[C@@H](C)[NH2+]C(C)(C)CC[NH+](C)C ZINC001257309442 984884153 /nfs/dbraw/zinc/88/41/53/984884153.db2.gz STQUHKRPLPNSHM-LLVKDONJSA-N 2 0 200.370 2.495 20 0 BEADRP CC1CC(C[N@H+](C)C2CCC([NH3+])CC2)C1 ZINC000691966729 985079775 /nfs/dbraw/zinc/07/97/75/985079775.db2.gz GQZMNQSABUERRM-UHFFFAOYSA-N 2 0 210.365 2.234 20 0 BEADRP CCC[C@H](C)CC[C@@H](C)[NH2+]CCOCC[NH3+] ZINC001257469080 985088412 /nfs/dbraw/zinc/08/84/12/985088412.db2.gz SVQOTNOUCGPAJQ-QWHCGFSZSA-N 2 0 230.396 2.156 20 0 BEADRP CCCCC[C@@H](C)NC(=[NH2+])SCC[NH3+] ZINC001257501910 985126820 /nfs/dbraw/zinc/12/68/20/985126820.db2.gz NDPJCXVFLDMGPK-SECBINFHSA-N 2 0 217.382 2.171 20 0 BEADRP CO[C@H]1CC[C@H](C)[N@H+](CCCCCC[NH3+])C1 ZINC000687191890 985257010 /nfs/dbraw/zinc/25/70/10/985257010.db2.gz BNLQZWUXBYQGGL-STQMWFEESA-N 2 0 228.380 2.005 20 0 BEADRP C[NH2+]CCC[N@@H+]1C[C@@H](C2CC2)C[C@H]1C1CC1 ZINC001578687236 985300285 /nfs/dbraw/zinc/30/02/85/985300285.db2.gz RXXPNFZSPCABPS-KBPBESRZSA-N 2 0 222.376 2.106 20 0 BEADRP COC(C)(C)CC[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC001578892874 985455483 /nfs/dbraw/zinc/45/54/83/985455483.db2.gz MCFLVOJWEOYWSS-LBPRGKRZSA-N 2 0 242.407 2.169 20 0 BEADRP CO[C@@](C)(C[N@@H+]1CCCCC[C@H]([NH3+])C1)C1CC1 ZINC001578897011 985478807 /nfs/dbraw/zinc/47/88/07/985478807.db2.gz HVOXVDSLPDWEOV-KBPBESRZSA-N 2 0 240.391 2.005 20 0 BEADRP C[N@H+](Cc1cc2c(s1)CC[NH2+]C2)C1CCC1 ZINC000688039601 985508780 /nfs/dbraw/zinc/50/87/80/985508780.db2.gz VDKLVRLNNFEWAA-UHFFFAOYSA-N 2 0 236.384 2.378 20 0 BEADRP CC[NH+](CC)Cc1cc2c(s1)CC[NH2+]C2 ZINC000688039540 985509394 /nfs/dbraw/zinc/50/93/94/985509394.db2.gz UJNFFXXDFQAWGO-UHFFFAOYSA-N 2 0 224.373 2.236 20 0 BEADRP CO[C@H]1CCC[C@H]([NH2+]CCCCCC[NH3+])CC1 ZINC001578938366 985554185 /nfs/dbraw/zinc/55/41/85/985554185.db2.gz SKMXMHJTHBKNQM-KBPBESRZSA-N 2 0 242.407 2.443 20 0 BEADRP CN(C)c1cc[nH+]c(/C=C/C2CC[NH2+]CC2)c1 ZINC001243891761 985555355 /nfs/dbraw/zinc/55/53/55/985555355.db2.gz GEXVODSIUSPQRE-ONEGZZNKSA-N 2 0 231.343 2.160 20 0 BEADRP C(=C/C1CC[NH2+]CC1)\c1ccc2c(c1)C[NH2+]CC2 ZINC001243892528 985564112 /nfs/dbraw/zinc/56/41/12/985564112.db2.gz KQVKJTFSLSMYKB-OWOJBTEDSA-N 2 0 242.366 2.345 20 0 BEADRP [NH3+][C@@H](CC(F)F)C[N@@H+]1CCC[C@H]1C1CCC1 ZINC000688242616 985585867 /nfs/dbraw/zinc/58/58/67/985585867.db2.gz VHGDVTZWLSGJEG-QWRGUYRKSA-N 2 0 232.318 2.233 20 0 BEADRP CSCC[C@H](C)[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC001258199965 985605372 /nfs/dbraw/zinc/60/53/72/985605372.db2.gz LXXROOYSMKWHQP-STQMWFEESA-N 2 0 244.448 2.450 20 0 BEADRP COCC1(C[NH2+]CC[NH2+]C(C)(C)C)CCCC1 ZINC001578982954 985606438 /nfs/dbraw/zinc/60/64/38/985606438.db2.gz SVIHHVUYVRBXHB-UHFFFAOYSA-N 2 0 242.407 2.171 20 0 BEADRP CSCC[C@@H](C)[NH2+]Cc1ccccc1C[NH3+] ZINC001258209491 985638646 /nfs/dbraw/zinc/63/86/46/985638646.db2.gz WJISCHMUEFOFID-LLVKDONJSA-N 2 0 238.400 2.377 20 0 BEADRP COCC[C@@H]([NH3+])C[NH2+][C@@H](C)CCC=C(C)C ZINC001579001082 985642845 /nfs/dbraw/zinc/64/28/45/985642845.db2.gz FMEDIQYITMIAPP-QWHCGFSZSA-N 2 0 228.380 2.075 20 0 BEADRP c1cc2c(c(C3=C[NH2+]CCC3)c1)C[NH2+]C2 ZINC001243951912 985653326 /nfs/dbraw/zinc/65/33/26/985653326.db2.gz ZWZVBSSTPSUDMN-UHFFFAOYSA-N 2 0 200.285 2.014 20 0 BEADRP [NH3+][C@H]1CCc2c1cccc2C1=C[NH2+]CCC1 ZINC001243951407 985654412 /nfs/dbraw/zinc/65/44/12/985654412.db2.gz GLNDACGLKQTWOT-AWEZNQCLSA-N 2 0 214.312 2.357 20 0 BEADRP [NH3+]Cc1cccc(C2=C[NH2+]CCC2)c1F ZINC001243952695 985659553 /nfs/dbraw/zinc/65/95/53/985659553.db2.gz QVPHCBJFJCNNET-UHFFFAOYSA-N 2 0 206.264 2.009 20 0 BEADRP [NH3+][C@H]1CCc2ccc(C3=C[NH2+]CCC3)cc21 ZINC001243954125 985668429 /nfs/dbraw/zinc/66/84/29/985668429.db2.gz RCCQRMLDZYMDEX-AWEZNQCLSA-N 2 0 214.312 2.357 20 0 BEADRP CCSC1(C[NH2+][C@H]2C[C@@H]([NH3+])C23CCC3)CC1 ZINC000691863999 985703922 /nfs/dbraw/zinc/70/39/22/985703922.db2.gz GXZNEULGDRPZCQ-MNOVXSKESA-N 2 0 240.416 2.132 20 0 BEADRP COc1ccc2c(c1)CC[N@@H+](CC(C)(C)C[NH3+])C2 ZINC001579243816 985825953 /nfs/dbraw/zinc/82/59/53/985825953.db2.gz QSQRWCIUQKMBGY-UHFFFAOYSA-N 2 0 248.370 2.038 20 0 BEADRP COc1cccc(C[NH2+][C@H]2C[C@H]([NH3+])C2(C)C)c1C ZINC001579277708 985829424 /nfs/dbraw/zinc/82/94/24/985829424.db2.gz KNSHHGOORUROGB-KBPBESRZSA-N 2 0 248.370 2.219 20 0 BEADRP CSCC[N@@H+]1CCCC[C@@H]1C1(C[NH3+])CCC1 ZINC001579373858 985863912 /nfs/dbraw/zinc/86/39/12/985863912.db2.gz DXAOORSRRGQAJL-GFCCVEGCSA-N 2 0 242.432 2.333 20 0 BEADRP C[C@@H]([NH2+]C[C@@]12C[C@@H]1C[NH2+]C2)c1cccs1 ZINC001579415030 985886726 /nfs/dbraw/zinc/88/67/26/985886726.db2.gz XNBODPNVTVOZMQ-FOGDFJRCSA-N 2 0 222.357 2.008 20 0 BEADRP [NH3+]C[C@@H]1CCCC[N@H+](CCCc2ccncc2)C1 ZINC001206606111 985893679 /nfs/dbraw/zinc/89/36/79/985893679.db2.gz DNSRKESDTJYVOD-HNNXBMFYSA-N 2 0 247.386 2.075 20 0 BEADRP CCCC[C@@H](CCC)[N@@H+]1CCO[C@@H](C[NH3+])C1 ZINC001258752887 986115568 /nfs/dbraw/zinc/11/55/68/986115568.db2.gz NAQIJATZUGLOLU-OLZOCXBDSA-N 2 0 228.380 2.005 20 0 BEADRP Cc1cc(C[NH2+][C@H]2C[C@H]([NH3+])C2(C)C)cc(C)c1O ZINC001579601779 986125632 /nfs/dbraw/zinc/12/56/32/986125632.db2.gz ZXRFTGDEDAZULS-STQMWFEESA-N 2 0 248.370 2.224 20 0 BEADRP CC[C@@H](C)C[C@@H](CC)NC(=[NH2+])NCCCC[NH3+] ZINC001258780031 986173353 /nfs/dbraw/zinc/17/33/53/986173353.db2.gz JHNGZKSPLFJAKZ-VXGBXAGGSA-N 2 0 242.411 2.054 20 0 BEADRP Cc1ccc(C[NH2+]C2CC3(CC([NH3+])C3)C2)cc1 ZINC001579696877 986186692 /nfs/dbraw/zinc/18/66/92/986186692.db2.gz KPDNQNXHCFLTGT-UHFFFAOYSA-N 2 0 230.355 2.355 20 0 BEADRP CCC[NH+]1C[C@H]2C[NH+](CC3CCC3)C[C@@H]2C1 ZINC001202791910 986313009 /nfs/dbraw/zinc/31/30/09/986313009.db2.gz GVTMKXUVCUXMBR-KBPBESRZSA-N 2 0 222.376 2.060 20 0 BEADRP FC(F)(F)CCC[NH2+]C[C@H]1CCC[NH2+]CC1 ZINC001580018280 986420184 /nfs/dbraw/zinc/42/01/84/986420184.db2.gz FLHLSFDGRHROKA-JTQLQIEISA-N 2 0 238.297 2.308 20 0 BEADRP Fc1cccc2c1CCC[C@H]2[NH2+]CC1C[NH2+]C1 ZINC001580033852 986435599 /nfs/dbraw/zinc/43/55/99/986435599.db2.gz AIRFRYRQFJFZJG-CQSZACIVSA-N 2 0 234.318 2.012 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+]C[C@H]1C[NH+]2CCC1CC2 ZINC001462635597 986467610 /nfs/dbraw/zinc/46/76/10/986467610.db2.gz MHQWSMOQYMMCIG-SNPRPXQTSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[NH+]2CCC1CC2)C1CCCC1 ZINC001462632591 986469121 /nfs/dbraw/zinc/46/91/21/986469121.db2.gz DTYNQGKLUYDCTA-DOMZBBRYSA-N 2 0 236.403 2.497 20 0 BEADRP [NH3+]C1CC([NH2+][C@H]2CCc3cc(Cl)ccc32)C1 ZINC001580166053 986644130 /nfs/dbraw/zinc/64/41/30/986644130.db2.gz OPUASRLKYLZBSU-XIVSLSHWSA-N 2 0 236.746 2.407 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH+]2CC[C@@](C)(CF)C2)CC1 ZINC001254515985 986650702 /nfs/dbraw/zinc/65/07/02/986650702.db2.gz ICGJJGDNLROAPS-OLZOCXBDSA-N 2 0 228.355 2.152 20 0 BEADRP CO[C@H]1CCC[C@@H]([NH2+][C@@H]2CCC[N@H+](C)CC2)C1 ZINC001254514862 986652119 /nfs/dbraw/zinc/65/21/19/986652119.db2.gz OWKCIVFUIUJUFF-MCIONIFRSA-N 2 0 240.391 2.018 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[N@@H+]2CCC[C@H]2c2ccc[nH]2)C1 ZINC001580386969 986810909 /nfs/dbraw/zinc/81/09/09/986810909.db2.gz AVMUYZJVRYXYCO-SCRDCRAPSA-N 2 0 233.359 2.279 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)C1 ZINC001580386968 986812566 /nfs/dbraw/zinc/81/25/66/986812566.db2.gz AVMUYZJVRYXYCO-OUCADQQQSA-N 2 0 233.359 2.279 20 0 BEADRP [NH3+]Cc1cnccc1-c1ccc(C2([NH3+])CC2)cc1 ZINC001245559089 986950884 /nfs/dbraw/zinc/95/08/84/986950884.db2.gz BETITVMQMUVWAC-UHFFFAOYSA-N 2 0 239.322 2.155 20 0 BEADRP [NH3+]Cc1cnccc1-c1ccc2c(c1)[C@@H]([NH3+])CC2 ZINC001245559547 986952016 /nfs/dbraw/zinc/95/20/16/986952016.db2.gz DHQPJPFURHMTQY-HNNXBMFYSA-N 2 0 239.322 2.153 20 0 BEADRP C[C@H]([NH3+])c1ccccc1-c1ccncc1C[NH3+] ZINC001245562295 986958302 /nfs/dbraw/zinc/95/83/02/986958302.db2.gz CRVRVSCVPHBDFH-JTQLQIEISA-N 2 0 227.311 2.227 20 0 BEADRP C[NH+](C)CCCCC[NH2+][C@@H]1CCOC(C)(C)C1 ZINC001255527895 987005238 /nfs/dbraw/zinc/00/52/38/987005238.db2.gz ZJTBRHUGEIJZNV-CYBMUJFWSA-N 2 0 242.407 2.266 20 0 BEADRP CCCCC[C@H](O)C[N@@H+]1CCC[C@](C)([NH3+])CC1 ZINC001246020320 987305068 /nfs/dbraw/zinc/30/50/68/987305068.db2.gz KQOVEPXQNLBHEW-KBPBESRZSA-N 2 0 242.407 2.131 20 0 BEADRP CC(C)CC[NH2+][C@@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C ZINC000693761826 987314650 /nfs/dbraw/zinc/31/46/50/987314650.db2.gz PHOLUBFEBXGVFM-FRRDWIJNSA-N 2 0 224.392 2.399 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+][C@@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C ZINC000693749674 987315749 /nfs/dbraw/zinc/31/57/49/987315749.db2.gz CPSVANGSPCLFPN-XHJNMGKDSA-N 2 0 236.403 2.399 20 0 BEADRP C([C@H]1CCCC[NH2+]C1)[N@@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC000697052293 987347506 /nfs/dbraw/zinc/34/75/06/987347506.db2.gz MXPFKWSSNLXYEM-MELADBBJSA-N 2 0 222.376 2.108 20 0 BEADRP C[C@H]1CC(F)(F)CC[N@@H+]1C[C@H]1CCCC[NH2+]C1 ZINC000697640485 987361919 /nfs/dbraw/zinc/36/19/19/987361919.db2.gz GPYSLCKTCIYFSV-RYUDHWBXSA-N 2 0 246.345 2.496 20 0 BEADRP CCOC1CCC([NH2+]CC2([NH3+])CCCC2)CC1 ZINC001246075585 987362626 /nfs/dbraw/zinc/36/26/26/987362626.db2.gz KQYRFRZMYYYQDM-UHFFFAOYSA-N 2 0 240.391 2.195 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CCCCCCCC[NH3+])CC[NH2+]1 ZINC001246074653 987363335 /nfs/dbraw/zinc/36/33/35/987363335.db2.gz BDLSUIIZKKVMNN-KBPBESRZSA-N 3 0 241.423 2.016 20 0 BEADRP [NH3+]C1(C[NH2+][C@H]2Cc3cccc(F)c3C2)CCCC1 ZINC001246075078 987364926 /nfs/dbraw/zinc/36/49/26/987364926.db2.gz HBMNTXFEXPLXML-LBPRGKRZSA-N 2 0 248.345 2.154 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]Cc2ccc3c(c2)CCC3)CC[NH2+]1 ZINC001246078955 987371301 /nfs/dbraw/zinc/37/13/01/987371301.db2.gz IKTMJHUHSVEDGH-MLGOLLRUSA-N 2 0 244.382 2.405 20 0 BEADRP Cc1cc2cc(C[NH3+])ccc2n1C1CC[NH2+]CC1 ZINC001246082274 987377484 /nfs/dbraw/zinc/37/74/84/987377484.db2.gz PEUZQCWRLWHRRK-UHFFFAOYSA-N 2 0 243.354 2.333 20 0 BEADRP [NH3+]Cc1ccc2c(ccn2[C@@H]2CCC[NH2+]C2)c1 ZINC001246087610 987390289 /nfs/dbraw/zinc/39/02/89/987390289.db2.gz ZGZYFFAMCKSBMG-CYBMUJFWSA-N 2 0 229.327 2.025 20 0 BEADRP CC[C@H](C)OCC[C@H](C)[NH2+][C@@H]1CCCC[NH2+]C1 ZINC001246089919 987394729 /nfs/dbraw/zinc/39/47/29/987394729.db2.gz HSSDPYFAKQWJQJ-MELADBBJSA-N 2 0 242.407 2.312 20 0 BEADRP CCSC[C@H](C)[NH2+]C[C@H]1CC[C@@H](C)[NH2+]C1 ZINC001246091240 987397973 /nfs/dbraw/zinc/39/79/73/987397973.db2.gz HJOISSTTYCGNMM-WOPDTQHZSA-N 2 0 230.421 2.106 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCCC[C@H]2C)C[NH2+]1 ZINC001246092591 987399440 /nfs/dbraw/zinc/39/94/40/987399440.db2.gz FBJKHLGYWMPOIM-NDBYEHHHSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]C[C@@H]1CC[C@@H](C)[NH2+]C1 ZINC001246103931 987427806 /nfs/dbraw/zinc/42/78/06/987427806.db2.gz ZAJLHCLLSODBII-NTZNESFSSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)C1CCC([NH2+][C@H]2C[NH2+]C[C@@H]2C)CC1 ZINC001246108720 987436228 /nfs/dbraw/zinc/43/62/28/987436228.db2.gz MJKSRDPFUJOWIW-ABXWRUBCSA-N 2 0 224.392 2.399 20 0 BEADRP CC(C)OCC[C@H](C)[NH2+]C[C@@H]1CC[C@@H](C)C[NH2+]1 ZINC001246106242 987439567 /nfs/dbraw/zinc/43/95/67/987439567.db2.gz OROGYVYEPMNFJI-RDBSUJKOSA-N 2 0 242.407 2.168 20 0 BEADRP C[C@@H]1C[C@@H](n2cc(C[NH3+])c3ccccc32)CC[NH2+]1 ZINC001246110088 987441060 /nfs/dbraw/zinc/44/10/60/987441060.db2.gz QMBJBKCBSXPOBP-YPMHNXCESA-N 2 0 243.354 2.413 20 0 BEADRP CCSC[C@H](C)[NH2+]C[C@H]1CCC[NH2+][C@@H]1C ZINC001246110506 987446510 /nfs/dbraw/zinc/44/65/10/987446510.db2.gz MCIWCYISKJMUIW-QJPTWQEYSA-N 2 0 230.421 2.106 20 0 BEADRP C[C@H]1C[C@@H](n2ccc3c2cccc3C[NH3+])CC[NH2+]1 ZINC001246112164 987447025 /nfs/dbraw/zinc/44/70/25/987447025.db2.gz DCIUVSORTNRWRS-AAEUAGOBSA-N 2 0 243.354 2.413 20 0 BEADRP CSCC[C@H](C)[NH2+]C[C@@H]1CCC[NH2+][C@@H]1C ZINC001246110952 987447403 /nfs/dbraw/zinc/44/74/03/987447403.db2.gz MYUAWGLFQXCBBP-TUAOUCFPSA-N 2 0 230.421 2.106 20 0 BEADRP C[C@H]1CC[C@@H](n2ccc3c2cccc3C[NH3+])C[NH2+]1 ZINC001246114392 987455623 /nfs/dbraw/zinc/45/56/23/987455623.db2.gz MBZBIHKNNMWKOG-WCQYABFASA-N 2 0 243.354 2.413 20 0 BEADRP CC1CCC([NH2+]C[C@H]2C[NH2+]CC[C@@H]2C)CC1 ZINC001246117254 987458643 /nfs/dbraw/zinc/45/86/43/987458643.db2.gz YPTWZPOORIRRSU-YIFLHPOLSA-N 2 0 224.392 2.400 20 0 BEADRP CC(C)OCC[C@@H](C)[NH2+]C[C@H]1C[NH2+]CC[C@H]1C ZINC001246118738 987462653 /nfs/dbraw/zinc/46/26/53/987462653.db2.gz ICJZXARGCPZBPW-MGPQQGTHSA-N 2 0 242.407 2.025 20 0 BEADRP CC(C)OCC[C@@H](C)[NH2+]C[C@H]1C[NH2+]CC[C@@H]1C ZINC001246118732 987462656 /nfs/dbraw/zinc/46/26/56/987462656.db2.gz ICJZXARGCPZBPW-BFHYXJOUSA-N 2 0 242.407 2.025 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@@H]2C[NH2+]CC23CC3)C[C@H]1C ZINC001246135220 987486997 /nfs/dbraw/zinc/48/69/97/987486997.db2.gz SYORIVJODBGVPE-FVCCEPFGSA-N 2 0 222.376 2.153 20 0 BEADRP CCC[C@H](C)CC[C@H](C)[NH2+][C@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001246147122 987504937 /nfs/dbraw/zinc/50/49/37/987504937.db2.gz LBHJASKSCWHGJJ-YHQUGGNUSA-N 2 0 224.392 2.399 20 0 BEADRP CC(C)C1CCC([NH2+]C[C@@]2(F)CC[NH2+]C2)CC1 ZINC001246150062 987505960 /nfs/dbraw/zinc/50/59/60/987505960.db2.gz VFPLRWUCLOBWDG-JXQTWKCFSA-N 2 0 242.382 2.492 20 0 BEADRP CCCC[C@@H](CC(C)C)[NH2+][C@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001246148018 987508336 /nfs/dbraw/zinc/50/83/36/987508336.db2.gz OMKRWWJULFOSTE-FQUUOJAGSA-N 2 0 224.392 2.399 20 0 BEADRP CCc1ccc(CC[NH2+][C@@H](C)CC[NH2+]C)cc1 ZINC001246156666 987516689 /nfs/dbraw/zinc/51/66/89/987516689.db2.gz BCZYXBPCZZTFCK-ZDUSSCGKSA-N 2 0 234.387 2.379 20 0 BEADRP [NH3+]Cc1ccc2ccn([C@@H]3CCC[NH2+]C3)c2c1 ZINC001246167159 987527755 /nfs/dbraw/zinc/52/77/55/987527755.db2.gz CZSHFFFNQLRUHK-CYBMUJFWSA-N 2 0 229.327 2.025 20 0 BEADRP C[C@@H](c1cccnc1)[N@@H+]1C[C@H]2CC[NH+](C)C[C@H]2C1 ZINC001473702073 987530603 /nfs/dbraw/zinc/53/06/03/987530603.db2.gz BOAKPLVMAMDKDZ-CFVMTHIKSA-N 2 0 245.370 2.026 20 0 BEADRP C[C@@H]1CC[C@H](n2ccc3ccc(C[NH3+])cc32)C[NH2+]1 ZINC001246170275 987533688 /nfs/dbraw/zinc/53/36/88/987533688.db2.gz QOPBQKRCTRGDKD-RISCZKNCSA-N 2 0 243.354 2.413 20 0 BEADRP CNc1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC001246171804 987538524 /nfs/dbraw/zinc/53/85/24/987538524.db2.gz NYUQFOOEUSBPCI-YIONKMFJSA-N 2 0 245.370 2.101 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CC2(F)CCCCC2)CC[NH2+]1 ZINC001246176208 987541404 /nfs/dbraw/zinc/54/14/04/987541404.db2.gz MKHXBHHLELAXIH-RYUDHWBXSA-N 2 0 228.355 2.389 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[NH2+][C@@H](C)C1)c1ccccc1 ZINC001246174263 987545604 /nfs/dbraw/zinc/54/56/04/987545604.db2.gz FCPUWTXTUUUBFP-SCRDCRAPSA-N 2 0 218.344 2.478 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[C@@H](C)[NH2+][C@@H](C)C1)c1cccc(N)c1 ZINC001246177565 987551094 /nfs/dbraw/zinc/55/10/94/987551094.db2.gz UGHLVUHRIYOBPG-NWJSVONSSA-N 2 0 247.386 2.448 20 0 BEADRP CCCC1CCC([NH2+][C@H]2C[C@H]([NH3+])C2)CC1 ZINC001246182942 987553298 /nfs/dbraw/zinc/55/32/98/987553298.db2.gz BWNFZEJZKZWBGT-FLWUZPLOSA-N 2 0 210.365 2.425 20 0 BEADRP C[NH2+]CC[C@@H](C)[NH2+]C1C2CC3CC(C2)CC1C3 ZINC001246181337 987557246 /nfs/dbraw/zinc/55/72/46/987557246.db2.gz WEHANOKQMNVBLA-IBEXFIOLSA-N 2 0 236.403 2.399 20 0 BEADRP Fc1ccc2c(c1)CC[C@H]([NH2+]C[C@H]1CCC[NH2+]1)C2 ZINC001246185484 987558279 /nfs/dbraw/zinc/55/82/79/987558279.db2.gz BDGRFQJBMOZFEA-LSDHHAIUSA-N 2 0 248.345 2.025 20 0 BEADRP CSC(C)(C)C[C@@H](C)[NH2+]C[C@H]1CCC[NH2+]C1 ZINC001246195580 987589578 /nfs/dbraw/zinc/58/95/78/987589578.db2.gz ADOKDUGKLLGOJA-NEPJUHHUSA-N 2 0 244.448 2.496 20 0 BEADRP Cc1cccc2c1CC[C@@H]([NH2+]C[C@@H]1CCC[NH2+]1)C2 ZINC001246196385 987590958 /nfs/dbraw/zinc/59/09/58/987590958.db2.gz WNIFTBWSROALRJ-CABCVRRESA-N 2 0 244.382 2.194 20 0 BEADRP CC1(C)[C@@H]2C[C@@H]([NH2+]C[C@@H]3CCC[NH2+]C3)C[C@@H]21 ZINC001246199639 987596849 /nfs/dbraw/zinc/59/68/49/987596849.db2.gz YDALLTRUGBPJNN-LPWJVIDDSA-N 2 0 222.376 2.010 20 0 BEADRP CC[C@@H](C)OCC[C@@H](C)[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC001246204994 987597812 /nfs/dbraw/zinc/59/78/12/987597812.db2.gz KGOQARZDIXJMSC-AAVRWANBSA-N 2 0 242.407 2.440 20 0 BEADRP CC[C@H]1CC[C@@H]([NH2+][C@@H]2CCC[C@@H]([NH3+])C2)C1 ZINC001246206455 987602277 /nfs/dbraw/zinc/60/22/77/987602277.db2.gz PISDPAXZQOFEBA-UMSGYPCISA-N 2 0 210.365 2.425 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+][C@H]2CC[C@@H]3CCC[C@@H]32)CN1 ZINC001246228865 987625113 /nfs/dbraw/zinc/62/51/13/987625113.db2.gz GYCLRYSFJHDAOT-HPCHECBXSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CCCCc2ccccn2)CC[NH2+]1 ZINC001246237222 987635515 /nfs/dbraw/zinc/63/55/15/987635515.db2.gz HEMOWHIGAUBTBO-DZGCQCFKSA-N 2 0 247.386 2.134 20 0 BEADRP [NH2+]=C(NC1CC[NH2+]CC1)C1CCCCCC1 ZINC001246239267 987637032 /nfs/dbraw/zinc/63/70/32/987637032.db2.gz IRFACQDZRNODRV-UHFFFAOYSA-N 2 0 223.364 2.276 20 0 BEADRP [NH2+]=C(N[C@H]1CCC[NH2+]C1)C1CCCCCC1 ZINC001246240755 987640454 /nfs/dbraw/zinc/64/04/54/987640454.db2.gz OKAUASIIOVFCTG-LBPRGKRZSA-N 2 0 223.364 2.276 20 0 BEADRP Cc1ccnc(CCC[NH2+][C@@H]2CC[NH2+][C@@H](C)C2)c1 ZINC001246241289 987643058 /nfs/dbraw/zinc/64/30/58/987643058.db2.gz RCACJZGTGMXVLC-DZGCQCFKSA-N 2 0 247.386 2.053 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CC(C)(C)C[NH3+])C[C@H]1C ZINC001246243443 987645716 /nfs/dbraw/zinc/64/57/16/987645716.db2.gz GKEFDWYGYPYNCF-IJLUTSLNSA-N 2 0 212.381 2.386 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C2CCCCCCC2)C[NH2+]1 ZINC001246242298 987646365 /nfs/dbraw/zinc/64/63/65/987646365.db2.gz DCMVDFQFPFSAHH-DGCLKSJQSA-N 2 0 210.365 2.439 20 0 BEADRP CC[N@@H+]1CCC[C@H](C[NH2+]C2CC(C(F)F)C2)C1 ZINC001116619927 987646978 /nfs/dbraw/zinc/64/69/78/987646978.db2.gz YFDOBEUEPODDMM-VOMCLLRMSA-N 2 0 246.345 2.352 20 0 BEADRP C[C@@H]1CC[C@H](N2CC[C@H]([NH3+])c3ccccc32)C[NH2+]1 ZINC001246261853 987655658 /nfs/dbraw/zinc/65/56/58/987655658.db2.gz NMXLGPOOYGNFOB-DYEKYZERSA-N 2 0 245.370 2.037 20 0 BEADRP Cc1cc(C[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)cc(C)n1 ZINC001474193514 987660330 /nfs/dbraw/zinc/66/03/30/987660330.db2.gz NRBUNPDAYJUKCR-GASCZTMLSA-N 2 0 247.386 2.128 20 0 BEADRP CCCCC(=O)[C@H](C)NC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC001246271897 987666890 /nfs/dbraw/zinc/66/68/90/987666890.db2.gz JEXOYBLWICLXAZ-ACJTYDJDSA-N 2 0 238.375 2.007 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H](c2ccncc2)C2CC2)CC[NH2+]1 ZINC001246279791 987672623 /nfs/dbraw/zinc/67/26/23/987672623.db2.gz QGMYWPLQPMECCO-KCPJHIHWSA-N 2 0 245.370 2.263 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@@H](c2ccncc2)C2CC2)CC[NH2+]1 ZINC001246279789 987673422 /nfs/dbraw/zinc/67/34/22/987673422.db2.gz QGMYWPLQPMECCO-BYCMXARLSA-N 2 0 245.370 2.263 20 0 BEADRP CCC[C@@H](C)CC[C@@H](C)[NH2+]CCN(C)CC[NH3+] ZINC001246284726 987677606 /nfs/dbraw/zinc/67/76/06/987677606.db2.gz OEIBQLBXCRPIFY-ZIAGYGMSSA-N 2 0 243.439 2.071 20 0 BEADRP C[C@H]1C[C@H]([NH2+][C@@H]2C[C@H]2c2ccc(F)cc2)CC[NH2+]1 ZINC001246283664 987678196 /nfs/dbraw/zinc/67/81/96/987678196.db2.gz XENXYSUKPLCSPY-OADPDTJPSA-N 2 0 248.345 2.412 20 0 BEADRP Cc1cccc(C(=[NH2+])N[C@H]2CC[NH2+][C@H](C)C2)c1 ZINC001246286357 987678343 /nfs/dbraw/zinc/67/83/43/987678343.db2.gz WVPHVKSNOFORRI-YPMHNXCESA-N 2 0 231.343 2.050 20 0 BEADRP C[C@@H]1C[C@H](N[C@@H]2CCc3ccc(O)cc32)CC[NH2+]1 ZINC001246285038 987678929 /nfs/dbraw/zinc/67/89/29/987678929.db2.gz FDWCCVPCWHXMTQ-IXPVHAAZSA-N 2 0 246.354 2.110 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2C[C@H]2c2ccc(F)cc2)CC[NH2+]1 ZINC001246283668 987679324 /nfs/dbraw/zinc/67/93/24/987679324.db2.gz XENXYSUKPLCSPY-SDJAHQOYSA-N 2 0 248.345 2.412 20 0 BEADRP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccccc1N ZINC001246294487 987685894 /nfs/dbraw/zinc/68/58/94/987685894.db2.gz VUJHDDMDEMZPST-FKJOKYEKSA-N 2 0 245.370 2.202 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@H](C)CC(C)(C)SC ZINC001246312063 987710530 /nfs/dbraw/zinc/71/05/30/987710530.db2.gz FJUUUAUTIJYTOZ-NXEZZACHSA-N 2 0 218.410 2.234 20 0 BEADRP [NH3+]CCc1ccc2c(ccn2[C@@H]2CCC[NH2+]C2)c1 ZINC001246310815 987713655 /nfs/dbraw/zinc/71/36/55/987713655.db2.gz QZQCCPUYTYVBNE-CQSZACIVSA-N 2 0 243.354 2.067 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+]C1CC(C)(C)OC(C)(C)C1 ZINC001246314025 987716181 /nfs/dbraw/zinc/71/61/81/987716181.db2.gz NAEPKSONKVFHRN-SNVBAGLBSA-N 2 0 228.380 2.050 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]C(C)(C)c2ccncc2)CC[NH2+]1 ZINC001246329022 987734892 /nfs/dbraw/zinc/73/48/92/987734892.db2.gz MWGLSKBINULLTL-AAEUAGOBSA-N 2 0 233.359 2.047 20 0 BEADRP C[C@@H]1CCCC[C@H]1[NH2+][C@@H]1CC[NH2+][C@@H](C)C1 ZINC001246336139 987745989 /nfs/dbraw/zinc/74/59/89/987745989.db2.gz SQSCZDJTWXXKFS-YVECIDJPSA-N 2 0 210.365 2.295 20 0 BEADRP CCCCCC[C@@H](C)[NH2+][C@H]1CC[NH2+]C[C@H]1OC ZINC001246346206 987750146 /nfs/dbraw/zinc/75/01/46/987750146.db2.gz FLAHNLOJDASICT-HZSPNIEDSA-N 2 0 242.407 2.312 20 0 BEADRP C[Si](C)(C)C([NH2+][C@H]1CC[NH2+]C1)[Si](C)(C)C ZINC001246340320 987750510 /nfs/dbraw/zinc/75/05/10/987750510.db2.gz UGKBYCDPGNBCDF-JTQLQIEISA-N 2 0 244.531 2.061 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCCCCCCCO)CC[NH2+]1 ZINC001246340594 987750682 /nfs/dbraw/zinc/75/06/82/987750682.db2.gz IWBZJKRDZQPOMG-KGLIPLIRSA-N 2 0 242.407 2.049 20 0 BEADRP CCCC[C@@H](CCC)[NH2+][C@H]1CC[NH2+]C[C@H]1OC ZINC001246346752 987756049 /nfs/dbraw/zinc/75/60/49/987756049.db2.gz FVNGSBGYNAXZCE-HZSPNIEDSA-N 2 0 242.407 2.312 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)CC1 ZINC001246357707 987763257 /nfs/dbraw/zinc/76/32/57/987763257.db2.gz AFTUZZYUXFPOJO-VEDUHTKKSA-N 2 0 222.376 2.438 20 0 BEADRP Fc1ccc2c(c1)CC[C@@H]([NH2+][C@@H]1CCCNC1)C2 ZINC001246357210 987764562 /nfs/dbraw/zinc/76/45/62/987764562.db2.gz KXHAJXYRNBBECG-HUUCEWRRSA-N 2 0 248.345 2.025 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC2Cc3ccccc3C2)CC[NH2+]1 ZINC001246378647 987776022 /nfs/dbraw/zinc/77/60/22/987776022.db2.gz XXVHFXVHSSFDOW-MLGOLLRUSA-N 2 0 244.382 2.132 20 0 BEADRP CCCC1([NH2+][C@@H]2CC[NH2+][C@@H](C)C2)CCC1 ZINC001246390653 987779867 /nfs/dbraw/zinc/77/98/67/987779867.db2.gz YJWHDOPHOYMPIW-NWDGAFQWSA-N 2 0 210.365 2.439 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C(C)(C)CC2CC2)CC[NH2+]1 ZINC001246396453 987783506 /nfs/dbraw/zinc/78/35/06/987783506.db2.gz ZQABMZRUPMOBFC-PWSUYJOCSA-N 2 0 210.365 2.295 20 0 BEADRP CCCCCC[C@@H](CCC)[NH2+]CCNCC[NH3+] ZINC001246406659 987787304 /nfs/dbraw/zinc/78/73/04/987787304.db2.gz UGVFSHSFSCLILL-CQSZACIVSA-N 2 0 243.439 2.263 20 0 BEADRP CC[C@H](C)C[C@H](CC)[NH2+][C@H]1CC12C[NH2+]C2 ZINC001246445290 987802384 /nfs/dbraw/zinc/80/23/84/987802384.db2.gz NSVMTLAYDUHRQA-SRVKXCTJSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CC2(CC3CC3)CC2)CC[NH2+]1 ZINC001246430958 987794841 /nfs/dbraw/zinc/79/48/41/987794841.db2.gz HQZOBZJCZUKCEB-YPMHNXCESA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C(C)(C)Cc2ccccn2)CC[NH2+]1 ZINC001246432848 987798141 /nfs/dbraw/zinc/79/81/41/987798141.db2.gz IDRFBNURGBYYEM-OLZOCXBDSA-N 2 0 247.386 2.133 20 0 BEADRP CC(C)CC(CC(C)C)[NH2+][C@@H]1CC12C[NH2+]C2 ZINC001246441861 987800623 /nfs/dbraw/zinc/80/06/23/987800623.db2.gz AITOVKBEOBNRHF-CYBMUJFWSA-N 2 0 224.392 2.399 20 0 BEADRP C[NH2+]CC[C@H](C)[NH2+]C[C@@H]1CCC(C)(C)C1 ZINC001246432888 987800844 /nfs/dbraw/zinc/80/08/44/987800844.db2.gz IQJWVICSWHZZCS-NWDGAFQWSA-N 2 0 212.381 2.400 20 0 BEADRP Cc1ccc(CC[C@H](C)[NH2+][C@@H]2CC23C[NH2+]C3)cc1 ZINC001246445169 987802655 /nfs/dbraw/zinc/80/26/55/987802655.db2.gz NEPOVSUAVOJIFP-DZGCQCFKSA-N 2 0 244.382 2.268 20 0 BEADRP Cc1ncccc1[C@H]([NH2+]C1CC[NH2+]CC1)C1CC1 ZINC001246443168 987802935 /nfs/dbraw/zinc/80/29/35/987802935.db2.gz GHWMLNXICDVKOI-OAHLLOKOSA-N 2 0 245.370 2.183 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@@H]3C[C@H]([C@@H]2C)C3(C)C)C[NH2+]1 ZINC001246443137 987803744 /nfs/dbraw/zinc/80/37/44/987803744.db2.gz LTWSPMIYQPPNNI-BBMNEWJDSA-N 2 0 236.403 2.397 20 0 BEADRP CC(C)C[C@H](C)C[C@H](C)[NH2+][C@@H]1CC12C[NH2+]C2 ZINC001246446764 987805145 /nfs/dbraw/zinc/80/51/45/987805145.db2.gz TYQVJQLOHIKWML-RWMBFGLXSA-N 2 0 224.392 2.399 20 0 BEADRP C(C1CC1)C1([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)CC1 ZINC001246447914 987807349 /nfs/dbraw/zinc/80/73/49/987807349.db2.gz XQENUTYZUYUKCS-FUNVUKJBSA-N 2 0 220.360 2.192 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2Cc3ccc(F)cc3C2)CC[NH2+]1 ZINC001246451893 987809142 /nfs/dbraw/zinc/80/91/42/987809142.db2.gz IFIOPLPUHFROKX-KMUNFCNLSA-N 2 0 248.345 2.023 20 0 BEADRP CCC[C@@]1(C[NH2+]C2CCCCC2)CC[NH2+]1 ZINC001246456760 987812287 /nfs/dbraw/zinc/81/22/87/987812287.db2.gz OIUDKNDRWYJZHK-ZDUSSCGKSA-N 2 0 210.365 2.441 20 0 BEADRP CCC[C@@]1(C[NH2+][C@H]2CC[C@@H](C)C2)CC[NH2+]1 ZINC001246455676 987813214 /nfs/dbraw/zinc/81/32/14/987813214.db2.gz IZPLLNVFEAYKCO-AGIUHOORSA-N 2 0 210.365 2.297 20 0 BEADRP CC1CCC([NH2+]C[C@@]2(C)CCC[NH2+]2)CC1 ZINC001246455299 987813904 /nfs/dbraw/zinc/81/39/04/987813904.db2.gz IVZWGSDUYMKMLU-WXRRBKDZSA-N 2 0 210.365 2.297 20 0 BEADRP CCCCC[C@H](C)[NH2+]CCC[NH2+]CCCC[NH3+] ZINC001246456605 987814080 /nfs/dbraw/zinc/81/40/80/987814080.db2.gz JXABRESOJMTPBC-AWEZNQCLSA-N 3 0 243.439 2.263 20 0 BEADRP CCC[C@@]1(C[NH2+][C@@H]2CC[C@@H](C)C2)CC[NH2+]1 ZINC001246455678 987814543 /nfs/dbraw/zinc/81/45/43/987814543.db2.gz IZPLLNVFEAYKCO-UPJWGTAASA-N 2 0 210.365 2.297 20 0 BEADRP C[NH2+][C@H]1C[C@H]([NH2+]C2CCC(C)(C)CC2)C1 ZINC001246462435 987822090 /nfs/dbraw/zinc/82/20/90/987822090.db2.gz SBAIVIGAKZCHDU-HAQNSBGRSA-N 2 0 210.365 2.295 20 0 BEADRP CC1(C)CCC[C@H]([NH2+]C[C@@H]2CC[NH2+]C[C@@H]2F)C1 ZINC001246475959 987831720 /nfs/dbraw/zinc/83/17/20/987831720.db2.gz IAFLBDDFXVZTFF-AVGNSLFASA-N 2 0 242.382 2.492 20 0 BEADRP C[C@@H]1CC[C@H](N[C@@H]2CCc3sccc32)C[NH2+]1 ZINC001246478160 987834060 /nfs/dbraw/zinc/83/40/60/987834060.db2.gz LRROKOXPBVEPJQ-JFGNBEQYSA-N 2 0 236.384 2.466 20 0 BEADRP C[NH2+][C@H]1C[C@@H]([NH2+][C@@H]2CC[C@@H](C)[C@H](C)C2)C1 ZINC001246496634 987849269 /nfs/dbraw/zinc/84/92/69/987849269.db2.gz PEMDERSRFFMBNC-VEGXAWMVSA-N 2 0 210.365 2.151 20 0 BEADRP CNc1cccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)c1 ZINC001246506311 987859125 /nfs/dbraw/zinc/85/91/25/987859125.db2.gz PTEVOLABFMBMDY-YIONKMFJSA-N 2 0 245.370 2.101 20 0 BEADRP CCCC[C@@H](CCC)[N@@H+]1CCO[C@H](CC[NH3+])C1 ZINC001246536319 987893158 /nfs/dbraw/zinc/89/31/58/987893158.db2.gz ULRNRQAORQYOND-ZIAGYGMSSA-N 2 0 242.407 2.395 20 0 BEADRP CCCCC[C@H](CC)[N@@H+]1CCO[C@@H](CC[NH3+])C1 ZINC001246535691 987893192 /nfs/dbraw/zinc/89/31/92/987893192.db2.gz OTSUEILOINSQML-KBPBESRZSA-N 2 0 242.407 2.395 20 0 BEADRP CCCCC[C@@H](CC)[N@@H+]1CCO[C@@H](CC[NH3+])C1 ZINC001246535692 987893996 /nfs/dbraw/zinc/89/39/96/987893996.db2.gz OTSUEILOINSQML-KGLIPLIRSA-N 2 0 242.407 2.395 20 0 BEADRP CCCC[C@@H](CC)[N@@H+]1C[C@H](C)[C@H](C[NH3+])C1 ZINC001246539285 987900576 /nfs/dbraw/zinc/90/05/76/987900576.db2.gz GYOWGEYBKJEKBX-YNEHKIRRSA-N 2 0 212.381 2.482 20 0 BEADRP CC(C)COCC[C@@H](C)[N@@H+]1CCC[C@@H]([NH3+])CC1 ZINC001246541816 987910075 /nfs/dbraw/zinc/91/00/75/987910075.db2.gz NSEKRSUTZPXJSL-ZIAGYGMSSA-N 2 0 242.407 2.251 20 0 BEADRP C[C@@H](CC(F)(F)F)[N@@H+]1CCC[C@@H]([NH3+])CC1 ZINC001246548207 987936128 /nfs/dbraw/zinc/93/61/28/987936128.db2.gz SUJLEHKQVXJYME-DTWKUNHWSA-N 2 0 224.270 2.141 20 0 BEADRP [NH3+]C[C@@]1(F)CCC[N@@H+]([C@@H]2CCCSC2)CC1 ZINC001246551066 987941162 /nfs/dbraw/zinc/94/11/62/987941162.db2.gz OUDAKWATTAVEMW-VXGBXAGGSA-N 2 0 246.395 2.035 20 0 BEADRP C[C@@H](CC1CC1)[N@@H+]1CCC[C@](F)(C[NH3+])CC1 ZINC001246552846 987950218 /nfs/dbraw/zinc/95/02/18/987950218.db2.gz VVDUYNXMIGZXFI-WCQYABFASA-N 2 0 228.355 2.328 20 0 BEADRP C[C@]1([NH3+])CCC[N@@H+](C2CCSCC2)CC1 ZINC001246552432 987955606 /nfs/dbraw/zinc/95/56/06/987955606.db2.gz OJQMSQQWXOPEOT-LBPRGKRZSA-N 2 0 228.405 2.085 20 0 BEADRP CCSC[C@@H](C)[N@@H+]1CCC[C@](C)([NH3+])CC1 ZINC001246556420 987964917 /nfs/dbraw/zinc/96/49/17/987964917.db2.gz ZRJCJXVVEBJJOO-NEPJUHHUSA-N 2 0 230.421 2.331 20 0 BEADRP CC[C@@H]1CC[C@H]([N@@H+]2CCC(F)(F)[C@@H](C[NH3+])C2)C1 ZINC001246557586 987972495 /nfs/dbraw/zinc/97/24/95/987972495.db2.gz MIZWOROXXRCCCN-WOPDTQHZSA-N 2 0 246.345 2.481 20 0 BEADRP CCOCC[C@H](C)[N@H+]1CC[C@@H](C[NH3+])[C@@H](C)CC1 ZINC001246557351 987973806 /nfs/dbraw/zinc/97/38/06/987973806.db2.gz KQYSUULNKBPTPX-IHRRRGAJSA-N 2 0 242.407 2.108 20 0 BEADRP CSCC[C@H](C)[N@@H+]1CCC[C@@H](C[NH3+])[C@H](C)C1 ZINC001246559538 987984620 /nfs/dbraw/zinc/98/46/20/987984620.db2.gz BFLYFGWCWZSRHI-AGIUHOORSA-N 2 0 244.448 2.435 20 0 BEADRP CCC(CC)[N@H+]1CC[C@@H](C[NH3+])[C@@H](C)CC1 ZINC001246561928 987993312 /nfs/dbraw/zinc/99/33/12/987993312.db2.gz USYNDFFNBYPQKT-RYUDHWBXSA-N 2 0 212.381 2.482 20 0 BEADRP C[C@@H]1CC[N@@H+]([C@H]2C[C@H]3C[C@H]3C2)CC[C@@H]1C[NH3+] ZINC001246561417 987999418 /nfs/dbraw/zinc/99/94/18/987999418.db2.gz SLTVLHYHBFMFMJ-POQQGIQPSA-N 2 0 222.376 2.092 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H](C)c1ccnc(Cl)c1 ZINC001118059799 988000751 /nfs/dbraw/zinc/00/07/51/988000751.db2.gz STQOJPSTTQKVSU-ZJUUUORDSA-N 2 0 241.766 2.241 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@H]1CCc2c1cccc2F ZINC001118060116 988002129 /nfs/dbraw/zinc/00/21/29/988002129.db2.gz WHLNQSTWAYMGCC-HZMBPMFUSA-N 2 0 236.334 2.401 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2CCC(F)(F)[C@@H](C)C2)CC[NH2+]1 ZINC001246562940 988003146 /nfs/dbraw/zinc/00/31/46/988003146.db2.gz IKNHWNOWWILWQV-HBNTYKKESA-N 2 0 232.318 2.104 20 0 BEADRP Cc1cccc2c1C[N@H+]([C@H]1CC[NH2+][C@@H](C)C1)C2 ZINC001246566662 988030292 /nfs/dbraw/zinc/03/02/92/988030292.db2.gz IPSNYJRUCORMBQ-JSGCOSHPSA-N 2 0 230.355 2.451 20 0 BEADRP C[C@@H]1C[N@@H+]([C@@H]2C[C@H]3C[C@H]3C2)CCC[C@H]1C[NH3+] ZINC001246571795 988061704 /nfs/dbraw/zinc/06/17/04/988061704.db2.gz WYZLHAYFWBAYGA-XHJNMGKDSA-N 2 0 222.376 2.092 20 0 BEADRP C[NH2+]CC[C@H](C)[N@@H+]1CCC[C@H](C)[C@H](C)C1 ZINC001246572969 988066222 /nfs/dbraw/zinc/06/62/22/988066222.db2.gz LNHDZFKQQNZENQ-XQQFMLRXSA-N 2 0 212.381 2.352 20 0 BEADRP CCSCC[N@@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001118197863 988088458 /nfs/dbraw/zinc/08/84/58/988088458.db2.gz FCJGKRZXVTYCQA-UHFFFAOYSA-N 2 0 242.432 2.205 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2CCC[C@H](C)[C@@H](C)C2)CC[NH2+]1 ZINC001246578143 988090497 /nfs/dbraw/zinc/09/04/97/988090497.db2.gz YJQMPHGCOLYBLB-IGQOVBAYSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@]1(C[NH3+])CCC[N@@H+]([C@H]2CCCSC2)CC1 ZINC001246579959 988096641 /nfs/dbraw/zinc/09/66/41/988096641.db2.gz VOUGVAJGNLRLPA-QWHCGFSZSA-N 2 0 242.432 2.333 20 0 BEADRP C[C@]1(C[NH3+])CCC[N@@H+]([C@@H]2CCCSC2)CC1 ZINC001246579957 988101814 /nfs/dbraw/zinc/10/18/14/988101814.db2.gz VOUGVAJGNLRLPA-OLZOCXBDSA-N 2 0 242.432 2.333 20 0 BEADRP CSCC[C@H](C)[N@@H+]1CCCC[C@@H](C[NH3+])C1 ZINC001246580937 988108348 /nfs/dbraw/zinc/10/83/48/988108348.db2.gz JCAFOVJBKGDBBC-RYUDHWBXSA-N 2 0 230.421 2.189 20 0 BEADRP CSCC[C@H](C)[N@@H+]1CCCC[C@H](C[NH3+])C1 ZINC001246580935 988116955 /nfs/dbraw/zinc/11/69/55/988116955.db2.gz JCAFOVJBKGDBBC-NWDGAFQWSA-N 2 0 230.421 2.189 20 0 BEADRP CC(C)OCC[C@@H](C)[N@@H+]1CCCC[C@H](C[NH3+])C1 ZINC001246584167 988122648 /nfs/dbraw/zinc/12/26/48/988122648.db2.gz SOQUJIIKDGVMBP-ZIAGYGMSSA-N 2 0 242.407 2.251 20 0 BEADRP C[C@@H]1C[C@@H]([N@@H+]2CCCC[C@](C)(C[NH3+])C2)CCO1 ZINC001246585581 988139900 /nfs/dbraw/zinc/13/99/00/988139900.db2.gz PIEDEAYFKWHYIY-HZSPNIEDSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@@H]1CC[C@H]([NH+]2CC(C)(C[NH3+])C2)C[C@H]1C ZINC001246586495 988145718 /nfs/dbraw/zinc/14/57/18/988145718.db2.gz BFKBSLADLIXBPI-UTUOFQBUSA-N 2 0 210.365 2.092 20 0 BEADRP Cc1cccc2c1CC[C@@H]([NH+]1CC(C)(C[NH3+])C1)C2 ZINC001246588893 988160482 /nfs/dbraw/zinc/16/04/82/988160482.db2.gz LRMPTROAWKSOJL-CQSZACIVSA-N 2 0 244.382 2.133 20 0 BEADRP CCc1ccc(C[C@@H](C)[NH+]2CC(C)(C[NH3+])C2)cc1 ZINC001246589986 988163089 /nfs/dbraw/zinc/16/30/89/988163089.db2.gz QTVJCMGUCRVZEL-CYBMUJFWSA-N 2 0 246.398 2.461 20 0 BEADRP CCCC1CCC([NH+]2CC(C[NH2+]C)C2)CC1 ZINC001246593134 988175127 /nfs/dbraw/zinc/17/51/27/988175127.db2.gz AGJUOCOFBDSWOX-UHFFFAOYSA-N 2 0 224.392 2.497 20 0 BEADRP CCC[C@@H](C)CC[C@@H](C)[NH+]1CC(C[NH3+])C1 ZINC001246594106 988183888 /nfs/dbraw/zinc/18/38/88/988183888.db2.gz JSJLJIJMPVOTKF-VXGBXAGGSA-N 2 0 212.381 2.482 20 0 BEADRP CCOCC[C@H](C)[N@@H+]1CCCC[C@](C)(C[NH3+])C1 ZINC001246595227 988186596 /nfs/dbraw/zinc/18/65/96/988186596.db2.gz SHSOHVYPPUUEDK-UONOGXRCSA-N 2 0 242.407 2.252 20 0 BEADRP C[C@H]1C[C@H]([N@@H+]2CCCC[C@](C)(C[NH3+])C2)CCO1 ZINC001246594243 988186747 /nfs/dbraw/zinc/18/67/47/988186747.db2.gz PIEDEAYFKWHYIY-BFHYXJOUSA-N 2 0 240.391 2.005 20 0 BEADRP CC1(C[NH3+])C[NH+](C2CCC(C)(C)CC2)C1 ZINC001246597751 988200096 /nfs/dbraw/zinc/20/00/96/988200096.db2.gz MOYNPNLTLWIWIV-UHFFFAOYSA-N 2 0 210.365 2.236 20 0 BEADRP CC[C@@H](C)C[C@@H](CC)[NH+]1CC(C)(C[NH3+])C1 ZINC001246602429 988214564 /nfs/dbraw/zinc/21/45/64/988214564.db2.gz XIKVOOBDSNPDFT-VXGBXAGGSA-N 2 0 212.381 2.482 20 0 BEADRP CC(C)OC1CCC([NH+]2CC(C)(C[NH3+])C2)CC1 ZINC001246602469 988216194 /nfs/dbraw/zinc/21/61/94/988216194.db2.gz XVGGMOKKWTYNDK-UHFFFAOYSA-N 2 0 240.391 2.003 20 0 BEADRP CC[C@H](C)C[C@H](CC)[NH+]1CC(C)(C[NH3+])C1 ZINC001246602428 988218996 /nfs/dbraw/zinc/21/89/96/988218996.db2.gz XIKVOOBDSNPDFT-RYUDHWBXSA-N 2 0 212.381 2.482 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2CCC[C@]23CCC[NH2+]C3)C1 ZINC001246608776 988225868 /nfs/dbraw/zinc/22/58/68/988225868.db2.gz JQSFOCFCROBADP-RDBSUJKOSA-N 2 0 222.376 2.393 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2CC[C@H]3C[NH2+]CC[C@H]32)C[C@@H]1C ZINC001246617537 988252737 /nfs/dbraw/zinc/25/27/37/988252737.db2.gz DBILPCBQUSZUSJ-CAEXGNQWSA-N 2 0 236.403 2.495 20 0 BEADRP CC[C@H](CC(C)C)[N@@H+]1CC[C@H]2C[NH2+]C[C@H]21 ZINC001246634124 988276062 /nfs/dbraw/zinc/27/60/62/988276062.db2.gz AIQIMIYWYPRPJE-YNEHKIRRSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH+]2CCC(F)(C[NH3+])CC2)C1 ZINC001246627584 988294221 /nfs/dbraw/zinc/29/42/21/988294221.db2.gz NPGSAJPNQVOKIP-VXGBXAGGSA-N 2 0 228.355 2.328 20 0 BEADRP CC1(C)CCC[C@@H]([N@@H+]2CC[C@@H]3[NH2+]CC[C@H]32)C1 ZINC001246629778 988309142 /nfs/dbraw/zinc/30/91/42/988309142.db2.gz GLOOVYGWHCNHOJ-FRRDWIJNSA-N 2 0 222.376 2.391 20 0 BEADRP C[C@H]1C[C@H]([N@@H+]2CC[C@@H]3CC[NH2+][C@@H]3C2)C[C@@H](C)C1 ZINC001246633917 988314813 /nfs/dbraw/zinc/31/48/13/988314813.db2.gz FMERGSXVHUKCSD-XPABHHOTSA-N 2 0 236.403 2.495 20 0 BEADRP Cc1ccc(C[C@H](C)N2CC[C@@H]3[NH2+]CC[C@H]32)cc1 ZINC001246634377 988316953 /nfs/dbraw/zinc/31/69/53/988316953.db2.gz NBLRPAXAKYJHGL-CWRNSKLLSA-N 2 0 244.382 2.362 20 0 BEADRP C[C@H]1CCC[C@H]([N@@H+]2CC[C@H]3[NH2+]CC[C@H]32)C1 ZINC001246636229 988323841 /nfs/dbraw/zinc/32/38/41/988323841.db2.gz FQPZPGIEUVFHPP-WUHRBBMRSA-N 2 0 208.349 2.001 20 0 BEADRP C1[C@@H]2C[C@@H]([N@@H+]3CCCC[C@]34CC[NH2+]C4)C[C@H]12 ZINC001246645853 988360864 /nfs/dbraw/zinc/36/08/64/988360864.db2.gz WSKZRICTSLUXDG-XJFOESAGSA-N 2 0 220.360 2.003 20 0 BEADRP C[C@@H]1CC([N@@H+]2CC[C@@H]3C[NH2+]C[C@H]3C2)C[C@@H](C)C1 ZINC001246647251 988367328 /nfs/dbraw/zinc/36/73/28/988367328.db2.gz JKXBESTWCJFNSE-FQUUOJAGSA-N 2 0 236.403 2.352 20 0 BEADRP CC[C@H](CC(C)C)[N@@H+]1C[C@@H]2CC[NH2+][C@@H]2C1 ZINC001246649154 988368958 /nfs/dbraw/zinc/36/89/58/988368958.db2.gz ALOGTNNSRSGCFN-YNEHKIRRSA-N 2 0 210.365 2.105 20 0 BEADRP CC1(C)[C@@H]2C[C@@H]([N@@H+]3C[C@H]4CCC[NH2+][C@H]4C3)C[C@@H]21 ZINC001246655387 988385259 /nfs/dbraw/zinc/38/52/59/988385259.db2.gz HPOUQBDEMLCUHL-POQQGIQPSA-N 2 0 234.387 2.105 20 0 BEADRP C[C@H]1C[C@H]([N@H+]2C[C@@H]3[C@@H]([NH3+])[C@@H]3C2)CC(C)(C)C1 ZINC001246655314 988385526 /nfs/dbraw/zinc/38/55/26/988385526.db2.gz HENGGZJFUBQPRD-JZRPKSSGSA-N 2 0 222.376 2.090 20 0 BEADRP CCCC[C@@H](CC(C)C)[N@H+]1C[C@@H]2[C@@H]([NH3+])[C@@H]2C1 ZINC001246657455 988385820 /nfs/dbraw/zinc/38/58/20/988385820.db2.gz MHCHQAMZUXPSLY-IGQOVBAYSA-N 2 0 224.392 2.480 20 0 BEADRP CC[C@H](CC(C)C)[N@@H+]1C[C@H]2CCC[NH2+][C@H]2C1 ZINC001246657337 988386762 /nfs/dbraw/zinc/38/67/62/988386762.db2.gz LYAPPIBBZBABMU-MCIONIFRSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1C[C@H]([N@H+]2C[C@@H]3[C@@H]([NH3+])[C@@H]3C2)CC(C)(C)C1 ZINC001246655311 988386931 /nfs/dbraw/zinc/38/69/31/988386931.db2.gz HENGGZJFUBQPRD-FHUSYTEZSA-N 2 0 222.376 2.090 20 0 BEADRP CC(C)C[C@@H](C)C[C@H](C)[N@H+]1C[C@@H]2[C@@H]([NH3+])[C@@H]2C1 ZINC001246661408 988396562 /nfs/dbraw/zinc/39/65/62/988396562.db2.gz WVMYHYMFPFBHBB-BJJPWKGXSA-N 2 0 224.392 2.336 20 0 BEADRP CC1(C)[C@@H]2C[C@@H]([N@@H+]3C[C@H]4CCC[C@@]4([NH3+])C3)C[C@@H]21 ZINC001246661434 988397627 /nfs/dbraw/zinc/39/76/27/988397627.db2.gz FPECUQPQFVHLJZ-XLFUENPSSA-N 2 0 234.387 2.234 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2C[C@H]3CCC[NH2+][C@H]3C2)C[C@@H]1C ZINC001246661418 988398239 /nfs/dbraw/zinc/39/82/39/988398239.db2.gz XDSBXHAHRYUXKM-SEBNEYGDSA-N 2 0 236.403 2.495 20 0 BEADRP CCC[C@@H](CC)[N@@H+]1C[C@H]2CCC[C@@]2([NH3+])C1 ZINC001246665813 988403055 /nfs/dbraw/zinc/40/30/55/988403055.db2.gz QQOWPRYRYAKAIZ-JHJVBQTASA-N 2 0 210.365 2.378 20 0 BEADRP CCCC[C@H](CCC)[N@H+]1C[C@@H]2[C@H]([NH3+])[C@@H]2C1 ZINC001246667074 988410798 /nfs/dbraw/zinc/41/07/98/988410798.db2.gz XRVVYGXYMYXATN-RVMXOQNASA-N 2 0 210.365 2.234 20 0 BEADRP C[C@H]1C[C@@H]([N@H+](C)CCOc2ccccc2)CC[NH2+]1 ZINC001246782716 988464568 /nfs/dbraw/zinc/46/45/68/988464568.db2.gz ULLLNXWVVYVOSL-KBPBESRZSA-N 2 0 248.370 2.138 20 0 BEADRP C[NH2+]CC[C@H](C)[N@H+](C)CCc1ccc(C)cc1 ZINC001246812988 988496999 /nfs/dbraw/zinc/49/69/99/988496999.db2.gz HBIPLZHKOTYFNS-AWEZNQCLSA-N 2 0 234.387 2.467 20 0 BEADRP Fc1cccc2c1CN(C1C[C@H]3CC[C@@H](C1)[NH2+]3)C2 ZINC001246826780 988518304 /nfs/dbraw/zinc/51/83/04/988518304.db2.gz XVWZGGGHYFLYQC-FUNVUKJBSA-N 2 0 246.329 2.424 20 0 BEADRP C[C@@H]1C[C@@H](C)C[NH+]([C@H]2CC[NH2+][C@H](C)C2)C1 ZINC001246842035 988548967 /nfs/dbraw/zinc/54/89/67/988548967.db2.gz SWIAYLRCUHHJGQ-LPWJVIDDSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@@H]1C[C@@H]([N@H+](C)C[C@@H]2CC2(C)C)CC[NH2+]1 ZINC001246846182 988558425 /nfs/dbraw/zinc/55/84/25/988558425.db2.gz NDDBSKYPKCPMMD-WOPDTQHZSA-N 2 0 210.365 2.105 20 0 BEADRP C[NH2+]Cc1cccc(NC2C[C@H]3CC[C@@H](C2)[NH2+]3)c1 ZINC001246853023 988572660 /nfs/dbraw/zinc/57/26/60/988572660.db2.gz QODZWLINFSYUMZ-YIONKMFJSA-N 2 0 245.370 2.101 20 0 BEADRP CC1(C)CCC[C@H]([N@@H+]2C[C@H]3CC[C@]3([NH3+])C2)C1 ZINC001246857029 988578227 /nfs/dbraw/zinc/57/82/27/988578227.db2.gz ZBAXGEYHZXYKBB-DYEKYZERSA-N 2 0 222.376 2.378 20 0 BEADRP [NH3+][C@]12CC[C@@H]1C[N@@H+](C1CCCCCC1)C2 ZINC001246862768 988607733 /nfs/dbraw/zinc/60/77/33/988607733.db2.gz RHYPIDMGCSDFNF-YPMHNXCESA-N 2 0 208.349 2.132 20 0 BEADRP CCCC[C@H](CC)[N@@H+]1C[C@@H]2CC[C@@]2([NH3+])C1 ZINC001246864005 988612050 /nfs/dbraw/zinc/61/20/50/988612050.db2.gz STXCJZAOWKDXBZ-RWMBFGLXSA-N 2 0 210.365 2.378 20 0 BEADRP COc1cccc(C[C@H](C)N2CCC[C@@H]2C[NH3+])c1 ZINC001246916703 988715063 /nfs/dbraw/zinc/71/50/63/988715063.db2.gz OXXCMJUCQIUHJM-GXTWGEPZSA-N 2 0 248.370 2.049 20 0 BEADRP CC[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)C(C)(C)OC)C1 ZINC001324240028 988763944 /nfs/dbraw/zinc/76/39/44/988763944.db2.gz QDNZPDFRQUSFLU-QWHCGFSZSA-N 2 0 242.407 2.121 20 0 BEADRP CC1(C)CC[C@H]([N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)C1 ZINC001246931936 988764853 /nfs/dbraw/zinc/76/48/53/988764853.db2.gz NYPDDDOTYZQJDM-MJBXVCDLSA-N 2 0 236.403 2.497 20 0 BEADRP CC[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)C(C)(C)OC)C1 ZINC001324240029 988766681 /nfs/dbraw/zinc/76/66/81/988766681.db2.gz QDNZPDFRQUSFLU-STQMWFEESA-N 2 0 242.407 2.121 20 0 BEADRP CC[C@H]1CC[C@@H]([N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)C1 ZINC001246941955 988774500 /nfs/dbraw/zinc/77/45/00/988774500.db2.gz MVMVGWALVRBVLB-BYNSBNAKSA-N 2 0 236.403 2.497 20 0 BEADRP CCCCC[C@H](C)[N@H+](C)[C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001246947144 988782340 /nfs/dbraw/zinc/78/23/40/988782340.db2.gz IXEKUNBXOAJZGW-WUHRBBMRSA-N 2 0 210.365 2.105 20 0 BEADRP CCCC[C@@H](CC)[N@H+](C)[C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001246948444 988786499 /nfs/dbraw/zinc/78/64/99/988786499.db2.gz QIUWDPDRHQTZEM-NDBYEHHHSA-N 2 0 210.365 2.105 20 0 BEADRP CC[C@H](C)C[C@H](CC)[N@H+](C)[C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001246949546 988787488 /nfs/dbraw/zinc/78/74/88/988787488.db2.gz UBIVQKGRMBUJER-QSLWVIQJSA-N 2 0 224.392 2.351 20 0 BEADRP C[C@@H]1C[C@H]([N@H+](C)[C@@H]2[C@H]3C[NH2+]C[C@H]32)CC(C)(C)C1 ZINC001246951093 988788513 /nfs/dbraw/zinc/78/85/13/988788513.db2.gz ZPUXOAYWKXMCEZ-BJJPWKGXSA-N 2 0 236.403 2.351 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+]Cc2cccn2C2CC2)C1 ZINC001324424295 988834843 /nfs/dbraw/zinc/83/48/43/988834843.db2.gz JKDLCIUCHIRGIZ-CYBMUJFWSA-N 2 0 247.386 2.254 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]Cc1ccccc1C ZINC001325624508 989221083 /nfs/dbraw/zinc/22/10/83/989221083.db2.gz DVTJJETVKWFCHT-LBPRGKRZSA-N 2 0 206.333 2.083 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H]1CC[C@H](C)[C@H](C)C1 ZINC001325715350 989237212 /nfs/dbraw/zinc/23/72/12/989237212.db2.gz BOIBJIFEGRZBRM-UMSGYPCISA-N 2 0 212.381 2.399 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H](C)CSC(C)(C)C ZINC001325743318 989247320 /nfs/dbraw/zinc/24/73/20/989247320.db2.gz LBMNBQSDHQHNJB-WDEREUQCSA-N 2 0 232.437 2.352 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H](C)Cc1cccs1 ZINC001325744241 989248616 /nfs/dbraw/zinc/24/86/16/989248616.db2.gz RYMXUIPUDQDAFY-GHMZBOCLSA-N 2 0 226.389 2.267 20 0 BEADRP Cc1cc(N[C@H]2CCCC[C@H]2[NH+](C)C)cc[nH+]1 ZINC001325777745 989260164 /nfs/dbraw/zinc/26/01/64/989260164.db2.gz YFNLOZXHQSTKOU-UONOGXRCSA-N 2 0 233.359 2.097 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+][C@H]1CCC[C@H](F)C1 ZINC001119699097 989344563 /nfs/dbraw/zinc/34/45/63/989344563.db2.gz JBCFMADWUFBSHC-GZLMRBNLSA-N 2 0 240.366 2.373 20 0 BEADRP CCC(=O)CC[N@@H+](C)[C@H]1CCN(CC)C[C@@H]1C ZINC001326304739 989473496 /nfs/dbraw/zinc/47/34/96/989473496.db2.gz GJXZPDCBOJTADB-JSGCOSHPSA-N 2 0 240.391 2.018 20 0 BEADRP CCC(=O)CC[N@@H+](C)[C@H]1CCN(CC)C[C@H]1C ZINC001326304742 989475688 /nfs/dbraw/zinc/47/56/88/989475688.db2.gz GJXZPDCBOJTADB-OCCSQVGLSA-N 2 0 240.391 2.018 20 0 BEADRP F[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)C1 ZINC001326581440 989617714 /nfs/dbraw/zinc/61/77/14/989617714.db2.gz AJVTWERYPGUPPN-PDWCTOEPSA-N 2 0 240.366 2.245 20 0 BEADRP C[N@@H+]1CC[C@@H]2[C@H](CCCN2c2cc[nH+]cc2)C1 ZINC001120860874 989931846 /nfs/dbraw/zinc/93/18/46/989931846.db2.gz UVVNCXLHLGVRCM-TZMCWYRMSA-N 2 0 231.343 2.002 20 0 BEADRP [NH3+]Cc1cccc(-c2ccc3c(c2)C[C@H]([NH3+])C3)c1 ZINC001526676646 990168687 /nfs/dbraw/zinc/16/86/87/990168687.db2.gz OTXQYCNXDSVLNK-MRXNPFEDSA-N 2 0 238.334 2.238 20 0 BEADRP C[C@H]1CC[N@@H+]1Cc1ccc(OCC[NH+](C)C)cc1 ZINC001138769271 991035103 /nfs/dbraw/zinc/03/51/03/991035103.db2.gz MMRNUECDKBYZRJ-ZDUSSCGKSA-N 2 0 248.370 2.221 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@@H]([NH2+]Cc3cccc(F)c3)[C@H]2C1 ZINC001308554299 991037206 /nfs/dbraw/zinc/03/72/06/991037206.db2.gz NVQJHFJYTGZLGU-AEGPPILISA-N 2 0 248.345 2.256 20 0 BEADRP C[C@H]1C[C@H]([N@H+]2C[C@H]3C[NH+](C)C[C@H]3C2)C[C@@H](C)C1 ZINC001258169135 991064978 /nfs/dbraw/zinc/06/49/78/991064978.db2.gz USXDQRYXSJLCJA-OYQDBORRSA-N 2 0 236.403 2.305 20 0 BEADRP C[C@@H](Cc1ccco1)[N@H+](C)CCC[NH+](C)C ZINC001258184535 991086624 /nfs/dbraw/zinc/08/66/24/991086624.db2.gz DTEUEHRMLVARGH-LBPRGKRZSA-N 2 0 224.348 2.094 20 0 BEADRP [NH3+]CCSCC[NH2+]C1CCCCCCC1 ZINC001258236506 991174893 /nfs/dbraw/zinc/17/48/93/991174893.db2.gz ZOBMAVKGAGIYBG-UHFFFAOYSA-N 2 0 230.421 2.381 20 0 BEADRP CCN1CCC[C@H]([NH2+]CC[C@]2(C)CC2(F)F)C1 ZINC001308868413 991190445 /nfs/dbraw/zinc/19/04/45/991190445.db2.gz ODRVOEFQBQZDKX-NWDGAFQWSA-N 2 0 246.345 2.496 20 0 BEADRP C[NH+](C)CCC[NH2+]C/C=C/c1ccc(F)cc1 ZINC000083363906 991195438 /nfs/dbraw/zinc/19/54/38/991195438.db2.gz IHGWFVJRTXOBBT-HWKANZROSA-N 2 0 236.334 2.380 20 0 BEADRP CC1(C)CCC[C@H](NC(=[NH2+])SCC[NH3+])C1 ZINC001258276260 991202417 /nfs/dbraw/zinc/20/24/17/991202417.db2.gz DRYCXSJVUQJVCK-VIFPVBQESA-N 2 0 229.393 2.171 20 0 BEADRP CC(C)C1CC([NH2+]C[C@@H]2C[NH+]3CCC2CC3)C1 ZINC001308966712 991237943 /nfs/dbraw/zinc/23/79/43/991237943.db2.gz YRJJEEJZPKSMDS-SHARSMKWSA-N 2 0 236.403 2.352 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@@H]([NH2+]C3CC4(CCC4)C3)[C@H]2C1 ZINC001308983728 991251321 /nfs/dbraw/zinc/25/13/21/991251321.db2.gz AVYILQVSOFLQMX-FPMFFAJLSA-N 2 0 234.387 2.249 20 0 BEADRP C[C@H](CC1CC1)[NH2+][C@H]1CCN(C2CCC2)C1 ZINC001258453929 991402679 /nfs/dbraw/zinc/40/26/79/991402679.db2.gz HAAMQMQEHWTEJM-YPMHNXCESA-N 2 0 222.376 2.391 20 0 BEADRP C[C@@H](CC1CC1)[N@H+](C)CC1CC[NH+](C)CC1 ZINC001258461667 991420074 /nfs/dbraw/zinc/42/00/74/991420074.db2.gz DOXJPCONKMEFCS-LBPRGKRZSA-N 2 0 224.392 2.449 20 0 BEADRP CC[NH+]1C[C@@H]2C[NH+]([C@@H]3CCC(C)(C)C3)C[C@H]2C1 ZINC001258608390 991525912 /nfs/dbraw/zinc/52/59/12/991525912.db2.gz JECLOKGOOUMQIR-MGPQQGTHSA-N 2 0 236.403 2.449 20 0 BEADRP CC[N@H+]1C[C@@H]2C[NH+]([C@@H]3CCC(C)(C)C3)C[C@@H]2C1 ZINC001258608388 991527933 /nfs/dbraw/zinc/52/79/33/991527933.db2.gz JECLOKGOOUMQIR-HZSPNIEDSA-N 2 0 236.403 2.449 20 0 BEADRP CC[N@H+]1C[C@@H]2C[NH+]([C@H]3CCC(C)(C)C3)C[C@@H]2C1 ZINC001258608391 991528284 /nfs/dbraw/zinc/52/82/84/991528284.db2.gz JECLOKGOOUMQIR-MJBXVCDLSA-N 2 0 236.403 2.449 20 0 BEADRP C[C@@H](Cc1cccnc1)[NH2+]CCCCC[NH+](C)C ZINC001258610669 991531704 /nfs/dbraw/zinc/53/17/04/991531704.db2.gz TZLQYTQABKCVRU-AWEZNQCLSA-N 2 0 249.402 2.334 20 0 BEADRP C[C@H](Cc1cccnc1)[NH2+][C@@H]1CCC[N@H+](C)CC1 ZINC001258613199 991535310 /nfs/dbraw/zinc/53/53/10/991535310.db2.gz LFBKMGKZFBDRFR-UKRRQHHQSA-N 2 0 247.386 2.087 20 0 BEADRP C[C@@H](Cc1cccnc1)[NH2+]C(C)(C)CC[NH+](C)C ZINC001258614767 991542336 /nfs/dbraw/zinc/54/23/36/991542336.db2.gz VQBFOBCMNZIGKW-ZDUSSCGKSA-N 2 0 249.402 2.333 20 0 BEADRP CC[NH+]1CCC(C[N@H+](C)Cc2ccoc2)CC1 ZINC001560679114 991547230 /nfs/dbraw/zinc/54/72/30/991547230.db2.gz BUGJBYPJSJTYBJ-UHFFFAOYSA-N 2 0 236.359 2.443 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2CC[C@H](C)[C@H](F)C2)CC1 ZINC001560708080 991568070 /nfs/dbraw/zinc/56/80/70/991568070.db2.gz BATLXMGYRLGXNN-GXTWGEPZSA-N 2 0 242.382 2.398 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CCSCC[NH3+])CC(C)(C)C1 ZINC001258690176 991621957 /nfs/dbraw/zinc/62/19/57/991621957.db2.gz PEXOVQATZCRBEV-RYUDHWBXSA-N 2 0 244.448 2.483 20 0 BEADRP CC[C@H](Cc1ccccc1)[NH2+]C1CC([NH3+])C1 ZINC001258840555 991873169 /nfs/dbraw/zinc/87/31/69/991873169.db2.gz WAYPXCFROKJCCB-ROKHWSDSSA-N 2 0 218.344 2.087 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H]1C[C@H]1C ZINC001258898442 991888191 /nfs/dbraw/zinc/88/81/91/991888191.db2.gz XLLBLCWRAPAHDJ-FRRDWIJNSA-N 2 0 212.381 2.495 20 0 BEADRP CCC(=O)C[NH2+][C@@H](C)CCC[NH+](CC)CC ZINC001258902103 991894804 /nfs/dbraw/zinc/89/48/04/991894804.db2.gz ANARZPLNBDZVKT-LBPRGKRZSA-N 2 0 228.380 2.066 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]C(C)(C)CCO ZINC001258899983 991895776 /nfs/dbraw/zinc/89/57/76/991895776.db2.gz XLBQILBJFAFAQR-CYBMUJFWSA-N 2 0 244.423 2.248 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+]C1(CO)CCC1 ZINC001258902985 991896237 /nfs/dbraw/zinc/89/62/37/991896237.db2.gz JIQKICBEWCOAOJ-ZDUSSCGKSA-N 2 0 242.407 2.002 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CC(C)(OC)C1 ZINC001258907577 991899438 /nfs/dbraw/zinc/89/94/38/991899438.db2.gz KTHUAQUOAHSHHD-CYBMUJFWSA-N 2 0 242.407 2.218 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H](C)c1cccs1 ZINC001261423762 992296912 /nfs/dbraw/zinc/29/69/12/992296912.db2.gz DAHIXXYBOXLDNM-ZJUUUORDSA-N 2 0 212.362 2.397 20 0 BEADRP C1[NH2+]C[C@@H]2[C@H]1[C@H]2[NH2+][C@H]1CC[C@@H]2CCCC[C@@H]2C1 ZINC001261424119 992297999 /nfs/dbraw/zinc/29/79/99/992297999.db2.gz NSTFQZLBTCRMGT-PMKSJIGOSA-N 2 0 234.387 2.153 20 0 BEADRP CC[C@@H](C)C[N@@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001261490128 992340901 /nfs/dbraw/zinc/34/09/01/992340901.db2.gz MLVOSMUHZXZGNF-CYBMUJFWSA-N 2 0 224.392 2.498 20 0 BEADRP [NH3+]CC1(CC[NH2+]Cc2ccc3c(c2)CCC3)CC1 ZINC001261506640 992353278 /nfs/dbraw/zinc/35/32/78/992353278.db2.gz ZMJHOMLKTLRHMJ-UHFFFAOYSA-N 2 0 244.382 2.394 20 0 BEADRP COC[C@H](C[NH2+]C1CCC(C[NH3+])CC1)C(C)C ZINC001262201618 992797648 /nfs/dbraw/zinc/79/76/48/992797648.db2.gz AQCVZZSKHVVKQH-MOKVOYLWSA-N 2 0 242.407 2.012 20 0 BEADRP [NH3+]C1CC[NH+](C[C@H]2C[C@@H]2c2ccccc2)CC1 ZINC001574271020 992836683 /nfs/dbraw/zinc/83/66/83/992836683.db2.gz WTAYFLBGPOKORW-UKRRQHHQSA-N 2 0 230.355 2.213 20 0 BEADRP C1=CO[C@H](C[NH2+]CC[C@H]2CCC[NH2+]CC2)CC1 ZINC001574774406 992898231 /nfs/dbraw/zinc/89/82/31/992898231.db2.gz MRMWSWXFTIDJJW-KBPBESRZSA-N 2 0 238.375 2.049 20 0 BEADRP C1=C(C[N@@H+]2CCC[C@]3(CC[NH2+]C3)C2)CCC1 ZINC001574773992 992903793 /nfs/dbraw/zinc/90/37/93/992903793.db2.gz IAOCXUKHLZBJFN-CQSZACIVSA-N 2 0 220.360 2.172 20 0 BEADRP C([NH2+][C@H]1C[C@H]2CCC[C@@H]21)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC001574795348 992910379 /nfs/dbraw/zinc/91/03/79/992910379.db2.gz MJKOLJSNYYXOFH-UGIFPKBASA-N 2 0 234.387 2.295 20 0 BEADRP C([NH2+]C1(C2CCCCC2)CC1)[C@H]1CCC[NH2+]1 ZINC001574795713 992910978 /nfs/dbraw/zinc/91/09/78/992910978.db2.gz PAADLZWRPBUDEA-CYBMUJFWSA-N 2 0 222.376 2.441 20 0 BEADRP C1C[C@H]2CC[C@H]([NH2+][C@]34CCC[C@H]3[NH2+]CC4)[C@H]2C1 ZINC001574816452 992916660 /nfs/dbraw/zinc/91/66/60/992916660.db2.gz FKTARWNCTIRFBD-LXFSFDBISA-N 2 0 234.387 2.439 20 0 BEADRP CC(C)(C[NH2+][C@@H]1C[C@H]([NH3+])C1(C)C)CC(F)F ZINC001575334774 993014594 /nfs/dbraw/zinc/01/45/94/993014594.db2.gz SNIGQLWAUPGMDW-DTWKUNHWSA-N 2 0 234.334 2.383 20 0 BEADRP CC(C)[C@@H](C[NH3+])C[N@@H+]1CC[C@H](C2CCC2)C1 ZINC001575423815 993041240 /nfs/dbraw/zinc/04/12/40/993041240.db2.gz YPBYGDFYDFQJPZ-KBPBESRZSA-N 2 0 224.392 2.339 20 0 BEADRP CC(C)C([NH2+]C1CC2(C[C@H]2[NH3+])C1)C(C)C ZINC001575472094 993051738 /nfs/dbraw/zinc/05/17/38/993051738.db2.gz LVSWWTNQPYGXPM-QWKFWESOSA-N 2 0 210.365 2.136 20 0 BEADRP CC(C)[C@H]1CC[N@@H+]1C[C@@]1(C)CCC[NH2+]C1 ZINC001575508347 993061953 /nfs/dbraw/zinc/06/19/53/993061953.db2.gz SIFOZKDQKXBLQP-OLZOCXBDSA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)OC1(C[NH2+][C@@H]2C[C@H]([NH3+])C2(C)C)CCC1 ZINC001575748627 993104723 /nfs/dbraw/zinc/10/47/23/993104723.db2.gz BZNRJZILKCYSFC-NWDGAFQWSA-N 2 0 240.391 2.050 20 0 BEADRP CC(C)OC1(C[NH2+][C@H]2C[C@H]([NH3+])C2(C)C)CCC1 ZINC001575748629 993104917 /nfs/dbraw/zinc/10/49/17/993104917.db2.gz BZNRJZILKCYSFC-RYUDHWBXSA-N 2 0 240.391 2.050 20 0 BEADRP CC(C)OC1(C[NH2+]C[C@@H](C[NH3+])C(C)C)CCC1 ZINC001575751703 993105276 /nfs/dbraw/zinc/10/52/76/993105276.db2.gz YCXFIBJJUXUQAR-CYBMUJFWSA-N 2 0 242.407 2.155 20 0 BEADRP C[C@@H]1CCC[C@H]([N@@H+]2CCC[C@@H]([NH3+])CC2)C1 ZINC000378665200 993198064 /nfs/dbraw/zinc/19/80/64/993198064.db2.gz FQECACHFXDOELQ-UPJWGTAASA-N 2 0 210.365 2.378 20 0 BEADRP C[C@@H]([NH3+])c1ccc(C[NH2+]Cc2cncs2)cc1 ZINC001576167783 993202133 /nfs/dbraw/zinc/20/21/33/993202133.db2.gz GKDMARQPHXKFDB-SNVBAGLBSA-N 2 0 247.367 2.453 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CC[C@@H]([NH3+])C1)C1CCSCC1 ZINC001576245158 993230232 /nfs/dbraw/zinc/23/02/32/993230232.db2.gz NYJORFVMIREFHP-NTZNESFSSA-N 2 0 242.432 2.235 20 0 BEADRP C[C@H]([NH2+][C@H]1C[C@H]([NH3+])C1)[C@@H]1CC2CCC1CC2 ZINC001576250368 993234540 /nfs/dbraw/zinc/23/45/40/993234540.db2.gz FKSGFBLSOYHODS-JRUDZLOGSA-N 2 0 222.376 2.281 20 0 BEADRP CC1(C)[C@H]([NH2+]CC23CCC(CC2)C3)C[C@@H]1[NH3+] ZINC001576381711 993290349 /nfs/dbraw/zinc/29/03/49/993290349.db2.gz DUXBGGQWKYGNAQ-MRFPXMQZSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@@H](CC1CC1)[N@@H+]1CCCC[C@H](C[NH3+])C1 ZINC000379855307 993290807 /nfs/dbraw/zinc/29/08/07/993290807.db2.gz BSZWEZJIMBIUCZ-WCQYABFASA-N 2 0 210.365 2.236 20 0 BEADRP CC1(C)CC[C@H](C[NH2+]C[C@@H]2CCSC2)[NH2+]C1 ZINC001576420966 993299304 /nfs/dbraw/zinc/29/93/04/993299304.db2.gz DSWDSVTVIQEPEG-NWDGAFQWSA-N 2 0 242.432 2.107 20 0 BEADRP C[C@@H]1CC([N@@H+]2CCCC[C@H](C[NH3+])C2)C[C@@H](C)O1 ZINC000379928233 993300366 /nfs/dbraw/zinc/30/03/66/993300366.db2.gz TVMHHFDHKHFVSX-JHJVBQTASA-N 2 0 240.391 2.003 20 0 BEADRP CC1(C)C[NH2+]C[C@@H]1[NH2+]C[C@@H]1CC[C@H]2C[C@H]2C1 ZINC001576477172 993315411 /nfs/dbraw/zinc/31/54/11/993315411.db2.gz REOMWOYHVBLWRN-XQHKEYJVSA-N 2 0 222.376 2.010 20 0 BEADRP C[C@@]1(C[N@@H+]2CCCCC[C@H]([NH3+])C2)CCCCO1 ZINC001576502659 993323767 /nfs/dbraw/zinc/32/37/67/993323767.db2.gz DVHZOBNXMMAFGJ-KBPBESRZSA-N 2 0 240.391 2.149 20 0 BEADRP CC1(C[N@@H+]2C[C@H]3CCC[C@]3([NH3+])C2)CCCC1 ZINC001576503434 993324407 /nfs/dbraw/zinc/32/44/07/993324407.db2.gz STVWDSLMQGWRNU-OCCSQVGLSA-N 2 0 222.376 2.380 20 0 BEADRP C[C@]1(C[NH2+]CC2CCC=CCC2)CC[NH2+]C1 ZINC001576518555 993328792 /nfs/dbraw/zinc/32/87/92/993328792.db2.gz AHJJDXWYMFNCMR-AWEZNQCLSA-N 2 0 222.376 2.322 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH2+][C@H]2C=CCCC2)CC1 ZINC000380360460 993328963 /nfs/dbraw/zinc/32/89/63/993328963.db2.gz YHHHNRMTSMSEEO-QWHCGFSZSA-N 2 0 208.349 2.169 20 0 BEADRP CC1(C)CCC[C@H]1C[NH2+]C[C@]1(C)CC[NH2+]C1 ZINC001576519863 993331543 /nfs/dbraw/zinc/33/15/43/993331543.db2.gz VAYNCVVHGCEKOS-GXTWGEPZSA-N 2 0 224.392 2.402 20 0 BEADRP C[C@@H]1C[C@@H](C[NH2+]CC[C@@H]2CCCS2)CC[NH2+]1 ZINC001576596917 993361167 /nfs/dbraw/zinc/36/11/67/993361167.db2.gz CASDAQZDUZWSBU-AGIUHOORSA-N 2 0 242.432 2.250 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@H]1[NH2+][C@@H]1CCC[N@H+](C)CC1 ZINC000381201677 993380252 /nfs/dbraw/zinc/38/02/52/993380252.db2.gz FJMFIVHKHFQICP-RQJABVFESA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H]1CCC(C)(C)C[C@H]1[NH2+][C@@H]1CC[NH2+]C1 ZINC001576647935 993382713 /nfs/dbraw/zinc/38/27/13/993382713.db2.gz VNQAVMFGHNUVEE-QJPTWQEYSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C2CC3(CC([NH3+])C3)C2)CS1 ZINC001576665115 993386506 /nfs/dbraw/zinc/38/65/06/993386506.db2.gz CIEVJFFQWGLAHP-BSOHTCKCSA-N 2 0 240.416 2.130 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+]C2CC3(CC([NH3+])C3)C2)CS1 ZINC001576665121 993387275 /nfs/dbraw/zinc/38/72/75/993387275.db2.gz CIEVJFFQWGLAHP-RBTDDNDWSA-N 2 0 240.416 2.130 20 0 BEADRP C[C@@H]1CCC[C@H](C)[N@H+](CC2(C[NH3+])CC2)C1 ZINC001576669528 993387841 /nfs/dbraw/zinc/38/78/41/993387841.db2.gz SKZMZDIYHYAIFU-NEPJUHHUSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@H]1CCC[C@H]([NH2+][C@H]2C[C@H](C[NH3+])C2)CC1 ZINC001576680548 993390725 /nfs/dbraw/zinc/39/07/25/993390725.db2.gz OYXLVMOIDZZAOZ-CYDGBPFRSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]1CC[N@H+](C[C@H]2CC[C@@H]([NH3+])C2)C[C@H]1C ZINC001576732440 993410646 /nfs/dbraw/zinc/41/06/46/993410646.db2.gz UHEVJINALQQPCX-QNWHQSFQSA-N 2 0 210.365 2.092 20 0 BEADRP Cc1ccc(N[C@H]2CCC[C@H]([NH3+])C2)nc1 ZINC000382434507 993460094 /nfs/dbraw/zinc/46/00/94/993460094.db2.gz UHBBORSQYMYUOP-QWRGUYRKSA-N 2 0 205.305 2.072 20 0 BEADRP CCC(C)(C)OCC[NH2+][C@@H]1CC[NH2+]CC[C@H]1C ZINC001576948414 993462697 /nfs/dbraw/zinc/46/26/97/993462697.db2.gz PWANKMBNMWVHSD-CHWSQXEVSA-N 2 0 242.407 2.169 20 0 BEADRP CCC(C)(C)OCC[NH2+][C@H]1CC[NH2+]CC[C@H]1C ZINC001576948416 993462610 /nfs/dbraw/zinc/46/26/10/993462610.db2.gz PWANKMBNMWVHSD-OLZOCXBDSA-N 2 0 242.407 2.169 20 0 BEADRP CC[C@](C)([NH2+]C[C@H](N)CC(F)(F)F)C1CC1 ZINC001576961099 993466937 /nfs/dbraw/zinc/46/69/37/993466937.db2.gz RVKRKZPAJCDKDV-ZJUUUORDSA-N 2 0 238.297 2.434 20 0 BEADRP CC[C@@H](C)[N@H+](CCO)C[C@@H]([NH3+])CCC(C)(C)C ZINC001576996832 993482095 /nfs/dbraw/zinc/48/20/95/993482095.db2.gz XQSDYQWDRIYWGW-OLZOCXBDSA-N 2 0 244.423 2.233 20 0 BEADRP CCC1(C[NH2+]CC2C[NH2+]C2)CCCCC1 ZINC001577221095 993549985 /nfs/dbraw/zinc/54/99/85/993549985.db2.gz VEAIZLUZSDVEHA-UHFFFAOYSA-N 2 0 210.365 2.156 20 0 BEADRP CC[C@@H]1CC[N@H+](CCC2CC[NH2+]CC2)[C@H]1C ZINC001577263382 993570135 /nfs/dbraw/zinc/57/01/35/993570135.db2.gz RMWFVMXRIMBMTH-GXTWGEPZSA-N 2 0 224.392 2.497 20 0 BEADRP CCC[C@H]([NH2+]C1CC(C[NH3+])C1)C1CCC1 ZINC001577365929 993623083 /nfs/dbraw/zinc/62/30/83/993623083.db2.gz PSVZRDYSLDSRLL-GDKBPFBDSA-N 2 0 210.365 2.282 20 0 BEADRP C[N@H+](CCCC[NH3+])Cc1cccc2cccnc21 ZINC000384950665 993637981 /nfs/dbraw/zinc/63/79/81/993637981.db2.gz AHUBQTNWKVHAHL-UHFFFAOYSA-N 2 0 243.354 2.406 20 0 BEADRP Cc1cccc(C)c1C[N@H+]1CC[NH2+]C[C@H](C)C1 ZINC000385292885 993656535 /nfs/dbraw/zinc/65/65/35/993656535.db2.gz GQCBIOTWDFJIKK-LBPRGKRZSA-N 2 0 232.371 2.345 20 0 BEADRP CCCCOc1ccccc1C[NH2+]C/C=C/C[NH3+] ZINC001577473289 993668576 /nfs/dbraw/zinc/66/85/76/993668576.db2.gz VAGAEEAYQJVNSW-VOTSOKGWSA-N 2 0 248.370 2.470 20 0 BEADRP CCCSC[C@H](C)[NH2+][C@H]1CC[NH2+][C@H](C)C1 ZINC001577596952 993691091 /nfs/dbraw/zinc/69/10/91/993691091.db2.gz NSKBMHKCZGUWHU-WOPDTQHZSA-N 2 0 230.421 2.248 20 0 BEADRP CC(C)[NH+]1CCC(NC(=[NH2+])C(C)(C)C)CC1 ZINC000387463433 993709972 /nfs/dbraw/zinc/70/99/72/993709972.db2.gz XIXVRFVRFJRWPJ-UHFFFAOYSA-N 2 0 225.380 2.472 20 0 BEADRP C[C@H](CCNc1cc[nH+]cc1)[NH+]1CCCCC1 ZINC001336909287 995121070 /nfs/dbraw/zinc/12/10/70/995121070.db2.gz LQYWDPNBPWHIKW-CYBMUJFWSA-N 2 0 233.359 2.180 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+]C[C@@H]1CCOC1 ZINC000019915188 1170140889 /nfs/dbraw/zinc/14/08/89/1170140889.db2.gz YNIBCTQHAMFVRH-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@H](CCC1CC1)[NH2+][C@@H]1CC[C@@H]2C[N@H+](C)C[C@@H]12 ZINC001621570549 1170164090 /nfs/dbraw/zinc/16/40/90/1170164090.db2.gz XACUCJSLKICMMB-NMFUWQPSSA-N 2 0 236.403 2.495 20 0 BEADRP C1CC[C@@H]2[C@H](C1)CCC[N@@H+]2[C@@H]1CCC[NH2+]C1 ZINC000036827154 1170918988 /nfs/dbraw/zinc/91/89/88/1170918988.db2.gz HBTGAYJPEGRVRI-MGPQQGTHSA-N 2 0 222.376 2.393 20 0 BEADRP C[C@H](CCc1ccc(O)cc1)[NH2+]C1CC[NH2+]CC1 ZINC000038041384 1171009480 /nfs/dbraw/zinc/00/94/80/1171009480.db2.gz ZIOIXNQDFCIJAY-GFCCVEGCSA-N 2 0 248.370 2.055 20 0 BEADRP c1ccc(CCC[NH2+][C@@H]2CCCC[NH2+]C2)cc1 ZINC000039020033 1171104302 /nfs/dbraw/zinc/10/43/02/1171104302.db2.gz MTFNYDATMPGLRF-OAHLLOKOSA-N 2 0 232.371 2.351 20 0 BEADRP COc1ccccc1C[C@@H](C)N1CCC[C@H]([NH3+])C1 ZINC000041027995 1171163934 /nfs/dbraw/zinc/16/39/34/1171163934.db2.gz FJTXLJDCYYLIRG-OCCSQVGLSA-N 2 0 248.370 2.049 20 0 BEADRP CC[C@H]([NH3+])C[NH+]1CCC(C(C)(C)C)CC1 ZINC000050346374 1171796639 /nfs/dbraw/zinc/79/66/39/1171796639.db2.gz ZCRLFYZFLUFIPQ-LBPRGKRZSA-N 2 0 212.381 2.482 20 0 BEADRP CC(C)(C)C1CC[NH+](C2CC[NH2+]CC2)CC1 ZINC000050347148 1171797262 /nfs/dbraw/zinc/79/72/62/1171797262.db2.gz LETWFTHLPJFDPM-UHFFFAOYSA-N 2 0 224.392 2.497 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]CCCCCO ZINC000051020631 1171865062 /nfs/dbraw/zinc/86/50/62/1171865062.db2.gz SOEHRHUPGQYLCJ-CQSZACIVSA-N 2 0 244.423 2.249 20 0 BEADRP CC[NH+](CC)C1CC[NH+](CC(C)C)CC1 ZINC000052050191 1171935743 /nfs/dbraw/zinc/93/57/43/1171935743.db2.gz YHEZYOFWFHBZQL-UHFFFAOYSA-N 2 0 212.381 2.449 20 0 BEADRP C1=C(CC[NH+]2C[C@@H]3C[NH2+]C[C@H]3C2)CCCC1 ZINC000385161150 398137448 /nfs/dbraw/zinc/13/74/48/398137448.db2.gz LGXHNRLEPRCWSA-KBPBESRZSA-N 2 0 220.360 2.028 20 0 BEADRP CC[C@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)C1CCC1 ZINC000322377798 343977796 /nfs/dbraw/zinc/97/77/96/343977796.db2.gz KZXFWZWUQQDDDX-OCCSQVGLSA-N 2 0 224.392 2.497 20 0 BEADRP CCc1ccc(CN[C@H]2CC[N@H+](C)[C@H](C)C2)o1 ZINC000161615125 349476989 /nfs/dbraw/zinc/47/69/89/349476989.db2.gz KLZGUIAFNOXADE-NEPJUHHUSA-N 2 0 236.359 2.414 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]C1(c2ccccc2)CC1 ZINC000422939353 398158703 /nfs/dbraw/zinc/15/87/03/398158703.db2.gz RDBGWMVSLCCYRC-VXGBXAGGSA-N 2 0 218.344 2.391 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H](C)C1CC1 ZINC000422942352 398159151 /nfs/dbraw/zinc/15/91/51/398159151.db2.gz PLDJAMFYQPESSH-NXEZZACHSA-N 2 0 233.359 2.298 20 0 BEADRP CCOCCC1(C[NH2+][C@H](C)C[C@@H](C)[NH3+])CCC1 ZINC000422942827 398159215 /nfs/dbraw/zinc/15/92/15/398159215.db2.gz QGJMBVDQQYPFRB-CHWSQXEVSA-N 2 0 242.407 2.299 20 0 BEADRP Cc1cc(C[N@@H+]2CC[C@H](C[NH3+])C2)c(C)s1 ZINC000050245565 178004222 /nfs/dbraw/zinc/00/42/22/178004222.db2.gz ZPKZAEYQPVVGID-LLVKDONJSA-N 2 0 224.373 2.146 20 0 BEADRP CCC1(CC)[C@H]([NH2+][C@H](C)C[C@@H](C)[NH3+])C[C@@H]1OC ZINC000422943705 398159264 /nfs/dbraw/zinc/15/92/64/398159264.db2.gz RDGURCYWILVPJI-LPWJVIDDSA-N 2 0 242.407 2.296 20 0 BEADRP C[C@H](C[C@@H]1CCCO1)[NH2+][C@@H]1CCCCC[C@@H]1[NH3+] ZINC000422907309 398156998 /nfs/dbraw/zinc/15/69/98/398156998.db2.gz WWGQVGMFDIHJBL-ZOBORPQBSA-N 2 0 240.391 2.194 20 0 BEADRP C[C@H](C[C@@H]1CCCO1)[NH2+][C@H]1CCCCC[C@@H]1[NH3+] ZINC000422907306 398157342 /nfs/dbraw/zinc/15/73/42/398157342.db2.gz WWGQVGMFDIHJBL-RFGFWPKPSA-N 2 0 240.391 2.194 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]C1(c2ccccc2)CC1 ZINC000422939351 398158303 /nfs/dbraw/zinc/15/83/03/398158303.db2.gz RDBGWMVSLCCYRC-NWDGAFQWSA-N 2 0 218.344 2.391 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]C1(c2ccccc2)CC1 ZINC000422939350 398158394 /nfs/dbraw/zinc/15/83/94/398158394.db2.gz RDBGWMVSLCCYRC-NEPJUHHUSA-N 2 0 218.344 2.391 20 0 BEADRP C[C@H](C[NH+]1CCC(C[NH3+])CC1)C(C)(C)C ZINC000379824625 398169632 /nfs/dbraw/zinc/16/96/32/398169632.db2.gz VKSHUNPCALKLOJ-LLVKDONJSA-N 2 0 212.381 2.339 20 0 BEADRP C[C@@H]1C[C@H](CC[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)CCO1 ZINC000563426363 398170826 /nfs/dbraw/zinc/17/08/26/398170826.db2.gz UDXMUTMGCGKWFY-AAVRWANBSA-N 2 0 240.391 2.051 20 0 BEADRP Cc1csc(CC[NH2+][C@H](C)CCCC[NH3+])n1 ZINC000390489299 398176158 /nfs/dbraw/zinc/17/61/58/398176158.db2.gz OVAQEPSRTDJOOT-SNVBAGLBSA-N 2 0 241.404 2.101 20 0 BEADRP Cc1csc(CC[NH2+][C@@H](C)CCCC[NH3+])n1 ZINC000390489298 398176391 /nfs/dbraw/zinc/17/63/91/398176391.db2.gz OVAQEPSRTDJOOT-JTQLQIEISA-N 2 0 241.404 2.101 20 0 BEADRP CC[C@@H](CSC)[NH2+]C1CCC(C[NH3+])CC1 ZINC000423019959 398161051 /nfs/dbraw/zinc/16/10/51/398161051.db2.gz YAPNSMXOFBAJNN-CXQJBGSLSA-N 2 0 230.421 2.235 20 0 BEADRP Cc1cc(F)ccc1C[N@@H+](C)C1CC([NH3+])C1 ZINC000336233509 178083781 /nfs/dbraw/zinc/08/37/81/178083781.db2.gz WDSCYJOPRRGRKM-UHFFFAOYSA-N 2 0 222.307 2.056 20 0 BEADRP Cc1cc(F)ccc1C[N@H+]1C[C@@H](C[NH3+])C[C@H]1C ZINC000228060321 178085313 /nfs/dbraw/zinc/08/53/13/178085313.db2.gz DMRVSFGPYCYWEG-VXGBXAGGSA-N 2 0 236.334 2.303 20 0 BEADRP Cc1cc(F)ccc1C[N@H+]1CC[C@H]([C@@H](C)[NH3+])C1 ZINC000126928208 178085471 /nfs/dbraw/zinc/08/54/71/178085471.db2.gz PIQNNGBSKFCRMP-YPMHNXCESA-N 2 0 236.334 2.303 20 0 BEADRP C[C@H]([NH2+][C@@H]1CN(C)C[C@H]1C)C1CCCCC1 ZINC000336747142 398190395 /nfs/dbraw/zinc/19/03/95/398190395.db2.gz RURVMIPOHKFHAO-MBNYWOFBSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@]12C[NH2+]C[C@@]1(C)C[N@H+](Cc1ccccc1)C2 ZINC000521398863 398197459 /nfs/dbraw/zinc/19/74/59/398197459.db2.gz QYDLHLFKHURUHQ-GASCZTMLSA-N 2 0 230.355 2.118 20 0 BEADRP C[N@@H+]1CCC[C@H](CC[NH2+][C@@H]2CCC[C@H]3C[C@H]32)C1 ZINC000576362790 365578050 /nfs/dbraw/zinc/57/80/50/365578050.db2.gz UOSBEYXVALMPSV-LXTVHRRPSA-N 2 0 236.403 2.497 20 0 BEADRP Cc1cc(NCC2(C)CC[NH2+]CC2)cc[nH+]1 ZINC000229577431 178156456 /nfs/dbraw/zinc/15/64/56/178156456.db2.gz FATBHWDONWQTAY-UHFFFAOYSA-N 2 0 219.332 2.192 20 0 BEADRP Cc1cc(NCC(C)(C)[NH+](C)C)cc[nH+]1 ZINC000229565497 178156892 /nfs/dbraw/zinc/15/68/92/178156892.db2.gz XTXHBJILXPUWAJ-UHFFFAOYSA-N 2 0 207.321 2.142 20 0 BEADRP Cc1cc(NC[C@@H](C2CC2)[NH+](C)C)cc[nH+]1 ZINC000302564826 178165943 /nfs/dbraw/zinc/16/59/43/178165943.db2.gz MTLIVTCXKGNYOD-ZDUSSCGKSA-N 2 0 219.332 2.142 20 0 BEADRP Cc1cc(NC[C@H]2CCC[N@@H+](C)C2)cc[nH+]1 ZINC000229565553 178168898 /nfs/dbraw/zinc/16/88/98/178168898.db2.gz VEZVFCZTPXXDEP-GFCCVEGCSA-N 2 0 219.332 2.144 20 0 BEADRP CC(C)(C[NH2+][C@H]1CCC[C@H]([NH3+])C1)c1cccnc1 ZINC000584242204 398221558 /nfs/dbraw/zinc/22/15/58/398221558.db2.gz KYONCADIZWHUNZ-KBPBESRZSA-N 2 0 247.386 2.219 20 0 BEADRP Cc1cc(N[C@H](C)[C@@H]2CCC[NH2+]C2)cc[nH+]1 ZINC000229574528 178185981 /nfs/dbraw/zinc/18/59/81/178185981.db2.gz BVBWFXJLZWTIPY-VXGBXAGGSA-N 2 0 219.332 2.190 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H]1CC[C@H](C)C[C@H]1C ZINC000576458089 365601071 /nfs/dbraw/zinc/60/10/71/365601071.db2.gz IEDJYQUGLXFICV-YNEHKIRRSA-N 2 0 212.381 2.400 20 0 BEADRP CCC(CC)C[N@@H+]1C[C@@H]2CCC[NH2+][C@@H]2C1 ZINC000128423929 168352565 /nfs/dbraw/zinc/35/25/65/168352565.db2.gz KBMZFPYRLFLGLF-QWHCGFSZSA-N 2 0 210.365 2.106 20 0 BEADRP CCOCCCC[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000165158922 538934730 /nfs/dbraw/zinc/93/47/30/538934730.db2.gz YDARLWDWFGHQHH-ZDUSSCGKSA-N 2 0 242.407 2.123 20 0 BEADRP Cc1cc([C@H](C)[NH2+]C[C@H](C)C[NH3+])c(C)o1 ZINC000309016087 178249804 /nfs/dbraw/zinc/24/98/04/178249804.db2.gz ZMBLRPKBQSCHMK-SCZZXKLOSA-N 2 0 210.321 2.142 20 0 BEADRP CCC(CC)C[NH2+]C1CC[NH+](CC)CC1 ZINC000037977193 168359605 /nfs/dbraw/zinc/35/96/05/168359605.db2.gz ORLPUMBZDSISQM-UHFFFAOYSA-N 2 0 212.381 2.497 20 0 BEADRP Cc1cc([C@H](C)N[C@H]2CC[N@@H+]3CCC[C@@H]3C2)no1 ZINC000337547552 178258160 /nfs/dbraw/zinc/25/81/60/178258160.db2.gz MKOCWPMJYVIFHL-RWMBFGLXSA-N 2 0 249.358 2.260 20 0 BEADRP Cc1cc([C@H](C)N[C@H]2CC[N@H+](C)[C@H](C)C2)no1 ZINC000337552940 178258692 /nfs/dbraw/zinc/25/86/92/178258692.db2.gz PNPHGQJGMMXWJP-USWWRNFRSA-N 2 0 237.347 2.116 20 0 BEADRP CC(C)[NH2+]CCC[NH2+][C@H](C)[C@H]1CC1(C)C ZINC000576694691 365657751 /nfs/dbraw/zinc/65/77/51/365657751.db2.gz MSHXZBIVKSFWLE-VXGBXAGGSA-N 2 0 212.381 2.399 20 0 BEADRP CCC[NH+](CCC)CCC[NH2+][C@H]1CO[C@@H](C)C1 ZINC000647178682 398264467 /nfs/dbraw/zinc/26/44/67/398264467.db2.gz CYYFZGCANFIFLN-UONOGXRCSA-N 2 0 242.407 2.266 20 0 BEADRP CCCC1(C[NH2+][C@@H](CCC[NH3+])COC)CCC1 ZINC000391879469 398264910 /nfs/dbraw/zinc/26/49/10/398264910.db2.gz RWQMIYLQYCQUQT-ZDUSSCGKSA-N 2 0 242.407 2.300 20 0 BEADRP CCCC1(C[NH2+][C@H](CCC[NH3+])COC)CCC1 ZINC000391879468 398264915 /nfs/dbraw/zinc/26/49/15/398264915.db2.gz RWQMIYLQYCQUQT-CYBMUJFWSA-N 2 0 242.407 2.300 20 0 BEADRP CC1(C[NH+]2CCC3(CC[NH2+]3)CC2)CCC1 ZINC000334587514 398270516 /nfs/dbraw/zinc/27/05/16/398270516.db2.gz OKJAMFWPAMRNBU-UHFFFAOYSA-N 2 0 208.349 2.005 20 0 BEADRP CCC[C@H](C)C[N@H+](C)CCC[NH+](C)C ZINC000561971118 323009710 /nfs/dbraw/zinc/00/97/10/323009710.db2.gz YTEZKGDRLMKSCA-LBPRGKRZSA-N 2 0 200.370 2.306 20 0 BEADRP CCC[C@@H](C)[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000037209010 538962030 /nfs/dbraw/zinc/96/20/30/538962030.db2.gz LQEHKJWGWAWLSZ-NEPJUHHUSA-N 2 0 212.381 2.495 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)C1CC[NH+](C)CC1)c1ccccn1 ZINC000037220378 538962082 /nfs/dbraw/zinc/96/20/82/538962082.db2.gz RNEZHQYWTDRPNR-QWHCGFSZSA-N 2 0 247.386 2.463 20 0 BEADRP Cc1ccc2c(c1)CC[C@H]2[NH2+]C1CC[NH2+]CC1 ZINC000335602369 136235690 /nfs/dbraw/zinc/23/56/90/136235690.db2.gz YKQOMZAQNUPYPQ-OAHLLOKOSA-N 2 0 230.355 2.324 20 0 BEADRP C[N@@H+]1CCC[C@H]1CC[NH+]1C[C@@H]2CCC[C@@H]2C1 ZINC000162235817 349615796 /nfs/dbraw/zinc/61/57/96/349615796.db2.gz XUPHFIQYOBGQSB-MJBXVCDLSA-N 2 0 222.376 2.203 20 0 BEADRP CCC(CC)[NH2+]CCC1CC[NH+](C)CC1 ZINC000122141793 168387149 /nfs/dbraw/zinc/38/71/49/168387149.db2.gz FJNXARXGKHBUNO-UHFFFAOYSA-N 2 0 212.381 2.497 20 0 BEADRP [NH3+][C@H]1CCCCC[C@@H]1[NH2+]CC1CC(F)(F)C1 ZINC000335611994 136237305 /nfs/dbraw/zinc/23/73/05/136237305.db2.gz NTYDJUSOCJXRRP-QWRGUYRKSA-N 2 0 232.318 2.281 20 0 BEADRP CC[C@H](C)C[NH2+]C[C@H]1CC[N@@H+](C(C)C)C1 ZINC000040622289 538971877 /nfs/dbraw/zinc/97/18/77/538971877.db2.gz DVLASFIIZGGXPS-QWHCGFSZSA-N 2 0 212.381 2.352 20 0 BEADRP CCC1CC([NH2+]C[C@H]2CC[N@@H+](C(C)C)C2)C1 ZINC000309715666 342799298 /nfs/dbraw/zinc/79/92/98/342799298.db2.gz SRRNNHGWVIGJRX-ROKHWSDSSA-N 2 0 224.392 2.495 20 0 BEADRP CCN1CCC([NH2+][C@H]2CCC(F)(F)C2)CC1 ZINC000381655642 539005926 /nfs/dbraw/zinc/00/59/26/539005926.db2.gz SWYGQQRGFIHJCP-NSHDSACASA-N 2 0 232.318 2.248 20 0 BEADRP CN1CCC[C@H]([NH2+][C@@H]2CCC23CCCC3)C1 ZINC000381647619 539005960 /nfs/dbraw/zinc/00/59/60/539005960.db2.gz CASKNXNUNIVDPF-QWHCGFSZSA-N 2 0 222.376 2.393 20 0 BEADRP FC1(F)CC[C@H]([NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)C1 ZINC000383928835 539012356 /nfs/dbraw/zinc/01/23/56/539012356.db2.gz BHCOFLJHKWKGTD-SDDRHHMPSA-N 2 0 244.329 2.391 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH2+][C@@H]2CCC2(C)C)C1 ZINC000389388653 539016118 /nfs/dbraw/zinc/01/61/18/539016118.db2.gz UOQFGUXMWOHZBJ-NWDGAFQWSA-N 2 0 210.365 2.106 20 0 BEADRP C[NH+](C)C1CCC([NH2+]CC2(C)CC2)CC1 ZINC000389882727 539017874 /nfs/dbraw/zinc/01/78/74/539017874.db2.gz PGXHLTSRHVVODA-UHFFFAOYSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C[C@]2(C)C[C@H]3C[C@H]3C2)CC[N@@H+]1C ZINC000624200544 342847316 /nfs/dbraw/zinc/84/73/16/342847316.db2.gz OCRAOWRKTNUFLK-NIFZNCRKSA-N 2 0 236.403 2.495 20 0 BEADRP CC(C)C1(C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)CC1 ZINC000232720704 342879465 /nfs/dbraw/zinc/87/94/65/342879465.db2.gz FELIBMYCWFOYPT-VXGBXAGGSA-N 2 0 210.365 2.282 20 0 BEADRP C[NH+](C)CCCC[NH2+]CC1CCSCC1 ZINC000401766017 398332530 /nfs/dbraw/zinc/33/25/30/398332530.db2.gz USSMDOZNHWXSKZ-UHFFFAOYSA-N 2 0 230.421 2.061 20 0 BEADRP CCC[NH2+]CC[NH2+][C@H](C)CCC(C)C ZINC000053388099 346893482 /nfs/dbraw/zinc/89/34/82/346893482.db2.gz GMPGEBUJZQVREH-GFCCVEGCSA-N 2 0 200.370 2.400 20 0 BEADRP CCC[NH2+]CC[NH2+][C@@H](C)CCC(C)C ZINC000053388097 346893542 /nfs/dbraw/zinc/89/35/42/346893542.db2.gz GMPGEBUJZQVREH-LBPRGKRZSA-N 2 0 200.370 2.400 20 0 BEADRP C[C@@H]1[C@@H]([NH2+]Cc2ccccc2)CCCN1C ZINC000306328388 398339667 /nfs/dbraw/zinc/33/96/67/398339667.db2.gz NIJPXCLERMPTQK-OCCSQVGLSA-N 2 0 218.344 2.259 20 0 BEADRP C[N@H+](Cc1coc2ccccc12)C1CC([NH3+])C1 ZINC000335479135 398341514 /nfs/dbraw/zinc/34/15/14/398341514.db2.gz RYGDIZBTJMMTBK-UHFFFAOYSA-N 2 0 230.311 2.354 20 0 BEADRP C[NH+](C)CC(C)(C)C[NH2+][C@H]1CCC[C@H]2C[C@H]21 ZINC000304577201 259335357 /nfs/dbraw/zinc/33/53/57/259335357.db2.gz NMFYGGCVCSODGM-XQQFMLRXSA-N 2 0 224.392 2.352 20 0 BEADRP CCc1cc(NCC[NH+]2CCCC2)cc[nH+]1 ZINC000307765880 529554558 /nfs/dbraw/zinc/55/45/58/529554558.db2.gz ASRRMKFUXVRJBS-UHFFFAOYSA-N 2 0 219.332 2.152 20 0 BEADRP CSCCCCC[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000235171310 342991204 /nfs/dbraw/zinc/99/12/04/342991204.db2.gz KQYHCJBEQRIMEK-NWDGAFQWSA-N 2 0 230.421 2.379 20 0 BEADRP C[C@H]([NH3+])[C@H]1CC[N@@H+]([C@@H]2CCc3ccc(F)cc32)C1 ZINC000351856983 136258365 /nfs/dbraw/zinc/25/83/65/136258365.db2.gz AHWCYIIWZQIXEX-ITDIGPHOSA-N 2 0 248.345 2.482 20 0 BEADRP C[C@@H](Cc1ccc(F)cc1)[NH2+]CCCC[NH3+] ZINC000162531602 349726111 /nfs/dbraw/zinc/72/61/11/349726111.db2.gz ZIOGOJMWBBEPJY-NSHDSACASA-N 2 0 224.323 2.085 20 0 BEADRP C[C@@H](F)CC[N@@H+]1CCC[C@H](c2ncc[nH]2)C1 ZINC000351875398 136261117 /nfs/dbraw/zinc/26/11/17/136261117.db2.gz LPONVKOGHCQZDG-MNOVXSKESA-N 2 0 225.311 2.337 20 0 BEADRP C[C@@H]1OCC[C@@]1(C)[NH2+]CC[C@@H]1CCCC[N@@H+]1C ZINC000235442233 343037581 /nfs/dbraw/zinc/03/75/81/343037581.db2.gz HOUFCWFYDAAVRW-MELADBBJSA-N 2 0 240.391 2.018 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)C(C)C ZINC000400937303 529660142 /nfs/dbraw/zinc/66/01/42/529660142.db2.gz BHXORWNSIDXYOL-SYQHCUMBSA-N 2 0 224.392 2.399 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)C(C)C ZINC000400937300 529661228 /nfs/dbraw/zinc/66/12/28/529661228.db2.gz BHXORWNSIDXYOL-FQUUOJAGSA-N 2 0 224.392 2.399 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+]CCC[NH+]1CCCC1 ZINC000308838081 346924745 /nfs/dbraw/zinc/92/47/45/346924745.db2.gz XCGXDKPHWFXHME-LBPRGKRZSA-N 2 0 210.365 2.251 20 0 BEADRP CC(C)CC[C@H](C)[NH2+][C@H]1CC[NH2+]C[C@@H]1C ZINC000308846773 346924188 /nfs/dbraw/zinc/92/41/88/346924188.db2.gz LPLUATDLUAEKDU-AVGNSLFASA-N 2 0 212.381 2.399 20 0 BEADRP CC(C)C[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000336702779 187231683 /nfs/dbraw/zinc/23/16/83/187231683.db2.gz QBWIBCNBQQWSCN-ACJTYDJDSA-N 2 0 210.365 2.294 20 0 BEADRP CCOc1cccc(C[N@@H+]2CC[C@H]([NH3+])C[C@@H]2C)c1 ZINC000131530765 343183788 /nfs/dbraw/zinc/18/37/88/343183788.db2.gz LDDBVEJWLULUKB-JSGCOSHPSA-N 2 0 248.370 2.397 20 0 BEADRP CCOc1ccc(C[N@@H+]2CC[C@H]([NH3+])C[C@@H]2C)cc1 ZINC000131473783 343183997 /nfs/dbraw/zinc/18/39/97/343183997.db2.gz IYTBJFSIMGWWNY-JSGCOSHPSA-N 2 0 248.370 2.397 20 0 BEADRP Cc1ccccc1CC[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000094183060 343152538 /nfs/dbraw/zinc/15/25/38/343152538.db2.gz AOPJMCQKPRLAMH-GJZGRUSLSA-N 2 0 232.371 2.397 20 0 BEADRP C[C@H]1C[C@H]([NH3+])CC[N@@H+]1Cc1ccc2c(c1)CCC2 ZINC000124494958 343162566 /nfs/dbraw/zinc/16/25/66/343162566.db2.gz PXBUIXSKYSTARG-BLLLJJGKSA-N 2 0 244.382 2.487 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@H]2CCC(C)(C)O2)CC1 ZINC000387457727 343215265 /nfs/dbraw/zinc/21/52/65/343215265.db2.gz WFQQLTAESVTZIN-CYBMUJFWSA-N 2 0 240.391 2.018 20 0 BEADRP [NH3+]C[C@H]1CC[N@H+](Cc2cccc3ncccc23)C1 ZINC000634687521 343241232 /nfs/dbraw/zinc/24/12/32/343241232.db2.gz OGXOUMMLBWIDLU-GFCCVEGCSA-N 2 0 241.338 2.015 20 0 BEADRP C[C@H]1C[C@H]([NH3+])CN1Cc1cccc2ncccc12 ZINC000634688582 343249074 /nfs/dbraw/zinc/24/90/74/343249074.db2.gz WZOVCFVKJCJQAJ-AAEUAGOBSA-N 2 0 241.338 2.156 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+]C1CCC(C(F)F)CC1 ZINC000335617742 136296405 /nfs/dbraw/zinc/29/64/05/136296405.db2.gz YVXQLAOCVJSVIM-WFBLGPOFSA-N 2 0 232.318 2.280 20 0 BEADRP CC(C)[C@H]1C[C@H]([NH2+]CCC[NH+](C)C)CS1 ZINC000336759374 346933456 /nfs/dbraw/zinc/93/34/56/346933456.db2.gz LGZNPMCOTGOGQE-NWDGAFQWSA-N 2 0 230.421 2.058 20 0 BEADRP Cc1cc(C[NH2+][C@H]2CC[NH2+][C@@H](C)C2)ccc1F ZINC000335635970 136300813 /nfs/dbraw/zinc/30/08/13/136300813.db2.gz BJZZDWDSYWTHTB-AAEUAGOBSA-N 2 0 236.334 2.364 20 0 BEADRP Cc1cc(C[NH2+][C@@H]2CC[NH2+][C@@H](C)C2)ccc1F ZINC000335635972 136300825 /nfs/dbraw/zinc/30/08/25/136300825.db2.gz BJZZDWDSYWTHTB-WCQYABFASA-N 2 0 236.334 2.364 20 0 BEADRP CC[C@H]1CCC[C@@H]([NH2+]CCC[NH+](C)C)C1 ZINC000070562244 343334959 /nfs/dbraw/zinc/33/49/59/343334959.db2.gz IVLYXTLGKJCNOF-QWHCGFSZSA-N 2 0 212.381 2.497 20 0 BEADRP CC[C@@H]1CCC[C@@H]([NH2+]CCC[NH+](C)C)C1 ZINC000070562243 343335081 /nfs/dbraw/zinc/33/50/81/343335081.db2.gz IVLYXTLGKJCNOF-CHWSQXEVSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000348869824 136302701 /nfs/dbraw/zinc/30/27/01/136302701.db2.gz PLSOTKJEAXKTNY-LSGALXMHSA-N 2 0 222.376 2.199 20 0 BEADRP c1ccc2c(c1)CC[C@@H]2C[NH2+][C@H]1CCC[NH2+]CC1 ZINC000335650854 136305204 /nfs/dbraw/zinc/30/52/04/136305204.db2.gz QSELBDNLLMWYPW-CABCVRRESA-N 2 0 244.382 2.448 20 0 BEADRP Fc1ccc(CN[C@@H]2CCCC[NH2+]C2)cc1F ZINC000335641536 136308444 /nfs/dbraw/zinc/30/84/44/136308444.db2.gz HKAHGSSXKLACMK-LLVKDONJSA-N 2 0 240.297 2.197 20 0 BEADRP Fc1cc(F)cc(CN[C@@H]2CCCC[NH2+]C2)c1 ZINC000335642345 136309143 /nfs/dbraw/zinc/30/91/43/136309143.db2.gz IAQICFJMBSNCTB-CYBMUJFWSA-N 2 0 240.297 2.197 20 0 BEADRP Cc1ccccc1C[N@H+]1CC[C@H]([C@@H](C)[NH3+])C1 ZINC000166214822 136309517 /nfs/dbraw/zinc/30/95/17/136309517.db2.gz HXBYFTYRGJLPQR-OCCSQVGLSA-N 2 0 218.344 2.164 20 0 BEADRP CCC[N@H+](CCC[NH+](C)C)C[C@@H]1C[C@@H]1C ZINC000349344536 136342534 /nfs/dbraw/zinc/34/25/34/136342534.db2.gz HMEYGUMVPNKDNJ-STQMWFEESA-N 2 0 212.381 2.306 20 0 BEADRP [NH3+]CCCC[NH2+][C@H]1CCc2cc(F)ccc21 ZINC000166514448 136358107 /nfs/dbraw/zinc/35/81/07/136358107.db2.gz LHFPASYUBUFELJ-ZDUSSCGKSA-N 2 0 222.307 2.142 20 0 BEADRP CC1=C[C@H](C)C[N@H+](CC[C@H]2CCC[NH+]2C)C1 ZINC000335891841 136358814 /nfs/dbraw/zinc/35/88/14/136358814.db2.gz AYVKIMNBQWTOCX-GXTWGEPZSA-N 2 0 222.376 2.369 20 0 BEADRP CCC[C@@H](C)C[NH+]1CCC([C@H](C)[NH3+])CC1 ZINC000082474748 343444363 /nfs/dbraw/zinc/44/43/63/343444363.db2.gz YAGQGJQGNHFHEZ-NEPJUHHUSA-N 2 0 212.381 2.482 20 0 BEADRP CCC[C@H](C)C[NH+]1CCC([C@H](C)[NH3+])CC1 ZINC000082474749 343444381 /nfs/dbraw/zinc/44/43/81/343444381.db2.gz YAGQGJQGNHFHEZ-RYUDHWBXSA-N 2 0 212.381 2.482 20 0 BEADRP CSC1CC[NH+](CC[C@@H]2CCC[N@@H+]2C)CC1 ZINC000602922604 349811837 /nfs/dbraw/zinc/81/18/37/349811837.db2.gz KTJGAYPEGHPHIV-LBPRGKRZSA-N 2 0 242.432 2.298 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@H]1CCc2ccccc2C1 ZINC000049554211 343602375 /nfs/dbraw/zinc/60/23/75/343602375.db2.gz HZRUXQBFVIHDJL-CJNGLKHVSA-N 2 0 246.398 2.474 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+]Cc1ccccc1 ZINC000049553433 343602751 /nfs/dbraw/zinc/60/27/51/343602751.db2.gz MLMOONRZFJQICV-LBPRGKRZSA-N 2 0 206.333 2.116 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+][C@@H]1CCC(C)(C)C1 ZINC000087771424 343660150 /nfs/dbraw/zinc/66/01/50/343660150.db2.gz PWJZYLDLOFPJRK-NWDGAFQWSA-N 2 0 212.381 2.495 20 0 BEADRP C/C=C/C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000384648551 343701919 /nfs/dbraw/zinc/70/19/19/343701919.db2.gz ABXPOWKYNNQWGV-OQXJOHJWSA-N 2 0 208.349 2.073 20 0 BEADRP CCC[C@@H]1C[C@@H]1[NH2+][C@@H]1CCN(C)C[C@@H]1C ZINC000090175198 343749965 /nfs/dbraw/zinc/74/99/65/343749965.db2.gz ONGGRQRKKHLWRI-LOWDOPEQSA-N 2 0 210.365 2.105 20 0 BEADRP C([NH2+]C1CCCCCC1)[C@H]1CCC[NH2+]C1 ZINC000040397408 187273784 /nfs/dbraw/zinc/27/37/84/187273784.db2.gz BSNGJERMQQZLOF-LBPRGKRZSA-N 2 0 210.365 2.298 20 0 BEADRP CCc1ccc(C[N@@H+]2CCC[C@H](C[NH3+])C2)cc1 ZINC000044527782 343781571 /nfs/dbraw/zinc/78/15/71/343781571.db2.gz PBCQXKULBZXKSP-OAHLLOKOSA-N 2 0 232.371 2.420 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+][C@H]1CCCC[C@H]1C[NH3+] ZINC000387661141 346994786 /nfs/dbraw/zinc/99/47/86/346994786.db2.gz HLONGKNINXWJNM-VOAKCMCISA-N 2 0 210.365 2.140 20 0 BEADRP C[NH2+]CCC[N@H+](C)C[C@H]1CCOc2ccccc21 ZINC000162078623 487535427 /nfs/dbraw/zinc/53/54/27/487535427.db2.gz ANMMEJOYYLQXDX-CYBMUJFWSA-N 2 0 248.370 2.094 20 0 BEADRP CCSCC[N@@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]2)C1 ZINC000159072873 347009361 /nfs/dbraw/zinc/00/93/61/347009361.db2.gz IVAVKVLVWCGJDV-OLZOCXBDSA-N 2 0 242.432 2.204 20 0 BEADRP CCC[C@H](C[NH2+]CCC[NH+]1CCCCC1)OC ZINC000395157407 362282513 /nfs/dbraw/zinc/28/25/13/362282513.db2.gz CLMSTTHAOICXLP-CQSZACIVSA-N 2 0 242.407 2.267 20 0 BEADRP CCN(CC)C[C@H](C)[NH2+]C1CC(C)(C)C1 ZINC000336749324 537840208 /nfs/dbraw/zinc/84/02/08/537840208.db2.gz DEUHAWJSSUOJAN-NSHDSACASA-N 2 0 212.381 2.495 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000634733441 344113317 /nfs/dbraw/zinc/11/33/17/344113317.db2.gz FYIFOVKNAVEJGV-UTUOFQBUSA-N 2 0 210.365 2.010 20 0 BEADRP CC1(C[NH2+][C@H]2CC[NH2+]CC(C)(C)C2)CC1 ZINC000634733978 344114617 /nfs/dbraw/zinc/11/46/17/344114617.db2.gz TYTSQFNKTLLMNE-NSHDSACASA-N 2 0 210.365 2.154 20 0 BEADRP CC1(C)CC[C@@H]([NH2+]CC[C@@H]2CC[NH2+]C2)C1 ZINC000129538199 344213735 /nfs/dbraw/zinc/21/37/35/344213735.db2.gz LPLWZBQZGZJUEG-NWDGAFQWSA-N 2 0 210.365 2.154 20 0 BEADRP CCCCOCCC[NH2+][C@H]1CC[N@H+](C)C[C@@H]1C ZINC000132021437 344267896 /nfs/dbraw/zinc/26/78/96/344267896.db2.gz HVDWNJUTYINRMG-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP CCCCOCCC[NH2+][C@@H]1CC[N@H+](C)C[C@@H]1C ZINC000132021208 344267948 /nfs/dbraw/zinc/26/79/48/344267948.db2.gz HVDWNJUTYINRMG-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]CCCOc2ccccc2)C1 ZINC000093215833 344312554 /nfs/dbraw/zinc/31/25/54/344312554.db2.gz GDUJXRCULGPZLB-KBPBESRZSA-N 2 0 248.370 2.315 20 0 BEADRP C[C@@H](c1ccc(F)cc1)[N@H+](C)CCC[NH3+] ZINC000133205950 344315223 /nfs/dbraw/zinc/31/52/23/344315223.db2.gz MKRVAEDYEGLLSI-JTQLQIEISA-N 2 0 210.296 2.167 20 0 BEADRP Cc1cc([C@H](C)[NH2+][C@@H]2C[C@H]2C2CC[NH2+]CC2)no1 ZINC000569567478 344319537 /nfs/dbraw/zinc/31/95/37/344319537.db2.gz QJVKEMRPBBRDJN-VHRBIJSZSA-N 2 0 249.358 2.022 20 0 BEADRP CCC[C@H](C)[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000132417741 344302104 /nfs/dbraw/zinc/30/21/04/344302104.db2.gz MUAWYPUPNOEPCQ-RWMBFGLXSA-N 2 0 210.365 2.391 20 0 BEADRP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]CC1CCCC1 ZINC000132678012 344306181 /nfs/dbraw/zinc/30/61/81/344306181.db2.gz KRLJCZIYNXKGSH-AAEUAGOBSA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)SCC[NH2+][C@H](C)C1CC[NH+](C)CC1 ZINC000380608565 344423851 /nfs/dbraw/zinc/42/38/51/344423851.db2.gz XJPVJLCZKTUOKB-GFCCVEGCSA-N 2 0 244.448 2.448 20 0 BEADRP CC[C@H]([NH2+]CC1CC[NH+](CC)CC1)C1CC1 ZINC000083056083 362386674 /nfs/dbraw/zinc/38/66/74/362386674.db2.gz LUNAOFJIXKTKLH-AWEZNQCLSA-N 2 0 224.392 2.497 20 0 BEADRP CCc1cc(N[C@@H]2CC[NH2+]CC(C)(C)C2)ncn1 ZINC000634813835 344399362 /nfs/dbraw/zinc/39/93/62/344399362.db2.gz ZDWSGAJLHSGOPQ-GFCCVEGCSA-N 2 0 248.374 2.229 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CCc1ccc(F)cc1F ZINC000584285622 344419711 /nfs/dbraw/zinc/41/97/11/344419711.db2.gz VMPIVKFNKSBTDD-NXEZZACHSA-N 2 0 242.313 2.223 20 0 BEADRP C[N@H+]1CC=C(C[NH2+][C@@H]2CC[C@H]2C2CC2)CC1 ZINC000336775441 537847347 /nfs/dbraw/zinc/84/73/47/537847347.db2.gz ZARUZAPKYKPJOW-UONOGXRCSA-N 2 0 220.360 2.027 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H]1CC[C@H]1C1CC1 ZINC000336775298 537847643 /nfs/dbraw/zinc/84/76/43/537847643.db2.gz YQLRBDVDSJKBTB-KBPBESRZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@@H](F)C1)[C@H]1CCC[NH2+]C1 ZINC000573967520 344580276 /nfs/dbraw/zinc/58/02/76/344580276.db2.gz SOZKQKOMJUXOMT-WUHRBBMRSA-N 2 0 228.355 2.245 20 0 BEADRP Cc1nc(C)c([C@H](C)NCC(C)(C)[NH3+])s1 ZINC000049538762 344651837 /nfs/dbraw/zinc/65/18/37/344651837.db2.gz USQDIJWKTRGSOU-ZETCQYMHSA-N 2 0 227.377 2.148 20 0 BEADRP CC[C@H]([NH3+])CN[C@H](C)c1sc(C)nc1C ZINC000049538807 344651858 /nfs/dbraw/zinc/65/18/58/344651858.db2.gz UIFOANBBALSIHK-XCBNKYQSSA-N 2 0 227.377 2.148 20 0 BEADRP CC(C)(N)C[N@@H+]1CCC[C@H]1C1CCCC1 ZINC000045089778 187292662 /nfs/dbraw/zinc/29/26/62/187292662.db2.gz KDWRZFNFVFKUDU-LBPRGKRZSA-N 2 0 210.365 2.378 20 0 BEADRP C[NH+](C)C[C@H]1CC[N@H+](C[C@]2(C)CCCS2)C1 ZINC000628174020 344894360 /nfs/dbraw/zinc/89/43/60/344894360.db2.gz UJQKNQIQNIRSLT-OLZOCXBDSA-N 2 0 242.432 2.156 20 0 BEADRP CCOCCCC[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000339076107 537873225 /nfs/dbraw/zinc/87/32/25/537873225.db2.gz SFEZTFSMGHFBTK-KGLIPLIRSA-N 2 0 240.391 2.020 20 0 BEADRP COCC[C@@H](C)[NH2+][C@@H]1CCN(C2CCCC2)C1 ZINC000153792646 344974448 /nfs/dbraw/zinc/97/44/48/344974448.db2.gz FEYZMMBUFRSHCH-CHWSQXEVSA-N 2 0 240.391 2.018 20 0 BEADRP [NH3+]C[C@H]1CC[C@@H]([NH2+]Cc2ccc(F)cc2F)C1 ZINC000583428569 344946773 /nfs/dbraw/zinc/94/67/73/344946773.db2.gz GSARZHMAHIBHAP-JOYOIKCWSA-N 2 0 240.297 2.182 20 0 BEADRP CCC1CC([NH2+]CCC2CC[NH+](C)CC2)C1 ZINC000309715640 168509733 /nfs/dbraw/zinc/50/97/33/168509733.db2.gz SQLGAQGOVUGIHQ-UHFFFAOYSA-N 2 0 224.392 2.497 20 0 BEADRP CC[N@H+](C)C[C@H]1CCN(Cc2ccc(C)nc2)C1 ZINC000153979016 345004159 /nfs/dbraw/zinc/00/41/59/345004159.db2.gz OMBAKVXEJOHXBD-OAHLLOKOSA-N 2 0 247.386 2.164 20 0 BEADRP FC(F)(F)CC[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000156094490 345122047 /nfs/dbraw/zinc/12/20/47/345122047.db2.gz RZFHHEKWLBLFOH-UWVGGRQHSA-N 2 0 236.281 2.155 20 0 BEADRP C[C@@H]1CCCCCN1CC12CC(C1)C[NH2+]2 ZINC000634992797 345188121 /nfs/dbraw/zinc/18/81/21/345188121.db2.gz BBTUCOGPHCDICB-PNESKVBLSA-N 2 0 208.349 2.003 20 0 BEADRP CCC(C)(C)CC[NH2+][C@@H]1CCOC[C@@H]1[C@H](C)[NH3+] ZINC000635021952 345224209 /nfs/dbraw/zinc/22/42/09/345224209.db2.gz QHQIXDIHJMQKOK-YNEHKIRRSA-N 2 0 242.407 2.155 20 0 BEADRP [NH3+][C@@H]1CCCCCN(Cc2cccs2)C1 ZINC000634997069 345194159 /nfs/dbraw/zinc/19/41/59/345194159.db2.gz CCAWMAUMKKBQOV-LLVKDONJSA-N 2 0 224.373 2.451 20 0 BEADRP C[C@H](C[C@@H]1CCC[NH2+]1)[NH2+][C@H]1CCCC12CC2 ZINC000634997609 345197672 /nfs/dbraw/zinc/19/76/72/345197672.db2.gz OZHRGDSBCCWAAX-AGIUHOORSA-N 2 0 222.376 2.439 20 0 BEADRP [NH3+]CC1CCC([NH2+][C@@H]2CCCC23CC3)CC1 ZINC000634998736 345199437 /nfs/dbraw/zinc/19/94/37/345199437.db2.gz KGPFBUMPBCSBQL-WXRRBKDZSA-N 2 0 222.376 2.426 20 0 BEADRP CCOc1ccc(C[N@H+]2C[C@@H](C[NH3+])[C@H](C)C2)cc1 ZINC000634999850 345201354 /nfs/dbraw/zinc/20/13/54/345201354.db2.gz AQURBSVDWVUSQA-TZMCWYRMSA-N 2 0 248.370 2.112 20 0 BEADRP C1CC12CCC[C@H]2[NH2+][C@H]1CCC[NH2+]CC1 ZINC000634998047 345202697 /nfs/dbraw/zinc/20/26/97/345202697.db2.gz ZTRVOEFXMQDBJV-NWDGAFQWSA-N 2 0 208.349 2.051 20 0 BEADRP C[C@H]([NH2+]Cc1cccc2c1CC[NH2+]C2)[C@@H]1C[C@H]1C ZINC000635002895 345205616 /nfs/dbraw/zinc/20/56/16/345205616.db2.gz AYSPRIQVLVUVIC-BFQNTYOBSA-N 2 0 244.382 2.466 20 0 BEADRP C[C@H]([NH2+][C@H]1CCCC12CC2)[C@H]1CCC[NH2+]1 ZINC000635004145 345207077 /nfs/dbraw/zinc/20/70/77/345207077.db2.gz NIZKQMVSGFFRPZ-TUAOUCFPSA-N 2 0 208.349 2.049 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+][C@@H]1CCO[C@H]1c1ccccc1 ZINC000635004212 345207744 /nfs/dbraw/zinc/20/77/44/345207744.db2.gz NOLDUJYGHHPLDE-GBOPCIDUSA-N 2 0 248.370 2.232 20 0 BEADRP C[C@H]1CC[C@H]([NH2+][C@H]2CC[C@H](C[NH3+])CC2)C1 ZINC000635006352 345210578 /nfs/dbraw/zinc/21/05/78/345210578.db2.gz MEMYPDZSIWWHDY-CYDGBPFRSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@H]2CC[C@H](C[NH3+])CC2)C1 ZINC000635006355 345210606 /nfs/dbraw/zinc/21/06/06/345210606.db2.gz MEMYPDZSIWWHDY-LPWJVIDDSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[NH2+]CC(C)(C)C1)C1CC1 ZINC000635011122 345212615 /nfs/dbraw/zinc/21/26/15/345212615.db2.gz MHBATPVWVMNCNK-PWSUYJOCSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H](CC1CCC1)[NH2+][C@H](C)[C@H]1CCC[NH2+]1 ZINC000635011369 345213455 /nfs/dbraw/zinc/21/34/55/345213455.db2.gz FBUAJSQSXDRHFU-NQBHXWOUSA-N 2 0 210.365 2.295 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+]Cc1cccc2[nH]ccc21 ZINC000635012237 345214208 /nfs/dbraw/zinc/21/42/08/345214208.db2.gz JVSXCYZGYPDQCE-GXTWGEPZSA-N 2 0 229.327 2.137 20 0 BEADRP CC(C)[C@H](C)[NH2+]Cc1cccc2c1CC[NH2+]C2 ZINC000635012566 345214709 /nfs/dbraw/zinc/21/47/09/345214709.db2.gz WJCHVXSJMMDQMF-LBPRGKRZSA-N 2 0 232.371 2.466 20 0 BEADRP CCCC[C@@H](COC)[NH2+][C@H]1CC[C@H](C[NH3+])CC1 ZINC000635008214 345215700 /nfs/dbraw/zinc/21/57/00/345215700.db2.gz SCXCREXFUBCEHE-IHRRRGAJSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H]1C[C@H]1C(F)(F)F ZINC000635014245 345219235 /nfs/dbraw/zinc/21/92/35/345219235.db2.gz ZMWSQCBDJAGDBE-DJLDLDEBSA-N 2 0 224.270 2.044 20 0 BEADRP CC(C)CCC[NH2+][C@H]1CC[N@H+](C)C[C@@H]1C ZINC000132293019 345325385 /nfs/dbraw/zinc/32/53/85/345325385.db2.gz VEYBWBHZRZJHAJ-STQMWFEESA-N 2 0 212.381 2.352 20 0 BEADRP CCOC(C)(C)C[NH2+][C@H]1C[C@H](C)N(C2CC2)C1 ZINC000159250944 345419617 /nfs/dbraw/zinc/41/96/17/345419617.db2.gz RFMNJKHZLCRSRZ-RYUDHWBXSA-N 2 0 240.391 2.016 20 0 BEADRP CC(C)[N@@H+]1CCCC2(CC[NH+](C)CC2)C1 ZINC000147498143 345710969 /nfs/dbraw/zinc/71/09/69/345710969.db2.gz RQSVWYSSWCQULD-UHFFFAOYSA-N 2 0 210.365 2.203 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@H]2CC[C@@H](C)C2)CC1 ZINC000070643702 345793348 /nfs/dbraw/zinc/79/33/48/345793348.db2.gz FDRPFUJCLLNMHL-OCCSQVGLSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCC[C@H]([NH3+])C1)c1cccc(O)c1 ZINC000093214300 345857782 /nfs/dbraw/zinc/85/77/82/345857782.db2.gz BMXILSSBTGFDMS-KGYLQXTDSA-N 2 0 234.343 2.313 20 0 BEADRP CC[C@H](C)[N@@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000181132612 345929050 /nfs/dbraw/zinc/92/90/50/345929050.db2.gz DDKNNRVTFYQVCL-QWHCGFSZSA-N 2 0 210.365 2.203 20 0 BEADRP CCc1cc(NC[C@@H]2CCC[N@H+](C)C2)cc[nH+]1 ZINC000307767797 345949640 /nfs/dbraw/zinc/94/96/40/345949640.db2.gz IYLDFPNBLHJXDN-LBPRGKRZSA-N 2 0 233.359 2.398 20 0 BEADRP COCC[NH2+]C1CC[NH+](CCCC(C)C)CC1 ZINC000563231364 323105634 /nfs/dbraw/zinc/10/56/34/323105634.db2.gz HPPXGTNUEBLJKX-UHFFFAOYSA-N 2 0 242.407 2.123 20 0 BEADRP CC[C@@H](C)C[N@H+](C)CC[C@@H]1CCC[NH2+]C1 ZINC000051918986 346207678 /nfs/dbraw/zinc/20/76/78/346207678.db2.gz IPCIKTZFFFEEJE-OLZOCXBDSA-N 2 0 212.381 2.354 20 0 BEADRP C1CC1C([NH2+][C@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)C1CC1 ZINC000401136129 346276023 /nfs/dbraw/zinc/27/60/23/346276023.db2.gz QQSBTSOALYXOCL-MCIONIFRSA-N 2 0 234.387 2.153 20 0 BEADRP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCC[NH2+]C1 ZINC000669378417 537966890 /nfs/dbraw/zinc/96/68/90/537966890.db2.gz DOEIRAGADRROJI-OLZOCXBDSA-N 2 0 210.365 2.251 20 0 BEADRP Cc1cccc(C)c1CN1CCC[NH2+]CC1 ZINC000122154679 179035380 /nfs/dbraw/zinc/03/53/80/179035380.db2.gz XJUQGSAKICQCEM-UHFFFAOYSA-N 2 0 218.344 2.099 20 0 BEADRP C[C@H]1CCCC[N@@H+]1C[C@H]1CCCC[NH2+]C1 ZINC000669378419 537966240 /nfs/dbraw/zinc/96/62/40/537966240.db2.gz DOEIRAGADRROJI-STQMWFEESA-N 2 0 210.365 2.251 20 0 BEADRP Cc1cccc(CC[NH2+]CC2CC[NH2+]CC2)c1 ZINC000094010423 179057868 /nfs/dbraw/zinc/05/78/68/179057868.db2.gz DBHVZNGFGCLGNV-UHFFFAOYSA-N 2 0 232.371 2.127 20 0 BEADRP Cc1cccc(C[N@H+](C)C[C@H]2CC[NH2+]C2)c1 ZINC000051890078 179067605 /nfs/dbraw/zinc/06/76/05/179067605.db2.gz GCBMHOKMXYPVIX-AWEZNQCLSA-N 2 0 218.344 2.036 20 0 BEADRP Cc1cccc(C[N@H+]2CC[C@H]([C@@H](C)[NH3+])C2)c1 ZINC000107935070 179081513 /nfs/dbraw/zinc/08/15/13/179081513.db2.gz BPSLYPCHBVNWEJ-OCCSQVGLSA-N 2 0 218.344 2.164 20 0 BEADRP CC[C@H]1CCC[C@@H](C[N@H+](C)CCC[NH3+])C1 ZINC000394504802 346423546 /nfs/dbraw/zinc/42/35/46/346423546.db2.gz FCASSFUWLJELPC-QWHCGFSZSA-N 2 0 212.381 2.483 20 0 BEADRP Cc1cccc(C[NH2+]CC2=CC[N@H+](C)CC2)c1F ZINC000295395127 179090976 /nfs/dbraw/zinc/09/09/76/179090976.db2.gz LQKOYCGRFNZCPT-UHFFFAOYSA-N 2 0 248.345 2.486 20 0 BEADRP Cc1cccc(C[NH2+][C@@H](C)CCC[NH3+])c1 ZINC000336682626 179096727 /nfs/dbraw/zinc/09/67/27/179096727.db2.gz JLNWQZQEVJLVSL-LBPRGKRZSA-N 2 0 206.333 2.212 20 0 BEADRP Cc1cccc(C[NH2+][C@@H]2CC[NH2+][C@H](C)C2)c1 ZINC000334865151 179097272 /nfs/dbraw/zinc/09/72/72/179097272.db2.gz QZDOZDWIFPADBG-TZMCWYRMSA-N 2 0 218.344 2.225 20 0 BEADRP Cc1ccc(CC[NH2+][C@H]2C[C@@H]([NH3+])C2(C)C)cc1 ZINC000641802609 362755414 /nfs/dbraw/zinc/75/54/14/362755414.db2.gz NRLCTDJBUFCHLZ-KGLIPLIRSA-N 2 0 232.371 2.253 20 0 BEADRP C[C@@H](CCC1CC1)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000186330241 346501747 /nfs/dbraw/zinc/50/17/47/346501747.db2.gz WYEBNRITZBTHBZ-GXTWGEPZSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1cnccc1CN1[C@@H](C)[C@H](C)CC[C@H]1C[NH3+] ZINC000641806385 362764981 /nfs/dbraw/zinc/76/49/81/362764981.db2.gz RIPAHFCEZSMLRI-ZLDLUXBVSA-N 2 0 247.386 2.338 20 0 BEADRP C[C@H](Cc1ccsc1)[NH2+][C@H](C)C[C@H](C)[NH3+] ZINC000580182195 346621383 /nfs/dbraw/zinc/62/13/83/346621383.db2.gz RYMZVISCZDSYNX-HBNTYKKESA-N 2 0 226.389 2.395 20 0 BEADRP CC(C)C[C@H](C)[NH2+]CCN1CC[C@H](C)C1 ZINC000380065343 365836831 /nfs/dbraw/zinc/83/68/31/365836831.db2.gz BVCDBQFCCWIOAL-STQMWFEESA-N 2 0 212.381 2.352 20 0 BEADRP Cc1cccc(NC[C@H]2CCC[C@H]([NH3+])C2)[nH+]1 ZINC000227669526 179147977 /nfs/dbraw/zinc/14/79/77/179147977.db2.gz GCRAFEBVXXFLET-RYUDHWBXSA-N 2 0 219.332 2.319 20 0 BEADRP Cc1cccc(OCC[N@H+]2CC[C@@H]([C@@H](C)[NH3+])C2)c1 ZINC000163194604 179165989 /nfs/dbraw/zinc/16/59/89/179165989.db2.gz IWDJZXHEHHTUFB-ZIAGYGMSSA-N 2 0 248.370 2.043 20 0 BEADRP COC[C@H](C)C[NH2+]CC[C@H](C)[NH+]1CCCCC1 ZINC000188377897 346806263 /nfs/dbraw/zinc/80/62/63/346806263.db2.gz XIGZKNLIUUBHLM-KGLIPLIRSA-N 2 0 242.407 2.123 20 0 BEADRP COC[C@@H](C)C[NH2+]CC[C@H](C)[NH+]1CCCCC1 ZINC000188377946 346806666 /nfs/dbraw/zinc/80/66/66/346806666.db2.gz XIGZKNLIUUBHLM-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP COC[C@@H](C)C[NH2+]CC[C@@H](C)[NH+]1CCCCC1 ZINC000188377969 346806720 /nfs/dbraw/zinc/80/67/20/346806720.db2.gz XIGZKNLIUUBHLM-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP Cc1cccc(OCC[N@@H+]2CC[C@H]([NH3+])[C@H](C)C2)c1 ZINC000042896877 179168438 /nfs/dbraw/zinc/16/84/38/179168438.db2.gz VMLPKQNOTQOUAZ-HIFRSBDPSA-N 2 0 248.370 2.043 20 0 BEADRP CN(C[C@H]1CCC2(CCCC2)O1)CC(C)(C)[NH3+] ZINC000641825534 362775674 /nfs/dbraw/zinc/77/56/74/362775674.db2.gz YTRLWHYUBRMEDZ-GFCCVEGCSA-N 2 0 240.391 2.147 20 0 BEADRP C[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1)c1cccnc1 ZINC000582063402 347157442 /nfs/dbraw/zinc/15/74/42/347157442.db2.gz CPBZSQGDRWUSMP-GFCCVEGCSA-N 2 0 241.338 2.391 20 0 BEADRP Cc1cccc([C@@H](C)[NH+]2CCC([NH3+])CC2)c1 ZINC000041046862 179178109 /nfs/dbraw/zinc/17/81/09/179178109.db2.gz MFJLRSBGDHTRRM-GFCCVEGCSA-N 2 0 218.344 2.479 20 0 BEADRP CC[NH+]1CCC(CC[NH2+]C[C@H]2C[C@H]2C)CC1 ZINC000309957768 347205438 /nfs/dbraw/zinc/20/54/38/347205438.db2.gz JIWYGLFVBBGCCR-TZMCWYRMSA-N 2 0 224.392 2.354 20 0 BEADRP CC[C@@H]([NH2+][C@H]1CCc2nc[nH]c2C1)C1CC1 ZINC000310041309 347223174 /nfs/dbraw/zinc/22/31/74/347223174.db2.gz YMFXFPJUGDICHE-WDEREUQCSA-N 2 0 219.332 2.045 20 0 BEADRP Cc1cccc([C@H](C)[N@@H+]2CC[C@@H](C[NH3+])C2)c1 ZINC000251201748 179194726 /nfs/dbraw/zinc/19/47/26/179194726.db2.gz UQMWVBRNPKQUTF-STQMWFEESA-N 2 0 218.344 2.337 20 0 BEADRP CC[NH+]1CCC([NH2+]CC(CC)(CC)OC)CC1 ZINC000310348895 347270033 /nfs/dbraw/zinc/27/00/33/347270033.db2.gz GONCDLISAFLWLK-UHFFFAOYSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@]1(C[NH3+])CC[N@H+](C/C=C\c2ccccc2)C1 ZINC000310413511 347281296 /nfs/dbraw/zinc/28/12/96/347281296.db2.gz XITDHPRILIATHH-GTBONMDNSA-N 2 0 230.355 2.371 20 0 BEADRP Cc1ccccc1CCC[NH+]1CCC([NH3+])CC1 ZINC000011729480 179261617 /nfs/dbraw/zinc/26/16/17/179261617.db2.gz NBHAXRVDQFJBAS-UHFFFAOYSA-N 2 0 232.371 2.351 20 0 BEADRP Cc1c[nH+]ccc1NC1CC[NH+](C2CC2)CC1 ZINC000195343140 347631213 /nfs/dbraw/zinc/63/12/13/347631213.db2.gz HFTRTFVYMSBEFK-UHFFFAOYSA-N 2 0 231.343 2.429 20 0 BEADRP Cc1ccccc1CC[NH2+][C@@H]1CC[N@@H+](C)C[C@H]1C ZINC000358290461 179267050 /nfs/dbraw/zinc/26/70/50/179267050.db2.gz RLJLOZDBQALZOY-GDBMZVCRSA-N 2 0 246.398 2.467 20 0 BEADRP Cc1ccccc1CC[NH2+][C@@H]1CCC[C@H]1C[NH3+] ZINC000094182726 179267423 /nfs/dbraw/zinc/26/74/23/179267423.db2.gz KSNYARNHFBWAAD-LSDHHAIUSA-N 2 0 232.371 2.255 20 0 BEADRP CC1(C)CCC[C@H]1[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000414900393 323151885 /nfs/dbraw/zinc/15/18/85/323151885.db2.gz DIFYEPXYFYJAGG-VXGBXAGGSA-N 2 0 210.365 2.297 20 0 BEADRP Cc1ccccc1C[N@H+]1CC[C@H](C)[C@H](C[NH3+])C1 ZINC000163438015 179277051 /nfs/dbraw/zinc/27/70/51/179277051.db2.gz DVWDWYGCPMUCEO-DZGCQCFKSA-N 2 0 232.371 2.412 20 0 BEADRP CC[N@H+](CCSC)CC[C@H]1CCC[NH+]1C ZINC000592201468 347753852 /nfs/dbraw/zinc/75/38/52/347753852.db2.gz HBOXPSGLBRMVGX-GFCCVEGCSA-N 2 0 230.421 2.156 20 0 BEADRP CCS[C@@H]1CC[C@H]([N@H+](C)C[C@H]2CC[NH2+]C2)C1 ZINC000592476774 347791458 /nfs/dbraw/zinc/79/14/58/347791458.db2.gz YQOSOLKYZUKUQU-RWMBFGLXSA-N 2 0 242.432 2.202 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+]CC1(C)CC[NH2+]CC1 ZINC000319565034 259398342 /nfs/dbraw/zinc/39/83/42/259398342.db2.gz QHDGBIRVHNEZSU-RYUDHWBXSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H]([NH2+]CCc1cncn1C)c1cccc(F)c1 ZINC000401792057 347902627 /nfs/dbraw/zinc/90/26/27/347902627.db2.gz XCXHTVAVBVUAGN-LLVKDONJSA-N 2 0 247.317 2.453 20 0 BEADRP Cc1ccccc1[C@@H](C)[NH2+]C[C@@H](C)C[NH3+] ZINC000309003978 179321576 /nfs/dbraw/zinc/32/15/76/179321576.db2.gz STIVIZNYQUKWGV-CMPLNLGQSA-N 2 0 206.333 2.240 20 0 BEADRP CC(C)[C@H]1CC[C@H]1[NH2+]CC1CC[NH2+]CC1 ZINC000577383042 365940996 /nfs/dbraw/zinc/94/09/96/365940996.db2.gz MIZUNZYDOUIHQE-CHWSQXEVSA-N 2 0 210.365 2.010 20 0 BEADRP Cc1ccccc1[C@H](C)[NH2+]CCCC[NH3+] ZINC000037714931 179337106 /nfs/dbraw/zinc/33/71/06/179337106.db2.gz HKLQEARVUTZIFD-LBPRGKRZSA-N 2 0 206.333 2.385 20 0 BEADRP [NH3+]CCC[N@@H+]1CCCC[C@H]1Cc1ccccc1 ZINC000202728502 348043942 /nfs/dbraw/zinc/04/39/42/348043942.db2.gz JWZCYSNNROAHDN-HNNXBMFYSA-N 2 0 232.371 2.432 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@H](C)CSCCF ZINC000595018008 348170924 /nfs/dbraw/zinc/17/09/24/348170924.db2.gz ZMHSDIRHXFVIJF-GHMZBOCLSA-N 2 0 236.400 2.007 20 0 BEADRP CCSC1(C[NH2+]C2CC[NH+](CC)CC2)CC1 ZINC000595098947 348194398 /nfs/dbraw/zinc/19/43/98/348194398.db2.gz KOEQVGZWPOGPEB-UHFFFAOYSA-N 2 0 242.432 2.346 20 0 BEADRP Cc1cncc(C[N@@H+]2C[C@H](C[NH3+])[C@H](C)C[C@@H]2C)c1 ZINC000397310596 362874920 /nfs/dbraw/zinc/87/49/20/362874920.db2.gz ORUHSGYKWBSUGU-IPYPFGDCSA-N 2 0 247.386 2.195 20 0 BEADRP CSCC1(CC[NH2+][C@H]2CCC[C@H]([NH3+])C2)CC1 ZINC000596651880 348606172 /nfs/dbraw/zinc/60/61/72/348606172.db2.gz RHODEEIGOCFSHP-RYUDHWBXSA-N 2 0 242.432 2.379 20 0 BEADRP CCSC1(C[NH2+][C@@H](C)[C@H]2CCC[NH2+]2)CC1 ZINC000596652322 348606737 /nfs/dbraw/zinc/60/67/37/348606737.db2.gz PPFAJZRXFSXWQC-WDEREUQCSA-N 2 0 228.405 2.002 20 0 BEADRP CCSC1(C[NH2+][C@H](C)CCCC[NH3+])CC1 ZINC000596654232 348607921 /nfs/dbraw/zinc/60/79/21/348607921.db2.gz ZCYKBVUZUMUTOQ-LLVKDONJSA-N 2 0 230.421 2.379 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CC[C@H]([NH3+])C1)c1ccccc1 ZINC000669384880 538018406 /nfs/dbraw/zinc/01/84/06/538018406.db2.gz LHTDYTSJARXWOS-BZPMIXESSA-N 2 0 218.344 2.465 20 0 BEADRP CSC[C@H](C)[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1 ZINC000598965328 349068901 /nfs/dbraw/zinc/06/89/01/349068901.db2.gz XZFGIMGPBLHBSB-QWRGUYRKSA-N 2 0 230.421 2.200 20 0 BEADRP CC[C@H](C)[N@@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000248372851 349125052 /nfs/dbraw/zinc/12/50/52/349125052.db2.gz DDKNNRVTFYQVCL-STQMWFEESA-N 2 0 210.365 2.203 20 0 BEADRP COC1([C@H](C)[NH2+]CCC[NH+](C)C)CCCCC1 ZINC000421804925 192384299 /nfs/dbraw/zinc/38/42/99/192384299.db2.gz VFRBDQLABAFSFS-ZDUSSCGKSA-N 2 0 242.407 2.266 20 0 BEADRP CC[C@H](C)C[NH2+][C@@H]1CC[N@H+](C)[C@@H]2CCC[C@H]21 ZINC000421873253 192397835 /nfs/dbraw/zinc/39/78/35/192397835.db2.gz HHIUTPUKYSLNGT-IGQOVBAYSA-N 2 0 224.392 2.495 20 0 BEADRP CCCCN1CCCC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000249905237 349165698 /nfs/dbraw/zinc/16/56/98/349165698.db2.gz YBPBQUFGULXXQW-CHWSQXEVSA-N 2 0 210.365 2.393 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCC[NH+]2CCCC2)C[C@H](C)O1 ZINC000252149506 349197005 /nfs/dbraw/zinc/19/70/05/349197005.db2.gz OKEOZZVAUMEHEQ-BTTYYORXSA-N 2 0 240.391 2.018 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[NH2+]C[C@H]1C ZINC000388634451 349279211 /nfs/dbraw/zinc/27/92/11/349279211.db2.gz MEHMUEDDJOQREN-LPWJVIDDSA-N 2 0 210.365 2.153 20 0 BEADRP CC1=CC[C@@H]([NH2+]CCN(C)C(C)C)CC1 ZINC000380262280 349280660 /nfs/dbraw/zinc/28/06/60/349280660.db2.gz RZJNJNQQZQXZPP-CYBMUJFWSA-N 2 0 210.365 2.415 20 0 BEADRP [NH3+][C@@H]1CCC[C@H](C[NH2+]C(C2CC2)C2CC2)C1 ZINC000070503286 350016199 /nfs/dbraw/zinc/01/61/99/350016199.db2.gz AVKOCTOAVCRCAO-GXFFZTMASA-N 2 0 222.376 2.282 20 0 BEADRP CC[C@H]([NH2+]CCCC[NH3+])c1ccc(F)cn1 ZINC000161321684 349421699 /nfs/dbraw/zinc/42/16/99/349421699.db2.gz CVHPCHHKZZKKGR-NSHDSACASA-N 2 0 225.311 2.000 20 0 BEADRP C[C@@H](c1ccncc1)N1CC[C@@H](C[NH+](C)C)C1 ZINC000603939456 350057181 /nfs/dbraw/zinc/05/71/81/350057181.db2.gz MDFBZUHXMQTVKY-STQMWFEESA-N 2 0 233.359 2.026 20 0 BEADRP CCc1nc([C@H](C)[NH2+][C@@H](C)CCC[NH3+])cs1 ZINC000422703038 192434959 /nfs/dbraw/zinc/43/49/59/192434959.db2.gz GSBKQKXFMKYOJF-UWVGGRQHSA-N 2 0 241.404 2.484 20 0 BEADRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)C(C)(C)C ZINC000422711560 192436991 /nfs/dbraw/zinc/43/69/91/192436991.db2.gz MWBJSEPZFLYZKN-WSMDXJOWSA-N 2 0 210.365 2.294 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]CCc1cccs1 ZINC000132115610 191025420 /nfs/dbraw/zinc/02/54/20/191025420.db2.gz TWTGHOCNHXNVQK-YPMHNXCESA-N 2 0 238.400 2.220 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CCCSC)[C@H](C)C1 ZINC000132473823 191032069 /nfs/dbraw/zinc/03/20/69/191032069.db2.gz JEZDTZNQDHXQGL-VXGBXAGGSA-N 2 0 230.421 2.059 20 0 BEADRP C[C@H]([NH2+]CCC[NH+]1CCCC1)C(C)(C)C ZINC000133301101 191039430 /nfs/dbraw/zinc/03/94/30/191039430.db2.gz RYKBVKJKPROCGI-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP CCC(CC)C[NH2+][C@@H]1CC[N@H+](C)C[C@@H]1C ZINC000133371821 191040586 /nfs/dbraw/zinc/04/05/86/191040586.db2.gz BAQNCAXKNZVKOY-WCQYABFASA-N 2 0 212.381 2.352 20 0 BEADRP CCC(CC)C[NH2+][C@H]1CC[N@H+](C)C[C@@H]1C ZINC000133371979 191040849 /nfs/dbraw/zinc/04/08/49/191040849.db2.gz BAQNCAXKNZVKOY-AAEUAGOBSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCC[C@@H]1C)C[NH+]1CCCC1 ZINC000083402362 350196159 /nfs/dbraw/zinc/19/61/59/350196159.db2.gz WMRXFPXICXMAJT-HZSPNIEDSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H](C)[NH2+]C[C@@H](C)C[NH+]1CCCCC1 ZINC000038041621 350302873 /nfs/dbraw/zinc/30/28/73/350302873.db2.gz BJQOVXMHKXNMNK-CHWSQXEVSA-N 2 0 212.381 2.497 20 0 BEADRP CC(C)Oc1cccc(CN2CC[C@@H]([NH3+])C2)c1 ZINC000050228055 350315142 /nfs/dbraw/zinc/31/51/42/350315142.db2.gz JHOFOWUJHUDLHE-CYBMUJFWSA-N 2 0 234.343 2.007 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H]1CCc2ccc(F)cc21 ZINC000423226579 490477968 /nfs/dbraw/zinc/47/79/68/490477968.db2.gz RGFQWTRCKFATTM-TVQRCGJNSA-N 2 0 222.307 2.140 20 0 BEADRP CCC1([NH2+][C@@H]2CC[N@H+](C)C(C)(C)C2)CC1 ZINC000623536831 362955750 /nfs/dbraw/zinc/95/57/50/362955750.db2.gz DKPLNJHQNXUHMM-LLVKDONJSA-N 2 0 210.365 2.391 20 0 BEADRP C[NH2+]CCC[NH2+]Cc1c(C)cc(C)cc1C ZINC000163318312 350517139 /nfs/dbraw/zinc/51/71/39/350517139.db2.gz BXZCAANTIYFJCQ-UHFFFAOYSA-N 2 0 220.360 2.311 20 0 BEADRP COc1cccc2c1CCC[C@@H]2[NH2+]C[C@@H](C)C[NH3+] ZINC000577482269 365963442 /nfs/dbraw/zinc/96/34/42/365963442.db2.gz YTSBFUCZKATLBP-FZMZJTMJSA-N 2 0 248.370 2.257 20 0 BEADRP CC[NH2+][C@@H]1CCCC[C@H]1C[NH+](CC)CC ZINC000060720696 350498841 /nfs/dbraw/zinc/49/88/41/350498841.db2.gz NNLSWNZYQXHCHB-QWHCGFSZSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@H](CC[NH+](C)C)N[C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000227539746 350500766 /nfs/dbraw/zinc/50/07/66/350500766.db2.gz KZVOSBBGCYLGHT-KCPJHIHWSA-N 2 0 247.386 2.061 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCN(C)C2CCCC2)CCO1 ZINC000070362062 350531221 /nfs/dbraw/zinc/53/12/21/350531221.db2.gz FKCGQLOERARJEF-OLZOCXBDSA-N 2 0 240.391 2.018 20 0 BEADRP CC[C@H]1CCC[C@H]1[NH2+]CC1=CC[NH2+]CC1 ZINC000577483028 365964930 /nfs/dbraw/zinc/96/49/30/365964930.db2.gz GGFZHIRJJQPLED-QWHCGFSZSA-N 2 0 208.349 2.074 20 0 BEADRP C[C@@H](CCc1ccco1)[NH2+][C@@H]1CCCC[NH2+]C1 ZINC000577483167 365965018 /nfs/dbraw/zinc/96/50/18/365965018.db2.gz UWVOEBOFIANZEP-QWHCGFSZSA-N 2 0 236.359 2.332 20 0 BEADRP CCC(C)(C)CC[N@@H+]1CC[C@H]2[NH2+]CC[C@H]2C1 ZINC000428029322 191109404 /nfs/dbraw/zinc/10/94/04/191109404.db2.gz ABSCJAUJNRPTGF-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@H]2CC[N@H+](C)C(C)(C)C2)CS1 ZINC000623549721 362969796 /nfs/dbraw/zinc/96/97/96/362969796.db2.gz MOSQMNFOWKTOSV-GRYCIOLGSA-N 2 0 242.432 2.343 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+][C@@H]2C[C@H]3C[C@H]3C2)CC1(C)C ZINC000623555187 362975505 /nfs/dbraw/zinc/97/55/05/362975505.db2.gz CAGLYZCELBHWON-YVECIDJPSA-N 2 0 222.376 2.247 20 0 BEADRP C[C@H]1C[C@@H](C[NH3+])C[N@@H+]1C[C@H]1CCCC[C@H]1C ZINC000346689627 365992000 /nfs/dbraw/zinc/99/20/00/365992000.db2.gz ZQPUSVQSLFJNHX-ZOBORPQBSA-N 2 0 224.392 2.482 20 0 BEADRP C[C@@H]1SCC[C@H]1[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623558516 362981288 /nfs/dbraw/zinc/98/12/88/362981288.db2.gz AGILQMCDTQNJIW-SDDRHHMPSA-N 2 0 242.432 2.343 20 0 BEADRP CCCC[N@H+](C)CCC[NH+](CC)CC ZINC000041210418 350784176 /nfs/dbraw/zinc/78/41/76/350784176.db2.gz CTWPVMXNOJUBDH-UHFFFAOYSA-N 2 0 200.370 2.450 20 0 BEADRP C[C@H]1CCCCN1CC[NH2+]CC(C)(C)C ZINC000163792254 350846021 /nfs/dbraw/zinc/84/60/21/350846021.db2.gz LMBRWRWQCXENQA-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@H]2COC(C)(C)C2)CC1(C)C ZINC000623561958 362985989 /nfs/dbraw/zinc/98/59/89/362985989.db2.gz DAXNVZBBCLDNEG-NWDGAFQWSA-N 2 0 240.391 2.016 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+][C@@H]2COC(C)(C)C2)CC1(C)C ZINC000623561957 362986048 /nfs/dbraw/zinc/98/60/48/362986048.db2.gz DAXNVZBBCLDNEG-NEPJUHHUSA-N 2 0 240.391 2.016 20 0 BEADRP CCN1CCC[C@H]1C[NH2+][C@@H](C)c1ccncc1 ZINC000019960035 350917003 /nfs/dbraw/zinc/91/70/03/350917003.db2.gz APZPSLSEMUJPGI-JSGCOSHPSA-N 2 0 233.359 2.217 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)CC2CCC2)C1 ZINC000252709094 538099757 /nfs/dbraw/zinc/09/97/57/538099757.db2.gz CAFGXXFNXDRBOX-OCCSQVGLSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@H](F)C1)[C@@H]1CCCC[NH2+]1 ZINC000577611606 366017413 /nfs/dbraw/zinc/01/74/13/366017413.db2.gz TWALEVYVDCCQEL-RVMXOQNASA-N 2 0 228.355 2.387 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+][C@@H]2[C@@H]3CCC[C@@H]32)CC1(C)C ZINC000623572199 363001177 /nfs/dbraw/zinc/00/11/77/363001177.db2.gz USPUTNMZZPVBDO-FVCCEPFGSA-N 2 0 222.376 2.247 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)C1CC(F)(F)C1 ZINC000628327046 351263463 /nfs/dbraw/zinc/26/34/63/351263463.db2.gz GLRWNNKBWLGLQT-FOGDFJRCSA-N 2 0 246.345 2.350 20 0 BEADRP CCCC[NH2+][C@@H](Cc1ccccc1)[C@@H](C)[NH3+] ZINC000201263763 363053892 /nfs/dbraw/zinc/05/38/92/363053892.db2.gz RJOHFBHGRAQINE-OCCSQVGLSA-N 2 0 220.360 2.335 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]CCCC1CC1 ZINC000577740195 366049683 /nfs/dbraw/zinc/04/96/83/366049683.db2.gz NKPUCYADLDSTIU-DGCLKSJQSA-N 2 0 210.365 2.154 20 0 BEADRP CCC[C@@H](C[N@H+](C)C[C@H]1CCC[NH+](C)C1)OC ZINC000637930614 351807169 /nfs/dbraw/zinc/80/71/69/351807169.db2.gz QGJLDQRSKIHSCS-KBPBESRZSA-N 2 0 242.407 2.075 20 0 BEADRP CC[C@@](C)(C[NH+]1CCC([NH2+]C(C)C)CC1)OC ZINC000637997545 351874550 /nfs/dbraw/zinc/87/45/50/351874550.db2.gz CJNZHYJZXGQOLE-AWEZNQCLSA-N 2 0 242.407 2.264 20 0 BEADRP CC[C@](C)(C[NH+]1CCC([NH2+]C(C)C)CC1)OC ZINC000637997546 351874947 /nfs/dbraw/zinc/87/49/47/351874947.db2.gz CJNZHYJZXGQOLE-CQSZACIVSA-N 2 0 242.407 2.264 20 0 BEADRP CC[C@](C)(C[N@H+](C)CC1CC[NH+](C)CC1)OC ZINC000638029408 351909825 /nfs/dbraw/zinc/90/98/25/351909825.db2.gz PAFKCNIYWQGHOU-CQSZACIVSA-N 2 0 242.407 2.075 20 0 BEADRP CO[C@@H](C[NH2+]CCC[NH+](C)C)C1CCCCC1 ZINC000638289481 352125036 /nfs/dbraw/zinc/12/50/36/352125036.db2.gz JZXWFRDZTFEWFT-AWEZNQCLSA-N 2 0 242.407 2.123 20 0 BEADRP CCCCCC[NH+]1CCC(C[NH2+]C)CC1 ZINC000051756166 168662280 /nfs/dbraw/zinc/66/22/80/168662280.db2.gz SHAWTRIKHQQKJA-UHFFFAOYSA-N 2 0 212.381 2.498 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]CCC[C@H]2CCO2)CC1 ZINC000638321339 352143001 /nfs/dbraw/zinc/14/30/01/352143001.db2.gz WXQGUQYGLYILCM-AWEZNQCLSA-N 2 0 240.391 2.018 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)[C@H]2CC2(F)F)C1 ZINC000638408348 352214167 /nfs/dbraw/zinc/21/41/67/352214167.db2.gz AHEYAVYEWULFAT-QJPTWQEYSA-N 2 0 246.345 2.352 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+]C[C@](C)(CC)OC)C1 ZINC000638408449 352215061 /nfs/dbraw/zinc/21/50/61/352215061.db2.gz BBOPGDHXXBXYLV-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@H]([NH2+]CCC1=CC[NH2+]CC1)c1ccoc1 ZINC000564560175 363127848 /nfs/dbraw/zinc/12/78/48/363127848.db2.gz OUIPYFIPCDPAGB-NSHDSACASA-N 2 0 220.316 2.240 20 0 BEADRP CCc1cccc(F)c1C[NH2+]CCCC[NH3+] ZINC000414915310 352261856 /nfs/dbraw/zinc/26/18/56/352261856.db2.gz YZOAFSDTCVBGBN-UHFFFAOYSA-N 2 0 224.323 2.217 20 0 BEADRP C[NH+](C)CCCC[NH2+]Cc1nc2ccccc2o1 ZINC000638451840 352262243 /nfs/dbraw/zinc/26/22/43/352262243.db2.gz RWFIGPWZWOVZSV-UHFFFAOYSA-N 2 0 247.342 2.259 20 0 BEADRP CO[C@H](C[NH2+]CCCC[NH+](C)C)C1CCCC1 ZINC000638452442 352262836 /nfs/dbraw/zinc/26/28/36/352262836.db2.gz ZOFWVWVIZUCDJS-CQSZACIVSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@@H]1C[N@H+](Cc2cccc3c2CCC3)C[C@@H]1C[NH3+] ZINC000630074878 363158771 /nfs/dbraw/zinc/15/87/71/363158771.db2.gz BWSIEDPMSRPRGH-DOMZBBRYSA-N 2 0 244.382 2.202 20 0 BEADRP C[C@@H]1CCC[C@H]1[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000414918232 352272934 /nfs/dbraw/zinc/27/29/34/352272934.db2.gz TWEWCEVDACGCRO-UPJWGTAASA-N 2 0 210.365 2.154 20 0 BEADRP CCc1ccc(C[NH2+][C@@H]2CC[NH2+][C@@H](C)C2)cc1 ZINC000414944572 352366901 /nfs/dbraw/zinc/36/69/01/352366901.db2.gz HATYUZJYSSWCJI-SWLSCSKDSA-N 2 0 232.371 2.479 20 0 BEADRP C[C@@H]([NH2+]CCC1CC[NH+](C)CC1)[C@H]1CC1(F)F ZINC000638567349 352390953 /nfs/dbraw/zinc/39/09/53/352390953.db2.gz ZKTLCWNZVIMRFY-ZYHUDNBSSA-N 2 0 246.345 2.352 20 0 BEADRP CC1CCC([NH2+][C@H]2CCC[C@H]([NH3+])C2)CC1 ZINC000086401862 538104110 /nfs/dbraw/zinc/10/41/10/538104110.db2.gz GUBGSODFOXBQMU-MVKMKZAISA-N 2 0 210.365 2.425 20 0 BEADRP [NH3+]CCC[NH2+][C@@H]1CCc2c1cccc2Cl ZINC000415087834 352567159 /nfs/dbraw/zinc/56/71/59/352567159.db2.gz VENZPMCCVQXOIH-GFCCVEGCSA-N 2 0 224.735 2.266 20 0 BEADRP COC1([C@@H](C)[NH2+]CC[C@@H]2CCC[N@@H+]2C)CCC1 ZINC000412026405 191240171 /nfs/dbraw/zinc/24/01/71/191240171.db2.gz SFFFXFRNNJKUTF-OLZOCXBDSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@H](F)CC[N@@H+]1CC[C@@]2(C1)CCC[NH+](C)C2 ZINC000334219519 352821414 /nfs/dbraw/zinc/82/14/14/352821414.db2.gz FUJHWHWWFBNTFR-STQMWFEESA-N 2 0 228.355 2.152 20 0 BEADRP C[C@@H](F)CC[N@@H+]1CC[C@]2(C1)CCC[NH+](C)C2 ZINC000334219505 352821446 /nfs/dbraw/zinc/82/14/46/352821446.db2.gz FUJHWHWWFBNTFR-CHWSQXEVSA-N 2 0 228.355 2.152 20 0 BEADRP Cc1ncc(C[NH2+]CCC[C@@H]2CCC[NH2+]2)s1 ZINC000336698879 187907863 /nfs/dbraw/zinc/90/78/63/187907863.db2.gz ZOHSUSFSOSCEAK-LLVKDONJSA-N 2 0 239.388 2.073 20 0 BEADRP CCO[C@H](CC[NH2+][C@H]1CCC[C@@H]1C[NH3+])C(C)C ZINC000422811898 192476192 /nfs/dbraw/zinc/47/61/92/192476192.db2.gz PUSGYKYYWDHIEF-HZSPNIEDSA-N 2 0 242.407 2.155 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H](C)[C@@H]1CC1(F)F ZINC000638862733 353031989 /nfs/dbraw/zinc/03/19/89/353031989.db2.gz HSCWFGOFJVEEPL-QWRGUYRKSA-N 2 0 234.334 2.352 20 0 BEADRP CCCC[C@@H](COC)[NH2+][C@H](C)CC[NH+](C)C ZINC000336750764 353037040 /nfs/dbraw/zinc/03/70/40/353037040.db2.gz ZTMUYBPZFWTGPW-OLZOCXBDSA-N 2 0 230.396 2.121 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@H](C)[C@]1(C)CCCO1 ZINC000340469491 188038435 /nfs/dbraw/zinc/03/84/35/188038435.db2.gz KEFWBJLGRACTON-KGLIPLIRSA-N 2 0 242.407 2.264 20 0 BEADRP C(C[NH+]1C[C@@H]2CCC[C@H]2C1)[C@@H]1CCC[NH2+]C1 ZINC000162729029 188048311 /nfs/dbraw/zinc/04/83/11/188048311.db2.gz DNFGVZUXGHICIJ-IHRRRGAJSA-N 2 0 222.376 2.108 20 0 BEADRP C([NH2+]C1CC[NH+](CC2CCC2)CC1)C1CC1 ZINC000133230427 188049637 /nfs/dbraw/zinc/04/96/37/188049637.db2.gz XHIZZAPIENMKDY-UHFFFAOYSA-N 2 0 222.376 2.251 20 0 BEADRP CCOc1ccc([C@H](C)[NH2+]CCCC[NH3+])cc1 ZINC000037714910 358476290 /nfs/dbraw/zinc/47/62/90/358476290.db2.gz ORKCRXAPHWDDII-LBPRGKRZSA-N 2 0 236.359 2.475 20 0 BEADRP COc1ccc([C@@H](C)[NH2+]CCCC[NH3+])cc1F ZINC000037715114 358476585 /nfs/dbraw/zinc/47/65/85/358476585.db2.gz MDQXQAMJOGBGFY-SNVBAGLBSA-N 2 0 240.322 2.224 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]CCC2CC2)CC1 ZINC000083893520 538112262 /nfs/dbraw/zinc/11/22/62/538112262.db2.gz YVZRBGCKNDXOCF-UHFFFAOYSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H]1C[N@H+](C[C@@H]2CCCC[C@@H]2C)CC[C@H]1[NH3+] ZINC000252097548 353295960 /nfs/dbraw/zinc/29/59/60/353295960.db2.gz FSQXNGIFBWULKA-RFQIPJPRSA-N 2 0 224.392 2.482 20 0 BEADRP C([C@H]1CC[N@@H+](C2CCCC2)C1)[NH+]1CCCC1 ZINC000120101918 188247622 /nfs/dbraw/zinc/24/76/22/188247622.db2.gz KJAHEQMMGPZNKL-CYBMUJFWSA-N 2 0 222.376 2.347 20 0 BEADRP Cc1ccc(F)c(CNC[C@@H](C)C[NH+](C)C)c1 ZINC000291706214 188268253 /nfs/dbraw/zinc/26/82/53/188268253.db2.gz KULDLDVSQFMBRG-GFCCVEGCSA-N 2 0 238.350 2.421 20 0 BEADRP Cc1ccc(C[NH2+]CCCC[NH+](C)C)cc1 ZINC000045598380 188297692 /nfs/dbraw/zinc/29/76/92/188297692.db2.gz MZHSLUNYEUVKHA-UHFFFAOYSA-N 2 0 220.360 2.426 20 0 BEADRP F[C@H]1CC[C@H]([NH2+]Cc2cccc3nccn32)C1 ZINC000334502593 353342392 /nfs/dbraw/zinc/34/23/92/353342392.db2.gz FIFADGXPSAVRSQ-QWRGUYRKSA-N 2 0 233.290 2.315 20 0 BEADRP CC(C)C[C@@H](C[NH2+][C@@H](C)CCCC[NH3+])N(C)C ZINC000310552184 188348289 /nfs/dbraw/zinc/34/82/89/188348289.db2.gz UWEGRDTXLQQMRJ-KBPBESRZSA-N 2 0 243.439 2.070 20 0 BEADRP CC(C)N(CC[NH2+][C@H](C)CCCC[NH3+])C(C)C ZINC000310570355 188348686 /nfs/dbraw/zinc/34/86/86/188348686.db2.gz ZACSFPPAIFLYMF-CQSZACIVSA-N 2 0 243.439 2.212 20 0 BEADRP CC(C)C[C@H](C)C[N@@H+]1CC[C@@H]([NH3+])[C@@H](C)C1 ZINC000300831787 188348783 /nfs/dbraw/zinc/34/87/83/188348783.db2.gz CCWIQMWOKXTLTP-RWMBFGLXSA-N 2 0 212.381 2.338 20 0 BEADRP C[N@@H+]1CC[C@@]2(CCN(Cc3cccc(F)c3)C2)C1 ZINC000292111848 188390059 /nfs/dbraw/zinc/39/00/59/188390059.db2.gz JBUMEXQPAIVMFW-OAHLLOKOSA-N 2 0 248.345 2.353 20 0 BEADRP Cc1ccsc1C[N@@H+]1CC[C@@H]([NH3+])[C@@H](C)C1 ZINC000227057957 363226582 /nfs/dbraw/zinc/22/65/82/363226582.db2.gz SNXWKUQNDKWVLI-WDEREUQCSA-N 2 0 224.373 2.226 20 0 BEADRP CCC[C@@H](C[N@@H+]1CCC[C@H]([NH+](C)C)CC1)OC ZINC000639106237 353613024 /nfs/dbraw/zinc/61/30/24/353613024.db2.gz XLRLXKYMIRCJJE-KBPBESRZSA-N 2 0 242.407 2.218 20 0 BEADRP C[NH+](C)C[C@@H]1CC[N@H+](CCC2CCCC2)C1 ZINC000119998478 353693748 /nfs/dbraw/zinc/69/37/48/353693748.db2.gz ZILAIUPRSQHDGA-AWEZNQCLSA-N 2 0 224.392 2.450 20 0 BEADRP CC(C)[N@H+](CC1CCC1)C[C@@H]1CCC[NH2+]C1 ZINC000232661933 353752723 /nfs/dbraw/zinc/75/27/23/353752723.db2.gz OMQLHSAKNZTGKO-CQSZACIVSA-N 2 0 224.392 2.497 20 0 BEADRP CC[N@@H+](Cc1ccccn1)C[C@@H]1CC[NH2+][C@@H](C)C1 ZINC000233481430 353822927 /nfs/dbraw/zinc/82/29/27/353822927.db2.gz BTXUGWRIYUOHEO-UONOGXRCSA-N 2 0 247.386 2.292 20 0 BEADRP C[NH+](C)CCC[N@H+](C)CC1CCSCC1 ZINC000639168411 354073389 /nfs/dbraw/zinc/07/33/89/354073389.db2.gz SZEWHKMDLKRBOK-UHFFFAOYSA-N 2 0 230.421 2.013 20 0 BEADRP C[C@H]1CCC[C@@H]1C[NH2+]C1CCC([NH3+])CC1 ZINC000230665016 363318614 /nfs/dbraw/zinc/31/86/14/363318614.db2.gz HMAWWJWDYAUJLC-ZFDZMSFRSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]1CCC[C@H]1C[NH2+]C1CCC([NH3+])CC1 ZINC000230665024 363318916 /nfs/dbraw/zinc/31/89/16/363318916.db2.gz HMAWWJWDYAUJLC-ZSVAQUKISA-N 2 0 210.365 2.282 20 0 BEADRP COCCCCC[NH+]1CCC(C[NH+](C)C)CC1 ZINC000344203107 354162890 /nfs/dbraw/zinc/16/28/90/354162890.db2.gz VHGDJQGQYUTKTK-UHFFFAOYSA-N 2 0 242.407 2.077 20 0 BEADRP CCC(CC)C[N@H+](C)[C@H]1CCC[NH2+]CC1 ZINC000231465342 363344736 /nfs/dbraw/zinc/34/47/36/363344736.db2.gz JZEIDQMRWCVKAX-ZDUSSCGKSA-N 2 0 212.381 2.497 20 0 BEADRP CC[N@H+](CC1CCC1)[C@@H]1CCC[NH2+]CC1 ZINC000231671187 363347615 /nfs/dbraw/zinc/34/76/15/363347615.db2.gz QBLDSCHIDPKRGB-CYBMUJFWSA-N 2 0 210.365 2.251 20 0 BEADRP CSc1ccccc1CN1CCC[C@@H]([NH3+])C1 ZINC000334585405 354208733 /nfs/dbraw/zinc/20/87/33/354208733.db2.gz FZOWOOWGDLRKMH-GFCCVEGCSA-N 2 0 236.384 2.332 20 0 BEADRP CC(C)(C)CC[NH+]1CCC2(CC[NH2+]2)CC1 ZINC000334588817 354216163 /nfs/dbraw/zinc/21/61/63/354216163.db2.gz YRPCNHCTQCKPTH-UHFFFAOYSA-N 2 0 210.365 2.251 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)C[C@@](C)(CC)OC ZINC000639176300 354220913 /nfs/dbraw/zinc/22/09/13/354220913.db2.gz UOSYXYNOGNSUMA-CYBMUJFWSA-N 2 0 230.396 2.075 20 0 BEADRP CC1CC([NH2+]Cc2ccc3c[nH+]cn3c2)C1 ZINC000334597985 354232829 /nfs/dbraw/zinc/23/28/29/354232829.db2.gz PYWBYFSNAKYUGO-UHFFFAOYSA-N 2 0 215.300 2.222 20 0 BEADRP CC1CCC([NH2+][C@@H]2CCCC[C@H]2[NH3+])CC1 ZINC000334617291 354304844 /nfs/dbraw/zinc/30/48/44/354304844.db2.gz XDBJXBGGIAHESA-FIYWTHMPSA-N 2 0 210.365 2.425 20 0 BEADRP CC(C)[C@@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)C1CC1 ZINC000578005413 366173680 /nfs/dbraw/zinc/17/36/80/366173680.db2.gz DUYXZDFYDUKSKO-RRFJBIMHSA-N 2 0 236.403 2.399 20 0 BEADRP CC(C)[C@@H]1C[N@H+](CC2CC[NH2+]CC2)CCS1 ZINC000178976774 535262446 /nfs/dbraw/zinc/26/24/46/535262446.db2.gz SBEWUECYWXQECV-ZDUSSCGKSA-N 2 0 242.432 2.059 20 0 BEADRP CC(C)C1CC([NH2+][C@@H](C)CC[NH+](C)C)C1 ZINC000232564549 363375012 /nfs/dbraw/zinc/37/50/12/363375012.db2.gz CFDUVIFJZPGDNI-HIFPTAJRSA-N 2 0 212.381 2.351 20 0 BEADRP CC(C)C1CC([NH2+][C@H](C)CC[NH+](C)C)C1 ZINC000232565754 363376849 /nfs/dbraw/zinc/37/68/49/363376849.db2.gz CFDUVIFJZPGDNI-PNESKVBLSA-N 2 0 212.381 2.351 20 0 BEADRP [NH3+]C1CCC([NH2+][C@@H]2CC[C@H]2C2CCC2)CC1 ZINC000335135464 354784495 /nfs/dbraw/zinc/78/44/95/354784495.db2.gz HFRJLNZWFPDHEQ-CLRIEMFWSA-N 2 0 222.376 2.425 20 0 BEADRP CC[N@H+](CC1CC1)C[C@@H]1CC[NH2+][C@@H](C)C1 ZINC000233456681 363402388 /nfs/dbraw/zinc/40/23/88/363402388.db2.gz QEDHLTREQHCBGO-WCQYABFASA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)([NH3+])C[NH2+]C1CCC2(CCOCC2)CC1 ZINC000335178686 354964787 /nfs/dbraw/zinc/96/47/87/354964787.db2.gz OEDMIZIGBNDDMU-UHFFFAOYSA-N 2 0 240.391 2.053 20 0 BEADRP C[C@H]1C[C@@H]1C[N@@H+]1CCCC12CC[NH+](C)CC2 ZINC000335204527 355039648 /nfs/dbraw/zinc/03/96/48/355039648.db2.gz NZPLRDGYJWCREB-QWHCGFSZSA-N 2 0 222.376 2.203 20 0 BEADRP CC(C[NH+]1CC[C@@H](C)C1)C[N@@H+]1CC[C@@H](C)C1 ZINC000346638025 355015302 /nfs/dbraw/zinc/01/53/02/355015302.db2.gz GKFVRKBZCKOGFZ-CHWSQXEVSA-N 2 0 224.392 2.306 20 0 BEADRP C[C@H]([NH3+])CN1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000335229452 355071469 /nfs/dbraw/zinc/07/14/69/355071469.db2.gz FGOHWTAKSAVABB-CMPLNLGQSA-N 2 0 238.762 2.477 20 0 BEADRP CC1(C)CCC([NH2+][C@H]2CCC[C@H]2[NH3+])CC1 ZINC000335217482 355056563 /nfs/dbraw/zinc/05/65/63/355056563.db2.gz OLDKXGFMORTJIS-NEPJUHHUSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCc2c1cccc2F)C1C[NH2+]C1 ZINC000335257372 355193887 /nfs/dbraw/zinc/19/38/87/355193887.db2.gz GDJJQVROGOYNKV-YMTOWFKASA-N 2 0 234.318 2.011 20 0 BEADRP CCC[C@@H]1CCC[N@H+](C[C@@H]2CCC[NH2+]C2)C1 ZINC000346997597 355196115 /nfs/dbraw/zinc/19/61/15/355196115.db2.gz XMERJWBPIGIDBO-ZIAGYGMSSA-N 2 0 224.392 2.498 20 0 BEADRP CCCCC[C@H](C)[NH2+]CCC[NH+](C)C ZINC000020091847 168743008 /nfs/dbraw/zinc/74/30/08/168743008.db2.gz HEEVISSHZYGBHY-LBPRGKRZSA-N 2 0 200.370 2.497 20 0 BEADRP Cc1cc(NCCCC[N@@H+](C)C2CC2)cc[nH+]1 ZINC000413349693 191373714 /nfs/dbraw/zinc/37/37/14/191373714.db2.gz SYWBWPHJRBTARD-UHFFFAOYSA-N 2 0 233.359 2.098 20 0 BEADRP CCC[C@@H](C[NH2+]CC[C@@H]1CCC[N@H+](C)C1)OC ZINC000639256574 355299496 /nfs/dbraw/zinc/29/94/96/355299496.db2.gz CQUBRVKMGDWTJC-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP CCC[C@@H](C[NH2+]CC[C@H]1CCC[N@H+](C)C1)OC ZINC000639256575 355299587 /nfs/dbraw/zinc/29/95/87/355299587.db2.gz CQUBRVKMGDWTJC-KGLIPLIRSA-N 2 0 242.407 2.123 20 0 BEADRP CCC[C@H](C[NH2+]CC[C@@H]1CCC[N@H+](C)C1)OC ZINC000639256576 355299708 /nfs/dbraw/zinc/29/97/08/355299708.db2.gz CQUBRVKMGDWTJC-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)[N@H+](CC[C@H]1CC[NH2+]C1)CC1CC1 ZINC000084385420 355360807 /nfs/dbraw/zinc/36/08/07/355360807.db2.gz DHNPASAMMKHCKC-GFCCVEGCSA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)=CC[N@H+]1CCC[C@H]([NH+](C)C)CC1 ZINC000335992350 134040756 /nfs/dbraw/zinc/04/07/56/134040756.db2.gz QUERXQZJXJSUCN-ZDUSSCGKSA-N 2 0 210.365 2.369 20 0 BEADRP C[C@H]([NH3+])c1ccc(NC[C@]2(C)CC[NH2+]C2)cc1 ZINC000414800396 191573062 /nfs/dbraw/zinc/57/30/62/191573062.db2.gz HXMGNEOCJSXJLT-SMDDNHRTSA-N 2 0 233.359 2.118 20 0 BEADRP CC[C@@H](COC)[NH2+]Cc1ccc([C@H](C)[NH3+])cc1 ZINC000414805271 191576084 /nfs/dbraw/zinc/57/60/84/191576084.db2.gz AJTSWJSDAQYHKH-FZMZJTMJSA-N 2 0 236.359 2.221 20 0 BEADRP CC[C@@](C)(C[NH2+]CCC[N@H+](C)CC(C)C)OC ZINC000639290822 355464711 /nfs/dbraw/zinc/46/47/11/355464711.db2.gz WBBZCOCQHQHKPL-AWEZNQCLSA-N 2 0 244.423 2.369 20 0 BEADRP CC[C@](C)(C[NH2+]CCC[N@H+](C)CC(C)C)OC ZINC000639290823 355465098 /nfs/dbraw/zinc/46/50/98/355465098.db2.gz WBBZCOCQHQHKPL-CQSZACIVSA-N 2 0 244.423 2.369 20 0 BEADRP CC1(C)CC[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000414825658 191587560 /nfs/dbraw/zinc/58/75/60/191587560.db2.gz HKCZJSXGXLCLLI-FXJUQPSGSA-N 2 0 222.376 2.438 20 0 BEADRP C[C@H](C[NH2+]CC[C@H]1CC[NH2+]C1)Cc1ccccc1 ZINC000414832255 191592004 /nfs/dbraw/zinc/59/20/04/191592004.db2.gz OGFPOXAUPOMCSF-HOCLYGCPSA-N 2 0 246.398 2.454 20 0 BEADRP Cc1cc(F)ccc1C[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000414834007 191594747 /nfs/dbraw/zinc/59/47/47/191594747.db2.gz SFEMWOOTLKNNCB-GFCCVEGCSA-N 2 0 236.334 2.223 20 0 BEADRP COc1ccc(C[NH2+]C[C@@H]2CCC[C@H]([NH3+])C2)cc1 ZINC000415003465 191646878 /nfs/dbraw/zinc/64/68/78/191646878.db2.gz XFQNXUBNXKMAGO-KGLIPLIRSA-N 2 0 248.370 2.302 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CC[C@H](C[NH3+])C1 ZINC000415051893 191654239 /nfs/dbraw/zinc/65/42/39/191654239.db2.gz ZZAXNKSEWHZXJU-VOAKCMCISA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+]CCCC[NH2+]Cc1cc(F)cc2cccnc21 ZINC000414897475 191618939 /nfs/dbraw/zinc/61/89/39/191618939.db2.gz BUCHYYKXGMRRFF-UHFFFAOYSA-N 2 0 247.317 2.202 20 0 BEADRP Cc1ccccc1C[C@H](C)[NH2+]CCCC[NH3+] ZINC000414896829 191619575 /nfs/dbraw/zinc/61/95/75/191619575.db2.gz AGUIFKGBVYOXGQ-ZDUSSCGKSA-N 2 0 220.360 2.255 20 0 BEADRP [NH3+]CCCC[NH2+]C/C=C\c1ccc(F)cc1F ZINC000414912964 191622695 /nfs/dbraw/zinc/62/26/95/191622695.db2.gz VKLDAIIXDWUAHU-ARJAWSKDSA-N 2 0 240.297 2.307 20 0 BEADRP CC(C)(C)CC[NH2+]CC1(C)CC[NH2+]CC1 ZINC000414913836 191622836 /nfs/dbraw/zinc/62/28/36/191622836.db2.gz XAOUQGLPQOWVRR-UHFFFAOYSA-N 2 0 212.381 2.402 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@@H]1CC[C@H](C)[C@H](C)C1 ZINC000414966320 191635357 /nfs/dbraw/zinc/63/53/57/191635357.db2.gz WIEMTSDYAROIND-UMSGYPCISA-N 2 0 212.381 2.399 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CCC[C@H]([NH3+])C1 ZINC000414992012 191642323 /nfs/dbraw/zinc/64/23/23/191642323.db2.gz BKWGMWAGESETEC-NDBYEHHHSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1C[C@H](C[NH2+][C@]2(C)CC=CCC2)CC[NH2+]1 ZINC000415103047 191681615 /nfs/dbraw/zinc/68/16/15/191681615.db2.gz BVFPMLPXDLSXAA-MGPQQGTHSA-N 2 0 222.376 2.463 20 0 BEADRP Cc1cc(NC2CC([NH+]3CCCCC3)C2)cc[nH+]1 ZINC000335857099 355602423 /nfs/dbraw/zinc/60/24/23/355602423.db2.gz LUEOETCEYVIMDV-UHFFFAOYSA-N 2 0 245.370 2.241 20 0 BEADRP Cc1cc(F)ccc1C[NH2+][C@H]1CC[C@@H](C[NH3+])C1 ZINC000415043421 191661486 /nfs/dbraw/zinc/66/14/86/191661486.db2.gz RWSJNCUWCPSYSA-RISCZKNCSA-N 2 0 236.334 2.351 20 0 BEADRP Cc1cccc(C)c1CC[NH2+]CC1CC[NH2+]CC1 ZINC000415078644 191672102 /nfs/dbraw/zinc/67/21/02/191672102.db2.gz GPKSNIWMQBTZLL-UHFFFAOYSA-N 2 0 246.398 2.435 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCN1C(C)(C)C)[C@@H]1CC1(F)F ZINC000639302788 355649915 /nfs/dbraw/zinc/64/99/15/355649915.db2.gz ITPPYNBYSDEHCR-DCAQKATOSA-N 2 0 246.345 2.493 20 0 BEADRP CCCN1CC[C@H]([NH2+]C[C@H](CC(C)C)OC)C1 ZINC000639330335 355747111 /nfs/dbraw/zinc/74/71/11/355747111.db2.gz NZGNPZHIDAMDSF-KBPBESRZSA-N 2 0 242.407 2.121 20 0 BEADRP CS[C@H]1CC[C@@H]1[NH2+]CCCC[N@H+](C)C1CC1 ZINC000425340276 191812644 /nfs/dbraw/zinc/81/26/44/191812644.db2.gz ADDNZANJGNKEFR-STQMWFEESA-N 2 0 242.432 2.344 20 0 BEADRP CC[C@@](C)(C[NH2+]C[C@@H]1CCCC[N@H+](C)C1)OC ZINC000639345771 355792020 /nfs/dbraw/zinc/79/20/20/355792020.db2.gz ACOBQQIGVLEMGR-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP COC[C@@H](C)[NH+]1CCC(C[N@H+](C)C(C)C)CC1 ZINC000608494917 355820289 /nfs/dbraw/zinc/82/02/89/355820289.db2.gz LXSKKLBSEFKDAW-CYBMUJFWSA-N 2 0 242.407 2.074 20 0 BEADRP CCC1([NH+](C)C)CC[NH+](C[C@@H](C)COC)CC1 ZINC000639378558 355912614 /nfs/dbraw/zinc/91/26/14/355912614.db2.gz IHUXBOLYKKLTIB-CYBMUJFWSA-N 2 0 242.407 2.075 20 0 BEADRP C[C@H]1C[C@@H]([N@H+](C)CC2(C)CC2)CCN1C ZINC000582217392 355938086 /nfs/dbraw/zinc/93/80/86/355938086.db2.gz WTOBODGJVIAACU-RYUDHWBXSA-N 2 0 210.365 2.201 20 0 BEADRP Cc1cccc2c1CC[C@@H]2[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000583625048 355893468 /nfs/dbraw/zinc/89/34/68/355893468.db2.gz AHPUFHWMKFOAFA-NHYWBVRUSA-N 2 0 230.355 2.180 20 0 BEADRP C[C@H]1C[N@H+](CC[C@H]2CCCC[NH+]2C)C[C@H]1C ZINC000351439995 355991888 /nfs/dbraw/zinc/99/18/88/355991888.db2.gz ZXBXCPQIAUTYLW-HZSPNIEDSA-N 2 0 224.392 2.449 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]CCCC2CCOCC2)C1 ZINC000582228974 355991985 /nfs/dbraw/zinc/99/19/85/355991985.db2.gz GKVSWVXCHYJPNZ-UONOGXRCSA-N 2 0 240.391 2.053 20 0 BEADRP CCC(C)(C)CC[N@@H+]1C[C@@H]2CC[C@@H]([NH3+])[C@H]2C1 ZINC000351494624 356001700 /nfs/dbraw/zinc/00/17/00/356001700.db2.gz OLTYAYQOPFGGGH-RWMBFGLXSA-N 2 0 224.392 2.482 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCCCO1)[C@H]1CCCC[NH2+]1 ZINC000385958786 355942541 /nfs/dbraw/zinc/94/25/41/355942541.db2.gz DZGDQUWOSNSQHS-BFHYXJOUSA-N 2 0 240.391 2.066 20 0 BEADRP C[C@@H]1C[C@H](C[NH3+])CN1c1cc[nH+]c2ccccc21 ZINC000216234697 355951781 /nfs/dbraw/zinc/95/17/81/355951781.db2.gz UCJQQOSKTCHTGQ-VXGBXAGGSA-N 2 0 241.338 2.408 20 0 BEADRP Cc1ccc(CC[N@@H+]2CC[C@@H]3[NH2+]CC[C@H]3C2)cc1 ZINC000335906398 356105803 /nfs/dbraw/zinc/10/58/03/356105803.db2.gz DDUNNXGGHUFYTG-HOTGVXAUSA-N 2 0 244.382 2.221 20 0 BEADRP Cc1nc([C@@H](C)[NH2+][C@H](C)CCC[NH3+])cs1 ZINC000422883431 192497644 /nfs/dbraw/zinc/49/76/44/192497644.db2.gz BZNHQZSFVBYZER-RKDXNWHRSA-N 2 0 227.377 2.230 20 0 BEADRP CCC[C@@H]1CCC[N@H+](CC[C@H]2CC[NH2+]C2)C1 ZINC000420297083 192204626 /nfs/dbraw/zinc/20/46/26/192204626.db2.gz FINZSZGNUHZINE-ZIAGYGMSSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H](c1cccc(O)c1)[N@H+](C)CC[C@@H]1CC[NH2+]C1 ZINC000420296026 192204860 /nfs/dbraw/zinc/20/48/60/192204860.db2.gz CVTSRNJMUXOYCM-STQMWFEESA-N 2 0 248.370 2.385 20 0 BEADRP [NH3+]CCC[NH2+][C@H](c1ccccc1)C1CCC1 ZINC000420297925 192205422 /nfs/dbraw/zinc/20/54/22/192205422.db2.gz GPRLUNGIMPKXHF-CQSZACIVSA-N 2 0 218.344 2.466 20 0 BEADRP CCC[C@H]1CCC[N@H+](CC[C@H]2CC[NH2+]C2)C1 ZINC000420297080 192205524 /nfs/dbraw/zinc/20/55/24/192205524.db2.gz FINZSZGNUHZINE-KGLIPLIRSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@H]([NH3+])C1CC[NH+](CC[C@@H]2CCCCO2)CC1 ZINC000420281925 192200531 /nfs/dbraw/zinc/20/05/31/192200531.db2.gz ATUNEAKVPDPYFF-JSGCOSHPSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CCCN(Cc2ncc(C3CC3)o2)C1 ZINC000420290928 192201009 /nfs/dbraw/zinc/20/10/09/192201009.db2.gz MQCWOTXBMMLLEV-CMPLNLGQSA-N 2 0 249.358 2.111 20 0 BEADRP CC[N@H+](CC[C@@H]1CCC[NH2+]C1)C1CCC1 ZINC000420302528 192206678 /nfs/dbraw/zinc/20/66/78/192206678.db2.gz MLKUEKFPEDKORV-LBPRGKRZSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@H]1CCCC[C@H]1OCC[N@H+](C)C1CC([NH3+])C1 ZINC000420331889 192213710 /nfs/dbraw/zinc/21/37/10/192213710.db2.gz MSHPCCSPRHOZGO-GFJIZPEISA-N 2 0 240.391 2.003 20 0 BEADRP CSc1ccccc1CN(C)C1CC([NH3+])C1 ZINC000420330046 192214470 /nfs/dbraw/zinc/21/44/70/192214470.db2.gz LDLRXIGZHBJMJK-UHFFFAOYSA-N 2 0 236.384 2.330 20 0 BEADRP CC[C@H](C)[N@@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1 ZINC000420330942 192214851 /nfs/dbraw/zinc/21/48/51/192214851.db2.gz QIJUWGRVSDWWHN-XQQFMLRXSA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@H](C)[N@@H+]1CCC[C@@H]([C@@H]2CC[NH2+]C2)C1 ZINC000420330944 192215256 /nfs/dbraw/zinc/21/52/56/192215256.db2.gz QIJUWGRVSDWWHN-YNEHKIRRSA-N 2 0 210.365 2.106 20 0 BEADRP C[N@H+](CC[C@H]1CC[NH2+]C1)C1Cc2ccccc2C1 ZINC000420303521 192207696 /nfs/dbraw/zinc/20/76/96/192207696.db2.gz KMZDCWKHADVWBW-CYBMUJFWSA-N 2 0 244.382 2.085 20 0 BEADRP Cc1cnc([C@@H](C)[N@@H+]2CCC[C@H](CC[NH3+])C2)o1 ZINC000420305473 192208698 /nfs/dbraw/zinc/20/86/98/192208698.db2.gz GKKKDZFDJFZYOU-VXGBXAGGSA-N 2 0 237.347 2.105 20 0 BEADRP FCCCCC[NH+]1CCC([C@@H]2CC[NH2+]C2)CC1 ZINC000420307758 192208733 /nfs/dbraw/zinc/20/87/33/192208733.db2.gz CHUNAGLCUQZKBB-CQSZACIVSA-N 2 0 242.382 2.448 20 0 BEADRP COc1ccc([C@@H](C[NH3+])C[N@@H+]2CCC[C@@H]2C)cc1 ZINC000420306611 192209645 /nfs/dbraw/zinc/20/96/45/192209645.db2.gz QNBBTOONRRNWPM-JSGCOSHPSA-N 2 0 248.370 2.222 20 0 BEADRP Cc1csc([C@@H]2CCCCN2CCC[NH3+])n1 ZINC000420308642 192211262 /nfs/dbraw/zinc/21/12/62/192211262.db2.gz DEJOEJWIPFWYCL-NSHDSACASA-N 2 0 239.388 2.327 20 0 BEADRP C[C@@H]([NH3+])[C@H]1CC[N@H+](CCCc2ccsc2)C1 ZINC000420317254 192211984 /nfs/dbraw/zinc/21/19/84/192211984.db2.gz ZDCHSSBBTFFCLY-YPMHNXCESA-N 2 0 238.400 2.350 20 0 BEADRP CCc1cccc(C[N@@H+]2CC[C@H]3[NH2+]CC[C@@H]3C2)c1 ZINC000420313978 192212237 /nfs/dbraw/zinc/21/22/37/192212237.db2.gz KODAWDBFNKVBBB-HZPDHXFCSA-N 2 0 244.382 2.433 20 0 BEADRP C[C@@H]1CC[C@@H](C)[NH+]1CC[C@@H]1CCC[NH2+]C1 ZINC000420314665 192212344 /nfs/dbraw/zinc/21/23/44/192212344.db2.gz ZHGJZCFFVSXCDW-UPJWGTAASA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H]1CC[C@H](C)[N@H+]1CC[C@H]1CCC[NH2+]C1 ZINC000420314661 192212351 /nfs/dbraw/zinc/21/23/51/192212351.db2.gz ZHGJZCFFVSXCDW-FRRDWIJNSA-N 2 0 210.365 2.249 20 0 BEADRP CC[C@]1(C)CCC[N@H+](CC[C@H]2CC[NH2+]C2)C1 ZINC000420313592 192212472 /nfs/dbraw/zinc/21/24/72/192212472.db2.gz YDEUDSHVFBQQLP-ZIAGYGMSSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@H]([NH3+])[C@H]1CC[N@H+](CCCc2ccsc2)C1 ZINC000420317250 192212637 /nfs/dbraw/zinc/21/26/37/192212637.db2.gz ZDCHSSBBTFFCLY-AAEUAGOBSA-N 2 0 238.400 2.350 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@@H](CC[NH3+])C2)c(C)n1 ZINC000420314241 192212871 /nfs/dbraw/zinc/21/28/71/192212871.db2.gz QKPFAOIPDDRRJR-AWEZNQCLSA-N 2 0 247.386 2.259 20 0 BEADRP CC[C@@H]([NH2+]CCC[NH2+]C)c1ccc(OC)cc1 ZINC000420367099 192225776 /nfs/dbraw/zinc/22/57/76/192225776.db2.gz GQNNEHDMFWSHCV-CQSZACIVSA-N 2 0 236.359 2.345 20 0 BEADRP CC[C@H]([NH2+]C[C@H]1CC[NH2+]C1)c1ccc(OC)cc1 ZINC000420366610 192225931 /nfs/dbraw/zinc/22/59/31/192225931.db2.gz GFZSNGSPCJDSDR-WFASDCNBSA-N 2 0 248.370 2.345 20 0 BEADRP Cc1cc([C@@H]2CCC[N@@H+]2CC[C@H]2CC[NH2+]C2)on1 ZINC000420326821 192229964 /nfs/dbraw/zinc/22/99/64/192229964.db2.gz XVHBZAZAYFFEOZ-OLZOCXBDSA-N 2 0 249.358 2.120 20 0 BEADRP C[C@@H]1CCCC[N@H+](CC[C@@H]2CCC[NH2+]C2)C1 ZINC000420364049 192224410 /nfs/dbraw/zinc/22/44/10/192224410.db2.gz CLTBCXGPIAAXRB-KGLIPLIRSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CCC[NH2+]C1)c1cccnc1 ZINC000420379291 192234155 /nfs/dbraw/zinc/23/41/55/192234155.db2.gz VAKWARVCVAYKRB-CHWSQXEVSA-N 2 0 233.359 2.122 20 0 BEADRP CC[C@H](C)[NH+]1CCC([C@H]2C[C@H]([NH3+])CCO2)CC1 ZINC000420389460 192234457 /nfs/dbraw/zinc/23/44/57/192234457.db2.gz MCQKOGSXPHOJJT-IACUBPJLSA-N 2 0 240.391 2.003 20 0 BEADRP CC[C@@H](C)N1C[C@@H](c2cccc(F)c2)[C@H]([NH3+])C1 ZINC000420384825 192234593 /nfs/dbraw/zinc/23/45/93/192234593.db2.gz GVUMSQLERQPEHL-DDTOSNHZSA-N 2 0 236.334 2.351 20 0 BEADRP C[NH2+]CCC[N@H+](C)CCCc1ccccc1C ZINC000420391364 192236025 /nfs/dbraw/zinc/23/60/25/192236025.db2.gz SEAMBKGUIIORJD-UHFFFAOYSA-N 2 0 234.387 2.469 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1CCCC[C@@H]1C(C)C ZINC000420395539 192236633 /nfs/dbraw/zinc/23/66/33/192236633.db2.gz DMSQANOYWNOLPB-CHWSQXEVSA-N 2 0 212.381 2.400 20 0 BEADRP C[NH2+]CCC[N@H+](C)[C@H]1CCc2ccc(F)cc21 ZINC000420392605 192236746 /nfs/dbraw/zinc/23/67/46/192236746.db2.gz VZLYWOPXFSRDHX-AWEZNQCLSA-N 2 0 236.334 2.354 20 0 BEADRP CCSCC[N@@H+]1CCCC[C@@H]1[C@@H]1CC[NH2+]C1 ZINC000420396045 192237470 /nfs/dbraw/zinc/23/74/70/192237470.db2.gz LMJMOSBNDFBCIT-CHWSQXEVSA-N 2 0 242.432 2.204 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)c1ccccn1 ZINC000420399469 192238702 /nfs/dbraw/zinc/23/87/02/192238702.db2.gz HYRUSEONKDVQMR-OLZOCXBDSA-N 2 0 233.359 2.122 20 0 BEADRP Cc1cccc([C@@H](C)[NH2+]CCC[NH3+])c1C ZINC000420419141 192240568 /nfs/dbraw/zinc/24/05/68/192240568.db2.gz XGDFJHVXJTXPKE-GFCCVEGCSA-N 2 0 206.333 2.303 20 0 BEADRP CCCC[NH+]1CCC([C@H]2OCCC[C@H]2[NH3+])CC1 ZINC000420374625 192231244 /nfs/dbraw/zinc/23/12/44/192231244.db2.gz HPWYUXWLPGTTHA-ZIAGYGMSSA-N 2 0 240.391 2.005 20 0 BEADRP CCc1cccc(C[N@H+](C)CCC[NH2+]C)c1 ZINC000420379085 192232880 /nfs/dbraw/zinc/23/28/80/192232880.db2.gz APGXUGVYZRJXBY-UHFFFAOYSA-N 2 0 220.360 2.290 20 0 BEADRP CC[C@H](C)[NH+]1CCC([C@H]2OCCC[C@@H]2[NH3+])CC1 ZINC000420379793 192233770 /nfs/dbraw/zinc/23/37/70/192233770.db2.gz NPIBVYCVEVXRKC-FPMFFAJLSA-N 2 0 240.391 2.003 20 0 BEADRP CCc1cc(N(C)C[C@@H]2CCC[N@@H+]2C)cc[nH+]1 ZINC000420635809 192252267 /nfs/dbraw/zinc/25/22/67/192252267.db2.gz MILAWBBDTRPWIT-AWEZNQCLSA-N 2 0 233.359 2.174 20 0 BEADRP [NH3+]C1CCC([NH2+][C@@H]2CCC[C@@H]2C2CC2)CC1 ZINC000336165709 134112956 /nfs/dbraw/zinc/11/29/56/134112956.db2.gz VGASIBRIFFOXQS-NWINJMCUSA-N 2 0 222.376 2.425 20 0 BEADRP CCc1cc(N2CCC[N@@H+](CC)CC2)cc[nH+]1 ZINC000336194151 134125225 /nfs/dbraw/zinc/12/52/25/134125225.db2.gz BBGLBWDIFOTWKA-UHFFFAOYSA-N 2 0 233.359 2.176 20 0 BEADRP C[C@H]1CSC[C@@H]1[NH2+]CCN1CCCC1(C)C ZINC000449781957 202034429 /nfs/dbraw/zinc/03/44/29/202034429.db2.gz JTEGNZFRWWTBCI-RYUDHWBXSA-N 2 0 242.432 2.202 20 0 BEADRP Cc1cccc(CC[NH+]2C[C@H]3C[N@H+](C)C[C@H]3C2)c1 ZINC000336215908 134136561 /nfs/dbraw/zinc/13/65/61/134136561.db2.gz PZAFYYYOHNRRJF-IYBDPMFKSA-N 2 0 244.382 2.031 20 0 BEADRP CCCC1(C[NH2+][C@H]2CCC[C@@H]2[NH3+])CCC1 ZINC000422927340 192508782 /nfs/dbraw/zinc/50/87/82/192508782.db2.gz GDYOTBJQVOWYHZ-RYUDHWBXSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CC1Cc2ccccc2C1 ZINC000422976015 192533020 /nfs/dbraw/zinc/53/30/20/192533020.db2.gz CRWOEWDARUYNML-RYUDHWBXSA-N 2 0 232.371 2.117 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]CC1(C2CC2)CCC1 ZINC000423005634 192535446 /nfs/dbraw/zinc/53/54/46/192535446.db2.gz SPAPQHPRYQMPFF-NEPJUHHUSA-N 2 0 208.349 2.036 20 0 BEADRP CC(C)O[C@@H]1C[C@H]([NH2+][C@H](C)CCC[NH3+])C1(C)C ZINC000423046447 192551337 /nfs/dbraw/zinc/55/13/37/192551337.db2.gz FFZODYILQWCUJK-FRRDWIJNSA-N 2 0 242.407 2.296 20 0 BEADRP CC(C)C[C@@H]1OCCC[C@@H]1[NH2+][C@H](C)C[C@H](C)[NH3+] ZINC000423047221 192551343 /nfs/dbraw/zinc/55/13/43/192551343.db2.gz FWGQGJZBAYYADF-CRWXNKLISA-N 2 0 242.407 2.296 20 0 BEADRP Cc1csc([C@@H](C)C[NH2+][C@H](C)CCC[NH3+])n1 ZINC000423036364 192548434 /nfs/dbraw/zinc/54/84/34/192548434.db2.gz KWJMPGWXNPTXGL-VHSXEESVSA-N 2 0 241.404 2.272 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]C[C@](C)(O)C1CCCCC1 ZINC000423072305 192559880 /nfs/dbraw/zinc/55/98/80/192559880.db2.gz JCPPQCIPZGFPGW-OCCSQVGLSA-N 2 0 242.407 2.035 20 0 BEADRP CCc1cc(N2CCC(C[NH+](C)C)CC2)cc[nH+]1 ZINC000450261240 202112121 /nfs/dbraw/zinc/11/21/21/202112121.db2.gz MUNWWDQNFCBJEZ-UHFFFAOYSA-N 2 0 247.386 2.422 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+]CCC1(C)CC1 ZINC000423087947 192563885 /nfs/dbraw/zinc/56/38/85/192563885.db2.gz QPSYKTLJDLLBHB-RYUDHWBXSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@H]1CC[C@@H]1C1CC1 ZINC000423100692 192567540 /nfs/dbraw/zinc/56/75/40/192567540.db2.gz VLVSMBZODSOLRI-RTXFEEFZSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1CCO[C@@H](C2CC2)C1 ZINC000423054581 192570416 /nfs/dbraw/zinc/57/04/16/192570416.db2.gz VAGIAWWYEUYZRR-MRVWCRGKSA-N 2 0 240.391 2.051 20 0 BEADRP CCOCC(C)(C)C[NH2+][C@H]1CC[NH2+]CC[C@@H]1C ZINC000423121176 192575902 /nfs/dbraw/zinc/57/59/02/192575902.db2.gz IDEHMAXNKITTJC-STQMWFEESA-N 2 0 242.407 2.027 20 0 BEADRP CC(C)[C@H](C)[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000130159354 325019729 /nfs/dbraw/zinc/01/97/29/325019729.db2.gz YZWZUEDYMBGUHJ-RWMBFGLXSA-N 2 0 210.365 2.247 20 0 BEADRP C[NH+](C)C[C@H]1CC[N@H+](C[C@@H]2CCC(F)(F)C2)C1 ZINC000450408145 202155933 /nfs/dbraw/zinc/15/59/33/202155933.db2.gz VFBVJJBRAKYHHP-VXGBXAGGSA-N 2 0 246.345 2.305 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623357484 356794916 /nfs/dbraw/zinc/79/49/16/356794916.db2.gz RIPIJAAQJCFTGN-IJLUTSLNSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@@H]1C[C@H]1C[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623357483 356795060 /nfs/dbraw/zinc/79/50/60/356795060.db2.gz RIPIJAAQJCFTGN-GRYCIOLGSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CC(C)(C)c1cccnc1 ZINC000423174141 192608468 /nfs/dbraw/zinc/60/84/68/192608468.db2.gz BJMDFBSDABUQEY-ZDUSSCGKSA-N 2 0 249.402 2.466 20 0 BEADRP C[C@H]([NH2+]CCCC[NH+](C)C)[C@@H]1C[C@H]1C1CC1 ZINC000623383480 356907049 /nfs/dbraw/zinc/90/70/49/356907049.db2.gz WLWJUZTTWLOTMA-UBHSHLNASA-N 2 0 224.392 2.352 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+]CCOC(C)(C)C)CC1(C)C ZINC000623385379 356910469 /nfs/dbraw/zinc/91/04/69/356910469.db2.gz HVORWHQQQQXMKB-GFCCVEGCSA-N 2 0 242.407 2.264 20 0 BEADRP CC1CC[NH+](C[C@@H]2CCCC[NH2+]C2)CC1 ZINC000257697699 538747033 /nfs/dbraw/zinc/74/70/33/538747033.db2.gz WTKRACINYKJLPB-CYBMUJFWSA-N 2 0 210.365 2.108 20 0 BEADRP CC[C@@H](C[NH2+][C@@H](C)C1C[NH2+]C1)CC(F)(F)F ZINC000423185559 192615704 /nfs/dbraw/zinc/61/57/04/192615704.db2.gz NYNWPLNYDRYOKM-DTWKUNHWSA-N 2 0 238.297 2.163 20 0 BEADRP Cc1cncc([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[NH2+]C2)c1 ZINC000423206826 192628169 /nfs/dbraw/zinc/62/81/69/192628169.db2.gz CEAMMNCCHPPIBK-MELADBBJSA-N 2 0 247.386 2.429 20 0 BEADRP CCC(C)(C)CC[N@@H+]1CC[C@H]([NH3+])[C@H](C)C1 ZINC000261554482 535351649 /nfs/dbraw/zinc/35/16/49/535351649.db2.gz UGIBISMUQVEHSQ-NEPJUHHUSA-N 2 0 212.381 2.482 20 0 BEADRP [NH3+]CCC[NH2+][C@H]1CCC[C@@H](c2cccnc2)C1 ZINC000423194867 192621231 /nfs/dbraw/zinc/62/12/31/192621231.db2.gz RYPLXRBIBGKWJF-OCCSQVGLSA-N 2 0 233.359 2.046 20 0 BEADRP CCC(C)(C)CC[N@@H+]1CC[C@@H]([NH3+])[C@@H](C)C1 ZINC000261554483 535351061 /nfs/dbraw/zinc/35/10/61/535351061.db2.gz UGIBISMUQVEHSQ-NWDGAFQWSA-N 2 0 212.381 2.482 20 0 BEADRP CCC(C)(C)CC[N@@H+]1CC[C@@](C)(C[NH3+])C1 ZINC000261545998 535351166 /nfs/dbraw/zinc/35/11/66/535351166.db2.gz KMKSIBKBLSXORL-ZDUSSCGKSA-N 2 0 212.381 2.483 20 0 BEADRP C[NH2+]CCC[NH2+][C@H]1CCCc2sccc21 ZINC000423203571 192626445 /nfs/dbraw/zinc/62/64/45/192626445.db2.gz SPKZTOPMFJWGOF-NSHDSACASA-N 2 0 224.373 2.325 20 0 BEADRP C[C@@H]1C[C@@H](C)C[NH+](C[C@H]2CCCC[NH2+]C2)C1 ZINC000257786747 538766768 /nfs/dbraw/zinc/76/67/68/538766768.db2.gz MJNAFIYCSVUAGF-MCIONIFRSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H]1c2cc(F)ccc2C[C@H]1C ZINC000423227036 192638019 /nfs/dbraw/zinc/63/80/19/192638019.db2.gz UAPHKEQGWBLEJT-BFVZDQMLSA-N 2 0 236.334 2.386 20 0 BEADRP C[N@H+](CCC[NH3+])Cc1cccc(C(F)(F)F)c1 ZINC000020525849 357012350 /nfs/dbraw/zinc/01/23/50/357012350.db2.gz OIJSJMAJOFMCFA-UHFFFAOYSA-N 2 0 246.276 2.486 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1cccc(O)c1 ZINC000423244177 192648503 /nfs/dbraw/zinc/64/85/03/192648503.db2.gz HJULLOHJBBONJR-VXGBXAGGSA-N 2 0 234.343 2.042 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+]CCN1CC[C@@H](C)C1 ZINC000389932600 357069525 /nfs/dbraw/zinc/06/95/25/357069525.db2.gz LMWYJLMLIPRAMX-JHJVBQTASA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000389985079 357079044 /nfs/dbraw/zinc/07/90/44/357079044.db2.gz LQOQQENCGBIGTI-YNEHKIRRSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1)C1CCC1 ZINC000582421019 357144024 /nfs/dbraw/zinc/14/40/24/357144024.db2.gz SIDVJBWLHBEQJX-LLVKDONJSA-N 2 0 218.344 2.424 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CC[NH2+]C1)[C@@H]1CC1(C)C ZINC000423248043 192649807 /nfs/dbraw/zinc/64/98/07/192649807.db2.gz MGHKQHOSXMAFHK-SRVKXCTJSA-N 2 0 210.365 2.010 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@H]2CCCSC2)CC1 ZINC000304573610 357168240 /nfs/dbraw/zinc/16/82/40/357168240.db2.gz XHHOUKIQHWDMSO-GFCCVEGCSA-N 2 0 242.432 2.204 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]C[C@H]2CCCC2(F)F)C1 ZINC000390872668 357119154 /nfs/dbraw/zinc/11/91/54/357119154.db2.gz POUWKOKRRMDEJJ-MXWKQRLJSA-N 2 0 232.318 2.281 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+][C@@H]1CCC12CCC2 ZINC000423275936 192668226 /nfs/dbraw/zinc/66/82/26/192668226.db2.gz MJFSUVQLOXKFAH-YNEHKIRRSA-N 2 0 222.376 2.426 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCCSC1)C1CC[NH+](C)CC1 ZINC000157132987 538811492 /nfs/dbraw/zinc/81/14/92/538811492.db2.gz BEULIQOQBJSEFS-WCQYABFASA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H]1CSC[C@H]1[NH2+]C[C@H]1CCCC[N@H+](C)C1 ZINC000628425917 357254134 /nfs/dbraw/zinc/25/41/34/357254134.db2.gz ZCZQTAQWMOVJPQ-JHJVBQTASA-N 2 0 242.432 2.059 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000423278795 192671875 /nfs/dbraw/zinc/67/18/75/192671875.db2.gz ROROXPYLLZZZQA-CHWSQXEVSA-N 2 0 236.359 2.190 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)[C@H]1CC1(C)C ZINC000423280044 192672472 /nfs/dbraw/zinc/67/24/72/192672472.db2.gz UEKPTWDEHQGJEX-RWMBFGLXSA-N 2 0 224.392 2.400 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H]1CCCC(C)(C)C1 ZINC000423280279 192673662 /nfs/dbraw/zinc/67/36/62/192673662.db2.gz UISHVJHHUHJQTF-NEPJUHHUSA-N 2 0 212.381 2.400 20 0 BEADRP COC[C@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)C1CC1 ZINC000423293657 192684238 /nfs/dbraw/zinc/68/42/38/192684238.db2.gz RVAWMFKTZOYTER-NHYWBVRUSA-N 2 0 248.370 2.221 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCC[C@H](F)C1)[C@@H]1CCC[NH2+]1 ZINC000582606941 357349273 /nfs/dbraw/zinc/34/92/73/357349273.db2.gz ZZPPBYXOJVSCQQ-RNJOBUHISA-N 2 0 228.355 2.387 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]C1CC(C)(C)C1 ZINC000395193032 357417055 /nfs/dbraw/zinc/41/70/55/357417055.db2.gz ZCSATZOTOPTCNG-WZRBSPASSA-N 2 0 224.392 2.493 20 0 BEADRP Cc1cnccc1C[N@@H+]1C[C@H](C[NH3+])[C@@H](C)C[C@@H]1C ZINC000397487376 357515800 /nfs/dbraw/zinc/51/58/00/357515800.db2.gz WHIJTFVAPMHXQS-WHOFXGATSA-N 2 0 247.386 2.195 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)C1 ZINC000230405680 357539440 /nfs/dbraw/zinc/53/94/40/357539440.db2.gz BTVIILDGYXBOIG-ZOBORPQBSA-N 2 0 224.392 2.495 20 0 BEADRP COC1CC([NH2+]C2CC[NH+](C(C)(C)C)CC2)C1 ZINC000230675763 357549499 /nfs/dbraw/zinc/54/94/99/357549499.db2.gz GBNLTEYASLLFTK-UHFFFAOYSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@@H]([NH2+]CCC[NH+]1CCCCC1)[C@@H]1C[C@H]1C ZINC000321554358 357589253 /nfs/dbraw/zinc/58/92/53/357589253.db2.gz MAKBSYBNIGMPEA-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH+](C)CCOCC[NH2+][C@@H]1CCCC(C)(C)C1 ZINC000231676043 357618691 /nfs/dbraw/zinc/61/86/91/357618691.db2.gz DBDSYGHMNJSRJZ-CYBMUJFWSA-N 2 0 242.407 2.123 20 0 BEADRP CCCC[C@@H](C)[NH2+]CC1(COC)CC[NH2+]CC1 ZINC000232985071 357688339 /nfs/dbraw/zinc/68/83/39/357688339.db2.gz MLGNGNUBGPBUQG-CYBMUJFWSA-N 2 0 242.407 2.171 20 0 BEADRP CC[C@@H]1CCCC[C@H]1[NH2+][C@@H](CCC[NH3+])COC ZINC000233925528 357762977 /nfs/dbraw/zinc/76/29/77/357762977.db2.gz QSVJVBPQHAWNKJ-HZSPNIEDSA-N 2 0 242.407 2.299 20 0 BEADRP CC[C@@H]([NH2+]CCC[NH+](CC)CC)[C@@H]1CCCO1 ZINC000191611547 357778588 /nfs/dbraw/zinc/77/85/88/357778588.db2.gz DYIQLGIZOCPFHD-KGLIPLIRSA-N 2 0 242.407 2.266 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+][C@H](C)C1CCCCC1 ZINC000234747807 357834725 /nfs/dbraw/zinc/83/47/25/357834725.db2.gz QFRPXVHUDXXJSW-TZMCWYRMSA-N 2 0 242.407 2.299 20 0 BEADRP CSC1(CN2CCC[N@@H+]3CCC[C@@H]3C2)CC1 ZINC000235076880 357846974 /nfs/dbraw/zinc/84/69/74/357846974.db2.gz GTASBGAKWNQOPQ-GFCCVEGCSA-N 2 0 240.416 2.052 20 0 BEADRP C[C@@]1(C[NH3+])CC[N@H+](CCCOc2ccccc2)C1 ZINC000235438454 357868989 /nfs/dbraw/zinc/86/89/89/357868989.db2.gz OOTMFISGQXQRMT-HNNXBMFYSA-N 2 0 248.370 2.126 20 0 BEADRP CC(C)=CC[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000261561819 535371054 /nfs/dbraw/zinc/37/10/54/535371054.db2.gz AWPLBJJNGHPMOS-BFHYXJOUSA-N 2 0 222.376 2.463 20 0 BEADRP C[C@H]([NH3+])[C@H]1CC[N@H+](C/C=C\c2ccccc2)C1 ZINC000382678823 357922942 /nfs/dbraw/zinc/92/29/42/357922942.db2.gz HPRVDICNGHPYNR-DFIIWKEWSA-N 2 0 230.355 2.369 20 0 BEADRP C[NH2+]CCSC[C@@H]1CCCC[N@@H+]1C(C)C ZINC000583810410 357955639 /nfs/dbraw/zinc/95/56/39/357955639.db2.gz NIFKGSMZUHAJTJ-LBPRGKRZSA-N 2 0 230.421 2.202 20 0 BEADRP C[C@@H]1C[C@@H]1[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000169240638 134249822 /nfs/dbraw/zinc/24/98/22/134249822.db2.gz QRRFUAMNLPDOMP-ZJNJWXDTSA-N 2 0 202.301 2.129 20 0 BEADRP CCC1([NH+](C)C)CC[NH+](CCCCOC)CC1 ZINC000640016318 358067532 /nfs/dbraw/zinc/06/75/32/358067532.db2.gz YEYGFOYEYJPMBF-UHFFFAOYSA-N 2 0 242.407 2.219 20 0 BEADRP c1ccc2c(c1)CC[NH+](C[C@H]1CCC[NH2+]C1)CC2 ZINC000079572132 358106742 /nfs/dbraw/zinc/10/67/42/358106742.db2.gz KOQFORUGCHSTJU-AWEZNQCLSA-N 2 0 244.382 2.087 20 0 BEADRP CC(C)C[C@@H]1C[C@H]1[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000583882363 358117183 /nfs/dbraw/zinc/11/71/83/358117183.db2.gz DLJQDDXYFLUMFU-FDYHWXHSSA-N 2 0 210.365 2.281 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]C(C2CC2)C2CC2)C1 ZINC000086402323 491123862 /nfs/dbraw/zinc/12/38/62/491123862.db2.gz HBOSQUMJIVJVSP-RYUDHWBXSA-N 2 0 208.349 2.035 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H](C)c1ccc(F)cc1 ZINC000584774230 358175011 /nfs/dbraw/zinc/17/50/11/358175011.db2.gz HSMPVMWLDSZNGQ-LLVKDONJSA-N 2 0 224.323 2.476 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCC[C@@H]([NH3+])C1)c1cccc(O)c1 ZINC000222959016 358216664 /nfs/dbraw/zinc/21/66/64/358216664.db2.gz BMXILSSBTGFDMS-RTXFEEFZSA-N 2 0 234.343 2.313 20 0 BEADRP Cc1ccccc1C[N@H+]1CC[C@@H]([NH3+])C[C@H]1C ZINC000226878749 358346718 /nfs/dbraw/zinc/34/67/18/358346718.db2.gz PRFUTTUEDNVVQT-TZMCWYRMSA-N 2 0 218.344 2.307 20 0 BEADRP [NH3+]CCC1CC[NH+](Cc2cccc(F)c2)CC1 ZINC000042427597 358348831 /nfs/dbraw/zinc/34/88/31/358348831.db2.gz UIJOXNFKGJZHAF-UHFFFAOYSA-N 2 0 236.334 2.387 20 0 BEADRP CC(C)(C)CC[NH+]1CCC(CC[NH3+])CC1 ZINC000042427776 358349177 /nfs/dbraw/zinc/34/91/77/358349177.db2.gz DCBPGBNZGFRUDB-UHFFFAOYSA-N 2 0 212.381 2.483 20 0 BEADRP CC(C)[N@H+](CC1CC1)C[C@H]1CCC[NH2+]C1 ZINC000042593610 358353113 /nfs/dbraw/zinc/35/31/13/358353113.db2.gz SUEKWZJFSZJLIO-ZDUSSCGKSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@H]1CCC[C@@H](C)C1 ZINC000219154300 134274409 /nfs/dbraw/zinc/27/44/09/134274409.db2.gz AMEBKHAIFFGZSP-UPJWGTAASA-N 2 0 212.381 2.495 20 0 BEADRP CCc1ccc(C[N@H+](C)CCC[NH3+])s1 ZINC000227742745 358362776 /nfs/dbraw/zinc/36/27/76/358362776.db2.gz DVSMLKSOVCLNLH-UHFFFAOYSA-N 2 0 212.362 2.091 20 0 BEADRP CC[C@H](C)C[NH2+]CC1CC[NH+](CC)CC1 ZINC000044517647 358388497 /nfs/dbraw/zinc/38/84/97/358388497.db2.gz NKCJDILQKBYHRP-LBPRGKRZSA-N 2 0 212.381 2.354 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@@H](C)c2ccncc2)CC1 ZINC000044517481 358388880 /nfs/dbraw/zinc/38/88/80/358388880.db2.gz RUUSOLZBFNGVSY-ZDUSSCGKSA-N 2 0 247.386 2.464 20 0 BEADRP COc1ccccc1CC[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000230285259 358396947 /nfs/dbraw/zinc/39/69/47/358396947.db2.gz BCBHWHHXBKJTFL-KGLIPLIRSA-N 2 0 248.370 2.097 20 0 BEADRP COc1ccccc1CC[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000230285266 358397025 /nfs/dbraw/zinc/39/70/25/358397025.db2.gz BCBHWHHXBKJTFL-KBPBESRZSA-N 2 0 248.370 2.097 20 0 BEADRP CCCCOCCC[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000229340562 358402206 /nfs/dbraw/zinc/40/22/06/358402206.db2.gz PNUZTXRHIOIFCZ-CHWSQXEVSA-N 2 0 228.380 2.053 20 0 BEADRP CC[C@H](C)[NH2+]CC1(C[NH+](C)C)CCCC1 ZINC000135016034 325388758 /nfs/dbraw/zinc/38/87/58/325388758.db2.gz ZCUBYCULMWVBKO-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP CC(C)C[NH2+]Cc1ccc(C[NH+](C)C)cc1 ZINC000048463112 358635912 /nfs/dbraw/zinc/63/59/12/358635912.db2.gz YBSWEVJPDIBTLX-UHFFFAOYSA-N 2 0 220.360 2.494 20 0 BEADRP C[C@H](CC[NH3+])[NH2+]Cc1ccc(OC(F)F)cc1 ZINC000131243117 358666685 /nfs/dbraw/zinc/66/66/85/358666685.db2.gz XXBJAKDOOOFXBK-SECBINFHSA-N 2 0 244.285 2.115 20 0 BEADRP C[C@H]1C[C@@H](C[NH3+])C[N@@H+]1CCCc1ccccc1 ZINC000131486805 358678511 /nfs/dbraw/zinc/67/85/11/358678511.db2.gz AOEROUQKYHJYKH-ZFWWWQNUSA-N 2 0 232.371 2.288 20 0 BEADRP Cc1ncc(CN(C)CC[C@H]([NH3+])C(C)C)s1 ZINC000133293746 358749481 /nfs/dbraw/zinc/74/94/81/358749481.db2.gz FSEREJAZQCCSKE-LBPRGKRZSA-N 2 0 241.404 2.257 20 0 BEADRP Cc1ncc(CN(C)CC[C@@H]([NH3+])C(C)C)s1 ZINC000133293945 358749693 /nfs/dbraw/zinc/74/96/93/358749693.db2.gz FSEREJAZQCCSKE-GFCCVEGCSA-N 2 0 241.404 2.257 20 0 BEADRP Cc1ccc(OCCCN2CC[C@H]([NH3+])C2)cc1C ZINC000050242588 358721226 /nfs/dbraw/zinc/72/12/26/358721226.db2.gz GQMFBPRUNLCFPX-AWEZNQCLSA-N 2 0 248.370 2.105 20 0 BEADRP Cc1cc(Cl)ccc1C[N@@H+]1CC[C@H](C[NH3+])C1 ZINC000219843605 134292456 /nfs/dbraw/zinc/29/24/56/134292456.db2.gz IRUQXDSSJHUDKS-LLVKDONJSA-N 2 0 238.762 2.429 20 0 BEADRP CC[C@H](O)CC[NH2+][C@@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000135034513 358816960 /nfs/dbraw/zinc/81/69/60/358816960.db2.gz JNZOXZPTWHZEHK-IHRRRGAJSA-N 2 0 242.407 2.048 20 0 BEADRP C[NH2+][C@@H]1CCCN(CCCOc2ccccc2)C1 ZINC000053203621 358818176 /nfs/dbraw/zinc/81/81/76/358818176.db2.gz JXYHRZQSUZYSQQ-CQSZACIVSA-N 2 0 248.370 2.139 20 0 BEADRP C[C@H]1CCC[N@@H+]1C1CC[NH+](CC2CC2)CC1 ZINC000134684939 358800815 /nfs/dbraw/zinc/80/08/15/358800815.db2.gz JVRWROJPYZEGMW-LBPRGKRZSA-N 2 0 222.376 2.345 20 0 BEADRP Cc1cccc(C[N@@H+]2CC[C@@H]([NH3+])[C@@H](C)C2)c1 ZINC000219836941 134292102 /nfs/dbraw/zinc/29/21/02/134292102.db2.gz BHYVJULQJQUVOV-GXTWGEPZSA-N 2 0 218.344 2.164 20 0 BEADRP Cc1ccccc1C[N@@H+]1CC[C@@H]([NH3+])[C@@H](C)C1 ZINC000219836450 134292108 /nfs/dbraw/zinc/29/21/08/134292108.db2.gz RYRFEPQYAFWMQG-GXTWGEPZSA-N 2 0 218.344 2.164 20 0 BEADRP C[NH+](C)CCC[NH2+]C[C@@H]1C[C@@H]1c1ccccc1 ZINC000135610475 358846591 /nfs/dbraw/zinc/84/65/91/358846591.db2.gz YWGGPAKHNDNXQC-LSDHHAIUSA-N 2 0 232.371 2.331 20 0 BEADRP CCC[NH+]1CCC([NH2+]C[C@@H]2C[C@H]2C)CC1 ZINC000132739974 491138166 /nfs/dbraw/zinc/13/81/66/491138166.db2.gz DEYKNBJYLDNMLT-NEPJUHHUSA-N 2 0 210.365 2.106 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH+](C)CCCF)[C@H](C)C1 ZINC000137645786 358897915 /nfs/dbraw/zinc/89/79/15/358897915.db2.gz XZJBOUXEAOGVHO-NEPJUHHUSA-N 2 0 216.344 2.008 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]CCc2ccsc2)C1 ZINC000086403614 358968601 /nfs/dbraw/zinc/96/86/01/358968601.db2.gz LDWGYNNUBMCVPM-NWDGAFQWSA-N 2 0 224.373 2.150 20 0 BEADRP C(C[NH2+][C@@H]1CCCSC1)C[NH+]1CCCCC1 ZINC000061571792 358934923 /nfs/dbraw/zinc/93/49/23/358934923.db2.gz TYDLOLJNFDIPRD-CYBMUJFWSA-N 2 0 242.432 2.348 20 0 BEADRP Cc1c[nH+]ccc1NCC[NH+]1CCCCC1 ZINC000070047268 359040266 /nfs/dbraw/zinc/04/02/66/359040266.db2.gz ZHGZNNQRJVCLFE-UHFFFAOYSA-N 2 0 219.332 2.288 20 0 BEADRP CCC[NH2+]CC[NH2+][C@@H]1CC[C@@H]1C1CCC1 ZINC000423312640 192700348 /nfs/dbraw/zinc/70/03/48/192700348.db2.gz SGKGTAFAMJUOFS-CHWSQXEVSA-N 2 0 210.365 2.154 20 0 BEADRP CC(C)[C@H]1C[C@H]([NH2+]CCCC[NH+](C)C)CCO1 ZINC000070360765 359051340 /nfs/dbraw/zinc/05/13/40/359051340.db2.gz SBPGHNHEHWLTPF-ZIAGYGMSSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H]1Cc2ccccc2[C@H]1[NH2+]CCCC[NH3+] ZINC000423319091 192704912 /nfs/dbraw/zinc/70/49/12/192704912.db2.gz CFJKVCXTQSVTQZ-FZMZJTMJSA-N 2 0 218.344 2.248 20 0 BEADRP CC[C@H]([NH2+]CC1(C)CC[NH2+]CC1)[C@@H]1C[C@H]1C ZINC000423332739 192713520 /nfs/dbraw/zinc/71/35/20/192713520.db2.gz PHJGNZNPXVMKDN-UPJWGTAASA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@@H]([NH2+]C[C@@H]([NH3+])C2CC2)C1 ZINC000423330371 192711084 /nfs/dbraw/zinc/71/10/84/192711084.db2.gz UFPMBKWANHZIFA-DNIRFERGSA-N 2 0 210.365 2.138 20 0 BEADRP CC(=O)Nc1ccc([C@@H](C)[NH2+]CCCC[NH3+])cc1 ZINC000423343177 192720399 /nfs/dbraw/zinc/72/03/99/192720399.db2.gz ZIURNGVDJTTZJR-LLVKDONJSA-N 2 0 249.358 2.035 20 0 BEADRP CC[C@@H]1CCCC[C@@H]1[NH2+]CC1=CC[NH2+]CC1 ZINC000423344381 192720652 /nfs/dbraw/zinc/72/06/52/192720652.db2.gz MSKSSUVTSBHVJH-KGLIPLIRSA-N 2 0 222.376 2.465 20 0 BEADRP Cc1cncc([C@@H](C)[NH2+]CC2(C)CC[NH2+]CC2)c1 ZINC000423345327 192721113 /nfs/dbraw/zinc/72/11/13/192721113.db2.gz YTCMIDYJTCGEES-CYBMUJFWSA-N 2 0 247.386 2.430 20 0 BEADRP COc1cc(C)ccc1CNC1CC[NH+](C)CC1 ZINC000075189359 359139721 /nfs/dbraw/zinc/13/97/21/359139721.db2.gz FAFCPQBXXIOMQT-UHFFFAOYSA-N 2 0 248.370 2.187 20 0 BEADRP COC[C@H]([NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1)C(C)C ZINC000246919309 359174374 /nfs/dbraw/zinc/17/43/74/359174374.db2.gz GAFVXZXCPXCIJJ-MCIONIFRSA-N 2 0 242.407 2.120 20 0 BEADRP C(C[C@H]1CCC[NH2+]1)[NH2+]C1CCC2(CC2)CC1 ZINC000423357909 192730271 /nfs/dbraw/zinc/73/02/71/192730271.db2.gz IXPPNXZJFZBJHR-GFCCVEGCSA-N 2 0 222.376 2.441 20 0 BEADRP CCC[C@@H]([NH2+]CC1=CC[NH2+]CC1)C1CCC1 ZINC000423361010 192731896 /nfs/dbraw/zinc/73/18/96/192731896.db2.gz WPJUMPOLGZOMEN-CQSZACIVSA-N 2 0 222.376 2.465 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCCF)[C@@H](C)C1 ZINC000247348462 359214418 /nfs/dbraw/zinc/21/44/18/359214418.db2.gz XZJBOUXEAOGVHO-NWDGAFQWSA-N 2 0 216.344 2.008 20 0 BEADRP CCCC[N@@H+]1CC[C@H](C[NH+](CC)CC)C1 ZINC000076002748 359264205 /nfs/dbraw/zinc/26/42/05/359264205.db2.gz CMHKRCKRTWIVDU-CYBMUJFWSA-N 2 0 212.381 2.450 20 0 BEADRP CO[C@@H](C[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1)C(C)C ZINC000623436967 359329972 /nfs/dbraw/zinc/32/99/72/359329972.db2.gz LSXRXXOVEQABHH-STQMWFEESA-N 2 0 242.407 2.120 20 0 BEADRP CC[C@@H](C)[C@H](C)[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000423432768 192767339 /nfs/dbraw/zinc/76/73/39/192767339.db2.gz JHRVCHJRTBCBJZ-UVLXDEKHSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)[C@H]1C[C@H]1C ZINC000423482677 192790418 /nfs/dbraw/zinc/79/04/18/192790418.db2.gz PNDLYVUITVUYNJ-XQHKEYJVSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@H](C[NH3+])C1)c1cccc(O)c1 ZINC000423484812 192791098 /nfs/dbraw/zinc/79/10/98/192791098.db2.gz AIGWSCKEVDDIRU-GMXVVIOVSA-N 2 0 234.343 2.170 20 0 BEADRP C[C@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1cccnc1 ZINC000423487977 192792371 /nfs/dbraw/zinc/79/23/71/192792371.db2.gz VCRLDKNVMIMQKV-JSGCOSHPSA-N 2 0 233.359 2.264 20 0 BEADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@H](C2CC2)C2CCC2)C1 ZINC000423511310 192799545 /nfs/dbraw/zinc/79/95/45/192799545.db2.gz PXZWVJVKMGFLBC-HONMWMINSA-N 2 0 222.376 2.282 20 0 BEADRP C1CC2(C1)CC[C@@H]2[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000423543608 192808666 /nfs/dbraw/zinc/80/86/66/192808666.db2.gz NLNXOXSLYCPALN-DGAVXFQQSA-N 2 0 234.387 2.297 20 0 BEADRP COCC1(C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)CCCC1 ZINC000580451112 359558323 /nfs/dbraw/zinc/55/83/23/359558323.db2.gz YSFAMHVRGQZDLP-CHWSQXEVSA-N 2 0 240.391 2.053 20 0 BEADRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]CC1=CCCCC1 ZINC000379586395 359561117 /nfs/dbraw/zinc/56/11/17/359561117.db2.gz JMEUAZXHBHJUEH-CHWSQXEVSA-N 2 0 208.349 2.204 20 0 BEADRP C[C@H]1CSCC[N@H+](CC[C@H]2CCC[NH+]2C)C1 ZINC000249034016 359616281 /nfs/dbraw/zinc/61/62/81/359616281.db2.gz MHJLRLZVPMOKKX-CHWSQXEVSA-N 2 0 242.432 2.156 20 0 BEADRP C[C@H](CNCc1cc2cccnc2o1)C[NH+](C)C ZINC000451172865 202369424 /nfs/dbraw/zinc/36/94/24/202369424.db2.gz PNJXREMEPOELKV-LLVKDONJSA-N 2 0 247.342 2.115 20 0 BEADRP CSCC[NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000169241792 359877966 /nfs/dbraw/zinc/87/79/66/359877966.db2.gz NORLPCYEWBZECI-NEPJUHHUSA-N 2 0 222.357 2.084 20 0 BEADRP C[C@@H]([NH2+]CCC1=CC[NH2+]CC1)c1cscn1 ZINC000578757540 366640526 /nfs/dbraw/zinc/64/05/26/366640526.db2.gz PEKPZAZECRQVRP-SNVBAGLBSA-N 2 0 237.372 2.104 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H]2CCC[C@H](F)C2)C1 ZINC000578787450 366650429 /nfs/dbraw/zinc/65/04/29/366650429.db2.gz PEOVDXUUAZIOMO-QCNOEVLYSA-N 2 0 214.328 2.127 20 0 BEADRP C[C@H]([NH3+])[C@@H]1COCC[C@@H]1[NH2+]CCCC(C)(C)C ZINC000578878477 366664294 /nfs/dbraw/zinc/66/42/94/366664294.db2.gz UWRFQHHHEZIXIY-AVGNSLFASA-N 2 0 242.407 2.155 20 0 BEADRP CC(C)CCOCC[NH2+][C@@H]1CCCC[C@H]1C[NH3+] ZINC000089145912 359992954 /nfs/dbraw/zinc/99/29/54/359992954.db2.gz RUVDUBCSPLZJKU-UONOGXRCSA-N 2 0 242.407 2.156 20 0 BEADRP C[N@H+](CC[C@H]1CC[NH2+]C1)Cc1cccc(F)c1 ZINC000089749133 360037174 /nfs/dbraw/zinc/03/71/74/360037174.db2.gz VUEBKAYJFRYCQO-GFCCVEGCSA-N 2 0 236.334 2.257 20 0 BEADRP c1ccc2c(c1)CC[N@@H+](CC[C@@H]1CC[NH2+]C1)C2 ZINC000089749099 360037198 /nfs/dbraw/zinc/03/71/98/360037198.db2.gz CYYWDDBQFLESLZ-ZDUSSCGKSA-N 2 0 230.355 2.044 20 0 BEADRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]CCCOc1ccccc1 ZINC000089150541 359994325 /nfs/dbraw/zinc/99/43/25/359994325.db2.gz JERVFUSNRQGWOZ-UKRRQHHQSA-N 2 0 248.370 2.173 20 0 BEADRP Cn1ccnc1C[C@H]1CCC[N@H+](CCCF)C1 ZINC000090004047 360053226 /nfs/dbraw/zinc/05/32/26/360053226.db2.gz KUILPHASIIXYBS-GFCCVEGCSA-N 2 0 239.338 2.034 20 0 BEADRP CC[C@H](COC)[NH2+]C1CCC(C[NH+](C)C)CC1 ZINC000090707194 360084042 /nfs/dbraw/zinc/08/40/42/360084042.db2.gz FTAUYOXJIQYTIP-ROKHWSDSSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]CC1(C2CC2)CC1 ZINC000090772730 360086395 /nfs/dbraw/zinc/08/63/95/360086395.db2.gz ZWZJXOPAANFGGM-AAEUAGOBSA-N 2 0 222.376 2.106 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CC2(C3CC3)CC2)[C@H](C)C1 ZINC000090772720 360086434 /nfs/dbraw/zinc/08/64/34/360086434.db2.gz IIZYEYHLZSPTOD-OCCSQVGLSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H](Cc1ccsc1)[NH2+]CC1([NH3+])CCC1 ZINC000578976483 366684170 /nfs/dbraw/zinc/68/41/70/366684170.db2.gz OWZHSMDCAKWTNS-SNVBAGLBSA-N 2 0 224.373 2.150 20 0 BEADRP CC1(C)C[C@@H]1[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000156073860 360946466 /nfs/dbraw/zinc/94/64/66/360946466.db2.gz JDGVJWITKWXVMH-UTUOFQBUSA-N 2 0 208.349 2.001 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCN(C)[C@H](C)C1)C(C)C ZINC000156111477 360948981 /nfs/dbraw/zinc/94/89/81/360948981.db2.gz FKOJVURKNHCQQM-UPJWGTAASA-N 2 0 212.381 2.493 20 0 BEADRP C[C@@H](CCC(F)(F)F)[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000414837065 200766565 /nfs/dbraw/zinc/76/65/65/200766565.db2.gz UBRXUHJJNQFIAJ-UWVGGRQHSA-N 2 0 238.297 2.307 20 0 BEADRP C([NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)C1CCC1 ZINC000155845201 360927268 /nfs/dbraw/zinc/92/72/68/360927268.db2.gz XBZMINNYVZZJGS-CHWSQXEVSA-N 2 0 208.349 2.003 20 0 BEADRP C[C@H](CC1CCC1)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000133406760 491153382 /nfs/dbraw/zinc/15/33/82/491153382.db2.gz HERDWVCQHCTQSK-TZMCWYRMSA-N 2 0 224.392 2.497 20 0 BEADRP COc1ccc2c(c1)CC[C@@H]2[NH2+]CCC[NH+](C)C ZINC000631562359 360986750 /nfs/dbraw/zinc/98/67/50/360986750.db2.gz WVNBHPRFBRIXFS-HNNXBMFYSA-N 2 0 248.370 2.224 20 0 BEADRP C[C@H](CC1CCC1)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000133406339 491153315 /nfs/dbraw/zinc/15/33/15/491153315.db2.gz HERDWVCQHCTQSK-OCCSQVGLSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H]1CCC[C@@H]([NH2+]CC2([NH3+])CCOCC2)C1 ZINC000629388759 361035725 /nfs/dbraw/zinc/03/57/25/361035725.db2.gz SPIJJXWFQXXCBE-CHWSQXEVSA-N 2 0 240.391 2.053 20 0 BEADRP CC[C@H]1CCC[C@@H]([NH2+]CC2([NH3+])CCOCC2)C1 ZINC000629388761 361035896 /nfs/dbraw/zinc/03/58/96/361035896.db2.gz SPIJJXWFQXXCBE-QWHCGFSZSA-N 2 0 240.391 2.053 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1[NH2+][C@@H]1CCC[C@@H](C)C1 ZINC000629390213 361037664 /nfs/dbraw/zinc/03/76/64/361037664.db2.gz ANRDGSIDMLDRBB-FVCCEPFGSA-N 2 0 210.365 2.295 20 0 BEADRP CC(C)[C@H]1CCC[C@@H]1[NH2+][C@@H]1CC[NH2+][C@H]1C ZINC000629407926 361056700 /nfs/dbraw/zinc/05/67/00/361056700.db2.gz NESMMTZNWRKVQZ-LOWDOPEQSA-N 2 0 210.365 2.151 20 0 BEADRP CC1(C)CCC([NH2+]CC2([NH3+])CCOCC2)CC1 ZINC000629388575 361041240 /nfs/dbraw/zinc/04/12/40/361041240.db2.gz PILGGERHFYQHPQ-UHFFFAOYSA-N 2 0 240.391 2.053 20 0 BEADRP CC(C)[C@H]1CCC[C@H]1[NH2+][C@@H]1CC[NH2+][C@H]1C ZINC000629407930 361056803 /nfs/dbraw/zinc/05/68/03/361056803.db2.gz NESMMTZNWRKVQZ-UMSGYPCISA-N 2 0 210.365 2.151 20 0 BEADRP CCCC[C@@H]1CCC[C@@H]1[NH2+]CCOCCC[NH3+] ZINC000629400483 361051912 /nfs/dbraw/zinc/05/19/12/361051912.db2.gz ZECKBSXVMSPKHK-KGLIPLIRSA-N 2 0 242.407 2.300 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+][C@H]1C[C@H](C)C[C@H](C)C1 ZINC000629406193 361054272 /nfs/dbraw/zinc/05/42/72/361054272.db2.gz JYBWYRSPHTXCHH-OBPIAQAESA-N 2 0 210.365 2.151 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+]C[C@H]1CCCC[C@@H]1C ZINC000629408686 361059763 /nfs/dbraw/zinc/05/97/63/361059763.db2.gz YQAPAEYPJJESOA-WUHRBBMRSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H](CCC(F)(F)F)[NH2+][C@@H]1CC[C@@H](C)NC1 ZINC000629418401 361063365 /nfs/dbraw/zinc/06/33/65/361063365.db2.gz XTXSZKVBKTVICO-KXUCPTDWSA-N 2 0 238.297 2.448 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[NH2+]C12CCC2)C1CCCC1 ZINC000629521175 361117789 /nfs/dbraw/zinc/11/77/89/361117789.db2.gz RXKMVFQZIWZOOM-WCQYABFASA-N 2 0 222.376 2.439 20 0 BEADRP Cc1ccc2ncc(CN(C)[C@@H](C)C[NH3+])cc2c1 ZINC000629510424 361108788 /nfs/dbraw/zinc/10/87/88/361108788.db2.gz UAUMOJHPQOVGMU-LBPRGKRZSA-N 2 0 243.354 2.322 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[NH2+][C@H]1CC)[C@@H]1C[C@@H]1C ZINC000629528118 361132155 /nfs/dbraw/zinc/13/21/55/361132155.db2.gz PNFYEGIHXFBEBI-FPYNETTCSA-N 2 0 210.365 2.151 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1[NH2+][C@H]1CC[C@H]1C1CCC1 ZINC000629528288 361135227 /nfs/dbraw/zinc/13/52/27/361135227.db2.gz VVQAIZPXSAQQIA-XDQVBPFNSA-N 2 0 222.376 2.295 20 0 BEADRP C[NH2+]CCOCC[NH2+][C@@H]1C[C@H](C)c2ccccc21 ZINC000629530530 361144348 /nfs/dbraw/zinc/14/43/48/361144348.db2.gz JEHMYWIIVYZJLI-SWLSCSKDSA-N 2 0 248.370 2.061 20 0 BEADRP C[NH2+]CCOCC[NH2+][C@H]1CCC[C@@H](C(C)C)C1 ZINC000629530814 361145726 /nfs/dbraw/zinc/14/57/26/361145726.db2.gz RXLSPDVDCSOKTQ-KGLIPLIRSA-N 2 0 242.407 2.027 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+]CC[C@@H]1CC=CCC1 ZINC000629531795 361149991 /nfs/dbraw/zinc/14/99/91/361149991.db2.gz YDUSNUIFDJRWIL-ZIAGYGMSSA-N 2 0 240.391 2.076 20 0 BEADRP Cc1ccc(C(C)(C)C[NH2+][C@@H]2CCC[C@H]2[NH3+])nc1 ZINC000629525220 361125597 /nfs/dbraw/zinc/12/55/97/361125597.db2.gz WWWIYSOPGNXZNT-CHWSQXEVSA-N 2 0 247.386 2.137 20 0 BEADRP CCC[N@H+](CCSCC)C1CC[NH2+]CC1 ZINC000158597451 361205502 /nfs/dbraw/zinc/20/55/02/361205502.db2.gz FFXDXWUVCOEPJR-UHFFFAOYSA-N 2 0 230.421 2.204 20 0 BEADRP CCC1CC([NH2+]Cc2ccc(C[NH3+])cc2)C1 ZINC000579008542 366696127 /nfs/dbraw/zinc/69/61/27/366696127.db2.gz ZRECFTBDFHPRPU-UHFFFAOYSA-N 2 0 218.344 2.424 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]CC[C@@H]1CC1(F)F ZINC000622043741 370675213 /nfs/dbraw/zinc/67/52/13/370675213.db2.gz JSPIXLODUCLWOU-MXWKQRLJSA-N 2 0 232.318 2.281 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CC1(F)F)[C@@H]1CCCC[NH2+]1 ZINC000622043664 370675385 /nfs/dbraw/zinc/67/53/85/370675385.db2.gz HFLQJAMDQSNUNR-MXWKQRLJSA-N 2 0 232.318 2.152 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CC1(F)F)[C@H]1CCCC[NH2+]1 ZINC000622043661 370675854 /nfs/dbraw/zinc/67/58/54/370675854.db2.gz HFLQJAMDQSNUNR-GARJFASQSA-N 2 0 232.318 2.152 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H]1CCCc2ccccc2C1 ZINC000622044891 370678249 /nfs/dbraw/zinc/67/82/49/370678249.db2.gz WTIMKZCMXNSPNO-SWLSCSKDSA-N 2 0 232.371 2.261 20 0 BEADRP CC(C)CO[C@H]1C[C@H]([NH2+]CC[C@H](C)[NH3+])C1(C)C ZINC000622045191 370678903 /nfs/dbraw/zinc/67/89/03/370678903.db2.gz GCNUALCOZHTVAF-AVGNSLFASA-N 2 0 242.407 2.153 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@H]1CCc2c1cc(F)cc2F ZINC000622045237 370678998 /nfs/dbraw/zinc/67/89/98/370678998.db2.gz JLMPELTWBGROII-SDBXPKJASA-N 2 0 240.297 2.279 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]C[C@]1(C)C[C@H]2C[C@H]2C1 ZINC000629539155 361404654 /nfs/dbraw/zinc/40/46/54/361404654.db2.gz QVUYOWHLRHKYAU-NIFZNCRKSA-N 2 0 236.403 2.400 20 0 BEADRP CC[C@H]([NH2+]CCOCCC[NH3+])c1ccccc1 ZINC000629536743 361399953 /nfs/dbraw/zinc/39/99/53/361399953.db2.gz GJVOHVRJYWISRJ-AWEZNQCLSA-N 2 0 236.359 2.093 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CCOCCC[NH3+])c2ccccc21 ZINC000629535359 361410255 /nfs/dbraw/zinc/41/02/55/361410255.db2.gz BZTOIDBNKDDIAQ-WFASDCNBSA-N 2 0 248.370 2.190 20 0 BEADRP Cc1cc([C@@H](C)[NH2+]CCOCCC[NH3+])cs1 ZINC000629535851 361411550 /nfs/dbraw/zinc/41/15/50/361411550.db2.gz DIJFGDACHCFXGS-LLVKDONJSA-N 2 0 242.388 2.073 20 0 BEADRP CC[C@H](C)[C@@H]([NH3+])C(=O)Nc1ccc([C@H](C)[NH3+])cc1 ZINC000429581590 201117655 /nfs/dbraw/zinc/11/76/55/201117655.db2.gz USDHWQPKHDGZCK-OUJBWJOFSA-N 2 0 249.358 2.018 20 0 BEADRP CC(C)C[C@H]([NH3+])C(=O)Nc1ccc([C@@H](C)[NH3+])cc1 ZINC000429578286 201118206 /nfs/dbraw/zinc/11/82/06/201118206.db2.gz SGGWSVGFBJVDFK-MFKMUULPSA-N 2 0 249.358 2.018 20 0 BEADRP C[C@H]1CC(C)(C)C[C@@H]1[NH2+][C@@H]1CC[NH2+][C@H]1C ZINC000629545688 361427104 /nfs/dbraw/zinc/42/71/04/361427104.db2.gz QAZFMBQVELFISU-YFKTTZPYSA-N 2 0 210.365 2.151 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CCCC12CC2)[C@@H]1CCC[NH2+]1 ZINC000629554275 361440079 /nfs/dbraw/zinc/44/00/79/361440079.db2.gz HGYIPMFUXMZEAZ-AGIUHOORSA-N 2 0 222.376 2.297 20 0 BEADRP FC1(F)C[C@H]2CC[C@@H](C1)[N@H+]2CC[C@@H]1CC[NH2+]C1 ZINC000629551421 361444682 /nfs/dbraw/zinc/44/46/82/361444682.db2.gz VMGODAFTHBRWHO-SDDRHHMPSA-N 2 0 244.329 2.248 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]C[C@H]1CCCC12CC2 ZINC000629555295 361446288 /nfs/dbraw/zinc/44/62/88/361446288.db2.gz UMJDUVCXDMOTPZ-IJLUTSLNSA-N 2 0 208.349 2.036 20 0 BEADRP CC(C)=CCC[C@H](C)[NH2+]CCOCCC[NH3+] ZINC000629542294 361419475 /nfs/dbraw/zinc/41/94/75/361419475.db2.gz XXMNPBACURRKEQ-ZDUSSCGKSA-N 2 0 228.380 2.076 20 0 BEADRP C[NH2+]CCOCC[N@H+](C)CC1CCCCCC1 ZINC000629571855 361463743 /nfs/dbraw/zinc/46/37/43/361463743.db2.gz KKDAWSCYZVVRGP-UHFFFAOYSA-N 2 0 242.407 2.125 20 0 BEADRP C[C@@H]1C[N@@H+]([C@@H]2CCc3ccc(F)cc32)CC[C@H]1[NH3+] ZINC000430941315 201160307 /nfs/dbraw/zinc/16/03/07/201160307.db2.gz VPRCWGIJHVLZDR-VCTAVGKDSA-N 2 0 248.345 2.482 20 0 BEADRP CCCC[N@@H+]1CC[C@H](C(F)(F)F)[C@H](C[NH3+])C1 ZINC000629567155 361457080 /nfs/dbraw/zinc/45/70/80/361457080.db2.gz WYTMXXXWRGYDPO-ZJUUUORDSA-N 2 0 238.297 2.246 20 0 BEADRP C[N@H+](CC1CCCC1)C[C@H]1CCC[NH+](C)C1 ZINC000152390221 201197397 /nfs/dbraw/zinc/19/73/97/201197397.db2.gz CZSBKJHSUQUBRG-AWEZNQCLSA-N 2 0 224.392 2.450 20 0 BEADRP CC(C)C[C@@H]([NH3+])C[NH2+]C[C@@H](C)c1ccncc1 ZINC000629656144 361561314 /nfs/dbraw/zinc/56/13/14/361561314.db2.gz OBCYOXTVMCFQCZ-TZMCWYRMSA-N 2 0 235.375 2.148 20 0 BEADRP [NH3+]CCCOCC[NH2+]CCCC1CCCCC1 ZINC000629681655 361602985 /nfs/dbraw/zinc/60/29/85/361602985.db2.gz SPKFZJPPEQXMII-UHFFFAOYSA-N 2 0 242.407 2.302 20 0 BEADRP CCC[NH+]1CCC([NH2+]C2(CC)CC2)CC1 ZINC000448552536 201244128 /nfs/dbraw/zinc/24/41/28/201244128.db2.gz FUDKNVDPWRRQPK-UHFFFAOYSA-N 2 0 210.365 2.393 20 0 BEADRP [NH3+]C1CCC([NH2+]CC2(C3CC3)CC2)CC1 ZINC000236205391 181341308 /nfs/dbraw/zinc/34/13/08/181341308.db2.gz DMABWUAHNOMVNB-UHFFFAOYSA-N 2 0 208.349 2.036 20 0 BEADRP [NH3+]C1CCC([NH2+]Cc2cc(F)cc(F)c2)CC1 ZINC000220818589 181341525 /nfs/dbraw/zinc/34/15/25/181341525.db2.gz NHXQOLLZECOTRT-UHFFFAOYSA-N 2 0 240.297 2.324 20 0 BEADRP c1cc(C[C@H]2CC[NH2+]C2)cc(C2=CC[NH2+]CC2)c1 ZINC000629723538 361664910 /nfs/dbraw/zinc/66/49/10/361664910.db2.gz OOCCITWDGHQFSN-CQSZACIVSA-N 2 0 242.366 2.215 20 0 BEADRP CC[N@H+](CCC[NH2+]C)[C@H](C)c1cccc(O)c1 ZINC000435875126 201291809 /nfs/dbraw/zinc/29/18/09/201291809.db2.gz QHHAFXQWMJRIGO-GFCCVEGCSA-N 2 0 236.359 2.385 20 0 BEADRP C[NH2+]CCC[N@@H+]1CC[C@H](c2ccc(OC)cc2)C1 ZINC000435875601 201291154 /nfs/dbraw/zinc/29/11/54/201291154.db2.gz TXQUEQXHEHPPEY-AWEZNQCLSA-N 2 0 248.370 2.094 20 0 BEADRP [NH3+]C1CCC([NH2+][C@@H]2CCOc3ccccc32)CC1 ZINC000051693376 181342623 /nfs/dbraw/zinc/34/26/23/181342623.db2.gz HKJGXWYWUITBNM-ORHYLEIMSA-N 2 0 246.354 2.370 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCC[C@@H]1Cc1ccccc1 ZINC000435871039 201289867 /nfs/dbraw/zinc/28/98/67/201289867.db2.gz ISWQWQGWRUKNOI-OAHLLOKOSA-N 2 0 232.371 2.303 20 0 BEADRP c1cc(C2=CC[NH2+]CC2)cc([C@@H]2CC[NH2+]C2)c1 ZINC000629722478 361662600 /nfs/dbraw/zinc/66/26/00/361662600.db2.gz AZGQMVSCWHBQHD-OAHLLOKOSA-N 2 0 228.339 2.140 20 0 BEADRP [NH3+]CC1(c2cccc(C3=CC[NH2+]CC3)c2)CCC1 ZINC000629722927 361663487 /nfs/dbraw/zinc/66/34/87/361663487.db2.gz HYIVGGGZMPTDGA-UHFFFAOYSA-N 2 0 242.366 2.444 20 0 BEADRP [NH3+][C@@H]1CCc2cc(C3=CC[NH2+]CC3)ccc21 ZINC000629722810 361663791 /nfs/dbraw/zinc/66/37/91/361663791.db2.gz FCVVNCJZGMDVOC-CQSZACIVSA-N 2 0 214.312 2.009 20 0 BEADRP C[NH2+]CCC[N@@H+]1CC[C@@](C)(c2ccccc2)C1 ZINC000435881151 201292360 /nfs/dbraw/zinc/29/23/60/201292360.db2.gz SRPVJXBQPZRFQD-OAHLLOKOSA-N 2 0 232.371 2.260 20 0 BEADRP C[NH2+]CCC[N@@H+]1CC[C@@H](c2ccccc2)[C@@H]1C ZINC000435879356 201293563 /nfs/dbraw/zinc/29/35/63/201293563.db2.gz JPFYYYCEZVFKEA-DZGCQCFKSA-N 2 0 232.371 2.474 20 0 BEADRP [NH3+]C1CC[NH+]([C@@H]2CCCc3ccccc32)CC1 ZINC000020521554 181344608 /nfs/dbraw/zinc/34/46/08/181344608.db2.gz DWAXSSDWUGOQTM-OAHLLOKOSA-N 2 0 230.355 2.487 20 0 BEADRP [NH3+]C1CC[NH+](Cc2ccc3ncccc3c2)CC1 ZINC000020247795 181345277 /nfs/dbraw/zinc/34/52/77/181345277.db2.gz RPQVKKJYFOQEAX-UHFFFAOYSA-N 2 0 241.338 2.158 20 0 BEADRP C[C@H](CCc1cccc(F)c1)[NH2+]CCC[NH3+] ZINC000437776280 201372872 /nfs/dbraw/zinc/37/28/72/201372872.db2.gz QRZVAADXCGZDQR-LLVKDONJSA-N 2 0 224.323 2.085 20 0 BEADRP [NH3+]CCC[NH2+][C@@H]1CCC[C@@H]1c1ccc(F)cc1 ZINC000437793046 201373454 /nfs/dbraw/zinc/37/34/54/201373454.db2.gz MSIDOQKCNOZYRK-ZIAGYGMSSA-N 2 0 236.334 2.400 20 0 BEADRP C[C@H]([NH2+][C@H]1CCc2nc[nH]c2C1)c1cncs1 ZINC000573530073 364854758 /nfs/dbraw/zinc/85/47/58/364854758.db2.gz QPTRFJOIXBEKNR-IUCAKERBSA-N 2 0 248.355 2.074 20 0 BEADRP [NH3+]CCC1CC[NH+](Cc2ccsc2)CC1 ZINC000042427726 181371850 /nfs/dbraw/zinc/37/18/50/181371850.db2.gz ABQISQQWJKSTRX-UHFFFAOYSA-N 2 0 224.373 2.309 20 0 BEADRP CC[NH+](CC)C[C@@H]1CC[N@@H+]([C@H](C)CCOC)C1 ZINC000446788795 541391266 /nfs/dbraw/zinc/39/12/66/541391266.db2.gz ZIIAFQBUEKTEAG-KGLIPLIRSA-N 2 0 242.407 2.075 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CCc1ccc(F)c(F)c1 ZINC000573711447 364898193 /nfs/dbraw/zinc/89/81/93/364898193.db2.gz TVWKJGYTLMDADS-ZJUUUORDSA-N 2 0 242.313 2.223 20 0 BEADRP [NH3+]CCCC[NH2+]Cc1cccc(Cl)c1 ZINC000037715034 181377796 /nfs/dbraw/zinc/37/77/96/181377796.db2.gz NYVRCPFBCGAQDJ-UHFFFAOYSA-N 2 0 212.724 2.169 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[NH2+][C@H](C)C1 ZINC000574191058 365006897 /nfs/dbraw/zinc/00/68/97/365006897.db2.gz ALMNGMSDWKCLKF-LPWJVIDDSA-N 2 0 210.365 2.295 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]CC2(C(F)(F)F)CC2)C1 ZINC000574415532 365059132 /nfs/dbraw/zinc/05/91/32/365059132.db2.gz YVGBSNZZCVZJCZ-RKDXNWHRSA-N 2 0 236.281 2.188 20 0 BEADRP C[N@@H+]1CCC[C@@H](CC[NH2+]CC2(C)CC2)C1 ZINC000574617155 365101980 /nfs/dbraw/zinc/10/19/80/365101980.db2.gz YVDCOPZBLNSLFZ-LBPRGKRZSA-N 2 0 210.365 2.108 20 0 BEADRP CCCOc1ccc(C[NH2+][C@H](C)CC[NH3+])cc1 ZINC000574782109 365143353 /nfs/dbraw/zinc/14/33/53/365143353.db2.gz LSXFIHVYQQLFJU-GFCCVEGCSA-N 2 0 236.359 2.302 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+][C@H]1CC[C@H](C[NH3+])C1 ZINC000574802198 365146422 /nfs/dbraw/zinc/14/64/22/365146422.db2.gz AUZSXYLOJRVUKE-RNJOBUHISA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)(C)CC[C@H](CO)[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000575195677 365237390 /nfs/dbraw/zinc/23/73/90/365237390.db2.gz RHJMVTWOEPKKJT-JHJVBQTASA-N 2 0 242.407 2.033 20 0 BEADRP C[C@H]([NH3+])c1ccc(C[NH2+]CC2(F)CC2)cc1 ZINC000575715623 365342857 /nfs/dbraw/zinc/34/28/57/365342857.db2.gz NIQFVPXPTDLFMT-JTQLQIEISA-N 2 0 222.307 2.298 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)C1C[NH2+]C1)[C@H]1CC2CCC1CC2 ZINC000575873234 365399185 /nfs/dbraw/zinc/39/91/85/365399185.db2.gz LNWMWSUZRCVKMN-ISNCYHOVSA-N 2 0 236.403 2.399 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+][C@@H]1CCC[C@H](F)C1 ZINC000575989227 365436906 /nfs/dbraw/zinc/43/69/06/365436906.db2.gz XILGATKOSNNGGP-XQHKEYJVSA-N 2 0 228.355 2.245 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@H](C)c1ccoc1 ZINC000576027217 365453163 /nfs/dbraw/zinc/45/31/63/365453163.db2.gz WAPMUEGKLKWPFK-GHMZBOCLSA-N 2 0 210.321 2.448 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](C)c1ccoc1 ZINC000576027219 365453400 /nfs/dbraw/zinc/45/34/00/365453400.db2.gz WAPMUEGKLKWPFK-QWRGUYRKSA-N 2 0 210.321 2.448 20 0 BEADRP CC(C)[C@@H]([NH2+]CCC1=CC[NH2+]CC1)C1CC1 ZINC000576027546 365453520 /nfs/dbraw/zinc/45/35/20/365453520.db2.gz PJACBCYXTYJFAN-CQSZACIVSA-N 2 0 222.376 2.320 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)CCCC[NH3+])c1ccoc1 ZINC000576027220 365453948 /nfs/dbraw/zinc/45/39/48/365453948.db2.gz WAPMUEGKLKWPFK-WDEREUQCSA-N 2 0 210.321 2.448 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@H]2CCCC(F)(F)C2)C1 ZINC000579614118 366909582 /nfs/dbraw/zinc/90/95/82/366909582.db2.gz RFPCPZNXOGYQBL-MXWKQRLJSA-N 2 0 232.318 2.424 20 0 BEADRP c1cn(CCC[NH+]2C[C@@H]3CCCC[C@H]3C2)cn1 ZINC000182829809 366948468 /nfs/dbraw/zinc/94/84/68/366948468.db2.gz USVUCRNSXKJTSR-KBPBESRZSA-N 2 0 233.359 2.395 20 0 BEADRP COc1ccc(C)cc1C[NH2+][C@H](C)C[C@@H](C)[NH3+] ZINC000579700065 366982372 /nfs/dbraw/zinc/98/23/72/366982372.db2.gz LSCUZJCISLZZIP-VXGBXAGGSA-N 2 0 236.359 2.219 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H](C)Cc1ccccc1F ZINC000579701383 366982898 /nfs/dbraw/zinc/98/28/98/366982898.db2.gz VKCVONNJZAJMIE-LBPRGKRZSA-N 2 0 238.350 2.346 20 0 BEADRP COCC[C@H](C)[NH2+]CC[C@H](C)[NH+]1CCCCC1 ZINC000184509176 367081253 /nfs/dbraw/zinc/08/12/53/367081253.db2.gz RXKYJFXLVJEERP-KBPBESRZSA-N 2 0 242.407 2.266 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H]1CCc2c1cccc2OC ZINC000580887080 367196002 /nfs/dbraw/zinc/19/60/02/367196002.db2.gz VSYCLNLFIKLHBH-CQSZACIVSA-N 2 0 248.370 2.272 20 0 BEADRP C[C@H](Cc1ccsc1)[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000581178722 367284498 /nfs/dbraw/zinc/28/44/98/367284498.db2.gz IXUWFUQMPMRMML-NEPJUHHUSA-N 2 0 238.400 2.268 20 0 BEADRP C[C@@H]1C[N@H+](C[C@@H]2CC[NH2+][C@@H](C)C2)C(C)(C)C1 ZINC000380504660 367224964 /nfs/dbraw/zinc/22/49/64/367224964.db2.gz IDPWOPIMJBAKRU-RWMBFGLXSA-N 2 0 224.392 2.495 20 0 BEADRP CC(C)C[C@H]([NH3+])C[N@@H+]1CCC2(CCC2)C1 ZINC000380523125 367228936 /nfs/dbraw/zinc/22/89/36/367228936.db2.gz UNAJXPIFLYKSDS-LBPRGKRZSA-N 2 0 210.365 2.236 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@H](C)C(C)(C)CC ZINC000581304713 367333831 /nfs/dbraw/zinc/33/38/31/367333831.db2.gz CJZLLZJOGUBTQI-GHMZBOCLSA-N 2 0 200.370 2.399 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[C@@H]([NH3+])C1)c1ccoc1 ZINC000581185197 367285409 /nfs/dbraw/zinc/28/54/09/367285409.db2.gz GIVUDSVPLZCSTI-DMDPSCGWSA-N 2 0 222.332 2.448 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000381128750 367353583 /nfs/dbraw/zinc/35/35/83/367353583.db2.gz KCKMBZCRXPGSDU-MELADBBJSA-N 2 0 224.392 2.352 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@@H]2C[C@H](C)[C@H]2C)CC1 ZINC000381382786 367391816 /nfs/dbraw/zinc/39/18/16/367391816.db2.gz LDMOLYZDDDTLHL-OUCADQQQSA-N 2 0 224.392 2.352 20 0 BEADRP Cc1cc(C[N@H+](C)CCC[NH3+])ccc1Cl ZINC000382060732 367483169 /nfs/dbraw/zinc/48/31/69/367483169.db2.gz MFILNATXRNUUJA-UHFFFAOYSA-N 2 0 226.751 2.429 20 0 BEADRP Cc1csc(C[NH2+][C@H]2CCC[C@H]([NH3+])C2)c1 ZINC000382080724 367484697 /nfs/dbraw/zinc/48/46/97/367484697.db2.gz IFOZBXQRNJDMGO-QWRGUYRKSA-N 2 0 224.373 2.416 20 0 BEADRP C[C@@H](CCc1ccco1)[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000581601942 367626080 /nfs/dbraw/zinc/62/60/80/367626080.db2.gz CBZARWSYEXKWEP-QWHCGFSZSA-N 2 0 236.359 2.332 20 0 BEADRP CCC[C@H](C)[C@@H]1CCC[N@@H+]1CCC[NH2+]C ZINC000581612323 367634816 /nfs/dbraw/zinc/63/48/16/367634816.db2.gz LVGZUFLGDTUUPD-STQMWFEESA-N 2 0 212.381 2.497 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+][C@H](C)CC(C)(C)C ZINC000384569653 367700879 /nfs/dbraw/zinc/70/08/79/367700879.db2.gz UPCXCVRVJFXVCN-NEPJUHHUSA-N 2 0 230.396 2.155 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+][C@@H](C)CC(C)(C)C ZINC000384569654 367701040 /nfs/dbraw/zinc/70/10/40/367701040.db2.gz UPCXCVRVJFXVCN-NWDGAFQWSA-N 2 0 230.396 2.155 20 0 BEADRP CC(C)[N@H+](CC[C@@H]1CC[NH2+]C1)Cc1ccccn1 ZINC000581669881 367701043 /nfs/dbraw/zinc/70/10/43/367701043.db2.gz KMAPYKWHVXPQAV-AWEZNQCLSA-N 2 0 247.386 2.292 20 0 BEADRP C[C@H](CC(C)(C)C)[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000384512706 367694920 /nfs/dbraw/zinc/69/49/20/367694920.db2.gz HOXLCTAGFRESIV-VXGBXAGGSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H](CC(C)(C)C)[NH2+]CC1CC[NH2+]CC1 ZINC000384533084 367697490 /nfs/dbraw/zinc/69/74/90/367697490.db2.gz MQROYJWGIUSVNX-NSHDSACASA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCC[NH+]2CCCCC2)[C@@H](C)O1 ZINC000385004771 367770743 /nfs/dbraw/zinc/77/07/43/367770743.db2.gz WEJBSAMKUBYYPR-MGPQQGTHSA-N 2 0 240.391 2.018 20 0 BEADRP CC/C=C\C[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@@H]1C ZINC000384866944 367745710 /nfs/dbraw/zinc/74/57/10/367745710.db2.gz NZEHXOUCVMZTQD-LECYDYFVSA-N 2 0 210.365 2.271 20 0 BEADRP C[C@H](CCCO)C[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000384661495 367713356 /nfs/dbraw/zinc/71/33/56/367713356.db2.gz BHHYIPFWWQTSEQ-BYCMXARLSA-N 2 0 248.370 2.129 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+]CC(C)(C)C1CCC1 ZINC000385029098 367775196 /nfs/dbraw/zinc/77/51/96/367775196.db2.gz KDRMTSFBILEEIL-CYBMUJFWSA-N 2 0 242.407 2.156 20 0 BEADRP COc1ccc(CN(C)C2(C[NH3+])CCC2)cc1C ZINC000385305156 367817244 /nfs/dbraw/zinc/81/72/44/367817244.db2.gz KNURTAWLXCPTIE-UHFFFAOYSA-N 2 0 248.370 2.317 20 0 BEADRP CCN(C)CC[NH2+]C1CCC(CSC)CC1 ZINC000385410762 367826700 /nfs/dbraw/zinc/82/67/00/367826700.db2.gz GIQXTUWHLIZBTL-UHFFFAOYSA-N 2 0 244.448 2.450 20 0 BEADRP CC[N@H+](CCC1CC1)C[C@H]1CC[NH2+][C@H](C)C1 ZINC000385489135 367835335 /nfs/dbraw/zinc/83/53/35/367835335.db2.gz DXBFFHYIWKLTDL-OCCSQVGLSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]([NH2+]C[C@@]1(C)CCCS1)[C@H]1CCCC[NH2+]1 ZINC000386536707 367988657 /nfs/dbraw/zinc/98/86/57/367988657.db2.gz CBVUJVZQMCDJAY-YNEHKIRRSA-N 2 0 242.432 2.392 20 0 BEADRP C[C@@H]([NH2+]CC1CCSCC1)[C@@H]1CCCC[NH2+]1 ZINC000386567245 367993438 /nfs/dbraw/zinc/99/34/38/367993438.db2.gz KNPUPANPQBIODX-YPMHNXCESA-N 2 0 242.432 2.250 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(C[NH3+])cc2)[C@@H]1C ZINC000386310584 367948910 /nfs/dbraw/zinc/94/89/10/367948910.db2.gz WUBYWVCJZGWWMD-JTNHKYCSSA-N 2 0 218.344 2.279 20 0 BEADRP CC(C)COCCC[NH2+][C@H](C)[C@@H]1CCCC[NH2+]1 ZINC000386489162 367980405 /nfs/dbraw/zinc/98/04/05/367980405.db2.gz UDBCZNNMQBMIBI-KGLIPLIRSA-N 2 0 242.407 2.169 20 0 BEADRP C[NH+](C)CCCC(C)(C)[NH2+]Cc1ccncc1 ZINC000387339189 368157896 /nfs/dbraw/zinc/15/78/96/368157896.db2.gz PUKNSYBYORZLFM-UHFFFAOYSA-N 2 0 235.375 2.292 20 0 BEADRP CC[NH+](CC)CCC[NH2+]C[C@@H]1C[C@H]2C[C@H]2C1 ZINC000252876463 368165704 /nfs/dbraw/zinc/16/57/04/368165704.db2.gz WHDYLHJCEVOLHK-BTTYYORXSA-N 2 0 224.392 2.354 20 0 BEADRP Cn1cccc1C[NH2+]C(C)(C)CCC[NH+](C)C ZINC000387302515 368146214 /nfs/dbraw/zinc/14/62/14/368146214.db2.gz KCVIQNHZIQWFBR-UHFFFAOYSA-N 2 0 237.391 2.235 20 0 BEADRP Cc1cc(C)c(C[N@H+](C)CCC[NH3+])cc1C ZINC000084493739 368857025 /nfs/dbraw/zinc/85/70/25/368857025.db2.gz ACPNKOKIXFXYBU-UHFFFAOYSA-N 2 0 220.360 2.392 20 0 BEADRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]CC(C1CC1)C1CC1 ZINC000084223067 368851204 /nfs/dbraw/zinc/85/12/04/368851204.db2.gz PXJDILBAPPDSFW-TZMCWYRMSA-N 2 0 222.376 2.140 20 0 BEADRP CC[C@@H](C)C[NH2+]C[C@H]1CCCC[N@H+](C)C1 ZINC000623657778 368998866 /nfs/dbraw/zinc/99/88/66/368998866.db2.gz YXPRIKOCMUWOGH-CHWSQXEVSA-N 2 0 212.381 2.354 20 0 BEADRP [NH3+][C@@H]1CCCC[C@H]1[NH2+]C[C@H]1CCC(F)(F)C1 ZINC000631829397 369005616 /nfs/dbraw/zinc/00/56/16/369005616.db2.gz PROHAYICPURBFD-HBNTYKKESA-N 2 0 232.318 2.281 20 0 BEADRP Cc1cc(C)c(CN2C[C@H](C)[NH2+]C[C@H]2C)c(C)n1 ZINC000631827502 368994790 /nfs/dbraw/zinc/99/47/90/368994790.db2.gz PLTCGBYRSYWGAG-QWHCGFSZSA-N 2 0 247.386 2.189 20 0 BEADRP CCc1ccc(CC[N@H+]2C[C@@H](C[NH3+])[C@H](C)C2)cc1 ZINC000631840942 369340448 /nfs/dbraw/zinc/34/04/48/369340448.db2.gz WQTONGNTXKWMFM-CZUORRHYSA-N 2 0 246.398 2.318 20 0 BEADRP C[C@@H]1C[N@H+](CCCc2ccccc2)C[C@H]1C[NH3+] ZINC000631843098 369373232 /nfs/dbraw/zinc/37/32/32/369373232.db2.gz JGCWODWIDVAGJA-UKRRQHHQSA-N 2 0 232.371 2.146 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]Cc2ccc3c[nH+]cn3c2)[C@@H]1C ZINC000459658440 203330440 /nfs/dbraw/zinc/33/04/40/203330440.db2.gz KILSAFUVWOLYPR-GYSYKLTISA-N 2 0 229.327 2.468 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc3c[nH+]cn3c2)[C@@H]1C ZINC000459658442 203331574 /nfs/dbraw/zinc/33/15/74/203331574.db2.gz KILSAFUVWOLYPR-JTNHKYCSSA-N 2 0 229.327 2.468 20 0 BEADRP C[N@@H+]1CCC[C@H](CC[NH2+][C@H]2CCCSC2)C1 ZINC000459724464 203343296 /nfs/dbraw/zinc/34/32/96/203343296.db2.gz DSTOYNDQZPDNJP-OLZOCXBDSA-N 2 0 242.432 2.204 20 0 BEADRP C[N@@H+]1CCC[C@@H](CC[NH2+]C2CCSCC2)C1 ZINC000459730502 203344346 /nfs/dbraw/zinc/34/43/46/203344346.db2.gz KJIDKMZBMZUUBH-LBPRGKRZSA-N 2 0 242.432 2.204 20 0 BEADRP C[N@@H+]1CCC[C@@H](CC[NH2+]Cc2ccco2)C1 ZINC000459731311 203345236 /nfs/dbraw/zinc/34/52/36/203345236.db2.gz LKRNUWPVKGHLLU-LBPRGKRZSA-N 2 0 222.332 2.101 20 0 BEADRP CCSCC[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC000459732361 203345280 /nfs/dbraw/zinc/34/52/80/203345280.db2.gz FUHXCPAECHWHGK-GFCCVEGCSA-N 2 0 230.421 2.061 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)c1ccccn1 ZINC000459737339 203347784 /nfs/dbraw/zinc/34/77/84/203347784.db2.gz QYFSBWACOJJVCO-UONOGXRCSA-N 2 0 247.386 2.464 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC000459795985 203372825 /nfs/dbraw/zinc/37/28/25/203372825.db2.gz VRKWLJLPCUYNJB-JSGCOSHPSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)OC[C@@H](C)[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC000459783999 203367581 /nfs/dbraw/zinc/36/75/81/203367581.db2.gz NSWPMSRNVOFYRG-KGLIPLIRSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)C1CCC1 ZINC000459787785 203371643 /nfs/dbraw/zinc/37/16/43/203371643.db2.gz PZDWDJMEJQYKSN-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP CCC1CC([NH2+]CC[C@H]2CCC[N@H+](C)C2)C1 ZINC000459798407 203372380 /nfs/dbraw/zinc/37/23/80/203372380.db2.gz XQAGILBFSYVHQG-ROKHWSDSSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1)C1CC1 ZINC000165542948 203385427 /nfs/dbraw/zinc/38/54/27/203385427.db2.gz MKZKTHNKXUDWNL-UHTWSYAYSA-N 2 0 210.365 2.247 20 0 BEADRP CCSCC[N@@H+]1CCC[C@H]([C@H]2CCC[NH2+]2)C1 ZINC000252719758 370120068 /nfs/dbraw/zinc/12/00/68/370120068.db2.gz IVAVKVLVWCGJDV-QWHCGFSZSA-N 2 0 242.432 2.204 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]CC2CC(C)C2)CC1 ZINC000621739513 370497082 /nfs/dbraw/zinc/49/70/82/370497082.db2.gz LLWVBVCPWOOQIR-UHFFFAOYSA-N 2 0 224.392 2.495 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CC2CC(C)C2)[C@@H](C)C1 ZINC000621739717 370497220 /nfs/dbraw/zinc/49/72/20/370497220.db2.gz UHDXQWVWWIRZHZ-YIOUJQMASA-N 2 0 224.392 2.352 20 0 BEADRP C[NH2+]CCC1CC[NH+](Cc2ccnc(C)c2)CC1 ZINC000621774979 370521694 /nfs/dbraw/zinc/52/16/94/370521694.db2.gz BXLRWYRHUQQWHV-UHFFFAOYSA-N 2 0 247.386 2.212 20 0 BEADRP Cc1ccc(CC[N@@H+]2C[C@H]3CCC[C@@]3([NH3+])C2)cc1 ZINC000621782845 370531734 /nfs/dbraw/zinc/53/17/34/370531734.db2.gz TVGOQMRIPVEGAX-HZPDHXFCSA-N 2 0 244.382 2.351 20 0 BEADRP [NH3+][C@]12CCC[C@H]1C[N@H+](CCCC1CCC1)C2 ZINC000621783465 370533521 /nfs/dbraw/zinc/53/35/21/370533521.db2.gz BXRYMNLCFPGMPP-KBPBESRZSA-N 2 0 222.376 2.380 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H](C)[C@H]1CCCCO1 ZINC000623849221 371124623 /nfs/dbraw/zinc/12/46/23/371124623.db2.gz ZNTBMMKWRHFQPK-UONOGXRCSA-N 2 0 242.407 2.266 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@H](C)[C@@H]1CCCCO1 ZINC000623858808 371129560 /nfs/dbraw/zinc/12/95/60/371129560.db2.gz WOMFMHBBQFCXKY-KGLIPLIRSA-N 2 0 242.407 2.264 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)C1CCC1 ZINC000624121367 371323330 /nfs/dbraw/zinc/32/33/30/371323330.db2.gz UTCUETFJAMOVIR-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP COC(C)(C)[C@H](C)[NH2+]C[C@@H]1CCCC[N@H+](C)C1 ZINC000624123198 371324581 /nfs/dbraw/zinc/32/45/81/371324581.db2.gz HSICNQFWVAIFLH-STQMWFEESA-N 2 0 242.407 2.121 20 0 BEADRP C[N@@H+]1CCCC[C@H](C[NH2+][C@@H]2CCC2(C)C)C1 ZINC000624123392 371325070 /nfs/dbraw/zinc/32/50/70/371325070.db2.gz LCPHBRXYOJQBIG-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP CCC(F)(F)C[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000624148180 371344189 /nfs/dbraw/zinc/34/41/89/371344189.db2.gz XSILGPAAKCRFQO-JTQLQIEISA-N 2 0 234.334 2.352 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1cn[nH]c1 ZINC000624211339 371397748 /nfs/dbraw/zinc/39/77/48/371397748.db2.gz YAOALRLUVFOWEH-LBPRGKRZSA-N 2 0 238.379 2.010 20 0 BEADRP C[C@H]1OCC[C@H]1[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000134203391 372179681 /nfs/dbraw/zinc/17/96/81/372179681.db2.gz YFFZSPSKQKTXJO-DGCLKSJQSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@H]([NH2+]CC(C)(C)F)C1CC[NH+](C)CC1 ZINC000631658124 372484621 /nfs/dbraw/zinc/48/46/21/372484621.db2.gz IZNUYUPGNSSFRC-JTQLQIEISA-N 2 0 216.344 2.054 20 0 BEADRP Cc1cc(C)c(C[N@H+]2CC[C@H]([NH3+])C[C@H]2C)c(C)n1 ZINC000631829361 372610488 /nfs/dbraw/zinc/61/04/88/372610488.db2.gz OTKUWJCLZGCBDU-OCCSQVGLSA-N 2 0 247.386 2.318 20 0 BEADRP C[C@H](c1ccccn1)N1CCCCC[C@@H]([NH3+])C1 ZINC000631834279 372618222 /nfs/dbraw/zinc/61/82/22/372618222.db2.gz UBYWLOYZHIJNRQ-CHWSQXEVSA-N 2 0 233.359 2.346 20 0 BEADRP C[C@@H](c1cccnc1)N1CCCCC[C@H]([NH3+])C1 ZINC000631834446 372619021 /nfs/dbraw/zinc/61/90/21/372619021.db2.gz XJTUKVPYGJJBHC-JSGCOSHPSA-N 2 0 233.359 2.346 20 0 BEADRP C[C@H](c1ccccn1)N1CCCCC[C@H]([NH3+])C1 ZINC000631834280 372619247 /nfs/dbraw/zinc/61/92/47/372619247.db2.gz UBYWLOYZHIJNRQ-OLZOCXBDSA-N 2 0 233.359 2.346 20 0 BEADRP FCCC1CC[NH+](CCC2CC[NH2+]CC2)CC1 ZINC000631836693 372625012 /nfs/dbraw/zinc/62/50/12/372625012.db2.gz FCVDUHIYQQCMLC-UHFFFAOYSA-N 2 0 242.382 2.448 20 0 BEADRP C[C@@H]1C[N@@H+]([C@H]2CCc3ccc(F)cc32)C[C@H]1C[NH3+] ZINC000631839208 372633753 /nfs/dbraw/zinc/63/37/53/372633753.db2.gz BXJCUHVVGDPCLF-HCKVZZMMSA-N 2 0 248.345 2.340 20 0 BEADRP C[C@H](c1ccc(F)cc1)[N@H+]1C[C@@H](C[NH3+])[C@H](C)C1 ZINC000631839553 372636717 /nfs/dbraw/zinc/63/67/17/372636717.db2.gz HRABYVDZHUTUSH-NQBHXWOUSA-N 2 0 236.334 2.413 20 0 BEADRP C[C@H]1C[N@H+](Cc2ccccc2Cl)C[C@H]1C[NH3+] ZINC000631844026 372643025 /nfs/dbraw/zinc/64/30/25/372643025.db2.gz DXBHQLGCDSWKSM-CMPLNLGQSA-N 2 0 238.762 2.367 20 0 BEADRP FC1(F)CC[C@@H](C[NH2+][C@]23CCC[C@@H]2C[NH2+]C3)C1 ZINC000631867048 372667718 /nfs/dbraw/zinc/66/77/18/372667718.db2.gz HSQORMPDDCARKV-UTUOFQBUSA-N 2 0 244.329 2.154 20 0 BEADRP [NH3+]CCC[N@@H+]1CCC[C@H](C2CCC2)CC1 ZINC000631873985 372675512 /nfs/dbraw/zinc/67/55/12/372675512.db2.gz XGGYWHUOFKLZNG-ZDUSSCGKSA-N 2 0 210.365 2.237 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCC[C@@H]2C[NH2+]CC[C@@H]21 ZINC000631887536 372681168 /nfs/dbraw/zinc/68/11/68/372681168.db2.gz NVKONUTZIAXXLH-XQQFMLRXSA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCC[C@H]2C[NH2+]CC[C@@H]21 ZINC000631887534 372681386 /nfs/dbraw/zinc/68/13/86/372681386.db2.gz NVKONUTZIAXXLH-AVGNSLFASA-N 2 0 210.365 2.106 20 0 BEADRP COCC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCCC[C@H]1[NH3+] ZINC000424378986 206038299 /nfs/dbraw/zinc/03/82/99/206038299.db2.gz UUFJQBUOTYYZPN-RFQIPJPRSA-N 2 0 240.391 2.051 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+][C@@H]1CCCC[C@H]1[NH3+] ZINC000424377710 206040572 /nfs/dbraw/zinc/04/05/72/206040572.db2.gz RPGOEUYSUWYVQF-UMSGYPCISA-N 2 0 210.365 2.281 20 0 BEADRP CCOCC(C)(C)C[NH2+][C@H](C)CCCC[NH3+] ZINC000336644868 170352680 /nfs/dbraw/zinc/35/26/80/170352680.db2.gz COLCRZYIQJIFOI-GFCCVEGCSA-N 2 0 230.396 2.156 20 0 BEADRP CCOCC[N@H+](CC)CCCC1CC[NH2+]CC1 ZINC000104200655 170394627 /nfs/dbraw/zinc/39/46/27/170394627.db2.gz QISLDBVYTJEKRZ-UHFFFAOYSA-N 2 0 242.407 2.125 20 0 BEADRP CCC[N@H+](CCc1cccnc1)C1CC[NH2+]CC1 ZINC000063223630 169169827 /nfs/dbraw/zinc/16/98/27/169169827.db2.gz CUPHJANUAWZFBO-UHFFFAOYSA-N 2 0 247.386 2.088 20 0 BEADRP CCC[NH+]1CCC([NH2+]C[C@H](C)CC)CC1 ZINC000020190101 169188165 /nfs/dbraw/zinc/18/81/65/169188165.db2.gz CODHJBGKQPQXKH-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H]2C[C@@H](C)[C@@H]2C)CC1 ZINC000309428906 169189146 /nfs/dbraw/zinc/18/91/46/169189146.db2.gz YWQOZTAOPPLOIS-MBNYWOFBSA-N 2 0 224.392 2.495 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H](C)COC(C)C)CC1 ZINC000337337855 169189412 /nfs/dbraw/zinc/18/94/12/169189412.db2.gz NEVPHWVJLFNPCB-CYBMUJFWSA-N 2 0 242.407 2.264 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H](C)C(C)C)CC1 ZINC000020189761 169190446 /nfs/dbraw/zinc/19/04/46/169190446.db2.gz KRXRSZZRQWLKMB-GFCCVEGCSA-N 2 0 212.381 2.495 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+]C2CCCC2)C1 ZINC000076453756 169206179 /nfs/dbraw/zinc/20/61/79/169206179.db2.gz BUPFBXZFKMQSLA-GFCCVEGCSA-N 2 0 210.365 2.251 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2ccncc2C)C1 ZINC000296599215 169207996 /nfs/dbraw/zinc/20/79/96/169207996.db2.gz YGGQFNCROPDQOX-CQSZACIVSA-N 2 0 247.386 2.212 20 0 BEADRP c1cc(C[NH2+]CCCCC[NH+]2CCCC2)c[nH]1 ZINC000293062921 183349817 /nfs/dbraw/zinc/34/98/17/183349817.db2.gz SJNBWUWPMGBQOZ-UHFFFAOYSA-N 2 0 235.375 2.370 20 0 BEADRP CCC[N@H+]1C[C@@H]2C[NH+](Cc3ccccc3)C[C@@H]2C1 ZINC000280325854 169210904 /nfs/dbraw/zinc/21/09/04/169210904.db2.gz GZIULWRJHNMFMH-IYBDPMFKSA-N 2 0 244.382 2.460 20 0 BEADRP c1cc2c(o1)CCC[C@@H]2[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000132036037 183372316 /nfs/dbraw/zinc/37/23/16/183372316.db2.gz YZQVWJPQYVNPHK-AAEUAGOBSA-N 2 0 234.343 2.246 20 0 BEADRP c1cc2c(s1)C[N@H+](CC1CC[NH2+]CC1)CC2 ZINC000297427855 183373488 /nfs/dbraw/zinc/37/34/88/183373488.db2.gz OXCZMHGSJHCEEN-UHFFFAOYSA-N 2 0 236.384 2.106 20 0 BEADRP c1cc2c(o1)CCC[C@H]2[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000132035817 183373577 /nfs/dbraw/zinc/37/35/77/183373577.db2.gz YZQVWJPQYVNPHK-WCQYABFASA-N 2 0 234.343 2.246 20 0 BEADRP c1ccc(C[NH+]2CCC([C@H]3CCC[NH2+]3)CC2)nc1 ZINC000063197614 183396510 /nfs/dbraw/zinc/39/65/10/183396510.db2.gz HWSQKZUHRCRALA-OAHLLOKOSA-N 2 0 245.370 2.046 20 0 BEADRP c1ccc2c(c1)CC[C@H]([NH2+]C[C@H]1CCC[NH2+]C1)C2 ZINC000132241770 183445795 /nfs/dbraw/zinc/44/57/95/183445795.db2.gz KUATWQTZEKAICM-BBRMVZONSA-N 2 0 244.382 2.133 20 0 BEADRP CCC[C@@H](C)[NH2+]CCN1CC=C(C)CC1 ZINC000309089834 169369667 /nfs/dbraw/zinc/36/96/67/169369667.db2.gz BTWSAFZSLOMOQU-CYBMUJFWSA-N 2 0 210.365 2.417 20 0 BEADRP CCC[C@@H](C)C[N@H+](C)[C@H]1CCC[NH2+]CC1 ZINC000300215116 169357785 /nfs/dbraw/zinc/35/77/85/169357785.db2.gz KPBLXDDUQMBHBY-OLZOCXBDSA-N 2 0 212.381 2.497 20 0 BEADRP CCC[C@@H](CC)[NH2+]C[C@H]1CC[N@H+](CC)C1 ZINC000125230886 169379784 /nfs/dbraw/zinc/37/97/84/169379784.db2.gz DOHFINOLJHAOKA-CHWSQXEVSA-N 2 0 212.381 2.497 20 0 BEADRP CC[C@H](C)[C@@H](C)[N@@H+]1C[C@H]2CC[NH+](C)C[C@H]2C1 ZINC001644099394 1172527234 /nfs/dbraw/zinc/52/72/34/1172527234.db2.gz PICIYNDEBMLFQJ-DGAVXFQQSA-N 2 0 224.392 2.305 20 0 BEADRP C(CC[NH+]1CCCC1)CC[NH+]1CCCC1 ZINC000059442068 1172535838 /nfs/dbraw/zinc/53/58/38/1172535838.db2.gz MCZFWDXGAIOXCO-UHFFFAOYSA-N 2 0 210.365 2.348 20 0 BEADRP CC(C)(C)CC[N@@H+]1CCC[C@H](CC[NH3+])C1 ZINC000069626399 383833278 /nfs/dbraw/zinc/83/32/78/383833278.db2.gz KMRQHWDTQAQZKV-GFCCVEGCSA-N 2 0 212.381 2.483 20 0 BEADRP C[C@H](Cc1cccs1)[NH2+][C@@H]1CC[C@@H](C[NH3+])C1 ZINC000643542623 383981661 /nfs/dbraw/zinc/98/16/61/383981661.db2.gz SKNPIDJQVFTGRZ-IJLUTSLNSA-N 2 0 238.400 2.396 20 0 BEADRP [NH3+]CC[C@H]1CCCC[N@@H+]1CCC(F)(F)F ZINC000070914867 383959528 /nfs/dbraw/zinc/95/95/28/383959528.db2.gz UUSXFYLDWDXHOQ-SECBINFHSA-N 2 0 224.270 2.142 20 0 BEADRP CC[NH+](CC)CCC[NH2+]CC1CCSCC1 ZINC000401776390 383976411 /nfs/dbraw/zinc/97/64/11/383976411.db2.gz ZCSKWZPGTOINOF-UHFFFAOYSA-N 2 0 244.448 2.451 20 0 BEADRP CCN1CC[C@H]2CC[C@@H](C1)[N@@H+]2CC1CCC1 ZINC000335846793 384003876 /nfs/dbraw/zinc/00/38/76/384003876.db2.gz BYWKOAZLGMNXHZ-KGLIPLIRSA-N 2 0 222.376 2.345 20 0 BEADRP CC1(C)CC[C@H]1[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000643547195 384033418 /nfs/dbraw/zinc/03/34/18/384033418.db2.gz AYWABYHZASYTHH-NWDGAFQWSA-N 2 0 222.376 2.439 20 0 BEADRP CO[C@@H](C[NH2+]C(C)(C)CCC[NH+](C)C)C1CC1 ZINC000400268406 384039375 /nfs/dbraw/zinc/03/93/75/384039375.db2.gz LKYOPGYJSHZKTC-ZDUSSCGKSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)[C@H]1C[C@H]1C ZINC000643549013 384040406 /nfs/dbraw/zinc/04/04/06/384040406.db2.gz YYMQXTFLMZFURU-VOAKCMCISA-N 2 0 222.376 2.295 20 0 BEADRP CC[C@@H](C)[NH+]1CCC2(CCC[N@@H+]2C)CC1 ZINC000336529251 384067927 /nfs/dbraw/zinc/06/79/27/384067927.db2.gz JPNFNRUQYHCZEX-GFCCVEGCSA-N 2 0 210.365 2.345 20 0 BEADRP CC(C)[C@@H]1CC[N@H+](CC[C@@H]2CCC[NH2+]C2)C1 ZINC000163615912 384097761 /nfs/dbraw/zinc/09/77/61/384097761.db2.gz RRBARWFKRLEQNM-UONOGXRCSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H]([NH3+])[C@H]1CC[N@H+](Cc2ccc3c(c2)CCC3)C1 ZINC000163243120 384189810 /nfs/dbraw/zinc/18/98/10/384189810.db2.gz IIJKKCIRIWDQBE-WBMJQRKESA-N 2 0 244.382 2.344 20 0 BEADRP C[C@H]([NH2+]CCC1CC[NH+](C)CC1)c1cccnc1 ZINC000092746294 384191644 /nfs/dbraw/zinc/19/16/44/384191644.db2.gz ZWVGVKJPVVBCRW-ZDUSSCGKSA-N 2 0 247.386 2.464 20 0 BEADRP [NH3+]CCCC[NH2+][C@@H]1CCC[C@H](C2CC2)C1 ZINC000081635522 384193186 /nfs/dbraw/zinc/19/31/86/384193186.db2.gz MECRISAHVXUBEQ-QWHCGFSZSA-N 2 0 210.365 2.284 20 0 BEADRP CCc1ccc(C[N@@H+]2CC[C@@H]([C@@H](C)[NH3+])C2)cc1 ZINC000163260263 384195482 /nfs/dbraw/zinc/19/54/82/384195482.db2.gz XINJRGVYNJBMMG-IUODEOHRSA-N 2 0 232.371 2.418 20 0 BEADRP CCC(CC)C[NH+]1CCC([C@H](C)[NH3+])CC1 ZINC000082474677 384232236 /nfs/dbraw/zinc/23/22/36/384232236.db2.gz PTDXHWITGRUOAG-NSHDSACASA-N 2 0 212.381 2.482 20 0 BEADRP C[N@@H+](Cc1ccco1)CC1CC[NH+](C)CC1 ZINC000093088609 384210496 /nfs/dbraw/zinc/21/04/96/384210496.db2.gz XKNUASRDRUWVAN-UHFFFAOYSA-N 2 0 222.332 2.053 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H]1CC(C)(C)C[C@H]1C ZINC000569566729 384251196 /nfs/dbraw/zinc/25/11/96/384251196.db2.gz YCRKMSKFPDCVOF-NEPJUHHUSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H]([NH3+])[C@H]1CCC[N@H+](CC2CCCC2)C1 ZINC000082645632 384254544 /nfs/dbraw/zinc/25/45/44/384254544.db2.gz YACRAAHCUORGQV-AAEUAGOBSA-N 2 0 210.365 2.236 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](CCc3ccccc3)C[C@H]21 ZINC000228471933 384257167 /nfs/dbraw/zinc/25/71/67/384257167.db2.gz JJPZCAXYXGHNLE-BZUAXINKSA-N 2 0 244.382 2.288 20 0 BEADRP CN(CC[C@@H]1CCCC[N@@H+]1C)Cc1ccn(C)c1 ZINC000093660008 384257760 /nfs/dbraw/zinc/25/77/60/384257760.db2.gz DURGPPWIKFIECY-HNNXBMFYSA-N 2 0 249.402 2.331 20 0 BEADRP C[C@H]([NH2+]C[C@H]1Cc2ccccc21)[C@@H]1CCC[NH2+]1 ZINC000400444313 384277761 /nfs/dbraw/zinc/27/77/61/384277761.db2.gz PEOKZEDOZXISFR-LNSITVRQSA-N 2 0 230.355 2.056 20 0 BEADRP C[N@H+](CC1CCC1)C[C@@H]1CCC[NH+](C)C1 ZINC000173791768 384263396 /nfs/dbraw/zinc/26/33/96/384263396.db2.gz MUWSTYFZMZBCRY-CYBMUJFWSA-N 2 0 210.365 2.060 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]C[C@@H]2CCSC2)c2ccccc21 ZINC000228555329 384276226 /nfs/dbraw/zinc/27/62/26/384276226.db2.gz HVTRAKQEGALVOG-ZLKJLUDKSA-N 2 0 248.395 2.474 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]CC1(C2CC2)CC1 ZINC000236260768 384301159 /nfs/dbraw/zinc/30/11/59/384301159.db2.gz VSPMZFKYJCZFRG-AAEUAGOBSA-N 2 0 222.376 2.284 20 0 BEADRP C[C@H]([NH2+]CCCC[NH+](C)C)c1ccncc1 ZINC000045663317 384403900 /nfs/dbraw/zinc/40/39/00/384403900.db2.gz HMFLYHWZXBTQJQ-LBPRGKRZSA-N 2 0 221.348 2.074 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@@H](C)[C@@H](C[NH3+])C2)s1 ZINC000229060639 384414413 /nfs/dbraw/zinc/41/44/13/384414413.db2.gz CNHUWTXKMZMZPT-PWSUYJOCSA-N 2 0 238.400 2.473 20 0 BEADRP CC(C)C1([NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)CC1 ZINC000334195351 384389343 /nfs/dbraw/zinc/38/93/43/384389343.db2.gz KFACJIPGTSLVCL-OLZOCXBDSA-N 2 0 222.376 2.391 20 0 BEADRP CC[C@H](C)[N@@H+]1CC[C@H](C[NH+](CC)CC)C1 ZINC000181134030 384456974 /nfs/dbraw/zinc/45/69/74/384456974.db2.gz NBMUDDKVYMFFPT-QWHCGFSZSA-N 2 0 212.381 2.449 20 0 BEADRP [NH3+]C[C@@H]1CCCN1C/C=C/c1ccccc1 ZINC000144681255 384439690 /nfs/dbraw/zinc/43/96/90/384439690.db2.gz OLXSIFMDQTZGKU-PXYYCUNGSA-N 2 0 216.328 2.123 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@H]2CCOC2(C)C)CC1 ZINC000335661846 384466998 /nfs/dbraw/zinc/46/69/98/384466998.db2.gz WSSPTHJNADYOBG-ZDUSSCGKSA-N 2 0 240.391 2.016 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H]2CC=C(C)CC2)C1 ZINC000556816632 384504185 /nfs/dbraw/zinc/50/41/85/384504185.db2.gz FMIXTCSQHNRAQL-UONOGXRCSA-N 2 0 222.376 2.417 20 0 BEADRP C[NH+]1CCC(C[NH2+]C2CCC(F)(F)CC2)CC1 ZINC000647180247 384534987 /nfs/dbraw/zinc/53/49/87/384534987.db2.gz OZYGMOZPLRTACJ-UHFFFAOYSA-N 2 0 246.345 2.496 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+]CCCC[NH3+])cc1 ZINC000037714765 384512529 /nfs/dbraw/zinc/51/25/29/384512529.db2.gz DGLYTQFAYYOJIC-GFCCVEGCSA-N 2 0 206.333 2.385 20 0 BEADRP CC1=CC[C@@H]([NH2+]CCN2CC[C@@H](C)C2)CC1 ZINC000556833868 384515258 /nfs/dbraw/zinc/51/52/58/384515258.db2.gz NWBACSFLSNBBEM-ZIAGYGMSSA-N 2 0 222.376 2.417 20 0 BEADRP CN1CCC[C@@H]1C[NH2+]Cc1cc(F)cc(F)c1 ZINC000160982390 384516165 /nfs/dbraw/zinc/51/61/65/384516165.db2.gz RGULHKCAVOWEQG-CYBMUJFWSA-N 2 0 240.297 2.149 20 0 BEADRP CO[C@@H](C)[C@H](C)[NH2+]C1CC[NH+](CC(C)C)CC1 ZINC000358016562 384516877 /nfs/dbraw/zinc/51/68/77/384516877.db2.gz GSVMZWVJFGBLQW-STQMWFEESA-N 2 0 242.407 2.120 20 0 BEADRP C[NH+](C)CCC[NH2+][C@H]1CCc2ccccc21 ZINC000019958638 384563217 /nfs/dbraw/zinc/56/32/17/384563217.db2.gz NQIVXZPDSVJSHK-AWEZNQCLSA-N 2 0 218.344 2.215 20 0 BEADRP CC[N@H+](CC[C@H]1CC[NH2+]C1)CCC(F)(F)F ZINC000643057515 384561283 /nfs/dbraw/zinc/56/12/83/384561283.db2.gz LREKDWNPPDKDJB-SNVBAGLBSA-N 2 0 238.297 2.260 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@H]2CCC(F)(F)C2)C[C@H]1C[NH3+] ZINC000306053641 384568567 /nfs/dbraw/zinc/56/85/67/384568567.db2.gz WXWNKODGXHLZMY-GRYCIOLGSA-N 2 0 246.345 2.339 20 0 BEADRP CC[C@@](C)(C[NH2+]C[C@H]1CC[N@@H+](C(C)C)C1)OC ZINC000319894243 384572790 /nfs/dbraw/zinc/57/27/90/384572790.db2.gz PJQSRSISNFXFPI-KGLIPLIRSA-N 2 0 242.407 2.121 20 0 BEADRP C(C1CCCCC1)[N@@H+]1CC[C@H]2CC[NH2+][C@@H]2C1 ZINC000643065748 384580681 /nfs/dbraw/zinc/58/06/81/384580681.db2.gz FRZCFKWPZVTQNQ-ZIAGYGMSSA-N 2 0 222.376 2.251 20 0 BEADRP Cc1cccc(CC[NH2+][C@@H](C)CCCC[NH3+])n1 ZINC000423084714 384565152 /nfs/dbraw/zinc/56/51/52/384565152.db2.gz IPAIQGBSLHCRSA-LBPRGKRZSA-N 2 0 235.375 2.040 20 0 BEADRP Cc1cccc(CC[NH2+][C@H](C)CCCC[NH3+])n1 ZINC000423084613 384566644 /nfs/dbraw/zinc/56/66/44/384566644.db2.gz IPAIQGBSLHCRSA-GFCCVEGCSA-N 2 0 235.375 2.040 20 0 BEADRP FC1(F)CC[C@H](CN2CC[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000306018131 384566905 /nfs/dbraw/zinc/56/69/05/384566905.db2.gz PSXVULWFDLVPJX-TUAOUCFPSA-N 2 0 244.329 2.248 20 0 BEADRP CC(C)C[C@H](C)C[NH2+]CCC[NH+](C)C ZINC000300844122 384603052 /nfs/dbraw/zinc/60/30/52/384603052.db2.gz DOTNWORBHVSXNU-LBPRGKRZSA-N 2 0 200.370 2.210 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)CO1 ZINC000647184040 384603274 /nfs/dbraw/zinc/60/32/74/384603274.db2.gz ZGDZUUDNCFXBPU-AGIUHOORSA-N 2 0 242.407 2.120 20 0 BEADRP Cc1cc(C)cc(C[N@@H+]2CC[C@@](C)(C[NH3+])C2)c1 ZINC000235846889 384633038 /nfs/dbraw/zinc/63/30/38/384633038.db2.gz TWKUKQTUFCUOBF-HNNXBMFYSA-N 2 0 232.371 2.474 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)C1 ZINC000568248686 384621769 /nfs/dbraw/zinc/62/17/69/384621769.db2.gz XWIVASLKZZZUOQ-NAWOPXAZSA-N 2 0 208.349 2.035 20 0 BEADRP c1ccc2c(c1)[nH+]ccc2N1CCC[NH2+]CC1 ZINC000041719754 384630657 /nfs/dbraw/zinc/63/06/57/384630657.db2.gz CZENTVNNJBFIMW-UHFFFAOYSA-N 2 0 227.311 2.035 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]C2CC(C(F)(F)F)C2)C1 ZINC000568247600 384601013 /nfs/dbraw/zinc/60/10/13/384601013.db2.gz RDYJLWNVSPXOJA-ZNHWEVIXSA-N 2 0 236.281 2.187 20 0 BEADRP CS[C@@H]1CC[C@H]1[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000309848184 384666491 /nfs/dbraw/zinc/66/64/91/384666491.db2.gz HSFXPLZOMWPDPG-CHWSQXEVSA-N 2 0 242.432 2.343 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC2(C(F)F)CC2)CC[N@@H+]1C ZINC000309810339 384637402 /nfs/dbraw/zinc/63/74/02/384637402.db2.gz UAQJNIJKWHYLAO-NXEZZACHSA-N 2 0 232.318 2.104 20 0 BEADRP Cc1cccc(CN2CC[C@H]3CC[NH2+][C@@H]3C2)c1C ZINC000647532752 384640458 /nfs/dbraw/zinc/64/04/58/384640458.db2.gz CNBAVTFEDKEGML-GDBMZVCRSA-N 2 0 244.382 2.487 20 0 BEADRP Cc1cccc(CN2CC[C@@H]3CC[NH2+][C@H]3C2)c1C ZINC000647532754 384640478 /nfs/dbraw/zinc/64/04/78/384640478.db2.gz CNBAVTFEDKEGML-HOCLYGCPSA-N 2 0 244.382 2.487 20 0 BEADRP C[C@H](C[N@@H+]1CC[C@@H]2CC[NH2+][C@H]2C1)C(C)(C)C ZINC000647533981 384646164 /nfs/dbraw/zinc/64/61/64/384646164.db2.gz CZDJFDPZPMTZOZ-AGIUHOORSA-N 2 0 224.392 2.352 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]CC2CCCCC2)C1 ZINC000086402711 384646510 /nfs/dbraw/zinc/64/65/10/384646510.db2.gz SYLLCXMZRSQKQT-STQMWFEESA-N 2 0 210.365 2.426 20 0 BEADRP C[NH+](C)C1CCC([NH2+][C@H]2CCCSC2)CC1 ZINC000309983121 384683876 /nfs/dbraw/zinc/68/38/76/384683876.db2.gz XCGXEGGVMVMTAD-CPCZMJQVSA-N 2 0 242.432 2.344 20 0 BEADRP C[N@H+](Cc1ccccc1)[C@@H]1CCC[NH2+]CC1 ZINC000082666635 384700301 /nfs/dbraw/zinc/70/03/01/384700301.db2.gz YICRVFXFCKIOTE-CQSZACIVSA-N 2 0 218.344 2.261 20 0 BEADRP Cn1cccc1C[NH2+]CC1(C[NH+](C)C)CCCC1 ZINC000185292488 384702592 /nfs/dbraw/zinc/70/25/92/384702592.db2.gz QDOHPWQYOZXGOW-UHFFFAOYSA-N 2 0 249.402 2.237 20 0 BEADRP CC(C)(C)CCC[N@@H+]1CC[C@](C)(C[NH3+])C1 ZINC000300921861 384712979 /nfs/dbraw/zinc/71/29/79/384712979.db2.gz TZRQBFJFHFVKSN-CYBMUJFWSA-N 2 0 212.381 2.483 20 0 BEADRP CC1(C)CCC[C@H]1[NH2+]CC1CC[NH2+]CC1 ZINC000086873620 384714113 /nfs/dbraw/zinc/71/41/13/384714113.db2.gz UEJNKGGFFRPZEM-GFCCVEGCSA-N 2 0 210.365 2.154 20 0 BEADRP C(C1CC1)[N@@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC000647544067 384715245 /nfs/dbraw/zinc/71/52/45/384715245.db2.gz VZNMMOGASAABMA-UONOGXRCSA-N 2 0 222.376 2.108 20 0 BEADRP Cc1ccsc1C[N@H+]1CC[C@H](C[NH+](C)C)C1 ZINC000125494416 384722539 /nfs/dbraw/zinc/72/25/39/384722539.db2.gz YQFBOLTZIWAPPZ-GFCCVEGCSA-N 2 0 238.400 2.440 20 0 BEADRP C[C@@H]([NH2+]C1CCC(F)(F)CC1)[C@H]1CCC[NH2+]1 ZINC000335027343 384774032 /nfs/dbraw/zinc/77/40/32/384774032.db2.gz SAMUWJAOJGHRSQ-MWLCHTKSSA-N 2 0 232.318 2.294 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CCc1ccsc1 ZINC000308469584 384739253 /nfs/dbraw/zinc/73/92/53/384739253.db2.gz BGPLSPYSVFERLL-SNVBAGLBSA-N 2 0 212.362 2.008 20 0 BEADRP CCN1CCC[C@@H]1C[NH2+][C@H]1CCCC12CC2 ZINC000568274883 384742671 /nfs/dbraw/zinc/74/26/71/384742671.db2.gz INXDISANLULUEP-OLZOCXBDSA-N 2 0 222.376 2.393 20 0 BEADRP C[C@H]1CCC[C@H](C[N@@H+]2C[C@@H]3CCC[NH2+][C@@H]3C2)C1 ZINC000220397031 384747244 /nfs/dbraw/zinc/74/72/44/384747244.db2.gz GXQFRDSJRVWWGQ-ZQDZILKHSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]([NH2+]CCN)C1CCC(C(F)(F)F)CC1 ZINC000423192542 384747279 /nfs/dbraw/zinc/74/72/79/384747279.db2.gz VVBBXHGWTWLJHV-XNWIYYODSA-N 2 0 238.297 2.292 20 0 BEADRP CC[C@H]1[C@H](C)CC[N@@H+]1CCn1ccnc1 ZINC000185632796 384748889 /nfs/dbraw/zinc/74/88/89/384748889.db2.gz OYUPROJFPIFWDV-NEPJUHHUSA-N 2 0 207.321 2.004 20 0 BEADRP C[NH+](C)CCC[NH2+][C@H]1CS[C@@H](C(C)(C)C)C1 ZINC000309980460 384757933 /nfs/dbraw/zinc/75/79/33/384757933.db2.gz VYEUZAWHSGVHNM-VXGBXAGGSA-N 2 0 244.448 2.448 20 0 BEADRP c1ccc(C[N@@H+]2CC[C@@H]3C[NH2+]CC[C@@H]3C2)cc1 ZINC000083328876 384758235 /nfs/dbraw/zinc/75/82/35/384758235.db2.gz HMEQPPDSBRYYKW-HUUCEWRRSA-N 2 0 230.355 2.118 20 0 BEADRP C(C1CC[NH2+]CC1)[N@@H+]1CC[C@H](C2CCC2)C1 ZINC000647552104 384758160 /nfs/dbraw/zinc/75/81/60/384758160.db2.gz FZNLMRMDFBMRQW-AWEZNQCLSA-N 2 0 222.376 2.108 20 0 BEADRP CC1(C)CCC[C@@H]1[C@H]1CC[N@H+](CCC[NH3+])C1 ZINC000647552761 384762633 /nfs/dbraw/zinc/76/26/33/384762633.db2.gz VNDBGEMJNTYZRJ-QWHCGFSZSA-N 2 0 224.392 2.483 20 0 BEADRP [NH3+]C[C@@H]1CCN(Cc2ccc(Cl)cc2)C1 ZINC000011891299 384765740 /nfs/dbraw/zinc/76/57/40/384765740.db2.gz QIGPQZKPXZPTHC-NSHDSACASA-N 2 0 224.735 2.121 20 0 BEADRP C([NH2+][C@H]1CC[NH2+]C12CCCC2)[C@H]1CCSC1 ZINC000647553473 384767636 /nfs/dbraw/zinc/76/76/36/384767636.db2.gz ALJGRUBCXLIXBH-NEPJUHHUSA-N 2 0 240.416 2.004 20 0 BEADRP C[C@@]1(C[NH2+]CC2CCC(F)CC2)CC[NH2+]C1 ZINC000647553291 384769191 /nfs/dbraw/zinc/76/91/91/384769191.db2.gz PSZWEURHBHHIFH-WXRRBKDZSA-N 2 0 228.355 2.104 20 0 BEADRP CC[C@@H](C)C[NH2+][C@H]1CC[NH2+]C12CCCC2 ZINC000647554297 384770887 /nfs/dbraw/zinc/77/08/87/384770887.db2.gz WGJANKGXQFXNNP-NEPJUHHUSA-N 2 0 210.365 2.297 20 0 BEADRP CC(C)CCC[NH2+]C[C@@H](C)C[NH+](C)C ZINC000308592487 384834540 /nfs/dbraw/zinc/83/45/40/384834540.db2.gz WIMCZBGCQYXMGB-GFCCVEGCSA-N 2 0 200.370 2.210 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CC[N@@H+](C)C[C@@H]2C)cc1 ZINC000105480763 384781696 /nfs/dbraw/zinc/78/16/96/384781696.db2.gz USHVXMRBOYUMRR-DZGCQCFKSA-N 2 0 232.371 2.425 20 0 BEADRP CCC([NH3+])(CC)C[NH2+][C@@H]1CC[C@@H]1C1CC1 ZINC000423289297 384785016 /nfs/dbraw/zinc/78/50/16/384785016.db2.gz ATJLNOUUCMEXHS-VXGBXAGGSA-N 2 0 210.365 2.282 20 0 BEADRP CCC1CC([NH2+][C@@H]2C[C@@H](C)N(C3CC3)C2)C1 ZINC000310023772 384790652 /nfs/dbraw/zinc/79/06/52/384790652.db2.gz OLHJBMQJQDOVPN-IKWCTNDRSA-N 2 0 222.376 2.390 20 0 BEADRP CC1(C[NH2+][C@H]2CC[C@@H]2C2CC2)CC[NH2+]CC1 ZINC000423338729 384812260 /nfs/dbraw/zinc/81/22/60/384812260.db2.gz UVFJEUWXONIARI-OLZOCXBDSA-N 2 0 222.376 2.154 20 0 BEADRP CCSCC[C@@H](C)[NH2+][C@@H](C)CCC[NH3+] ZINC000308636330 384882390 /nfs/dbraw/zinc/88/23/90/384882390.db2.gz AZUKVNGWLGRDRW-WDEREUQCSA-N 2 0 218.410 2.235 20 0 BEADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)C2CC2)C1 ZINC000247388233 384839225 /nfs/dbraw/zinc/83/92/25/384839225.db2.gz VKQGXOPBVUMMTB-OLZOCXBDSA-N 2 0 224.392 2.495 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCC[C@H]([NH3+])C1)[C@@H]1C[C@H]1C ZINC000423370255 384840887 /nfs/dbraw/zinc/84/08/87/384840887.db2.gz PIHRIFTXDKRKEA-MLGHIDQZSA-N 2 0 210.365 2.281 20 0 BEADRP Cc1cncc([C@H](C)[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)c1 ZINC000423373473 384848176 /nfs/dbraw/zinc/84/81/76/384848176.db2.gz HMDAPCYOVQKEBV-IACUBPJLSA-N 2 0 233.359 2.311 20 0 BEADRP C[C@@H]([NH3+])[C@H]1CCC[N@H+](CCc2ccccc2)C1 ZINC000104424510 384851189 /nfs/dbraw/zinc/85/11/89/384851189.db2.gz RFFOXKXUQRKNFZ-HIFRSBDPSA-N 2 0 232.371 2.288 20 0 BEADRP Cc1ncc([C@H](C)[NH2+][C@H]2CCC[C@H]([NH3+])C2)c(C)n1 ZINC000423393652 384852853 /nfs/dbraw/zinc/85/28/53/384852853.db2.gz QUMRPISAEKGWJG-DRZSPHRISA-N 2 0 248.374 2.014 20 0 BEADRP Cc1ccc([C@H](C)[NH2+]C[C@H](C)C[NH3+])s1 ZINC000308604107 384863293 /nfs/dbraw/zinc/86/32/93/384863293.db2.gz GKCUCTZWOLDXQK-SCZZXKLOSA-N 2 0 212.362 2.302 20 0 BEADRP Cc1ccc(C[NH2+]C[C@H]2CCC[NH2+]C2)cc1C ZINC000258861152 384949125 /nfs/dbraw/zinc/94/91/25/384949125.db2.gz AAAUHPVBZOZHLU-HNNXBMFYSA-N 2 0 232.371 2.393 20 0 BEADRP Fc1ccc(C[NH2+]CC[C@H]2CCC[NH2+]C2)cc1 ZINC000258953674 384956834 /nfs/dbraw/zinc/95/68/34/384956834.db2.gz ISTNKXWYKBFQKN-GFCCVEGCSA-N 2 0 236.334 2.305 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H]2CCC[C@@H]2[NH3+])cc1 ZINC000258953106 384956961 /nfs/dbraw/zinc/95/69/61/384956961.db2.gz KNUBDJATYIKWKN-UONOGXRCSA-N 2 0 218.344 2.007 20 0 BEADRP CC(C)(C[NH2+][C@@H]1CCC[C@@H]1[NH3+])C1CCC1 ZINC000258988130 384957554 /nfs/dbraw/zinc/95/75/54/384957554.db2.gz MKXPORWBYZOVCE-NWDGAFQWSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)[C@H]1CC[C@@H]1[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000423446566 384899307 /nfs/dbraw/zinc/89/93/07/384899307.db2.gz SPOXKRGNPHVPJF-CBBWQLFWSA-N 2 0 236.403 2.399 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]C[C@@](C)(CC)OC)[C@@H](C)C1 ZINC000449474813 384920729 /nfs/dbraw/zinc/92/07/29/384920729.db2.gz KJFNBGKITQRKFO-MELADBBJSA-N 2 0 242.407 2.121 20 0 BEADRP C([NH2+]C1CC2(CCC2)C1)[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000448062287 384924173 /nfs/dbraw/zinc/92/41/73/384924173.db2.gz APNDRGSUWXNBKW-LBPRGKRZSA-N 2 0 234.387 2.393 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+]Cc1coc2ccccc12 ZINC000258699945 384931369 /nfs/dbraw/zinc/93/13/69/384931369.db2.gz GREMNWWBMFQRON-JTQLQIEISA-N 2 0 218.300 2.117 20 0 BEADRP Cc1ccsc1CC[NH2+][C@H]1CCC[C@H]1[NH3+] ZINC000258800990 384934480 /nfs/dbraw/zinc/93/44/80/384934480.db2.gz CDTDFWSRGMEPPS-MNOVXSKESA-N 2 0 224.373 2.068 20 0 BEADRP CC[N@@H+]1CC[C@@H](CN[C@@H](C)c2ccoc2)C1 ZINC000087289885 384938875 /nfs/dbraw/zinc/93/88/75/384938875.db2.gz MFJGSSMDRUOYIC-RYUDHWBXSA-N 2 0 222.332 2.272 20 0 BEADRP FC1(F)CC[NH+](CCC2CC[NH2+]CC2)CC1 ZINC000259292957 384960254 /nfs/dbraw/zinc/96/02/54/384960254.db2.gz CCXRJDZBKFBOKT-UHFFFAOYSA-N 2 0 232.318 2.107 20 0 BEADRP Cc1cnccc1C[N@H+]1CCC[C@H](C)[C@H]1CC[NH3+] ZINC000404265928 384964746 /nfs/dbraw/zinc/96/47/46/384964746.db2.gz HHTKPNIPEAPNGK-SWLSCSKDSA-N 2 0 247.386 2.339 20 0 BEADRP C[C@@H]1CCC[N@H+](C[C@H]2CCCCO2)[C@H]1CC[NH3+] ZINC000404281179 384965657 /nfs/dbraw/zinc/96/56/57/384965657.db2.gz FAWRGGXLJSPLQP-MCIONIFRSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@@H]1CCC[N@H+](C[C@@H]2CCCCO2)[C@@H]1CC[NH3+] ZINC000404281177 384966584 /nfs/dbraw/zinc/96/65/84/384966584.db2.gz FAWRGGXLJSPLQP-HZSPNIEDSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@@H]([NH3+])[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000058041105 384979698 /nfs/dbraw/zinc/97/96/98/384979698.db2.gz IMUMZPSUQCFIOJ-TZMCWYRMSA-N 2 0 218.344 2.246 20 0 BEADRP Cc1ccc(C[N@H+](C)C[C@H]2CCC[NH2+]C2)s1 ZINC000226437709 385022045 /nfs/dbraw/zinc/02/20/45/385022045.db2.gz AORCEYURGRJQLT-LBPRGKRZSA-N 2 0 238.400 2.488 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+][C@@H](C)C2CC2)[C@H](C)C1 ZINC000177387016 384992331 /nfs/dbraw/zinc/99/23/31/384992331.db2.gz KAAVRKKGRUQBIK-NTZNESFSSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[NH2+][C@H]1C)C1CCCCC1 ZINC000308702567 385000496 /nfs/dbraw/zinc/00/04/96/385000496.db2.gz BBQQULBFNCAUDD-GMXVVIOVSA-N 2 0 210.365 2.295 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+][C@H]1CC[C@H](C[NH3+])C1 ZINC000423496271 385005169 /nfs/dbraw/zinc/00/51/69/385005169.db2.gz GJJMQGGLCVVTST-CYDGBPFRSA-N 2 0 210.365 2.138 20 0 BEADRP COc1ccc(C[N@@H+]2CCC[C@@H]([C@H](C)[NH3+])C2)cc1 ZINC000107954018 385013527 /nfs/dbraw/zinc/01/35/27/385013527.db2.gz LMXRJYXRGGDZGW-GXTWGEPZSA-N 2 0 248.370 2.254 20 0 BEADRP C1CCCC([NH2+][C@H]2CCCC[NH2+]C2)CC1 ZINC000129805133 385014146 /nfs/dbraw/zinc/01/41/46/385014146.db2.gz SKSMBUYAKVAVBJ-ZDUSSCGKSA-N 2 0 210.365 2.441 20 0 BEADRP C[C@H]([NH2+]C1CCCCC1)[C@@H]1CCC[NH2+]C1 ZINC000129791856 385014651 /nfs/dbraw/zinc/01/46/51/385014651.db2.gz QZAHXWCKDGAGDS-NWDGAFQWSA-N 2 0 210.365 2.297 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+][C@H]1CC[C@@H]1C1CC1 ZINC000423462832 384961388 /nfs/dbraw/zinc/96/13/88/384961388.db2.gz POEGSZWDKGBRHQ-LWWDWZNRSA-N 2 0 234.387 2.281 20 0 BEADRP COc1cccc(C[NH2+]CC[C@@H]2CCC[NH2+]C2)c1 ZINC000259139671 384964119 /nfs/dbraw/zinc/96/41/19/384964119.db2.gz XACUUKUFXQDFPP-ZDUSSCGKSA-N 2 0 248.370 2.175 20 0 BEADRP CCC(CC)[C@H](C[NH2+][C@H](C)CCC[NH3+])N(C)C ZINC000310407738 385047964 /nfs/dbraw/zinc/04/79/64/385047964.db2.gz OKTAWDINEQQTMV-OCCSQVGLSA-N 2 0 243.439 2.070 20 0 BEADRP CCC(CC)[C@@H](C[NH2+][C@@H](C)CCC[NH3+])N(C)C ZINC000310407228 385049495 /nfs/dbraw/zinc/04/94/95/385049495.db2.gz OKTAWDINEQQTMV-GXTWGEPZSA-N 2 0 243.439 2.070 20 0 BEADRP CCC(CC)[C@@H](C[NH2+][C@H](C)CCC[NH3+])N(C)C ZINC000310407741 385049952 /nfs/dbraw/zinc/04/99/52/385049952.db2.gz OKTAWDINEQQTMV-TZMCWYRMSA-N 2 0 243.439 2.070 20 0 BEADRP C[C@@H](CNc1ccncc1Cl)[NH+](C)C ZINC000086833076 385050315 /nfs/dbraw/zinc/05/03/15/385050315.db2.gz XYCUWMLMSBMSIL-QMMMGPOBSA-N 2 0 213.712 2.097 20 0 BEADRP CC[C@@H]([NH2+]CCc1cn(C)cn1)[C@H]1CC1(C)C ZINC000397617010 385065325 /nfs/dbraw/zinc/06/53/25/385065325.db2.gz CTOIFJDLKFIHDY-CHWSQXEVSA-N 2 0 235.375 2.377 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+][C@@H]1CC[C@@H](C)[C@H](C)C1 ZINC000300023903 385065359 /nfs/dbraw/zinc/06/53/59/385065359.db2.gz ITTNISJUAFSAHK-SYQHCUMBSA-N 2 0 242.407 2.155 20 0 BEADRP C[C@H](F)CC[NH2+][C@@H]1CC[N@H+](C)[C@H]2CCC[C@@H]21 ZINC000340464312 385065889 /nfs/dbraw/zinc/06/58/89/385065889.db2.gz SPVKTRBFSQTGLH-LOWDOPEQSA-N 2 0 228.355 2.197 20 0 BEADRP CC(C)C1([NH2+][C@@H]2C[C@H](C)N(C3CC3)C2)CC1 ZINC000340477805 385069981 /nfs/dbraw/zinc/06/99/81/385069981.db2.gz IKCDAFYKCOINQS-NWDGAFQWSA-N 2 0 222.376 2.390 20 0 BEADRP C[C@@H]1C[C@@H](C[NH3+])CN1Cc1cc(F)cc(F)c1 ZINC000157114895 385076785 /nfs/dbraw/zinc/07/67/85/385076785.db2.gz LMVGBAQASXHWRH-KOLCDFICSA-N 2 0 240.297 2.134 20 0 BEADRP Cc1ccc(F)cc1C[N@H+]1CC[C@@H]([C@@H](C)[NH3+])C1 ZINC000157116245 385078504 /nfs/dbraw/zinc/07/85/04/385078504.db2.gz CZTNHRXIRRGYBT-VXGBXAGGSA-N 2 0 236.334 2.303 20 0 BEADRP CCC(CC)C[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000130406649 385034344 /nfs/dbraw/zinc/03/43/44/385034344.db2.gz HXSGAXCHNFNCAT-ZDUSSCGKSA-N 2 0 212.381 2.402 20 0 BEADRP Cc1ccc(C[N@H+](C)CC2CC[NH2+]CC2)s1 ZINC000086701646 385040832 /nfs/dbraw/zinc/04/08/32/385040832.db2.gz OKRPJVPDGVOSBH-UHFFFAOYSA-N 2 0 238.400 2.488 20 0 BEADRP C[C@@H]([NH2+]CC1CC[NH2+]CC1)c1cccs1 ZINC000086700335 385040895 /nfs/dbraw/zinc/04/08/95/385040895.db2.gz RFZOMOHLMDLWHW-SNVBAGLBSA-N 2 0 224.373 2.398 20 0 BEADRP CC(C)(C)CC[N@H+]1CC[C@H]2C[NH2+]C[C@H]2CC1 ZINC000309534337 385046840 /nfs/dbraw/zinc/04/68/40/385046840.db2.gz WSTVMHGCBFIROC-BETUJISGSA-N 2 0 224.392 2.354 20 0 BEADRP CC1(C)[C@H]([NH3+])C[C@@H]1[NH2+]CCC1CCCC1 ZINC000404878100 385121683 /nfs/dbraw/zinc/12/16/83/385121683.db2.gz YBSAQZIJUXMZSO-NEPJUHHUSA-N 2 0 210.365 2.282 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H]1CCCSC1 ZINC000061571279 385123012 /nfs/dbraw/zinc/12/30/12/385123012.db2.gz PEOICROGXWQDTK-LBPRGKRZSA-N 2 0 230.421 2.204 20 0 BEADRP CO[C@@H](C)[C@H](C)[NH2+]Cc1cnc2ccc(C)cn12 ZINC000189124532 385126023 /nfs/dbraw/zinc/12/60/23/385126023.db2.gz HWKGMLWPMIIICG-RYUDHWBXSA-N 2 0 247.342 2.156 20 0 BEADRP c1cc2cc(CN3CCC[NH2+]CC3)ccc2cn1 ZINC000647481667 385187465 /nfs/dbraw/zinc/18/74/65/385187465.db2.gz OSAIRKDZUZDXOU-UHFFFAOYSA-N 2 0 241.338 2.030 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)C2CCC2)C1 ZINC000178184966 385194242 /nfs/dbraw/zinc/19/42/42/385194242.db2.gz VIUJXJAPEZGCBH-RYUDHWBXSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+][C@H]1CCC12CCC2 ZINC000308830946 385196783 /nfs/dbraw/zinc/19/67/83/385196783.db2.gz GERBBSIPSSZBBG-RYUDHWBXSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](C)c1ccco1 ZINC000308808938 385178319 /nfs/dbraw/zinc/17/83/19/385178319.db2.gz GQDMJWFQDXDXSE-QWRGUYRKSA-N 2 0 210.321 2.448 20 0 BEADRP CCCN(CC)CC[NH2+][C@@H](C)C1CCC1 ZINC000178231668 385213331 /nfs/dbraw/zinc/21/33/31/385213331.db2.gz JCJIFHNONZRQMB-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CCCC2CC2)[C@@H](C)C1 ZINC000222091284 385215356 /nfs/dbraw/zinc/21/53/56/385215356.db2.gz RSXUKPMYRCLOON-GXTWGEPZSA-N 2 0 224.392 2.497 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CCCC2CC2)[C@@H](C)C1 ZINC000222091336 385215381 /nfs/dbraw/zinc/21/53/81/385215381.db2.gz RSXUKPMYRCLOON-JSGCOSHPSA-N 2 0 224.392 2.497 20 0 BEADRP CSCCC[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@H]1C ZINC000068997598 385240137 /nfs/dbraw/zinc/24/01/37/385240137.db2.gz IFWHOFPJBVBQDS-IJLUTSLNSA-N 2 0 230.421 2.058 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCCC[C@H]1C[NH3+])c1ccncc1 ZINC000160945327 385312060 /nfs/dbraw/zinc/31/20/60/385312060.db2.gz OOERCCOLKHSXKL-FPMFFAJLSA-N 2 0 233.359 2.250 20 0 BEADRP CC1(C)CCC[C@H](C[N@@H+]2CC[C@@H](C[NH3+])C2)C1 ZINC000647490855 385281550 /nfs/dbraw/zinc/28/15/50/385281550.db2.gz VOCAWENLJACLBV-STQMWFEESA-N 2 0 224.392 2.483 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C2CCC2)[C@H]2CCC[C@@H]21 ZINC000308924844 385296455 /nfs/dbraw/zinc/29/64/55/385296455.db2.gz HXXNZNYTIBFCLI-AGIUHOORSA-N 2 0 208.349 2.001 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@@H]([C@H](C)[NH3+])C2)cc1F ZINC000228150108 385349564 /nfs/dbraw/zinc/34/95/64/385349564.db2.gz MQTZHKYWUQRDSI-WCQYABFASA-N 2 0 236.334 2.303 20 0 BEADRP Cc1ccc([C@H](C)[NH2+]C[C@H](C)C[NH3+])cc1 ZINC000309013152 385368761 /nfs/dbraw/zinc/36/87/61/385368761.db2.gz YDOGSQURYXDPBO-NEPJUHHUSA-N 2 0 206.333 2.240 20 0 BEADRP Cc1c[nH+]ccc1NCC[N@H+]1[C@H](C)CCC[C@@H]1C ZINC000359478834 385370776 /nfs/dbraw/zinc/37/07/76/385370776.db2.gz GHVYGMONLJANBK-OKILXGFUSA-N 2 0 247.386 2.487 20 0 BEADRP CC(C)OCCCC[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000180456019 385390795 /nfs/dbraw/zinc/39/07/95/385390795.db2.gz WPXOVBAQPRWDRA-ZIAGYGMSSA-N 2 0 242.407 2.264 20 0 BEADRP C[C@H]([NH2+]CCC1CC[NH+](C)CC1)C1CCC1 ZINC000178747624 385325814 /nfs/dbraw/zinc/32/58/14/385325814.db2.gz DVXDXMVADPWBFM-LBPRGKRZSA-N 2 0 224.392 2.497 20 0 BEADRP CCSCC[NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000309061031 385397297 /nfs/dbraw/zinc/39/72/97/385397297.db2.gz WPPWAWBUMMQVFN-VXGBXAGGSA-N 2 0 230.421 2.202 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CC2(C3CC3)CC2)CC[N@@H+]1C ZINC000181654273 385412175 /nfs/dbraw/zinc/41/21/75/385412175.db2.gz XFYIUYVTOMURKT-YPMHNXCESA-N 2 0 222.376 2.249 20 0 BEADRP C[C@@H]([NH3+])[C@H](C)[NH2+][C@H](C)CCc1ccccc1 ZINC000309247900 385498366 /nfs/dbraw/zinc/49/83/66/385498366.db2.gz NWXLMYVFWXSMOX-UPJWGTAASA-N 2 0 220.360 2.333 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]C1CCC(C(F)(F)F)CC1 ZINC000309322350 385533097 /nfs/dbraw/zinc/53/30/97/385533097.db2.gz HIYIKCDAWQASOX-XNWIYYODSA-N 2 0 238.297 2.292 20 0 BEADRP COC(C)(C)[C@H](C)[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000302510577 385534823 /nfs/dbraw/zinc/53/48/23/385534823.db2.gz VCUVECROUXEYJS-XQQFMLRXSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@@H](CCC(C)(C)C)[NH2+]CCOCC[NH+](C)C ZINC000302560146 385538208 /nfs/dbraw/zinc/53/82/08/385538208.db2.gz XZXFTPOQNCREEV-ZDUSSCGKSA-N 2 0 244.423 2.369 20 0 BEADRP CC[C@H](C)[C@@H](C)[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000319020011 385540126 /nfs/dbraw/zinc/54/01/26/385540126.db2.gz QSQKDZZZCNABLS-QJPTWQEYSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H](CCc1ccccc1)[NH2+]CC(C)(C)[NH3+] ZINC000309350319 385542903 /nfs/dbraw/zinc/54/29/03/385542903.db2.gz MJCUNGUOWQFBMH-LBPRGKRZSA-N 2 0 220.360 2.335 20 0 BEADRP C[C@H]([NH2+]CC1=CC[N@H+](C)CC1)c1cccc(O)c1 ZINC000282222747 385525746 /nfs/dbraw/zinc/52/57/46/385525746.db2.gz ICCRKDAFGJJIIS-LBPRGKRZSA-N 2 0 246.354 2.305 20 0 BEADRP C[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)c1cccc(O)c1 ZINC000282222745 385526869 /nfs/dbraw/zinc/52/68/69/385526869.db2.gz ICCRKDAFGJJIIS-GFCCVEGCSA-N 2 0 246.354 2.305 20 0 BEADRP COC1(C[N@@H+]2CCC[C@@H]([C@@H](C)[NH3+])C2)CCCC1 ZINC000318932274 385527176 /nfs/dbraw/zinc/52/71/76/385527176.db2.gz ANVVYQUHFWOLFB-CHWSQXEVSA-N 2 0 240.391 2.005 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CCC[C@H](C)[C@@H]1C ZINC000414849771 385630168 /nfs/dbraw/zinc/63/01/68/385630168.db2.gz YNPNLMCOVZJLQZ-ZDEQEGDKSA-N 2 0 212.381 2.256 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]Cc1ccc(F)c(F)c1 ZINC000309476434 385608593 /nfs/dbraw/zinc/60/85/93/385608593.db2.gz VBLGPZIHDHXHOC-VIFPVBQESA-N 2 0 228.286 2.182 20 0 BEADRP CCC[C@H](C)[NH+]1CCC(C[NH+](C)C)CC1 ZINC000337342803 385610495 /nfs/dbraw/zinc/61/04/95/385610495.db2.gz WNSANXGJCKOXDO-LBPRGKRZSA-N 2 0 212.381 2.449 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@@H]2CCC[C@H]3C[C@]32C)CC1 ZINC000337415448 385645726 /nfs/dbraw/zinc/64/57/26/385645726.db2.gz ZEHWTRUQPDAILQ-RRFJBIMHSA-N 2 0 236.403 2.497 20 0 BEADRP COc1cccc(C[NH2+][C@@H](C)[C@H]2CCC[NH2+]C2)c1 ZINC000414851888 385660478 /nfs/dbraw/zinc/66/04/78/385660478.db2.gz JMQSZCHSJVGXJL-JSGCOSHPSA-N 2 0 248.370 2.173 20 0 BEADRP COc1cccc(C[NH2+][C@H](C)[C@H]2CCC[NH2+]C2)c1 ZINC000414851889 385661831 /nfs/dbraw/zinc/66/18/31/385661831.db2.gz JMQSZCHSJVGXJL-OCCSQVGLSA-N 2 0 248.370 2.173 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC000414853146 385684557 /nfs/dbraw/zinc/68/45/57/385684557.db2.gz RXVJPFZELPHMKS-SNPRPXQTSA-N 2 0 232.371 2.235 20 0 BEADRP C([NH2+][C@@H]1CCCC[C@H]1C1CC1)[C@@H]1CCC[NH2+]1 ZINC000414853785 385690486 /nfs/dbraw/zinc/69/04/86/385690486.db2.gz YCKAIYSETACBFS-MELADBBJSA-N 2 0 222.376 2.297 20 0 BEADRP C[N@H+]1CC=C(C[NH2+][C@@H]2CCC[C@@H]3C[C@@]32C)CC1 ZINC000337499538 385692496 /nfs/dbraw/zinc/69/24/96/385692496.db2.gz ZWSMXLUAFGRHPV-KFWWJZLASA-N 2 0 234.387 2.417 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)o1 ZINC000647792827 385696106 /nfs/dbraw/zinc/69/61/06/385696106.db2.gz AEXKJEUXUPRZQN-MELADBBJSA-N 2 0 248.370 2.108 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]Cc1ccccc1 ZINC000307584977 385706421 /nfs/dbraw/zinc/70/64/21/385706421.db2.gz KHQIBXZPXXGDBM-GFCCVEGCSA-N 2 0 206.333 2.294 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@@H]2CCC[C@H]21)C1CC1 ZINC000309576756 385709311 /nfs/dbraw/zinc/70/93/11/385709311.db2.gz PEBXKBQERWLNBE-SCUASFONSA-N 2 0 222.376 2.247 20 0 BEADRP Cc1nc(C)c(C[NH2+][C@@H](C)CCCC[NH3+])s1 ZINC000309586787 385711136 /nfs/dbraw/zinc/71/11/36/385711136.db2.gz WAKKZSFCKMWLBD-VIFPVBQESA-N 2 0 241.404 2.367 20 0 BEADRP CCC[C@@]1(C)CCC[N@H+](CCC[NH2+]C)C1 ZINC000336689184 385711369 /nfs/dbraw/zinc/71/13/69/385711369.db2.gz VVNGFTPPEGITOQ-ZDUSSCGKSA-N 2 0 212.381 2.498 20 0 BEADRP C[C@H](C[NH2+]C[C@H]1CC=CCC1)C[NH+](C)C ZINC000336688588 385711386 /nfs/dbraw/zinc/71/13/86/385711386.db2.gz LTWAWQVPIFLVHR-OLZOCXBDSA-N 2 0 210.365 2.130 20 0 BEADRP CCSCC[C@@H](C)[N@H+](C)CCC[NH2+]C ZINC000336735824 385716634 /nfs/dbraw/zinc/71/66/34/385716634.db2.gz OOEVRDCZOCDZAT-LLVKDONJSA-N 2 0 218.410 2.059 20 0 BEADRP CC[C@H]([NH2+]C[C@@H](C)C[NH3+])c1ccc(OC)cc1 ZINC000336691944 385728814 /nfs/dbraw/zinc/72/88/14/385728814.db2.gz HPPLNZMQDDLCJW-FZMZJTMJSA-N 2 0 236.359 2.331 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1Cc2ccc(Cl)cc2C1 ZINC000414857514 385730550 /nfs/dbraw/zinc/73/05/50/385730550.db2.gz DPPXEAZIFOCSPZ-CYBMUJFWSA-N 2 0 238.762 2.006 20 0 BEADRP [NH3+]C1(C[NH2+]CC[C@H]2CCOC2)CCCCCC1 ZINC000414857437 385730631 /nfs/dbraw/zinc/73/06/31/385730631.db2.gz DGRVXPWPUNWKFF-ZDUSSCGKSA-N 2 0 240.391 2.054 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H](C)CCc1cccc(F)c1 ZINC000414857720 385732980 /nfs/dbraw/zinc/73/29/80/385732980.db2.gz FKQNXTZNEBGVEW-LBPRGKRZSA-N 2 0 238.350 2.346 20 0 BEADRP CC(C)CCC[C@H](C)[NH2+]C[C@@H](C)C[NH3+] ZINC000336692392 385734765 /nfs/dbraw/zinc/73/47/65/385734765.db2.gz QGLJMBBBVGDNBD-RYUDHWBXSA-N 2 0 200.370 2.386 20 0 BEADRP [NH3+]C1(C[NH2+]C[C@H]2CCCOC2)CCCCCC1 ZINC000414858911 385734966 /nfs/dbraw/zinc/73/49/66/385734966.db2.gz LNYKTTXFUQQXKB-CYBMUJFWSA-N 2 0 240.391 2.054 20 0 BEADRP C[C@@H]([NH2+]Cc1cccs1)[C@@H]1CCC[NH2+]C1 ZINC000414860811 385744155 /nfs/dbraw/zinc/74/41/55/385744155.db2.gz VVIXUENGQCTBEX-GHMZBOCLSA-N 2 0 224.373 2.226 20 0 BEADRP C[NH2+]Cc1ccccc1NC[C@@H]1CC[NH2+][C@@H](C)C1 ZINC000414861125 385744997 /nfs/dbraw/zinc/74/49/97/385744997.db2.gz FAZWBQNHDRPXIK-QWHCGFSZSA-N 2 0 247.386 2.206 20 0 BEADRP C[C@@H]([NH2+]Cc1cccc(F)c1)[C@@H]1CCC[NH2+]C1 ZINC000414861244 385745400 /nfs/dbraw/zinc/74/54/00/385745400.db2.gz WHSBEKGGAVUHRU-DGCLKSJQSA-N 2 0 236.334 2.303 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)CCC2CC2)C1 ZINC000186255279 385752996 /nfs/dbraw/zinc/75/29/96/385752996.db2.gz HRAVQMJECHFJET-JSGCOSHPSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)C[C@@H](C)[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000336697916 385755470 /nfs/dbraw/zinc/75/54/70/385755470.db2.gz OLNSSCLEFZDSOX-OLZOCXBDSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H]1C[C@@H]1C[NH2+]CC1([NH3+])CCCCCC1 ZINC000414862560 385756848 /nfs/dbraw/zinc/75/68/48/385756848.db2.gz VJXFDHWXSVQZLG-NWDGAFQWSA-N 2 0 210.365 2.284 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1C[C@H](c2ccccc2)[C@H]1C ZINC000414864699 385764552 /nfs/dbraw/zinc/76/45/52/385764552.db2.gz ZTXLLUGLWLVKKR-VHDGCEQUSA-N 2 0 232.371 2.378 20 0 BEADRP CC(C)C(C)(C)C[NH2+][C@@H](C)CCC[NH3+] ZINC000336701018 385764525 /nfs/dbraw/zinc/76/45/25/385764525.db2.gz XPVBBQOWNHSKPC-NSHDSACASA-N 2 0 200.370 2.386 20 0 BEADRP C[C@@H](C[NH2+][C@H]1CCC[C@@H](C)C1)C[NH+](C)C ZINC000336655852 385766865 /nfs/dbraw/zinc/76/68/65/385766865.db2.gz ABWPWNHMHVEWOJ-AGIUHOORSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@@H](C)CC(F)(F)F ZINC000336703282 385774714 /nfs/dbraw/zinc/77/47/14/385774714.db2.gz ZNQGWMRHZJLTKC-YUMQZZPRSA-N 2 0 212.259 2.044 20 0 BEADRP CC[C@@H](C)[NH2+]C[C@@H]1N(C)CCCC1(C)C ZINC000336735853 385719819 /nfs/dbraw/zinc/71/98/19/385719819.db2.gz OTEMESMYFSOMOB-NEPJUHHUSA-N 2 0 212.381 2.495 20 0 BEADRP c1coc([C@@H]2C[C@H]2[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)c1 ZINC000647799627 385800746 /nfs/dbraw/zinc/80/07/46/385800746.db2.gz MPMISCQSQRJMRU-XVIXHAIJSA-N 2 0 246.354 2.113 20 0 BEADRP C([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)[C@@H]1C[C@H]1C1CC1 ZINC000647800012 385801750 /nfs/dbraw/zinc/80/17/50/385801750.db2.gz XEYUXKQAFZGIMV-FQKPHLNHSA-N 2 0 234.387 2.010 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCC(C)(C)C1)C[NH+](C)C ZINC000336713368 385806879 /nfs/dbraw/zinc/80/68/79/385806879.db2.gz VLRRGEPZQAKKME-NEPJUHHUSA-N 2 0 212.381 2.352 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CC2CCC1CC2 ZINC000647801081 385809733 /nfs/dbraw/zinc/80/97/33/385809733.db2.gz NWIYROLOKZFFRV-LFGDDXOXSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[NH2+]CC[C@@H]1C)CC(F)F ZINC000647801453 385811440 /nfs/dbraw/zinc/81/14/40/385811440.db2.gz WDLZWMHOBGPAAW-GARJFASQSA-N 2 0 234.334 2.255 20 0 BEADRP CCC[NH2+]CC[NH2+]C[C@@H]1CCCC[C@H]1C ZINC000414868189 385814643 /nfs/dbraw/zinc/81/46/43/385814643.db2.gz JPZJPBUPOPFFFN-OLZOCXBDSA-N 2 0 212.381 2.402 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+]Cc1ccc(OCC2CC2)cc1 ZINC000414869110 385831856 /nfs/dbraw/zinc/83/18/56/385831856.db2.gz ABHFOVHHKMHKPI-LBPRGKRZSA-N 2 0 248.370 2.160 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+]Cc1ccc(Cl)c(F)c1 ZINC000414869166 385833461 /nfs/dbraw/zinc/83/34/61/385833461.db2.gz AFJWXSHPAOANHP-QMMMGPOBSA-N 2 0 230.714 2.164 20 0 BEADRP C[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1)C1CCOCC1 ZINC000647803306 385837413 /nfs/dbraw/zinc/83/74/13/385837413.db2.gz SUBBYTYQZZTUIG-GFCCVEGCSA-N 2 0 248.370 2.050 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCS[C@H]1C)[C@@H]1CCC[NH2+]1 ZINC000647804569 385840385 /nfs/dbraw/zinc/84/03/85/385840385.db2.gz UZQRBUMVNPNLTJ-YFKTTZPYSA-N 2 0 228.405 2.001 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]CC1CCC(F)CC1 ZINC000647804320 385840497 /nfs/dbraw/zinc/84/04/97/385840497.db2.gz OZXPYIQSBQMRJU-PYNQCMFNSA-N 2 0 228.355 2.232 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[C@@H]2C[C@@H]2C1)[C@@H]1CCC[NH2+]1 ZINC000647804008 385841024 /nfs/dbraw/zinc/84/10/24/385841024.db2.gz HOYGYSGSYQFBFD-POQQGIQPSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CC1CCC(F)CC1 ZINC000647804258 385841601 /nfs/dbraw/zinc/84/16/01/385841601.db2.gz MWCVXOWILPGAQL-QKEWWQLBSA-N 2 0 216.344 2.230 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@@H](C)CCc1ccc(F)cc1 ZINC000414869841 385841899 /nfs/dbraw/zinc/84/18/99/385841899.db2.gz BHNHYHFEAUOYHZ-RYUDHWBXSA-N 2 0 238.350 2.331 20 0 BEADRP c1cn(CCCNc2ccnc(C3CC3)n2)cn1 ZINC000271639947 385842830 /nfs/dbraw/zinc/84/28/30/385842830.db2.gz PICAZEVHQDPZJU-UHFFFAOYSA-N 2 0 243.314 2.053 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CC1(C2CC2)CC1 ZINC000336718510 385844057 /nfs/dbraw/zinc/84/40/57/385844057.db2.gz YOLSUMGMTMVDBI-LLVKDONJSA-N 2 0 210.365 2.284 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H](C)[C@]1(C)CCCO1 ZINC000340462343 385849750 /nfs/dbraw/zinc/84/97/50/385849750.db2.gz LTNNGYLZHGSPQM-KGLIPLIRSA-N 2 0 242.407 2.266 20 0 BEADRP CC[NH2+]Cc1cccc(NCC2CC[NH2+]CC2)c1 ZINC000414871224 385854354 /nfs/dbraw/zinc/85/43/54/385854354.db2.gz SYUFAJPGULGDGD-UHFFFAOYSA-N 2 0 247.386 2.208 20 0 BEADRP CCSCCC[NH2+][C@@H]1CC[N@H+](CC)C[C@@H]1C ZINC000309679387 385792839 /nfs/dbraw/zinc/79/28/39/385792839.db2.gz ZBILEYDAZHJJPQ-QWHCGFSZSA-N 2 0 244.448 2.450 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+]C/C=C\c1ccc(F)cc1 ZINC000414874697 385886232 /nfs/dbraw/zinc/88/62/32/385886232.db2.gz IUSVSTPNYRQPGU-QUCGXOGASA-N 2 0 222.307 2.023 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H](C)CCc1ccsc1 ZINC000414874692 385887442 /nfs/dbraw/zinc/88/74/42/385887442.db2.gz IURDDIMABPPJIH-MNOVXSKESA-N 2 0 226.389 2.254 20 0 BEADRP CC(C)CC[N@H+](C)CC[C@H]([NH3+])C(C)C ZINC000123706616 385904839 /nfs/dbraw/zinc/90/48/39/385904839.db2.gz XXAAOWPQSJOXJT-LBPRGKRZSA-N 2 0 200.370 2.338 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+]Cc1cc(Cl)cs1 ZINC000414876191 385905537 /nfs/dbraw/zinc/90/55/37/385905537.db2.gz KXHCWEPEDMVHOW-ZETCQYMHSA-N 2 0 218.753 2.086 20 0 BEADRP C[C@H]1CCC[C@H](C[NH2+]CC2(N(C)C)CC2)C1 ZINC000397768492 385907244 /nfs/dbraw/zinc/90/72/44/385907244.db2.gz KRLHVFNICZVDQQ-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H](Cc1ccccc1F)[NH2+]CC1([NH3+])CCC1 ZINC000414876392 385907447 /nfs/dbraw/zinc/90/74/47/385907447.db2.gz LHZXDJVSSXOSOB-LLVKDONJSA-N 2 0 236.334 2.228 20 0 BEADRP FC1(F)CC(C[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)C1 ZINC000334492159 385908599 /nfs/dbraw/zinc/90/85/99/385908599.db2.gz FCEYWOREDMHCNS-RYUDHWBXSA-N 2 0 244.329 2.248 20 0 BEADRP Cc1ccc(CN2CC[C@@H]3CC[N@@H+](C)C[C@@H]32)o1 ZINC000272544116 385910134 /nfs/dbraw/zinc/91/01/34/385910134.db2.gz CGCXPEIMNBVDPR-JSGCOSHPSA-N 2 0 234.343 2.114 20 0 BEADRP CC[NH+](CC)CCC[N@H+](C)CC(C)C ZINC000338232506 385922896 /nfs/dbraw/zinc/92/28/96/385922896.db2.gz FXXSTZOTZDTJOQ-UHFFFAOYSA-N 2 0 200.370 2.306 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000414967258 385927257 /nfs/dbraw/zinc/92/72/57/385927257.db2.gz HFWIZSNUGQWSNB-UPJWGTAASA-N 2 0 210.365 2.297 20 0 BEADRP CCCOc1cccc(C[NH2+]C[C@@H](C)C[NH3+])c1 ZINC000414871602 385862383 /nfs/dbraw/zinc/86/23/83/385862383.db2.gz DKOWIVCSYRKKRT-LBPRGKRZSA-N 2 0 236.359 2.160 20 0 BEADRP c1ccc(CC[N@H+](C2CC2)C2CC[NH2+]CC2)cc1 ZINC000647814213 385868986 /nfs/dbraw/zinc/86/89/86/385868986.db2.gz CVUFZEPQDBGRCL-UHFFFAOYSA-N 2 0 244.382 2.446 20 0 BEADRP C[N@H+]1CC=C(C[NH2+][C@@H]2CC[C@H]2C2CCC2)CC1 ZINC000337990054 385869991 /nfs/dbraw/zinc/86/99/91/385869991.db2.gz SCMPCQRTMJSBTG-LSDHHAIUSA-N 2 0 234.387 2.417 20 0 BEADRP Cc1ccc2cc(C[NH2+]C[C@H](C)C[NH3+])ccc2n1 ZINC000414872945 385871132 /nfs/dbraw/zinc/87/11/32/385871132.db2.gz GSSLJBMUHOIXOQ-LLVKDONJSA-N 2 0 243.354 2.228 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+]C/C=C/c1ccc(F)cc1F ZINC000414873335 385873125 /nfs/dbraw/zinc/87/31/25/385873125.db2.gz HBALOOYPVPGHLD-PBKGFPTLSA-N 2 0 240.297 2.162 20 0 BEADRP CC[C@H]1CO[C@@H](C)CN1CCC[NH+](CC)CC ZINC000338251486 385928156 /nfs/dbraw/zinc/92/81/56/385928156.db2.gz PNDPBODHRNVQQZ-KBPBESRZSA-N 2 0 242.407 2.218 20 0 BEADRP CC1(C[NH2+][C@H]2CCC23CCC3)CC[NH2+]CC1 ZINC000335021108 385979979 /nfs/dbraw/zinc/97/99/79/385979979.db2.gz BJVWVOYGZKVTKS-LBPRGKRZSA-N 2 0 222.376 2.298 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]CC1CCC(F)(F)CC1 ZINC000335020929 385980860 /nfs/dbraw/zinc/98/08/60/385980860.db2.gz CZGXXUHQUBSZJA-GHMZBOCLSA-N 2 0 232.318 2.281 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+]CC1CCC(F)(F)CC1 ZINC000335020932 385981304 /nfs/dbraw/zinc/98/13/04/385981304.db2.gz CZGXXUHQUBSZJA-WDEREUQCSA-N 2 0 232.318 2.281 20 0 BEADRP Cc1ccc(C[NH2+]CCC[C@@H]2CCC[NH2+]2)nc1 ZINC000414972058 385982093 /nfs/dbraw/zinc/98/20/93/385982093.db2.gz LUTYXRBXRBACGH-CYBMUJFWSA-N 2 0 233.359 2.012 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCCc2ccccc21)C1C[NH2+]C1 ZINC000335039063 385930444 /nfs/dbraw/zinc/93/04/44/385930444.db2.gz LSRUKJYEDZEDBO-XHDPSFHLSA-N 2 0 230.355 2.262 20 0 BEADRP C[C@@H]([NH2+]C1CC[NH+](CC2CC2)CC1)[C@@H]1C[C@H]1C ZINC000414060995 385935988 /nfs/dbraw/zinc/93/59/88/385935988.db2.gz BDFHNDILENGUDI-LALPHHSUSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@@H]1Cc2ccccc2[C@H]1[NH2+]CC1([NH3+])CCC1 ZINC000335056828 385955656 /nfs/dbraw/zinc/95/56/56/385955656.db2.gz ZEUHWLRMBQYUFJ-RISCZKNCSA-N 2 0 230.355 2.391 20 0 BEADRP COCC1(C[NH2+]CCCC(C)C)CC[NH2+]CC1 ZINC000414970343 385957766 /nfs/dbraw/zinc/95/77/66/385957766.db2.gz HMZPCKIAJSPFEJ-UHFFFAOYSA-N 2 0 242.407 2.028 20 0 BEADRP C[C@@H]1COCC[C@H]1[NH2+]CC1([NH3+])CCCCCC1 ZINC000335058881 385962293 /nfs/dbraw/zinc/96/22/93/385962293.db2.gz MDLVWXOVQDSBDL-CHWSQXEVSA-N 2 0 240.391 2.053 20 0 BEADRP C[C@@H](CC[NH3+])[NH2+]Cc1ccccc1OC(F)F ZINC000414880221 385966579 /nfs/dbraw/zinc/96/65/79/385966579.db2.gz JHNXIKGLAQCRFF-VIFPVBQESA-N 2 0 244.285 2.115 20 0 BEADRP CC[NH+](CC)CCC[N@H+]1C[C@@H]2[C@H](C1)C2(C)C ZINC000338317971 385968012 /nfs/dbraw/zinc/96/80/12/385968012.db2.gz SQCGPGQTAWJKHW-BETUJISGSA-N 2 0 224.392 2.306 20 0 BEADRP CC(C)CCOCC[NH+]1CCC([C@H](C)[NH3+])CC1 ZINC000111612399 385968821 /nfs/dbraw/zinc/96/88/21/385968821.db2.gz BRRUKPUGKYUNKN-ZDUSSCGKSA-N 2 0 242.407 2.108 20 0 BEADRP C(C[NH2+]C1CCSCC1)C[C@H]1CCC[NH2+]1 ZINC000414975009 386005709 /nfs/dbraw/zinc/00/57/09/386005709.db2.gz OCFADTIRNWPNRP-LLVKDONJSA-N 2 0 228.405 2.004 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+]C1CC2(CCC2)C1 ZINC000336752782 386016550 /nfs/dbraw/zinc/01/65/50/386016550.db2.gz HCUCINZUTNKVIX-LLVKDONJSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@H]1CCCC[C@@H]1[NH2+]CC1=CC[NH2+]CC1 ZINC000335060832 386027038 /nfs/dbraw/zinc/02/70/38/386027038.db2.gz TZPALTRFODUKGT-AAEUAGOBSA-N 2 0 208.349 2.074 20 0 BEADRP Cc1cccc2c1CC[C@H]2[NH2+]CC1=CC[NH2+]CC1 ZINC000335061495 386027679 /nfs/dbraw/zinc/02/76/79/386027679.db2.gz WYHCIILMDBYYAW-MRXNPFEDSA-N 2 0 242.366 2.492 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]CC2([NH3+])CCC2)[C@H]1C ZINC000414883535 386031647 /nfs/dbraw/zinc/03/16/47/386031647.db2.gz VIWVJKSEZQJIGU-GRYCIOLGSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[NH2+]C[C@H]([NH3+])C1CC1 ZINC000414883185 386032305 /nfs/dbraw/zinc/03/23/05/386032305.db2.gz CVHRPUATTXDXPH-RTXFEEFZSA-N 2 0 210.365 2.140 20 0 BEADRP CC[NH+](CC)CCC[NH2+]C1CC(C)(C)C1 ZINC000336771447 386040883 /nfs/dbraw/zinc/04/08/83/386040883.db2.gz WTPLZMVSLOZTKN-UHFFFAOYSA-N 2 0 212.381 2.497 20 0 BEADRP C[NH2+]Cc1ccc(NC[C@@H]2CC[NH2+][C@@H](C)C2)cc1 ZINC000414979041 386048656 /nfs/dbraw/zinc/04/86/56/386048656.db2.gz TUZNTUAVZIQGJD-GXTWGEPZSA-N 2 0 247.386 2.206 20 0 BEADRP C[C@@H](C[NH2+][C@H](C)CC[NH3+])Cc1ccccc1 ZINC000414884844 386050371 /nfs/dbraw/zinc/05/03/71/386050371.db2.gz BKLDOASYPOKCKL-CHWSQXEVSA-N 2 0 220.360 2.192 20 0 BEADRP CN(CC[N@H+](C)C1CC1)c1nc2ccccc2[nH]1 ZINC000274534354 386115212 /nfs/dbraw/zinc/11/52/12/386115212.db2.gz ZJZAAZXXVXHAGJ-UHFFFAOYSA-N 2 0 244.342 2.093 20 0 BEADRP CC[C@@H]1CCC[C@@H](C[NH2+][C@@H]2CC[NH2+]C2)C1 ZINC000414886758 386077677 /nfs/dbraw/zinc/07/76/77/386077677.db2.gz QLCFCVGOBWXTGT-JHJVBQTASA-N 2 0 210.365 2.154 20 0 BEADRP CCOc1ccccc1CNCC1([NH3+])CCC1 ZINC000414886927 386086079 /nfs/dbraw/zinc/08/60/79/386086079.db2.gz QDNJESQRBHZGAH-UHFFFAOYSA-N 2 0 234.343 2.056 20 0 BEADRP CC[N@H+](C)C[C@@H]1CCN(c2cc[nH+]c(C)c2)C1 ZINC000274358462 386094427 /nfs/dbraw/zinc/09/44/27/386094427.db2.gz MLEXVUVMIOPWAP-ZDUSSCGKSA-N 2 0 233.359 2.168 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H](C)Cc1ccc(Cl)cc1 ZINC000414887744 386095105 /nfs/dbraw/zinc/09/51/05/386095105.db2.gz ZJPKECVKKXZPOP-GHMZBOCLSA-N 2 0 240.778 2.455 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H]2CCC[C@@H]2C2CC2)CCC1 ZINC000414887755 386095815 /nfs/dbraw/zinc/09/58/15/386095815.db2.gz ZKEQJSVRANXWFS-VXGBXAGGSA-N 2 0 208.349 2.036 20 0 BEADRP C[C@@H](C[NH2+]C[C@@H]([NH3+])C1CC1)c1ccc(F)cc1 ZINC000414888489 386098721 /nfs/dbraw/zinc/09/87/21/386098721.db2.gz JWVJCZSSWLFINI-IINYFYTJSA-N 2 0 236.334 2.256 20 0 BEADRP C[C@@H]1CC(C)(C)CC[C@@H]1[NH2+][C@H]1CC[NH2+]C1 ZINC000414892272 386150696 /nfs/dbraw/zinc/15/06/96/386150696.db2.gz XTTFRFQIQSMPEX-WOPDTQHZSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CCC[C@@H]([NH3+])C1 ZINC000414992009 386152903 /nfs/dbraw/zinc/15/29/03/386152903.db2.gz BKWGMWAGESETEC-LPWJVIDDSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H](CC[NH3+])[NH2+]C/C=C\c1ccc(F)cc1 ZINC000414892672 386153552 /nfs/dbraw/zinc/15/35/52/386153552.db2.gz XHURBMVZEPANCK-QUCGXOGASA-N 2 0 222.307 2.166 20 0 BEADRP C[C@@H](CCc1ccccc1)C[NH2+][C@@H]1CC[NH2+]C1 ZINC000414893251 386153912 /nfs/dbraw/zinc/15/39/12/386153912.db2.gz YYHYHOCMTMXVOI-DZGCQCFKSA-N 2 0 232.371 2.207 20 0 BEADRP COc1ccccc1C[NH2+]C[C@H]1CCC[C@@H]([NH3+])C1 ZINC000414992322 386157206 /nfs/dbraw/zinc/15/72/06/386157206.db2.gz KHUNJYFOVNQMCW-GXTWGEPZSA-N 2 0 248.370 2.302 20 0 BEADRP Cc1cccc([C@@H]2CCC[N@@H+]2CCC[NH3+])c1 ZINC000414681601 386163235 /nfs/dbraw/zinc/16/32/35/386163235.db2.gz WCGKQCSRCIJTEW-AWEZNQCLSA-N 2 0 218.344 2.481 20 0 BEADRP [NH3+]CCC[N@@H+]1CCC[C@H]1Cc1ccc(F)cc1 ZINC000414682668 386165993 /nfs/dbraw/zinc/16/59/93/386165993.db2.gz ADVHRYYXIVOZSD-AWEZNQCLSA-N 2 0 236.334 2.181 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]C[C@H]([NH3+])C2CC2)[C@@H]1C ZINC000414894821 386178110 /nfs/dbraw/zinc/17/81/10/386178110.db2.gz UKRMUOOQBIQXNA-AAXDQBDMSA-N 2 0 210.365 2.138 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@@H](CC)Cc1ccccc1 ZINC000414995780 386179427 /nfs/dbraw/zinc/17/94/27/386179427.db2.gz WSGKXSGXMCRONP-KGLIPLIRSA-N 2 0 220.360 2.335 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@@H](C)CCc1cccc(F)c1 ZINC000414995886 386180334 /nfs/dbraw/zinc/18/03/34/386180334.db2.gz WTTSEMXIDZKLSC-SMDDNHRTSA-N 2 0 238.350 2.474 20 0 BEADRP c1ccc([C@@H]2CCC[N@H+]2C[C@H]2CC[NH2+]C2)cc1 ZINC000647874484 386139684 /nfs/dbraw/zinc/13/96/84/386139684.db2.gz ZSRCRDFIXHAXEU-ZFWWWQNUSA-N 2 0 230.355 2.433 20 0 BEADRP C[C@H](CC[NH3+])[NH2+][C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000414891523 386142693 /nfs/dbraw/zinc/14/26/93/386142693.db2.gz ILSJYNNAPOKQIJ-KXUCPTDWSA-N 2 0 238.297 2.434 20 0 BEADRP C[N@H+](C[C@H]1CC[NH2+]C1)[C@H]1CCc2ccccc21 ZINC000647874666 386143826 /nfs/dbraw/zinc/14/38/26/386143826.db2.gz KUMBBEGGYWAXCY-WFASDCNBSA-N 2 0 230.355 2.215 20 0 BEADRP C[C@@H](C[NH2+][C@@H](C)CC[NH3+])c1ccc(F)cc1 ZINC000414896774 386207314 /nfs/dbraw/zinc/20/73/14/386207314.db2.gz PUWPHBFCOIWFSQ-QWRGUYRKSA-N 2 0 224.323 2.256 20 0 BEADRP C[C@H](CC[NH3+])[NH2+]CCSCc1ccccc1 ZINC000414896989 386210831 /nfs/dbraw/zinc/21/08/31/386210831.db2.gz QNAYMTQRZFWPCM-GFCCVEGCSA-N 2 0 238.400 2.247 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCC[C@H]1c1ccc(O)cc1 ZINC000647882003 386218649 /nfs/dbraw/zinc/21/86/49/386218649.db2.gz ARCYLVWUUCBSHD-AWEZNQCLSA-N 2 0 234.343 2.139 20 0 BEADRP COc1ccccc1/C=C/CN1CCC[C@H]1C[NH3+] ZINC000347040199 386225682 /nfs/dbraw/zinc/22/56/82/386225682.db2.gz HSPLWJNTIPZGIJ-GBXSZLQWSA-N 2 0 246.354 2.132 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000339066399 386231715 /nfs/dbraw/zinc/23/17/15/386231715.db2.gz BZKLPLKIBXGSBJ-BPLDGKMQSA-N 2 0 248.370 2.427 20 0 BEADRP C[C@@H]1CC[C@H](C)[N@H+]1C[C@H]1CC[NH2+][C@H](C)C1 ZINC000414716427 386238667 /nfs/dbraw/zinc/23/86/67/386238667.db2.gz XWIZKGBXHVGLFA-NDBYEHHHSA-N 2 0 210.365 2.247 20 0 BEADRP C(C[C@H]1CCC[NH2+]1)[NH2+][C@@H]1CCC[C@H]1C1CC1 ZINC000414898990 386239594 /nfs/dbraw/zinc/23/95/94/386239594.db2.gz BPIFSDQZXGIONK-HZSPNIEDSA-N 2 0 222.376 2.297 20 0 BEADRP [NH3+]C[C@@H]1CC[N@H+](C/C=C\c2ccc(F)cc2)C1 ZINC000347084548 386242899 /nfs/dbraw/zinc/24/28/99/386242899.db2.gz AQRHTURSQQOLON-FYDYADQUSA-N 2 0 234.318 2.120 20 0 BEADRP c1ccc(C[NH2+][C@@H]2C[C@H]2C2CC[NH2+]CC2)cc1 ZINC000415002470 386243616 /nfs/dbraw/zinc/24/36/16/386243616.db2.gz DPNJCZZAHVQHRA-LSDHHAIUSA-N 2 0 230.355 2.164 20 0 BEADRP [NH3+][C@H]1CCC[C@H](C[NH2+]Cc2ccccc2F)C1 ZINC000415003287 386253322 /nfs/dbraw/zinc/25/33/22/386253322.db2.gz WXFKFAPSJSHFBJ-AAEUAGOBSA-N 2 0 236.334 2.433 20 0 BEADRP CC(C)[C@@H]1CCC[C@H]1[NH2+]C[C@@H]([NH3+])C1CC1 ZINC000414895684 386193856 /nfs/dbraw/zinc/19/38/56/386193856.db2.gz YORFMDNICIFGOB-YNEHKIRRSA-N 2 0 210.365 2.138 20 0 BEADRP CCC(CC)C[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000415004798 386286496 /nfs/dbraw/zinc/28/64/96/386286496.db2.gz IKCUUKBCTBVYFV-UONOGXRCSA-N 2 0 224.392 2.400 20 0 BEADRP CC[NH+](CC)C[C@@H]1CC[N@H+](CCC2CC2)C1 ZINC000336666801 386293417 /nfs/dbraw/zinc/29/34/17/386293417.db2.gz LHAIIHWPAULLAW-AWEZNQCLSA-N 2 0 224.392 2.450 20 0 BEADRP C[C@H](CC[NH3+])[NH2+]Cc1cc(F)cc(Cl)c1 ZINC000414901053 386294644 /nfs/dbraw/zinc/29/46/44/386294644.db2.gz WSLANXNIEFONJX-MRVPVSSYSA-N 2 0 230.714 2.306 20 0 BEADRP CCn1cncc1CNc1ccc(C)cn1 ZINC000416425047 386301693 /nfs/dbraw/zinc/30/16/93/386301693.db2.gz GWJRGLQLGFPAJY-UHFFFAOYSA-N 2 0 216.288 2.219 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]C[C@@H]2CC[NH2+]C2)[C@@H]1C ZINC000414901508 386308329 /nfs/dbraw/zinc/30/83/29/386308329.db2.gz GBTTVJUPKBTFPE-LPWJVIDDSA-N 2 0 210.365 2.010 20 0 BEADRP CCc1cc(OC)ccc1C[NH2+][C@H](C)CC[NH3+] ZINC000414901541 386308391 /nfs/dbraw/zinc/30/83/91/386308391.db2.gz XFBPVNUIMIWRIW-LLVKDONJSA-N 2 0 236.359 2.085 20 0 BEADRP CC[C@H]1Cc2ccccc2C[N@@H+]1CCC[NH3+] ZINC000414735075 386309003 /nfs/dbraw/zinc/30/90/03/386309003.db2.gz FONHTJUGFVQVLM-AWEZNQCLSA-N 2 0 218.344 2.172 20 0 BEADRP Cc1ccncc1C[N@@H+](C)C[C@H]1CC[NH2+][C@H](C)C1 ZINC000414738291 386317037 /nfs/dbraw/zinc/31/70/37/386317037.db2.gz JAWYYYCAMWOYLV-KGLIPLIRSA-N 2 0 247.386 2.210 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CC2CCCCC2)CC[NH2+]1 ZINC000335261609 386320390 /nfs/dbraw/zinc/32/03/90/386320390.db2.gz OZYHCDQEFBNEDS-WCQYABFASA-N 2 0 210.365 2.297 20 0 BEADRP C(=C/c1ccccc1)\C[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000414902404 386320476 /nfs/dbraw/zinc/32/04/76/386320476.db2.gz HYRATPWPVRECBC-SGJXGLNRSA-N 2 0 230.355 2.432 20 0 BEADRP C[C@H]1c2ccccc2CC[N@H+]1C[C@@H]1CC[NH2+]C1 ZINC000647884445 386263383 /nfs/dbraw/zinc/26/33/83/386263383.db2.gz QKNNKCOMESBINQ-QWHCGFSZSA-N 2 0 230.355 2.215 20 0 BEADRP Cc1ccc(CN[C@H](C)[C@H](C)[NH3+])cc1C ZINC000415004306 386276141 /nfs/dbraw/zinc/27/61/41/386276141.db2.gz HNNFJJRUUPGXBE-NWDGAFQWSA-N 2 0 206.333 2.129 20 0 BEADRP C[C@@H]1C[C@@H](C[N@H+](C)[C@H]2CC2(C)C)CC[NH2+]1 ZINC000414741523 386324087 /nfs/dbraw/zinc/32/40/87/386324087.db2.gz MNYYBZLLZOINKV-WOPDTQHZSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@H]1[C@H](N2CCCC2)CC[N@@H+]1CCC1CC1 ZINC000347349102 386343562 /nfs/dbraw/zinc/34/35/62/386343562.db2.gz VEXXCMNBFDWXFZ-GXTWGEPZSA-N 2 0 222.376 2.345 20 0 BEADRP C[C@]1(C[NH2+]Cc2ccc(F)cc2)CCC[NH2+]C1 ZINC000414905291 386354266 /nfs/dbraw/zinc/35/42/66/386354266.db2.gz OKLIFRQYPBBYOP-AWEZNQCLSA-N 2 0 236.334 2.305 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CCCC1CCOCC1 ZINC000415007359 386358740 /nfs/dbraw/zinc/35/87/40/386358740.db2.gz BJPAFWGSWUIBHH-ZDUSSCGKSA-N 2 0 242.407 2.300 20 0 BEADRP C[C@H]([NH3+])[C@H](C)[NH2+]CCSCc1ccccc1 ZINC000415007418 386361332 /nfs/dbraw/zinc/36/13/32/386361332.db2.gz CSEGCGISVAZURS-RYUDHWBXSA-N 2 0 238.400 2.245 20 0 BEADRP C[C@H]([NH2+]CC1(N(C)C)CCC1)C1CCC1 ZINC000336774741 386364973 /nfs/dbraw/zinc/36/49/73/386364973.db2.gz ZOZUHDKEZYKYOT-NSHDSACASA-N 2 0 210.365 2.249 20 0 BEADRP CC(C)C[C@H]1CCC[N@H+](C[C@H]2CC[NH2+]C2)C1 ZINC000647890131 386367264 /nfs/dbraw/zinc/36/72/64/386367264.db2.gz TWIFOQDGLBBYHH-KGLIPLIRSA-N 2 0 224.392 2.354 20 0 BEADRP Cn1ccc(C[NH2+]CC(C)(C)C[NH+]2CCCC2)c1 ZINC000276706210 386367438 /nfs/dbraw/zinc/36/74/38/386367438.db2.gz OZIWHSJFPHFZPE-UHFFFAOYSA-N 2 0 249.402 2.237 20 0 BEADRP [NH3+]CCCC[NH2+][C@H]1CCCC[C@@H]1C1CC1 ZINC000414902512 386329072 /nfs/dbraw/zinc/32/90/72/386329072.db2.gz JUWHDVSFDHEENO-OLZOCXBDSA-N 2 0 210.365 2.284 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@H]2CC[NH2+]C2)[C@H](C)C1 ZINC000414902731 386331542 /nfs/dbraw/zinc/33/15/42/386331542.db2.gz HLRDWZFHKPCFOQ-NDBYEHHHSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@H]1CC2(C[N@@H+]1Cc1ccncc1)CC[NH2+]CC2 ZINC000335275532 386335135 /nfs/dbraw/zinc/33/51/35/386335135.db2.gz CEHMAXFWICFHFG-ZDUSSCGKSA-N 2 0 245.370 2.046 20 0 BEADRP CC(C)[C@H]1CC[N@H+](CC[C@H]2CCC[NH+]2C)C1 ZINC000336681587 386337083 /nfs/dbraw/zinc/33/70/83/386337083.db2.gz QWSHAMKSXMCEKQ-UONOGXRCSA-N 2 0 224.392 2.449 20 0 BEADRP CC(C)[C@@H]1CC[N@H+](CC[C@@H]2CCC[NH+]2C)C1 ZINC000336681586 386337939 /nfs/dbraw/zinc/33/79/39/386337939.db2.gz QWSHAMKSXMCEKQ-KGLIPLIRSA-N 2 0 224.392 2.449 20 0 BEADRP C[C@H]1CC2(C[N@@H+]1CC1CCC1)CC[NH2+]CC2 ZINC000335276470 386338762 /nfs/dbraw/zinc/33/87/62/386338762.db2.gz DNVWVGODXPFFGT-LBPRGKRZSA-N 2 0 222.376 2.251 20 0 BEADRP CCN(CC[NH2+][C@H]1CCC12CCC2)C1CC1 ZINC000336754138 386441458 /nfs/dbraw/zinc/44/14/58/386441458.db2.gz FKHACAKWTGLSJR-ZDUSSCGKSA-N 2 0 222.376 2.393 20 0 BEADRP C[C@@H]1CCC[C@@H]1C[NH2+][C@H]1CC[N@H+](C)C[C@@H]1C ZINC000336775788 386389546 /nfs/dbraw/zinc/38/95/46/386389546.db2.gz CRNNJBUSBORSKR-RQJABVFESA-N 2 0 224.392 2.352 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@@H]1CCC[C@@H]2C[C@@]21C ZINC000336776017 386390676 /nfs/dbraw/zinc/39/06/76/386390676.db2.gz DJCQYDUOVJUTRG-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@H]([NH2+][C@H](C)CC[NH+](C)C)c1ccncc1 ZINC000347419477 386396872 /nfs/dbraw/zinc/39/68/72/386396872.db2.gz NKPZSTPEEPSDIQ-OCCSQVGLSA-N 2 0 235.375 2.463 20 0 BEADRP COC1CC([NH2+]CCC[NH+](C(C)C)C(C)C)C1 ZINC000347431545 386402200 /nfs/dbraw/zinc/40/22/00/386402200.db2.gz OLJIZYAJVNCCLE-UHFFFAOYSA-N 2 0 242.407 2.262 20 0 BEADRP CC[C@@H]1C[C@H](C)C[N@@H+]1CC[C@H]1CCC[NH2+]C1 ZINC000399163022 386428875 /nfs/dbraw/zinc/42/88/75/386428875.db2.gz LOLHRVQTVQATEM-BFHYXJOUSA-N 2 0 224.392 2.497 20 0 BEADRP CC1(C[N@@H+]2CCC[C@H]([C@@H]3CC[NH2+]C3)C2)CCC1 ZINC000414775187 386470414 /nfs/dbraw/zinc/47/04/14/386470414.db2.gz GGSQITKINANGRQ-KGLIPLIRSA-N 2 0 236.403 2.498 20 0 BEADRP CCCC[C@@H](COC)[NH2+]CC1(C)CC[NH2+]CC1 ZINC000414912624 386476676 /nfs/dbraw/zinc/47/66/76/386476676.db2.gz VLOALFINQDLGCP-ZDUSSCGKSA-N 2 0 242.407 2.171 20 0 BEADRP C[C@H](CCCC(F)(F)F)[NH2+]C1CC[NH2+]CC1 ZINC000414775835 386477139 /nfs/dbraw/zinc/47/71/39/386477139.db2.gz DLDPARLLAHHUMM-SECBINFHSA-N 2 0 238.297 2.449 20 0 BEADRP CC[C@H]1C[N@H+](CCCc2ccncc2)CC[C@H]1[NH3+] ZINC000647934485 386479057 /nfs/dbraw/zinc/47/90/57/386479057.db2.gz GXQUJUQYYXROGD-LSDHHAIUSA-N 2 0 247.386 2.073 20 0 BEADRP C[C@@H](C[NH2+]CCCC[NH3+])c1ccc(F)cc1 ZINC000414913033 386480142 /nfs/dbraw/zinc/48/01/42/386480142.db2.gz VNTOIIPRNHNVOB-NSHDSACASA-N 2 0 224.323 2.258 20 0 BEADRP C1CC2(C1)CCC[C@H]2[NH2+]C1CC[NH2+]CC1 ZINC000335453909 386529151 /nfs/dbraw/zinc/52/91/51/386529151.db2.gz XNXNUOJZVJLUBY-GFCCVEGCSA-N 2 0 208.349 2.051 20 0 BEADRP COC[C@H](CC(C)C)[NH2+]C[C@H]1CCC[C@@H]([NH3+])C1 ZINC000415014634 386500047 /nfs/dbraw/zinc/50/00/47/386500047.db2.gz ZYUMULKSTTTXNW-MJBXVCDLSA-N 2 0 242.407 2.155 20 0 BEADRP COC[C@@H](CC(C)C)[NH2+][C@H](C)CCCC[NH3+] ZINC000415015638 386500298 /nfs/dbraw/zinc/50/02/98/386500298.db2.gz ONPIEBBTJKMPQN-CHWSQXEVSA-N 2 0 230.396 2.155 20 0 BEADRP C[N@H+](CCCCOc1ccccc1)C1CC([NH3+])C1 ZINC000414781544 386500313 /nfs/dbraw/zinc/50/03/13/386500313.db2.gz VTBAADDRGJJXNX-UHFFFAOYSA-N 2 0 248.370 2.267 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+]C1C[C@H](C)C[C@@H](C)C1 ZINC000414787811 386529750 /nfs/dbraw/zinc/52/97/50/386529750.db2.gz CRIBUPPLDQJFPU-WZRBSPASSA-N 2 0 212.381 2.384 20 0 BEADRP FC(F)c1ccc(C[NH2+]C2CC[NH2+]CC2)cc1 ZINC000414782772 386503528 /nfs/dbraw/zinc/50/35/28/386503528.db2.gz PJTPIZYQZLRLPF-UHFFFAOYSA-N 2 0 240.297 2.466 20 0 BEADRP CC(C)[C@H]1C[C@@H](C[NH2+][C@H](C)CCC[NH3+])CCO1 ZINC000415017449 386503951 /nfs/dbraw/zinc/50/39/51/386503951.db2.gz FMOFCOGGIOMMOP-HZSPNIEDSA-N 2 0 242.407 2.155 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]C/C=C\c1ccccc1 ZINC000415017809 386504039 /nfs/dbraw/zinc/50/40/39/386504039.db2.gz GDJGLBCOFWDJOH-HKBVPSITSA-N 2 0 218.344 2.417 20 0 BEADRP C[C@H]1[C@@H]([NH3+])CC[N@@H+]1C[C@@H]1CCC[C@H](C)C1 ZINC000415050483 386504880 /nfs/dbraw/zinc/50/48/80/386504880.db2.gz CWZZBTQGWYSFDC-RVMXOQNASA-N 2 0 210.365 2.234 20 0 BEADRP CC(C)CC[N@@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1 ZINC000414783679 386508547 /nfs/dbraw/zinc/50/85/47/386508547.db2.gz QIRTVPPXCGCHHO-KBPBESRZSA-N 2 0 224.392 2.354 20 0 BEADRP CC[C@@H]1C[C@@H](C[NH2+][C@@H](C)CCCC[NH3+])CCO1 ZINC000415022000 386511177 /nfs/dbraw/zinc/51/11/77/386511177.db2.gz ZFXJYASSCKJOES-MELADBBJSA-N 2 0 242.407 2.299 20 0 BEADRP COc1cc(C[NH2+][C@@H](C)CCC[NH3+])ccc1C ZINC000415022321 386511915 /nfs/dbraw/zinc/51/19/15/386511915.db2.gz LHDYDXOCWPSBLG-LBPRGKRZSA-N 2 0 236.359 2.221 20 0 BEADRP Cc1ccncc1C[NH2+]C[C@H]1CC[C@H](C[NH3+])CC1 ZINC000415025563 386513268 /nfs/dbraw/zinc/51/32/68/386513268.db2.gz QKNZEJMWHMSWDN-HDJSIYSDSA-N 2 0 247.386 2.245 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]C[C@@H]1CCOc2ccccc21 ZINC000415024636 386514844 /nfs/dbraw/zinc/51/48/44/386514844.db2.gz PGZZWTHMFDZEIC-STQMWFEESA-N 2 0 248.370 2.270 20 0 BEADRP C[C@H]1CCCC[C@H]1C[N@@H+]1CCC[C@H]2C[NH2+]C[C@H]21 ZINC000414785779 386514912 /nfs/dbraw/zinc/51/49/12/386514912.db2.gz TWXGJKOMDVDABX-ZQDZILKHSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]Cc1cc(F)cc(F)c1 ZINC000415027980 386516897 /nfs/dbraw/zinc/51/68/97/386516897.db2.gz XPGBCAPDSUPUBY-VIFPVBQESA-N 2 0 228.286 2.182 20 0 BEADRP CCc1cc(OC)ccc1CN1CC[C@@H]([NH3+])[C@@H]1C ZINC000414784787 386517059 /nfs/dbraw/zinc/51/70/59/386517059.db2.gz LIFCMEKNIVLGBE-XHDPSFHLSA-N 2 0 248.370 2.179 20 0 BEADRP [NH3+]C[C@@H]1CC[C@H]([NH2+]Cc2cc(F)ccc2F)C1 ZINC000415030710 386518800 /nfs/dbraw/zinc/51/88/00/386518800.db2.gz FWWBSKCKDJMUOO-SKDRFNHKSA-N 2 0 240.297 2.182 20 0 BEADRP CCOc1ccc(C[NH2+][C@@H]2CC[C@@H](C[NH3+])C2)cc1 ZINC000415029945 386520150 /nfs/dbraw/zinc/52/01/50/386520150.db2.gz FDSBXTXJIAMHHE-ZIAGYGMSSA-N 2 0 248.370 2.302 20 0 BEADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@H]2CCc3ccccc3C2)C1 ZINC000415034546 386521181 /nfs/dbraw/zinc/52/11/81/386521181.db2.gz JYKVUICRUUBQJO-WQVCFCJDSA-N 2 0 244.382 2.261 20 0 BEADRP C[C@H](CCC1CC1)[NH2+][C@@H]1CC[C@H](C[NH3+])C1 ZINC000415033149 386521354 /nfs/dbraw/zinc/52/13/54/386521354.db2.gz IQJPQBOMVXDZLZ-KGYLQXTDSA-N 2 0 210.365 2.282 20 0 BEADRP Cc1occc1C[NH2+]CCCC[NH+](C)C ZINC000390400051 386525388 /nfs/dbraw/zinc/52/53/88/386525388.db2.gz SYKLNMHJIHWWIM-UHFFFAOYSA-N 2 0 210.321 2.019 20 0 BEADRP C[C@H](C[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21)CC1CCCCC1 ZINC000415040130 386526449 /nfs/dbraw/zinc/52/64/49/386526449.db2.gz PUWMFWGYNDSYSC-SPWCGHHHSA-N 2 0 236.403 2.400 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@@H]1CCc2ccccc2C1 ZINC000414786470 386526858 /nfs/dbraw/zinc/52/68/58/386526858.db2.gz BHBPFGFGMCGDCL-HUUCEWRRSA-N 2 0 232.371 2.117 20 0 BEADRP C[C@H](C[N@@H+]1CC[C@H]([NH3+])[C@@H](C)C1)c1ccccc1 ZINC000094339088 386458002 /nfs/dbraw/zinc/45/80/02/386458002.db2.gz NLMVPNGWBMQFEC-IPYPFGDCSA-N 2 0 232.371 2.459 20 0 BEADRP CCSCC[NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1 ZINC000336781311 386583452 /nfs/dbraw/zinc/58/34/52/386583452.db2.gz UINJDPPNPLQGJF-ZDUSSCGKSA-N 2 0 244.448 2.450 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H](C)c1ccccn1 ZINC000336644141 386587212 /nfs/dbraw/zinc/58/72/12/386587212.db2.gz BUURXPOQQGXHLM-NEPJUHHUSA-N 2 0 221.348 2.250 20 0 BEADRP CC(C)C[C@H]([NH3+])C[NH2+]CCc1cccs1 ZINC000415078946 386589711 /nfs/dbraw/zinc/58/97/11/386589711.db2.gz HJFINIYBXDWDDV-NSHDSACASA-N 2 0 226.389 2.254 20 0 BEADRP Cc1cccc(C)c1CC[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000415081590 386592431 /nfs/dbraw/zinc/59/24/31/386592431.db2.gz KKODZDHSCCUDNY-OAHLLOKOSA-N 2 0 246.398 2.435 20 0 BEADRP [NH3+]C[C@H]1CC[C@@H]([NH2+]Cc2ncc(Cl)s2)C1 ZINC000415045503 386532403 /nfs/dbraw/zinc/53/24/03/386532403.db2.gz UDKVTEREIJTVBJ-JGVFFNPUSA-N 2 0 245.779 2.014 20 0 BEADRP [NH3+]C[C@@H]1CC[C@H]([NH2+]Cc2ccc(F)cc2)C1 ZINC000415047828 386534233 /nfs/dbraw/zinc/53/42/33/386534233.db2.gz WFVCOSABCSHRQY-YPMHNXCESA-N 2 0 222.307 2.043 20 0 BEADRP CC1(C)CC[C@H]([NH2+][C@H]2CC[C@@H](C[NH3+])C2)C1 ZINC000415047383 386534378 /nfs/dbraw/zinc/53/43/78/386534378.db2.gz WAKTZXPOYKPXFT-WOPDTQHZSA-N 2 0 210.365 2.282 20 0 BEADRP COc1ccsc1CN[C@@H](C[NH3+])C(C)(C)C ZINC000415056048 386537709 /nfs/dbraw/zinc/53/77/09/386537709.db2.gz PDYRHBZIWHITHI-NSHDSACASA-N 2 0 242.388 2.220 20 0 BEADRP [NH3+]CCC[C@H]([NH2+]CC1CC1)c1ccccc1 ZINC000415058164 386540464 /nfs/dbraw/zinc/54/04/64/386540464.db2.gz SWBUGGSZWVSMJG-AWEZNQCLSA-N 2 0 218.344 2.466 20 0 BEADRP CC(C)(C)CC[NH2+][C@H](CN)C(C)(C)C ZINC000415059798 386540756 /nfs/dbraw/zinc/54/07/56/386540756.db2.gz ZDNCSIIKELYYPF-SNVBAGLBSA-N 2 0 200.370 2.386 20 0 BEADRP CC(C)(C)[C@@H](C[NH3+])NCc1ccc(F)cc1F ZINC000415058152 386541288 /nfs/dbraw/zinc/54/12/88/386541288.db2.gz SSMYJGPKXGHYIR-GFCCVEGCSA-N 2 0 242.313 2.428 20 0 BEADRP CCc1cnc(CN[C@@H](C[NH3+])C(C)(C)C)s1 ZINC000415058697 386542473 /nfs/dbraw/zinc/54/24/73/386542473.db2.gz WLFKFAIVCHFSKE-JTQLQIEISA-N 2 0 241.404 2.169 20 0 BEADRP Cc1ccc2c(c1)[C@@H]([NH2+]CC1C[NH2+]C1)[C@@H](C)C2 ZINC000335460897 386542560 /nfs/dbraw/zinc/54/25/60/386542560.db2.gz HASNRCIEFWXDNF-NHYWBVRUSA-N 2 0 230.355 2.037 20 0 BEADRP CC(C)C[C@@H](C)C[NH2+]CCC[NH2+]C1CC1 ZINC000415064547 386544004 /nfs/dbraw/zinc/54/40/04/386544004.db2.gz CVOAQARYCMUQBO-GFCCVEGCSA-N 2 0 212.381 2.400 20 0 BEADRP CC(C)(C)C[NH+]1CCC([C@H]2CCC[NH2+]2)CC1 ZINC000063197380 386552471 /nfs/dbraw/zinc/55/24/71/386552471.db2.gz WUYSDMPFHWGTFA-CYBMUJFWSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+][C@H]2CCCC[NH2+]C2)C1 ZINC000415071007 386554447 /nfs/dbraw/zinc/55/44/47/386554447.db2.gz RZPNTTPNBWRBBY-UPJWGTAASA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+][C@H]1CCCC[NH2+]C1 ZINC000415070989 386554760 /nfs/dbraw/zinc/55/47/60/386554760.db2.gz JJHGOIBKIDWTPA-ZJUUUORDSA-N 2 0 238.297 2.449 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@@H]1CCC[C@@H](C)[C@@H]1C ZINC000414794292 386557911 /nfs/dbraw/zinc/55/79/11/386557911.db2.gz LSVJAZJEJIXQTK-YVECIDJPSA-N 2 0 212.381 2.384 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@H](C)Cc1ccccc1F ZINC000414794388 386560616 /nfs/dbraw/zinc/56/06/16/386560616.db2.gz LZRNTEZWSYELGY-BXUZGUMPSA-N 2 0 238.350 2.330 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000414919806 386564149 /nfs/dbraw/zinc/56/41/49/386564149.db2.gz XUAAOESODCJXIV-AAEUAGOBSA-N 2 0 210.365 2.154 20 0 BEADRP CCSCC[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000336756901 386573649 /nfs/dbraw/zinc/57/36/49/386573649.db2.gz HFFHQOSIMKIIAU-UHFFFAOYSA-N 2 0 242.432 2.346 20 0 BEADRP CC(C)C1CC([NH2+][C@H]2CCCC[NH2+]C2)C1 ZINC000335496226 386619411 /nfs/dbraw/zinc/61/94/11/386619411.db2.gz OLUMWCIFDKRKNO-CPCZMJQVSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1C[C@H](C[NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)CC[NH2+]1 ZINC000415104427 386623826 /nfs/dbraw/zinc/62/38/26/386623826.db2.gz DYSUCLXRVQNRSW-XGFWRYKXSA-N 2 0 222.376 2.153 20 0 BEADRP CC(C)(C)[C@@H]1CCC[C@H]1[NH2+][C@H]1CC[NH2+]C1 ZINC000415123491 386626748 /nfs/dbraw/zinc/62/67/48/386626748.db2.gz NAAQURRZVSJOMF-QJPTWQEYSA-N 2 0 210.365 2.153 20 0 BEADRP Cc1cncc([C@H](C)[NH2+]C2CCC([NH3+])CC2)c1 ZINC000335500235 386627289 /nfs/dbraw/zinc/62/72/89/386627289.db2.gz OLPPBHAWBKQFHG-XGNXJENSSA-N 2 0 233.359 2.311 20 0 BEADRP C[C@@H]([NH3+])c1ccc(NC[C@H]2CCC[NH2+]C2)cc1 ZINC000414813270 386642928 /nfs/dbraw/zinc/64/29/28/386642928.db2.gz QOYMVGFDBNHJPH-NEPJUHHUSA-N 2 0 233.359 2.118 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]C[C@H]1CC12CC2 ZINC000417371114 386644427 /nfs/dbraw/zinc/64/44/27/386644427.db2.gz VAUYLEDYZJIRPF-FDYHWXHSSA-N 2 0 222.376 2.105 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]C[C@@H]1CC12CC2 ZINC000417371115 386644749 /nfs/dbraw/zinc/64/47/49/386644749.db2.gz VAUYLEDYZJIRPF-FVCCEPFGSA-N 2 0 222.376 2.105 20 0 BEADRP C[C@@H]([NH3+])c1ccc(CNCC[NH2+]C(C)(C)C)cc1 ZINC000414815263 386650316 /nfs/dbraw/zinc/65/03/16/386650316.db2.gz OYZCUIHVIQVWCP-GFCCVEGCSA-N 2 0 249.402 2.184 20 0 BEADRP C[C@H](CCCC(F)(F)F)[NH2+]CC(C)(C)[NH3+] ZINC000414804622 386608369 /nfs/dbraw/zinc/60/83/69/386608369.db2.gz NSFMYBJQEAJCPQ-MRVPVSSYSA-N 2 0 226.286 2.434 20 0 BEADRP CC[C@H]([NH2+][C@H](C)C[C@H]1CCC[NH2+]1)[C@H]1CCCO1 ZINC000415090107 386611228 /nfs/dbraw/zinc/61/12/28/386611228.db2.gz ZYCYCQWUYYYGEV-YIYPIFLZSA-N 2 0 240.391 2.064 20 0 BEADRP C1CC2(CCCC2)[C@H]1[NH2+][C@@H]1CCCC[NH2+]C1 ZINC000335493634 386613973 /nfs/dbraw/zinc/61/39/73/386613973.db2.gz BLIKMVGSHNTIKB-OLZOCXBDSA-N 2 0 222.376 2.441 20 0 BEADRP C[NH+](C)CCC[NH2+][C@H]1CCCc2ccccc2C1 ZINC000648402750 386615337 /nfs/dbraw/zinc/61/53/37/386615337.db2.gz TYJDMEPZQIXRQB-INIZCTEOSA-N 2 0 246.398 2.475 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]CCC1CC(F)(F)C1 ZINC000453432678 386615710 /nfs/dbraw/zinc/61/57/10/386615710.db2.gz SBRCTWXFJFAMAX-ZYHUDNBSSA-N 2 0 246.345 2.352 20 0 BEADRP Cc1ccc(C[NH2+]C[C@@]2(C)CC[NH2+]C2)cc1F ZINC000415108024 386616538 /nfs/dbraw/zinc/61/65/38/386616538.db2.gz OMGIJRMRMNWZQZ-AWEZNQCLSA-N 2 0 236.334 2.223 20 0 BEADRP C[C@H]([NH3+])c1ccc(C[NH2+]C2CCC([NH3+])CC2)cc1 ZINC000414807236 386617119 /nfs/dbraw/zinc/61/71/19/386617119.db2.gz CJLOOGFWQCJLEY-QGLTVNCISA-N 3 0 247.386 2.066 20 0 BEADRP Cc1cc(C)cc(CN2CCC[C@@H]([NH3+])C2)c1 ZINC000041029184 386660605 /nfs/dbraw/zinc/66/06/05/386660605.db2.gz JQNGPNOTZGGZCK-CQSZACIVSA-N 2 0 218.344 2.227 20 0 BEADRP Cc1ccc(C)c(OCCN2CCC[C@@H]([NH3+])C2)c1 ZINC000041029140 386660738 /nfs/dbraw/zinc/66/07/38/386660738.db2.gz PKVCZXLZWLHDIN-CQSZACIVSA-N 2 0 248.370 2.105 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000414819727 386661633 /nfs/dbraw/zinc/66/16/33/386661633.db2.gz IETCONFINBWLCD-AEJSXWLSSA-N 2 0 238.297 2.434 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+]C[C@@H]1CCC[NH2+]1 ZINC000414820342 386664290 /nfs/dbraw/zinc/66/42/90/386664290.db2.gz AMUJHORBCOENIZ-BDAKNGLRSA-N 2 0 224.270 2.059 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CCC[NH2+]C1)c1ccccc1 ZINC000041231972 386664855 /nfs/dbraw/zinc/66/48/55/386664855.db2.gz QNXFKBXEIYLNOW-CHWSQXEVSA-N 2 0 218.344 2.337 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]C[C@@H](C)c1ccccc1 ZINC000414830789 386710614 /nfs/dbraw/zinc/71/06/14/386710614.db2.gz CKNKZECGQBOBLQ-QWHCGFSZSA-N 2 0 220.360 2.235 20 0 BEADRP CN(C)c1ccccc1C[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000414927724 386710859 /nfs/dbraw/zinc/71/08/59/386710859.db2.gz PGOGHSIOPQRAEY-ZIAGYGMSSA-N 2 0 247.386 2.112 20 0 BEADRP CCc1ccc(C[N@H+](C)C2CC[NH2+]CC2)cc1 ZINC000049962214 386684407 /nfs/dbraw/zinc/68/44/07/386684407.db2.gz FFWIAIWUTUDQJJ-UHFFFAOYSA-N 2 0 232.371 2.433 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCC1(C)C)C[NH+]1CCCC1 ZINC000336648484 386684563 /nfs/dbraw/zinc/68/45/63/386684563.db2.gz GEHLQYZNHRLLBE-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@H]1CCC[C@@H](C2CC2)C1 ZINC000414825139 386686345 /nfs/dbraw/zinc/68/63/45/386686345.db2.gz SANZXOQVZJTACX-UHTWSYAYSA-N 2 0 210.365 2.282 20 0 BEADRP Cc1cccc(C[NH2+]CC[C@H]2CC[NH2+]C2)c1C ZINC000414826691 386687589 /nfs/dbraw/zinc/68/75/89/386687589.db2.gz GARVLDVOOGZQDY-CQSZACIVSA-N 2 0 232.371 2.393 20 0 BEADRP CCOc1ccccc1C[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000414825416 386691069 /nfs/dbraw/zinc/69/10/69/386691069.db2.gz CDYOYQQXYNMJHO-CYBMUJFWSA-N 2 0 248.370 2.175 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]CC[C@H]2CC[NH2+]C2)C1 ZINC000414827902 386693318 /nfs/dbraw/zinc/69/33/18/386693318.db2.gz IBMAHNPPLUQSHK-UPJWGTAASA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H](C)CCCC(F)(F)F ZINC000414828147 386697356 /nfs/dbraw/zinc/69/73/56/386697356.db2.gz ZAYZKKFPVBQLQX-IUCAKERBSA-N 2 0 226.286 2.434 20 0 BEADRP Cc1cc(C)cc(C[NH2+]C[C@@H]2CCC[NH2+]C2)c1 ZINC000414827285 386704006 /nfs/dbraw/zinc/70/40/06/386704006.db2.gz KHEPPLKBZVRMPR-CQSZACIVSA-N 2 0 232.371 2.393 20 0 BEADRP Cc1ccccc1CN[C@@H](C[NH3+])CC(C)C ZINC000414837227 386735971 /nfs/dbraw/zinc/73/59/71/386735971.db2.gz JEVUDHYKIRGWON-CQSZACIVSA-N 2 0 220.360 2.458 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H](C)C1CCCCC1 ZINC000414840550 386739020 /nfs/dbraw/zinc/73/90/20/386739020.db2.gz MLJPTCMGYKXLKN-RYUDHWBXSA-N 2 0 212.381 2.400 20 0 BEADRP CC(C)C1CC([NH2+][C@@H]2CC[NH2+][C@H](C)C2)C1 ZINC000335537778 386740810 /nfs/dbraw/zinc/74/08/10/386740810.db2.gz FGWZNHNNXHASTD-CQLXCSJHSA-N 2 0 210.365 2.151 20 0 BEADRP C[C@H](Cc1ccccc1)C[N@@H+]1C[C@@H](C)[C@@H]([NH3+])C1 ZINC000340693014 386713759 /nfs/dbraw/zinc/71/37/59/386713759.db2.gz WXKOYBGDRLIFOZ-NFAWXSAZSA-N 2 0 232.371 2.144 20 0 BEADRP CC(C)[C@H]1CCC[C@@H]1[NH2+]C1CC[NH2+]CC1 ZINC000335484926 386713679 /nfs/dbraw/zinc/71/36/79/386713679.db2.gz XKJHVEIRZDOSIG-OLZOCXBDSA-N 2 0 210.365 2.153 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H]1CCC[C@@H]1C(C)C ZINC000414833685 386715097 /nfs/dbraw/zinc/71/50/97/386715097.db2.gz GQACPMYDYDOSFD-XQQFMLRXSA-N 2 0 212.381 2.256 20 0 BEADRP CC(C)(C)C[NH+]1CCC([C@H]2CC[NH2+]C2)CC1 ZINC000357084334 386715492 /nfs/dbraw/zinc/71/54/92/386715492.db2.gz PRBLNOCXACLWQP-ZDUSSCGKSA-N 2 0 224.392 2.354 20 0 BEADRP [NH3+]C[C@H]1CC[C@@H]([NH2+]C2CCC3(CC3)CC2)C1 ZINC000335486511 386717519 /nfs/dbraw/zinc/71/75/19/386717519.db2.gz HEOQTAGNJPAKMO-WCQYABFASA-N 2 0 222.376 2.426 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000414832529 386718373 /nfs/dbraw/zinc/71/83/73/386718373.db2.gz QRKPHNDDIQDLBD-LSGALXMHSA-N 2 0 222.376 2.438 20 0 BEADRP C[C@@H](C[NH2+]CC[C@H]1CC[NH2+]C1)Cc1ccccc1 ZINC000414832256 386718574 /nfs/dbraw/zinc/71/85/74/386718574.db2.gz OGFPOXAUPOMCSF-ZBFHGGJFSA-N 2 0 246.398 2.454 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H](C)CCc1ccccc1 ZINC000414834269 386723389 /nfs/dbraw/zinc/72/33/89/386723389.db2.gz HFQVSLXUGMIPFA-UONOGXRCSA-N 2 0 234.387 2.453 20 0 BEADRP CC(C)[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CCC[NH2+]1 ZINC000414841287 386753651 /nfs/dbraw/zinc/75/36/51/386753651.db2.gz HOBFVCBRHQVGPR-AGIUHOORSA-N 2 0 210.365 2.153 20 0 BEADRP CCC(CC)C[NH2+][C@H](C)[C@H]1CCC[NH2+]C1 ZINC000414842566 386764062 /nfs/dbraw/zinc/76/40/62/386764062.db2.gz BKHOABKXGVYNQH-YPMHNXCESA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H](CC1CCCC1)[NH2+]C[C@@H]1CCC[NH2+]1 ZINC000414843663 386765871 /nfs/dbraw/zinc/76/58/71/386765871.db2.gz JZQFGBOYUCBCHD-YPMHNXCESA-N 2 0 210.365 2.297 20 0 BEADRP CSC1(C[NH2+]C[C@H]2C[C@@H]2C)CC[NH+](C)CC1 ZINC000336668788 386793950 /nfs/dbraw/zinc/79/39/50/386793950.db2.gz GJLKTDGZOJPCOQ-NWDGAFQWSA-N 2 0 242.432 2.059 20 0 BEADRP C[C@@H]1CCC[C@@H](C[N@H+](C)C2CC([NH3+])C2)C1 ZINC000394999400 386795610 /nfs/dbraw/zinc/79/56/10/386795610.db2.gz FPRYAGIQCFMSNG-OKZRHMCRSA-N 2 0 210.365 2.234 20 0 BEADRP Cc1cc(NCC[NH+]2[C@@H](C)CCC[C@@H]2C)cc[nH+]1 ZINC000357681897 386824893 /nfs/dbraw/zinc/82/48/93/386824893.db2.gz JRDPWHRMFBMIRL-KBPBESRZSA-N 2 0 247.386 2.487 20 0 BEADRP C[NH+]1CCC(CC[NH2+][C@H]2CCC2(C)C)CC1 ZINC000336672475 386823125 /nfs/dbraw/zinc/82/31/25/386823125.db2.gz SULVHVBRJYCLIJ-ZDUSSCGKSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1cc(NCC[N@H+]2[C@H](C)CCC[C@@H]2C)cc[nH+]1 ZINC000357681898 386823977 /nfs/dbraw/zinc/82/39/77/386823977.db2.gz JRDPWHRMFBMIRL-OKILXGFUSA-N 2 0 247.386 2.487 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]Cc1ccc(C)c(C)c1 ZINC000414845863 386805713 /nfs/dbraw/zinc/80/57/13/386805713.db2.gz TXNPVADIXPTBEA-LLVKDONJSA-N 2 0 220.360 2.249 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+]C[C@H](C)CC1CCOCC1 ZINC000414935146 386807652 /nfs/dbraw/zinc/80/76/52/386807652.db2.gz AODNPXWOZNQGCK-CHWSQXEVSA-N 2 0 242.407 2.027 20 0 BEADRP CC(C)[C@H]([NH2+][C@H]1CCC[C@H]([NH3+])C1)C1CC1 ZINC000324224225 386829157 /nfs/dbraw/zinc/82/91/57/386829157.db2.gz FXFZDSNPFXYDOE-AVGNSLFASA-N 2 0 210.365 2.281 20 0 BEADRP C[C@H](C[NH2+][C@H](C)CCc1ccco1)C[NH+](C)C ZINC000293364093 386833337 /nfs/dbraw/zinc/83/33/37/386833337.db2.gz HOELPCQAKDREFK-CHWSQXEVSA-N 2 0 238.375 2.388 20 0 BEADRP CC1(C)CCC[NH2+][C@@H]1CNCc1cccc(O)c1 ZINC000414936615 386837472 /nfs/dbraw/zinc/83/74/72/386837472.db2.gz WTHXAHPOXLTLRM-CQSZACIVSA-N 2 0 248.370 2.260 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CC[C@H]2SC)C1 ZINC000425339403 386838941 /nfs/dbraw/zinc/83/89/41/386838941.db2.gz CMWXOWQZOJUBOP-JHJVBQTASA-N 2 0 242.432 2.202 20 0 BEADRP CO[C@@H](C[NH2+]CCCc1cnccc1C)C1CC1 ZINC000293567520 386839787 /nfs/dbraw/zinc/83/97/87/386839787.db2.gz GRUVNMYYIKRIRZ-HNNXBMFYSA-N 2 0 248.370 2.337 20 0 BEADRP [NH3+]C[C@H]1CC[N@H+](Cc2cc3cc(F)ccc3o2)C1 ZINC000334784860 386844975 /nfs/dbraw/zinc/84/49/75/386844975.db2.gz DHEQWBFMELFNHI-SNVBAGLBSA-N 2 0 248.301 2.353 20 0 BEADRP CCSCCC[NH2+][C@@H](C)[C@@H]1CCCC[NH2+]1 ZINC000395078389 386846815 /nfs/dbraw/zinc/84/68/15/386846815.db2.gz NMPHQRODYMNBGT-RYUDHWBXSA-N 2 0 230.421 2.250 20 0 BEADRP CC(C)CC[NH+]1CCC(C[NH+](C)C)CC1 ZINC000341167405 386849493 /nfs/dbraw/zinc/84/94/93/386849493.db2.gz DWZHBQHQNDNDER-UHFFFAOYSA-N 2 0 212.381 2.306 20 0 BEADRP C1[C@@H]([NH2+]C2CCCCC2)[C@@H]1C1CC[NH2+]CC1 ZINC000334832952 386870369 /nfs/dbraw/zinc/87/03/69/386870369.db2.gz JLTUMYRITFKFBD-UONOGXRCSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H]1C[C@@H](C[N@@H+]2CCCC3(CC3)C2)CC[NH2+]1 ZINC000334833062 386871459 /nfs/dbraw/zinc/87/14/59/386871459.db2.gz MLXQMHFWYILIHR-STQMWFEESA-N 2 0 222.376 2.251 20 0 BEADRP Cc1cc(C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)ccc1F ZINC000334846799 386894702 /nfs/dbraw/zinc/89/47/02/386894702.db2.gz PXQBLGJZKYSZJF-OLZOCXBDSA-N 2 0 236.334 2.494 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CC[NH2+][C@H](C)C2)s1 ZINC000334863357 386917749 /nfs/dbraw/zinc/91/77/49/386917749.db2.gz NUQWBBMKPNWXQA-KOLCDFICSA-N 2 0 224.373 2.287 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]Cc2ccc(F)cc2)CC[NH2+]1 ZINC000334862397 386917957 /nfs/dbraw/zinc/91/79/57/386917957.db2.gz LCXGDWZCOBJYDQ-GWCFXTLKSA-N 2 0 222.307 2.056 20 0 BEADRP Fc1cccc2c1CC[C@@H]2[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000334862415 386918295 /nfs/dbraw/zinc/91/82/95/386918295.db2.gz LIIKPFAYKZAHGM-ABAIWWIYSA-N 2 0 248.345 2.402 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CC[NH2+]C[C@H]2C)c(C)c1 ZINC000334853615 386904626 /nfs/dbraw/zinc/90/46/26/386904626.db2.gz FAKOIAUYVCNPIO-UKRRQHHQSA-N 2 0 232.371 2.391 20 0 BEADRP C[C@@H]1CC(C)(C)C[N@@H+]1CC1CC[NH2+]CC1 ZINC000334856445 386908534 /nfs/dbraw/zinc/90/85/34/386908534.db2.gz XPBAATXZVRSCCD-LLVKDONJSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@]1(C[NH2+][C@@H]2CCc3ccccc32)CC[NH2+]C1 ZINC000334865166 386921897 /nfs/dbraw/zinc/92/18/97/386921897.db2.gz RALDCXZVLJRHPB-HUUCEWRRSA-N 2 0 230.355 2.263 20 0 BEADRP COc1cccc2c1CC[C@H]2[NH2+]C1CC[NH2+]CC1 ZINC000334867144 386923686 /nfs/dbraw/zinc/92/36/86/386923686.db2.gz UIHJAGRJHVRBGX-CQSZACIVSA-N 2 0 246.354 2.024 20 0 BEADRP C[C@@H]1Cc2ccccc2[C@@H]1[NH2+]C1CC[NH2+]CC1 ZINC000334866410 386924386 /nfs/dbraw/zinc/92/43/86/386924386.db2.gz QDNRLGBWNBHYDY-IAQYHMDHSA-N 2 0 230.355 2.262 20 0 BEADRP C[C@@H](NCCc1cccs1)[C@@H]1CCCC[NH2+]1 ZINC000395193845 386978517 /nfs/dbraw/zinc/97/85/17/386978517.db2.gz JMOHMQIHMCLNAR-YPMHNXCESA-N 2 0 238.400 2.411 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@H]1CC[C@@H]1C1CCC1 ZINC000336745331 386984349 /nfs/dbraw/zinc/98/43/49/386984349.db2.gz QRHUDXNKTKWCRD-BNOWGMLFSA-N 2 0 224.392 2.495 20 0 BEADRP c1ccc(CCC[N@@H+]2CC[C@@H]3C[NH2+]C[C@@H]3C2)cc1 ZINC000336786238 386991668 /nfs/dbraw/zinc/99/16/68/386991668.db2.gz BLSBULBRIMFOLM-HZPDHXFCSA-N 2 0 244.382 2.161 20 0 BEADRP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]CCC1(C)CC1 ZINC000336763771 387036837 /nfs/dbraw/zinc/03/68/37/387036837.db2.gz PNIBBQFTASDSIT-RYUDHWBXSA-N 2 0 210.365 2.106 20 0 BEADRP CO[C@@H](C)C[N@H+](CCC1CC[NH2+]CC1)C(C)C ZINC000359215345 387067581 /nfs/dbraw/zinc/06/75/81/387067581.db2.gz JUCUZWSLWZKRBT-ZDUSSCGKSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@]1(C[NH+](CC2CC2)CC2CC2)CC[NH2+]C1 ZINC000070064384 387043715 /nfs/dbraw/zinc/04/37/15/387043715.db2.gz CRAKSIIXRQZIJP-AWEZNQCLSA-N 2 0 222.376 2.108 20 0 BEADRP C[C@@H]1CCCC[N@H+](CC[C@@H]2CC[NH2+]C2)C1 ZINC000334966024 387047476 /nfs/dbraw/zinc/04/74/76/387047476.db2.gz DNPNFIITOIVFAB-OLZOCXBDSA-N 2 0 210.365 2.108 20 0 BEADRP C[NH+](C)CCC[NH2+][C@@H]1CC[C@@H]1C1CCC1 ZINC000336764768 387056219 /nfs/dbraw/zinc/05/62/19/387056219.db2.gz QIUZMAJKHBLCCC-CHWSQXEVSA-N 2 0 210.365 2.106 20 0 BEADRP C(C1CCC1)[N@@H+]1CCC[C@@H]([C@@H]2CC[NH2+]C2)C1 ZINC000334978862 387064569 /nfs/dbraw/zinc/06/45/69/387064569.db2.gz CAGYSGDXKAZMOX-ZIAGYGMSSA-N 2 0 222.376 2.108 20 0 BEADRP CS[C@@H]1CC[C@H]1[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC000425372834 387014140 /nfs/dbraw/zinc/01/41/40/387014140.db2.gz UFLLNTWOFWNUBK-JHJVBQTASA-N 2 0 242.432 2.202 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H]1CCc2c1c(F)ccc2F ZINC000423298556 387130271 /nfs/dbraw/zinc/13/02/71/387130271.db2.gz ONTJCPJZKKFEJJ-PRHODGIISA-N 2 0 240.297 2.137 20 0 BEADRP COCc1cccc(C[N@@H+]2CC[C@@H]([C@@H](C)[NH3+])C2)c1 ZINC000126929874 387074594 /nfs/dbraw/zinc/07/45/94/387074594.db2.gz SABPAEWTOLOIJM-IUODEOHRSA-N 2 0 248.370 2.002 20 0 BEADRP CC[C@@H](COC)[NH2+]CCC[N@@H+]1CCCC[C@H]1C ZINC000246366391 387079937 /nfs/dbraw/zinc/07/99/37/387079937.db2.gz LUMXGLFRGMPURO-KGLIPLIRSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@@H]1CCCNc2ccccc21 ZINC000423299540 387130771 /nfs/dbraw/zinc/13/07/71/387130771.db2.gz BUEHPTDVMVUDME-SMDDNHRTSA-N 2 0 233.359 2.118 20 0 BEADRP C[C@H]([NH3+])[C@H]1CCC[N@H+](Cc2ccc(F)cc2)C1 ZINC000070977045 387085732 /nfs/dbraw/zinc/08/57/32/387085732.db2.gz YWFCVJBBGWFRJN-AAEUAGOBSA-N 2 0 236.334 2.385 20 0 BEADRP [NH3+]C[C@H]1CC[N@@H+]([C@@H]2CCCc3ccc(F)cc32)C1 ZINC000334998253 387089747 /nfs/dbraw/zinc/08/97/47/387089747.db2.gz MXVCDUAJPSKNBP-IAQYHMDHSA-N 2 0 248.345 2.484 20 0 BEADRP [NH3+]C[C@@H]1CC[N@@H+]([C@H]2CCCc3ccc(F)cc32)C1 ZINC000334998254 387090596 /nfs/dbraw/zinc/09/05/96/387090596.db2.gz MXVCDUAJPSKNBP-NHYWBVRUSA-N 2 0 248.345 2.484 20 0 BEADRP CCc1cccc(C[N@@H+]2CC[C@@H]([NH3+])[C@@H](C)C2)c1 ZINC000334997514 387090931 /nfs/dbraw/zinc/09/09/31/387090931.db2.gz DHWYBVVNHABFIP-SWLSCSKDSA-N 2 0 232.371 2.418 20 0 BEADRP C[C@H]1C[NH2+]CC[C@H]1[NH2+]C1CCC(C(F)F)CC1 ZINC000335004049 387097738 /nfs/dbraw/zinc/09/77/38/387097738.db2.gz AIELBXVYDMTZMQ-WNYYMSAVSA-N 2 0 246.345 2.398 20 0 BEADRP C[C@H]1C[NH2+]CC[C@@H]1[NH2+]C1CCC(C(F)F)CC1 ZINC000335004051 387097915 /nfs/dbraw/zinc/09/79/15/387097915.db2.gz AIELBXVYDMTZMQ-XKGSQUFQSA-N 2 0 246.345 2.398 20 0 BEADRP CC1(F)CC([NH2+][C@H]2CCCCC[C@@H]2[NH3+])C1 ZINC000335004823 387099298 /nfs/dbraw/zinc/09/92/98/387099298.db2.gz GNOOHVCJVUYLLJ-YECOWLKZSA-N 2 0 214.328 2.127 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]CC1=CCCCC1 ZINC000335004792 387099475 /nfs/dbraw/zinc/09/94/75/387099475.db2.gz GAXYEUKHVRWNLV-TZMCWYRMSA-N 2 0 222.376 2.465 20 0 BEADRP CSC[C@H](C)[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000127341858 387100851 /nfs/dbraw/zinc/10/08/51/387100851.db2.gz DJYDSQREWZXZJW-TVYUQYBPSA-N 2 0 236.384 2.472 20 0 BEADRP CCCc1cccc(C[NH+]2C[C@H]3C[NH2+]C[C@@H]3C2)c1 ZINC000359475285 387108837 /nfs/dbraw/zinc/10/88/37/387108837.db2.gz RGHLAVPMMFGRBC-HZPDHXFCSA-N 2 0 244.382 2.290 20 0 BEADRP [NH3+][C@H]1CCCCC[C@H]1[NH2+]Cc1ccccc1 ZINC000335025405 387115731 /nfs/dbraw/zinc/11/57/31/387115731.db2.gz RMDSFCOGNNJQEO-UONOGXRCSA-N 2 0 218.344 2.436 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CC[NH2+]CC[C@H]2C)cc1 ZINC000335026557 387118148 /nfs/dbraw/zinc/11/81/48/387118148.db2.gz QFHAQNXLLQZBGT-UKRRQHHQSA-N 2 0 232.371 2.473 20 0 BEADRP Cc1cc(C[NH2+][C@@H]2CC[NH2+]CC[C@H]2C)cc(C)n1 ZINC000335029122 387122916 /nfs/dbraw/zinc/12/29/16/387122916.db2.gz NHVQBHUAMXAIHK-IAQYHMDHSA-N 2 0 247.386 2.176 20 0 BEADRP Cc1cc(C)c(C[NH2+][C@H]2CC[NH2+]CC[C@H]2C)cn1 ZINC000335028856 387123285 /nfs/dbraw/zinc/12/32/85/387123285.db2.gz ZHURDHLQIYOFBN-ABAIWWIYSA-N 2 0 247.386 2.176 20 0 BEADRP CCO[C@@H]1C[C@H]([NH2+]C[C@@H](C)C[NH3+])C1(CC)CC ZINC000423298652 387129592 /nfs/dbraw/zinc/12/95/92/387129592.db2.gz AMXSXQYWMBMDQH-RWMBFGLXSA-N 2 0 242.407 2.155 20 0 BEADRP CCC[C@H](C)[C@H](CC)[NH2+]C[C@@H](C)C[NH3+] ZINC000423299157 387129619 /nfs/dbraw/zinc/12/96/19/387129619.db2.gz PLIHWRKUJQIUIS-SRVKXCTJSA-N 2 0 200.370 2.386 20 0 BEADRP COc1ccsc1[C@@H](C)[NH2+]C[C@H](C)C[NH3+] ZINC000423299884 387132502 /nfs/dbraw/zinc/13/25/02/387132502.db2.gz CMVRKQQBZWIOCC-RKDXNWHRSA-N 2 0 228.361 2.002 20 0 BEADRP Cc1csc(C[NH2+]C[C@H]2CCC[C@@H]([NH3+])C2)n1 ZINC000070503305 387067908 /nfs/dbraw/zinc/06/79/08/387067908.db2.gz BNLPELABTYDWGD-WDEREUQCSA-N 2 0 239.388 2.059 20 0 BEADRP [NH3+][C@H]1CCC[C@@H](C[NH2+]Cc2ccccc2)C1 ZINC000070503228 387068549 /nfs/dbraw/zinc/06/85/49/387068549.db2.gz AJQUQEQNKJSLHS-KGLIPLIRSA-N 2 0 218.344 2.294 20 0 BEADRP COc1cccc([C@@H](C)[NH2+]CC2=CC[NH2+]CC2)c1 ZINC000423343583 387192303 /nfs/dbraw/zinc/19/23/03/387192303.db2.gz MAMDNXIHISJUBB-GFCCVEGCSA-N 2 0 246.354 2.266 20 0 BEADRP CC[C@@H]1C[C@@H](C)CC[C@H]1[NH2+]CC1C[NH2+]C1 ZINC000423307345 387143357 /nfs/dbraw/zinc/14/33/57/387143357.db2.gz VTFNBDJTMJMKDH-CYZMBNFOSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]CCCCCO ZINC000229110379 387143544 /nfs/dbraw/zinc/14/35/44/387143544.db2.gz ZUOSHXWHIDEXOJ-KGLIPLIRSA-N 2 0 242.407 2.049 20 0 BEADRP CC[C@@H]1CCCC[C@H]1[NH2+]C[C@H]([NH3+])C1CC1 ZINC000423310661 387145430 /nfs/dbraw/zinc/14/54/30/387145430.db2.gz APDJGHVLDVYFFX-KGYLQXTDSA-N 2 0 210.365 2.282 20 0 BEADRP CCC[NH2+]CC[NH2+][C@H]1CC[C@@H]1C(C)(C)C ZINC000423309030 387147023 /nfs/dbraw/zinc/14/70/23/387147023.db2.gz KUGCHSQSZAXCCI-RYUDHWBXSA-N 2 0 212.381 2.400 20 0 BEADRP CC(C)CO[C@@H]1C[C@@H]([NH2+]C[C@@H](C)C[NH3+])C1(C)C ZINC000423311488 387148757 /nfs/dbraw/zinc/14/87/57/387148757.db2.gz UBELJDWFSNBGFQ-YNEHKIRRSA-N 2 0 242.407 2.011 20 0 BEADRP [NH3+][C@H](C[NH2+][C@H]1CCCC12CCCC2)C1CC1 ZINC000423310686 387149144 /nfs/dbraw/zinc/14/91/44/387149144.db2.gz ARPKBSQVPLZASF-OLZOCXBDSA-N 2 0 222.376 2.426 20 0 BEADRP CCC[C@@H]([NH2+]C[C@H](C)C[NH3+])c1ccccn1 ZINC000423313270 387150520 /nfs/dbraw/zinc/15/05/20/387150520.db2.gz WTAIOVWJJJQNST-VXGBXAGGSA-N 2 0 221.348 2.107 20 0 BEADRP CC(C)[C@H](Cc1ccccc1)[NH2+]C[C@H](C)C[NH3+] ZINC000423312775 387151402 /nfs/dbraw/zinc/15/14/02/387151402.db2.gz VSFXWEFRBNKUSP-HIFRSBDPSA-N 2 0 234.387 2.438 20 0 BEADRP C[N@@H+]1CCC[C@@H]1CC[NH+]1CCCC2(CC2)C1 ZINC000187006226 387153909 /nfs/dbraw/zinc/15/39/09/387153909.db2.gz XNTXCLHTMKNITR-CYBMUJFWSA-N 2 0 222.376 2.347 20 0 BEADRP [NH3+][C@H](C[NH2+][C@H]1CCC[C@@H]1CCCF)C1CC1 ZINC000423317183 387156756 /nfs/dbraw/zinc/15/67/56/387156756.db2.gz KAWQMZGXGIRGHU-UPJWGTAASA-N 2 0 228.355 2.232 20 0 BEADRP C[C@@H](CCCc1cccnc1)[NH2+]C[C@@H]([NH3+])C1CC1 ZINC000423320241 387161841 /nfs/dbraw/zinc/16/18/41/387161841.db2.gz MFTXSOQQAXFJNA-SWLSCSKDSA-N 2 0 247.386 2.120 20 0 BEADRP C[C@H](Cc1ccsc1)[NH2+]CCCC[NH3+] ZINC000571742927 387167946 /nfs/dbraw/zinc/16/79/46/387167946.db2.gz YWLJIFVIBMUEOK-SNVBAGLBSA-N 2 0 212.362 2.008 20 0 BEADRP [NH3+]CCCC[NH2+][C@H](c1cccnc1)C1CCC1 ZINC000423328042 387169515 /nfs/dbraw/zinc/16/95/15/387169515.db2.gz NSFNZXMHSLICIO-AWEZNQCLSA-N 2 0 233.359 2.251 20 0 BEADRP C[C@@H]([NH2+]CC1C[NH2+]C1)c1cccc(C2CC2)c1 ZINC000423328123 387171055 /nfs/dbraw/zinc/17/10/55/387171055.db2.gz SAYLUYDERVPMAY-LLVKDONJSA-N 2 0 230.355 2.434 20 0 BEADRP [NH3+]CCCC[NH2+][C@@H](c1cccnc1)C1CCC1 ZINC000423328043 387171093 /nfs/dbraw/zinc/17/10/93/387171093.db2.gz NSFNZXMHSLICIO-CQSZACIVSA-N 2 0 233.359 2.251 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]CC2=CC[NH2+]CC2)[C@@H]1C ZINC000423328770 387171936 /nfs/dbraw/zinc/17/19/36/387171936.db2.gz ATULSJZAWNQGNY-YRGRVCCFSA-N 2 0 222.376 2.320 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]CC2=CC[NH2+]CC2)[C@H]1C ZINC000423328769 387172456 /nfs/dbraw/zinc/17/24/56/387172456.db2.gz ATULSJZAWNQGNY-MBNYWOFBSA-N 2 0 222.376 2.320 20 0 BEADRP CCC[C@H]([NH2+]C[C@H]1CC[NH2+]C1)C(C)(C)C ZINC000423330726 387174822 /nfs/dbraw/zinc/17/48/22/387174822.db2.gz GBVQJSJGBLFEDY-RYUDHWBXSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H](Cc1ccoc1)[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000423330709 387175048 /nfs/dbraw/zinc/17/50/48/387175048.db2.gz GAWBWIARFOCWBV-JSGCOSHPSA-N 2 0 236.359 2.190 20 0 BEADRP [NH3+]C1(C[NH2+][C@H]2CC[C@@H]2C2CCC2)CCC1 ZINC000423332713 387177857 /nfs/dbraw/zinc/17/78/57/387177857.db2.gz QWQXXOWPJHDRLK-NEPJUHHUSA-N 2 0 208.349 2.036 20 0 BEADRP Cc1cc(N[C@@H]2CC[N@H+](C)[C@@H](C)C2)cc[nH+]1 ZINC000229570599 387179151 /nfs/dbraw/zinc/17/91/51/387179151.db2.gz QNOOKMGNGHWKDP-WCQYABFASA-N 2 0 219.332 2.285 20 0 BEADRP Cc1cncc([C@@H](C)[NH2+]C[C@]2(C)CCC[NH2+]C2)c1 ZINC000423334940 387181073 /nfs/dbraw/zinc/18/10/73/387181073.db2.gz IMBIJDJYDVYNRN-UKRRQHHQSA-N 2 0 247.386 2.430 20 0 BEADRP C[C@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)C1(C)CC1 ZINC000423334786 387181147 /nfs/dbraw/zinc/18/11/47/387181147.db2.gz RFEFLVCQOOUMRW-RYUDHWBXSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1Cc2ccc(F)cc2[C@@H]1[NH2+]C[C@@H]1CC[NH2+]C1 ZINC000423333662 387181459 /nfs/dbraw/zinc/18/14/59/387181459.db2.gz HZBQNJQDEXIIJH-UEKVPHQBSA-N 2 0 248.345 2.258 20 0 BEADRP C[C@@H]1CCC[C@@H](C)C1[NH2+]C[C@@H]([NH3+])C1CC1 ZINC000423339281 387187260 /nfs/dbraw/zinc/18/72/60/387187260.db2.gz ZMEMOJQURZFHJW-CKYFFXLPSA-N 2 0 210.365 2.138 20 0 BEADRP CC(C)=CCC[C@@H](C)[NH2+]C[C@H]([NH3+])C1CC1 ZINC000423339968 387188789 /nfs/dbraw/zinc/18/87/89/387188789.db2.gz ZZZLGQDADCQVHG-YPMHNXCESA-N 2 0 210.365 2.448 20 0 BEADRP C[C@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)c1cccc(O)c1 ZINC000423341738 387189796 /nfs/dbraw/zinc/18/97/96/387189796.db2.gz MUDWVIXFJRGLLY-SWLSCSKDSA-N 2 0 248.370 2.433 20 0 BEADRP CC(C)n1cc([C@H](C)[NH2+]CC2=CC[NH2+]CC2)cn1 ZINC000423341815 387190225 /nfs/dbraw/zinc/19/02/25/387190225.db2.gz KJFWUBZPBLYAPH-LBPRGKRZSA-N 2 0 248.374 2.034 20 0 BEADRP CC[C@@H]1CCCC[C@H]1[NH2+]CC1([NH3+])CCC1 ZINC000423340512 387191021 /nfs/dbraw/zinc/19/10/21/387191021.db2.gz XGQYTCGTLSNRGD-VXGBXAGGSA-N 2 0 210.365 2.426 20 0 BEADRP COc1ccsc1[C@H](C)[NH2+]C[C@@H](C)C[NH3+] ZINC000423299883 387132729 /nfs/dbraw/zinc/13/27/29/387132729.db2.gz CMVRKQQBZWIOCC-IUCAKERBSA-N 2 0 228.361 2.002 20 0 BEADRP CC(C)[C@@H](Cc1ccccc1)[NH2+]CC1C[NH2+]C1 ZINC000423302753 387134986 /nfs/dbraw/zinc/13/49/86/387134986.db2.gz KGZHNATZTNZEQR-OAHLLOKOSA-N 2 0 232.371 2.063 20 0 BEADRP Cc1cccc(C[C@@H]([NH2+]CC2C[NH2+]C2)C2CC2)c1 ZINC000423303065 387137406 /nfs/dbraw/zinc/13/74/06/387137406.db2.gz KXIQNGHVFXZKRP-MRXNPFEDSA-N 2 0 244.382 2.125 20 0 BEADRP C[C@@H]([NH2+]CC1C[NH2+]C1)[C@H](C)C1CCCCC1 ZINC000423303650 387137512 /nfs/dbraw/zinc/13/75/12/387137512.db2.gz MGFDPMHGXMHCSX-NWDGAFQWSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H]([NH2+]CC1(C)CC[NH2+]CC1)[C@H]1C[C@H]1C ZINC000423345763 387194164 /nfs/dbraw/zinc/19/41/64/387194164.db2.gz ZABMNHLDFUWWIJ-WOPDTQHZSA-N 2 0 210.365 2.010 20 0 BEADRP COC[C@@H](CC(C)C)[NH2+]CCC[N@H+](C)C(C)C ZINC000359636653 387138269 /nfs/dbraw/zinc/13/82/69/387138269.db2.gz HFUGSZAAFQLKLI-CQSZACIVSA-N 2 0 244.423 2.367 20 0 BEADRP COc1ccc([C@@H]([NH2+]CC2C[NH2+]C2)C(C)C)cc1 ZINC000423304868 387138785 /nfs/dbraw/zinc/13/87/85/387138785.db2.gz PKDSKSQRICELLL-HNNXBMFYSA-N 2 0 248.370 2.201 20 0 BEADRP CCC[NH2+]CC[NH2+][C@H]1CCC[C@H]1CCCF ZINC000423305383 387139116 /nfs/dbraw/zinc/13/91/16/387139116.db2.gz BNFHOWFUXRKNDE-STQMWFEESA-N 2 0 230.371 2.494 20 0 BEADRP CSc1ccc([C@H](C)[NH2+]CC2C[NH2+]C2)cc1 ZINC000423304663 387140608 /nfs/dbraw/zinc/14/06/08/387140608.db2.gz OPMRLYBWMRPBHX-JTQLQIEISA-N 2 0 236.384 2.279 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H](C)[C@H]1CCCC[C@@H]1C ZINC000423306035 387141293 /nfs/dbraw/zinc/14/12/93/387141293.db2.gz KYLQNMFTFUPVMA-XQHKEYJVSA-N 2 0 212.381 2.386 20 0 BEADRP CC(C)[C@@H](Cc1ccccc1)[NH2+]C[C@H]1CC[NH2+]C1 ZINC000423351692 387202641 /nfs/dbraw/zinc/20/26/41/387202641.db2.gz ZKHWXMDLZVOXQV-JKSUJKDBSA-N 2 0 246.398 2.453 20 0 BEADRP Cc1cc([C@H](C)[NH2+]CC2=CC[NH2+]CC2)oc1C ZINC000423352556 387203234 /nfs/dbraw/zinc/20/32/34/387203234.db2.gz KQEYSYBRSZYRGI-NSHDSACASA-N 2 0 234.343 2.467 20 0 BEADRP FCCC[C@H]1CCC[C@@H]1[NH2+]CC1=CC[NH2+]CC1 ZINC000423352886 387204835 /nfs/dbraw/zinc/20/48/35/387204835.db2.gz KYQMHFZWJCWOSC-KGLIPLIRSA-N 2 0 240.366 2.414 20 0 BEADRP COc1cccc([C@H](C)[NH2+]CC[C@H]2CCC[NH2+]2)c1 ZINC000423353222 387205426 /nfs/dbraw/zinc/20/54/26/387205426.db2.gz BGFGNYCEHSKKJV-GXTWGEPZSA-N 2 0 248.370 2.488 20 0 BEADRP CC[C@H]([NH2+]CC[C@H]1CCC[NH2+]1)[C@@H]1C[C@@H]1C ZINC000423354777 387205576 /nfs/dbraw/zinc/20/55/76/387205576.db2.gz GWYDWZXVTCLDJG-LOWDOPEQSA-N 2 0 210.365 2.153 20 0 BEADRP COc1ccc([C@@H](C)[NH2+]CC[C@H]2CCC[NH2+]2)cc1 ZINC000423357848 387209396 /nfs/dbraw/zinc/20/93/96/387209396.db2.gz IRJFJDGTDBGNRY-TZMCWYRMSA-N 2 0 248.370 2.488 20 0 BEADRP FCC[C@@H]1CCC[C@@H]1[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000423359019 387210621 /nfs/dbraw/zinc/21/06/21/387210621.db2.gz OPJTXJUGVCGZGO-XQQFMLRXSA-N 2 0 228.355 2.246 20 0 BEADRP C(C[C@H]1CCC[NH2+]1)[NH2+][C@@H]1CCCC12CCC2 ZINC000423361374 387213356 /nfs/dbraw/zinc/21/33/56/387213356.db2.gz RWGGKIVRVIVTCS-CHWSQXEVSA-N 2 0 222.376 2.441 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@H]([NH2+]CC2=CC[NH2+]CC2)C1 ZINC000423362766 387215134 /nfs/dbraw/zinc/21/51/34/387215134.db2.gz YBZIMOKBFDDNQM-MBNYWOFBSA-N 2 0 222.376 2.320 20 0 BEADRP C[C@@H]1CC[C@@H](C)[C@@H]([NH2+]CC2=CC[NH2+]CC2)C1 ZINC000423362764 387216085 /nfs/dbraw/zinc/21/60/85/387216085.db2.gz YBZIMOKBFDDNQM-BZPMIXESSA-N 2 0 222.376 2.320 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC23CCC3)CC[NH2+]1 ZINC000423367300 387218730 /nfs/dbraw/zinc/21/87/30/387218730.db2.gz ADJVCKYKFPPFDF-IJLUTSLNSA-N 2 0 208.349 2.049 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)[C@H]1CC1(C)C ZINC000423368972 387222037 /nfs/dbraw/zinc/22/20/37/387222037.db2.gz BMMPSGBDYIQTDR-DDHJBXDOSA-N 2 0 210.365 2.151 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+][C@H]1CCc2c1cccc2F ZINC000423400913 387235138 /nfs/dbraw/zinc/23/51/38/387235138.db2.gz QNBYBZCZXAYEDD-KMUNFCNLSA-N 2 0 248.345 2.401 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@H]1CC[C@@H]1C(C)(C)C ZINC000423401439 387238086 /nfs/dbraw/zinc/23/80/86/387238086.db2.gz QWJJZTKNHPDGRI-VOAKCMCISA-N 2 0 224.392 2.399 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+]C1[C@@H](C)CCC[C@@H]1C ZINC000423407839 387244641 /nfs/dbraw/zinc/24/46/41/387244641.db2.gz WKQCSZSYFLWSON-RVMXOQNASA-N 2 0 224.392 2.399 20 0 BEADRP C[C@@H]([NH2+]CCN1CCCC1(C)C)[C@@H]1CCCO1 ZINC000063074097 387246981 /nfs/dbraw/zinc/24/69/81/387246981.db2.gz AEORBYSNRBZWGE-OLZOCXBDSA-N 2 0 240.391 2.018 20 0 BEADRP CCc1nc(C)c([C@H](C)[NH2+]CCCC[NH3+])s1 ZINC000423345610 387194704 /nfs/dbraw/zinc/19/47/04/387194704.db2.gz XWHAMHFNBHXZFK-VIFPVBQESA-N 2 0 241.404 2.403 20 0 BEADRP Cc1nc([C@@H](C)[NH2+]CC2=CC[NH2+]CC2)cs1 ZINC000423345256 387194798 /nfs/dbraw/zinc/19/47/98/387194798.db2.gz FYBGXAXFHLNEQG-SECBINFHSA-N 2 0 237.372 2.022 20 0 BEADRP C[C@@H]([NH2+]CC1=CC[NH2+]CC1)c1ccccc1 ZINC000423345915 387194853 /nfs/dbraw/zinc/19/48/53/387194853.db2.gz ONRPRYKZGBMVRO-GFCCVEGCSA-N 2 0 216.328 2.257 20 0 BEADRP CC[C@@H]([NH2+]CCCC[NH3+])c1cccc(OC)c1 ZINC000423345642 387194952 /nfs/dbraw/zinc/19/49/52/387194952.db2.gz XZFFYOQCWHNHKM-CQSZACIVSA-N 2 0 236.359 2.475 20 0 BEADRP C[C@@H]([NH2+]CC1(C)CC[NH2+]CC1)[C@@H]1C[C@H]1C ZINC000423345761 387195083 /nfs/dbraw/zinc/19/50/83/387195083.db2.gz ZABMNHLDFUWWIJ-IJLUTSLNSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@H]([NH2+]CC1(C)CC[NH2+]CC1)c1cccnc1 ZINC000423346236 387196146 /nfs/dbraw/zinc/19/61/46/387196146.db2.gz ZOLKDUMLQYBTKW-LBPRGKRZSA-N 2 0 233.359 2.122 20 0 BEADRP CC[C@@H]([NH2+]C[C@H]1CC[NH2+]C1)c1ccccc1OC ZINC000423348067 387198436 /nfs/dbraw/zinc/19/84/36/387198436.db2.gz SLHGHGLRESAWQF-GXTWGEPZSA-N 2 0 248.370 2.345 20 0 BEADRP C1=C(C[NH2+][C@H]2CCC[C@@H]2C2CC2)CC[NH2+]C1 ZINC000423347155 387198513 /nfs/dbraw/zinc/19/85/13/387198513.db2.gz QEYLHSIVKHTCGH-KGLIPLIRSA-N 2 0 220.360 2.074 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+]C1CC(OC(C)(C)C)C1 ZINC000352556252 387309534 /nfs/dbraw/zinc/30/95/34/387309534.db2.gz XJGCFWFIFNSXDW-PNESKVBLSA-N 2 0 242.407 2.262 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@@H]1CCC[C@H](c2cccnc2)C1 ZINC000423464002 387312558 /nfs/dbraw/zinc/31/25/58/387312558.db2.gz LRCIUYGVTUHTID-AEGPPILISA-N 2 0 247.386 2.435 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@@H]1CCCc2c(O)cccc21 ZINC000423464368 387313237 /nfs/dbraw/zinc/31/32/37/387313237.db2.gz VUAQKWPFYCYPPS-SMDDNHRTSA-N 2 0 248.370 2.487 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1CCC[C@H]([NH3+])C1)C1CC1 ZINC000423463996 387313297 /nfs/dbraw/zinc/31/32/97/387313297.db2.gz GHMUMNNDPKIMME-WXHSDQCUSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)[C@H]1C[C@H]1C ZINC000321903014 387314035 /nfs/dbraw/zinc/31/40/35/387314035.db2.gz NYSWDCSEBISATE-CCJXIVEXSA-N 2 0 222.376 2.246 20 0 BEADRP Cc1cc([C@H](C)[NH2+]CCC[C@@H]2CCC[NH2+]2)no1 ZINC000423467600 387314929 /nfs/dbraw/zinc/31/49/29/387314929.db2.gz BKSOKRYHWUDLBM-NWDGAFQWSA-N 2 0 237.347 2.166 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@H](C)CCCc1cccnc1 ZINC000423378383 387259916 /nfs/dbraw/zinc/25/99/16/387259916.db2.gz FUUWYCKSNWVUGA-ZIAGYGMSSA-N 2 0 249.402 2.380 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@@H](C)[C@H]2C[C@H]2C)CC1 ZINC000321513471 387267274 /nfs/dbraw/zinc/26/72/74/387267274.db2.gz IAFFSCQSGBGVEE-DYEKYZERSA-N 2 0 224.392 2.493 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@@H]([NH3+])C1)c1cncc(F)c1 ZINC000423385073 387267557 /nfs/dbraw/zinc/26/75/57/387267557.db2.gz LLYQSTHQCCNJFS-BIMULSAOSA-N 2 0 237.322 2.141 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[NH2+]C[C@@H]1C)[C@@H]1C[C@H]1C ZINC000423385679 387268280 /nfs/dbraw/zinc/26/82/80/387268280.db2.gz GWVAJBVJNOEYNW-RXGFPQBGSA-N 2 0 210.365 2.009 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@@H]1CC[C@H]1C1CCC1 ZINC000423389493 387273245 /nfs/dbraw/zinc/27/32/45/387273245.db2.gz NNNOYCCHXCYISV-KGYLQXTDSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CC[C@H]2C2CCC2)CC[NH2+]1 ZINC000423388098 387273350 /nfs/dbraw/zinc/27/33/50/387273350.db2.gz SYHSYSLOHDTQTQ-ZZVYKPCYSA-N 2 0 222.376 2.295 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@H]1CC[C@@H]1C1CCC1 ZINC000423389495 387274226 /nfs/dbraw/zinc/27/42/26/387274226.db2.gz NNNOYCCHXCYISV-RTXFEEFZSA-N 2 0 210.365 2.153 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+][C@@H]1CC[NH2+]C[C@H]1C ZINC000423393210 387277775 /nfs/dbraw/zinc/27/77/75/387277775.db2.gz MAOGMEDVYFHVPO-MBNYWOFBSA-N 2 0 233.359 2.039 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H](C)Cc1cccs1 ZINC000643498927 387278533 /nfs/dbraw/zinc/27/85/33/387278533.db2.gz XFFKPSCWLCAUMH-NSHDSACASA-N 2 0 226.389 2.268 20 0 BEADRP CC(C)C[C@@H]1CCC[C@H]([NH2+][C@@H]2[C@H]3C[NH2+]C[C@H]32)C1 ZINC000423432055 387283429 /nfs/dbraw/zinc/28/34/29/387283429.db2.gz MERDAOSYTPYSBR-BTFPBAQTSA-N 2 0 236.403 2.399 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)c1cccnc1 ZINC000423431478 387284940 /nfs/dbraw/zinc/28/49/40/387284940.db2.gz VKYOOCYWHHJQGO-MGPQQGTHSA-N 2 0 247.386 2.497 20 0 BEADRP CCO[C@@H]1C[C@H]([NH2+][C@@H](C)[C@@H](C)[NH3+])C1(CC)CC ZINC000423439757 387290854 /nfs/dbraw/zinc/29/08/54/387290854.db2.gz IBNYYBBHXIOYHV-MROQNXINSA-N 2 0 242.407 2.296 20 0 BEADRP c1ccc2c(c1)CCCC[C@H]2[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000423441509 387293665 /nfs/dbraw/zinc/29/36/65/387293665.db2.gz UNFGFBOZHMTVLY-QXSJWSMHSA-N 2 0 242.366 2.262 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@@H]1CCCC12CCC2 ZINC000423446961 387295331 /nfs/dbraw/zinc/29/53/31/387295331.db2.gz CXSUCDKSUQVUBL-NWDGAFQWSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]Cc1ccc2c(c1)CCCN2 ZINC000423450095 387298691 /nfs/dbraw/zinc/29/86/91/387298691.db2.gz SICRYUSBUFDWOL-NEPJUHHUSA-N 2 0 247.386 2.260 20 0 BEADRP CC(C)CC[C@H]1CC[C@@H]([NH2+][C@@H]2[C@H]3C[NH2+]C[C@H]32)C1 ZINC000423453868 387302266 /nfs/dbraw/zinc/30/22/66/387302266.db2.gz LALHRSUBNQKBOE-XPABHHOTSA-N 2 0 236.403 2.399 20 0 BEADRP COc1c(C)cc(C[N@H+](C)CCC[NH3+])cc1C ZINC000258847566 387302887 /nfs/dbraw/zinc/30/28/87/387302887.db2.gz WXOFPFRJXVBKSF-UHFFFAOYSA-N 2 0 236.359 2.093 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@H]1CCC[C@@H]1CCCF ZINC000423457030 387303405 /nfs/dbraw/zinc/30/34/05/387303405.db2.gz FDQKMETXZCNSLY-WOPDTQHZSA-N 2 0 216.344 2.232 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@@H]1CCC[C@H]1CCCF ZINC000423457003 387304325 /nfs/dbraw/zinc/30/43/25/387304325.db2.gz FDQKMETXZCNSLY-SDDRHHMPSA-N 2 0 216.344 2.232 20 0 BEADRP C[C@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)C1(C)CC1 ZINC000423480855 387362302 /nfs/dbraw/zinc/36/23/02/387362302.db2.gz NPYPZDTVJOAXIP-NWDGAFQWSA-N 2 0 210.365 2.297 20 0 BEADRP C1CC1[C@H]1CC[C@H]1[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000423538687 387363156 /nfs/dbraw/zinc/36/31/56/387363156.db2.gz GVRGPIJYNYZQHM-XLWJZTARSA-N 2 0 234.387 2.153 20 0 BEADRP C[C@H]([NH2+]CCC1=CC[NH2+]CC1)c1cccc(O)c1 ZINC000423536873 387363797 /nfs/dbraw/zinc/36/37/97/387363797.db2.gz ILKAWWNKFJQJFH-LBPRGKRZSA-N 2 0 246.354 2.353 20 0 BEADRP C[NH+](C)[C@@H]1CCC[N@@H+](C2CCCC2)CC1 ZINC000336541590 387364052 /nfs/dbraw/zinc/36/40/52/387364052.db2.gz BIGVRUNQJFCVLB-GFCCVEGCSA-N 2 0 210.365 2.345 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@H]1C[C@H](OCC(C)C)C1(C)C ZINC000423481616 387364297 /nfs/dbraw/zinc/36/42/97/387364297.db2.gz XAEABDCCFHBTPM-AVGNSLFASA-N 2 0 242.407 2.153 20 0 BEADRP CC[C@H]1CC[C@@H]1[NH2+]CCC1=CC[NH2+]CC1 ZINC000423542754 387367504 /nfs/dbraw/zinc/36/75/04/387367504.db2.gz UECONQDCULAEBD-STQMWFEESA-N 2 0 208.349 2.074 20 0 BEADRP C1CC2(C1)CC[C@@H]2[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000423543611 387367658 /nfs/dbraw/zinc/36/76/58/387367658.db2.gz NLNXOXSLYCPALN-SYQHCUMBSA-N 2 0 234.387 2.297 20 0 BEADRP Cc1cc(C[NH2+][C@H](C)CCCC[NH3+])cc(C)n1 ZINC000423548725 387370134 /nfs/dbraw/zinc/37/01/34/387370134.db2.gz MSTGJAKKLZULNP-LLVKDONJSA-N 2 0 235.375 2.306 20 0 BEADRP C(C[NH2+]C1CC1)C[NH2+][C@H]1CCC12CCC2 ZINC000423545929 387370276 /nfs/dbraw/zinc/37/02/76/387370276.db2.gz FDVMWWBIUFHZMO-LBPRGKRZSA-N 2 0 208.349 2.051 20 0 BEADRP [NH3+]CC1CCC([NH2+]C[C@@H]2Cc3ccccc32)CC1 ZINC000643453633 387370849 /nfs/dbraw/zinc/37/08/49/387370849.db2.gz NNAISLYHQQIWNQ-BLZCZZARSA-N 2 0 244.382 2.433 20 0 BEADRP CC[C@@H]1C[C@H]([NH2+][C@@H]2CCCC[C@@H]2C[NH3+])CCO1 ZINC000423547642 387371308 /nfs/dbraw/zinc/37/13/08/387371308.db2.gz LOLMCLJUFKXLDE-AAVRWANBSA-N 2 0 240.391 2.051 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)[C@@H]1C[C@H]1C ZINC000423552854 387371990 /nfs/dbraw/zinc/37/19/90/387371990.db2.gz QDPGHELYHDLFPL-KYFQHEKYSA-N 2 0 236.403 2.399 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)[C@H]1C[C@H]1C ZINC000423550497 387373640 /nfs/dbraw/zinc/37/36/40/387373640.db2.gz NXXXLQWKHOHDDO-JJEKRJTGSA-N 2 0 222.376 2.009 20 0 BEADRP c1coc(CNC2CC([NH+]3CCCCC3)C2)c1 ZINC000373491946 387375256 /nfs/dbraw/zinc/37/52/56/387375256.db2.gz ZWZGKTZRAIYVPF-UHFFFAOYSA-N 2 0 234.343 2.386 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000423555056 387376118 /nfs/dbraw/zinc/37/61/18/387376118.db2.gz XRJOYBLCGVIYSY-ITGHMWBKSA-N 2 0 222.376 2.153 20 0 BEADRP CCCC[N@H+](CCOC)CC[C@H]1CCC[NH+]1C ZINC000121244673 387320254 /nfs/dbraw/zinc/32/02/54/387320254.db2.gz XYQHJGNBUCQHBV-CQSZACIVSA-N 2 0 242.407 2.219 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]C[C@H]1CCC[C@H]([NH3+])C1 ZINC000423476761 387325351 /nfs/dbraw/zinc/32/53/51/387325351.db2.gz RIBCVUDDQPTJMV-RNJOBUHISA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]([NH3+])[C@@H](C)[NH2+][C@H](C)CCCc1cccnc1 ZINC000423479485 387326917 /nfs/dbraw/zinc/32/69/17/387326917.db2.gz VKNKQTRSILGRLN-JHJVBQTASA-N 2 0 235.375 2.118 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCC23CCC3)C1 ZINC000390434498 387326966 /nfs/dbraw/zinc/32/69/66/387326966.db2.gz RIBXNODXNWHORH-CHWSQXEVSA-N 2 0 222.376 2.251 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@H](C)CCCc1cccnc1 ZINC000423478938 387327487 /nfs/dbraw/zinc/32/74/87/387327487.db2.gz UXUMQVZZWWQIGU-OCCSQVGLSA-N 2 0 235.375 2.120 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000423483056 387328293 /nfs/dbraw/zinc/32/82/93/387328293.db2.gz PSFQPXUMGHZIHS-UPJWGTAASA-N 2 0 210.365 2.297 20 0 BEADRP CC[NH+](CC)CCO[C@@H]1CC[N@H+](CC(C)C)C1 ZINC000354099579 387330053 /nfs/dbraw/zinc/33/00/53/387330053.db2.gz FXQUANQJOOORNT-CQSZACIVSA-N 2 0 242.407 2.075 20 0 BEADRP CCO[C@@H]1C[C@@H]([NH2+]C[C@@H]([NH3+])CC)C12CCCC2 ZINC000423485996 387330880 /nfs/dbraw/zinc/33/08/80/387330880.db2.gz ZIJBLYSXNPDVBZ-YNEHKIRRSA-N 2 0 240.391 2.051 20 0 BEADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@@H]2CCc3ccccc32)C1 ZINC000423492013 387335675 /nfs/dbraw/zinc/33/56/75/387335675.db2.gz LDIMTPDCBHXMIY-OSAQELSMSA-N 2 0 230.355 2.391 20 0 BEADRP C[C@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1ccco1 ZINC000423491531 387336909 /nfs/dbraw/zinc/33/69/09/387336909.db2.gz ZINZNJSQJBQWPT-RYUDHWBXSA-N 2 0 222.332 2.462 20 0 BEADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@H]2CC[C@@H]2C2CCC2)C1 ZINC000423495439 387337876 /nfs/dbraw/zinc/33/78/76/387337876.db2.gz FGTCVWDXKNIWMO-CABNGKKXSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@H](C[NH3+])C1)C1CCCC1 ZINC000423494938 387338474 /nfs/dbraw/zinc/33/84/74/387338474.db2.gz SVGYKFWFZXKZDX-GMXVVIOVSA-N 2 0 210.365 2.282 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[C@H](C[NH3+])C1)c1ccncc1 ZINC000423499672 387340899 /nfs/dbraw/zinc/34/08/99/387340899.db2.gz HZFMXWNYAFPQHM-YUTCNCBUSA-N 2 0 233.359 2.250 20 0 BEADRP CCc1cccnc1[C@H](C)[NH2+][C@@H]1CC[C@H](C[NH3+])C1 ZINC000423498713 387340942 /nfs/dbraw/zinc/34/09/42/387340942.db2.gz HGWGGFCQWYEMRW-SGMGOOAPSA-N 2 0 247.386 2.422 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@@H](C)[C@H]1C[C@H]1C ZINC000321989879 387344721 /nfs/dbraw/zinc/34/47/21/387344721.db2.gz DWWGNUCUHUVTGH-AGIUHOORSA-N 2 0 212.381 2.351 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[NH2+]C2)c(C)n1 ZINC000643500778 387345773 /nfs/dbraw/zinc/34/57/73/387345773.db2.gz FAFGCXKFWQXGFG-TZMCWYRMSA-N 2 0 247.386 2.349 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000423511065 387347118 /nfs/dbraw/zinc/34/71/18/387347118.db2.gz NCNIFGPHGFSHEB-DZGCQCFKSA-N 3 0 249.402 2.184 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC[C@@H](C)CC1)[C@@H]1CCC[NH2+]1 ZINC000400639242 387348401 /nfs/dbraw/zinc/34/84/01/387348401.db2.gz NPTFXRSKFJPSGI-LPWJVIDDSA-N 2 0 210.365 2.295 20 0 BEADRP CC[C@H]([NH2+]C1CCC([NH3+])CC1)[C@@H]1C[C@@H]1C ZINC000322006405 387350270 /nfs/dbraw/zinc/35/02/70/387350270.db2.gz HRQRJIVNKMTLCS-NVNOCSQKSA-N 2 0 210.365 2.281 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H](C[NH3+])C1)[C@H]1CC1(C)C ZINC000423520883 387352840 /nfs/dbraw/zinc/35/28/40/387352840.db2.gz WPQWVAMBQOPTKH-IRCOFANPSA-N 2 0 210.365 2.138 20 0 BEADRP CCC[C@H](C)[C@H](CC)[NH2+]C[C@@H]1C[NH2+]CCCO1 ZINC000423519633 387353333 /nfs/dbraw/zinc/35/33/33/387353333.db2.gz PMGYUFITMUDPSJ-IHRRRGAJSA-N 2 0 242.407 2.169 20 0 BEADRP CCC1CC([NH2+]CCC2=CC[NH2+]CC2)C1 ZINC000423536616 387383863 /nfs/dbraw/zinc/38/38/63/387383863.db2.gz HZQBITFVRMHSIE-UHFFFAOYSA-N 2 0 208.349 2.074 20 0 BEADRP CCCN(CC)C[C@@H](C)[NH2+][C@@H]1CCOC[C@@H]1C ZINC000515859440 387431146 /nfs/dbraw/zinc/43/11/46/387431146.db2.gz RNBUGZRFWBLHMN-BFHYXJOUSA-N 2 0 242.407 2.121 20 0 BEADRP COCC1(CC[NH2+][C@@H]2CCCCC[C@H]2[NH3+])CC1 ZINC000515846274 387433422 /nfs/dbraw/zinc/43/34/22/387433422.db2.gz LOHGELYJKIGCEX-CHWSQXEVSA-N 2 0 240.391 2.053 20 0 BEADRP c1ccc2c(c1)CCC[C@H]([NH2+]C[C@@H]1CCC[NH2+]1)C2 ZINC000643505770 387455302 /nfs/dbraw/zinc/45/53/02/387455302.db2.gz JFOMSRHVJDHADJ-HOTGVXAUSA-N 2 0 244.382 2.276 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+]CC[C@H]2CC[NH2+]C2)c(C)n1 ZINC000643509172 387506186 /nfs/dbraw/zinc/50/61/86/387506186.db2.gz CDFXYYURGZQYSC-TZMCWYRMSA-N 2 0 247.386 2.349 20 0 BEADRP CO[C@@H]1CCC[C@@H]([NH2+][C@@H](C)CCCC[NH3+])C1 ZINC000643475374 387508166 /nfs/dbraw/zinc/50/81/66/387508166.db2.gz NPVCAZJSTKYHBG-YNEHKIRRSA-N 2 0 228.380 2.051 20 0 BEADRP CO[C@@H]1CCC[C@@H]([NH2+][C@H](C)CCCC[NH3+])C1 ZINC000643475372 387508578 /nfs/dbraw/zinc/50/85/78/387508578.db2.gz NPVCAZJSTKYHBG-JHJVBQTASA-N 2 0 228.380 2.051 20 0 BEADRP Cc1cc(NC[C@H]2CC[N@@H+](C3CC3)C2)cc[nH+]1 ZINC000162717099 387510100 /nfs/dbraw/zinc/51/01/00/387510100.db2.gz NVPHLFLLKLXRPP-GFCCVEGCSA-N 2 0 231.343 2.286 20 0 BEADRP CCN(CC)[C@H](C)C[NH2+][C@@H](C)[C@@H]1CCCOC1 ZINC000355295864 387516659 /nfs/dbraw/zinc/51/66/59/387516659.db2.gz SFJNGIMXPOVDQQ-HZSPNIEDSA-N 2 0 242.407 2.121 20 0 BEADRP CCC[C@]1([NH2+]CC[C@@H]2CCC[N@@H+]2C)CCOC1 ZINC000352825409 387530850 /nfs/dbraw/zinc/53/08/50/387530850.db2.gz PTUQUYODFHCMCR-KBPBESRZSA-N 2 0 240.391 2.020 20 0 BEADRP CC[N@@H+]1CC[C@H](N(C)CC2(F)CC2)C[C@@H]1C ZINC000527219148 387538843 /nfs/dbraw/zinc/53/88/43/387538843.db2.gz IHRZLMUDOXDWIL-RYUDHWBXSA-N 2 0 228.355 2.293 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@H]2CCCSC2)CC[N@@H+]1C ZINC000304332841 387467204 /nfs/dbraw/zinc/46/72/04/387467204.db2.gz AOMXGNCCYIVOQJ-JHJVBQTASA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCCC[C@@H]2[NH3+])C[C@H](C)O1 ZINC000516173950 387477096 /nfs/dbraw/zinc/47/70/96/387477096.db2.gz PCRMRBKUSDYQRG-ZUWCUPBKSA-N 2 0 240.391 2.192 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCCC[C@H]2[NH3+])C[C@H](C)O1 ZINC000516173949 387477296 /nfs/dbraw/zinc/47/72/96/387477296.db2.gz PCRMRBKUSDYQRG-XVIXHAIJSA-N 2 0 240.391 2.192 20 0 BEADRP Cc1occc1C[NH2+][C@H]1CCCC[C@@H]1C[NH3+] ZINC000643472177 387485422 /nfs/dbraw/zinc/48/54/22/387485422.db2.gz DQAIPMFLCVLQQC-YPMHNXCESA-N 2 0 222.332 2.195 20 0 BEADRP CC(C)[NH2+]CCC[NH2+][C@@H](C)C(C)(C)C ZINC000643508276 387489132 /nfs/dbraw/zinc/48/91/32/387489132.db2.gz AIFBPGXCKNWTPY-NSHDSACASA-N 2 0 200.370 2.399 20 0 BEADRP CC[C@@H](C[NH2+][C@H](C)C1C[NH2+]C1)c1ccccc1 ZINC000422716451 387628472 /nfs/dbraw/zinc/62/84/72/387628472.db2.gz NEFLZPJNLFSJNR-OLZOCXBDSA-N 2 0 232.371 2.378 20 0 BEADRP C[C@@H]1CCCC[C@@H]1OCC[NH2+][C@H]1CCC[C@H]1[NH3+] ZINC000422714009 387628507 /nfs/dbraw/zinc/62/85/07/387628507.db2.gz QGEGGHFBIAPBHZ-MQYQWHSLSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H]1CCCc2ccccc2C1 ZINC000643514875 387599932 /nfs/dbraw/zinc/59/99/32/387599932.db2.gz AAMLCFNWNFZBEO-DOMZBBRYSA-N 2 0 232.371 2.118 20 0 BEADRP C[C@@H]1C[C@@H](C)[N@H+](Cc2cccc(N)c2)C[C@@H]1C[NH3+] ZINC000422641331 387611171 /nfs/dbraw/zinc/61/11/71/387611171.db2.gz XQUJCNFXBUZMJN-BZPMIXESSA-N 2 0 247.386 2.074 20 0 BEADRP CC(C)n1cc([C@@H](C)[NH2+][C@H](C)CCC[NH3+])cn1 ZINC000422716664 387629406 /nfs/dbraw/zinc/62/94/06/387629406.db2.gz UVUMOLPHXXGASQ-VXGBXAGGSA-N 2 0 238.379 2.242 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CCc1c(F)cccc1F ZINC000422692612 387613774 /nfs/dbraw/zinc/61/37/74/387613774.db2.gz KLHXHAFAZMADKS-ZJUUUORDSA-N 2 0 242.313 2.223 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]C[C@H]1C[C@H]1C ZINC000422701916 387619067 /nfs/dbraw/zinc/61/90/67/387619067.db2.gz JKRUDGOAADDBFC-JFGNBEQYSA-N 2 0 233.359 2.155 20 0 BEADRP C[C@H]([NH3+])[C@H](Cc1ccccc1)[NH2+]C[C@@H]1C[C@H]1C ZINC000422703609 387619365 /nfs/dbraw/zinc/61/93/65/387619365.db2.gz NOHSNAPWVHTFMR-DHMWGJHJSA-N 2 0 232.371 2.191 20 0 BEADRP c1ccc([C@@H](CC2CC2)[NH2+]CC2C[NH2+]C2)cc1 ZINC000643516016 387619972 /nfs/dbraw/zinc/61/99/72/387619972.db2.gz MRVOMEDJMAAUFP-OAHLLOKOSA-N 2 0 230.355 2.337 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CCCC[C@H]1C)C1C[NH2+]C1 ZINC000422707165 387620754 /nfs/dbraw/zinc/62/07/54/387620754.db2.gz VUZMJWPHNPWNBX-UTUOFQBUSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@H]([NH3+])[C@H](Cc1ccccc1)[NH2+]CC1CCC1 ZINC000422713616 387625396 /nfs/dbraw/zinc/62/53/96/387625396.db2.gz KDJNFCKWHJNZBP-WFASDCNBSA-N 2 0 232.371 2.335 20 0 BEADRP CC[C@@H]([NH2+]CCCC[NH3+])c1ccccc1OC ZINC000037715402 387564521 /nfs/dbraw/zinc/56/45/21/387564521.db2.gz MBDUIFMFWSICCO-CYBMUJFWSA-N 2 0 236.359 2.475 20 0 BEADRP CCCC[N@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000375762609 387579580 /nfs/dbraw/zinc/57/95/80/387579580.db2.gz KKASQUFGLFUGLX-FUNVUKJBSA-N 2 0 210.365 2.344 20 0 BEADRP CSC1(C[N@@H+]2CC[C@@H](C[NH+](C)C)C2)CCC1 ZINC000356227411 387631028 /nfs/dbraw/zinc/63/10/28/387631028.db2.gz VEGMQBUCIHFOJQ-LBPRGKRZSA-N 2 0 242.432 2.156 20 0 BEADRP C[C@](C[NH3+])(NCc1ccc(F)c(F)c1)C1CC1 ZINC000430597587 387631813 /nfs/dbraw/zinc/63/18/13/387631813.db2.gz QPBFZQXOQAUBJL-CYBMUJFWSA-N 2 0 240.297 2.182 20 0 BEADRP CC(C)CCC[C@@H](C)[NH2+][C@H](C)C1C[NH2+]C1 ZINC000422728321 387637860 /nfs/dbraw/zinc/63/78/60/387637860.db2.gz JBKUIRDBPRBAFK-VXGBXAGGSA-N 2 0 212.381 2.399 20 0 BEADRP CCCCOCCC[NH2+][C@H]1CC[NH2+]CC[C@H]1C ZINC000422729953 387638511 /nfs/dbraw/zinc/63/85/11/387638511.db2.gz LQJZSTSWDZOCRX-KGLIPLIRSA-N 2 0 242.407 2.171 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]CCCc1ccccc1 ZINC000422732239 387640801 /nfs/dbraw/zinc/64/08/01/387640801.db2.gz NOYPWQICDQRDED-KGLIPLIRSA-N 2 0 218.344 2.089 20 0 BEADRP Fc1ccc(CC[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000422734562 387642951 /nfs/dbraw/zinc/64/29/51/387642951.db2.gz SQQZXBSDQFZOAD-YIONKMFJSA-N 2 0 248.345 2.241 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000422736012 387643926 /nfs/dbraw/zinc/64/39/26/387643926.db2.gz VMLJCKQWDAKJLG-IHRRRGAJSA-N 3 0 243.439 2.212 20 0 BEADRP CO[C@H](C[NH2+][C@H]1CCC[C@H]1C[NH3+])c1ccccc1 ZINC000422738674 387645939 /nfs/dbraw/zinc/64/59/39/387645939.db2.gz JSLIVWWHKWPRQL-SOUVJXGZSA-N 2 0 248.370 2.091 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)[C@@H]1C[C@H]1C1CC1 ZINC000527636769 387647524 /nfs/dbraw/zinc/64/75/24/387647524.db2.gz DPTFUOZMFVDAFT-VZAMPYOESA-N 2 0 248.414 2.495 20 0 BEADRP Cc1ccccc1[C@@H](C)[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000422745569 387648124 /nfs/dbraw/zinc/64/81/24/387648124.db2.gz MHLBHSKMWQOJKA-NWDGAFQWSA-N 2 0 218.344 2.254 20 0 BEADRP C[C@@H](C[NH2+][C@@H](C)C1C[NH2+]C1)c1ccc(F)cc1 ZINC000422745701 387648186 /nfs/dbraw/zinc/64/81/86/387648186.db2.gz VMTWEMUZNAIOBG-QWRGUYRKSA-N 2 0 236.334 2.127 20 0 BEADRP CCCC[C@H](CC)C[NH2+][C@H](C)C1C[NH2+]C1 ZINC000422741441 387648844 /nfs/dbraw/zinc/64/88/44/387648844.db2.gz DRHQUVFSAKHYDU-NEPJUHHUSA-N 2 0 212.381 2.400 20 0 BEADRP CCOc1ccccc1C[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000422745428 387649273 /nfs/dbraw/zinc/64/92/73/387649273.db2.gz XQWDWGCYKZTSEJ-RYUDHWBXSA-N 2 0 236.359 2.301 20 0 BEADRP Cc1ccccc1C[C@H](C)[NH2+][C@H](C)C1C[NH2+]C1 ZINC000422746495 387650099 /nfs/dbraw/zinc/65/00/99/387650099.db2.gz WQWNPQJRPCZTOK-QWHCGFSZSA-N 2 0 232.371 2.124 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCc2ccccc2C1)[C@@H]1CCC[NH2+]1 ZINC000422752908 387657981 /nfs/dbraw/zinc/65/79/81/387657981.db2.gz HUVFUDUMNZSXJK-WQVCFCJDSA-N 2 0 244.382 2.274 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCc2ccccc2C1)[C@@H]1CCC[NH2+]1 ZINC000422752906 387658334 /nfs/dbraw/zinc/65/83/34/387658334.db2.gz HUVFUDUMNZSXJK-KCXAZCMYSA-N 2 0 244.382 2.274 20 0 BEADRP COc1cc(C[NH2+][C@@H](C)C[C@H](C)[NH3+])ccc1C ZINC000422753125 387658697 /nfs/dbraw/zinc/65/86/97/387658697.db2.gz DQGKNGBSBMZICD-RYUDHWBXSA-N 2 0 236.359 2.219 20 0 BEADRP C[C@H](CCC(C)(C)C)[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000422760532 387662745 /nfs/dbraw/zinc/66/27/45/387662745.db2.gz QFYSLEAESZJTTH-MNOVXSKESA-N 2 0 212.381 2.399 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@@H]1CCc2ccccc2C1 ZINC000422759479 387664213 /nfs/dbraw/zinc/66/42/13/387664213.db2.gz PGHQQDXYZSLXCJ-YWPYICTPSA-N 2 0 232.371 2.259 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]CCOC1CCCC1 ZINC000422763870 387664823 /nfs/dbraw/zinc/66/48/23/387664823.db2.gz NYAMARPHPSIRAJ-KGLIPLIRSA-N 2 0 240.391 2.195 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]CC1(c2cccc(F)c2)CC1 ZINC000422765728 387665957 /nfs/dbraw/zinc/66/59/57/387665957.db2.gz LAQWPUKYGSZISK-KGLIPLIRSA-N 2 0 248.345 2.327 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]CCOc1ccccc1 ZINC000422764603 387666507 /nfs/dbraw/zinc/66/65/07/387666507.db2.gz VGXTZCZVNYEQLX-HUUCEWRRSA-N 2 0 248.370 2.315 20 0 BEADRP CC1(C[NH2+]C2CC([NH+]3CCCCC3)C2)CC1 ZINC000309426909 387668058 /nfs/dbraw/zinc/66/80/58/387668058.db2.gz KJYRJRCZCFROLT-UHFFFAOYSA-N 2 0 222.376 2.393 20 0 BEADRP Cc1ccc([C@H](C)C[NH2+][C@@H](C)C2C[NH2+]C2)cc1 ZINC000422773345 387670339 /nfs/dbraw/zinc/67/03/39/387670339.db2.gz YKPQAGRMKXDCFB-OLZOCXBDSA-N 2 0 232.371 2.296 20 0 BEADRP COc1ccc([C@H](C)[NH2+][C@H](C)C[C@@H](C)[NH3+])cc1 ZINC000422777274 387674382 /nfs/dbraw/zinc/67/43/82/387674382.db2.gz FGIVLPMDBJETIX-UTUOFQBUSA-N 2 0 236.359 2.472 20 0 BEADRP C[C@@H]1CC(CCN2CC[C@H]([NH3+])C2)C[C@@H](C)C1 ZINC000431084239 387675461 /nfs/dbraw/zinc/67/54/61/387675461.db2.gz KFTFVBNZEUZAIF-OBJOEFQTSA-N 2 0 224.392 2.482 20 0 BEADRP C[NH+](C)C1CC(NCc2ccc3cc[nH]c3c2)C1 ZINC000527723705 387676541 /nfs/dbraw/zinc/67/65/41/387676541.db2.gz GBUIXKUBBMUPKD-UHFFFAOYSA-N 2 0 243.354 2.350 20 0 BEADRP CCOc1cccc([C@H](C)[NH2+][C@H](C)C2C[NH2+]C2)c1 ZINC000422779793 387678733 /nfs/dbraw/zinc/67/87/33/387678733.db2.gz JEGHBAIPTGEXME-NWDGAFQWSA-N 2 0 248.370 2.344 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]Cc1cccc2cccnc21 ZINC000422781214 387679995 /nfs/dbraw/zinc/67/99/95/387679995.db2.gz LDUSBSMSUQJFKN-NEPJUHHUSA-N 2 0 243.354 2.450 20 0 BEADRP C[C@H](Cc1cccs1)[NH2+]CC1=CC[NH2+]CC1 ZINC000643520129 387680692 /nfs/dbraw/zinc/68/06/92/387680692.db2.gz FTSYXWRISVIPNR-LLVKDONJSA-N 2 0 236.384 2.188 20 0 BEADRP CC[C@H]([NH2+][C@@H](C)C[C@H](C)[NH3+])c1ccncc1 ZINC000422782377 387681370 /nfs/dbraw/zinc/68/13/70/387681370.db2.gz LWIVASRYAJXYJD-GVXVVHGQSA-N 2 0 221.348 2.248 20 0 BEADRP CC[C@H](F)CN1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000440771966 387690255 /nfs/dbraw/zinc/69/02/55/387690255.db2.gz SWAQDLJBPFVJAZ-STQMWFEESA-N 2 0 228.355 2.152 20 0 BEADRP CC[C@H](F)CN1CC[C@H](C[NH+]2CCCC2)C1 ZINC000440771962 387690696 /nfs/dbraw/zinc/69/06/96/387690696.db2.gz SWAQDLJBPFVJAZ-OLZOCXBDSA-N 2 0 228.355 2.152 20 0 BEADRP C1C[C@H]([NH2+][C@@H]2CC[C@@H]3CCCC[C@@H]3C2)C[NH2+]1 ZINC000422792376 387692678 /nfs/dbraw/zinc/69/26/78/387692678.db2.gz DQEKDOYOTGQRDT-DGAVXFQQSA-N 2 0 222.376 2.297 20 0 BEADRP Cc1cc(C)c(C[NH2+][C@@H](C)C2C[NH2+]C2)c(C)c1 ZINC000422792519 387692713 /nfs/dbraw/zinc/69/27/13/387692713.db2.gz ZIXUIDASHZZIHS-ZDUSSCGKSA-N 2 0 232.371 2.309 20 0 BEADRP CC(C)CCOCC[NH2+][C@H]1CC[NH2+]CC[C@H]1C ZINC000422790315 387693529 /nfs/dbraw/zinc/69/35/29/387693529.db2.gz XOWPPFYMDQJVOE-KGLIPLIRSA-N 2 0 242.407 2.027 20 0 BEADRP CC(C)CC(CC(C)C)[NH2+]C[C@@H](C)[NH3+] ZINC000643526327 387749103 /nfs/dbraw/zinc/74/91/03/387749103.db2.gz ZNSJPLZRROZCQH-LLVKDONJSA-N 2 0 200.370 2.384 20 0 BEADRP CCc1noc(CC)c1C[NH2+][C@@H](C)CCC[NH3+] ZINC000422869727 387749175 /nfs/dbraw/zinc/74/91/75/387749175.db2.gz WUQACNLXSAQUNG-JTQLQIEISA-N 2 0 239.363 2.016 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H]1CCCS1)[C@@H]1CCC[NH2+]1 ZINC000422871570 387749916 /nfs/dbraw/zinc/74/99/16/387749916.db2.gz DCYXRKPXEYVVBR-TUAOUCFPSA-N 2 0 228.405 2.002 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]C[C@H]1CCCS1 ZINC000422873774 387752697 /nfs/dbraw/zinc/75/26/97/387752697.db2.gz MFCKZYINCKUHQT-IJLUTSLNSA-N 2 0 228.405 2.132 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]C[C@@H]1CCCS1 ZINC000422873776 387752976 /nfs/dbraw/zinc/75/29/76/387752976.db2.gz MFCKZYINCKUHQT-TUAOUCFPSA-N 2 0 228.405 2.132 20 0 BEADRP C[C@@H]([NH2+]C[C@@]1(C)CCCS1)[C@@H]1CCC[NH2+]1 ZINC000422876524 387756528 /nfs/dbraw/zinc/75/65/28/387756528.db2.gz QGUVFBCZRQGKST-GRYCIOLGSA-N 2 0 228.405 2.002 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)[C@H]1CC12CC2 ZINC000527846515 387753525 /nfs/dbraw/zinc/75/35/25/387753525.db2.gz FPKRAKOIHQRHSD-SGMGOOAPSA-N 2 0 234.387 2.249 20 0 BEADRP CCCCOCC[NH2+][C@H]1CCCCC[C@@H]1[NH3+] ZINC000422792812 387696860 /nfs/dbraw/zinc/69/68/60/387696860.db2.gz ZMDNBDBZDNPHAM-STQMWFEESA-N 2 0 228.380 2.053 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[C@@H]2CCC[C@@H]2C1 ZINC000422796206 387698575 /nfs/dbraw/zinc/69/85/75/387698575.db2.gz XSIHVGSLRODTEE-MRTXSQPYSA-N 2 0 222.376 2.425 20 0 BEADRP C[C@@H]([NH2+]Cc1cc(F)cc(F)c1)[C@@H]1CC[NH2+]C1 ZINC000422803495 387700954 /nfs/dbraw/zinc/70/09/54/387700954.db2.gz IYNQLCLXSSNQEY-MWLCHTKSSA-N 2 0 240.297 2.052 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+]CCc1ccsc1 ZINC000422802479 387702277 /nfs/dbraw/zinc/70/22/77/387702277.db2.gz DGMNSKFLPDEROK-WCQYABFASA-N 2 0 238.400 2.268 20 0 BEADRP C[C@H]([NH2+][C@H](c1ccccc1)C1CC1)C1C[NH2+]C1 ZINC000422805063 387703626 /nfs/dbraw/zinc/70/36/26/387703626.db2.gz LOVUNPZMVQEPJB-XHDPSFHLSA-N 2 0 230.355 2.335 20 0 BEADRP CCO[C@@H](CC[NH2+][C@H](C)[C@H]1CCC[NH2+]1)C(C)C ZINC000422806075 387706418 /nfs/dbraw/zinc/70/64/18/387706418.db2.gz HTJWMEJMNJUYRE-MCIONIFRSA-N 2 0 242.407 2.168 20 0 BEADRP C[C@@H]([NH2+]C[C@]1(C)CCCS1)[C@H]1CCC[NH2+]1 ZINC000422876526 387755286 /nfs/dbraw/zinc/75/52/86/387755286.db2.gz QGUVFBCZRQGKST-UTUOFQBUSA-N 2 0 228.405 2.002 20 0 BEADRP CC(C)CCC[NH2+][C@H]1CC[NH2+]CC[C@H]1C ZINC000422812912 387712133 /nfs/dbraw/zinc/71/21/33/387712133.db2.gz YIOYZIYDPVJBBU-OLZOCXBDSA-N 2 0 212.381 2.400 20 0 BEADRP CC[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000422812162 387712519 /nfs/dbraw/zinc/71/25/19/387712519.db2.gz QBMLRZBXOLTTSF-DMDPSCGWSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CCc1cc(F)ccc1F ZINC000422819856 387717673 /nfs/dbraw/zinc/71/76/73/387717673.db2.gz JCSJIGZPZIAJMX-VHSXEESVSA-N 2 0 242.313 2.223 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@]1(C)CCCC[C@@H]1O ZINC000422819463 387718338 /nfs/dbraw/zinc/71/83/38/387718338.db2.gz IIMPEKZBOGNPFZ-RDBSUJKOSA-N 2 0 242.407 2.035 20 0 BEADRP Cc1cc(C)cc(C[N@@H+]2CCC[C@H](C[NH3+])C2)c1 ZINC000038076855 177900418 /nfs/dbraw/zinc/90/04/18/177900418.db2.gz DKLFHWFQAIVQTC-CQSZACIVSA-N 2 0 232.371 2.474 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CCc1cc(F)ccc1F ZINC000422829463 387721626 /nfs/dbraw/zinc/72/16/26/387721626.db2.gz UOJGSRQPLPYSRD-SNVBAGLBSA-N 2 0 242.313 2.224 20 0 BEADRP Cc1cc(C)cc(C[N@@H+]2CC[C@@H](C[NH3+])C2)c1 ZINC000050245548 177900082 /nfs/dbraw/zinc/90/00/82/177900082.db2.gz CWSAHOCOKYKJDB-ZDUSSCGKSA-N 2 0 218.344 2.084 20 0 BEADRP CC[C@H]([NH2+]C[C@@]1(C)CCCS1)[C@@H]1CCC[NH2+]1 ZINC000422880353 387755974 /nfs/dbraw/zinc/75/59/74/387755974.db2.gz WTZIUAPWPHIGIO-RWMBFGLXSA-N 2 0 242.432 2.392 20 0 BEADRP Cc1ccccc1C(C)(C)C[NH2+][C@H](C)C1C[NH2+]C1 ZINC000422857274 387740708 /nfs/dbraw/zinc/74/07/08/387740708.db2.gz GPYQZLMPPLBULJ-CYBMUJFWSA-N 2 0 246.398 2.470 20 0 BEADRP COCCC1(C[NH2+][C@H]2CCC[C@@H]2[NH3+])CCCC1 ZINC000422892383 387762135 /nfs/dbraw/zinc/76/21/35/387762135.db2.gz YELMHAUQZRADIT-STQMWFEESA-N 2 0 240.391 2.053 20 0 BEADRP CCC1(C[NH2+][C@H]2CCC[C@H]2[NH3+])CCCC1 ZINC000422891225 387762176 /nfs/dbraw/zinc/76/21/76/387762176.db2.gz UVSJWHLXZBIDDE-NEPJUHHUSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@H]([NH3+])C[NH2+][C@@H]1CC[C@](C)(c2ccccc2)C1 ZINC000643527911 387762831 /nfs/dbraw/zinc/76/28/31/387762831.db2.gz VFOQJTGRWZRDLW-CFVMTHIKSA-N 2 0 232.371 2.434 20 0 BEADRP C[C@H](CCc1ccsc1)[NH2+]C[C@H](C)[NH3+] ZINC000643527936 387765754 /nfs/dbraw/zinc/76/57/54/387765754.db2.gz VULBDYDQUYAISJ-VHSXEESVSA-N 2 0 212.362 2.006 20 0 BEADRP CC(C)C1CCC([NH2+][C@H](C)C2C[NH2+]C2)CC1 ZINC000422895403 387766320 /nfs/dbraw/zinc/76/63/20/387766320.db2.gz VWMAVIHSRKZVFO-LKSINWNRSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@@H]([NH3+])C[NH2+][C@@H]1CCCCC12CCCC2 ZINC000643527600 387766631 /nfs/dbraw/zinc/76/66/31/387766631.db2.gz OZYABOPWSTVTKP-VXGBXAGGSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@@H]([NH3+])C[NH2+][C@H](C)CCc1ccsc1 ZINC000643527934 387766736 /nfs/dbraw/zinc/76/67/36/387766736.db2.gz VULBDYDQUYAISJ-NXEZZACHSA-N 2 0 212.362 2.006 20 0 BEADRP COc1ccc([C@H]([NH2+]C[C@H](C)[NH3+])C(C)C)cc1 ZINC000643528284 387766986 /nfs/dbraw/zinc/76/69/86/387766986.db2.gz GPKZPYPWVMOBEP-SMDDNHRTSA-N 2 0 236.359 2.329 20 0 BEADRP Cc1ccc2c(c1)[C@@H]([NH2+]CCCC[NH3+])CC2 ZINC000129363141 387767154 /nfs/dbraw/zinc/76/71/54/387767154.db2.gz MCXJCIIECMJOMO-AWEZNQCLSA-N 2 0 218.344 2.311 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+]CCCC[NH3+])CC2 ZINC000129362909 387767258 /nfs/dbraw/zinc/76/72/58/387767258.db2.gz MCXJCIIECMJOMO-CQSZACIVSA-N 2 0 218.344 2.311 20 0 BEADRP C[C@H](C[C@@H]1CCCO1)[NH2+][C@H]1CCCC[C@@H]1C[NH3+] ZINC000422904441 387767729 /nfs/dbraw/zinc/76/77/29/387767729.db2.gz PYLOCCUTFQRFSC-MQYQWHSLSA-N 2 0 240.391 2.051 20 0 BEADRP Cc1ccc([C@@H]([NH2+]C[C@H](C)[NH3+])C2CC2)cc1 ZINC000643528248 387768285 /nfs/dbraw/zinc/76/82/85/387768285.db2.gz FZFFWKRAPAWVCP-SMDDNHRTSA-N 2 0 218.344 2.383 20 0 BEADRP C[C@H]([NH3+])C[NH2+][C@@H]1CCCCc2ccccc21 ZINC000643528684 387768855 /nfs/dbraw/zinc/76/88/55/387768855.db2.gz MUXAACBHMPTKCU-SMDDNHRTSA-N 2 0 218.344 2.391 20 0 BEADRP C[C@@H]([NH3+])C[NH2+][C@H]1CCCCc2ccccc21 ZINC000643528683 387770622 /nfs/dbraw/zinc/77/06/22/387770622.db2.gz MUXAACBHMPTKCU-RISCZKNCSA-N 2 0 218.344 2.391 20 0 BEADRP C[C@H]([NH2+][C@@H](Cc1ccccc1)C1CC1)C1C[NH2+]C1 ZINC000422914463 387771673 /nfs/dbraw/zinc/77/16/73/387771673.db2.gz UHVSOIBVGFFPLC-LRDDRELGSA-N 2 0 244.382 2.205 20 0 BEADRP Cc1ccc(CC[C@H](C)[NH2+]C[C@H](C)[NH3+])cc1 ZINC000643528748 387773096 /nfs/dbraw/zinc/77/30/96/387773096.db2.gz ODQCLZJQHWOEKI-STQMWFEESA-N 2 0 220.360 2.253 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]Cc1cnc2ccccc2c1 ZINC000422915791 387773625 /nfs/dbraw/zinc/77/36/25/387773625.db2.gz ZAAPOTFLOMUFAM-NEPJUHHUSA-N 2 0 243.354 2.450 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]CCC(F)(F)F ZINC000422919586 387775673 /nfs/dbraw/zinc/77/56/73/387775673.db2.gz KCFFSQCVIZGKFF-RKDXNWHRSA-N 2 0 224.270 2.188 20 0 BEADRP CCC1(C[NH2+][C@H]2CC[NH2+]CC[C@@H]2C)CC1 ZINC000422920241 387775715 /nfs/dbraw/zinc/77/57/15/387775715.db2.gz MAIUUYBMRLOAAM-RYUDHWBXSA-N 2 0 210.365 2.154 20 0 BEADRP CCC1(C[NH2+][C@@H]2CC[NH2+]CC[C@H]2C)CC1 ZINC000422920242 387776221 /nfs/dbraw/zinc/77/62/21/387776221.db2.gz MAIUUYBMRLOAAM-VXGBXAGGSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]([NH3+])[C@@H](Cc1ccccc1)[NH2+]CC1(C)CC1 ZINC000422922150 387777424 /nfs/dbraw/zinc/77/74/24/387777424.db2.gz SCHLNKVVWGXRFM-TZMCWYRMSA-N 2 0 232.371 2.335 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@H]1C1CCCCC1)C1C[NH2+]C1 ZINC000422922024 387777465 /nfs/dbraw/zinc/77/74/65/387777465.db2.gz PLIGPVUQYCPUPH-LEWSCRJBSA-N 2 0 222.376 2.153 20 0 BEADRP CC(C)[C@@H]1OCCC[C@H]1C[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000422922010 387777849 /nfs/dbraw/zinc/77/78/49/387777849.db2.gz RPDWTFKZEJJSEC-XUXIUFHCSA-N 2 0 242.407 2.153 20 0 BEADRP COc1ccc([C@H](C)[C@H](C)[NH2+]C[C@H](C)[NH3+])cc1 ZINC000643529433 387777980 /nfs/dbraw/zinc/77/79/80/387777980.db2.gz ZRUFPEVGTFDJDB-TUAOUCFPSA-N 2 0 236.359 2.124 20 0 BEADRP Cc1cccc(OCC[NH2+][C@@H](C)C[C@H](C)[NH3+])c1 ZINC000422927844 387778851 /nfs/dbraw/zinc/77/88/51/387778851.db2.gz HIFDBGHWULVIKX-STQMWFEESA-N 2 0 236.359 2.089 20 0 BEADRP COc1ccc(C[NH2+][C@H](C)CCC[NH3+])c(F)c1 ZINC000422927950 387779858 /nfs/dbraw/zinc/77/98/58/387779858.db2.gz HXULMDIBQWZVHF-SNVBAGLBSA-N 2 0 240.322 2.051 20 0 BEADRP Cc1cccc(OCC[NH2+][C@@H](C)C[C@@H](C)[NH3+])c1 ZINC000422927842 387780207 /nfs/dbraw/zinc/78/02/07/387780207.db2.gz HIFDBGHWULVIKX-OLZOCXBDSA-N 2 0 236.359 2.089 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]CC1(C2CC2)CC1 ZINC000422932629 387780996 /nfs/dbraw/zinc/78/09/96/387780996.db2.gz GDSHQDFFSHTLDX-CHWSQXEVSA-N 2 0 222.376 2.426 20 0 BEADRP [NH3+][C@H]1CCCCC[C@@H]1[NH2+]CC1(C2CC2)CC1 ZINC000422932632 387781338 /nfs/dbraw/zinc/78/13/38/387781338.db2.gz GDSHQDFFSHTLDX-STQMWFEESA-N 2 0 222.376 2.426 20 0 BEADRP CC(C)CC1(C[NH2+][C@@H]2CCC[C@H]2[NH3+])CC1 ZINC000422932573 387781585 /nfs/dbraw/zinc/78/15/85/387781585.db2.gz ZNMWBAZHJPLKNE-VXGBXAGGSA-N 2 0 210.365 2.282 20 0 BEADRP Cc1cc(C)cc(OCC[NH2+][C@@H]2CCC[C@H]2[NH3+])c1 ZINC000422944358 387786074 /nfs/dbraw/zinc/78/60/74/387786074.db2.gz MBRHIDDFTPBZSP-HUUCEWRRSA-N 2 0 248.370 2.152 20 0 BEADRP CCC1(CC)[C@H]([NH2+][C@@H](C)CCC[NH3+])C[C@H]1OC ZINC000422944788 387786373 /nfs/dbraw/zinc/78/63/73/387786373.db2.gz STPMQFCPGMSFCQ-YNEHKIRRSA-N 2 0 242.407 2.297 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)[C@H]1CC12CC2 ZINC000527918343 387788053 /nfs/dbraw/zinc/78/80/53/387788053.db2.gz WDLKUYWBIJRZNZ-BFHYXJOUSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@@H]1CCc2c1cccc2O ZINC000422979132 387789115 /nfs/dbraw/zinc/78/91/15/387789115.db2.gz LJHJUUUCGLCREL-GXFFZTMASA-N 2 0 234.343 2.097 20 0 BEADRP C[C@H](Cc1ccc(O)cc1)[NH2+][C@@H]1CCC[C@@H]1C[NH3+] ZINC000422979582 387791954 /nfs/dbraw/zinc/79/19/54/387791954.db2.gz NCZCGHVRXHWHTB-UXIGCNINSA-N 2 0 248.370 2.040 20 0 BEADRP Cc1ccc(CC[NH2+][C@H]2CCC[C@@H]2C[NH3+])cc1 ZINC000422983809 387793934 /nfs/dbraw/zinc/79/39/34/387793934.db2.gz VDCNUTOGDNGUQD-CABCVRRESA-N 2 0 232.371 2.255 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H](C)C[C@H](C)[NH3+])cc1 ZINC000422983693 387794544 /nfs/dbraw/zinc/79/45/44/387794544.db2.gz UOAOYCHECGCDAX-STQMWFEESA-N 2 0 220.360 2.253 20 0 BEADRP CCC[C@H](C[NH2+][C@@H]1CC[N@H+](C)C[C@@H]1C)OCC ZINC000527931940 387795133 /nfs/dbraw/zinc/79/51/33/387795133.db2.gz ONFWXFBPOPPQRD-BFHYXJOUSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@@H]1CCCC(F)(F)C1 ZINC000422985919 387795841 /nfs/dbraw/zinc/79/58/41/387795841.db2.gz BAJLYLBUKMCFSZ-IVZWLZJFSA-N 2 0 220.307 2.280 20 0 BEADRP C[C@@H]1C[C@H](C[NH2+][C@@H]2CCCCC[C@@H]2[NH3+])CCO1 ZINC000422985568 387796605 /nfs/dbraw/zinc/79/66/05/387796605.db2.gz FIKMFECAKCDVRV-YIYPIFLZSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@@H]1CCCC(F)(F)C1 ZINC000422987871 387798691 /nfs/dbraw/zinc/79/86/91/387798691.db2.gz HOONMUSMLBXTIN-VHSXEESVSA-N 2 0 220.307 2.281 20 0 BEADRP C[NH+](C)CCCNCc1sccc1Cl ZINC000163605638 387799193 /nfs/dbraw/zinc/79/91/93/387799193.db2.gz VPNROVPYJZHJGR-UHFFFAOYSA-N 2 0 232.780 2.443 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CC1(CCO)CCCCC1 ZINC000422990369 387800432 /nfs/dbraw/zinc/80/04/32/387800432.db2.gz BWCHZBYJIQEURL-CYBMUJFWSA-N 2 0 242.407 2.036 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]CCc1ccc(O)cc1 ZINC000422990781 387800517 /nfs/dbraw/zinc/80/05/17/387800517.db2.gz NYTZLLBGKBDPKG-HUUCEWRRSA-N 2 0 248.370 2.184 20 0 BEADRP CCC(CC)[C@H](CC[NH2+][C@H](C)C1C[NH2+]C1)OC ZINC000422995565 387802010 /nfs/dbraw/zinc/80/20/10/387802010.db2.gz KJJJPETUQVBIJO-RISCZKNCSA-N 2 0 242.407 2.025 20 0 BEADRP CC[C@@H]([NH2+]CCCc1ccccn1)[C@@H]1CCC[NH2+]1 ZINC000422994878 387802547 /nfs/dbraw/zinc/80/25/47/387802547.db2.gz IVRANDIWIYBLHX-CABCVRRESA-N 2 0 247.386 2.134 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCCC(F)(F)C1 ZINC000422995787 387803037 /nfs/dbraw/zinc/80/30/37/387803037.db2.gz ZEUSMBDFXHKKBQ-AXFHLTTASA-N 2 0 232.318 2.281 20 0 BEADRP COc1cc(C)cc(C[NH2+][C@@H]2CCC[C@@H]2C[NH3+])c1 ZINC000423001383 387805661 /nfs/dbraw/zinc/80/56/61/387805661.db2.gz IBGOSYUQRCLNAX-UKRRQHHQSA-N 2 0 248.370 2.221 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@@H]1CCCc2occc21 ZINC000422964188 387813405 /nfs/dbraw/zinc/81/34/05/387813405.db2.gz KPKOLBBDULEISN-HOSYDEDBSA-N 2 0 222.332 2.372 20 0 BEADRP Cc1ccccc1OCC[NH2+][C@@H](C)CCC[NH3+] ZINC000422949553 387807596 /nfs/dbraw/zinc/80/75/96/387807596.db2.gz UGHIOAQTSLYDOQ-ZDUSSCGKSA-N 2 0 236.359 2.091 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]C[C@@H]1CC1(C)C ZINC000422954359 387809121 /nfs/dbraw/zinc/80/91/21/387809121.db2.gz IJTQIKNFZXAKBJ-GRYCIOLGSA-N 2 0 210.365 2.010 20 0 BEADRP COC[C@H]([NH2+][C@@H](C)C[C@@H](C)[NH3+])c1ccccc1 ZINC000422954309 387809143 /nfs/dbraw/zinc/80/91/43/387809143.db2.gz HYFXDZAUCMFGCT-DYEKYZERSA-N 2 0 236.359 2.090 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CC1(C)C)[C@@H]1CCCC[NH2+]1 ZINC000422954775 387809337 /nfs/dbraw/zinc/80/93/37/387809337.db2.gz JQHZTZLVKPOQFY-UTUOFQBUSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1CC1(C)C)[C@@H]1CCC[NH2+]1 ZINC000422954595 387809513 /nfs/dbraw/zinc/80/95/13/387809513.db2.gz JGGUCRXLEQXDSP-SRVKXCTJSA-N 2 0 210.365 2.153 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@H](C)[C@@H]2CC23CC3)CC1 ZINC000527859005 387757394 /nfs/dbraw/zinc/75/73/94/387757394.db2.gz NXTXMFZJFALOKQ-OCCSQVGLSA-N 2 0 236.403 2.497 20 0 BEADRP CCOc1cccc(C[NH2+][C@H](C)C[C@H](C)[NH3+])c1 ZINC000422882722 387758308 /nfs/dbraw/zinc/75/83/08/387758308.db2.gz SUUZKDWFRSFKIK-NWDGAFQWSA-N 2 0 236.359 2.301 20 0 BEADRP C[C@H]([NH3+])C[NH2+][C@@H]1CC[C@@H](c2ccccc2)C1 ZINC000643526733 387759584 /nfs/dbraw/zinc/75/95/84/387759584.db2.gz FQEZWUVPXFOSJF-IACUBPJLSA-N 2 0 218.344 2.260 20 0 BEADRP C[C@H]([NH3+])C[NH2+][C@@H]1CC[C@H](c2ccccc2)C1 ZINC000643526732 387759872 /nfs/dbraw/zinc/75/98/72/387759872.db2.gz FQEZWUVPXFOSJF-FPMFFAJLSA-N 2 0 218.344 2.260 20 0 BEADRP COc1cccc2c1CC[C@@H]2[NH2+][C@H](C)C[C@H](C)[NH3+] ZINC000422888912 387761247 /nfs/dbraw/zinc/76/12/47/387761247.db2.gz OGVQRTPEQZTOCX-WDMOLILDSA-N 2 0 248.370 2.398 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CC=CCC1)[C@H]1CCCC[NH2+]1 ZINC000422972945 387820517 /nfs/dbraw/zinc/82/05/17/387820517.db2.gz NDNOJVJOBZDDPZ-MGPQQGTHSA-N 2 0 222.376 2.463 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1CC=CCC1)[C@@H]1CCC[NH2+]1 ZINC000422974823 387823882 /nfs/dbraw/zinc/82/38/82/387823882.db2.gz RTZNDSAXOYMLDI-RDBSUJKOSA-N 2 0 222.376 2.463 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H](C)[C@@H]1COc2ccccc21 ZINC000423007238 387828202 /nfs/dbraw/zinc/82/82/02/387828202.db2.gz XDHHXSSSFNDMMH-MNXVOIDGSA-N 2 0 248.370 2.267 20 0 BEADRP CCCC[C@@H]([NH3+])C(=O)Nc1ccc([C@H](C)[NH3+])cc1 ZINC000442722566 387829027 /nfs/dbraw/zinc/82/90/27/387829027.db2.gz XQEBQPKIZJUNTH-GXFFZTMASA-N 2 0 249.358 2.162 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)C[C@H](C)[NH3+])[C@@H]1COc2ccccc21 ZINC000423007237 387829589 /nfs/dbraw/zinc/82/95/89/387829589.db2.gz XDHHXSSSFNDMMH-FMSGJZPZSA-N 2 0 248.370 2.267 20 0 BEADRP CC(C)[C@@H](O)C(C)(C)C[NH2+][C@@H](C)CCCC[NH3+] ZINC000423006617 387829710 /nfs/dbraw/zinc/82/97/10/387829710.db2.gz WBDGFIJYTJIBEQ-QWHCGFSZSA-N 2 0 244.423 2.137 20 0 BEADRP CC(C)CSCC[NH2+][C@@H]1CC[NH2+]CC[C@H]1C ZINC000423008443 387831370 /nfs/dbraw/zinc/83/13/70/387831370.db2.gz AHKPTVBBXWRHSU-CHWSQXEVSA-N 2 0 244.448 2.353 20 0 BEADRP C[C@H]([NH2+]CC12CCC(CC1)C2)[C@H]1CCC[NH2+]1 ZINC000423008625 387831405 /nfs/dbraw/zinc/83/14/05/387831405.db2.gz ARZZCRUHCGBIBW-RJZJGCCBSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CC1(C2CC2)CCC1 ZINC000423008229 387831469 /nfs/dbraw/zinc/83/14/69/387831469.db2.gz ZLFBRUZMVDURIG-GHMZBOCLSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H](C)Cc1ccoc1 ZINC000423007918 387831792 /nfs/dbraw/zinc/83/17/92/387831792.db2.gz RVFNHAGFHTWVBN-NEPJUHHUSA-N 2 0 224.348 2.318 20 0 BEADRP CC[C@H](CSC)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000423011172 387833154 /nfs/dbraw/zinc/83/31/54/387833154.db2.gz ANQLXGUWVUZOLJ-YIBTVLSRSA-N 2 0 228.405 2.001 20 0 BEADRP CC(C)CSCCC[NH2+][C@H](C)[C@@H]1CCC[NH2+]1 ZINC000423009817 387833586 /nfs/dbraw/zinc/83/35/86/387833586.db2.gz DZQOTFQJIBAXRQ-OLZOCXBDSA-N 2 0 244.448 2.496 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CC12CCC(CC1)C2 ZINC000423013659 387835996 /nfs/dbraw/zinc/83/59/96/387835996.db2.gz NECBQBBCEUAYRY-ZFDZMSFRSA-N 2 0 210.365 2.282 20 0 BEADRP COC1CCC(CC[NH2+][C@@H](C)CCC[NH3+])CC1 ZINC000423032490 387849203 /nfs/dbraw/zinc/84/92/03/387849203.db2.gz FLUZEJCRRMDWLS-HSBZDZAISA-N 2 0 242.407 2.299 20 0 BEADRP C[C@H](C[NH2+][C@H](C)C1(C)CC1)C[NH+]1CCCC1 ZINC000062078309 387849491 /nfs/dbraw/zinc/84/94/91/387849491.db2.gz QKXHHRZJTHTSHS-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H](C)c1cncc(F)c1 ZINC000423037470 387851011 /nfs/dbraw/zinc/85/10/11/387851011.db2.gz WAEAJYCNTCUZBG-MNOVXSKESA-N 2 0 239.338 2.389 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@H](C)c1cncc(F)c1 ZINC000423037469 387851890 /nfs/dbraw/zinc/85/18/90/387851890.db2.gz WAEAJYCNTCUZBG-GHMZBOCLSA-N 2 0 239.338 2.389 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+][C@@H]1CC12CCCC2 ZINC000423075243 387874083 /nfs/dbraw/zinc/87/40/83/387874083.db2.gz OCHLOTDDMFBMHK-JHJVBQTASA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CC[C@H]1CCO[C@@H](C)C1 ZINC000423038977 387852832 /nfs/dbraw/zinc/85/28/32/387852832.db2.gz ZKDIGCRTWLNLFW-RDBSUJKOSA-N 2 0 242.407 2.299 20 0 BEADRP CC[C@H]([NH2+]C1Cc2ccccc2C1)[C@@H]1CCC[NH2+]1 ZINC000423040352 387853435 /nfs/dbraw/zinc/85/34/35/387853435.db2.gz TZOGLRNSOMLLBC-HOTGVXAUSA-N 2 0 244.382 2.274 20 0 BEADRP Cc1csc([C@H](C)C[NH2+][C@@H](C)C[C@@H](C)[NH3+])n1 ZINC000423039550 387854053 /nfs/dbraw/zinc/85/40/53/387854053.db2.gz QUVXAFZXXVNLNE-BBBLOLIVSA-N 2 0 241.404 2.270 20 0 BEADRP CC(C)O[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H]2[NH3+])C1(C)C ZINC000423044091 387855702 /nfs/dbraw/zinc/85/57/02/387855702.db2.gz ATBZJUWYILMDHJ-FVCCEPFGSA-N 2 0 240.391 2.048 20 0 BEADRP CC(C)C[C@@H]1C[C@H]([NH2+][C@@H](C)C[C@H](C)[NH3+])CCO1 ZINC000423046268 387857274 /nfs/dbraw/zinc/85/72/74/387857274.db2.gz TUQKOTXIRCUDFT-IGQOVBAYSA-N 2 0 242.407 2.296 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[NH2+]CC[C@H]1C)c1ccncc1 ZINC000643460299 387874340 /nfs/dbraw/zinc/87/43/40/387874340.db2.gz NDMCWUSBDJAMGC-UMVBOHGHSA-N 2 0 247.386 2.163 20 0 BEADRP Cc1oc2ccccc2c1C[NH2+][C@H](C)C1C[NH2+]C1 ZINC000423052615 387860801 /nfs/dbraw/zinc/86/08/01/387860801.db2.gz QZZBNINFUSFCCS-SNVBAGLBSA-N 2 0 244.338 2.439 20 0 BEADRP C[C@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1cccc(O)c1 ZINC000643534944 387861161 /nfs/dbraw/zinc/86/11/61/387861161.db2.gz GEFTZIXJRFRUBN-FZMZJTMJSA-N 2 0 246.354 2.185 20 0 BEADRP C[C@H](C[NH2+][C@@H](C)CCCC[NH3+])C(F)(F)F ZINC000423057555 387863656 /nfs/dbraw/zinc/86/36/56/387863656.db2.gz ZNXVIQFQORTHLA-BDAKNGLRSA-N 2 0 226.286 2.292 20 0 BEADRP c1cc2c(o1)CCC[C@H]2[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000643535589 387864027 /nfs/dbraw/zinc/86/40/27/387864027.db2.gz NJEMWYNBWLKPQT-OCCSQVGLSA-N 2 0 246.354 2.389 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000643535591 387864370 /nfs/dbraw/zinc/86/43/70/387864370.db2.gz NOXWAVTVWGQRSE-GXTWGEPZSA-N 2 0 245.370 2.183 20 0 BEADRP C/C=C/C[C@H](CO)[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000423057710 387864904 /nfs/dbraw/zinc/86/49/04/387864904.db2.gz ZSFJTIPKNCSAOB-WRAVZFSGSA-N 2 0 246.354 2.048 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H](C)C1)[C@H]1CCCC[NH2+]1 ZINC000423061218 387865552 /nfs/dbraw/zinc/86/55/52/387865552.db2.gz KFOXVTHZSOXRRX-YVECIDJPSA-N 2 0 210.365 2.295 20 0 BEADRP C1CC1[C@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)C1CCC1 ZINC000643536043 387865788 /nfs/dbraw/zinc/86/57/88/387865788.db2.gz MJMCTLJZJYVENV-ZIAGYGMSSA-N 2 0 234.387 2.297 20 0 BEADRP CC(C)C(C)(C)C[NH2+][C@H]1CCOC[C@H]1[C@H](C)[NH3+] ZINC000423059053 387865986 /nfs/dbraw/zinc/86/59/86/387865986.db2.gz KVPNHXQPODWRSN-AVGNSLFASA-N 2 0 242.407 2.011 20 0 BEADRP C1CC12CCC([NH2+][C@@H]1CC13CC[NH2+]CC3)CC2 ZINC000643536194 387867956 /nfs/dbraw/zinc/86/79/56/387867956.db2.gz NSJQHZLXGHEWJZ-CYBMUJFWSA-N 2 0 234.387 2.441 20 0 BEADRP COc1ccc(F)cc1C[NH2+][C@@H](C)CCC[NH3+] ZINC000423062944 387868313 /nfs/dbraw/zinc/86/83/13/387868313.db2.gz NXPDSTYDPAPKOU-JTQLQIEISA-N 2 0 240.322 2.051 20 0 BEADRP CC(C)=CCC[NH2+][C@H]1CC[NH2+]CC[C@@H]1C ZINC000423066915 387869099 /nfs/dbraw/zinc/86/90/99/387869099.db2.gz FTSLAXKYVZFREE-STQMWFEESA-N 2 0 210.365 2.320 20 0 BEADRP CC[C@@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1ccncc1 ZINC000643536624 387869793 /nfs/dbraw/zinc/86/97/93/387869793.db2.gz SWIKIIWLEGGYDI-ZIAGYGMSSA-N 2 0 245.370 2.264 20 0 BEADRP CCC(O)(CC)CC[NH2+][C@H]1CCCC[C@@H]1C[NH3+] ZINC000423067095 387869867 /nfs/dbraw/zinc/86/98/67/387869867.db2.gz GHZAGFNQDFNGIQ-OLZOCXBDSA-N 2 0 242.407 2.035 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[C@@H](OC)C1)[C@H]1CCCC[NH2+]1 ZINC000423068316 387870759 /nfs/dbraw/zinc/87/07/59/387870759.db2.gz JRDXGOZVASKHRR-YIYPIFLZSA-N 2 0 240.391 2.064 20 0 BEADRP CC[C@@H]1CCC[C@H]1[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000643537086 387871612 /nfs/dbraw/zinc/87/16/12/387871612.db2.gz ZBERQYIVKBFTMY-UPJWGTAASA-N 2 0 222.376 2.297 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H]2C[C@]2(C)OCC)CC1 ZINC000527975344 387815872 /nfs/dbraw/zinc/81/58/72/387815872.db2.gz VLAQRRCCLGPNTL-KGLIPLIRSA-N 2 0 240.391 2.018 20 0 BEADRP [NH3+]CC1CCC([NH2+]C[C@H]2CC=CCC2)CC1 ZINC000422966491 387816648 /nfs/dbraw/zinc/81/66/48/387816648.db2.gz AHILQLCIVBCFOD-MOKVOYLWSA-N 2 0 222.376 2.450 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+]CCc1ccccc1O ZINC000422966939 387816942 /nfs/dbraw/zinc/81/69/42/387816942.db2.gz AXDVNSXROLPEIZ-KGLIPLIRSA-N 2 0 248.370 2.042 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]1[NH2+][C@H]1C[C@H](c2ccccc2)C1 ZINC000422970229 387818440 /nfs/dbraw/zinc/81/84/40/387818440.db2.gz VZMNMPHSWGCCRV-AJNGGQMLSA-N 2 0 230.355 2.402 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]C[C@@H]1CCCC(F)(F)C1 ZINC000423103427 387889728 /nfs/dbraw/zinc/88/97/28/387889728.db2.gz AKLCYSLOVMEJNB-GMTAPVOTSA-N 2 0 232.318 2.281 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]CC1(C(F)(F)F)CCC1 ZINC000423107002 387891704 /nfs/dbraw/zinc/89/17/04/387891704.db2.gz KFLIFQYPUJUOLO-RKDXNWHRSA-N 2 0 236.281 2.188 20 0 BEADRP Cc1cc([C@H](C)[NH2+][C@H](C)CCCC[NH3+])no1 ZINC000423105772 387891839 /nfs/dbraw/zinc/89/18/39/387891839.db2.gz CKEOWQAIBZONSW-KOLCDFICSA-N 2 0 225.336 2.151 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CCCC(F)(F)C1)C1C[NH2+]C1 ZINC000423117802 387898899 /nfs/dbraw/zinc/89/88/99/387898899.db2.gz XHAXUVSYCJXESC-ZJUUUORDSA-N 2 0 232.318 2.009 20 0 BEADRP C[C@@H]1CCC[C@@H]1C[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000423109822 387893570 /nfs/dbraw/zinc/89/35/70/387893570.db2.gz VBLCZLOSMADGMP-LSGALXMHSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC1(C)C)[C@H]1CCC[NH2+]C1 ZINC000423110190 387893608 /nfs/dbraw/zinc/89/36/08/387893608.db2.gz OTBOSISQXQQYRC-SRVKXCTJSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@H]([NH2+]CCN1CCCC1)[C@H]1C[C@@H]1C ZINC000322062906 387875187 /nfs/dbraw/zinc/87/51/87/387875187.db2.gz RJGCVGINYCGTNZ-AVGNSLFASA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@H]([NH2+]C[C@H](C)c1ccncc1)[C@@H]1CCC[NH2+]1 ZINC000643460375 387875458 /nfs/dbraw/zinc/87/54/58/387875458.db2.gz WRCJABCCGDEGPR-QEJZJMRPSA-N 2 0 247.386 2.305 20 0 BEADRP CC[C@H]([NH2+]CCN1CCCC1)[C@@H]1C[C@H]1C ZINC000322062907 387875518 /nfs/dbraw/zinc/87/55/18/387875518.db2.gz RJGCVGINYCGTNZ-UPJWGTAASA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]C1CCC2(CC2)CC1 ZINC000423077929 387876027 /nfs/dbraw/zinc/87/60/27/387876027.db2.gz USRGFPXLXZKTOK-NSHDSACASA-N 2 0 210.365 2.426 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+]C1CCC2(CC2)CC1 ZINC000423077292 387876805 /nfs/dbraw/zinc/87/68/05/387876805.db2.gz SVNYPFXZCPGIIZ-ZDUSSCGKSA-N 2 0 240.391 2.053 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCC12CCCC2)[C@@H]1CCC[NH2+]1 ZINC000423075875 387877398 /nfs/dbraw/zinc/87/73/98/387877398.db2.gz PORCEYPISZYIFH-AGIUHOORSA-N 2 0 222.376 2.439 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]Cc1ccc2ncccc2c1 ZINC000423081458 387878212 /nfs/dbraw/zinc/87/82/12/387878212.db2.gz BSBDNOKQTMGMFB-VXGBXAGGSA-N 2 0 243.354 2.450 20 0 BEADRP CC1(CC[NH2+][C@H]2CCCC[C@@H]2C[NH3+])CC1 ZINC000423083671 387878372 /nfs/dbraw/zinc/87/83/72/387878372.db2.gz GFYREANMORHCIA-NEPJUHHUSA-N 2 0 210.365 2.284 20 0 BEADRP CC[C@](C)(C[NH2+][C@@H]1CCN2CCCC[C@@H]12)OC ZINC000322518373 387878575 /nfs/dbraw/zinc/87/85/75/387878575.db2.gz KYEOBZAGSICWPT-HZSPNIEDSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]Cc1ccc2ncccc2c1 ZINC000423081456 387878979 /nfs/dbraw/zinc/87/89/79/387878979.db2.gz BSBDNOKQTMGMFB-RYUDHWBXSA-N 2 0 243.354 2.450 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]Cc1ccc2ncccc2c1 ZINC000423081454 387879310 /nfs/dbraw/zinc/87/93/10/387879310.db2.gz BSBDNOKQTMGMFB-NWDGAFQWSA-N 2 0 243.354 2.450 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+][C@H](C)CCC[NH3+])c(C)n1 ZINC000643539202 387879822 /nfs/dbraw/zinc/87/98/22/387879822.db2.gz FYBABBZMHRJSGN-ZYHUDNBSSA-N 2 0 235.375 2.476 20 0 BEADRP Cc1ncc([C@@H](C)[NH2+][C@@H](C)CCC[NH3+])s1 ZINC000643539248 387879856 /nfs/dbraw/zinc/87/98/56/387879856.db2.gz MRFIFUHUUVJZRO-DTWKUNHWSA-N 2 0 227.377 2.230 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@H](C)Cc1cccs1 ZINC000643540249 387882097 /nfs/dbraw/zinc/88/20/97/387882097.db2.gz LJBQMNUNXBDCIC-ZJUUUORDSA-N 2 0 212.362 2.006 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CC[C@@H](C)C1)[C@H]1CCC[NH2+]1 ZINC000423092552 387882604 /nfs/dbraw/zinc/88/26/04/387882604.db2.gz CIDSBBVCWATRED-YVECIDJPSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@@H]([NH2+]CC1(SC)CC1)[C@@H]1CCC[NH2+]1 ZINC000423091637 387882623 /nfs/dbraw/zinc/88/26/23/387882623.db2.gz YACOPLQBJZDRKL-MNOVXSKESA-N 2 0 228.405 2.002 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CC[C@@H]1C1CC1 ZINC000423095865 387884547 /nfs/dbraw/zinc/88/45/47/387884547.db2.gz NHHROIYZSRSNOA-CRWXNKLISA-N 2 0 222.376 2.282 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]C[C@H]1CCC(F)(F)C1 ZINC000423095194 387885636 /nfs/dbraw/zinc/88/56/36/387885636.db2.gz LPGRFRWWFNRXKY-UWVGGRQHSA-N 2 0 220.307 2.139 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]C1CC(C(F)(F)F)C1 ZINC000423119834 387900486 /nfs/dbraw/zinc/90/04/86/387900486.db2.gz FNWLSJUQBVKFSN-PZYMCFGQSA-N 2 0 224.270 2.043 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CC[C@@H]1C[C@@H](C)O[C@@H](C)C1 ZINC000423118051 387900875 /nfs/dbraw/zinc/90/08/75/387900875.db2.gz YOTKNDDJHFAZQH-VJTDZRGJSA-N 2 0 242.407 2.296 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CCCSC1)[C@@H]1CCCC[NH2+]1 ZINC000423119051 387901409 /nfs/dbraw/zinc/90/14/09/387901409.db2.gz CXYXMIGLJNMLMB-AGIUHOORSA-N 2 0 242.432 2.250 20 0 BEADRP C[C@@H](C[C@@H]1CCCCC[NH2+]1)[NH2+][C@H]1CCCOC1 ZINC000423124044 387902394 /nfs/dbraw/zinc/90/23/94/387902394.db2.gz LVQWYOFXJINCOT-IHRRRGAJSA-N 2 0 240.391 2.066 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]CCC1(F)CCC1 ZINC000423125151 387902695 /nfs/dbraw/zinc/90/26/95/387902695.db2.gz NBIMOAVRAJJYFT-NWDGAFQWSA-N 2 0 228.355 2.376 20 0 BEADRP CC[C@@H]([NH2+]CC1CC(F)(F)C1)[C@@H]1CCC[NH2+]1 ZINC000423126373 387904457 /nfs/dbraw/zinc/90/44/57/387904457.db2.gz ISADXKVNXOSVIZ-MNOVXSKESA-N 2 0 232.318 2.152 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCCCC(F)(F)C1)C1C[NH2+]C1 ZINC000423130118 387906708 /nfs/dbraw/zinc/90/67/08/387906708.db2.gz MJDTVFHCZXTLHI-WDEREUQCSA-N 2 0 246.345 2.400 20 0 BEADRP F[C@@H]1CC[C@H]([NH2+][C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)C1 ZINC000423128849 387906754 /nfs/dbraw/zinc/90/67/54/387906754.db2.gz QPHLZRDGNNHDBT-MBJXGIAVSA-N 2 0 240.366 2.387 20 0 BEADRP C[C@H](F)CC[NH2+][C@@H](Cc1ccccc1)[C@H](C)[NH3+] ZINC000423129552 387907439 /nfs/dbraw/zinc/90/74/39/387907439.db2.gz FGWNIPJMQCMXLU-OBJOEFQTSA-N 2 0 238.350 2.283 20 0 BEADRP C[C@@H]([NH3+])[C@H](Cc1ccccc1)[NH2+]CC[C@H](C)F ZINC000423129554 387908377 /nfs/dbraw/zinc/90/83/77/387908377.db2.gz FGWNIPJMQCMXLU-SCRDCRAPSA-N 2 0 238.350 2.283 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1CCCSC1)[C@@H]1CCC[NH2+]1 ZINC000423131944 387909067 /nfs/dbraw/zinc/90/90/67/387909067.db2.gz UCNVGRSOGZHSNI-AVGNSLFASA-N 2 0 242.432 2.250 20 0 BEADRP Cc1cccnc1C(C)(C)C[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000423132744 387909650 /nfs/dbraw/zinc/90/96/50/387909650.db2.gz CCTUIOLCBUFHHX-STQMWFEESA-N 2 0 249.402 2.383 20 0 BEADRP C[C@H](F)CC[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000423131224 387910340 /nfs/dbraw/zinc/91/03/40/387910340.db2.gz HPGTUZIDSNVGTE-RVMXOQNASA-N 2 0 228.355 2.245 20 0 BEADRP COCC1(C[NH2+][C@@H](C)C[C@@H](C)[NH3+])CCCCC1 ZINC000423134762 387911462 /nfs/dbraw/zinc/91/14/62/387911462.db2.gz FHDUTIUQXGPHAP-OLZOCXBDSA-N 2 0 242.407 2.299 20 0 BEADRP C=Cc1ccc(CC[NH2+][C@H]2CCC[C@H]2[NH3+])cc1 ZINC000423134690 387911519 /nfs/dbraw/zinc/91/15/19/387911519.db2.gz DXSFYMRHJIWMLC-CABCVRRESA-N 2 0 230.355 2.342 20 0 BEADRP C[C@H]([NH2+]C[C@@H](c1ccccc1)C1CC1)C1C[NH2+]C1 ZINC000423133326 387912259 /nfs/dbraw/zinc/91/22/59/387912259.db2.gz QDKNXXMCPNFOFX-LRDDRELGSA-N 2 0 244.382 2.378 20 0 BEADRP C[C@@H]([NH2+]C[C@@H](c1ccccc1)C1CC1)C1C[NH2+]C1 ZINC000423133328 387912486 /nfs/dbraw/zinc/91/24/86/387912486.db2.gz QDKNXXMCPNFOFX-WBMJQRKESA-N 2 0 244.382 2.378 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CCCC1(C)C)C1C[NH2+]C1 ZINC000423135909 387914146 /nfs/dbraw/zinc/91/41/46/387914146.db2.gz OOWYJNXGPSXSFC-ZYHUDNBSSA-N 2 0 210.365 2.010 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]C[C@H]1CCCCC1(F)F ZINC000423150832 387930698 /nfs/dbraw/zinc/93/06/98/387930698.db2.gz ZHTWFQRVULGLNG-GMTAPVOTSA-N 2 0 232.318 2.281 20 0 BEADRP C[NH+]1CCC(C[NH2+]C(C2CC2)C2CC2)CC1 ZINC000044515659 387930919 /nfs/dbraw/zinc/93/09/19/387930919.db2.gz SRPZIELQONNGCD-UHFFFAOYSA-N 2 0 222.376 2.106 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+][C@@H]1CC[NH2+]CC[C@@H]1C ZINC000423152703 387931459 /nfs/dbraw/zinc/93/14/59/387931459.db2.gz MAOPHLLJZFBCHV-QNWHQSFQSA-N 2 0 210.365 2.010 20 0 BEADRP CC(C)[C@@H]1C[C@H]1C[NH2+][C@H]1CC[NH2+]CC[C@H]1C ZINC000423154336 387931942 /nfs/dbraw/zinc/93/19/42/387931942.db2.gz OQVVGVQHJPVQDZ-RFGFWPKPSA-N 2 0 224.392 2.256 20 0 BEADRP CSCC1CCC([NH2+][C@@H](C)C2C[NH2+]C2)CC1 ZINC000423154103 387932394 /nfs/dbraw/zinc/93/23/94/387932394.db2.gz HDJAQFHQIRKZLU-ZBOXLXRLSA-N 2 0 242.432 2.106 20 0 BEADRP CO[C@@H]1CCC[C@H]1[NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000423156629 387936924 /nfs/dbraw/zinc/93/69/24/387936924.db2.gz SVZUKDWXJXUJDS-APIJFGDWSA-N 2 0 246.354 2.288 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCCCC1(F)F)C1C[NH2+]C1 ZINC000423144741 387920378 /nfs/dbraw/zinc/92/03/78/387920378.db2.gz HUZGAHDPZSVEES-GXSJLCMTSA-N 2 0 232.318 2.009 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]CC(C)(C)c1ccccn1 ZINC000423145015 387922388 /nfs/dbraw/zinc/92/23/88/387922388.db2.gz IPTYPCJJFVEWAG-LBPRGKRZSA-N 2 0 235.375 2.076 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+][C@H]1CCCCC[C@@H]1[NH3+] ZINC000423147567 387924197 /nfs/dbraw/zinc/92/41/97/387924197.db2.gz CWPIMXRVCOPNJB-VOAKCMCISA-N 2 0 210.365 2.282 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+][C@H]1CCCCC[C@H]1[NH3+] ZINC000423147568 387925052 /nfs/dbraw/zinc/92/50/52/387925052.db2.gz CWPIMXRVCOPNJB-XQHKEYJVSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CCOC2CCCC2)CC[N@@H+]1C ZINC000156147205 387926934 /nfs/dbraw/zinc/92/69/34/387926934.db2.gz RUICNPXDCJYEDF-STQMWFEESA-N 2 0 240.391 2.018 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)[C@H]1C[C@H]1C ZINC000321159188 387954238 /nfs/dbraw/zinc/95/42/38/387954238.db2.gz XBTPULVAWUTXJN-ITGHMWBKSA-N 2 0 222.376 2.247 20 0 BEADRP CC(C)C[C@@H]1C[C@H]1[NH2+][C@@H]1CCC[C@H]1C[NH3+] ZINC000423169743 387954454 /nfs/dbraw/zinc/95/44/54/387954454.db2.gz KJJMILUNTKEYAG-UMSGYPCISA-N 2 0 210.365 2.138 20 0 BEADRP C[N@@H+](CC1=CCCC1)C[C@@H]1CCC[NH+](C)C1 ZINC000645807752 387954619 /nfs/dbraw/zinc/95/46/19/387954619.db2.gz AFSGITWSKYHKDT-CQSZACIVSA-N 2 0 222.376 2.370 20 0 BEADRP CC(C)O[C@H]1C[C@@H]([NH2+]C2CCC(C[NH3+])CC2)C1 ZINC000423170028 387954994 /nfs/dbraw/zinc/95/49/94/387954994.db2.gz XDQHRUUCZWDSMT-LLZFXZEUSA-N 2 0 240.391 2.050 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[C@H]1C1CC1)C1C[NH2+]C1 ZINC000423168707 387955507 /nfs/dbraw/zinc/95/55/07/387955507.db2.gz HYRVUPQRWCCGIA-SUHUHFCYSA-N 2 0 222.376 2.010 20 0 BEADRP C[C@@H]1CCCC[C@H]1[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000044535201 387938142 /nfs/dbraw/zinc/93/81/42/387938142.db2.gz ONXDOIKKFHVVQH-HZSPNIEDSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]C[C@@H]1C[C@H]1C1CC1 ZINC000423159182 387938812 /nfs/dbraw/zinc/93/88/12/387938812.db2.gz FMMTZDMZDCJIJS-DRZSPHRISA-N 2 0 210.365 2.140 20 0 BEADRP CCn1cc([C@@H](C)[NH2+][C@H](C)CCCC[NH3+])cn1 ZINC000423162503 387943443 /nfs/dbraw/zinc/94/34/43/387943443.db2.gz PPMHODCNCUAHNF-VXGBXAGGSA-N 2 0 238.379 2.071 20 0 BEADRP CC(C)O[C@H]1C[C@@H]([NH2+][C@H]2CCCCC[C@@H]2[NH3+])C1 ZINC000423161544 387944332 /nfs/dbraw/zinc/94/43/32/387944332.db2.gz JBEPBHDGROGZPK-CRWXNKLISA-N 2 0 240.391 2.192 20 0 BEADRP CCCc1ncc(C[NH2+][C@H](C)CCCC[NH3+])o1 ZINC000423165345 387948897 /nfs/dbraw/zinc/94/88/97/387948897.db2.gz UJTQOEGSKRVVQM-LLVKDONJSA-N 2 0 239.363 2.234 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+][C@@H]1C[C@H]1c1ccccc1F ZINC000423166822 387949735 /nfs/dbraw/zinc/94/97/35/387949735.db2.gz DLJNNQQSYAIAJO-OBCWZRDOSA-N 2 0 248.345 2.399 20 0 BEADRP CC[C@@H]1OCC[C@H]1[NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000423166479 387950575 /nfs/dbraw/zinc/95/05/75/387950575.db2.gz CSVKKRJCNDOKLI-KBXIAJHMSA-N 2 0 246.354 2.288 20 0 BEADRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+][C@@H]1C[C@H]1c1ccccc1F ZINC000423166823 387950682 /nfs/dbraw/zinc/95/06/82/387950682.db2.gz DLJNNQQSYAIAJO-UEEZHKSASA-N 2 0 248.345 2.399 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]C[C@@H]1C[C@H]1C1CC1 ZINC000423170767 387958181 /nfs/dbraw/zinc/95/81/81/387958181.db2.gz YULOCWKZSKEVHA-SAXRGWBVSA-N 2 0 222.376 2.010 20 0 BEADRP CO[C@@H]1C[C@H]([NH2+][C@H](C)CCCC[NH3+])C12CCC2 ZINC000423172996 387959568 /nfs/dbraw/zinc/95/95/68/387959568.db2.gz WKQIVEKSMWEDMI-FRRDWIJNSA-N 2 0 240.391 2.051 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CCC[C@@H]1C1CC1 ZINC000423172222 387959633 /nfs/dbraw/zinc/95/96/33/387959633.db2.gz RVRBRHBJDBDUAR-SYQHCUMBSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@@H]([NH2+]C1(C2CCC2)CCC1)[C@@H]1CCC[NH2+]1 ZINC000423172671 387960115 /nfs/dbraw/zinc/96/01/15/387960115.db2.gz UPZLVGGQCCFCFS-YPMHNXCESA-N 2 0 222.376 2.439 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1C[C@H]1c1ccco1 ZINC000423176547 387962517 /nfs/dbraw/zinc/96/25/17/387962517.db2.gz GJPLONMTFMMGBK-IJLUTSLNSA-N 2 0 222.332 2.243 20 0 BEADRP CC1(C)C[C@@H]([NH2+]CCC[NH3+])c2ccccc21 ZINC000423175068 387962582 /nfs/dbraw/zinc/96/25/82/387962582.db2.gz CTSJGONPHKGKMM-CYBMUJFWSA-N 2 0 218.344 2.347 20 0 BEADRP C[C@@H]1CC[C@@H](C)[NH+]1CC[C@H]1CCC[N@@H+]1C ZINC000245593204 387963238 /nfs/dbraw/zinc/96/32/38/387963238.db2.gz GTVWDZDQMYCWBA-JHJVBQTASA-N 2 0 210.365 2.344 20 0 BEADRP CC[C@H](C)C[N@H+](C)CC[C@H]1CCC[NH+]1C ZINC000245589794 387963738 /nfs/dbraw/zinc/96/37/38/387963738.db2.gz FYJRRRQXCOKMFO-QWHCGFSZSA-N 2 0 212.381 2.449 20 0 BEADRP CC[C@@H]([NH2+]CC1([NH3+])CCCCC1)[C@@H]1CCOC1 ZINC000423178136 387964566 /nfs/dbraw/zinc/96/45/66/387964566.db2.gz KGOJAMQWGIYEJO-CHWSQXEVSA-N 2 0 240.391 2.053 20 0 BEADRP C[C@@H]([NH2+]CCC[NH3+])c1cc2c(s1)CCC2 ZINC000423180530 387965605 /nfs/dbraw/zinc/96/56/05/387965605.db2.gz FDASYYGSZFTUTI-SECBINFHSA-N 2 0 224.373 2.236 20 0 BEADRP COc1ccc([C@@H](C)[C@@H](C)[NH2+]CCC[NH3+])cc1 ZINC000423179436 387965842 /nfs/dbraw/zinc/96/58/42/387965842.db2.gz DFHQYHJNPQYZRM-NWDGAFQWSA-N 2 0 236.359 2.126 20 0 BEADRP CCC[C@@H]([NH2+]C1CC[NH2+]CC1)c1cccnc1 ZINC000423179629 387966893 /nfs/dbraw/zinc/96/68/93/387966893.db2.gz HQGSKPUCJMRNNT-CQSZACIVSA-N 2 0 233.359 2.264 20 0 BEADRP Cc1ccc2c(c1)[C@@H]([NH2+]CCC[NH3+])[C@H](C)C2 ZINC000423179953 387966929 /nfs/dbraw/zinc/96/69/29/387966929.db2.gz DOUCHXGZAQTHSF-RISCZKNCSA-N 2 0 218.344 2.167 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+][C@@H]1C[C@H]1c1ccco1 ZINC000423185530 387970208 /nfs/dbraw/zinc/97/02/08/387970208.db2.gz NWHYQZPCQCSSIM-UMSGYPCISA-N 2 0 234.343 2.243 20 0 BEADRP C[C@H]([NH2+]CC1([NH3+])CCCCC1)C1(C)CC1 ZINC000423187243 387970896 /nfs/dbraw/zinc/97/08/96/387970896.db2.gz XOUFKDBRZAMWDS-NSHDSACASA-N 2 0 210.365 2.426 20 0 BEADRP C[C@H]([NH2+]CC1([NH3+])CCCCC1)[C@H]1C[C@H]1C ZINC000423187486 387971484 /nfs/dbraw/zinc/97/14/84/387971484.db2.gz XVEVORLFCOQPCG-WOPDTQHZSA-N 2 0 210.365 2.282 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H](C)c1cccc(C)c1 ZINC000423194943 387980116 /nfs/dbraw/zinc/98/01/16/387980116.db2.gz ZQYFKOZPCXWWKZ-LBPRGKRZSA-N 2 0 206.333 2.255 20 0 BEADRP CC[C@H]([NH2+]CCC[NH2+]C)c1ccccc1 ZINC000423189337 387972931 /nfs/dbraw/zinc/97/29/31/387972931.db2.gz PFLYEQUMRATXRO-ZDUSSCGKSA-N 2 0 206.333 2.337 20 0 BEADRP C[C@@H](C[NH2+][C@@H](C)[C@H]1CCC[NH2+]1)CC(F)(F)F ZINC000423196124 387981879 /nfs/dbraw/zinc/98/18/79/387981879.db2.gz YZTJHIQBGDLQDH-KXUCPTDWSA-N 2 0 238.297 2.305 20 0 BEADRP Cc1cccc2c1[C@@H](C)C[C@@H]2[NH2+]CCC[NH3+] ZINC000423196641 387981733 /nfs/dbraw/zinc/98/17/33/387981733.db2.gz VTNFBDMTJPRJOR-AAEUAGOBSA-N 2 0 218.344 2.482 20 0 BEADRP CCOc1ccc([C@@H](C)[NH2+]CCC[NH2+]C)cc1 ZINC000423192708 387978208 /nfs/dbraw/zinc/97/82/08/387978208.db2.gz VUJHIGOZUOCZMW-GFCCVEGCSA-N 2 0 236.359 2.345 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C2CC2)C2CCC2)C1 ZINC000453068860 387978307 /nfs/dbraw/zinc/97/83/07/387978307.db2.gz TVYMFRFXPSYVCW-SWLSCSKDSA-N 2 0 236.403 2.497 20 0 BEADRP CC[C@@H]1C[C@H](C)CC[C@H]1[NH2+][C@@H]1CC[NH2+]C1 ZINC000423201703 387987903 /nfs/dbraw/zinc/98/79/03/387987903.db2.gz JCLYVLMQJXVSEH-FDYHWXHSSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)[C@@H]([NH2+]C[C@H]1CCC[NH2+]C1)c1cccnc1 ZINC000423202614 387989019 /nfs/dbraw/zinc/98/90/19/387989019.db2.gz BEGPTABTNDTKRS-DZGCQCFKSA-N 2 0 247.386 2.368 20 0 BEADRP Cc1ccc(CCC[NH2+][C@@H]2CCCC[C@H]2[NH3+])cn1 ZINC000424362601 387990455 /nfs/dbraw/zinc/99/04/55/387990455.db2.gz AJMLHNNJYZGURR-HUUCEWRRSA-N 2 0 247.386 2.182 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1CCC[NH2+]C1)[C@H]1C[C@@H]1C ZINC000423205625 387991077 /nfs/dbraw/zinc/99/10/77/387991077.db2.gz FGIYLXSMNBIONZ-RNJOBUHISA-N 2 0 210.365 2.010 20 0 BEADRP COc1ccc([C@@H](C)[NH2+]CCC[NH3+])c(C)c1 ZINC000423197053 387982452 /nfs/dbraw/zinc/98/24/52/387982452.db2.gz XPEXJFVIYQDIEX-LLVKDONJSA-N 2 0 222.332 2.003 20 0 BEADRP Cc1cc2c(cc1C)[C@@H]([NH2+]CCC[NH3+])CCCO2 ZINC000423197442 387982495 /nfs/dbraw/zinc/98/24/95/387982495.db2.gz ZLDLJFNSGFTRHI-AWEZNQCLSA-N 2 0 248.370 2.456 20 0 BEADRP CC[C@H]([NH2+]CCC[NH2+]C)c1cccc(F)c1 ZINC000423197690 387983549 /nfs/dbraw/zinc/98/35/49/387983549.db2.gz APXKIPVCSRHGSS-ZDUSSCGKSA-N 2 0 224.323 2.476 20 0 BEADRP C[C@@H]([NH2+]CC1([NH3+])CCCCCC1)C1CC1 ZINC000423198541 387983874 /nfs/dbraw/zinc/98/38/74/387983874.db2.gz GKNRLQRNJQDXOH-LLVKDONJSA-N 2 0 210.365 2.426 20 0 BEADRP C[NH2+]CCC[NH2+][C@H](c1ccccc1)C1CC1 ZINC000423197936 387984124 /nfs/dbraw/zinc/98/41/24/387984124.db2.gz CBCYTTTWDUILKL-CQSZACIVSA-N 2 0 218.344 2.337 20 0 BEADRP CC[C@@H]([NH2+]CCC[NH2+]C)c1cccs1 ZINC000423198012 387984154 /nfs/dbraw/zinc/98/41/54/387984154.db2.gz CNRNBNZPDBITAQ-SNVBAGLBSA-N 2 0 212.362 2.398 20 0 BEADRP CCC1(CC)[C@H]([NH2+]CCC[NH2+]C)[C@H](C)[C@H]1OC ZINC000423197859 387984680 /nfs/dbraw/zinc/98/46/80/387984680.db2.gz BNROEMAKZHRYBN-YNEHKIRRSA-N 2 0 242.407 2.025 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H]2C[C@H]3C[C@H]3C2)[C@H](C)C1 ZINC000424349611 387985534 /nfs/dbraw/zinc/98/55/34/387985534.db2.gz MDGUAVMUJOPKOE-RGDJUOJXSA-N 2 0 222.376 2.105 20 0 BEADRP CC[C@@H]([NH2+]CCC[NH2+]C)c1ccsc1 ZINC000423199669 387986467 /nfs/dbraw/zinc/98/64/67/387986467.db2.gz KLAJDKMDUKGCJE-LLVKDONJSA-N 2 0 212.362 2.398 20 0 BEADRP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1)[C@H]1C[C@H]1C ZINC000423216066 387997325 /nfs/dbraw/zinc/99/73/25/387997325.db2.gz NYLFJHSSVPZARB-SJHCENCUSA-N 2 0 210.365 2.009 20 0 BEADRP Cc1cncc([C@H](C)[NH2+]C[C@@H]2CCC[NH2+]C2)c1 ZINC000423214045 387997551 /nfs/dbraw/zinc/99/75/51/387997551.db2.gz OFPGYPRJHZNAOL-QWHCGFSZSA-N 2 0 233.359 2.040 20 0 BEADRP CC[C@H]([NH2+][C@H](C)[C@@H]1CCC[NH2+]C1)C1CC1 ZINC000423215282 387997582 /nfs/dbraw/zinc/99/75/82/387997582.db2.gz MVYLCEYVQKNHOP-RTXFEEFZSA-N 2 0 210.365 2.153 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+][C@H](C)[C@@H]1CCC[NH2+]C1 ZINC000423214308 387998028 /nfs/dbraw/zinc/99/80/28/387998028.db2.gz LDNGBPZCILXVKQ-HZSPNIEDSA-N 2 0 247.386 2.429 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1CCC[NH2+]C1)c1ccncc1 ZINC000423217706 387999448 /nfs/dbraw/zinc/99/94/48/387999448.db2.gz UJWBRUNOEVQGKW-OCCSQVGLSA-N 2 0 233.359 2.122 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+][C@@H]1C[C@H]2C[C@H]2C1 ZINC000424386030 388000919 /nfs/dbraw/zinc/00/09/19/388000919.db2.gz XCNTZLGNXRLXNJ-NZEXEKPDSA-N 2 0 208.349 2.035 20 0 BEADRP C[C@H]([NH3+])[C@H](Cc1ccccc1)[NH2+][C@@H]1C[C@H]2C[C@H]2C1 ZINC000424382325 388001383 /nfs/dbraw/zinc/00/13/83/388001383.db2.gz SAWYKKOVCTVRMP-SLZITWOASA-N 2 0 244.382 2.333 20 0 BEADRP CSCC[C@H](C)[N@H+](C)C[C@H]1CCC[NH2+]C1 ZINC000252690072 135097369 /nfs/dbraw/zinc/09/73/69/135097369.db2.gz TWDQYWZOJIZKNF-RYUDHWBXSA-N 2 0 230.421 2.059 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H](C)c1ccc2c(c1)COC2 ZINC000423223939 388006539 /nfs/dbraw/zinc/00/65/39/388006539.db2.gz IAPRKABOMLVVGP-QWRGUYRKSA-N 2 0 234.343 2.105 20 0 BEADRP CSCC1CCC([NH2+]CC[C@H](C)[NH3+])CC1 ZINC000423226502 388009287 /nfs/dbraw/zinc/00/92/87/388009287.db2.gz QYODJPYZIVVHNR-UNXYVOJBSA-N 2 0 230.421 2.235 20 0 BEADRP C(C[C@@H]1CC[NH2+]C1)[NH2+][C@H](C1CC1)C1CCC1 ZINC000423240578 388023638 /nfs/dbraw/zinc/02/36/38/388023638.db2.gz CJQYZXOECYNFAQ-FZMZJTMJSA-N 2 0 222.376 2.154 20 0 BEADRP COc1cc([C@H](C)[NH2+]CC[C@H](C)[NH3+])ccc1F ZINC000423228487 388013073 /nfs/dbraw/zinc/01/30/73/388013073.db2.gz ZVLMNBOASSUGFC-UWVGGRQHSA-N 2 0 240.322 2.222 20 0 BEADRP C[C@H](C[NH2+][C@H](C1CC1)C1CCC1)C[NH+](C)C ZINC000453224465 388014541 /nfs/dbraw/zinc/01/45/41/388014541.db2.gz AXGZAGOPMIHUOA-RISCZKNCSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H]1CCCc2ccccc21 ZINC000423231777 388016856 /nfs/dbraw/zinc/01/68/56/388016856.db2.gz LTVILMMBWLFMMR-SMDDNHRTSA-N 2 0 218.344 2.391 20 0 BEADRP CCOC[C@@H]1CCC[C@@H]1[NH2+]C1CCC([NH3+])CC1 ZINC000423233761 388018463 /nfs/dbraw/zinc/01/84/63/388018463.db2.gz OQXMWGDDRWPGAW-ABXWRUBCSA-N 2 0 240.391 2.051 20 0 BEADRP Cc1ccccc1[C@H](C)[NH2+]CC[C@H](C)[NH3+] ZINC000423233781 388019127 /nfs/dbraw/zinc/01/91/27/388019127.db2.gz OTIHKHMWBCJECR-RYUDHWBXSA-N 2 0 206.333 2.383 20 0 BEADRP Cc1cncc([C@@H](C)[NH2+]CC[C@@H]2CC[NH2+]C2)c1 ZINC000423238441 388022067 /nfs/dbraw/zinc/02/20/67/388022067.db2.gz AJKYWOONZNVBRN-OLZOCXBDSA-N 2 0 233.359 2.040 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1cccc(F)c1 ZINC000423249730 388032071 /nfs/dbraw/zinc/03/20/71/388032071.db2.gz PNSFGZWHBZQLRZ-NEPJUHHUSA-N 2 0 236.334 2.476 20 0 BEADRP C[N@@H+]1CCCC[C@@H]1CC[NH+]1C2CCC1CC2 ZINC000533237356 388034319 /nfs/dbraw/zinc/03/43/19/388034319.db2.gz QTNBTJPCXIYXFK-IYXRBSQSSA-N 2 0 222.376 2.488 20 0 BEADRP CC[C@H]([NH2+]CC[C@@H]1CC[NH2+]C1)C1CCC1 ZINC000423254352 388035689 /nfs/dbraw/zinc/03/56/89/388035689.db2.gz XTAYSXIFAJEFCZ-AAEUAGOBSA-N 2 0 210.365 2.154 20 0 BEADRP CC[C@H]([NH2+]CC[C@H]1CCC[NH2+]C1)C1CC1 ZINC000423256071 388036376 /nfs/dbraw/zinc/03/63/76/388036376.db2.gz DIODFGCOEBYHGQ-YPMHNXCESA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)c1ccco1 ZINC000423255432 388036393 /nfs/dbraw/zinc/03/63/93/388036393.db2.gz CBRLDXCQFSXJGX-RYUDHWBXSA-N 2 0 222.332 2.320 20 0 BEADRP CC[C@H]([NH2+]C[C@H](C)C[NH2+]C)[C@H]1CC1(C)C ZINC000423255733 388037257 /nfs/dbraw/zinc/03/72/57/388037257.db2.gz APZNKWMKLRQBJB-UTUOFQBUSA-N 2 0 212.381 2.256 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+][C@@H]1CC[N@H+](C)[C@@H]2CCC[C@H]21 ZINC000453303018 388039985 /nfs/dbraw/zinc/03/99/85/388039985.db2.gz BAXWELFZJNIBHZ-GZBLMMOJSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@H](CN)C1CCCCC1 ZINC000423262188 388040426 /nfs/dbraw/zinc/04/04/26/388040426.db2.gz LYEAELALORBXBM-TZMCWYRMSA-N 2 0 241.423 2.001 20 0 BEADRP COC[C@@H]([NH2+]CCCC[NH+](C)C)C1CCCC1 ZINC000446842751 388041581 /nfs/dbraw/zinc/04/15/81/388041581.db2.gz YBCNWBCIGWTAPB-CQSZACIVSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@@H]1CC(C)(C)C[C@@H]1C ZINC000423263904 388041736 /nfs/dbraw/zinc/04/17/36/388041736.db2.gz BJPSWMQCMXKOSC-QJPTWQEYSA-N 2 0 212.381 2.384 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CC[NH2+]C1)C1CCSCC1 ZINC000423245474 388027959 /nfs/dbraw/zinc/02/79/59/388027959.db2.gz IZYUDMRPJLMEBA-VXGBXAGGSA-N 2 0 242.432 2.107 20 0 BEADRP Cc1ccnc([C@H](C)[NH2+]CC[C@H]2CC[NH2+]C2)c1 ZINC000423247268 388030515 /nfs/dbraw/zinc/03/05/15/388030515.db2.gz KYBWZXBNXYKPEO-QWHCGFSZSA-N 2 0 233.359 2.040 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+]C1[C@@H](C)CCC[C@@H]1C ZINC000423271724 388051110 /nfs/dbraw/zinc/05/11/10/388051110.db2.gz JEYSCWWEGDMDEI-SDDRHHMPSA-N 2 0 212.381 2.384 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H](C)c1cccc(F)c1 ZINC000423274646 388055281 /nfs/dbraw/zinc/05/52/81/388055281.db2.gz MHAQTOYKKYWKQQ-QWRGUYRKSA-N 2 0 224.323 2.332 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H](c1cccnc1)C1CCC1 ZINC000423274350 388055576 /nfs/dbraw/zinc/05/55/76/388055576.db2.gz MAEQWABKMGQBLA-WFASDCNBSA-N 2 0 247.386 2.368 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CCC12CCC2 ZINC000423275933 388056297 /nfs/dbraw/zinc/05/62/97/388056297.db2.gz MJFSUVQLOXKFAH-AVGNSLFASA-N 2 0 222.376 2.426 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H]1CC[C@@H]1C(C)(C)C ZINC000423276147 388057463 /nfs/dbraw/zinc/05/74/63/388057463.db2.gz OFDNJCZWQMEMAT-SRVKXCTJSA-N 2 0 212.381 2.256 20 0 BEADRP CCC[C@@H]1CCC[C@@H]1[NH2+]C[C@@H](C)C[NH2+]C ZINC000423279095 388060487 /nfs/dbraw/zinc/06/04/87/388060487.db2.gz RXNRSHAJPXJUJX-XQQFMLRXSA-N 2 0 212.381 2.400 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+]C1CCC(C(F)F)CC1 ZINC000423279522 388060725 /nfs/dbraw/zinc/06/07/25/388060725.db2.gz SEVBTFLWNNCSHE-VQXHTEKXSA-N 2 0 234.334 2.383 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CC[C@H]1C1CCC1 ZINC000423280613 388061492 /nfs/dbraw/zinc/06/14/92/388061492.db2.gz UXMUPOCNCWJEAM-WCFLWFBJSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+][C@@H]1CCCC[C@H]1C[NH3+] ZINC000423279564 388061779 /nfs/dbraw/zinc/06/17/79/388061779.db2.gz RNEYPUVCNWQOJC-KWCYVHTRSA-N 2 0 236.359 2.318 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H]1CCc2ccccc21 ZINC000423280976 388061808 /nfs/dbraw/zinc/06/18/08/388061808.db2.gz VDDNNUPBQLODLY-RISCZKNCSA-N 2 0 218.344 2.119 20 0 BEADRP Cc1cc([C@H](C)[NH2+]CC[C@H]2CCC[NH2+]C2)no1 ZINC000423281926 388064285 /nfs/dbraw/zinc/06/42/85/388064285.db2.gz VYXRFMSLRYITPO-NWDGAFQWSA-N 2 0 237.347 2.023 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+][C@@H]1CCCC[C@@H]1C[NH3+] ZINC000423283447 388065122 /nfs/dbraw/zinc/06/51/22/388065122.db2.gz WEIRWKOZZNLVCV-LPWJVIDDSA-N 2 0 210.365 2.282 20 0 BEADRP CC[C@@H]1CCCC[C@@H]1[NH2+]C[C@@H](C)C[NH2+]C ZINC000423284418 388066995 /nfs/dbraw/zinc/06/69/95/388066995.db2.gz YLDWFLKRNPIIHJ-XQQFMLRXSA-N 2 0 212.381 2.400 20 0 BEADRP COC[C@H]([NH2+]CCCC[N@H+](C)C1CC1)C(C)C ZINC000453386256 388067339 /nfs/dbraw/zinc/06/73/39/388067339.db2.gz ALGHAOWZTBFARA-AWEZNQCLSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CCCC[N@H+](C)C2CC2)CCO1 ZINC000453387787 388067377 /nfs/dbraw/zinc/06/73/77/388067377.db2.gz BFQXRSHIUUJALD-QWHCGFSZSA-N 2 0 240.391 2.018 20 0 BEADRP COC[C@@H]([NH2+]CCCC[N@H+](C)C1CC1)C(C)C ZINC000453386258 388068060 /nfs/dbraw/zinc/06/80/60/388068060.db2.gz ALGHAOWZTBFARA-CQSZACIVSA-N 2 0 242.407 2.121 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@@H]1CC[C@@H]1C1CCC1 ZINC000423285125 388069188 /nfs/dbraw/zinc/06/91/88/388069188.db2.gz YXOJENCXFXNFOE-JHJVBQTASA-N 2 0 210.365 2.138 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@H]1CC[C@@H]1C1CCC1 ZINC000423285126 388069478 /nfs/dbraw/zinc/06/94/78/388069478.db2.gz YXOJENCXFXNFOE-UPJWGTAASA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H]1CC[C@H](C)C[N@H+]1CCC1CC[NH2+]CC1 ZINC000084048332 388070917 /nfs/dbraw/zinc/07/09/17/388070917.db2.gz OKOUGHNLHWSCFE-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP C[N@H+](CCCC[NH2+][C@@H]1CCCOCC1)C1CC1 ZINC000453397541 388071263 /nfs/dbraw/zinc/07/12/63/388071263.db2.gz JPGJBTAUORQEGF-CYBMUJFWSA-N 2 0 240.391 2.020 20 0 BEADRP CC(C)([NH3+])C[NH2+][C@@H](C1CC1)C1CCCC1 ZINC000423287357 388071755 /nfs/dbraw/zinc/07/17/55/388071755.db2.gz LSALNCWNFJXTHB-GFCCVEGCSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)([NH3+])C[NH2+][C@H]1CCC[C@@H](c2cccnc2)C1 ZINC000423287675 388072668 /nfs/dbraw/zinc/07/26/68/388072668.db2.gz NVAAYUCKNMYPAY-OCCSQVGLSA-N 2 0 247.386 2.435 20 0 BEADRP C[C@H]([NH2+][C@H]1CCCC[C@@H]1C[NH3+])c1ccco1 ZINC000084216004 388074181 /nfs/dbraw/zinc/07/41/81/388074181.db2.gz GAMGJRLKUVMGSE-TUAOUCFPSA-N 2 0 222.332 2.448 20 0 BEADRP C[N@H+](CCCC[NH2+][C@H]1CCCSC1)C1CC1 ZINC000453411699 388077118 /nfs/dbraw/zinc/07/71/18/388077118.db2.gz VZDLYQCCRAZZQH-LBPRGKRZSA-N 2 0 242.432 2.346 20 0 BEADRP CC[C@H]([NH2+]C[C@H](C)C[NH3+])c1ccc(F)cc1 ZINC000423295545 388077161 /nfs/dbraw/zinc/07/71/61/388077161.db2.gz FCLNSQUVJFBLBR-MFKMUULPSA-N 2 0 224.323 2.461 20 0 BEADRP CSC[C@H](C)[NH2+][C@@H]1CC[N@H+](C)[C@H]2CCC[C@@H]21 ZINC000336658273 388077258 /nfs/dbraw/zinc/07/72/58/388077258.db2.gz BHMPUCLPWKORBM-LOWDOPEQSA-N 2 0 242.432 2.200 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+]C[C@H](C)C[NH3+])CCCO2 ZINC000423296884 388079016 /nfs/dbraw/zinc/07/90/16/388079016.db2.gz HWBVQSTUCHIECS-TZMCWYRMSA-N 2 0 248.370 2.393 20 0 BEADRP CC[C@@H]([NH2+]C[C@H](C)C[NH3+])c1cccc(OC)c1 ZINC000423297488 388079382 /nfs/dbraw/zinc/07/93/82/388079382.db2.gz KNBIJURYJRTRNM-BXUZGUMPSA-N 2 0 236.359 2.331 20 0 BEADRP CC(C)C[C@H]([NH2+]C[C@H](C)C[NH3+])c1ccccn1 ZINC000423297677 388079399 /nfs/dbraw/zinc/07/93/99/388079399.db2.gz LHVDADHWIYOOLN-OCCSQVGLSA-N 2 0 235.375 2.353 20 0 BEADRP COc1ccc2c(c1)CCC[C@H]2[NH2+]C[C@H](C)C[NH3+] ZINC000423297642 388079683 /nfs/dbraw/zinc/07/96/83/388079683.db2.gz LDDUONMPNRSWGX-IAQYHMDHSA-N 2 0 248.370 2.257 20 0 BEADRP Cc1ccc2c(c1)[C@@H]([NH2+]C[C@@H](C)C[NH3+])CC2 ZINC000423297493 388079753 /nfs/dbraw/zinc/07/97/53/388079753.db2.gz KNBQADDCOZHGAK-FZMZJTMJSA-N 2 0 218.344 2.167 20 0 BEADRP Cc1ccsc1[C@@H](C)[NH2+]C[C@@H](C)C[NH3+] ZINC000423298119 388079844 /nfs/dbraw/zinc/07/98/44/388079844.db2.gz NEYUSWNWBPGUGI-WCBMZHEXSA-N 2 0 212.362 2.302 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H](C)C[NH3+])c1cccc(OC)c1 ZINC000423297491 388080394 /nfs/dbraw/zinc/08/03/94/388080394.db2.gz KNBIJURYJRTRNM-SMDDNHRTSA-N 2 0 236.359 2.331 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CCC2CC(F)(F)C2)CC[N@@H+]1C ZINC000453426109 388081472 /nfs/dbraw/zinc/08/14/72/388081472.db2.gz ONXPCSTXDPIJTF-CMPLNLGQSA-N 2 0 246.345 2.494 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@@H](C)c1ccccc1 ZINC000336659058 388083596 /nfs/dbraw/zinc/08/35/96/388083596.db2.gz BMCHECFBNHFIKW-RYUDHWBXSA-N 2 0 206.333 2.465 20 0 BEADRP CC(C)CO[C@@H]1C[C@@H]([NH2+]CCCC[NH3+])C1(C)C ZINC000085400662 388086875 /nfs/dbraw/zinc/08/68/75/388086875.db2.gz GRXGKIFNPPFZCL-CHWSQXEVSA-N 2 0 242.407 2.155 20 0 BEADRP CCO[C@H]1C[C@@H]([NH2+]CCCC[NH+](C)C)C1(C)C ZINC000085398158 388087612 /nfs/dbraw/zinc/08/76/12/388087612.db2.gz SMFXBJPMXQLNAL-OLZOCXBDSA-N 2 0 242.407 2.121 20 0 BEADRP CC[C@H](C)C[NH2+]CCCC[N@H+](C)C1CC1 ZINC000453593526 388088585 /nfs/dbraw/zinc/08/85/85/388088585.db2.gz GOFSCFBGQVAJAX-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP C[N@H+](CCCC[NH2+]Cc1cscn1)C1CC1 ZINC000453594360 388089136 /nfs/dbraw/zinc/08/91/36/388089136.db2.gz IFQDAMDKIHBROM-UHFFFAOYSA-N 2 0 239.388 2.107 20 0 BEADRP CCO[C@@H]1C[C@H]([NH2+]CCCC[NH3+])C12CCCC2 ZINC000085679968 388094115 /nfs/dbraw/zinc/09/41/15/388094115.db2.gz VVOPJGPEZDUQSJ-QWHCGFSZSA-N 2 0 240.391 2.053 20 0 BEADRP Cc1cc(NC[C@H]2[N@H+](C)CCCC2(C)C)cc[nH+]1 ZINC000447808880 388094089 /nfs/dbraw/zinc/09/40/89/388094089.db2.gz WUKPYVCPGLOBFK-CQSZACIVSA-N 2 0 247.386 2.344 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]Cc2ccccc2F)C1 ZINC000086402016 388101419 /nfs/dbraw/zinc/10/14/19/388101419.db2.gz JNPMFFSRAHBNFZ-NWDGAFQWSA-N 2 0 222.307 2.185 20 0 BEADRP Cc1ccccc1C[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000086403258 388101508 /nfs/dbraw/zinc/10/15/08/388101508.db2.gz JKIYZIXUMKZRHK-UONOGXRCSA-N 2 0 218.344 2.355 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@H]([NH3+])C1)c1cccnc1 ZINC000086402306 388101745 /nfs/dbraw/zinc/10/17/45/388101745.db2.gz VWNHKFSYIJLCTR-WCFLWFBJSA-N 2 0 219.332 2.002 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H]2CCCOCC2)CC1 ZINC000086870145 388109623 /nfs/dbraw/zinc/10/96/23/388109623.db2.gz KFAZXWBXDZJNHN-ZDUSSCGKSA-N 2 0 240.391 2.020 20 0 BEADRP C[C@@H]1CCC[C@H](C[N@@H+]2CC[C@H]([NH3+])[C@H](C)C2)C1 ZINC000086884271 388110092 /nfs/dbraw/zinc/11/00/92/388110092.db2.gz ILBOPLDSZVRMND-MQYQWHSLSA-N 2 0 224.392 2.482 20 0 BEADRP C[C@H]([NH2+][C@H]1CCCC[C@H]1C[NH3+])c1cncs1 ZINC000423269385 388047325 /nfs/dbraw/zinc/04/73/25/388047325.db2.gz FQVNWYGHEWNFGA-DCAQKATOSA-N 2 0 239.388 2.311 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CCC(C)(F)F)[C@@H](C)C1 ZINC000449354692 388180022 /nfs/dbraw/zinc/18/00/22/388180022.db2.gz QMSZPVNBDOJOGQ-QWRGUYRKSA-N 2 0 234.334 2.352 20 0 BEADRP C[C@H]1C[C@H]1C[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC000488464207 388181062 /nfs/dbraw/zinc/18/10/62/388181062.db2.gz RGNFRHTYQQQAFB-WFASDCNBSA-N 2 0 232.371 2.494 20 0 BEADRP CC[C@@H]([NH2+]CC1CC[NH2+]CC1)C1CCC1 ZINC000324920449 388126660 /nfs/dbraw/zinc/12/66/60/388126660.db2.gz LDJNRPWPRHHXOC-CYBMUJFWSA-N 2 0 210.365 2.154 20 0 BEADRP CC[C@H]([NH2+][C@H]1CCC[C@H]([NH3+])C1)C1CCC1 ZINC000324956793 388129323 /nfs/dbraw/zinc/12/93/23/388129323.db2.gz VWAMDECPCFTVCQ-AVGNSLFASA-N 2 0 210.365 2.425 20 0 BEADRP CC[C@H]([NH2+][C@H]1CCC[C@@H]([NH3+])C1)C1CCC1 ZINC000324956792 388129387 /nfs/dbraw/zinc/12/93/87/388129387.db2.gz VWAMDECPCFTVCQ-AGIUHOORSA-N 2 0 210.365 2.425 20 0 BEADRP CCC[NH2+][C@@H](C)C(=O)Nc1ccc([C@H](C)[NH3+])cc1 ZINC000449124154 388145081 /nfs/dbraw/zinc/14/50/81/388145081.db2.gz FSTBTXRWDFTCGE-QWRGUYRKSA-N 2 0 249.358 2.033 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)C1CC1 ZINC000449442085 388206861 /nfs/dbraw/zinc/20/68/61/388206861.db2.gz WFDMGXKNUNUYAG-WXHSDQCUSA-N 2 0 208.349 2.001 20 0 BEADRP C[N@H+](CC[C@H]1CCC[NH+]1C)[C@@H]1CC1(C)C ZINC000489515943 388219504 /nfs/dbraw/zinc/21/95/04/388219504.db2.gz PEKPTJVOGGHHIO-VXGBXAGGSA-N 2 0 210.365 2.201 20 0 BEADRP CC[NH+](CC)CCC[N@@H+]1CC[C@@H](OC)[C@@H](C)C1 ZINC000451578834 388282668 /nfs/dbraw/zinc/28/26/68/388282668.db2.gz XUPVKUBOFRIWIN-UONOGXRCSA-N 2 0 242.407 2.075 20 0 BEADRP CO[C@@H]1CCC[C@H]1[NH2+]CCC[NH+]1CCCCC1 ZINC000451628539 388285386 /nfs/dbraw/zinc/28/53/86/388285386.db2.gz BFEHGFQNNKRIAJ-ZIAGYGMSSA-N 2 0 240.391 2.020 20 0 BEADRP CC[C@H](C)[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000181116363 256586308 /nfs/dbraw/zinc/58/63/08/256586308.db2.gz STWPNIFUTBWOQR-LBPRGKRZSA-N 2 0 212.381 2.449 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]C[C@H]2CC=CCC2)C1 ZINC000086403861 388347914 /nfs/dbraw/zinc/34/79/14/388347914.db2.gz LBVQOGFBKHIEDX-YNEHKIRRSA-N 2 0 208.349 2.202 20 0 BEADRP C[C@H](CN)[NH2+]C1CCC(C(F)(F)F)CC1 ZINC000235448806 388369710 /nfs/dbraw/zinc/36/97/10/388369710.db2.gz KXSGPMYGSVBIGX-AFPNSQJFSA-N 2 0 224.270 2.044 20 0 BEADRP C[C@H](Cc1ccsc1)[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000519349504 256647367 /nfs/dbraw/zinc/64/73/67/256647367.db2.gz HNKUQBWLBRSNJA-DGCLKSJQSA-N 2 0 238.400 2.411 20 0 BEADRP Cc1cnccc1CC[N@@H+](C)C[C@@H]1CCCOC1 ZINC000572872619 388383354 /nfs/dbraw/zinc/38/33/54/388383354.db2.gz GNTIUIQIRGTHIG-AWEZNQCLSA-N 2 0 248.370 2.291 20 0 BEADRP Cc1sccc1C[NH2+]C[C@@H]1CCCN1C ZINC000293460246 388388927 /nfs/dbraw/zinc/38/89/27/388388927.db2.gz DCCRFYJLCYZYPK-LBPRGKRZSA-N 2 0 224.373 2.240 20 0 BEADRP CCC(C)(C)OCC[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000308550696 388442445 /nfs/dbraw/zinc/44/24/45/388442445.db2.gz WONAKGMROFODTE-OLZOCXBDSA-N 2 0 242.407 2.264 20 0 BEADRP [NH3+]CCCC[NH2+]Cc1sccc1Cl ZINC000394082877 388450573 /nfs/dbraw/zinc/45/05/73/388450573.db2.gz JWTLSHJYIXNVHJ-UHFFFAOYSA-N 2 0 218.753 2.230 20 0 BEADRP Cc1ccc(C[N@@H+]2C[C@H](C[NH3+])[C@@H](C)C[C@H]2C)cn1 ZINC000397304644 388458298 /nfs/dbraw/zinc/45/82/98/388458298.db2.gz LYEUKELYWFBAQR-LNSITVRQSA-N 2 0 247.386 2.195 20 0 BEADRP CCC[C@H](C)C[N@@H+]1C[C@@H]2CC[C@H]([NH3+])[C@@H]2C1 ZINC000336712249 388466643 /nfs/dbraw/zinc/46/66/43/388466643.db2.gz UXNXDUWPIJSGEL-RVMXOQNASA-N 2 0 210.365 2.092 20 0 BEADRP CCS[C@@H]1CC[C@H]([N@H+](C)CCC[NH2+]C)C1 ZINC000336719419 388468245 /nfs/dbraw/zinc/46/82/45/388468245.db2.gz YEMQVQMZHDTJJW-NWDGAFQWSA-N 2 0 230.421 2.202 20 0 BEADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@H](C)[C@H](C)CC ZINC000165939762 388413702 /nfs/dbraw/zinc/41/37/02/388413702.db2.gz HOOIHZKBFAMATP-MGPQQGTHSA-N 2 0 244.423 2.367 20 0 BEADRP CC(C)C[C@@H]1CC[N@H+](CC[C@H]2CC[NH2+]C2)C1 ZINC000307824515 388427440 /nfs/dbraw/zinc/42/74/40/388427440.db2.gz XIOYNJJQUXQFRW-KGLIPLIRSA-N 2 0 224.392 2.354 20 0 BEADRP C[N@@H+]1CC[C@]2(CC[NH+](CC3CC(C)(C)C3)C2)C1 ZINC000528510620 388538811 /nfs/dbraw/zinc/53/88/11/388538811.db2.gz BMJILERZVIYPRK-HNNXBMFYSA-N 2 0 236.403 2.450 20 0 BEADRP C[C@@H]1C[C@H](C)[N@H+]1CCC[NH+]1CCCCC1 ZINC000548096654 388511127 /nfs/dbraw/zinc/51/11/27/388511127.db2.gz FFIZROGSFNYSAR-BETUJISGSA-N 2 0 210.365 2.345 20 0 BEADRP C[C@H](CCC1CC1)[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000398043905 388515394 /nfs/dbraw/zinc/51/53/94/388515394.db2.gz AESVLYRUNXIUIZ-YPMHNXCESA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[NH+]1CCC(C[NH3+])CC1 ZINC000346688374 388520457 /nfs/dbraw/zinc/52/04/57/388520457.db2.gz NPVJTAPAAHBSGS-TZMCWYRMSA-N 2 0 224.392 2.483 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]C[C@@H]2CCC(F)(F)C2)C1 ZINC000516877925 388520573 /nfs/dbraw/zinc/52/05/73/388520573.db2.gz RAMYPWFOMRYABP-MXWKQRLJSA-N 2 0 232.318 2.281 20 0 BEADRP CCc1cc(N2CC[N@@H+](CC)[C@H](C)C2)cc[nH+]1 ZINC000649311189 388597333 /nfs/dbraw/zinc/59/73/33/388597333.db2.gz WPCQNOYZAXVWGE-GFCCVEGCSA-N 2 0 233.359 2.174 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CC2(C)CCC2)[C@@H](C)C1 ZINC000222211705 388615843 /nfs/dbraw/zinc/61/58/43/388615843.db2.gz IFGIANBTQISFAK-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1cncc([C@H](C)[NH2+]C[C@@H]2CCCN2C)c1 ZINC000184302823 388575743 /nfs/dbraw/zinc/57/57/43/388575743.db2.gz DDZJNWRVHPHAEK-JSGCOSHPSA-N 2 0 233.359 2.135 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH+](C)CCCCOC)[C@@H](C)C1 ZINC000245439388 388580010 /nfs/dbraw/zinc/58/00/10/388580010.db2.gz SUWBYOYSPVASLV-KBPBESRZSA-N 2 0 242.407 2.075 20 0 BEADRP CCC[N@H+](C)C[C@@H]1CC[NH+](CCCCOC)C1 ZINC000081571796 388584299 /nfs/dbraw/zinc/58/42/99/388584299.db2.gz ZNGSEFGLAIDATQ-AWEZNQCLSA-N 2 0 242.407 2.077 20 0 BEADRP CC1=CC[C@@H]([NH2+]C[C@@H]2CCC[N@@H+](C)C2)CC1 ZINC000552117518 388670556 /nfs/dbraw/zinc/67/05/56/388670556.db2.gz PPZPIWQILHKFIS-UONOGXRCSA-N 2 0 222.376 2.417 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH+](C)CC2CC2)[C@@H](C)C1 ZINC000248293019 388675007 /nfs/dbraw/zinc/67/50/07/388675007.db2.gz XGTLWMFBTMPVOI-AAEUAGOBSA-N 2 0 210.365 2.059 20 0 BEADRP CC1(C)CCC[C@H]1[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000530177320 388621766 /nfs/dbraw/zinc/62/17/66/388621766.db2.gz FYBJECJREZRIJO-VXGBXAGGSA-N 2 0 222.376 2.439 20 0 BEADRP CCC[C@H](C[NH2+][C@@H]1CCCC[C@@H]1C[NH3+])OCC ZINC000530206570 388626617 /nfs/dbraw/zinc/62/66/17/388626617.db2.gz APOIPLXOJUFKTD-MGPQQGTHSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CC[C@H]2C[C@H]2C1)[C@@H]1CCC[NH2+]1 ZINC000530212362 388627941 /nfs/dbraw/zinc/62/79/41/388627941.db2.gz RGDGSGAFINLVGS-VJTDZRGJSA-N 2 0 222.376 2.153 20 0 BEADRP COC[C@@H](C)C[NH2+]CCC[N@@H+]1CCCC[C@H]1C ZINC000248572699 388684370 /nfs/dbraw/zinc/68/43/70/388684370.db2.gz NGGHXHZUPPIFAV-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)C1CC([NH2+][C@H]2CC[NH2+]C23CCC3)C1 ZINC000530215753 388628752 /nfs/dbraw/zinc/62/87/52/388628752.db2.gz IQLRPAJDBHAKLL-BPCQOVAHSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[NH2+]C12CCC2)C(C)(C)C ZINC000530216299 388630249 /nfs/dbraw/zinc/63/02/49/388630249.db2.gz AFADZDBNTDVFDJ-WDEREUQCSA-N 2 0 210.365 2.295 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]CC[C@H]1CC=CCC1 ZINC000530221904 388633112 /nfs/dbraw/zinc/63/31/12/388633112.db2.gz PQXKORLXXZBFEA-XQQFMLRXSA-N 2 0 208.349 2.202 20 0 BEADRP C[C@H]1CC[N@H+](CC2CC(C)(C)C2)C[C@H]1C[NH3+] ZINC000530222914 388634072 /nfs/dbraw/zinc/63/40/72/388634072.db2.gz IRNCGANPUMHQSV-WCQYABFASA-N 2 0 224.392 2.339 20 0 BEADRP C[C@H]1CC(F)(F)CC[N@@H+]1CC[C@H]1CC[NH2+]C1 ZINC000530233639 388636683 /nfs/dbraw/zinc/63/66/83/388636683.db2.gz ZJKAFZUQXFLUQI-WDEREUQCSA-N 2 0 232.318 2.106 20 0 BEADRP CC(C)(C)CC[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000530242830 388637961 /nfs/dbraw/zinc/63/79/61/388637961.db2.gz DNZRWXXRWGTSSL-NSHDSACASA-N 2 0 210.365 2.297 20 0 BEADRP Cc1ncccc1C[NH2+][C@@H](C)C[C@@H]1CCC[NH2+]1 ZINC000530243342 388639071 /nfs/dbraw/zinc/63/90/71/388639071.db2.gz HPBUZPFAJKISHS-FZMZJTMJSA-N 2 0 233.359 2.010 20 0 BEADRP C[C@H](CC1CC1)[NH2+][C@@H]1CCCC[C@H]1C[NH3+] ZINC000251176502 388642184 /nfs/dbraw/zinc/64/21/84/388642184.db2.gz GFZOIPZEYWVBPU-KGYLQXTDSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]C[C@@H]1CC=CCC1 ZINC000222825776 388645531 /nfs/dbraw/zinc/64/55/31/388645531.db2.gz LCPZSQVASYECBE-MCIONIFRSA-N 2 0 222.376 2.273 20 0 BEADRP C[C@H](C[NH2+]C(C1CC1)C1CC1)C[NH+]1CCCC1 ZINC000062077367 388649044 /nfs/dbraw/zinc/64/90/44/388649044.db2.gz IXYSBJAGTQSKKT-GFCCVEGCSA-N 2 0 236.403 2.497 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]C[C@H]2CCCS2)[C@H](C)C1 ZINC000246838224 388653041 /nfs/dbraw/zinc/65/30/41/388653041.db2.gz BLRTYROITLZHRK-UPJWGTAASA-N 2 0 242.432 2.202 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)C2(C)CC2)C1 ZINC000246886086 388654377 /nfs/dbraw/zinc/65/43/77/388654377.db2.gz FDIJKVHFAQEVSH-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H]2CCCSC2)[C@@H](C)C1 ZINC000224430835 388663992 /nfs/dbraw/zinc/66/39/92/388663992.db2.gz WNFLRZDMGZDMGC-XQQFMLRXSA-N 2 0 242.432 2.202 20 0 BEADRP CC(C)[C@H](C)[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000251379479 388747157 /nfs/dbraw/zinc/74/71/57/388747157.db2.gz YZWZUEDYMBGUHJ-XQQFMLRXSA-N 2 0 210.365 2.247 20 0 BEADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+][C@H]1CC12CC2 ZINC000424373916 388696366 /nfs/dbraw/zinc/69/63/66/388696366.db2.gz KFICGXOWJWLBKU-AGIUHOORSA-N 2 0 222.376 2.439 20 0 BEADRP [NH3+]CCCC[NH2+]Cc1cccc(Cl)c1F ZINC000229237149 388783444 /nfs/dbraw/zinc/78/34/44/388783444.db2.gz OKTKOFRYYAGBJI-UHFFFAOYSA-N 2 0 230.714 2.308 20 0 BEADRP COC[C@@H](C)C[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000129606836 388858029 /nfs/dbraw/zinc/85/80/29/388858029.db2.gz XZMMGQDKWYWGIC-LBPRGKRZSA-N 2 0 242.407 2.121 20 0 BEADRP C(CSCC1CC[NH2+]CC1)C[NH+]1CCCC1 ZINC000564925507 388898042 /nfs/dbraw/zinc/89/80/42/388898042.db2.gz CORUCHCYLOJZKG-UHFFFAOYSA-N 2 0 242.432 2.205 20 0 BEADRP C[NH2+]CCC[N@@H+]1CC[C@H](C)[C@@H]2CCCC[C@H]21 ZINC000564989823 388906722 /nfs/dbraw/zinc/90/67/22/388906722.db2.gz IPAUNGXKZNNPLS-MELADBBJSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1)[C@@H]1CCOC1 ZINC000565421921 388943071 /nfs/dbraw/zinc/94/30/71/388943071.db2.gz IPXYFINXZQLMJJ-HUUCEWRRSA-N 2 0 248.370 2.050 20 0 BEADRP CC(C)[NH2+]CCC[NH2+][C@@H]1CCO[C@@H](C(C)C)C1 ZINC000565592462 388955340 /nfs/dbraw/zinc/95/53/40/388955340.db2.gz DPELNINJJVQXCJ-ZIAGYGMSSA-N 2 0 242.407 2.168 20 0 BEADRP COc1ccc(C[NH2+][C@H](C)C[C@@H](C)[NH3+])c(C)c1 ZINC000565593365 388955899 /nfs/dbraw/zinc/95/58/99/388955899.db2.gz SRNHCQXACXKSRR-VXGBXAGGSA-N 2 0 236.359 2.219 20 0 BEADRP CC(C)[NH2+]CCC[NH2+][C@@H]1CC[C@@H]1C1CC1 ZINC000566088401 388986788 /nfs/dbraw/zinc/98/67/88/388986788.db2.gz LNHOBSJHJZSYOP-CHWSQXEVSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)[NH2+]CCC[NH2+][C@@H]1CC[C@H]1C1CC1 ZINC000566088403 388986830 /nfs/dbraw/zinc/98/68/30/388986830.db2.gz LNHOBSJHJZSYOP-QWHCGFSZSA-N 2 0 210.365 2.153 20 0 BEADRP Cc1ccc(F)cc1C[NH2+]CC1=CC[N@H+](C)CC1 ZINC000272236332 389030081 /nfs/dbraw/zinc/03/00/81/389030081.db2.gz GIPMUALIUFTWBN-UHFFFAOYSA-N 2 0 248.345 2.486 20 0 BEADRP C(C[N@@H+]1CC[C@@H]2C[NH2+]C[C@@H]2C1)C1CCCCC1 ZINC000261542161 533365302 /nfs/dbraw/zinc/36/53/02/533365302.db2.gz BWNRPYWBTSMEOR-HUUCEWRRSA-N 2 0 236.403 2.498 20 0 BEADRP C([NH2+]C[C@H]1CCC[NH2+]C1)C1CCCCC1 ZINC000087646352 533368273 /nfs/dbraw/zinc/36/82/73/533368273.db2.gz IDGRFGUOOBFNNR-ZDUSSCGKSA-N 2 0 210.365 2.156 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C2CC[NH+](CC3CC3)CC2)[C@H]1C ZINC000494889567 533642796 /nfs/dbraw/zinc/64/27/96/533642796.db2.gz BUZXYLHWXNHPFE-TYNCELHUSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CC2CC[NH+](C3CC3)CC2)[C@H]1C ZINC000494984521 533644563 /nfs/dbraw/zinc/64/45/63/533644563.db2.gz GBNWVUQDXINGJN-TYNCELHUSA-N 2 0 236.403 2.495 20 0 BEADRP Cc1cc(N2CCC[C@@H]3C[N@H+](C)CC[C@H]32)cc[nH+]1 ZINC000277063142 132207372 /nfs/dbraw/zinc/20/73/72/132207372.db2.gz RMBXCFNPINKRPV-UKRRQHHQSA-N 2 0 245.370 2.311 20 0 BEADRP Cc1cc(N2CCC[C@@H]3C[N@H+](C)CC[C@@H]32)cc[nH+]1 ZINC000277063137 132207431 /nfs/dbraw/zinc/20/74/31/132207431.db2.gz RMBXCFNPINKRPV-HIFRSBDPSA-N 2 0 245.370 2.311 20 0 BEADRP [NH3+]C[C@H]1CCCN(c2cc[nH+]c3ccccc32)C1 ZINC000044532196 132225285 /nfs/dbraw/zinc/22/52/85/132225285.db2.gz PACKYJFLTFIOBS-GFCCVEGCSA-N 2 0 241.338 2.410 20 0 BEADRP C[C@@H]1C[NH2+]CCN1c1cc[nH+]c2ccccc21 ZINC000054374746 132233801 /nfs/dbraw/zinc/23/38/01/132233801.db2.gz XJWZYUDWNXKVIF-LLVKDONJSA-N 2 0 227.311 2.033 20 0 BEADRP C[C@H]1CN(c2cc[nH+]c3ccccc32)CC[C@@H]1[NH3+] ZINC000094342415 132239245 /nfs/dbraw/zinc/23/92/45/132239245.db2.gz WQSGBYFGDNVMSD-AAEUAGOBSA-N 2 0 241.338 2.408 20 0 BEADRP CCCC[NH+]1CCN(c2cc[nH+]cc2OC)CC1 ZINC000361519469 132280272 /nfs/dbraw/zinc/28/02/72/132280272.db2.gz OKBCJKNVDAUUJQ-UHFFFAOYSA-N 2 0 249.358 2.012 20 0 BEADRP C[C@H]1CC[C@@H]1[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000334317525 132296177 /nfs/dbraw/zinc/29/61/77/132296177.db2.gz VAOUZCKDNVAKTM-WFASDCNBSA-N 2 0 245.370 2.439 20 0 BEADRP [NH3+]C1CCN(c2cc[nH+]c3ccccc32)CC1 ZINC000041719758 132297240 /nfs/dbraw/zinc/29/72/40/132297240.db2.gz YNLKSAAVICVSJS-UHFFFAOYSA-N 2 0 227.311 2.162 20 0 BEADRP C[C@@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)C1CC1 ZINC000035732802 132339050 /nfs/dbraw/zinc/33/90/50/132339050.db2.gz MFSAIKYPUSSUDQ-GFCCVEGCSA-N 2 0 245.370 2.439 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCC[C@H]1C)C[NH+]1CCCC1 ZINC000083402359 133525039 /nfs/dbraw/zinc/52/50/39/133525039.db2.gz WMRXFPXICXMAJT-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP CCC[C@@H](CC)[NH2+][C@@H](C)CC[NH+](C)C ZINC000224613865 133531549 /nfs/dbraw/zinc/53/15/49/133531549.db2.gz WDWHDYDSAFOFPF-NWDGAFQWSA-N 2 0 200.370 2.495 20 0 BEADRP CC[NH+](CC)CCOCC[NH2+][C@H](C)C(C)(C)C ZINC000349694237 133903003 /nfs/dbraw/zinc/90/30/03/133903003.db2.gz PAVURAXNBRYVMQ-CYBMUJFWSA-N 2 0 244.423 2.369 20 0 BEADRP C([C@@H]1CCC[NH2+]C1)[N@@H+]1CCC[C@H]1C1CCC1 ZINC000336197082 134127085 /nfs/dbraw/zinc/12/70/85/134127085.db2.gz KGEHHXQTCKIYLX-OCCSQVGLSA-N 2 0 222.376 2.251 20 0 BEADRP C([NH2+]C1CCCCCCC1)[C@@H]1CCC[NH2+]1 ZINC000216542554 134149937 /nfs/dbraw/zinc/14/99/37/134149937.db2.gz JLJWYIRLUWEXMV-ZDUSSCGKSA-N 2 0 210.365 2.441 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[N@@H+]1CCC[C@@H](C[NH3+])C1 ZINC000347032433 134196276 /nfs/dbraw/zinc/19/62/76/134196276.db2.gz ABIDRIJWUOFBGV-HZSPNIEDSA-N 2 0 224.392 2.483 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCC[NH2+]CC1)c1ccccc1 ZINC000168693632 134242429 /nfs/dbraw/zinc/24/24/29/134242429.db2.gz KFZULCLPVQNGFO-OCCSQVGLSA-N 2 0 218.344 2.479 20 0 BEADRP CC(C)C[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C)C1 ZINC000178627734 134312057 /nfs/dbraw/zinc/31/20/57/134312057.db2.gz TYFVEOHVWGMFQO-OLZOCXBDSA-N 2 0 210.365 2.059 20 0 BEADRP CC(C)[C@H]1C[N@H+](CC2CC[NH2+]CC2)CCS1 ZINC000178976786 134314004 /nfs/dbraw/zinc/31/40/04/134314004.db2.gz SBEWUECYWXQECV-CYBMUJFWSA-N 2 0 242.432 2.059 20 0 BEADRP C[C@H]1CCC[C@H](C)[N@H+](CC2CC[NH2+]CC2)C1 ZINC000178974083 134314098 /nfs/dbraw/zinc/31/40/98/134314098.db2.gz MGFOVQNMAVNECR-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@]1(C)CCC[N@H+](CC2CC[NH2+]CC2)C1 ZINC000178973847 134314271 /nfs/dbraw/zinc/31/42/71/134314271.db2.gz MWFYTGBUHMNYEE-CQSZACIVSA-N 2 0 224.392 2.498 20 0 BEADRP C[N@H+](CC[C@@H]1CCC[NH+]1C)C1CCCC1 ZINC000179239192 134318519 /nfs/dbraw/zinc/31/85/19/134318519.db2.gz IXKUXYOQJOSOBO-ZDUSSCGKSA-N 2 0 210.365 2.345 20 0 BEADRP C(C1CCCCC1)[N@@H+]1C[C@H]2CCC[NH2+][C@@H]2C1 ZINC000221366492 134321295 /nfs/dbraw/zinc/32/12/95/134321295.db2.gz FSANDADYTGBVNK-ZIAGYGMSSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@@H]([NH2+]CCC[NH+](C)C)C1 ZINC000221649268 134325953 /nfs/dbraw/zinc/32/59/53/134325953.db2.gz RGFBZJNRYDIFLW-AGIUHOORSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H]1CC[C@@H](C)[C@@H]([NH2+]CCn2ccnc2)C1 ZINC000222024512 134329094 /nfs/dbraw/zinc/32/90/94/134329094.db2.gz UFBADWHWHMCKFV-UPJWGTAASA-N 2 0 221.348 2.297 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CC2(C)C)CC[N@@H+]1C ZINC000222043226 134329318 /nfs/dbraw/zinc/32/93/18/134329318.db2.gz YHHRVYUEZBNPDP-GRYCIOLGSA-N 2 0 210.365 2.105 20 0 BEADRP CC(C)CSCC[NH2+][C@@H]1CC[N@H+](C)C[C@@H]1C ZINC000222440146 134332072 /nfs/dbraw/zinc/33/20/72/134332072.db2.gz XIZBWKOUULTOOD-QWHCGFSZSA-N 2 0 244.448 2.305 20 0 BEADRP CC(C)C[C@H](C[NH2+]C[C@H]1CCSC1)N(C)C ZINC000224307781 134346001 /nfs/dbraw/zinc/34/60/01/134346001.db2.gz WSKJQQXTTRIFIC-CHWSQXEVSA-N 2 0 244.448 2.305 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]C[C@@]1(C)CCCS1 ZINC000224567178 134348295 /nfs/dbraw/zinc/34/82/95/134348295.db2.gz ZQMWPIMOALWDCD-FRRDWIJNSA-N 2 0 242.432 2.202 20 0 BEADRP CCC[C@@H](CC)[NH2+]CCCC[NH+](C)C ZINC000224613736 134349355 /nfs/dbraw/zinc/34/93/55/134349355.db2.gz ZZXLDWJWXRCONW-GFCCVEGCSA-N 2 0 200.370 2.497 20 0 BEADRP C(C[NH2+]C1CC[NH2+]CC1)CC1CCCC1 ZINC000225094688 134352960 /nfs/dbraw/zinc/35/29/60/134352960.db2.gz SHFWIUJHWQZHES-UHFFFAOYSA-N 2 0 210.365 2.298 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+]CCCC1CCCC1 ZINC000225056956 134352971 /nfs/dbraw/zinc/35/29/71/134352971.db2.gz ONYUODYINKCPNC-AWEZNQCLSA-N 2 0 242.407 2.300 20 0 BEADRP COCC[C@H](C)[NH2+]CC1(C[NH+](C)C)CCCC1 ZINC000184474668 134364451 /nfs/dbraw/zinc/36/44/51/134364451.db2.gz SRZBRSZRKJQOEW-ZDUSSCGKSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@@H]1CCC[C@H]1[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000227327057 134378005 /nfs/dbraw/zinc/37/80/05/134378005.db2.gz AGHNBXYNPYNMAK-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@H](COC)[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000227541078 134382893 /nfs/dbraw/zinc/38/28/93/134382893.db2.gz IWTSGAQXHPDFOA-LERXQTSPSA-N 2 0 234.343 2.146 20 0 BEADRP Cc1ccccc1[C@@H](C)[N@H+](C)CCC[NH3+] ZINC000227743732 134392048 /nfs/dbraw/zinc/39/20/48/134392048.db2.gz NZNULDLGGCYEIW-GFCCVEGCSA-N 2 0 206.333 2.337 20 0 BEADRP CC[C@H](C)C[NH+]1CCC([C@H]2CCC[NH2+]2)CC1 ZINC000063197480 134538427 /nfs/dbraw/zinc/53/84/27/134538427.db2.gz FCZPLLBWCNOFFE-GXTWGEPZSA-N 2 0 224.392 2.497 20 0 BEADRP CCCC[NH+]1CCC([C@@H]2CCC[NH2+]2)CC1 ZINC000063197882 134538581 /nfs/dbraw/zinc/53/85/81/134538581.db2.gz SMQHGKNNUYBRSV-ZDUSSCGKSA-N 2 0 210.365 2.251 20 0 BEADRP CCC(CC)C[NH2+]CC1(COC)CC[NH2+]CC1 ZINC000232883927 134557119 /nfs/dbraw/zinc/55/71/19/134557119.db2.gz ZXWMZDIODVEPOL-UHFFFAOYSA-N 2 0 242.407 2.028 20 0 BEADRP CC[C@@H]1CCC[C@H]([NH2+][C@@H](CCC[NH3+])COC)C1 ZINC000233909915 134570930 /nfs/dbraw/zinc/57/09/30/134570930.db2.gz ZOFMYXVRKYZOLE-RDBSUJKOSA-N 2 0 242.407 2.299 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+]CC1(C)CCCCC1 ZINC000234779488 134583508 /nfs/dbraw/zinc/58/35/08/134583508.db2.gz HORUOLUUVNSFOS-ZDUSSCGKSA-N 2 0 242.407 2.300 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H]1CCO[C@H]1C ZINC000245974411 134874248 /nfs/dbraw/zinc/87/42/48/134874248.db2.gz WPNXLYXNQGIWOR-IHRRRGAJSA-N 2 0 242.407 2.264 20 0 BEADRP CC[NH+]1CCC(Nc2cc[nH+]cc2C)CC1 ZINC000070047147 134907489 /nfs/dbraw/zinc/90/74/89/134907489.db2.gz QZORVLQCRILWGZ-UHFFFAOYSA-N 2 0 219.332 2.286 20 0 BEADRP CC(C)[C@@H]1C[C@@H]([NH2+]CCCC[NH+](C)C)CCO1 ZINC000070360766 134917127 /nfs/dbraw/zinc/91/71/27/134917127.db2.gz SBPGHNHEHWLTPF-KBPBESRZSA-N 2 0 242.407 2.121 20 0 BEADRP CC[C@@H]1CC[C@H]([NH2+]CCCC[NH+](C)C)C1 ZINC000070643867 134922151 /nfs/dbraw/zinc/92/21/51/134922151.db2.gz ACOZKZUVNMIGQE-OLZOCXBDSA-N 2 0 212.381 2.497 20 0 BEADRP CCCC[NH2+][C@@H]1CCC[C@H]1[C@H]1CCC[NH2+]1 ZINC000249849647 135046314 /nfs/dbraw/zinc/04/63/14/135046314.db2.gz INRLUCPVNUWPIV-JHJVBQTASA-N 2 0 210.365 2.297 20 0 BEADRP CC(C)CCOCC[N@@H+]1CCC[C@H]([C@H](C)[NH3+])C1 ZINC000250589276 135056155 /nfs/dbraw/zinc/05/61/55/135056155.db2.gz JTGRIYCOJRXFSV-KBPBESRZSA-N 2 0 242.407 2.108 20 0 BEADRP CSCCC[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000250961998 135061105 /nfs/dbraw/zinc/06/11/05/135061105.db2.gz WXTWDRARRHDWTH-YNEHKIRRSA-N 2 0 242.432 2.250 20 0 BEADRP CCC[C@H](C)[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000251327674 135068051 /nfs/dbraw/zinc/06/80/51/135068051.db2.gz MUAWYPUPNOEPCQ-AVGNSLFASA-N 2 0 210.365 2.391 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)C1CC1 ZINC000251687351 135074778 /nfs/dbraw/zinc/07/47/78/135074778.db2.gz WFDMGXKNUNUYAG-DRZSPHRISA-N 2 0 208.349 2.001 20 0 BEADRP C[C@@H]1C[N@H+](CC2CCCCC2)CC[C@H]1[NH3+] ZINC000251706340 135074964 /nfs/dbraw/zinc/07/49/64/135074964.db2.gz JDTXEYQOJHLZCZ-DGCLKSJQSA-N 2 0 210.365 2.236 20 0 BEADRP CC[C@@H](C)C[N@H+](C)CC[C@H]1CCC[NH2+]C1 ZINC000251774397 135076271 /nfs/dbraw/zinc/07/62/71/135076271.db2.gz IPCIKTZFFFEEJE-CHWSQXEVSA-N 2 0 212.381 2.354 20 0 BEADRP CC[C@H](C)C[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000252028704 135082338 /nfs/dbraw/zinc/08/23/38/135082338.db2.gz YVGHZDKCZGZPLW-AVGNSLFASA-N 2 0 210.365 2.249 20 0 BEADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+][C@H]1C[C@H]1C ZINC000252162518 135085469 /nfs/dbraw/zinc/08/54/69/135085469.db2.gz PZSZSXXNEMHNQU-NDBYEHHHSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+][C@@H]1C[C@H]1C ZINC000252162516 135086171 /nfs/dbraw/zinc/08/61/71/135086171.db2.gz PZSZSXXNEMHNQU-FVCCEPFGSA-N 2 0 210.365 2.295 20 0 BEADRP CC(C)C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000086494167 135086192 /nfs/dbraw/zinc/08/61/92/135086192.db2.gz FCUDGHZDYQXJOD-FRRDWIJNSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1)C1CC1 ZINC000086494347 135086258 /nfs/dbraw/zinc/08/62/58/135086258.db2.gz KKGABOSSRUNFIV-AHLTXXRQSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)CS1 ZINC000252203614 135086322 /nfs/dbraw/zinc/08/63/22/135086322.db2.gz WTPMYMMZSMBWGU-NDBYEHHHSA-N 2 0 240.416 2.097 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000252207441 135086951 /nfs/dbraw/zinc/08/69/51/135086951.db2.gz VKJTUBXRAAFNRQ-BZPMIXESSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+]CC1CC[NH2+]CC1 ZINC000086700215 135095651 /nfs/dbraw/zinc/09/56/51/135095651.db2.gz RQTPKIDVJMASPH-YPMHNXCESA-N 2 0 210.365 2.154 20 0 BEADRP [NH3+]C[C@H]1CCC[C@@H]1Nc1ccncc1Cl ZINC000086840116 135098396 /nfs/dbraw/zinc/09/83/96/135098396.db2.gz UDZUFQMNSZBVSU-SCZZXKLOSA-N 2 0 225.723 2.274 20 0 BEADRP C[C@@H](c1ccccn1)[N@@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000257669489 135101047 /nfs/dbraw/zinc/10/10/47/135101047.db2.gz DLRCSKRMKWYPMG-ZDUSSCGKSA-N 2 0 245.370 2.218 20 0 BEADRP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]CC1(C2CC2)CC1 ZINC000252733537 135104482 /nfs/dbraw/zinc/10/44/82/135104482.db2.gz ZWZJXOPAANFGGM-WCQYABFASA-N 2 0 222.376 2.106 20 0 BEADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+][C@@H](C)C[C@H](C)O ZINC000252751541 135107384 /nfs/dbraw/zinc/10/73/84/135107384.db2.gz GRXBOFOXLFVHJM-CRWXNKLISA-N 2 0 242.407 2.046 20 0 BEADRP C[C@@H]1C[C@@H]1[NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000252787831 135109920 /nfs/dbraw/zinc/10/99/20/135109920.db2.gz QRRFUAMNLPDOMP-KMLBCRHOSA-N 2 0 202.301 2.129 20 0 BEADRP C[C@@H]1CCC[C@@H](C[N@H+](C)C2CC[NH2+]CC2)C1 ZINC000261592011 135110322 /nfs/dbraw/zinc/11/03/22/135110322.db2.gz VQTSRFLOSWNUPG-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1CC[N@H+](CCC2CCCC2)C[C@@H]1C[NH3+] ZINC000261599725 135111389 /nfs/dbraw/zinc/11/13/89/135111389.db2.gz ZZCHRKGNHGFAAW-JSGCOSHPSA-N 2 0 224.392 2.483 20 0 BEADRP CC(C)CC[N@@H+]1C[C@@H]2CCC[C@H]([NH3+])[C@H]2C1 ZINC000252861961 135113642 /nfs/dbraw/zinc/11/36/42/135113642.db2.gz NUCLYPABRYEUJQ-AVGNSLFASA-N 2 0 210.365 2.092 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+]CCC[NH3+])cc1F ZINC000087284268 135116655 /nfs/dbraw/zinc/11/66/55/135116655.db2.gz DGXZCCUTAXJLNH-SNVBAGLBSA-N 2 0 210.296 2.134 20 0 BEADRP CC[C@H](CCO)[NH2+][C@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000253033034 135119253 /nfs/dbraw/zinc/11/92/53/135119253.db2.gz UFPOFZRAOFJBBF-MGPQQGTHSA-N 2 0 242.407 2.048 20 0 BEADRP CC[C@H](CCO)[NH2+][C@@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000253033033 135119290 /nfs/dbraw/zinc/11/92/90/135119290.db2.gz UFPOFZRAOFJBBF-BFHYXJOUSA-N 2 0 242.407 2.048 20 0 BEADRP Cc1ccsc1C[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000087308684 135121975 /nfs/dbraw/zinc/12/19/75/135121975.db2.gz DCMLLIWHCXKKSE-GHMZBOCLSA-N 2 0 224.373 2.416 20 0 BEADRP C[C@@H]1CC[N@H+](CC2CCCC2)C[C@H]1C[NH3+] ZINC000253207830 135124789 /nfs/dbraw/zinc/12/47/89/135124789.db2.gz HTQOJEGDNHYITG-DGCLKSJQSA-N 2 0 210.365 2.093 20 0 BEADRP C[C@H]1CC[N@H+](CCC(C)(C)C)C[C@H]1C[NH3+] ZINC000253246653 135125582 /nfs/dbraw/zinc/12/55/82/135125582.db2.gz SBIHQKKKMLLHFJ-NWDGAFQWSA-N 2 0 212.381 2.339 20 0 BEADRP C[C@H](c1cccnc1)[N@@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000257651014 135138560 /nfs/dbraw/zinc/13/85/60/135138560.db2.gz ADGBKMSAKZQNBP-CYBMUJFWSA-N 2 0 245.370 2.218 20 0 BEADRP Cc1ccc(CC[N@@H+]2CC[C@]3(CC[NH2+]C3)C2)cc1 ZINC000257721868 135140837 /nfs/dbraw/zinc/14/08/37/135140837.db2.gz VSKIHEXWDNBXNH-INIZCTEOSA-N 2 0 244.382 2.223 20 0 BEADRP C[NH2+]CCCN(C)[C@@H](C)c1cccc(F)c1 ZINC000087472248 135143074 /nfs/dbraw/zinc/14/30/74/135143074.db2.gz QRTJQYLJZCVUDH-NSHDSACASA-N 2 0 224.323 2.428 20 0 BEADRP C[C@H](c1ccccc1)N1C[C@@H](C)[C@H]([NH3+])C1 ZINC000261529505 135155509 /nfs/dbraw/zinc/15/55/09/135155509.db2.gz AWGQZEVMUZELRF-NQBHXWOUSA-N 2 0 204.317 2.027 20 0 BEADRP C[C@@H]([NH3+])C1CC[NH+](CC2(C)CCC2)CC1 ZINC000261529867 135156733 /nfs/dbraw/zinc/15/67/33/135156733.db2.gz BPUVPPSRMCTFRD-LLVKDONJSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@@H](C1CC1)[N@H+](C)C[C@H]1CC[NH2+][C@H](C)C1 ZINC000261530769 135157988 /nfs/dbraw/zinc/15/79/88/135157988.db2.gz CZKPCMOMCASSEL-WOPDTQHZSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]C[C@H]2CCC[NH2+]2)[C@H]1C ZINC000261530824 135158895 /nfs/dbraw/zinc/15/88/95/135158895.db2.gz DFSJYTCDCBXGBU-XQHKEYJVSA-N 2 0 210.365 2.153 20 0 BEADRP Cc1[nH+]ccc(NC[C@H]([NH3+])C2CC2)c1Cl ZINC000261531411 135159563 /nfs/dbraw/zinc/15/95/63/135159563.db2.gz GJQMHAIWCMCUQH-VIFPVBQESA-N 2 0 225.723 2.193 20 0 BEADRP C[C@@H]([NH3+])[C@H](C)[NH2+]C[C@@H](C)c1ccccc1 ZINC000261531656 135160588 /nfs/dbraw/zinc/16/05/88/135160588.db2.gz HKLLTGQAVHNDHM-UTUOFQBUSA-N 2 0 206.333 2.115 20 0 BEADRP CC1CCC([NH2+]C[C@@H]2CCC[NH2+]C2)CC1 ZINC000087646010 135160707 /nfs/dbraw/zinc/16/07/07/135160707.db2.gz RTVILVUEDVOYSA-OTTFEQOBSA-N 2 0 210.365 2.154 20 0 BEADRP C[NH2+]C[C@H]1CCC[N@H+](CC2(C)CCC2)C1 ZINC000261531956 135161554 /nfs/dbraw/zinc/16/15/54/135161554.db2.gz IMSJZIIUFRFYEE-GFCCVEGCSA-N 2 0 210.365 2.108 20 0 BEADRP Cc1cc(CN(C)[C@H](C)C[NH3+])ccc1Cl ZINC000261532348 135162557 /nfs/dbraw/zinc/16/25/57/135162557.db2.gz AHDGKWWPWPJJQT-SNVBAGLBSA-N 2 0 226.751 2.427 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000261532600 135163355 /nfs/dbraw/zinc/16/33/55/135163355.db2.gz JXNUEOUCORBLLO-WCQYABFASA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+][C@H]2CCC[NH2+]CC2)C1 ZINC000261533589 135165139 /nfs/dbraw/zinc/16/51/39/135165139.db2.gz KZYQOWMVQMICMK-AGIUHOORSA-N 2 0 210.365 2.154 20 0 BEADRP CC(C)[C@@H]1CCC[N@@H+]1C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000261533670 135165574 /nfs/dbraw/zinc/16/55/74/135165574.db2.gz JSPHLAMKDGFSQD-MCIONIFRSA-N 2 0 224.392 2.495 20 0 BEADRP CS[C@@H]1CCC[C@H]([NH2+][C@H]2CCC[C@@H]2C[NH3+])C1 ZINC000261534121 135165942 /nfs/dbraw/zinc/16/59/42/135165942.db2.gz NIVIQGCIOSYNSZ-XQHKEYJVSA-N 2 0 242.432 2.378 20 0 BEADRP Cc1cccc(CN2C[C@H](C)[C@H]([NH3+])C2)c1C ZINC000261534302 135166814 /nfs/dbraw/zinc/16/68/14/135166814.db2.gz PQMXPQAQYXAQCW-SMDDNHRTSA-N 2 0 218.344 2.082 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2CCS[C@H](C)[C@@H]2C)CC[NH2+]1 ZINC000261534774 135167610 /nfs/dbraw/zinc/16/76/10/135167610.db2.gz UCIVMCQTDWUCME-YVECIDJPSA-N 2 0 242.432 2.200 20 0 BEADRP CC1CCC([NH2+][C@@H]2CC[NH2+]C[C@H]2C)CC1 ZINC000261534829 135167846 /nfs/dbraw/zinc/16/78/46/135167846.db2.gz NCCFOCSYULLSJT-POOIEITISA-N 2 0 210.365 2.153 20 0 BEADRP C[N@H+](CC1CC[NH2+]CC1)[C@@H]1CCC(C)(C)C1 ZINC000087772954 135168239 /nfs/dbraw/zinc/16/82/39/135168239.db2.gz LMAHMNQYFDVREP-CYBMUJFWSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[NH2+]C[C@@H]1C)c1cccs1 ZINC000261535068 135168693 /nfs/dbraw/zinc/16/86/93/135168693.db2.gz NRIIARWNIVDMOJ-GARJFASQSA-N 2 0 224.373 2.397 20 0 BEADRP CC(C)[C@@H]1CC[N@H+](C[C@H]2CC[NH2+][C@H](C)C2)C1 ZINC000261535240 135169582 /nfs/dbraw/zinc/16/95/82/135169582.db2.gz XECAGSGUGWSYDN-HZSPNIEDSA-N 2 0 224.392 2.352 20 0 BEADRP [NH3+]C[C@@H]1CCC[N@H+](CCC2CCCC2)C1 ZINC000261535802 135170487 /nfs/dbraw/zinc/17/04/87/135170487.db2.gz PGAKKJXSOOJLNE-ZDUSSCGKSA-N 2 0 210.365 2.237 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@H]1CCC(C)(C)C1 ZINC000261536363 135171635 /nfs/dbraw/zinc/17/16/35/135171635.db2.gz RJROZGJAIQMICC-WOPDTQHZSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@]1(C[NH2+]C2CCC([NH3+])CC2)CCCS1 ZINC000087793166 135171872 /nfs/dbraw/zinc/17/18/72/135171872.db2.gz SCRSPABUTSCFJA-MCIGGMRASA-N 2 0 228.405 2.132 20 0 BEADRP C[C@@H]([NH2+]C1CCCCCC1)[C@@H]1CC[NH2+]C1 ZINC000261536672 135172228 /nfs/dbraw/zinc/17/22/28/135172228.db2.gz SKYWOOLCFUAMMB-VXGBXAGGSA-N 2 0 210.365 2.297 20 0 BEADRP CC(C)(C)CC[N@@H+]1CC[C@H]2[NH2+]CC[C@H]2C1 ZINC000261537103 135173374 /nfs/dbraw/zinc/17/33/74/135173374.db2.gz UWSOULUHYKMPJQ-NWDGAFQWSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1CC[N@H+](CC(C)(C)[NH3+])CC12CCC2 ZINC000261541123 135180883 /nfs/dbraw/zinc/18/08/83/135180883.db2.gz FOMPMLJEZINOSA-LLVKDONJSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@H]1CC[N@H+](CC(C)(C)[NH3+])CC12CCC2 ZINC000261541124 135180894 /nfs/dbraw/zinc/18/08/94/135180894.db2.gz FOMPMLJEZINOSA-NSHDSACASA-N 2 0 210.365 2.236 20 0 BEADRP C[C@H]1[C@H]([NH3+])CCN1Cc1ccc(C2CC2)cc1 ZINC000261544054 135185509 /nfs/dbraw/zinc/18/55/09/135185509.db2.gz DNVRPUTVNLAKCK-XHDPSFHLSA-N 2 0 230.355 2.486 20 0 BEADRP CC1CCC(C[N@@H+]2C[C@@H]3CC[C@H]([NH3+])[C@@H]3C2)CC1 ZINC000261550950 135189908 /nfs/dbraw/zinc/18/99/08/135189908.db2.gz LQDLKCGVTBUCIF-PCGVCOGMSA-N 2 0 236.403 2.482 20 0 BEADRP C[C@H]1CCCC[N@H+](C[C@]2(C)CC[NH2+]C2)C1 ZINC000261551333 135189974 /nfs/dbraw/zinc/18/99/74/135189974.db2.gz QJGAGMVXVZPUCP-QWHCGFSZSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@@H]1CCC[C@H](C[N@@H+]2CC[C@H]3C[NH2+]C[C@H]3C2)C1 ZINC000261552269 135191578 /nfs/dbraw/zinc/19/15/78/135191578.db2.gz MUTRJUVAGIAKIB-QPSCCSFWSA-N 2 0 236.403 2.354 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@@H]1C[NH3+])c1ccco1 ZINC000084218871 135192594 /nfs/dbraw/zinc/19/25/94/135192594.db2.gz NTUXZPQNSBPZOO-AXFHLTTASA-N 2 0 208.305 2.058 20 0 BEADRP CCC(C)(C)CC[N@@H+]1CCC[C@H](C[NH3+])C1 ZINC000261555408 135195439 /nfs/dbraw/zinc/19/54/39/135195439.db2.gz UXAMVHGLYGSGNO-GFCCVEGCSA-N 2 0 212.381 2.483 20 0 BEADRP C[C@@H]1[C@H]([NH3+])CCN1c1cc[nH+]c2ccccc21 ZINC000261556772 135196829 /nfs/dbraw/zinc/19/68/29/135196829.db2.gz RAJLZYZSAUFQMG-ZYHUDNBSSA-N 2 0 227.311 2.161 20 0 BEADRP C[C@H]1[C@@H]([NH3+])CCN1Cc1cccc(C2CC2)c1 ZINC000261558866 135199470 /nfs/dbraw/zinc/19/94/70/135199470.db2.gz SUIRFAXHGTYVFR-NHYWBVRUSA-N 2 0 230.355 2.486 20 0 BEADRP CCS[C@@H]1CC[C@H]([N@H+](C)CC(C)(C)[NH3+])C1 ZINC000261560083 135201325 /nfs/dbraw/zinc/20/13/25/135201325.db2.gz ZNJAYPDIJYZKSN-WDEREUQCSA-N 2 0 230.421 2.330 20 0 BEADRP Cc1[nH+]ccc(NC[C@@H]2CCC[NH2+]C2)c1Cl ZINC000261560631 135202117 /nfs/dbraw/zinc/20/21/17/135202117.db2.gz ADWPGBGTFIQEDW-SNVBAGLBSA-N 2 0 239.750 2.455 20 0 BEADRP Cc1ccccc1C[N@@H+]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000261561707 135202709 /nfs/dbraw/zinc/20/27/09/135202709.db2.gz VRTWUIFDHCVLAI-DZGCQCFKSA-N 2 0 230.355 2.036 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@H]3C[NH2+]C[C@H]3C2)cc1 ZINC000261562009 135203914 /nfs/dbraw/zinc/20/39/14/135203914.db2.gz VXJZSGZBIAIVKM-GJZGRUSLSA-N 2 0 230.355 2.036 20 0 BEADRP Cc1cc(N2CC[C@@H]([NH3+])[C@H]2C)c2ccccc2[nH+]1 ZINC000261562598 135204560 /nfs/dbraw/zinc/20/45/60/135204560.db2.gz GNFVTDZSDCNIIE-DGCLKSJQSA-N 2 0 241.338 2.469 20 0 BEADRP C[C@@H]1[C@@H]([NH3+])CCN1Cc1coc2ccccc12 ZINC000261563687 135205529 /nfs/dbraw/zinc/20/55/29/135205529.db2.gz XDIKNKOHFXWATR-MFKMUULPSA-N 2 0 230.311 2.354 20 0 BEADRP Cc1cc(C)cc(C[N@@H+]2CC[C@@H]3C[NH2+]C[C@@H]3C2)c1 ZINC000261564768 135207275 /nfs/dbraw/zinc/20/72/75/135207275.db2.gz HMOSLOKVLKLPNH-HZPDHXFCSA-N 2 0 244.382 2.345 20 0 BEADRP C[C@@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]CCC(C)(C)O ZINC000261565390 135207967 /nfs/dbraw/zinc/20/79/67/135207967.db2.gz YHTZCBYCWZMHEN-STQMWFEESA-N 2 0 242.407 2.048 20 0 BEADRP Cc1ccccc1C[C@H](C)[NH2+][C@H](C)[C@@H](C)[NH3+] ZINC000261568618 135209965 /nfs/dbraw/zinc/20/99/65/135209965.db2.gz FQOYLXKHECKHQT-YNEHKIRRSA-N 2 0 220.360 2.251 20 0 BEADRP Cc1ccc(C[N@@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@@H]3C2)cc1C ZINC000261569196 135211195 /nfs/dbraw/zinc/21/11/95/135211195.db2.gz JPTRGPMHCOVEIA-ARFHVFGLSA-N 2 0 244.382 2.473 20 0 BEADRP [NH3+]C[C@@H]1CC[N@H+](CC2CCCCCC2)C1 ZINC000084329936 135211569 /nfs/dbraw/zinc/21/15/69/135211569.db2.gz HOIPREYUBPDENA-ZDUSSCGKSA-N 2 0 210.365 2.237 20 0 BEADRP Cc1cccc(C[NH2+][C@H]2CC[NH2+]C[C@H]2C)c1 ZINC000261571597 135213688 /nfs/dbraw/zinc/21/36/88/135213688.db2.gz HOQAGQXZIZVGDP-OCCSQVGLSA-N 2 0 218.344 2.083 20 0 BEADRP CCOc1cccc(C[NH2+][C@H]2CC[NH2+]C[C@H]2C)c1 ZINC000261572563 135214923 /nfs/dbraw/zinc/21/49/23/135214923.db2.gz LSPMPVJPXHKCLD-DOMZBBRYSA-N 2 0 248.370 2.173 20 0 BEADRP C[C@H]1C[C@H]([NH2+][C@@H]2CC[NH2+]C[C@@H]2C)C[C@@H](C)C1 ZINC000261576031 135217355 /nfs/dbraw/zinc/21/73/55/135217355.db2.gz KBEUSITWVORGFM-MEBFFEOJSA-N 2 0 224.392 2.399 20 0 BEADRP C(C[NH+]1CCCCCCC1)[C@H]1CC[NH2+]C1 ZINC000084384616 135218073 /nfs/dbraw/zinc/21/80/73/135218073.db2.gz GNCRTPYALRVRCY-CYBMUJFWSA-N 2 0 210.365 2.252 20 0 BEADRP CCC1CC[NH+](CC[C@H]2CC[NH2+]C2)CC1 ZINC000084385104 135218137 /nfs/dbraw/zinc/21/81/37/135218137.db2.gz QFCGLCZNHXMXOL-CYBMUJFWSA-N 2 0 210.365 2.108 20 0 BEADRP C[N@H+](CC[C@H]1CC[NH2+]C1)CC1CCCCC1 ZINC000084385236 135218146 /nfs/dbraw/zinc/21/81/46/135218146.db2.gz JSDXHTFRLCXBKZ-CYBMUJFWSA-N 2 0 224.392 2.498 20 0 BEADRP Cc1cccc(C)c1C[N@@H+]1C[C@@H]2CC[C@H]([NH3+])[C@@H]2C1 ZINC000261578013 135218872 /nfs/dbraw/zinc/21/88/72/135218872.db2.gz ORUGOYHYMZZVAS-IMJJTQAJSA-N 2 0 244.382 2.473 20 0 BEADRP C[C@H]1C[NH2+]CC[C@H]1[NH2+]Cc1cccc(Cl)c1 ZINC000261578210 135219253 /nfs/dbraw/zinc/21/92/53/135219253.db2.gz LOOKKXWRUKCZRG-GXFFZTMASA-N 2 0 238.762 2.428 20 0 BEADRP CC1(C[N@@H+]2C[C@@H]3CCC[C@@H]([NH3+])[C@H]3C2)CCC1 ZINC000261580789 135221159 /nfs/dbraw/zinc/22/11/59/135221159.db2.gz NDJFEOZGWJGZGI-RWMBFGLXSA-N 2 0 222.376 2.236 20 0 BEADRP C[C@H](C[N@@H+]1CC[C@]2(CC[NH2+]C2)C1)c1ccccc1 ZINC000261581615 135222836 /nfs/dbraw/zinc/22/28/36/135222836.db2.gz QUQXQJTYSSOGPQ-ZBFHGGJFSA-N 2 0 244.382 2.476 20 0 BEADRP Cc1cccc(C)c1C[N@@H+]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000261583455 135224147 /nfs/dbraw/zinc/22/41/47/135224147.db2.gz RUAYTSLCBHWOSE-CABCVRRESA-N 2 0 244.382 2.345 20 0 BEADRP CCC(CC)C[N@@H+]1C[C@@H]2CCC[C@H]([NH3+])[C@@H]2C1 ZINC000164370009 135224715 /nfs/dbraw/zinc/22/47/15/135224715.db2.gz CXNWCHNUDGIZSF-MJBXVCDLSA-N 2 0 224.392 2.482 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+][C@@H]1CCc2ccccc2C1 ZINC000261584114 135224767 /nfs/dbraw/zinc/22/47/67/135224767.db2.gz SCKFFWXHOUAKSU-DAXOMENPSA-N 2 0 244.382 2.132 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@@H]1CCc2ccccc2C1 ZINC000261584119 135225202 /nfs/dbraw/zinc/22/52/02/135225202.db2.gz SCKFFWXHOUAKSU-WQVCFCJDSA-N 2 0 244.382 2.132 20 0 BEADRP COc1cccc([C@H](C)[NH2+][C@@H]2CC[NH2+]C[C@H]2C)c1 ZINC000261585533 135226901 /nfs/dbraw/zinc/22/69/01/135226901.db2.gz SZFKQRKXAGJVRU-TYNCELHUSA-N 2 0 248.370 2.344 20 0 BEADRP Cc1[nH+]ccc(N2CC[C@H]([C@@H](C)[NH3+])C2)c1Cl ZINC000261588373 135228968 /nfs/dbraw/zinc/22/89/68/135228968.db2.gz SIFOWTUYLVMLJE-SCZZXKLOSA-N 2 0 239.750 2.217 20 0 BEADRP Cc1[nH+]ccc(N2C[C@H](C[NH3+])C[C@H]2C)c1Cl ZINC000261591999 135232807 /nfs/dbraw/zinc/23/28/07/135232807.db2.gz VQDOZLMQYSZORV-SCZZXKLOSA-N 2 0 239.750 2.217 20 0 BEADRP [NH3+]C[C@H]1CC[N@H+](Cc2cnc3ccccc3c2)C1 ZINC000261545892 135237970 /nfs/dbraw/zinc/23/79/70/135237970.db2.gz MWEIFBSLJCEECS-GFCCVEGCSA-N 2 0 241.338 2.015 20 0 BEADRP CCOCC(C)(C)C[NH2+][C@@H]1CCCC[C@@H]1C[NH3+] ZINC000261548068 135241603 /nfs/dbraw/zinc/24/16/03/135241603.db2.gz JBCCGAUFHWRMHZ-CHWSQXEVSA-N 2 0 242.407 2.156 20 0 BEADRP CC[C@@H]1C[C@H](C)C[N@@H+]1C[C@]1(C)CC[NH2+]C1 ZINC000261548190 135241948 /nfs/dbraw/zinc/24/19/48/135241948.db2.gz NHHZWWZUPAFXHY-YNEHKIRRSA-N 2 0 210.365 2.106 20 0 BEADRP C(C1CC1)[N@H+](CC1CC[NH2+]CC1)C1CCC1 ZINC000261646188 135243007 /nfs/dbraw/zinc/24/30/07/135243007.db2.gz APOSGDCQHTWXIT-UHFFFAOYSA-N 2 0 222.376 2.251 20 0 BEADRP C(C[NH+](CC1CC1)CC1CC1)[C@@H]1CC[NH2+]C1 ZINC000084386070 135244515 /nfs/dbraw/zinc/24/45/15/135244515.db2.gz OFYROMIIQPLOGR-LBPRGKRZSA-N 2 0 222.376 2.108 20 0 BEADRP C[C@@H]1C[N@H+](C[C@]2(C)CC[NH2+]C2)CC(C)(C)C1 ZINC000261714630 135247337 /nfs/dbraw/zinc/24/73/37/135247337.db2.gz FBDCNGKZOCFCTC-GXTWGEPZSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H]1C[N@H+](C[C@@]2(C)CC[NH2+]C2)CC(C)(C)C1 ZINC000261714633 135247445 /nfs/dbraw/zinc/24/74/45/135247445.db2.gz FBDCNGKZOCFCTC-JSGCOSHPSA-N 2 0 224.392 2.354 20 0 BEADRP COc1cc(C[N@@H+]2C[C@H](C[NH3+])C[C@@H]2C)ccc1C ZINC000261787632 135252473 /nfs/dbraw/zinc/25/24/73/135252473.db2.gz FYYJGFKQUCXKPM-JSGCOSHPSA-N 2 0 248.370 2.173 20 0 BEADRP C(C1CC1)[N@H+](C[C@H]1CCC[NH2+]C1)C1CCC1 ZINC000261790083 135253848 /nfs/dbraw/zinc/25/38/48/135253848.db2.gz GBYGOTALQXPDSS-ZDUSSCGKSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@H](C[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1)c1ccc(F)cc1 ZINC000261815029 135255501 /nfs/dbraw/zinc/25/55/01/135255501.db2.gz HXOHQEZCLLSPRD-BNOWGMLFSA-N 2 0 248.345 2.080 20 0 BEADRP C[C@]1(C[N@@H+]2CCC[C@H]2C2CCC2)CC[NH2+]C1 ZINC000261866175 135257929 /nfs/dbraw/zinc/25/79/29/135257929.db2.gz NVPDWSBMSHJHAD-KBPBESRZSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@H]1C[C@H]1C[NH+]1CCC([NH2+]CC2CC2)CC1 ZINC000261948513 135265565 /nfs/dbraw/zinc/26/55/65/135265565.db2.gz NNXTWXZFEUVSCU-AAEUAGOBSA-N 2 0 222.376 2.106 20 0 BEADRP C[C@H](C[NH+]1CCC([NH3+])CC1)c1ccc(F)cc1 ZINC000261953063 135266506 /nfs/dbraw/zinc/26/65/06/135266506.db2.gz OGIRYWHIWMHQAF-LLVKDONJSA-N 2 0 236.334 2.352 20 0 BEADRP CC(C)[C@@H]1CCC[N@H+](C[C@]2(C)CC[NH2+]C2)C1 ZINC000261984046 135269516 /nfs/dbraw/zinc/26/95/16/135269516.db2.gz JMJBEQXJISNDLP-ZIAGYGMSSA-N 2 0 224.392 2.354 20 0 BEADRP CC(C)[C@H]1CCC[N@H+](C[C@H]2CCC[NH2+]C2)C1 ZINC000261982462 135269688 /nfs/dbraw/zinc/26/96/88/135269688.db2.gz RNYHWSMDDPKJTN-KBPBESRZSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@H]1C[N@H+](C[C@H]2CCC[NH2+]C2)CC(C)(C)C1 ZINC000261985109 135269732 /nfs/dbraw/zinc/26/97/32/135269732.db2.gz RVGZBQXHIWFXSL-OLZOCXBDSA-N 2 0 224.392 2.354 20 0 BEADRP Cc1cc([C@@H]2CCC[N@@H+]2CC2CC[NH2+]CC2)on1 ZINC000262298393 135291618 /nfs/dbraw/zinc/29/16/18/135291618.db2.gz WZDQMXZKJHYLAC-ZDUSSCGKSA-N 2 0 249.358 2.120 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCc2nc[nH]c2C1)c1nccs1 ZINC000334404845 135393131 /nfs/dbraw/zinc/39/31/31/135393131.db2.gz HBJLATHWPZMGEK-BDAKNGLRSA-N 2 0 248.355 2.074 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCc2nc[nH]c2C1)c1nccs1 ZINC000334404849 135393185 /nfs/dbraw/zinc/39/31/85/135393185.db2.gz HBJLATHWPZMGEK-DTWKUNHWSA-N 2 0 248.355 2.074 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCc2nc[nH]c2C1)c1ccccn1 ZINC000334405943 135394186 /nfs/dbraw/zinc/39/41/86/135394186.db2.gz HOJPAJTUFDPULV-WDEREUQCSA-N 2 0 242.326 2.013 20 0 BEADRP C[C@@H]1CCCC[C@H]1C[NH+]1CCC(C[NH3+])CC1 ZINC000346688373 135475346 /nfs/dbraw/zinc/47/53/46/135475346.db2.gz NPVJTAPAAHBSGS-OCCSQVGLSA-N 2 0 224.392 2.483 20 0 BEADRP CCO[C@@H]1C[C@H]([NH2+]CCCC[NH+](C)C)C1(C)C ZINC000085398155 135483586 /nfs/dbraw/zinc/48/35/86/135483586.db2.gz SMFXBJPMXQLNAL-QWHCGFSZSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H]1CC([NH2+]CC2CC[NH2+]CC2)C[C@H](C)C1 ZINC000086701330 135494748 /nfs/dbraw/zinc/49/47/48/135494748.db2.gz FOJDBSREJFFJFK-VXGBXAGGSA-N 2 0 224.392 2.400 20 0 BEADRP CC1(C)CC[N@H+](CC[C@H]2CCC[NH2+]C2)C1 ZINC000087254611 135504451 /nfs/dbraw/zinc/50/44/51/135504451.db2.gz TUYRYXOARZNGLL-GFCCVEGCSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@H]1CCC[C@H]1[NH2+]CC1(C)CC[NH2+]CC1 ZINC000334863179 135826739 /nfs/dbraw/zinc/82/67/39/135826739.db2.gz MNADEMAWNYTTLA-NWDGAFQWSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]Cc1cccs1 ZINC000335219644 135960007 /nfs/dbraw/zinc/96/00/07/135960007.db2.gz UNCJWUNSANICJT-PWSUYJOCSA-N 2 0 224.373 2.226 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CCc3nc[nH]c3C2)s1 ZINC000335326087 136051897 /nfs/dbraw/zinc/05/18/97/136051897.db2.gz VYAWZMAGMSGFAP-JTQLQIEISA-N 2 0 247.367 2.427 20 0 BEADRP Cc1cc(N)cc(C[NH2+][C@@H]2CC[N@@H+](C)C[C@H]2C)c1 ZINC000335356514 136061653 /nfs/dbraw/zinc/06/16/53/136061653.db2.gz DKUGESOVWICPHD-IUODEOHRSA-N 2 0 247.386 2.007 20 0 BEADRP CC(C)(C)[NH+]1CCC([NH2+][C@@H]2C[C@H]2C(F)F)CC1 ZINC000348296406 136062865 /nfs/dbraw/zinc/06/28/65/136062865.db2.gz VZYNNEHGCJUVJV-GHMZBOCLSA-N 2 0 246.345 2.493 20 0 BEADRP FC1(CC[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)CCC1 ZINC000348336941 136075643 /nfs/dbraw/zinc/07/56/43/136075643.db2.gz SPPNAIRNRHNKEM-QWHCGFSZSA-N 2 0 240.366 2.485 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CC2C[NH2+]C2)c2ccccc21 ZINC000335551935 136098267 /nfs/dbraw/zinc/09/82/67/136098267.db2.gz LNJGAAHTZOCBNH-ABAIWWIYSA-N 2 0 230.355 2.434 20 0 BEADRP Clc1ccc2c(c1)CC[C@H]2[NH2+]CC1C[NH2+]C1 ZINC000335552529 136098315 /nfs/dbraw/zinc/09/83/15/136098315.db2.gz OHCRABMMYXCAAR-CYBMUJFWSA-N 2 0 236.746 2.136 20 0 BEADRP c1ccc2c(c1)CCCC[C@H]2[NH2+]CC1C[NH2+]C1 ZINC000335553023 136098872 /nfs/dbraw/zinc/09/88/72/136098872.db2.gz RWXNUWBFPJLTJG-OAHLLOKOSA-N 2 0 230.355 2.263 20 0 BEADRP C[C@H]1CC(C)(C)C[C@H]1[NH2+]C1CC[NH2+]CC1 ZINC000335568954 136108976 /nfs/dbraw/zinc/10/89/76/136108976.db2.gz PCZKTZUIPVQUGA-CMPLNLGQSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+]C(C)C)C1 ZINC000053655363 166970542 /nfs/dbraw/zinc/97/05/42/166970542.db2.gz BBEMWUVCCKVSRN-CYBMUJFWSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H](CC1CC1)[NH2+]C[C@@H]1CCCC[N@H+](C)C1 ZINC000624121271 397801062 /nfs/dbraw/zinc/80/10/62/397801062.db2.gz SBWSGUJIOLOLOM-OCCSQVGLSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)=CCC[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000309101982 397851245 /nfs/dbraw/zinc/85/12/45/397851245.db2.gz GGCCJUQHYBKFPF-STQMWFEESA-N 2 0 210.365 2.415 20 0 BEADRP C[C@H](CCO)CC[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000397616106 397883386 /nfs/dbraw/zinc/88/33/86/397883386.db2.gz FFVFISZJZVLREW-NILFDRSVSA-N 2 0 248.370 2.129 20 0 BEADRP C[NH+](C)CCC1CC[NH+](Cc2ccccn2)CC1 ZINC000264303433 397919597 /nfs/dbraw/zinc/91/95/97/397919597.db2.gz WPOJIPIIIBWIAK-UHFFFAOYSA-N 2 0 247.386 2.245 20 0 BEADRP CC(C)CCC[N@@H+]1CCC[C@H]([C@@H](C)[NH3+])C1 ZINC000165030488 398002314 /nfs/dbraw/zinc/00/23/14/398002314.db2.gz AVYBVBKYXPLCCL-OLZOCXBDSA-N 2 0 212.381 2.482 20 0 BEADRP C[C@H]1C[C@H](C[NH3+])C[N@@H+]1C[C@@H]1C[C@H]1c1ccccc1 ZINC000414657551 398005998 /nfs/dbraw/zinc/00/59/98/398005998.db2.gz HQYGHMLFZCKXMH-XRGAULLZSA-N 2 0 244.382 2.459 20 0 BEADRP CC[C@H](C)N(C)CC[NH2+]CC1(COC)CCC1 ZINC000383452282 398020246 /nfs/dbraw/zinc/02/02/46/398020246.db2.gz HMPNBPNKEXSISO-ZDUSSCGKSA-N 2 0 242.407 2.123 20 0 BEADRP CSC1(C[NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)CCC1 ZINC000193801999 398029166 /nfs/dbraw/zinc/02/91/66/398029166.db2.gz HGZFGNLTYXVSTL-RYUDHWBXSA-N 2 0 242.432 2.344 20 0 BEADRP CSC1(C[NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)CCC1 ZINC000193801970 398029771 /nfs/dbraw/zinc/02/97/71/398029771.db2.gz HGZFGNLTYXVSTL-NWDGAFQWSA-N 2 0 242.432 2.344 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H](C)Cc1ccccc1F ZINC000414851554 398059562 /nfs/dbraw/zinc/05/95/62/398059562.db2.gz PISVINQRJWRIIA-NEPJUHHUSA-N 2 0 238.350 2.202 20 0 BEADRP CCC[C@@H](C)C[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000414855176 398063106 /nfs/dbraw/zinc/06/31/06/398063106.db2.gz VVXKVRXRQWICPM-OLZOCXBDSA-N 2 0 212.381 2.402 20 0 BEADRP CC[C@H](O)[C@H](CC)[NH2+][C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000313148075 398094862 /nfs/dbraw/zinc/09/48/62/398094862.db2.gz KCZRBEDUXQFOLH-AJNGGQMLSA-N 2 0 248.370 2.270 20 0 BEADRP CC[NH+](CC)CCC[N@H+](CC)[C@@H]1CCCOC1 ZINC000649755395 398086200 /nfs/dbraw/zinc/08/62/00/398086200.db2.gz MVAKSJBRKKCUFD-CQSZACIVSA-N 2 0 242.407 2.219 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+][C@H]1CCN(CC2CC2)C1 ZINC000648450096 398051830 /nfs/dbraw/zinc/05/18/30/398051830.db2.gz SWHOBRNZFHQSHL-DOMZBBRYSA-N 2 0 248.370 2.285 20 0 BEADRP CC[NH+](CC)CCC[NH2+]CC1(COC)CCC1 ZINC000383948488 398052939 /nfs/dbraw/zinc/05/29/39/398052939.db2.gz WCNSCEQWGJKPHB-UHFFFAOYSA-N 2 0 242.407 2.125 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]C[C@H](C)Cc1ccccc1 ZINC000414850666 398057726 /nfs/dbraw/zinc/05/77/26/398057726.db2.gz ZRCNABHJIVZELA-ZIAGYGMSSA-N 2 0 234.387 2.310 20 0 BEADRP CCSCC[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC000128996824 398099605 /nfs/dbraw/zinc/09/96/05/398099605.db2.gz OKBFBGMNCLSQPV-YHWZYXNKSA-N 2 0 242.432 2.344 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+][C@H]1CCC[NH2+]CC1 ZINC000128908219 398097798 /nfs/dbraw/zinc/09/77/98/398097798.db2.gz CDVUKLZHBLNSSX-OLZOCXBDSA-N 2 0 236.359 2.332 20 0 BEADRP CSCCCC[NH2+][C@H]1CCCC[C@H]1C[NH3+] ZINC000229207839 398113027 /nfs/dbraw/zinc/11/30/27/398113027.db2.gz MSXDMBAIMLCMNU-RYUDHWBXSA-N 2 0 230.421 2.237 20 0 BEADRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]C1CCC2(CC2)CC1 ZINC000335007138 398125045 /nfs/dbraw/zinc/12/50/45/398125045.db2.gz FOXSRJAFCZKDQA-YPMHNXCESA-N 2 0 222.376 2.426 20 0 BEADRP CC[C@H](C)[C@H](C[NH2+][C@@H](C)CCCC[NH3+])OC ZINC000362976036 171393097 /nfs/dbraw/zinc/39/30/97/171393097.db2.gz IWSNXMWWMCQSCG-AVGNSLFASA-N 2 0 230.396 2.155 20 0 BEADRP C[C@H](CCC1CC1)[NH2+][C@H]1CC[NH2+]C[C@H]1C ZINC000398111062 322864285 /nfs/dbraw/zinc/86/42/85/322864285.db2.gz XETCOIZCYZINFU-WZRBSPASSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1C[C@H]1C[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000668782162 487529517 /nfs/dbraw/zinc/52/95/17/487529517.db2.gz AIDZUKLDTRDFCO-DOMZBBRYSA-N 2 0 236.403 2.354 20 0 BEADRP Cc1cc(C[NH2+]C[C@H]2CCC[NH2+]C2)ccc1F ZINC000258990976 322880735 /nfs/dbraw/zinc/88/07/35/322880735.db2.gz LTUSNVQGISMFJI-ZDUSSCGKSA-N 2 0 236.334 2.223 20 0 BEADRP Cc1ccccc1C[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000259091168 322881675 /nfs/dbraw/zinc/88/16/75/322881675.db2.gz UGORITHMZBGWEG-CQSZACIVSA-N 2 0 218.344 2.227 20 0 BEADRP COc1ccccc1C[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000259144507 322882073 /nfs/dbraw/zinc/88/20/73/322882073.db2.gz XHHIXAPTABJAKR-ZDUSSCGKSA-N 2 0 248.370 2.175 20 0 BEADRP CC(C)C[C@@H](C)[NH2+]CCC[NH2+]C(C)C ZINC000238170353 487570602 /nfs/dbraw/zinc/57/06/02/487570602.db2.gz XSKRJKIGPIICNC-GFCCVEGCSA-N 2 0 200.370 2.399 20 0 BEADRP [NH3+]CCC[N@@H+]1CCC[C@@]2(CC=CCC2)C1 ZINC000334859481 487571795 /nfs/dbraw/zinc/57/17/95/487571795.db2.gz ZBOWYESBRNDSMN-ZDUSSCGKSA-N 2 0 208.349 2.158 20 0 BEADRP [NH3+]CC[C@@H]1CCC[N@H+](CC2CC=CC2)C1 ZINC000238553971 487586549 /nfs/dbraw/zinc/58/65/49/487586549.db2.gz IKEHDXSQHSBQMJ-ZDUSSCGKSA-N 2 0 208.349 2.013 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H]1CS[C@H](C)C1 ZINC000086934275 487589469 /nfs/dbraw/zinc/58/94/69/487589469.db2.gz VCPYSZORGYMAER-NEPJUHHUSA-N 2 0 230.421 2.202 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000668820997 487596482 /nfs/dbraw/zinc/59/64/82/487596482.db2.gz ZZCGQSMIIVMAOT-VHDGCEQUSA-N 2 0 236.403 2.354 20 0 BEADRP Cc1ccccc1C[NH2+][C@@H]1CC[C@@H]2C[N@@H+](C)C[C@H]12 ZINC001651697440 1172976412 /nfs/dbraw/zinc/97/64/12/1172976412.db2.gz AACROSYEHBDTJL-OWCLPIDISA-N 2 0 244.382 2.425 20 0 BEADRP COc1ccc2c(c1)C[N@@H+](CC1CC[NH2+]CC1)C2 ZINC000058012248 487601136 /nfs/dbraw/zinc/60/11/36/487601136.db2.gz PVQUROPEVSCTSM-UHFFFAOYSA-N 2 0 246.354 2.010 20 0 BEADRP C([C@H]1CCC[NH2+]C1)[N@@H+]1CCC[C@@H](C2CCC2)C1 ZINC000662318397 409636349 /nfs/dbraw/zinc/63/63/49/409636349.db2.gz ZQUHWOWGAVSRIQ-DZGCQCFKSA-N 2 0 236.403 2.498 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCC[C@H](C2CCC2)C1 ZINC000662317787 409637333 /nfs/dbraw/zinc/63/73/33/409637333.db2.gz SIYYLTAUIFKQCK-ZDUSSCGKSA-N 2 0 210.365 2.108 20 0 BEADRP C1=CCC(C[N@@H+]2CCC[C@@]3(CC[NH2+]C3)C2)C1 ZINC000662277646 409593068 /nfs/dbraw/zinc/59/30/68/409593068.db2.gz RGKZAFRQGYXUSH-AWEZNQCLSA-N 2 0 220.360 2.028 20 0 BEADRP CC(C)SCC[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@H]1C ZINC000309408772 167332582 /nfs/dbraw/zinc/33/25/82/167332582.db2.gz VGUWPJDESYXNGT-JHJVBQTASA-N 2 0 244.448 2.446 20 0 BEADRP C[NH+](C)C1CCN(c2[nH+]ccc3[nH]ccc32)CC1 ZINC000663386435 410172321 /nfs/dbraw/zinc/17/23/21/410172321.db2.gz LYFIRDCWRNUVNX-UHFFFAOYSA-N 2 0 244.342 2.093 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CC[N@H+](Cc2cccc3c2CCC3)C1 ZINC000650703280 410334633 /nfs/dbraw/zinc/33/46/33/410334633.db2.gz SNYHTYYKMFNUCV-GXTWGEPZSA-N 2 0 244.382 2.344 20 0 BEADRP c1cc2c(c(C[NH2+]C[C@@H]3CCC[NH2+]C3)c1)CCC2 ZINC000650703910 410335908 /nfs/dbraw/zinc/33/59/08/410335908.db2.gz XPZHHPXNYBAJCY-CYBMUJFWSA-N 2 0 244.382 2.265 20 0 BEADRP C[C@H]1C[NH2+]CC[C@H]1[NH2+]Cc1cccc2c1CCC2 ZINC000650703862 410336389 /nfs/dbraw/zinc/33/63/89/410336389.db2.gz VOULDSMBYVILMX-BLLLJJGKSA-N 2 0 244.382 2.263 20 0 BEADRP c1cc2c(c(C[NH2+]CC[C@@H]3CC[NH2+]C3)c1)CCC2 ZINC000650703951 410336480 /nfs/dbraw/zinc/33/64/80/410336480.db2.gz ZIKZAEADSOXDOB-ZDUSSCGKSA-N 2 0 244.382 2.265 20 0 BEADRP [NH3+]CC1(CC[NH2+]Cc2c(F)cccc2F)CC1 ZINC000650712301 410341845 /nfs/dbraw/zinc/34/18/45/410341845.db2.gz ZNVUUSUUTOBLBR-UHFFFAOYSA-N 2 0 240.297 2.183 20 0 BEADRP [NH3+]CC1(CC[NH2+]Cc2cc(F)ccc2F)CC1 ZINC000650712515 410342704 /nfs/dbraw/zinc/34/27/04/410342704.db2.gz HKZQHDRWQKCBFD-UHFFFAOYSA-N 2 0 240.297 2.183 20 0 BEADRP CC(C)C[C@@H]([NH3+])CN1C[C@H](C)OCC12CCC2 ZINC000650720711 410360783 /nfs/dbraw/zinc/36/07/83/410360783.db2.gz ZENQAOVXMRFHND-QWHCGFSZSA-N 2 0 240.391 2.003 20 0 BEADRP Cc1ccccc1[C@@H]1C[C@H]1[NH2+][C@H]1CCC[C@@H]1[NH3+] ZINC000650742326 410375488 /nfs/dbraw/zinc/37/54/88/410375488.db2.gz VWJOKSAXFZOFPW-ZQDZILKHSA-N 2 0 230.355 2.320 20 0 BEADRP C[C@@H](CCc1ccco1)[NH2+]CCC1(C[NH3+])CC1 ZINC000650743605 410377815 /nfs/dbraw/zinc/37/78/15/410377815.db2.gz XJAZLUZBTHPWFA-LBPRGKRZSA-N 2 0 236.359 2.319 20 0 BEADRP C[C@@H]([NH2+]CCC1(C[NH3+])CC1)c1cncc(F)c1 ZINC000650744106 410380690 /nfs/dbraw/zinc/38/06/90/410380690.db2.gz GIPBURKFGJILSZ-SNVBAGLBSA-N 2 0 237.322 2.000 20 0 BEADRP Cc1cncc([C@@H](C)[NH2+]CCC2(C[NH3+])CC2)c1 ZINC000650747072 410384389 /nfs/dbraw/zinc/38/43/89/410384389.db2.gz QZJFKNPJNRICNS-GFCCVEGCSA-N 2 0 233.359 2.170 20 0 BEADRP CC(C)C1CC([NH2+]CCC2(C[NH3+])CC2)C1 ZINC000650747223 410385084 /nfs/dbraw/zinc/38/50/84/410385084.db2.gz VAYVIYNGGCQVRY-UHFFFAOYSA-N 2 0 210.365 2.140 20 0 BEADRP CC[C@H]([NH2+]CCC1(C[NH3+])CC1)c1ccncc1 ZINC000650748362 410389910 /nfs/dbraw/zinc/38/99/10/410389910.db2.gz SFPZIWRLVKVJGC-ZDUSSCGKSA-N 2 0 233.359 2.251 20 0 BEADRP CC[C@H]([NH2+]CCC1(C[NH3+])CC1)[C@@H]1C[C@@H]1C ZINC000650748475 410390565 /nfs/dbraw/zinc/39/05/65/410390565.db2.gz VCNJTFWBMZTNKI-TUAOUCFPSA-N 2 0 210.365 2.140 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]Cc2ccc(C[NH3+])cc2F)[C@H]1C ZINC000650755589 410402067 /nfs/dbraw/zinc/40/20/67/410402067.db2.gz IJUDNPHNKKEECP-BFVZDQMLSA-N 2 0 236.334 2.419 20 0 BEADRP C[NH2+]Cc1ccccc1C[NH2+][C@H](C)[C@@H]1CCCO1 ZINC000650756713 410404017 /nfs/dbraw/zinc/40/40/17/410404017.db2.gz IILRISZQFDFOFL-DOMZBBRYSA-N 2 0 248.370 2.063 20 0 BEADRP CC[C@H]1CC[C@H]1[NH2+]CCC1CC[NH2+]CC1 ZINC000650761625 410410245 /nfs/dbraw/zinc/41/02/45/410410245.db2.gz FLWCMOUJPQTWBA-QWHCGFSZSA-N 2 0 210.365 2.154 20 0 BEADRP CC[C@H]([NH2+]CCC1CC[NH2+]CC1)[C@@H]1C[C@@H]1C ZINC000650762248 410411955 /nfs/dbraw/zinc/41/19/55/410411955.db2.gz XXHPOIWHWXTMAE-YUTCNCBUSA-N 2 0 224.392 2.400 20 0 BEADRP Cc1cncc([C@@H](C)[NH2+]CCC2CC[NH2+]CC2)c1 ZINC000650762472 410412535 /nfs/dbraw/zinc/41/25/35/410412535.db2.gz BEUUWOOLVZZQJN-CYBMUJFWSA-N 2 0 247.386 2.430 20 0 BEADRP C[C@H](CC1CC1)[NH2+]CCC1CC[NH2+]CC1 ZINC000650764263 410414794 /nfs/dbraw/zinc/41/47/94/410414794.db2.gz UUHROHREQXOKED-LLVKDONJSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1C[C@H](C)[N@H+](Cc2cccc(O)c2)C[C@@H]1C[NH3+] ZINC000397251756 410535128 /nfs/dbraw/zinc/53/51/28/410535128.db2.gz CWFMYBCJYQGPAS-DYEKYZERSA-N 2 0 248.370 2.197 20 0 BEADRP CC[C@@H]([NH2+]C[C@]1(C)CC1(F)F)[C@@H]1CCC[NH2+]1 ZINC000665267548 410739673 /nfs/dbraw/zinc/73/96/73/410739673.db2.gz YKXPKORFLUJJFA-VWYCJHECSA-N 2 0 232.318 2.152 20 0 BEADRP C[NH2+]C[C@H](C)[NH2+][C@H]1CCC[C@H](c2cccnc2)C1 ZINC000665297728 410816560 /nfs/dbraw/zinc/81/65/60/410816560.db2.gz KJFZKWOTYPAQDX-YDHLFZDLSA-N 2 0 247.386 2.305 20 0 BEADRP C[NH2+]C[C@H](C)[NH2+][C@H](Cc1ccccc1)C1CC1 ZINC000665296784 410813907 /nfs/dbraw/zinc/81/39/07/410813907.db2.gz XRRHQDPXLYQUAI-SWLSCSKDSA-N 2 0 232.371 2.205 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]C[C@@H]1CCCO1 ZINC000020049027 169776028 /nfs/dbraw/zinc/77/60/28/169776028.db2.gz OOVJGHUDCNPUTI-KGLIPLIRSA-N 2 0 242.407 2.266 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+]CC1CC1 ZINC000037118295 169776698 /nfs/dbraw/zinc/77/66/98/169776698.db2.gz MCLANKSREJGEAP-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP CC(C)[NH2+]C[C@]1(N(C)C)CCC[C@@H](C)C1 ZINC000040668399 167117538 /nfs/dbraw/zinc/11/75/38/167117538.db2.gz SDCFIEBGHKXLIW-OLZOCXBDSA-N 2 0 212.381 2.495 20 0 BEADRP CC(C)[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000336668073 167131532 /nfs/dbraw/zinc/13/15/32/167131532.db2.gz FATUQYNSVLATGF-ZDUSSCGKSA-N 2 0 206.333 2.465 20 0 BEADRP CC(C)[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000336668072 167138535 /nfs/dbraw/zinc/13/85/35/167138535.db2.gz FATUQYNSVLATGF-CYBMUJFWSA-N 2 0 206.333 2.465 20 0 BEADRP CC(C)OC[C@H](C)[NH2+]CCC[N@H+](C)C(C)C ZINC000309579223 167263761 /nfs/dbraw/zinc/26/37/61/167263761.db2.gz PWEWSLGBHJYDJE-ZDUSSCGKSA-N 2 0 230.396 2.120 20 0 BEADRP CC(C)SCC[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000304325759 167333671 /nfs/dbraw/zinc/33/36/71/167333671.db2.gz SVLFBSJFILVEQY-QWHCGFSZSA-N 2 0 242.432 2.344 20 0 BEADRP CC(C)[C@@H](C)[NH2+]CC(C)(C)C[NH+](C)C ZINC000019905806 167379835 /nfs/dbraw/zinc/37/98/35/167379835.db2.gz RCBDOJQZHPLJIX-LLVKDONJSA-N 2 0 200.370 2.208 20 0 BEADRP CC(C)[C@@H](C)[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000020189174 167380510 /nfs/dbraw/zinc/38/05/10/167380510.db2.gz RURCYSDOFFNEEC-GFCCVEGCSA-N 2 0 212.381 2.493 20 0 BEADRP CC(C)[C@@H](C)[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000297624819 167382821 /nfs/dbraw/zinc/38/28/21/167382821.db2.gz WFNSSOZHCIOVPQ-LLVKDONJSA-N 2 0 217.316 2.468 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[C@H]2C[C@H]2C1)C1CC[NH+](C)CC1 ZINC000397720219 410932236 /nfs/dbraw/zinc/93/22/36/410932236.db2.gz AUJRSKQBFNZEJJ-RUZUBIRVSA-N 2 0 222.376 2.105 20 0 BEADRP Cc1cc(C[NH2+]C2CCC([NH+](C)C)CC2)ccn1 ZINC000651388386 410970359 /nfs/dbraw/zinc/97/03/59/410970359.db2.gz UGCGBWGPWGTPBM-UHFFFAOYSA-N 2 0 247.386 2.352 20 0 BEADRP C[NH+](C)CCCC[NH2+]Cc1cc2cnccc2o1 ZINC000651691755 411136960 /nfs/dbraw/zinc/13/69/60/411136960.db2.gz GHKNOKBSKXNUPK-UHFFFAOYSA-N 2 0 247.342 2.259 20 0 BEADRP CC(C)[C@@H]1CCCC[N@@H+]1C[C@@H]1CC[NH2+]C1 ZINC000108324129 411144221 /nfs/dbraw/zinc/14/42/21/411144221.db2.gz NYNXRHISTOGBHF-OLZOCXBDSA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)C[N@H+](C)CCC[NH2+][C@@H]1COC(C)(C)C1 ZINC000651864810 411148034 /nfs/dbraw/zinc/14/80/34/411148034.db2.gz FNQXRRKIZWXUIX-ZDUSSCGKSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H]([NH3+])C[N@@H+]1CCC[C@@H]1CC1CCCC1 ZINC000655949011 411161499 /nfs/dbraw/zinc/16/14/99/411161499.db2.gz KFEUEVRXIMYWLY-WCQYABFASA-N 2 0 210.365 2.378 20 0 BEADRP CC(F)(F)CCC[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000401001300 411168573 /nfs/dbraw/zinc/16/85/73/411168573.db2.gz MVYAOBOTJQVJIB-IJLUTSLNSA-N 2 0 246.345 2.400 20 0 BEADRP C1=C(C[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)CCCC1 ZINC000401003409 411168601 /nfs/dbraw/zinc/16/86/01/411168601.db2.gz AINFASIROIJZHX-RRFJBIMHSA-N 2 0 234.387 2.465 20 0 BEADRP C1[C@H]([NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)C12CCCC2 ZINC000400989613 411168648 /nfs/dbraw/zinc/16/86/48/411168648.db2.gz XVRMTHOBRZGHFT-FQUUOJAGSA-N 2 0 234.387 2.297 20 0 BEADRP C[C@H]1CCCCC[C@@H]1[NH2+]CCOCC[NH+](C)C ZINC000652193084 411168711 /nfs/dbraw/zinc/16/87/11/411168711.db2.gz VLYIQPVSULRGMD-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP C[N@@H+]1CCC[C@@H]2C[NH+](CC3CC=CC3)CC[C@H]21 ZINC000660009879 411172723 /nfs/dbraw/zinc/17/27/23/411172723.db2.gz CIIKLEYYTBMOOL-HUUCEWRRSA-N 2 0 234.387 2.369 20 0 BEADRP Cc1ccccc1C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000401027314 411173274 /nfs/dbraw/zinc/17/32/74/411173274.db2.gz VEBDDQUJXRXUQP-HRCADAONSA-N 2 0 244.382 2.473 20 0 BEADRP CC(F)(F)CC[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000401027205 411173656 /nfs/dbraw/zinc/17/36/56/411173656.db2.gz NZVAWLCIOGCTGE-GMTAPVOTSA-N 2 0 232.318 2.009 20 0 BEADRP COC(C)(C)[C@@H](C)[NH2+]CCC[N@H+](C)CC(C)C ZINC000652222379 411175363 /nfs/dbraw/zinc/17/53/63/411175363.db2.gz MTFKSSAOYZYKTB-CYBMUJFWSA-N 2 0 244.423 2.367 20 0 BEADRP COC[C@H]([NH2+]CCC[N@H+](C)CC(C)C)C(C)C ZINC000652221995 411175653 /nfs/dbraw/zinc/17/56/53/411175653.db2.gz BTPGNTAPPRKIQH-AWEZNQCLSA-N 2 0 244.423 2.225 20 0 BEADRP Fc1ccccc1C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000401088268 411176857 /nfs/dbraw/zinc/17/68/57/411176857.db2.gz WGKLURITYKNXQG-FPMFFAJLSA-N 2 0 248.345 2.303 20 0 BEADRP Fc1ccccc1C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000401088270 411177085 /nfs/dbraw/zinc/17/70/85/411177085.db2.gz WGKLURITYKNXQG-KWCYVHTRSA-N 2 0 248.345 2.303 20 0 BEADRP CCC(CC)C[N@@H+]1CC[C@H]2CC[NH2+][C@@H]2C1 ZINC000309996323 411194014 /nfs/dbraw/zinc/19/40/14/411194014.db2.gz CFFQNSQPOZXMIB-CHWSQXEVSA-N 2 0 210.365 2.106 20 0 BEADRP CCC(CC)(CCO)C[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000656193077 411198371 /nfs/dbraw/zinc/19/83/71/411198371.db2.gz MBIBRLDNEOWSQN-CHWSQXEVSA-N 2 0 242.407 2.035 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]CC2CCC(F)CC2)C1 ZINC000656193357 411200670 /nfs/dbraw/zinc/20/06/70/411200670.db2.gz HQIKJLAGKGSRCB-TYUFSLCMSA-N 2 0 228.355 2.374 20 0 BEADRP Cc1cccc(CCC[NH2+][C@H]2CCC[C@@H]([NH3+])C2)n1 ZINC000656199179 411201447 /nfs/dbraw/zinc/20/14/47/411201447.db2.gz VIVVZQHGILHZEK-HIFRSBDPSA-N 2 0 247.386 2.182 20 0 BEADRP C[C@H]([NH2+][C@@H](C)C1CCC(F)(F)CC1)C1C[NH2+]C1 ZINC000656201956 411208056 /nfs/dbraw/zinc/20/80/56/411208056.db2.gz VUEKZNURSFHTJN-UWVGGRQHSA-N 2 0 246.345 2.398 20 0 BEADRP CC(C)CC[C@H]1CCC[N@@H+]1C[C@H]1CC[NH2+]C1 ZINC000652343515 411208220 /nfs/dbraw/zinc/20/82/20/411208220.db2.gz OSBPNTCCVVXXRW-UONOGXRCSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1)c1ccccn1 ZINC000658064004 411229173 /nfs/dbraw/zinc/22/91/73/411229173.db2.gz MLMRGAKYBRSXMV-HZSPNIEDSA-N 2 0 247.386 2.257 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CCCOC1CCCC1 ZINC000422827471 411232615 /nfs/dbraw/zinc/23/26/15/411232615.db2.gz MZNRJNUXAGGTCV-NEPJUHHUSA-N 2 0 228.380 2.051 20 0 BEADRP CC1(C[NH+]2CCC(OCCC[NH3+])CC2)CCC1 ZINC000310302623 411232728 /nfs/dbraw/zinc/23/27/28/411232728.db2.gz BWGQOFRNACDMPW-UHFFFAOYSA-N 2 0 240.391 2.006 20 0 BEADRP C[C@H]([NH2+]CC1(c2ccc(F)cc2)CC1)C1C[NH2+]C1 ZINC000422905155 411233831 /nfs/dbraw/zinc/23/38/31/411233831.db2.gz YQXGYNGOJDXEPV-NSHDSACASA-N 2 0 248.345 2.055 20 0 BEADRP C[C@H]1CC[C@H]([NH2+]CCC[NH+]2CCCC2)CS1 ZINC000655694863 411240035 /nfs/dbraw/zinc/24/00/35/411240035.db2.gz HUFTVEBDYQFHOE-STQMWFEESA-N 2 0 242.432 2.346 20 0 BEADRP CCC(CC)C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000400969784 411166548 /nfs/dbraw/zinc/16/65/48/411166548.db2.gz OTVSBKPRWGPZMY-MGPQQGTHSA-N 2 0 224.392 2.400 20 0 BEADRP CC(C)(C)C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000400950688 411166684 /nfs/dbraw/zinc/16/66/84/411166684.db2.gz WSIAIMFTLBWUHO-QJPTWQEYSA-N 2 0 210.365 2.010 20 0 BEADRP CCC(C)(C)C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000400983195 411167190 /nfs/dbraw/zinc/16/71/90/411167190.db2.gz WVPFRQBYILXCHU-JHJVBQTASA-N 2 0 224.392 2.400 20 0 BEADRP C1=CC[C@H]([NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)CC1 ZINC000400979966 411167253 /nfs/dbraw/zinc/16/72/53/411167253.db2.gz RGRKSZYPNXMZPY-YIYPIFLZSA-N 2 0 220.360 2.073 20 0 BEADRP CCC1(C[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)CC1 ZINC000400977172 411167499 /nfs/dbraw/zinc/16/74/99/411167499.db2.gz PSEMTKIPPOVMGM-YNEHKIRRSA-N 2 0 222.376 2.154 20 0 BEADRP [NH3+]C1CCC([NH2+]C(C2CC2)C2CC2)CC1 ZINC000051693191 411279962 /nfs/dbraw/zinc/27/99/62/411279962.db2.gz FJAYZTPOLPIMOG-UHFFFAOYSA-N 2 0 208.349 2.035 20 0 BEADRP c1cnc2c(c1)CCC[C@@H]2[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000643509388 411280153 /nfs/dbraw/zinc/28/01/53/411280153.db2.gz KWVIBUFGROXQAQ-OCCSQVGLSA-N 2 0 245.370 2.048 20 0 BEADRP C([C@@H]1CC[NH2+]C1)[N@@H+]1CCC[C@H]1C1CCCC1 ZINC000051890106 411284512 /nfs/dbraw/zinc/28/45/12/411284512.db2.gz FKKGFYYKAWFZGY-OCCSQVGLSA-N 2 0 222.376 2.251 20 0 BEADRP CCC[NH2+]CCN[C@@H](C)Cc1cccs1 ZINC000643515266 411285308 /nfs/dbraw/zinc/28/53/08/411285308.db2.gz ZJPWDAXMBZNEJP-NSHDSACASA-N 2 0 226.389 2.268 20 0 BEADRP C[N@@H+](Cc1cccc(Cl)c1)C[C@H]1CC[NH2+]C1 ZINC000051889985 411285782 /nfs/dbraw/zinc/28/57/82/411285782.db2.gz VWCPIOXSSFJNSC-LBPRGKRZSA-N 2 0 238.762 2.381 20 0 BEADRP C[C@H]1CC[C@H]([NH2+]CCC2CC[NH2+]CC2)C1 ZINC000129417200 411286841 /nfs/dbraw/zinc/28/68/41/411286841.db2.gz QWSNTJRAVYOGRX-AAEUAGOBSA-N 2 0 210.365 2.154 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]CCc2ccoc2)CC1 ZINC000658199803 411290284 /nfs/dbraw/zinc/29/02/84/411290284.db2.gz NGAQZAMBXQMSGE-UHFFFAOYSA-N 2 0 236.359 2.285 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCC[C@@H]3C[C@@H]32)CC[N@@H+]1C ZINC000658204773 411291990 /nfs/dbraw/zinc/29/19/90/411291990.db2.gz BIPUTNQOVLDKGD-QMIVOQANSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CC[C@]2(C)CC2(F)F)CC[N@@H+]1C ZINC000658223085 411302335 /nfs/dbraw/zinc/30/23/35/411302335.db2.gz SKGZFQSBBJGRJY-GRYCIOLGSA-N 2 0 246.345 2.494 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CC2=CCCC2)[C@@H](C)C1 ZINC000658292656 411325777 /nfs/dbraw/zinc/32/57/77/411325777.db2.gz FSUIYMCXJKBWPT-JSGCOSHPSA-N 2 0 222.376 2.417 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CC2=CCCC2)[C@H](C)C1 ZINC000658292658 411326072 /nfs/dbraw/zinc/32/60/72/411326072.db2.gz FSUIYMCXJKBWPT-TZMCWYRMSA-N 2 0 222.376 2.417 20 0 BEADRP C[NH+](C)C1CC[NH+](C[C@@H]2CC[C@H]3C[C@H]3C2)CC1 ZINC000659839905 411326316 /nfs/dbraw/zinc/32/63/16/411326316.db2.gz ZYDKGPZHZNZGNW-HZSPNIEDSA-N 2 0 236.403 2.449 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]Cc2cccc(N)c2)[C@H](C)C1 ZINC000656785300 411357862 /nfs/dbraw/zinc/35/78/62/411357862.db2.gz NCSWBHUFVCBKCT-DOMZBBRYSA-N 2 0 247.386 2.089 20 0 BEADRP CC(C)C[C@H]([NH3+])C[NH2+]C[C@@H](C)c1ccccn1 ZINC000656782374 411360429 /nfs/dbraw/zinc/36/04/29/411360429.db2.gz FNWIXUNADCMYQH-OLZOCXBDSA-N 2 0 235.375 2.148 20 0 BEADRP CN(C[C@@H]1CCOc2ccccc21)CC(C)(C)[NH3+] ZINC000656784622 411361356 /nfs/dbraw/zinc/36/13/56/411361356.db2.gz FXKGLOYPXMSGLR-LBPRGKRZSA-N 2 0 248.370 2.222 20 0 BEADRP C[C@@H]1C[C@H]1C[NH+]1CCC([C@H]2CCC[NH2+]C2)CC1 ZINC000656784319 411361735 /nfs/dbraw/zinc/36/17/35/411361735.db2.gz AJGXPZJOHZHAFZ-SNPRPXQTSA-N 2 0 236.403 2.354 20 0 BEADRP CC(C)C[N@@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000656786199 411364225 /nfs/dbraw/zinc/36/42/25/411364225.db2.gz PNFFLLYYRPBPCG-AWEZNQCLSA-N 2 0 224.392 2.354 20 0 BEADRP Cc1ccc2c(c1)C[N@@H+](CC1CC[NH2+]CC1)CC2 ZINC000656787476 411365511 /nfs/dbraw/zinc/36/55/11/411365511.db2.gz LBMIPHKGOGXMMU-UHFFFAOYSA-N 2 0 244.382 2.353 20 0 BEADRP CC(C)C[NH+]1CCC([C@@H]2CCC[NH2+]C2)CC1 ZINC000656787100 411365973 /nfs/dbraw/zinc/36/59/73/411365973.db2.gz SZSWATAKMBUSGM-CQSZACIVSA-N 2 0 224.392 2.354 20 0 BEADRP CC1(C)C[N@H+](CCC[NH3+])CCc2ccccc21 ZINC000656787729 411367143 /nfs/dbraw/zinc/36/71/43/411367143.db2.gz SVPLGVPJOKFEBR-UHFFFAOYSA-N 2 0 232.371 2.171 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]([NH2+][C@H]2CC[NH2+]C2)C[C@@H]1C ZINC000656787995 411367245 /nfs/dbraw/zinc/36/72/45/411367245.db2.gz DALAORDJZASFSE-CRWXNKLISA-N 2 0 224.392 2.399 20 0 BEADRP [NH3+]C1(C[NH2+]C2Cc3ccccc3C2)CCCC1 ZINC000656789776 411370230 /nfs/dbraw/zinc/37/02/30/411370230.db2.gz YBSSXWAVRHKAIZ-UHFFFAOYSA-N 2 0 230.355 2.015 20 0 BEADRP C[NH2+]CCC1CC[NH+]([C@@H](C)c2ccncc2)CC1 ZINC000070188968 411371461 /nfs/dbraw/zinc/37/14/61/411371461.db2.gz PCQBNLCVZDLKKQ-ZDUSSCGKSA-N 2 0 247.386 2.464 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[C@@H]2C1)C1CC[NH+](C)CC1 ZINC000403349193 411341051 /nfs/dbraw/zinc/34/10/51/411341051.db2.gz VWDXIONIWOJFGM-ZGKBOVNRSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@@H](C[NH+]1CC[C@@H]2C[C@@H]2C1)C[N@@H+]1CC[C@H]2C[C@H]2C1 ZINC000661974284 411341560 /nfs/dbraw/zinc/34/15/60/411341560.db2.gz VSSSVRQTAOLSOC-FRXHMLBDSA-N 2 0 248.414 2.306 20 0 BEADRP CC1(C[N@@H+]2CCC[C@]3(CC[NH2+]C3)C2)CCC1 ZINC000336631957 168023841 /nfs/dbraw/zinc/02/38/41/168023841.db2.gz AWFNHJQCAKIOKT-CQSZACIVSA-N 2 0 222.376 2.252 20 0 BEADRP CC1CC([NH2+]CC(C)(C)C[NH+]2CCCC2)C1 ZINC000309447293 168145124 /nfs/dbraw/zinc/14/51/24/168145124.db2.gz LQRVXZDCVSBWDQ-UHFFFAOYSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[N@H+](CC2CCC(C)CC2)C[C@@H]1[NH3+] ZINC000232859335 168152775 /nfs/dbraw/zinc/15/27/75/168152775.db2.gz IDYCQYCDURYUMF-KPFVRQRISA-N 2 0 210.365 2.092 20 0 BEADRP C[C@H]1C[C@H](C[NH3+])C[N@@H+]1CC1CCC(C)CC1 ZINC000126796121 168153414 /nfs/dbraw/zinc/15/34/14/168153414.db2.gz UGWOEEBBRLWTCZ-GNRIBBGQSA-N 2 0 224.392 2.482 20 0 BEADRP CC1CCC(C[N@@H+]2CC[C@H]([NH3+])[C@@H](C)C2)CC1 ZINC000221097770 168153931 /nfs/dbraw/zinc/15/39/31/168153931.db2.gz MKTSOJLVKAKZHW-YIOUJQMASA-N 2 0 224.392 2.482 20 0 BEADRP CC1(C)C[C@@H]([NH2+]CCC[NH+]2CCCC2)CCO1 ZINC000070346241 411391940 /nfs/dbraw/zinc/39/19/40/411391940.db2.gz JFKFUQGOVUVUJN-ZDUSSCGKSA-N 2 0 240.391 2.020 20 0 BEADRP CCC[C@H](C)C[N@@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC000366486238 411382255 /nfs/dbraw/zinc/38/22/55/411382255.db2.gz CYEZBPYVHDEVDI-UONOGXRCSA-N 2 0 224.392 2.450 20 0 BEADRP CCC(C)(C)CC[N@@H+]1CC[C@]2(CC[NH2+]C2)C1 ZINC000360566190 168276169 /nfs/dbraw/zinc/27/61/69/168276169.db2.gz XWDARNGXPADGLW-AWEZNQCLSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H]1C[C@H]1C[NH2+]Cc1ccnn1-c1cc[nH+]cc1 ZINC000657309804 411459270 /nfs/dbraw/zinc/45/92/70/411459270.db2.gz IDRKWEROVVIYHI-NEPJUHHUSA-N 2 0 242.326 2.013 20 0 BEADRP C[C@@H]1CCC[N@H+](CC2CCC2)[C@@H]1CC[NH3+] ZINC000404392555 411393144 /nfs/dbraw/zinc/39/31/44/411393144.db2.gz YWNJMKYYKWIFNA-DGCLKSJQSA-N 2 0 210.365 2.236 20 0 BEADRP CC(C)[C@@H]1C[C@H]1C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000647797881 411405137 /nfs/dbraw/zinc/40/51/37/411405137.db2.gz GFBVLELIQFEKAG-ZQNQSHIBSA-N 2 0 236.403 2.256 20 0 BEADRP FC1(F)CC12CC[NH+](C[C@H]1CCC[NH2+]C1)CC2 ZINC000405046944 411414708 /nfs/dbraw/zinc/41/47/08/411414708.db2.gz FOVJMVWMNLGNQJ-NSHDSACASA-N 2 0 244.329 2.107 20 0 BEADRP CCO[C@@H]1C[N@H+](CCCC(C)(C)C)C[C@H]1C[NH3+] ZINC000405544728 411434408 /nfs/dbraw/zinc/43/44/08/411434408.db2.gz VICQWUOCIDJROV-CHWSQXEVSA-N 2 0 242.407 2.108 20 0 BEADRP CCc1cc(OC)ccc1C[NH2+]CC[C@H](C)[NH3+] ZINC000414824174 411447835 /nfs/dbraw/zinc/44/78/35/411447835.db2.gz QEVRVFDFNYFPKR-NSHDSACASA-N 2 0 236.359 2.085 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H]2CO[C@@H](CC)C2)CC1 ZINC000657294021 411450152 /nfs/dbraw/zinc/45/01/52/411450152.db2.gz AHVGVGGPEYOXSV-KBPBESRZSA-N 2 0 240.391 2.018 20 0 BEADRP C[NH+](C)CC1CC[NH+](CCC2CCC2)CC1 ZINC000659845740 411474619 /nfs/dbraw/zinc/47/46/19/411474619.db2.gz XPEZSLMBKSVYBZ-UHFFFAOYSA-N 2 0 224.392 2.450 20 0 BEADRP COc1cc(C[NH2+]C[C@]2(C)CC[NH2+]C2)ccc1C ZINC000415089187 411491729 /nfs/dbraw/zinc/49/17/29/411491729.db2.gz YLHCPJPTANMAIO-OAHLLOKOSA-N 2 0 248.370 2.093 20 0 BEADRP C[C@@H](C[NH2+]CC(C)(C)[NH3+])Cc1cccs1 ZINC000415088257 411491817 /nfs/dbraw/zinc/49/18/17/411491817.db2.gz VZQMFTGAKOXOFY-SNVBAGLBSA-N 2 0 226.389 2.254 20 0 BEADRP C[C@@H](C[NH2+]C1CC[NH2+]CC1)Cc1cccs1 ZINC000415089036 411491882 /nfs/dbraw/zinc/49/18/82/411491882.db2.gz XDFRKALVVPICBF-LLVKDONJSA-N 2 0 238.400 2.268 20 0 BEADRP C[N@H+](CCCC1CC[NH2+]CC1)C1CCC1 ZINC000127551379 411495030 /nfs/dbraw/zinc/49/50/30/411495030.db2.gz FFIJLEXRDZWJDX-UHFFFAOYSA-N 2 0 210.365 2.251 20 0 BEADRP C[NH+](C)C[C@@H]1CC[N@H+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)C1 ZINC000659929027 411501473 /nfs/dbraw/zinc/50/14/73/411501473.db2.gz WIUBLJJAGMIQEW-BARDWOONSA-N 2 0 236.403 2.306 20 0 BEADRP CC[C@@H]1C[C@@H]([NH2+]C2CCC([NH+](C)C)CC2)CO1 ZINC000657493462 411534517 /nfs/dbraw/zinc/53/45/17/411534517.db2.gz DIRPNJUYQCOAOH-FKZOYECMSA-N 2 0 240.391 2.016 20 0 BEADRP CC[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)[C@H]1C[C@@H]1C ZINC000655804042 411519191 /nfs/dbraw/zinc/51/91/91/411519191.db2.gz NDAAYPWRFNMOAQ-HPCHECBXSA-N 2 0 224.392 2.351 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655805452 411519245 /nfs/dbraw/zinc/51/92/45/411519245.db2.gz HLVGIHRAPVJAOU-WCFLWFBJSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1ccncc1 ZINC000655805363 411519422 /nfs/dbraw/zinc/51/94/22/411519422.db2.gz MTOWMSCBEWLPGA-SGMGOOAPSA-N 2 0 233.359 2.072 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]C(C2CC2)C2CC2)C1 ZINC000655805549 411519468 /nfs/dbraw/zinc/51/94/68/411519468.db2.gz PBZIWENOCCSWOL-GSJFWJNXSA-N 2 0 222.376 2.105 20 0 BEADRP Cc1cccc(C[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)c1 ZINC000655826218 411529786 /nfs/dbraw/zinc/52/97/86/411529786.db2.gz SPANGIWJFZTXDW-GASCZTMLSA-N 2 0 232.371 2.425 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cccnc2)C1 ZINC000037644022 170008107 /nfs/dbraw/zinc/00/81/07/170008107.db2.gz HHPYPQBUVMMREZ-STQMWFEESA-N 2 0 233.359 2.074 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2cccc(F)c2)C1 ZINC000037643766 170008482 /nfs/dbraw/zinc/00/84/82/170008482.db2.gz MLTRXASPVGIIQH-ZDUSSCGKSA-N 2 0 236.334 2.257 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+]C2CCCCC2)C1 ZINC000037484161 170008708 /nfs/dbraw/zinc/00/87/08/170008708.db2.gz TXCWOFAVPNFTLP-LBPRGKRZSA-N 2 0 210.365 2.251 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH+](C)CC2CC2)C[C@@H]1C ZINC000336648179 170010360 /nfs/dbraw/zinc/01/03/60/170010360.db2.gz NRSAZOIPPIDPJF-WCQYABFASA-N 2 0 210.365 2.201 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+]C2CCC(C)CC2)C1 ZINC000037484172 170015343 /nfs/dbraw/zinc/01/53/43/170015343.db2.gz PITVDHRDZDCJRZ-ROKHWSDSSA-N 2 0 224.392 2.497 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+]C2CC3(CCC3)C2)C1 ZINC000336776605 170015595 /nfs/dbraw/zinc/01/55/95/170015595.db2.gz GDHOXLNSEMNUQD-GFCCVEGCSA-N 2 0 222.376 2.251 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+]Cc2cccc(C)c2)C1 ZINC000037643773 170015870 /nfs/dbraw/zinc/01/58/70/170015870.db2.gz BYAAHDAHARGDLY-OAHLLOKOSA-N 2 0 232.371 2.426 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+]C[C@H]2CC=CCC2)C1 ZINC000037484274 170015896 /nfs/dbraw/zinc/01/58/96/170015896.db2.gz MHZUPRZVHCWLDL-UONOGXRCSA-N 2 0 222.376 2.274 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H]2CC[C@@H]2C2CCC2)C1 ZINC000337983868 170016478 /nfs/dbraw/zinc/01/64/78/170016478.db2.gz CHLOFLOWKSSAKB-YUELXQCFSA-N 2 0 236.403 2.497 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)[C@@H]2CC2(C)C)C1 ZINC000309973732 170017152 /nfs/dbraw/zinc/01/71/52/170017152.db2.gz RESWJAKVCSRVCU-UPJWGTAASA-N 2 0 224.392 2.352 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)[C@H]2CC2(C)C)C1 ZINC000309973731 170017276 /nfs/dbraw/zinc/01/72/76/170017276.db2.gz RESWJAKVCSRVCU-JHJVBQTASA-N 2 0 224.392 2.352 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH+](C)CCCCOC)C[C@@H]1C ZINC000336718069 170019827 /nfs/dbraw/zinc/01/98/27/170019827.db2.gz ZPSYWRFCHCFCJP-KBPBESRZSA-N 2 0 242.407 2.218 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CCCCF)[C@@H](C)C1 ZINC000309063945 170020949 /nfs/dbraw/zinc/02/09/49/170020949.db2.gz YHLQEGPPODKSSE-RYUDHWBXSA-N 2 0 216.344 2.056 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CC[C@H](C)F)[C@H](C)C1 ZINC000340463553 170021679 /nfs/dbraw/zinc/02/16/79/170021679.db2.gz QZLHYIHRLQPKFO-WOPDTQHZSA-N 2 0 216.344 2.054 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H]2CC[C@H](F)C2)[C@H](C)C1 ZINC000336778106 170022069 /nfs/dbraw/zinc/02/20/69/170022069.db2.gz KIXGLWUAOLWXGN-XQHKEYJVSA-N 2 0 228.355 2.197 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@H]2CC2(C)C)[C@@H](C)C1 ZINC000309043411 170022616 /nfs/dbraw/zinc/02/26/16/170022616.db2.gz MUAGHNVKEZFJBD-SRVKXCTJSA-N 2 0 210.365 2.105 20 0 BEADRP CC[N@H+]1C[C@@H]2C[NH+](Cc3ccccc3)CC[C@@H]2C1 ZINC000307624120 170040897 /nfs/dbraw/zinc/04/08/97/170040897.db2.gz FJTSJNSPVZSZPB-HZPDHXFCSA-N 2 0 244.382 2.460 20 0 BEADRP Cc1cnccc1C[NH2+]C[C@H]1CCN1C(C)(C)C ZINC000657526144 411542869 /nfs/dbraw/zinc/54/28/69/411542869.db2.gz AWLBGSGDTGCUHO-CQSZACIVSA-N 2 0 247.386 2.352 20 0 BEADRP c1cc(C[NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)c[nH]1 ZINC000663344974 411633963 /nfs/dbraw/zinc/63/39/63/411633963.db2.gz DIJDVEXQYUAAJG-HNNXBMFYSA-N 2 0 247.386 2.226 20 0 BEADRP C1C[C@@H]2[C@H](C1)[C@@H]2[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000657734110 411587812 /nfs/dbraw/zinc/58/78/12/411587812.db2.gz FNPDESKYLFJAOM-XGFWRYKXSA-N 2 0 220.360 2.001 20 0 BEADRP c1coc(CCC[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)c1 ZINC000657781643 411597668 /nfs/dbraw/zinc/59/76/68/411597668.db2.gz FOAJYVQJXKACJN-ZIAGYGMSSA-N 2 0 248.370 2.429 20 0 BEADRP CCOC1CCC([NH2+]CCCC[NH+](C)C)CC1 ZINC000657857930 411612781 /nfs/dbraw/zinc/61/27/81/411612781.db2.gz DHANKJGYCHEUEN-UHFFFAOYSA-N 2 0 242.407 2.266 20 0 BEADRP CC(C)=CC[NH+]1CCC[C@@]2(CC[N@@H+](C)C2)C1 ZINC000660653893 411612953 /nfs/dbraw/zinc/61/29/53/411612953.db2.gz DISVALVPVFMDTH-AWEZNQCLSA-N 2 0 222.376 2.370 20 0 BEADRP CC[NH+](CC)CCC[NH2+]C1(CCO)CCCC1 ZINC000660682050 411617069 /nfs/dbraw/zinc/61/70/69/411617069.db2.gz FGACPWRSKAGFRU-UHFFFAOYSA-N 2 0 242.407 2.003 20 0 BEADRP CC[C@@H](c1ccccc1)[N@H+](C)CCC[NH3+] ZINC000133205499 411655085 /nfs/dbraw/zinc/65/50/85/411655085.db2.gz YMVPUMNMZBQZQB-ZDUSSCGKSA-N 2 0 206.333 2.418 20 0 BEADRP CCCC[C@H](CC)[NH2+]CC12CC(C1)C[NH2+]2 ZINC000663498551 411681283 /nfs/dbraw/zinc/68/12/83/411681283.db2.gz PWFCBOQEWWUUDB-CPCZMJQVSA-N 2 0 210.365 2.297 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+]Cc1ccc(F)cc1 ZINC000663498232 411681441 /nfs/dbraw/zinc/68/14/41/411681441.db2.gz NEFNCSFDOAHPGA-CYBMUJFWSA-N 2 0 224.323 2.289 20 0 BEADRP C[C@@H]1CC([NH2+]CC23CC(C2)C[NH2+]3)C[C@@H](C)C1 ZINC000663498337 411682136 /nfs/dbraw/zinc/68/21/36/411682136.db2.gz OURDELYRLSLSEO-PZFKGIAWSA-N 2 0 222.376 2.153 20 0 BEADRP C[N@@H+]1CCC[C@H]1CC[NH+]1C[C@@H]2CCCC[C@@H]21 ZINC000660933308 411684109 /nfs/dbraw/zinc/68/41/09/411684109.db2.gz OQPIICOSEABOCN-IHRRRGAJSA-N 2 0 222.376 2.345 20 0 BEADRP C[C@@H](C[NH2+]CC12CC(C1)C[NH2+]2)c1ccccc1 ZINC000663499506 411684387 /nfs/dbraw/zinc/68/43/87/411684387.db2.gz XFKBESQYPCTJPU-OPFPJEHXSA-N 2 0 230.355 2.132 20 0 BEADRP CC(C)CCC[NH2+]CC[C@@H]([NH3+])C(C)C ZINC000663503366 411688006 /nfs/dbraw/zinc/68/80/06/411688006.db2.gz QEUZPVSUWGANQW-GFCCVEGCSA-N 2 0 200.370 2.386 20 0 BEADRP C[NH2+]C[C@H](C)[NH2+]C[C@@H]1CCCC(C)(C)C1 ZINC000663508780 411689535 /nfs/dbraw/zinc/68/95/35/411689535.db2.gz DKTRKYZICCPUJJ-NWDGAFQWSA-N 2 0 212.381 2.400 20 0 BEADRP CC[C@@H]1CCC[C@H](C[NH2+][C@H](C)C[NH2+]C)C1 ZINC000663509430 411691652 /nfs/dbraw/zinc/69/16/52/411691652.db2.gz KJZZZCXZHMZLNL-UPJWGTAASA-N 2 0 212.381 2.400 20 0 BEADRP CCC(C)(C)[C@@H](C)[NH2+]C[C@@H](O)C[N@H+](C)C(C)C ZINC000661231543 411737740 /nfs/dbraw/zinc/73/77/40/411737740.db2.gz NXAZCLHHNYMOSO-CHWSQXEVSA-N 2 0 244.423 2.102 20 0 BEADRP C[N@H+]1CC=C(CNc2[nH+]ccc3[nH]ccc32)CC1 ZINC000663776369 411744541 /nfs/dbraw/zinc/74/45/41/411744541.db2.gz RCSOLKHCKCDUCC-UHFFFAOYSA-N 2 0 242.326 2.237 20 0 BEADRP Cc1ccc2c(c1)C[N@@H+](CCn1ccnc1)CC2 ZINC000661371102 411756398 /nfs/dbraw/zinc/75/63/98/411756398.db2.gz CZBMXOVLXBURTI-UHFFFAOYSA-N 2 0 241.338 2.250 20 0 BEADRP CC[C@@H]([NH2+]CC1CC[NH+](C)CC1)C(C)C ZINC000044516573 170892972 /nfs/dbraw/zinc/89/29/72/170892972.db2.gz JTSRGXMCSFCRFV-CYBMUJFWSA-N 2 0 212.381 2.352 20 0 BEADRP CCCN(C)CC(C)(C)[NH2+]CC[C@@H]1CCOC1 ZINC000662179370 412021133 /nfs/dbraw/zinc/02/11/33/412021133.db2.gz KDIDHUSYSYAHSG-CYBMUJFWSA-N 2 0 242.407 2.123 20 0 BEADRP CO[C@H](CN1CCC[C@@H]([NH3+])C1)C1CCCCC1 ZINC000662235338 412033859 /nfs/dbraw/zinc/03/38/59/412033859.db2.gz QOFLJDLDHOEXEU-ZIAGYGMSSA-N 2 0 240.391 2.005 20 0 BEADRP CC[C@H](CC(F)F)C[NH+]1CCC([NH2+]C)CC1 ZINC000662243307 412040069 /nfs/dbraw/zinc/04/00/69/412040069.db2.gz HZRTWAISQGRHKN-SNVBAGLBSA-N 2 0 234.334 2.352 20 0 BEADRP C[C@H]1C[N@H+](CCCC2CCC2)CC[C@@H]1[NH3+] ZINC000662246975 412045166 /nfs/dbraw/zinc/04/51/66/412045166.db2.gz XOMQADSQKJIGDI-AAEUAGOBSA-N 2 0 210.365 2.236 20 0 BEADRP CCC(CC)(CC)[NH2+]C[C@@H]1CCC2(C[NH2+]C2)O1 ZINC000662259204 412054433 /nfs/dbraw/zinc/05/44/33/412054433.db2.gz RVGPTCRIUOSXEH-LBPRGKRZSA-N 2 0 240.391 2.066 20 0 BEADRP CC(C)=CCC[N@@H+]1C[C@@H]2CCC[C@H]([NH3+])[C@@H]2C1 ZINC000662264115 412055516 /nfs/dbraw/zinc/05/55/16/412055516.db2.gz AYQCGFLQHLDNGK-MJBXVCDLSA-N 2 0 222.376 2.402 20 0 BEADRP C[C@@H]([NH3+])[C@@H]1CC[N@H+](CCCC2CCC2)C1 ZINC000662264166 412056399 /nfs/dbraw/zinc/05/63/99/412056399.db2.gz BOJURTKJJYKZCB-DGCLKSJQSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@H]([NH3+])[C@H]1CC[N@H+](CCCC2CCC2)C1 ZINC000662264165 412056540 /nfs/dbraw/zinc/05/65/40/412056540.db2.gz BOJURTKJJYKZCB-AAEUAGOBSA-N 2 0 210.365 2.236 20 0 BEADRP C1=CCC(C[N@@H+]2CCC[C@H]([C@@H]3CCC[NH2+]3)C2)C1 ZINC000662263503 412056788 /nfs/dbraw/zinc/05/67/88/412056788.db2.gz BVMGPPNAGGBQGM-GJZGRUSLSA-N 2 0 234.387 2.417 20 0 BEADRP CC[C@H]1C[N@H+](Cc2cccc(OC)c2)CC[C@@H]1[NH3+] ZINC000134100427 412057687 /nfs/dbraw/zinc/05/76/87/412057687.db2.gz YOBRXQPRMUSGAU-ZFWWWQNUSA-N 2 0 248.370 2.254 20 0 BEADRP CC[C@@H]1CC[C@@H](C)[N@@H+]1CC[C@H]1CC[NH2+]C1 ZINC000251686715 171039219 /nfs/dbraw/zinc/03/92/19/171039219.db2.gz PPSWVQXXPHDNNZ-JHJVBQTASA-N 2 0 210.365 2.249 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]CCN(CC)C(C)C ZINC000309236958 171041552 /nfs/dbraw/zinc/04/15/52/171041552.db2.gz XRTYYHRYJDOXII-OLZOCXBDSA-N 2 0 212.381 2.495 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000310018934 171058933 /nfs/dbraw/zinc/05/89/33/171058933.db2.gz MGCCUOQCNXHRPB-YRGRVCCFSA-N 2 0 222.376 2.249 20 0 BEADRP CC[C@H]1C[N@H+](CC2CC=CC2)CC[C@H]1[NH3+] ZINC000662270852 412063653 /nfs/dbraw/zinc/06/36/53/412063653.db2.gz PZZXQZTUMOPXIU-QWHCGFSZSA-N 2 0 208.349 2.012 20 0 BEADRP CO[C@H](C[N@@H+]1CCCC[C@@H]1CC[NH3+])C1CCC1 ZINC000662272589 412063975 /nfs/dbraw/zinc/06/39/75/412063975.db2.gz GVECBOWEVMPQIZ-ZIAGYGMSSA-N 2 0 240.391 2.005 20 0 BEADRP C1=CCC(C[NH+]2CCC([C@H]3CCC[NH2+]3)CC2)C1 ZINC000662274248 412064822 /nfs/dbraw/zinc/06/48/22/412064822.db2.gz GVAHOBWEJVYXPO-OAHLLOKOSA-N 2 0 234.387 2.417 20 0 BEADRP C[C@H]1CC[N@H+](CCCC2CCC2)C[C@@H]1C[NH3+] ZINC000662280467 412070564 /nfs/dbraw/zinc/07/05/64/412070564.db2.gz FBDDGEJABNCNTD-JSGCOSHPSA-N 2 0 224.392 2.483 20 0 BEADRP C[C@@H]1CC[N@H+](CCCC2CCC2)C[C@H]1C[NH3+] ZINC000662280469 412071097 /nfs/dbraw/zinc/07/10/97/412071097.db2.gz FBDDGEJABNCNTD-TZMCWYRMSA-N 2 0 224.392 2.483 20 0 BEADRP C[NH2+]CCC[N@H+](C)C[C@@H](OC)C1CCCCC1 ZINC000662280343 412071298 /nfs/dbraw/zinc/07/12/98/412071298.db2.gz COGZYOAMPPJVGR-CQSZACIVSA-N 2 0 242.407 2.123 20 0 BEADRP CC[C@H](C)C[NH+]1CCC([NH2+]C(C)C)CC1 ZINC000120207133 171279968 /nfs/dbraw/zinc/27/99/68/171279968.db2.gz JFBZSXOSEOSVQV-LBPRGKRZSA-N 2 0 212.381 2.495 20 0 BEADRP CC[C@H](C)C[NH2+][C@@H]1CC[N@H+](CC)C[C@@H]1C ZINC000309220312 171287385 /nfs/dbraw/zinc/28/73/85/171287385.db2.gz VDABTMBQWNUWGD-RWMBFGLXSA-N 2 0 212.381 2.352 20 0 BEADRP CCCC[N@@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000662295419 412083765 /nfs/dbraw/zinc/08/37/65/412083765.db2.gz REBHKENGRRUFOC-CQSZACIVSA-N 2 0 224.392 2.498 20 0 BEADRP CC[C@H](C)[NH+]1CCC([C@@H]2CCC[NH2+]2)CC1 ZINC000063197444 171318304 /nfs/dbraw/zinc/31/83/04/171318304.db2.gz RNFNZQWYRDDDJC-AAEUAGOBSA-N 2 0 210.365 2.249 20 0 BEADRP FCCC[NH+]1CCC([C@H]2CCC[NH2+]C2)CC1 ZINC000662291540 412082271 /nfs/dbraw/zinc/08/22/71/412082271.db2.gz HWHWDNKBLRQXIL-ZDUSSCGKSA-N 2 0 228.355 2.058 20 0 BEADRP CC[C@H](C)[C@@H]1CCCC[N@@H+]1CCC[NH2+]C ZINC000310032345 171380955 /nfs/dbraw/zinc/38/09/55/171380955.db2.gz RLBATALYANPPQC-STQMWFEESA-N 2 0 212.381 2.497 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+]C[C@H]1CCCN1CC ZINC000238857069 171389495 /nfs/dbraw/zinc/38/94/95/171389495.db2.gz XZUSPJIKFBSHMU-RWMBFGLXSA-N 2 0 212.381 2.495 20 0 BEADRP Cc1ccc2c(c1)C[N@@H+](CC[C@@H]1CC[NH2+]C1)CC2 ZINC000662298806 412086953 /nfs/dbraw/zinc/08/69/53/412086953.db2.gz HEUPCZZYDOUCRB-AWEZNQCLSA-N 2 0 244.382 2.353 20 0 BEADRP [NH3+]CC12CC(C1)C[N@@H+]2CCC1CCCCC1 ZINC000662303393 412088939 /nfs/dbraw/zinc/08/89/39/412088939.db2.gz BUQOUPMGMCOIIH-UHFFFAOYSA-N 2 0 222.376 2.380 20 0 BEADRP CC(C)(C)CCC[N@@H+]1CC2CC1(C[NH3+])C2 ZINC000662305253 412090758 /nfs/dbraw/zinc/09/07/58/412090758.db2.gz GBZYCLPYCVPNAR-UHFFFAOYSA-N 2 0 210.365 2.236 20 0 BEADRP C[NH2+]CCC[N@@H+]1CC[C@H](C2CCCCC2)C1 ZINC000662305976 412091635 /nfs/dbraw/zinc/09/16/35/412091635.db2.gz MKWWHFHNTMQODN-AWEZNQCLSA-N 2 0 224.392 2.498 20 0 BEADRP CCC(CC)CCC[N@H+](C)C[C@@H](C)[NH3+] ZINC000662316146 412097071 /nfs/dbraw/zinc/09/70/71/412097071.db2.gz IYEFCLNDVAXDBA-LLVKDONJSA-N 2 0 200.370 2.482 20 0 BEADRP [NH3+]CCOCC[N@@H+]1CCCC[C@H]1CC1CCC1 ZINC000662319634 412100930 /nfs/dbraw/zinc/10/09/30/412100930.db2.gz PCUIKAMYMORBCW-AWEZNQCLSA-N 2 0 240.391 2.006 20 0 BEADRP CCCCC[C@@H]1CCCC[N@@H+]1CCOCC[NH3+] ZINC000662320846 412101143 /nfs/dbraw/zinc/10/11/43/412101143.db2.gz WXPYMKXYMHGORP-CQSZACIVSA-N 2 0 242.407 2.397 20 0 BEADRP CC[C@@H]1C[C@@H](C)CC[C@@H]1[NH2+][C@H]1CC[NH2+]C1 ZINC000665242740 412177997 /nfs/dbraw/zinc/17/79/97/412177997.db2.gz JCLYVLMQJXVSEH-RNJOBUHISA-N 2 0 210.365 2.153 20 0 BEADRP Cc1ccncc1CC[NH2+][C@H]1CCCCC[C@H]1[NH3+] ZINC000665239018 412180588 /nfs/dbraw/zinc/18/05/88/412180588.db2.gz KGJYFWYXDDQNTO-CABCVRRESA-N 2 0 247.386 2.182 20 0 BEADRP Cc1ccncc1CC[NH2+][C@H](C)CCCC[NH3+] ZINC000665238913 412180714 /nfs/dbraw/zinc/18/07/14/412180714.db2.gz HJAKZXIZEOBSQK-CYBMUJFWSA-N 2 0 235.375 2.040 20 0 BEADRP C[C@]12C[C@H]1CCC[C@H]2[NH2+]CC1([NH3+])CCCC1 ZINC000665246778 412184897 /nfs/dbraw/zinc/18/48/97/412184897.db2.gz NMNGIEIZHKJXRK-UPJWGTAASA-N 2 0 222.376 2.426 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+]CC1([NH3+])CCCC1 ZINC000665246343 412190990 /nfs/dbraw/zinc/19/09/90/412190990.db2.gz CHDHISTVMJKHAY-LLVKDONJSA-N 2 0 222.332 2.072 20 0 BEADRP C[C@@H]([NH2+]CC1([NH3+])CCCC1)[C@H]1CC1(C)C ZINC000665246823 412191781 /nfs/dbraw/zinc/19/17/81/412191781.db2.gz OYYDGTODHTZNOX-GHMZBOCLSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H](C2CC2)C2CCC2)CCCC1 ZINC000665247175 412192939 /nfs/dbraw/zinc/19/29/39/412192939.db2.gz XFUCTNHASCSZDK-CYBMUJFWSA-N 2 0 222.376 2.426 20 0 BEADRP C[C@]1(C[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)CC1(F)F ZINC000665266498 412208953 /nfs/dbraw/zinc/20/89/53/412208953.db2.gz CLMNOPYDIPPOHY-DDHJBXDOSA-N 2 0 244.329 2.009 20 0 BEADRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]CCCC1CCC1 ZINC000665267233 412210185 /nfs/dbraw/zinc/21/01/85/412210185.db2.gz SIAGYZREEKTJTK-CHWSQXEVSA-N 2 0 210.365 2.284 20 0 BEADRP C[C@]1(C[NH2+][C@@H]2CCCCC[C@@H]2[NH3+])CC1(F)F ZINC000665266804 412210271 /nfs/dbraw/zinc/21/02/71/412210271.db2.gz KCAZIQOFVCKVRM-HBNTYKKESA-N 2 0 232.318 2.281 20 0 BEADRP C[C@@]1(C[NH2+]C2CCC(C[NH3+])CC2)CC1(F)F ZINC000665267503 412210605 /nfs/dbraw/zinc/21/06/05/412210605.db2.gz XZTWPQBBXKADKL-ILDUYXDCSA-N 2 0 232.318 2.139 20 0 BEADRP C[C@@H]([NH2+]CC[C@@]1(C)CC1(F)F)[C@H]1CCC[NH2+]1 ZINC000665267284 412210681 /nfs/dbraw/zinc/21/06/81/412210681.db2.gz TXKFEXDWFCFLPH-MXWKQRLJSA-N 2 0 232.318 2.152 20 0 BEADRP C[C@H]([NH2+]CC[C@]1(C)CC1(F)F)[C@@H]1CCC[NH2+]1 ZINC000665267281 412210909 /nfs/dbraw/zinc/21/09/09/412210909.db2.gz TXKFEXDWFCFLPH-GARJFASQSA-N 2 0 232.318 2.152 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]CCCC1CCC1 ZINC000665267235 412210992 /nfs/dbraw/zinc/21/09/92/412210992.db2.gz SIAGYZREEKTJTK-QWHCGFSZSA-N 2 0 210.365 2.284 20 0 BEADRP CC[C@H]([NH2+]CCCC[NH+](C)C)C(C)C ZINC000045664036 171519447 /nfs/dbraw/zinc/51/94/47/171519447.db2.gz TVZLLLKBPUGYMD-LBPRGKRZSA-N 2 0 200.370 2.352 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCCC[C@H]1C[NH3+])c1ccccn1 ZINC000665232386 412170541 /nfs/dbraw/zinc/17/05/41/412170541.db2.gz MBXAMWFBBYHHHM-VNHYZAJKSA-N 2 0 247.386 2.292 20 0 BEADRP C[C@H](C[NH2+][C@@H](C)CCCC[NH3+])c1ccccn1 ZINC000665232022 412170806 /nfs/dbraw/zinc/17/08/06/412170806.db2.gz DPANHXFLQXCWND-OLZOCXBDSA-N 2 0 235.375 2.292 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+][C@@H]2C[C@H]3CC[C@@H]2O3)c2ccccc21 ZINC000422748070 412172691 /nfs/dbraw/zinc/17/26/91/412172691.db2.gz RTYGUKJOYLNZBO-VILKCFAHSA-N 2 0 244.338 2.041 20 0 BEADRP C1=C(C[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)CCC1 ZINC000665274621 412216937 /nfs/dbraw/zinc/21/69/37/412216937.db2.gz UQSJRPKCTZDIIN-HZSPNIEDSA-N 2 0 220.360 2.074 20 0 BEADRP CC1(C)C[C@]1(C)[NH2+]C1CCC(C[NH3+])CC1 ZINC000665275570 412218460 /nfs/dbraw/zinc/21/84/60/412218460.db2.gz MWTRULROYGCNTK-XIVSLSHWSA-N 2 0 210.365 2.282 20 0 BEADRP CC1(C)C[C@]1(C)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000665276054 412219579 /nfs/dbraw/zinc/21/95/79/412219579.db2.gz XOEFDKOVMNPCMZ-LMSJBEHQSA-N 2 0 208.349 2.048 20 0 BEADRP CC[C@H]([NH2+]CC12CC(C1)C[NH2+]2)C1CCCC1 ZINC000665279791 412220665 /nfs/dbraw/zinc/22/06/65/412220665.db2.gz MIQKBPKJISSIBV-QRMWWUJWSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]1CC(C)(C)C[C@@H]1[NH2+]CC12CC(C1)C[NH2+]2 ZINC000665279709 412222710 /nfs/dbraw/zinc/22/27/10/412222710.db2.gz KHYUVWHGHPJYED-JJMZSNKZSA-N 2 0 222.376 2.153 20 0 BEADRP CC[C@H](C)[C@@H](C)[NH2+]CC[C@@H]([NH3+])C(C)C ZINC000665279329 412222873 /nfs/dbraw/zinc/22/28/73/412222873.db2.gz ANAABICCSJWKKR-QJPTWQEYSA-N 2 0 200.370 2.384 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+][C@@H](C)c1cccc(O)c1 ZINC000665280413 412224638 /nfs/dbraw/zinc/22/46/38/412224638.db2.gz AHNLQSPSRMVLEA-SMDDNHRTSA-N 2 0 236.359 2.416 20 0 BEADRP COC[C@@H]([NH2+]CC[C@@H]([NH3+])C(C)C)C1CCCC1 ZINC000665281837 412225324 /nfs/dbraw/zinc/22/53/24/412225324.db2.gz LLPJUFOXDIKTBA-ZIAGYGMSSA-N 2 0 242.407 2.155 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+][C@@H](C)c1cccnc1 ZINC000665281340 412225746 /nfs/dbraw/zinc/22/57/46/412225746.db2.gz ZUCISAGOXFKBNW-WCQYABFASA-N 2 0 221.348 2.106 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+][C@H](C)c1ccoc1 ZINC000665281003 412225758 /nfs/dbraw/zinc/22/57/58/412225758.db2.gz RKMCOOPDLKOLRP-ZYHUDNBSSA-N 2 0 210.321 2.304 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+][C@H](C)c1cncs1 ZINC000665281082 412226516 /nfs/dbraw/zinc/22/65/16/412226516.db2.gz UBIVPBNTRIHXSD-NXEZZACHSA-N 2 0 227.377 2.167 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+][C@H](C)C1CCSCC1 ZINC000665281497 412226666 /nfs/dbraw/zinc/22/66/66/412226666.db2.gz FHILEGOUZKWITE-DGCLKSJQSA-N 2 0 244.448 2.481 20 0 BEADRP COCC[C@@H]1CCC[C@@H]1[NH2+]CC[C@@H]([NH3+])C(C)C ZINC000665282236 412227946 /nfs/dbraw/zinc/22/79/46/412227946.db2.gz UCBTYBHGPSTFQW-MJBXVCDLSA-N 2 0 242.407 2.155 20 0 BEADRP CC(C)[C@H]([NH3+])CCN[C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000665283718 412228787 /nfs/dbraw/zinc/22/87/87/412228787.db2.gz SUFVRJHMSPORKC-QLFBSQMISA-N 2 0 247.386 2.094 20 0 BEADRP CO[C@H](C[NH2+][C@@H](C)C[C@H](C)[NH3+])C1CCCCC1 ZINC000665284040 412229219 /nfs/dbraw/zinc/22/92/19/412229219.db2.gz ZKGQUJILDRGBID-SGMGOOAPSA-N 2 0 242.407 2.297 20 0 BEADRP CC[C@@H]([NH2+]CCCc1ccco1)[C@@H]1CCC[NH2+]1 ZINC000665283991 412230021 /nfs/dbraw/zinc/23/00/21/412230021.db2.gz YLHNSPVLAUIRGY-KGLIPLIRSA-N 2 0 236.359 2.332 20 0 BEADRP CCC[C@H](C)[C@@H](CC)[NH2+][C@H](C)C[NH2+]C ZINC000665296420 412242294 /nfs/dbraw/zinc/24/22/94/412242294.db2.gz SIENRVHIYJYHGP-QJPTWQEYSA-N 2 0 200.370 2.399 20 0 BEADRP C[NH2+]C[C@H](C)[NH2+][C@@H]1CCC[C@H](C(C)C)C1 ZINC000665298545 412246167 /nfs/dbraw/zinc/24/61/67/412246167.db2.gz XWYCVXTXYSQIQP-RWMBFGLXSA-N 2 0 212.381 2.399 20 0 BEADRP CC[C@H]1CC[C@@H]1[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000336741160 171643996 /nfs/dbraw/zinc/64/39/96/171643996.db2.gz QUKSPISXMHRAEQ-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP C[N@H+](CC[C@H]1CCC[NH2+]C1)CC1CCC1 ZINC000061458134 172778494 /nfs/dbraw/zinc/77/84/94/172778494.db2.gz QMUYLBWURVXLMG-GFCCVEGCSA-N 2 0 210.365 2.108 20 0 BEADRP C[N@H+](C[C@H]1CC[NH2+]C1)C1CCCCCC1 ZINC000051889543 172833996 /nfs/dbraw/zinc/83/39/96/172833996.db2.gz FFITTXVYOFQKCB-LBPRGKRZSA-N 2 0 210.365 2.251 20 0 BEADRP C[N@@H+]1CCC[C@@H]1CC[NH+]1CCCC1(C)C ZINC000336556116 173028765 /nfs/dbraw/zinc/02/87/65/173028765.db2.gz HVYUGPAYLYWYTL-GFCCVEGCSA-N 2 0 210.365 2.345 20 0 BEADRP C[N@@H+]1CCC[C@@H]2C[NH+](CCC3CC3)CC[C@@H]21 ZINC000335904937 173037233 /nfs/dbraw/zinc/03/72/33/173037233.db2.gz NYEYWFWAYBDVLA-KGLIPLIRSA-N 2 0 222.376 2.203 20 0 BEADRP C[N@@H+]1CCC[C@@]2(CC[NH+](CC3CCC3)C2)C1 ZINC000336581153 173039735 /nfs/dbraw/zinc/03/97/35/173039735.db2.gz LLYQVGJQMKKXGZ-CQSZACIVSA-N 2 0 222.376 2.204 20 0 BEADRP CN1CCC[C@H]([NH2+]CC2CCCCC2)C1 ZINC000040671787 173046129 /nfs/dbraw/zinc/04/61/29/173046129.db2.gz NYLVQMULNMSLSH-ZDUSSCGKSA-N 2 0 210.365 2.251 20 0 BEADRP C[N@@H+]1CC[C@@]2(CC[NH+](CCC(C)(C)C)C2)C1 ZINC000336280404 173138054 /nfs/dbraw/zinc/13/80/54/173138054.db2.gz CVUIVKFNWLDFAC-CQSZACIVSA-N 2 0 224.392 2.450 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CC(C)(C)C)[C@@H]2CCC[C@@H]21 ZINC000368600183 173152102 /nfs/dbraw/zinc/15/21/02/173152102.db2.gz AYLGWYYKZBCPIR-AVGNSLFASA-N 2 0 224.392 2.495 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CC2(C)CC2)[C@@H]2CCC[C@H]21 ZINC000336770478 173152273 /nfs/dbraw/zinc/15/22/73/173152273.db2.gz SXOQOIXBJNQVTM-RWMBFGLXSA-N 2 0 222.376 2.249 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C[C@@H]2CC2(C)C)[C@H]2CCC[C@@H]21 ZINC000353399064 173152667 /nfs/dbraw/zinc/15/26/67/173152667.db2.gz ANQSOZWLXUWSGI-CRWXNKLISA-N 2 0 236.403 2.495 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CC2(C)CC2)[C@H]2CCC[C@H]21 ZINC000336770477 173152918 /nfs/dbraw/zinc/15/29/18/173152918.db2.gz SXOQOIXBJNQVTM-FRRDWIJNSA-N 2 0 222.376 2.249 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CC2(C)C)[C@@H]2CCC[C@@H]21 ZINC000336726554 173154744 /nfs/dbraw/zinc/15/47/44/173154744.db2.gz CCSCJFYWAXFXHA-ZDEQEGDKSA-N 2 0 222.376 2.247 20 0 BEADRP C[NH2+]C1CC[NH+](C[C@H](C)CC(C)C)CC1 ZINC000300885459 173323055 /nfs/dbraw/zinc/32/30/55/173323055.db2.gz JISAGAPJBAVDGJ-GFCCVEGCSA-N 2 0 212.381 2.352 20 0 BEADRP C[NH2+]CC1CC[NH+](Cc2cccc(F)c2)CC1 ZINC000011889161 173338489 /nfs/dbraw/zinc/33/84/89/173338489.db2.gz HIPTZIXMBVXYFM-UHFFFAOYSA-N 2 0 236.334 2.257 20 0 BEADRP C[NH2+]CC1CC[NH+](Cc2ccc(OC)cc2)CC1 ZINC000011889192 173338586 /nfs/dbraw/zinc/33/85/86/173338586.db2.gz ILZAKISJFFJMJA-UHFFFAOYSA-N 2 0 248.370 2.127 20 0 BEADRP C[NH2+]CCC[N@H+](C)Cc1cccc2cccnc21 ZINC000124782681 173345826 /nfs/dbraw/zinc/34/58/26/173345826.db2.gz HJZYAWNZZVTPJM-UHFFFAOYSA-N 2 0 243.354 2.276 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCC[C@H]1c1cccs1 ZINC000336714962 173347115 /nfs/dbraw/zinc/34/71/15/173347115.db2.gz VCKSKNYTEHSHHA-NSHDSACASA-N 2 0 224.373 2.495 20 0 BEADRP C[NH2+]CCC[NH2+]Cc1cc(C)ccc1C ZINC000083344897 173349164 /nfs/dbraw/zinc/34/91/64/173349164.db2.gz FEOUTZBZSLLEAD-UHFFFAOYSA-N 2 0 206.333 2.003 20 0 BEADRP C[NH2+]CCC[NH2+]Cc1cccc(C)c1C ZINC000083344900 173349821 /nfs/dbraw/zinc/34/98/21/173349821.db2.gz XTXDOJLCTOCJPI-UHFFFAOYSA-N 2 0 206.333 2.003 20 0 BEADRP C[NH2+]C[C@@H]1CCC[N@H+](Cc2ccc(C)s2)C1 ZINC000040591684 173367564 /nfs/dbraw/zinc/36/75/64/173367564.db2.gz HGWQFXDDFBRTCP-LBPRGKRZSA-N 2 0 238.400 2.488 20 0 BEADRP C[NH2+]C[C@@H]1CCC[N@H+](Cc2sccc2C)C1 ZINC000040591982 173368358 /nfs/dbraw/zinc/36/83/58/173368358.db2.gz HJQUDXYRXVLKEL-LBPRGKRZSA-N 2 0 238.400 2.488 20 0 BEADRP C[NH2+]C[C@@H]1CCCN1CCCC(C)(C)C ZINC000300935881 173369066 /nfs/dbraw/zinc/36/90/66/173369066.db2.gz VNLGLEIKGAGLDV-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2C)C1 ZINC000011891897 173370827 /nfs/dbraw/zinc/37/08/27/173370827.db2.gz INFDTSFOQHMDRF-ZDUSSCGKSA-N 2 0 218.344 2.036 20 0 BEADRP C[NH2+]C[C@H]1CCC[N@H+](CC2CCCC2)C1 ZINC000042375124 173379368 /nfs/dbraw/zinc/37/93/68/173379368.db2.gz RYLQTDUYNCVYLE-CYBMUJFWSA-N 2 0 210.365 2.108 20 0 BEADRP C[NH2+]C[C@H]1CC[N@H+](Cc2cc(C)sc2C)C1 ZINC000070798764 173381276 /nfs/dbraw/zinc/38/12/76/173381276.db2.gz MJNQEDSYKDMNMV-GFCCVEGCSA-N 2 0 238.400 2.406 20 0 BEADRP C[NH2+]C[C@H]1CC[N@H+](Cc2c(C)cccc2C)C1 ZINC000130888976 173382114 /nfs/dbraw/zinc/38/21/14/173382114.db2.gz IXLWMDCLZLETNO-CQSZACIVSA-N 2 0 232.371 2.345 20 0 BEADRP COCCC[C@H](C)[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000363546409 174263752 /nfs/dbraw/zinc/26/37/52/174263752.db2.gz RKZOAPLDPKJKKU-BFHYXJOUSA-N 2 0 240.391 2.018 20 0 BEADRP COCC[C@@H](C)[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000045037130 174382317 /nfs/dbraw/zinc/38/23/17/174382317.db2.gz VJFFJVLZLOKXNX-GFCCVEGCSA-N 2 0 242.407 2.264 20 0 BEADRP CC(C)C[NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000053658204 487629620 /nfs/dbraw/zinc/62/96/20/487629620.db2.gz MQCINLQPCDKFQP-CQSZACIVSA-N 2 0 224.392 2.354 20 0 BEADRP COc1ccc(C[N@@H+]2CCCC[C@@H]2CC[NH3+])cc1 ZINC000104314170 175098871 /nfs/dbraw/zinc/09/88/71/175098871.db2.gz DJAUMOVNOBFYDK-CQSZACIVSA-N 2 0 248.370 2.399 20 0 BEADRP COc1ccc(C[NH2+][C@@H](C)CC[NH+](C)C)cc1 ZINC000049551710 175109466 /nfs/dbraw/zinc/10/94/66/175109466.db2.gz AQOOAHLGANCDFP-LBPRGKRZSA-N 2 0 236.359 2.125 20 0 BEADRP COc1ccc(C[NH2+][C@H](C)CC[NH+](C)C)cc1 ZINC000049551712 175110680 /nfs/dbraw/zinc/11/06/80/175110680.db2.gz AQOOAHLGANCDFP-GFCCVEGCSA-N 2 0 236.359 2.125 20 0 BEADRP COc1ccc([C@@H](C)[NH2+][C@@H]2CCC[NH2+]CC2)cc1 ZINC000129301715 175177102 /nfs/dbraw/zinc/17/71/02/175177102.db2.gz FOUYRSURKVHYOR-TZMCWYRMSA-N 2 0 248.370 2.488 20 0 BEADRP COc1ccc([C@@H](C)[NH2+]C[C@@H](C)C[NH3+])cc1F ZINC000310540338 175177288 /nfs/dbraw/zinc/17/72/88/175177288.db2.gz SJWOBOJQRKOYRD-VHSXEESVSA-N 2 0 240.322 2.080 20 0 BEADRP COc1ccc([C@@H](C)[NH2+][C@H]2CCN(C)C2)cc1 ZINC000042544280 175177886 /nfs/dbraw/zinc/17/78/86/175177886.db2.gz RSDWWGYIGVLJDG-YPMHNXCESA-N 2 0 234.343 2.050 20 0 BEADRP COc1cccc(C[N@H+](C)[C@H]2CCC[NH2+]CC2)c1 ZINC000113712681 175255306 /nfs/dbraw/zinc/25/53/06/175255306.db2.gz GWBGTVVFRTUEIP-AWEZNQCLSA-N 2 0 248.370 2.269 20 0 BEADRP COc1cccc(C[NH+]2CCC([C@@H](C)[NH3+])CC2)c1 ZINC000111611467 175256615 /nfs/dbraw/zinc/25/66/15/175256615.db2.gz QGGOTEGWHWNZKS-GFCCVEGCSA-N 2 0 248.370 2.254 20 0 BEADRP COc1cccc(C[N@@H+]2CCC[C@@H]([C@H](C)[NH3+])C2)c1 ZINC000111695788 175259179 /nfs/dbraw/zinc/25/91/79/175259179.db2.gz GUWXPNDUXZQJOC-GXTWGEPZSA-N 2 0 248.370 2.254 20 0 BEADRP COc1cccc([C@H](C)[NH2+][C@H]2CCC[C@H]2C[NH3+])c1 ZINC000148222944 175293577 /nfs/dbraw/zinc/29/35/77/175293577.db2.gz ADQABIYVQWQTQO-WHOFXGATSA-N 2 0 248.370 2.473 20 0 BEADRP COc1ccccc1C[N@@H+]1CCC[C@@H](CC[NH3+])C1 ZINC000070074262 175328111 /nfs/dbraw/zinc/32/81/11/175328111.db2.gz YDHZFMPUQMHEPK-ZDUSSCGKSA-N 2 0 248.370 2.256 20 0 BEADRP COc1ccccc1[C@@H](C)[NH2+][C@H](C)CCC[NH3+] ZINC000310347514 175345764 /nfs/dbraw/zinc/34/57/64/175345764.db2.gz GICWDQSXUGDCNP-VXGBXAGGSA-N 2 0 236.359 2.473 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H](C)CC(F)(F)F ZINC000336703281 175649490 /nfs/dbraw/zinc/64/94/90/175649490.db2.gz ZNQGWMRHZJLTKC-SFYZADRCSA-N 2 0 212.259 2.044 20 0 BEADRP C[C@@H](CCC1CC1)[NH2+]CCCC[NH+](C)C ZINC000336747332 175661581 /nfs/dbraw/zinc/66/15/81/175661581.db2.gz CJBPKYAAUDQDRP-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@H]1CCC[C@H]([NH2+]CC2CC[NH2+]CC2)C1 ZINC000086700454 322931768 /nfs/dbraw/zinc/93/17/68/322931768.db2.gz ZSIYQCDFIOJWDI-AAEUAGOBSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H](c1ccccn1)[N@@H+]1CCC[C@H](CC[NH3+])C1 ZINC000070169588 176027905 /nfs/dbraw/zinc/02/79/05/176027905.db2.gz WWMCKIQIONJJKV-QWHCGFSZSA-N 2 0 233.359 2.203 20 0 BEADRP C[C@@H]1CCCCC[N@@H+]1C[C@]1(C)CC[NH2+]C1 ZINC000069945351 176063637 /nfs/dbraw/zinc/06/36/37/176063637.db2.gz QIMBGJFXRMUIGM-CHWSQXEVSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[N@@H+]1C[C@H]2CCC[NH2+][C@H]2C1 ZINC000346158796 176076984 /nfs/dbraw/zinc/07/69/84/176076984.db2.gz AJRHWVIPXWLCCF-TUVASFSCSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+]CC1CC[NH+](C)CC1 ZINC000044515345 176080690 /nfs/dbraw/zinc/08/06/90/176080690.db2.gz YDMOFCIBMUJTAE-OCCSQVGLSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2CCC[C@@H](C)CC2)CC[NH2+]1 ZINC000235311419 176099234 /nfs/dbraw/zinc/09/92/34/176099234.db2.gz IASXGRNIGYYJPC-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CCC[C@@H](CC[N@@H+]2CC[C@H](C[NH3+])C2)C1 ZINC000070532675 176117011 /nfs/dbraw/zinc/11/70/11/176117011.db2.gz BNYFRJVVAAVKJT-HZSPNIEDSA-N 2 0 224.392 2.483 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCC[C@@H](C)C1)C[NH+](C)C ZINC000336655854 176123150 /nfs/dbraw/zinc/12/31/50/176123150.db2.gz ABWPWNHMHVEWOJ-JHJVBQTASA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H]1CCC[C@H](C[N@H+]2C[C@H]3C[NH+](C)C[C@H]3C2)C1 ZINC000193597350 176137706 /nfs/dbraw/zinc/13/77/06/176137706.db2.gz UNPGWLMRUGPGBO-BARDWOONSA-N 2 0 236.403 2.306 20 0 BEADRP C[C@@H]1CCC[C@H]([NH+]2CCC(C[NH3+])CC2)C1 ZINC000044511953 176140769 /nfs/dbraw/zinc/14/07/69/176140769.db2.gz CONRXVQGEDTUMS-YPMHNXCESA-N 2 0 210.365 2.236 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]C[C@@H]2CCC[NH2+]2)[C@@H]1C ZINC000235302305 176144373 /nfs/dbraw/zinc/14/43/73/176144373.db2.gz DFSJYTCDCBXGBU-NDBYEHHHSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1CCC[C@H]1[NH2+]CC(C)(C)C[NH+](C)C ZINC000083389620 176150057 /nfs/dbraw/zinc/15/00/57/176150057.db2.gz FGSAQLGDUXHPGX-VXGBXAGGSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H]1CC[N@H+](CC[C@H]2CCC[NH+]2C)[C@@H]1C ZINC000245603554 176170464 /nfs/dbraw/zinc/17/04/64/176170464.db2.gz JLVCENIRZQBVIT-JHJVBQTASA-N 2 0 210.365 2.201 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@@H]2CCCC[C@@H]2C[NH3+])C1 ZINC000128480449 176233458 /nfs/dbraw/zinc/23/34/58/176233458.db2.gz OAUJZIDOXZYVBN-FVCCEPFGSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]CCC(C)(F)F ZINC000357719311 176278285 /nfs/dbraw/zinc/27/82/85/176278285.db2.gz ZAPRIVTYXVMETN-GMTAPVOTSA-N 2 0 234.334 2.350 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+][C@@H]1CCC1(C)C ZINC000309218650 176278331 /nfs/dbraw/zinc/27/83/31/176278331.db2.gz PYWUDQVXWOJGAQ-FVCCEPFGSA-N 2 0 224.392 2.493 20 0 BEADRP C[C@@H]1C[N@H+](CCCc2ccccc2)CC[C@@H]1[NH3+] ZINC000049713011 176290070 /nfs/dbraw/zinc/29/00/70/176290070.db2.gz DRNWZLBWEXEPDR-HIFRSBDPSA-N 2 0 232.371 2.288 20 0 BEADRP C[C@@H]1CSC[C@@H]1[NH2+]C1CCC([NH+](C)C)CC1 ZINC000309817773 176352498 /nfs/dbraw/zinc/35/24/98/176352498.db2.gz VQUSSSKAIQDQMC-XVSSEFHLSA-N 2 0 242.432 2.200 20 0 BEADRP C[C@@H]1CSC[C@H]1[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000297611115 176355522 /nfs/dbraw/zinc/35/55/22/176355522.db2.gz VCFGPLKNTMPXFV-ZWNOBZJWSA-N 2 0 247.367 2.175 20 0 BEADRP C[C@@H]1C[C@@H](C[N@@H+]2CCSC(C)(C)C2)CC[NH2+]1 ZINC000235381948 176369465 /nfs/dbraw/zinc/36/94/65/176369465.db2.gz SIMNHEALXOFQPG-NEPJUHHUSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H]1C[C@@H]([NH3+])CC[N@@H+]1CCc1cccs1 ZINC000049712299 176371250 /nfs/dbraw/zinc/37/12/50/176371250.db2.gz DDKJDMUDZFHXEL-MNOVXSKESA-N 2 0 224.373 2.102 20 0 BEADRP C[C@@H]1C[C@@H]([NH3+])CC[N@@H+]1CC1CCCCC1 ZINC000049710733 176371315 /nfs/dbraw/zinc/37/13/15/176371315.db2.gz NFMMOBFVRUZEOH-YPMHNXCESA-N 2 0 210.365 2.378 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CC2CCSCC2)CC[N@@H+]1C ZINC000133658320 176375414 /nfs/dbraw/zinc/37/54/14/176375414.db2.gz HSGPWRDXQASNIR-YPMHNXCESA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+]CC1(C[NH+](C)C)CCCC1 ZINC000336778619 176396252 /nfs/dbraw/zinc/39/62/52/176396252.db2.gz LUUPQNBYTFZQTO-CHWSQXEVSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+][C@H]1CCC[C@H]([NH+](C)C)C1 ZINC000336769808 176397582 /nfs/dbraw/zinc/39/75/82/176397582.db2.gz VWNZRIWJHUFLQP-NDBYEHHHSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCCC[C@H]1C[NH3+])c1ccccn1 ZINC000160812773 176895432 /nfs/dbraw/zinc/89/54/32/176895432.db2.gz DQTGHNJQYARDHW-SGMGOOAPSA-N 2 0 233.359 2.250 20 0 BEADRP C[C@H](c1ccccc1F)[N@@H+]1CC[C@H](C[NH3+])C1 ZINC000049530941 177041984 /nfs/dbraw/zinc/04/19/84/177041984.db2.gz DCZNYNSJWHXWJD-GHMZBOCLSA-N 2 0 222.307 2.167 20 0 BEADRP C[C@H](c1cccnc1)[N@@H+]1CCC[C@@H](CC[NH3+])C1 ZINC000226326739 177044675 /nfs/dbraw/zinc/04/46/75/177044675.db2.gz GDEORWNAMOOVFX-OLZOCXBDSA-N 2 0 233.359 2.203 20 0 BEADRP C[C@H]1CC([NH2+]C[C@@H]2CCC[NH2+]2)C[C@H](C)C1 ZINC000235604999 177065094 /nfs/dbraw/zinc/06/50/94/177065094.db2.gz XMZHASAWCUCKSG-UTUOFQBUSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]1CCCC[N@@H+]1CCC[NH2+]C1CCOCC1 ZINC000036303944 177075544 /nfs/dbraw/zinc/07/55/44/177075544.db2.gz ZASZWSQBCTXXJW-ZDUSSCGKSA-N 2 0 240.391 2.020 20 0 BEADRP C[C@H]1CCCC[C@@H]1C[NH+]1CCC([NH3+])CC1 ZINC000042864221 177080021 /nfs/dbraw/zinc/08/00/21/177080021.db2.gz MSOIOGBQIGFUAE-NWDGAFQWSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@H]1CCC[C@@H](C[N@H+]2C[C@H]3C[NH+](C)C[C@H]3C2)C1 ZINC000193597396 177119318 /nfs/dbraw/zinc/11/93/18/177119318.db2.gz UNPGWLMRUGPGBO-LJISPDSOSA-N 2 0 236.403 2.306 20 0 BEADRP C[C@H]1CCC[C@@H]1[NH2+]CC1([NH3+])CCCCC1 ZINC000334816905 177126101 /nfs/dbraw/zinc/12/61/01/177126101.db2.gz CZIATLSZKGAXGS-RYUDHWBXSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@H]1CCC[C@H]([NH2+]C2CCC([NH3+])CC2)C1 ZINC000051692919 177136311 /nfs/dbraw/zinc/13/63/11/177136311.db2.gz GJVDRBRZSYDSON-WTIISPKJSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@H]1CC[N@H+](Cc2cccc(F)c2)C[C@@H]1C[NH3+] ZINC000163472776 177164965 /nfs/dbraw/zinc/16/49/65/177164965.db2.gz WCKKLOUOPSZFKP-AAEUAGOBSA-N 2 0 236.334 2.242 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+]CCC2CC[NH+](C)CC2)C1 ZINC000122000850 177193154 /nfs/dbraw/zinc/19/31/54/177193154.db2.gz KWFFJIRLPRZMRV-GXTWGEPZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1CC[C@H](C)[N@H+](CC2CC[NH2+]CC2)C1 ZINC000084048134 177198491 /nfs/dbraw/zinc/19/84/91/177198491.db2.gz RNWBTYAMEAKDKT-RYUDHWBXSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1C[C@H](C)C[N@@H+](C[C@@H]2CC[NH2+][C@@H](C)C2)C1 ZINC000235677098 177313072 /nfs/dbraw/zinc/31/30/72/177313072.db2.gz TYIMXBXKLXKSEE-RFQIPJPRSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1C[C@H](C)C[N@@H+](CC[C@@H]2CCCC[NH2+]2)C1 ZINC000026515079 177313572 /nfs/dbraw/zinc/31/35/72/177313572.db2.gz DFIGHHKRSRRDCH-MJBXVCDLSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1CN(C)C[C@H]1[NH2+][C@H]1C[C@H](C)C[C@H](C)C1 ZINC000309783308 177317854 /nfs/dbraw/zinc/31/78/54/177317854.db2.gz NLHWNDFAPVPTEC-MEBFFEOJSA-N 2 0 224.392 2.351 20 0 BEADRP C[C@H]1C[C@@H](C[N@@H+]2CCc3ccccc3C2)CC[NH2+]1 ZINC000235743879 177324515 /nfs/dbraw/zinc/32/45/15/177324515.db2.gz HNOUVSUKFPDUMS-KBPBESRZSA-N 2 0 244.382 2.433 20 0 BEADRP C[C@H]1C[C@@H](N(C)Cc2cccc(O)c2)CC[N@@H+]1C ZINC000093644764 177327925 /nfs/dbraw/zinc/32/79/25/177327925.db2.gz XOWUZAYHCKPZIB-JSGCOSHPSA-N 2 0 248.370 2.307 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CC2(C)CCC2)CC[N@@H+]1C ZINC000181244033 177331177 /nfs/dbraw/zinc/33/11/77/177331177.db2.gz ACEFXFRSGWKDBZ-RYUDHWBXSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@H]1C[C@@H]1C[N@H+](CCC[NH3+])CC1CCCC1 ZINC000352539479 177342213 /nfs/dbraw/zinc/34/22/13/177342213.db2.gz BCUPORVVHDLWTI-GXTWGEPZSA-N 2 0 224.392 2.483 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CC2CC[NH2+]CC2)[C@@H](C)C1 ZINC000226367534 177355895 /nfs/dbraw/zinc/35/58/95/177355895.db2.gz VMBMDUPHVVPXNB-DYEKYZERSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H]1C[C@H](C[NH+]2Cc3ccccc3C2)CC[NH2+]1 ZINC000235697398 177362441 /nfs/dbraw/zinc/36/24/41/177362441.db2.gz CVOGTYIDIURRIJ-QWHCGFSZSA-N 2 0 230.355 2.390 20 0 BEADRP C[C@H]1C[C@H]([NH3+])CC[N@@H+]1CC1CCCCC1 ZINC000049710730 177365123 /nfs/dbraw/zinc/36/51/23/177365123.db2.gz NFMMOBFVRUZEOH-WCQYABFASA-N 2 0 210.365 2.378 20 0 BEADRP C[C@H]1C[C@H]([NH2+]C2CCCCCC2)CC[NH2+]1 ZINC000235734162 177368629 /nfs/dbraw/zinc/36/86/29/177368629.db2.gz NYPFZJFPGKJMLM-WCQYABFASA-N 2 0 210.365 2.439 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CCC(C)(F)F)CC[N@@H+]1C ZINC000357715629 177369761 /nfs/dbraw/zinc/36/97/61/177369761.db2.gz YFXHLOLOXMWKNZ-VHSXEESVSA-N 2 0 220.307 2.104 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+][C@@H]1CCN(C)[C@@H](C)C1 ZINC000361922420 177371201 /nfs/dbraw/zinc/37/12/01/177371201.db2.gz AAVUGKFBMYSNTL-MBNYWOFBSA-N 2 0 236.359 2.283 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+]C/C=C\c1ccncc1 ZINC000486964949 225276763 /nfs/dbraw/zinc/27/67/63/225276763.db2.gz IZEYAURUUHORTE-ZFDPJTLLSA-N 2 0 233.359 2.025 20 0 BEADRP C[C@@H]1C[C@H]1C[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC000488464202 225403636 /nfs/dbraw/zinc/40/36/36/225403636.db2.gz RGNFRHTYQQQAFB-DOMZBBRYSA-N 2 0 232.371 2.494 20 0 BEADRP CSCCCCC[NH2+][C@@H](C)[C@@H]1CCC[NH2+]1 ZINC000400356948 226341305 /nfs/dbraw/zinc/34/13/05/226341305.db2.gz AVXNCUOTIDDBSV-RYUDHWBXSA-N 2 0 230.421 2.250 20 0 BEADRP C[C@H]([NH2+]CCCC(F)(F)F)[C@@H]1CCC[NH2+]1 ZINC000400607299 226347717 /nfs/dbraw/zinc/34/77/17/226347717.db2.gz XUVRAHYPFRJQNL-IUCAKERBSA-N 2 0 224.270 2.059 20 0 BEADRP C[C@H]([NH2+]CCCC(F)(F)F)[C@H]1CCC[NH2+]1 ZINC000400607297 226347770 /nfs/dbraw/zinc/34/77/70/226347770.db2.gz XUVRAHYPFRJQNL-DTWKUNHWSA-N 2 0 224.270 2.059 20 0 BEADRP CC[C@H](C)[N@@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]2)C1 ZINC000225881777 487652534 /nfs/dbraw/zinc/65/25/34/487652534.db2.gz XSRTUPIIARLOOR-XQQFMLRXSA-N 2 0 210.365 2.249 20 0 BEADRP Cc1cccc([C@@H](C)[NH2+]C[C@@H](C)C[NH3+])c1 ZINC000309007998 229298088 /nfs/dbraw/zinc/29/80/88/229298088.db2.gz VKAHROZEMLYNSW-NWDGAFQWSA-N 2 0 206.333 2.240 20 0 BEADRP Cc1[nH+]ccc(N[C@@H](C)C[NH+](C)C)c1Cl ZINC000309082276 229329566 /nfs/dbraw/zinc/32/95/66/229329566.db2.gz RJJFDAUKIUHQAK-QMMMGPOBSA-N 2 0 227.739 2.405 20 0 BEADRP C[C@]1(C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)CCCS1 ZINC000087793238 487687247 /nfs/dbraw/zinc/68/72/47/487687247.db2.gz HHTPGKQKZZHSGK-QJPTWQEYSA-N 2 0 228.405 2.132 20 0 BEADRP CCCN1CC[C@@H]([NH2+]CC(CC)CC)C1 ZINC000328465347 487693211 /nfs/dbraw/zinc/69/32/11/487693211.db2.gz JALCGXQZGFMRMA-CYBMUJFWSA-N 2 0 212.381 2.497 20 0 BEADRP CC[C@@H]1C[C@H](C)C[N@@H+]1CC[C@@H]1CC[NH2+]C1 ZINC000399148420 262776963 /nfs/dbraw/zinc/77/69/63/262776963.db2.gz GCVIQBLCXQRYEQ-RWMBFGLXSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]([NH2+]CC1(C2CC2)CC1)[C@@H]1CCCC[NH2+]1 ZINC000395242248 262784943 /nfs/dbraw/zinc/78/49/43/262784943.db2.gz YZHOSIWCXBQMMU-AAEUAGOBSA-N 2 0 222.376 2.297 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@@H](C2CC2)C2CCC2)C1 ZINC000324824577 262796110 /nfs/dbraw/zinc/79/61/10/262796110.db2.gz SZEVDBNOFIJYAI-MGPQQGTHSA-N 2 0 222.376 2.425 20 0 BEADRP CCC[C@H](C[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1)OCC ZINC000527934695 262896641 /nfs/dbraw/zinc/89/66/41/262896641.db2.gz SZSVQYPRCSWBCR-HZSPNIEDSA-N 2 0 242.407 2.264 20 0 BEADRP CC(C)CSCC[NH2+][C@H](C)CCCC[NH3+] ZINC000397279136 262920694 /nfs/dbraw/zinc/92/06/94/262920694.db2.gz CTORVJNMGOGQIT-GFCCVEGCSA-N 2 0 232.437 2.483 20 0 BEADRP C[C@@H](F)CC[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000902389129 584580376 /nfs/dbraw/zinc/58/03/76/584580376.db2.gz SDFJNGFAGQXRNM-MNOVXSKESA-N 2 0 216.344 2.102 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]C[C@H]1CCC[C@H](C)C1 ZINC000414851160 487709847 /nfs/dbraw/zinc/70/98/47/487709847.db2.gz OQANYDUFWXNJIL-AVGNSLFASA-N 2 0 212.381 2.258 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@H]1CCOC(C)(C)C1 ZINC000226336196 487713652 /nfs/dbraw/zinc/71/36/52/487713652.db2.gz UQHBJLSLGSKABG-ZDUSSCGKSA-N 2 0 242.407 2.264 20 0 BEADRP CCCC[N@@H+]1CCC[C@@H]([C@H]2CCC[NH2+]2)C1 ZINC000249907248 487725769 /nfs/dbraw/zinc/72/57/69/487725769.db2.gz YXOKMQJJFIBUQN-CHWSQXEVSA-N 2 0 210.365 2.251 20 0 BEADRP CC(C)C[N@@H+]1CCC[C@H]([C@H]2CCC[NH2+]2)C1 ZINC000250607517 487735866 /nfs/dbraw/zinc/73/58/66/487735866.db2.gz XHWZSUKNMZALAZ-QWHCGFSZSA-N 2 0 210.365 2.106 20 0 BEADRP CCO[C@H]1C[C@@H]([NH2+]CC[C@@H]([NH3+])C(C)C)C1(C)C ZINC000233780060 487743710 /nfs/dbraw/zinc/74/37/10/487743710.db2.gz MGGQGSVJZRPOFW-UPJWGTAASA-N 2 0 242.407 2.153 20 0 BEADRP CC(C)[C@H]1CCC[N@H+](C[C@H]2CC[NH2+]C2)CC1 ZINC000251384364 487754692 /nfs/dbraw/zinc/75/46/92/487754692.db2.gz ZYULCDFUQHRBAL-KBPBESRZSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H](c1ccccc1)[N@H+](C)C[C@H]1CC[NH2+]C1 ZINC000251593348 487774429 /nfs/dbraw/zinc/77/44/29/487774429.db2.gz YAQVUKXLGVEJBT-STQMWFEESA-N 2 0 218.344 2.289 20 0 BEADRP C[C@@H](C[N@@H+]1CC[C@H]([NH3+])[C@H](C)C1)C(C)(C)C ZINC000251889689 487805944 /nfs/dbraw/zinc/80/59/44/487805944.db2.gz VLHMVHRYGDRJCN-WOPDTQHZSA-N 2 0 212.381 2.338 20 0 BEADRP COc1cccc([C@H]2C[C@@H](C)C[N@@H+]2CCC[NH3+])c1 ZINC000414740204 487820086 /nfs/dbraw/zinc/82/00/86/487820086.db2.gz KTPNDLRVHIOJJB-IUODEOHRSA-N 2 0 248.370 2.427 20 0 BEADRP CCC[C@@H](C)[NH+]1CCN(c2cc[nH+]cc2)CC1 ZINC000681643599 487830019 /nfs/dbraw/zinc/83/00/19/487830019.db2.gz FAWHHJHSPJKBAV-CYBMUJFWSA-N 2 0 233.359 2.392 20 0 BEADRP CCCC[C@@H](CC)CC[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000415036771 487834420 /nfs/dbraw/zinc/83/44/20/487834420.db2.gz MEQYHDNBIDADEE-MQYQWHSLSA-N 2 0 224.392 2.400 20 0 BEADRP CC[C@@H](C)C[NH2+]CCC[NH+]1CCCCC1 ZINC000020128881 590075811 /nfs/dbraw/zinc/07/58/11/590075811.db2.gz NHJOYRPXENCDQY-CYBMUJFWSA-N 2 0 212.381 2.498 20 0 BEADRP Cc1ccc(C[N@@H+](C)C[C@H]2CC[NH2+][C@H](C)C2)nc1 ZINC000666693930 487862047 /nfs/dbraw/zinc/86/20/47/487862047.db2.gz JIUVLWMVVJYQBQ-KGLIPLIRSA-N 2 0 247.386 2.210 20 0 BEADRP C[C@H](CC1CCC1)[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000666853961 487872679 /nfs/dbraw/zinc/87/26/79/487872679.db2.gz UKPMHOYIKAJRCI-WXHSDQCUSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@H](CC1CCC1)[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000666853960 487872737 /nfs/dbraw/zinc/87/27/37/487872737.db2.gz UKPMHOYIKAJRCI-RTXFEEFZSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@@H](CC1CCC1)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000666762248 487874276 /nfs/dbraw/zinc/87/42/76/487874276.db2.gz IIAXRUCEVPELCT-RAQOOLMWSA-N 2 0 222.376 2.438 20 0 BEADRP C[C@H](CC1CCC1)[NH2+][C@H]1CC[NH2+][C@H](C)C1 ZINC000666874202 487875118 /nfs/dbraw/zinc/87/51/18/487875118.db2.gz APOAXRRAYBATEA-WZRBSPASSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@@H](CC1CCC1)[NH2+][C@@H]1CC[NH2+][C@H](C)C1 ZINC000666874201 487875022 /nfs/dbraw/zinc/87/50/22/487875022.db2.gz APOAXRRAYBATEA-NTZNESFSSA-N 2 0 210.365 2.295 20 0 BEADRP [NH3+][C@@H](C[NH2+]Cc1cccc2cnccc21)C1CC1 ZINC000666834235 487887558 /nfs/dbraw/zinc/88/75/58/487887558.db2.gz HZJZFGPBBLFNRI-HNNXBMFYSA-N 2 0 241.338 2.062 20 0 BEADRP Cc1cc(C[NH2+][C@@H]2CC23CC[NH2+]CC3)ccc1F ZINC000666952382 487890169 /nfs/dbraw/zinc/89/01/69/487890169.db2.gz URWSUOQBLFSTID-CQSZACIVSA-N 2 0 248.345 2.366 20 0 BEADRP C[C@H](C[NH2+]C1(C)CC[NH2+]CC1)C(C)(C)C ZINC000666882279 487895285 /nfs/dbraw/zinc/89/52/85/487895285.db2.gz VZQRJFRMJLUQAT-LLVKDONJSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)C1CCC1 ZINC000666993713 487902637 /nfs/dbraw/zinc/90/26/37/487902637.db2.gz GCICGJIIJAOKGT-DGCLKSJQSA-N 2 0 222.376 2.439 20 0 BEADRP c1cc(N2CC[NH+]([C@@H]3C=CCCC3)CC2)cc[nH+]1 ZINC000675500110 487914351 /nfs/dbraw/zinc/91/43/51/487914351.db2.gz YZMXYHGBBOJZPB-CQSZACIVSA-N 2 0 243.354 2.312 20 0 BEADRP Cc1cc(F)ccc1C[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000666952299 487913980 /nfs/dbraw/zinc/91/39/80/487913980.db2.gz PMIWKFZTLVXJCF-CQSZACIVSA-N 2 0 248.345 2.366 20 0 BEADRP CCC(CC)C[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000666952107 487914437 /nfs/dbraw/zinc/91/44/37/487914437.db2.gz GFJAQDQQFPXFBI-LBPRGKRZSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H](CCC1CC1)[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000666953885 487915861 /nfs/dbraw/zinc/91/58/61/487915861.db2.gz KBEGJEBWEKKFKH-DGCLKSJQSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H](CCC1CC1)[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000666953886 487916137 /nfs/dbraw/zinc/91/61/37/487916137.db2.gz KBEGJEBWEKKFKH-WCQYABFASA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000666954053 487916233 /nfs/dbraw/zinc/91/62/33/487916233.db2.gz ONZUDKWXBNDKJD-FRRDWIJNSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]1CCC[N@H+](CC[C@H]2CCCO2)[C@H]1CC[NH3+] ZINC000404296871 487916439 /nfs/dbraw/zinc/91/64/39/487916439.db2.gz OBYNMRCZALQCJE-MCIONIFRSA-N 2 0 240.391 2.005 20 0 BEADRP Cc1cc(N[C@H]2CC[N@@H+](C3CC3)C2)cc[nH+]1 ZINC000229565612 487926422 /nfs/dbraw/zinc/92/64/22/487926422.db2.gz KTVLTKFJAKNMJO-LBPRGKRZSA-N 2 0 217.316 2.039 20 0 BEADRP FC1(F)C[C@]12CC[N@H+](CC[C@@H]1CCC[NH2+]C1)C2 ZINC000652364479 487934026 /nfs/dbraw/zinc/93/40/26/487934026.db2.gz SQAYIKROTAFWTH-RYUDHWBXSA-N 2 0 244.329 2.107 20 0 BEADRP FC1(F)C[C@@]12CC[N@H+](CC[C@@H]1CCC[NH2+]C1)C2 ZINC000652364478 487934148 /nfs/dbraw/zinc/93/41/48/487934148.db2.gz SQAYIKROTAFWTH-NWDGAFQWSA-N 2 0 244.329 2.107 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CCCCN1)C1CCCC1 ZINC000235222932 487936369 /nfs/dbraw/zinc/93/63/69/487936369.db2.gz RELPJFBLZSPPMI-YPMHNXCESA-N 2 0 210.365 2.297 20 0 BEADRP CCc1cc(N[C@@H]2CC[N@@H+](C3CC3)C2)cc[nH+]1 ZINC000307767733 487945072 /nfs/dbraw/zinc/94/50/72/487945072.db2.gz IIHYXTUWSNEOOR-CYBMUJFWSA-N 2 0 231.343 2.293 20 0 BEADRP COCC1(CC[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)CCC1 ZINC000566480834 323000966 /nfs/dbraw/zinc/00/09/66/323000966.db2.gz BBVGCRDWOYDSJY-CHWSQXEVSA-N 2 0 240.391 2.053 20 0 BEADRP [NH3+]Cc1ccc(C[NH2+][C@H]2CC[C@H]2C2CC2)cc1 ZINC000564729927 323011911 /nfs/dbraw/zinc/01/19/11/323011911.db2.gz VYUMOEKDWROAKQ-GJZGRUSLSA-N 2 0 230.355 2.424 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)C2CC2)C1 ZINC000247401206 323012981 /nfs/dbraw/zinc/01/29/81/323012981.db2.gz XHSPPKIHNBZQIZ-NEPJUHHUSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CC[C@@H]2C[C@@H]2C1)[C@H]1CCC[NH2+]1 ZINC000403479366 323030821 /nfs/dbraw/zinc/03/08/21/323030821.db2.gz RGDGSGAFINLVGS-MQLXINIDSA-N 2 0 222.376 2.153 20 0 BEADRP CC[C@H]([NH2+]CCC[NH2+]C(C)C)[C@H]1C[C@H]1C ZINC000562956420 323034885 /nfs/dbraw/zinc/03/48/85/323034885.db2.gz SUMPYHRWEXDVAL-AGIUHOORSA-N 2 0 212.381 2.399 20 0 BEADRP C([NH2+][C@@H]1CCC12CCCC2)C1CC[NH2+]CC1 ZINC000562956402 323034893 /nfs/dbraw/zinc/03/48/93/323034893.db2.gz ZYKDRIUPLPVURY-CYBMUJFWSA-N 2 0 222.376 2.298 20 0 BEADRP Cc1cncc([C@H](C)[NH2+]CC2CC[NH2+]CC2)c1 ZINC000562956060 323034977 /nfs/dbraw/zinc/03/49/77/323034977.db2.gz BJKWXHLGRSQYCC-LBPRGKRZSA-N 2 0 233.359 2.040 20 0 BEADRP CC[C@H]1CCC[C@@H]1[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000562962797 323036722 /nfs/dbraw/zinc/03/67/22/323036722.db2.gz HBOOBOLVEACKFH-XQQFMLRXSA-N 2 0 210.365 2.297 20 0 BEADRP CC(C)(C[NH2+][C@H]1CCC[C@@H]([NH3+])C1)c1ccccn1 ZINC000569825193 323041646 /nfs/dbraw/zinc/04/16/46/323041646.db2.gz NLCVJIVHOLUJLH-OLZOCXBDSA-N 2 0 247.386 2.219 20 0 BEADRP C([NH2+][C@H]1CCC[C@H]2C[C@H]21)[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000408510478 323047134 /nfs/dbraw/zinc/04/71/34/323047134.db2.gz PVMWLGVKMFPXLZ-VIRABCJISA-N 2 0 234.387 2.249 20 0 BEADRP CCC1(C[N@H+](C)CCC[NH+](C)C)CCOCC1 ZINC000570008747 323047404 /nfs/dbraw/zinc/04/74/04/323047404.db2.gz HKBONWAXKUNFCB-UHFFFAOYSA-N 2 0 242.407 2.077 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]CC23CCC(CC2)C3)C1 ZINC000570226586 323053682 /nfs/dbraw/zinc/05/36/82/323053682.db2.gz OBADUXRTNNUTGF-YIFLHPOLSA-N 2 0 222.376 2.426 20 0 BEADRP CC(C)[C@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)C1CC1 ZINC000570562620 323063122 /nfs/dbraw/zinc/06/31/22/323063122.db2.gz HYLGVVWJPCIRHO-KBPBESRZSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]Cc2cnc3n2CCCC3)[C@@H]1C ZINC000570775944 323069838 /nfs/dbraw/zinc/06/98/38/323069838.db2.gz NZASTMZPOYDQIK-WZRBSPASSA-N 2 0 233.359 2.354 20 0 BEADRP C[C@@H]1CC[NH+](CCCC[N@H+]2CC[C@@H](C)C2)C1 ZINC000536541731 323077308 /nfs/dbraw/zinc/07/73/08/323077308.db2.gz QMTQHOFMGVBTGA-ZIAGYGMSSA-N 2 0 224.392 2.450 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@@H]2CC[C@H]3C[C@H]3C2)CC1 ZINC000403872199 323077654 /nfs/dbraw/zinc/07/76/54/323077654.db2.gz ZTHNGPPSGCLWIL-HZSPNIEDSA-N 2 0 236.403 2.497 20 0 BEADRP C(CC1CCCC1)C[NH+]1C[C@@H]2C[NH2+]C[C@H]2C1 ZINC000309588474 323082486 /nfs/dbraw/zinc/08/24/86/323082486.db2.gz XLQHNOFTEHLHMD-KBPBESRZSA-N 2 0 222.376 2.108 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCCC12CCC2)C[NH+](C)C ZINC000394829901 323086055 /nfs/dbraw/zinc/08/60/55/323086055.db2.gz TUVDINLIAAGHMB-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CC[C@@H](C)[C@@H]([NH2+]CCC[NH+](C)C)C1 ZINC000221649150 323090772 /nfs/dbraw/zinc/09/07/72/323090772.db2.gz RGFBZJNRYDIFLW-UPJWGTAASA-N 2 0 212.381 2.352 20 0 BEADRP COc1ccccc1/C=C\C[NH2+][C@H](C)C[C@H](C)[NH3+] ZINC000563135339 323094681 /nfs/dbraw/zinc/09/46/81/323094681.db2.gz JHDYFYLATFTSRJ-SVSNBYFCSA-N 2 0 248.370 2.424 20 0 BEADRP C[C@H]([NH2+]Cc1ccc(C[NH3+])cc1)C1(C)CC1 ZINC000563154332 323095826 /nfs/dbraw/zinc/09/58/26/323095826.db2.gz XAJLLXZSTKIZDA-NSHDSACASA-N 2 0 218.344 2.424 20 0 BEADRP CC(C)[C@H]([NH2+]CC[C@H]1CCC[NH2+]C1)C1CC1 ZINC000571037687 323104356 /nfs/dbraw/zinc/10/43/56/323104356.db2.gz GQDCTTPLKDSUPP-OCCSQVGLSA-N 2 0 224.392 2.400 20 0 BEADRP COC[C@H](C)C[NH2+]CC[NH2+]C1CCCCCC1 ZINC000563430580 323125010 /nfs/dbraw/zinc/12/50/10/323125010.db2.gz BIOSDNGBBUFGKM-CYBMUJFWSA-N 2 0 242.407 2.171 20 0 BEADRP Nc1ccc2c(c1)CC[C@@H]2[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000563430470 323125063 /nfs/dbraw/zinc/12/50/63/323125063.db2.gz CKHSPLSZLODUBH-ZLDLUXBVSA-N 2 0 245.370 2.116 20 0 BEADRP Cn1cncc1CC[NH2+][C@H]1CCc2ccccc21 ZINC000401832017 323127770 /nfs/dbraw/zinc/12/77/70/323127770.db2.gz JWDXVMDNXBIELT-HNNXBMFYSA-N 2 0 241.338 2.240 20 0 BEADRP CC[C@H]([NH2+]CCC[NH2+]C(C)C)C(C)C ZINC000571394855 323143247 /nfs/dbraw/zinc/14/32/47/323143247.db2.gz QNVNAKSUHUZXRC-LBPRGKRZSA-N 2 0 200.370 2.399 20 0 BEADRP C([NH2+][C@H]1CC[C@@H]1C1CCC1)C1CC[NH2+]CC1 ZINC000571514117 323146392 /nfs/dbraw/zinc/14/63/92/323146392.db2.gz FSLPUNSEQAAJFK-KGLIPLIRSA-N 2 0 222.376 2.154 20 0 BEADRP C1CC1C([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)C1CC1 ZINC000571633531 323150123 /nfs/dbraw/zinc/15/01/23/323150123.db2.gz FASYZXHMBZSJMJ-UONOGXRCSA-N 2 0 234.387 2.153 20 0 BEADRP C[C@@H](CCc1ccccc1)C[NH2+]C[C@H]1CC[NH2+]C1 ZINC000414919151 323152026 /nfs/dbraw/zinc/15/20/26/323152026.db2.gz WHGNBPZRXXMOMX-HOCLYGCPSA-N 2 0 246.398 2.454 20 0 BEADRP Cc1ccc(CC[NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)o1 ZINC000531940795 323155939 /nfs/dbraw/zinc/15/59/39/323155939.db2.gz MRBLERYZRSCBKY-YPMHNXCESA-N 2 0 236.359 2.203 20 0 BEADRP COc1ccc(C[N@@H+]2CC[C@H]([C@H](C)[NH3+])C2)cc1C ZINC000252774307 323174476 /nfs/dbraw/zinc/17/44/76/323174476.db2.gz JRARVLLLAJZYFS-JSGCOSHPSA-N 2 0 248.370 2.173 20 0 BEADRP CC[NH+](CC)C[C@H](C[NH3+])c1ccc(OC)cc1 ZINC000041271838 323205913 /nfs/dbraw/zinc/20/59/13/323205913.db2.gz CGRLPUWQEWIFSD-ZDUSSCGKSA-N 2 0 236.359 2.079 20 0 BEADRP CC[C@@H]([NH2+][C@@H]1CC[NH2+]C12CCC2)C1CCC1 ZINC000530213640 323216943 /nfs/dbraw/zinc/21/69/43/323216943.db2.gz BDLUIHJXGPSYNB-CHWSQXEVSA-N 2 0 222.376 2.439 20 0 BEADRP CC1(C)CC[C@H]1[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000530216556 323217166 /nfs/dbraw/zinc/21/71/66/323217166.db2.gz QKUSLLYMSDNORK-MNOVXSKESA-N 2 0 208.349 2.049 20 0 BEADRP C1=CCC(C[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)C1 ZINC000530216529 323217211 /nfs/dbraw/zinc/21/72/11/323217211.db2.gz QBUPHBIZEAAUEM-RBSFLKMASA-N 2 0 234.387 2.463 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@H]2CCCC2(F)F)CC1 ZINC000395755368 323240622 /nfs/dbraw/zinc/24/06/22/323240622.db2.gz GFEYMGKTIINPPW-LLVKDONJSA-N 2 0 246.345 2.496 20 0 BEADRP CC[C@H]([NH2+][C@H](C)CC[NH+](C)C)C1CCOCC1 ZINC000532491506 323269070 /nfs/dbraw/zinc/26/90/70/323269070.db2.gz BSNHVBIHFSELJS-OCCSQVGLSA-N 2 0 242.407 2.121 20 0 BEADRP [NH3+]C1CCC([NH2+][C@@H](C2CC2)C2CCC2)CC1 ZINC000324777315 323281684 /nfs/dbraw/zinc/28/16/84/323281684.db2.gz FPFQYEBOZLJFEM-JXQTWKCFSA-N 2 0 222.376 2.425 20 0 BEADRP C[C@@H]([NH3+])[C@H](C)[NH2+]C(C1CCC1)C1CCC1 ZINC000324774582 323283265 /nfs/dbraw/zinc/28/32/65/323283265.db2.gz DTPWIVULHWLFIP-ZJUUUORDSA-N 2 0 210.365 2.281 20 0 BEADRP C[C@@H]([NH2+]CCC1CC[NH+](C)CC1)[C@H]1C[C@H]1C ZINC000321569507 323385112 /nfs/dbraw/zinc/38/51/12/323385112.db2.gz UPNJEFOVKYHMNZ-BZPMIXESSA-N 2 0 224.392 2.352 20 0 BEADRP CC(C)(C)[C@@H]1CC[C@H]1[NH2+]CC1CC[NH2+]CC1 ZINC000572510483 324136768 /nfs/dbraw/zinc/13/67/68/324136768.db2.gz RNOAEPFUPXNHJG-CHWSQXEVSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H]1CCC[C@H]1[NH2+]Cc1ccc(C[NH3+])cc1 ZINC000572522379 324189110 /nfs/dbraw/zinc/18/91/10/324189110.db2.gz AKUAIKWYEWXDIF-SMDDNHRTSA-N 2 0 218.344 2.424 20 0 BEADRP CCCCC[N@@H+]1C[C@H](C[NH3+])[C@H](C)C[C@@H]1C ZINC000397339382 324213325 /nfs/dbraw/zinc/21/33/25/324213325.db2.gz VBHNJPVWBHBDFS-AGIUHOORSA-N 2 0 212.381 2.482 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)C2CC(F)(F)C2)C1 ZINC000529530151 324325896 /nfs/dbraw/zinc/32/58/96/324325896.db2.gz GHIMTBUHIQLVQC-WDEREUQCSA-N 2 0 246.345 2.352 20 0 BEADRP COCCC1CC[NH+]([C@H](C)CCCC[NH3+])CC1 ZINC000530213737 324529995 /nfs/dbraw/zinc/52/99/95/324529995.db2.gz VYVUFQVEGWJTLJ-CYBMUJFWSA-N 2 0 242.407 2.252 20 0 BEADRP Cc1ncccc1C[NH2+][C@@H](C)C[C@H]1CCC[NH2+]1 ZINC000530243345 324554451 /nfs/dbraw/zinc/55/44/51/324554451.db2.gz HPBUZPFAJKISHS-SMDDNHRTSA-N 2 0 233.359 2.010 20 0 BEADRP C[C@@H](CN(C)C)[NH2+][C@@H]1C[C@H](C)CC[C@@H]1C ZINC000130080311 325010961 /nfs/dbraw/zinc/01/09/61/325010961.db2.gz VDAZLOCDTKUSLT-MROQNXINSA-N 2 0 212.381 2.351 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+]CCCC[NH+](C)C ZINC000132997208 325259394 /nfs/dbraw/zinc/25/93/94/325259394.db2.gz ZQCQPLYNJYSMQL-OLZOCXBDSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)C1CCC1 ZINC000133404563 325293952 /nfs/dbraw/zinc/29/39/52/325293952.db2.gz ZRLRJUMLAAGYPE-RYUDHWBXSA-N 2 0 210.365 2.106 20 0 BEADRP CCSCC[C@H](C)[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000133751729 325316076 /nfs/dbraw/zinc/31/60/76/325316076.db2.gz MNLBAAQZLANUKR-SRVKXCTJSA-N 2 0 230.421 2.378 20 0 BEADRP C[C@@H]1C[C@@H](C)[NH+]1CC[C@H]1CCCC[N@@H+]1C ZINC000547769859 325395110 /nfs/dbraw/zinc/39/51/10/325395110.db2.gz UQGAMNQTQFQKPM-JHJVBQTASA-N 2 0 210.365 2.344 20 0 BEADRP C[NH2+]CCC[NH2+]Cc1ccc(C(F)F)cc1 ZINC000565762681 325952762 /nfs/dbraw/zinc/95/27/62/325952762.db2.gz COKOPVHGRGFSAL-UHFFFAOYSA-N 2 0 228.286 2.323 20 0 BEADRP C[C@H](Cc1ccsc1)[NH2+][C@H]1CC[C@@H](C[NH3+])C1 ZINC000567220630 326142615 /nfs/dbraw/zinc/14/26/15/326142615.db2.gz HHUSJJQLNFUYMQ-WZRBSPASSA-N 2 0 238.400 2.396 20 0 BEADRP CC(C)(C[NH2+][C@@H]1CCC[C@H]1[NH3+])C(F)(F)F ZINC000567226693 326145647 /nfs/dbraw/zinc/14/56/47/326145647.db2.gz JZHWNQDOTWNEHV-HTQZYQBOSA-N 2 0 224.270 2.044 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+][C@H]2CC[C@H]2C2CC2)C1 ZINC000309987667 326177952 /nfs/dbraw/zinc/17/79/52/326177952.db2.gz ZEXSSEKPTANXGG-XBFCOCLRSA-N 2 0 222.376 2.106 20 0 BEADRP CC(C)[C@H]1CCC[C@@H]1[NH2+]CC1CC[NH2+]CC1 ZINC000567639132 326236123 /nfs/dbraw/zinc/23/61/23/326236123.db2.gz YCOZRGHRSHOPAK-KGLIPLIRSA-N 2 0 224.392 2.400 20 0 BEADRP C([NH2+][C@@H]1CCC[C@H]1C1CC1)C1CC[NH2+]CC1 ZINC000567639024 326236168 /nfs/dbraw/zinc/23/61/68/326236168.db2.gz JPPGVHBYNPNLPK-UONOGXRCSA-N 2 0 222.376 2.154 20 0 BEADRP C[NH+](CCCC[N@@H+](C)CC1CC1)CC1CC1 ZINC000157599971 326285790 /nfs/dbraw/zinc/28/57/90/326285790.db2.gz FRBGMJQZXSKKAX-UHFFFAOYSA-N 2 0 224.392 2.450 20 0 BEADRP CC(C)[C@@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)C1CC1 ZINC000158250876 326313007 /nfs/dbraw/zinc/31/30/07/326313007.db2.gz DXKZCFSBKURKSH-TZMCWYRMSA-N 2 0 224.392 2.352 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]CCC[C@@H]2CCCCO2)C1 ZINC000568249012 326334697 /nfs/dbraw/zinc/33/46/97/326334697.db2.gz DTCFWNNMAMNELH-MCIONIFRSA-N 2 0 240.391 2.195 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CCc1ccc(F)c(F)c1 ZINC000568618330 326367653 /nfs/dbraw/zinc/36/76/53/326367653.db2.gz HBILANYQQHDPDJ-SNVBAGLBSA-N 2 0 242.313 2.224 20 0 BEADRP CC[NH2+]CCC[NH2+]C1C[C@H](C)C[C@@H](C)C1 ZINC000568617078 326367691 /nfs/dbraw/zinc/36/76/91/326367691.db2.gz BDBWUSZJBPOXGS-VXGBXAGGSA-N 2 0 212.381 2.400 20 0 BEADRP CC(C)C(C)(C)[NH2+]C[C@H]1CC[NH2+][C@H](C)C1 ZINC000568727300 326373541 /nfs/dbraw/zinc/37/35/41/326373541.db2.gz RXXVXAXWZYYCAX-NEPJUHHUSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@@H]([NH2+]CC1(C)CC[NH2+]CC1)c1ccoc1 ZINC000569093172 326389246 /nfs/dbraw/zinc/38/92/46/326389246.db2.gz ASFBPTBJJIKJBA-LLVKDONJSA-N 2 0 222.332 2.320 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H]1CCC[C@H]1CCCF ZINC000569211338 326395134 /nfs/dbraw/zinc/39/51/34/326395134.db2.gz FDZVDUUDFMIDON-QWHCGFSZSA-N 2 0 230.371 2.494 20 0 BEADRP CC[C@H]1C[C@@H](C[N@H+](C)CCC[NH+](C)C)CCO1 ZINC000569290962 326398935 /nfs/dbraw/zinc/39/89/35/326398935.db2.gz OEGNOKNKBPXYDT-KBPBESRZSA-N 2 0 242.407 2.075 20 0 BEADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@@H](CC)C(C)C ZINC000166017016 326427615 /nfs/dbraw/zinc/42/76/15/326427615.db2.gz YQDGLPSQOUULMJ-KGLIPLIRSA-N 2 0 244.423 2.367 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@H]2CCc3c2cccc3O)C1 ZINC000573107550 326430140 /nfs/dbraw/zinc/43/01/40/326430140.db2.gz XRUMUZVHYPKKKG-SUNKGSAMSA-N 2 0 246.354 2.239 20 0 BEADRP C1=C(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)CCC1 ZINC000401027256 488000307 /nfs/dbraw/zinc/00/03/07/488000307.db2.gz KOZRYILJPMTYTG-ZIAGYGMSSA-N 2 0 220.360 2.313 20 0 BEADRP [NH3+]CC[C@H]1CCC[N@H+](CC2CC=CC2)C1 ZINC000238562560 488007285 /nfs/dbraw/zinc/00/72/85/488007285.db2.gz IKEHDXSQHSBQMJ-CYBMUJFWSA-N 2 0 208.349 2.013 20 0 BEADRP CCC[N@H+](CC(C)C)C[C@H](O)C[NH+](C)C(C)C ZINC000310437650 488023343 /nfs/dbraw/zinc/02/33/43/488023343.db2.gz UZBDBGQYMKXCLN-CQSZACIVSA-N 2 0 244.423 2.056 20 0 BEADRP CC[C@H]1CCC[N@@H+]1Cc1cnc2n1CCC2 ZINC000667545126 488041308 /nfs/dbraw/zinc/04/13/08/488041308.db2.gz YCDMJJGIEOAJFM-NSHDSACASA-N 2 0 219.332 2.204 20 0 BEADRP C[N@@H+]1CC[C@H](NCc2ccccn2)CC1(C)C ZINC000084519280 488057027 /nfs/dbraw/zinc/05/70/27/488057027.db2.gz FXNAWHPZCGDJFC-LBPRGKRZSA-N 2 0 233.359 2.044 20 0 BEADRP COC[C@H](CC(C)(C)C)[NH2+][C@H](C)C[C@H](C)[NH3+] ZINC000656200849 488066905 /nfs/dbraw/zinc/06/69/05/488066905.db2.gz GKAGVWFMSIVVSP-TUAOUCFPSA-N 2 0 230.396 2.153 20 0 BEADRP Cc1ncc(C[N@@H+]2CCC3(CCC3)C2)n1C ZINC000667644277 488067683 /nfs/dbraw/zinc/06/76/83/488067683.db2.gz CKVSEWOCFZEHAW-UHFFFAOYSA-N 2 0 219.332 2.105 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCC[C@H]([NH3+])C1)CC(F)F ZINC000656200901 488067900 /nfs/dbraw/zinc/06/79/00/488067900.db2.gz YGSXIKLLANMCQM-GUBZILKMSA-N 2 0 220.307 2.137 20 0 BEADRP c1csc(C[N@@H+]2CC[C@@]3(C2)CCC[NH2+]C3)c1 ZINC000257699611 488082470 /nfs/dbraw/zinc/08/24/70/488082470.db2.gz PSFVQROPKBHESG-ZDUSSCGKSA-N 2 0 236.384 2.324 20 0 BEADRP Cc1ccnc(CN(C)C[C@@H]2CCC[N@H+](C)C2)c1 ZINC000683010003 488089808 /nfs/dbraw/zinc/08/98/08/488089808.db2.gz BEOOTMXSNPJAFD-CQSZACIVSA-N 2 0 247.386 2.164 20 0 BEADRP Cc1ccnc(CN(C)[C@H]2CC[N@H+](C)[C@@H](C)C2)c1 ZINC000683010619 488090658 /nfs/dbraw/zinc/09/06/58/488090658.db2.gz CIFDNNGOQCENOW-ZFWWWQNUSA-N 2 0 247.386 2.305 20 0 BEADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+][C@H]2CCC[C@@H]3C[C@@H]32)C1 ZINC000378960181 488114169 /nfs/dbraw/zinc/11/41/69/488114169.db2.gz POGJRQPEEFMITM-XGUBFFRZSA-N 2 0 236.403 2.495 20 0 BEADRP CC[NH+](CC)CCC[N@H+](CC)C[C@H]1CCOC1 ZINC000683140699 488117624 /nfs/dbraw/zinc/11/76/24/488117624.db2.gz BQUCLAXTIKJGIF-CQSZACIVSA-N 2 0 242.407 2.077 20 0 BEADRP [NH3+]C[C@]12CCC[C@H]1C[N@H+](C[C@@H]1CC[C@H]3C[C@H]3C1)C2 ZINC000403519770 488125212 /nfs/dbraw/zinc/12/52/12/488125212.db2.gz KQDUDFIGLPHXTF-LEOABGAYSA-N 2 0 248.414 2.483 20 0 BEADRP C[C@@H]1C[C@H](C[NH3+])C[N@@H+]1C[C@@H]1CC[C@H]2C[C@H]2C1 ZINC000403587555 488127261 /nfs/dbraw/zinc/12/72/61/488127261.db2.gz DEYRIVUXDOZATR-XGFWRYKXSA-N 2 0 222.376 2.092 20 0 BEADRP c1cc(C2CC2)ccc1C[NH+]1C[C@H]2C[NH2+]C[C@@H]2C1 ZINC000094522265 487538520 /nfs/dbraw/zinc/53/85/20/487538520.db2.gz AGCJSMGVIZUXAH-HZPDHXFCSA-N 2 0 242.366 2.215 20 0 BEADRP C[N@H+](CCC(C)(C)C)CC1CC[NH2+]CC1 ZINC000086701759 487533219 /nfs/dbraw/zinc/53/32/19/487533219.db2.gz FWTNCHUPFRZDJH-UHFFFAOYSA-N 2 0 212.381 2.354 20 0 BEADRP Cc1ccc(C[NH2+][C@@H](C)C2CC[NH+](C)CC2)cn1 ZINC000062051201 487491450 /nfs/dbraw/zinc/49/14/50/487491450.db2.gz CVGLUVAPWRVHPC-ZDUSSCGKSA-N 2 0 247.386 2.210 20 0 BEADRP CC(C)(CC[N@@H+]1CC[C@](C)(C[NH3+])C1)C1CC1 ZINC000406064256 487498937 /nfs/dbraw/zinc/49/89/37/487498937.db2.gz NWTVQUHVRJONAJ-CQSZACIVSA-N 2 0 224.392 2.483 20 0 BEADRP Cc1ccc(CCC[NH+]2C[C@@H]3C[NH2+]C[C@H]3C2)cc1 ZINC000680046160 487525959 /nfs/dbraw/zinc/52/59/59/487525959.db2.gz RFPZQYMALJDDBD-HOTGVXAUSA-N 2 0 244.382 2.079 20 0 BEADRP C[C@@H](c1ccncc1)[N@H+](C)CC(C)(C)C[NH3+] ZINC000086637509 487523500 /nfs/dbraw/zinc/52/35/00/487523500.db2.gz CEXSMVLFFDEUHB-NSHDSACASA-N 2 0 221.348 2.059 20 0 BEADRP C([C@@H]1C[C@H]2C[C@H]2C1)[NH+]1CCC([C@@H]2CC[NH2+]C2)CC1 ZINC000662274626 487523853 /nfs/dbraw/zinc/52/38/53/487523853.db2.gz YBRYQLOFMZGWGX-DMRZNYOFSA-N 2 0 248.414 2.354 20 0 BEADRP Cc1ccc(CCC[NH+]2C[C@H]3C[NH2+]C[C@@H]3C2)cc1 ZINC000680046167 487526505 /nfs/dbraw/zinc/52/65/05/487526505.db2.gz RFPZQYMALJDDBD-HZPDHXFCSA-N 2 0 244.382 2.079 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]C[C@H]2Cc3ccccc32)C1 ZINC000250853003 487742196 /nfs/dbraw/zinc/74/21/96/487742196.db2.gz NDLQVFLMAHWMFA-MCIONIFRSA-N 2 0 230.355 2.186 20 0 BEADRP CCc1ccc(C[N@H+](C)C[C@@H]2CC[NH2+]C2)cc1 ZINC000258795543 488136123 /nfs/dbraw/zinc/13/61/23/488136123.db2.gz CLKWJFXCOBBGDO-OAHLLOKOSA-N 2 0 232.371 2.290 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]1[NH2+]C[C@@H]1CC[C@H]2C[C@H]2C1 ZINC000403789059 488138220 /nfs/dbraw/zinc/13/82/20/488138220.db2.gz ALMOREGQKFLGSC-RQJABVFESA-N 2 0 236.403 2.400 20 0 BEADRP Cc1ccc(CC[NH2+][C@H]2CCC[C@@H]2[NH3+])cc1C ZINC000258852619 488139175 /nfs/dbraw/zinc/13/91/75/488139175.db2.gz FEWCIMOYSDFQQW-GJZGRUSLSA-N 2 0 232.371 2.315 20 0 BEADRP FC1(F)CCCN(CCC2CC[NH2+]CC2)C1 ZINC000259487047 488175706 /nfs/dbraw/zinc/17/57/06/488175706.db2.gz MXEXQXOTDQTLOG-UHFFFAOYSA-N 2 0 232.318 2.107 20 0 BEADRP CC(C)=CCC[C@@H](C)[NH2+]CCOCC[NH+](C)C ZINC000683692504 488207925 /nfs/dbraw/zinc/20/79/25/488207925.db2.gz RVILNVMUNCPZDJ-CQSZACIVSA-N 2 0 242.407 2.289 20 0 BEADRP CC(C)[C@@H]([NH3+])CC[N@H+](C)CCC1CCC1 ZINC000398612561 488220532 /nfs/dbraw/zinc/22/05/32/488220532.db2.gz AUBGHZQWBKBMIS-ZDUSSCGKSA-N 2 0 212.381 2.482 20 0 BEADRP CC[NH2+]CC1CC[NH+](CCC2CCC2)CC1 ZINC000398671941 488222437 /nfs/dbraw/zinc/22/24/37/488222437.db2.gz SLDDEWKRFQBTQN-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP CO[C@H](C)[C@@H](C)[NH2+]C1CCC(C[NH+](C)C)CC1 ZINC000678604017 488270316 /nfs/dbraw/zinc/27/03/16/488270316.db2.gz VLDYBNZAOYULOZ-IWMBGFJWSA-N 2 0 242.407 2.120 20 0 BEADRP CCC1([NH2+][C@@H]2CCN(C)[C@@H](C)C2)CCOCC1 ZINC000679152025 488313590 /nfs/dbraw/zinc/31/35/90/488313590.db2.gz XPBSZAUGHZZREQ-QWHCGFSZSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@H]([NH2+]CC1(C(F)F)CC1)C1CC[NH+](C)CC1 ZINC000684559575 488327366 /nfs/dbraw/zinc/32/73/66/488327366.db2.gz ISHFIXTZZOFWFU-JTQLQIEISA-N 2 0 246.345 2.352 20 0 BEADRP C[N@@H+](Cc1ccc(O)cc1)C[C@@H]1CCC[NH+](C)C1 ZINC000679396060 488350724 /nfs/dbraw/zinc/35/07/24/488350724.db2.gz NWAFWGCBCLJTRV-CQSZACIVSA-N 2 0 248.370 2.166 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+]CCCc1ccco1 ZINC000665283126 490096269 /nfs/dbraw/zinc/09/62/69/490096269.db2.gz HUBXCCCFQVXQMK-TZMCWYRMSA-N 2 0 236.359 2.319 20 0 BEADRP C[C@@H](Cc1cccs1)[NH2+]CCC[NH+](C)C ZINC000122116078 490125762 /nfs/dbraw/zinc/12/57/62/490125762.db2.gz KQFCQAYXNFCITH-NSHDSACASA-N 2 0 226.389 2.220 20 0 BEADRP C[C@]1(C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)CCCS1 ZINC000227390379 490145137 /nfs/dbraw/zinc/14/51/37/490145137.db2.gz HHTPGKQKZZHSGK-IJLUTSLNSA-N 2 0 228.405 2.132 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H]1CCC[C@H](OC)C1 ZINC000070325871 490207568 /nfs/dbraw/zinc/20/75/68/490207568.db2.gz JNHZTKZBHGWEIA-KBPBESRZSA-N 2 0 242.407 2.266 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H]1CCC[C@H](OC)C1 ZINC000070325870 490207597 /nfs/dbraw/zinc/20/75/97/490207597.db2.gz JNHZTKZBHGWEIA-KGLIPLIRSA-N 2 0 242.407 2.266 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H]1CCCOC1 ZINC000070463762 490214423 /nfs/dbraw/zinc/21/44/23/490214423.db2.gz NEONYGKSAVMAML-UONOGXRCSA-N 2 0 242.407 2.266 20 0 BEADRP CSc1ccc([C@@H](C)[NH2+]CC2C[NH2+]C2)cc1 ZINC000423304664 490219150 /nfs/dbraw/zinc/21/91/50/490219150.db2.gz OPMRLYBWMRPBHX-SNVBAGLBSA-N 2 0 236.384 2.279 20 0 BEADRP COc1ccc(C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)c(C)c1 ZINC000577887121 490221063 /nfs/dbraw/zinc/22/10/63/490221063.db2.gz FIDLLDYWYHAFMA-UONOGXRCSA-N 2 0 248.370 2.363 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]CC[C@H]2CCCO2)c2ccccc21 ZINC000252789417 490267713 /nfs/dbraw/zinc/26/77/13/490267713.db2.gz RMIQFRCFJJALNI-DFBGVHRSSA-N 2 0 246.354 2.290 20 0 BEADRP C[C@@H]1SCC[C@@H]1[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000300333416 490557166 /nfs/dbraw/zinc/55/71/66/490557166.db2.gz MJFNSLXGICIUJR-CYDGBPFRSA-N 2 0 240.416 2.097 20 0 BEADRP C[C@@]1(C[NH3+])CC[N@H+](C[C@@H]2CCC(F)(F)C2)C1 ZINC000300802352 490569010 /nfs/dbraw/zinc/56/90/10/490569010.db2.gz DCTPNDQNNGXZQK-MNOVXSKESA-N 2 0 232.318 2.093 20 0 BEADRP c1ccc2c(c1)CC[C@H]2[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000128895545 490593428 /nfs/dbraw/zinc/59/34/28/490593428.db2.gz NAURYGMRUPFCLB-UKRRQHHQSA-N 2 0 230.355 2.406 20 0 BEADRP Cc1cc(C)c(C[NH+]2C[C@H]3C[NH2+]C[C@@H]3C2)cc1C ZINC000220219971 490593510 /nfs/dbraw/zinc/59/35/10/490593510.db2.gz ITDJZKBRJUMDDF-HZPDHXFCSA-N 2 0 244.382 2.263 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCCS1)C1CC[NH+](C)CC1 ZINC000087667952 491091251 /nfs/dbraw/zinc/09/12/51/491091251.db2.gz WLVOMAXEKYGJFA-WCQYABFASA-N 2 0 242.432 2.202 20 0 BEADRP CC[C@H]([NH2+]C[C@H](C)C[NH3+])c1cccs1 ZINC000336696526 491106436 /nfs/dbraw/zinc/10/64/36/491106436.db2.gz UCBJPOOVPVOYBP-ZJUUUORDSA-N 2 0 212.362 2.384 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]CCCc1ccco1 ZINC000665282901 491107830 /nfs/dbraw/zinc/10/78/30/491107830.db2.gz DORVYRBLNKTLGN-OCCSQVGLSA-N 2 0 236.359 2.190 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+]CCCc1ccco1 ZINC000665282899 491107965 /nfs/dbraw/zinc/10/79/65/491107965.db2.gz DORVYRBLNKTLGN-GXTWGEPZSA-N 2 0 236.359 2.190 20 0 BEADRP CCC[NH2+]CC[NH2+][C@@H]1CC[C@@H](C)C[C@@H]1C ZINC000414862854 491111415 /nfs/dbraw/zinc/11/14/15/491111415.db2.gz BCFVMNUQTCHANT-FRRDWIJNSA-N 2 0 212.381 2.400 20 0 BEADRP CCC[NH2+]CC[NH2+][C@@H]1CC[C@H](C)C[C@H]1C ZINC000414862857 491111421 /nfs/dbraw/zinc/11/14/21/491111421.db2.gz BCFVMNUQTCHANT-YNEHKIRRSA-N 2 0 212.381 2.400 20 0 BEADRP Cc1ccncc1[C@H](C)NC[C@H](C)C[NH+](C)C ZINC000293659101 491114300 /nfs/dbraw/zinc/11/43/00/491114300.db2.gz LUIHTCRZTMCQIS-AAEUAGOBSA-N 2 0 235.375 2.238 20 0 BEADRP CC1=CCC[C@H](C)[C@@H]1C[N@H+](C)CC1CN(C)C1 ZINC000668538698 491127269 /nfs/dbraw/zinc/12/72/69/491127269.db2.gz AJAZHAXIQWLOSX-DZGCQCFKSA-N 2 0 236.403 2.472 20 0 BEADRP C[C@H]([NH2+]CCOC(C)(C)C)C1CC[NH+](C)CC1 ZINC000308727738 491137901 /nfs/dbraw/zinc/13/79/01/491137901.db2.gz HMSOJBIFHCDJAB-LBPRGKRZSA-N 2 0 242.407 2.121 20 0 BEADRP CSC[C@@H]1CCC[N@@H+]1C[C@@H]1CC[NH2+][C@@H](C)C1 ZINC000400115408 533748815 /nfs/dbraw/zinc/74/88/15/533748815.db2.gz JDWCSERQAQQCNM-XQQFMLRXSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@H]([NH2+]CC1CCCCC1)[C@@H]1CCC[NH2+]1 ZINC000400635435 533838577 /nfs/dbraw/zinc/83/85/77/533838577.db2.gz MREBKPCYLHAFFX-AAEUAGOBSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]([NH2+]CCC1CCCC1)[C@H]1CCC[NH2+]1 ZINC000400668831 533843322 /nfs/dbraw/zinc/84/33/22/533843322.db2.gz UBUZJGIKZCGJPH-WCQYABFASA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCCCS1)[C@H]1CCC[NH2+]1 ZINC000400399360 533880714 /nfs/dbraw/zinc/88/07/14/533880714.db2.gz PJEGXYYHGNLUOP-SDDRHHMPSA-N 2 0 228.405 2.002 20 0 BEADRP CCC[C@H](C)C[N@@H+]1CCC[C@@H]([C@@H](C)[NH3+])C1 ZINC000224886273 535610845 /nfs/dbraw/zinc/61/08/45/535610845.db2.gz GXYFGUWHCPGMAY-YNEHKIRRSA-N 2 0 212.381 2.482 20 0 BEADRP CC[C@@H]1CCC[C@H]([NH2+]CCOCC[NH+](C)C)C1 ZINC000226744864 535821981 /nfs/dbraw/zinc/82/19/81/535821981.db2.gz RTPJOXBCXXWEAZ-KGLIPLIRSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)(C)C[N@@H+]1C[C@@H]2CCC[C@H]([NH3+])[C@@H]2C1 ZINC000164370261 534606110 /nfs/dbraw/zinc/60/61/10/534606110.db2.gz WWFMSKPLNWUSJC-TUAOUCFPSA-N 2 0 210.365 2.092 20 0 BEADRP C(=C\c1ccncc1)\C[NH2+]CCC[NH+]1CCCC1 ZINC000486980729 527472538 /nfs/dbraw/zinc/47/25/38/527472538.db2.gz OKPDILKALMZDJI-HYXAFXHYSA-N 2 0 245.370 2.170 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH+](C)C[C@@H]2C[C@H]2C)C[C@H]1C ZINC000488302148 527832764 /nfs/dbraw/zinc/83/27/64/527832764.db2.gz SEQJWIANPMUGFG-MQYQWHSLSA-N 2 0 224.392 2.447 20 0 BEADRP CC(C)C[C@H](C)[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000401044807 528475692 /nfs/dbraw/zinc/47/56/92/528475692.db2.gz LNSHHZCVCIVQIA-XDQVBPFNSA-N 2 0 224.392 2.399 20 0 BEADRP CC(C)C[C@H](C)[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000401044801 528475900 /nfs/dbraw/zinc/47/59/00/528475900.db2.gz LNSHHZCVCIVQIA-REWJHTLYSA-N 2 0 224.392 2.399 20 0 BEADRP CCC(C)(C)OCC[NH2+][C@@H]1CC[N@H+](C)C[C@H]1C ZINC000308715879 528592858 /nfs/dbraw/zinc/59/28/58/528592858.db2.gz BDQPBCKLVUCEBI-CHWSQXEVSA-N 2 0 242.407 2.121 20 0 BEADRP CC(C)[C@H]([NH3+])CC[N@H+](C)C[C@@H]1CCSC1 ZINC000224622099 535063082 /nfs/dbraw/zinc/06/30/82/535063082.db2.gz NAULQEGMBFCWCL-NWDGAFQWSA-N 2 0 230.421 2.045 20 0 BEADRP CC(C)(C)[C@@H]1CC[N@H+](CC2CC[NH2+]CC2)C1 ZINC000166228809 535081792 /nfs/dbraw/zinc/08/17/92/535081792.db2.gz ADAYUTWVZOMBQV-CYBMUJFWSA-N 2 0 224.392 2.354 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]C2CC(C)C2)CC1 ZINC000163878894 535161230 /nfs/dbraw/zinc/16/12/30/535161230.db2.gz MXLRJEUCJIKGKT-UHFFFAOYSA-N 2 0 210.365 2.247 20 0 BEADRP CCC[NH2+][C@@H]1CC[N@H+](CCCOCC)C[C@H]1C ZINC000250639922 535186186 /nfs/dbraw/zinc/18/61/86/535186186.db2.gz SSLVMFMCBUQXMV-ZIAGYGMSSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)[C@](C)(O)C[NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000261569438 535285974 /nfs/dbraw/zinc/28/59/74/535285974.db2.gz JUHMPSMLHJAUNA-QLFBSQMISA-N 2 0 248.370 2.128 20 0 BEADRP CC[NH2+]CC1CC[NH+](Cc2cccnc2C)CC1 ZINC000261557381 535459685 /nfs/dbraw/zinc/45/96/85/535459685.db2.gz COSPEUBXZSVZHK-UHFFFAOYSA-N 2 0 247.386 2.212 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H]1CCCOC1 ZINC000070463761 535522167 /nfs/dbraw/zinc/52/21/67/535522167.db2.gz NEONYGKSAVMAML-ZIAGYGMSSA-N 2 0 242.407 2.266 20 0 BEADRP CC[C@@H](C)C[NH2+]CC1CCC(C[NH3+])CC1 ZINC000086478838 535523690 /nfs/dbraw/zinc/52/36/90/535523690.db2.gz QULVLTCGCGLZED-PNESKVBLSA-N 2 0 212.381 2.387 20 0 BEADRP CCOCC[N@H+](CC)CC[C@@H]1CCCC[NH+]1C ZINC000351602220 535585727 /nfs/dbraw/zinc/58/57/27/535585727.db2.gz XYOIGIMTBGMTAA-AWEZNQCLSA-N 2 0 242.407 2.219 20 0 BEADRP CC[NH+](CC)C[C@H]1CC[N@H+](CC[C@H](C)F)C1 ZINC000352003397 535597405 /nfs/dbraw/zinc/59/74/05/535597405.db2.gz LUVWPEWJXQQIMA-QWHCGFSZSA-N 2 0 230.371 2.398 20 0 BEADRP CCS[C@H]1CCCC[N@H+](CC(C)(C)[NH3+])C1 ZINC000261548641 535724559 /nfs/dbraw/zinc/72/45/59/535724559.db2.gz NSKKUGNIQROTIS-NSHDSACASA-N 2 0 230.421 2.331 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]C2CC(C)(F)C2)[C@@H](C)C1 ZINC000335373323 535768601 /nfs/dbraw/zinc/76/86/01/535768601.db2.gz HXQCGKVKYSFLMR-QCXCNERSSA-N 2 0 228.355 2.197 20 0 BEADRP CC[C@@H](Cc1ccccc1)[N@H+](C)CCC[NH3+] ZINC000227741962 535773392 /nfs/dbraw/zinc/77/33/92/535773392.db2.gz UUTKJNGQGLJZHU-AWEZNQCLSA-N 2 0 220.360 2.288 20 0 BEADRP CC[N@@H+]1C[C@H](C)N(c2cc[nH+]c(C)c2)C[C@@H]1C ZINC000357701763 535781155 /nfs/dbraw/zinc/78/11/55/535781155.db2.gz XNDFOTDPSARFNU-STQMWFEESA-N 2 0 233.359 2.309 20 0 BEADRP C[NH+](C)CCCC[NH2+]Cc1ncc(Cl)s1 ZINC000225332448 535831744 /nfs/dbraw/zinc/83/17/44/535831744.db2.gz DKPLKGKITYBROS-UHFFFAOYSA-N 2 0 247.795 2.228 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@H]1CCC(C)(C)C1 ZINC000087771579 535832263 /nfs/dbraw/zinc/83/22/63/535832263.db2.gz MOSFSWGOHBVOEW-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP CCc1ccccc1C[N@@H+]1CC[C@]2(CC[NH2+]C2)C1 ZINC000261576257 535936486 /nfs/dbraw/zinc/93/64/86/535936486.db2.gz NOIFIPZENKZOOT-INIZCTEOSA-N 2 0 244.382 2.434 20 0 BEADRP CCc1ccccc1C[N@@H+]1C[C@@H]2CC[C@@H]([NH3+])[C@@H]2C1 ZINC000261565578 535936815 /nfs/dbraw/zinc/93/68/15/535936815.db2.gz HSZXYQZIMWVNBK-ARFHVFGLSA-N 2 0 244.382 2.418 20 0 BEADRP CCc1ccc(C[N@@H+]2CC[C@@H]([C@H](C)[NH3+])C2)cc1 ZINC000252788803 536178404 /nfs/dbraw/zinc/17/84/04/536178404.db2.gz XINJRGVYNJBMMG-SWLSCSKDSA-N 2 0 232.371 2.418 20 0 BEADRP CCCSC[C@@H](C)[NH2+]C[C@H]1CC[N@H+](CC)C1 ZINC000892612542 582929166 /nfs/dbraw/zinc/92/91/66/582929166.db2.gz ARTMWRMCVYPGGB-CHWSQXEVSA-N 2 0 244.448 2.450 20 0 BEADRP COc1cc(C[N@H+](C)C2CC[NH2+]CC2)ccc1C ZINC000261654157 536745535 /nfs/dbraw/zinc/74/55/35/536745535.db2.gz BFOLSFRIUCCGSG-UHFFFAOYSA-N 2 0 248.370 2.187 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCC2(C)C)C1 ZINC000389388655 537995017 /nfs/dbraw/zinc/99/50/17/537995017.db2.gz UOQFGUXMWOHZBJ-VXGBXAGGSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H](CC[N@H+](C)CC1CC1)[NH+](C)CC1CC1 ZINC000431598240 566365056 /nfs/dbraw/zinc/36/50/56/566365056.db2.gz BSZUXGCKQJFZJG-LBPRGKRZSA-N 2 0 224.392 2.449 20 0 BEADRP C[C@@H]1CC[C@H]1[NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000853240263 588728229 /nfs/dbraw/zinc/72/82/29/588728229.db2.gz OFXGKLOJWMOKPI-VHDGCEQUSA-N 2 0 236.403 2.497 20 0 BEADRP CCC(N)=[NH+]OC[C@@H]1CCCC[N@@H+]1C(C)C ZINC000853656122 588752875 /nfs/dbraw/zinc/75/28/75/588752875.db2.gz JCFYYBOCSGMTHE-NSHDSACASA-N 2 0 227.352 2.158 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@H]1C[C@@H](O)c2ccccc21 ZINC000854229223 588780956 /nfs/dbraw/zinc/78/09/56/588780956.db2.gz IIFYLJAKMIEOJG-BYCMXARLSA-N 2 0 248.370 2.272 20 0 BEADRP C[C@@H]1CCC[N@H+](CC2CC[NH+](C)CC2)CC1 ZINC000891820863 582726813 /nfs/dbraw/zinc/72/68/13/582726813.db2.gz CEJJCORMFZRZRM-CYBMUJFWSA-N 2 0 224.392 2.450 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2CCC3(CCC3)C2)CC1 ZINC000892055850 582778014 /nfs/dbraw/zinc/77/80/14/582778014.db2.gz MKLFDNHPEHMBEL-UHFFFAOYSA-N 2 0 222.376 2.204 20 0 BEADRP C[C@@H]1CC[N@H+](CC2CC[NH+](C)CC2)C[C@H]1C ZINC000892066933 582783569 /nfs/dbraw/zinc/78/35/69/582783569.db2.gz ZRLYIJGNCUPQJM-CHWSQXEVSA-N 2 0 224.392 2.306 20 0 BEADRP C[C@@H]1C[C@H](C)[N@H+](CC2CC[NH+](C)CC2)C1 ZINC000892105236 582792740 /nfs/dbraw/zinc/79/27/40/582792740.db2.gz XSWFJTQSIBHGRP-NEPJUHHUSA-N 2 0 210.365 2.059 20 0 BEADRP C(C[NH+]1C[C@@H]2C[NH2+]C[C@H]2C1)C1CCCCCC1 ZINC000394611658 582998298 /nfs/dbraw/zinc/99/82/98/582998298.db2.gz HZTJQJSNBCGMRO-GJZGRUSLSA-N 2 0 236.403 2.498 20 0 BEADRP CCCSC[C@H](C)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000892946696 583015025 /nfs/dbraw/zinc/01/50/25/583015025.db2.gz KTVTYQGNBKVFRE-STQMWFEESA-N 2 0 244.448 2.450 20 0 BEADRP CCCSC[C@@H](C)[NH2+]CC1=CC[N@H+](C)CC1 ZINC000893302027 583094584 /nfs/dbraw/zinc/09/45/84/583094584.db2.gz BVXODUKZXUBPNY-GFCCVEGCSA-N 2 0 242.432 2.370 20 0 BEADRP CCCSC[C@H](C)[NH2+]CC1=CC[N@H+](C)CC1 ZINC000893302028 583094825 /nfs/dbraw/zinc/09/48/25/583094825.db2.gz BVXODUKZXUBPNY-LBPRGKRZSA-N 2 0 242.432 2.370 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCCC1(F)F)C1CC[NH+](C)CC1 ZINC000398040140 583118218 /nfs/dbraw/zinc/11/82/18/583118218.db2.gz RNPONMQWCNOUPF-PWSUYJOCSA-N 2 0 246.345 2.494 20 0 BEADRP C[C@@H]1[C@H](C)C[N@H+](CC2CC[NH+](C)CC2)[C@H]1C ZINC000894959559 583559278 /nfs/dbraw/zinc/55/92/78/583559278.db2.gz YIRCEFYWDLFQIZ-UPJWGTAASA-N 2 0 224.392 2.305 20 0 BEADRP C[C@H]([NH2+]CCCC[N@H+](C)C1CC1)c1cnccn1 ZINC000894968897 583560436 /nfs/dbraw/zinc/56/04/36/583560436.db2.gz ZMGDRDMMKXIBBU-LBPRGKRZSA-N 2 0 248.374 2.002 20 0 BEADRP CCCSC[C@H](C)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000895205629 583625613 /nfs/dbraw/zinc/62/56/13/583625613.db2.gz RBZVLTWDECYVPC-RWMBFGLXSA-N 2 0 244.448 2.448 20 0 BEADRP Cc1ccc(CCC[NH2+]CC[C@@H](C)[NH+](C)C)cn1 ZINC000895292974 583639210 /nfs/dbraw/zinc/63/92/10/583639210.db2.gz FBPNIUYUSDTLOE-CQSZACIVSA-N 2 0 249.402 2.252 20 0 BEADRP CCC1(C[NH2+]CC[C@H](C)[NH+](C)C)CCOCC1 ZINC000895296189 583640878 /nfs/dbraw/zinc/64/08/78/583640878.db2.gz ABASPLXUSLKIIL-ZDUSSCGKSA-N 2 0 242.407 2.123 20 0 BEADRP CCCSC[C@H](C)[NH2+]CC[C@H](C)[NH+](C)C ZINC000895429952 583669041 /nfs/dbraw/zinc/66/90/41/583669041.db2.gz ZRLLWVJPOORITN-RYUDHWBXSA-N 2 0 232.437 2.448 20 0 BEADRP C[C@@H]1C[N@H+](CC2(C)CC2)CCN1c1cc[nH+]cc1 ZINC000895556307 583690616 /nfs/dbraw/zinc/69/06/16/583690616.db2.gz HBNGOHXVYDBMDH-CYBMUJFWSA-N 2 0 245.370 2.392 20 0 BEADRP C[N@@H+]1CC[C@H]1CNc1ccnc2ccsc21 ZINC000895770017 583724082 /nfs/dbraw/zinc/72/40/82/583724082.db2.gz YGHIGRYUFGYRHO-VIFPVBQESA-N 2 0 233.340 2.412 20 0 BEADRP C[N@@H+]1CC[C@@H]1CNc1ccnc2ccsc21 ZINC000895769994 583724225 /nfs/dbraw/zinc/72/42/25/583724225.db2.gz YGHIGRYUFGYRHO-SECBINFHSA-N 2 0 233.340 2.412 20 0 BEADRP C[C@H]1[C@@H]([NH2+]CC2Cc3ccccc3C2)CCN1C ZINC000896555564 583811599 /nfs/dbraw/zinc/81/15/99/583811599.db2.gz OPRMNVFOZGQDSW-LRDDRELGSA-N 2 0 244.382 2.084 20 0 BEADRP C[C@@H]1[C@H]([NH2+]CC2Cc3ccccc3C2)CCN1C ZINC000896555565 583811813 /nfs/dbraw/zinc/81/18/13/583811813.db2.gz OPRMNVFOZGQDSW-MLGOLLRUSA-N 2 0 244.382 2.084 20 0 BEADRP CCc1cc(N2C[C@@H]3C[N@H+](C)C[C@]3(C)C2)cc[nH+]1 ZINC000896913595 583854013 /nfs/dbraw/zinc/85/40/13/583854013.db2.gz USUXEYSPJNVOEL-SWLSCSKDSA-N 2 0 245.370 2.032 20 0 BEADRP COc1ccc([C@@H](C)[NH2+][C@@H]2CCN(C)C2)c(C)c1 ZINC000840721719 583920623 /nfs/dbraw/zinc/92/06/23/583920623.db2.gz WFBVPVUEXIQMLW-CHWSQXEVSA-N 2 0 248.370 2.358 20 0 BEADRP F[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000865697165 584027083 /nfs/dbraw/zinc/02/70/83/584027083.db2.gz UKOXHEIBSBABER-DGAVXFQQSA-N 2 0 240.366 2.484 20 0 BEADRP C[NH+]1CCC(C[NH+]2CC(Cc3ccoc3)C2)CC1 ZINC000898159759 584087613 /nfs/dbraw/zinc/08/76/13/584087613.db2.gz GJKZDMHZZPDKHX-UHFFFAOYSA-N 2 0 248.370 2.096 20 0 BEADRP Cc1ncccc1CC[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000898251640 584100435 /nfs/dbraw/zinc/10/04/35/584100435.db2.gz GPYPNBCTTCQVPS-WFASDCNBSA-N 2 0 247.386 2.005 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1ccc(Cl)nc1 ZINC000873256271 584128229 /nfs/dbraw/zinc/12/82/29/584128229.db2.gz MHMHAQMWKXDVAG-QXEWZRGKSA-N 2 0 239.750 2.123 20 0 BEADRP [NH3+]Cc1cc(C2=C[C@H]3CC[C@@H](C2)[NH2+]3)cs1 ZINC000899327448 584197819 /nfs/dbraw/zinc/19/78/19/584197819.db2.gz AAIPHVLTVQHPPM-MNOVXSKESA-N 2 0 220.341 2.115 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]([NH2+]C[C@H]2CCCS2)C1 ZINC000902346751 584559111 /nfs/dbraw/zinc/55/91/11/584559111.db2.gz POHNMBZDMAGIIX-VXGBXAGGSA-N 2 0 242.432 2.250 20 0 BEADRP CSCCCC[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000902331972 584563019 /nfs/dbraw/zinc/56/30/19/584563019.db2.gz XQUHYPTULVPWTL-LBPRGKRZSA-N 2 0 244.448 2.497 20 0 BEADRP CSC(C)(C)C[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000902333516 584563884 /nfs/dbraw/zinc/56/38/84/584563884.db2.gz KEOMRDOUELHPIW-NSHDSACASA-N 2 0 244.448 2.496 20 0 BEADRP Cc1occc1C[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000902364996 584573460 /nfs/dbraw/zinc/57/34/60/584573460.db2.gz WCEGWKQNNQHTOK-ZDUSSCGKSA-N 2 0 236.359 2.456 20 0 BEADRP CC/C=C/C[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000902387424 584579025 /nfs/dbraw/zinc/57/90/25/584579025.db2.gz KSKOEYCUFALQLT-BTDICHCPSA-N 2 0 210.365 2.320 20 0 BEADRP CCC1([NH2+][C@H]2CC[NH2+]CC(C)(C)C2)CC1 ZINC000902386493 584579202 /nfs/dbraw/zinc/57/92/02/584579202.db2.gz FGEBPNYWQJLASO-NSHDSACASA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CC[NH2+]CC(C)(C)C2)CS1 ZINC000902391306 584582109 /nfs/dbraw/zinc/58/21/09/584582109.db2.gz VBJCSHVWDRJPSI-IJLUTSLNSA-N 2 0 242.432 2.248 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]([NH2+]CCc2ccoc2)C1 ZINC000902401035 584587329 /nfs/dbraw/zinc/58/73/29/584587329.db2.gz ZUVAUBHRXONKRO-ZDUSSCGKSA-N 2 0 236.359 2.190 20 0 BEADRP CC(C)[C@H]1CCC[C@@H]([NH2+]CC2([NH3+])CC2)C1 ZINC000902403812 584588081 /nfs/dbraw/zinc/58/80/81/584588081.db2.gz BNYFXYBUIJBJIZ-NWDGAFQWSA-N 2 0 210.365 2.282 20 0 BEADRP COc1ccc([C@@H](C)[NH2+]C2CC[NH2+]CC2)cc1C ZINC000902403520 584588381 /nfs/dbraw/zinc/58/83/81/584588381.db2.gz IBZNNGCXGFEDHQ-GFCCVEGCSA-N 2 0 248.370 2.406 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]([NH2+]C[C@H]2C=CCC2)C1 ZINC000902404610 584588729 /nfs/dbraw/zinc/58/87/29/584588729.db2.gz XJIOEFFVEWRTKA-QWHCGFSZSA-N 2 0 222.376 2.320 20 0 BEADRP [NH3+]C1(C[NH2+][C@H]2CCC[C@@H](C3CC3)C2)CC1 ZINC000902416909 584591160 /nfs/dbraw/zinc/59/11/60/584591160.db2.gz PFWZOANCDIMTIP-NEPJUHHUSA-N 2 0 208.349 2.036 20 0 BEADRP [NH3+]C1(C[NH2+][C@H]2CCC[C@H](C3CC3)C2)CC1 ZINC000902416914 584591205 /nfs/dbraw/zinc/59/12/05/584591205.db2.gz PFWZOANCDIMTIP-RYUDHWBXSA-N 2 0 208.349 2.036 20 0 BEADRP CC[C@H](Cc1cccs1)[NH2+]CC1([NH3+])CC1 ZINC000902418212 584591934 /nfs/dbraw/zinc/59/19/34/584591934.db2.gz WKPNBJRXABQDKB-SNVBAGLBSA-N 2 0 224.373 2.150 20 0 BEADRP CC1(C)CC[C@H](CC[NH2+][C@@H]2CCC[C@@H]2[NH3+])OC1 ZINC000902428302 584594287 /nfs/dbraw/zinc/59/42/87/584594287.db2.gz BKSLGMOXTKRTIF-FRRDWIJNSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CC[C@@H]1CCCC[C@@H]1O ZINC000902430742 584594900 /nfs/dbraw/zinc/59/49/00/584594900.db2.gz DIIXXYGESMUAOF-IHRRRGAJSA-N 2 0 242.407 2.035 20 0 BEADRP CC(C)(C[NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32)C1CC1 ZINC000902430883 584595074 /nfs/dbraw/zinc/59/50/74/584595074.db2.gz JKBTUYYQNRZWRY-GOCOPAARSA-N 2 0 234.387 2.009 20 0 BEADRP CC(C)(C[NH2+][C@@H]1CCC[C@H]1C[NH3+])C1CC1 ZINC000902432800 584595344 /nfs/dbraw/zinc/59/53/44/584595344.db2.gz PZGBYRIPPIXPBP-CMPLNLGQSA-N 2 0 210.365 2.140 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CC(C)(C)C1CCOCC1 ZINC000902432231 584595578 /nfs/dbraw/zinc/59/55/78/584595578.db2.gz ORGBKWRYIMIRCR-RYUDHWBXSA-N 2 0 242.407 2.155 20 0 BEADRP CC(C)(C[NH2+][C@H]1C[C@H]([NH3+])C12CCC2)C1CC1 ZINC000902432844 584595658 /nfs/dbraw/zinc/59/56/58/584595658.db2.gz QWKPDVLUYXPUGA-RYUDHWBXSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[NH2+]CC1(C)C)C1CCSCC1 ZINC000902443170 584598130 /nfs/dbraw/zinc/59/81/30/584598130.db2.gz KJHZLFMXRUKFJZ-CMPLNLGQSA-N 2 0 242.432 2.106 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+][C@H]1C[NH2+]CC1(C)C ZINC000902444140 584598410 /nfs/dbraw/zinc/59/84/10/584598410.db2.gz MRBBCGGXUQAUJK-SRVKXCTJSA-N 2 0 210.365 2.009 20 0 BEADRP CC1(C)CC[C@@H]([NH2+][C@@H]2C[NH2+]CC2(C)C)C1 ZINC000902443923 584598447 /nfs/dbraw/zinc/59/84/47/584598447.db2.gz MOMUUDFVONAMHK-GHMZBOCLSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H](CC(C)(C)C)[NH2+][C@@H]1C[NH2+]CC1(C)C ZINC000902444236 584598516 /nfs/dbraw/zinc/59/85/16/584598516.db2.gz MWOZPMFXSNJPBF-GHMZBOCLSA-N 2 0 212.381 2.399 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H]2CCC[C@H]2c2ccccc2)CC1 ZINC000902413751 584599429 /nfs/dbraw/zinc/59/94/29/584599429.db2.gz OFYFNUJXEWAACK-UONOGXRCSA-N 2 0 230.355 2.404 20 0 BEADRP CCC[C@@H](Cc1ccccc1)[NH2+]CC1([NH3+])CC1 ZINC000902414048 584600041 /nfs/dbraw/zinc/60/00/41/584600041.db2.gz RCAUWJAHEWMYBF-AWEZNQCLSA-N 2 0 232.371 2.479 20 0 BEADRP CCCCC[C@H](C)[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902473032 584601285 /nfs/dbraw/zinc/60/12/85/584601285.db2.gz OROLMYWPDORAHG-QNWHQSFQSA-N 2 0 210.365 2.438 20 0 BEADRP CC(C)CC[C@H](C)[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902472525 584601312 /nfs/dbraw/zinc/60/13/12/584601312.db2.gz CJBRGNSRAWUFLU-QNWHQSFQSA-N 2 0 210.365 2.294 20 0 BEADRP CC(C)[C@H]1CCC[C@H]1[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902474144 584602145 /nfs/dbraw/zinc/60/21/45/584602145.db2.gz CWNZDDBPJWBSJM-XGFWRYKXSA-N 2 0 222.376 2.294 20 0 BEADRP C[C@@H](CC1CCCC1)[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902478939 584603219 /nfs/dbraw/zinc/60/32/19/584603219.db2.gz ZAIFDBNFCMJPHW-AHLTXXRQSA-N 2 0 222.376 2.438 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+][C@H]1CCCC2(CC2)C1 ZINC000902450018 584606146 /nfs/dbraw/zinc/60/61/46/584606146.db2.gz BRDOTKFJUQAGMJ-QJPTWQEYSA-N 2 0 208.349 2.179 20 0 BEADRP CC(C)[C@@H]([NH2+][C@@H]1C[NH2+]CC1(C)C)C1CC1 ZINC000902450515 584606756 /nfs/dbraw/zinc/60/67/56/584606756.db2.gz SSWIOJVZMAXVNK-VXGBXAGGSA-N 2 0 210.365 2.009 20 0 BEADRP CC(C)[C@H]([NH2+][C@H]1C[NH2+]CC1(C)C)C1CC1 ZINC000902450514 584607010 /nfs/dbraw/zinc/60/70/10/584607010.db2.gz SSWIOJVZMAXVNK-RYUDHWBXSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1C[C@@H]2CCC[C@H]12 ZINC000902453495 584607902 /nfs/dbraw/zinc/60/79/02/584607902.db2.gz DGCOOBHLDACQBB-MROQNXINSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+][C@@H]1C[C@H]2CCC[C@H]21 ZINC000902453430 584607983 /nfs/dbraw/zinc/60/79/83/584607983.db2.gz CSPDCHMYUKJEPR-XGFWRYKXSA-N 2 0 222.376 2.425 20 0 BEADRP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)S2)[C@H]1CCC[NH2+]1 ZINC000902455697 584609469 /nfs/dbraw/zinc/60/94/69/584609469.db2.gz YIVBMHNFYYSJEE-JVGWCMFKSA-N 2 0 240.416 2.143 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CCC(F)(F)C1)C1C[NH2+]C1 ZINC000902457580 584610389 /nfs/dbraw/zinc/61/03/89/584610389.db2.gz UWXWUVWIWKWNPF-NXEZZACHSA-N 2 0 232.318 2.009 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+][C@@H]1C[C@H]2CCC[C@@H]21 ZINC000902458636 584610854 /nfs/dbraw/zinc/61/08/54/584610854.db2.gz WWWFSEWJTOXJDG-PEBLQZBPSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]C[C@H]1CCCC(C)(C)O1 ZINC000902460616 584611733 /nfs/dbraw/zinc/61/17/33/584611733.db2.gz HPNKGIDBBAMUSG-SDDRHHMPSA-N 2 0 228.380 2.050 20 0 BEADRP CCCC[C@@H](CC)[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902465298 584612799 /nfs/dbraw/zinc/61/27/99/584612799.db2.gz FELSKFYJAMIZST-YVECIDJPSA-N 2 0 210.365 2.438 20 0 BEADRP C[C@@H]1CC(C)(C)C[C@@H]1[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902465092 584613372 /nfs/dbraw/zinc/61/33/72/584613372.db2.gz DCLJUSHROQSXBY-MLGHIDQZSA-N 2 0 222.376 2.294 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902465100 584613441 /nfs/dbraw/zinc/61/34/41/584613441.db2.gz DCOLUERKJUKOKH-UTINFBMNSA-N 2 0 236.281 2.200 20 0 BEADRP CC1(C)CC[C@@H]([NH2+][C@@H]2C[C@@H]3CC[C@H]2[NH2+]3)C1 ZINC000902468165 584614548 /nfs/dbraw/zinc/61/45/48/584614548.db2.gz MARUIGRLMZNOEO-IRCOFANPSA-N 2 0 208.349 2.048 20 0 BEADRP C1CC2(C1)CCC[C@H]2[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902468278 584614633 /nfs/dbraw/zinc/61/46/33/584614633.db2.gz SWNKBHHGQFPTLM-YVECIDJPSA-N 2 0 220.360 2.192 20 0 BEADRP CCC[C@@H]([NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2)C1CCC1 ZINC000902467596 584614746 /nfs/dbraw/zinc/61/47/46/584614746.db2.gz PKBYRSZUNPZSRB-YIYPIFLZSA-N 2 0 222.376 2.438 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@@H]([NH2+][C@@H]2C[C@H]3CC[C@@H]2[NH2+]3)C1 ZINC000902469164 584615318 /nfs/dbraw/zinc/61/53/18/584615318.db2.gz YLNXSWLIRCAFNO-QTJJRWQNSA-N 2 0 222.376 2.294 20 0 BEADRP C1CC([C@@H]2CC[C@H]2[NH2+][C@@H]2C[C@@H]3CC[C@H]2[NH2+]3)C1 ZINC000902469074 584615519 /nfs/dbraw/zinc/61/55/19/584615519.db2.gz OYORRMAFKJNXQV-ODXJTPSBSA-N 2 0 220.360 2.048 20 0 BEADRP C1CC([C@@H]2CC[C@@H]2[NH2+][C@@H]2C[C@@H]3CC[C@H]2[NH2+]3)C1 ZINC000902469075 584615621 /nfs/dbraw/zinc/61/56/21/584615621.db2.gz OYORRMAFKJNXQV-QSLWVIQJSA-N 2 0 220.360 2.048 20 0 BEADRP C1CC([C@H]2CC[C@H]2[NH2+][C@@H]2C[C@@H]3CC[C@H]2[NH2+]3)C1 ZINC000902469076 584615834 /nfs/dbraw/zinc/61/58/34/584615834.db2.gz OYORRMAFKJNXQV-RYMFRWLXSA-N 2 0 220.360 2.048 20 0 BEADRP CC[C@H]1CCCC[C@@H]1[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902470483 584616241 /nfs/dbraw/zinc/61/62/41/584616241.db2.gz YOVOAPNUAKDCFW-QSLWVIQJSA-N 2 0 222.376 2.438 20 0 BEADRP CC1(C)CCCC[C@@H]1[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902471225 584616271 /nfs/dbraw/zinc/61/62/71/584616271.db2.gz KKBQYARTPWIILZ-LOWDOPEQSA-N 2 0 222.376 2.438 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@@H]2C[C@@H]3CC[C@H]2[NH2+]3)C[C@H]1C ZINC000902470450 584616441 /nfs/dbraw/zinc/61/64/41/584616441.db2.gz XTIBGRPLYHGERE-UYYXNEDZSA-N 2 0 222.376 2.294 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+][C@@H]2C[C@@H]3CC[C@H]2[NH2+]3)[C@@H](C)C1 ZINC000902470487 584616525 /nfs/dbraw/zinc/61/65/25/584616525.db2.gz YOXYJNCGPKQTEZ-GSZZWUTPSA-N 2 0 222.376 2.294 20 0 BEADRP CC[C@@H]([NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2)C1CCCC1 ZINC000902470276 584616784 /nfs/dbraw/zinc/61/67/84/584616784.db2.gz VWLLOAITOWCRTP-REWJHTLYSA-N 2 0 222.376 2.438 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@@H]2C[C@@H]3CC[C@H]2[NH2+]3)C[C@@H]1C ZINC000902470448 584616955 /nfs/dbraw/zinc/61/69/55/584616955.db2.gz XTIBGRPLYHGERE-BBMNEWJDSA-N 2 0 222.376 2.294 20 0 BEADRP C[C@@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1ccc(F)cc1 ZINC000902490520 584618240 /nfs/dbraw/zinc/61/82/40/584618240.db2.gz VZAVINSYTWFTIA-GIPNMCIBSA-N 2 0 222.307 2.214 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+][C@H]2CCCc3ccccc32)C1 ZINC000902490960 584618269 /nfs/dbraw/zinc/61/82/69/584618269.db2.gz ZHYCZNVMXQQSBO-WHOFXGATSA-N 2 0 230.355 2.391 20 0 BEADRP C[C@@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1ccccc1N(C)C ZINC000902490866 584618450 /nfs/dbraw/zinc/61/84/50/584618450.db2.gz VMTLSVVWOZJGRI-JHJVBQTASA-N 2 0 247.386 2.141 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC=CC[C@H]1C)[C@@H]1CCC[NH2+]1 ZINC000902506166 584622250 /nfs/dbraw/zinc/62/22/50/584622250.db2.gz XFMDFHJWTGEGNC-LPWJVIDDSA-N 2 0 208.349 2.071 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]C[C@H]1CCCCC[NH2+]1 ZINC000902481181 584623120 /nfs/dbraw/zinc/62/31/20/584623120.db2.gz ARFCHFJSKMKHKR-UPJWGTAASA-N 2 0 210.365 2.297 20 0 BEADRP C([NH2+][C@H]1CC[C@@H]1C1CC1)[C@@H]1CCCCC[NH2+]1 ZINC000902482163 584623911 /nfs/dbraw/zinc/62/39/11/584623911.db2.gz JXOJHVBPPAJUKS-MJBXVCDLSA-N 2 0 222.376 2.297 20 0 BEADRP CO[C@@H]1CCC[C@H]([NH2+]C[C@@H]2CCCCC[NH2+]2)C1 ZINC000902482424 584624352 /nfs/dbraw/zinc/62/43/52/584624352.db2.gz LDVCYJWBJIRZEM-MELADBBJSA-N 2 0 240.391 2.066 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+][C@H]2C[C@H](C[NH3+])C2)[C@@H](C)C1 ZINC000902485358 584624561 /nfs/dbraw/zinc/62/45/61/584624561.db2.gz JXTJJECHTITXKL-NZEXEKPDSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+][C@H]2C[C@H](C[NH3+])C2)C[C@@H]1C ZINC000902484183 584624972 /nfs/dbraw/zinc/62/49/72/584624972.db2.gz FFXANTVCNRIMKD-NZEXEKPDSA-N 2 0 210.365 2.138 20 0 BEADRP CO[C@H](c1ccccc1)[C@@H](C)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902485757 584625240 /nfs/dbraw/zinc/62/52/40/584625240.db2.gz NWBUXTLBFLAVJP-GBOPCIDUSA-N 2 0 248.370 2.090 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+][C@H]2CCc3c2cccc3F)C1 ZINC000902489408 584627195 /nfs/dbraw/zinc/62/71/95/584627195.db2.gz PWFLLTSRQKWLAE-BHDSKKPTSA-N 2 0 234.318 2.140 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+][C@@H]2CCc3c2cccc3F)C1 ZINC000902489890 584627309 /nfs/dbraw/zinc/62/73/09/584627309.db2.gz PWFLLTSRQKWLAE-GPCCPHFNSA-N 2 0 234.318 2.140 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+][C@H](c2cccnc2)C2CCC2)C1 ZINC000902488684 584627344 /nfs/dbraw/zinc/62/73/44/584627344.db2.gz ZXPOEUDHBOSTFI-CQDKDKBSSA-N 2 0 245.370 2.250 20 0 BEADRP Cc1ccc2c(c1)CC[C@@H]2[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902489349 584627355 /nfs/dbraw/zinc/62/73/55/584627355.db2.gz PGXCBMCTUKAYJV-WHOFXGATSA-N 2 0 230.355 2.309 20 0 BEADRP Cc1ccccc1C[C@@H](C)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902489360 584627426 /nfs/dbraw/zinc/62/74/26/584627426.db2.gz PKZGDSXAFMYXGG-UMVBOHGHSA-N 2 0 232.371 2.253 20 0 BEADRP CC[C@@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1ccc(OC)cc1 ZINC000902488527 584627590 /nfs/dbraw/zinc/62/75/90/584627590.db2.gz NCBOAFXFGJSFQV-UXIGCNINSA-N 2 0 248.370 2.473 20 0 BEADRP Cc1ccsc1[C@@H](C)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902488790 584627646 /nfs/dbraw/zinc/62/76/46/584627646.db2.gz NUEKVLXTGGEYBR-GMTAPVOTSA-N 2 0 224.373 2.444 20 0 BEADRP Cc1ncccc1CC[NH2+][C@@H]1CCCC[C@H]1C[NH3+] ZINC000902514650 584629479 /nfs/dbraw/zinc/62/94/79/584629479.db2.gz TWCHXZDUFPHWJB-LSDHHAIUSA-N 2 0 247.386 2.040 20 0 BEADRP C[C@H]([NH2+]C1(C2CCCCC2)CC1)C1C[NH2+]C1 ZINC000902517371 584629824 /nfs/dbraw/zinc/62/98/24/584629824.db2.gz KXJPYNWMIPPEEP-NSHDSACASA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]([NH2+]C1(C)C(C)(C)C1(C)C)C1C[NH2+]C1 ZINC000902521000 584631339 /nfs/dbraw/zinc/63/13/39/584631339.db2.gz QPKFCMHPFPHHPJ-SECBINFHSA-N 2 0 210.365 2.009 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]([NH2+]C/C=C\Cl)C1 ZINC000902521772 584631524 /nfs/dbraw/zinc/63/15/24/584631524.db2.gz UOMAPLIFVKIEKL-ATPLWMGHSA-N 2 0 216.756 2.107 20 0 BEADRP C[NH+](C)CCC[NH2+]C1C[C@@H]2CCC[C@H]2C1 ZINC000902721400 584659856 /nfs/dbraw/zinc/65/98/56/584659856.db2.gz ZYMBQBAFKHCAKV-RYUDHWBXSA-N 2 0 210.365 2.106 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH2+][C@@H]2C[C@H]3CCC[C@H]3C2)C1 ZINC000902796984 584674559 /nfs/dbraw/zinc/67/45/59/584674559.db2.gz SARCGRACNOVHRP-XQLPTFJDSA-N 2 0 236.403 2.497 20 0 BEADRP C[N@H+]1CC=C(C[NH2+]C2C[C@@H]3CCC[C@H]3C2)CC1 ZINC000902896930 584691420 /nfs/dbraw/zinc/69/14/20/584691420.db2.gz NKSBWLJYQAYUOR-KBPBESRZSA-N 2 0 234.387 2.417 20 0 BEADRP C/C=C/C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C1CC1 ZINC000903206141 584736345 /nfs/dbraw/zinc/73/63/45/584736345.db2.gz HQCJFERODGNZHV-LCJPNKJISA-N 2 0 220.360 2.310 20 0 BEADRP C[C@@H]1C[C@H]1[C@@H]1C[C@H]1[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000903252495 584739089 /nfs/dbraw/zinc/73/90/89/584739089.db2.gz DITRWFOBDWPRHK-JSLGZRHDSA-N 2 0 234.387 2.247 20 0 BEADRP C[C@@H]1C[C@H]1[C@@H]1C[C@H]1[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC000903254040 584739518 /nfs/dbraw/zinc/73/95/18/584739518.db2.gz PBKHMKHMBYPXPS-XGFWRYKXSA-N 2 0 236.403 2.493 20 0 BEADRP C[C@@](C[NH3+])([NH2+]Cc1ccc2cc[nH]c2c1)C1CC1 ZINC000903426068 584760850 /nfs/dbraw/zinc/76/08/50/584760850.db2.gz DXXKWXCPOMRSGG-HNNXBMFYSA-N 2 0 243.354 2.385 20 0 BEADRP C[N@H+](CCOc1ccccc1)C[C@@H]1CC[C@H]([NH3+])C1 ZINC000903427237 584761124 /nfs/dbraw/zinc/76/11/24/584761124.db2.gz UZQXKQOPMQPWHR-KGLIPLIRSA-N 2 0 248.370 2.125 20 0 BEADRP Cc1cccc2c1CC[N@H+](C[C@@H]1CC[C@H]([NH3+])C1)C2 ZINC000903435691 584762363 /nfs/dbraw/zinc/76/23/63/584762363.db2.gz VYBDBIXJKUJHCU-HIFRSBDPSA-N 2 0 244.382 2.481 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@@H+]1Cc2ccccc2C[C@H]1C ZINC000903439893 584763065 /nfs/dbraw/zinc/76/30/65/584763065.db2.gz PIKQMBGQMVFCMX-IOASZLSFSA-N 2 0 244.382 2.289 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@@H]1CCCCC1(C)C ZINC000903458888 584765716 /nfs/dbraw/zinc/76/57/16/584765716.db2.gz MKBOSJCBZQACJK-FRRDWIJNSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C[C@H]2CCC[NH2+]2)[C@H](C)C1 ZINC000903459765 584765774 /nfs/dbraw/zinc/76/57/74/584765774.db2.gz ZHEQYJQCLGTVCK-FDYHWXHSSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CC[C@H]([NH3+])C1)C1CCCC1 ZINC000903458951 584765934 /nfs/dbraw/zinc/76/59/34/584765934.db2.gz NVLDDWDEEQKUBC-WZRBSPASSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)[N@@H+](Cc1ccccn1)C[C@@H]1CC[C@H]([NH3+])C1 ZINC000903442010 584767262 /nfs/dbraw/zinc/76/72/62/584767262.db2.gz FOLCKZHMSQKFMG-KGLIPLIRSA-N 2 0 247.386 2.419 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH+]1CCC(c2ccco2)CC1 ZINC000903463984 584767280 /nfs/dbraw/zinc/76/72/80/584767280.db2.gz VLVRBJYKYPANGU-OCCSQVGLSA-N 2 0 248.370 2.315 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH+]1CCC([C@H]2CC[NH2+]C2)CC1 ZINC000903451472 584771825 /nfs/dbraw/zinc/77/18/25/584771825.db2.gz AFIFXIIIWIEMKV-SNPRPXQTSA-N 2 0 236.403 2.354 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC000903453909 584773000 /nfs/dbraw/zinc/77/30/00/584773000.db2.gz PCZREMFLPYEYBR-RDBSUJKOSA-N 2 0 222.376 2.108 20 0 BEADRP CC(F)(F)CCC[N@@H+]1CCC[C@]2(CC[NH2+]C2)C1 ZINC000903454148 584773492 /nfs/dbraw/zinc/77/34/92/584773492.db2.gz VXOWCXFFFGGPGW-CYBMUJFWSA-N 2 0 246.345 2.497 20 0 BEADRP CCSCCC[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000903472504 584776045 /nfs/dbraw/zinc/77/60/45/584776045.db2.gz ZYXSKEYBTFXGTP-LLVKDONJSA-N 2 0 228.405 2.004 20 0 BEADRP C=C/C=C\CC[NH2+][C@@H]1CC[NH2+]C12CCCC2 ZINC000903481840 584778186 /nfs/dbraw/zinc/77/81/86/584778186.db2.gz OCUVPMIAPFRUPI-DHCBQETCSA-N 2 0 220.360 2.383 20 0 BEADRP CC1(C)[C@H]([NH2+]Cc2ccc3cc[nH]c3c2)C[C@@H]1[NH3+] ZINC000903482634 584778608 /nfs/dbraw/zinc/77/86/08/584778608.db2.gz NLTINWCFGNZOCY-UONOGXRCSA-N 2 0 243.354 2.383 20 0 BEADRP C[C@H]1CCC(C)(C)[N@@H+]1C[C@@H]1CC[C@H]([NH3+])C1 ZINC000903482859 584779081 /nfs/dbraw/zinc/77/90/81/584779081.db2.gz WEFHDMZNWCXEEV-TUAOUCFPSA-N 2 0 210.365 2.377 20 0 BEADRP Cc1ccc(C[N@H+]2C[C@@H](C)[C@H](CC[NH3+])C2)c(C)n1 ZINC000903499201 584780205 /nfs/dbraw/zinc/78/02/05/584780205.db2.gz JNVOXBCDLIAKIT-BXUZGUMPSA-N 2 0 247.386 2.115 20 0 BEADRP C[C@H]1CCCC[C@@H]1OCCN1CCC[C@H]([NH3+])C1 ZINC000903545546 584781881 /nfs/dbraw/zinc/78/18/81/584781881.db2.gz UEJVAOVQEDJOHQ-IHRRRGAJSA-N 2 0 240.391 2.005 20 0 BEADRP CC1(C)CN(CCCCC(F)(F)F)C[C@@H]1[NH3+] ZINC000903556572 584782923 /nfs/dbraw/zinc/78/29/23/584782923.db2.gz AGLXUGURCVJVGZ-VIFPVBQESA-N 2 0 238.297 2.388 20 0 BEADRP CC1CC(C[N@@H+]2CCC[C@@H]([C@H]3CC[NH2+]C3)C2)C1 ZINC000903748905 584794648 /nfs/dbraw/zinc/79/46/48/584794648.db2.gz CUUQQBJNKKENCY-PFSRBDOWSA-N 2 0 236.403 2.354 20 0 BEADRP FCc1ccccc1C[N@@H+]1CC[C@]2(CC[NH2+]C2)C1 ZINC000903744726 584796572 /nfs/dbraw/zinc/79/65/72/584796572.db2.gz XSCWFRKHSXJMAN-HNNXBMFYSA-N 2 0 248.345 2.342 20 0 BEADRP C[N@H+](C[C@H]1CC1(C)C)C[C@@H]1CCCC[NH2+]C1 ZINC000903769891 584797868 /nfs/dbraw/zinc/79/78/68/584797868.db2.gz QXQRTESYMMNWKE-CHWSQXEVSA-N 2 0 224.392 2.354 20 0 BEADRP [NH3+]CC1(c2ccccc2)CC[NH+](CC2CC2)CC1 ZINC000903793066 584799058 /nfs/dbraw/zinc/79/90/58/584799058.db2.gz LVGPJMADGPYMPJ-UHFFFAOYSA-N 2 0 244.382 2.389 20 0 BEADRP [NH3+]CC1([C@@H]2CCCC[N@@H+]2CC2CC2)CCC1 ZINC000903812154 584803407 /nfs/dbraw/zinc/80/34/07/584803407.db2.gz QZFNWYWXSYPEPP-ZDUSSCGKSA-N 2 0 222.376 2.380 20 0 BEADRP CCOCC[N@@H+]1CCCC[C@@H]1C1(C[NH3+])CCC1 ZINC000903812881 584803547 /nfs/dbraw/zinc/80/35/47/584803547.db2.gz ACGZUEKYPTXBDW-CYBMUJFWSA-N 2 0 240.391 2.006 20 0 BEADRP C[C@@H]1CCOCC[N@@H+]1CCCCCCC[NH3+] ZINC000903832938 584806124 /nfs/dbraw/zinc/80/61/24/584806124.db2.gz TYHNCYWUCZPFPH-CYBMUJFWSA-N 2 0 228.380 2.006 20 0 BEADRP [NH3+][C@@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccccc1F)C2 ZINC000903849217 584808015 /nfs/dbraw/zinc/80/80/15/584808015.db2.gz BAHXUTIJDPNXND-UHTWSYAYSA-N 2 0 234.318 2.137 20 0 BEADRP CC(C)=CCC[N@@H+]1CC[C@@H]2CC[C@@]21CN ZINC000903856534 584809127 /nfs/dbraw/zinc/80/91/27/584809127.db2.gz ABFUZHQDEOEACN-QWHCGFSZSA-N 2 0 208.349 2.156 20 0 BEADRP C[C@]12CSC[C@H]1C[N@H+](CCCCCC[NH3+])C2 ZINC000903870785 584814652 /nfs/dbraw/zinc/81/46/52/584814652.db2.gz JHBCUSVKCAQNCF-OLZOCXBDSA-N 2 0 242.432 2.190 20 0 BEADRP C[C@H](CC(C)(C)C)[NH2+]C[C@@H]([NH3+])CC(F)F ZINC000903925333 584823937 /nfs/dbraw/zinc/82/39/37/584823937.db2.gz FMZIXTAOBLDGEG-BDAKNGLRSA-N 2 0 222.323 2.383 20 0 BEADRP C[C@H]1CC(C)(C)CN1C[C@H]([NH3+])CC(F)F ZINC000903929183 584824196 /nfs/dbraw/zinc/82/41/96/584824196.db2.gz BMZXJIGGAGSABT-DTWKUNHWSA-N 2 0 220.307 2.089 20 0 BEADRP C[C@@]1([NH2+]C[C@@H](N)CC(F)F)CC=CCC1 ZINC000903929693 584824464 /nfs/dbraw/zinc/82/44/64/584824464.db2.gz JQHWVJAEHNDXAU-GXSJLCMTSA-N 2 0 218.291 2.057 20 0 BEADRP Cc1ccc(C[NH2+]CCC(C)(C)[NH3+])cc1F ZINC000903938688 584826384 /nfs/dbraw/zinc/82/63/84/584826384.db2.gz HIPQRTIBXHEIBT-UHFFFAOYSA-N 2 0 224.323 2.351 20 0 BEADRP Cc1ccc(F)c(C[NH2+]CCC(C)(C)[NH3+])c1 ZINC000903938844 584826841 /nfs/dbraw/zinc/82/68/41/584826841.db2.gz MUEDNJWRVZKTOB-UHFFFAOYSA-N 2 0 224.323 2.351 20 0 BEADRP COc1ccccc1/C=C/C[NH2+]CCC(C)(C)[NH3+] ZINC000903938841 584826902 /nfs/dbraw/zinc/82/69/02/584826902.db2.gz MSEMOLYCNFRXFJ-SOFGYWHQSA-N 2 0 248.370 2.425 20 0 BEADRP N[C@@H](CC(F)F)C[N@H+](CC1CC1)CC1CCC1 ZINC000903917072 584827044 /nfs/dbraw/zinc/82/70/44/584827044.db2.gz KNAPCBYVCNCOCS-LBPRGKRZSA-N 2 0 246.345 2.481 20 0 BEADRP C[C@@H]1C[C@H](C[NH2+]Cc2cc(C3CC3)no2)CC[NH2+]1 ZINC000903954094 584831677 /nfs/dbraw/zinc/83/16/77/584831677.db2.gz QAARVUBPEMDOAN-GHMZBOCLSA-N 2 0 249.358 2.030 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]C[C@@H]2C[NH2+]CCC2(F)F)C1 ZINC000903956077 584832162 /nfs/dbraw/zinc/83/21/62/584832162.db2.gz GNKSIXYXCFYOKO-WOPDTQHZSA-N 2 0 246.345 2.400 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]C[C@H]2C[NH2+]CCC2(F)F)C1 ZINC000903956075 584832286 /nfs/dbraw/zinc/83/22/86/584832286.db2.gz GNKSIXYXCFYOKO-IJLUTSLNSA-N 2 0 246.345 2.400 20 0 BEADRP CC1CCC([NH2+]C[C@H]2C[NH2+]CCC2(F)F)CC1 ZINC000903956249 584832368 /nfs/dbraw/zinc/83/23/68/584832368.db2.gz JVUSCTMVKKKZBS-MOENNCHZSA-N 2 0 246.345 2.400 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+][C@@H]1CCCC[C@@H]1C1CC1 ZINC000903963588 584833558 /nfs/dbraw/zinc/83/35/58/584833558.db2.gz BQFXGNDWFPURBZ-FMKGYKFTSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H](CCCC(F)(F)F)[NH2+][C@@H]1C[NH2+]C[C@H]1C ZINC000903963708 584833587 /nfs/dbraw/zinc/83/35/87/584833587.db2.gz GNVLYFZQLVICAY-KXUCPTDWSA-N 2 0 238.297 2.305 20 0 BEADRP CCC1CCC([NH2+][C@@H]2C[NH2+]C[C@H]2C)CC1 ZINC000903963720 584833687 /nfs/dbraw/zinc/83/36/87/584833687.db2.gz GYCICCYRIUQONO-IKWCTNDRSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+]C/C=C/c1ccccc1 ZINC000903964269 584834013 /nfs/dbraw/zinc/83/40/13/584834013.db2.gz HBAJDWXWJMIDGE-IEOKHJKGSA-N 2 0 230.355 2.145 20 0 BEADRP C[C@@H]1C[C@@H](C[NH2+]C2CCC=CCC2)CC[NH2+]1 ZINC000903964561 584834234 /nfs/dbraw/zinc/83/42/34/584834234.db2.gz UGLXIAAHRHRKNL-OLZOCXBDSA-N 2 0 222.376 2.463 20 0 BEADRP CC(C)[C@@H]1CCC[C@@H]1[NH2+][C@@H]1C[NH2+]C[C@H]1C ZINC000903965048 584834468 /nfs/dbraw/zinc/83/44/68/584834468.db2.gz YUZQWJHRJDZLIN-MROQNXINSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+]C[C@H]1CCC[C@H](C)C1 ZINC000903965025 584834485 /nfs/dbraw/zinc/83/44/85/584834485.db2.gz YLAFTAMIGKZEJC-QNWHQSFQSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H](Cc1ccsc1)[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000903967360 584834920 /nfs/dbraw/zinc/83/49/20/584834920.db2.gz IHJDZLDZJUFXKN-MDZLAQPJSA-N 2 0 238.400 2.124 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@@H]1CCC[C@H](C2CC2)C1 ZINC000903967515 584835058 /nfs/dbraw/zinc/83/50/58/584835058.db2.gz KDXYLPANKDEFSK-UQOMUDLDSA-N 2 0 236.403 2.400 20 0 BEADRP Cc1cccc(OCC[N@@H+](C)C[C@H]2C[C@@H]([NH3+])C2)c1 ZINC000904305116 584862155 /nfs/dbraw/zinc/86/21/55/584862155.db2.gz DUFNBPQWEFFPHJ-OKILXGFUSA-N 2 0 248.370 2.043 20 0 BEADRP C[N@H+](C[C@H]1C[C@@H]([NH3+])C1)[C@H]1CCc2ccccc21 ZINC000904307947 584862938 /nfs/dbraw/zinc/86/29/38/584862938.db2.gz ZJJZAKSXUSANIJ-LNSITVRQSA-N 2 0 230.355 2.343 20 0 BEADRP C[C@@H]1CCC[C@H](C)C[N@H+]1C[C@H]1C[C@@H]([NH3+])C1 ZINC000904321656 584864104 /nfs/dbraw/zinc/86/41/04/584864104.db2.gz BAGFPDPJSWEANE-QNWHQSFQSA-N 2 0 210.365 2.234 20 0 BEADRP C[C@H]1CCC[C@H](C)[N@H+](C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000904321658 584864133 /nfs/dbraw/zinc/86/41/33/584864133.db2.gz BAGFPDPJSWEANE-ZDEQEGDKSA-N 2 0 210.365 2.234 20 0 BEADRP C[C@@H]1CC[C@]2(CC[N@H+](C[C@H]3C[C@@H]([NH3+])C3)C2)C1 ZINC000904331725 584865942 /nfs/dbraw/zinc/86/59/42/584865942.db2.gz KQXHNBBUUYGZRD-MQYQWHSLSA-N 2 0 222.376 2.236 20 0 BEADRP C[C@H]1CC[C@@]2(CC[N@H+](C[C@H]3C[C@@H]([NH3+])C3)C2)C1 ZINC000904331724 584866214 /nfs/dbraw/zinc/86/62/14/584866214.db2.gz KQXHNBBUUYGZRD-IGQOVBAYSA-N 2 0 222.376 2.236 20 0 BEADRP C[C@@H]1C[N@H+](C[C@H]2C[C@@H]([NH3+])C2)CC(C)(C)C1 ZINC000904341846 584867133 /nfs/dbraw/zinc/86/71/33/584867133.db2.gz XJFXFOQVFDQZJN-SDDRHHMPSA-N 2 0 210.365 2.092 20 0 BEADRP C[C@H]1C[C@@H](c2cccnc2)[N@H+](C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000904341786 584867440 /nfs/dbraw/zinc/86/74/40/584867440.db2.gz VXVXBZCPKMRNAY-VIRABCJISA-N 2 0 245.370 2.202 20 0 BEADRP CCC([NH3+])(CC)CNC[C@H]([NH3+])CCC(C)(C)C ZINC000904350684 584869590 /nfs/dbraw/zinc/86/95/90/584869590.db2.gz PAKHVJGGCMDKHP-GFCCVEGCSA-N 2 0 243.439 2.247 20 0 BEADRP CC(C)C[C@H](C[NH3+])NC[C@H]([NH3+])CCC(C)(C)C ZINC000904353382 584869713 /nfs/dbraw/zinc/86/97/13/584869713.db2.gz LEODYFCZBNRQLW-CHWSQXEVSA-N 3 0 243.439 2.103 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]C[C@@H]([NH3+])CCC(C)(C)C ZINC000904354843 584870774 /nfs/dbraw/zinc/87/07/74/584870774.db2.gz JOXBXAPQGHUIRP-STQMWFEESA-N 3 0 243.439 2.247 20 0 BEADRP C[C@H]1CC([NH2+]C2CC(C[NH3+])C2)C[C@H](C)C1 ZINC000904360105 584871628 /nfs/dbraw/zinc/87/16/28/584871628.db2.gz HPXAVNKJRMYRAD-IXYVEGFRSA-N 2 0 210.365 2.138 20 0 BEADRP [NH3+]CC1CC([NH2+]CCc2ccccc2Cl)C1 ZINC000904360264 584871787 /nfs/dbraw/zinc/87/17/87/584871787.db2.gz KBSKDHPTMLCPTP-UHFFFAOYSA-N 2 0 238.762 2.209 20 0 BEADRP CCc1ccccc1C[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000904362169 584871904 /nfs/dbraw/zinc/87/19/04/584871904.db2.gz HJWAQZDGWYVPEA-VDISTLRHSA-N 2 0 218.344 2.076 20 0 BEADRP [NH3+]CC1CC([NH2+]CCc2cc3ccccc3o2)C1 ZINC000904361165 584872026 /nfs/dbraw/zinc/87/20/26/584872026.db2.gz WVLOFQKHDVYXMM-UHFFFAOYSA-N 2 0 244.338 2.302 20 0 BEADRP COc1ccccc1[C@@H](C)[NH2+]C1CC(C[NH3+])C1 ZINC000904360679 584872187 /nfs/dbraw/zinc/87/21/87/584872187.db2.gz NZGULVJEMBYVHG-VOMCLLRMSA-N 2 0 234.343 2.083 20 0 BEADRP CC(C)(C)CC[C@@H]([NH3+])C[NH2+]C[C@H]1CCCCO1 ZINC000904367920 584872668 /nfs/dbraw/zinc/87/26/68/584872668.db2.gz KEVGUPGNBSADJI-CHWSQXEVSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@@]1(C[NH2+]CC2CCC(F)CC2)CCC[NH2+]C1 ZINC000904373771 584873983 /nfs/dbraw/zinc/87/39/83/584873983.db2.gz IYUVYLAMMJJGNI-JXQTWKCFSA-N 2 0 242.382 2.494 20 0 BEADRP C[C@]1(C[NH2+]CC2CCC(F)CC2)CCC[NH2+]C1 ZINC000904373776 584874105 /nfs/dbraw/zinc/87/41/05/584874105.db2.gz IYUVYLAMMJJGNI-RUXDESIVSA-N 2 0 242.382 2.494 20 0 BEADRP CC(C)(C)CC[C@H]([NH3+])C[NH2+]C[C@]1(C)CCCO1 ZINC000904366852 584875009 /nfs/dbraw/zinc/87/50/09/584875009.db2.gz RHHCPNLTXWVXSW-JSGCOSHPSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@H]([NH2+]C1CC(C[NH3+])C1)c1c(F)cccc1F ZINC000904389349 584875375 /nfs/dbraw/zinc/87/53/75/584875375.db2.gz KTLLVBYUUDOKBB-IDKOKCKLSA-N 2 0 240.297 2.353 20 0 BEADRP CC(C)(C)CC[C@H]([NH3+])C[NH2+][C@@H]1C=CCC1 ZINC000904377789 584875910 /nfs/dbraw/zinc/87/59/10/584875910.db2.gz YUKVBXLKCXOKHL-NWDGAFQWSA-N 2 0 210.365 2.448 20 0 BEADRP C[C@@H](C[NH2+]C[C@@]1(C)CCC[NH2+]C1)c1ccccn1 ZINC000904377397 584875946 /nfs/dbraw/zinc/87/59/46/584875946.db2.gz PTUHMDOGRZFEJC-ZFWWWQNUSA-N 2 0 247.386 2.164 20 0 BEADRP CC(C)(C)CC[C@H]([NH3+])CNCC1([NH3+])CCCC1 ZINC000904377243 584876258 /nfs/dbraw/zinc/87/62/58/584876258.db2.gz LMVCAOYDDNPKRP-LBPRGKRZSA-N 2 0 241.423 2.001 20 0 BEADRP C/C=C\C[C@H]1CCC[N@H+](C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000904381651 584877073 /nfs/dbraw/zinc/87/70/73/584877073.db2.gz QRVGJGHZWPZDOR-RCWDGGQMSA-N 2 0 222.376 2.402 20 0 BEADRP C[C@H](C[NH2+]C[C@@]1(C)CCC[NH2+]C1)c1ccncc1 ZINC000904381596 584877121 /nfs/dbraw/zinc/87/71/21/584877121.db2.gz ZLQWTGGBMSSBCL-HIFRSBDPSA-N 2 0 247.386 2.164 20 0 BEADRP C[N@H+](CCCCCC[NH3+])Cc1ccc(C[NH3+])cc1 ZINC000904384050 584877560 /nfs/dbraw/zinc/87/75/60/584877560.db2.gz HMNFBNSTXCLWQH-UHFFFAOYSA-N 3 0 249.402 2.096 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@@H]2c3ccccc3CC[C@H]2F)C1 ZINC000904386173 584877959 /nfs/dbraw/zinc/87/79/59/584877959.db2.gz RHVIEBZAIHRMPF-DZGBDDFRSA-N 2 0 248.345 2.339 20 0 BEADRP Cc1ccsc1C[N@@H+]1CC[C@H](C[NH3+])[C@@H](C)C1 ZINC000904411813 584879765 /nfs/dbraw/zinc/87/97/65/584879765.db2.gz NPSQALISNHPADP-NWDGAFQWSA-N 2 0 238.400 2.473 20 0 BEADRP C[C@@H](Cc1ccccc1)C[N@H+]1C[C@@H](C[NH3+])[C@H](C)C1 ZINC000904419547 584882244 /nfs/dbraw/zinc/88/22/44/584882244.db2.gz WZXDXGJGOXAFRM-SQWLQELKSA-N 2 0 246.398 2.392 20 0 BEADRP COc1cc(C)c([C@@H](C)NC[C@H](C)[NH3+])cc1C ZINC000817972709 584993980 /nfs/dbraw/zinc/99/39/80/584993980.db2.gz NXWABSRWXNJRSX-NWDGAFQWSA-N 2 0 236.359 2.310 20 0 BEADRP C[C@@H](c1ccncc1)[N@H+](C)CC1CC[NH+](C)CC1 ZINC000738312076 585042600 /nfs/dbraw/zinc/04/26/00/585042600.db2.gz NROOPNIWXDOHSZ-ZDUSSCGKSA-N 2 0 247.386 2.416 20 0 BEADRP C[C@H](c1ccncc1)[N@H+](C)CC1CC[NH+](C)CC1 ZINC000738312075 585042741 /nfs/dbraw/zinc/04/27/41/585042741.db2.gz NROOPNIWXDOHSZ-CYBMUJFWSA-N 2 0 247.386 2.416 20 0 BEADRP C[C@@H](c1ccccn1)[N@H+](C)CC1CC[NH+](C)CC1 ZINC000750043120 585209533 /nfs/dbraw/zinc/20/95/33/585209533.db2.gz RGPKEAKAXJZLCH-ZDUSSCGKSA-N 2 0 247.386 2.416 20 0 BEADRP C[Si](C)(C)C[NH+]1CCN(c2cc[nH+]cc2)CC1 ZINC000753910146 585271924 /nfs/dbraw/zinc/27/19/24/585271924.db2.gz OUUIORRUKJXTCN-UHFFFAOYSA-N 2 0 249.434 2.081 20 0 BEADRP CCCC[C@@H](COC)[NH2+]CCN1CCC[C@@H]1C ZINC000766271333 585500238 /nfs/dbraw/zinc/50/02/38/585500238.db2.gz UEHSITNMLCLHAD-KBPBESRZSA-N 2 0 242.407 2.266 20 0 BEADRP FC(F)C1CC([NH2+]CCC[NH+]2CCCCC2)C1 ZINC000768669545 585541629 /nfs/dbraw/zinc/54/16/29/585541629.db2.gz SSAMWMKVODPYAL-UHFFFAOYSA-N 2 0 246.345 2.496 20 0 BEADRP C[NH+](C)[C@@H]1CCC[C@H]([NH2+]C2CC(C(F)F)C2)C1 ZINC000769528248 585558676 /nfs/dbraw/zinc/55/86/76/585558676.db2.gz UVNQZSGLPGKCLI-POSLAHMBSA-N 2 0 246.345 2.493 20 0 BEADRP C[C@H](CCO)[NH2+]CCC[N@H+](C)C1CCCCC1 ZINC000779343867 585752087 /nfs/dbraw/zinc/75/20/87/585752087.db2.gz UOQCTLMNCILRJZ-CYBMUJFWSA-N 2 0 242.407 2.002 20 0 BEADRP CC(C)[C@H](C)[N@H+](C)CC1CC[NH+](C)CC1 ZINC000782183269 585810525 /nfs/dbraw/zinc/81/05/25/585810525.db2.gz JRAPDXNPCIWQKA-LBPRGKRZSA-N 2 0 212.381 2.305 20 0 BEADRP C[C@@H](C1CC1)[N@H+](C)CC1CC[NH+](C)CC1 ZINC000782183613 585810963 /nfs/dbraw/zinc/81/09/63/585810963.db2.gz NCXKZKJCAZZENP-NSHDSACASA-N 2 0 210.365 2.059 20 0 BEADRP C[C@H](C1CC1)[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C)C1 ZINC000782192943 585811610 /nfs/dbraw/zinc/81/16/10/585811610.db2.gz XDIGJUWYUZZWBJ-XBFCOCLRSA-N 2 0 222.376 2.201 20 0 BEADRP CCn1ccc(C[N@H+](C)CC2CC[NH+](C)CC2)c1 ZINC000789503892 585943534 /nfs/dbraw/zinc/94/35/34/585943534.db2.gz JSVZCYMCLCAJIG-UHFFFAOYSA-N 2 0 249.402 2.282 20 0 BEADRP C[NH+]1CCC2(CCC[N@H+](CC3(F)CC3)C2)CC1 ZINC000798957537 586154389 /nfs/dbraw/zinc/15/43/89/586154389.db2.gz ZWJRBSZUUYATPO-UHFFFAOYSA-N 2 0 240.366 2.296 20 0 BEADRP CCC[N@H+](CCC[NH+](C)C)C[C@@H]1CCC=CO1 ZINC000809757792 586517551 /nfs/dbraw/zinc/51/75/51/586517551.db2.gz XWBHABJJKYDWFT-AWEZNQCLSA-N 2 0 240.391 2.343 20 0 BEADRP Cc1cccc(F)c1C[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000817896978 586834523 /nfs/dbraw/zinc/83/45/23/586834523.db2.gz AUQMRYXSMNMWPL-QWRGUYRKSA-N 2 0 224.323 2.350 20 0 BEADRP C[C@H](CSC(C)(C)C)[NH2+]C1CC[NH2+]CC1 ZINC000817936877 586844051 /nfs/dbraw/zinc/84/40/51/586844051.db2.gz RYANTABBUIZTDE-SNVBAGLBSA-N 2 0 230.421 2.248 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+]CCNc1ccccc1 ZINC000817900079 586835926 /nfs/dbraw/zinc/83/59/26/586835926.db2.gz KCTFUGMOVDZONE-ZFWWWQNUSA-N 2 0 247.386 2.076 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]CCNc1ccccc1 ZINC000817900076 586836514 /nfs/dbraw/zinc/83/65/14/586836514.db2.gz KCTFUGMOVDZONE-HIFRSBDPSA-N 2 0 247.386 2.076 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+]CCSC(C)(C)C ZINC000817907647 586836918 /nfs/dbraw/zinc/83/69/18/586836918.db2.gz GZZKDTQVEUNYOX-NWDGAFQWSA-N 2 0 244.448 2.496 20 0 BEADRP Cc1cccc(OCCC[NH2+][C@H]2CCC[C@@H]2[NH3+])c1 ZINC000817907775 586837551 /nfs/dbraw/zinc/83/75/51/586837551.db2.gz WETJPPWQBRKENW-GJZGRUSLSA-N 2 0 248.370 2.233 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H](C)CSC(C)(C)C ZINC000817944151 586841070 /nfs/dbraw/zinc/84/10/70/586841070.db2.gz YECACQKYXQQXDZ-LLVKDONJSA-N 2 0 232.437 2.496 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H](C)CSC(C)(C)C ZINC000817951109 586841213 /nfs/dbraw/zinc/84/12/13/586841213.db2.gz BLXNURFNEIBWRZ-UWVGGRQHSA-N 2 0 218.410 2.234 20 0 BEADRP C[C@]1(C[NH2+][C@@H]2CCC[C@@H]2[NH3+])CC1(Cl)Cl ZINC000817937824 586844087 /nfs/dbraw/zinc/84/40/87/586844087.db2.gz YGYXUYFBBUUCDJ-DJLDLDEBSA-N 2 0 237.174 2.040 20 0 BEADRP C[C@@H](N[C@@H](C[NH3+])C1CC1)c1ccc2c(c1)CCO2 ZINC000817959105 586851940 /nfs/dbraw/zinc/85/19/40/586851940.db2.gz CGKIJAZJVNYGFR-YGRLFVJLSA-N 2 0 246.354 2.009 20 0 BEADRP C[C@@H](CSC(C)(C)C)[NH2+]CC1=CC[NH2+]CC1 ZINC000817968751 586852927 /nfs/dbraw/zinc/85/29/27/586852927.db2.gz XMJZSEVHRPYOGC-NSHDSACASA-N 2 0 242.432 2.416 20 0 BEADRP C[C@@H]([NH3+])C[NH2+]C1CCC(C(F)(F)F)CC1 ZINC000817971340 586859557 /nfs/dbraw/zinc/85/95/57/586859557.db2.gz CNTAMPREEPUCCR-AFPNSQJFSA-N 2 0 224.270 2.044 20 0 BEADRP [NH3+]CCCCCCCOc1ccccc1C[NH3+] ZINC000818617245 586907531 /nfs/dbraw/zinc/90/75/31/586907531.db2.gz BFAJRABACWTVRG-UHFFFAOYSA-N 2 0 236.359 2.433 20 0 BEADRP C[C@H]1CC[C@@H]1[NH2+]CCCC[N@H+](C)C1CC1 ZINC000834909614 587770274 /nfs/dbraw/zinc/77/02/74/587770274.db2.gz SPQUITOBSMPDLN-AAEUAGOBSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H]([NH2+]Cc1ccc(CC[NH3+])cc1)C1CCC1 ZINC000841033690 587937090 /nfs/dbraw/zinc/93/70/90/587937090.db2.gz SUJZFDNPARZEOX-GFCCVEGCSA-N 2 0 232.371 2.466 20 0 BEADRP C[C@H]([NH2+]Cc1ccc(CC[NH3+])cc1)C1CCC1 ZINC000841033691 587937189 /nfs/dbraw/zinc/93/71/89/587937189.db2.gz SUJZFDNPARZEOX-LBPRGKRZSA-N 2 0 232.371 2.466 20 0 BEADRP C[C@@H]1CCC[C@H]1[NH2+]Cc1ccc(CC[NH3+])cc1 ZINC000841032665 587937275 /nfs/dbraw/zinc/93/72/75/587937275.db2.gz VKTHRJBFTMFLOH-IUODEOHRSA-N 2 0 232.371 2.466 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]Cc1cccnc1Cl ZINC000841080528 587944882 /nfs/dbraw/zinc/94/48/82/587944882.db2.gz SDNIRZDRJIMLDJ-JTQLQIEISA-N 2 0 241.766 2.342 20 0 BEADRP C([NH2+]C1CCCCCCC1)[C@H]1C[NH2+]CCCO1 ZINC000841086917 587945514 /nfs/dbraw/zinc/94/55/14/587945514.db2.gz QNYCWSLSGCBGBX-CQSZACIVSA-N 2 0 240.391 2.067 20 0 BEADRP Cc1cccc2c1CC[N@H+](CC[C@@H]1CC[NH2+]C1)C2 ZINC000842472351 588028995 /nfs/dbraw/zinc/02/89/95/588028995.db2.gz XFYHCSVUDFPNKB-AWEZNQCLSA-N 2 0 244.382 2.353 20 0 BEADRP CC(C)(C)[C@@H](C[NH3+])NCc1ccc(Cl)cn1 ZINC000842474874 588029194 /nfs/dbraw/zinc/02/91/94/588029194.db2.gz DGWPHWYDLCIUFP-LLVKDONJSA-N 2 0 241.766 2.198 20 0 BEADRP [NH3+]CCCCCC[NH2+][C@@H]1CCC12CCC2 ZINC000843342960 588101545 /nfs/dbraw/zinc/10/15/45/588101545.db2.gz VVCUSFCIYKJLKK-GFCCVEGCSA-N 2 0 210.365 2.428 20 0 BEADRP [NH3+]CCCCCC[NH2+][C@H]1CCC12CCOCC2 ZINC000843341570 588100954 /nfs/dbraw/zinc/10/09/54/588100954.db2.gz JMRVHBMILLPYNR-ZDUSSCGKSA-N 2 0 240.391 2.054 20 0 BEADRP COCC[C@H]1CCC[C@H]1[NH2+]CCCCCC[NH3+] ZINC000843342915 588101298 /nfs/dbraw/zinc/10/12/98/588101298.db2.gz VCYRYHAYGAIKRQ-ZIAGYGMSSA-N 2 0 242.407 2.300 20 0 BEADRP C[N@H+](Cc1ncc(C2CC2)o1)C1CCC([NH3+])CC1 ZINC000843354840 588102916 /nfs/dbraw/zinc/10/29/16/588102916.db2.gz HXIXSRVKEAGIRU-UHFFFAOYSA-N 2 0 249.358 2.254 20 0 BEADRP C[C@@H]1C[N@H+](C[C@H]2CC[NH2+]C2)Cc2ccccc21 ZINC000843356218 588103295 /nfs/dbraw/zinc/10/32/95/588103295.db2.gz HTVRRHIWVARPAI-OLZOCXBDSA-N 2 0 230.355 2.215 20 0 BEADRP COCC[N@H+](CCCCCC[NH3+])C1CCCC1 ZINC000846217552 588260428 /nfs/dbraw/zinc/26/04/28/588260428.db2.gz DGFWGPKOGLSLNY-UHFFFAOYSA-N 2 0 242.407 2.397 20 0 BEADRP CC[C@@H]([NH2+]CCN1CCCC1)[C@@H]1CCCCO1 ZINC000847089858 588305708 /nfs/dbraw/zinc/30/57/08/588305708.db2.gz LJZPEALHZUSGGI-KGLIPLIRSA-N 2 0 240.391 2.020 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H]2CC[C@@H]2C2CC2)C1 ZINC000848559517 588397029 /nfs/dbraw/zinc/39/70/29/588397029.db2.gz XURQFBOPEALVKX-YXCITZCRSA-N 2 0 222.376 2.105 20 0 BEADRP C[C@H]1CCCN1CC[NH2+][C@H]1CCCSCC1 ZINC000850439226 588546540 /nfs/dbraw/zinc/54/65/40/588546540.db2.gz MDVOCWRGJOOVPG-STQMWFEESA-N 2 0 242.432 2.346 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@H]2C=CCC2)[C@H](C)C1 ZINC000850512179 588555867 /nfs/dbraw/zinc/55/58/67/588555867.db2.gz XFVUSODSKGYYES-AGIUHOORSA-N 2 0 208.349 2.025 20 0 BEADRP C[C@@H]1CC[C@H]1[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000850583360 588561546 /nfs/dbraw/zinc/56/15/46/588561546.db2.gz NPHQSRJHXCQBSU-IUODEOHRSA-N 2 0 236.403 2.497 20 0 BEADRP [NH3+]CCCCCCCOc1ccc(C[NH3+])cc1 ZINC000202820741 589193246 /nfs/dbraw/zinc/19/32/46/589193246.db2.gz GSPYRVMQJKWNMP-UHFFFAOYSA-N 2 0 236.359 2.433 20 0 BEADRP C1C[C@@H]([NH2+][C@H]2CC[C@H]3CCCC[C@@H]3C2)C[NH2+]1 ZINC000863488055 589293708 /nfs/dbraw/zinc/29/37/08/589293708.db2.gz DQEKDOYOTGQRDT-YIYPIFLZSA-N 2 0 222.376 2.297 20 0 BEADRP Cc1cc(CN(C)C[C@@H](C)[NH3+])cc2cccnc12 ZINC000863652079 589307630 /nfs/dbraw/zinc/30/76/30/589307630.db2.gz PWHLCNOMRFOLNP-GFCCVEGCSA-N 2 0 243.354 2.322 20 0 BEADRP CCC(CC)NC(=[NH2+])NCC[N@@H+](C)[C@@H](C)CC ZINC000864455886 589366980 /nfs/dbraw/zinc/36/69/80/589366980.db2.gz ACLUZUZNVLYGNC-NSHDSACASA-N 2 0 242.411 2.019 20 0 BEADRP C[NH+](C)CCC[NH2+]C/C=C/c1cccc(F)c1 ZINC000885894580 589470552 /nfs/dbraw/zinc/47/05/52/589470552.db2.gz YXPIFWQQEXAZLI-QPJJXVBHSA-N 2 0 236.334 2.380 20 0 BEADRP C[C@@H](CCc1cccnc1)[NH2+][C@@H](C)CC[NH+](C)C ZINC000866250214 589482775 /nfs/dbraw/zinc/48/27/75/589482775.db2.gz WOBVRYJPWUCNNM-KBPBESRZSA-N 2 0 249.402 2.333 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@H]2C[C@H](SC)C2)[C@@H](C)C1 ZINC000866486620 589496474 /nfs/dbraw/zinc/49/64/74/589496474.db2.gz MPAZCTVLTBBWCJ-CYDGBPFRSA-N 2 0 242.432 2.200 20 0 BEADRP CS[C@H]1C[C@H]([NH2+][C@@H](C)C2CC[NH+](C)CC2)C1 ZINC000866487496 589496993 /nfs/dbraw/zinc/49/69/93/589496993.db2.gz ZDMMFELLJGXPPF-DRZSPHRISA-N 2 0 242.432 2.200 20 0 BEADRP CC1(C)CC[C@H](C[NH2+][C@@H]2CCCC[C@H]2[NH3+])OC1 ZINC000866667423 589510073 /nfs/dbraw/zinc/51/00/73/589510073.db2.gz LZTZTJBNURNBGM-JHJVBQTASA-N 2 0 240.391 2.051 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCC[C@@H](OC2CCC2)CC1 ZINC000866696921 589512836 /nfs/dbraw/zinc/51/28/36/589512836.db2.gz CFPKQARUHMTRQU-CQSZACIVSA-N 2 0 240.391 2.020 20 0 BEADRP CC(C)OCC[N@@H+]1CC[C@@](C[NH3+])(C(C)(C)C)C1 ZINC000866705268 589514400 /nfs/dbraw/zinc/51/44/00/589514400.db2.gz WOFJYTOUPWHEJT-AWEZNQCLSA-N 2 0 242.407 2.108 20 0 BEADRP C[C@@H]1C[C@@H](Nc2cc[nH+]cc2C2CC2)CC[N@@H+]1C ZINC000872463055 589941871 /nfs/dbraw/zinc/94/18/71/589941871.db2.gz HKKVXKVODPJSHG-YPMHNXCESA-N 2 0 245.370 2.276 20 0 BEADRP C[NH+](C)C[C@@H]1CCN(c2cc[nH+]cc2C2CC2)C1 ZINC000872506334 589946041 /nfs/dbraw/zinc/94/60/41/589946041.db2.gz SUKXLGSQCLVVGX-LBPRGKRZSA-N 2 0 245.370 2.347 20 0 BEADRP CCn1ccnc1CNc1cc[nH+]cc1C1CC1 ZINC000872559901 589951208 /nfs/dbraw/zinc/95/12/08/589951208.db2.gz BQEGFJKWXMENQQ-UHFFFAOYSA-N 2 0 242.326 2.209 20 0 BEADRP CC(C)[C@@H](C[NH3+])CNc1ccc([C@@H]2C[C@H]2[NH3+])cc1 ZINC000873215946 589998249 /nfs/dbraw/zinc/99/82/49/589998249.db2.gz MSWOGCDGOGYZAZ-AEGPPILISA-N 2 0 247.386 2.144 20 0 BEADRP CC(C)(C)[NH2+]CCN1CC[C@@H]2CSC[C@@H]2C1 ZINC000873221917 589999768 /nfs/dbraw/zinc/99/97/68/589999768.db2.gz TYOKECOOZIEUIP-NEPJUHHUSA-N 2 0 242.432 2.059 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@@H]1C)C1CC[NH2+]CC1 ZINC000873222148 589999848 /nfs/dbraw/zinc/99/98/48/589999848.db2.gz BVNWPNDAYIYWQZ-GVXVVHGQSA-N 2 0 210.365 2.153 20 0 BEADRP CCC(CC)C[NH2+]C1(CCOC)CC[NH2+]CC1 ZINC000873224636 590001102 /nfs/dbraw/zinc/00/11/02/590001102.db2.gz JFGJWMHTEGQUGF-UHFFFAOYSA-N 2 0 242.407 2.171 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]CC[C@@H]1CCSC1 ZINC000873235973 590004569 /nfs/dbraw/zinc/00/45/69/590004569.db2.gz SBSDUSMOFMYDFZ-JHJVBQTASA-N 2 0 242.432 2.107 20 0 BEADRP CC[C@@H]([NH2+]CC[C@@H]1CCSC1)[C@@H]1CCC[NH2+]1 ZINC000873235515 590004885 /nfs/dbraw/zinc/00/48/85/590004885.db2.gz NIQUBURMSPTYOG-UPJWGTAASA-N 2 0 242.432 2.250 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+][C@@H]1CCCC[C@@H]1F ZINC000873238968 590005227 /nfs/dbraw/zinc/00/52/27/590005227.db2.gz KQSVPWGASAJAKJ-MROQNXINSA-N 2 0 228.355 2.374 20 0 BEADRP [NH3+]C[C@H]1CC[C@H]([NH2+][C@@H]2CC[C@@H]2C2CC2)CC1 ZINC000873238864 590005679 /nfs/dbraw/zinc/00/56/79/590005679.db2.gz IJERLFTVFFPPFI-FMKGYKFTSA-N 2 0 222.376 2.282 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]CC1CCC2(CC2)CC1 ZINC000873242753 590006372 /nfs/dbraw/zinc/00/63/72/590006372.db2.gz SDNKBWAEHSIUAR-OLZOCXBDSA-N 2 0 222.376 2.426 20 0 BEADRP CO[C@@H](c1ccccc1)[C@@H](C)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873248635 590007322 /nfs/dbraw/zinc/00/73/22/590007322.db2.gz CISVZULNZXASCX-RJZRQDKASA-N 2 0 248.370 2.090 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1cccc(F)c1F ZINC000873249506 590007403 /nfs/dbraw/zinc/00/74/03/590007403.db2.gz AQPZWAMSRXHWQJ-BBBLOLIVSA-N 2 0 240.297 2.353 20 0 BEADRP C[C@@H]1CC[C@@H](C)[C@@H]([NH2+]C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000873249073 590007552 /nfs/dbraw/zinc/00/75/52/590007552.db2.gz ICHYFNYGVSPDFH-KVSVUVNWSA-N 2 0 210.365 2.138 20 0 BEADRP Cc1cc([C@@H](C)[NH2+]C[C@H]2C[C@@H]([NH3+])C2)oc1C ZINC000873249295 590007611 /nfs/dbraw/zinc/00/76/11/590007611.db2.gz KJIHFODGPKADQG-JLLWLGSASA-N 2 0 222.332 2.284 20 0 BEADRP C[C@@H]1CC(C)(C)C[C@H]1[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873248847 590007634 /nfs/dbraw/zinc/00/76/34/590007634.db2.gz FMQBQXHCGRBNAY-WISYIIOYSA-N 2 0 210.365 2.138 20 0 BEADRP CO[C@H](c1ccccc1)[C@H](C)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873248637 590007782 /nfs/dbraw/zinc/00/77/82/590007782.db2.gz CISVZULNZXASCX-VIRABCJISA-N 2 0 248.370 2.090 20 0 BEADRP CCOc1ccccc1[C@@H](C)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873254011 590009334 /nfs/dbraw/zinc/00/93/34/590009334.db2.gz JAKXPYNTWIAMIK-UPJWGTAASA-N 2 0 248.370 2.473 20 0 BEADRP CC[C@@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccccc1OC ZINC000873253782 590009584 /nfs/dbraw/zinc/00/95/84/590009584.db2.gz FDIVICVIMXSTTR-MBNYWOFBSA-N 2 0 248.370 2.473 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+]C[C@H]2C[C@@H]([NH3+])C2)s1 ZINC000873255050 590010089 /nfs/dbraw/zinc/01/00/89/590010089.db2.gz DQULAIFTEUVYNH-MXWKQRLJSA-N 2 0 224.373 2.444 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+][C@@H]2CCCC23CCC3)C1 ZINC000873254683 590010137 /nfs/dbraw/zinc/01/01/37/590010137.db2.gz AJJAOZWCAKBMSZ-IJLUTSLNSA-N 2 0 208.349 2.036 20 0 BEADRP CCC[C@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1ccccn1 ZINC000873255129 590010241 /nfs/dbraw/zinc/01/02/41/590010241.db2.gz DJXBKIDFSMYRHN-AVGNSLFASA-N 2 0 233.359 2.250 20 0 BEADRP CC[C@@H](Cc1cccs1)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873254638 590010415 /nfs/dbraw/zinc/01/04/15/590010415.db2.gz YVGYRSHTLXGXSK-TUAOUCFPSA-N 2 0 238.400 2.396 20 0 BEADRP CC1(C)CCCC[C@H]1[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873256137 590011202 /nfs/dbraw/zinc/01/12/02/590011202.db2.gz LYOLKQQXXASAJO-IJLUTSLNSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1ccnc(Cl)c1 ZINC000873257097 590011866 /nfs/dbraw/zinc/01/18/66/590011866.db2.gz QXJMVJGMHMQSNP-FXPVBKGRSA-N 2 0 239.750 2.123 20 0 BEADRP CC[C@@H]1CCC[C@@H]([NH2+]C[C@H]2C[C@H]([NH3+])C2)C1 ZINC000873256706 590011949 /nfs/dbraw/zinc/01/19/49/590011949.db2.gz PDOFKFPQWFHYQJ-FDYHWXHSSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+][C@H](C2CC2)C2CCCC2)C1 ZINC000873256956 590011964 /nfs/dbraw/zinc/01/19/64/590011964.db2.gz RLGOABNWDPSFQW-BPNCWPANSA-N 2 0 222.376 2.282 20 0 BEADRP COc1ccc([C@@H](C)[NH2+]C[C@H]2C[C@H]([NH3+])C2)cc1 ZINC000873257508 590012369 /nfs/dbraw/zinc/01/23/69/590012369.db2.gz IMSBOOCXYGCKND-NQBHXWOUSA-N 2 0 234.343 2.083 20 0 BEADRP Cc1cccc2c1CC[C@H]2[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873259102 590012693 /nfs/dbraw/zinc/01/26/93/590012693.db2.gz XUXNCCYORLUJMG-LALPHHSUSA-N 2 0 230.355 2.309 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1cccs1 ZINC000873258763 590012898 /nfs/dbraw/zinc/01/28/98/590012898.db2.gz UKIVWNPORSWYKJ-OPRDCNLKSA-N 2 0 210.346 2.136 20 0 BEADRP Cc1cccc2c1CC[C@@H]2[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873259101 590013001 /nfs/dbraw/zinc/01/30/01/590013001.db2.gz XUXNCCYORLUJMG-HUBLWGQQSA-N 2 0 230.355 2.309 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+]C2CCC(C(F)F)CC2)C1 ZINC000873258693 590013130 /nfs/dbraw/zinc/01/31/30/590013130.db2.gz VJJCZYXXBRKECK-RSIPAPEOSA-N 2 0 232.318 2.137 20 0 BEADRP CC[C@H]1CCCC[C@H]1[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873259121 590013474 /nfs/dbraw/zinc/01/34/74/590013474.db2.gz ZPZVJLJEDOIAMP-ZDEQEGDKSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C[C@H]2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000873259663 590013702 /nfs/dbraw/zinc/01/37/02/590013702.db2.gz JDZGVEDESPXGLI-XGFWRYKXSA-N 2 0 222.376 2.295 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000873262356 590014159 /nfs/dbraw/zinc/01/41/59/590014159.db2.gz XOQJQHRMAUQMFB-RKQHYHRCSA-N 2 0 222.376 2.295 20 0 BEADRP C([NH2+][C@H]1CC[C@@H]1C1CC1)[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000873261806 590014301 /nfs/dbraw/zinc/01/43/01/590014301.db2.gz SBHAOQDVLQLMDJ-RCSLCFTFSA-N 2 0 234.387 2.295 20 0 BEADRP Cc1ccncc1[C@@H](C)[NH2+][C@@H](C)C1CC[NH2+]CC1 ZINC000873272932 590016837 /nfs/dbraw/zinc/01/68/37/590016837.db2.gz XLZUEKXRFBHTIC-QWHCGFSZSA-N 2 0 247.386 2.429 20 0 BEADRP CC[C@@H]([NH2+]CCC(C)(C)COC)[C@@H]1CCC[NH2+]1 ZINC000873279212 590017906 /nfs/dbraw/zinc/01/79/06/590017906.db2.gz DYZRHLZDTFRUON-OLZOCXBDSA-N 2 0 242.407 2.169 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]CCC[C@@H]1C=CCC1 ZINC000873282305 590018306 /nfs/dbraw/zinc/01/83/06/590018306.db2.gz SYOMZMQSLIKMDE-HZSPNIEDSA-N 2 0 222.376 2.450 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@@H]1C[C@H]2CCC[C@H]2O1 ZINC000873282169 590018735 /nfs/dbraw/zinc/01/87/35/590018735.db2.gz QZDDNVDCFHOEOK-YIYPIFLZSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H]([NH2+]CCC[C@@H]1C=CCC1)[C@H]1CCC[NH2+]1 ZINC000873282565 590019720 /nfs/dbraw/zinc/01/97/20/590019720.db2.gz VCSAGZCZLIQOIG-MGPQQGTHSA-N 2 0 222.376 2.463 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]C1CC(Nc2ccccc2)C1 ZINC000873295293 590024018 /nfs/dbraw/zinc/02/40/18/590024018.db2.gz DZJCTGJEOGJGPX-RMNLLRHXSA-N 2 0 247.386 2.345 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]C1CC(Nc2ccccc2)C1 ZINC000873295292 590024396 /nfs/dbraw/zinc/02/43/96/590024396.db2.gz DZJCTGJEOGJGPX-HGWMRPEMSA-N 2 0 247.386 2.345 20 0 BEADRP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+]CCC[C@@H]2CCO2)C1 ZINC000877074129 590278406 /nfs/dbraw/zinc/27/84/06/590278406.db2.gz ZSTBVNOCRSZXFP-MGPQQGTHSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@H]1CCCN1CC[NH2+]C[C@@H]1C[C@H]2C[C@H]2C1 ZINC000877154385 590293201 /nfs/dbraw/zinc/29/32/01/590293201.db2.gz PGHDAZARRDMUNG-FQUUOJAGSA-N 2 0 222.376 2.106 20 0 BEADRP C[N@H+]1C[C@@H]2C[NH+](CC3(C)CCCC3)C[C@@H]2C1 ZINC000877482273 590337032 /nfs/dbraw/zinc/33/70/32/590337032.db2.gz CAXCSXQHHVOTFK-BETUJISGSA-N 2 0 222.376 2.060 20 0 BEADRP C[NH+](C)CC1CC[NH+](CCCC2CC2)CC1 ZINC000877969482 590461793 /nfs/dbraw/zinc/46/17/93/590461793.db2.gz BRSKTEQYXGSEOT-UHFFFAOYSA-N 2 0 224.392 2.450 20 0 BEADRP C=C/C=C/CC[NH+]1CC[C@@]2(CC[N@@H+](C)C2)C1 ZINC000878645263 590600542 /nfs/dbraw/zinc/60/05/42/590600542.db2.gz JEYUVGNBJYNHJE-ISZGNANSSA-N 2 0 220.360 2.146 20 0 BEADRP C[C@@H]1C[C@H]1C[N@@H+]1CCN(c2cc[nH+]cc2)[C@H](C)C1 ZINC000880259550 590979815 /nfs/dbraw/zinc/97/98/15/590979815.db2.gz WAPLJJHDWAPPTG-MCIONIFRSA-N 2 0 245.370 2.248 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[C@@H](C)C1)C1CC[NH+](C)CC1 ZINC000128511482 591100343 /nfs/dbraw/zinc/10/03/43/591100343.db2.gz PMYPMQXMFGVOAF-DYEKYZERSA-N 2 0 224.392 2.495 20 0 BEADRP C=C/C=C\CC[NH2+][C@@H]1CC[N@@H+](CC)C[C@H]1C ZINC000883267774 591600694 /nfs/dbraw/zinc/60/06/94/591600694.db2.gz POWNVQCDJDBCPQ-YOIVVXPQSA-N 2 0 222.376 2.439 20 0 BEADRP CCN1CC[C@H]1C[NH2+][C@H](C)CCC1CC1 ZINC000883355318 591626577 /nfs/dbraw/zinc/62/65/77/591626577.db2.gz OEQGGBSREGOLJZ-YPMHNXCESA-N 2 0 210.365 2.249 20 0 BEADRP C[NH2+]C1CC[NH+](CC[C@@H]2CCCC2(F)F)CC1 ZINC000883416855 591652800 /nfs/dbraw/zinc/65/28/00/591652800.db2.gz HEWGDOULUNKJOE-NSHDSACASA-N 2 0 246.345 2.496 20 0 BEADRP C[NH2+]C[C@@H]1CCCN1CC[C@@H]1CCCC1(F)F ZINC000883418134 591654574 /nfs/dbraw/zinc/65/45/74/591654574.db2.gz YOLZRQINHATEOF-RYUDHWBXSA-N 2 0 246.345 2.496 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CC[N@H+](CC[C@H]2CCCC2(F)F)C1 ZINC000883424099 591659382 /nfs/dbraw/zinc/65/93/82/591659382.db2.gz GBEXPGHCUCBGQQ-QJPTWQEYSA-N 2 0 246.345 2.481 20 0 BEADRP C=C/C=C/CC[NH2+][C@@H]1[C@H](C)CCN[C@@H]1C ZINC000883429639 591659920 /nfs/dbraw/zinc/65/99/20/591659920.db2.gz AORYCBUOGPINEW-ZAGQHCIPSA-N 2 0 208.349 2.095 20 0 BEADRP C=C/C=C/CC[N@@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1 ZINC000883429362 591660053 /nfs/dbraw/zinc/66/00/53/591660053.db2.gz SOXWCNWDZCMVTE-WCYDHSITSA-N 2 0 234.387 2.440 20 0 BEADRP C[C@H]1[C@@H]([NH3+])CC[N@@H+]1C[C@@H]1CC(C)(C)OC1(C)C ZINC000883429844 591662021 /nfs/dbraw/zinc/66/20/21/591662021.db2.gz GFSTXTXNBNSZLP-SRVKXCTJSA-N 2 0 240.391 2.002 20 0 BEADRP C[N@H+](CC[C@H]1CCCC1(F)F)CC(C)(C)[NH3+] ZINC000883435009 591664259 /nfs/dbraw/zinc/66/42/59/591664259.db2.gz HSWUIZYAPSHHDL-SNVBAGLBSA-N 2 0 234.334 2.481 20 0 BEADRP [NH3+]CCC[N@@H+]1C[C@@H]2CC[C@H]1c1ccccc12 ZINC000883462774 591673825 /nfs/dbraw/zinc/67/38/25/591673825.db2.gz ZMJACJQSHCUKFY-FZMZJTMJSA-N 2 0 216.328 2.270 20 0 BEADRP Fc1ccc(C[NH2+]C[C@@H]2CCC[NH2+]C2)cc1F ZINC000132229391 591693931 /nfs/dbraw/zinc/69/39/31/591693931.db2.gz UHXVZPRMEWFSSE-LLVKDONJSA-N 2 0 240.297 2.054 20 0 BEADRP c1ccc2c(c1)CC[C@@H]([NH2+]C[C@@H]1CCC[NH2+]C1)C2 ZINC000132241562 591695971 /nfs/dbraw/zinc/69/59/71/591695971.db2.gz KUATWQTZEKAICM-CZUORRHYSA-N 2 0 244.382 2.133 20 0 BEADRP CSCC[C@@H](C)[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000134076311 591881825 /nfs/dbraw/zinc/88/18/25/591881825.db2.gz SPTILQUSTNTHCY-NEPJUHHUSA-N 2 0 244.448 2.448 20 0 BEADRP CSCC[C@H](C)[NH2+][C@H](C)C1CC[NH+](C)CC1 ZINC000134076523 591882402 /nfs/dbraw/zinc/88/24/02/591882402.db2.gz SPTILQUSTNTHCY-NWDGAFQWSA-N 2 0 244.448 2.448 20 0 BEADRP CN1CCC[C@H]([NH2+]CC2(C)CCCC2)C1 ZINC000134284635 591911994 /nfs/dbraw/zinc/91/19/94/591911994.db2.gz VSCYBENBPLZAGY-LBPRGKRZSA-N 2 0 210.365 2.251 20 0 BEADRP C[NH+](C)[C@@H]1CCC[C@H]([NH2+][C@@H]2CCCSC2)C1 ZINC000134807625 591950702 /nfs/dbraw/zinc/95/07/02/591950702.db2.gz CYTVXHVKYVZDFE-YNEHKIRRSA-N 2 0 242.432 2.344 20 0 BEADRP CCc1nccc(NCC[C@@H]2CCC[N@H+](C)C2)n1 ZINC000884528474 591967846 /nfs/dbraw/zinc/96/78/46/591967846.db2.gz PUJCVHOXZCTKMD-LBPRGKRZSA-N 2 0 248.374 2.183 20 0 BEADRP CCc1nccc(NC[C@@H]2CCCC[N@H+](C)C2)n1 ZINC000884564903 591982077 /nfs/dbraw/zinc/98/20/77/591982077.db2.gz UJGQFHQUSYLSLJ-LBPRGKRZSA-N 2 0 248.374 2.183 20 0 BEADRP [NH3+][C@@H]1CCCC[C@H]1[NH2+]CCSC(F)(F)F ZINC000886840133 592359655 /nfs/dbraw/zinc/35/96/55/592359655.db2.gz UPUJWLKTSWMXOE-HTQZYQBOSA-N 2 0 242.310 2.099 20 0 BEADRP C(C[N@@H+]1CCC[C@@]2(CC[NH2+]C2)C1)[C@@H]1C[C@H]1C1CC1 ZINC000886840150 592359797 /nfs/dbraw/zinc/35/97/97/592359797.db2.gz USGDZIHKHJGHSW-PMPSAXMXSA-N 2 0 248.414 2.498 20 0 BEADRP [NH3+]CCCCCC[N@@H+]1CC[C@H]([C@H]2CCCO2)C1 ZINC000886860272 592369885 /nfs/dbraw/zinc/36/98/85/592369885.db2.gz YGXJYBMBYVNFSB-UONOGXRCSA-N 2 0 240.391 2.006 20 0 BEADRP CC(C)C[N@@H+]1CCN(c2cc[nH+]cc2)C[C@@H]1C ZINC000887131289 592448592 /nfs/dbraw/zinc/44/85/92/592448592.db2.gz VABXDWYBWOIKDP-ZDUSSCGKSA-N 2 0 233.359 2.248 20 0 BEADRP CO[C@H]1C[N@H+](CCCCCCC[NH3+])CC[C@H]1C ZINC000300004928 592500171 /nfs/dbraw/zinc/50/01/71/592500171.db2.gz KSNULFSRECTKKI-KGLIPLIRSA-N 2 0 242.407 2.252 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]1[NH2+]CCCC1CC1 ZINC000300833805 592520815 /nfs/dbraw/zinc/52/08/15/592520815.db2.gz KVVLDJJRCQRVKZ-GFCCVEGCSA-N 2 0 210.365 2.154 20 0 BEADRP CSC(C)(C)C[C@@H](C)[N@H+](C)C[C@@H](C)C[NH3+] ZINC001258335132 991260400 /nfs/dbraw/zinc/26/04/00/991260400.db2.gz XFIUVFMPDHFRIB-WDEREUQCSA-N 2 0 232.437 2.433 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[NH2+]C12CCC2)CC(F)F ZINC000925707239 634394490 /nfs/dbraw/zinc/39/44/90/634394490.db2.gz DPHFRXGCKSDVOH-VHSXEESVSA-N 2 0 232.318 2.152 20 0 BEADRP C([C@H]1CCC[NH2+]1)[N@@H+]1CCC[C@H]2CCC[C@H]21 ZINC000299906266 634399316 /nfs/dbraw/zinc/39/93/16/634399316.db2.gz FCBHVLLQMLDUJW-JHJVBQTASA-N 2 0 208.349 2.003 20 0 BEADRP C[C@@H]1CC[C@@H](C)C1[NH2+]CC1=CC[N@H+](C)CC1 ZINC000925712395 634415698 /nfs/dbraw/zinc/41/56/98/634415698.db2.gz UHWACPWZMRYHEK-VXGBXAGGSA-N 2 0 222.376 2.273 20 0 BEADRP CC1(C[N@@H+]2CC[C@@]3(C2)CCC[NH2+]C3)CCC1 ZINC000334350285 634456848 /nfs/dbraw/zinc/45/68/48/634456848.db2.gz FCQFLDHFXYBBSD-AWEZNQCLSA-N 2 0 222.376 2.252 20 0 BEADRP FC1(F)C[C@@H]1CC[NH2+][C@H]1CC[NH2+]C12CCCC2 ZINC000925720354 634458121 /nfs/dbraw/zinc/45/81/21/634458121.db2.gz GSDXWTZRKSBVKE-QWRGUYRKSA-N 2 0 244.329 2.296 20 0 BEADRP FC1(F)C[C@@H]1CC[NH2+][C@@H]1CC[NH2+]C12CCCC2 ZINC000925720356 634458520 /nfs/dbraw/zinc/45/85/20/634458520.db2.gz GSDXWTZRKSBVKE-WDEREUQCSA-N 2 0 244.329 2.296 20 0 BEADRP FC1(F)C[C@H]1CC[NH2+][C@@H]1CC[NH2+]C12CCCC2 ZINC000925720351 634458677 /nfs/dbraw/zinc/45/86/77/634458677.db2.gz GSDXWTZRKSBVKE-GHMZBOCLSA-N 2 0 244.329 2.296 20 0 BEADRP [NH3+]CC[C@@H]1CC[N@H+](Cc2ccc(F)c(F)c2)C1 ZINC000125552843 634546174 /nfs/dbraw/zinc/54/61/74/634546174.db2.gz KGTSSJOJBNDCKF-SNVBAGLBSA-N 2 0 240.297 2.136 20 0 BEADRP C[C@H](C[C@H]1CCC[NH2+]1)[NH2+]Cc1cccc(F)c1 ZINC000093462930 634547496 /nfs/dbraw/zinc/54/74/96/634547496.db2.gz OEHBDKCXHHKGNG-BXUZGUMPSA-N 2 0 236.334 2.446 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H]1C=CCC1)[C@@H]1CCC[NH2+]1 ZINC000925731452 634563185 /nfs/dbraw/zinc/56/31/85/634563185.db2.gz KSEGKQQYKIEFDB-UPJWGTAASA-N 2 0 208.349 2.073 20 0 BEADRP CC[C@@H]([NH2+]C[C@H]1C=CCC1)[C@@H]1CCC[NH2+]1 ZINC000925731453 634565246 /nfs/dbraw/zinc/56/52/46/634565246.db2.gz KSEGKQQYKIEFDB-XQQFMLRXSA-N 2 0 208.349 2.073 20 0 BEADRP CC1(C)C[C@H]([NH3+])C[C@@H]([NH2+]C[C@H]2C=CCC2)C1 ZINC000925732220 634570161 /nfs/dbraw/zinc/57/01/61/634570161.db2.gz PBPLTVPSXPFENY-YNEHKIRRSA-N 2 0 222.376 2.448 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]CC1(CC2CC2)CC1 ZINC000925732458 634572934 /nfs/dbraw/zinc/57/29/34/634572934.db2.gz BEGUKURZNOSUFY-QWHCGFSZSA-N 2 0 222.376 2.284 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+]CC1(C)CC(F)(F)C1 ZINC000925734730 634584904 /nfs/dbraw/zinc/58/49/04/634584904.db2.gz UHWUBWSEHUHDJB-WDEREUQCSA-N 2 0 246.345 2.400 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]C[C@H]1C=CCC1 ZINC000925733216 634578857 /nfs/dbraw/zinc/57/88/57/634578857.db2.gz UIBHSFPEFOJOFR-YNEHKIRRSA-N 2 0 208.349 2.202 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+]CCCCC1CC1 ZINC000925734448 634585962 /nfs/dbraw/zinc/58/59/62/634585962.db2.gz PSZUTNAFDKKNEE-LBPRGKRZSA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@@H]([NH2+]CCC(C)(C)[NH3+])c1ccncc1 ZINC000925736483 634590566 /nfs/dbraw/zinc/59/05/66/634590566.db2.gz AJFZJEHXWOFFFV-GFCCVEGCSA-N 2 0 221.348 2.250 20 0 BEADRP C[C@@H]([NH2+]CCC(C)(C)[NH3+])c1ccc2c(c1)COC2 ZINC000925740353 634599152 /nfs/dbraw/zinc/59/91/52/634599152.db2.gz JOFAXPWZZCSXGQ-LLVKDONJSA-N 2 0 248.370 2.495 20 0 BEADRP C[C@@H]([NH2+]CCC(C)(C)[NH3+])c1ccc2c(c1)CCO2 ZINC000925741852 634604096 /nfs/dbraw/zinc/60/40/96/634604096.db2.gz UXNHEYVZPHRJNK-LLVKDONJSA-N 2 0 248.370 2.400 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H]1C[NH2+]CCC1(F)F)C(C)C ZINC000925777506 635260465 /nfs/dbraw/zinc/26/04/65/635260465.db2.gz FDPUOOYEACVJIO-WDEREUQCSA-N 2 0 234.334 2.255 20 0 BEADRP C[C@H]1C[N@H+](CCC2C[C@H]3CC[C@@H](C2)[NH2+]3)C[C@H]1C ZINC000225245958 635404600 /nfs/dbraw/zinc/40/46/00/635404600.db2.gz UTROKQBBOIBDKS-AXOHJZAGSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[C@H]1[C@@H]1C[C@H]1C)[C@@H]1CCC[NH2+]C1 ZINC000925824391 635413636 /nfs/dbraw/zinc/41/36/36/635413636.db2.gz SIUPASGFAXNWGQ-UCKQBZRPSA-N 2 0 222.376 2.009 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H]1C[C@H]1[C@@H]1C[C@H]1C ZINC000925824963 635418151 /nfs/dbraw/zinc/41/81/51/635418151.db2.gz XIXNEJOKLNAUED-RXGFPQBGSA-N 2 0 210.365 2.138 20 0 BEADRP CC(C)C[C@H](O)C[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000226076496 635422332 /nfs/dbraw/zinc/42/23/32/635422332.db2.gz PDQFXLZQKGGREX-NILFDRSVSA-N 2 0 248.370 2.128 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+]C[C@]12C[C@H]1CCC2 ZINC000925881821 635610714 /nfs/dbraw/zinc/61/07/14/635610714.db2.gz VFOILPVEAJCCCD-CRWXNKLISA-N 2 0 222.376 2.154 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+]C[C@H]1CC1(Cl)Cl ZINC000308695400 631356407 /nfs/dbraw/zinc/35/64/07/631356407.db2.gz STNFAOWEDDQDMB-RKDXNWHRSA-N 2 0 239.190 2.110 20 0 BEADRP C[C@@H](C[C@H]1CCC[NH2+]1)[NH2+][C@H]1CC[C@@H](C)C1 ZINC000253234113 631680788 /nfs/dbraw/zinc/68/07/88/631680788.db2.gz DAURMCVEJUAISJ-XQHKEYJVSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H]1CC[C@@H]1[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000309033009 631805941 /nfs/dbraw/zinc/80/59/41/631805941.db2.gz CVRCDGXCERIIBY-RYUDHWBXSA-N 2 0 210.365 2.106 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@@H]1CCOC12CCCC2 ZINC000934395042 631821117 /nfs/dbraw/zinc/82/11/17/631821117.db2.gz IYNLJCQCUIFBEA-CYBMUJFWSA-N 2 0 240.391 2.020 20 0 BEADRP CC[C@@H](C)NC(=[NH2+])NCC[NH+](C(C)C)C(C)C ZINC000848980946 631842157 /nfs/dbraw/zinc/84/21/57/631842157.db2.gz MHVFTLUVYZFLSR-GFCCVEGCSA-N 2 0 242.411 2.018 20 0 BEADRP CSC1(C[NH2+][C@@H]2CCC[NH2+]CC2)CCC1 ZINC000235089731 631945663 /nfs/dbraw/zinc/94/56/63/631945663.db2.gz DQZWXGIKJLAFHC-LLVKDONJSA-N 2 0 228.405 2.004 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2CCC[C@@H](C)[C@@H]2C)CC[NH2+]1 ZINC000235368175 632028383 /nfs/dbraw/zinc/02/83/83/632028383.db2.gz LDGOYXDXDFYFRM-YIYPIFLZSA-N 2 0 224.392 2.495 20 0 BEADRP CC(C)[N@H+](C[C@@H]1CC[C@H]([NH3+])C1)C1CCC1 ZINC000309406550 632049301 /nfs/dbraw/zinc/04/93/01/632049301.db2.gz HZSJLCANTUTURG-NEPJUHHUSA-N 2 0 210.365 2.377 20 0 BEADRP C[C@@H]1CCC[C@H](C[N@@H+]2CC[C@@H](CC[NH3+])C2)C1 ZINC000309480281 632419758 /nfs/dbraw/zinc/41/97/58/632419758.db2.gz WNQIBEFJYSKGLK-MCIONIFRSA-N 2 0 224.392 2.483 20 0 BEADRP C[N@H+](Cc1cccc(O)c1)C1CCC([NH3+])CC1 ZINC000091843664 632503747 /nfs/dbraw/zinc/50/37/47/632503747.db2.gz CLZKCRZEMLYPTO-UHFFFAOYSA-N 2 0 234.343 2.094 20 0 BEADRP CC[C@@H](C)C[N@H+](C)C[C@@]1(C)CCC[NH2+]C1 ZINC000219753302 632561833 /nfs/dbraw/zinc/56/18/33/632561833.db2.gz QHCBIGODYLZGAA-OLZOCXBDSA-N 2 0 212.381 2.354 20 0 BEADRP C[C@@H]([N@H+](C)C[C@@H]1C[NH2+]C[C@H]1C)C(C)(C)C ZINC000235262735 632592025 /nfs/dbraw/zinc/59/20/25/632592025.db2.gz BIUUQZIYJSHQDQ-UTUOFQBUSA-N 2 0 212.381 2.208 20 0 BEADRP C[C@@H]1C[C@H](C[NH2+]CC2(C)CCC2)CC[NH2+]1 ZINC000235373142 632678856 /nfs/dbraw/zinc/67/88/56/632678856.db2.gz DKVRTHJPIPJZMU-VXGBXAGGSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H](Cc1ccccn1)[NH2+]CC(C)(C)C[NH+](C)C ZINC000924527023 632686657 /nfs/dbraw/zinc/68/66/57/632686657.db2.gz MZWGAVFQEMXGTQ-ZDUSSCGKSA-N 2 0 249.402 2.190 20 0 BEADRP C[C@H](Cc1ccccn1)[NH2+]CC(C)(C)C[NH+](C)C ZINC000924527022 632686914 /nfs/dbraw/zinc/68/69/14/632686914.db2.gz MZWGAVFQEMXGTQ-CYBMUJFWSA-N 2 0 249.402 2.190 20 0 BEADRP CCC[N@H+](C)C[C@H]1CCN(C/C=C/Cl)C1 ZINC000177035097 632692829 /nfs/dbraw/zinc/69/28/29/632692829.db2.gz FBKJTFZLKWFPJU-FVOPLDGLSA-N 2 0 230.783 2.403 20 0 BEADRP C[C@H](CC(F)(F)F)[NH2+][C@H]1CCC[NH2+]CC1 ZINC000235468505 632762023 /nfs/dbraw/zinc/76/20/23/632762023.db2.gz RUNFIZUEJZDYRL-BDAKNGLRSA-N 2 0 224.270 2.059 20 0 BEADRP C[N@H+]1C[C@H]2CC[C@@H](C1)C2[NH2+]CC1=CCCC1 ZINC000926717964 632866424 /nfs/dbraw/zinc/86/64/24/632866424.db2.gz XOPGQYTVAUBUER-PBWFPOADSA-N 2 0 220.360 2.027 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]CC[C@@H]2CCOC2)c2ccccc21 ZINC000236308009 632916791 /nfs/dbraw/zinc/91/67/91/632916791.db2.gz TWKVMURXPCOGGI-DFBGVHRSSA-N 2 0 246.354 2.147 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2CCC[C@H](C3CC3)C2)CC1 ZINC000894520882 635903041 /nfs/dbraw/zinc/90/30/41/635903041.db2.gz HKAXXSFFFJQZJE-HNNXBMFYSA-N 2 0 236.403 2.450 20 0 BEADRP Cc1ccc(OCC[N@@H+]2CC[C@](C)(C[NH3+])C2)cc1 ZINC000311219480 633085875 /nfs/dbraw/zinc/08/58/75/633085875.db2.gz TZEDIRSHDNEMAG-OAHLLOKOSA-N 2 0 248.370 2.045 20 0 BEADRP CSCCC[NH2+][C@@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925503451 633828165 /nfs/dbraw/zinc/82/81/65/633828165.db2.gz KLJRITHDHIYRFV-GHMZBOCLSA-N 2 0 230.421 2.235 20 0 BEADRP CCCC[C@H](COC)[NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2 ZINC000925503609 633829833 /nfs/dbraw/zinc/82/98/33/633829833.db2.gz KQIRACGWZXBUFZ-JHJVBQTASA-N 2 0 240.391 2.051 20 0 BEADRP Cc1cc(C[NH2+][C@@H]2C[C@H]([NH3+])C23CCC3)ccc1F ZINC000925512667 633854229 /nfs/dbraw/zinc/85/42/29/633854229.db2.gz AHGMPEWKLXOJLS-UONOGXRCSA-N 2 0 248.345 2.494 20 0 BEADRP CC(C)C[C@H](C)C[N@@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1 ZINC000309427223 633917175 /nfs/dbraw/zinc/91/71/75/633917175.db2.gz XFCSFKOTGOBXHV-MELADBBJSA-N 2 0 224.392 2.210 20 0 BEADRP CCSCC[C@@H](C)[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000925528140 633917945 /nfs/dbraw/zinc/91/79/45/633917945.db2.gz TUBPHMFGIMRKET-NEPJUHHUSA-N 2 0 242.432 2.392 20 0 BEADRP CC[NH+]1CCC(CC[NH2+][C@@H]2CC[C@@H]2C)CC1 ZINC000309942830 633967487 /nfs/dbraw/zinc/96/74/87/633967487.db2.gz CFZWYWZYOWWPDW-GXTWGEPZSA-N 2 0 224.392 2.497 20 0 BEADRP CC1CC([NH2+][C@@H]2C[C@H]([NH3+])CC(C)(C)C2)C1 ZINC000925575490 634072952 /nfs/dbraw/zinc/07/29/52/634072952.db2.gz HBQUFJYWZXWWSC-POSLAHMBSA-N 2 0 210.365 2.281 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+]CC1(C2CC2)CC1 ZINC000925589992 634103739 /nfs/dbraw/zinc/10/37/39/634103739.db2.gz MRRHMUANSDWYFN-WHCAJBEMSA-N 2 0 234.387 2.282 20 0 BEADRP CCC[C@@H]1C[C@H]1[NH2+][C@@H]1C[C@H]([NH3+])C12CCC2 ZINC000925603955 634132797 /nfs/dbraw/zinc/13/27/97/634132797.db2.gz GSEQXEHJIIULQA-WISYIIOYSA-N 2 0 208.349 2.035 20 0 BEADRP CCC(O)(CC)C[NH2+][C@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925615431 634161565 /nfs/dbraw/zinc/16/15/65/634161565.db2.gz GHVWAGRLVJTNQT-NEPJUHHUSA-N 2 0 242.407 2.033 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+]CC1(C2CC2)CCC1 ZINC000925620961 634179766 /nfs/dbraw/zinc/17/97/66/634179766.db2.gz DVONBPDUTCMWOS-LBPRGKRZSA-N 2 0 222.376 2.297 20 0 BEADRP CSC1(C[NH2+][C@@H]2CC[NH2+]C23CCCC3)CC1 ZINC000925654700 634217032 /nfs/dbraw/zinc/21/70/32/634217032.db2.gz BQKZLMOLZARQIP-LLVKDONJSA-N 2 0 240.416 2.146 20 0 BEADRP CC1(C)SC[C@H]1[NH2+][C@@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925666860 634241300 /nfs/dbraw/zinc/24/13/00/634241300.db2.gz OKOCBEQWMGOCJI-GMTAPVOTSA-N 2 0 242.432 2.376 20 0 BEADRP FCCCC[NH2+][C@H]1CC[NH2+]C[C@@H]1C1CCCC1 ZINC000925677634 634269627 /nfs/dbraw/zinc/26/96/27/634269627.db2.gz XFPHPFIXFLSYBI-KGLIPLIRSA-N 2 0 242.382 2.494 20 0 BEADRP CC[C@@H]1CCC[C@@H]1C[NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32 ZINC000925679690 634277028 /nfs/dbraw/zinc/27/70/28/634277028.db2.gz LSAJYYOZZABUFH-FFNDWZFNSA-N 2 0 248.414 2.399 20 0 BEADRP Cc1cc(C[NH2+][C@H]2C[C@@H]([NH3+])CC(C)(C)C2)ccn1 ZINC000925680745 634278352 /nfs/dbraw/zinc/27/83/52/634278352.db2.gz TVQFBMOWCWZVIA-KGLIPLIRSA-N 2 0 247.386 2.386 20 0 BEADRP CC(C)[NH2+]CCCN[C@@H](c1ccccc1)[C@@H](C)[NH3+] ZINC000925695258 634345117 /nfs/dbraw/zinc/34/51/17/634345117.db2.gz VBASZSGIUZCEJP-UKRRQHHQSA-N 2 0 249.402 2.053 20 0 BEADRP CC(C)C[C@@H]1C[C@H]1[NH2+][C@H]1C[C@@H]([NH3+])C12CCC2 ZINC000925696903 634356738 /nfs/dbraw/zinc/35/67/38/634356738.db2.gz VMAUUECTXDWPDB-LPWJVIDDSA-N 2 0 222.376 2.281 20 0 BEADRP C[C@H](C1CC1)[NH+]1CCC(C)([NH+]2CCC2)CC1 ZINC000931700920 635253067 /nfs/dbraw/zinc/25/30/67/635253067.db2.gz SJFOODGKXLXEAE-GFCCVEGCSA-N 2 0 222.376 2.345 20 0 BEADRP CCC[C@H]([NH2+][C@@H]1C[NH2+]C[C@H]1C)C1CCC1 ZINC000925783784 635292064 /nfs/dbraw/zinc/29/20/64/635292064.db2.gz LBVLFQIICPABPF-KGYLQXTDSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@H]1CCCC[C@H]1[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000925783762 635293307 /nfs/dbraw/zinc/29/33/07/635293307.db2.gz GSSOXVKQIXDYML-ZOBORPQBSA-N 2 0 224.392 2.400 20 0 BEADRP CCC[C@@H]([NH2+][C@@H]1C[NH2+]C[C@H]1C)C1CCC1 ZINC000925783785 635297013 /nfs/dbraw/zinc/29/70/13/635297013.db2.gz LBVLFQIICPABPF-RAIGVLPGSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1C[NH2+]C[C@H]1C)c1cccs1 ZINC000925790551 635317106 /nfs/dbraw/zinc/31/71/06/635317106.db2.gz IQPRZRPXWFKXTM-VWYCJHECSA-N 2 0 224.373 2.254 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+][C@H]1CCC12CCC2 ZINC000925802780 635353220 /nfs/dbraw/zinc/35/32/20/635353220.db2.gz IVKPLRRCSBSQTG-UPJWGTAASA-N 2 0 222.376 2.154 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]CC[C@@H]1CC[C@H]2C[C@H]21 ZINC000925804438 635356480 /nfs/dbraw/zinc/35/64/80/635356480.db2.gz HJKNLJMWUYWGGT-QTVXIADOSA-N 2 0 236.403 2.400 20 0 BEADRP COC[C@@H](C[NH2+][C@@H](C)[C@H]1CCCC[NH2+]1)C(C)C ZINC000925874400 635595156 /nfs/dbraw/zinc/59/51/56/635595156.db2.gz RKCNJGZZEZPBHY-BFHYXJOUSA-N 2 0 242.407 2.025 20 0 BEADRP COC[C@H](C[NH2+][C@@H](C)[C@H]1CCCC[NH2+]1)C(C)C ZINC000925874411 635596012 /nfs/dbraw/zinc/59/60/12/635596012.db2.gz RKCNJGZZEZPBHY-MELADBBJSA-N 2 0 242.407 2.025 20 0 BEADRP [NH3+]C[C@H]1CC[N@H+](CCOC2CCCCCC2)C1 ZINC000430947395 636371471 /nfs/dbraw/zinc/37/14/71/636371471.db2.gz DQOGNGWUIMCEOT-CYBMUJFWSA-N 2 0 240.391 2.006 20 0 BEADRP CC(C)[NH+](CCC[NH2+][C@@H]1COC[C@H]1C)C(C)C ZINC000925197116 636375983 /nfs/dbraw/zinc/37/59/83/636375983.db2.gz QBOTWPZFSQEDEK-ZIAGYGMSSA-N 2 0 242.407 2.120 20 0 BEADRP C[C@H](C[NH2+][C@@H](C)CCc1cccnc1)C[NH+](C)C ZINC000866364812 636882070 /nfs/dbraw/zinc/88/20/70/636882070.db2.gz QBZNNUXKIWUGEW-KGLIPLIRSA-N 2 0 249.402 2.190 20 0 BEADRP FC(F)(F)C1CCC([NH2+][C@H]2CC[NH2+]C2)CC1 ZINC000086727458 636887971 /nfs/dbraw/zinc/88/79/71/636887971.db2.gz LLCPRBAJNQAQAY-RTBKNWGFSA-N 2 0 236.281 2.059 20 0 BEADRP [NH3+]CCCCCC[N@@H+]1CC[C@H]2CSC[C@@H]2C1 ZINC000866704868 636933971 /nfs/dbraw/zinc/93/39/71/636933971.db2.gz ZAFAXPRKSYZRKG-STQMWFEESA-N 2 0 242.432 2.190 20 0 BEADRP C[C@@H]1C[N@H+](CCCCCCC[NH3+])CC(C)(C)O1 ZINC000041681550 637016251 /nfs/dbraw/zinc/01/62/51/637016251.db2.gz ACPGEJAKXNQNDU-CYBMUJFWSA-N 2 0 242.407 2.395 20 0 BEADRP CCCCC[C@@H](C)[NH2+]C[C@H](O)C[NH+]1CCCC1 ZINC000042238387 637090854 /nfs/dbraw/zinc/09/08/54/637090854.db2.gz XDDMXMRMFTYOEK-KGLIPLIRSA-N 2 0 242.407 2.002 20 0 BEADRP CCC1CC[NH+](C[C@@H]2CCC[NH2+]C2)CC1 ZINC000042447390 637255181 /nfs/dbraw/zinc/25/51/81/637255181.db2.gz XRDMOLNXFUOKRP-CYBMUJFWSA-N 2 0 210.365 2.108 20 0 BEADRP Cc1cc(C)nc(C[N@@H+]2CC[C@H](C[NH3+])[C@@H](C)C2)c1 ZINC000903789398 637383737 /nfs/dbraw/zinc/38/37/37/637383737.db2.gz WLZFPKSMIOVVJU-GXTWGEPZSA-N 2 0 247.386 2.115 20 0 BEADRP [NH3+][C@H]1C[C@H]2C[C@@H](C1)[N@H+](CCc1cccc(F)c1)C2 ZINC000903841642 637385324 /nfs/dbraw/zinc/38/53/24/637385324.db2.gz YXKSLJXENFAEGE-QEJZJMRPSA-N 2 0 248.345 2.180 20 0 BEADRP CC(C)([NH3+])C[N@@H+]1C[C@@H]2[C@@H]3CC[C@@H](C3)[C@]2(C)C1 ZINC000904461522 637405909 /nfs/dbraw/zinc/40/59/09/637405909.db2.gz CLUSFLAGHIWHKV-CZXHOFHRSA-N 2 0 222.376 2.092 20 0 BEADRP CC(C)(C[NH3+])C1CC[NH+](CC2(F)CC2)CC1 ZINC000904445889 637414267 /nfs/dbraw/zinc/41/42/67/637414267.db2.gz TZWNSGPINAFAAV-UHFFFAOYSA-N 2 0 228.355 2.185 20 0 BEADRP CCC(CC)[NH2+][C@@H](C)CN(C)CCC[NH+](C)C ZINC000668475597 637884978 /nfs/dbraw/zinc/88/49/78/637884978.db2.gz UAQLKGZKGVMTKR-ZDUSSCGKSA-N 2 0 243.439 2.037 20 0 BEADRP CCCCOc1ccc(C[NH2+]C2CC([NH3+])C2)cc1 ZINC000906508680 638181761 /nfs/dbraw/zinc/18/17/61/638181761.db2.gz UNUZXOIJCQMWJY-UHFFFAOYSA-N 2 0 248.370 2.445 20 0 BEADRP Cc1nc2ccc(C[NH2+]C3CC([NH3+])C3)cc2s1 ZINC000906511046 638184015 /nfs/dbraw/zinc/18/40/15/638184015.db2.gz QXJLVGBQCBSQFS-UHFFFAOYSA-N 2 0 247.367 2.184 20 0 BEADRP Cc1cc(C[NH2+][C@H]2C[C@H]([NH3+])C2)ccc1Cl ZINC000906516273 638185883 /nfs/dbraw/zinc/18/58/83/638185883.db2.gz AOAQSWGLIHEPMO-XYPYZODXSA-N 2 0 224.735 2.228 20 0 BEADRP C[C@@H](CCc1ccccc1)C[NH2+][C@H]1C[C@H]([NH3+])C1 ZINC000906518353 638188496 /nfs/dbraw/zinc/18/84/96/638188496.db2.gz XDDSTAHYIAENGA-QEJZJMRPSA-N 2 0 232.371 2.335 20 0 BEADRP CCCC[NH2+]CCC1CC[NH+](CC)CC1 ZINC000906529103 638194490 /nfs/dbraw/zinc/19/44/90/638194490.db2.gz FETOCBJZOTVPOC-UHFFFAOYSA-N 2 0 212.381 2.498 20 0 BEADRP C[N@@H+]1CC[C@]2(CC[NH+](CCCC(C)(F)F)C2)C1 ZINC000930554888 639810453 /nfs/dbraw/zinc/81/04/53/639810453.db2.gz JKEZHEKOCIUNHX-ZDUSSCGKSA-N 2 0 246.345 2.449 20 0 BEADRP C[C@H](C1CC1)[N@@H+]1CCC[C@]2(CC[NH+](C)C2)C1 ZINC000930602258 639817205 /nfs/dbraw/zinc/81/72/05/639817205.db2.gz OLYWYGRYUYLNBP-TZMCWYRMSA-N 2 0 222.376 2.203 20 0 BEADRP CN1C[C@]2(C)C[N@H+](CC3CCCC3)C[C@]2(C)C1 ZINC000931310508 640146042 /nfs/dbraw/zinc/14/60/42/640146042.db2.gz ZEWVPXWHYNWECB-GASCZTMLSA-N 2 0 236.403 2.450 20 0 BEADRP C=C/C=C/CC[N@H+]1C[C@@]2(C)CN(C)C[C@@]2(C)C1 ZINC000931317180 640155329 /nfs/dbraw/zinc/15/53/29/640155329.db2.gz NLACSIXOKUIDSP-JRIJJQDJSA-N 2 0 234.387 2.392 20 0 BEADRP CC[C@H](C)C[NH+]1CCC(C)([NH+](C)C)CC1 ZINC000931351302 640167573 /nfs/dbraw/zinc/16/75/73/640167573.db2.gz KQWHWQXNTQRKTN-LBPRGKRZSA-N 2 0 212.381 2.449 20 0 BEADRP Cc1ccc(C[NH2+]CC2CC[NH+](C)CC2)s1 ZINC000044516030 640398753 /nfs/dbraw/zinc/39/87/53/640398753.db2.gz IYAQQUJFYTZODT-UHFFFAOYSA-N 2 0 238.400 2.488 20 0 BEADRP COc1cccc(C[N@H+](C)C2CCC([NH3+])CC2)c1 ZINC000055144475 640440096 /nfs/dbraw/zinc/44/00/96/640440096.db2.gz JWBAEPMAUOTDCH-UHFFFAOYSA-N 2 0 248.370 2.397 20 0 BEADRP Cc1ccc(C[N@@H+](C)C2CCC([NH3+])CC2)nc1 ZINC000156606096 640470204 /nfs/dbraw/zinc/47/02/04/640470204.db2.gz VUXQRPQCVHPQLO-UHFFFAOYSA-N 2 0 233.359 2.092 20 0 BEADRP CCCCCC[N@@H+]1CC[C@@H](C)[C@H](C[NH3+])C1 ZINC000164646012 640493172 /nfs/dbraw/zinc/49/31/72/640493172.db2.gz JHSGXEFDUZQBCQ-CHWSQXEVSA-N 2 0 212.381 2.483 20 0 BEADRP CC(C)CCC[N@@H+]1CC[C@H](C[NH3+])[C@H](C)C1 ZINC000165418601 640575532 /nfs/dbraw/zinc/57/55/32/640575532.db2.gz HAPWFINZTKCUBV-CHWSQXEVSA-N 2 0 212.381 2.339 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@@H+]1CCC[C@@H]2CCCC[C@@H]21 ZINC000223931430 640594522 /nfs/dbraw/zinc/59/45/22/640594522.db2.gz HGLTZSKYRSLMIQ-QPSCCSFWSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H](C[N@@H+]1CC[C@@H](C[NH3+])C1)c1ccccc1 ZINC000224206845 640605730 /nfs/dbraw/zinc/60/57/30/640605730.db2.gz AXCCSGLZYHMTOD-STQMWFEESA-N 2 0 218.344 2.071 20 0 BEADRP C[N@@H+]1C[C@@H]2C[NH+](CCc3ccccc3)C[C@]2(C)C1 ZINC000933736023 640756133 /nfs/dbraw/zinc/75/61/33/640756133.db2.gz QKZRWESRUXUWEN-CVEARBPZSA-N 2 0 244.382 2.113 20 0 BEADRP CC(C)CCC[N@@H+]1C[C@@H]2C[NH+](C)C[C@]2(C)C1 ZINC000933734054 640756844 /nfs/dbraw/zinc/75/68/44/640756844.db2.gz NVRYDDAZGAJCSA-UONOGXRCSA-N 2 0 224.392 2.306 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@@H]1CCc2cccnc21 ZINC000226818222 640793844 /nfs/dbraw/zinc/79/38/44/640793844.db2.gz YISQHWHNZJUFKD-CYBMUJFWSA-N 2 0 233.359 2.000 20 0 BEADRP COc1ccc(C[N@@H+]2CC[C@H]([NH3+])[C@@H](C)C2)cc1C ZINC000227055474 640812995 /nfs/dbraw/zinc/81/29/95/640812995.db2.gz MANXCNSPESYZGM-JSGCOSHPSA-N 2 0 248.370 2.173 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]C[C@@H]1CC=CCC1 ZINC000227126938 640817086 /nfs/dbraw/zinc/81/70/86/640817086.db2.gz BZASSFVPXIYXQK-HZSPNIEDSA-N 2 0 222.376 2.450 20 0 BEADRP [NH3+]C1CC([NH2+][C@H]2CCC[C@H](C(F)(F)F)C2)C1 ZINC000087651572 640957586 /nfs/dbraw/zinc/95/75/86/640957586.db2.gz UXARPYILYBLTDX-FMLYDFSMSA-N 2 0 236.281 2.187 20 0 BEADRP CC[N@H+](CC1CCC1)C[C@@]1(C)CCC[NH2+]C1 ZINC000230321326 641047806 /nfs/dbraw/zinc/04/78/06/641047806.db2.gz RSZNYUIVEAMPQU-AWEZNQCLSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H]1CCC[C@H]1C[NH2+]CC1CC[NH+](C)CC1 ZINC000230664538 641081904 /nfs/dbraw/zinc/08/19/04/641081904.db2.gz MRXRTSUCEKRWSP-OCCSQVGLSA-N 2 0 224.392 2.354 20 0 BEADRP CCC1CC[NH+](C[C@]2(C)CCC[NH2+]C2)CC1 ZINC000062862425 641099801 /nfs/dbraw/zinc/09/98/01/641099801.db2.gz NGRCDJBPRXJIQL-CQSZACIVSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H]1C[C@@H](C)C[NH+](C[C@]2(C)CCC[NH2+]C2)C1 ZINC000062861773 641100607 /nfs/dbraw/zinc/10/06/07/641100607.db2.gz STIHNLVQLMFBQI-MGPQQGTHSA-N 2 0 224.392 2.354 20 0 BEADRP CC1(C)CC[N@H+](CC2CC[NH2+]CC2)CCS1 ZINC000231047914 641131883 /nfs/dbraw/zinc/13/18/83/641131883.db2.gz BDMUOEXHAUOXDN-UHFFFAOYSA-N 2 0 242.432 2.204 20 0 BEADRP C[NH+](C)CCOCC[NH2+]C1CCCCCCC1 ZINC000231786875 641203875 /nfs/dbraw/zinc/20/38/75/641203875.db2.gz JFMKCAUOEWTPPN-UHFFFAOYSA-N 2 0 242.407 2.267 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000929697056 641402563 /nfs/dbraw/zinc/40/25/63/641402563.db2.gz QEPSXSFYVCRKKX-KFWWJZLASA-N 2 0 236.403 2.450 20 0 BEADRP C[C@@H](CSC(C)(C)C)[NH2+]CCC[NH+](C)C ZINC000151930755 641482963 /nfs/dbraw/zinc/48/29/63/641482963.db2.gz AQRVENYDONKGPE-NSHDSACASA-N 2 0 232.437 2.448 20 0 BEADRP CC(C)[C@H](C)[NH2+]Cc1ccc(CC[NH3+])cc1 ZINC000318998301 641602093 /nfs/dbraw/zinc/60/20/93/641602093.db2.gz MGUIJOFHPQMBDG-LBPRGKRZSA-N 2 0 220.360 2.322 20 0 BEADRP C[NH+](C)CCC[NH2+][C@H](C1CC1)C(C)(C)C ZINC000324335140 641705567 /nfs/dbraw/zinc/70/55/67/641705567.db2.gz CGRSDIRMBWTAFI-GFCCVEGCSA-N 2 0 212.381 2.352 20 0 BEADRP CCCCC[C@H](C)[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000232951265 641799523 /nfs/dbraw/zinc/79/95/23/641799523.db2.gz ZXVCDXVBCKHZLU-AGIUHOORSA-N 2 0 212.381 2.400 20 0 BEADRP Cc1ccc(CC[N@@H+]2CC[C@H](CC[NH3+])C2)cc1 ZINC000076679628 641819953 /nfs/dbraw/zinc/81/99/53/641819953.db2.gz UZTCGNBXKHLGJL-HNNXBMFYSA-N 2 0 232.371 2.208 20 0 BEADRP [NH3+]CC[C@H]1CCCC[N@@H+]1CCc1cccs1 ZINC000069721204 642411408 /nfs/dbraw/zinc/41/14/08/642411408.db2.gz HWOBIDWYDQEPSB-GFCCVEGCSA-N 2 0 238.400 2.494 20 0 BEADRP [NH3+]CCc1ccc(C[NH2+]C2CCCC2)cc1 ZINC000070533140 642433408 /nfs/dbraw/zinc/43/34/08/642433408.db2.gz QKTDOEWGAUQDAR-UHFFFAOYSA-N 2 0 218.344 2.220 20 0 BEADRP CCC1(C[NH2+]C2CCC([NH3+])CC2)CCC1 ZINC000232992683 642643576 /nfs/dbraw/zinc/64/35/76/642643576.db2.gz UXIDCPTUTLQAAZ-UHFFFAOYSA-N 2 0 210.365 2.426 20 0 BEADRP CC[N@H+](C[C@@H]1C[NH2+]C[C@H]1C)C1CCCCC1 ZINC000233486854 642674192 /nfs/dbraw/zinc/67/41/92/642674192.db2.gz XPJGGBSIPJRFKC-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP CCO[C@@H]1C[C@H]([NH2+]CCCCCC[NH3+])C1(C)C ZINC000233764758 642692781 /nfs/dbraw/zinc/69/27/81/642692781.db2.gz QDEIVPQSCDUSQK-QWHCGFSZSA-N 2 0 242.407 2.299 20 0 BEADRP [NH3+]CCc1ccc(C[NH2+]C(C2CC2)C2CC2)cc1 ZINC000070542758 643032012 /nfs/dbraw/zinc/03/20/12/643032012.db2.gz WGJYQSNNLZTPNX-UHFFFAOYSA-N 2 0 244.382 2.466 20 0 BEADRP C[N@@H+]1CCC[C@@H]2CN(C/C=C\Cl)CC[C@H]21 ZINC000255048100 643282121 /nfs/dbraw/zinc/28/21/21/643282121.db2.gz XRNXTWPJMRBORC-BCIKPAMSSA-N 2 0 228.767 2.155 20 0 BEADRP [NH3+]CCCCCC[NH2+][C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000843344088 643327793 /nfs/dbraw/zinc/32/77/93/643327793.db2.gz QAEBFSLSWHGMJC-GJZGRUSLSA-N 3 0 247.386 2.240 20 0 BEADRP CC[NH2+]CC1CC[NH+](C/C=C/Cl)CC1 ZINC000082645653 643362844 /nfs/dbraw/zinc/36/28/44/643362844.db2.gz KHPHWYIDYNEORC-ZZXKWVIFSA-N 2 0 216.756 2.060 20 0 BEADRP CC[C@H]1CCCC[N@@H+]1C[C@@H]1C[NH2+]C[C@H]1C ZINC000234072419 643424590 /nfs/dbraw/zinc/42/45/90/643424590.db2.gz PBDPOLWDOLGFDK-AGIUHOORSA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@@H]1CCCC[N@@H+]1C[C@@H]1CC[C@H]([NH3+])C1 ZINC000085014515 643523230 /nfs/dbraw/zinc/52/32/30/643523230.db2.gz FRXXXTIBVSWYTK-FRRDWIJNSA-N 2 0 210.365 2.378 20 0 BEADRP CC1(C[NH2+][C@@H]2CCC[C@@H]2C[NH3+])CCCC1 ZINC000084222015 643651239 /nfs/dbraw/zinc/65/12/39/643651239.db2.gz WTFHSDCPEGQPSB-VXGBXAGGSA-N 2 0 210.365 2.284 20 0 BEADRP Cc1ncsc1C[NH2+][C@H]1CCCC[C@@H]1C[NH3+] ZINC000084216804 643651256 /nfs/dbraw/zinc/65/12/56/643651256.db2.gz NTNYQFDCGIOWMU-MNOVXSKESA-N 2 0 239.388 2.059 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CCC[C@H]2C[NH3+])s1 ZINC000084221311 643651288 /nfs/dbraw/zinc/65/12/88/643651288.db2.gz VUWIWYGLJFUFEV-JQWIXIFHSA-N 2 0 224.373 2.274 20 0 BEADRP Cc1ccsc1C[NH2+]CCC(C)(C)[NH3+] ZINC000087310026 643654345 /nfs/dbraw/zinc/65/43/45/643654345.db2.gz FQLDNHHIJFLGIW-UHFFFAOYSA-N 2 0 212.362 2.274 20 0 BEADRP C[N@@H+](Cc1cccs1)C[C@@H]1CC[C@H]([NH3+])C1 ZINC000085014617 643678583 /nfs/dbraw/zinc/67/85/83/643678583.db2.gz YYEBKMSXEGBVQK-MNOVXSKESA-N 2 0 224.373 2.307 20 0 BEADRP CCCC[N@H+](C[C@@H]1CC[C@H]([NH3+])C1)C1CC1 ZINC000085015176 643678932 /nfs/dbraw/zinc/67/89/32/643678932.db2.gz SMNPMSCYZRHZPP-NEPJUHHUSA-N 2 0 210.365 2.378 20 0 BEADRP C[C@@H]([N@H+](C)C[C@@H]1CC[C@H]([NH3+])C1)C(C)(C)C ZINC000085015399 643679170 /nfs/dbraw/zinc/67/91/70/643679170.db2.gz ZIBDKXXTGUPSRV-UTUOFQBUSA-N 2 0 212.381 2.480 20 0 BEADRP CC[C@H](C)C[N@H+](CC)CCC[NH2+]C1CC1 ZINC000086437506 644134199 /nfs/dbraw/zinc/13/41/99/644134199.db2.gz AQKVJQJPXSFKLR-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP CCC(CC)(CC)[NH2+]C[C@H](O)C[NH+]1CCCC1 ZINC000086642764 644159428 /nfs/dbraw/zinc/15/94/28/644159428.db2.gz XOCYLFATRCCOPX-ZDUSSCGKSA-N 2 0 242.407 2.002 20 0 BEADRP CCC1CCC(C[NH2+][C@H]2CC[NH2+]C2)CC1 ZINC000086728865 644170509 /nfs/dbraw/zinc/17/05/09/644170509.db2.gz OXLWLHIGXRSNPU-BPCQOVAHSA-N 2 0 210.365 2.154 20 0 BEADRP CCC1CC[NH+](C[C@@H]2CC[NH2+][C@@H](C)C2)CC1 ZINC000232898060 644171528 /nfs/dbraw/zinc/17/15/28/644171528.db2.gz QZZQNDADZFUXJA-GXTWGEPZSA-N 2 0 224.392 2.497 20 0 BEADRP C[N@H+](CCC[NH2+]C1CC1)C1Cc2ccccc2C1 ZINC000923308419 644340503 /nfs/dbraw/zinc/34/05/03/644340503.db2.gz BUSDFZOWLDRMMV-UHFFFAOYSA-N 2 0 244.382 2.228 20 0 BEADRP C[N@H+](CCC[NH2+]C1CC1)C(C1CC1)C1CC1 ZINC000923310523 644345820 /nfs/dbraw/zinc/34/58/20/644345820.db2.gz IOZZAFOZELZNHK-UHFFFAOYSA-N 2 0 222.376 2.249 20 0 BEADRP [NH3+][C@@H]1CC[C@H]2C[N@H+](CCc3cccc(F)c3)C[C@@H]12 ZINC000923331778 644361226 /nfs/dbraw/zinc/36/12/26/644361226.db2.gz ICQRRIFGFUIMFO-NWANDNLSSA-N 2 0 248.345 2.037 20 0 BEADRP c1ccc([C@@H]2CCN(CCC[NH2+]C3CC3)C2)nc1 ZINC000923370230 644382228 /nfs/dbraw/zinc/38/22/28/644382228.db2.gz SPMIGTRPFIOVLX-CYBMUJFWSA-N 2 0 245.370 2.013 20 0 BEADRP CCO[C@@H]1C[C@@H]([NH2+]C2CCC([NH3+])CC2)C1(C)C ZINC000085398251 644441764 /nfs/dbraw/zinc/44/17/64/644441764.db2.gz BMFWILSUFCRWET-FIYWTHMPSA-N 2 0 240.391 2.050 20 0 BEADRP [NH3+]CC[C@H]1CC[N@H+](CC[C@H]2CCCC2(F)F)C1 ZINC000923480688 644459348 /nfs/dbraw/zinc/45/93/48/644459348.db2.gz ZLRFWHRQACVXHC-NWDGAFQWSA-N 2 0 246.345 2.483 20 0 BEADRP C=C/C=C\CC[N@@H+]1CC[C@H](C[NH3+])[C@H](C)C1 ZINC000923488341 644462225 /nfs/dbraw/zinc/46/22/25/644462225.db2.gz DSKXQBGNUUTHQK-DIABFLQPSA-N 2 0 208.349 2.035 20 0 BEADRP C[C@@H]1C[N@H+](CC2CC(C)(C)C2)CC[C@@H]1C[NH3+] ZINC000923489831 644464893 /nfs/dbraw/zinc/46/48/93/644464893.db2.gz LQHWOVBKBYSZJF-DGCLKSJQSA-N 2 0 224.392 2.339 20 0 BEADRP C[C@@H]1C[N@H+](CCCC(C)(F)F)CC[C@H]1C[NH3+] ZINC000923490521 644465306 /nfs/dbraw/zinc/46/53/06/644465306.db2.gz DFJJVZFHTRINEH-MNOVXSKESA-N 2 0 234.334 2.339 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]Cc2cccs2)C1 ZINC000086402358 644466678 /nfs/dbraw/zinc/46/66/78/644466678.db2.gz OOMHDUHLHGEJSH-UWVGGRQHSA-N 2 0 210.346 2.108 20 0 BEADRP C[C@@H]1C[N@@H+]([C@@H]2C[C@H]2C(C)(C)C)CC[C@H]1C[NH3+] ZINC000923493261 644468514 /nfs/dbraw/zinc/46/85/14/644468514.db2.gz QZUBRFLZITWPMW-YVECIDJPSA-N 2 0 224.392 2.338 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@@H](C[NH3+])[C@@H](C)C2)c(C)n1 ZINC000923494914 644469704 /nfs/dbraw/zinc/46/97/04/644469704.db2.gz QMGWSQYMFXMAAQ-FZMZJTMJSA-N 2 0 247.386 2.115 20 0 BEADRP Cc1cccc(C[N@@H+]2CC[C@H](C[NH3+])[C@@H](C)C2)c1 ZINC000923498718 644472282 /nfs/dbraw/zinc/47/22/82/644472282.db2.gz JJDHUWYLLHNXIQ-DZGCQCFKSA-N 2 0 232.371 2.412 20 0 BEADRP COc1cccc(C[N@@H+]2CC[C@@H](C[NH3+])[C@@H](C)C2)c1 ZINC000923498550 644472984 /nfs/dbraw/zinc/47/29/84/644472984.db2.gz OTXWEAPOSASSOA-JSGCOSHPSA-N 2 0 248.370 2.112 20 0 BEADRP C[C@H]1C[N@H+](Cc2ccccc2F)CC[C@H]1C[NH3+] ZINC000923504202 644475949 /nfs/dbraw/zinc/47/59/49/644475949.db2.gz PWNHQOLPDZCBNO-RYUDHWBXSA-N 2 0 236.334 2.242 20 0 BEADRP Cc1ccccc1C[N@@H+]1CC[C@H](C[NH3+])[C@@H](C)C1 ZINC000923505108 644476252 /nfs/dbraw/zinc/47/62/52/644476252.db2.gz YMOLSVUNATYSFB-UONOGXRCSA-N 2 0 232.371 2.412 20 0 BEADRP C(C1CC1)[NH+]1CCC([C@H]2CCC[NH2+]CC2)CC1 ZINC000923508054 644478103 /nfs/dbraw/zinc/47/81/03/644478103.db2.gz SWMUQFRGQPILMA-AWEZNQCLSA-N 2 0 236.403 2.498 20 0 BEADRP Cc1cccc(C[N@@H+]2C[C@@H]3CC[NH2+]C[C@@H]3C2)c1 ZINC000923519224 644482630 /nfs/dbraw/zinc/48/26/30/644482630.db2.gz KROGKMGHGYDQGV-LSDHHAIUSA-N 2 0 230.355 2.036 20 0 BEADRP C(C1CCCCCC1)[N@@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1 ZINC000923521716 644483177 /nfs/dbraw/zinc/48/31/77/644483177.db2.gz QJECSOILPRQEMW-LSDHHAIUSA-N 2 0 236.403 2.498 20 0 BEADRP CC[C@H](C)C[N@@H+]1CC[C@]2(C1)CCCC[NH2+]2 ZINC000923534213 644490271 /nfs/dbraw/zinc/49/02/71/644490271.db2.gz RNVGWFNPDIKXFZ-STQMWFEESA-N 2 0 210.365 2.251 20 0 BEADRP COc1ccccc1C[NH2+][C@@H]1CCCC[C@@H]1C[NH3+] ZINC000089139032 644535873 /nfs/dbraw/zinc/53/58/73/644535873.db2.gz IQYRKEYSFDNPEV-TZMCWYRMSA-N 2 0 248.370 2.302 20 0 BEADRP C[N@@H+](Cc1cccc(F)c1)C[C@@H]1CC[C@H]([NH3+])C1 ZINC000091540778 644630083 /nfs/dbraw/zinc/63/00/83/644630083.db2.gz JZQFTNYYUYEYBY-OCCSQVGLSA-N 2 0 236.334 2.385 20 0 BEADRP COc1cccc(C[N@H+](C)C[C@@H]2CC[C@H]([NH3+])C2)c1 ZINC000091546093 644630119 /nfs/dbraw/zinc/63/01/19/644630119.db2.gz XKCHYJJUBVMDGF-KGLIPLIRSA-N 2 0 248.370 2.254 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]C[C@@H]2CCC[NH2+]C2)[C@H]1C ZINC000251591298 644811642 /nfs/dbraw/zinc/81/16/42/644811642.db2.gz BIEZVYUKOWKDJY-RQJABVFESA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1CCC[N@H+](CC[C@H]2CCC[NH2+]C2)[C@H]1C ZINC000252172584 644840148 /nfs/dbraw/zinc/84/01/48/644840148.db2.gz OGSNQQZUAJLEKT-HZSPNIEDSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CCC[N@H+](CC[C@H]2CCC[NH2+]C2)[C@@H]1C ZINC000252172585 644840634 /nfs/dbraw/zinc/84/06/34/644840634.db2.gz OGSNQQZUAJLEKT-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CCC[N@H+](CC[C@@H]2CCC[NH2+]C2)[C@H]1C ZINC000252172586 644841029 /nfs/dbraw/zinc/84/10/29/644841029.db2.gz OGSNQQZUAJLEKT-RDBSUJKOSA-N 2 0 224.392 2.497 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CCCC[C@H]2C)C1 ZINC000252439762 644850961 /nfs/dbraw/zinc/85/09/61/644850961.db2.gz SHRLFQISWGSLBP-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)C(N)=[NH+]OCCC[NH+]1CCCCC1 ZINC000808264077 644876112 /nfs/dbraw/zinc/87/61/12/644876112.db2.gz OFIOPYFXKSDFHD-UHFFFAOYSA-N 2 0 227.352 2.017 20 0 BEADRP C[C@]1(C[N@@H+]2CCC3(CCCC3)C2)CC[NH2+]C1 ZINC000304419084 644904574 /nfs/dbraw/zinc/90/45/74/644904574.db2.gz QSJMHKIAYMLQJG-ZDUSSCGKSA-N 2 0 222.376 2.252 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000252958073 644927260 /nfs/dbraw/zinc/92/72/60/644927260.db2.gz KYSFZPHFDBSNKX-DHGKCCLASA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]1CC[N@H+](CCc2cccs2)C[C@H]1C[NH3+] ZINC000253202449 644944003 /nfs/dbraw/zinc/94/40/03/644944003.db2.gz YXIKOPUIGYRLET-VXGBXAGGSA-N 2 0 238.400 2.207 20 0 BEADRP C[C@@H]([NH2+]CCCC[N@H+](C)C1CC1)c1ncco1 ZINC000926558368 645279251 /nfs/dbraw/zinc/27/92/51/645279251.db2.gz HGWMLFWQDXRIES-LLVKDONJSA-N 2 0 237.347 2.200 20 0 BEADRP C[C@]1(CC[NH2+][C@@H]2CCC[C@@H]2C[NH3+])C[C@]1(F)Cl ZINC000844926578 645350410 /nfs/dbraw/zinc/35/04/10/645350410.db2.gz YULIPSJORMGUFA-WISYIIOYSA-N 2 0 248.773 2.408 20 0 BEADRP C[N@H+]1C[C@H]2CC[C@@H](C1)C2[NH2+][C@@H]1CCCC[C@@H]1F ZINC000926787673 645432290 /nfs/dbraw/zinc/43/22/90/645432290.db2.gz ZEHQOHPLPOXMLO-IZXDZPFWSA-N 2 0 240.366 2.197 20 0 BEADRP CCC[NH2+][C@H]1CC[NH2+]C[C@H]1C1CCCC1 ZINC000925487335 645465658 /nfs/dbraw/zinc/46/56/58/645465658.db2.gz CIAUVUZZQVLPHM-STQMWFEESA-N 2 0 210.365 2.154 20 0 BEADRP CCc1cc(N2CC[C@@H]3[C@@H]2CCC[N@@H+]3C)cc[nH+]1 ZINC000872779763 645769449 /nfs/dbraw/zinc/76/94/49/645769449.db2.gz TUCARJRVVRZZLD-CABCVRRESA-N 2 0 245.370 2.317 20 0 BEADRP CCOCCC[NH2+][C@@H]1CCCN2CCCC[C@@H]12 ZINC000924523935 646045758 /nfs/dbraw/zinc/04/57/58/646045758.db2.gz CZKZOSPZGDBHHA-KGLIPLIRSA-N 2 0 240.391 2.020 20 0 BEADRP COC[C@@H](C)[NH2+]C1CC[NH+](CCC(C)C)CC1 ZINC000924524707 646046867 /nfs/dbraw/zinc/04/68/67/646046867.db2.gz AWWRQMCMDPRIKH-CYBMUJFWSA-N 2 0 242.407 2.121 20 0 BEADRP C1=C[C@@H]2CC[C@H]1C[C@@H]2[NH2+][C@H]1CCN(CC2CC2)C1 ZINC000925009262 646158185 /nfs/dbraw/zinc/15/81/85/646158185.db2.gz BKOWTHHLGUAOSC-UKMLZYKCSA-N 2 0 246.398 2.415 20 0 BEADRP CCC[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000925489107 646300170 /nfs/dbraw/zinc/30/01/70/646300170.db2.gz NJDIWJLSACMEDB-ZDUSSCGKSA-N 2 0 206.333 2.466 20 0 BEADRP CSCC[C@@H](C)[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000925510383 646307879 /nfs/dbraw/zinc/30/78/79/646307879.db2.gz VPQHAOVGCHDDME-GHMZBOCLSA-N 2 0 228.405 2.002 20 0 BEADRP C([NH2+][C@@H]1CC[NH2+]C12CCC2)C(C1CC1)C1CC1 ZINC000925514773 646310698 /nfs/dbraw/zinc/31/06/98/646310698.db2.gz MDNYDAHBHJAYEB-CQSZACIVSA-N 2 0 234.387 2.297 20 0 BEADRP COC[C@H]([NH2+][C@H]1C[C@H]([NH3+])CC(C)(C)C1)C(C)C ZINC000925518484 646312710 /nfs/dbraw/zinc/31/27/10/646312710.db2.gz RATWSPIHQCKJMJ-AVGNSLFASA-N 2 0 242.407 2.153 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+]CCC1CCCC1 ZINC000925520077 646313621 /nfs/dbraw/zinc/31/36/21/646313621.db2.gz URCKXEBGVWHHCY-GFCCVEGCSA-N 2 0 210.365 2.297 20 0 BEADRP CSC(C)(C)C[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000925526257 646317786 /nfs/dbraw/zinc/31/77/86/646317786.db2.gz HUZHWEBFCRQNFB-SNVBAGLBSA-N 2 0 228.405 2.002 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@@H]([NH3+])CC(C)(C)C1)[C@H]1CCCO1 ZINC000925538300 646321717 /nfs/dbraw/zinc/32/17/17/646321717.db2.gz TZNGWWFFEYEEQY-UMSGYPCISA-N 2 0 240.391 2.050 20 0 BEADRP CC1(C)C[C@@H]([NH3+])C[C@@H]([NH2+]CCc2cccnc2)C1 ZINC000925536381 646321725 /nfs/dbraw/zinc/32/17/25/646321725.db2.gz OFFSCAHNDHGDFJ-UONOGXRCSA-N 2 0 247.386 2.120 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1CC[C@@H](C[NH+](C)CC)C1 ZINC000929791585 646322820 /nfs/dbraw/zinc/32/28/20/646322820.db2.gz UBGVYPLTJLJZAM-MJBXVCDLSA-N 2 0 224.392 2.306 20 0 BEADRP CC1(C[NH2+][C@@H]2CC[NH2+]C23CCCC3)CC1 ZINC000925575845 646341795 /nfs/dbraw/zinc/34/17/95/646341795.db2.gz HWUGCQTXJGRSEY-LLVKDONJSA-N 2 0 208.349 2.051 20 0 BEADRP C[C@H](C[NH2+][C@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C)C1CC1 ZINC000925585976 646346191 /nfs/dbraw/zinc/34/61/91/646346191.db2.gz QLRDQYOHZVLJLK-ZZVYKPCYSA-N 2 0 236.403 2.399 20 0 BEADRP C1CCC2(C1)[NH2+]CC[C@H]2[NH2+]C1CCSCC1 ZINC000925591994 646348558 /nfs/dbraw/zinc/34/85/58/646348558.db2.gz UWAQFFMZEPNHQB-GFCCVEGCSA-N 2 0 240.416 2.146 20 0 BEADRP CC1(C)C[C@H]1C[NH2+][C@@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C ZINC000925595396 646351393 /nfs/dbraw/zinc/35/13/93/646351393.db2.gz JVOFGJKDQYGHSY-QNWHQSFQSA-N 2 0 236.403 2.399 20 0 BEADRP C([NH2+][C@H]1CC[NH2+]C12CCC2)C1(C2CC2)CCC1 ZINC000925622751 646369313 /nfs/dbraw/zinc/36/93/13/646369313.db2.gz PTAQPHOHXICALJ-ZDUSSCGKSA-N 2 0 234.387 2.441 20 0 BEADRP CS[C@@H](C[NH2+][C@@H]1CC[NH2+]C1(C)C)C(C)(C)C ZINC000925636139 646379718 /nfs/dbraw/zinc/37/97/18/646379718.db2.gz AETAZGNNYZHTIQ-MNOVXSKESA-N 2 0 244.448 2.494 20 0 BEADRP CSCCCCC[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000925641177 646382387 /nfs/dbraw/zinc/38/23/87/646382387.db2.gz BAFFXKFENSFLBT-GFCCVEGCSA-N 2 0 242.432 2.394 20 0 BEADRP CC1(CC[NH2+][C@@H]2CC[NH2+]C23CCCC3)CC1 ZINC000925653802 646392294 /nfs/dbraw/zinc/39/22/94/646392294.db2.gz OCOHHNSGDOSPTL-GFCCVEGCSA-N 2 0 222.376 2.441 20 0 BEADRP CC(C)=CC[NH2+][C@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C ZINC000925657605 646394342 /nfs/dbraw/zinc/39/43/42/646394342.db2.gz JZMCQPAECYHQQZ-AGIUHOORSA-N 2 0 222.376 2.319 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]CC2(C(F)(F)F)CC2)C12CCC2 ZINC000925673868 646403787 /nfs/dbraw/zinc/40/37/87/646403787.db2.gz ZJMVQAYFEKCZHG-BDAKNGLRSA-N 2 0 248.292 2.188 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]CCC2CC(F)(F)C2)C12CCC2 ZINC000925685639 646410354 /nfs/dbraw/zinc/41/03/54/646410354.db2.gz NWVMNATUYTYQBK-MNOVXSKESA-N 2 0 244.329 2.281 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+]CCC2CC(F)(F)C2)C12CCC2 ZINC000925685643 646410714 /nfs/dbraw/zinc/41/07/14/646410714.db2.gz NWVMNATUYTYQBK-WDEREUQCSA-N 2 0 244.329 2.281 20 0 BEADRP C1[C@@H]2[C@H]1CCC[C@H]2[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000925686002 646412380 /nfs/dbraw/zinc/41/23/80/646412380.db2.gz PGSMOFJSPHHLRY-LOWDOPEQSA-N 2 0 220.360 2.049 20 0 BEADRP COCC[C@H](C)C[NH2+][C@@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925685497 646412728 /nfs/dbraw/zinc/41/27/28/646412728.db2.gz JSKAQLHXTIXZDD-YNEHKIRRSA-N 2 0 242.407 2.155 20 0 BEADRP Cc1ccncc1C[NH2+][C@@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925689369 646414561 /nfs/dbraw/zinc/41/45/61/646414561.db2.gz IESRDSOOINPOQO-UONOGXRCSA-N 2 0 247.386 2.386 20 0 BEADRP CC(C)[C@@H]1C[C@H]1C[NH2+][C@@H]1CC[NH2+]C1(C)C ZINC000925687508 646414875 /nfs/dbraw/zinc/41/48/75/646414875.db2.gz CHVXPQLJTJXEIO-SDDRHHMPSA-N 2 0 210.365 2.009 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000925694255 646420175 /nfs/dbraw/zinc/42/01/75/646420175.db2.gz RMJOVGIIRFCWRO-LSDHHAIUSA-N 3 0 249.402 2.040 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+]C[C@@H]1C[C@H]1C1CCC1 ZINC000925705595 646431335 /nfs/dbraw/zinc/43/13/35/646431335.db2.gz LEFWTPZCTXYDHZ-RWMBFGLXSA-N 2 0 222.376 2.153 20 0 BEADRP CC1(C)[C@H]([NH2+][C@H]2C=CCC2)[C@@H]2CCC[NH2+][C@@H]21 ZINC000925708113 646432693 /nfs/dbraw/zinc/43/26/93/646432693.db2.gz CWFNQHBJMZAQQM-QNWHQSFQSA-N 2 0 220.360 2.071 20 0 BEADRP CC1(C)C[C@@H]([NH3+])C[C@@H]([NH2+]CCc2ccoc2)C1 ZINC000925709034 646432954 /nfs/dbraw/zinc/43/29/54/646432954.db2.gz NRAAXZIZOOCWHS-QWHCGFSZSA-N 2 0 236.359 2.318 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@H](c1ccccc1)[C@H](C)N ZINC000925711826 646436713 /nfs/dbraw/zinc/43/67/13/646436713.db2.gz SJWCDQQVADYOBC-IPYPFGDCSA-N 2 0 249.402 2.182 20 0 BEADRP CC(C)([NH3+])CC[NH2+][C@H]1CCC[C@H]1CCF ZINC000925736837 646438621 /nfs/dbraw/zinc/43/86/21/646438621.db2.gz CVYIJPNLVIMBHS-QWRGUYRKSA-N 2 0 216.344 2.232 20 0 BEADRP C[C@@]1(CC[NH2+][C@H]2CC[NH2+]C2(C)C)C[C@]1(F)Cl ZINC000925713830 646439228 /nfs/dbraw/zinc/43/92/28/646439228.db2.gz UVEPWLSMKXWNPQ-MVWJERBFSA-N 2 0 248.773 2.421 20 0 BEADRP C[C@]1(CC[NH2+][C@H]2CC[NH2+]C2(C)C)C[C@@]1(F)Cl ZINC000925713829 646439292 /nfs/dbraw/zinc/43/92/92/646439292.db2.gz UVEPWLSMKXWNPQ-DLOVCJGASA-N 2 0 248.773 2.421 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+]C[C@H]1CCCC12CC2 ZINC000925716636 646441453 /nfs/dbraw/zinc/44/14/53/646441453.db2.gz BICNLMBUZYBVRP-NEPJUHHUSA-N 2 0 222.376 2.297 20 0 BEADRP C([NH2+][C@@H]1CC[NH2+]C12CCC2)[C@@H]1CCCC12CC2 ZINC000925719850 646444312 /nfs/dbraw/zinc/44/43/12/646444312.db2.gz VCOAQCMNTCYTKY-QWHCGFSZSA-N 2 0 234.387 2.441 20 0 BEADRP C([NH2+][C@@H]1CC[NH2+]C12CCC2)[C@H]1CCCC12CC2 ZINC000925719848 646444692 /nfs/dbraw/zinc/44/46/92/646444692.db2.gz VCOAQCMNTCYTKY-CHWSQXEVSA-N 2 0 234.387 2.441 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+][C@H]1CCCC12CC2 ZINC000925723573 646448486 /nfs/dbraw/zinc/44/84/86/646448486.db2.gz BPRZTYAWBZRBNZ-MNOVXSKESA-N 2 0 208.349 2.049 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+][C@@H]2CCCC[C@@H]2F)C12CCC2 ZINC000925726341 646452761 /nfs/dbraw/zinc/45/27/61/646452761.db2.gz RJQSTMYYKJTBPJ-USZNOCQGSA-N 2 0 226.339 2.127 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C=CCC1)[C@H]1CCCC[NH2+]1 ZINC000925731525 646456953 /nfs/dbraw/zinc/45/69/53/646456953.db2.gz LTDYEMPQCXLTDJ-FRRDWIJNSA-N 2 0 208.349 2.073 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]CC1(CC2CC2)CC1 ZINC000925734537 646457767 /nfs/dbraw/zinc/45/77/67/646457767.db2.gz SCLHBRKSQWPAPJ-VXGBXAGGSA-N 2 0 208.349 2.036 20 0 BEADRP C([NH2+][C@@H]1CC[NH2+]C12CCC2)C1(CC2CC2)CC1 ZINC000925734989 646457795 /nfs/dbraw/zinc/45/77/95/646457795.db2.gz WPJGWKBTRNQNQT-CYBMUJFWSA-N 2 0 234.387 2.441 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+]C[C@H]1C=CCC1 ZINC000925733483 646459177 /nfs/dbraw/zinc/45/91/77/646459177.db2.gz VTRPFIFTJARHTA-OMXXWXSESA-N 2 0 220.360 2.058 20 0 BEADRP C[C@@H]([NH2+]CCC(C)(C)[NH3+])C1CCSCC1 ZINC000925737809 646460323 /nfs/dbraw/zinc/46/03/23/646460323.db2.gz LNWMRLJZOHTFNU-SNVBAGLBSA-N 2 0 230.421 2.235 20 0 BEADRP CC(C)([NH3+])CC[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000925736436 646461145 /nfs/dbraw/zinc/46/11/45/646461145.db2.gz GOHCYQAJLKHUSZ-AWEZNQCLSA-N 2 0 249.402 2.184 20 0 BEADRP CCC1(CC)[C@H]([NH2+]CCC(C)(C)[NH3+])C[C@@H]1OC ZINC000925740779 646463045 /nfs/dbraw/zinc/46/30/45/646463045.db2.gz LJRUNPXDCBVOAP-NEPJUHHUSA-N 2 0 242.407 2.297 20 0 BEADRP CCC1([NH3+])CC[NH+]([C@@H](C)[C@H]2CCCOC2)CC1 ZINC000925760069 646466321 /nfs/dbraw/zinc/46/63/21/646466321.db2.gz NYPZGDLOKZACRF-STQMWFEESA-N 2 0 240.391 2.005 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+][C@@H]1C[C@@H]2CCCC[C@H]12 ZINC000925767366 646466650 /nfs/dbraw/zinc/46/66/50/646466650.db2.gz XZTRYDNHNNTCEY-WUHRBBMRSA-N 2 0 222.376 2.295 20 0 BEADRP CCC1([NH3+])CC[NH+]([C@@H]2CC[C@@H]2C2CC2)CC1 ZINC000925760082 646466708 /nfs/dbraw/zinc/46/67/08/646466708.db2.gz OFUKLHPVVYENOR-CHWSQXEVSA-N 2 0 222.376 2.378 20 0 BEADRP CCC1([NH3+])CC[NH+]([C@H]2CC[C@H]2C2CC2)CC1 ZINC000925760085 646466734 /nfs/dbraw/zinc/46/67/34/646466734.db2.gz OFUKLHPVVYENOR-STQMWFEESA-N 2 0 222.376 2.378 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1C[C@H]1[C@H]1C[C@H]1C)[C@H]1CCCC[NH2+]1 ZINC000925771312 646470538 /nfs/dbraw/zinc/47/05/38/646470538.db2.gz ATAGNTRXLCHCLL-PEZGRIKUSA-N 2 0 236.403 2.399 20 0 BEADRP CC[C@@H]([NH2+]C[C@H]1C[NH2+]CCC1(F)F)C1CCC1 ZINC000925777413 646474725 /nfs/dbraw/zinc/47/47/25/646474725.db2.gz OWGRCMKUAOQWPT-VXGBXAGGSA-N 2 0 246.345 2.400 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[NH2+]CCC1(F)F)C1CCCC1 ZINC000925781658 646478644 /nfs/dbraw/zinc/47/86/44/646478644.db2.gz JDGKEYHOFWYSQZ-ZYHUDNBSSA-N 2 0 246.345 2.400 20 0 BEADRP CC(C)[C@H]([NH2+]C[C@@H]1C[NH2+]CCC1(F)F)C1CC1 ZINC000925782340 646478986 /nfs/dbraw/zinc/47/89/86/646478986.db2.gz LIWKGIHCURIHKE-RYUDHWBXSA-N 2 0 246.345 2.255 20 0 BEADRP CCC[C@@H]([NH2+]C[C@@H]1C[NH2+]C[C@H]1C)c1cccnc1 ZINC000925783203 646480039 /nfs/dbraw/zinc/48/00/39/646480039.db2.gz DIXSIUJURZVBDD-VHDGCEQUSA-N 2 0 247.386 2.368 20 0 BEADRP CCC(C)(C)[C@@H](C)[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000925785274 646481364 /nfs/dbraw/zinc/48/13/64/646481364.db2.gz MXGXVIJUNYLOTL-UTUOFQBUSA-N 2 0 212.381 2.256 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@H](C1CC1)C1CCC1 ZINC000925788227 646484613 /nfs/dbraw/zinc/48/46/13/646484613.db2.gz ZGTZBNIMUUFCBV-SWHYSGLUSA-N 2 0 222.376 2.010 20 0 BEADRP Cc1cc([C@H](C)[NH2+]C[C@@H]2C[NH2+]C[C@H]2C)c(C)o1 ZINC000925790851 646484741 /nfs/dbraw/zinc/48/47/41/646484741.db2.gz LSBPNPDCIYKWCM-CDMKHQONSA-N 2 0 236.359 2.403 20 0 BEADRP Cc1ccc2c(c1)CC[C@@H]2[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000925793198 646485601 /nfs/dbraw/zinc/48/56/01/646485601.db2.gz XRHBLBUTDYUKRM-INWMFGNUSA-N 2 0 244.382 2.427 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1C[NH2+]C[C@H]1C)c1ccsc1 ZINC000925790905 646485678 /nfs/dbraw/zinc/48/56/78/646485678.db2.gz MYNGBPXYYKSTFX-FOGDFJRCSA-N 2 0 224.373 2.254 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]C[C@@]12C[C@@H]1CCCC2 ZINC000925802565 646486960 /nfs/dbraw/zinc/48/69/60/646486960.db2.gz ORIFQMRPHMRULL-QNWHQSFQSA-N 2 0 208.349 2.036 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+][C@@H]1CCC[C@@H]2C[C@@]21C ZINC000925804018 646488155 /nfs/dbraw/zinc/48/81/55/646488155.db2.gz XUSASVXNBXXNRL-RYPNDVFKSA-N 2 0 236.403 2.400 20 0 BEADRP Cc1cncc([C@@H](C)[NH2+]CC[C@@H]2C[NH2+]C[C@H]2C)c1 ZINC000925803782 646488624 /nfs/dbraw/zinc/48/86/24/646488624.db2.gz VKSNITWGGDQKAD-MGPQQGTHSA-N 2 0 247.386 2.286 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]Cc1nccc2c1CCCC2 ZINC000925804733 646488668 /nfs/dbraw/zinc/48/86/68/646488668.db2.gz CEUQHOHEVGEGBM-NWDGAFQWSA-N 2 0 247.386 2.176 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]Cc1nccc2c1CCCC2 ZINC000925804734 646488866 /nfs/dbraw/zinc/48/88/66/646488866.db2.gz CEUQHOHEVGEGBM-RYUDHWBXSA-N 2 0 247.386 2.176 20 0 BEADRP C[C@H]([NH2+][C@@H](c1ccccn1)C1CC1)[C@H]1CC[NH2+]C1 ZINC000925822686 646497206 /nfs/dbraw/zinc/49/72/06/646497206.db2.gz NZBXBQRFZQMCTH-CORIIIEPSA-N 2 0 245.370 2.120 20 0 BEADRP C[C@@H]1C[C@H]1[C@@H]1C[C@H]1[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000925825204 646498352 /nfs/dbraw/zinc/49/83/52/646498352.db2.gz YAKYDZMXLJNWKT-NGOQWVGTSA-N 2 0 234.387 2.009 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+]C[C@]12CCC[C@H]1[NH2+]CC2 ZINC000925840061 646506694 /nfs/dbraw/zinc/50/66/94/646506694.db2.gz GRCSSNXCSOQXNY-XJFOESAGSA-N 2 0 222.376 2.297 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+][C@H]1CCSC2(CCC2)C1 ZINC000925857803 646510664 /nfs/dbraw/zinc/51/06/64/646510664.db2.gz IYOFYWDBPRZQAB-QJPTWQEYSA-N 2 0 240.416 2.274 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCS[C@H](C)C1)[C@H]1CCC[NH2+]1 ZINC000925862239 646515362 /nfs/dbraw/zinc/51/53/62/646515362.db2.gz YPARFCYHLDQACE-WISYIIOYSA-N 2 0 228.405 2.001 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H]1CCCc2cccnc21 ZINC000925871674 646521701 /nfs/dbraw/zinc/52/17/01/646521701.db2.gz DKFLBYSPMJICBX-GMXVVIOVSA-N 2 0 233.359 2.174 20 0 BEADRP C[C@H]1CCC[C@@H]([NH2+]C[C@@H]2CC[C@H]([NH3+])C2)C1 ZINC000925877166 646527288 /nfs/dbraw/zinc/52/72/88/646527288.db2.gz NJLZAKPTJUXSMD-QNWHQSFQSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H](CCc1ccco1)[NH2+]C[C@@H]1CC[C@H]([NH3+])C1 ZINC000925877528 646527556 /nfs/dbraw/zinc/52/75/56/646527556.db2.gz RJLABWAWJVDRAY-XQQFMLRXSA-N 2 0 236.359 2.318 20 0 BEADRP C[C@H]1CCC[C@H]([NH2+]C[C@@H]2CC[C@H]([NH3+])C2)C1 ZINC000925877167 646527611 /nfs/dbraw/zinc/52/76/11/646527611.db2.gz NJLZAKPTJUXSMD-RNJOBUHISA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]C[C@@H]2CC[C@H]([NH3+])C2)C1 ZINC000925877164 646527923 /nfs/dbraw/zinc/52/79/23/646527923.db2.gz NJLZAKPTJUXSMD-FVCCEPFGSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]([NH2+]CC1CCC=CCC1)[C@H]1CCC[NH2+]1 ZINC000925881773 646528876 /nfs/dbraw/zinc/52/88/76/646528876.db2.gz UUPNLRKDQFILBX-TZMCWYRMSA-N 2 0 222.376 2.463 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+]C[C@@H]1CC[C@H]([NH3+])C1 ZINC000925879397 646529295 /nfs/dbraw/zinc/52/92/95/646529295.db2.gz DAZMBEHVLPZDQW-VOAKCMCISA-N 2 0 210.365 2.138 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1CC[C@H]([NH3+])C1)[C@@H]1C[C@H]1C ZINC000925879484 646529763 /nfs/dbraw/zinc/52/97/63/646529763.db2.gz FQYLSTPUVGBBGO-LBELIVKGSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H](CCC1CC1)[NH2+]C[C@@H]1CC[C@H]([NH3+])C1 ZINC000925883760 646532436 /nfs/dbraw/zinc/53/24/36/646532436.db2.gz XHFBUVQEWTZANT-UHTWSYAYSA-N 2 0 210.365 2.282 20 0 BEADRP C[N@H+]1C[C@H]2CC[C@@H](C1)C2[NH2+]CCC1(C)CC1 ZINC000926328182 646617572 /nfs/dbraw/zinc/61/75/72/646617572.db2.gz YHSNQELFEHMONC-FUNVUKJBSA-N 2 0 222.376 2.106 20 0 BEADRP C[C@@H](C[NH2+][C@@H](C)C1CC(F)(F)C1)C[NH+](C)C ZINC000926475776 646653825 /nfs/dbraw/zinc/65/38/25/646653825.db2.gz WRQLENAYLVIRRR-UWVGGRQHSA-N 2 0 234.334 2.208 20 0 BEADRP CC[C@H]1C[N@H+](CCCC(C)(F)F)CC[C@@H]1[NH3+] ZINC000718709723 711663264 /nfs/dbraw/zinc/66/32/64/711663264.db2.gz UZEIRUQDIMJTKU-QWRGUYRKSA-N 2 0 234.334 2.481 20 0 BEADRP C[NH+]1CCC(C[NH2+]Cc2ccsc2)CC1 ZINC000044515395 711769723 /nfs/dbraw/zinc/76/97/23/711769723.db2.gz BQLADRMKTXYDGD-UHFFFAOYSA-N 2 0 224.373 2.180 20 0 BEADRP C[C@H]([NH2+]CC1(C)CC[NH+](C)CC1)C1(Cl)CC1 ZINC000702412770 712051410 /nfs/dbraw/zinc/05/14/10/712051410.db2.gz FGEPNJHYUVEXSQ-NSHDSACASA-N 2 0 244.810 2.468 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CC[C@@H]2CCSC2)CC[N@@H+]1C ZINC000704789767 712117032 /nfs/dbraw/zinc/11/70/32/712117032.db2.gz HROPLSPMRSBFAK-UPJWGTAASA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CC[C@H]2CCSC2)CC[N@@H+]1C ZINC000704789760 712116791 /nfs/dbraw/zinc/11/67/91/712116791.db2.gz HROPLSPMRSBFAK-AGIUHOORSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@H](CC[NH2+][C@H]1CCCC12CC2)[NH+](C)C ZINC000706614980 712151266 /nfs/dbraw/zinc/15/12/66/712151266.db2.gz MSQHNQAZLMHSKW-NEPJUHHUSA-N 2 0 210.365 2.249 20 0 BEADRP CC(C)C[C@@H](C)C[N@H+]1C[C@@H](C[NH3+])[C@H](C)C1 ZINC000708188039 712183653 /nfs/dbraw/zinc/18/36/53/712183653.db2.gz XFNPIURGBFOAOT-JHJVBQTASA-N 2 0 212.381 2.195 20 0 BEADRP C[C@@H]1C[N@H+](C[C@@H]2CCC[C@H](C)C2)C[C@H]1C[NH3+] ZINC000708208570 712184129 /nfs/dbraw/zinc/18/41/29/712184129.db2.gz YKJLQUOWKUPZSJ-REWJHTLYSA-N 2 0 224.392 2.339 20 0 BEADRP C[C@H](CN1CC[C@@H]2C[NH2+]C[C@@H]21)CC(C)(C)C ZINC000709175461 712199530 /nfs/dbraw/zinc/19/95/30/712199530.db2.gz GRCHYIMUONLUDJ-XQQFMLRXSA-N 2 0 224.392 2.352 20 0 BEADRP CC1(C)C[C@@H](C[NH+]2CCC([NH3+])CC2)C(C)(C)O1 ZINC000709685955 712215459 /nfs/dbraw/zinc/21/54/59/712215459.db2.gz LPSMNBCZUOJPMZ-NSHDSACASA-N 2 0 240.391 2.003 20 0 BEADRP C(CC1CC1)C[N@@H+]1CC[C@@]2(C1)CCC[NH2+]C2 ZINC000709848313 712229157 /nfs/dbraw/zinc/22/91/57/712229157.db2.gz GUVBKSGKYGRATG-AWEZNQCLSA-N 2 0 222.376 2.252 20 0 BEADRP CC1(C)CC[C@H](C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)OC1 ZINC000711387645 712296804 /nfs/dbraw/zinc/29/68/04/712296804.db2.gz CSMMDWGNUWCJNN-YNEHKIRRSA-N 2 0 240.391 2.051 20 0 BEADRP [NH3+]CCCCCCC[N@@H+]1CC[C@H](CF)C1 ZINC000711497429 712306899 /nfs/dbraw/zinc/30/68/99/712306899.db2.gz WXHIKFBHYBZOQJ-GFCCVEGCSA-N 2 0 216.344 2.187 20 0 BEADRP C[C@H]1c2sccc2CC[N@H+]1C[C@H]1CC[NH2+]C1 ZINC000712263439 712344930 /nfs/dbraw/zinc/34/49/30/712344930.db2.gz HMKZIFCVDRJGEU-QWRGUYRKSA-N 2 0 236.384 2.277 20 0 BEADRP CC1(C)[C@@H]2C[N@@H+](CCCCCC[NH3+])C[C@@H]21 ZINC000379517700 712387146 /nfs/dbraw/zinc/38/71/46/712387146.db2.gz YJYKRQNTOUSGLM-TXEJJXNPSA-N 2 0 210.365 2.093 20 0 BEADRP CSCC[C@H](C)[NH2+][C@@H](C)CCCC[NH3+] ZINC000379517229 712387159 /nfs/dbraw/zinc/38/71/59/712387159.db2.gz AWOVBJBKLUNYPO-QWRGUYRKSA-N 2 0 218.410 2.235 20 0 BEADRP C[C@H]1CC[N@H+](C[C@@]2(C)CCC[NH2+]C2)CCS1 ZINC000379545348 712387551 /nfs/dbraw/zinc/38/75/51/712387551.db2.gz YOWUKECNSUZYDY-STQMWFEESA-N 2 0 242.432 2.204 20 0 BEADRP C(C[NH2+]C1CC1)C[N@@H+]1CCC2(CCC2)C1 ZINC000379545135 712387564 /nfs/dbraw/zinc/38/75/64/712387564.db2.gz YAEBGNAPOFHXCQ-UHFFFAOYSA-N 2 0 208.349 2.005 20 0 BEADRP CC(C)[N@@H+]1CC[C@H](C[NH2+][C@@H]2CC[C@H]2C)C1 ZINC000379780124 712398816 /nfs/dbraw/zinc/39/88/16/712398816.db2.gz BVGPYLXRIIYPNG-JHJVBQTASA-N 2 0 210.365 2.105 20 0 BEADRP C=C/C=C\CC[N@@H+]1CC[C@H]([NH3+])[C@@H](CC)C1 ZINC000713700390 712469375 /nfs/dbraw/zinc/46/93/75/712469375.db2.gz AEDXMTZOFVOGJZ-IBPBTGAJSA-N 2 0 208.349 2.178 20 0 BEADRP C[C@@H]1C[C@@H]([NH3+])CC[N@@H+]1C[C@@H]1CCCC(C)(C)O1 ZINC000714374717 712484362 /nfs/dbraw/zinc/48/43/62/712484362.db2.gz NRVRVZLBYLUQPJ-AGIUHOORSA-N 2 0 240.391 2.146 20 0 BEADRP C[C@]1(C[NH3+])CC[N@H+](CC[C@@H]2C[C@H]2C2CC2)C1 ZINC000714850953 712501995 /nfs/dbraw/zinc/50/19/95/712501995.db2.gz ZEKKKAICNKDVIN-HZSPNIEDSA-N 2 0 222.376 2.093 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CCCS1)[C@H]1CCCC[NH2+]1 ZINC000715623810 712528031 /nfs/dbraw/zinc/52/80/31/712528031.db2.gz RGZDHSIRQFEBQA-RWMBFGLXSA-N 2 0 242.432 2.392 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCCS1)[C@H]1CCCC[NH2+]1 ZINC000715623815 712528339 /nfs/dbraw/zinc/52/83/39/712528339.db2.gz RGZDHSIRQFEBQA-YNEHKIRRSA-N 2 0 242.432 2.392 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CC[C@@H]2C[C@@H]21)[C@H]1CCC[NH2+]1 ZINC000717031426 712615075 /nfs/dbraw/zinc/61/50/75/712615075.db2.gz UIUJZJPCTHXSDB-ODXJTPSBSA-N 2 0 222.376 2.153 20 0 BEADRP CC[C@H]1C[N@H+](CCCC(C)(F)F)CC[C@H]1[NH3+] ZINC000718709747 712777921 /nfs/dbraw/zinc/77/79/21/712777921.db2.gz UZEIRUQDIMJTKU-WDEREUQCSA-N 2 0 234.334 2.481 20 0 BEADRP CO[C@@H]1CCC[C@@H]([NH2+]CC[C@@H](C)[NH+](C)C)CC1 ZINC000718774414 712782369 /nfs/dbraw/zinc/78/23/69/712782369.db2.gz HUVLAJXYBAHQLK-MGPQQGTHSA-N 2 0 242.407 2.264 20 0 BEADRP CO[C@H]1CCC[C@@H]([NH2+]C2CC([NH+](C)C)C2)CC1 ZINC000718823699 712783941 /nfs/dbraw/zinc/78/39/41/712783941.db2.gz IPKOKMSZBGTIHK-RYSNWHEDSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@H](C[NH2+][C@H](C)C1CC1)C[NH+]1CCCCC1 ZINC000038041777 712801655 /nfs/dbraw/zinc/80/16/55/712801655.db2.gz RPTNWAKTFJXHQR-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1CC([NH2+]C[C@H]2C[C@@H]([NH3+])C2)C[C@H](C)C1 ZINC000719376292 712806535 /nfs/dbraw/zinc/80/65/35/712806535.db2.gz GHVQZSADHVUGSC-KKOKHZNYSA-N 2 0 210.365 2.138 20 0 BEADRP CC[C@H](c1ccccc1)[N@@H+]1CCC[NH2+]CC1 ZINC000038086989 712806834 /nfs/dbraw/zinc/80/68/34/712806834.db2.gz FAAAFCDOFVYSCA-CQSZACIVSA-N 2 0 218.344 2.433 20 0 BEADRP CCO[C@@H]1CCC[C@H]([NH2+]CCCC[NH+](C)C)C1 ZINC000721170039 712894685 /nfs/dbraw/zinc/89/46/85/712894685.db2.gz XFWRHAJYMVLNML-UONOGXRCSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1C[NH2+]C[C@H]1C)c1nccs1 ZINC000722511598 710713342 /nfs/dbraw/zinc/71/33/42/710713342.db2.gz AMDGGJCIRNBFRE-OUAUKWLOSA-N 2 0 239.388 2.039 20 0 BEADRP CC(C)C1CC([NH2+]CC[C@@H]2C[NH2+]C[C@H]2C)C1 ZINC000722508043 710713563 /nfs/dbraw/zinc/71/35/63/710713563.db2.gz LDIZYPUXHGZMPN-IWMBGFJWSA-N 2 0 224.392 2.256 20 0 BEADRP C[C@@H](CCC1CC1)[NH2+]CC[C@@H]1C[NH2+]C[C@H]1C ZINC000722568317 710718242 /nfs/dbraw/zinc/71/82/42/710718242.db2.gz IFJVBYPHLJVSNU-MBNYWOFBSA-N 2 0 224.392 2.400 20 0 BEADRP C[N@H+](CCC[NH3+])C[C@@H]1CC2CCC1CC2 ZINC000382055185 710769217 /nfs/dbraw/zinc/76/92/17/710769217.db2.gz GRJXINBOFFJJAH-BPCQOVAHSA-N 2 0 210.365 2.093 20 0 BEADRP C1=C(CC[NH2+][C@H]2[C@@H]3[NH2+]C[C@@H]4C[C@H]2C[C@@H]43)CCCC1 ZINC000385463226 711013275 /nfs/dbraw/zinc/01/32/75/711013275.db2.gz AAZFFXBZOKYSGC-RFBLXINOSA-N 2 0 246.398 2.463 20 0 BEADRP C[C@@H]1CCC[C@H](C[NH2+][C@H]2[C@@H]3[NH2+]C[C@H]4C[C@H]2C[C@H]34)C1 ZINC000385545749 711015335 /nfs/dbraw/zinc/01/53/35/711015335.db2.gz VPEIMWPIDQVPMU-UAIIHYSCSA-N 2 0 248.414 2.399 20 0 BEADRP C1[NH2+][C@H]2[C@H]([NH2+][C@H]3CC4CCC3CC4)[C@H]3C[C@H]1[C@@H]2C3 ZINC000385593120 711016728 /nfs/dbraw/zinc/01/67/28/711016728.db2.gz JCMODDPLYCWOHJ-CGURJELMSA-N 2 0 246.398 2.151 20 0 BEADRP CC(C)(CC[NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32)C1CC1 ZINC000385592992 711016920 /nfs/dbraw/zinc/01/69/20/711016920.db2.gz IZMANBUPJVFUCD-XSXPHNMFSA-N 2 0 248.414 2.399 20 0 BEADRP CC(F)(F)CCC[NH2+][C@@H]1CC[NH2+]CC1(C)C ZINC000390080285 711104110 /nfs/dbraw/zinc/10/41/10/711104110.db2.gz BFQXENSNLULCOM-SNVBAGLBSA-N 2 0 234.334 2.400 20 0 BEADRP C[C@H](CCN(C)C[C@H](C)[NH3+])c1ccccc1 ZINC000390257109 711110249 /nfs/dbraw/zinc/11/02/49/711110249.db2.gz XESDDBMZYRPISB-OLZOCXBDSA-N 2 0 220.360 2.459 20 0 BEADRP CSC1(C[NH2+][C@H]2CC[C@@H]2C)CC[NH+](C)CC1 ZINC000390509998 711123071 /nfs/dbraw/zinc/12/30/71/711123071.db2.gz ZCEGHWAEFZMNSL-RYUDHWBXSA-N 2 0 242.432 2.202 20 0 BEADRP CC(C)(C)CC[NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23 ZINC000392832587 711153429 /nfs/dbraw/zinc/15/34/29/711153429.db2.gz IILKKDWLCJDWNA-OBPIAQAESA-N 2 0 222.376 2.009 20 0 BEADRP CC(C)C[C@H](C)[NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2 ZINC000392871608 711153593 /nfs/dbraw/zinc/15/35/93/711153593.db2.gz JLNYROZZTTZURR-VZKILSJISA-N 2 0 222.376 2.007 20 0 BEADRP C1[NH2+][C@H]2[C@H]([NH2+]C3CCCCCC3)[C@H]3C[C@H]1[C@@H]2C3 ZINC000392980158 711154783 /nfs/dbraw/zinc/15/47/83/711154783.db2.gz ZRDJTCPUMGSHSK-WPTOEGHWSA-N 2 0 234.387 2.295 20 0 BEADRP C[NH2+]CC1CC[NH+](CCCC2CC2)CC1 ZINC000394654376 711196352 /nfs/dbraw/zinc/19/63/52/711196352.db2.gz LVDYPAUMGPOIPE-UHFFFAOYSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@@H]1CC[N@H+](CCCC2CC2)C[C@@H]1C[NH3+] ZINC000394668602 711196783 /nfs/dbraw/zinc/19/67/83/711196783.db2.gz RAZGDHCSDURKLG-YPMHNXCESA-N 2 0 210.365 2.093 20 0 BEADRP CC(C)[C@H]1CCCC[N@@H+]1C[C@@H]1C[NH2+]C[C@H]1C ZINC000395842545 711216622 /nfs/dbraw/zinc/21/66/22/711216622.db2.gz IQZAUDNCORSMCR-HZSPNIEDSA-N 2 0 224.392 2.352 20 0 BEADRP CC(C)[C@@H]1CCCC[N@@H+]1C[C@@H]1C[NH2+]C[C@H]1C ZINC000395842551 711216719 /nfs/dbraw/zinc/21/67/19/711216719.db2.gz IQZAUDNCORSMCR-RDBSUJKOSA-N 2 0 224.392 2.352 20 0 BEADRP COC(C)(C)[C@@H](C)[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000396445647 711220834 /nfs/dbraw/zinc/22/08/34/711220834.db2.gz PGFDGRJHNLQOMX-NWDGAFQWSA-N 2 0 242.407 2.120 20 0 BEADRP C[C@H](CCC1CC1)[NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23 ZINC000398175812 711404422 /nfs/dbraw/zinc/40/44/22/711404422.db2.gz VULDHNKVSKILSK-KJCZUFAUSA-N 2 0 234.387 2.151 20 0 BEADRP C[C@H](CCC1CC1)[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000398215872 711404568 /nfs/dbraw/zinc/40/45/68/711404568.db2.gz LWOMFBAXRMTSQN-WZRBSPASSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@H]1CC[C@@H]1[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000381258189 710612640 /nfs/dbraw/zinc/61/26/40/710612640.db2.gz RHYIIIWNWLGUQG-FZMZJTMJSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+]C(C1CC1)C1CC1 ZINC000722523120 710715201 /nfs/dbraw/zinc/71/52/01/710715201.db2.gz ZFMQJOFYJNUFTA-ZWNOBZJWSA-N 2 0 222.376 2.010 20 0 BEADRP C[C@H]1NCCC[C@H]1[NH2+]CCCOc1ccccc1 ZINC000396633921 711362074 /nfs/dbraw/zinc/36/20/74/711362074.db2.gz JSWCECGBLQZVLB-UKRRQHHQSA-N 2 0 248.370 2.186 20 0 BEADRP CC(C)(C)SCC[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000397432827 711382430 /nfs/dbraw/zinc/38/24/30/711382430.db2.gz FPPMSLJBLKJHMS-GHMZBOCLSA-N 2 0 230.421 2.378 20 0 BEADRP CC(C)(C)SCC[NH2+][C@H]1CCC[C@H]1C[NH3+] ZINC000397464890 711382736 /nfs/dbraw/zinc/38/27/36/711382736.db2.gz SOXAYDYSDRGWOW-QWRGUYRKSA-N 2 0 230.421 2.235 20 0 BEADRP CC(C)(C)SCC[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000397432829 711382983 /nfs/dbraw/zinc/38/29/83/711382983.db2.gz FPPMSLJBLKJHMS-QWRGUYRKSA-N 2 0 230.421 2.378 20 0 BEADRP C[NH+]1CCC(C[NH2+]C2(C3(C)CC3)CC2)CC1 ZINC000398254400 711405003 /nfs/dbraw/zinc/40/50/03/711405003.db2.gz PFGQISJXAMGMAC-UHFFFAOYSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@H+](C)CCC(C)(C)C ZINC000399755655 711434641 /nfs/dbraw/zinc/43/46/41/711434641.db2.gz PVLFNVAXMKAVDW-NEPJUHHUSA-N 2 0 212.381 2.210 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH+]1CCC([C@@H](C)[NH3+])CC1 ZINC000723079565 711499802 /nfs/dbraw/zinc/49/98/02/711499802.db2.gz NLBIIDZEQUFKHU-WZRBSPASSA-N 2 0 210.365 2.092 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@H](CC[NH3+])C2)s1 ZINC000723711801 711535242 /nfs/dbraw/zinc/53/52/42/711535242.db2.gz JCWLXFRARKVRSB-NSHDSACASA-N 2 0 224.373 2.227 20 0 BEADRP [NH3+]CC[C@H]1CC[N@H+](C/C=C\c2ccccc2)C1 ZINC000723713941 711535270 /nfs/dbraw/zinc/53/52/70/711535270.db2.gz XSYUVDCQQFZHEX-QZDDGCDVSA-N 2 0 230.355 2.371 20 0 BEADRP C=C/C=C/CC[N@H+]1C[C@@H](C)[C@H](CC[NH3+])C1 ZINC000723886941 711543104 /nfs/dbraw/zinc/54/31/04/711543104.db2.gz OLSQSLPGCQMBPU-IJWDBEHRSA-N 2 0 208.349 2.035 20 0 BEADRP C[C@@H]1C[N@H+](CCC2CCCC2)C[C@H]1CC[NH3+] ZINC000723886193 711543255 /nfs/dbraw/zinc/54/32/55/711543255.db2.gz HVHIXKYIXZQYGW-TZMCWYRMSA-N 2 0 224.392 2.483 20 0 BEADRP C[C@@H]1C[N@H+](CC[C@@H]2C[C@H]2C2CC2)C[C@H]1CC[NH3+] ZINC000723884255 711543300 /nfs/dbraw/zinc/54/33/00/711543300.db2.gz SBRMCXUIHDNHAI-NGFQHRJXSA-N 2 0 236.403 2.339 20 0 BEADRP C[C@H](c1cccnc1)[N@@H+]1C[C@@H](C)[C@H](CC[NH3+])C1 ZINC000723892587 711543740 /nfs/dbraw/zinc/54/37/40/711543740.db2.gz SCZOCLUOTOVCOU-YRGRVCCFSA-N 2 0 233.359 2.059 20 0 BEADRP C[C@@H]1C[N@H+](CC=C(Cl)Cl)C[C@H]1CC[NH3+] ZINC000723900595 711543915 /nfs/dbraw/zinc/54/39/15/711543915.db2.gz KKRKHHRWUISTPY-RKDXNWHRSA-N 2 0 237.174 2.222 20 0 BEADRP Cc1ccc(C[N@H+]2C[C@@H](C)[C@H](CC[NH3+])C2)s1 ZINC000723890620 711544010 /nfs/dbraw/zinc/54/40/10/711544010.db2.gz FULCILNMYXZCLR-ZYHUDNBSSA-N 2 0 238.400 2.473 20 0 BEADRP C[C@@H]1C[N@H+](C[C@@H]2CCC(F)(F)C2)C[C@H]1CC[NH3+] ZINC000723893996 711544430 /nfs/dbraw/zinc/54/44/30/711544430.db2.gz IAQYBSYHPHHYKS-IJLUTSLNSA-N 2 0 246.345 2.339 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CCC2CC=CC2)CC[N@@H+]1C ZINC000724184473 711567188 /nfs/dbraw/zinc/56/71/88/711567188.db2.gz IXZAAVISTJCOKR-JSGCOSHPSA-N 2 0 222.376 2.415 20 0 BEADRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]CCC1CC=CC1 ZINC000724200688 711568930 /nfs/dbraw/zinc/56/89/30/711568930.db2.gz PVVAMQJWJUCGMC-CHWSQXEVSA-N 2 0 208.349 2.060 20 0 BEADRP CC1(C)C[N@H+](C[C@]2(C)CCC[NH2+]C2)CCS1 ZINC000133324961 711638109 /nfs/dbraw/zinc/63/81/09/711638109.db2.gz MCIXGVRPYQCLGJ-CYBMUJFWSA-N 2 0 242.432 2.204 20 0 BEADRP C[C@]1(C[NH2+][C@@H]2C[C@H]([NH3+])C23CCC3)C[C@H]2C[C@H]2C1 ZINC000925718601 711714728 /nfs/dbraw/zinc/71/47/28/711714728.db2.gz OBMCDVCBILEZCS-MEBFFEOJSA-N 2 0 234.387 2.282 20 0 BEADRP CC(C)[C@H]1CC[C@H]1[NH2+]C1CCC([NH3+])CC1 ZINC000335049123 711720063 /nfs/dbraw/zinc/72/00/63/711720063.db2.gz IYBNHBUWVJAWCN-FIYWTHMPSA-N 2 0 210.365 2.281 20 0 BEADRP C(C1CCCC1)[N@@H+]1CCC[C@@]12CC[NH2+]C2 ZINC000257682165 711726780 /nfs/dbraw/zinc/72/67/80/711726780.db2.gz LIQAHCSFAKFSRQ-ZDUSSCGKSA-N 2 0 208.349 2.005 20 0 BEADRP CC(C)C1CC[NH+](CCC[NH2+]C2CC2)CC1 ZINC000232537526 711760870 /nfs/dbraw/zinc/76/08/70/711760870.db2.gz CYIIGDHKZGIIPO-UHFFFAOYSA-N 2 0 224.392 2.497 20 0 BEADRP [NH3+]C[C@@H]1CC[N@H+](Cc2cc3ccccc3o2)C1 ZINC000050245182 711789135 /nfs/dbraw/zinc/78/91/35/711789135.db2.gz KVPHBMNUXOBWQQ-NSHDSACASA-N 2 0 230.311 2.213 20 0 BEADRP C[NH+](C)CCC1CC[NH+](C/C=C/Cl)CC1 ZINC000056524545 711825760 /nfs/dbraw/zinc/82/57/60/711825760.db2.gz GVUXSEIJBSPUNF-XVNBXDOJSA-N 2 0 230.783 2.403 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[N@@H+]2CCc3sccc3C2)C1 ZINC000227800018 711832927 /nfs/dbraw/zinc/83/29/27/711832927.db2.gz KRISZVRFNYUWRC-CMPLNLGQSA-N 2 0 236.384 2.234 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+]CCC1CCC1 ZINC000229077837 711837608 /nfs/dbraw/zinc/83/76/08/711837608.db2.gz GEQFMEZOYWFATQ-OLZOCXBDSA-N 2 0 210.365 2.284 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)C1(Cl)CC1 ZINC000700807813 711852545 /nfs/dbraw/zinc/85/25/45/711852545.db2.gz DTQDNPZOADJTOQ-RYUDHWBXSA-N 2 0 244.810 2.468 20 0 BEADRP C1CC1[C@@H]1CC[C@H]1[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000530216511 711938079 /nfs/dbraw/zinc/93/80/79/711938079.db2.gz PYJSRPWPNRDONH-XQQFMLRXSA-N 2 0 220.360 2.049 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@]2(C)CCC[NH2+]C2)C[C@@H]1C ZINC000132005410 711953576 /nfs/dbraw/zinc/95/35/76/711953576.db2.gz KZPNGGIIRSSJII-HZSPNIEDSA-N 2 0 224.392 2.354 20 0 BEADRP Cc1cccc(C[NH2+]CC[C@@H](C)[NH+](C)C)c1 ZINC000700606247 712001229 /nfs/dbraw/zinc/00/12/29/712001229.db2.gz WLALGECNHIPUHO-CYBMUJFWSA-N 2 0 220.360 2.425 20 0 BEADRP C[N@@H+]1CCCC[C@H](C[NH2+]C[C@@H]2CCC=CO2)C1 ZINC000700812277 712006633 /nfs/dbraw/zinc/00/66/33/712006633.db2.gz HRXWHALCXXTDFG-KGLIPLIRSA-N 2 0 238.375 2.001 20 0 BEADRP CC1(C)C[C@]1(C)C[NH2+][C@@H]1C[C@H]([NH3+])C12CCC2 ZINC000702000061 712035681 /nfs/dbraw/zinc/03/56/81/712035681.db2.gz BHQIZRHNGHRIJT-DMDPSCGWSA-N 2 0 222.376 2.282 20 0 BEADRP C[NH+]1CCC(C[NH2+]C2(C)CC=CC2)CC1 ZINC000702156581 712040328 /nfs/dbraw/zinc/04/03/28/712040328.db2.gz MEYBEBAXERDJRJ-UHFFFAOYSA-N 2 0 208.349 2.027 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)C2(Cl)CC2)C1 ZINC000702253969 712041940 /nfs/dbraw/zinc/04/19/40/712041940.db2.gz BGIQPIHZUGOVRB-GHMZBOCLSA-N 2 0 230.783 2.078 20 0 BEADRP Cc1cc(C[N@@H+](C)C2CCC([NH3+])CC2)ccn1 ZINC000703508733 712077491 /nfs/dbraw/zinc/07/74/91/712077491.db2.gz PCGUCSFKXDPTOY-UHFFFAOYSA-N 2 0 233.359 2.092 20 0 BEADRP Cc1ccccc1OCC[NH+]1CCC(C)([NH3+])CC1 ZINC000704597878 712112155 /nfs/dbraw/zinc/11/21/55/712112155.db2.gz UBBOBQRTKWCWEP-UHFFFAOYSA-N 2 0 248.370 2.187 20 0 BEADRP C[C@@H]1CCCC[N@H+](C[C@]2(C)CCC[NH2+]C2)C1 ZINC000705575813 712133737 /nfs/dbraw/zinc/13/37/37/712133737.db2.gz DXSJJZKYPKTLQJ-ZIAGYGMSSA-N 2 0 224.392 2.498 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]C[C@H]2CCCC23CC3)C12CCC2 ZINC000706300026 712144541 /nfs/dbraw/zinc/14/45/41/712144541.db2.gz XPQVGXFPLBZOGX-JHJVBQTASA-N 2 0 234.387 2.426 20 0 BEADRP CSC1CC([NH2+]CC(C)(C)C[NH+](C)C)C1 ZINC000706920800 712160856 /nfs/dbraw/zinc/16/08/56/712160856.db2.gz YPSHFKMGSJTZTQ-UHFFFAOYSA-N 2 0 230.421 2.058 20 0 BEADRP C([NH2+][C@@H]1CCCC12CC2)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000706995025 712164280 /nfs/dbraw/zinc/16/42/80/712164280.db2.gz BUJGCCJDMJJIGP-WTUNAVPPSA-N 2 0 234.387 2.439 20 0 BEADRP C[C@@H](C[NH+]1CCC([NH3+])CC1)CC(C)(C)C ZINC000709102880 712208612 /nfs/dbraw/zinc/20/86/12/712208612.db2.gz NIUCDMZKSKONHF-LLVKDONJSA-N 2 0 212.381 2.482 20 0 BEADRP C[C@H](C[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1)CC(C)(C)C ZINC000709121832 712209236 /nfs/dbraw/zinc/20/92/36/712209236.db2.gz GQAIAHUKIZPULE-RWMBFGLXSA-N 2 0 224.392 2.210 20 0 BEADRP C[C@@H]1[C@H]2CC[C@@H](C[C@@H]1[NH2+][C@H]1CCCSC1)[NH2+]2 ZINC000709284565 712219020 /nfs/dbraw/zinc/21/90/20/712219020.db2.gz NQPFJNVLCNOAQH-SJHCENCUSA-N 2 0 240.416 2.001 20 0 BEADRP C(C[C@H]1CCSC1)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000709351246 712220167 /nfs/dbraw/zinc/22/01/67/712220167.db2.gz LJGKBPOWFFJAPB-ACJTYDJDSA-N 2 0 240.416 2.002 20 0 BEADRP C[C@@H]1[C@H]2CC[C@@H](C[C@H]1[NH2+][C@H]1CCC1(C)C)[NH2+]2 ZINC000709433552 712221842 /nfs/dbraw/zinc/22/18/42/712221842.db2.gz HEMYZISDQRNYFC-MLGHIDQZSA-N 2 0 222.376 2.294 20 0 BEADRP C[C@@H]1[C@H]2CC[C@@H](C[C@H]1[NH2+][C@@H]1CC=CCC1)[NH2+]2 ZINC000709436643 712222163 /nfs/dbraw/zinc/22/21/63/712222163.db2.gz MEXTWBRWVZWUTQ-RKQHYHRCSA-N 2 0 220.360 2.214 20 0 BEADRP C([C@@H]1C[C@H]2C[C@H]2C1)[N@@H+]1CC[C@]2(C1)CCC[NH2+]C2 ZINC000709920525 712232605 /nfs/dbraw/zinc/23/26/05/712232605.db2.gz QDPRSMUKOPENNB-LXTVHRRPSA-N 2 0 234.387 2.108 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@]23C[C@H]2CCC3)CC[N@@H+]1C ZINC000710484136 712253708 /nfs/dbraw/zinc/25/37/08/712253708.db2.gz SSAGLKPLSSTXRY-SYQHCUMBSA-N 2 0 222.376 2.249 20 0 BEADRP Cc1ccc(C[N@H+](C)CCCCCC[NH3+])nc1 ZINC000710712877 712254633 /nfs/dbraw/zinc/25/46/33/712254633.db2.gz BVFGQLKNLDFUFC-UHFFFAOYSA-N 2 0 235.375 2.341 20 0 BEADRP C[N@H+](CCCCCC[NH3+])C[C@H]1CCSC1 ZINC000710704930 712254981 /nfs/dbraw/zinc/25/49/81/712254981.db2.gz FIYJVVNGYHFTBD-GFCCVEGCSA-N 2 0 230.421 2.190 20 0 BEADRP C[C@H]1CC[C@H](C[N@H+](C)CCCCCC[NH3+])O1 ZINC000710749650 712256144 /nfs/dbraw/zinc/25/61/44/712256144.db2.gz IZTPWNCMKOAYQK-QWHCGFSZSA-N 2 0 228.380 2.005 20 0 BEADRP C[N@H+]1CC=C(C[NH2+][C@@H]2C[C@@H]3CC[C@@H](C3)C2)CC1 ZINC000710895124 712261954 /nfs/dbraw/zinc/26/19/54/712261954.db2.gz FEDCHDBHPIMNFD-QDMKHBRRSA-N 2 0 234.387 2.417 20 0 BEADRP C[C@@H]1C[C@@H](C[N@@H+]2CCC[C@H](CF)C2)CC[NH2+]1 ZINC000711463302 712305039 /nfs/dbraw/zinc/30/50/39/712305039.db2.gz VTLNKBUPHFJMJA-FRRDWIJNSA-N 2 0 228.355 2.056 20 0 BEADRP FC[C@@H]1CC[N@H+](Cc2cccc3c2CC[NH2+]C3)C1 ZINC000711512778 712307830 /nfs/dbraw/zinc/30/78/30/712307830.db2.gz JRBWJBSLZDFKDB-LBPRGKRZSA-N 2 0 248.345 2.124 20 0 BEADRP C1=C[C@H](C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)CC1 ZINC000711790620 712331290 /nfs/dbraw/zinc/33/12/90/712331290.db2.gz ZKIPUQDUEIALNL-LJISPDSOSA-N 2 0 234.387 2.463 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+][C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000378907013 712366860 /nfs/dbraw/zinc/36/68/60/712366860.db2.gz ZNMRCCKAFUCEGM-QNWHQSFQSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@@H]1C[N@H+](CC[C@@H]2C[C@H]2C2CC2)CC[C@@H]1[NH3+] ZINC000712683224 712440518 /nfs/dbraw/zinc/44/05/18/712440518.db2.gz FYKJAEPDHAXNHX-ZZVYKPCYSA-N 2 0 222.376 2.092 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]CC[C@@H]2C[C@H]2C2CC2)C12CCC2 ZINC000712675565 712440672 /nfs/dbraw/zinc/44/06/72/712440672.db2.gz QYVANTNBBVZFFC-RQJABVFESA-N 2 0 234.387 2.282 20 0 BEADRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]CC[C@@H]1C[C@H]1C1CC1 ZINC000712751318 712449149 /nfs/dbraw/zinc/44/91/49/712449149.db2.gz RYJIZSMDSREMEA-MQYQWHSLSA-N 2 0 222.376 2.140 20 0 BEADRP CC1(C)[C@H]([NH3+])C[C@H]1[NH2+]CC[C@@H]1C[C@H]1C1CC1 ZINC000712751279 712449302 /nfs/dbraw/zinc/44/93/02/712449302.db2.gz RLGCJWRPCFXLEV-YVECIDJPSA-N 2 0 222.376 2.138 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]CC[C@@H]1C[C@H]1C1CC1 ZINC000712751325 712449349 /nfs/dbraw/zinc/44/93/49/712449349.db2.gz RYJIZSMDSREMEA-ZOBORPQBSA-N 2 0 222.376 2.140 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]CC[C@@H]2C[C@H]2C2CC2)C12CCC2 ZINC000712751231 712449472 /nfs/dbraw/zinc/44/94/72/712449472.db2.gz QYVANTNBBVZFFC-XJFOESAGSA-N 2 0 234.387 2.282 20 0 BEADRP C[N@H+](C[C@@H]1CCC(C)(C)CO1)CC(C)(C)C[NH3+] ZINC000713597434 712465937 /nfs/dbraw/zinc/46/59/37/712465937.db2.gz UYDNCCUKSJZJHD-LBPRGKRZSA-N 2 0 242.407 2.108 20 0 BEADRP C=C/C=C/CC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000713640754 712467688 /nfs/dbraw/zinc/46/76/88/712467688.db2.gz GSXRZLNOAUQNOH-SNSWZIKMSA-N 2 0 220.360 2.334 20 0 BEADRP C=C/C=C/CC[NH+]1CCC([C@H](C)[NH3+])CC1 ZINC000713705416 712469198 /nfs/dbraw/zinc/46/91/98/712469198.db2.gz XCISGBPRDPQBJQ-ITKZLYELSA-N 2 0 208.349 2.178 20 0 BEADRP C=C/C=C/CC[NH2+][C@H](C)C1CC[NH+](C)CC1 ZINC000713695076 712469406 /nfs/dbraw/zinc/46/94/06/712469406.db2.gz MKBCMSACPBRSGO-URWSZGRFSA-N 2 0 222.376 2.439 20 0 BEADRP C=C/C=C\CC[N@H+]1CC[C@H](C)[C@@H](C[NH3+])C1 ZINC000713735220 712470481 /nfs/dbraw/zinc/47/04/81/712470481.db2.gz NIMNBNQVYKRJBF-AIMRDXAKSA-N 2 0 208.349 2.035 20 0 BEADRP C=C/C=C\CC[NH+]1CCC(C[NH2+]CC)CC1 ZINC000713740736 712470806 /nfs/dbraw/zinc/47/08/06/712470806.db2.gz QNDSFWLCPXYEBC-WAYWQWQTSA-N 2 0 222.376 2.440 20 0 BEADRP C=C/C=C/CC[N@H+]1C[C@@H]2CCC[C@]2(C[NH3+])C1 ZINC000713738591 712470815 /nfs/dbraw/zinc/47/08/15/712470815.db2.gz FUUFJUFUTBMFJF-NVFZZLLCSA-N 2 0 220.360 2.180 20 0 BEADRP C=C/C=C/CC[N@@H+]1CC[C@]2(C1)CCC[NH2+]C2 ZINC000713755447 712471895 /nfs/dbraw/zinc/47/18/95/712471895.db2.gz MZGCWFIZSJBIPL-RDFMZFSFSA-N 2 0 220.360 2.194 20 0 BEADRP CC(C)(C[NH3+])C1CC[NH+](CC2(C)CC2)CC1 ZINC000714396160 712487716 /nfs/dbraw/zinc/48/77/16/712487716.db2.gz IVXHZHSVZUHWDL-UHFFFAOYSA-N 2 0 224.392 2.483 20 0 BEADRP COCC[C@H](C)[NH+]1CCC(C(C)(C)C[NH3+])CC1 ZINC000714442755 712489187 /nfs/dbraw/zinc/48/91/87/712489187.db2.gz AMHWTLYUJMRBMF-LBPRGKRZSA-N 2 0 242.407 2.108 20 0 BEADRP CC[C@@H]1C[N@H+](CC[C@@H]2C[C@H]2C2CC2)CC[C@H]1[NH3+] ZINC000714813017 712498338 /nfs/dbraw/zinc/49/83/38/712498338.db2.gz RZKKEVAVSHJDMS-REBRKWNGSA-N 2 0 236.403 2.482 20 0 BEADRP C(C[N@@H+]1CC[C@@]2(C1)CCC[NH2+]C2)[C@@H]1C[C@H]1C1CC1 ZINC000714811456 712498379 /nfs/dbraw/zinc/49/83/79/712498379.db2.gz NBIFHYLEVQHTMT-PMPSAXMXSA-N 2 0 248.414 2.498 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CC[N@H+](CC[C@@H]2C[C@H]2C2CC2)C1 ZINC000714853371 712501599 /nfs/dbraw/zinc/50/15/99/712501599.db2.gz XMOYPQTVRBELLB-ASEORRQLSA-N 2 0 222.376 2.092 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23 ZINC000388720992 712501625 /nfs/dbraw/zinc/50/16/25/712501625.db2.gz SKFSSVMVISYWEO-MRKIUDBFSA-N 2 0 234.387 2.151 20 0 BEADRP [NH3+]CC[C@@H]1CCC[N@H+](CC[C@@H]2C[C@H]2C2CC2)C1 ZINC000714856056 712501649 /nfs/dbraw/zinc/50/16/49/712501649.db2.gz ANWLNGSVTRJHDY-CFVMTHIKSA-N 2 0 236.403 2.483 20 0 BEADRP COC1CC([NH2+]C2CCC(C)([NH+](C)C)CC2)C1 ZINC000715504792 712523720 /nfs/dbraw/zinc/52/37/20/712523720.db2.gz DKSOJRHWQPPCJL-UHFFFAOYSA-N 2 0 240.391 2.016 20 0 BEADRP CC[NH+]1CCC([NH2+]CC[C@@H]2CCCS2)CC1 ZINC000715600043 712527592 /nfs/dbraw/zinc/52/75/92/712527592.db2.gz HXWSALWKJGZUEH-ZDUSSCGKSA-N 2 0 242.432 2.346 20 0 BEADRP C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000716528144 712567119 /nfs/dbraw/zinc/56/71/19/712567119.db2.gz CMXWUNUGCUQNPL-BBJIVYBFSA-N 2 0 248.414 2.256 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@@H]1C[C@@H]1[C@H]1C[C@H]1C ZINC000716544853 712567495 /nfs/dbraw/zinc/56/74/95/712567495.db2.gz IQPUOTDOBRJITF-DGTMBMJNSA-N 2 0 224.392 2.386 20 0 BEADRP C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000716546518 712567646 /nfs/dbraw/zinc/56/76/46/712567646.db2.gz PTMZAUSDWZPSMY-IKKURHKOSA-N 2 0 222.376 2.138 20 0 BEADRP C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000716622808 712568211 /nfs/dbraw/zinc/56/82/11/712568211.db2.gz JMZLDYSGVHZZMN-QDIQDFCCSA-N 2 0 248.414 2.493 20 0 BEADRP CC1(C)CO[C@H](CC[NH2+][C@@H]2CCC[C@H]([NH3+])C2)C1 ZINC000717287217 712645259 /nfs/dbraw/zinc/64/52/59/712645259.db2.gz ZJQNWYIIVPWOEX-YNEHKIRRSA-N 2 0 240.391 2.051 20 0 BEADRP CCCC[C@@H](C)[NH2+]C[C@H]1C[NH2+]CCC1(F)F ZINC000717303986 712645762 /nfs/dbraw/zinc/64/57/62/712645762.db2.gz LJTRTXVYEMPTDA-GHMZBOCLSA-N 2 0 234.334 2.400 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@@H]2CC[C@H]2C)CC1 ZINC000380034508 712683667 /nfs/dbraw/zinc/68/36/67/712683667.db2.gz RKILNQSHPJWLOO-DGCLKSJQSA-N 2 0 210.365 2.106 20 0 BEADRP C1=CCCC([NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)CC1 ZINC000718019526 712736348 /nfs/dbraw/zinc/73/63/48/712736348.db2.gz OGFIROAVMCLREQ-UMVBOHGHSA-N 2 0 234.387 2.463 20 0 BEADRP C[C@@H]([NH2+]C1CCC=CCC1)[C@H]1CCC[NH2+]1 ZINC000718020717 712736442 /nfs/dbraw/zinc/73/64/42/712736442.db2.gz VVZIAKPUBUUPTQ-DGCLKSJQSA-N 2 0 208.349 2.215 20 0 BEADRP CC(C)(C)[NH+]1CCC([NH2+][C@H]2CCSC2)CC1 ZINC000037786315 712756919 /nfs/dbraw/zinc/75/69/19/712756919.db2.gz HHRRTRSDTTWQBT-LBPRGKRZSA-N 2 0 242.432 2.344 20 0 BEADRP C[C@H]1CC[N@H+](CCCC(C)(F)F)C[C@@H]1C[NH3+] ZINC000718570267 712774743 /nfs/dbraw/zinc/77/47/43/712774743.db2.gz JJFKHMLOJIXFSL-QWRGUYRKSA-N 2 0 234.334 2.339 20 0 BEADRP CC(F)(F)CCC[N@@H+]1C[C@@H]2CCC[C@H]([NH3+])[C@H]2C1 ZINC000718583532 712775651 /nfs/dbraw/zinc/77/56/51/712775651.db2.gz KRSJONZQHOAUDX-SRVKXCTJSA-N 2 0 246.345 2.481 20 0 BEADRP C[C@H](C[NH2+][C@@H](C)C1CC1)C[NH+]1CCCCC1 ZINC000038041775 712801113 /nfs/dbraw/zinc/80/11/13/712801113.db2.gz RPTNWAKTFJXHQR-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1[C@@H](Nc2cc[nH+]c3ccccc23)CC[N@@H+]1C ZINC000719577341 712812109 /nfs/dbraw/zinc/81/21/09/712812109.db2.gz SEALIFJDIQULKP-YPMHNXCESA-N 2 0 241.338 2.161 20 0 BEADRP CC[C@H](C)C[N@@H+]1C[C@H](C[NH3+])[C@H](C(F)(F)F)C1 ZINC000720805287 712867016 /nfs/dbraw/zinc/86/70/16/712867016.db2.gz LXPXVKPHNYVQSO-LPEHRKFASA-N 2 0 238.297 2.102 20 0 BEADRP C[C@@H](C[N@@H+]1C[C@@H]2C[NH2+]C[C@]2(C)C1)C(C)(C)C ZINC000720829967 712868922 /nfs/dbraw/zinc/86/89/22/712868922.db2.gz IOVGIGLONHPAAA-SGMGOOAPSA-N 2 0 224.392 2.210 20 0 BEADRP [NH3+]C[C@H]1C[N@H+](CC2CC=CC2)C[C@@H]1C(F)(F)F ZINC000720878443 712872693 /nfs/dbraw/zinc/87/26/93/712872693.db2.gz SRFYJVGKYQQGQN-QWRGUYRKSA-N 2 0 248.292 2.022 20 0 BEADRP [NH3+]CCCCCC[N@@H+]1CCC2(CCC2)C1 ZINC000380308362 712873666 /nfs/dbraw/zinc/87/36/66/712873666.db2.gz REQCRFOMNVOGSX-UHFFFAOYSA-N 2 0 210.365 2.382 20 0 BEADRP CCC(CC)CN1C[C@@H](C(F)(F)F)[C@H]([NH3+])C1 ZINC000720901905 712875856 /nfs/dbraw/zinc/87/58/56/712875856.db2.gz ZHHPGNULEWNJME-NXEZZACHSA-N 2 0 238.297 2.244 20 0 BEADRP CC1(C[NH2+][C@@H]2CCC[C@H]2C[NH3+])CC(F)(F)C1 ZINC000720912886 712877853 /nfs/dbraw/zinc/87/78/53/712877853.db2.gz QYRPJRNIKFHNFM-VHSXEESVSA-N 2 0 232.318 2.139 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+][C@H]1CCCC[C@@H]1C ZINC000721123526 712891409 /nfs/dbraw/zinc/89/14/09/712891409.db2.gz XPBTWURDHMCQFJ-DGAVXFQQSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]([NH2+]CCN1CCC[C@H]1C)C1CCC1 ZINC000380354072 712892797 /nfs/dbraw/zinc/89/27/97/712892797.db2.gz WHKOPDFPNJLOJR-VXGBXAGGSA-N 2 0 210.365 2.249 20 0 BEADRP CC1CC[NH+](C[C@H]2CCC[N@H+](C)C2)CC1 ZINC001208603584 957093356 /nfs/dbraw/zinc/09/33/56/957093356.db2.gz FCWFVFFKVRVEKZ-ZDUSSCGKSA-N 2 0 210.365 2.060 20 0 BEADRP C[NH+](C)[C@@H]1CCCN(c2cc3[nH]ccc3c[nH+]2)C1 ZINC001165034496 721887014 /nfs/dbraw/zinc/88/70/14/721887014.db2.gz GOMWHMRSWFCTMA-GFCCVEGCSA-N 2 0 244.342 2.093 20 0 BEADRP C[C@H]([NH3+])C1CC[NH+](CC=C(Cl)Cl)CC1 ZINC000403316027 958448700 /nfs/dbraw/zinc/44/87/00/958448700.db2.gz DUVBUIDTUXGKFT-QMMMGPOBSA-N 2 0 237.174 2.365 20 0 BEADRP CC[C@H]1CC[C@@H]([NH+]2CCC(C)([NH3+])CC2)C1 ZINC000309517383 959899087 /nfs/dbraw/zinc/89/90/87/959899087.db2.gz ZAMQIZUWKCYYKI-NWDGAFQWSA-N 2 0 210.365 2.378 20 0 BEADRP Cc1cc(C[N@@H+]2C[C@@H](C[NH3+])[C@H](C)C2)cs1 ZINC000708864160 959985491 /nfs/dbraw/zinc/98/54/91/959985491.db2.gz XGBZLTOOERYNPF-BXKDBHETSA-N 2 0 224.373 2.083 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@H]2C[C@H]3C[C@H]3C2)CC1 ZINC001167896323 961518289 /nfs/dbraw/zinc/51/82/89/961518289.db2.gz AZMLENWOPPUPNC-WDNDVIMCSA-N 2 0 222.376 2.106 20 0 BEADRP [NH3+]CCCC[N@@H+]1CCC[C@H]1c1nccs1 ZINC000710598913 962417432 /nfs/dbraw/zinc/41/74/32/962417432.db2.gz WRIGTVYBDQEDRM-JTQLQIEISA-N 2 0 225.361 2.019 20 0 BEADRP C[NH+](C)C1CCC([NH+]2CC3(CCC3)C2)CC1 ZINC001168315344 964427755 /nfs/dbraw/zinc/42/77/55/964427755.db2.gz UXWCNECHCJSKIU-UHFFFAOYSA-N 2 0 222.376 2.345 20 0 BEADRP C1=C[C@H]([NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)CC1 ZINC000698277945 965164744 /nfs/dbraw/zinc/16/47/44/965164744.db2.gz MSEXMNOJWLCOEG-RFQIPJPRSA-N 2 0 220.360 2.215 20 0 BEADRP Cc1cc(CN2[C@@H](C)CC[C@H]2C[NH3+])cc(C)n1 ZINC001205076735 965494429 /nfs/dbraw/zinc/49/44/29/965494429.db2.gz VJWKNYAAYWRXQK-JSGCOSHPSA-N 2 0 233.359 2.010 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[C@H]([NH3+])C1)c1nccs1 ZINC000070733424 1165845334 /nfs/dbraw/zinc/84/53/34/1165845334.db2.gz HXQWISHEQFXPIS-AXFHLTTASA-N 2 0 239.388 2.311 20 0 BEADRP C[NH2+]Cc1cccc(CC[NH+]2CCCC2)c1 ZINC001250166112 967463056 /nfs/dbraw/zinc/46/30/56/967463056.db2.gz GUVWALWPMUYLKH-UHFFFAOYSA-N 2 0 218.344 2.044 20 0 BEADRP CS[C@@H](C)CC[N@@H+]1CCC[C@](F)(C[NH3+])CC1 ZINC001205546026 967687440 /nfs/dbraw/zinc/68/74/40/967687440.db2.gz PDGGCIWHBLMORE-NWDGAFQWSA-N 2 0 248.411 2.281 20 0 BEADRP CS[C@H](C)CC[N@@H+]1CC[C@@H](C)[C@@H](C[NH3+])CC1 ZINC001205602586 967716448 /nfs/dbraw/zinc/71/64/48/967716448.db2.gz KBRQRGRPMILCNH-JHJVBQTASA-N 2 0 244.448 2.435 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH2+]C2CCCCC2)CC1 ZINC000075135659 1165887002 /nfs/dbraw/zinc/88/70/02/1165887002.db2.gz NGBRGWRBHKHQDU-CYBMUJFWSA-N 2 0 210.365 2.393 20 0 BEADRP CCCCC[C@H](C)[NH2+]C[C@H](C)C[NH2+]C ZINC000086070526 1165900655 /nfs/dbraw/zinc/90/06/55/1165900655.db2.gz DKKIACASKXZLFA-NEPJUHHUSA-N 2 0 200.370 2.400 20 0 BEADRP C[C@@H]1C[N@H+](CC(C)(C)C)CCC[C@H]1C[NH3+] ZINC001205981139 967918670 /nfs/dbraw/zinc/91/86/70/967918670.db2.gz BXWMJAUPGZPUKG-NEPJUHHUSA-N 2 0 212.381 2.339 20 0 BEADRP C[C@H]1C[N@H+](CCC(F)(F)F)CCC[C@H]1C[NH3+] ZINC001205984634 967931936 /nfs/dbraw/zinc/93/19/36/967931936.db2.gz SQWMARVTWJOKTJ-UWVGGRQHSA-N 2 0 238.297 2.246 20 0 BEADRP CC(C)(C)C[N@@H+]1CCC[C@](C)(C[NH3+])CC1 ZINC001206297273 968207052 /nfs/dbraw/zinc/20/70/52/968207052.db2.gz XEFGZQVEVRGSGM-ZDUSSCGKSA-N 2 0 212.381 2.483 20 0 BEADRP C[C@@H](Cc1ccco1)[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000086403001 1166006348 /nfs/dbraw/zinc/00/63/48/1166006348.db2.gz BAGGXJGLXYBLDG-SDDRHHMPSA-N 2 0 222.332 2.070 20 0 BEADRP C[N@H+](CC1CC[NH2+]CC1)C[C@@]1(C)CCCS1 ZINC000327476199 1166018280 /nfs/dbraw/zinc/01/82/80/1166018280.db2.gz KUTITSIABDOCBG-CYBMUJFWSA-N 2 0 242.432 2.204 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]C[C@H]1C[C@@H]1C ZINC000389914039 1166051274 /nfs/dbraw/zinc/05/12/74/1166051274.db2.gz LTZJUFCOZNCNAV-RWMBFGLXSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H]1CC[C@H]([NH+]2CCC(C[NH3+])CC2)C[C@@H]1C ZINC000082838443 1166079025 /nfs/dbraw/zinc/07/90/25/1166079025.db2.gz DWJSHRFMKXXRCY-DYEKYZERSA-N 2 0 224.392 2.482 20 0 BEADRP C[C@@H]1CC[C@@H]([NH+]2CCC(C[NH3+])CC2)C[C@@H]1C ZINC000082838447 1166079642 /nfs/dbraw/zinc/07/96/42/1166079642.db2.gz DWJSHRFMKXXRCY-MBNYWOFBSA-N 2 0 224.392 2.482 20 0 BEADRP CC[C@@H](C)[N@H+](C)CCC1CC[NH+](C)CC1 ZINC001207482591 968799917 /nfs/dbraw/zinc/79/99/17/968799917.db2.gz YNMUIAQWGKIDJP-GFCCVEGCSA-N 2 0 212.381 2.449 20 0 BEADRP C[N@H+](CCCCCC[NH3+])CCC(F)(F)F ZINC000083890067 1166129822 /nfs/dbraw/zinc/12/98/22/1166129822.db2.gz PMGGXAHKADXWQD-UHFFFAOYSA-N 2 0 226.286 2.390 20 0 BEADRP C[C@@H]1CC[N@H+](CC2(C)CC[NH+](C)CC2)C[C@H]1F ZINC001208108080 969001934 /nfs/dbraw/zinc/00/19/34/969001934.db2.gz POLDPFHMMVLWNF-CHWSQXEVSA-N 2 0 242.382 2.398 20 0 BEADRP CCCC1([NH2+]C[C@@H](O)C[NH+](CC)CC)CCC1 ZINC001253211668 969111853 /nfs/dbraw/zinc/11/18/53/969111853.db2.gz JKATTZISEYJDQN-CYBMUJFWSA-N 2 0 242.407 2.002 20 0 BEADRP C[C@@H]1CCC[N@H+](C[C@@H]2CCC[NH+](C)C2)CC1 ZINC001208608487 969145995 /nfs/dbraw/zinc/14/59/95/969145995.db2.gz UFHROKJUYYZTTE-ZIAGYGMSSA-N 2 0 224.392 2.450 20 0 BEADRP CCC[N@H+](CCC[NH3+])[C@H]1CCC[C@@H](OC)C1 ZINC000226539033 1166288432 /nfs/dbraw/zinc/28/84/32/1166288432.db2.gz QBEYDSJLKQOUCJ-QWHCGFSZSA-N 2 0 228.380 2.005 20 0 BEADRP CC[C@H](C)C[C@H](CC)[N@H+](C)CCC[NH3+] ZINC000227744772 1166308549 /nfs/dbraw/zinc/30/85/49/1166308549.db2.gz NYICZAMSKZTNLI-RYUDHWBXSA-N 2 0 200.370 2.482 20 0 BEADRP CC1(C)CC[C@H]([N@@H+]2C[C@H]3CCC[NH2+][C@H]3C2)C1 ZINC000299893892 1166326816 /nfs/dbraw/zinc/32/68/16/1166326816.db2.gz QAAUZYSTLBVUID-AGIUHOORSA-N 2 0 222.376 2.249 20 0 BEADRP COCCC[N@H+](C)CC1CC[NH+](C(C)C)CC1 ZINC001209050847 969339024 /nfs/dbraw/zinc/33/90/24/969339024.db2.gz YCWNTKNKPFNROH-UHFFFAOYSA-N 2 0 242.407 2.075 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]CCC1CC1)C2 ZINC001169098599 969391369 /nfs/dbraw/zinc/39/13/69/969391369.db2.gz JOJCVAXEZFOTBJ-CLLJXQQHSA-N 2 0 208.349 2.001 20 0 BEADRP C([C@H]1CCCC[NH2+]1)[N@@H+]1CCC[C@@H]2CCC[C@H]21 ZINC000228015312 1166381122 /nfs/dbraw/zinc/38/11/22/1166381122.db2.gz CYKPDYNGQBVWRG-BFHYXJOUSA-N 2 0 222.376 2.393 20 0 BEADRP C[C@@H]1C[C@@H](C[N@H+](C)CCC[NH+](C)C)C[C@H](C)O1 ZINC001209378720 969452147 /nfs/dbraw/zinc/45/21/47/969452147.db2.gz MWGRDQYMHRVDGH-BTTYYORXSA-N 2 0 242.407 2.074 20 0 BEADRP COC(C)(C)CC[N@H+](C)CC1CC[NH+](C)CC1 ZINC001209408141 969471468 /nfs/dbraw/zinc/47/14/68/969471468.db2.gz ZUPBBFIVYILMDJ-UHFFFAOYSA-N 2 0 242.407 2.075 20 0 BEADRP CCC(CC)C[N@@H+]1CC[C@H]2[NH2+]CCC[C@H]2C1 ZINC000250783398 1166430091 /nfs/dbraw/zinc/43/00/91/1166430091.db2.gz UNRGAQPCHRQAEI-UONOGXRCSA-N 2 0 224.392 2.497 20 0 BEADRP CCN1CCC([NH+]2CCC(C)(F)CC2)CC1 ZINC001169246071 969537304 /nfs/dbraw/zinc/53/73/04/969537304.db2.gz OEBYGTMNYLBUEE-UHFFFAOYSA-N 2 0 228.355 2.295 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH2+][C@@H]2C[C@@H]3CC[C@H]2C3)CC1 ZINC001254511875 969679815 /nfs/dbraw/zinc/67/98/15/969679815.db2.gz GSRQPTMSBXOFLW-ZOBORPQBSA-N 2 0 222.376 2.249 20 0 BEADRP CCC1([NH2+][C@H]2CCC[N@H+](C)CC2)CCC1 ZINC001254510899 969683353 /nfs/dbraw/zinc/68/33/53/969683353.db2.gz RCOZCGMIGQORBI-LBPRGKRZSA-N 2 0 210.365 2.393 20 0 BEADRP C(C1CCCC1)[N@@H+]1CC[C@H]2[NH2+]CCC[C@H]2C1 ZINC000251020629 1166485487 /nfs/dbraw/zinc/48/54/87/1166485487.db2.gz FCEUXDMDVFQAQD-UONOGXRCSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@@H](CC(F)(F)F)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000158258528 1166514287 /nfs/dbraw/zinc/51/42/87/1166514287.db2.gz HVPWLNGGQRNKPX-UWVGGRQHSA-N 2 0 238.297 2.259 20 0 BEADRP CCCC[C@H](C)[N@@H+]1CCC[C@H](C[NH2+]C)C1 ZINC000394604441 1166605118 /nfs/dbraw/zinc/60/51/18/1166605118.db2.gz FMWRNVIIJOXCJQ-QWHCGFSZSA-N 2 0 212.381 2.497 20 0 BEADRP Cc1c[nH+]c(NC2(C)CC[NH2+]CC2)c(C)c1 ZINC000394774526 1166618270 /nfs/dbraw/zinc/61/82/70/1166618270.db2.gz WDPREXKFRWZJCG-UHFFFAOYSA-N 2 0 219.332 2.252 20 0 BEADRP C[C@H]([NH2+]CC1CC[NH+](C)CC1)C1(Cl)CC1 ZINC000695665955 1166663444 /nfs/dbraw/zinc/66/34/44/1166663444.db2.gz FZJGNYKNNPCFJJ-JTQLQIEISA-N 2 0 230.783 2.078 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CCCC(F)(F)F)CC[NH2+]1 ZINC000709318299 1166690848 /nfs/dbraw/zinc/69/08/48/1166690848.db2.gz HKOODRKZLQFAAN-IUCAKERBSA-N 2 0 224.270 2.059 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+][C@@H](COC)C(C)C ZINC001255941599 970572324 /nfs/dbraw/zinc/57/23/24/970572324.db2.gz UQMAQIOLWDIDAG-KGLIPLIRSA-N 2 0 244.423 2.367 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]CC(C)(C)OC ZINC001255943677 970574826 /nfs/dbraw/zinc/57/48/26/970574826.db2.gz PTBSNJMEQZYROF-LBPRGKRZSA-N 2 0 230.396 2.121 20 0 BEADRP C[C@@H]1CC[C@H]1[NH2+]CCC1CC[NH+](C)CC1 ZINC000379894870 1166809142 /nfs/dbraw/zinc/80/91/42/1166809142.db2.gz BQFUNVSECOBISQ-DGCLKSJQSA-N 2 0 210.365 2.106 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+][C@@H]1CCO[C@@H](C)C1 ZINC001255954370 970579277 /nfs/dbraw/zinc/57/92/77/970579277.db2.gz VOZQLFCSAXSRIX-MELADBBJSA-N 2 0 242.407 2.264 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]CC1(CC)COC1 ZINC001255944917 970579319 /nfs/dbraw/zinc/57/93/19/970579319.db2.gz HWHCZIXORWQYLD-ZDUSSCGKSA-N 2 0 242.407 2.123 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]CCCC(C)(C)O ZINC001255948164 970582725 /nfs/dbraw/zinc/58/27/25/970582725.db2.gz GKHDVDIIFZPEBB-ZDUSSCGKSA-N 2 0 244.423 2.248 20 0 BEADRP CCCC[C@@H](CO)[NH2+][C@@H](C)CC[NH+](CC)CC ZINC001255946614 970583428 /nfs/dbraw/zinc/58/34/28/970583428.db2.gz XDPBKEYENHUSBF-KBPBESRZSA-N 2 0 244.423 2.248 20 0 BEADRP CC(C)[C@H]1CCC[C@H]([NH2+][C@@H]2C[NH2+]C[C@H]2C)C1 ZINC000925784864 1166833008 /nfs/dbraw/zinc/83/30/08/1166833008.db2.gz OIDHSXDPFVAVLJ-ZOBORPQBSA-N 2 0 224.392 2.399 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+][C@@]1(C)CCCOC1 ZINC001255955346 970588117 /nfs/dbraw/zinc/58/81/17/970588117.db2.gz RFQMRUAWWQVZQV-KGLIPLIRSA-N 2 0 242.407 2.266 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[N@H+](CC)CCOC ZINC001255955973 970594450 /nfs/dbraw/zinc/59/44/50/970594450.db2.gz YIUSGXCKHVTLLN-CYBMUJFWSA-N 2 0 230.396 2.075 20 0 BEADRP CSC(C)(C)C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000401024984 970655043 /nfs/dbraw/zinc/65/50/43/970655043.db2.gz NCYMTHCEAIPDFL-IJLUTSLNSA-N 2 0 242.432 2.106 20 0 BEADRP C[NH+]1CCC(C[NH2+]CC2=CCCC2)CC1 ZINC000401143285 970664972 /nfs/dbraw/zinc/66/49/72/970664972.db2.gz HQVYMQMWNHOJSH-UHFFFAOYSA-N 2 0 208.349 2.028 20 0 BEADRP CCCC[N@H+](C)C[C@H](C)Nc1cc[nH+]cc1 ZINC000381561565 1166945618 /nfs/dbraw/zinc/94/56/18/1166945618.db2.gz RMDVXMAIYYQBQN-LBPRGKRZSA-N 2 0 221.348 2.036 20 0 BEADRP CC[NH+](CC)C1CCC([NH2+]CCF)CC1 ZINC001173105842 975025780 /nfs/dbraw/zinc/02/57/80/975025780.db2.gz WFVRTVHRPVHJCQ-UHFFFAOYSA-N 2 0 216.344 2.199 20 0 BEADRP CCC[NH+]1C[C@@H]2C[NH+]([C@H]3C[C@H]4C[C@H]4C3)C[C@H]2C1 ZINC001167949400 1167005676 /nfs/dbraw/zinc/00/56/76/1167005676.db2.gz WWQTWCMGXFKSCW-KHMAMNHCSA-N 2 0 234.387 2.059 20 0 BEADRP CC[C@H]1CC[C@H]([NH2+][C@@H]2CCC[C@H]([NH3+])C2)C1 ZINC001173260889 975108770 /nfs/dbraw/zinc/10/87/70/975108770.db2.gz PISDPAXZQOFEBA-RVMXOQNASA-N 2 0 210.365 2.425 20 0 BEADRP CCSC[C@@H](C)[NH2+]CC1CC[NH+](CC)CC1 ZINC001173289343 975255399 /nfs/dbraw/zinc/25/53/99/975255399.db2.gz UPXWLRZTJURFJN-GFCCVEGCSA-N 2 0 244.448 2.450 20 0 BEADRP C1=CC[NH+](C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)C1 ZINC001167983818 1167080651 /nfs/dbraw/zinc/08/06/51/1167080651.db2.gz IOTMICXGBVAXBM-YIONKMFJSA-N 2 0 232.371 2.264 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@@H+]([C@H](C)CCC(C)C)C1 ZINC000251394394 1167140404 /nfs/dbraw/zinc/14/04/04/1167140404.db2.gz KPGDIFINHNNYJY-OLZOCXBDSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[C@@H]([NH3+])C1)c1nccs1 ZINC000227114924 1167158926 /nfs/dbraw/zinc/15/89/26/1167158926.db2.gz HXQWISHEQFXPIS-GARJFASQSA-N 2 0 239.388 2.311 20 0 BEADRP CCC[N@H+](CC(C)C)[C@@H]1CC[NH2+][C@H](C)C1 ZINC000308804533 1167199974 /nfs/dbraw/zinc/19/99/74/1167199974.db2.gz AGLFTHMQEWJUPQ-CHWSQXEVSA-N 2 0 212.381 2.495 20 0 BEADRP C[C@@H]1CC[C@@H]([N@@H+]2CCCC[C@@H](C[NH3+])C2)C1 ZINC000308800137 1167200917 /nfs/dbraw/zinc/20/09/17/1167200917.db2.gz DJVGPPMTVMUBFL-FRRDWIJNSA-N 2 0 210.365 2.236 20 0 BEADRP CCC[N@H+](CC(C)C)[C@@H]1CC[NH2+][C@@H](C)C1 ZINC000308804536 1167200952 /nfs/dbraw/zinc/20/09/52/1167200952.db2.gz AGLFTHMQEWJUPQ-QWHCGFSZSA-N 2 0 212.381 2.495 20 0 BEADRP CC[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)[C@@H]2CC2(F)F)C1 ZINC001333338328 975678934 /nfs/dbraw/zinc/67/89/34/975678934.db2.gz OHEPKJYQWQFTHC-TUAOUCFPSA-N 2 0 246.345 2.352 20 0 BEADRP CCCC[C@@H](C)[N@H+](C)CC1CC[NH2+]CC1 ZINC000309023470 1167238908 /nfs/dbraw/zinc/23/89/08/1167238908.db2.gz WKZALUMOPUXKMZ-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP CC[C@H](C)[NH2+][C@H]1CC[N@@H+](C(C)C)C[C@@H]1C ZINC000309236974 1167271827 /nfs/dbraw/zinc/27/18/27/1167271827.db2.gz XSKHLAYIAOYXFS-AVGNSLFASA-N 2 0 212.381 2.493 20 0 BEADRP CC[C@H](C)[NH2+][C@H]1CC[N@@H+](C(C)C)C[C@H]1C ZINC000309236972 1167271248 /nfs/dbraw/zinc/27/12/48/1167271248.db2.gz XSKHLAYIAOYXFS-AGIUHOORSA-N 2 0 212.381 2.493 20 0 BEADRP CCCC[C@H](CC)[N@@H+]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000309409526 1167301961 /nfs/dbraw/zinc/30/19/61/1167301961.db2.gz KABQJUBGNWPMEC-RDBSUJKOSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)C[C@H](CNc1cc[nH+]cc1)[NH+](C)C ZINC000309422854 1167304064 /nfs/dbraw/zinc/30/40/64/1167304064.db2.gz AETKSDMSYDBJDA-CYBMUJFWSA-N 2 0 221.348 2.470 20 0 BEADRP C[C@@H]1C[NH2+]CC[N@H+](CCCC2CCCC2)C1 ZINC000225275568 1167362465 /nfs/dbraw/zinc/36/24/65/1167362465.db2.gz CNAVHSFXFPDESM-CYBMUJFWSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H]1C[N@@H+]([C@@H]2CCc3c2cccc3F)CC[C@H]1[NH3+] ZINC000251617099 1167450004 /nfs/dbraw/zinc/45/00/04/1167450004.db2.gz DTEYCLRRZGABKQ-VCTAVGKDSA-N 2 0 248.345 2.482 20 0 BEADRP C[NH+](C)Cc1cccc(C2=CC[NH2+]CC2)c1 ZINC000033487570 1167551524 /nfs/dbraw/zinc/55/15/24/1167551524.db2.gz FEBSYZFVMPSDEA-UHFFFAOYSA-N 2 0 216.328 2.125 20 0 BEADRP CCC[N@H+](CC)C[C@@H](C)Nc1cc[nH+]cc1 ZINC000381429088 1167601594 /nfs/dbraw/zinc/60/15/94/1167601594.db2.gz ZYOGCQMIVBXARA-GFCCVEGCSA-N 2 0 221.348 2.036 20 0 BEADRP CCCC[N@H+](CCC)CC1CC[NH2+]CC1 ZINC000086701944 1167640732 /nfs/dbraw/zinc/64/07/32/1167640732.db2.gz QCFKQAXSAGJHQM-UHFFFAOYSA-N 2 0 212.381 2.498 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2C[C@@H]3CC[NH2+]C[C@@H]3C2)C[C@H]1C ZINC000310397862 1167682230 /nfs/dbraw/zinc/68/22/30/1167682230.db2.gz MIFPGUTWJHAJDJ-QMIVOQANSA-N 2 0 236.403 2.352 20 0 BEADRP CCC[C@H](C[N@H+](C)C1CCC([NH3+])CC1)OC ZINC000386437205 1167710331 /nfs/dbraw/zinc/71/03/31/1167710331.db2.gz MFBLKWMQNZIVPZ-WXRRBKDZSA-N 2 0 228.380 2.003 20 0 BEADRP CS[C@H](C)CC[N@H+]1C[C@@H]2CC[NH2+]CC[C@@H]2C1 ZINC001236315220 979524428 /nfs/dbraw/zinc/52/44/28/979524428.db2.gz WHQWNLQJKNWGMC-UPJWGTAASA-N 2 0 242.432 2.059 20 0 BEADRP CC(C)CC[N@@H+]1CCCC[C@](C)(C[NH3+])C1 ZINC001206542130 979646905 /nfs/dbraw/zinc/64/69/05/979646905.db2.gz SDXMLUZCXBQJDL-CYBMUJFWSA-N 2 0 212.381 2.483 20 0 BEADRP CCC[C@@H]1C[N@H+](CCCCCCC[NH3+])CCO1 ZINC000708896438 1168380728 /nfs/dbraw/zinc/38/07/28/1168380728.db2.gz DEZOFMWXTJWKSM-CQSZACIVSA-N 2 0 242.407 2.397 20 0 BEADRP CC(C)CC[C@@H](C)[NH2+]C[C@H]1CC[N@H+](C)C1 ZINC000037484738 1168418876 /nfs/dbraw/zinc/41/88/76/1168418876.db2.gz ARIUGHDZUNOUIH-CHWSQXEVSA-N 2 0 212.381 2.352 20 0 BEADRP C[NH+](C)C[C@@H]1CCCN1c1cc2[nH]ccc2c[nH+]1 ZINC001165070937 1168428929 /nfs/dbraw/zinc/42/89/29/1168428929.db2.gz AQJYGEVUQJUKPI-LBPRGKRZSA-N 2 0 244.342 2.093 20 0 BEADRP CC[C@H](C)[NH2+]CCCC[NH+](CC)CC ZINC000177961622 1168450931 /nfs/dbraw/zinc/45/09/31/1168450931.db2.gz DYWQGSTZANNDCW-LBPRGKRZSA-N 2 0 200.370 2.497 20 0 BEADRP [NH3+]CC1(Cc2ccccc2Cl)CC[NH2+]CC1 ZINC001239323932 980533803 /nfs/dbraw/zinc/53/38/03/980533803.db2.gz MVAFIXDMTDYUBF-UHFFFAOYSA-N 2 0 238.762 2.211 20 0 BEADRP C1=C(c2cccc(C3CC[NH2+]CC3)c2)C[NH2+]C1 ZINC001243111099 1168517879 /nfs/dbraw/zinc/51/78/79/1168517879.db2.gz BHNCJKKEBLLEAA-UHFFFAOYSA-N 2 0 228.339 2.140 20 0 BEADRP [NH3+]C[C@@]1(F)CCC[N@H+](CC2CCCC2)CC1 ZINC001205539363 980914792 /nfs/dbraw/zinc/91/47/92/980914792.db2.gz XNUIAAOOYZFZKW-CYBMUJFWSA-N 2 0 228.355 2.330 20 0 BEADRP c1cc(N[C@H]2CC[N@@H+]3CCC[C@H]3C2)cc[nH+]1 ZINC000227334113 1168658540 /nfs/dbraw/zinc/65/85/40/1168658540.db2.gz MFZAQQAQOHQLGQ-STQMWFEESA-N 2 0 217.316 2.120 20 0 BEADRP CC[C@H](C)C[N@@H+]1CC[C@@H](C)[C@H](C[NH3+])CC1 ZINC001205605136 1168791084 /nfs/dbraw/zinc/79/10/84/1168791084.db2.gz ZFSKTNUGBGMHML-XQQFMLRXSA-N 2 0 212.381 2.339 20 0 BEADRP [NH3+]CCCC[NH2+]Cc1ccccc1C1CC1 ZINC000087011886 1168919683 /nfs/dbraw/zinc/91/96/83/1168919683.db2.gz YPOUHWBXMCVLTR-UHFFFAOYSA-N 2 0 218.344 2.393 20 0 BEADRP CC1(C)CO[C@H](CC[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)C1 ZINC000717287182 1168967952 /nfs/dbraw/zinc/96/79/52/1168967952.db2.gz ZJQNWYIIVPWOEX-JHJVBQTASA-N 2 0 240.391 2.051 20 0 BEADRP Cc1cccc(CN(C)[C@@H]2CCC[NH2+]C2)c1C ZINC000110926769 1168984629 /nfs/dbraw/zinc/98/46/29/1168984629.db2.gz UTAFLRTUHHEWEQ-OAHLLOKOSA-N 2 0 232.371 2.487 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[N@H+](C)C[C@H]21)C1CCCC1 ZINC001308983264 1169055562 /nfs/dbraw/zinc/05/55/62/1169055562.db2.gz BVPJGNMQJYRLQU-SPWCGHHHSA-N 2 0 236.403 2.495 20 0 BEADRP CO[C@@H]1CC[C@H](C)[N@H+](CCCCCCC[NH3+])C1 ZINC000687197959 1169122704 /nfs/dbraw/zinc/12/27/04/1169122704.db2.gz UXZMLYLYFISVFH-UONOGXRCSA-N 2 0 242.407 2.395 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H]1CC[C@@H]2CCC[C@@H]21 ZINC001575953424 984136728 /nfs/dbraw/zinc/13/67/28/984136728.db2.gz ZUIOYFFXOKGGSV-VOAKCMCISA-N 2 0 210.365 2.282 20 0 BEADRP Cc1cc(C[N@@H+]2CCC[C@H](C[NH3+])C2)cs1 ZINC000379828356 1169232872 /nfs/dbraw/zinc/23/28/72/1169232872.db2.gz YCSPXMJREHBLSP-LLVKDONJSA-N 2 0 224.373 2.227 20 0 BEADRP Cc1cc(C[N@@H+]2CCC[C@@H](C[NH3+])C2)cs1 ZINC000379828357 1169232291 /nfs/dbraw/zinc/23/22/91/1169232291.db2.gz YCSPXMJREHBLSP-NSHDSACASA-N 2 0 224.373 2.227 20 0 BEADRP CCOCC[C@H](C)[NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1 ZINC001172414681 974683147 /nfs/dbraw/zinc/68/31/47/974683147.db2.gz GWOITIFXJWGAKA-MJBXVCDLSA-N 2 0 242.407 2.264 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[N@@H+]1CCC[C@@H](OC)C1 ZINC001255954439 1169272282 /nfs/dbraw/zinc/27/22/82/1169272282.db2.gz DOQOVZANTXYCGZ-UONOGXRCSA-N 2 0 242.407 2.218 20 0 BEADRP CC[C@@H](CC(C)C)[NH2+]C[C@@H]1CC[N@H+](C)C1 ZINC001172384479 974727403 /nfs/dbraw/zinc/72/74/03/974727403.db2.gz INZHPCCJMQYRDC-STQMWFEESA-N 2 0 212.381 2.352 20 0 BEADRP CC[C@H](C)OCC[C@@H](C)[N@@H+]1CCC[C@H]([NH3+])CC1 ZINC001246542264 972568817 /nfs/dbraw/zinc/56/88/17/972568817.db2.gz NZNJWVZWNMQXSB-RDBSUJKOSA-N 2 0 242.407 2.393 20 0 BEADRP CSCC[C@@H](C)[N@@H+]1CCC[C@](F)(C[NH3+])CC1 ZINC001246549605 972695314 /nfs/dbraw/zinc/69/53/14/972695314.db2.gz MMYXUUXDALAISA-VXGBXAGGSA-N 2 0 248.411 2.281 20 0 BEADRP CC1(C)C[C@H]([N@@H+]2CCC[C@@](C)(C[NH3+])CC2)CO1 ZINC001246572958 972864354 /nfs/dbraw/zinc/86/43/54/972864354.db2.gz DSOHJILIZWFVCE-GXTWGEPZSA-N 2 0 240.391 2.005 20 0 BEADRP CC(C)C[C@@H](C)C[C@H](C)[N@H+]1C[C@@H]2[C@H]([NH3+])[C@@H]2C1 ZINC001246666659 973078128 /nfs/dbraw/zinc/07/81/28/973078128.db2.gz WVMYHYMFPFBHBB-XHJNMGKDSA-N 2 0 224.392 2.336 20 0 BEADRP CCOc1cc[nH+]c(N[C@H]2CCC[C@@H]([NH3+])C2)c1 ZINC001154986619 1169417793 /nfs/dbraw/zinc/41/77/93/1169417793.db2.gz UGRIIGPRIALIMN-MNOVXSKESA-N 2 0 235.331 2.162 20 0 BEADRP Cc1cc2[nH]ccc2c(N2CCC[C@H]([NH3+])[C@H]2C)[nH+]1 ZINC001157740994 970767152 /nfs/dbraw/zinc/76/71/52/970767152.db2.gz JDQYQBNFJDWLDV-PWSUYJOCSA-N 2 0 244.342 2.187 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H](C)Cc1ccsc1 ZINC001329023476 973431723 /nfs/dbraw/zinc/43/17/23/973431723.db2.gz IMFQIFJRIYCTRR-GHMZBOCLSA-N 2 0 226.389 2.267 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)[C@@H](C)Cc1ccccn1 ZINC001256425713 970834317 /nfs/dbraw/zinc/83/43/17/970834317.db2.gz JEDDVRJYPLKMGT-AWEZNQCLSA-N 2 0 249.402 2.286 20 0 BEADRP CCOCCC[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC001256558130 970861627 /nfs/dbraw/zinc/86/16/27/970861627.db2.gz QTMFTEFPPBSSCU-UHFFFAOYSA-N 2 0 242.407 2.266 20 0 BEADRP CC[C@H](C)[N@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001256624038 970889358 /nfs/dbraw/zinc/88/93/58/970889358.db2.gz PWAGAJCAABTMGH-ACJTYDJDSA-N 2 0 210.365 2.342 20 0 BEADRP [NH3+]C[C@H]1C[N@H+](CC2CCCCC2)CCC1(F)F ZINC000403216031 970896921 /nfs/dbraw/zinc/89/69/21/970896921.db2.gz GOKPBAVOFQTDOU-LBPRGKRZSA-N 2 0 246.345 2.483 20 0 BEADRP CCC[N@H+](CCC[NH3+])[C@@H](C)Cc1ccncc1 ZINC001256719861 970940655 /nfs/dbraw/zinc/94/06/55/970940655.db2.gz VIIMTBIPIVKBEI-ZDUSSCGKSA-N 2 0 235.375 2.073 20 0 BEADRP C[C@@H](Cc1ccncc1)[NH2+]CC[C@H]1CCC[N@@H+]1C ZINC001256722946 970945646 /nfs/dbraw/zinc/94/56/46/970945646.db2.gz LZGOOLKVGVOWEH-DZGCQCFKSA-N 2 0 247.386 2.087 20 0 BEADRP C[NH2+]Cc1cccc(Nc2cc[nH+]cc2)c1F ZINC001216218664 970990525 /nfs/dbraw/zinc/99/05/25/970990525.db2.gz IIVLXYYYNDZEIU-UHFFFAOYSA-N 2 0 231.274 2.106 20 0 BEADRP CC[N@H+](C)C1CCN(c2cc[nH+]cc2)CC1 ZINC001256854983 970997438 /nfs/dbraw/zinc/99/74/38/970997438.db2.gz CHILMWAIGRPHRF-UHFFFAOYSA-N 2 0 219.332 2.002 20 0 BEADRP [NH3+]CCC1CC[NH+](CC=C(Cl)Cl)CC1 ZINC000403627702 970998537 /nfs/dbraw/zinc/99/85/37/970998537.db2.gz MISYHELQRYRWIA-UHFFFAOYSA-N 2 0 237.174 2.366 20 0 BEADRP C([C@@H]1CC[C@@H]2C[C@@H]2C1)[N@@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000403637631 970999430 /nfs/dbraw/zinc/99/94/30/970999430.db2.gz GRURIJOKTYXMRO-KFWWJZLASA-N 2 0 248.414 2.498 20 0 BEADRP CC[C@@H]1C[N@H+](CCCCCCC[NH3+])[C@@H](C)CO1 ZINC000403915625 971089281 /nfs/dbraw/zinc/08/92/81/971089281.db2.gz OPDNKBAPYNHXIM-UONOGXRCSA-N 2 0 242.407 2.395 20 0 BEADRP CCC[N@H+](CCC[NH3+])C1C[C@H](C)O[C@@H](C)C1 ZINC001257073718 971089196 /nfs/dbraw/zinc/08/91/96/971089196.db2.gz TWRIWVWHUAPISW-RYUDHWBXSA-N 2 0 228.380 2.003 20 0 BEADRP C[C@H]1CC([NH2+]Cc2ccccc2C[NH3+])C[C@H](C)O1 ZINC001257078380 971093061 /nfs/dbraw/zinc/09/30/61/971093061.db2.gz JTSIMKHSNBOTJN-RYUDHWBXSA-N 2 0 248.370 2.191 20 0 BEADRP C[C@@H]1CC([NH2+]C(C)(C)C(C)(C)[NH3+])C[C@@H](C)O1 ZINC001257082857 971095388 /nfs/dbraw/zinc/09/53/88/971095388.db2.gz CGSKMYNZGSUPFF-NXEZZACHSA-N 2 0 228.380 2.048 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]C2(C)CCOCC2)CC1 ZINC001257202039 971122849 /nfs/dbraw/zinc/12/28/49/971122849.db2.gz PFFKZIMRAVOBGQ-UHFFFAOYSA-N 2 0 240.391 2.018 20 0 BEADRP CC(C)N1CCC([NH+]2C3CCC2CC3)CC1 ZINC001257217320 971132093 /nfs/dbraw/zinc/13/20/93/971132093.db2.gz LYPWWFLEUDMELS-UHFFFAOYSA-N 2 0 222.376 2.486 20 0 BEADRP CCC[C@H](CC)N(CCC[NH3+])CCC[NH+](C)C ZINC001257250304 971145234 /nfs/dbraw/zinc/14/52/34/971145234.db2.gz YPJJDEBHGRGRKE-AWEZNQCLSA-N 2 0 243.439 2.168 20 0 BEADRP CCC[C@H](CC)[N@@H+]1C[C@H]2C[C@@]2(C[NH+](C)C)C1 ZINC001257267725 971168920 /nfs/dbraw/zinc/16/89/20/971168920.db2.gz YWGPRHSGUCWHGO-HZSPNIEDSA-N 2 0 224.392 2.449 20 0 BEADRP CCCC(CCC)[N@H+](C)C[C@@H](C)C[NH3+] ZINC001257334080 971181610 /nfs/dbraw/zinc/18/16/10/971181610.db2.gz ZWQMHXMJTNFLLC-NSHDSACASA-N 2 0 200.370 2.482 20 0 BEADRP CCC(CC)[N@H+]1C[C@H]2C[NH+](CC)C[C@H]2C1 ZINC001257301381 971189899 /nfs/dbraw/zinc/18/98/99/971189899.db2.gz DMMHKAQSSZAYPX-TXEJJXNPSA-N 2 0 210.365 2.059 20 0 BEADRP CCC(CC)[N@@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC001257302927 971191485 /nfs/dbraw/zinc/19/14/85/971191485.db2.gz GCGPAICPDYQSOK-ZDUSSCGKSA-N 2 0 210.365 2.203 20 0 BEADRP CCC[C@H](C)[NH2+]CC12CC[NH+](CC1)CC2 ZINC001257308884 971199149 /nfs/dbraw/zinc/19/91/49/971199149.db2.gz LPDWMOUJIYNNJR-LBPRGKRZSA-N 2 0 210.365 2.251 20 0 BEADRP CCC[C@@H](C)[N@H+](C1COC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001257312590 971205409 /nfs/dbraw/zinc/20/54/09/971205409.db2.gz ZEPMMQWGASQVBL-JHJVBQTASA-N 2 0 240.391 2.146 20 0 BEADRP CC(F)(F)CCC[NH2+][C@H]1C[C@@H]([NH3+])C1(C)C ZINC000405223948 971211425 /nfs/dbraw/zinc/21/14/25/971211425.db2.gz NSPRIRDDRNJZOA-BDAKNGLRSA-N 2 0 220.307 2.137 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]CCCc2ccccc2)C12CCC2 ZINC000405232925 971211927 /nfs/dbraw/zinc/21/19/27/971211927.db2.gz BVWQHFSMHLEOLC-CABCVRRESA-N 2 0 244.382 2.479 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+]CCCc2ccccc2)C12CCC2 ZINC000405232928 971212043 /nfs/dbraw/zinc/21/20/43/971212043.db2.gz BVWQHFSMHLEOLC-LSDHHAIUSA-N 2 0 244.382 2.479 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]C[C@@H]2CCCCS2)C12CCC2 ZINC000405237645 971215706 /nfs/dbraw/zinc/21/57/06/971215706.db2.gz FTWUESPRIBYKMF-TUAOUCFPSA-N 2 0 240.416 2.132 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]C[C@@H]2CC=CCC2)C12CCC2 ZINC000405248120 971218569 /nfs/dbraw/zinc/21/85/69/971218569.db2.gz BISZGXXGXUDMMA-UPJWGTAASA-N 2 0 220.360 2.202 20 0 BEADRP Cc1cc(C)c(C[NH2+][C@@H]2C[C@H]([NH3+])C23CCC3)cn1 ZINC000405245382 971221211 /nfs/dbraw/zinc/22/12/11/971221211.db2.gz ZNYQMULKRXUBJN-UONOGXRCSA-N 2 0 245.370 2.058 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]CC(C2CC2)C2CC2)C12CCC2 ZINC000405282579 971224550 /nfs/dbraw/zinc/22/45/50/971224550.db2.gz CKNPDFFIZXTCJB-ZIAGYGMSSA-N 2 0 234.387 2.282 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]C2CCC(F)(F)CC2)C12CCC2 ZINC000405264423 971229142 /nfs/dbraw/zinc/22/91/42/971229142.db2.gz QNPJUIUGMJPRAL-QWRGUYRKSA-N 2 0 244.329 2.424 20 0 BEADRP C[C@H](CCC1CC1)[NH2+][C@H]1C[C@H]([NH3+])C12CCC2 ZINC000405304459 971232942 /nfs/dbraw/zinc/23/29/42/971232942.db2.gz LKLNQCHGCXGVBU-WXHSDQCUSA-N 2 0 222.376 2.425 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+]Cc2ccsc2)C12CCC2 ZINC000405309861 971233025 /nfs/dbraw/zinc/23/30/25/971233025.db2.gz OEIQLEFKAFETQO-WDEREUQCSA-N 2 0 222.357 2.108 20 0 BEADRP Cc1cscc1C[NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405293351 971233703 /nfs/dbraw/zinc/23/37/03/971233703.db2.gz ZGLDRFBPNLVNME-VXGBXAGGSA-N 2 0 236.384 2.416 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+]CC2(C3CC3)CCC2)C12CCC2 ZINC000405329410 971235162 /nfs/dbraw/zinc/23/51/62/971235162.db2.gz VZBGTOAXUBXCLM-QWHCGFSZSA-N 2 0 234.387 2.426 20 0 BEADRP CCCCOCCC[NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405343262 971238666 /nfs/dbraw/zinc/23/86/66/971238666.db2.gz JKIQSLKVWSOCFZ-CHWSQXEVSA-N 2 0 240.391 2.053 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+][C@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405333929 971237067 /nfs/dbraw/zinc/23/70/67/971237067.db2.gz FQYSCPJTMCSBGK-XQHKEYJVSA-N 2 0 222.376 2.425 20 0 BEADRP CC1(C)CCC[C@@H]1[NH2+][C@H]1C[C@H]([NH3+])C12CCC2 ZINC000405355871 971243697 /nfs/dbraw/zinc/24/36/97/971243697.db2.gz QVSPKSDTPYLEKO-SRVKXCTJSA-N 2 0 222.376 2.425 20 0 BEADRP CC(C)C1(C[NH2+][C@H]2C[C@@H]([NH3+])C23CCC3)CC1 ZINC000405372909 971250306 /nfs/dbraw/zinc/25/03/06/971250306.db2.gz ZODRFVUZCXMXAF-NEPJUHHUSA-N 2 0 222.376 2.282 20 0 BEADRP CCC1(C[NH2+][C@@H]2C[C@H]([NH3+])C23CCC3)CC1 ZINC000405480228 971259786 /nfs/dbraw/zinc/25/97/86/971259786.db2.gz MXOHATGBQPPNCA-WDEREUQCSA-N 2 0 208.349 2.036 20 0 BEADRP CCCCCC[NH2+][C@@H]1C[C@H]([NH3+])C12CCC2 ZINC000405466711 971260858 /nfs/dbraw/zinc/26/08/58/971260858.db2.gz JZRVLCIALRDEJG-NWDGAFQWSA-N 2 0 210.365 2.426 20 0 BEADRP COc1cccc(C[NH2+][C@H]2C[C@@H]([NH3+])C23CCC3)c1 ZINC000405493504 971264230 /nfs/dbraw/zinc/26/42/30/971264230.db2.gz PNMCXMSLJNLLOC-KGLIPLIRSA-N 2 0 246.354 2.055 20 0 BEADRP CCC[C@H](CC)[NH2+][C@H]1C[C@H]([NH3+])C12CCC2 ZINC000405498824 971265539 /nfs/dbraw/zinc/26/55/39/971265539.db2.gz QOULLZXRAMDCMS-SRVKXCTJSA-N 2 0 210.365 2.425 20 0 BEADRP CC(C)(CC[N@@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1)C1CC1 ZINC000405937403 971320515 /nfs/dbraw/zinc/32/05/15/971320515.db2.gz BLQKJVZPKKNBTE-QWHCGFSZSA-N 2 0 236.403 2.354 20 0 BEADRP C[C@@H]1[C@H]2CC[N@@H+]1C[C@@H]([NH2+]C1CCCCC1)C2 ZINC001257452412 971373294 /nfs/dbraw/zinc/37/32/94/971373294.db2.gz UNHBDTGWZIEOPP-DYEKYZERSA-N 2 0 222.376 2.391 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1OCc1ccc(C[NH3+])cc1 ZINC001217783072 971402759 /nfs/dbraw/zinc/40/27/59/971402759.db2.gz UOTBQSZGAVSHOQ-DOMZBBRYSA-N 2 0 248.370 2.050 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1OCCCCCCC[NH3+] ZINC001217792151 971412188 /nfs/dbraw/zinc/41/21/88/971412188.db2.gz ZPEMJTZPDKSNFY-KBPBESRZSA-N 2 0 242.407 2.300 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]1OCCCCCCC[NH3+] ZINC001217878386 971470434 /nfs/dbraw/zinc/47/04/34/971470434.db2.gz JJXKGEDFFYQKOE-ZDUSSCGKSA-N 2 0 242.407 2.300 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]1OCCCCCCC[NH3+] ZINC001217878385 971471319 /nfs/dbraw/zinc/47/13/19/971471319.db2.gz JJXKGEDFFYQKOE-CYBMUJFWSA-N 2 0 242.407 2.300 20 0 BEADRP CC(C)([NH3+])C(C)(C)[NH2+]C1CCC2(COC2)CC1 ZINC001257901046 971532915 /nfs/dbraw/zinc/53/29/15/971532915.db2.gz USYOQDVSGMYLTJ-UHFFFAOYSA-N 2 0 240.391 2.051 20 0 BEADRP CC1(C)C[C@@H](OCCCCCCC[NH3+])CC[NH2+]1 ZINC001217938597 971539422 /nfs/dbraw/zinc/53/94/22/971539422.db2.gz QDSHJLGIWUKVDD-ZDUSSCGKSA-N 2 0 242.407 2.443 20 0 BEADRP C[C@H]([NH3+])c1ccc(O[C@H]2CCC[NH2+]C[C@H]2C)cc1 ZINC001217996155 971563730 /nfs/dbraw/zinc/56/37/30/971563730.db2.gz QPSOROSLPFKVLO-XUJVJEKNSA-N 2 0 248.370 2.473 20 0 BEADRP C[C@H]([NH3+])c1ccc(O[C@@H]2CC[NH2+]CC[C@@H]2C)cc1 ZINC001218034116 971577057 /nfs/dbraw/zinc/57/70/57/971577057.db2.gz LYWHCHQUBUNMGG-SLEUVZQESA-N 2 0 248.370 2.473 20 0 BEADRP [NH3+]Cc1ccccc1O[C@H]1CCC[C@@]12CC[NH2+]C2 ZINC001218089473 971598222 /nfs/dbraw/zinc/59/82/22/971598222.db2.gz FUHJXMLZRXIFQQ-GJZGRUSLSA-N 2 0 246.354 2.056 20 0 BEADRP N[C@@H]1CC[N@H+](C[C@@H]2CC=CCC2)CC[C@H]1F ZINC001206155566 974329762 /nfs/dbraw/zinc/32/97/62/974329762.db2.gz MGGVDBYUVHOCRS-JHJVBQTASA-N 2 0 226.339 2.104 20 0 BEADRP CC(C)[N@@H+]1CC[C@@H](Oc2cccc(C[NH3+])c2)C1 ZINC001218291949 971690631 /nfs/dbraw/zinc/69/06/31/971690631.db2.gz MKLXMRYFDARYQX-CQSZACIVSA-N 2 0 234.343 2.007 20 0 BEADRP [NH3+]Cc1ccc(O[C@@H]2CC[NH2+]C3(CCC3)C2)cc1 ZINC001218309348 971704697 /nfs/dbraw/zinc/70/46/97/971704697.db2.gz NZCYEGZXVDDHKP-CQSZACIVSA-N 2 0 246.354 2.199 20 0 BEADRP C[NH+]1CC2(C1)CC[NH+]([C@@H]1C[C@@H]3[C@H](C1)C3(C)C)CC2 ZINC001170764049 971747342 /nfs/dbraw/zinc/74/73/42/971747342.db2.gz GEPVVFNNXJKHQQ-ZSOGYDGISA-N 2 0 248.414 2.449 20 0 BEADRP C[NH+](C)C[C@@]12C[C@@H]1C[N@@H+]([C@@H]1C[C@@H]3[C@H](C1)C3(C)C)C2 ZINC001170765993 971755245 /nfs/dbraw/zinc/75/52/45/971755245.db2.gz ZZCDEERHDVUXFE-AQDIXCGQSA-N 2 0 248.414 2.305 20 0 BEADRP CC1(C)C[C@H](Oc2cccc(C[NH3+])c2)CC[NH2+]1 ZINC001218477761 971827494 /nfs/dbraw/zinc/82/74/94/971827494.db2.gz FULLXYXKSDAXDW-CYBMUJFWSA-N 2 0 234.343 2.055 20 0 BEADRP C[NH+](C)[C@H]1CC[C@@H]([NH2+][C@H]2CCCOCC2)CC1 ZINC001170801390 971846487 /nfs/dbraw/zinc/84/64/87/971846487.db2.gz SXPKMQDDOVQVJT-MELADBBJSA-N 2 0 240.391 2.018 20 0 BEADRP Cc1cc(N[C@H]2C[NH+]3CCC2CC3)cc(C)[nH+]1 ZINC000310201462 971956417 /nfs/dbraw/zinc/95/64/17/971956417.db2.gz BVEXNBSNDVEVDZ-AWEZNQCLSA-N 2 0 231.343 2.205 20 0 BEADRP [NH3+]C[C@@H]1CCCC[N@H+](CCOc2ccccc2)C1 ZINC000311211274 971995559 /nfs/dbraw/zinc/99/55/59/971995559.db2.gz LCQULTGPAAWBEZ-AWEZNQCLSA-N 2 0 248.370 2.126 20 0 BEADRP CC[C@]([NH3+])(CO)Nc1ccc2c[nH+]c(C)cc2c1 ZINC001170866206 971999422 /nfs/dbraw/zinc/99/94/22/971999422.db2.gz PILLXUINYLLKSX-CQSZACIVSA-N 2 0 245.326 2.012 20 0 BEADRP C[C@@H]([NH3+])CCNc1ccc([C@@H]2CCC[NH2+]2)cc1 ZINC001170890872 972043547 /nfs/dbraw/zinc/04/35/47/972043547.db2.gz JGHXTPJZOWROAG-RISCZKNCSA-N 2 0 233.359 2.260 20 0 BEADRP CC(C)c1ccccc1N[C@@H]([NH3+])CCC[NH3+] ZINC001170898027 972056030 /nfs/dbraw/zinc/05/60/30/972056030.db2.gz BCAFCAOHXCMTRB-CYBMUJFWSA-N 2 0 221.348 2.246 20 0 BEADRP CC[C@@H]1CC[C@@H]([NH2+]CC2([NH3+])CCCC2)C1 ZINC001246076652 972129683 /nfs/dbraw/zinc/12/96/83/972129683.db2.gz QVTDODDFJIPRHR-VXGBXAGGSA-N 2 0 210.365 2.426 20 0 BEADRP Cc1ccc(C[C@H](C)[NH2+]C2CC[NH2+]CC2)cc1 ZINC001246077810 972130844 /nfs/dbraw/zinc/13/08/44/972130844.db2.gz KQVPDZXEQIUERG-ZDUSSCGKSA-N 2 0 232.371 2.268 20 0 BEADRP Fc1ccc2c(c1)CC[C@H]([NH2+]C1CC[NH2+]CC1)C2 ZINC001246080235 972134299 /nfs/dbraw/zinc/13/42/99/972134299.db2.gz QMDWFDZSOAETEP-HNNXBMFYSA-N 2 0 248.345 2.025 20 0 BEADRP CC1(C)[C@@H]2C[C@@H]([NH2+][C@@H]3CCCC[NH2+]C3)C[C@@H]21 ZINC001246089282 972143647 /nfs/dbraw/zinc/14/36/47/972143647.db2.gz BXGYQIFFZOUUMM-LPWJVIDDSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]1CC[C@@H](C[NH2+][C@H]2C[C@@H]3[C@H](C2)C3(C)C)[NH2+]C1 ZINC001246102755 972167279 /nfs/dbraw/zinc/16/72/79/972167279.db2.gz FIBOXGMJDLBSFE-XHJNMGKDSA-N 2 0 236.403 2.399 20 0 BEADRP C[C@H]1[NH2+]CCC[C@@H]1C[NH2+]C1Cc2ccccc2C1 ZINC001246113147 972176799 /nfs/dbraw/zinc/17/67/99/972176799.db2.gz SJDUWSQLUOEJSM-IUODEOHRSA-N 2 0 244.382 2.132 20 0 BEADRP CC[C@H](C[C@@H](C)CC)[NH2+][C@@H]1C[NH2+]C[C@@H]1C ZINC001246113522 972177244 /nfs/dbraw/zinc/17/72/44/972177244.db2.gz BZPHTLXVGIGPLH-WUHRBBMRSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@H]1CC[C@H](C[NH2+]C2CCCCC2)[NH2+]C1 ZINC001246115090 972178177 /nfs/dbraw/zinc/17/81/77/972178177.db2.gz QUABTAXVDRDLMV-WCQYABFASA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]1C[C@H](n2ccc3c2cccc3C[NH3+])CC[NH2+]1 ZINC001246112166 972175519 /nfs/dbraw/zinc/17/55/19/972175519.db2.gz DCIUVSORTNRWRS-WCQYABFASA-N 2 0 243.354 2.413 20 0 BEADRP C[C@H]1C[NH2+]C[C@H]1[NH2+][C@@H]1C[C@@H](C)CC(C)(C)C1 ZINC001246116498 972180438 /nfs/dbraw/zinc/18/04/38/972180438.db2.gz MRTLBRBZQWCLME-YVECIDJPSA-N 2 0 224.392 2.399 20 0 BEADRP CC[C@H]1CC[C@@H]([NH2+][C@H]2CCCC[NH2+]C2)C1 ZINC001246118179 972182474 /nfs/dbraw/zinc/18/24/74/972182474.db2.gz XBIAOOOTDQHINY-XQQFMLRXSA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@H]1CC[C@H]([NH2+][C@H]2CCCC[NH2+]C2)C1 ZINC001246118178 972184018 /nfs/dbraw/zinc/18/40/18/972184018.db2.gz XBIAOOOTDQHINY-AVGNSLFASA-N 2 0 210.365 2.297 20 0 BEADRP CCCC[C@H](CC(C)C)[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001246148938 972194735 /nfs/dbraw/zinc/19/47/35/972194735.db2.gz OMKRWWJULFOSTE-MQYQWHSLSA-N 2 0 224.392 2.399 20 0 BEADRP CC[C@@H]1C[C@H]([NH2+][C@@H](C)c2cccc(N)c2)CC[NH2+]1 ZINC001246177995 972207562 /nfs/dbraw/zinc/20/75/62/972207562.db2.gz XLBRBSPIVDGALI-NILFDRSVSA-N 2 0 247.386 2.450 20 0 BEADRP C[C@H]1C[C@@H]([NH2+][C@H]2C[C@H]([NH3+])C2)CC(C)(C)C1 ZINC001246190707 972212970 /nfs/dbraw/zinc/21/29/70/972212970.db2.gz RRESNSRJXWDVKA-FIQHERPVSA-N 2 0 210.365 2.281 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C[C@H]2CCC[NH2+]C2)C[C@@H]1C ZINC001246215972 972218504 /nfs/dbraw/zinc/21/85/04/972218504.db2.gz ACNARBXHXSZUKL-ZOBORPQBSA-N 2 0 224.392 2.400 20 0 BEADRP CC1C[C@H]2CC[C@@H](C1)[N@H+]2CCC[NH2+]C1CC1 ZINC000692939552 956881976 /nfs/dbraw/zinc/88/19/76/956881976.db2.gz IKIBMXKFETUPPF-QXMXGUDHSA-N 2 0 222.376 2.391 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH+]2CCC3(CC3)CC2)C1 ZINC001208605996 957092970 /nfs/dbraw/zinc/09/29/70/957092970.db2.gz CVIXUUSBXIUBTH-ZDUSSCGKSA-N 2 0 222.376 2.204 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH+]2CCC(CF)CC2)C1 ZINC001208612291 957101717 /nfs/dbraw/zinc/10/17/17/957101717.db2.gz MEUNVUVOUOVVNO-ZDUSSCGKSA-N 2 0 228.355 2.010 20 0 BEADRP Cc1ccc2[nH+]c(N)n(C3=CC[N@H+](C)CC3)c2c1 ZINC001208719565 957136686 /nfs/dbraw/zinc/13/66/86/957136686.db2.gz SGYHZGQHEARBDM-UHFFFAOYSA-N 2 0 242.326 2.103 20 0 BEADRP C[NH+](C)Cc1ccc(NC2=CC[N@H+](C)CC2)cc1 ZINC001208836725 957175481 /nfs/dbraw/zinc/17/54/81/957175481.db2.gz AFSUPJRNITXMTR-UHFFFAOYSA-N 2 0 245.370 2.380 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH+]2CCC(C3CCC3)CC2)C1 ZINC000692972029 957175872 /nfs/dbraw/zinc/17/58/72/957175872.db2.gz RDRPOVRRFGDBLK-VDISTLRHSA-N 2 0 222.376 2.236 20 0 BEADRP CC[C@@H]1CC[C@H]([NH2+][C@H]2CCC[C@H]([NH3+])C2)C1 ZINC000414927731 972250542 /nfs/dbraw/zinc/25/05/42/972250542.db2.gz PISDPAXZQOFEBA-VOAKCMCISA-N 2 0 210.365 2.425 20 0 BEADRP C[C@@H]1CCCC[N@@H+](C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000705581196 957354297 /nfs/dbraw/zinc/35/42/97/957354297.db2.gz HREXQXQPOKDGKM-HABKJSAYSA-N 2 0 222.376 2.391 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@H]1Cc2cccc(Cl)c2C1 ZINC001246307361 972269644 /nfs/dbraw/zinc/26/96/44/972269644.db2.gz XCDPETCFYIUASD-ONGXEEELSA-N 2 0 238.762 2.134 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@H]1CCc2c(F)cccc2C1 ZINC001246311422 972272215 /nfs/dbraw/zinc/27/22/15/972272215.db2.gz CLTFSTUHWMKUOE-RYUDHWBXSA-N 2 0 236.334 2.010 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@@H]1CCc2cc(F)ccc2C1 ZINC001246313816 972274699 /nfs/dbraw/zinc/27/46/99/972274699.db2.gz LNXWBDBAUSOIIT-ZIAGYGMSSA-N 2 0 236.334 2.010 20 0 BEADRP C[N@@H+]1CC[C@H](Nc2ccc([C@H]3CCC[NH2+]3)cc2)C1 ZINC001167278820 957626979 /nfs/dbraw/zinc/62/69/79/957626979.db2.gz TYMGJEJLHYVWRC-LSDHHAIUSA-N 2 0 245.370 2.227 20 0 BEADRP C[C@H](CC(F)(F)F)[NH2+]C[C@@H]1CC[C@@H](C)[NH2+]C1 ZINC000397530377 957681864 /nfs/dbraw/zinc/68/18/64/957681864.db2.gz YGMIKZRYSUENLA-OPRDCNLKSA-N 2 0 238.297 2.305 20 0 BEADRP Cc1ccc(CC[C@@H](C)[NH2+][C@@H]2CC23C[NH2+]C3)cc1 ZINC001246445171 972312071 /nfs/dbraw/zinc/31/20/71/972312071.db2.gz NEPOVSUAVOJIFP-UKRRQHHQSA-N 2 0 244.382 2.268 20 0 BEADRP C[C@@H](CC(F)(F)F)[NH2+]C[C@@H]1C[NH2+]C[C@@H](C)C1 ZINC000398645023 958340863 /nfs/dbraw/zinc/34/08/63/958340863.db2.gz BVOLTLWMYWIHCP-GUBZILKMSA-N 2 0 238.297 2.163 20 0 BEADRP C[NH2+][C@H]1C[C@@H]([NH2+][C@H]2CCc3ccc(C)cc3C2)C1 ZINC001246493517 972354118 /nfs/dbraw/zinc/35/41/18/972354118.db2.gz BYRFDXKJAYGSAP-HRCADAONSA-N 2 0 244.382 2.192 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)S3)C1 ZINC000403674971 958787448 /nfs/dbraw/zinc/78/74/48/958787448.db2.gz PTVHJVIJVCTUQU-PBYDBYKOSA-N 2 0 240.416 2.273 20 0 BEADRP [NH3+]CCCC[NH2+]Cc1ccc2c(c1)CCC2 ZINC000259002107 958793813 /nfs/dbraw/zinc/79/38/13/958793813.db2.gz WWMSRMMECLTOPZ-UHFFFAOYSA-N 2 0 218.344 2.004 20 0 BEADRP C[C@@H]1C[C@H](C)[C@H](C)[N@H+](C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000693578904 958868151 /nfs/dbraw/zinc/86/81/51/958868151.db2.gz LMQQTJVSBOSEJB-SJHCENCUSA-N 2 0 210.365 2.090 20 0 BEADRP Cc1cccc(C[N@H+](C)C[C@H]2C[C@@H]([NH3+])C2)c1 ZINC000693592269 958902822 /nfs/dbraw/zinc/90/28/22/958902822.db2.gz PKPQNKMCKCYDML-OKILXGFUSA-N 2 0 218.344 2.164 20 0 BEADRP Cc1nc(C)c([C@@H](C)[NH2+]C[C@H]2C[C@H]([NH3+])C2)s1 ZINC000693601149 958927424 /nfs/dbraw/zinc/92/74/24/958927424.db2.gz DIUBRACRGFBOBI-AVPPRXQKSA-N 2 0 239.388 2.148 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]C[C@]12C[C@H]1CCCC2 ZINC000693598761 958930697 /nfs/dbraw/zinc/93/06/97/958930697.db2.gz JVLWXUKLZIHFEL-CRWXNKLISA-N 2 0 222.376 2.284 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]C[C@@]12C[C@@H]1CCCC2 ZINC000693598765 958931282 /nfs/dbraw/zinc/93/12/82/958931282.db2.gz JVLWXUKLZIHFEL-XDQVBPFNSA-N 2 0 222.376 2.284 20 0 BEADRP [NH3+]Cc1cccn1-c1ccc([C@H]2CCC[NH2+]2)cc1 ZINC001167593265 958989651 /nfs/dbraw/zinc/98/96/51/958989651.db2.gz OIGORKZRIUMGLD-OAHLLOKOSA-N 2 0 241.338 2.361 20 0 BEADRP C[C@@]1([NH3+])CCN([C@@H]2CSc3ccccc3C2)C1 ZINC001246526824 972399746 /nfs/dbraw/zinc/39/97/46/972399746.db2.gz BUTATDPEAJJRNS-GXTWGEPZSA-N 2 0 248.395 2.127 20 0 BEADRP CC1(C[NH2+][C@H]2C[C@H]([NH3+])C23CCC3)CCCC1 ZINC000405355450 959445252 /nfs/dbraw/zinc/44/52/52/959445252.db2.gz QPTHUUZGNDDXMB-RYUDHWBXSA-N 2 0 222.376 2.426 20 0 BEADRP CC(C)C[C@@H](C)C[N@@H+]1CC[C@@H](CC[NH3+])C1 ZINC000300993769 959489728 /nfs/dbraw/zinc/48/97/28/959489728.db2.gz WAEHFIHHWDFJQL-CHWSQXEVSA-N 2 0 212.381 2.339 20 0 BEADRP CC(C)(CC[N@@H+]1CCC[C@@H](C[NH3+])C1)C1CC1 ZINC000406084224 959573479 /nfs/dbraw/zinc/57/34/79/959573479.db2.gz YXGIHURWKCSKJD-LBPRGKRZSA-N 2 0 224.392 2.483 20 0 BEADRP CCOc1ccc(NC(=[NH2+])SCC[NH3+])cc1 ZINC001167913282 959605724 /nfs/dbraw/zinc/60/57/24/959605724.db2.gz KLSSBJLIRISVGV-UHFFFAOYSA-N 2 0 239.344 2.124 20 0 BEADRP [NH3+]CCCCCCCO[C@@H]1CC[C@@]12CC[NH2+]C2 ZINC001217808560 959619222 /nfs/dbraw/zinc/61/92/22/959619222.db2.gz MTEWFGIUHZCCRT-KGLIPLIRSA-N 2 0 240.391 2.054 20 0 BEADRP CC1=C[C@@H](C)[C@@H](C[NH+]2CC3(C2)CC[NH2+]C3)CC1 ZINC001222379693 972449713 /nfs/dbraw/zinc/44/97/13/972449713.db2.gz IKIFXQLGKVSDDW-ZIAGYGMSSA-N 2 0 234.387 2.274 20 0 BEADRP C[C@@H]1C[C@@H](Oc2ccc([C@@H]3C[C@H]3[NH3+])cc2)CC[NH2+]1 ZINC001218054251 959848289 /nfs/dbraw/zinc/84/82/89/959848289.db2.gz YGSGVZJLOCJJIC-SDJAHQOYSA-N 2 0 246.354 2.021 20 0 BEADRP C[C@H]1C[N@@H+](C2CCC(C)CC2)C[C@H]1C[NH3+] ZINC000708830770 959860316 /nfs/dbraw/zinc/86/03/16/959860316.db2.gz PDHAMIXOBSSTDT-CMOBGSAGSA-N 2 0 210.365 2.092 20 0 BEADRP C[C@H]([NH3+])c1ccc(O[C@@H]2CC[C@@H](C)[NH2+]C2)cc1 ZINC001218408100 960064457 /nfs/dbraw/zinc/06/44/57/960064457.db2.gz PWLQNVDOVKYWSM-UHIISALHSA-N 2 0 234.343 2.226 20 0 BEADRP Fc1ccc2c(c1)C[N@@H+](CC1CC[NH2+]CC1)C2 ZINC001207438039 960094491 /nfs/dbraw/zinc/09/44/91/960094491.db2.gz RYRFQHJGYGLBDV-UHFFFAOYSA-N 2 0 234.318 2.141 20 0 BEADRP C[NH2+]CCNc1ccc2c(c1)C(C(C)C)=[NH+]CC2 ZINC001167726171 960245354 /nfs/dbraw/zinc/24/53/54/960245354.db2.gz UXUKWTADWVXIET-UHFFFAOYSA-N 2 0 245.370 2.319 20 0 BEADRP C[C@H]([NH2+][C@H]1CCCC2(CC2)C1)[C@@H]1CCC[NH2+]1 ZINC000695725395 960404435 /nfs/dbraw/zinc/40/44/35/960404435.db2.gz WWEKUBFVAFTXGF-AVGNSLFASA-N 2 0 222.376 2.439 20 0 BEADRP C1CC12CCC([NH2+][C@H]1[C@@H]3[NH2+]C[C@@H]4C[C@H]1C[C@@H]43)CC2 ZINC000695766824 960444875 /nfs/dbraw/zinc/44/48/75/960444875.db2.gz CWWZODHHJOFCCG-XSXPHNMFSA-N 2 0 246.398 2.295 20 0 BEADRP C[C@@H]([NH2+]CCCC[NH3+])c1ccc2c(c1)CCO2 ZINC000037715531 960612589 /nfs/dbraw/zinc/61/25/89/960612589.db2.gz FYXQCSJHQYXHOQ-LLVKDONJSA-N 2 0 234.343 2.011 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH2+][C@H]2CC3CCC2CC3)C1 ZINC000310169255 961164223 /nfs/dbraw/zinc/16/42/23/961164223.db2.gz OZIRMGBPYVHIBX-SHWKFHJASA-N 2 0 236.403 2.497 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CC[C@@H]1COC ZINC001167834916 961207801 /nfs/dbraw/zinc/20/78/01/961207801.db2.gz NTYNWZGZUFOKQM-ZIAGYGMSSA-N 2 0 242.407 2.218 20 0 BEADRP Cl/C=C\C[NH+]1CCC([C@@H]2CCC[NH2+]C2)CC1 ZINC000692915153 961321840 /nfs/dbraw/zinc/32/18/40/961321840.db2.gz LSKNFKZVXNRRAH-IUAZIXFQSA-N 2 0 242.794 2.451 20 0 BEADRP C[NH+](C)CCCCC[NH2+][C@@H]1C[C@H]2C[C@H]2C1 ZINC001167894613 961515040 /nfs/dbraw/zinc/51/50/40/961515040.db2.gz PQMNGABRXCAZSA-CLLJXQQHSA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@H](C)CC[NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2 ZINC000696217401 961873816 /nfs/dbraw/zinc/87/38/16/961873816.db2.gz NVIGNSDHUUJLGU-VZKILSJISA-N 2 0 222.376 2.009 20 0 BEADRP C[N@H+](C[C@H]1CC2CCC1CC2)C1CC[NH2+]CC1 ZINC000400024144 962185409 /nfs/dbraw/zinc/18/54/09/962185409.db2.gz SVFKMIOTJKXNJW-JXQTWKCFSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@]1([NH3+])CC[N@@H+](C2CCC3(CC3)CC2)C1 ZINC000710149198 962334778 /nfs/dbraw/zinc/33/47/78/962334778.db2.gz IUMGUHNRHCBXIM-GFCCVEGCSA-N 2 0 208.349 2.132 20 0 BEADRP C[C@@H]1CC[NH2+]C[C@H]1C[NH2+][C@H]1CCC(C)(C)C1 ZINC000710684563 962441986 /nfs/dbraw/zinc/44/19/86/962441986.db2.gz GPJWPNAURAZYRM-AGIUHOORSA-N 2 0 224.392 2.400 20 0 BEADRP C1C[C@H]2CC([N@H+]3C[C@@H]4CCCC[C@@H]4C3)C[C@@H]1[NH2+]2 ZINC000710749517 962460624 /nfs/dbraw/zinc/46/06/24/962460624.db2.gz RRUCPMGSFQACKQ-RRIFHVCJSA-N 2 0 234.387 2.391 20 0 BEADRP Cc1c[nH+]c(N[C@@H]2CCC[C@@H]([NH3+])C2)cc1C ZINC001154987727 962934266 /nfs/dbraw/zinc/93/42/66/962934266.db2.gz NBSALJLBFSGDHO-VXGBXAGGSA-N 2 0 219.332 2.380 20 0 BEADRP c1cc2c[nH+]c(N[C@@]34CCC[C@@H]3[NH2+]CC4)cc2[nH]1 ZINC001155402993 963065930 /nfs/dbraw/zinc/06/59/30/963065930.db2.gz ZRYNCJFKMZLXGJ-GXTWGEPZSA-N 2 0 242.326 2.259 20 0 BEADRP CC1C[NH+](C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)C1 ZINC001167985086 963093596 /nfs/dbraw/zinc/09/35/96/963093596.db2.gz VCYZDMFNWOKODE-YIONKMFJSA-N 2 0 234.387 2.344 20 0 BEADRP C[C@H]1CC[C@H]([N@H+](C)CC2CC[NH+](C)CC2)C1 ZINC000093088599 963292524 /nfs/dbraw/zinc/29/25/24/963292524.db2.gz OYJNFIGVDDRGHY-JSGCOSHPSA-N 2 0 224.392 2.449 20 0 BEADRP C([C@@H]1CCCC[NH2+]C1)[N@@H+]1CCC2(CCC2)C1 ZINC000697017446 963639931 /nfs/dbraw/zinc/63/99/31/963639931.db2.gz SBLSYDYOBBEOED-CYBMUJFWSA-N 2 0 222.376 2.252 20 0 BEADRP CC(C)[NH+]1CC(Nc2[nH+]ccc3c2ccn3C)C1 ZINC001157526359 963644122 /nfs/dbraw/zinc/64/41/22/963644122.db2.gz RQAXUCVABJVKNU-UHFFFAOYSA-N 2 0 244.342 2.078 20 0 BEADRP CC(C)[NH+]1CC(Nc2cc3[nH]ccc3c[nH+]2)C1 ZINC001157525619 963644414 /nfs/dbraw/zinc/64/44/14/963644414.db2.gz GGNVFOULGZPVAO-UHFFFAOYSA-N 2 0 230.315 2.067 20 0 BEADRP CCCC[N@H+](CC)C[C@H]1CCCC[NH2+]C1 ZINC000697049719 963681435 /nfs/dbraw/zinc/68/14/35/963681435.db2.gz BPRXVDFHPGJABU-ZDUSSCGKSA-N 2 0 212.381 2.498 20 0 BEADRP C[C@H]1C[C@@H]([NH2+][C@H]2CC[C@H]([NH+](C)C)CC2)CCO1 ZINC001168091938 963688533 /nfs/dbraw/zinc/68/85/33/963688533.db2.gz CRQOQLCAKZPSIV-XUXIUFHCSA-N 2 0 240.391 2.016 20 0 BEADRP Cc1[nH+]c(N2CCC[C@H]([NH3+])[C@H]2C)cc2[nH]ccc21 ZINC001157746118 963715764 /nfs/dbraw/zinc/71/57/64/963715764.db2.gz PYFJFWAXSOWCOT-PWSUYJOCSA-N 2 0 244.342 2.187 20 0 BEADRP Cc1[nH+]c(N2CCC[C@@H]([NH3+])[C@H]2C)cc2[nH]ccc21 ZINC001157746121 963716909 /nfs/dbraw/zinc/71/69/09/963716909.db2.gz PYFJFWAXSOWCOT-ZYHUDNBSSA-N 2 0 244.342 2.187 20 0 BEADRP CCN(c1cc2[nH]ccc2c[nH+]1)[C@H]1CCC[NH2+]C1 ZINC001158201082 963830507 /nfs/dbraw/zinc/83/05/07/963830507.db2.gz SRXOSSOLHXEAEL-LBPRGKRZSA-N 2 0 244.342 2.141 20 0 BEADRP Cc1c[nH+]c(N2CCC[C@@](C)(C[NH3+])C2)cc1C ZINC001158684771 963902412 /nfs/dbraw/zinc/90/24/12/963902412.db2.gz TUTAIIKPGIUNKP-AWEZNQCLSA-N 2 0 233.359 2.264 20 0 BEADRP Cc1c[nH+]c(NC(C)(C)CC[NH+](C)C)cc1N ZINC001158760901 963916141 /nfs/dbraw/zinc/91/61/41/963916141.db2.gz RKIITIFUOFIGMZ-UHFFFAOYSA-N 2 0 236.363 2.114 20 0 BEADRP Cc1ccc(C)c(NC2(C)CC[NH2+]CC2)[nH+]1 ZINC001168182672 963934742 /nfs/dbraw/zinc/93/47/42/963934742.db2.gz WSPJUIUELNYRCN-UHFFFAOYSA-N 2 0 219.332 2.252 20 0 BEADRP CC(C)([NH3+])c1ccccc1NC1(C)CC[NH2+]CC1 ZINC001168187759 963945640 /nfs/dbraw/zinc/94/56/40/963945640.db2.gz FYMKEFDYIHBBBD-UHFFFAOYSA-N 2 0 247.386 2.434 20 0 BEADRP CCc1cc(Nc2ccc3c(c2)C[NH2+]C3)cc[nH+]1 ZINC001159296379 964060228 /nfs/dbraw/zinc/06/02/28/964060228.db2.gz JZRUMFNVXGKNJL-UHFFFAOYSA-N 2 0 239.322 2.413 20 0 BEADRP [NH3+]CCc1cccc(NC=CC2CC[NH2+]CC2)c1 ZINC001159672225 964146318 /nfs/dbraw/zinc/14/63/18/964146318.db2.gz RWLRTHCCDNOGNP-YRNVUSSQSA-N 2 0 245.370 2.113 20 0 BEADRP Cn1ccc2c1cc[nH+]c2NC[C@H]1CCCC[NH2+]1 ZINC001160144528 964256522 /nfs/dbraw/zinc/25/65/22/964256522.db2.gz GEUZSSHLYYXNJT-LLVKDONJSA-N 2 0 244.342 2.127 20 0 BEADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H](Nc1cc(N)cc[nH+]1)C2 ZINC001160466061 964308085 /nfs/dbraw/zinc/30/80/85/964308085.db2.gz PNEMCDJIRVBCFU-XYYAHUGASA-N 2 0 246.358 2.091 20 0 BEADRP CC[N@H+](C1CC1)C1CCC([NH+](C)C)CC1 ZINC001168314315 964421489 /nfs/dbraw/zinc/42/14/89/964421489.db2.gz DJNAPNGZFSWBOD-UHFFFAOYSA-N 2 0 210.365 2.344 20 0 BEADRP C[NH+](C)C1CCC([N@@H+]2CCC[C@@H](F)C2)CC1 ZINC001168323442 964446700 /nfs/dbraw/zinc/44/67/00/964446700.db2.gz ZLKRKGWWZFDZFF-PNESKVBLSA-N 2 0 228.355 2.293 20 0 BEADRP C[N@@H+]1CCC[C@@H]1CCNc1cc2[nH]ccc2c[nH+]1 ZINC001160966533 964460009 /nfs/dbraw/zinc/46/00/09/964460009.db2.gz NFJWHMZEGWTRNK-GFCCVEGCSA-N 2 0 244.342 2.459 20 0 BEADRP C(C1CC1)[NH+]1CCC([NH2+]C23CC(C2)C3)CC1 ZINC001168353724 964493038 /nfs/dbraw/zinc/49/30/38/964493038.db2.gz RJRAPVHDRMAGRK-UHFFFAOYSA-N 2 0 220.360 2.003 20 0 BEADRP C[C@H](C[NH2+][C@@H]1C[C@H]([NH3+])C12CCC2)CC(F)F ZINC000697705838 964504843 /nfs/dbraw/zinc/50/48/43/964504843.db2.gz DCXNBXSLJVUXRW-LPEHRKFASA-N 2 0 232.318 2.137 20 0 BEADRP COC1(C[NH2+]CC[C@H](C)[NH+](C)C)CCCCC1 ZINC000697825877 964548888 /nfs/dbraw/zinc/54/88/88/964548888.db2.gz HJWYZVGLOACTSM-ZDUSSCGKSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@@H](CC[NH2+][C@@H]1CCc2ccccc2C1)[NH+](C)C ZINC000697858924 964575363 /nfs/dbraw/zinc/57/53/63/964575363.db2.gz PENDIEZLDOQNAH-XJKSGUPXSA-N 2 0 246.398 2.474 20 0 BEADRP C[C@@H](CC[NH2+][C@H]1CCC(C)(C)C1)[NH+](C)C ZINC000697879259 964603995 /nfs/dbraw/zinc/60/39/95/964603995.db2.gz NEGORBXNZKGEKB-RYUDHWBXSA-N 2 0 212.381 2.495 20 0 BEADRP C(C1CC1)[NH+]1CCC([NH2+][C@H]2C[C@H]2C2CC2)CC1 ZINC001168370743 964926242 /nfs/dbraw/zinc/92/62/42/964926242.db2.gz GCAHIJUXBHSNST-GJZGRUSLSA-N 2 0 234.387 2.249 20 0 BEADRP CCc1cccc(N[C@@H]2CCC[C@@H]([NH3+])C2)n1 ZINC001162401571 964960257 /nfs/dbraw/zinc/96/02/57/964960257.db2.gz LHQUZCDXSJRTCJ-ZYHUDNBSSA-N 2 0 219.332 2.326 20 0 BEADRP [NH3+][C@H]1CCC[C@H](Nc2cccc3c2C[NH2+]CC3)C1 ZINC001162402584 964963186 /nfs/dbraw/zinc/96/31/86/964963186.db2.gz UISXVVYIUVWMOI-STQMWFEESA-N 2 0 245.370 2.014 20 0 BEADRP Cc1c(N)cc[nH+]c1NC[C@H]1CCC[NH2+]C[C@H]1C ZINC001162454448 964983750 /nfs/dbraw/zinc/98/37/50/964983750.db2.gz OJGIUIPLXKGIGP-ZYHUDNBSSA-N 2 0 248.374 2.020 20 0 BEADRP Cc1c(N)cc[nH+]c1NC[C@@H]1CCC[NH2+]C[C@@H]1C ZINC001162454444 964985227 /nfs/dbraw/zinc/98/52/27/964985227.db2.gz OJGIUIPLXKGIGP-JQWIXIFHSA-N 2 0 248.374 2.020 20 0 BEADRP Cc1ccc(NC[C@H]2CCC[NH2+]C[C@@H]2C)[nH+]c1N ZINC001162460217 964987244 /nfs/dbraw/zinc/98/72/44/964987244.db2.gz HYGSQTWBFWOCNS-NWDGAFQWSA-N 2 0 248.374 2.020 20 0 BEADRP C[NH2+]C[C@H]1CC[N@@H+]([C@H]2CCc3c2cccc3F)C1 ZINC000250730855 965044841 /nfs/dbraw/zinc/04/48/41/965044841.db2.gz KLKVZEBDSNWECR-ABAIWWIYSA-N 2 0 248.345 2.354 20 0 BEADRP Cc1ccc(NC[C@@]2(F)CCCC[NH2+]C2)nc1 ZINC001162572598 965053511 /nfs/dbraw/zinc/05/35/11/965053511.db2.gz HKBFNGPDCUADBV-CYBMUJFWSA-N 2 0 237.322 2.284 20 0 BEADRP Cc1c[nH+]c(NC[C@@H]2CC[NH2+]C[C@@H]2F)cc1C ZINC001162808598 965194254 /nfs/dbraw/zinc/19/42/54/965194254.db2.gz NCJKZMURBWOJJY-RYUDHWBXSA-N 2 0 237.322 2.058 20 0 BEADRP [NH3+]CC1CC([NH2+]C[C@@H]2CCc3ccccc32)C1 ZINC001120370973 965280989 /nfs/dbraw/zinc/28/09/89/965280989.db2.gz LLTZQYWRCRXPRC-QRMWWUJWSA-N 2 0 230.355 2.043 20 0 BEADRP Cc1[nH+]c(N(C)CCC[NH+](C)C)cc2[nH]ccc21 ZINC001163597701 965472675 /nfs/dbraw/zinc/47/26/75/965472675.db2.gz HXHZVQGYXYOBTP-UHFFFAOYSA-N 2 0 246.358 2.259 20 0 BEADRP Cc1[nH]c2ccc(N[C@@H](C)C[NH+](C)C)cc2[nH+]1 ZINC001163776748 965583596 /nfs/dbraw/zinc/58/35/96/965583596.db2.gz JRADZDFQIMFAOG-VIFPVBQESA-N 2 0 232.331 2.233 20 0 BEADRP C/C(=C\C=C\N)[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC001163994117 965681812 /nfs/dbraw/zinc/68/18/12/965681812.db2.gz DSMDRXOFKXNWKK-PMHYKQBESA-N 2 0 245.370 2.214 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@H]([NH3+])CC2)cc1F ZINC001205093655 965720784 /nfs/dbraw/zinc/72/07/84/965720784.db2.gz DFXQJSFNIMEMMD-ZDUSSCGKSA-N 2 0 236.334 2.447 20 0 BEADRP [NH3+][C@@H]1CCC[N@H+](CC2Cc3ccccc3C2)CC1 ZINC001205095529 965757436 /nfs/dbraw/zinc/75/74/36/965757436.db2.gz YKTWABWPSPPGJD-MRXNPFEDSA-N 2 0 244.382 2.215 20 0 BEADRP C[C@@H]1CC[N@H+](CC2C[C@H]3CC[C@@H](C2)[NH2+]3)C[C@H]1C ZINC000699202789 965803457 /nfs/dbraw/zinc/80/34/57/965803457.db2.gz DTZZHSWJOMJVIT-MLQJFRMTSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@H]1CC[N@H+](CC2C[C@H]3CC[C@@H](C2)[NH2+]3)C[C@H]1C ZINC000699202785 965804750 /nfs/dbraw/zinc/80/47/50/965804750.db2.gz DTZZHSWJOMJVIT-FIBILERRSA-N 2 0 236.403 2.495 20 0 BEADRP [NH3+]CCCCCCC[N@@H+]1CC[C@H]2C[C@H]2C1 ZINC000699248614 965823590 /nfs/dbraw/zinc/82/35/90/965823590.db2.gz XGGILGIBRIIKFI-STQMWFEESA-N 2 0 210.365 2.237 20 0 BEADRP C[N@@H+](Cc1ccncc1)CC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000699261438 965823841 /nfs/dbraw/zinc/82/38/41/965823841.db2.gz RSNBRLXEXTWANM-GOOCMWNKSA-N 2 0 245.370 2.044 20 0 BEADRP Cc1cc(F)cc(C[N@@H+]2CCC[C@@H]([NH3+])CC2)c1 ZINC001205110585 965833494 /nfs/dbraw/zinc/83/34/94/965833494.db2.gz WHRYYKJMUWUOMX-CQSZACIVSA-N 2 0 236.334 2.447 20 0 BEADRP Cc1c(O)cccc1C[N@@H+]1CCC[C@H]([NH3+])CC1 ZINC001205110104 965834141 /nfs/dbraw/zinc/83/41/41/965834141.db2.gz OQZLQGSGZLJMDT-ZDUSSCGKSA-N 2 0 234.343 2.014 20 0 BEADRP C([NH2+][C@@]12C[C@@H]1CCCC2)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000699294667 965834371 /nfs/dbraw/zinc/83/43/71/965834371.db2.gz VQMOHUQJFUBBMJ-OEWLLCOZSA-N 2 0 234.387 2.439 20 0 BEADRP CC[N@H+](CC1C[C@H]2CC[C@@H](C1)[NH2+]2)C(C)C ZINC000699305046 965842035 /nfs/dbraw/zinc/84/20/35/965842035.db2.gz LCHRCXBRLBCECV-YHWZYXNKSA-N 2 0 210.365 2.247 20 0 BEADRP COC1(C[NH2+][C@H]2CCC[C@@H]([NH+](C)C)C2)CCC1 ZINC000715202147 965948789 /nfs/dbraw/zinc/94/87/89/965948789.db2.gz NKDDMZPTKKPWIG-QWHCGFSZSA-N 2 0 240.391 2.018 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCCC[C@]12CC[NH2+]C2 ZINC001235123359 966008467 /nfs/dbraw/zinc/00/84/67/966008467.db2.gz JIRJCLONQSZDNO-QWHCGFSZSA-N 2 0 210.365 2.251 20 0 BEADRP Cc1ccc([C@H](C)CCN(C)C[C@H](C)[NH3+])o1 ZINC001236885974 966611704 /nfs/dbraw/zinc/61/17/04/966611704.db2.gz YQAJHPZGWCGAMF-MNOVXSKESA-N 2 0 224.348 2.361 20 0 BEADRP CC[NH+]1C[C@@H]2C[NH+](Cc3cccc(C)c3)C[C@H]2C1 ZINC001203893542 966812692 /nfs/dbraw/zinc/81/26/92/966812692.db2.gz KKIBSMRFIBVLPR-HZPDHXFCSA-N 2 0 244.382 2.379 20 0 BEADRP CC(C)[C@@H]1CCC[N@@H+]1CC[C@@H]1CCC[NH2+]C1 ZINC000084126118 966926576 /nfs/dbraw/zinc/92/65/76/966926576.db2.gz XDVGEVPANYXWQM-KBPBESRZSA-N 2 0 224.392 2.497 20 0 BEADRP CCc1ccc(C[NH+]2CCC3(C[NH+](C)C3)CC2)o1 ZINC001204394303 966991924 /nfs/dbraw/zinc/99/19/24/966991924.db2.gz AOPZRVYZVWBJAS-UHFFFAOYSA-N 2 0 248.370 2.370 20 0 BEADRP C[NH+](C)Cc1ccc(-c2cccc(C[NH3+])n2)cc1 ZINC001204612966 967105378 /nfs/dbraw/zinc/10/53/78/967105378.db2.gz AKZJZBJWWZCJFM-UHFFFAOYSA-N 2 0 241.338 2.269 20 0 BEADRP CCCC[C@H](CC)C[N@@H+]1CCO[C@@H](CC[NH3+])C1 ZINC001204748750 967146243 /nfs/dbraw/zinc/14/62/43/967146243.db2.gz SYTXQQLRBHCOHR-KBPBESRZSA-N 2 0 242.407 2.252 20 0 BEADRP Cc1[nH+]c(-c2cncc(C[NH3+])c2)cc2[nH]ccc21 ZINC001239791204 967186353 /nfs/dbraw/zinc/18/63/53/967186353.db2.gz BKDNGWJFGSSWHB-UHFFFAOYSA-N 2 0 238.294 2.392 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H]([NH+](C)C)C2)CCO1 ZINC000715583354 967194396 /nfs/dbraw/zinc/19/43/96/967194396.db2.gz JWTVQZNMMYOURA-AAVRWANBSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@H]([NH3+])c1ccccc1-c1cncc(C[NH3+])c1 ZINC001239804413 967201180 /nfs/dbraw/zinc/20/11/80/967201180.db2.gz QEYZPCVKNDAEGA-JTQLQIEISA-N 2 0 227.311 2.227 20 0 BEADRP [NH3+]CC1CC[NH+](CC2Cc3ccccc3C2)CC1 ZINC001205025661 967293755 /nfs/dbraw/zinc/29/37/55/967293755.db2.gz BELKIWGUEOFIPD-UHFFFAOYSA-N 2 0 244.382 2.072 20 0 BEADRP Cc1cc(C[N@@H+]2CCC[C@@H]([NH3+])CC2)ccc1F ZINC001205093860 967339553 /nfs/dbraw/zinc/33/95/53/967339553.db2.gz GUURFZQXXYBLRR-CYBMUJFWSA-N 2 0 236.334 2.447 20 0 BEADRP COC1CCC(C[N@@H+]2CCC[C@@H]([NH3+])CC2)CC1 ZINC001205094593 967342132 /nfs/dbraw/zinc/34/21/32/967342132.db2.gz NDSOXTXOJHCDRO-ROKHWSDSSA-N 2 0 240.391 2.005 20 0 BEADRP [NH3+][C@H]1CCC[N@H+](Cc2ccc3ncoc3c2)CC1 ZINC001205117772 967362520 /nfs/dbraw/zinc/36/25/20/967362520.db2.gz UVXCOCGRXCHBDG-LBPRGKRZSA-N 2 0 245.326 2.141 20 0 BEADRP Cc1cc(O)cc(C[N@@H+]2CCC[C@H]([NH3+])CC2)c1 ZINC001205117948 967370464 /nfs/dbraw/zinc/37/04/64/967370464.db2.gz ZKZIMLVLYJDBFY-ZDUSSCGKSA-N 2 0 234.343 2.014 20 0 BEADRP Cc1cccc(F)c1C[N@H+]1C[C@H](C)[C@H](C[NH3+])C1 ZINC001205146194 967386633 /nfs/dbraw/zinc/38/66/33/967386633.db2.gz SDXSBERVAIXASS-NWDGAFQWSA-N 2 0 236.334 2.161 20 0 BEADRP C[NH+](C)CCCc1cccc(C[NH+](C)C)c1 ZINC001250160755 967453401 /nfs/dbraw/zinc/45/34/01/967453401.db2.gz GBQOWOMCMFRNRY-UHFFFAOYSA-N 2 0 220.360 2.242 20 0 BEADRP Cc1cncc(C[N@@H+]2CCC[C@](C)([NH3+])CC2)c1 ZINC001205265247 967459340 /nfs/dbraw/zinc/45/93/40/967459340.db2.gz OZNKPHUCMMRIEO-AWEZNQCLSA-N 2 0 233.359 2.093 20 0 BEADRP Cc1cc(C[N@@H+]2CCC[C@@](C)([NH3+])CC2)cc(C)n1 ZINC001205280812 967470207 /nfs/dbraw/zinc/47/02/07/967470207.db2.gz JMRHZZTWMRNTPH-OAHLLOKOSA-N 2 0 247.386 2.402 20 0 BEADRP Cc1cnsc1C[N@@H+]1CCC[C@](C)([NH3+])CC1 ZINC001205288353 967481942 /nfs/dbraw/zinc/48/19/42/967481942.db2.gz JIXOEHNATXLRPE-LBPRGKRZSA-N 2 0 239.388 2.155 20 0 BEADRP C[C@@]1([NH3+])CCC[N@H+](CC2OC=CC2=S)CC1 ZINC001205288346 967485069 /nfs/dbraw/zinc/48/50/69/967485069.db2.gz JELXOUNTJHRTGI-GFCCVEGCSA-N 2 0 240.372 2.272 20 0 BEADRP [NH3+]CCCC[NH+]1CCC(Oc2ccccc2)CC1 ZINC001205339357 967557264 /nfs/dbraw/zinc/55/72/64/967557264.db2.gz IDNIMGJYTXMJLF-UHFFFAOYSA-N 2 0 248.370 2.269 20 0 BEADRP CS[C@H]1CCC[C@H]([NH2+]C2CC([NH+](C)C)C2)C1 ZINC000922213689 967605346 /nfs/dbraw/zinc/60/53/46/967605346.db2.gz DVXRMNBCLAYQSW-WTIISPKJSA-N 2 0 242.432 2.343 20 0 BEADRP [NH3+]C[C@]1(F)CCC[N@H+](CCC(F)(F)F)CC1 ZINC001205539495 967679064 /nfs/dbraw/zinc/67/90/64/967679064.db2.gz ZQNPHXYEAQQDTP-VIFPVBQESA-N 2 0 242.260 2.092 20 0 BEADRP CS[C@H](C)CC[N@@H+]1CCC[C@@](F)(C[NH3+])CC1 ZINC001205546025 967689690 /nfs/dbraw/zinc/68/96/90/967689690.db2.gz PDGGCIWHBLMORE-NEPJUHHUSA-N 2 0 248.411 2.281 20 0 BEADRP CN(c1ccc2c[nH+]cn2c1)c1cc(N)cc[nH+]1 ZINC001250328140 967709589 /nfs/dbraw/zinc/70/95/89/967709589.db2.gz LMSQLRIJUVPAJB-UHFFFAOYSA-N 2 0 239.282 2.079 20 0 BEADRP C[C@H]1CC[N@H+](CC2CCCC2)CC[C@H]1C[NH3+] ZINC001205603035 967719002 /nfs/dbraw/zinc/71/90/02/967719002.db2.gz NDLGWDRBHQXXMY-JSGCOSHPSA-N 2 0 224.392 2.483 20 0 BEADRP C[C@@H]1CC[N@H+](CCC(F)(F)F)CC[C@H]1C[NH3+] ZINC001205601789 967719622 /nfs/dbraw/zinc/71/96/22/967719622.db2.gz GKLZGIBPLFDCLZ-ZJUUUORDSA-N 2 0 238.297 2.246 20 0 BEADRP C[C@H]1C[N@H+](CC(C)(C)C)CCC[C@H]1C[NH3+] ZINC001205981142 967923439 /nfs/dbraw/zinc/92/34/39/967923439.db2.gz BXWMJAUPGZPUKG-RYUDHWBXSA-N 2 0 212.381 2.339 20 0 BEADRP CC(C)CC[N@@H+]1CCC[C@@H](C[NH3+])[C@@H](C)C1 ZINC001205984004 967928489 /nfs/dbraw/zinc/92/84/89/967928489.db2.gz QUDZGQLMXXNTMC-STQMWFEESA-N 2 0 212.381 2.339 20 0 BEADRP C[C@@H]1C[N@H+](CCC2CC2)CCC[C@H]1C[NH3+] ZINC001205984713 967934868 /nfs/dbraw/zinc/93/48/68/967934868.db2.gz UKSSZRWVMOJZEA-YPMHNXCESA-N 2 0 210.365 2.093 20 0 BEADRP C[C@H]1C[N@H+](CCC(F)(F)F)CCC[C@@H]1C[NH3+] ZINC001205984635 967936009 /nfs/dbraw/zinc/93/60/09/967936009.db2.gz SQWMARVTWJOKTJ-VHSXEESVSA-N 2 0 238.297 2.246 20 0 BEADRP Cc1ccncc1C[N@@H+]1CCC[C@@H](C[NH3+])[C@H](C)C1 ZINC001206003455 967959677 /nfs/dbraw/zinc/95/96/77/967959677.db2.gz IFEYKAYUHQTXJB-KGLIPLIRSA-N 2 0 247.386 2.197 20 0 BEADRP C[NH+](C)CCC[NH2+][C@H]1C[C@@H]2CC[C@@H](C2)C1 ZINC000711197484 968000578 /nfs/dbraw/zinc/00/05/78/968000578.db2.gz UPQWIXKHOGIQHM-ITGUQSILSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]1C[N@@H+](CC2(F)CC[NH2+]CC2)CCC[C@@H]1C ZINC001206110295 968070732 /nfs/dbraw/zinc/07/07/32/968070732.db2.gz SPFRZHIIOFUONI-STQMWFEESA-N 2 0 242.382 2.446 20 0 BEADRP Cc1cc(C[N@H+]2CC[C@@H](F)[C@@H]([NH3+])CC2)cs1 ZINC001206214216 968145660 /nfs/dbraw/zinc/14/56/60/968145660.db2.gz XWTCNWDLLMULDH-NEPJUHHUSA-N 2 0 242.363 2.318 20 0 BEADRP C[C@@]1(C[NH3+])CCC[N@H+](Cc2cccc(O)c2)CC1 ZINC001206296070 968202263 /nfs/dbraw/zinc/20/22/63/968202263.db2.gz PEBBCXXCYARIPD-OAHLLOKOSA-N 2 0 248.370 2.343 20 0 BEADRP C[C@]1(C[NH3+])CCC[N@H+](Cc2ccns2)CC1 ZINC001206318564 968226891 /nfs/dbraw/zinc/22/68/91/968226891.db2.gz RHNZKOWRWNYXIZ-LBPRGKRZSA-N 2 0 239.388 2.094 20 0 BEADRP C[NH+](C)Cc1ccccc1Nc1cc[nH+]c(N)c1 ZINC001206561513 968382709 /nfs/dbraw/zinc/38/27/09/968382709.db2.gz JDJLIBZOTULXOS-UHFFFAOYSA-N 2 0 242.326 2.469 20 0 BEADRP Cc1cc(C[N@@H+]2CCCC[C@@H](C[NH3+])C2)oc1C ZINC001206615567 968419592 /nfs/dbraw/zinc/41/95/92/968419592.db2.gz JBWZXRQXTVYMJI-ZDUSSCGKSA-N 2 0 236.359 2.457 20 0 BEADRP Cc1ccnc(C[N@H+](C)CC2CC[NH+](C)CC2)c1 ZINC001206855388 968502148 /nfs/dbraw/zinc/50/21/48/968502148.db2.gz VZEPOSZTBIAUOJ-UHFFFAOYSA-N 2 0 247.386 2.164 20 0 BEADRP C[NH+](C)Cc1ccc(C2=CCC[NH2+]C2)cc1 ZINC001240663998 968631299 /nfs/dbraw/zinc/63/12/99/968631299.db2.gz FHGRCVFUPLWMEB-UHFFFAOYSA-N 2 0 216.328 2.125 20 0 BEADRP C[N@@H+]1CCC2(C1)CC[NH+](CCC1CC1)CC2 ZINC001276512872 968675950 /nfs/dbraw/zinc/67/59/50/968675950.db2.gz BRFLOSKLZGUKIC-UHFFFAOYSA-N 2 0 222.376 2.204 20 0 BEADRP CC1CC[NH+](CC(C)(C)C[NH+](C)C)CC1 ZINC001207274625 968708422 /nfs/dbraw/zinc/70/84/22/968708422.db2.gz DXVMQKMQSZYIPN-UHFFFAOYSA-N 2 0 212.381 2.306 20 0 BEADRP CC[NH+]1CCC(C[NH+]2CCC(F)CC2)CC1 ZINC001207314070 968722161 /nfs/dbraw/zinc/72/21/61/968722161.db2.gz LYOGJGYXGFUWON-UHFFFAOYSA-N 2 0 228.355 2.152 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2CCC[C@@H](F)CC2)CC1 ZINC001207392364 968749997 /nfs/dbraw/zinc/74/99/97/968749997.db2.gz ZZXLLFLMQHBXAP-CYBMUJFWSA-N 2 0 228.355 2.152 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2CC[C@](C)(F)[C@H](F)C2)CC1 ZINC001207395041 968750446 /nfs/dbraw/zinc/75/04/46/968750446.db2.gz OJXSXWNQMFYGCH-OLZOCXBDSA-N 2 0 246.345 2.100 20 0 BEADRP C[NH+]1CCC(CC[N@@H+]2C[C@@H]3C[C@H]2C[C@@H]3F)CC1 ZINC001207487308 968796273 /nfs/dbraw/zinc/79/62/73/968796273.db2.gz XIEPTVIBJICQPH-IHRRRGAJSA-N 2 0 240.366 2.151 20 0 BEADRP C[N@H+](CCC1CC[NH+](C)CC1)CC1CC1 ZINC001207480168 968797245 /nfs/dbraw/zinc/79/72/45/968797245.db2.gz VSKAARGSXXZLFD-UHFFFAOYSA-N 2 0 210.365 2.060 20 0 BEADRP CC(C)[C@@H]1CCC[N@@H+]1C[C@@H]1CCCC[NH2+]C1 ZINC000829274391 968824572 /nfs/dbraw/zinc/82/45/72/968824572.db2.gz DCHQHNYNBPYUFW-KGLIPLIRSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)CCC[NH2+][C@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405459914 968991791 /nfs/dbraw/zinc/99/17/91/968991791.db2.gz ILUZQHLOMZGPIL-NEPJUHHUSA-N 2 0 210.365 2.282 20 0 BEADRP C[NH+]1CCC(C)(C[NH+]2CCC(F)(F)CC2)CC1 ZINC001208104495 969001453 /nfs/dbraw/zinc/00/14/53/969001453.db2.gz NVZYEOZBSURUFU-UHFFFAOYSA-N 2 0 246.345 2.449 20 0 BEADRP C[C@@H]1CC[N@H+](CC2(C)CC[NH+](C)CC2)C1 ZINC001208108634 969002305 /nfs/dbraw/zinc/00/23/05/969002305.db2.gz XBTGEINTBIDWJU-GFCCVEGCSA-N 2 0 210.365 2.060 20 0 BEADRP C[NH+]1CCC(C)(C[NH+]2C3CCC2CC3)CC1 ZINC001208113766 969008120 /nfs/dbraw/zinc/00/81/20/969008120.db2.gz OACVOIJHGUACMI-UHFFFAOYSA-N 2 0 222.376 2.345 20 0 BEADRP C[NH+]1CCC(C)(C[N@@H+]2CCC[C@H](CF)C2)CC1 ZINC001208113283 969010325 /nfs/dbraw/zinc/01/03/25/969010325.db2.gz GTTURVJKFGCBMR-CYBMUJFWSA-N 2 0 242.382 2.400 20 0 BEADRP C[NH+]1CCc2cc(C3=CCC[N@@H+](C)C3)ccc2C1 ZINC001241571421 969067259 /nfs/dbraw/zinc/06/72/59/969067259.db2.gz ZAXKZYUVVZFYSD-UHFFFAOYSA-N 2 0 242.366 2.393 20 0 BEADRP CS[C@@H](C)CC[N@@H+]1C[C@H]2C[C@@]2(C[NH+](C)C)C1 ZINC001208156704 969085995 /nfs/dbraw/zinc/08/59/95/969085995.db2.gz YBFWXPVZJIXRLM-YNEHKIRRSA-N 2 0 242.432 2.012 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2CCc3occc3C2)CC1 ZINC001208601225 969156049 /nfs/dbraw/zinc/15/60/49/969156049.db2.gz KQGOZBXAIFWJNA-UHFFFAOYSA-N 2 0 248.370 2.370 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH+]2CCC(C)(F)CC2)C1 ZINC001208605096 969158135 /nfs/dbraw/zinc/15/81/35/969158135.db2.gz YRSCQXHYKFHJAL-GFCCVEGCSA-N 2 0 228.355 2.152 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH+]2CC[C@H]3CCC[C@H]3C2)C1 ZINC001208605182 969158572 /nfs/dbraw/zinc/15/85/72/969158572.db2.gz AJMCXDZMFNZIRN-ZNMIVQPWSA-N 2 0 236.403 2.450 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH+]2CC3CCC(CC3)C2)C1 ZINC001208615553 969169381 /nfs/dbraw/zinc/16/93/81/969169381.db2.gz HXSDZIQULRLTQS-NRXISQOPSA-N 2 0 236.403 2.450 20 0 BEADRP CC[C@@H]1CC[N@H+](C[C@@H]2CCC[NH+](C)C2)C1 ZINC001208615755 969172714 /nfs/dbraw/zinc/17/27/14/969172714.db2.gz XYHYPWGVYYJECH-CHWSQXEVSA-N 2 0 210.365 2.060 20 0 BEADRP Cc1cc(N2CC[NH+](CCC3CC3)CC2)cc[nH+]1 ZINC001208686661 969195712 /nfs/dbraw/zinc/19/57/12/969195712.db2.gz PNJHBWIZVMQMKG-UHFFFAOYSA-N 2 0 245.370 2.312 20 0 BEADRP CC/C=C\CC[NH+]1C[C@@H]2C[NH+](CC)C[C@H]2C1 ZINC001208733021 969218365 /nfs/dbraw/zinc/21/83/65/969218365.db2.gz AOHOZPHBRQQQJX-LAWSMPECSA-N 2 0 222.376 2.226 20 0 BEADRP CCc1cc(N(CC[NH3+])c2cccnc2)cc[nH+]1 ZINC001168837722 969230518 /nfs/dbraw/zinc/23/05/18/969230518.db2.gz KBKBOTKXJBPQLW-UHFFFAOYSA-N 2 0 242.326 2.136 20 0 BEADRP C[C@@H]1C[N@H+](Cc2ccoc2)CCC[C@H]1C[NH3+] ZINC001205996334 969304967 /nfs/dbraw/zinc/30/49/67/969304967.db2.gz WGQIDGOMUCXZBF-YPMHNXCESA-N 2 0 222.332 2.086 20 0 BEADRP C1=CC[NH+](C[C@@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC001208945405 969313195 /nfs/dbraw/zinc/31/31/95/969313195.db2.gz BVWWZXJHWBLTGB-INIZCTEOSA-N 2 0 242.366 2.380 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]CC1(C)CC1)C2 ZINC001169082489 969402629 /nfs/dbraw/zinc/40/26/29/969402629.db2.gz ZWCNCHRPBRGSIY-CNDDSTCGSA-N 2 0 208.349 2.001 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]CC(C)(C)C)C2 ZINC001169081734 969405374 /nfs/dbraw/zinc/40/53/74/969405374.db2.gz VNILNLNNHYLYEX-ZSBIGDGJSA-N 2 0 210.365 2.247 20 0 BEADRP C[C@@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)C1CCC1 ZINC001169118769 969412465 /nfs/dbraw/zinc/41/24/65/969412465.db2.gz NFYCYGBPVWDOJO-RUZUBIRVSA-N 2 0 222.376 2.390 20 0 BEADRP C[C@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)C1CCC1 ZINC001169118767 969412662 /nfs/dbraw/zinc/41/26/62/969412662.db2.gz NFYCYGBPVWDOJO-DEQVHRJGSA-N 2 0 222.376 2.390 20 0 BEADRP C[C@H]1C[C@@H](CF)[N@@H+]([C@H]2C[C@H]3CC[C@@H](C2)[NH+]3C)C1 ZINC001169126118 969425947 /nfs/dbraw/zinc/42/59/47/969425947.db2.gz PVGIPDVGGSAIIV-QNSTZXKLSA-N 2 0 240.366 2.292 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CCC(C)(F)CC1)C2 ZINC001169125408 969427935 /nfs/dbraw/zinc/42/79/35/969427935.db2.gz HTYXSBGUUCWABF-ITGUQSILSA-N 2 0 240.366 2.436 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](N1CC3CCC1CC3)C2 ZINC001169142636 969457346 /nfs/dbraw/zinc/45/73/46/969457346.db2.gz DYSMVBOPNLXHGR-QSCRHYGLSA-N 2 0 234.387 2.486 20 0 BEADRP C[N@H+](CCC1CC1)[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169155661 969474370 /nfs/dbraw/zinc/47/43/70/969474370.db2.gz ULRCHSPHQABJBW-WDNDVIMCSA-N 2 0 222.376 2.344 20 0 BEADRP CC[C@@H]1CC[N@@H+]([C@@H]2C[C@H]3CC[C@@H](C2)[NH+]3C)C1 ZINC001169161718 969480361 /nfs/dbraw/zinc/48/03/61/969480361.db2.gz PTBWHWPANJIJFU-YIYPIFLZSA-N 2 0 222.376 2.344 20 0 BEADRP CC[NH+]1CCC([NH2+]CCc2cc(C)ccn2)CC1 ZINC001169230821 969503179 /nfs/dbraw/zinc/50/31/79/969503179.db2.gz KOTXOKMCNAMTRN-UHFFFAOYSA-N 2 0 247.386 2.006 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH2+]C[C@@H]2CCC[C@H]2F)CC1 ZINC001254497032 969663544 /nfs/dbraw/zinc/66/35/44/969663544.db2.gz FGIFIPQXYSVTRR-RWMBFGLXSA-N 2 0 228.355 2.199 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH2+]CCc2ccccc2O)CC1 ZINC001254506020 969670521 /nfs/dbraw/zinc/67/05/21/969670521.db2.gz NOMATPGOACHDRN-AWEZNQCLSA-N 2 0 248.370 2.009 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH2+][C@H]2CCc3ncccc32)CC1 ZINC001254506942 969675530 /nfs/dbraw/zinc/67/55/30/969675530.db2.gz DDUCEFOKQIXHGV-DOMZBBRYSA-N 2 0 245.370 2.143 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[N@H+](C)CC1)c1ccc(N)cc1 ZINC001254506813 969675799 /nfs/dbraw/zinc/67/57/99/969675799.db2.gz ATXGNMISESYXHR-WFASDCNBSA-N 2 0 247.386 2.404 20 0 BEADRP C[N@@H+]1CCC[C@@H](Nc2cccc(CC[NH3+])c2)CC1 ZINC001254507859 969680537 /nfs/dbraw/zinc/68/05/37/969680537.db2.gz GGAFDYPJQXYHLZ-CQSZACIVSA-N 2 0 247.386 2.084 20 0 BEADRP C[N@@H+]1CCC[C@H](Nc2cccc(CC[NH3+])c2)CC1 ZINC001254507856 969682868 /nfs/dbraw/zinc/68/28/68/969682868.db2.gz GGAFDYPJQXYHLZ-AWEZNQCLSA-N 2 0 247.386 2.084 20 0 BEADRP C[C@@H]1C[N@@H+]([C@H]2CCC[NH+](C)CC2)CCC1(F)F ZINC001254516812 969686536 /nfs/dbraw/zinc/68/65/36/969686536.db2.gz QAYPYOGYXZBCRG-NEPJUHHUSA-N 2 0 246.345 2.448 20 0 BEADRP CC[N@H+](Cc1ccncc1)[C@@H]1CCC[NH+](C)CC1 ZINC001254516167 969689906 /nfs/dbraw/zinc/68/99/06/969689906.db2.gz JPIHVVOBUSPTBR-OAHLLOKOSA-N 2 0 247.386 2.388 20 0 BEADRP COc1cc(Nc2c[nH+]c(N)cc2C)[nH+]cc1C ZINC001209966341 969731941 /nfs/dbraw/zinc/73/19/41/969731941.db2.gz XGISICIDTGYQOM-UHFFFAOYSA-N 2 0 244.298 2.428 20 0 BEADRP Cc1cc2[nH+]ccn2cc1NCC[C@H]1CCC[NH2+]1 ZINC001169564895 969763733 /nfs/dbraw/zinc/76/37/33/969763733.db2.gz ZIHLBGRCSWQCNF-GFCCVEGCSA-N 2 0 244.342 2.197 20 0 BEADRP [NH3+]Cc1cccc(NCC23CC[NH+](CC2)CC3)c1 ZINC001169795345 969861649 /nfs/dbraw/zinc/86/16/49/969861649.db2.gz OSWQEUGTBURHBT-UHFFFAOYSA-N 2 0 245.370 2.043 20 0 BEADRP [NH3+]Cc1ccccc1C[NH2+]C1CCSCC1 ZINC001255082182 969871364 /nfs/dbraw/zinc/87/13/64/969871364.db2.gz VOUMKJBDJYZDGW-UHFFFAOYSA-N 2 0 236.384 2.131 20 0 BEADRP CC(C)[N@H+]([C@H]1CCSC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001255274232 970027198 /nfs/dbraw/zinc/02/71/98/970027198.db2.gz ALKXFLSRCZGYTG-AVGNSLFASA-N 2 0 242.432 2.472 20 0 BEADRP CCCC[C@H](C)[N@H+]1C[C@H]2C[NH+](C)C[C@H]2C1 ZINC001255331037 970112448 /nfs/dbraw/zinc/11/24/48/970112448.db2.gz YNGPIUMBFVJHOM-RWMBFGLXSA-N 2 0 210.365 2.059 20 0 BEADRP CC(C)CCC[C@@H](C)NC(=[NH2+])NCCCC[NH3+] ZINC001170061445 970118873 /nfs/dbraw/zinc/11/88/73/970118873.db2.gz PXLVJCJOFPTKRM-GFCCVEGCSA-N 2 0 242.411 2.054 20 0 BEADRP CC(C)CCC[C@H](C)NC(=[NH2+])SCC[NH3+] ZINC001170060706 970120891 /nfs/dbraw/zinc/12/08/91/970120891.db2.gz CFMXEROCGFDMBR-JTQLQIEISA-N 2 0 231.409 2.417 20 0 BEADRP C[N@@H+]1CC[C@@H](n2cc(CC[NH3+])c3ccccc32)C1 ZINC001255412190 970130505 /nfs/dbraw/zinc/13/05/05/970130505.db2.gz GKNULJKXHHANQI-CYBMUJFWSA-N 2 0 243.354 2.019 20 0 BEADRP CC(C)CCC[C@H](C)[NH2+]CCSCC[NH3+] ZINC001170065471 970134629 /nfs/dbraw/zinc/13/46/29/970134629.db2.gz ZBNTWWHAMXHZJO-LBPRGKRZSA-N 2 0 232.437 2.483 20 0 BEADRP C[NH2+]Cc1cccc(Nc2cc[nH+]c(C)c2)c1 ZINC001211134478 970158901 /nfs/dbraw/zinc/15/89/01/970158901.db2.gz MBXARVNCEKVWIV-UHFFFAOYSA-N 2 0 227.311 2.275 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+]CC23CC[NH+](CC2)CC3)C1 ZINC001170099474 970286378 /nfs/dbraw/zinc/28/63/78/970286378.db2.gz ASGRCVKYJNUSII-QWHCGFSZSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+]Cc2ccccc2C[NH3+])C1 ZINC001170111201 970321240 /nfs/dbraw/zinc/32/12/40/970321240.db2.gz AYYFJLFPCJHRPG-SMDDNHRTSA-N 2 0 218.344 2.424 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@H]2C[C@H]3CC[N@H+](C2)[C@H]3C)C1 ZINC001170109921 970322213 /nfs/dbraw/zinc/32/22/13/970322213.db2.gz SOHBPMGHDRVCIW-BJJPWKGXSA-N 2 0 222.376 2.247 20 0 BEADRP COC[C@@H](C)[N@H+](CC1CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001255561144 970343952 /nfs/dbraw/zinc/34/39/52/970343952.db2.gz DMCIYYXJBQMMNL-MRVWCRGKSA-N 2 0 240.391 2.003 20 0 BEADRP COC[C@@H](C)[NH+]1CCC([NH3+])(CC2CCC2)CC1 ZINC001255563183 970351132 /nfs/dbraw/zinc/35/11/32/970351132.db2.gz RCLBMQOXIHYLDU-GFCCVEGCSA-N 2 0 240.391 2.005 20 0 BEADRP CCCC[NH+]1CCC(C[NH2+][C@@H](C)COC)CC1 ZINC001255564397 970352102 /nfs/dbraw/zinc/35/21/02/970352102.db2.gz YNSBHDWWPFVJCU-ZDUSSCGKSA-N 2 0 242.407 2.123 20 0 BEADRP COC[C@H](C)[NH2+]C[C@H](C)CC(C)(C)CC[NH3+] ZINC001255564049 970354501 /nfs/dbraw/zinc/35/45/01/970354501.db2.gz UFQWTLOEXKIQLK-NEPJUHHUSA-N 2 0 230.396 2.012 20 0 BEADRP CC(C)[N@H+](CCC[NH3+])[C@H](C)CC(F)(F)F ZINC001255633573 970407678 /nfs/dbraw/zinc/40/76/78/970407678.db2.gz LWYGRZFOHLUIFX-SECBINFHSA-N 2 0 226.286 2.387 20 0 BEADRP CC(C)[N@H+](CCC[NH3+])[C@@H](C)CC(F)(F)F ZINC001255633574 970408441 /nfs/dbraw/zinc/40/84/41/970408441.db2.gz LWYGRZFOHLUIFX-VIFPVBQESA-N 2 0 226.286 2.387 20 0 BEADRP C[C@H]1CC[C@@H]([N@@H+]2C[C@H]3CC[NH+](C)C[C@H]3C2)C1 ZINC001170134629 970409375 /nfs/dbraw/zinc/40/93/75/970409375.db2.gz CUMNUOVRIVWWJU-RFQIPJPRSA-N 2 0 222.376 2.059 20 0 BEADRP CC[C@@H]1C[C@@H]([N@H+](CCC[NH3+])C(C)C)CCO1 ZINC001170171046 970540842 /nfs/dbraw/zinc/54/08/42/970540842.db2.gz OOUKXELEWBAUAR-QWHCGFSZSA-N 2 0 228.380 2.003 20 0 BEADRP CC[C@@H]1C[C@@H]([NH2+]CCCCC[NH+](C)C)CCO1 ZINC001170170662 970547594 /nfs/dbraw/zinc/54/75/94/970547594.db2.gz MZDCAQJSYAYTBR-UONOGXRCSA-N 2 0 242.407 2.266 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](C[C@H]2CC3CCC2CC3)C1 ZINC000400113412 970553020 /nfs/dbraw/zinc/55/30/20/970553020.db2.gz LGGAQUFIKSPZQB-OOJKYFRXSA-N 2 0 236.403 2.354 20 0 BEADRP CC[C@@H]1C[C@@H]([NH2+]Cc2ccccc2C[NH3+])CCO1 ZINC001170181159 970554963 /nfs/dbraw/zinc/55/49/63/970554963.db2.gz DZOZLSDNRXZWRH-LSDHHAIUSA-N 2 0 248.370 2.193 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)n1ccnc1[C@H](C)[NH3+] ZINC001255940624 970569365 /nfs/dbraw/zinc/56/93/65/970569365.db2.gz FDPYJEAWEMCGBA-NEPJUHHUSA-N 2 0 238.379 2.196 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]C1(C)CCOCC1 ZINC001255941808 970573317 /nfs/dbraw/zinc/57/33/17/970573317.db2.gz XLLSIIVDJMWAHJ-CYBMUJFWSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@@H]([NH2+][C@H](C)C1CC[NH2+]CC1)c1ccccn1 ZINC000400317503 970573859 /nfs/dbraw/zinc/57/38/59/970573859.db2.gz ANFRKGIOBDOARF-VXGBXAGGSA-N 2 0 233.359 2.120 20 0 BEADRP CCCN(CCC[NH3+])[C@@H](C)CC[NH+](CC)CC ZINC001255942431 970575268 /nfs/dbraw/zinc/57/52/68/970575268.db2.gz GJXUMZMFYZYBPM-AWEZNQCLSA-N 2 0 243.439 2.168 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]C[C@@]1(C)CCOC1 ZINC001255951298 970590766 /nfs/dbraw/zinc/59/07/66/970590766.db2.gz HULWTIFJULXMSK-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)CCC[NH2+][C@H](C)C1CC[NH2+]CC1 ZINC000400448993 970592009 /nfs/dbraw/zinc/59/20/09/970592009.db2.gz OESNIQDFSFZIDR-GFCCVEGCSA-N 2 0 212.381 2.400 20 0 BEADRP CC[C@@H]([NH2+][C@H](C)C1CC[NH2+]CC1)C(C)C ZINC000400451105 970592054 /nfs/dbraw/zinc/59/20/54/970592054.db2.gz ORCDOKUPSRDTCO-DGCLKSJQSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@H]1C)C1CC[NH2+]CC1 ZINC000400500188 970596850 /nfs/dbraw/zinc/59/68/50/970596850.db2.gz BVNWPNDAYIYWQZ-NTZNESFSSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC1(C)C)C1CC[NH2+]CC1 ZINC000400561716 970604675 /nfs/dbraw/zinc/60/46/75/970604675.db2.gz HXYNDBFYNZNHPF-JQWIXIFHSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H](Cc1ccco1)[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000400996879 970651738 /nfs/dbraw/zinc/65/17/38/970651738.db2.gz CFXNCAZMYSJWHT-ZOBORPQBSA-N 2 0 248.370 2.188 20 0 BEADRP Cc1cccc(C(=[NH2+])NC2CC[NH+](C)CC2)c1 ZINC001256197666 970691996 /nfs/dbraw/zinc/69/19/96/970691996.db2.gz OLUKHAWPXWVDRX-UHFFFAOYSA-N 2 0 231.343 2.004 20 0 BEADRP CC(C)CC[C@H](C)[N@H+](C)C[C@H](C)C[NH3+] ZINC001256357581 970735777 /nfs/dbraw/zinc/73/57/77/970735777.db2.gz IBYATORXIZULOB-NEPJUHHUSA-N 2 0 200.370 2.338 20 0 BEADRP CCCCC[C@@H](C)[N@@H+]1CCC[C@@](O)(C[NH3+])CC1 ZINC001246545979 972660560 /nfs/dbraw/zinc/66/05/60/972660560.db2.gz XUBJYZWDTIIYLM-KGLIPLIRSA-N 2 0 242.407 2.131 20 0 BEADRP CCOCC[C@H](C)[N@@H+]1CCC[C@@](C)([NH3+])CC1 ZINC001246548011 972674043 /nfs/dbraw/zinc/67/40/43/972674043.db2.gz DXPWUPNHGZJTIH-QWHCGFSZSA-N 2 0 228.380 2.005 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2CCC[C@@](F)(C[NH3+])CC2)C1 ZINC001246548260 972680710 /nfs/dbraw/zinc/68/07/10/972680710.db2.gz JVTMBMAWZAFVAJ-AGIUHOORSA-N 2 0 228.355 2.328 20 0 BEADRP C[C@@H]1C[C@@H]([N@@H+]2CCC[C@@](C)([NH3+])CC2)C[C@H](C)O1 ZINC001246550593 972706851 /nfs/dbraw/zinc/70/68/51/972706851.db2.gz JNKCTQURIROZRE-XJFOESAGSA-N 2 0 240.391 2.146 20 0 BEADRP CCCCC[C@H](C)[N@@H+]1CCCC[C@@](O)(C[NH3+])C1 ZINC001246557969 972780709 /nfs/dbraw/zinc/78/07/09/972780709.db2.gz JSJXMZXCRKBYJE-UONOGXRCSA-N 2 0 242.407 2.131 20 0 BEADRP C[C@H](CC1CC1)[N@@H+]1CCC(F)(F)[C@@H](C[NH3+])C1 ZINC001246560400 972792209 /nfs/dbraw/zinc/79/22/09/972792209.db2.gz ULPMPFLRVLILIC-KOLCDFICSA-N 2 0 232.318 2.091 20 0 BEADRP Cc1cccc2c1C[N@@H+](C1CC[NH2+]CC1)C2 ZINC001246570093 972837584 /nfs/dbraw/zinc/83/75/84/972837584.db2.gz ZBIPGMHLEFWQNI-UHFFFAOYSA-N 2 0 216.328 2.063 20 0 BEADRP CC(C)([NH3+])CNc1cc(N2CCCCC2)cc[nH+]1 ZINC001171191462 972838240 /nfs/dbraw/zinc/83/82/40/972838240.db2.gz YCVHGYVXJCQTMP-UHFFFAOYSA-N 2 0 248.374 2.221 20 0 BEADRP CC1(C)C[C@@H]([N@@H+]2CCCC[C@@](C)(C[NH3+])C2)CO1 ZINC001246597877 973013622 /nfs/dbraw/zinc/01/36/22/973013622.db2.gz YODAFBONJYWHFO-OCCSQVGLSA-N 2 0 240.391 2.005 20 0 BEADRP C1[C@@H]2C[C@H]([N@@H+]3CCC[C@]34CCC[NH2+]C4)C[C@H]12 ZINC001246605923 973025055 /nfs/dbraw/zinc/02/50/55/973025055.db2.gz CZAMZKQOJJLUEE-DGAVXFQQSA-N 2 0 220.360 2.003 20 0 BEADRP CCCC[C@@H](C)[N@@H+]1C[C@H]2CCC[NH2+][C@H]2C1 ZINC001246655149 973071665 /nfs/dbraw/zinc/07/16/65/973071665.db2.gz GJZJEZIUCIOBBU-UPJWGTAASA-N 2 0 210.365 2.249 20 0 BEADRP CCCCCC[C@@H](C)[N@H+]1C[C@@H]2[C@@H]([NH3+])[C@@H]2C1 ZINC001246660522 973074307 /nfs/dbraw/zinc/07/43/07/973074307.db2.gz UWBIDIIGXDPMIA-NDBYEHHHSA-N 2 0 210.365 2.234 20 0 BEADRP CCC[C@H](C)CC[C@H](C)[N@H+]1C[C@@H]2[C@H]([NH3+])[C@@H]2C1 ZINC001246665980 973079247 /nfs/dbraw/zinc/07/92/47/973079247.db2.gz VOMDTPRPHJXJAN-YHQUGGNUSA-N 2 0 224.392 2.480 20 0 BEADRP CCC1(C[NH2+]CC2CC[NH+](C)CC2)CCC1 ZINC000233006826 973127456 /nfs/dbraw/zinc/12/74/56/973127456.db2.gz HLJXHUAWMJJARJ-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H]1CC[C@H]([N@H+]2C[C@H]3CC[C@@H](C2)[C@@H]3[NH3+])C[C@H]1C ZINC001246841223 973136545 /nfs/dbraw/zinc/13/65/45/973136545.db2.gz NAUFFWJWDCPYLB-PMXAPFLYSA-N 2 0 236.403 2.480 20 0 BEADRP CC(C)CC[C@H](C)[N@H+]1C[C@H]2CC[C@@H](C1)[C@@H]2[NH3+] ZINC001246843625 973139143 /nfs/dbraw/zinc/13/91/43/973139143.db2.gz VGIDRHXLOPFURM-FQUUOJAGSA-N 2 0 224.392 2.480 20 0 BEADRP CC[C@@H]1CC[C@@H]([N@@H+]2C[C@H]3CC[C@@H](C2)[NH2+]C3)C1 ZINC001246869927 973241428 /nfs/dbraw/zinc/24/14/28/973241428.db2.gz XKPSIEJAOZTTIT-ZOBORPQBSA-N 2 0 222.376 2.249 20 0 BEADRP CC[C@H]1CC[C@H]([N@@H+]2C[C@H]3CC[C@@H](C2)[NH2+]C3)C1 ZINC001246869917 973246979 /nfs/dbraw/zinc/24/69/79/973246979.db2.gz XKPSIEJAOZTTIT-XUXIUFHCSA-N 2 0 222.376 2.249 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]Cc1cc(C)sc1C ZINC001328676366 973256919 /nfs/dbraw/zinc/25/69/19/973256919.db2.gz DAKYNCHEILMUJS-VIFPVBQESA-N 2 0 226.389 2.453 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2C[C@@H]3C[NH2+]C[C@@H]32)CC(C)(C)C1 ZINC001246919627 973482979 /nfs/dbraw/zinc/48/29/79/973482979.db2.gz NPXLIWBUVIXESV-VOAKCMCISA-N 2 0 222.376 2.105 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH2+]CC2(C)CC(F)(F)C2)CC1 ZINC000720935287 973669122 /nfs/dbraw/zinc/66/91/22/973669122.db2.gz NDRYZTILOMKOJX-LLVKDONJSA-N 2 0 246.345 2.496 20 0 BEADRP C[C@@H]1C[C@@H](C[N@H+](C)CCC(F)(F)F)CC[NH2+]1 ZINC000235381333 973844289 /nfs/dbraw/zinc/84/42/89/973844289.db2.gz NJHQWIPDOWSIFV-ZJUUUORDSA-N 2 0 238.297 2.259 20 0 BEADRP Fc1cc2nc[nH]c2cc1NC[C@@H]1CCCC[NH2+]1 ZINC001171335162 973868767 /nfs/dbraw/zinc/86/87/67/973868767.db2.gz NAPLUAYUXXCZRT-VIFPVBQESA-N 2 0 248.305 2.256 20 0 BEADRP CC[NH+](CC)C[C@@H](C)OC[C@H]1CCCC[N@@H+]1C ZINC001224703955 973872112 /nfs/dbraw/zinc/87/21/12/973872112.db2.gz VYLOMZYUVHZGHO-ZIAGYGMSSA-N 2 0 242.407 2.218 20 0 BEADRP C1=C[C@@H]2CC[C@H]1C[C@@H]2[NH2+]CCC[NH+]1CCCC1 ZINC001332834038 1169969177 /nfs/dbraw/zinc/96/91/77/1169969177.db2.gz QREPHXIJYQSJKS-ZNMIVQPWSA-N 2 0 234.387 2.417 20 0 BEADRP CC[NH+](CC)CCO[C@H]1CCC[N@@H+](C(C)C)C1 ZINC001224927157 974076818 /nfs/dbraw/zinc/07/68/18/974076818.db2.gz DSWHIGQMDRCKHP-AWEZNQCLSA-N 2 0 242.407 2.218 20 0 BEADRP CCOCC[NH2+]C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171617237 974114676 /nfs/dbraw/zinc/11/46/76/974114676.db2.gz IOQOGTVXRJIVTN-UHFFFAOYSA-N 2 0 242.407 2.264 20 0 BEADRP CCN(CCC[NH+](C)C)Cc1cccc(C)n1 ZINC001204071025 974124488 /nfs/dbraw/zinc/12/44/88/974124488.db2.gz QEYUPYJFDDOIHF-UHFFFAOYSA-N 2 0 235.375 2.164 20 0 BEADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1ccncc1)C2 ZINC001172100333 974344979 /nfs/dbraw/zinc/34/49/79/974344979.db2.gz OXMBSJBPIAMXID-QDMKHBRRSA-N 2 0 245.370 2.187 20 0 BEADRP CC(C)OCC[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172100100 974346612 /nfs/dbraw/zinc/34/66/12/974346612.db2.gz MVWMFCYCGMICQF-BTTYYORXSA-N 2 0 240.391 2.016 20 0 BEADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC[C@@H]1CF)C2 ZINC001172130193 974352036 /nfs/dbraw/zinc/35/20/36/974352036.db2.gz HQPRPJSYWLKMLY-RQJABVFESA-N 2 0 240.366 2.436 20 0 BEADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CC3CC(C3)C1)C2 ZINC001172122337 974382835 /nfs/dbraw/zinc/38/28/35/974382835.db2.gz ACPSJVOXFUABLX-QSCRHYGLSA-N 2 0 234.387 2.344 20 0 BEADRP COCC(C)(C)CC[NH2+]C1CCC(C[NH3+])CC1 ZINC001330793159 974474297 /nfs/dbraw/zinc/47/42/97/974474297.db2.gz AXIRYWPCAKUYDE-UHFFFAOYSA-N 2 0 242.407 2.156 20 0 BEADRP C[C@@H]1CC[C@H](NC(=[NH2+])SCC[NH3+])C[C@@H]1C ZINC001172359454 974628812 /nfs/dbraw/zinc/62/88/12/974628812.db2.gz MSGRJSIYODHRNS-UTLUCORTSA-N 2 0 229.393 2.027 20 0 BEADRP CCOCC[C@@H](C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001172409667 974671772 /nfs/dbraw/zinc/67/17/72/974671772.db2.gz ATQKSWOAUZTXFK-YIYPIFLZSA-N 2 0 240.391 2.016 20 0 BEADRP CCOCC[C@H](C)[N@H+](C)C1CCC([NH3+])CC1 ZINC001172411169 974675193 /nfs/dbraw/zinc/67/51/93/974675193.db2.gz LOCAFIHTNUFEKL-HIFPTAJRSA-N 2 0 228.380 2.003 20 0 BEADRP CCOCC[C@@H](C)[NH2+]C(C)(C)CC[NH+](C)C ZINC001172415753 974683401 /nfs/dbraw/zinc/68/34/01/974683401.db2.gz ZKOXFTKGUUBGDH-GFCCVEGCSA-N 2 0 230.396 2.121 20 0 BEADRP CC[C@@H](CC(C)C)[N@H+](C)C[C@@H](C)C[NH3+] ZINC001172394489 974746534 /nfs/dbraw/zinc/74/65/34/974746534.db2.gz VKQXHTTWFXWJOA-RYUDHWBXSA-N 2 0 200.370 2.338 20 0 BEADRP CC[C@H](CC(C)C)[NH2+]CCSCC[NH3+] ZINC001172394505 974747708 /nfs/dbraw/zinc/74/77/08/974747708.db2.gz VTJIYZXSDTYEBJ-LLVKDONJSA-N 2 0 218.410 2.093 20 0 BEADRP CC(C)COCC[C@@H](C)[N@H+](C)CCC[NH+](C)C ZINC001172468894 974765998 /nfs/dbraw/zinc/76/59/98/974765998.db2.gz PYSLZAURQXFZLC-CQSZACIVSA-N 2 0 244.423 2.321 20 0 BEADRP [NH3+]C1CC([NH2+][C@H]2CC[C@@H](c3ccccc3)C2)C1 ZINC001172561687 974870376 /nfs/dbraw/zinc/87/03/76/974870376.db2.gz XXWGUSYPGTWCGP-JLVJUDLZSA-N 2 0 230.355 2.402 20 0 BEADRP C[C@@H](C[NH+](C)C)Oc1cc(N)[nH+]c2ccccc21 ZINC001226418583 974892009 /nfs/dbraw/zinc/89/20/09/974892009.db2.gz PCSZVDARLIXNGV-JTQLQIEISA-N 2 0 245.326 2.146 20 0 BEADRP C[NH+](C)CCC[NH2+]C1CC(C)(C)OC(C)(C)C1 ZINC001172641557 974893171 /nfs/dbraw/zinc/89/31/71/974893171.db2.gz GVHRFKYXFDBOSQ-UHFFFAOYSA-N 2 0 242.407 2.264 20 0 BEADRP [NH3+]CCOCC[NH2+]C1CCC2(CCCC2)CC1 ZINC001172725009 974910074 /nfs/dbraw/zinc/91/00/74/974910074.db2.gz GERDDPKCZUXLEJ-UHFFFAOYSA-N 2 0 240.391 2.054 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH2+][C@@H]2CC23CCC3)CC1 ZINC000721159605 974929537 /nfs/dbraw/zinc/92/95/37/974929537.db2.gz CVSMYIDIYPVLJN-VXGBXAGGSA-N 2 0 208.349 2.003 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH2+][C@H]2CC23CCC3)CC1 ZINC000721159601 974930862 /nfs/dbraw/zinc/93/08/62/974930862.db2.gz CVSMYIDIYPVLJN-NEPJUHHUSA-N 2 0 208.349 2.003 20 0 BEADRP Cc1ccc2c(c1)C[C@H]([NH2+]CCCC[NH3+])CC2 ZINC001172834336 974953406 /nfs/dbraw/zinc/95/34/06/974953406.db2.gz FEOPJJARMZJQBO-OAHLLOKOSA-N 2 0 232.371 2.181 20 0 BEADRP CO[C@H]1CCC[C@@H]([NH2+]C(C)(C)C(C)(C)[NH3+])C1 ZINC001172926266 974972920 /nfs/dbraw/zinc/97/29/20/974972920.db2.gz PCOGHHSRRCDYCU-MNOVXSKESA-N 2 0 228.380 2.050 20 0 BEADRP CC[NH+](CC)C1CCC([NH2+]C2CC2)CC1 ZINC001173104032 975021351 /nfs/dbraw/zinc/02/13/51/975021351.db2.gz DLPVWDVOUJPOQS-UHFFFAOYSA-N 2 0 210.365 2.391 20 0 BEADRP C[C@H]1C[C@@H](n2ccnc2[C@H]2CCC[NH2+]C2)CCO1 ZINC001173173275 975055048 /nfs/dbraw/zinc/05/50/48/975055048.db2.gz FGAIMTMPGVTPBC-AVGNSLFASA-N 2 0 249.358 2.090 20 0 BEADRP CC[C@H]1CC[C@H]([N@H+](C)CCC[NH+](C)C)C1 ZINC001173275532 975086246 /nfs/dbraw/zinc/08/62/46/975086246.db2.gz VUDICFJFSNUHIK-STQMWFEESA-N 2 0 212.381 2.449 20 0 BEADRP CC[C@H]1CC[C@@H]([NH2+][C@@H]2CCC[C@H]([NH3+])C2)C1 ZINC001173260890 975108562 /nfs/dbraw/zinc/10/85/62/975108562.db2.gz PISDPAXZQOFEBA-WUHRBBMRSA-N 2 0 210.365 2.425 20 0 BEADRP CCSC[C@H](C)[NH2+]C(C)(C)C(C)(C)[NH3+] ZINC001173295806 975177240 /nfs/dbraw/zinc/17/72/40/975177240.db2.gz IPPCATKCXFCRGO-VIFPVBQESA-N 2 0 218.410 2.234 20 0 BEADRP CCSC[C@H](C)[NH2+]C(C)(C)CC[NH+](C)C ZINC001173290890 975262384 /nfs/dbraw/zinc/26/23/84/975262384.db2.gz ITNWJYMRGHAFLO-NSHDSACASA-N 2 0 232.437 2.448 20 0 BEADRP CC[N@@H+]1CC[C@H](n2c(C[NH3+])cc3ccccc32)C1 ZINC001173349900 975293253 /nfs/dbraw/zinc/29/32/53/975293253.db2.gz KTBXBKHKIRAYHO-ZDUSSCGKSA-N 2 0 243.354 2.367 20 0 BEADRP C[NH+](C)C1CCC([NH2+][C@H]2CC23CCC3)CC1 ZINC000721228172 975365532 /nfs/dbraw/zinc/36/55/32/975365532.db2.gz YDUZCRLTZXOGIJ-BPCQOVAHSA-N 2 0 222.376 2.391 20 0 BEADRP C[NH+](C)Cc1ccccc1Nc1cc[nH+]cc1 ZINC001173883031 975940781 /nfs/dbraw/zinc/94/07/81/975940781.db2.gz CJZVJBRKWPXTEH-UHFFFAOYSA-N 2 0 227.311 2.309 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@@H]2CCC[C@H](F)C2)CC1 ZINC001333835184 976114387 /nfs/dbraw/zinc/11/43/87/976114387.db2.gz WFXAMTLAQZSNON-QWHCGFSZSA-N 2 0 228.355 2.199 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2CC(C)(C)C2(C)C)CC1 ZINC001334142712 976330057 /nfs/dbraw/zinc/33/00/57/976330057.db2.gz ZQQIOJBIMCUYKM-UHFFFAOYSA-N 2 0 224.392 2.449 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC001334389962 976488214 /nfs/dbraw/zinc/48/82/14/976488214.db2.gz KQKVXBOURRWFEG-UKRRQHHQSA-N 3 0 249.402 2.054 20 0 BEADRP Cc1cc(Nc2ccc3[nH+]ccn3c2)cc[nH+]1 ZINC001174276281 976509094 /nfs/dbraw/zinc/50/90/94/976509094.db2.gz VJJVVMREFGUMMH-UHFFFAOYSA-N 2 0 224.267 2.203 20 0 BEADRP C[C@@H](C[NH+](C)C)Oc1ccc2c(c1)CC[N@@H+](C)C2 ZINC001228936126 976591248 /nfs/dbraw/zinc/59/12/48/976591248.db2.gz BXNZKJMMKWLUTO-LBPRGKRZSA-N 2 0 248.370 2.003 20 0 BEADRP Cc1c[nH+]ccc1N(C)c1cc(N)cc[nH+]1 ZINC001174537367 976821803 /nfs/dbraw/zinc/82/18/03/976821803.db2.gz HRLDYCYSUPESGM-UHFFFAOYSA-N 2 0 214.272 2.135 20 0 BEADRP C[NH+](C)[C@@H]1CC[C@H]2C[N@H+](CC3(C)CC3)C[C@@H]2C1 ZINC001335133587 976859899 /nfs/dbraw/zinc/85/98/99/976859899.db2.gz JLWNSWFLYXVDNE-MELADBBJSA-N 2 0 236.403 2.449 20 0 BEADRP Cc1cc(Nc2cc[nH+]c(N(C)C)c2)cc[nH+]1 ZINC001174652630 976937316 /nfs/dbraw/zinc/93/73/16/976937316.db2.gz AMWGVMYSFSTIJD-UHFFFAOYSA-N 2 0 228.299 2.017 20 0 BEADRP [NH3+]C[C@H]1CCC[N@H+](CC2Cc3ccccc3C2)C1 ZINC001574270387 1170025218 /nfs/dbraw/zinc/02/52/18/1170025218.db2.gz FFLRDHMLZWWJSS-CYBMUJFWSA-N 2 0 244.382 2.072 20 0 BEADRP CCO[C@@H]1CC[N@H+](Cc2cc3c[nH+]ccc3[nH]2)C1 ZINC001232017806 977843959 /nfs/dbraw/zinc/84/39/59/977843959.db2.gz YPERNFLSIIZCKV-CYBMUJFWSA-N 2 0 245.326 2.174 20 0 BEADRP c1c[nH+]c(Nc2cc[nH+]c(C3CC3)c2)[nH]1 ZINC001176082683 977882399 /nfs/dbraw/zinc/88/23/99/977882399.db2.gz RONUSSQAGSOAAO-UHFFFAOYSA-N 2 0 200.245 2.426 20 0 BEADRP Cc1ccc(CN(C)C2CC[NH+](C)CC2)c(C)n1 ZINC001232082057 977885959 /nfs/dbraw/zinc/88/59/59/977885959.db2.gz OYQQBKDZXIYYSY-UHFFFAOYSA-N 2 0 247.386 2.224 20 0 BEADRP C[NH+](C)CCc1ccc(Nc2[nH]cc[nH+]2)cc1 ZINC001176085787 977891479 /nfs/dbraw/zinc/89/14/79/977891479.db2.gz ZDHBMKFYJSLTAV-UHFFFAOYSA-N 2 0 230.315 2.257 20 0 BEADRP Cc1cc(Nc2c[nH+]ccc2N(C)C)cc(C)[nH+]1 ZINC001176051642 977896340 /nfs/dbraw/zinc/89/63/40/977896340.db2.gz HLEHYJHSCKKHHF-UHFFFAOYSA-N 2 0 242.326 2.325 20 0 BEADRP CC[NH+](CC)[C@@H]1CCN(c2cc[nH+]cc2)C1 ZINC001336908738 978047820 /nfs/dbraw/zinc/04/78/20/978047820.db2.gz HMVAFFJWCTWEHX-CYBMUJFWSA-N 2 0 219.332 2.002 20 0 BEADRP Cc1cccnc1N1CCC[C@]2(CC[N@@H+](C)C2)C1 ZINC001277708328 978261049 /nfs/dbraw/zinc/26/10/49/978261049.db2.gz SOBZVVDMCIRUJF-OAHLLOKOSA-N 2 0 245.370 2.312 20 0 BEADRP C[C@@]1(C[NH3+])CCC[N@H+](Cc2cccnc2)CC1 ZINC001206293310 978291353 /nfs/dbraw/zinc/29/13/53/978291353.db2.gz HGNLYXKOIVIBGJ-CQSZACIVSA-N 2 0 233.359 2.033 20 0 BEADRP CCOC(C)(C)C[N@@H+]1CCC[C@](C)(C[NH3+])CC1 ZINC001206295677 978300486 /nfs/dbraw/zinc/30/04/86/978300486.db2.gz MWLGOGAIRKNMMA-AWEZNQCLSA-N 2 0 242.407 2.252 20 0 BEADRP Cc1ccnc(N[C@@H]2CC[C@@H]3C[N@@H+](C)C[C@H]23)c1 ZINC001337432176 978335556 /nfs/dbraw/zinc/33/55/56/978335556.db2.gz QNETWCAWPSZYDO-FRRDWIJNSA-N 2 0 231.343 2.142 20 0 BEADRP c1cc(N2CCC[C@@H]([NH+]3CCCC3)C2)cc[nH+]1 ZINC001337652088 978441970 /nfs/dbraw/zinc/44/19/70/978441970.db2.gz WRHZVJAQXWQLAP-CQSZACIVSA-N 2 0 231.343 2.146 20 0 BEADRP CCc1ccc(N2CC[C@H](C[NH+](C)C)C2)nc1 ZINC001337914725 978562312 /nfs/dbraw/zinc/56/23/12/978562312.db2.gz NBUMEOSEYJVSEB-CYBMUJFWSA-N 2 0 233.359 2.032 20 0 BEADRP CC[C@@H]1CC[C@H]([NH2+]C[C@@H]2CC[N@H+](C)C2)C1 ZINC000070643335 978861559 /nfs/dbraw/zinc/86/15/59/978861559.db2.gz DBURVKNRIMMDND-AGIUHOORSA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@@H]1CC[C@@H]([NH2+]CCCC[NH+](C)C)C1 ZINC000070643871 978862067 /nfs/dbraw/zinc/86/20/67/978862067.db2.gz ACOZKZUVNMIGQE-CHWSQXEVSA-N 2 0 212.381 2.497 20 0 BEADRP CCSCC[NH+]1CCC2(CC[N@H+](C)C2)CC1 ZINC001277914123 978945255 /nfs/dbraw/zinc/94/52/55/978945255.db2.gz QGDFUKHBTASPOA-UHFFFAOYSA-N 2 0 242.432 2.157 20 0 BEADRP CC1(CN2CC[C@H]3C[NH2+]C[C@H]32)CCCCC1 ZINC001235007814 978949801 /nfs/dbraw/zinc/94/98/01/978949801.db2.gz ROBOZTOZFXBEJB-QWHCGFSZSA-N 2 0 222.376 2.251 20 0 BEADRP c1c[nH]c(C[NH+]2CCC([C@@H]3CCCC[NH2+]3)CC2)c1 ZINC001235230599 978998628 /nfs/dbraw/zinc/99/86/28/978998628.db2.gz PZNZHWOLEXCSQS-HNNXBMFYSA-N 2 0 247.386 2.369 20 0 BEADRP CC(C)Cc1ccc(C[N@H+]2C[C@@H]3[C@@H]([NH3+])[C@@H]3C2)cc1 ZINC001235210058 978998648 /nfs/dbraw/zinc/99/86/48/978998648.db2.gz JQSNJBVCVXBRMA-ZSHCYNCHSA-N 2 0 244.382 2.274 20 0 BEADRP [NH3+]CCCC[N@@H+]1CCC[C@H](Oc2ccccc2)C1 ZINC001235690659 979117618 /nfs/dbraw/zinc/11/76/18/979117618.db2.gz GTCDOJHXDMNKMO-HNNXBMFYSA-N 2 0 248.370 2.269 20 0 BEADRP [NH3+]CCCC[N@@H+]1CC[C@H]1COCc1ccccc1 ZINC001235716077 979133615 /nfs/dbraw/zinc/13/36/15/979133615.db2.gz YGRAREBGJVEAPF-HNNXBMFYSA-N 2 0 248.370 2.016 20 0 BEADRP C(CC1CCCC1)C[N@H+]1C[C@H]2C[NH2+]CC[C@@H]2C1 ZINC001235929331 979210244 /nfs/dbraw/zinc/21/02/44/979210244.db2.gz MCKSDXMAFQAWIU-HUUCEWRRSA-N 2 0 236.403 2.498 20 0 BEADRP Cc1ccc(C[N@H+]2C[C@H]3CC[C@@H](C2)[C@@H]3[NH3+])cc1C ZINC001235958461 979226210 /nfs/dbraw/zinc/22/62/10/979226210.db2.gz FGXQPIWLYOTSSI-MUJYYYPQSA-N 2 0 244.382 2.473 20 0 BEADRP [NH3+][C@@]12CC[C@H]1C[N@H+](CCC1CCCCC1)C2 ZINC001235981868 979245099 /nfs/dbraw/zinc/24/50/99/979245099.db2.gz YHJYLFCVUTWSDR-UONOGXRCSA-N 2 0 222.376 2.380 20 0 BEADRP CC/C=C\CCC[N@@H+]1C[C@@H]2CC[C@]2([NH3+])C1 ZINC001235981104 979260161 /nfs/dbraw/zinc/26/01/61/979260161.db2.gz UNFQIVCJVABOMV-LDIIPZEWSA-N 2 0 208.349 2.156 20 0 BEADRP CC(C)CCCN1C[C@H]2CC[C@@H](C1)[NH2+]C2 ZINC001236059888 979347099 /nfs/dbraw/zinc/34/70/99/979347099.db2.gz NEMAVONRMJRUAL-STQMWFEESA-N 2 0 210.365 2.106 20 0 BEADRP Cc1cccc(CN2C[C@H]3CC[C@@H](C2)[NH2+]C3)c1 ZINC001236059533 979349601 /nfs/dbraw/zinc/34/96/01/979349601.db2.gz JHSUPXUZEZECBW-GJZGRUSLSA-N 2 0 230.355 2.179 20 0 BEADRP CC1CC(C[N@@H+]2CCC[C@@H]([NH+](C)C)CC2)C1 ZINC001341375589 979366495 /nfs/dbraw/zinc/36/64/95/979366495.db2.gz OFGMKYZPFJTEOL-JXQTWKCFSA-N 2 0 224.392 2.449 20 0 BEADRP C[C@@H](CN1CCC[C@@H]1C[NH3+])OCc1ccccc1 ZINC001236244656 979461395 /nfs/dbraw/zinc/46/13/95/979461395.db2.gz MWVMMGARSUNSGJ-DZGCQCFKSA-N 2 0 248.370 2.015 20 0 BEADRP C[N@@H+]1CCC[C@@H](CC[NH2+][C@H]2C[C@@H]3CCC[C@@H]32)C1 ZINC001182250406 979481144 /nfs/dbraw/zinc/48/11/44/979481144.db2.gz JKLBVZIULVVZSE-AJNGGQMLSA-N 2 0 236.403 2.497 20 0 BEADRP CCCCC[N@H+]1C[C@@H]2CC[NH2+]CC[C@@H]2C1 ZINC001236315090 979526163 /nfs/dbraw/zinc/52/61/63/979526163.db2.gz VRIGNGLUWLXUIL-BETUJISGSA-N 2 0 210.365 2.108 20 0 BEADRP Cc1cc(C)c(C[N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)[nH]1 ZINC001236317618 979531735 /nfs/dbraw/zinc/53/17/35/979531735.db2.gz ZZDLKBYCXYOVNE-OKILXGFUSA-N 2 0 247.386 2.063 20 0 BEADRP CC1(C)OCCC12CC[NH+](CCCC[NH3+])CC2 ZINC001236433528 979594291 /nfs/dbraw/zinc/59/42/91/979594291.db2.gz JNWOHHVCHIBUNU-UHFFFAOYSA-N 2 0 240.391 2.006 20 0 BEADRP C[C@@]1(C[NH3+])CCCC[N@H+](Cc2ccco2)C1 ZINC001206541512 979642818 /nfs/dbraw/zinc/64/28/18/979642818.db2.gz IDCBBULVIDIZOO-ZDUSSCGKSA-N 2 0 222.332 2.231 20 0 BEADRP C[C@H]1C[N@H+](CCCC[NH3+])[C@@H](c2ccccc2)CO1 ZINC001236620239 979681006 /nfs/dbraw/zinc/68/10/06/979681006.db2.gz AUPBZZFXBHVLFA-DZGCQCFKSA-N 2 0 248.370 2.187 20 0 BEADRP CS[C@H](C)CC[N@@H+]1CCC[C@@](C)([NH3+])CC1 ZINC001205254703 979730417 /nfs/dbraw/zinc/73/04/17/979730417.db2.gz ACGQGHGTXOAZFP-VXGBXAGGSA-N 2 0 230.421 2.331 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@](C)([NH3+])CC2)c(C)n1 ZINC001205281645 979890347 /nfs/dbraw/zinc/89/03/47/979890347.db2.gz WWCGDUXZTLZYFR-HNNXBMFYSA-N 2 0 247.386 2.402 20 0 BEADRP Cc1cc(C[N@@H+]2CCC[C@](C)([NH3+])CC2)cnc1C ZINC001205289143 979938314 /nfs/dbraw/zinc/93/83/14/979938314.db2.gz TXRUQLDCDWFIGE-HNNXBMFYSA-N 2 0 247.386 2.402 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H]1C[NH+]2CCC1CC2)C1CCC1 ZINC001184135098 979946970 /nfs/dbraw/zinc/94/69/70/979946970.db2.gz KRJMJUPTUZTPQY-HUUCEWRRSA-N 2 0 236.403 2.497 20 0 BEADRP CCC[N@H+](CCOC)Cc1cccc2c[nH+]cn21 ZINC001238102786 980149247 /nfs/dbraw/zinc/14/92/47/980149247.db2.gz IJWBHCIHWDQMNM-UHFFFAOYSA-N 2 0 247.342 2.193 20 0 BEADRP C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CCCn1cccc1 ZINC001278189359 980163216 /nfs/dbraw/zinc/16/32/16/980163216.db2.gz QEMILPJHDITWFF-GOOCMWNKSA-N 2 0 247.386 2.093 20 0 BEADRP [NH3+]Cc1cccc(C2=CCC[NH2+]CC2)c1F ZINC001238946680 980365066 /nfs/dbraw/zinc/36/50/66/980365066.db2.gz SHGPOQGIQSZGHJ-UHFFFAOYSA-N 2 0 220.291 2.051 20 0 BEADRP C([C@@H]1CC2CCC1CC2)[N@@H+]1CC[C@]2(CC[NH2+]C2)C1 ZINC000691659523 980375965 /nfs/dbraw/zinc/37/59/65/980375965.db2.gz GYRRWGCKKZFABC-CKUJCDMFSA-N 2 0 248.414 2.498 20 0 BEADRP [NH3+]C[C@@H]1CCC[N@H+](C[C@H]2CC3CCC2CC3)C1 ZINC000691663203 980382580 /nfs/dbraw/zinc/38/25/80/980382580.db2.gz RRXRKPZOKDRZIB-OOJKYFRXSA-N 2 0 236.403 2.483 20 0 BEADRP [NH3+]C1(c2ccccc2C2=CCC[NH2+]CC2)CC1 ZINC001238944767 980384863 /nfs/dbraw/zinc/38/48/63/980384863.db2.gz CZGGBEZWDCVDRO-UHFFFAOYSA-N 2 0 228.339 2.401 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H](C)CCC(C)C ZINC001345469981 980615913 /nfs/dbraw/zinc/61/59/13/980615913.db2.gz MNVMCAAXIUNEJW-NEPJUHHUSA-N 2 0 200.370 2.399 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@H](C)c1ccccc1N(C)C ZINC001345484655 980618397 /nfs/dbraw/zinc/61/83/97/980618397.db2.gz YQCGWCLGEFIUFQ-QWHCGFSZSA-N 2 0 249.402 2.401 20 0 BEADRP C/C=C(\NC=[NH2+])c1ccccc1C[NH+](C)C ZINC001239680514 980840375 /nfs/dbraw/zinc/84/03/75/980840375.db2.gz ZOBSPJZHUSGXOA-PQMHYQBVSA-N 2 0 217.316 2.306 20 0 BEADRP C[C@H]1CC[N@H+](Cc2ccc(O)cc2)CC[C@@H]1C[NH3+] ZINC001205603679 981174184 /nfs/dbraw/zinc/17/41/84/981174184.db2.gz RXKGVNRMUVKVBK-GXTWGEPZSA-N 2 0 248.370 2.199 20 0 BEADRP Cc1cccnc1C[N@@H+]1CC[C@@H](C[NH3+])[C@@H](C)CC1 ZINC001205603990 981175676 /nfs/dbraw/zinc/17/56/76/981175676.db2.gz SXSIKGFAADBTGI-JSGCOSHPSA-N 2 0 247.386 2.197 20 0 BEADRP Cc1c[nH]c(C[N@H+]2CC[C@H](C)[C@@H](C[NH3+])CC2)c1C ZINC001205625260 981267889 /nfs/dbraw/zinc/26/78/89/981267889.db2.gz ANUJZYQKDVSXTA-SMDDNHRTSA-N 2 0 249.402 2.438 20 0 BEADRP CO[C@@H]1CC[C@@H]([NH2+][C@@H]2CC[N@H+](C)C(C)(C)C2)C1 ZINC001348100598 981279096 /nfs/dbraw/zinc/27/90/96/981279096.db2.gz YFSFFZCTDWMZJU-JHJVBQTASA-N 2 0 240.391 2.016 20 0 BEADRP C[N@@H+]1CCc2c(F)cc(C3=CC[NH2+]CC3)cc2C1 ZINC001240470828 981407920 /nfs/dbraw/zinc/40/79/20/981407920.db2.gz UTLHWRRVGUYUGO-UHFFFAOYSA-N 2 0 246.329 2.190 20 0 BEADRP C[N@@H+]1CC[C@@H](c2ccc(C3=CC[NH2+]CC3)cc2)C1 ZINC001240470280 981408300 /nfs/dbraw/zinc/40/83/00/981408300.db2.gz LKBLTYBVHNSYET-MRXNPFEDSA-N 2 0 242.366 2.482 20 0 BEADRP C[C@H]1CC[N@H+](Cc2cccc(N)c2)CC[C@@H]1C[NH3+] ZINC001205638816 981411901 /nfs/dbraw/zinc/41/19/01/981411901.db2.gz SERXEMVDSLTTJC-GXTWGEPZSA-N 2 0 247.386 2.076 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CCc1ccc(N(C)C)cc1 ZINC001348841364 981455207 /nfs/dbraw/zinc/45/52/07/981455207.db2.gz SLHLULPHRZTDFP-OLZOCXBDSA-N 2 0 249.402 2.011 20 0 BEADRP C[C@H]([NH3+])c1ccc(C2=CCC[NH2+]C2)cc1 ZINC001240664510 981573429 /nfs/dbraw/zinc/57/34/29/981573429.db2.gz JOQUFSVMYXUMEQ-JTQLQIEISA-N 2 0 202.301 2.083 20 0 BEADRP c1cc([C@@H]2CC[NH2+]C2)ccc1C1=CCC[NH2+]C1 ZINC001240670783 981580724 /nfs/dbraw/zinc/58/07/24/981580724.db2.gz NVISVMPODOJMPX-OAHLLOKOSA-N 2 0 228.339 2.140 20 0 BEADRP CC(C)[C@H](C)[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000159024679 981630849 /nfs/dbraw/zinc/63/08/49/981630849.db2.gz HXWXDTRLERSIDM-LBPRGKRZSA-N 2 0 224.392 2.495 20 0 BEADRP [NH3+]CC[C@H]1CC[N@H+](C[C@@H]2CC3CCC2CC3)C1 ZINC000691700867 982230458 /nfs/dbraw/zinc/23/04/58/982230458.db2.gz KXVHQTBGQPHYSR-SHWKFHJASA-N 2 0 236.403 2.483 20 0 BEADRP COC1(C[N@H+](C)CC(C)(C)C[NH+](C)C)CCC1 ZINC001352114004 982473562 /nfs/dbraw/zinc/47/35/62/982473562.db2.gz XBQHGYGLZUGNCI-UHFFFAOYSA-N 2 0 242.407 2.075 20 0 BEADRP C[NH+](C)/C=C/c1ccncc1C1=CC[N@H+](C)CC1 ZINC001241333020 982497823 /nfs/dbraw/zinc/49/78/23/982497823.db2.gz PHBACMZZBAKAAR-WEVVVXLNSA-N 2 0 243.354 2.333 20 0 BEADRP CC[C@H](C)[C@@H](C)[N@@H+]1C[C@H]2CN(C)C[C@@]2(C)C1 ZINC001198271595 982687608 /nfs/dbraw/zinc/68/76/08/982687608.db2.gz WYVCKAZKYCUFNZ-DGAVXFQQSA-N 2 0 224.392 2.305 20 0 BEADRP C[NH+](C)CCC[NH2+]C/C=C\c1ccc(F)cc1 ZINC001198935146 982877002 /nfs/dbraw/zinc/87/70/02/982877002.db2.gz IHGWFVJRTXOBBT-HYXAFXHYSA-N 2 0 236.334 2.380 20 0 BEADRP Cn1c[nH+]cc1Nc1cccc(C[NH+](C)C)c1 ZINC001201392414 983214700 /nfs/dbraw/zinc/21/47/00/983214700.db2.gz DQGJESWENQPADI-UHFFFAOYSA-N 2 0 230.315 2.225 20 0 BEADRP CC(C)CC[NH+]1CCC(N2CCC2)CC1 ZINC001201630078 983357209 /nfs/dbraw/zinc/35/72/09/983357209.db2.gz KELKQVWRFVHINY-UHFFFAOYSA-N 2 0 210.365 2.203 20 0 BEADRP Cn1cncc1-c1ccc(OCC[NH+](C)C)cc1 ZINC001242148779 983382074 /nfs/dbraw/zinc/38/20/74/983382074.db2.gz AGUZMPXBVALBSD-UHFFFAOYSA-N 2 0 245.326 2.028 20 0 BEADRP CCCC[NH+]1CCN(c2cc[nH+]cc2C)CC1 ZINC001201722631 983429702 /nfs/dbraw/zinc/42/97/02/983429702.db2.gz FDUKMDTYNWTEML-UHFFFAOYSA-N 2 0 233.359 2.312 20 0 BEADRP CCCCC[N@@H+]1C[C@H]2CC[NH+](C)C[C@H]2C1 ZINC001201727051 983433537 /nfs/dbraw/zinc/43/35/37/983433537.db2.gz LWWSSPVABXQRKL-OLZOCXBDSA-N 2 0 210.365 2.060 20 0 BEADRP CCCCC[N@H+]1C[C@H]2[C@H](C1)CCCN2C ZINC001201737331 983444485 /nfs/dbraw/zinc/44/44/85/983444485.db2.gz IQEHDCHAHXTDRX-STQMWFEESA-N 2 0 210.365 2.203 20 0 BEADRP CCCCC[NH+]1C[C@@H]2C[NH+](CC)C[C@H]2C1 ZINC001201744296 983451576 /nfs/dbraw/zinc/45/15/76/983451576.db2.gz GFAUXWGPMLPOKI-STQMWFEESA-N 2 0 210.365 2.060 20 0 BEADRP CCCC[C@H](O)C[N@H+](CCC)CCC[NH+](C)C ZINC001252098411 983554139 /nfs/dbraw/zinc/55/41/39/983554139.db2.gz VFPNWNYQUYFIBM-AWEZNQCLSA-N 2 0 244.423 2.201 20 0 BEADRP C[NH+](C)C[C@@]12C[C@@H]1C[N@H+](CCC(C)(C)C)C2 ZINC001202096787 983557518 /nfs/dbraw/zinc/55/75/18/983557518.db2.gz SMINZXBHGZKVPM-TZMCWYRMSA-N 2 0 224.392 2.306 20 0 BEADRP CN1CCC[C@@H]2C[N@H+](CC3CCCC3)C[C@H]21 ZINC001202190301 983592693 /nfs/dbraw/zinc/59/26/93/983592693.db2.gz NOAQXSRFJVFOON-ZIAGYGMSSA-N 2 0 222.376 2.203 20 0 BEADRP CCC[N@H+]1C[C@@H]2C[NH+](CC3CCCC3)C[C@@H]2C1 ZINC001202189990 983593812 /nfs/dbraw/zinc/59/38/12/983593812.db2.gz ITCUICMXDQUHHD-GASCZTMLSA-N 2 0 236.403 2.450 20 0 BEADRP CC1(C)CCCC[C@@H]1C[N@@H+]1CC[C@@H]2C[NH2+]C[C@@H]21 ZINC000852749667 983758189 /nfs/dbraw/zinc/75/81/89/983758189.db2.gz OXEXSJZIBCCVRD-MCIONIFRSA-N 2 0 236.403 2.497 20 0 BEADRP CC[NH+](CC)Cc1ccc(N[C@@H]2CC[NH2+]C2)cc1 ZINC001573770938 984040810 /nfs/dbraw/zinc/04/08/10/984040810.db2.gz HYJYWPVBZNTVHD-OAHLLOKOSA-N 2 0 247.386 2.302 20 0 BEADRP C[C@@H]1CCC[C@H](C2C[NH+](C[C@]34C[C@H]3C[NH2+]C4)C2)C1 ZINC001576668822 984179933 /nfs/dbraw/zinc/17/99/33/984179933.db2.gz GUPWOZLOJIWQBI-BFJAYTPKSA-N 2 0 248.414 2.354 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@@H](C)Cc1cccc(C)c1 ZINC001577124509 984189239 /nfs/dbraw/zinc/18/92/39/984189239.db2.gz FKISSNVOKIJUKB-JSGCOSHPSA-N 2 0 220.360 2.253 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@H](C)Cc1cccc(C)c1 ZINC001577124511 984190777 /nfs/dbraw/zinc/19/07/77/984190777.db2.gz FKISSNVOKIJUKB-TZMCWYRMSA-N 2 0 220.360 2.253 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@@H](C)Cc1cccc(C)c1 ZINC001577124508 984190914 /nfs/dbraw/zinc/19/09/14/984190914.db2.gz FKISSNVOKIJUKB-GXTWGEPZSA-N 2 0 220.360 2.253 20 0 BEADRP CCC[C@@H]([NH2+]C[C@H]1[C@@H]2C[NH2+]C[C@H]12)C1CCC1 ZINC001577365209 984192260 /nfs/dbraw/zinc/19/22/60/984192260.db2.gz BTHUKIKCXZRXIU-ZOBORPQBSA-N 2 0 222.376 2.010 20 0 BEADRP CCCCC[C@H](O)C[NH2+]C1CC[NH+](CC)CC1 ZINC001253550083 984201346 /nfs/dbraw/zinc/20/13/46/984201346.db2.gz WSIFTSBHDXYAOZ-AWEZNQCLSA-N 2 0 242.407 2.002 20 0 BEADRP C[C@H]1C[N@H+](CC2CCCC2)CCC[C@@H]1C[NH3+] ZINC001205985016 984219812 /nfs/dbraw/zinc/21/98/12/984219812.db2.gz VBHBJELQMSVOCA-GXTWGEPZSA-N 2 0 224.392 2.483 20 0 BEADRP C[C@H]1C[N@H+](Cc2ccccc2)CCC[C@H]1C[NH3+] ZINC001205985225 984301102 /nfs/dbraw/zinc/30/11/02/984301102.db2.gz WODXCDNADFUUSF-ZFWWWQNUSA-N 2 0 232.371 2.493 20 0 BEADRP CC[C@@H](C)C[N@H+]1C[C@@H]2CC[NH+](C)CC[C@@H]2C1 ZINC001275061849 984455053 /nfs/dbraw/zinc/45/50/53/984455053.db2.gz LSYZBOJXHLWSFH-MCIONIFRSA-N 2 0 224.392 2.306 20 0 BEADRP [NH3+]CC1CC[NH+]([C@@H]2C[C@H]2c2cccc(F)c2)CC1 ZINC001580265437 984480874 /nfs/dbraw/zinc/48/08/74/984480874.db2.gz IUEAAJJSLCGMAK-LSDHHAIUSA-N 2 0 248.345 2.352 20 0 BEADRP C[N@H+]1CC[C@H]2C[NH+](CC3CCCC3)C[C@H]2CC1 ZINC001275154015 984508268 /nfs/dbraw/zinc/50/82/68/984508268.db2.gz RSFLFRDSSNOCFM-GASCZTMLSA-N 2 0 236.403 2.450 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[N@H+](C)C[C@@H]21)[C@@H]1C[C@H]1C1CC1 ZINC001308985547 984652960 /nfs/dbraw/zinc/65/29/60/984652960.db2.gz XPHWJMXSDNKKLN-ZCGGHUBDSA-N 2 0 248.414 2.351 20 0 BEADRP C[C@@H]1C[C@H]1C[N@@H+]1CCC[C@@]2(CCC[NH+](C)C2)C1 ZINC001276032785 984788469 /nfs/dbraw/zinc/78/84/69/984788469.db2.gz LNLFTYNRKVMFDL-QLFBSQMISA-N 2 0 236.403 2.450 20 0 BEADRP C[NH2+][C@@]12CC[C@@]([NH2+]Cc3ccc(C)[nH]3)(C1)CCC2 ZINC001276071830 984809676 /nfs/dbraw/zinc/80/96/76/984809676.db2.gz JAQZPKYRVFVEQG-LSDHHAIUSA-N 2 0 247.386 2.478 20 0 BEADRP Cc1ccc(C[NH+]2C[C@@H]3CC[N@H+](C)CC[C@@H]3C2)[nH]1 ZINC001276071985 984811381 /nfs/dbraw/zinc/81/13/81/984811381.db2.gz LINYSXWSEYAVQB-OKILXGFUSA-N 2 0 247.386 2.097 20 0 BEADRP CCNc1ccccc1C[NH2+]C[C@H]1CC[C@@H]([NH3+])C1 ZINC001577902175 984815558 /nfs/dbraw/zinc/81/55/58/984815558.db2.gz KKFUEISYBJZPIW-GXTWGEPZSA-N 2 0 247.386 2.335 20 0 BEADRP [NH3+]CCC[C@H]([NH2+]C[C@H]1CCCO1)c1ccccc1 ZINC000925500805 984827480 /nfs/dbraw/zinc/82/74/80/984827480.db2.gz FSKFXNJYHRDJHC-CABCVRRESA-N 2 0 248.370 2.235 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H]1CCO[C@@H](c2ccccc2)C1 ZINC001256799567 984840627 /nfs/dbraw/zinc/84/06/27/984840627.db2.gz VFPQOPOZDXYIDU-BPLDGKMQSA-N 2 0 248.370 2.091 20 0 BEADRP CCO[C@@H]1CCC[C@H]([NH2+][C@@H]2CCCC[C@H]2[NH3+])C1 ZINC001578098126 984849722 /nfs/dbraw/zinc/84/97/22/984849722.db2.gz SAAVJWNNDJMPJW-REWJHTLYSA-N 2 0 240.391 2.194 20 0 BEADRP CCS[C@H]1CCCC[C@@H]1[NH2+]C[C@H]1CCC[NH2+]1 ZINC001578217074 984869848 /nfs/dbraw/zinc/86/98/48/984869848.db2.gz YXTSNXITQOIOPW-AGIUHOORSA-N 2 0 242.432 2.392 20 0 BEADRP CCC[C@@H](C)n1c(C)nc2c1CC[NH2+]CC2 ZINC001257317676 984892289 /nfs/dbraw/zinc/89/22/89/984892289.db2.gz SKCMFJRFWKRDOY-SNVBAGLBSA-N 2 0 221.348 2.241 20 0 BEADRP CCn1ccc(C[N@H+](C)C[C@H](C[NH3+])C(C)C)c1 ZINC001578350433 984985389 /nfs/dbraw/zinc/98/53/89/984985389.db2.gz OSOWZDPJWPZOTA-AWEZNQCLSA-N 2 0 237.391 2.171 20 0 BEADRP CC[C@@H](C)[NH+]1CCC([NH3+])(Cc2ccccn2)CC1 ZINC001257432889 985007346 /nfs/dbraw/zinc/00/73/46/985007346.db2.gz ASMDFFOAGNSUGI-CYBMUJFWSA-N 2 0 247.386 2.216 20 0 BEADRP C[N@H+](CCCCCC[NH3+])[C@H](CO)CC(C)(C)C ZINC001578465753 985099034 /nfs/dbraw/zinc/09/90/34/985099034.db2.gz LOYRPDXNOVGLDD-ZDUSSCGKSA-N 2 0 244.423 2.234 20 0 BEADRP C[N@H+](Cc1ccc2[nH]ccc2c1)C1CC([NH3+])C1 ZINC001578490144 985121016 /nfs/dbraw/zinc/12/10/16/985121016.db2.gz CNCNDURQFSNCBH-UHFFFAOYSA-N 2 0 229.327 2.089 20 0 BEADRP C[NH+](C)[C@H]1CC[C@H]([NH2+][C@H]2CCCSC2)CC1 ZINC001257664780 985245407 /nfs/dbraw/zinc/24/54/07/985245407.db2.gz XCGXEGGVMVMTAD-AVGNSLFASA-N 2 0 242.432 2.344 20 0 BEADRP CNc1ccccc1C[NH2+][C@H]1C[C@@H]([NH3+])C12CCC2 ZINC001578764562 985327189 /nfs/dbraw/zinc/32/71/89/985327189.db2.gz YROSKFNUNUMIEY-KGLIPLIRSA-N 2 0 245.370 2.088 20 0 BEADRP CNc1ccc(C)cc1C[NH2+][C@H](C)C[C@@H](C)[NH3+] ZINC001578757613 985327299 /nfs/dbraw/zinc/32/72/99/985327299.db2.gz UUDQPNOPIMLVDT-VXGBXAGGSA-N 2 0 235.375 2.252 20 0 BEADRP c1c(C[NH2+][C@]23C[C@H]2CCC3)sc2c1C[NH2+]CC2 ZINC000687980295 985439559 /nfs/dbraw/zinc/43/95/59/985439559.db2.gz GIXCQTXWIJCDSK-BXUZGUMPSA-N 2 0 248.395 2.426 20 0 BEADRP COC[C@H](CC(C)(C)C)[NH2+]CC1(C[NH3+])CCC1 ZINC001578960914 985565579 /nfs/dbraw/zinc/56/55/79/985565579.db2.gz PNWUFPRRDRIGLP-LBPRGKRZSA-N 2 0 242.407 2.156 20 0 BEADRP [NH3+]Cc1cccc(/C=C/C2CC[NH2+]CC2)c1 ZINC001243892456 985567350 /nfs/dbraw/zinc/56/73/50/985567350.db2.gz JFCGSRXKAFGWFJ-SNAWJCMRSA-N 2 0 216.328 2.158 20 0 BEADRP C[NH+](C)Cc1ccc(/C=C/C2CC[NH2+]CC2)nc1 ZINC001243894484 985573302 /nfs/dbraw/zinc/57/33/02/985573302.db2.gz JGXVFDVHFGCLTN-HWKANZROSA-N 2 0 245.370 2.156 20 0 BEADRP C(=C/C1CC[NH2+]CC1)\c1ccc2c(c1)C[NH2+]C2 ZINC001243895352 985576966 /nfs/dbraw/zinc/57/69/66/985576966.db2.gz ANMYAIDXDMAJNF-OWOJBTEDSA-N 2 0 228.339 2.303 20 0 BEADRP C(=C/C1CC[NH2+]CC1)\c1cccc2c[nH+]cn21 ZINC001243897097 985585400 /nfs/dbraw/zinc/58/54/00/985585400.db2.gz NZUIUPWMGOXORR-SNAWJCMRSA-N 2 0 227.311 2.347 20 0 BEADRP [NH3+][C@@H](CC(F)F)C[N@@H+]1CCC[C@@H]1C1CCC1 ZINC000688242617 985589522 /nfs/dbraw/zinc/58/95/22/985589522.db2.gz VHGDVTZWLSGJEG-WDEREUQCSA-N 2 0 232.318 2.233 20 0 BEADRP CSCC[C@@H](C)[NH2+]CCC1CC[NH+](C)CC1 ZINC001258198955 985601264 /nfs/dbraw/zinc/60/12/64/985601264.db2.gz UASZCFLBLCSOKF-GFCCVEGCSA-N 2 0 244.448 2.450 20 0 BEADRP CSCC[C@@H](C)[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC001258199963 985607346 /nfs/dbraw/zinc/60/73/46/985607346.db2.gz LXXROOYSMKWHQP-OLZOCXBDSA-N 2 0 244.448 2.450 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@@H+]1CCC[C@@H]1C1CCC1 ZINC000688287010 985608190 /nfs/dbraw/zinc/60/81/90/985608190.db2.gz BHKDOOPHPXUONQ-KWCYVHTRSA-N 2 0 222.376 2.106 20 0 BEADRP C[C@@H](CC[NH2+]C1CCC(F)(F)CC1)[NH+](C)C ZINC000688319897 985609739 /nfs/dbraw/zinc/60/97/39/985609739.db2.gz WZFDKONTUYQHAZ-JTQLQIEISA-N 2 0 234.334 2.494 20 0 BEADRP C[NH2+]Cc1ccc(C2=C[NH2+]CCC2)cc1 ZINC001243951141 985646929 /nfs/dbraw/zinc/64/69/29/985646929.db2.gz DXHFUYCOVOTJOQ-UHFFFAOYSA-N 2 0 202.301 2.130 20 0 BEADRP C[N@@H+]1CCc2ccc(C3=C[NH2+]CCC3)cc2C1 ZINC001243951979 985657778 /nfs/dbraw/zinc/65/77/78/985657778.db2.gz FDGNIUJDANWJQT-UHFFFAOYSA-N 2 0 228.339 2.399 20 0 BEADRP [NH3+]C1(c2cccc(C3=C[NH2+]CCC3)c2)CC1 ZINC001243952797 985663651 /nfs/dbraw/zinc/66/36/51/985663651.db2.gz UVBCWHVFVCPPLX-UHFFFAOYSA-N 2 0 214.312 2.359 20 0 BEADRP CCSC1(C[NH2+][C@@H]2C[C@H]([NH3+])C23CCC3)CC1 ZINC000691864004 985704127 /nfs/dbraw/zinc/70/41/27/985704127.db2.gz GXZNEULGDRPZCQ-WDEREUQCSA-N 2 0 240.416 2.132 20 0 BEADRP COc1ccc(C)cc1C[NH2+]C[C@H]1CC[C@@H]([NH3+])C1 ZINC001579198186 985821852 /nfs/dbraw/zinc/82/18/52/985821852.db2.gz PGBRDQYVBALIRF-GXTWGEPZSA-N 2 0 248.370 2.221 20 0 BEADRP COc1cccc(C[NH2+]C[C@@H]2CCC[NH2+]C2)c1C ZINC001579277911 985828743 /nfs/dbraw/zinc/82/87/43/985828743.db2.gz ROMYIPSWNWFOKB-CYBMUJFWSA-N 2 0 248.370 2.093 20 0 BEADRP CCCCC[C@@H](CC)[NH2+]CCC[N@H+](C)CCO ZINC001258435284 985880390 /nfs/dbraw/zinc/88/03/90/985880390.db2.gz JVSMJYYTMMEZQA-CQSZACIVSA-N 2 0 244.423 2.249 20 0 BEADRP CCC[NH+]1C[C@@H]2C[NH+]([C@H](C)CC3CC3)C[C@H]2C1 ZINC001258471338 985934504 /nfs/dbraw/zinc/93/45/04/985934504.db2.gz ZERXJVPKXWGKGA-BPLDGKMQSA-N 2 0 236.403 2.449 20 0 BEADRP [NH3+]C[C@H]1CCCC[N@H+](CCCc2cccnc2)C1 ZINC001206607146 985957551 /nfs/dbraw/zinc/95/75/51/985957551.db2.gz WOAHOUZQWWIUBN-OAHLLOKOSA-N 2 0 247.386 2.075 20 0 BEADRP C[C@H]1[NH2+]CC[C@@H]1[NH2+]C1CCc2ccccc2CC1 ZINC001579504972 986044731 /nfs/dbraw/zinc/04/47/31/986044731.db2.gz AYGZFBLSJGOQMP-WBMJQRKESA-N 2 0 244.382 2.274 20 0 BEADRP F[C@H]1CCCC[C@H]1[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC001461679043 986103308 /nfs/dbraw/zinc/10/33/08/986103308.db2.gz UKOXHEIBSBABER-XDQVBPFNSA-N 2 0 240.366 2.484 20 0 BEADRP Cc1cc(C[N@H+]2CCC[C@@H]([C@@H](C)[NH3+])C2)cc(C)n1 ZINC001579598177 986115397 /nfs/dbraw/zinc/11/53/97/986115397.db2.gz GYXKIMXDXZRSCI-UKRRQHHQSA-N 2 0 247.386 2.258 20 0 BEADRP Cc1cccc(C[C@@H](C)[NH2+][C@H]2C[C@@H]([NH3+])C2)c1 ZINC001579759604 986213229 /nfs/dbraw/zinc/21/32/29/986213229.db2.gz PGOYOPYPOPHXDD-BNOWGMLFSA-N 2 0 218.344 2.005 20 0 BEADRP Cc1ccccc1OCC[N@@H+](C)CC1(C[NH3+])CC1 ZINC001579804646 986224834 /nfs/dbraw/zinc/22/48/34/986224834.db2.gz KGGVGFYCFDKLEM-UHFFFAOYSA-N 2 0 248.370 2.045 20 0 BEADRP Cc1ccsc1CC[NH2+][C@H]1CC[C@@H](C[NH3+])C1 ZINC001579816191 986237473 /nfs/dbraw/zinc/23/74/73/986237473.db2.gz YLWYPURZTKDXHG-NEPJUHHUSA-N 2 0 238.400 2.316 20 0 BEADRP C[C@H]1CCC[C@H]([N@H+]2C[C@H]3C[NH+](C)C[C@H]3C2)C1 ZINC001258825486 986288016 /nfs/dbraw/zinc/28/80/16/986288016.db2.gz DBHSJPLDWQMPCL-FQUUOJAGSA-N 2 0 222.376 2.059 20 0 BEADRP Cn1cccc1[C@@H]1CCC[N@@H+]1CC(C)(C)C[NH3+] ZINC001579974622 986378467 /nfs/dbraw/zinc/37/84/67/986378467.db2.gz PMAXNBGIMZGSIO-ZDUSSCGKSA-N 2 0 235.375 2.147 20 0 BEADRP C[NH2+]Cc1cccc(-c2c[nH+]ccc2N)c1F ZINC001244860829 986403877 /nfs/dbraw/zinc/40/38/77/986403877.db2.gz YTXBIEPQDHTVPY-UHFFFAOYSA-N 2 0 231.274 2.020 20 0 BEADRP FC1(F)CC[C@H](CC[NH2+]C[C@@H]2CCC[NH2+]C2)C1 ZINC001580023858 986418712 /nfs/dbraw/zinc/41/87/12/986418712.db2.gz IHIWJKHBRNGZRG-VXGBXAGGSA-N 2 0 246.345 2.401 20 0 BEADRP Fc1ccc(C2([NH2+]CC[C@@H]3CC[NH2+]C3)CC2)cc1 ZINC001580029466 986432265 /nfs/dbraw/zinc/43/22/65/986432265.db2.gz TVYVEZDFVVMKKS-LBPRGKRZSA-N 2 0 248.345 2.404 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]C[C@H]1CCC=CO1 ZINC001462672614 986507778 /nfs/dbraw/zinc/50/77/78/986507778.db2.gz KPWLWWQZVCXEDQ-UONOGXRCSA-N 2 0 240.391 2.389 20 0 BEADRP CC[NH+]1CCC([NH2+]C/C=C/C2CC2)CC1 ZINC000378847500 986617126 /nfs/dbraw/zinc/61/71/26/986617126.db2.gz AWXWYHXBWYGLET-ONEGZZNKSA-N 2 0 208.349 2.027 20 0 BEADRP [NH3+][C@@]12CCC[C@@H]1CN(Cc1ccc(CF)cc1)C2 ZINC001580157747 986630648 /nfs/dbraw/zinc/63/06/48/986630648.db2.gz LRGJACPGFUAPFV-HUUCEWRRSA-N 2 0 248.345 2.469 20 0 BEADRP [NH3+][C@H]1CC12CC([NH2+]CC[C@H]1CC=CCC1)C2 ZINC001580164346 986635347 /nfs/dbraw/zinc/63/53/47/986635347.db2.gz HOSAMTXYTAZUMQ-AHPWVWPOSA-N 2 0 220.360 2.202 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH+]2C[C@H]3[C@H](CC3(F)F)C2)CC1 ZINC001254519832 986652404 /nfs/dbraw/zinc/65/24/04/986652404.db2.gz KMOORLADPNCQHC-UTUOFQBUSA-N 2 0 244.329 2.058 20 0 BEADRP CC1CC[NH+]([C@H]2CCC[N@H+](C)CC2)CC1 ZINC001254517948 986659886 /nfs/dbraw/zinc/65/98/86/986659886.db2.gz ZOTSJWJCVBSSTJ-ZDUSSCGKSA-N 2 0 210.365 2.203 20 0 BEADRP C[C@@H]1CCCC[N@@H+]1[C@H]1CCC[NH+](C)CC1 ZINC001254515817 986661972 /nfs/dbraw/zinc/66/19/72/986661972.db2.gz DKZZQTDVHDGXDD-OLZOCXBDSA-N 2 0 210.365 2.345 20 0 BEADRP CCC[N@H+](CC(C)C)[C@@H](C)CC[NH2+]C ZINC000379592954 986668116 /nfs/dbraw/zinc/66/81/16/986668116.db2.gz ZWGBQAFSQCMWMC-LBPRGKRZSA-N 2 0 200.370 2.352 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]Cc1cccn1C1CC1 ZINC001580262197 986719018 /nfs/dbraw/zinc/71/90/18/986719018.db2.gz QJSJNSUNWJUCON-WFASDCNBSA-N 2 0 247.386 2.430 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+]Cc1cccn1C1CC1 ZINC001580262195 986719762 /nfs/dbraw/zinc/71/97/62/986719762.db2.gz QJSJNSUNWJUCON-IUODEOHRSA-N 2 0 247.386 2.430 20 0 BEADRP [NH3+]CCCCCC[NH2+]C1([C@H]2CCCCO2)CC1 ZINC001580293355 986737502 /nfs/dbraw/zinc/73/75/02/986737502.db2.gz URNVGEKIOJFYAI-CYBMUJFWSA-N 2 0 240.391 2.197 20 0 BEADRP [NH3+]C[C@H]1CC[C@H]([NH2+][C@H]2CCC[C@@H]3C[C@@H]32)CC1 ZINC001580331715 986770072 /nfs/dbraw/zinc/77/00/72/986770072.db2.gz FNCXEMJNGXKSRB-POQQGIQPSA-N 2 0 222.376 2.282 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+]Cc2cccc3c2CCC3)C1 ZINC001580334199 986774532 /nfs/dbraw/zinc/77/45/32/986774532.db2.gz YWGBCPLJQDOFIL-YEORSEQZSA-N 2 0 230.355 2.002 20 0 BEADRP [NH3+]Cc1cccc(C[NH2+][C@H]2C=CCCC2)c1 ZINC001580343069 986780827 /nfs/dbraw/zinc/78/08/27/986780827.db2.gz VXCOMHBNJMEWBD-AWEZNQCLSA-N 2 0 216.328 2.344 20 0 BEADRP C[NH+](C)CCCCC[NH2+]C1CCSCC1 ZINC001255080379 986804919 /nfs/dbraw/zinc/80/49/19/986804919.db2.gz JTIHUQKGDUZQJN-UHFFFAOYSA-N 2 0 230.421 2.204 20 0 BEADRP C[NH+](C)[C@H]1CC[C@H]([NH2+]C2CCSCC2)CC1 ZINC001255084579 986809301 /nfs/dbraw/zinc/80/93/01/986809301.db2.gz UOHRTZDAFCVNOX-AULYBMBSSA-N 2 0 242.432 2.344 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[N@@H+]2CCCC23CCC3)C1 ZINC001580387156 986811767 /nfs/dbraw/zinc/81/17/67/986811767.db2.gz OKKVHLPQJGKPSM-NWDGAFQWSA-N 2 0 208.349 2.132 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[NH2+][C@H]2C[C@@H]3CC[C@@H](C3)C2)C1 ZINC001580389915 986815205 /nfs/dbraw/zinc/81/52/05/986815205.db2.gz XDKAIQVBAMXULQ-MEBFFEOJSA-N 2 0 222.376 2.282 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+]Cc2ccccc2Cl)C1 ZINC001580427494 986845436 /nfs/dbraw/zinc/84/54/36/986845436.db2.gz HVCOWSWZLYVRTB-HOMQSWHASA-N 2 0 224.735 2.167 20 0 BEADRP CC[NH+](CC)[C@H]1CC[C@@H]([NH2+][C@@H](C)COC)CC1 ZINC001255566098 987019972 /nfs/dbraw/zinc/01/99/72/987019972.db2.gz AUOYMOQFZZLGHY-MELADBBJSA-N 2 0 242.407 2.264 20 0 BEADRP Cc1ccc(C[C@@H](C)[NH2+]C[C@@H](C)C[NH3+])cc1 ZINC001255779277 987068430 /nfs/dbraw/zinc/06/84/30/987068430.db2.gz AAQYVGDNTSARTN-QWHCGFSZSA-N 2 0 220.360 2.110 20 0 BEADRP Cc1ccc(C[C@@H](C)[NH2+]C[C@H](C)C[NH3+])cc1 ZINC001255779274 987069468 /nfs/dbraw/zinc/06/94/68/987069468.db2.gz AAQYVGDNTSARTN-CHWSQXEVSA-N 2 0 220.360 2.110 20 0 BEADRP Cc1ccc(C[C@H](C)[NH2+]C[C@@H](C)C[NH3+])cc1 ZINC001255779278 987071600 /nfs/dbraw/zinc/07/16/00/987071600.db2.gz AAQYVGDNTSARTN-STQMWFEESA-N 2 0 220.360 2.110 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]CCn1cccc1 ZINC001255940349 987077087 /nfs/dbraw/zinc/07/70/87/987077087.db2.gz ABMUICMSEUXQGO-AWEZNQCLSA-N 2 0 237.391 2.198 20 0 BEADRP C[C@H]([NH3+])c1ccc(-c2ccc3c[nH+]cn3c2)cn1 ZINC001245899302 987126589 /nfs/dbraw/zinc/12/65/89/987126589.db2.gz FAJCWRKZTIMYJX-JTQLQIEISA-N 2 0 238.294 2.416 20 0 BEADRP CC/C=C\C[NH2+][C@@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C ZINC000693718017 987312988 /nfs/dbraw/zinc/31/29/88/987312988.db2.gz BNLWSIMJJCNHEV-HXLASYRJSA-N 2 0 222.376 2.319 20 0 BEADRP CSC[C@H](C)[NH2+][C@@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C ZINC000693662818 987313165 /nfs/dbraw/zinc/31/31/65/987313165.db2.gz GVEBZRFFQQYYCC-WHOHXGKFSA-N 2 0 242.432 2.104 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@@H]2CCCC[NH2+]C2)[C@@H]1C ZINC000697017862 987342757 /nfs/dbraw/zinc/34/27/57/987342757.db2.gz VAMPCPLXFRXPOG-JHJVBQTASA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@@H]1[C@H](C)CC[N@@H+]1C[C@@H]1CCCC[NH2+]C1 ZINC000697017473 987343454 /nfs/dbraw/zinc/34/34/54/987343454.db2.gz SPJYCACUJLJFEM-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)[N@H+](CC1CC1)C[C@H]1CCCC[NH2+]C1 ZINC000697054075 987348043 /nfs/dbraw/zinc/34/80/43/987348043.db2.gz ZXRVODIFAAVVOS-AWEZNQCLSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CC[C@@H](C)[N@H+](C[C@@H]2CCCC[NH2+]C2)C1 ZINC000697052755 987348672 /nfs/dbraw/zinc/34/86/72/987348672.db2.gz QJPMGXYWYNNUTE-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H](Cc1cccc(F)c1)[NH2+]C1CC[NH2+]CC1 ZINC001246077185 987367750 /nfs/dbraw/zinc/36/77/50/987367750.db2.gz HWEZHIGQGYOVEF-NSHDSACASA-N 2 0 236.334 2.098 20 0 BEADRP CSC(C)(C)C[C@H](C)[NH2+]C1CC[NH2+]CC1 ZINC001246079529 987370525 /nfs/dbraw/zinc/37/05/25/987370525.db2.gz QCNZGDNLLULSLJ-JTQLQIEISA-N 2 0 230.421 2.248 20 0 BEADRP C[N@H+](CC1C[C@H]2CC[C@@H](C1)[NH2+]2)C1CCCC1 ZINC000699309647 987372805 /nfs/dbraw/zinc/37/28/05/987372805.db2.gz BNDJWKFDPFUWRM-YHWZYXNKSA-N 2 0 222.376 2.391 20 0 BEADRP C[C@H]1CCC[C@@H]([NH2+][C@H]2CC[C@H](C)NC2)C1 ZINC001246083815 987382636 /nfs/dbraw/zinc/38/26/36/987382636.db2.gz KHFMBHIDFPGSFM-RVMXOQNASA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H]1CC[C@H](n2ccc3cc(C[NH3+])ccc32)C[NH2+]1 ZINC001246085398 987387353 /nfs/dbraw/zinc/38/73/53/987387353.db2.gz QPKAFUUDYXSVGS-FZMZJTMJSA-N 2 0 243.354 2.413 20 0 BEADRP CCSC[C@H](C)[NH2+]C[C@H]1CC[C@H](C)[NH2+]C1 ZINC001246091239 987396467 /nfs/dbraw/zinc/39/64/67/987396467.db2.gz HJOISSTTYCGNMM-SRVKXCTJSA-N 2 0 230.421 2.106 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@H]2CCCC[C@H]2C)C[NH2+]1 ZINC001246092589 987398052 /nfs/dbraw/zinc/39/80/52/987398052.db2.gz FBJKHLGYWMPOIM-LPWJVIDDSA-N 2 0 210.365 2.153 20 0 BEADRP CCc1ccc(C[C@H](C)[NH2+]CCC[NH2+]C)cc1 ZINC001246105258 987431552 /nfs/dbraw/zinc/43/15/52/987431552.db2.gz AWSGPOFDPBPMBM-ZDUSSCGKSA-N 2 0 234.387 2.379 20 0 BEADRP CCC1CCC([NH2+][C@H]2C[NH2+]C[C@@H]2C)CC1 ZINC001246107227 987437120 /nfs/dbraw/zinc/43/71/20/987437120.db2.gz GYCICCYRIUQONO-WTIISPKJSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+][C@H]2CC[NH2+][C@H](C)C2)C1 ZINC001246117186 987457605 /nfs/dbraw/zinc/45/76/05/987457605.db2.gz OJRMLVOIYNRJNN-LPWJVIDDSA-N 2 0 210.365 2.295 20 0 BEADRP CCC[C@H](CC)[NH2+]C[C@H]1C[NH2+]CC[C@@H]1C ZINC001246116549 987461156 /nfs/dbraw/zinc/46/11/56/987461156.db2.gz WKVDUMBYZJBGHQ-XQQFMLRXSA-N 2 0 212.381 2.400 20 0 BEADRP CC[C@@H]1CC[C@H]([NH2+]C[C@@H]2C[NH2+]CC[C@@H]2C)C1 ZINC001246120678 987467231 /nfs/dbraw/zinc/46/72/31/987467231.db2.gz NJYDTGWSJHWSRW-CRWXNKLISA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1CC[NH2+]C[C@H]1C[NH2+][C@@H]1C[C@@H]2[C@H](C1)C2(C)C ZINC001246121490 987469336 /nfs/dbraw/zinc/46/93/36/987469336.db2.gz RIKVQOMZWZZTJL-ITGHMWBKSA-N 2 0 236.403 2.256 20 0 BEADRP C[C@H]1CC([NH2+][C@H]2C[NH2+]CC23CC3)C[C@H](C)C1 ZINC001246127981 987477008 /nfs/dbraw/zinc/47/70/08/987477008.db2.gz CZPLZYZJSZICFV-WZRBSPASSA-N 2 0 222.376 2.153 20 0 BEADRP FC(F)c1ccccc1C[NH2+]C1CC[NH2+]CC1 ZINC001246134767 987486489 /nfs/dbraw/zinc/48/64/89/987486489.db2.gz NQLKDPICQNFNCT-UHFFFAOYSA-N 2 0 240.297 2.466 20 0 BEADRP C1[C@@H]2C[C@@H]([NH2+][C@H]3CCC4(C3)CC[NH2+]CC4)C[C@H]12 ZINC001246134454 987490434 /nfs/dbraw/zinc/49/04/34/987490434.db2.gz SPBQRFSPJCMFIU-CRWXNKLISA-N 2 0 234.387 2.297 20 0 BEADRP CC1(C)CCC[C@H]([NH2+][C@H]2C[NH2+]CC23CC3)C1 ZINC001246136401 987491477 /nfs/dbraw/zinc/49/14/77/987491477.db2.gz WTSJIXYSZFDKFS-RYUDHWBXSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+][C@H]2CC[C@@H]3C[NH2+]C[C@@H]32)C[C@@H]1C ZINC001246145122 987504747 /nfs/dbraw/zinc/50/47/47/987504747.db2.gz OUBHXAJDEAXXHB-QLKXBERHSA-N 2 0 236.403 2.399 20 0 BEADRP C[C@H]1C[C@H]([NH2+][C@H]2[C@@H]3C[C@H]2C[NH2+]C3)CC(C)(C)C1 ZINC001246145935 987504789 /nfs/dbraw/zinc/50/47/89/987504789.db2.gz GFYFXSDTJBDMMA-PDWCTOEPSA-N 2 0 236.403 2.399 20 0 BEADRP C1[C@@H]2C[NH2+]C[C@H]1[C@H]2[NH2+]C1CCCCCCC1 ZINC001246145141 987505134 /nfs/dbraw/zinc/50/51/34/987505134.db2.gz DMQXDOYGBITOJJ-IMRBUKKESA-N 2 0 222.376 2.297 20 0 BEADRP CC[C@@H](C)C[C@@H](CC)[NH2+][C@H]1[C@@H]2C[C@H]1C[NH2+]C2 ZINC001246151082 987511052 /nfs/dbraw/zinc/51/10/52/987511052.db2.gz VXDHFRHQBWDDPM-RGDJUOJXSA-N 2 0 224.392 2.399 20 0 BEADRP CCCC[C@@H]1C[C@@H]([NH2+]CCCCC[NH3+])CC[NH2+]1 ZINC001246163495 987527177 /nfs/dbraw/zinc/52/71/77/987527177.db2.gz JJMWGLFQMKKJQV-KGLIPLIRSA-N 3 0 241.423 2.016 20 0 BEADRP CCCC[C@H]1C[C@@H]([NH2+]CCCCC[NH3+])CC[NH2+]1 ZINC001246163494 987529105 /nfs/dbraw/zinc/52/91/05/987529105.db2.gz JJMWGLFQMKKJQV-KBPBESRZSA-N 3 0 241.423 2.016 20 0 BEADRP C[C@H]1CC[C@@H](n2ccc3ccc(C[NH3+])cc32)C[NH2+]1 ZINC001246170281 987534986 /nfs/dbraw/zinc/53/49/86/987534986.db2.gz QOPBQKRCTRGDKD-SMDDNHRTSA-N 2 0 243.354 2.413 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCCc2cccs2)CC[NH2+]1 ZINC001246171516 987538792 /nfs/dbraw/zinc/53/87/92/987538792.db2.gz WHLQINKITSLFKF-VXGBXAGGSA-N 2 0 238.400 2.411 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]23)C[C@@H]1C ZINC001246178496 987546724 /nfs/dbraw/zinc/54/67/24/987546724.db2.gz OUBHXAJDEAXXHB-ZAQNNHEOSA-N 2 0 236.403 2.399 20 0 BEADRP C[NH2+]CC[C@H](C)[NH2+]C1C2CC3CC(C2)CC1C3 ZINC001246181336 987553805 /nfs/dbraw/zinc/55/38/05/987553805.db2.gz WEHANOKQMNVBLA-GFSREQAASA-N 2 0 236.403 2.399 20 0 BEADRP CC[C@@H](CC(C)C)[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC001246199707 987594841 /nfs/dbraw/zinc/59/48/41/987594841.db2.gz ZDTAHDHVJMODHH-OLZOCXBDSA-N 2 0 212.381 2.400 20 0 BEADRP CC[C@H](CC(C)C)[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC001246199706 987597025 /nfs/dbraw/zinc/59/70/25/987597025.db2.gz ZDTAHDHVJMODHH-CHWSQXEVSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H]1CC[C@@H](NCc2ccc3[nH]ccc3c2)C[NH2+]1 ZINC001246228961 987625712 /nfs/dbraw/zinc/62/57/12/987625712.db2.gz IZVNAZQQSJNWTQ-BXUZGUMPSA-N 2 0 243.354 2.398 20 0 BEADRP CC[C@@H]([NH2+][C@H]1CC[NH2+][C@H](C)C1)c1ccncc1 ZINC001246238571 987638468 /nfs/dbraw/zinc/63/84/68/987638468.db2.gz QACGCKPEFBMGBP-KWCYVHTRSA-N 2 0 233.359 2.263 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[NH2+][C@H](C)C1)c1ccc(O)cc1 ZINC001246272963 987666462 /nfs/dbraw/zinc/66/64/62/987666462.db2.gz NCCXSMJIDDZPCC-YRGRVCCFSA-N 2 0 248.370 2.226 20 0 BEADRP CCC[NH2+]CCN[C@H](C)Cc1cccc(F)c1 ZINC001246271114 987666854 /nfs/dbraw/zinc/66/68/54/987666854.db2.gz QDBQRHHXBWCTKN-GFCCVEGCSA-N 2 0 238.350 2.346 20 0 BEADRP CC[C@@H]1CC(NCCC(C)(C)[NH3+])C[C@@H](CC)[NH2+]1 ZINC001246273711 987670830 /nfs/dbraw/zinc/67/08/30/987670830.db2.gz QNYQVQFZGHGTNS-VXGBXAGGSA-N 2 0 241.423 2.013 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H](c2ccncc2)C2CC2)CC[NH2+]1 ZINC001246279790 987673232 /nfs/dbraw/zinc/67/32/32/987673232.db2.gz QGMYWPLQPMECCO-DFBGVHRSSA-N 2 0 245.370 2.263 20 0 BEADRP Cc1cccc(C(=[NH2+])N[C@@H]2CC[NH2+][C@@H](C)C2)c1 ZINC001246286354 987677676 /nfs/dbraw/zinc/67/76/76/987677676.db2.gz WVPHVKSNOFORRI-WCQYABFASA-N 2 0 231.343 2.050 20 0 BEADRP Cc1cccc(C(=[NH2+])N[C@@H]2CC[C@@H](C)[NH2+]C2)c1 ZINC001246285311 987677908 /nfs/dbraw/zinc/67/79/08/987677908.db2.gz RJACSVCMGLWXEA-DGCLKSJQSA-N 2 0 231.343 2.050 20 0 BEADRP C[C@H]1C[C@@H](N[C@@H]2CCc3ccc(O)cc32)CC[NH2+]1 ZINC001246285036 987679511 /nfs/dbraw/zinc/67/95/11/987679511.db2.gz FDWCCVPCWHXMTQ-ITDIGPHOSA-N 2 0 246.354 2.110 20 0 BEADRP CC[NH+](CC)C1CC[NH+](C[C@H]2C[C@@H]2C)CC1 ZINC001116758680 987698663 /nfs/dbraw/zinc/69/86/63/987698663.db2.gz YYDJJEUGVLXKNQ-QWHCGFSZSA-N 2 0 224.392 2.449 20 0 BEADRP CC[C@@H]([NH3+])CCN[C@@H]1C[C@@H](CC)[NH2+][C@@H](CC)C1 ZINC001246303945 987701865 /nfs/dbraw/zinc/70/18/65/987701865.db2.gz BMKGONXEVGHFFZ-YIYPIFLZSA-N 2 0 241.423 2.013 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2CCSC[C@@H]2C)CC1 ZINC001474376495 987702104 /nfs/dbraw/zinc/70/21/04/987702104.db2.gz OFOKGIWFEYUHRQ-LBPRGKRZSA-N 2 0 242.432 2.156 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@@H](C)Cc1ccc(C)cc1 ZINC001246315102 987720078 /nfs/dbraw/zinc/72/00/78/987720078.db2.gz HFYGSEBLQLLDDY-GXTWGEPZSA-N 2 0 220.360 2.253 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@@H]1CCc2c(C)cccc2C1 ZINC001246315724 987721504 /nfs/dbraw/zinc/72/15/04/987721504.db2.gz VPUGFHTVZIDSJU-UONOGXRCSA-N 2 0 232.371 2.179 20 0 BEADRP C[Si](C)(C)C([NH2+][C@@H]1CC[NH2+]C1)[Si](C)(C)C ZINC001246340326 987749170 /nfs/dbraw/zinc/74/91/70/987749170.db2.gz UGKBYCDPGNBCDF-SNVBAGLBSA-N 2 0 244.531 2.061 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CCCCCCCCO)CC[NH2+]1 ZINC001246340593 987750357 /nfs/dbraw/zinc/75/03/57/987750357.db2.gz IWBZJKRDZQPOMG-KBPBESRZSA-N 2 0 242.407 2.049 20 0 BEADRP CC[N@H+](C[C@H](C)OC)CC1CC[NH+](CC)CC1 ZINC001474537927 987752779 /nfs/dbraw/zinc/75/27/79/987752779.db2.gz QCEYCVJKCZEWKS-ZDUSSCGKSA-N 2 0 242.407 2.075 20 0 BEADRP Fc1cccc2c1C[C@@H](N[C@@H]1CCC[NH2+]C1)CC2 ZINC001246357062 987763523 /nfs/dbraw/zinc/76/35/23/987763523.db2.gz IQEGGOJGVUSXOW-QWHCGFSZSA-N 2 0 248.345 2.025 20 0 BEADRP FC1(F)CCC2(C[C@H]2[NH2+]C2CC[NH2+]CC2)CC1 ZINC001246386911 987779636 /nfs/dbraw/zinc/77/96/36/987779636.db2.gz PZFTYJHFYLJBAR-LLVKDONJSA-N 2 0 244.329 2.296 20 0 BEADRP c1ccc2c(c1)CC[C@@H]2C[NH2+][C@@H]1CCCC[NH2+]C1 ZINC001246418603 987792318 /nfs/dbraw/zinc/79/23/18/987792318.db2.gz DUAZVJBUJIJFOB-HUUCEWRRSA-N 2 0 244.382 2.448 20 0 BEADRP C[C@H]1C[C@H]([NH2+]C2(CC3CC3)CC2)CC[NH2+]1 ZINC001246445155 987801448 /nfs/dbraw/zinc/80/14/48/987801448.db2.gz MYLCSHXSGNBDJQ-CMPLNLGQSA-N 2 0 208.349 2.049 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]C2(CC3CC3)CC2)CC[NH2+]1 ZINC001246445156 987802080 /nfs/dbraw/zinc/80/20/80/987802080.db2.gz MYLCSHXSGNBDJQ-JQWIXIFHSA-N 2 0 208.349 2.049 20 0 BEADRP Cc1ccc(CC[C@@H](C)[NH2+][C@H]2CC23C[NH2+]C3)cc1 ZINC001246445170 987802482 /nfs/dbraw/zinc/80/24/82/987802482.db2.gz NEPOVSUAVOJIFP-HIFRSBDPSA-N 2 0 244.382 2.268 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@H]2Cc3ccc(F)cc3C2)CC[NH2+]1 ZINC001246451894 987809410 /nfs/dbraw/zinc/80/94/10/987809410.db2.gz IFIOPLPUHFROKX-ONERCXAPSA-N 2 0 248.345 2.023 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+]C[C@@H]1C[NH+]2CCC1CC2 ZINC001474735254 987813472 /nfs/dbraw/zinc/81/34/72/987813472.db2.gz MBOYDIIOCOOQEC-MRVWCRGKSA-N 2 0 222.376 2.106 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@H]2C[C@@](C)([NH3+])C2)C[C@@H]1C ZINC001246460739 987818849 /nfs/dbraw/zinc/81/88/49/987818849.db2.gz MUCBLPDSXMTJLN-SJHCENCUSA-N 2 0 210.365 2.281 20 0 BEADRP C[NH2+][C@H]1C[C@H]([NH2+][C@@H](C)CCC=C(C)C)C1 ZINC001246460489 987819988 /nfs/dbraw/zinc/81/99/88/987819988.db2.gz JCMQCZMQVGTARB-AVGNSLFASA-N 2 0 210.365 2.461 20 0 BEADRP C[NH2+][C@H]1C[C@H]([NH2+]C2C[C@H](C)C[C@@H](C)C2)C1 ZINC001246459892 987820819 /nfs/dbraw/zinc/82/08/19/987820819.db2.gz HTBLJIUNSHFWBL-PRULPYPASA-N 2 0 210.365 2.151 20 0 BEADRP CCCCC[C@@H](CC)[NH2+][C@H]1CN[C@H](COC)C1 ZINC001246463843 987822347 /nfs/dbraw/zinc/82/23/47/987822347.db2.gz HQGGQBRCXIEQIO-MCIONIFRSA-N 2 0 242.407 2.312 20 0 BEADRP CC(C)[NH2+]CC[NH2+][C@@H]1CC[C@@H](C)[C@H](C)C1 ZINC001246467631 987826868 /nfs/dbraw/zinc/82/68/68/987826868.db2.gz ZJJFXJNEVGWQBZ-JHJVBQTASA-N 2 0 212.381 2.399 20 0 BEADRP C[C@H]1C[C@H]([NH2+]C[C@@H]2CC[NH2+]C[C@@H]2F)C[C@@H](C)C1 ZINC001246477339 987833889 /nfs/dbraw/zinc/83/38/89/987833889.db2.gz OIRZUGRAXYRXCR-VJTDZRGJSA-N 2 0 242.382 2.348 20 0 BEADRP C[C@H]1CC([NH2+]C[C@@H]2CC[NH2+]C[C@@H]2F)C[C@H](C)C1 ZINC001246477338 987834969 /nfs/dbraw/zinc/83/49/69/987834969.db2.gz OIRZUGRAXYRXCR-NMKXLXIOSA-N 2 0 242.382 2.348 20 0 BEADRP CC[C@@H]1CC[C@H]([NH2+]C[C@@H]2CC[NH2+]C[C@@H]2F)C1 ZINC001246478959 987837940 /nfs/dbraw/zinc/83/79/40/987837940.db2.gz ZUGITFQXVUXFOI-VOAKCMCISA-N 2 0 228.355 2.102 20 0 BEADRP CCCC(C[NH3+])(CCC)N[C@@H]1CC[NH2+][C@@H](C)C1 ZINC001246494050 987847609 /nfs/dbraw/zinc/84/76/09/987847609.db2.gz CTWBEPNOSCACRN-QWHCGFSZSA-N 2 0 241.423 2.014 20 0 BEADRP C[NH2+][C@H]1C[C@@H]([NH2+][C@@H](C)Cc2ccc(C)cc2)C1 ZINC001246499035 987852753 /nfs/dbraw/zinc/85/27/53/987852753.db2.gz RLYQEELPIZHYRM-AEGPPILISA-N 2 0 232.371 2.266 20 0 BEADRP CC[C@H](C)C[C@H](CC)[NH2+]C12CC([NH3+])(C1)C2 ZINC001246506493 987858746 /nfs/dbraw/zinc/85/87/46/987858746.db2.gz WFOVEZBQPWHGSE-ZSVAQUKISA-N 2 0 210.365 2.425 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C23CC([NH3+])(C2)C3)CC(C)(C)C1 ZINC001246506509 987858879 /nfs/dbraw/zinc/85/88/79/987858879.db2.gz WMUPNWIZAFHLDU-UJLSLHKQSA-N 2 0 222.376 2.425 20 0 BEADRP C[C@H]1C[N@@H+]([C@@H]2CCC[C@@H](C)C2)C[C@H]1C[NH3+] ZINC001246539297 987904305 /nfs/dbraw/zinc/90/43/05/987904305.db2.gz HECQLJLNRQBCLU-YVECIDJPSA-N 2 0 210.365 2.092 20 0 BEADRP CC[C@H](CC(C)C)[N@@H+]1C[C@H](C)[C@H](C[NH3+])C1 ZINC001246540991 987910135 /nfs/dbraw/zinc/91/01/35/987910135.db2.gz LITKAQKPZYYPBP-YNEHKIRRSA-N 2 0 212.381 2.338 20 0 BEADRP CC1(C)[C@@H]2C[C@H]([N@@H+]3CCC[C@@H]([NH3+])CC3)C[C@@H]21 ZINC001246543048 987913618 /nfs/dbraw/zinc/91/36/18/987913618.db2.gz RTNFVVZKGHKUHD-FVCCEPFGSA-N 2 0 222.376 2.234 20 0 BEADRP CCCC[C@H](CC)[N@@H+]1CCC[C@@](O)(C[NH3+])CC1 ZINC001246545127 987922953 /nfs/dbraw/zinc/92/29/53/987922953.db2.gz TYZFCTJJCOJLSZ-KBPBESRZSA-N 2 0 242.407 2.131 20 0 BEADRP CO[C@@H]1CCC[C@H]([N@@H+]2CCC[C@](C)([NH3+])CC2)C1 ZINC001246546814 987924956 /nfs/dbraw/zinc/92/49/56/987924956.db2.gz AKRHKGCNEADANT-MJBXVCDLSA-N 2 0 240.391 2.147 20 0 BEADRP Cc1ccc2c(c1)C[N@H+]([C@@H]1CC[NH2+][C@H](C)C1)CC2 ZINC001246547684 987929117 /nfs/dbraw/zinc/92/91/17/987929117.db2.gz MCZSYUFUBHUXES-CZUORRHYSA-N 2 0 244.382 2.494 20 0 BEADRP CC[C@H]1CC[C@@H]([N@@H+]2C[C@H](C)[C@H](C[NH3+])C2)C1 ZINC001246547748 987930258 /nfs/dbraw/zinc/93/02/58/987930258.db2.gz NBRVWLZDDNQPIM-WUHRBBMRSA-N 2 0 210.365 2.092 20 0 BEADRP CO[C@@H]1CCC[C@H]([N@@H+]2CCC[C@@](C)([NH3+])CC2)C1 ZINC001246546811 987931024 /nfs/dbraw/zinc/93/10/24/987931024.db2.gz AKRHKGCNEADANT-BFHYXJOUSA-N 2 0 240.391 2.147 20 0 BEADRP C[C@H](Cc1cccnc1)[N@@H+]1CCC[C@](C)([NH3+])CC1 ZINC001246548064 987934501 /nfs/dbraw/zinc/93/45/01/987934501.db2.gz FIIQWBBCFLKCNA-HIFRSBDPSA-N 2 0 247.386 2.216 20 0 BEADRP [NH3+][C@@H]1CCC[N@@H+](C2CCC(F)(F)CC2)CC1 ZINC001246549242 987937082 /nfs/dbraw/zinc/93/70/82/987937082.db2.gz WDEBYTHTJWYKFB-SNVBAGLBSA-N 2 0 232.318 2.378 20 0 BEADRP C[C@@H](CC1CC1)[N@@H+]1CCC[C@](C)([NH3+])CC1 ZINC001246548362 987940110 /nfs/dbraw/zinc/94/01/10/987940110.db2.gz GIAITTQLRHXXJW-AAEUAGOBSA-N 2 0 210.365 2.378 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]C[C@H](C)c1ccccc1 ZINC001117954027 987967629 /nfs/dbraw/zinc/96/76/29/987967629.db2.gz XGXFJFZYAUAIRU-STQMWFEESA-N 2 0 220.360 2.378 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]C[C@H](C)c1ccccc1 ZINC001117954026 987969007 /nfs/dbraw/zinc/96/90/07/987969007.db2.gz XGXFJFZYAUAIRU-QWHCGFSZSA-N 2 0 220.360 2.378 20 0 BEADRP CCC[C@@H](CC)[N@@H+]1CCC(F)(F)[C@@H](C[NH3+])C1 ZINC001246558293 987976402 /nfs/dbraw/zinc/97/64/02/987976402.db2.gz OWHGLZLENXWSOS-WDEREUQCSA-N 2 0 234.334 2.481 20 0 BEADRP C[C@@H]1CC[N@@H+](C2CCSCC2)CC[C@H]1C[NH3+] ZINC001246557247 987978068 /nfs/dbraw/zinc/97/80/68/987978068.db2.gz KFXFTQMWIMDWRS-NEPJUHHUSA-N 2 0 242.432 2.189 20 0 BEADRP CCSC[C@H](C)[N@@H+]1CCC[C@@](F)(C[NH3+])CC1 ZINC001246557296 987978706 /nfs/dbraw/zinc/97/87/06/987978706.db2.gz KKUIOOFCGJDLNN-RYUDHWBXSA-N 2 0 248.411 2.281 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]Cc1ccc2c(c1)CCC2 ZINC001118019157 987984960 /nfs/dbraw/zinc/98/49/60/987984960.db2.gz OEMUNEZCWMMKOZ-LBPRGKRZSA-N 2 0 232.371 2.120 20 0 BEADRP CCOCC[C@H](C)[N@@H+]1CCC[C@H](C[NH3+])[C@@H](C)C1 ZINC001246559230 987986465 /nfs/dbraw/zinc/98/64/65/987986465.db2.gz CLPGVGUHFFONKT-MELADBBJSA-N 2 0 242.407 2.108 20 0 BEADRP C[C@@H]1CC[N@@H+]([C@H]2C[C@H]3C[C@H]3C2)CC[C@H]1C[NH3+] ZINC001246561416 987991205 /nfs/dbraw/zinc/99/12/05/987991205.db2.gz SLTVLHYHBFMFMJ-BJJPWKGXSA-N 2 0 222.376 2.092 20 0 BEADRP C[C@@H]1CC[C@H]([N@H+]2CC[C@@H](C[NH3+])[C@@H](C)CC2)C1 ZINC001246561456 987994622 /nfs/dbraw/zinc/99/46/22/987994622.db2.gz SUMGDYFFCQGTCT-RFGFWPKPSA-N 2 0 224.392 2.482 20 0 BEADRP CCC[C@H](C)[N@H+]1CC[C@@H](C[NH3+])[C@@H](C)CC1 ZINC001246561916 987998881 /nfs/dbraw/zinc/99/88/81/987998881.db2.gz USPCKZLEKUXPRL-AVGNSLFASA-N 2 0 212.381 2.482 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H](C)c1ccnc(Cl)c1 ZINC001118059794 987999643 /nfs/dbraw/zinc/99/96/43/987999643.db2.gz STQOJPSTTQKVSU-UWVGGRQHSA-N 2 0 241.766 2.241 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H]1CCC[C@@H]2C[C@@]21C ZINC001118060108 988001312 /nfs/dbraw/zinc/00/13/12/988001312.db2.gz WAQUTABPSOTCKY-LPWJVIDDSA-N 2 0 210.365 2.153 20 0 BEADRP CS[C@H]1CC[C@H]([NH2+]C2CCC(C[NH3+])CC2)C1 ZINC001118118893 988021520 /nfs/dbraw/zinc/02/15/20/988021520.db2.gz KLIHEUQBRCOTFP-TYUFSLCMSA-N 2 0 242.432 2.378 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2CCC[C@@H](C[NH3+])[C@@H](C)C2)C1 ZINC001246567929 988023327 /nfs/dbraw/zinc/02/33/27/988023327.db2.gz NELLSDZIAPVAML-RFGFWPKPSA-N 2 0 224.392 2.482 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H](C)c1sc(C)nc1C ZINC001118121825 988030224 /nfs/dbraw/zinc/03/02/24/988030224.db2.gz JDZXKYFAQAXLTM-RKDXNWHRSA-N 2 0 241.404 2.409 20 0 BEADRP Cc1cccc2c1CC[C@H]([N@@H+]1C[C@@H](C)[C@H]([NH3+])C1)C2 ZINC001246568234 988043511 /nfs/dbraw/zinc/04/35/11/988043511.db2.gz QJCJTLUQMLOXAE-IVMMDQJWSA-N 2 0 244.382 2.131 20 0 BEADRP C[C@H]1CCN([C@@H]2CCC[NH2+]C2)CCC1(F)F ZINC001246569680 988048343 /nfs/dbraw/zinc/04/83/43/988048343.db2.gz RSFOLKJBXAYPHK-WDEREUQCSA-N 2 0 232.318 2.106 20 0 BEADRP C[NH2+]Cc1ccc2c(ccn2[C@H]2CCC[NH2+]C2)c1 ZINC001246572464 988059995 /nfs/dbraw/zinc/05/99/95/988059995.db2.gz HCWJRPDXHKBUOY-AWEZNQCLSA-N 2 0 243.354 2.285 20 0 BEADRP CC(C)OCC[C@@H](C)[N@@H+]1CCCC[C@@H](C[NH3+])C1 ZINC001246584165 988126076 /nfs/dbraw/zinc/12/60/76/988126076.db2.gz SOQUJIIKDGVMBP-KGLIPLIRSA-N 2 0 242.407 2.251 20 0 BEADRP C[C@@H]1C[C@@H]([N@@H+]2CCC[C@H](C)CC2)CC[NH2+]1 ZINC001246584422 988132313 /nfs/dbraw/zinc/13/23/13/988132313.db2.gz ALUDKAYKLDXMEI-XQQFMLRXSA-N 2 0 210.365 2.249 20 0 BEADRP CC1(C)[C@@H]2C[C@@H]([N@@H+]3CCCC[C@H](C[NH3+])C3)C[C@@H]21 ZINC001246584948 988139967 /nfs/dbraw/zinc/13/99/67/988139967.db2.gz XBBWFQLWPIYKRX-SYQHCUMBSA-N 2 0 236.403 2.482 20 0 BEADRP C[C@@H]1CC[C@H]([NH+]2CC(C)(C[NH3+])C2)C[C@@H]1C ZINC001246586497 988146885 /nfs/dbraw/zinc/14/68/85/988146885.db2.gz BFKBSLADLIXBPI-WOPDTQHZSA-N 2 0 210.365 2.092 20 0 BEADRP Cc1ccc2c(c1)C[C@@H]([NH+]1CC(C)(C[NH3+])C1)CC2 ZINC001246591012 988169639 /nfs/dbraw/zinc/16/96/39/988169639.db2.gz UWRDPKVHGTVIND-HNNXBMFYSA-N 2 0 244.382 2.133 20 0 BEADRP C[C@@]1(C[NH3+])CCCC[N@@H+]([C@@H]2CCCOCC2)C1 ZINC001246593916 988185496 /nfs/dbraw/zinc/18/54/96/988185496.db2.gz OTSZHERGZFZJFL-KGLIPLIRSA-N 2 0 240.391 2.006 20 0 BEADRP CCCCCC[C@@H](C)[NH+]1CC(C[NH2+]C)C1 ZINC001246596702 988194445 /nfs/dbraw/zinc/19/44/45/988194445.db2.gz JUEJUTIDBZWFMU-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP CCC1CCC([NH+]2CC(C)(C[NH3+])C2)CC1 ZINC001246600657 988208622 /nfs/dbraw/zinc/20/86/22/988208622.db2.gz UBOGSWHDHDXQOB-UHFFFAOYSA-N 2 0 210.365 2.236 20 0 BEADRP CCSC[C@H](C)[N@@H+]1CCC[C@@]12CCC[NH2+]C2 ZINC001246609524 988226107 /nfs/dbraw/zinc/22/61/07/988226107.db2.gz LUTGYTPXUVUQAR-QWHCGFSZSA-N 2 0 242.432 2.346 20 0 BEADRP CCSC[C@H](C)[N@@H+]1CCC[C@]12CCC[NH2+]C2 ZINC001246609525 988232139 /nfs/dbraw/zinc/23/21/39/988232139.db2.gz LUTGYTPXUVUQAR-STQMWFEESA-N 2 0 242.432 2.346 20 0 BEADRP CC(C)CCC[C@@H](C)N1CC2(C[NH2+]C2)C1 ZINC001246611246 988233609 /nfs/dbraw/zinc/23/36/09/988233609.db2.gz BMGKWOAPJMZTSC-GFCCVEGCSA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@@H](CC(C)C)[NH+]1CC2(C1)CCC[NH2+]C2 ZINC001246619051 988268336 /nfs/dbraw/zinc/26/83/36/988268336.db2.gz KQNSWGZPBLUOKC-ZDUSSCGKSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@H](CC(C)C)[NH+]1CC2(C1)CCC[NH2+]C2 ZINC001246619050 988271737 /nfs/dbraw/zinc/27/17/37/988271737.db2.gz KQNSWGZPBLUOKC-CYBMUJFWSA-N 2 0 224.392 2.497 20 0 BEADRP CCCC[C@H](CCC)[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC001246624469 988280340 /nfs/dbraw/zinc/28/03/40/988280340.db2.gz NGDMWGNDPJPUAK-MJBXVCDLSA-N 2 0 224.392 2.497 20 0 BEADRP CCC[C@H](CC)[NH+]1CCC(F)(C[NH3+])CC1 ZINC001246624819 988286013 /nfs/dbraw/zinc/28/60/13/988286013.db2.gz FRBCVYVPYAJKHJ-NSHDSACASA-N 2 0 216.344 2.328 20 0 BEADRP CCCC[C@H](CC)[N@@H+]1CC[C@@H]2[NH2+]CC[C@H]21 ZINC001246627983 988299687 /nfs/dbraw/zinc/29/96/87/988299687.db2.gz BLWVYKGJPCPNQT-RWMBFGLXSA-N 2 0 210.365 2.391 20 0 BEADRP C[C@@H]1CC([N@@H+]2CC[C@@H]3[NH2+]CC[C@H]32)C[C@@H](C)C1 ZINC001246632908 988306750 /nfs/dbraw/zinc/30/67/50/988306750.db2.gz ISDJJFXQPGHPOI-AUZPSNTRSA-N 2 0 222.376 2.247 20 0 BEADRP C[C@H]1CC([N@@H+]2CC[C@@H]3[NH2+]CC[C@H]32)C[C@H](C)C1 ZINC001246632912 988310106 /nfs/dbraw/zinc/31/01/06/988310106.db2.gz ISDJJFXQPGHPOI-MHDGFBEUSA-N 2 0 222.376 2.247 20 0 BEADRP FC1(F)CCC(N2CC[C@@H]3[NH2+]CC[C@H]32)CC1 ZINC001246633128 988313113 /nfs/dbraw/zinc/31/31/13/988313113.db2.gz JQKYMXZMGSVNOT-WDEREUQCSA-N 2 0 230.302 2.001 20 0 BEADRP C[C@@H]1CC([N@@H+]2CC[C@H]3C[NH2+]C[C@H]32)C[C@@H](C)C1 ZINC001246634314 988314633 /nfs/dbraw/zinc/31/46/33/988314633.db2.gz BOUUIINJSAJAFI-ZJQBRPOHSA-N 2 0 222.376 2.105 20 0 BEADRP C[C@H]1CC([N@@H+]2CC[C@H]3C[NH2+]C[C@H]32)C[C@H](C)C1 ZINC001246634313 988317640 /nfs/dbraw/zinc/31/76/40/988317640.db2.gz BOUUIINJSAJAFI-NRWUCQMLSA-N 2 0 222.376 2.105 20 0 BEADRP CCCC[C@H](CC)[N@@H+]1CC[C@H]2[NH2+]CC[C@H]21 ZINC001246634933 988320499 /nfs/dbraw/zinc/32/04/99/988320499.db2.gz BLWVYKGJPCPNQT-YNEHKIRRSA-N 2 0 210.365 2.391 20 0 BEADRP C[C@@H]1CC([N@@H+]2CC[C@@H]3CC[NH2+][C@@H]3C2)C[C@@H](C)C1 ZINC001246633916 988322216 /nfs/dbraw/zinc/32/22/16/988322216.db2.gz FMERGSXVHUKCSD-PWNZVWSESA-N 2 0 236.403 2.495 20 0 BEADRP C[C@@H]1CC[C@H]([N@H+]2C[C@@H]3CC(F)(F)C[C@@H]3C2)C[NH2+]1 ZINC001246640479 988342125 /nfs/dbraw/zinc/34/21/25/988342125.db2.gz UONSFSKAHKTOKM-WYUUTHIRSA-N 2 0 244.329 2.104 20 0 BEADRP CC[C@H](C)OCC[C@H](C)N1CC[C@@H]2[NH2+]CC[C@H]21 ZINC001246641472 988350475 /nfs/dbraw/zinc/35/04/75/988350475.db2.gz IIZLUQXGDFMESW-XDQVBPFNSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@@H]1CC[C@@H]([N@@H+]2CC[C@@H]3C[NH2+]C[C@H]3C2)C[C@@H]1C ZINC001246647336 988364114 /nfs/dbraw/zinc/36/41/14/988364114.db2.gz KROHLJIPCZFNHG-QKGCVVFFSA-N 2 0 236.403 2.352 20 0 BEADRP CC1(C)CCC[C@H]([N@@H+]2C[C@@H]3CC[NH2+][C@@H]3C2)C1 ZINC001246654675 988377454 /nfs/dbraw/zinc/37/74/54/988377454.db2.gz WPEDCILGFNLRPK-RWMBFGLXSA-N 2 0 222.376 2.249 20 0 BEADRP CC(C)C[C@@H](C)C[C@@H](C)[N@H+]1C[C@@H]2[C@@H]([NH3+])[C@@H]2C1 ZINC001246661410 988398386 /nfs/dbraw/zinc/39/83/86/988398386.db2.gz WVMYHYMFPFBHBB-POQQGIQPSA-N 2 0 224.392 2.336 20 0 BEADRP C[C@H]1CC([N@@H+]2CC[C@@H]3C[NH2+]C[C@@H]3C2)C[C@H](C)C1 ZINC001246666411 988404080 /nfs/dbraw/zinc/40/40/80/988404080.db2.gz JKXBESTWCJFNSE-AAVRWANBSA-N 2 0 236.403 2.352 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2CC[C@@H](c3ccncc3)C2)CC[NH2+]1 ZINC001246773700 988453667 /nfs/dbraw/zinc/45/36/67/988453667.db2.gz COTYVIFTYIEHGP-BPLDGKMQSA-N 2 0 245.370 2.011 20 0 BEADRP CCCOC1CC[NH+]([C@H]2CC[NH2+][C@@H](C)C2)CC1 ZINC001246788746 988468709 /nfs/dbraw/zinc/46/87/09/988468709.db2.gz ILBKGFYXUYPZJH-STQMWFEESA-N 2 0 240.391 2.018 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2[C@H](C1)C2(F)F)[C@@H]1CCC[NH2+]1 ZINC001118607848 988476508 /nfs/dbraw/zinc/47/65/08/988476508.db2.gz FROQHWGOKSNIEY-KNZXXDILSA-N 2 0 244.329 2.150 20 0 BEADRP C[C@@H]1C[C@H](N2Cc3cccc(F)c3C2)CC[NH2+]1 ZINC001246822655 988507255 /nfs/dbraw/zinc/50/72/55/988507255.db2.gz MHQYRXXJVDGHES-ZYHUDNBSSA-N 2 0 234.318 2.282 20 0 BEADRP CC(C)CC[C@H](C)[N@@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1 ZINC001246842689 988546614 /nfs/dbraw/zinc/54/66/14/988546614.db2.gz DAGDJKVRDDUYOU-MELADBBJSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1CC[C@@H]([N@H+]2C[C@H]3CC[C@@H](C2)[C@@H]3[NH3+])C[C@H]1C ZINC001246841222 988548193 /nfs/dbraw/zinc/54/81/93/988548193.db2.gz NAUFFWJWDCPYLB-PLJUSGQGSA-N 2 0 236.403 2.480 20 0 BEADRP CCCCC[C@H](C)[N@@H+]1C[C@@H]2CC[NH2+]C[C@H]2C1 ZINC001246845906 988559173 /nfs/dbraw/zinc/55/91/73/988559173.db2.gz NERUPRRCAVXVSR-IHRRRGAJSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1C[C@H]([N@@H+]2C[C@H]3CC[C@]3([NH3+])C2)C[C@@H](C)C1 ZINC001246852225 988570186 /nfs/dbraw/zinc/57/01/86/988570186.db2.gz ICDFBZXQVJUZAV-BJJPWKGXSA-N 2 0 222.376 2.234 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2C[C@@H]3CC[C@@]3([NH3+])C2)C[C@@H]1C ZINC001246856425 988575808 /nfs/dbraw/zinc/57/58/08/988575808.db2.gz XCGMYMWJYUBWPS-IKOXMDCHSA-N 2 0 222.376 2.234 20 0 BEADRP Cc1ccc(C[C@H](C)[N@@H+]2C[C@H]3CC[C@]3([NH3+])C2)cc1 ZINC001246858705 988591800 /nfs/dbraw/zinc/59/18/00/988591800.db2.gz HYAVMZRXHBILKG-IMJJTQAJSA-N 2 0 244.382 2.349 20 0 BEADRP [NH3+][C@]12CC[C@@H]1C[N@@H+](C1CCC3(CC3)CC1)C2 ZINC001246859342 988592592 /nfs/dbraw/zinc/59/25/92/988592592.db2.gz JWNDMUDRULCZPO-RISCZKNCSA-N 2 0 220.360 2.132 20 0 BEADRP C1C[C@H]2C[N@@H+](C3CCCCCC3)C[C@@H]1C[NH2+]2 ZINC001246862936 988607934 /nfs/dbraw/zinc/60/79/34/988607934.db2.gz FMXOJYHWEUSRMH-STQMWFEESA-N 2 0 222.376 2.393 20 0 BEADRP CC[C@H](CC(C)C)[N@@H+]1CC[C@H](C[NH2+]C)C1 ZINC001246866133 988616972 /nfs/dbraw/zinc/61/69/72/988616972.db2.gz ZXTQXFAZDOEERL-CHWSQXEVSA-N 2 0 212.381 2.352 20 0 BEADRP CC1(C)CC[C@H]([N@@H+]2C[C@H]3CC[C@@H](C2)[NH2+]C3)C1 ZINC001246869136 988628893 /nfs/dbraw/zinc/62/88/93/988628893.db2.gz UDPABTPUZJSKJE-AVGNSLFASA-N 2 0 222.376 2.249 20 0 BEADRP CC1(C)[C@@H]2C[C@@H]([N@H+]3C[C@@H]4CC[NH2+]CC[C@@H]4C3)C[C@@H]21 ZINC001246931027 988759723 /nfs/dbraw/zinc/75/97/23/988759723.db2.gz MMZMMYVFDCFOMQ-CUZDEVPKSA-N 2 0 248.414 2.352 20 0 BEADRP CCSC[C@@H](C)[N@H+]1C[C@@H]2CC[NH2+]CC[C@@H]2C1 ZINC001246939701 988769952 /nfs/dbraw/zinc/76/99/52/988769952.db2.gz GVLAVKIRLCSWFQ-UPJWGTAASA-N 2 0 242.432 2.059 20 0 BEADRP Cc1ccc2c(c1)CC[N@@H+]([C@@H]1CC[NH2+][C@H](C)C1)C2 ZINC001246964133 988793355 /nfs/dbraw/zinc/79/33/55/988793355.db2.gz BQPNCDANRVMFON-CZUORRHYSA-N 2 0 244.382 2.494 20 0 BEADRP CC[C@H](N)C[N@H+](C)[C@H](C)CCC[NH+](CC)CC ZINC001246974766 988806885 /nfs/dbraw/zinc/80/68/85/988806885.db2.gz QUIUSHAUDDJGIM-KGLIPLIRSA-N 2 0 243.439 2.166 20 0 BEADRP CC[NH+](CC)C1CC[NH+](C[C@H](C)COC)CC1 ZINC001324346184 988808315 /nfs/dbraw/zinc/80/83/15/988808315.db2.gz XSAKRRHXPGJWIA-ZDUSSCGKSA-N 2 0 242.407 2.075 20 0 BEADRP CC(C)[N@H+](C1CCOCC1)[C@H]1CC[NH2+][C@@H](C)C1 ZINC001246985033 988816609 /nfs/dbraw/zinc/81/66/09/988816609.db2.gz ORVSEZFBDKAZBN-JSGCOSHPSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@@H]1CC[C@H](N2CC[C@H]3[NH2+]CCC[C@@H]3C2)C1 ZINC001247016397 988845274 /nfs/dbraw/zinc/84/52/74/988845274.db2.gz USGLBMIEVVDJPB-YIYPIFLZSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@@H]([NH3+])C[N@@H+]1CCC[C@]1(C)c1ccccc1 ZINC001119347952 988991169 /nfs/dbraw/zinc/99/11/69/988991169.db2.gz UAUSQICEFMZEQO-TZMCWYRMSA-N 2 0 218.344 2.345 20 0 BEADRP CC1(C)C[N@H+](CCCn2ccnc2)C1(C)C ZINC001324903860 989015965 /nfs/dbraw/zinc/01/59/65/989015965.db2.gz FFVFEIPMNJUYTM-UHFFFAOYSA-N 2 0 221.348 2.394 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H]1CCc2ccc(OC)cc21 ZINC001325745313 989249855 /nfs/dbraw/zinc/24/98/55/989249855.db2.gz XBGAVPZIJIGMTC-ABAIWWIYSA-N 2 0 248.370 2.270 20 0 BEADRP CCC(=O)CC[N@@H+](C)[C@@H]1CCN(CC)C[C@@H]1C ZINC001326304738 989476069 /nfs/dbraw/zinc/47/60/69/989476069.db2.gz GJXZPDCBOJTADB-GXTWGEPZSA-N 2 0 240.391 2.018 20 0 BEADRP CCc1cc(N[C@@H]2CCCC[C@@H]2[NH+](C)C)cc[nH+]1 ZINC001326491154 989580264 /nfs/dbraw/zinc/58/02/64/989580264.db2.gz AXOISBUMNZODQJ-CABCVRRESA-N 2 0 247.386 2.351 20 0 BEADRP Cc1c[nH+]ccc1N1CC[NH+](C(C)(C)C)CC1 ZINC001326880173 989756429 /nfs/dbraw/zinc/75/64/29/989756429.db2.gz WBMQFSCMQWGXQA-UHFFFAOYSA-N 2 0 233.359 2.311 20 0 BEADRP CC[NH+](CC)C1CCN(c2cc[nH+]cc2)CC1 ZINC001120780509 989877235 /nfs/dbraw/zinc/87/72/35/989877235.db2.gz ZRCYUZHVYXHZMZ-UHFFFAOYSA-N 2 0 233.359 2.392 20 0 BEADRP C[N@@H+]1CC[C@H]2[C@@H](CCCN2c2cc[nH+]cc2)C1 ZINC001120860872 989930426 /nfs/dbraw/zinc/93/04/26/989930426.db2.gz UVVNCXLHLGVRCM-JSGCOSHPSA-N 2 0 231.343 2.002 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@H]([NH2+]Cc3cccc(F)c3)[C@H]2C1 ZINC001308554303 991035535 /nfs/dbraw/zinc/03/55/35/991035535.db2.gz NVQJHFJYTGZLGU-QEJZJMRPSA-N 2 0 248.345 2.256 20 0 BEADRP C[C@H](Cc1ccco1)[NH+]1CCC2(C[NH+](C)C2)CC1 ZINC001258198658 991116892 /nfs/dbraw/zinc/11/68/92/991116892.db2.gz IZXBBNPCGQMNRM-CYBMUJFWSA-N 2 0 248.370 2.238 20 0 BEADRP CC1(C)CCC[C@@H](NC(=[NH2+])SCC[NH3+])C1 ZINC001258276259 991205608 /nfs/dbraw/zinc/20/56/08/991205608.db2.gz DRYCXSJVUQJVCK-SECBINFHSA-N 2 0 229.393 2.171 20 0 BEADRP C[C@@H]1CC[N@@H+]1Cc1ccc(-n2ccnc2)cc1 ZINC001139355768 991230282 /nfs/dbraw/zinc/23/02/82/991230282.db2.gz APOIBIDXCBUTBG-GFCCVEGCSA-N 2 0 227.311 2.467 20 0 BEADRP CC(C)SCC[NH2+][C@@H]1CC[C@H]2C[N@H+](C)C[C@H]21 ZINC001308984344 991237215 /nfs/dbraw/zinc/23/72/15/991237215.db2.gz HGSBODJXOVUNOB-YNEHKIRRSA-N 2 0 242.432 2.058 20 0 BEADRP CSC(C)(C)C[C@@H](C)[NH2+]C[C@@H]1CC[N@H+](C)C1 ZINC001258317014 991243044 /nfs/dbraw/zinc/24/30/44/991243044.db2.gz VFABOCYNBMXCEC-NEPJUHHUSA-N 2 0 244.448 2.448 20 0 BEADRP CSC(C)(C)C[C@@H](C)[NH2+]CCn1ccnc1 ZINC001258320148 991244354 /nfs/dbraw/zinc/24/43/54/991244354.db2.gz MPYHDEVLFLHEAP-LLVKDONJSA-N 2 0 241.404 2.393 20 0 BEADRP C[C@@H](CC1CC1)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001258449123 991396728 /nfs/dbraw/zinc/39/67/28/991396728.db2.gz VFAFQMCGAVQHBJ-DEQVHRJGSA-N 2 0 222.376 2.390 20 0 BEADRP C[C@H](CC1CC1)[NH2+]Cc1ccccc1C[NH3+] ZINC001258455411 991407181 /nfs/dbraw/zinc/40/71/81/991407181.db2.gz PMLCILCUBZSCNC-LLVKDONJSA-N 2 0 218.344 2.424 20 0 BEADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@H]1CCC[C@H]1C ZINC001560393884 991465489 /nfs/dbraw/zinc/46/54/89/991465489.db2.gz QXDJLXFCICRIKR-MCIONIFRSA-N 2 0 242.407 2.121 20 0 BEADRP C[NH+](C)C[C@@]12C[C@@H]1C[N@@H+]([C@H]1CCC(C)(C)C1)C2 ZINC001258607581 991527738 /nfs/dbraw/zinc/52/77/38/991527738.db2.gz LYVJVFYTOJGFSM-VNHYZAJKSA-N 2 0 236.403 2.449 20 0 BEADRP C[C@@H](Cc1cccnc1)[NH2+]CC(C)(C)C[NH+](C)C ZINC001258611291 991530889 /nfs/dbraw/zinc/53/08/89/991530889.db2.gz IBQRXZRVBSUKKH-ZDUSSCGKSA-N 2 0 249.402 2.190 20 0 BEADRP C[C@@H](Cc1cccnc1)[NH2+]CCC[NH+]1CCCC1 ZINC001258609929 991533049 /nfs/dbraw/zinc/53/30/49/991533049.db2.gz YLSFRPSFVXWWTB-AWEZNQCLSA-N 2 0 247.386 2.088 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)[C@@H](C)Cc1cccnc1 ZINC001258632241 991578963 /nfs/dbraw/zinc/57/89/63/991578963.db2.gz WZBRXNCNBNDSCF-AWEZNQCLSA-N 2 0 249.402 2.286 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCSCC[NH3+])CC(C)(C)C1 ZINC001258690177 991623345 /nfs/dbraw/zinc/62/33/45/991623345.db2.gz PEXOVQATZCRBEV-VXGBXAGGSA-N 2 0 244.448 2.483 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@@H]2C[NH+]3CCC2CC3)C1 ZINC001561033934 991693186 /nfs/dbraw/zinc/69/31/86/991693186.db2.gz AGYHJPYQWTZZLA-BNOWGMLFSA-N 2 0 222.376 2.106 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C[C@@H]2C[NH+]3CCC2CC3)C1 ZINC001561033936 991695970 /nfs/dbraw/zinc/69/59/70/991695970.db2.gz AGYHJPYQWTZZLA-MRVWCRGKSA-N 2 0 222.376 2.106 20 0 BEADRP CCCC[C@H](CO)[NH2+]C1CC[NH+](CCC)CC1 ZINC001258766350 991727997 /nfs/dbraw/zinc/72/79/97/991727997.db2.gz RFSYAEMWYCVBLT-CQSZACIVSA-N 2 0 242.407 2.002 20 0 BEADRP CCC[NH+]1CCC(n2ccc3c2CC[NH2+]C3)CC1 ZINC001258777003 991745109 /nfs/dbraw/zinc/74/51/09/991745109.db2.gz LMHLKKYPSXHFKE-UHFFFAOYSA-N 2 0 247.386 2.181 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H](CO)C(C)C ZINC001258896267 991891718 /nfs/dbraw/zinc/89/17/18/991891718.db2.gz JTWXWDCIRXWHBX-ZIAGYGMSSA-N 2 0 244.423 2.103 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]C1(CO)CCC1 ZINC001258902984 991893803 /nfs/dbraw/zinc/89/38/03/991893803.db2.gz JIQKICBEWCOAOJ-CYBMUJFWSA-N 2 0 242.407 2.002 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@]1(C)CCOC1 ZINC001258904890 991894895 /nfs/dbraw/zinc/89/48/95/991894895.db2.gz MNBSTKUKSMZHOX-KBPBESRZSA-N 2 0 242.407 2.266 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[N@H+](C)CCOC ZINC001258906831 991895179 /nfs/dbraw/zinc/89/51/79/991895179.db2.gz BANLLIDKBKHZSN-ZDUSSCGKSA-N 2 0 230.396 2.075 20 0 BEADRP CCC[C@@H](CO)[NH2+][C@H](C)CCC[NH+](CC)CC ZINC001258900489 991895945 /nfs/dbraw/zinc/89/59/45/991895945.db2.gz NIXJPYREFUOBAA-KGLIPLIRSA-N 2 0 244.423 2.248 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1C[C@@H]2C[C@@H]2C1 ZINC001258909635 991900953 /nfs/dbraw/zinc/90/09/53/991900953.db2.gz HEHDZTGUXXBUNX-MELADBBJSA-N 2 0 224.392 2.449 20 0 BEADRP COC1(C[NH+]2CCC([NH2+]C(C)C)CC2)CCC1 ZINC000362282728 992191327 /nfs/dbraw/zinc/19/13/27/992191327.db2.gz HVULOOUCWOHVRP-UHFFFAOYSA-N 2 0 240.391 2.018 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]C[C@@H](C)C(C)(C)C ZINC001261370458 992275440 /nfs/dbraw/zinc/27/54/40/992275440.db2.gz KEMMTLITTBCYPH-GHMZBOCLSA-N 2 0 200.370 2.256 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]C[C@H](C)C(C)(C)C ZINC001261370460 992275670 /nfs/dbraw/zinc/27/56/70/992275670.db2.gz KEMMTLITTBCYPH-QWRGUYRKSA-N 2 0 200.370 2.256 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H]1CCC[C@@H]1CCCF ZINC001261423751 992292362 /nfs/dbraw/zinc/29/23/62/992292362.db2.gz CWHNTIHFJDETFL-UPJWGTAASA-N 2 0 230.371 2.492 20 0 BEADRP C[NH+](C)CCOc1ccc(C[NH2+]C2(C)CC2)cc1 ZINC001320648495 992294557 /nfs/dbraw/zinc/29/45/57/992294557.db2.gz JBWUVMRUZPPLGH-UHFFFAOYSA-N 2 0 248.370 2.269 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H](C)CSC(C)(C)C ZINC001261423965 992295299 /nfs/dbraw/zinc/29/52/99/992295299.db2.gz JWQXYUOJQMHRRU-MNOVXSKESA-N 2 0 232.437 2.494 20 0 BEADRP [NH3+]CCCC[NH2+]Cc1cccc2c1CCC2 ZINC001261506514 992355073 /nfs/dbraw/zinc/35/50/73/992355073.db2.gz VFNZZUOYAKUOSF-UHFFFAOYSA-N 2 0 218.344 2.004 20 0 BEADRP CCc1ccccc1CC[NH+]1CCC(C[NH3+])CC1 ZINC001573832031 992731869 /nfs/dbraw/zinc/73/18/69/992731869.db2.gz HZRKFKDFLGEGCY-UHFFFAOYSA-N 2 0 246.398 2.462 20 0 BEADRP Cc1occc1C[NH+]1CCC([C@@H]2C[C@H]2[NH3+])CC1 ZINC001574207999 992820064 /nfs/dbraw/zinc/82/00/64/992820064.db2.gz KKOUUCXTHDSPDE-UONOGXRCSA-N 2 0 234.343 2.147 20 0 BEADRP [NH3+][C@H]1C[C@H]1C1CC[NH+](CC2CCCC2)CC1 ZINC001574269514 992834534 /nfs/dbraw/zinc/83/45/34/992834534.db2.gz ZVKAFHBNHCIDKH-KBPBESRZSA-N 2 0 222.376 2.236 20 0 BEADRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccc[nH]1 ZINC001262364341 992861104 /nfs/dbraw/zinc/86/11/04/992861104.db2.gz UBIBHJHQWPDLRW-WODVXLOZSA-N 2 0 233.359 2.291 20 0 BEADRP C1=C(C[N@@H+]2CCC[C@@]3(CC[NH2+]C3)C2)CCC1 ZINC001574773990 992901629 /nfs/dbraw/zinc/90/16/29/992901629.db2.gz IAOCXUKHLZBJFN-AWEZNQCLSA-N 2 0 220.360 2.172 20 0 BEADRP C1=C[C@@H](CCC[NH2+]CC2CC[NH2+]CC2)CC1 ZINC001574775186 992903622 /nfs/dbraw/zinc/90/36/22/992903622.db2.gz XKQSNHGQWKSJKD-CYBMUJFWSA-N 2 0 222.376 2.322 20 0 BEADRP C1CC2(C1)CCC[C@H]2[NH2+][C@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC001574796082 992911442 /nfs/dbraw/zinc/91/14/42/992911442.db2.gz SWNKBHHGQFPTLM-MROQNXINSA-N 2 0 220.360 2.192 20 0 BEADRP C1CC2(C1)CCC[C@@H]2[NH2+][C@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC001574796085 992911960 /nfs/dbraw/zinc/91/19/60/992911960.db2.gz SWNKBHHGQFPTLM-VOAKCMCISA-N 2 0 220.360 2.192 20 0 BEADRP C=C/C=C/CC[NH2+][C@@H]1CC[NH2+]CC[C@@H]1C ZINC001574887728 992935639 /nfs/dbraw/zinc/93/56/39/992935639.db2.gz ASRBXLRMFFLLAJ-QITAHTHBSA-N 2 0 208.349 2.096 20 0 BEADRP CC(C)(C)c1ccc(C[NH2+]C[C@H]2C[C@@H]([NH3+])C2)o1 ZINC001575275222 993004186 /nfs/dbraw/zinc/00/41/86/993004186.db2.gz LAWJNZAOMWXMIH-PHIMTYICSA-N 2 0 236.359 2.404 20 0 BEADRP CC(C)(C[NH3+])C[NH+]1CCC(CCF)CC1 ZINC001575314899 993008383 /nfs/dbraw/zinc/00/83/83/993008383.db2.gz BRXGAOLOCONBGD-UHFFFAOYSA-N 2 0 216.344 2.043 20 0 BEADRP CC(C)(C[NH3+])C[N@@H+]1CCSC2(CCC2)CC1 ZINC001575315722 993011112 /nfs/dbraw/zinc/01/11/12/993011112.db2.gz WSUQWPVMOGNSBT-UHFFFAOYSA-N 2 0 242.432 2.333 20 0 BEADRP CC(C)([NH3+])C[NH2+][C@@H]1CC[C@@H]2CCC[C@H]2C1 ZINC001575357681 993013582 /nfs/dbraw/zinc/01/35/82/993013582.db2.gz DTVBBEXJTBGQPG-SDDRHHMPSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)([NH3+])C[NH2+][C@@H]1CC[C@@H]2CCC[C@@H]2C1 ZINC001575357678 993013927 /nfs/dbraw/zinc/01/39/27/993013927.db2.gz DTVBBEXJTBGQPG-QJPTWQEYSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)(C[NH2+][C@H]1C[C@@H]([NH3+])C1(C)C)CC(F)F ZINC001575334773 993014940 /nfs/dbraw/zinc/01/49/40/993014940.db2.gz SNIGQLWAUPGMDW-BDAKNGLRSA-N 2 0 234.334 2.383 20 0 BEADRP CC(C)[C@@H](C[NH3+])C[NH2+]C[C@H]1C(C)(C)C1(F)F ZINC001575422907 993033859 /nfs/dbraw/zinc/03/38/59/993033859.db2.gz OFXSFZYJSWVVCJ-UWVGGRQHSA-N 2 0 234.334 2.098 20 0 BEADRP CC(C)[C@@H]1[N@H+](CC2(C[NH3+])CCC2)CC1(C)C ZINC001575519980 993062987 /nfs/dbraw/zinc/06/29/87/993062987.db2.gz HSIOHSAZLWELKL-LBPRGKRZSA-N 2 0 224.392 2.482 20 0 BEADRP CC(C)C[C@@H]1CCC[N@H+](C[C@@]23C[C@@H]2C[NH2+]C3)C1 ZINC001575549352 993070376 /nfs/dbraw/zinc/07/03/76/993070376.db2.gz GOHPWCSJTZPCHQ-ZNMIVQPWSA-N 2 0 236.403 2.354 20 0 BEADRP CC(C)C[NH+]1CCC2(C[NH2+][C@H]2C(C)C)CC1 ZINC001575599502 993080784 /nfs/dbraw/zinc/08/07/84/993080784.db2.gz CPJNTZCTBSJCHR-ZDUSSCGKSA-N 2 0 224.392 2.352 20 0 BEADRP CC(C)COc1ccccc1C[NH2+]C/C=C/C[NH3+] ZINC001575617865 993083198 /nfs/dbraw/zinc/08/31/98/993083198.db2.gz UVRNOIPGXCMRSS-AATRIKPKSA-N 2 0 248.370 2.326 20 0 BEADRP CC(C)C[C@@H]1C[C@H]1[NH2+][C@@H]1C[C@@H]([NH3+])C1(C)C ZINC001575633491 993090084 /nfs/dbraw/zinc/09/00/84/993090084.db2.gz BMHFOVHSGNRHMO-DDHJBXDOSA-N 2 0 210.365 2.136 20 0 BEADRP CC(C)[N@H+](Cc1ccccn1)CC1(C[NH3+])CCC1 ZINC001575689219 993095713 /nfs/dbraw/zinc/09/57/13/993095713.db2.gz BLTQXEIXDZANRR-UHFFFAOYSA-N 2 0 247.386 2.421 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]C1CC(OC(C)(C)C)C1 ZINC001575943074 993134575 /nfs/dbraw/zinc/13/45/75/993134575.db2.gz MZHKOEHCPGCZCX-HIFPTAJRSA-N 2 0 242.407 2.440 20 0 BEADRP CC(C)[C@@H](C[NH2+]C[C@H](C)[NH3+])c1ccccc1 ZINC001576159239 993198988 /nfs/dbraw/zinc/19/89/88/993198988.db2.gz OAYYXVKEVKHPMO-GXTWGEPZSA-N 2 0 220.360 2.363 20 0 BEADRP C[C@@H]1CCC[C@@H]([N@@H+]2CCC[C@H]([NH3+])CC2)C1 ZINC000378665198 993199415 /nfs/dbraw/zinc/19/94/15/993199415.db2.gz FQECACHFXDOELQ-FRRDWIJNSA-N 2 0 210.365 2.378 20 0 BEADRP C[C@H]([NH3+])c1ccc(C[NH2+]Cc2cncs2)cc1 ZINC001576167782 993200716 /nfs/dbraw/zinc/20/07/16/993200716.db2.gz GKDMARQPHXKFDB-JTQLQIEISA-N 2 0 247.367 2.453 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1C[C@H]1C1CCCC1)C1C[NH2+]C1 ZINC001576245326 993230130 /nfs/dbraw/zinc/23/01/30/993230130.db2.gz OPDKJEARWLAXRG-JKOKRWQUSA-N 2 0 222.376 2.010 20 0 BEADRP C[C@@H]([NH2+][C@H]1C[C@@H]([NH3+])C1)[C@@H]1C[C@H]1c1cccs1 ZINC001576251373 993232306 /nfs/dbraw/zinc/23/23/06/993232306.db2.gz LPTMWEDKVLULBH-LDMBFOFVSA-N 2 0 236.384 2.319 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[NH2+]C[C@H]1C)[C@@H]1CC2CCC1CC2 ZINC001576252805 993233702 /nfs/dbraw/zinc/23/37/02/993233702.db2.gz TZXOBTRFCQTNRF-JCBPEIEWSA-N 2 0 236.403 2.399 20 0 BEADRP CC1(C)[C@H]([NH3+])C[C@@H]1[NH2+]CC12CCC(CC1)C2 ZINC001576381709 993293355 /nfs/dbraw/zinc/29/33/55/993293355.db2.gz DUXBGGQWKYGNAQ-BEVNXUHPSA-N 2 0 222.376 2.282 20 0 BEADRP CC1(C)[C@H]([NH3+])C[C@H]1[NH2+][C@@H]1CCSC(C)(C)C1 ZINC001576393185 993294333 /nfs/dbraw/zinc/29/43/33/993294333.db2.gz DIVSMHUOXIAOKI-GMTAPVOTSA-N 2 0 242.432 2.376 20 0 BEADRP C[C@@H]1C[C@@H]([N@@H+]2CCCC[C@H](C[NH3+])C2)C[C@H](C)O1 ZINC000379928235 993297363 /nfs/dbraw/zinc/29/73/63/993297363.db2.gz TVMHHFDHKHFVSX-XJFOESAGSA-N 2 0 240.391 2.003 20 0 BEADRP C[C@]1(C[N@@H+]2CCCCC[C@@H]([NH3+])C2)CCCCO1 ZINC001576502662 993324521 /nfs/dbraw/zinc/32/45/21/993324521.db2.gz DVHZOBNXMMAFGJ-ZIAGYGMSSA-N 2 0 240.391 2.149 20 0 BEADRP CC1(C[NH2+]C[C@H]2CCC[NH2+]CC2)CCC1 ZINC001576518588 993327883 /nfs/dbraw/zinc/32/78/83/993327883.db2.gz AXSIPEKLQRTLOM-LBPRGKRZSA-N 2 0 210.365 2.156 20 0 BEADRP C[C@@H]1C[C@H]1[C@@H]1C[C@H]1[NH2+]C[C@H]1CC[NH2+][C@@H](C)C1 ZINC001576597213 993360575 /nfs/dbraw/zinc/36/05/75/993360575.db2.gz DMSMNVUYZDZXBS-GUDWOMEESA-N 2 0 222.376 2.009 20 0 BEADRP C[C@@H]1C[C@@H](CC[NH2+]CC(C)(C)C[NH3+])C[C@H](C)O1 ZINC001576599860 993362599 /nfs/dbraw/zinc/36/25/99/993362599.db2.gz VYKOLVVETDXNML-CLLJXQQHSA-N 2 0 242.407 2.155 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2CC[C@@H](c3ccco3)C2)CC[NH2+]1 ZINC001576598829 993363979 /nfs/dbraw/zinc/36/39/79/993363979.db2.gz OMKDBGBLWYLWNI-MGPQQGTHSA-N 2 0 248.370 2.457 20 0 BEADRP CC1CCC(C)(C[NH2+]CC2C[NH2+]C2)CC1 ZINC001576647324 993381156 /nfs/dbraw/zinc/38/11/56/993381156.db2.gz NXFZRCNHQSVQDP-UHFFFAOYSA-N 2 0 210.365 2.012 20 0 BEADRP C[C@@H]1CCC[C@@H](C[NH2+][C@@H]2C[NH2+]CC2(C)C)C1 ZINC001576678716 993390439 /nfs/dbraw/zinc/39/04/39/993390439.db2.gz OJXYCZHRLQUHSU-JHJVBQTASA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1CCC[C@H](C[NH2+][C@H]2C[NH2+]CC2(C)C)C1 ZINC001576678714 993392198 /nfs/dbraw/zinc/39/21/98/993392198.db2.gz OJXYCZHRLQUHSU-AGIUHOORSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H]1C[C@H]([N@H+]2C[C@@H]3CCCC[C@@H]3C2)CC[NH2+]1 ZINC000381877407 993430304 /nfs/dbraw/zinc/43/03/04/993430304.db2.gz NMNXCDDLJRNACS-IGQOVBAYSA-N 2 0 222.376 2.249 20 0 BEADRP [NH3+][C@H]1CCC[N@H+](CCC2CCCC2)CC1 ZINC000382302649 993447227 /nfs/dbraw/zinc/44/72/27/993447227.db2.gz NVFPKRRBQBNHPH-ZDUSSCGKSA-N 2 0 210.365 2.380 20 0 BEADRP CCCC[C@H](CC)C[NH+]1CC(C[NH2+]C)C1 ZINC000382316577 993449075 /nfs/dbraw/zinc/44/90/75/993449075.db2.gz TURNMDXDXDBDAI-LBPRGKRZSA-N 2 0 212.381 2.354 20 0 BEADRP CCOc1cccnc1N[C@@H]1CCC[C@@H]([NH3+])C1 ZINC000382407075 993459643 /nfs/dbraw/zinc/45/96/43/993459643.db2.gz BMPUBWOEWXPDLJ-GHMZBOCLSA-N 2 0 235.331 2.162 20 0 BEADRP Cc1ccc(N[C@@H]2CCC[C@H]([NH3+])C2)nc1 ZINC000382434508 993459683 /nfs/dbraw/zinc/45/96/83/993459683.db2.gz UHBBORSQYMYUOP-WDEREUQCSA-N 2 0 205.305 2.072 20 0 BEADRP CC[C@@H]1CCCC[C@@H]1C[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001577255365 993566547 /nfs/dbraw/zinc/56/65/47/993566547.db2.gz UXCOCAYRDVZLML-POQQGIQPSA-N 2 0 222.376 2.010 20 0 BEADRP C[C@H]1[NH2+]CCC[C@H]1C[NH2+]C1CCCCC1 ZINC000384288073 993569137 /nfs/dbraw/zinc/56/91/37/993569137.db2.gz VQOBTCLTPZRQQI-NEPJUHHUSA-N 2 0 210.365 2.297 20 0 BEADRP CCC[C@H](C)[NH+]1CCC([C@H]2CC[NH2+]C2)CC1 ZINC001577345400 993582563 /nfs/dbraw/zinc/58/25/63/993582563.db2.gz QPXSRMHKEFBERV-JSGCOSHPSA-N 2 0 224.392 2.497 20 0 BEADRP CCC[C@@H]1CCCC[C@H]1[NH2+]C[C@@H]([NH3+])CCOC ZINC001577377178 993634329 /nfs/dbraw/zinc/63/43/29/993634329.db2.gz IBCZWXSPJRLRQH-HZSPNIEDSA-N 2 0 242.407 2.299 20 0 BEADRP Cc1cccc(C[N@H+]2CC[NH2+]C[C@@H](C)C2)c1C ZINC000385170638 993651270 /nfs/dbraw/zinc/65/12/70/993651270.db2.gz FRFXGLKYLQOONW-GFCCVEGCSA-N 2 0 232.371 2.345 20 0 BEADRP COc1ccc(C[N@@H+]2CCCC[C@H](C[NH3+])C2)cc1 ZINC000386498473 993687212 /nfs/dbraw/zinc/68/72/12/993687212.db2.gz YRHCEPSOMOTCAM-CQSZACIVSA-N 2 0 248.370 2.256 20 0 BEADRP CCCCC[C@H](C)[NH2+]CCSCC[NH3+] ZINC000389693308 993761174 /nfs/dbraw/zinc/76/11/74/993761174.db2.gz AQHKYPBWBNWBHP-NSHDSACASA-N 2 0 218.410 2.237 20 0 BEADRP C[NH+](C)C1CCC([NH2+][C@@H]2CC[C@@H](F)C2)CC1 ZINC000390655798 993800185 /nfs/dbraw/zinc/80/01/85/993800185.db2.gz QPDMOPSHGJAWPA-CQLXCSJHSA-N 2 0 228.355 2.339 20 0 BEADRP [NH3+][C@@H]1CCC[N@H+](CCCc2ccccc2)CC1 ZINC000393181013 993909101 /nfs/dbraw/zinc/90/91/01/993909101.db2.gz BUHYVEYYJDCCCG-OAHLLOKOSA-N 2 0 232.371 2.432 20 0 BEADRP C[C@H]1C[C@@H]([N@@H+]2CCCC(F)(F)CC2)CC[NH2+]1 ZINC000702795778 994051040 /nfs/dbraw/zinc/05/10/40/994051040.db2.gz CHWSYCCGNRHLSC-QWRGUYRKSA-N 2 0 232.318 2.248 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC2(C)CCCC2)CC[NH2+]1 ZINC000821987774 994417732 /nfs/dbraw/zinc/41/77/32/994417732.db2.gz GOPKLBLPXNWZQL-VXGBXAGGSA-N 2 0 210.365 2.297 20 0 BEADRP CC[NH+]1CCC(C[NH2+]C2(C)CC=CC2)CC1 ZINC001621415919 1170802919 /nfs/dbraw/zinc/80/29/19/1170802919.db2.gz NCIAXDFZMZQHAA-UHFFFAOYSA-N 2 0 222.376 2.417 20 0 BEADRP CC1(C)CC[C@@H]([NH2+]C[C@@H]2C[NH+]3CCC2CC3)C1 ZINC001621551536 1170846594 /nfs/dbraw/zinc/84/65/94/1170846594.db2.gz LFRSOUAKCSFMHB-ZIAGYGMSSA-N 2 0 236.403 2.497 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@H]([NH2+][C@H]3CCC34CCC4)[C@H]2C1 ZINC001621570237 1170855160 /nfs/dbraw/zinc/85/51/60/1170855160.db2.gz NZOXIQQEMNPGEH-XUXIUFHCSA-N 2 0 234.387 2.249 20 0 BEADRP C1CC[C@H]2CCC[N@H+]([C@@H]3CCC[NH2+]C3)[C@@H]2C1 ZINC000036827152 1170917784 /nfs/dbraw/zinc/91/77/84/1170917784.db2.gz HBTGAYJPEGRVRI-BFHYXJOUSA-N 2 0 222.376 2.393 20 0 BEADRP C([C@@H]1CCC[NH2+]1)[N@@H+]1CCC[C@@H]2CCCC[C@H]21 ZINC000036827220 1170918676 /nfs/dbraw/zinc/91/86/76/1170918676.db2.gz RYYKXPYZNYPFLF-MELADBBJSA-N 2 0 222.376 2.393 20 0 BEADRP C([C@@H]1CCC[NH2+]1)[N@@H+]1CCC[C@@H]2CCCC[C@@H]21 ZINC000036827221 1170919613 /nfs/dbraw/zinc/91/96/13/1170919613.db2.gz RYYKXPYZNYPFLF-IHRRRGAJSA-N 2 0 222.376 2.393 20 0 BEADRP CCCCC[C@H](C)[NH2+]C[C@H](O)C[NH+](CC)CC ZINC000042229485 1171217911 /nfs/dbraw/zinc/21/79/11/1171217911.db2.gz RUXDSMYUOFBAHQ-KBPBESRZSA-N 2 0 244.423 2.248 20 0 BEADRP Cc1cc(C[NH+]2CCC(C[NH3+])CC2)cc(C)c1O ZINC000044511809 1171386752 /nfs/dbraw/zinc/38/67/52/1171386752.db2.gz BQBNXNIYOAEGIU-UHFFFAOYSA-N 2 0 248.370 2.180 20 0 BEADRP COc1ccc(CC[C@H](C)N2CC[C@H]([NH3+])C2)cc1 ZINC000050228046 1171778535 /nfs/dbraw/zinc/77/85/35/1171778535.db2.gz PXWRKOAPKOUWHX-JSGCOSHPSA-N 2 0 248.370 2.049 20 0 BEADRP CC[C@H]1CO[C@H](C)C[N@@H+]1CC(CC)(CC)C[NH3+] ZINC000051257654 1171887805 /nfs/dbraw/zinc/88/78/05/1171887805.db2.gz SJPFQSAYWLHHBV-OLZOCXBDSA-N 2 0 242.407 2.251 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@@H]2CCC[NH2+]C2)[C@H](C)C1 ZINC000051732102 1171912644 /nfs/dbraw/zinc/91/26/44/1171912644.db2.gz BFYJIJXBFFTRQB-JHJVBQTASA-N 2 0 210.365 2.106 20 0 BEADRP CCC(CC)(CCO)[NH2+]CC[C@H]1CCC[N@@H+]1C ZINC000338369531 168319904 /nfs/dbraw/zinc/31/99/04/168319904.db2.gz TUVHTVFRDFZDNH-CYBMUJFWSA-N 2 0 242.407 2.002 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)C1CCC1 ZINC000322377797 343977777 /nfs/dbraw/zinc/97/77/77/343977777.db2.gz KZXFWZWUQQDDDX-JSGCOSHPSA-N 2 0 224.392 2.497 20 0 BEADRP C(C[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)CC1CC1 ZINC000161703496 538917546 /nfs/dbraw/zinc/91/75/46/538917546.db2.gz PFODZOTXPQGLFC-KBPBESRZSA-N 2 0 222.376 2.393 20 0 BEADRP CC(C)OC[C@H](C)[NH2+]C1CCC([NH+](C)C)CC1 ZINC000421377350 192322953 /nfs/dbraw/zinc/32/29/53/192322953.db2.gz RIJAGJYVRMMRNO-HSBZDZAISA-N 2 0 242.407 2.262 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]Cc1ccc(F)c(F)c1 ZINC000422907630 398157333 /nfs/dbraw/zinc/15/73/33/398157333.db2.gz XGTXIYADKKQZJB-RKDXNWHRSA-N 2 0 228.286 2.180 20 0 BEADRP Cc1cc(C[NH2+][C@H]2CCC[NH2+]CC2)ccc1F ZINC000334846715 178039976 /nfs/dbraw/zinc/03/99/76/178039976.db2.gz KWZGWXNPPPAMBY-ZDUSSCGKSA-N 2 0 236.334 2.366 20 0 BEADRP C[C@H](Cc1ccsc1)[NH2+]CCC[NH2+]C1CC1 ZINC000382548221 398183731 /nfs/dbraw/zinc/18/37/31/398183731.db2.gz QWZOHHNVLSJIHF-LLVKDONJSA-N 2 0 238.400 2.411 20 0 BEADRP CC[N@H+](CC[C@@H]1CCC[NH+]1C)CC1CC1 ZINC000161840370 349511670 /nfs/dbraw/zinc/51/16/70/349511670.db2.gz XMMZLKPHQIELNE-ZDUSSCGKSA-N 2 0 210.365 2.203 20 0 BEADRP C[N@@H+]1CCC[C@H]1CC[NH+]1CC[C@@]2(CC2(F)F)C1 ZINC000649907376 398180742 /nfs/dbraw/zinc/18/07/42/398180742.db2.gz PZEXGHWIESUXNB-NWDGAFQWSA-N 2 0 244.329 2.202 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H]1CC1(C)C ZINC000423021291 398161982 /nfs/dbraw/zinc/16/19/82/398161982.db2.gz BPAJCQQKFLNXGJ-ZWNOBZJWSA-N 2 0 233.359 2.298 20 0 BEADRP CC(C)C[C@@H]([NH3+])C[NH2+][C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000415118351 398163281 /nfs/dbraw/zinc/16/32/81/398163281.db2.gz YBHXJBXROLAKFY-FVCCEPFGSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@@H]1C(C)(C)C)C1C[NH2+]C1 ZINC000423174439 398164040 /nfs/dbraw/zinc/16/40/40/398164040.db2.gz CDKRGHHHZZIYQW-DRZSPHRISA-N 2 0 224.392 2.399 20 0 BEADRP C[C@@H]1CCC[N@H+](C[C@H]2CCC[NH2+]C2)[C@H]1C ZINC000252111298 398185533 /nfs/dbraw/zinc/18/55/33/398185533.db2.gz HUHIKYFQIDCGHS-AGIUHOORSA-N 2 0 210.365 2.106 20 0 BEADRP Cc1cc(F)ccc1C[N@@H+](C)C1CC[NH2+]CC1 ZINC000135464865 178084195 /nfs/dbraw/zinc/08/41/95/178084195.db2.gz NQTUAOISMFEJMY-UHFFFAOYSA-N 2 0 236.334 2.318 20 0 BEADRP Cc1cc(N(C)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc[nH+]1 ZINC000286446882 178097018 /nfs/dbraw/zinc/09/70/18/178097018.db2.gz RRNNOPXHRLWHSD-NNQSOWQGSA-N 2 0 245.370 2.451 20 0 BEADRP C[C@H]1CC[N@H+](CCCC2CC[NH2+]CC2)[C@H]1C ZINC000380602297 398202239 /nfs/dbraw/zinc/20/22/39/398202239.db2.gz HJGSJNOUCVGFNQ-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP CO[C@@H]1CCC[C@H]([NH2+]CC2([NH3+])CCCCC2)C1 ZINC000643496602 398205689 /nfs/dbraw/zinc/20/56/89/398205689.db2.gz CQYMDWSRZVMBPE-QWHCGFSZSA-N 2 0 240.391 2.195 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+]CCC(C)(C)C1CC1 ZINC000336894927 398218105 /nfs/dbraw/zinc/21/81/05/398218105.db2.gz YBVPFLPYMRZCIG-ZDUSSCGKSA-N 2 0 242.407 2.156 20 0 BEADRP Cc1cccnc1[C@@H]([NH2+]C[C@H]1CC[NH2+]C1)C(C)C ZINC000649414607 398218341 /nfs/dbraw/zinc/21/83/41/398218341.db2.gz LNGFWJZYWDATRF-KBPBESRZSA-N 2 0 247.386 2.286 20 0 BEADRP CC(C)(C[NH2+][C@@H]1CCC[C@@H]([NH3+])C1)c1cccnc1 ZINC000584242207 398221551 /nfs/dbraw/zinc/22/15/51/398221551.db2.gz KYONCADIZWHUNZ-ZIAGYGMSSA-N 2 0 247.386 2.219 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@@H]2CC[NH2+]C2)[C@H]2CCCC[C@H]12 ZINC000647880342 398223083 /nfs/dbraw/zinc/22/30/83/398223083.db2.gz JSMBQFLJUPNZAR-TUVASFSCSA-N 2 0 236.403 2.497 20 0 BEADRP CCC(CC)C[N@@H+]1C[C@@H]2CC[C@@H]([NH3+])[C@@H]2C1 ZINC000336673805 168354775 /nfs/dbraw/zinc/35/47/75/168354775.db2.gz GUGATNDWGMWRTQ-YNEHKIRRSA-N 2 0 210.365 2.092 20 0 BEADRP Cc1cccc(OCC[NH2+][C@@](C)(C[NH3+])C2CC2)c1 ZINC000430576961 398230440 /nfs/dbraw/zinc/23/04/40/398230440.db2.gz NHIXGEXJOULXRO-HNNXBMFYSA-N 2 0 248.370 2.091 20 0 BEADRP CC[C@H]1C[N@H+](CCC2CC[NH2+]CC2)CCS1 ZINC000133091492 398230699 /nfs/dbraw/zinc/23/06/99/398230699.db2.gz BFBVNEIQXHMTOT-ZDUSSCGKSA-N 2 0 242.432 2.204 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C2CCC([NH+](C)C)CC2)[C@@H](C)O1 ZINC000421365030 192333501 /nfs/dbraw/zinc/33/35/01/192333501.db2.gz AQQDNBHTNPMVNF-KPHYFBGPSA-N 2 0 240.391 2.015 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C2CCC([NH+](C)C)CC2)[C@H](C)O1 ZINC000421365029 192334196 /nfs/dbraw/zinc/33/41/96/192334196.db2.gz AQQDNBHTNPMVNF-CJQNXBEJSA-N 2 0 240.391 2.015 20 0 BEADRP Cc1cccc(CC[NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)n1 ZINC000280191509 538937134 /nfs/dbraw/zinc/93/71/34/538937134.db2.gz SGBNTLVGKBTOLG-HIFRSBDPSA-N 2 0 247.386 2.005 20 0 BEADRP C[NH+](C)CCc1ccc(C2=CC[NH2+]CC2)cc1 ZINC000649443641 398245300 /nfs/dbraw/zinc/24/53/00/398245300.db2.gz FNLSAJCYZRSHIM-UHFFFAOYSA-N 2 0 230.355 2.167 20 0 BEADRP CC1CC[NH+](C[C@@H]2CC[NH2+][C@H](C)C2)CC1 ZINC000232835468 136229968 /nfs/dbraw/zinc/22/99/68/136229968.db2.gz KXKINBIMLLCKRF-CHWSQXEVSA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)[N@H+](C[C@H]1CC[NH2+]C1)C1CCCC1 ZINC000381557408 398262479 /nfs/dbraw/zinc/26/24/79/398262479.db2.gz PQUNDEAOHVCBCY-LBPRGKRZSA-N 2 0 210.365 2.249 20 0 BEADRP CC[C@@H]1C[N@H+](CC[C@@H]2CCC[NH+]2C)CCS1 ZINC000162099222 349564697 /nfs/dbraw/zinc/56/46/97/349564697.db2.gz WGUJUCNFUCPKTN-QWHCGFSZSA-N 2 0 242.432 2.298 20 0 BEADRP C[C@H](F)CC[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000378766809 346829210 /nfs/dbraw/zinc/82/92/10/346829210.db2.gz YOKOAHKGUVDSAN-NSHDSACASA-N 2 0 228.355 2.199 20 0 BEADRP C[C@@H](F)CC[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000378766808 346829361 /nfs/dbraw/zinc/82/93/61/346829361.db2.gz YOKOAHKGUVDSAN-LLVKDONJSA-N 2 0 228.355 2.199 20 0 BEADRP CC(C)[C@H](C)C[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000251282455 398268548 /nfs/dbraw/zinc/26/85/48/398268548.db2.gz DPVZYFJCQRJZFN-RDBSUJKOSA-N 2 0 224.392 2.495 20 0 BEADRP Cc1ccc2c(c1)CC[C@@H]2[NH2+][C@H](C)C1C[NH2+]C1 ZINC000335602158 136235487 /nfs/dbraw/zinc/23/54/87/136235487.db2.gz XGJBEXOZYHLALW-ABAIWWIYSA-N 2 0 230.355 2.180 20 0 BEADRP C[NH2+]C[C@H]1CCC[N@H+](CCCC(C)C)C1 ZINC000165428657 361841085 /nfs/dbraw/zinc/84/10/85/361841085.db2.gz QGKRRZMQHPDMKR-CYBMUJFWSA-N 2 0 212.381 2.354 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@@H]1CCC[C@@H]1C ZINC000165715490 361844135 /nfs/dbraw/zinc/84/41/35/361844135.db2.gz CERARHALVOMXKN-QWHCGFSZSA-N 2 0 212.381 2.495 20 0 BEADRP CC(C)CC[NH2+][C@H](C)C1CC[NH+](C)CC1 ZINC000037209535 538962087 /nfs/dbraw/zinc/96/20/87/538962087.db2.gz DLSHWGGDQVICBT-GFCCVEGCSA-N 2 0 212.381 2.352 20 0 BEADRP CCC(CC)[NH2+]CC(C)(C)C[NH+](C)C ZINC000019905784 168387121 /nfs/dbraw/zinc/38/71/21/168387121.db2.gz PPGUIADOJYAIAW-UHFFFAOYSA-N 2 0 200.370 2.352 20 0 BEADRP C[C@@H]1CC[C@H](C)[N@H+]1CC[C@@H]1CCC[NH+]1C ZINC000162252238 349621442 /nfs/dbraw/zinc/62/14/42/349621442.db2.gz GTVWDZDQMYCWBA-XQQFMLRXSA-N 2 0 210.365 2.344 20 0 BEADRP CCSCCC[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000401001764 398288568 /nfs/dbraw/zinc/28/85/68/398288568.db2.gz BUDIUFFGIGYKAL-FRRDWIJNSA-N 2 0 242.432 2.107 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+]C1CSC1 ZINC000380335946 538989178 /nfs/dbraw/zinc/98/91/78/538989178.db2.gz PYMWUFNUZMUAPE-NSHDSACASA-N 2 0 230.421 2.202 20 0 BEADRP CCN(CC)C[C@@H](C)[NH2+]C(C1CC1)C1CC1 ZINC000045690738 538993131 /nfs/dbraw/zinc/99/31/31/538993131.db2.gz IRXJADJRKDAFFQ-LLVKDONJSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CSC1(C)C)C1CC[NH+](C)CC1 ZINC000381470405 539001938 /nfs/dbraw/zinc/00/19/38/539001938.db2.gz OGMPNTPZHPBAOX-ZYHUDNBSSA-N 2 0 242.432 2.200 20 0 BEADRP CCN1CCC([NH2+][C@@H]2CCC(F)(F)C2)CC1 ZINC000381655640 539005899 /nfs/dbraw/zinc/00/58/99/539005899.db2.gz SWYGQQRGFIHJCP-LLVKDONJSA-N 2 0 232.318 2.248 20 0 BEADRP CC(C)[C@H]1CC[C@H]1[NH2+]CC1CC[NH+](C)CC1 ZINC000381177208 538995758 /nfs/dbraw/zinc/99/57/58/538995758.db2.gz VJPBIMQZZLQPHR-ZIAGYGMSSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H](C[NH2+]CC1(C)CC1)N1CCC(C)CC1 ZINC000390504878 539022894 /nfs/dbraw/zinc/02/28/94/539022894.db2.gz WOIKDSFQNDILJZ-ZDUSSCGKSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H](F)CC[NH2+][C@H](C)C1CC[NH+](C)CC1 ZINC000382154206 398308011 /nfs/dbraw/zinc/30/80/11/398308011.db2.gz QUGAGRAKGPIZEL-GHMZBOCLSA-N 2 0 216.344 2.054 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCCCO1)[C@@H]1CCCC[NH2+]1 ZINC000385958789 342878342 /nfs/dbraw/zinc/87/83/42/342878342.db2.gz DZGDQUWOSNSQHS-MJBXVCDLSA-N 2 0 240.391 2.066 20 0 BEADRP CC1(C[N@@H+]2CC[C@H](C[NH+]3CCCC3)C2)CC1 ZINC000562364347 323017828 /nfs/dbraw/zinc/01/78/28/323017828.db2.gz SQKFYFVGYDEUSL-CYBMUJFWSA-N 2 0 222.376 2.204 20 0 BEADRP [NH3+]CCC[N@H+](CC1CCCC1)CC1(F)CC1 ZINC000564970580 398332913 /nfs/dbraw/zinc/33/29/13/398332913.db2.gz LQSPKVIYPKETOY-UHFFFAOYSA-N 2 0 228.355 2.330 20 0 BEADRP CCC[C@H](C)[NH2+]CCN(C)[C@@H](C)CC ZINC000053377507 346888070 /nfs/dbraw/zinc/88/80/70/346888070.db2.gz ZMRGFQRRUUOHKN-RYUDHWBXSA-N 2 0 200.370 2.495 20 0 BEADRP C[C@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1cscn1 ZINC000580312083 346893632 /nfs/dbraw/zinc/89/36/32/346893632.db2.gz JBZXBBDNZIAQFR-WDEREUQCSA-N 2 0 239.388 2.326 20 0 BEADRP CSC[C@H](C)[NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000229353135 398342764 /nfs/dbraw/zinc/34/27/64/398342764.db2.gz DJYDSQREWZXZJW-BIMULSAOSA-N 2 0 236.384 2.472 20 0 BEADRP CC[C@@H](C)C[NH2+]CC(C)(C)C[NH+](C)C ZINC000020087873 342968809 /nfs/dbraw/zinc/96/88/09/342968809.db2.gz FURUDYNUKMRHJB-LLVKDONJSA-N 2 0 200.370 2.210 20 0 BEADRP CCc1cc(NCC[N@@H+](C)CC)cc[nH+]1 ZINC000307767299 529555225 /nfs/dbraw/zinc/55/52/25/529555225.db2.gz HKOHZIZFWVBALW-UHFFFAOYSA-N 2 0 207.321 2.008 20 0 BEADRP Cc1cccc(C[NH2+]CCC[NH+](C)C)c1 ZINC000019958154 342964558 /nfs/dbraw/zinc/96/45/58/342964558.db2.gz NWWRXMWBFZOMGA-UHFFFAOYSA-N 2 0 206.333 2.036 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000336683719 346910937 /nfs/dbraw/zinc/91/09/37/346910937.db2.gz ZIJBGEABSBEWRO-XQQFMLRXSA-N 2 0 222.376 2.391 20 0 BEADRP CC1(C)C[C@@H]1[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000309819573 343021714 /nfs/dbraw/zinc/02/17/14/343021714.db2.gz WAGPCRMWGUPDGY-ZDUSSCGKSA-N 2 0 222.376 2.249 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(O)cc2)C1 ZINC000236785582 346917006 /nfs/dbraw/zinc/91/70/06/346917006.db2.gz DRLJPKKIVWTRLW-AWEZNQCLSA-N 2 0 248.370 2.214 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(O)cc2)C1 ZINC000236787898 346918594 /nfs/dbraw/zinc/91/85/94/346918594.db2.gz DRLJPKKIVWTRLW-CQSZACIVSA-N 2 0 248.370 2.214 20 0 BEADRP C[N@H+](CC1(C)CC1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000309508652 259343318 /nfs/dbraw/zinc/34/33/18/259343318.db2.gz OFBSHMHADNFZJO-FOSCPWQOSA-N 2 0 208.349 2.001 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@H]2CSC[C@H]2C)CC1 ZINC000304485098 187224727 /nfs/dbraw/zinc/22/47/27/187224727.db2.gz LTTRBGPCBJSDKB-YPMHNXCESA-N 2 0 242.432 2.200 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)C1CC1 ZINC000400961839 529660365 /nfs/dbraw/zinc/66/03/65/529660365.db2.gz MWWMNFOQJNUIKY-SYQHCUMBSA-N 2 0 222.376 2.153 20 0 BEADRP CC[C@@H](C)[C@H](C)[NH2+]C1CCN(CC)CC1 ZINC000038098013 343063944 /nfs/dbraw/zinc/06/39/44/343063944.db2.gz JCJGIRBUXZFRFE-NEPJUHHUSA-N 2 0 212.381 2.495 20 0 BEADRP CC(C)CC[C@H](C)[NH2+][C@@H]1CC[NH2+]C[C@H]1C ZINC000308846775 346924147 /nfs/dbraw/zinc/92/41/47/346924147.db2.gz LPLUATDLUAEKDU-FRRDWIJNSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@@H]([NH2+]CCCC(F)(F)F)[C@H]1CCCC[NH2+]1 ZINC000386593042 343078870 /nfs/dbraw/zinc/07/88/70/343078870.db2.gz RYXIFBASAVJXLA-NXEZZACHSA-N 2 0 238.297 2.449 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]CC2(C3CC3)CC2)C1 ZINC000236330606 343091704 /nfs/dbraw/zinc/09/17/04/343091704.db2.gz OEGYZXMAGRTABU-RYUDHWBXSA-N 2 0 208.349 2.036 20 0 BEADRP C[C@@H](Cc1ccsc1)[NH2+]C1CC[NH2+]CC1 ZINC000049157303 343093683 /nfs/dbraw/zinc/09/36/83/343093683.db2.gz NPWBJVZCMIOQDK-JTQLQIEISA-N 2 0 224.373 2.021 20 0 BEADRP Cc1ccccc1C[NH2+][C@H]1CCC[NH2+]CC1 ZINC000168730031 136269879 /nfs/dbraw/zinc/26/98/79/136269879.db2.gz VTPCMHPXDOSEGL-AWEZNQCLSA-N 2 0 218.344 2.227 20 0 BEADRP CCOc1cccc(C[N@@H+]2CC[C@@H]([NH3+])C[C@@H]2C)c1 ZINC000131530992 343183775 /nfs/dbraw/zinc/18/37/75/343183775.db2.gz LDDBVEJWLULUKB-GXTWGEPZSA-N 2 0 248.370 2.397 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+]CC1CC[NH2+]CC1 ZINC000094009603 343151633 /nfs/dbraw/zinc/15/16/33/343151633.db2.gz HBGTXRRDNMVNNC-GFCCVEGCSA-N 2 0 236.359 2.190 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]Cc1cccc2cccnc21 ZINC000311239807 136275933 /nfs/dbraw/zinc/27/59/33/136275933.db2.gz VXHVILBLJBFISK-GFCCVEGCSA-N 2 0 243.354 2.452 20 0 BEADRP Cc1cccc(C)c1C[NH2+]CCc1cncn1C ZINC000401787507 343241335 /nfs/dbraw/zinc/24/13/35/343241335.db2.gz AJLJJUQZFNDUEW-UHFFFAOYSA-N 2 0 243.354 2.369 20 0 BEADRP CCC(CC)C[N@@H+]1CCC[C@H](CC[NH3+])C1 ZINC000069723838 343290137 /nfs/dbraw/zinc/29/01/37/343290137.db2.gz FFNYQSKCUKJQAA-CYBMUJFWSA-N 2 0 212.381 2.483 20 0 BEADRP C[N@H+](CCc1ccccc1)C[C@]1(C)CC[NH2+]C1 ZINC000088242803 136285775 /nfs/dbraw/zinc/28/57/75/136285775.db2.gz QKADHFKWNIFCPS-OAHLLOKOSA-N 2 0 232.371 2.161 20 0 BEADRP CC[C@@H](C)C[NH+]1CCC(CC[NH2+]C)CC1 ZINC000069730278 343290217 /nfs/dbraw/zinc/29/02/17/343290217.db2.gz NJWHIXTZGUDOPT-GFCCVEGCSA-N 2 0 212.381 2.354 20 0 BEADRP C[C@@H]1C[C@H]([NH3+])CC[N@@H+]1CCCOc1ccccc1 ZINC000052092375 343300517 /nfs/dbraw/zinc/30/05/17/343300517.db2.gz PNKMOBPFELNHOS-ZIAGYGMSSA-N 2 0 248.370 2.267 20 0 BEADRP CC(C)c1ncc(C[NH2+][C@H](C)C[C@@H](C)[NH3+])s1 ZINC000584053360 343308865 /nfs/dbraw/zinc/30/88/65/343308865.db2.gz IYFOTJWYCYKKSY-NXEZZACHSA-N 2 0 241.404 2.482 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+]CC1CC(F)(F)C1 ZINC000335613055 136295713 /nfs/dbraw/zinc/29/57/13/136295713.db2.gz RWLYBTLHCIWDAM-GXSJLCMTSA-N 2 0 232.318 2.009 20 0 BEADRP CC1(C)CCC([NH2+]CC2([NH3+])CCC2)CC1 ZINC000335647899 136304318 /nfs/dbraw/zinc/30/43/18/136304318.db2.gz CCXMRXSRTMEADN-UHFFFAOYSA-N 2 0 210.365 2.426 20 0 BEADRP CC1(C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)CCC1 ZINC000335654171 136306278 /nfs/dbraw/zinc/30/62/78/136306278.db2.gz LOSICHWJPNMOMU-FOSCPWQOSA-N 2 0 208.349 2.049 20 0 BEADRP Fc1cc(F)cc(CN[C@H]2CCCC[NH2+]C2)c1 ZINC000335642346 136309009 /nfs/dbraw/zinc/30/90/09/136309009.db2.gz IAQICFJMBSNCTB-ZDUSSCGKSA-N 2 0 240.297 2.197 20 0 BEADRP C[C@@H]([NH3+])[C@@H]1CC[N@H+](CC2CCCCC2)C1 ZINC000166224867 136313584 /nfs/dbraw/zinc/31/35/84/136313584.db2.gz CYYCZCKLPMETPY-DGCLKSJQSA-N 2 0 210.365 2.236 20 0 BEADRP Cc1nccn1CCC[N@@H+](C)C[C@@H]1C[C@@H]1C ZINC000349408372 136344501 /nfs/dbraw/zinc/34/45/01/136344501.db2.gz PUZSUGRTCSQHDQ-AAEUAGOBSA-N 2 0 221.348 2.169 20 0 BEADRP CC(C)CC[C@@H](C)[NH2+]CC[NH2+]C(C)C ZINC000053388244 1172027085 /nfs/dbraw/zinc/02/70/85/1172027085.db2.gz AJGZMVNAQFXPDE-GFCCVEGCSA-N 2 0 200.370 2.399 20 0 BEADRP CC[C@@H]1CCC[C@H](C[N@H+]2C[C@H]3C[NH2+]C[C@H]3C2)C1 ZINC000394501529 259360480 /nfs/dbraw/zinc/36/04/80/259360480.db2.gz BHVMEHSVEQMXNE-BARDWOONSA-N 2 0 236.403 2.354 20 0 BEADRP CC1=C[C@@H](C)C[N@H+](CC[C@@H]2CCC[NH+]2C)C1 ZINC000335891855 136358669 /nfs/dbraw/zinc/35/86/69/136358669.db2.gz AYVKIMNBQWTOCX-OCCSQVGLSA-N 2 0 222.376 2.369 20 0 BEADRP C[C@H](c1cccnc1)[NH+]1CCC(C[NH+](C)C)CC1 ZINC000350953507 136366195 /nfs/dbraw/zinc/36/61/95/136366195.db2.gz WJKJJDLJILHVEZ-CYBMUJFWSA-N 2 0 247.386 2.416 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccn(C)c2)[C@@H](C)C1 ZINC000271211008 136375103 /nfs/dbraw/zinc/37/51/03/136375103.db2.gz UMMAGAUKJDAYPU-DZGCQCFKSA-N 2 0 249.402 2.187 20 0 BEADRP C[C@@]1(C[NH3+])CC[N@H+](C/C=C\c2ccccc2)C1 ZINC000310413513 343486776 /nfs/dbraw/zinc/48/67/76/343486776.db2.gz XITDHPRILIATHH-KKTNHOPESA-N 2 0 230.355 2.371 20 0 BEADRP [NH3+]CC[C@H]1CCC[N@H+](CCC2CCC2)C1 ZINC000398616630 488220800 /nfs/dbraw/zinc/22/08/00/488220800.db2.gz CMJNRKNETAWLMU-CYBMUJFWSA-N 2 0 210.365 2.237 20 0 BEADRP [NH3+]CCC[NH2+]C1CCC(C(F)(F)F)CC1 ZINC000082867543 343469631 /nfs/dbraw/zinc/46/96/31/343469631.db2.gz WSDAYVFMVYGMOS-UHFFFAOYSA-N 2 0 224.270 2.046 20 0 BEADRP Cc1c[nH+]ccc1N(C)CC1CC[NH+](C)CC1 ZINC000192565347 365759044 /nfs/dbraw/zinc/75/90/44/365759044.db2.gz PLAQCGCVZRWGCP-UHFFFAOYSA-N 2 0 233.359 2.168 20 0 BEADRP CC[NH+](CC)CC1CC[NH+](CCCOC)CC1 ZINC000047973378 343679027 /nfs/dbraw/zinc/67/90/27/343679027.db2.gz OBINDGJMMXJCDB-UHFFFAOYSA-N 2 0 242.407 2.077 20 0 BEADRP CC1(C)CC(C[NH2+][C@@H]2CCC[C@H]2C[NH3+])C1 ZINC000577054380 365794955 /nfs/dbraw/zinc/79/49/55/365794955.db2.gz GASLCIZQOCQJLO-NWDGAFQWSA-N 2 0 210.365 2.140 20 0 BEADRP C[NH+](C)CC1CCC([NH2+]Cc2cc[nH]c2)CC1 ZINC000178668145 346962219 /nfs/dbraw/zinc/96/22/19/346962219.db2.gz XPYHUNHRGWJDQQ-UHFFFAOYSA-N 2 0 235.375 2.225 20 0 BEADRP C(=C\c1ccccc1)\C[N@@H+]1CCc2nc[nH]c2C1 ZINC000625437823 343740130 /nfs/dbraw/zinc/74/01/30/343740130.db2.gz JBWYNHMSBUJLAE-DAXSKMNVSA-N 2 0 239.322 2.481 20 0 BEADRP C[C@@H]1C[C@H]1C[N@@H+]1CCC[C@@]2(CC[NH+](C)C2)C1 ZINC000625450603 343777846 /nfs/dbraw/zinc/77/78/46/343777846.db2.gz QNIJEONGNVVCGL-RDBSUJKOSA-N 2 0 222.376 2.060 20 0 BEADRP C(C[NH2+][C@@H]1CC[C@@H]1C1CC1)C[NH+]1CCCC1 ZINC000336650622 537818398 /nfs/dbraw/zinc/81/83/98/537818398.db2.gz DTUXKSVRIRVOSE-ZIAGYGMSSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@H]([NH2+]CC1CC(C)C1)C1CC[NH+](C)CC1 ZINC000621771266 343894648 /nfs/dbraw/zinc/89/46/48/343894648.db2.gz AHMVUSOLTXHMFJ-CPCZMJQVSA-N 2 0 224.392 2.352 20 0 BEADRP CCc1cc(N[C@H](C)C2CC[NH+](C)CC2)cc[nH+]1 ZINC000396445492 347008551 /nfs/dbraw/zinc/00/85/51/347008551.db2.gz ZJTUXSYGJNZCOI-GFCCVEGCSA-N 2 0 247.386 2.208 20 0 BEADRP CCSCC[N@@H+]1CCC[C@H]([C@@H]2CCC[NH2+]2)C1 ZINC000159072718 347009266 /nfs/dbraw/zinc/00/92/66/347009266.db2.gz IVAVKVLVWCGJDV-STQMWFEESA-N 2 0 242.432 2.204 20 0 BEADRP CCC[N@H+](Cc1ccnc(C)c1)C1CC[NH2+]CC1 ZINC000621775047 343898175 /nfs/dbraw/zinc/89/81/75/343898175.db2.gz DVQAVXKAQWQVMS-UHFFFAOYSA-N 2 0 247.386 2.354 20 0 BEADRP CC(C)=CCC[N@@H+]1C[C@H]2CCC[C@]2([NH3+])C1 ZINC000621784630 343907841 /nfs/dbraw/zinc/90/78/41/343907841.db2.gz RSKAIWMUROVPGF-OLZOCXBDSA-N 2 0 208.349 2.156 20 0 BEADRP CCN1CCC[C@@H]1C[NH2+][C@@H]1CC[C@H](C)C1 ZINC000070748574 343955263 /nfs/dbraw/zinc/95/52/63/343955263.db2.gz PHDNCYGJXMRPRN-YNEHKIRRSA-N 2 0 210.365 2.249 20 0 BEADRP CC1CC([NH2+][C@@H]2CC[NH2+]CC(C)(C)C2)C1 ZINC000634733291 344113257 /nfs/dbraw/zinc/11/32/57/344113257.db2.gz BZEIFROIUBPMCU-MOENNCHZSA-N 2 0 210.365 2.153 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]([NH2+]C[C@H]2CCSC2)C1 ZINC000634733549 344113848 /nfs/dbraw/zinc/11/38/48/344113848.db2.gz IFRUGNZJBBGVSD-NEPJUHHUSA-N 2 0 242.432 2.107 20 0 BEADRP CCC[C@H](C[NH2+]C[C@H]1CC[N@@H+](C(C)C)C1)OC ZINC000395209470 362348455 /nfs/dbraw/zinc/34/84/55/362348455.db2.gz UYAVHCMSMASGMU-ZIAGYGMSSA-N 2 0 242.407 2.121 20 0 BEADRP CCC[C@H](C)CN1CCC[C@H]2C[NH2+]C[C@H]21 ZINC000299892985 344117525 /nfs/dbraw/zinc/11/75/25/344117525.db2.gz GGRRLAQFAOEXBC-RWMBFGLXSA-N 2 0 210.365 2.106 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@@H]1CC[C@H]1C1CC1 ZINC000336753968 537841852 /nfs/dbraw/zinc/84/18/52/537841852.db2.gz HEBZEXDYNMZONP-QWHCGFSZSA-N 2 0 210.365 2.106 20 0 BEADRP c1ccc(C2CC2)c(C[NH+]2C[C@H]3C[NH2+]C[C@@H]3C2)c1 ZINC000094528304 537841105 /nfs/dbraw/zinc/84/11/05/537841105.db2.gz JEMQKMSJNIDYCV-HUUCEWRRSA-N 2 0 242.366 2.215 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@@H]1CC[C@@H]1C1CC1 ZINC000336753965 537842239 /nfs/dbraw/zinc/84/22/39/537842239.db2.gz HEBZEXDYNMZONP-CHWSQXEVSA-N 2 0 210.365 2.106 20 0 BEADRP c1ccc(C2CC2)c(C[NH+]2C[C@@H]3C[NH2+]C[C@H]3C2)c1 ZINC000094528305 537841155 /nfs/dbraw/zinc/84/11/55/537841155.db2.gz JEMQKMSJNIDYCV-GJZGRUSLSA-N 2 0 242.366 2.215 20 0 BEADRP CC(C)CCC[N@@H+]1C[C@H]2CCC[C@@]2([NH3+])C1 ZINC000622003957 344181285 /nfs/dbraw/zinc/18/12/85/344181285.db2.gz IGJPUIZTOJRVPK-CHWSQXEVSA-N 2 0 210.365 2.236 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H]2CC[C@H]2C2CC2)C1 ZINC000336751302 537841316 /nfs/dbraw/zinc/84/13/16/537841316.db2.gz CHQVVAYINSLLQK-XBFCOCLRSA-N 2 0 222.376 2.106 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CC[C@@H]2C2CC2)C1 ZINC000336751300 537841471 /nfs/dbraw/zinc/84/14/71/537841471.db2.gz CHQVVAYINSLLQK-MRVWCRGKSA-N 2 0 222.376 2.106 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H]2CC[C@@H]2C2CC2)C1 ZINC000336751298 537841804 /nfs/dbraw/zinc/84/18/04/537841804.db2.gz CHQVVAYINSLLQK-BNOWGMLFSA-N 2 0 222.376 2.106 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]CCCOc2ccccc2)C1 ZINC000093215834 344312680 /nfs/dbraw/zinc/31/26/80/344312680.db2.gz GDUJXRCULGPZLB-ZIAGYGMSSA-N 2 0 248.370 2.315 20 0 BEADRP Cc1cccc(OCC[NH2+][C@H]2CCC[C@H]([NH3+])C2)c1 ZINC000093215586 344312698 /nfs/dbraw/zinc/31/26/98/344312698.db2.gz FPEWPCMBEIEHRL-KBPBESRZSA-N 2 0 248.370 2.233 20 0 BEADRP Cc1cccc(OCC[NH2+][C@@H]2CCC[C@H]([NH3+])C2)c1 ZINC000093215585 344312801 /nfs/dbraw/zinc/31/28/01/344312801.db2.gz FPEWPCMBEIEHRL-UONOGXRCSA-N 2 0 248.370 2.233 20 0 BEADRP CC(C)[C@H]([NH3+])CC[N@H+](C)CC1CCCC1 ZINC000133307456 344317837 /nfs/dbraw/zinc/31/78/37/344317837.db2.gz KJKONOVXQWRLKX-CYBMUJFWSA-N 2 0 212.381 2.482 20 0 BEADRP CSCC1CCC([NH2+][C@@H]2CC[NH2+][C@H]2C)CC1 ZINC000600714940 344365537 /nfs/dbraw/zinc/36/55/37/344365537.db2.gz VRXSAPYBQMSWOQ-YWPUVAFDSA-N 2 0 242.432 2.248 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]C[C@H]2C[C@@H]2C)CC1 ZINC000132820804 344308474 /nfs/dbraw/zinc/30/84/74/344308474.db2.gz GCSCAFANFWBAIW-NWDGAFQWSA-N 2 0 210.365 2.105 20 0 BEADRP CC(C)[N@H+](CCC[NH3+])Cc1cccs1 ZINC000042517639 344456508 /nfs/dbraw/zinc/45/65/08/344456508.db2.gz FQSOKNXYJHXKRN-UHFFFAOYSA-N 2 0 212.362 2.307 20 0 BEADRP C[C@H](C[C@H]1CCCCC[NH2+]1)[NH2+]CCCF ZINC000389331100 344459883 /nfs/dbraw/zinc/45/98/83/344459883.db2.gz LSBQSZKBCBJWRI-VXGBXAGGSA-N 2 0 216.344 2.246 20 0 BEADRP C[C@@H]1CSC[C@@H]1[NH2+]CC[C@@H]1CCCC[N@@H+]1C ZINC000381039292 344472936 /nfs/dbraw/zinc/47/29/36/344472936.db2.gz BWNSUVUOUOLXLE-AGIUHOORSA-N 2 0 242.432 2.202 20 0 BEADRP CC[C@@H]1CCC[C@H]([NH2+][C@H](CCC[NH3+])COC)C1 ZINC000300026562 344515300 /nfs/dbraw/zinc/51/53/00/344515300.db2.gz ZOFMYXVRKYZOLE-HZSPNIEDSA-N 2 0 242.407 2.299 20 0 BEADRP CC(C)[C@H]1CCC[N@@H+]1C[C@H]1CCC[NH2+]C1 ZINC000251368146 187359115 /nfs/dbraw/zinc/35/91/15/187359115.db2.gz FNLXSRQDEQGQDY-QWHCGFSZSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+]C1CCC(C)CC1 ZINC000049551817 344652607 /nfs/dbraw/zinc/65/26/07/344652607.db2.gz HFAPLVMOQHJOGV-OTTFEQOBSA-N 2 0 212.381 2.495 20 0 BEADRP Cc1ccc(C[NH2+][C@@H](C)CC[NH+](C)C)s1 ZINC000049553555 344653295 /nfs/dbraw/zinc/65/32/95/344653295.db2.gz DBZNFDXQBLULRJ-JTQLQIEISA-N 2 0 226.389 2.486 20 0 BEADRP C[NH+]1CCC(C[NH2+]C/C=C/c2ccncc2)CC1 ZINC000487268774 530049421 /nfs/dbraw/zinc/04/94/21/530049421.db2.gz DFOYADGXLWCACD-NSCUHMNNSA-N 2 0 245.370 2.026 20 0 BEADRP CCOCCC[N@@H+]1CC[C@H](C[NH+](CC)CC)C1 ZINC000076003217 344790457 /nfs/dbraw/zinc/79/04/57/344790457.db2.gz YALRRALSVALMAG-CQSZACIVSA-N 2 0 242.407 2.077 20 0 BEADRP CSC1(C[NH2+][C@H]2CCC[C@H]([NH3+])C2)CCC1 ZINC000235120285 344801799 /nfs/dbraw/zinc/80/17/99/344801799.db2.gz NIZILLLCRWFDHJ-QWRGUYRKSA-N 2 0 228.405 2.132 20 0 BEADRP CCC[N@H+](C[C@@H](C)CC)C1CC[NH2+]CC1 ZINC000050427174 344820381 /nfs/dbraw/zinc/82/03/81/344820381.db2.gz HGIRIKHICIPJQN-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP C[NH+](C)C[C@@H]1CC[N@H+](C[C@]2(C)CCCS2)C1 ZINC000628174022 344894974 /nfs/dbraw/zinc/89/49/74/344894974.db2.gz UJQKNQIQNIRSLT-STQMWFEESA-N 2 0 242.432 2.156 20 0 BEADRP CO[C@H]1CCC[C@H]([NH2+]CCC[N@H+](C)C(C)C)C1 ZINC000234796383 537875469 /nfs/dbraw/zinc/87/54/69/537875469.db2.gz YZCYVKTWFCDCSX-KBPBESRZSA-N 2 0 242.407 2.264 20 0 BEADRP C[C@H](C[NH2+]Cc1ccc2cc[nH]c2c1)C[NH+](C)C ZINC000311073058 344917986 /nfs/dbraw/zinc/91/79/86/344917986.db2.gz DIZOZOUPOSDVQM-GFCCVEGCSA-N 2 0 245.370 2.455 20 0 BEADRP C[C@@H](C[NH2+]Cc1ccc2cc[nH]c2c1)C[NH+](C)C ZINC000311073070 344918426 /nfs/dbraw/zinc/91/84/26/344918426.db2.gz DIZOZOUPOSDVQM-LBPRGKRZSA-N 2 0 245.370 2.455 20 0 BEADRP C[C@H](C[N@@H+]1C[C@@H]2CCC[NH2+][C@@H]2C1)C(C)(C)C ZINC000304311232 537880413 /nfs/dbraw/zinc/88/04/13/537880413.db2.gz QMSCXPASFUPQKU-FRRDWIJNSA-N 2 0 224.392 2.352 20 0 BEADRP COCC[C@H](C)[NH2+][C@@H]1CCN(C2CCCC2)C1 ZINC000153792538 344974379 /nfs/dbraw/zinc/97/43/79/344974379.db2.gz FEYZMMBUFRSHCH-QWHCGFSZSA-N 2 0 240.391 2.018 20 0 BEADRP COCC[C@H](C)[NH2+][C@H]1CCN(C2CCCC2)C1 ZINC000153792753 344974877 /nfs/dbraw/zinc/97/48/77/344974877.db2.gz FEYZMMBUFRSHCH-STQMWFEESA-N 2 0 240.391 2.018 20 0 BEADRP C[NH2+]CCC[N@H+](Cc1ccccc1)C1CC1 ZINC000238336838 345025535 /nfs/dbraw/zinc/02/55/35/345025535.db2.gz HCUYLMWPAWTGMS-UHFFFAOYSA-N 2 0 218.344 2.261 20 0 BEADRP FC(F)(F)CC[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000156094381 345122240 /nfs/dbraw/zinc/12/22/40/345122240.db2.gz RZFHHEKWLBLFOH-VHSXEESVSA-N 2 0 236.281 2.155 20 0 BEADRP C([N@@H+]1CCC[C@H]2CCC[C@H]21)C12CC(C1)C[NH2+]2 ZINC000634992151 345179757 /nfs/dbraw/zinc/17/97/57/345179757.db2.gz FYKMKVQSUXFPOZ-CEUNDQEZSA-N 2 0 220.360 2.003 20 0 BEADRP C[C@@H]1CC[N@H+](CC23CC(C2)C[NH2+]3)CC12CCC2 ZINC000634994765 345182891 /nfs/dbraw/zinc/18/28/91/345182891.db2.gz MJYKINTZPRMMAT-DNOWBOINSA-N 2 0 234.387 2.251 20 0 BEADRP Cc1ccc(CC[NH2+]CC23CC(C2)C[NH2+]3)c(C)c1 ZINC000634995598 345185249 /nfs/dbraw/zinc/18/52/49/345185249.db2.gz KAEQINSDRPMCCS-UHFFFAOYSA-N 2 0 244.382 2.188 20 0 BEADRP C[NH+](C)CC[C@@H](NCc1ccon1)C(C)(C)C ZINC000634962395 345136634 /nfs/dbraw/zinc/13/66/34/345136634.db2.gz SCBSYXJUJAQPGY-GFCCVEGCSA-N 2 0 239.363 2.131 20 0 BEADRP C1CC12CCC[C@@H]2[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000634997074 345193962 /nfs/dbraw/zinc/19/39/62/345193962.db2.gz CEDUWSXKJHUWAF-FQUUOJAGSA-N 2 0 234.387 2.297 20 0 BEADRP C1CC12CCC[C@@H]2[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000634997076 345193980 /nfs/dbraw/zinc/19/39/80/345193980.db2.gz CEDUWSXKJHUWAF-SYQHCUMBSA-N 2 0 234.387 2.297 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@H]2CCCC23CC3)C1 ZINC000634997015 345194248 /nfs/dbraw/zinc/19/42/48/345194248.db2.gz BCVLGXNBMHOFKJ-WOPDTQHZSA-N 2 0 208.349 2.179 20 0 BEADRP [NH3+]C1CCC([NH2+][C@@H]2CCCC23CC3)CC1 ZINC000634997773 345195459 /nfs/dbraw/zinc/19/54/59/345195459.db2.gz SFVKOMHSIRGKMG-HTAVTVPLSA-N 2 0 208.349 2.179 20 0 BEADRP CC(C)(C)[NH2+]CC[NH2+][C@@H]1CCCC12CC2 ZINC000634999223 345198989 /nfs/dbraw/zinc/19/89/89/345198989.db2.gz RJGSMWAKPNHQIE-LLVKDONJSA-N 2 0 210.365 2.297 20 0 BEADRP CC(C)C[C@H]([NH3+])C[NH2+][C@H]1CCCC12CC2 ZINC000634998772 345199468 /nfs/dbraw/zinc/19/94/68/345199468.db2.gz KQXIGUZYHYECNR-RYUDHWBXSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H](Cc1ccccc1)C[N@H+]1C[C@@H](C[NH3+])[C@H](C)C1 ZINC000634999615 345200122 /nfs/dbraw/zinc/20/01/22/345200122.db2.gz WZXDXGJGOXAFRM-IIAWOOMASA-N 2 0 246.398 2.392 20 0 BEADRP CCOc1cccc(C[N@@H+]2C[C@H](C)[C@H](C[NH3+])C2)c1 ZINC000634999899 345202001 /nfs/dbraw/zinc/20/20/01/345202001.db2.gz BWSUAAWMLIYNOP-GXTWGEPZSA-N 2 0 248.370 2.112 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+][C@H]1CCCC12CC2 ZINC000635004315 345207842 /nfs/dbraw/zinc/20/78/42/345207842.db2.gz OGBBHHGKVYFOSK-SRVKXCTJSA-N 2 0 208.349 2.036 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)c1ccco1 ZINC000635004817 345208509 /nfs/dbraw/zinc/20/85/09/345208509.db2.gz GMGQHVXCCLUUIS-IJLUTSLNSA-N 2 0 222.332 2.448 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]([NH3+])Cc1ccccc1)C1CC1 ZINC000635004675 345208591 /nfs/dbraw/zinc/20/85/91/345208591.db2.gz JWNZMHJFOVRCMR-SWLSCSKDSA-N 2 0 232.371 2.335 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+][C@H]1CCCC12CC2 ZINC000635004856 345208754 /nfs/dbraw/zinc/20/87/54/345208754.db2.gz QKHONVYSVKKMBT-UPJWGTAASA-N 2 0 222.376 2.297 20 0 BEADRP Cc1cc([C@@H](C)[NH2+][C@H]2CC[C@H](C[NH3+])CC2)no1 ZINC000635005862 345209583 /nfs/dbraw/zinc/20/95/83/345209583.db2.gz PSPMCGKTTYFXFK-IJLUTSLNSA-N 2 0 237.347 2.151 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)[C@@H]1C[C@H]1C ZINC000635005531 345209740 /nfs/dbraw/zinc/20/97/40/345209740.db2.gz OQQVZVYSSGZGKX-SYLRKERUSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1CCCC12CC2 ZINC000635006057 345210501 /nfs/dbraw/zinc/21/05/01/345210501.db2.gz XGEYYWCHAYYBIT-VXGBXAGGSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+][C@H]2CC[C@H](C[NH3+])CC2)C1 ZINC000635006354 345210512 /nfs/dbraw/zinc/21/05/12/345210512.db2.gz MEMYPDZSIWWHDY-FDYHWXHSSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)c1nccs1 ZINC000635006771 345211244 /nfs/dbraw/zinc/21/12/44/345211244.db2.gz NMYFGMGBZZKWDV-DCAQKATOSA-N 2 0 239.388 2.311 20 0 BEADRP COCCC[C@H](C)[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000635010540 345212874 /nfs/dbraw/zinc/21/28/74/345212874.db2.gz KCJPBQAVPDBFGF-QWHCGFSZSA-N 2 0 242.407 2.169 20 0 BEADRP C[C@H](CC1CCC1)[NH2+][C@@H](C)[C@@H]1CCC[NH2+]1 ZINC000635011368 345213368 /nfs/dbraw/zinc/21/33/68/345213368.db2.gz FBUAJSQSXDRHFU-MDZLAQPJSA-N 2 0 210.365 2.295 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]Cc1cccc2[nH]ccc21 ZINC000635012239 345214720 /nfs/dbraw/zinc/21/47/20/345214720.db2.gz JVSXCYZGYPDQCE-OCCSQVGLSA-N 2 0 229.327 2.137 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[NH2+]CC(C)(C)C2)[C@H]1C ZINC000635012814 345215257 /nfs/dbraw/zinc/21/52/57/345215257.db2.gz VRALVHLNUMUFHX-XQHKEYJVSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@H]2CC[C@H](C[NH3+])CC2)[C@H]1C ZINC000635007687 345215398 /nfs/dbraw/zinc/21/53/98/345215398.db2.gz XDQRHVCFEWBHAL-NZEXEKPDSA-N 2 0 210.365 2.138 20 0 BEADRP COC[C@H](CC(C)C)[NH2+][C@H]1CC[C@H](C[NH3+])CC1 ZINC000635008769 345216937 /nfs/dbraw/zinc/21/69/37/345216937.db2.gz VGDQYVOLPVAMMD-IHRRRGAJSA-N 2 0 242.407 2.155 20 0 BEADRP Cc1scc(C[NH2+][C@@H](C)C2C[NH2+]C2)c1C ZINC000635020574 345223542 /nfs/dbraw/zinc/22/35/42/345223542.db2.gz MALULPHFFSUKFQ-VIFPVBQESA-N 2 0 224.373 2.062 20 0 BEADRP C[N@@H+]1CCCC[C@H]1CC[NH2+]C1(C2CC2)CC1 ZINC000381324239 345324730 /nfs/dbraw/zinc/32/47/30/345324730.db2.gz QCTMYFRURAQWFW-ZDUSSCGKSA-N 2 0 222.376 2.393 20 0 BEADRP C[N@@H+]1CCC[C@@H]1CN1CCCC2(CC2)CC1 ZINC000626115342 345329802 /nfs/dbraw/zinc/32/98/02/345329802.db2.gz PRCSFAYEZYBXOV-CYBMUJFWSA-N 2 0 222.376 2.347 20 0 BEADRP CC[NH+]1CCC(C[NH2+]Cc2cnccc2C)CC1 ZINC000135457220 345442030 /nfs/dbraw/zinc/44/20/30/345442030.db2.gz ZPPQKIZMOJZSRP-UHFFFAOYSA-N 2 0 247.386 2.212 20 0 BEADRP CC[C@H](C)C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C)C1 ZINC000158949384 345391203 /nfs/dbraw/zinc/39/12/03/345391203.db2.gz MHCFSHBGKBZWGZ-BFHYXJOUSA-N 2 0 224.392 2.449 20 0 BEADRP CCC[N@H+](C)C[C@H]1CCN(Cc2ccn(C)c2)C1 ZINC000093742126 345663118 /nfs/dbraw/zinc/66/31/18/345663118.db2.gz ZPEHYEOGJMBMIJ-OAHLLOKOSA-N 2 0 249.402 2.189 20 0 BEADRP C(CC1CCCC1)C[NH+]1C[C@H]2C[NH2+]C[C@@H]2C1 ZINC000309588476 187309242 /nfs/dbraw/zinc/30/92/42/187309242.db2.gz XLQHNOFTEHLHMD-ZIAGYGMSSA-N 2 0 222.376 2.108 20 0 BEADRP C[C@@H]1CC[NH+](CCC[N@H+]2CC[C@H](C)C2)C1 ZINC000137675598 345685493 /nfs/dbraw/zinc/68/54/93/345685493.db2.gz JSFSIQWVRIGBLS-BETUJISGSA-N 2 0 210.365 2.060 20 0 BEADRP CC[C@@H](C)[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000319126693 259385115 /nfs/dbraw/zinc/38/51/15/259385115.db2.gz IMYXSYMNJDYXAH-UCEQBCCISA-N 2 0 210.365 2.294 20 0 BEADRP CC(C)C[C@H](C)C[N@@H+]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000309436651 187309391 /nfs/dbraw/zinc/30/93/91/187309391.db2.gz NEGDYMYOAIEQQS-MJBXVCDLSA-N 2 0 224.392 2.210 20 0 BEADRP CC[NH+](CC)CC1CC[NH+](C(C)C)CC1 ZINC000145310879 345710513 /nfs/dbraw/zinc/71/05/13/345710513.db2.gz PHHQVIXSPFIJDJ-UHFFFAOYSA-N 2 0 212.381 2.449 20 0 BEADRP CCCCOCCC[NH2+][C@@H]1CCCC[C@H]1C[NH3+] ZINC000160195552 345813147 /nfs/dbraw/zinc/81/31/47/345813147.db2.gz CKBMTGPZEUQJNU-UONOGXRCSA-N 2 0 242.407 2.300 20 0 BEADRP C[C@@H](CC1CCC1)[NH2+]C[C@H]1CCCN1C ZINC000166878568 345925401 /nfs/dbraw/zinc/92/54/01/345925401.db2.gz LEHTWAWSCUCLHB-WCQYABFASA-N 2 0 210.365 2.249 20 0 BEADRP CCCC(O)(CCC)C[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000577076470 365806740 /nfs/dbraw/zinc/80/67/40/365806740.db2.gz HKEVQXWCGNHTAU-CHWSQXEVSA-N 2 0 242.407 2.177 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)[C@H]1CC1(C)C ZINC000381492589 346077505 /nfs/dbraw/zinc/07/75/05/346077505.db2.gz YTEWIFGUFMQDDG-RWMBFGLXSA-N 2 0 224.392 2.352 20 0 BEADRP C1CC1C([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)C1CC1 ZINC000401136130 346276350 /nfs/dbraw/zinc/27/63/50/346276350.db2.gz QQSBTSOALYXOCL-MGPQQGTHSA-N 2 0 234.387 2.153 20 0 BEADRP Cc1cccc(C)c1C[NH+]1C[C@H]2C[N@H+](C)C[C@H]2C1 ZINC000278931049 179036197 /nfs/dbraw/zinc/03/61/97/179036197.db2.gz WIEUCEHKAJZQCK-GASCZTMLSA-N 2 0 244.382 2.297 20 0 BEADRP Cc1cccc(CC[NH2+]C[C@@H]2CCC[NH2+]C2)c1 ZINC000132242617 179058585 /nfs/dbraw/zinc/05/85/85/179058585.db2.gz USSOTPDCZPUDTC-OAHLLOKOSA-N 2 0 232.371 2.127 20 0 BEADRP Cc1cccc(C[N@@H+]2CCC[C@@H](C[NH3+])C2)c1 ZINC000011888318 179074393 /nfs/dbraw/zinc/07/43/93/179074393.db2.gz CBHXHESECXQGEL-AWEZNQCLSA-N 2 0 218.344 2.166 20 0 BEADRP Cc1cccc(C[N@H+]2CC[C@H](C)[C@H](C[NH3+])C2)c1 ZINC000163424988 179080982 /nfs/dbraw/zinc/08/09/82/179080982.db2.gz PZQZIZURPBSUOU-DZGCQCFKSA-N 2 0 232.371 2.412 20 0 BEADRP Cc1cccc(C[N@H+]2C[C@@H](C[NH3+])C[C@H]2C)c1C ZINC000228066891 179081380 /nfs/dbraw/zinc/08/13/80/179081380.db2.gz USOJHFQEAMHYFS-TZMCWYRMSA-N 2 0 232.371 2.473 20 0 BEADRP Cc1cccc(C[N@@H+]2CC[C@H]([NH3+])[C@@H](C)C2)c1C ZINC000227054624 179081599 /nfs/dbraw/zinc/08/15/99/179081599.db2.gz NAHHXYBJRFSNQO-WFASDCNBSA-N 2 0 232.371 2.473 20 0 BEADRP C[C@@H](C[NH2+][C@@H]1CCCC12CCC2)C[NH+](C)C ZINC000394829903 346426467 /nfs/dbraw/zinc/42/64/67/346426467.db2.gz TUVDINLIAAGHMB-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP CC[NH+](CC)CC1CCN(CC(F)F)CC1 ZINC000603412222 349960385 /nfs/dbraw/zinc/96/03/85/349960385.db2.gz YVEJJFAVKYAZPY-UHFFFAOYSA-N 2 0 234.334 2.305 20 0 BEADRP CCc1nc(C)c(CN[C@H](C[NH3+])C(C)(C)C)o1 ZINC000641800534 362751557 /nfs/dbraw/zinc/75/15/57/362751557.db2.gz ZACKHVUNLQNMIH-LLVKDONJSA-N 2 0 239.363 2.008 20 0 BEADRP C[C@@H]1C[N@@H+](CC[C@@H]2CCC[NH2+]C2)C[C@H](C)S1 ZINC000069908592 349967938 /nfs/dbraw/zinc/96/79/38/349967938.db2.gz MQHKKZVZXIQPKM-XQQFMLRXSA-N 2 0 242.432 2.202 20 0 BEADRP Cc1cc(C)c(C[NH2+][C@H]2C[C@H]([NH3+])C2(C)C)c(C)n1 ZINC000641801991 362757495 /nfs/dbraw/zinc/75/74/95/362757495.db2.gz XIYXCMDIPPMNQX-KBPBESRZSA-N 2 0 247.386 2.222 20 0 BEADRP C[C@@H]1CC[C@H](CN)[N@H+](C[C@@H]2CCCCO2)[C@H]1C ZINC000641806335 362764095 /nfs/dbraw/zinc/76/40/95/362764095.db2.gz QOZWLPCQGAMIGS-RQJABVFESA-N 2 0 240.391 2.003 20 0 BEADRP Cc1cc(CN2[C@H](C)[C@@H](C)CC[C@H]2C[NH3+])ccn1 ZINC000641806403 362763885 /nfs/dbraw/zinc/76/38/85/362763885.db2.gz RQZBKVHLRBCZFM-LNSITVRQSA-N 2 0 247.386 2.338 20 0 BEADRP CC[C@H]([NH2+]CCC[NH3+])c1ccccc1OC ZINC000037713696 346703433 /nfs/dbraw/zinc/70/34/33/346703433.db2.gz HLIFVYZNAUPIEG-LBPRGKRZSA-N 2 0 222.332 2.085 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C2CC([NH+](C)C)C2)C[C@H]1C ZINC000580216038 346700975 /nfs/dbraw/zinc/70/09/75/346700975.db2.gz LEIIGYRSZDWGQV-PGDPNYEUSA-N 2 0 224.392 2.493 20 0 BEADRP C[C@@H]1OCC[C@@]1(C)[NH2+]CC[C@H]1CCCC[N@@H+]1C ZINC000300422526 346746170 /nfs/dbraw/zinc/74/61/70/346746170.db2.gz HOUFCWFYDAAVRW-BFHYXJOUSA-N 2 0 240.391 2.018 20 0 BEADRP CC(C)(C)CC[N@@H+]1C[C@@H]2CCC[C@]2([NH3+])C1 ZINC000622003471 370653960 /nfs/dbraw/zinc/65/39/60/370653960.db2.gz AGMNJRNFQMNLGX-AAEUAGOBSA-N 2 0 210.365 2.236 20 0 BEADRP CCC(F)(F)CN1CCC(CC[NH3+])CC1 ZINC000641825515 362775314 /nfs/dbraw/zinc/77/53/14/362775314.db2.gz YNBJPHRTBXZWEZ-UHFFFAOYSA-N 2 0 220.307 2.093 20 0 BEADRP Cc1cccc([C@@H]2CCC[N@@H+]2CCOCC[NH3+])c1 ZINC000357084226 179189906 /nfs/dbraw/zinc/18/99/06/179189906.db2.gz ZKLWBJPXINCLRO-HNNXBMFYSA-N 2 0 248.370 2.107 20 0 BEADRP Cc1cccc([C@H](C)[N@H+]2C[C@H]3C[NH2+]C[C@H]3C2)c1 ZINC000203597028 179194960 /nfs/dbraw/zinc/19/49/60/179194960.db2.gz XBPHPELGIVYRHC-AEGPPILISA-N 2 0 230.355 2.207 20 0 BEADRP Cc1cccc([C@H]2CCC[N@@H+]2CCOCC[NH3+])c1 ZINC000357084227 179203227 /nfs/dbraw/zinc/20/32/27/179203227.db2.gz ZKLWBJPXINCLRO-OAHLLOKOSA-N 2 0 248.370 2.107 20 0 BEADRP Cn1cncc1CCC[N@H+](C)CC1CCC1 ZINC000518791100 347385410 /nfs/dbraw/zinc/38/54/10/347385410.db2.gz WTZSXGZCEMLFFV-UHFFFAOYSA-N 2 0 221.348 2.085 20 0 BEADRP C[C@H](C[NH3+])N(C)Cc1ccc(Cl)cc1 ZINC000020226759 347430904 /nfs/dbraw/zinc/43/09/04/347430904.db2.gz JHCWPJAHEDDGDP-SECBINFHSA-N 2 0 212.724 2.119 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H]1CCC[C@@H]1C1CC1 ZINC000577214408 365883477 /nfs/dbraw/zinc/88/34/77/365883477.db2.gz NBBFFGYFCBTARP-CHWSQXEVSA-N 2 0 210.365 2.154 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H]1CCC[C@H]1C1CC1 ZINC000577214411 365883523 /nfs/dbraw/zinc/88/35/23/365883523.db2.gz NBBFFGYFCBTARP-STQMWFEESA-N 2 0 210.365 2.154 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H]1CCC[C@H]1C1CC1 ZINC000577214410 365883560 /nfs/dbraw/zinc/88/35/60/365883560.db2.gz NBBFFGYFCBTARP-QWHCGFSZSA-N 2 0 210.365 2.154 20 0 BEADRP Cc1ccccc1CC[NH2+][C@@H]1CCC[C@@H]1C[NH3+] ZINC000094182724 179267065 /nfs/dbraw/zinc/26/70/65/179267065.db2.gz KSNYARNHFBWAAD-HUUCEWRRSA-N 2 0 232.371 2.255 20 0 BEADRP Cc1ccccc1C[N@H+]1CC[C@H]([C@H](C)[NH3+])C1 ZINC000228201702 179276219 /nfs/dbraw/zinc/27/62/19/179276219.db2.gz HXBYFTYRGJLPQR-JSGCOSHPSA-N 2 0 218.344 2.164 20 0 BEADRP Cc1ccccc1C[N@@H+]1CC[C@@]2(CC[NH2+]C2)C1 ZINC000031994567 179277228 /nfs/dbraw/zinc/27/72/28/179277228.db2.gz WZCRCJHCLXTUJJ-OAHLLOKOSA-N 2 0 230.355 2.180 20 0 BEADRP C[C@H](Cc1ccco1)[NH2+]C[C@@H]1CCCCN1C ZINC000054241417 1172095263 /nfs/dbraw/zinc/09/52/63/1172095263.db2.gz YSAUIXNSOODLHC-OLZOCXBDSA-N 2 0 236.359 2.285 20 0 BEADRP Cc1nc(C)c([C@H](C)[NH2+]C[C@@H](C)C[NH3+])s1 ZINC000054345897 347771303 /nfs/dbraw/zinc/77/13/03/347771303.db2.gz YSEXKBLJRHFAAW-YUMQZZPRSA-N 2 0 227.377 2.005 20 0 BEADRP Cc1ccccc1C[NH2+][C@@H](C)CCC[NH3+] ZINC000308877446 179282616 /nfs/dbraw/zinc/28/26/16/179282616.db2.gz USMBEEJACDSPGR-LBPRGKRZSA-N 2 0 206.333 2.212 20 0 BEADRP Cc1ccccc1C[NH2+][C@@H]1CC[NH2+][C@H](C)C1 ZINC000334866459 179282804 /nfs/dbraw/zinc/28/28/04/179282804.db2.gz WNJMFFPKSNPTAV-TZMCWYRMSA-N 2 0 218.344 2.225 20 0 BEADRP Cc1ccccc1C[C@H](C)[NH2+]C[C@H](C)C[NH3+] ZINC000309396114 179290722 /nfs/dbraw/zinc/29/07/22/179290722.db2.gz UMINDUQADLDYRK-YPMHNXCESA-N 2 0 220.360 2.110 20 0 BEADRP CCS[C@H]1CCCC[N@H+](C[C@@H]2CC[NH2+]C2)C1 ZINC000592477065 347791299 /nfs/dbraw/zinc/79/12/99/347791299.db2.gz QYLYNUMHGZSOEE-OLZOCXBDSA-N 2 0 242.432 2.204 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]C[C@@H]1CCCC1(F)F ZINC000390713471 259398506 /nfs/dbraw/zinc/39/85/06/259398506.db2.gz XMCALPCWNSEMOT-UWVGGRQHSA-N 2 0 220.307 2.139 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]C[C@H]1CCCC1(F)F ZINC000390713875 259398646 /nfs/dbraw/zinc/39/86/46/259398646.db2.gz XMCALPCWNSEMOT-VHSXEESVSA-N 2 0 220.307 2.139 20 0 BEADRP Cc1ccccc1[C@H](C)[NH2+]C1CC[NH2+]CC1 ZINC000038040667 179337201 /nfs/dbraw/zinc/33/72/01/179337201.db2.gz YSNQMYYHAARRGH-LBPRGKRZSA-N 2 0 218.344 2.398 20 0 BEADRP C[C@@H]([NH2+]C1CC=CC1)C1CC[NH+](C)CC1 ZINC000122129118 490125524 /nfs/dbraw/zinc/12/55/24/490125524.db2.gz MMQZMVZARPORTB-LLVKDONJSA-N 2 0 208.349 2.025 20 0 BEADRP [NH3+]CCC[N@@H+]1CCCC[C@@H]1Cc1ccccc1 ZINC000202728526 348043888 /nfs/dbraw/zinc/04/38/88/348043888.db2.gz JWZCYSNNROAHDN-OAHLLOKOSA-N 2 0 232.371 2.432 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CCN3CCCC[C@H]23)CS1 ZINC000251741290 362905436 /nfs/dbraw/zinc/90/54/36/362905436.db2.gz CUGZNQJZDZAWFE-MROQNXINSA-N 2 0 240.416 2.097 20 0 BEADRP COCCCCC[NH2+][C@H](C)C1CC[NH+](C)CC1 ZINC000122788822 490173545 /nfs/dbraw/zinc/17/35/45/490173545.db2.gz DQAANOJEMFVOOG-CYBMUJFWSA-N 2 0 242.407 2.123 20 0 BEADRP CSCC1(CC[NH2+][C@@H](C)[C@H]2CCC[NH2+]2)CC1 ZINC000596650244 348605163 /nfs/dbraw/zinc/60/51/63/348605163.db2.gz KGOQJXXXTALXOA-NWDGAFQWSA-N 2 0 242.432 2.250 20 0 BEADRP CS[C@H](C)C[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC000598970265 349069408 /nfs/dbraw/zinc/06/94/08/349069408.db2.gz LTJXBYHQSDDLMV-GHMZBOCLSA-N 2 0 230.421 2.200 20 0 BEADRP CS[C@@H](C)C[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC000598970268 349069652 /nfs/dbraw/zinc/06/96/52/349069652.db2.gz LTJXBYHQSDDLMV-WDEREUQCSA-N 2 0 230.421 2.200 20 0 BEADRP CSCCC[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC000598962970 349067987 /nfs/dbraw/zinc/06/79/87/349067987.db2.gz DYYMJOMLTRVLSY-LLVKDONJSA-N 2 0 230.421 2.202 20 0 BEADRP C[C@H]1CC[C@H]([NH2+][C@@H]2CCC[C@H]([NH3+])C2)CC1 ZINC000253117812 349224611 /nfs/dbraw/zinc/22/46/11/349224611.db2.gz GUBGSODFOXBQMU-ZDEQEGDKSA-N 2 0 210.365 2.425 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+][C@H]1CC[NH2+]C[C@@H]1C ZINC000388634453 349279283 /nfs/dbraw/zinc/27/92/83/349279283.db2.gz MEHMUEDDJOQREN-RNJOBUHISA-N 2 0 210.365 2.153 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+]CCCCF)CC1(C)C ZINC000623529522 362948296 /nfs/dbraw/zinc/94/82/96/362948296.db2.gz MVPWSHJMPXTAFN-LLVKDONJSA-N 2 0 216.344 2.199 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CCc1c(F)cccc1F ZINC000422692611 192432571 /nfs/dbraw/zinc/43/25/71/192432571.db2.gz KLHXHAFAZMADKS-VHSXEESVSA-N 2 0 242.313 2.223 20 0 BEADRP Cc1ncsc1C[NH2+]C1CCC(C[NH3+])CC1 ZINC000422736220 192447106 /nfs/dbraw/zinc/44/71/06/192447106.db2.gz FYWJSARFHSMFPC-UHFFFAOYSA-N 2 0 239.388 2.059 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CCC(C)C)[C@H](C)C1 ZINC000151768769 191065804 /nfs/dbraw/zinc/06/58/04/191065804.db2.gz GHFFQHKDQDJCJY-OLZOCXBDSA-N 2 0 212.381 2.352 20 0 BEADRP C1[C@@H]2[C@H]1CCC[C@@H]2[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000306073406 191074050 /nfs/dbraw/zinc/07/40/50/191074050.db2.gz DNFJOCUWIWKGKC-ZQNQSHIBSA-N 2 0 234.387 2.391 20 0 BEADRP CCC[C@@H]([NH2+]C[C@@H]1CCC[NH2+]1)C1CCC1 ZINC000324929725 323306341 /nfs/dbraw/zinc/30/63/41/323306341.db2.gz NHHWMVXWFBSPLD-QWHCGFSZSA-N 2 0 210.365 2.297 20 0 BEADRP CCCN(CC)CC[NH2+][C@@H](CC)[C@@H]1CCOC1 ZINC000156813625 191088385 /nfs/dbraw/zinc/08/83/85/191088385.db2.gz HIDVTPGQTCKKPR-KGLIPLIRSA-N 2 0 242.407 2.123 20 0 BEADRP CC[C@@H]([NH2+]CCCCSC)[C@@H]1CCC[NH2+]1 ZINC000422749985 192454879 /nfs/dbraw/zinc/45/48/79/192454879.db2.gz BRDHQIBBNKGWDM-NEPJUHHUSA-N 2 0 230.421 2.250 20 0 BEADRP CSCCCC[NH2+][C@@H]1CC[NH2+]CC[C@H]1C ZINC000422758140 192456688 /nfs/dbraw/zinc/45/66/88/192456688.db2.gz NNQYTFCWTWQVHJ-VXGBXAGGSA-N 2 0 230.421 2.107 20 0 BEADRP CCCC[N@H+](CC)CCC1CC[NH2+]CC1 ZINC000026514044 350278184 /nfs/dbraw/zinc/27/81/84/350278184.db2.gz BWHXKSADQOLWPS-UHFFFAOYSA-N 2 0 212.381 2.498 20 0 BEADRP CCC[C@H]([NH2+]CCCC[NH3+])c1ccccn1 ZINC000223567987 350279880 /nfs/dbraw/zinc/27/98/80/350279880.db2.gz ZIOJEYQFFAKETM-LBPRGKRZSA-N 2 0 221.348 2.251 20 0 BEADRP CCC[C@H](C[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1)OC ZINC000623535258 362953515 /nfs/dbraw/zinc/95/35/15/362953515.db2.gz SARGAMSPGZTZGI-CHWSQXEVSA-N 2 0 242.407 2.264 20 0 BEADRP CC(C)CCOCC[NH2+]C1CCC(C[NH3+])CC1 ZINC000422780813 192465215 /nfs/dbraw/zinc/46/52/15/192465215.db2.gz KQTKTKHUJRNXBB-UHFFFAOYSA-N 2 0 242.407 2.156 20 0 BEADRP CCC[C@@H](C[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1)OC ZINC000623535259 362954505 /nfs/dbraw/zinc/95/45/05/362954505.db2.gz SARGAMSPGZTZGI-OLZOCXBDSA-N 2 0 242.407 2.264 20 0 BEADRP Cc1ncsc1C[NH2+]C[C@@H]1CCC[C@H]([NH3+])C1 ZINC000070838263 180319534 /nfs/dbraw/zinc/31/95/34/180319534.db2.gz PVOXDAFCPDJUEA-MNOVXSKESA-N 2 0 239.388 2.059 20 0 BEADRP CO[C@@H]1CCC[C@H]1[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623539612 362958442 /nfs/dbraw/zinc/95/84/42/362958442.db2.gz WODMTWJTWAQTRQ-JHJVBQTASA-N 2 0 240.391 2.016 20 0 BEADRP CC[C@@](C)(C[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1)OC ZINC000623538712 362958680 /nfs/dbraw/zinc/95/86/80/362958680.db2.gz RIBKIFNNWZBMRI-JSGCOSHPSA-N 2 0 242.407 2.264 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+]C[C@@H]2C[C@H]2C2CC2)CC1(C)C ZINC000623542614 362961378 /nfs/dbraw/zinc/96/13/78/362961378.db2.gz LGTQWMYNLAJUPW-MJBXVCDLSA-N 2 0 236.403 2.495 20 0 BEADRP COc1cccc2c1CCC[C@H]2[NH2+]C[C@H](C)C[NH3+] ZINC000577482268 365964036 /nfs/dbraw/zinc/96/40/36/365964036.db2.gz YTSBFUCZKATLBP-BXUZGUMPSA-N 2 0 248.370 2.257 20 0 BEADRP CO[C@H](C[NH2+][C@@H](C)CCC[NH3+])c1ccccc1 ZINC000422743244 192469184 /nfs/dbraw/zinc/46/91/84/192469184.db2.gz SXYIEMOBILRKJE-GXTWGEPZSA-N 2 0 236.359 2.091 20 0 BEADRP CC[N@@H+]1CCC[C@H](C[NH2+][C@H](C)COC(C)C)C1 ZINC000337308026 350571928 /nfs/dbraw/zinc/57/19/28/350571928.db2.gz SSIFMHYNRPMPMM-ZIAGYGMSSA-N 2 0 242.407 2.121 20 0 BEADRP CC[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)COC(C)C)C1 ZINC000337308025 350572074 /nfs/dbraw/zinc/57/20/74/350572074.db2.gz SSIFMHYNRPMPMM-UONOGXRCSA-N 2 0 242.407 2.121 20 0 BEADRP CCC(C)(C)CC[N@@H+]1CC[C@@H]2[NH2+]CC[C@H]2C1 ZINC000428029324 191109212 /nfs/dbraw/zinc/10/92/12/191109212.db2.gz ABSCJAUJNRPTGF-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@H]2CCC[C@@H]2C1)C1C[NH2+]C1 ZINC000422796285 192471773 /nfs/dbraw/zinc/47/17/73/192471773.db2.gz YCHCPNNDFGWCME-FMCLSXCISA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]([NH2+]Cc1cccc2c1CC[NH2+]C2)C1CC1 ZINC000398039485 362990926 /nfs/dbraw/zinc/99/09/26/362990926.db2.gz KLNIHXWGZDOVRD-LLVKDONJSA-N 2 0 230.355 2.220 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@@H]2[C@@H]3CCC[C@@H]32)CC1(C)C ZINC000623572201 363001391 /nfs/dbraw/zinc/00/13/91/363001391.db2.gz USPUTNMZZPVBDO-RVMXOQNASA-N 2 0 222.376 2.247 20 0 BEADRP CCc1nc(C)cc(N[C@H]2CC[N@@H+](C(C)C)C2)n1 ZINC000283786081 351069560 /nfs/dbraw/zinc/06/95/60/351069560.db2.gz RESOXVJTFCSILV-LBPRGKRZSA-N 2 0 248.374 2.242 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]C[C@H]2CC2(C)C)CC1 ZINC000228821509 535162522 /nfs/dbraw/zinc/16/25/22/535162522.db2.gz JLZJNAXSRYRCCP-GFCCVEGCSA-N 2 0 224.392 2.495 20 0 BEADRP [NH3+]CCC[N@@H+]1CCSC[C@H]1c1ccccc1 ZINC000414680856 351588512 /nfs/dbraw/zinc/58/85/12/351588512.db2.gz UVMSNISATVHOFI-ZDUSSCGKSA-N 2 0 236.384 2.125 20 0 BEADRP CC[C@@](C)(C[NH+]1CCC(C[NH+](C)C)CC1)OC ZINC000637906703 351776536 /nfs/dbraw/zinc/77/65/36/351776536.db2.gz CTKOIPAVDOIWOG-AWEZNQCLSA-N 2 0 242.407 2.075 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000414843507 351830485 /nfs/dbraw/zinc/83/04/85/351830485.db2.gz QAPODJVEDFYESO-AGIUHOORSA-N 2 0 210.365 2.154 20 0 BEADRP CCC[C@H](C[N@H+](C)C[C@@H]1CCC[NH+](C)C1)OC ZINC000637930617 351806619 /nfs/dbraw/zinc/80/66/19/351806619.db2.gz QGJLDQRSKIHSCS-ZIAGYGMSSA-N 2 0 242.407 2.075 20 0 BEADRP C[C@H]([NH2+]CC1([NH3+])CCCCC1)C1CCC1 ZINC000414847470 351856388 /nfs/dbraw/zinc/85/63/88/351856388.db2.gz VAAYAVJNOBOUDS-NSHDSACASA-N 2 0 210.365 2.426 20 0 BEADRP CCC[C@@H](C[N@@H+]1CC[C@@H](C[NH+](C)CC)C1)OC ZINC000638131879 352001891 /nfs/dbraw/zinc/00/18/91/352001891.db2.gz FDSXJYKNRHGNFJ-KBPBESRZSA-N 2 0 242.407 2.075 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)[C@@H]1CC1(F)F ZINC000638361026 352171431 /nfs/dbraw/zinc/17/14/31/352171431.db2.gz ZHTKRSCRDQNMFE-UMNHJUIQSA-N 2 0 244.329 2.104 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)[C@H]1CC1(F)F ZINC000638361023 352171477 /nfs/dbraw/zinc/17/14/77/352171477.db2.gz ZHTKRSCRDQNMFE-HOSYDEDBSA-N 2 0 244.329 2.104 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)[C@@H]1CC1(F)F ZINC000638377106 352188683 /nfs/dbraw/zinc/18/86/83/352188683.db2.gz NHZOOZHKGNMECT-USZNOCQGSA-N 2 0 244.329 2.247 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+]C[C@@](C)(CC)OC)C1 ZINC000638408452 352215002 /nfs/dbraw/zinc/21/50/02/352215002.db2.gz BBOPGDHXXBXYLV-ZIAGYGMSSA-N 2 0 242.407 2.123 20 0 BEADRP CCC[NH2+]CCNc1cc[nH+]c(C)c1Cl ZINC000261536900 535173523 /nfs/dbraw/zinc/17/35/23/535173523.db2.gz UDWUGCOXOAKILZ-UHFFFAOYSA-N 2 0 227.739 2.455 20 0 BEADRP CO[C@@H](C[NH2+]CCCC[NH+](C)C)C1CCCC1 ZINC000638452441 352263237 /nfs/dbraw/zinc/26/32/37/352263237.db2.gz ZOFWVWVIZUCDJS-AWEZNQCLSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)C[C@H](C)[NH2+]CCC1=CC[NH2+]CC1 ZINC000336687185 187648795 /nfs/dbraw/zinc/64/87/95/187648795.db2.gz LFVDSZPFHFVTPO-LBPRGKRZSA-N 2 0 210.365 2.320 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+]C[C@H](C)Cc1ccccc1 ZINC000414955723 352374848 /nfs/dbraw/zinc/37/48/48/352374848.db2.gz MRVXRXDONNOUPX-ZIAGYGMSSA-N 2 0 234.387 2.453 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2CCC[C@H](C)[C@H]2C)CC[NH2+]1 ZINC000252931283 538103683 /nfs/dbraw/zinc/10/36/83/538103683.db2.gz BFFRSWMZRDXURF-UMSGYPCISA-N 2 0 210.365 2.247 20 0 BEADRP C[C@@H]1C[C@H](C)C[N@H+]([C@@H]2CC[NH2+][C@H](C)C2)C1 ZINC000252958517 538103786 /nfs/dbraw/zinc/10/37/86/538103786.db2.gz SWIAYLRCUHHJGQ-YVECIDJPSA-N 2 0 210.365 2.105 20 0 BEADRP CCOc1ccccc1C[N@@H+]1CCC[C@@H](C[NH3+])C1 ZINC000044527771 352654581 /nfs/dbraw/zinc/65/45/81/352654581.db2.gz LWXGUYOELPWASK-ZDUSSCGKSA-N 2 0 248.370 2.256 20 0 BEADRP C[N@H+](CC1CCCCC1)C[C@@H]1CCC[NH2+]C1 ZINC000042495608 352622240 /nfs/dbraw/zinc/62/22/40/352622240.db2.gz WMNPUBSJBQKVFX-CQSZACIVSA-N 2 0 224.392 2.498 20 0 BEADRP COC1([C@H](C)[NH2+]CCC[NH+]2CCCC2)CCC1 ZINC000412024895 191239082 /nfs/dbraw/zinc/23/90/82/191239082.db2.gz ONJVKWBMXIVWJR-ZDUSSCGKSA-N 2 0 240.391 2.020 20 0 BEADRP CCC[NH+]1CCC([NH2+]CCC[C@@H]2CCO2)CC1 ZINC000638849559 353029747 /nfs/dbraw/zinc/02/97/47/353029747.db2.gz WILLAZUIWMMIQT-CQSZACIVSA-N 2 0 240.391 2.020 20 0 BEADRP CCCC[C@@H](COC)[NH2+][C@@H](C)CC[NH+](C)C ZINC000336750767 353037193 /nfs/dbraw/zinc/03/71/93/353037193.db2.gz ZTMUYBPZFWTGPW-STQMWFEESA-N 2 0 230.396 2.121 20 0 BEADRP c1cc(CN2CCC[C@]3(CC[NH2+]C3)C2)cs1 ZINC000334430954 353105569 /nfs/dbraw/zinc/10/55/69/353105569.db2.gz BEWVVBDHYWUSES-CYBMUJFWSA-N 2 0 236.384 2.324 20 0 BEADRP c1cc(CN2CCC[C@@]3(CC[NH2+]C3)C2)cs1 ZINC000334430956 353105697 /nfs/dbraw/zinc/10/56/97/353105697.db2.gz BEWVVBDHYWUSES-ZDUSSCGKSA-N 2 0 236.384 2.324 20 0 BEADRP CC(C)[C@H](C)[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000020189176 188005767 /nfs/dbraw/zinc/00/57/67/188005767.db2.gz RURCYSDOFFNEEC-LBPRGKRZSA-N 2 0 212.381 2.493 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]CC[C@H](C)F)CC1 ZINC000340465678 188007244 /nfs/dbraw/zinc/00/72/44/188007244.db2.gz XAAWGOSZFRVORJ-NSHDSACASA-N 2 0 216.344 2.197 20 0 BEADRP C[C@H](CC[NH+](C)C)Nc1nc2ccccc2[nH]1 ZINC000049558502 353168319 /nfs/dbraw/zinc/16/83/19/353168319.db2.gz PYYHSARDVLBXPO-SNVBAGLBSA-N 2 0 232.331 2.315 20 0 BEADRP C[C@@H]1CCCC[C@H]1C[N@@H+]1CC[C@@H]([NH3+])[C@H](C)C1 ZINC000252097549 353296095 /nfs/dbraw/zinc/29/60/95/353296095.db2.gz FSQXNGIFBWULKA-YIYPIFLZSA-N 2 0 224.392 2.482 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H](C)CCc1ccco1 ZINC000336683781 188256335 /nfs/dbraw/zinc/25/63/35/188256335.db2.gz ZKRLYFZCKNGGGU-NEPJUHHUSA-N 2 0 224.348 2.318 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]([NH2+]CCC[NH3+])C[C@@H]1C ZINC000336688775 188256637 /nfs/dbraw/zinc/25/66/37/188256637.db2.gz VUZUNMYFUOZYDT-XQQFMLRXSA-N 2 0 212.381 2.386 20 0 BEADRP C1CC([NH2+]C2CCCCCCC2)CC[NH2+]1 ZINC000038040536 188283546 /nfs/dbraw/zinc/28/35/46/188283546.db2.gz FWXMFXUUHKMPEJ-UHFFFAOYSA-N 2 0 210.365 2.441 20 0 BEADRP CC(C)C[C@H]([NH3+])C[N@@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC000126282372 188316198 /nfs/dbraw/zinc/31/61/98/188316198.db2.gz MUFUSUGQYSZHNN-XQQFMLRXSA-N 2 0 210.365 2.092 20 0 BEADRP C(C1CC[NH2+]CC1)[N@@H+]1CCC[C@H]2CCC[C@@H]21 ZINC000227167961 188330838 /nfs/dbraw/zinc/33/08/38/188330838.db2.gz IRPUNYSVHOHOHY-KGLIPLIRSA-N 2 0 222.376 2.251 20 0 BEADRP CC(C)C1CC([NH2+]CC2=CC[N@H+](C)CC2)C1 ZINC000336666354 188339121 /nfs/dbraw/zinc/33/91/21/188339121.db2.gz LUOYAZZYKDPVBE-UHFFFAOYSA-N 2 0 222.376 2.273 20 0 BEADRP C1C[C@@H]2C[C@@H]([NH2+]C3CCSCC3)CC[N@@H+]2C1 ZINC000106868997 188345206 /nfs/dbraw/zinc/34/52/06/188345206.db2.gz IRSLVGSOGWWFBB-QWHCGFSZSA-N 2 0 240.416 2.098 20 0 BEADRP C(C[NH2+]C1CCCC1)C[NH+]1CCCCC1 ZINC000020128711 188352122 /nfs/dbraw/zinc/35/21/22/188352122.db2.gz QUZQRQJZUOEQNU-UHFFFAOYSA-N 2 0 210.365 2.395 20 0 BEADRP c1coc(C2=CCC[N@@H+](CCn3ccnc3)C2)c1 ZINC000285251882 188385231 /nfs/dbraw/zinc/38/52/31/188385231.db2.gz HFNHDXAZVPGFJV-UHFFFAOYSA-N 2 0 243.310 2.265 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccsc3)C[C@@H]21 ZINC000230126783 353473440 /nfs/dbraw/zinc/47/34/40/353473440.db2.gz XBSFAUXONVIAPO-RWMBFGLXSA-N 2 0 236.384 2.307 20 0 BEADRP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+]C[C@H]2CCSC2)C1 ZINC000336778957 353530097 /nfs/dbraw/zinc/53/00/97/353530097.db2.gz MVFBLAUCWFHLCD-JHJVBQTASA-N 2 0 242.432 2.202 20 0 BEADRP CC[C@@](C)(C[N@@H+]1CCC[C@@H]([NH+](C)C)CC1)OC ZINC000639106206 353621587 /nfs/dbraw/zinc/62/15/87/353621587.db2.gz XBUPFOKVWHUAPX-KGLIPLIRSA-N 2 0 242.407 2.218 20 0 BEADRP Cc1ccccc1[C@H](C)[N@H+](C)CCC[NH3+] ZINC000227743737 363249216 /nfs/dbraw/zinc/24/92/16/363249216.db2.gz NZNULDLGGCYEIW-LBPRGKRZSA-N 2 0 206.333 2.337 20 0 BEADRP C[C@@H](CCC1CC1)[NH2+][C@H]1CCC[NH2+]CC1 ZINC000398105712 324218027 /nfs/dbraw/zinc/21/80/27/324218027.db2.gz VNABIGHLEMQGTR-AAEUAGOBSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)C1CC(F)(F)C1 ZINC000529548277 324336667 /nfs/dbraw/zinc/33/66/67/324336667.db2.gz KFQZUIFTMAEQBX-QWRGUYRKSA-N 2 0 246.345 2.352 20 0 BEADRP CCCC[C@H](COC)[NH2+]CC1=CC[N@H+](C)CC1 ZINC000344281013 354200807 /nfs/dbraw/zinc/20/08/07/354200807.db2.gz ABKJBSMKRUYMPN-CQSZACIVSA-N 2 0 240.391 2.043 20 0 BEADRP C[C@H](CC[NH2+]Cc1ccn(C)c1)[NH+]1CCCCC1 ZINC000344353847 354240967 /nfs/dbraw/zinc/24/09/67/354240967.db2.gz RJFWZQNLJHTWGT-CQSZACIVSA-N 2 0 249.402 2.379 20 0 BEADRP [NH3+][C@@H]1CCCC[C@H]1[NH2+]C1Cc2ccccc2C1 ZINC000334616596 354303776 /nfs/dbraw/zinc/30/37/76/354303776.db2.gz SSNFXGJWGWPFHT-HUUCEWRRSA-N 2 0 230.355 2.013 20 0 BEADRP C[C@H]1C[N@H+](CC[C@H]2CCC[NH+]2C)CCC1(F)F ZINC000334685094 354431189 /nfs/dbraw/zinc/43/11/89/354431189.db2.gz VNEDBJLLOZSNGF-NWDGAFQWSA-N 2 0 246.345 2.448 20 0 BEADRP c1nc2c([nH]1)C[C@@H]([NH2+]C1CC3(CCC3)C1)CC2 ZINC000334646625 354436623 /nfs/dbraw/zinc/43/66/23/354436623.db2.gz MAFQIHLLTXXUEK-JTQLQIEISA-N 2 0 231.343 2.189 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H](C)CCC(F)(F)F ZINC000578062672 366209509 /nfs/dbraw/zinc/20/95/09/366209509.db2.gz KCMVPEIAWDZMOR-VIFPVBQESA-N 2 0 226.286 2.307 20 0 BEADRP CCCC[N@H+](CC)C[C@@H]1CC[NH2+][C@@H](C)C1 ZINC000232959871 363389541 /nfs/dbraw/zinc/38/95/41/363389541.db2.gz VPMCHYHOFSVVDF-QWHCGFSZSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCCCC1(C)C)C1C[NH2+]C1 ZINC000335145920 354856216 /nfs/dbraw/zinc/85/62/16/354856216.db2.gz JRYBAXWVULJNIO-ZYHUDNBSSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H](C[NH2+][C@@H](C)CC[NH3+])c1ccccc1 ZINC000235086524 363437518 /nfs/dbraw/zinc/43/75/18/363437518.db2.gz HABCSHOUUAXSHL-RYUDHWBXSA-N 2 0 206.333 2.117 20 0 BEADRP CC(C[NH+](C)CC1CC1)C[N@H+](C)CC1CC1 ZINC000346434442 354933866 /nfs/dbraw/zinc/93/38/66/354933866.db2.gz SPVZEDKXYDSAIV-UHFFFAOYSA-N 2 0 224.392 2.306 20 0 BEADRP C[C@H](C[NH+]1CC[C@@H](C)C1)C[N@@H+]1CC[C@H](C)C1 ZINC000346638022 355015612 /nfs/dbraw/zinc/01/56/12/355015612.db2.gz GKFVRKBZCKOGFZ-BTTYYORXSA-N 2 0 224.392 2.306 20 0 BEADRP [NH3+]CC1CC[NH+]([C@H]2CCc3ccc(F)cc32)CC1 ZINC000335227906 355070020 /nfs/dbraw/zinc/07/00/20/355070020.db2.gz BJIXJGFNIJHCTR-HNNXBMFYSA-N 2 0 248.345 2.484 20 0 BEADRP CO[C@H](C)[C@H](C)[NH2+]CC[C@@H](C)[NH+]1CCCCC1 ZINC000346869029 355158055 /nfs/dbraw/zinc/15/80/55/355158055.db2.gz KDXPHBUAKQZPEO-HZSPNIEDSA-N 2 0 242.407 2.264 20 0 BEADRP CO[C@H](C)[C@@H](C)[NH2+]CC[C@H](C)[NH+]1CCCCC1 ZINC000346869028 355158503 /nfs/dbraw/zinc/15/85/03/355158503.db2.gz KDXPHBUAKQZPEO-BFHYXJOUSA-N 2 0 242.407 2.264 20 0 BEADRP C1CC1[C@H]1CCC[C@H]([NH2+]C2CC[NH2+]CC2)C1 ZINC000335252439 355207674 /nfs/dbraw/zinc/20/76/74/355207674.db2.gz PHGDWRJMMREHRO-JSGCOSHPSA-N 2 0 222.376 2.297 20 0 BEADRP CC[C@@]1(C)CCC[N@H+](C[C@H]2CCC[NH2+]C2)C1 ZINC000346977889 355211483 /nfs/dbraw/zinc/21/14/83/355211483.db2.gz NECZOWBPQOIPNF-KBPBESRZSA-N 2 0 224.392 2.498 20 0 BEADRP Cc1ccccc1C[NH2+][C@H]1CC[NH2+]CC[C@H]1C ZINC000335256228 355189391 /nfs/dbraw/zinc/18/93/91/355189391.db2.gz FDJAELUVTCOHTB-HIFRSBDPSA-N 2 0 232.371 2.473 20 0 BEADRP C[C@@H]1C[N@H+](C[C@@H]2CCC[NH2+]C2)[C@H]2CCCC[C@H]12 ZINC000347008693 355202291 /nfs/dbraw/zinc/20/22/91/355202291.db2.gz RVOZTYNRKJMBFL-TUVASFSCSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]1C[N@H+](C[C@@H]2CCC[NH2+]C2)[C@H]2CCCC[C@@H]12 ZINC000347008691 355202880 /nfs/dbraw/zinc/20/28/80/355202880.db2.gz RVOZTYNRKJMBFL-KBXIAJHMSA-N 2 0 236.403 2.497 20 0 BEADRP C[N@H+](CCCC[NH2+]CCC[C@@H]1CCO1)C1CC1 ZINC000639244131 355230638 /nfs/dbraw/zinc/23/06/38/355230638.db2.gz GZYCBEIIAFBCND-CQSZACIVSA-N 2 0 240.391 2.020 20 0 BEADRP C[C@@H]1CC2(C[N@@H+]1Cc1ccccn1)CC[NH2+]CC2 ZINC000335280251 355244539 /nfs/dbraw/zinc/24/45/39/355244539.db2.gz LEQHCFKWNLKILQ-CYBMUJFWSA-N 2 0 245.370 2.046 20 0 BEADRP c1[nH+]cn2cc(C[NH2+]C[C@@H]3C[C@H]4C[C@H]4C3)ccc12 ZINC000639256256 355301136 /nfs/dbraw/zinc/30/11/36/355301136.db2.gz GILKYZFQKCIPHL-BTTYYORXSA-N 2 0 241.338 2.470 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)[C@@H]1CC1(F)F ZINC000639257182 355301939 /nfs/dbraw/zinc/30/19/39/355301939.db2.gz JYTZGNILVMPYGV-TUAOUCFPSA-N 2 0 246.345 2.352 20 0 BEADRP CC[C@@](C)(C[NH2+]CC[C@@H]1CCC[N@H+](C)C1)OC ZINC000639258126 355305124 /nfs/dbraw/zinc/30/51/24/355305124.db2.gz ZWRVMHPHBFYMFM-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)([NH3+])C[NH2+][C@H]1CCC[C@H](C2CC2)C1 ZINC000414810922 191579928 /nfs/dbraw/zinc/57/99/28/191579928.db2.gz YJLDMJNQOCBCOI-RYUDHWBXSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CC[C@H]2CC[NH2+]C2)[C@H](C)C1 ZINC000414830469 191590365 /nfs/dbraw/zinc/59/03/65/191590365.db2.gz MDEAZQYETZAVPH-SYQHCUMBSA-N 2 0 224.392 2.400 20 0 BEADRP C[NH2+]Cc1ccccc1NC[C@@H]1CC[NH2+][C@H](C)C1 ZINC000414861122 191604130 /nfs/dbraw/zinc/60/41/30/191604130.db2.gz FAZWBQNHDRPXIK-CHWSQXEVSA-N 2 0 247.386 2.206 20 0 BEADRP [NH3+][C@H]1CCC[C@@H](C[NH2+]Cc2ccccc2F)C1 ZINC000415003294 191646104 /nfs/dbraw/zinc/64/61/04/191646104.db2.gz WXFKFAPSJSHFBJ-YPMHNXCESA-N 2 0 236.334 2.433 20 0 BEADRP COc1ccccc1/C=C\C[NH2+][C@H](C)CCC[NH3+] ZINC000415016848 191650963 /nfs/dbraw/zinc/65/09/63/191650963.db2.gz DHHMPVWNVJOTOB-OYVUYXNMSA-N 2 0 248.370 2.425 20 0 BEADRP C[C@H]1CCC[C@H]1[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000415014759 191651414 /nfs/dbraw/zinc/65/14/14/191651414.db2.gz XKAYHQJUDBUKIV-SCUASFONSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H]1CCC[C@@H]1C1CC1 ZINC000415015127 191651498 /nfs/dbraw/zinc/65/14/98/191651498.db2.gz AERWFIJDEIFFRX-RTXFEEFZSA-N 2 0 210.365 2.282 20 0 BEADRP COc1ccc(C[NH2+][C@H](C)CCC[NH3+])cc1F ZINC000415025072 191655179 /nfs/dbraw/zinc/65/51/79/191655179.db2.gz QDBMZXXBUXNBQZ-SNVBAGLBSA-N 2 0 240.322 2.051 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+][C@@H](C)CCC[NH3+] ZINC000415024574 191655460 /nfs/dbraw/zinc/65/54/60/191655460.db2.gz PDDZFFNBHJKHPV-DTWKUNHWSA-N 2 0 226.286 2.434 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H](C)Cc1ccc(Cl)cc1 ZINC000414887745 191615099 /nfs/dbraw/zinc/61/50/99/191615099.db2.gz ZJPKECVKKXZPOP-MNOVXSKESA-N 2 0 240.778 2.455 20 0 BEADRP [NH3+]CCCC[NH2+]C1CCC2(CCOCC2)CC1 ZINC000414903813 191621135 /nfs/dbraw/zinc/62/11/35/191621135.db2.gz LSZSSSGRWKMDRD-UHFFFAOYSA-N 2 0 240.391 2.054 20 0 BEADRP [NH3+]CC1CCC([NH2+]Cc2cccs2)CC1 ZINC000415092585 191675946 /nfs/dbraw/zinc/67/59/46/191675946.db2.gz TXNDOPOQXVSUNC-UHFFFAOYSA-N 2 0 224.373 2.355 20 0 BEADRP C[C@@H]1C[C@H](C[NH2+][C@H]2CCC[C@@H]3C[C@@H]32)CC[NH2+]1 ZINC000415104425 191680764 /nfs/dbraw/zinc/68/07/64/191680764.db2.gz DYSUCLXRVQNRSW-POQQGIQPSA-N 2 0 222.376 2.153 20 0 BEADRP Cc1ccc(N[C@@H]2CCC[NH2+]C2)c(C[NH+](C)C)c1 ZINC000415126708 191682576 /nfs/dbraw/zinc/68/25/76/191682576.db2.gz UYCFNTBAKBEOOE-CQSZACIVSA-N 2 0 247.386 2.221 20 0 BEADRP Cc1ccccc1C[NH2+][C@H]1CC[C@@H](C[NH3+])C1 ZINC000415044503 191661497 /nfs/dbraw/zinc/66/14/97/191661497.db2.gz STQDSMSVOOCWFQ-OCCSQVGLSA-N 2 0 218.344 2.212 20 0 BEADRP C[N@@H+]1CC[C@@]2(CC[NH+]([C@H]3C=CCCC3)C2)C1 ZINC000335887761 355679652 /nfs/dbraw/zinc/67/96/52/355679652.db2.gz CFBLXFVFIGLAGK-UONOGXRCSA-N 2 0 220.360 2.123 20 0 BEADRP c1nc2c([nH]1)C[C@@H]([NH2+][C@H]1CCC13CCC3)CC2 ZINC000336003071 134048249 /nfs/dbraw/zinc/04/82/49/134048249.db2.gz OTIDYXKKXMOUKO-GWCFXTLKSA-N 2 0 231.343 2.189 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C[C@H]2CCCC[N@H+](C)C2)CS1 ZINC000639346600 355793174 /nfs/dbraw/zinc/79/31/74/355793174.db2.gz HMKUZJWSOYHEFS-JHJVBQTASA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H]1C[C@@H](C)[C@H](C)[N@H+](CC2CC[NH2+]CC2)C1 ZINC000166718317 355831689 /nfs/dbraw/zinc/83/16/89/355831689.db2.gz DYOKXNYRPWMRNI-UPJWGTAASA-N 2 0 224.392 2.352 20 0 BEADRP C[C@H](CC[N@@H+]1CC[C@@H](C[NH3+])C1)c1ccccc1 ZINC000216161097 355911216 /nfs/dbraw/zinc/91/12/16/355911216.db2.gz KRYJPHUVKDNLFB-KGLIPLIRSA-N 2 0 232.371 2.461 20 0 BEADRP C[C@@H]1C[C@H](C[NH3+])C[N@@H+]1C/C=C/c1ccccc1 ZINC000216193636 355925829 /nfs/dbraw/zinc/92/58/29/355925829.db2.gz FLAIQOKFGJKICM-IEOKHJKGSA-N 2 0 230.355 2.369 20 0 BEADRP C[C@@H]1C[C@H]([N@H+](C)CC2(C)CC2)CCN1C ZINC000582217393 355937654 /nfs/dbraw/zinc/93/76/54/355937654.db2.gz WTOBODGJVIAACU-VXGBXAGGSA-N 2 0 210.365 2.201 20 0 BEADRP Cc1cccc2c1CC[C@@H]2[NH2+][C@H](C)C1C[NH2+]C1 ZINC000583625046 355893919 /nfs/dbraw/zinc/89/39/19/355893919.db2.gz AHPUFHWMKFOAFA-ABAIWWIYSA-N 2 0 230.355 2.180 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]CCCC2CCOCC2)C1 ZINC000582228975 355992464 /nfs/dbraw/zinc/99/24/64/355992464.db2.gz GKVSWVXCHYJPNZ-ZIAGYGMSSA-N 2 0 240.391 2.053 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CC[C@@H](Oc2ccncc2)C1 ZINC000351471955 355996557 /nfs/dbraw/zinc/99/65/57/355996557.db2.gz NIIQRMBMUPKVHS-YRGRVCCFSA-N 2 0 232.327 2.191 20 0 BEADRP CC(C)N(C)CC[NH2+][C@H]1CCCC12CC2 ZINC000583641980 355948018 /nfs/dbraw/zinc/94/80/18/355948018.db2.gz KRVMVTGYTBVSGQ-LBPRGKRZSA-N 2 0 210.365 2.249 20 0 BEADRP Cc1ccc(CC[N@H+]2CC[C@@H]([C@@H](C)[NH3+])C2)cc1 ZINC000351861980 356099540 /nfs/dbraw/zinc/09/95/40/356099540.db2.gz MRYFCJPGDDJQNY-UKRRQHHQSA-N 2 0 232.371 2.207 20 0 BEADRP CCc1ccc(CC[N@@H+]2CC[C@@H]([C@H](C)[NH3+])C2)cc1 ZINC000351861576 356099796 /nfs/dbraw/zinc/09/97/96/356099796.db2.gz KRIDWAGZXOIVOM-XJKSGUPXSA-N 2 0 246.398 2.461 20 0 BEADRP C[N@H+](CCCc1ccsc1)C1CC[NH2+]CC1 ZINC000420264572 192191511 /nfs/dbraw/zinc/19/15/11/192191511.db2.gz APFHZNNIOVRRQV-UHFFFAOYSA-N 2 0 238.400 2.365 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CCC[N@H+](CCCc2ccncc2)C1 ZINC000420292674 192203627 /nfs/dbraw/zinc/20/36/27/192203627.db2.gz PVJXNQJUOOGUTD-DZGCQCFKSA-N 2 0 247.386 2.073 20 0 BEADRP CCSCC[C@H](C)[N@H+](C)CC[C@@H]1CC[NH2+]C1 ZINC000420298867 192204344 /nfs/dbraw/zinc/20/43/44/192204344.db2.gz IDIZKAKTRIBOOS-STQMWFEESA-N 2 0 244.448 2.450 20 0 BEADRP C[C@H](c1cccc(O)c1)[N@H+](C)CC[C@@H]1CC[NH2+]C1 ZINC000420296021 192204513 /nfs/dbraw/zinc/20/45/13/192204513.db2.gz CVTSRNJMUXOYCM-OLZOCXBDSA-N 2 0 248.370 2.385 20 0 BEADRP C[C@@H]([NH3+])C[N@@H+]1CCC[C@H]1CCc1ccccc1 ZINC000420297420 192204656 /nfs/dbraw/zinc/20/46/56/192204656.db2.gz DIIBBELAXOBEGU-HIFRSBDPSA-N 2 0 232.371 2.431 20 0 BEADRP CCSCC[C@@H](C)[N@H+](C)CC[C@@H]1CC[NH2+]C1 ZINC000420298865 192204682 /nfs/dbraw/zinc/20/46/82/192204682.db2.gz IDIZKAKTRIBOOS-OLZOCXBDSA-N 2 0 244.448 2.450 20 0 BEADRP C[C@@H]([NH3+])C[N@@H+]1CCCC2(CCCCC2)C1 ZINC000420298795 192204755 /nfs/dbraw/zinc/20/47/55/192204755.db2.gz HUTGDDYGRABUIM-GFCCVEGCSA-N 2 0 210.365 2.380 20 0 BEADRP Cc1ccc(C[C@@H]2CCC[N@H+]2C[C@H](C)[NH3+])cc1 ZINC000420298202 192205637 /nfs/dbraw/zinc/20/56/37/192205637.db2.gz GZTWYGZGJVVCHT-ZFWWWQNUSA-N 2 0 232.371 2.349 20 0 BEADRP [NH3+]CC1CC[NH+](CCCc2ccsc2)CC1 ZINC000420278666 192198750 /nfs/dbraw/zinc/19/87/50/192198750.db2.gz WAFGOFLBIDIKQQ-UHFFFAOYSA-N 2 0 238.400 2.351 20 0 BEADRP C[C@@H]([NH3+])C1CC[NH+](CC[C@@H]2CCCCO2)CC1 ZINC000420281927 192199677 /nfs/dbraw/zinc/19/96/77/192199677.db2.gz ATUNEAKVPDPYFF-OCCSQVGLSA-N 2 0 240.391 2.005 20 0 BEADRP Cc1ccc(CN2CCC[C@H](C)[C@H]2C[NH3+])c(C)n1 ZINC000420289981 192201604 /nfs/dbraw/zinc/20/16/04/192201604.db2.gz LAHJBDOTOJACKL-XHDPSFHLSA-N 2 0 247.386 2.258 20 0 BEADRP C[C@@H](C1CC1)[N@H+](CC[C@H]1CC[NH2+]C1)C1CC1 ZINC000420300000 192207146 /nfs/dbraw/zinc/20/71/46/192207146.db2.gz GYGXXYQIUXBBIK-NWDGAFQWSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@@H](C1CC1)[N@H+](CC[C@@H]1CC[NH2+]C1)C1CC1 ZINC000420300001 192207204 /nfs/dbraw/zinc/20/72/04/192207204.db2.gz GYGXXYQIUXBBIK-RYUDHWBXSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@H]([NH3+])C1CC[NH+](CCCc2ccncc2)CC1 ZINC000420295513 192202375 /nfs/dbraw/zinc/20/23/75/192202375.db2.gz PJFCGWMDXLDDBN-ZDUSSCGKSA-N 2 0 247.386 2.073 20 0 BEADRP COc1ccc([C@@H](C[NH3+])C[N@H+](C)C2CCC2)cc1 ZINC000420295637 192202708 /nfs/dbraw/zinc/20/27/08/192202708.db2.gz CHSTUIUBPYBLBT-ZDUSSCGKSA-N 2 0 248.370 2.222 20 0 BEADRP CC[NH+](CC)CCCN(C)CC[C@H]([NH3+])C(C)C ZINC000420291309 192202738 /nfs/dbraw/zinc/20/27/38/192202738.db2.gz NEWSERODBGBAFG-AWEZNQCLSA-N 2 0 243.439 2.024 20 0 BEADRP C[C@H]1C[C@@H](C[NH3+])C[N@@H+]1CCCc1ccsc1 ZINC000420316217 192213254 /nfs/dbraw/zinc/21/32/54/192213254.db2.gz LTTGZTURKISMBO-AAEUAGOBSA-N 2 0 238.400 2.350 20 0 BEADRP C[C@H]([NH3+])C[N@@H+]1CC[C@H](Cc2ccccc2)[C@H]1C ZINC000420310952 192210677 /nfs/dbraw/zinc/21/06/77/192210677.db2.gz VMAGIFXIGLEBBK-GZBFAFLISA-N 2 0 232.371 2.287 20 0 BEADRP CCc1cccc(C[N@@H+]2C[C@@H](C[NH3+])C[C@@H]2C)c1 ZINC000420317228 192212231 /nfs/dbraw/zinc/21/22/31/192212231.db2.gz MRSUGQPYIOETSF-SWLSCSKDSA-N 2 0 232.371 2.418 20 0 BEADRP CCc1cccc(C[N@@H+]2CC[C@@H]3C[NH2+]C[C@@H]3C2)c1 ZINC000420314913 192212286 /nfs/dbraw/zinc/21/22/86/192212286.db2.gz LRGRCELNJNUTQJ-HZPDHXFCSA-N 2 0 244.382 2.290 20 0 BEADRP CC[C@@]1(C)CCC[N@H+](CC[C@@H]2CC[NH2+]C2)C1 ZINC000420313588 192212346 /nfs/dbraw/zinc/21/23/46/192212346.db2.gz YDEUDSHVFBQQLP-KBPBESRZSA-N 2 0 224.392 2.498 20 0 BEADRP Cc1cc([C@H]2CCC[N@@H+]2CC[C@H]2CC[NH2+]C2)on1 ZINC000420326819 192229903 /nfs/dbraw/zinc/22/99/03/192229903.db2.gz XVHBZAZAYFFEOZ-CHWSQXEVSA-N 2 0 249.358 2.120 20 0 BEADRP C[C@H]1CCCC[N@H+](CC[C@@H]2CCC[NH2+]C2)C1 ZINC000420364046 192224346 /nfs/dbraw/zinc/22/43/46/192224346.db2.gz CLTBCXGPIAAXRB-KBPBESRZSA-N 2 0 224.392 2.498 20 0 BEADRP C[NH2+]CCC[N@H+](CCc1nccs1)C(C)C ZINC000420363602 192224761 /nfs/dbraw/zinc/22/47/61/192224761.db2.gz PNVUDFJLVZBPIB-UHFFFAOYSA-N 2 0 241.404 2.006 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1CC[NH2+]C1)c1ccc(OC)cc1 ZINC000420366607 192225513 /nfs/dbraw/zinc/22/55/13/192225513.db2.gz GFZSNGSPCJDSDR-DOMZBBRYSA-N 2 0 248.370 2.345 20 0 BEADRP CCC(C)(C)CC[N@H+](C)CCC[NH2+]C ZINC000420382484 192235466 /nfs/dbraw/zinc/23/54/66/192235466.db2.gz ANNPTKIPIGUGRB-UHFFFAOYSA-N 2 0 200.370 2.354 20 0 BEADRP CCCC[NH+]1CCC([C@@H]2C[C@H]([NH3+])CCO2)CC1 ZINC000420383140 192235585 /nfs/dbraw/zinc/23/55/85/192235585.db2.gz FEOWEDCDRSLDBO-KGLIPLIRSA-N 2 0 240.391 2.005 20 0 BEADRP CC[C@H](C)[NH+]1CCC([C@@H]2C[C@H]([NH3+])CCO2)CC1 ZINC000420389465 192235597 /nfs/dbraw/zinc/23/55/97/192235597.db2.gz MCQKOGSXPHOJJT-YUTCNCBUSA-N 2 0 240.391 2.003 20 0 BEADRP C[C@H](c1ccccc1)[C@H](C)[NH2+]C[C@H](C)[NH3+] ZINC000420417329 192240613 /nfs/dbraw/zinc/24/06/13/192240613.db2.gz WJVMFVFYXCDKBC-SRVKXCTJSA-N 2 0 206.333 2.115 20 0 BEADRP CC(C)[C@@H]1CCCC[C@@H]1[NH2+]C[C@H]1CC[NH2+]C1 ZINC000420421207 192242308 /nfs/dbraw/zinc/24/23/08/192242308.db2.gz YNJXKJMFQJOALK-IHRRRGAJSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H]1CCCC[N@H+](CCC2CC[NH2+]CC2)C1 ZINC000420376324 192231529 /nfs/dbraw/zinc/23/15/29/192231529.db2.gz QKWCKFSRVMRTLO-ZDUSSCGKSA-N 2 0 224.392 2.498 20 0 BEADRP CC[C@H](C)[NH+]1CCC([C@@H]2OCCC[C@@H]2[NH3+])CC1 ZINC000420379797 192234060 /nfs/dbraw/zinc/23/40/60/192234060.db2.gz NPIBVYCVEVXRKC-UBHSHLNASA-N 2 0 240.391 2.003 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCN2CCCC2(C)C)[C@@H](C)O1 ZINC000449782248 202034950 /nfs/dbraw/zinc/03/49/50/202034950.db2.gz KIXLVJUHTZRUQP-UPJWGTAASA-N 2 0 240.391 2.016 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCN2CCCC2(C)C)[C@H](C)O1 ZINC000449782246 202035758 /nfs/dbraw/zinc/03/57/58/202035758.db2.gz KIXLVJUHTZRUQP-FRRDWIJNSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]C[C@H](C)Oc1ccccc1 ZINC000422981074 192516092 /nfs/dbraw/zinc/51/60/92/192516092.db2.gz NCNHMRNSTMPCDJ-OLZOCXBDSA-N 2 0 236.359 2.171 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+][C@H]1CC=CCC1 ZINC000422991136 192520474 /nfs/dbraw/zinc/52/04/74/192520474.db2.gz OHYOMKDOEAKCIF-XQQFMLRXSA-N 2 0 208.349 2.345 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CCCC(F)(F)F ZINC000422962464 192526958 /nfs/dbraw/zinc/52/69/58/192526958.db2.gz CORPZFHWZQCSLH-YUMQZZPRSA-N 2 0 212.259 2.044 20 0 BEADRP C[C@H]1C[C@@H]1C[N@@H+]1CCCN(c2cc[nH+]cc2)CC1 ZINC000639685932 356601694 /nfs/dbraw/zinc/60/16/94/356601694.db2.gz ZEQBKHTXIBPSGD-UONOGXRCSA-N 2 0 245.370 2.250 20 0 BEADRP C1=CC[C@@H](C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)CC1 ZINC000422971666 192532553 /nfs/dbraw/zinc/53/25/53/192532553.db2.gz JIRXIJSFBDQZPG-HABKJSAYSA-N 2 0 220.360 2.215 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](C)c1cncc(F)c1 ZINC000423037471 192548326 /nfs/dbraw/zinc/54/83/26/192548326.db2.gz WAEAJYCNTCUZBG-QWRGUYRKSA-N 2 0 239.338 2.389 20 0 BEADRP CCC(CC)C[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000044535271 538465987 /nfs/dbraw/zinc/46/59/87/538465987.db2.gz DWGVKRYHPCDLEX-ZDUSSCGKSA-N 2 0 212.381 2.354 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]C[C@](C)(O)C1CCCCC1 ZINC000423072307 192558547 /nfs/dbraw/zinc/55/85/47/192558547.db2.gz JDTMIXLKDTWXDI-OBJOEFQTSA-N 2 0 242.407 2.033 20 0 BEADRP CC[C@H](C)[N@@H+]1CCC2(C1)CC[NH+](C)CC2 ZINC000639756257 356660761 /nfs/dbraw/zinc/66/07/61/356660761.db2.gz TUHJPGNBXDDEOM-LBPRGKRZSA-N 2 0 210.365 2.203 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@H]1CCc2ccccc2OC1 ZINC000423108748 192570286 /nfs/dbraw/zinc/57/02/86/192570286.db2.gz GHBPWCQZILPWNX-JSGCOSHPSA-N 2 0 248.370 2.097 20 0 BEADRP CC(C)=CC[N@H+]1CCC2(C1)CC[NH+](C)CC2 ZINC000639755210 356658512 /nfs/dbraw/zinc/65/85/12/356658512.db2.gz HYRBCLISEILZET-UHFFFAOYSA-N 2 0 222.376 2.370 20 0 BEADRP COCC(C)(C)CCC[NH2+][C@H](C)[C@H]1CCC[NH2+]1 ZINC000423129218 192578378 /nfs/dbraw/zinc/57/83/78/192578378.db2.gz QWITUOWATYYIQS-CHWSQXEVSA-N 2 0 242.407 2.169 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H]2CCCCC[C@@H]2[NH3+])cn1 ZINC000563951297 356665097 /nfs/dbraw/zinc/66/50/97/356665097.db2.gz XUXHHLIASPAJBJ-LSDHHAIUSA-N 2 0 247.386 2.182 20 0 BEADRP CCc1cc(N2C[C@@H](C)[N@H+](C)C[C@@H]2C)cc[nH+]1 ZINC000450417372 202161056 /nfs/dbraw/zinc/16/10/56/202161056.db2.gz JGOJAWVAXMYLPT-NEPJUHHUSA-N 2 0 233.359 2.173 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+]CCc2ccco2)CC1(C)C ZINC000623338585 356734426 /nfs/dbraw/zinc/73/44/26/356734426.db2.gz HIAVSTBRMZSYSD-GFCCVEGCSA-N 2 0 236.359 2.285 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H]1CC[C@H](C)[C@H](C)C1 ZINC000578185298 366368063 /nfs/dbraw/zinc/36/80/63/366368063.db2.gz YCPYTFOHHZHZDG-YNEHKIRRSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CC(C)(C)c1ccccn1 ZINC000423150807 192590954 /nfs/dbraw/zinc/59/09/54/192590954.db2.gz ZGCYVVMPKQUCRE-CYBMUJFWSA-N 2 0 249.402 2.466 20 0 BEADRP C[C@@H]1C[C@@H]([NH+]2CC(C)(C)OC(C)(C)C2)CC[NH2+]1 ZINC000226427734 538610166 /nfs/dbraw/zinc/61/01/66/538610166.db2.gz BHQXZLPBSKAQPN-NEPJUHHUSA-N 2 0 240.391 2.016 20 0 BEADRP CC[C@]1(C(C)C)C[C@H]1[NH2+][C@@H](CCC[NH3+])COC ZINC000423160954 192598990 /nfs/dbraw/zinc/59/89/90/192598990.db2.gz IDGNBQGQQRNLST-BFHYXJOUSA-N 2 0 242.407 2.155 20 0 BEADRP CCC[C@H]([NH2+][C@H](C)C1C[NH2+]C1)C(C)(C)C ZINC000423164626 192601513 /nfs/dbraw/zinc/60/15/13/192601513.db2.gz XGUKXFFGNJBZKZ-PWSUYJOCSA-N 2 0 212.381 2.399 20 0 BEADRP CC[C@@H]1CCC[C@@H]1C[NH2+][C@@H]1CCC[C@@H]1[NH3+] ZINC000423156267 192594661 /nfs/dbraw/zinc/59/46/61/192594661.db2.gz KWORSGMFAIKTAB-FVCCEPFGSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)[C@@H]1C[C@H]1C[NH2+][C@H]1CC[NH2+]CC[C@@H]1C ZINC000423154338 192594807 /nfs/dbraw/zinc/59/48/07/192594807.db2.gz OQVVGVQHJPVQDZ-XUXIUFHCSA-N 2 0 224.392 2.256 20 0 BEADRP CCc1cc(N2CC[N@@H+](CC)C[C@H]2C)cc[nH+]1 ZINC000450533121 202190820 /nfs/dbraw/zinc/19/08/20/202190820.db2.gz ZJFGJVNVPKPYEB-GFCCVEGCSA-N 2 0 233.359 2.174 20 0 BEADRP CC[NH+]1CCC(CC[NH2+][C@@H](C)[C@H](C)OC)CC1 ZINC000361766899 356937142 /nfs/dbraw/zinc/93/71/42/356937142.db2.gz AGDXURDGWYXDOX-STQMWFEESA-N 2 0 242.407 2.121 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+]CC(C)(C)C)CC1(C)C ZINC000623374621 356890767 /nfs/dbraw/zinc/89/07/67/356890767.db2.gz IBRSDAPKFHWFCA-LLVKDONJSA-N 2 0 212.381 2.495 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CC(C)(C)C)CC1(C)C ZINC000623374622 356891001 /nfs/dbraw/zinc/89/10/01/356891001.db2.gz IBRSDAPKFHWFCA-NSHDSACASA-N 2 0 212.381 2.495 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]CCOCc2ccccc2)C1 ZINC000390229026 357086686 /nfs/dbraw/zinc/08/66/86/357086686.db2.gz FEJGJJIPPWAFEH-HUUCEWRRSA-N 2 0 248.370 2.063 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]CCOCc2ccccc2)C1 ZINC000390229024 357086774 /nfs/dbraw/zinc/08/67/74/357086774.db2.gz FEJGJJIPPWAFEH-CABCVRRESA-N 2 0 248.370 2.063 20 0 BEADRP CC[C@@H]([NH2+]CC[C@H]1CCC[NH2+]C1)C(C)C ZINC000423262347 192657107 /nfs/dbraw/zinc/65/71/07/192657107.db2.gz VFKHJWBSQBVRKL-CHWSQXEVSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1ccsc1 ZINC000423243109 192649439 /nfs/dbraw/zinc/64/94/39/192649439.db2.gz GFYUPFUGZDHEPI-GHMZBOCLSA-N 2 0 224.373 2.398 20 0 BEADRP CC(C)C1CC([NH2+]CC[C@H]2CC[NH2+]C2)C1 ZINC000423253572 192652561 /nfs/dbraw/zinc/65/25/61/192652561.db2.gz WFHWKTJYVDSUCZ-PNESKVBLSA-N 2 0 210.365 2.010 20 0 BEADRP Cc1cc(CN[C@@H]2CC[N@@H+]3CCCC[C@H]23)ccn1 ZINC000391169757 357125758 /nfs/dbraw/zinc/12/57/58/357125758.db2.gz FQQXUPXYXKQYBK-HUUCEWRRSA-N 2 0 245.370 2.106 20 0 BEADRP Fc1cccc2c1CC[C@H]2[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000423251998 192653842 /nfs/dbraw/zinc/65/38/42/192653842.db2.gz SSTBELKZTFEADS-IAQYHMDHSA-N 2 0 248.345 2.402 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]CC2(C3CC3)CCC2)C1 ZINC000391456076 357130329 /nfs/dbraw/zinc/13/03/29/357130329.db2.gz JHTMPBHZVAIUHY-OLZOCXBDSA-N 2 0 222.376 2.426 20 0 BEADRP CC[C@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)[C@H]1C[C@@H]1C ZINC000423284340 192676310 /nfs/dbraw/zinc/67/63/10/192676310.db2.gz YDGAFRZSNCBTJU-XUXIUFHCSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1CCCC[C@H]1C[N@@H+]1CCC[C@H](C[NH3+])C1 ZINC000347032439 134196314 /nfs/dbraw/zinc/19/63/14/134196314.db2.gz ABIDRIJWUOFBGV-MCIONIFRSA-N 2 0 224.392 2.483 20 0 BEADRP CC1(C)CCC[C@H](C[N@H+]2C[C@H]3C[NH2+]C[C@H]3C2)C1 ZINC000582606259 357349181 /nfs/dbraw/zinc/34/91/81/357349181.db2.gz LSFGOOQRUQKHMI-MELADBBJSA-N 2 0 236.403 2.354 20 0 BEADRP C([NH2+][C@H]1CCCC12CCC2)C1CC[NH2+]CC1 ZINC000582958446 357438056 /nfs/dbraw/zinc/43/80/56/357438056.db2.gz CNGMNQFTMIABRC-ZDUSSCGKSA-N 2 0 222.376 2.298 20 0 BEADRP C[NH2+]Cc1cccc(N[C@@H]2CCC[C@@H]([NH3+])C2)c1 ZINC000582975878 357450240 /nfs/dbraw/zinc/45/02/40/357450240.db2.gz QYAXSSGBEHKJFW-TZMCWYRMSA-N 2 0 233.359 2.088 20 0 BEADRP Cc1cc(C)c(C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)cn1 ZINC000396976192 357487967 /nfs/dbraw/zinc/48/79/67/357487967.db2.gz KIGTZSXIGROPKK-UONOGXRCSA-N 2 0 233.359 2.058 20 0 BEADRP CC(C)CSCC[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000397364326 357513751 /nfs/dbraw/zinc/51/37/51/357513751.db2.gz YOBOWTSRLPYYAW-VXGBXAGGSA-N 2 0 230.421 2.235 20 0 BEADRP C[C@@H]([NH2+]CC1CC[NH2+]CC1)[C@@H]1CC1(C)C ZINC000397757180 357675576 /nfs/dbraw/zinc/67/55/76/357675576.db2.gz DGUXIIHDMTZIRT-PWSUYJOCSA-N 2 0 210.365 2.010 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+][C@H](C)c1ccccc1 ZINC000234697430 357822704 /nfs/dbraw/zinc/82/27/04/357822704.db2.gz GKSCJGJMMBHNJM-OCCSQVGLSA-N 2 0 236.359 2.091 20 0 BEADRP C[C@H]([NH2+]Cc1ccc(C[NH3+])cc1)C1CC1 ZINC000398171605 357857658 /nfs/dbraw/zinc/85/76/58/357857658.db2.gz IFACBPYIWVYPKD-JTQLQIEISA-N 2 0 204.317 2.033 20 0 BEADRP C[C@@H]([NH2+]CCCC[NH3+])c1cccc(F)c1F ZINC000235208413 357857797 /nfs/dbraw/zinc/85/77/97/357857797.db2.gz ALPGLMSRKMEZPN-SECBINFHSA-N 2 0 228.286 2.354 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+][C@H](C)CCC(C)C ZINC000234810646 357831753 /nfs/dbraw/zinc/83/17/53/357831753.db2.gz ZTKZJIXWPITSOF-OLZOCXBDSA-N 2 0 230.396 2.155 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+][C@@H]1CCCCC1(C)C ZINC000234744068 357834556 /nfs/dbraw/zinc/83/45/56/357834556.db2.gz AGOPRHCJHJJYRG-CHWSQXEVSA-N 2 0 242.407 2.299 20 0 BEADRP Cc1c[nH+]ccc1N1CC[C@@H]2[C@H](CCC[N@H+]2C)C1 ZINC000192693980 357847838 /nfs/dbraw/zinc/84/78/38/357847838.db2.gz XXQOSNDLFQQKDO-UKRRQHHQSA-N 2 0 245.370 2.311 20 0 BEADRP CCC1(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)CC1 ZINC000193014942 357864263 /nfs/dbraw/zinc/86/42/63/357864263.db2.gz YQDYTRVEAOGWOK-YHWZYXNKSA-N 2 0 222.376 2.391 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@H](C)[C@@H]2C[C@H]2C)CC1 ZINC000321513474 259474693 /nfs/dbraw/zinc/47/46/93/259474693.db2.gz IAFFSCQSGBGVEE-YRGRVCCFSA-N 2 0 224.392 2.493 20 0 BEADRP C[NH+](C)CCOCC[NH2+][C@H]1CCCCC1(C)C ZINC000219324072 357995092 /nfs/dbraw/zinc/99/50/92/357995092.db2.gz WDICCVKZICRGPE-ZDUSSCGKSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)[NH+]1CCC(C)([NH+]2CCCC2)CC1 ZINC000639981568 358025324 /nfs/dbraw/zinc/02/53/24/358025324.db2.gz LOBXITNZXQHJRL-UHFFFAOYSA-N 2 0 210.365 2.345 20 0 BEADRP CCc1ccccc1C[N@@H+]1CC[C@@H]([NH3+])[C@@H](C)C1 ZINC000217464335 134246812 /nfs/dbraw/zinc/24/68/12/134246812.db2.gz BKOLLYXTMPGIGK-SWLSCSKDSA-N 2 0 232.371 2.418 20 0 BEADRP CC[C@H](C[NH+]1CCC(CC)([NH+](C)C)CC1)OC ZINC000640015761 358069118 /nfs/dbraw/zinc/06/91/18/358069118.db2.gz MPOLYUXRQXLKJP-CYBMUJFWSA-N 2 0 242.407 2.218 20 0 BEADRP Cc1cscc1C[NH2+][C@H]1CCC[NH2+]CC1 ZINC000168772111 134248021 /nfs/dbraw/zinc/24/80/21/134248021.db2.gz OXDVJNZHVNBZGO-LBPRGKRZSA-N 2 0 224.373 2.288 20 0 BEADRP CC[C@H](N[C@H]1CCC[NH2+]CC1)c1nccs1 ZINC000168758214 134248087 /nfs/dbraw/zinc/24/80/87/134248087.db2.gz VOEDVDKSIQNVFU-QWRGUYRKSA-N 2 0 239.388 2.326 20 0 BEADRP C([NH2+]C(C1CC1)C1CC1)[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000037649099 358084989 /nfs/dbraw/zinc/08/49/89/358084989.db2.gz CYYXPSSBTUHCMK-NSHDSACASA-N 2 0 234.387 2.249 20 0 BEADRP C[N@@H+]1CCC[C@H]1CC[NH+]1CCC(C)(F)CC1 ZINC000640071275 358154644 /nfs/dbraw/zinc/15/46/44/358154644.db2.gz HNOVTVLYOYJMPR-LBPRGKRZSA-N 2 0 228.355 2.295 20 0 BEADRP CCC(C)(C)[C@H](C)[NH2+]C[C@@H]([NH3+])C(C)C ZINC000584774433 358174858 /nfs/dbraw/zinc/17/48/58/358174858.db2.gz TZVHXZQROKIMCY-WDEREUQCSA-N 2 0 200.370 2.384 20 0 BEADRP CCC(C)(C)[C@@H](C)[NH2+]C[C@@H]([NH3+])C(C)C ZINC000584774430 358175136 /nfs/dbraw/zinc/17/51/36/358175136.db2.gz TZVHXZQROKIMCY-GHMZBOCLSA-N 2 0 200.370 2.384 20 0 BEADRP C[C@H]1CCC[C@@H]([NH2+]C2CC([NH+](C)C)C2)C1 ZINC000584790306 358179875 /nfs/dbraw/zinc/17/98/75/358179875.db2.gz LNYAFTBZEXOAHE-ZFDZMSFRSA-N 2 0 210.365 2.247 20 0 BEADRP Cc1noc(C)c1C[NH2+]Cc1ccc(C[NH3+])cc1 ZINC000584838906 358198454 /nfs/dbraw/zinc/19/84/54/358198454.db2.gz AQSRVGNSAULGBO-UHFFFAOYSA-N 2 0 245.326 2.040 20 0 BEADRP COCC(C)(C)CCC[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000584848882 358208699 /nfs/dbraw/zinc/20/86/99/358208699.db2.gz ATNLSMRELIWWCA-QWHCGFSZSA-N 2 0 242.407 2.299 20 0 BEADRP COCC(C)(C)CCC[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000584848880 358208846 /nfs/dbraw/zinc/20/88/46/358208846.db2.gz ATNLSMRELIWWCA-CHWSQXEVSA-N 2 0 242.407 2.299 20 0 BEADRP CC(C)C[C@H]([NH3+])C[NH2+][C@H]1CCc2cc(N)ccc21 ZINC000578206657 366391668 /nfs/dbraw/zinc/39/16/68/366391668.db2.gz ZWOFAOMDHGHHLS-ZFWWWQNUSA-N 2 0 247.386 2.219 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@H]([NH3+])C[C@H]2C)s1 ZINC000226959817 358346954 /nfs/dbraw/zinc/34/69/54/358346954.db2.gz XDFPYVIBHICQNK-KOLCDFICSA-N 2 0 224.373 2.368 20 0 BEADRP Cc1cccc(C[N@H+]2CC[C@H]([NH3+])C[C@H]2C)c1 ZINC000226878794 358346981 /nfs/dbraw/zinc/34/69/81/358346981.db2.gz OGAWICBJXCBKIG-OCCSQVGLSA-N 2 0 218.344 2.307 20 0 BEADRP CCc1ccc(C[N@@H+]2CC[C@H]([NH3+])[C@@H](C)C2)s1 ZINC000227057429 358347568 /nfs/dbraw/zinc/34/75/68/358347568.db2.gz BPPVLRLHXLUTFQ-GWCFXTLKSA-N 2 0 238.400 2.480 20 0 BEADRP CC(C)[N@H+](CCC1CC[NH2+]CC1)CC1CC1 ZINC000042593581 358353449 /nfs/dbraw/zinc/35/34/49/358353449.db2.gz NCHPUNQWMRYALD-UHFFFAOYSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)[N@H+](CC1CC1)C[C@@H]1CCC[NH2+]C1 ZINC000042593607 358353641 /nfs/dbraw/zinc/35/36/41/358353641.db2.gz SUEKWZJFSZJLIO-CYBMUJFWSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@@H]1CCC[C@@H](C)C1 ZINC000219154221 134274460 /nfs/dbraw/zinc/27/44/60/134274460.db2.gz AMEBKHAIFFGZSP-JHJVBQTASA-N 2 0 212.381 2.495 20 0 BEADRP C[C@H]([N@H+](C)CC1CC[NH2+]CC1)C(C)(C)C ZINC000042781587 358358417 /nfs/dbraw/zinc/35/84/17/358358417.db2.gz QCLXCKZQVKZXSR-NSHDSACASA-N 2 0 212.381 2.352 20 0 BEADRP COC[C@H]([NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21)C(C)C ZINC000227541418 358359646 /nfs/dbraw/zinc/35/96/46/358359646.db2.gz QLNLWLKGTYEBDZ-KFWWJZLASA-N 2 0 248.370 2.392 20 0 BEADRP CSCC[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000173882851 134278240 /nfs/dbraw/zinc/27/82/40/134278240.db2.gz NZZOJRJDINFNLV-CYBMUJFWSA-N 2 0 242.432 2.157 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@H](C)c2ccncc2)CC1 ZINC000044517482 358388448 /nfs/dbraw/zinc/38/84/48/358388448.db2.gz RUUSOLZBFNGVSY-CYBMUJFWSA-N 2 0 247.386 2.464 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@@H](C)c2ccccn2)CC1 ZINC000044517424 358388608 /nfs/dbraw/zinc/38/86/08/358388608.db2.gz TVYZFDAMCFSEPY-ZDUSSCGKSA-N 2 0 247.386 2.464 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1cccc(O)c1 ZINC000044534559 358389975 /nfs/dbraw/zinc/38/99/75/358389975.db2.gz ZXDUYUYVSOILOH-STQMWFEESA-N 2 0 248.370 2.385 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1ccncc1 ZINC000044535028 358390139 /nfs/dbraw/zinc/39/01/39/358390139.db2.gz IUUHDEBWQKNNHR-CHWSQXEVSA-N 2 0 233.359 2.074 20 0 BEADRP CSCCC[N@@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000173786609 134277651 /nfs/dbraw/zinc/27/76/51/134277651.db2.gz DMLIDCUXROEJKB-CYBMUJFWSA-N 2 0 242.432 2.157 20 0 BEADRP CCCCOCCC[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000229340597 358402030 /nfs/dbraw/zinc/40/20/30/358402030.db2.gz PNUZTXRHIOIFCZ-STQMWFEESA-N 2 0 228.380 2.053 20 0 BEADRP CCCCOCCC[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000229340574 358402339 /nfs/dbraw/zinc/40/23/39/358402339.db2.gz PNUZTXRHIOIFCZ-OLZOCXBDSA-N 2 0 228.380 2.053 20 0 BEADRP COC1CCC([NH2+]CCC[NH+]2CCCC2)CC1 ZINC000129839733 358599130 /nfs/dbraw/zinc/59/91/30/358599130.db2.gz ZGHLOTBOOXMKLS-UHFFFAOYSA-N 2 0 240.391 2.020 20 0 BEADRP CC(C)CSCC[NH2+][C@H]1CC[N@H+](C)C[C@H]1C ZINC000131530349 358680499 /nfs/dbraw/zinc/68/04/99/358680499.db2.gz XIZBWKOUULTOOD-OLZOCXBDSA-N 2 0 244.448 2.305 20 0 BEADRP CC[C@@H](C)C[NH+]1CCC([NH2+]CC2CC2)CC1 ZINC000133231072 358749182 /nfs/dbraw/zinc/74/91/82/358749182.db2.gz RFVRDOPLGZFENV-GFCCVEGCSA-N 2 0 224.392 2.497 20 0 BEADRP COCC[C@H](C)[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000132136969 358708852 /nfs/dbraw/zinc/70/88/52/358708852.db2.gz PGHKVUVKERTPKP-LEWSCRJBSA-N 2 0 234.343 2.146 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCCC(F)(F)F)CC[N@@H+]1C ZINC000132334660 358719569 /nfs/dbraw/zinc/71/95/69/358719569.db2.gz KESZLUBLUSPBQK-ZJUUUORDSA-N 2 0 238.297 2.401 20 0 BEADRP Cc1cc(C)cc(OCCCN2CC[C@H]([NH3+])C2)c1 ZINC000050243288 358721070 /nfs/dbraw/zinc/72/10/70/358721070.db2.gz OVDQRYXYXBWAGV-AWEZNQCLSA-N 2 0 248.370 2.105 20 0 BEADRP C[C@]12C[C@H]1CCC[C@@H]2[NH2+]CC1([NH3+])CCC1 ZINC000423319400 192704521 /nfs/dbraw/zinc/70/45/21/192704521.db2.gz FEHAWWCDEIIRKW-WOPDTQHZSA-N 2 0 208.349 2.036 20 0 BEADRP [NH3+]CCCC[NH2+][C@H]1CCC[C@H]1CCCF ZINC000423332284 192713598 /nfs/dbraw/zinc/71/35/98/192713598.db2.gz QRXQXGAQRIHIDS-RYUDHWBXSA-N 2 0 216.344 2.233 20 0 BEADRP [NH3+]CCCC[NH2+]C1CCC(C(F)F)CC1 ZINC000423328622 192709989 /nfs/dbraw/zinc/70/99/89/192709989.db2.gz OABSKFZAVUVAPY-UHFFFAOYSA-N 2 0 220.307 2.139 20 0 BEADRP CC(C)[C@@H]1CCC[C@@H]([NH2+]CC2C[NH2+]C2)C1 ZINC000423331682 192711658 /nfs/dbraw/zinc/71/16/58/192711658.db2.gz UTCBOHGYFCJUKI-CHWSQXEVSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@H]([NH2+]CC1(C)CC[NH2+]CC1)c1cncs1 ZINC000423344828 192720861 /nfs/dbraw/zinc/72/08/61/192720861.db2.gz YGYMDVFQESTRAK-JTQLQIEISA-N 2 0 239.388 2.183 20 0 BEADRP CO[C@H](C[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1)C(C)(C)C ZINC000247136563 359196737 /nfs/dbraw/zinc/19/67/37/359196737.db2.gz QPQOCXBSLAJZDJ-FRRDWIJNSA-N 2 0 242.407 2.120 20 0 BEADRP C1=C(C[NH2+][C@@H]2CCCC[C@@H]2C2CC2)CC[NH2+]C1 ZINC000423349220 192724929 /nfs/dbraw/zinc/72/49/29/192724929.db2.gz WDFLBNAFCQYEFX-HUUCEWRRSA-N 2 0 234.387 2.465 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CCCCCOC)[C@@H](C)C1 ZINC000246940789 359176064 /nfs/dbraw/zinc/17/60/64/359176064.db2.gz HQKOAIOWVOXRMZ-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](C)CCCOC)C1 ZINC000247160928 359198299 /nfs/dbraw/zinc/19/82/99/359198299.db2.gz UDVZLZPBVDDEOP-ZIAGYGMSSA-N 2 0 242.407 2.123 20 0 BEADRP CC1CC([NH2+][C@H]2CC[N@H+](C)C(C)(C)C2)C1 ZINC000623439114 359331889 /nfs/dbraw/zinc/33/18/89/359331889.db2.gz WVCKQTGEJKPUTM-CXQJBGSLSA-N 2 0 210.365 2.247 20 0 BEADRP CC(C)C[C@H]1CCC[C@@H]([NH2+][C@@H]2[C@H]3C[NH2+]C[C@H]32)C1 ZINC000423455154 192776536 /nfs/dbraw/zinc/77/65/36/192776536.db2.gz MERDAOSYTPYSBR-ZSAUSMIDSA-N 2 0 236.403 2.399 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+]C[C@H]1CCC[C@H]([NH3+])C1 ZINC000423467411 192781331 /nfs/dbraw/zinc/78/13/31/192781331.db2.gz IVSKKEREXFXQIG-DYEKYZERSA-N 2 0 236.359 2.318 20 0 BEADRP Cc1cc(N)cc(C[NH2+][C@@H](C)CCCC[NH3+])c1 ZINC000423468548 192784512 /nfs/dbraw/zinc/78/45/12/192784512.db2.gz BJTFPLIIQGSVBB-LBPRGKRZSA-N 2 0 235.375 2.184 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[C@H]([NH3+])C1)c1cccnc1 ZINC000423474925 192787096 /nfs/dbraw/zinc/78/70/96/192787096.db2.gz PHPMCQNYVSFTOW-SCRDCRAPSA-N 2 0 233.359 2.250 20 0 BEADRP COc1ccc([C@H](C)[NH2+][C@H]2CC[C@@H](C[NH3+])C2)cc1 ZINC000423485682 192790645 /nfs/dbraw/zinc/79/06/45/192790645.db2.gz BCPAZBSMWHBQTO-SCRDCRAPSA-N 2 0 248.370 2.473 20 0 BEADRP C(C[NH2+][C@@H]1CC[C@@H]1C1CC1)C[C@@H]1CCC[NH2+]1 ZINC000423490418 192792625 /nfs/dbraw/zinc/79/26/25/192792625.db2.gz XTQSGQOQEAVZBT-BFHYXJOUSA-N 2 0 222.376 2.297 20 0 BEADRP C1=C(CC[NH2+][C@@H](C2CC2)C2CCC2)CC[NH2+]C1 ZINC000423543345 192809519 /nfs/dbraw/zinc/80/95/19/192809519.db2.gz VBVZIDWFFXHREI-OAHLLOKOSA-N 2 0 234.387 2.465 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]CC2=CCCCC2)C1 ZINC000379591797 359557233 /nfs/dbraw/zinc/55/72/33/359557233.db2.gz YCMNUBHVPOMYFX-QWHCGFSZSA-N 2 0 208.349 2.346 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]CC2=CCCCC2)C1 ZINC000379591796 359557254 /nfs/dbraw/zinc/55/72/54/359557254.db2.gz YCMNUBHVPOMYFX-OLZOCXBDSA-N 2 0 208.349 2.346 20 0 BEADRP CC(C)C1CC([NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)C1 ZINC000423555581 192812925 /nfs/dbraw/zinc/81/29/25/192812925.db2.gz XZQWRJAURBBOHG-HNBOJAAESA-N 2 0 236.403 2.399 20 0 BEADRP CCC[NH+]1CCC([NH2+]C[C@@H](C)C2CC2)CC1 ZINC000132909920 491142113 /nfs/dbraw/zinc/14/21/13/491142113.db2.gz JLHCRLLTUVXBTP-GFCCVEGCSA-N 2 0 224.392 2.497 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]C2CC(C)C2)[C@H](C)C1 ZINC000130382291 359693553 /nfs/dbraw/zinc/69/35/53/359693553.db2.gz ZITIMHXPCDOWNA-POOIEITISA-N 2 0 210.365 2.105 20 0 BEADRP CCC(=O)CCC[N@@H+]1CCC[C@@H]([NH+](C)C)CC1 ZINC000450852429 202290669 /nfs/dbraw/zinc/29/06/69/202290669.db2.gz FLAUGOCDYCMKDK-CYBMUJFWSA-N 2 0 240.391 2.162 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+][C@@H](C)CC1CCC1 ZINC000133007685 491145233 /nfs/dbraw/zinc/14/52/33/491145233.db2.gz LGQHKXCDSFYVLL-RYUDHWBXSA-N 2 0 212.381 2.495 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@H](C)CC1CCC1 ZINC000133008300 491145247 /nfs/dbraw/zinc/14/52/47/491145247.db2.gz LGQHKXCDSFYVLL-VXGBXAGGSA-N 2 0 212.381 2.495 20 0 BEADRP C[C@@H](Cn1ccnc1)[NH2+][C@H]1CCC(C)(C)C1 ZINC000087770974 359926325 /nfs/dbraw/zinc/92/63/25/359926325.db2.gz AKERRPBEECJFPG-RYUDHWBXSA-N 2 0 221.348 2.440 20 0 BEADRP C[C@H](Cn1ccnc1)[NH2+][C@H]1CCC(C)(C)C1 ZINC000087770976 359926507 /nfs/dbraw/zinc/92/65/07/359926507.db2.gz AKERRPBEECJFPG-NEPJUHHUSA-N 2 0 221.348 2.440 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@H]2CCC[C@@H](F)C2)C1 ZINC000578787452 366650501 /nfs/dbraw/zinc/65/05/01/366650501.db2.gz PEOVDXUUAZIOMO-WYUUTHIRSA-N 2 0 214.328 2.127 20 0 BEADRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]CCCc1ccccc1 ZINC000089147661 359993719 /nfs/dbraw/zinc/99/37/19/359993719.db2.gz QCDFXZQLANPMIM-CABCVRRESA-N 2 0 232.371 2.336 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]CCc1ccc(O)cc1 ZINC000089145573 359993030 /nfs/dbraw/zinc/99/30/30/359993030.db2.gz YJNWSRBUINMXBC-ZFWWWQNUSA-N 2 0 248.370 2.042 20 0 BEADRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]Cc1cc(F)ccc1F ZINC000089150686 359993826 /nfs/dbraw/zinc/99/38/26/359993826.db2.gz BXNGBPTVFGXTGZ-RNCFNFMXSA-N 2 0 240.297 2.182 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCCC[C@@H]1C[NH3+])c1ccccn1 ZINC000089139981 359993211 /nfs/dbraw/zinc/99/32/11/359993211.db2.gz DQTGHNJQYARDHW-OUCADQQQSA-N 2 0 233.359 2.250 20 0 BEADRP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+]C2CSC2)C1 ZINC000309360468 491147490 /nfs/dbraw/zinc/14/74/90/491147490.db2.gz OOKKLHZARDAKRR-LBPRGKRZSA-N 2 0 242.432 2.059 20 0 BEADRP CC(C)[C@@H]([NH2+]C1CCN(C)CC1)c1cccnc1 ZINC000091266444 360110417 /nfs/dbraw/zinc/11/04/17/360110417.db2.gz SCKIRRSJPBRTKG-OAHLLOKOSA-N 2 0 247.386 2.463 20 0 BEADRP CC[C@@H](C)C[NH2+]C1CC[NH+](CCCOC)CC1 ZINC000093066872 360213437 /nfs/dbraw/zinc/21/34/37/360213437.db2.gz RTNMCOPYTRXJPO-CYBMUJFWSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000095015555 360331348 /nfs/dbraw/zinc/33/13/48/360331348.db2.gz OUXRQVDXXIDWEB-SYQHCUMBSA-N 2 0 222.376 2.391 20 0 BEADRP C[C@H](CCCO)[NH2+][C@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000094941528 360327158 /nfs/dbraw/zinc/32/71/58/360327158.db2.gz WSMNXFQKBUBUOV-MCIONIFRSA-N 2 0 242.407 2.048 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@H]2CC[N@H+](C)C(C)(C)C2)CCO1 ZINC000623481306 360443341 /nfs/dbraw/zinc/44/33/41/360443341.db2.gz ZLLZYFCKQAVUSA-AGIUHOORSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@H]([NH2+]CCC1(C)CC1)C1CC[NH+](C)CC1 ZINC000309475054 491149418 /nfs/dbraw/zinc/14/94/18/491149418.db2.gz RTEUSYRQEWDKMS-LBPRGKRZSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)[C@H](C)[N@H+](C)CC[C@@H]1CCC[NH2+]C1 ZINC000051919023 200712368 /nfs/dbraw/zinc/71/23/68/200712368.db2.gz ILCLDUCLYHAHAE-STQMWFEESA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H]([NH3+])[C@@H]1CC[N@H+](C[C@@H]2C[C@H]2c2ccccc2)C1 ZINC000414665781 200757734 /nfs/dbraw/zinc/75/77/34/200757734.db2.gz VXUYPEYEBPPIFM-OJLVUWQFSA-N 2 0 244.382 2.459 20 0 BEADRP C[C@H](CCc1ccsc1)[NH2+]C1CC[NH2+]CC1 ZINC000414787613 200763828 /nfs/dbraw/zinc/76/38/28/200763828.db2.gz ZLYKWQXIULDGGK-LLVKDONJSA-N 2 0 238.400 2.411 20 0 BEADRP C[C@@H](CCC(F)(F)F)[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000414837068 200767607 /nfs/dbraw/zinc/76/76/07/200767607.db2.gz UBRXUHJJNQFIAJ-VHSXEESVSA-N 2 0 238.297 2.307 20 0 BEADRP [NH3+]CCCC[NH2+][C@@H]1CCCC[C@@H]1C1CC1 ZINC000414902509 200779316 /nfs/dbraw/zinc/77/93/16/200779316.db2.gz JUWHDVSFDHEENO-CHWSQXEVSA-N 2 0 210.365 2.284 20 0 BEADRP CC[C@@H]([NH2+]CC1CC[NH+](C)CC1)c1ccncc1 ZINC000453114457 200788649 /nfs/dbraw/zinc/78/86/49/200788649.db2.gz VNICLRNBBSLSAZ-OAHLLOKOSA-N 2 0 247.386 2.464 20 0 BEADRP C[C@H](CC1CCCC1)[NH2+]CC1([NH3+])CCC1 ZINC000414883504 200774176 /nfs/dbraw/zinc/77/41/76/200774176.db2.gz VEWRSZRZRXTGNK-LLVKDONJSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@@H]1C[N@@H+](CCC2CC[NH2+]CC2)C[C@H](C)S1 ZINC000069910108 361018023 /nfs/dbraw/zinc/01/80/23/361018023.db2.gz SNRBWXQYTPMIJT-TXEJJXNPSA-N 2 0 242.432 2.202 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1[NH2+][C@@H]1CCCC1(C)C ZINC000629390316 361038070 /nfs/dbraw/zinc/03/80/70/361038070.db2.gz NYJYNUFKNZOTCK-QJPTWQEYSA-N 2 0 210.365 2.295 20 0 BEADRP Cc1cnccc1CC[NH2+][C@@H](C)CCCC[NH3+] ZINC000423016276 200855441 /nfs/dbraw/zinc/85/54/41/200855441.db2.gz SPGYZZMHZVFLNS-ZDUSSCGKSA-N 2 0 235.375 2.040 20 0 BEADRP [NH3+]CCCOCC[NH2+]Cc1cccc(C2CC2)c1 ZINC000629400561 361052154 /nfs/dbraw/zinc/05/21/54/361052154.db2.gz DICWDGWGWGMZCW-UHFFFAOYSA-N 2 0 248.370 2.019 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+][C@H]1CCCC[C@H]1C1CC1 ZINC000629408447 361059234 /nfs/dbraw/zinc/05/92/34/361059234.db2.gz VIYKHVQXOSAOTN-DEQVHRJGSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+][C@@H]1CCCC[C@@H]1C1CC1 ZINC000629408448 361059686 /nfs/dbraw/zinc/05/96/86/361059686.db2.gz VIYKHVQXOSAOTN-IGHBBLSQSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@H]1CC[C@H](NCc2cccc3c2CCC3)C[NH2+]1 ZINC000629418377 361062983 /nfs/dbraw/zinc/06/29/83/361062983.db2.gz XKFSKMJUQQXZOG-WFASDCNBSA-N 2 0 244.382 2.405 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+][C@@H]1CC[C@@H](C)NC1 ZINC000629418402 361063163 /nfs/dbraw/zinc/06/31/63/361063163.db2.gz XTXSZKVBKTVICO-OPRDCNLKSA-N 2 0 238.297 2.448 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC[NH2+]C12CCC2)C1CCCC1 ZINC000629521173 361117717 /nfs/dbraw/zinc/11/77/17/361117717.db2.gz RXKMVFQZIWZOOM-DGCLKSJQSA-N 2 0 222.376 2.439 20 0 BEADRP C[C@H]1C[NH+](CC2CC[NH2+]CC2)C[C@H](C)C1(F)F ZINC000629497106 361098976 /nfs/dbraw/zinc/09/89/76/361098976.db2.gz VEIFAOGHTAJTCO-QWRGUYRKSA-N 2 0 246.345 2.209 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1[NH2+][C@@H]1CCCC12CCC2 ZINC000629528097 361135627 /nfs/dbraw/zinc/13/56/27/361135627.db2.gz PDVBKCBFQDMUNG-YNEHKIRRSA-N 2 0 222.376 2.439 20 0 BEADRP CCO[C@@H](C[N@@H+]1CCCC[C@H]1CC[NH3+])C1CC1 ZINC000629531655 361148868 /nfs/dbraw/zinc/14/88/68/361148868.db2.gz SUIWLOSJSLONAX-KBPBESRZSA-N 2 0 240.391 2.005 20 0 BEADRP CC[C@H]1CCC[C@@H]1[NH2+][C@@H]1CC[NH2+][C@H]1CC ZINC000629526282 361127715 /nfs/dbraw/zinc/12/77/15/361127715.db2.gz OTEGGOFFBJMZGW-ZDEQEGDKSA-N 2 0 210.365 2.295 20 0 BEADRP CC1CC(C[NH2+][C@H]2CC[NH2+]CC[C@@H]2C)C1 ZINC000622044443 370672521 /nfs/dbraw/zinc/67/25/21/370672521.db2.gz FSVHQJDOIGLPOY-MVKMKZAISA-N 2 0 210.365 2.010 20 0 BEADRP C[C@H]([NH2+]CC1CC(C)C1)[C@H]1CCCC[NH2+]1 ZINC000622044869 370674610 /nfs/dbraw/zinc/67/46/10/370674610.db2.gz WGGDSEXHQAMGHZ-PYNQCMFNSA-N 2 0 210.365 2.153 20 0 BEADRP CC1CC(C[NH2+]C2CCC(C[NH3+])CC2)C1 ZINC000622044683 370676652 /nfs/dbraw/zinc/67/66/52/370676652.db2.gz PNLCXDRTKRFRPK-UHFFFAOYSA-N 2 0 210.365 2.140 20 0 BEADRP CC[C@H]([NH2+]CC1CC(C)C1)[C@@H]1CCC[NH2+]1 ZINC000622044492 370676791 /nfs/dbraw/zinc/67/67/91/370676791.db2.gz HYXYHYYVUOFMEU-TYUFSLCMSA-N 2 0 210.365 2.153 20 0 BEADRP CCCCO[C@H]1C[C@@H]([NH2+]CC[C@H](C)[NH3+])C1(C)C ZINC000622045308 370680190 /nfs/dbraw/zinc/68/01/90/370680190.db2.gz LURWZBYMPMUOIV-XQQFMLRXSA-N 2 0 242.407 2.297 20 0 BEADRP [NH3+]CCCOCC[NH2+][C@@H]1CCCc2ccccc21 ZINC000629539475 361406052 /nfs/dbraw/zinc/40/60/52/361406052.db2.gz MHWJIUJEKHGBDG-OAHLLOKOSA-N 2 0 248.370 2.019 20 0 BEADRP COC(C)(C)CC[N@@H+]1CCC[C@H]([NH+](C)C)CC1 ZINC000429541357 201112981 /nfs/dbraw/zinc/11/29/81/201112981.db2.gz OPLJBKUXDNJOOT-ZDUSSCGKSA-N 2 0 242.407 2.218 20 0 BEADRP C[C@H]([NH2+]CCOCCC[NH3+])[C@H]1CCCC[C@H]1C ZINC000629538572 361403556 /nfs/dbraw/zinc/40/35/56/361403556.db2.gz NWPVYKNOZVEMEL-RDBSUJKOSA-N 2 0 242.407 2.156 20 0 BEADRP CC(C)[C@H](N[C@@H]1CC[NH2+][C@H]1C)c1cccnc1 ZINC000629543544 361411160 /nfs/dbraw/zinc/41/11/60/361411160.db2.gz BTSQYMUGOKTWIH-YUTCNCBUSA-N 2 0 233.359 2.119 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+][C@@H]1CC[C@@H]1C(C)(C)C ZINC000629543801 361412726 /nfs/dbraw/zinc/41/27/26/361412726.db2.gz BQULZLDWYBGSAW-NNYUYHANSA-N 2 0 210.365 2.151 20 0 BEADRP C[NH2+]CCC[N@@H+]1CC(C)(C)CCC1(C)C ZINC000629543715 361412866 /nfs/dbraw/zinc/41/28/66/361412866.db2.gz ABPZCIRVOLICOF-UHFFFAOYSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@]1(C[NH2+][C@@H]2CCC[C@H]2C[NH3+])C[C@H]2C[C@H]2C1 ZINC000629539849 361413192 /nfs/dbraw/zinc/41/31/92/361413192.db2.gz RTAADEQEMGBWCC-ODXJTPSBSA-N 2 0 222.376 2.140 20 0 BEADRP CC[C@@H]([NH2+][C@@H]1C[C@@H](C)O[C@@H](C)C1)[C@@H]1CCC[NH2+]1 ZINC000579461670 366812803 /nfs/dbraw/zinc/81/28/03/366812803.db2.gz MZZRUXTVXZYNEH-ITGHMWBKSA-N 2 0 240.391 2.063 20 0 BEADRP [NH3+]CCCOCC[NH2+][C@@H](c1ccccc1)C1CC1 ZINC000629540493 361414692 /nfs/dbraw/zinc/41/46/92/361414692.db2.gz VCNNZJMAGSSQID-HNNXBMFYSA-N 2 0 248.370 2.093 20 0 BEADRP CC[C@H]([NH2+][C@@H]1C[C@@H](C)O[C@@H](C)C1)[C@@H]1CCC[NH2+]1 ZINC000579461672 366812928 /nfs/dbraw/zinc/81/29/28/366812928.db2.gz MZZRUXTVXZYNEH-NDKCEZKHSA-N 2 0 240.391 2.063 20 0 BEADRP CCC1(CC)[C@H](OC)C[C@@H]1[NH2+]CCC[NH+](C)C ZINC000181393035 366806974 /nfs/dbraw/zinc/80/69/74/366806974.db2.gz AGNDGOLUKZELMQ-QWHCGFSZSA-N 2 0 242.407 2.121 20 0 BEADRP CCC[C@H]([NH2+]CCOCCC[NH3+])C1CCCC1 ZINC000629534934 361408408 /nfs/dbraw/zinc/40/84/08/361408408.db2.gz BASKKLNQBRGMPY-AWEZNQCLSA-N 2 0 242.407 2.300 20 0 BEADRP CC[C@H]1CCCC[C@@H]1[NH2+][C@@H]1CC[NH2+][C@H]1C ZINC000629544288 361420856 /nfs/dbraw/zinc/42/08/56/361420856.db2.gz JBBDGIAWZIJJOG-RVMXOQNASA-N 2 0 210.365 2.295 20 0 BEADRP C[C@@H](CCCC(F)(F)F)[NH2+][C@@H]1CC[NH2+][C@H]1C ZINC000629544335 361421481 /nfs/dbraw/zinc/42/14/81/361421481.db2.gz JWTNNYUBKWTILG-LPEHRKFASA-N 2 0 238.297 2.448 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+][C@@H]1CCC12CCCC2 ZINC000629544955 361424895 /nfs/dbraw/zinc/42/48/95/361424895.db2.gz OKEXYPBWEBTXHM-QJPTWQEYSA-N 2 0 208.349 2.049 20 0 BEADRP C[C@H]1CC(C)(C)C[C@H]1[NH2+][C@@H]1CC[NH2+][C@H]1C ZINC000629545683 361427002 /nfs/dbraw/zinc/42/70/02/361427002.db2.gz QAZFMBQVELFISU-NNYUYHANSA-N 2 0 210.365 2.151 20 0 BEADRP CC[C@@H]1CC[C@@H](C)C[C@@H]1[NH2+][C@@H]1CC[NH2+]C1 ZINC000629553179 361437890 /nfs/dbraw/zinc/43/78/90/361437890.db2.gz LVEJYLCQJPMURG-LPWJVIDDSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)=CCC[C@@H](C)[NH2+]CCOCCC[NH3+] ZINC000629542293 361419589 /nfs/dbraw/zinc/41/95/89/361419589.db2.gz XXMNPBACURRKEQ-CYBMUJFWSA-N 2 0 228.380 2.076 20 0 BEADRP C[NH2+]CCOCC[N@H+](C)CCCC1CCCC1 ZINC000629571536 361462942 /nfs/dbraw/zinc/46/29/42/361462942.db2.gz NVQWTEDPDPCWHS-UHFFFAOYSA-N 2 0 242.407 2.125 20 0 BEADRP CCc1ccc(CC[NH+]2CCC([NH2+]C)CC2)cc1 ZINC000430952867 201159250 /nfs/dbraw/zinc/15/92/50/201159250.db2.gz FNJWNYGDVJZRNI-UHFFFAOYSA-N 2 0 246.398 2.475 20 0 BEADRP COc1cccc2c1C[N@H+](CC[C@@H]1CC[NH2+]C1)C2 ZINC000629581877 361472084 /nfs/dbraw/zinc/47/20/84/361472084.db2.gz IVSBJNUJTFEPFO-LBPRGKRZSA-N 2 0 246.354 2.010 20 0 BEADRP C(CC1CC[NH2+]CC1)C[NH+](C1CC1)C1CC1 ZINC000629562561 361456231 /nfs/dbraw/zinc/45/62/31/361456231.db2.gz DGSROKHJVSADTD-UHFFFAOYSA-N 2 0 222.376 2.393 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1[NH2+]C[C@H](C)CC(C)C ZINC000629566543 361457898 /nfs/dbraw/zinc/45/78/98/361457898.db2.gz ULBJZXXCCBKPAB-FRRDWIJNSA-N 2 0 212.381 2.399 20 0 BEADRP CCO[C@H](CC[NH+](C)C)C[NH2+]C1CC(C)(C)C1 ZINC000433294203 201175428 /nfs/dbraw/zinc/17/54/28/201175428.db2.gz KHNOFDXVSAJLNU-CYBMUJFWSA-N 2 0 242.407 2.121 20 0 BEADRP Cc1cnccc1C[NH2+]C[C@H](N)c1ccccc1 ZINC000629647947 361539570 /nfs/dbraw/zinc/53/95/70/361539570.db2.gz LNLKGXLKBCIMTG-HNNXBMFYSA-N 2 0 241.338 2.180 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]CC1=Cc2ccccc2OC1 ZINC000629649607 361544349 /nfs/dbraw/zinc/54/43/49/361544349.db2.gz WUHAXVKHRIKBGG-LBPRGKRZSA-N 2 0 246.354 2.179 20 0 BEADRP C[C@@H]1C[NH+](C[C@@]2(C)CC[NH2+]C2)C[C@@H](C)C1(F)F ZINC000629649984 361545908 /nfs/dbraw/zinc/54/59/08/361545908.db2.gz MWPMTDCBVGJAAY-UTUOFQBUSA-N 2 0 246.345 2.209 20 0 BEADRP CCCCC[NH2+][C@@H]1CC[N@H+](CC)C[C@@H]1C ZINC000152215204 201191073 /nfs/dbraw/zinc/19/10/73/201191073.db2.gz XFDNHZZPZHCRRX-QWHCGFSZSA-N 2 0 212.381 2.497 20 0 BEADRP CC[C@@H](C)[NH2+]C1CC[NH+](CC(C)C)CC1 ZINC000152153557 201191463 /nfs/dbraw/zinc/19/14/63/201191463.db2.gz LFGDNZPXDQHNFC-GFCCVEGCSA-N 2 0 212.381 2.495 20 0 BEADRP [NH3+]CCCOCC[NH2+]CCC1CCCCCC1 ZINC000629677713 361600921 /nfs/dbraw/zinc/60/09/21/361600921.db2.gz DVCGINRJFXNUSO-UHFFFAOYSA-N 2 0 242.407 2.302 20 0 BEADRP [NH3+]C1CCC([NH2+]Cc2ccsc2)CC1 ZINC000051692946 181341016 /nfs/dbraw/zinc/34/10/16/181341016.db2.gz IJKPVRZUOVGYRB-UHFFFAOYSA-N 2 0 210.346 2.108 20 0 BEADRP CC[N@H+](Cc1ccc(C)cn1)[C@@H]1CCC[NH2+]CC1 ZINC000435379099 201265824 /nfs/dbraw/zinc/26/58/24/201265824.db2.gz AYTVPWAFLBMPHW-OAHLLOKOSA-N 2 0 247.386 2.354 20 0 BEADRP CC[N@H+](Cc1cccnc1C)[C@H]1CCC[NH2+]CC1 ZINC000435381594 201266182 /nfs/dbraw/zinc/26/61/82/201266182.db2.gz UVLBIJJPKUGWSZ-HNNXBMFYSA-N 2 0 247.386 2.354 20 0 BEADRP CC[N@H+](Cc1cccnc1)[C@@H]1CCC[NH2+]CC1 ZINC000435389683 201267003 /nfs/dbraw/zinc/26/70/03/201267003.db2.gz LUSRKFGGGKQLBD-CQSZACIVSA-N 2 0 233.359 2.046 20 0 BEADRP [NH3+]C1CCC([NH2+]Cc2ccc(F)cc2F)CC1 ZINC000051693539 181341610 /nfs/dbraw/zinc/34/16/10/181341610.db2.gz PHLJYBOLNUNGRF-UHFFFAOYSA-N 2 0 240.297 2.324 20 0 BEADRP [NH3+]C/C=C/c1ccc(C2=CC[NH2+]CC2)cc1 ZINC000629724151 361664723 /nfs/dbraw/zinc/66/47/23/361664723.db2.gz YTVTXBANCGJCRT-OWOJBTEDSA-N 2 0 214.312 2.035 20 0 BEADRP Cc1cc(C2=CC[NH2+]CC2)cc2c1C[NH2+]CC2 ZINC000629724130 361664821 /nfs/dbraw/zinc/66/48/21/361664821.db2.gz YAGQLZXABXVSEV-UHFFFAOYSA-N 2 0 228.339 2.017 20 0 BEADRP C[C@@H]([NH3+])c1cccc(C2=CC[NH2+]CC2)c1 ZINC000629723809 361665777 /nfs/dbraw/zinc/66/57/77/361665777.db2.gz QWWYQHCAJFWJSM-SNVBAGLBSA-N 2 0 202.301 2.083 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCC[C@@H]1c1ccccc1 ZINC000435872273 201289565 /nfs/dbraw/zinc/28/95/65/201289565.db2.gz NTBUYBNMDUBJEE-CQSZACIVSA-N 2 0 218.344 2.433 20 0 BEADRP c1cc(C2=CC[NH2+]CC2)cc([C@H]2CC[NH2+]C2)c1 ZINC000629722475 361662653 /nfs/dbraw/zinc/66/26/53/361662653.db2.gz AZGQMVSCWHBQHD-HNNXBMFYSA-N 2 0 228.339 2.140 20 0 BEADRP CC(C)(C[NH3+])c1ccc(C2=CC[NH2+]CC2)cc1 ZINC000629722890 361663739 /nfs/dbraw/zinc/66/37/39/361663739.db2.gz GMOLLBGLSFEBOA-UHFFFAOYSA-N 2 0 230.355 2.300 20 0 BEADRP C[NH2+]CCC[N@@H+]1CC[C@@H](c2ccccc2OC)C1 ZINC000435878061 201293888 /nfs/dbraw/zinc/29/38/88/201293888.db2.gz XPGLWWTYSYKDJA-CYBMUJFWSA-N 2 0 248.370 2.094 20 0 BEADRP C[NH2+]CCC[N@@H+]1CC[C@](C)(c2ccccc2)C1 ZINC000435881150 201294247 /nfs/dbraw/zinc/29/42/47/201294247.db2.gz SRPVJXBQPZRFQD-HNNXBMFYSA-N 2 0 232.371 2.260 20 0 BEADRP [NH3+]C1CC[NH+](CCC2CCCCC2)CC1 ZINC000037741962 181344058 /nfs/dbraw/zinc/34/40/58/181344058.db2.gz NAFHKBZXYAAHBR-UHFFFAOYSA-N 2 0 210.365 2.380 20 0 BEADRP Cc1ccc(C[NH2+]CCC2CC[NH+](C)CC2)cn1 ZINC000155803363 201352843 /nfs/dbraw/zinc/35/28/43/201352843.db2.gz VOIJDDOGLKRVFD-UHFFFAOYSA-N 2 0 247.386 2.212 20 0 BEADRP C[C@@H](CCc1cccc(F)c1)[NH2+]CCC[NH3+] ZINC000437776281 201371150 /nfs/dbraw/zinc/37/11/50/201371150.db2.gz QRZVAADXCGZDQR-NSHDSACASA-N 2 0 224.323 2.085 20 0 BEADRP CCC[C@H](Cc1ccccc1)[NH2+]CCC[NH3+] ZINC000437769473 201372350 /nfs/dbraw/zinc/37/23/50/201372350.db2.gz FFNYCGGARSPUKG-CQSZACIVSA-N 2 0 220.360 2.336 20 0 BEADRP Cc1ccc(CC[C@@H](C)[NH2+]CCC[NH3+])cc1 ZINC000437782592 201372503 /nfs/dbraw/zinc/37/25/03/201372503.db2.gz GJODOUWYJXOMMQ-CYBMUJFWSA-N 2 0 220.360 2.255 20 0 BEADRP CC(F)(F)CC[NH2+][C@H]1CCCC[C@H]1C[NH3+] ZINC000357716675 167816254 /nfs/dbraw/zinc/81/62/54/167816254.db2.gz OWQBZLCFGJGDKC-UWVGGRQHSA-N 2 0 220.307 2.139 20 0 BEADRP C(C[N@@H+]1CC[C@@H]2CCCC[C@@H]21)[C@@H]1CC[NH2+]C1 ZINC000134827617 364415228 /nfs/dbraw/zinc/41/52/28/364415228.db2.gz ZSOBJHPJYOMJRE-IHRRRGAJSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCc2nc[nH]c2C1)c1cncs1 ZINC000573530074 364855172 /nfs/dbraw/zinc/85/51/72/364855172.db2.gz QPTRFJOIXBEKNR-RKDXNWHRSA-N 2 0 248.355 2.074 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH+](C)CC2(C)CC2)[C@H](C)C1 ZINC000573633582 364879671 /nfs/dbraw/zinc/87/96/71/364879671.db2.gz HDMHDWVVFURXKB-CHWSQXEVSA-N 2 0 224.392 2.449 20 0 BEADRP CCC(C)(C)[C@@H](C)[NH2+]CC1=CC[NH2+]CC1 ZINC000573793393 364916405 /nfs/dbraw/zinc/91/64/05/364916405.db2.gz KHPZQIJHEKWEIB-LLVKDONJSA-N 2 0 210.365 2.320 20 0 BEADRP COC1CCC(C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)CC1 ZINC000573696555 364896463 /nfs/dbraw/zinc/89/64/63/364896463.db2.gz JVQFQZAPCNVPAG-CEUNDQEZSA-N 2 0 240.391 2.051 20 0 BEADRP [NH3+]CCCC[NH2+][C@H]1CCCC12CCCC2 ZINC000328095223 181377177 /nfs/dbraw/zinc/37/71/77/181377177.db2.gz JQCGJJNUAVQRSX-LBPRGKRZSA-N 2 0 210.365 2.428 20 0 BEADRP [NH3+]CCCC[NH2+][C@@H]1CCCC12CCCC2 ZINC000328095222 181377527 /nfs/dbraw/zinc/37/75/27/181377527.db2.gz JQCGJJNUAVQRSX-GFCCVEGCSA-N 2 0 210.365 2.428 20 0 BEADRP [NH3+]CCC[NH+]1CCC(c2ccc(F)cc2)CC1 ZINC000057527908 181379527 /nfs/dbraw/zinc/37/95/27/181379527.db2.gz VFMQCWPKRRNFKO-UHFFFAOYSA-N 2 0 236.334 2.354 20 0 BEADRP [NH3+]CCC[N@H+](Cc1cccs1)C1CC1 ZINC000042515259 181379863 /nfs/dbraw/zinc/37/98/63/181379863.db2.gz CMJCQGXLHMYCRC-UHFFFAOYSA-N 2 0 210.346 2.061 20 0 BEADRP [NH3+]CCCN[C@@H](c1ccccc1)c1ccccn1 ZINC000037713183 181382887 /nfs/dbraw/zinc/38/28/87/181382887.db2.gz ZKLNYNFLOKDNJJ-HNNXBMFYSA-N 2 0 241.338 2.109 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@@H]1CCCC12CC2 ZINC000574412636 365058116 /nfs/dbraw/zinc/05/81/16/365058116.db2.gz DGYCLLNDYPQCDH-GFCCVEGCSA-N 2 0 210.365 2.251 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]CC2(C(F)(F)F)CC2)C1 ZINC000574415530 365059225 /nfs/dbraw/zinc/05/92/25/365059225.db2.gz YVGBSNZZCVZJCZ-DTWKUNHWSA-N 2 0 236.281 2.188 20 0 BEADRP [NH3+]CCOCC[NH2+][C@@H](c1ccccc1)C1CCC1 ZINC000357078592 181399025 /nfs/dbraw/zinc/39/90/25/181399025.db2.gz LLRFLBPQIKIMAQ-HNNXBMFYSA-N 2 0 248.370 2.093 20 0 BEADRP C[C@H]1CCCC[C@@H]1C[N@@H+]1C[C@@H]2CCC[NH2+][C@@H]2C1 ZINC000574793028 365145942 /nfs/dbraw/zinc/14/59/42/365145942.db2.gz AJRHWVIPXWLCCF-LJISPDSOSA-N 2 0 236.403 2.497 20 0 BEADRP CC[C@H]([NH2+]CCC[NH+]1CCCC1)[C@@H]1CCCO1 ZINC000182330834 366887206 /nfs/dbraw/zinc/88/72/06/366887206.db2.gz CUKRRPJXKRCUNA-KBPBESRZSA-N 2 0 240.391 2.020 20 0 BEADRP C[C@@H]([NH3+])c1ccc(C[NH2+]CC2(F)CC2)cc1 ZINC000575715627 365343644 /nfs/dbraw/zinc/34/36/44/365343644.db2.gz NIQFVPXPTDLFMT-SNVBAGLBSA-N 2 0 222.307 2.298 20 0 BEADRP CC(C)[C@H]([NH2+]CCC1=CC[NH2+]CC1)C1CC1 ZINC000576027541 365453306 /nfs/dbraw/zinc/45/33/06/365453306.db2.gz PJACBCYXTYJFAN-AWEZNQCLSA-N 2 0 222.376 2.320 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@@H]2CCCC(F)(F)C2)C1 ZINC000579614117 366910570 /nfs/dbraw/zinc/91/05/70/366910570.db2.gz RFPCPZNXOGYQBL-GMTAPVOTSA-N 2 0 232.318 2.424 20 0 BEADRP COc1ccc(C)cc1C[NH2+][C@H](C)C[C@H](C)[NH3+] ZINC000579700063 366982909 /nfs/dbraw/zinc/98/29/09/366982909.db2.gz LSCUZJCISLZZIP-NWDGAFQWSA-N 2 0 236.359 2.219 20 0 BEADRP C[NH2+]Cc1ccc(N[C@H]2CCC[C@@H]([NH3+])C2)cc1 ZINC000579978706 367114474 /nfs/dbraw/zinc/11/44/74/367114474.db2.gz AHQUTWOZNMYUJD-OCCSQVGLSA-N 2 0 233.359 2.088 20 0 BEADRP C[C@@H]1C[C@H](C[N@H+](C)Cc2cccc(O)c2)CC[NH2+]1 ZINC000580939948 367210252 /nfs/dbraw/zinc/21/02/52/367210252.db2.gz NKZDVDVQNBLKHF-TZMCWYRMSA-N 2 0 248.370 2.212 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@@H]2CC[NH2+][C@H](C)C2)[C@H]1C ZINC000380669942 367276446 /nfs/dbraw/zinc/27/64/46/367276446.db2.gz KXHAGPLNWSLCBW-FVCCEPFGSA-N 2 0 210.365 2.105 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@H](c2cccnc2)C2CC2)C1 ZINC000581143568 367277233 /nfs/dbraw/zinc/27/72/33/367277233.db2.gz XLGILDHLVTYSNR-ILXRZTDVSA-N 2 0 245.370 2.392 20 0 BEADRP C[C@@H]1C[N@H+](C[C@@H]2CC[NH2+][C@H](C)C2)C(C)(C)C1 ZINC000380504664 367225032 /nfs/dbraw/zinc/22/50/32/367225032.db2.gz IDPWOPIMJBAKRU-YNEHKIRRSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[NH2+]C1)[C@H]1CC2CCC1CC2 ZINC000382203938 367497945 /nfs/dbraw/zinc/49/79/45/367497945.db2.gz SBCVHUPVBMGWSG-FDZXDKCCSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+][C@@H]1CCC[C@H]2C[C@H]21 ZINC000382181452 367494712 /nfs/dbraw/zinc/49/47/12/367494712.db2.gz ZNMRCCKAFUCEGM-WUHRBBMRSA-N 2 0 210.365 2.105 20 0 BEADRP CC1(C)CCC[C@H]1[NH2+]CCC[NH2+]C1CC1 ZINC000382608009 367548244 /nfs/dbraw/zinc/54/82/44/367548244.db2.gz ZQUKONZWASHPNB-GFCCVEGCSA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@@H]1CCC[C@H]1[NH2+]C[C@H](C)C[NH+](C)C ZINC000382366855 367512097 /nfs/dbraw/zinc/51/20/97/367512097.db2.gz WQBGUGOUMOJDAY-YNEHKIRRSA-N 2 0 212.381 2.352 20 0 BEADRP CC[C@@H]1CCC[C@H]1[NH2+]C[C@@H](C)C[NH+](C)C ZINC000382366848 367512610 /nfs/dbraw/zinc/51/26/10/367512610.db2.gz WQBGUGOUMOJDAY-JHJVBQTASA-N 2 0 212.381 2.352 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+]CC1CC(F)(F)C1 ZINC000383199938 367605966 /nfs/dbraw/zinc/60/59/66/367605966.db2.gz YVAOEPOSPBAXHI-MNOVXSKESA-N 2 0 232.318 2.139 20 0 BEADRP [NH3+]CCC[NH+]1CCC(OCc2ccccc2)CC1 ZINC000383905722 367658481 /nfs/dbraw/zinc/65/84/81/367658481.db2.gz MHGMWOUIDPBJKF-UHFFFAOYSA-N 2 0 248.370 2.016 20 0 BEADRP CC(C)[N@H+](CC[C@H]1CC[NH2+]C1)Cc1ccccn1 ZINC000581669882 367700478 /nfs/dbraw/zinc/70/04/78/367700478.db2.gz KMAPYKWHVXPQAV-CQSZACIVSA-N 2 0 247.386 2.292 20 0 BEADRP CC[C@@H]1[C@H](C)CCN1CC[NH2+]C(C)(C)C ZINC000384009029 367668370 /nfs/dbraw/zinc/66/83/70/367668370.db2.gz KAGFZARRBRTRCG-VXGBXAGGSA-N 2 0 212.381 2.495 20 0 BEADRP CC[C@H]1[C@H](C)CC[N@@H+]1CCC1CC[NH2+]CC1 ZINC000384026596 367669281 /nfs/dbraw/zinc/66/92/81/367669281.db2.gz YEZMKPBYPQIIJL-OCCSQVGLSA-N 2 0 224.392 2.497 20 0 BEADRP CC/C=C\C[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000384834135 367738923 /nfs/dbraw/zinc/73/89/23/367738923.db2.gz HLNHQVLOAIORBG-WAYWQWQTSA-N 2 0 210.365 2.415 20 0 BEADRP CC/C=C\C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000385094029 367788110 /nfs/dbraw/zinc/78/81/10/367788110.db2.gz YNIMPVSQMNCDLT-KVOUUQTQSA-N 2 0 222.376 2.463 20 0 BEADRP CC/C=C/C[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000385094032 367788374 /nfs/dbraw/zinc/78/83/74/367788374.db2.gz YNIMPVSQMNCDLT-SZRIJTSKSA-N 2 0 222.376 2.463 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H]1CCC[C@H]1C(C)C ZINC000581878551 367866209 /nfs/dbraw/zinc/86/62/09/367866209.db2.gz NYDVNYWJTDLHKD-QWHCGFSZSA-N 2 0 212.381 2.400 20 0 BEADRP CSCC1CCC([NH2+]C[C@H](C)C[NH3+])CC1 ZINC000385810975 367867330 /nfs/dbraw/zinc/86/73/30/367867330.db2.gz IEKAOKYINLXAPX-VOMCLLRMSA-N 2 0 230.421 2.093 20 0 BEADRP C[C@@H]([N@H+](C)C[C@@H]1CC[NH2+][C@H](C)C1)C1(C)CC1 ZINC000385481902 367835141 /nfs/dbraw/zinc/83/51/41/367835141.db2.gz YUGXCMWLKUZVIN-JHJVBQTASA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H]([NH2+][C@H]1CC=CCC1)[C@H]1CCCC[NH2+]1 ZINC000386125381 367915937 /nfs/dbraw/zinc/91/59/37/367915937.db2.gz NQUMITAELWXBJG-RWMBFGLXSA-N 2 0 208.349 2.215 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC[C@@H]2CCC[NH2+]C2)[C@H]1C ZINC000386171672 367922654 /nfs/dbraw/zinc/92/26/54/367922654.db2.gz YYLAHLUJDJLVRZ-VOAKCMCISA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H](c1cccnc1)[N@H+]1CC[C@H]2C[NH2+]C[C@H]2CC1 ZINC000386181222 367925183 /nfs/dbraw/zinc/92/51/83/367925183.db2.gz IWDVHWFKQGQPNP-AEGPPILISA-N 2 0 245.370 2.074 20 0 BEADRP FC(F)C1CCC([NH2+]CC2CC[NH2+]CC2)CC1 ZINC000581937841 367964473 /nfs/dbraw/zinc/96/44/73/367964473.db2.gz WEVPNRKWJJYHRU-UHFFFAOYSA-N 2 0 246.345 2.400 20 0 BEADRP CC(C)COCCC[NH2+][C@H](C)[C@H]1CCCC[NH2+]1 ZINC000386489167 367980614 /nfs/dbraw/zinc/98/06/14/367980614.db2.gz UDBCZNNMQBMIBI-ZIAGYGMSSA-N 2 0 242.407 2.169 20 0 BEADRP CCOCC(C)(C)C[NH2+][C@@H](C)[C@@H]1CCCC[NH2+]1 ZINC000386506007 367981511 /nfs/dbraw/zinc/98/15/11/367981511.db2.gz WMPTVIVGCDVPDG-STQMWFEESA-N 2 0 242.407 2.169 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1CC12CCCC2 ZINC000386904379 368033963 /nfs/dbraw/zinc/03/39/63/368033963.db2.gz BUBLCZZBUMNFJI-VXGBXAGGSA-N 2 0 210.365 2.426 20 0 BEADRP C[NH+](C)C1CC([NH2+]C2CCCCCC2)C1 ZINC000566476071 326054077 /nfs/dbraw/zinc/05/40/77/326054077.db2.gz SUELGZCDYUUHPM-UHFFFAOYSA-N 2 0 210.365 2.391 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCC[C@@H]([NH3+])C1)C1CCCC1 ZINC000088162988 368907302 /nfs/dbraw/zinc/90/73/02/368907302.db2.gz SMPRYMGHYAGJJI-RAIGVLPGSA-N 2 0 210.365 2.425 20 0 BEADRP Cc1cc(C[NH2+]C[C@H]2CCCC[N@@H+](C)C2)ccn1 ZINC000623657556 368997055 /nfs/dbraw/zinc/99/70/55/368997055.db2.gz UKGSQLURKQZGGH-OAHLLOKOSA-N 2 0 247.386 2.212 20 0 BEADRP CCCn1ccc(C[NH2+]C[C@@H]2CCC[N@H+](C)C2)c1 ZINC000091013032 369004392 /nfs/dbraw/zinc/00/43/92/369004392.db2.gz JNVPHGVDHNNKOH-AWEZNQCLSA-N 2 0 249.402 2.330 20 0 BEADRP C[N@@H+]1CCCC[C@@H](C[NH2+]C2CCCC2)C1 ZINC000623655748 368991179 /nfs/dbraw/zinc/99/11/79/368991179.db2.gz DOEWPAJNALNTRT-LBPRGKRZSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@@H]2CCCC[N@H+](C)C2)C1 ZINC000623656022 368992883 /nfs/dbraw/zinc/99/28/83/368992883.db2.gz LBWDAIHWDVZINL-RDBSUJKOSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C[C@H]2CCCC[N@H+](C)C2)C1 ZINC000623656021 368994059 /nfs/dbraw/zinc/99/40/59/368994059.db2.gz LBWDAIHWDVZINL-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP C([NH2+][C@H]1CCC[C@H]1C1CC1)C1CC[NH2+]CC1 ZINC000567639022 326236204 /nfs/dbraw/zinc/23/62/04/326236204.db2.gz JPPGVHBYNPNLPK-KBPBESRZSA-N 2 0 222.376 2.154 20 0 BEADRP CCc1ccc(CC[N@@H+]2C[C@H](C)[C@@H](C[NH3+])C2)cc1 ZINC000631840940 369340475 /nfs/dbraw/zinc/34/04/75/369340475.db2.gz WQTONGNTXKWMFM-BBRMVZONSA-N 2 0 246.398 2.318 20 0 BEADRP CC(C)OC[C@@H](C)[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000459647638 203328893 /nfs/dbraw/zinc/32/88/93/203328893.db2.gz AZROLXRKYKMHLW-GFCCVEGCSA-N 2 0 247.342 2.237 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000459656186 203330780 /nfs/dbraw/zinc/33/07/80/203330780.db2.gz FXPLJWSRZDQASC-ZYHUDNBSSA-N 2 0 215.300 2.080 20 0 BEADRP Cc1ccccc1OCCCN1C[C@@H]([NH3+])C[C@H]1C ZINC000631858543 369443584 /nfs/dbraw/zinc/44/35/84/369443584.db2.gz AAOUMPGBFZSKHA-KGLIPLIRSA-N 2 0 248.370 2.185 20 0 BEADRP C[C@H]1C[C@H]1C[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000459656183 203331734 /nfs/dbraw/zinc/33/17/34/203331734.db2.gz FXPLJWSRZDQASC-JQWIXIFHSA-N 2 0 215.300 2.080 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CC[C@H]2CCC[N@H+](C)C2)C1 ZINC000459732733 203344403 /nfs/dbraw/zinc/34/44/03/203344403.db2.gz MSQMRISNRYGPIN-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1ccc(C[NH2+]CC[C@H]2CCC[N@@H+](C)C2)nc1 ZINC000459735037 203346756 /nfs/dbraw/zinc/34/67/56/203346756.db2.gz PJKFPCHGSALLEW-CQSZACIVSA-N 2 0 247.386 2.212 20 0 BEADRP COCC(C)(C)C[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000459662930 203332855 /nfs/dbraw/zinc/33/28/55/203332855.db2.gz VLZRZYBSXSBSSR-UHFFFAOYSA-N 2 0 247.342 2.097 20 0 BEADRP Cc1cc(C[NH+]2C[C@@H]3C[NH2+]C[C@H]3C2)c(C)s1 ZINC000082238105 370973493 /nfs/dbraw/zinc/97/34/93/370973493.db2.gz HZIKNIUNIWAOCK-STQMWFEESA-N 2 0 236.384 2.016 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC[C@H]2CCC[N@H+](C)C2)[C@@H]1C ZINC000459783935 203366596 /nfs/dbraw/zinc/36/65/96/203366596.db2.gz NMJWWDMVZUDEFV-SYQHCUMBSA-N 2 0 224.392 2.352 20 0 BEADRP CC1(C)CC(CN2CCC[C@@H]3C[NH2+]CC[C@H]32)C1 ZINC000631889450 370975599 /nfs/dbraw/zinc/97/55/99/370975599.db2.gz GHLORJRQVBYHBA-ZIAGYGMSSA-N 2 0 236.403 2.497 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H]2CCO[C@H]2CC)CC1 ZINC000459740828 203350353 /nfs/dbraw/zinc/35/03/53/203350353.db2.gz MGUNNXMFZQRJBA-KGLIPLIRSA-N 2 0 240.391 2.018 20 0 BEADRP CCC(CC)[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC000459800614 203369753 /nfs/dbraw/zinc/36/97/53/203369753.db2.gz ZVGCOYVOTVYEAH-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP CC[C@H](C)[C@@H](C)[NH2+]C[C@@H](C1CC1)N(C)C ZINC000166204353 203387515 /nfs/dbraw/zinc/38/75/15/203387515.db2.gz VVHQPKDXKBUNBW-LOWVWBTDSA-N 2 0 212.381 2.351 20 0 BEADRP C[C@H]1C[C@H]([NH3+])CN1Cc1cc2ccccc2o1 ZINC000631863092 369596665 /nfs/dbraw/zinc/59/66/65/369596665.db2.gz XKKSFSHFSZHWNX-JQWIXIFHSA-N 2 0 230.311 2.354 20 0 BEADRP CC[NH+](CCC[N@@H+](CC)C1CC1)C1CC1 ZINC000157543150 326281321 /nfs/dbraw/zinc/28/13/21/326281321.db2.gz AZSUNMANCVCMMB-UHFFFAOYSA-N 2 0 210.365 2.345 20 0 BEADRP Cc1ncccc1CN[C@@H]1CC[N@@H+](C)C(C)(C)C1 ZINC000623703382 369867347 /nfs/dbraw/zinc/86/73/47/369867347.db2.gz LVLTZZUFPBTAFP-CQSZACIVSA-N 2 0 247.386 2.352 20 0 BEADRP C[C@H]1CN(c2cc[nH+]c3ccccc32)CC[C@H]1[NH3+] ZINC000251903956 369981226 /nfs/dbraw/zinc/98/12/26/369981226.db2.gz WQSGBYFGDNVMSD-WCQYABFASA-N 2 0 241.338 2.408 20 0 BEADRP C[C@H](c1cccnc1)[N@@H+]1C[C@@H]2CCC[C@H]([NH3+])[C@H]2C1 ZINC000252860997 370137258 /nfs/dbraw/zinc/13/72/58/370137258.db2.gz NGDLLRXNSMOKIJ-UNQGMJICSA-N 2 0 245.370 2.202 20 0 BEADRP C([NH2+][C@]12CCC[C@@H]1C[NH2+]C2)[C@@H]1CC[C@H]2C[C@H]2C1 ZINC000631867585 370283628 /nfs/dbraw/zinc/28/36/28/370283628.db2.gz XEQLWJVNJZTWPP-KHMAMNHCSA-N 2 0 234.387 2.154 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC[C@H]2CC2(F)F)CC[N@@H+]1C ZINC000621770570 370512808 /nfs/dbraw/zinc/51/28/08/370512808.db2.gz TWRSSIHORPTSIH-OUAUKWLOSA-N 2 0 232.318 2.104 20 0 BEADRP CCC[NH+]1CCC([NH2+]CC[C@H]2CC2(F)F)CC1 ZINC000621734146 370490886 /nfs/dbraw/zinc/49/08/86/370490886.db2.gz GMCCSHYQDGDFKK-NSHDSACASA-N 2 0 246.345 2.496 20 0 BEADRP [NH3+][C@@H]1CCCC[C@H]1NCc1cncc(Cl)c1 ZINC000621776061 370524695 /nfs/dbraw/zinc/52/46/95/370524695.db2.gz BAHNCLGMLXWBQD-VXGBXAGGSA-N 2 0 239.750 2.095 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+][C@]2(C)CCCOC2)CC1(C)C ZINC000623908128 371149916 /nfs/dbraw/zinc/14/99/16/371149916.db2.gz PULIHWSOCPVZQU-TZMCWYRMSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCCc2ncccc21)C[NH+](C)C ZINC000631629757 372469765 /nfs/dbraw/zinc/46/97/65/372469765.db2.gz DGZYRUYANXHKCY-IUODEOHRSA-N 2 0 247.386 2.246 20 0 BEADRP Cc1cc(C)c(C[N@H+]2C[C@@H](C[NH3+])C[C@H]2C)c(C)n1 ZINC000631822442 372598635 /nfs/dbraw/zinc/59/86/35/372598635.db2.gz DETYDOCUIBQAKA-TZMCWYRMSA-N 2 0 247.386 2.176 20 0 BEADRP Cc1ccc(C[N@H+]2C[C@H](C)[C@H](C[NH3+])C2)cc1F ZINC000631837507 372627870 /nfs/dbraw/zinc/62/78/70/372627870.db2.gz SYSAUBMJBJPESZ-WCQYABFASA-N 2 0 236.334 2.161 20 0 BEADRP Cc1cccc(C[N@H+]2C[C@H](C)[C@H](C[NH3+])C2)c1 ZINC000631843880 372641659 /nfs/dbraw/zinc/64/16/59/372641659.db2.gz STYARPQHRUTRHL-GXTWGEPZSA-N 2 0 218.344 2.022 20 0 BEADRP C[C@@H]1C[N@H+](Cc2ccc(Cl)cc2)C[C@H]1C[NH3+] ZINC000631845164 372643626 /nfs/dbraw/zinc/64/36/26/372643626.db2.gz UVCIDVCTSUUJOK-ZYHUDNBSSA-N 2 0 238.762 2.367 20 0 BEADRP CCC(CC)C[NH2+][C@]12CCC[C@@H]1C[NH2+]C2 ZINC000631867196 372668283 /nfs/dbraw/zinc/66/82/83/372668283.db2.gz MKPACANRVQUDMA-OLZOCXBDSA-N 2 0 210.365 2.154 20 0 BEADRP COC[C@H](CC(C)C)[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000414961085 205795217 /nfs/dbraw/zinc/79/52/17/205795217.db2.gz IHNFNNIUBIPRGO-KGLIPLIRSA-N 2 0 242.407 2.169 20 0 BEADRP C[C@@H]1CCCC[N@@H+]1CC[C@H]1CCC[NH+]1C ZINC000246575203 374275953 /nfs/dbraw/zinc/27/59/53/374275953.db2.gz CAJNOULRPRSQJJ-CHWSQXEVSA-N 2 0 210.365 2.345 20 0 BEADRP CC(C)CCC[N@@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC000429035628 206060991 /nfs/dbraw/zinc/06/09/91/206060991.db2.gz NMMTVYBJHPGRNH-AWEZNQCLSA-N 2 0 224.392 2.450 20 0 BEADRP C[NH2+]C[C@H]1CC[N@H+](CCc2ccc(C)cc2)C1 ZINC000430915329 206062050 /nfs/dbraw/zinc/06/20/50/206062050.db2.gz CEQYOLOELAAUNK-OAHLLOKOSA-N 2 0 232.371 2.079 20 0 BEADRP CCC[N@H+](C)CCCN(C)Cc1ccco1 ZINC000285773479 169074845 /nfs/dbraw/zinc/07/48/45/169074845.db2.gz SXUVHVFYKAQUOX-UHFFFAOYSA-N 2 0 224.348 2.443 20 0 BEADRP CCC[N@H+](CCOCC[NH3+])CC1CCCCC1 ZINC000357082402 169169570 /nfs/dbraw/zinc/16/95/70/169169570.db2.gz OEVGZYUKWZZAHO-UHFFFAOYSA-N 2 0 242.407 2.254 20 0 BEADRP CCC[NH+]1CCC([NH2+]C[C@@H]2CCC=CO2)CC1 ZINC000050267750 169188263 /nfs/dbraw/zinc/18/82/63/169188263.db2.gz LIWSWRMBLPIMIU-AWEZNQCLSA-N 2 0 238.375 2.143 20 0 BEADRP CCC[NH+]1CCC([NH2+]CCC(C)C)CC1 ZINC000019911853 169188666 /nfs/dbraw/zinc/18/86/66/169188666.db2.gz IDDPEAWDVZBCBZ-UHFFFAOYSA-N 2 0 212.381 2.497 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H]2CC[C@@H]2SC)CC1 ZINC000336682070 169190379 /nfs/dbraw/zinc/19/03/79/169190379.db2.gz DFNVARZACSFRKP-OLZOCXBDSA-N 2 0 242.432 2.344 20 0 BEADRP c1cc2c(o1)CCC[C@H]2[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000128924566 183373142 /nfs/dbraw/zinc/37/31/42/183373142.db2.gz DIOABYGLEZNHLJ-DGCLKSJQSA-N 2 0 234.343 2.389 20 0 BEADRP c1cc2c(o1)CCC[C@@H]2[NH2+][C@H]1CCC[NH2+]CC1 ZINC000128925216 183373733 /nfs/dbraw/zinc/37/37/33/183373733.db2.gz DIOABYGLEZNHLJ-AAEUAGOBSA-N 2 0 234.343 2.389 20 0 BEADRP c1ccc(CCC[N@@H+]2CC[C@@]3(CC[NH2+]C3)C2)cc1 ZINC000031994627 183391771 /nfs/dbraw/zinc/39/17/71/183391771.db2.gz AIZUTGQRJCORCJ-MRXNPFEDSA-N 2 0 244.382 2.305 20 0 BEADRP c1ccc(CCC[N@@H+]2CC[C@H]3[NH2+]CC[C@H]3C2)cc1 ZINC000336794653 183392057 /nfs/dbraw/zinc/39/20/57/183392057.db2.gz DPDRBMHDXUSNPD-JKSUJKDBSA-N 2 0 244.382 2.303 20 0 BEADRP CCC[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCCC[NH2+]1 ZINC000250904670 169282489 /nfs/dbraw/zinc/28/24/89/169282489.db2.gz YJHUGCGXKOIEGL-JHJVBQTASA-N 2 0 210.365 2.297 20 0 BEADRP CCC[C@@H](C[NH2+]C1CC[NH+](CCC)CC1)OC ZINC000356344611 169384629 /nfs/dbraw/zinc/38/46/29/169384629.db2.gz XCIPHOFSAQWSKM-AWEZNQCLSA-N 2 0 242.407 2.266 20 0 BEADRP CCC[C@@H](C)[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000227497844 134381184 /nfs/dbraw/zinc/38/11/84/134381184.db2.gz SIFJNXDVHOKWDX-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP CCC(CC)[NH2+][C@H]1C[C@H](C)N(C2CC2)C1 ZINC000131943904 383908634 /nfs/dbraw/zinc/90/86/34/383908634.db2.gz AQQCETSLQMXRSY-JQWIXIFHSA-N 2 0 210.365 2.390 20 0 BEADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@H]2CCCc3cccnc32)C1 ZINC000643542769 383983139 /nfs/dbraw/zinc/98/31/39/383983139.db2.gz XJPFCUFVWYPJRA-XBFCOCLRSA-N 2 0 245.370 2.176 20 0 BEADRP CC(C)[C@@H]([NH3+])CC[N@H+](C)CC(C)(C)C ZINC000227732293 134385950 /nfs/dbraw/zinc/38/59/50/134385950.db2.gz PAHRFDNOWJBWKF-NSHDSACASA-N 2 0 200.370 2.338 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CCCCC[NH+]2CCCC2)CO1 ZINC000647213169 383963894 /nfs/dbraw/zinc/96/38/94/383963894.db2.gz RFJAUASIXZTAPH-KBPBESRZSA-N 2 0 240.391 2.020 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)C1CC1 ZINC000643546096 384016369 /nfs/dbraw/zinc/01/63/69/384016369.db2.gz IHIXTCBPLMOQKZ-CMPLNLGQSA-N 2 0 208.349 2.049 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)[C@H]1C[C@H]1C ZINC000643549011 384040432 /nfs/dbraw/zinc/04/04/32/384040432.db2.gz YYMQXTFLMZFURU-LPWJVIDDSA-N 2 0 222.376 2.295 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH3+])[C@@H]1c1cccs1 ZINC000069796362 384063833 /nfs/dbraw/zinc/06/38/33/384063833.db2.gz DPKWXOKHANQUNA-GXSJLCMTSA-N 2 0 210.346 2.090 20 0 BEADRP CC(C)[C@H]1CC[N@H+](CC[C@@H]2CCC[NH2+]C2)C1 ZINC000163616036 384096413 /nfs/dbraw/zinc/09/64/13/384096413.db2.gz RRBARWFKRLEQNM-KBPBESRZSA-N 2 0 224.392 2.354 20 0 BEADRP C[NH+](C)CCC1CC[NH+](Cc2ccco2)CC1 ZINC000092381242 384175875 /nfs/dbraw/zinc/17/58/75/384175875.db2.gz IQJFKUPRBJURRB-UHFFFAOYSA-N 2 0 236.359 2.443 20 0 BEADRP C[N@H+](Cc1cccs1)CC(C)(C)C[NH3+] ZINC000051216572 384230478 /nfs/dbraw/zinc/23/04/78/384230478.db2.gz QQCDPXUMRINSMO-UHFFFAOYSA-N 2 0 212.362 2.165 20 0 BEADRP Cc1cc(NCC[NH+]2[C@H](C)CCC[C@H]2C)cc[nH+]1 ZINC000357681899 384234451 /nfs/dbraw/zinc/23/44/51/384234451.db2.gz JRDPWHRMFBMIRL-ZIAGYGMSSA-N 2 0 247.386 2.487 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@@H](C)CC(F)F)CC1 ZINC000647317334 384238397 /nfs/dbraw/zinc/23/83/97/384238397.db2.gz LTMDSFRQKXCPHB-JTQLQIEISA-N 2 0 234.334 2.352 20 0 BEADRP C[C@@H]([NH2+]CCCn1ccnc1)C(C)(C)C ZINC000133295096 384238685 /nfs/dbraw/zinc/23/86/85/384238685.db2.gz AMTGXEOZHNHFGG-LLVKDONJSA-N 2 0 209.337 2.297 20 0 BEADRP C[N@H+](C[C@H]1CCC[NH2+]C1)[C@@H]1CCC(C)(C)C1 ZINC000234366510 384215020 /nfs/dbraw/zinc/21/50/20/384215020.db2.gz RDPKKIHJHGFTRL-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP [NH3+]CC[C@H]1CCCC[N@@H+]1CC1CCCC1 ZINC000082594451 384240357 /nfs/dbraw/zinc/24/03/57/384240357.db2.gz MFBPVWPFHZLZMN-CYBMUJFWSA-N 2 0 210.365 2.380 20 0 BEADRP C[C@H]([NH3+])C1CC[NH+](Cc2ccsc2)CC1 ZINC000082474674 384229930 /nfs/dbraw/zinc/22/99/30/384229930.db2.gz WBSNUHDRQYTFTR-JTQLQIEISA-N 2 0 224.373 2.307 20 0 BEADRP COC1(C[NH+]2CCC([C@@H](C)[NH3+])CC2)CCCC1 ZINC000319480923 384249165 /nfs/dbraw/zinc/24/91/65/384249165.db2.gz SINKBUCYPWJBGV-GFCCVEGCSA-N 2 0 240.391 2.005 20 0 BEADRP CC(C)[C@@H](C)[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000319503465 384256544 /nfs/dbraw/zinc/25/65/44/384256544.db2.gz JEDBJFRVNMTNAK-VXGBXAGGSA-N 2 0 210.365 2.295 20 0 BEADRP CSCCC[N@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000173791905 384262913 /nfs/dbraw/zinc/26/29/13/384262913.db2.gz RADJUNDYURUOLT-LBPRGKRZSA-N 2 0 230.421 2.013 20 0 BEADRP CC[C@H]1CCC[C@@H]([NH2+]C2CC[NH2+]CC2)C1 ZINC000082847465 384270690 /nfs/dbraw/zinc/27/06/90/384270690.db2.gz QPHIHXAIXWEZPP-WCQYABFASA-N 2 0 210.365 2.297 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+]C(C1CC1)C1CC1 ZINC000166562314 384274483 /nfs/dbraw/zinc/27/44/83/384274483.db2.gz HUBKMDKIHGRDGS-UHFFFAOYSA-N 2 0 224.392 2.495 20 0 BEADRP CC[C@H](C)C[N@H+](C)C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000300056941 384283565 /nfs/dbraw/zinc/28/35/65/384283565.db2.gz WSMPAVRNPXUQOV-YNEHKIRRSA-N 2 0 212.381 2.352 20 0 BEADRP CC[N@H+](C)C[C@@H]1CC[NH+](CCCSC)C1 ZINC000173909028 384284103 /nfs/dbraw/zinc/28/41/03/384284103.db2.gz HKURKJNKVIKJBU-LBPRGKRZSA-N 2 0 230.421 2.013 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCC[N@@H+]2CCCC[C@@H]2C)CO1 ZINC000401975650 384354177 /nfs/dbraw/zinc/35/41/77/384354177.db2.gz TYHVZPFCXWSQAL-BFHYXJOUSA-N 2 0 240.391 2.018 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH+](C)CCCCOC)[C@H](C)C1 ZINC000174776550 384362071 /nfs/dbraw/zinc/36/20/71/384362071.db2.gz SUWBYOYSPVASLV-KGLIPLIRSA-N 2 0 242.407 2.075 20 0 BEADRP C[C@@H]([NH2+]CCCC[NH+](C)C)c1ccc(F)cn1 ZINC000133999979 384325123 /nfs/dbraw/zinc/32/51/23/384325123.db2.gz SKHCCSZKYHSLTB-LLVKDONJSA-N 2 0 239.338 2.213 20 0 BEADRP c1cn2c(cccc2C[NH+]2CC(C3CC3)C2)n1 ZINC000643345837 384426207 /nfs/dbraw/zinc/42/62/07/384426207.db2.gz POFQVAYZQBFGDA-UHFFFAOYSA-N 2 0 227.311 2.176 20 0 BEADRP C[NH+](C)CCCC[NH2+]Cc1c(F)cccc1F ZINC000045598387 384401019 /nfs/dbraw/zinc/40/10/19/384401019.db2.gz UECAONUPSMPHCE-UHFFFAOYSA-N 2 0 242.313 2.396 20 0 BEADRP CCN(CC)C[C@H](C)[NH2+][C@@H]1C[C@H](C)[C@@H]1C ZINC000336718425 384377617 /nfs/dbraw/zinc/37/76/17/384377617.db2.gz YKBLUGZUZLXIHS-ZDEQEGDKSA-N 2 0 212.381 2.351 20 0 BEADRP CCC[C@H](C)[N@H+](C)CCC1CC[NH2+]CC1 ZINC000036790846 384458851 /nfs/dbraw/zinc/45/88/51/384458851.db2.gz ZPACDOVNIPIGJK-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP COC1(C[N@H+](C)CC[C@@H]([NH3+])C(C)C)CCCC1 ZINC000319817726 384497897 /nfs/dbraw/zinc/49/78/97/384497897.db2.gz HYDWTRNFXUBTCX-CYBMUJFWSA-N 2 0 242.407 2.251 20 0 BEADRP CC(C)CSCC[NH2+][C@H]1CCC[C@H]1C[NH3+] ZINC000397341840 384508488 /nfs/dbraw/zinc/50/84/88/384508488.db2.gz QMLDXLZKVPFHIC-RYUDHWBXSA-N 2 0 230.421 2.093 20 0 BEADRP CC(C)CC[N@@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000150803645 384513840 /nfs/dbraw/zinc/51/38/40/384513840.db2.gz SRAGEKSIUILWMI-AWEZNQCLSA-N 2 0 224.392 2.450 20 0 BEADRP CC[C@@H]([NH2+]CCCC[NH3+])c1ccccc1 ZINC000037714768 384513696 /nfs/dbraw/zinc/51/36/96/384513696.db2.gz UBWPMOABABYCTP-CYBMUJFWSA-N 2 0 206.333 2.466 20 0 BEADRP CC[C@](C)(C[NH2+]CC1(C)CC[NH+](C)CC1)OC ZINC000319848406 384514690 /nfs/dbraw/zinc/51/46/90/384514690.db2.gz KSBVOEJTYIWUFC-CQSZACIVSA-N 2 0 242.407 2.123 20 0 BEADRP CO[C@@H](C)[C@@H](C)[NH2+]C1CC[NH+](CC(C)C)CC1 ZINC000358016544 384517935 /nfs/dbraw/zinc/51/79/35/384517935.db2.gz GSVMZWVJFGBLQW-OLZOCXBDSA-N 2 0 242.407 2.120 20 0 BEADRP CC(C)C[C@@H](C)C[NH+]1CCC(C[NH3+])CC1 ZINC000300739516 384526251 /nfs/dbraw/zinc/52/62/51/384526251.db2.gz ARIDMDFWJUXKNR-GFCCVEGCSA-N 2 0 212.381 2.339 20 0 BEADRP C[NH2+][C@@H]1CCN(CC2CCCCCC2)C1 ZINC000150060440 384555296 /nfs/dbraw/zinc/55/52/96/384555296.db2.gz XCYSYKUBEYTKBT-CYBMUJFWSA-N 2 0 210.365 2.251 20 0 BEADRP C[NH+](C)CCCNCc1ccc(Cl)s1 ZINC000020054176 384572124 /nfs/dbraw/zinc/57/21/24/384572124.db2.gz SVIKHQWKQHKQGT-UHFFFAOYSA-N 2 0 232.780 2.443 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+]CCC[N@@H+]1CCCC[C@@H]1C ZINC000309732271 384572974 /nfs/dbraw/zinc/57/29/74/384572974.db2.gz BLMSQLBBNLNNAT-HZSPNIEDSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CN(C)C[C@H]1[NH2+]C[C@H]1C[C@@H]1c1ccccc1 ZINC000647230506 384586572 /nfs/dbraw/zinc/58/65/72/384586572.db2.gz UXPMOGJWJUJKEL-DTZQCDIJSA-N 2 0 244.382 2.330 20 0 BEADRP C[C@H]1CN(C)C[C@@H]1[NH2+]C[C@H]1C[C@@H]1c1ccccc1 ZINC000647230508 384587237 /nfs/dbraw/zinc/58/72/37/384587237.db2.gz UXPMOGJWJUJKEL-XZDPQHSOSA-N 2 0 244.382 2.330 20 0 BEADRP CC(C)C[C@@H](C)C[NH2+]CCC[NH+](C)C ZINC000300844119 384602952 /nfs/dbraw/zinc/60/29/52/384602952.db2.gz DOTNWORBHVSXNU-GFCCVEGCSA-N 2 0 200.370 2.210 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)CO1 ZINC000647184043 384604145 /nfs/dbraw/zinc/60/41/45/384604145.db2.gz ZGDZUUDNCFXBPU-UPJWGTAASA-N 2 0 242.407 2.120 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+]CC1CC[NH+](C)CC1 ZINC000357776518 384611045 /nfs/dbraw/zinc/61/10/45/384611045.db2.gz CNIBXTRYERTKBH-ZDUSSCGKSA-N 2 0 247.386 2.382 20 0 BEADRP C[N@@H+](Cc1cccc(F)c1)CC1CC[NH2+]CC1 ZINC000020293339 384613467 /nfs/dbraw/zinc/61/34/67/384613467.db2.gz VGEHFNVKAFAECS-UHFFFAOYSA-N 2 0 236.334 2.257 20 0 BEADRP CC(C)=CC[N@@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000150819628 384625362 /nfs/dbraw/zinc/62/53/62/384625362.db2.gz XYOYHNDGCVSERP-CQSZACIVSA-N 2 0 222.376 2.370 20 0 BEADRP C1[C@H]2CC[C@@H]([NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)C[C@@H]12 ZINC000403313571 384628835 /nfs/dbraw/zinc/62/88/35/384628835.db2.gz BLUKRLYVRXPGGA-KJWHEZOQSA-N 2 0 234.387 2.391 20 0 BEADRP C[C@H](C[NH2+]C1CCC2(CC2)CC1)C[NH+](C)C ZINC000309781643 384597491 /nfs/dbraw/zinc/59/74/91/384597491.db2.gz RJVXMLLVWKZGLT-GFCCVEGCSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]([NH2+]CC1CC[NH2+]CC1)C1CCCC1 ZINC000086701238 384672067 /nfs/dbraw/zinc/67/20/67/384672067.db2.gz WDSMQWOHRHIYNQ-NSHDSACASA-N 2 0 210.365 2.154 20 0 BEADRP Cc1ccc(CN2CC[C@@H]3CC[NH2+][C@H]3C2)c(C)c1 ZINC000647532814 384638412 /nfs/dbraw/zinc/63/84/12/384638412.db2.gz DWDDWQCHYNKQNB-HOCLYGCPSA-N 2 0 244.382 2.487 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]CC2CCCCC2)C1 ZINC000086402709 384647112 /nfs/dbraw/zinc/64/71/12/384647112.db2.gz SYLLCXMZRSQKQT-QWHCGFSZSA-N 2 0 210.365 2.426 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+]CCC(C)(C)C)C1 ZINC000044536040 384657870 /nfs/dbraw/zinc/65/78/70/384657870.db2.gz MRUBQZFBAMDXFZ-GFCCVEGCSA-N 2 0 212.381 2.354 20 0 BEADRP CCCCOCCC[NH2+][C@@H]1CC[N@H+](C)C[C@H]1C ZINC000359360697 384725009 /nfs/dbraw/zinc/72/50/09/384725009.db2.gz HVDWNJUTYINRMG-ZIAGYGMSSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)CCOCC[N@@H+]1CCC[C@H]([C@@H](C)[NH3+])C1 ZINC000104421447 384685833 /nfs/dbraw/zinc/68/58/33/384685833.db2.gz JTGRIYCOJRXFSV-KGLIPLIRSA-N 2 0 242.407 2.108 20 0 BEADRP CSCCC[NH2+][C@@H]1CC[N@H+](C)[C@@H]2CCC[C@H]21 ZINC000309935869 384727043 /nfs/dbraw/zinc/72/70/43/384727043.db2.gz ZTBPYAGZZOTQGY-YNEHKIRRSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000647543425 384710951 /nfs/dbraw/zinc/71/09/51/384710951.db2.gz NFWZQPWIANTLLS-APIJFGDWSA-N 2 0 236.403 2.354 20 0 BEADRP FC1(C[N@@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]C3)C2)CC1 ZINC000647543745 384713569 /nfs/dbraw/zinc/71/35/69/384713569.db2.gz RPJHQPHJYKERLV-CHWSQXEVSA-N 2 0 240.366 2.200 20 0 BEADRP C(C1CC1)[N@@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000647544068 384715462 /nfs/dbraw/zinc/71/54/62/384715462.db2.gz VZNMMOGASAABMA-ZIAGYGMSSA-N 2 0 222.376 2.108 20 0 BEADRP C[N@H+](Cc1ccc2cnccc2c1)C1CC([NH3+])C1 ZINC000647544739 384720038 /nfs/dbraw/zinc/72/00/38/384720038.db2.gz WGWLYSDPLRAYEY-UHFFFAOYSA-N 2 0 241.338 2.156 20 0 BEADRP CC(C)C[C@H](C)C[N@@H+]1C[C@@H](C[NH3+])C[C@H]1C ZINC000300988787 384774617 /nfs/dbraw/zinc/77/46/17/384774617.db2.gz VEXJHFDRUGUPBX-YNEHKIRRSA-N 2 0 212.381 2.338 20 0 BEADRP C(C1CC[NH2+]CC1)[N@@H+]1CC[C@@H](C2CCC2)C1 ZINC000647552105 384756552 /nfs/dbraw/zinc/75/65/52/384756552.db2.gz FZNLMRMDFBMRQW-CQSZACIVSA-N 2 0 222.376 2.108 20 0 BEADRP c1ccc(C[N@@H+]2CC[C@@H]3C[NH2+]CC[C@H]3C2)cc1 ZINC000083328873 384757919 /nfs/dbraw/zinc/75/79/19/384757919.db2.gz HMEQPPDSBRYYKW-CABCVRRESA-N 2 0 230.355 2.118 20 0 BEADRP CN1CCC[C@H]1C[NH2+]Cc1ccc2cc[nH]c2c1 ZINC000226013953 384830352 /nfs/dbraw/zinc/83/03/52/384830352.db2.gz HXGYAJZAQWJKMO-AWEZNQCLSA-N 2 0 243.354 2.352 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CC[N@@H+](C)C[C@@H]2C)cc1 ZINC000105480764 384785267 /nfs/dbraw/zinc/78/52/67/384785267.db2.gz USHVXMRBOYUMRR-ZFWWWQNUSA-N 2 0 232.371 2.425 20 0 BEADRP CC(C)[C@@H]([NH3+])CN[C@@H]1CCc2ccc(F)cc21 ZINC000423277109 384787824 /nfs/dbraw/zinc/78/78/24/384787824.db2.gz PESBIOMICRXYPN-UONOGXRCSA-N 2 0 236.334 2.386 20 0 BEADRP Cc1cnc(C[NH2+][C@@H](C)CCCC[NH3+])s1 ZINC000379893374 384800375 /nfs/dbraw/zinc/80/03/75/384800375.db2.gz FYJBHUIGQCVXEE-VIFPVBQESA-N 2 0 227.377 2.059 20 0 BEADRP C[C@]1(C[NH2+][C@@H]2CC[C@H]2C2CC2)CCC[NH2+]C1 ZINC000423332189 384803155 /nfs/dbraw/zinc/80/31/55/384803155.db2.gz HBTRLQJPUUISQR-MJBXVCDLSA-N 2 0 222.376 2.154 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000423339588 384814613 /nfs/dbraw/zinc/81/46/13/384814613.db2.gz LJKZRWBWMQLAAZ-MJBXVCDLSA-N 2 0 224.392 2.400 20 0 BEADRP C[NH+]1CCC(CC[NH2+]Cc2ccco2)CC1 ZINC000105454808 384869940 /nfs/dbraw/zinc/86/99/40/384869940.db2.gz LQNKGDMHZRUYTA-UHFFFAOYSA-N 2 0 222.332 2.101 20 0 BEADRP C1CC1[C@H]1CC[C@H]1[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000423437615 384872491 /nfs/dbraw/zinc/87/24/91/384872491.db2.gz MLNZXOKQJQKWKO-LXTVHRRPSA-N 2 0 234.387 2.153 20 0 BEADRP C[C@@H](C[NH2+][C@@H](C)C(C)(C)C)C[NH+](C)C ZINC000308645539 384885420 /nfs/dbraw/zinc/88/54/20/384885420.db2.gz HJJUQGCDDDEWEE-QWRGUYRKSA-N 2 0 200.370 2.208 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@H]([NH3+])C1)c1cncs1 ZINC000423368135 384841238 /nfs/dbraw/zinc/84/12/38/384841238.db2.gz DBPMWNDUYDNTBB-LPEHRKFASA-N 2 0 225.361 2.064 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H]2CCC23CCC3)C1 ZINC000423370322 384842784 /nfs/dbraw/zinc/84/27/84/384842784.db2.gz PLJKVYRNZLYMMK-GRYCIOLGSA-N 2 0 208.349 2.179 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@H]2CCC23CCC3)C1 ZINC000423370327 384842994 /nfs/dbraw/zinc/84/29/94/384842994.db2.gz PLJKVYRNZLYMMK-WOPDTQHZSA-N 2 0 208.349 2.179 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@@H]([NH3+])C1)c1cccc(CO)c1 ZINC000423376899 384848181 /nfs/dbraw/zinc/84/81/81/384848181.db2.gz JFWWSVNWHWOYPO-GLQYFDAESA-N 2 0 248.370 2.099 20 0 BEADRP Cc1ncc([C@H](C)[NH2+][C@@H]2CCC[C@H]([NH3+])C2)c(C)n1 ZINC000423393655 384853222 /nfs/dbraw/zinc/85/32/22/384853222.db2.gz QUMRPISAEKGWJG-WCFLWFBJSA-N 2 0 248.374 2.014 20 0 BEADRP CC(C)Oc1ccc(CN[C@H]2CCC[C@@H]2[NH3+])cc1 ZINC000258920500 384951045 /nfs/dbraw/zinc/95/10/45/384951045.db2.gz ISYGNPHMTYYDOK-GJZGRUSLSA-N 2 0 248.370 2.443 20 0 BEADRP Cc1ccccc1C[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000258987787 384956310 /nfs/dbraw/zinc/95/63/10/384956310.db2.gz LLSNUISFIJVFTD-ZDUSSCGKSA-N 2 0 218.344 2.084 20 0 BEADRP Cc1cc(C[NH2+]C[C@@H]2CCC[NH2+]C2)ccc1F ZINC000258990974 384957156 /nfs/dbraw/zinc/95/71/56/384957156.db2.gz LTUSNVQGISMFJI-CYBMUJFWSA-N 2 0 236.334 2.223 20 0 BEADRP C(C[N@H+]1CC[C@H]2C[NH2+]C[C@H]2CC1)C1CCCC1 ZINC000310588333 384890800 /nfs/dbraw/zinc/89/08/00/384890800.db2.gz XDCBTMXUMAJVSR-GASCZTMLSA-N 2 0 236.403 2.498 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000423446173 384900896 /nfs/dbraw/zinc/90/08/96/384900896.db2.gz SPOXKRGNPHVPJF-BYNSBNAKSA-N 2 0 236.403 2.399 20 0 BEADRP Cc1ccc(C[N@@H+]2CCCC[C@H]2CC[NH3+])nc1 ZINC000156599748 384904687 /nfs/dbraw/zinc/90/46/87/384904687.db2.gz NDJUACVICMTEPU-AWEZNQCLSA-N 2 0 233.359 2.093 20 0 BEADRP CC(C)[C@@H]1CCC[N@@H+]1C[C@H]1CCC[NH2+]C1 ZINC000251368149 384913476 /nfs/dbraw/zinc/91/34/76/384913476.db2.gz FNLXSRQDEQGQDY-STQMWFEESA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]C[C@H]2CCC[N@H+](C)C2)C1 ZINC000251749435 384914393 /nfs/dbraw/zinc/91/43/93/384914393.db2.gz JQNCSLPKMWJRKT-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)(C[NH2+][C@H]1CCC[C@H]1[NH3+])c1ccccc1 ZINC000258762648 384941137 /nfs/dbraw/zinc/94/11/37/384941137.db2.gz APVWJUVHYOFJAC-KGLIPLIRSA-N 2 0 232.371 2.434 20 0 BEADRP CCc1ccc(C[NH2+]CC[C@H]2CC[NH2+]C2)cc1 ZINC000258901810 384944131 /nfs/dbraw/zinc/94/41/31/384944131.db2.gz DLGQESVUNBMOMR-HNNXBMFYSA-N 2 0 232.371 2.338 20 0 BEADRP Cc1cncc(C[N@H+]2CCC[C@H](C)[C@H]2CC[NH3+])c1 ZINC000404315863 384970188 /nfs/dbraw/zinc/97/01/88/384970188.db2.gz ZZDRSZXLILVDGA-DZGCQCFKSA-N 2 0 247.386 2.339 20 0 BEADRP CO[C@H](C)CC[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000310336329 384987404 /nfs/dbraw/zinc/98/74/04/384987404.db2.gz MWHPQWUYCLJHPY-DDTOSNHZSA-N 2 0 234.343 2.146 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@@H]1CC[C@H](C)C1 ZINC000164422231 384988644 /nfs/dbraw/zinc/98/86/44/384988644.db2.gz PTECQPJVAUOSNZ-QWHCGFSZSA-N 2 0 212.381 2.495 20 0 BEADRP Cc1cc(CNCCC[N@@H+](C)C(C)C)sn1 ZINC000404421384 384991254 /nfs/dbraw/zinc/99/12/54/384991254.db2.gz CXAKYOQMYAGCSS-UHFFFAOYSA-N 2 0 241.404 2.271 20 0 BEADRP Cc1cc(C)cc(C[NH+]2CCC([NH3+])CC2)c1 ZINC000036754764 384997908 /nfs/dbraw/zinc/99/79/08/384997908.db2.gz XUDUXGNLGLPZHC-UHFFFAOYSA-N 2 0 218.344 2.227 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+][C@@H]1CC[C@H](C[NH3+])C1 ZINC000423496273 385005517 /nfs/dbraw/zinc/00/55/17/385005517.db2.gz GJJMQGGLCVVTST-RNJOBUHISA-N 2 0 210.365 2.138 20 0 BEADRP [NH3+][C@@H]1CCC[C@H](C[NH2+][C@@H]2CC[C@@H]2C2CC2)C1 ZINC000423482541 385005745 /nfs/dbraw/zinc/00/57/45/385005745.db2.gz XYFDNBSUZCVXON-IGHBBLSQSA-N 2 0 222.376 2.282 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+][C@H]1CC[C@@H](C[NH3+])C1 ZINC000423496274 385006336 /nfs/dbraw/zinc/00/63/36/385006336.db2.gz GJJMQGGLCVVTST-VOAKCMCISA-N 2 0 210.365 2.138 20 0 BEADRP Cc1ccc(C[N@H+](C)C[C@@H]2CCC[NH2+]C2)s1 ZINC000226437704 385019608 /nfs/dbraw/zinc/01/96/08/385019608.db2.gz AORCEYURGRJQLT-GFCCVEGCSA-N 2 0 238.400 2.488 20 0 BEADRP COc1cccc([C@H](C)[NH2+][C@@H]2C[C@H]([NH3+])C2(C)C)c1 ZINC000404759386 385051477 /nfs/dbraw/zinc/05/14/77/385051477.db2.gz BHHBBSQUIFHBIA-LEWSCRJBSA-N 2 0 248.370 2.472 20 0 BEADRP Cc1cccc(C[NH2+][C@H]2C[C@H]([NH3+])C2(C)C)c1 ZINC000404781582 385059172 /nfs/dbraw/zinc/05/91/72/385059172.db2.gz NKGGWAXUSVIZLX-STQMWFEESA-N 2 0 218.344 2.210 20 0 BEADRP Cc1ccccc1CC[NH2+][C@@H]1CC[N@@H+](C)C[C@@H]1C ZINC000157049049 385059339 /nfs/dbraw/zinc/05/93/39/385059339.db2.gz RLJLOZDBQALZOY-GOEBONIOSA-N 2 0 246.398 2.467 20 0 BEADRP C[C@@H](N[C@@H](C)C[NH3+])c1cccc(OC(F)F)c1 ZINC000235096455 385060447 /nfs/dbraw/zinc/06/04/47/385060447.db2.gz UGZPMINODIKVSA-DTWKUNHWSA-N 2 0 244.285 2.286 20 0 BEADRP C[C@@H](N[C@@H](C)C[NH3+])c1cccc(Cl)c1 ZINC000235096197 385061151 /nfs/dbraw/zinc/06/11/51/385061151.db2.gz XVARVRUSLBDWPE-DTWKUNHWSA-N 2 0 212.724 2.338 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]CCCC(F)(F)F ZINC000157090870 385067065 /nfs/dbraw/zinc/06/70/65/385067065.db2.gz GYMNCFCUHOAHMO-ZJUUUORDSA-N 2 0 238.297 2.259 20 0 BEADRP CC1=CC[C@@H]([NH2+][C@H](C)CC[NH+](C)C)CC1 ZINC000518411649 385080380 /nfs/dbraw/zinc/08/03/80/385080380.db2.gz RCZYMRYKQMDKIS-CHWSQXEVSA-N 2 0 210.365 2.415 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@H]1CCOc2ccccc21 ZINC000310384158 385025708 /nfs/dbraw/zinc/02/57/08/385025708.db2.gz JRZLKCJIEJSQGN-AAEUAGOBSA-N 2 0 234.343 2.227 20 0 BEADRP C[N@H+](CCCF)[C@H]1CCC[NH+](CCCF)CC1 ZINC000156986897 385036151 /nfs/dbraw/zinc/03/61/51/385036151.db2.gz PRIPDAVVWRXXJE-ZDUSSCGKSA-N 2 0 248.361 2.492 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)C1CCC1 ZINC000177943977 385140627 /nfs/dbraw/zinc/14/06/27/385140627.db2.gz FHNBTYNGADTUSR-VXGBXAGGSA-N 2 0 222.376 2.249 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)C2CCC2)C1 ZINC000178184949 385195092 /nfs/dbraw/zinc/19/50/92/385195092.db2.gz VIUJXJAPEZGCBH-NWDGAFQWSA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000157359248 385151622 /nfs/dbraw/zinc/15/16/22/385151622.db2.gz YLZGDSMJXRPIBA-ZDUSSCGKSA-N 2 0 210.365 2.345 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@H]2C[C@@H]2Cc2ccccc2)C1 ZINC000516663568 385152927 /nfs/dbraw/zinc/15/29/27/385152927.db2.gz STKWFTVNBVNGCK-FZKCQIBNSA-N 2 0 244.382 2.477 20 0 BEADRP C1CC12C[C@H]2[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000424373158 385153513 /nfs/dbraw/zinc/15/35/13/385153513.db2.gz IZVPWJXHJSGRMG-WUHRBBMRSA-N 2 0 220.360 2.049 20 0 BEADRP C[C@@H]1C[N@H+](CC2CCCCC2)C[C@@]1(C)C[NH3+] ZINC000309179841 385169760 /nfs/dbraw/zinc/16/97/60/385169760.db2.gz BZLSSZCSECUOFT-TZMCWYRMSA-N 2 0 224.392 2.483 20 0 BEADRP CCSCC[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000308803300 385173155 /nfs/dbraw/zinc/17/31/55/385173155.db2.gz LNRKWMUJSLMPQU-UHFFFAOYSA-N 2 0 230.421 2.202 20 0 BEADRP C[C@H](CC(F)(F)F)[NH2+][C@@H](C)CCCC[NH3+] ZINC000308860568 385221620 /nfs/dbraw/zinc/22/16/20/385221620.db2.gz PDUCLVZEENRAPI-DTWKUNHWSA-N 2 0 226.286 2.434 20 0 BEADRP COC(C)(C)[C@H](C)[NH2+]CCC[N@H+](C)C(C)C ZINC000300990301 385222517 /nfs/dbraw/zinc/22/25/17/385222517.db2.gz LNYLIOUSHRJATR-LBPRGKRZSA-N 2 0 230.396 2.120 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H]2CCC[C@H]3C[C@H]32)C1 ZINC000304562943 385238551 /nfs/dbraw/zinc/23/85/51/385238551.db2.gz LOBJZUAVAZXHEG-IGQOVBAYSA-N 2 0 222.376 2.106 20 0 BEADRP C[C@@H](C[NH2+]C[C@@H]1CCC[NH2+]1)c1ccccc1 ZINC000235156827 385240152 /nfs/dbraw/zinc/24/01/52/385240152.db2.gz UVTLDDMWTYUECZ-JSGCOSHPSA-N 2 0 218.344 2.132 20 0 BEADRP C[C@H](C[NH2+]C1CCCCCC1)C[NH+](C)C ZINC000308932592 385303659 /nfs/dbraw/zinc/30/36/59/385303659.db2.gz RRYARIARLAIGAJ-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CC(C)(C)C)[C@H](C)C1 ZINC000178677720 385316865 /nfs/dbraw/zinc/31/68/65/385316865.db2.gz FMWNDGYPTPCJLG-VXGBXAGGSA-N 2 0 212.381 2.352 20 0 BEADRP CC1(C)CCC[C@H](C[N@@H+]2CC[C@H](C[NH3+])C2)C1 ZINC000647490854 385281449 /nfs/dbraw/zinc/28/14/49/385281449.db2.gz VOCAWENLJACLBV-QWHCGFSZSA-N 2 0 224.392 2.483 20 0 BEADRP [NH3+]C[C@@H]1CC[N@H+](Cc2nccc3ccccc32)C1 ZINC000647490746 385282105 /nfs/dbraw/zinc/28/21/05/385282105.db2.gz NDWBLKZIYZLIMO-LBPRGKRZSA-N 2 0 241.338 2.015 20 0 BEADRP [NH3+]C[C@H]1CC[N@H+](Cc2ccc3cnccc3c2)C1 ZINC000647490379 385283185 /nfs/dbraw/zinc/28/31/85/385283185.db2.gz STQAPCZSKNGZLR-CYBMUJFWSA-N 2 0 241.338 2.015 20 0 BEADRP Cc1ccc(C[N@H+]2C[C@@H](C[NH3+])C[C@H]2C)cc1C ZINC000228064159 385323861 /nfs/dbraw/zinc/32/38/61/385323861.db2.gz XERLLWGCXCOUPZ-UKRRQHHQSA-N 2 0 232.371 2.473 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]C[C@@H]1CC=CCC1 ZINC000309024660 385367720 /nfs/dbraw/zinc/36/77/20/385367720.db2.gz XFMMCRRLIUQHDY-QWHCGFSZSA-N 2 0 210.365 2.450 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]C[C@@]1(C)CCCS1 ZINC000309019303 385373434 /nfs/dbraw/zinc/37/34/34/385373434.db2.gz STLMVNQUEMKNNU-NWDGAFQWSA-N 2 0 230.421 2.379 20 0 BEADRP CC(C)OCCCC[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000180456051 385391544 /nfs/dbraw/zinc/39/15/44/385391544.db2.gz WPXOVBAQPRWDRA-KGLIPLIRSA-N 2 0 242.407 2.264 20 0 BEADRP Cc1ccc(C)c(C[NH+]2C[C@H]3C[N@H+](C)C[C@H]3C2)c1 ZINC000193608745 385404515 /nfs/dbraw/zinc/40/45/15/385404515.db2.gz CKIPAKDBYSDDFO-IYBDPMFKSA-N 2 0 244.382 2.297 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H]1CCO[C@H]1c1ccccc1 ZINC000422824337 385423649 /nfs/dbraw/zinc/42/36/49/385423649.db2.gz NOLDUJYGHHPLDE-VIRABCJISA-N 2 0 248.370 2.232 20 0 BEADRP CCC1CC([NH2+][C@H]2CCN(C)[C@@H](C)C2)C1 ZINC000309176631 385451477 /nfs/dbraw/zinc/45/14/77/385451477.db2.gz MXTLLXBUADMFJA-QCXCNERSSA-N 2 0 210.365 2.247 20 0 BEADRP COCCC(C)(C)C[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000183934488 385482271 /nfs/dbraw/zinc/48/22/71/385482271.db2.gz GNTQCZBBKZQHNI-STQMWFEESA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000309274950 385508501 /nfs/dbraw/zinc/50/85/01/385508501.db2.gz DRGKZJLJNPHTHH-OPRDCNLKSA-N 2 0 238.297 2.292 20 0 BEADRP COC1(C[N@@H+]2CCC[C@H]([C@@H](C)[NH3+])C2)CCCC1 ZINC000318932276 385525713 /nfs/dbraw/zinc/52/57/13/385525713.db2.gz ANVVYQUHFWOLFB-OLZOCXBDSA-N 2 0 240.391 2.005 20 0 BEADRP CC(C)[NH2+]C1CC[NH+](CC2CCC2)CC1 ZINC000173309207 385553228 /nfs/dbraw/zinc/55/32/28/385553228.db2.gz MRHUBQKDEIZGOL-UHFFFAOYSA-N 2 0 210.365 2.249 20 0 BEADRP CC(C)(C)CCC[N@@H+]1C[C@@H]2CC[C@H]([NH3+])[C@@H]2C1 ZINC000309388810 385559659 /nfs/dbraw/zinc/55/96/59/385559659.db2.gz SPOTUJVGAJGNGR-XQQFMLRXSA-N 2 0 224.392 2.482 20 0 BEADRP CC[C@@H]([NH2+]C1CC[NH2+]CC1)c1ccc(OC)cc1 ZINC000038041174 385599308 /nfs/dbraw/zinc/59/93/08/385599308.db2.gz ODEMIXJLEYIEPY-OAHLLOKOSA-N 2 0 248.370 2.488 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)[C@H]1C ZINC000336650096 385604800 /nfs/dbraw/zinc/60/48/00/385604800.db2.gz DLMNUWGYZLETME-CZXHOFHRSA-N 2 0 222.376 2.105 20 0 BEADRP CCC1CC([NH2+]C[C@H](C)C[NH+]2CCCC2)C1 ZINC000336677998 385614783 /nfs/dbraw/zinc/61/47/83/385614783.db2.gz CDSHMFFNKFGQGW-HSBZDZAISA-N 2 0 224.392 2.497 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]C[C@@H](C)c1ccc(F)cc1 ZINC000414848799 385619445 /nfs/dbraw/zinc/61/94/45/385619445.db2.gz XJSPDPKOJCANAQ-VXGBXAGGSA-N 2 0 238.350 2.374 20 0 BEADRP FCCCCC[N@@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000309487523 385607675 /nfs/dbraw/zinc/60/76/75/385607675.db2.gz YPCMRZRBJZUAID-UHFFFAOYSA-N 2 0 228.355 2.202 20 0 BEADRP CSCCCCC[NH2+][C@H](C)CCC[NH3+] ZINC000336650255 385609011 /nfs/dbraw/zinc/60/90/11/385609011.db2.gz AMDCHBJZMBLINH-LLVKDONJSA-N 2 0 218.410 2.237 20 0 BEADRP Cc1sccc1C[NH2+]CCCC[NH+](C)C ZINC000293456159 385611242 /nfs/dbraw/zinc/61/12/42/385611242.db2.gz CXWWSASBMAEJSQ-UHFFFAOYSA-N 2 0 226.389 2.488 20 0 BEADRP CC(C)C[C@H](C)C[N@@H+]1C[C@@H]2CC[C@@H]([NH3+])[C@@H]2C1 ZINC000336653168 385658907 /nfs/dbraw/zinc/65/89/07/385658907.db2.gz FZYLVRLPFGTQPB-IGQOVBAYSA-N 2 0 224.392 2.338 20 0 BEADRP CCC1CC([NH2+]CCN2CC=C(C)CC2)C1 ZINC000309538708 385673198 /nfs/dbraw/zinc/67/31/98/385673198.db2.gz FNWRMLWITGWLSZ-UHFFFAOYSA-N 2 0 222.376 2.417 20 0 BEADRP C[C@H](CCCC(F)(F)F)[NH2+]C[C@@H]1CCC[NH2+]1 ZINC000414853369 385688962 /nfs/dbraw/zinc/68/89/62/385688962.db2.gz XUAVWZRBWPBWSQ-ZJUUUORDSA-N 2 0 238.297 2.449 20 0 BEADRP CCC1(C[NH2+][C@@H](C)CCCC[NH3+])CCOCC1 ZINC000336687732 385705742 /nfs/dbraw/zinc/70/57/42/385705742.db2.gz GSYMENLNZHRJSD-ZDUSSCGKSA-N 2 0 242.407 2.300 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]Cc1ccccc1 ZINC000307584978 385707476 /nfs/dbraw/zinc/70/74/76/385707476.db2.gz KHQIBXZPXXGDBM-LBPRGKRZSA-N 2 0 206.333 2.294 20 0 BEADRP CC(C)C[C@@H](C)C[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000414856184 385708599 /nfs/dbraw/zinc/70/85/99/385708599.db2.gz OASNXIBQYITESJ-OLZOCXBDSA-N 2 0 212.381 2.258 20 0 BEADRP C(CC1CCCC1)C[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC000309588475 385715228 /nfs/dbraw/zinc/71/52/28/385715228.db2.gz XLQHNOFTEHLHMD-OKILXGFUSA-N 2 0 222.376 2.108 20 0 BEADRP CCOC[C@@H](C)[NH2+]CC1([NH3+])CCCCCC1 ZINC000414857721 385731621 /nfs/dbraw/zinc/73/16/21/385731621.db2.gz FLGDADSHCRXJKL-GFCCVEGCSA-N 2 0 228.380 2.053 20 0 BEADRP C[NH2+]CCC[NH2+][C@H](C)CCc1cccc(F)c1 ZINC000414857719 385731637 /nfs/dbraw/zinc/73/16/37/385731637.db2.gz FKQNXTZNEBGVEW-GFCCVEGCSA-N 2 0 238.350 2.346 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H](C)CCc1ccccc1 ZINC000414858294 385733693 /nfs/dbraw/zinc/73/36/93/385733693.db2.gz IUZKPKYPEUHXQI-ZDUSSCGKSA-N 2 0 220.360 2.207 20 0 BEADRP COc1ccc(C[NH2+][C@@H](C)[C@H]2CCC[NH2+]C2)cc1 ZINC000414858352 385733849 /nfs/dbraw/zinc/73/38/49/385733849.db2.gz RMXJDRWSTUXOOQ-JSGCOSHPSA-N 2 0 248.370 2.173 20 0 BEADRP C[NH2+]CCC[NH2+][C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000414858960 385733989 /nfs/dbraw/zinc/73/39/89/385733989.db2.gz LQUDVNLADCUDAO-ZJUUUORDSA-N 2 0 238.297 2.307 20 0 BEADRP CC(C)CCC[C@@H](C)[NH2+]C[C@H](C)C[NH3+] ZINC000336692395 385734378 /nfs/dbraw/zinc/73/43/78/385734378.db2.gz QGLJMBBBVGDNBD-VXGBXAGGSA-N 2 0 200.370 2.386 20 0 BEADRP C[C@@H]([NH2+]Cc1ccccc1)[C@H]1CCC[NH2+]C1 ZINC000414861306 385749806 /nfs/dbraw/zinc/74/98/06/385749806.db2.gz WKDZYEFUGUHSQU-OCCSQVGLSA-N 2 0 218.344 2.164 20 0 BEADRP CC(C)C[C@H](C)[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000336697918 385754357 /nfs/dbraw/zinc/75/43/57/385754357.db2.gz OLNSSCLEFZDSOX-STQMWFEESA-N 2 0 212.381 2.400 20 0 BEADRP C[NH2+]CCC[NH2+]C1CCC(C(F)(F)F)CC1 ZINC000414862628 385755817 /nfs/dbraw/zinc/75/58/17/385755817.db2.gz VRWSTEAZNNLVMX-UHFFFAOYSA-N 2 0 238.297 2.307 20 0 BEADRP CC[NH2+]Cc1ccccc1NC[C@H]1CCC[NH2+]C1 ZINC000414863362 385759402 /nfs/dbraw/zinc/75/94/02/385759402.db2.gz IYDYQBKGAJOMTP-ZDUSSCGKSA-N 2 0 247.386 2.208 20 0 BEADRP CCC[NH2+]CC[NH2+]C[C@@H](C)CC1CCOCC1 ZINC000414864556 385764206 /nfs/dbraw/zinc/76/42/06/385764206.db2.gz CWRQGFPJZFYKIS-ZDUSSCGKSA-N 2 0 242.407 2.028 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+]Cc1cccc(C(F)(F)F)c1 ZINC000336700515 385764387 /nfs/dbraw/zinc/76/43/87/385764387.db2.gz JRLZXNDIFOHHPB-VIFPVBQESA-N 2 0 246.276 2.390 20 0 BEADRP C[NH2+]Cc1ccccc1NC[C@H]([NH3+])CC(C)C ZINC000414865222 385769471 /nfs/dbraw/zinc/76/94/71/385769471.db2.gz KLLHRVFPNKZNKW-CYBMUJFWSA-N 2 0 235.375 2.191 20 0 BEADRP C[N@H+]1CC=C(C[NH2+]CC2CCCCC2)CC1 ZINC000309682855 385787510 /nfs/dbraw/zinc/78/75/10/385787510.db2.gz ZXQBOUUYVPDIQN-UHFFFAOYSA-N 2 0 222.376 2.418 20 0 BEADRP CC(C)[C@@H]1CCC[C@@H]1[NH2+][C@H]1CC[NH2+]C[C@H]1C ZINC000414944868 385784101 /nfs/dbraw/zinc/78/41/01/385784101.db2.gz QORUWWDPXWGEBD-RFGFWPKPSA-N 2 0 224.392 2.399 20 0 BEADRP Cc1ccc(CCC[NH2+][C@@H]2CC[NH2+][C@@H](C)C2)cn1 ZINC000414945421 385799626 /nfs/dbraw/zinc/79/96/26/385799626.db2.gz IHBOQVZPJSJIBO-DZGCQCFKSA-N 2 0 247.386 2.053 20 0 BEADRP c1coc([C@@H]2C[C@H]2[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)c1 ZINC000647799626 385800118 /nfs/dbraw/zinc/80/01/18/385800118.db2.gz MPMISCQSQRJMRU-RYMFRWLXSA-N 2 0 246.354 2.113 20 0 BEADRP F[C@@H]1CCCC[C@H]1[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000647799477 385800197 /nfs/dbraw/zinc/80/01/97/385800197.db2.gz IEBDDWJCAFCDMD-XVIXHAIJSA-N 2 0 240.366 2.245 20 0 BEADRP F[C@@H]1CCCC[C@H]1[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000647799475 385800634 /nfs/dbraw/zinc/80/06/34/385800634.db2.gz IEBDDWJCAFCDMD-ODXJTPSBSA-N 2 0 240.366 2.245 20 0 BEADRP Cc1ccc(CCC[NH2+][C@H]2CC[NH2+][C@@H](C)C2)cn1 ZINC000414945429 385800797 /nfs/dbraw/zinc/80/07/97/385800797.db2.gz IHBOQVZPJSJIBO-ZFWWWQNUSA-N 2 0 247.386 2.053 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCc3ccccc3C2)CC[NH2+]1 ZINC000414947432 385801977 /nfs/dbraw/zinc/80/19/77/385801977.db2.gz KVBFWHLEHRSJIX-DAXOMENPSA-N 2 0 244.382 2.274 20 0 BEADRP C1[C@@H]([NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)[C@@H]1C1CCC1 ZINC000647799701 385803129 /nfs/dbraw/zinc/80/31/29/385803129.db2.gz OLNOFDBQVWFPLR-ARILJUKYSA-N 2 0 234.387 2.153 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@H]1CCC[C@H]1C1CC1 ZINC000414947836 385805013 /nfs/dbraw/zinc/80/50/13/385805013.db2.gz XDYATMKOHDZYRA-SAXRGWBVSA-N 2 0 222.376 2.153 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]C[C@H]1C[C@@H]1c1ccccc1 ZINC000647800415 385806440 /nfs/dbraw/zinc/80/64/40/385806440.db2.gz AVTYFZJRPLYGSL-TUVASFSCSA-N 2 0 230.355 2.260 20 0 BEADRP C[C@H](C[NH2+][C@@H](C)CCCC[NH3+])CC(F)F ZINC000647800458 385806575 /nfs/dbraw/zinc/80/65/75/385806575.db2.gz BNLSTIFIFHXZAH-UWVGGRQHSA-N 2 0 222.323 2.385 20 0 BEADRP C[C@@H](C[NH2+][C@@H](C)CCCC[NH3+])CC(F)F ZINC000647800460 385806774 /nfs/dbraw/zinc/80/67/74/385806774.db2.gz BNLSTIFIFHXZAH-ZJUUUORDSA-N 2 0 222.323 2.385 20 0 BEADRP C[C@@H](C[NH2+][C@H](C)[C@@H]1CCCC[NH2+]1)CC(F)F ZINC000647800561 385807577 /nfs/dbraw/zinc/80/75/77/385807577.db2.gz FGYWEMBRTHSLFL-MXWKQRLJSA-N 2 0 234.334 2.398 20 0 BEADRP C[C@H](C[NH2+][C@@H](C)C1CCCC1)C[NH+](C)C ZINC000336714659 385811377 /nfs/dbraw/zinc/81/13/77/385811377.db2.gz WCAJIDMFQVVTJW-NEPJUHHUSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H](C[NH2+][C@@H](C)[C@H]1CCC[NH2+]1)CC(F)F ZINC000647801558 385811412 /nfs/dbraw/zinc/81/14/12/385811412.db2.gz YHJIKSWIJOICPY-LPEHRKFASA-N 2 0 220.307 2.008 20 0 BEADRP C1C[C@@H]([NH2+][C@@H]2CC[NH2+]C2)C2(C1)CCCCC2 ZINC000313024744 385813665 /nfs/dbraw/zinc/81/36/65/385813665.db2.gz NKXDUEBTVUIQCV-CHWSQXEVSA-N 2 0 222.376 2.441 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[NH2+][C@H](C)C2)C1 ZINC000414950311 385816401 /nfs/dbraw/zinc/81/64/01/385816401.db2.gz OJRMLVOIYNRJNN-FVCCEPFGSA-N 2 0 210.365 2.295 20 0 BEADRP Cc1ccncc1[C@@H](C)[NH2+]CCCC[NH+](C)C ZINC000271327698 385818973 /nfs/dbraw/zinc/81/89/73/385818973.db2.gz ANCZKDHIKBDAJA-CYBMUJFWSA-N 2 0 235.375 2.382 20 0 BEADRP CC(C)(C)C[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000112341315 385840122 /nfs/dbraw/zinc/84/01/22/385840122.db2.gz VJNQQHQMQXDHRS-VXGBXAGGSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@H]([NH2+]CC1CCC(F)CC1)[C@H]1CCC[NH2+]1 ZINC000647804263 385840698 /nfs/dbraw/zinc/84/06/98/385840698.db2.gz MXEYPLSZVRMUNS-YWPUVAFDSA-N 2 0 228.355 2.245 20 0 BEADRP CCC[NH2+]CC[NH2+][C@@H]1CCC[C@@H](C)[C@@H]1C ZINC000414871020 385854849 /nfs/dbraw/zinc/85/48/49/385854849.db2.gz NIWACVXKPLQDDL-FRRDWIJNSA-N 2 0 212.381 2.400 20 0 BEADRP CCC[NH2+]CC[NH2+][C@@H]1CCC[C@H](C)[C@@H]1C ZINC000414871022 385855592 /nfs/dbraw/zinc/85/55/92/385855592.db2.gz NIWACVXKPLQDDL-RWMBFGLXSA-N 2 0 212.381 2.400 20 0 BEADRP CCSCCC[NH2+][C@H]1CC[N@H+](CC)C[C@@H]1C ZINC000309679388 385792676 /nfs/dbraw/zinc/79/26/76/385792676.db2.gz ZBILEYDAZHJJPQ-STQMWFEESA-N 2 0 244.448 2.450 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)C(F)F ZINC000647798620 385794273 /nfs/dbraw/zinc/79/42/73/385794273.db2.gz UHTUGQZYVWORBJ-MMWGEVLESA-N 2 0 232.318 2.008 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)C(F)F ZINC000647798617 385794300 /nfs/dbraw/zinc/79/43/00/385794300.db2.gz UHTUGQZYVWORBJ-DBIOUOCHSA-N 2 0 232.318 2.008 20 0 BEADRP C[C@H](CCC1CCCC1)[NH2+][C@H]1CC[NH2+]C1 ZINC000414867059 385794388 /nfs/dbraw/zinc/79/43/88/385794388.db2.gz FYTUOYQBUBMXIX-YPMHNXCESA-N 2 0 210.365 2.297 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@H]2CCc3ccccc3C2)C1 ZINC000250844220 385928494 /nfs/dbraw/zinc/92/84/94/385928494.db2.gz HLXQWGPADKOEAF-PMPSAXMXSA-N 2 0 244.382 2.403 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+]Cc1cc(F)cc2cccnc21 ZINC000414874731 385886634 /nfs/dbraw/zinc/88/66/34/385886634.db2.gz IYTCIYRPAAUXCU-JTQLQIEISA-N 2 0 247.317 2.058 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+]C/C=C/c1ccc(F)cc1 ZINC000414874698 385887825 /nfs/dbraw/zinc/88/78/25/385887825.db2.gz IUSVSTPNYRQPGU-VUDBWIFFSA-N 2 0 222.307 2.023 20 0 BEADRP CC[NH2+]Cc1ccccc1NCC1CC[NH2+]CC1 ZINC000414875350 385893254 /nfs/dbraw/zinc/89/32/54/385893254.db2.gz ZISJKHOVNJMIBW-UHFFFAOYSA-N 2 0 247.386 2.208 20 0 BEADRP CCCCC[N@H+](C)CC[C@H]([NH3+])C(C)C ZINC000123648937 385898410 /nfs/dbraw/zinc/89/84/10/385898410.db2.gz YKQAFECUDOOMIC-LBPRGKRZSA-N 2 0 200.370 2.482 20 0 BEADRP Cc1cc(N)cc(C[NH2+][C@@H](C)C[C@H]2CCC[NH2+]2)c1 ZINC000414964003 385901462 /nfs/dbraw/zinc/90/14/62/385901462.db2.gz LKFKSBAJPBAJPO-SWLSCSKDSA-N 2 0 247.386 2.197 20 0 BEADRP CC(C)CC[N@H+](C)CC[C@@H]([NH3+])C(C)C ZINC000123706854 385904824 /nfs/dbraw/zinc/90/48/24/385904824.db2.gz XXAAOWPQSJOXJT-GFCCVEGCSA-N 2 0 200.370 2.338 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]Cc1ccc(Cl)cc1F ZINC000414876176 385905621 /nfs/dbraw/zinc/90/56/21/385905621.db2.gz KWMQYIBNVKEVLG-MRVPVSSYSA-N 2 0 230.714 2.164 20 0 BEADRP COC[C@]1(C[NH2+][C@@H](C)CCC(C)C)CCC[NH2+]1 ZINC000414964847 385909135 /nfs/dbraw/zinc/90/91/35/385909135.db2.gz YPNXXVQDHRJGFO-UONOGXRCSA-N 2 0 242.407 2.169 20 0 BEADRP Cc1ccc(CN2CC[C@H]3CC[N@@H+](C)C[C@H]32)o1 ZINC000272544121 385911219 /nfs/dbraw/zinc/91/12/19/385911219.db2.gz CGCXPEIMNBVDPR-TZMCWYRMSA-N 2 0 234.343 2.114 20 0 BEADRP CC(C)=CCC[NH2+][C@@H](C)[C@H]1CCCC[NH2+]1 ZINC000397769938 385913030 /nfs/dbraw/zinc/91/30/30/385913030.db2.gz UPRNRMIJVLQEFL-QWHCGFSZSA-N 2 0 210.365 2.463 20 0 BEADRP CCCC[C@@H](COC)[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000414965227 385913519 /nfs/dbraw/zinc/91/35/19/385913519.db2.gz NJOJKVSXGCMGIT-KGLIPLIRSA-N 2 0 242.407 2.313 20 0 BEADRP COc1ccccc1/C=C/C[NH2+][C@H](C)CC[NH3+] ZINC000414877063 385917088 /nfs/dbraw/zinc/91/70/88/385917088.db2.gz FKRQKCPABNRZCE-HOSRBBHYSA-N 2 0 234.343 2.035 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@@H]1CC[C@@H](C)[C@@H](C)C1 ZINC000414966322 385919588 /nfs/dbraw/zinc/91/95/88/385919588.db2.gz WIEMTSDYAROIND-YVECIDJPSA-N 2 0 212.381 2.399 20 0 BEADRP C([NH2+][C@@H]1CCCC12CCCC2)[C@@H]1CCC[NH2+]1 ZINC000335033071 385921317 /nfs/dbraw/zinc/92/13/17/385921317.db2.gz OFSBQNVQNBLIQX-QWHCGFSZSA-N 2 0 222.376 2.441 20 0 BEADRP C([NH2+][C@H]1CCCC12CCCC2)[C@@H]1CCC[NH2+]1 ZINC000335033072 385922121 /nfs/dbraw/zinc/92/21/21/385922121.db2.gz OFSBQNVQNBLIQX-STQMWFEESA-N 2 0 222.376 2.441 20 0 BEADRP CCOc1ccccc1CN[C@@H]1CC[NH2+]C[C@H]1C ZINC000414966961 385924667 /nfs/dbraw/zinc/92/46/67/385924667.db2.gz XCCPGDKXWOUVCW-TZMCWYRMSA-N 2 0 248.370 2.173 20 0 BEADRP CC[C@H]1CO[C@H](C)CN1CCC[NH+](CC)CC ZINC000338251488 385926798 /nfs/dbraw/zinc/92/67/98/385926798.db2.gz PNDPBODHRNVQQZ-KGLIPLIRSA-N 2 0 242.407 2.218 20 0 BEADRP [NH3+]C1(C[NH2+][C@H]2CCC[C@@H](C3CC3)C2)CCC1 ZINC000414871917 385860332 /nfs/dbraw/zinc/86/03/32/385860332.db2.gz DSIBWLATJSEGCN-OLZOCXBDSA-N 2 0 222.376 2.426 20 0 BEADRP COc1ccc(C[N@@H+]2C[C@H](C[NH3+])C[C@H]2C)cc1C ZINC000250874404 385927563 /nfs/dbraw/zinc/92/75/63/385927563.db2.gz HVAODTRYECNVOX-OCCSQVGLSA-N 2 0 248.370 2.173 20 0 BEADRP Cc1ccc2cc(C[NH2+]C[C@@H](C)C[NH3+])ccc2n1 ZINC000414872946 385870647 /nfs/dbraw/zinc/87/06/47/385870647.db2.gz GSSLJBMUHOIXOQ-NSHDSACASA-N 2 0 243.354 2.228 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C2CCC(C[NH3+])CC2)C[C@H](C)O1 ZINC000335037708 385928144 /nfs/dbraw/zinc/92/81/44/385928144.db2.gz FBYBOPDQQQEXFL-NRSZHIJWSA-N 2 0 240.391 2.050 20 0 BEADRP [NH3+]C1CCC([NH2+]C2CC(C(F)(F)F)C2)CC1 ZINC000335017846 385975783 /nfs/dbraw/zinc/97/57/83/385975783.db2.gz OHFLRLSKUSOEOT-UHFFFAOYSA-N 2 0 236.281 2.187 20 0 BEADRP COc1cccc(C[NH2+]CCC[C@H]2CCC[NH2+]2)c1 ZINC000414971559 385976118 /nfs/dbraw/zinc/97/61/18/385976118.db2.gz LPEBAIIZMLUNCC-AWEZNQCLSA-N 2 0 248.370 2.317 20 0 BEADRP CC[NH+](CC)CCC[N@@H+]1CC[C@H](OC)C[C@H]1C ZINC000338365490 385980295 /nfs/dbraw/zinc/98/02/95/385980295.db2.gz RRRZLWMSCZNAFB-KGLIPLIRSA-N 2 0 242.407 2.218 20 0 BEADRP CC[NH+](CC)CCC[N@@H+]1CC[C@H](OC)C[C@@H]1C ZINC000338365487 385981751 /nfs/dbraw/zinc/98/17/51/385981751.db2.gz RRRZLWMSCZNAFB-KBPBESRZSA-N 2 0 242.407 2.218 20 0 BEADRP Cc1cc(N)cc(C[NH2+]C[C@H]2CC[NH2+][C@@H](C)C2)c1 ZINC000414972421 385983659 /nfs/dbraw/zinc/98/36/59/385983659.db2.gz XWWPWTFTFBTCFD-STQMWFEESA-N 2 0 247.386 2.055 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCCc2ccc(F)cc21)C1C[NH2+]C1 ZINC000335023577 385984838 /nfs/dbraw/zinc/98/48/38/385984838.db2.gz SBAYCGWWGDDVEJ-MEBBXXQBSA-N 2 0 248.345 2.401 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+]Cc1ccc(F)cc1 ZINC000335039080 385930520 /nfs/dbraw/zinc/93/05/20/385930520.db2.gz LWVKLXAGZJMOPS-SMDDNHRTSA-N 2 0 236.334 2.303 20 0 BEADRP Cc1cccc2c1CC[C@@H]2[NH2+]CC1([NH3+])CCC1 ZINC000335054659 385953673 /nfs/dbraw/zinc/95/36/73/385953673.db2.gz SXYCVYMIDDIMCE-AWEZNQCLSA-N 2 0 230.355 2.453 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@@H]1CCC[C@H]2C[C@H]21 ZINC000304648724 385954826 /nfs/dbraw/zinc/95/48/26/385954826.db2.gz YAYJLFNFVBABBH-BFHYXJOUSA-N 2 0 224.392 2.495 20 0 BEADRP c1ccc2c(c1)CC[C@H]([NH2+]CC1=CC[NH2+]CC1)C2 ZINC000335057544 385958422 /nfs/dbraw/zinc/95/84/22/385958422.db2.gz GFCFKUDPXUHKRW-INIZCTEOSA-N 2 0 242.366 2.053 20 0 BEADRP Cn1cccc1[C@H]1CCC[N@@H+]1CCn1ccnc1 ZINC000272998538 385958515 /nfs/dbraw/zinc/95/85/15/385958515.db2.gz RRFUEAPOUSQYGC-CQSZACIVSA-N 2 0 244.342 2.059 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CC2([NH3+])CCCCCC2)CCO1 ZINC000335057520 385959463 /nfs/dbraw/zinc/95/94/63/385959463.db2.gz FKAPLZHXMZQQOL-OLZOCXBDSA-N 2 0 240.391 2.195 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CC2([NH3+])CCCCCC2)CCO1 ZINC000335057522 385959589 /nfs/dbraw/zinc/95/95/89/385959589.db2.gz FKAPLZHXMZQQOL-STQMWFEESA-N 2 0 240.391 2.195 20 0 BEADRP C[C@H](CC[NH3+])[NH2+]Cc1ccccc1OC(F)F ZINC000414880220 385965516 /nfs/dbraw/zinc/96/55/16/385965516.db2.gz JHNXIKGLAQCRFF-SECBINFHSA-N 2 0 244.285 2.115 20 0 BEADRP CN(CCC[N@H+](C)CC1CC1)Cc1ccco1 ZINC000285850871 385971031 /nfs/dbraw/zinc/97/10/31/385971031.db2.gz XWESJAKHVQHBRQ-UHFFFAOYSA-N 2 0 236.359 2.443 20 0 BEADRP C[C@@H]1CCC[C@H](C[NH2+]CC2([NH3+])CCC2)C1 ZINC000414880552 385973007 /nfs/dbraw/zinc/97/30/07/385973007.db2.gz RCJKZVWPJOOGJF-NEPJUHHUSA-N 2 0 210.365 2.284 20 0 BEADRP CC[NH+](CC)CCCN1CC(C)(C)OC[C@H]1C ZINC000338345831 385974014 /nfs/dbraw/zinc/97/40/14/385974014.db2.gz BGTPUVVHNUNZJE-CYBMUJFWSA-N 2 0 242.407 2.218 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]Cc1cccc2c1OC(C)(C)C2 ZINC000414881504 386001448 /nfs/dbraw/zinc/00/14/48/386001448.db2.gz SJZDCLFXYZGMFL-LLVKDONJSA-N 2 0 248.370 2.085 20 0 BEADRP Cc1ccc(C[NH2+]C[C@H](C)C[NH3+])cc1Cl ZINC000414881853 386005398 /nfs/dbraw/zinc/00/53/98/386005398.db2.gz SVBAPPMXFKUUCV-SECBINFHSA-N 2 0 226.751 2.333 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+]Cc1sccc1Cl ZINC000414882365 386012264 /nfs/dbraw/zinc/01/22/64/386012264.db2.gz UDVLVVBHCXIYQO-ZETCQYMHSA-N 2 0 218.753 2.086 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)c1ccncc1 ZINC000414168743 386013947 /nfs/dbraw/zinc/01/39/47/386013947.db2.gz ALBZJVPCLYPJRD-ZIAGYGMSSA-N 2 0 247.386 2.464 20 0 BEADRP C[C@H]([NH2+]Cc1ccc2c[nH+]cn2c1)[C@H]1C[C@H]1C ZINC000414180586 386022697 /nfs/dbraw/zinc/02/26/97/386022697.db2.gz LFGVWTFHLQPVNK-SUNKGSAMSA-N 2 0 229.327 2.468 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]C[C@@H](C)CCc1ccccc1 ZINC000414882852 386023924 /nfs/dbraw/zinc/02/39/24/386023924.db2.gz USHJEUBZBAZQNW-UONOGXRCSA-N 2 0 234.387 2.440 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)c1cccnc1 ZINC000414185506 386025140 /nfs/dbraw/zinc/02/51/40/386025140.db2.gz OTDAYPUSAYMWGX-UONOGXRCSA-N 2 0 247.386 2.464 20 0 BEADRP COCCC[C@H](C)[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000414183790 386026064 /nfs/dbraw/zinc/02/60/64/386026064.db2.gz NNPKEOJJLUBCGB-LBPRGKRZSA-N 2 0 247.342 2.239 20 0 BEADRP Fc1ccc2c(c1)CC[C@@H]2[NH2+]CC1=CC[NH2+]CC1 ZINC000335061496 386026822 /nfs/dbraw/zinc/02/68/22/386026822.db2.gz WZRXITZCYLFJRN-HNNXBMFYSA-N 2 0 246.329 2.322 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)[C@H]1C[C@H]1C ZINC000414191448 386030406 /nfs/dbraw/zinc/03/04/06/386030406.db2.gz RYPGHNVLTJJKGS-RFGFWPKPSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1CCCC[C@H]1C[NH2+]C[C@@H]([NH3+])C1CC1 ZINC000414883181 386032427 /nfs/dbraw/zinc/03/24/27/386032427.db2.gz CVHRPUATTXDXPH-KGYLQXTDSA-N 2 0 210.365 2.140 20 0 BEADRP CCc1cc(OC)ccc1CNCC1([NH3+])CCC1 ZINC000414883498 386032696 /nfs/dbraw/zinc/03/26/96/386032696.db2.gz VEIBYGQDMWUISC-UHFFFAOYSA-N 2 0 248.370 2.229 20 0 BEADRP C[C@@H](CC1CCCC1)[NH2+]CC1([NH3+])CCC1 ZINC000414883505 386033374 /nfs/dbraw/zinc/03/33/74/386033374.db2.gz VEWRSZRZRXTGNK-NSHDSACASA-N 2 0 210.365 2.426 20 0 BEADRP C[NH2+]Cc1ccc(NC2CCC([NH3+])CC2)cc1 ZINC000414978810 386034008 /nfs/dbraw/zinc/03/40/08/386034008.db2.gz SNBVZTFIRTYGEN-UHFFFAOYSA-N 2 0 233.359 2.088 20 0 BEADRP COC(C)(C)[C@@H](C)[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000414200215 386036918 /nfs/dbraw/zinc/03/69/18/386036918.db2.gz ZMBWKGDULZXCGS-LLVKDONJSA-N 2 0 247.342 2.237 20 0 BEADRP C[C@@H](C[NH2+]C/C=C/c1ccccc1)C[NH+](C)C ZINC000291762391 386040349 /nfs/dbraw/zinc/04/03/49/386040349.db2.gz RRHKEBGDNZIGKA-RNVIBTMRSA-N 2 0 232.371 2.487 20 0 BEADRP c1ccc(C[C@@H]2CC[C@@H]([NH2+][C@@H]3CC[NH2+]C3)C2)cc1 ZINC000414889083 386106014 /nfs/dbraw/zinc/10/60/14/386106014.db2.gz SPDZRFKCYIEFBF-ARFHVFGLSA-N 2 0 244.382 2.349 20 0 BEADRP c1ccc(C[C@@H]2CC[C@H]([NH2+][C@@H]3CC[NH2+]C3)C2)cc1 ZINC000414889084 386107143 /nfs/dbraw/zinc/10/71/43/386107143.db2.gz SPDZRFKCYIEFBF-HRCADAONSA-N 2 0 244.382 2.349 20 0 BEADRP Cc1ccc([C@H](C)[NH2+]C2CC[NH2+]CC2)cc1 ZINC000038041493 386117167 /nfs/dbraw/zinc/11/71/67/386117167.db2.gz HHSDHDUBUOEUFB-LBPRGKRZSA-N 2 0 218.344 2.398 20 0 BEADRP CCC[N@@H+]1CC[C@H](CNCc2ccoc2C)C1 ZINC000414320279 386117531 /nfs/dbraw/zinc/11/75/31/386117531.db2.gz SFTMJEPLFDMJJH-CYBMUJFWSA-N 2 0 236.359 2.410 20 0 BEADRP Cc1ccccc1C[C@H](C)[NH2+]C[C@@H]([NH3+])C1CC1 ZINC000414885826 386068972 /nfs/dbraw/zinc/06/89/72/386068972.db2.gz GTHYTZFCPBHHJO-SWLSCSKDSA-N 2 0 232.371 2.253 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+][C@H]2CC2(C)C)[C@@H](C)C1 ZINC000414221860 386075859 /nfs/dbraw/zinc/07/58/59/386075859.db2.gz MUAGHNVKEZFJBD-TUAOUCFPSA-N 2 0 210.365 2.105 20 0 BEADRP Cc1cnccc1C[NH2+][C@H]1CCC[C@H]([NH+](C)C)C1 ZINC000295819742 386089582 /nfs/dbraw/zinc/08/95/82/386089582.db2.gz UOGFYQMSCBEJDJ-GJZGRUSLSA-N 2 0 247.386 2.352 20 0 BEADRP Cc1cnccc1C[NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1 ZINC000295819737 386089855 /nfs/dbraw/zinc/08/98/55/386089855.db2.gz UOGFYQMSCBEJDJ-CABCVRRESA-N 2 0 247.386 2.352 20 0 BEADRP Cc1cncc([C@@H](C)[NH2+]CC2=CC[N@H+](C)CC2)c1 ZINC000274352042 386090777 /nfs/dbraw/zinc/09/07/77/386090777.db2.gz GMZXRWSXGODEKH-CYBMUJFWSA-N 2 0 245.370 2.303 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@H](C)CCc1ccsc1 ZINC000414984337 386092941 /nfs/dbraw/zinc/09/29/41/386092941.db2.gz GDMCCDZGPRUZDM-PWSUYJOCSA-N 2 0 226.389 2.396 20 0 BEADRP [NH3+][C@H]1CCC[C@H](C[NH2+]Cc2ccc(F)cc2)C1 ZINC000414990286 386145031 /nfs/dbraw/zinc/14/50/31/386145031.db2.gz IEOPSCMJUAXCMC-JSGCOSHPSA-N 2 0 236.334 2.433 20 0 BEADRP CC[C@](C)(C[NH2+]CCC1CC[NH+](C)CC1)OC ZINC000319805880 386145060 /nfs/dbraw/zinc/14/50/60/386145060.db2.gz GULOEGCQGRYMOZ-CQSZACIVSA-N 2 0 242.407 2.123 20 0 BEADRP [NH3+][C@H]1CCC[C@H](C[NH2+]Cc2cccc(F)c2)C1 ZINC000414990751 386147392 /nfs/dbraw/zinc/14/73/92/386147392.db2.gz JBAUHSSHERZZGJ-JSGCOSHPSA-N 2 0 236.334 2.433 20 0 BEADRP [NH3+][C@H]1CCC[C@@H](C[NH2+]Cc2cccc(F)c2)C1 ZINC000414990753 386147801 /nfs/dbraw/zinc/14/78/01/386147801.db2.gz JBAUHSSHERZZGJ-OCCSQVGLSA-N 2 0 236.334 2.433 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@H]1CCc2ccccc2C1 ZINC000336729904 386149964 /nfs/dbraw/zinc/14/99/64/386149964.db2.gz XQVKHHQGWNCUQC-WFASDCNBSA-N 2 0 232.371 2.261 20 0 BEADRP C[C@@H]1CC(C)(C)CC[C@@H]1[NH2+][C@@H]1CC[NH2+]C1 ZINC000414892271 386150966 /nfs/dbraw/zinc/15/09/66/386150966.db2.gz XTTFRFQIQSMPEX-UTUOFQBUSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H](CCc1ccccc1)C[NH2+][C@H]1CC[NH2+]C1 ZINC000414893252 386154165 /nfs/dbraw/zinc/15/41/65/386154165.db2.gz YYHYHOCMTMXVOI-HIFRSBDPSA-N 2 0 232.371 2.207 20 0 BEADRP c1coc([C@@H]2C[C@H]2[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)c1 ZINC000414352181 386154957 /nfs/dbraw/zinc/15/49/57/386154957.db2.gz SZXNZIBDTAVEJF-XJFOESAGSA-N 2 0 246.354 2.352 20 0 BEADRP [NH3+][C@H](C[NH2+][C@@H]1CCC[C@@H](C2CC2)C1)C1CC1 ZINC000414894273 386171571 /nfs/dbraw/zinc/17/15/71/386171571.db2.gz SQKBGUBKUWLBFS-MGPQQGTHSA-N 2 0 222.376 2.282 20 0 BEADRP [NH3+]CCC[N@@H+]1CCC[C@H]1c1cccs1 ZINC000414685592 386172255 /nfs/dbraw/zinc/17/22/55/386172255.db2.gz ZXVBHUQBQHSKIE-JTQLQIEISA-N 2 0 210.346 2.234 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC000414994659 386172301 /nfs/dbraw/zinc/17/23/01/386172301.db2.gz VCFXFHDMQJUKFA-MJBXVCDLSA-N 2 0 218.344 2.117 20 0 BEADRP [NH3+]CCC[N@@H+]1CCC[C@@H]1c1cccs1 ZINC000414685593 386172845 /nfs/dbraw/zinc/17/28/45/386172845.db2.gz ZXVBHUQBQHSKIE-SNVBAGLBSA-N 2 0 210.346 2.234 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+]C[C@@H]([NH3+])C1CC1 ZINC000414894865 386177618 /nfs/dbraw/zinc/17/76/18/386177618.db2.gz UTXBGGINWLPQDO-VXNVDRBHSA-N 2 0 224.270 2.044 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]C[C@@H]([NH3+])C2CC2)[C@H]1C ZINC000414894822 386177836 /nfs/dbraw/zinc/17/78/36/386177836.db2.gz UKRMUOOQBIQXNA-DNIRFERGSA-N 2 0 210.365 2.138 20 0 BEADRP CC(C)N(C)C[C@H](C)[NH2+][C@H]1CCOC(C)(C)C1 ZINC000310429087 386184482 /nfs/dbraw/zinc/18/44/82/386184482.db2.gz MSKQCNUTWGXNMQ-STQMWFEESA-N 2 0 242.407 2.262 20 0 BEADRP C[C@H](CC[NH3+])[NH2+]C/C=C/c1ccc(F)cc1F ZINC000414895404 386184959 /nfs/dbraw/zinc/18/49/59/386184959.db2.gz NNACRKREWIRDNY-VMZHVLLKSA-N 2 0 240.297 2.305 20 0 BEADRP CO[C@H](C)C[N@H+](C[C@@H]1CC[NH2+][C@H](C)C1)C(C)C ZINC000414691360 386187441 /nfs/dbraw/zinc/18/74/41/386187441.db2.gz BJWMLFVSFYSUIV-MGPQQGTHSA-N 2 0 242.407 2.120 20 0 BEADRP CCSCC[NH+]1CCC([C@H]2CCC[NH2+]2)CC1 ZINC000129999077 386132510 /nfs/dbraw/zinc/13/25/10/386132510.db2.gz RLPYOFLALMJOFP-CYBMUJFWSA-N 2 0 242.432 2.204 20 0 BEADRP [NH3+]CCC[N@@H+]1CCC[C@@H]1c1ccsc1 ZINC000414670353 386134537 /nfs/dbraw/zinc/13/45/37/386134537.db2.gz DBMPHTQXLYFYJT-LLVKDONJSA-N 2 0 210.346 2.234 20 0 BEADRP Fc1cccc(CN(C[C@@H]2CC[NH2+]C2)C2CC2)c1 ZINC000647874844 386143512 /nfs/dbraw/zinc/14/35/12/386143512.db2.gz CTHZUGWZRIZMPC-CYBMUJFWSA-N 2 0 248.345 2.400 20 0 BEADRP C[N@H+](C[C@H]1CC[NH2+]C1)[C@@H]1CCc2ccccc21 ZINC000647874665 386143719 /nfs/dbraw/zinc/14/37/19/386143719.db2.gz KUMBBEGGYWAXCY-SWLSCSKDSA-N 2 0 230.355 2.215 20 0 BEADRP C[N@H+](C[C@@H]1CC[NH2+]C1)[C@H]1CCc2ccccc21 ZINC000647874663 386144046 /nfs/dbraw/zinc/14/40/46/386144046.db2.gz KUMBBEGGYWAXCY-DOMZBBRYSA-N 2 0 230.355 2.215 20 0 BEADRP CC(C)C[C@@H]([NH3+])CN1CCc2ccsc2C1 ZINC000414700060 386204748 /nfs/dbraw/zinc/20/47/48/386204748.db2.gz KCYCSLBHLHVHQE-GFCCVEGCSA-N 2 0 238.400 2.480 20 0 BEADRP COc1ccc([C@H](C)C[NH2+]CCCC[NH3+])cc1 ZINC000414896844 386208436 /nfs/dbraw/zinc/20/84/36/386208436.db2.gz AISXQTIUAHLYHA-GFCCVEGCSA-N 2 0 236.359 2.127 20 0 BEADRP CCc1ccc(C[N@@H+]2C[C@@H](C[NH3+])C[C@@H]2C)cc1 ZINC000131547183 386209322 /nfs/dbraw/zinc/20/93/22/386209322.db2.gz HMBKIVGFRFODGX-SWLSCSKDSA-N 2 0 232.371 2.418 20 0 BEADRP C[C@H](c1ccccn1)[N@H+](C)C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000414702605 386210096 /nfs/dbraw/zinc/21/00/96/386210096.db2.gz ICUZAHJLTBWGLW-MGPQQGTHSA-N 2 0 247.386 2.463 20 0 BEADRP CC[NH+](CC)CCC[NH2+]CCC1CCOCC1 ZINC000310583996 386210967 /nfs/dbraw/zinc/21/09/67/386210967.db2.gz SYIKZARUSIFPED-UHFFFAOYSA-N 2 0 242.407 2.125 20 0 BEADRP C[C@H]1[C@@H](c2ccccc2)CC[N@@H+]1CCC[NH3+] ZINC000414707050 386216382 /nfs/dbraw/zinc/21/63/82/386216382.db2.gz NJOIFMFQZSCKFU-JSGCOSHPSA-N 2 0 218.344 2.213 20 0 BEADRP C[N@H+](CCC[NH3+])Cc1ccccc1N1CCCC1 ZINC000347075865 386217129 /nfs/dbraw/zinc/21/71/29/386217129.db2.gz UTYRJHYGNKSDFL-UHFFFAOYSA-N 2 0 247.386 2.067 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]C[C@@H]2CCCCO2)c2ccccc21 ZINC000132061096 386219771 /nfs/dbraw/zinc/21/97/71/386219771.db2.gz SWEPYNYPJLXDLL-GLQYFDAESA-N 2 0 246.354 2.290 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]CC1(C)CC[NH2+]CC1 ZINC000414897702 386222115 /nfs/dbraw/zinc/22/21/15/386222115.db2.gz FHXKIEYIZAOLJO-NSHDSACASA-N 2 0 210.365 2.154 20 0 BEADRP CCC[C@H](CC)[NH2+]C[C@@H]1CC[N@H+](CC)C1 ZINC000125230651 386234561 /nfs/dbraw/zinc/23/45/61/386234561.db2.gz DOHFINOLJHAOKA-STQMWFEESA-N 2 0 212.381 2.497 20 0 BEADRP COc1ccc([C@@H](C)C[N@@H+]2CCC[C@H]2CN)cc1 ZINC000347125410 386236449 /nfs/dbraw/zinc/23/64/49/386236449.db2.gz YFVPLCJEWFKGCU-JSGCOSHPSA-N 2 0 248.370 2.222 20 0 BEADRP COc1ccc([C@@H](C)C[N@@H+]2CCC[C@@H]2CN)cc1 ZINC000347125402 386237860 /nfs/dbraw/zinc/23/78/60/386237860.db2.gz YFVPLCJEWFKGCU-GXTWGEPZSA-N 2 0 248.370 2.222 20 0 BEADRP C(C[C@H]1CCC[NH2+]1)[NH2+][C@H]1CCC[C@H]1C1CC1 ZINC000414898993 386239154 /nfs/dbraw/zinc/23/91/54/386239154.db2.gz BPIFSDQZXGIONK-RDBSUJKOSA-N 2 0 222.376 2.297 20 0 BEADRP [NH3+]C[C@H]1CC[N@H+](C/C=C/c2ccc(F)cc2)C1 ZINC000347084561 386242544 /nfs/dbraw/zinc/24/25/44/386242544.db2.gz AQRHTURSQQOLON-ZIYVKSGCSA-N 2 0 234.318 2.120 20 0 BEADRP COc1c(C)cc(C[N@@H+]2CC[C@@H](C[NH3+])C2)cc1C ZINC000347096019 386248191 /nfs/dbraw/zinc/24/81/91/386248191.db2.gz ITAJNOKAPPUJFS-ZDUSSCGKSA-N 2 0 248.370 2.093 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H](C[NH2+]Cc2ccccc2F)C1 ZINC000415003290 386253231 /nfs/dbraw/zinc/25/32/31/386253231.db2.gz WXFKFAPSJSHFBJ-DGCLKSJQSA-N 2 0 236.334 2.433 20 0 BEADRP CC[C@H]1CCC[N@@H+]1CC[C@H]1CCC[NH+]1C ZINC000336645801 386254860 /nfs/dbraw/zinc/25/48/60/386254860.db2.gz IYLMZJBEEUMYET-QWHCGFSZSA-N 2 0 210.365 2.345 20 0 BEADRP CCC[N@H+](CCC[NH3+])[C@H]1C[C@H](OCC)C1(C)C ZINC000414693093 386193575 /nfs/dbraw/zinc/19/35/75/386193575.db2.gz DLNHAMLHEMFOJN-STQMWFEESA-N 2 0 242.407 2.251 20 0 BEADRP CC(C)[C@@H]1CCC[C@H]1[NH2+]C[C@H]([NH3+])C1CC1 ZINC000414895682 386193893 /nfs/dbraw/zinc/19/38/93/386193893.db2.gz YORFMDNICIFGOB-RWMBFGLXSA-N 2 0 210.365 2.138 20 0 BEADRP CCCCO[C@H]1C[C@@H]([N@H+](C)CCC[NH3+])C1(C)C ZINC000414696039 386197240 /nfs/dbraw/zinc/19/72/40/386197240.db2.gz AULASGGQKUCTAW-OLZOCXBDSA-N 2 0 242.407 2.251 20 0 BEADRP CC[N@H+](C[C@@H]1CC[NH2+]C1)[C@@H](C)c1cccc(O)c1 ZINC000647880367 386197573 /nfs/dbraw/zinc/19/75/73/386197573.db2.gz NSWXFNYNFLZJHY-QWHCGFSZSA-N 2 0 248.370 2.385 20 0 BEADRP C[C@]1(C[NH3+])CC[N@H+](C[C@@H]2C[C@H]2c2ccccc2)C1 ZINC000414730037 386282089 /nfs/dbraw/zinc/28/20/89/386282089.db2.gz GIFQTBMEDFWVBL-HRCADAONSA-N 2 0 244.382 2.461 20 0 BEADRP Cc1ccc(C[C@H](C)[N@H+](C)C[C@@H]2CC[NH2+]C2)cc1 ZINC000647886090 386293579 /nfs/dbraw/zinc/29/35/79/386293579.db2.gz PZSZCUFLZUATQV-GOEBONIOSA-N 2 0 246.398 2.467 20 0 BEADRP C[C@@H](CC[NH3+])[NH2+]Cc1cc(F)cc(Cl)c1 ZINC000414901058 386295444 /nfs/dbraw/zinc/29/54/44/386295444.db2.gz WSLANXNIEFONJX-QMMMGPOBSA-N 2 0 230.714 2.306 20 0 BEADRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]CC1(C2CC2)CCC1 ZINC000391466633 386324906 /nfs/dbraw/zinc/32/49/06/386324906.db2.gz QJAWKAMHTIVXGP-YPMHNXCESA-N 2 0 222.376 2.284 20 0 BEADRP CCc1cc(OC)ccc1C[NH2+][C@@H](C)CC[NH3+] ZINC000414901542 386307115 /nfs/dbraw/zinc/30/71/15/386307115.db2.gz XFBPVNUIMIWRIW-NSHDSACASA-N 2 0 236.359 2.085 20 0 BEADRP C[N@H+](CC[C@@H]1CCCC[NH+]1C)CC1CC1 ZINC000336652059 386267233 /nfs/dbraw/zinc/26/72/33/386267233.db2.gz WFKANKVNJCPTMR-ZDUSSCGKSA-N 2 0 210.365 2.203 20 0 BEADRP Cc1ccncc1CCC[NH2+][C@@H](C)CC[NH+](C)C ZINC000289171993 386269402 /nfs/dbraw/zinc/26/94/02/386269402.db2.gz FHGYMRBJASSHDL-AWEZNQCLSA-N 2 0 249.402 2.252 20 0 BEADRP [NH3+]C1CC[NH+](CCCCC2CCOCC2)CC1 ZINC000310070350 386357859 /nfs/dbraw/zinc/35/78/59/386357859.db2.gz LOUKIOHEOWCENZ-UHFFFAOYSA-N 2 0 240.391 2.006 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CCCC1CCOCC1 ZINC000415007356 386358244 /nfs/dbraw/zinc/35/82/44/386358244.db2.gz BJPAFWGSWUIBHH-CYBMUJFWSA-N 2 0 242.407 2.300 20 0 BEADRP C[C@@H]([NH3+])[C@@H](C)[NH2+][C@H](C)CCCC(F)(F)F ZINC000415007336 386358876 /nfs/dbraw/zinc/35/88/76/386358876.db2.gz CPXGNJFFYVGKPG-IWSPIJDZSA-N 2 0 226.286 2.433 20 0 BEADRP CC(C)C[N@@H+]1CC2(C[C@H]1C)CC[NH2+]CC2 ZINC000335278950 386360642 /nfs/dbraw/zinc/36/06/42/386360642.db2.gz MVYUTFHMGCPUQH-GFCCVEGCSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@]1(c2ccccc2)CC[N@H+](C[C@@H]2CC[NH2+]C2)C1 ZINC000647890173 386367250 /nfs/dbraw/zinc/36/72/50/386367250.db2.gz WSOIPYCXMNFCPP-ZBFHGGJFSA-N 2 0 244.382 2.260 20 0 BEADRP CC(C)C[C@@H]1CCC[N@H+](C[C@@H]2CC[NH2+]C2)C1 ZINC000647890132 386368024 /nfs/dbraw/zinc/36/80/24/386368024.db2.gz TWIFOQDGLBBYHH-UONOGXRCSA-N 2 0 224.392 2.354 20 0 BEADRP COC(C)(C)CC[N@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000336695686 386373376 /nfs/dbraw/zinc/37/33/76/386373376.db2.gz OEJPZEDCLYUITP-ZDUSSCGKSA-N 2 0 242.407 2.075 20 0 BEADRP COC1CC([NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)C1 ZINC000347394339 386382218 /nfs/dbraw/zinc/38/22/18/386382218.db2.gz YDXUWTYNBUKKIS-BPCQOVAHSA-N 2 0 242.407 2.120 20 0 BEADRP CC(C)CC[N@@H+]1CC2(C[C@@H]1C)CC[NH2+]CC2 ZINC000335275913 386335089 /nfs/dbraw/zinc/33/50/89/386335089.db2.gz BCEJLUOANBYPCP-ZDUSSCGKSA-N 2 0 224.392 2.497 20 0 BEADRP COC[C@H](CC(C)C)[NH2+]CC1(C)CC[NH2+]CC1 ZINC000414911038 386448965 /nfs/dbraw/zinc/44/89/65/386448965.db2.gz TUPUZJXNBZLSPB-ZDUSSCGKSA-N 2 0 242.407 2.027 20 0 BEADRP C[NH+]1CCC(N[C@@H]2C[C@]2(F)c2ccccc2)CC1 ZINC000335279457 386391486 /nfs/dbraw/zinc/39/14/86/386391486.db2.gz HUXQOPPQLKRTTL-CABCVRRESA-N 2 0 248.345 2.308 20 0 BEADRP CC(C)[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@H]([NH3+])C2)CCO1 ZINC000414907741 386393500 /nfs/dbraw/zinc/39/35/00/386393500.db2.gz AVSPSVOQQYNIHL-FQUUOJAGSA-N 2 0 240.391 2.050 20 0 BEADRP COc1cc(C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)ccc1C ZINC000414908483 386398647 /nfs/dbraw/zinc/39/86/47/386398647.db2.gz BKXOZDUKMBFKHT-KGLIPLIRSA-N 2 0 248.370 2.363 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCCC[C@H]1C[NH3+])c1cccnc1 ZINC000160881192 386402518 /nfs/dbraw/zinc/40/25/18/386402518.db2.gz LKRGSACBTKPNEZ-SGMGOOAPSA-N 2 0 233.359 2.250 20 0 BEADRP Cc1ccc(C[NH2+]C[C@@]2(C)CCC[NH2+]C2)cc1 ZINC000414909978 386408811 /nfs/dbraw/zinc/40/88/11/386408811.db2.gz RXGCCTWIJUGYBX-HNNXBMFYSA-N 2 0 232.371 2.474 20 0 BEADRP CC(C)C[C@H]([NH3+])C[N@@H+]1CCCC12CCC2 ZINC000414762665 386423776 /nfs/dbraw/zinc/42/37/76/386423776.db2.gz WKDCILUERNWBHH-LBPRGKRZSA-N 2 0 210.365 2.378 20 0 BEADRP [NH3+]CCCC[NH2+]CCCCOc1ccccc1 ZINC000414910048 386428508 /nfs/dbraw/zinc/42/85/08/386428508.db2.gz ROMHPVWMLXDLCK-UHFFFAOYSA-N 2 0 236.359 2.174 20 0 BEADRP CC[C@@H]1C[C@@H](C)C[N@@H+]1CC[C@H]1CCC[NH2+]C1 ZINC000399163029 386428893 /nfs/dbraw/zinc/42/88/93/386428893.db2.gz LOLHRVQTVQATEM-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1C[C@@H](C[N@@H+]2CCCC[C@@H](C)C2)CC[NH2+]1 ZINC000414765496 386431442 /nfs/dbraw/zinc/43/14/42/386431442.db2.gz ZXXREUTUXGURLN-RDBSUJKOSA-N 2 0 224.392 2.497 20 0 BEADRP CC[NH+](CC)CCCCNc1ccnc(C)n1 ZINC000266442494 386436068 /nfs/dbraw/zinc/43/60/68/386436068.db2.gz WIUPXWLPWOFGNI-UHFFFAOYSA-N 2 0 236.363 2.319 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@H]1C[C@H](C)C[C@H](C)C1 ZINC000414787808 386528762 /nfs/dbraw/zinc/52/87/62/386528762.db2.gz CRIBUPPLDQJFPU-MROQNXINSA-N 2 0 212.381 2.384 20 0 BEADRP CC1(C[NH2+]Cc2ccccc2F)CC[NH2+]CC1 ZINC000414912701 386478307 /nfs/dbraw/zinc/47/83/07/386478307.db2.gz VQXMZHDDMWDPQC-UHFFFAOYSA-N 2 0 236.334 2.305 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]Cc1cc(O)cc(F)c1 ZINC000415011269 386482431 /nfs/dbraw/zinc/48/24/31/386482431.db2.gz HGAYNBYKMAJJFM-SNVBAGLBSA-N 2 0 240.322 2.138 20 0 BEADRP C[C@@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1cccnc1 ZINC000227496761 386486900 /nfs/dbraw/zinc/48/69/00/386486900.db2.gz JJTWXHANXPGDGG-CYBMUJFWSA-N 2 0 247.386 2.464 20 0 BEADRP C([NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)[C@@H]1CC12CC2 ZINC000417345929 386488314 /nfs/dbraw/zinc/48/83/14/386488314.db2.gz YMAJJKXIYJALCK-YNEHKIRRSA-N 2 0 220.360 2.003 20 0 BEADRP C[N@H+](C/C=C\c1ccc(F)cc1)C1CC([NH3+])C1 ZINC000414779453 386492550 /nfs/dbraw/zinc/49/25/50/386492550.db2.gz REVONVMBYBFKDV-IHWYPQMZSA-N 2 0 234.318 2.260 20 0 BEADRP C[C@@H]([NH3+])[C@@H](C)[NH2+][C@H](C)CCc1ccsc1 ZINC000415013196 386496673 /nfs/dbraw/zinc/49/66/73/386496673.db2.gz KNZHREREWXJIOY-GMTAPVOTSA-N 2 0 226.389 2.395 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)C1CCC1 ZINC000415016112 386500165 /nfs/dbraw/zinc/50/01/65/386500165.db2.gz ZOHAVOQQJYJMBJ-LEWSCRJBSA-N 2 0 222.376 2.153 20 0 BEADRP CC[C@@H](C)C[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000415015770 386500528 /nfs/dbraw/zinc/50/05/28/386500528.db2.gz ZIJHSGGQEIWLQU-KGYLQXTDSA-N 2 0 210.365 2.010 20 0 BEADRP CC[C@H](Cc1ccccc1)[NH2+][C@H](C)[C@@H](C)[NH3+] ZINC000415015849 386501055 /nfs/dbraw/zinc/50/10/55/386501055.db2.gz NHOQSMSVQDHLGD-YRGRVCCFSA-N 2 0 220.360 2.333 20 0 BEADRP CC[C@H](Cc1ccccc1)[NH2+][C@H](C)[C@H](C)[NH3+] ZINC000415015846 386501275 /nfs/dbraw/zinc/50/12/75/386501275.db2.gz NHOQSMSVQDHLGD-OUCADQQQSA-N 2 0 220.360 2.333 20 0 BEADRP COc1ccccc1/C=C/C[NH2+][C@@H](C)CCC[NH3+] ZINC000415016849 386503551 /nfs/dbraw/zinc/50/35/51/386503551.db2.gz DHHMPVWNVJOTOB-PPGNKHEKSA-N 2 0 248.370 2.425 20 0 BEADRP CCC[C@@H](C)C[N@@H+]1C[C@@H](C)[C@](C)(C[NH3+])C1 ZINC000415050431 386506438 /nfs/dbraw/zinc/50/64/38/386506438.db2.gz CLWROHRWPYCJSZ-JHJVBQTASA-N 2 0 212.381 2.339 20 0 BEADRP CCC[C@H](Cc1ccccc1)[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000415019931 386508477 /nfs/dbraw/zinc/50/84/77/386508477.db2.gz AJFDIMPRXVOPCL-WCVJEAGWSA-N 2 0 244.382 2.205 20 0 BEADRP CC(C)[C@H](C[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21)c1ccccc1 ZINC000415020398 386509023 /nfs/dbraw/zinc/50/90/23/386509023.db2.gz ATTYKMLYHJQJJJ-CAOSSQGBSA-N 2 0 244.382 2.234 20 0 BEADRP C[C@H](Cc1ccccc1F)[NH2+][C@@H](C)CCC[NH3+] ZINC000415020598 386512564 /nfs/dbraw/zinc/51/25/64/386512564.db2.gz JOSQRWCBOYTEJD-NWDGAFQWSA-N 2 0 238.350 2.474 20 0 BEADRP c1cn(CC[N@@H+]2CC[C@H](CC3CC3)C2)cn1 ZINC000339674265 386514700 /nfs/dbraw/zinc/51/47/00/386514700.db2.gz UJVBSKNSXPAEKB-CYBMUJFWSA-N 2 0 219.332 2.005 20 0 BEADRP CCCc1csc(C[NH2+][C@H](C)CCC[NH3+])n1 ZINC000415024785 386514570 /nfs/dbraw/zinc/51/45/70/386514570.db2.gz PNIUYRNICFJSPX-SNVBAGLBSA-N 2 0 241.404 2.313 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CC[C@@H](C[NH3+])C2)cc1F ZINC000415028139 386515962 /nfs/dbraw/zinc/51/59/62/386515962.db2.gz CGZCFQFTWIHHGM-DGCLKSJQSA-N 2 0 236.334 2.351 20 0 BEADRP CC(C)CCC[C@@H](C)[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000415031237 386518256 /nfs/dbraw/zinc/51/82/56/386518256.db2.gz GADSFSNIUIKBCY-NDBYEHHHSA-N 2 0 210.365 2.009 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@H](C)[C@H](C[NH3+])C2)cc1 ZINC000163470351 386523663 /nfs/dbraw/zinc/52/36/63/386523663.db2.gz HGWYNHIXNXPMCB-DZGCQCFKSA-N 2 0 232.371 2.412 20 0 BEADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+]Cc2cccc(F)c2)C1 ZINC000415036920 386523988 /nfs/dbraw/zinc/52/39/88/386523988.db2.gz LUABHZOQQRXEGP-ZWNOBZJWSA-N 2 0 222.307 2.043 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CC[C@H](C[NH3+])C2)s1 ZINC000415036882 386524023 /nfs/dbraw/zinc/52/40/23/386524023.db2.gz LSWIXHMMCRQWET-QWRGUYRKSA-N 2 0 224.373 2.274 20 0 BEADRP CC(C)C[C@H](C)C[NH2+][C@@H]1CC[C@H](C[NH3+])C1 ZINC000415036005 386524090 /nfs/dbraw/zinc/52/40/90/386524090.db2.gz KZKVUWOTLONRNY-RWMBFGLXSA-N 2 0 212.381 2.386 20 0 BEADRP C[C@@H](C[C@@H]1CCC[NH2+]1)Nc1ccc(C[NH3+])cc1 ZINC000414916347 386524610 /nfs/dbraw/zinc/52/46/10/386524610.db2.gz SKKFCNYESAQTDL-FZMZJTMJSA-N 2 0 233.359 2.088 20 0 BEADRP [NH3+]C[C@H]1CC[C@H]([NH2+]Cc2c(F)cccc2F)C1 ZINC000415037384 386525106 /nfs/dbraw/zinc/52/51/06/386525106.db2.gz MGPYEKUCTOZQAY-UWVGGRQHSA-N 2 0 240.297 2.182 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+]C[C@H](C)CC1CCOCC1 ZINC000414786438 386527064 /nfs/dbraw/zinc/52/70/64/386527064.db2.gz BEDBGPNPNGLEKC-TZMCWYRMSA-N 2 0 242.407 2.012 20 0 BEADRP COCc1cccc(C[N@@H+]2CC[C@H]([NH3+])[C@H](C)C2)c1 ZINC000094338929 386457551 /nfs/dbraw/zinc/45/75/51/386457551.db2.gz ZQNBPLZTTNPUAA-DOMZBBRYSA-N 2 0 248.370 2.002 20 0 BEADRP CCSCC[NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1 ZINC000336781310 386584881 /nfs/dbraw/zinc/58/48/81/386584881.db2.gz UINJDPPNPLQGJF-CYBMUJFWSA-N 2 0 244.448 2.450 20 0 BEADRP Cc1[nH+]ccc(N[C@H](C)CC[NH+](C)C)c1Cl ZINC000336644145 386586199 /nfs/dbraw/zinc/58/61/99/386586199.db2.gz BVNQIJRXBALCGH-SECBINFHSA-N 2 0 241.766 2.217 20 0 BEADRP CC(C)([NH3+])C[NH2+]C[C@@H]1CCCO[C@@H]1C(C)(C)C ZINC000415084744 386598660 /nfs/dbraw/zinc/59/86/60/386598660.db2.gz PNCBBBHKEVRXED-RYUDHWBXSA-N 2 0 242.407 2.155 20 0 BEADRP C[C@@H]([NH2+]CCC[NH3+])C(C)(C)c1ccccc1 ZINC000415080392 386594090 /nfs/dbraw/zinc/59/40/90/386594090.db2.gz JEOGPDCQRJJAFO-GFCCVEGCSA-N 2 0 220.360 2.291 20 0 BEADRP CCC([NH3+])(CC)C[NH2+][C@@H]1CCO[C@H](C(C)C)C1 ZINC000414802534 386595700 /nfs/dbraw/zinc/59/57/00/386595700.db2.gz BVUFOQMXCDCQJP-OLZOCXBDSA-N 2 0 242.407 2.297 20 0 BEADRP CC(C)C[C@H](C)C[C@H](C)[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000415046545 386532591 /nfs/dbraw/zinc/53/25/91/386532591.db2.gz XLPXBTNZQBOPPA-QSLWVIQJSA-N 2 0 224.392 2.255 20 0 BEADRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]Cc1cc(F)cc(F)c1 ZINC000414788615 386534220 /nfs/dbraw/zinc/53/42/20/386534220.db2.gz DQLQMMNEIBDXQD-ZWNOBZJWSA-N 2 0 240.297 2.182 20 0 BEADRP c1ccc2c(c1)CCC[N@@H+](C[C@H]1CCC[NH2+]C1)C2 ZINC000062944686 386534470 /nfs/dbraw/zinc/53/44/70/386534470.db2.gz FMCXFELUBFBZQN-AWEZNQCLSA-N 2 0 244.382 2.434 20 0 BEADRP c1ccc2c(c1)CCC[N@@H+](C[C@@H]1CCC[NH2+]C1)C2 ZINC000062944685 386534822 /nfs/dbraw/zinc/53/48/22/386534822.db2.gz FMCXFELUBFBZQN-CQSZACIVSA-N 2 0 244.382 2.434 20 0 BEADRP CC(C)(C)[C@H](C[NH3+])NCc1ccc(F)cc1F ZINC000415058153 386540962 /nfs/dbraw/zinc/54/09/62/386540962.db2.gz SSMYJGPKXGHYIR-LBPRGKRZSA-N 2 0 242.313 2.428 20 0 BEADRP CCc1ncc(CN[C@H](C[NH3+])C(C)(C)C)s1 ZINC000415059880 386542331 /nfs/dbraw/zinc/54/23/31/386542331.db2.gz ZUQKPNDTYBMJLV-SNVBAGLBSA-N 2 0 241.404 2.169 20 0 BEADRP CCc1ccccc1[C@H](N)C[NH2+]C(C)C ZINC000415061361 386542376 /nfs/dbraw/zinc/54/23/76/386542376.db2.gz CNDDRMHFDBWSNH-CYBMUJFWSA-N 2 0 206.333 2.247 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CC2C[NH2+]C2)c2sccc21 ZINC000335463602 386548244 /nfs/dbraw/zinc/54/82/44/386548244.db2.gz YSOLHXNEMFQVFA-BXKDBHETSA-N 2 0 236.384 2.496 20 0 BEADRP CC1(C)CC[C@H]([NH2+][C@H]2CCCC[NH2+]C2)C1 ZINC000415066488 386548621 /nfs/dbraw/zinc/54/86/21/386548621.db2.gz IWRHKTRGNOUUGB-RYUDHWBXSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H](CCC1CC1)[NH2+][C@H]1CCCC[NH2+]C1 ZINC000415070314 386551200 /nfs/dbraw/zinc/55/12/00/386551200.db2.gz IFEDAHNWTXPLKG-AAEUAGOBSA-N 2 0 210.365 2.297 20 0 BEADRP CCC[N@@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000647974963 386556489 /nfs/dbraw/zinc/55/64/89/386556489.db2.gz DQEKWVANEYFEFO-OLZOCXBDSA-N 2 0 210.365 2.108 20 0 BEADRP c1ccc2c(c1)CC[C@H]([NH2+][C@H]1CCCC[NH2+]C1)C2 ZINC000415075690 386568124 /nfs/dbraw/zinc/56/81/24/386568124.db2.gz RDOCLETWJVADEG-HOTGVXAUSA-N 2 0 244.382 2.276 20 0 BEADRP C(C1CCC1)[N@@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC000647976490 386571995 /nfs/dbraw/zinc/57/19/95/386571995.db2.gz PMUQGZKWINISHH-GJZGRUSLSA-N 2 0 236.403 2.498 20 0 BEADRP CN(CC[NH3+])CCCCCOc1ccccc1 ZINC000415102995 386623091 /nfs/dbraw/zinc/62/30/91/386623091.db2.gz FGTFQUVGOKVRDG-UHFFFAOYSA-N 2 0 236.359 2.126 20 0 BEADRP [NH3+]C1CCC([NH2+][C@H]2CC[C@@H]2C2CC2)CC1 ZINC000335498785 386625587 /nfs/dbraw/zinc/62/55/87/386625587.db2.gz VSXXVXZKONRONQ-TUUUFIMRSA-N 2 0 208.349 2.035 20 0 BEADRP Cc1ccc(NCC(C)(C)[NH3+])c(C[NH+](C)C)c1 ZINC000415122197 386625945 /nfs/dbraw/zinc/62/59/45/386625945.db2.gz NRMIFICTIQYRNV-UHFFFAOYSA-N 2 0 235.375 2.206 20 0 BEADRP CC[C@H]1C[C@H](C[NH2+]CC([NH3+])(CC)CC)CCO1 ZINC000414810157 386626828 /nfs/dbraw/zinc/62/68/28/386626828.db2.gz NRHSOHIGSHUFNC-OLZOCXBDSA-N 2 0 242.407 2.299 20 0 BEADRP Cc1ccccc1C1(C[NH2+]C2CC[NH2+]CC2)CC1 ZINC000415122131 386628370 /nfs/dbraw/zinc/62/83/70/386628370.db2.gz ZVHZAPMSUPEKEX-UHFFFAOYSA-N 2 0 244.382 2.368 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@@H]([NH3+])[C@H](C)C2)cc1 ZINC000049708877 386639102 /nfs/dbraw/zinc/63/91/02/386639102.db2.gz PYOLQBREACEXHT-TZMCWYRMSA-N 2 0 218.344 2.164 20 0 BEADRP [NH3+]C[C@@H](NCc1ccc(Cl)s1)C1CC1 ZINC000414812177 386640438 /nfs/dbraw/zinc/64/04/38/386640438.db2.gz XAZFWFSDIXPIDJ-SECBINFHSA-N 2 0 230.764 2.228 20 0 BEADRP COCC(C)(C)C[NH2+]CCCC[N@H+](C)C1CC1 ZINC000453601031 386644200 /nfs/dbraw/zinc/64/42/00/386644200.db2.gz SUAYXBSUOZLLCT-UHFFFAOYSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCC12CCC2)C[NH+](C)C ZINC000336758914 386644660 /nfs/dbraw/zinc/64/46/60/386644660.db2.gz KXQGXZKTUSBWMS-NEPJUHHUSA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)C[C@@H](C)C[N@H+]1C[C@H]2C[NH+](C)C[C@H]2C1 ZINC000337200792 386647440 /nfs/dbraw/zinc/64/74/40/386647440.db2.gz FHROTHHTNXIBRX-MCIONIFRSA-N 2 0 224.392 2.162 20 0 BEADRP CCC([NH3+])(CC)C[NH2+]C1Cc2ccccc2C1 ZINC000414816305 386653466 /nfs/dbraw/zinc/65/34/66/386653466.db2.gz ZWMFCCNTXUWOON-UHFFFAOYSA-N 2 0 232.371 2.261 20 0 BEADRP C[C@H]([NH3+])c1ccc(NCC2CC[NH2+]CC2)cc1 ZINC000414816114 386653981 /nfs/dbraw/zinc/65/39/81/386653981.db2.gz WDHHOCBXWJENAR-NSHDSACASA-N 2 0 233.359 2.118 20 0 BEADRP C([NH2+][C@H]1CCC12CCCC2)[C@@H]1CCC[NH2+]C1 ZINC000335519371 386656530 /nfs/dbraw/zinc/65/65/30/386656530.db2.gz ORFCYKRNHMUYAR-OLZOCXBDSA-N 2 0 222.376 2.298 20 0 BEADRP C[C@@H]([NH3+])c1ccc(C[NH2+]C[C@H]2CCCOC2)cc1 ZINC000414803452 386599285 /nfs/dbraw/zinc/59/92/85/386599285.db2.gz CSUBUUSIFCOKAA-TZMCWYRMSA-N 2 0 248.370 2.223 20 0 BEADRP CC(C)([NH3+])C[NH2+]C[C@H]1CCCO[C@H]1C(C)(C)C ZINC000415084745 386600123 /nfs/dbraw/zinc/60/01/23/386600123.db2.gz PNCBBBHKEVRXED-VXGBXAGGSA-N 2 0 242.407 2.155 20 0 BEADRP C[C@H]([NH3+])c1ccc(C[NH2+]C[C@H]2CCCOC2)cc1 ZINC000414803449 386600258 /nfs/dbraw/zinc/60/02/58/386600258.db2.gz CSUBUUSIFCOKAA-GXTWGEPZSA-N 2 0 248.370 2.223 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H](C)[C@@H]2CC[NH2+]C2)c(C)c1 ZINC000415085431 386601180 /nfs/dbraw/zinc/60/11/80/386601180.db2.gz IEQUUNLPLJOHHA-GOEBONIOSA-N 2 0 246.398 2.434 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CNCC[C@@H]1C)Cc1ccccc1 ZINC000414922967 386602035 /nfs/dbraw/zinc/60/20/35/386602035.db2.gz GPHDQXSXADLLOA-OFQRWUPVSA-N 2 0 246.398 2.453 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H](C)[C@H]2CC[NH2+]C2)c(C)c1 ZINC000415085434 386602344 /nfs/dbraw/zinc/60/23/44/386602344.db2.gz IEQUUNLPLJOHHA-HOCLYGCPSA-N 2 0 246.398 2.434 20 0 BEADRP CC(C)C[C@H]([NH3+])C[NH2+]CCc1ccccc1F ZINC000415086642 386604413 /nfs/dbraw/zinc/60/44/13/386604413.db2.gz JVVHPSPVAQORJL-ZDUSSCGKSA-N 2 0 238.350 2.331 20 0 BEADRP Cc1ccccc1OCCC[NH2+]C1CC[NH2+]CC1 ZINC000415086915 386605391 /nfs/dbraw/zinc/60/53/91/386605391.db2.gz VINFEUNEZRHAHU-UHFFFAOYSA-N 2 0 248.370 2.106 20 0 BEADRP COc1cc(C[NH2+][C@H]2CCC[C@H]2C[NH3+])ccc1C ZINC000414803867 386607087 /nfs/dbraw/zinc/60/70/87/386607087.db2.gz OIXCADCGJDIFTO-KBPBESRZSA-N 2 0 248.370 2.221 20 0 BEADRP C[C@@H]1C[C@H](C[NH2+]Cc2cccc(F)c2)CC[NH2+]1 ZINC000415091321 386610849 /nfs/dbraw/zinc/61/08/49/386610849.db2.gz YWXHFZTYHGLMFW-DGCLKSJQSA-N 2 0 236.334 2.303 20 0 BEADRP C[C@H](C[NH2+]CC(C)(C)[NH3+])c1ccc(F)cc1F ZINC000415098547 386616579 /nfs/dbraw/zinc/61/65/79/386616579.db2.gz FOEWWTANPCMUDD-SECBINFHSA-N 2 0 242.313 2.395 20 0 BEADRP CN(CC[NH3+])Cc1cccc(OC2CCCC2)c1 ZINC000415107252 386617209 /nfs/dbraw/zinc/61/72/09/386617209.db2.gz KXJKGZJIOVXYRT-UHFFFAOYSA-N 2 0 248.370 2.399 20 0 BEADRP NC[C@H]([NH2+][C@H]1CCC[C@@H](C2CC2)C1)C1CC1 ZINC000414807427 386617590 /nfs/dbraw/zinc/61/75/90/386617590.db2.gz QYXBSALLLMEMSR-RDBSUJKOSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@H](C[NH2+][C@@H](CN)C1CC1)c1ccc(F)cc1 ZINC000414807480 386618988 /nfs/dbraw/zinc/61/89/88/386618988.db2.gz OCGFIJJNBZSFDH-YGRLFVJLSA-N 2 0 236.334 2.256 20 0 BEADRP CC1(C)CCC[C@H]1[NH2+]CC1=CC[NH2+]CC1 ZINC000335520273 386660058 /nfs/dbraw/zinc/66/00/58/386660058.db2.gz QMSLPZIHRHTALV-GFCCVEGCSA-N 2 0 208.349 2.074 20 0 BEADRP CC(C)C[C@@H]([NH3+])CNCc1ccc([C@@H](C)[NH3+])cc1 ZINC000414819861 386662213 /nfs/dbraw/zinc/66/22/13/386662213.db2.gz ZVNZSQLAJLKVFP-IUODEOHRSA-N 2 0 249.402 2.169 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H](C)CCC(F)(F)F ZINC000414820215 386664133 /nfs/dbraw/zinc/66/41/33/386664133.db2.gz JEZHJHJEGZGSKG-YUMQZZPRSA-N 2 0 212.259 2.044 20 0 BEADRP Cc1ccccc1C[C@@H](C)[NH2+]CC[C@H](C)[NH3+] ZINC000414820165 386664430 /nfs/dbraw/zinc/66/44/30/386664430.db2.gz IWRYBEYWNNADIK-QWHCGFSZSA-N 2 0 220.360 2.253 20 0 BEADRP C[C@H]([NH3+])CC[NH2+]C1CCC2(CCOCC2)CC1 ZINC000414820189 386665921 /nfs/dbraw/zinc/66/59/21/386665921.db2.gz JBLYACMVLLXHJF-LBPRGKRZSA-N 2 0 240.391 2.053 20 0 BEADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@H]2CCCOCC2)cc1 ZINC000414818946 386667762 /nfs/dbraw/zinc/66/77/62/386667762.db2.gz XGLSEKQTKGNRDO-DOMZBBRYSA-N 2 0 248.370 2.365 20 0 BEADRP CNCC[NH2+]C[C@H](C)CC1CCCCC1 ZINC000414822758 386669906 /nfs/dbraw/zinc/66/99/06/386669906.db2.gz GXMACWSEFJHIJO-GFCCVEGCSA-N 2 0 212.381 2.402 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CC[C@H]2CC[NH2+]C2)C[C@@H]1C ZINC000414824540 386682717 /nfs/dbraw/zinc/68/27/17/386682717.db2.gz AUVWIUYUHOVFCD-RQJABVFESA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H]([NH2+]CCC(C)(C)C)[C@H]1CCC[NH2+]C1 ZINC000414824028 386680632 /nfs/dbraw/zinc/68/06/32/386680632.db2.gz PWWKNZCHHMMNDI-RYUDHWBXSA-N 2 0 212.381 2.400 20 0 BEADRP [NH3+]CCOCC[N@H+](CC1CC1)C1CCCCC1 ZINC000357074756 386709141 /nfs/dbraw/zinc/70/91/41/386709141.db2.gz NIMYZPLKYINONJ-UHFFFAOYSA-N 2 0 240.391 2.006 20 0 BEADRP CCC1CCC([NH2+]C[C@H](C)C[NH2+]C)CC1 ZINC000414833026 386709967 /nfs/dbraw/zinc/70/99/67/386709967.db2.gz FXGASDLPJVJWMB-PNESKVBLSA-N 2 0 212.381 2.400 20 0 BEADRP CC[C@@H](Cc1ccccc1)[NH2+]CC[C@H](C)[NH3+] ZINC000414823410 386685392 /nfs/dbraw/zinc/68/53/92/386685392.db2.gz OMXAKGCGZQXINE-JSGCOSHPSA-N 2 0 220.360 2.335 20 0 BEADRP C[C@H]([NH2+]CCCC[NH+](C)C)[C@H]1CC1(C)C ZINC000336759774 386685921 /nfs/dbraw/zinc/68/59/21/386685921.db2.gz LQNICMAYYSIMDH-NWDGAFQWSA-N 2 0 212.381 2.352 20 0 BEADRP Clc1ccsc1C[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000414826184 386693553 /nfs/dbraw/zinc/69/35/53/386693553.db2.gz DZGTXGSBHNONGF-SECBINFHSA-N 2 0 244.791 2.491 20 0 BEADRP Cc1cccc(C)c1C[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000414826112 386693617 /nfs/dbraw/zinc/69/36/17/386693617.db2.gz INCDBCIHKDPNQW-CQSZACIVSA-N 2 0 232.371 2.393 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]CC[C@@H]2CC[NH2+]C2)C1 ZINC000414827899 386693676 /nfs/dbraw/zinc/69/36/76/386693676.db2.gz IBMAHNPPLUQSHK-AGIUHOORSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]CC[C@H]2CC[NH2+]C2)[C@@H]1C ZINC000414827516 386694429 /nfs/dbraw/zinc/69/44/29/386694429.db2.gz HDXQXKYXDSLMEA-SYQHCUMBSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H](C[NH2+][C@@H](C)CCCC[NH3+])c1nccs1 ZINC000336648753 386699056 /nfs/dbraw/zinc/69/90/56/386699056.db2.gz GPXYATAARUKJPL-MNOVXSKESA-N 2 0 241.404 2.354 20 0 BEADRP CCCC[C@H](COC)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000414829121 386701630 /nfs/dbraw/zinc/70/16/30/386701630.db2.gz NDKLEEAIWZIFEB-RBKKPWLPSA-N 2 0 240.391 2.064 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CCC[C@@H]1C(C)C ZINC000414833686 386712273 /nfs/dbraw/zinc/71/22/73/386712273.db2.gz GQACPMYDYDOSFD-YNEHKIRRSA-N 2 0 212.381 2.256 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]Cc1cc(Cl)cs1 ZINC000414835937 386732632 /nfs/dbraw/zinc/73/26/32/386732632.db2.gz ITRIBJOWAKIMAT-QMMMGPOBSA-N 2 0 232.780 2.347 20 0 BEADRP C[C@@H]1CCCC[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000414838735 386738779 /nfs/dbraw/zinc/73/87/79/386738779.db2.gz XGOJVADCHMWIPU-SYCZCVCYSA-N 2 0 222.376 2.438 20 0 BEADRP Cc1nccn1CC[N@H+]1CC[C@@H](C)[C@@H](C)C1 ZINC000335485500 386714116 /nfs/dbraw/zinc/71/41/16/386714116.db2.gz FPFUPLRVDIMAPC-NEPJUHHUSA-N 2 0 221.348 2.169 20 0 BEADRP Cc1nccn1CC[N@H+]1CC[C@H](C)[C@H](C)C1 ZINC000335485503 386715355 /nfs/dbraw/zinc/71/53/55/386715355.db2.gz FPFUPLRVDIMAPC-NWDGAFQWSA-N 2 0 221.348 2.169 20 0 BEADRP C[C@H](C[NH2+]CC[C@@H]1CC[NH2+]C1)Cc1ccccc1 ZINC000414832254 386715768 /nfs/dbraw/zinc/71/57/68/386715768.db2.gz OGFPOXAUPOMCSF-GOEBONIOSA-N 2 0 246.398 2.454 20 0 BEADRP CC[C@H]([NH2+]CCCC[NH+](C)C)[C@H]1C[C@@H]1C ZINC000321084398 386720535 /nfs/dbraw/zinc/72/05/35/386720535.db2.gz MGYZQQPJGYRCMS-AVGNSLFASA-N 2 0 212.381 2.352 20 0 BEADRP Cc1cc(F)ccc1C[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000414834008 386721124 /nfs/dbraw/zinc/72/11/24/386721124.db2.gz SFEMWOOTLKNNCB-LBPRGKRZSA-N 2 0 236.334 2.223 20 0 BEADRP Cc1cc(C)cc(C[NH2+]CC[C@H]2CC[NH2+]C2)c1 ZINC000414834891 386724900 /nfs/dbraw/zinc/72/49/00/386724900.db2.gz RCWFFMCKFUDZTN-CQSZACIVSA-N 2 0 232.371 2.393 20 0 BEADRP c1ccc2c(c1)CC[C@@H]([NH2+]CC[C@@H]1CC[NH2+]C1)C2 ZINC000414834288 386725580 /nfs/dbraw/zinc/72/55/80/386725580.db2.gz QNQNCJCIINGDAM-XJKSGUPXSA-N 2 0 244.382 2.133 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H](C)CCC(F)(F)F ZINC000414839739 386744657 /nfs/dbraw/zinc/74/46/57/386744657.db2.gz MOWRJAMVIJLKOF-DTWKUNHWSA-N 2 0 226.286 2.163 20 0 BEADRP CCC(C)(C)C[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000414840205 386749181 /nfs/dbraw/zinc/74/91/81/386749181.db2.gz YENHDKOEIOKAJC-FOSCPWQOSA-N 2 0 210.365 2.295 20 0 BEADRP c1ccc([C@@H]2C[C@H]2C[NH2+]CC[C@@H]2CC[NH2+]C2)cc1 ZINC000414841641 386749622 /nfs/dbraw/zinc/74/96/22/386749622.db2.gz YKVYHUITHPCKKM-BPUTZDHNSA-N 2 0 244.382 2.379 20 0 BEADRP CC(C)[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CCC[NH2+]1 ZINC000414841289 386754643 /nfs/dbraw/zinc/75/46/43/386754643.db2.gz HOBFVCBRHQVGPR-AVGNSLFASA-N 2 0 210.365 2.153 20 0 BEADRP c1ccc([C@@H]2C[C@H]2C[NH2+]C[C@H]2CCC[NH2+]2)cc1 ZINC000414841329 386754795 /nfs/dbraw/zinc/75/47/95/386754795.db2.gz HURDCLIMVVYCSP-ZNMIVQPWSA-N 2 0 230.355 2.132 20 0 BEADRP C[C@H]1CC[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000414841252 386755227 /nfs/dbraw/zinc/75/52/27/386755227.db2.gz ZBUQDSDYOROJFI-MSXOGSJSSA-N 2 0 208.349 2.048 20 0 BEADRP C[C@@H](NCC[C@H]1CCCC[N@@H+]1C)c1ccon1 ZINC000349204819 386790951 /nfs/dbraw/zinc/79/09/51/386790951.db2.gz VIRKRWRILIKOPB-VXGBXAGGSA-N 2 0 237.347 2.200 20 0 BEADRP C[N@H+](CC1CCCCC1)CC(C)(C)C[NH3+] ZINC000051283811 386780115 /nfs/dbraw/zinc/78/01/15/386780115.db2.gz WXWHWLZXSBIMMR-UHFFFAOYSA-N 2 0 212.381 2.483 20 0 BEADRP CC[C@H](C[NH2+][C@@H](C)C[C@@H]1CCCCC[NH2+]1)OC ZINC000336669539 386801393 /nfs/dbraw/zinc/80/13/93/386801393.db2.gz AMPBCPHWPHYODT-MELADBBJSA-N 2 0 242.407 2.312 20 0 BEADRP CC[C@H](Cc1ccccc1)[NH2+]C[C@@H](C)C[NH2+]C ZINC000414847147 386832489 /nfs/dbraw/zinc/83/24/89/386832489.db2.gz VIMOMEFUEMFBAE-DZGCQCFKSA-N 2 0 234.387 2.453 20 0 BEADRP CO[C@@H](C)[C@H](C)[NH2+]CC(C)(C)C[NH+]1CCCC1 ZINC000357842143 386853993 /nfs/dbraw/zinc/85/39/93/386853993.db2.gz ATSPRGWKKWSTLZ-STQMWFEESA-N 2 0 242.407 2.121 20 0 BEADRP CC[C@H](C[NH2+][C@H]1C[C@H]([NH3+])c2ccccc21)OC ZINC000336674149 386842323 /nfs/dbraw/zinc/84/23/23/386842323.db2.gz BVPHRXYUJSGEOA-SWHYSGLUSA-N 2 0 234.343 2.146 20 0 BEADRP [NH3+]CC1CCC([NH2+][C@H]2COc3ccccc32)CC1 ZINC000334844938 386891893 /nfs/dbraw/zinc/89/18/93/386891893.db2.gz WRDQUPVLWQBDQW-YIZWMMSDSA-N 2 0 246.354 2.227 20 0 BEADRP CCN1CCCC[C@@H]1C[NH2+][C@H]1CC[C@@H]1SC ZINC000425343413 386856583 /nfs/dbraw/zinc/85/65/83/386856583.db2.gz IFXNJAQUKNRXJE-AGIUHOORSA-N 2 0 242.432 2.344 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCC2(C)C)CC[NH2+]1 ZINC000414939929 386875442 /nfs/dbraw/zinc/87/54/42/386875442.db2.gz BKUGRDWJBHIVLM-GRYCIOLGSA-N 2 0 210.365 2.295 20 0 BEADRP CC1([NH2+]Cc2cccc(F)c2)CC[NH2+]CC1 ZINC000334840959 386884890 /nfs/dbraw/zinc/88/48/90/386884890.db2.gz DSSSZUGWHQQXTK-UHFFFAOYSA-N 2 0 222.307 2.057 20 0 BEADRP C[C@H]1[C@@H]([NH3+])CCN1C/C=C/c1ccc(F)cc1 ZINC000334842100 386885603 /nfs/dbraw/zinc/88/56/03/386885603.db2.gz KOLKPEMBDBLWHA-OAWOSGDHSA-N 2 0 234.318 2.260 20 0 BEADRP Cc1ccsc1C[NH2+]C1(C)CC[NH2+]CC1 ZINC000334841311 386885798 /nfs/dbraw/zinc/88/57/98/386885798.db2.gz GTCXZMPIBCPQME-UHFFFAOYSA-N 2 0 224.373 2.288 20 0 BEADRP Fc1cccc2c1CC[C@@H]2[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000334862417 386917551 /nfs/dbraw/zinc/91/75/51/386917551.db2.gz LIIKPFAYKZAHGM-NHYWBVRUSA-N 2 0 248.345 2.402 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@H]2CCC(C)(C)C2)CC[NH2+]1 ZINC000414941967 386897755 /nfs/dbraw/zinc/89/77/55/386897755.db2.gz DCTDMQHBUYGENN-WOPDTQHZSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC[NH2+]C[C@@H]1C)Cc1ccccc1 ZINC000414943915 386900964 /nfs/dbraw/zinc/90/09/64/386900964.db2.gz OOBAHWILXJOVSE-DZKIICNBSA-N 2 0 246.398 2.453 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[NH2+]C[C@H]1C)Cc1ccccc1 ZINC000414943920 386901141 /nfs/dbraw/zinc/90/11/41/386901141.db2.gz OOBAHWILXJOVSE-SQWLQELKSA-N 2 0 246.398 2.453 20 0 BEADRP Cc1cc(C[NH2+][C@H]2CC[NH2+]C[C@@H]2C)ccc1F ZINC000334852828 386901859 /nfs/dbraw/zinc/90/18/59/386901859.db2.gz ATJRQRFDJNQIMX-FZMZJTMJSA-N 2 0 236.334 2.222 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H]2CCc3ccccc3C2)CCC1 ZINC000334856140 386908419 /nfs/dbraw/zinc/90/84/19/386908419.db2.gz GHHKDFHYYBZQKT-CQSZACIVSA-N 2 0 230.355 2.015 20 0 BEADRP Cc1cc(C)cc(C[NH2+][C@@H]2CC[NH2+]C[C@@H]2C)c1 ZINC000334858372 386910513 /nfs/dbraw/zinc/91/05/13/386910513.db2.gz SDBFCFCLHZKOOS-DZGCQCFKSA-N 2 0 232.371 2.391 20 0 BEADRP Cc1cc(C)cc(C[NH2+][C@@H]2CC[NH2+]C[C@H]2C)c1 ZINC000334858376 386911753 /nfs/dbraw/zinc/91/17/53/386911753.db2.gz SDBFCFCLHZKOOS-UKRRQHHQSA-N 2 0 232.371 2.391 20 0 BEADRP Cc1ccc(C)c(C[NH2+][C@H]2CC[NH2+]C[C@@H]2C)c1 ZINC000334859377 386913115 /nfs/dbraw/zinc/91/31/15/386913115.db2.gz YSEFFPUZBZLVNS-ZFWWWQNUSA-N 2 0 232.371 2.391 20 0 BEADRP C[C@]1(C[NH2+][C@H]2CCc3ccccc32)CC[NH2+]C1 ZINC000334865165 386921990 /nfs/dbraw/zinc/92/19/90/386921990.db2.gz RALDCXZVLJRHPB-GJZGRUSLSA-N 2 0 230.355 2.263 20 0 BEADRP C[C@H]1Cc2ccccc2[C@H]1[NH2+]C1CC[NH2+]CC1 ZINC000334866411 386923324 /nfs/dbraw/zinc/92/33/24/386923324.db2.gz QDNRLGBWNBHYDY-NHYWBVRUSA-N 2 0 230.355 2.262 20 0 BEADRP CS[C@H]1CC[C@@H]1[NH2+]CCC[NH+]1CCCCC1 ZINC000425363012 386970264 /nfs/dbraw/zinc/97/02/64/386970264.db2.gz WFKKQDPTYQOXTJ-STQMWFEESA-N 2 0 242.432 2.346 20 0 BEADRP COc1ccccc1CCC[NH+]1CCC([NH3+])CC1 ZINC000011729489 386990834 /nfs/dbraw/zinc/99/08/34/386990834.db2.gz RPXVUPDBYJHAAH-UHFFFAOYSA-N 2 0 248.370 2.051 20 0 BEADRP CC/C=C/CC[N@@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC000368631205 386996458 /nfs/dbraw/zinc/99/64/58/386996458.db2.gz GTXSFJOHKOJEKF-NNTXTVRGSA-N 2 0 222.376 2.370 20 0 BEADRP Cc1c[nH+]ccc1N[C@@H](C)[C@H]1CCC[NH2+]C1 ZINC000070047575 387044375 /nfs/dbraw/zinc/04/43/75/387044375.db2.gz GCJQXGUWTITQJW-RYUDHWBXSA-N 2 0 219.332 2.190 20 0 BEADRP C[C@@H]1CCCC[N@H+](CC[C@H]2CC[NH2+]C2)C1 ZINC000334966023 387046782 /nfs/dbraw/zinc/04/67/82/387046782.db2.gz DNPNFIITOIVFAB-CHWSQXEVSA-N 2 0 210.365 2.108 20 0 BEADRP [NH3+][C@H]1CCC[C@H](C[NH2+]Cc2ccccc2)C1 ZINC000070503229 387066964 /nfs/dbraw/zinc/06/69/64/387066964.db2.gz AJQUQEQNKJSLHS-KBPBESRZSA-N 2 0 218.344 2.294 20 0 BEADRP C[C@@H]([NH3+])CN1Cc2ccccc2C(C)(C)C1 ZINC000334967720 387051547 /nfs/dbraw/zinc/05/15/47/387051547.db2.gz JLJBEWWXNNHTAT-LLVKDONJSA-N 2 0 218.344 2.127 20 0 BEADRP CCc1ccccc1C[N@@H+]1CC[C@@H]([C@@H](C)[NH3+])C1 ZINC000126876118 387055914 /nfs/dbraw/zinc/05/59/14/387055914.db2.gz BPGOMUXXMHZNTA-TZMCWYRMSA-N 2 0 232.371 2.418 20 0 BEADRP C(C1CCC1)[NH+]1CCC([C@@H]2CC[NH2+]C2)CC1 ZINC000334977194 387063658 /nfs/dbraw/zinc/06/36/58/387063658.db2.gz ANZQMCZACFIQJP-CQSZACIVSA-N 2 0 222.376 2.108 20 0 BEADRP CS[C@@H]1CC[C@@H]1[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC000425372832 387013753 /nfs/dbraw/zinc/01/37/53/387013753.db2.gz UFLLNTWOFWNUBK-FRRDWIJNSA-N 2 0 242.432 2.202 20 0 BEADRP CCN(CC[NH2+][C@H](C)[C@@H]1C[C@@H]1C)C1CC1 ZINC000322126017 387022955 /nfs/dbraw/zinc/02/29/55/387022955.db2.gz DDBKOEGKPPNTAL-DMDPSCGWSA-N 2 0 210.365 2.105 20 0 BEADRP Cc1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000334883294 387026838 /nfs/dbraw/zinc/02/68/38/387026838.db2.gz VRUBKCFLJBNJMU-YIONKMFJSA-N 2 0 230.355 2.368 20 0 BEADRP COCc1cccc(C[N@@H+]2C[C@H](C[NH3+])C[C@@H]2C)c1 ZINC000216074710 387028276 /nfs/dbraw/zinc/02/82/76/387028276.db2.gz VZZIDNWGCVDTRL-WFASDCNBSA-N 2 0 248.370 2.002 20 0 BEADRP C[C@H](C[NH+]1CCC2(CC[NH2+]2)CC1)C(C)(C)C ZINC000643427612 387029653 /nfs/dbraw/zinc/02/96/53/387029653.db2.gz OIEZLPRUHZWLHM-GFCCVEGCSA-N 2 0 224.392 2.497 20 0 BEADRP [NH3+]CC[C@H]1CCCC[N@@H+]1CCOc1ccccc1 ZINC000111380559 387077173 /nfs/dbraw/zinc/07/71/73/387077173.db2.gz CGQYQFVSXUHDCN-CQSZACIVSA-N 2 0 248.370 2.269 20 0 BEADRP C[C@@H]([NH3+])[C@@H]1CCC[N@H+](Cc2ccc(F)cc2)C1 ZINC000070977044 387085158 /nfs/dbraw/zinc/08/51/58/387085158.db2.gz YWFCVJBBGWFRJN-DGCLKSJQSA-N 2 0 236.334 2.385 20 0 BEADRP C[C@H]([NH3+])[C@H]1CCN(c2cc[nH+]c3ccccc32)C1 ZINC000162207299 387089421 /nfs/dbraw/zinc/08/94/21/387089421.db2.gz HHVHTRMAZJWUAE-RYUDHWBXSA-N 2 0 241.338 2.408 20 0 BEADRP CCc1cccc(C[N@@H+]2CC[C@@H]([NH3+])[C@H](C)C2)c1 ZINC000334997512 387090331 /nfs/dbraw/zinc/09/03/31/387090331.db2.gz DHWYBVVNHABFIP-IUODEOHRSA-N 2 0 232.371 2.418 20 0 BEADRP C[N@H+](CCCC[NH2+][C@@H]1COC(C)(C)C1)C1CC1 ZINC000418082449 387091498 /nfs/dbraw/zinc/09/14/98/387091498.db2.gz IYPSKZZDJILSCH-LBPRGKRZSA-N 2 0 240.391 2.018 20 0 BEADRP Cc1ccc(C[N@H+]2CCC[C@H]([C@@H](C)[NH3+])C2)c(C)n1 ZINC000334998959 387092858 /nfs/dbraw/zinc/09/28/58/387092858.db2.gz XFYXEXVXOMYSJJ-OCCSQVGLSA-N 2 0 247.386 2.258 20 0 BEADRP CC[C@](C)(C[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)OC ZINC000322514413 387093505 /nfs/dbraw/zinc/09/35/05/387093505.db2.gz JTUQVBUJCCDHNK-HZSPNIEDSA-N 2 0 240.391 2.018 20 0 BEADRP CC(C)(C)C1CC([NH2+][C@H]2CCC[C@@H]2[NH3+])C1 ZINC000335004776 387098804 /nfs/dbraw/zinc/09/88/04/387098804.db2.gz FPNMHTLLUQQXLE-QQFIATSDSA-N 2 0 210.365 2.281 20 0 BEADRP CSC(C)(C)C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000186386922 387099303 /nfs/dbraw/zinc/09/93/03/387099303.db2.gz WGYAOSJTGSFMAJ-YOGCLGLASA-N 2 0 242.432 2.343 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]C1CCC2(CC2)CC1 ZINC000335007137 387100482 /nfs/dbraw/zinc/10/04/82/387100482.db2.gz FOXSRJAFCZKDQA-WCQYABFASA-N 2 0 222.376 2.426 20 0 BEADRP CCCC[C@@H]1CCC[C@@H]1[NH2+]CC1C[NH2+]C1 ZINC000423301272 387131570 /nfs/dbraw/zinc/13/15/70/387131570.db2.gz HBIPVSNNTQHOGL-OLZOCXBDSA-N 2 0 210.365 2.154 20 0 BEADRP C1CC2(CCCC2)[C@@H]1[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000335011827 387106270 /nfs/dbraw/zinc/10/62/70/387106270.db2.gz VXMTVMDPVLDCJX-CHWSQXEVSA-N 2 0 222.376 2.441 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+]Cc1ccccc1 ZINC000335024912 387117010 /nfs/dbraw/zinc/11/70/10/387117010.db2.gz PMGFEVZELPQVIY-JSGCOSHPSA-N 2 0 218.344 2.164 20 0 BEADRP CC(C)CCOCC[N@@H+]1CCC[C@H](CC[NH3+])C1 ZINC000070074169 387119099 /nfs/dbraw/zinc/11/90/99/387119099.db2.gz DYFOLNYXZWMXKA-CQSZACIVSA-N 2 0 242.407 2.110 20 0 BEADRP Cc1cc(C[NH2+][C@H]2CC[NH2+]CC[C@@H]2C)cc(C)n1 ZINC000335029123 387122565 /nfs/dbraw/zinc/12/25/65/387122565.db2.gz NHVQBHUAMXAIHK-NHYWBVRUSA-N 2 0 247.386 2.176 20 0 BEADRP C[C@H]([NH2+][C@H]1CCCC(C)(C)C1)C1C[NH2+]C1 ZINC000335030499 387124170 /nfs/dbraw/zinc/12/41/70/387124170.db2.gz QCSYZEHNMGILLR-JQWIXIFHSA-N 2 0 210.365 2.153 20 0 BEADRP CC1(C[NH2+][C@@H]2CCCCC[C@H]2[NH3+])CCC1 ZINC000335031797 387126862 /nfs/dbraw/zinc/12/68/62/387126862.db2.gz IVCWHDVICFPXCC-VXGBXAGGSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@@]1(c2ccccc2)CC[C@H]([NH2+]CC2C[NH2+]C2)C1 ZINC000423299473 387128835 /nfs/dbraw/zinc/12/88/35/387128835.db2.gz BUOJRRNMNQMJIW-JKSUJKDBSA-N 2 0 244.382 2.306 20 0 BEADRP C[C@@]1(c2ccccc2)CC[C@@H]([NH2+]CC2C[NH2+]C2)C1 ZINC000423299472 387128943 /nfs/dbraw/zinc/12/89/43/387128943.db2.gz BUOJRRNMNQMJIW-HZPDHXFCSA-N 2 0 244.382 2.306 20 0 BEADRP COc1ccc2c(c1)[C@@H]([NH2+]C[C@@H](C)C[NH3+])CCC2 ZINC000423299663 387128977 /nfs/dbraw/zinc/12/89/77/387128977.db2.gz QJJIIBHNFMCLKT-NHYWBVRUSA-N 2 0 248.370 2.257 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H]1CCC[C@@H]1CCCF ZINC000423298522 387129303 /nfs/dbraw/zinc/12/93/03/387129303.db2.gz AJUMHPXKAGJQEG-UTUOFQBUSA-N 2 0 216.344 2.089 20 0 BEADRP COc1ccc([C@@H](C)[NH2+]C[C@H](C)C[NH3+])c(C)c1 ZINC000423298712 387129857 /nfs/dbraw/zinc/12/98/57/387129857.db2.gz ATSHHWMOLMLSOZ-ZYHUDNBSSA-N 2 0 236.359 2.249 20 0 BEADRP CCC[N@H+](CCC[NH+](C)C)CC1(C)CC1 ZINC000571688844 387141367 /nfs/dbraw/zinc/14/13/67/387141367.db2.gz OQXPCGOFHORPBJ-UHFFFAOYSA-N 2 0 212.381 2.450 20 0 BEADRP Cc1cc(C)c([C@@H](C)[NH2+]CC2C[NH2+]C2)cc1C ZINC000423307723 387143539 /nfs/dbraw/zinc/14/35/39/387143539.db2.gz WMCLKCNVSBNLKO-CYBMUJFWSA-N 2 0 232.371 2.482 20 0 BEADRP Cc1cc(C)cc([C@H](C)[NH2+]CC2C[NH2+]C2)c1 ZINC000423307334 387144352 /nfs/dbraw/zinc/14/43/52/387144352.db2.gz VRPZVEDNFQJJJK-LBPRGKRZSA-N 2 0 218.344 2.173 20 0 BEADRP CC(C)CC[C@H]1CC[C@H]([NH2+]CC2C[NH2+]C2)C1 ZINC000423310719 387148335 /nfs/dbraw/zinc/14/83/35/387148335.db2.gz AVTWDKSCEOZMIZ-JSGCOSHPSA-N 2 0 224.392 2.400 20 0 BEADRP COc1ccc([C@H](C)[NH2+]CC2=CC[NH2+]CC2)cc1 ZINC000423344368 387192625 /nfs/dbraw/zinc/19/26/25/387192625.db2.gz MPUDGVRZGQSDTP-LBPRGKRZSA-N 2 0 246.354 2.266 20 0 BEADRP CCC[C@H]([NH2+]C[C@H](C)C[NH3+])c1ccccn1 ZINC000423313267 387151916 /nfs/dbraw/zinc/15/19/16/387151916.db2.gz WTAIOVWJJJQNST-NEPJUHHUSA-N 2 0 221.348 2.107 20 0 BEADRP [NH3+][C@H](C[NH2+][C@H](Cc1ccccc1)C1CC1)C1CC1 ZINC000423315187 387155033 /nfs/dbraw/zinc/15/50/33/387155033.db2.gz IQPRHBCZNWNTJI-HZPDHXFCSA-N 2 0 244.382 2.335 20 0 BEADRP CCCCO[C@@H]1C[C@H]([NH2+]C[C@H](C)C[NH3+])C1(C)C ZINC000423316186 387156641 /nfs/dbraw/zinc/15/66/41/387156641.db2.gz ZQTJDWNOMFPSBO-FRRDWIJNSA-N 2 0 242.407 2.155 20 0 BEADRP C[C@H]([NH2+]CCCC[NH3+])c1ccc(Cl)cn1 ZINC000423317680 387158315 /nfs/dbraw/zinc/15/83/15/387158315.db2.gz CWTOSXDBPDZXLG-VIFPVBQESA-N 2 0 227.739 2.125 20 0 BEADRP CCC1(CC)[C@H]([NH2+]CC2([NH3+])CCC2)C[C@@H]1OC ZINC000423319993 387161377 /nfs/dbraw/zinc/16/13/77/387161377.db2.gz FYGGTZKPXHESDL-NEPJUHHUSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]Cc1cc(F)c(F)c(F)c1 ZINC000571762294 387163323 /nfs/dbraw/zinc/16/33/23/387163323.db2.gz GGMPURCQBQJZEU-HTQZYQBOSA-N 2 0 246.276 2.319 20 0 BEADRP C[C@@H]([NH2+]CC1(C)CC[NH2+]CC1)c1cccc(O)c1 ZINC000423323037 387164486 /nfs/dbraw/zinc/16/44/86/387164486.db2.gz HYFVQQAAVMGTHI-GFCCVEGCSA-N 2 0 248.370 2.433 20 0 BEADRP COc1ccsc1[C@H](C)[NH2+]CCCC[NH3+] ZINC000423322914 387164716 /nfs/dbraw/zinc/16/47/16/387164716.db2.gz JEYSIPDROYKPJS-VIFPVBQESA-N 2 0 228.361 2.146 20 0 BEADRP C[C@H]([NH2+]CCCC[NH3+])c1ccccc1N(C)C ZINC000423321830 387164906 /nfs/dbraw/zinc/16/49/06/387164906.db2.gz HQJXFPQAKWSXCB-LBPRGKRZSA-N 2 0 235.375 2.142 20 0 BEADRP CCCCO[C@@H]1C[C@@H]([NH2+]CCCC[NH3+])C1(C)C ZINC000423322881 387165817 /nfs/dbraw/zinc/16/58/17/387165817.db2.gz JANFVDVZVUAYFI-CHWSQXEVSA-N 2 0 242.407 2.299 20 0 BEADRP CC(C)[C@@H]1C[C@H]1C[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000571777086 387169802 /nfs/dbraw/zinc/16/98/02/387169802.db2.gz QWLDUUOZMLOCSK-CYDGBPFRSA-N 2 0 210.365 2.138 20 0 BEADRP CC(C)[C@@H]1C[C@H]1C[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000571777089 387170600 /nfs/dbraw/zinc/17/06/00/387170600.db2.gz QWLDUUOZMLOCSK-RVMXOQNASA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H]1CC[C@@H](C)[C@H]([NH2+]CC2([NH3+])CCC2)C1 ZINC000423330999 387174931 /nfs/dbraw/zinc/17/49/31/387174931.db2.gz OBIJCCNNJMRQFR-IJLUTSLNSA-N 2 0 210.365 2.282 20 0 BEADRP CCO[C@H]1C[C@@H]([NH2+]CCCC[NH3+])C1(CC)CC ZINC000423330645 387175799 /nfs/dbraw/zinc/17/57/99/387175799.db2.gz PMQVMENYYLJADC-OLZOCXBDSA-N 2 0 242.407 2.299 20 0 BEADRP CC(C)[C@H]1CCC[C@H]([NH2+]CC2C[NH2+]C2)C1 ZINC000423331685 387176247 /nfs/dbraw/zinc/17/62/47/387176247.db2.gz UTCBOHGYFCJUKI-STQMWFEESA-N 2 0 210.365 2.010 20 0 BEADRP CC(C)[C@H]([NH2+]CC1=CC[NH2+]CC1)c1cccnc1 ZINC000423331927 387177871 /nfs/dbraw/zinc/17/78/71/387177871.db2.gz DEKVTTXAPUAAJX-HNNXBMFYSA-N 2 0 245.370 2.288 20 0 BEADRP C[C@@H]([NH2+]CC1=CC[NH2+]CC1)c1cccs1 ZINC000423342369 387193778 /nfs/dbraw/zinc/19/37/78/387193778.db2.gz KVKZIJWLQMCVLP-SNVBAGLBSA-N 2 0 222.357 2.318 20 0 BEADRP C[C@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)C1(C)CC1 ZINC000423334784 387182059 /nfs/dbraw/zinc/18/20/59/387182059.db2.gz RFEFLVCQOOUMRW-NWDGAFQWSA-N 2 0 210.365 2.154 20 0 BEADRP Cc1cc([C@H](C)[NH2+]CCCC[NH3+])oc1C ZINC000423336807 387182847 /nfs/dbraw/zinc/18/28/47/387182847.db2.gz VDXVODKKSULABE-JTQLQIEISA-N 2 0 210.321 2.286 20 0 BEADRP CC(C)C[C@H]([NH2+]CCCC[NH3+])c1ccccn1 ZINC000423337463 387185535 /nfs/dbraw/zinc/18/55/35/387185535.db2.gz VPPRHSRGEXECCY-AWEZNQCLSA-N 2 0 235.375 2.497 20 0 BEADRP C[C@H]([NH2+]CC1(C)CC[NH2+]CC1)c1ccccn1 ZINC000423339411 387188286 /nfs/dbraw/zinc/18/82/86/387188286.db2.gz VABSMTUGRQCTHT-LBPRGKRZSA-N 2 0 233.359 2.122 20 0 BEADRP CC[C@H]1CCC[C@H]([NH2+]CC2=CC[NH2+]CC2)C1 ZINC000423340330 387190035 /nfs/dbraw/zinc/19/00/35/387190035.db2.gz JJXJVMVNJNHWMJ-JSGCOSHPSA-N 2 0 222.376 2.465 20 0 BEADRP CCc1ccc([C@@H](C)[NH2+]CC2=CC[NH2+]CC2)o1 ZINC000423340337 387190937 /nfs/dbraw/zinc/19/09/37/387190937.db2.gz JKGJKOMVOTYNJJ-LLVKDONJSA-N 2 0 234.343 2.412 20 0 BEADRP C[C@@H]([NH2+]CC1=CC[NH2+]CC1)C1CCCCC1 ZINC000423341108 387191169 /nfs/dbraw/zinc/19/11/69/387191169.db2.gz JXRNOWZJGKHLMQ-GFCCVEGCSA-N 2 0 222.376 2.465 20 0 BEADRP CCC[C@@H]([NH2+]C[C@@H](C)C[NH3+])C(C)(C)C ZINC000423302342 387134119 /nfs/dbraw/zinc/13/41/19/387134119.db2.gz HDYSKEBIIOAASR-WDEREUQCSA-N 2 0 200.370 2.386 20 0 BEADRP Cc1cc([C@@H](C)[NH2+]C[C@H](C)C[NH3+])oc1C ZINC000423302388 387134321 /nfs/dbraw/zinc/13/43/21/387134321.db2.gz HIAIRMNXBXMWHE-PSASIEDQSA-N 2 0 210.321 2.142 20 0 BEADRP C[C@@H]([C@H](C)[NH2+]CC1C[NH2+]C1)C1CCCCC1 ZINC000423303651 387136430 /nfs/dbraw/zinc/13/64/30/387136430.db2.gz MGFDPMHGXMHCSX-RYUDHWBXSA-N 2 0 224.392 2.400 20 0 BEADRP CCCC1CCC([NH2+]CC2C[NH2+]C2)CC1 ZINC000423303507 387137289 /nfs/dbraw/zinc/13/72/89/387137289.db2.gz LTVPJSFGDMWAPM-UHFFFAOYSA-N 2 0 210.365 2.154 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+]C[C@H](C)C[NH3+])[C@@H](C)C2 ZINC000423302988 387137707 /nfs/dbraw/zinc/13/77/07/387137707.db2.gz IGLUTSJYWZEFKX-TYNCELHUSA-N 2 0 232.371 2.413 20 0 BEADRP CC(C)CCOCC[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000119518437 387137668 /nfs/dbraw/zinc/13/76/68/387137668.db2.gz XZHWNNRZIWAMPW-UONOGXRCSA-N 2 0 242.407 2.121 20 0 BEADRP CCC[NH2+]CC[NH2+][C@@H]1C[C@H](C)CC[C@@H]1C ZINC000423305457 387138887 /nfs/dbraw/zinc/13/88/87/387138887.db2.gz BZYUVRFELLVELG-FRRDWIJNSA-N 2 0 212.381 2.400 20 0 BEADRP [NH3+][C@H](C[NH2+][C@@H]1CCCc2ccccc21)C1CC1 ZINC000423325035 387139366 /nfs/dbraw/zinc/13/93/66/387139366.db2.gz PTHKNWUFQSOXAO-HUUCEWRRSA-N 2 0 230.355 2.391 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@@H](C)C1C(C)(C)C1(C)C ZINC000423304789 387139663 /nfs/dbraw/zinc/13/96/63/387139663.db2.gz ZLWXVNYICVFHOO-UWVGGRQHSA-N 2 0 212.381 2.242 20 0 BEADRP [NH3+][C@@H](C[NH2+][C@H]1CCCc2ccccc21)C1CC1 ZINC000423325034 387140517 /nfs/dbraw/zinc/14/05/17/387140517.db2.gz PTHKNWUFQSOXAO-GJZGRUSLSA-N 2 0 230.355 2.391 20 0 BEADRP Cc1ccc(C[C@@H]([NH2+]CC2C[NH2+]C2)C(C)C)cc1 ZINC000423305516 387141191 /nfs/dbraw/zinc/14/11/91/387141191.db2.gz QXRWZRYFRWIOTB-MRXNPFEDSA-N 2 0 246.398 2.371 20 0 BEADRP CC(C)[C@H](Cc1ccccc1)[NH2+]C[C@@H]1CC[NH2+]C1 ZINC000423351688 387202765 /nfs/dbraw/zinc/20/27/65/387202765.db2.gz ZKHWXMDLZVOXQV-CVEARBPZSA-N 2 0 246.398 2.453 20 0 BEADRP C[C@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)c1cccnc1 ZINC000423351167 387203267 /nfs/dbraw/zinc/20/32/67/387203267.db2.gz YQHMLPQYSROWQJ-GXTWGEPZSA-N 2 0 233.359 2.122 20 0 BEADRP CC(C)CC[C@H](C)[NH2+]CC1=CC[NH2+]CC1 ZINC000423350408 387203425 /nfs/dbraw/zinc/20/34/25/387203425.db2.gz ZJFYLORQAPFZPF-LBPRGKRZSA-N 2 0 210.365 2.320 20 0 BEADRP FCCC[C@@H]1CCC[C@@H]1[NH2+]CC1=CC[NH2+]CC1 ZINC000423352885 387204723 /nfs/dbraw/zinc/20/47/23/387204723.db2.gz KYQMHFZWJCWOSC-KBPBESRZSA-N 2 0 240.366 2.414 20 0 BEADRP CC[C@H]([NH2+]CC[C@H]1CCC[NH2+]1)[C@@H]1C[C@H]1C ZINC000423354778 387205882 /nfs/dbraw/zinc/20/58/82/387205882.db2.gz GWYDWZXVTCLDJG-LPWJVIDDSA-N 2 0 210.365 2.153 20 0 BEADRP COC[C@@H]([NH2+][C@@H](C)CCCC[NH3+])C1CCCC1 ZINC000423425498 387252608 /nfs/dbraw/zinc/25/26/08/387252608.db2.gz GYVIOXURIMNTLY-GXTWGEPZSA-N 2 0 242.407 2.299 20 0 BEADRP C(C[C@H]1CCC[NH2+]1)[NH2+][C@@H]1CC[C@H]1C1CCC1 ZINC000423359038 387209943 /nfs/dbraw/zinc/20/99/43/387209943.db2.gz ORXZETKZCJRJTQ-HZSPNIEDSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@]12C[C@H]1CCC[C@H]2[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000423357896 387210255 /nfs/dbraw/zinc/21/02/55/387210255.db2.gz IWFCCJGOZKHZQK-SYQHCUMBSA-N 2 0 222.376 2.297 20 0 BEADRP CC[C@H]([NH2+][C@H]1CC[NH2+]C[C@@H]1C)c1ccncc1 ZINC000423364605 387216835 /nfs/dbraw/zinc/21/68/35/387216835.db2.gz CNTOHMZDXWYFOT-UBHSHLNASA-N 2 0 233.359 2.120 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)[C@H]1C[C@@H]1C ZINC000423368512 387220059 /nfs/dbraw/zinc/22/00/59/387220059.db2.gz BANWUWMLPXQWMB-QWQWKMKNSA-N 2 0 210.365 2.151 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)C1CCSCC1 ZINC000423371774 387222999 /nfs/dbraw/zinc/22/29/99/387222999.db2.gz FQWAEWGIWLHJSL-NTZNESFSSA-N 2 0 242.432 2.248 20 0 BEADRP C(C[C@H]1CCC[NH2+]1)[NH2+][C@@H]1CCC12CCC2 ZINC000423371796 387223406 /nfs/dbraw/zinc/22/34/06/387223406.db2.gz VEYOTFMLQCZUQC-VXGBXAGGSA-N 2 0 208.349 2.051 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CCc3ccccc32)CC[NH2+]1 ZINC000423373672 387229566 /nfs/dbraw/zinc/22/95/66/387229566.db2.gz JHXCZYYSHXFYTG-KYOSRNDESA-N 2 0 230.355 2.404 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@@H]1CCC[C@H]2C[C@]21C ZINC000423396408 387231003 /nfs/dbraw/zinc/23/10/03/387231003.db2.gz NUEZMCAEOHAWTJ-MBJXGIAVSA-N 2 0 222.376 2.153 20 0 BEADRP [NH3+]CCCC[NH2+][C@H]1CCC[C@H](c2cccnc2)C1 ZINC000423326820 387232918 /nfs/dbraw/zinc/23/29/18/387232918.db2.gz MIIFOYCXELMGIH-ZFWWWQNUSA-N 2 0 247.386 2.436 20 0 BEADRP COC[C@H]([NH2+][C@H]1CCC[C@H]([NH3+])C1)c1ccccc1 ZINC000423406145 387242985 /nfs/dbraw/zinc/24/29/85/387242985.db2.gz YQFCSKDJCYNZFY-KKUMJFAQSA-N 2 0 248.370 2.234 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]Cc1cccc2c1CCCN2 ZINC000423411951 387245396 /nfs/dbraw/zinc/24/53/96/387245396.db2.gz GQCSNESKORPBBM-RYUDHWBXSA-N 2 0 247.386 2.260 20 0 BEADRP COC[C@]1(C[NH2+][C@H](C)CC(C)(C)C)CCC[NH2+]1 ZINC000423413431 387245714 /nfs/dbraw/zinc/24/57/14/387245714.db2.gz KLIVBZCUPXNOFZ-TZMCWYRMSA-N 2 0 242.407 2.169 20 0 BEADRP C[C@H]([NH2+]CCN1CCCC1(C)C)[C@H]1CCCO1 ZINC000063074098 387247699 /nfs/dbraw/zinc/24/76/99/387247699.db2.gz AEORBYSNRBZWGE-QWHCGFSZSA-N 2 0 240.391 2.018 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H]2CC[C@H]2C2CC2)C1 ZINC000423374926 387253935 /nfs/dbraw/zinc/25/39/35/387253935.db2.gz UCTBTNVHIILGEC-MROQNXINSA-N 2 0 208.349 2.035 20 0 BEADRP CC[C@H]([NH2+]CC1(C)CC[NH2+]CC1)C1CC1 ZINC000423345334 387195797 /nfs/dbraw/zinc/19/57/97/387195797.db2.gz YTUZCNNRPJGFTB-LBPRGKRZSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CC2=CC[NH2+]CC2)C[C@H]1C ZINC000423348179 387196942 /nfs/dbraw/zinc/19/69/42/387196942.db2.gz SCDQYSDEWFJVJE-BZPMIXESSA-N 2 0 222.376 2.320 20 0 BEADRP C[C@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)[C@H]1CC1(C)C ZINC000423346760 387197903 /nfs/dbraw/zinc/19/79/03/387197903.db2.gz QCTGHGVOVXIATH-OUCADQQQSA-N 2 0 224.392 2.400 20 0 BEADRP C1=C(C[NH2+][C@@H]2CCC[C@@H]2C2CC2)CC[NH2+]C1 ZINC000423347158 387198463 /nfs/dbraw/zinc/19/84/63/387198463.db2.gz QEYLHSIVKHTCGH-ZIAGYGMSSA-N 2 0 220.360 2.074 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@@H](C)c1ccc2c(c1)COC2 ZINC000423463838 387312425 /nfs/dbraw/zinc/31/24/25/387312425.db2.gz VMHOLSIVZIKOAH-RYUDHWBXSA-N 2 0 248.370 2.495 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)CCC[NH3+])c1ccc2c(c1)COC2 ZINC000423463837 387312669 /nfs/dbraw/zinc/31/26/69/387312669.db2.gz VMHOLSIVZIKOAH-NWDGAFQWSA-N 2 0 248.370 2.495 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[C@@H]([NH3+])C1)c1ccco1 ZINC000423464310 387313112 /nfs/dbraw/zinc/31/31/12/387313112.db2.gz QTYWZPOWWQXNGX-SDDRHHMPSA-N 2 0 222.332 2.448 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@H]1CCC12CCC2 ZINC000423428123 387254403 /nfs/dbraw/zinc/25/44/03/387254403.db2.gz JCIWNQLZXCTJJF-RYUDHWBXSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]CCCC1CC1 ZINC000161717367 387260325 /nfs/dbraw/zinc/26/03/25/387260325.db2.gz JXOHPAMIXXVZAG-YRGRVCCFSA-N 2 0 224.392 2.495 20 0 BEADRP Cc1ccc2c(c1)[C@H](N[C@@H](C)C[NH3+])CCC2 ZINC000423379933 387263232 /nfs/dbraw/zinc/26/32/32/387263232.db2.gz YGGYOKCKILVYFZ-SMDDNHRTSA-N 2 0 218.344 2.309 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+]C1CCC(C(F)F)CC1 ZINC000423381559 387264469 /nfs/dbraw/zinc/26/44/69/387264469.db2.gz IBKQTTQJBQIPCW-KPPDAEKUSA-N 2 0 234.334 2.398 20 0 BEADRP CC(C)[C@H]([NH2+]CC1CC[NH2+]CC1)c1cccnc1 ZINC000643497665 387270300 /nfs/dbraw/zinc/27/03/00/387270300.db2.gz PKTLEDCYGZDLHZ-HNNXBMFYSA-N 2 0 247.386 2.368 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@@H](C1CC1)C1CCC1 ZINC000423386909 387271127 /nfs/dbraw/zinc/27/11/27/387271127.db2.gz LQBRMKRQCVRJTG-ZWNOBZJWSA-N 2 0 210.365 2.153 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]CCc1ccccc1)C2 ZINC000263589585 387273832 /nfs/dbraw/zinc/27/38/32/387273832.db2.gz NIFBNIANYCOETB-PHZGNYQRSA-N 2 0 244.382 2.444 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@H]1CCC12CCCC2 ZINC000423390418 387276596 /nfs/dbraw/zinc/27/65/96/387276596.db2.gz WADRCIQLPIDWGI-NEPJUHHUSA-N 2 0 210.365 2.297 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+][C@@H]1CC[NH2+]C[C@@H]1C ZINC000423393212 387278105 /nfs/dbraw/zinc/27/81/05/387278105.db2.gz MAOGMEDVYFHVPO-SGMGOOAPSA-N 2 0 233.359 2.039 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H](C)c1ccc(C)nc1C ZINC000643498994 387282698 /nfs/dbraw/zinc/28/26/98/387282698.db2.gz IVBRIHTZDXYDJG-GFCCVEGCSA-N 2 0 235.375 2.349 20 0 BEADRP C[C@H](C[NH2+][C@H](C)[C@H]1C[C@H]1C)C[NH+]1CCCC1 ZINC000321594240 387282718 /nfs/dbraw/zinc/28/27/18/387282718.db2.gz PODKFRNQQCYMGN-SYQHCUMBSA-N 2 0 224.392 2.352 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H]1CCCc2ccc(O)cc21 ZINC000643499306 387282928 /nfs/dbraw/zinc/28/29/28/387282928.db2.gz ZNWWXAIPQHKUTB-HNNXBMFYSA-N 2 0 248.370 2.359 20 0 BEADRP C[C@H]([NH3+])[C@H](C)[NH2+][C@H](C1CC1)C1CCCC1 ZINC000423469483 387317982 /nfs/dbraw/zinc/31/79/82/387317982.db2.gz PBAYPRYJMXSLOT-KWBADKCTSA-N 2 0 210.365 2.281 20 0 BEADRP CC(C)C[C@@H]1CCC[C@@H]([NH2+][C@@H]2[C@H]3C[NH2+]C[C@H]32)C1 ZINC000423432059 387284310 /nfs/dbraw/zinc/28/43/10/387284310.db2.gz MERDAOSYTPYSBR-XPABHHOTSA-N 2 0 236.403 2.399 20 0 BEADRP CCOC[C@@H]1CCC[C@H]1[NH2+][C@H](C)CCCC[NH3+] ZINC000423438689 387287488 /nfs/dbraw/zinc/28/74/88/387287488.db2.gz RRZFIWAFSCFZSZ-HZSPNIEDSA-N 2 0 242.407 2.299 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@H](C)C1C(C)(C)C1(C)C ZINC000423440672 387291160 /nfs/dbraw/zinc/29/11/60/387291160.db2.gz AVNGMKJFCFKRDI-ZJUUUORDSA-N 2 0 212.381 2.384 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000423442108 387292774 /nfs/dbraw/zinc/29/27/74/387292774.db2.gz UVWOSLYSMQCTLT-KCPJHIHWSA-N 3 0 247.386 2.238 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)C(C)(C)C ZINC000423449874 387300587 /nfs/dbraw/zinc/30/05/87/387300587.db2.gz WTDKWRNAKOGEOF-WCFLWFBJSA-N 2 0 224.392 2.399 20 0 BEADRP CC[C@@H]1C[C@@H](C)CC[C@@H]1[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000423454104 387301616 /nfs/dbraw/zinc/30/16/16/387301616.db2.gz KJGQPUPLHRULNS-AJSWTNHPSA-N 2 0 222.376 2.009 20 0 BEADRP C[C@H]([NH3+])[C@H](C)[NH2+][C@@H](C)C1C(C)(C)C1(C)C ZINC000423454099 387301752 /nfs/dbraw/zinc/30/17/52/387301752.db2.gz YNUKTQGSEXVMOL-GUBZILKMSA-N 2 0 212.381 2.382 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)C1C(C)(C)C1(C)C)[C@H](C)[NH3+] ZINC000423454098 387301882 /nfs/dbraw/zinc/30/18/82/387301882.db2.gz YNUKTQGSEXVMOL-AEJSXWLSSA-N 2 0 212.381 2.382 20 0 BEADRP CC(C)C[C@H]1CCC[C@H]([NH2+][C@@H]2[C@H]3C[NH2+]C[C@H]32)C1 ZINC000423455146 387302652 /nfs/dbraw/zinc/30/26/52/387302652.db2.gz MERDAOSYTPYSBR-SEBNEYGDSA-N 2 0 236.403 2.399 20 0 BEADRP CCCCO[C@@H]1C[C@H]([NH2+]C[C@@H]([NH3+])CC)C1(C)C ZINC000423455423 387303211 /nfs/dbraw/zinc/30/32/11/387303211.db2.gz CKKQXBGAEHWCAE-RWMBFGLXSA-N 2 0 242.407 2.297 20 0 BEADRP c1ccc([C@H]2CC[C@@H]([NH2+][C@@H]3[C@H]4C[NH2+]C[C@H]43)C2)cc1 ZINC000423459078 387305543 /nfs/dbraw/zinc/30/55/43/387305543.db2.gz RCTSXJJJGFWJLV-ZVDSWSACSA-N 2 0 242.366 2.130 20 0 BEADRP C[C@@H]1C[C@H]1C[N@H+](CCC[NH3+])CC1CCCC1 ZINC000352539481 387307232 /nfs/dbraw/zinc/30/72/32/387307232.db2.gz BCUPORVVHDLWTI-OCCSQVGLSA-N 2 0 224.392 2.483 20 0 BEADRP CC(C)[C@H]1CCCC[C@H]1[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000423460591 387308119 /nfs/dbraw/zinc/30/81/19/387308119.db2.gz SVYNLYWINRDJGE-RGDJUOJXSA-N 2 0 222.376 2.009 20 0 BEADRP C[C@H]([NH2+]CCC1=CC[NH2+]CC1)c1ccncc1F ZINC000423535361 387360647 /nfs/dbraw/zinc/36/06/47/387360647.db2.gz CTGQVRJGVSCQMU-NSHDSACASA-N 2 0 249.333 2.181 20 0 BEADRP C[C@@H]([NH2+]CCC1=CC[NH2+]CC1)c1ccncc1F ZINC000423535360 387361941 /nfs/dbraw/zinc/36/19/41/387361941.db2.gz CTGQVRJGVSCQMU-LLVKDONJSA-N 2 0 249.333 2.181 20 0 BEADRP CCCC[C@@H](COC)[NH2+]CCC1=CC[NH2+]CC1 ZINC000423534557 387362248 /nfs/dbraw/zinc/36/22/48/387362248.db2.gz ADBGFLWZOIRSFO-AWEZNQCLSA-N 2 0 240.391 2.091 20 0 BEADRP C[C@H]([NH2+][C@H]1CCCC[NH2+]C1)[C@@H]1CC1(C)C ZINC000423541765 387365151 /nfs/dbraw/zinc/36/51/51/387365151.db2.gz AAFOMUUPLFDZHI-SRVKXCTJSA-N 2 0 210.365 2.153 20 0 BEADRP CCC[C@H](N[C@@H](C)C1C[NH2+]C1)c1ccccn1 ZINC000643453404 387368254 /nfs/dbraw/zinc/36/82/54/387368254.db2.gz QFBGVMYKUVGYQZ-FZMZJTMJSA-N 2 0 233.359 2.120 20 0 BEADRP C1=C(CC[NH2+][C@H](C2CC2)C2CCC2)CC[NH2+]C1 ZINC000423543344 387369086 /nfs/dbraw/zinc/36/90/86/387369086.db2.gz VBVZIDWFFXHREI-HNNXBMFYSA-N 2 0 234.387 2.465 20 0 BEADRP C(C[NH2+]C1CC1)C[NH2+][C@@H]1CCC12CCC2 ZINC000423545928 387370429 /nfs/dbraw/zinc/37/04/29/387370429.db2.gz FDVMWWBIUFHZMO-GFCCVEGCSA-N 2 0 208.349 2.051 20 0 BEADRP C[C@H]1CCC[C@H]([NH2+]CCC2=CC[NH2+]CC2)C1 ZINC000423547907 387370557 /nfs/dbraw/zinc/37/05/57/387370557.db2.gz GDLMDEYSHXYQAY-JSGCOSHPSA-N 2 0 222.376 2.465 20 0 BEADRP [NH3+]CC1CCC([NH2+]C[C@H]2Cc3ccccc32)CC1 ZINC000643453634 387370988 /nfs/dbraw/zinc/37/09/88/387370988.db2.gz NNAISLYHQQIWNQ-HNFVBEJKSA-N 2 0 244.382 2.433 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]C[C@H]1Cc2ccccc21 ZINC000643453600 387371101 /nfs/dbraw/zinc/37/11/01/387371101.db2.gz KLFCZWAZRPEQKU-XNRPHZJLSA-N 2 0 244.382 2.304 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1Cc2ccccc21)[C@H]1CCC[NH2+]1 ZINC000643453651 387371157 /nfs/dbraw/zinc/37/11/57/387371157.db2.gz PEOKZEDOZXISFR-UXIGCNINSA-N 2 0 230.355 2.056 20 0 BEADRP C(C[NH2+]C1CC1)C[NH2+][C@@H]1CC[C@H]1C1CCC1 ZINC000423547390 387371482 /nfs/dbraw/zinc/37/14/82/387371482.db2.gz GBVZUBKTQIPHPM-UONOGXRCSA-N 2 0 222.376 2.297 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)[C@H]1C[C@H]1C ZINC000423552853 387372644 /nfs/dbraw/zinc/37/26/44/387372644.db2.gz QDPGHELYHDLFPL-JEWKUQAESA-N 2 0 236.403 2.399 20 0 BEADRP C(C[NH2+]C1CC1)C[NH2+]C1CCC2(CC2)CC1 ZINC000423557711 387376120 /nfs/dbraw/zinc/37/61/20/387376120.db2.gz NOIPADXAQDBWBP-UHFFFAOYSA-N 2 0 222.376 2.441 20 0 BEADRP C[C@@H]([NH2+]CCC[NH2+]C1CC1)C1CCSCC1 ZINC000423573155 387380258 /nfs/dbraw/zinc/38/02/58/387380258.db2.gz YZKBXTXJJGLQHF-LLVKDONJSA-N 2 0 242.432 2.250 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[C@@H]([NH3+])C1)c1cncs1 ZINC000423475549 387322846 /nfs/dbraw/zinc/32/28/46/387322846.db2.gz PYXUKNIXWPFKFX-HBNTYKKESA-N 2 0 239.388 2.311 20 0 BEADRP CCO[C@@H]1C[C@H]([NH2+]C[C@@H]([NH3+])CC)C1(CC)CC ZINC000423477844 387323431 /nfs/dbraw/zinc/32/34/31/387323431.db2.gz UEKGISGVKANQGH-RWMBFGLXSA-N 2 0 242.407 2.297 20 0 BEADRP C[C@H](CCCc1cccnc1)[NH2+][C@@H](C)[C@H](C)[NH3+] ZINC000423479483 387326526 /nfs/dbraw/zinc/32/65/26/387326526.db2.gz VKNKQTRSILGRLN-AGIUHOORSA-N 2 0 235.375 2.118 20 0 BEADRP [NH3+][C@@H]1CCC[C@H](C[NH2+][C@@H]2CCC23CCC3)C1 ZINC000423479256 387326893 /nfs/dbraw/zinc/32/68/93/387326893.db2.gz UVJSAHSYHWNFNZ-YNEHKIRRSA-N 2 0 222.376 2.426 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH2+][C@@H]2CCC23CCC3)C1 ZINC000390434502 387327465 /nfs/dbraw/zinc/32/74/65/387327465.db2.gz RIBXNODXNWHORH-QWHCGFSZSA-N 2 0 222.376 2.251 20 0 BEADRP CC[NH+](CC)CCO[C@H]1CC[N@H+](CC(C)C)C1 ZINC000354099578 387329417 /nfs/dbraw/zinc/32/94/17/387329417.db2.gz FXQUANQJOOORNT-AWEZNQCLSA-N 2 0 242.407 2.075 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H](C[NH3+])C1)c1cccc(O)c1 ZINC000423484811 387330988 /nfs/dbraw/zinc/33/09/88/387330988.db2.gz AIGWSCKEVDDIRU-DMDPSCGWSA-N 2 0 234.343 2.170 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000423487344 387333650 /nfs/dbraw/zinc/33/36/50/387333650.db2.gz UDKGYHYYLYAPSR-TZMCWYRMSA-N 2 0 236.359 2.332 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+][C@H](C)CCc1ccco1 ZINC000515053158 387334712 /nfs/dbraw/zinc/33/47/12/387334712.db2.gz DHRHAHUQLPCVDO-YPMHNXCESA-N 2 0 224.348 2.174 20 0 BEADRP C[C@H](CCC(C)(C)C)[NH2+]C[C@H]1C[NH2+]CCCO1 ZINC000423491930 387336118 /nfs/dbraw/zinc/33/61/18/387336118.db2.gz KUHSENJKEFPVQY-CHWSQXEVSA-N 2 0 242.407 2.169 20 0 BEADRP C[C@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1ccco1 ZINC000423491530 387336464 /nfs/dbraw/zinc/33/64/64/387336464.db2.gz ZINZNJSQJBQWPT-NWDGAFQWSA-N 2 0 222.332 2.462 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[C@@H](C[NH3+])C1)C1CCCC1 ZINC000423494940 387339248 /nfs/dbraw/zinc/33/92/48/387339248.db2.gz SVGYKFWFZXKZDX-LOWVWBTDSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@H](C[NH3+])C1)C1CCSCC1 ZINC000423501291 387340582 /nfs/dbraw/zinc/34/05/82/387340582.db2.gz JHVWNAKZXBHWEK-GMXVVIOVSA-N 2 0 242.432 2.235 20 0 BEADRP CC(C)=CCC[C@H](C)[NH2+]C[C@H]1C[NH2+]CCCO1 ZINC000423506461 387345125 /nfs/dbraw/zinc/34/51/25/387345125.db2.gz GXSKKGYTBKSPPE-UONOGXRCSA-N 2 0 240.391 2.089 20 0 BEADRP Cc1ccc([C@H](C)[NH2+]C[C@H]2CCC[NH2+]C2)c(C)n1 ZINC000643500776 387345988 /nfs/dbraw/zinc/34/59/88/387345988.db2.gz FAFGCXKFWQXGFG-JSGCOSHPSA-N 2 0 247.386 2.349 20 0 BEADRP CSC1(C[NH2+][C@@H]2CC[N@H+](C)C[C@H]2C)CCC1 ZINC000304004851 387423846 /nfs/dbraw/zinc/42/38/46/387423846.db2.gz SYEMWLFCOLLZIC-VXGBXAGGSA-N 2 0 242.432 2.202 20 0 BEADRP Cc1ccc2c(c1)[C@@H]([NH2+][C@@H](C)C1C[NH2+]C1)CC2 ZINC000643468990 387424834 /nfs/dbraw/zinc/42/48/34/387424834.db2.gz WRQRVNYTXPVSDP-NHYWBVRUSA-N 2 0 230.355 2.180 20 0 BEADRP CCCN(CC)C[C@@H](C)[NH2+][C@@H]1CCOC[C@H]1C ZINC000515859442 387430106 /nfs/dbraw/zinc/43/01/06/387430106.db2.gz RNBUGZRFWBLHMN-MGPQQGTHSA-N 2 0 242.407 2.121 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H]1C[C@@H](C)O[C@@H](C)C1 ZINC000648495928 387454379 /nfs/dbraw/zinc/45/43/79/387454379.db2.gz TVKLRNVZPJYTDY-WDNDVIMCSA-N 2 0 242.407 2.264 20 0 BEADRP C[C@@H](C[NH2+][C@@H](C)C[C@H](C)[NH3+])C(C)(C)C ZINC000643455204 387390815 /nfs/dbraw/zinc/39/08/15/387390815.db2.gz GOPYPALBKMLZEJ-DCAQKATOSA-N 2 0 200.370 2.384 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]C[C@@H](C)C(C)(C)C ZINC000643455207 387390874 /nfs/dbraw/zinc/39/08/74/387390874.db2.gz GOPYPALBKMLZEJ-VWYCJHECSA-N 2 0 200.370 2.384 20 0 BEADRP C[N@H+](CC1CC[NH+](C)CC1)CC1(C)CC1 ZINC000515545652 387395812 /nfs/dbraw/zinc/39/58/12/387395812.db2.gz PFFVPYMIMINTPM-UHFFFAOYSA-N 2 0 210.365 2.060 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCCCC[C@@H]1[NH3+])C1CC1 ZINC000643468291 387418375 /nfs/dbraw/zinc/41/83/75/387418375.db2.gz IYGIPPILIMDYQG-WXHSDQCUSA-N 2 0 210.365 2.282 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000304644170 387498193 /nfs/dbraw/zinc/49/81/93/387498193.db2.gz XHFIRKZAOWCESN-HZSPNIEDSA-N 2 0 224.392 2.497 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H]2COC(C)(C)C2)CC1 ZINC000396839721 387499770 /nfs/dbraw/zinc/49/97/70/387499770.db2.gz FQEPIRBRPBSYMO-ZDUSSCGKSA-N 2 0 240.391 2.018 20 0 BEADRP C[N@@H+]1CCCC12CC[NH+](C[Si](C)(C)C)CC2 ZINC000374976357 387503314 /nfs/dbraw/zinc/50/33/14/387503314.db2.gz FXGCXUZITPCGMV-UHFFFAOYSA-N 2 0 240.467 2.424 20 0 BEADRP CO[C@@H]1CCC[C@H]([NH2+][C@@H]2CCCC[C@H]2C[NH3+])C1 ZINC000643475298 387508746 /nfs/dbraw/zinc/50/87/46/387508746.db2.gz CDZLOZZTSGAYSM-IGQOVBAYSA-N 2 0 240.391 2.051 20 0 BEADRP CCSCCC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000300900336 387522563 /nfs/dbraw/zinc/52/25/63/387522563.db2.gz IUUZLPLXKDBBFZ-YHWZYXNKSA-N 2 0 242.432 2.344 20 0 BEADRP CCC[C@]1([NH2+]CCC[NH+](CC)CC)CCOC1 ZINC000352825245 387528497 /nfs/dbraw/zinc/52/84/97/387528497.db2.gz OSFXXTIUQGNDNA-AWEZNQCLSA-N 2 0 242.407 2.267 20 0 BEADRP CC1(C)C[C@@H]1[NH2+]Cc1cc(C2CC[NH2+]CC2)no1 ZINC000425898321 387533564 /nfs/dbraw/zinc/53/35/64/387533564.db2.gz YZIKWPFPFJQAIL-ZDUSSCGKSA-N 2 0 249.358 2.030 20 0 BEADRP Cc1cc(C)c(C[NH2+][C@@H]2CCCC[C@H]2C[NH3+])cn1 ZINC000397026974 387534610 /nfs/dbraw/zinc/53/46/10/387534610.db2.gz OEZDZZFVFZPWOG-DZGCQCFKSA-N 2 0 247.386 2.306 20 0 BEADRP CC[N@@H+]1CC[C@@H](N(C)CC2(F)CC2)C[C@H]1C ZINC000527219149 387538437 /nfs/dbraw/zinc/53/84/37/387538437.db2.gz IHRZLMUDOXDWIL-VXGBXAGGSA-N 2 0 228.355 2.293 20 0 BEADRP COCCC[C@H](C)[NH2+]C1CCC([NH+](C)C)CC1 ZINC000421892415 387467729 /nfs/dbraw/zinc/46/77/29/387467729.db2.gz ZCFCUQWNCFISSI-HSBZDZAISA-N 2 0 242.407 2.264 20 0 BEADRP CO[C@@H](C)[C@@H](C)[NH2+]CC1(C[NH+](C)C)CCCC1 ZINC000355069921 387475312 /nfs/dbraw/zinc/47/53/12/387475312.db2.gz SIWBFYJHEQPLFR-OLZOCXBDSA-N 2 0 242.407 2.121 20 0 BEADRP CO[C@H](C)[C@H](C)[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C ZINC000361523833 387478901 /nfs/dbraw/zinc/47/89/01/387478901.db2.gz GWDQUHHTTJKQAR-XQQFMLRXSA-N 2 0 244.423 2.366 20 0 BEADRP CC(C)[NH+]1CCC([N@H+](C)CCCF)CC1 ZINC000361556373 387487807 /nfs/dbraw/zinc/48/78/07/387487807.db2.gz GRKRZIJMIKQSAP-UHFFFAOYSA-N 2 0 216.344 2.151 20 0 BEADRP CC(C)[NH2+]CCC[NH2+][C@H](C)C(C)(C)C ZINC000643508275 387488531 /nfs/dbraw/zinc/48/85/31/387488531.db2.gz AIFBPGXCKNWTPY-LLVKDONJSA-N 2 0 200.370 2.399 20 0 BEADRP COc1cccc(C[C@@H]2CCC[N@@H+]2CCC[NH3+])c1 ZINC000516258532 387491244 /nfs/dbraw/zinc/49/12/44/387491244.db2.gz GWKYWBZMIUFIMJ-AWEZNQCLSA-N 2 0 248.370 2.051 20 0 BEADRP C[NH+](C)CC1CC[NH+](CCC(F)(F)F)CC1 ZINC000355881050 387589832 /nfs/dbraw/zinc/58/98/32/387589832.db2.gz PJPBTCRSGXQNNS-UHFFFAOYSA-N 2 0 238.297 2.212 20 0 BEADRP CCCCOCCN1CC[C@@H](C[N@H+](C)CC)C1 ZINC000362348477 387598316 /nfs/dbraw/zinc/59/83/16/387598316.db2.gz JIGVCGGBLAOXQY-AWEZNQCLSA-N 2 0 242.407 2.077 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]Cc1cccc(C2CC2)c1 ZINC000422551245 387599347 /nfs/dbraw/zinc/59/93/47/387599347.db2.gz DHWCZQQMDMTCKU-LLVKDONJSA-N 2 0 218.344 2.248 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CCO[C@@H]1CCCC[C@H]1C ZINC000422716309 387628859 /nfs/dbraw/zinc/62/88/59/387628859.db2.gz UGFHHGCJQSPTBO-ZOBORPQBSA-N 2 0 242.407 2.297 20 0 BEADRP CCC[C@H](C)C[NH+]1CCC2(CC[NH2+]2)CC1 ZINC000422564349 387602416 /nfs/dbraw/zinc/60/24/16/387602416.db2.gz VSIORXXJLPNEQH-LBPRGKRZSA-N 2 0 210.365 2.251 20 0 BEADRP CC(C)OCCC[N@@H+]1C[C@H](C[NH3+])[C@@H](C)C[C@@H]1C ZINC000422639440 387611241 /nfs/dbraw/zinc/61/12/41/387611241.db2.gz STWJQDBILPSPEE-IHRRRGAJSA-N 2 0 242.407 2.107 20 0 BEADRP CCc1nc([C@H](C)[NH2+][C@H](C)CCC[NH3+])cs1 ZINC000422703040 387618014 /nfs/dbraw/zinc/61/80/14/387618014.db2.gz GSBKQKXFMKYOJF-ZJUUUORDSA-N 2 0 241.404 2.484 20 0 BEADRP C[C@@H]([NH2+]CCCCC(C)(C)C)C1C[NH2+]C1 ZINC000422716712 387627367 /nfs/dbraw/zinc/62/73/67/387627367.db2.gz NQYKWNBEGBZCLV-LLVKDONJSA-N 2 0 212.381 2.400 20 0 BEADRP Cc1ccc(CC[NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)nc1 ZINC000399681353 387566300 /nfs/dbraw/zinc/56/63/00/387566300.db2.gz QMRKWKXDZGXPJN-ZFWWWQNUSA-N 2 0 247.386 2.005 20 0 BEADRP CC[NH+]1CCC([NH2+]CCc2ccc(C)cn2)CC1 ZINC000399754206 387567463 /nfs/dbraw/zinc/56/74/63/387567463.db2.gz PCIBZAWYXLCFDX-UHFFFAOYSA-N 2 0 247.386 2.006 20 0 BEADRP CC[C@@H]1CCC[C@H]([NH2+][C@H](C)C2C[NH2+]C2)C1 ZINC000422792512 387694459 /nfs/dbraw/zinc/69/44/59/387694459.db2.gz XCWLPRWYHOQTSU-WZRBSPASSA-N 2 0 210.365 2.153 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+][C@H](C)C2C[NH2+]C2)cc1 ZINC000422718942 387630505 /nfs/dbraw/zinc/63/05/05/387630505.db2.gz LQHGRNLAVAVCGS-VXGBXAGGSA-N 2 0 218.344 2.254 20 0 BEADRP CC(C)[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000422717536 387631793 /nfs/dbraw/zinc/63/17/93/387631793.db2.gz OVACZOYAWPRRQR-FPMFFAJLSA-N 2 0 224.392 2.399 20 0 BEADRP [NH3+]CC1CCC([NH2+]CC2CCSCC2)CC1 ZINC000422726106 387634910 /nfs/dbraw/zinc/63/49/10/387634910.db2.gz DAKSFVYQZHASJN-UHFFFAOYSA-N 2 0 242.432 2.237 20 0 BEADRP Cc1ccc(CC[N@@H+]2CCC[C@@H](C[NH3+])C2)cc1 ZINC000430648742 387635219 /nfs/dbraw/zinc/63/52/19/387635219.db2.gz HKQDIROZCNVLGT-HNNXBMFYSA-N 2 0 232.371 2.208 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCC[C@@H](C)[C@H]1C)C1C[NH2+]C1 ZINC000422729331 387637789 /nfs/dbraw/zinc/63/77/89/387637789.db2.gz KMXFUSMUUJSPGA-UZWSLXQKSA-N 2 0 210.365 2.009 20 0 BEADRP COc1ccc(C[NH2+][C@@H]2CC[NH2+]CC[C@@H]2C)cc1 ZINC000422729055 387638337 /nfs/dbraw/zinc/63/83/37/387638337.db2.gz HINJPWAQFDCZGK-SWLSCSKDSA-N 2 0 248.370 2.173 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCC[C@@H](C)[C@@H]1C)C1C[NH2+]C1 ZINC000422729332 387638413 /nfs/dbraw/zinc/63/84/13/387638413.db2.gz KMXFUSMUUJSPGA-XZUYRWCXSA-N 2 0 210.365 2.009 20 0 BEADRP CCCCOCCC[NH2+][C@@H]1CC[NH2+]CC[C@H]1C ZINC000422729955 387638521 /nfs/dbraw/zinc/63/85/21/387638521.db2.gz LQJZSTSWDZOCRX-ZIAGYGMSSA-N 2 0 242.407 2.171 20 0 BEADRP C[C@@H](CCc1ccccc1)[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000422730877 387639371 /nfs/dbraw/zinc/63/93/71/387639371.db2.gz MPHPTBIKIKUNBP-STQMWFEESA-N 2 0 232.371 2.205 20 0 BEADRP C[C@@H]([NH2+]CCC[NH+]1CCCC1)[C@@H]1C[C@H]1C1CC1 ZINC000527632499 387643325 /nfs/dbraw/zinc/64/33/25/387643325.db2.gz PCDGFTIXOITWMX-SNPRPXQTSA-N 2 0 236.403 2.497 20 0 BEADRP CCCCOCCC[NH2+][C@H]1CCCCC[C@@H]1[NH3+] ZINC000422737299 387644620 /nfs/dbraw/zinc/64/46/20/387644620.db2.gz XFRKEXXYIDOSAV-KBPBESRZSA-N 2 0 242.407 2.443 20 0 BEADRP C[C@H](Cc1ccccc1F)[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000422739694 387645516 /nfs/dbraw/zinc/64/55/16/387645516.db2.gz LZHXNHACBVJSQH-SDDRHHMPSA-N 2 0 238.350 2.472 20 0 BEADRP CCCCOCCC[NH2+][C@@H]1CCCCC[C@@H]1[NH3+] ZINC000422737301 387646521 /nfs/dbraw/zinc/64/65/21/387646521.db2.gz XFRKEXXYIDOSAV-UONOGXRCSA-N 2 0 242.407 2.443 20 0 BEADRP CCOc1ccccc1C[NH2+][C@H]1CCC[C@@H]1C[NH3+] ZINC000422740517 387649207 /nfs/dbraw/zinc/64/92/07/387649207.db2.gz NQZNOJUCUCTGGG-OCCSQVGLSA-N 2 0 248.370 2.302 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+]CCc1ccccc1 ZINC000422741594 387649222 /nfs/dbraw/zinc/64/92/22/387649222.db2.gz DWPGQKBOWWKJJZ-ZFWWWQNUSA-N 2 0 232.371 2.207 20 0 BEADRP CC[C@@H]([NH2+]C1CCCCC1)[C@@H]1CCC[NH2+]1 ZINC000422747018 387650605 /nfs/dbraw/zinc/65/06/05/387650605.db2.gz OXBYUVBWERDYMU-OLZOCXBDSA-N 2 0 210.365 2.439 20 0 BEADRP CC[C@@H](C)[NH2+][C@H](C)c1ccc(C[NH3+])nc1C ZINC000422746336 387651087 /nfs/dbraw/zinc/65/10/87/387651087.db2.gz NTBJRQNPJNTDLL-NXEZZACHSA-N 2 0 221.348 2.298 20 0 BEADRP CC[C@@H](C)[NH2+][C@@H](C)c1ccc(C[NH3+])nc1C ZINC000422746339 387651111 /nfs/dbraw/zinc/65/11/11/387651111.db2.gz NTBJRQNPJNTDLL-ZJUUUORDSA-N 2 0 221.348 2.298 20 0 BEADRP CC[C@H](C)[NH2+][C@@H](C)c1ccc(C[NH3+])nc1C ZINC000422746337 387651835 /nfs/dbraw/zinc/65/18/35/387651835.db2.gz NTBJRQNPJNTDLL-UWVGGRQHSA-N 2 0 221.348 2.298 20 0 BEADRP Cc1ccc(OCC[NH2+][C@H](C)CCC[NH3+])cc1 ZINC000422750880 387655972 /nfs/dbraw/zinc/65/59/72/387655972.db2.gz DUXMKNUXOSYDTK-CYBMUJFWSA-N 2 0 236.359 2.091 20 0 BEADRP COc1ccccc1[C@H](C)[NH2+][C@@H](C)C[C@@H](C)[NH3+] ZINC000422753928 387658723 /nfs/dbraw/zinc/65/87/23/387658723.db2.gz JATDGUDWOBOXPK-WOPDTQHZSA-N 2 0 236.359 2.472 20 0 BEADRP CC[NH+]1CCC(C[NH2+]Cc2ccnc(C)c2)CC1 ZINC000527652509 387659955 /nfs/dbraw/zinc/65/99/55/387659955.db2.gz FBNNHDAHWNKZLJ-UHFFFAOYSA-N 2 0 247.386 2.212 20 0 BEADRP Cc1ccc(C[C@@H](C)[NH2+][C@@H](C)C2C[NH2+]C2)s1 ZINC000422757308 387660333 /nfs/dbraw/zinc/66/03/33/387660333.db2.gz HUZMYKBLTROEOF-KOLCDFICSA-N 2 0 238.400 2.185 20 0 BEADRP CCC(CC)C[NH+]1CCC2(CC[NH2+]C2)CC1 ZINC000430926447 387661069 /nfs/dbraw/zinc/66/10/69/387661069.db2.gz GITMMCDFMITWSJ-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP CCOC[C@H](C)[NH2+]C[C@@H](C)C[NH+]1CCCCC1 ZINC000125627456 387661340 /nfs/dbraw/zinc/66/13/40/387661340.db2.gz ACSRTCXIIKNBKM-KGLIPLIRSA-N 2 0 242.407 2.123 20 0 BEADRP Cc1cc(C[NH2+]CCC2CC[NH+](C)CC2)ccn1 ZINC000527654907 387662222 /nfs/dbraw/zinc/66/22/22/387662222.db2.gz WOKRSYNREZOJFV-UHFFFAOYSA-N 2 0 247.386 2.212 20 0 BEADRP CC[C@H]([NH2+]CCc1cccs1)[C@@H]1CCC[NH2+]1 ZINC000422763661 387665567 /nfs/dbraw/zinc/66/55/67/387665567.db2.gz UHZBOSNGWGKFNO-STQMWFEESA-N 2 0 238.400 2.411 20 0 BEADRP CCO[C@@H]1C[C@H]([NH2+][C@@H](C)CCC[NH3+])C12CCC2 ZINC000422788629 387667881 /nfs/dbraw/zinc/66/78/81/387667881.db2.gz VUTNHQOJXBPXQQ-RWMBFGLXSA-N 2 0 240.391 2.051 20 0 BEADRP CCO[C@@H]1C[C@@H]([NH2+][C@H](C)CCC[NH3+])C12CCC2 ZINC000422788627 387667889 /nfs/dbraw/zinc/66/78/89/387667889.db2.gz VUTNHQOJXBPXQQ-JHJVBQTASA-N 2 0 240.391 2.051 20 0 BEADRP CC[C@@H]([NH2+][C@H](C)C1C[NH2+]C1)c1ccc(OC)cc1 ZINC000422767445 387668688 /nfs/dbraw/zinc/66/86/88/387668688.db2.gz RBNHVCJLHNELPC-IAQYHMDHSA-N 2 0 248.370 2.344 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCc2nc[nH]c2C1)[C@@H]1C[C@H]1C1CC1 ZINC000527714009 387669524 /nfs/dbraw/zinc/66/95/24/387669524.db2.gz YDJWVYMNYCHPOS-RYDUCSDGSA-N 2 0 245.370 2.291 20 0 BEADRP CC(C)[C@@H](C)C[NH2+][C@@H](C)[C@H]1CCCC[NH2+]1 ZINC000422773171 387670113 /nfs/dbraw/zinc/67/01/13/387670113.db2.gz TWAVFVOTNYPPMK-RWMBFGLXSA-N 2 0 212.381 2.399 20 0 BEADRP COc1ccc([C@H](C)[NH2+][C@H](C)C[C@H](C)[NH3+])cc1 ZINC000422777273 387674230 /nfs/dbraw/zinc/67/42/30/387674230.db2.gz FGIVLPMDBJETIX-TUAOUCFPSA-N 2 0 236.359 2.472 20 0 BEADRP CC[C@@H]([NH2+][C@H](C)C1C[NH2+]C1)c1ccccc1 ZINC000422777898 387675421 /nfs/dbraw/zinc/67/54/21/387675421.db2.gz GQABXBBBVFYHPT-BXUZGUMPSA-N 2 0 218.344 2.335 20 0 BEADRP CCO[C@@H]1C[C@H]([NH2+][C@H](C)C[C@@H](C)[NH3+])C12CCC2 ZINC000422777105 387675695 /nfs/dbraw/zinc/67/56/95/387675695.db2.gz FFLGLHAAIDSROU-FVCCEPFGSA-N 2 0 240.391 2.050 20 0 BEADRP CCOc1cccc([C@@H](C)[NH2+][C@@H](C)C2C[NH2+]C2)c1 ZINC000422779792 387678527 /nfs/dbraw/zinc/67/85/27/387678527.db2.gz JEGHBAIPTGEXME-NEPJUHHUSA-N 2 0 248.370 2.344 20 0 BEADRP Cc1cccc([C@H](C)C[NH2+][C@H](C)C2C[NH2+]C2)c1 ZINC000422781031 387680911 /nfs/dbraw/zinc/68/09/11/387680911.db2.gz JZXBAHFTAQORDS-CHWSQXEVSA-N 2 0 232.371 2.296 20 0 BEADRP Cc1cc(C)cc(CC[NH2+][C@@H]2CCC[C@H]2[NH3+])c1 ZINC000422783816 387683557 /nfs/dbraw/zinc/68/35/57/387683557.db2.gz NGVXXFMBIKPJHT-HUUCEWRRSA-N 2 0 232.371 2.315 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@@H](C)c1ccccc1 ZINC000422742904 387688404 /nfs/dbraw/zinc/68/84/04/387688404.db2.gz HFMFHXXJCVJXHV-TUAOUCFPSA-N 2 0 206.333 2.463 20 0 BEADRP CC[C@H](F)CN(C)[C@H]1CC[N@H+](CC)C[C@@H]1C ZINC000440770705 387688888 /nfs/dbraw/zinc/68/88/88/387688888.db2.gz KSZSYUCCHGMPGZ-AVGNSLFASA-N 2 0 230.371 2.397 20 0 BEADRP CC[C@@H]1CCC[C@@H]([NH2+][C@@H](C)C2C[NH2+]C2)C1 ZINC000422792507 387694088 /nfs/dbraw/zinc/69/40/88/387694088.db2.gz XCWLPRWYHOQTSU-DMDPSCGWSA-N 2 0 210.365 2.153 20 0 BEADRP Cc1ccc(OCCC[NH2+][C@@H]2CCC[C@@H]2[NH3+])cc1 ZINC000422860462 387744910 /nfs/dbraw/zinc/74/49/10/387744910.db2.gz MKBRHGMIVQSKFR-LSDHHAIUSA-N 2 0 248.370 2.233 20 0 BEADRP C[C@H](Cc1cccs1)[NH2+][C@@H]1CC[NH2+][C@H](C)C1 ZINC000643525500 387745674 /nfs/dbraw/zinc/74/56/74/387745674.db2.gz YXOWWLGUEKBPKA-IJLUTSLNSA-N 2 0 238.400 2.409 20 0 BEADRP COc1cc(C)ccc1C[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000422872782 387753126 /nfs/dbraw/zinc/75/31/26/387753126.db2.gz IPRFMBCYLIISRA-RYUDHWBXSA-N 2 0 236.359 2.219 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CCCc2ccccc21)C1C[NH2+]C1 ZINC000422802590 387701693 /nfs/dbraw/zinc/70/16/93/387701693.db2.gz HNVVPNJICZFQMU-OCCSQVGLSA-N 2 0 244.382 2.304 20 0 BEADRP CO[C@H](C[NH2+][C@H]1CCCC[C@H]1C[NH3+])C(C)(C)C ZINC000422801762 387702033 /nfs/dbraw/zinc/70/20/33/387702033.db2.gz AMYVHYXBLAGMMY-RWMBFGLXSA-N 2 0 242.407 2.155 20 0 BEADRP CO[C@H](C[NH2+][C@@H]1CCCC[C@@H]1C[NH3+])C(C)(C)C ZINC000422801761 387702249 /nfs/dbraw/zinc/70/22/49/387702249.db2.gz AMYVHYXBLAGMMY-JHJVBQTASA-N 2 0 242.407 2.155 20 0 BEADRP CC[C@@H]([NH2+]C[C@@]1(C)CCCS1)[C@@H]1CCC[NH2+]1 ZINC000422880352 387754952 /nfs/dbraw/zinc/75/49/52/387754952.db2.gz WTZIUAPWPHIGIO-FRRDWIJNSA-N 2 0 242.432 2.392 20 0 BEADRP CO[C@@H](C[NH2+]C1CCC(C[NH3+])CC1)C(C)(C)C ZINC000422806403 387704333 /nfs/dbraw/zinc/70/43/33/387704333.db2.gz IGODQIDOOZNFAX-BPCQOVAHSA-N 2 0 242.407 2.155 20 0 BEADRP COCc1ccc(C[NH2+][C@@H](C)C[C@H](C)[NH3+])cc1 ZINC000422807008 387704361 /nfs/dbraw/zinc/70/43/61/387704361.db2.gz LOMJRABGOLZIOT-RYUDHWBXSA-N 2 0 236.359 2.048 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]CCCC1CCCC1 ZINC000422806264 387704402 /nfs/dbraw/zinc/70/44/02/387704402.db2.gz NFCFSNJSDILYEK-CHWSQXEVSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]Cc1cccc(F)c1 ZINC000422805567 387704619 /nfs/dbraw/zinc/70/46/19/387704619.db2.gz JMLPLGGWTPRHRT-NXEZZACHSA-N 2 0 210.296 2.041 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)[C@H]2CC23CC3)C1 ZINC000527849180 387755132 /nfs/dbraw/zinc/75/51/32/387755132.db2.gz KSDOVBIZQVIOMC-JHJVBQTASA-N 2 0 222.376 2.106 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+]CCCC1CCCC1 ZINC000422806266 387706688 /nfs/dbraw/zinc/70/66/88/387706688.db2.gz NFCFSNJSDILYEK-QWHCGFSZSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CCc1ccsc1 ZINC000422811103 387709062 /nfs/dbraw/zinc/70/90/62/387709062.db2.gz TZYBHQXODGAJQV-UWVGGRQHSA-N 2 0 212.362 2.006 20 0 BEADRP COCc1ccccc1C[NH2+][C@@H](C)C[C@@H](C)[NH3+] ZINC000422812659 387711642 /nfs/dbraw/zinc/71/16/42/387711642.db2.gz YDPMDFIMESNQLB-NEPJUHHUSA-N 2 0 236.359 2.048 20 0 BEADRP CCSCC[C@H](C)[NH2+][C@H](C)C[C@H](C)[NH3+] ZINC000422812438 387712570 /nfs/dbraw/zinc/71/25/70/387712570.db2.gz WGEUAHVWEAPNGA-GARJFASQSA-N 2 0 218.410 2.234 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+][C@@H]1CCCSC1 ZINC000422814722 387713644 /nfs/dbraw/zinc/71/36/44/387713644.db2.gz ACIPDDUGKRKPME-IJLUTSLNSA-N 2 0 228.405 2.132 20 0 BEADRP CCO[C@@H](CC[NH2+][C@H](C)CCC[NH3+])C(C)C ZINC000422814596 387714535 /nfs/dbraw/zinc/71/45/35/387714535.db2.gz VOPKUWMZZUNAFB-OLZOCXBDSA-N 2 0 230.396 2.155 20 0 BEADRP CC[C@H]([NH2+][C@H]1CCCSC1)[C@@H]1CCC[NH2+]1 ZINC000422821146 387717365 /nfs/dbraw/zinc/71/73/65/387717365.db2.gz UOBPABRLCFKRIL-SRVKXCTJSA-N 2 0 228.405 2.002 20 0 BEADRP C1CC2(C1)CC[C@@H]2[NH2+][C@H]1CCC[NH2+]CC1 ZINC000643522289 387718187 /nfs/dbraw/zinc/71/81/87/387718187.db2.gz KVCNRJHSZNLIGS-RYUDHWBXSA-N 2 0 208.349 2.051 20 0 BEADRP CC[C@@H]([NH2+][C@@H]1CCCSC1)[C@@H]1CCC[NH2+]1 ZINC000422821148 387718154 /nfs/dbraw/zinc/71/81/54/387718154.db2.gz UOBPABRLCFKRIL-UTUOFQBUSA-N 2 0 228.405 2.002 20 0 BEADRP CCS[C@@H]1CCC[C@H]([NH2+][C@@H](C)C2C[NH2+]C2)C1 ZINC000422820419 387718259 /nfs/dbraw/zinc/71/82/59/387718259.db2.gz QMANJIOBHPQBHS-WCFLWFBJSA-N 2 0 242.432 2.248 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@]1(C)CCCC[C@H]1O ZINC000422819461 387718572 /nfs/dbraw/zinc/71/85/72/387718572.db2.gz IIMPEKZBOGNPFZ-MCIONIFRSA-N 2 0 242.407 2.035 20 0 BEADRP Cc1cncc([C@@H](C)[NH2+][C@H]2CCC[NH2+]CC2)c1 ZINC000643523305 387722269 /nfs/dbraw/zinc/72/22/69/387722269.db2.gz ZYTZSDZAFUNRCJ-OCCSQVGLSA-N 2 0 233.359 2.183 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+][C@@H]2CCC[NH2+]CC2)c(C)n1 ZINC000643522990 387723893 /nfs/dbraw/zinc/72/38/93/387723893.db2.gz VJOXCSDAAAAHBY-ZIAGYGMSSA-N 2 0 247.386 2.491 20 0 BEADRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]CCCOC1CCCC1 ZINC000422834756 387726349 /nfs/dbraw/zinc/72/63/49/387726349.db2.gz XKQANKHVNIBJFS-OCCSQVGLSA-N 2 0 240.391 2.053 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H](C)Cc1ccncc1 ZINC000422835136 387729541 /nfs/dbraw/zinc/72/95/41/387729541.db2.gz IJROUFDVHPIASO-OLZOCXBDSA-N 2 0 235.375 2.120 20 0 BEADRP C[C@H]([NH2+][C@@H](c1cccs1)C1CC1)C1C[NH2+]C1 ZINC000422789719 387731586 /nfs/dbraw/zinc/73/15/86/387731586.db2.gz BMKXHOXDJRSPNV-TVQRCGJNSA-N 2 0 236.384 2.397 20 0 BEADRP CC(C)CCOCC[NH2+][C@H]1CCCCC[C@@H]1[NH3+] ZINC000422788940 387732479 /nfs/dbraw/zinc/73/24/79/387732479.db2.gz WFHCSKMGLITYLM-KBPBESRZSA-N 2 0 242.407 2.299 20 0 BEADRP Cc1cc(F)ccc1CC[NH2+][C@@H]1CCC[C@@H]1[NH3+] ZINC000422849228 387734467 /nfs/dbraw/zinc/73/44/67/387734467.db2.gz BPUVUJXOHIQSLQ-UONOGXRCSA-N 2 0 236.334 2.146 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H]2CCCc3cccnc32)C1 ZINC000643524089 387735025 /nfs/dbraw/zinc/73/50/25/387735025.db2.gz HDHFVTKIZIWUNC-HZSPNIEDSA-N 2 0 245.370 2.319 20 0 BEADRP CSc1ccc(C[NH2+][C@@H](C)C2C[NH2+]C2)cc1 ZINC000422876748 387755941 /nfs/dbraw/zinc/75/59/41/387755941.db2.gz GKYVZJJUUWYCQW-JTQLQIEISA-N 2 0 236.384 2.106 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]C[C@H](C)N(C)c1ccccc1 ZINC000422854837 387736700 /nfs/dbraw/zinc/73/67/00/387736700.db2.gz DEJGPWOTURRERG-KGLIPLIRSA-N 2 0 249.402 2.228 20 0 BEADRP CO[C@H]1CCCC[C@@H]1[NH2+]CC[C@H]1CCC[N@@H+]1C ZINC000441223263 387737501 /nfs/dbraw/zinc/73/75/01/387737501.db2.gz CRUKYFZISLRMCM-RDBSUJKOSA-N 2 0 240.391 2.018 20 0 BEADRP CCC1(C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)CCC1 ZINC000422852395 387738026 /nfs/dbraw/zinc/73/80/26/387738026.db2.gz QQPYRXUGCDYJAX-FUNVUKJBSA-N 2 0 222.376 2.439 20 0 BEADRP Cc1cccc(CC[NH2+][C@@H](C)C[C@@H](C)[NH3+])c1 ZINC000422853522 387738366 /nfs/dbraw/zinc/73/83/66/387738366.db2.gz YZQSOPVBLLIKMC-OLZOCXBDSA-N 2 0 220.360 2.253 20 0 BEADRP Cc1ncc([C@H](C)[NH2+][C@H]2CCC[C@H]([NH3+])C2)s1 ZINC000643524241 387738922 /nfs/dbraw/zinc/73/89/22/387738922.db2.gz XYZHHMVPZBYVNZ-LSJOCFKGSA-N 2 0 239.388 2.372 20 0 BEADRP C[C@@H](CC[NH2+][C@@H](C)C1C[NH2+]C1)c1ccccc1 ZINC000422856586 387741919 /nfs/dbraw/zinc/74/19/19/387741919.db2.gz WZNGIVGOFRCUKD-STQMWFEESA-N 2 0 232.371 2.378 20 0 BEADRP CC[C@H]([NH2+][C@H](CCC[NH3+])COC)C(C)(C)C ZINC000422856447 387742228 /nfs/dbraw/zinc/74/22/28/387742228.db2.gz FKBLDRYHJDBIBV-NEPJUHHUSA-N 2 0 230.396 2.155 20 0 BEADRP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)[C@@H]1CC12CC2 ZINC000527905328 387761996 /nfs/dbraw/zinc/76/19/96/387761996.db2.gz NJIRALPBUZSAAA-JWURUJNWSA-N 2 0 234.387 2.390 20 0 BEADRP C[C@@H]([NH3+])C[NH2+][C@H]1CCCCC12CCCC2 ZINC000643527597 387766131 /nfs/dbraw/zinc/76/61/31/387766131.db2.gz OZYABOPWSTVTKP-NEPJUHHUSA-N 2 0 210.365 2.426 20 0 BEADRP COc1ccc([C@@H]([NH2+]C[C@H](C)[NH3+])C(C)C)cc1 ZINC000643528282 387767887 /nfs/dbraw/zinc/76/78/87/387767887.db2.gz GPKZPYPWVMOBEP-FZMZJTMJSA-N 2 0 236.359 2.329 20 0 BEADRP C[C@@H]([NH3+])C[NH2+][C@@H](C)CCc1ccccc1F ZINC000643528324 387768674 /nfs/dbraw/zinc/76/86/74/387768674.db2.gz HAUVSKVRIFENCT-MNOVXSKESA-N 2 0 224.323 2.084 20 0 BEADRP Cc1ccc(C[C@@H]([NH2+]C[C@@H](C)[NH3+])C(C)C)cc1 ZINC000643528627 387768949 /nfs/dbraw/zinc/76/89/49/387768949.db2.gz MENAHISGNFWWND-UKRRQHHQSA-N 2 0 234.387 2.499 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]C[C@H]1CCc2ccccc21 ZINC000422912309 387771842 /nfs/dbraw/zinc/77/18/42/387771842.db2.gz VXTQRKMODQERPE-SGMGOOAPSA-N 2 0 232.371 2.432 20 0 BEADRP Cc1ccc(CC[C@H](C)[NH2+]C[C@@H](C)[NH3+])cc1 ZINC000643528746 387772176 /nfs/dbraw/zinc/77/21/76/387772176.db2.gz ODQCLZJQHWOEKI-OLZOCXBDSA-N 2 0 220.360 2.253 20 0 BEADRP C[C@H]([NH3+])C[NH2+][C@@H](C)CCc1ccc(F)cc1 ZINC000643529031 387772285 /nfs/dbraw/zinc/77/22/85/387772285.db2.gz SZELAAFIKWTLKJ-QWRGUYRKSA-N 2 0 224.323 2.084 20 0 BEADRP Cc1ccc(CC[C@@H](C)[NH2+]C[C@H](C)[NH3+])cc1 ZINC000643528747 387772390 /nfs/dbraw/zinc/77/23/90/387772390.db2.gz ODQCLZJQHWOEKI-QWHCGFSZSA-N 2 0 220.360 2.253 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]1[NH2+]CCc1cc2ccccc2o1 ZINC000422915264 387774131 /nfs/dbraw/zinc/77/41/31/387774131.db2.gz AORKAWMXSKYFAF-KBPBESRZSA-N 2 0 244.338 2.445 20 0 BEADRP [NH3+][C@H]1CCCCC[C@H]1[NH2+]CCC(F)(F)F ZINC000422919584 387775561 /nfs/dbraw/zinc/77/55/61/387775561.db2.gz KCFFSQCVIZGKFF-DTWKUNHWSA-N 2 0 224.270 2.188 20 0 BEADRP CCC1(C[NH2+][C@H]2CC[NH2+]CC[C@H]2C)CC1 ZINC000422920239 387775695 /nfs/dbraw/zinc/77/56/95/387775695.db2.gz MAIUUYBMRLOAAM-NEPJUHHUSA-N 2 0 210.365 2.154 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+][C@H]1C[C@@H]1Cc1ccccc1 ZINC000422921153 387775835 /nfs/dbraw/zinc/77/58/35/387775835.db2.gz NMHOFHDEWHDCIZ-XGUBFFRZSA-N 2 0 230.355 2.087 20 0 BEADRP C[C@@H]([NH3+])C[NH2+][C@H](C)Cc1coc2ccccc12 ZINC000643529893 387776383 /nfs/dbraw/zinc/77/63/83/387776383.db2.gz UNBWQVUENFEBQN-GHMZBOCLSA-N 2 0 232.327 2.301 20 0 BEADRP Cc1cc(C)cc(C[C@H](C)[NH2+][C@@H](C)C2C[NH2+]C2)c1 ZINC000422923154 387777124 /nfs/dbraw/zinc/77/71/24/387777124.db2.gz RHFKXHXBMASYFE-KBPBESRZSA-N 2 0 246.398 2.432 20 0 BEADRP C[C@H]([NH2+][C@H]1C[C@H]1C1CCCCC1)C1C[NH2+]C1 ZINC000422922022 387777340 /nfs/dbraw/zinc/77/73/40/387777340.db2.gz PLIGPVUQYCPUPH-BPNCWPANSA-N 2 0 222.376 2.153 20 0 BEADRP CCC[C@H](Cc1ccccc1)[NH2+]C[C@@H](C)[NH3+] ZINC000643529322 387777569 /nfs/dbraw/zinc/77/75/69/387777569.db2.gz YNLWHDNZFRAJMI-TZMCWYRMSA-N 2 0 220.360 2.335 20 0 BEADRP CC[C@H]([NH2+]CC1(C)CCC1)[C@@H]1CCC[NH2+]1 ZINC000422923434 387778143 /nfs/dbraw/zinc/77/81/43/387778143.db2.gz WCGNOMMNLOKBOJ-RYUDHWBXSA-N 2 0 210.365 2.297 20 0 BEADRP CCC[NH+]1CCC([NH2+]CC2CC=CC2)CC1 ZINC000527943347 387780838 /nfs/dbraw/zinc/78/08/38/387780838.db2.gz JMIQPJQKLVKBNJ-UHFFFAOYSA-N 2 0 222.376 2.417 20 0 BEADRP CCCC1(C[NH2+][C@H](C)C2C[NH2+]C2)CCC1 ZINC000422932054 387782160 /nfs/dbraw/zinc/78/21/60/387782160.db2.gz YOXYXJQUAKJVQZ-LLVKDONJSA-N 2 0 210.365 2.154 20 0 BEADRP CC[C@H]([NH2+][C@@H](C)C1C[NH2+]C1)c1cccs1 ZINC000422935793 387782992 /nfs/dbraw/zinc/78/29/92/387782992.db2.gz DRJXLPKKLBUGNK-ONGXEEELSA-N 2 0 224.373 2.397 20 0 BEADRP COc1ccc(C2([NH2+][C@H](C)C[C@H](C)[NH3+])CC2)cc1 ZINC000422934476 387783105 /nfs/dbraw/zinc/78/31/05/387783105.db2.gz JMJOYJBSKHUBDC-NWDGAFQWSA-N 2 0 248.370 2.400 20 0 BEADRP COc1ccc(C[NH2+][C@H](C)C[C@@H](C)[NH3+])cc1F ZINC000422937247 387783551 /nfs/dbraw/zinc/78/35/51/387783551.db2.gz JCLZLVWXNBNFRK-NXEZZACHSA-N 2 0 240.322 2.050 20 0 BEADRP CCC1(CC)[C@H]([NH2+][C@H](C)CCC[NH3+])C[C@H]1OC ZINC000422944785 387785829 /nfs/dbraw/zinc/78/58/29/387785829.db2.gz STPMQFCPGMSFCQ-JHJVBQTASA-N 2 0 242.407 2.297 20 0 BEADRP C[C@@H]([NH2+]CCc1ccc(Cl)s1)C1C[NH2+]C1 ZINC000422944079 387786384 /nfs/dbraw/zinc/78/63/84/387786384.db2.gz RMCGEVDYVNSEAE-MRVPVSSYSA-N 2 0 244.791 2.142 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]C[C@H]1CCc2ccccc21 ZINC000422902101 387787569 /nfs/dbraw/zinc/78/75/69/387787569.db2.gz CXMONUHMHACGSC-TZMCWYRMSA-N 2 0 232.371 2.433 20 0 BEADRP CCC[C@H](C[NH2+]C1CC[NH+](CC)CC1)OCC ZINC000527928512 387793028 /nfs/dbraw/zinc/79/30/28/387793028.db2.gz FRBFTPGMLPKYOV-CQSZACIVSA-N 2 0 242.407 2.266 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H]2CCC[C@H]2C[NH3+])cc1 ZINC000422983812 387793911 /nfs/dbraw/zinc/79/39/11/387793911.db2.gz VDCNUTOGDNGUQD-LSDHHAIUSA-N 2 0 232.371 2.255 20 0 BEADRP C[C@H]([NH2+]CCN1CC[C@H](C)C1)C1CCCC1 ZINC000309506225 387813023 /nfs/dbraw/zinc/81/30/23/387813023.db2.gz VZBOYDTZHKNVSZ-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+][C@@H]1CC=CCC1 ZINC000422986710 387795829 /nfs/dbraw/zinc/79/58/29/387795829.db2.gz HENDSFOIGIUVQS-JHJVBQTASA-N 2 0 208.349 2.073 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CCC[C@@H]1CCCC[C@H]1O ZINC000422988943 387797326 /nfs/dbraw/zinc/79/73/26/387797326.db2.gz JYCSKAKYMGBRES-HZSPNIEDSA-N 2 0 242.407 2.035 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CCC[C@@H]1CCCC[C@@H]1O ZINC000422988946 387798334 /nfs/dbraw/zinc/79/83/34/387798334.db2.gz JYCSKAKYMGBRES-RDBSUJKOSA-N 2 0 242.407 2.035 20 0 BEADRP [NH3+][C@H]1CCCCC[C@H]1[NH2+]CCc1ccc(O)cc1 ZINC000422990782 387799847 /nfs/dbraw/zinc/79/98/47/387799847.db2.gz NYTZLLBGKBDPKG-LSDHHAIUSA-N 2 0 248.370 2.184 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]1[NH2+]CC1(Cc2ccccc2)CC1 ZINC000422991279 387799898 /nfs/dbraw/zinc/79/98/98/387799898.db2.gz ASQGUNJLCSAEBL-GJZGRUSLSA-N 2 0 244.382 2.479 20 0 BEADRP COCCC1(C[NH2+][C@H]2CCCCC[C@H]2[NH3+])CC1 ZINC000422992854 387800012 /nfs/dbraw/zinc/80/00/12/387800012.db2.gz RSRQYMMRIAOVFC-OLZOCXBDSA-N 2 0 240.391 2.053 20 0 BEADRP COCCC1(C[NH2+][C@@H]2CCCCC[C@H]2[NH3+])CC1 ZINC000422992853 387800975 /nfs/dbraw/zinc/80/09/75/387800975.db2.gz RSRQYMMRIAOVFC-CHWSQXEVSA-N 2 0 240.391 2.053 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]CCCc1ccccn1 ZINC000422994482 387801637 /nfs/dbraw/zinc/80/16/37/387801637.db2.gz HVWWTTNLNQOXOJ-DZGCQCFKSA-N 2 0 247.386 2.121 20 0 BEADRP CC[C@@H]([NH2+][C@@H]1CC=CCC1)[C@@H]1CCC[NH2+]1 ZINC000422997683 387803393 /nfs/dbraw/zinc/80/33/93/387803393.db2.gz VHFJSTCRFOQMQE-UPJWGTAASA-N 2 0 208.349 2.215 20 0 BEADRP COc1cc(C)cc(C[NH2+][C@@H](C)C[C@@H](C)[NH3+])c1 ZINC000423001626 387805256 /nfs/dbraw/zinc/80/52/56/387805256.db2.gz IFLVWLNMDFMNES-NEPJUHHUSA-N 2 0 236.359 2.219 20 0 BEADRP CC1CC([NH2+]C[C@@H]2CCN2C2CCCC2)C1 ZINC000527999175 387805412 /nfs/dbraw/zinc/80/54/12/387805412.db2.gz FPEUGFHGJPFLIQ-YIZWMMSDSA-N 2 0 222.376 2.391 20 0 BEADRP COc1cccc(CCC[NH2+][C@@H]2CCC[C@H]2[NH3+])c1 ZINC000422949483 387806693 /nfs/dbraw/zinc/80/66/93/387806693.db2.gz VGFBBEZNNWKGEH-HUUCEWRRSA-N 2 0 248.370 2.097 20 0 BEADRP COc1cccc(C2([NH2+][C@@H](C)C[C@@H](C)[NH3+])CC2)c1 ZINC000422951900 387806815 /nfs/dbraw/zinc/80/68/15/387806815.db2.gz ARXFJVKUHOEMOB-NEPJUHHUSA-N 2 0 248.370 2.400 20 0 BEADRP C[C@H]1CC[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)CC1 ZINC000422951814 387806855 /nfs/dbraw/zinc/80/68/55/387806855.db2.gz AFTUZZYUXFPOJO-JZSPREIISA-N 2 0 222.376 2.438 20 0 BEADRP CCC[C@H](CCO)C[NH2+][C@@H]1CCCCC[C@@H]1[NH3+] ZINC000423002331 387807556 /nfs/dbraw/zinc/80/75/56/387807556.db2.gz FUZZHUVITLFZLZ-HZSPNIEDSA-N 2 0 242.407 2.035 20 0 BEADRP CC[C@H]([NH2+]C[C@H]1CC1(C)C)[C@@H]1CCC[NH2+]1 ZINC000422954598 387809348 /nfs/dbraw/zinc/80/93/48/387809348.db2.gz JGGUCRXLEQXDSP-WOPDTQHZSA-N 2 0 210.365 2.153 20 0 BEADRP COC[C@@H]([NH2+][C@@H](C)CCC[NH3+])c1ccccc1 ZINC000422956673 387810423 /nfs/dbraw/zinc/81/04/23/387810423.db2.gz QDXBSYQYOAOUNM-GXTWGEPZSA-N 2 0 236.359 2.091 20 0 BEADRP Cc1ccc2c(c1C)OC[C@@H]2[NH2+][C@H](C)CCC[NH3+] ZINC000422958322 387811031 /nfs/dbraw/zinc/81/10/31/387811031.db2.gz PGRSCUQPZKJGAN-RISCZKNCSA-N 2 0 248.370 2.454 20 0 BEADRP C[C@@H](CCc1ccco1)[NH2+][C@@H](C)[C@H]1CCC[NH2+]1 ZINC000422961984 387811663 /nfs/dbraw/zinc/81/16/63/387811663.db2.gz DRRIMISLMSPQNS-SGMGOOAPSA-N 2 0 236.359 2.331 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](C)[C@@H]2CC23CC3)C1 ZINC000527855958 387758003 /nfs/dbraw/zinc/75/80/03/387758003.db2.gz XKJUXRAHAQPYRP-MCIONIFRSA-N 2 0 236.403 2.497 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]C1CCC1 ZINC000422959097 387811812 /nfs/dbraw/zinc/81/18/12/387811812.db2.gz QQOANXAMAUJHSJ-SECBINFHSA-N 2 0 219.332 2.052 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CC=CCC1)[C@@H]1CCC[NH2+]1 ZINC000422972549 387821254 /nfs/dbraw/zinc/82/12/54/387821254.db2.gz MCRKSBSPNHELHB-AGIUHOORSA-N 2 0 208.349 2.073 20 0 BEADRP C[C@H]([NH2+]CC(C)(C)C1CCCC1)C1C[NH2+]C1 ZINC000423004706 387827211 /nfs/dbraw/zinc/82/72/11/387827211.db2.gz PUMQKZXDROWBES-NSHDSACASA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@H](CCO)C1CCCCC1 ZINC000423007810 387830825 /nfs/dbraw/zinc/83/08/25/387830825.db2.gz RTEQIWBTLPITRT-OUCADQQQSA-N 2 0 242.407 2.033 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H](CCO)C1CCCCC1 ZINC000423007809 387830975 /nfs/dbraw/zinc/83/09/75/387830975.db2.gz RTEQIWBTLPITRT-OBJOEFQTSA-N 2 0 242.407 2.033 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CC1(C2CC2)CCC1 ZINC000423008230 387831274 /nfs/dbraw/zinc/83/12/74/387831274.db2.gz ZLFBRUZMVDURIG-MNOVXSKESA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+][C@@H](C)[C@H]1CCC[NH2+]C1 ZINC000423008702 387831677 /nfs/dbraw/zinc/83/16/77/387831677.db2.gz UDEMXTDHNINPCA-DYEKYZERSA-N 2 0 236.359 2.188 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@@H](CCO)C1CCCCC1 ZINC000423007811 387831717 /nfs/dbraw/zinc/83/17/17/387831717.db2.gz RTEQIWBTLPITRT-SCRDCRAPSA-N 2 0 242.407 2.033 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+][C@H](C)[C@@H]1CCC[NH2+]C1 ZINC000423008704 387832252 /nfs/dbraw/zinc/83/22/52/387832252.db2.gz UDEMXTDHNINPCA-YRGRVCCFSA-N 2 0 236.359 2.188 20 0 BEADRP Cc1ccc(CC[N@H+]2C[C@H](C[NH3+])C[C@H]2C)cc1 ZINC000442763709 387833797 /nfs/dbraw/zinc/83/37/97/387833797.db2.gz JBIZKZFUJNSJKW-HIFRSBDPSA-N 2 0 232.371 2.207 20 0 BEADRP CC(C)CSCCC[NH2+][C@H](C)[C@H]1CCC[NH2+]1 ZINC000423009816 387833917 /nfs/dbraw/zinc/83/39/17/387833917.db2.gz DZQOTFQJIBAXRQ-CHWSQXEVSA-N 2 0 244.448 2.496 20 0 BEADRP Cc1cnccc1CC[NH2+]C1CCC(C[NH3+])CC1 ZINC000423014039 387837043 /nfs/dbraw/zinc/83/70/43/387837043.db2.gz NXLYUOVSLDQSBQ-UHFFFAOYSA-N 2 0 247.386 2.040 20 0 BEADRP COc1cc(F)cc(C[NH2+][C@H](C)C[C@H](C)[NH3+])c1 ZINC000423015674 387838017 /nfs/dbraw/zinc/83/80/17/387838017.db2.gz LDYZBIUTJYEXMB-VHSXEESVSA-N 2 0 240.322 2.050 20 0 BEADRP Cc1ccsc1CC[NH2+][C@@H](C)C[C@@H](C)[NH3+] ZINC000423014950 387838207 /nfs/dbraw/zinc/83/82/07/387838207.db2.gz JPAIKTYFRSYIRM-MNOVXSKESA-N 2 0 226.389 2.314 20 0 BEADRP C[C@@H]1C[C@@H](C[NH3+])C[N@@H+]1[C@@H]1CCc2ccc(F)cc21 ZINC000442779846 387839933 /nfs/dbraw/zinc/83/99/33/387839933.db2.gz JQVCJFMBVCIOKL-JRPNMDOOSA-N 2 0 248.345 2.482 20 0 BEADRP CC(C)[C@@H]([NH3+])CC[N@H+](C)Cc1ccccc1 ZINC000058058260 387840338 /nfs/dbraw/zinc/84/03/38/387840338.db2.gz HGULBZJMCQKVRU-AWEZNQCLSA-N 2 0 220.360 2.492 20 0 BEADRP CC[C@H]([NH2+][C@@H](C)CCCC[NH3+])[C@H]1CCCO1 ZINC000423017570 387840413 /nfs/dbraw/zinc/84/04/13/387840413.db2.gz WQWNLAIHLVEREJ-RWMBFGLXSA-N 2 0 228.380 2.051 20 0 BEADRP Cc1cnc([C@H](C)C[NH2+][C@H]2CCC[C@@H]2[NH3+])s1 ZINC000423031793 387845837 /nfs/dbraw/zinc/84/58/37/387845837.db2.gz DQTBHZQJOVIAQO-MIMYLULJSA-N 2 0 239.388 2.024 20 0 BEADRP Cc1ccc([C@H](C)[NH2+][C@@H]2CC23CC[NH2+]CC3)o1 ZINC000643533744 387848787 /nfs/dbraw/zinc/84/87/87/387848787.db2.gz CPKZAQMNLLKCKO-WCQYABFASA-N 2 0 234.343 2.381 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@@H]2CCC[C@@H]2[NH3+])C[C@H]1C ZINC000423033768 387849117 /nfs/dbraw/zinc/84/91/17/387849117.db2.gz GVVMRKSATKDHTQ-NAWOPXAZSA-N 2 0 210.365 2.281 20 0 BEADRP CC(C)OCCCC[NH2+]C1CCC(C[NH3+])CC1 ZINC000423032729 387849316 /nfs/dbraw/zinc/84/93/16/387849316.db2.gz NBBBPKVAOFUAEE-UHFFFAOYSA-N 2 0 242.407 2.299 20 0 BEADRP CS[C@H](C[NH2+][C@H]1CCC[C@@H]1[NH3+])C(C)(C)C ZINC000423031920 387849354 /nfs/dbraw/zinc/84/93/54/387849354.db2.gz LQTSCSQGIJZZAO-GARJFASQSA-N 2 0 230.421 2.234 20 0 BEADRP Cc1cc(C[NH+](C)C)cc(N[C@H](C)C2C[NH2+]C2)c1 ZINC000423035030 387850765 /nfs/dbraw/zinc/85/07/65/387850765.db2.gz YHHPGQNAIZBNJQ-GFCCVEGCSA-N 2 0 247.386 2.076 20 0 BEADRP COCC[C@H]([NH2+][C@@H](C)C[C@@H](C)[NH3+])c1ccco1 ZINC000423036353 387851207 /nfs/dbraw/zinc/85/12/07/387851207.db2.gz ANHGZSNAPWATAD-WOPDTQHZSA-N 2 0 240.347 2.073 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CCC[C@H]1CCCCO1 ZINC000423035477 387851370 /nfs/dbraw/zinc/85/13/70/387851370.db2.gz JOCURWWEOUFBHA-YNEHKIRRSA-N 2 0 228.380 2.051 20 0 BEADRP CC[C@@H]([NH2+]C[C@H]1CCCCS1)[C@@H]1CCC[NH2+]1 ZINC000423036427 387851413 /nfs/dbraw/zinc/85/14/13/387851413.db2.gz UAAPQRJVKWAGKM-UPJWGTAASA-N 2 0 242.432 2.392 20 0 BEADRP COCC[C@H]([NH2+][C@H](C)C[C@H](C)[NH3+])c1ccco1 ZINC000423036351 387851729 /nfs/dbraw/zinc/85/17/29/387851729.db2.gz ANHGZSNAPWATAD-TUAOUCFPSA-N 2 0 240.347 2.073 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CC[C@@H]1CCO[C@H](C)C1 ZINC000423038976 387852505 /nfs/dbraw/zinc/85/25/05/387852505.db2.gz ZKDIGCRTWLNLFW-MGPQQGTHSA-N 2 0 242.407 2.299 20 0 BEADRP COC1CCC(CC[NH2+][C@@H]2CCC[C@H]2[NH3+])CC1 ZINC000423039516 387853265 /nfs/dbraw/zinc/85/32/65/387853265.db2.gz QORPWIHMWBKOFR-NWINJMCUSA-N 2 0 240.391 2.051 20 0 BEADRP CC[C@@H]([NH2+]C1Cc2ccccc2C1)[C@@H]1CCC[NH2+]1 ZINC000423040350 387854176 /nfs/dbraw/zinc/85/41/76/387854176.db2.gz TZOGLRNSOMLLBC-CVEARBPZSA-N 2 0 244.382 2.274 20 0 BEADRP CC[C@H](CC(F)(F)F)[NH2+][C@H](C)C[C@@H](C)[NH3+] ZINC000423041248 387855656 /nfs/dbraw/zinc/85/56/56/387855656.db2.gz WQYKMTHLFRJYJD-IWSPIJDZSA-N 2 0 226.286 2.433 20 0 BEADRP CSCCCCC[NH2+][C@H]1CC[NH2+]CC[C@@H]1C ZINC000423049926 387859950 /nfs/dbraw/zinc/85/99/50/387859950.db2.gz KIIRTQPLWKBNDS-STQMWFEESA-N 2 0 244.448 2.497 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@@H]1CCC12CCCC2 ZINC000423073261 387874592 /nfs/dbraw/zinc/87/45/92/387874592.db2.gz IICBVBKIZXCZIA-NWDGAFQWSA-N 2 0 210.365 2.426 20 0 BEADRP CC(C)[C@H](CC(F)(F)F)[NH2+][C@H](C)C1C[NH2+]C1 ZINC000423059050 387865466 /nfs/dbraw/zinc/86/54/66/387865466.db2.gz KUYVBRBDQYZXGB-SCZZXKLOSA-N 2 0 238.297 2.161 20 0 BEADRP CC(C)=CCC[NH2+][C@@H]1CC[NH2+]CC[C@@H]1C ZINC000423066914 387869875 /nfs/dbraw/zinc/86/98/75/387869875.db2.gz FTSLAXKYVZFREE-QWHCGFSZSA-N 2 0 210.365 2.320 20 0 BEADRP CC(C)C1CC([NH2+][C@@H]2CCC[C@H]2C[NH3+])C1 ZINC000423067848 387870421 /nfs/dbraw/zinc/87/04/21/387870421.db2.gz AHQREBRYQCPVSP-YWPUVAFDSA-N 2 0 210.365 2.138 20 0 BEADRP Cc1c[nH+]ccc1NC[C@@H]1CC[N@@H+]1C1CCCC1 ZINC000528207094 387870992 /nfs/dbraw/zinc/87/09/92/387870992.db2.gz AAQSZEIOENEDBM-AWEZNQCLSA-N 2 0 245.370 2.241 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]Cc1ccc2c(n1)CCCC2 ZINC000423072055 387871636 /nfs/dbraw/zinc/87/16/36/387871636.db2.gz GOBLCTOFBYJIAP-VXGBXAGGSA-N 2 0 247.386 2.176 20 0 BEADRP CC[C@@H]([NH2+]CCCC(F)(F)F)[C@@H]1CCC[NH2+]1 ZINC000422964302 387814763 /nfs/dbraw/zinc/81/47/63/387814763.db2.gz IFOGIGILMRDHFV-ZJUUUORDSA-N 2 0 238.297 2.449 20 0 BEADRP C[C@H]([NH3+])C[NH2+]C(C)(C)CCc1ccccc1 ZINC000442667509 387818557 /nfs/dbraw/zinc/81/85/57/387818557.db2.gz XSASVCKKCBLPMB-LBPRGKRZSA-N 2 0 220.360 2.335 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+]CCCC(F)(F)F ZINC000422968431 387818608 /nfs/dbraw/zinc/81/86/08/387818608.db2.gz QSUULEAQMAIMSV-VHSXEESVSA-N 2 0 238.297 2.307 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+]CCC1(F)CCC1 ZINC000423103007 387889819 /nfs/dbraw/zinc/88/98/19/387889819.db2.gz FWRRGSRNMJPVPV-RYUDHWBXSA-N 2 0 228.355 2.246 20 0 BEADRP C[C@@H]1CC(CC[NH2+][C@@H]2CCC[C@H]2[NH3+])C[C@@H](C)O1 ZINC000423106836 387890772 /nfs/dbraw/zinc/89/07/72/387890772.db2.gz DLVCCCPPJLKORV-HBJVGIJOSA-N 2 0 240.391 2.050 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H](C)c1ccc2n[nH]cc2c1 ZINC000423104918 387892000 /nfs/dbraw/zinc/89/20/00/387892000.db2.gz HNMQYZUFCMZZLG-GHMZBOCLSA-N 2 0 246.358 2.341 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC1(C)C)[C@@H]1CCC[NH2+]C1 ZINC000423110191 387893294 /nfs/dbraw/zinc/89/32/94/387893294.db2.gz OTBOSISQXQQYRC-TUAOUCFPSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CC1(C(F)(F)F)CCC1 ZINC000423111662 387893399 /nfs/dbraw/zinc/89/33/99/387893399.db2.gz RABOSKXSZDCJKM-BDAKNGLRSA-N 2 0 238.297 2.434 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)C[C@H](C)[NH3+])c1ccc2n[nH]cc2c1 ZINC000423108688 387893477 /nfs/dbraw/zinc/89/34/77/387893477.db2.gz MNTUIIYWLNJULP-GARJFASQSA-N 2 0 246.358 2.339 20 0 BEADRP COCC1(C[NH2+][C@H]2CCCCC[C@@H]2[NH3+])CCC1 ZINC000423110673 387893589 /nfs/dbraw/zinc/89/35/89/387893589.db2.gz IGLPQMJBCVOMIC-STQMWFEESA-N 2 0 240.391 2.053 20 0 BEADRP C[C@H]([NH2+]C1CC(C)(c2ccccc2)C1)C1C[NH2+]C1 ZINC000423114815 387895346 /nfs/dbraw/zinc/89/53/46/387895346.db2.gz ZWHYOOPSFFHRNM-JQRITLKVSA-N 2 0 244.382 2.304 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CC1(c2ccccn2)CCC1 ZINC000423113952 387895448 /nfs/dbraw/zinc/89/54/48/387895448.db2.gz VBOSKWWIHQHYPE-CYBMUJFWSA-N 2 0 247.386 2.220 20 0 BEADRP CCSCCC[NH2+][C@H](CC)[C@@H]1CCC[NH2+]1 ZINC000423115071 387896875 /nfs/dbraw/zinc/89/68/75/387896875.db2.gz MRIJEUBMHLXPLM-NEPJUHHUSA-N 2 0 230.421 2.250 20 0 BEADRP COCC[C@@H]([NH2+][C@H]1CCC[NH2+]CC1)C(C)(C)C ZINC000423117234 387897669 /nfs/dbraw/zinc/89/76/69/387897669.db2.gz UIRYAUYCLAEEGZ-QWHCGFSZSA-N 2 0 242.407 2.169 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC12CCCC2)[C@H]1CCC[NH2+]1 ZINC000423075884 387875945 /nfs/dbraw/zinc/87/59/45/387875945.db2.gz PORCEYPISZYIFH-YNEHKIRRSA-N 2 0 222.376 2.439 20 0 BEADRP CC(C)C1CC([NH2+][C@@H](C)[C@H]2CCC[NH2+]C2)C1 ZINC000423077635 387876206 /nfs/dbraw/zinc/87/62/06/387876206.db2.gz MLQRICWFRCOTRN-FEPKRQSRSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@H]([NH2+]Cc1ccc(C2CC2)cc1)C1C[NH2+]C1 ZINC000423081791 387879210 /nfs/dbraw/zinc/87/92/10/387879210.db2.gz VOIHWQLLWSWLJD-NSHDSACASA-N 2 0 230.355 2.262 20 0 BEADRP [NH3+]CCCC[NH2+][C@H]1CCCc2ccc(O)cc21 ZINC000236213411 387879775 /nfs/dbraw/zinc/87/97/75/387879775.db2.gz JLIXVPVIPGHONA-AWEZNQCLSA-N 2 0 234.343 2.098 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@@H](CC)Cc1cccs1 ZINC000643540331 387880699 /nfs/dbraw/zinc/88/06/99/387880699.db2.gz YNBYXVSRFRSLJN-QWRGUYRKSA-N 2 0 226.389 2.396 20 0 BEADRP C[C@H]([NH2+]CCC1(C)CC1)[C@@H]1CCCC[NH2+]1 ZINC000423088363 387880984 /nfs/dbraw/zinc/88/09/84/387880984.db2.gz RRWPZKRVDUDGCK-RYUDHWBXSA-N 2 0 210.365 2.297 20 0 BEADRP COC1CCC(C)(C[NH2+][C@@H]2CCC[C@@H]2[NH3+])CC1 ZINC000423087000 387881193 /nfs/dbraw/zinc/88/11/93/387881193.db2.gz ONHPWSZRAWHEQK-YIFLHPOLSA-N 2 0 240.391 2.051 20 0 BEADRP COC1CCC(C)(C[NH2+][C@@H](C)C[C@H](C)[NH3+])CC1 ZINC000423089825 387882963 /nfs/dbraw/zinc/88/29/63/387882963.db2.gz WDTFONJYSSFSDF-FEPKRQSRSA-N 2 0 242.407 2.297 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H]1CC[C@@H]1C ZINC000423116157 387898571 /nfs/dbraw/zinc/89/85/71/387898571.db2.gz ZRTPHBCBTMPAGT-NURSFMCSSA-N 2 0 233.359 2.298 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]C[C@H]1CCC(F)(F)C1 ZINC000423095820 387884486 /nfs/dbraw/zinc/88/44/86/387884486.db2.gz NBZPZLWTEIQICK-GARJFASQSA-N 2 0 232.318 2.139 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]C[C@H]1CCC(F)(F)C1 ZINC000423093656 387884748 /nfs/dbraw/zinc/88/47/48/387884748.db2.gz IIYFSFTZUGKOFW-GRYCIOLGSA-N 2 0 246.345 2.400 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]C[C@H]1CCC(F)(F)C1 ZINC000423095196 387885213 /nfs/dbraw/zinc/88/52/13/387885213.db2.gz LPGRFRWWFNRXKY-ZJUUUORDSA-N 2 0 220.307 2.139 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CCC(F)(F)C1)[C@@H]1CCC[NH2+]1 ZINC000423095214 387885407 /nfs/dbraw/zinc/88/54/07/387885407.db2.gz LQGHJTMTNXFDSL-MXWKQRLJSA-N 2 0 232.318 2.152 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CCC(F)(F)C1)[C@H]1CCC[NH2+]1 ZINC000423095215 387886092 /nfs/dbraw/zinc/88/60/92/387886092.db2.gz LQGHJTMTNXFDSL-OUAUKWLOSA-N 2 0 232.318 2.152 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[N@@H+]1CCC[C@]2(CCSC2)C1 ZINC000423163724 387898671 /nfs/dbraw/zinc/89/86/71/387898671.db2.gz RNTWLLBWAVDEEM-XQQFMLRXSA-N 2 0 242.432 2.331 20 0 BEADRP COCC[C@H]([NH2+][C@@H](C)C[C@@H](C)[NH3+])C(C)(C)C ZINC000423116778 387898702 /nfs/dbraw/zinc/89/87/02/387898702.db2.gz RLSNJDIKOVNTKM-WOPDTQHZSA-N 2 0 230.396 2.153 20 0 BEADRP Cc1cccc(CCC[NH2+][C@@H]2CCC[C@H]2C[NH3+])n1 ZINC000423100153 387886893 /nfs/dbraw/zinc/88/68/93/387886893.db2.gz GJVIGPILYRZDQH-DZGCQCFKSA-N 2 0 247.386 2.040 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CC1C(C)(C)C1(C)C ZINC000423098911 387887040 /nfs/dbraw/zinc/88/70/40/387887040.db2.gz SXYGHVGSWXHETB-ZJUUUORDSA-N 2 0 212.381 2.384 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1CC[C@H]1C1CC1 ZINC000423100690 387887095 /nfs/dbraw/zinc/88/70/95/387887095.db2.gz VLVSMBZODSOLRI-KGYLQXTDSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]CCCc1ccccc1F ZINC000423097891 387887285 /nfs/dbraw/zinc/88/72/85/387887285.db2.gz RIUUFAXDKIRNCA-ZIAGYGMSSA-N 2 0 236.334 2.228 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]CCC1CC(F)(F)C1 ZINC000423163809 387917988 /nfs/dbraw/zinc/91/79/88/387917988.db2.gz NLXQBXBTRLBQGZ-VIFPVBQESA-N 2 0 220.307 2.139 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+]C1CC(C(C)(C)C)C1 ZINC000423140677 387918963 /nfs/dbraw/zinc/91/89/63/387918963.db2.gz ZCSGOHXCYLUTJK-OTTFEQOBSA-N 2 0 242.407 2.155 20 0 BEADRP CO[C@H](C)[C@@H](C)[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000423141117 387919050 /nfs/dbraw/zinc/91/90/50/387919050.db2.gz OANSKVKGXCEOGC-XYHOJCAOSA-N 2 0 234.343 2.144 20 0 BEADRP FC(F)(F)C1(C[NH2+]C2CC[NH2+]CC2)CCC1 ZINC000423115950 387899157 /nfs/dbraw/zinc/89/91/57/387899157.db2.gz ZDVKKQNJYYAAMA-UHFFFAOYSA-N 2 0 236.281 2.061 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+]CCC1(F)CCC1 ZINC000423125153 387903716 /nfs/dbraw/zinc/90/37/16/387903716.db2.gz NBIMOAVRAJJYFT-VXGBXAGGSA-N 2 0 228.355 2.376 20 0 BEADRP CO[C@H](C)[C@@H](C)[NH2+][C@@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000423125610 387905672 /nfs/dbraw/zinc/90/56/72/387905672.db2.gz AKZUMSHHSGBLFG-DGAVXFQQSA-N 2 0 242.407 2.310 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCCCC(F)(F)C1)C1C[NH2+]C1 ZINC000423130117 387906827 /nfs/dbraw/zinc/90/68/27/387906827.db2.gz MJDTVFHCZXTLHI-QWRGUYRKSA-N 2 0 246.345 2.400 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CCCCC(F)(F)C1)C1C[NH2+]C1 ZINC000423130115 387907130 /nfs/dbraw/zinc/90/71/30/387907130.db2.gz MJDTVFHCZXTLHI-GHMZBOCLSA-N 2 0 246.345 2.400 20 0 BEADRP F[C@@H]1CC[C@H]([NH2+][C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)C1 ZINC000423128851 387908210 /nfs/dbraw/zinc/90/82/10/387908210.db2.gz QPHLZRDGNNHDBT-XVIXHAIJSA-N 2 0 240.366 2.387 20 0 BEADRP C[C@H]([NH2+]CC1CC(C)(C)C1)[C@H]1CCC[NH2+]1 ZINC000514667671 387909536 /nfs/dbraw/zinc/90/95/36/387909536.db2.gz KFTBCMQUZHCAGH-CMPLNLGQSA-N 2 0 210.365 2.153 20 0 BEADRP CC1(C)CCC[C@@H]1C[NH2+][C@@H]1CCC[C@@H]1[NH3+] ZINC000423132613 387909571 /nfs/dbraw/zinc/90/95/71/387909571.db2.gz JNGZILODCCSARW-GRYCIOLGSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H](F)CC[NH2+][C@@H]1CCC[C@H]1[C@H]1CCC[NH2+]1 ZINC000423131225 387909758 /nfs/dbraw/zinc/90/97/58/387909758.db2.gz HPGTUZIDSNVGTE-UMSGYPCISA-N 2 0 228.355 2.245 20 0 BEADRP Cc1cccnc1C(C)(C)C[NH2+][C@H](C)C[C@H](C)[NH3+] ZINC000423132743 387909999 /nfs/dbraw/zinc/90/99/99/387909999.db2.gz CCTUIOLCBUFHHX-QWHCGFSZSA-N 2 0 249.402 2.383 20 0 BEADRP C=Cc1ccc(CC[NH2+][C@H]2CCC[C@@H]2[NH3+])cc1 ZINC000423134691 387911896 /nfs/dbraw/zinc/91/18/96/387911896.db2.gz DXSFYMRHJIWMLC-GJZGRUSLSA-N 2 0 230.355 2.342 20 0 BEADRP COCC1(C[NH2+][C@H](C)CCC[NH3+])CCCCC1 ZINC000423134244 387911936 /nfs/dbraw/zinc/91/19/36/387911936.db2.gz DUFLTUIOXYPBSJ-CYBMUJFWSA-N 2 0 242.407 2.300 20 0 BEADRP Cc1ccc(F)c(CC[NH2+][C@@H]2CCC[C@@H]2[NH3+])c1 ZINC000423151386 387929488 /nfs/dbraw/zinc/92/94/88/387929488.db2.gz KCFFJHVMPJMJOC-UONOGXRCSA-N 2 0 236.334 2.146 20 0 BEADRP Cc1cccnc1CC[NH2+][C@H]1CCCCC[C@H]1[NH3+] ZINC000423151967 387929696 /nfs/dbraw/zinc/92/96/96/387929696.db2.gz LAJIHAIZTSXXRZ-HIFRSBDPSA-N 2 0 247.386 2.182 20 0 BEADRP CC[C@@H]1CCC[C@@H]1C[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000423151855 387929986 /nfs/dbraw/zinc/92/99/86/387929986.db2.gz CZZSZLWGRCNWHX-QJPTWQEYSA-N 2 0 210.365 2.010 20 0 BEADRP CC(C)[C@@H]1C[C@H]1C[NH2+][C@@H]1CC[NH2+]CC[C@H]1C ZINC000423154339 387931302 /nfs/dbraw/zinc/93/13/02/387931302.db2.gz OQVVGVQHJPVQDZ-ZOBORPQBSA-N 2 0 224.392 2.256 20 0 BEADRP Fc1ccc(CC2([NH2+]C3CC[NH2+]CC3)CC2)cc1 ZINC000423154826 387934935 /nfs/dbraw/zinc/93/49/35/387934935.db2.gz KBCACKCZCXRQBE-UHFFFAOYSA-N 2 0 248.345 2.242 20 0 BEADRP C[C@H](CC(C)(C)C)[NH2+][C@@H]1CCOC[C@H]1[C@@H](C)[NH3+] ZINC000423157652 387936021 /nfs/dbraw/zinc/93/60/21/387936021.db2.gz BKNZWJQKWIZFAK-FVCCEPFGSA-N 2 0 242.407 2.153 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C[C@H]2CC=CCC2)CC[N@@H+]1C ZINC000156121370 387920702 /nfs/dbraw/zinc/92/07/02/387920702.db2.gz MZSIJNWCHHIZIM-RDBSUJKOSA-N 2 0 222.376 2.415 20 0 BEADRP CCC[C@H](C[NH2+][C@H]1CCCCC[C@@H]1[NH3+])OC ZINC000423144610 387921244 /nfs/dbraw/zinc/92/12/44/387921244.db2.gz HNAXCDXNLUJMLK-AGIUHOORSA-N 2 0 228.380 2.051 20 0 BEADRP Cc1cccnc1CCC[NH2+][C@H](C)CCCC[NH3+] ZINC000423146898 387924593 /nfs/dbraw/zinc/92/45/93/387924593.db2.gz BQEJSBBLZJNNQE-CQSZACIVSA-N 2 0 249.402 2.430 20 0 BEADRP CC(C)C[C@@H]1C[C@H]1[NH2+][C@H]1CCC[C@H]1C[NH3+] ZINC000423169742 387954135 /nfs/dbraw/zinc/95/41/35/387954135.db2.gz KJJMILUNTKEYAG-QNWHQSFQSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CC(C)(C)C1(O)CCCC1 ZINC000423168909 387954832 /nfs/dbraw/zinc/95/48/32/387954832.db2.gz VIMUDMMBQGYZLQ-RYUDHWBXSA-N 2 0 242.407 2.033 20 0 BEADRP Cc1ccc(C[NH2+]C2CCC(C[NH3+])CC2)nc1C ZINC000423169980 387955752 /nfs/dbraw/zinc/95/57/52/387955752.db2.gz KUERIQNRORFDIS-UHFFFAOYSA-N 2 0 247.386 2.306 20 0 BEADRP CSCC1CCC([NH2+][C@H]2CCC[C@H]2[NH3+])CC1 ZINC000423159125 387937973 /nfs/dbraw/zinc/93/79/73/387937973.db2.gz OUZWIPLWZCPOFS-TUUUFIMRSA-N 2 0 242.432 2.378 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)C1(C)CC1 ZINC000044533952 387938116 /nfs/dbraw/zinc/93/81/16/387938116.db2.gz HQTBDDFTVQZHTD-NWDGAFQWSA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)C[C@H](C)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000044535012 387938972 /nfs/dbraw/zinc/93/89/72/387938972.db2.gz PFZADHSVZZJEMN-QWHCGFSZSA-N 2 0 212.381 2.352 20 0 BEADRP CC[C@@H]1CCCC[C@@H]1C[NH2+][C@H](C)C1C[NH2+]C1 ZINC000423160373 387941105 /nfs/dbraw/zinc/94/11/05/387941105.db2.gz QRYRLCZNIMGSNO-JHJVBQTASA-N 2 0 224.392 2.400 20 0 BEADRP Cc1ccc(CC[NH2+][C@H]2CCCCC[C@H]2[NH3+])nc1 ZINC000423160969 387941516 /nfs/dbraw/zinc/94/15/16/387941516.db2.gz IFKVNZSMZPRDKY-CABCVRRESA-N 2 0 247.386 2.182 20 0 BEADRP CC(C)O[C@H]1C[C@@H]([NH2+][C@@H](C)CCCC[NH3+])C1 ZINC000423163552 387945094 /nfs/dbraw/zinc/94/50/94/387945094.db2.gz MROUWFRVMVVOBR-RWMBFGLXSA-N 2 0 228.380 2.050 20 0 BEADRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]CCC1CC(F)(F)C1 ZINC000423164136 387946752 /nfs/dbraw/zinc/94/67/52/387946752.db2.gz OBTYGBBOWUCXMG-GHMZBOCLSA-N 2 0 232.318 2.139 20 0 BEADRP CC(C)O[C@H]1C[C@@H]([NH2+][C@H](C)CCCC[NH3+])C1 ZINC000423163553 387946821 /nfs/dbraw/zinc/94/68/21/387946821.db2.gz MROUWFRVMVVOBR-UPJWGTAASA-N 2 0 228.380 2.050 20 0 BEADRP C[C@H](CCCC[NH3+])[N@@H+]1CCC[C@@]2(CCOC2)C1 ZINC000423164814 387947240 /nfs/dbraw/zinc/94/72/40/387947240.db2.gz SWPKWSCJPLBVBM-ZIAGYGMSSA-N 2 0 240.391 2.006 20 0 BEADRP CCC[C@H]([NH2+][C@@H](C)C1C[NH2+]C1)C(C)(C)C ZINC000423164625 387948212 /nfs/dbraw/zinc/94/82/12/387948212.db2.gz XGUKXFFGNJBZKZ-JQWIXIFHSA-N 2 0 212.381 2.399 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+][C@@H](C)CCC=C(C)C ZINC000423165033 387948383 /nfs/dbraw/zinc/94/83/83/387948383.db2.gz XPOQJJOKYLIBKC-KBPBESRZSA-N 2 0 242.407 2.465 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]1[NH2+]CC1(C2CCC2)CCC1 ZINC000423164443 387948832 /nfs/dbraw/zinc/94/88/32/387948832.db2.gz OQWCZHBKBUPTIA-STQMWFEESA-N 2 0 222.376 2.426 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CCC1CC(F)(F)C1 ZINC000423166178 387949779 /nfs/dbraw/zinc/94/97/79/387949779.db2.gz QUMGSJWFUBCCJZ-BDAKNGLRSA-N 2 0 220.307 2.137 20 0 BEADRP [NH3+]CC1CCC([NH2+]C[C@@H]2C[C@H]2C2CC2)CC1 ZINC000423166237 387950194 /nfs/dbraw/zinc/95/01/94/387950194.db2.gz RAEQVWWFHFHVEV-YSOMNSGWSA-N 2 0 222.376 2.140 20 0 BEADRP CC[C@@H]1OCC[C@H]1[NH2+][C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000423166482 387950559 /nfs/dbraw/zinc/95/05/59/387950559.db2.gz CSVKKRJCNDOKLI-XGUBFFRZSA-N 2 0 246.354 2.288 20 0 BEADRP CC[C@H]([NH2+]C[C@H](C)C[NH+](C)C)[C@H]1C[C@@H]1C ZINC000321136875 387951185 /nfs/dbraw/zinc/95/11/85/387951185.db2.gz UOZJOBLZKFHOBI-CYDGBPFRSA-N 2 0 212.381 2.208 20 0 BEADRP CC(C)C[C@@H]1C[C@H]1[NH2+][C@@H](C)[C@H]1CCC[NH2+]1 ZINC000423167755 387951673 /nfs/dbraw/zinc/95/16/73/387951673.db2.gz FUKSZYKCTHTFNF-UMSGYPCISA-N 2 0 210.365 2.151 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@@H]1C[C@H]1c1ccccc1F ZINC000423172655 387959618 /nfs/dbraw/zinc/95/96/18/387959618.db2.gz UOQSJUMKBOGFFN-VHRBIJSZSA-N 2 0 236.334 2.399 20 0 BEADRP CC(C)[C@H](C)C[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000156369681 387962929 /nfs/dbraw/zinc/96/29/29/387962929.db2.gz YKSVDSMVMMQRMJ-AGIUHOORSA-N 2 0 212.381 2.351 20 0 BEADRP CC[C@H]([NH2+]CC1([NH3+])CCCCC1)[C@H]1CCOC1 ZINC000423178139 387964139 /nfs/dbraw/zinc/96/41/39/387964139.db2.gz KGOJAMQWGIYEJO-STQMWFEESA-N 2 0 240.391 2.053 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+][C@@H]1CCCC[C@H]1F ZINC000423180887 387968483 /nfs/dbraw/zinc/96/84/83/387968483.db2.gz KQSVPWGASAJAKJ-UMSGYPCISA-N 2 0 228.355 2.374 20 0 BEADRP CCc1nc(C)c([C@H](C)[NH2+]CCC[NH3+])s1 ZINC000423183847 387970036 /nfs/dbraw/zinc/97/00/36/387970036.db2.gz IAGKDKDSHDIXIS-QMMMGPOBSA-N 2 0 227.377 2.013 20 0 BEADRP C[C@@H]1C[C@H](C[NH2+][C@@H]2CCCCC[C@H]2[NH3+])[C@H](C)O1 ZINC000423183600 387970341 /nfs/dbraw/zinc/97/03/41/387970341.db2.gz MSDBSSKNCFJJES-XVIXHAIJSA-N 2 0 240.391 2.050 20 0 BEADRP C[C@H]([NH2+]CC1([NH3+])CCCCC1)[C@@H]1C[C@H]1C ZINC000423187483 387971390 /nfs/dbraw/zinc/97/13/90/387971390.db2.gz XVEVORLFCOQPCG-GRYCIOLGSA-N 2 0 210.365 2.282 20 0 BEADRP CC[C@H]([NH2+]C[C@H]1CC[N@H+](CC)C1)c1ccncc1 ZINC000453067924 387978524 /nfs/dbraw/zinc/97/85/24/387978524.db2.gz SFIQSVDKJLMBDD-HIFRSBDPSA-N 2 0 247.386 2.464 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+][C@@H]1C[C@H]1c1ccco1 ZINC000423194540 387980637 /nfs/dbraw/zinc/98/06/37/387980637.db2.gz WTDLUGGTFVYHKE-FVCCEPFGSA-N 2 0 234.343 2.113 20 0 BEADRP CC(C)(C[NH2+][C@@H]1CCC[C@@H]1C[NH3+])c1cccnc1 ZINC000423196500 387981486 /nfs/dbraw/zinc/98/14/86/387981486.db2.gz ZVVPLCTWUUERAA-TZMCWYRMSA-N 2 0 247.386 2.076 20 0 BEADRP Cc1ccccc1C[C@H]([NH2+]CCC[NH3+])C1CC1 ZINC000423189151 387973042 /nfs/dbraw/zinc/97/30/42/387973042.db2.gz MOXKXCQKWXBVKP-HNNXBMFYSA-N 2 0 232.371 2.255 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CC(C)(C)c1cccnc1 ZINC000423189909 387973450 /nfs/dbraw/zinc/97/34/50/387973450.db2.gz RMIIAMPXRKVELC-RYUDHWBXSA-N 2 0 235.375 2.075 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CC(C)(C)c1cccnc1 ZINC000423189907 387973780 /nfs/dbraw/zinc/97/37/80/387973780.db2.gz RMIIAMPXRKVELC-NEPJUHHUSA-N 2 0 235.375 2.075 20 0 BEADRP FCCC[C@H]1CCC[C@@H]1[NH2+]C1CC[NH2+]CC1 ZINC000423189746 387974650 /nfs/dbraw/zinc/97/46/50/387974650.db2.gz RJDJLUBKTACGKL-YPMHNXCESA-N 2 0 228.355 2.246 20 0 BEADRP CC[C@H]([NH2+]CCC[NH2+]C)c1ccc(F)cc1 ZINC000423190219 387976306 /nfs/dbraw/zinc/97/63/06/387976306.db2.gz QOJARVJMFSSKTE-ZDUSSCGKSA-N 2 0 224.323 2.476 20 0 BEADRP CC(C)[C@H]([NH2+]C1CC[NH2+]CC1)c1cccnc1 ZINC000423190156 387976408 /nfs/dbraw/zinc/97/64/08/387976408.db2.gz RXEVUEPNDKFZAY-AWEZNQCLSA-N 2 0 233.359 2.120 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H](Cc1ccccc1)C1CC1 ZINC000423200789 387987838 /nfs/dbraw/zinc/98/78/38/387987838.db2.gz NFTLGJKFKZNHCJ-HNNXBMFYSA-N 2 0 232.371 2.207 20 0 BEADRP C[NH2+]CCC[NH2+]C(C1CCC1)C1CCC1 ZINC000423200928 387988003 /nfs/dbraw/zinc/98/80/03/387988003.db2.gz NLVVQOVHHQMVGL-UHFFFAOYSA-N 2 0 210.365 2.154 20 0 BEADRP C[NH2+]CCC[NH2+][C@H](C)[C@@H]1CCCC[C@@H]1C ZINC000423201887 387988435 /nfs/dbraw/zinc/98/84/35/387988435.db2.gz QDTTVSTUNYNGIA-YNEHKIRRSA-N 2 0 212.381 2.400 20 0 BEADRP C[NH2+]CCC[NH2+][C@H](Cc1ccccc1)C1CC1 ZINC000423200790 387988442 /nfs/dbraw/zinc/98/84/42/387988442.db2.gz NFTLGJKFKZNHCJ-OAHLLOKOSA-N 2 0 232.371 2.207 20 0 BEADRP COCCC[C@@H](C)[NH2+]CC1([NH3+])CCCCCC1 ZINC000423203210 387988860 /nfs/dbraw/zinc/98/88/60/387988860.db2.gz RXYYGXXUGQYIRF-CYBMUJFWSA-N 2 0 242.407 2.443 20 0 BEADRP CC(C)[C@@H]1C[C@@H]([NH2+][C@@H]2CCCC[C@H]2[NH3+])CCO1 ZINC000424364954 387990049 /nfs/dbraw/zinc/99/00/49/387990049.db2.gz FOZANZCAIQVMRL-DGAVXFQQSA-N 2 0 240.391 2.050 20 0 BEADRP C[C@@H](CC1CCOCC1)[NH2+][C@@H]1CCCC[C@H]1[NH3+] ZINC000424366473 387991669 /nfs/dbraw/zinc/99/16/69/387991669.db2.gz IZJKGRKZNPCJFT-IACUBPJLSA-N 2 0 240.391 2.051 20 0 BEADRP CO[C@@H](C)[C@@H](C)[NH2+]CC1([NH3+])CCCCCC1 ZINC000423207686 387994158 /nfs/dbraw/zinc/99/41/58/387994158.db2.gz YEFLYOSHUCXCGT-NEPJUHHUSA-N 2 0 228.380 2.051 20 0 BEADRP FC(F)C1CCC([NH2+]C[C@H]2CCC[NH2+]C2)CC1 ZINC000423210570 387994640 /nfs/dbraw/zinc/99/46/40/387994640.db2.gz JXJQZFCFZPSBEM-UNXYVOJBSA-N 2 0 246.345 2.400 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@@H]2C[C@H]3C[C@H]3C2)[C@@H]2CCC[C@H]21 ZINC000424342178 387982316 /nfs/dbraw/zinc/98/23/16/387982316.db2.gz FJMJYNNHUHLMOT-JLZCTACVSA-N 2 0 234.387 2.247 20 0 BEADRP C[C@H](CCc1c(F)cccc1F)[NH2+]CCC[NH3+] ZINC000423197241 387982391 /nfs/dbraw/zinc/98/23/91/387982391.db2.gz YNQMLSTXLMYZQF-SNVBAGLBSA-N 2 0 242.313 2.224 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@@H]2C[C@H]3C[C@H]3C2)[C@H]2CCC[C@@H]21 ZINC000424342179 387982582 /nfs/dbraw/zinc/98/25/82/387982582.db2.gz FJMJYNNHUHLMOT-QLKXBERHSA-N 2 0 234.387 2.247 20 0 BEADRP Cc1cccnc1[C@@H]1CCC[C@H]([NH2+]CCC[NH3+])C1 ZINC000423196599 387982755 /nfs/dbraw/zinc/98/27/55/387982755.db2.gz VQMSDFHMKOCHNL-KGLIPLIRSA-N 2 0 247.386 2.355 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H](C)c1ccc(C)s1 ZINC000423198805 387983343 /nfs/dbraw/zinc/98/33/43/387983343.db2.gz IAWYRWAADXAONI-JTQLQIEISA-N 2 0 212.362 2.317 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1CCCc2ccc(F)cc21 ZINC000423198156 387983367 /nfs/dbraw/zinc/98/33/67/387983367.db2.gz DKDMRHQHYWZMNX-CQSZACIVSA-N 2 0 236.334 2.402 20 0 BEADRP CCC1(CC)[C@H]([NH2+]CCC[NH2+]C)[C@H](C)[C@@H]1OC ZINC000423197858 387984760 /nfs/dbraw/zinc/98/47/60/387984760.db2.gz BNROEMAKZHRYBN-XQQFMLRXSA-N 2 0 242.407 2.025 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1c2cc(F)ccc2C[C@H]1C ZINC000423198045 387984854 /nfs/dbraw/zinc/98/48/54/387984854.db2.gz CQCSXBIAIGQWPX-YGRLFVJLSA-N 2 0 236.334 2.258 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H](CCC(C)C)C1CC1 ZINC000423200398 387985667 /nfs/dbraw/zinc/98/56/67/387985667.db2.gz MDVAJUKAVDMYQJ-ZDUSSCGKSA-N 2 0 212.381 2.400 20 0 BEADRP CCCCO[C@H]1C[C@H]([NH2+]CCC[NH2+]C)C1(C)C ZINC000423200346 387986696 /nfs/dbraw/zinc/98/66/96/387986696.db2.gz LXVJLUUHBZJCRI-STQMWFEESA-N 2 0 242.407 2.169 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)[C@H]1C[C@H]1C)[C@@H]1CCC[NH2+]C1 ZINC000423216063 387997712 /nfs/dbraw/zinc/99/77/12/387997712.db2.gz NYLFJHSSVPZARB-LBELIVKGSA-N 2 0 210.365 2.009 20 0 BEADRP Cc1cncc([C@@H](C)[NH2+]C[C@H]2CCC[NH2+]C2)c1 ZINC000423214044 387998171 /nfs/dbraw/zinc/99/81/71/387998171.db2.gz OFPGYPRJHZNAOL-OLZOCXBDSA-N 2 0 233.359 2.040 20 0 BEADRP CCC1CC([NH2+][C@H](C)[C@H]2CCC[NH2+]C2)C1 ZINC000423218003 387999136 /nfs/dbraw/zinc/99/91/36/387999136.db2.gz QYJLLYUGHZNOOR-IGJPJIBNSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCCC[C@H]1[NH3+])C1CCSCC1 ZINC000424376410 387999833 /nfs/dbraw/zinc/99/98/33/387999833.db2.gz PADUSKJVOHVWLH-CYZMBNFOSA-N 2 0 242.432 2.378 20 0 BEADRP CC[N@@H+]1C[C@@H](C)[C@@H](Nc2ccc3c(c2)CCN3)C1 ZINC000423222100 388001235 /nfs/dbraw/zinc/00/12/35/388001235.db2.gz ZRVRZFMNICRMQJ-ABAIWWIYSA-N 2 0 245.370 2.407 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1C[C@H]1C1CCC1 ZINC000424382233 388001659 /nfs/dbraw/zinc/00/16/59/388001659.db2.gz RXIWRTXCSBYYOH-XDQVBPFNSA-N 2 0 222.376 2.140 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H](C)c1cc(F)c(F)c(F)c1 ZINC000423222257 388002563 /nfs/dbraw/zinc/00/25/63/388002563.db2.gz AJKQPVVEMRATIH-YUMQZZPRSA-N 2 0 246.276 2.492 20 0 BEADRP C[C@@H]([NH2+]CC[C@H](C)[NH3+])c1ccccc1N(C)C ZINC000423225799 388008867 /nfs/dbraw/zinc/00/88/67/388008867.db2.gz OHIFIHOHIHABSK-NWDGAFQWSA-N 2 0 235.375 2.141 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@H](C1CC1)C1CCC1 ZINC000423269834 388010642 /nfs/dbraw/zinc/01/06/42/388010642.db2.gz HQSLACDSTLUIBT-OLZOCXBDSA-N 2 0 210.365 2.138 20 0 BEADRP C(C[C@H]1CC[NH2+]C1)[NH2+][C@H](C1CC1)C1CCC1 ZINC000423240580 388024771 /nfs/dbraw/zinc/02/47/71/388024771.db2.gz CJQYZXOECYNFAQ-RISCZKNCSA-N 2 0 222.376 2.154 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@H]1CCC[C@H]1CCCF ZINC000423227600 388011659 /nfs/dbraw/zinc/01/16/59/388011659.db2.gz WIEGCMDNNHYPJE-SRVKXCTJSA-N 2 0 216.344 2.232 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H]1CCC[C@H]1CCCF ZINC000423227599 388011879 /nfs/dbraw/zinc/01/18/79/388011879.db2.gz WIEGCMDNNHYPJE-SDDRHHMPSA-N 2 0 216.344 2.232 20 0 BEADRP CC(=O)Nc1ccc([C@H](C)[NH2+]CC[C@H](C)[NH3+])cc1 ZINC000423226900 388012134 /nfs/dbraw/zinc/01/21/34/388012134.db2.gz SRWMMBRYXZCAAG-QWRGUYRKSA-N 2 0 249.358 2.033 20 0 BEADRP C([NH2+][C@@H](C1CC1)C1CCCC1)[C@H]1CCC[NH2+]1 ZINC000423229411 388015791 /nfs/dbraw/zinc/01/57/91/388015791.db2.gz BFASKISWGDPVFK-ZIAGYGMSSA-N 2 0 222.376 2.297 20 0 BEADRP CNCC[NH2+][C@@H]1CC[C@H](c2ccccc2)C1 ZINC000423235444 388018258 /nfs/dbraw/zinc/01/82/58/388018258.db2.gz AZHRNDYUHOCEAL-UONOGXRCSA-N 2 0 218.344 2.132 20 0 BEADRP CCNCC[NH2+][C@H]1CCC[C@H](c2cccnc2)C1 ZINC000423234927 388018501 /nfs/dbraw/zinc/01/85/01/388018501.db2.gz MQSKXADAYFHGOX-ZFWWWQNUSA-N 2 0 247.386 2.307 20 0 BEADRP C[C@@H]1CC(C)(C)C[C@H]1[NH2+]C[C@@H]1CCC[NH2+]1 ZINC000423243446 388026060 /nfs/dbraw/zinc/02/60/60/388026060.db2.gz WNMNJRBDSQDEOT-GRYCIOLGSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H](C)c1ccc(F)cc1 ZINC000423238548 388022902 /nfs/dbraw/zinc/02/29/02/388022902.db2.gz VPDLPQKFSAOQFF-UWVGGRQHSA-N 2 0 210.296 2.214 20 0 BEADRP Fc1cccc2c1CC[C@H]2[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000423252000 388033333 /nfs/dbraw/zinc/03/33/33/388033333.db2.gz SSTBELKZTFEADS-XHDPSFHLSA-N 2 0 248.345 2.402 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+]CC[C@@H]2CC[NH2+]C2)o1 ZINC000423254668 388036369 /nfs/dbraw/zinc/03/63/69/388036369.db2.gz ZBZPXVPZPMOUID-NEPJUHHUSA-N 2 0 222.332 2.238 20 0 BEADRP Cc1ccnc([C@@H](C)[NH2+]CC[C@@H]2CCC[NH2+]C2)c1 ZINC000423256606 388036388 /nfs/dbraw/zinc/03/63/88/388036388.db2.gz CEFOUGZWQGGADI-KGLIPLIRSA-N 2 0 247.386 2.430 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC[N@H+](C)[C@H]2CCC[C@@H]21)C1CC1 ZINC000453292791 388036959 /nfs/dbraw/zinc/03/69/59/388036959.db2.gz PEBXKBQERWLNBE-ZRJCITRHSA-N 2 0 222.376 2.247 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CCC[NH2+]C1)c1ccncc1 ZINC000423262280 388040216 /nfs/dbraw/zinc/04/02/16/388040216.db2.gz UXLDJUJEJIWGJF-CHWSQXEVSA-N 2 0 233.359 2.122 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@@H]1CC[C@H]1C(C)(C)C ZINC000423264881 388041524 /nfs/dbraw/zinc/04/15/24/388041524.db2.gz CLFHWHRVRQCFED-IJLUTSLNSA-N 2 0 212.381 2.384 20 0 BEADRP CC(C)O[C@@H]1C[C@H]([NH2+]C[C@H]([NH3+])C(C)C)C1(C)C ZINC000423263344 388042330 /nfs/dbraw/zinc/04/23/30/388042330.db2.gz AZMOFQPZXHWVTA-RWMBFGLXSA-N 2 0 242.407 2.151 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@@H]1CC(C)(C)C[C@H]1C ZINC000423263903 388042703 /nfs/dbraw/zinc/04/27/03/388042703.db2.gz BJPSWMQCMXKOSC-IJLUTSLNSA-N 2 0 212.381 2.384 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@H]1[C@H](C)CCC[C@@H]1C ZINC000423271726 388051933 /nfs/dbraw/zinc/05/19/33/388051933.db2.gz JEYSCWWEGDMDEI-XQHKEYJVSA-N 2 0 212.381 2.384 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H](C)c1cccc(F)c1 ZINC000423274645 388054649 /nfs/dbraw/zinc/05/46/49/388054649.db2.gz MHAQTOYKKYWKQQ-MNOVXSKESA-N 2 0 224.323 2.332 20 0 BEADRP CCC1CC([NH2+][C@@H]2CCCC[C@@H]2C[NH3+])C1 ZINC000423277796 388057727 /nfs/dbraw/zinc/05/77/27/388057727.db2.gz OSSYDZKVWVZAKJ-POOIEITISA-N 2 0 210.365 2.282 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CCC[C@H]2C[C@]21C ZINC000423277042 388059148 /nfs/dbraw/zinc/05/91/48/388059148.db2.gz PJGCQSRCUGGPLN-WUHRBBMRSA-N 2 0 210.365 2.010 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H]1CCc2c1cccc2C ZINC000423280981 388061747 /nfs/dbraw/zinc/06/17/47/388061747.db2.gz VEJIDOJAAJUFQS-NHYWBVRUSA-N 2 0 232.371 2.427 20 0 BEADRP CCC[C@H]([NH2+]C[C@@H](C)C[NH2+]C)c1cccnc1 ZINC000423279969 388062602 /nfs/dbraw/zinc/06/26/02/388062602.db2.gz TVRCPUJJHXQXHD-JSGCOSHPSA-N 2 0 235.375 2.368 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H]1CCC[C@H]1CCCF ZINC000423281018 388063497 /nfs/dbraw/zinc/06/34/97/388063497.db2.gz VHUIDXIUOZLWBV-AVGNSLFASA-N 2 0 230.371 2.350 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H](C1CC1)C1CCC1 ZINC000423282363 388065749 /nfs/dbraw/zinc/06/57/49/388065749.db2.gz WLLHVLTXLWESNK-GWCFXTLKSA-N 2 0 210.365 2.010 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H](C1CC1)C1CCCC1 ZINC000423283116 388065979 /nfs/dbraw/zinc/06/59/79/388065979.db2.gz XFRSNHLYAAVQPN-FZMZJTMJSA-N 2 0 224.392 2.400 20 0 BEADRP CC(C)([NH3+])C[NH2+]C1CCC(C(F)F)CC1 ZINC000423283890 388066796 /nfs/dbraw/zinc/06/67/96/388066796.db2.gz FTWYQJJYQMRZIE-UHFFFAOYSA-N 2 0 220.307 2.137 20 0 BEADRP CCOC[C@H]1CCC[C@H]1[NH2+]CC([NH3+])(CC)CC ZINC000423283873 388067050 /nfs/dbraw/zinc/06/70/50/388067050.db2.gz FSSSKUXRIHJAOT-CHWSQXEVSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CCC[NH2+]C1)[C@H]1C[C@H]1C ZINC000423284664 388067345 /nfs/dbraw/zinc/06/73/45/388067345.db2.gz YRCUSVNRAQHQKY-LPWJVIDDSA-N 2 0 210.365 2.010 20 0 BEADRP C(C[C@@H]1CCC[NH2+]C1)[NH2+][C@@H]1CCC12CCC2 ZINC000423285073 388070014 /nfs/dbraw/zinc/07/00/14/388070014.db2.gz ZGDLNYKPMUHUCZ-QWHCGFSZSA-N 2 0 222.376 2.298 20 0 BEADRP CCCCO[C@H]1C[C@@H]([NH2+]CC(C)(C)[NH3+])C1(C)C ZINC000423286396 388070964 /nfs/dbraw/zinc/07/09/64/388070964.db2.gz GZHYSRACNQBIMQ-NEPJUHHUSA-N 2 0 242.407 2.297 20 0 BEADRP C[N@H+](CCCC[NH2+][C@H]1CCCOCC1)C1CC1 ZINC000453397543 388071240 /nfs/dbraw/zinc/07/12/40/388071240.db2.gz JPGJBTAUORQEGF-ZDUSSCGKSA-N 2 0 240.391 2.020 20 0 BEADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@H]2C[C@@H](C)O[C@@H]2C)cc1 ZINC000423289893 388074262 /nfs/dbraw/zinc/07/42/62/388074262.db2.gz BXUABONHVNKOKS-BLTAXRJOSA-N 2 0 248.370 2.362 20 0 BEADRP C[C@@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)[C@H]1CCCO1 ZINC000423289864 388074402 /nfs/dbraw/zinc/07/44/02/388074402.db2.gz BUJLNSRDIPLSRM-YWPYICTPSA-N 2 0 248.370 2.363 20 0 BEADRP CCc1ccc([C@@H](C)[NH2+]C[C@@H](C)C[NH3+])o1 ZINC000423297625 388079329 /nfs/dbraw/zinc/07/93/29/388079329.db2.gz LCFHJAGHBNUADB-VHSXEESVSA-N 2 0 210.321 2.087 20 0 BEADRP COc1ccc2c(c1)CCC[C@@H]2[NH2+]C[C@H](C)C[NH3+] ZINC000423297641 388079636 /nfs/dbraw/zinc/07/96/36/388079636.db2.gz LDDUONMPNRSWGX-ABAIWWIYSA-N 2 0 248.370 2.257 20 0 BEADRP Cc1nc2c(s1)[C@H]([NH2+]C[C@H](C)C[NH3+])CCC2 ZINC000423297512 388079930 /nfs/dbraw/zinc/07/99/30/388079930.db2.gz KPICBQODINCPCP-PSASIEDQSA-N 2 0 239.388 2.013 20 0 BEADRP Cc1ccsc1[C@H](C)[NH2+]C[C@H](C)C[NH3+] ZINC000423298118 388079982 /nfs/dbraw/zinc/07/99/82/388079982.db2.gz NEYUSWNWBPGUGI-SCZZXKLOSA-N 2 0 212.362 2.302 20 0 BEADRP CC(C)C[C@@H]([NH2+]C[C@@H](C)C[NH3+])c1ccccn1 ZINC000423297675 388080274 /nfs/dbraw/zinc/08/02/74/388080274.db2.gz LHVDADHWIYOOLN-GXTWGEPZSA-N 2 0 235.375 2.353 20 0 BEADRP Cc1nc2c(s1)[C@@H]([NH2+]C[C@H](C)C[NH3+])CCC2 ZINC000423297513 388080293 /nfs/dbraw/zinc/08/02/93/388080293.db2.gz KPICBQODINCPCP-SCZZXKLOSA-N 2 0 239.388 2.013 20 0 BEADRP CCSCC[NH2+]CCCC[N@H+](C)C1CC1 ZINC000453595006 388089073 /nfs/dbraw/zinc/08/90/73/388089073.db2.gz JLCJVYJRCGVAMY-UHFFFAOYSA-N 2 0 230.421 2.204 20 0 BEADRP CSC1(C[NH2+]CCCC[N@H+](C)C2CC2)CC1 ZINC000453599302 388089400 /nfs/dbraw/zinc/08/94/00/388089400.db2.gz QOFALGUZYFGDHS-UHFFFAOYSA-N 2 0 242.432 2.346 20 0 BEADRP C(C[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1)C1CCCCC1 ZINC000085734148 388095515 /nfs/dbraw/zinc/09/55/15/388095515.db2.gz JPLCKFBXJXXXFV-OKILXGFUSA-N 2 0 222.376 2.108 20 0 BEADRP C[N@H+](CCc1cccs1)C[C@@]1(C)CC[NH2+]C1 ZINC000086442316 388101964 /nfs/dbraw/zinc/10/19/64/388101964.db2.gz ZDABLLYAPRUQKZ-ZDUSSCGKSA-N 2 0 238.400 2.222 20 0 BEADRP C[C@H](C[C@@H]1CCC[NH2+]1)[NH2+]CCc1cccs1 ZINC000086494981 388103987 /nfs/dbraw/zinc/10/39/87/388103987.db2.gz XBJGKLGOFMTUGY-NEPJUHHUSA-N 2 0 238.400 2.411 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H]2CS[C@@H](C)C2)CC1 ZINC000086934591 388111269 /nfs/dbraw/zinc/11/12/69/388111269.db2.gz CBMIBYMUMQTBAY-AAEUAGOBSA-N 2 0 242.432 2.344 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H](C)c1ccccc1N(C)C ZINC000423267469 388045434 /nfs/dbraw/zinc/04/54/34/388045434.db2.gz FEKBXOUWFPUFOO-CHWSQXEVSA-N 2 0 249.402 2.259 20 0 BEADRP CCC1(CC)[C@H]([NH2+]C[C@@H](C)C[NH2+]C)C[C@@H]1OC ZINC000423268706 388047132 /nfs/dbraw/zinc/04/71/32/388047132.db2.gz GGLDMSWZTQKQCD-XQQFMLRXSA-N 2 0 242.407 2.025 20 0 BEADRP COc1ccc(C[NH2+]CCCC[NH3+])cc1Cl ZINC000083188728 388047801 /nfs/dbraw/zinc/04/78/01/388047801.db2.gz FEORHFRUQYRQBN-UHFFFAOYSA-N 2 0 242.750 2.177 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCCC[C@H]1C[NH3+])c1cncs1 ZINC000423269686 388047871 /nfs/dbraw/zinc/04/78/71/388047871.db2.gz FQVNWYGHEWNFGA-GARJFASQSA-N 2 0 239.388 2.311 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCCC[C@@H]1C[NH3+])c1cncs1 ZINC000423269687 388048387 /nfs/dbraw/zinc/04/83/87/388048387.db2.gz FQVNWYGHEWNFGA-HBNTYKKESA-N 2 0 239.388 2.311 20 0 BEADRP CC[C@@H]1CC[C@H](C)C[C@@H]1[NH2+][C@H]1CC[NH2+]C1 ZINC000423213881 388049540 /nfs/dbraw/zinc/04/95/40/388049540.db2.gz LVEJYLCQJPMURG-RNJOBUHISA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@H](C)CC(C)(C)C ZINC000423271311 388049844 /nfs/dbraw/zinc/04/98/44/388049844.db2.gz IXBZUGKOYBWXSF-GHMZBOCLSA-N 2 0 200.370 2.384 20 0 BEADRP C[C@@H](Cc1ccoc1)[NH2+]CC1=CC[N@H+](C)CC1 ZINC000449253925 388163763 /nfs/dbraw/zinc/16/37/63/388163763.db2.gz VAUIZTXYTTZLMJ-LBPRGKRZSA-N 2 0 234.343 2.062 20 0 BEADRP C[C@H]1CN(C2CC2)C[C@@H]1[NH2+]CCC(C)(F)F ZINC000449355259 388180704 /nfs/dbraw/zinc/18/07/04/388180704.db2.gz XIFFKZJFDSJSDQ-ONGXEEELSA-N 2 0 232.318 2.104 20 0 BEADRP C[NH+](C)CCCC[NH2+]Cc1cc2cccnc2o1 ZINC000449105796 388142920 /nfs/dbraw/zinc/14/29/20/388142920.db2.gz IVQYITXMGFXIIJ-UHFFFAOYSA-N 2 0 247.342 2.259 20 0 BEADRP [NH3+]CCCC[NH2+]Cc1ccsc1Cl ZINC000312629710 256526282 /nfs/dbraw/zinc/52/62/82/256526282.db2.gz RLKMRMQNNHHGPW-UHFFFAOYSA-N 2 0 218.753 2.230 20 0 BEADRP Cc1ccncc1CCC[NH2+]CCC1(CO)CC1 ZINC000449581143 388237801 /nfs/dbraw/zinc/23/78/01/388237801.db2.gz XNQXWCSXYMCHIZ-UHFFFAOYSA-N 2 0 248.370 2.075 20 0 BEADRP CS[C@H]1CC[N@H+](CCC[NH+]2CCCCC2)C1 ZINC000451328761 388261584 /nfs/dbraw/zinc/26/15/84/388261584.db2.gz VSIFKVBLQJSJIP-ZDUSSCGKSA-N 2 0 242.432 2.300 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+]C2CC(C(C)C)C2)C1 ZINC000233499746 388347302 /nfs/dbraw/zinc/34/73/02/388347302.db2.gz SRMMEEFEZKWIJU-HSBZDZAISA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1)C1CC1 ZINC000086494349 388366156 /nfs/dbraw/zinc/36/61/56/388366156.db2.gz KKGABOSSRUNFIV-RUZUBIRVSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@@H]1C[C@H](C[NH2+]Cc2cccs2)CC[NH2+]1 ZINC000235383989 388368355 /nfs/dbraw/zinc/36/83/55/388368355.db2.gz XVMKWCNWBIPQJO-GHMZBOCLSA-N 2 0 224.373 2.226 20 0 BEADRP C[C@H](C[NH3+])N[C@H](C)c1ccccc1OC(F)F ZINC000235462548 388369170 /nfs/dbraw/zinc/36/91/70/388369170.db2.gz UZOGNVREASGQQE-RKDXNWHRSA-N 2 0 244.285 2.286 20 0 BEADRP CC[C@H]1CCCCN1CC[NH2+][C@@H](C)CCOC ZINC000164882854 388387148 /nfs/dbraw/zinc/38/71/48/388387148.db2.gz BKOSNMUFXFKXFV-KBPBESRZSA-N 2 0 242.407 2.266 20 0 BEADRP CC(C)(C[NH2+][C@@H]1CCC[NH2+]CC1)C(F)(F)F ZINC000572989748 388403539 /nfs/dbraw/zinc/40/35/39/388403539.db2.gz FCYZANSDBJZPPA-SECBINFHSA-N 2 0 238.297 2.307 20 0 BEADRP CCC(C)(C)OCC[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000308550697 388442922 /nfs/dbraw/zinc/44/29/22/388442922.db2.gz WONAKGMROFODTE-QWHCGFSZSA-N 2 0 242.407 2.264 20 0 BEADRP CC(C)CSCC[NH2+][C@@H](C)CCCC[NH3+] ZINC000397279138 388456629 /nfs/dbraw/zinc/45/66/29/388456629.db2.gz CTORVJNMGOGQIT-LBPRGKRZSA-N 2 0 232.437 2.483 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@@H](c1ccccc1)C1CC1 ZINC000336688912 388463634 /nfs/dbraw/zinc/46/36/34/388463634.db2.gz VWUNXRXGOFEUTB-FZMZJTMJSA-N 2 0 218.344 2.322 20 0 BEADRP CCS[C@H]1CC[C@@H]([N@H+](C)CCC[NH2+]C)C1 ZINC000336719418 388467436 /nfs/dbraw/zinc/46/74/36/388467436.db2.gz YEMQVQMZHDTJJW-NEPJUHHUSA-N 2 0 230.421 2.202 20 0 BEADRP CC[C@@H]([NH2+]CC1CC[NH+](C)CC1)C1CCC1 ZINC000322358497 388432702 /nfs/dbraw/zinc/43/27/02/388432702.db2.gz GMOPIWDHTDMYBA-CQSZACIVSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@](C)(C[NH2+]C1CC[NH+](C(C)C)CC1)OC ZINC000322491158 388436064 /nfs/dbraw/zinc/43/60/64/388436064.db2.gz CCPNOUZPCFYIJN-AWEZNQCLSA-N 2 0 242.407 2.264 20 0 BEADRP CC(C)(C)[NH+]1CCC([NH2+][C@@H]2CCCOC2)CC1 ZINC000070464821 388436817 /nfs/dbraw/zinc/43/68/17/388436817.db2.gz FOZODTOOQCJPOB-CYBMUJFWSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@H](c1ccccn1)[N@H+]1CC[C@H]2C[NH2+]C[C@H]2CC1 ZINC000311187841 388493295 /nfs/dbraw/zinc/49/32/95/388493295.db2.gz BPSGWVDTJJNSCZ-MCIONIFRSA-N 2 0 245.370 2.074 20 0 BEADRP CC[C@H](C)[NH+](C)CCOCC[N@@H+](C)[C@@H](C)CC ZINC000178628901 388502394 /nfs/dbraw/zinc/50/23/94/388502394.db2.gz VRNHFRHCOCSYRN-KBPBESRZSA-N 2 0 244.423 2.464 20 0 BEADRP CC[NH+](CCOCC[N@@H+](CC)C(C)C)C(C)C ZINC000178616773 388502526 /nfs/dbraw/zinc/50/25/26/388502526.db2.gz QAPCKSSAKZOGMI-UHFFFAOYSA-N 2 0 244.423 2.464 20 0 BEADRP CCC[C@@H]([NH2+]CCN(C)C)[C@H]1CC1(C)C ZINC000397853330 388506298 /nfs/dbraw/zinc/50/62/98/388506298.db2.gz SMYDREKUJYQFCF-VXGBXAGGSA-N 2 0 212.381 2.352 20 0 BEADRP Cc1ccsc1C[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000087309980 256802784 /nfs/dbraw/zinc/80/27/84/256802784.db2.gz GWZQQCBRWZHJBQ-LLVKDONJSA-N 2 0 224.373 2.288 20 0 BEADRP C[C@@H]([NH2+]CCC[NH2+]C1CC1)[C@@H]1CC1(C)C ZINC000397867827 388506958 /nfs/dbraw/zinc/50/69/58/388506958.db2.gz ZHGCHGBBQHNUBG-PWSUYJOCSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1CSC[C@@H]1[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000397864873 388507213 /nfs/dbraw/zinc/50/72/13/388507213.db2.gz ZPEYQIODACHKEI-JXJLXUTGSA-N 2 0 248.395 2.472 20 0 BEADRP CC(C)C[C@@H]1CCC[N@@H+]1C[C@H]1CCC[NH2+]C1 ZINC000346832532 388520358 /nfs/dbraw/zinc/52/03/58/388520358.db2.gz QXEGAEZHXGSDSM-KBPBESRZSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)C[C@H]1CCC[N@@H+]1C[C@H]1CCC[NH2+]C1 ZINC000346832534 388520543 /nfs/dbraw/zinc/52/05/43/388520543.db2.gz QXEGAEZHXGSDSM-UONOGXRCSA-N 2 0 224.392 2.497 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]C[C@H]2CCC(F)(F)C2)C1 ZINC000516877922 388522877 /nfs/dbraw/zinc/52/28/77/388522877.db2.gz RAMYPWFOMRYABP-AXFHLTTASA-N 2 0 232.318 2.281 20 0 BEADRP CC[C@@H](C)C[N@H+](C)C1CCN(CC)CC1 ZINC000088492346 388530919 /nfs/dbraw/zinc/53/09/19/388530919.db2.gz ZWFAEEKPQIRXQC-GFCCVEGCSA-N 2 0 212.381 2.449 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@H]2CCC[C@H]2F)[C@H]2CCC[C@H]21 ZINC000550934149 388616908 /nfs/dbraw/zinc/61/69/08/388616908.db2.gz WVMNOXKPDVJCNZ-PEBLQZBPSA-N 2 0 240.366 2.339 20 0 BEADRP CC[C@@H](C)C[NH2+]CCN1CCCC[C@H]1C ZINC000245532385 388587906 /nfs/dbraw/zinc/58/79/06/388587906.db2.gz ICRHUBBZTAKLBR-CHWSQXEVSA-N 2 0 212.381 2.497 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+]C[C@H](C)CC)C1 ZINC000245547106 388588202 /nfs/dbraw/zinc/58/82/02/388588202.db2.gz XAFHMGNHQRVWDG-OLZOCXBDSA-N 2 0 212.381 2.354 20 0 BEADRP CO[C@H](C[N@@H+]1CC[C@H]([C@H](C)[NH3+])C1)c1ccccc1 ZINC000379232141 388599875 /nfs/dbraw/zinc/59/98/75/388599875.db2.gz STVCTTYVGSLHTR-AEGPPILISA-N 2 0 248.370 2.043 20 0 BEADRP C[C@@H]1C[N@H+](CC[C@@H]2CCCC[NH+]2C)[C@@H]1C ZINC000550307210 388605522 /nfs/dbraw/zinc/60/55/22/388605522.db2.gz RLLOCUSZKOQWCM-UPJWGTAASA-N 2 0 210.365 2.201 20 0 BEADRP COc1ccncc1Cn1ccnc1C1CC1 ZINC000530129838 388613771 /nfs/dbraw/zinc/61/37/71/388613771.db2.gz LIXHSEPKMSSXNP-UHFFFAOYSA-N 2 0 229.283 2.212 20 0 BEADRP C[C@@H]([N@H+](C)CCC1CC[NH2+]CC1)C1(C)CC1 ZINC000359199757 388556108 /nfs/dbraw/zinc/55/61/08/388556108.db2.gz FGYBOTHBWVTQTR-GFCCVEGCSA-N 2 0 224.392 2.497 20 0 BEADRP CCCC[NH2+][C@@H]1CC[N@H+](C)[C@H]2CCC[C@H]21 ZINC000367621442 388566611 /nfs/dbraw/zinc/56/66/11/388566611.db2.gz SXDORDIQVCYDBG-XQQFMLRXSA-N 2 0 210.365 2.249 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCCCOC)[C@@H](C)C1 ZINC000245439390 388580748 /nfs/dbraw/zinc/58/07/48/388580748.db2.gz SUWBYOYSPVASLV-UONOGXRCSA-N 2 0 242.407 2.075 20 0 BEADRP CCC[N@H+](C)C[C@@H]1CC[NH+](CC(C)C)C1 ZINC000081572166 388584886 /nfs/dbraw/zinc/58/48/86/388584886.db2.gz BERZUPDNUKPJPD-ZDUSSCGKSA-N 2 0 212.381 2.306 20 0 BEADRP Cc1ccc(CC[NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)cn1 ZINC000248062014 388673222 /nfs/dbraw/zinc/67/32/22/388673222.db2.gz LWSSCNPFALWXKV-ZFWWWQNUSA-N 2 0 247.386 2.005 20 0 BEADRP CCCCC[NH2+][C@H]1CC[N@H+](CC)C[C@H]1C ZINC000248054801 388673488 /nfs/dbraw/zinc/67/34/88/388673488.db2.gz XFDNHZZPZHCRRX-OLZOCXBDSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000530176646 388621131 /nfs/dbraw/zinc/62/11/31/388621131.db2.gz DUTYDDDUOQFXQM-WOPDTQHZSA-N 2 0 208.349 2.049 20 0 BEADRP C[C@@H]1CCC[C@H]1[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000530176645 388621901 /nfs/dbraw/zinc/62/19/01/388621901.db2.gz DUTYDDDUOQFXQM-UTUOFQBUSA-N 2 0 208.349 2.049 20 0 BEADRP CC1(C)CCC[C@@H]1[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000530177318 388622161 /nfs/dbraw/zinc/62/21/61/388622161.db2.gz FYBJECJREZRIJO-NWDGAFQWSA-N 2 0 222.376 2.439 20 0 BEADRP C([NH2+][C@H]1CC[NH2+]C12CCC2)C1CCCCC1 ZINC000530179353 388622772 /nfs/dbraw/zinc/62/27/72/388622772.db2.gz XDTBEIAFXLFSCR-ZDUSSCGKSA-N 2 0 222.376 2.441 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+][C@H]2CC[NH2+]C23CCC3)C1 ZINC000530179678 388622780 /nfs/dbraw/zinc/62/27/80/388622780.db2.gz ZUJMZHFLQZCKPP-UPJWGTAASA-N 2 0 222.376 2.439 20 0 BEADRP CC(C)C[C@@H](C)[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000530179354 388622806 /nfs/dbraw/zinc/62/28/06/388622806.db2.gz XEDUQMXZMKZMSE-NEPJUHHUSA-N 2 0 210.365 2.295 20 0 BEADRP C[NH2+]C[C@@H]1CCC[N@@H+]1CC1CC(C)(C)C1 ZINC000530207809 388626317 /nfs/dbraw/zinc/62/63/17/388626317.db2.gz DOUQZQDYVDUERR-LBPRGKRZSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCCC1(C)C)C1C[NH2+]C1 ZINC000530210029 388627545 /nfs/dbraw/zinc/62/75/45/388627545.db2.gz KIJLVLLOFDPYBS-WCQYABFASA-N 2 0 224.392 2.400 20 0 BEADRP CC1(C)CC(C[N@@H+]2CCC[C@H](C[NH3+])C2)C1 ZINC000530213046 388627865 /nfs/dbraw/zinc/62/78/65/388627865.db2.gz UGYLJVIGPUNHIN-LLVKDONJSA-N 2 0 210.365 2.093 20 0 BEADRP CC1(C)CC(C[N@@H+]2C[C@@H]3CCC[C@H]([NH3+])[C@@H]3C2)C1 ZINC000530217095 388630056 /nfs/dbraw/zinc/63/00/56/388630056.db2.gz FIGDJMSYWHYERA-MJBXVCDLSA-N 2 0 236.403 2.482 20 0 BEADRP CC[C@@H]1C[N@H+](CC2CC(C)(C)C2)CC[C@@H]1[NH3+] ZINC000530217918 388630617 /nfs/dbraw/zinc/63/06/17/388630617.db2.gz JCWDBKXJBDBPEG-OLZOCXBDSA-N 2 0 224.392 2.482 20 0 BEADRP CC1(C)CC(C[N@@H+]2C[C@@H]3CCC[C@@H]([NH3+])[C@@H]3C2)C1 ZINC000530217092 388630748 /nfs/dbraw/zinc/63/07/48/388630748.db2.gz FIGDJMSYWHYERA-BFHYXJOUSA-N 2 0 236.403 2.482 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[NH2+]C12CCC2)[C@@H]1CC1(C)C ZINC000530217646 388630803 /nfs/dbraw/zinc/63/08/03/388630803.db2.gz URYMNCVXKJUVGO-SRVKXCTJSA-N 2 0 222.376 2.295 20 0 BEADRP CC[C@H]([NH2+][C@H]1CC[NH2+]C12CCC2)C1CC1 ZINC000530219347 388631396 /nfs/dbraw/zinc/63/13/96/388631396.db2.gz LKMQZBZOSXVDCB-RYUDHWBXSA-N 2 0 208.349 2.049 20 0 BEADRP CC1(C)CC(C[N@@H+]2CC[C@@H]3[NH2+]CC[C@H]3C2)C1 ZINC000530220177 388631441 /nfs/dbraw/zinc/63/14/41/388631441.db2.gz LUBUQLGBXQZEDN-STQMWFEESA-N 2 0 222.376 2.106 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]CC1CC=CC1 ZINC000530218775 388632286 /nfs/dbraw/zinc/63/22/86/388632286.db2.gz XEPGPYNNEVLWAH-OLZOCXBDSA-N 2 0 208.349 2.202 20 0 BEADRP C[C@@H]1CC[N@H+](CC2CC(C)(C)C2)C[C@@H]1C[NH3+] ZINC000530222916 388633642 /nfs/dbraw/zinc/63/36/42/388633642.db2.gz IRNCGANPUMHQSV-YPMHNXCESA-N 2 0 224.392 2.339 20 0 BEADRP C[C@H]1C[C@H]([NH3+])CC[N@@H+]1CC1CC(C)(C)C1 ZINC000530225301 388634085 /nfs/dbraw/zinc/63/40/85/388634085.db2.gz VNGCNHGMVONRSI-CMPLNLGQSA-N 2 0 210.365 2.234 20 0 BEADRP CC1(C)CC(C[NH2+][C@@H]2CCCC[C@H]2[NH3+])C1 ZINC000530227757 388635293 /nfs/dbraw/zinc/63/52/93/388635293.db2.gz ZVHVKTYGWZNXNC-VXGBXAGGSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)(C)CC[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000530242826 388638053 /nfs/dbraw/zinc/63/80/53/388638053.db2.gz DNZRWXXRWGTSSL-LLVKDONJSA-N 2 0 210.365 2.297 20 0 BEADRP Cc1ccc(C[N@@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@H]3C2)cc1 ZINC000261551914 388644178 /nfs/dbraw/zinc/64/41/78/388644178.db2.gz MOQZSFFIDQFTQJ-SOUVJXGZSA-N 2 0 230.355 2.164 20 0 BEADRP CCOC[C@H](C)[NH2+]CCC[N@@H+]1CCCC[C@H]1C ZINC000252709042 388772380 /nfs/dbraw/zinc/77/23/80/388772380.db2.gz BWEAWHYGZOGJIB-UONOGXRCSA-N 2 0 242.407 2.266 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@H]2CCCSC2)[C@H](C)C1 ZINC000252715722 388775231 /nfs/dbraw/zinc/77/52/31/388775231.db2.gz WNFLRZDMGZDMGC-AGIUHOORSA-N 2 0 242.432 2.202 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]CCOC2CCCCC2)C1 ZINC000093216151 388829722 /nfs/dbraw/zinc/82/97/22/388829722.db2.gz IXZOULNDXDFNFY-CHWSQXEVSA-N 2 0 240.391 2.195 20 0 BEADRP CC[NH+](CC)CCC[N@H+](C)CC(C)(C)OC ZINC000554825665 388832528 /nfs/dbraw/zinc/83/25/28/388832528.db2.gz SJUOEXJKPLGCLC-UHFFFAOYSA-N 2 0 230.396 2.075 20 0 BEADRP [NH3+]CCC[NH2+][C@@H](CC1CC1)c1ccccc1 ZINC000564791766 388890403 /nfs/dbraw/zinc/89/04/03/388890403.db2.gz CSJKBIIVDKEDKE-AWEZNQCLSA-N 2 0 218.344 2.466 20 0 BEADRP CC(C)[N@H+](CCCc1cncn1C)C1CC1 ZINC000565165198 388920743 /nfs/dbraw/zinc/92/07/43/388920743.db2.gz PMHLHHQUROVLFP-UHFFFAOYSA-N 2 0 221.348 2.226 20 0 BEADRP C([NH2+][C@H]1CCCC12CC2)[C@H]1CC[N@@H+](C2CC2)C1 ZINC000565242671 388931305 /nfs/dbraw/zinc/93/13/05/388931305.db2.gz GVQSIDLWXWHNPR-OCCSQVGLSA-N 2 0 234.387 2.393 20 0 BEADRP c1ccc([C@H]2CCC[N@H+]2C[C@H]2CCC[NH2+]C2)nc1 ZINC000564975600 388904209 /nfs/dbraw/zinc/90/42/09/388904209.db2.gz LEXJVSDCZHSTDN-DZGCQCFKSA-N 2 0 245.370 2.218 20 0 BEADRP CCC(C)(C)[C@H](C)[NH2+]C[C@]1(COC)CCC[NH2+]1 ZINC000566062621 388985894 /nfs/dbraw/zinc/98/58/94/388985894.db2.gz RZWVZGUKXMPBGG-JSGCOSHPSA-N 2 0 242.407 2.169 20 0 BEADRP C([NH2+][C@@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1)C1CCC1 ZINC000086494317 533370743 /nfs/dbraw/zinc/37/07/43/533370743.db2.gz WFNOYZNPIPKBKS-MELADBBJSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]([NH2+]C[C@@H](C)CC(F)(F)F)[C@@H]1CCC[NH2+]1 ZINC000400473781 533408832 /nfs/dbraw/zinc/40/88/32/533408832.db2.gz YZTJHIQBGDLQDH-AEJSXWLSSA-N 2 0 238.297 2.305 20 0 BEADRP CSC1(C[NH2+][C@@H](C)[C@@H]2CCC[NH2+]2)CCC1 ZINC000400507642 533511612 /nfs/dbraw/zinc/51/16/12/533511612.db2.gz IJPKATJFZVABQR-QWRGUYRKSA-N 2 0 228.405 2.002 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C2CC[NH+](CC3CC3)CC2)[C@@H]1C ZINC000494889566 533641516 /nfs/dbraw/zinc/64/15/16/533641516.db2.gz BUZXYLHWXNHPFE-LALPHHSUSA-N 2 0 236.403 2.495 20 0 BEADRP CC1(C)CCCC[C@H]1[NH2+]CC1=CC[NH2+]CC1 ZINC000335502042 133868737 /nfs/dbraw/zinc/86/87/37/133868737.db2.gz UGPYLEHTQUWZEQ-CYBMUJFWSA-N 2 0 222.376 2.465 20 0 BEADRP C[N@H+](CC1CC1)C[C@H]1CC[NH+](CCCCF)C1 ZINC000352011220 134035428 /nfs/dbraw/zinc/03/54/28/134035428.db2.gz ACTNQOWWZCJFML-CQSZACIVSA-N 2 0 242.382 2.400 20 0 BEADRP C[C@@H]1CC[C@]2(CC[N@H+](CC3CC[NH2+]CC3)C2)C1 ZINC000336054445 134065712 /nfs/dbraw/zinc/06/57/12/134065712.db2.gz AURFSMYCRYCJHB-HIFRSBDPSA-N 2 0 236.403 2.498 20 0 BEADRP Cc1ccnc(N2CCC3(CCC[N@H+]3C)CC2)c1 ZINC000336179560 134117690 /nfs/dbraw/zinc/11/76/90/134117690.db2.gz SBGGONUYASIVRD-UHFFFAOYSA-N 2 0 245.370 2.455 20 0 BEADRP C[C@@H]1CC[N@H+](Cc2cccs2)C[C@@H]1C[NH3+] ZINC000167598861 134118897 /nfs/dbraw/zinc/11/88/97/134118897.db2.gz GOSSCKJLDSKVQF-MNOVXSKESA-N 2 0 224.373 2.165 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCC[NH2+]CC1)c1ccccc1 ZINC000168693459 134242606 /nfs/dbraw/zinc/24/26/06/134242606.db2.gz KFZULCLPVQNGFO-TZMCWYRMSA-N 2 0 218.344 2.479 20 0 BEADRP C[C@@]1(C[NH2+][C@@H]2CCC[NH2+]CC2)CCCS1 ZINC000168774067 134247711 /nfs/dbraw/zinc/24/77/11/134247711.db2.gz WFKCVLPTDWTVHJ-NEPJUHHUSA-N 2 0 228.405 2.004 20 0 BEADRP Cc1csc([C@@H](C)N[C@@H]2CCC[NH2+]CC2)n1 ZINC000168758773 134247878 /nfs/dbraw/zinc/24/78/78/134247878.db2.gz RSWHLDDYOOJHQD-GHMZBOCLSA-N 2 0 239.388 2.244 20 0 BEADRP C[C@@H](c1ccc(F)cc1)N1CCC[C@@H]([NH3+])C1 ZINC000217500288 134248957 /nfs/dbraw/zinc/24/89/57/134248957.db2.gz QXVRYYIYZWXXMF-GXFFZTMASA-N 2 0 222.307 2.310 20 0 BEADRP C[C@H](N[C@H]1CC[N@@H+]2CCCC[C@@H]12)c1cccnc1 ZINC000217677458 134249491 /nfs/dbraw/zinc/24/94/91/134249491.db2.gz SQYDKVRHQXZCJM-QEJZJMRPSA-N 2 0 245.370 2.359 20 0 BEADRP CC[C@H](C)[NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000178038500 134302494 /nfs/dbraw/zinc/30/24/94/134302494.db2.gz YQGKXZDJLNVYKF-BFHYXJOUSA-N 2 0 242.407 2.264 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CCCOC(C)C)[C@H](C)C1 ZINC000178192043 134304614 /nfs/dbraw/zinc/30/46/14/134304614.db2.gz HYMMUXZRUMTPQI-KGLIPLIRSA-N 2 0 242.407 2.121 20 0 BEADRP COCCC[C@H](C)[NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1 ZINC000178305170 134305878 /nfs/dbraw/zinc/30/58/78/134305878.db2.gz ISPSKAKNKBEYHR-MJBXVCDLSA-N 2 0 242.407 2.264 20 0 BEADRP Cc1ccc(C[NH2+][C@@H](C)CC[NH3+])cc1C ZINC000220539931 134309919 /nfs/dbraw/zinc/30/99/19/134309919.db2.gz MOLSDJOAPFVJJI-LBPRGKRZSA-N 2 0 206.333 2.130 20 0 BEADRP COCCC[C@@H](C)[NH2+]CCC[NH+]1CCCCC1 ZINC000178411073 134310282 /nfs/dbraw/zinc/31/02/82/134310282.db2.gz DTWUGWQCJKSEES-CQSZACIVSA-N 2 0 242.407 2.267 20 0 BEADRP C[C@@H]1Cc2ccccc2C[N@@H+]1CC1CC[NH2+]CC1 ZINC000178975100 134314148 /nfs/dbraw/zinc/31/41/48/134314148.db2.gz XXLNPWDHQAXGBC-CYBMUJFWSA-N 2 0 244.382 2.433 20 0 BEADRP CCN(C)CC[NH2+][C@@H]1CCC[C@@H](C)[C@@H]1C ZINC000222060142 134329369 /nfs/dbraw/zinc/32/93/69/134329369.db2.gz QZXLSVKTMVDQCF-FRRDWIJNSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@@H]([NH2+]CCn2ccnc2)C1 ZINC000222024619 134329487 /nfs/dbraw/zinc/32/94/87/134329487.db2.gz UFBADWHWHMCKFV-AGIUHOORSA-N 2 0 221.348 2.297 20 0 BEADRP CC(C)CCC[N@H+](C)[C@H]1CCC[NH2+]CC1 ZINC000226468782 134363444 /nfs/dbraw/zinc/36/34/44/134363444.db2.gz OFDNAWPZTLTFAO-ZDUSSCGKSA-N 2 0 212.381 2.497 20 0 BEADRP CC[C@H]1CCC[C@@H]([NH2+]CCOCC[NH+](C)C)C1 ZINC000226744857 134371098 /nfs/dbraw/zinc/37/10/98/134371098.db2.gz RTPJOXBCXXWEAZ-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@H](CC1CC1)[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000227496680 134381308 /nfs/dbraw/zinc/38/13/08/134381308.db2.gz JECDVPKLEFNLFW-GFCCVEGCSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H](CC[NH+](C)C)N[C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000227539759 134382930 /nfs/dbraw/zinc/38/29/30/134382930.db2.gz KZVOSBBGCYLGHT-DFBGVHRSSA-N 2 0 247.386 2.061 20 0 BEADRP CC(C)(C)CC[NH2+]CCC[NH+]1CCCC1 ZINC000059382898 134391886 /nfs/dbraw/zinc/39/18/86/134391886.db2.gz UQGSOYKAYNJNQV-UHFFFAOYSA-N 2 0 212.381 2.498 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+][C@@H]1CCC[C@@H](C)[C@@H]1C ZINC000234806839 134584259 /nfs/dbraw/zinc/58/42/59/134584259.db2.gz RASCYZZXWDVDSY-ZOBORPQBSA-N 2 0 242.407 2.155 20 0 BEADRP CC[C@H]1CC[C@H]([NH2+]CC2CC[NH+](C)CC2)C1 ZINC000070643692 135001271 /nfs/dbraw/zinc/00/12/71/135001271.db2.gz KBWOQPWHNNAUAO-JSGCOSHPSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1cccc(CC[NH2+]CCC[NH+](C)C)c1 ZINC000163610029 135016915 /nfs/dbraw/zinc/01/69/15/135016915.db2.gz VFYDWXGIUMAQQU-UHFFFAOYSA-N 2 0 220.360 2.079 20 0 BEADRP C[C@H]1C[C@@H]1C[NH2+]CCC[NH+]1CCCCC1 ZINC000163630304 135023077 /nfs/dbraw/zinc/02/30/77/135023077.db2.gz YPHVMPSRDRPHIK-QWHCGFSZSA-N 2 0 210.365 2.108 20 0 BEADRP CC(C)CC[N@@H+]1C[C@@H]2CCC[C@H]([NH3+])[C@@H]2C1 ZINC000163666385 135040685 /nfs/dbraw/zinc/04/06/85/135040685.db2.gz NUCLYPABRYEUJQ-XQQFMLRXSA-N 2 0 210.365 2.092 20 0 BEADRP CCCC[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000249849650 135045989 /nfs/dbraw/zinc/04/59/89/135045989.db2.gz INRLUCPVNUWPIV-YNEHKIRRSA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@H](COC)[NH2+][C@@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000251098697 135064025 /nfs/dbraw/zinc/06/40/25/135064025.db2.gz QSJINEJGWISMFN-BFHYXJOUSA-N 2 0 242.407 2.312 20 0 BEADRP COCC[C@H](C)[NH2+][C@@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000251154561 135065064 /nfs/dbraw/zinc/06/50/64/135065064.db2.gz BFGHGHSGWPHYNT-MELADBBJSA-N 2 0 242.407 2.312 20 0 BEADRP C[C@@H]1C[N@H+](CCCOc2ccccc2)CC[C@H]1[NH3+] ZINC000251834927 135078832 /nfs/dbraw/zinc/07/88/32/135078832.db2.gz PXJBGWUEEMSGFT-UKRRQHHQSA-N 2 0 248.370 2.125 20 0 BEADRP C[C@H]1C[N@H+](CCC2CCCC2)CC[C@H]1[NH3+] ZINC000251891951 135080264 /nfs/dbraw/zinc/08/02/64/135080264.db2.gz VQPPCRBHGUAXFG-WCQYABFASA-N 2 0 210.365 2.236 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]Cc2ccsc2)C1 ZINC000086404138 135083260 /nfs/dbraw/zinc/08/32/60/135083260.db2.gz MKWDGXXQKGBXIT-GHMZBOCLSA-N 2 0 210.346 2.108 20 0 BEADRP C[C@@H]1CCC[N@H+](CC[C@H]2CC[NH2+]C2)[C@H]1C ZINC000252196667 135086756 /nfs/dbraw/zinc/08/67/56/135086756.db2.gz SMNWGLPOTAGPIU-FRRDWIJNSA-N 2 0 210.365 2.106 20 0 BEADRP C1CC([NH2+][C@H]2CCC[C@@H]2[C@H]2CCCC[NH2+]2)C1 ZINC000086500062 135087432 /nfs/dbraw/zinc/08/74/32/135087432.db2.gz CNGPJEIAUDUBLH-MCIONIFRSA-N 2 0 222.376 2.439 20 0 BEADRP CC[C@H](C)[C@@H](C)[NH2+]C[C@H]1CC[N@H+](CC)C1 ZINC000252439517 135089012 /nfs/dbraw/zinc/08/90/12/135089012.db2.gz PPFDCIHSNHBGOP-YNEHKIRRSA-N 2 0 212.381 2.352 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CCCOC(C)C)[C@@H](C)C1 ZINC000252644012 135093539 /nfs/dbraw/zinc/09/35/39/135093539.db2.gz HYMMUXZRUMTPQI-UONOGXRCSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H]1CCCC[C@@H]1[NH2+]CC1CC[NH2+]CC1 ZINC000086700218 135095041 /nfs/dbraw/zinc/09/50/41/135095041.db2.gz RQTPKIDVJMASPH-AAEUAGOBSA-N 2 0 210.365 2.154 20 0 BEADRP CCc1ccc(C[N@@H+]2C[C@@H](C[NH3+])C[C@H]2C)cc1 ZINC000252697449 135098333 /nfs/dbraw/zinc/09/83/33/135098333.db2.gz HMBKIVGFRFODGX-IUODEOHRSA-N 2 0 232.371 2.418 20 0 BEADRP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]CCc1ccccc1 ZINC000252710984 135099533 /nfs/dbraw/zinc/09/95/33/135099533.db2.gz IFKNTQHOSCZARD-DZGCQCFKSA-N 2 0 232.371 2.159 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@@H]2CCCC2(C)C)CC1 ZINC000086857120 135099560 /nfs/dbraw/zinc/09/95/60/135099560.db2.gz HPCZBKFAPJEGKI-CYBMUJFWSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]CC1CCCC1 ZINC000252711813 135100464 /nfs/dbraw/zinc/10/04/64/135100464.db2.gz KRLJCZIYNXKGSH-DGCLKSJQSA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)CCC[NH2+][C@@H]1CC[N@H+](C)C[C@H]1C ZINC000252715304 135101672 /nfs/dbraw/zinc/10/16/72/135101672.db2.gz VEYBWBHZRZJHAJ-CHWSQXEVSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]CC1(C)CCCC1 ZINC000252729730 135103500 /nfs/dbraw/zinc/10/35/00/135103500.db2.gz IAPZSHYFRUURSX-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)CSCC[NH2+][C@@H]1CC[N@H+](C)C[C@H]1C ZINC000252732981 135104842 /nfs/dbraw/zinc/10/48/42/135104842.db2.gz XIZBWKOUULTOOD-CHWSQXEVSA-N 2 0 244.448 2.305 20 0 BEADRP CC(C)C1(C[NH2+][C@@H]2CC[N@H+](C)C[C@H]2C)CC1 ZINC000252731984 135104877 /nfs/dbraw/zinc/10/48/77/135104877.db2.gz SNUDHVCQFKJEFK-CHWSQXEVSA-N 2 0 224.392 2.352 20 0 BEADRP CCS[C@H]1CC[C@@H]([N@H+](C)CC(C)(C)[NH3+])C1 ZINC000261560081 135109878 /nfs/dbraw/zinc/10/98/78/135109878.db2.gz ZNJAYPDIJYZKSN-MNOVXSKESA-N 2 0 230.421 2.330 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[NH2+]C[C@@H]1C)c1ccccc1 ZINC000261599709 135110772 /nfs/dbraw/zinc/11/07/72/135110772.db2.gz ZYJNXGDTPNCJHR-SGMGOOAPSA-N 2 0 218.344 2.335 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[NH2+]C[C@@H]1C)c1ccccc1 ZINC000261599708 135111193 /nfs/dbraw/zinc/11/11/93/135111193.db2.gz ZYJNXGDTPNCJHR-OBJOEFQTSA-N 2 0 218.344 2.335 20 0 BEADRP CCSCCC[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000252816516 135111728 /nfs/dbraw/zinc/11/17/28/135111728.db2.gz KMJVVIQMIYHQLA-OLZOCXBDSA-N 2 0 242.432 2.346 20 0 BEADRP C[C@@H]1CC[N@H+](Cc2cccs2)C[C@H]1C[NH3+] ZINC000253183485 135123093 /nfs/dbraw/zinc/12/30/93/135123093.db2.gz GOSSCKJLDSKVQF-GHMZBOCLSA-N 2 0 224.373 2.165 20 0 BEADRP Cc1ccsc1C[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000087310051 135123688 /nfs/dbraw/zinc/12/36/88/135123688.db2.gz NKKPCEPCJAAPJF-NSHDSACASA-N 2 0 224.373 2.146 20 0 BEADRP C[C@@H]1CC[N@H+](Cc2ccsc2)C[C@H]1C[NH3+] ZINC000253200968 135124735 /nfs/dbraw/zinc/12/47/35/135124735.db2.gz XKBUNVDUFAERAO-ZYHUDNBSSA-N 2 0 224.373 2.165 20 0 BEADRP CC(C)CC[N@@H+]1CC[C@]2(C1)CCC[NH2+]C2 ZINC000257712890 135140818 /nfs/dbraw/zinc/14/08/18/135140818.db2.gz UAKPTSYMRTTXSX-CYBMUJFWSA-N 2 0 210.365 2.108 20 0 BEADRP CC(C)(C)[C@H]1CCC[N@@H+]1C[C@H]1CCC[NH2+]C1 ZINC000257782417 135141555 /nfs/dbraw/zinc/14/15/55/135141555.db2.gz QLPVATVGLHXTPK-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1[nH+]ccc(NC[C@@H]2CC[NH2+]C2)c1Cl ZINC000261529495 135155506 /nfs/dbraw/zinc/15/55/06/135155506.db2.gz AVPFFAGCBAGWJI-SECBINFHSA-N 2 0 225.723 2.065 20 0 BEADRP CC[C@H]([NH2+][C@@H](C)[C@@H](C)[NH3+])c1ccccc1 ZINC000261530266 135157677 /nfs/dbraw/zinc/15/76/77/135157677.db2.gz CDCRCTIXXRHFIV-MDZLAQPJSA-N 2 0 206.333 2.463 20 0 BEADRP CC(C)[C@H](C)[N@H+](C)C[C@H]1CC[NH2+][C@H](C)C1 ZINC000261530858 135159479 /nfs/dbraw/zinc/15/94/79/135159479.db2.gz DIDRAFOUPUORSR-AGIUHOORSA-N 2 0 212.381 2.351 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[NH2+]C[C@H]1C)C1CCCC1 ZINC000261531168 135159877 /nfs/dbraw/zinc/15/98/77/135159877.db2.gz FLOPIFHKIVAEEP-MDZLAQPJSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC[NH2+]C[C@H]1C)C1CCCC1 ZINC000261531169 135159940 /nfs/dbraw/zinc/15/99/40/135159940.db2.gz FLOPIFHKIVAEEP-NQBHXWOUSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@H]([NH2+]CC(C)(C)[NH3+])c1ccccc1 ZINC000261531515 135160555 /nfs/dbraw/zinc/16/05/55/135160555.db2.gz GVLXDZDGLXIVBD-LBPRGKRZSA-N 2 0 206.333 2.465 20 0 BEADRP CCc1ccc(C[N@H+](C)C2CC([NH3+])C2)cc1 ZINC000087653259 135160628 /nfs/dbraw/zinc/16/06/28/135160628.db2.gz WBMHKUFHDKCUGF-UHFFFAOYSA-N 2 0 218.344 2.171 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CCC[NH2+]C1)C1CCCC1 ZINC000087647311 135160904 /nfs/dbraw/zinc/16/09/04/135160904.db2.gz LYBKILNMIGMTHZ-VXGBXAGGSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]([NH2+]C[C@@H](C)c1ccccc1)[C@H](C)[NH3+] ZINC000261531654 135161034 /nfs/dbraw/zinc/16/10/34/135161034.db2.gz HKLLTGQAVHNDHM-GRYCIOLGSA-N 2 0 206.333 2.115 20 0 BEADRP Cc1cccc(C[NH2+]C[C@H]2CCC[NH2+]C2)c1 ZINC000087646160 135161173 /nfs/dbraw/zinc/16/11/73/135161173.db2.gz CHNILIVPNKWBLW-AWEZNQCLSA-N 2 0 218.344 2.084 20 0 BEADRP Cc1[nH+]ccc(N[C@H]2CCC[NH2+]C2)c1Cl ZINC000261531914 135161473 /nfs/dbraw/zinc/16/14/73/135161473.db2.gz IJJBHONITIDGQA-VIFPVBQESA-N 2 0 225.723 2.207 20 0 BEADRP CC(C)(C)CC[NH2+][C@H]1CC[NH2+]CC1(C)C ZINC000261531856 135161933 /nfs/dbraw/zinc/16/19/33/135161933.db2.gz IBNMQQXKXZGCHV-NSHDSACASA-N 2 0 212.381 2.400 20 0 BEADRP CC1(C)CC[C@H]1[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000261532599 135163099 /nfs/dbraw/zinc/16/30/99/135163099.db2.gz JXNUEOUCORBLLO-DGCLKSJQSA-N 2 0 210.365 2.154 20 0 BEADRP CC(C)C[N@H+](C[C@H]1CC[NH2+][C@H](C)C1)C1CC1 ZINC000261534210 135166438 /nfs/dbraw/zinc/16/64/38/135166438.db2.gz OTNOTEOISXTQPE-OLZOCXBDSA-N 2 0 224.392 2.495 20 0 BEADRP CSc1ccc(CN2C[C@@H](C)[C@H]([NH3+])C2)cc1 ZINC000261534340 135166837 /nfs/dbraw/zinc/16/68/37/135166837.db2.gz PZAHVCYKCZFBQZ-ZWNOBZJWSA-N 2 0 236.384 2.188 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+]C[C@@H]1CCC[C@@H]([NH3+])C1 ZINC000261535059 135168679 /nfs/dbraw/zinc/16/86/79/135168679.db2.gz NPEFDBDQWIEZCJ-UTUOFQBUSA-N 2 0 210.365 2.282 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+]C[C@@H]1CCC[C@H]([NH3+])C1 ZINC000261535060 135169140 /nfs/dbraw/zinc/16/91/40/135169140.db2.gz NPEFDBDQWIEZCJ-WOPDTQHZSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2CCCC[C@H]2C)CC[NH2+]1 ZINC000261535302 135169478 /nfs/dbraw/zinc/16/94/78/135169478.db2.gz OBLVBDRSHHJVOE-JHJVBQTASA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H]([NH3+])[C@@H]1CC[N@H+](CCC2CCCC2)C1 ZINC000261535560 135169590 /nfs/dbraw/zinc/16/95/90/135169590.db2.gz ONXWXSRLUDJVDF-DGCLKSJQSA-N 2 0 210.365 2.236 20 0 BEADRP CC(C)([NH3+])C[NH2+][C@@H]1CCc2ccccc21 ZINC000261537388 135173826 /nfs/dbraw/zinc/17/38/26/135173826.db2.gz VLXXLKNKDUNNIX-GFCCVEGCSA-N 2 0 204.317 2.001 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+]CC1CCCCC1 ZINC000261538480 135176378 /nfs/dbraw/zinc/17/63/78/135176378.db2.gz YGBVPRXODRERLQ-DGCLKSJQSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H]1CCCC[N@H+](C[C@H]2CCC[NH2+]C2)C1 ZINC000261539322 135177841 /nfs/dbraw/zinc/17/78/41/135177841.db2.gz CCRCMMGMJILHSB-STQMWFEESA-N 2 0 210.365 2.108 20 0 BEADRP C[C@H]1CN(c2cc[nH+]c3ccccc32)C[C@H]1[NH3+] ZINC000261540278 135179353 /nfs/dbraw/zinc/17/93/53/135179353.db2.gz FOEYTZBFVYKWDI-CMPLNLGQSA-N 2 0 227.311 2.018 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC[NH2+]C[C@H]1C)c1ccccc1 ZINC000261540469 135179599 /nfs/dbraw/zinc/17/95/99/135179599.db2.gz AGBXKHCZLDHUEK-NFAWXSAZSA-N 2 0 232.371 2.378 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+][C@H]1CCc2ccccc21 ZINC000261540968 135179942 /nfs/dbraw/zinc/17/99/42/135179942.db2.gz ASTKXPSEOHVVSF-DFBGVHRSSA-N 2 0 230.355 2.262 20 0 BEADRP C[C@H]1[C@@H]([NH3+])CCN1Cc1ccc(C2CC2)cc1 ZINC000261544052 135185220 /nfs/dbraw/zinc/18/52/20/135185220.db2.gz DNVRPUTVNLAKCK-NHYWBVRUSA-N 2 0 230.355 2.486 20 0 BEADRP C[C@@H]1C[N@H+](CC2CC[NH2+]CC2)C(C)(C)C1 ZINC000261548691 135187735 /nfs/dbraw/zinc/18/77/35/135187735.db2.gz NVYXZAZJANVJMD-NSHDSACASA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]1CCCC[N@H+](C[C@@]2(C)CC[NH2+]C2)C1 ZINC000261551334 135189848 /nfs/dbraw/zinc/18/98/48/135189848.db2.gz QJGAGMVXVZPUCP-STQMWFEESA-N 2 0 210.365 2.108 20 0 BEADRP CC1CCC(C[N@@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@@H]3C2)CC1 ZINC000261550949 135190343 /nfs/dbraw/zinc/19/03/43/135190343.db2.gz LQDLKCGVTBUCIF-MMCPYJTDSA-N 2 0 236.403 2.482 20 0 BEADRP Cc1ncsc1C[NH2+][C@@H]1CCCC[C@H]1C[NH3+] ZINC000084216806 135192625 /nfs/dbraw/zinc/19/26/25/135192625.db2.gz NTNYQFDCGIOWMU-WDEREUQCSA-N 2 0 239.388 2.059 20 0 BEADRP CCOc1ccc(CN2CC[C@H]([NH3+])[C@@H]2C)cc1 ZINC000261558405 135199268 /nfs/dbraw/zinc/19/92/68/135199268.db2.gz SHXRZSDQJYXLIH-FZMZJTMJSA-N 2 0 234.343 2.007 20 0 BEADRP C[C@H]1[C@H]([NH3+])CCN1Cc1cccc(C2CC2)c1 ZINC000261558867 135199315 /nfs/dbraw/zinc/19/93/15/135199315.db2.gz SUIRFAXHGTYVFR-XHDPSFHLSA-N 2 0 230.355 2.486 20 0 BEADRP Cc1cccc(C)c1C[N@@H+]1CC[C@]2(CC[NH2+]C2)C1 ZINC000261561039 135201837 /nfs/dbraw/zinc/20/18/37/135201837.db2.gz FRYYUSRDJCWHSM-INIZCTEOSA-N 2 0 244.382 2.489 20 0 BEADRP Cc1ccccc1C[N@@H+]1CC[C@@H]2[NH2+]CC[C@H]2C1 ZINC000261561679 135203000 /nfs/dbraw/zinc/20/30/00/135203000.db2.gz VPESSKODPJYVGW-GJZGRUSLSA-N 2 0 230.355 2.179 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@@H]3[NH2+]CC[C@H]3C2)c(C)c1 ZINC000261562770 135204770 /nfs/dbraw/zinc/20/47/70/135204770.db2.gz GQAOJNDEPBCGAN-HOTGVXAUSA-N 2 0 244.382 2.487 20 0 BEADRP Fc1cccc(CN2CC[C@@H]3[NH2+]CC[C@H]3C2)c1 ZINC000261563398 135205339 /nfs/dbraw/zinc/20/53/39/135205339.db2.gz XBCRYJORSRBKLU-JSGCOSHPSA-N 2 0 234.318 2.010 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]1[NH2+]Cc1cccc(F)c1 ZINC000261562944 135205621 /nfs/dbraw/zinc/20/56/21/135205621.db2.gz WSVOOXALSWVKDT-CYBMUJFWSA-N 2 0 236.334 2.303 20 0 BEADRP C[NH+](C)CCC[NH2+]CC1CCCCCC1 ZINC000084328226 135211206 /nfs/dbraw/zinc/21/12/06/135211206.db2.gz ASBUSJVRWAZOMA-UHFFFAOYSA-N 2 0 212.381 2.498 20 0 BEADRP Cc1cccc(NCC2([NH3+])CCCCC2)n1 ZINC000261569094 135211217 /nfs/dbraw/zinc/21/12/17/135211217.db2.gz GCNYQNYMBRUVCT-UHFFFAOYSA-N 2 0 219.332 2.464 20 0 BEADRP Cc1ccccc1C[NH2+][C@](C)(C[NH3+])C(C)C ZINC000261571047 135213466 /nfs/dbraw/zinc/21/34/66/135213466.db2.gz HIRCRNYTAPIZMN-CQSZACIVSA-N 2 0 220.360 2.458 20 0 BEADRP C[C@@H]1SCC[N@H+](CC[C@@H]2CCC[NH2+]C2)[C@H]1C ZINC000164176513 135214443 /nfs/dbraw/zinc/21/44/43/135214443.db2.gz WKCYGPCGWMNDGQ-AVGNSLFASA-N 2 0 242.432 2.202 20 0 BEADRP Cc1cc(F)ccc1CN1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000261576467 135217751 /nfs/dbraw/zinc/21/77/51/135217751.db2.gz NQXHUKXOXULNQA-GXTWGEPZSA-N 2 0 248.345 2.175 20 0 BEADRP CCc1ccccc1C[N@@H+]1CC[C@@]2(CC[NH2+]C2)C1 ZINC000261576258 135217770 /nfs/dbraw/zinc/21/77/70/135217770.db2.gz NOIFIPZENKZOOT-MRXNPFEDSA-N 2 0 244.382 2.434 20 0 BEADRP CC(C)([NH3+])C[NH2+][C@@H](c1ccccc1)C1CC1 ZINC000261576893 135218657 /nfs/dbraw/zinc/21/86/57/135218657.db2.gz KQTSOIRLNCHWLK-ZDUSSCGKSA-N 2 0 218.344 2.465 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2C[C@@H]([NH3+])c3ccccc32)CCO1 ZINC000261580988 135221222 /nfs/dbraw/zinc/22/12/22/135221222.db2.gz QGVDSYPBTDDYBZ-FKGLVLAHSA-N 2 0 246.354 2.288 20 0 BEADRP CC1(C[N@@H+]2C[C@@H]3CCC[C@@H]([NH3+])[C@@H]3C2)CCC1 ZINC000261580796 135221841 /nfs/dbraw/zinc/22/18/41/135221841.db2.gz NDJFEOZGWJGZGI-YNEHKIRRSA-N 2 0 222.376 2.236 20 0 BEADRP C[C@H](C[N@@H+]1CC[C@@H]2C[NH2+]C[C@H]2C1)c1ccccc1 ZINC000261581333 135222403 /nfs/dbraw/zinc/22/24/03/135222403.db2.gz QPBQNOXPLLRNRL-BMFZPTHFSA-N 2 0 244.382 2.331 20 0 BEADRP CC1CCC(C[N@@H+]2CC[C@@](C)(C[NH3+])C2)CC1 ZINC000261582347 135223599 /nfs/dbraw/zinc/22/35/99/135223599.db2.gz OFQSGIOBFCROEL-RUXDESIVSA-N 2 0 224.392 2.483 20 0 BEADRP CC1CCC(C[NH2+][C@H]2CC[NH2+]C[C@H]2C)CC1 ZINC000261582810 135224202 /nfs/dbraw/zinc/22/42/02/135224202.db2.gz OSIRHHWQUXRDMM-HHTDUIENSA-N 2 0 224.392 2.400 20 0 BEADRP Cc1[nH+]ccc(NCC[C@@H]2CC[NH2+]C2)c1Cl ZINC000261584392 135225151 /nfs/dbraw/zinc/22/51/51/135225151.db2.gz PUYQBULPCZJSRC-JTQLQIEISA-N 2 0 239.750 2.455 20 0 BEADRP CC(C)([NH3+])C[NH2+][C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000261584331 135225402 /nfs/dbraw/zinc/22/54/02/135225402.db2.gz PQBKTUVSYJDLDW-IUCAKERBSA-N 2 0 238.297 2.434 20 0 BEADRP Cc1ccc(C)c(C[N@@H+]2CC[C@H]3C[NH2+]C[C@H]3C2)c1 ZINC000261585621 135226711 /nfs/dbraw/zinc/22/67/11/135226711.db2.gz TYCRLJLTKXELAM-HOCLYGCPSA-N 2 0 244.382 2.345 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[NH2+]C[C@H]2C)C[C@H]1C ZINC000261586988 135228464 /nfs/dbraw/zinc/22/84/64/135228464.db2.gz RLOLMQJTJSSXLZ-XGFWRYKXSA-N 2 0 224.392 2.399 20 0 BEADRP Cc1cc(C)cc(C[N@@H+]2CC[C@@H]3[NH2+]CC[C@H]3C2)c1 ZINC000261589787 135230285 /nfs/dbraw/zinc/23/02/85/135230285.db2.gz WMYTWLLGLFKGKP-HOTGVXAUSA-N 2 0 244.382 2.487 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@H]3C[NH2+]C[C@H]3C2)cc1C ZINC000261590723 135230828 /nfs/dbraw/zinc/23/08/28/135230828.db2.gz XEPPAELUYCIUJT-HOTGVXAUSA-N 2 0 244.382 2.345 20 0 BEADRP Cc1ccsc1C[N@@H+]1CC[C@H]2[NH2+]CC[C@@H]2C1 ZINC000261592430 135232660 /nfs/dbraw/zinc/23/26/60/135232660.db2.gz VWDSRHQUJQZJNW-VXGBXAGGSA-N 2 0 236.384 2.240 20 0 BEADRP Cc1ccccc1C[NH2+][C@@H]1CC[NH2+]C[C@H]1C ZINC000261593597 135234305 /nfs/dbraw/zinc/23/43/05/135234305.db2.gz WZAZIZISVPFZAX-TZMCWYRMSA-N 2 0 218.344 2.083 20 0 BEADRP [NH3+]C[C@@H]1CC[N@H+](Cc2cnc3ccccc3c2)C1 ZINC000261545893 135238045 /nfs/dbraw/zinc/23/80/45/135238045.db2.gz MWEIFBSLJCEECS-LBPRGKRZSA-N 2 0 241.338 2.015 20 0 BEADRP CC[C@@H]1[C@@H](C)CC[N@@H+]1CC1CC[NH2+]CC1 ZINC000261546633 135239554 /nfs/dbraw/zinc/23/95/54/135239554.db2.gz LCGFSXSDRPPVDA-WCQYABFASA-N 2 0 210.365 2.106 20 0 BEADRP CCC[N@H+](C[C@@H]1C[C@@H]1C)C1CC[NH2+]CC1 ZINC000261547317 135240143 /nfs/dbraw/zinc/24/01/43/135240143.db2.gz MCHPFPOSWMXQQB-RYUDHWBXSA-N 2 0 210.365 2.106 20 0 BEADRP COc1ccc(C[NH2+][C@@](C)(C[NH3+])C(C)C)cc1 ZINC000261548072 135241655 /nfs/dbraw/zinc/24/16/55/135241655.db2.gz JBKQAGNJVTZCKB-AWEZNQCLSA-N 2 0 236.359 2.158 20 0 BEADRP C[C@H]1CC2(CCC2)C[N@@H+]1C[C@@]1(C)CC[NH2+]C1 ZINC000261740112 135248806 /nfs/dbraw/zinc/24/88/06/135248806.db2.gz IHBACOPDXKTAJN-STQMWFEESA-N 2 0 222.376 2.251 20 0 BEADRP C[C@@H]1C[C@H]1C[NH+]1CCC([C@@H]2CCC[NH2+]2)CC1 ZINC000261760770 135250915 /nfs/dbraw/zinc/25/09/15/135250915.db2.gz CYDVLUXSSZRSKX-XBFCOCLRSA-N 2 0 222.376 2.106 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@]2(C)CC[NH2+]C2)CC1(C)C ZINC000261768988 135251282 /nfs/dbraw/zinc/25/12/82/135251282.db2.gz MIOCHGPBBOSMQM-TZMCWYRMSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@@]2(C)CC[NH2+]C2)CC1(C)C ZINC000261768986 135251425 /nfs/dbraw/zinc/25/14/25/135251425.db2.gz MIOCHGPBBOSMQM-OCCSQVGLSA-N 2 0 224.392 2.354 20 0 BEADRP Cc1ccc2cc(CN(C)[C@H](C)C[NH3+])ccc2n1 ZINC000261805605 135254579 /nfs/dbraw/zinc/25/45/79/135254579.db2.gz HHKOJJJUKANYBR-GFCCVEGCSA-N 2 0 243.354 2.322 20 0 BEADRP C[C@@H]1C[N@H+](C[C@]2(C)CC[NH2+]C2)[C@@H]2CCCC[C@@H]21 ZINC000261914141 135262409 /nfs/dbraw/zinc/26/24/09/135262409.db2.gz YYQKIYCZXFZKPH-KBUPBQIOSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H]1C[N@H+](C[C@@H]2CCC[NH2+]C2)CC(C)(C)C1 ZINC000261985108 135270020 /nfs/dbraw/zinc/27/00/20/135270020.db2.gz RVGZBQXHIWFXSL-CHWSQXEVSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2CC[C@H]3CCC[C@@H]32)CC[NH2+]1 ZINC000262013533 135273006 /nfs/dbraw/zinc/27/30/06/135273006.db2.gz UZPGLQJZOLKUSJ-SYQHCUMBSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@@H]1CCCC[C@H]1C[N@@H+]1CC[C@]2(CC[NH2+]C2)C1 ZINC000262122202 135280280 /nfs/dbraw/zinc/28/02/80/135280280.db2.gz XJDGNGXMHKAPOG-ILXRZTDVSA-N 2 0 236.403 2.498 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[N@@H+]1CC[C@@]2(CC[NH2+]C2)C1 ZINC000262122207 135280616 /nfs/dbraw/zinc/28/06/16/135280616.db2.gz XJDGNGXMHKAPOG-RBSFLKMASA-N 2 0 236.403 2.498 20 0 BEADRP Cc1ccc(C)c(OC2CCN(CC[NH3+])CC2)c1 ZINC000262958664 135324854 /nfs/dbraw/zinc/32/48/54/135324854.db2.gz KLFDITVGZNIENC-UHFFFAOYSA-N 2 0 248.370 2.105 20 0 BEADRP CC[C@H](COC)[NH2+]C[C@@H](C)C[NH+]1CCCCC1 ZINC000079713142 135355706 /nfs/dbraw/zinc/35/57/06/135355706.db2.gz YLBGBELYZLKZCT-ZIAGYGMSSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)CC[N@@H+]1CCC[C@H]2C[NH+](C)CC[C@@H]21 ZINC000334356229 135369282 /nfs/dbraw/zinc/36/92/82/135369282.db2.gz MTUINFFTJLUFAL-KBPBESRZSA-N 2 0 224.392 2.449 20 0 BEADRP C[C@@H]1CCC[C@H](C[N@@H+]2C[C@H]3CCC[NH2+][C@H]3C2)C1 ZINC000299916042 135381592 /nfs/dbraw/zinc/38/15/92/135381592.db2.gz GXQFRDSJRVWWGQ-BARDWOONSA-N 2 0 236.403 2.497 20 0 BEADRP CC1CCC([NH2+][C@H]2CCC[C@@H]2C[NH3+])CC1 ZINC000084217595 135466988 /nfs/dbraw/zinc/46/69/88/135466988.db2.gz HAOOSEZGYOBHKQ-KPFVRQRISA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]Cc1ccccc1F ZINC000084217777 135467101 /nfs/dbraw/zinc/46/71/01/135467101.db2.gz DNDLVQMIDTWDET-ZWNOBZJWSA-N 2 0 222.307 2.043 20 0 BEADRP Cc1ccc(C[NH2+]CC[C@@H]2CC[NH2+]C2)s1 ZINC000084385638 135470701 /nfs/dbraw/zinc/47/07/01/135470701.db2.gz PPAXQCFMOIEYTH-NSHDSACASA-N 2 0 224.373 2.146 20 0 BEADRP c1ccc2c(c1)C[NH+](CC[C@H]1CC[NH2+]C1)C2 ZINC000084385688 135471121 /nfs/dbraw/zinc/47/11/21/135471121.db2.gz IMURBVYVXGBTRE-GFCCVEGCSA-N 2 0 216.328 2.002 20 0 BEADRP CC(C)CO[C@H]1C[C@@H]([NH2+]CCCC[NH3+])C1(C)C ZINC000085400663 135484318 /nfs/dbraw/zinc/48/43/18/135484318.db2.gz GRXGKIFNPPFZCL-OLZOCXBDSA-N 2 0 242.407 2.155 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]Cc2cccc(F)c2)C1 ZINC000086402576 135490812 /nfs/dbraw/zinc/49/08/12/135490812.db2.gz HLGJHGLYWZBHLJ-CHWSQXEVSA-N 2 0 222.307 2.185 20 0 BEADRP C(CC1CC1)[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000086494532 135492793 /nfs/dbraw/zinc/49/27/93/135492793.db2.gz NHIDYHLFFLFSTE-MJBXVCDLSA-N 2 0 222.376 2.297 20 0 BEADRP COc1ccccc1C[NH2+][C@H]1CCCC[C@@H]1C[NH3+] ZINC000089139034 135531189 /nfs/dbraw/zinc/53/11/89/135531189.db2.gz IQYRKEYSFDNPEV-OCCSQVGLSA-N 2 0 248.370 2.302 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H]2CCCOCC2)CCCCCC1 ZINC000334837403 135818987 /nfs/dbraw/zinc/81/89/87/135818987.db2.gz LRJFKWWNTPXEOA-CYBMUJFWSA-N 2 0 240.391 2.197 20 0 BEADRP CC1CCC([NH2+][C@@H]2CC[C@@H](C[NH3+])C2)CC1 ZINC000334863379 135826890 /nfs/dbraw/zinc/82/68/90/135826890.db2.gz MWKQCUKLDSPZTG-POOIEITISA-N 2 0 210.365 2.282 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CC[NH2+][C@H](C)C2)cc1 ZINC000334864398 135827186 /nfs/dbraw/zinc/82/71/86/135827186.db2.gz PHOJWWZRJUXBTK-TZMCWYRMSA-N 2 0 218.344 2.225 20 0 BEADRP Cc1cccc2c1CC[C@@H]2[NH2+]CC1=CC[NH2+]CC1 ZINC000335061494 135885908 /nfs/dbraw/zinc/88/59/08/135885908.db2.gz WYHCIILMDBYYAW-INIZCTEOSA-N 2 0 242.366 2.492 20 0 BEADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@@H](CC)C1CC1 ZINC000166050377 135929854 /nfs/dbraw/zinc/92/98/54/135929854.db2.gz MNIOGYZBSAICOW-KGLIPLIRSA-N 2 0 242.407 2.121 20 0 BEADRP c1ccc(C2([NH2+]CC3CC[NH2+]CC3)CC2)cc1 ZINC000347000820 135989278 /nfs/dbraw/zinc/98/92/78/135989278.db2.gz ZJUOBYXKIZLJOW-UHFFFAOYSA-N 2 0 230.355 2.265 20 0 BEADRP CC(C)[C@H](C)[N@H+](C)CC[C@@H]1CCC[NH+]1C ZINC000348078410 136034551 /nfs/dbraw/zinc/03/45/51/136034551.db2.gz LAMJCSXKBSYTJB-STQMWFEESA-N 2 0 212.381 2.447 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@@H]2C[C@H]2C(F)F)CC1 ZINC000348116391 136037733 /nfs/dbraw/zinc/03/77/33/136037733.db2.gz KOGLPSQPGFYRLF-GHMZBOCLSA-N 2 0 232.318 2.102 20 0 BEADRP [NH3+]CC1CCC([NH2+][C@H]2CCC[C@@H](F)C2)CC1 ZINC000335386991 136089198 /nfs/dbraw/zinc/08/91/98/136089198.db2.gz ORLOLBHOGMJUNL-KPFVRQRISA-N 2 0 228.355 2.374 20 0 BEADRP Cc1cc(N)cc(C[NH2+][C@H]2CC[NH2+]CC[C@@H]2C)c1 ZINC000335363903 136095148 /nfs/dbraw/zinc/09/51/48/136095148.db2.gz UAJUFNFNOKJHHD-WFASDCNBSA-N 2 0 247.386 2.055 20 0 BEADRP Cc1cccc2c1[C@H](C)C[C@@H]2[NH2+]CC1C[NH2+]C1 ZINC000335551539 136097955 /nfs/dbraw/zinc/09/79/55/136097955.db2.gz HKYVJVUJEWOGIN-RISCZKNCSA-N 2 0 230.355 2.352 20 0 BEADRP C[C@H]1CCc2c(F)cccc2[C@@H]1[NH2+]CC1C[NH2+]C1 ZINC000335553066 136098789 /nfs/dbraw/zinc/09/87/89/136098789.db2.gz STZVDGFCNOPRGJ-ZUZCIYMTSA-N 2 0 248.345 2.258 20 0 BEADRP COc1ccc2c(c1)[C@H]([NH2+]C1CC[NH2+]CC1)CC2 ZINC000335566998 136108058 /nfs/dbraw/zinc/10/80/58/136108058.db2.gz HTNCDIRNTIRWDM-OAHLLOKOSA-N 2 0 246.354 2.024 20 0 BEADRP C[C@H]1CC[C@H]([NH2+]C2CCC(C[NH3+])CC2)C1 ZINC000335567629 136108151 /nfs/dbraw/zinc/10/81/51/136108151.db2.gz MEMYPDZSIWWHDY-WTIISPKJSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]([NH2+]C1CC[NH2+]CC1)C1C(C)(C)C1(C)C ZINC000335571087 136109639 /nfs/dbraw/zinc/10/96/39/136109639.db2.gz ZEIXZJZOPXXSCM-JTQLQIEISA-N 2 0 224.392 2.399 20 0 BEADRP CC[C@H](C)C[N@@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC000335571546 136110045 /nfs/dbraw/zinc/11/00/45/136110045.db2.gz FLVRDMSGMPPFBC-STQMWFEESA-N 2 0 210.365 2.060 20 0 BEADRP CC1([NH3+])CC[NH+](Cc2ccc3c(c2)CCC3)CC1 ZINC000647531328 397779486 /nfs/dbraw/zinc/77/94/86/397779486.db2.gz OUPQKIFQKMONBW-UHFFFAOYSA-N 2 0 244.382 2.489 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]C[C@H]1CCCC[N@H+](C)C1 ZINC000624121269 397801402 /nfs/dbraw/zinc/80/14/02/397801402.db2.gz SBWSGUJIOLOLOM-GXTWGEPZSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH+](C)CCC[NH2+][C@@H]1CC[C@@H]1C(C)(C)C ZINC000309036914 397846769 /nfs/dbraw/zinc/84/67/69/397846769.db2.gz IQPMYGIMBNBBMT-NWDGAFQWSA-N 2 0 212.381 2.352 20 0 BEADRP C[NH+](C)CCC[NH2+][C@@H]1CC[C@H]1C(C)(C)C ZINC000309036916 397846788 /nfs/dbraw/zinc/84/67/88/397846788.db2.gz IQPMYGIMBNBBMT-VXGBXAGGSA-N 2 0 212.381 2.352 20 0 BEADRP CC(C)=CCC[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000309101980 397850974 /nfs/dbraw/zinc/85/09/74/397850974.db2.gz GGCCJUQHYBKFPF-OLZOCXBDSA-N 2 0 210.365 2.415 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CCc1ccccc1F ZINC000310116178 397878790 /nfs/dbraw/zinc/87/87/90/397878790.db2.gz CMANAZWKZMQZHO-GFCCVEGCSA-N 2 0 238.350 2.475 20 0 BEADRP Cc1sccc1C[NH2+]CC1=CC[N@H+](C)CC1 ZINC000293143770 397940019 /nfs/dbraw/zinc/94/00/19/397940019.db2.gz DCQHQAYTHZKOEK-UHFFFAOYSA-N 2 0 236.384 2.408 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@@H]2CSC[C@H]2C)CC1 ZINC000304485093 397952760 /nfs/dbraw/zinc/95/27/60/397952760.db2.gz LTTRBGPCBJSDKB-DGCLKSJQSA-N 2 0 242.432 2.200 20 0 BEADRP CCCCOCCC[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000221679261 398046200 /nfs/dbraw/zinc/04/62/00/398046200.db2.gz WCAQOSVYICPHND-KBPBESRZSA-N 2 0 242.407 2.266 20 0 BEADRP C[N@@H+]1CCC[C@@H]1CC[NH+]1CCC12CCCC2 ZINC000649657803 398025823 /nfs/dbraw/zinc/02/58/23/398025823.db2.gz NKFDPAZPMATBLH-CYBMUJFWSA-N 2 0 222.376 2.489 20 0 BEADRP C(C1CCCC1)[N@@H+]1CCC[C@@H]([C@@H]2CC[NH2+]C2)C1 ZINC000414777371 398035240 /nfs/dbraw/zinc/03/52/40/398035240.db2.gz IENQWQOEBYKJOS-HUUCEWRRSA-N 2 0 236.403 2.498 20 0 BEADRP CCc1ccc(CC[NH+]2CCC([NH3+])CC2)cc1 ZINC000071536474 397975353 /nfs/dbraw/zinc/97/53/53/397975353.db2.gz MGOBHPFBDOZXNU-UHFFFAOYSA-N 2 0 232.371 2.215 20 0 BEADRP C[C@@H]1C[C@H](C)[N@H+](CC2CCC2)C[C@H]1C[NH3+] ZINC000397321479 397976591 /nfs/dbraw/zinc/97/65/91/397976591.db2.gz SXUIMHBGRVDDCH-NTZNESFSSA-N 2 0 210.365 2.092 20 0 BEADRP Cc1ccoc1CN1CC[C@H]2CC[N@@H+](C)C[C@@H]21 ZINC000272625690 397980335 /nfs/dbraw/zinc/98/03/35/397980335.db2.gz MNNJFUBWGPABCX-OLZOCXBDSA-N 2 0 234.343 2.114 20 0 BEADRP C[C@@H]([NH3+])[C@@H](C)[NH2+][C@H](C)Cc1cccs1 ZINC000389297142 398068796 /nfs/dbraw/zinc/06/87/96/398068796.db2.gz GZLDWBYAPUDLEI-OPRDCNLKSA-N 2 0 212.362 2.004 20 0 BEADRP CC[C@@H]1CN(CCC[NH+](CC)CC)[C@H](C)CO1 ZINC000649735591 398076811 /nfs/dbraw/zinc/07/68/11/398076811.db2.gz NIXCWSYIPYWEEO-ZIAGYGMSSA-N 2 0 242.407 2.218 20 0 BEADRP CC[C@H](O)[C@H](CC)[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000313148076 398094945 /nfs/dbraw/zinc/09/49/45/398094945.db2.gz KCZRBEDUXQFOLH-BARDWOONSA-N 2 0 248.370 2.270 20 0 BEADRP C1CC([NH2+][C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)C1 ZINC000086494446 398055230 /nfs/dbraw/zinc/05/52/30/398055230.db2.gz MRUGVJXLUDOKBZ-RWMBFGLXSA-N 2 0 208.349 2.049 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]C[C@@H](C)Cc1ccccc1 ZINC000414850665 398058325 /nfs/dbraw/zinc/05/83/25/398058325.db2.gz ZRCNABHJIVZELA-UONOGXRCSA-N 2 0 234.387 2.310 20 0 BEADRP CCc1ccc(C[NH2+]CCCC[NH+](C)C)o1 ZINC000051725051 398058567 /nfs/dbraw/zinc/05/85/67/398058567.db2.gz AWARFUUCJVAYPG-UHFFFAOYSA-N 2 0 224.348 2.273 20 0 BEADRP CCCC[C@H](CC)[NH2+]CCC[NH+](C)C ZINC000068985618 398099470 /nfs/dbraw/zinc/09/94/70/398099470.db2.gz ATCOZSIQWDQLFB-LBPRGKRZSA-N 2 0 200.370 2.497 20 0 BEADRP C[N@@H+]1CCC[C@H]1CC[NH2+]C1(C2CCC2)CC1 ZINC000649810592 398117082 /nfs/dbraw/zinc/11/70/82/398117082.db2.gz RMLINMHRFILMCW-ZDUSSCGKSA-N 2 0 222.376 2.393 20 0 BEADRP CC[N@H+](C)C[C@H]1CC[NH+](CCC(C)(C)OC)C1 ZINC000336691322 398132942 /nfs/dbraw/zinc/13/29/42/398132942.db2.gz GEIRANYNIYDJFM-CYBMUJFWSA-N 2 0 242.407 2.075 20 0 BEADRP CC1(C)CC[NH+](CC2(C)CC[NH2+]CC2)CC1 ZINC000062841973 1172782021 /nfs/dbraw/zinc/78/20/21/1172782021.db2.gz PDOHQOUDGOIFMX-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP [NH3+][C@@H]1CCC[C@H](C[NH2+]Cc2ccsc2)C1 ZINC000063147383 1172802525 /nfs/dbraw/zinc/80/25/25/1172802525.db2.gz NEKWJVZABGSRKT-CMPLNLGQSA-N 2 0 224.373 2.355 20 0 BEADRP CC(C)[NH2+]CCC[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC000037480273 167101873 /nfs/dbraw/zinc/10/18/73/167101873.db2.gz AWKYYQYWSFEXRM-BETUJISGSA-N 2 0 212.381 2.352 20 0 BEADRP CCc1ccc(C[NH2+]CC[C@@H]2CC[NH2+]C2)cc1 ZINC000258901812 322878421 /nfs/dbraw/zinc/87/84/21/322878421.db2.gz DLGQESVUNBMOMR-OAHLLOKOSA-N 2 0 232.371 2.338 20 0 BEADRP Cc1cccc(C[NH2+]CC[C@@H]2CCC[NH2+]C2)c1 ZINC000259171693 322882207 /nfs/dbraw/zinc/88/22/07/322882207.db2.gz YTJQZQLUTXAFTI-AWEZNQCLSA-N 2 0 232.371 2.474 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]Cc2cccc3c2NCC3)C1 ZINC000334849089 487573266 /nfs/dbraw/zinc/57/32/66/487573266.db2.gz VDIVYAJWHMIKGE-KBPBESRZSA-N 2 0 245.370 2.014 20 0 BEADRP [NH3+]CC[C@H]1CCCC[N@@H+]1CC1CC=CC1 ZINC000238559544 487586454 /nfs/dbraw/zinc/58/64/54/487586454.db2.gz IIVPGPJECHLTMJ-CYBMUJFWSA-N 2 0 208.349 2.156 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@H]2CS[C@@H](C)C2)CC1 ZINC000086935662 487593483 /nfs/dbraw/zinc/59/34/83/487593483.db2.gz ATSRSMYXMXLHEX-WCQYABFASA-N 2 0 242.432 2.202 20 0 BEADRP Cc1ccccc1C[NH2+][C@@H]1CC[C@H]2C[N@@H+](C)C[C@H]21 ZINC001651697437 1172977072 /nfs/dbraw/zinc/97/70/72/1172977072.db2.gz AACROSYEHBDTJL-ARFHVFGLSA-N 2 0 244.382 2.425 20 0 BEADRP C([C@@H]1C[C@H]2C[C@H]2C1)[N@@H+]1CCC[C@H]([C@@H]2CCC[NH2+]2)C1 ZINC000662265618 409563654 /nfs/dbraw/zinc/56/36/54/409563654.db2.gz SDGNNQZPKNRPBN-QMHWVQJVSA-N 2 0 248.414 2.497 20 0 BEADRP CO[C@@H](C[NH+]1CCC([NH3+])CC1)C1CCCCC1 ZINC000662241284 409528312 /nfs/dbraw/zinc/52/83/12/409528312.db2.gz RSMGBSPDTKQBGL-AWEZNQCLSA-N 2 0 240.391 2.005 20 0 BEADRP C[NH2+]C1CC[NH+](CCCC2CCC2)CC1 ZINC000662244416 409537631 /nfs/dbraw/zinc/53/76/31/409537631.db2.gz OBBJIEXHAKDSEG-UHFFFAOYSA-N 2 0 210.365 2.251 20 0 BEADRP C[NH2+]CC1CC[NH+](CCCC2CCC2)CC1 ZINC000662246106 409541139 /nfs/dbraw/zinc/54/11/39/409541139.db2.gz OYBWGMONQLVLRF-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP FCC[C@H]1CCC[N@H+](CC[C@H]2CC[NH2+]C2)C1 ZINC000662310138 409632488 /nfs/dbraw/zinc/63/24/88/409632488.db2.gz HNWZVAKUMNKLJA-CHWSQXEVSA-N 2 0 228.355 2.058 20 0 BEADRP C(C[N@@H+]1CCC[C@@]2(CC[NH2+]C2)C1)C1CCC1 ZINC000662278450 409598251 /nfs/dbraw/zinc/59/82/51/409598251.db2.gz XRUUNZCOWCLYMD-AWEZNQCLSA-N 2 0 222.376 2.252 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCC[C@@H](C)[C@H]1CC[NH3+] ZINC000404324974 409840650 /nfs/dbraw/zinc/84/06/50/409840650.db2.gz UFVNWHBLXICAMD-YNEHKIRRSA-N 2 0 212.381 2.482 20 0 BEADRP CS[C@@H](C)C[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000090726320 410009377 /nfs/dbraw/zinc/00/93/77/410009377.db2.gz SGNCVLZVJYFPNS-QWRGUYRKSA-N 2 0 230.421 2.058 20 0 BEADRP C[C@@H]1CSCC[N@@H+]1CCCC1CC[NH2+]CC1 ZINC000069762544 410011978 /nfs/dbraw/zinc/01/19/78/410011978.db2.gz RNMVITPPDBEQQL-GFCCVEGCSA-N 2 0 242.432 2.204 20 0 BEADRP CC[C@H]1CCC[N@H+](C[C@H]2CC[NH2+]C2)CC1 ZINC000251725279 487613163 /nfs/dbraw/zinc/61/31/63/487613163.db2.gz KDPTYCOQBZDIDX-STQMWFEESA-N 2 0 210.365 2.108 20 0 BEADRP CC(C)[C@@H]1CCC[C@@H]1[NH2+]CC12CC(C1)C[NH2+]2 ZINC000663498180 410275426 /nfs/dbraw/zinc/27/54/26/410275426.db2.gz MXYQVADCMJXFLP-QPPOZKHWSA-N 2 0 222.376 2.153 20 0 BEADRP CC(C)CC[C@@H](C)[NH2+]CC12CC(C1)C[NH2+]2 ZINC000663498983 410275493 /nfs/dbraw/zinc/27/54/93/410275493.db2.gz SSIZDAQYTYEGOY-PNESKVBLSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+]Cc1cccc2c1NCC2 ZINC000663498413 410275602 /nfs/dbraw/zinc/27/56/02/410275602.db2.gz CAJGIJHUVUKGGY-CQSZACIVSA-N 2 0 247.386 2.118 20 0 BEADRP C[N@H+](Cc1cccc2c1CCC2)C1CC([NH3+])C1 ZINC000650703889 410336033 /nfs/dbraw/zinc/33/60/33/410336033.db2.gz WTOYHWPNTOIEQT-UHFFFAOYSA-N 2 0 230.355 2.097 20 0 BEADRP C[C@H]1C[NH2+]CC[C@@H]1[NH2+]Cc1cccc2c1CCC2 ZINC000650703863 410336601 /nfs/dbraw/zinc/33/66/01/410336601.db2.gz VOULDSMBYVILMX-LRDDRELGSA-N 2 0 244.382 2.263 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CCC[C@@H](C)[C@@H]1CC[NH3+] ZINC000650711704 410340317 /nfs/dbraw/zinc/34/03/17/410340317.db2.gz AKWPUORCABKCGS-LPWJVIDDSA-N 2 0 210.365 2.092 20 0 BEADRP COCc1cccc(C[NH2+]CCC2(C[NH3+])CC2)c1 ZINC000650712558 410342633 /nfs/dbraw/zinc/34/26/33/410342633.db2.gz KGEMBKSXLRYVMA-UHFFFAOYSA-N 2 0 248.370 2.052 20 0 BEADRP [NH3+]CC1(CC[NH2+]Cc2ncc(Cl)s2)CC1 ZINC000650714007 410344904 /nfs/dbraw/zinc/34/49/04/410344904.db2.gz MSEUJLZAVKRLLR-UHFFFAOYSA-N 2 0 245.779 2.015 20 0 BEADRP C[C@@H](CC1CCC1)[NH2+]CCC1(C[NH3+])CC1 ZINC000650714294 410347469 /nfs/dbraw/zinc/34/74/69/410347469.db2.gz YEXZTZLWEGNPNZ-NSHDSACASA-N 2 0 210.365 2.284 20 0 BEADRP C[C@H](CC1CCC1)[NH2+]CCC1(C[NH3+])CC1 ZINC000650714293 410348017 /nfs/dbraw/zinc/34/80/17/410348017.db2.gz YEXZTZLWEGNPNZ-LLVKDONJSA-N 2 0 210.365 2.284 20 0 BEADRP C[NH2+]Cc1ccccc1C[NH2+]Cc1cccnc1 ZINC000650718609 410356395 /nfs/dbraw/zinc/35/63/95/410356395.db2.gz RZQBZTOWKAKVOM-UHFFFAOYSA-N 2 0 241.338 2.091 20 0 BEADRP C[C@@H]([NH2+]CCC1CC[NH2+]CC1)C(C)(C)C ZINC000650764040 410415233 /nfs/dbraw/zinc/41/52/33/410415233.db2.gz PBSNOJOIPYVDJZ-LLVKDONJSA-N 2 0 212.381 2.400 20 0 BEADRP CC(C)([NH3+])C[NH2+]CC[C@H]1CCc2ccccc2N1 ZINC000650720290 410357388 /nfs/dbraw/zinc/35/73/88/410357388.db2.gz KVCFGKGSJWCMNG-CYBMUJFWSA-N 2 0 247.386 2.130 20 0 BEADRP CC(C)([NH3+])C[NH2+]CC[C@@H]1CCc2ccccc2N1 ZINC000650720291 410357953 /nfs/dbraw/zinc/35/79/53/410357953.db2.gz KVCFGKGSJWCMNG-ZDUSSCGKSA-N 2 0 247.386 2.130 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@H]1CC(C)(C)C)C1C[NH2+]C1 ZINC000650742070 410374537 /nfs/dbraw/zinc/37/45/37/410374537.db2.gz QPVIAVUVDWKGSF-JBLDHEPKSA-N 2 0 210.365 2.009 20 0 BEADRP COc1cccc([C@H](C)[NH2+]CCC2(C[NH3+])CC2)c1 ZINC000650742655 410377620 /nfs/dbraw/zinc/37/76/20/410377620.db2.gz AZOXSSVEVLLQJZ-LBPRGKRZSA-N 2 0 248.370 2.475 20 0 BEADRP CC[C@H]([NH2+]CCC1(C[NH3+])CC1)[C@H]1C[C@@H]1C ZINC000650748474 410390528 /nfs/dbraw/zinc/39/05/28/410390528.db2.gz VCNJTFWBMZTNKI-SRVKXCTJSA-N 2 0 210.365 2.140 20 0 BEADRP C[C@H]([NH2+]Cc1ccc(C[NH3+])cc1F)[C@H]1C[C@H]1C ZINC000650755902 410403323 /nfs/dbraw/zinc/40/33/23/410403323.db2.gz PCOHXOZFIQDDRM-NRUUGDAUSA-N 2 0 236.334 2.419 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+]CCC1CC[NH2+]CC1 ZINC000650761623 410409106 /nfs/dbraw/zinc/40/91/06/410409106.db2.gz FLWCMOUJPQTWBA-CHWSQXEVSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]([NH2+]CCC1CC[NH2+]CC1)[C@H]1C[C@H]1C ZINC000650761911 410409741 /nfs/dbraw/zinc/40/97/41/410409741.db2.gz NJHHUOASYVZJSH-WZRBSPASSA-N 2 0 210.365 2.010 20 0 BEADRP CCCC[C@H](COC)[NH2+]CCC1CC[NH2+]CC1 ZINC000650763848 410414011 /nfs/dbraw/zinc/41/40/11/410414011.db2.gz KQFQVYXBNCRJLW-CQSZACIVSA-N 2 0 242.407 2.171 20 0 BEADRP CS[C@H](C)C[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000228900393 410450408 /nfs/dbraw/zinc/45/04/08/410450408.db2.gz HHIFPTUBNVWPMY-OASPWFOLSA-N 2 0 236.384 2.472 20 0 BEADRP C[C@H]1C[C@@H]([NH3+])CC[N@@H+]1Cc1cccc2c1CCC2 ZINC000653280258 410633711 /nfs/dbraw/zinc/63/37/11/410633711.db2.gz JFYJTMZPIDYIJT-WFASDCNBSA-N 2 0 244.382 2.487 20 0 BEADRP CC[NH+](CC)CC1CC[NH+]([C@@H](C)COC)CC1 ZINC000336719126 169769380 /nfs/dbraw/zinc/76/93/80/169769380.db2.gz XOWBPONWJSPRRP-ZDUSSCGKSA-N 2 0 242.407 2.075 20 0 BEADRP C([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)[C@H]1CCC[C@H]2C[C@H]21 ZINC000665263205 410737218 /nfs/dbraw/zinc/73/72/18/410737218.db2.gz IIADTNGVZDHKNU-AQSJMSBDSA-N 2 0 234.387 2.295 20 0 BEADRP C[C@@]1(CC[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)CC1(F)F ZINC000665266614 410740018 /nfs/dbraw/zinc/74/00/18/410740018.db2.gz GDSMUKNEBQBGSG-AYLPWXGPSA-N 2 0 244.329 2.294 20 0 BEADRP C[C@]1(CC[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)CC1(F)F ZINC000665266615 410740093 /nfs/dbraw/zinc/74/00/93/410740093.db2.gz GDSMUKNEBQBGSG-MBYGNEARSA-N 2 0 244.329 2.294 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[C@@H]1c1ccccc1 ZINC000665274024 410742949 /nfs/dbraw/zinc/74/29/49/410742949.db2.gz ICUJSGBQJRROHZ-TUVASFSCSA-N 2 0 230.355 2.402 20 0 BEADRP C([NH2+][C@H]1CCCC12CCC2)C12CC(C1)C[NH2+]2 ZINC000665280250 410754644 /nfs/dbraw/zinc/75/46/44/410754644.db2.gz WSWOQFKTSLWART-LXVYMNJGSA-N 2 0 220.360 2.051 20 0 BEADRP CC[C@H]([NH2+]CC[C@@H]([NH3+])C(C)C)[C@@H]1C[C@@H]1C ZINC000665282971 410763916 /nfs/dbraw/zinc/76/39/16/410763916.db2.gz FNTZTUVXHNWLQV-LOWDOPEQSA-N 2 0 212.381 2.384 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]CCCc2ccco2)C1 ZINC000665283612 410765672 /nfs/dbraw/zinc/76/56/72/410765672.db2.gz QTASPWLDAXWSLE-NWDGAFQWSA-N 2 0 222.332 2.072 20 0 BEADRP C[NH2+]C[C@@H](C)N[C@@H](C)c1sc(C)nc1C ZINC000665295677 410800043 /nfs/dbraw/zinc/80/00/43/410800043.db2.gz HQJSOVCGUFLJRX-SFYZADRCSA-N 2 0 227.377 2.018 20 0 BEADRP CC(C)C[N@H+](CCC1CC[NH2+]CC1)C1CC1 ZINC000042559868 166956604 /nfs/dbraw/zinc/95/66/04/166956604.db2.gz TWQCNXOONCOXFI-UHFFFAOYSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)C[NH2+]CCC[N@@H+]1CCCC[C@H]1C ZINC000019912957 167003648 /nfs/dbraw/zinc/00/36/48/167003648.db2.gz ASPYMTATKKHQCA-CYBMUJFWSA-N 2 0 212.381 2.497 20 0 BEADRP CC(C)C[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC000047848617 167009600 /nfs/dbraw/zinc/00/96/00/167009600.db2.gz FWDRLAFYHXNGQI-UHFFFAOYSA-N 2 0 220.360 2.494 20 0 BEADRP CC(C)C[NH2+][C@@H]1CC[N@H+](C)[C@H]2CCC[C@H]21 ZINC000367617970 167012015 /nfs/dbraw/zinc/01/20/15/167012015.db2.gz NZQPVXUNUSVPPF-XQQFMLRXSA-N 2 0 210.365 2.105 20 0 BEADRP CC(C)[NH2+]Cc1ccc(C[NH+](C)C)cc1 ZINC000022862392 167119515 /nfs/dbraw/zinc/11/95/15/167119515.db2.gz ZKINYGQQLCVZNS-UHFFFAOYSA-N 2 0 206.333 2.246 20 0 BEADRP CC(C)OCCC[N@@H+]1CCCC[C@@H]1CC[NH3+] ZINC000352504846 167213947 /nfs/dbraw/zinc/21/39/47/167213947.db2.gz VIJFQJJYCMVWCQ-CYBMUJFWSA-N 2 0 228.380 2.005 20 0 BEADRP CC(C)[C@@H](C)[N@H+](C)CC[C@@H]1CCC[NH2+]C1 ZINC000051919021 167369198 /nfs/dbraw/zinc/36/91/98/167369198.db2.gz ILCLDUCLYHAHAE-OLZOCXBDSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[NH2+]CC1)[C@H]1CC1(C)C ZINC000397752827 410933756 /nfs/dbraw/zinc/93/37/56/410933756.db2.gz CGYKLESZRGZHJH-SDDRHHMPSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@H]1Cc2ccccc21 ZINC000310272092 411015292 /nfs/dbraw/zinc/01/52/92/411015292.db2.gz NQUXHGOUWRGMIX-TZMCWYRMSA-N 2 0 232.371 2.433 20 0 BEADRP Cc1ccc(C[NH+]2CCC(C)([NH3+])CC2)s1 ZINC000309529129 411162824 /nfs/dbraw/zinc/16/28/24/411162824.db2.gz CKKZUDZSEPHUQX-UHFFFAOYSA-N 2 0 224.373 2.370 20 0 BEADRP CC(C)CC[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000400936405 411163592 /nfs/dbraw/zinc/16/35/92/411163592.db2.gz QWKCWAATIBEFOH-RWMBFGLXSA-N 2 0 210.365 2.010 20 0 BEADRP CC(C)(C)[C@@H]1CCC[N@@H+]1C[C@@H]1CC[NH2+]C1 ZINC000108324138 411144311 /nfs/dbraw/zinc/14/43/11/411144311.db2.gz JWBAPILCSYUBKG-NEPJUHHUSA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)CC[N@H+](C[C@H]1CCC[NH2+]C1)C1CC1 ZINC000109279761 411149809 /nfs/dbraw/zinc/14/98/09/411149809.db2.gz PKVUPVBJRDBEKP-ZDUSSCGKSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)CCC[NH2+]CC1CC[NH+](C)CC1 ZINC000054243380 411124056 /nfs/dbraw/zinc/12/40/56/411124056.db2.gz QKLQKUAQLODUPN-UHFFFAOYSA-N 2 0 212.381 2.354 20 0 BEADRP Cc1cccc(C[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)c1 ZINC000401032039 411173657 /nfs/dbraw/zinc/17/36/57/411173657.db2.gz XEZUYHWMWVSQFI-OWCLPIDISA-N 2 0 244.382 2.473 20 0 BEADRP C([NH2+][C@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)C1(C2CC2)CC1 ZINC000401056592 411174674 /nfs/dbraw/zinc/17/46/74/411174674.db2.gz CNLCVXNWSSEDDS-DYEKYZERSA-N 2 0 234.387 2.154 20 0 BEADRP C([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)C1(C2CC2)CC1 ZINC000401056594 411174824 /nfs/dbraw/zinc/17/48/24/411174824.db2.gz CNLCVXNWSSEDDS-MBNYWOFBSA-N 2 0 234.387 2.154 20 0 BEADRP CC(C)C[N@H+](C)CCC[NH2+][C@H](C)[C@H]1CCCO1 ZINC000652221938 411175816 /nfs/dbraw/zinc/17/58/16/411175816.db2.gz AIQRZAKXYBCGJH-ZIAGYGMSSA-N 2 0 242.407 2.121 20 0 BEADRP c1cc(C[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)cs1 ZINC000401082190 411176194 /nfs/dbraw/zinc/17/61/94/411176194.db2.gz SEPBEUKJVCOPMO-RWMBFGLXSA-N 2 0 236.384 2.226 20 0 BEADRP Fc1cccc(C[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)c1 ZINC000401079157 411176816 /nfs/dbraw/zinc/17/68/16/411176816.db2.gz QGNJIKCVTASXTH-KCQAQPDRSA-N 2 0 248.345 2.303 20 0 BEADRP Cc1noc(C)c1CN(C)CC[C@@H]([NH3+])C(C)C ZINC000123687576 411182389 /nfs/dbraw/zinc/18/23/89/411182389.db2.gz NUMMYWPVNFJPOB-CYBMUJFWSA-N 2 0 239.363 2.097 20 0 BEADRP CCC(CC)C[N@@H+]1CC[C@H]2CC[NH2+][C@H]2C1 ZINC000309996327 411194400 /nfs/dbraw/zinc/19/44/00/411194400.db2.gz CFFQNSQPOZXMIB-OLZOCXBDSA-N 2 0 210.365 2.106 20 0 BEADRP CCC(CC)C[N@@H+]1CC[C@@H]2CC[NH2+][C@@H]2C1 ZINC000309996331 411194645 /nfs/dbraw/zinc/19/46/45/411194645.db2.gz CFFQNSQPOZXMIB-QWHCGFSZSA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)N(C)C[C@@H](C)[NH2+]C1CC(CF)(CF)C1 ZINC000658019200 411200019 /nfs/dbraw/zinc/20/00/19/411200019.db2.gz KTGVJGJLKDQDJB-LLVKDONJSA-N 2 0 248.361 2.393 20 0 BEADRP Cc1cccc(CCC[NH2+][C@H]2CCC[C@H]([NH3+])C2)n1 ZINC000656199181 411202236 /nfs/dbraw/zinc/20/22/36/411202236.db2.gz VIVVZQHGILHZEK-ZFWWWQNUSA-N 2 0 247.386 2.182 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)C1C[NH2+]C1)C1CCC(F)(F)CC1 ZINC000656201959 411207962 /nfs/dbraw/zinc/20/79/62/411207962.db2.gz VUEKZNURSFHTJN-ZJUUUORDSA-N 2 0 246.345 2.398 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]C2CC3(CCC3)C2)C1 ZINC000656270055 411220101 /nfs/dbraw/zinc/22/01/01/411220101.db2.gz WUZACYPMROBVDQ-BJHJDKERSA-N 2 0 222.376 2.249 20 0 BEADRP CC1=CC[C@@H]([NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)CC1 ZINC000656269813 411220244 /nfs/dbraw/zinc/22/02/44/411220244.db2.gz VTHBMFDGJPVSHX-MCIONIFRSA-N 2 0 222.376 2.415 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CC(C)(C)C[NH+](C)C)CS1 ZINC000655679737 411222524 /nfs/dbraw/zinc/22/25/24/411222524.db2.gz GBPJESPLUFOKGL-NEPJUHHUSA-N 2 0 244.448 2.448 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]C[C@@H]1Cc2ccccc21 ZINC000310272089 411231543 /nfs/dbraw/zinc/23/15/43/411231543.db2.gz NQUXHGOUWRGMIX-JSGCOSHPSA-N 2 0 232.371 2.433 20 0 BEADRP CCCC(O)(CCC)C[NH2+][C@H](C)C[C@@H](C)[NH3+] ZINC000422976187 411235507 /nfs/dbraw/zinc/23/55/07/411235507.db2.gz HZQNJSFXLHQVEV-VXGBXAGGSA-N 2 0 230.396 2.033 20 0 BEADRP CC1(C)[C@@H](c2ccccc2)C[C@@H]1[NH2+]CC1C[NH2+]C1 ZINC000423306710 411237489 /nfs/dbraw/zinc/23/74/89/411237489.db2.gz UGPXSHLPFQSSGY-CABCVRRESA-N 2 0 244.382 2.378 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H]1CCC[C@@H](c2cccnc2)C1 ZINC000423307131 411238766 /nfs/dbraw/zinc/23/87/66/411238766.db2.gz MMZLZRVGLLBHLI-UMVBOHGHSA-N 2 0 247.386 2.292 20 0 BEADRP CC(C)CCC[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000400967883 411166564 /nfs/dbraw/zinc/16/65/64/411166564.db2.gz NYAFPSZNXWHXLQ-BFHYXJOUSA-N 2 0 224.392 2.400 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)cc1 ZINC000400960629 411167474 /nfs/dbraw/zinc/16/74/74/411167474.db2.gz BMVQQTDJGRJFPO-ARFHVFGLSA-N 2 0 244.382 2.473 20 0 BEADRP CC1(C)C[C@@H]1C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000400978379 411167706 /nfs/dbraw/zinc/16/77/06/411167706.db2.gz QHKYPELXQYJHCX-YVECIDJPSA-N 2 0 222.376 2.010 20 0 BEADRP C([C@@H]1CC[NH2+]C1)[N@@H+]1CCC[C@@H]1C1CCCC1 ZINC000051890108 411284979 /nfs/dbraw/zinc/28/49/79/411284979.db2.gz FKKGFYYKAWFZGY-TZMCWYRMSA-N 2 0 222.376 2.251 20 0 BEADRP CCC1CCC([N@H+](C)C[C@H]2CC[NH2+]C2)CC1 ZINC000051889683 411285094 /nfs/dbraw/zinc/28/50/94/411285094.db2.gz OKSCAFOTVJMFSJ-MOKVOYLWSA-N 2 0 224.392 2.497 20 0 BEADRP CCCCC[N@H+](C[C@H]1CC[NH2+]C1)C(C)C ZINC000051889788 411285373 /nfs/dbraw/zinc/28/53/73/411285373.db2.gz RTIZFLQHVGZQDV-ZDUSSCGKSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CCC2CC[NH2+]CC2)C1 ZINC000129417439 411286220 /nfs/dbraw/zinc/28/62/20/411286220.db2.gz QWSNTJRAVYOGRX-DGCLKSJQSA-N 2 0 210.365 2.154 20 0 BEADRP Cc1[nH+]ccc(N[C@@H]2CCC[C@H]([NH3+])C2)c1Cl ZINC000382452468 411290320 /nfs/dbraw/zinc/29/03/20/411290320.db2.gz NYZCYJUFSMXAEV-VHSXEESVSA-N 2 0 239.750 2.147 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCS[C@H]1C)C1CC[NH+](C)CC1 ZINC000309851216 411295471 /nfs/dbraw/zinc/29/54/71/411295471.db2.gz XXBYTEQXEBSJBF-GMXVVIOVSA-N 2 0 242.432 2.200 20 0 BEADRP C[C@H]([NH2+][C@H]1CCS[C@@H]1C)C1CC[NH+](C)CC1 ZINC000309851221 411295539 /nfs/dbraw/zinc/29/55/39/411295539.db2.gz XXBYTEQXEBSJBF-LOWVWBTDSA-N 2 0 242.432 2.200 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]C[C@]2(C)CC2(F)F)CC1 ZINC000658218055 411297657 /nfs/dbraw/zinc/29/76/57/411297657.db2.gz GUNYVIYCDNUWPY-LBPRGKRZSA-N 2 0 246.345 2.494 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]C[C@@]2(C)CC2(F)F)CC1 ZINC000658218054 411297862 /nfs/dbraw/zinc/29/78/62/411297862.db2.gz GUNYVIYCDNUWPY-GFCCVEGCSA-N 2 0 246.345 2.494 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000656783359 411359907 /nfs/dbraw/zinc/35/99/07/411359907.db2.gz PWTFOTXWQBWWOT-BPLDGKMQSA-N 2 0 236.403 2.354 20 0 BEADRP C[C@H](C[C@@H]1CCC[NH2+]1)[NH2+]C[C@H](C)c1ccccn1 ZINC000656782021 411360232 /nfs/dbraw/zinc/36/02/32/411360232.db2.gz CQPFEEXOGQDTOR-MJBXVCDLSA-N 2 0 247.386 2.305 20 0 BEADRP C[C@@H]1C[C@H]1C[NH+]1CCC([C@@H]2CCC[NH2+]C2)CC1 ZINC000656784323 411361012 /nfs/dbraw/zinc/36/10/12/411361012.db2.gz AJGXPZJOHZHAFZ-YUELXQCFSA-N 2 0 236.403 2.354 20 0 BEADRP CC(C)C[N@@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000656786200 411365076 /nfs/dbraw/zinc/36/50/76/411365076.db2.gz PNFFLLYYRPBPCG-CQSZACIVSA-N 2 0 224.392 2.354 20 0 BEADRP CC(C)C[C@@H](C)C[C@@H](C)[NH2+][C@H]1CC[NH2+]C1 ZINC000656788235 411367720 /nfs/dbraw/zinc/36/77/20/411367720.db2.gz YIYUXJRZJZTJPX-UPJWGTAASA-N 2 0 212.381 2.399 20 0 BEADRP C[C@]1(C[NH+]2CCC(c3ccco3)CC2)CC[NH2+]C1 ZINC000656787913 411367923 /nfs/dbraw/zinc/36/79/23/411367923.db2.gz YYRYOMDWJNPONT-HNNXBMFYSA-N 2 0 248.370 2.459 20 0 BEADRP C[C@H](C[N@@H+]1CC[C@@]2(CC[NH2+]C2)C1)C(C)(C)C ZINC000304503598 411369100 /nfs/dbraw/zinc/36/91/00/411369100.db2.gz IUPANPHFWVSSRW-TZMCWYRMSA-N 2 0 224.392 2.354 20 0 BEADRP Cc1ccc(CCC[NH2+]CC2([NH3+])CCCC2)cn1 ZINC000656789472 411369373 /nfs/dbraw/zinc/36/93/73/411369373.db2.gz OKVZFDSJDMRSEC-UHFFFAOYSA-N 2 0 247.386 2.184 20 0 BEADRP C[C@@H](C[N@@H+]1CC[C@]2(CC[NH2+]C2)C1)C(C)(C)C ZINC000304503594 411369394 /nfs/dbraw/zinc/36/93/94/411369394.db2.gz IUPANPHFWVSSRW-JSGCOSHPSA-N 2 0 224.392 2.354 20 0 BEADRP CCCC[C@@H](COC)[NH2+]CC1([NH3+])CCCC1 ZINC000656789574 411369576 /nfs/dbraw/zinc/36/95/76/411369576.db2.gz RDPRQSPSUOGHRC-LBPRGKRZSA-N 2 0 228.380 2.053 20 0 BEADRP CC(C)(C)[NH2+]CCN1CCC[C@H](CCF)C1 ZINC000656792433 411371636 /nfs/dbraw/zinc/37/16/36/411371636.db2.gz QLHLHFRHTNGFPS-GFCCVEGCSA-N 2 0 230.371 2.446 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCCc2ccco2)CC[N@@H+]1C ZINC000658327777 411336174 /nfs/dbraw/zinc/33/61/74/411336174.db2.gz RKCPLCCSXOPDOO-CHWSQXEVSA-N 2 0 236.359 2.285 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[C@H]2C1)C1CC[NH+](C)CC1 ZINC000403349182 411340568 /nfs/dbraw/zinc/34/05/68/411340568.db2.gz VWDXIONIWOJFGM-CYUUQNCZSA-N 2 0 236.403 2.495 20 0 BEADRP CC(C)c1cccc(C[NH+]2C[C@H]3C[NH2+]C[C@@H]3C2)c1 ZINC000659849010 411341403 /nfs/dbraw/zinc/34/14/03/411341403.db2.gz DPSTWOWLAUNDFK-HZPDHXFCSA-N 2 0 244.382 2.461 20 0 BEADRP CC1(C[NH2+]Cc2ccsc2)CC[NH2+]CC1 ZINC000063147365 168043423 /nfs/dbraw/zinc/04/34/23/168043423.db2.gz MWGVEYIPQONKIU-UHFFFAOYSA-N 2 0 224.373 2.227 20 0 BEADRP C[C@@H]([NH2+]CCC[NH+]1CCC(C)CC1)C1CC1 ZINC000020146290 168179381 /nfs/dbraw/zinc/17/93/81/168179381.db2.gz ZMXDSEPEOHVJRU-CYBMUJFWSA-N 2 0 224.392 2.497 20 0 BEADRP CC1CC[NH+](C[C@H]2CC[NH2+][C@@H](C)C2)CC1 ZINC000232836186 168182537 /nfs/dbraw/zinc/18/25/37/168182537.db2.gz KXKINBIMLLCKRF-STQMWFEESA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]([NH2+]CCC1CC[NH2+]CC1)c1nccs1 ZINC000070733419 411384750 /nfs/dbraw/zinc/38/47/50/411384750.db2.gz ROGSSYLMJNZDIE-SNVBAGLBSA-N 2 0 239.388 2.183 20 0 BEADRP CCC(C)(C)C[NH2+][C@@H]1CC[N@H+](C)C[C@@H]1C ZINC000336772614 168282151 /nfs/dbraw/zinc/28/21/51/168282151.db2.gz YEGKBODKTPCFPA-NWDGAFQWSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H]1C[C@H]1C[NH2+]Cc1ccnn1-c1cc[nH+]cc1 ZINC000657309806 411458932 /nfs/dbraw/zinc/45/89/32/411458932.db2.gz IDRKWEROVVIYHI-RYUDHWBXSA-N 2 0 242.326 2.013 20 0 BEADRP C[C@@H]1CCC[N@H+](Cc2cccnc2)[C@@H]1CC[NH3+] ZINC000404379092 411392890 /nfs/dbraw/zinc/39/28/90/411392890.db2.gz LOKHHMAWBSLIDR-TZMCWYRMSA-N 2 0 233.359 2.031 20 0 BEADRP Cc1ccc(C[N@H+]2CCC[C@@H](C)[C@H]2CC[NH3+])cn1 ZINC000404431444 411396739 /nfs/dbraw/zinc/39/67/39/411396739.db2.gz OTYRJTZEUWDYRR-IUODEOHRSA-N 2 0 247.386 2.339 20 0 BEADRP CC[C@@H]1C[N@@H+]([C@@H](C)c2cccnc2)CC[C@@H]1[NH3+] ZINC000122245707 411425439 /nfs/dbraw/zinc/42/54/39/411425439.db2.gz ACGWYUHUTQFPIC-SCRDCRAPSA-N 2 0 233.359 2.202 20 0 BEADRP CC[C@@H]1C[N@H+](Cc2ccccc2OC)CC[C@@H]1[NH3+] ZINC000122273631 411427086 /nfs/dbraw/zinc/42/70/86/411427086.db2.gz YQFJSYOITMWXLP-OCCSQVGLSA-N 2 0 248.370 2.254 20 0 BEADRP CC(C)CC[NH2+]Cc1ccnn1-c1cc[nH+]cc1 ZINC000657286153 411444902 /nfs/dbraw/zinc/44/49/02/411444902.db2.gz KECYVHJNNGEEKN-UHFFFAOYSA-N 2 0 244.342 2.403 20 0 BEADRP CC[C@@H]1C[C@H]([NH2+]C2CC[NH+](C(C)C)CC2)CO1 ZINC000657294090 411449833 /nfs/dbraw/zinc/44/98/33/411449833.db2.gz CYUSROVXKNZVOY-UONOGXRCSA-N 2 0 240.391 2.016 20 0 BEADRP CC(C)[NH2+]C1CC[NH+]([C@@H]2CCO[C@H](C)C2)CC1 ZINC000660065008 411532790 /nfs/dbraw/zinc/53/27/90/411532790.db2.gz YVKSTULIFAICMF-TZMCWYRMSA-N 2 0 240.391 2.016 20 0 BEADRP Cc1ncc(CN[C@@H](C)c2nccs2)n1C ZINC000657490376 411533344 /nfs/dbraw/zinc/53/33/44/411533344.db2.gz IATCGSIPPHVAJK-QMMMGPOBSA-N 2 0 236.344 2.036 20 0 BEADRP CC[NH+]1CCC(CC[NH2+][C@H](C)[C@@H](C)OC)CC1 ZINC000361766896 169951043 /nfs/dbraw/zinc/95/10/43/169951043.db2.gz AGDXURDGWYXDOX-CHWSQXEVSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)[C@H]1CC1(C)C ZINC000655803941 411519066 /nfs/dbraw/zinc/51/90/66/411519066.db2.gz IWWIINXNMQPXGK-WUHRBBMRSA-N 2 0 224.392 2.351 20 0 BEADRP CC[C@@H]1CCC[C@H]1[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655805418 411519101 /nfs/dbraw/zinc/51/91/01/411519101.db2.gz NLPWLSHHLDTFQR-YIYPIFLZSA-N 2 0 224.392 2.495 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H](C2CC2)C2CCC2)C1 ZINC000655803975 411519294 /nfs/dbraw/zinc/51/92/94/411519294.db2.gz KRUBZJYTRCZZSS-BYCMXARLSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)C(C)(C)C ZINC000655805162 411519549 /nfs/dbraw/zinc/51/95/49/411519549.db2.gz JSSPKNYNBHQTNX-UTUOFQBUSA-N 2 0 212.381 2.351 20 0 BEADRP CC[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)[C@H]1C[C@H]1C ZINC000655804041 411519575 /nfs/dbraw/zinc/51/95/75/411519575.db2.gz NDAAYPWRFNMOAQ-DGTMBMJNSA-N 2 0 224.392 2.351 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655804108 411519649 /nfs/dbraw/zinc/51/96/49/411519649.db2.gz PTIKRTWWBGKMFP-FVCCEPFGSA-N 2 0 210.365 2.105 20 0 BEADRP CC[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)[C@@H]1C[C@H]1C ZINC000655804044 411519687 /nfs/dbraw/zinc/51/96/87/411519687.db2.gz NDAAYPWRFNMOAQ-RGDJUOJXSA-N 2 0 224.392 2.351 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+]Cc1ccnn1-c1cc[nH+]cc1 ZINC000657466224 411519817 /nfs/dbraw/zinc/51/98/17/411519817.db2.gz QWOJIRFPIZWXSX-RISCZKNCSA-N 2 0 242.326 2.155 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H]2CCC(C)(C)C2)C1 ZINC000655805748 411520534 /nfs/dbraw/zinc/52/05/34/411520534.db2.gz RXDUINFRKKKVQB-UPJWGTAASA-N 2 0 224.392 2.495 20 0 BEADRP CC[C@@H](C)[C@H](C)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655807910 411521165 /nfs/dbraw/zinc/52/11/65/411521165.db2.gz WAXSJMCHRLSVQL-XQHKEYJVSA-N 2 0 212.381 2.351 20 0 BEADRP CC[N@H+](C)C[C@H]1CC[NH+](C[C@@H]2C[C@H]3C[C@H]3C2)C1 ZINC000659990229 411521154 /nfs/dbraw/zinc/52/11/54/411521154.db2.gz YYDFMZQWTGOARH-APIJFGDWSA-N 2 0 236.403 2.306 20 0 BEADRP CC(C)C[C@H](C)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655807417 411521908 /nfs/dbraw/zinc/52/19/08/411521908.db2.gz LLOVEXXIBDKMEM-RWMBFGLXSA-N 2 0 212.381 2.351 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]CC2CCCCC2)C1 ZINC000655826158 411526313 /nfs/dbraw/zinc/52/63/13/411526313.db2.gz ROSRJYYYUCZBDH-OKILXGFUSA-N 2 0 224.392 2.497 20 0 BEADRP COc1ccc(C[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)cc1 ZINC000655825258 411527181 /nfs/dbraw/zinc/52/71/81/411527181.db2.gz BDTFXCIHXGYVJD-OKILXGFUSA-N 2 0 248.370 2.125 20 0 BEADRP Cc1occc1C[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655825160 411527286 /nfs/dbraw/zinc/52/72/86/411527286.db2.gz YQMIWYWEGRBIBO-BJHJDKERSA-N 2 0 222.332 2.018 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]C[C@H]2CC=CCC2)C1 ZINC000655825330 411527612 /nfs/dbraw/zinc/52/76/12/411527612.db2.gz DTRSHUBMWGASFQ-MELADBBJSA-N 2 0 222.376 2.273 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccncc2)C1 ZINC000037644020 170007618 /nfs/dbraw/zinc/00/76/18/170007618.db2.gz OJIFYRBJJVRVRB-STQMWFEESA-N 2 0 233.359 2.074 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(OC)cc2)C1 ZINC000037643746 170008318 /nfs/dbraw/zinc/00/83/18/170008318.db2.gz HFYVBKZQCLMAQM-AWEZNQCLSA-N 2 0 248.370 2.127 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCC2CC2)[C@H](C)C1 ZINC000336671499 170010010 /nfs/dbraw/zinc/01/00/10/170010010.db2.gz YULJXPKRASGVSH-TZMCWYRMSA-N 2 0 224.392 2.449 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]C2CC(F)(F)C2)[C@H](C)C1 ZINC000309676850 170013168 /nfs/dbraw/zinc/01/31/68/170013168.db2.gz YBGGHOUPZHIMMU-MWLCHTKSSA-N 2 0 232.318 2.104 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+]C2CC(C)(C)C2)C1 ZINC000336762605 170015572 /nfs/dbraw/zinc/01/55/72/170015572.db2.gz NZFPTAKRPMRMNC-LLVKDONJSA-N 2 0 210.365 2.106 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)[C@H]2CC2(C)C)C1 ZINC000309973734 170016596 /nfs/dbraw/zinc/01/65/96/170016596.db2.gz RESWJAKVCSRVCU-YNEHKIRRSA-N 2 0 224.392 2.352 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH+](C)CC(C)C)C[C@@H]1C ZINC000336643812 170019636 /nfs/dbraw/zinc/01/96/36/170019636.db2.gz DSODZKHMPBFUQF-STQMWFEESA-N 2 0 212.381 2.447 20 0 BEADRP CC[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000037241745 170108305 /nfs/dbraw/zinc/10/83/05/170108305.db2.gz HPDIJDYOJCMWET-UHFFFAOYSA-N 2 0 210.365 2.393 20 0 BEADRP CC[NH2+]CC1CC[NH+](C[C@H](C)CC)CC1 ZINC000053659212 170111777 /nfs/dbraw/zinc/11/17/77/170111777.db2.gz LPNHWZKMWKWBPD-GFCCVEGCSA-N 2 0 212.381 2.354 20 0 BEADRP CCOC[C@@H]1CCC[C@@H]1[NH2+]CCCC[NH+](C)C ZINC000354211423 170440692 /nfs/dbraw/zinc/44/06/92/170440692.db2.gz MWEBYNWGJBECRM-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)[C@@H]([NH2+]Cc1cnc2n1CCC2)C1CC1 ZINC000657757519 411590179 /nfs/dbraw/zinc/59/01/79/411590179.db2.gz SVKQYMCNTDITPD-CQSZACIVSA-N 2 0 233.359 2.354 20 0 BEADRP c1coc(CCC[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)c1 ZINC000657781638 411597267 /nfs/dbraw/zinc/59/72/67/411597267.db2.gz FOAJYVQJXKACJN-KBPBESRZSA-N 2 0 248.370 2.429 20 0 BEADRP COC1([C@@H](C)[NH2+]CC(C)(C)C[NH+](C)C)CCC1 ZINC000657818573 411605959 /nfs/dbraw/zinc/60/59/59/411605959.db2.gz WGMDULMRLIIKGC-GFCCVEGCSA-N 2 0 242.407 2.121 20 0 BEADRP Cc1nccn1CC[NH2+][C@H]1CCCSCC1 ZINC000657863437 411613439 /nfs/dbraw/zinc/61/34/39/411613439.db2.gz ITRMKPJYGXPFND-LBPRGKRZSA-N 2 0 239.388 2.067 20 0 BEADRP CC[C@@H](C)C[N@@H+]1CCC[C@]2(CC[NH+](C)C2)C1 ZINC000660654956 411613599 /nfs/dbraw/zinc/61/35/99/411613599.db2.gz DGUNANXNJUXBCR-ZIAGYGMSSA-N 2 0 224.392 2.450 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCCSCC2)C1 ZINC000657875878 411615167 /nfs/dbraw/zinc/61/51/67/411615167.db2.gz IOJCBXXMDKMEIV-CHWSQXEVSA-N 2 0 242.432 2.204 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH2+]C2CC(CF)(CF)C2)C1 ZINC000657875877 411615386 /nfs/dbraw/zinc/61/53/86/411615386.db2.gz IODHSKAWOIWAGI-NSHDSACASA-N 2 0 246.345 2.006 20 0 BEADRP CC[N@@H+]1CCC[C@@H](Nc2[nH+]ccc3[nH]ccc32)C1 ZINC000663415801 411653192 /nfs/dbraw/zinc/65/31/92/411653192.db2.gz ROYZXAJGJIZGNE-LLVKDONJSA-N 2 0 244.342 2.459 20 0 BEADRP C[C@H]1C[C@H](Nc2[nH+]ccc3[nH]ccc32)CC[N@@H+]1C ZINC000663661912 411716911 /nfs/dbraw/zinc/71/69/11/411716911.db2.gz SJPBDBIHJHHKHK-WDEREUQCSA-N 2 0 244.342 2.458 20 0 BEADRP CC1CC([NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)C1 ZINC000663466385 411666315 /nfs/dbraw/zinc/66/63/15/411666315.db2.gz SCDYGVWMVNZYHT-BLZCZZARSA-N 2 0 236.403 2.497 20 0 BEADRP C([NH2+][C@H]1CCCC[C@@H]1C1CC1)C12CC(C1)C[NH2+]2 ZINC000663497286 411679222 /nfs/dbraw/zinc/67/92/22/411679222.db2.gz CSWLDTULWRSCTL-YTELLUSKSA-N 2 0 234.387 2.297 20 0 BEADRP C[C@@H](CC1CCCC1)[NH2+]CC12CC(C1)C[NH2+]2 ZINC000663497300 411679773 /nfs/dbraw/zinc/67/97/73/411679773.db2.gz CXLOKPZNAFEBQP-XGNXJENSSA-N 2 0 222.376 2.297 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+]Cc1cccc(F)c1 ZINC000663498928 411681827 /nfs/dbraw/zinc/68/18/27/411681827.db2.gz UQIYOZKPIZNFTA-CYBMUJFWSA-N 2 0 224.323 2.289 20 0 BEADRP C[C@H](C[NH2+]CC12CC(C1)C[NH2+]2)c1ccccc1 ZINC000663499505 411683220 /nfs/dbraw/zinc/68/32/20/411683220.db2.gz XFKBESQYPCTJPU-DNOWBOINSA-N 2 0 230.355 2.132 20 0 BEADRP C[NH2+]C[C@@H](C)[NH2+]C[C@@H]1CCCC(C)(C)C1 ZINC000663508782 411690844 /nfs/dbraw/zinc/69/08/44/411690844.db2.gz DKTRKYZICCPUJJ-VXGBXAGGSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H]1C[C@H](C[N@H+](C)C[C@H]2CC2(C)C)CC[NH2+]1 ZINC000663513124 411694862 /nfs/dbraw/zinc/69/48/62/411694862.db2.gz ILZBCPUDLDCFSU-JHJVBQTASA-N 2 0 224.392 2.352 20 0 BEADRP C[NH+](C)[C@@H](CNc1[nH+]ccc2[nH]ccc21)C1CC1 ZINC000663548476 411701373 /nfs/dbraw/zinc/70/13/73/411701373.db2.gz RCRIILYGEQCIRH-ZDUSSCGKSA-N 2 0 244.342 2.315 20 0 BEADRP CCSCC[NH2+]CCC1CC[NH+](CC)CC1 ZINC000309981953 170635841 /nfs/dbraw/zinc/63/58/41/170635841.db2.gz WMEUCALBFQCEJG-UHFFFAOYSA-N 2 0 244.448 2.451 20 0 BEADRP Cc1cccc(NCC[C@@H](C)[NH+](C)C)[nH+]1 ZINC000664243164 411895153 /nfs/dbraw/zinc/89/51/53/411895153.db2.gz JGQVKYDTVVNNFP-LLVKDONJSA-N 2 0 207.321 2.142 20 0 BEADRP C(C[NH+]1CCCCC1)C[N@@H+]1CC[C@@H]2C[C@@H]2C1 ZINC000661967160 411924043 /nfs/dbraw/zinc/92/40/43/411924043.db2.gz CDCKGPWMMAJREF-ZIAGYGMSSA-N 2 0 222.376 2.204 20 0 BEADRP CC[NH+](CC)CCC[N@@H+]1CC[C@H]2C[C@H]2C1 ZINC000661966896 411924102 /nfs/dbraw/zinc/92/41/02/411924102.db2.gz AMHJFAFQSWOGRB-STQMWFEESA-N 2 0 210.365 2.060 20 0 BEADRP CN(CC1C[NH+](C)C1)c1cc[nH+]c2ccccc21 ZINC000664332522 411924777 /nfs/dbraw/zinc/92/47/77/411924777.db2.gz ZIUHNBNKTIYPTF-UHFFFAOYSA-N 2 0 241.338 2.233 20 0 BEADRP C(CC[N@@H+]1CC[C@@H]2C[C@@H]2C1)C[NH+]1CC[C@@H]2C[C@@H]2C1 ZINC000661969474 411926657 /nfs/dbraw/zinc/92/66/57/411926657.db2.gz JNOFWTSCLDFUBB-KLHDSHLOSA-N 2 0 248.414 2.450 20 0 BEADRP C(C[NH+]1CC[C@@H]2C[C@@H]2C1)C[N@@H+]1CC[C@@H]2C[C@@H]2C1 ZINC000661972372 411928709 /nfs/dbraw/zinc/92/87/09/411928709.db2.gz PVDFFOAKOJUVTO-KBUPBQIOSA-N 2 0 234.387 2.060 20 0 BEADRP CC1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC[NH2+]CC1 ZINC000662230380 412031615 /nfs/dbraw/zinc/03/16/15/412031615.db2.gz XLOQQJWEVFYIPY-QXMXGUDHSA-N 2 0 222.376 2.249 20 0 BEADRP C[N@H+](CCCC1CCC1)CC(C)(C)C[NH3+] ZINC000662247810 412037022 /nfs/dbraw/zinc/03/70/22/412037022.db2.gz LOINIDNCFLGFCD-UHFFFAOYSA-N 2 0 212.381 2.483 20 0 BEADRP CC[C@H](CC(F)F)C[NH+]1CCC([NH3+])CC1 ZINC000662239710 412037416 /nfs/dbraw/zinc/03/74/16/412037416.db2.gz FWHPMCYKDIBCSE-SECBINFHSA-N 2 0 220.307 2.091 20 0 BEADRP CC(C)=CCC[N@H+]1CCC[C@H]([C@@H](C)[NH3+])C1 ZINC000662245760 412042994 /nfs/dbraw/zinc/04/29/94/412042994.db2.gz OKZXUSFQLABCMR-OLZOCXBDSA-N 2 0 210.365 2.402 20 0 BEADRP CC[C@H](C[NH2+][C@@](C)(CN)C1CC1)CC(F)F ZINC000662247380 412044804 /nfs/dbraw/zinc/04/48/04/412044804.db2.gz GCZDTGSTWVJVHR-CABZTGNLSA-N 2 0 234.334 2.385 20 0 BEADRP CC(C)[C@H]([NH3+])CC[N@H+](C)CC1CC=CC1 ZINC000662247808 412044881 /nfs/dbraw/zinc/04/48/81/412044881.db2.gz LOCKZNMTLZBEJZ-CYBMUJFWSA-N 2 0 210.365 2.258 20 0 BEADRP CC[C@@H](CC(F)F)CN1CCC[C@H]([NH2+]C)C1 ZINC000662247199 412045170 /nfs/dbraw/zinc/04/51/70/412045170.db2.gz VHUUSLAFMWWLCV-QWRGUYRKSA-N 2 0 234.334 2.352 20 0 BEADRP CCC(CC)(CC)[NH2+]C[C@H]1CCC2(C[NH2+]C2)O1 ZINC000662259203 412054633 /nfs/dbraw/zinc/05/46/33/412054633.db2.gz RVGPTCRIUOSXEH-GFCCVEGCSA-N 2 0 240.391 2.066 20 0 BEADRP C[C@@H]([NH3+])[C@H]1CC[N@H+](CCCC2CCC2)C1 ZINC000662264169 412055401 /nfs/dbraw/zinc/05/54/01/412055401.db2.gz BOJURTKJJYKZCB-YPMHNXCESA-N 2 0 210.365 2.236 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]CCC[N@H+](C)C(C)C ZINC000336771827 171042725 /nfs/dbraw/zinc/04/27/25/171042725.db2.gz WZUVBHZLWLONQL-OLZOCXBDSA-N 2 0 212.381 2.495 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]C[C@H]1CC[N@H+](CC)C1 ZINC000308937988 171043257 /nfs/dbraw/zinc/04/32/57/171043257.db2.gz LKKPIDGUGLGYST-UPJWGTAASA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]C[C@@H]1CC[N@H+](CC)C1 ZINC000308937990 171043882 /nfs/dbraw/zinc/04/38/82/171043882.db2.gz LKKPIDGUGLGYST-XQQFMLRXSA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000310018931 171044139 /nfs/dbraw/zinc/04/41/39/171044139.db2.gz MGCCUOQCNXHRPB-BZPMIXESSA-N 2 0 222.376 2.249 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000336741155 171057187 /nfs/dbraw/zinc/05/71/87/171057187.db2.gz QUKSPISXMHRAEQ-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H]1C[N@H+](CCC2CC[NH2+]CC2)CCS1 ZINC000133091297 171079460 /nfs/dbraw/zinc/07/94/60/171079460.db2.gz BFBVNEIQXHMTOT-CYBMUJFWSA-N 2 0 242.432 2.204 20 0 BEADRP CC(C)=CCC[N@@H+]1CC[C@H]2[NH2+]CC[C@@H]2C1 ZINC000662274738 412067940 /nfs/dbraw/zinc/06/79/40/412067940.db2.gz WPSLGAKCNXRNBY-CHWSQXEVSA-N 2 0 208.349 2.027 20 0 BEADRP C1=CCC(C[N@@H+]2CCCC[C@H]2[C@H]2CC[NH2+]C2)C1 ZINC000662276494 412069934 /nfs/dbraw/zinc/06/99/34/412069934.db2.gz NMMNFJQUMUFXIO-GJZGRUSLSA-N 2 0 234.387 2.417 20 0 BEADRP C[C@@H]1C[C@H](C)[N@H+](CC2CC=CC2)C[C@H]1C[NH3+] ZINC000662281971 412073365 /nfs/dbraw/zinc/07/33/65/412073365.db2.gz AHOSPJDAPAEIIT-MBNYWOFBSA-N 2 0 222.376 2.258 20 0 BEADRP C[C@H]1CC2(C[N@@H+]1CC1CC=CC1)CC[NH2+]CC2 ZINC000662284159 412075353 /nfs/dbraw/zinc/07/53/53/412075353.db2.gz UCZNMXIHDNUVPW-ZDUSSCGKSA-N 2 0 234.387 2.417 20 0 BEADRP C[C@@H]1CC2(C[N@@H+]1C[C@@H]1C[C@H]3C[C@H]3C1)CC[NH2+]CC2 ZINC000662283043 412076080 /nfs/dbraw/zinc/07/60/80/412076080.db2.gz KCCMLSMJAFGMHN-APIJFGDWSA-N 2 0 248.414 2.497 20 0 BEADRP CC[C@H](C)C[N@@H+]1CC[C@]2(C1)CCC[NH+](C)C2 ZINC000334217508 171282812 /nfs/dbraw/zinc/28/28/12/171282812.db2.gz HGCXOSIFIKYVRS-UONOGXRCSA-N 2 0 224.392 2.450 20 0 BEADRP CC[C@H](C)C[NH2+]CCC[NH+](CC)CC ZINC000020090544 171285102 /nfs/dbraw/zinc/28/51/02/171285102.db2.gz DSIRHQQSEVXZKQ-LBPRGKRZSA-N 2 0 200.370 2.354 20 0 BEADRP C[N@H+](CCC(C)(C)C1CC1)CC(C)(C)[NH3+] ZINC000662296200 412083925 /nfs/dbraw/zinc/08/39/25/412083925.db2.gz XPWLGBPVGXHLRU-UHFFFAOYSA-N 2 0 212.381 2.482 20 0 BEADRP [NH3+]CCOCC[NH2+][C@H]1CCCC12CCCCC2 ZINC000662294891 412084397 /nfs/dbraw/zinc/08/43/97/412084397.db2.gz GKBUVYNXNHSTBR-ZDUSSCGKSA-N 2 0 240.391 2.054 20 0 BEADRP CC[C@H](C)[N@@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000337256634 171319616 /nfs/dbraw/zinc/31/96/16/171319616.db2.gz SMVXTMXOIQISSJ-JSGCOSHPSA-N 2 0 224.392 2.449 20 0 BEADRP CC[C@H](C)[N@@H+]1CC[C@H](OCC[NH+](CC)CC)C1 ZINC000337260810 171320481 /nfs/dbraw/zinc/32/04/81/171320481.db2.gz XKODXWDSCRPPTK-KBPBESRZSA-N 2 0 242.407 2.218 20 0 BEADRP CCCC[NH+]1CCC([C@H]2CCC[NH2+]C2)CC1 ZINC000662290148 412079742 /nfs/dbraw/zinc/07/97/42/412079742.db2.gz LIFQUMBBTRBNAY-AWEZNQCLSA-N 2 0 224.392 2.498 20 0 BEADRP CC(C)[NH+]1CCC([C@@H]2CCC[NH2+]C2)CC1 ZINC000662290144 412079923 /nfs/dbraw/zinc/07/99/23/412079923.db2.gz LDGFOMUWNWIYNR-CYBMUJFWSA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@H](C)[C@@H](C)[NH2+]C[C@H]1CCCN1CC ZINC000238857070 171365140 /nfs/dbraw/zinc/36/51/40/171365140.db2.gz XZUSPJIKFBSHMU-YNEHKIRRSA-N 2 0 212.381 2.495 20 0 BEADRP c1coc(C2CC[NH+](CC[C@H]3CC[NH2+]C3)CC2)c1 ZINC000662298933 412087325 /nfs/dbraw/zinc/08/73/25/412087325.db2.gz SZHBLPVSIWPAAG-CYBMUJFWSA-N 2 0 248.370 2.459 20 0 BEADRP C([C@@H]1CC[NH2+]C1)[N@@H+]1CC[C@H](C2CCCCC2)C1 ZINC000662305438 412090610 /nfs/dbraw/zinc/09/06/10/412090610.db2.gz HPXQXOMYECBDKN-HIFRSBDPSA-N 2 0 236.403 2.498 20 0 BEADRP c1cc2c(cc1C[N@@H+]1CC[C@H]3C[C@H]3C1)C[NH2+]CC2 ZINC000662316002 412095767 /nfs/dbraw/zinc/09/57/67/412095767.db2.gz TZIIWYGXEYOSEH-HOCLYGCPSA-N 2 0 242.366 2.174 20 0 BEADRP CC1C[C@H]2CC[C@@H](C1)[N@H+]2CC[C@@H]1CC[NH2+]C1 ZINC000662319059 412099338 /nfs/dbraw/zinc/09/93/38/412099338.db2.gz JVDPYRKMNCCBGD-PBNFFQIGSA-N 2 0 222.376 2.249 20 0 BEADRP CCCCC[N@@H+]1CCO[C@H](CCC[NH+](C)C)C1 ZINC000662321737 412099639 /nfs/dbraw/zinc/09/96/39/412099639.db2.gz SJGSNOKSMGHTRH-CQSZACIVSA-N 2 0 242.407 2.219 20 0 BEADRP CCCCC[N@@H+]1CCO[C@@H](CCC[NH+](C)C)C1 ZINC000662321733 412100843 /nfs/dbraw/zinc/10/08/43/412100843.db2.gz SJGSNOKSMGHTRH-AWEZNQCLSA-N 2 0 242.407 2.219 20 0 BEADRP C[N@H+](CC[C@H]1CCC[NH2+]C1)C[C@H]1CC1(C)C ZINC000662331576 412104349 /nfs/dbraw/zinc/10/43/49/412104349.db2.gz NRLNLXGRGYMEPO-CHWSQXEVSA-N 2 0 224.392 2.354 20 0 BEADRP Cc1ccncc1CC[NH2+][C@@H]1CCCCC[C@@H]1[NH3+] ZINC000665239021 412181405 /nfs/dbraw/zinc/18/14/05/412181405.db2.gz KGJYFWYXDDQNTO-LSDHHAIUSA-N 2 0 247.386 2.182 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H]2CC[C@H]2C2CCC2)CCCC1 ZINC000665246386 412190510 /nfs/dbraw/zinc/19/05/10/412190510.db2.gz CYZYWHRHZQJPDV-QWHCGFSZSA-N 2 0 222.376 2.426 20 0 BEADRP Cc1cc(C)cc(C[NH2+][C@@H](C)C2C[NH2+]C2)c1 ZINC000665245954 412190859 /nfs/dbraw/zinc/19/08/59/412190859.db2.gz VOJWLXRAYQOCCD-LBPRGKRZSA-N 2 0 218.344 2.001 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+]CC1([NH3+])CCCC1 ZINC000665248960 412194284 /nfs/dbraw/zinc/19/42/84/412194284.db2.gz GOSSAGCXUSWJKN-GFCCVEGCSA-N 2 0 236.359 2.462 20 0 BEADRP CC[C@H]1CCC[C@H]1[NH2+]CC1([NH3+])CCCC1 ZINC000665249278 412194770 /nfs/dbraw/zinc/19/47/70/412194770.db2.gz MKUZLENVDJAEBS-NWDGAFQWSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@@H](CCc1ccco1)[NH2+]CC1([NH3+])CCCC1 ZINC000665248961 412195065 /nfs/dbraw/zinc/19/50/65/412195065.db2.gz GOSSAGCXUSWJKN-LBPRGKRZSA-N 2 0 236.359 2.462 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+]CC1=CCCC1 ZINC000665273872 412215242 /nfs/dbraw/zinc/21/52/42/412215242.db2.gz FZLFKNMVHLDKMU-WCQYABFASA-N 2 0 208.349 2.074 20 0 BEADRP CC(C)(F)CC[NH2+][C@@H]1CCCCC[C@H]1[NH3+] ZINC000665261788 412203757 /nfs/dbraw/zinc/20/37/57/412203757.db2.gz LKPMHRMWNONLPG-GHMZBOCLSA-N 2 0 216.344 2.374 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CCC(C)(C)F ZINC000665261572 412204315 /nfs/dbraw/zinc/20/43/15/412204315.db2.gz GPKNOVAQCMUOAG-JTQLQIEISA-N 2 0 204.333 2.232 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[C@@H]2C[C@@H]21)[C@@H]1CCC[NH2+]1 ZINC000665263046 412205063 /nfs/dbraw/zinc/20/50/63/412205063.db2.gz FDRATALTNLTQEE-NDKCEZKHSA-N 2 0 222.376 2.153 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]CCc1ccoc1 ZINC000665262275 412205895 /nfs/dbraw/zinc/20/58/95/412205895.db2.gz XWDQSOBEVWTHIV-CHWSQXEVSA-N 2 0 222.332 2.072 20 0 BEADRP CC(C)(F)CC[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000665262351 412206145 /nfs/dbraw/zinc/20/61/45/412206145.db2.gz ZAPNRTYXHFRHCO-QJPTWQEYSA-N 2 0 228.355 2.102 20 0 BEADRP CC(C)(F)CC[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000665262349 412206156 /nfs/dbraw/zinc/20/61/56/412206156.db2.gz ZAPNRTYXHFRHCO-GRYCIOLGSA-N 2 0 228.355 2.102 20 0 BEADRP C[C@]1(C[NH2+][C@H]2CCCC[C@@H]2C[NH3+])CC1(F)F ZINC000665265735 412209233 /nfs/dbraw/zinc/20/92/33/412209233.db2.gz ZWTYMEJWXRNBAJ-OUAUKWLOSA-N 2 0 232.318 2.139 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@]1(C)CC1(F)F ZINC000665266981 412210075 /nfs/dbraw/zinc/21/00/75/412210075.db2.gz NENHYUCKILBLIZ-ZJUUUORDSA-N 2 0 220.307 2.139 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CC[C@@]1(C)CC1(F)F ZINC000665266912 412211110 /nfs/dbraw/zinc/21/11/10/412211110.db2.gz LTQLQQNPADMTMK-AEJSXWLSSA-N 2 0 220.307 2.137 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@H]1CCc2cc(N)ccc21 ZINC000665272064 412213190 /nfs/dbraw/zinc/21/31/90/412213190.db2.gz XFCLFYSMRJGVCC-NHYWBVRUSA-N 2 0 247.386 2.363 20 0 BEADRP COC1CC(CC[NH2+][C@H]2CCCCC[C@@H]2[NH3+])C1 ZINC000665229852 412168971 /nfs/dbraw/zinc/16/89/71/412168971.db2.gz DYQAVZQTQQNXGL-HOAMVYINSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@H]([NH2+]Cc1cccc(N)c1)C1CC[NH+](C)CC1 ZINC000665233631 412172887 /nfs/dbraw/zinc/17/28/87/412172887.db2.gz LYDYFKAKWHOXMD-LBPRGKRZSA-N 2 0 247.386 2.089 20 0 BEADRP [NH3+]CC1CCC([NH2+]CC2=CCCC2)CC1 ZINC000665274449 412218194 /nfs/dbraw/zinc/21/81/94/412218194.db2.gz QIZGYTOZVDYYKK-UHFFFAOYSA-N 2 0 208.349 2.204 20 0 BEADRP C([NH2+]C1C2CC3CC(C2)CC1C3)C12CC(C1)C[NH2+]2 ZINC000665277063 412219193 /nfs/dbraw/zinc/21/91/93/412219193.db2.gz RXVRUAHDPGNWKY-UHFFFAOYSA-N 2 0 246.398 2.153 20 0 BEADRP C[C@@H]1CCC[C@@H](C)C1[NH2+]CC12CC(C1)C[NH2+]2 ZINC000665277550 412220901 /nfs/dbraw/zinc/22/09/01/412220901.db2.gz FHIXUYNPPSMRPT-IBQNZTRDSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]1CC[C@@H](C)[C@@H]([NH2+]CC23CC(C2)C[NH2+]3)C1 ZINC000665279649 412221009 /nfs/dbraw/zinc/22/10/09/412221009.db2.gz IJEVFMARUQCIJN-WCCYQHBJSA-N 2 0 222.376 2.153 20 0 BEADRP CC1(C)CCC[C@@H]([NH2+]CC23CC(C2)C[NH2+]3)C1 ZINC000665278332 412221706 /nfs/dbraw/zinc/22/17/06/412221706.db2.gz BETDUBZTNVQTFD-MBHSVXNSSA-N 2 0 222.376 2.297 20 0 BEADRP CC[C@@H]1CCCC[C@H]1[NH2+]CC12CC(C1)C[NH2+]2 ZINC000665278785 412222352 /nfs/dbraw/zinc/22/23/52/412222352.db2.gz OUTFCAZSGBTKKA-CEUNDQEZSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H]1CC(C)(C)C[C@H]1[NH2+]CC12CC(C1)C[NH2+]2 ZINC000665279711 412223115 /nfs/dbraw/zinc/22/31/15/412223115.db2.gz KHYUVWHGHPJYED-WDBLDGLGSA-N 2 0 222.376 2.153 20 0 BEADRP CC[C@@H]([NH2+]CC12CC(C1)C[NH2+]2)C1CCCC1 ZINC000665279790 412223332 /nfs/dbraw/zinc/22/33/32/412223332.db2.gz MIQKBPKJISSIBV-HRDQMINSSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H]([NH2+]CC12CC(C1)C[NH2+]2)C1C(C)(C)C1(C)C ZINC000665279232 412223368 /nfs/dbraw/zinc/22/33/68/412223368.db2.gz ZTYDIYUAIRNHLA-NLTNOIMHSA-N 2 0 236.403 2.399 20 0 BEADRP C([NH2+][C@H]1CCCC12CCCC2)C12CC(C1)C[NH2+]2 ZINC000665279660 412223415 /nfs/dbraw/zinc/22/34/15/412223415.db2.gz IOGKBFUHXDRXNP-OWYJLGKBSA-N 2 0 234.387 2.441 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+][C@@H](C)c1cncc(F)c1 ZINC000665280717 412224225 /nfs/dbraw/zinc/22/42/25/412224225.db2.gz JNLSCOUWMKOQJB-GXFFZTMASA-N 2 0 239.338 2.245 20 0 BEADRP Cc1ncc([C@@H](C)[NH2+]CC[C@@H]([NH3+])C(C)C)s1 ZINC000665281240 412225798 /nfs/dbraw/zinc/22/57/98/412225798.db2.gz YCEXODWIHHLXCK-MWLCHTKSSA-N 2 0 241.404 2.476 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+]C1CC(C(C)C)C1 ZINC000665281853 412225974 /nfs/dbraw/zinc/22/59/74/412225974.db2.gz LZATYHPBQPONQY-WXRRBKDZSA-N 2 0 212.381 2.384 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]CCCc1ccco1 ZINC000665283651 412229637 /nfs/dbraw/zinc/22/96/37/412229637.db2.gz RRVRVOWFFBEYKQ-KGLIPLIRSA-N 2 0 236.359 2.462 20 0 BEADRP COc1cccc(C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)c1C ZINC000665294076 412239416 /nfs/dbraw/zinc/23/94/16/412239416.db2.gz HNEMULQUUMDAGG-ZIAGYGMSSA-N 2 0 248.370 2.363 20 0 BEADRP C[NH2+]C[C@H](C)[NH2+][C@H]1CCCC[C@H]1C(C)C ZINC000665295465 412242263 /nfs/dbraw/zinc/24/22/63/412242263.db2.gz DTIRZASTWYVXRH-AVGNSLFASA-N 2 0 212.381 2.399 20 0 BEADRP C[NH2+]C[C@H](C)[NH2+]C(C1CCC1)C1CCC1 ZINC000665297895 412244102 /nfs/dbraw/zinc/24/41/02/412244102.db2.gz NVGOZRARHGFXRS-JTQLQIEISA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]([NH2+]CC(C)(C)CC(F)(F)F)C1C[NH2+]C1 ZINC000665300636 412250016 /nfs/dbraw/zinc/25/00/16/412250016.db2.gz GSXKNLBKSPBEGF-MRVPVSSYSA-N 2 0 238.297 2.163 20 0 BEADRP CCc1ccc(C[NH2+]CCCC[NH3+])cc1 ZINC000037714647 171805171 /nfs/dbraw/zinc/80/51/71/171805171.db2.gz ZEBJKYRQZNJRCM-UHFFFAOYSA-N 2 0 206.333 2.078 20 0 BEADRP CCc1nccn1Cc1cn2cccc(C)c2n1 ZINC000158307771 172027433 /nfs/dbraw/zinc/02/74/33/172027433.db2.gz HUZSAKOAKSCKOJ-UHFFFAOYSA-N 2 0 240.310 2.450 20 0 BEADRP C[N@H+]1CC=C(C[NH2+][C@H]2CCCC2(C)C)CC1 ZINC000309667604 172978517 /nfs/dbraw/zinc/97/85/17/172978517.db2.gz UUUFMVHXPAFKMH-ZDUSSCGKSA-N 2 0 222.376 2.417 20 0 BEADRP C[N@@H+]1CCCC[C@H]1CC[NH2+][C@@H]1CCOC1(C)C ZINC000328278708 173006752 /nfs/dbraw/zinc/00/67/52/173006752.db2.gz YSBNICBXVQCCNC-QWHCGFSZSA-N 2 0 240.391 2.018 20 0 BEADRP C[N@@H+]1CCC[C@@]2(CC[NH+](CCCCF)C2)C1 ZINC000339441117 173039261 /nfs/dbraw/zinc/03/92/61/173039261.db2.gz OSHQBIGKXWBNBW-CYBMUJFWSA-N 2 0 228.355 2.154 20 0 BEADRP C[N@@H+]1CCC[C@H]1CC[NH+]1CCC12CCC2 ZINC000336555780 173051431 /nfs/dbraw/zinc/05/14/31/173051431.db2.gz UYCDBVHCCUTNIO-LBPRGKRZSA-N 2 0 208.349 2.099 20 0 BEADRP C[N@@H+]1CCC[C@H]2C[NH+](CCCCF)CC[C@H]21 ZINC000367158590 173058388 /nfs/dbraw/zinc/05/83/88/173058388.db2.gz TVEVJMHEDBUNRN-QWHCGFSZSA-N 2 0 228.355 2.152 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CCC2CC2)[C@@H]2CCC[C@H]21 ZINC000309436394 173152392 /nfs/dbraw/zinc/15/23/92/173152392.db2.gz HHYVFKQGGPIPQI-MELADBBJSA-N 2 0 222.376 2.249 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CC(C)(C)C)[C@H]2CCC[C@@H]21 ZINC000368600178 173152578 /nfs/dbraw/zinc/15/25/78/173152578.db2.gz AYLGWYYKZBCPIR-AGIUHOORSA-N 2 0 224.392 2.495 20 0 BEADRP C[N@@H+]1CC[C@]2(CC[NH+](CCc3ccccc3)C2)C1 ZINC000292206511 173167350 /nfs/dbraw/zinc/16/73/50/173167350.db2.gz SSLSTGICNMTMTP-INIZCTEOSA-N 2 0 244.382 2.257 20 0 BEADRP C[NH2+]C1CC[NH+](C[C@@H]2CCC[C@H](C)C2)CC1 ZINC000234346052 173322915 /nfs/dbraw/zinc/32/29/15/173322915.db2.gz PNKGTKHDIOWYRG-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH2+]C1CC[NH+](C[C@H]2CCC[C@H](C)C2)CC1 ZINC000234346229 173323203 /nfs/dbraw/zinc/32/32/03/173323203.db2.gz PNKGTKHDIOWYRG-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP C[NH2+]CCC[N@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC000300989067 173345626 /nfs/dbraw/zinc/34/56/26/173345626.db2.gz TXHXXKHPIAEEBX-LLVKDONJSA-N 2 0 234.334 2.353 20 0 BEADRP C[NH2+]CCC[N@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC000300989068 173346564 /nfs/dbraw/zinc/34/65/64/173346564.db2.gz TXHXXKHPIAEEBX-NSHDSACASA-N 2 0 234.334 2.353 20 0 BEADRP C[NH2+]CCC[N@@H+]1CC[C@H]2CCCC[C@@H]2C1 ZINC000042409654 173346741 /nfs/dbraw/zinc/34/67/41/173346741.db2.gz QFWJZBGJOJTABE-CHWSQXEVSA-N 2 0 210.365 2.108 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCC[C@@H]1C1CCCC1 ZINC000045086632 173346836 /nfs/dbraw/zinc/34/68/36/173346836.db2.gz REEPJCOEBWXTEO-CYBMUJFWSA-N 2 0 210.365 2.251 20 0 BEADRP C[NH2+]CCN(C)[C@@H]1CCCc2ccccc21 ZINC000069801115 173353673 /nfs/dbraw/zinc/35/36/73/173353673.db2.gz YWPLLXHNMNVREP-CQSZACIVSA-N 2 0 218.344 2.215 20 0 BEADRP C[NH2+]C[C@@H]1CCCN1CCCc1ccc(C)nc1 ZINC000339409456 173368969 /nfs/dbraw/zinc/36/89/69/173368969.db2.gz MHAZDRKOPDSXRU-HNNXBMFYSA-N 2 0 247.386 2.006 20 0 BEADRP C[NH2+]C[C@@H]1CCCN1CCOc1ccccc1C ZINC000019933434 173369157 /nfs/dbraw/zinc/36/91/57/173369157.db2.gz SWCCVRLALQDESD-AWEZNQCLSA-N 2 0 248.370 2.058 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@@H+]([C@H]2CCc3ccc(F)cc32)C1 ZINC000336578218 173370862 /nfs/dbraw/zinc/37/08/62/173370862.db2.gz XWAMORDMIVXZQN-NHYWBVRUSA-N 2 0 248.345 2.354 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](C[C@H](C)CC(C)C)C1 ZINC000300965183 173370868 /nfs/dbraw/zinc/37/08/68/173370868.db2.gz RLIJABTYJGVGLW-OLZOCXBDSA-N 2 0 212.381 2.210 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](Cc2cccc(C)c2)C1 ZINC000011891904 173370929 /nfs/dbraw/zinc/37/09/29/173370929.db2.gz CGHVQMJPGMGXRG-AWEZNQCLSA-N 2 0 218.344 2.036 20 0 BEADRP C[NH2+]C[C@H]1CCC[N@H+](CCc2ccccc2)C1 ZINC000011888794 173379313 /nfs/dbraw/zinc/37/93/13/173379313.db2.gz DLAVNDLZWDBEPM-OAHLLOKOSA-N 2 0 232.371 2.161 20 0 BEADRP C[NH2+]C[C@H]1CCCN1CCOc1cccc(C)c1 ZINC000019933442 173379551 /nfs/dbraw/zinc/37/95/51/173379551.db2.gz SLYQFCFRMMZVKV-CQSZACIVSA-N 2 0 248.370 2.058 20 0 BEADRP C[NH2+]C[C@H]1CCCN1CCOc1ccccc1C ZINC000019933436 173379645 /nfs/dbraw/zinc/37/96/45/173379645.db2.gz SWCCVRLALQDESD-CQSZACIVSA-N 2 0 248.370 2.058 20 0 BEADRP COC1(C[NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)CCCC1 ZINC000336655243 174003531 /nfs/dbraw/zinc/00/35/31/174003531.db2.gz JCVRGXFDFNAUSM-CHWSQXEVSA-N 2 0 240.391 2.018 20 0 BEADRP COCCCCC[N@@H+]1CCC[C@@H]([NH+](C)C)CC1 ZINC000365405607 174178885 /nfs/dbraw/zinc/17/88/85/174178885.db2.gz TUSFMYPETDQRGB-CQSZACIVSA-N 2 0 242.407 2.219 20 0 BEADRP COCC[C@@H](C)[NH2+]CCCCC[NH+]1CCCC1 ZINC000340475546 174382769 /nfs/dbraw/zinc/38/27/69/174382769.db2.gz DBVRWLHGXADFIE-CQSZACIVSA-N 2 0 242.407 2.267 20 0 BEADRP COCC[C@@H]1CCC[C@H]1[NH2+][C@@H](C)CC[NH+](C)C ZINC000337410443 174397558 /nfs/dbraw/zinc/39/75/58/174397558.db2.gz VSTIAZZMUOGERX-MELADBBJSA-N 2 0 242.407 2.121 20 0 BEADRP COc1ccc(C)cc1[C@@H](C)[NH2+]CCC[NH3+] ZINC000037713354 175079068 /nfs/dbraw/zinc/07/90/68/175079068.db2.gz URSXHPUBXFFWCK-LLVKDONJSA-N 2 0 222.332 2.003 20 0 BEADRP COc1ccc(C)cc1[C@H](C)[NH2+]CCC[NH3+] ZINC000037713355 175081035 /nfs/dbraw/zinc/08/10/35/175081035.db2.gz URSXHPUBXFFWCK-NSHDSACASA-N 2 0 222.332 2.003 20 0 BEADRP COc1ccc(C[NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000090720845 175111960 /nfs/dbraw/zinc/11/19/60/175111960.db2.gz ZEPDVHIRKNEXMG-JSGCOSHPSA-N 2 0 248.370 2.268 20 0 BEADRP COc1ccc([C@@H](C)[NH2+][C@H](C)CCC[NH3+])cc1 ZINC000310171121 175177782 /nfs/dbraw/zinc/17/77/82/175177782.db2.gz TYNLFRBYEWLCIE-VXGBXAGGSA-N 2 0 236.359 2.473 20 0 BEADRP COc1cccc(C[NH2+][C@@H]2CCC[N@H+](C)CC2)c1 ZINC000076693013 175267126 /nfs/dbraw/zinc/26/71/26/175267126.db2.gz PNNMPOVYVRWWHT-CQSZACIVSA-N 2 0 248.370 2.269 20 0 BEADRP COc1cccc([C@H](C)[NH2+][C@@H]2CN(C)C[C@@H]2C)c1 ZINC000358407124 175293405 /nfs/dbraw/zinc/29/34/05/175293405.db2.gz SOYCXQGWPQFZHU-SLEUVZQESA-N 2 0 248.370 2.296 20 0 BEADRP COc1ccccc1C[N@@H+]1CCCC[C@@H]1CC[NH3+] ZINC000070074069 175326629 /nfs/dbraw/zinc/32/66/29/175326629.db2.gz WETASUQCQJWPHM-CQSZACIVSA-N 2 0 248.370 2.399 20 0 BEADRP COc1ccccc1C[NH2+][C@@H](C)CCCC[NH3+] ZINC000336682584 175329826 /nfs/dbraw/zinc/32/98/26/175329826.db2.gz FAMMJNQBQRQSMA-LBPRGKRZSA-N 2 0 236.359 2.302 20 0 BEADRP COc1ccccc1[C@H](C)[NH2+][C@@H]1CCC[C@H]1C[NH3+] ZINC000149128709 175352073 /nfs/dbraw/zinc/35/20/73/175352073.db2.gz MVYNUZRJFZVPOY-SGMGOOAPSA-N 2 0 248.370 2.473 20 0 BEADRP CSCC[C@H](C)[N@H+](C)C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000300056446 175504840 /nfs/dbraw/zinc/50/48/40/175504840.db2.gz QAVJSYGRDGBXOB-FRRDWIJNSA-N 2 0 244.448 2.448 20 0 BEADRP CC(C)C1(C[NH2+]C[C@H]2CCC[N@H+](C)C2)CC1 ZINC000232678229 487630929 /nfs/dbraw/zinc/63/09/29/487630929.db2.gz AOMFPNGVCOEYIL-CYBMUJFWSA-N 2 0 224.392 2.354 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H]1CCCCC1(C)C ZINC000556933998 322931471 /nfs/dbraw/zinc/93/14/71/322931471.db2.gz BFLAAUHXNHKLPV-RYUDHWBXSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](C)c1ccncc1 ZINC000309252838 175663292 /nfs/dbraw/zinc/66/32/92/175663292.db2.gz AMPHVSAJWGBADS-RYUDHWBXSA-N 2 0 221.348 2.250 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]CCOC1CCCCC1 ZINC000309442139 175665214 /nfs/dbraw/zinc/66/52/14/175665214.db2.gz OGZLPDHRJODAFP-LBPRGKRZSA-N 2 0 228.380 2.053 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+]Cc1cccc(Cl)c1 ZINC000308494384 175708472 /nfs/dbraw/zinc/70/84/72/175708472.db2.gz BIIROJXZZWRNGR-VIFPVBQESA-N 2 0 212.724 2.024 20 0 BEADRP C[N@H+](C[C@H]1CC[NH2+]C1)C1CCC(C)(C)CC1 ZINC000087287467 487631903 /nfs/dbraw/zinc/63/19/03/487631903.db2.gz DILDPKCBDLHIKE-LBPRGKRZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H](c1cccc(F)c1)[N@@H+]1CC[C@H](C[NH3+])C1 ZINC000049530942 176018500 /nfs/dbraw/zinc/01/85/00/176018500.db2.gz XMRDWBJBEDGNIL-WDEREUQCSA-N 2 0 222.307 2.167 20 0 BEADRP C[C@@H]1CCCCC[N@@H+]1C[C@@H]1CCC[NH2+]C1 ZINC000069944954 176063770 /nfs/dbraw/zinc/06/37/70/176063770.db2.gz QVQFCDZOIQMHDA-CHWSQXEVSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[NH+]1CCC([NH3+])CC1 ZINC000042864218 176074855 /nfs/dbraw/zinc/07/48/55/176074855.db2.gz MSOIOGBQIGFUAE-VXGBXAGGSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+]C[C@@H]1CCCN1C ZINC000221149819 176081095 /nfs/dbraw/zinc/08/10/95/176081095.db2.gz RBFRUAUQEKSJRO-AGIUHOORSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H]1CCC[N@H+](CCC2CC[NH2+]CC2)[C@@H]1C ZINC000050565082 176097811 /nfs/dbraw/zinc/09/78/11/176097811.db2.gz YRTHNYBSOKWNCL-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CCC[C@@H]1C[NH2+]C1CCC([NH3+])CC1 ZINC000230665012 176128417 /nfs/dbraw/zinc/12/84/17/176128417.db2.gz HMAWWJWDYAUJLC-OKZRHMCRSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1CCC[C@H](CC[N@@H+]2CC[C@H](C[NH3+])C2)C1 ZINC000070532673 176136442 /nfs/dbraw/zinc/13/64/42/176136442.db2.gz BNYFRJVVAAVKJT-MGPQQGTHSA-N 2 0 224.392 2.483 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]C2CC[NH2+]CC2)[C@@H]1C ZINC000038040601 176142930 /nfs/dbraw/zinc/14/29/30/176142930.db2.gz GLILUBLVMICMFH-WZRBSPASSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1CCC[C@H]1[NH2+]CC[C@H]1CCC[N@@H+]1C ZINC000309154114 176150704 /nfs/dbraw/zinc/15/07/04/176150704.db2.gz WZBDZGKDNVMHTC-JHJVBQTASA-N 2 0 210.365 2.249 20 0 BEADRP CC(C)C[N@H+](C[C@H]1CC[NH2+]C1)C1CCCC1 ZINC000087286702 487633023 /nfs/dbraw/zinc/63/30/23/487633023.db2.gz DEMHOEHIPGBDJB-ZDUSSCGKSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000336717143 176218047 /nfs/dbraw/zinc/21/80/47/176218047.db2.gz XUVHLWQQVGGQPA-VOAKCMCISA-N 2 0 208.349 2.001 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)C1 ZINC000300239964 176227029 /nfs/dbraw/zinc/22/70/29/176227029.db2.gz BTVIILDGYXBOIG-MQYQWHSLSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CC2=CC[N@H+](C)CC2)C1 ZINC000309105913 176232913 /nfs/dbraw/zinc/23/29/13/176232913.db2.gz HWKXDEILZBQEHM-YPMHNXCESA-N 2 0 208.349 2.027 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@@H]2CCC[NH2+]C2)C[C@H]1C ZINC000251525194 176233091 /nfs/dbraw/zinc/23/30/91/176233091.db2.gz ACNARBXHXSZUKL-SYQHCUMBSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1CN(C)C[C@H]1[NH2+][C@H]1CC[C@@H](C)C[C@H]1C ZINC000336747398 176234423 /nfs/dbraw/zinc/23/44/23/176234423.db2.gz RZGGBHMTDCTUKZ-XGFWRYKXSA-N 2 0 224.392 2.351 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@@H]2CCc3nc[nH]c3C2)C1 ZINC000309772313 176234445 /nfs/dbraw/zinc/23/44/45/176234445.db2.gz KSQQYWYFPXLBHQ-OUAUKWLOSA-N 2 0 219.332 2.045 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]CCC1(C)CC1 ZINC000336763769 176268328 /nfs/dbraw/zinc/26/83/28/176268328.db2.gz PNIBBQFTASDSIT-NEPJUHHUSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC[N@H+](C)C[C@H]1C)C(F)(F)F ZINC000309727261 176268578 /nfs/dbraw/zinc/26/85/78/176268578.db2.gz DKHHLQPHBFDWTM-BBBLOLIVSA-N 2 0 238.297 2.115 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]C[C@H]1CCSC1 ZINC000300230004 176278985 /nfs/dbraw/zinc/27/89/85/176278985.db2.gz NPCBEIXOGQZEPK-LPWJVIDDSA-N 2 0 242.432 2.058 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+][C@H]1CCC1(C)C ZINC000309218652 176280120 /nfs/dbraw/zinc/28/01/20/176280120.db2.gz PYWUDQVXWOJGAQ-LPWJVIDDSA-N 2 0 224.392 2.493 20 0 BEADRP C[C@@H]1C[N@H+](Cc2cccc(F)c2)C[C@@]1(C)C[NH3+] ZINC000335262670 176306588 /nfs/dbraw/zinc/30/65/88/176306588.db2.gz MWPWSCCCXSDTOA-BXUZGUMPSA-N 2 0 236.334 2.242 20 0 BEADRP C[C@@H]1C[N@H+](Cc2ccsc2)C[C@@]1(C)C[NH3+] ZINC000309042566 176308560 /nfs/dbraw/zinc/30/85/60/176308560.db2.gz KUUSWFTWKSRIJA-ZYHUDNBSSA-N 2 0 224.373 2.165 20 0 BEADRP C[C@H](C[NH2+][C@H]1CSC[C@H]1C)C[NH+]1CCCC1 ZINC000304500481 176353364 /nfs/dbraw/zinc/35/33/64/176353364.db2.gz NFHKQLWMICYMIO-UPJWGTAASA-N 2 0 242.432 2.059 20 0 BEADRP C[C@@H]1C[C@@H](C)C[NH+](CCC[NH2+]Cc2cc[nH]c2)C1 ZINC000086251050 176360519 /nfs/dbraw/zinc/36/05/19/176360519.db2.gz XTJQBEUQYQCMBW-ZIAGYGMSSA-N 2 0 249.402 2.472 20 0 BEADRP C[C@@H]1C[C@@H](C)C[NH+](CC[C@@H]2CCCC[NH2+]2)C1 ZINC000026515077 176361852 /nfs/dbraw/zinc/36/18/52/176361852.db2.gz DFIGHHKRSRRDCH-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[C@@H]([N@H+](C)CCc2cccnc2)CCN1C ZINC000172844211 176371772 /nfs/dbraw/zinc/37/17/72/176371772.db2.gz RQCUTYOOVKBWLN-HIFRSBDPSA-N 2 0 247.386 2.039 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CC2(C)CCC2)CC[N@@H+]1C ZINC000181244019 176375456 /nfs/dbraw/zinc/37/54/56/176375456.db2.gz ACEFXFRSGWKDBZ-NEPJUHHUSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1 ZINC000336769807 176397404 /nfs/dbraw/zinc/39/74/04/176397404.db2.gz VWNZRIWJHUFLQP-LPWJVIDDSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]Cc1ccc(F)cc1 ZINC000336716043 176621202 /nfs/dbraw/zinc/62/12/02/176621202.db2.gz WXDFRIYWJAFBQW-SNVBAGLBSA-N 2 0 210.296 2.043 20 0 BEADRP C[C@H]([NH2+]C1CCC([NH3+])CC1)c1ccoc1 ZINC000087290152 487635646 /nfs/dbraw/zinc/63/56/46/487635646.db2.gz SINSLDMRTOLDBU-GCVQQVDUSA-N 2 0 208.305 2.200 20 0 BEADRP C[C@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1nccs1 ZINC000309422743 176845788 /nfs/dbraw/zinc/84/57/88/176845788.db2.gz BFKKOIFVBZPAIX-QWRGUYRKSA-N 2 0 239.388 2.326 20 0 BEADRP C[C@H](c1cccnc1)[N@@H+]1C[C@@H]2CCC[C@@H]([NH3+])[C@@H]2C1 ZINC000228474320 177046273 /nfs/dbraw/zinc/04/62/73/177046273.db2.gz NGDLLRXNSMOKIJ-FAAHXZRKSA-N 2 0 245.370 2.202 20 0 BEADRP C[C@H]1CCCCC[N@@H+]1C[C@@]1(C)CC[NH2+]C1 ZINC000226737007 177070616 /nfs/dbraw/zinc/07/06/16/177070616.db2.gz QIMBGJFXRMUIGM-STQMWFEESA-N 2 0 210.365 2.251 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2CCCC[C@@H]2C)CC[NH2+]1 ZINC000235367732 177077048 /nfs/dbraw/zinc/07/70/48/177077048.db2.gz OBLVBDRSHHJVOE-FRRDWIJNSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@H]1CCCC[C@@H]1C[NH2+]C1CC[NH2+]CC1 ZINC000042859661 177079905 /nfs/dbraw/zinc/07/99/05/177079905.db2.gz ZPZJICWFVVSSJU-NWDGAFQWSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H]1CCCC[C@@H]1[NH2+]CCCC[NH+](C)C ZINC000045662967 177082485 /nfs/dbraw/zinc/08/24/85/177082485.db2.gz FMHWEPVUIKJCFC-STQMWFEESA-N 2 0 212.381 2.497 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCCC[C@@H]1C)C[NH+](C)C ZINC000336668027 177082963 /nfs/dbraw/zinc/08/29/63/177082963.db2.gz DZHODBGSMGUHAD-AGIUHOORSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H]1CCCC[C@H]1C[NH2+]CCC[NH+](C)C ZINC000122588910 177085967 /nfs/dbraw/zinc/08/59/67/177085967.db2.gz VBUDBSQSGAORFM-STQMWFEESA-N 2 0 212.381 2.354 20 0 BEADRP C[C@H]1CCCC[C@H]1[N@H+](C)CC1CC[NH2+]CC1 ZINC000042611001 177087155 /nfs/dbraw/zinc/08/71/55/177087155.db2.gz JBVPRWCQBUWEBS-GXTWGEPZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1CCC[C@H]([NH2+]CC2=CC[N@H+](C)CC2)C1 ZINC000309769222 177137595 /nfs/dbraw/zinc/13/75/95/177137595.db2.gz KCHPGNKXHCYYBZ-JSGCOSHPSA-N 2 0 222.376 2.417 20 0 BEADRP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]CCC1(F)CCC1 ZINC000336778900 177233693 /nfs/dbraw/zinc/23/36/93/177233693.db2.gz MQWBSIMREOTHHI-NWDGAFQWSA-N 2 0 228.355 2.199 20 0 BEADRP C[C@H]1C[N@H+](CCCCC(F)(F)F)CC[C@@H]1[NH3+] ZINC000124394529 177248553 /nfs/dbraw/zinc/24/85/53/177248553.db2.gz VLNOUDCBJMRPLB-UWVGGRQHSA-N 2 0 238.297 2.388 20 0 BEADRP C[C@H]1C[N@H+](Cc2ccc3c(c2)CCC3)CC[C@@H]1[NH3+] ZINC000094341411 177263615 /nfs/dbraw/zinc/26/36/15/177263615.db2.gz QBTLNIVLAUZURD-LRDDRELGSA-N 2 0 244.382 2.344 20 0 BEADRP C[C@H]1CSC[C@H]1[NH2+]CCC1CC[NH+](C)CC1 ZINC000304405956 177306736 /nfs/dbraw/zinc/30/67/36/177306736.db2.gz HXLAWPBNISKLAR-WCQYABFASA-N 2 0 242.432 2.059 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CCC2(C)CC2)CC[N@@H+]1C ZINC000336760059 177330471 /nfs/dbraw/zinc/33/04/71/177330471.db2.gz LYHRGWAZWWKIHI-RYUDHWBXSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]CC1CCCC1 ZINC000036908586 177330545 /nfs/dbraw/zinc/33/05/45/177330545.db2.gz ADPPVWLZEVORLJ-MBNYWOFBSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CC2CC(F)(F)C2)CC[N@@H+]1C ZINC000309810328 177330843 /nfs/dbraw/zinc/33/08/43/177330843.db2.gz UALWFRSSUWQBJF-ONGXEEELSA-N 2 0 232.318 2.104 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CCCc2ccccn2)CC[N@@H+]1C ZINC000181493648 177331193 /nfs/dbraw/zinc/33/11/93/177331193.db2.gz CUCFFOIDOBUUEB-ZFWWWQNUSA-N 2 0 247.386 2.087 20 0 BEADRP C[C@H]1C[C@@H]1C[NH2+]C1CCC([NH+](C)C)CC1 ZINC000309113492 177344961 /nfs/dbraw/zinc/34/49/61/177344961.db2.gz KOIQPVLQEMKQKZ-ZFDZMSFRSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@H]1C[C@@H]1C[NH2+]CC1(C[NH+](C)C)CCCC1 ZINC000336778621 177345010 /nfs/dbraw/zinc/34/50/10/177345010.db2.gz LUUPQNBYTFZQTO-QWHCGFSZSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@@H]2CCC[NH2+]C2)[C@@H](C)C1 ZINC000226846284 177356001 /nfs/dbraw/zinc/35/60/01/177356001.db2.gz IGYZBENVAABSJN-RQJABVFESA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H]1C[C@H](C[N@@H+]2CCC(C)(C)C2)CC[NH2+]1 ZINC000235661396 177362278 /nfs/dbraw/zinc/36/22/78/177362278.db2.gz XFVUNXCSFJMTLP-NWDGAFQWSA-N 2 0 210.365 2.106 20 0 BEADRP CCC(CC)C[N@@H+]1CC[C@@H]([NH3+])[C@@H](CC)C1 ZINC000226013418 487644048 /nfs/dbraw/zinc/64/40/48/487644048.db2.gz FJKAHHHSIBICOW-QWHCGFSZSA-N 2 0 212.381 2.482 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+]C/C=C/c1ccncc1 ZINC000486964946 225277304 /nfs/dbraw/zinc/27/73/04/225277304.db2.gz IZEYAURUUHORTE-IHVVCDCBSA-N 2 0 233.359 2.025 20 0 BEADRP Cc1cc(N2CC[N@H+](C)[C@@H](C(C)C)C2)cc[nH+]1 ZINC000487078081 225287057 /nfs/dbraw/zinc/28/70/57/225287057.db2.gz XWTKXASOTAYVSJ-CQSZACIVSA-N 2 0 233.359 2.166 20 0 BEADRP CC(C)OC[C@@H](C)[NH2+]C[C@@H]1CC[N@@H+](C(C)C)C1 ZINC000669680747 487644182 /nfs/dbraw/zinc/64/41/82/487644182.db2.gz HYWARZBBPNYRDY-KGLIPLIRSA-N 2 0 242.407 2.120 20 0 BEADRP CC(C)OC[C@H](C)[NH2+]C[C@H]1CC[N@@H+](C(C)C)C1 ZINC000669680748 487644333 /nfs/dbraw/zinc/64/43/33/487644333.db2.gz HYWARZBBPNYRDY-UONOGXRCSA-N 2 0 242.407 2.120 20 0 BEADRP COCC(C)(C)C[NH2+]CCC[NH+]1CCCCC1 ZINC000494330356 226263894 /nfs/dbraw/zinc/26/38/94/226263894.db2.gz MEGVKBUEASFJNK-UHFFFAOYSA-N 2 0 242.407 2.125 20 0 BEADRP C[C@H](CCC1CC1)[NH2+][C@H](C)[C@H]1CCC[NH2+]1 ZINC000400332962 226340958 /nfs/dbraw/zinc/34/09/58/226340958.db2.gz DIWLZQQWPBFXJY-NQBHXWOUSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCCCS1)[C@H]1CCC[NH2+]1 ZINC000400399358 226342611 /nfs/dbraw/zinc/34/26/11/226342611.db2.gz PJEGXYYHGNLUOP-QJPTWQEYSA-N 2 0 228.405 2.002 20 0 BEADRP C[C@H]([NH2+][C@H]1CC2CCC1CC2)[C@H]1CCC[NH2+]1 ZINC000400690089 226349521 /nfs/dbraw/zinc/34/95/21/226349521.db2.gz YVEBUJKQOROWDE-MGYRSQIZSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)c1ccncc1 ZINC000401035669 226352629 /nfs/dbraw/zinc/35/26/29/226352629.db2.gz YTZUPICPADDAGY-PMOUVXMZSA-N 2 0 245.370 2.120 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]CC1CC(C)(C)C1 ZINC000564826477 322933984 /nfs/dbraw/zinc/93/39/84/322933984.db2.gz PUBIMJFDICXKJZ-DGCLKSJQSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CC1CC(F)(F)C1 ZINC000394812867 262748926 /nfs/dbraw/zinc/74/89/26/262748926.db2.gz PJHHQYXAMOUKKE-SECBINFHSA-N 2 0 220.307 2.139 20 0 BEADRP Cc1cccc([C@H](C)N[C@H](C)[C@H](C)[NH3+])c1 ZINC000309120135 229361542 /nfs/dbraw/zinc/36/15/42/229361542.db2.gz SVHSMZDENDYQCY-TUAOUCFPSA-N 2 0 206.333 2.381 20 0 BEADRP CC[C@@H](C)C[N@H+](CC)C[C@@H](O)C[NH+](C)C(C)C ZINC000383842528 487677816 /nfs/dbraw/zinc/67/78/16/487677816.db2.gz ZQXQYXCBICDIEI-KGLIPLIRSA-N 2 0 244.423 2.056 20 0 BEADRP CCC[C@H](C)[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000233338779 487710989 /nfs/dbraw/zinc/71/09/89/487710989.db2.gz IDVMMLVBKMBHLU-NWDGAFQWSA-N 2 0 210.365 2.439 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@@H]2CCC[C@H]21)C1CC1 ZINC000671743655 487718727 /nfs/dbraw/zinc/71/87/27/487718727.db2.gz GRRBHUQTUIWGHG-FAAHXZRKSA-N 2 0 236.403 2.495 20 0 BEADRP CCCCC[N@@H+]1C[C@@H]2CCC[C@]2(C[NH3+])C1 ZINC000308900036 487723116 /nfs/dbraw/zinc/72/31/16/487723116.db2.gz JTPJMRIQTPIMTJ-STQMWFEESA-N 2 0 210.365 2.237 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@@H](C)CCc1ccccc1F ZINC000414875189 487733346 /nfs/dbraw/zinc/73/33/46/487733346.db2.gz JLBDGTIVOOZSOP-RYUDHWBXSA-N 2 0 238.350 2.331 20 0 BEADRP C[C@@H]([N@H+](C)CC[C@H]1CC[NH2+]C1)C(C)(C)C ZINC000251027313 487746683 /nfs/dbraw/zinc/74/66/83/487746683.db2.gz GTOFTBSJCQXCOL-VXGBXAGGSA-N 2 0 212.381 2.352 20 0 BEADRP CC[C@@](C)(C[NH2+]CCC[NH+]1CCCCC1)OC ZINC000233958228 487754524 /nfs/dbraw/zinc/75/45/24/487754524.db2.gz XWDJAQDFYGCMTG-AWEZNQCLSA-N 2 0 242.407 2.267 20 0 BEADRP CC(C)[C@@H]1CCC[N@H+](C[C@H]2CC[NH2+]C2)CC1 ZINC000251384365 487754734 /nfs/dbraw/zinc/75/47/34/487754734.db2.gz ZYULCDFUQHRBAL-UONOGXRCSA-N 2 0 224.392 2.354 20 0 BEADRP CCC(CC)C[N@@H+]1CC[C@@H]([NH3+])[C@H](CC)C1 ZINC000251629314 487779690 /nfs/dbraw/zinc/77/96/90/487779690.db2.gz FJKAHHHSIBICOW-CHWSQXEVSA-N 2 0 212.381 2.482 20 0 BEADRP C[C@@H](C[N@@H+]1CC[C@@H]([NH3+])[C@H](C)C1)C(C)(C)C ZINC000251889687 487805646 /nfs/dbraw/zinc/80/56/46/487805646.db2.gz VLHMVHRYGDRJCN-GRYCIOLGSA-N 2 0 212.381 2.338 20 0 BEADRP C[C@@H]1CCC[C@@H]([N@H+](C)C[C@H]2CC[NH2+]C2)C1 ZINC000251953166 487809413 /nfs/dbraw/zinc/80/94/13/487809413.db2.gz XABDLEAURPRWHR-FRRDWIJNSA-N 2 0 210.365 2.106 20 0 BEADRP [NH3+]CCC[NH2+]C1(c2ccccc2)CCC1 ZINC000414698387 487817438 /nfs/dbraw/zinc/81/74/38/487817438.db2.gz DEQIDGGWPODZRP-UHFFFAOYSA-N 2 0 204.317 2.004 20 0 BEADRP Cc1cc(C)cc([C@H]2CC[N@H+](CCC[NH3+])C2)c1 ZINC000414716676 487818761 /nfs/dbraw/zinc/81/87/61/487818761.db2.gz SNFQKYTYAWCTGM-AWEZNQCLSA-N 2 0 232.371 2.442 20 0 BEADRP CCc1ccc(C(C)(C)[NH2+]CCC[NH3+])cc1 ZINC000414706370 487819079 /nfs/dbraw/zinc/81/90/79/487819079.db2.gz LRMICJKVEBZQAW-UHFFFAOYSA-N 2 0 220.360 2.423 20 0 BEADRP C[C@H]1C[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)CS1 ZINC000322749041 487821862 /nfs/dbraw/zinc/82/18/62/487821862.db2.gz WWRJRMKDDPJEJO-HNMFLPSRSA-N 2 0 240.416 2.095 20 0 BEADRP COc1ccc2c(c1)C[C@H](C)[N@@H+](CCC[NH3+])[C@@H]2C ZINC000414753534 487822297 /nfs/dbraw/zinc/82/22/97/487822297.db2.gz DUHPAQMWWMJJBB-NWDGAFQWSA-N 2 0 248.370 2.352 20 0 BEADRP CC[C@H](C)[N@@H+]1CCC[C@@H]([C@H]2CCC[NH2+]2)C1 ZINC000252419010 487824287 /nfs/dbraw/zinc/82/42/87/487824287.db2.gz XSRTUPIIARLOOR-YNEHKIRRSA-N 2 0 210.365 2.249 20 0 BEADRP COc1ccsc1C[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000414936636 487831211 /nfs/dbraw/zinc/83/12/11/487831211.db2.gz ZIVLUQQKEGYQKK-UWVGGRQHSA-N 2 0 240.372 2.116 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCCC[C@H]1C[NH3+])C1CC1 ZINC000252910325 487837614 /nfs/dbraw/zinc/83/76/14/487837614.db2.gz CQAWMUIBBGEBEE-KGYLQXTDSA-N 2 0 210.365 2.140 20 0 BEADRP Cc1ccc(C[N@@H+](C)C[C@@H]2CC[NH2+][C@H](C)C2)nc1 ZINC000666693932 487861791 /nfs/dbraw/zinc/86/17/91/487861791.db2.gz JIUVLWMVVJYQBQ-ZIAGYGMSSA-N 2 0 247.386 2.210 20 0 BEADRP C[C@H](CC1CCC1)[NH2+][C@@H]1CC[NH2+][C@H](C)C1 ZINC000666874200 487874552 /nfs/dbraw/zinc/87/45/52/487874552.db2.gz APOAXRRAYBATEA-NQBHXWOUSA-N 2 0 210.365 2.295 20 0 BEADRP COC[C@]1(C[NH2+]C[C@H](C)C(C)(C)C)CCC[NH2+]1 ZINC000666891903 487875604 /nfs/dbraw/zinc/87/56/04/487875604.db2.gz BVQCIYBSISVTQR-GXTWGEPZSA-N 2 0 242.407 2.027 20 0 BEADRP Fc1cccc(C[NH2+]CC[C@@H]2CC[NH2+]C2)c1F ZINC000666787372 487879858 /nfs/dbraw/zinc/87/98/58/487879858.db2.gz BLSHRNKDXUSVLP-JTQLQIEISA-N 2 0 240.297 2.054 20 0 BEADRP C[C@H](Cc1ccsc1)[NH2+]C[C@@H]([NH3+])C1CC1 ZINC000666835091 487883158 /nfs/dbraw/zinc/88/31/58/487883158.db2.gz ZNUMTQKNACCAGG-BXKDBHETSA-N 2 0 224.373 2.006 20 0 BEADRP [NH3+]C1(C[NH2+]C[C@H]2CCOc3ccccc32)CCC1 ZINC000666828772 487888130 /nfs/dbraw/zinc/88/81/30/487888130.db2.gz OLYBQQWAOFRFPP-GFCCVEGCSA-N 2 0 246.354 2.024 20 0 BEADRP C[C@H](CC1CCC1)[NH2+][C@H]1CCC[NH2+]CC1 ZINC000666857877 487892306 /nfs/dbraw/zinc/89/23/06/487892306.db2.gz NORBYRPPWGOECI-YPMHNXCESA-N 2 0 210.365 2.297 20 0 BEADRP Fc1ccc(C[NH2+][C@H]2CC23CC[NH2+]CC3)cc1 ZINC000666950730 487913216 /nfs/dbraw/zinc/91/32/16/487913216.db2.gz CVNCIEIWDUHROT-ZDUSSCGKSA-N 2 0 234.318 2.057 20 0 BEADRP CCC(CC)C[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000666952106 487913936 /nfs/dbraw/zinc/91/39/36/487913936.db2.gz GFJAQDQQFPXFBI-GFCCVEGCSA-N 2 0 210.365 2.154 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CC23CC[NH2+]CC3)cc1F ZINC000666952316 487914033 /nfs/dbraw/zinc/91/40/33/487914033.db2.gz QODUKAGYLAYISW-CQSZACIVSA-N 2 0 248.345 2.366 20 0 BEADRP C[C@@H]1CCC[N@H+](CC[C@@H]2CCCO2)[C@@H]1CC[NH3+] ZINC000404296867 487917492 /nfs/dbraw/zinc/91/74/92/487917492.db2.gz OBYNMRCZALQCJE-HZSPNIEDSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@@H](C[NH2+][C@@H]1CC[NH2+]C1(C)C)C(C)(C)C ZINC000666966506 487919506 /nfs/dbraw/zinc/91/95/06/487919506.db2.gz YNERLDFBCZPQFQ-WDEREUQCSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@@H](CC1CCC1)[NH2+]CCC[NH2+]C1CC1 ZINC000666991367 487922164 /nfs/dbraw/zinc/92/21/64/487922164.db2.gz BJKIUVVURPAOAU-NSHDSACASA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H](C[NH2+][C@H]1CCCC[NH2+]C1)C(C)(C)C ZINC000666993004 487923847 /nfs/dbraw/zinc/92/38/47/487923847.db2.gz UHBUHGDJSUZWQO-RYUDHWBXSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@H]2CC[NH2+]C3(CCC3)C2)C1 ZINC000666995311 487925379 /nfs/dbraw/zinc/92/53/79/487925379.db2.gz JZCIDWIAWPSZJL-AGIUHOORSA-N 2 0 222.376 2.439 20 0 BEADRP CC1CC([NH2+][C@H]2CC[NH2+]C3(CCC3)C2)C1 ZINC000666995178 487925474 /nfs/dbraw/zinc/92/54/74/487925474.db2.gz FKJOYOPOBYBQJQ-CXQJBGSLSA-N 2 0 208.349 2.049 20 0 BEADRP FC1(F)C[C@]12CC[N@H+](CC[C@H]1CCC[NH2+]C1)C2 ZINC000652364477 487934362 /nfs/dbraw/zinc/93/43/62/487934362.db2.gz SQAYIKROTAFWTH-NEPJUHHUSA-N 2 0 244.329 2.107 20 0 BEADRP C[C@@H]1C[C@@H](C[N@@H+]2CC[C@H](C3CCC3)C2)CC[NH2+]1 ZINC000667060770 487935930 /nfs/dbraw/zinc/93/59/30/487935930.db2.gz YGSUZTHQOJNHTM-IPYPFGDCSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H](CC1CCC1)[NH2+]C1CCC([NH3+])CC1 ZINC000229694564 487937238 /nfs/dbraw/zinc/93/72/38/487937238.db2.gz RPCXILIBANVLMO-QFWMXSHPSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]C[C@@H]1CC[C@H]2C[C@H]2C1 ZINC000403208542 323000305 /nfs/dbraw/zinc/00/03/05/323000305.db2.gz HNOVFBZIPPLUDT-QMIVOQANSA-N 2 0 236.403 2.352 20 0 BEADRP CCN1CCC[C@@H]([NH2+][C@@H]2CCCC23CC3)C1 ZINC000566500759 323003680 /nfs/dbraw/zinc/00/36/80/323003680.db2.gz QUUNUABATQKPNC-CHWSQXEVSA-N 2 0 222.376 2.393 20 0 BEADRP Cc1ccncc1[C@@H](C)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000562860788 323032258 /nfs/dbraw/zinc/03/22/58/323032258.db2.gz IPAPRUBREFIBSG-ZIAGYGMSSA-N 2 0 247.386 2.382 20 0 BEADRP Cc1nc([C@H](C)[NH2+]CC2CC[NH2+]CC2)cs1 ZINC000567638909 323034333 /nfs/dbraw/zinc/03/43/33/323034333.db2.gz VEDOBXJFZDXZME-VIFPVBQESA-N 2 0 239.388 2.102 20 0 BEADRP CC[C@H]([NH2+]CCC[NH2+]C(C)C)[C@@H]1C[C@@H]1C ZINC000562956423 323034807 /nfs/dbraw/zinc/03/48/07/323034807.db2.gz SUMPYHRWEXDVAL-XQQFMLRXSA-N 2 0 212.381 2.399 20 0 BEADRP CCC(C)(C)[C@@H](C)[NH2+]C[C@@H](C)C[NH2+]C ZINC000562956130 323034978 /nfs/dbraw/zinc/03/49/78/323034978.db2.gz GUHFQKHMQXIKHB-WDEREUQCSA-N 2 0 200.370 2.256 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+][C@@H]1CC[C@@H](C[NH3+])C1 ZINC000562962660 323036619 /nfs/dbraw/zinc/03/66/19/323036619.db2.gz JPOXTEFIKYKRNV-JHJVBQTASA-N 2 0 236.359 2.318 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H](C)Cc1ccsc1 ZINC000570183453 323052060 /nfs/dbraw/zinc/05/20/60/323052060.db2.gz KJLVMLCYTRRWHO-MNOVXSKESA-N 2 0 226.389 2.124 20 0 BEADRP Cc1ccc(OCC[NH2+][C@H]2CCC[C@@H]([NH3+])C2)cc1 ZINC000570463198 323060209 /nfs/dbraw/zinc/06/02/09/323060209.db2.gz UTDJUFIUTGYASH-KGLIPLIRSA-N 2 0 248.370 2.233 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[C@@H]([NH3+])C1)c1cscn1 ZINC000570832117 323072182 /nfs/dbraw/zinc/07/21/82/323072182.db2.gz UDPRERXALFDIIF-HBNTYKKESA-N 2 0 239.388 2.311 20 0 BEADRP CC(C)[C@@H](C)[NH2+]C[C@@H](N)c1ccccc1 ZINC000319631698 323085560 /nfs/dbraw/zinc/08/55/60/323085560.db2.gz ZOWRILNDYPAEQC-DGCLKSJQSA-N 2 0 206.333 2.321 20 0 BEADRP CC(C)[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000152012050 323099597 /nfs/dbraw/zinc/09/95/97/323099597.db2.gz HKIQNVVIXZCIKL-UHFFFAOYSA-N 2 0 210.365 2.391 20 0 BEADRP C([NH2+][C@@H]1CCC[C@H]2C[C@H]21)[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000408510476 323120586 /nfs/dbraw/zinc/12/05/86/323120586.db2.gz PVMWLGVKMFPXLZ-DDHJSBNISA-N 2 0 234.387 2.249 20 0 BEADRP CC[NH2+]Cc1cccc(N[C@@H]2CCC[C@H]([NH3+])C2)c1 ZINC000563423378 323124327 /nfs/dbraw/zinc/12/43/27/323124327.db2.gz GVRHHOFPMCQHAM-DZGCQCFKSA-N 2 0 247.386 2.478 20 0 BEADRP CCOc1ccc(C[NH2+]C[C@H]2CCC[NH2+]C2)cc1 ZINC000259042303 323146649 /nfs/dbraw/zinc/14/66/49/323146649.db2.gz PQPAFWXOLJPUGH-AWEZNQCLSA-N 2 0 248.370 2.175 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@@H]1CCC[C@@H](C)[C@@H]1C ZINC000414956061 323152238 /nfs/dbraw/zinc/15/22/38/323152238.db2.gz MYDYOJBIRPJJCD-FVCCEPFGSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]CCOC(C)(C)C ZINC000308722980 323177337 /nfs/dbraw/zinc/17/73/37/323177337.db2.gz FBDIXWRTDBIDFR-FRRDWIJNSA-N 2 0 242.407 2.120 20 0 BEADRP CC[NH+](CC)C[C@@H](C[NH3+])c1ccc(OC)cc1 ZINC000041271835 323205845 /nfs/dbraw/zinc/20/58/45/323205845.db2.gz CGRLPUWQEWIFSD-CYBMUJFWSA-N 2 0 236.359 2.079 20 0 BEADRP C1=CCC(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)C1 ZINC000530216531 323217365 /nfs/dbraw/zinc/21/73/65/323217365.db2.gz QBUPHBIZEAAUEM-SOUVJXGZSA-N 2 0 234.387 2.463 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]CC[C@@H]1CC=CCC1 ZINC000530217074 323217372 /nfs/dbraw/zinc/21/73/72/323217372.db2.gz FCFVPJNMQIDJIK-RDBSUJKOSA-N 2 0 222.376 2.450 20 0 BEADRP CC[C@H]([NH2+][C@H]1CC[NH2+]C[C@H]1C)C1CCC1 ZINC000324908069 323301680 /nfs/dbraw/zinc/30/16/80/323301680.db2.gz ITUBURVQVSBEJV-WXHSDQCUSA-N 2 0 210.365 2.153 20 0 BEADRP CCOCC[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000123490045 323364711 /nfs/dbraw/zinc/36/47/11/323364711.db2.gz HRHKWAOUXBAITN-UHFFFAOYSA-N 2 0 242.407 2.077 20 0 BEADRP C[C@H]([NH2+]CCC1CC[NH+](C)CC1)[C@H]1C[C@H]1C ZINC000321569509 323385180 /nfs/dbraw/zinc/38/51/80/323385180.db2.gz UPNJEFOVKYHMNZ-DYEKYZERSA-N 2 0 224.392 2.352 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]CCCC1CC1 ZINC000156834440 324127622 /nfs/dbraw/zinc/12/76/22/324127622.db2.gz FKEYESGGJDKEDA-QWHCGFSZSA-N 2 0 210.365 2.284 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]CCCc1cccs1 ZINC000517731000 324176649 /nfs/dbraw/zinc/17/66/49/324176649.db2.gz YLTGVHBNWHRBSJ-NEPJUHHUSA-N 2 0 224.373 2.150 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]CCCc1cccs1 ZINC000517731003 324176698 /nfs/dbraw/zinc/17/66/98/324176698.db2.gz YLTGVHBNWHRBSJ-VXGBXAGGSA-N 2 0 224.373 2.150 20 0 BEADRP C[C@H]1CCC[C@@H]1[NH2+]Cc1ccc(C[NH3+])cc1 ZINC000572522377 324189078 /nfs/dbraw/zinc/18/90/78/324189078.db2.gz AKUAIKWYEWXDIF-FZMZJTMJSA-N 2 0 218.344 2.424 20 0 BEADRP C[C@H]([NH2+]CC1=CC[N@H+](C)CC1)C1CC(F)(F)C1 ZINC000529544400 324333458 /nfs/dbraw/zinc/33/34/58/324333458.db2.gz NYNSMIBMCXTOPD-JTQLQIEISA-N 2 0 244.329 2.272 20 0 BEADRP C[C@H](C[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccncc1 ZINC000530223362 324543062 /nfs/dbraw/zinc/54/30/62/324543062.db2.gz UMZACTKWUVGOFL-SQPSOYEMSA-N 2 0 245.370 2.058 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)C(C)(C)C ZINC000133321475 325286373 /nfs/dbraw/zinc/28/63/73/325286373.db2.gz UFNNQNMKVZLSJX-RYUDHWBXSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)C1CCC1 ZINC000133405165 325293639 /nfs/dbraw/zinc/29/36/39/325293639.db2.gz ZRLRJUMLAAGYPE-VXGBXAGGSA-N 2 0 210.365 2.106 20 0 BEADRP COCCCC[N@H+](C)CC[C@H]1CCCC[NH+]1C ZINC000075860425 325317780 /nfs/dbraw/zinc/31/77/80/325317780.db2.gz XOEFTJGPHATTAO-CQSZACIVSA-N 2 0 242.407 2.219 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]CCC2CCCC2)C1 ZINC000086403281 325614565 /nfs/dbraw/zinc/61/45/65/325614565.db2.gz WDQFDVNLLKGOGP-QWHCGFSZSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCC[NH+]2CCCC2)C[C@H](C)O1 ZINC000556149637 325781651 /nfs/dbraw/zinc/78/16/51/325781651.db2.gz OKEOZZVAUMEHEQ-WDNDVIMCSA-N 2 0 240.391 2.018 20 0 BEADRP [NH3+]CCC[NH2+][C@H](CC1CC1)c1ccccc1 ZINC000564791767 325809381 /nfs/dbraw/zinc/80/93/81/325809381.db2.gz CSJKBIIVDKEDKE-CQSZACIVSA-N 2 0 218.344 2.466 20 0 BEADRP COc1ccc(C[NH2+][C@@H](C)C[C@H](C)[NH3+])c(C)c1 ZINC000565593363 325931536 /nfs/dbraw/zinc/93/15/36/325931536.db2.gz SRNHCQXACXKSRR-RYUDHWBXSA-N 2 0 236.359 2.219 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]CC2Cc3ccccc3C2)C1 ZINC000565609797 325935150 /nfs/dbraw/zinc/93/51/50/325935150.db2.gz RMZYZPZDDDHLKW-CVEARBPZSA-N 2 0 244.382 2.261 20 0 BEADRP COC[C@@H](C)C[NH2+]Cc1ccc([C@@H](C)[NH3+])cc1 ZINC000565762694 325952826 /nfs/dbraw/zinc/95/28/26/325952826.db2.gz CXBKYTPNCPKYKJ-NWDGAFQWSA-N 2 0 236.359 2.078 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+]CCCC1CC1 ZINC000156834704 326244013 /nfs/dbraw/zinc/24/40/13/326244013.db2.gz FKEYESGGJDKEDA-CHWSQXEVSA-N 2 0 210.365 2.284 20 0 BEADRP CCCC[C@@H](COC)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000158198696 326311217 /nfs/dbraw/zinc/31/12/17/326311217.db2.gz WWMVQRXHQORWGW-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)[C@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)C1CC1 ZINC000158250721 326313033 /nfs/dbraw/zinc/31/30/33/326313033.db2.gz DXKZCFSBKURKSH-OCCSQVGLSA-N 2 0 224.392 2.352 20 0 BEADRP CC[C@@H](C)[C@H](C)[NH2+]CCCC[NH+]1CCOCC1 ZINC000158739796 326341289 /nfs/dbraw/zinc/34/12/89/326341289.db2.gz GFVOZJSLPNZGNM-KGLIPLIRSA-N 2 0 242.407 2.123 20 0 BEADRP CC[C@H]([NH2+]CCCC[NH+]1CCOCC1)C(C)C ZINC000158807644 326344068 /nfs/dbraw/zinc/34/40/68/326344068.db2.gz DDCCJRRXUAAGKB-AWEZNQCLSA-N 2 0 242.407 2.123 20 0 BEADRP CC/C=C\C[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000569069767 326388483 /nfs/dbraw/zinc/38/84/83/326388483.db2.gz QDIKEORQSDEFQD-ARJAWSKDSA-N 2 0 222.376 2.417 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H]1CCc2ccc(F)cc21 ZINC000569106071 326390471 /nfs/dbraw/zinc/39/04/71/326390471.db2.gz BKHSAQAGVBJAOX-AWEZNQCLSA-N 2 0 236.334 2.402 20 0 BEADRP C[C@H](CC1CCCC1)[NH2+]CCOCC[NH+](C)C ZINC000572808753 326412002 /nfs/dbraw/zinc/41/20/02/326412002.db2.gz BRXJOGRIECNRNU-CYBMUJFWSA-N 2 0 242.407 2.123 20 0 BEADRP c1cc2c(cc1C[NH+]1CCCCC1)C[NH2+]CC2 ZINC000166223729 326431273 /nfs/dbraw/zinc/43/12/73/326431273.db2.gz LOUDNQVGHQLPHC-UHFFFAOYSA-N 2 0 230.355 2.318 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CC2=CCCC2)CC[N@@H+]1C ZINC000401173883 488017708 /nfs/dbraw/zinc/01/77/08/488017708.db2.gz UWKIDIDXDNCMFL-WCQYABFASA-N 2 0 208.349 2.169 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)CC1 ZINC000310126581 488017871 /nfs/dbraw/zinc/01/78/71/488017871.db2.gz XAJANBPRAOLWGC-QLFBSQMISA-N 2 0 236.403 2.497 20 0 BEADRP CCC[N@H+](C)Cc1ccnn1-c1cc[nH+]cc1 ZINC000667495955 488028715 /nfs/dbraw/zinc/02/87/15/488028715.db2.gz CSIHPGZESZVKJG-UHFFFAOYSA-N 2 0 230.315 2.109 20 0 BEADRP CC(C)C[N@@H+]1CCCC[C@H]1[C@H]1CC[NH2+]C1 ZINC000334867370 488059049 /nfs/dbraw/zinc/05/90/49/488059049.db2.gz CVXUKJKHQOJTEK-STQMWFEESA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@H]1CCc2ccc(F)cc21 ZINC000423226580 488062370 /nfs/dbraw/zinc/06/23/70/488062370.db2.gz RGFQWTRCKFATTM-ZANVPECISA-N 2 0 222.307 2.140 20 0 BEADRP CCC(CC)[N@H+](CC)C[C@@H](O)C[NH+](C)C(C)C ZINC000660559985 488064390 /nfs/dbraw/zinc/06/43/90/488064390.db2.gz FWHQOCFFNACBCR-AWEZNQCLSA-N 2 0 244.423 2.198 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@H](C)Cc1ccccn1 ZINC000656200796 488066435 /nfs/dbraw/zinc/06/64/35/488066435.db2.gz FLNLIMYXLKOUCK-CHWSQXEVSA-N 2 0 235.375 2.120 20 0 BEADRP CC[C@H](C)CC[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000394413136 488070149 /nfs/dbraw/zinc/07/01/49/488070149.db2.gz RNQDJJQAYLLJBD-XQQFMLRXSA-N 2 0 212.381 2.495 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]2)C1 ZINC000225882063 488081922 /nfs/dbraw/zinc/08/19/22/488081922.db2.gz SUSIWNCPSNUWKN-MJBXVCDLSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H](C)CC[NH2+]C1CC[NH+](CC)CC1 ZINC000394449124 488091215 /nfs/dbraw/zinc/09/12/15/488091215.db2.gz KUHYVCMOMCHWKA-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP C(CC1CC[NH2+]CC1)C[NH+]1C[C@@H]2CCC[C@H]2C1 ZINC000159948976 488093959 /nfs/dbraw/zinc/09/39/59/488093959.db2.gz BQXYXQKWAFRBMN-GJZGRUSLSA-N 2 0 236.403 2.498 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCC[C@@H]2C[C@@H]21)C[NH+]1CCCC1 ZINC000378957346 488112880 /nfs/dbraw/zinc/11/28/80/488112880.db2.gz NFIWDWRFZSIXOJ-APIJFGDWSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H](C[NH2+][C@H]1CCC[C@@H]2C[C@@H]21)C[NH+]1CCCC1 ZINC000378957371 488114041 /nfs/dbraw/zinc/11/40/41/488114041.db2.gz NFIWDWRFZSIXOJ-XGUBFFRZSA-N 2 0 236.403 2.497 20 0 BEADRP CCC[C@@H](CC)[NH2+]Cc1cnc2n1CCC2 ZINC000657348917 488115722 /nfs/dbraw/zinc/11/57/22/488115722.db2.gz LXTXETBYNNXFTJ-LLVKDONJSA-N 2 0 221.348 2.498 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+]C(C2CC2)C2CC2)C1 ZINC000151104215 488117461 /nfs/dbraw/zinc/11/74/61/488117461.db2.gz YAWJHERVWZOXEW-LBPRGKRZSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@]1(C[NH3+])CC[N@H+](C[C@@H]2CC[C@H]3C[C@H]3C2)C1 ZINC000403602589 488128461 /nfs/dbraw/zinc/12/84/61/488128461.db2.gz GYGIGTMICGFJPS-XJFOESAGSA-N 2 0 222.376 2.093 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCCN(C)C1)[C@@H]1CC1(C)C ZINC000397653402 488128608 /nfs/dbraw/zinc/12/86/08/488128608.db2.gz MGAZSFYNXJMOMP-AGIUHOORSA-N 2 0 224.392 2.495 20 0 BEADRP [NH3+]CCC[NH2+]CCc1csc2ccccc12 ZINC000258721181 488129077 /nfs/dbraw/zinc/12/90/77/488129077.db2.gz IXNDWBXYJZDWFG-UHFFFAOYSA-N 2 0 234.368 2.382 20 0 BEADRP c1cc(C2CC2)ccc1C[NH+]1C[C@@H]2C[NH2+]C[C@H]2C1 ZINC000094522266 487537752 /nfs/dbraw/zinc/53/77/52/487537752.db2.gz AGCJSMGVIZUXAH-HOTGVXAUSA-N 2 0 242.366 2.215 20 0 BEADRP [NH3+]C1CC[NH+](Cc2ccccc2C2CC2)CC1 ZINC000094528185 487537811 /nfs/dbraw/zinc/53/78/11/487537811.db2.gz UZCFLOGHKYXXBK-UHFFFAOYSA-N 2 0 230.355 2.487 20 0 BEADRP COc1ccc(C[N@@H+]2CC[C@@H]([NH3+])C[C@@H]2C)cc1C ZINC000131534691 490083312 /nfs/dbraw/zinc/08/33/12/490083312.db2.gz NPWDWYQKWPHRBG-GXTWGEPZSA-N 2 0 248.370 2.315 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]C[C@@H]1Cc2ccccc21 ZINC000227137699 487554342 /nfs/dbraw/zinc/55/43/42/487554342.db2.gz YAYUQTHOLNSXAG-OFQRWUPVSA-N 2 0 244.382 2.433 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)C1 ZINC000382114121 487531447 /nfs/dbraw/zinc/53/14/47/487531447.db2.gz LOBJZUAVAZXHEG-RFQIPJPRSA-N 2 0 222.376 2.106 20 0 BEADRP C[C@H]1C[NH+](CCCC2CC[NH2+]CC2)C[C@@H]1C ZINC000086015089 487471666 /nfs/dbraw/zinc/47/16/66/487471666.db2.gz OPUDMVATMFGQCF-STQMWFEESA-N 2 0 224.392 2.354 20 0 BEADRP CC[C@@H]1CC[C@@H](C)[N@H+](CC2CC[NH2+]CC2)C1 ZINC000304348750 487487629 /nfs/dbraw/zinc/48/76/29/487487629.db2.gz KDWXWKCUNQPUNX-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)(CC[N@@H+]1CC[C@@](C)(C[NH3+])C1)C1CC1 ZINC000406064253 487498499 /nfs/dbraw/zinc/49/84/99/487498499.db2.gz NWTVQUHVRJONAJ-AWEZNQCLSA-N 2 0 224.392 2.483 20 0 BEADRP CC(C)CC[N@H+](C)C[C@H]1CC[NH2+][C@H](C)C1 ZINC000300056254 487498755 /nfs/dbraw/zinc/49/87/55/487498755.db2.gz OLWLZWUYGMVJAW-OLZOCXBDSA-N 2 0 212.381 2.352 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000304648728 487513657 /nfs/dbraw/zinc/51/36/57/487513657.db2.gz YAYJLFNFVBABBH-HZSPNIEDSA-N 2 0 224.392 2.495 20 0 BEADRP COc1cccc(C[NH2+][C@@H](C)CCC[NH3+])c1F ZINC000666942057 487908797 /nfs/dbraw/zinc/90/87/97/487908797.db2.gz GSLKHALLXHRPLS-JTQLQIEISA-N 2 0 240.322 2.051 20 0 BEADRP CC1=CCC[C@H](C)[C@@H]1C[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC000682404679 487947858 /nfs/dbraw/zinc/94/78/58/487947858.db2.gz HYVSTPZZCIFQRM-BYNSBNAKSA-N 2 0 234.387 2.130 20 0 BEADRP COc1ccc(CC[NH2+][C@@H]2CCC[C@H]([NH3+])C2)cc1 ZINC000093209568 488139565 /nfs/dbraw/zinc/13/95/65/488139565.db2.gz XSJJDFKHZZBQKC-UONOGXRCSA-N 2 0 248.370 2.097 20 0 BEADRP C(C1CC1)N1CC[C@@H]([NH2+][C@H]2CCC[C@@H]3C[C@@H]32)C1 ZINC000667859194 488140209 /nfs/dbraw/zinc/14/02/09/488140209.db2.gz HXBNAAZKLKQOKG-KBXIAJHMSA-N 2 0 234.387 2.249 20 0 BEADRP C[N@H+](CCC1CCCCC1)C[C@H]1CC[NH2+]C1 ZINC000258863512 488140300 /nfs/dbraw/zinc/14/03/00/488140300.db2.gz IWZOXAOETUQUPX-AWEZNQCLSA-N 2 0 224.392 2.498 20 0 BEADRP C(C1CC1)N1CC[C@H]([NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)C1 ZINC000667859193 488140719 /nfs/dbraw/zinc/14/07/19/488140719.db2.gz HXBNAAZKLKQOKG-CBBWQLFWSA-N 2 0 234.387 2.249 20 0 BEADRP CC[C@@](C)(C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)OC ZINC000322529327 488189545 /nfs/dbraw/zinc/18/95/45/488189545.db2.gz PCGXLKQPLHRQSK-GSPSYOTPSA-N 2 0 240.391 2.016 20 0 BEADRP CC[C@@](C)(C[NH2+][C@H](C)C1CC[NH+](C)CC1)OC ZINC000322568092 488191926 /nfs/dbraw/zinc/19/19/26/488191926.db2.gz YOQHTALEZQKKEY-OCCSQVGLSA-N 2 0 242.407 2.121 20 0 BEADRP Cc1cc(C[N@H+]2CCCC23CC[NH+](C)CC3)on1 ZINC000678219108 488219685 /nfs/dbraw/zinc/21/96/85/488219685.db2.gz KJZUMKYBTDNXPA-UHFFFAOYSA-N 2 0 249.358 2.043 20 0 BEADRP [NH3+]CC[C@@H]1CCC[N@H+](CCC2CCC2)C1 ZINC000398616632 488220758 /nfs/dbraw/zinc/22/07/58/488220758.db2.gz CMJNRKNETAWLMU-ZDUSSCGKSA-N 2 0 210.365 2.237 20 0 BEADRP [NH3+]C[C@]12CCC[C@H]1C[N@H+](CCC1CCC1)C2 ZINC000398679908 488222271 /nfs/dbraw/zinc/22/22/71/488222271.db2.gz XGOQXIQMYDVKIF-KBPBESRZSA-N 2 0 222.376 2.237 20 0 BEADRP CC[C@@H]1C[N@H+](CCC2CCC2)CC[C@H]1[NH3+] ZINC000398751677 488223350 /nfs/dbraw/zinc/22/33/50/488223350.db2.gz BYSHWFOIHCZORA-CHWSQXEVSA-N 2 0 210.365 2.236 20 0 BEADRP Cc1ccc([C@H](C)[NH2+]CCN2CCCC2)c(C)n1 ZINC000678412291 488251895 /nfs/dbraw/zinc/25/18/95/488251895.db2.gz SVSMNCQVKFVCGO-ZDUSSCGKSA-N 2 0 247.386 2.445 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@]2(C)CCCOC2)CC1 ZINC000678772902 488281611 /nfs/dbraw/zinc/28/16/11/488281611.db2.gz AFMBMBNYZPETOI-CQSZACIVSA-N 2 0 240.391 2.020 20 0 BEADRP C[C@H](CNc1cc[nH+]c2c(O)cccc12)[NH+](C)C ZINC000684570016 488327841 /nfs/dbraw/zinc/32/78/41/488327841.db2.gz MBUISOGPTNOGLP-SNVBAGLBSA-N 2 0 245.326 2.302 20 0 BEADRP C[N@@H+](Cc1ccc(O)cc1)C[C@H]1CCC[NH+](C)C1 ZINC000679396059 488350664 /nfs/dbraw/zinc/35/06/64/488350664.db2.gz NWAFWGCBCLJTRV-AWEZNQCLSA-N 2 0 248.370 2.166 20 0 BEADRP CO[C@@H]1CCC[C@H]([NH2+]CC(C)(C)C[NH+](C)C)C1 ZINC000070325467 490205976 /nfs/dbraw/zinc/20/59/76/490205976.db2.gz LDLPAUBQMZAVII-QWHCGFSZSA-N 2 0 242.407 2.121 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H]1CCCOC1 ZINC000070463764 490214414 /nfs/dbraw/zinc/21/44/14/490214414.db2.gz NEONYGKSAVMAML-KBPBESRZSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@H]1C)C1CC[NH+](C)CC1 ZINC000070827359 490240073 /nfs/dbraw/zinc/24/00/73/490240073.db2.gz JZVMBTRHABMEMH-MBNYWOFBSA-N 2 0 224.392 2.495 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]CC[C@H]2CCCO2)c2ccccc21 ZINC000252789419 490267734 /nfs/dbraw/zinc/26/77/34/490267734.db2.gz RMIQFRCFJJALNI-KCPJHIHWSA-N 2 0 246.354 2.290 20 0 BEADRP CC[C@H]([NH2+]C[C@H]1CC[N@@H+](C(C)C)C1)C1CC1 ZINC000083055796 490318686 /nfs/dbraw/zinc/31/86/86/490318686.db2.gz KUBAUVWQDBVZGI-OCCSQVGLSA-N 2 0 224.392 2.495 20 0 BEADRP Cc1cccc(C)c1C[N@@H+](C)CC1CN(C)C1 ZINC000668539824 490357845 /nfs/dbraw/zinc/35/78/45/490357845.db2.gz NKDUYBRALKKEDE-UHFFFAOYSA-N 2 0 232.371 2.297 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CC1(C)C)C1CC[NH+](C)CC1 ZINC000222050558 490466449 /nfs/dbraw/zinc/46/64/49/490466449.db2.gz DBINLTSRQDAGHT-YPMHNXCESA-N 2 0 224.392 2.352 20 0 BEADRP CCC[N@@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000662293303 491087505 /nfs/dbraw/zinc/08/75/05/491087505.db2.gz GIPJTHSLXNLLKU-CYBMUJFWSA-N 2 0 210.365 2.108 20 0 BEADRP Cc1ncccc1C[N@H+]1CCC[C@@H](C)[C@@H]1CC[NH3+] ZINC000404292487 491093579 /nfs/dbraw/zinc/09/35/79/491093579.db2.gz LVJHNICPMZWTLE-DOMZBBRYSA-N 2 0 247.386 2.339 20 0 BEADRP CC(C)(C[NH2+][C@H]1CCC[C@H]1[NH3+])c1cccs1 ZINC000259086649 491102036 /nfs/dbraw/zinc/10/20/36/491102036.db2.gz RNHWPKGUEOARJT-MNOVXSKESA-N 2 0 238.400 2.495 20 0 BEADRP CC1CCC([NH2+][C@H]2CCC[NH2+]CC2)CC1 ZINC000168698652 491106650 /nfs/dbraw/zinc/10/66/50/491106650.db2.gz MWAJVHMXEGSCOA-CPCZMJQVSA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@@H]1CC[C@@H](C)[N@H+](CC[C@@H]2CC[NH2+]C2)C1 ZINC000304318406 491109998 /nfs/dbraw/zinc/10/99/98/491109998.db2.gz FJFBNEGDHWERFR-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP CCCN1CC[C@H]([NH2+][C@@H]2C[C@@H](C)[C@@H]2C)C1 ZINC000395093426 491125229 /nfs/dbraw/zinc/12/52/29/491125229.db2.gz CZTJNRPKEWMIEE-MROQNXINSA-N 2 0 210.365 2.105 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@H]1CCCc2cccnc21 ZINC000091661469 491131396 /nfs/dbraw/zinc/13/13/96/491131396.db2.gz SGDXWGQYUWCJMA-AWEZNQCLSA-N 2 0 247.386 2.390 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1Cc2ccccc21 ZINC000227077834 491138049 /nfs/dbraw/zinc/13/80/49/491138049.db2.gz RONDBQFZNZFUGK-KCQAQPDRSA-N 2 0 230.355 2.043 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@H]1CC[C@H]1C1CC1 ZINC000309323168 491146881 /nfs/dbraw/zinc/14/68/81/491146881.db2.gz FQTSLOLDAYQWLA-KBPBESRZSA-N 2 0 224.392 2.495 20 0 BEADRP CC[NH+]1CCC(C[NH2+]CC2(C)CCC2)CC1 ZINC000309774802 491156172 /nfs/dbraw/zinc/15/61/72/491156172.db2.gz PKADIRRBEAUSAZ-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP CSC[C@@H]1CCC[N@@H+]1C[C@@H]([NH3+])CC(C)C ZINC000400010305 533750412 /nfs/dbraw/zinc/75/04/12/533750412.db2.gz VLFZEFHMCMCZIZ-RYUDHWBXSA-N 2 0 230.421 2.187 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+][C@@H](C)[C@@H]1CCC[NH2+]1 ZINC000400364946 534001067 /nfs/dbraw/zinc/00/10/67/534001067.db2.gz DRRIMISLMSPQNS-DYEKYZERSA-N 2 0 236.359 2.331 20 0 BEADRP CC[C@@H](COC)[NH2+]C[C@@H](C)C[NH+]1CCCCC1 ZINC000079713138 535761008 /nfs/dbraw/zinc/76/10/08/535761008.db2.gz YLBGBELYZLKZCT-KGLIPLIRSA-N 2 0 242.407 2.123 20 0 BEADRP C[NH2+][C@H]1CCCN(c2cc[nH+]c(C)c2Cl)C1 ZINC000261571607 536415242 /nfs/dbraw/zinc/41/52/42/536415242.db2.gz HPBDPVGBUUPJAC-JTQLQIEISA-N 2 0 239.750 2.232 20 0 BEADRP CC(C)C(C)(C)C[NH2+][C@H](C)[C@@H]1CCC[NH2+]1 ZINC000400513982 527571002 /nfs/dbraw/zinc/57/10/02/527571002.db2.gz MNUDXAKILLWVHD-NEPJUHHUSA-N 2 0 212.381 2.399 20 0 BEADRP CC(C)C(C)(C)C[NH2+][C@H](C)[C@H]1CCC[NH2+]1 ZINC000400514678 527573329 /nfs/dbraw/zinc/57/33/29/527573329.db2.gz MNUDXAKILLWVHD-VXGBXAGGSA-N 2 0 212.381 2.399 20 0 BEADRP CC(C)C1(C[NH2+][C@@H](C)[C@H]2CCC[NH2+]2)CC1 ZINC000400681884 527616081 /nfs/dbraw/zinc/61/60/81/527616081.db2.gz XBOPUHJXIZSUAN-NWDGAFQWSA-N 2 0 210.365 2.153 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH+](C)C[C@@H]2C[C@H]2C)[C@@H](C)C1 ZINC000488311711 527833367 /nfs/dbraw/zinc/83/33/67/527833367.db2.gz JUGZDWNKHNVVDO-RFGFWPKPSA-N 2 0 224.392 2.305 20 0 BEADRP CCC[NH+]1CCC([N@H+](C)C[C@H]2C[C@@H]2C)CC1 ZINC000488314551 528195458 /nfs/dbraw/zinc/19/54/58/528195458.db2.gz OJEKVDUNRGUADH-QWHCGFSZSA-N 2 0 224.392 2.449 20 0 BEADRP CCSCC[C@H](C)[NH2+][C@H](C)[C@@H]1CCC[NH2+]1 ZINC000400364859 529195608 /nfs/dbraw/zinc/19/56/08/529195608.db2.gz DQFCKCXPSBTGKL-TUAOUCFPSA-N 2 0 230.421 2.248 20 0 BEADRP CC(C)O[C@H]1C[C@H]([NH2+]CCC[NH+](C)C)C1(C)C ZINC000185186631 534932333 /nfs/dbraw/zinc/93/23/33/534932333.db2.gz BZXUAGGTAATLCA-STQMWFEESA-N 2 0 242.407 2.120 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@@H]1CC[C@@H](C)C1 ZINC000164422099 535003440 /nfs/dbraw/zinc/00/34/40/535003440.db2.gz PTECQPJVAUOSNZ-CHWSQXEVSA-N 2 0 212.381 2.495 20 0 BEADRP CC(C)C[N@@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000172644675 535127544 /nfs/dbraw/zinc/12/75/44/535127544.db2.gz YTCJOWMAXCTESQ-ZDUSSCGKSA-N 2 0 210.365 2.060 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]C[C@@H]2CCCS2)CC1 ZINC000087668004 535160893 /nfs/dbraw/zinc/16/08/93/535160893.db2.gz ZAGRZPBNAUBBEU-ZDUSSCGKSA-N 2 0 242.432 2.344 20 0 BEADRP CC1(C)CCC[C@H]1[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000087647689 535308522 /nfs/dbraw/zinc/30/85/22/535308522.db2.gz HEEYBSKTDRCCHH-NWDGAFQWSA-N 2 0 210.365 2.154 20 0 BEADRP CC[NH+](CC)CCC[N@H+](C)[C@@H]1CCSC1 ZINC000179568539 535503020 /nfs/dbraw/zinc/50/30/20/535503020.db2.gz ORTWGCXFUJAFHO-GFCCVEGCSA-N 2 0 230.421 2.156 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]C1CC(OC)C1 ZINC000221253034 535519845 /nfs/dbraw/zinc/51/98/45/535519845.db2.gz ZOGUNUCGFJMPMO-IYXRBSQSSA-N 2 0 242.407 2.264 20 0 BEADRP CCOCC[N@H+](CC)CC[C@H]1CCCC[NH+]1C ZINC000351602221 535586030 /nfs/dbraw/zinc/58/60/30/535586030.db2.gz XYOIGIMTBGMTAA-CQSZACIVSA-N 2 0 242.407 2.219 20 0 BEADRP CC[NH+](CC)C[C@H]1CCCC[C@H]1[NH2+]CCOC ZINC000348309349 535594056 /nfs/dbraw/zinc/59/40/56/535594056.db2.gz FXHVBTOTABMMEX-ZIAGYGMSSA-N 2 0 242.407 2.123 20 0 BEADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@H]1CC[C@H]1CC ZINC000348069915 535597017 /nfs/dbraw/zinc/59/70/17/535597017.db2.gz HBEOIXDVRJKAGP-MCIONIFRSA-N 2 0 242.407 2.121 20 0 BEADRP CC[N@@H+]1C[C@H](C)N(c2cc[nH+]c(C)c2)C[C@H]1C ZINC000357701759 535780886 /nfs/dbraw/zinc/78/08/86/535780886.db2.gz XNDFOTDPSARFNU-OLZOCXBDSA-N 2 0 233.359 2.309 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@@H]1CCCC1(C)C ZINC000086857192 535831504 /nfs/dbraw/zinc/83/15/04/535831504.db2.gz INWBNQXSOPKSJE-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP CCc1ccccc1C[N@@H+]1CC[C@](C)(C[NH3+])C1 ZINC000261541252 535935857 /nfs/dbraw/zinc/93/58/57/535935857.db2.gz BAJWBVHNHGCULZ-OAHLLOKOSA-N 2 0 232.371 2.420 20 0 BEADRP CCc1ccccc1C[N@@H+]1CC[C@H]([NH3+])[C@@H](C)C1 ZINC000217464409 535936545 /nfs/dbraw/zinc/93/65/45/535936545.db2.gz BKOLLYXTMPGIGK-WFASDCNBSA-N 2 0 232.371 2.418 20 0 BEADRP CC[C@H](COC)[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000079713033 536121415 /nfs/dbraw/zinc/12/14/15/536121415.db2.gz QDROPGKAPAJRIU-GFCCVEGCSA-N 2 0 242.407 2.264 20 0 BEADRP CC[C@H](COC)[NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000227541086 536122092 /nfs/dbraw/zinc/12/20/92/536122092.db2.gz IWTSGAQXHPDFOA-HONMWMINSA-N 2 0 234.343 2.146 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+]C1CCC(C)(C)CC1 ZINC000234709501 536593373 /nfs/dbraw/zinc/59/33/73/536593373.db2.gz BHEBUWROPZGKHH-CYBMUJFWSA-N 2 0 242.407 2.299 20 0 BEADRP COCCCCC[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@@H]1C ZINC000222977664 536878910 /nfs/dbraw/zinc/87/89/10/536878910.db2.gz YZQSYCIJLHGKED-BFHYXJOUSA-N 2 0 242.407 2.121 20 0 BEADRP COc1ccc(C[NH2+][C@@H]2CC[NH2+]CC2(C)C)cc1 ZINC000261555687 536897305 /nfs/dbraw/zinc/89/73/05/536897305.db2.gz BQRSYFWIGZUYOR-CQSZACIVSA-N 2 0 248.370 2.173 20 0 BEADRP COc1ccccc1CC[NH2+]C1CCC([NH3+])CC1 ZINC000230287941 537038768 /nfs/dbraw/zinc/03/87/68/537038768.db2.gz BXWLFRSOLIOEGI-UHFFFAOYSA-N 2 0 248.370 2.097 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+][C@@H]1CC[C@H]1C1CC1 ZINC000854230551 588781144 /nfs/dbraw/zinc/78/11/44/588781144.db2.gz UGLFKWGYGXNSMS-YNEHKIRRSA-N 2 0 210.365 2.138 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+][C@H]1CC[C@H]1C1CC1 ZINC000854230550 588780824 /nfs/dbraw/zinc/78/08/24/588780824.db2.gz UGLFKWGYGXNSMS-XQQFMLRXSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@H]1CCC[N@H+](CC2CC[NH+](C)CC2)[C@H]1C ZINC000891860928 582730866 /nfs/dbraw/zinc/73/08/66/582730866.db2.gz DUIDBGMWSPUHQF-STQMWFEESA-N 2 0 224.392 2.449 20 0 BEADRP C[N@H+](CCCCCCC[NH3+])C[C@H]1CCCOC1 ZINC000104198776 582792858 /nfs/dbraw/zinc/79/28/58/582792858.db2.gz SIYYOOCEHGFMMO-CQSZACIVSA-N 2 0 242.407 2.254 20 0 BEADRP CCCSC[C@H](C)[NH2+]C[C@@H]1CC[N@H+](CC)C1 ZINC000892612545 582929242 /nfs/dbraw/zinc/92/92/42/582929242.db2.gz ARTMWRMCVYPGGB-STQMWFEESA-N 2 0 244.448 2.450 20 0 BEADRP Cc1occc1C[NH2+][C@H](C)C1CC[NH+](C)CC1 ZINC000396455734 583082636 /nfs/dbraw/zinc/08/26/36/583082636.db2.gz MMSKSPLAQDKHHN-LLVKDONJSA-N 2 0 236.359 2.408 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CC[C@H]1CC1(Cl)Cl ZINC000857253852 583136622 /nfs/dbraw/zinc/13/66/22/583136622.db2.gz TYHFFQVUQRVXFD-YIZRAAEISA-N 2 0 239.190 2.286 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]CC(C1CC1)C1CC1 ZINC000308995972 583162181 /nfs/dbraw/zinc/16/21/81/583162181.db2.gz JXBRNKXJIUPTMJ-JTQLQIEISA-N 2 0 210.365 2.140 20 0 BEADRP COC[C@@H]([NH2+]CCCCCC[NH3+])C1CCCC1 ZINC000843340335 583215278 /nfs/dbraw/zinc/21/52/78/583215278.db2.gz BDKHHISYUWUMPC-CQSZACIVSA-N 2 0 242.407 2.300 20 0 BEADRP CC[N@H+](C)C[C@H]1CCN(Cc2cc(C)co2)C1 ZINC000894087231 583298793 /nfs/dbraw/zinc/29/87/93/583298793.db2.gz VYUSKVWHMLLLEX-CYBMUJFWSA-N 2 0 236.359 2.362 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]CC[C@@H]1CC1(Cl)Cl ZINC000857253692 588901256 /nfs/dbraw/zinc/90/12/56/588901256.db2.gz RLGKADOSOZJDRI-HLTSFMKQSA-N 2 0 237.174 2.040 20 0 BEADRP C[C@@H](c1cccnc1)[N@H+](C)CC1CC[NH+](C)CC1 ZINC000738312923 583379471 /nfs/dbraw/zinc/37/94/71/583379471.db2.gz ZMFVFCHDKNEIEP-ZDUSSCGKSA-N 2 0 247.386 2.416 20 0 BEADRP CN1CCC[C@@H]2[C@H]1CC[N@@H+]2CC1=CCCC1 ZINC000880140664 583473035 /nfs/dbraw/zinc/47/30/35/583473035.db2.gz COALAXMJUCKGCN-ZIAGYGMSSA-N 2 0 220.360 2.265 20 0 BEADRP CC[C@@H](CSC)[N@H+](C)CC1CC[NH+](C)CC1 ZINC000894494544 583473557 /nfs/dbraw/zinc/47/35/57/583473557.db2.gz FZMRRFOMXKVYBU-ZDUSSCGKSA-N 2 0 244.448 2.402 20 0 BEADRP C[C@H](CSCCF)[NH2+]CC[C@@H](C)[NH+](C)C ZINC000895291533 583637268 /nfs/dbraw/zinc/63/72/68/583637268.db2.gz FWZOGPGAWVNBRQ-GHMZBOCLSA-N 2 0 236.400 2.007 20 0 BEADRP C[C@H](CC[NH2+]C1CC2(CCC2)C1)[NH+](C)C ZINC000895292574 583638790 /nfs/dbraw/zinc/63/87/90/583638790.db2.gz QECWLIXTGPKPHA-LLVKDONJSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@H](CC1CCOCC1)[NH2+]CC[C@H](C)[NH+](C)C ZINC000895292941 583638787 /nfs/dbraw/zinc/63/87/87/583638787.db2.gz DZDCXYDTVQNHRT-OLZOCXBDSA-N 2 0 242.407 2.121 20 0 BEADRP CC[C@@H]1C[C@H](C[NH2+]CC[C@@H](C)[NH+](C)C)CCO1 ZINC000895296941 583641371 /nfs/dbraw/zinc/64/13/71/583641371.db2.gz RDXPYHAUHHXTMB-MGPQQGTHSA-N 2 0 242.407 2.121 20 0 BEADRP COC1CCC(C[NH2+]CC[C@@H](C)[NH+](C)C)CC1 ZINC000895429783 583668969 /nfs/dbraw/zinc/66/89/69/583668969.db2.gz VAALKMJAZWINNZ-IYXRBSQSSA-N 2 0 242.407 2.121 20 0 BEADRP Cn1cccc1CN1CCC(C)([NH+]2CCC2)CC1 ZINC000895671405 583706198 /nfs/dbraw/zinc/70/61/98/583706198.db2.gz NYVFBYFSXGCVAO-UHFFFAOYSA-N 2 0 247.386 2.085 20 0 BEADRP CCc1cc(N[C@@H]2CC[N@H+](C)[C@H]2C)nc(CC)n1 ZINC000895734391 583717447 /nfs/dbraw/zinc/71/74/47/583717447.db2.gz LSONOUXOLLJVJJ-CMPLNLGQSA-N 2 0 248.374 2.106 20 0 BEADRP CCN(CC[NH3+])C[C@H]1CC[C@H](c2ccccc2)O1 ZINC000883437002 583810343 /nfs/dbraw/zinc/81/03/43/583810343.db2.gz HGAUTISPFLDPKS-HUUCEWRRSA-N 2 0 248.370 2.187 20 0 BEADRP C[C@H]1[C@@H]([NH2+]C[C@@H]2C[C@H]2c2ccccc2)CCN1C ZINC000896555601 583811840 /nfs/dbraw/zinc/81/18/40/583811840.db2.gz PGJPIEQZJSNZCZ-TUUVXOQKSA-N 2 0 244.382 2.472 20 0 BEADRP COc1ccc([C@H](C)[NH2+][C@H]2CCN(C)C2)c(C)c1 ZINC000840721725 583920725 /nfs/dbraw/zinc/92/07/25/583920725.db2.gz WFBVPVUEXIQMLW-STQMWFEESA-N 2 0 248.370 2.358 20 0 BEADRP COc1ccc([C@@H](C)[NH2+][C@H]2CCN(C)C2)c(C)c1 ZINC000840721721 583920877 /nfs/dbraw/zinc/92/08/77/583920877.db2.gz WFBVPVUEXIQMLW-OLZOCXBDSA-N 2 0 248.370 2.358 20 0 BEADRP CC[C@H]([NH2+]CCN1CCC[C@@H]1C)[C@@H]1C[C@H]1C ZINC000840725405 583934130 /nfs/dbraw/zinc/93/41/30/583934130.db2.gz AFLXCSBUCLNGSD-RQJABVFESA-N 2 0 224.392 2.495 20 0 BEADRP F[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000865697172 584026853 /nfs/dbraw/zinc/02/68/53/584026853.db2.gz UKOXHEIBSBABER-SYQHCUMBSA-N 2 0 240.366 2.484 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@@H]2C[C@H]3CCC[C@H]32)CC1 ZINC000897959817 584067672 /nfs/dbraw/zinc/06/76/72/584067672.db2.gz LTXAYJKGALINAA-MGPQQGTHSA-N 2 0 222.376 2.106 20 0 BEADRP C[NH+](C)CC(C)(C)C[N@H+](C)CCC[C@H]1CCO1 ZINC000898307181 584109613 /nfs/dbraw/zinc/10/96/13/584109613.db2.gz UTBMTSDMHZABHK-ZDUSSCGKSA-N 2 0 242.407 2.075 20 0 BEADRP C[C@@H]1C[C@H]1C[N@H+](C)CC(C)(C)C[NH+](C)C ZINC000898307722 584109786 /nfs/dbraw/zinc/10/97/86/584109786.db2.gz GHZFSZFXTLSHEB-NEPJUHHUSA-N 2 0 212.381 2.162 20 0 BEADRP C[NH+](C)CC(C)(C)C[N@H+](C)CCC[C@@H]1CCO1 ZINC000898307179 584109791 /nfs/dbraw/zinc/10/97/91/584109791.db2.gz UTBMTSDMHZABHK-CYBMUJFWSA-N 2 0 242.407 2.075 20 0 BEADRP C[C@H](C[NH3+])NCc1ccc(SC(F)F)cc1 ZINC000841059931 584126103 /nfs/dbraw/zinc/12/61/03/584126103.db2.gz MXCZUJXNQHTNKA-MRVPVSSYSA-N 2 0 246.326 2.438 20 0 BEADRP Cc1ccccc1[C@H](C)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873259093 584128790 /nfs/dbraw/zinc/12/87/90/584128790.db2.gz XTLWVVMBXRNGEJ-AVGNSLFASA-N 2 0 218.344 2.383 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]([NH2+]CC2CCC2)C1 ZINC000902321099 584552332 /nfs/dbraw/zinc/55/23/32/584552332.db2.gz ULUTUBUSDKNELB-LBPRGKRZSA-N 2 0 210.365 2.154 20 0 BEADRP CCOCCCC[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000902315406 584555499 /nfs/dbraw/zinc/55/54/99/584555499.db2.gz KZGQIJOJELLHDK-ZDUSSCGKSA-N 2 0 242.407 2.171 20 0 BEADRP CSCCCC[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000902331971 584562991 /nfs/dbraw/zinc/56/29/91/584562991.db2.gz XQUHYPTULVPWTL-GFCCVEGCSA-N 2 0 244.448 2.497 20 0 BEADRP COCCCCC[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000902333203 584563836 /nfs/dbraw/zinc/56/38/36/584563836.db2.gz HZGGSQIIWUPHPU-ZDUSSCGKSA-N 2 0 242.407 2.171 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]([NH2+]C[C@@H]2CCC=CO2)C1 ZINC000902376017 584567808 /nfs/dbraw/zinc/56/78/08/584567808.db2.gz GNCWGDSTFGSEAY-OLZOCXBDSA-N 2 0 238.375 2.047 20 0 BEADRP CS[C@H](C)C[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000902360243 584571559 /nfs/dbraw/zinc/57/15/59/584571559.db2.gz HHHRRCKDFVMDAD-GHMZBOCLSA-N 2 0 230.421 2.106 20 0 BEADRP C[C@@H]1Cc2ccccc2[C@H]1[NH2+]CC1([NH3+])CC1 ZINC000902412532 584576097 /nfs/dbraw/zinc/57/60/97/584576097.db2.gz COAZKEIRUIITQL-MFKMUULPSA-N 2 0 216.328 2.001 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+]CC1([NH3+])CC1)[C@H](C)C2 ZINC000902412518 584576216 /nfs/dbraw/zinc/57/62/16/584576216.db2.gz CGQCYNFTZQEQHF-BXUZGUMPSA-N 2 0 230.355 2.309 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]([NH2+]C[C@@H]2C[C@H]2C2CC2)C1 ZINC000902388711 584579707 /nfs/dbraw/zinc/57/97/07/584579707.db2.gz QOFBXUSZRSJUQG-MJBXVCDLSA-N 2 0 236.403 2.400 20 0 BEADRP CC(F)(F)CC[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000902389759 584581420 /nfs/dbraw/zinc/58/14/20/584581420.db2.gz XNDNXAJRJAYVDN-SNVBAGLBSA-N 2 0 234.334 2.400 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CC[NH2+]CC(C)(C)C2)CS1 ZINC000902391309 584581993 /nfs/dbraw/zinc/58/19/93/584581993.db2.gz VBJCSHVWDRJPSI-WOPDTQHZSA-N 2 0 242.432 2.248 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]([NH2+][C@H]2C=CCC2)C1 ZINC000902391568 584582097 /nfs/dbraw/zinc/58/20/97/584582097.db2.gz GYCQKXXUBCLVQA-RYUDHWBXSA-N 2 0 208.349 2.073 20 0 BEADRP C[C@H]([NH2+]CC1([NH3+])CC1)C1CCC(F)(F)CC1 ZINC000902403659 584588223 /nfs/dbraw/zinc/58/82/23/584588223.db2.gz AKOCTOVXGBSXSD-VIFPVBQESA-N 2 0 232.318 2.281 20 0 BEADRP [NH3+]C1(C[NH2+][C@H]2CCC[C@@H](c3cccnc3)C2)CC1 ZINC000902405495 584589164 /nfs/dbraw/zinc/58/91/64/584589164.db2.gz IFCZLNSRRWGIOX-OCCSQVGLSA-N 2 0 245.370 2.189 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]([NH2+]C[C@@H]2C=CCC2)C1 ZINC000902404608 584589271 /nfs/dbraw/zinc/58/92/71/584589271.db2.gz XJIOEFFVEWRTKA-CHWSQXEVSA-N 2 0 222.376 2.320 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H]2CCC[C@@H](C(F)(F)F)C2)CC1 ZINC000902405548 584589729 /nfs/dbraw/zinc/58/97/29/584589729.db2.gz ISIYHVAKYWWLDP-RKDXNWHRSA-N 2 0 236.281 2.188 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CC[C@H]1CCC(C)(C)CO1 ZINC000902428681 584594650 /nfs/dbraw/zinc/59/46/50/584594650.db2.gz GCLDVCMIOBXGLE-RWMBFGLXSA-N 2 0 242.407 2.297 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CC[C@@H]1CCC(C)(C)CO1 ZINC000902428682 584594944 /nfs/dbraw/zinc/59/49/44/584594944.db2.gz GCLDVCMIOBXGLE-XQQFMLRXSA-N 2 0 242.407 2.297 20 0 BEADRP CC(C)(C[NH2+][C@@H]1C[C@H]([NH3+])C12CCC2)C1CC1 ZINC000902432843 584595410 /nfs/dbraw/zinc/59/54/10/584595410.db2.gz QWKPDVLUYXPUGA-NWDGAFQWSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@H]([NH2+]CC(C)(C)C1CC1)[C@@H]1CCC[NH2+]1 ZINC000902430906 584595624 /nfs/dbraw/zinc/59/56/24/584595624.db2.gz JSJQPCLKMZIXFC-JQWIXIFHSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)(C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)C1CC1 ZINC000902432238 584595693 /nfs/dbraw/zinc/59/56/93/584595693.db2.gz OWJOCPDTBMGSJV-MBNYWOFBSA-N 2 0 236.403 2.400 20 0 BEADRP CC(C)(C[NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2)C1CC1 ZINC000902432845 584595836 /nfs/dbraw/zinc/59/58/36/584595836.db2.gz QWKPDVLUYXPUGA-VXGBXAGGSA-N 2 0 222.376 2.282 20 0 BEADRP CC1(C)C[NH2+]C[C@@H]1[NH2+]C1CCC(C(F)F)CC1 ZINC000902442475 584597818 /nfs/dbraw/zinc/59/78/18/584597818.db2.gz IMJQERPTWFNVJZ-ILDUYXDCSA-N 2 0 246.345 2.398 20 0 BEADRP C[C@H](CC(C)(C)C)[NH2+][C@H]1C[NH2+]CC1(C)C ZINC000902444238 584598598 /nfs/dbraw/zinc/59/85/98/584598598.db2.gz MWOZPMFXSNJPBF-MNOVXSKESA-N 2 0 212.381 2.399 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@@H]2C[NH2+]CC2(C)C)C1 ZINC000902445370 584599122 /nfs/dbraw/zinc/59/91/22/584599122.db2.gz LUPBFPQUTUNIRX-GRYCIOLGSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@H](NCC1([NH3+])CC1)c1ccc(OC)cc1 ZINC000902414816 584600118 /nfs/dbraw/zinc/60/01/18/584600118.db2.gz CWGFYNLYSMJOGU-ZDUSSCGKSA-N 2 0 234.343 2.227 20 0 BEADRP [NH3+]C1(CN[C@H]2CCCc3sccc32)CC1 ZINC000902414929 584600258 /nfs/dbraw/zinc/60/02/58/584600258.db2.gz GVNNZRUFOJTSKT-JTQLQIEISA-N 2 0 222.357 2.206 20 0 BEADRP [NH3+]C1(CN[C@H]2CCSc3ccccc32)CC1 ZINC000902414481 584600533 /nfs/dbraw/zinc/60/05/33/584600533.db2.gz BHKKEXSWPANKLE-NSHDSACASA-N 2 0 234.368 2.304 20 0 BEADRP C[C@H]1CCC[C@H]([NH2+][C@@H]2C[C@H]3CC[C@@H]2[NH2+]3)C1 ZINC000902473239 584601552 /nfs/dbraw/zinc/60/15/52/584601552.db2.gz VUOXQZRVHZKHQU-IEECTRCBSA-N 2 0 208.349 2.048 20 0 BEADRP C1C[C@@H]2[NH2+][C@H]1C[C@H]2[NH2+]C1CCCCCC1 ZINC000902473263 584601907 /nfs/dbraw/zinc/60/19/07/584601907.db2.gz WNTKOEDFAKAMCP-FRRDWIJNSA-N 2 0 208.349 2.192 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+][C@@H]2C[C@H]3CC[C@@H]2[NH2+]3)[C@H]1C ZINC000902474662 584602165 /nfs/dbraw/zinc/60/21/65/584602165.db2.gz HIBYDIQCAAKJHP-CLHCLYRXSA-N 2 0 222.376 2.294 20 0 BEADRP CC[C@@H]1CCC[C@H]([NH2+][C@@H]2C[C@H]3CC[C@@H]2[NH2+]3)C1 ZINC000902474485 584602187 /nfs/dbraw/zinc/60/21/87/584602187.db2.gz FOPVYEHJMIKGJA-XHJNMGKDSA-N 2 0 222.376 2.438 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@@H]2C[C@H]3CC[C@@H]2[NH2+]3)[C@@H]1C ZINC000902474663 584602337 /nfs/dbraw/zinc/60/23/37/584602337.db2.gz HIBYDIQCAAKJHP-IZMFDJJNSA-N 2 0 222.376 2.294 20 0 BEADRP CC[C@H]([NH2+][C@@H]1C[NH2+]CC1(C)C)[C@@H]1C[C@H]1C ZINC000902446946 584603896 /nfs/dbraw/zinc/60/38/96/584603896.db2.gz WJVNPJHHXNWRQE-WISYIIOYSA-N 2 0 210.365 2.009 20 0 BEADRP CC[C@H]([NH2+][C@@H]1C[NH2+]CC1(C)C)[C@H]1C[C@@H]1C ZINC000902446943 584604267 /nfs/dbraw/zinc/60/42/67/584604267.db2.gz WJVNPJHHXNWRQE-FIQHERPVSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+][C@H]1C[NH2+]CC1(C)C ZINC000902448170 584604689 /nfs/dbraw/zinc/60/46/89/584604689.db2.gz DGUBIMPOVBTSPN-BDAKNGLRSA-N 2 0 238.297 2.305 20 0 BEADRP CC1(C)CCC[C@@H]1[NH2+][C@@H]1C[NH2+]CC1(C)C ZINC000902448907 584605328 /nfs/dbraw/zinc/60/53/28/584605328.db2.gz JFRDRJIZSHMLHY-WDEREUQCSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)[C@@H]1CCC[C@@H]1[NH2+][C@@H]1C[NH2+]CC1(C)C ZINC000902448690 584605408 /nfs/dbraw/zinc/60/54/08/584605408.db2.gz HAOQPMKTGGHQID-RWMBFGLXSA-N 2 0 224.392 2.399 20 0 BEADRP CC1(C)CCC[C@H]1[NH2+][C@H]1C[NH2+]CC1(C)C ZINC000902448905 584605530 /nfs/dbraw/zinc/60/55/30/584605530.db2.gz JFRDRJIZSHMLHY-MNOVXSKESA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH2+][C@H]1C[NH2+]CC1(C)C)C1CCCC1 ZINC000902448732 584605552 /nfs/dbraw/zinc/60/55/52/584605552.db2.gz HZDBHCVCLKYFGL-JQWIXIFHSA-N 2 0 210.365 2.153 20 0 BEADRP C1CC2(C1)[NH2+]CC[C@H]2[NH2+][C@H]1C[C@H]2CCC[C@@H]21 ZINC000902453079 584607746 /nfs/dbraw/zinc/60/77/46/584607746.db2.gz CCZDWXCZWPQYNP-MROQNXINSA-N 2 0 220.360 2.049 20 0 BEADRP C[C@@H]1[C@H]2CC[C@@H](C[C@@H]1[NH2+][C@@H]1C[C@@H]3CCC[C@H]13)[NH2+]2 ZINC000902453026 584607947 /nfs/dbraw/zinc/60/79/47/584607947.db2.gz BPULQWQDPXJHGW-GRUOELOHSA-N 2 0 234.387 2.294 20 0 BEADRP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)S2)[C@@H]1CCC[NH2+]1 ZINC000902455699 584609783 /nfs/dbraw/zinc/60/97/83/584609783.db2.gz YIVBMHNFYYSJEE-XYTAGDGMSA-N 2 0 240.416 2.143 20 0 BEADRP C[C@H]([NH2+]CCC1CCC(F)(F)CC1)C1C[NH2+]C1 ZINC000902458461 584610896 /nfs/dbraw/zinc/61/08/96/584610896.db2.gz XQBVARSVXZFWOD-JTQLQIEISA-N 2 0 246.345 2.400 20 0 BEADRP C1CC1[C@@H]([NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2)C1CCC1 ZINC000902459603 584610998 /nfs/dbraw/zinc/61/09/98/584610998.db2.gz CXGWZVDBZQNZDB-DGAVXFQQSA-N 2 0 220.360 2.048 20 0 BEADRP C[C@H](CCC1CC1)[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902463981 584612340 /nfs/dbraw/zinc/61/23/40/584612340.db2.gz CBMOZIZNPSVKGF-GWNIPJSYSA-N 2 0 208.349 2.048 20 0 BEADRP CC(C)[C@H]1CCC[C@H]1[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902464819 584613069 /nfs/dbraw/zinc/61/30/69/584613069.db2.gz CWNZDDBPJWBSJM-RYMFRWLXSA-N 2 0 222.376 2.294 20 0 BEADRP C[C@H]1CCCC[C@@H]1[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902465467 584614002 /nfs/dbraw/zinc/61/40/02/584614002.db2.gz GFJVSAVZOJHVKI-JZRPKSSGSA-N 2 0 208.349 2.048 20 0 BEADRP C[C@@H](CC(C)(C)C)[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902465728 584614201 /nfs/dbraw/zinc/61/42/01/584614201.db2.gz IPVYOWTWWOLWAK-WHOHXGKFSA-N 2 0 210.365 2.294 20 0 BEADRP CC(C)(C)[C@H]1CC[C@H]1[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902468203 584614531 /nfs/dbraw/zinc/61/45/31/584614531.db2.gz MVJZKIJXKGQQQX-KIJLLGNVSA-N 2 0 222.376 2.294 20 0 BEADRP C1CC([C@H]2CC[C@H]2[NH2+][C@@H]2C[C@H]3CC[C@@H]2[NH2+]3)C1 ZINC000902467584 584614987 /nfs/dbraw/zinc/61/49/87/584614987.db2.gz OYORRMAFKJNXQV-XGFWRYKXSA-N 2 0 220.360 2.048 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902471315 584616323 /nfs/dbraw/zinc/61/63/23/584616323.db2.gz MVPABWCNFDHBDF-KSSYENDESA-N 2 0 208.349 2.048 20 0 BEADRP CC1(C)CCCC[C@H]1[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902471226 584616707 /nfs/dbraw/zinc/61/67/07/584616707.db2.gz KKBQYARTPWIILZ-UMSGYPCISA-N 2 0 222.376 2.438 20 0 BEADRP CC[C@@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1ccccc1 ZINC000902490058 584617229 /nfs/dbraw/zinc/61/72/29/584617229.db2.gz UZHDGSJFBZPDGD-MRVWCRGKSA-N 2 0 218.344 2.465 20 0 BEADRP C[C@@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1cccs1 ZINC000902490934 584618141 /nfs/dbraw/zinc/61/81/41/584618141.db2.gz YRSIXNTVPRHSCA-OPRDCNLKSA-N 2 0 210.346 2.136 20 0 BEADRP CC[C@@H]1CCC[C@H]([NH2+][C@H]2C[C@H](C[NH3+])C2)C1 ZINC000902491806 584618162 /nfs/dbraw/zinc/61/81/62/584618162.db2.gz ZXVIRQSKWSXMJM-FVCCEPFGSA-N 2 0 210.365 2.282 20 0 BEADRP CC1(C)CCCC[C@H]1[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902491397 584618458 /nfs/dbraw/zinc/61/84/58/584618458.db2.gz WVIVAKGAHQUNKR-IJLUTSLNSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1CC=CC[C@H]1[NH2+][C@H]1C[C@@H]([NH3+])C12CCC2 ZINC000902502454 584620907 /nfs/dbraw/zinc/62/09/07/584620907.db2.gz FUKCYTITTWXCMD-LPWJVIDDSA-N 2 0 220.360 2.201 20 0 BEADRP C[C@@H]1CC=CC[C@H]1[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000902504254 584621362 /nfs/dbraw/zinc/62/13/62/584621362.db2.gz NCQCPAVRQXKULI-UPJWGTAASA-N 2 0 220.360 2.215 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+]C[C@@H]1CCCCC[NH2+]1 ZINC000902481179 584623309 /nfs/dbraw/zinc/62/33/09/584623309.db2.gz ARFCHFJSKMKHKR-FRRDWIJNSA-N 2 0 210.365 2.297 20 0 BEADRP Cc1ncccc1CC[NH2+][C@@H]1CCCCC[C@@H]1[NH3+] ZINC000902511759 584623432 /nfs/dbraw/zinc/62/34/32/584623432.db2.gz FJUIARWQAJYKLH-LSDHHAIUSA-N 2 0 247.386 2.182 20 0 BEADRP Cc1cc([C@H](C)[NH2+][C@H]2C[C@H](C[NH3+])C2)oc1C ZINC000902484129 584624671 /nfs/dbraw/zinc/62/46/71/584624671.db2.gz DKBUFMLMRYDNLZ-DLOVCJGASA-N 2 0 222.332 2.284 20 0 BEADRP C[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1CCCCC[NH2+]1 ZINC000902485315 584624950 /nfs/dbraw/zinc/62/49/50/584624950.db2.gz ZPMAELGMXOIGLJ-FRRDWIJNSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]1CC(C)(C)C[C@H]1[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902484137 584624985 /nfs/dbraw/zinc/62/49/85/584624985.db2.gz DLEQPJVZSWNHNR-FIQHERPVSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H]1Cc2ccccc2[C@@H]1[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902485615 584625200 /nfs/dbraw/zinc/62/52/00/584625200.db2.gz BRWIANFTIPXGNU-NLRBGTRBSA-N 2 0 230.355 2.247 20 0 BEADRP C[C@@H](CCc1ccsc1)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902485516 584625206 /nfs/dbraw/zinc/62/52/06/584625206.db2.gz LNFUHTNFBCGAFN-DRZSPHRISA-N 2 0 238.400 2.396 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H]2CCCF)C1 ZINC000902485675 584625519 /nfs/dbraw/zinc/62/55/19/584625519.db2.gz MKYLGOBVUYJVRM-FDYHWXHSSA-N 2 0 228.355 2.232 20 0 BEADRP C[C@H](Cc1ccsc1)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902487121 584626021 /nfs/dbraw/zinc/62/60/21/584626021.db2.gz JUBBYPQWFALNQG-YUSALJHKSA-N 2 0 224.373 2.006 20 0 BEADRP CCC[C@@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1cccnc1 ZINC000902487796 584626643 /nfs/dbraw/zinc/62/66/43/584626643.db2.gz USEXARZAGDURMI-MRVWCRGKSA-N 2 0 233.359 2.250 20 0 BEADRP C[C@@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1ccccc1 ZINC000902488083 584626817 /nfs/dbraw/zinc/62/68/17/584626817.db2.gz JOBRYMVHMGVWOQ-NQBHXWOUSA-N 2 0 204.317 2.075 20 0 BEADRP C[C@@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1ccc2c(c1)CCO2 ZINC000902487484 584626900 /nfs/dbraw/zinc/62/69/00/584626900.db2.gz HJYUCAKSNQGVIN-JTNHKYCSSA-N 2 0 246.354 2.009 20 0 BEADRP Cc1nc(C)c([C@H](C)[NH2+][C@H]2C[C@H](C[NH3+])C2)s1 ZINC000902487721 584627032 /nfs/dbraw/zinc/62/70/32/584627032.db2.gz LVFKMSWHAALDBD-LSJOCFKGSA-N 2 0 239.388 2.148 20 0 BEADRP COc1ccccc1[C@@H](C)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902488805 584627469 /nfs/dbraw/zinc/62/74/69/584627469.db2.gz NZGULVJEMBYVHG-IJLUTSLNSA-N 2 0 234.343 2.083 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+]C1C[C@@H]2CCC[C@H]2C1 ZINC000902780761 584669732 /nfs/dbraw/zinc/66/97/32/584669732.db2.gz SAHJFJQFFRTGSL-AGIUHOORSA-N 2 0 224.392 2.495 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@@H]2C[C@H]3CCC[C@H]3C2)CC1 ZINC000902792511 584673551 /nfs/dbraw/zinc/67/35/51/584673551.db2.gz AULMJVHNIAZNTI-QDMKHBRRSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H]1C[C@@H]1C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C1CC1 ZINC000903079325 584724367 /nfs/dbraw/zinc/72/43/67/584724367.db2.gz LXSOTDNWKYVAEN-QGZQTAFBSA-N 2 0 234.387 2.390 20 0 BEADRP CO[C@@H]1CCC[C@H]1[NH2+]CCC[N@H+](C)CC(C)C ZINC000903195064 584734504 /nfs/dbraw/zinc/73/45/04/584734504.db2.gz URXUWRZKWLZSLO-ZIAGYGMSSA-N 2 0 242.407 2.121 20 0 BEADRP C[N@H+]1C[C@H]2CC[C@@H](C1)C2[NH2+][C@@H]1C[C@@H]2CCC[C@H]12 ZINC000903319499 584746053 /nfs/dbraw/zinc/74/60/53/584746053.db2.gz VAKYJBIYYMWXEY-SIOPTORSSA-N 2 0 234.387 2.105 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@@H]2CCC[C@H]12)C1CC[NH+](C)CC1 ZINC000903319210 584746247 /nfs/dbraw/zinc/74/62/47/584746247.db2.gz TZJSPUBRFBGCBO-CYUUQNCZSA-N 2 0 236.403 2.495 20 0 BEADRP CCC(CC)[N@H+](C[C@@H]1C[NH2+]C[C@H]1C)C1CC1 ZINC000903433045 584762155 /nfs/dbraw/zinc/76/21/55/584762155.db2.gz RXCGCYCSAXBLDE-NEPJUHHUSA-N 2 0 224.392 2.495 20 0 BEADRP Cc1cc([C@@H]2CCC[N@@H+]2C[C@@H]2CC[C@H]([NH3+])C2)on1 ZINC000903431487 584762179 /nfs/dbraw/zinc/76/21/79/584762179.db2.gz WIASWHHAGBVQKS-AGIUHOORSA-N 2 0 249.358 2.247 20 0 BEADRP Cc1cc([C@H]2CCC[N@@H+]2C[C@@H]2CC[C@H]([NH3+])C2)on1 ZINC000903431488 584762243 /nfs/dbraw/zinc/76/22/43/584762243.db2.gz WIASWHHAGBVQKS-FRRDWIJNSA-N 2 0 249.358 2.247 20 0 BEADRP [NH3+]C[C@H]1CCC[N@H+](Cc2ccc3cc[nH]c3c2)C1 ZINC000903421306 584763904 /nfs/dbraw/zinc/76/39/04/584763904.db2.gz LCKBGZWSUJXKSI-CYBMUJFWSA-N 2 0 243.354 2.339 20 0 BEADRP COc1ccccc1[C@@H](C)[NH2+]C[C@@H]1CC[C@H]([NH3+])C1 ZINC000903458472 584765535 /nfs/dbraw/zinc/76/55/35/584765535.db2.gz AOVSCMAKTUQSSF-UPJWGTAASA-N 2 0 248.370 2.473 20 0 BEADRP C[C@@H]1C[NH+](C[C@@H]2CC[C@H]([NH3+])C2)C[C@@H](C)C1(F)F ZINC000903464236 584767610 /nfs/dbraw/zinc/76/76/10/584767610.db2.gz FAQSXCZHLYJHLB-KKOKHZNYSA-N 2 0 246.345 2.337 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[N@H+](Cc2ccccn2)C2CC2)C1 ZINC000903454588 584773108 /nfs/dbraw/zinc/77/31/08/584773108.db2.gz DHKOCSTVJVUSOW-QWHCGFSZSA-N 2 0 245.370 2.173 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@@H+]1CCC[C@H]1c1cccnc1 ZINC000903454642 584773405 /nfs/dbraw/zinc/77/34/05/584773405.db2.gz GWOFIFIRWOCLNA-SNPRPXQTSA-N 2 0 245.370 2.074 20 0 BEADRP C(C[C@@H]1C[C@H]1C1CC1)[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000903472002 584775964 /nfs/dbraw/zinc/77/59/64/584775964.db2.gz OWAMAYUIWDXWPB-RDBSUJKOSA-N 2 0 234.387 2.297 20 0 BEADRP C([NH2+][C@H]1CC[NH2+]C12CCC2)[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000903473014 584776038 /nfs/dbraw/zinc/77/60/38/584776038.db2.gz YUHFQUMFNKVJTL-MQYQWHSLSA-N 2 0 234.387 2.297 20 0 BEADRP C1=CCC(C[NH2+][C@@H]2CC[NH2+]C23CCCC3)C1 ZINC000903481569 584777977 /nfs/dbraw/zinc/77/79/77/584777977.db2.gz GNNDMQVZEIVYNA-CYBMUJFWSA-N 2 0 220.360 2.217 20 0 BEADRP CCSCCC[NH2+][C@@H]1CC[NH2+]C12CCCC2 ZINC000903482966 584778519 /nfs/dbraw/zinc/77/85/19/584778519.db2.gz AIILNUXMTPFHDV-GFCCVEGCSA-N 2 0 242.432 2.394 20 0 BEADRP C(CC1CCC1)[NH2+][C@H]1CC[NH2+]C12CCCC2 ZINC000903482237 584778571 /nfs/dbraw/zinc/77/85/71/584778571.db2.gz ZQTQGGFKLKMGLR-ZDUSSCGKSA-N 2 0 222.376 2.441 20 0 BEADRP C([NH2+][C@@H]1CC[NH2+]C12CCCC2)C1CCC1 ZINC000903483034 584778633 /nfs/dbraw/zinc/77/86/33/584778633.db2.gz BLVYFQMTQHHSLC-GFCCVEGCSA-N 2 0 208.349 2.051 20 0 BEADRP C[C@H]1CCCC[C@H]1OCCN1CCC[C@H]([NH3+])C1 ZINC000903545547 584781833 /nfs/dbraw/zinc/78/18/33/584781833.db2.gz UEJVAOVQEDJOHQ-MELADBBJSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CCC[N@H+](CC2CC(C)C2)C1 ZINC000903716267 584794383 /nfs/dbraw/zinc/79/43/83/584794383.db2.gz LESVNSHWTXHJCB-PYNQCMFNSA-N 2 0 210.365 2.092 20 0 BEADRP CC1CC(C[NH+]2CCC([C@H]3CC[NH2+]C3)CC2)C1 ZINC000903749195 584794772 /nfs/dbraw/zinc/79/47/72/584794772.db2.gz HZNRBYCQWXVVDQ-PIMMBPRGSA-N 2 0 236.403 2.354 20 0 BEADRP CC1CC(C[N@@H+]2CCCC[C@H]2CC[NH3+])C1 ZINC000903749394 584795141 /nfs/dbraw/zinc/79/51/41/584795141.db2.gz KKSXQKRTFKOEPS-BPCQOVAHSA-N 2 0 210.365 2.236 20 0 BEADRP CC1CC(C[NH+]2CCC([C@@H]3CCC[NH2+]3)CC2)C1 ZINC000903751412 584795749 /nfs/dbraw/zinc/79/57/49/584795749.db2.gz IULGCOOCVPNAEW-PIMMBPRGSA-N 2 0 236.403 2.497 20 0 BEADRP FC1(F)C[C@]12CC[N@H+](C[C@H]1CCCC[NH2+]C1)C2 ZINC000903768792 584797770 /nfs/dbraw/zinc/79/77/70/584797770.db2.gz QVVYUOSUXMZFHI-RYUDHWBXSA-N 2 0 244.329 2.107 20 0 BEADRP CCOCC[N@@H+]1CCCC[C@H]1C1(C[NH3+])CCC1 ZINC000903812886 584803432 /nfs/dbraw/zinc/80/34/32/584803432.db2.gz ACGZUEKYPTXBDW-ZDUSSCGKSA-N 2 0 240.391 2.006 20 0 BEADRP CC(C)C[C@H](C)C[NH2+][C@H]1C[NH2+]CC1(C)C ZINC000903821465 584803968 /nfs/dbraw/zinc/80/39/68/584803968.db2.gz LEWSVDFVCSCARB-RYUDHWBXSA-N 2 0 212.381 2.256 20 0 BEADRP C[C@]12C[N@H+](C[C@H]3CCC[NH2+]C3)C[C@H]1[C@H]1C=C[C@@H]2C1 ZINC000903826531 584804973 /nfs/dbraw/zinc/80/49/73/584804973.db2.gz LICRVMQQHILQMK-ARKGTOAJSA-N 2 0 246.398 2.130 20 0 BEADRP C[C@@H]1CSCCC[N@@H+]1CC[C@H]1CCC[NH2+]C1 ZINC000903829229 584805610 /nfs/dbraw/zinc/80/56/10/584805610.db2.gz CLCZCZXQNJLULC-CHWSQXEVSA-N 2 0 242.432 2.204 20 0 BEADRP C[C@H]1CCOCC[N@@H+]1CCCCCCC[NH3+] ZINC000903832940 584806169 /nfs/dbraw/zinc/80/61/69/584806169.db2.gz TYHNCYWUCZPFPH-ZDUSSCGKSA-N 2 0 228.380 2.006 20 0 BEADRP C[C@@H]1CC=CC[C@H]1[NH2+]C[C@@H]1CCCC[NH2+]C1 ZINC000903850538 584807987 /nfs/dbraw/zinc/80/79/87/584807987.db2.gz UEVYFJRVDAXMRM-MGPQQGTHSA-N 2 0 222.376 2.320 20 0 BEADRP CCC(C)(C)[NH2+]CC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000903900124 584820703 /nfs/dbraw/zinc/82/07/03/584820703.db2.gz YYWDHSMRDDSECY-YOGCLGLASA-N 2 0 210.365 2.295 20 0 BEADRP C[C@@H]1C[N@H+](C[C@H]([NH3+])CC(F)F)[C@@H]2CCCC[C@H]21 ZINC000903903514 584821245 /nfs/dbraw/zinc/82/12/45/584821245.db2.gz UXFQUUBPMLZLGQ-WISYIIOYSA-N 2 0 246.345 2.479 20 0 BEADRP CC(C)([NH3+])CC[NH2+]C[C@@H]1CCOc2ccccc21 ZINC000903939144 584823135 /nfs/dbraw/zinc/82/31/35/584823135.db2.gz RJUDHLFYBFOCKK-LBPRGKRZSA-N 2 0 248.370 2.270 20 0 BEADRP c1ccc(CC[NH2+]CC2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000903923125 584823679 /nfs/dbraw/zinc/82/36/79/584823679.db2.gz LXVCQNFJYCZQPQ-MQVJKMGUSA-N 2 0 244.382 2.349 20 0 BEADRP [NH3+][C@H](C[NH2+]CC1CCCCC1)CC(F)F ZINC000903925911 584823901 /nfs/dbraw/zinc/82/39/01/584823901.db2.gz JAONXPOTWZYUPM-JTQLQIEISA-N 2 0 220.307 2.139 20 0 BEADRP C[N@H+](C[C@H]1CC1(C)C)CC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000903932958 584824903 /nfs/dbraw/zinc/82/49/03/584824903.db2.gz IMPZCIDVLGNXAQ-CPIKKWJDSA-N 2 0 236.403 2.495 20 0 BEADRP CC(C)([NH3+])CC[NH2+]Cc1cncc2ccccc21 ZINC000903938840 584827025 /nfs/dbraw/zinc/82/70/25/584827025.db2.gz MQNIEDHKKIFJCG-UHFFFAOYSA-N 2 0 243.354 2.452 20 0 BEADRP C[C@H]([NH3+])c1ccc(NC[C@H]([NH3+])CC(F)F)cc1 ZINC000903918167 584827031 /nfs/dbraw/zinc/82/70/31/584827031.db2.gz UDFYFTWZOUNRDZ-WCBMZHEXSA-N 2 0 243.301 2.101 20 0 BEADRP N[C@H](CC(F)F)C[N@H+](CC1CC1)CC1CCC1 ZINC000903917071 584827243 /nfs/dbraw/zinc/82/72/43/584827243.db2.gz KNAPCBYVCNCOCS-GFCCVEGCSA-N 2 0 246.345 2.481 20 0 BEADRP COc1ccccc1/C=C\C[NH2+]CCC(C)(C)[NH3+] ZINC000903938842 584827332 /nfs/dbraw/zinc/82/73/32/584827332.db2.gz MSEMOLYCNFRXFJ-VURMDHGXSA-N 2 0 248.370 2.425 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]C[C@H]1C[NH2+]CCC1(F)F ZINC000903958337 584827718 /nfs/dbraw/zinc/82/77/18/584827718.db2.gz XYIURHMQIWYAHQ-GXSJLCMTSA-N 2 0 232.318 2.009 20 0 BEADRP CC(C)(C)CC[NH2+]C[C@@H]1C[NH2+]CCC1(F)F ZINC000903957423 584827766 /nfs/dbraw/zinc/82/77/66/584827766.db2.gz QPLXSPYIRATAHF-SNVBAGLBSA-N 2 0 234.334 2.257 20 0 BEADRP CC(C)([NH3+])CC[NH2+]Cc1scnc1C1CC1 ZINC000903939839 584828791 /nfs/dbraw/zinc/82/87/91/584828791.db2.gz OGXGJYZDNXJGGF-UHFFFAOYSA-N 2 0 239.388 2.238 20 0 BEADRP CC(C)([NH3+])CC[NH2+]Cc1cccc2c1CCC2 ZINC000903939814 584829130 /nfs/dbraw/zinc/82/91/30/584829130.db2.gz NKEXBQIRKXDALC-UHFFFAOYSA-N 2 0 232.371 2.392 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+][C@H]1CCC[C@H](C)C1 ZINC000903975092 584832536 /nfs/dbraw/zinc/83/25/36/584832536.db2.gz XBRAPMLRFROLAJ-DGAVXFQQSA-N 2 0 224.392 2.400 20 0 BEADRP CCC[C@H](CC)[NH2+]CC[C@@H]1C[NH2+]C[C@H]1C ZINC000903974162 584832656 /nfs/dbraw/zinc/83/26/56/584832656.db2.gz KMZJWSDOWRJXGA-UPJWGTAASA-N 2 0 212.381 2.400 20 0 BEADRP COc1cccc(C[NH2+]CC[C@@H]2C[NH2+]C[C@H]2C)c1 ZINC000903975045 584832721 /nfs/dbraw/zinc/83/27/21/584832721.db2.gz WGZUMJUAZMDHNR-TZMCWYRMSA-N 2 0 248.370 2.030 20 0 BEADRP COc1ccccc1C[NH2+]CC[C@@H]1C[NH2+]C[C@H]1C ZINC000903974558 584832755 /nfs/dbraw/zinc/83/27/55/584832755.db2.gz QNQGKBVOULVQQK-CHWSQXEVSA-N 2 0 248.370 2.030 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1C[NH2+]C[C@H]1C)C1CCC1 ZINC000903978297 584833266 /nfs/dbraw/zinc/83/32/66/584833266.db2.gz DOKYTGJXHYZNLV-NQBHXWOUSA-N 2 0 210.365 2.010 20 0 BEADRP CC[C@@H](C)C[C@@H](CC)[NH2+][C@@H]1C[NH2+]C[C@H]1C ZINC000903963605 584833377 /nfs/dbraw/zinc/83/33/77/584833377.db2.gz BZPHTLXVGIGPLH-FDYHWXHSSA-N 2 0 212.381 2.399 20 0 BEADRP Cc1ccc(F)cc1C[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000903964565 584833826 /nfs/dbraw/zinc/83/38/26/584833826.db2.gz LHOQPYIHKGQNCR-YPMHNXCESA-N 2 0 236.334 2.079 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+]C1CCCCCCC1 ZINC000903964695 584834156 /nfs/dbraw/zinc/83/41/56/584834156.db2.gz TUHHJDUKMNMTKT-DGCLKSJQSA-N 2 0 210.365 2.297 20 0 BEADRP CC(C)[C@H]1CCC[C@H]1[NH2+][C@@H]1C[NH2+]C[C@H]1C ZINC000903965045 584834502 /nfs/dbraw/zinc/83/45/02/584834502.db2.gz YUZQWJHRJDZLIN-FDYHWXHSSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000903967016 584834523 /nfs/dbraw/zinc/83/45/23/584834523.db2.gz DDYUOHBQNJTPJI-BBBLOLIVSA-N 2 0 238.297 2.163 20 0 BEADRP C[C@H](C[NH2+]C[C@@H]1C[NH2+]C[C@H]1C)Cc1ccccc1 ZINC000903968326 584834869 /nfs/dbraw/zinc/83/48/69/584834869.db2.gz SSBCUVQVTHMBTI-SQWLQELKSA-N 2 0 246.398 2.310 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@H]1CCC[C@@H](C2CC2)C1 ZINC000903967513 584834914 /nfs/dbraw/zinc/83/49/14/584834914.db2.gz KDXYLPANKDEFSK-RZFFKMDDSA-N 2 0 236.403 2.400 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+]C[C@H]1CCCC[C@@H]1C ZINC000903967066 584834978 /nfs/dbraw/zinc/83/49/78/584834978.db2.gz GDMGLJRADQUVBC-DGAVXFQQSA-N 2 0 224.392 2.258 20 0 BEADRP CCCC[C@H](CC)[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000903968056 584835198 /nfs/dbraw/zinc/83/51/98/584835198.db2.gz QQNVUTRKLCDMFS-AGIUHOORSA-N 2 0 212.381 2.400 20 0 BEADRP CN(C[C@H]([NH3+])CCC(C)(C)C)CC(C)(C)C[NH3+] ZINC000904301561 584861333 /nfs/dbraw/zinc/86/13/33/584861333.db2.gz NTSVQXGYBDBRJK-GFCCVEGCSA-N 2 0 243.439 2.057 20 0 BEADRP CC(C)[C@@H](C)[N@H+](C[C@H]1C[C@@H]([NH3+])C1)C1CC1 ZINC000904301265 584861511 /nfs/dbraw/zinc/86/15/11/584861511.db2.gz CLIAEIGYUNQZMN-UTUOFQBUSA-N 2 0 210.365 2.233 20 0 BEADRP CCC(CC)[N@H+](C[C@H]1C[C@@H]([NH3+])C1)C1CC1 ZINC000904307092 584862343 /nfs/dbraw/zinc/86/23/43/584862343.db2.gz KUWRAQGWZULUQT-PHIMTYICSA-N 2 0 210.365 2.377 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[N@H+](C2CC2)C2CCCC2)C1 ZINC000904307780 584862411 /nfs/dbraw/zinc/86/24/11/584862411.db2.gz WHPWABYJKUVZSV-PHIMTYICSA-N 2 0 208.349 2.131 20 0 BEADRP C[N@H+](CCc1ccc(F)cc1)C[C@H]1C[C@@H]([NH3+])C1 ZINC000904311374 584862788 /nfs/dbraw/zinc/86/27/88/584862788.db2.gz AGTKHXAKRAKVSO-XBXGTLAGSA-N 2 0 236.334 2.037 20 0 BEADRP CC[N@@H+](Cc1ccc(OC)cc1)C[C@H]1C[C@@H]([NH3+])C1 ZINC000904311588 584863086 /nfs/dbraw/zinc/86/30/86/584863086.db2.gz FTNCTNYHNHPPHG-OKILXGFUSA-N 2 0 248.370 2.254 20 0 BEADRP C[C@H](C[N@H+](C)C[C@H]1C[C@@H]([NH3+])C1)c1ccccc1 ZINC000904316554 584863252 /nfs/dbraw/zinc/86/32/52/584863252.db2.gz PRKMZBGTBHSTBQ-NFAWXSAZSA-N 2 0 232.371 2.459 20 0 BEADRP CCCO[C@H]1CCC[N@H+](C[C@H]2C[C@@H]([NH3+])C2)CC1 ZINC000904320046 584863892 /nfs/dbraw/zinc/86/38/92/584863892.db2.gz BUGHFMUWJDRJHT-MJBXVCDLSA-N 2 0 240.391 2.005 20 0 BEADRP CC[C@@]1(C)CCC[N@H+](C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000904322098 584864759 /nfs/dbraw/zinc/86/47/59/584864759.db2.gz ONVCXOVRHDDGCV-XQQFMLRXSA-N 2 0 210.365 2.236 20 0 BEADRP CC[C@]1(C)CCC[N@H+](C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000904322097 584864828 /nfs/dbraw/zinc/86/48/28/584864828.db2.gz ONVCXOVRHDDGCV-FRRDWIJNSA-N 2 0 210.365 2.236 20 0 BEADRP CCS[C@@H]1CC[C@H]([N@H+](C)C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000904325958 584865578 /nfs/dbraw/zinc/86/55/78/584865578.db2.gz AAKKGWVSOXTOGV-QNWHQSFQSA-N 2 0 242.432 2.330 20 0 BEADRP CCCCC[N@H+](CCCOC)C[C@H]1C[C@@H]([NH3+])C1 ZINC000904332558 584865954 /nfs/dbraw/zinc/86/59/54/584865954.db2.gz RNAXDQSPWJTAEL-OKILXGFUSA-N 2 0 242.407 2.252 20 0 BEADRP C[C@@H]1C[N@H+](C[C@H]2C[C@@H]([NH3+])C2)[C@@H]2CCCC[C@H]21 ZINC000904330684 584865961 /nfs/dbraw/zinc/86/59/61/584865961.db2.gz AKVGUKXDOOBUCG-PEBLQZBPSA-N 2 0 222.376 2.234 20 0 BEADRP CC[C@](C)(CCO)[NH2+]C[C@H]([NH3+])CCC(C)(C)C ZINC000904329464 584866110 /nfs/dbraw/zinc/86/61/10/584866110.db2.gz NWHXJVAEHRXGJV-TZMCWYRMSA-N 2 0 244.423 2.281 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[N@@H+]2CCC[C@@H]2c2ccc(O)cc2)C1 ZINC000904335366 584866386 /nfs/dbraw/zinc/86/63/86/584866386.db2.gz CUWGBKYOZNGKNO-OSAQELSMSA-N 2 0 246.354 2.266 20 0 BEADRP C[C@H]1CC[N@H+](C[C@H]2C[C@@H]([NH3+])C2)CC12CCC2 ZINC000904345424 584868350 /nfs/dbraw/zinc/86/83/50/584868350.db2.gz DFOYSOGKAGCAIU-RWMBFGLXSA-N 2 0 222.376 2.236 20 0 BEADRP CC(C)(C)CC[C@@H]([NH3+])C[NH2+]C[C@@H]1CCCCO1 ZINC000904367921 584872917 /nfs/dbraw/zinc/87/29/17/584872917.db2.gz KEVGUPGNBSADJI-OLZOCXBDSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@H](CCCc1cccnc1)[NH2+]C1CC(C[NH3+])C1 ZINC000904371514 584873371 /nfs/dbraw/zinc/87/33/71/584873371.db2.gz PCZIPWOPBMFWNC-LRVUVFPRSA-N 2 0 247.386 2.120 20 0 BEADRP C[C@@H](CCCc1cccnc1)[NH2+]C1CC(C[NH3+])C1 ZINC000904371513 584873457 /nfs/dbraw/zinc/87/34/57/584873457.db2.gz PCZIPWOPBMFWNC-GRTSSRMGSA-N 2 0 247.386 2.120 20 0 BEADRP C[C@@]1(C[N@@H+]2CC[C@H](C3CCC3)C2)CCC[NH2+]C1 ZINC000904372695 584873659 /nfs/dbraw/zinc/87/36/59/584873659.db2.gz GRIGVQYNELRCEF-LSDHHAIUSA-N 2 0 236.403 2.498 20 0 BEADRP C[C@]1(C[N@@H+]2CC[C@H](C3CCC3)C2)CCC[NH2+]C1 ZINC000904372693 584873923 /nfs/dbraw/zinc/87/39/23/584873923.db2.gz GRIGVQYNELRCEF-GJZGRUSLSA-N 2 0 236.403 2.498 20 0 BEADRP C[C@H]([NH2+]C1CC(C[NH3+])C1)C1CCCCC1 ZINC000904374503 584874011 /nfs/dbraw/zinc/87/40/11/584874011.db2.gz SBQZGRKMPCDUCC-ZBOXLXRLSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H](C[NH2+]C[C@H]1C[C@@H]([NH3+])C1)Cc1cccs1 ZINC000904363991 584874197 /nfs/dbraw/zinc/87/41/97/584874197.db2.gz HUOOWQSJWBCGRB-SDDRHHMPSA-N 2 0 238.400 2.254 20 0 BEADRP Cc1cccc(OC[C@H](C)[NH2+]C2CC(C[NH3+])C2)c1 ZINC000904362990 584874361 /nfs/dbraw/zinc/87/43/61/584874361.db2.gz VRLYUIHYAGYHIQ-HSBZDZAISA-N 2 0 248.370 2.089 20 0 BEADRP Cc1ccccc1OCCC[NH2+]C1CC(C[NH3+])C1 ZINC000904362794 584874505 /nfs/dbraw/zinc/87/45/05/584874505.db2.gz RZPHLZZTWBLOBE-UHFFFAOYSA-N 2 0 248.370 2.091 20 0 BEADRP C[C@H](C[NH2+]C1CC(C[NH3+])C1)Cc1cccs1 ZINC000904364819 584874689 /nfs/dbraw/zinc/87/46/89/584874689.db2.gz RICWTMDBVCVQAD-UNXYVOJBSA-N 2 0 238.400 2.254 20 0 BEADRP COc1ccc([C@H](C)[NH2+]C[C@H]2C[C@@H]([NH3+])C2)cc1C ZINC000904389093 584874743 /nfs/dbraw/zinc/87/47/43/584874743.db2.gz GYRWKDMXQDZSGD-SGMGOOAPSA-N 2 0 248.370 2.392 20 0 BEADRP [NH3+]CC1CC([NH2+][C@H]2CCc3c2cccc3F)C1 ZINC000904366807 584874786 /nfs/dbraw/zinc/87/47/86/584874786.db2.gz PWFLLTSRQKWLAE-FDZGAKKTSA-N 2 0 234.318 2.140 20 0 BEADRP C[C@]1(C[N@@H+]2CC[C@]3(CC3(F)F)C2)CCC[NH2+]C1 ZINC000904376393 584875883 /nfs/dbraw/zinc/87/58/83/584875883.db2.gz QZXLEBZYUFDQND-RYUDHWBXSA-N 2 0 244.329 2.107 20 0 BEADRP C[C@]1(C[N@@H+]2CC[C@@]3(CC3(F)F)C2)CCC[NH2+]C1 ZINC000904376392 584876337 /nfs/dbraw/zinc/87/63/37/584876337.db2.gz QZXLEBZYUFDQND-NWDGAFQWSA-N 2 0 244.329 2.107 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@H]2c3ccccc3CC[C@H]2F)C1 ZINC000904386172 584877724 /nfs/dbraw/zinc/87/77/24/584877724.db2.gz RHVIEBZAIHRMPF-BQPHKTIFSA-N 2 0 248.345 2.339 20 0 BEADRP [NH3+]CC[C@H]1CC[N@H+](C[C@@H]2C[C@H]2c2ccccc2)C1 ZINC000904406508 584878407 /nfs/dbraw/zinc/87/84/07/584878407.db2.gz XMZPOFUAJMLHHK-BPUTZDHNSA-N 2 0 244.382 2.461 20 0 BEADRP COc1cc(C)c([C@H](C)NC[C@H](C)[NH3+])cc1C ZINC000817972710 584994061 /nfs/dbraw/zinc/99/40/61/584994061.db2.gz NXWABSRWXNJRSX-RYUDHWBXSA-N 2 0 236.359 2.310 20 0 BEADRP C[NH+]1CCC(CC[NH2+]Cc2ccc(O)cc2)CC1 ZINC000166314464 585013948 /nfs/dbraw/zinc/01/39/48/585013948.db2.gz SUHPTRUWPMQAIY-UHFFFAOYSA-N 2 0 248.370 2.214 20 0 BEADRP C[N@@H+]1CCC[C@H](CC[NH2+]C2CC(C(F)F)C2)C1 ZINC000839183214 585096624 /nfs/dbraw/zinc/09/66/24/585096624.db2.gz UWYCUEQGVCMOAA-VOMCLLRMSA-N 2 0 246.345 2.352 20 0 BEADRP FC(F)C1CC([NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)C1 ZINC000768675890 585541731 /nfs/dbraw/zinc/54/17/31/585541731.db2.gz WXYOZPMIVMYVHX-KPPDAEKUSA-N 2 0 244.329 2.104 20 0 BEADRP CCCC[N@@H+]1CCC[C@@H]2C[NH+](C)CC[C@@H]21 ZINC000769663939 585561391 /nfs/dbraw/zinc/56/13/91/585561391.db2.gz ZWRBHEANVHYNMM-OLZOCXBDSA-N 2 0 210.365 2.203 20 0 BEADRP C[C@@H](CCO)[NH2+]CCC[N@H+](C)C1CCCCC1 ZINC000779343868 585752126 /nfs/dbraw/zinc/75/21/26/585752126.db2.gz UOQCTLMNCILRJZ-ZDUSSCGKSA-N 2 0 242.407 2.002 20 0 BEADRP CCC[C@@H](C)[N@H+](C)CC1CC[NH+](C)CC1 ZINC000782185115 585810995 /nfs/dbraw/zinc/81/09/95/585810995.db2.gz WXJVZLFSHZAKJY-GFCCVEGCSA-N 2 0 212.381 2.449 20 0 BEADRP CN1CCC[C@@]2(CC[N@H+](C[Si](C)(C)C)C2)C1 ZINC000815146611 586670130 /nfs/dbraw/zinc/67/01/30/586670130.db2.gz SZLSANBDHOHGCY-CYBMUJFWSA-N 2 0 240.467 2.282 20 0 BEADRP CC[C@H](C)[N@@H+]1CC[C@@]2(C1)CCC[NH+](C)C2 ZINC000815145980 586670296 /nfs/dbraw/zinc/67/02/96/586670296.db2.gz JQYNLQZIKSDWAC-STQMWFEESA-N 2 0 210.365 2.203 20 0 BEADRP C[C@H]([NH3+])[C@@H]1COCC[C@H]1[NH2+]C[C@@H](C)C(C)(C)C ZINC000817893965 586834228 /nfs/dbraw/zinc/83/42/28/586834228.db2.gz JTOJKAKXRNSHFW-MROQNXINSA-N 2 0 242.407 2.011 20 0 BEADRP CS[C@@H]1CC[C@@H]([NH2+][C@@H](C)[C@H]2CCCC[NH2+]2)C1 ZINC000817897224 586834793 /nfs/dbraw/zinc/83/47/93/586834793.db2.gz HGUTYKXJBXOMLM-UMSGYPCISA-N 2 0 242.432 2.391 20 0 BEADRP CCC(CC)(C[NH2+][C@@H]1CCC[C@H]1[NH3+])SC ZINC000817898427 586835167 /nfs/dbraw/zinc/83/51/67/586835167.db2.gz FOSMBZCTZRYCNB-GHMZBOCLSA-N 2 0 230.421 2.378 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]CCNc1ccccc1 ZINC000817899541 586835797 /nfs/dbraw/zinc/83/57/97/586835797.db2.gz GQFQAMYZRFGJSP-DZGCQCFKSA-N 2 0 247.386 2.206 20 0 BEADRP CSC(C)(C)C[NH2+][C@H]1CCCCC[C@H]1[NH3+] ZINC000817900313 586836222 /nfs/dbraw/zinc/83/62/22/586836222.db2.gz ODHXNDRQGVGNSF-MNOVXSKESA-N 2 0 230.421 2.378 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)CCC[NH3+])c1ccc2c(c1)CCO2 ZINC000817901504 586836351 /nfs/dbraw/zinc/83/63/51/586836351.db2.gz WNLOHSVNSYICEM-NWDGAFQWSA-N 2 0 248.370 2.400 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]CCNc1ccccc1 ZINC000817899544 586836359 /nfs/dbraw/zinc/83/63/59/586836359.db2.gz GQFQAMYZRFGJSP-ZFWWWQNUSA-N 2 0 247.386 2.206 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H](C)c1ccc(F)cc1C ZINC000817940917 586845176 /nfs/dbraw/zinc/84/51/76/586845176.db2.gz PDNUYIFPSSTUPU-NSHDSACASA-N 2 0 224.323 2.394 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H](C)c1ccc(Cl)nc1 ZINC000817951378 586847739 /nfs/dbraw/zinc/84/77/39/586847739.db2.gz FAASWMMVTPOEON-IUCAKERBSA-N 2 0 227.739 2.123 20 0 BEADRP CC[C@@H]([NH2+]CC[C@H](C)[NH3+])c1ccc2c(c1)CCO2 ZINC000817953951 586849012 /nfs/dbraw/zinc/84/90/12/586849012.db2.gz WSAQRPXGIYPJIO-SMDDNHRTSA-N 2 0 248.370 2.400 20 0 BEADRP C[C@@H](N[C@H](C[NH3+])C1CC1)c1ccc2c(c1)CCO2 ZINC000817959104 586851263 /nfs/dbraw/zinc/85/12/63/586851263.db2.gz CGKIJAZJVNYGFR-QMTHXVAHSA-N 2 0 246.354 2.009 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000817968535 586856376 /nfs/dbraw/zinc/85/63/76/586856376.db2.gz LFYQGQWUOMNFFM-FRRDWIJNSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH3+])C[NH2+][C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000817971335 586856822 /nfs/dbraw/zinc/85/68/22/586856822.db2.gz CLSWXNOFFSFQRR-DJLDLDEBSA-N 2 0 224.270 2.044 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000817976676 586860906 /nfs/dbraw/zinc/86/09/06/586860906.db2.gz QYKXNIFRSGVSPD-XQQFMLRXSA-N 2 0 222.376 2.153 20 0 BEADRP COc1c(C)cc(C[NH2+][C@H](C)CC[NH3+])cc1C ZINC000841051315 587939819 /nfs/dbraw/zinc/93/98/19/587939819.db2.gz NNHBFEPAYQETSQ-GFCCVEGCSA-N 2 0 236.359 2.139 20 0 BEADRP [NH3+]CCC[C@H]([NH2+][C@H]1CCCOC1)c1ccccc1 ZINC000841088231 587945929 /nfs/dbraw/zinc/94/59/29/587945929.db2.gz YTFXCXRPVSUXJB-GJZGRUSLSA-N 2 0 248.370 2.235 20 0 BEADRP Cc1cccc2c1CC[N@H+](CC[C@H]1CC[NH2+]C1)C2 ZINC000842472353 588028792 /nfs/dbraw/zinc/02/87/92/588028792.db2.gz XFYHCSVUDFPNKB-CQSZACIVSA-N 2 0 244.382 2.353 20 0 BEADRP Cc1cccc2c1CC[N@H+](C[C@H]1CCC[NH2+]C1)C2 ZINC000843064550 588078627 /nfs/dbraw/zinc/07/86/27/588078627.db2.gz XDMARQWSIWMTEU-AWEZNQCLSA-N 2 0 244.382 2.353 20 0 BEADRP C[C@H](C[NH2+]C[C@@H]1CCC[NH2+]1)Cc1cccs1 ZINC000843125892 588084133 /nfs/dbraw/zinc/08/41/33/588084133.db2.gz KDTKPZXZZJUTKS-RYUDHWBXSA-N 2 0 238.400 2.268 20 0 BEADRP [NH3+]CCCCCC[NH2+]Cc1ccc(Cl)nc1 ZINC000843128474 588085047 /nfs/dbraw/zinc/08/50/47/588085047.db2.gz WEPVXZBOUCWDET-UHFFFAOYSA-N 2 0 241.766 2.344 20 0 BEADRP CC[C@@H]1C[C@@H](C[NH2+]CCCCCC[NH3+])CCO1 ZINC000843127994 588085057 /nfs/dbraw/zinc/08/50/57/588085057.db2.gz SNNPNCPPAAJNRN-UONOGXRCSA-N 2 0 242.407 2.300 20 0 BEADRP Cc1ccc(CCC[NH2+]CCCCCC[NH3+])cn1 ZINC000843128582 588085146 /nfs/dbraw/zinc/08/51/46/588085146.db2.gz KIJWPHWXNJOYFT-UHFFFAOYSA-N 2 0 249.402 2.431 20 0 BEADRP C[C@@H]([NH2+]CCCCCC[NH3+])c1ccccn1 ZINC000843342520 588101309 /nfs/dbraw/zinc/10/13/09/588101309.db2.gz RNDFWZFWZFUMKP-GFCCVEGCSA-N 2 0 221.348 2.251 20 0 BEADRP C[NH+]1CCC(CC[NH2+]C2CCCC2)CC1 ZINC000105454755 588173618 /nfs/dbraw/zinc/17/36/18/588173618.db2.gz NBXKDVACBBNYAA-UHFFFAOYSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CC[C@]1(C)C[C@@]1(F)Cl ZINC000844923581 588219042 /nfs/dbraw/zinc/21/90/42/588219042.db2.gz LMZAYSWTKXHATN-MMWGEVLESA-N 2 0 236.762 2.407 20 0 BEADRP CC(C)C[N@H+](C)CCC[NH2+][C@H]1CC[C@@H]1C ZINC000845997130 588252435 /nfs/dbraw/zinc/25/24/35/588252435.db2.gz VBDZVUWRSLLURG-STQMWFEESA-N 2 0 212.381 2.352 20 0 BEADRP [NH3+]CCCCCC[N@@H+]1CC[C@H](c2ccccn2)C1 ZINC000846220375 588261061 /nfs/dbraw/zinc/26/10/61/588261061.db2.gz HOFSEUPKUYPSEN-AWEZNQCLSA-N 2 0 247.386 2.390 20 0 BEADRP Cl/C=C/C[NH+]1CCC([C@H]2CC[NH2+]C2)CC1 ZINC000846220581 588261418 /nfs/dbraw/zinc/26/14/18/588261418.db2.gz LTUAUYCYNUXNHG-FDQQOCSASA-N 2 0 228.767 2.060 20 0 BEADRP [NH3+]CCCCCC[N@@H+]1CC[C@H](c2cccnc2)C1 ZINC000846222269 588261542 /nfs/dbraw/zinc/26/15/42/588261542.db2.gz BZSONFOJMFBLQC-HNNXBMFYSA-N 2 0 247.386 2.390 20 0 BEADRP [NH3+]CCCCCC[N@@H+]1CCC[C@@H]1c1ncc[nH]1 ZINC000846223723 588261806 /nfs/dbraw/zinc/26/18/06/588261806.db2.gz MRZVMZSIOFAEKO-GFCCVEGCSA-N 2 0 236.363 2.066 20 0 BEADRP [NH3+]CCCCCC[N@@H+]1CC[C@@H](c2cccnc2)C1 ZINC000846222270 588261838 /nfs/dbraw/zinc/26/18/38/588261838.db2.gz BZSONFOJMFBLQC-OAHLLOKOSA-N 2 0 247.386 2.390 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@@H]2C=CCC2)[C@H]2CCC[C@@H]21 ZINC000850506203 588552919 /nfs/dbraw/zinc/55/29/19/588552919.db2.gz CLCOFTAKLSGUJG-MQYQWHSLSA-N 2 0 220.360 2.167 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H]2C=CCC2)[C@@H](C)C1 ZINC000850512182 588555840 /nfs/dbraw/zinc/55/58/40/588555840.db2.gz XFVUSODSKGYYES-XQQFMLRXSA-N 2 0 208.349 2.025 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H]2C=CCC2)[C@H](C)C1 ZINC000850512181 588556039 /nfs/dbraw/zinc/55/60/39/588556039.db2.gz XFVUSODSKGYYES-UPJWGTAASA-N 2 0 208.349 2.025 20 0 BEADRP [NH3+]CCCOCC[NH2+]C1CCCCCCC1 ZINC000863484579 589293456 /nfs/dbraw/zinc/29/34/56/589293456.db2.gz JTUSDJMTGHHBHC-UHFFFAOYSA-N 2 0 228.380 2.054 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1[NH2+][C@@H]1CC[C@@H]1C(C)C ZINC000863543442 589296933 /nfs/dbraw/zinc/29/69/33/589296933.db2.gz OXWDWXLWTWXLPE-YVECIDJPSA-N 2 0 210.365 2.151 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1[NH2+][C@H]1CC[C@H]1C(C)C ZINC000863543443 589297182 /nfs/dbraw/zinc/29/71/82/589297182.db2.gz OXWDWXLWTWXLPE-ZDEQEGDKSA-N 2 0 210.365 2.151 20 0 BEADRP C[C@@H]([NH3+])CN(C)CCCc1c(F)cccc1F ZINC000863567821 589299910 /nfs/dbraw/zinc/29/99/10/589299910.db2.gz GZWFXCMKYSGPKP-SNVBAGLBSA-N 2 0 242.313 2.176 20 0 BEADRP CCc1cccc(CN(C)C[C@@H](C)[NH3+])c1 ZINC000863568509 589300336 /nfs/dbraw/zinc/30/03/36/589300336.db2.gz NDBYFEZNQYRKAU-LLVKDONJSA-N 2 0 206.333 2.028 20 0 BEADRP Cc1c[nH+]ccc1N1CC[N@@H+](C)C(C)(C)CC1 ZINC000866112886 589477248 /nfs/dbraw/zinc/47/72/48/589477248.db2.gz NEPVLOPQAHTDDV-UHFFFAOYSA-N 2 0 233.359 2.311 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@H]2C[C@H](SC)C2)[C@H](C)C1 ZINC000866486622 589496264 /nfs/dbraw/zinc/49/62/64/589496264.db2.gz MPAZCTVLTBBWCJ-LPWJVIDDSA-N 2 0 242.432 2.200 20 0 BEADRP CS[C@H]1C[C@H]([NH2+][C@H](C)C2CC[NH+](C)CC2)C1 ZINC000866487497 589497029 /nfs/dbraw/zinc/49/70/29/589497029.db2.gz ZDMMFELLJGXPPF-RAIGVLPGSA-N 2 0 242.432 2.200 20 0 BEADRP [NH3+]CC[C@@H]1CCC[N@H+](Cc2coc(C3CC3)n2)C1 ZINC000866665703 589509416 /nfs/dbraw/zinc/50/94/16/589509416.db2.gz ZLZKIEMWXZWDGC-NSHDSACASA-N 2 0 249.358 2.113 20 0 BEADRP C(CC1CC1)C[N@@H+]1CCC[C@]2(CC[NH2+]C2)C1 ZINC000866665835 589509500 /nfs/dbraw/zinc/50/95/00/589509500.db2.gz IKVXVEQVBAKNSF-CQSZACIVSA-N 2 0 222.376 2.252 20 0 BEADRP C(CC1CC1)C[NH+]1CCC2(CC[NH2+]C2)CC1 ZINC000866665208 589509824 /nfs/dbraw/zinc/50/98/24/589509824.db2.gz FDEGAYLUKXTQDO-UHFFFAOYSA-N 2 0 222.376 2.252 20 0 BEADRP CC(C)(C)[C@]1(C[NH3+])CC[N@H+](CC2CCC2)C1 ZINC000866703582 589513579 /nfs/dbraw/zinc/51/35/79/589513579.db2.gz KBROADZITSRMRS-AWEZNQCLSA-N 2 0 224.392 2.483 20 0 BEADRP CCSCC[N@@H+]1CC[C@@](C[NH3+])(C(C)(C)C)C1 ZINC000866705018 589514130 /nfs/dbraw/zinc/51/41/30/589514130.db2.gz RTWFRNDWAQDMMD-ZDUSSCGKSA-N 2 0 244.448 2.436 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CC[C@@](C[NH3+])(C(C)(C)C)C1 ZINC000866706698 589514636 /nfs/dbraw/zinc/51/46/36/589514636.db2.gz CBRCWGPTCHANEN-BZPMIXESSA-N 2 0 224.392 2.339 20 0 BEADRP CC(C)(C)[C@@]1(C[NH3+])CC[N@H+](C/C=C/Cl)C1 ZINC000866709048 589514717 /nfs/dbraw/zinc/51/47/17/589514717.db2.gz VKOVQWUPUDWHBJ-FVOPLDGLSA-N 2 0 230.783 2.436 20 0 BEADRP C[N@@H+](Cc1ccc2cc[nH]c2c1)C[C@H]1CC[NH2+]C1 ZINC000866717786 589514972 /nfs/dbraw/zinc/51/49/72/589514972.db2.gz OYRVFUYAKYPBOD-ZDUSSCGKSA-N 2 0 243.354 2.209 20 0 BEADRP CCC[NH+]1CCN(c2cc[nH+]cc2C2CC2)CC1 ZINC000872390080 589931175 /nfs/dbraw/zinc/93/11/75/589931175.db2.gz ZXSLQBMVQDGLJK-UHFFFAOYSA-N 2 0 245.370 2.491 20 0 BEADRP CC[NH+]1CCC(Nc2cc[nH+]cc2C2CC2)CC1 ZINC000872394243 589932118 /nfs/dbraw/zinc/93/21/18/589932118.db2.gz DCIWUKTZTWAJJT-UHFFFAOYSA-N 2 0 245.370 2.277 20 0 BEADRP C[C@H](CC[NH+](C)C)Nc1cc[nH+]cc1C1CC1 ZINC000872429699 589939064 /nfs/dbraw/zinc/93/90/64/589939064.db2.gz NQINWASAUMKSJQ-LLVKDONJSA-N 2 0 233.359 2.133 20 0 BEADRP C[NH+](C)[C@@H]1CCCN(c2cc[nH+]cc2C2CC2)C1 ZINC000872441057 589939849 /nfs/dbraw/zinc/93/98/49/589939849.db2.gz GYTCLELSPHVYJM-CYBMUJFWSA-N 2 0 245.370 2.489 20 0 BEADRP C[C@H](CCNc1cc[nH+]cc1C1CC1)[NH+](C)C ZINC000872596081 589955436 /nfs/dbraw/zinc/95/54/36/589955436.db2.gz BQFDJKONHDTGDT-LLVKDONJSA-N 2 0 233.359 2.133 20 0 BEADRP CCC[C@H](C)C[NH2+][C@H](C)C1CC[NH2+]CC1 ZINC000873220302 589998803 /nfs/dbraw/zinc/99/88/03/589998803.db2.gz IZISTMWYKPYASK-NWDGAFQWSA-N 2 0 212.381 2.400 20 0 BEADRP COC[C@@H](CC(C)C)[NH2+][C@H](C)C1CC[NH2+]CC1 ZINC000873220679 589998995 /nfs/dbraw/zinc/99/89/95/589998995.db2.gz RAPAOKMHEMLGJS-TZMCWYRMSA-N 2 0 242.407 2.025 20 0 BEADRP CC(C)(C)[C@]1(C[NH3+])CC[N@H+](CC2(F)CC2)C1 ZINC000873223611 590000471 /nfs/dbraw/zinc/00/04/71/590000471.db2.gz PAXHFJNCPOQFFM-LBPRGKRZSA-N 2 0 228.355 2.185 20 0 BEADRP CC(C)CCC[NH2+][C@@]12CCC[C@@H]1[NH2+]CC2 ZINC000873232100 590000878 /nfs/dbraw/zinc/00/08/78/590000878.db2.gz VPRRIYWRAVNXPP-QWHCGFSZSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]CC[C@H]1CCCS1 ZINC000873243268 590000942 /nfs/dbraw/zinc/00/09/42/590000942.db2.gz KIRLUYYXGUDBRZ-UPJWGTAASA-N 2 0 242.432 2.250 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]CC[C@H]1CCCS1 ZINC000873243267 590001240 /nfs/dbraw/zinc/00/12/40/590001240.db2.gz KIRLUYYXGUDBRZ-JHJVBQTASA-N 2 0 242.432 2.250 20 0 BEADRP C([NH2+][C@@H]1CCCCC12CC[NH2+]CC2)C1CC1 ZINC000873232871 590003543 /nfs/dbraw/zinc/00/35/43/590003543.db2.gz PCPWODUCUDQDBV-CYBMUJFWSA-N 2 0 222.376 2.298 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@@H]2CCCC23CCC3)C1 ZINC000873248445 590006798 /nfs/dbraw/zinc/00/67/98/590006798.db2.gz AJJAOZWCAKBMSZ-GRYCIOLGSA-N 2 0 208.349 2.036 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@H]([NH2+]C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000873249075 590007544 /nfs/dbraw/zinc/00/75/44/590007544.db2.gz ICHYFNYGVSPDFH-RXGFPQBGSA-N 2 0 210.365 2.138 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@@H](c2ccccc2)C2CC2)C1 ZINC000873251405 590007984 /nfs/dbraw/zinc/00/79/84/590007984.db2.gz MKLZTHIRUASVRA-GLQYFDAESA-N 2 0 230.355 2.465 20 0 BEADRP CSCC1CCC([NH2+]C[C@H]2C[C@@H]([NH3+])C2)CC1 ZINC000873250909 590008388 /nfs/dbraw/zinc/00/83/88/590008388.db2.gz RMULLHPUYZORCP-UNTZMWQOSA-N 2 0 242.432 2.235 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+]C2CCC(C(F)F)CC2)C1 ZINC000873251246 590008399 /nfs/dbraw/zinc/00/83/99/590008399.db2.gz VJJCZYXXBRKECK-NGXUNHMNSA-N 2 0 232.318 2.137 20 0 BEADRP CC1(C)CCC[C@@H]([NH2+]C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000873251671 590008551 /nfs/dbraw/zinc/00/85/51/590008551.db2.gz MXYJCLAYLPCGAG-GRYCIOLGSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H](CCCC(F)(F)F)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873252443 590008913 /nfs/dbraw/zinc/00/89/13/590008913.db2.gz RUVKFLQRAMDJSJ-BBBLOLIVSA-N 2 0 238.297 2.434 20 0 BEADRP Cc1cc([C@H](C)[NH2+]C[C@H]2C[C@@H]([NH3+])C2)c(C)o1 ZINC000873252199 590008976 /nfs/dbraw/zinc/00/89/76/590008976.db2.gz PVNFQOKHZGCGMP-ZMLRMANQSA-N 2 0 222.332 2.284 20 0 BEADRP Cc1cccc2c1CC[C@H]2[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873254595 590010235 /nfs/dbraw/zinc/01/02/35/590010235.db2.gz XUXNCCYORLUJMG-TYNCELHUSA-N 2 0 230.355 2.309 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@H]2CCCc3sccc32)C1 ZINC000873255046 590010411 /nfs/dbraw/zinc/01/04/11/590010411.db2.gz DQFGGAUPSWKVGU-UMNHJUIQSA-N 2 0 236.384 2.452 20 0 BEADRP CO[C@H](c1ccccc1)[C@H](C)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873254962 590010427 /nfs/dbraw/zinc/01/04/27/590010427.db2.gz CISVZULNZXASCX-JURCDPSOSA-N 2 0 248.370 2.090 20 0 BEADRP CC1(C)CCC[C@H]([NH2+]C[C@H]2C[C@H]([NH3+])C2)C1 ZINC000873256299 590010641 /nfs/dbraw/zinc/01/06/41/590010641.db2.gz MXYJCLAYLPCGAG-SRVKXCTJSA-N 2 0 210.365 2.282 20 0 BEADRP Cc1cccc([C@@H](C)[NH2+]C[C@H]2C[C@@H]([NH3+])C2)c1 ZINC000873255966 590010666 /nfs/dbraw/zinc/01/06/66/590010666.db2.gz LHWBYDMOIXIYJK-BZPMIXESSA-N 2 0 218.344 2.383 20 0 BEADRP Cc1cc([C@H](C)[NH2+]C[C@H]2C[C@H]([NH3+])C2)cs1 ZINC000873255363 590010681 /nfs/dbraw/zinc/01/06/81/590010681.db2.gz GXTISEWEPPEWHN-NHCYSSNCSA-N 2 0 224.373 2.444 20 0 BEADRP CCOc1cccc([C@H](C)[NH2+]C[C@H]2C[C@H]([NH3+])C2)c1 ZINC000873255406 590011145 /nfs/dbraw/zinc/01/11/45/590011145.db2.gz FZPQMXAXFBVJQM-OBJOEFQTSA-N 2 0 248.370 2.473 20 0 BEADRP Cc1cccc([C@H](C)[NH2+]C[C@H]2C[C@@H]([NH3+])C2)c1 ZINC000873256025 590011235 /nfs/dbraw/zinc/01/12/35/590011235.db2.gz LHWBYDMOIXIYJK-SGMGOOAPSA-N 2 0 218.344 2.383 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+]C[C@H]2C[C@H]([NH3+])C2)s1 ZINC000873257055 590011683 /nfs/dbraw/zinc/01/16/83/590011683.db2.gz DQULAIFTEUVYNH-GMTAPVOTSA-N 2 0 224.373 2.444 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1ccsc1 ZINC000873256609 590011717 /nfs/dbraw/zinc/01/17/17/590011717.db2.gz BCGFBOQSOXIULL-FXPVBKGRSA-N 2 0 210.346 2.136 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)C1CCCCC1 ZINC000873257030 590011777 /nfs/dbraw/zinc/01/17/77/590011777.db2.gz DBSWHSLNKVZMEC-NQBHXWOUSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1cccnc1Cl ZINC000873257079 590011905 /nfs/dbraw/zinc/01/19/05/590011905.db2.gz QOAAWZNZOZGLSL-GUBZILKMSA-N 2 0 239.750 2.123 20 0 BEADRP C[C@@H](CC1CCCC1)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873258243 590012554 /nfs/dbraw/zinc/01/25/54/590012554.db2.gz YVKPBDJNRBEJOC-DRZSPHRISA-N 2 0 210.365 2.282 20 0 BEADRP CCOc1ccc([C@H](C)[NH2+]C[C@H]2C[C@H]([NH3+])C2)cc1 ZINC000873258154 590012591 /nfs/dbraw/zinc/01/25/91/590012591.db2.gz NDNZLGADJABGOW-OBJOEFQTSA-N 2 0 248.370 2.473 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1ccc(F)cc1F ZINC000873258527 590012715 /nfs/dbraw/zinc/01/27/15/590012715.db2.gz RGQYXANCHZUFMZ-QXEWZRGKSA-N 2 0 240.297 2.353 20 0 BEADRP CC(C)[C@H]1CCC[C@H]1[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873258194 590012835 /nfs/dbraw/zinc/01/28/35/590012835.db2.gz XRBMTWWQDZWWDO-FDYHWXHSSA-N 2 0 210.365 2.138 20 0 BEADRP CC[C@@H]1CCCC[C@H]1[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873259119 590013421 /nfs/dbraw/zinc/01/34/21/590013421.db2.gz ZPZVJLJEDOIAMP-FDYHWXHSSA-N 2 0 210.365 2.282 20 0 BEADRP Cc1cc([C@H](C)[NH2+]C[C@H]2C[C@H]3CC[C@@H](C2)[NH2+]3)no1 ZINC000873260495 590013523 /nfs/dbraw/zinc/01/35/23/590013523.db2.gz BRXGQXQIWCYWLU-RVMXOQNASA-N 2 0 249.358 2.164 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@H]2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000873259661 590013587 /nfs/dbraw/zinc/01/35/87/590013587.db2.gz JDZGVEDESPXGLI-PEBLQZBPSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1cccnc1 ZINC000873262577 590014028 /nfs/dbraw/zinc/01/40/28/590014028.db2.gz AGVIHZZLVDOFFD-VIRABCJISA-N 2 0 245.370 2.263 20 0 BEADRP C([NH2+][C@@H]1CC[C@@H]1C1CC1)[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000873261804 590014157 /nfs/dbraw/zinc/01/41/57/590014157.db2.gz SBHAOQDVLQLMDJ-COWZWYNKSA-N 2 0 234.387 2.295 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccccn1 ZINC000873265769 590014906 /nfs/dbraw/zinc/01/49/06/590014906.db2.gz XOIFGIWVOJFFFT-FQUUOJAGSA-N 2 0 245.370 2.263 20 0 BEADRP C[C@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)c1cncs1 ZINC000873272878 590016628 /nfs/dbraw/zinc/01/66/28/590016628.db2.gz WWZSYIFWLUGVDU-UWVGGRQHSA-N 2 0 239.388 2.182 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC=CC[C@H]1C(F)(F)F)C1C[NH2+]C1 ZINC000873273500 590017008 /nfs/dbraw/zinc/01/70/08/590017008.db2.gz HRLPKQXOXHUPNJ-JMJZKYOTSA-N 2 0 248.292 2.081 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CCC[C@H]1C=CCC1 ZINC000873281674 590018482 /nfs/dbraw/zinc/01/84/82/590018482.db2.gz OLCVDSUGQYOGQC-XQQFMLRXSA-N 2 0 210.365 2.448 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]C1CC(Nc2ccccc2)C1 ZINC000873295322 590023768 /nfs/dbraw/zinc/02/37/68/590023768.db2.gz FRYUMYSBLRYALE-NEXFUWMNSA-N 2 0 245.370 2.099 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H](C)C(C)C ZINC000019943021 590053186 /nfs/dbraw/zinc/05/31/86/590053186.db2.gz IVCHXNXRZHUOKC-GFCCVEGCSA-N 2 0 200.370 2.352 20 0 BEADRP C[N@H+]1CC=C(C[NH2+]C[C@@H]2CC2(Cl)Cl)CC1 ZINC000877137899 590290980 /nfs/dbraw/zinc/29/09/80/590290980.db2.gz FAZDRPBFTNJRFR-JTQLQIEISA-N 2 0 249.185 2.032 20 0 BEADRP COC[C@H]([NH2+]C[C@H](C)N1CCCCC1)C(C)C ZINC000126431921 590302882 /nfs/dbraw/zinc/30/28/82/590302882.db2.gz PPRYLSSIVSSJQW-KBPBESRZSA-N 2 0 242.407 2.121 20 0 BEADRP CSC(C)(C)CC[N@H+]1C[C@H]2C[NH+](C)C[C@H]2C1 ZINC000877483044 590337943 /nfs/dbraw/zinc/33/79/43/590337943.db2.gz JBVXGYDNXJVBIR-TXEJJXNPSA-N 2 0 242.432 2.012 20 0 BEADRP CSC(C)(C)CC[N@H+](C)CCC[NH+](C)C ZINC000877522644 590346410 /nfs/dbraw/zinc/34/64/10/590346410.db2.gz QKVGNHVEKBWSNG-UHFFFAOYSA-N 2 0 232.437 2.402 20 0 BEADRP CC[C@H](C)C[N@@H+]1CC[C@H]2[C@H](CC[NH+]2C)C1 ZINC000877742959 590407864 /nfs/dbraw/zinc/40/78/64/590407864.db2.gz SHYKWBFDSJOVBK-XQQFMLRXSA-N 2 0 210.365 2.059 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C2(C)CC(F)(F)C2)CCN1C ZINC000877834365 590430246 /nfs/dbraw/zinc/43/02/46/590430246.db2.gz QFZMQZLXCZYPHG-ZJUUUORDSA-N 2 0 232.318 2.247 20 0 BEADRP CC(C)(C)SCCC[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC000877982208 590465043 /nfs/dbraw/zinc/46/50/43/590465043.db2.gz KXZJWXLMNAOGNJ-TXEJJXNPSA-N 2 0 242.432 2.059 20 0 BEADRP Cc1ccc(CN2CC[C@H]3[C@@H]2CCC[N@H+]3C)nc1 ZINC000880138548 590939189 /nfs/dbraw/zinc/93/91/89/590939189.db2.gz YJCCXXNXWBVLRS-GJZGRUSLSA-N 2 0 245.370 2.059 20 0 BEADRP C[C@@H]1C[C@H]1C[N@@H+]1CCN(c2cc[nH+]cc2)[C@@H](C)C1 ZINC000880259552 590980432 /nfs/dbraw/zinc/98/04/32/590980432.db2.gz WAPLJJHDWAPPTG-RDBSUJKOSA-N 2 0 245.370 2.248 20 0 BEADRP C[C@@H]1C[C@H]1C[NH+]1CCC(C)([NH+]2CCC2)CC1 ZINC000880476117 591054282 /nfs/dbraw/zinc/05/42/82/591054282.db2.gz NTMHJIDGNQOVOG-OLZOCXBDSA-N 2 0 222.376 2.203 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H]2C[C@@H]3CC[C@@H](C3)C2)C1 ZINC000883162536 591556771 /nfs/dbraw/zinc/55/67/71/591556771.db2.gz WESQCVWEKYBHFA-CUZDEVPKSA-N 2 0 236.403 2.495 20 0 BEADRP C1=C[C@@H](C[NH2+]C2CC[NH+](CC3CC3)CC2)CC1 ZINC000883246400 591587310 /nfs/dbraw/zinc/58/73/10/591587310.db2.gz HWZLPCBQTOZRQS-CYBMUJFWSA-N 2 0 234.387 2.417 20 0 BEADRP C[N@H+](CC[C@@H]1CCCC1(F)F)C1CC[NH2+]CC1 ZINC000883416133 591652700 /nfs/dbraw/zinc/65/27/00/591652700.db2.gz MMEKMQOXZAHTHW-NSHDSACASA-N 2 0 246.345 2.496 20 0 BEADRP C[NH2+]C[C@@H]1CCCN1CC[C@H]1CCCC1(F)F ZINC000883418132 591654336 /nfs/dbraw/zinc/65/43/36/591654336.db2.gz YOLZRQINHATEOF-NEPJUHHUSA-N 2 0 246.345 2.496 20 0 BEADRP C[C@]1(C[NH3+])CC[N@H+](CC[C@@H]2CCCC2(F)F)C1 ZINC000883428199 591660159 /nfs/dbraw/zinc/66/01/59/591660159.db2.gz NXIVYRLGDRRYBW-NWDGAFQWSA-N 2 0 246.345 2.483 20 0 BEADRP C[C@@]1(C[NH3+])CC[N@H+](CC[C@H]2CCCC2(F)F)C1 ZINC000883428198 591660393 /nfs/dbraw/zinc/66/03/93/591660393.db2.gz NXIVYRLGDRRYBW-NEPJUHHUSA-N 2 0 246.345 2.483 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+]CC2CCOCC2)c2ccccc21 ZINC000132112450 591687126 /nfs/dbraw/zinc/68/71/26/591687126.db2.gz VHXCYVVKDQKBIP-LSDHHAIUSA-N 2 0 246.354 2.147 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]CC2CCOCC2)c2ccccc21 ZINC000132112239 591688075 /nfs/dbraw/zinc/68/80/75/591688075.db2.gz VHXCYVVKDQKBIP-HUUCEWRRSA-N 2 0 246.354 2.147 20 0 BEADRP CC1(C)C[N@H+](CCCCCC[NH3+])CCS1 ZINC000133330382 591788108 /nfs/dbraw/zinc/78/81/08/591788108.db2.gz QOVPWCRVIQNIDU-UHFFFAOYSA-N 2 0 230.421 2.333 20 0 BEADRP COCC[NH2+]C1CCC(C)([NH+]2CCCC2)CC1 ZINC000886489385 592236011 /nfs/dbraw/zinc/23/60/11/592236011.db2.gz HLONQLIFWYLSRK-UHFFFAOYSA-N 2 0 240.391 2.020 20 0 BEADRP Cc1ccc(F)c(C[NH2+]C2CCC([NH3+])CC2)c1 ZINC000220818929 592356762 /nfs/dbraw/zinc/35/67/62/592356762.db2.gz UUKCLCXMPDZDDT-UHFFFAOYSA-N 2 0 236.334 2.494 20 0 BEADRP [NH3+]CCCCCC[N@@H+]1CC[C@H]([C@@H]2CCCO2)C1 ZINC000886860270 592369111 /nfs/dbraw/zinc/36/91/11/592369111.db2.gz YGXJYBMBYVNFSB-KBPBESRZSA-N 2 0 240.391 2.006 20 0 BEADRP CC[C@H](C)[N@@H+]1CCN(c2cc[nH+]cc2)C[C@H]1C ZINC000887134913 592448336 /nfs/dbraw/zinc/44/83/36/592448336.db2.gz SGHDYNFTKFLCNZ-QWHCGFSZSA-N 2 0 233.359 2.391 20 0 BEADRP CC(C)C[N@@H+]1CCN(c2cc[nH+]cc2)C[C@H]1C ZINC000887131288 592449939 /nfs/dbraw/zinc/44/99/39/592449939.db2.gz VABXDWYBWOIKDP-CYBMUJFWSA-N 2 0 233.359 2.248 20 0 BEADRP C[C@H](CC[N@H+](C)CCCF)[NH+](C)CCCF ZINC000887141238 592457535 /nfs/dbraw/zinc/45/75/35/592457535.db2.gz KPEFKSZOVLJPDL-GFCCVEGCSA-N 2 0 236.350 2.348 20 0 BEADRP CC(C)C[C@H](O)C[NH2+][C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000300275498 592505953 /nfs/dbraw/zinc/50/59/53/592505953.db2.gz PDQFXLZQKGGREX-CQDKDKBSSA-N 2 0 248.370 2.128 20 0 BEADRP C[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)c1ccns1 ZINC000925703798 634380071 /nfs/dbraw/zinc/38/00/71/634380071.db2.gz DSZBFTMJXNKSAI-SNVBAGLBSA-N 2 0 237.372 2.056 20 0 BEADRP C[C@@H](C[NH2+][C@@H]1CC[NH2+]C12CCC2)CC(F)F ZINC000925707237 634393893 /nfs/dbraw/zinc/39/38/93/634393893.db2.gz DPHFRXGCKSDVOH-NXEZZACHSA-N 2 0 232.318 2.152 20 0 BEADRP C[N@H+]1CC=C(C[NH2+][C@H]2C[C@H]3C=C[C@@H]2CC3)CC1 ZINC000925711796 634413345 /nfs/dbraw/zinc/41/33/45/634413345.db2.gz RQRPHOCXYOZPLT-CFVMTHIKSA-N 2 0 232.371 2.193 20 0 BEADRP C[C@@H]1SCC[C@H]1[NH2+][C@H]1CC[NH2+]C12CCCC2 ZINC000925713804 634416673 /nfs/dbraw/zinc/41/66/73/634416673.db2.gz UJHQXTAQSAFNOM-TUAOUCFPSA-N 2 0 240.416 2.145 20 0 BEADRP C[C@@H]1SCC[C@H]1[NH2+][C@@H]1CC[NH2+]C12CCCC2 ZINC000925713801 634417439 /nfs/dbraw/zinc/41/74/39/634417439.db2.gz UJHQXTAQSAFNOM-QJPTWQEYSA-N 2 0 240.416 2.145 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+]C[C@H]1CCCC12CC2 ZINC000925716642 634446470 /nfs/dbraw/zinc/44/64/70/634446470.db2.gz BICNLMBUZYBVRP-VXGBXAGGSA-N 2 0 222.376 2.297 20 0 BEADRP CC1(C[N@@H+]2CC[C@]3(C2)CCC[NH2+]C3)CCC1 ZINC000334350287 634456097 /nfs/dbraw/zinc/45/60/97/634456097.db2.gz FCQFLDHFXYBBSD-CQSZACIVSA-N 2 0 222.376 2.252 20 0 BEADRP CC1CC(C[NH2+][C@H]2CC[NH2+]C23CCCC3)C1 ZINC000925720706 634459255 /nfs/dbraw/zinc/45/92/55/634459255.db2.gz HRHSSTQXGMIFOK-BPCQOVAHSA-N 2 0 222.376 2.297 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+][C@@H]1CCCC[C@@H]1F ZINC000925726781 634523351 /nfs/dbraw/zinc/52/33/51/634523351.db2.gz VYHSXAWWVXPUGX-UXAWBVGHSA-N 2 0 240.366 2.373 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@@H]([NH3+])CC(C)(C)C2)[C@H](C)O1 ZINC000925726486 634523393 /nfs/dbraw/zinc/52/33/93/634523393.db2.gz SZJVYZKTPOZZNF-MLGHIDQZSA-N 2 0 240.391 2.048 20 0 BEADRP CCc1ccc(C[N@@H+]2CC[C@@H](CC[NH3+])C2)cc1 ZINC000125545690 634539191 /nfs/dbraw/zinc/53/91/91/634539191.db2.gz NEPNKNBNGJSGHB-OAHLLOKOSA-N 2 0 232.371 2.420 20 0 BEADRP Cc1ccc(C)c(C[N@@H+]2CC[C@H](CC[NH3+])C2)c1 ZINC000125556473 634547607 /nfs/dbraw/zinc/54/76/07/634547607.db2.gz MQZSIDKDDGFMJU-AWEZNQCLSA-N 2 0 232.371 2.474 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]C[C@@H]1C=CCC1 ZINC000925731721 634569070 /nfs/dbraw/zinc/56/90/70/634569070.db2.gz MQAWBONWGRTIQX-WCQYABFASA-N 2 0 245.370 2.466 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]C[C@@H]1C=CCC1 ZINC000925731720 634569696 /nfs/dbraw/zinc/56/96/96/634569696.db2.gz MQAWBONWGRTIQX-DGCLKSJQSA-N 2 0 245.370 2.466 20 0 BEADRP C(CCC1CC1)C[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000925735681 634587347 /nfs/dbraw/zinc/58/73/47/634587347.db2.gz WLMQHIQHSHQUQM-ZDUSSCGKSA-N 2 0 222.376 2.441 20 0 BEADRP CC(C)([NH3+])CC[NH2+][C@@H]1CCCc2c(O)cccc21 ZINC000925736477 634589990 /nfs/dbraw/zinc/58/99/90/634589990.db2.gz AEJIMIRKCOSBBC-CYBMUJFWSA-N 2 0 248.370 2.487 20 0 BEADRP Cc1cc(C[NH2+]CCC(C)(C)[NH3+])ccc1F ZINC000258896180 635222430 /nfs/dbraw/zinc/22/24/30/635222430.db2.gz LVBJMSKMZHCJSP-UHFFFAOYSA-N 2 0 224.323 2.351 20 0 BEADRP Cc1ncc([C@@H](C)[NH2+]CCC(C)(C)[NH3+])s1 ZINC000925740050 634602083 /nfs/dbraw/zinc/60/20/83/634602083.db2.gz GPWHBRIBZQIECL-MRVPVSSYSA-N 2 0 227.377 2.230 20 0 BEADRP C[C@H]([NH2+]CCC(C)(C)[NH3+])c1ccc2c(c1)CCO2 ZINC000925741853 634602931 /nfs/dbraw/zinc/60/29/31/634602931.db2.gz UXNHEYVZPHRJNK-NSHDSACASA-N 2 0 248.370 2.400 20 0 BEADRP C[C@@H]1C[C@H]1[C@@H]1C[C@H]1[NH2+][C@H]1C[C@@H]2CC[C@@H]([NH2+]2)[C@H]1C ZINC000925822895 635403607 /nfs/dbraw/zinc/40/36/07/635403607.db2.gz LUKMXXYBDBDRPY-YOBRWUOSSA-N 2 0 234.387 2.150 20 0 BEADRP C[C@@H]1C[C@H]1[C@@H]1C[C@H]1[NH2+][C@@H]1C[C@@H]2CC[C@@H]([NH2+]2)[C@H]1C ZINC000925822883 635405083 /nfs/dbraw/zinc/40/50/83/635405083.db2.gz LUKMXXYBDBDRPY-DEQRYCOSSA-N 2 0 234.387 2.150 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@H]2CC[NH2+]C23CCC3)CCS1 ZINC000925857695 635549264 /nfs/dbraw/zinc/54/92/64/635549264.db2.gz HWDBZXXVPOCKLH-WOPDTQHZSA-N 2 0 240.416 2.145 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCC[C@H]2C[NH3+])CCS1 ZINC000925860948 635556253 /nfs/dbraw/zinc/55/62/53/635556253.db2.gz MLFDHHIIDPJSML-YVECIDJPSA-N 2 0 242.432 2.378 20 0 BEADRP CC[C@H]([NH2+][C@H]1CCS[C@@H](C)C1)[C@@H]1CCC[NH2+]1 ZINC000925860899 635556296 /nfs/dbraw/zinc/55/62/96/635556296.db2.gz LWFLKOXAVNMZJQ-CYDGBPFRSA-N 2 0 242.432 2.391 20 0 BEADRP COC(C)(C)CC[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000234590283 635556470 /nfs/dbraw/zinc/55/64/70/635556470.db2.gz NKORCHOTTFSQIF-UHFFFAOYSA-N 2 0 242.407 2.264 20 0 BEADRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+][C@H]1CCCc2cccnc21 ZINC000925871912 635588215 /nfs/dbraw/zinc/58/82/15/635588215.db2.gz LMXSPVZPTHISJL-RDBSUJKOSA-N 2 0 245.370 2.176 20 0 BEADRP Cc1ncc([C@H](C)[NH2+]C2CCN(C)CC2)s1 ZINC000090400658 631291263 /nfs/dbraw/zinc/29/12/63/631291263.db2.gz CMYZUQIXHGQVCA-VIFPVBQESA-N 2 0 239.388 2.196 20 0 BEADRP C[N@H+](CCC[NH2+]C1CC1)CCc1cccs1 ZINC000086441587 631469940 /nfs/dbraw/zinc/46/99/40/631469940.db2.gz NIVLVUKLMVIZGE-UHFFFAOYSA-N 2 0 238.400 2.365 20 0 BEADRP CO[C@H](C)C[NH2+]C1CC[NH+](CCC(C)C)CC1 ZINC000926247758 631501755 /nfs/dbraw/zinc/50/17/55/631501755.db2.gz WXZYWQJNOWCSMD-CYBMUJFWSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H]1CC[C@H]1[NH2+]CCC[NH+]1CCCCC1 ZINC000308838040 631678440 /nfs/dbraw/zinc/67/84/40/631678440.db2.gz XAHFEMKBBRJPHU-QWHCGFSZSA-N 2 0 210.365 2.251 20 0 BEADRP CC(C)([NH3+])CC[NH2+]Cc1cccc(F)c1 ZINC000259004435 631717591 /nfs/dbraw/zinc/71/75/91/631717591.db2.gz XASASPXESWVQPI-UHFFFAOYSA-N 2 0 210.296 2.043 20 0 BEADRP C[C@@H](Cc1cccs1)[NH2+]CCC(C)(C)[NH3+] ZINC000308969382 631774604 /nfs/dbraw/zinc/77/46/04/631774604.db2.gz OKALMWJVOPSTMR-JTQLQIEISA-N 2 0 226.389 2.396 20 0 BEADRP C[C@@H]1CSCCC[N@@H+]1CC[C@@H]1CCC[NH+]1C ZINC000934303795 631772588 /nfs/dbraw/zinc/77/25/88/631772588.db2.gz MGBJBYKEYXTDQY-OLZOCXBDSA-N 2 0 242.432 2.298 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CCSC(F)(F)F ZINC000309006758 631799581 /nfs/dbraw/zinc/79/95/81/631799581.db2.gz NLPGJLMMTCDZIM-MRVPVSSYSA-N 2 0 244.326 2.347 20 0 BEADRP [NH3+]C1CCC([NH2+]Cc2c(F)cccc2F)CC1 ZINC000051692873 631869782 /nfs/dbraw/zinc/86/97/82/631869782.db2.gz BDXRLGKNUPTVTC-UHFFFAOYSA-N 2 0 240.297 2.324 20 0 BEADRP C[C@@H](CC(F)(F)F)[NH2+][C@H]1CCC[NH2+]CC1 ZINC000235091826 631943031 /nfs/dbraw/zinc/94/30/31/631943031.db2.gz RUNFIZUEJZDYRL-IUCAKERBSA-N 2 0 224.270 2.059 20 0 BEADRP CC[C@H]1CCC[N@H+](CC[C@@H]2CCC[NH2+]C2)C1 ZINC000051919037 632012844 /nfs/dbraw/zinc/01/28/44/632012844.db2.gz XKEBKRCVTQBFQV-KBPBESRZSA-N 2 0 224.392 2.498 20 0 BEADRP CC[N@H+](CCCC1CC[NH2+]CC1)C(C)C ZINC000050952539 632120570 /nfs/dbraw/zinc/12/05/70/632120570.db2.gz NTEACTMOKPJKMI-UHFFFAOYSA-N 2 0 212.381 2.497 20 0 BEADRP CS[C@@H]1CC[C@H]([NH2+][C@@H]2CCC[C@@H]([NH3+])C2)C1 ZINC000235165554 632391052 /nfs/dbraw/zinc/39/10/52/632391052.db2.gz WBUCLRYCJBAAIB-WISYIIOYSA-N 2 0 228.405 2.130 20 0 BEADRP CS[C@@H]1CCC[C@@H]([NH2+]C2CC[NH2+]CC2)C1 ZINC000235161146 632390964 /nfs/dbraw/zinc/39/09/64/632390964.db2.gz WYYOEWLPOHLWOH-VXGBXAGGSA-N 2 0 228.405 2.002 20 0 BEADRP C[C@H]1CCC[N@H+](C[C@@]2(C)CCC[NH2+]C2)C1 ZINC000219749481 632561410 /nfs/dbraw/zinc/56/14/10/632561410.db2.gz OZCISRRGALPMJP-STQMWFEESA-N 2 0 210.365 2.108 20 0 BEADRP C[C@H]1CC[C@@H]1[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000309659484 632623942 /nfs/dbraw/zinc/62/39/42/632623942.db2.gz AOOMPMSHUJRNGS-FZMZJTMJSA-N 2 0 222.376 2.391 20 0 BEADRP CCC[N@H+](C)C[C@@H]1CCN(C/C=C/Cl)C1 ZINC000177035073 632692886 /nfs/dbraw/zinc/69/28/86/632692886.db2.gz FBKJTFZLKWFPJU-FUEXJSSKSA-N 2 0 230.783 2.403 20 0 BEADRP C1=CC[C@@H]2C[N@@H+](CC[C@H]3CCC[NH2+]C3)C[C@@H]2C1 ZINC000310348865 632725761 /nfs/dbraw/zinc/72/57/61/632725761.db2.gz QBDZTZSXLKXYKQ-KFWWJZLASA-N 2 0 234.387 2.274 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+]C1Cc2ccccc2C1 ZINC000236200514 632896311 /nfs/dbraw/zinc/89/63/11/632896311.db2.gz QJJCELYJVZYYEX-ZBFHGGJFSA-N 2 0 244.382 2.261 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]C1Cc2ccccc2C1 ZINC000236260614 632903883 /nfs/dbraw/zinc/90/38/83/632903883.db2.gz QJJCELYJVZYYEX-HOCLYGCPSA-N 2 0 244.382 2.261 20 0 BEADRP C[C@H]1CC[C@H]1[NH2+]CCC[NH+]1CCC(C)CC1 ZINC000309300974 632911556 /nfs/dbraw/zinc/91/15/56/632911556.db2.gz LZMSBCKYXHHEJL-UONOGXRCSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2CCC[C@@H](C3CC3)C2)CC1 ZINC000894520883 635904047 /nfs/dbraw/zinc/90/40/47/635904047.db2.gz HKAXXSFFFJQZJE-OAHLLOKOSA-N 2 0 236.403 2.450 20 0 BEADRP COc1ccccc1[C@@H](C)[NH2+]CCC(C)(C)[NH3+] ZINC000310131879 636005784 /nfs/dbraw/zinc/00/57/84/636005784.db2.gz HTUXNRKJOMGJMV-LLVKDONJSA-N 2 0 236.359 2.473 20 0 BEADRP CC(C)C1(C[NH2+][C@H]2CCC[C@@H]2C[NH3+])CC1 ZINC000232727864 636029277 /nfs/dbraw/zinc/02/92/77/636029277.db2.gz COTHKTSTCQJBRA-NEPJUHHUSA-N 2 0 210.365 2.140 20 0 BEADRP CCC(CC)C[NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23 ZINC000328471682 633768223 /nfs/dbraw/zinc/76/82/23/633768223.db2.gz ADXJWOYQMHSVQI-MEBFFEOJSA-N 2 0 222.376 2.009 20 0 BEADRP CC(C)CCC[NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23 ZINC000328566137 633775672 /nfs/dbraw/zinc/77/56/72/633775672.db2.gz MKRDYSDXSVNZJJ-MEBFFEOJSA-N 2 0 222.376 2.009 20 0 BEADRP CC(C)C1(C[NH2+][C@@H]2[C@H]3C[C@H]4C[NH2+][C@H]2[C@H]4C3)CC1 ZINC000328566539 633777163 /nfs/dbraw/zinc/77/71/63/633777163.db2.gz MVMWBBCQEKNTNF-YHQUGGNUSA-N 2 0 234.387 2.009 20 0 BEADRP CC1(C[NH2+][C@H]2[C@@H]3[NH2+]C[C@@H]4C[C@H]2C[C@@H]43)CCCC1 ZINC000328573048 633779689 /nfs/dbraw/zinc/77/96/89/633779689.db2.gz VJNJXWIRCXEVJZ-QSLWVIQJSA-N 2 0 234.387 2.153 20 0 BEADRP CSC[C@@H](C)[NH2+][C@@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C ZINC000925502362 633826213 /nfs/dbraw/zinc/82/62/13/633826213.db2.gz GVEBZRFFQQYYCC-WISYIIOYSA-N 2 0 242.432 2.104 20 0 BEADRP CS[C@@H]1CC[C@H]([NH2+][C@H]2CC[NH2+]C2(C)C)C1 ZINC000925523668 633896085 /nfs/dbraw/zinc/89/60/85/633896085.db2.gz NKYHCQJTJBZKJJ-AXFHLTTASA-N 2 0 228.405 2.001 20 0 BEADRP CO[C@H](C[NH2+][C@@H]1C[C@@H]([NH3+])CC(C)(C)C1)C(C)C ZINC000925526378 633909320 /nfs/dbraw/zinc/90/93/20/633909320.db2.gz IGQVDJHGWLAEMQ-JHJVBQTASA-N 2 0 242.407 2.153 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2C[C@@H]([NH3+])CC(C)(C)C2)cn1 ZINC000925563191 634048029 /nfs/dbraw/zinc/04/80/29/634048029.db2.gz SKYBFKMYKVEGMV-ZIAGYGMSSA-N 2 0 247.386 2.386 20 0 BEADRP CC1CC([NH2+][C@@H]2C[C@@H]([NH3+])CC(C)(C)C2)C1 ZINC000925575494 634072424 /nfs/dbraw/zinc/07/24/24/634072424.db2.gz HBQUFJYWZXWWSC-RUJICJSRSA-N 2 0 210.365 2.281 20 0 BEADRP CC1CC([NH2+][C@H]2C[C@@H]([NH3+])CC(C)(C)C2)C1 ZINC000925575492 634073079 /nfs/dbraw/zinc/07/30/79/634073079.db2.gz HBQUFJYWZXWWSC-RSJDFQLWSA-N 2 0 210.365 2.281 20 0 BEADRP CC1CC([NH2+][C@H]2C[C@H]([NH3+])CC(C)(C)C2)C1 ZINC000925575488 634073489 /nfs/dbraw/zinc/07/34/89/634073489.db2.gz HBQUFJYWZXWWSC-ADPBJBESSA-N 2 0 210.365 2.281 20 0 BEADRP C[C@H]([NH2+][C@H]1C[C@@H]([NH3+])CC(C)(C)C1)C1CC1 ZINC000925586321 634091139 /nfs/dbraw/zinc/09/11/39/634091139.db2.gz CGQORXPWNNTIAZ-WCQGTBRESA-N 2 0 210.365 2.281 20 0 BEADRP C1=CC[C@@H]2C[N@@H+](CC[C@@H]3CCC[NH2+]C3)C[C@@H]2C1 ZINC000310348868 634129103 /nfs/dbraw/zinc/12/91/03/634129103.db2.gz QBDZTZSXLKXYKQ-SOUVJXGZSA-N 2 0 234.387 2.274 20 0 BEADRP CCC[C@@H]1C[C@H]1[NH2+][C@H]1C[C@@H]([NH3+])C12CCC2 ZINC000925603954 634133152 /nfs/dbraw/zinc/13/31/52/634133152.db2.gz GSEQXEHJIIULQA-KKOKHZNYSA-N 2 0 208.349 2.035 20 0 BEADRP CC1(C)C[C@@H]([NH2+]C[C@H]2CCC=CO2)C[C@@H]([NH3+])C1 ZINC000925642354 634190847 /nfs/dbraw/zinc/19/08/47/634190847.db2.gz GGFVHXQURZHRPJ-FRRDWIJNSA-N 2 0 238.375 2.175 20 0 BEADRP CC1(C)C[C@@H]([NH2+]C[C@@H]2CCC=CO2)C[C@@H]([NH3+])C1 ZINC000925642353 634191303 /nfs/dbraw/zinc/19/13/03/634191303.db2.gz GGFVHXQURZHRPJ-AGIUHOORSA-N 2 0 238.375 2.175 20 0 BEADRP C[C@H](F)CC[NH2+][C@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925676590 634265968 /nfs/dbraw/zinc/26/59/68/634265968.db2.gz KLNUTJLJMNTAFJ-AXFHLTTASA-N 2 0 216.344 2.230 20 0 BEADRP CCC1([NH2+][C@H]2C[C@@H]([NH3+])CC(C)(C)C2)CC1 ZINC000925681345 634281398 /nfs/dbraw/zinc/28/13/98/634281398.db2.gz XGDLPOQJQDCATH-MNOVXSKESA-N 2 0 210.365 2.425 20 0 BEADRP CC/C=C\C[NH2+][C@@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925682146 634284729 /nfs/dbraw/zinc/28/47/29/634284729.db2.gz UDDHKBIFAICJPP-GKKDLHFNSA-N 2 0 210.365 2.448 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+]CCC1CC(F)(F)C1 ZINC000925684695 634295279 /nfs/dbraw/zinc/29/52/79/634295279.db2.gz IWHKKKXGIOOQFW-SNVBAGLBSA-N 2 0 232.318 2.152 20 0 BEADRP C1CC(C2([NH2+][C@H]3[C@@H]4[NH2+]C[C@@H]5C[C@H]3C[C@@H]54)CCC2)C1 ZINC000925684377 634295727 /nfs/dbraw/zinc/29/57/27/634295727.db2.gz ALCCQQFBTWQFEM-XSXPHNMFSA-N 2 0 246.398 2.295 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+][C@H]2CCC[C@@H]3C[C@@H]32)C12CCC2 ZINC000925686908 634299726 /nfs/dbraw/zinc/29/97/26/634299726.db2.gz XNFASBSKGYGBIK-KSSYENDESA-N 2 0 220.360 2.035 20 0 BEADRP C[C@@H]1[C@H]2CC[C@@H](C[C@@H]1[NH2+][C@@H]1CCCC[C@H]1F)[NH2+]2 ZINC000925687673 634303981 /nfs/dbraw/zinc/30/39/81/634303981.db2.gz BJQKLKFLGOSPGD-LEZGYBIHSA-N 2 0 240.366 2.386 20 0 BEADRP CC(C)[NH2+]CCCN[C@@H](c1ccccc1)[C@H](C)[NH3+] ZINC000925695256 634345415 /nfs/dbraw/zinc/34/54/15/634345415.db2.gz VBASZSGIUZCEJP-DZGCQCFKSA-N 2 0 249.402 2.053 20 0 BEADRP CC[NH2+][C@H](C)CN[C@H](CCC[NH3+])c1ccccc1 ZINC000925701366 634374830 /nfs/dbraw/zinc/37/48/30/634374830.db2.gz YGRDFKUWLGTDKT-UKRRQHHQSA-N 2 0 249.402 2.054 20 0 BEADRP C[N@H+](CCC1CCC1)C1CCC([NH3+])CC1 ZINC000258869612 635216365 /nfs/dbraw/zinc/21/63/65/635216365.db2.gz SRFWWBWSINDMDK-UHFFFAOYSA-N 2 0 210.365 2.378 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]C[C@@H]1CCC2(CCC2)CO1 ZINC000925774213 635231223 /nfs/dbraw/zinc/23/12/23/635231223.db2.gz LJFQVAFXSXAIQH-XQQFMLRXSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C[NH2+][C@H]1CC[NH2+]C1(C)C ZINC000925774488 635237026 /nfs/dbraw/zinc/23/70/26/635237026.db2.gz VZMHTZWOYLLOSE-LBELIVKGSA-N 2 0 222.376 2.009 20 0 BEADRP FC1(F)CC[NH2+]C[C@@H]1C[NH2+][C@H]1CCC12CCC2 ZINC000925775571 635247264 /nfs/dbraw/zinc/24/72/64/635247264.db2.gz HMUOKLZRYQMWGN-MNOVXSKESA-N 2 0 244.329 2.154 20 0 BEADRP Cc1ccccc1CC[NH2+]CC1CC[NH+](C)CC1 ZINC000094182642 635247343 /nfs/dbraw/zinc/24/73/43/635247343.db2.gz GVRNSPAPSPBJOH-UHFFFAOYSA-N 2 0 246.398 2.469 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1C[NH2+]CCC1(F)F)C(C)C ZINC000925777505 635259794 /nfs/dbraw/zinc/25/97/94/635259794.db2.gz FDPUOOYEACVJIO-QWRGUYRKSA-N 2 0 234.334 2.255 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1N[C@@H]1C[C@H](C)c2ccccc21 ZINC000925786224 635304645 /nfs/dbraw/zinc/30/46/45/635304645.db2.gz SHTJVWCYJMNMNI-RBDSIQFVSA-N 2 0 230.355 2.432 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1C[NH2+]C[C@H]1C)c1ccc(F)cc1 ZINC000925790154 635316487 /nfs/dbraw/zinc/31/64/87/635316487.db2.gz GLSNSSIGQTWMCJ-WZRBSPASSA-N 2 0 236.334 2.332 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1C[NH2+]C[C@H]1C)[C@@H]1CC1(C)C ZINC000925802768 635354845 /nfs/dbraw/zinc/35/48/45/635354845.db2.gz IQLXNGSAPBUWJH-XQHKEYJVSA-N 2 0 224.392 2.256 20 0 BEADRP CC[C@H]1CC[C@H]1[NH2+]CC[C@@H]1C[NH2+]C[C@H]1C ZINC000925803827 635356945 /nfs/dbraw/zinc/35/69/45/635356945.db2.gz VZJOLUCHMYRHFO-YVECIDJPSA-N 2 0 210.365 2.010 20 0 BEADRP [NH3+]C[C@H]1CC[N@H+](Cc2ccc(C3CC3)cc2)C1 ZINC000094522063 635371706 /nfs/dbraw/zinc/37/17/06/635371706.db2.gz HQOYIMIWLOXQBC-CYBMUJFWSA-N 2 0 230.355 2.345 20 0 BEADRP C[C@]1(C[N@@H+]2C[C@@H]3CCC[C@@H]3C2)CCC[NH2+]C1 ZINC000126288740 635749273 /nfs/dbraw/zinc/74/92/73/635749273.db2.gz BJLBOJAGXAMSQV-MJBXVCDLSA-N 2 0 222.376 2.108 20 0 BEADRP CCCC1(C[NH2+][C@@H]2CCC[C@@H]2C[NH3+])CC1 ZINC000233034965 636340888 /nfs/dbraw/zinc/34/08/88/636340888.db2.gz IWCWAIAYNGSNEK-VXGBXAGGSA-N 2 0 210.365 2.284 20 0 BEADRP COC[C@H]1CCC[N@@H+]1CCCCCCC[NH3+] ZINC000143468872 636341505 /nfs/dbraw/zinc/34/15/05/636341505.db2.gz CEUTVLFJNYZICO-CYBMUJFWSA-N 2 0 228.380 2.006 20 0 BEADRP C[C@@H]1CCC[C@@H](C[N@@H+]2C[C@@H]3CC[NH2+]C[C@@H]3C2)C1 ZINC000928997891 636698426 /nfs/dbraw/zinc/69/84/26/636698426.db2.gz PBRSWLKYCIBWOR-APIJFGDWSA-N 2 0 236.403 2.354 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CCC[C@H]([NH3+])C2)cc1 ZINC000086402135 636885974 /nfs/dbraw/zinc/88/59/74/636885974.db2.gz YESDVVAXAQIFGE-KBPBESRZSA-N 2 0 218.344 2.355 20 0 BEADRP CCC1(CC)CC[N@H+](CC[C@@H]2CC[NH2+]C2)C1 ZINC000087255375 636893182 /nfs/dbraw/zinc/89/31/82/636893182.db2.gz ZCJNRBIQBYYLBJ-ZDUSSCGKSA-N 2 0 224.392 2.498 20 0 BEADRP CCCSC[C@H](C)[NH2+]CCc1cncn1C ZINC000903154473 637348004 /nfs/dbraw/zinc/34/80/04/637348004.db2.gz YRUHLVUBMRYNKT-NSHDSACASA-N 2 0 241.404 2.084 20 0 BEADRP C[C@@H]1C[C@H]2CCCC[C@@H]2[N@@H+]1C[C@H]1CCC[NH2+]1 ZINC000903436753 637361137 /nfs/dbraw/zinc/36/11/37/637361137.db2.gz BFWRXEQQTZLPQR-SYQHCUMBSA-N 2 0 222.376 2.391 20 0 BEADRP C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@@H+]1C[C@@H]1C[NH2+]C[C@H]1C ZINC000903437849 637362376 /nfs/dbraw/zinc/36/23/76/637362376.db2.gz NQGPBMOGAPQCIK-MRLBHPIUSA-N 2 0 236.403 2.495 20 0 BEADRP COc1cccc([C@@H](C)[NH2+]C[C@@H]2CC[C@H]([NH3+])C2)c1 ZINC000903461472 637362556 /nfs/dbraw/zinc/36/25/56/637362556.db2.gz UWOVODNHZXLIBV-BZPMIXESSA-N 2 0 248.370 2.473 20 0 BEADRP C[C@@H]1C[C@H]2CCCC[C@@H]2[N@@H+]1C[C@@H]1C[NH2+]C[C@H]1C ZINC000903437851 637363417 /nfs/dbraw/zinc/36/34/17/637363417.db2.gz NQGPBMOGAPQCIK-ZSAUSMIDSA-N 2 0 236.403 2.495 20 0 BEADRP [NH3+]CC[C@H]1CC[N@H+](Cc2ccccc2CF)C1 ZINC000903788976 637383787 /nfs/dbraw/zinc/38/37/87/637383787.db2.gz SGIOBLCWRBOJQW-LBPRGKRZSA-N 2 0 236.334 2.327 20 0 BEADRP Cc1cc(C)nc(C[N@@H+]2CC[C@@H](C[NH3+])[C@H](C)C2)c1 ZINC000903789400 637383872 /nfs/dbraw/zinc/38/38/72/637383872.db2.gz WLZFPKSMIOVVJU-OCCSQVGLSA-N 2 0 247.386 2.115 20 0 BEADRP CCCCC[N@@H+]1CC[NH2+]CCC12CCOCC2 ZINC000903814119 637384312 /nfs/dbraw/zinc/38/43/12/637384312.db2.gz KFAUSGXJVIJUHM-UHFFFAOYSA-N 2 0 240.391 2.021 20 0 BEADRP [NH3+]C1(C[NH2+]CCSCc2ccccc2)CC1 ZINC000904443517 637411719 /nfs/dbraw/zinc/41/17/19/637411719.db2.gz KFZGIVWMYTYSHZ-UHFFFAOYSA-N 2 0 236.384 2.001 20 0 BEADRP COc1ccc([C@@H](C)[NH2+]CCC[NH3+])cc1C ZINC000904444659 637415049 /nfs/dbraw/zinc/41/50/49/637415049.db2.gz OKAXLKAAWGFDMN-LLVKDONJSA-N 2 0 222.332 2.003 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CC[NH2+][C@H](C)C1)c1cncs1 ZINC000904468362 637424076 /nfs/dbraw/zinc/42/40/76/637424076.db2.gz AKEAXSQEHSGJIZ-VWYCJHECSA-N 2 0 239.388 2.182 20 0 BEADRP [NH3+]Cc1ccccc1NCC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000904485529 637427430 /nfs/dbraw/zinc/42/74/30/637427430.db2.gz NMRLNAXQVFURER-QXMXGUDHSA-N 2 0 245.370 2.088 20 0 BEADRP CCCC(N)=[NH+]OCC[C@@H]1CCCC[N@@H+]1C ZINC000906498438 638174455 /nfs/dbraw/zinc/17/44/55/638174455.db2.gz AYZFSQSWUWNINW-NSHDSACASA-N 2 0 227.352 2.159 20 0 BEADRP CCCC(N)=[NH+]OCC[C@H]1CCCC[N@@H+]1C ZINC000906498436 638174774 /nfs/dbraw/zinc/17/47/74/638174774.db2.gz AYZFSQSWUWNINW-LLVKDONJSA-N 2 0 227.352 2.159 20 0 BEADRP Cc1cc(C)c(C[NH2+][C@H]2C[C@H]([NH3+])C2)c(C)c1 ZINC000906508751 638181784 /nfs/dbraw/zinc/18/17/84/638181784.db2.gz YJQVSIYWCCLBDZ-JOCQHMNTSA-N 2 0 218.344 2.191 20 0 BEADRP Cc1cc(C[NH2+]C2CC([NH3+])C2)ccc1Cl ZINC000906509210 638182254 /nfs/dbraw/zinc/18/22/54/638182254.db2.gz AOAQSWGLIHEPMO-UHFFFAOYSA-N 2 0 224.735 2.228 20 0 BEADRP CCSc1cccc(C[NH2+]C2CC([NH3+])C2)c1 ZINC000906509953 638182949 /nfs/dbraw/zinc/18/29/49/638182949.db2.gz FMVJQMSZTUKKJN-UHFFFAOYSA-N 2 0 236.384 2.378 20 0 BEADRP CC(C)c1ccc(CC[NH2+]C2CC([NH3+])C2)cc1 ZINC000906511533 638186110 /nfs/dbraw/zinc/18/61/10/638186110.db2.gz ZPRSMFGJRPRUME-UHFFFAOYSA-N 2 0 232.371 2.432 20 0 BEADRP CC1(C)CCC[C@@H](C[NH2+][C@H]2C[C@H]([NH3+])C2)C1 ZINC000906516723 638187805 /nfs/dbraw/zinc/18/78/05/638187805.db2.gz IYUJORVIJPZOLZ-IJLUTSLNSA-N 2 0 210.365 2.282 20 0 BEADRP CC[C@H]1CCC[C@@H](C[NH2+][C@H]2C[C@H]([NH3+])C2)C1 ZINC000906517740 638188184 /nfs/dbraw/zinc/18/81/84/638188184.db2.gz OKGWCNLKCSITTF-RNJOBUHISA-N 2 0 210.365 2.282 20 0 BEADRP CCCCC[C@H](C)[NH2+]CC1([NH3+])CCOCC1 ZINC000149788221 639145985 /nfs/dbraw/zinc/14/59/85/639145985.db2.gz ZFFQKHBCGILANK-LBPRGKRZSA-N 2 0 228.380 2.053 20 0 BEADRP [NH3+]C[C@H]1CC[N@H+](Cc2ccc(C(F)F)cc2)C1 ZINC000150284316 639478076 /nfs/dbraw/zinc/47/80/76/639478076.db2.gz VOTZIQZOEXNVHH-LLVKDONJSA-N 2 0 240.297 2.405 20 0 BEADRP C[C@@H]1C[N@H+](CCCCCCC[NH3+])[C@H](C)CO1 ZINC000035787399 639944218 /nfs/dbraw/zinc/94/42/18/639944218.db2.gz DVTBGNYSBNZVBI-CHWSQXEVSA-N 2 0 228.380 2.005 20 0 BEADRP C[NH+](C)C1(C)CC[NH+](CC2CC=CC2)CC1 ZINC000931355524 640167176 /nfs/dbraw/zinc/16/71/76/640167176.db2.gz TVDCBKHUVODSKT-UHFFFAOYSA-N 2 0 222.376 2.369 20 0 BEADRP C[NH+](C)C1(C)CC[NH+](CC2CCC2)CC1 ZINC000931351226 640167411 /nfs/dbraw/zinc/16/74/11/640167411.db2.gz IFEVJYOTBFEARC-UHFFFAOYSA-N 2 0 210.365 2.203 20 0 BEADRP CCCCC[N@@H+]1C[C@@H]2CC[NH+](C)C[C@@H]2C1 ZINC000931439161 640201042 /nfs/dbraw/zinc/20/10/42/640201042.db2.gz LWWSSPVABXQRKL-QWHCGFSZSA-N 2 0 210.365 2.060 20 0 BEADRP C[N@@H+]1CC[C@@H]2C[NH+](CC[C@@H]3C[C@H]3C3CC3)C[C@@H]2C1 ZINC000931443559 640207748 /nfs/dbraw/zinc/20/77/48/640207748.db2.gz YRUHCGPQXZWGBQ-WCVJEAGWSA-N 2 0 248.414 2.306 20 0 BEADRP C=C/C=C/CC[NH+]1C[C@H]2CC[N@@H+](C)C[C@H]2C1 ZINC000931442383 640208346 /nfs/dbraw/zinc/20/83/46/640208346.db2.gz FULNQUZHYMNXIA-WEHDMVHDSA-N 2 0 220.360 2.002 20 0 BEADRP CC1CC(CN2CC[C@@H]3[C@H](CC[N@@H+]3C)C2)C1 ZINC000931547311 640267408 /nfs/dbraw/zinc/26/74/08/640267408.db2.gz QJTAXPCAYGHPFY-NWINJMCUSA-N 2 0 222.376 2.059 20 0 BEADRP CN1CC[C@@H]2CC[C@H](C1)[N@@H+]2C1CCCC1 ZINC000931721267 640340271 /nfs/dbraw/zinc/34/02/71/640340271.db2.gz MJVCFJAGIXNEPV-QWHCGFSZSA-N 2 0 208.349 2.098 20 0 BEADRP C[NH+]1CCC(C[NH2+]Cc2ccccc2F)CC1 ZINC000044515812 640398870 /nfs/dbraw/zinc/39/88/70/640398870.db2.gz LSKWVFDRLHDTQA-UHFFFAOYSA-N 2 0 236.334 2.257 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1cnc[nH]1 ZINC000054763208 640403953 /nfs/dbraw/zinc/40/39/53/640403953.db2.gz XBIZATQYWLZZFV-GFCCVEGCSA-N 2 0 238.379 2.010 20 0 BEADRP CCCCCC[N@@H+]1CC[C@H](C)[C@H](C[NH3+])C1 ZINC000164645899 640493766 /nfs/dbraw/zinc/49/37/66/640493766.db2.gz JHSGXEFDUZQBCQ-QWHCGFSZSA-N 2 0 212.381 2.483 20 0 BEADRP C[C@@H]1C[C@H](C)[N@H+](C[C@@]2(C)CCC[NH2+]C2)C1 ZINC000222612970 640495946 /nfs/dbraw/zinc/49/59/46/640495946.db2.gz SAQMVCPTEJXAAY-AGIUHOORSA-N 2 0 210.365 2.106 20 0 BEADRP CCc1ccc(C[NH2+]CCC(C)(C)[NH3+])cc1 ZINC000222647286 640499549 /nfs/dbraw/zinc/49/95/49/640499549.db2.gz UTKNGYVZJUIMHQ-UHFFFAOYSA-N 2 0 220.360 2.466 20 0 BEADRP CC[NH+]1CCC([NH2+]CC(C)(C)SC)CC1 ZINC000157101170 640572931 /nfs/dbraw/zinc/57/29/31/640572931.db2.gz MVXJFGYYCQFLLQ-UHFFFAOYSA-N 2 0 230.421 2.202 20 0 BEADRP C[N@@H+]1C[C@@H]2C[NH+](CC3(C)CCC3)C[C@]2(C)C1 ZINC000933732962 640757690 /nfs/dbraw/zinc/75/76/90/640757690.db2.gz WZEIWTZQUBZTMA-OCCSQVGLSA-N 2 0 222.376 2.060 20 0 BEADRP C[N@@H+]1C[C@@H]2C[NH+](CC3CC(C)(C)C3)C[C@]2(C)C1 ZINC000933734715 640761083 /nfs/dbraw/zinc/76/10/83/640761083.db2.gz RELRUQQQJYESCQ-HIFRSBDPSA-N 2 0 236.403 2.306 20 0 BEADRP C[C@@H]1C[C@@H](N[C@@H]2CCc3cccnc32)CC[N@@H+]1C ZINC000226826114 640798208 /nfs/dbraw/zinc/79/82/08/640798208.db2.gz ASAKNLLKELPBQP-KWCYVHTRSA-N 2 0 245.370 2.141 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CC=CCC1 ZINC000227074602 640815159 /nfs/dbraw/zinc/81/51/59/640815159.db2.gz NOGGAAPXNSETRA-AGIUHOORSA-N 2 0 208.349 2.060 20 0 BEADRP CC1(C)CC[NH+](CC[C@@H]2CCC[NH2+]C2)CC1 ZINC000061820124 640997333 /nfs/dbraw/zinc/99/73/33/640997333.db2.gz IIESEQXVOZFCRS-ZDUSSCGKSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H](C[NH2+][C@@H](C)C1CC1)C[NH+]1CCCC1 ZINC000062077349 641017990 /nfs/dbraw/zinc/01/79/90/641017990.db2.gz IADIBYAEKCXQIV-RYUDHWBXSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]1CC[C@H](C[NH2+]CC2CC[NH+](C)CC2)C1 ZINC000230412001 641053135 /nfs/dbraw/zinc/05/31/35/641053135.db2.gz ANRJPGYCJHOIOI-JSGCOSHPSA-N 2 0 224.392 2.354 20 0 BEADRP CCC[C@](C)(O)C[NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000230687134 641087685 /nfs/dbraw/zinc/08/76/85/641087685.db2.gz VUARDMXPTCUMJH-ILXRZTDVSA-N 2 0 248.370 2.272 20 0 BEADRP CCC[NH+](CCC)C[C@@]1(C)CCC[NH2+]C1 ZINC000062861668 641101536 /nfs/dbraw/zinc/10/15/36/641101536.db2.gz PXKPUKPXBBFZCB-ZDUSSCGKSA-N 2 0 212.381 2.498 20 0 BEADRP [NH3+]CCCCCC[NH2+]Cc1ccsc1 ZINC000063147272 641140396 /nfs/dbraw/zinc/14/03/96/641140396.db2.gz QOCCNFAWPSAGDT-UHFFFAOYSA-N 2 0 212.362 2.357 20 0 BEADRP CC(C)C1CC[NH+](C[C@@H]2CC[C@H]([NH3+])C2)CC1 ZINC000232539423 641297139 /nfs/dbraw/zinc/29/71/39/641297139.db2.gz PEEQSYYJSQAMHC-OCCSQVGLSA-N 2 0 224.392 2.482 20 0 BEADRP CC(C)C1CC[NH+](CC[C@@H]2CC[NH2+]C2)CC1 ZINC000232538421 641297547 /nfs/dbraw/zinc/29/75/47/641297547.db2.gz RKLVNXANHONWHG-ZDUSSCGKSA-N 2 0 224.392 2.354 20 0 BEADRP C[N@H+](CCCCCCC[NH3+])C[C@@H]1CCCCO1 ZINC000042466667 641552194 /nfs/dbraw/zinc/55/21/94/641552194.db2.gz ALJVPGYCBYPJKH-AWEZNQCLSA-N 2 0 242.407 2.397 20 0 BEADRP CC(C)C(C)(C)C[NH2+][C@@H]1CCC[C@@H]1C[NH3+] ZINC000232772742 641570566 /nfs/dbraw/zinc/57/05/66/641570566.db2.gz ZXMPPKZCOLCJJP-VXGBXAGGSA-N 2 0 212.381 2.386 20 0 BEADRP CC1CC(C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C)C2)C1 ZINC000929847632 641763261 /nfs/dbraw/zinc/76/32/61/641763261.db2.gz MPNVKGIDIYDWBA-CVSAEHQPSA-N 2 0 236.403 2.449 20 0 BEADRP CN(C)[C@H](C[NH2+]CCc1ccccc1)C1CC1 ZINC000916838596 641980788 /nfs/dbraw/zinc/98/07/88/641980788.db2.gz XBKMBGYMOFNBTN-OAHLLOKOSA-N 2 0 232.371 2.159 20 0 BEADRP CC1(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)CC1 ZINC000232916008 642389574 /nfs/dbraw/zinc/38/95/74/642389574.db2.gz GFYJRLHVLPZXMT-FRRDWIJNSA-N 2 0 222.376 2.297 20 0 BEADRP CC[NH+](CC)CCNc1cc(N)[nH+]cc1Cl ZINC000891391439 642458528 /nfs/dbraw/zinc/45/85/28/642458528.db2.gz TYSZQKDGUSDEIS-UHFFFAOYSA-N 2 0 242.754 2.071 20 0 BEADRP CCC[NH+](CCC)C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000233022152 642643238 /nfs/dbraw/zinc/64/32/38/642643238.db2.gz JAUFTGQMFWOCSB-CHWSQXEVSA-N 2 0 212.381 2.497 20 0 BEADRP CCC1(C[NH2+][C@@H]2CCCC[C@H]2C[NH3+])CC1 ZINC000233087643 642650284 /nfs/dbraw/zinc/65/02/84/642650284.db2.gz KYKNZZRFLVEDDX-NWDGAFQWSA-N 2 0 210.365 2.284 20 0 BEADRP CCC1(C[NH2+][C@@H]2CCC[C@@H]2C[NH3+])CCC1 ZINC000233089112 642650727 /nfs/dbraw/zinc/65/07/27/642650727.db2.gz RNHBYXAFBASJEN-VXGBXAGGSA-N 2 0 210.365 2.284 20 0 BEADRP CCO[C@H]1C[C@H]([NH2+]CCCCCC[NH3+])C1(C)C ZINC000233759889 642691839 /nfs/dbraw/zinc/69/18/39/642691839.db2.gz QDEIVPQSCDUSQK-STQMWFEESA-N 2 0 242.407 2.299 20 0 BEADRP CC[C@@H]1CCC[N@H+](C[C@@H]2CC[NH2+][C@@H](C)C2)C1 ZINC000233922265 642706664 /nfs/dbraw/zinc/70/66/64/642706664.db2.gz DIKLLNDKUDNXFW-BFHYXJOUSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CCC[N@H+](C[C@@H]2CC[C@H]([NH3+])C2)[C@H]1C ZINC000252119640 642886927 /nfs/dbraw/zinc/88/69/27/642886927.db2.gz JDPFGPJVSKQTER-XQHKEYJVSA-N 2 0 210.365 2.234 20 0 BEADRP C[C@@H]([NH2+]CCC1CCC1)C1CC[NH+](C)CC1 ZINC000090233837 643078361 /nfs/dbraw/zinc/07/83/61/643078361.db2.gz WKPYBYVUFKXALE-GFCCVEGCSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+]CCC(C)(C)[NH3+] ZINC000304568136 643126690 /nfs/dbraw/zinc/12/66/90/643126690.db2.gz HPBZZPLHLMOAGM-LLVKDONJSA-N 2 0 224.348 2.318 20 0 BEADRP C[C@@H]([NH2+]CCC(C)(C)[NH3+])c1cccc(O)c1 ZINC000304581044 643130906 /nfs/dbraw/zinc/13/09/06/643130906.db2.gz JRPAFSKXZLZYNE-SNVBAGLBSA-N 2 0 222.332 2.170 20 0 BEADRP C[C@H]1CC([NH2+]C2CC[NH2+]CC2)C[C@H](C)C1 ZINC000082834912 643384466 /nfs/dbraw/zinc/38/44/66/643384466.db2.gz IGZACBDQKKCLEO-GHMZBOCLSA-N 2 0 210.365 2.153 20 0 BEADRP C[NH+](C)[C@H]1CCC[C@@H]([NH2+]C2CCCC2)C1 ZINC000165424086 643392650 /nfs/dbraw/zinc/39/26/50/643392650.db2.gz ROIGIPYHLYMMKM-OLZOCXBDSA-N 2 0 210.365 2.391 20 0 BEADRP CC(C)C[N@H+](C[C@@H]1CC[C@H]([NH3+])C1)C1CC1 ZINC000085015355 643522739 /nfs/dbraw/zinc/52/27/39/643522739.db2.gz PXDCVEBVYOLWFA-NEPJUHHUSA-N 2 0 210.365 2.234 20 0 BEADRP CC(C)C[N@H+](C[C@@H]1CC[C@H]([NH3+])C1)C(C)C ZINC000085015370 643522900 /nfs/dbraw/zinc/52/29/00/643522900.db2.gz OXWMIXYIXGSDDP-OLZOCXBDSA-N 2 0 212.381 2.480 20 0 BEADRP C[N@@H+](Cc1ccsc1)C[C@@H]1CC[C@H]([NH3+])C1 ZINC000085014624 643523283 /nfs/dbraw/zinc/52/32/83/643523283.db2.gz VSUCRRNUTZMQRC-PWSUYJOCSA-N 2 0 224.373 2.307 20 0 BEADRP CC[C@H]1CCCC[N@@H+]1C[C@@H]1CC[C@H]([NH3+])C1 ZINC000085014521 643524172 /nfs/dbraw/zinc/52/41/72/643524172.db2.gz FRXXXTIBVSWYTK-AGIUHOORSA-N 2 0 210.365 2.378 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@@H]1C[NH3+])C1CCCC1 ZINC000084222263 643650448 /nfs/dbraw/zinc/65/04/48/643650448.db2.gz LOBYTSRXOANCBY-CYZMBNFOSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]CCc1ccsc1 ZINC000084220716 643650706 /nfs/dbraw/zinc/65/07/06/643650706.db2.gz NOWVUAWGECPQFE-NWDGAFQWSA-N 2 0 224.373 2.008 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]C1CCCCCC1 ZINC000084218027 643651052 /nfs/dbraw/zinc/65/10/52/643651052.db2.gz FWRCVRNRZGGPKZ-WCQYABFASA-N 2 0 210.365 2.426 20 0 BEADRP CC[NH+](CC)CCC[NH2+]C[C@@H]1CCC=CO1 ZINC000050267368 643670374 /nfs/dbraw/zinc/67/03/74/643670374.db2.gz UBUSPVDRHSTMBQ-ZDUSSCGKSA-N 2 0 226.364 2.001 20 0 BEADRP CCC[N@H+](CC1CC1)C[C@@H]1CC[C@H]([NH3+])C1 ZINC000085015158 643679087 /nfs/dbraw/zinc/67/90/87/643679087.db2.gz ZTLAUTGVDGBMQL-OLZOCXBDSA-N 2 0 210.365 2.236 20 0 BEADRP Cc1ncc(C[N@@H+](C)C2CCC([NH3+])CC2)s1 ZINC000085869304 643824876 /nfs/dbraw/zinc/82/48/76/643824876.db2.gz QIEZKXZEKOYJRE-UHFFFAOYSA-N 2 0 239.388 2.153 20 0 BEADRP CC1(C)CCC[C@@H]1[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000086873407 644242346 /nfs/dbraw/zinc/24/23/46/644242346.db2.gz BWYNURIUZDFMIQ-SRVKXCTJSA-N 2 0 210.365 2.425 20 0 BEADRP CCCCCC[C@@H](O)C[N@H+](C)C1CC[NH2+]CC1 ZINC000923280369 644315518 /nfs/dbraw/zinc/31/55/18/644315518.db2.gz XXYSSBZAICTRBA-CQSZACIVSA-N 2 0 242.407 2.002 20 0 BEADRP CC(C)CC[C@@H](O)C[N@H+](C)CC[C@@H]([NH3+])C(C)C ZINC000923298991 644327016 /nfs/dbraw/zinc/32/70/16/644327016.db2.gz VWERRYRLOORYNW-ZIAGYGMSSA-N 2 0 244.423 2.089 20 0 BEADRP C[C@@H]([NH3+])[C@H]1CC[N@H+](CCc2cccc(F)c2)C1 ZINC000923333057 644354348 /nfs/dbraw/zinc/35/43/48/644354348.db2.gz SWWDHBFOGNKJMD-YPMHNXCESA-N 2 0 236.334 2.037 20 0 BEADRP [NH3+][C@@H]1CC[C@@H]2C[N@H+](CCc3cccc(F)c3)C[C@H]12 ZINC000923331780 644359701 /nfs/dbraw/zinc/35/97/01/644359701.db2.gz ICQRRIFGFUIMFO-VHDGCEQUSA-N 2 0 248.345 2.037 20 0 BEADRP C[N@H+](CCC[NH2+]C1CC1)C[C@H]1CC1(C)C ZINC000923398516 644405140 /nfs/dbraw/zinc/40/51/40/644405140.db2.gz UXQVMMLZWPDKBU-LLVKDONJSA-N 2 0 210.365 2.106 20 0 BEADRP FCCC1CC[NH+](CCC[NH2+]C2CC2)CC1 ZINC000923413164 644415810 /nfs/dbraw/zinc/41/58/10/644415810.db2.gz UHMRTUPFPKLDIO-UHFFFAOYSA-N 2 0 228.355 2.200 20 0 BEADRP COc1c(C)cc(C[NH2+]C2CC[NH2+]CC2)cc1C ZINC000084574677 644428210 /nfs/dbraw/zinc/42/82/10/644428210.db2.gz SXIHVEUSFOSDMR-UHFFFAOYSA-N 2 0 248.370 2.154 20 0 BEADRP C[C@H]1CC[C@H](C)[N@H+](C[C@@H]2CC[C@H]([NH3+])C2)C1 ZINC000085016287 644435126 /nfs/dbraw/zinc/43/51/26/644435126.db2.gz OTICXAHIGWGDEF-RVMXOQNASA-N 2 0 210.365 2.234 20 0 BEADRP [NH3+]CC[C@@H]1CC[N@H+](CC[C@H]2CCCC2(F)F)C1 ZINC000923480693 644459666 /nfs/dbraw/zinc/45/96/66/644459666.db2.gz ZLRFWHRQACVXHC-VXGBXAGGSA-N 2 0 246.345 2.483 20 0 BEADRP C[C@@H](c1ccccn1)[N@@H+]1CC[C@H](C[NH3+])[C@H](C)C1 ZINC000923495971 644462284 /nfs/dbraw/zinc/46/22/84/644462284.db2.gz FMHPLDUQRAEAKO-FRRDWIJNSA-N 2 0 233.359 2.059 20 0 BEADRP C[C@@H]1C[N@H+](CCC2CCC2)CC[C@@H]1C[NH3+] ZINC000923488012 644463250 /nfs/dbraw/zinc/46/32/50/644463250.db2.gz CTMFUAXHURKRJK-DGCLKSJQSA-N 2 0 210.365 2.093 20 0 BEADRP C[C@@H](c1ccccn1)[N@@H+]1CC[C@@H](C[NH3+])[C@H](C)C1 ZINC000923495970 644463382 /nfs/dbraw/zinc/46/33/82/644463382.db2.gz FMHPLDUQRAEAKO-AGIUHOORSA-N 2 0 233.359 2.059 20 0 BEADRP CC(C)=CCC[N@@H+]1CC[C@@H](C[NH3+])[C@@H](C)C1 ZINC000923490975 644464532 /nfs/dbraw/zinc/46/45/32/644464532.db2.gz PLBHVZLLVNZGJM-STQMWFEESA-N 2 0 210.365 2.259 20 0 BEADRP CC(C)=CCC[N@@H+]1CC[C@H](C[NH3+])[C@@H](C)C1 ZINC000923490973 644465765 /nfs/dbraw/zinc/46/57/65/644465765.db2.gz PLBHVZLLVNZGJM-QWHCGFSZSA-N 2 0 210.365 2.259 20 0 BEADRP C[C@@H]1C[N@H+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC[C@H]1C[NH3+] ZINC000923494517 644471134 /nfs/dbraw/zinc/47/11/34/644471134.db2.gz NMCZWBJSLGRXDG-ZSAUSMIDSA-N 2 0 236.403 2.339 20 0 BEADRP CC[C@@H]([NH2+][C@H]1CC[NH2+]C1)C1CCCCC1 ZINC000086729804 644472344 /nfs/dbraw/zinc/47/23/44/644472344.db2.gz OYFNLPWBFHJAMN-QWHCGFSZSA-N 2 0 210.365 2.297 20 0 BEADRP C(C1CC1)[NH+]1CCC([C@@H]2CCC[NH2+]CC2)CC1 ZINC000923508057 644478354 /nfs/dbraw/zinc/47/83/54/644478354.db2.gz SWMUQFRGQPILMA-CQSZACIVSA-N 2 0 236.403 2.498 20 0 BEADRP C([C@@H]1CC2CCC1CC2)[N@@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1 ZINC000923516026 644479547 /nfs/dbraw/zinc/47/95/47/644479547.db2.gz RJXPETAOGREJJG-SVXVCFNTSA-N 2 0 248.414 2.354 20 0 BEADRP C([C@H]1CC2CCC1CC2)[N@@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1 ZINC000923516027 644481540 /nfs/dbraw/zinc/48/15/40/644481540.db2.gz RJXPETAOGREJJG-UIEKQHFFSA-N 2 0 248.414 2.354 20 0 BEADRP C(C[N@@H+]1C[C@H](C2CC2)C[C@@H]1C1CC1)[C@H]1CC[NH2+]C1 ZINC000923526933 644485412 /nfs/dbraw/zinc/48/54/12/644485412.db2.gz WECWJRPAJNQXMH-DAXOMENPSA-N 2 0 248.414 2.497 20 0 BEADRP C([C@@H]1C[C@H]2C[C@H]2C1)[N@@H+]1CC[C@]2(C1)CCCC[NH2+]2 ZINC000923532719 644489222 /nfs/dbraw/zinc/48/92/22/644489222.db2.gz GENNGJWAGANDAJ-XGUBFFRZSA-N 2 0 234.387 2.251 20 0 BEADRP CC(C)[C@H](C)[N@@H+]1CC[C@]2(C1)CCCC[NH2+]2 ZINC000923533728 644489532 /nfs/dbraw/zinc/48/95/32/644489532.db2.gz NTCZIMVQRRNAMK-STQMWFEESA-N 2 0 210.365 2.249 20 0 BEADRP [NH3+]CCCCCC[N@@H+]1CCOC[C@@H]1CC1CC1 ZINC000923551593 644495623 /nfs/dbraw/zinc/49/56/23/644495623.db2.gz ABOHMCNTJWMJLE-AWEZNQCLSA-N 2 0 240.391 2.006 20 0 BEADRP COc1ccccc1C[NH2+][C@@H]1CCCC[C@H]1C[NH3+] ZINC000089139037 644536196 /nfs/dbraw/zinc/53/61/96/644536196.db2.gz IQYRKEYSFDNPEV-GXTWGEPZSA-N 2 0 248.370 2.302 20 0 BEADRP C[C@H](C[C@H]1CCCCC[NH2+]1)[NH2+]C1CCOCC1 ZINC000093514915 644693930 /nfs/dbraw/zinc/69/39/30/644693930.db2.gz MWNOLZXOWAEZED-TZMCWYRMSA-N 2 0 240.391 2.066 20 0 BEADRP C[NH+](C)[C@@H]1CCC[C@H]([NH2+]C[C@H]2CCC=CO2)C1 ZINC000248994557 644707355 /nfs/dbraw/zinc/70/73/55/644707355.db2.gz OKZHSXJEORXNTD-BFHYXJOUSA-N 2 0 238.375 2.142 20 0 BEADRP Cc1ccc(OCC[N@@H+]2CC[C@@H]([NH3+])[C@H](C)C2)cc1 ZINC000094341897 644716679 /nfs/dbraw/zinc/71/66/79/644716679.db2.gz XKAZSVCGPVKIFB-UKRRQHHQSA-N 2 0 248.370 2.043 20 0 BEADRP C[C@]1(C[NH2+][C@@H]2CCCC[C@H]2C[NH3+])CCCS1 ZINC000250783810 644780822 /nfs/dbraw/zinc/78/08/22/644780822.db2.gz FEZGHORLLIHIMT-YNEHKIRRSA-N 2 0 242.432 2.379 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[N@@H+]2CCC[C@H]3CCC[C@H]32)C1 ZINC000251294426 644801161 /nfs/dbraw/zinc/80/11/61/644801161.db2.gz NZSLPMSNWYSLSQ-REWJHTLYSA-N 2 0 222.376 2.378 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]C[C@H]2CCC[NH2+]C2)[C@H]1C ZINC000251591293 644812189 /nfs/dbraw/zinc/81/21/89/644812189.db2.gz BIEZVYUKOWKDJY-RFGFWPKPSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1CCCC[C@H]1[N@H+](C)CC[C@H]1CC[NH2+]C1 ZINC000252175029 644840111 /nfs/dbraw/zinc/84/01/11/644840111.db2.gz OTVUZVBOQLUANX-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP [NH3+]CCC[NH2+][C@@H]1CC[C@H]2CCCC[C@H]2C1 ZINC000252439953 644851657 /nfs/dbraw/zinc/85/16/57/644851657.db2.gz VFIPEGQHDKRVGD-FRRDWIJNSA-N 2 0 210.365 2.284 20 0 BEADRP CC(C)([NH3+])CC[NH2+][C@@H]1CCc2ccccc21 ZINC000304671825 644925712 /nfs/dbraw/zinc/92/57/12/644925712.db2.gz XNEFAQCTXLBJIU-CYBMUJFWSA-N 2 0 218.344 2.391 20 0 BEADRP C([NH2+][C@@H]1CC[NH2+]C12CCCC2)C1CCCC1 ZINC000843129000 645266966 /nfs/dbraw/zinc/26/69/66/645266966.db2.gz ODOYMBZLWWQENO-CYBMUJFWSA-N 2 0 222.376 2.441 20 0 BEADRP C[C@H]([NH2+]CCCC[N@H+](C)C1CC1)c1ncco1 ZINC000926558369 645280496 /nfs/dbraw/zinc/28/04/96/645280496.db2.gz HGWMLFWQDXRIES-NSHDSACASA-N 2 0 237.347 2.200 20 0 BEADRP CSC1CC([NH2+]CCCC[N@H+](C)C2CC2)C1 ZINC000926559429 645281789 /nfs/dbraw/zinc/28/17/89/645281789.db2.gz NVRVXNFTDQDQSO-UHFFFAOYSA-N 2 0 242.432 2.344 20 0 BEADRP C[N@H+]1C[C@H]2CC[C@@H](C1)C2[NH2+]C1CC2(CCC2)C1 ZINC000926659829 645342800 /nfs/dbraw/zinc/34/28/00/645342800.db2.gz HTFKCTXEABROHV-ONXXMXGDSA-N 2 0 234.387 2.249 20 0 BEADRP C[C@H]([NH2+]CC[C@]1(C)C[C@@]1(F)Cl)[C@@H]1CCC[NH2+]1 ZINC000844923183 645348461 /nfs/dbraw/zinc/34/84/61/645348461.db2.gz HZGMRXOLAPWDPY-YFKTTZPYSA-N 2 0 248.773 2.421 20 0 BEADRP C[C@H]([NH2+]CC[C@@]1(C)C[C@@]1(F)Cl)[C@H]1CCC[NH2+]1 ZINC000844923181 645348505 /nfs/dbraw/zinc/34/85/05/645348505.db2.gz HZGMRXOLAPWDPY-USZNOCQGSA-N 2 0 248.773 2.421 20 0 BEADRP C[C@]1(CC[NH2+][C@@H]2CCC[C@H]2[NH3+])C[C@@]1(F)Cl ZINC000844925451 645350336 /nfs/dbraw/zinc/35/03/36/645350336.db2.gz VCFJBISNPXHNRZ-ZNSHCXBVSA-N 2 0 234.746 2.161 20 0 BEADRP C/C=C/C[NH2+][C@@H]1CCCN2CCCC[C@H]12 ZINC000926764231 645412423 /nfs/dbraw/zinc/41/24/23/645412423.db2.gz CIPXRLVCRTXPGW-XCUNLHGCSA-N 2 0 208.349 2.169 20 0 BEADRP C[N@H+]1C[C@H]2CC[C@@H](C1)C2[NH2+][C@H]1CCCC12CC2 ZINC000926778896 645425259 /nfs/dbraw/zinc/42/52/59/645425259.db2.gz SOVARTYSYYKMMD-WJLOJVBCSA-N 2 0 234.387 2.249 20 0 BEADRP C[C@@H]1C[C@@H]1[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000925488167 645503341 /nfs/dbraw/zinc/50/33/41/645503341.db2.gz BRPDDJUPBHZCDH-XBFCOCLRSA-N 2 0 218.344 2.465 20 0 BEADRP C[C@@H]1C[C@@H]1[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000925488155 645503369 /nfs/dbraw/zinc/50/33/69/645503369.db2.gz BRPDDJUPBHZCDH-BNOWGMLFSA-N 2 0 218.344 2.465 20 0 BEADRP CC1(C)[C@H]([NH2+]C2CCCC2)[C@@H]2CCC[NH2+][C@@H]21 ZINC000925490168 645535454 /nfs/dbraw/zinc/53/54/54/645535454.db2.gz FGHGCRPQPNCSJG-FRRDWIJNSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@H]([NH3+])[C@H](N[C@H]1C[C@H]1C)c1ccccc1 ZINC000925490511 645536951 /nfs/dbraw/zinc/53/69/51/645536951.db2.gz OBFDYGMDQDWJQG-URBCHYCLSA-N 2 0 204.317 2.073 20 0 BEADRP C[C@@H]1C[C@H]1C[NH2+][C@@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C ZINC000925482054 645861678 /nfs/dbraw/zinc/86/16/78/645861678.db2.gz PTWDJZVVQCONPX-RXGFPQBGSA-N 2 0 222.376 2.009 20 0 BEADRP Cc1ccc(F)c(C[N@H+]2C[C@@H](C[NH3+])C[C@@H]2C)c1 ZINC000220337776 645890465 /nfs/dbraw/zinc/89/04/65/645890465.db2.gz IEJPKAJUBJCVDZ-NWDGAFQWSA-N 2 0 236.334 2.303 20 0 BEADRP COCCC[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000925496600 645941399 /nfs/dbraw/zinc/94/13/99/645941399.db2.gz WUMJZRWMIISZNY-AWEZNQCLSA-N 2 0 236.359 2.093 20 0 BEADRP C[N@H+]1C[C@H]2CC[C@@H](C1)C2[NH2+]Cc1ccc(F)cc1 ZINC000924524783 646046377 /nfs/dbraw/zinc/04/63/77/646046377.db2.gz KNBZZVWABSLGFL-NNQSOWQGSA-N 2 0 248.345 2.256 20 0 BEADRP CC(C)CC[NH+]1CCC([NH2+][C@H]2C[C@@H]2C)CC1 ZINC000924952580 646139235 /nfs/dbraw/zinc/13/92/35/646139235.db2.gz XJJMTGSLYDGUFP-JSGCOSHPSA-N 2 0 224.392 2.495 20 0 BEADRP CCOCCCC[NH2+][C@@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925482642 646295759 /nfs/dbraw/zinc/29/57/59/646295759.db2.gz WUZFEQSJXFCPPQ-CHWSQXEVSA-N 2 0 242.407 2.299 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1NC[C@H]1Cc2ccccc21 ZINC000925490786 646298912 /nfs/dbraw/zinc/29/89/12/646298912.db2.gz OVTRTVVBCCDVPG-TZMCWYRMSA-N 2 0 230.355 2.056 20 0 BEADRP CSCC[NH2+][C@H]1CC[NH2+]C[C@H]1C1CCCC1 ZINC000925501795 646303401 /nfs/dbraw/zinc/30/34/01/646303401.db2.gz CATFKPUCQAAHJL-STQMWFEESA-N 2 0 242.432 2.107 20 0 BEADRP C([NH2+][C@H]1CC[NH2+]C12CCC2)C(C1CC1)C1CC1 ZINC000925514772 646310154 /nfs/dbraw/zinc/31/01/54/646310154.db2.gz MDNYDAHBHJAYEB-AWEZNQCLSA-N 2 0 234.387 2.297 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+]CC(C1CC1)C1CC1 ZINC000925514307 646310230 /nfs/dbraw/zinc/31/02/30/646310230.db2.gz KKIAKTHPZYEVDA-CYBMUJFWSA-N 2 0 222.376 2.153 20 0 BEADRP Cc1cc(C[NH2+][C@H]2C[C@@H]([NH3+])C23CCC3)ccc1F ZINC000925512665 646310321 /nfs/dbraw/zinc/31/03/21/646310321.db2.gz AHGMPEWKLXOJLS-KGLIPLIRSA-N 2 0 248.345 2.494 20 0 BEADRP CS[C@@H]1CC[C@H]([NH2+][C@H]2CC[NH2+]C23CCC3)C1 ZINC000925520922 646313571 /nfs/dbraw/zinc/31/35/71/646313571.db2.gz BHRLHNMEULFCHB-TUAOUCFPSA-N 2 0 240.416 2.145 20 0 BEADRP CC1(C)C[C@H]([NH3+])C[C@@H]([NH2+]C[C@H]2CCCS2)C1 ZINC000925552616 646329874 /nfs/dbraw/zinc/32/98/74/646329874.db2.gz LIQLQWQWRYHKET-IJLUTSLNSA-N 2 0 242.432 2.378 20 0 BEADRP CC(C)CC[NH+]1CCC([NH2+]CCCF)CC1 ZINC000925556319 646331807 /nfs/dbraw/zinc/33/18/07/646331807.db2.gz JXFGCDGYIALBTD-UHFFFAOYSA-N 2 0 230.371 2.446 20 0 BEADRP CC(C)[N@H+](C)CCN[C@H](c1ccccc1)[C@@H](C)[NH3+] ZINC000925560611 646335359 /nfs/dbraw/zinc/33/53/59/646335359.db2.gz WTBKTMLJXGEJFE-HIFRSBDPSA-N 2 0 249.402 2.005 20 0 BEADRP CC(C)[N@H+](C)CCN[C@@H](c1ccccc1)[C@H](C)[NH3+] ZINC000925560608 646335491 /nfs/dbraw/zinc/33/54/91/646335491.db2.gz WTBKTMLJXGEJFE-DZGCQCFKSA-N 2 0 249.402 2.005 20 0 BEADRP CC1(C[NH2+][C@H]2CC[NH2+]C23CCCC3)CC1 ZINC000925575846 646341195 /nfs/dbraw/zinc/34/11/95/646341195.db2.gz HWUGCQTXJGRSEY-NSHDSACASA-N 2 0 208.349 2.051 20 0 BEADRP C([NH2+][C@@H]1CC[NH2+]C12CCC2)C1(C2CC2)CC1 ZINC000925589806 646348296 /nfs/dbraw/zinc/34/82/96/646348296.db2.gz KSDBELAFISKIMY-GFCCVEGCSA-N 2 0 220.360 2.051 20 0 BEADRP C[C@H]([NH2+][C@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C)C1CC1 ZINC000925589624 646349319 /nfs/dbraw/zinc/34/93/19/646349319.db2.gz ZTVXILKERKCTKW-RYDUCSDGSA-N 2 0 222.376 2.151 20 0 BEADRP CC1(C[NH2+][C@@H]2CC[NH2+]C2(C)C)CCCC1 ZINC000925594138 646350658 /nfs/dbraw/zinc/35/06/58/646350658.db2.gz JLXIMDYWMFHTQG-LLVKDONJSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCOC1)c1cccc(C[NH+](C)C)c1 ZINC000925614782 646363658 /nfs/dbraw/zinc/36/36/58/646363658.db2.gz CKHUEWBNMCLBLK-DOMZBBRYSA-N 2 0 248.370 2.188 20 0 BEADRP CC1(C)[C@H]([NH2+][C@H]2CC=CCC2)[C@@H]2CCC[NH2+][C@@H]21 ZINC000925619336 646366913 /nfs/dbraw/zinc/36/69/13/646366913.db2.gz MRXTYNIINVICLO-RFQIPJPRSA-N 2 0 234.387 2.461 20 0 BEADRP C([NH2+][C@@H]1CC[NH2+]C12CCC2)C1(C2CC2)CCC1 ZINC000925622750 646369946 /nfs/dbraw/zinc/36/99/46/646369946.db2.gz PTAQPHOHXICALJ-CYBMUJFWSA-N 2 0 234.387 2.441 20 0 BEADRP CC(C)OCCCC[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000925633688 646372130 /nfs/dbraw/zinc/37/21/30/646372130.db2.gz GFXOJCJVTNDYLJ-ZDUSSCGKSA-N 2 0 240.391 2.066 20 0 BEADRP CC(C)CSCCC[NH2+][C@H]1CC[NH2+]C1(C)C ZINC000925627705 646375077 /nfs/dbraw/zinc/37/50/77/646375077.db2.gz ZGOCKPQLEPCHMY-LBPRGKRZSA-N 2 0 244.448 2.496 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+]CC23CCC(CC2)C3)C12CCC2 ZINC000925627052 646375262 /nfs/dbraw/zinc/37/52/62/646375262.db2.gz VVOMWAKXGIMLGH-YIFLHPOLSA-N 2 0 234.387 2.426 20 0 BEADRP CC1(C)C[C@@H]([NH2+][C@H]2CCCOCC2)C[C@@H]([NH3+])C1 ZINC000925636479 646379703 /nfs/dbraw/zinc/37/97/03/646379703.db2.gz SRLLOTZNQRNNQP-AGIUHOORSA-N 2 0 240.391 2.051 20 0 BEADRP CS[C@H](C[NH2+][C@@H]1CC[NH2+]C1(C)C)C(C)(C)C ZINC000925636137 646380016 /nfs/dbraw/zinc/38/00/16/646380016.db2.gz AETAZGNNYZHTIQ-GHMZBOCLSA-N 2 0 244.448 2.494 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+]CCC[C@@H]1CCCCO1 ZINC000925638957 646382178 /nfs/dbraw/zinc/38/21/78/646382178.db2.gz HUHYKRNIEWTKKV-STQMWFEESA-N 2 0 240.391 2.066 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+]CCC[C@@H]1CCCCO1 ZINC000925638955 646382963 /nfs/dbraw/zinc/38/29/63/646382963.db2.gz HUHYKRNIEWTKKV-QWHCGFSZSA-N 2 0 240.391 2.066 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+]CCC[C@H]1CCCCO1 ZINC000925638951 646383022 /nfs/dbraw/zinc/38/30/22/646383022.db2.gz HUHYKRNIEWTKKV-CHWSQXEVSA-N 2 0 240.391 2.066 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+][C@@H]2CC[NH2+]C23CCCC3)C1 ZINC000925645355 646386824 /nfs/dbraw/zinc/38/68/24/646386824.db2.gz PXMVEHXUXOAJPJ-JHJVBQTASA-N 2 0 222.376 2.439 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+]C1CCC2(CC2)CC1 ZINC000925651770 646389352 /nfs/dbraw/zinc/38/93/52/646389352.db2.gz KMGMRJOTOXAZTH-LBPRGKRZSA-N 2 0 222.376 2.439 20 0 BEADRP CC1(C)[C@H]([NH2+]C2CC(F)(F)C2)[C@@H]2CCC[NH2+][C@@H]21 ZINC000925651383 646390133 /nfs/dbraw/zinc/39/01/33/646390133.db2.gz BONCFTFNYPGPMZ-OUAUKWLOSA-N 2 0 244.329 2.150 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+]C[C@H]1CCC(F)(F)C1 ZINC000925652027 646392139 /nfs/dbraw/zinc/39/21/39/646392139.db2.gz AZDRDOCQNMEOKP-VHSXEESVSA-N 2 0 232.318 2.152 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+]C1CCC2(CC2)CC1 ZINC000925651769 646392418 /nfs/dbraw/zinc/39/24/18/646392418.db2.gz KMGMRJOTOXAZTH-GFCCVEGCSA-N 2 0 222.376 2.439 20 0 BEADRP C[C@@H]1CC[C@@H](C[NH2+][C@@H]2CC[NH2+]C23CCC3)C1 ZINC000925661195 646395950 /nfs/dbraw/zinc/39/59/50/646395950.db2.gz BTMKVJPLHCYWKK-JHJVBQTASA-N 2 0 222.376 2.297 20 0 BEADRP CO[C@@H]1CCC[C@H]1[NH2+][C@@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925683546 646411945 /nfs/dbraw/zinc/41/19/45/646411945.db2.gz SIDUUBIDLJZJAL-FDYHWXHSSA-N 2 0 240.391 2.050 20 0 BEADRP CCO[C@H]1C[C@@H]([NH2+][C@H]2C[C@@H]([NH3+])CC(C)(C)C2)C1 ZINC000925693098 646418334 /nfs/dbraw/zinc/41/83/34/646418334.db2.gz LFTPAUWSGXQREP-NDBYEHHHSA-N 2 0 240.391 2.050 20 0 BEADRP CC1(C)C[C@@H]([NH2+][C@H]2C=CCC2)C[C@@H]([NH3+])C1 ZINC000925710198 646434666 /nfs/dbraw/zinc/43/46/66/646434666.db2.gz HYXSQSIJBIMUSY-WOPDTQHZSA-N 2 0 208.349 2.201 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[NH2+]C1(C)C)CC(F)F ZINC000925713826 646438835 /nfs/dbraw/zinc/43/88/35/646438835.db2.gz UTVAEGQRLCSJKK-DTWKUNHWSA-N 2 0 220.307 2.008 20 0 BEADRP CC(C)(F)C[NH2+][C@@H]1CC[NH2+]C[C@H]1C1CCCC1 ZINC000925725453 646450026 /nfs/dbraw/zinc/45/00/26/646450026.db2.gz UGOFIBOBWFQHJV-QWHCGFSZSA-N 2 0 242.382 2.492 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]CC2(CC3CC3)CC2)C1 ZINC000925732842 646455619 /nfs/dbraw/zinc/45/56/19/646455619.db2.gz DQVFBQITWUQHAC-CHWSQXEVSA-N 2 0 222.376 2.426 20 0 BEADRP CC1(C)C[C@@]1(C)C[NH2+][C@@H]1CC[NH2+]C1(C)C ZINC000925733417 646456897 /nfs/dbraw/zinc/45/68/97/646456897.db2.gz IQQMPFOPLTWPIY-MFKMUULPSA-N 2 0 210.365 2.153 20 0 BEADRP CCC[C@H](C)CC[NH2+][C@@H](C)[C@@H]1CC[NH2+]C1 ZINC000925735245 646458528 /nfs/dbraw/zinc/45/85/28/646458528.db2.gz XVXLJCVSQMVVKC-RWMBFGLXSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H]([NH2+]CC(C)(C)CC(F)F)[C@@H]1CCC[NH2+]1 ZINC000925735329 646458800 /nfs/dbraw/zinc/45/88/00/646458800.db2.gz ZDKUGSGLWFJWGB-UWVGGRQHSA-N 2 0 234.334 2.398 20 0 BEADRP C([NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32)C1(CC2CC2)CC1 ZINC000925735315 646459045 /nfs/dbraw/zinc/45/90/45/646459045.db2.gz ZACGWEFIVLPSOO-BTFPBAQTSA-N 2 0 246.398 2.153 20 0 BEADRP CC(C)([NH3+])CC[NH2+][C@@H]1CCCc2cccnc21 ZINC000925739592 646462713 /nfs/dbraw/zinc/46/27/13/646462713.db2.gz ZSGTUFHYPLZYLH-GFCCVEGCSA-N 2 0 233.359 2.176 20 0 BEADRP CC(C)n1cc([C@@H](C)[NH2+]CCC(C)(C)[NH3+])cn1 ZINC000925742201 646462772 /nfs/dbraw/zinc/46/27/72/646462772.db2.gz ZLRUNGHMIFNGSM-LLVKDONJSA-N 2 0 238.379 2.242 20 0 BEADRP CCC1([NH3+])CC[NH+]([C@H]2CC[C@@H]2C2CC2)CC1 ZINC000925760083 646466120 /nfs/dbraw/zinc/46/61/20/646466120.db2.gz OFUKLHPVVYENOR-OLZOCXBDSA-N 2 0 222.376 2.378 20 0 BEADRP C[C@H]1CCNC[C@@H]1[NH2+][C@@H]1C[C@@H]2CCCC[C@H]12 ZINC000925766992 646469547 /nfs/dbraw/zinc/46/95/47/646469547.db2.gz VVMXYDIAEFFGTG-YHQUGGNUSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1C[C@H]1[C@H]1C[C@H]1C)[C@@H]1CCCC[NH2+]1 ZINC000925771308 646470819 /nfs/dbraw/zinc/47/08/19/646470819.db2.gz ATAGNTRXLCHCLL-DBWOOVFOSA-N 2 0 236.403 2.399 20 0 BEADRP CC[C@H]([NH2+]C[C@H]1C[NH2+]CCC1(F)F)C1CCC1 ZINC000925777410 646475229 /nfs/dbraw/zinc/47/52/29/646475229.db2.gz OWGRCMKUAOQWPT-NEPJUHHUSA-N 2 0 246.345 2.400 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+][C@@H](C1CC1)C1CCCC1 ZINC000925779547 646476670 /nfs/dbraw/zinc/47/66/70/646476670.db2.gz KQLDPKAKTQGJSU-LERXQTSPSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+][C@H](C1CC1)C1CCCC1 ZINC000925779546 646477793 /nfs/dbraw/zinc/47/77/93/646477793.db2.gz KQLDPKAKTQGJSU-HONMWMINSA-N 2 0 222.376 2.153 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1C[NH2+]CCC1(F)F ZINC000925779971 646477974 /nfs/dbraw/zinc/47/79/74/646477974.db2.gz COYHMKRMQAUKKB-UTUOFQBUSA-N 2 0 246.345 2.400 20 0 BEADRP C[C@@H]1CC(C)(C)C[C@H]1[NH2+][C@@H]1C[NH2+]C[C@H]1C ZINC000925782438 646478902 /nfs/dbraw/zinc/47/89/02/646478902.db2.gz GMPHLOCSBCCGAV-DDHJBXDOSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@H]1CCCc2occc21 ZINC000925784250 646481637 /nfs/dbraw/zinc/48/16/37/646481637.db2.gz IHWFBGCPMHSXEA-MDZLAQPJSA-N 2 0 234.343 2.102 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@@H]1CCC[C@H]2C[C@]21C ZINC000925785211 646481735 /nfs/dbraw/zinc/48/17/35/646481735.db2.gz LTQQWZJMLKFQRR-MBJXGIAVSA-N 2 0 222.376 2.010 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+][C@H]1CCC[C@@H]1CCCF ZINC000925787118 646482765 /nfs/dbraw/zinc/48/27/65/646482765.db2.gz XCAVYZBACUEAGG-FVCCEPFGSA-N 2 0 228.355 2.102 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+][C@@H]1CCC[C@@H]1CCCF ZINC000925787117 646483032 /nfs/dbraw/zinc/48/30/32/646483032.db2.gz XCAVYZBACUEAGG-FDYHWXHSSA-N 2 0 228.355 2.102 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@@H]1CCc2cc(F)ccc21 ZINC000925791457 646484776 /nfs/dbraw/zinc/48/47/76/646484776.db2.gz QCEQHCRRNGNXBX-IFUGULHKSA-N 2 0 248.345 2.258 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@@H]1CCc2ccc(F)cc21 ZINC000925791477 646485344 /nfs/dbraw/zinc/48/53/44/646485344.db2.gz QOVZOZCDZWFGBY-IFUGULHKSA-N 2 0 248.345 2.258 20 0 BEADRP CC[C@H]([NH2+]CC[C@@H]1C[NH2+]C[C@H]1C)C1CCC1 ZINC000925803505 646488981 /nfs/dbraw/zinc/48/89/81/646488981.db2.gz QDYASXLHTXFGCQ-BNOWGMLFSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1C[C@H]1[C@@H]1C[C@H]1[NH2+][C@H]1CC[NH2+]CC[C@H]1C ZINC000925821273 646495713 /nfs/dbraw/zinc/49/57/13/646495713.db2.gz GNFWFNJHCBTEPF-IZMFDJJNSA-N 2 0 222.376 2.009 20 0 BEADRP CCC[C@H](C)[NH2+]C[C@]12CCC[C@H]1[NH2+]CC2 ZINC000925840759 646505958 /nfs/dbraw/zinc/50/59/58/646505958.db2.gz KTLWNOKGWJXOMN-YNEHKIRRSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+]C[C@]23CCC[C@H]2[NH2+]CC3)C1 ZINC000925842331 646507607 /nfs/dbraw/zinc/50/76/07/646507607.db2.gz IYGVWFPYIKAIMZ-REWJHTLYSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCS[C@H](C)C1)[C@@H]1CCC[NH2+]1 ZINC000925862241 646514241 /nfs/dbraw/zinc/51/42/41/646514241.db2.gz YPARFCYHLDQACE-WYUUTHIRSA-N 2 0 228.405 2.001 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+]CC1CCC=CCC1 ZINC000925879987 646528885 /nfs/dbraw/zinc/52/88/85/646528885.db2.gz FRTMRPMNBJHOAC-AWEZNQCLSA-N 2 0 240.391 2.076 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[NH2+][C@H](C2CC2)C2CCC2)C1 ZINC000925879514 646529693 /nfs/dbraw/zinc/52/96/93/646529693.db2.gz GNSOUGYPCZDSGN-GDLCADMTSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C1([C@@H]2CCCCO2)CC1 ZINC000925893920 646535188 /nfs/dbraw/zinc/53/51/88/646535188.db2.gz SFYFNOJYZGQAIJ-OLZOCXBDSA-N 2 0 240.391 2.195 20 0 BEADRP CCN1C[C@H](C)[C@H]([NH2+][C@@H]2C[C@H]3C=C[C@@H]2CC3)C1 ZINC000925929243 646543829 /nfs/dbraw/zinc/54/38/29/646543829.db2.gz LGMPFIHNDFYKRX-VQJWOFKYSA-N 2 0 234.387 2.271 20 0 BEADRP C[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ncco1 ZINC000926308175 646614789 /nfs/dbraw/zinc/61/47/89/646614789.db2.gz NDCIUUBAJMJZMF-LLVKDONJSA-N 2 0 249.358 2.200 20 0 BEADRP CC[C@H](C[C@](C)(O)CC)[NH2+]C[C@H](C)C[NH+](C)C ZINC000926473697 646653010 /nfs/dbraw/zinc/65/30/10/646653010.db2.gz NFBPHRKEVWFKTC-BFHYXJOUSA-N 2 0 244.423 2.103 20 0 BEADRP C[C@@H](C[NH2+]C1CC2(C1)CCCC2)C[NH+](C)C ZINC000926473626 646653515 /nfs/dbraw/zinc/65/35/15/646653515.db2.gz MKYSAYGICRPJLU-LBPRGKRZSA-N 2 0 224.392 2.497 20 0 BEADRP CCCC[C@H](C)[NH2+]CC[C@@H]1C[NH2+]C[C@H]1C ZINC000722509595 711760223 /nfs/dbraw/zinc/76/02/23/711760223.db2.gz WFZLZIGAZXHLKB-FRRDWIJNSA-N 2 0 212.381 2.400 20 0 BEADRP CC1CC[NH+](CC2C[C@H]3CC[C@@H](C2)[NH2+]3)CC1 ZINC000703797236 712087578 /nfs/dbraw/zinc/08/75/78/712087578.db2.gz MONULIBMJWGHKA-AGUYFDCRSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC[C@@H]2CCSC2)CC[N@@H+]1C ZINC000704789764 712116909 /nfs/dbraw/zinc/11/69/09/712116909.db2.gz HROPLSPMRSBFAK-JHJVBQTASA-N 2 0 242.432 2.202 20 0 BEADRP CCOC[C@H]1CC[N@H+](CCCCCCC[NH3+])C1 ZINC000707565408 712175113 /nfs/dbraw/zinc/17/51/13/712175113.db2.gz SUYMAUFROKHINP-AWEZNQCLSA-N 2 0 242.407 2.254 20 0 BEADRP CC(C)=CCC[N@@H+]1CC[C@]2(C1)CCC[NH2+]C2 ZINC000709922218 712233627 /nfs/dbraw/zinc/23/36/27/712233627.db2.gz YXYDQIAUGGXVQD-CQSZACIVSA-N 2 0 222.376 2.418 20 0 BEADRP FC[C@H]1CCC[N@H+](CCCC2CC[NH2+]CC2)C1 ZINC000711444744 712300565 /nfs/dbraw/zinc/30/05/65/712300565.db2.gz VCDZQDPCDNWGMF-CQSZACIVSA-N 2 0 242.382 2.448 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@@H]1CC2CCC1CC2 ZINC000379461131 712384785 /nfs/dbraw/zinc/38/47/85/712384785.db2.gz SORXZSLLHVFANU-JXQTWKCFSA-N 2 0 224.392 2.497 20 0 BEADRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+][C@@H]1C[C@@H]2CCCC[C@H]12 ZINC000712378711 712428648 /nfs/dbraw/zinc/42/86/48/712428648.db2.gz RHUPXNVQXLIWRY-ZUWCUPBKSA-N 2 0 222.376 2.282 20 0 BEADRP C[N@H+](C[C@H]1CCC(C)(C)CO1)CC(C)(C)C[NH3+] ZINC000713597432 712466360 /nfs/dbraw/zinc/46/63/60/712466360.db2.gz UYDNCCUKSJZJHD-GFCCVEGCSA-N 2 0 242.407 2.108 20 0 BEADRP C=C/C=C\CC[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000713691407 712469166 /nfs/dbraw/zinc/46/91/66/712469166.db2.gz BJJDWECBBMIAPC-AGFGORMFSA-N 2 0 208.349 2.191 20 0 BEADRP C=C/C=C\CC[N@H+]1CCC[C@H](CC[NH3+])C1 ZINC000713729157 712470654 /nfs/dbraw/zinc/47/06/54/712470654.db2.gz AVBPUGFJUPAANG-DHCBQETCSA-N 2 0 208.349 2.180 20 0 BEADRP C=C/C=C/CC[NH+]1CCC(CC[NH2+]C)CC1 ZINC000713741581 712471515 /nfs/dbraw/zinc/47/15/15/712471515.db2.gz WAZPDGGSZOFOOE-SNAWJCMRSA-N 2 0 222.376 2.440 20 0 BEADRP CCOCCC[NH+]1CCC(C(C)(C)C[NH3+])CC1 ZINC000714444144 712489415 /nfs/dbraw/zinc/48/94/15/712489415.db2.gz DMOLOEIPKJBTBK-UHFFFAOYSA-N 2 0 242.407 2.110 20 0 BEADRP COC[C@H](C)C[NH2+]C1CCC(C)([NH+](C)C)CC1 ZINC000715511563 712524762 /nfs/dbraw/zinc/52/47/62/712524762.db2.gz WEAMJYNJVUDHCZ-IYXRBSQSSA-N 2 0 242.407 2.121 20 0 BEADRP C[NH+](C)C1(C)CCC([NH2+]C2CCOCC2)CC1 ZINC000715514494 712525265 /nfs/dbraw/zinc/52/52/65/712525265.db2.gz WJEHTUQBXZNUBA-UHFFFAOYSA-N 2 0 240.391 2.018 20 0 BEADRP [NH3+]CCCCCCC[N@@H+]1C[C@H]2[C@@H](C1)C2(F)F ZINC000715534312 712526288 /nfs/dbraw/zinc/52/62/88/712526288.db2.gz UJXDKVIMYFSWLH-PHIMTYICSA-N 2 0 232.318 2.093 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]CC[C@@H]2CCCS2)C1 ZINC000715751540 712531727 /nfs/dbraw/zinc/53/17/27/712531727.db2.gz FNNJPTKZVAAPMY-UTUOFQBUSA-N 2 0 228.405 2.132 20 0 BEADRP C[C@@H]1CCCC[C@H]1[NH2+]C[C@H]1C[NH2+]CCC1(F)F ZINC000717047329 712624984 /nfs/dbraw/zinc/62/49/84/712624984.db2.gz LOTMYCPUKDDKMO-IJLUTSLNSA-N 2 0 246.345 2.400 20 0 BEADRP CC[C@@H](C)C[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000037485295 712650944 /nfs/dbraw/zinc/65/09/44/712650944.db2.gz GBTOSBZJTUUTDM-VXGBXAGGSA-N 2 0 210.365 2.106 20 0 BEADRP CC[NH+]1CCC([NH2+]CCC(C)(C)COC)CC1 ZINC000718666103 712776792 /nfs/dbraw/zinc/77/67/92/712776792.db2.gz PKUUFGBNIPXTGM-UHFFFAOYSA-N 2 0 242.407 2.123 20 0 BEADRP COCC(C)(C)CC[NH2+][C@H](C)[C@H]1CCCC[NH2+]1 ZINC000718713868 712778229 /nfs/dbraw/zinc/77/82/29/712778229.db2.gz AERMGYYXQGDSPS-CHWSQXEVSA-N 2 0 242.407 2.169 20 0 BEADRP CO[C@@H]1CCC[C@@H]([NH2+][C@H](C)CC[NH+](C)C)CC1 ZINC000718838916 712785027 /nfs/dbraw/zinc/78/50/27/712785027.db2.gz BZQLMEKTMDCAIO-MGPQQGTHSA-N 2 0 242.407 2.264 20 0 BEADRP C[C@H]([NH2+]CC1(C)CC(F)(F)C1)[C@@H]1CCC[NH2+]1 ZINC000720899253 712875473 /nfs/dbraw/zinc/87/54/73/712875473.db2.gz GKMNSUCWCFSUHQ-UWVGGRQHSA-N 2 0 232.318 2.152 20 0 BEADRP CCC(CC)C[N@@H+]1CCC[C@@H]2[NH2+]CC[C@@H]21 ZINC000720905483 712876955 /nfs/dbraw/zinc/87/69/55/712876955.db2.gz YVLJQBCAOGWBMU-STQMWFEESA-N 2 0 210.365 2.249 20 0 BEADRP C[NH+]1CCC(C[NH2+]C2(C)CC(F)(F)C2)CC1 ZINC000720950912 712881948 /nfs/dbraw/zinc/88/19/48/712881948.db2.gz ZJVDHPBFRVMEBM-UHFFFAOYSA-N 2 0 232.318 2.106 20 0 BEADRP CC[C@@H]1[C@@H](C)CC[N@@H+]1C[C@@H]([NH3+])CC(F)F ZINC000384159238 710671861 /nfs/dbraw/zinc/67/18/61/710671861.db2.gz MZQJUPGTUNZOCV-LPEHRKFASA-N 2 0 220.307 2.089 20 0 BEADRP CCOc1ccc(C[N@@H+]2CC[C@H](CC[NH3+])C2)cc1 ZINC000723670968 710731660 /nfs/dbraw/zinc/73/16/60/710731660.db2.gz XCBMZJDWIOANPC-AWEZNQCLSA-N 2 0 248.370 2.256 20 0 BEADRP C[C@@H]1C[C@H](C)CC[N@H+](C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000723836553 710733057 /nfs/dbraw/zinc/73/30/57/710733057.db2.gz VOBBQGCBOGAWGR-LPWJVIDDSA-N 2 0 210.365 2.092 20 0 BEADRP CC[C@H]([NH2+][C@H](C)CC[NH+](C)C)[C@@H]1CCCOC1 ZINC000723957649 710734104 /nfs/dbraw/zinc/73/41/04/710734104.db2.gz DNRKOYKPJHREGM-MCIONIFRSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCC1(C)C)C1CC[NH+](C)CC1 ZINC000380540987 712901692 /nfs/dbraw/zinc/90/16/92/712901692.db2.gz HECBPOITASSMBH-DGCLKSJQSA-N 2 0 224.392 2.495 20 0 BEADRP CC(C)(C)[C@H]1CC[N@H+](C[C@@H]([NH3+])CC(F)F)C1 ZINC000380612377 712901889 /nfs/dbraw/zinc/90/18/89/712901889.db2.gz YMTHLMKMMAUMHQ-UWVGGRQHSA-N 2 0 234.334 2.337 20 0 BEADRP CC[C@@H]1C[N@H+](C[C@]2(C)CCC[NH2+]C2)CCS1 ZINC000133049465 710968129 /nfs/dbraw/zinc/96/81/29/710968129.db2.gz AJRWQTOQBFZSTE-CHWSQXEVSA-N 2 0 242.432 2.204 20 0 BEADRP CC(C)C(C)(C)C[NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2 ZINC000383308280 710980168 /nfs/dbraw/zinc/98/01/68/710980168.db2.gz NBHWITJQSAUHBO-YHQUGGNUSA-N 2 0 236.403 2.255 20 0 BEADRP C[C@H](CC(C)(C)C)[NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32 ZINC000384575865 710994228 /nfs/dbraw/zinc/99/42/28/710994228.db2.gz VYLJMQVGKONMCA-BBMNEWJDSA-N 2 0 236.403 2.397 20 0 BEADRP CSC(C)(C)CC[NH2+][C@H](C)Cn1ccnc1 ZINC000385334756 711011647 /nfs/dbraw/zinc/01/16/47/711011647.db2.gz VSLFODQJTNHGEG-LLVKDONJSA-N 2 0 241.404 2.393 20 0 BEADRP C[C@H]([N@H+](C)C[C@@H]1CC[C@H]([NH3+])C1)C1(C)CC1 ZINC000385417679 711012637 /nfs/dbraw/zinc/01/26/37/711012637.db2.gz ZURNTXRXZZPBGU-TUAOUCFPSA-N 2 0 210.365 2.234 20 0 BEADRP C[C@@H]([N@H+](C)C[C@@]1(C)CCC[NH2+]C1)C1(C)CC1 ZINC000385467755 711013549 /nfs/dbraw/zinc/01/35/49/711013549.db2.gz ORWSYBSOILDMJJ-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP CC[N@H+](CCC1CC1)C[C@]1(C)CCC[NH2+]C1 ZINC000385490485 711013599 /nfs/dbraw/zinc/01/35/99/711013599.db2.gz DZLNRYNRNUWMHW-CQSZACIVSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@@]2(C)CCC[NH2+]C2)[C@H]1C ZINC000380702821 712902601 /nfs/dbraw/zinc/90/26/01/712902601.db2.gz XSIZJJVEFUAALL-AGIUHOORSA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+][C@@H]1CC[NH2+]CC1(C)C ZINC000387667644 711044727 /nfs/dbraw/zinc/04/47/27/711044727.db2.gz JAJKJHMPTAPNNZ-GRYCIOLGSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@H]1C[N@H+](CCCC(C)(F)F)CC[C@H]1[NH3+] ZINC000390067679 711104058 /nfs/dbraw/zinc/10/40/58/711104058.db2.gz DIHZGKAVIFLIAG-VHSXEESVSA-N 2 0 220.307 2.091 20 0 BEADRP CNc1ccccc1C[NH2+]CCCC[NH+](C)C ZINC000390409772 711114955 /nfs/dbraw/zinc/11/49/55/711114955.db2.gz WFFZEROUYJCIFS-UHFFFAOYSA-N 2 0 235.375 2.160 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)C1CC[NH+](C)CC1)C1(C)CC1 ZINC000390516474 711122523 /nfs/dbraw/zinc/12/25/23/711122523.db2.gz DBRSWKKCMHEYBG-NWDGAFQWSA-N 2 0 224.392 2.495 20 0 BEADRP Cc1cc(C[NH2+]CCCC[NH+](C)C)c(C)o1 ZINC000390529890 711123789 /nfs/dbraw/zinc/12/37/89/711123789.db2.gz ICWDMKAQDKZTKP-UHFFFAOYSA-N 2 0 224.348 2.328 20 0 BEADRP CC(C)C[NH+]1CCC([NH2+][C@H]2CC[C@@H]2C)CC1 ZINC000390575061 711127169 /nfs/dbraw/zinc/12/71/69/711127169.db2.gz OFFLJHHPHXMFML-JSGCOSHPSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H]1CC[N@H+](CCCC2CC2)C[C@@H]1C[NH3+] ZINC000394668592 711196765 /nfs/dbraw/zinc/19/67/65/711196765.db2.gz RAZGDHCSDURKLG-AAEUAGOBSA-N 2 0 210.365 2.093 20 0 BEADRP CC(C)[C@@H]([NH3+])CC[N@H+](C)CCCC1CC1 ZINC000394631787 711196973 /nfs/dbraw/zinc/19/69/73/711196973.db2.gz VILRMDADNFIDQF-ZDUSSCGKSA-N 2 0 212.381 2.482 20 0 BEADRP C[C@@H]([NH2+]C/C=C\Cl)C1CC[NH+](C)CC1 ZINC000396500011 711222998 /nfs/dbraw/zinc/22/29/98/711222998.db2.gz VFNUJBQLXIAZJM-XICOKMJESA-N 2 0 216.756 2.059 20 0 BEADRP C[C@@H]([NH2+]Cc1ccc(CC[NH3+])cc1)C1CC1 ZINC000398003484 711398733 /nfs/dbraw/zinc/39/87/33/711398733.db2.gz XQXBRUBEFOBXTL-LLVKDONJSA-N 2 0 218.344 2.076 20 0 BEADRP CC[C@@H]1C[C@H](C)C[N@@H+]1CCC[NH2+]C1CC1 ZINC000399137196 711420865 /nfs/dbraw/zinc/42/08/65/711420865.db2.gz XPEFBDVWXYJPFC-WCQYABFASA-N 2 0 210.365 2.249 20 0 BEADRP CO[C@H](C[N@@H+]1CC[C@H](CC[NH3+])C1)c1ccccc1 ZINC000386019268 711020149 /nfs/dbraw/zinc/02/01/49/711020149.db2.gz WRTCWLMSDQTGSF-DZGCQCFKSA-N 2 0 248.370 2.045 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H]2CC3CCC2CC3)C1 ZINC000394214668 711188929 /nfs/dbraw/zinc/18/89/29/711188929.db2.gz CZJMYWCOHGBGQE-OOJKYFRXSA-N 2 0 236.403 2.497 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](CCCC3CC3)C[C@H]21 ZINC000394594343 711194918 /nfs/dbraw/zinc/19/49/18/711194918.db2.gz GCIREFZQGXBDIT-MGPQQGTHSA-N 2 0 222.376 2.236 20 0 BEADRP CC(C)C[C@H]1CCC[N@@H+]1C[C@@H]1C[NH2+]C[C@H]1C ZINC000396756550 711368340 /nfs/dbraw/zinc/36/83/40/711368340.db2.gz BVEFMKYVMQDHSS-HZSPNIEDSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1C[C@@H](C)[N@H+](CCCC2CC2)C[C@H]1C[NH3+] ZINC000397476387 711384004 /nfs/dbraw/zinc/38/40/04/711384004.db2.gz HFQJAQPCDHNTBE-YRGRVCCFSA-N 2 0 224.392 2.482 20 0 BEADRP CC(C)=CCC[NH2+]CC1CC[NH+](C)CC1 ZINC000397893128 711395432 /nfs/dbraw/zinc/39/54/32/711395432.db2.gz TWQLENRRFNJEFZ-UHFFFAOYSA-N 2 0 210.365 2.274 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000723052753 711497691 /nfs/dbraw/zinc/49/76/91/711497691.db2.gz SIUHCKFEBNJJQE-OLZOCXBDSA-N 2 0 222.376 2.108 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCCC2(CC2)C1)C[NH+](C)C ZINC000723560989 711517681 /nfs/dbraw/zinc/51/76/81/711517681.db2.gz VLBUHXOTRUCWKF-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP CCc1ccccc1C[N@@H+]1CC[C@H](CC[NH3+])C1 ZINC000723670059 711533381 /nfs/dbraw/zinc/53/33/81/711533381.db2.gz NUBIUVPKHFTHBR-ZDUSSCGKSA-N 2 0 232.371 2.420 20 0 BEADRP Cc1cc(C)nc(C[NH+]2CCC([C@H](C)[NH3+])CC2)c1 ZINC000723845990 711539066 /nfs/dbraw/zinc/53/90/66/711539066.db2.gz MWFBWGUNGSMUDF-ZDUSSCGKSA-N 2 0 247.386 2.258 20 0 BEADRP C[C@H]([NH2+]CCC1CC=CC1)[C@H]1CCC[NH2+]1 ZINC000724127734 711562921 /nfs/dbraw/zinc/56/29/21/711562921.db2.gz ARGAEWGESUKRQY-WCQYABFASA-N 2 0 208.349 2.073 20 0 BEADRP CS[C@H]1CCC[C@H]([NH2+]CCC[NH+](C)C)C1 ZINC000235219241 711648628 /nfs/dbraw/zinc/64/86/28/711648628.db2.gz MGLKCEMYSKLBBO-RYUDHWBXSA-N 2 0 230.421 2.202 20 0 BEADRP CC(F)(F)CCC[N@@H+]1CC[C@H](CC[NH3+])C1 ZINC000718639107 711662726 /nfs/dbraw/zinc/66/27/26/711662726.db2.gz ASUVOQXFKKKWMV-JTQLQIEISA-N 2 0 220.307 2.093 20 0 BEADRP CC[N@H+](C)C[C@H]1CCN(C/C=C/Cl)C1 ZINC000177838640 711672628 /nfs/dbraw/zinc/67/26/28/711672628.db2.gz RBEMUYUFAXJCER-DUMNWFOQSA-N 2 0 216.756 2.013 20 0 BEADRP C[C@@H]1CC[C@@H](C)C1[NH2+]CCCC[NH+](C)C ZINC000380189194 711679440 /nfs/dbraw/zinc/67/94/40/711679440.db2.gz HDHSUDCJDKSGAM-VXGBXAGGSA-N 2 0 212.381 2.352 20 0 BEADRP CSC(C)(C)C[NH2+][C@@H](C)[C@H]1CCCC[NH2+]1 ZINC000395092429 711692397 /nfs/dbraw/zinc/69/23/97/711692397.db2.gz VLUCRZWPHOXDFN-WDEREUQCSA-N 2 0 230.421 2.248 20 0 BEADRP CC1(C)C[C@@H]([NH3+])C[C@H]([NH2+]CC2CC=CC2)C1 ZINC000925722744 711726115 /nfs/dbraw/zinc/72/61/15/711726115.db2.gz KRDGDYDNMBQKHD-STQMWFEESA-N 2 0 222.376 2.448 20 0 BEADRP [NH3+]C1C[C@H]2CCC[C@@H](C1)C2[NH2+]CC1CC=CC1 ZINC000925724039 711727416 /nfs/dbraw/zinc/72/74/16/711727416.db2.gz VUFLCDKILZJTEC-DGKWVBSXSA-N 2 0 234.387 2.448 20 0 BEADRP CC[C@@]1(C)CC[N@H+](C[C@]2(C)CCC[NH2+]C2)C1 ZINC000399452880 711747339 /nfs/dbraw/zinc/74/73/39/711747339.db2.gz IVVJIJRYMFYLDA-UONOGXRCSA-N 2 0 224.392 2.498 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]C[C@]12C[C@H]1CCC2 ZINC000925880319 711762162 /nfs/dbraw/zinc/76/21/62/711762162.db2.gz JEIZWHNQPZDPRS-SYQHCUMBSA-N 2 0 222.376 2.426 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]C2CC(SC)C2)[C@H](C)C1 ZINC000925170339 711786505 /nfs/dbraw/zinc/78/65/05/711786505.db2.gz MPAZCTVLTBBWCJ-IKWCTNDRSA-N 2 0 242.432 2.200 20 0 BEADRP C[C@@H]1NCCC[C@H]1[NH2+]C[C@H]1CC=CCC1 ZINC000396644421 711795561 /nfs/dbraw/zinc/79/55/61/711795561.db2.gz BVFVVPSUNLZGTG-RWMBFGLXSA-N 2 0 208.349 2.073 20 0 BEADRP CSC(C)(C)C[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000159987183 711805144 /nfs/dbraw/zinc/80/51/44/711805144.db2.gz FIDBJERYUMMKLC-VXGBXAGGSA-N 2 0 242.432 2.344 20 0 BEADRP C#CC[NH+]1CCC(C[NH+]2CCCCCC2)CC1 ZINC000045944269 711828015 /nfs/dbraw/zinc/82/80/15/711828015.db2.gz CPGADHHSPWGVBV-UHFFFAOYSA-N 2 0 234.387 2.208 20 0 BEADRP CSC(C)(C)C[NH2+][C@H]1CCCC[C@H]1C[NH3+] ZINC000229083533 711837473 /nfs/dbraw/zinc/83/74/73/711837473.db2.gz DKWQBQAFSMAKRA-QWRGUYRKSA-N 2 0 230.421 2.235 20 0 BEADRP C[NH+]1CCC(C[NH2+]CCC2CCC2)CC1 ZINC000229082298 711837496 /nfs/dbraw/zinc/83/74/96/711837496.db2.gz FYSPBKMLCZTGGF-UHFFFAOYSA-N 2 0 210.365 2.108 20 0 BEADRP CC[C@H]1CCC[N@H+](C[C@H]2CCCC[NH2+]C2)C1 ZINC000700239997 711987988 /nfs/dbraw/zinc/98/79/88/711987988.db2.gz ZLVFKYMPDKSVLD-KBPBESRZSA-N 2 0 224.392 2.498 20 0 BEADRP CSCC[C@@H](C)[N@H+](C)C[C@H]1CCCC[NH2+]C1 ZINC000700402472 711992227 /nfs/dbraw/zinc/99/22/27/711992227.db2.gz CFZNAAFXTJZHGK-OLZOCXBDSA-N 2 0 244.448 2.450 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)C1(Cl)CC1 ZINC000700807810 712006677 /nfs/dbraw/zinc/00/66/77/712006677.db2.gz DTQDNPZOADJTOQ-NWDGAFQWSA-N 2 0 244.810 2.468 20 0 BEADRP C[C@H]([NH2+]C[C@@]1(C)CC1(C)C)[C@@H]1CCC[NH2+]1 ZINC000701943244 712032806 /nfs/dbraw/zinc/03/28/06/712032806.db2.gz ITSYDYRSSIATMW-GMXVVIOVSA-N 2 0 210.365 2.153 20 0 BEADRP C[NH+]1CCC(C[NH2+]C[C@]2(C)CC2(C)C)CC1 ZINC000701983490 712034395 /nfs/dbraw/zinc/03/43/95/712034395.db2.gz VZTBVIPGLNTDLI-AWEZNQCLSA-N 2 0 224.392 2.354 20 0 BEADRP CC1(C)C[C@]1(C)C[NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2 ZINC000701986359 712035131 /nfs/dbraw/zinc/03/51/31/712035131.db2.gz OBNIBRQJMDHROC-QBOXMOKDSA-N 2 0 234.387 2.009 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)C2(Cl)CC2)C1 ZINC000702253973 712041859 /nfs/dbraw/zinc/04/18/59/712041859.db2.gz BGIQPIHZUGOVRB-MNOVXSKESA-N 2 0 230.783 2.078 20 0 BEADRP C[C@@H]1CCCC[N@H+](C[C@H]2CCCC[NH2+]C2)C1 ZINC000703211904 712068604 /nfs/dbraw/zinc/06/86/04/712068604.db2.gz HRWDVYVROHUVLB-KGLIPLIRSA-N 2 0 224.392 2.498 20 0 BEADRP CC(C)[C@@H]1CCCC[N@@H+]1C[C@H]1C[C@@H]([NH3+])C1 ZINC000703487092 712076776 /nfs/dbraw/zinc/07/67/76/712076776.db2.gz JHDNJNWIOFSCOQ-XQQFMLRXSA-N 2 0 210.365 2.234 20 0 BEADRP C[C@H](C[N@@H+]1C[C@@H]2C[NH2+]C[C@]2(C)C1)C(C)(C)C ZINC000703618901 712081244 /nfs/dbraw/zinc/08/12/44/712081244.db2.gz IOVGIGLONHPAAA-MBNYWOFBSA-N 2 0 224.392 2.210 20 0 BEADRP CC[NH+](CC)CCC[NH2+]C1CCC(C)(O)CC1 ZINC000705444512 712131308 /nfs/dbraw/zinc/13/13/08/712131308.db2.gz NUSHJVNRCARGPZ-UHFFFAOYSA-N 2 0 242.407 2.002 20 0 BEADRP C([NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2)[C@H]1CCCC12CC2 ZINC000706262961 712142756 /nfs/dbraw/zinc/14/27/56/712142756.db2.gz ITIZEWDWAICLRD-UJOWSUJOSA-N 2 0 246.398 2.153 20 0 BEADRP C[C@@H](CC[NH2+][C@H]1CCCC12CC2)[NH+](C)C ZINC000706614982 712151328 /nfs/dbraw/zinc/15/13/28/712151328.db2.gz MSQHNQAZLMHSKW-RYUDHWBXSA-N 2 0 210.365 2.249 20 0 BEADRP CSC1CC([NH2+][C@H]2CCN(C(C)(C)C)C2)C1 ZINC000706931822 712161570 /nfs/dbraw/zinc/16/15/70/712161570.db2.gz UBUKGMQJPBJFDX-UNXYVOJBSA-N 2 0 242.432 2.343 20 0 BEADRP CC(C)[C@@H]1C[N@H+](CCC[NH2+]C2CC2)CCS1 ZINC000707165774 712166523 /nfs/dbraw/zinc/16/65/23/712166523.db2.gz DHNKKMKOMJGEKV-ZDUSSCGKSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H](C[N@@H+]1CCCO[C@@H](C[NH3+])C1)CC(C)(C)C ZINC000709179881 712204059 /nfs/dbraw/zinc/20/40/59/712204059.db2.gz VCHZTLBBVNVQNA-OLZOCXBDSA-N 2 0 242.407 2.108 20 0 BEADRP C[C@H](C[NH+]1CCC([NH3+])CC1)CC(C)(C)C ZINC000709102881 712208840 /nfs/dbraw/zinc/20/88/40/712208840.db2.gz NIUCDMZKSKONHF-NSHDSACASA-N 2 0 212.381 2.482 20 0 BEADRP C[C@@H]1[C@H]2CC[C@@H](C[C@H]1[NH2+]C1CCSCC1)[NH2+]2 ZINC000709283360 712218956 /nfs/dbraw/zinc/21/89/56/712218956.db2.gz MFMCFPQNTDPJOT-GWNIPJSYSA-N 2 0 240.416 2.001 20 0 BEADRP CC1(C)C[C@@]1(C)C[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000709287394 712219439 /nfs/dbraw/zinc/21/94/39/712219439.db2.gz LBEULNSQFSAVLS-BRZZBQFESA-N 2 0 222.376 2.295 20 0 BEADRP C[C@@H]1[C@H]2CC[C@@H](C[C@H]1[NH2+][C@H]1CC13CCCC3)[NH2+]2 ZINC000709389787 712220792 /nfs/dbraw/zinc/22/07/92/712220792.db2.gz SPWJAIZIYQRGNT-ITGHMWBKSA-N 2 0 234.387 2.438 20 0 BEADRP CSCC[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000709467162 712222355 /nfs/dbraw/zinc/22/23/55/712222355.db2.gz ZXMKCQVSUVGBAH-WSMDXJOWSA-N 2 0 228.405 2.001 20 0 BEADRP CSC(C)(C)C[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000709456644 712222444 /nfs/dbraw/zinc/22/24/44/712222444.db2.gz KPJSBLXKCJCTPG-ZACCUICWSA-N 2 0 228.405 2.001 20 0 BEADRP [NH3+][C@@H]1C[C@H]2C[C@@H](C1)[N@H+](CC1CCCCC1)C2 ZINC000709824568 712228815 /nfs/dbraw/zinc/22/88/15/712228815.db2.gz FKWDJNUOXWHOMJ-MJBXVCDLSA-N 2 0 222.376 2.378 20 0 BEADRP Cc1ccc(C[N@H+](C)CCCCCC[NH3+])cn1 ZINC000710778931 712256423 /nfs/dbraw/zinc/25/64/23/712256423.db2.gz DEFSCGMYNKBONP-UHFFFAOYSA-N 2 0 235.375 2.341 20 0 BEADRP C[N@H+](CCCCCC[NH3+])CC1CC=CC1 ZINC000710802835 712257509 /nfs/dbraw/zinc/25/75/09/712257509.db2.gz BVPSRWYRUODAGP-UHFFFAOYSA-N 2 0 210.365 2.404 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H]2C[C@@H]3CC[C@@H](C3)C2)C1 ZINC000711205506 712289309 /nfs/dbraw/zinc/28/93/09/712289309.db2.gz YJMPRSZAUJJEDN-XGUBFFRZSA-N 2 0 236.403 2.497 20 0 BEADRP CC1(C)CC[C@H](C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)OC1 ZINC000711387631 712296743 /nfs/dbraw/zinc/29/67/43/712296743.db2.gz CSMMDWGNUWCJNN-JHJVBQTASA-N 2 0 240.391 2.051 20 0 BEADRP FC[C@H]1CCC[N@H+](CC[C@@H]2CCC[NH2+]C2)C1 ZINC000711444811 712300989 /nfs/dbraw/zinc/30/09/89/712300989.db2.gz RBAGMAGMPGNHIT-QWHCGFSZSA-N 2 0 228.355 2.058 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2CCC[C@H](CF)C2)CC[NH2+]1 ZINC000711463303 712304752 /nfs/dbraw/zinc/30/47/52/712304752.db2.gz VTLNKBUPHFJMJA-JHJVBQTASA-N 2 0 228.355 2.056 20 0 BEADRP C1=C[C@H](C[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)CC1 ZINC000711719514 712319602 /nfs/dbraw/zinc/31/96/02/712319602.db2.gz NLZVNXMHPCJCER-MELADBBJSA-N 2 0 220.360 2.169 20 0 BEADRP [NH3+]CC[C@@H]1CC[N@@H+]([C@H]2C[C@H]2c2ccccc2)C1 ZINC000923480396 712335118 /nfs/dbraw/zinc/33/51/18/712335118.db2.gz YATFFCCWMYOXCQ-SNPRPXQTSA-N 2 0 230.355 2.213 20 0 BEADRP CC1(C)[C@@H]2C[N@@H+](CCC3C[C@H]4CC[C@@H](C3)[NH2+]4)C[C@@H]21 ZINC000379558418 712388020 /nfs/dbraw/zinc/38/80/20/712388020.db2.gz LEMROXPLIKZJLC-LFAHVKQVSA-N 2 0 248.414 2.495 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+]C[C@H]1CCCCC[NH2+]1 ZINC000379789843 712399263 /nfs/dbraw/zinc/39/92/63/712399263.db2.gz IXOQCAZXQPKGDP-NEPJUHHUSA-N 2 0 210.365 2.297 20 0 BEADRP CC[N@@H+]1CC[C@H]1CNc1nc2ccccc2[nH]1 ZINC000712581130 712433743 /nfs/dbraw/zinc/43/37/43/712433743.db2.gz UBNWIVBNGXFFFZ-JTQLQIEISA-N 2 0 230.315 2.069 20 0 BEADRP C(C[C@@H]1C[C@H]1C1CC1)[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000712763800 712449354 /nfs/dbraw/zinc/44/93/54/712449354.db2.gz LBNAIDGTHYCZSR-CWVYHPPDSA-N 2 0 248.414 2.400 20 0 BEADRP C=C/C=C\CC[N@H+]1CCCC[C@H]1CC[NH3+] ZINC000713734695 712470420 /nfs/dbraw/zinc/47/04/20/712470420.db2.gz LGWNHINBKOSNGU-SCOBNMCVSA-N 2 0 208.349 2.322 20 0 BEADRP C=C/C=C\CC[N@H+]1C[C@@H]2CCC[C@H]([NH3+])[C@@H]2C1 ZINC000713741422 712471350 /nfs/dbraw/zinc/47/13/50/712471350.db2.gz UNIIIYURTYLSOC-KVOUUQTQSA-N 2 0 220.360 2.178 20 0 BEADRP C=C/C=C\CC[NH+]1CCC(CC[NH2+]C)CC1 ZINC000713741579 712471404 /nfs/dbraw/zinc/47/14/04/712471404.db2.gz WAZPDGGSZOFOOE-PLNGDYQASA-N 2 0 222.376 2.440 20 0 BEADRP C[C@H]([NH3+])[C@H]1CC[N@H+](C[C@@H]2CCCC(C)(C)O2)C1 ZINC000714375369 712484682 /nfs/dbraw/zinc/48/46/82/712484682.db2.gz UFDZXQYYZGCQHZ-AVGNSLFASA-N 2 0 240.391 2.003 20 0 BEADRP CC(C)(C[NH3+])C1CC[NH+](CCCF)CC1 ZINC000714410147 712485803 /nfs/dbraw/zinc/48/58/03/712485803.db2.gz KAADAHLWSMHXAU-UHFFFAOYSA-N 2 0 216.344 2.043 20 0 BEADRP C(C[N@@H+]1CC[C@]2(C1)CCC[NH2+]C2)[C@@H]1C[C@H]1C1CC1 ZINC000714811450 712498185 /nfs/dbraw/zinc/49/81/85/712498185.db2.gz NBIFHYLEVQHTMT-OWCLPIDISA-N 2 0 248.414 2.498 20 0 BEADRP [NH3+]CC[C@H]1CC[N@H+](CC[C@@H]2C[C@H]2C2CC2)C1 ZINC000714881702 712498985 /nfs/dbraw/zinc/49/89/85/712498985.db2.gz YTLSNHHSWTYGFA-YUTCNCBUSA-N 2 0 222.376 2.093 20 0 BEADRP CC1([NH3+])CC[NH+](CC[C@@H]2C[C@H]2C2CC2)CC1 ZINC000714826662 712500918 /nfs/dbraw/zinc/50/09/18/712500918.db2.gz AAGVVLLOWNNWTI-OLZOCXBDSA-N 2 0 222.376 2.236 20 0 BEADRP C[C@@H]([NH3+])[C@H]1CCC[N@H+](CC[C@@H]2C[C@H]2C2CC2)C1 ZINC000714835776 712501297 /nfs/dbraw/zinc/50/12/97/712501297.db2.gz YYAJOPGHISXIEK-RZFFKMDDSA-N 2 0 236.403 2.482 20 0 BEADRP C(CC1CC1)CN1CCC[C@H]2C[NH2+]CC[C@@H]21 ZINC000714998308 712503595 /nfs/dbraw/zinc/50/35/95/712503595.db2.gz FYCLRGAEUKYYSV-KBPBESRZSA-N 2 0 222.376 2.251 20 0 BEADRP C[NH+](C)C1(C)CCC([NH2+]Cc2ccncc2)CC1 ZINC000715509565 712524269 /nfs/dbraw/zinc/52/42/69/712524269.db2.gz NATHGYSBPUWKGG-UHFFFAOYSA-N 2 0 247.386 2.434 20 0 BEADRP Cn1cccc1C[NH2+]C1CCC(C)([NH+](C)C)CC1 ZINC000715508691 712524270 /nfs/dbraw/zinc/52/42/70/712524270.db2.gz JWMRVEVBCVIJQX-UHFFFAOYSA-N 2 0 249.402 2.378 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]CC[C@H]1CCCS1 ZINC000715600100 712527708 /nfs/dbraw/zinc/52/77/08/712527708.db2.gz ICKMLSBPIRKXSS-XQQFMLRXSA-N 2 0 242.432 2.379 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CC[C@H]2CCCS2)CC[N@@H+]1C ZINC000715603379 712527802 /nfs/dbraw/zinc/52/78/02/712527802.db2.gz PZIIYVAFCABIHT-FRRDWIJNSA-N 2 0 242.432 2.344 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCCS1)[C@@H]1CCC[NH2+]1 ZINC000715656543 712529665 /nfs/dbraw/zinc/52/96/65/712529665.db2.gz HNSOZSVWJBYUHH-TUAOUCFPSA-N 2 0 228.405 2.002 20 0 BEADRP C(CCC1CC1)C[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000716359768 712556576 /nfs/dbraw/zinc/55/65/76/712556576.db2.gz YTYXKYVVVWBHRI-PBWFPOADSA-N 2 0 222.376 2.439 20 0 BEADRP C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C[NH2+][C@H]1CCCC[C@@H]1C[NH3+] ZINC000716582883 712564259 /nfs/dbraw/zinc/56/42/59/712564259.db2.gz LQJUIPGNIIESLH-LACSLYJWSA-N 2 0 236.403 2.386 20 0 BEADRP C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000716528146 712567296 /nfs/dbraw/zinc/56/72/96/712567296.db2.gz CMXWUNUGCUQNPL-DEBNCQAFSA-N 2 0 248.414 2.256 20 0 BEADRP C[C@@H]1C[C@@H]1[C@H]1C[C@@H]1C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000716622806 712568181 /nfs/dbraw/zinc/56/81/81/712568181.db2.gz JMZLDYSGVHZZMN-GYUQODATSA-N 2 0 248.414 2.493 20 0 BEADRP C[N@H+](CCCF)Cc1cc2c(s1)CC[NH2+]C2 ZINC000716801050 712575055 /nfs/dbraw/zinc/57/50/55/712575055.db2.gz PIJDLFHQKCRSSI-UHFFFAOYSA-N 2 0 242.363 2.185 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@@H]2CC[C@@H]2C)CC1 ZINC000380034509 712683485 /nfs/dbraw/zinc/68/34/85/712683485.db2.gz RKILNQSHPJWLOO-WCQYABFASA-N 2 0 210.365 2.106 20 0 BEADRP CC(F)(F)CCC[NH+]1CCC(C)([NH3+])CC1 ZINC000718633194 712773748 /nfs/dbraw/zinc/77/37/48/712773748.db2.gz MFNRJXCHOAWRIX-UHFFFAOYSA-N 2 0 220.307 2.235 20 0 BEADRP CC(F)(F)CCC[N@@H+]1CC[C@@]2(CC[NH2+]C2)C1 ZINC000718569699 712775072 /nfs/dbraw/zinc/77/50/72/712775072.db2.gz GNWDQVKQDFBDLW-GFCCVEGCSA-N 2 0 232.318 2.107 20 0 BEADRP CC[C@@H](c1ccccc1)[N@@H+]1CCC[NH2+]CC1 ZINC000038086988 712806808 /nfs/dbraw/zinc/80/68/08/712806808.db2.gz FAAAFCDOFVYSCA-AWEZNQCLSA-N 2 0 218.344 2.433 20 0 BEADRP c1cnc2cccc(C[NH2+]C3CC[NH2+]CC3)c2c1 ZINC000720474112 712845469 /nfs/dbraw/zinc/84/54/69/712845469.db2.gz VGKWRGHJTFAREZ-UHFFFAOYSA-N 2 0 241.338 2.076 20 0 BEADRP CC[C@H](C)C[N@H+]1C[C@H](C(F)(F)F)[C@@H](C[NH3+])C1 ZINC000720805286 712867220 /nfs/dbraw/zinc/86/72/20/712867220.db2.gz LXPXVKPHNYVQSO-GUBZILKMSA-N 2 0 238.297 2.102 20 0 BEADRP CC[C@H](C)C[N@@H+]1C[C@@H](C[NH3+])[C@@H](C(F)(F)F)C1 ZINC000720805285 712867395 /nfs/dbraw/zinc/86/73/95/712867395.db2.gz LXPXVKPHNYVQSO-AEJSXWLSSA-N 2 0 238.297 2.102 20 0 BEADRP CC1(C[NH2+][C@H]2C[C@H]([NH3+])C23CCC3)CC(F)(F)C1 ZINC000720900588 712875255 /nfs/dbraw/zinc/87/52/55/712875255.db2.gz ODXNAWZYZVVONG-UWVGGRQHSA-N 2 0 244.329 2.281 20 0 BEADRP CC1(C[NH2+][C@H]2CCC[C@H]([NH3+])C2)CC(F)(F)C1 ZINC000720914195 712878022 /nfs/dbraw/zinc/87/80/22/712878022.db2.gz ZURGAUDYIOXEOR-UWVGGRQHSA-N 2 0 232.318 2.281 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CC2(C)CC(F)(F)C2)CC[N@@H+]1C ZINC000720934291 712880258 /nfs/dbraw/zinc/88/02/58/712880258.db2.gz FUVCJNYCPMLIEE-WDEREUQCSA-N 2 0 246.345 2.494 20 0 BEADRP CC[C@@H](C)[C@H](C)[NH2+]CC[C@@H]1C[NH2+]C[C@H]1C ZINC000721120712 712892134 /nfs/dbraw/zinc/89/21/34/712892134.db2.gz JEOYRDSGIBWUIK-FVCCEPFGSA-N 2 0 212.381 2.256 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH+]2C[C@H]3CCC[C@@H]3C2)C1 ZINC001208603361 957095051 /nfs/dbraw/zinc/09/50/51/957095051.db2.gz BYPRICAZJBJWSX-BFHYXJOUSA-N 2 0 222.376 2.060 20 0 BEADRP Cc1c[nH+]c(N2CCC(C[NH+](C)C)CC2)cc1C ZINC001165045711 721949755 /nfs/dbraw/zinc/94/97/55/721949755.db2.gz XENIITRTXXWUDE-UHFFFAOYSA-N 2 0 247.386 2.476 20 0 BEADRP C[C@@H]1CCC[C@H]([N@H+](C)C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000693579977 958869775 /nfs/dbraw/zinc/86/97/75/958869775.db2.gz RJVFKKJWQKFCJX-NDBYEHHHSA-N 2 0 210.365 2.234 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]CCC2SCCS2)C1 ZINC000693778508 959277316 /nfs/dbraw/zinc/27/73/16/959277316.db2.gz YYJDOKOXQCWLEL-VHSXEESVSA-N 2 0 246.445 2.042 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CCC1SCCS1 ZINC000693778676 959277334 /nfs/dbraw/zinc/27/73/34/959277334.db2.gz ZWSMNPIOEIOLRI-JTQLQIEISA-N 2 0 248.461 2.290 20 0 BEADRP Cc1ccc(C[N@@H+](C)C[C@@H]2C[NH2+]C[C@H]2C)s1 ZINC000693956624 959614423 /nfs/dbraw/zinc/61/44/23/959614423.db2.gz LFOOXEWIKLAFJY-PWSUYJOCSA-N 2 0 238.400 2.344 20 0 BEADRP CO[C@H]1CCC[C@H]1[NH2+]CCC[NH+]1CCCCC1 ZINC000695446393 960258196 /nfs/dbraw/zinc/25/81/96/960258196.db2.gz BFEHGFQNNKRIAJ-KGLIPLIRSA-N 2 0 240.391 2.020 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)C2(Cl)CC2)C1 ZINC000695635916 960310152 /nfs/dbraw/zinc/31/01/52/960310152.db2.gz DVDWPICQYNDOAZ-NWDGAFQWSA-N 2 0 244.810 2.468 20 0 BEADRP C=Cc1cccc(NC(=[NH2+])SCC[NH3+])c1 ZINC001167914454 961183360 /nfs/dbraw/zinc/18/33/60/961183360.db2.gz LOWBPFJFBAVCKZ-UHFFFAOYSA-N 2 0 221.329 2.368 20 0 BEADRP C[C@@H](CC[NH2+][C@@H]1CCCC1(C)C)[NH+](C)C ZINC000697877970 964604977 /nfs/dbraw/zinc/60/49/77/964604977.db2.gz GMVAESHAZPAGQG-NWDGAFQWSA-N 2 0 212.381 2.495 20 0 BEADRP CCC[N@H+](C)C1CC[NH+](CC2CC2)CC1 ZINC001168371400 964938343 /nfs/dbraw/zinc/93/83/43/964938343.db2.gz KWVBUFJJNRTCLS-UHFFFAOYSA-N 2 0 210.365 2.203 20 0 BEADRP C[C@@H]1C[C@@H](C)[N@H+](C[C@]2(C)CCC[NH2+]C2)C1 ZINC000157967281 965239685 /nfs/dbraw/zinc/23/96/85/965239685.db2.gz SAQMVCPTEJXAAY-JHJVBQTASA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)[C@@H]1C[C@H]1[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC001204128145 966896506 /nfs/dbraw/zinc/89/65/06/966896506.db2.gz IXJUVWXWBVTONI-YIYPIFLZSA-N 2 0 222.376 2.247 20 0 BEADRP [NH3+]CC1CC[NH+](Cc2ccc(Cl)o2)CC1 ZINC001205054161 967305920 /nfs/dbraw/zinc/30/59/20/967305920.db2.gz XYMMWOOTMMTPPV-UHFFFAOYSA-N 2 0 228.723 2.104 20 0 BEADRP C[C@@]1([NH3+])CCC[N@H+](CCC(F)(F)F)CC1 ZINC001205254802 967446120 /nfs/dbraw/zinc/44/61/20/967446120.db2.gz BMIHDERNEKAGOA-SECBINFHSA-N 2 0 224.270 2.142 20 0 BEADRP CCCCC[C@@H](C)[NH2+]C[C@H](C)C[NH2+]C ZINC000086070525 1165898593 /nfs/dbraw/zinc/89/85/93/1165898593.db2.gz DKKIACASKXZLFA-VXGBXAGGSA-N 2 0 200.370 2.400 20 0 BEADRP CCCCC[C@@H](C)[NH2+]C[C@@H](C)C[NH2+]C ZINC000086070521 1165899497 /nfs/dbraw/zinc/89/94/97/1165899497.db2.gz DKKIACASKXZLFA-NWDGAFQWSA-N 2 0 200.370 2.400 20 0 BEADRP COC(C)(C)CC[N@@H+]1CCC[C@H](C[NH3+])[C@@H](C)C1 ZINC001205981915 967921239 /nfs/dbraw/zinc/92/12/39/967921239.db2.gz JBPQENOEYBIOTN-QWHCGFSZSA-N 2 0 242.407 2.108 20 0 BEADRP C[C@]1(C[NH3+])CCC[N@H+](Cc2cnsc2)CC1 ZINC001206318537 968226074 /nfs/dbraw/zinc/22/60/74/968226074.db2.gz QYXPWAHZTNCHAL-LBPRGKRZSA-N 2 0 239.388 2.094 20 0 BEADRP C[N@@H+]1CC[C@H](C[NH2+][C@@H]2CCCC(C)(C)C2)C1 ZINC000070628981 1165940594 /nfs/dbraw/zinc/94/05/94/1165940594.db2.gz ROPAHKDLQPTULG-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP CCCC(CCC)[N@@H+]1CC[C@H](C[NH2+]C)C1 ZINC000070798673 1165952959 /nfs/dbraw/zinc/95/29/59/1165952959.db2.gz KUGBGCIBSVTUMC-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP C[NH2+]CC[C@H](C)[N@H+](C)Cc1ccc(C)cc1 ZINC000052424630 1165979280 /nfs/dbraw/zinc/97/92/80/1165979280.db2.gz YKIJJUSGTAMOMV-ZDUSSCGKSA-N 2 0 220.360 2.425 20 0 BEADRP CO[C@H]1CC[N@H+](CC(C)(C)C[NH+](C)C)[C@@H](C)C1 ZINC001207284147 968701746 /nfs/dbraw/zinc/70/17/46/968701746.db2.gz KIERBJURAMPPAC-STQMWFEESA-N 2 0 242.407 2.074 20 0 BEADRP C[NH+](C)CC(C)(C)C[N@@H+]1CCC[C@H](F)CC1 ZINC001207275223 968707445 /nfs/dbraw/zinc/70/74/45/968707445.db2.gz KHERJZPFYGQGIC-LBPRGKRZSA-N 2 0 230.371 2.398 20 0 BEADRP CC(C)O[C@H]1CC[N@H+](CC(C)(C)C[NH+](C)C)C1 ZINC001207282904 968718140 /nfs/dbraw/zinc/71/81/40/968718140.db2.gz QMJMXAJPUANYCY-ZDUSSCGKSA-N 2 0 242.407 2.074 20 0 BEADRP CC[C@H]1CCC[N@@H+]1CC(C)(C)C[NH+](C)C ZINC001207286406 968718701 /nfs/dbraw/zinc/71/87/01/968718701.db2.gz RANHSUUFQIQTLV-LBPRGKRZSA-N 2 0 212.381 2.449 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2CC3CCC2CC3)CC1 ZINC001207398681 968751683 /nfs/dbraw/zinc/75/16/83/968751683.db2.gz IBGHJSSSHMMGEK-UHFFFAOYSA-N 2 0 222.376 2.203 20 0 BEADRP C(CC[NH+]1CCCC1)C[NH2+]C1CCCC1 ZINC000126169035 1166125599 /nfs/dbraw/zinc/12/55/99/1166125599.db2.gz VHZKVGZEWBZTDH-UHFFFAOYSA-N 2 0 210.365 2.395 20 0 BEADRP CCC[C@@H](O)C[NH2+][C@H](C)CCC[NH+](CC)CC ZINC001252801008 968984051 /nfs/dbraw/zinc/98/40/51/968984051.db2.gz SFFNUVSRVUWLTL-ZIAGYGMSSA-N 2 0 244.423 2.248 20 0 BEADRP C[C@@H]1C[C@@H](F)C[N@@H+]1CC1(C)CC[NH+](C)CC1 ZINC001208108605 969003600 /nfs/dbraw/zinc/00/36/00/969003600.db2.gz WRRMUQWUDUQTGM-VXGBXAGGSA-N 2 0 228.355 2.151 20 0 BEADRP C[NH+]1CCC(C)(C[N@@H+]2CCC3(CC3)C2)CC1 ZINC001208108036 969004148 /nfs/dbraw/zinc/00/41/48/969004148.db2.gz NRHILHHXJDXOAX-UHFFFAOYSA-N 2 0 222.376 2.204 20 0 BEADRP C[N@@H+]1CCC2(C1)CCN(c1cc[nH+]cc1)CC2 ZINC000224247393 1166221498 /nfs/dbraw/zinc/22/14/98/1166221498.db2.gz LKQMSYQRZVGGPM-UHFFFAOYSA-N 2 0 231.343 2.004 20 0 BEADRP CSCC[C@@H](C)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000228873549 1166224052 /nfs/dbraw/zinc/22/40/52/1166224052.db2.gz MUPGEYUWBCQWLZ-VXGBXAGGSA-N 2 0 230.421 2.059 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2C[C@@H](C)C[C@H]2CF)CC1 ZINC001208593522 969149985 /nfs/dbraw/zinc/14/99/85/969149985.db2.gz VPJJBUQNQZVUSU-JSGCOSHPSA-N 2 0 242.382 2.398 20 0 BEADRP CC[NH+]1CCC(C[N@H+](C)CC(C)C)CC1 ZINC001208595919 969151758 /nfs/dbraw/zinc/15/17/58/969151758.db2.gz XYGRNOUMXYEBJV-UHFFFAOYSA-N 2 0 212.381 2.306 20 0 BEADRP C[C@@H]1C[N@H+](CCC[NH2+]C2CC2)[C@@H](C)[C@H]1C ZINC000399667442 1166250385 /nfs/dbraw/zinc/25/03/85/1166250385.db2.gz MRNMZDUNXGKPEF-WOPDTQHZSA-N 2 0 210.365 2.105 20 0 BEADRP C[N@H+](C[C@H]1CC1(C)C)C[C@H]1CCC[NH+](C)C1 ZINC001208607575 969159961 /nfs/dbraw/zinc/15/99/61/969159961.db2.gz DDHQDWOCYUXIQC-QWHCGFSZSA-N 2 0 224.392 2.306 20 0 BEADRP CCCC1([NH2+]C[C@H](O)C[NH2+]C(C)(C)C)CCC1 ZINC001253410048 969161740 /nfs/dbraw/zinc/16/17/40/969161740.db2.gz ADUZBTOJPFYLQQ-GFCCVEGCSA-N 2 0 242.407 2.048 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH+]2CCC[C@H](C(F)F)C2)C1 ZINC001208612793 969172649 /nfs/dbraw/zinc/17/26/49/969172649.db2.gz NZDJGQOJYFIZRE-NEPJUHHUSA-N 2 0 246.345 2.305 20 0 BEADRP CCC1CC[NH+](C[C@H]2CC[C@@H]([NH3+])C2)CC1 ZINC000085015065 1166283627 /nfs/dbraw/zinc/28/36/27/1166283627.db2.gz GJLGUCHXWQYFOM-QWHCGFSZSA-N 2 0 210.365 2.236 20 0 BEADRP CC(C)CCC[NH+]1CC2(C1)CC[NH+](C)CC2 ZINC001208736870 969226324 /nfs/dbraw/zinc/22/63/24/969226324.db2.gz QTYLSJKAPPSSGN-UHFFFAOYSA-N 2 0 224.392 2.450 20 0 BEADRP C([C@H]1CC[NH2+]C1)[N@@H+]1CC[C@@H]2CCCC[C@@H]2C1 ZINC000225983628 1166347829 /nfs/dbraw/zinc/34/78/29/1166347829.db2.gz VZZSTNBUJKBISN-MELADBBJSA-N 2 0 222.376 2.108 20 0 BEADRP CC(C)CC[N@@H+]1CC[C@@H]2[NH2+]CCC[C@H]2C1 ZINC000250599428 1166414021 /nfs/dbraw/zinc/41/40/21/1166414021.db2.gz QOFSURIPVBSVAS-STQMWFEESA-N 2 0 210.365 2.106 20 0 BEADRP C[N@H+](C[C@H]1CC1(C)C)[C@H]1CCC[NH+](C)CC1 ZINC001254524848 969699689 /nfs/dbraw/zinc/69/96/89/969699689.db2.gz CVKZBRJJLWACKF-OLZOCXBDSA-N 2 0 224.392 2.449 20 0 BEADRP CC1CC([N@H+](C)[C@@H]2CCC[NH+](C)CC2)C1 ZINC001254517239 969703742 /nfs/dbraw/zinc/70/37/42/969703742.db2.gz SOFLMXVDLFWUNY-OTTFEQOBSA-N 2 0 210.365 2.201 20 0 BEADRP CCCCC[N@H+](C)CC1CC[NH+](C)CC1 ZINC000154707187 1166505216 /nfs/dbraw/zinc/50/52/16/1166505216.db2.gz YIXRUPFDEHSDSF-UHFFFAOYSA-N 2 0 212.381 2.450 20 0 BEADRP COc1ccccc1C[N@@H+]1CCC[C@H]([NH3+])CC1 ZINC000216200340 1166539103 /nfs/dbraw/zinc/53/91/03/1166539103.db2.gz DKDYIVGFLHMBQM-ZDUSSCGKSA-N 2 0 234.343 2.008 20 0 BEADRP C[C@@H](C[NH2+][C@@H]1CCSC1)CC(C)(C)CC[NH3+] ZINC001255275603 970025529 /nfs/dbraw/zinc/02/55/29/970025529.db2.gz ZSYROAXYRUBFPH-VXGBXAGGSA-N 2 0 244.448 2.483 20 0 BEADRP CC(C)C[C@@H]1C[C@H]1[NH2+]CC1CC[NH+](C)CC1 ZINC000395410857 1166625073 /nfs/dbraw/zinc/62/50/73/1166625073.db2.gz VURJYUNLDWSNNK-ZIAGYGMSSA-N 2 0 224.392 2.352 20 0 BEADRP COC(C)(C)C[N@H+](C)Cc1ccc(C[NH3+])cc1 ZINC000379292913 1166702942 /nfs/dbraw/zinc/70/29/42/1166702942.db2.gz LDSRIHXMYGJIMI-UHFFFAOYSA-N 2 0 236.359 2.002 20 0 BEADRP CCCC[NH+]1CCC([N@H+](C)[C@@H](C)COC)CC1 ZINC001255577376 970377057 /nfs/dbraw/zinc/37/70/57/970377057.db2.gz FXVLNILSEYPAQW-ZDUSSCGKSA-N 2 0 242.407 2.218 20 0 BEADRP C[C@H]1CC[C@H]([NH+]2CC3(C2)CC[NH+](C)CC3)C1 ZINC001170147184 970439389 /nfs/dbraw/zinc/43/93/89/970439389.db2.gz APDOMUDSKVSGHB-STQMWFEESA-N 2 0 222.376 2.203 20 0 BEADRP Cc1cc(C[N@H+]2CC[C@H]([C@H](C)[NH3+])C2)cs1 ZINC000379804120 1166789802 /nfs/dbraw/zinc/78/98/02/1166789802.db2.gz NGYUNVRQWFYTBL-JQWIXIFHSA-N 2 0 224.373 2.226 20 0 BEADRP Cc1cc(C[N@H+]2CC[C@@H]([C@@H](C)[NH3+])C2)cs1 ZINC000379804129 1166790608 /nfs/dbraw/zinc/79/06/08/1166790608.db2.gz NGYUNVRQWFYTBL-ZYHUDNBSSA-N 2 0 224.373 2.226 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+][C@@H](COC)C(C)C ZINC001255941598 970567990 /nfs/dbraw/zinc/56/79/90/970567990.db2.gz UQMAQIOLWDIDAG-KBPBESRZSA-N 2 0 244.423 2.367 20 0 BEADRP C[C@@H]([NH2+][C@H](C)C1CC[NH2+]CC1)c1ccco1 ZINC000400325913 970577850 /nfs/dbraw/zinc/57/78/50/970577850.db2.gz AHZJFLDICDRAML-GHMZBOCLSA-N 2 0 222.332 2.318 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]C[C@H]1CC(C)(C)O1 ZINC001255947588 970580674 /nfs/dbraw/zinc/58/06/74/970580674.db2.gz SXBLCPNRIYUXMQ-QWHCGFSZSA-N 2 0 242.407 2.264 20 0 BEADRP Cc1cc(C[N@@H+]2CC[C@](C)(C[NH3+])C2)cs1 ZINC000379962032 1166818602 /nfs/dbraw/zinc/81/86/02/1166818602.db2.gz NBFUPQFNUYPWQX-GFCCVEGCSA-N 2 0 224.373 2.227 20 0 BEADRP CC[NH+](CC)CC[C@H](C)n1cccc1CC[NH3+] ZINC001255949539 970584160 /nfs/dbraw/zinc/58/41/60/970584160.db2.gz XXZLUPYRVOVEMK-ZDUSSCGKSA-N 2 0 237.391 2.282 20 0 BEADRP CCC[N@H+](CCOC)[C@H](C)CC[NH+](CC)CC ZINC001255954236 970588903 /nfs/dbraw/zinc/58/89/03/970588903.db2.gz BISFIUMNUDHUMG-CQSZACIVSA-N 2 0 244.423 2.465 20 0 BEADRP C[C@H]([NH3+])[C@H]1CC[N@@H+]([C@H]2CCc3c2cccc3F)C1 ZINC000252770685 1166832383 /nfs/dbraw/zinc/83/23/83/1166832383.db2.gz LEATTXCNFOHCNM-PGUXBMHVSA-N 2 0 248.345 2.482 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[N@@H+]1C[C@@H]2C[C@@H]2C1 ZINC001255957639 970595348 /nfs/dbraw/zinc/59/53/48/970595348.db2.gz UAHHAURNUZOCAP-UPJWGTAASA-N 2 0 210.365 2.059 20 0 BEADRP C[N@@H+]1CCC[C@@H](CC[NH2+][C@H]2C[C@H]3C[C@H]3C2)C1 ZINC001167898231 1166897692 /nfs/dbraw/zinc/89/76/92/1166897692.db2.gz QDGXRGHPYIDNCU-IGQOVBAYSA-N 2 0 222.376 2.106 20 0 BEADRP C[C@H]1C[C@@H]([N@@H+]2CCC3(CCCC3)C2)CC[NH2+]1 ZINC000304318486 1166911946 /nfs/dbraw/zinc/91/19/46/1166911946.db2.gz BWBHUZCCDWLWFP-STQMWFEESA-N 2 0 222.376 2.393 20 0 BEADRP C[C@H]1C[N@H+](C2CCN(C)CC2)CCC[C@@H]1C ZINC001256202667 970703805 /nfs/dbraw/zinc/70/38/05/970703805.db2.gz KIUSKNXULFYMNS-STQMWFEESA-N 2 0 224.392 2.449 20 0 BEADRP CC(C)CC[C@H](C)NC(=[NH2+])SCC[NH3+] ZINC001256354303 970747445 /nfs/dbraw/zinc/74/74/45/970747445.db2.gz GVKXYQWWEWWWDT-VIFPVBQESA-N 2 0 217.382 2.027 20 0 BEADRP CC[NH+](CC)C1CCC([NH2+][C@@H]2C[C@H]2F)CC1 ZINC001173102613 975023598 /nfs/dbraw/zinc/02/35/98/975023598.db2.gz BLJBQSARSWQZCG-FIYWTHMPSA-N 2 0 228.355 2.339 20 0 BEADRP [NH3+]CC1CC[NH+](C2CCC3(CC3)CC2)CC1 ZINC000710198602 1166987736 /nfs/dbraw/zinc/98/77/36/1166987736.db2.gz FJBHQTALHFIRIT-UHFFFAOYSA-N 2 0 222.376 2.380 20 0 BEADRP CCSC[C@H](C)[N@H+](C)CC1CC[NH+](C)CC1 ZINC001173306734 975212296 /nfs/dbraw/zinc/21/22/96/975212296.db2.gz PYPRCPMWRXDUKJ-LBPRGKRZSA-N 2 0 244.448 2.402 20 0 BEADRP CCSC[C@@H](C)[N@@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC001173311908 975224647 /nfs/dbraw/zinc/22/46/47/975224647.db2.gz QZDQVNBTCOLVNS-OLZOCXBDSA-N 2 0 242.432 2.156 20 0 BEADRP CC(C)CC[NH2+]CCCC[N@H+](C)C1CC1 ZINC000453601764 1167077674 /nfs/dbraw/zinc/07/76/74/1167077674.db2.gz VPSADIUPPWUMMU-UHFFFAOYSA-N 2 0 212.381 2.497 20 0 BEADRP CS[C@@H]1CC[N@H+](CCCCCCC[NH3+])C1 ZINC000382903054 1167112304 /nfs/dbraw/zinc/11/23/04/1167112304.db2.gz CGWQYBXQACLESZ-GFCCVEGCSA-N 2 0 230.421 2.333 20 0 BEADRP Cc1sccc1C[N@@H+]1CC[C@H]([NH3+])[C@@H](F)CC1 ZINC001206200440 975378105 /nfs/dbraw/zinc/37/81/05/975378105.db2.gz RPYGJNMGQYKAIO-RYUDHWBXSA-N 2 0 242.363 2.318 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]([NH2+]C/C=C\C2CC2)C1 ZINC001334742587 976612737 /nfs/dbraw/zinc/61/27/37/976612737.db2.gz JQTRFVOKYMMJLA-DHCBQETCSA-N 2 0 222.376 2.320 20 0 BEADRP CC(C)C[C@@H]1C[C@H]1[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000385322043 1167389766 /nfs/dbraw/zinc/38/97/66/1167389766.db2.gz OGDRPZSIKJWTCL-MCIONIFRSA-N 2 0 224.392 2.400 20 0 BEADRP CC(C)[C@@H](C[NH3+])C[N@H+](C)[C@@H](C)C1(C)CC1 ZINC000385505076 1167393770 /nfs/dbraw/zinc/39/37/70/1167393770.db2.gz LOWIRHOQTCDEET-RYUDHWBXSA-N 2 0 212.381 2.338 20 0 BEADRP C[C@H]1C[C@H]([N@@H+]2CC[C@]3(CC[NH2+]C3)C2)C[C@@H](C)C1 ZINC000310143899 1167422719 /nfs/dbraw/zinc/42/27/19/1167422719.db2.gz DUSUNTAUQCIRJV-YJNKXOJESA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2CCC[C@@H]3CCC[C@@H]32)C[NH2+]1 ZINC000227168450 1167446682 /nfs/dbraw/zinc/44/66/82/1167446682.db2.gz VEUCWUGYRDUPKE-RFGFWPKPSA-N 2 0 222.376 2.391 20 0 BEADRP [NH3+][C@H]1CCC[N@H+](CC2CCCCC2)CC1 ZINC000215787531 1167478682 /nfs/dbraw/zinc/47/86/82/1167478682.db2.gz NESCTUXHFZOEPS-ZDUSSCGKSA-N 2 0 210.365 2.380 20 0 BEADRP CCC[N@H+](CC(C)C)CC1CC[NH2+]CC1 ZINC000086701946 1167640662 /nfs/dbraw/zinc/64/06/62/1167640662.db2.gz YHYUKEIEWYLDRD-UHFFFAOYSA-N 2 0 212.381 2.354 20 0 BEADRP CCC[N@H+](CC1CC[NH2+]CC1)[C@H](C)CC ZINC000086701985 1167640907 /nfs/dbraw/zinc/64/09/07/1167640907.db2.gz JTFNNRSGNRGPTC-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@H]1CCCN1CC[NH2+]C[C@@H]1CC=CCC1 ZINC000228689870 1167672538 /nfs/dbraw/zinc/67/25/38/1167672538.db2.gz BMEPYMWGIOTUSI-UONOGXRCSA-N 2 0 222.376 2.417 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+][C@@H]1CCc2cc(F)ccc2C1 ZINC001168419752 1167688323 /nfs/dbraw/zinc/68/83/23/1167688323.db2.gz DQPWXPYBQCYNPI-QLFBSQMISA-N 2 0 248.345 2.152 20 0 BEADRP C[C@]1(C[NH3+])CCC[N@H+](CCC(F)(F)F)CC1 ZINC001206293141 978293087 /nfs/dbraw/zinc/29/30/87/978293087.db2.gz GJXATGNLIXMBKE-JTQLQIEISA-N 2 0 238.297 2.390 20 0 BEADRP CCOC(C)(C)C[N@@H+]1CCC[C@@](C)(C[NH3+])CC1 ZINC001206295682 978298750 /nfs/dbraw/zinc/29/87/50/978298750.db2.gz MWLGOGAIRKNMMA-CQSZACIVSA-N 2 0 242.407 2.252 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@@H]2CCC[N@H+](C)CC2)C1 ZINC000128513201 1167811706 /nfs/dbraw/zinc/81/17/06/1167811706.db2.gz NZQYHBXXNWABJZ-UPJWGTAASA-N 2 0 210.365 2.249 20 0 BEADRP CCCC[C@H](CC)CN1CC[C@H]2C[NH2+]C[C@H]21 ZINC001235007488 978950241 /nfs/dbraw/zinc/95/02/41/978950241.db2.gz OUISFNUOCAIFDM-MELADBBJSA-N 2 0 224.392 2.497 20 0 BEADRP [NH3+]CCCC[N@@H+]1CCSc2ccccc2C1 ZINC001236241506 979464214 /nfs/dbraw/zinc/46/42/14/979464214.db2.gz SRTROGRQMAERSB-UHFFFAOYSA-N 2 0 236.384 2.333 20 0 BEADRP C(C[N@@H+]1CCCC[C@@]12CC[NH2+]C2)C1CC1 ZINC000257653988 1168334366 /nfs/dbraw/zinc/33/43/66/1168334366.db2.gz DYQIHSAJEAAOMH-ZDUSSCGKSA-N 2 0 208.349 2.005 20 0 BEADRP C[NH2+]CC[C@H](C)[NH2+]Cc1ccc(C)cc1C ZINC000323221719 1168432788 /nfs/dbraw/zinc/43/27/88/1168432788.db2.gz MCMYIIUXSFCVRD-ZDUSSCGKSA-N 2 0 220.360 2.391 20 0 BEADRP C[C@@H]1CCC[C@@H]([N@H+](C)CCC[NH+](C)C)C1 ZINC000337344929 1168458914 /nfs/dbraw/zinc/45/89/14/1168458914.db2.gz ZMYRPGAQZSZVOK-CHWSQXEVSA-N 2 0 212.381 2.449 20 0 BEADRP CC[N@H+](CC[C@H]1CC[NH2+]C1)CC(C)(C)C ZINC000389602820 1168485258 /nfs/dbraw/zinc/48/52/58/1168485258.db2.gz VYXANIFCJRERRA-GFCCVEGCSA-N 2 0 212.381 2.354 20 0 BEADRP [NH3+]C[C@]1(F)CCC[N@H+](CC2CCCC2)CC1 ZINC001205539364 980915387 /nfs/dbraw/zinc/91/53/87/980915387.db2.gz XNUIAAOOYZFZKW-ZDUSSCGKSA-N 2 0 228.355 2.330 20 0 BEADRP CC[C@H]1CC[C@@H]([NH2+]C[C@H]2CCC[NH2+]C2)C1 ZINC001246216217 1168627096 /nfs/dbraw/zinc/62/70/96/1168627096.db2.gz FUMKGHUQOCTNKX-RWMBFGLXSA-N 2 0 210.365 2.154 20 0 BEADRP CC[C@H]1CC[C@H]([NH2+]C[C@H]2CCC[NH2+]C2)C1 ZINC001246216216 1168627298 /nfs/dbraw/zinc/62/72/98/1168627298.db2.gz FUMKGHUQOCTNKX-AVGNSLFASA-N 2 0 210.365 2.154 20 0 BEADRP Cc1cccc2c1CC[C@@H]([NH2+][C@H]1C[C@@](C)([NH3+])C1)C2 ZINC001246457096 1168638244 /nfs/dbraw/zinc/63/82/44/1168638244.db2.gz CGKYHNBTNKILDK-FMKPAKJESA-N 2 0 244.382 2.322 20 0 BEADRP CO[C@@H]1CCC[C@H]([NH2+]CCCCCCC[NH3+])C1 ZINC001172922873 1168683614 /nfs/dbraw/zinc/68/36/14/1168683614.db2.gz JKMKHKYVGPBJGR-UONOGXRCSA-N 2 0 242.407 2.443 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@H](C)Cc1ccc(F)cc1 ZINC001326035815 982374527 /nfs/dbraw/zinc/37/45/27/982374527.db2.gz BTUAZUIIRJUTHN-NWDGAFQWSA-N 2 0 238.350 2.344 20 0 BEADRP C[NH+](C)CCCCCCC[NH2+]C1CCOCC1 ZINC001199830067 1168833134 /nfs/dbraw/zinc/83/31/34/1168833134.db2.gz BVIILIIOKDBECJ-UHFFFAOYSA-N 2 0 242.407 2.267 20 0 BEADRP CC1(C)CO[C@H](CC[NH2+][C@H]2CCC[C@@H]([NH3+])C2)C1 ZINC000717287181 1168967092 /nfs/dbraw/zinc/96/70/92/1168967092.db2.gz ZJQNWYIIVPWOEX-FRRDWIJNSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[N@H+](C)C[C@@H]12)C1CCCC1 ZINC001308983265 1169056360 /nfs/dbraw/zinc/05/63/60/1169056360.db2.gz BVPJGNMQJYRLQU-ZGKBOVNRSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@H]1C[C@@H]1C[NH+]1CCC2(CCC[N@H+](C)C2)CC1 ZINC001276034161 1169063993 /nfs/dbraw/zinc/06/39/93/1169063993.db2.gz RFFDYTGSCGCPMB-UONOGXRCSA-N 2 0 236.403 2.450 20 0 BEADRP C[C@@H]1C[C@H]1C[NH+]1CCC2(CCC[N@H+](C)C2)CC1 ZINC001276034158 1169065088 /nfs/dbraw/zinc/06/50/88/1169065088.db2.gz RFFDYTGSCGCPMB-KGLIPLIRSA-N 2 0 236.403 2.450 20 0 BEADRP CCCCCC[C@H](C)NC(=[NH2+])NCCCC[NH3+] ZINC001257362790 1169080732 /nfs/dbraw/zinc/08/07/32/1169080732.db2.gz FSBVCGMLQWYVPP-LBPRGKRZSA-N 2 0 242.411 2.198 20 0 BEADRP CN1CCC[C@H]2C[N@H+](CC3CCCC3)C[C@@H]21 ZINC001202190295 983592720 /nfs/dbraw/zinc/59/27/20/983592720.db2.gz NOAQXSRFJVFOON-KBPBESRZSA-N 2 0 222.376 2.203 20 0 BEADRP CO[C@@H]1CC[C@@H](C)[N@H+](CCCCCCC[NH3+])C1 ZINC000687197960 1169123072 /nfs/dbraw/zinc/12/30/72/1169123072.db2.gz UXZMLYLYFISVFH-ZIAGYGMSSA-N 2 0 242.407 2.395 20 0 BEADRP CCOCC[C@H](C)[N@H+](C)CCC[NH+]1CCCC1 ZINC001172424077 974699002 /nfs/dbraw/zinc/69/90/02/974699002.db2.gz MQXZPCBSJBOARR-AWEZNQCLSA-N 2 0 242.407 2.219 20 0 BEADRP CCc1ccc(C[NH2+]CC[C@H](C)[NH2+]C)cc1 ZINC001331418003 974712029 /nfs/dbraw/zinc/71/20/29/974712029.db2.gz FRAIJRZKQYOBKM-LBPRGKRZSA-N 2 0 220.360 2.337 20 0 BEADRP CC[C@@H](CC(C)C)[N@H+]1C[C@H]2C[NH+](C)C[C@H]2C1 ZINC001172399313 974759395 /nfs/dbraw/zinc/75/93/95/974759395.db2.gz BMLGWVFMQQMYTB-MJBXVCDLSA-N 2 0 224.392 2.305 20 0 BEADRP CC(C)OCC[C@H](C)[N@H+](C)C1CCC([NH3+])CC1 ZINC001172449216 974812712 /nfs/dbraw/zinc/81/27/12/974812712.db2.gz QQDZANGCNKQTND-HSBZDZAISA-N 2 0 242.407 2.392 20 0 BEADRP C[C@H](CC(F)(F)F)[N@@H+]1CC[C@H]([NH3+])[C@@H](F)CC1 ZINC001246589589 972993126 /nfs/dbraw/zinc/99/31/26/972993126.db2.gz SSIDMUYCUBALBU-VGMNWLOBSA-N 2 0 242.260 2.089 20 0 BEADRP C[NH2+]CC1C[NH+]([C@H]2C[C@H](C)CC(C)(C)C2)C1 ZINC001246594785 973002414 /nfs/dbraw/zinc/00/24/14/973002414.db2.gz FGMMXBHXCDJCLU-AAEUAGOBSA-N 2 0 224.392 2.352 20 0 BEADRP [NH3+]C[C@@H]1CCCC[N@H+](C[C@H]2CC=CCC2)C1 ZINC000402202313 970767776 /nfs/dbraw/zinc/76/77/76/970767776.db2.gz FFNWMHXUHCUFJO-KBPBESRZSA-N 2 0 222.376 2.404 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H](C)c1ccccc1 ZINC001329024949 973410344 /nfs/dbraw/zinc/41/03/44/973410344.db2.gz WLLHOGFDGYJRAB-VXGBXAGGSA-N 2 0 206.333 2.335 20 0 BEADRP c1cc2c[nH+]cc(N[C@@]34CCC[C@@H]3[NH2+]CC4)c2[nH]1 ZINC001162982699 1169453410 /nfs/dbraw/zinc/45/34/10/1169453410.db2.gz IOECNZVZXHNDAI-GXTWGEPZSA-N 2 0 242.326 2.259 20 0 BEADRP CC(C)CC[NH+]1CCC(OCC[NH+](C)C)CC1 ZINC000351830442 1169465464 /nfs/dbraw/zinc/46/54/64/1169465464.db2.gz RXEIIPRSLNFIOP-UHFFFAOYSA-N 2 0 242.407 2.075 20 0 BEADRP CCOC1CCC([N@H+](C)CCC[NH+](C)C)CC1 ZINC001256437308 970841818 /nfs/dbraw/zinc/84/18/18/970841818.db2.gz XVANKYZKJQOTQN-UHFFFAOYSA-N 2 0 242.407 2.218 20 0 BEADRP C[C@@H]1C[C@H](NC=[NH2+])CC[N@@H+]1Cc1ccccc1 ZINC001256523202 970856290 /nfs/dbraw/zinc/85/62/90/970856290.db2.gz NKWUVTBBYQAROC-TZMCWYRMSA-N 2 0 231.343 2.236 20 0 BEADRP C[C@@H]1C[C@@H](NC=[NH2+])CC[N@@H+]1Cc1ccccc1 ZINC001256523200 970856392 /nfs/dbraw/zinc/85/63/92/970856392.db2.gz NKWUVTBBYQAROC-OCCSQVGLSA-N 2 0 231.343 2.236 20 0 BEADRP CC(C)(C)[NH+]1CCC([NH2+]CCn2cccc2)CC1 ZINC001256558694 970862615 /nfs/dbraw/zinc/86/26/15/970862615.db2.gz WAHJHIQWKKCTQE-UHFFFAOYSA-N 2 0 249.402 2.341 20 0 BEADRP CC(C)(C)[NH+]1CCC([NH2+]C23CC(C2)C3)CC1 ZINC001256558057 970862867 /nfs/dbraw/zinc/86/28/67/970862867.db2.gz HSHQQZGUZJYGDU-UHFFFAOYSA-N 2 0 222.376 2.391 20 0 BEADRP C[C@@H](Cc1ccncc1)[NH2+]CCC[NH+]1CCCC1 ZINC001256716552 970934950 /nfs/dbraw/zinc/93/49/50/970934950.db2.gz TWWYHKJWFGRUEU-AWEZNQCLSA-N 2 0 247.386 2.088 20 0 BEADRP [NH3+]CCCC[NH2+][C@@H]1CCO[C@@H](c2ccccc2)C1 ZINC001256787314 970987528 /nfs/dbraw/zinc/98/75/28/970987528.db2.gz QLQJVBHZSBFZOQ-HUUCEWRRSA-N 2 0 248.370 2.235 20 0 BEADRP C[NH2+]Cc1cccc(Nc2cc[nH+]cc2C)c1F ZINC001216219233 970991583 /nfs/dbraw/zinc/99/15/83/970991583.db2.gz QUBLZFBHYXXDAG-UHFFFAOYSA-N 2 0 245.301 2.414 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)S2 ZINC000403654061 971004182 /nfs/dbraw/zinc/00/41/82/971004182.db2.gz IBOYQVIKHLSNLX-OFIBSPLFSA-N 2 0 240.416 2.130 20 0 BEADRP Nc1[nH+]ccn1-c1cccc(C2=C[NH2+]CCC2)c1 ZINC001243951482 971043039 /nfs/dbraw/zinc/04/30/39/971043039.db2.gz GXYYDNZUCCDAMN-UHFFFAOYSA-N 2 0 240.310 2.179 20 0 BEADRP C[C@@H]1CC([NH2+]C(C)(C)CC[NH+](C)C)C[C@@H](C)O1 ZINC001257082233 971080779 /nfs/dbraw/zinc/08/07/79/971080779.db2.gz WSTFDXUUCVARPW-VXGBXAGGSA-N 2 0 242.407 2.262 20 0 BEADRP CCC[N@H+](CCC[NH3+])[C@@H]1C[C@@H](C)O[C@@H](C)C1 ZINC001257073717 971090030 /nfs/dbraw/zinc/09/00/30/971090030.db2.gz TWRIWVWHUAPISW-CLLJXQQHSA-N 2 0 228.380 2.003 20 0 BEADRP CCC[N@H+](CCC[NH3+])C1C[C@@H](C)O[C@H](C)C1 ZINC001257073719 971090369 /nfs/dbraw/zinc/09/03/69/971090369.db2.gz TWRIWVWHUAPISW-VXGBXAGGSA-N 2 0 228.380 2.003 20 0 BEADRP CC(C)[NH+]1CCC(Nc2cccc(C[NH3+])c2)CC1 ZINC001257204893 971124889 /nfs/dbraw/zinc/12/48/89/971124889.db2.gz SKODVPNZZHFXHR-UHFFFAOYSA-N 2 0 247.386 2.430 20 0 BEADRP CCC[C@H](CC)[NH+]1CCC([NH3+])(CCOC)CC1 ZINC001257252852 971150006 /nfs/dbraw/zinc/15/00/06/971150006.db2.gz IGWAYRDWWUGFMF-ZDUSSCGKSA-N 2 0 242.407 2.395 20 0 BEADRP C[C@@H]1CCC[N@H+](C/C=C\Cl)[C@H]1CC[NH3+] ZINC000404368518 971158532 /nfs/dbraw/zinc/15/85/32/971158532.db2.gz QEZLGAGLQVDZBW-APUFIWCYSA-N 2 0 216.756 2.188 20 0 BEADRP CCc1cc(N[C@H]2C[NH+]3CCC2CC3)cc[nH+]1 ZINC000307775739 971175493 /nfs/dbraw/zinc/17/54/93/971175493.db2.gz SQWOATXVMFQIJG-AWEZNQCLSA-N 2 0 231.343 2.150 20 0 BEADRP CC(C)O[C@@H]1CCC[N@H+](CCC[NH2+]C2CC2)C1 ZINC000404676150 971177878 /nfs/dbraw/zinc/17/78/78/971177878.db2.gz XZAQFLARIWEKBQ-CQSZACIVSA-N 2 0 240.391 2.018 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[NH+]2CCC3(CC3(F)F)CC2)C1 ZINC000405063406 971191957 /nfs/dbraw/zinc/19/19/57/971191957.db2.gz QHDKKHVQUPYRFI-WDEREUQCSA-N 2 0 244.329 2.235 20 0 BEADRP CCC(CC)[N@@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC001257302926 971193195 /nfs/dbraw/zinc/19/31/95/971193195.db2.gz GCGPAICPDYQSOK-CYBMUJFWSA-N 2 0 210.365 2.203 20 0 BEADRP CC(C)(C)SCC[NH2+][C@@H]1C[C@H]([NH3+])C12CCC2 ZINC000405199785 971207916 /nfs/dbraw/zinc/20/79/16/971207916.db2.gz CGQAGQHMYKJZHW-WDEREUQCSA-N 2 0 242.432 2.378 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+][C@@H]1C[C@H]([NH3+])C12CCC2 ZINC000405224822 971211623 /nfs/dbraw/zinc/21/16/23/971211623.db2.gz OBMJTKRADVSEHM-KWCYVHTRSA-N 2 0 248.370 2.460 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]CCCC(F)(F)F)C12CCC2 ZINC000405226231 971212473 /nfs/dbraw/zinc/21/24/73/971212473.db2.gz DEMQUCSPXNJCKQ-RKDXNWHRSA-N 2 0 236.281 2.188 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2C[C@@H]([NH3+])C23CCC3)cc1 ZINC000405246776 971218365 /nfs/dbraw/zinc/21/83/65/971218365.db2.gz HUQWZRXFFWUXIV-KGLIPLIRSA-N 2 0 230.355 2.355 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]C[C@H]2CCCC2(F)F)C12CCC2 ZINC000405270634 971222019 /nfs/dbraw/zinc/22/20/19/971222019.db2.gz RQJKQKKEAQDXQN-MXWKQRLJSA-N 2 0 244.329 2.281 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+]CCc2ccccc2F)C12CCC2 ZINC000405238370 971222406 /nfs/dbraw/zinc/22/24/06/971222406.db2.gz VBGUICQLQUXOBL-UONOGXRCSA-N 2 0 248.345 2.228 20 0 BEADRP Cc1cc(C)c(C[NH2+][C@H]2C[C@@H]([NH3+])C23CCC3)cn1 ZINC000405245381 971222553 /nfs/dbraw/zinc/22/25/53/971222553.db2.gz ZNYQMULKRXUBJN-KGLIPLIRSA-N 2 0 245.370 2.058 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]C2CCC(F)(F)CC2)C12CCC2 ZINC000405264421 971224200 /nfs/dbraw/zinc/22/42/00/971224200.db2.gz QNPJUIUGMJPRAL-GHMZBOCLSA-N 2 0 244.329 2.424 20 0 BEADRP CSC1(C[NH2+][C@H]2C[C@@H]([NH3+])C23CCC3)CCC1 ZINC000405281380 971228542 /nfs/dbraw/zinc/22/85/42/971228542.db2.gz ZPYASJRWRYRHFP-MNOVXSKESA-N 2 0 240.416 2.132 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]Cc2ccsc2)C12CCC2 ZINC000405309860 971229761 /nfs/dbraw/zinc/22/97/61/971229761.db2.gz OEIQLEFKAFETQO-QWRGUYRKSA-N 2 0 222.357 2.108 20 0 BEADRP C[C@H](CCC1CC1)[NH2+][C@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405304457 971233569 /nfs/dbraw/zinc/23/35/69/971233569.db2.gz LKLNQCHGCXGVBU-RTXFEEFZSA-N 2 0 222.376 2.425 20 0 BEADRP CC1(C)[C@H]([NH2+]CCc2cccc(F)c2)C[C@@H]1[NH3+] ZINC000405309456 971233845 /nfs/dbraw/zinc/23/38/45/971233845.db2.gz ZWHKSYUPRFXVPF-QWHCGFSZSA-N 2 0 236.334 2.084 20 0 BEADRP CCCC(CCC)NC(=[NH2+])SCC[NH3+] ZINC001257329943 971235902 /nfs/dbraw/zinc/23/59/02/971235902.db2.gz XDJOKZJNPQVNKZ-UHFFFAOYSA-N 2 0 217.382 2.171 20 0 BEADRP CC(C)OCCCC[NH2+][C@H]1C[C@H]([NH3+])C12CCC2 ZINC000405358286 971241127 /nfs/dbraw/zinc/24/11/27/971241127.db2.gz SHCGVWLFNFDVCZ-STQMWFEESA-N 2 0 240.391 2.051 20 0 BEADRP CC(C)OCCCC[NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405358283 971244843 /nfs/dbraw/zinc/24/48/43/971244843.db2.gz SHCGVWLFNFDVCZ-CHWSQXEVSA-N 2 0 240.391 2.051 20 0 BEADRP CCC(C)(C)C[NH2+][C@H]1C[C@H]([NH3+])C12CCC2 ZINC000405437919 971254086 /nfs/dbraw/zinc/25/40/86/971254086.db2.gz CSSGQADGYHJOEP-QWRGUYRKSA-N 2 0 210.365 2.282 20 0 BEADRP CCCCCC[C@H](C)[NH2+]CCC[N@H+](C)CCO ZINC001257359251 971273288 /nfs/dbraw/zinc/27/32/88/971273288.db2.gz NJBZNYWXYWXABY-AWEZNQCLSA-N 2 0 244.423 2.249 20 0 BEADRP C[C@]1([NH3+])CC[N@H+](CCC2CCCCC2)C1 ZINC000405794947 971313648 /nfs/dbraw/zinc/31/36/48/971313648.db2.gz MZKNBBXOUIZJMJ-ZDUSSCGKSA-N 2 0 210.365 2.380 20 0 BEADRP CC[C@@H](C)[NH2+]CCCC1CC[NH+](C)CC1 ZINC001257432433 971340746 /nfs/dbraw/zinc/34/07/46/971340746.db2.gz XQSFRRYOXRWFRZ-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP CCC[NH+]1C[C@@H]2C[NH+]([C@H](C)CC)C[C@H]2C1 ZINC001257446910 971362520 /nfs/dbraw/zinc/36/25/20/971362520.db2.gz SKLOZVKLGMYVQC-JHJVBQTASA-N 2 0 210.365 2.059 20 0 BEADRP C[C@H]1C[NH2+]CCC[C@H]1OCc1cccc(C[NH3+])c1 ZINC001217778173 971400221 /nfs/dbraw/zinc/40/02/21/971400221.db2.gz KPVYGRRFTAQOFQ-SWLSCSKDSA-N 2 0 248.370 2.050 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1OCc1ccc(C[NH3+])cc1 ZINC001217783078 971402709 /nfs/dbraw/zinc/40/27/09/971402709.db2.gz UOTBQSZGAVSHOQ-WFASDCNBSA-N 2 0 248.370 2.050 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]1OCc1ccccc1C[NH3+] ZINC001217876355 971471866 /nfs/dbraw/zinc/47/18/66/971471866.db2.gz GAGXWZWXHJYCOY-AWEZNQCLSA-N 2 0 248.370 2.050 20 0 BEADRP CC[N@H+](C)C1CC[NH+]([C@H]2CCCSC2)CC1 ZINC001257684454 971490226 /nfs/dbraw/zinc/49/02/26/971490226.db2.gz SZGBPQQDBIBUPY-ZDUSSCGKSA-N 2 0 242.432 2.298 20 0 BEADRP CCCC[C@@H](CC)C[NH+]1CC2(C1)CC[NH2+]C2 ZINC000724110279 971496220 /nfs/dbraw/zinc/49/62/20/971496220.db2.gz DTNWSRKFARXSIC-CYBMUJFWSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@H]1CC[C@@H](OCCCCCCC[NH3+])C[NH2+]1 ZINC001217914186 971516866 /nfs/dbraw/zinc/51/68/66/971516866.db2.gz XDBABFLPGVEPGY-QWHCGFSZSA-N 2 0 228.380 2.053 20 0 BEADRP C[C@@H]1C[NH2+]CCC[C@@H]1Oc1cccc2c1C[NH2+]C2 ZINC001217992417 971563394 /nfs/dbraw/zinc/56/33/94/971563394.db2.gz RHTLLSZMGAJANR-RISCZKNCSA-N 2 0 246.354 2.057 20 0 BEADRP C[C@H](Oc1cccc2c1C[NH2+]C2)C1CC[NH2+]CC1 ZINC001218005596 971568846 /nfs/dbraw/zinc/56/88/46/971568846.db2.gz KNOCALRIYYIRRW-NSHDSACASA-N 2 0 246.354 2.057 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1Oc1ccc2c(c1)C[NH2+]C2 ZINC001218028377 971575532 /nfs/dbraw/zinc/57/55/32/971575532.db2.gz FORGIQDPBXLDQC-IAQYHMDHSA-N 2 0 246.354 2.057 20 0 BEADRP C[C@H]([NH3+])c1ccc(O[C@@H]2CC[NH2+][C@H](C)C2)cc1 ZINC001218053436 971589246 /nfs/dbraw/zinc/58/92/46/971589246.db2.gz QVFGWSXOILTLHI-UHIISALHSA-N 2 0 234.343 2.226 20 0 BEADRP [NH3+]Cc1ccccc1O[C@H]1CCC12CC[NH2+]CC2 ZINC001218085517 971596555 /nfs/dbraw/zinc/59/65/55/971596555.db2.gz SAZPKCBHBGJSLC-AWEZNQCLSA-N 2 0 246.354 2.056 20 0 BEADRP [NH3+]Cc1ccccc1O[C@H]1CCC[C@]12CC[NH2+]C2 ZINC001218089477 971598909 /nfs/dbraw/zinc/59/89/09/971598909.db2.gz FUHJXMLZRXIFQQ-LSDHHAIUSA-N 2 0 246.354 2.056 20 0 BEADRP C[C@H]([NH3+])c1ccc(O[C@H]2CC[C@@]23CC[NH2+]C3)cc1 ZINC001218126137 971603811 /nfs/dbraw/zinc/60/38/11/971603811.db2.gz YVPLRBDGKWYPFK-CQDKDKBSSA-N 2 0 246.354 2.227 20 0 BEADRP C[C@@H](c1cccc(O[C@H]2CC[NH2+]C2)c1)[NH+](C)C ZINC001218182721 971617929 /nfs/dbraw/zinc/61/79/29/971617929.db2.gz ZXNXMQUSTGKPSV-FZMZJTMJSA-N 2 0 234.343 2.050 20 0 BEADRP CC1(C)[C@@H]2C[C@@H]([NH2+]CCC[NH+]3CCCC3)C[C@@H]21 ZINC001170714003 971623019 /nfs/dbraw/zinc/62/30/19/971623019.db2.gz VZDNJGNPLDHUTG-ZSOGYDGISA-N 2 0 236.403 2.497 20 0 BEADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H](NC1(CF)CC1)C2 ZINC001172101177 974327453 /nfs/dbraw/zinc/32/74/53/974327453.db2.gz XESAEWKNTLPRTL-CNDDSTCGSA-N 2 0 226.339 2.093 20 0 BEADRP C[N@@H+]1CCC[C@@H]1CC[NH2+][C@H]1C[C@@H]2[C@H](C1)C2(C)C ZINC001170724412 971653859 /nfs/dbraw/zinc/65/38/59/971653859.db2.gz JIVZODBRRWHDKH-YIYPIFLZSA-N 2 0 236.403 2.495 20 0 BEADRP C[N@@H+]1CCC[C@H]1CC[NH2+][C@H]1C[C@@H]2[C@H](C1)C2(C)C ZINC001170724409 971655935 /nfs/dbraw/zinc/65/59/35/971655935.db2.gz JIVZODBRRWHDKH-FQUUOJAGSA-N 2 0 236.403 2.495 20 0 BEADRP CN1[C@@H]2CCC[C@H]1C[C@H]([NH2+]C1(C)CC1)C2 ZINC001172101165 974332355 /nfs/dbraw/zinc/33/23/55/974332355.db2.gz XECFOYRXXZCICW-CNDDSTCGSA-N 2 0 208.349 2.144 20 0 BEADRP CC1(C)[C@@H]2C[C@H]([NH+]3CCC(C)([NH3+])CC3)C[C@@H]21 ZINC001170727550 971664723 /nfs/dbraw/zinc/66/47/23/971664723.db2.gz OBUABCHEVVJQSK-ZSBIGDGJSA-N 2 0 222.376 2.234 20 0 BEADRP [NH3+]Cc1ccccc1OC1CCC2(C[NH2+]C2)CC1 ZINC001218263044 971666311 /nfs/dbraw/zinc/66/63/11/971666311.db2.gz TVBQKWKFXIVZML-UHFFFAOYSA-N 2 0 246.354 2.056 20 0 BEADRP [NH3+]Cc1cccc(OC2CC[NH+](C3CC3)CC2)c1 ZINC001218289322 971686216 /nfs/dbraw/zinc/68/62/16/971686216.db2.gz PQTGDVQTJZCFLJ-UHFFFAOYSA-N 2 0 246.354 2.151 20 0 BEADRP COC(C)(C)C[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172103575 974368934 /nfs/dbraw/zinc/36/89/34/974368934.db2.gz VYPNVELKWGTELW-XYYAHUGASA-N 2 0 240.391 2.016 20 0 BEADRP CC[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCC2(C)C)C1 ZINC000309681679 971761988 /nfs/dbraw/zinc/76/19/88/971761988.db2.gz ZPYFOHOAOZKXCT-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H](C)OCC[C@H](C)[NH+]1CCC(C)([NH3+])CC1 ZINC001172327061 974535662 /nfs/dbraw/zinc/53/56/62/974535662.db2.gz CQBGYWPLZCMOAO-QWHCGFSZSA-N 2 0 242.407 2.393 20 0 BEADRP CC[C@@H](C)OCC[C@H](C)[NH2+][C@@H]1CCC[C@@H]1[NH3+] ZINC001172326715 974536757 /nfs/dbraw/zinc/53/67/57/974536757.db2.gz BFXFVBIXDUZUOO-QNWHQSFQSA-N 2 0 228.380 2.050 20 0 BEADRP COc1cccc(C[N@@H+]2CCCC[C@@H](C[NH3+])C2)c1 ZINC000310990096 971990593 /nfs/dbraw/zinc/99/05/93/971990593.db2.gz GMISDKWDFFTVEP-AWEZNQCLSA-N 2 0 248.370 2.256 20 0 BEADRP Cc1cc(Cl)cc(C)c1N[C@H]([NH3+])CCC[NH3+] ZINC001170898990 972062055 /nfs/dbraw/zinc/06/20/55/972062055.db2.gz GCFGQKLSJZYVSG-NSHDSACASA-N 2 0 241.766 2.392 20 0 BEADRP CCCc1ccc(N[C@@H]([NH3+])CCC[NH3+])cc1 ZINC001170900586 972065901 /nfs/dbraw/zinc/06/59/01/972065901.db2.gz MKJPTCQFBYDQJI-CYBMUJFWSA-N 2 0 221.348 2.075 20 0 BEADRP [NH3+]CCC[C@H]([NH3+])Nc1cccc(C(F)F)c1 ZINC001170900476 972066178 /nfs/dbraw/zinc/06/61/78/972066178.db2.gz URNQOOJELFVKJN-SNVBAGLBSA-N 2 0 229.274 2.060 20 0 BEADRP [NH3+]CCCC[NH2+][C@@H]1CCc2cccc(F)c2C1 ZINC001170957265 972155075 /nfs/dbraw/zinc/15/50/75/972155075.db2.gz NATMNNFCOXBLDQ-GFCCVEGCSA-N 2 0 236.334 2.012 20 0 BEADRP CC[C@@H]1CC[C@H]([NH2+]C[C@@H]2C[NH2+]C[C@@H](C)C2)C1 ZINC001246103844 972164927 /nfs/dbraw/zinc/16/49/27/972164927.db2.gz TZLCKVBNRJGOLZ-CRWXNKLISA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+]C2CCCCC2)[NH2+]C1 ZINC001246115086 972176661 /nfs/dbraw/zinc/17/66/61/972176661.db2.gz QUABTAXVDRDLMV-DGCLKSJQSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]C[C@H]2C[NH2+]CC[C@@H]2C)C1 ZINC001246112285 972177018 /nfs/dbraw/zinc/17/70/18/972177018.db2.gz NLBAXZRBFZVIGX-RQJABVFESA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1C[C@@H](n2ccc3c2cccc3C[NH3+])CC[NH2+]1 ZINC001246112167 972175107 /nfs/dbraw/zinc/17/51/07/972175107.db2.gz DCIUVSORTNRWRS-YPMHNXCESA-N 2 0 243.354 2.413 20 0 BEADRP CC(C)[C@H]1C[C@@H]([NH2+]Cc2cccc(N)c2)CC[NH2+]1 ZINC001246119069 972182211 /nfs/dbraw/zinc/18/22/11/972182211.db2.gz ARBXXBTXRFKPII-LSDHHAIUSA-N 2 0 247.386 2.135 20 0 BEADRP CCCC[C@@H](CC)[NH2+][C@H]1C[NH2+]CC12CC2 ZINC001246133531 972192209 /nfs/dbraw/zinc/19/22/09/972192209.db2.gz OEJBEZRYJIXBNA-NEPJUHHUSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCNc3ccccc32)CC[NH2+]1 ZINC001246228759 972234332 /nfs/dbraw/zinc/23/43/32/972234332.db2.gz JFBOHFMJROZWTK-LALPHHSUSA-N 2 0 245.370 2.273 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH+]2CC[C@]3(CC3(F)F)C2)C1 ZINC001208608032 957092391 /nfs/dbraw/zinc/09/23/91/957092391.db2.gz FFWLNUVBWLTUMV-NEPJUHHUSA-N 2 0 244.329 2.059 20 0 BEADRP C[C@@H]1C[C@@H](C)C[NH+](C[C@H]2CCC[N@H+](C)C2)C1 ZINC001208612293 957097658 /nfs/dbraw/zinc/09/76/58/957097658.db2.gz MFVXODISJGBEEM-MCIONIFRSA-N 2 0 224.392 2.306 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H](C)Cc1cccc(F)c1 ZINC001246306968 972269078 /nfs/dbraw/zinc/26/90/78/972269078.db2.gz UNVSZZWTVLXAHS-QWRGUYRKSA-N 2 0 224.323 2.084 20 0 BEADRP C[C@@H](Cc1ccco1)[NH2+]C[C@@H]1CC[C@@H](C)[NH2+]C1 ZINC000397523290 957663623 /nfs/dbraw/zinc/66/36/23/957663623.db2.gz FZOUKTXISBNQFP-FRRDWIJNSA-N 2 0 236.359 2.188 20 0 BEADRP C[C@H](Cc1ccco1)[NH2+]C[C@@H]1CC[C@@H](C)[NH2+]C1 ZINC000397523297 957663956 /nfs/dbraw/zinc/66/39/56/957663956.db2.gz FZOUKTXISBNQFP-JHJVBQTASA-N 2 0 236.359 2.188 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@@H]2CC[C@@H](C)[NH2+]C2)C1 ZINC000397535106 957679247 /nfs/dbraw/zinc/67/92/47/957679247.db2.gz OJPMJGGSUIIWTO-LPWJVIDDSA-N 2 0 210.365 2.153 20 0 BEADRP CCCCC[C@@H](CC)[NH2+][C@@H]1CC12C[NH2+]C2 ZINC001246441932 972313252 /nfs/dbraw/zinc/31/32/52/972313252.db2.gz ATXQZUFWQQCWSQ-VXGBXAGGSA-N 2 0 210.365 2.297 20 0 BEADRP CCCC1CCC([NH2+][C@@H]2CC23C[NH2+]C3)CC1 ZINC001246443019 972314611 /nfs/dbraw/zinc/31/46/11/972314611.db2.gz FPEZFEIOSCOWCC-WXRRBKDZSA-N 2 0 222.376 2.297 20 0 BEADRP c1cc(C[NH2+][C@]23C[C@H]2CCC3)c2c(c1)C[NH2+]CC2 ZINC000693283124 958159119 /nfs/dbraw/zinc/15/91/19/958159119.db2.gz LVFKKIONNXUYCE-GDBMZVCRSA-N 2 0 242.366 2.365 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1CCC[C@@H]([C@@H](C)[NH3+])C1 ZINC000723122319 958162721 /nfs/dbraw/zinc/16/27/21/958162721.db2.gz OPFPFUQLTAPWHT-LPWJVIDDSA-N 2 0 210.365 2.092 20 0 BEADRP C[C@@H]1CC([NH2+][C@H]2C[C@@](C)([NH3+])C2)C[C@@H](C)C1 ZINC001246458508 972330447 /nfs/dbraw/zinc/33/04/47/972330447.db2.gz HAKYSZJHASUFHR-XRRVDJEJSA-N 2 0 210.365 2.281 20 0 BEADRP CC[C@@]1([NH2+]C2CCCCCC2)CC[NH2+]C1 ZINC001246459084 972332779 /nfs/dbraw/zinc/33/27/79/972332779.db2.gz JCTFGSDBTHNJDD-CYBMUJFWSA-N 2 0 210.365 2.441 20 0 BEADRP C1CC2(CCCCC2)[N@@H+]1[C@@H]1CCC[NH2+]C1 ZINC000707663841 958656693 /nfs/dbraw/zinc/65/66/93/958656693.db2.gz XWYVEYQQTVJFGR-GFCCVEGCSA-N 2 0 208.349 2.147 20 0 BEADRP CC[C@@H]1C[N@H+](CCCCCC[NH3+])[C@H](CC)CO1 ZINC000403731892 958835275 /nfs/dbraw/zinc/83/52/75/958835275.db2.gz BABZVGRCCDWKKW-ZIAGYGMSSA-N 2 0 242.407 2.395 20 0 BEADRP CC[C@H]1CCC[N@H+](C[C@H]2C[C@@H]([NH3+])C2)CC1 ZINC000693581719 958870073 /nfs/dbraw/zinc/87/00/73/958870073.db2.gz ZYVOLOHKHKHJGE-RWMBFGLXSA-N 2 0 210.365 2.236 20 0 BEADRP C1=C[C@@H]2C[C@H]1C[C@@H]2C[N@@H+]1CC[C@]2(C1)CCC[NH2+]C2 ZINC001222141454 972389160 /nfs/dbraw/zinc/38/91/60/972389160.db2.gz MJDLCTPHQVJXFB-ZJIFWQFVSA-N 2 0 246.398 2.274 20 0 BEADRP C[C@H]1C[N@H+](C[C@H]2C[C@@H]([NH3+])C2)CCc2ccccc21 ZINC000693618756 959006198 /nfs/dbraw/zinc/00/61/98/959006198.db2.gz ZCYFLKMHBQSRBB-KCQAQPDRSA-N 2 0 244.382 2.386 20 0 BEADRP C(C1CCC1)[N@@H+]1CCC[C@@]12CCC[NH2+]C2 ZINC001222231150 972412871 /nfs/dbraw/zinc/41/28/71/972412871.db2.gz JZBUBCHFRFBDPS-CYBMUJFWSA-N 2 0 208.349 2.005 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]CCC2SCCS2)C1 ZINC000693778510 959279370 /nfs/dbraw/zinc/27/93/70/959279370.db2.gz YYJDOKOXQCWLEL-ZJUUUORDSA-N 2 0 246.445 2.042 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+]CC2(C3CC3)CC2)C12CCC2 ZINC000405258564 959422205 /nfs/dbraw/zinc/42/22/05/959422205.db2.gz HUCMFZNZYPMVDH-NWDGAFQWSA-N 2 0 220.360 2.036 20 0 BEADRP Cc1ccsc1C[NH2+][C@@H]1C[C@H]([NH3+])C12CCC2 ZINC000405263903 959423924 /nfs/dbraw/zinc/42/39/24/959423924.db2.gz OMCHBKFYSURLAG-NWDGAFQWSA-N 2 0 236.384 2.416 20 0 BEADRP Cc1ccsc1C[NH2+][C@H]1C[C@H]([NH3+])C12CCC2 ZINC000405263907 959424705 /nfs/dbraw/zinc/42/47/05/959424705.db2.gz OMCHBKFYSURLAG-RYUDHWBXSA-N 2 0 236.384 2.416 20 0 BEADRP CC(C)([NH3+])CC[NH2+][C@H]1CCC12CCCC2 ZINC000693887500 959479554 /nfs/dbraw/zinc/47/95/54/959479554.db2.gz NVBKZQAFZANEBX-NSHDSACASA-N 2 0 210.365 2.426 20 0 BEADRP CC(C)([NH3+])CC[NH2+][C@@H]1CCC12CCCC2 ZINC000693887499 959479979 /nfs/dbraw/zinc/47/99/79/959479979.db2.gz NVBKZQAFZANEBX-LLVKDONJSA-N 2 0 210.365 2.426 20 0 BEADRP CC(C)C[C@@H](C)C[N@@H+]1CC[C@H](CC[NH3+])C1 ZINC000300993772 959486023 /nfs/dbraw/zinc/48/60/23/959486023.db2.gz WAEHFIHHWDFJQL-OLZOCXBDSA-N 2 0 212.381 2.339 20 0 BEADRP CCCCC[C@@H](C)[NH2+]CC12CC(C1)C[NH2+]2 ZINC000694515170 959899593 /nfs/dbraw/zinc/89/95/93/959899593.db2.gz MLUWYPPXNULYBF-PNESKVBLSA-N 2 0 210.365 2.297 20 0 BEADRP Cc1sccc1C[N@H+]1C[C@H](C)[C@H](C[NH3+])C1 ZINC000708865058 959985656 /nfs/dbraw/zinc/98/56/56/959985656.db2.gz ZFCSALDAEPGTSM-JOYOIKCWSA-N 2 0 224.373 2.083 20 0 BEADRP CCCCC(CCCC)[N@@H+]1C[C@H](N)C[C@H](O)C1 ZINC001246537073 972474069 /nfs/dbraw/zinc/47/40/69/972474069.db2.gz AYQSKEREGIMGIM-OCCSQVGLSA-N 2 0 242.407 2.129 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+][C@@H]2CCCC(F)(F)C2)C12CCC2 ZINC000695112757 960105754 /nfs/dbraw/zinc/10/57/54/960105754.db2.gz MFHFMFWVCAXKOR-MXWKQRLJSA-N 2 0 244.329 2.424 20 0 BEADRP [NH3+][C@H]1CCC[N@H+](CC2CCC3(CC3)CC2)C1 ZINC000695761930 960431761 /nfs/dbraw/zinc/43/17/61/960431761.db2.gz KHKHOFVVRZPMFG-ZDUSSCGKSA-N 2 0 222.376 2.380 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+][C@@H]1CCCC2(CC2)C1 ZINC000695765020 960445701 /nfs/dbraw/zinc/44/57/01/960445701.db2.gz SJMJIVGBCPSFMD-YNEHKIRRSA-N 2 0 222.376 2.426 20 0 BEADRP C/C(=C\C=C\N)[NH2+]CCC[N@H+]1CCCC[C@@H]1C ZINC001167753379 960544611 /nfs/dbraw/zinc/54/46/11/960544611.db2.gz OBCNBPHBNSLTHF-CVUZOVOKSA-N 2 0 237.391 2.217 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2CCC[C@@H]2c2ccncc2)CC[NH2+]1 ZINC000709467544 960611135 /nfs/dbraw/zinc/61/11/35/960611135.db2.gz UMNAQUPEGQMUFW-BPLDGKMQSA-N 2 0 245.370 2.359 20 0 BEADRP C[C@H](C[NH3+])C[N@H+](C)[C@H]1CCCC(C)(C)C1 ZINC000709525819 960633361 /nfs/dbraw/zinc/63/33/61/960633361.db2.gz RTKRSYRGDVFZRW-NEPJUHHUSA-N 2 0 212.381 2.482 20 0 BEADRP Cc1cc(C)cc(C[N@@H+]2CC[C@@H](CC[NH3+])C2)c1 ZINC000125535824 960835238 /nfs/dbraw/zinc/83/52/38/960835238.db2.gz DENFXVDDTNQMRG-CQSZACIVSA-N 2 0 232.371 2.474 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@H]2CC[NH2+][C@@H](C)C2)C1 ZINC000300056243 961005982 /nfs/dbraw/zinc/00/59/82/961005982.db2.gz OHYYVIKXDUQDIL-VOAKCMCISA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]CCOC2CCC2)CC1 ZINC000690688487 961173716 /nfs/dbraw/zinc/17/37/16/961173716.db2.gz MZFKKYHMSWQFDB-UHFFFAOYSA-N 2 0 240.391 2.018 20 0 BEADRP Cl/C=C\C[NH+]1CCC([C@H]2CCC[NH2+]C2)CC1 ZINC000692915156 961322517 /nfs/dbraw/zinc/32/25/17/961322517.db2.gz LSKNFKZVXNRRAH-XYRDXQRHSA-N 2 0 242.794 2.451 20 0 BEADRP C[NH+](C)C[C@@]12C[C@@H]1C[N@H+](C[C@H]1C[C@H]3C=C[C@@H]1C3)C2 ZINC001207631588 961403288 /nfs/dbraw/zinc/40/32/88/961403288.db2.gz JNEWPUYQDCNBRE-UYJHQMFVSA-N 2 0 246.398 2.082 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H]1C[C@H]2C[C@H]2C1 ZINC001167892141 961493202 /nfs/dbraw/zinc/49/32/02/961493202.db2.gz SGDFNOSBZBIKKM-CLLJXQQHSA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)[NH+]1CCC(C[NH2+][C@H]2C[C@H]3C[C@H]3C2)CC1 ZINC001167899086 961537739 /nfs/dbraw/zinc/53/77/39/961537739.db2.gz WUDQODPLDSGEBO-FICVDOATSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@@H+]1CCC[C@H](C2CCC2)C1 ZINC000692926523 961746327 /nfs/dbraw/zinc/74/63/27/961746327.db2.gz KDUNELPTMCLDPN-SNPRPXQTSA-N 2 0 236.403 2.354 20 0 BEADRP C[N@@H+](C/C=C/Cl)CCCCCC[NH3+] ZINC000710683723 961773373 /nfs/dbraw/zinc/77/33/73/961773373.db2.gz KNKHCCVDTOFZBA-VOTSOKGWSA-N 2 0 204.745 2.190 20 0 BEADRP [NH2+]=C(Nc1ccc(CF)cc1)SCC[NH3+] ZINC001167915170 961839937 /nfs/dbraw/zinc/83/99/37/961839937.db2.gz RNVSWVCCPWKGDR-UHFFFAOYSA-N 2 0 227.308 2.195 20 0 BEADRP [NH3+]C1(CC2CC2)CC[NH+]([C@H]2C[C@H]3C[C@H]3C2)CC1 ZINC001167916146 961861719 /nfs/dbraw/zinc/86/17/19/961861719.db2.gz FWZOKSVOCWNPGI-WDNDVIMCSA-N 2 0 234.387 2.378 20 0 BEADRP C[C@@H]1CC[C@@H]([NH+]2CCN(c3cc[nH+]cc3)CC2)C1 ZINC000092874348 961898259 /nfs/dbraw/zinc/89/82/59/961898259.db2.gz HMADQCBECSBUIZ-UKRRQHHQSA-N 2 0 245.370 2.392 20 0 BEADRP C[NH+](C)[C@H]1CC[C@@H]([NH2+][C@@H]2C[C@H]3C[C@H]3C2)CC1 ZINC001167919175 961926169 /nfs/dbraw/zinc/92/61/69/961926169.db2.gz UQMFDFXIMDBYII-KYGRNUTJSA-N 2 0 222.376 2.247 20 0 BEADRP Cc1cc(C[N@@H+]2CCCC[C@@H](C[NH3+])C2)cc(C)n1 ZINC001206632864 962150194 /nfs/dbraw/zinc/15/01/94/962150194.db2.gz PJJSYOFMUBBCGL-AWEZNQCLSA-N 2 0 247.386 2.259 20 0 BEADRP C[N@H+](CCC[NH+]1CCCC1)[C@H]1C[C@H]2C[C@H]2C1 ZINC001167941352 962193611 /nfs/dbraw/zinc/19/36/11/962193611.db2.gz XCQZPXFABNMXHQ-WDNDVIMCSA-N 2 0 222.376 2.203 20 0 BEADRP C[C@@H]1CC[C@@H]([NH+]2CC3(C2)CCC[NH2+]C3)C[C@@H]1C ZINC000709984267 962211812 /nfs/dbraw/zinc/21/18/12/962211812.db2.gz RHKAKHHIZYEJAX-HZSPNIEDSA-N 2 0 236.403 2.497 20 0 BEADRP C[N@@H+]1CCC[C@H]1CC[NH2+][C@@H]1CCOC(C)(C)C1 ZINC000710384748 962376794 /nfs/dbraw/zinc/37/67/94/962376794.db2.gz MZFQKCYTDGAPSI-OLZOCXBDSA-N 2 0 240.391 2.018 20 0 BEADRP C(C1CC1)[N@H+]1[C@@H]2CC[C@H]1CC([NH+]1CCC1)C2 ZINC001167981728 963066757 /nfs/dbraw/zinc/06/67/57/963066757.db2.gz GYAYPJVTDPFLQU-PBWFPOADSA-N 2 0 220.360 2.098 20 0 BEADRP C(C[NH2+]C1CC1)C[N@@H+]1CCC[C@H]1C1CCC1 ZINC000688239841 963094413 /nfs/dbraw/zinc/09/44/13/963094413.db2.gz NAGZOXYOLVFRDH-AWEZNQCLSA-N 2 0 222.376 2.393 20 0 BEADRP Cc1c[nH+]c(N[C@H]2CC[C@@H]3C[NH2+]C[C@@H]32)c(C)c1 ZINC001155586542 963118918 /nfs/dbraw/zinc/11/89/18/963118918.db2.gz YFVIPYHWEQTQBK-AGIUHOORSA-N 2 0 231.343 2.108 20 0 BEADRP C[C@@H]1C[N@H+](C[C@@H]2CCC(F)(F)C2)CC[C@H]1C[NH3+] ZINC000302389071 963365734 /nfs/dbraw/zinc/36/57/34/963365734.db2.gz IZSJTNIPULOJFQ-UTUOFQBUSA-N 2 0 246.345 2.339 20 0 BEADRP CC(C)C[N@H+](C[C@@H]1CCCC[NH2+]C1)C1CC1 ZINC000697052635 963680674 /nfs/dbraw/zinc/68/06/74/963680674.db2.gz OCJMCKIKYNXZJV-CYBMUJFWSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C2CCC(CC[NH3+])CC2)CCO1 ZINC001168090328 963681331 /nfs/dbraw/zinc/68/13/31/963681331.db2.gz CESITGIGXQWSGE-RYSNWHEDSA-N 2 0 240.391 2.051 20 0 BEADRP Cc1[nH+]c(N2CCC[C@H]([NH3+])[C@@H]2C)cc2[nH]ccc21 ZINC001157746116 963715084 /nfs/dbraw/zinc/71/50/84/963715084.db2.gz PYFJFWAXSOWCOT-JQWIXIFHSA-N 2 0 244.342 2.187 20 0 BEADRP Cc1[nH+]c(N2CCC[C@@H]([NH3+])[C@@H]2C)cc2[nH]ccc21 ZINC001157746115 963715646 /nfs/dbraw/zinc/71/56/46/963715646.db2.gz PYFJFWAXSOWCOT-CMPLNLGQSA-N 2 0 244.342 2.187 20 0 BEADRP [NH3+]C[C@@]1(F)CCN(c2nccc3ccccc32)C1 ZINC001157808413 963730195 /nfs/dbraw/zinc/73/01/95/963730195.db2.gz GGDSFAGRUJLGCJ-AWEZNQCLSA-N 2 0 245.301 2.112 20 0 BEADRP Cc1cc2cc[nH]c2c(NC2(C)CC[NH2+]CC2)[nH+]1 ZINC001168182536 963936663 /nfs/dbraw/zinc/93/66/63/963936663.db2.gz TZGVNGODFZSIOJ-UHFFFAOYSA-N 2 0 244.342 2.425 20 0 BEADRP Cc1c[nH+]c(NC2(C)CC[NH2+]CC2)c2[nH]ccc21 ZINC001168183657 963940065 /nfs/dbraw/zinc/94/00/65/963940065.db2.gz LLDLPGRNNCFNHH-UHFFFAOYSA-N 2 0 244.342 2.425 20 0 BEADRP Nc1cc(Nc2ccc3c(c2)C[NH2+]C3)cc[nH+]1 ZINC001159114418 964004061 /nfs/dbraw/zinc/00/40/61/964004061.db2.gz ZWDLEPDVWWMMHJ-UHFFFAOYSA-N 2 0 226.283 2.011 20 0 BEADRP C([NH+]=c1ccc2ns[nH]c-2c1)=C1CC[NH2+]CC1 ZINC001159446930 964095556 /nfs/dbraw/zinc/09/55/56/964095556.db2.gz FUUUKDZPOPRJIH-UHFFFAOYSA-N 2 0 246.339 2.371 20 0 BEADRP COc1ccc2c[nH+]c(NCC[C@@H](C)[NH3+])cc2c1 ZINC001159773234 964191053 /nfs/dbraw/zinc/19/10/53/964191053.db2.gz YQRKSOPAPVQYPC-SNVBAGLBSA-N 2 0 245.326 2.393 20 0 BEADRP c1cc([C@H]2CC[NH2+]C2)ccc1NC1=CCC[NH2+]C1 ZINC001159775837 964191071 /nfs/dbraw/zinc/19/10/71/964191071.db2.gz NFCFYEAPUGRMKO-ZDUSSCGKSA-N 2 0 243.354 2.053 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)[C@H](C)Cc1ccncc1 ZINC001256747088 1169837924 /nfs/dbraw/zinc/83/79/24/1169837924.db2.gz CLJNPUWJPHQDEK-CQSZACIVSA-N 2 0 249.402 2.286 20 0 BEADRP C[NH+](C)C1CCC([NH2+]COc2ccccc2)CC1 ZINC001168304038 964396745 /nfs/dbraw/zinc/39/67/45/964396745.db2.gz LONXWLFFACAJED-UHFFFAOYSA-N 2 0 248.370 2.485 20 0 BEADRP C[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)c1ccno1 ZINC001168315708 964419195 /nfs/dbraw/zinc/41/91/95/964419195.db2.gz LCUOUVRYYVKRIV-VOMCLLRMSA-N 2 0 237.347 2.198 20 0 BEADRP CC(C)[NH+]1CC(Nc2cccc3c2CC[C@H]3[NH3+])C1 ZINC001168317424 964431822 /nfs/dbraw/zinc/43/18/22/964431822.db2.gz KTVVRQPPIFQVOW-CQSZACIVSA-N 2 0 245.370 2.137 20 0 BEADRP COc1cc[nH+]c(NCc2ccccc2C[NH3+])c1 ZINC001160906395 964442096 /nfs/dbraw/zinc/44/20/96/964442096.db2.gz WVVVBDALKNNTHJ-UHFFFAOYSA-N 2 0 243.310 2.161 20 0 BEADRP C[NH+](C)C1CCC([N@@H+]2CCC[C@H](F)C2)CC1 ZINC001168323441 964447360 /nfs/dbraw/zinc/44/73/60/964447360.db2.gz ZLKRKGWWZFDZFF-HIFPTAJRSA-N 2 0 228.355 2.293 20 0 BEADRP C[NH+](C)C1CCC([N@@H+]2CCC[C@@H]3C[C@@H]32)CC1 ZINC001168329511 964458587 /nfs/dbraw/zinc/45/85/87/964458587.db2.gz WDOKBRLIPLZOIP-RYSNWHEDSA-N 2 0 222.376 2.344 20 0 BEADRP Cc1cccc2cc[nH+]c(NC/C=C/C[NH3+])c12 ZINC001160982268 964465033 /nfs/dbraw/zinc/46/50/33/964465033.db2.gz GVFZOGKRFVZOAS-NSCUHMNNSA-N 2 0 227.311 2.470 20 0 BEADRP CC[C@H]([NH2+]CC[C@H](C)[NH+](C)C)C1CCC1 ZINC000697824824 964544390 /nfs/dbraw/zinc/54/43/90/964544390.db2.gz MGNANTMEDBIDTH-AAEUAGOBSA-N 2 0 212.381 2.495 20 0 BEADRP C[C@@H](CC[NH2+][C@H]1CCCSCC1)[NH+](C)C ZINC000697846255 964565543 /nfs/dbraw/zinc/56/55/43/964565543.db2.gz BZIIGUOBLCEKMP-RYUDHWBXSA-N 2 0 230.421 2.202 20 0 BEADRP C[C@@H](CC[NH2+][C@H]1CCC[C@@H]2C[C@@H]21)[NH+](C)C ZINC000697869833 964595443 /nfs/dbraw/zinc/59/54/43/964595443.db2.gz IXSHDOMEIHBGTQ-RNJOBUHISA-N 2 0 210.365 2.105 20 0 BEADRP C[C@H](CC[NH2+][C@@H]1CCC(C)(C)C1)[NH+](C)C ZINC000697879261 964604044 /nfs/dbraw/zinc/60/40/44/964604044.db2.gz NEGORBXNZKGEKB-VXGBXAGGSA-N 2 0 212.381 2.495 20 0 BEADRP c1ccc([C@@H]2C[C@@H]2[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000149714484 964614565 /nfs/dbraw/zinc/61/45/65/964614565.db2.gz OOUPHCVQCFQHLO-YKUJZXIWSA-N 2 0 242.366 2.415 20 0 BEADRP C[C@H]([NH2+]CCCCCC[NH3+])c1cscn1 ZINC000697905351 964672965 /nfs/dbraw/zinc/67/29/65/964672965.db2.gz LAAGZTLAGZUGCL-JTQLQIEISA-N 2 0 227.377 2.313 20 0 BEADRP Cc1ccc(NCC[NH+](C)C)c(C[NH+](C)C)c1 ZINC001161672976 964676338 /nfs/dbraw/zinc/67/63/38/964676338.db2.gz RGCODZLFPHKVIL-UHFFFAOYSA-N 2 0 235.375 2.030 20 0 BEADRP C[NH+](C)CCNc1cccc(C2=[NH+]CCC2)c1 ZINC001161672931 964677893 /nfs/dbraw/zinc/67/78/93/964677893.db2.gz OSJCGMVEEJFZPA-UHFFFAOYSA-N 2 0 231.343 2.243 20 0 BEADRP CC[NH+]1CCC(C[NH+]2CCCCC2)CC1 ZINC000200718691 964728583 /nfs/dbraw/zinc/72/85/83/964728583.db2.gz CPMBFHYVJZDBSM-UHFFFAOYSA-N 2 0 210.365 2.204 20 0 BEADRP CCc1cc(NC[C@H]2CCC[NH2+]C[C@@H]2C)cc[nH+]1 ZINC001162471979 964988055 /nfs/dbraw/zinc/98/80/55/964988055.db2.gz RZABEZOVYUPLGY-QWHCGFSZSA-N 2 0 247.386 2.114 20 0 BEADRP CC1(CC[NH2+][C@H]2C[C@@H]([NH3+])C23CCC3)CC1 ZINC000698118043 965018217 /nfs/dbraw/zinc/01/82/17/965018217.db2.gz ZPZHLJFJXWUKGQ-MNOVXSKESA-N 2 0 208.349 2.036 20 0 BEADRP C[C@H]([NH3+])c1ccc(NC[C@H]2C[NH2+][C@H](C)C2)cc1 ZINC001162556544 965049178 /nfs/dbraw/zinc/04/91/78/965049178.db2.gz JPMNZCWTXIXRAU-GRYCIOLGSA-N 2 0 233.359 2.116 20 0 BEADRP Cc1cccnc1NC[C@]1(F)CCCC[NH2+]C1 ZINC001162574253 965051346 /nfs/dbraw/zinc/05/13/46/965051346.db2.gz XAVQNQDUSFYMNL-ZDUSSCGKSA-N 2 0 237.322 2.284 20 0 BEADRP C[C@H]1[NH2+]CC[C@H]1Nc1ccc([C@@H]2CCC[NH2+]2)cc1 ZINC001162677899 965108436 /nfs/dbraw/zinc/10/84/36/965108436.db2.gz VTOCYJHEEBCVDZ-DFBGVHRSSA-N 2 0 245.370 2.273 20 0 BEADRP c1ccc([C@@H]2[NH2+]CC[C@H]2Nc2cc[nH+]cc2)cc1 ZINC001163206033 965299850 /nfs/dbraw/zinc/29/98/50/965299850.db2.gz DMPSSUYYINDAGK-CABCVRRESA-N 2 0 239.322 2.019 20 0 BEADRP CC(C)[N@@H+]1CC[C@@H](Nc2cccc(N)[nH+]2)[C@H](C)C1 ZINC001163365413 965369994 /nfs/dbraw/zinc/36/99/94/965369994.db2.gz ZVKAJMURYHKZIO-VXGBXAGGSA-N 2 0 248.374 2.195 20 0 BEADRP Cc1c[nH+]c(N(C)CCC[NH+](C)C)cc1C ZINC001163600423 965471576 /nfs/dbraw/zinc/47/15/76/965471576.db2.gz HHMHTFFIOFWPIE-UHFFFAOYSA-N 2 0 221.348 2.086 20 0 BEADRP CCCOCC[NH2+]C1CC[NH+](CC(C)C)CC1 ZINC000714974919 965573767 /nfs/dbraw/zinc/57/37/67/965573767.db2.gz OGYCWTNJLPZNIU-UHFFFAOYSA-N 2 0 242.407 2.123 20 0 BEADRP [NH3+][C@@H]1CCC[N@H+](Cc2ccc3[nH]ccc3c2)CC1 ZINC001205094387 965726246 /nfs/dbraw/zinc/72/62/46/965726246.db2.gz LUIIOHHAFZIZFN-CQSZACIVSA-N 2 0 243.354 2.481 20 0 BEADRP [NH3+][C@@H]1CCC[N@H+](Cc2ccc3cc[nH]c3c2)CC1 ZINC001205094729 965729608 /nfs/dbraw/zinc/72/96/08/965729608.db2.gz OTRFWOZKQWFRKW-CQSZACIVSA-N 2 0 243.354 2.481 20 0 BEADRP CCOc1ccc(C[N@@H+]2CCC[C@@H]([NH3+])CC2)cc1 ZINC001205094681 965729694 /nfs/dbraw/zinc/72/96/94/965729694.db2.gz OACZNZFMLLKBKB-CQSZACIVSA-N 2 0 248.370 2.399 20 0 BEADRP CN(C)c1ccccc1C[N@@H+]1CCC[C@@H]([NH3+])CC1 ZINC001205094904 965735581 /nfs/dbraw/zinc/73/55/81/965735581.db2.gz RIVYKWBAJZCEBF-CQSZACIVSA-N 2 0 247.386 2.066 20 0 BEADRP [NH3+][C@@H]1CCC[N@H+](Cc2c[nH]c3ccccc23)CC1 ZINC001205095197 965739409 /nfs/dbraw/zinc/73/94/09/965739409.db2.gz VEQCZXYVYLYTKO-CYBMUJFWSA-N 2 0 243.354 2.481 20 0 BEADRP Cc1[nH]c2ccc(N(CCC[NH3+])C(C)C)cc2[nH+]1 ZINC001164123057 965745147 /nfs/dbraw/zinc/74/51/47/965745147.db2.gz XYLKWOKLAOMKPW-UHFFFAOYSA-N 2 0 246.358 2.435 20 0 BEADRP CC1(C)[C@@H]2C[N@@H+](CC3C[C@H]4CC[C@@H](C3)[NH2+]4)C[C@@H]21 ZINC000699206906 965816965 /nfs/dbraw/zinc/81/69/65/965816965.db2.gz PEOLZNFPVDKRPV-LTQVTBIESA-N 2 0 234.387 2.105 20 0 BEADRP C[C@@H]1C[C@H](C)C[N@@H+](CC2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000699206719 965817350 /nfs/dbraw/zinc/81/73/50/965817350.db2.gz YXJAWKQNMIICLW-AXOHJZAGSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@@H](C[NH+](C)C)Oc1cccc2c1CC[N@H+](C)C2 ZINC001234421307 965819856 /nfs/dbraw/zinc/81/98/56/965819856.db2.gz CUVFTODSBRFXCY-LBPRGKRZSA-N 2 0 248.370 2.003 20 0 BEADRP Cc1c[nH+]c(N2C[C@@H](C[NH3+])CC[C@@H]2C)cc1C ZINC001164474580 965896757 /nfs/dbraw/zinc/89/67/57/965896757.db2.gz SBZMHFACJRXZBQ-QWHCGFSZSA-N 2 0 233.359 2.262 20 0 BEADRP Cc1ccnc(C[NH2+]C2CCC([NH+](C)C)CC2)c1 ZINC000715222075 965975434 /nfs/dbraw/zinc/97/54/34/965975434.db2.gz WPXRBYZOPFSXMO-UHFFFAOYSA-N 2 0 247.386 2.352 20 0 BEADRP CC1=C[C@H](C)[C@H](CN2CC[C@@H]3[NH2+]CC[C@H]32)CC1 ZINC001235039606 965991830 /nfs/dbraw/zinc/99/18/30/965991830.db2.gz VWBYIUXOKAPWBI-ZQDZILKHSA-N 2 0 234.387 2.415 20 0 BEADRP C1=C[C@@H]2C[C@H]1C[C@@H]2C[N@@H+]1CCCC[C@]12CC[NH2+]C2 ZINC001235124266 966008664 /nfs/dbraw/zinc/00/86/64/966008664.db2.gz LIFMWFYSFIMCAN-ZJIFWQFVSA-N 2 0 246.398 2.417 20 0 BEADRP Cc1c[nH+]c(N2CCC(C3C[NH2+]C3)CC2)cc1C ZINC001165413062 966097729 /nfs/dbraw/zinc/09/77/29/966097729.db2.gz WFEJQCNRLIOOQW-UHFFFAOYSA-N 2 0 245.370 2.134 20 0 BEADRP CCCC[C@@H](CC)C[NH+]1CC(C)(C[NH3+])C1 ZINC001206710932 966187095 /nfs/dbraw/zinc/18/70/95/966187095.db2.gz BAZGBEPIEXQKIN-GFCCVEGCSA-N 2 0 212.381 2.483 20 0 BEADRP CC1(C[NH3+])C[NH+](CCCCc2ccccc2)C1 ZINC001206712250 966261781 /nfs/dbraw/zinc/26/17/81/966261781.db2.gz YVGXULFEPFQTLK-UHFFFAOYSA-N 2 0 232.371 2.290 20 0 BEADRP C[NH2+]Cc1cccc(Nc2cc(N)c(C)c[nH+]2)c1 ZINC001167033651 966526303 /nfs/dbraw/zinc/52/63/03/966526303.db2.gz PKZSHUBSUZWLHN-UHFFFAOYSA-N 2 0 242.326 2.435 20 0 BEADRP C[C@@H]1CCCC[N@H+](C[C@@]2(C)CCC[NH2+]C2)C1 ZINC000705575806 966737088 /nfs/dbraw/zinc/73/70/88/966737088.db2.gz DXSJJZKYPKTLQJ-KGLIPLIRSA-N 2 0 224.392 2.498 20 0 BEADRP CCC1(Nc2cc[nH+]c(C3CC3)c2)C[NH2+]C1 ZINC001168582535 966923955 /nfs/dbraw/zinc/92/39/55/966923955.db2.gz SZSFPDIKAOUBKO-UHFFFAOYSA-N 2 0 217.316 2.123 20 0 BEADRP CC(C)[C@@H]1CCC[N@@H+]1CC[NH2+]C(C)(C)C ZINC000084125902 966926720 /nfs/dbraw/zinc/92/67/20/966926720.db2.gz AZBWSRWDWJGJMH-LBPRGKRZSA-N 2 0 212.381 2.495 20 0 BEADRP CCC1(Nc2ccc3[nH]c[nH+]c3c2C)C[NH2+]C1 ZINC001168584095 966933773 /nfs/dbraw/zinc/93/37/73/966933773.db2.gz YUNJXQKMJGEFFR-UHFFFAOYSA-N 2 0 230.315 2.035 20 0 BEADRP Cc1cc(C[NH+]2CCC(C[NH3+])CC2)oc1C ZINC001205033494 967298176 /nfs/dbraw/zinc/29/81/76/967298176.db2.gz ITUTWNVBXZQXGC-UHFFFAOYSA-N 2 0 222.332 2.067 20 0 BEADRP Cc1c(O)cccc1CN1[C@@H](C)CC[C@H]1C[NH3+] ZINC001205075316 967328941 /nfs/dbraw/zinc/32/89/41/967328941.db2.gz HXKRCHYWMMYYQU-GWCFXTLKSA-N 2 0 234.343 2.012 20 0 BEADRP [NH3+][C@@H]1CCC[N@H+](Cc2cccc3cc[nH]c32)CC1 ZINC001205109298 967351078 /nfs/dbraw/zinc/35/10/78/967351078.db2.gz DPYPWTDLOONJDJ-CQSZACIVSA-N 2 0 243.354 2.481 20 0 BEADRP Cc1cc(C[N@@H+]2CCC[C@@H]([NH3+])CC2)ccc1O ZINC001205110121 967358820 /nfs/dbraw/zinc/35/88/20/967358820.db2.gz PCXJUKMCFHACDD-CYBMUJFWSA-N 2 0 234.343 2.014 20 0 BEADRP C[C@H]1C[N@H+](Cc2cc(C(C)(C)C)c[nH]2)C[C@H]1C[NH3+] ZINC001205155992 967401054 /nfs/dbraw/zinc/40/10/54/967401054.db2.gz LAHAHCQWYQPNPP-NWDGAFQWSA-N 2 0 249.402 2.339 20 0 BEADRP CCc1cccc(CN2CC[C@@H]([NH3+])[C@H]2C)c1 ZINC001205190945 967419596 /nfs/dbraw/zinc/41/95/96/967419596.db2.gz SJIXCGUORGVVIR-BXUZGUMPSA-N 2 0 218.344 2.171 20 0 BEADRP COc1ccccc1C[N@@H+]1CCC[C@](C)([NH3+])CC1 ZINC001205256074 967445696 /nfs/dbraw/zinc/44/56/96/967445696.db2.gz MOAJTPZBEAMOQI-HNNXBMFYSA-N 2 0 248.370 2.399 20 0 BEADRP Cc1cnc(C[N@@H+]2CCC[C@](C)([NH3+])CC2)c(C)c1 ZINC001205296170 967494064 /nfs/dbraw/zinc/49/40/64/967494064.db2.gz IICICOQJSIQKLF-HNNXBMFYSA-N 2 0 247.386 2.402 20 0 BEADRP CS[C@H](C)CC[N@@H+]1CCC[C@](F)(C[NH3+])CC1 ZINC001205546028 967687839 /nfs/dbraw/zinc/68/78/39/967687839.db2.gz PDGGCIWHBLMORE-VXGBXAGGSA-N 2 0 248.411 2.281 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@](F)(C[NH3+])CC2)o1 ZINC001205546469 967692483 /nfs/dbraw/zinc/69/24/83/967692483.db2.gz VYBIBZLSELWPPF-CYBMUJFWSA-N 2 0 240.322 2.241 20 0 BEADRP C[C@H]1CC[N@H+](Cc2ccccc2)CC[C@H]1C[NH3+] ZINC001205603628 967719861 /nfs/dbraw/zinc/71/98/61/967719861.db2.gz RHXGYYZFKVABAN-ZFWWWQNUSA-N 2 0 232.371 2.493 20 0 BEADRP C[C@H]1CC[N@H+](CCC(F)(F)F)CC[C@H]1C[NH3+] ZINC001205601787 967721583 /nfs/dbraw/zinc/72/15/83/967721583.db2.gz GKLZGIBPLFDCLZ-UWVGGRQHSA-N 2 0 238.297 2.246 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@@H](C)[C@H](C[NH3+])CC2)nc1 ZINC001205626750 967735688 /nfs/dbraw/zinc/73/56/88/967735688.db2.gz IVWSSYLWYITVOC-KGLIPLIRSA-N 2 0 247.386 2.197 20 0 BEADRP Cc1[nH+]c(N[C@H]2C[C@@](C)([NH3+])C2)cc2[nH]ccc21 ZINC001162328984 967808308 /nfs/dbraw/zinc/80/83/08/967808308.db2.gz UZQIXUIMYQHMAD-SWZMTVOYSA-N 2 0 230.315 2.163 20 0 BEADRP C[N@@H+]1CCC[C@@](C)(Nc2[nH+]ccc3[nH]ccc32)C1 ZINC001162330196 967808391 /nfs/dbraw/zinc/80/83/91/967808391.db2.gz BAYDZBHDCNXGPX-CQSZACIVSA-N 2 0 244.342 2.459 20 0 BEADRP Cc1ccc(N[C@@H]2CC[NH2+][C@@H]2C)c(C[NH+](C)C)c1 ZINC001162676280 967886702 /nfs/dbraw/zinc/88/67/02/967886702.db2.gz PULCBNADALDDGH-TZMCWYRMSA-N 2 0 247.386 2.219 20 0 BEADRP [NH3+]CC12CC(C1)C[N@@H+]2C[C@@H]1CC2CCC1CC2 ZINC000694602264 967898114 /nfs/dbraw/zinc/89/81/14/967898114.db2.gz BUHWRFDWJXARFS-IHXHZNKUSA-N 2 0 234.387 2.236 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@H](C)c1cccc(F)c1 ZINC001118059719 967922472 /nfs/dbraw/zinc/92/24/72/967922472.db2.gz SLJLQRBRUADJNL-WDEREUQCSA-N 2 0 224.323 2.474 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@@H](C[NH3+])[C@H](C)C2)o1 ZINC001205983922 967929872 /nfs/dbraw/zinc/92/98/72/967929872.db2.gz QGKOCEMIQVKVJL-YPMHNXCESA-N 2 0 236.359 2.395 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@H](C[NH3+])[C@@H](C)C2)o1 ZINC001205983921 967932190 /nfs/dbraw/zinc/93/21/90/967932190.db2.gz QGKOCEMIQVKVJL-WCQYABFASA-N 2 0 236.359 2.395 20 0 BEADRP C[C@@H]1C[N@H+](CCC2CC2)CCC[C@@H]1C[NH3+] ZINC001205984709 967933240 /nfs/dbraw/zinc/93/32/40/967933240.db2.gz UKSSZRWVMOJZEA-DGCLKSJQSA-N 2 0 210.365 2.093 20 0 BEADRP CCOC(C)(C)C[N@@H+]1CCC[C@H](C[NH3+])[C@H](C)C1 ZINC001205982590 967933641 /nfs/dbraw/zinc/93/36/41/967933641.db2.gz MMAPRRONMHICOK-CHWSQXEVSA-N 2 0 242.407 2.108 20 0 BEADRP Cc1cccc(C[N@@H+]2CCC[C@H](C[NH3+])[C@H](C)C2)n1 ZINC001205992544 967944531 /nfs/dbraw/zinc/94/45/31/967944531.db2.gz FFFFWJSCFQMICT-TZMCWYRMSA-N 2 0 247.386 2.197 20 0 BEADRP C[C@H]1C[N@H+](Cc2ccc(O)cc2)CCC[C@@H]1C[NH3+] ZINC001205996135 967952798 /nfs/dbraw/zinc/95/27/98/967952798.db2.gz VAGORDGSOJGFMQ-GXTWGEPZSA-N 2 0 248.370 2.199 20 0 BEADRP C[C@@H]1C[N@H+](Cc2ccc(O)cc2)CCC[C@@H]1C[NH3+] ZINC001205996138 967953476 /nfs/dbraw/zinc/95/34/76/967953476.db2.gz VAGORDGSOJGFMQ-TZMCWYRMSA-N 2 0 248.370 2.199 20 0 BEADRP C[C@]1(C[NH3+])CCC[N@H+](Cc2cccc(O)c2)CC1 ZINC001206296069 968202033 /nfs/dbraw/zinc/20/20/33/968202033.db2.gz PEBBCXXCYARIPD-HNNXBMFYSA-N 2 0 248.370 2.343 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCC[C@@](C)(C[NH3+])CC1 ZINC001206294007 968202442 /nfs/dbraw/zinc/20/24/42/968202442.db2.gz ILAFNCJFWUWUAQ-QWHCGFSZSA-N 2 0 212.381 2.483 20 0 BEADRP CC[C@@H](C)C[N@@H+]1CCC[C@](C)(C[NH3+])CC1 ZINC001206294004 968203695 /nfs/dbraw/zinc/20/36/95/968203695.db2.gz ILAFNCJFWUWUAQ-OLZOCXBDSA-N 2 0 212.381 2.483 20 0 BEADRP CC[C@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)C(C)C ZINC000400451102 968390189 /nfs/dbraw/zinc/39/01/89/968390189.db2.gz ORCDOKUPSRDTCO-AAEUAGOBSA-N 2 0 212.381 2.399 20 0 BEADRP Cc1cc(C)c(C[N@@H+]2CCCC[C@@H](C[NH3+])C2)[nH]1 ZINC001206616966 968419616 /nfs/dbraw/zinc/41/96/16/968419616.db2.gz VKOLIZUDBQOMJL-ZDUSSCGKSA-N 2 0 235.375 2.192 20 0 BEADRP CCCC[C@H](O)C[NH2+]CCCC[NH+]1CCCC1 ZINC001252108126 968589342 /nfs/dbraw/zinc/58/93/42/968589342.db2.gz KPZNSUCJEYLGJX-AWEZNQCLSA-N 2 0 242.407 2.003 20 0 BEADRP C[NH+](C)CC(C)(C)C[N@H+](C)C(C)(C)C ZINC001207281405 968713707 /nfs/dbraw/zinc/71/37/07/968713707.db2.gz BWBCSIATMXCQRV-UHFFFAOYSA-N 2 0 200.370 2.305 20 0 BEADRP C[NH+](C)CC(C)(C)C[N@@H+]1CCC[C@H](CF)C1 ZINC001207286918 968715490 /nfs/dbraw/zinc/71/54/90/968715490.db2.gz WJDRBTJZKBCBES-GFCCVEGCSA-N 2 0 230.371 2.256 20 0 BEADRP C[C@H]1C[N@@H+](CC2CC[NH2+]CC2)CCC[C@@H]1C ZINC001207437014 968770970 /nfs/dbraw/zinc/77/09/70/968770970.db2.gz ZNZVGPDXXGLBPT-STQMWFEESA-N 2 0 224.392 2.354 20 0 BEADRP C[N@H+](CCC[NH3+])CC1CCC2(CC2)CC1 ZINC000829155634 968826408 /nfs/dbraw/zinc/82/64/08/968826408.db2.gz HSCPMURLBBTWSJ-UHFFFAOYSA-N 2 0 210.365 2.237 20 0 BEADRP C[NH+]1CC2(C1)CC[NH+](C[C@@H]1C[C@H]3C=C[C@@H]1C3)CC2 ZINC001207632112 968848423 /nfs/dbraw/zinc/84/84/23/968848423.db2.gz MIBADMAVCXNEQG-ZNMIVQPWSA-N 2 0 246.398 2.226 20 0 BEADRP Cc1c[nH+]c(NC[C@@H]2CCC[NH2+]C[C@@H]2C)cc1N ZINC001155034952 968859019 /nfs/dbraw/zinc/85/90/19/968859019.db2.gz ZHXBCUATWJAZLR-JQWIXIFHSA-N 2 0 248.374 2.020 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]CCC[C@@H]1CCO1 ZINC001207858100 968892015 /nfs/dbraw/zinc/89/20/15/968892015.db2.gz DIQZRZORESEGGJ-ZIAGYGMSSA-N 2 0 242.407 2.266 20 0 BEADRP C[N@H+]1CC=C(c2c[nH+]cc3cc[nH]c32)CC1 ZINC001241322794 968974402 /nfs/dbraw/zinc/97/44/02/968974402.db2.gz SPQKJAAUGAHCMN-UHFFFAOYSA-N 2 0 213.284 2.282 20 0 BEADRP CC1(C)CCC[C@@H]1[NH2+][C@@H]1C[C@H]([NH3+])C12CCC2 ZINC000405355870 968983758 /nfs/dbraw/zinc/98/37/58/968983758.db2.gz QVSPKSDTPYLEKO-SDDRHHMPSA-N 2 0 222.376 2.425 20 0 BEADRP C[NH+]1CCC(C)(C[NH+]2CC3(CCC3)C2)CC1 ZINC001208108601 969002596 /nfs/dbraw/zinc/00/25/96/969002596.db2.gz WRIIKWZCLCMVNY-UHFFFAOYSA-N 2 0 222.376 2.204 20 0 BEADRP C[N@H+](CCC1CC1)CC1(C)CC[NH+](C)CC1 ZINC001208109544 969005673 /nfs/dbraw/zinc/00/56/73/969005673.db2.gz OFUNVOISKXHTGJ-UHFFFAOYSA-N 2 0 224.392 2.450 20 0 BEADRP C[N@@H+]1CCC=C(c2ccc(C3([NH3+])CC3)cc2)C1 ZINC001241570643 969058337 /nfs/dbraw/zinc/05/83/37/969058337.db2.gz MXSQTFDPJYRTJL-UHFFFAOYSA-N 2 0 228.339 2.353 20 0 BEADRP [NH3+]Cc1ccc(-c2cccc3c2C[NH2+]C3)cc1 ZINC001241914549 969143267 /nfs/dbraw/zinc/14/32/67/969143267.db2.gz BYFRQRAZTNODKK-UHFFFAOYSA-N 2 0 224.307 2.416 20 0 BEADRP CCC[N@H+](C[C@H](O)C[NH2+]C(C)(C)C)[C@H](C)CC ZINC001253384921 969148405 /nfs/dbraw/zinc/14/84/05/969148405.db2.gz MTUAOUHVOGSHJG-CHWSQXEVSA-N 2 0 244.423 2.246 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2CC[C@@H](C)C2)CC1 ZINC001208592890 969148393 /nfs/dbraw/zinc/14/83/93/969148393.db2.gz LWUNOXNJKQDWSO-GFCCVEGCSA-N 2 0 210.365 2.060 20 0 BEADRP CC[NH+]1CCC(C[N@H+]2C[C@@H]3[C@H](C2)C3(C)C)CC1 ZINC001208598618 969151461 /nfs/dbraw/zinc/15/14/61/969151461.db2.gz VAPYQTOSIUHRFP-OKILXGFUSA-N 2 0 236.403 2.306 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2CCC[C@@H](CF)C2)CC1 ZINC001208597984 969152392 /nfs/dbraw/zinc/15/23/92/969152392.db2.gz ORVWBQWFEVEDCU-AWEZNQCLSA-N 2 0 242.382 2.400 20 0 BEADRP Cc1ccc(OCC[N@@H+](C)C2CC[NH2+]CC2)cc1 ZINC000036300528 969154044 /nfs/dbraw/zinc/15/40/44/969154044.db2.gz RAOFSRMGYXVSSQ-UHFFFAOYSA-N 2 0 248.370 2.058 20 0 BEADRP C[C@H]1CCC[N@H+](C[C@H]2CCC[NH+](C)C2)C1 ZINC001208604157 969156686 /nfs/dbraw/zinc/15/66/86/969156686.db2.gz LRJJKCUKDQCIGZ-STQMWFEESA-N 2 0 210.365 2.060 20 0 BEADRP C(CN1CC2(C1)CC[N@H+](CC1CC1)C2)C1CC1 ZINC001208680895 969191650 /nfs/dbraw/zinc/19/16/50/969191650.db2.gz JBBPUEIFMNQBDJ-UHFFFAOYSA-N 2 0 234.387 2.204 20 0 BEADRP CC[NH+]1C[C@H]2C[NH+](CCC3CCCC3)C[C@@H]2C1 ZINC001208699313 969199434 /nfs/dbraw/zinc/19/94/34/969199434.db2.gz TWYORUIJNNCIKI-GJZGRUSLSA-N 2 0 236.403 2.450 20 0 BEADRP CCCCC[C@@H](O)C[NH2+]CCCCC[NH+](C)C ZINC001253549420 969220492 /nfs/dbraw/zinc/22/04/92/969220492.db2.gz QZHDKPWPEUVNAF-CQSZACIVSA-N 2 0 244.423 2.249 20 0 BEADRP CC[NH+]1C[C@@H]2C[NH+](CCCC(C)C)C[C@H]2C1 ZINC001208737760 969228752 /nfs/dbraw/zinc/22/87/52/969228752.db2.gz ZZNVXJRNMSEDCP-ZIAGYGMSSA-N 2 0 224.392 2.306 20 0 BEADRP Cc1cnccc1C[N@@H+]1CCC[C@H](C[NH3+])[C@@H](C)C1 ZINC001205995733 969263825 /nfs/dbraw/zinc/26/38/25/969263825.db2.gz PSICHOYFJPVYRV-UONOGXRCSA-N 2 0 247.386 2.197 20 0 BEADRP CCC[N@H+](CCC[NH+](C)C)C[C@@H](O)C(C)(C)C ZINC001253731964 969351795 /nfs/dbraw/zinc/35/17/95/969351795.db2.gz ZNXKXPCDBUPNNZ-CYBMUJFWSA-N 2 0 244.423 2.057 20 0 BEADRP CCCC[N@H+](C)CCC[NH2+]C[C@@H](O)C(C)(C)C ZINC001253740861 969358937 /nfs/dbraw/zinc/35/89/37/969358937.db2.gz LLVHNTXXFKQNJT-CYBMUJFWSA-N 2 0 244.423 2.105 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+][C@H]1CCC(F)(F)C1)C2 ZINC001169081778 969404569 /nfs/dbraw/zinc/40/45/69/969404569.db2.gz WHIMNTJBEJATAL-YFKTTZPYSA-N 2 0 244.329 2.389 20 0 BEADRP CCCC[N@H+](C)[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169123377 969419136 /nfs/dbraw/zinc/41/91/36/969419136.db2.gz KKASQUFGLFUGLX-CLLJXQQHSA-N 2 0 210.365 2.344 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CCCCC1)C2 ZINC001169123778 969419469 /nfs/dbraw/zinc/41/94/69/969419469.db2.gz MVSSXDKAQLWYQO-ITGUQSILSA-N 2 0 208.349 2.098 20 0 BEADRP C[C@@H]1CCC[N@@H+]([C@@H]2C[C@H]3CC[C@@H](C2)[NH+]3C)C1 ZINC001169123422 969421035 /nfs/dbraw/zinc/42/10/35/969421035.db2.gz LGOKUHAUQIJXDM-YIYPIFLZSA-N 2 0 222.376 2.344 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CC[C@](C)(CF)C1)C2 ZINC001169126499 969433296 /nfs/dbraw/zinc/43/32/96/969433296.db2.gz VHCBWORKGPQETO-ZOBORPQBSA-N 2 0 240.366 2.293 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CCC(CF)CC1)C2 ZINC001169139384 969445584 /nfs/dbraw/zinc/44/55/84/969445584.db2.gz BQETXVJOYSIGGV-WDNDVIMCSA-N 2 0 240.366 2.293 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1C[C@@H]3[C@H](C1)C3(C)C)C2 ZINC001169148792 969464579 /nfs/dbraw/zinc/46/45/79/969464579.db2.gz ZYEKXHQZHWDBHH-IZHRXLMESA-N 2 0 234.387 2.199 20 0 BEADRP CC(C)[N@H+](C[C@@H]1C[C@H]1C)C1CCN(C)CC1 ZINC001209427601 969499214 /nfs/dbraw/zinc/49/92/14/969499214.db2.gz POUKDTVIHKBEIZ-OLZOCXBDSA-N 2 0 224.392 2.447 20 0 BEADRP C[C@H]([NH3+])c1ccn(-c2cc[nH+]c(C3CC3)c2)n1 ZINC001169234976 969521972 /nfs/dbraw/zinc/52/19/72/969521972.db2.gz MYDWSSYVQUFKGK-VIFPVBQESA-N 2 0 228.299 2.164 20 0 BEADRP CC(C)[N@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@H]1CCCOC1 ZINC001254372166 969585902 /nfs/dbraw/zinc/58/59/02/969585902.db2.gz RBELWCUJZGMXPX-IHRRRGAJSA-N 2 0 240.391 2.146 20 0 BEADRP C[N@H+](CCc1cccs1)Cc1cnccc1N ZINC001209735633 969600018 /nfs/dbraw/zinc/60/00/18/969600018.db2.gz ZDUCMWDRCZLOBP-UHFFFAOYSA-N 2 0 247.367 2.230 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH2+]CCc2cccc(O)c2)CC1 ZINC001254499328 969658723 /nfs/dbraw/zinc/65/87/23/969658723.db2.gz CSTFWHRAVDGQSD-CQSZACIVSA-N 2 0 248.370 2.009 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH2+]CCCc2cccnc2)CC1 ZINC001254505182 969672614 /nfs/dbraw/zinc/67/26/14/969672614.db2.gz ZQHWNTVVCOQLHM-OAHLLOKOSA-N 2 0 247.386 2.088 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCC[N@H+](C)CC1)c1ccc(N)cc1 ZINC001254506810 969674068 /nfs/dbraw/zinc/67/40/68/969674068.db2.gz ATXGNMISESYXHR-DOMZBBRYSA-N 2 0 247.386 2.404 20 0 BEADRP CC[N@H+](Cc1ccncc1)[C@H]1CCC[NH+](C)CC1 ZINC001254516166 969687060 /nfs/dbraw/zinc/68/70/60/969687060.db2.gz JPIHVVOBUSPTBR-HNNXBMFYSA-N 2 0 247.386 2.388 20 0 BEADRP Cc1cc(N)[nH+]cc1Nc1cc[nH+]c(N(C)C)c1 ZINC001209964909 969724899 /nfs/dbraw/zinc/72/48/99/969724899.db2.gz HCDTXHOLVCEGJE-UHFFFAOYSA-N 2 0 243.314 2.177 20 0 BEADRP CC(C)([NH3+])c1ccccc1NCC[C@H]1CCC[NH2+]1 ZINC001169568581 969766897 /nfs/dbraw/zinc/76/68/97/969766897.db2.gz CNKUPEOGTPOBIS-GFCCVEGCSA-N 2 0 247.386 2.434 20 0 BEADRP C[NH+](C)CCC(C)(C)Nc1[nH+]ccc2c1CCN2 ZINC001169712137 969829017 /nfs/dbraw/zinc/82/90/17/969829017.db2.gz ZGVDIWIHWYLCFC-UHFFFAOYSA-N 2 0 248.374 2.192 20 0 BEADRP C[NH+](C)CCC(C)(C)Nc1ccc2c(c1)C[NH2+]C2 ZINC001169717130 969831604 /nfs/dbraw/zinc/83/16/04/969831604.db2.gz DYTGZHSAESUVEU-UHFFFAOYSA-N 2 0 247.386 2.432 20 0 BEADRP C[NH+](C)CCC(C)(C)Nc1cccc(C[NH3+])c1 ZINC001169718805 969831994 /nfs/dbraw/zinc/83/19/94/969831994.db2.gz YJLZHMSJJWSUDQ-UHFFFAOYSA-N 2 0 235.375 2.288 20 0 BEADRP C[N@H+](CCCC[NH3+])Cc1nc2ccccc2s1 ZINC001210546573 969932724 /nfs/dbraw/zinc/93/27/24/969932724.db2.gz YGDSJRZQSPXXBI-UHFFFAOYSA-N 2 0 249.383 2.467 20 0 BEADRP [NH3+]CCc1cn([C@@H]2CCSC2)c2cc[nH+]cc12 ZINC001255273690 970024559 /nfs/dbraw/zinc/02/45/59/970024559.db2.gz CZHBDXQDZBEHFH-LLVKDONJSA-N 2 0 247.367 2.216 20 0 BEADRP [NH3+]C1(CC2CC2)CC[NH+]([C@H]2CCSC2)CC1 ZINC001255276810 970029999 /nfs/dbraw/zinc/02/99/99/970029999.db2.gz YZFOVELGXKXBKZ-LBPRGKRZSA-N 2 0 240.416 2.085 20 0 BEADRP C[NH2+]Cc1ccc(Nc2cc[nH+]c(CO)c2)cc1 ZINC001211129302 970155466 /nfs/dbraw/zinc/15/54/66/970155466.db2.gz QOEORRFLYDOSLB-UHFFFAOYSA-N 2 0 243.310 2.037 20 0 BEADRP C[NH2+]Cc1cccc(Nc2c[nH+]c(C)n2C)c1 ZINC001211137993 970159465 /nfs/dbraw/zinc/15/94/65/970159465.db2.gz HJQLCIRBMAUGAY-UHFFFAOYSA-N 2 0 230.315 2.192 20 0 BEADRP COC1CCC([NH2+]C(C)(C)CC[NH+](C)C)CC1 ZINC001255449930 970185010 /nfs/dbraw/zinc/18/50/10/970185010.db2.gz AUHGNEJJHMCMEJ-UHFFFAOYSA-N 2 0 242.407 2.264 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)C1CCC(OC)CC1 ZINC001255464093 970189434 /nfs/dbraw/zinc/18/94/34/970189434.db2.gz AIIJXWYRKHDZMP-UHFFFAOYSA-N 2 0 242.407 2.218 20 0 BEADRP Cn1c[nH+]cc1Nc1ccc(CC[NH+](C)C)cc1 ZINC001211251495 970197490 /nfs/dbraw/zinc/19/74/90/970197490.db2.gz HSGIKSXWSNSJLZ-UHFFFAOYSA-N 2 0 244.342 2.268 20 0 BEADRP CC(C)[N@H+](CCC[NH3+])[C@H]1CCOC(C)(C)C1 ZINC001255527347 970289075 /nfs/dbraw/zinc/28/90/75/970289075.db2.gz KDKGTXUYXAOMKR-LBPRGKRZSA-N 2 0 228.380 2.003 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C(C)(C)CC[NH+](C)C)C1 ZINC001170100915 970290916 /nfs/dbraw/zinc/29/09/16/970290916.db2.gz MUOQWQFZWFXMHG-VXGBXAGGSA-N 2 0 212.381 2.495 20 0 BEADRP COC[C@@H](C)[NH+]1C(C)(C)CC([NH3+])CC1(C)C ZINC001255557446 970334390 /nfs/dbraw/zinc/33/43/90/970334390.db2.gz UGTPZWFLGYGURC-SNVBAGLBSA-N 2 0 228.380 2.002 20 0 BEADRP C[C@@H]1CC[C@H]([N@H+](C)C2CCN(C)CC2)C1 ZINC001170124231 970366077 /nfs/dbraw/zinc/36/60/77/970366077.db2.gz FVPPQXYIYHLJOA-YPMHNXCESA-N 2 0 210.365 2.201 20 0 BEADRP C[C@H](CC(F)(F)F)[NH2+]C(C)(C)C(C)(C)[NH3+] ZINC001255639359 970411402 /nfs/dbraw/zinc/41/14/02/970411402.db2.gz KKGAVJFXBZBZEH-SSDOTTSWSA-N 2 0 226.286 2.433 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2C[C@H]3C[C@@]3(C[NH+](C)C)C2)C1 ZINC001170156345 970482941 /nfs/dbraw/zinc/48/29/41/970482941.db2.gz DJSWOKWRQIJQAF-YIYPIFLZSA-N 2 0 222.376 2.059 20 0 BEADRP [NH3+]C[C@@H]1CC[N@H+](C[C@@H]2CC3CCC2CC3)C1 ZINC000400131573 970550874 /nfs/dbraw/zinc/55/08/74/970550874.db2.gz VGFZHIKAIFMQNU-YIOUJQMASA-N 2 0 222.376 2.093 20 0 BEADRP CC[C@@H]1C[C@H]([NH2+]CCCCCCC[NH3+])CCO1 ZINC001170178096 970552487 /nfs/dbraw/zinc/55/24/87/970552487.db2.gz MZNJIGUJMNPGDF-ZIAGYGMSSA-N 2 0 242.407 2.443 20 0 BEADRP CC[C@H]1C[C@H]([NH2+]CCCCCCC[NH3+])CCO1 ZINC001170178093 970553694 /nfs/dbraw/zinc/55/36/94/970553694.db2.gz MZNJIGUJMNPGDF-KGLIPLIRSA-N 2 0 242.407 2.443 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]CC1CCOCC1 ZINC001255940576 970568381 /nfs/dbraw/zinc/56/83/81/970568381.db2.gz DQOQJCBYLMGWFL-CYBMUJFWSA-N 2 0 242.407 2.123 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]CC1(O)CCCC1 ZINC001255941236 970570860 /nfs/dbraw/zinc/57/08/60/970570860.db2.gz LVQCPMBKVXEUMO-CYBMUJFWSA-N 2 0 242.407 2.002 20 0 BEADRP CC[NH+](CC)CC[C@H](C)n1ccnc1[C@@H](C)[NH3+] ZINC001255940627 970571006 /nfs/dbraw/zinc/57/10/06/970571006.db2.gz FDPYJEAWEMCGBA-NWDGAFQWSA-N 2 0 238.379 2.196 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+][C@H](COC)C(C)C ZINC001255941600 970573666 /nfs/dbraw/zinc/57/36/66/970573666.db2.gz UQMAQIOLWDIDAG-UONOGXRCSA-N 2 0 244.423 2.367 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]C1CCC(=O)CC1 ZINC001255945710 970575446 /nfs/dbraw/zinc/57/54/46/970575446.db2.gz IHPOCYROFLUCKA-GFCCVEGCSA-N 2 0 240.391 2.208 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]CC1CSC1 ZINC001255942633 970578339 /nfs/dbraw/zinc/57/83/39/970578339.db2.gz GZVOUQASOUBSFA-NSHDSACASA-N 2 0 230.421 2.059 20 0 BEADRP CC[C@H](C)[C@@H](C)[NH2+][C@@H](C)C1CC[NH2+]CC1 ZINC000400335797 970578565 /nfs/dbraw/zinc/57/85/65/970578565.db2.gz FYIWMLOGRPXATH-TUAOUCFPSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@@H]([NH2+]Cc1cccs1)C1CC[NH2+]CC1 ZINC000400380487 970583517 /nfs/dbraw/zinc/58/35/17/970583517.db2.gz WSZPYSLVEPAGCI-SNVBAGLBSA-N 2 0 224.373 2.226 20 0 BEADRP CCC[N@H+](CCOC)[C@@H](C)CC[NH+](CC)CC ZINC001255954235 970587090 /nfs/dbraw/zinc/58/70/90/970587090.db2.gz BISFIUMNUDHUMG-AWEZNQCLSA-N 2 0 244.423 2.465 20 0 BEADRP C[C@@H]([NH2+]CCC(C)(C)C)C1CC[NH2+]CC1 ZINC000400493104 970595019 /nfs/dbraw/zinc/59/50/19/970595019.db2.gz ZWVFEXKRAVMWNK-LLVKDONJSA-N 2 0 212.381 2.400 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[N@H+](C)[C@H]1CCCOC1 ZINC001255969065 970606120 /nfs/dbraw/zinc/60/61/20/970606120.db2.gz STUBICAUXABXCL-KBPBESRZSA-N 2 0 242.407 2.218 20 0 BEADRP CC[C@@H]1C[C@H]([N@H+](CC)CCC[NH+](C)C)CCO1 ZINC001170238948 970619370 /nfs/dbraw/zinc/61/93/70/970619370.db2.gz LJMXGNAMYNBNQR-ZIAGYGMSSA-N 2 0 242.407 2.218 20 0 BEADRP CSCC[C@H](C)[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000401025316 970653023 /nfs/dbraw/zinc/65/30/23/970653023.db2.gz NGHNGPMZJSSWRT-ZDEQEGDKSA-N 2 0 242.432 2.106 20 0 BEADRP Cc1cccc2c1C[N@H+](C1CCN(C)CC1)C2 ZINC001256202628 970704128 /nfs/dbraw/zinc/70/41/28/970704128.db2.gz JHVCIFUVEOLLGJ-UHFFFAOYSA-N 2 0 230.355 2.405 20 0 BEADRP CN1CCC([N@@H+]2CCC[C@@H]2c2ccncc2)CC1 ZINC001256207220 970709496 /nfs/dbraw/zinc/70/94/96/970709496.db2.gz COHVNYLAQHRVNG-OAHLLOKOSA-N 2 0 245.370 2.313 20 0 BEADRP C[C@@H]1CCC[N@@H+](C2CCN(C)CC2)[C@H]1C ZINC001256207228 970714248 /nfs/dbraw/zinc/71/42/48/970714248.db2.gz DAHXUSYAADEEHS-NEPJUHHUSA-N 2 0 210.365 2.201 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2CCC[C@](F)(C[NH3+])CC2)C1 ZINC001246548261 972681975 /nfs/dbraw/zinc/68/19/75/972681975.db2.gz JVTMBMAWZAFVAJ-FRRDWIJNSA-N 2 0 228.355 2.328 20 0 BEADRP C[C@@H](CC1CC1)[N@@H+]1CCC(F)(F)[C@@H](C[NH3+])C1 ZINC001246560413 972791873 /nfs/dbraw/zinc/79/18/73/972791873.db2.gz ULPMPFLRVLILIC-ONGXEEELSA-N 2 0 232.318 2.091 20 0 BEADRP C[C@@]1(F)CCC[N@@H+](C2C[C@H]3CC[C@@H](C2)[NH2+]3)CC1 ZINC001246566876 972816461 /nfs/dbraw/zinc/81/64/61/972816461.db2.gz JPPVJRGKQQRRDS-QNMSZWNNSA-N 2 0 240.366 2.484 20 0 BEADRP CC1(C)C[C@@H]([N@@H+]2CCC[C@@](C)(C[NH3+])CC2)CO1 ZINC001246572990 972864528 /nfs/dbraw/zinc/86/45/28/972864528.db2.gz DSOHJILIZWFVCE-TZMCWYRMSA-N 2 0 240.391 2.005 20 0 BEADRP C[NH2+]CC1C[NH+]([C@@H]2C[C@H](C)CC(C)(C)C2)C1 ZINC001246594802 973009086 /nfs/dbraw/zinc/00/90/86/973009086.db2.gz FGMMXBHXCDJCLU-WCQYABFASA-N 2 0 224.392 2.352 20 0 BEADRP CC(C)CCC[C@H](C)[NH+]1CC(C)(C[NH3+])C1 ZINC001246598363 973011231 /nfs/dbraw/zinc/01/12/31/973011231.db2.gz NXQRBLHNCHHZPP-LBPRGKRZSA-N 2 0 212.381 2.482 20 0 BEADRP CC1(C)CCC([N@@H+]2CC[C@H]3[NH2+]CC[C@H]32)CC1 ZINC001246637724 973053139 /nfs/dbraw/zinc/05/31/39/973053139.db2.gz IYGNCBYAKHJNOZ-CHWSQXEVSA-N 2 0 222.376 2.391 20 0 BEADRP C[C@H]1CC[C@H]([N@H+]2C[C@H]3[C@H](CCC3(F)F)C2)C[NH2+]1 ZINC001246654522 973070650 /nfs/dbraw/zinc/07/06/50/973070650.db2.gz ICSDDTWLEVWPPT-USZNOCQGSA-N 2 0 244.329 2.104 20 0 BEADRP COCC[C@H]1CCCC[N@@H+]1[C@H]1CC[NH2+][C@H](C)C1 ZINC001246781016 973087397 /nfs/dbraw/zinc/08/73/97/973087397.db2.gz DBLNNVGKJGDULP-MCIONIFRSA-N 2 0 240.391 2.018 20 0 BEADRP c1ccc(C[C@H]2CCN([C@@H]3CCC[NH2+]C3)C2)cc1 ZINC001246789639 973096011 /nfs/dbraw/zinc/09/60/11/973096011.db2.gz DANSNFKKIRBENB-HZPDHXFCSA-N 2 0 244.382 2.303 20 0 BEADRP CSC(C)(C)C[C@H](C)[N@@H+]1C[C@H]2CC[C@]2([NH3+])C1 ZINC001246854708 973175191 /nfs/dbraw/zinc/17/51/91/973175191.db2.gz QQWKUJGHLLWIBQ-LOWVWBTDSA-N 2 0 242.432 2.330 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@@H](C)c1ccccc1 ZINC001329024945 973412897 /nfs/dbraw/zinc/41/28/97/973412897.db2.gz WLLHOGFDGYJRAB-RYUDHWBXSA-N 2 0 206.333 2.335 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@@H]1CCc2c1cccc2OC ZINC001329024425 973434208 /nfs/dbraw/zinc/43/42/08/973434208.db2.gz RQNUPYZTVVYGAL-SMDDNHRTSA-N 2 0 248.370 2.270 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2C[C@H]3C[NH2+]C[C@@H]32)CC(C)(C)C1 ZINC001246919620 973482542 /nfs/dbraw/zinc/48/25/42/973482542.db2.gz NPXLIWBUVIXESV-NDBYEHHHSA-N 2 0 222.376 2.105 20 0 BEADRP C[C@@H]1C[C@H](C[N@H+](C)CCC(F)(F)F)CC[NH2+]1 ZINC000235274300 973827394 /nfs/dbraw/zinc/82/73/94/973827394.db2.gz NJHQWIPDOWSIFV-NXEZZACHSA-N 2 0 238.297 2.259 20 0 BEADRP c1cc2c[nH+]cc(NC[C@@H]3CCCC[NH2+]3)c2[nH]1 ZINC001171334333 973863865 /nfs/dbraw/zinc/86/38/65/973863865.db2.gz LLZSFOIDHMDPRL-NSHDSACASA-N 2 0 230.315 2.117 20 0 BEADRP [NH3+][C@@H]1CCc2c1cccc2NC[C@H]1CCCC[NH2+]1 ZINC001171334853 973868803 /nfs/dbraw/zinc/86/88/03/973868803.db2.gz KLXXGOSZMWXKGK-BXUZGUMPSA-N 2 0 245.370 2.187 20 0 BEADRP CC[NH+](CC)C[C@H](C)OC[C@H]1CCCC[N@@H+]1C ZINC001224703954 973870342 /nfs/dbraw/zinc/87/03/42/973870342.db2.gz VYLOMZYUVHZGHO-UONOGXRCSA-N 2 0 242.407 2.218 20 0 BEADRP CC(C)([NH3+])c1ccccc1NC[C@H]1CCCC[NH2+]1 ZINC001171335675 973877743 /nfs/dbraw/zinc/87/77/43/973877743.db2.gz QJDGNMZUXLTNHS-GFCCVEGCSA-N 2 0 247.386 2.434 20 0 BEADRP Cc1cccc2c1CC[C@@H]([NH2+]CCC[NH+](C)C)C2 ZINC001171550622 974095645 /nfs/dbraw/zinc/09/56/45/974095645.db2.gz XEOYVEACSWYRBU-OAHLLOKOSA-N 2 0 246.398 2.394 20 0 BEADRP COC[C@@H](C)[NH2+]C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171617455 974114405 /nfs/dbraw/zinc/11/44/05/974114405.db2.gz LLHXAYSIWZYBQF-LLVKDONJSA-N 2 0 242.407 2.262 20 0 BEADRP CN1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CC(C)(C)C1)C2 ZINC001172109155 974376917 /nfs/dbraw/zinc/37/69/17/974376917.db2.gz BUHCPGLHDBTZED-CLLJXQQHSA-N 2 0 222.376 2.344 20 0 BEADRP C[C@@H]1C[C@H](F)C[N@@H+]1[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172120455 974381969 /nfs/dbraw/zinc/38/19/69/974381969.db2.gz KZXWAIWTQSFWRU-BJJPWKGXSA-N 2 0 240.366 2.434 20 0 BEADRP C[NH+](C)[C@H]1CC[C@H]([NH2+][C@@H]2COC(C)(C)C2)CC1 ZINC001172280018 974512733 /nfs/dbraw/zinc/51/27/33/974512733.db2.gz RAIBSARBFMLWIM-AVGNSLFASA-N 2 0 240.391 2.016 20 0 BEADRP Cc1csc(C[N@H+]2CC[C@@H](F)[C@@H]([NH3+])CC2)c1 ZINC001206163804 974514957 /nfs/dbraw/zinc/51/49/57/974514957.db2.gz GCTDDVXZXGKPLO-NEPJUHHUSA-N 2 0 242.363 2.318 20 0 BEADRP C[NH+](C)[C@H]1CC[C@@H]([NH2+][C@H]2COC(C)(C)C2)CC1 ZINC001172282259 974541770 /nfs/dbraw/zinc/54/17/70/974541770.db2.gz RAIBSARBFMLWIM-UPJWGTAASA-N 2 0 240.391 2.016 20 0 BEADRP C[C@@H]1CC[C@@H](NC(=[NH2+])SCC[NH3+])C[C@H]1C ZINC001172359453 974629057 /nfs/dbraw/zinc/62/90/57/974629057.db2.gz MSGRJSIYODHRNS-OPRDCNLKSA-N 2 0 229.393 2.027 20 0 BEADRP CCOCC[C@H](C)[NH2+]CCCC[NH+]1CCCC1 ZINC001172408098 974667999 /nfs/dbraw/zinc/66/79/99/974667999.db2.gz DVKOYAFCLMHNMA-AWEZNQCLSA-N 2 0 242.407 2.267 20 0 BEADRP CCOCC[C@H](C)[NH2+]C(C)(C)CC[NH+](C)C ZINC001172415754 974683289 /nfs/dbraw/zinc/68/32/89/974683289.db2.gz ZKOXFTKGUUBGDH-LBPRGKRZSA-N 2 0 230.396 2.121 20 0 BEADRP CCc1ccc(C[NH2+]CC[C@@H](C)[NH2+]C)cc1 ZINC001331417992 974712255 /nfs/dbraw/zinc/71/22/55/974712255.db2.gz FRAIJRZKQYOBKM-GFCCVEGCSA-N 2 0 220.360 2.337 20 0 BEADRP CCC[N@H+](CCC[NH3+])[C@H](C)CCOC(C)C ZINC001172432852 974720262 /nfs/dbraw/zinc/72/02/62/974720262.db2.gz CYAXMEHWCKTZOY-CYBMUJFWSA-N 2 0 230.396 2.251 20 0 BEADRP CC[C@@H](CC(C)C)NC(=[NH2+])SCC[NH3+] ZINC001172389944 974737239 /nfs/dbraw/zinc/73/72/39/974737239.db2.gz QTSSPJJSEZSMIB-VIFPVBQESA-N 2 0 217.382 2.027 20 0 BEADRP C[C@H]([NH3+])C[N@@H+]1CC[C@H](C)[C@@H]1c1ccccc1 ZINC001331707938 974798395 /nfs/dbraw/zinc/79/83/95/974798395.db2.gz XVOMXVDFVVOXKI-SGMGOOAPSA-N 2 0 218.344 2.417 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc2c(c1)CCC2 ZINC001331822587 974827240 /nfs/dbraw/zinc/82/72/40/974827240.db2.gz SGRHECQTYYNBQQ-HOTGVXAUSA-N 2 0 244.382 2.392 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H](C)C1CCSCC1 ZINC001331833949 974829621 /nfs/dbraw/zinc/82/96/21/974829621.db2.gz KAEJBYIAPOZHFS-GHMZBOCLSA-N 2 0 230.421 2.106 20 0 BEADRP N[C@@H]1C[C@H]1[NH2+][C@H]1CC[C@@H](c2ccccc2)C1 ZINC001172552632 974867164 /nfs/dbraw/zinc/86/71/64/974867164.db2.gz GUYHFKHQVDXJCA-XJFOESAGSA-N 2 0 216.328 2.012 20 0 BEADRP CO[C@H]1CCC[C@@H]([NH2+]Cc2ccccc2C[NH3+])C1 ZINC001172924667 974972013 /nfs/dbraw/zinc/97/20/13/974972013.db2.gz XLEFVHHAGZAGMY-CABCVRRESA-N 2 0 248.370 2.193 20 0 BEADRP CC[NH+](CC)C1CCC([NH2+]C[C@H]2CCO2)CC1 ZINC001173101619 975023247 /nfs/dbraw/zinc/02/32/47/975023247.db2.gz LLWWDOJFGBBBIG-JXQTWKCFSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@H]1C[C@H]([NH2+][C@H]2CCC[C@H]([NH+](C)C)C2)CCO1 ZINC001173170132 975063303 /nfs/dbraw/zinc/06/33/03/975063303.db2.gz JWTVQZNMMYOURA-FQUUOJAGSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@H]1C[C@H]([NH2+][C@@H]2CCC[C@H]([NH+](C)C)C2)CCO1 ZINC001173170131 975063842 /nfs/dbraw/zinc/06/38/42/975063842.db2.gz JWTVQZNMMYOURA-DGAVXFQQSA-N 2 0 240.391 2.016 20 0 BEADRP CCCC[C@H](CC(C)C)[NH2+]CCOCC[NH3+] ZINC001173250195 975087424 /nfs/dbraw/zinc/08/74/24/975087424.db2.gz PGWGLIGRYXQSQE-CYBMUJFWSA-N 2 0 230.396 2.156 20 0 BEADRP CCCC[C@H](CC(C)C)[NH2+]CCN(C)CC[NH3+] ZINC001173252301 975093609 /nfs/dbraw/zinc/09/36/09/975093609.db2.gz IIPAUWXMWKKQBZ-CQSZACIVSA-N 2 0 243.439 2.071 20 0 BEADRP CCSC[C@@H](C)[NH2+]CCCCC[NH+](C)C ZINC001173293022 975169829 /nfs/dbraw/zinc/16/98/29/975169829.db2.gz VGBNJTYETQARGB-GFCCVEGCSA-N 2 0 232.437 2.450 20 0 BEADRP CC[C@@H]1CC[C@H]([N@@H+]2C[C@H]3C[C@@]3(C[NH+](C)C)C2)C1 ZINC001173295495 975178813 /nfs/dbraw/zinc/17/88/13/975178813.db2.gz QFTBXVOOFBOOJQ-APIJFGDWSA-N 2 0 236.403 2.449 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H]2CC23CCC3)CC1 ZINC000721226776 975366542 /nfs/dbraw/zinc/36/65/42/975366542.db2.gz RWYDXCHKKQALLB-ZDUSSCGKSA-N 2 0 222.376 2.393 20 0 BEADRP COc1ccc2[nH+]c(N)n(-c3cc[nH+]cc3)c2c1 ZINC001173879025 975910283 /nfs/dbraw/zinc/91/02/83/975910283.db2.gz BCBDEYUYYGXPDV-UHFFFAOYSA-N 2 0 240.266 2.011 20 0 BEADRP Cc1cccc2c1[nH+]c(N)n2-c1cc[nH+]cc1 ZINC001173879169 975911939 /nfs/dbraw/zinc/91/19/39/975911939.db2.gz JCVUXDQIDKPJAS-UHFFFAOYSA-N 2 0 224.267 2.311 20 0 BEADRP c1cc(Nc2c[nH+]ccc2N2CCCC2)cc[nH+]1 ZINC001173882259 975934977 /nfs/dbraw/zinc/93/49/77/975934977.db2.gz LXNYXZSRYGFFLG-UHFFFAOYSA-N 2 0 240.310 2.242 20 0 BEADRP Cc1ncoc1C[N@H+]1CCCC12CC[NH+](C)CC2 ZINC001334366922 976469319 /nfs/dbraw/zinc/46/93/19/976469319.db2.gz IEJJGHWSJZCOCT-UHFFFAOYSA-N 2 0 249.358 2.043 20 0 BEADRP C[C@H](C[NH+](C)C)Oc1ccc2c(c1)CC[N@@H+](C)C2 ZINC001228936125 976592245 /nfs/dbraw/zinc/59/22/45/976592245.db2.gz BXNZKJMMKWLUTO-GFCCVEGCSA-N 2 0 248.370 2.003 20 0 BEADRP C[C@H](c1cccc(O[C@@H]2CC[N@H+](C)C2)c1)[NH+](C)C ZINC001229625583 976915841 /nfs/dbraw/zinc/91/58/41/976915841.db2.gz IDQDXBKJMSGZLZ-IUODEOHRSA-N 2 0 248.370 2.392 20 0 BEADRP Cc1cc(N(C)c2cc(N)cc[nH+]2)cc[nH+]1 ZINC001174654628 976945429 /nfs/dbraw/zinc/94/54/29/976945429.db2.gz HRBUTRMNMXRWLB-UHFFFAOYSA-N 2 0 214.272 2.135 20 0 BEADRP C[NH+](C)Cc1ccccc1OC1CC[NH+](C)CC1 ZINC001229699001 976946956 /nfs/dbraw/zinc/94/69/56/976946956.db2.gz JFRAPBDOOTTYMD-UHFFFAOYSA-N 2 0 248.370 2.221 20 0 BEADRP CCc1ccc(N2CC[C@@H](C[N@@H+](C)CC)C2)nc1 ZINC001336544171 977764907 /nfs/dbraw/zinc/76/49/07/977764907.db2.gz PDXLVBJSNMSTGD-AWEZNQCLSA-N 2 0 247.386 2.422 20 0 BEADRP Cn1cc[nH+]c1Nc1ccc(C[NH+](C)C)cc1 ZINC001176287747 978011359 /nfs/dbraw/zinc/01/13/59/978011359.db2.gz VGNUVKSSCINDMO-UHFFFAOYSA-N 2 0 230.315 2.225 20 0 BEADRP Cc1cc(C)[nH+]c(N[C@@H]2CCC[C@H]([NH3+])C2)c1 ZINC000721838720 978051147 /nfs/dbraw/zinc/05/11/47/978051147.db2.gz STPZQWDJVDQFNI-NWDGAFQWSA-N 2 0 219.332 2.380 20 0 BEADRP CC(C)[C@H](CNc1cc[nH+]cc1)[NH+]1CCCC1 ZINC001336917100 978053320 /nfs/dbraw/zinc/05/33/20/978053320.db2.gz ZRGMFZDOPFPVKK-AWEZNQCLSA-N 2 0 233.359 2.036 20 0 BEADRP CC[C@H](CNc1cc[nH+]c(C)c1)[NH+]1CCCC1 ZINC001336971089 978093711 /nfs/dbraw/zinc/09/37/11/978093711.db2.gz WXMMESZZNDPKPD-CQSZACIVSA-N 2 0 233.359 2.098 20 0 BEADRP C[NH+](C)CCOC1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001206278349 978145280 /nfs/dbraw/zinc/14/52/80/978145280.db2.gz LSMBCHFEAZKHRP-UHFFFAOYSA-N 2 0 242.407 2.216 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@@](C)(C[NH3+])CC2)nc1 ZINC001206312067 978494436 /nfs/dbraw/zinc/49/44/36/978494436.db2.gz YWHKATZKPZGNFX-OAHLLOKOSA-N 2 0 247.386 2.341 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@](C)(C[NH3+])CC2)nc1 ZINC001206312066 978495438 /nfs/dbraw/zinc/49/54/38/978495438.db2.gz YWHKATZKPZGNFX-HNNXBMFYSA-N 2 0 247.386 2.341 20 0 BEADRP Cc1cc(C[NH2+]CC2=CC[N@H+](C)CC2)cc(C)n1 ZINC001178311069 978551028 /nfs/dbraw/zinc/55/10/28/978551028.db2.gz WXUSCLNLDPAWFP-UHFFFAOYSA-N 2 0 245.370 2.050 20 0 BEADRP CCc1ccc(N2CC[C@@H](C[NH+](C)C)C2)nc1 ZINC001337914726 978561600 /nfs/dbraw/zinc/56/16/00/978561600.db2.gz NBUMEOSEYJVSEB-ZDUSSCGKSA-N 2 0 233.359 2.032 20 0 BEADRP CC[C@H]1CC[C@H]([NH2+]CCCC[NH+](C)C)C1 ZINC000070643869 978861676 /nfs/dbraw/zinc/86/16/76/978861676.db2.gz ACOZKZUVNMIGQE-STQMWFEESA-N 2 0 212.381 2.497 20 0 BEADRP CC[C@H](CNc1cc[nH+]cc1C)[NH+]1CCCC1 ZINC001339534932 978863345 /nfs/dbraw/zinc/86/33/45/978863345.db2.gz VWZVEGQZDPJLLC-CYBMUJFWSA-N 2 0 233.359 2.098 20 0 BEADRP [NH3+]CCCC[NH+]1CCC2(CC(F)(F)C2)CC1 ZINC001234981847 978943696 /nfs/dbraw/zinc/94/36/96/978943696.db2.gz PGQHCDMRSGYYDV-UHFFFAOYSA-N 2 0 232.318 2.237 20 0 BEADRP F[C@@H]1CCC[C@@H]([NH2+][C@@H]2CC[NH2+]C23CCC3)C1 ZINC001340065398 978963533 /nfs/dbraw/zinc/96/35/33/978963533.db2.gz TYUYCBBEEQMATC-IJLUTSLNSA-N 2 0 226.339 2.141 20 0 BEADRP C(C1CCC1)[N@@H+]1CCCC[C@]12CC[NH2+]C2 ZINC001235122643 978979640 /nfs/dbraw/zinc/97/96/40/978979640.db2.gz HPWIHAUGJIGRAF-CYBMUJFWSA-N 2 0 208.349 2.005 20 0 BEADRP C[N@@H+]1CCC2(C1)CC[NH+](C1CCCC1)CC2 ZINC001277929507 978993316 /nfs/dbraw/zinc/99/33/16/978993316.db2.gz WASICITZOPPQKA-UHFFFAOYSA-N 2 0 222.376 2.347 20 0 BEADRP [NH3+][C@@H]1[C@H]2C[N@@H+](CCCC3CCCCC3)C[C@H]21 ZINC001235210619 979000624 /nfs/dbraw/zinc/00/06/24/979000624.db2.gz OTBBWLWHFCUHBY-WDNDVIMCSA-N 2 0 222.376 2.236 20 0 BEADRP CC/C=C\CC[N@@H+]1C[C@H]2CCC[C@@]2([NH3+])C1 ZINC001235241543 979004784 /nfs/dbraw/zinc/00/47/84/979004784.db2.gz XSCOIVRIGXGIOS-FGTRRKKMSA-N 2 0 208.349 2.156 20 0 BEADRP CC1=C[C@H](C)[C@H](C[N@@H+]2C[C@@H]3C[NH2+]CC[C@@H]32)CC1 ZINC001235256768 979009149 /nfs/dbraw/zinc/00/91/49/979009149.db2.gz GQMUBVNKTKODFG-AJNGGQMLSA-N 2 0 234.387 2.273 20 0 BEADRP CC1=C[C@H](C)[C@H](C[N@@H+]2C[C@@H]3C[NH2+]CC[C@H]32)CC1 ZINC001235256776 979009493 /nfs/dbraw/zinc/00/94/93/979009493.db2.gz GQMUBVNKTKODFG-ZQDZILKHSA-N 2 0 234.387 2.273 20 0 BEADRP [NH3+]CCCC[N@@H+]1CCC[C@@H](Oc2ccccc2)C1 ZINC001235690661 979117928 /nfs/dbraw/zinc/11/79/28/979117928.db2.gz GTCDOJHXDMNKMO-OAHLLOKOSA-N 2 0 248.370 2.269 20 0 BEADRP [NH3+]CCCC[N@@H+]1CC[C@H](c2cccc(F)c2)C1 ZINC001235934259 979212446 /nfs/dbraw/zinc/21/24/46/979212446.db2.gz KVOAVJUMGKAORW-ZDUSSCGKSA-N 2 0 236.334 2.354 20 0 BEADRP C(CC1CCCC1)C[N@@H+]1C[C@@H]2CC[NH2+]C[C@H]2C1 ZINC001235929330 979213579 /nfs/dbraw/zinc/21/35/79/979213579.db2.gz MCKSDXMAFQAWIU-GJZGRUSLSA-N 2 0 236.403 2.498 20 0 BEADRP C[N@H+](CC[C@H]1CCCC[NH2+]1)C[C@@H]1CC1(C)C ZINC001235959556 979228822 /nfs/dbraw/zinc/22/88/22/979228822.db2.gz YRUHZIIAFDIEPQ-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H](C[N@@H+]1C[C@@H]2CC[C@]2([NH3+])C1)c1ccccc1 ZINC001235976608 979240418 /nfs/dbraw/zinc/24/04/18/979240418.db2.gz AJMBNGWFBNUNCJ-SNPRPXQTSA-N 2 0 230.355 2.213 20 0 BEADRP CC1=C[C@H](C)[C@H](C[N@@H+]2C[C@H]3CC[C@]3([NH3+])C2)CC1 ZINC001235977789 979245147 /nfs/dbraw/zinc/24/51/47/979245147.db2.gz HYKUKIJAQUAQFP-XQLPTFJDSA-N 2 0 234.387 2.402 20 0 BEADRP CC[N@H+](CCCC[NH3+])Cc1cccc(F)c1 ZINC001236042251 979336630 /nfs/dbraw/zinc/33/66/30/979336630.db2.gz PMEJIWLONQXBRP-UHFFFAOYSA-N 2 0 224.323 2.387 20 0 BEADRP CC/C=C\CCC[N@@H+]1CC[C@H](C[NH2+]C)C1 ZINC001236068295 979359011 /nfs/dbraw/zinc/35/90/11/979359011.db2.gz XQBRMCUKSDFHQY-DSYXLKISSA-N 2 0 210.365 2.274 20 0 BEADRP COc1ccc([C@H]2CC[N@H+](CCCC[NH3+])C2)cc1 ZINC001236097718 979388064 /nfs/dbraw/zinc/38/80/64/979388064.db2.gz MTYBQBWZHCJZRV-AWEZNQCLSA-N 2 0 248.370 2.223 20 0 BEADRP COc1ccc([C@@H]2CC[N@H+](CCCC[NH3+])C2)cc1 ZINC001236097719 979390094 /nfs/dbraw/zinc/39/00/94/979390094.db2.gz MTYBQBWZHCJZRV-CQSZACIVSA-N 2 0 248.370 2.223 20 0 BEADRP [NH3+]C[C@H]1CCCN1CC1CCC(F)(F)CC1 ZINC001236244789 979463191 /nfs/dbraw/zinc/46/31/91/979463191.db2.gz NTPYYQOXJOOYSU-LLVKDONJSA-N 2 0 232.318 2.235 20 0 BEADRP [NH3+]C[C@H]1CCCN1Cc1ccc(F)c2cc[nH]c21 ZINC001236251949 979473001 /nfs/dbraw/zinc/47/30/01/979473001.db2.gz AMSQPMCGHWSHKI-LLVKDONJSA-N 2 0 247.317 2.230 20 0 BEADRP C1=CC[C@H](C[N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)CC1 ZINC001236314039 979522979 /nfs/dbraw/zinc/52/29/79/979522979.db2.gz GXZGXLGSQQEOMR-SOUVJXGZSA-N 2 0 234.387 2.274 20 0 BEADRP CCCC[C@@H](CC)C[N@H+](C)[C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001236412466 979588579 /nfs/dbraw/zinc/58/85/79/979588579.db2.gz VEVXZWGZCWMPAK-MQYQWHSLSA-N 2 0 224.392 2.352 20 0 BEADRP CCOC(C)(C)C[N@@H+]1CCCC[C@](C)(C[NH3+])C1 ZINC001206542353 979654727 /nfs/dbraw/zinc/65/47/27/979654727.db2.gz YZQQYFHYWJVSSI-CQSZACIVSA-N 2 0 242.407 2.252 20 0 BEADRP CCC(CC)[N@H+](CCCO)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236781926 979723373 /nfs/dbraw/zinc/72/33/73/979723373.db2.gz BNHLVSQKRMPKGB-MQMHXKEQSA-N 2 0 242.407 2.129 20 0 BEADRP CCC(CC)[N@H+](C[C@H](C)N)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236781973 979730679 /nfs/dbraw/zinc/73/06/79/979730679.db2.gz DBBXKJQGBOXZGE-OBJOEFQTSA-N 2 0 241.423 2.094 20 0 BEADRP C[C@H]([NH3+])CN(C)Cc1ccc2cccnc2c1 ZINC001236895050 979784605 /nfs/dbraw/zinc/78/46/05/979784605.db2.gz IWKIVLNDNONYNO-NSHDSACASA-N 2 0 229.327 2.014 20 0 BEADRP Cc1cnccc1C[N@@H+]1CCC[C@@](C)([NH3+])CC1 ZINC001205267014 979823090 /nfs/dbraw/zinc/82/30/90/979823090.db2.gz ZTKCWEDNTDPHOQ-CQSZACIVSA-N 2 0 233.359 2.093 20 0 BEADRP Cc1cnccc1C[N@@H+]1CCC[C@](C)([NH3+])CC1 ZINC001205267013 979823674 /nfs/dbraw/zinc/82/36/74/979823674.db2.gz ZTKCWEDNTDPHOQ-AWEZNQCLSA-N 2 0 233.359 2.093 20 0 BEADRP CNc1ccccc1C[N@@H+]1CCC[C@@](C)([NH3+])CC1 ZINC001205280682 979874734 /nfs/dbraw/zinc/87/47/34/979874734.db2.gz FUNIIQSFSPIKRP-OAHLLOKOSA-N 2 0 247.386 2.432 20 0 BEADRP CS[C@H](C)CC[N@@H+]1CC[C@H]2[NH2+]CCC[C@H]2C1 ZINC001237383613 979879458 /nfs/dbraw/zinc/87/94/58/979879458.db2.gz QQAIOHKBXDQBBJ-FRRDWIJNSA-N 2 0 242.432 2.202 20 0 BEADRP Cc1cc(C[N@@H+]2CCC[C@@](C)([NH3+])CC2)cnc1C ZINC001205289145 979939633 /nfs/dbraw/zinc/93/96/33/979939633.db2.gz TXRUQLDCDWFIGE-OAHLLOKOSA-N 2 0 247.386 2.402 20 0 BEADRP C1=CC[C@H](C[NH2+]C[C@H]2C[NH+]3CCC2CC3)CC1 ZINC001184135744 979945357 /nfs/dbraw/zinc/94/53/57/979945357.db2.gz VPMJAMFFALEXTC-ZFWWWQNUSA-N 2 0 234.387 2.274 20 0 BEADRP C1=CC[C@H](C[NH2+]C[C@@H]2C[NH+]3CCC2CC3)CC1 ZINC001184135741 979947865 /nfs/dbraw/zinc/94/78/65/979947865.db2.gz VPMJAMFFALEXTC-DZGCQCFKSA-N 2 0 234.387 2.274 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+][C@@H]1CC[C@@H]2C[N@H+](C)C[C@H]12 ZINC001184386310 980058723 /nfs/dbraw/zinc/05/87/23/980058723.db2.gz BRKGZNJAWKPDFQ-PDWCTOEPSA-N 2 0 224.392 2.351 20 0 BEADRP C[NH+](C)CCc1ccc(C[NH+]2CCCC2)cc1 ZINC001250157267 980112275 /nfs/dbraw/zinc/11/22/75/980112275.db2.gz DEMJTXNELLXJLY-UHFFFAOYSA-N 2 0 232.371 2.387 20 0 BEADRP c1cc(C2=CCC[NH2+]CC2)ncc1[C@@H]1CCC[NH2+]1 ZINC001238936148 980373295 /nfs/dbraw/zinc/37/32/95/980373295.db2.gz MHGSGMPCNCBRNL-AWEZNQCLSA-N 2 0 243.354 2.273 20 0 BEADRP [NH3+]CC1CC[NH+](C[C@@H]2CC3CCC2CC3)CC1 ZINC000691660060 980378202 /nfs/dbraw/zinc/37/82/02/980378202.db2.gz ISPFOYIOKLMCFJ-ZALBZXLWSA-N 2 0 236.403 2.483 20 0 BEADRP c1cc2c(c(C3=CCC[NH2+]CC3)c1)C[NH2+]C2 ZINC001238945251 980383368 /nfs/dbraw/zinc/38/33/68/980383368.db2.gz QDAKEQRTFLQGOM-UHFFFAOYSA-N 2 0 214.312 2.057 20 0 BEADRP c1cc2c(c(C3=CCC[NH2+]CC3)c1)C[NH2+]CC2 ZINC001238945001 980384119 /nfs/dbraw/zinc/38/41/19/980384119.db2.gz MOKKBZPSXBILBB-UHFFFAOYSA-N 2 0 228.339 2.099 20 0 BEADRP C[NH+](C)/C=C/c1ccncc1C1=CCC[NH2+]CC1 ZINC001238949883 980389942 /nfs/dbraw/zinc/38/99/42/980389942.db2.gz KKTGEZCOKPPRGO-YRNVUSSQSA-N 2 0 243.354 2.381 20 0 BEADRP CC[N@H+]1C[C@@H]2C[NH+](Cc3ccccc3C)C[C@@H]2C1 ZINC001203713847 980857019 /nfs/dbraw/zinc/85/70/19/980857019.db2.gz YFCDRRSQPSCLRQ-IYBDPMFKSA-N 2 0 244.382 2.379 20 0 BEADRP [NH3+]C[C@@]1(F)CCC[N@H+](C[C@@H]2CC=CCC2)CC1 ZINC001205539442 980913529 /nfs/dbraw/zinc/91/35/29/980913529.db2.gz ZDTLOSJQXFDSNE-ZIAGYGMSSA-N 2 0 240.366 2.496 20 0 BEADRP [NH3+]Cc1cncc(-c2cccc3c2CC[C@@H]3[NH3+])c1 ZINC001239804528 980941402 /nfs/dbraw/zinc/94/14/02/980941402.db2.gz RTJKZMWRBCYSFL-HNNXBMFYSA-N 2 0 239.322 2.153 20 0 BEADRP [NH3+]C[C@]1(F)CCC[N@H+](Cc2ccsc2)CC1 ZINC001205545670 980947429 /nfs/dbraw/zinc/94/74/29/980947429.db2.gz LNFOBTADWUUHKZ-LBPRGKRZSA-N 2 0 242.363 2.401 20 0 BEADRP C[C@@H](Cc1ccco1)[NH2+]C1CCC(C[NH3+])CC1 ZINC001325743034 980996334 /nfs/dbraw/zinc/99/63/34/980996334.db2.gz IDULZDLECMXLOH-HIFPTAJRSA-N 2 0 236.359 2.318 20 0 BEADRP C[C@@H]1CC[N@H+](CCC2CC2)CC[C@H]1C[NH3+] ZINC001205600448 981155889 /nfs/dbraw/zinc/15/58/89/981155889.db2.gz BSVWGBBXAWSABE-YPMHNXCESA-N 2 0 210.365 2.093 20 0 BEADRP CCCCC[N@@H+]1CC[C@H](C)[C@@H](C[NH3+])CC1 ZINC001205602646 981165303 /nfs/dbraw/zinc/16/53/03/981165303.db2.gz KXRDNHFAAANRKN-QWHCGFSZSA-N 2 0 212.381 2.483 20 0 BEADRP C[C@@H]1CCC[N@H+](CCCCNc2cc[nH+]cc2)C1 ZINC001347772063 981168689 /nfs/dbraw/zinc/16/86/89/981168689.db2.gz JZNLBQLFYYIGJM-CQSZACIVSA-N 2 0 247.386 2.428 20 0 BEADRP Cc1cccnc1C[N@H+]1CC[C@@H](C)[C@H](C[NH3+])CC1 ZINC001205603991 981174601 /nfs/dbraw/zinc/17/46/01/981174601.db2.gz SXSIKGFAADBTGI-OCCSQVGLSA-N 2 0 247.386 2.197 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@@H](C)[C@H](C[NH3+])CC2)o1 ZINC001205604821 981181994 /nfs/dbraw/zinc/18/19/94/981181994.db2.gz XUUMHOKJVIUUML-YPMHNXCESA-N 2 0 236.359 2.395 20 0 BEADRP Cc1c(N)cc[nH+]c1-c1ccc2c(c1)CC[NH2+]C2 ZINC001240453525 981389656 /nfs/dbraw/zinc/38/96/56/981389656.db2.gz BVMNMOWDGDCSSR-UHFFFAOYSA-N 2 0 239.322 2.285 20 0 BEADRP [NH3+]C1(c2cccc(C3=CC[NH2+]CC3)c2)CC1 ZINC001240469582 981405266 /nfs/dbraw/zinc/40/52/66/981405266.db2.gz DJDOKGXXZUGHQQ-UHFFFAOYSA-N 2 0 214.312 2.011 20 0 BEADRP C[NH+](C)Cc1ccc(C2=CC[NH2+]CC2)cc1F ZINC001240470987 981409307 /nfs/dbraw/zinc/40/93/07/981409307.db2.gz UWVZYCBFTJRJPP-UHFFFAOYSA-N 2 0 234.318 2.264 20 0 BEADRP COc1ccc(C2=CC[NH2+]CC2)c(C[NH+](C)C)c1 ZINC001240471140 981410085 /nfs/dbraw/zinc/41/00/85/981410085.db2.gz WHNJKVMXQGPGRL-UHFFFAOYSA-N 2 0 246.354 2.134 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H]1CCC[C@H]1C(C)C ZINC001348839624 981454032 /nfs/dbraw/zinc/45/40/32/981454032.db2.gz DJXCQEANTNKWKK-AGIUHOORSA-N 2 0 212.381 2.399 20 0 BEADRP C[NH+](C)Cc1ccc(C2=CCC[NH2+]C2)cc1F ZINC001240671799 981581950 /nfs/dbraw/zinc/58/19/50/981581950.db2.gz ZJTHDUSXLYZWDK-UHFFFAOYSA-N 2 0 234.318 2.264 20 0 BEADRP C[N@@H+]1CC[C@@H](c2ccc(C3=CCC[NH2+]C3)cc2)C1 ZINC001240671351 981583292 /nfs/dbraw/zinc/58/32/92/981583292.db2.gz SNZAUJHHZMJEHY-MRXNPFEDSA-N 2 0 242.366 2.482 20 0 BEADRP c1cc([C@@H]([NH2+]C[C@@H]2CCC[NH2+]C2)C2CC2)ccn1 ZINC001580888050 981714821 /nfs/dbraw/zinc/71/48/21/981714821.db2.gz POXWCCHEWXEELJ-DOMZBBRYSA-N 2 0 245.370 2.122 20 0 BEADRP c1cc(CC[NH2+][C@@H]2CC[C@H]3[NH2+]CCC[C@H]3C2)co1 ZINC001580887744 981716261 /nfs/dbraw/zinc/71/62/61/981716261.db2.gz GVTONVVPQBEDLT-RRFJBIMHSA-N 2 0 248.370 2.332 20 0 BEADRP CC1CC([NH2+][C@H]2C[C@@](C[NH3+])(c3ccccc3)C2)C1 ZINC001350955979 982135243 /nfs/dbraw/zinc/13/52/43/982135243.db2.gz LARKGUOKBNVGRG-DVMLXDCBSA-N 2 0 244.382 2.434 20 0 BEADRP [NH3+]CC1CCC([NH2+]C[C@H]2C=CCC2)CC1 ZINC001350958865 982138294 /nfs/dbraw/zinc/13/82/94/982138294.db2.gz VEFZXHOKSDCZAV-CPCZMJQVSA-N 2 0 208.349 2.060 20 0 BEADRP CC(C)C[N@@H+]1C[C@@H]2CC[C@H]([NH+](C)C)C[C@H]2C1 ZINC001352113656 982474989 /nfs/dbraw/zinc/47/49/89/982474989.db2.gz TUJRLEINIGBMQF-IHRRRGAJSA-N 2 0 224.392 2.305 20 0 BEADRP C[C@H]([NH3+])c1cccc(C2=CC[N@H+](C)CC2)c1 ZINC001241330519 982491125 /nfs/dbraw/zinc/49/11/25/982491125.db2.gz UVPYQNMTBBZXBH-NSHDSACASA-N 2 0 216.328 2.425 20 0 BEADRP C[N@H+]1CC=C(c2ccc([C@H]3CC[NH2+]C3)cc2)CC1 ZINC001241333403 982499539 /nfs/dbraw/zinc/49/95/39/982499539.db2.gz VESHRZQOPMYQHR-INIZCTEOSA-N 2 0 242.366 2.482 20 0 BEADRP C[C@H]1CC[C@@H](C[NH3+])N(CCCC(F)(F)F)C1 ZINC001205807288 982573970 /nfs/dbraw/zinc/57/39/70/982573970.db2.gz ZNIQEHYDLXCXPS-UWVGGRQHSA-N 2 0 238.297 2.388 20 0 BEADRP C[N@@H+]1CCC=C(c2ccc([C@@H]3CCC[NH2+]3)cn2)C1 ZINC001241565020 982806956 /nfs/dbraw/zinc/80/69/56/982806956.db2.gz FOIWIDFWDMFROD-AWEZNQCLSA-N 2 0 243.354 2.225 20 0 BEADRP C[C@H]([NH3+])c1ccccc1C1=CCC[N@H+](C)C1 ZINC001241570551 982823331 /nfs/dbraw/zinc/82/33/31/982823331.db2.gz KJMKBCZWEZKFQO-NSHDSACASA-N 2 0 216.328 2.425 20 0 BEADRP CC[N@@H+]1C[C@@H](C)N(c2cc[nH+]cc2)C[C@@H]1C ZINC001354019629 983118297 /nfs/dbraw/zinc/11/82/97/983118297.db2.gz UBOVYSZGSRIGEY-NWDGAFQWSA-N 2 0 219.332 2.001 20 0 BEADRP [NH3+]Cc1ccc(-c2cccc(C[NH3+])c2F)cc1 ZINC001241917952 983138252 /nfs/dbraw/zinc/13/82/52/983138252.db2.gz MLKVQMQJSCUDSU-UHFFFAOYSA-N 2 0 230.286 2.410 20 0 BEADRP CNc1ccc(C[N@@H+]2CCC[C@@H](C[NH3+])[C@H]2C)cc1 ZINC001205915861 983185260 /nfs/dbraw/zinc/18/52/60/983185260.db2.gz RBYAWNMQBBDWMW-OCCSQVGLSA-N 2 0 247.386 2.288 20 0 BEADRP CC[NH+]1C[C@H]2C[NH+](CC3CCCCC3)C[C@@H]2C1 ZINC001201401262 983203539 /nfs/dbraw/zinc/20/35/39/983203539.db2.gz FPQKUSCDJOBWQV-GJZGRUSLSA-N 2 0 236.403 2.450 20 0 BEADRP [NH3+]CCc1cccc(C2=C[C@H]3CC[C@@H](C2)[NH2+]3)c1 ZINC001242026459 983240408 /nfs/dbraw/zinc/24/04/08/983240408.db2.gz SHCVZQPLXPEVRY-CABCVRRESA-N 2 0 228.339 2.096 20 0 BEADRP C[NH+]1CCC2(C[NH+](CC(C)(C)C)C2)CC1 ZINC001201441389 983245786 /nfs/dbraw/zinc/24/57/86/983245786.db2.gz DPAHULZIYOEYMT-UHFFFAOYSA-N 2 0 210.365 2.060 20 0 BEADRP C[NH+]1CC2(C1)CC[NH+](CCc1ccccc1)CC2 ZINC001201606330 983375350 /nfs/dbraw/zinc/37/53/50/983375350.db2.gz YGCQZAUILMGZOK-UHFFFAOYSA-N 2 0 244.382 2.257 20 0 BEADRP CCC[NH+]1C[C@@H]2C[NH+](CCCSC)C[C@H]2C1 ZINC001201697879 983412918 /nfs/dbraw/zinc/41/29/18/983412918.db2.gz RYEJOWLTQPRQJM-CHWSQXEVSA-N 2 0 242.432 2.013 20 0 BEADRP CCCCC[NH+]1CC2(C1)CC[NH+](C)CC2 ZINC001201737195 983442503 /nfs/dbraw/zinc/44/25/03/983442503.db2.gz HUPITOHNXGTKQH-UHFFFAOYSA-N 2 0 210.365 2.204 20 0 BEADRP CN1CCC[C@H]2C[N@H+](CC3CCCC3)C[C@H]21 ZINC001202190299 983594821 /nfs/dbraw/zinc/59/48/21/983594821.db2.gz NOAQXSRFJVFOON-UONOGXRCSA-N 2 0 222.376 2.203 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2CC[C@@]3(CC[NH+](C)C3)C2)C1 ZINC000339211246 984023214 /nfs/dbraw/zinc/02/32/14/984023214.db2.gz GUJCFSZJSRVAHS-HZSPNIEDSA-N 2 0 222.376 2.203 20 0 BEADRP c1cc2c(c(-c3ccc4c(c3)C[NH2+]C4)[nH+]1)CCN2 ZINC001242673537 984042286 /nfs/dbraw/zinc/04/22/86/984042286.db2.gz FYQQJGXAVDBDMA-UHFFFAOYSA-N 2 0 237.306 2.320 20 0 BEADRP CC[NH+](CC)Cc1ccc(N[C@H]2CC[NH2+]C2)cc1 ZINC001573770937 984042247 /nfs/dbraw/zinc/04/22/47/984042247.db2.gz HYJYWPVBZNTVHD-HNNXBMFYSA-N 2 0 247.386 2.302 20 0 BEADRP C[C@H]1C[N@H+](CC2CCCC2)CCC[C@H]1C[NH3+] ZINC001205985017 984220407 /nfs/dbraw/zinc/22/04/07/984220407.db2.gz VBHBJELQMSVOCA-JSGCOSHPSA-N 2 0 224.392 2.483 20 0 BEADRP C[NH2+][C@@]12CC[C@@]([NH2+]CCCSC)(C1)CCC2 ZINC001275109519 984494953 /nfs/dbraw/zinc/49/49/53/984494953.db2.gz HSWAIWZETWGWRE-QWHCGFSZSA-N 2 0 242.432 2.394 20 0 BEADRP C[N@@H+]1CCC2(C1)CC[NH+](CC1CCC1)CC2 ZINC001275180775 984512891 /nfs/dbraw/zinc/51/28/91/984512891.db2.gz JRCMODTVBWMDAR-UHFFFAOYSA-N 2 0 222.376 2.204 20 0 BEADRP C1=C(c2cncc(C[NH+]3CCCCC3)c2)C[NH2+]C1 ZINC001243111629 984575160 /nfs/dbraw/zinc/57/51/60/984575160.db2.gz UAWKJJSPSZECLJ-UHFFFAOYSA-N 2 0 243.354 2.054 20 0 BEADRP C[NH2+][C@@]12CC[C@@]([NH2+]Cc3ccncc3)(C1)CCC2 ZINC001275885352 984716355 /nfs/dbraw/zinc/71/63/55/984716355.db2.gz DJCNFPFDLAVRHW-LSDHHAIUSA-N 2 0 245.370 2.236 20 0 BEADRP CC[NH+]1CCC(C[NH2+]Cc2cccc(N)c2)CC1 ZINC001577764003 984743578 /nfs/dbraw/zinc/74/35/78/984743578.db2.gz OIAVPLWTRICFQM-UHFFFAOYSA-N 2 0 247.386 2.090 20 0 BEADRP C[C@@H]1C[C@H]1C[NH+]1CCC2(CC[N@H+](C)C2)CC1 ZINC001276031483 984790400 /nfs/dbraw/zinc/79/04/00/984790400.db2.gz HRLNDIDBRFKFLV-OLZOCXBDSA-N 2 0 222.376 2.060 20 0 BEADRP CCC[C@@H](CC)[N@H+]1C[C@H]2C[NH+](C)C[C@H]2C1 ZINC001257266665 984865637 /nfs/dbraw/zinc/86/56/37/984865637.db2.gz QOKBLMPDIRCUBY-FRRDWIJNSA-N 2 0 210.365 2.059 20 0 BEADRP CCOc1cccc(C[NH2+][C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001578191851 984866925 /nfs/dbraw/zinc/86/69/25/984866925.db2.gz JOTWATBTWPJFEF-HDJSIYSDSA-N 2 0 248.370 2.445 20 0 BEADRP CC1CC(C[NH2+][C@@H]2CC[NH2+]CC2(C)C)C1 ZINC000691886678 984893388 /nfs/dbraw/zinc/89/33/88/984893388.db2.gz UJEPBHHWDANPAU-HTAVTVPLSA-N 2 0 210.365 2.010 20 0 BEADRP CC[C@@H](C)[NH+]1CCC([NH3+])(Cc2cccnc2)CC1 ZINC001257433163 985006976 /nfs/dbraw/zinc/00/69/76/985006976.db2.gz FRKUKERTSLPNDW-CYBMUJFWSA-N 2 0 247.386 2.216 20 0 BEADRP CC[C@H](C)[NH+]1CCC([NH3+])(Cc2ccccn2)CC1 ZINC001257432890 985007247 /nfs/dbraw/zinc/00/72/47/985007247.db2.gz ASMDFFOAGNSUGI-ZDUSSCGKSA-N 2 0 247.386 2.216 20 0 BEADRP CC1(C[N@@H+]2C[C@@H]3CCC[NH2+][C@@H]3C2)CCCC1 ZINC000685990073 985027926 /nfs/dbraw/zinc/02/79/26/985027926.db2.gz WRGPHZCAQDRCLU-QWHCGFSZSA-N 2 0 222.376 2.251 20 0 BEADRP C[N@H+](CCCCc1ccccc1)[C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001578466432 985101637 /nfs/dbraw/zinc/10/16/37/985101637.db2.gz LUDHIKBLSNQVEO-ZSHCYNCHSA-N 2 0 244.382 2.159 20 0 BEADRP C[NH2+]CCOCC[NH2+]CCCC1CCCCC1 ZINC001578709796 985309739 /nfs/dbraw/zinc/30/97/39/985309739.db2.gz OBGXGUPCDVRMGZ-UHFFFAOYSA-N 2 0 242.407 2.173 20 0 BEADRP c1c(C[NH2+]C2CCCC2)sc2c1C[NH2+]CC2 ZINC000688039534 985508482 /nfs/dbraw/zinc/50/84/82/985508482.db2.gz TZRHYPVEEACHAC-UHFFFAOYSA-N 2 0 236.384 2.426 20 0 BEADRP CO[C@H]1CCC[C@@H]([NH2+]CCC[NH2+]C(C)C)CC1 ZINC001578936990 985541872 /nfs/dbraw/zinc/54/18/72/985541872.db2.gz HQJDNLGMVMNZFZ-KGLIPLIRSA-N 2 0 242.407 2.312 20 0 BEADRP CO[C@@H]1CCC[C@@H]([NH2+]CC[C@@H]([NH3+])C(C)C)CC1 ZINC001578936872 985544832 /nfs/dbraw/zinc/54/48/32/985544832.db2.gz HLNZDOJPVYDZGP-MGPQQGTHSA-N 2 0 242.407 2.297 20 0 BEADRP COC[C@H](CC(C)(C)C)[NH2+][C@@H]1CC[NH2+][C@H](C)C1 ZINC001578960532 985579280 /nfs/dbraw/zinc/57/92/80/985579280.db2.gz JJXRHMYIUFZZHL-UPJWGTAASA-N 2 0 242.407 2.168 20 0 BEADRP COC[C@H](CC(C)(C)C)[NH2+][C@H]1CC[NH2+][C@H](C)C1 ZINC001578960530 985580535 /nfs/dbraw/zinc/58/05/35/985580535.db2.gz JJXRHMYIUFZZHL-AGIUHOORSA-N 2 0 242.407 2.168 20 0 BEADRP CSCC[C@H](C)[NH2+]CC(C)(C)C[NH+](C)C ZINC001258203238 985614849 /nfs/dbraw/zinc/61/48/49/985614849.db2.gz BROIACILVPOYQB-NSHDSACASA-N 2 0 232.437 2.305 20 0 BEADRP c1cc2c(cc1C1=C[NH2+]CCC1)C[NH2+]CC2 ZINC001243951652 985653620 /nfs/dbraw/zinc/65/36/20/985653620.db2.gz BLROVSNEPKSTIX-UHFFFAOYSA-N 2 0 214.312 2.057 20 0 BEADRP CSC(C)(C)C[C@@H](C)[NH2+][C@@H]1CCC[C@@H]1[NH3+] ZINC001258331394 985809450 /nfs/dbraw/zinc/80/94/50/985809450.db2.gz NJQWBRYBLQDXFN-OUAUKWLOSA-N 2 0 230.421 2.376 20 0 BEADRP C[C@@H](CC1CC1)[NH+]1CCC(C[NH+](C)C)CC1 ZINC001258461655 985906184 /nfs/dbraw/zinc/90/61/84/985906184.db2.gz DJJOJJCXTRGKKI-LBPRGKRZSA-N 2 0 224.392 2.449 20 0 BEADRP [NH3+]C[C@H]1CCCC[N@H+](C[C@@H]2C[C@H]3C=C[C@@H]2C3)C1 ZINC001206606787 985938474 /nfs/dbraw/zinc/93/84/74/985938474.db2.gz SKGZWBPAJLSXAK-YJNKXOJESA-N 2 0 234.387 2.259 20 0 BEADRP Cc1cc(C)c(/C=C/C[NH2+]CC2C[NH2+]C2)c(C)c1 ZINC001579572313 986096506 /nfs/dbraw/zinc/09/65/06/986096506.db2.gz XEVTUHRXBMUOMM-SNAWJCMRSA-N 2 0 244.382 2.434 20 0 BEADRP Cc1cc(NCC(C)(C)C[NH3+])ccc1C[NH+](C)C ZINC001579635926 986155969 /nfs/dbraw/zinc/15/59/69/986155969.db2.gz OHFVLWQMDKOXFP-UHFFFAOYSA-N 2 0 249.402 2.453 20 0 BEADRP Cc1ccc(C2(C[NH2+]C3CC([NH3+])C3)CC2)c(C)c1 ZINC001579678479 986173379 /nfs/dbraw/zinc/17/33/79/986173379.db2.gz UCTRAUMBOYTNAV-UHFFFAOYSA-N 2 0 244.382 2.414 20 0 BEADRP CC[C@@H](C)C[C@@H](CC)[NH2+]CCC[N@H+](C)CCO ZINC001258786957 986202532 /nfs/dbraw/zinc/20/25/32/986202532.db2.gz DAZCZUFGDAPCPU-ZIAGYGMSSA-N 2 0 244.423 2.105 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2CC[C@@H](C)[C@@H]2C)CC1 ZINC001461886966 986217388 /nfs/dbraw/zinc/21/73/88/986217388.db2.gz KMHMGFYPKRRJGE-OLZOCXBDSA-N 2 0 224.392 2.449 20 0 BEADRP C[C@H]1CCC[C@H]([NH2+]C[C@H]2CCC[N@H+](C)C2)C1 ZINC001258807689 986265935 /nfs/dbraw/zinc/26/59/35/986265935.db2.gz JQNCSLPKMWJRKT-MJBXVCDLSA-N 2 0 224.392 2.497 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[N@H+](CC)CCOC ZINC001258907622 986311950 /nfs/dbraw/zinc/31/19/50/986311950.db2.gz LKWNEPLGCGCMCY-AWEZNQCLSA-N 2 0 244.423 2.465 20 0 BEADRP Cn1cccc1[C@H]1CCC[N@@H+]1CC(C)(C)C[NH3+] ZINC001579974621 986376975 /nfs/dbraw/zinc/37/69/75/986376975.db2.gz PMAXNBGIMZGSIO-CYBMUJFWSA-N 2 0 235.375 2.147 20 0 BEADRP CC=C(NC=[NH2+])c1cccc(C[NH+](C)C)c1F ZINC001244861988 986404240 /nfs/dbraw/zinc/40/42/40/986404240.db2.gz CLDQCAVODRJETQ-QCDXTXTGSA-N 2 0 235.306 2.445 20 0 BEADRP F[C@@]1(c2ccccc2)C[C@H]1[NH2+]CC1CC[NH2+]CC1 ZINC001580026277 986422529 /nfs/dbraw/zinc/42/25/29/986422529.db2.gz BJEWLFCTGLFALQ-HUUCEWRRSA-N 2 0 248.345 2.213 20 0 BEADRP FC1(CC[NH2+]C2CC3(C2)CC[NH2+]CC3)CCC1 ZINC001580024130 986425648 /nfs/dbraw/zinc/42/56/48/986425648.db2.gz QLJGFMPOPROEDZ-UHFFFAOYSA-N 2 0 240.366 2.391 20 0 BEADRP CC[NH+]1CCC(C[NH2+]C2(C)CC(F)(F)C2)CC1 ZINC001462558613 986434866 /nfs/dbraw/zinc/43/48/66/986434866.db2.gz JGECQHMGUUIADY-UHFFFAOYSA-N 2 0 246.345 2.496 20 0 BEADRP CCCC[C@H](C)[NH2+]C[C@H]1C[NH+]2CCC1CC2 ZINC001462632292 986465425 /nfs/dbraw/zinc/46/54/25/986465425.db2.gz CUWJATFNYASIJY-JSGCOSHPSA-N 2 0 224.392 2.497 20 0 BEADRP CC1CCC([NH2+]C[C@H]2C[NH+]3CCC2CC3)CC1 ZINC001462638656 986470358 /nfs/dbraw/zinc/47/03/58/986470358.db2.gz YRZQWSTVCCLUOF-BLZCZZARSA-N 2 0 236.403 2.497 20 0 BEADRP CCCC[C@H](CC)[N@@H+]1CC[C@H]2C[NH2+]C[C@H]21 ZINC000378661743 986610256 /nfs/dbraw/zinc/61/02/56/986610256.db2.gz BYGVETDBNLGBOU-RWMBFGLXSA-N 2 0 210.365 2.249 20 0 BEADRP CCCC(CCC)[N@@H+]1CC[C@H]2C[NH2+]C[C@H]21 ZINC000378663861 986613740 /nfs/dbraw/zinc/61/37/40/986613740.db2.gz DOYURVFWNBYCDL-WCQYABFASA-N 2 0 210.365 2.249 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH+]2CCC[C@H](F)CC2)CC1 ZINC001254517560 986651126 /nfs/dbraw/zinc/65/11/26/986651126.db2.gz VKZZPMXRRGCDMA-QWHCGFSZSA-N 2 0 228.355 2.295 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH+]2CC[C@](C)(CF)C2)CC1 ZINC001254515986 986653262 /nfs/dbraw/zinc/65/32/62/986653262.db2.gz ICGJJGDNLROAPS-QWHCGFSZSA-N 2 0 228.355 2.152 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH+]2CC[C@]3(CC3(F)F)C2)CC1 ZINC001254525093 986670011 /nfs/dbraw/zinc/67/00/11/986670011.db2.gz FZKAHYKBJWAHIH-RYUDHWBXSA-N 2 0 244.329 2.202 20 0 BEADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@H]2C[C@@]2(F)c2ccccc2)C1 ZINC001580258259 986714195 /nfs/dbraw/zinc/71/41/95/986714195.db2.gz LGXPSWIIKGJBMB-UQOMUDLDSA-N 2 0 248.345 2.341 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+]Cc1cccn1C1CC1 ZINC001580262194 986718118 /nfs/dbraw/zinc/71/81/18/986718118.db2.gz QJSJNSUNWJUCON-DOMZBBRYSA-N 2 0 247.386 2.430 20 0 BEADRP [NH3+]CCCCCC[NH2+]C[C@@H]1CC1(Cl)Cl ZINC001580293271 986737097 /nfs/dbraw/zinc/73/70/97/986737097.db2.gz KKZFWDPTOMRDEN-VIFPVBQESA-N 2 0 239.190 2.289 20 0 BEADRP C[N@H+](CC1CC(F)(F)C1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000383152447 986785444 /nfs/dbraw/zinc/78/54/44/986785444.db2.gz MEWVWSBHTLQNSH-FOSCPWQOSA-N 2 0 244.329 2.247 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[N@@H+]2CC[C@@H]2c2ccc(F)cc2)C1 ZINC001580419068 986838499 /nfs/dbraw/zinc/83/84/99/986838499.db2.gz RKPGJGIHXBLNNE-DDTOSNHZSA-N 2 0 234.318 2.310 20 0 BEADRP CCCC[C@H](C)N(CCC[NH3+])CCC[NH+](C)C ZINC001255315009 986908671 /nfs/dbraw/zinc/90/86/71/986908671.db2.gz ZPXSGSZWLOTLEF-AWEZNQCLSA-N 2 0 243.439 2.168 20 0 BEADRP C[C@@H]([NH3+])c1ccc(-c2ccncc2C[NH3+])cc1 ZINC001245556941 986943526 /nfs/dbraw/zinc/94/35/26/986943526.db2.gz BYJWPZIIKKZHNO-SNVBAGLBSA-N 2 0 227.311 2.227 20 0 BEADRP [NH3+]Cc1cnccc1-c1ccccc1C1([NH3+])CC1 ZINC001245559417 986950095 /nfs/dbraw/zinc/95/00/95/986950095.db2.gz CMKWLHSIWVZQCS-UHFFFAOYSA-N 2 0 239.322 2.155 20 0 BEADRP [NH3+]Cc1cnccc1-c1ccc2c(c1)[C@H]([NH3+])CC2 ZINC001245559549 986950683 /nfs/dbraw/zinc/95/06/83/986950683.db2.gz DHQPJPFURHMTQY-OAHLLOKOSA-N 2 0 239.322 2.153 20 0 BEADRP CC[NH+](CC)[C@H]1CC[C@H]([NH2+][C@@H](C)COC)CC1 ZINC001255566096 987017457 /nfs/dbraw/zinc/01/74/57/987017457.db2.gz AUOYMOQFZZLGHY-IHRRRGAJSA-N 2 0 242.407 2.264 20 0 BEADRP C[C@@H](CC(F)(F)F)[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC001255639061 987037535 /nfs/dbraw/zinc/03/75/35/987037535.db2.gz HHWRWHNIUYVHAH-CIUDSAMLSA-N 2 0 224.270 2.187 20 0 BEADRP CC[NH+](CC)CC[C@H](C)n1cccc1C[NH3+] ZINC001255942567 987077482 /nfs/dbraw/zinc/07/74/82/987077482.db2.gz FJMODWYLZWGVOI-LBPRGKRZSA-N 2 0 223.364 2.240 20 0 BEADRP C[C@@]1(C[NH3+])CC[N@H+](C[C@H]2CC3CCC2CC3)C1 ZINC000691657806 987288583 /nfs/dbraw/zinc/28/85/83/987288583.db2.gz AIGBDFCZIYVSAN-CVSAEHQPSA-N 2 0 236.403 2.483 20 0 BEADRP CC1CC([NH2+][C@@H]2[C@@H]3CCC[NH2+][C@@H]3C2(C)C)C1 ZINC000693752623 987315473 /nfs/dbraw/zinc/31/54/73/987315473.db2.gz ANDINMXUFFHFEZ-UDSBESMDSA-N 2 0 222.376 2.151 20 0 BEADRP CCC(C)(C)[C@H](C)[NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2 ZINC000695155663 987334106 /nfs/dbraw/zinc/33/41/06/987334106.db2.gz ZMEUBRDOPVCUAK-VZKILSJISA-N 2 0 236.403 2.397 20 0 BEADRP C[C@H]([NH2+]CC(C)(C)C[NH+](C)C)C1(Cl)CC1 ZINC000695683790 987334917 /nfs/dbraw/zinc/33/49/17/987334917.db2.gz CXQDQBJKLZPBHI-JTQLQIEISA-N 2 0 232.799 2.324 20 0 BEADRP CCC(C)(C)[C@H](C)[NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32 ZINC000695155658 987334976 /nfs/dbraw/zinc/33/49/76/987334976.db2.gz ZMEUBRDOPVCUAK-SNIKSBKOSA-N 2 0 236.403 2.397 20 0 BEADRP CC[C@@H]1C[C@@H](C)C[N@@H+]1C[C@@H]1CCCC[NH2+]C1 ZINC000697037163 987346257 /nfs/dbraw/zinc/34/62/57/987346257.db2.gz OBGWUAAIFFDMND-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)[C@@H]1CC[N@H+](C[C@@H]2CCCC[NH2+]C2)C1 ZINC000697052268 987348632 /nfs/dbraw/zinc/34/86/32/987348632.db2.gz MKKSDCIUTCTBJR-ZIAGYGMSSA-N 2 0 224.392 2.354 20 0 BEADRP CC1([NH2+][C@H]2CCCC[NH2+]C2)CCCCC1 ZINC001246079745 987372588 /nfs/dbraw/zinc/37/25/88/987372588.db2.gz FQKWCQTUBGDDRV-LBPRGKRZSA-N 2 0 210.365 2.441 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+]CC2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000699314188 987373389 /nfs/dbraw/zinc/37/33/89/987373389.db2.gz JDZGVEDESPXGLI-KZWUZSNJSA-N 2 0 222.376 2.295 20 0 BEADRP [NH3+]CCc1cn([C@@H]2CCC[NH2+]C2)c2ccccc12 ZINC001246082217 987376936 /nfs/dbraw/zinc/37/69/36/987376936.db2.gz OBAGEYKQWFDDQF-CYBMUJFWSA-N 2 0 243.354 2.067 20 0 BEADRP C[C@H]1CC[C@@H](n2ccc3cc(C[NH3+])ccc32)C[NH2+]1 ZINC001246085402 987384049 /nfs/dbraw/zinc/38/40/49/987384049.db2.gz QPKAFUUDYXSVGS-SMDDNHRTSA-N 2 0 243.354 2.413 20 0 BEADRP C[C@@H]1C[C@@H](n2ccc3cc(C[NH3+])ccc32)CC[NH2+]1 ZINC001246086823 987386507 /nfs/dbraw/zinc/38/65/07/987386507.db2.gz WCQOLTDHYKIZJX-RISCZKNCSA-N 2 0 243.354 2.413 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+][C@@H]2C[C@@H]3[C@H](C2)C3(C)C)C[NH2+]1 ZINC001246098913 987412506 /nfs/dbraw/zinc/41/25/06/987412506.db2.gz QKGVTEMIRQWZTH-ITGHMWBKSA-N 2 0 236.403 2.399 20 0 BEADRP CC(C)OCC[C@@H](C)[NH2+]C[C@H]1CC[C@@H](C)[NH2+]C1 ZINC001246099478 987419738 /nfs/dbraw/zinc/41/97/38/987419738.db2.gz RHGASAOGDHHTSH-MCIONIFRSA-N 2 0 242.407 2.168 20 0 BEADRP CC(C)OCC[C@@H](C)[NH2+]C[C@@H]1CC[C@H](C)[NH2+]C1 ZINC001246099476 987420572 /nfs/dbraw/zinc/42/05/72/987420572.db2.gz RHGASAOGDHHTSH-BFHYXJOUSA-N 2 0 242.407 2.168 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@H]2CC[C@@H](C)C[NH2+]2)C1 ZINC001246104958 987431735 /nfs/dbraw/zinc/43/17/35/987431735.db2.gz KZAGOGYIDFBJGB-FVCCEPFGSA-N 2 0 210.365 2.153 20 0 BEADRP CCC[C@H](CC)[NH2+]C[C@@H]1C[NH2+]C[C@@H](C)C1 ZINC001246105734 987431966 /nfs/dbraw/zinc/43/19/66/987431966.db2.gz WPSXYEUDHYDKAZ-AVGNSLFASA-N 2 0 212.381 2.400 20 0 BEADRP CC1CCC([NH2+]C[C@@H]2C[NH2+]C[C@H](C)C2)CC1 ZINC001246104848 987432244 /nfs/dbraw/zinc/43/22/44/987432244.db2.gz VLGGBABADRPQAF-DKNRTOFZSA-N 2 0 224.392 2.400 20 0 BEADRP CC(C)OCC[C@H](C)[NH2+]C[C@H]1CC[C@@H](C)C[NH2+]1 ZINC001246106239 987437771 /nfs/dbraw/zinc/43/77/71/987437771.db2.gz OROGYVYEPMNFJI-HZSPNIEDSA-N 2 0 242.407 2.168 20 0 BEADRP C[C@@H]1C[C@H](n2cc(C[NH3+])c3ccccc32)CC[NH2+]1 ZINC001246110084 987442628 /nfs/dbraw/zinc/44/26/28/987442628.db2.gz QMBJBKCBSXPOBP-DGCLKSJQSA-N 2 0 243.354 2.413 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@@H]2C[C@@H](F)CN2)CC(C)(C)C1 ZINC001246111881 987444244 /nfs/dbraw/zinc/44/42/44/987444244.db2.gz OSIJVSYVKMBJDW-NDBYEHHHSA-N 2 0 242.382 2.491 20 0 BEADRP CSCC[C@H](C)[NH2+]C[C@@H]1CCC[NH2+][C@H]1C ZINC001246110951 987446718 /nfs/dbraw/zinc/44/67/18/987446718.db2.gz MYUAWGLFQXCBBP-SRVKXCTJSA-N 2 0 230.421 2.106 20 0 BEADRP C[C@H]1C[NH2+]C[C@@H]1[NH2+]C1CCCCCCC1 ZINC001246110615 987447067 /nfs/dbraw/zinc/44/70/67/987447067.db2.gz TUHHJDUKMNMTKT-AAEUAGOBSA-N 2 0 210.365 2.297 20 0 BEADRP C[NH+](C)[C@@H](CNc1cc[nH+]cc1)c1cccs1 ZINC001116177454 987460388 /nfs/dbraw/zinc/46/03/88/987460388.db2.gz JJXMAJHTQKMPLL-LBPRGKRZSA-N 2 0 247.367 2.280 20 0 BEADRP CC(C)[C@@H]1C[C@@H]([NH2+]Cc2cccc(N)c2)CC[NH2+]1 ZINC001246119063 987464385 /nfs/dbraw/zinc/46/43/85/987464385.db2.gz ARBXXBTXRFKPII-GJZGRUSLSA-N 2 0 247.386 2.135 20 0 BEADRP CC[C@H](C)[NH2+][C@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246123371 987473796 /nfs/dbraw/zinc/47/37/96/987473796.db2.gz AKSHBXPLXDYBMB-RYUDHWBXSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@H]2CC[C@@H]3C[NH2+]C[C@@H]32)C[C@H]1C ZINC001246145112 987502236 /nfs/dbraw/zinc/50/22/36/987502236.db2.gz OUBHXAJDEAXXHB-JNWWKETESA-N 2 0 236.403 2.399 20 0 BEADRP C[C@H]1C[C@@H]([NH2+][C@H]2[C@@H]3C[C@H]2C[NH2+]C3)CC(C)(C)C1 ZINC001246145932 987504993 /nfs/dbraw/zinc/50/49/93/987504993.db2.gz GFYFXSDTJBDMMA-ODXJTPSBSA-N 2 0 236.403 2.399 20 0 BEADRP CC(C)CCC[C@@H](C)[NH2+][C@H]1[C@@H]2C[C@H]1C[NH2+]C2 ZINC001246145791 987505071 /nfs/dbraw/zinc/50/50/71/987505071.db2.gz DYSQMZKCTMJWLT-MQYQWHSLSA-N 2 0 224.392 2.399 20 0 BEADRP CCCCC[C@H](CC)[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001246150989 987513449 /nfs/dbraw/zinc/51/34/49/987513449.db2.gz VCUMPBYJDWGCJZ-WUHRBBMRSA-N 2 0 210.365 2.153 20 0 BEADRP C[NH2+]CC[C@H](C)[NH2+]CCc1ccc(C)cc1C ZINC001246160472 987523049 /nfs/dbraw/zinc/52/30/49/987523049.db2.gz ULNBDHDXSQTTOX-AWEZNQCLSA-N 2 0 234.387 2.434 20 0 BEADRP C[C@@H]1C[C@H](n2ccc3ccc(C[NH3+])cc32)CC[NH2+]1 ZINC001246167304 987527091 /nfs/dbraw/zinc/52/70/91/987527091.db2.gz FHJDDARWABPVIP-BXUZGUMPSA-N 2 0 243.354 2.413 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H]2CC[NH2+][C@@H](C)C2)s1 ZINC001246167107 987527246 /nfs/dbraw/zinc/52/72/46/987527246.db2.gz CQPHSZFBPKWITB-CMPLNLGQSA-N 2 0 238.400 2.329 20 0 BEADRP C[C@H]1C[C@H](n2ccc3ccc(C[NH3+])cc32)CC[NH2+]1 ZINC001246167311 987528787 /nfs/dbraw/zinc/52/87/87/987528787.db2.gz FHJDDARWABPVIP-SMDDNHRTSA-N 2 0 243.354 2.413 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC2(F)CCCCC2)CC[NH2+]1 ZINC001246176209 987544524 /nfs/dbraw/zinc/54/45/24/987544524.db2.gz MKHXBHHLELAXIH-VXGBXAGGSA-N 2 0 228.355 2.389 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]23)C[C@H]1C ZINC001246178491 987547533 /nfs/dbraw/zinc/54/75/33/987547533.db2.gz OUBHXAJDEAXXHB-LWGJEFJTSA-N 2 0 236.403 2.399 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@@H](C)[NH2+][C@@H](C)C1)c1cccc(N)c1 ZINC001246177566 987549598 /nfs/dbraw/zinc/54/95/98/987549598.db2.gz UGHLVUHRIYOBPG-OXIQGZBJSA-N 2 0 247.386 2.448 20 0 BEADRP CC(C)C1CCC([NH2+][C@H]2C[C@@H]([NH3+])C2)CC1 ZINC001246191625 987577447 /nfs/dbraw/zinc/57/74/47/987577447.db2.gz WTCWKBFHLHNFJS-JSTMSRMQSA-N 2 0 210.365 2.281 20 0 BEADRP C[C@H]1CCC[C@H]([NH2+]C[C@H]2CCC[NH2+]C2)C1 ZINC001246216417 987612548 /nfs/dbraw/zinc/61/25/48/987612548.db2.gz JACKSXYTNGWUCF-AVGNSLFASA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H]1CCC[C@@H]([NH2+]C[C@H]2CCC[NH2+]C2)C1 ZINC001246216418 987614882 /nfs/dbraw/zinc/61/48/82/987614882.db2.gz JACKSXYTNGWUCF-RWMBFGLXSA-N 2 0 210.365 2.154 20 0 BEADRP Cc1ccc(CN[C@@H]2CC[NH2+][C@H](C)C2)c(F)c1 ZINC001246229570 987624449 /nfs/dbraw/zinc/62/44/49/987624449.db2.gz DJRYTQIPPNGYOA-DGCLKSJQSA-N 2 0 236.334 2.364 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@H]2CC[C@@H]3CCC[C@@H]32)CN1 ZINC001246228869 987626276 /nfs/dbraw/zinc/62/62/76/987626276.db2.gz GYCLRYSFJHDAOT-QMVSFRDZSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@@H]1CC[C@H](N[C@H]2CCNc3ccccc32)C[NH2+]1 ZINC001246229913 987626536 /nfs/dbraw/zinc/62/65/36/987626536.db2.gz LWTPRBXLSTYHSA-XUJVJEKNSA-N 2 0 245.370 2.273 20 0 BEADRP Cc1cccc2c1CC[C@H]([NH2+]CC(C)(C)C[NH3+])C2 ZINC001246253558 987651999 /nfs/dbraw/zinc/65/19/99/987651999.db2.gz ZQBNUQASPTUZLH-AWEZNQCLSA-N 2 0 246.398 2.427 20 0 BEADRP CCC1([NH2+]C2CC[NH2+]CC2)CCCCC1 ZINC001246258494 987654803 /nfs/dbraw/zinc/65/48/03/987654803.db2.gz XAHAIQNGEWSOCP-UHFFFAOYSA-N 2 0 210.365 2.441 20 0 BEADRP CCC[NH2+]CCN[C@@H](C)Cc1cccc(F)c1 ZINC001246271115 987666249 /nfs/dbraw/zinc/66/62/49/987666249.db2.gz QDBQRHHXBWCTKN-LBPRGKRZSA-N 2 0 238.350 2.346 20 0 BEADRP Fc1ccc([C@H]2C[C@@H]2[NH2+]C2CC[NH2+]CC2)cc1 ZINC001246278978 987673143 /nfs/dbraw/zinc/67/31/43/987673143.db2.gz CPQCVYPKYPPUIW-KGLIPLIRSA-N 2 0 234.318 2.023 20 0 BEADRP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc(N)cc1 ZINC001246282792 987674603 /nfs/dbraw/zinc/67/46/03/987674603.db2.gz CVOHVWZCBKVIRO-FMVWZJFZSA-N 2 0 245.370 2.202 20 0 BEADRP CC[NH+]1CCC(C[N@H+](C)C2CCC2)CC1 ZINC001474355256 987695270 /nfs/dbraw/zinc/69/52/70/987695270.db2.gz KICPTTWRQGDPPI-UHFFFAOYSA-N 2 0 210.365 2.203 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@H]1CCO[C@H](c2ccccc2)C1 ZINC001246302733 987702237 /nfs/dbraw/zinc/70/22/37/987702237.db2.gz AGJKZKKTNKLCQS-QEJZJMRPSA-N 2 0 248.370 2.234 20 0 BEADRP CC[NH+]1CCC(C[N@H+]2CC=C(C)CC2)CC1 ZINC001474370264 987702974 /nfs/dbraw/zinc/70/29/74/987702974.db2.gz RCBSGNDUPAMPTR-UHFFFAOYSA-N 2 0 222.376 2.370 20 0 BEADRP C[C@H]1CCCC[C@H]1[NH2+][C@H]1CCCC[NH2+]C1 ZINC001246334641 987741396 /nfs/dbraw/zinc/74/13/96/987741396.db2.gz VZEMLTIMEVHOFB-RWMBFGLXSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]1C[C@H]([NH2+][C@@H]2CCCC[C@@H]2C)CC[NH2+]1 ZINC001246333957 987742462 /nfs/dbraw/zinc/74/24/62/987742462.db2.gz SQSCZDJTWXXKFS-WUHRBBMRSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H]1C[C@@H]([NH2+][C@@H]2CCCC[C@@H]2C)CC[NH2+]1 ZINC001246333958 987742976 /nfs/dbraw/zinc/74/29/76/987742976.db2.gz SQSCZDJTWXXKFS-ZDEQEGDKSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]Cc2cccc3ncoc32)CC[NH2+]1 ZINC001246335579 987746038 /nfs/dbraw/zinc/74/60/38/987746038.db2.gz ZINPZPLZILJXRJ-PWSUYJOCSA-N 2 0 245.326 2.058 20 0 BEADRP C[C@H]1C[C@H]([NH2+]Cc2cccc3ncoc32)CC[NH2+]1 ZINC001246335577 987746320 /nfs/dbraw/zinc/74/63/20/987746320.db2.gz ZINPZPLZILJXRJ-CMPLNLGQSA-N 2 0 245.326 2.058 20 0 BEADRP C[C@H](Cc1cccc(O)c1)[NH2+][C@@H]1CC[NH2+][C@H](C)C1 ZINC001246344728 987752395 /nfs/dbraw/zinc/75/23/95/987752395.db2.gz COOIRAMZKGZUFT-YRGRVCCFSA-N 2 0 248.370 2.053 20 0 BEADRP Cc1ccnc(C(C)(C)C[NH2+]C2CC[NH2+]CC2)c1 ZINC001246393365 987778440 /nfs/dbraw/zinc/77/84/40/987778440.db2.gz XEOXPGKZZHGTCC-UHFFFAOYSA-N 2 0 247.386 2.009 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C(C)(C)CC2CC2)CC[NH2+]1 ZINC001246396454 987782871 /nfs/dbraw/zinc/78/28/71/987782871.db2.gz ZQABMZRUPMOBFC-ZYHUDNBSSA-N 2 0 210.365 2.295 20 0 BEADRP C[NH2+]CC[C@@H](C)[NH2+]C[C@@H]1CCC(C)(C)C1 ZINC001246432890 987783091 /nfs/dbraw/zinc/78/30/91/987783091.db2.gz IQJWVICSWHZZCS-VXGBXAGGSA-N 2 0 212.381 2.400 20 0 BEADRP CC(C)(CC1CCC1)[NH2+]C1CC[NH2+]CC1 ZINC001246406295 987789154 /nfs/dbraw/zinc/78/91/54/987789154.db2.gz MADIECBBZJJANO-UHFFFAOYSA-N 2 0 210.365 2.297 20 0 BEADRP FC(F)(F)[C@@H]1CCC[C@@H]([NH2+][C@H]2CC23C[NH2+]C3)C1 ZINC001246445119 987802243 /nfs/dbraw/zinc/80/22/43/987802243.db2.gz MMLNMXZDVUMQPS-BBBLOLIVSA-N 2 0 248.292 2.059 20 0 BEADRP CCCC[C@H](CCC)[NH2+][C@H]1CC12C[NH2+]C2 ZINC001246444278 987803631 /nfs/dbraw/zinc/80/36/31/987803631.db2.gz JUZZDLDQXSYVRS-RYUDHWBXSA-N 2 0 210.365 2.297 20 0 BEADRP CCC[C@H](Cc1ccccc1)[NH2+][C@H]1CC12C[NH2+]C2 ZINC001246445417 987804050 /nfs/dbraw/zinc/80/40/50/987804050.db2.gz OBKNGTSORBKMQX-CABCVRRESA-N 2 0 244.382 2.349 20 0 BEADRP CC(C)C[C@H](C)C[C@H](C)[NH2+][C@H]1CC12C[NH2+]C2 ZINC001246446762 987806761 /nfs/dbraw/zinc/80/67/61/987806761.db2.gz TYQVJQLOHIKWML-AVGNSLFASA-N 2 0 224.392 2.399 20 0 BEADRP CCC[C@@]1(C[NH2+][C@H]2CC[C@H](C)C2)CC[NH2+]1 ZINC001246455677 987812215 /nfs/dbraw/zinc/81/22/15/987812215.db2.gz IZPLLNVFEAYKCO-AVGNSLFASA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]([NH2+]C1CC[NH2+]CC1)c1cccc(N(C)C)c1 ZINC001246469547 987828559 /nfs/dbraw/zinc/82/85/59/987828559.db2.gz RSPURABSQTYSQK-LBPRGKRZSA-N 2 0 247.386 2.155 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@@H]2CC[NH2+]C[C@@H]2F)C[C@H]1C ZINC001246475441 987831593 /nfs/dbraw/zinc/83/15/93/987831593.db2.gz FTTNYWKZDGMJSN-DGTMBMJNSA-N 2 0 242.382 2.348 20 0 BEADRP CCCC[C@H](CC)[NH2+]C[C@@H]1CC[NH2+]C[C@@H]1F ZINC001246478214 987834076 /nfs/dbraw/zinc/83/40/76/987834076.db2.gz VBOSZPJYIGXFGT-AVGNSLFASA-N 2 0 230.371 2.492 20 0 BEADRP [NH3+][C@@H]1CCCC[C@@H]1[NH2+]C1CCC(F)(F)CC1 ZINC001246479221 987838044 /nfs/dbraw/zinc/83/80/44/987838044.db2.gz SJZVYCGVYHNYAF-MNOVXSKESA-N 2 0 232.318 2.424 20 0 BEADRP CC[C@@H]1CC[C@H]([NH2+][C@H]2CCCC[C@H]2[NH3+])C1 ZINC001246479897 987839163 /nfs/dbraw/zinc/83/91/63/987839163.db2.gz VSRVHAGHMYWQNG-XQHKEYJVSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@@H]1CC[C@@H](C)C1[NH2+][C@H]1CC[NH2+][C@H](C)C1 ZINC001246493606 987846803 /nfs/dbraw/zinc/84/68/03/987846803.db2.gz ILPDFIFQCOYMSG-KKOKHZNYSA-N 2 0 210.365 2.151 20 0 BEADRP C[NH2+][C@H]1C[C@@H]([NH2+][C@@H]2CC[C@H](C)[C@H](C)C2)C1 ZINC001246496629 987850165 /nfs/dbraw/zinc/85/01/65/987850165.db2.gz PEMDERSRFFMBNC-CKIKVBCHSA-N 2 0 210.365 2.151 20 0 BEADRP C[NH2+][C@H]1C[C@@H]([NH2+][C@H]2C[C@H](C)C[C@H](C)C2)C1 ZINC001246494790 987850977 /nfs/dbraw/zinc/85/09/77/987850977.db2.gz HTBLJIUNSHFWBL-CXYFJQCHSA-N 2 0 210.365 2.151 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@H]2CCCc3ccncc32)CC[NH2+]1 ZINC001246501646 987855195 /nfs/dbraw/zinc/85/51/95/987855195.db2.gz BCJUWANASIIMGJ-ZLDLUXBVSA-N 2 0 245.370 2.189 20 0 BEADRP C[C@]1([NH3+])CC[N@@H+](C2CC(C)(C)OC(C)(C)C2)C1 ZINC001246532816 987889508 /nfs/dbraw/zinc/88/95/08/987889508.db2.gz YJNKFDHINZWTKE-AWEZNQCLSA-N 2 0 240.391 2.146 20 0 BEADRP CCCC[C@H](CCC)[N@@H+]1CCO[C@H](CC[NH3+])C1 ZINC001246536318 987894606 /nfs/dbraw/zinc/89/46/06/987894606.db2.gz ULRNRQAORQYOND-UONOGXRCSA-N 2 0 242.407 2.395 20 0 BEADRP CC(C)OCC[C@H](C)[N@@H+]1CCC[C@H]([NH3+])CC1 ZINC001246538415 987897065 /nfs/dbraw/zinc/89/70/65/987897065.db2.gz BVMVTEZYKXIRQR-STQMWFEESA-N 2 0 228.380 2.003 20 0 BEADRP C[C@H]1C[N@@H+]([C@@H]2CC[C@@H](C)[C@@H](C)C2)C[C@H]1C[NH3+] ZINC001246541668 987913158 /nfs/dbraw/zinc/91/31/58/987913158.db2.gz MNKURBWAUIAWSS-MBJXGIAVSA-N 2 0 224.392 2.338 20 0 BEADRP CC(C)CC[C@@H](C)[N@@H+]1C[C@H](C)[C@H](C[NH3+])C1 ZINC001246542979 987913710 /nfs/dbraw/zinc/91/37/10/987913710.db2.gz QOQCBHPDWUPNRH-YNEHKIRRSA-N 2 0 212.381 2.338 20 0 BEADRP CCCC[C@@H](CC)[N@@H+]1CCC[C@@](O)(C[NH3+])CC1 ZINC001246545129 987920421 /nfs/dbraw/zinc/92/04/21/987920421.db2.gz TYZFCTJJCOJLSZ-KGLIPLIRSA-N 2 0 242.407 2.131 20 0 BEADRP CCCC[C@@H](CC)[N@@H+]1CCC[C@](O)(C[NH3+])CC1 ZINC001246545133 987921774 /nfs/dbraw/zinc/92/17/74/987921774.db2.gz TYZFCTJJCOJLSZ-ZIAGYGMSSA-N 2 0 242.407 2.131 20 0 BEADRP C[C@H](Cc1ccco1)[N@@H+]1CCC[C@](C)([NH3+])CC1 ZINC001246547898 987928892 /nfs/dbraw/zinc/92/88/92/987928892.db2.gz CZWUYTFNVDVXFN-OCCSQVGLSA-N 2 0 236.359 2.414 20 0 BEADRP Cc1ccc2c(c1)C[C@@H]([N@H+]1CC[C@@H]([NH3+])[C@H]1C)CC2 ZINC001246546108 987929023 /nfs/dbraw/zinc/92/90/23/987929023.db2.gz YGKRPQSEBQNIFO-UHOFOFEASA-N 2 0 244.382 2.274 20 0 BEADRP C[C@H](CC(F)(F)F)[N@@H+]1CCC[C@@H]([NH3+])CC1 ZINC001246548209 987933321 /nfs/dbraw/zinc/93/33/21/987933321.db2.gz SUJLEHKQVXJYME-RKDXNWHRSA-N 2 0 224.270 2.141 20 0 BEADRP C[C@H](Cc1ccncc1)[N@@H+]1CCC[C@@](C)([NH3+])CC1 ZINC001246548388 987937669 /nfs/dbraw/zinc/93/76/69/987937669.db2.gz GKXQUCGGILPRRI-UKRRQHHQSA-N 2 0 247.386 2.216 20 0 BEADRP C[C@@]1([NH3+])CCC[N@@H+](C2Cc3ccccc3C2)CC1 ZINC001246551059 987942286 /nfs/dbraw/zinc/94/22/86/987942286.db2.gz KISMRTZLDQLAPN-MRXNPFEDSA-N 2 0 244.382 2.357 20 0 BEADRP C[NH2+]C[C@H]1CCC[N@@H+]([C@H]2C[C@@H]3[C@H](C2)C3(C)C)C1 ZINC001246549970 987942552 /nfs/dbraw/zinc/94/25/52/987942552.db2.gz LAQBWAJWQVJKGT-YIYPIFLZSA-N 2 0 236.403 2.352 20 0 BEADRP [NH3+]C[C@]1(F)CCC[N@@H+]([C@H]2CCCSC2)CC1 ZINC001246551065 987942908 /nfs/dbraw/zinc/94/29/08/987942908.db2.gz OUDAKWATTAVEMW-RYUDHWBXSA-N 2 0 246.395 2.035 20 0 BEADRP C[C@@H](Cc1ccc(F)cc1)N1CC[C@@H]([NH3+])[C@H]1C ZINC001246550080 987947763 /nfs/dbraw/zinc/94/77/63/987947763.db2.gz NTXQLGYJPFIGHS-MISXGVKJSA-N 2 0 236.334 2.178 20 0 BEADRP CSCC[C@H](C)[N@@H+]1CCC[C@@](C)([NH3+])CC1 ZINC001246552936 987950273 /nfs/dbraw/zinc/95/02/73/987950273.db2.gz QDXBDAMEBHOKGZ-NWDGAFQWSA-N 2 0 230.421 2.331 20 0 BEADRP CC1(C)C[C@@H]([N@@H+]2CCC[C@](C)([NH3+])CC2)CCO1 ZINC001246552073 987952619 /nfs/dbraw/zinc/95/26/19/987952619.db2.gz NRBVZNCPKHXICI-JSGCOSHPSA-N 2 0 240.391 2.147 20 0 BEADRP CSCC[C@H](C)[N@@H+]1CC[C@@H](C)[C@H](C[NH3+])CC1 ZINC001246555387 987965087 /nfs/dbraw/zinc/96/50/87/987965087.db2.gz DVSIYTSHRDEUAG-AGIUHOORSA-N 2 0 244.448 2.435 20 0 BEADRP C[C@H]1CC[N@@H+](C2CCSCC2)CC[C@@H]1C[NH3+] ZINC001246557249 987977044 /nfs/dbraw/zinc/97/70/44/987977044.db2.gz KFXFTQMWIMDWRS-NWDGAFQWSA-N 2 0 242.432 2.189 20 0 BEADRP [NH3+]C[C@H]1CC[C@H]([NH2+]Cc2ccc3c(c2)CCC3)C1 ZINC001118015862 987980183 /nfs/dbraw/zinc/98/01/83/987980183.db2.gz NURYQDXRMDAZRT-LRDDRELGSA-N 2 0 244.382 2.392 20 0 BEADRP CCCCC[C@H](CCC)[N@@H+]1CC[C@@H]([NH3+])[C@H](O)C1 ZINC001246558718 987982677 /nfs/dbraw/zinc/98/26/77/987982677.db2.gz MPTLRZDIUDNXCD-BFHYXJOUSA-N 2 0 242.407 2.129 20 0 BEADRP C[C@@H]1CC[N@@H+]([C@@H]2C[C@H]3C[C@H]3C2)CC[C@@H]1C[NH3+] ZINC001246561418 987991020 /nfs/dbraw/zinc/99/10/20/987991020.db2.gz SLTVLHYHBFMFMJ-XGFWRYKXSA-N 2 0 222.376 2.092 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@@H](C)CCC(F)(F)F ZINC001118057451 987995413 /nfs/dbraw/zinc/99/54/13/987995413.db2.gz QVJOGXRAZMXNLL-IUCAKERBSA-N 2 0 226.286 2.305 20 0 BEADRP CC(C)OC1CCC([N@@H+]2C[C@@H](C)[C@H]([NH3+])C2)CC1 ZINC001246561259 987997454 /nfs/dbraw/zinc/99/74/54/987997454.db2.gz JRWGNHGGKVNFFQ-BLYZHGLHSA-N 2 0 240.391 2.002 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H](C)c1ccc(C)nc1C ZINC001118058476 987998613 /nfs/dbraw/zinc/99/86/13/987998613.db2.gz KONKVPAVUFVXRY-PWSUYJOCSA-N 2 0 235.375 2.347 20 0 BEADRP C[C@@H](CC1CC1)[N@@H+]1CC[C@@H](C)[C@@H](C[NH3+])CC1 ZINC001246563699 988003491 /nfs/dbraw/zinc/00/34/91/988003491.db2.gz XNYZMGKPMNROIE-MBNYWOFBSA-N 2 0 224.392 2.482 20 0 BEADRP C[C@@H]1CC[N@@H+]([C@H]2CCCSC2)CC[C@@H]1C[NH3+] ZINC001246564773 988018259 /nfs/dbraw/zinc/01/82/59/988018259.db2.gz ZVISTNWUKMFYAQ-UPJWGTAASA-N 2 0 242.432 2.189 20 0 BEADRP CC(C)CCC[C@@H](C)[N@@H+]1C[C@@H](C)[C@H]([NH3+])C1 ZINC001246565361 988021195 /nfs/dbraw/zinc/02/11/95/988021195.db2.gz CLHOWJJINWMKNQ-JHJVBQTASA-N 2 0 212.381 2.480 20 0 BEADRP CCC(C)(C)[C@@H](C)[NH2+]CC[C@@H](C)[NH2+]C ZINC001118121688 988021647 /nfs/dbraw/zinc/02/16/47/988021647.db2.gz HKQZFMJXHKXYBX-GHMZBOCLSA-N 2 0 200.370 2.399 20 0 BEADRP CC1([NH2+][C@H]2C[C@H]([NH3+])c3ccccc32)CC1 ZINC001118118922 988022395 /nfs/dbraw/zinc/02/23/95/988022395.db2.gz KQDNVEDJDQBJML-RYUDHWBXSA-N 2 0 202.301 2.273 20 0 BEADRP CCCOC1CCC([N@@H+]2C[C@@H](C)[C@H]([NH3+])C2)CC1 ZINC001246566645 988025339 /nfs/dbraw/zinc/02/53/39/988025339.db2.gz IGKFGQCARLDCHY-BLYZHGLHSA-N 2 0 240.391 2.003 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@@H]1CCc2ccc(F)cc21 ZINC001118122126 988028973 /nfs/dbraw/zinc/02/89/73/988028973.db2.gz PQAQXZFPLGTPAR-IINYFYTJSA-N 2 0 236.334 2.401 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2CCC[C@H](C[NH3+])[C@@H](C)C2)C1 ZINC001246567931 988030957 /nfs/dbraw/zinc/03/09/57/988030957.db2.gz NELLSDZIAPVAML-RQJABVFESA-N 2 0 224.392 2.482 20 0 BEADRP C[C@H]1C[N@@H+](C2C[C@H]3CC[C@@H](C2)[NH2+]3)CCC1(F)F ZINC001246567668 988031022 /nfs/dbraw/zinc/03/10/22/988031022.db2.gz XJRKDIFYXKAAQR-WSMDXJOWSA-N 2 0 244.329 2.247 20 0 BEADRP C[C@@H]1C[C@@H]([N@@H+]2CCCC[C@](C)(F)C2)CC[NH2+]1 ZINC001246571609 988053751 /nfs/dbraw/zinc/05/37/51/988053751.db2.gz DMCFKPUVUHPLSN-AGIUHOORSA-N 2 0 228.355 2.341 20 0 BEADRP C[NH2+]CC[C@H](C)[N@@H+]1CCC[C@@H](C)[C@H](C)C1 ZINC001246572967 988070830 /nfs/dbraw/zinc/07/08/30/988070830.db2.gz LNHDZFKQQNZENQ-UPJWGTAASA-N 2 0 212.381 2.352 20 0 BEADRP CCCCCC[C@H](CC)[N@@H+]1CC[C@@H]([NH3+])[C@H](O)C1 ZINC001246573690 988072998 /nfs/dbraw/zinc/07/29/98/988072998.db2.gz ZBXNORFYAXWRAS-BFHYXJOUSA-N 2 0 242.407 2.129 20 0 BEADRP C[C@H]1C[C@@H]([N@@H+]2CCC[C@@](C)(C[NH3+])CC2)CCO1 ZINC001246579848 988104838 /nfs/dbraw/zinc/10/48/38/988104838.db2.gz LTSHHWBNKMLITL-MELADBBJSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2CCCC[C@@](C)(C[NH3+])C2)CCO1 ZINC001246585584 988131900 /nfs/dbraw/zinc/13/19/00/988131900.db2.gz PIEDEAYFKWHYIY-MCIONIFRSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@@H](Cc1ccncc1)[N@@H+]1CCCC[C@H](C[NH3+])C1 ZINC001246590582 988165126 /nfs/dbraw/zinc/16/51/26/988165126.db2.gz HHTRHMIAFNEUCN-DZGCQCFKSA-N 2 0 247.386 2.073 20 0 BEADRP CC1(C)C[N@@H+](C2CC[NH2+]CC2)CCC1(F)F ZINC001246599940 988207177 /nfs/dbraw/zinc/20/71/77/988207177.db2.gz QDJAHQXXPHDUDB-UHFFFAOYSA-N 2 0 232.318 2.106 20 0 BEADRP CSCC[C@H](C)[N@@H+]1CCC[C@]12CCC[NH2+]C2 ZINC001246609749 988238059 /nfs/dbraw/zinc/23/80/59/988238059.db2.gz NAGCSMWTWLXONL-STQMWFEESA-N 2 0 242.432 2.346 20 0 BEADRP C[C@@H]1CC[C@@H]([N@@H+]2CC[C@H]3C[NH2+]CC[C@H]32)C[C@H]1C ZINC001246617540 988252846 /nfs/dbraw/zinc/25/28/46/988252846.db2.gz DBILPCBQUSZUSJ-UXXRCYHCSA-N 2 0 236.403 2.495 20 0 BEADRP CCCCC[C@H](CC)[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC001246628084 988288557 /nfs/dbraw/zinc/28/85/57/988288557.db2.gz WVPQFPZHIMULPB-MJBXVCDLSA-N 2 0 224.392 2.497 20 0 BEADRP [NH3+]CC1(F)CC[NH+](C2CCC3(CC3)CC2)CC1 ZINC001246628612 988291583 /nfs/dbraw/zinc/29/15/83/988291583.db2.gz OIILOTPFOJEENP-UHFFFAOYSA-N 2 0 240.366 2.472 20 0 BEADRP CC(C)CCC[C@H](C)[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC001246628166 988297690 /nfs/dbraw/zinc/29/76/90/988297690.db2.gz XUWRHDFHZITTDJ-MELADBBJSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1CCC[C@H]([N@@H+]2CC[C@@H]3[NH2+]CC[C@H]32)C1 ZINC001246629654 988310215 /nfs/dbraw/zinc/31/02/15/988310215.db2.gz FQPZPGIEUVFHPP-MROQNXINSA-N 2 0 208.349 2.001 20 0 BEADRP C[C@H]1CCC[C@H]([N@@H+]2CC[C@@H]3[NH2+]CC[C@H]32)C1 ZINC001246629659 988310655 /nfs/dbraw/zinc/31/06/55/988310655.db2.gz FQPZPGIEUVFHPP-ZDEQEGDKSA-N 2 0 208.349 2.001 20 0 BEADRP C1CC12CCC([N@@H+]1CC[C@@H]3[NH2+]CC[C@H]31)CC2 ZINC001246633014 988315127 /nfs/dbraw/zinc/31/51/27/988315127.db2.gz IZPAGBIJMMMLMM-QWHCGFSZSA-N 2 0 220.360 2.145 20 0 BEADRP CC1(C)CC[C@@H]([NH+]2CCC(F)(C[NH3+])CC2)C1 ZINC001246632047 988319102 /nfs/dbraw/zinc/31/91/02/988319102.db2.gz YXCLHIUTBZBKGR-LLVKDONJSA-N 2 0 228.355 2.328 20 0 BEADRP CC[C@H](CC(C)C)[N@@H+]1CC[C@@H]2CC[NH2+][C@@H]2C1 ZINC001246634030 988320994 /nfs/dbraw/zinc/32/09/94/988320994.db2.gz GSLARTRLUBTHBW-BFHYXJOUSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1C[C@@H]([N@H+]2C[C@@H]3CC(F)(F)C[C@@H]3C2)CC[NH2+]1 ZINC001246636636 988328170 /nfs/dbraw/zinc/32/81/70/988328170.db2.gz DFAIOMYZQYYYNN-WYUUTHIRSA-N 2 0 244.329 2.104 20 0 BEADRP CC[C@H](C)OCC[C@@H](C)N1CC[C@@H]2[NH2+]CC[C@H]21 ZINC001246641474 988346261 /nfs/dbraw/zinc/34/62/61/988346261.db2.gz IIZLUQXGDFMESW-ZOBORPQBSA-N 2 0 240.391 2.016 20 0 BEADRP CC[C@H](C)C[C@H](CC)[N@@H+]1CC[C@H]2C[NH2+]C[C@H]21 ZINC001246643811 988353663 /nfs/dbraw/zinc/35/36/63/988353663.db2.gz DJBDXGRZCKIJRS-XDQVBPFNSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1CC[C@@H]([N@@H+]2CC[C@H]3C[NH2+]C[C@H]32)C[C@H]1C ZINC001246644884 988359476 /nfs/dbraw/zinc/35/94/76/988359476.db2.gz JKVJDJFCXRXNMX-RKQHYHRCSA-N 2 0 222.376 2.105 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2CCCC[C@]23CC[NH2+]C3)C1 ZINC001246645843 988363269 /nfs/dbraw/zinc/36/32/69/988363269.db2.gz WOLCXFBLDDNIMY-HZSPNIEDSA-N 2 0 222.376 2.393 20 0 BEADRP CC(C)C1CCC([N@@H+]2CC[C@H]3C[NH2+]C[C@H]32)CC1 ZINC001246647317 988363959 /nfs/dbraw/zinc/36/39/59/988363959.db2.gz RTOCSCHNLSIEBI-OOJKYFRXSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2CC[C@@H]3[NH2+]CC[C@H]32)C[C@@H]1C ZINC001246647142 988364673 /nfs/dbraw/zinc/36/46/73/988364673.db2.gz ZEYVORMFGNMNBC-IKOXMDCHSA-N 2 0 222.376 2.247 20 0 BEADRP CCC[C@@H](Cc1ccccc1)[N@H+]1C[C@@H]2[C@@H]([NH3+])[C@@H]2C1 ZINC001246653854 988379816 /nfs/dbraw/zinc/37/98/16/988379816.db2.gz AOGLKUOMMWXMKW-CAOSSQGBSA-N 2 0 244.382 2.287 20 0 BEADRP CCCC1CCC([N@H+]2C[C@@H]3[C@@H]([NH3+])[C@@H]3C2)CC1 ZINC001246659111 988384076 /nfs/dbraw/zinc/38/40/76/988384076.db2.gz RBIBDJYQZYOJOD-TWASESMYSA-N 2 0 222.376 2.234 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2CC[C@H]3CCC[C@H]3C2)C[NH2+]1 ZINC001246655752 988387413 /nfs/dbraw/zinc/38/74/13/988387413.db2.gz KPWDWZPXUFMISZ-MQYQWHSLSA-N 2 0 222.376 2.249 20 0 BEADRP CCCC[C@@H](CCC)[N@H+]1C[C@@H]2[C@@H]([NH3+])[C@@H]2C1 ZINC001246661463 988400972 /nfs/dbraw/zinc/40/09/72/988400972.db2.gz XRVVYGXYMYXATN-NDBYEHHHSA-N 2 0 210.365 2.234 20 0 BEADRP CCC[C@H](C)CC[C@@H](C)[N@H+]1C[C@@H]2[C@H]([NH3+])[C@@H]2C1 ZINC001246665974 988403534 /nfs/dbraw/zinc/40/35/34/988403534.db2.gz VOMDTPRPHJXJAN-VJTDZRGJSA-N 2 0 224.392 2.480 20 0 BEADRP CC(C)CCC[C@H](C)[N@@H+]1C[C@H]2C[NH2+]CC[C@H]21 ZINC001246669873 988410418 /nfs/dbraw/zinc/41/04/18/988410418.db2.gz CFOHPPNMUVQRHY-BFHYXJOUSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2C[C@H]3C[NH2+]CC[C@@H]32)CC(C)(C)C1 ZINC001246672749 988414775 /nfs/dbraw/zinc/41/47/75/988414775.db2.gz LGJIRXWEVMKIAM-MQYQWHSLSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2CCC[C@H]2c2ccccn2)CC[NH2+]1 ZINC001246786830 988466888 /nfs/dbraw/zinc/46/68/88/988466888.db2.gz AIIFANYEGHNOCQ-NFAWXSAZSA-N 2 0 245.370 2.359 20 0 BEADRP C[C@@H]1C[C@@H]([N@@H+]2CCC[C@@H](C)[C@H]2C)CC[NH2+]1 ZINC001246786925 988470285 /nfs/dbraw/zinc/47/02/85/988470285.db2.gz BFFRSWMZRDXURF-LPWJVIDDSA-N 2 0 210.365 2.247 20 0 BEADRP FC(F)[C@@H]1CCC[N@@H+](C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC001246805221 988483186 /nfs/dbraw/zinc/48/31/86/988483186.db2.gz CGAMJUBQZXBNHO-YIBTVLSRSA-N 2 0 244.329 2.247 20 0 BEADRP FC1(F)C[C@@]12CC[N@@H+](C1C[C@H]3CC[C@@H](C1)[NH2+]3)C2 ZINC001246804721 988486117 /nfs/dbraw/zinc/48/61/17/988486117.db2.gz BPLFEVOMMVCCQM-AYLPWXGPSA-N 2 0 242.313 2.001 20 0 BEADRP C[C@@H]1CC[N@@H+]([C@H]2CC[NH2+][C@H](C)C2)[C@@H](C)C1 ZINC001246811410 988498230 /nfs/dbraw/zinc/49/82/30/988498230.db2.gz VELJTGIBRWVDFS-NDBYEHHHSA-N 2 0 210.365 2.247 20 0 BEADRP C[C@H]1C[C@H](N2Cc3cccc(F)c3C2)CC[NH2+]1 ZINC001246822643 988511889 /nfs/dbraw/zinc/51/18/89/988511889.db2.gz MHQYRXXJVDGHES-CMPLNLGQSA-N 2 0 234.318 2.282 20 0 BEADRP CC(C)CC[C@H](C)[N@H+]1C[C@H]2C[NH2+]CC[C@@H]2C1 ZINC001246842682 988550727 /nfs/dbraw/zinc/55/07/27/988550727.db2.gz DAGDJKVRDDUYOU-BFHYXJOUSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1C[C@H]([N@H+](C)C[C@H]2CC2(C)C)CC[NH2+]1 ZINC001246846179 988555199 /nfs/dbraw/zinc/55/51/99/988555199.db2.gz NDDBSKYPKCPMMD-IJLUTSLNSA-N 2 0 210.365 2.105 20 0 BEADRP CC[C@H](Cc1ccccc1)[N@@H+]1C[C@H]2CC[C@@]2([NH3+])C1 ZINC001246851720 988570924 /nfs/dbraw/zinc/57/09/24/988570924.db2.gz GSXIIWDIUCXZFA-BZUAXINKSA-N 2 0 244.382 2.431 20 0 BEADRP CCCCC[C@H](C)[N@@H+]1C[C@H]2CC[C@]2([NH3+])C1 ZINC001246857568 988586250 /nfs/dbraw/zinc/58/62/50/988586250.db2.gz AZWHTYFKLVCCOG-XQQFMLRXSA-N 2 0 210.365 2.378 20 0 BEADRP CC(C)CC[C@H](C)[N@@H+]1C[C@H]2CC[C@]2([NH3+])C1 ZINC001246862127 988597763 /nfs/dbraw/zinc/59/77/63/988597763.db2.gz QBMRWEPKEWYPEA-XQQFMLRXSA-N 2 0 210.365 2.234 20 0 BEADRP CCCC[C@H](C)[N@@H+]1C[C@H]2CC[C@@H](C1)[NH2+]C2 ZINC001246867042 988621457 /nfs/dbraw/zinc/62/14/57/988621457.db2.gz MZVDKJSAULNGEA-AVGNSLFASA-N 2 0 210.365 2.249 20 0 BEADRP CC1(C)[C@@H]2C[C@@H]([N@@H+]3C[C@H]4CC[C@@H](C3)[NH2+]C4)C[C@@H]21 ZINC001246870719 988633185 /nfs/dbraw/zinc/63/31/85/988633185.db2.gz ZHROHIUXLPRHGH-HTVCTNPSSA-N 2 0 234.387 2.105 20 0 BEADRP CC(C)CCC[C@@H](C)[N@@H+]1C[C@@H](C)[C@@H]([NH3+])C1 ZINC001246877353 988644967 /nfs/dbraw/zinc/64/49/67/988644967.db2.gz CLHOWJJINWMKNQ-UPJWGTAASA-N 2 0 212.381 2.480 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+]CCc2ccncc2)CC1(C)C ZINC001118856470 988654449 /nfs/dbraw/zinc/65/44/49/988654449.db2.gz XHPOPQOIXNODNA-CQSZACIVSA-N 2 0 247.386 2.087 20 0 BEADRP C[C@@H]1C[C@@H]([NH+]2C[C@@H]3CCCC[C@H]3C2)CC[NH2+]1 ZINC001246894386 988665452 /nfs/dbraw/zinc/66/54/52/988665452.db2.gz NMNXCDDLJRNACS-RFGFWPKPSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@H]1CC[C@@H]([NH+]2C[C@@H]3CCCC[C@H]3C2)C[NH2+]1 ZINC001246896146 988668099 /nfs/dbraw/zinc/66/80/99/988668099.db2.gz TUNRRUSMSJINLX-XDQVBPFNSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@@H]1C[N@H+]([C@H]2CC[NH2+][C@@H](C)C2)C2(CC2)C1 ZINC001246895957 988670271 /nfs/dbraw/zinc/67/02/71/988670271.db2.gz RKWFQJWLQWPNCK-SRVKXCTJSA-N 2 0 208.349 2.001 20 0 BEADRP NC[C@H]1CCC[N@@H+]1[C@@H]1CCc2cc(F)ccc2C1 ZINC001246907669 988690434 /nfs/dbraw/zinc/69/04/34/988690434.db2.gz HFPXDZHPJFQWAY-HUUCEWRRSA-N 2 0 248.345 2.106 20 0 BEADRP CC1(C)[C@@H]2C[C@H]([N@H+]3C[C@@H]4CC[NH2+]CC[C@@H]4C3)C[C@@H]21 ZINC001246931028 988761563 /nfs/dbraw/zinc/76/15/63/988761563.db2.gz MMZMMYVFDCFOMQ-SBAKFKMJSA-N 2 0 248.414 2.352 20 0 BEADRP C[C@H](CC1CC1)[N@H+]1C[C@@H]2CC[NH2+]CC[C@@H]2C1 ZINC001246930505 988763367 /nfs/dbraw/zinc/76/33/67/988763367.db2.gz JSQIQHIYWSYDFS-BNOWGMLFSA-N 2 0 222.376 2.106 20 0 BEADRP CC[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)C(C)(C)OC)C1 ZINC001324240027 988766735 /nfs/dbraw/zinc/76/67/35/988766735.db2.gz QDNZPDFRQUSFLU-OLZOCXBDSA-N 2 0 242.407 2.121 20 0 BEADRP CCC(CC)[N@H+]1C[C@@H]2CC[NH2+]CC[C@@H]2C1 ZINC001246936796 988768252 /nfs/dbraw/zinc/76/82/52/988768252.db2.gz XQTXPUFMAJXRAM-TXEJJXNPSA-N 2 0 210.365 2.106 20 0 BEADRP CCCC(CCC)[N@H+](C)[C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001246947232 988778830 /nfs/dbraw/zinc/77/88/30/988778830.db2.gz KANSRRQPPQMSLH-ITGUQSILSA-N 2 0 210.365 2.105 20 0 BEADRP C(=C/C1CC1)\C[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC001324300422 988790068 /nfs/dbraw/zinc/79/00/68/988790068.db2.gz VNEVRXWTGVCMND-OWOJBTEDSA-N 2 0 234.387 2.417 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCCC(F)F)CN1C1CC1 ZINC001119540980 989147223 /nfs/dbraw/zinc/14/72/23/989147223.db2.gz MTPLWZAGARGVQU-NXEZZACHSA-N 2 0 232.318 2.247 20 0 BEADRP CC(C)([NH3+])CNCc1ccccc1N1CCCC1 ZINC001325610800 989208480 /nfs/dbraw/zinc/20/84/80/989208480.db2.gz OMWQWIJZWHBYQO-UHFFFAOYSA-N 2 0 247.386 2.114 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]CC(C)(C)c1ccccc1 ZINC001325625444 989221596 /nfs/dbraw/zinc/22/15/96/989221596.db2.gz KSHMUCBXRJPKNB-CYBMUJFWSA-N 2 0 234.387 2.409 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H]1CCC[C@H](C)[C@@H]1C ZINC001325741762 989243457 /nfs/dbraw/zinc/24/34/57/989243457.db2.gz MLHCKWDZUWVDSP-QNWHQSFQSA-N 2 0 212.381 2.399 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H]1CCCc2ccccc2C1 ZINC001326034823 989334404 /nfs/dbraw/zinc/33/44/04/989334404.db2.gz AIMNAAMOEXXBSL-BBRMVZONSA-N 2 0 246.398 2.379 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H](C)c1ccsc1 ZINC001326036642 989335921 /nfs/dbraw/zinc/33/59/21/989335921.db2.gz SCEGVVGEDFYBBS-NXEZZACHSA-N 2 0 212.362 2.397 20 0 BEADRP Cc1ccccc1NC(=[NH2+])NC[C@@H](C)C[NH+](C)C ZINC001326949519 989780666 /nfs/dbraw/zinc/78/06/66/989780666.db2.gz SNBLEHHKPVIHQN-LLVKDONJSA-N 2 0 248.374 2.129 20 0 BEADRP CC(C)=CCC[C@H](C)[NH2+]CCC[N@H+](C)CCO ZINC001258086753 990996111 /nfs/dbraw/zinc/99/61/11/990996111.db2.gz DCVSBAQWBTXQLX-AWEZNQCLSA-N 2 0 242.407 2.025 20 0 BEADRP C[C@H](Cc1ccco1)[NH2+]Cc1ccccc1C[NH3+] ZINC001258178949 991079623 /nfs/dbraw/zinc/07/96/23/991079623.db2.gz NDIVNBDFXSRBAA-GFCCVEGCSA-N 2 0 244.338 2.459 20 0 BEADRP C[C@H](Cc1ccco1)[N@@H+]1C[C@H]2CCCN(C)[C@H]2C1 ZINC001258196921 991111176 /nfs/dbraw/zinc/11/11/76/991111176.db2.gz BNTLSOYACQAMAQ-NFAWXSAZSA-N 2 0 248.370 2.237 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)[C@@H](C)Cc1ccco1 ZINC001258198798 991114777 /nfs/dbraw/zinc/11/47/77/991114777.db2.gz JRXDMZQHZKUOHR-ZDUSSCGKSA-N 2 0 238.375 2.484 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)[C@H](C)Cc1ccco1 ZINC001258198797 991117213 /nfs/dbraw/zinc/11/72/13/991117213.db2.gz JRXDMZQHZKUOHR-CYBMUJFWSA-N 2 0 238.375 2.484 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@@H](C)CCSC)CC1 ZINC001258202575 991118568 /nfs/dbraw/zinc/11/85/68/991118568.db2.gz ORCVMSMQKLVUPV-LBPRGKRZSA-N 2 0 244.448 2.450 20 0 BEADRP CSCC[C@@H](C)[N@@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC001258226764 991162713 /nfs/dbraw/zinc/16/27/13/991162713.db2.gz RHHBGBGAQLLMOE-OLZOCXBDSA-N 2 0 242.432 2.156 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@H]([NH2+]C3CC4(CCC4)C3)[C@@H]2C1 ZINC001308983731 991251555 /nfs/dbraw/zinc/25/15/55/991251555.db2.gz AVYILQVSOFLQMX-YUTCNCBUSA-N 2 0 234.387 2.249 20 0 BEADRP C[C@H](CC1CC1)[NH2+]CC12CC[NH+](CC1)CC2 ZINC001258450281 991400617 /nfs/dbraw/zinc/40/06/17/991400617.db2.gz BPKYEFODXYHTDW-GFCCVEGCSA-N 2 0 222.376 2.251 20 0 BEADRP COCCC1([NH3+])CC[NH+]([C@H](C)CC2CC2)CC1 ZINC001258452936 991404111 /nfs/dbraw/zinc/40/41/11/991404111.db2.gz DZVSVISNKJUKJK-GFCCVEGCSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[C@H]2C[N@H+](C)C[C@H]21 ZINC001560622565 991525789 /nfs/dbraw/zinc/52/57/89/991525789.db2.gz KSRMRUOLXDYHLW-XHJNMGKDSA-N 2 0 222.376 2.105 20 0 BEADRP CC(C)[N@H+](CCC[NH3+])[C@@H](C)Cc1cccnc1 ZINC001258613071 991536685 /nfs/dbraw/zinc/53/66/85/991536685.db2.gz LBDSTIKMJYAKFR-ZDUSSCGKSA-N 2 0 235.375 2.072 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[N@H+](C)C[C@H]12)C1CCC1 ZINC001561053066 991707423 /nfs/dbraw/zinc/70/74/23/991707423.db2.gz RYVQAQGYUXEUHI-AHLTXXRQSA-N 2 0 222.376 2.105 20 0 BEADRP CCC[NH+]1CCC([NH2+]C[C@@H]2CC(C)(C)O2)CC1 ZINC001258766541 991726993 /nfs/dbraw/zinc/72/69/93/991726993.db2.gz XRQGFOAXSLNADF-ZDUSSCGKSA-N 2 0 240.391 2.018 20 0 BEADRP CC[C@@H](C)C[C@@H](CC)[NH2+]CCSCC[NH3+] ZINC001258783088 991753679 /nfs/dbraw/zinc/75/36/79/991753679.db2.gz AYIRLYOKZWHXIA-VXGBXAGGSA-N 2 0 232.437 2.483 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1ncco1 ZINC001258897653 991893012 /nfs/dbraw/zinc/89/30/12/991893012.db2.gz NARHLQRAPFUCOS-GFCCVEGCSA-N 2 0 239.363 2.275 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[N@H+](C)C[C@H](C)C[NH3+] ZINC001258902845 991894918 /nfs/dbraw/zinc/89/49/18/991894918.db2.gz HEMQRVDPJUXSNB-ZIAGYGMSSA-N 2 0 243.439 2.024 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+](C)CC ZINC001258907006 991896579 /nfs/dbraw/zinc/89/65/79/991896579.db2.gz CQHZEIXXUFSSML-GFCCVEGCSA-N 2 0 200.370 2.449 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[N@H+](C)C[C@@H](C)C[NH3+] ZINC001258902844 991896832 /nfs/dbraw/zinc/89/68/32/991896832.db2.gz HEMQRVDPJUXSNB-UONOGXRCSA-N 2 0 243.439 2.024 20 0 BEADRP CC[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)c2ccncc2)C1 ZINC001319691780 991942944 /nfs/dbraw/zinc/94/29/44/991942944.db2.gz VCKDOFBSUNGTAP-KGLIPLIRSA-N 2 0 247.386 2.464 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]C1CCC(C(F)F)CC1 ZINC001261423932 992297038 /nfs/dbraw/zinc/29/70/38/992297038.db2.gz JAKYCEOLHQMFTF-KPPDAEKUSA-N 2 0 234.334 2.398 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]CCCOCc1ccccc1 ZINC001261423439 992297679 /nfs/dbraw/zinc/29/76/79/992297679.db2.gz WFVPEWXVPGLZTO-HUUCEWRRSA-N 2 0 248.370 2.063 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@H](C)c1cccs1 ZINC001261423761 992298771 /nfs/dbraw/zinc/29/87/71/992298771.db2.gz DAHIXXYBOXLDNM-VHSXEESVSA-N 2 0 212.362 2.397 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@H]([NH2+][C@@H]3CC[C@H]3C3CC3)[C@H]2C1 ZINC001474756470 992512966 /nfs/dbraw/zinc/51/29/66/992512966.db2.gz GSWPMXFINWBMHY-LXFSFDBISA-N 2 0 234.387 2.105 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001262161025 992720505 /nfs/dbraw/zinc/72/05/05/992720505.db2.gz WDFBESDSYNUYIU-KGLIPLIRSA-N 2 0 236.403 2.498 20 0 BEADRP C[C@H]1CC[N@H+](CC2CC[NH+](C)CC2)C[C@H]1F ZINC001262365147 992860923 /nfs/dbraw/zinc/86/09/23/992860923.db2.gz SWWBETSVDJVKFP-WCQYABFASA-N 2 0 228.355 2.008 20 0 BEADRP C(C[C@H]1CC[NH2+]C1)[NH2+][C@@H]1C[C@@H]2CC[C@@H](C2)C1 ZINC001574774297 992899250 /nfs/dbraw/zinc/89/92/50/992899250.db2.gz KUFUGIUCDKMFFD-YIYPIFLZSA-N 2 0 222.376 2.154 20 0 BEADRP C([NH2+]CC1(CC2CC2)CC1)C1CC[NH2+]CC1 ZINC001574775032 992902149 /nfs/dbraw/zinc/90/21/49/992902149.db2.gz VETYWBFHDQRPFY-UHFFFAOYSA-N 2 0 222.376 2.156 20 0 BEADRP C1=C(CC[NH2+]CC2C[NH2+]C2)CCCCC1 ZINC001574774285 992904119 /nfs/dbraw/zinc/90/41/19/992904119.db2.gz KUDFTYHKVSHYRM-UHFFFAOYSA-N 2 0 208.349 2.076 20 0 BEADRP C([NH2+][C@H]1C[C@@H]2CC[C@@H](C2)C1)[C@H]1CCC[NH2+]C1 ZINC001574799938 992914660 /nfs/dbraw/zinc/91/46/60/992914660.db2.gz FZSGPRZIPBOJIV-RFQIPJPRSA-N 2 0 222.376 2.154 20 0 BEADRP CC(C)(C)O[C@H]1C[C@H]([NH2+][C@H]2CCC[C@@H]([NH3+])C2)C1 ZINC001575254129 993001358 /nfs/dbraw/zinc/00/13/58/993001358.db2.gz YSOWSHOVAXULDE-YVECIDJPSA-N 2 0 240.391 2.192 20 0 BEADRP CC(C)(C[NH2+][C@@H]1C[C@@H]([NH3+])C1(C)C)CC(F)F ZINC001575334776 993014416 /nfs/dbraw/zinc/01/44/16/993014416.db2.gz SNIGQLWAUPGMDW-RKDXNWHRSA-N 2 0 234.334 2.383 20 0 BEADRP CC(C)[C@@H](C[NH3+])C[NH2+]Cc1cccc2cc[nH]c21 ZINC001575421948 993039780 /nfs/dbraw/zinc/03/97/80/993039780.db2.gz DEGSNBGDGALAEI-AWEZNQCLSA-N 2 0 245.370 2.488 20 0 BEADRP CC(C)[C@@H]1C[C@H]1C[NH2+]C1CC2(C1)CC[NH2+]CC2 ZINC001575828695 993110675 /nfs/dbraw/zinc/11/06/75/993110675.db2.gz QGOFZDBOQXIEPJ-JSGCOSHPSA-N 2 0 236.403 2.400 20 0 BEADRP C[C@@H](CCc1ccsc1)[NH2+][C@H]1C[C@@H]([NH3+])C1 ZINC001575971147 993146025 /nfs/dbraw/zinc/14/60/25/993146025.db2.gz CLVGHHBDSPRDIW-ZMLRMANQSA-N 2 0 224.373 2.149 20 0 BEADRP C[C@H](CCc1ccsc1)[NH2+][C@H]1C[C@@H]([NH3+])C1 ZINC001575971146 993146613 /nfs/dbraw/zinc/14/66/13/993146613.db2.gz CLVGHHBDSPRDIW-JLLWLGSASA-N 2 0 224.373 2.149 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+]C/C=C/c1cccc(F)c1 ZINC001575987489 993150778 /nfs/dbraw/zinc/15/07/78/993150778.db2.gz HVBLPFQIEFKTEK-TZNOJPMFSA-N 2 0 222.307 2.023 20 0 BEADRP C[C@H]([NH2+][C@H]1C[C@H]([NH3+])C1(C)C)C1CCSCC1 ZINC001576234857 993227269 /nfs/dbraw/zinc/22/72/69/993227269.db2.gz ATOZAKASHFUDKE-DLOVCJGASA-N 2 0 242.432 2.234 20 0 BEADRP CC1(C)[C@@H]([NH3+])C[C@@H]1[NH2+]CC12CCC(CC1)C2 ZINC001576381708 993290102 /nfs/dbraw/zinc/29/01/02/993290102.db2.gz DUXBGGQWKYGNAQ-ATJQQHLPSA-N 2 0 222.376 2.282 20 0 BEADRP CC1(C)CCC[C@H](C[NH+]2CC3(C2)CC[NH2+]C3)C1 ZINC001576426470 993303118 /nfs/dbraw/zinc/30/31/18/993303118.db2.gz IOKKTYXEVTZJSW-ZDUSSCGKSA-N 2 0 236.403 2.498 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+]CC1CC2(CCC2)C1 ZINC001576487275 993319843 /nfs/dbraw/zinc/31/98/43/993319843.db2.gz HTBPXIFBFWRIQG-GFCCVEGCSA-N 2 0 222.376 2.297 20 0 BEADRP CC1(C[NH2+]C[C@@H]2CCC[NH2+]CC2)CCC1 ZINC001576518587 993328404 /nfs/dbraw/zinc/32/84/04/993328404.db2.gz AXSIPEKLQRTLOM-GFCCVEGCSA-N 2 0 210.365 2.156 20 0 BEADRP CC1(C)CCC[C@@H]1C[NH2+]C[C@@]1(C)CC[NH2+]C1 ZINC001576519865 993330250 /nfs/dbraw/zinc/33/02/50/993330250.db2.gz VAYNCVVHGCEKOS-OCCSQVGLSA-N 2 0 224.392 2.402 20 0 BEADRP C[C@@]1(C[NH2+]C2CC3(CC([NH3+])C3)C2)CCCS1 ZINC001576519246 993330713 /nfs/dbraw/zinc/33/07/13/993330713.db2.gz LGVFFCJFJVAWQR-ARAJFMJPSA-N 2 0 240.416 2.132 20 0 BEADRP CC1CC(C[NH2+]C[C@@]2(C)CCC[NH2+]C2)C1 ZINC001576597129 993361407 /nfs/dbraw/zinc/36/14/07/993361407.db2.gz CIMZWCFGEZCVGA-BPCQOVAHSA-N 2 0 210.365 2.012 20 0 BEADRP C[C@@H]1C[C@H](CNc2ccc3c([nH+]2)CCC3)CC[NH2+]1 ZINC001576596875 993361882 /nfs/dbraw/zinc/36/18/82/993361882.db2.gz BGWDTVGELCENPS-VXGBXAGGSA-N 2 0 245.370 2.370 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+][C@H]2C[C@H](C[NH3+])C2)CC1 ZINC001576680549 993391393 /nfs/dbraw/zinc/39/13/93/993391393.db2.gz OYXLVMOIDZZAOZ-FDYHWXHSSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]1CCC[C@@H]([NH2+][C@H]2C[C@H]3CC[C@@H]2[NH2+]3)C1 ZINC001576680893 993392982 /nfs/dbraw/zinc/39/29/82/993392982.db2.gz VUOXQZRVHZKHQU-QWQWKMKNSA-N 2 0 208.349 2.048 20 0 BEADRP C[C@H]1C[N@H+](CCSC(C)(C)C)CC[C@@H]1C[NH3+] ZINC001576807268 993427210 /nfs/dbraw/zinc/42/72/10/993427210.db2.gz OZUNNOSCAGXQDD-NWDGAFQWSA-N 2 0 244.448 2.435 20 0 BEADRP CC[C@H](C)[C@H](C[N@@H+]1CC[C@H]([NH3+])[C@@H](CC)C1)OC ZINC001576961229 993469593 /nfs/dbraw/zinc/46/95/93/993469593.db2.gz LZTCBGMRFQORMR-XUXIUFHCSA-N 2 0 242.407 2.107 20 0 BEADRP CCC(CC)C[NH2+]C1CC2(CC([NH3+])C2)C1 ZINC001577069693 993493192 /nfs/dbraw/zinc/49/31/92/993493192.db2.gz QZDPETLUQBMQCY-UHFFFAOYSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+]C[C@H]1CCCC[N@H+](Cc2ccc(F)cc2)C1 ZINC000383512962 993497491 /nfs/dbraw/zinc/49/74/91/993497491.db2.gz LQVLLGXBYDHQLO-CYBMUJFWSA-N 2 0 236.334 2.387 20 0 BEADRP CCC[N@H+](CC(C)C)C[C@@H](O)C[NH+](CC)CC ZINC000383645808 993506408 /nfs/dbraw/zinc/50/64/08/993506408.db2.gz HYRVBGAAXMWJQU-AWEZNQCLSA-N 2 0 244.423 2.057 20 0 BEADRP CCC1(CC)CCC[N@H+](CC2C[NH2+]C2)CC1 ZINC001577212194 993543843 /nfs/dbraw/zinc/54/38/43/993543843.db2.gz CONUIBHFLDCWOI-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP CC[C@@H]1CCCC[C@H]1C[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001577255361 993566038 /nfs/dbraw/zinc/56/60/38/993566038.db2.gz UXCOCAYRDVZLML-BJJPWKGXSA-N 2 0 222.376 2.010 20 0 BEADRP C[C@@H]1[NH2+]CCC[C@H]1C[NH2+]C1CCCCC1 ZINC000384288075 993566661 /nfs/dbraw/zinc/56/66/61/993566661.db2.gz VQOBTCLTPZRQQI-RYUDHWBXSA-N 2 0 210.365 2.297 20 0 BEADRP CCC[C@H](C)CC[NH2+]C[C@@]12C[C@@H]1C[NH2+]C2 ZINC001577340704 993603820 /nfs/dbraw/zinc/60/38/20/993603820.db2.gz HYSVGMJGGCSPOW-YNEHKIRRSA-N 2 0 210.365 2.012 20 0 BEADRP CCC[C@H](C)[NH+]1CCC([C@@H]2CC[NH2+]C2)CC1 ZINC001577345399 993609031 /nfs/dbraw/zinc/60/90/31/993609031.db2.gz QPXSRMHKEFBERV-GXTWGEPZSA-N 2 0 224.392 2.497 20 0 BEADRP CCC[C@@H]1CCCC[C@@H]1[NH2+]C[C@H]([NH3+])CCOC ZINC001577377179 993633448 /nfs/dbraw/zinc/63/34/48/993633448.db2.gz IBCZWXSPJRLRQH-MCIONIFRSA-N 2 0 242.407 2.299 20 0 BEADRP CCCSC[C@@H](C)[NH2+][C@@H]1CCCC[C@H]1[NH3+] ZINC001577597359 993689777 /nfs/dbraw/zinc/68/97/77/993689777.db2.gz YZNRSBYGDRVKAB-IJLUTSLNSA-N 2 0 230.421 2.378 20 0 BEADRP CC1CCC([N@@H+]2CCC[C@H]([NH3+])CC2)CC1 ZINC000393196287 993910083 /nfs/dbraw/zinc/91/00/83/993910083.db2.gz AHVWCICJQCWFPY-CPCZMJQVSA-N 2 0 210.365 2.378 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CCC2CCCC2)CC[NH2+]1 ZINC000821987588 994414922 /nfs/dbraw/zinc/41/49/22/994414922.db2.gz FKPLGBWADRRZNP-AAEUAGOBSA-N 2 0 210.365 2.297 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2CC[C@@H](SC)C2)CC1 ZINC001621360139 1170119677 /nfs/dbraw/zinc/11/96/77/1170119677.db2.gz WODFPGMAGFJTLE-CYBMUJFWSA-N 2 0 242.432 2.156 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]C[C@H]1CCCO1 ZINC000020049033 1170142291 /nfs/dbraw/zinc/14/22/91/1170142291.db2.gz OOVJGHUDCNPUTI-ZIAGYGMSSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@H](CCC1CC1)[NH2+][C@@H]1CC[C@@H]2C[N@H+](C)C[C@H]12 ZINC001621570550 1170163921 /nfs/dbraw/zinc/16/39/21/1170163921.db2.gz XACUCJSLKICMMB-REBRKWNGSA-N 2 0 236.403 2.495 20 0 BEADRP C[NH+](C)CCCOc1ccc(C[NH+](C)C)cc1 ZINC000028570593 1170241234 /nfs/dbraw/zinc/24/12/34/1170241234.db2.gz BPXZGIUFHOBASJ-UHFFFAOYSA-N 2 0 236.359 2.079 20 0 BEADRP CCOCC[NH2+][C@@H](C)CCC[NH+](CC)CC ZINC000035098240 1170643207 /nfs/dbraw/zinc/64/32/07/1170643207.db2.gz KENYAMNKVGKYEA-ZDUSSCGKSA-N 2 0 230.396 2.123 20 0 BEADRP Cc1nc([C@@H](C)[NH2+]CCCC[NH3+])c(C)s1 ZINC000037715234 1170964703 /nfs/dbraw/zinc/96/47/03/1170964703.db2.gz DZOZOBPXZZTZCC-MRVPVSSYSA-N 2 0 227.377 2.149 20 0 BEADRP CCC[N@H+](CC1CC1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000040747570 1171153205 /nfs/dbraw/zinc/15/32/05/1171153205.db2.gz YJUBNOJCRCLFBI-PBWFPOADSA-N 2 0 222.376 2.391 20 0 BEADRP CCC1CCC(N2CC[C@@H]([NH2+]C)C2)CC1 ZINC000042580721 1171240451 /nfs/dbraw/zinc/24/04/51/1171240451.db2.gz OYTPGYJHPWZCFO-OTTFEQOBSA-N 2 0 210.365 2.249 20 0 BEADRP COc1ccc(CC[C@@H](C)N2CC[C@H]([NH3+])C2)cc1 ZINC000050228047 1171776747 /nfs/dbraw/zinc/77/67/47/1171776747.db2.gz PXWRKOAPKOUWHX-OCCSQVGLSA-N 2 0 248.370 2.049 20 0 BEADRP CC[C@@H]1CO[C@H](C)C[N@@H+]1CC(CC)(CC)C[NH3+] ZINC000051257652 1171889306 /nfs/dbraw/zinc/88/93/06/1171889306.db2.gz SJPFQSAYWLHHBV-CHWSQXEVSA-N 2 0 242.407 2.251 20 0 BEADRP Cc1ccc(C[NH2+]Cc2ccc(C[NH3+])cc2)cn1 ZINC000516970322 398136641 /nfs/dbraw/zinc/13/66/41/398136641.db2.gz IHBNZMISHLNTFX-UHFFFAOYSA-N 2 0 241.338 2.139 20 0 BEADRP C1=C(CC[N@H+]2C[C@H]3C[NH2+]C[C@H]3C2)CCCC1 ZINC000385161153 398137391 /nfs/dbraw/zinc/13/73/91/398137391.db2.gz LGXHNRLEPRCWSA-OKILXGFUSA-N 2 0 220.360 2.028 20 0 BEADRP CO[C@H](C[N@@H+]1C[C@H](C[NH3+])C[C@H]1C)c1ccccc1 ZINC000379241322 398140990 /nfs/dbraw/zinc/14/09/90/398140990.db2.gz WZKTUCDRJVNGKP-VNHYZAJKSA-N 2 0 248.370 2.043 20 0 BEADRP C[N@H+](CC1CC1)C[C@H]1CC[NH+](CCC2CC2)C1 ZINC000336706977 187321453 /nfs/dbraw/zinc/32/14/53/187321453.db2.gz LDBWWMUMSVXPBI-OAHLLOKOSA-N 2 0 236.403 2.450 20 0 BEADRP CC(C)OC[C@@H](C)[NH2+]C1CCC([NH+](C)C)CC1 ZINC000421377353 192322709 /nfs/dbraw/zinc/32/27/09/192322709.db2.gz RIJAGJYVRMMRNO-IYXRBSQSSA-N 2 0 242.407 2.262 20 0 BEADRP C([NH2+][C@H]1CCC12CCC2)[C@H]1CC[N@@H+](C2CC2)C1 ZINC000337399692 187324435 /nfs/dbraw/zinc/32/44/35/187324435.db2.gz PEZLIFTZOIISPA-OCCSQVGLSA-N 2 0 234.387 2.393 20 0 BEADRP C[NH+](C)CCC[NH2+]C1CCC(F)(F)CC1 ZINC000389954250 398151941 /nfs/dbraw/zinc/15/19/41/398151941.db2.gz OCJLPVNROASTMG-UHFFFAOYSA-N 2 0 220.307 2.106 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CCOC1CCCCC1 ZINC000422941832 398159631 /nfs/dbraw/zinc/15/96/31/398159631.db2.gz IPSZMPDKWDSSGN-RYUDHWBXSA-N 2 0 228.380 2.051 20 0 BEADRP Cc1cc(C[NH2+]C2CCC([NH3+])CC2)ccc1F ZINC000051694482 178018941 /nfs/dbraw/zinc/01/89/41/178018941.db2.gz MNXDHXFLRKOFNY-UHFFFAOYSA-N 2 0 236.334 2.494 20 0 BEADRP C[C@@H]1SCC[N@H+](CC[C@H]2CCC[NH+]2C)[C@H]1C ZINC000245605397 398167756 /nfs/dbraw/zinc/16/77/56/398167756.db2.gz JYMAPSHBYWEFBV-RWMBFGLXSA-N 2 0 242.432 2.297 20 0 BEADRP C[C@@H](C[NH+]1CCC(C[NH3+])CC1)C(C)(C)C ZINC000379824628 398169739 /nfs/dbraw/zinc/16/97/39/398169739.db2.gz VKSHUNPCALKLOJ-NSHDSACASA-N 2 0 212.381 2.339 20 0 BEADRP CC[N@H+](CCC[NH+]1CCCC1)CC1CC1 ZINC000161841116 349511763 /nfs/dbraw/zinc/51/17/63/349511763.db2.gz WUUPPLBDEWJLJE-UHFFFAOYSA-N 2 0 210.365 2.204 20 0 BEADRP C[N@@H+]1CCC[C@@H]1CC[NH+]1CC[C@]2(CC2(F)F)C1 ZINC000649907375 398180942 /nfs/dbraw/zinc/18/09/42/398180942.db2.gz PZEXGHWIESUXNB-NEPJUHHUSA-N 2 0 244.329 2.202 20 0 BEADRP CC(C)c1nc(CC[NH2+]CC(C)(C)[NH3+])cs1 ZINC000415096632 398161808 /nfs/dbraw/zinc/16/18/08/398161808.db2.gz BUURUQQMQYMLLM-UHFFFAOYSA-N 2 0 241.404 2.136 20 0 BEADRP Cc1cc(F)ccc1C[N@@H+]1CC[C@@](C)(C[NH3+])C1 ZINC000235751278 178085806 /nfs/dbraw/zinc/08/58/06/178085806.db2.gz BLBFMOZWGLXXAN-AWEZNQCLSA-N 2 0 236.334 2.305 20 0 BEADRP Cc1cc(N2CCC[N@@H+]3CCC[C@H]3C2)cc[nH+]1 ZINC000372227313 178114208 /nfs/dbraw/zinc/11/42/08/178114208.db2.gz LDXCLKONZWMLDQ-AWEZNQCLSA-N 2 0 231.343 2.065 20 0 BEADRP CC1(CC[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)CC1 ZINC000647796803 398201582 /nfs/dbraw/zinc/20/15/82/398201582.db2.gz ODABGRMLPOXSJM-RWMBFGLXSA-N 2 0 222.376 2.154 20 0 BEADRP CC1(CC[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)CC1 ZINC000647796804 398201702 /nfs/dbraw/zinc/20/17/02/398201702.db2.gz ODABGRMLPOXSJM-YNEHKIRRSA-N 2 0 222.376 2.154 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]Cc2cccc3c2CC[NH2+]C3)[C@@H]1C ZINC000386302703 398205025 /nfs/dbraw/zinc/20/50/25/398205025.db2.gz VRPBRQCVSJMVGW-XHBSWPGZSA-N 2 0 244.382 2.466 20 0 BEADRP CO[C@H]1CCC[C@H]([NH2+]CC2([NH3+])CCCCC2)C1 ZINC000643496603 398205674 /nfs/dbraw/zinc/20/56/74/398205674.db2.gz CQYMDWSRZVMBPE-STQMWFEESA-N 2 0 240.391 2.195 20 0 BEADRP Cc1nc(C[N@@H+]2CCC[C@H](CC[NH3+])C2)cs1 ZINC000069723919 398213897 /nfs/dbraw/zinc/21/38/97/398213897.db2.gz DRCJDQDVSNCCAZ-LLVKDONJSA-N 2 0 239.388 2.012 20 0 BEADRP Cc1cccnc1[C@H]([NH2+]C[C@@H]1CC[NH2+]C1)C(C)C ZINC000649414610 398218628 /nfs/dbraw/zinc/21/86/28/398218628.db2.gz LNGFWJZYWDATRF-ZIAGYGMSSA-N 2 0 247.386 2.286 20 0 BEADRP C(CC[NH2+]C1CCOCC1)CC[NH+]1CCCC1 ZINC000339498268 187329085 /nfs/dbraw/zinc/32/90/85/187329085.db2.gz JRHOIDHLFIRFEZ-UHFFFAOYSA-N 2 0 240.391 2.021 20 0 BEADRP Cc1cc(NC[C@@H]2CCC[N@@H+](C)C2)cc[nH+]1 ZINC000229565547 178167694 /nfs/dbraw/zinc/16/76/94/178167694.db2.gz VEZVFCZTPXXDEP-LBPRGKRZSA-N 2 0 219.332 2.144 20 0 BEADRP Cc1cc(NC[C@H](C2CC2)[NH+](C)C)cc[nH+]1 ZINC000302564825 178168346 /nfs/dbraw/zinc/16/83/46/178168346.db2.gz MTLIVTCXKGNYOD-CYBMUJFWSA-N 2 0 219.332 2.142 20 0 BEADRP Cc1cc(N[C@@H]2C[C@H](C)[N@@H+](C3CC3)C2)cc[nH+]1 ZINC000290737956 178184914 /nfs/dbraw/zinc/18/49/14/178184914.db2.gz GUKZSDXCUSNMJS-WCQYABFASA-N 2 0 231.343 2.427 20 0 BEADRP C[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)[C@H]1C[C@H]1C ZINC000421371311 192335943 /nfs/dbraw/zinc/33/59/43/192335943.db2.gz JNJKBVYFKYMULF-AYZDXNEBSA-N 2 0 224.392 2.493 20 0 BEADRP C[C@@H]1C[C@@H]([N@H+](C)C2CCCCC2)CC[NH2+]1 ZINC000229539148 538939649 /nfs/dbraw/zinc/93/96/49/538939649.db2.gz PZHBMFMTNTYDNX-YPMHNXCESA-N 2 0 210.365 2.391 20 0 BEADRP CCC(CC)C[NH2+]C[C@@H](C)C[NH+](C)C ZINC000308590180 168362332 /nfs/dbraw/zinc/36/23/32/168362332.db2.gz UVUKFPXSZYNRPP-LLVKDONJSA-N 2 0 200.370 2.210 20 0 BEADRP CCOc1cccc(C[N@@H+]2CC[C@H]([C@H](C)[NH3+])C2)c1 ZINC000252793813 136226848 /nfs/dbraw/zinc/22/68/48/136226848.db2.gz XULNXZAYXDGLLO-JSGCOSHPSA-N 2 0 248.370 2.254 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]C[C@H]2COc3ccccc32)C1 ZINC000576718176 365668441 /nfs/dbraw/zinc/66/84/41/365668441.db2.gz UXVVGVKTTRTFHU-XQQFMLRXSA-N 2 0 246.354 2.022 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]C[C@@H]2COc3ccccc32)C1 ZINC000576718175 365669140 /nfs/dbraw/zinc/66/91/40/365669140.db2.gz UXVVGVKTTRTFHU-UPJWGTAASA-N 2 0 246.354 2.022 20 0 BEADRP CC[C@H]1C[N@H+](CC[C@@H]2CCC[NH+]2C)CCS1 ZINC000162099357 349564277 /nfs/dbraw/zinc/56/42/77/349564277.db2.gz WGUJUCNFUCPKTN-STQMWFEESA-N 2 0 242.432 2.298 20 0 BEADRP C[C@H](C[N@@H+]1CC[C@@H]2[NH2+]CC[C@@H]2C1)C(C)(C)C ZINC000381595578 398265096 /nfs/dbraw/zinc/26/50/96/398265096.db2.gz JRISTSNIMWOORZ-UPJWGTAASA-N 2 0 224.392 2.352 20 0 BEADRP C[C@H]([NH2+]CCc1ccco1)C1CC[NH+](C)CC1 ZINC000035661423 538957613 /nfs/dbraw/zinc/95/76/13/538957613.db2.gz FRYDDAYMADZIGH-LBPRGKRZSA-N 2 0 236.359 2.142 20 0 BEADRP CC(C)CCC[NH2+][C@@H](C)CC[NH+](C)C ZINC000165219758 361836853 /nfs/dbraw/zinc/83/68/53/361836853.db2.gz NBAFDGFQFZMGQW-LBPRGKRZSA-N 2 0 200.370 2.352 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@@H](C)C1(C)CC1 ZINC000166566781 361852706 /nfs/dbraw/zinc/85/27/06/361852706.db2.gz PKOXRBIBFBADMN-LBPRGKRZSA-N 2 0 212.381 2.495 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@H](C)C1(C)CC1 ZINC000166566897 361852871 /nfs/dbraw/zinc/85/28/71/361852871.db2.gz PKOXRBIBFBADMN-GFCCVEGCSA-N 2 0 212.381 2.495 20 0 BEADRP CSC1(C[NH2+]C[C@@H]2CCCC[N@H+](C)C2)CC1 ZINC000600191492 342697986 /nfs/dbraw/zinc/69/79/86/342697986.db2.gz PJULDOZPVUFNLO-LBPRGKRZSA-N 2 0 242.432 2.204 20 0 BEADRP C[C@@H]([NH2+]C(C1CC1)C1CC1)C1CC[NH+](C)CC1 ZINC000037220970 538961860 /nfs/dbraw/zinc/96/18/60/538961860.db2.gz YCEYGYZQMKJGHX-LLVKDONJSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@@H]([NH2+]C1CCCC1)C1CC[NH+](C)CC1 ZINC000037208721 538962080 /nfs/dbraw/zinc/96/20/80/538962080.db2.gz LXVIQRISZYGMIB-LLVKDONJSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@H]([NH3+])[C@H]1CCC[N@H+](C[C@@H]2CCC(F)(F)C2)C1 ZINC000382309835 361895473 /nfs/dbraw/zinc/89/54/73/361895473.db2.gz ICPILYPPTRBBKM-TUAOUCFPSA-N 2 0 246.345 2.481 20 0 BEADRP Fc1ccc2c(c1)CN(C[C@H]1CCC[NH2+]C1)CC2 ZINC000335338224 398285292 /nfs/dbraw/zinc/28/52/92/398285292.db2.gz HKDJGRDSGXJRBX-LBPRGKRZSA-N 2 0 248.345 2.183 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]C1CSC1 ZINC000380335941 538989353 /nfs/dbraw/zinc/98/93/53/538989353.db2.gz PYMWUFNUZMUAPE-LLVKDONJSA-N 2 0 230.421 2.202 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC(F)(F)C1)C1CC[NH+](C)CC1 ZINC000379918904 538981646 /nfs/dbraw/zinc/98/16/46/538981646.db2.gz PPYAFLGEUZIOAH-JQWIXIFHSA-N 2 0 246.345 2.494 20 0 BEADRP C[C@@H]([NH2+][C@H]1CSC1(C)C)C1CC[NH+](C)CC1 ZINC000381470403 539001600 /nfs/dbraw/zinc/00/16/00/539001600.db2.gz OGMPNTPZHPBAOX-PWSUYJOCSA-N 2 0 242.432 2.200 20 0 BEADRP CN1CCC[C@@H]([NH2+][C@@H]2CCC23CCCC3)C1 ZINC000381647616 539006161 /nfs/dbraw/zinc/00/61/61/539006161.db2.gz CASKNXNUNIVDPF-CHWSQXEVSA-N 2 0 222.376 2.393 20 0 BEADRP CCC[C@H](C)CCC[NH+]1C[C@@H]2C[NH2+]C[C@H]2C1 ZINC000625096964 342852108 /nfs/dbraw/zinc/85/21/08/342852108.db2.gz HSDDUOVEMFXCHE-IHRRRGAJSA-N 2 0 224.392 2.354 20 0 BEADRP CCc1ccc(C[N@H+](C)CCC[NH3+])cc1 ZINC000036198793 342897381 /nfs/dbraw/zinc/89/73/81/342897381.db2.gz DOYJQZCWGUTXPO-UHFFFAOYSA-N 2 0 206.333 2.030 20 0 BEADRP CSC[C@@H](C)[NH2+][C@H](C)C1CC[NH+](C)CC1 ZINC000134014374 398328549 /nfs/dbraw/zinc/32/85/49/398328549.db2.gz KCBFBOLVVVDJPH-GHMZBOCLSA-N 2 0 230.421 2.058 20 0 BEADRP CC1(C)COC[C@@H]1N[C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000313054185 259330256 /nfs/dbraw/zinc/33/02/56/259330256.db2.gz HQVDZAPEYVMUPO-RDBSUJKOSA-N 2 0 246.354 2.146 20 0 BEADRP C[C@@H]1[C@H]([NH2+]Cc2ccccc2)CCCN1C ZINC000306328391 398339634 /nfs/dbraw/zinc/33/96/34/398339634.db2.gz NIJPXCLERMPTQK-TZMCWYRMSA-N 2 0 218.344 2.259 20 0 BEADRP CSCC[C@H](C)[N@H+](C)CCC1CC[NH2+]CC1 ZINC000156910392 398339737 /nfs/dbraw/zinc/33/97/37/398339737.db2.gz ZIWWWCPNIHIGNO-LBPRGKRZSA-N 2 0 244.448 2.450 20 0 BEADRP Cc1cccc(N2CC[C@@H]([NH+]3CCCC3)C2)n1 ZINC000157375309 398340283 /nfs/dbraw/zinc/34/02/83/398340283.db2.gz LVGOTGMTVPPEOW-CYBMUJFWSA-N 2 0 231.343 2.065 20 0 BEADRP Cc1cccc(N2CC[C@H]([NH+]3CCCC3)C2)n1 ZINC000157375144 398340297 /nfs/dbraw/zinc/34/02/97/398340297.db2.gz LVGOTGMTVPPEOW-ZDUSSCGKSA-N 2 0 231.343 2.065 20 0 BEADRP C[C@H](C[NH2+]CCCC[NH3+])c1ccccc1 ZINC000037715143 342943373 /nfs/dbraw/zinc/94/33/73/342943373.db2.gz AGUUFHYHIXBTEJ-GFCCVEGCSA-N 2 0 206.333 2.119 20 0 BEADRP COCCC[C@H](C)[NH2+]C[C@H](C)C[NH+]1CCCC1 ZINC000178244200 536666779 /nfs/dbraw/zinc/66/67/79/536666779.db2.gz HISJLBWNRKXGEN-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H]1CC[C@@H]1C(C)(C)C ZINC000576814629 365691126 /nfs/dbraw/zinc/69/11/26/365691126.db2.gz FXMNNLJGFDILLL-RYUDHWBXSA-N 2 0 212.381 2.400 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@@H](C)C1CCOCC1 ZINC000353910384 187208924 /nfs/dbraw/zinc/20/89/24/187208924.db2.gz DDYCFXBYOBHYFK-ZDUSSCGKSA-N 2 0 242.407 2.121 20 0 BEADRP CCCCOCC[N@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000355889001 187212012 /nfs/dbraw/zinc/21/20/12/187212012.db2.gz JONSMKIVIFZSGA-AWEZNQCLSA-N 2 0 242.407 2.077 20 0 BEADRP CC[C@H]1CCC[N@@H+]1CCC1CC[NH2+]CC1 ZINC000037914081 343002198 /nfs/dbraw/zinc/00/21/98/343002198.db2.gz BOXGXBSKRAETBX-ZDUSSCGKSA-N 2 0 210.365 2.251 20 0 BEADRP CC[C@@H]1CCC[N@@H+]1CCC1CC[NH2+]CC1 ZINC000037914080 343002297 /nfs/dbraw/zinc/00/22/97/343002297.db2.gz BOXGXBSKRAETBX-CYBMUJFWSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@@H](F)CC[N@@H+]1CCC[C@@H](c2ncc[nH]2)C1 ZINC000351875393 136261010 /nfs/dbraw/zinc/26/10/10/136261010.db2.gz LPONVKOGHCQZDG-GHMZBOCLSA-N 2 0 225.311 2.337 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCC[C@@H]([NH3+])C1)c1nccs1 ZINC000235483856 343039653 /nfs/dbraw/zinc/03/96/53/343039653.db2.gz IQMFYHCVYKACOW-MXWKQRLJSA-N 2 0 239.388 2.106 20 0 BEADRP CCC(C)(C)[C@H](C)[NH2+][C@H]1CC[NH2+]C[C@@H]1C ZINC000576862101 365705919 /nfs/dbraw/zinc/70/59/19/365705919.db2.gz IYVOWCWWWUSWBB-SRVKXCTJSA-N 2 0 212.381 2.399 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)C1CC1 ZINC000400961838 529660360 /nfs/dbraw/zinc/66/03/60/529660360.db2.gz MWWMNFOQJNUIKY-RQJABVFESA-N 2 0 222.376 2.153 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]CCCc2ccccc2)C1 ZINC000093210097 343151341 /nfs/dbraw/zinc/15/13/41/343151341.db2.gz MJSZYFRIPVKXIC-CABCVRRESA-N 2 0 232.371 2.479 20 0 BEADRP C[C@@H]1C[C@H]([NH3+])CC[N@@H+]1Cc1ccc2c(c1)CCC2 ZINC000124494724 343162544 /nfs/dbraw/zinc/16/25/44/343162544.db2.gz PXBUIXSKYSTARG-MLGOLLRUSA-N 2 0 244.382 2.487 20 0 BEADRP C[C@@H](CCc1ccco1)[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000132023024 343187209 /nfs/dbraw/zinc/18/72/09/343187209.db2.gz RPPVQIPEDIFZJA-STQMWFEESA-N 2 0 236.359 2.190 20 0 BEADRP c1cnc2cccc(CN3CCC[NH2+]CC3)c2c1 ZINC000634687368 343239844 /nfs/dbraw/zinc/23/98/44/343239844.db2.gz ITAYONRKVKHIPP-UHFFFAOYSA-N 2 0 241.338 2.030 20 0 BEADRP C[C@@H]1C[C@H]([NH3+])CN1Cc1cccc2ncccc12 ZINC000634688585 343249043 /nfs/dbraw/zinc/24/90/43/343249043.db2.gz WZOVCFVKJCJQAJ-YPMHNXCESA-N 2 0 241.338 2.156 20 0 BEADRP CCc1ccc(C[NH2+]CCCC[NH3+])s1 ZINC000051718469 343258298 /nfs/dbraw/zinc/25/82/98/343258298.db2.gz NBVGOTGDTNEZAW-UHFFFAOYSA-N 2 0 212.362 2.139 20 0 BEADRP CC[C@H](C)[N@@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000302365362 529701864 /nfs/dbraw/zinc/70/18/64/529701864.db2.gz KKDAZURKEUHPEL-CFVMTHIKSA-N 2 0 232.371 2.459 20 0 BEADRP CC(C)c1ncc(C[NH2+][C@@H](C)C[C@@H](C)[NH3+])s1 ZINC000584053363 343307517 /nfs/dbraw/zinc/30/75/17/343307517.db2.gz IYFOTJWYCYKKSY-ZJUUUORDSA-N 2 0 241.404 2.482 20 0 BEADRP CCC1([NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)CC1 ZINC000335626659 136299841 /nfs/dbraw/zinc/29/98/41/136299841.db2.gz VYUCOWCTGSNKEO-NEPJUHHUSA-N 2 0 208.349 2.145 20 0 BEADRP CC[C@@H]1CCCC[C@H]1[NH2+]CCC[NH+](C)C ZINC000070558354 343334592 /nfs/dbraw/zinc/33/45/92/343334592.db2.gz FJPCOORIBUSJRQ-CHWSQXEVSA-N 2 0 212.381 2.497 20 0 BEADRP CC1(C)CCCC[C@H]1[NH2+]CC1([NH3+])CCC1 ZINC000335650235 136304908 /nfs/dbraw/zinc/30/49/08/136304908.db2.gz RPQQZCOAZMPOIH-LLVKDONJSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@H]([NH3+])[C@H]1CC[N@H+](CC2CCCCC2)C1 ZINC000166224981 136313572 /nfs/dbraw/zinc/31/35/72/136313572.db2.gz CYYCZCKLPMETPY-AAEUAGOBSA-N 2 0 210.365 2.236 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]CCc2cccnc2)CC1 ZINC000037717664 187260392 /nfs/dbraw/zinc/26/03/92/187260392.db2.gz GXIRXJBLPFFEOG-UHFFFAOYSA-N 2 0 247.386 2.087 20 0 BEADRP C[C@H]1CCC[N@@H+]1CC[C@@H]1CCCC[NH+]1C ZINC000335698430 136327708 /nfs/dbraw/zinc/32/77/08/136327708.db2.gz NYVUYONZBKVEBD-STQMWFEESA-N 2 0 210.365 2.345 20 0 BEADRP CCC[N@H+](CCC[NH+](C)C)C[C@@H]1CCSC1 ZINC000349365428 136343141 /nfs/dbraw/zinc/34/31/41/136343141.db2.gz HVFDWRFPZRQRCG-ZDUSSCGKSA-N 2 0 244.448 2.403 20 0 BEADRP Cc1nccn1CCC[N@@H+](C)C[C@@H]1C[C@H]1C ZINC000349408375 136344436 /nfs/dbraw/zinc/34/44/36/136344436.db2.gz PUZSUGRTCSQHDQ-YPMHNXCESA-N 2 0 221.348 2.169 20 0 BEADRP Cc1nccn1CCC[N@@H+](C)C[C@H]1C[C@@H]1C ZINC000349408374 136344642 /nfs/dbraw/zinc/34/46/42/136344642.db2.gz PUZSUGRTCSQHDQ-WCQYABFASA-N 2 0 221.348 2.169 20 0 BEADRP [NH3+]CCCC[NH2+][C@@H]1CCc2cc(F)ccc21 ZINC000166514537 136357852 /nfs/dbraw/zinc/35/78/52/136357852.db2.gz LHFPASYUBUFELJ-CYBMUJFWSA-N 2 0 222.307 2.142 20 0 BEADRP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]CCC1CCCC1 ZINC000166530441 136358096 /nfs/dbraw/zinc/35/80/96/136358096.db2.gz FURIRQNBNMOQRP-JSGCOSHPSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@H]([NH2+]CC(C)(C)C[NH+](C)C)C1CC1 ZINC000083054093 343475379 /nfs/dbraw/zinc/47/53/79/343475379.db2.gz XZNJMGRETJOLED-LBPRGKRZSA-N 2 0 212.381 2.352 20 0 BEADRP CC(C)CC[C@@H](C)[NH2+]CC1CC[NH2+]CC1 ZINC000086700277 343626985 /nfs/dbraw/zinc/62/69/85/343626985.db2.gz SJNIUMZWDJOMKK-GFCCVEGCSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[NH2+]C1)C1CCCCCC1 ZINC000088163226 343709789 /nfs/dbraw/zinc/70/97/89/343709789.db2.gz DIOBXSJRNXCDBG-YPMHNXCESA-N 2 0 210.365 2.297 20 0 BEADRP CC[NH2+]CC1CC[NH+](CCC(C)C)CC1 ZINC000053658920 346968999 /nfs/dbraw/zinc/96/89/99/346968999.db2.gz ZJQAVYHSSYIRPB-UHFFFAOYSA-N 2 0 212.381 2.354 20 0 BEADRP C[C@@H](C[N@@H+]1CCC[C@H](C[NH3+])C1)c1ccccc1 ZINC000044528046 343781273 /nfs/dbraw/zinc/78/12/73/343781273.db2.gz QIKLPOPRTBEGTO-UONOGXRCSA-N 2 0 232.371 2.461 20 0 BEADRP Cc1ccsc1C[N@@H+]1CCC[C@@H](C[NH3+])C1 ZINC000044527838 343781298 /nfs/dbraw/zinc/78/12/98/343781298.db2.gz YCOGWWMYVPRJNH-NSHDSACASA-N 2 0 224.373 2.227 20 0 BEADRP C[C@@H](NC[C@H]1CCC[NH2+]1)c1ccc(F)cc1 ZINC000235213156 187273819 /nfs/dbraw/zinc/27/38/19/187273819.db2.gz DHPRGVVCQDGMFA-ZWNOBZJWSA-N 2 0 222.307 2.228 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+][C@@H]1CCCC[C@@H]1C[NH3+] ZINC000387661116 346995196 /nfs/dbraw/zinc/99/51/96/346995196.db2.gz HLONGKNINXWJNM-FVCCEPFGSA-N 2 0 210.365 2.140 20 0 BEADRP Cc1cc(C[N@@H+]2C[C@H](C[NH3+])[C@@H](C)C[C@H]2C)ccn1 ZINC000621776702 343899375 /nfs/dbraw/zinc/89/93/75/343899375.db2.gz SZWUBVAASGCCRL-LNSITVRQSA-N 2 0 247.386 2.195 20 0 BEADRP COc1ccccc1C[NH2+]C1CCC([NH3+])CC1 ZINC000051692860 259371773 /nfs/dbraw/zinc/37/17/73/259371773.db2.gz SWNOUKRYLVKYDK-UHFFFAOYSA-N 2 0 234.343 2.055 20 0 BEADRP CC(C)[N@@H+]1CC[C@H](C[NH2+]C2CCCC2)C1 ZINC000040620882 187281305 /nfs/dbraw/zinc/28/13/05/187281305.db2.gz LSMYJMRLITYEHD-GFCCVEGCSA-N 2 0 210.365 2.249 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@H]1CC[C@@H]1C1CC1 ZINC000336753967 537840324 /nfs/dbraw/zinc/84/03/24/537840324.db2.gz HEBZEXDYNMZONP-OLZOCXBDSA-N 2 0 210.365 2.106 20 0 BEADRP C[NH+]1CCC(CC[NH2+][C@@H]2CC[C@@H]2C2CC2)CC1 ZINC000348120210 537839993 /nfs/dbraw/zinc/83/99/93/537839993.db2.gz OXSWJFWANQTQIH-HUUCEWRRSA-N 2 0 236.403 2.497 20 0 BEADRP CC1CC([NH2+][C@H]2CC[NH2+]CC(C)(C)C2)C1 ZINC000634733290 344113321 /nfs/dbraw/zinc/11/33/21/344113321.db2.gz BZEIFROIUBPMCU-CXQJBGSLSA-N 2 0 210.365 2.153 20 0 BEADRP COCC(C)(C)C[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000634734111 344114599 /nfs/dbraw/zinc/11/45/99/344114599.db2.gz XAOCKQIOGVSATE-LBPRGKRZSA-N 2 0 242.407 2.027 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CC[C@H]2C2CC2)C1 ZINC000336751299 537842160 /nfs/dbraw/zinc/84/21/60/537842160.db2.gz CHQVVAYINSLLQK-KWCYVHTRSA-N 2 0 222.376 2.106 20 0 BEADRP CCC(CC)C[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000130451857 344221662 /nfs/dbraw/zinc/22/16/62/344221662.db2.gz RSNDADMTAPYEJP-CYBMUJFWSA-N 2 0 212.381 2.402 20 0 BEADRP CCCCC[N@H+](C)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000040747118 344284580 /nfs/dbraw/zinc/28/45/80/344284580.db2.gz WOMWGXKKJDAEQW-FUNVUKJBSA-N 2 0 210.365 2.391 20 0 BEADRP COCc1ccccc1C[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000093214623 344312803 /nfs/dbraw/zinc/31/28/03/344312803.db2.gz DDLVOUMZEQGFMK-CABCVRRESA-N 2 0 248.370 2.193 20 0 BEADRP CC(C)[N@H+](CC1CC1)C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000300055816 344383980 /nfs/dbraw/zinc/38/39/80/344383980.db2.gz KLMGDXXPIXYCHO-TZMCWYRMSA-N 2 0 224.392 2.495 20 0 BEADRP Cc1cc(N[C@@H]2CC[NH2+]CC(C)(C)C2)nc(C)n1 ZINC000634813591 344399022 /nfs/dbraw/zinc/39/90/22/344399022.db2.gz QOCIVSJXFNJAHB-GFCCVEGCSA-N 2 0 248.374 2.284 20 0 BEADRP COCCCCC[N@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000152339459 344521872 /nfs/dbraw/zinc/52/18/72/344521872.db2.gz RRILTIPHOJVMNA-CQSZACIVSA-N 2 0 242.407 2.077 20 0 BEADRP Cc1nc(C)c([C@@H](C)NCC(C)(C)[NH3+])s1 ZINC000049538761 344651745 /nfs/dbraw/zinc/65/17/45/344651745.db2.gz USQDIJWKTRGSOU-SSDOTTSWSA-N 2 0 227.377 2.148 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000569616293 344683818 /nfs/dbraw/zinc/68/38/18/344683818.db2.gz QRIDRUZBTQCGNC-QEJZJMRPSA-N 2 0 236.403 2.495 20 0 BEADRP CC(C)[C@H](C)[NH2+]Cc1ccc2c(c1)C[NH2+]C2 ZINC000318969272 259381137 /nfs/dbraw/zinc/38/11/37/259381137.db2.gz GQRHDMWEFGQXHR-NSHDSACASA-N 2 0 218.344 2.424 20 0 BEADRP C[NH+](C)CCC[NH2+]Cc1ccc2cnccc2c1 ZINC000234219657 537863063 /nfs/dbraw/zinc/86/30/63/537863063.db2.gz UDZZNYSCXQQYRD-UHFFFAOYSA-N 2 0 243.354 2.276 20 0 BEADRP C[N@H+](C[C@@H]1CCC[NH+](C)C1)CC1(C)CCC1 ZINC000432833659 537866882 /nfs/dbraw/zinc/86/68/82/537866882.db2.gz DYMNSCNVNPQOQR-CYBMUJFWSA-N 2 0 224.392 2.450 20 0 BEADRP C1[C@@H]2[C@H]1CCC[C@@H]2[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000306073390 187296039 /nfs/dbraw/zinc/29/60/39/187296039.db2.gz DNFJOCUWIWKGKC-AHDPXTMNSA-N 2 0 234.387 2.391 20 0 BEADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(F)cc2F)C1 ZINC000583428567 344947126 /nfs/dbraw/zinc/94/71/26/344947126.db2.gz GSARZHMAHIBHAP-BXKDBHETSA-N 2 0 240.297 2.182 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCC(C)(C)C)CC[N@@H+]1C ZINC000156095979 345122607 /nfs/dbraw/zinc/12/26/07/345122607.db2.gz FBQZSTGRTXPTSI-VXGBXAGGSA-N 2 0 212.381 2.495 20 0 BEADRP C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@@H+]1CC12CC(C1)C[NH2+]2 ZINC000634993397 345190357 /nfs/dbraw/zinc/19/03/57/345190357.db2.gz SZDBDWLWLYZWFG-FVEONMQPSA-N 2 0 234.387 2.391 20 0 BEADRP CC(C)[C@H](C[NH3+])C[NH2+]Cc1ccc([C@H](C)[NH3+])cc1 ZINC000634994405 345181858 /nfs/dbraw/zinc/18/18/58/345181858.db2.gz BOPUEJDOSFZMHT-SWLSCSKDSA-N 3 0 249.402 2.027 20 0 BEADRP CC(C)[C@@H](C[NH3+])CNc1ccc([C@H](C)[NH3+])cc1 ZINC000634995033 345183443 /nfs/dbraw/zinc/18/34/43/345183443.db2.gz SOJZPKJGPAWRKC-AAEUAGOBSA-N 2 0 235.375 2.349 20 0 BEADRP CC[C@@H](c1ccccc1)N1CC[C@@H]([NH2+]C)C1 ZINC000225574836 345160346 /nfs/dbraw/zinc/16/03/46/345160346.db2.gz QRRYNSSHMWMHIQ-KGLIPLIRSA-N 2 0 218.344 2.431 20 0 BEADRP CCOc1cccc(C[N@@H+]2CC[C@H]([NH3+])[C@@H](C)C2)c1 ZINC000227058004 345246392 /nfs/dbraw/zinc/24/63/92/345246392.db2.gz QJMRYCNSBGAUPI-WFASDCNBSA-N 2 0 248.370 2.254 20 0 BEADRP CC1([NH2+]CC23CC(C2)C[NH2+]3)CCC(F)(F)CC1 ZINC000634997486 345196413 /nfs/dbraw/zinc/19/64/13/345196413.db2.gz MEYWGHYBQHDKIC-UHFFFAOYSA-N 2 0 244.329 2.296 20 0 BEADRP C[C@H]1C[N@H+](Cc2coc3ccccc23)C[C@H]1C[NH3+] ZINC000634998091 345197734 /nfs/dbraw/zinc/19/77/34/345197734.db2.gz ANHCOFUNYRDIIL-NWDGAFQWSA-N 2 0 244.338 2.459 20 0 BEADRP C[C@H](Cc1ccccc1)C[N@@H+]1C[C@H](C)[C@H](C[NH3+])C1 ZINC000634999616 345200336 /nfs/dbraw/zinc/20/03/36/345200336.db2.gz WZXDXGJGOXAFRM-IJEWVQPXSA-N 2 0 246.398 2.392 20 0 BEADRP CC[C@@H]([NH2+][C@H]1CCCC12CC2)[C@@H]1CCC[NH2+]1 ZINC000635004480 345207828 /nfs/dbraw/zinc/20/78/28/345207828.db2.gz PFSUHTUTAFZJAG-AGIUHOORSA-N 2 0 222.376 2.439 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+][C@@H]1CCCC12CC2 ZINC000635004853 345208334 /nfs/dbraw/zinc/20/83/34/345208334.db2.gz QKHONVYSVKKMBT-FRRDWIJNSA-N 2 0 222.376 2.297 20 0 BEADRP CCC[C@H](CCO)[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000635005973 345209644 /nfs/dbraw/zinc/20/96/44/345209644.db2.gz XCGZDQIGHBKSRF-BYCMXARLSA-N 2 0 248.370 2.272 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)c1cccnc1 ZINC000635006774 345211047 /nfs/dbraw/zinc/21/10/47/345211047.db2.gz NRHNSGGXUBFYGQ-YRGRVCCFSA-N 2 0 233.359 2.250 20 0 BEADRP C[C@@H]1CCC[C@H]1[NH2+][C@H]1CC[C@H](C[NH3+])CC1 ZINC000635009786 345211967 /nfs/dbraw/zinc/21/19/67/345211967.db2.gz ZSCWNVGPPUHOEK-FDYHWXHSSA-N 2 0 210.365 2.282 20 0 BEADRP CC1CC([NH2+]CC[C@@H]([NH3+])Cc2ccccc2)C1 ZINC000635010121 345211987 /nfs/dbraw/zinc/21/19/87/345211987.db2.gz YLNKXHBDFLKIDF-HNFVBEJKSA-N 2 0 232.371 2.335 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+][C@@H]1C[C@H]1C(F)(F)F ZINC000635012443 345214217 /nfs/dbraw/zinc/21/42/17/345214217.db2.gz MLOJOKWEWMBNNH-DOLQZWNJSA-N 2 0 236.281 2.044 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CC[NH2+]CC(C)(C)C2)[C@H]1C ZINC000635012813 345215070 /nfs/dbraw/zinc/21/50/70/345215070.db2.gz VRALVHLNUMUFHX-VOAKCMCISA-N 2 0 224.392 2.399 20 0 BEADRP Cc1c[nH+]ccc1N[C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000158451696 345337113 /nfs/dbraw/zinc/33/71/13/345337113.db2.gz IVPOFJXYCKRAHG-NEPJUHHUSA-N 2 0 219.332 2.285 20 0 BEADRP CC(C)C[C@@H](C)[NH2+]CC1=CC[N@H+](C)CC1 ZINC000308847265 187306802 /nfs/dbraw/zinc/30/68/02/187306802.db2.gz MSLXNILSRRBTSF-GFCCVEGCSA-N 2 0 210.365 2.273 20 0 BEADRP CC1CCC([NH2+][C@@H]2CCN(C)C[C@H]2C)CC1 ZINC000089555128 345560869 /nfs/dbraw/zinc/56/08/69/345560869.db2.gz QTHTYBOOMWTMBM-FKZOYECMSA-N 2 0 224.392 2.495 20 0 BEADRP C([NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)C1(C2CC2)CC1 ZINC000090772696 345575462 /nfs/dbraw/zinc/57/54/62/345575462.db2.gz VUZHWDSIQVJVQA-KGLIPLIRSA-N 2 0 234.387 2.393 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]CCCC(C)(F)F ZINC000390243264 259383805 /nfs/dbraw/zinc/38/38/05/259383805.db2.gz PEORAJNBMCRFOP-GHMZBOCLSA-N 2 0 234.334 2.352 20 0 BEADRP c1ccc(C2(C[NH2+]C3CC[NH2+]CC3)CC2)cc1 ZINC000216202176 345743127 /nfs/dbraw/zinc/74/31/27/345743127.db2.gz XYFKSGVTUNCKEF-UHFFFAOYSA-N 2 0 230.355 2.060 20 0 BEADRP C[C@H]([NH2+]CCCC[NH+](C)C)C1CC(F)(F)C1 ZINC000628210116 345812311 /nfs/dbraw/zinc/81/23/11/345812311.db2.gz HCVYLUZVQALTDM-JTQLQIEISA-N 2 0 234.334 2.352 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@H](C)C1CC(F)(F)C1 ZINC000628210185 345812402 /nfs/dbraw/zinc/81/24/02/345812402.db2.gz KQGOPKDNZLHNJW-NXEZZACHSA-N 2 0 234.334 2.350 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCC[C@H]([NH3+])C1)c1cccc(O)c1 ZINC000093214306 345857652 /nfs/dbraw/zinc/85/76/52/345857652.db2.gz BMXILSSBTGFDMS-WXHSDQCUSA-N 2 0 234.343 2.313 20 0 BEADRP CC1(C)SC[C@@H]1[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000309815622 187311258 /nfs/dbraw/zinc/31/12/58/187311258.db2.gz VFHHABUJJJNSRB-WOPDTQHZSA-N 2 0 240.416 2.097 20 0 BEADRP CCOC[C@@H]1CC[N@H+](CCC[NH+](CC)CC)C1 ZINC000191803854 346065039 /nfs/dbraw/zinc/06/50/39/346065039.db2.gz STFGWMXFPZFRPY-CQSZACIVSA-N 2 0 242.407 2.077 20 0 BEADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+]CC2(C)CC2)C1 ZINC000381521490 346242553 /nfs/dbraw/zinc/24/25/53/346242553.db2.gz UVIMQJWVXAAEMI-CYBMUJFWSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1cccc(C)c1CN1CCC[C@@H]([NH3+])C1 ZINC000122155258 179035008 /nfs/dbraw/zinc/03/50/08/179035008.db2.gz OLQGZXCWBMSHGT-CYBMUJFWSA-N 2 0 218.344 2.227 20 0 BEADRP Cc1cccc(C)c1C[NH+]1CCC(C[NH3+])CC1 ZINC000130884238 179035875 /nfs/dbraw/zinc/03/58/75/179035875.db2.gz DRXNBRWREJZQPY-UHFFFAOYSA-N 2 0 232.371 2.474 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000069662174 349952535 /nfs/dbraw/zinc/95/25/35/349952535.db2.gz UXGRXJAZNSKQMP-WCQYABFASA-N 2 0 210.365 2.106 20 0 BEADRP Cc1cccc(C[N@H+]2CC[C@H]([C@H](C)[NH3+])C2)c1 ZINC000228204718 179081901 /nfs/dbraw/zinc/08/19/01/179081901.db2.gz BPSLYPCHBVNWEJ-JSGCOSHPSA-N 2 0 218.344 2.164 20 0 BEADRP Cc1cccc(C[N@H+]2CC[C@H]3C[NH2+]C[C@H]3CC2)c1 ZINC000335271825 179082838 /nfs/dbraw/zinc/08/28/38/179082838.db2.gz WDQBHOOGUVKSTE-IYBDPMFKSA-N 2 0 244.382 2.426 20 0 BEADRP Cc1cccc(C[NH2+][C@@H]2CCN(C)C2)c1C ZINC000043314312 179097581 /nfs/dbraw/zinc/09/75/81/179097581.db2.gz VOFDGOMXRZYWKF-CQSZACIVSA-N 2 0 218.344 2.097 20 0 BEADRP Cc1cccc(C[NH2+][C@@H](C)CC[NH+](C)C)c1 ZINC000049551784 179096536 /nfs/dbraw/zinc/09/65/36/179096536.db2.gz YXOUFIXVHJWMGK-ZDUSSCGKSA-N 2 0 220.360 2.425 20 0 BEADRP CC(C)C[C@H](C)C[NH2+][C@H]1C[C@H]([NH3+])C1(C)C ZINC000641804250 362761738 /nfs/dbraw/zinc/76/17/38/362761738.db2.gz XDAKJJPMQDUGET-SRVKXCTJSA-N 2 0 212.381 2.384 20 0 BEADRP CC1(C)[C@H]([NH3+])C[C@@H]1[NH2+]C[C@H]1CCC(F)(F)C1 ZINC000641800905 362752954 /nfs/dbraw/zinc/75/29/54/362752954.db2.gz ILLSEOSFNBARGU-AEJSXWLSSA-N 2 0 232.318 2.137 20 0 BEADRP CC1(C)[C@H]([NH3+])C[C@H]1[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC000641800908 362753536 /nfs/dbraw/zinc/75/35/36/362753536.db2.gz ILLSEOSFNBARGU-OPRDCNLKSA-N 2 0 232.318 2.137 20 0 BEADRP CO[C@H](C[NH2+][C@@H]1C[C@@H]([NH3+])C1(C)C)c1ccccc1 ZINC000641801102 362755182 /nfs/dbraw/zinc/75/51/82/362755182.db2.gz NBYMOGMNNLOWQI-MGPQQGTHSA-N 2 0 248.370 2.090 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H]1CCCc2c(O)cccc21 ZINC000574981068 346488486 /nfs/dbraw/zinc/48/84/86/346488486.db2.gz WRSPFTGTRBZDIK-AWEZNQCLSA-N 2 0 248.370 2.359 20 0 BEADRP Cc1cc(C)c(C[NH2+][C@@H]2C[C@H]([NH3+])C2(C)C)c(C)n1 ZINC000641801993 362758510 /nfs/dbraw/zinc/75/85/10/362758510.db2.gz XIYXCMDIPPMNQX-UONOGXRCSA-N 2 0 247.386 2.222 20 0 BEADRP Cc1ccc(F)cc1C[NH2+][C@@H]1C[C@@H]([NH3+])C1(C)C ZINC000641802352 362759364 /nfs/dbraw/zinc/75/93/64/362759364.db2.gz JMMMLVJWBPDGMK-CHWSQXEVSA-N 2 0 236.334 2.350 20 0 BEADRP C[C@@H](CCC1CC1)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000186330206 346501885 /nfs/dbraw/zinc/50/18/85/346501885.db2.gz WYEBNRITZBTHBZ-JSGCOSHPSA-N 2 0 224.392 2.497 20 0 BEADRP CC[N@@H+]1CCC[C@H](C[NH+]2CCC(C)CC2)C1 ZINC000104949686 346548764 /nfs/dbraw/zinc/54/87/64/346548764.db2.gz PANSLSQRYWQEGU-AWEZNQCLSA-N 2 0 224.392 2.450 20 0 BEADRP COc1cc(C)cc(C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)c1 ZINC000577124171 365828816 /nfs/dbraw/zinc/82/88/16/365828816.db2.gz IUUAMHIAKPQZGR-ZIAGYGMSSA-N 2 0 248.370 2.363 20 0 BEADRP C[C@H](Cc1ccsc1)[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000580182194 346621489 /nfs/dbraw/zinc/62/14/89/346621489.db2.gz RYMZVISCZDSYNX-GARJFASQSA-N 2 0 226.389 2.395 20 0 BEADRP Cc1nccn1CCC[N@@H+](C)C(C)(C)C ZINC000563614783 323131554 /nfs/dbraw/zinc/13/15/54/323131554.db2.gz FCPSZQAAARAHEK-UHFFFAOYSA-N 2 0 209.337 2.312 20 0 BEADRP Cc1cccc(OCC[N@H+]2CC[C@H]([C@H](C)[NH3+])C2)c1 ZINC000228202298 179168177 /nfs/dbraw/zinc/16/81/77/179168177.db2.gz IWDJZXHEHHTUFB-KBPBESRZSA-N 2 0 248.370 2.043 20 0 BEADRP Cc1cccc(OCC[N@H+]2C[C@H](C[NH3+])C[C@@H]2C)c1 ZINC000131784838 179168444 /nfs/dbraw/zinc/16/84/44/179168444.db2.gz WWLCIKSNBIPCTD-KBPBESRZSA-N 2 0 248.370 2.043 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@H]1C ZINC000387970946 347138345 /nfs/dbraw/zinc/13/83/45/347138345.db2.gz GBNXKDXUPSABQK-XHJNMGKDSA-N 2 0 224.392 2.351 20 0 BEADRP COCC[C@@H](C)[NH2+]CC[C@H](C)[NH+]1CCCCC1 ZINC000184509191 347165181 /nfs/dbraw/zinc/16/51/81/347165181.db2.gz RXKYJFXLVJEERP-KGLIPLIRSA-N 2 0 242.407 2.266 20 0 BEADRP CC[NH+]1CCC([NH2+]Cc2ccccc2)CC1 ZINC000019886011 347307239 /nfs/dbraw/zinc/30/72/39/347307239.db2.gz GUWXXQAGWUCDRI-UHFFFAOYSA-N 2 0 218.344 2.261 20 0 BEADRP CC(C)C[C@H](C)[NH2+]CCC[NH+]1CCCC1 ZINC000020129006 347408406 /nfs/dbraw/zinc/40/84/06/347408406.db2.gz UQYLHZFTONWLPZ-ZDUSSCGKSA-N 2 0 212.381 2.497 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]CCC1CCCCC1 ZINC000259040102 323146673 /nfs/dbraw/zinc/14/66/73/323146673.db2.gz PGXZVSALOJJIMJ-CHWSQXEVSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@H]([NH2+]CCCC[NH+](C)C)C1CCCC1 ZINC000054081438 347445506 /nfs/dbraw/zinc/44/55/06/347445506.db2.gz OTRREEUFPYILJC-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP CCOCC[NH+]1CCC(C[N@H+](C)C(C)C)CC1 ZINC000590818945 347568800 /nfs/dbraw/zinc/56/88/00/347568800.db2.gz LAOHTNWHZIUJNM-UHFFFAOYSA-N 2 0 242.407 2.075 20 0 BEADRP Cc1ccccc1CCC[NH+]1C[C@H]2C[NH2+]C[C@@H]2C1 ZINC000359283909 179261471 /nfs/dbraw/zinc/26/14/71/179261471.db2.gz KIXOKSVNFQJGJF-HZPDHXFCSA-N 2 0 244.382 2.079 20 0 BEADRP Cc1ccccc1CCC[NH2+]CC1([NH3+])CCC1 ZINC000342135224 179261634 /nfs/dbraw/zinc/26/16/34/179261634.db2.gz OHCSVJURPSPHEC-UHFFFAOYSA-N 2 0 232.371 2.399 20 0 BEADRP Cc1ccccc1C[N@H+](C)CCCC[NH3+] ZINC000036127821 179269725 /nfs/dbraw/zinc/26/97/25/179269725.db2.gz VXSUVZZPOHDWPV-UHFFFAOYSA-N 2 0 206.333 2.166 20 0 BEADRP CCS[C@@H]1CCCC[N@H+](C[C@H]2CC[NH2+]C2)C1 ZINC000592477066 347791474 /nfs/dbraw/zinc/79/14/74/347791474.db2.gz QYLYNUMHGZSOEE-QWHCGFSZSA-N 2 0 242.432 2.204 20 0 BEADRP C[C@H](Cc1ccco1)[NH2+]C[C@H]1CCCCN1C ZINC000054241419 1172096450 /nfs/dbraw/zinc/09/64/50/1172096450.db2.gz YSAUIXNSOODLHC-CHWSQXEVSA-N 2 0 236.359 2.285 20 0 BEADRP CC[C@@H](C)[C@@H](C)[NH2+]CC1(C)CC[NH2+]CC1 ZINC000319565035 259398345 /nfs/dbraw/zinc/39/83/45/259398345.db2.gz QHDGBIRVHNEZSU-VXGBXAGGSA-N 2 0 212.381 2.400 20 0 BEADRP Cc1ccccc1OCC[N@@H+]1CCC[C@H](C[NH3+])C1 ZINC000011888572 179310577 /nfs/dbraw/zinc/31/05/77/179310577.db2.gz XAQGQQQDEWKYHO-CQSZACIVSA-N 2 0 248.370 2.045 20 0 BEADRP CC(C)[C@H]1CC[C@@H]1[NH2+]CC1CC[NH2+]CC1 ZINC000577383043 365940148 /nfs/dbraw/zinc/94/01/48/365940148.db2.gz MIZUNZYDOUIHQE-OLZOCXBDSA-N 2 0 210.365 2.010 20 0 BEADRP CCOc1ccc([C@H](C)[NH2+]C2CC[NH2+]CC2)cc1 ZINC000038041300 348038387 /nfs/dbraw/zinc/03/83/87/348038387.db2.gz IIMWOEUUFIHKLW-LBPRGKRZSA-N 2 0 248.370 2.488 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)CSCCF)C1 ZINC000595010210 348159948 /nfs/dbraw/zinc/15/99/48/348159948.db2.gz IZPGPNKGEUGIND-NWDGAFQWSA-N 2 0 248.411 2.009 20 0 BEADRP C[C@H](CSCCF)[NH2+]CCC[NH+]1CCCC1 ZINC000595003071 348169317 /nfs/dbraw/zinc/16/93/17/348169317.db2.gz CRSFKTHLIHTJLV-GFCCVEGCSA-N 2 0 248.411 2.153 20 0 BEADRP CCN(CC[NH2+][C@@H](C)CSCCF)C1CC1 ZINC000595035349 348175573 /nfs/dbraw/zinc/17/55/73/348175573.db2.gz HUUMIJXVMATBLR-NSHDSACASA-N 2 0 248.411 2.152 20 0 BEADRP CCN(CC[NH2+][C@H](C)CSCCF)C1CC1 ZINC000595035348 348175906 /nfs/dbraw/zinc/17/59/06/348175906.db2.gz HUUMIJXVMATBLR-LLVKDONJSA-N 2 0 248.411 2.152 20 0 BEADRP C[C@H](CSCCF)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000595015917 348185823 /nfs/dbraw/zinc/18/58/23/348185823.db2.gz FEDNYMWKBFDATF-VXGBXAGGSA-N 2 0 248.411 2.009 20 0 BEADRP Cc1cncc(C[N@@H+]2C[C@H](C[NH3+])[C@@H](C)C[C@@H]2C)c1 ZINC000397310602 362874881 /nfs/dbraw/zinc/87/48/81/362874881.db2.gz ORUHSGYKWBSUGU-YDHLFZDLSA-N 2 0 247.386 2.195 20 0 BEADRP Cc1cncc(C[N@@H+]2C[C@H](C[NH3+])[C@H](C)C[C@H]2C)c1 ZINC000397310599 362874940 /nfs/dbraw/zinc/87/49/40/362874940.db2.gz ORUHSGYKWBSUGU-NFAWXSAZSA-N 2 0 247.386 2.195 20 0 BEADRP CC(C)[C@@H]([NH2+]CCCC[NH+](C)C)C1CC1 ZINC000308987543 323183508 /nfs/dbraw/zinc/18/35/08/323183508.db2.gz KELKTZADLQCXOS-CYBMUJFWSA-N 2 0 212.381 2.352 20 0 BEADRP COCCCCC[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000122788555 490173596 /nfs/dbraw/zinc/17/35/96/490173596.db2.gz DQAANOJEMFVOOG-ZDUSSCGKSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)(C)[C@@H]1CCC[N@@H+]1C[C@H]1CCC[NH2+]C1 ZINC000257782418 535075707 /nfs/dbraw/zinc/07/57/07/535075707.db2.gz QLPVATVGLHXTPK-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP CSCC1(CC[NH2+][C@H](C)C[C@H](C)[NH3+])CC1 ZINC000596649694 348605540 /nfs/dbraw/zinc/60/55/40/348605540.db2.gz FEQMKWNHSRQPPL-WDEREUQCSA-N 2 0 230.421 2.235 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC000038812866 348734476 /nfs/dbraw/zinc/73/44/76/348734476.db2.gz MRWADXJLYWZRTH-SGMGOOAPSA-N 2 0 218.344 2.417 20 0 BEADRP CSC[C@@H](C)[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1 ZINC000598965327 349068629 /nfs/dbraw/zinc/06/86/29/349068629.db2.gz XZFGIMGPBLHBSB-MNOVXSKESA-N 2 0 230.421 2.200 20 0 BEADRP Cc1cc(Nc2ccc3c(c2)C[NH2+]CC3)cc[nH+]1 ZINC000420178312 192170647 /nfs/dbraw/zinc/17/06/47/192170647.db2.gz AUUQBOOYKLRCGV-UHFFFAOYSA-N 2 0 239.322 2.201 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CC2CC[NH2+]CC2)C[C@H]1C ZINC000251591019 349188719 /nfs/dbraw/zinc/18/87/19/349188719.db2.gz CISCQNBHAADBOS-YRGRVCCFSA-N 2 0 224.392 2.400 20 0 BEADRP CC(C)[N@@H+]1CC[C@H](C[NH2+][C@H](C)C2CC2)C1 ZINC000250475319 349170871 /nfs/dbraw/zinc/17/08/71/349170871.db2.gz AHDNCOBMGLDNLK-VXGBXAGGSA-N 2 0 210.365 2.105 20 0 BEADRP CCOc1ccc(C[N@@H+]2CC[C@H]([NH3+])C[C@H]2C)cc1 ZINC000252685974 349210124 /nfs/dbraw/zinc/21/01/24/349210124.db2.gz IYTBJFSIMGWWNY-OCCSQVGLSA-N 2 0 248.370 2.397 20 0 BEADRP CC[C@@H]1CCC[C@H]1[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000388590907 349203568 /nfs/dbraw/zinc/20/35/68/349203568.db2.gz APCXIVGVPWIAGY-YNEHKIRRSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623524326 362944575 /nfs/dbraw/zinc/94/45/75/362944575.db2.gz OASJFEAYKRVBPG-UTUOFQBUSA-N 2 0 210.365 2.247 20 0 BEADRP [NH3+][C@H]1CCC[C@@H](C[NH2+]C(C2CC2)C2CC2)C1 ZINC000070503289 350016034 /nfs/dbraw/zinc/01/60/34/350016034.db2.gz AVKOCTOAVCRCAO-MFKMUULPSA-N 2 0 222.376 2.282 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CCCCF)CC1(C)C ZINC000623529523 362948091 /nfs/dbraw/zinc/94/80/91/362948091.db2.gz MVPWSHJMPXTAFN-NSHDSACASA-N 2 0 216.344 2.199 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@@H]2CCCC2(F)F)CC1 ZINC000395755370 323240534 /nfs/dbraw/zinc/24/05/34/323240534.db2.gz GFEYMGKTIINPPW-NSHDSACASA-N 2 0 246.345 2.496 20 0 BEADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+][C@H]2CC[C@@H](C)C2)C1 ZINC000070643535 350035835 /nfs/dbraw/zinc/03/58/35/350035835.db2.gz ALEZIGMLRIHGLW-RDBSUJKOSA-N 2 0 224.392 2.495 20 0 BEADRP CCc1nc(C)c(C[NH2+][C@H](C)CCCC[NH3+])o1 ZINC000311852919 350042339 /nfs/dbraw/zinc/04/23/39/350042339.db2.gz PXRDIGZDHWHJCS-SNVBAGLBSA-N 2 0 239.363 2.153 20 0 BEADRP CCc1ccc(C[N@@H+]2CC[C@H](C[NH2+]C)C2)s1 ZINC000070798690 350059370 /nfs/dbraw/zinc/05/93/70/350059370.db2.gz WWQBRUGKYWUHCU-LLVKDONJSA-N 2 0 238.400 2.352 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CC2CC(F)(F)C2)CC1(C)C ZINC000623530052 362949426 /nfs/dbraw/zinc/94/94/26/362949426.db2.gz LAUNDINRMYTWDS-NSHDSACASA-N 2 0 246.345 2.494 20 0 BEADRP C[C@@H](C[NH2+][C@@H](C)CC1CC1)C[NH+]1CCCC1 ZINC000132430253 191032591 /nfs/dbraw/zinc/03/25/91/191032591.db2.gz GKOBYFLVQYMMFP-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP COc1ccc(C[NH2+][C@H]2CC[NH2+]CC[C@H]2C)cc1 ZINC000422729053 192444189 /nfs/dbraw/zinc/44/41/89/192444189.db2.gz HINJPWAQFDCZGK-DOMZBBRYSA-N 2 0 248.370 2.173 20 0 BEADRP CSC1(C[NH2+]C[C@H]2CC[N@@H+](C(C)C)C2)CC1 ZINC000304248332 350150789 /nfs/dbraw/zinc/15/07/89/350150789.db2.gz GLOBHMGINKUYAG-GFCCVEGCSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@H]3C[C@H]32)CCN1C ZINC000304424141 350156011 /nfs/dbraw/zinc/15/60/11/350156011.db2.gz AHHRONQSITVESW-ITGHMWBKSA-N 2 0 222.376 2.247 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[C@@H](C)C[C@@H]1C)C1C[NH2+]C1 ZINC000422737342 192447179 /nfs/dbraw/zinc/44/71/79/192447179.db2.gz XJVBIDQZJJVKAO-XZUYRWCXSA-N 2 0 210.365 2.009 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH2+][C@H]2CCC[C@H]3C[C@H]32)C1 ZINC000304531845 350161981 /nfs/dbraw/zinc/16/19/81/350161981.db2.gz HBHQISNRUMLMLV-FQUUOJAGSA-N 2 0 222.376 2.106 20 0 BEADRP Cc1nccn1CCCC[N@H+]1C[C@H](C)[C@@H]1C ZINC000339570159 180236454 /nfs/dbraw/zinc/23/64/54/180236454.db2.gz QKMLIGCVFMANJA-RYUDHWBXSA-N 2 0 221.348 2.312 20 0 BEADRP CC(C)C1CC([NH2+]CCN2CC[C@H](C)C2)C1 ZINC000309305250 350276160 /nfs/dbraw/zinc/27/61/60/350276160.db2.gz AOSMPMIZSMVNLC-HSBZDZAISA-N 2 0 224.392 2.352 20 0 BEADRP CCC[NH+]1CCC([NH2+]CC2(C)CC2)CC1 ZINC000223814645 350291170 /nfs/dbraw/zinc/29/11/70/350291170.db2.gz VRNPATSNSWRGHA-UHFFFAOYSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]CCC[NH+]1CCCC1 ZINC000069666270 350377584 /nfs/dbraw/zinc/37/75/84/350377584.db2.gz IXXGKDBHKLFXGW-LBPRGKRZSA-N 2 0 210.365 2.251 20 0 BEADRP CO[C@H](C)[C@@H](C)[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000163250227 350511495 /nfs/dbraw/zinc/51/14/95/350511495.db2.gz IYADKMWGYABFRX-VXGBXAGGSA-N 2 0 242.407 2.262 20 0 BEADRP CO[C@H](C)[C@H](C)[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000163250142 350511765 /nfs/dbraw/zinc/51/17/65/350511765.db2.gz IYADKMWGYABFRX-NWDGAFQWSA-N 2 0 242.407 2.262 20 0 BEADRP Cc1ccc(C[NH2+]CCC[NH2+]C2CC2)cc1 ZINC000163424072 350521985 /nfs/dbraw/zinc/52/19/85/350521985.db2.gz ATRLHHNYCREEEH-UHFFFAOYSA-N 2 0 218.344 2.227 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CCC2CC2)[C@@H](C)C1 ZINC000222133604 490574820 /nfs/dbraw/zinc/57/48/20/490574820.db2.gz SVFYJPMEJDTZRF-AAEUAGOBSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CCCOC1CCCCC1 ZINC000422786928 192469651 /nfs/dbraw/zinc/46/96/51/192469651.db2.gz PHUIBKAGDFKOKW-CHWSQXEVSA-N 2 0 242.407 2.441 20 0 BEADRP C[C@H]([NH2+]CCN1CCC[C@@H](C)C1)C1(C)CC1 ZINC000156702773 191116226 /nfs/dbraw/zinc/11/62/26/191116226.db2.gz DDIDMQIMQRGEHS-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@@H]2C[C@H]3C[C@H]3C2)CC1(C)C ZINC000623555184 362975386 /nfs/dbraw/zinc/97/53/86/362975386.db2.gz CAGLYZCELBHWON-RNJOBUHISA-N 2 0 222.376 2.247 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@@H](F)C1)[C@@H]1CCCC[NH2+]1 ZINC000577611604 366017711 /nfs/dbraw/zinc/01/77/11/366017711.db2.gz TWALEVYVDCCQEL-LOWDOPEQSA-N 2 0 228.355 2.387 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C[C@@]2(C)CC2(F)F)CC1(C)C ZINC000623570152 362999952 /nfs/dbraw/zinc/99/99/52/362999952.db2.gz JEADXLFZSUGSDX-CMPLNLGQSA-N 2 0 246.345 2.494 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+]CC[C@@H]2CC2(F)F)CC1(C)C ZINC000623575975 363006359 /nfs/dbraw/zinc/00/63/59/363006359.db2.gz YIPCNDXYUCEMRE-GHMZBOCLSA-N 2 0 246.345 2.494 20 0 BEADRP CSCC[NH2+][C@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000086501074 351166219 /nfs/dbraw/zinc/16/62/19/351166219.db2.gz KDGUJAZBECZYMI-VXGBXAGGSA-N 2 0 230.421 2.250 20 0 BEADRP CC(C)[C@@H](C)[N@H+](C)CC[C@H]1CCC[NH+]1C ZINC000348078404 535159529 /nfs/dbraw/zinc/15/95/29/535159529.db2.gz LAMJCSXKBSYTJB-CHWSQXEVSA-N 2 0 212.381 2.447 20 0 BEADRP C[C@H]1CC[C@@H](N(C)Cc2ccccc2)C[NH2+]1 ZINC000306987299 351404208 /nfs/dbraw/zinc/40/42/08/351404208.db2.gz YOHBDVNKHVUXCV-GXTWGEPZSA-N 2 0 218.344 2.259 20 0 BEADRP [NH3+]CCC[N@@H+]1CCSC[C@@H]1c1ccccc1 ZINC000414680854 351588503 /nfs/dbraw/zinc/58/85/03/351588503.db2.gz UVMSNISATVHOFI-CYBMUJFWSA-N 2 0 236.384 2.125 20 0 BEADRP CCC[C@H](C[N@H+](C)C1CCN(CC)CC1)OC ZINC000637887701 351755146 /nfs/dbraw/zinc/75/51/46/351755146.db2.gz XSCIMTXSPWIHAS-CQSZACIVSA-N 2 0 242.407 2.218 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000414843510 351830312 /nfs/dbraw/zinc/83/03/12/351830312.db2.gz QAPODJVEDFYESO-UPJWGTAASA-N 2 0 210.365 2.154 20 0 BEADRP C([C@@H]1CC[C@H]2C[C@H]2C1)[N@@H+]1C[C@@H]2CCC[NH2+][C@@H]2C1 ZINC000638088986 351967285 /nfs/dbraw/zinc/96/72/85/351967285.db2.gz JDAJFYDKZSECPJ-GZBLMMOJSA-N 2 0 234.387 2.106 20 0 BEADRP C([C@@H]1CC[C@@H]2C[C@@H]2C1)[N@@H+]1C[C@@H]2CCC[NH2+][C@@H]2C1 ZINC000638088987 351967304 /nfs/dbraw/zinc/96/73/04/351967304.db2.gz JDAJFYDKZSECPJ-NIFZNCRKSA-N 2 0 234.387 2.106 20 0 BEADRP Cc1scc(C[N@H+]2C[C@H]3C[NH2+]C[C@H]3C2)c1C ZINC000638185745 352050078 /nfs/dbraw/zinc/05/00/78/352050078.db2.gz AACAQCDBOVOTSZ-TXEJJXNPSA-N 2 0 236.384 2.016 20 0 BEADRP CO[C@](C)(C[NH2+]CCC[N@H+](C)C(C)C)C1CC1 ZINC000638338521 352158913 /nfs/dbraw/zinc/15/89/13/352158913.db2.gz YALFBCWLRXMCAD-CQSZACIVSA-N 2 0 242.407 2.121 20 0 BEADRP CC[C@@H](C[NH2+]C[C@](C)(CC)OC)N1CCCC1 ZINC000638353523 352167639 /nfs/dbraw/zinc/16/76/39/352167639.db2.gz APBFZMRNCQUGEX-KBPBESRZSA-N 2 0 242.407 2.266 20 0 BEADRP C([NH2+]C[C@@H]1C[C@H]2C[C@H]2C1)[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000638358335 352170310 /nfs/dbraw/zinc/17/03/10/352170310.db2.gz CDIOXWAXYKULJA-FQUUOJAGSA-N 2 0 234.387 2.106 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)[C@H]1CC1(F)F ZINC000638361024 352171660 /nfs/dbraw/zinc/17/16/60/352171660.db2.gz ZHTKRSCRDQNMFE-JBLDHEPKSA-N 2 0 244.329 2.104 20 0 BEADRP C[C@@H](CC[NH3+])[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC000414900110 352175289 /nfs/dbraw/zinc/17/52/89/352175289.db2.gz VPBXQIKNADSVNL-UBHSHLNASA-N 2 0 218.344 2.117 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+]C[C@@](C)(CC)OC)C1 ZINC000638408451 352214665 /nfs/dbraw/zinc/21/46/65/352214665.db2.gz BBOPGDHXXBXYLV-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)C[C@H](C)C[N@@H+]1C[C@@H]2CC[C@H]([NH3+])[C@@H]2C1 ZINC000336653156 187647212 /nfs/dbraw/zinc/64/72/12/187647212.db2.gz FZYLVRLPFGTQPB-FQUUOJAGSA-N 2 0 224.392 2.338 20 0 BEADRP CC(C)(C)OCC[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000252761148 538102474 /nfs/dbraw/zinc/10/24/74/538102474.db2.gz XHJKFHXMYOGRDK-OLZOCXBDSA-N 2 0 240.391 2.018 20 0 BEADRP Cn1ccc(C[NH2+]CCCCC[NH+]2CCCC2)c1 ZINC000293003275 180700836 /nfs/dbraw/zinc/70/08/36/180700836.db2.gz NFNFXQQSAATFSD-UHFFFAOYSA-N 2 0 249.402 2.381 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H]1CCCC[C@@H]1OC ZINC000037211031 358470220 /nfs/dbraw/zinc/47/02/20/358470220.db2.gz MFJYQWWYRRLRNP-KBPBESRZSA-N 2 0 242.407 2.266 20 0 BEADRP COc1cccc(C[NH2+]C[C@@H]2CCC[N@H+](C)C2)c1 ZINC000044535869 352352096 /nfs/dbraw/zinc/35/20/96/352352096.db2.gz NUPBDMVZAZSEOO-AWEZNQCLSA-N 2 0 248.370 2.127 20 0 BEADRP CCc1ccc(C[NH2+][C@H]2CC[NH2+][C@@H](C)C2)cc1 ZINC000414944574 352367067 /nfs/dbraw/zinc/36/70/67/352367067.db2.gz HATYUZJYSSWCJI-WFASDCNBSA-N 2 0 232.371 2.479 20 0 BEADRP CC[NH+]1CCC(C[NH2+]C[C@@H]2C[C@H]3C[C@H]3C2)CC1 ZINC000638562697 352387830 /nfs/dbraw/zinc/38/78/30/352387830.db2.gz AVPHCTLNVRCDLU-QDMKHBRRSA-N 2 0 236.403 2.354 20 0 BEADRP Cc1ccc(CC[NH2+]CC2CC[NH+](C)CC2)cc1 ZINC000638567340 352394704 /nfs/dbraw/zinc/39/47/04/352394704.db2.gz ZGHSQYQSUKQEKS-UHFFFAOYSA-N 2 0 246.398 2.469 20 0 BEADRP Fc1cccc(C[NH2+][C@@H]2C[C@H]2C2CC[NH2+]CC2)c1 ZINC000415013963 352550579 /nfs/dbraw/zinc/55/05/79/352550579.db2.gz WCHNOTNRUQLSCQ-LSDHHAIUSA-N 2 0 248.345 2.303 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCC[C@H]([NH3+])C1)c1nccs1 ZINC000300361825 352560303 /nfs/dbraw/zinc/56/03/03/352560303.db2.gz IQMFYHCVYKACOW-OUAUKWLOSA-N 2 0 239.388 2.106 20 0 BEADRP CCOc1cccc(C[NH+]2CCC(C[NH3+])CC2)c1 ZINC000044512288 352653530 /nfs/dbraw/zinc/65/35/30/352653530.db2.gz LOBBWOGKQKJELA-UHFFFAOYSA-N 2 0 248.370 2.256 20 0 BEADRP CCOc1ccc(C[N@@H+]2CCC[C@@H](C[NH3+])C2)cc1 ZINC000044527773 352654478 /nfs/dbraw/zinc/65/44/78/352654478.db2.gz LTWJFRAEQGUMJN-AWEZNQCLSA-N 2 0 248.370 2.256 20 0 BEADRP CSC1(C[NH2+][C@H](C)CN2CCCCC2)CC1 ZINC000304322155 352729796 /nfs/dbraw/zinc/72/97/96/352729796.db2.gz SFSCKUSLIUJYMM-GFCCVEGCSA-N 2 0 242.432 2.346 20 0 BEADRP Cc1c[nH+]ccc1N1CC[NH+](C2CCC2)CC1 ZINC000334184883 352773207 /nfs/dbraw/zinc/77/32/07/352773207.db2.gz DIAQQMIFBINMQZ-UHFFFAOYSA-N 2 0 231.343 2.065 20 0 BEADRP C[C@H]1C[C@H]([NH2+]C2CCC([NH+](C)C)CC2)CCO1 ZINC000334217140 352817736 /nfs/dbraw/zinc/81/77/36/352817736.db2.gz CRQOQLCAKZPSIV-RJZJGCCBSA-N 2 0 240.391 2.016 20 0 BEADRP CC[C@H](C)C[N@@H+]1CC[C@@]2(C1)CCC[NH+](C)C2 ZINC000334217493 352817836 /nfs/dbraw/zinc/81/78/36/352817836.db2.gz HGCXOSIFIKYVRS-KBPBESRZSA-N 2 0 224.392 2.450 20 0 BEADRP Cc1[nH+]ccc(N2CCN(C)C[C@@H]2C)c1Cl ZINC000334336182 352971451 /nfs/dbraw/zinc/97/14/51/352971451.db2.gz RWEHMOKWKWBSEF-VIFPVBQESA-N 2 0 239.750 2.184 20 0 BEADRP C[C@@H]1Cc2ccccc2CN1CC(C)(C)[NH3+] ZINC000334318872 352949433 /nfs/dbraw/zinc/94/94/33/352949433.db2.gz XCTCCTFMUYCBOT-LLVKDONJSA-N 2 0 218.344 2.171 20 0 BEADRP CCC[NH+]1CCC([NH2+]CCC[C@H]2CCO2)CC1 ZINC000638849558 353029837 /nfs/dbraw/zinc/02/98/37/353029837.db2.gz WILLAZUIWMMIQT-AWEZNQCLSA-N 2 0 240.391 2.020 20 0 BEADRP Cc1ccc(CCC[NH2+][C@@H](C)C[C@@H](C)O)cn1 ZINC000354639749 188007975 /nfs/dbraw/zinc/00/79/75/188007975.db2.gz WNURHODOBUSSPD-QWHCGFSZSA-N 2 0 236.359 2.072 20 0 BEADRP CCCCOCC[N@H+](C)CCCn1ccnc1 ZINC000341142379 188043789 /nfs/dbraw/zinc/04/37/89/188043789.db2.gz YAPYPIXWTBQYMS-UHFFFAOYSA-N 2 0 239.363 2.022 20 0 BEADRP CC(C)C[C@H](C)C[N@H+]1C[C@@H]2[NH2+]CCC[C@H]2C1 ZINC000300987393 188043089 /nfs/dbraw/zinc/04/30/89/188043089.db2.gz VBERXDRECRSPLG-IHRRRGAJSA-N 2 0 224.392 2.352 20 0 BEADRP C(C[NH+](CC1CC1)CC1CC1)[C@@H]1CCC[NH2+]C1 ZINC000070505433 188047402 /nfs/dbraw/zinc/04/74/02/188047402.db2.gz DRVVZFOSHUJZLI-ZDUSSCGKSA-N 2 0 236.403 2.498 20 0 BEADRP COc1ccc(C[N@@H+]2CCC[C@@H](CC[NH3+])C2)cc1 ZINC000070533451 188047735 /nfs/dbraw/zinc/04/77/35/188047735.db2.gz RWFPAYTWSTWHSG-ZDUSSCGKSA-N 2 0 248.370 2.256 20 0 BEADRP CC(C)([NH3+])C[NH2+]CCc1ccc(Cl)s1 ZINC000258782894 535210089 /nfs/dbraw/zinc/21/00/89/535210089.db2.gz ISEWWCUXGPMZAY-UHFFFAOYSA-N 2 0 232.780 2.271 20 0 BEADRP C[C@@H]([NH2+]CCC1CC[NH+](C)CC1)C1CC1 ZINC000122062783 324026355 /nfs/dbraw/zinc/02/63/55/324026355.db2.gz OHHGLWDHCONYSS-LLVKDONJSA-N 2 0 210.365 2.106 20 0 BEADRP CCO[C@@H]1C[C@@H]1[NH2+][C@@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000563700099 353274621 /nfs/dbraw/zinc/27/46/21/353274621.db2.gz FQJLFMUTJZYHGI-RFQIPJPRSA-N 2 0 240.391 2.064 20 0 BEADRP CC[N@@H+]1CCC[C@H](C[NH2+][C@H](C)C2CCC2)C1 ZINC000336768278 353279178 /nfs/dbraw/zinc/27/91/78/353279178.db2.gz QSIOFSOHALNVRB-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)([NH3+])C[NH2+]C1C2CC3CC(C2)CC1C3 ZINC000216719974 188232292 /nfs/dbraw/zinc/23/22/92/188232292.db2.gz RLBLHMIZKKOWLJ-UHFFFAOYSA-N 2 0 222.376 2.138 20 0 BEADRP C1CN2CCCC[C@H]2[C@H]1[NH2+]C1CCSCC1 ZINC000036997089 188254779 /nfs/dbraw/zinc/25/47/79/188254779.db2.gz ZEYQMBAQXSVVBQ-STQMWFEESA-N 2 0 240.416 2.098 20 0 BEADRP C(C[N@@H+]1CCC2(CCC2)C1)[C@H]1CCC[NH2+]C1 ZINC000335663574 188256456 /nfs/dbraw/zinc/25/64/56/188256456.db2.gz NVFKDLMGDXQTIX-CYBMUJFWSA-N 2 0 222.376 2.252 20 0 BEADRP C(CC[NH2+][C@@H]1CCSC1)CC[NH+]1CCCC1 ZINC000340474001 188257860 /nfs/dbraw/zinc/25/78/60/188257860.db2.gz GBAUOYIHWLZERD-CYBMUJFWSA-N 2 0 242.432 2.348 20 0 BEADRP CC(C)(CCc1ccccc1)[NH2+]CCC[NH3+] ZINC000126770758 188258176 /nfs/dbraw/zinc/25/81/76/188258176.db2.gz LNERWNQTGWUPSO-UHFFFAOYSA-N 2 0 220.360 2.336 20 0 BEADRP Cc1ccc(F)c(CNC[C@H](C)C[NH+](C)C)c1 ZINC000291706216 188267912 /nfs/dbraw/zinc/26/79/12/188267912.db2.gz KULDLDVSQFMBRG-LBPRGKRZSA-N 2 0 238.350 2.421 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@H](C)[C@H]2CCCO2)CC1 ZINC000020205749 188285219 /nfs/dbraw/zinc/28/52/19/188285219.db2.gz DUTVBASHOSXSQJ-TZMCWYRMSA-N 2 0 240.391 2.016 20 0 BEADRP CC(C)(C)[C@@H]1CC[N@H+](C[C@H]2CCC[NH2+]C2)C1 ZINC000252876158 353313020 /nfs/dbraw/zinc/31/30/20/353313020.db2.gz WCENZTRHPDZKQW-QWHCGFSZSA-N 2 0 224.392 2.354 20 0 BEADRP CN1CCC([NH2+][C@@H](c2cccnc2)C2CC2)CC1 ZINC000358357743 188325228 /nfs/dbraw/zinc/32/52/28/188325228.db2.gz RGVKXRVZRUFXKQ-OAHLLOKOSA-N 2 0 245.370 2.217 20 0 BEADRP CC(C)C[C@H](C)C[N@@H+]1C[C@H](C[NH3+])C[C@@H]1C ZINC000300988782 188336111 /nfs/dbraw/zinc/33/61/11/188336111.db2.gz VEXJHFDRUGUPBX-AVGNSLFASA-N 2 0 212.381 2.338 20 0 BEADRP C(C1CCCCCC1)[NH+]1C[C@@H]2C[NH2+]C[C@H]2C1 ZINC000085282047 538116113 /nfs/dbraw/zinc/11/61/13/538116113.db2.gz VBPQKOQVDGJQBO-KBPBESRZSA-N 2 0 222.376 2.108 20 0 BEADRP C1CC2(CCCC2)[C@@H]1[NH2+]C1CC[NH2+]CC1 ZINC000335010851 188356587 /nfs/dbraw/zinc/35/65/87/188356587.db2.gz RHMZSYORTBYSSK-GFCCVEGCSA-N 2 0 208.349 2.051 20 0 BEADRP C(C[NH2+]C1CCCCC1)C[C@H]1CCC[NH2+]1 ZINC000336771025 188352581 /nfs/dbraw/zinc/35/25/81/188352581.db2.gz XGLQAJPZDAAUAP-ZDUSSCGKSA-N 2 0 210.365 2.441 20 0 BEADRP CC(C)[NH+]1CCC(N(C)Cc2ccccn2)CC1 ZINC000264242085 188370899 /nfs/dbraw/zinc/37/08/99/188370899.db2.gz BPHNBHPFRUEBQO-UHFFFAOYSA-N 2 0 247.386 2.386 20 0 BEADRP C[C@H](c1ccccc1)[N@@H+]1CC[C@@H]([C@H](C)[NH3+])C1 ZINC000059868947 353513077 /nfs/dbraw/zinc/51/30/77/353513077.db2.gz MRWADXJLYWZRTH-OUCADQQQSA-N 2 0 218.344 2.417 20 0 BEADRP CC[C@H]1C[C@H](C)C[N@@H+]1CCCn1ccnc1 ZINC000343306100 353524805 /nfs/dbraw/zinc/52/48/05/353524805.db2.gz UPDMOSXZSHPAFQ-STQMWFEESA-N 2 0 221.348 2.394 20 0 BEADRP C[NH+](C)[C@@H]1CCC[C@H]([NH2+]C[C@@H]2CCSC2)C1 ZINC000336778958 353530208 /nfs/dbraw/zinc/53/02/08/353530208.db2.gz MVFBLAUCWFHLCD-RWMBFGLXSA-N 2 0 242.432 2.202 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+][C@@H]2CCSC2)c2ccccc21 ZINC000231347933 353595563 /nfs/dbraw/zinc/59/55/63/353595563.db2.gz PVMIUVLZYTZYJK-OASPWFOLSA-N 2 0 234.368 2.226 20 0 BEADRP CC[C@@](C)(C[N@@H+]1CCC[C@H]([NH+](C)C)CC1)OC ZINC000639106205 353621610 /nfs/dbraw/zinc/62/16/10/353621610.db2.gz XBUPFOKVWHUAPX-KBPBESRZSA-N 2 0 242.407 2.218 20 0 BEADRP C([NH2+]CC1CC[NH+](C2CC2)CC1)[C@@H]1C[C@H]2C[C@H]2C1 ZINC000639108479 353649688 /nfs/dbraw/zinc/64/96/88/353649688.db2.gz JQXHDDQGBMXWTQ-QDMKHBRRSA-N 2 0 248.414 2.497 20 0 BEADRP CCC[C@H](C[N@@H+]1CCC[C@H]([NH+](C)C)CC1)OC ZINC000639106239 353612852 /nfs/dbraw/zinc/61/28/52/353612852.db2.gz XLRLXKYMIRCJJE-UONOGXRCSA-N 2 0 242.407 2.218 20 0 BEADRP C[C@H](CCC1CC1)[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000398105714 324217851 /nfs/dbraw/zinc/21/78/51/324217851.db2.gz VNABIGHLEMQGTR-DGCLKSJQSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H](c1ccncc1)N(C)C[C@@H]1CCC[NH2+]C1 ZINC000220425229 353836503 /nfs/dbraw/zinc/83/65/03/353836503.db2.gz LUNNIFRTPGFKIL-CHWSQXEVSA-N 2 0 233.359 2.074 20 0 BEADRP C[N@H+](CCC[NH+]1CCCC1)C[C@@H]1CCSC1 ZINC000343610576 353933218 /nfs/dbraw/zinc/93/32/18/353933218.db2.gz YHJFIHWMUYOESA-ZDUSSCGKSA-N 2 0 242.432 2.157 20 0 BEADRP C[C@@H]1CCC[C@H]1C[NH2+]C1CCC([NH3+])CC1 ZINC000230665020 363318570 /nfs/dbraw/zinc/31/85/70/363318570.db2.gz HMAWWJWDYAUJLC-IALDZJHCSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)C1CC(F)(F)C1 ZINC000529548275 324336863 /nfs/dbraw/zinc/33/68/63/324336863.db2.gz KFQZUIFTMAEQBX-GHMZBOCLSA-N 2 0 246.345 2.352 20 0 BEADRP CC[N@H+](CC1CCC1)[C@H]1CCC[NH2+]CC1 ZINC000231671189 363348040 /nfs/dbraw/zinc/34/80/40/363348040.db2.gz QBLDSCHIDPKRGB-ZDUSSCGKSA-N 2 0 210.365 2.251 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CCCC[C@H]2[NH3+])s1 ZINC000334614737 354300279 /nfs/dbraw/zinc/30/02/79/354300279.db2.gz DJCGTBCOJWYRPP-VXGBXAGGSA-N 2 0 224.373 2.416 20 0 BEADRP CCCCC[NH+]1CCC(C[NH+](C)C)CC1 ZINC000344581469 354310106 /nfs/dbraw/zinc/31/01/06/354310106.db2.gz KYRPTBWDWFWBBF-UHFFFAOYSA-N 2 0 212.381 2.450 20 0 BEADRP CC[C@](C)(C[N@H+](C)[C@H]1CCN(C)C[C@@H]1C)OC ZINC000639179543 354272676 /nfs/dbraw/zinc/27/26/76/354272676.db2.gz UCTSGLMUNNYPBY-MELADBBJSA-N 2 0 242.407 2.074 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C[C@H]2CCCN2C)C[C@@H]1C ZINC000623634622 366202059 /nfs/dbraw/zinc/20/20/59/366202059.db2.gz MZSQXECDNBZURN-XJFOESAGSA-N 2 0 224.392 2.495 20 0 BEADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@H](C)C1(C)CC1 ZINC000166033116 354872030 /nfs/dbraw/zinc/87/20/30/354872030.db2.gz NWQMAKFTGQUJOR-CHWSQXEVSA-N 2 0 242.407 2.121 20 0 BEADRP CCC[C@H](C[NH2+][C@H]1CCCC[C@@H]1C[NH3+])OCC ZINC000530206567 324523045 /nfs/dbraw/zinc/52/30/45/324523045.db2.gz APOIPLXOJUFKTD-MCIONIFRSA-N 2 0 242.407 2.299 20 0 BEADRP Cc1ccc(F)c(CN2C[C@@H]3C[N@H+](C)C[C@@H]3C2)c1 ZINC000335192070 355025135 /nfs/dbraw/zinc/02/51/35/355025135.db2.gz GSHOKQQNSVILEH-OKILXGFUSA-N 2 0 248.345 2.128 20 0 BEADRP CCN(Cc1ccc(OC)cc1)CC(C)(C)[NH3+] ZINC000346844711 355134786 /nfs/dbraw/zinc/13/47/86/355134786.db2.gz JQLXANVYOZBIEP-UHFFFAOYSA-N 2 0 236.359 2.254 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@@H]2CCC[NH2+]C2)C[C@@H](C)C1 ZINC000346972748 355208250 /nfs/dbraw/zinc/20/82/50/355208250.db2.gz HXPYBTDNWFWDFX-HZSPNIEDSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@H]1Cc2ccccc2C[N@@H+]1C[C@@H]1CCC[NH2+]C1 ZINC000346975494 355208873 /nfs/dbraw/zinc/20/88/73/355208873.db2.gz JEOZXBLISFPACL-UONOGXRCSA-N 2 0 244.382 2.433 20 0 BEADRP C1CC1[C@H]1CCCC[C@@H]1[NH2+]C1CC[NH2+]CC1 ZINC000335253588 355210525 /nfs/dbraw/zinc/21/05/25/355210525.db2.gz YJCOYMSYPQORNK-KGLIPLIRSA-N 2 0 222.376 2.297 20 0 BEADRP CC[C@]1(C)CCC[N@H+](C[C@H]2CCC[NH2+]C2)C1 ZINC000346977891 355211636 /nfs/dbraw/zinc/21/16/36/355211636.db2.gz NECZOWBPQOIPNF-UONOGXRCSA-N 2 0 224.392 2.498 20 0 BEADRP Fc1ccc2c(c1)C[N@@H+](CC[C@@H]1CC[NH2+]C1)CC2 ZINC000335241755 355176455 /nfs/dbraw/zinc/17/64/55/355176455.db2.gz PPEJIUGAWFHUOI-LBPRGKRZSA-N 2 0 248.345 2.183 20 0 BEADRP C[NH+](C)CCCC(C)(C)[NH2+]CCC[C@H]1CCO1 ZINC000639231812 355191350 /nfs/dbraw/zinc/19/13/50/355191350.db2.gz SMMWNUWCJKVZNK-ZDUSSCGKSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCCC[N@H+](C)C2CC2)CS1 ZINC000639244745 355248580 /nfs/dbraw/zinc/24/85/80/355248580.db2.gz OQLHIIMSVQKORD-VXGBXAGGSA-N 2 0 242.432 2.344 20 0 BEADRP C[NH+](C)C[C@H]1CC[N@H+](CCC(C)(C)C)C1 ZINC000113514766 355250891 /nfs/dbraw/zinc/25/08/91/355250891.db2.gz SFJDRNRTMLBNEJ-GFCCVEGCSA-N 2 0 212.381 2.306 20 0 BEADRP C[NH+](C)C[C@@H]1CC[N@H+](CCC(C)(C)C)C1 ZINC000113514767 355251053 /nfs/dbraw/zinc/25/10/53/355251053.db2.gz SFJDRNRTMLBNEJ-LBPRGKRZSA-N 2 0 212.381 2.306 20 0 BEADRP CCC[C@H](C[NH2+]CC[C@H]1CCC[N@H+](C)C1)OC ZINC000639256577 355299575 /nfs/dbraw/zinc/29/95/75/355299575.db2.gz CQUBRVKMGDWTJC-ZIAGYGMSSA-N 2 0 242.407 2.123 20 0 BEADRP C[N@@H+]1CCC[C@H](CC[NH2+]C[C@@H]2C[C@H]3C[C@H]3C2)C1 ZINC000639256712 355300141 /nfs/dbraw/zinc/30/01/41/355300141.db2.gz DUJPVZQWXUBQDH-APIJFGDWSA-N 2 0 236.403 2.354 20 0 BEADRP CC[NH+](CC)CCOCC[NH2+][C@@H](C)C1CCC1 ZINC000349725612 355420086 /nfs/dbraw/zinc/42/00/86/355420086.db2.gz XRUCBBXNGSSHKE-ZDUSSCGKSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)CC[N@@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1 ZINC000414783683 191567704 /nfs/dbraw/zinc/56/77/04/191567704.db2.gz QIRTVPPXCGCHHO-KGLIPLIRSA-N 2 0 224.392 2.354 20 0 BEADRP Cc1ccc(C[NH2+]CC[C@@H]2CC[NH2+]C2)cc1F ZINC000414830680 191590595 /nfs/dbraw/zinc/59/05/95/191590595.db2.gz MELHRHLHCNHPMN-LBPRGKRZSA-N 2 0 236.334 2.223 20 0 BEADRP C[C@@H]1CCCC[C@H]1[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000414831587 191591155 /nfs/dbraw/zinc/59/11/55/191591155.db2.gz NGIATSBXRZSRMJ-FRRDWIJNSA-N 2 0 210.365 2.154 20 0 BEADRP C1CC1[C@@H]1CCC[C@@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000414831922 191593149 /nfs/dbraw/zinc/59/31/49/191593149.db2.gz QJWSLNRTYNZUIC-AWQNUYMJSA-N 2 0 234.387 2.438 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+][C@@H]2C[C@H]2C2CC[NH2+]CC2)C1 ZINC000415008827 191648403 /nfs/dbraw/zinc/64/84/03/191648403.db2.gz NEJRQJGVXMNHMR-AHLTXXRQSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H](CC[NH3+])[NH2+]Cc1cccc(OC(F)F)c1 ZINC000414887482 191616051 /nfs/dbraw/zinc/61/60/51/191616051.db2.gz QKQYUQYSCZLKJN-SECBINFHSA-N 2 0 244.285 2.115 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@H]2CC[NH2+][C@@H](C)C2)C1 ZINC000414950316 191631809 /nfs/dbraw/zinc/63/18/09/191631809.db2.gz OJRMLVOIYNRJNN-VOAKCMCISA-N 2 0 210.365 2.295 20 0 BEADRP CC(C)OCC(C)(C)[NH2+]C[C@H]1CC[NH2+][C@@H](C)C1 ZINC000415121838 191683719 /nfs/dbraw/zinc/68/37/19/191683719.db2.gz KTHAKAIWYUQCNF-STQMWFEESA-N 2 0 242.407 2.168 20 0 BEADRP Cc1ccccc1C[NH2+][C@H]1CC[C@H](C[NH3+])C1 ZINC000415044501 191661289 /nfs/dbraw/zinc/66/12/89/191661289.db2.gz STQDSMSVOOCWFQ-JSGCOSHPSA-N 2 0 218.344 2.212 20 0 BEADRP [NH3+]CC1CCC([NH2+]Cc2cccc(F)c2)CC1 ZINC000415077602 191672902 /nfs/dbraw/zinc/67/29/02/191672902.db2.gz FOQINWIREWWWJN-UHFFFAOYSA-N 2 0 236.334 2.433 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCN1C(C)(C)C)[C@H]1CC1(F)F ZINC000639302790 355650129 /nfs/dbraw/zinc/65/01/29/355650129.db2.gz ITPPYNBYSDEHCR-HBNTYKKESA-N 2 0 246.345 2.493 20 0 BEADRP Cc1ccc(C[NH+]2CCC(C[NH+](C)C)CC2)nc1 ZINC000350176004 355619730 /nfs/dbraw/zinc/61/97/30/355619730.db2.gz LGWDGDDAQQKBDH-UHFFFAOYSA-N 2 0 247.386 2.164 20 0 BEADRP CCCN1CCC[C@H]1C[NH2+][C@@H](C)CCCOC ZINC000353986612 355747876 /nfs/dbraw/zinc/74/78/76/355747876.db2.gz JZTGXDZHBUIQAE-KBPBESRZSA-N 2 0 242.407 2.266 20 0 BEADRP COC[C@H](C)[NH+]1CCC(C[N@H+](C)C(C)C)CC1 ZINC000608494921 355820764 /nfs/dbraw/zinc/82/07/64/355820764.db2.gz LXSKKLBSEFKDAW-ZDUSSCGKSA-N 2 0 242.407 2.074 20 0 BEADRP Cc1ccc(CN(C)C2CC[NH2+]CC2)cc1F ZINC000336053436 134060948 /nfs/dbraw/zinc/06/09/48/134060948.db2.gz WUFKVHROYQXYFO-UHFFFAOYSA-N 2 0 236.334 2.318 20 0 BEADRP C[C@@H]1C[C@H](C)[C@H](C)[N@H+](C[C@@H]2CCC[NH2+]C2)C1 ZINC000166716303 355829231 /nfs/dbraw/zinc/82/92/31/355829231.db2.gz LESAHKZIPUPBGK-ZOBORPQBSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H](CC[N@@H+]1CC[C@@H](C[NH3+])C1)c1ccccc1 ZINC000216161056 355910949 /nfs/dbraw/zinc/91/09/49/355910949.db2.gz KRYJPHUVKDNLFB-KBPBESRZSA-N 2 0 232.371 2.461 20 0 BEADRP CCC1([NH+](C)C)CC[NH+](C[C@@H]2C[C@@H]2C)CC1 ZINC000639378190 355911020 /nfs/dbraw/zinc/91/10/20/355911020.db2.gz FAHVPWONPKWEMS-STQMWFEESA-N 2 0 224.392 2.449 20 0 BEADRP C[C@H]1CC(C)(C)C[C@H]1[NH2+]CCC[NH+](C)C ZINC000192390006 355982101 /nfs/dbraw/zinc/98/21/01/355982101.db2.gz YPEYTFWNVHSKKB-NWDGAFQWSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CC[C@H](Oc2ccncc2)C1 ZINC000351471952 355996115 /nfs/dbraw/zinc/99/61/15/355996115.db2.gz NIIQRMBMUPKVHS-BZPMIXESSA-N 2 0 232.327 2.191 20 0 BEADRP CCC(C)(C)CC[N@@H+]1C[C@@H]2CC[C@H]([NH3+])[C@H]2C1 ZINC000351494623 356001968 /nfs/dbraw/zinc/00/19/68/356001968.db2.gz OLTYAYQOPFGGGH-AVGNSLFASA-N 2 0 224.392 2.482 20 0 BEADRP CCN1CC[C@H]2CC[C@@H](C1)[N@@H+]2C[C@@H]1C[C@H]1C ZINC000351232413 355965012 /nfs/dbraw/zinc/96/50/12/355965012.db2.gz XWSUUNCHDFJHKY-RQJABVFESA-N 2 0 222.376 2.201 20 0 BEADRP Cc1ccc(C[C@@H]2CCC[N@H+]2C[C@@H](C)[NH3+])cc1 ZINC000420298200 192204262 /nfs/dbraw/zinc/20/42/62/192204262.db2.gz GZTWYGZGJVVCHT-HIFRSBDPSA-N 2 0 232.371 2.349 20 0 BEADRP CCc1cccc(C[N@@H+]2CC[C@@H](C[NH2+]C)C2)c1 ZINC000420297065 192204688 /nfs/dbraw/zinc/20/46/88/192204688.db2.gz QVVIJBGNEFSLDM-HNNXBMFYSA-N 2 0 232.371 2.290 20 0 BEADRP C[C@H](C1CC1)[N@H+](CC[C@H]1CC[NH2+]C1)C1CC1 ZINC000420300004 192206506 /nfs/dbraw/zinc/20/65/06/192206506.db2.gz GYGXXYQIUXBBIK-VXGBXAGGSA-N 2 0 222.376 2.249 20 0 BEADRP CC[N@H+](CCOCC(C)C)[C@H]1CCC[NH2+]CC1 ZINC000420319550 192195306 /nfs/dbraw/zinc/19/53/06/192195306.db2.gz XRXUTRAEALSINY-AWEZNQCLSA-N 2 0 242.407 2.123 20 0 BEADRP CCc1cccc(C[N@H+](C)C2CC[NH2+]CC2)c1 ZINC000420278447 192198411 /nfs/dbraw/zinc/19/84/11/192198411.db2.gz VQBFWKCFAHCMOU-UHFFFAOYSA-N 2 0 232.371 2.433 20 0 BEADRP c1cc(C[NH+]2CCC3(CC[NH2+]C3)CC2)cs1 ZINC000336129206 134093825 /nfs/dbraw/zinc/09/38/25/134093825.db2.gz UCMFBMMZANWCRY-UHFFFAOYSA-N 2 0 236.384 2.324 20 0 BEADRP C[N@H+](CC[C@@H]1CC[NH2+]C1)C1Cc2ccccc2C1 ZINC000420303522 192206647 /nfs/dbraw/zinc/20/66/47/192206647.db2.gz KMZDCWKHADVWBW-ZDUSSCGKSA-N 2 0 244.382 2.085 20 0 BEADRP CC(C)[N@H+](CC[C@H]1CCC[NH2+]C1)C1CC1 ZINC000420301728 192206714 /nfs/dbraw/zinc/20/67/14/192206714.db2.gz IXLRBYULZNJEGU-GFCCVEGCSA-N 2 0 210.365 2.249 20 0 BEADRP CCc1cccc(C[N@@H+]2CC[C@H]([C@@H](C)[NH3+])C2)c1 ZINC000420302423 192206720 /nfs/dbraw/zinc/20/67/20/192206720.db2.gz GAXPOEPHCSXRPQ-DOMZBBRYSA-N 2 0 232.371 2.418 20 0 BEADRP C[NH2+]CC1CC[NH+](Cc2ccc(C)nc2C)CC1 ZINC000420291761 192202925 /nfs/dbraw/zinc/20/29/25/192202925.db2.gz KSBWTVAUSFZTKZ-UHFFFAOYSA-N 2 0 247.386 2.130 20 0 BEADRP CC[C@@]1(C)CCC[N@H+](CC[C@H]2CC[NH2+]C2)C1 ZINC000420313589 192213483 /nfs/dbraw/zinc/21/34/83/192213483.db2.gz YDEUDSHVFBQQLP-KGLIPLIRSA-N 2 0 224.392 2.498 20 0 BEADRP COc1ccccc1[C@H](C)[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000420371678 192215205 /nfs/dbraw/zinc/21/52/05/192215205.db2.gz KWQVAWZESSFEDQ-QWHCGFSZSA-N 2 0 248.370 2.345 20 0 BEADRP C[N@H+](CCCCC(F)(F)F)C1CC([NH3+])C1 ZINC000420340804 192216508 /nfs/dbraw/zinc/21/65/08/192216508.db2.gz ULOSNRWHHKRJAL-UHFFFAOYSA-N 2 0 224.270 2.141 20 0 BEADRP C(C[N@@H+]1CCC[C@@H]1C1CCC1)[C@@H]1CC[NH2+]C1 ZINC000420306638 192209783 /nfs/dbraw/zinc/20/97/83/192209783.db2.gz QREMSUZPLMMJRH-GXTWGEPZSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@H]([NH3+])C[N@@H+]1CC[C@@H](Cc2ccccc2)[C@@H]1C ZINC000420310956 192210406 /nfs/dbraw/zinc/21/04/06/192210406.db2.gz VMAGIFXIGLEBBK-YDHLFZDLSA-N 2 0 232.371 2.287 20 0 BEADRP C[C@H]([NH3+])C[N@@H+]1CC[C@H](Cc2ccccc2)[C@@H]1C ZINC000420310955 192210512 /nfs/dbraw/zinc/21/05/12/192210512.db2.gz VMAGIFXIGLEBBK-KCQAQPDRSA-N 2 0 232.371 2.287 20 0 BEADRP CC(C)[C@H]1C[N@H+](CC[C@H]2CC[NH2+]C2)CCS1 ZINC000420314102 192212249 /nfs/dbraw/zinc/21/22/49/192212249.db2.gz YSVUWFCXCCTVGV-CHWSQXEVSA-N 2 0 242.432 2.059 20 0 BEADRP COc1ccc([C@H](C[NH3+])C[N@@H+]2CC[C@@H](C)C2)cc1 ZINC000420317669 192212966 /nfs/dbraw/zinc/21/29/66/192212966.db2.gz NPZDNQOBOLFFPA-TZMCWYRMSA-N 2 0 248.370 2.079 20 0 BEADRP CC(C)[N@H+](CC[C@H]1CC[NH2+]C1)CC1CCC1 ZINC000420370553 192228005 /nfs/dbraw/zinc/22/80/05/192228005.db2.gz JNYQRZWIKNHAGC-CYBMUJFWSA-N 2 0 224.392 2.497 20 0 BEADRP COc1cccc(CCC[N@H+](C)C2CC([NH3+])C2)c1 ZINC000420326262 192229240 /nfs/dbraw/zinc/22/92/40/192229240.db2.gz DSJFKQDERILQHO-UHFFFAOYSA-N 2 0 248.370 2.049 20 0 BEADRP CC[N@H+](C[C@H](C[NH3+])c1ccc(OC)cc1)C1CC1 ZINC000420326243 192230389 /nfs/dbraw/zinc/23/03/89/192230389.db2.gz XAMRXKFARCAMPQ-ZDUSSCGKSA-N 2 0 248.370 2.222 20 0 BEADRP C[C@@H]1CCCC[N@H+](CC[C@H]2CCC[NH2+]C2)C1 ZINC000420364054 192223497 /nfs/dbraw/zinc/22/34/97/192223497.db2.gz CLTBCXGPIAAXRB-ZIAGYGMSSA-N 2 0 224.392 2.498 20 0 BEADRP c1cc([C@H]2CCC[N@H+]2CC[C@H]2CC[NH2+]C2)ccn1 ZINC000420363490 192224301 /nfs/dbraw/zinc/22/43/01/192224301.db2.gz PHBXAVVNPDHRNG-UKRRQHHQSA-N 2 0 245.370 2.218 20 0 BEADRP NC[C@@H]([NH2+]Cc1cccc(N)c1)C1CCCCC1 ZINC000420364694 192224372 /nfs/dbraw/zinc/22/43/72/192224372.db2.gz KNDGLRPDUMGEJE-OAHLLOKOSA-N 2 0 247.386 2.266 20 0 BEADRP CCCC[NH+]1CCC([C@H]2C[C@@H]([NH3+])CCO2)CC1 ZINC000420383141 192234555 /nfs/dbraw/zinc/23/45/55/192234555.db2.gz FEOWEDCDRSLDBO-UONOGXRCSA-N 2 0 240.391 2.005 20 0 BEADRP C[NH2+]CCC[N@H+](C)CCCc1cccc(F)c1 ZINC000420383746 192235601 /nfs/dbraw/zinc/23/56/01/192235601.db2.gz CINKMBJAWQCALW-UHFFFAOYSA-N 2 0 238.350 2.300 20 0 BEADRP CN(CC[NH3+])CCSc1ccc(Cl)cc1 ZINC000420390774 192236136 /nfs/dbraw/zinc/23/61/36/192236136.db2.gz ZVQQURXDBXENJA-UHFFFAOYSA-N 2 0 244.791 2.323 20 0 BEADRP CCSCC[N@@H+]1CCCC[C@H]1[C@@H]1CC[NH2+]C1 ZINC000420396046 192236572 /nfs/dbraw/zinc/23/65/72/192236572.db2.gz LMJMOSBNDFBCIT-OLZOCXBDSA-N 2 0 242.432 2.204 20 0 BEADRP CCSCC[N@@H+]1CCCC[C@@H]1[C@H]1CC[NH2+]C1 ZINC000420396047 192237541 /nfs/dbraw/zinc/23/75/41/192237541.db2.gz LMJMOSBNDFBCIT-QWHCGFSZSA-N 2 0 242.432 2.204 20 0 BEADRP CC(C)[N@H+](C)CC1CC[NH+](CC2CC2)CC1 ZINC000532421422 356420262 /nfs/dbraw/zinc/42/02/62/356420262.db2.gz FRWGGLNYKMBWEL-UHFFFAOYSA-N 2 0 224.392 2.449 20 0 BEADRP [NH3+]CCC[NH2+][C@@H](C[C@H]1CCOC1)c1ccccc1 ZINC000420410981 192239216 /nfs/dbraw/zinc/23/92/16/192239216.db2.gz RNOONDRPFTYVAV-HIFRSBDPSA-N 2 0 248.370 2.093 20 0 BEADRP CC(C)CC[C@H]1CCC[C@H]1[NH2+]CCOCC[NH3+] ZINC000420417314 192240448 /nfs/dbraw/zinc/24/04/48/192240448.db2.gz WIVFRPFLJZHNED-ZIAGYGMSSA-N 2 0 242.407 2.156 20 0 BEADRP CC(C)CC[C@@H]1CCC[C@@H]1[NH2+]CCOCC[NH3+] ZINC000420417311 192240562 /nfs/dbraw/zinc/24/05/62/192240562.db2.gz WIVFRPFLJZHNED-KBPBESRZSA-N 2 0 242.407 2.156 20 0 BEADRP CCOc1ccccc1CN1CCC([NH3+])CC1 ZINC000020521654 356489195 /nfs/dbraw/zinc/48/91/95/356489195.db2.gz YCAIZWQAKZVILB-UHFFFAOYSA-N 2 0 234.343 2.008 20 0 BEADRP CCCCOCC[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000249904792 535312811 /nfs/dbraw/zinc/31/28/11/535312811.db2.gz XTPIKNBNZCNBEZ-KGLIPLIRSA-N 2 0 240.391 2.020 20 0 BEADRP CCCCOCC[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@H]1C ZINC000249613224 535313331 /nfs/dbraw/zinc/31/33/31/535313331.db2.gz IFZFBRCSFFJZCR-HZSPNIEDSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CC1(CCO)CCCCC1 ZINC000423004106 192534401 /nfs/dbraw/zinc/53/44/01/192534401.db2.gz JEHYATRNTVCSMV-CHWSQXEVSA-N 2 0 242.407 2.035 20 0 BEADRP C[C@H]([NH2+]CC1C2CC3CC(C2)CC1C3)C1C[NH2+]C1 ZINC000422989776 192520628 /nfs/dbraw/zinc/52/06/28/192520628.db2.gz MMBSVLBSSPRZCD-BSTQEOMGSA-N 2 0 248.414 2.256 20 0 BEADRP [NH3+]CC1CCC([NH2+]CCCc2ccccn2)CC1 ZINC000422998102 192521963 /nfs/dbraw/zinc/52/19/63/192521963.db2.gz PQCZKIPYYWBHPS-UHFFFAOYSA-N 2 0 247.386 2.121 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]CCCc1ccccn1 ZINC000422994485 192522162 /nfs/dbraw/zinc/52/21/62/192522162.db2.gz HVWWTTNLNQOXOJ-ZFWWWQNUSA-N 2 0 247.386 2.121 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]C1CCC1 ZINC000422959098 192527197 /nfs/dbraw/zinc/52/71/97/192527197.db2.gz QQOANXAMAUJHSJ-VIFPVBQESA-N 2 0 219.332 2.052 20 0 BEADRP CC[C@H]([NH2+]CCCC[NH+](C)C)[C@@H]1C[C@H]1C ZINC000321084399 259468339 /nfs/dbraw/zinc/46/83/39/259468339.db2.gz MGYZQQPJGYRCMS-UPJWGTAASA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H]([NH2+]CC(C)(C)C1CCCC1)C1C[NH2+]C1 ZINC000423004705 192534841 /nfs/dbraw/zinc/53/48/41/192534841.db2.gz PUMQKZXDROWBES-LLVKDONJSA-N 2 0 224.392 2.400 20 0 BEADRP CCc1ccc(C[NH+]2CCC([NH3+])CC2)cc1 ZINC000026514588 363537854 /nfs/dbraw/zinc/53/78/54/363537854.db2.gz HETRVFJPFYYPMP-UHFFFAOYSA-N 2 0 218.344 2.172 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CCC1(F)CCC1 ZINC000423101049 192567183 /nfs/dbraw/zinc/56/71/83/192567183.db2.gz CGWZDCSMONCZPL-LLVKDONJSA-N 2 0 216.344 2.376 20 0 BEADRP CO[C@H]1CCCC[C@@H]1[NH2+][C@H](C)CCCC[NH3+] ZINC000423109520 192571193 /nfs/dbraw/zinc/57/11/93/192571193.db2.gz HLARJZUWOGBQBA-AGIUHOORSA-N 2 0 228.380 2.051 20 0 BEADRP CC[C@H]([NH2+]CCCC[NH+](C)C)[C@H]1C[C@H]1C ZINC000321084397 259468556 /nfs/dbraw/zinc/46/85/56/259468556.db2.gz MGYZQQPJGYRCMS-AGIUHOORSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CCC2(C1)CC[NH+](C)CC2 ZINC000639757066 356664252 /nfs/dbraw/zinc/66/42/52/356664252.db2.gz FANOKISXSYABJS-CHWSQXEVSA-N 2 0 222.376 2.060 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCC2(C1)CC[NH+](C)CC2 ZINC000639758874 356669614 /nfs/dbraw/zinc/66/96/14/356669614.db2.gz YADCCLDJCUREBW-ZDUSSCGKSA-N 2 0 224.392 2.450 20 0 BEADRP [NH3+]CCCC[NH2+][C@@H]1Cc2ccc(Cl)cc2C1 ZINC000168082440 134156009 /nfs/dbraw/zinc/15/60/09/134156009.db2.gz VDYCIKIAFHFMEC-CYBMUJFWSA-N 2 0 238.762 2.136 20 0 BEADRP CCc1cc(N[C@H]2C[C@@H](C)[N@@H+](C3CC3)C2)cc[nH+]1 ZINC000450373552 202144401 /nfs/dbraw/zinc/14/44/01/202144401.db2.gz CSHDLHDSVVURMK-RISCZKNCSA-N 2 0 245.370 2.103 20 0 BEADRP CC[C@@H]1CCC[N@H+](CCC2CC[NH2+]CC2)C1 ZINC000036169798 356706874 /nfs/dbraw/zinc/70/68/74/356706874.db2.gz SYOPIZOXFYVSRG-CYBMUJFWSA-N 2 0 224.392 2.498 20 0 BEADRP CC(C)[C@H]1C[C@H](C[NH2+][C@@H](C)C[C@H](C)[NH3+])CCO1 ZINC000423150123 192590909 /nfs/dbraw/zinc/59/09/09/192590909.db2.gz IDHWOQQVYMLGDS-IGQOVBAYSA-N 2 0 242.407 2.153 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623357485 356794904 /nfs/dbraw/zinc/79/49/04/356794904.db2.gz RIPIJAAQJCFTGN-UTUOFQBUSA-N 2 0 210.365 2.105 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+]CC1(C2CCC2)CCC1 ZINC000423164442 192600530 /nfs/dbraw/zinc/60/05/30/192600530.db2.gz OQWCZHBKBUPTIA-QWHCGFSZSA-N 2 0 222.376 2.426 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CC[C@H]2CCCO2)CC1(C)C ZINC000623353642 356781540 /nfs/dbraw/zinc/78/15/40/356781540.db2.gz SCFYAGVAKYUVQI-QWHCGFSZSA-N 2 0 240.391 2.018 20 0 BEADRP CO[C@H]1c2ccccc2C[C@H]1[NH2+][C@H](C)CCC[NH3+] ZINC000423171034 192605298 /nfs/dbraw/zinc/60/52/98/192605298.db2.gz NFHKYAVTXKPBIP-DFBGVHRSSA-N 2 0 248.370 2.016 20 0 BEADRP CC1CC[NH+](C[C@H]2CCCC[NH2+]C2)CC1 ZINC000257697700 538745682 /nfs/dbraw/zinc/74/56/82/538745682.db2.gz WTKRACINYKJLPB-ZDUSSCGKSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@H](NC1CC[NH+](C2CCC2)CC1)c1ncc[nH]1 ZINC000353499246 538746313 /nfs/dbraw/zinc/74/63/13/538746313.db2.gz CNZQSXOJFJGKPY-NSHDSACASA-N 2 0 248.374 2.077 20 0 BEADRP Cc1ccc2c(c1)OCCC[C@H]2[NH2+]CCC[NH3+] ZINC000423190306 192616510 /nfs/dbraw/zinc/61/65/10/192616510.db2.gz NNDRITJPHQTUGT-CYBMUJFWSA-N 2 0 234.343 2.147 20 0 BEADRP CCc1ccc(C[N@@H+]2CCC[C@H](C[NH3+])C2)s1 ZINC000019843415 356901590 /nfs/dbraw/zinc/90/15/90/356901590.db2.gz ZHOBWWOMZJERAV-LLVKDONJSA-N 2 0 238.400 2.481 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1CCc2ccc(F)cc21 ZINC000423198105 192622957 /nfs/dbraw/zinc/62/29/57/192622957.db2.gz DDKALDFGVUWTRU-CYBMUJFWSA-N 2 0 222.307 2.012 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H](c1ccc(F)cc1)C1CC1 ZINC000423199187 192623339 /nfs/dbraw/zinc/62/33/39/192623339.db2.gz JMIDWJJTYXLNGC-CQSZACIVSA-N 2 0 236.334 2.476 20 0 BEADRP CCC(C)(C)CC[N@@H+]1CC[C@@H]([C@@H](C)[NH3+])C1 ZINC000261550466 535351033 /nfs/dbraw/zinc/35/10/33/535351033.db2.gz PLYFTMNKMOBEGE-VXGBXAGGSA-N 2 0 212.381 2.482 20 0 BEADRP C[C@@H]1CC(C)(C)C[C@@H]1[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000423202647 192626460 /nfs/dbraw/zinc/62/64/60/192626460.db2.gz BIDKTDBFGDOCNU-UPJWGTAASA-N 2 0 224.392 2.400 20 0 BEADRP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+]CC2(C)CC2)C1 ZINC000389984732 357079062 /nfs/dbraw/zinc/07/90/62/357079062.db2.gz LJOGETHPNYEUDO-VXGBXAGGSA-N 2 0 210.365 2.249 20 0 BEADRP CC(F)(F)CCC[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000390253073 357087868 /nfs/dbraw/zinc/08/78/68/357087868.db2.gz VDOYEDZLOUYLNI-UWVGGRQHSA-N 2 0 220.307 2.281 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCC[NH2+]C1)c1ccco1 ZINC000423255431 192654966 /nfs/dbraw/zinc/65/49/66/192654966.db2.gz CBRLDXCQFSXJGX-NWDGAFQWSA-N 2 0 222.332 2.320 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CCC[NH2+]C1)C1(C)CC1 ZINC000423255539 192655277 /nfs/dbraw/zinc/65/52/77/192655277.db2.gz CCVVBXIWMLJLIY-VXGBXAGGSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CCC[NH2+]C1)C(C)(C)C ZINC000423261918 192658340 /nfs/dbraw/zinc/65/83/40/192658340.db2.gz TYAZJGGPCBPWBW-VXGBXAGGSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@H](CN)C1CCCCC1 ZINC000423262185 192658060 /nfs/dbraw/zinc/65/80/60/192658060.db2.gz LYEAELALORBXBM-GXTWGEPZSA-N 2 0 241.423 2.001 20 0 BEADRP COc1cccc([C@@H](C)[NH2+]CC[C@@H]2CC[NH2+]C2)c1 ZINC000423250181 192651325 /nfs/dbraw/zinc/65/13/25/192651325.db2.gz PYCGCZCLLANNOM-OLZOCXBDSA-N 2 0 248.370 2.345 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]CC2(C3CC3)CCC2)C1 ZINC000391456082 357130176 /nfs/dbraw/zinc/13/01/76/357130176.db2.gz JHTMPBHZVAIUHY-STQMWFEESA-N 2 0 222.376 2.426 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+][C@@H](C)CCCc1cccnc1 ZINC000423274168 192667225 /nfs/dbraw/zinc/66/72/25/192667225.db2.gz LMVNKUUYRSXIIJ-ZFWWWQNUSA-N 2 0 249.402 2.366 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CCc2ccccc21 ZINC000423280977 192673076 /nfs/dbraw/zinc/67/30/76/192673076.db2.gz VDDNNUPBQLODLY-SMDDNHRTSA-N 2 0 218.344 2.119 20 0 BEADRP CC[C@H]([NH2+]CC1CC[NH2+]CC1)[C@H]1C[C@H]1C ZINC000582540534 357338443 /nfs/dbraw/zinc/33/84/43/357338443.db2.gz SRJSSEWORPFYSQ-WXHSDQCUSA-N 2 0 210.365 2.010 20 0 BEADRP CC[C@H]1CCC[C@H](C[N@H+](C)CCC[NH3+])C1 ZINC000394504803 357363200 /nfs/dbraw/zinc/36/32/00/357363200.db2.gz FCASSFUWLJELPC-STQMWFEESA-N 2 0 212.381 2.483 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H](C)CCCc1cccnc1 ZINC000582779475 357390391 /nfs/dbraw/zinc/39/03/91/357390391.db2.gz IDSRKLFWKOZXFF-AWEZNQCLSA-N 2 0 249.402 2.382 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]CCOC(C)(C)C)CC1 ZINC000395778491 357456343 /nfs/dbraw/zinc/45/63/43/357456343.db2.gz WYJBTURODHOILG-UHFFFAOYSA-N 2 0 242.407 2.264 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCC[C@H]([NH3+])C1)CC(F)(F)F ZINC000396919801 357486615 /nfs/dbraw/zinc/48/66/15/357486615.db2.gz XUPDRWOPZDZLRH-LPEHRKFASA-N 2 0 238.297 2.434 20 0 BEADRP Cc1cnccc1C[N@@H+]1C[C@H](C[NH3+])[C@H](C)C[C@H]1C ZINC000397487374 357515633 /nfs/dbraw/zinc/51/56/33/357515633.db2.gz WHIJTFVAPMHXQS-KYOSRNDESA-N 2 0 247.386 2.195 20 0 BEADRP C[C@H]([NH2+]CCC1CC1)C1CC[NH+](C)CC1 ZINC000083893692 491112768 /nfs/dbraw/zinc/11/27/68/491112768.db2.gz QYCOHXHMNVVMGT-NSHDSACASA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]([NH2+]CC1CC[NH2+]CC1)[C@@H]1CC1(C)C ZINC000397757178 357675463 /nfs/dbraw/zinc/67/54/63/357675463.db2.gz DGUXIIHDMTZIRT-JQWIXIFHSA-N 2 0 210.365 2.010 20 0 BEADRP CC[NH+](CC)CCC[N@H+](C)[C@H](CO)C(C)(C)C ZINC000189930638 357676344 /nfs/dbraw/zinc/67/63/44/357676344.db2.gz LGTXDMMDFNTHKC-CYBMUJFWSA-N 2 0 244.423 2.057 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+][C@H]1CCCC(C)(C)C1 ZINC000234700468 357826318 /nfs/dbraw/zinc/82/63/18/357826318.db2.gz FZOLRVPOVZCANT-STQMWFEESA-N 2 0 242.407 2.299 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+][C@H]1CCCCC1(C)C ZINC000234753764 357827275 /nfs/dbraw/zinc/82/72/75/357827275.db2.gz AGOPRHCJHJJYRG-OLZOCXBDSA-N 2 0 242.407 2.299 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+][C@@H]1CCC[C@@H](C)CC1 ZINC000234806801 357830700 /nfs/dbraw/zinc/83/07/00/357830700.db2.gz SZHOXNSTORKSAP-MCIONIFRSA-N 2 0 242.407 2.299 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+][C@@H]1CC[C@@H](C)[C@@H](C)C1 ZINC000234808167 357831867 /nfs/dbraw/zinc/83/18/67/357831867.db2.gz ITTNISJUAFSAHK-RQJABVFESA-N 2 0 242.407 2.155 20 0 BEADRP C[C@@H](CCc1ccccc1)[NH2+]C[C@H]1CCC[NH2+]1 ZINC000235099889 357847889 /nfs/dbraw/zinc/84/78/89/357847889.db2.gz TZQRLYFZWULRPA-DZGCQCFKSA-N 2 0 232.371 2.349 20 0 BEADRP CC(C)[NH2+]CCC[NH2+][C@H]1CC[C@H]1C(C)C ZINC000583316293 357898309 /nfs/dbraw/zinc/89/83/09/357898309.db2.gz FOGQWMHTUOMUTO-STQMWFEESA-N 2 0 212.381 2.399 20 0 BEADRP CC(C)[NH2+]CCC[NH2+][C@@H]1CC[C@H]1C(C)C ZINC000583316292 357898355 /nfs/dbraw/zinc/89/83/55/357898355.db2.gz FOGQWMHTUOMUTO-QWHCGFSZSA-N 2 0 212.381 2.399 20 0 BEADRP CCOCCC[NH+]1CCC(CC)([NH+](C)C)CC1 ZINC000640018282 358080662 /nfs/dbraw/zinc/08/06/62/358080662.db2.gz SRBYBAMVCKBDKL-UHFFFAOYSA-N 2 0 242.407 2.219 20 0 BEADRP CSCCC[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000169242044 134250237 /nfs/dbraw/zinc/25/02/37/134250237.db2.gz ROIQVIAFHNZAHT-CHWSQXEVSA-N 2 0 236.384 2.474 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H](C)c1ccc(F)cc1 ZINC000584774235 358175093 /nfs/dbraw/zinc/17/50/93/358175093.db2.gz HSMPVMWLDSZNGQ-NSHDSACASA-N 2 0 224.323 2.476 20 0 BEADRP CC[C@@H]1CCC[C@H]1[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000388621079 358182369 /nfs/dbraw/zinc/18/23/69/358182369.db2.gz HGSIIDFDJUXJJO-JHJVBQTASA-N 2 0 210.365 2.297 20 0 BEADRP COCC(C)(C)CCC[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000584848881 358208778 /nfs/dbraw/zinc/20/87/78/358208778.db2.gz ATNLSMRELIWWCA-OLZOCXBDSA-N 2 0 242.407 2.299 20 0 BEADRP CC[NH+]1CCC(C[NH2+]C[C@@H]2CCSC2)CC1 ZINC000224405800 358232954 /nfs/dbraw/zinc/23/29/54/358232954.db2.gz MERFHNGRVOJQJQ-ZDUSSCGKSA-N 2 0 242.432 2.061 20 0 BEADRP CCc1ccc(C[NH2+]CC[C@@H]2CC[NH2+]C2)s1 ZINC000225370897 358240043 /nfs/dbraw/zinc/24/00/43/358240043.db2.gz XTNOKFWEEBXPBO-NSHDSACASA-N 2 0 238.400 2.400 20 0 BEADRP CCc1ccc(C[NH2+]C[C@H](C)C[NH2+]C)s1 ZINC000225373593 358240743 /nfs/dbraw/zinc/24/07/43/358240743.db2.gz SFJPZKHVMMAGCS-SNVBAGLBSA-N 2 0 226.389 2.256 20 0 BEADRP CC(C)OCCCC[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000224969675 358242069 /nfs/dbraw/zinc/24/20/69/358242069.db2.gz KUSBPPIWHCNXCD-CHWSQXEVSA-N 2 0 228.380 2.051 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@@H]([NH3+])C[C@H]2C)s1 ZINC000226959824 358346608 /nfs/dbraw/zinc/34/66/08/358346608.db2.gz XDFPYVIBHICQNK-MWLCHTKSSA-N 2 0 224.373 2.368 20 0 BEADRP Cc1ccccc1C[N@H+]1CC[C@H]([NH3+])C[C@H]1C ZINC000226878741 358346929 /nfs/dbraw/zinc/34/69/29/358346929.db2.gz PRFUTTUEDNVVQT-OCCSQVGLSA-N 2 0 218.344 2.307 20 0 BEADRP CCc1ccc(C[N@@H+]2CC[C@@H]([NH3+])[C@@H](C)C2)s1 ZINC000227057426 358347447 /nfs/dbraw/zinc/34/74/47/358347447.db2.gz BPPVLRLHXLUTFQ-GXFFZTMASA-N 2 0 238.400 2.480 20 0 BEADRP CCCCC[N@@H+]1CC[C@H](C[NH+](C)CC)C1 ZINC000173891605 134278590 /nfs/dbraw/zinc/27/85/90/134278590.db2.gz FFTXQXQPLMJDOY-CYBMUJFWSA-N 2 0 212.381 2.450 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@@H](C)C2(C)CC2)CC1 ZINC000044517663 358388696 /nfs/dbraw/zinc/38/86/96/358388696.db2.gz KNKLDMGHMGWSFB-LBPRGKRZSA-N 2 0 224.392 2.497 20 0 BEADRP CC[NH+]1CCC(C[NH2+]C2CCCC2)CC1 ZINC000044517345 358388830 /nfs/dbraw/zinc/38/88/30/358388830.db2.gz NZYAYVRKZWSZBR-UHFFFAOYSA-N 2 0 210.365 2.251 20 0 BEADRP CC[NH+]1CCC(C[NH2+]CC(C)(C)C)CC1 ZINC000044517886 358388961 /nfs/dbraw/zinc/38/89/61/358388961.db2.gz QPFMQRHCBGSKDI-UHFFFAOYSA-N 2 0 212.381 2.354 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH2+]C2Cc3ccccc3C2)C1 ZINC000044533421 358390110 /nfs/dbraw/zinc/39/01/10/358390110.db2.gz ZXQMJJDWXIIQIJ-ZDUSSCGKSA-N 2 0 244.382 2.085 20 0 BEADRP CC[NH+]1CCC(N(C)Cc2ccco2)CC1 ZINC000125261097 358536142 /nfs/dbraw/zinc/53/61/42/358536142.db2.gz ARAXYCQGCPSJMM-UHFFFAOYSA-N 2 0 222.332 2.196 20 0 BEADRP CCOC[C@@H](C)[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000130579702 358632521 /nfs/dbraw/zinc/63/25/21/358632521.db2.gz CCSOYYORJLJEPD-GFCCVEGCSA-N 2 0 242.407 2.264 20 0 BEADRP C[C@@H](CC[NH3+])[NH2+]Cc1ccc(OC(F)F)cc1 ZINC000131242918 358666822 /nfs/dbraw/zinc/66/68/22/358666822.db2.gz XXBJAKDOOOFXBK-VIFPVBQESA-N 2 0 244.285 2.115 20 0 BEADRP CC(C)CSCC[NH2+][C@H]1CC[N@H+](C)C[C@@H]1C ZINC000131530540 358681020 /nfs/dbraw/zinc/68/10/20/358681020.db2.gz XIZBWKOUULTOOD-STQMWFEESA-N 2 0 244.448 2.305 20 0 BEADRP FCCC[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000133774142 358767269 /nfs/dbraw/zinc/76/72/69/358767269.db2.gz LRHXNOIBNDIKER-CYBMUJFWSA-N 2 0 228.355 2.154 20 0 BEADRP CC(C)Oc1cccc(C[NH2+][C@H](C)CC[NH3+])c1 ZINC000136138101 358865249 /nfs/dbraw/zinc/86/52/49/358865249.db2.gz KSQJLJYDYLVRLM-GFCCVEGCSA-N 2 0 236.359 2.301 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]CC(C2CC2)C2CC2)C1 ZINC000086404704 358968343 /nfs/dbraw/zinc/96/83/43/358968343.db2.gz SXPHMFZZMFGWJD-CHWSQXEVSA-N 2 0 222.376 2.282 20 0 BEADRP CC[C@H]1CC[C@@H]1[NH2+]CC1(C)CC[NH2+]CC1 ZINC000423332988 192713301 /nfs/dbraw/zinc/71/33/01/192713301.db2.gz PPDCIGLCKQHHPU-RYUDHWBXSA-N 2 0 210.365 2.154 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H](Cc2ccccc2)C2CC2)CCC1 ZINC000423329253 192709928 /nfs/dbraw/zinc/70/99/28/192709928.db2.gz OKNRYHCCUUETPH-HNNXBMFYSA-N 2 0 244.382 2.479 20 0 BEADRP C[C@@H]([NH2+]CC1CC[NH+](C)CC1)c1nccs1 ZINC000070717655 359063427 /nfs/dbraw/zinc/06/34/27/359063427.db2.gz SRTBMXCABBLMPE-SNVBAGLBSA-N 2 0 239.388 2.136 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CC2=CC[NH2+]CC2)[C@@H](C)C1 ZINC000423345903 192722156 /nfs/dbraw/zinc/72/21/56/192722156.db2.gz OMOZJAIZPRRESD-MBNYWOFBSA-N 2 0 222.376 2.320 20 0 BEADRP CCCC[C@@H](CC)[NH2+]CC1=CC[NH2+]CC1 ZINC000423348615 192723890 /nfs/dbraw/zinc/72/38/90/192723890.db2.gz UMJXPYUVJLNSJN-CYBMUJFWSA-N 2 0 210.365 2.465 20 0 BEADRP [NH3+]CCCC[NH2+][C@H]1CCC[C@@H](c2cccnc2)C1 ZINC000423326816 192740669 /nfs/dbraw/zinc/74/06/69/192740669.db2.gz MIIFOYCXELMGIH-HIFRSBDPSA-N 2 0 247.386 2.436 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)CCCOC)C1 ZINC000247160914 359198193 /nfs/dbraw/zinc/19/81/93/359198193.db2.gz UDVZLZPBVDDEOP-KGLIPLIRSA-N 2 0 242.407 2.123 20 0 BEADRP COC[C@]1(C[NH2+][C@@H](C)CC(C)(C)C)CCC[NH2+]1 ZINC000423413428 192748777 /nfs/dbraw/zinc/74/87/77/192748777.db2.gz KLIVBZCUPXNOFZ-GXTWGEPZSA-N 2 0 242.407 2.169 20 0 BEADRP C1CC1[C@@H]1CC[C@@H]1[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000423437616 192768665 /nfs/dbraw/zinc/76/86/65/192768665.db2.gz MLNZXOKQJQKWKO-ZQDZILKHSA-N 2 0 234.387 2.153 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)c1ccccn1 ZINC000423436412 192768719 /nfs/dbraw/zinc/76/87/19/192768719.db2.gz ZTIDQYXTLSUQFN-MGPQQGTHSA-N 2 0 247.386 2.497 20 0 BEADRP C[C@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1ccncc1 ZINC000423477757 192787733 /nfs/dbraw/zinc/78/77/33/192787733.db2.gz KITUDVZOMFYHEP-GXTWGEPZSA-N 2 0 233.359 2.264 20 0 BEADRP C[C@H]([NH3+])[C@H](C)[NH2+][C@H]1CCC[C@H](c2cccnc2)C1 ZINC000423482979 192789278 /nfs/dbraw/zinc/78/92/78/192789278.db2.gz XQHVKEZHOUXRLD-ABHRYQDASA-N 2 0 247.386 2.433 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[C@H]([NH3+])C1)c1ccccn1 ZINC000423484148 192789632 /nfs/dbraw/zinc/78/96/32/192789632.db2.gz ZVKCRPKZIJDPMU-AVGNSLFASA-N 2 0 233.359 2.250 20 0 BEADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@@H]2CCC23CCC3)C1 ZINC000423524075 192803968 /nfs/dbraw/zinc/80/39/68/192803968.db2.gz ZGGSPHWASPPLDX-GRYCIOLGSA-N 2 0 208.349 2.036 20 0 BEADRP CCCC[C@H](C)[C@H](C)[NH2+]C[C@H]1C[NH2+]CCCO1 ZINC000423492165 192794515 /nfs/dbraw/zinc/79/45/15/192794515.db2.gz LYRVASGHYNKSJU-MELADBBJSA-N 2 0 242.407 2.169 20 0 BEADRP CC[C@H]([NH2+][C@H]1CC[C@@H](C[NH3+])C1)c1ccncc1 ZINC000423499671 192795120 /nfs/dbraw/zinc/79/51/20/192795120.db2.gz HZFMXWNYAFPQHM-XBFCOCLRSA-N 2 0 233.359 2.250 20 0 BEADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@@H]2CCCC23CCC3)C1 ZINC000423500827 192796115 /nfs/dbraw/zinc/79/61/15/192796115.db2.gz JARAHUCXPXDBSD-JHJVBQTASA-N 2 0 222.376 2.426 20 0 BEADRP C[C@H]1C[C@@H](C[N@@H+]2CCSC[C@@H](C)C2)CC[NH2+]1 ZINC000379554242 359541544 /nfs/dbraw/zinc/54/15/44/359541544.db2.gz ZXCVMBKYZWSOOR-AVGNSLFASA-N 2 0 242.432 2.059 20 0 BEADRP CC1(C)CCC[C@H]1[NH2+]CCC1=CC[NH2+]CC1 ZINC000423543188 192808592 /nfs/dbraw/zinc/80/85/92/192808592.db2.gz UNXJMKSTCSUGNI-CYBMUJFWSA-N 2 0 222.376 2.465 20 0 BEADRP CCC1CC([NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)C1 ZINC000423541139 192808764 /nfs/dbraw/zinc/80/87/64/192808764.db2.gz FFEBLKWSRUAJBJ-ANNIKCPVSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]([NH2+]CCC1=CC[NH2+]CC1)C1CCCC1 ZINC000423542325 192809352 /nfs/dbraw/zinc/80/93/52/192809352.db2.gz TVKGBFCCCQDUEG-GFCCVEGCSA-N 2 0 222.376 2.465 20 0 BEADRP C1=C(CC[NH2+][C@H]2CCC23CCC3)CC[NH2+]C1 ZINC000423545104 192810021 /nfs/dbraw/zinc/81/00/21/192810021.db2.gz XOXFGCAPETTXMR-ZDUSSCGKSA-N 2 0 220.360 2.219 20 0 BEADRP CC[C@@H]1C[C@H]([NH2+][C@H]2CCCC[C@H]2C[NH3+])CCO1 ZINC000423547643 192810093 /nfs/dbraw/zinc/81/00/93/192810093.db2.gz LOLMCLJUFKXLDE-DGAVXFQQSA-N 2 0 240.391 2.051 20 0 BEADRP COCC1(C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)CCCC1 ZINC000580451114 359558023 /nfs/dbraw/zinc/55/80/23/359558023.db2.gz YSFAMHVRGQZDLP-QWHCGFSZSA-N 2 0 240.391 2.053 20 0 BEADRP C[C@H]1CCCC[C@@H]1[NH2+]CCC1=CC[NH2+]CC1 ZINC000423567167 192815128 /nfs/dbraw/zinc/81/51/28/192815128.db2.gz UXEDHUSUYNIONL-JSGCOSHPSA-N 2 0 222.376 2.465 20 0 BEADRP CC(C)[C@H]1CC[C@@H]1[NH2+][C@H](C)CC[NH+](C)C ZINC000309000649 491141464 /nfs/dbraw/zinc/14/14/64/491141464.db2.gz NZBOUFCPFJAXPQ-UPJWGTAASA-N 2 0 212.381 2.351 20 0 BEADRP CC(C)[C@H]1CC[C@H]1[NH2+][C@H](C)CC[NH+](C)C ZINC000309000648 491141479 /nfs/dbraw/zinc/14/14/79/491141479.db2.gz NZBOUFCPFJAXPQ-JHJVBQTASA-N 2 0 212.381 2.351 20 0 BEADRP C[NH+](C)CC[C@@H]([NH2+]C1CSC1)C(C)(C)C ZINC000309035912 491142996 /nfs/dbraw/zinc/14/29/96/491142996.db2.gz IAZVAQLNOOESHW-LLVKDONJSA-N 2 0 230.421 2.058 20 0 BEADRP C[C@@H]([NH2+]CCCC[NH3+])c1cc(F)cc(F)c1 ZINC000087282702 359905232 /nfs/dbraw/zinc/90/52/32/359905232.db2.gz TVHHXHQBUHXEAV-SECBINFHSA-N 2 0 228.286 2.354 20 0 BEADRP C[C@H]([NH2+]CCCC[NH3+])c1cc(F)cc(F)c1 ZINC000087282700 359905594 /nfs/dbraw/zinc/90/55/94/359905594.db2.gz TVHHXHQBUHXEAV-VIFPVBQESA-N 2 0 228.286 2.354 20 0 BEADRP CC[C@@H](C)C[N@@H+]1CC[C@H](C[NH+](C)CC)C1 ZINC000088536899 359965889 /nfs/dbraw/zinc/96/58/89/359965889.db2.gz HDNZWWZZVXWBII-CHWSQXEVSA-N 2 0 212.381 2.306 20 0 BEADRP COc1cccc(C[NH2+][C@@H]2CCCC[C@H]2C[NH3+])c1 ZINC000089144605 359993193 /nfs/dbraw/zinc/99/31/93/359993193.db2.gz HGLJZYKPAIQEFO-DZGCQCFKSA-N 2 0 248.370 2.302 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]CCOC1CCCCC1 ZINC000089150695 359993865 /nfs/dbraw/zinc/99/38/65/359993865.db2.gz WLEMJNDWGGERBG-GXTWGEPZSA-N 2 0 240.391 2.053 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]Cc1ccc(F)cc1F ZINC000089150511 359994042 /nfs/dbraw/zinc/99/40/42/359994042.db2.gz YUVZIHCJVIHTER-TVQRCGJNSA-N 2 0 240.297 2.182 20 0 BEADRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]CCc1cccc(F)c1 ZINC000089148166 359994211 /nfs/dbraw/zinc/99/42/11/359994211.db2.gz NHXDNWLPYGAZEF-TZMCWYRMSA-N 2 0 236.334 2.085 20 0 BEADRP Cc1cccc(CC[NH2+][C@@H]2CCC[C@H]2C[NH3+])c1 ZINC000089150527 359994275 /nfs/dbraw/zinc/99/42/75/359994275.db2.gz ADWXGDFNDNTWQZ-LSDHHAIUSA-N 2 0 232.371 2.255 20 0 BEADRP C[NH+]1CCC(C)(C[NH2+]CC2(C)CCC2)CC1 ZINC000309289786 491147144 /nfs/dbraw/zinc/14/71/44/491147144.db2.gz PUBAGNBMMOVLJY-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H](CC[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1)c1ccccc1 ZINC000090320649 360069785 /nfs/dbraw/zinc/06/97/85/360069785.db2.gz ZBRDSZZLKCOBMI-CWRNSKLLSA-N 2 0 244.382 2.331 20 0 BEADRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+]C2CSC2)C1 ZINC000309360467 491147484 /nfs/dbraw/zinc/14/74/84/491147484.db2.gz OOKKLHZARDAKRR-GFCCVEGCSA-N 2 0 242.432 2.059 20 0 BEADRP COc1ccc2c(c1)[C@H]([NH2+]CCC[NH3+])CCC2 ZINC000092383690 360165777 /nfs/dbraw/zinc/16/57/77/360165777.db2.gz YTRWCJHBFKXCSR-CQSZACIVSA-N 2 0 234.343 2.011 20 0 BEADRP CCOCCC[NH2+][C@@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000093496273 360251548 /nfs/dbraw/zinc/25/15/48/360251548.db2.gz XGNGKMLKAWRKNJ-KBPBESRZSA-N 2 0 242.407 2.313 20 0 BEADRP COCCCC[NH2+][C@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000093516159 360256116 /nfs/dbraw/zinc/25/61/16/360256116.db2.gz SIJOKKXHBTZBHP-KGLIPLIRSA-N 2 0 242.407 2.313 20 0 BEADRP CCOCCC[NH2+][C@@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000093496275 360251386 /nfs/dbraw/zinc/25/13/86/360251386.db2.gz XGNGKMLKAWRKNJ-UONOGXRCSA-N 2 0 242.407 2.313 20 0 BEADRP CC(C)(F)C[NH2+]Cc1ccnn1-c1cc[nH+]cc1 ZINC000631188983 360334615 /nfs/dbraw/zinc/33/46/15/360334615.db2.gz NWWLMUPBXFDDGF-UHFFFAOYSA-N 2 0 248.305 2.105 20 0 BEADRP c1nc2n(c1C[NH2+][C@H]1CCCC13CC3)CCC2 ZINC000631192308 360573420 /nfs/dbraw/zinc/57/34/20/360573420.db2.gz KLQGJSWCTDGMHE-LBPRGKRZSA-N 2 0 231.343 2.252 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CC(C)(C)C)[C@H](C)C1 ZINC000178677709 219866404 /nfs/dbraw/zinc/86/64/04/219866404.db2.gz FMWNDGYPTPCJLG-NEPJUHHUSA-N 2 0 212.381 2.352 20 0 BEADRP c1cn(CCC[NH2+][C@@H]2CC[C@@H]2C2CC2)cn1 ZINC000309577994 491151994 /nfs/dbraw/zinc/15/19/94/491151994.db2.gz RAAZKNKTMVYXAA-CHWSQXEVSA-N 2 0 219.332 2.051 20 0 BEADRP C[C@@H]([NH3+])c1ccc(C[NH2+]C[C@@H]2CCCOC2)cc1 ZINC000414803451 200765577 /nfs/dbraw/zinc/76/55/77/200765577.db2.gz CSUBUUSIFCOKAA-OCCSQVGLSA-N 2 0 248.370 2.223 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CC2CCCC2)CC[N@@H+]1C ZINC000155880826 360932310 /nfs/dbraw/zinc/93/23/10/360932310.db2.gz LRDUKCGLVODQIS-AAEUAGOBSA-N 2 0 210.365 2.249 20 0 BEADRP CCOc1ccc(C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)cc1 ZINC000414925336 200782629 /nfs/dbraw/zinc/78/26/29/200782629.db2.gz LOUVAYPEQJWNGH-KGLIPLIRSA-N 2 0 248.370 2.445 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CC2([NH3+])CCC2)C[C@@H]1C ZINC000414871049 200773151 /nfs/dbraw/zinc/77/31/51/200773151.db2.gz CREZVGNJRXDANR-WOPDTQHZSA-N 2 0 210.365 2.282 20 0 BEADRP CC1(C)CC[C@H]([NH2+][C@H]2CC[NH2+]C23CCC3)C1 ZINC000629385200 361032529 /nfs/dbraw/zinc/03/25/29/361032529.db2.gz UJXFKIPLABSZAY-RYUDHWBXSA-N 2 0 222.376 2.439 20 0 BEADRP CC1(C)CCCC[C@H]1[NH2+]CC1([NH3+])CCOCC1 ZINC000629387385 361038760 /nfs/dbraw/zinc/03/87/60/361038760.db2.gz IFFSMUOGJKBZTC-GFCCVEGCSA-N 2 0 240.391 2.053 20 0 BEADRP CC[C@H](C)C[C@H](CC)[NH2+]CC1([NH3+])CCOCC1 ZINC000629388041 361039868 /nfs/dbraw/zinc/03/98/68/361039868.db2.gz PXABDFBEGHTWBW-STQMWFEESA-N 2 0 242.407 2.299 20 0 BEADRP C[NH2+]CCOCC[NH2+][C@@H]1CCC(C)(C)C[C@H]1C ZINC000629404193 361050239 /nfs/dbraw/zinc/05/02/39/361050239.db2.gz LROGNINQQFUUFR-CHWSQXEVSA-N 2 0 242.407 2.027 20 0 BEADRP CCCC[C@H]1CCC[C@@H]1[NH2+]CCOCCC[NH3+] ZINC000629400482 361052160 /nfs/dbraw/zinc/05/21/60/361052160.db2.gz ZECKBSXVMSPKHK-KBPBESRZSA-N 2 0 242.407 2.300 20 0 BEADRP CCCC[C@H]1CCC[C@H]1[NH2+]CCOCC[NH2+]C ZINC000629405814 361053600 /nfs/dbraw/zinc/05/36/00/361053600.db2.gz UATQHFLLQRLQFR-UONOGXRCSA-N 2 0 242.407 2.171 20 0 BEADRP CCCC[C@@H]1CCC[C@H]1[NH2+]CCOCC[NH2+]C ZINC000629405815 361054192 /nfs/dbraw/zinc/05/41/92/361054192.db2.gz UATQHFLLQRLQFR-ZIAGYGMSSA-N 2 0 242.407 2.171 20 0 BEADRP CCC1CCC([NH2+][C@@H]2CC[NH2+][C@H]2C)CC1 ZINC000629407186 361054527 /nfs/dbraw/zinc/05/45/27/361054527.db2.gz XBRAITDNHKIJHN-YWPUVAFDSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@@H]1CC[C@@H](NCc2cccc3c2CCC3)C[NH2+]1 ZINC000629418375 361063014 /nfs/dbraw/zinc/06/30/14/361063014.db2.gz XKFSKMJUQQXZOG-IUODEOHRSA-N 2 0 244.382 2.405 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[NH2+]C12CCC2)C1CCCC1 ZINC000629521176 361117577 /nfs/dbraw/zinc/11/75/77/361117577.db2.gz RXKMVFQZIWZOOM-YPMHNXCESA-N 2 0 222.376 2.439 20 0 BEADRP CC[C@@H]1C[C@H](C)CC[C@@H]1[NH2+]CCOCC[NH2+]C ZINC000629529551 361143495 /nfs/dbraw/zinc/14/34/95/361143495.db2.gz GTEIKJKUDKXVDD-MCIONIFRSA-N 2 0 242.407 2.027 20 0 BEADRP C[NH2+]CCOCC[NH2+][C@H](C)C1CCCCCC1 ZINC000629530216 361143713 /nfs/dbraw/zinc/14/37/13/361143713.db2.gz ZOYSVVKXVSELJI-CYBMUJFWSA-N 2 0 242.407 2.171 20 0 BEADRP CCC[C@@H]([NH2+]CCOCC[NH2+]C)C1CCCC1 ZINC000629531091 361145592 /nfs/dbraw/zinc/14/55/92/361145592.db2.gz ZWCCLSGCKCRKCR-CQSZACIVSA-N 2 0 242.407 2.171 20 0 BEADRP C[NH2+]CCOCC[NH2+][C@H](C)[C@@H]1CCCC[C@H]1C ZINC000629530763 361145671 /nfs/dbraw/zinc/14/56/71/361145671.db2.gz QLPUHDOVFDNHLS-MGPQQGTHSA-N 2 0 242.407 2.027 20 0 BEADRP CCO[C@H](C[N@@H+]1CCCC[C@@H]1CC[NH3+])C1CC1 ZINC000629531658 361148686 /nfs/dbraw/zinc/14/86/86/361148686.db2.gz SUIWLOSJSLONAX-ZIAGYGMSSA-N 2 0 240.391 2.005 20 0 BEADRP CCC(F)(F)C(C)(C)C[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000629531380 361149319 /nfs/dbraw/zinc/14/93/19/361149319.db2.gz IXKBPSLZDWMYCE-VIFPVBQESA-N 2 0 234.334 2.255 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+]CC[C@H]1CC=CCC1 ZINC000629531794 361150180 /nfs/dbraw/zinc/15/01/80/361150180.db2.gz YDUSNUIFDJRWIL-UONOGXRCSA-N 2 0 240.391 2.076 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1N[C@H](C)c1ccccc1OC ZINC000629524190 361121988 /nfs/dbraw/zinc/12/19/88/361121988.db2.gz NKSFJFNMKZJXPR-KWCYVHTRSA-N 2 0 248.370 2.486 20 0 BEADRP Cc1cccc([C@H](C)[NH2+]CC2([NH3+])CCOCC2)c1 ZINC000629524228 361122957 /nfs/dbraw/zinc/12/29/57/361122957.db2.gz OMBOFGAIFLFZPT-ZDUSSCGKSA-N 2 0 248.370 2.154 20 0 BEADRP CC1(C)CC(CN2CC[C@@H]3CC[NH2+][C@@H]3C2)C1 ZINC000629534004 361163333 /nfs/dbraw/zinc/16/33/33/361163333.db2.gz HVESJYFKBNBHOH-QWHCGFSZSA-N 2 0 222.376 2.106 20 0 BEADRP CC1(C)CC(CN2CC[C@H]3CC[NH2+][C@H]3C2)C1 ZINC000629534003 361163463 /nfs/dbraw/zinc/16/34/63/361163463.db2.gz HVESJYFKBNBHOH-OLZOCXBDSA-N 2 0 222.376 2.106 20 0 BEADRP Cc1nccn1CCC[N@@H+](C)[C@@H](C)C1CC1 ZINC000579070215 366703050 /nfs/dbraw/zinc/70/30/50/366703050.db2.gz IPENVZMBPXVJOL-NSHDSACASA-N 2 0 221.348 2.312 20 0 BEADRP CO[C@H](C)C[N@H+](C)CCCC[NH+]1CCCCC1 ZINC000640533870 361302907 /nfs/dbraw/zinc/30/29/07/361302907.db2.gz XTSKCURUBLDNMR-CQSZACIVSA-N 2 0 242.407 2.219 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]CC[C@H]1CC1(F)F ZINC000622043843 370675351 /nfs/dbraw/zinc/67/53/51/370675351.db2.gz NNAKMAUQVPWRGI-DCAQKATOSA-N 2 0 232.318 2.139 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]CC[C@H]1CC1(F)F ZINC000622043740 370675882 /nfs/dbraw/zinc/67/58/82/370675882.db2.gz JSPIXLODUCLWOU-HBNTYKKESA-N 2 0 232.318 2.281 20 0 BEADRP CC1CC(C[NH2+][C@@H]2CCCCC[C@@H]2[NH3+])C1 ZINC000622044646 370677119 /nfs/dbraw/zinc/67/71/19/370677119.db2.gz NWYKFPWCEPEVMC-IFWUJCSASA-N 2 0 210.365 2.282 20 0 BEADRP CC1CC(C[NH2+][C@H]2CCCCC[C@H]2[NH3+])C1 ZINC000622044647 370677339 /nfs/dbraw/zinc/67/73/39/370677339.db2.gz NWYKFPWCEPEVMC-TUUUFIMRSA-N 2 0 210.365 2.282 20 0 BEADRP CC[NH+]1CCC([NH2+]CCCC2CC2)CC1 ZINC000162324902 361345688 /nfs/dbraw/zinc/34/56/88/361345688.db2.gz OSFLIWPUTBVEPP-UHFFFAOYSA-N 2 0 210.365 2.251 20 0 BEADRP CCC[NH+]1CCC([NH2+]C[C@H](C)SC)CC1 ZINC000162341831 361347161 /nfs/dbraw/zinc/34/71/61/361347161.db2.gz SHWZQAPZRXHZRK-NSHDSACASA-N 2 0 230.421 2.202 20 0 BEADRP [NH3+]C1(C[NH2+]CCCCC(F)(F)F)CCC1 ZINC000124475945 181331923 /nfs/dbraw/zinc/33/19/23/181331923.db2.gz DDGIGEJEPRQHAQ-UHFFFAOYSA-N 2 0 224.270 2.190 20 0 BEADRP C[C@H](Cc1ccsc1)[NH2+][C@H]1CC[NH2+][C@H](C)C1 ZINC000579328734 366759647 /nfs/dbraw/zinc/75/96/47/366759647.db2.gz PBPKENYUYYPVQY-WZRBSPASSA-N 2 0 238.400 2.409 20 0 BEADRP C/C=C/C[NH2+][C@@H](C)c1ccc(C[NH3+])nc1C ZINC000629535347 361410365 /nfs/dbraw/zinc/41/03/65/361410365.db2.gz DDFAWQUMHGFSLA-YEZKRMTDSA-N 2 0 219.332 2.075 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+][C@H]1CC[C@@H]1C(C)(C)C ZINC000629543803 361412837 /nfs/dbraw/zinc/41/28/37/361412837.db2.gz BQULZLDWYBGSAW-YFKTTZPYSA-N 2 0 210.365 2.151 20 0 BEADRP CC[C@@H]([NH2+][C@@H]1CC[NH2+][C@H]1C)C1CCCC1 ZINC000629543862 361413261 /nfs/dbraw/zinc/41/32/61/361413261.db2.gz CRHZMDNFLKFJAE-CYZMBNFOSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@@H](CCC(C)(C)C)[NH2+]CCOCCC[NH3+] ZINC000629540088 361414006 /nfs/dbraw/zinc/41/40/06/361414006.db2.gz SUUMUKLMDAAPHA-LBPRGKRZSA-N 2 0 230.396 2.156 20 0 BEADRP C[C@]1(C[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)C[C@H]2C[C@H]2C1 ZINC000629541093 361415262 /nfs/dbraw/zinc/41/52/62/361415262.db2.gz WEQASHGIPLBUAK-XMEMRUQMSA-N 2 0 248.414 2.400 20 0 BEADRP CCC1(CC)[C@H]([NH2+]CCC[NH+](C)C)C[C@@H]1OC ZINC000181392975 366807345 /nfs/dbraw/zinc/80/73/45/366807345.db2.gz AGNDGOLUKZELMQ-OLZOCXBDSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+][C@H]1CCC[C@H]1CCCF ZINC000629544260 361422898 /nfs/dbraw/zinc/42/28/98/361422898.db2.gz HENDHUWBVRWUGS-RVMXOQNASA-N 2 0 228.355 2.245 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+][C@H]1CCC[C@@H]1CCCF ZINC000629544259 361422924 /nfs/dbraw/zinc/42/29/24/361422924.db2.gz HENDHUWBVRWUGS-LOWDOPEQSA-N 2 0 228.355 2.245 20 0 BEADRP C[C@@H]1CC(C)(C)C[C@H]1[NH2+][C@@H]1CC[NH2+][C@H]1C ZINC000629545685 361426989 /nfs/dbraw/zinc/42/69/89/361426989.db2.gz QAZFMBQVELFISU-WRWGMCAJSA-N 2 0 210.365 2.151 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CCCC12CC2 ZINC000629555202 361446336 /nfs/dbraw/zinc/44/63/36/361446336.db2.gz RVCYJYJWITTZBO-AVGNSLFASA-N 2 0 222.376 2.284 20 0 BEADRP Cc1ccsc1[C@H](C)[NH2+]CCOCCC[NH3+] ZINC000629541579 361416416 /nfs/dbraw/zinc/41/64/16/361416416.db2.gz RIFCMSSMPJGITO-NSHDSACASA-N 2 0 242.388 2.073 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+]C1CCC2(CC2)CC1 ZINC000629544253 361418457 /nfs/dbraw/zinc/41/84/57/361418457.db2.gz IIWKAHOULRMUQK-CMPLNLGQSA-N 2 0 208.349 2.049 20 0 BEADRP C[C@@H]1C[N@@H+]([C@@H]2CCc3ccc(F)cc32)CC[C@@H]1[NH3+] ZINC000430941316 201158794 /nfs/dbraw/zinc/15/87/94/201158794.db2.gz VPRCWGIJHVLZDR-WKPIXPDZSA-N 2 0 248.345 2.482 20 0 BEADRP FC1(F)CCC[N@H+](CC[C@@H]2CC[NH2+]C2)CC1 ZINC000629558477 361452693 /nfs/dbraw/zinc/45/26/93/361452693.db2.gz IKGPQARLLCQCLY-NSHDSACASA-N 2 0 232.318 2.107 20 0 BEADRP FC1(F)CCC[N@H+](CC[C@@H]2CCC[NH2+]C2)CC1 ZINC000629559953 361455258 /nfs/dbraw/zinc/45/52/58/361455258.db2.gz VWFBECYDOUSXOL-LBPRGKRZSA-N 2 0 246.345 2.497 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CC[C@@H]2C(C)C)C1 ZINC000309966771 491158629 /nfs/dbraw/zinc/15/86/29/491158629.db2.gz NVEILGGYULBHNL-MGPQQGTHSA-N 2 0 224.392 2.352 20 0 BEADRP CC[NH+](CC)CCOCC[NH2+]C1CC(C)(C)C1 ZINC000433225621 201171589 /nfs/dbraw/zinc/17/15/89/201171589.db2.gz CKEFEEXFXQURLE-UHFFFAOYSA-N 2 0 242.407 2.123 20 0 BEADRP Cc1ccc(CCC[NH2+][C@@H]2CC[C@@H](C)NC2)cn1 ZINC000629659775 361564745 /nfs/dbraw/zinc/56/47/45/361564745.db2.gz GTQPDJHTPKMLHH-UKRRQHHQSA-N 2 0 247.386 2.053 20 0 BEADRP COCc1ccc(C[NH2+][C@H](C)CCCC[NH3+])o1 ZINC000629649204 361543125 /nfs/dbraw/zinc/54/31/25/361543125.db2.gz MAFMOISWFRIONP-LLVKDONJSA-N 2 0 240.347 2.033 20 0 BEADRP C[C@@H](N)C[N@@H+]1CCC[C@@H](C(C)(C)C)CC1 ZINC000163732864 361565521 /nfs/dbraw/zinc/56/55/21/361565521.db2.gz RRBBVQLKKYUXCM-VXGBXAGGSA-N 2 0 212.381 2.482 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CC1=Cc2ccccc2OC1 ZINC000629649754 361545781 /nfs/dbraw/zinc/54/57/81/361545781.db2.gz FWTLRGPOHTYNRJ-NWDGAFQWSA-N 2 0 246.354 2.178 20 0 BEADRP CN(CC1=Cc2ccccc2OC1)CC(C)(C)[NH3+] ZINC000629649758 361546357 /nfs/dbraw/zinc/54/63/57/361546357.db2.gz FYJGKXBICZDJFF-UHFFFAOYSA-N 2 0 246.354 2.132 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1[NH2+]C[C@@H](C)C(C)(C)C ZINC000629653611 361553079 /nfs/dbraw/zinc/55/30/79/361553079.db2.gz KQWACEXRIKQCDH-GRYCIOLGSA-N 2 0 212.381 2.399 20 0 BEADRP CC1(C[NH2+][C@@H]2CC[NH2+]C23CCC3)CCC1 ZINC000629651173 361556258 /nfs/dbraw/zinc/55/62/58/361556258.db2.gz KSJVTQHYFRXFBC-LLVKDONJSA-N 2 0 208.349 2.051 20 0 BEADRP [NH3+]CCCOCC[NH2+]Cc1ccc(C2CC2)cc1 ZINC000629679744 361602209 /nfs/dbraw/zinc/60/22/09/361602209.db2.gz NLOILQOPSICDKI-UHFFFAOYSA-N 2 0 248.370 2.019 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+]CC(C)(C)C)C1 ZINC000163800764 361579385 /nfs/dbraw/zinc/57/93/85/361579385.db2.gz KDMLGBXXXIQIKZ-GFCCVEGCSA-N 2 0 212.381 2.354 20 0 BEADRP CC[C@H]1CCC[C@@H](C[N@H+](C)CCOCC[NH3+])C1 ZINC000629667999 361588724 /nfs/dbraw/zinc/58/87/24/361588724.db2.gz ZAIUKPYABRYGCE-UONOGXRCSA-N 2 0 242.407 2.110 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+]C[C@@H]1CCC[C@H](C)C1 ZINC000629672444 361613864 /nfs/dbraw/zinc/61/38/64/361613864.db2.gz SDVACCIKBVSEIY-WUHRBBMRSA-N 2 0 210.365 2.153 20 0 BEADRP CCCc1cccc(C[N@@H+]2CC[C@@H](C[NH3+])C2)c1 ZINC000435368854 201265092 /nfs/dbraw/zinc/26/50/92/201265092.db2.gz JLIQTFIXPGMBCB-HNNXBMFYSA-N 2 0 232.371 2.420 20 0 BEADRP CC(C)(C[NH3+])c1cccc(C2=CC[NH2+]CC2)c1 ZINC000629723582 361665803 /nfs/dbraw/zinc/66/58/03/361665803.db2.gz PQOSWJVXTJZQTA-UHFFFAOYSA-N 2 0 230.355 2.300 20 0 BEADRP CC[C@H]1Cc2c(cccc2C2=CC[NH2+]CC2)C[NH2+]1 ZINC000629723620 361665889 /nfs/dbraw/zinc/66/58/89/361665889.db2.gz QSBUBCZGIUQSAG-AWEZNQCLSA-N 2 0 242.366 2.488 20 0 BEADRP [NH3+]C1CCC([NH2+][C@@H]2CCc3ccccc3C2)CC1 ZINC000051694273 181342389 /nfs/dbraw/zinc/34/23/89/181342389.db2.gz CYKAUQDIQNLMBK-UYSNPLJNSA-N 2 0 244.382 2.403 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCC[C@@H]1c1ccc(OC)cc1 ZINC000435886225 201296699 /nfs/dbraw/zinc/29/66/99/201296699.db2.gz URVFIVMCVZIMEY-OAHLLOKOSA-N 2 0 248.370 2.442 20 0 BEADRP C[NH2+]CCC[N@@H+]1CC[C@H](c2ccccc2OC)C1 ZINC000435878062 201293412 /nfs/dbraw/zinc/29/34/12/201293412.db2.gz XPGLWWTYSYKDJA-ZDUSSCGKSA-N 2 0 248.370 2.094 20 0 BEADRP [NH3+]C1CC[NH+](CCCc2cccc(F)c2)CC1 ZINC000011729484 181343958 /nfs/dbraw/zinc/34/39/58/181343958.db2.gz UYRBVGRIRPDNHA-UHFFFAOYSA-N 2 0 236.334 2.181 20 0 BEADRP CCCC[C@H](COC)[NH2+]C1CCC([NH3+])CC1 ZINC000437759397 201371826 /nfs/dbraw/zinc/37/18/26/201371826.db2.gz DFVMGCLXOGBBOI-WXRRBKDZSA-N 2 0 228.380 2.051 20 0 BEADRP [NH3+]CCC[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1 ZINC000437771096 201372688 /nfs/dbraw/zinc/37/26/88/201372688.db2.gz GSVFCTLJGAUSLQ-CABCVRRESA-N 2 0 232.371 2.336 20 0 BEADRP CC[N@H+](Cc1cccc2c1CC[NH2+]C2)C1CC1 ZINC000123892980 541318719 /nfs/dbraw/zinc/31/87/19/541318719.db2.gz YNIMEXCKSUXSMU-UHFFFAOYSA-N 2 0 230.355 2.317 20 0 BEADRP CSC[C@H](C)[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@H]1C ZINC000133965089 364380515 /nfs/dbraw/zinc/38/05/15/364380515.db2.gz QAFINOGIMHLPGJ-NOOOWODRSA-N 2 0 230.421 2.056 20 0 BEADRP [NH3+]CCC1CC[NH+](CC2CCCC2)CC1 ZINC000044412954 181371869 /nfs/dbraw/zinc/37/18/69/181371869.db2.gz DESCRVVAWMBGQE-UHFFFAOYSA-N 2 0 210.365 2.237 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]CCCNc2ccccc2)C1 ZINC000573742775 364907700 /nfs/dbraw/zinc/90/77/00/364907700.db2.gz ZBMBYCGPSUHOLH-DZGCQCFKSA-N 2 0 247.386 2.348 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]CCCNc2ccccc2)C1 ZINC000573742778 364907765 /nfs/dbraw/zinc/90/77/65/364907765.db2.gz ZBMBYCGPSUHOLH-ZFWWWQNUSA-N 2 0 247.386 2.348 20 0 BEADRP CCO[C@@H](CC[NH+](C)C)C[NH2+]CC1(C)CCC1 ZINC000434753553 541390370 /nfs/dbraw/zinc/39/03/70/541390370.db2.gz GAMMDFFIHMAPSP-ZDUSSCGKSA-N 2 0 242.407 2.123 20 0 BEADRP CC[NH+](CC)CCOCC[NH2+]CC1(C)CCC1 ZINC000434758272 541390765 /nfs/dbraw/zinc/39/07/65/541390765.db2.gz KGWGYDPOZDQOMM-UHFFFAOYSA-N 2 0 242.407 2.125 20 0 BEADRP Cc1ccc(CC[N@H+]2CC[C@H]([NH3+])C[C@@H]2C)cc1 ZINC000573931523 364949584 /nfs/dbraw/zinc/94/95/84/364949584.db2.gz XAIWMECWOHUNQY-ZFWWWQNUSA-N 2 0 232.371 2.349 20 0 BEADRP Cc1ccc(CC[N@H+]2CC[C@@H]([NH3+])C[C@@H]2C)cc1 ZINC000573931520 364949842 /nfs/dbraw/zinc/94/98/42/364949842.db2.gz XAIWMECWOHUNQY-DZGCQCFKSA-N 2 0 232.371 2.349 20 0 BEADRP [NH3+]CCCC[NH2+]C1C2CC3CC(C2)CC1C3 ZINC000037715336 181377941 /nfs/dbraw/zinc/37/79/41/181377941.db2.gz ZQZKEGLRPPCCCO-UHFFFAOYSA-N 2 0 222.376 2.140 20 0 BEADRP [NH3+]CCCC[NH2+][C@H]1CCc2ccccc21 ZINC000001544539 181377944 /nfs/dbraw/zinc/37/79/44/181377944.db2.gz ZCTVHWPVISYHOJ-ZDUSSCGKSA-N 2 0 204.317 2.002 20 0 BEADRP [NH3+]CCCC[NH2+][C@@H]1CCCc2ccccc21 ZINC000037715122 181377968 /nfs/dbraw/zinc/37/79/68/181377968.db2.gz GEGKBXSNUUPMJH-CQSZACIVSA-N 2 0 218.344 2.393 20 0 BEADRP [NH3+]CCC[NH+]1CCC2(CCCCC2)CC1 ZINC000061818690 181380159 /nfs/dbraw/zinc/38/01/59/181380159.db2.gz DPLPNDCCIKBETB-UHFFFAOYSA-N 2 0 210.365 2.382 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@H]1CCCC12CC2 ZINC000574412643 365057384 /nfs/dbraw/zinc/05/73/84/365057384.db2.gz DGYCLLNDYPQCDH-LBPRGKRZSA-N 2 0 210.365 2.251 20 0 BEADRP COc1ccc2oc(C[N@H+](C)CCC[NH3+])cc2c1 ZINC000574277259 365025813 /nfs/dbraw/zinc/02/58/13/365025813.db2.gz NUVAUMQCPJKMTO-UHFFFAOYSA-N 2 0 248.326 2.222 20 0 BEADRP [NH3+]CCC[N@H+](Cc1cccc(F)c1)C1CC1 ZINC000036883467 181380256 /nfs/dbraw/zinc/38/02/56/181380256.db2.gz XZFYGLFPEGBDBK-UHFFFAOYSA-N 2 0 222.307 2.139 20 0 BEADRP C[C@H]1CCCC[C@H]1C[N@@H+]1C[C@@H]2CCC[NH2+][C@@H]2C1 ZINC000574793029 365146080 /nfs/dbraw/zinc/14/60/80/365146080.db2.gz AJRHWVIPXWLCCF-ZQDZILKHSA-N 2 0 236.403 2.497 20 0 BEADRP CC[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCC[C@H]3C[C@H]32)C1 ZINC000575197936 365238970 /nfs/dbraw/zinc/23/89/70/365238970.db2.gz RJOHMYOFTQJNCL-LXTVHRRPSA-N 2 0 236.403 2.497 20 0 BEADRP CC[N@@H+]1CCC[C@@H](C[NH2+][C@H]2CCC[C@H]3C[C@H]32)C1 ZINC000575197937 365239338 /nfs/dbraw/zinc/23/93/38/365239338.db2.gz RJOHMYOFTQJNCL-XQLPTFJDSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+][C@H]1CCC[C@@H](F)C1 ZINC000575989225 365437596 /nfs/dbraw/zinc/43/75/96/365437596.db2.gz XILGATKOSNNGGP-NDBYEHHHSA-N 2 0 228.355 2.245 20 0 BEADRP COc1ccc(C)cc1C[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000579700064 366982676 /nfs/dbraw/zinc/98/26/76/366982676.db2.gz LSCUZJCISLZZIP-RYUDHWBXSA-N 2 0 236.359 2.219 20 0 BEADRP CC1(C[N@@H+]2CCC[C@H]([C@H]3CC[NH2+]C3)C2)CC1 ZINC000579958583 367103162 /nfs/dbraw/zinc/10/31/62/367103162.db2.gz KMBWOKDXWBCQMK-STQMWFEESA-N 2 0 222.376 2.108 20 0 BEADRP c1ccc(CC[N@@H+]2CCC[C@H]3C[NH2+]CC[C@@H]32)cc1 ZINC000631887133 370833982 /nfs/dbraw/zinc/83/39/82/370833982.db2.gz OCGUHYSEZDXCRR-HOTGVXAUSA-N 2 0 244.382 2.303 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H]1C[C@H](OC)C1(CC)CC ZINC000580827657 367177840 /nfs/dbraw/zinc/17/78/40/367177840.db2.gz XVQJCRUDGDTDGA-STQMWFEESA-N 2 0 242.407 2.169 20 0 BEADRP C[C@H]1CC[N@H+](C[C@@H]2CC[NH2+][C@H](C)C2)[C@H]1C ZINC000380669944 367275707 /nfs/dbraw/zinc/27/57/07/367275707.db2.gz KXHAGPLNWSLCBW-QNWHQSFQSA-N 2 0 210.365 2.105 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@H](c2cccnc2)C2CC2)C1 ZINC000581143655 367276823 /nfs/dbraw/zinc/27/68/23/367276823.db2.gz XLGILDHLVTYSNR-KFWWJZLASA-N 2 0 245.370 2.392 20 0 BEADRP CC(C)C[C@H](N)C[N@@H+]1C[C@@H](C)CC1(C)C ZINC000380576898 367245677 /nfs/dbraw/zinc/24/56/77/367245677.db2.gz VIWIKQWORONPNJ-RYUDHWBXSA-N 2 0 212.381 2.480 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@H]2CCC2(C)C)CC1 ZINC000380860841 367318392 /nfs/dbraw/zinc/31/83/92/367318392.db2.gz ZLROEFDBRWJLCC-ZDUSSCGKSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[NH2+]C1)[C@H]1CC2CCC1CC2 ZINC000382203940 367497675 /nfs/dbraw/zinc/49/76/75/367497675.db2.gz SBCVHUPVBMGWSG-YOMYCBHVSA-N 2 0 222.376 2.153 20 0 BEADRP C[N@H+](CCC[NH3+])C[C@@H]1C[C@H]1c1ccccc1 ZINC000382082206 367484276 /nfs/dbraw/zinc/48/42/76/367484276.db2.gz QETKVUHLYNSTPP-KBPBESRZSA-N 2 0 218.344 2.071 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[NH2+]C1)[C@@H]1CC2CCC1CC2 ZINC000382203936 367498399 /nfs/dbraw/zinc/49/83/99/367498399.db2.gz SBCVHUPVBMGWSG-ASUPZPJHSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]C[C@@H]2C[C@H]2C2CC2)CC[N@@H+]1C ZINC000382184839 367495024 /nfs/dbraw/zinc/49/50/24/367495024.db2.gz AWEVJURBBLLHBG-PYJNHQTQSA-N 2 0 222.376 2.105 20 0 BEADRP CC[NH+]1CCC(CC[NH2+]CC2(F)CC2)CC1 ZINC000381744440 367453383 /nfs/dbraw/zinc/45/33/83/367453383.db2.gz PSFROQNAFWLGBH-UHFFFAOYSA-N 2 0 228.355 2.200 20 0 BEADRP COc1ccc([C@H](C)[NH2+]CCC[NH2+]C2CC2)cc1 ZINC000382558709 367540036 /nfs/dbraw/zinc/54/00/36/367540036.db2.gz ONSYQTQKFVRQHJ-LBPRGKRZSA-N 2 0 248.370 2.488 20 0 BEADRP C[C@@H]([NH2+]CCC[NH2+]C1CC1)C1CCCC1 ZINC000382577154 367543597 /nfs/dbraw/zinc/54/35/97/367543597.db2.gz BEYCPGPRZVOEHM-LLVKDONJSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]([NH2+]CC1CC[NH2+]CC1)C1CCSCC1 ZINC000581542455 367564015 /nfs/dbraw/zinc/56/40/15/367564015.db2.gz XGFUPUXBHSENRE-LLVKDONJSA-N 2 0 242.432 2.107 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+]C[C@H](C)C[NH+](C)C ZINC000382366853 367512764 /nfs/dbraw/zinc/51/27/64/367512764.db2.gz WQBGUGOUMOJDAY-XQQFMLRXSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H](C[NH3+])N(C)Cc1cccc(C2CC2)c1 ZINC000382983299 367580470 /nfs/dbraw/zinc/58/04/70/367580470.db2.gz ZAEJTGUZBCJQGF-NSHDSACASA-N 2 0 218.344 2.343 20 0 BEADRP CC(C)[C@@H]([NH2+]CC[C@H]1CCC[NH2+]1)C1CC1 ZINC000581661521 367662497 /nfs/dbraw/zinc/66/24/97/367662497.db2.gz MZVVYCXHNPMPFW-CHWSQXEVSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@@H]1[C@@H](C)CC[N@@H+]1CC[C@@H]1CCC[NH2+]C1 ZINC000384027840 367669569 /nfs/dbraw/zinc/66/95/69/367669569.db2.gz ZECUUGQBEKPSEW-MELADBBJSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H](CC(C)(C)C)[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000384512705 367694818 /nfs/dbraw/zinc/69/48/18/367694818.db2.gz HOXLCTAGFRESIV-RYUDHWBXSA-N 2 0 212.381 2.400 20 0 BEADRP C/C=C/C[NH2+][C@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000384731852 367721713 /nfs/dbraw/zinc/72/17/13/367721713.db2.gz JVAYRUGJWSTPJC-CDJBXZAQSA-N 2 0 210.365 2.463 20 0 BEADRP Cc1ccc(C[N@@H+](C)C2CC([NH3+])C2)c(C)c1 ZINC000384741588 367724637 /nfs/dbraw/zinc/72/46/37/367724637.db2.gz LZOOHLZOROSOMX-UHFFFAOYSA-N 2 0 218.344 2.225 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+][C@@H]1CCc2ccccc2C1 ZINC000227084614 181433523 /nfs/dbraw/zinc/43/35/23/181433523.db2.gz DUKTYZWRNQUQGG-ARFHVFGLSA-N 2 0 244.382 2.261 20 0 BEADRP Cc1ccc(C)c(OCC[N@@H+](C)C2CC([NH3+])C2)c1 ZINC000384969838 367768095 /nfs/dbraw/zinc/76/80/95/367768095.db2.gz XWAXCNSTWFMPPJ-UHFFFAOYSA-N 2 0 248.370 2.104 20 0 BEADRP Cc1cc(C)cc(C[N@@H+](C)C2CC([NH3+])C2)c1 ZINC000384974736 367768778 /nfs/dbraw/zinc/76/87/78/367768778.db2.gz ITQROWNNLCKKFA-UHFFFAOYSA-N 2 0 218.344 2.225 20 0 BEADRP CCOc1ccc(C[N@H+](C)C2CC([NH3+])C2)cc1 ZINC000385093533 367788359 /nfs/dbraw/zinc/78/83/59/367788359.db2.gz YKVFERXFPAZUEG-UHFFFAOYSA-N 2 0 234.343 2.007 20 0 BEADRP Cc1cnccc1C[NH2+]C[C@H]1CC[N@@H+](C(C)C)C1 ZINC000385175752 367805137 /nfs/dbraw/zinc/80/51/37/367805137.db2.gz MTIKGMOLGJIFLM-CQSZACIVSA-N 2 0 247.386 2.210 20 0 BEADRP CSCC1CCC([NH2+]C[C@@H](C)C[NH3+])CC1 ZINC000385810970 367867215 /nfs/dbraw/zinc/86/72/15/367867215.db2.gz IEKAOKYINLXAPX-UNXYVOJBSA-N 2 0 230.421 2.093 20 0 BEADRP C[C@@H]1CCC[C@@H](C[N@@H+]2CC[C@@H]3C[NH2+]C[C@@H]32)C1 ZINC000385373271 367823548 /nfs/dbraw/zinc/82/35/48/367823548.db2.gz LNRKSYFCUZJARV-SYQHCUMBSA-N 2 0 222.376 2.106 20 0 BEADRP C[C@H]1CCC[C@H](C[N@@H+]2CC[C@@H]3C[NH2+]C[C@@H]32)C1 ZINC000385373269 367823559 /nfs/dbraw/zinc/82/35/59/367823559.db2.gz LNRKSYFCUZJARV-FQUUOJAGSA-N 2 0 222.376 2.106 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2CCSCC[C@@H]2C)CC[NH2+]1 ZINC000385411261 367826926 /nfs/dbraw/zinc/82/69/26/367826926.db2.gz UVBSIKWXLRAHRU-FRRDWIJNSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]Cc1scnc1C1CC1 ZINC000581824188 367831931 /nfs/dbraw/zinc/83/19/31/367831931.db2.gz AXNFSIAXDPSIOT-IUCAKERBSA-N 2 0 239.388 2.236 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCC[C@@H]2C[NH3+])[C@H]1C ZINC000385617899 367847363 /nfs/dbraw/zinc/84/73/63/367847363.db2.gz ICDWINKKKHJHTB-MLGHIDQZSA-N 2 0 210.365 2.138 20 0 BEADRP Cc1cc(C)c(Cn2ccnc2)c(C)[nH+]1 ZINC000631013126 370892274 /nfs/dbraw/zinc/89/22/74/370892274.db2.gz SDPLVPVRZJSSDK-UHFFFAOYSA-N 2 0 201.273 2.252 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[C@@H](C)C1)[C@H]1CCCC[NH2+]1 ZINC000386103617 367912663 /nfs/dbraw/zinc/91/26/63/367912663.db2.gz KFOXVTHZSOXRRX-MROQNXINSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC1(C)C)[C@H]1CCCC[NH2+]1 ZINC000386129364 367915420 /nfs/dbraw/zinc/91/54/20/367915420.db2.gz OHHNMWGJKIJTPJ-QJPTWQEYSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+]CC1Cc2ccccc2C1 ZINC000386443283 367972410 /nfs/dbraw/zinc/97/24/10/367972410.db2.gz QFILRRUBXRTUQN-CYBMUJFWSA-N 2 0 246.398 2.331 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+]CC1Cc2ccccc2C1 ZINC000386443285 367972701 /nfs/dbraw/zinc/97/27/01/367972701.db2.gz QFILRRUBXRTUQN-ZDUSSCGKSA-N 2 0 246.398 2.331 20 0 BEADRP CC(C)OCCCC[NH2+][C@@H](C)[C@@H]1CCCC[NH2+]1 ZINC000386476569 367979171 /nfs/dbraw/zinc/97/91/71/367979171.db2.gz RIVRHRYZKDOFQG-KBPBESRZSA-N 2 0 242.407 2.312 20 0 BEADRP CC(C)COCCC[NH2+][C@@H](C)[C@@H]1CCCC[NH2+]1 ZINC000386489159 367980510 /nfs/dbraw/zinc/98/05/10/367980510.db2.gz UDBCZNNMQBMIBI-KBPBESRZSA-N 2 0 242.407 2.169 20 0 BEADRP CC[C@H]([NH2+][C@H](C)C[C@@H]1CCCCC[NH2+]1)[C@@H](C)O ZINC000386835786 368026084 /nfs/dbraw/zinc/02/60/84/368026084.db2.gz IOKZGIZXRVLWKV-MQYQWHSLSA-N 2 0 242.407 2.046 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@H]1CC12CCCC2 ZINC000386904372 368032317 /nfs/dbraw/zinc/03/23/17/368032317.db2.gz BUBLCZZBUMNFJI-NEPJUHHUSA-N 2 0 210.365 2.426 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+][C@@H]1CC12CCCC2 ZINC000387155249 368072163 /nfs/dbraw/zinc/07/21/63/368072163.db2.gz QAVXEBPTMQLYIX-QJPTWQEYSA-N 2 0 208.349 2.036 20 0 BEADRP CCSCC[NH2+]C(C)(C)CCC[NH+](C)C ZINC000387348989 368159013 /nfs/dbraw/zinc/15/90/13/368159013.db2.gz RTXRCKQDSAZBGI-UHFFFAOYSA-N 2 0 232.437 2.450 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@H]2CCC(F)(F)C2)CC1 ZINC000387443073 368194067 /nfs/dbraw/zinc/19/40/67/368194067.db2.gz SMSJUSBBZIHKQX-NSHDSACASA-N 2 0 246.345 2.496 20 0 BEADRP C[NH+](C)CCCC(C)(C)[NH2+]C[C@@H]1CCCOC1 ZINC000387248924 368135849 /nfs/dbraw/zinc/13/58/49/368135849.db2.gz YOUBDZQOWNYDHS-ZDUSSCGKSA-N 2 0 242.407 2.123 20 0 BEADRP Cn1ccc(C[NH2+]C(C)(C)CCC[NH+](C)C)c1 ZINC000387288320 368141366 /nfs/dbraw/zinc/14/13/66/368141366.db2.gz HPSKZRGTYFUSSA-UHFFFAOYSA-N 2 0 237.391 2.235 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CCC[NH+](C)C)C[C@H]1C ZINC000101635009 368377448 /nfs/dbraw/zinc/37/74/48/368377448.db2.gz HZVHIPHFEIJXIH-UPJWGTAASA-N 2 0 212.381 2.352 20 0 BEADRP [NH3+]C[C@@H]1CC[C@H]([NH2+]C2CCCCCC2)C1 ZINC000335581023 181436051 /nfs/dbraw/zinc/43/60/51/181436051.db2.gz LASPKMBKWRQNTO-YPMHNXCESA-N 2 0 210.365 2.426 20 0 BEADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+][C@H]2CCC[C@H]2C)C1 ZINC000083390740 368771973 /nfs/dbraw/zinc/77/19/73/368771973.db2.gz HEWSJGGECOMNGV-RDBSUJKOSA-N 2 0 224.392 2.495 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]CCc2cccs2)C1 ZINC000086402012 368880312 /nfs/dbraw/zinc/88/03/12/368880312.db2.gz KCILGDIMEMQHAH-GHMZBOCLSA-N 2 0 224.373 2.150 20 0 BEADRP C[N@@H+]1CCCC[C@@H](C[NH2+][C@H]2CCCSC2)C1 ZINC000623656993 368997245 /nfs/dbraw/zinc/99/72/45/368997245.db2.gz HHZAHOAAHCZMRE-STQMWFEESA-N 2 0 242.432 2.204 20 0 BEADRP C[N@@H+]1CCCC[C@@H](C[NH2+]CC2(C)CC2)C1 ZINC000623657114 368998149 /nfs/dbraw/zinc/99/81/49/368998149.db2.gz KASYQPNCMNYYIV-LBPRGKRZSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)C1CC1 ZINC000623655835 368991152 /nfs/dbraw/zinc/99/11/52/368991152.db2.gz GZPJSKKWKHMYDS-NEPJUHHUSA-N 2 0 210.365 2.106 20 0 BEADRP FCCC1CC[NH+](CC[C@H]2CC[NH2+]C2)CC1 ZINC000631836485 369078599 /nfs/dbraw/zinc/07/85/99/369078599.db2.gz AATAVFIVSCHWHT-CYBMUJFWSA-N 2 0 228.355 2.058 20 0 BEADRP FCCC1CC[NH+](CC[C@@H]2CC[NH2+]C2)CC1 ZINC000631836486 369078859 /nfs/dbraw/zinc/07/88/59/369078859.db2.gz AATAVFIVSCHWHT-ZDUSSCGKSA-N 2 0 228.355 2.058 20 0 BEADRP CCC[NH+]1CCC(C[NH2+]CC2(F)CC2)CC1 ZINC000309957514 326176914 /nfs/dbraw/zinc/17/69/14/326176914.db2.gz JDMBJOTTXARTSC-UHFFFAOYSA-N 2 0 228.355 2.200 20 0 BEADRP Cc1ccc(F)cc1C[N@H+]1C[C@H](C)[C@H](C[NH3+])C1 ZINC000631837386 369093870 /nfs/dbraw/zinc/09/38/70/369093870.db2.gz BADIHTYRQLVLSP-WCQYABFASA-N 2 0 236.334 2.161 20 0 BEADRP CCc1ccccc1C[N@@H+]1C[C@H](C)[C@H](C[NH3+])C1 ZINC000631839061 369123912 /nfs/dbraw/zinc/12/39/12/369123912.db2.gz ZJCXDUNNDPNVOU-SWLSCSKDSA-N 2 0 232.371 2.276 20 0 BEADRP C[NH+](C)CCC[NH2+]C1CC(C(C)(C)C)C1 ZINC000459363878 203266298 /nfs/dbraw/zinc/26/62/98/203266298.db2.gz ITPAYLCMZDGGKE-UHFFFAOYSA-N 2 0 212.381 2.352 20 0 BEADRP CCc1ccc(CC[N@@H+]2C[C@H](C)[C@H](C[NH3+])C2)cc1 ZINC000631840943 369340292 /nfs/dbraw/zinc/34/02/92/369340292.db2.gz WQTONGNTXKWMFM-XJKSGUPXSA-N 2 0 246.398 2.318 20 0 BEADRP C[C@H](Cc1ccsc1)N[C@H](C)[C@@H]1CCC[NH2+]1 ZINC000400483038 369350006 /nfs/dbraw/zinc/35/00/06/369350006.db2.gz WPTAGDQTUUEHOP-WZRBSPASSA-N 2 0 238.400 2.409 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC000459730471 203336904 /nfs/dbraw/zinc/33/69/04/203336904.db2.gz KDTKJUNAPPZDIW-RDBSUJKOSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@H](C)C[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC000459723599 203342104 /nfs/dbraw/zinc/34/21/04/203342104.db2.gz AGPISJSQXYJKFF-QWHCGFSZSA-N 2 0 212.381 2.354 20 0 BEADRP Cc1ccc(C[NH2+]CC[C@H]2CCC[N@@H+](C)C2)o1 ZINC000459732737 203344424 /nfs/dbraw/zinc/34/44/24/203344424.db2.gz MTTNCEFQVMZDPM-CYBMUJFWSA-N 2 0 236.359 2.410 20 0 BEADRP CCSCC[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC000459732364 203345403 /nfs/dbraw/zinc/34/54/03/203345403.db2.gz FUHXCPAECHWHGK-LBPRGKRZSA-N 2 0 230.421 2.061 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC000459776119 203364418 /nfs/dbraw/zinc/36/44/18/203364418.db2.gz KCANJWWJJMKGRC-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CSC[C@H]1[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC000459798036 203373295 /nfs/dbraw/zinc/37/32/95/203373295.db2.gz XKELHXXGWGDTRY-FRRDWIJNSA-N 2 0 242.432 2.059 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC000459795984 203374141 /nfs/dbraw/zinc/37/41/41/203374141.db2.gz VRKWLJLPCUYNJB-GXTWGEPZSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)OC[C@H](C)[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC000459783998 203368332 /nfs/dbraw/zinc/36/83/32/203368332.db2.gz NSWPMSRNVOFYRG-KBPBESRZSA-N 2 0 242.407 2.121 20 0 BEADRP COc1ccc(C)cc1C[N@@H+]1C[C@H](C[NH3+])C[C@H]1C ZINC000252698588 370116793 /nfs/dbraw/zinc/11/67/93/370116793.db2.gz NYKAIWCVHBKNNN-OLZOCXBDSA-N 2 0 248.370 2.173 20 0 BEADRP CCOc1ccc(C[N@@H+]2CC[C@H]([C@H](C)[NH3+])C2)cc1 ZINC000252754357 370122783 /nfs/dbraw/zinc/12/27/83/370122783.db2.gz BAXMBCKYOZUBNV-JSGCOSHPSA-N 2 0 248.370 2.254 20 0 BEADRP C[C@H]1CC[C@@H]1[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000309803226 370263476 /nfs/dbraw/zinc/26/34/76/370263476.db2.gz RONQYCUXIYPODQ-FZMZJTMJSA-N 2 0 222.376 2.249 20 0 BEADRP CC[C@H]1CC[C@@H]1[NH2+]CC1CC[NH+](CC)CC1 ZINC000310024672 370290310 /nfs/dbraw/zinc/29/03/10/370290310.db2.gz OQTWQXYZJREBFX-KBPBESRZSA-N 2 0 224.392 2.497 20 0 BEADRP CC1CC(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)C1 ZINC000621384336 370328365 /nfs/dbraw/zinc/32/83/65/370328365.db2.gz CCIHNBZXGNMDBN-PQAZSJQKSA-N 2 0 222.376 2.249 20 0 BEADRP CC[C@@H](C)[C@@H](C)[NH2+]CCCC[NH+]1CCOCC1 ZINC000158739512 326341265 /nfs/dbraw/zinc/34/12/65/326341265.db2.gz GFVOZJSLPNZGNM-ZIAGYGMSSA-N 2 0 242.407 2.123 20 0 BEADRP CC1CC(C[NH2+][C@@H]2CC[N@H+](C)[C@@H]3CCC[C@H]32)C1 ZINC000621770701 370513752 /nfs/dbraw/zinc/51/37/52/370513752.db2.gz WFDRFPFFVSSKDE-MMCPYJTDSA-N 2 0 236.403 2.495 20 0 BEADRP CC1CC(C[NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)C1 ZINC000621771812 370514518 /nfs/dbraw/zinc/51/45/18/370514518.db2.gz NGKGNURXKTWFEF-POOIEITISA-N 2 0 210.365 2.105 20 0 BEADRP Cc1cc(CN2CCCC[C@@H]2[C@H](C)[NH3+])ccn1 ZINC000621773961 370518532 /nfs/dbraw/zinc/51/85/32/370518532.db2.gz HDOABOUUNYZBDA-GXTWGEPZSA-N 2 0 233.359 2.092 20 0 BEADRP CC1CC(C[NH2+]C2CC[NH+](CC3CC3)CC2)C1 ZINC000621739329 370496998 /nfs/dbraw/zinc/49/69/98/370496998.db2.gz DGASVZNDXSUGOV-UHFFFAOYSA-N 2 0 236.403 2.497 20 0 BEADRP C[NH+](C/C=C\C[N@@H+](C)CC1CC1)CC1CC1 ZINC000255416060 370528513 /nfs/dbraw/zinc/52/85/13/370528513.db2.gz HSEBIYRUBYFMAL-ARJAWSKDSA-N 2 0 222.376 2.226 20 0 BEADRP [NH3+][C@@]12CCC[C@@H]1C[N@H+](CCC1CCCC1)C2 ZINC000621781271 370529915 /nfs/dbraw/zinc/52/99/15/370529915.db2.gz BOANVBXGJBODHR-ZIAGYGMSSA-N 2 0 222.376 2.380 20 0 BEADRP CCC(CC)C[N@@H+]1C[C@H]2CCC[C@]2([NH3+])C1 ZINC000621784131 370535181 /nfs/dbraw/zinc/53/51/81/370535181.db2.gz KIIBIYMXVHTOAC-OLZOCXBDSA-N 2 0 210.365 2.236 20 0 BEADRP C/C=C\C[NH2+]Cc1cn(-c2cc[nH+]cc2)nc1C ZINC000623739930 371074511 /nfs/dbraw/zinc/07/45/11/371074511.db2.gz KDKSGGUGEUNJQN-ARJAWSKDSA-N 2 0 242.326 2.241 20 0 BEADRP C[C@@H](Cc1ccccc1)C[N@H+](C)CCC[NH3+] ZINC000568983397 326384480 /nfs/dbraw/zinc/38/44/80/326384480.db2.gz IAQJNLOSKYOPEP-ZDUSSCGKSA-N 2 0 220.360 2.146 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)c1ccncc1 ZINC000624122644 371323523 /nfs/dbraw/zinc/32/35/23/371323523.db2.gz XNAKRCPUCLYEIP-KBPBESRZSA-N 2 0 247.386 2.464 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@H]2CCCC[N@H+](C)C2)[C@@H]1C ZINC000624124122 371325121 /nfs/dbraw/zinc/32/51/21/371325121.db2.gz XTDSHSXYNFRKQQ-SYQHCUMBSA-N 2 0 224.392 2.352 20 0 BEADRP CN1CCC[C@H]1C[NH2+][C@H]1[C@@H]2CCC[C@@H]2C1(C)C ZINC000624271753 371453397 /nfs/dbraw/zinc/45/33/97/371453397.db2.gz CNGHRRQPCDGSJF-CRWXNKLISA-N 2 0 236.403 2.495 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+]Cc2ccccc2)C12CCC2 ZINC000405376886 372156729 /nfs/dbraw/zinc/15/67/29/372156729.db2.gz BQCBAMXXVGRKBG-QWHCGFSZSA-N 2 0 216.328 2.046 20 0 BEADRP C[C@@H]1OCC[C@@H]1[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000134203724 372179782 /nfs/dbraw/zinc/17/97/82/372179782.db2.gz YFFZSPSKQKTXJO-AAEUAGOBSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CC[N@H+](C)C(C)(C)C2)[C@@H](C)O1 ZINC000631218277 372239904 /nfs/dbraw/zinc/23/99/04/372239904.db2.gz MHSCYJOFIRUHJD-NDBYEHHHSA-N 2 0 240.391 2.015 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@H]1CCCc2ncccc21 ZINC000631577456 372436538 /nfs/dbraw/zinc/43/65/38/372436538.db2.gz SJUDRONUEFVOOH-AWEZNQCLSA-N 2 0 247.386 2.390 20 0 BEADRP Cc1cc(C)c(C[N@H+]2C[C@H](C[NH3+])C[C@H]2C)c(C)n1 ZINC000631822441 372598557 /nfs/dbraw/zinc/59/85/57/372598557.db2.gz DETYDOCUIBQAKA-OCCSQVGLSA-N 2 0 247.386 2.176 20 0 BEADRP [NH3+][C@]12CCC[C@@H]1C[N@H+](C[C@H]1CCC(F)(F)C1)C2 ZINC000631829877 372612600 /nfs/dbraw/zinc/61/26/00/372612600.db2.gz CLTHGTRRPQQNHL-TUAOUCFPSA-N 2 0 244.329 2.235 20 0 BEADRP C[C@H](c1cccnc1)N1CCCCC[C@H]([NH3+])C1 ZINC000631834447 372617619 /nfs/dbraw/zinc/61/76/19/372617619.db2.gz XJTUKVPYGJJBHC-OCCSQVGLSA-N 2 0 233.359 2.346 20 0 BEADRP FCCC1CC[NH+](C[C@H]2CCC[NH2+]C2)CC1 ZINC000631836915 372625050 /nfs/dbraw/zinc/62/50/50/372625050.db2.gz JJSGVSOEQQZWTN-ZDUSSCGKSA-N 2 0 228.355 2.058 20 0 BEADRP Cc1ccc(C[N@@H+]2C[C@@H](C[NH3+])[C@H](C)C2)cc1C ZINC000631837646 372629459 /nfs/dbraw/zinc/62/94/59/372629459.db2.gz DMPVVFJVZVNNRC-UKRRQHHQSA-N 2 0 232.371 2.330 20 0 BEADRP C[C@@H]1C[N@H+](CCC2CCCC2)C[C@H]1C[NH3+] ZINC000631839947 372635952 /nfs/dbraw/zinc/63/59/52/372635952.db2.gz NEVFXQZDWVQKFL-DGCLKSJQSA-N 2 0 210.365 2.093 20 0 BEADRP Cc1cccc(C[N@@H+]2C[C@@H](C[NH3+])[C@H](C)C2)c1 ZINC000631843883 372641373 /nfs/dbraw/zinc/64/13/73/372641373.db2.gz STYARPQHRUTRHL-TZMCWYRMSA-N 2 0 218.344 2.022 20 0 BEADRP CC1(F)CC[NH+](CC[C@@H]2CCC[NH2+]C2)CC1 ZINC000631867641 372669238 /nfs/dbraw/zinc/66/92/38/372669238.db2.gz YGZAJBUNMPWEJN-LBPRGKRZSA-N 2 0 228.355 2.200 20 0 BEADRP CC1(F)CC[NH+](CC[C@H]2CCC[NH2+]C2)CC1 ZINC000631867640 372669646 /nfs/dbraw/zinc/66/96/46/372669646.db2.gz YGZAJBUNMPWEJN-GFCCVEGCSA-N 2 0 228.355 2.200 20 0 BEADRP C([C@H]1CC[NH2+]C1)[N@@H+]1CCC[C@@H](C2CCC2)CC1 ZINC000631873776 372675417 /nfs/dbraw/zinc/67/54/17/372675417.db2.gz WBCADJVWECMQBS-DZGCQCFKSA-N 2 0 236.403 2.498 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC[C@@H]2CCCCO2)CC[N@@H+]1C ZINC000180255790 205657609 /nfs/dbraw/zinc/65/76/09/205657609.db2.gz OLSMRPWOAZGNDL-MCIONIFRSA-N 2 0 240.391 2.018 20 0 BEADRP COC[C@@H](CC(C)C)[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000414961086 205795013 /nfs/dbraw/zinc/79/50/13/205795013.db2.gz IHNFNNIUBIPRGO-UONOGXRCSA-N 2 0 242.407 2.169 20 0 BEADRP CCC[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000246559600 374274111 /nfs/dbraw/zinc/27/41/11/374274111.db2.gz KUKRNAUGFUSGAA-JSGCOSHPSA-N 2 0 222.376 2.345 20 0 BEADRP CC(C)(C)CC[N@@H+]1C[C@@H]2CCC[NH2+][C@@H]2C1 ZINC000220397764 134306631 /nfs/dbraw/zinc/30/66/31/134306631.db2.gz PQWKLFZYNVQFFC-NWDGAFQWSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CCCC[C@H]1[NH3+] ZINC000424369445 206039764 /nfs/dbraw/zinc/03/97/64/206039764.db2.gz BVCLEFGVFWBPDF-FVCCEPFGSA-N 2 0 210.365 2.425 20 0 BEADRP CCC[NH+]1CCC(C[NH2+][C@H](C)[C@H](C)OC)CC1 ZINC000361156065 169186791 /nfs/dbraw/zinc/18/67/91/169186791.db2.gz QPROAIYPBCARSO-OLZOCXBDSA-N 2 0 242.407 2.121 20 0 BEADRP CCC[NH+]1CCC(CNc2cc[nH+]cc2C)CC1 ZINC000357228807 169187436 /nfs/dbraw/zinc/18/74/36/169187436.db2.gz RVLYKHHJMGAWLW-UHFFFAOYSA-N 2 0 247.386 2.346 20 0 BEADRP CCC[NH+]1CCC([NH2+]CC2(C(F)F)CC2)CC1 ZINC000355144110 169187815 /nfs/dbraw/zinc/18/78/15/169187815.db2.gz CJUNFLHXLSMBDI-UHFFFAOYSA-N 2 0 246.345 2.496 20 0 BEADRP CCC[NH+]1CCC([NH2+]CC[C@H](C)F)CC1 ZINC000340467109 169188033 /nfs/dbraw/zinc/18/80/33/169188033.db2.gz OLHCDWRDCVOZPR-NSHDSACASA-N 2 0 216.344 2.199 20 0 BEADRP CCC[NH+]1CCC([NH2+]C2CC(F)(F)C2)CC1 ZINC000336671570 169188080 /nfs/dbraw/zinc/18/80/80/169188080.db2.gz ANWSTTIGCKVTKJ-UHFFFAOYSA-N 2 0 232.318 2.248 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H]2CC[C@H]2SC)CC1 ZINC000336682071 169189517 /nfs/dbraw/zinc/18/95/17/169189517.db2.gz DFNVARZACSFRKP-QWHCGFSZSA-N 2 0 242.432 2.344 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H](C)COC(C)C)CC1 ZINC000337337856 169189579 /nfs/dbraw/zinc/18/95/79/169189579.db2.gz NEVPHWVJLFNPCB-ZDUSSCGKSA-N 2 0 242.407 2.264 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+]C2CC(CC)C2)C1 ZINC000336779298 169206548 /nfs/dbraw/zinc/20/65/48/169206548.db2.gz NWVPPYRPJVSWCT-MOKVOYLWSA-N 2 0 224.392 2.497 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+]C2CC(C)(C)C2)C1 ZINC000336781278 169206666 /nfs/dbraw/zinc/20/66/66/169206666.db2.gz UFNCUIPRWCHFME-GFCCVEGCSA-N 2 0 224.392 2.497 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccncc2)C1 ZINC000156487792 169209268 /nfs/dbraw/zinc/20/92/68/169209268.db2.gz GOEDZZMCOMJCIJ-UONOGXRCSA-N 2 0 247.386 2.464 20 0 BEADRP c1cc(C[NH2+]CCC[C@@H]2CCC[NH2+]2)cs1 ZINC000336754636 183350274 /nfs/dbraw/zinc/35/02/74/183350274.db2.gz ILFYBDMADIWZKB-GFCCVEGCSA-N 2 0 224.373 2.370 20 0 BEADRP CCC[NH2+]Cc1ccc(OCC[NH+](C)C)cc1 ZINC000033465880 169268430 /nfs/dbraw/zinc/26/84/30/169268430.db2.gz NSXQHTYIRMWQRW-UHFFFAOYSA-N 2 0 236.359 2.127 20 0 BEADRP CCC[C@@H](C)C[N@@H+]1CCC[C@]2(CC[NH2+]C2)C1 ZINC000352539759 169358051 /nfs/dbraw/zinc/35/80/51/169358051.db2.gz CMAJSUOCDKYPOS-ZIAGYGMSSA-N 2 0 224.392 2.498 20 0 BEADRP CCC(CC)C[N@@H+]1CC[C@@H](C[NH+](C)C)C1 ZINC000179884880 134325199 /nfs/dbraw/zinc/32/51/99/134325199.db2.gz UTBFORRTNZPADB-ZDUSSCGKSA-N 2 0 212.381 2.306 20 0 BEADRP CCC(CC)C[N@@H+]1C[C@H]2CCC[NH2+][C@@H]2C1 ZINC000221394144 134324015 /nfs/dbraw/zinc/32/40/15/134324015.db2.gz KBMZFPYRLFLGLF-CHWSQXEVSA-N 2 0 210.365 2.106 20 0 BEADRP c1csc(C[NH2+]CCC[C@@H]2CCC[NH2+]2)c1 ZINC000336745857 183518764 /nfs/dbraw/zinc/51/87/64/183518764.db2.gz BMPAJVWENDEREP-LLVKDONJSA-N 2 0 224.373 2.370 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+]CCC1CC[NH+](C)CC1 ZINC000336744452 171057748 /nfs/dbraw/zinc/05/77/48/171057748.db2.gz UYVCLFXUGCCYCG-ZIAGYGMSSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H]1CC[C@H](C)[N@@H+]1CC[C@H]1CC[NH2+]C1 ZINC000251686717 171053732 /nfs/dbraw/zinc/05/37/32/171053732.db2.gz PPSWVQXXPHDNNZ-YNEHKIRRSA-N 2 0 210.365 2.249 20 0 BEADRP CS[C@@H]1CCC[C@H]([NH2+][C@@H]2CCC[C@@H]2C[NH3+])C1 ZINC000235234611 383871514 /nfs/dbraw/zinc/87/15/14/383871514.db2.gz NIVIQGCIOSYNSZ-YVECIDJPSA-N 2 0 242.432 2.378 20 0 BEADRP C[C@H]1OCC[C@H]1[NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000119892140 383913262 /nfs/dbraw/zinc/91/32/62/383913262.db2.gz KZUBRNOTIIBNDQ-ZYHUDNBSSA-N 2 0 240.391 2.063 20 0 BEADRP COC1(C[N@H+](C)CCC[NH+](C)C)CCCCC1 ZINC000558416531 383993170 /nfs/dbraw/zinc/99/31/70/383993170.db2.gz XMOOGBBZMNVRNH-UHFFFAOYSA-N 2 0 242.407 2.219 20 0 BEADRP C1CC1C([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)C1CC1 ZINC000643546529 384014486 /nfs/dbraw/zinc/01/44/86/384014486.db2.gz QFLOIVDLVGRIPS-CYBMUJFWSA-N 2 0 234.387 2.439 20 0 BEADRP CCC[C@@H](C)C[N@@H+]1CC[C@@]2(C1)CCC[NH2+]C2 ZINC000564973523 384053577 /nfs/dbraw/zinc/05/35/77/384053577.db2.gz NRQKIIISPOKHPD-KGLIPLIRSA-N 2 0 224.392 2.498 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CC2(C)CCC2)[C@H](C)C1 ZINC000090219868 384036394 /nfs/dbraw/zinc/03/63/94/384036394.db2.gz IFGIANBTQISFAK-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CC[NH2+]C3(CCC3)C2)[C@@H]1C ZINC000643548786 384037633 /nfs/dbraw/zinc/03/76/33/384037633.db2.gz VEQKJTLVHHFPMI-NDBYEHHHSA-N 2 0 222.376 2.295 20 0 BEADRP CCC[C@H](C[NH2+][C@H]1CC[N@H+](CC)C[C@@H]1C)OC ZINC000449379261 384078615 /nfs/dbraw/zinc/07/86/15/384078615.db2.gz SIXIEUORTKRGRO-MJBXVCDLSA-N 2 0 242.407 2.121 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@H]([NH3+])[C@@H](C)C2)s1 ZINC000224085434 384128556 /nfs/dbraw/zinc/12/85/56/384128556.db2.gz SFSULZYIBGSAOM-CABZTGNLSA-N 2 0 224.373 2.226 20 0 BEADRP C[NH2+]CCC[N@@H+]1[C@H](C)C[C@H]2CCCC[C@@H]21 ZINC000309636651 384184870 /nfs/dbraw/zinc/18/48/70/384184870.db2.gz MYGIERPFAZSWBT-UPJWGTAASA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H]([NH+](C)C)C2)[C@@H](C)O1 ZINC000449178573 384205440 /nfs/dbraw/zinc/20/54/40/384205440.db2.gz XPNPLKVPIHHRMZ-POQQGIQPSA-N 2 0 240.391 2.015 20 0 BEADRP Cc1cc(C)cc(C[N@@H+](C)C2CC[NH2+]CC2)c1 ZINC000036300612 384233982 /nfs/dbraw/zinc/23/39/82/384233982.db2.gz SLHVHNAGUUNJRO-UHFFFAOYSA-N 2 0 232.371 2.487 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CCC1CC1 ZINC000422916859 384214085 /nfs/dbraw/zinc/21/40/85/384214085.db2.gz BSLZCPCOMBDPGZ-SNVBAGLBSA-N 2 0 233.359 2.299 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CCC[C@H]3C[C@H]32)C1 ZINC000558700118 384252116 /nfs/dbraw/zinc/25/21/16/384252116.db2.gz PJECVSPMODDHMB-LXTVHRRPSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CCC[N@H+](CC2CCCC2)C1 ZINC000082645630 384253128 /nfs/dbraw/zinc/25/31/28/384253128.db2.gz YACRAAHCUORGQV-WCQYABFASA-N 2 0 210.365 2.236 20 0 BEADRP CC[C@](C)(C[NH2+]C[C@H](C)C[NH+]1CCCC1)OC ZINC000319536618 384254030 /nfs/dbraw/zinc/25/40/30/384254030.db2.gz AXNBFQLWKBSQPC-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)[C@@H](C)[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000319502730 384256943 /nfs/dbraw/zinc/25/69/43/384256943.db2.gz JEDBJFRVNMTNAK-NEPJUHHUSA-N 2 0 210.365 2.295 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccc(F)cc3)C[C@H]21 ZINC000228471953 384257181 /nfs/dbraw/zinc/25/71/81/384257181.db2.gz CJUGFXOBRUGASE-BPLDGKMQSA-N 2 0 248.345 2.385 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]2C[N@H+](CCc3ccccc3)C[C@H]21 ZINC000228471943 384257257 /nfs/dbraw/zinc/25/72/57/384257257.db2.gz JJPZCAXYXGHNLE-ARFHVFGLSA-N 2 0 244.382 2.288 20 0 BEADRP C[C@H](C[NH2+]C1CCN(C2CC2)CC1)CC(F)F ZINC000647319770 384266024 /nfs/dbraw/zinc/26/60/24/384266024.db2.gz LHXUMNXMMNECDM-JTQLQIEISA-N 2 0 246.345 2.494 20 0 BEADRP CC(C)[N@H+](CCC[NH3+])Cc1ccccc1 ZINC000011953195 384304712 /nfs/dbraw/zinc/30/47/12/384304712.db2.gz BDHPJWSPJJFUKH-UHFFFAOYSA-N 2 0 206.333 2.246 20 0 BEADRP CC(C)CCC[N@@H+]1CC[C@H]2[NH2+]CC[C@@H]2C1 ZINC000308823637 384313589 /nfs/dbraw/zinc/31/35/89/384313589.db2.gz HFEDIZAONRTMOW-CHWSQXEVSA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H]1CC[N@H+](CC)C1)C1CC1 ZINC000083055491 384278944 /nfs/dbraw/zinc/27/89/44/384278944.db2.gz UFFBWFOMBNABCF-WCQYABFASA-N 2 0 210.365 2.106 20 0 BEADRP CCC[N@H+](CC[C@H]1CCC[NH+]1C)C1CC1 ZINC000179422377 384289675 /nfs/dbraw/zinc/28/96/75/384289675.db2.gz VZPCDRCBSABSDQ-GFCCVEGCSA-N 2 0 210.365 2.345 20 0 BEADRP C[C@H]1C[C@H]1C[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000159042119 384296982 /nfs/dbraw/zinc/29/69/82/384296982.db2.gz FCODEVGEWKTVMJ-STQMWFEESA-N 2 0 245.370 2.296 20 0 BEADRP C[C@H]1CN(C)C[C@@H]1[NH2+]CC1CCCCCC1 ZINC000309736244 384357704 /nfs/dbraw/zinc/35/77/04/384357704.db2.gz CKOMRZAQUNXFRC-JSGCOSHPSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]CC1(C)CC1 ZINC000300359086 384357771 /nfs/dbraw/zinc/35/77/71/384357771.db2.gz MNCPLLRIZULHKZ-GRYCIOLGSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)CO1 ZINC000401979192 384361346 /nfs/dbraw/zinc/36/13/46/384361346.db2.gz ZJRACUSDOSFLLY-GHMZBOCLSA-N 2 0 240.391 2.063 20 0 BEADRP CC1(C)[C@@H]([NH3+])C[C@@H]1[NH2+]CCCCC(F)(F)F ZINC000405472054 384367821 /nfs/dbraw/zinc/36/78/21/384367821.db2.gz LBXWLWOHGLLRRV-IUCAKERBSA-N 2 0 238.297 2.434 20 0 BEADRP COCC[C@H](C)[NH2+]C[C@H](C)C[NH+]1CCCCC1 ZINC000045037481 384372173 /nfs/dbraw/zinc/37/21/73/384372173.db2.gz ABVYPXZFGVKVDP-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@@H]2CC[C@@H]2C)CC1 ZINC000308827256 384325603 /nfs/dbraw/zinc/32/56/03/384325603.db2.gz SMVXJYZLIVOENE-WCQYABFASA-N 2 0 210.365 2.247 20 0 BEADRP C[C@H]([NH2+]CCCC[NH+](C)C)c1ccc(F)cn1 ZINC000133999778 384325764 /nfs/dbraw/zinc/32/57/64/384325764.db2.gz SKHCCSZKYHSLTB-NSHDSACASA-N 2 0 239.338 2.213 20 0 BEADRP C[N@@H+](Cc1cccc(O)c1)CC1CC[NH+](C)CC1 ZINC000134007076 384326184 /nfs/dbraw/zinc/32/61/84/384326184.db2.gz AHPYYXSEPAGWPE-UHFFFAOYSA-N 2 0 248.370 2.166 20 0 BEADRP CC1(C)[C@@H]([NH3+])C[C@@H]1[NH2+]CCCc1ccccc1 ZINC000405431071 384330978 /nfs/dbraw/zinc/33/09/78/384330978.db2.gz AXRFRLMRLQEOND-KBPBESRZSA-N 2 0 232.371 2.335 20 0 BEADRP CCCC[N@H+](CC[C@H]1CC[NH2+]C1)C1CC1 ZINC000084385229 384392691 /nfs/dbraw/zinc/39/26/91/384392691.db2.gz ANFROEKORSERCL-GFCCVEGCSA-N 2 0 210.365 2.251 20 0 BEADRP CC1(CN(CC[NH3+])Cc2ccccc2)CC1 ZINC000647512972 384414862 /nfs/dbraw/zinc/41/48/62/384414862.db2.gz ZOXWUILYAYBJCL-UHFFFAOYSA-N 2 0 218.344 2.247 20 0 BEADRP Cc1ccoc1CNC[C@H](C)C[NH+]1CCCC1 ZINC000135152642 384418828 /nfs/dbraw/zinc/41/88/28/384418828.db2.gz IPYCMAMWKDJUCM-LBPRGKRZSA-N 2 0 236.359 2.410 20 0 BEADRP c1csc(CN2CC[C@H]3CC[C@@H](C2)[NH2+]3)c1 ZINC000169035232 384389065 /nfs/dbraw/zinc/38/90/65/384389065.db2.gz BLXIZSJAUOECEF-MNOVXSKESA-N 2 0 222.357 2.074 20 0 BEADRP C[N@H+](CCC[NH3+])Cc1cccc(OC(F)F)c1 ZINC000560961454 384425785 /nfs/dbraw/zinc/42/57/85/384425785.db2.gz UMVGGFBRSOFBJS-UHFFFAOYSA-N 2 0 244.285 2.069 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)CC(F)F ZINC000647227017 384438116 /nfs/dbraw/zinc/43/81/16/384438116.db2.gz MHPXLQQJUSHISC-SDDRHHMPSA-N 2 0 246.345 2.494 20 0 BEADRP C[C@H]([NH2+]CCC[NH+]1CCCC1)C1(C)CC1 ZINC000037468214 384501239 /nfs/dbraw/zinc/50/12/39/384501239.db2.gz HNTLMJNTOPOOON-LBPRGKRZSA-N 2 0 210.365 2.251 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CC=C(C)CC2)C1 ZINC000556816633 384502068 /nfs/dbraw/zinc/50/20/68/384502068.db2.gz FMIXTCSQHNRAQL-ZIAGYGMSSA-N 2 0 222.376 2.417 20 0 BEADRP CC(C)CSCC[NH2+][C@@H]1CCC[C@@H]1C[NH3+] ZINC000397341845 384508150 /nfs/dbraw/zinc/50/81/50/384508150.db2.gz QMLDXLZKVPFHIC-VXGBXAGGSA-N 2 0 230.421 2.093 20 0 BEADRP FC1(F)CC([NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)C1 ZINC000309484230 384542418 /nfs/dbraw/zinc/54/24/18/384542418.db2.gz FRNJNHCAKCDLGK-GXSJLCMTSA-N 2 0 230.302 2.001 20 0 BEADRP C[NH2+]CC1CC[NH+](C[C@@H]2CCC(F)(F)C2)CC1 ZINC000305918559 384550972 /nfs/dbraw/zinc/55/09/72/384550972.db2.gz BHKZXSQGBCZTGH-GFCCVEGCSA-N 2 0 246.345 2.353 20 0 BEADRP Cc1cccc(CC[NH2+][C@@H]2CCCCC[C@H]2[NH3+])n1 ZINC000423081066 384552610 /nfs/dbraw/zinc/55/26/10/384552610.db2.gz AZUGCOSXVPOMGW-HUUCEWRRSA-N 2 0 247.386 2.182 20 0 BEADRP CSC1(C[NH2+][C@@H]2CCC[C@@H]([NH+](C)C)C2)CC1 ZINC000309728990 384559105 /nfs/dbraw/zinc/55/91/05/384559105.db2.gz ZABOWUIHRNPWNX-VXGBXAGGSA-N 2 0 242.432 2.344 20 0 BEADRP C[C@@H]1C[C@H]1C[NH2+]CCC[N@@H+]1CCCC[C@H]1C ZINC000309732272 384572722 /nfs/dbraw/zinc/57/27/22/384572722.db2.gz BLMSQLBBNLNNAT-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)[C@H](C)[NH2+]C[C@@H]1CC[N@@H+](C(C)C)C1 ZINC000040621547 384589483 /nfs/dbraw/zinc/58/94/83/384589483.db2.gz AFXVSPFALRJPHW-STQMWFEESA-N 2 0 212.381 2.351 20 0 BEADRP Cc1cccc(CC[NH2+][C@@H]2CCCC[C@H]2C[NH3+])n1 ZINC000423087187 384564822 /nfs/dbraw/zinc/56/48/22/384564822.db2.gz OYTOHPRLWLQLLY-DZGCQCFKSA-N 2 0 247.386 2.040 20 0 BEADRP CSCCC[N@H+](C)C[C@H]1CC[NH2+][C@@H](C)C1 ZINC000300855845 384611272 /nfs/dbraw/zinc/61/12/72/384611272.db2.gz OKYQYOAACCPFOJ-RYUDHWBXSA-N 2 0 230.421 2.059 20 0 BEADRP C[C@@H]1C[C@H]1C[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000309793528 384616528 /nfs/dbraw/zinc/61/65/28/384616528.db2.gz PRIYQOQKXAXYEY-NEPJUHHUSA-N 2 0 222.376 2.249 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)C1 ZINC000568248687 384622862 /nfs/dbraw/zinc/62/28/62/384622862.db2.gz XWIVASLKZZZUOQ-NJMOYASZSA-N 2 0 208.349 2.035 20 0 BEADRP C[C@H](C[N@@H+]1CC[C@@H]2CC[NH2+][C@@H]2C1)C(C)(C)C ZINC000647533982 384645174 /nfs/dbraw/zinc/64/51/74/384645174.db2.gz CZDJFDPZPMTZOZ-FRRDWIJNSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1CCC[C@H](C[N@@H+]2CC[C@H]3CC[NH2+][C@@H]3C2)C1 ZINC000647534539 384647100 /nfs/dbraw/zinc/64/71/00/384647100.db2.gz QDUWHPUUIDELQL-LXTVHRRPSA-N 2 0 236.403 2.497 20 0 BEADRP CC(C)(C[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1)c1ccccc1 ZINC000647535594 384651756 /nfs/dbraw/zinc/65/17/56/384651756.db2.gz VMMYBKDQLXDCAU-OKILXGFUSA-N 2 0 244.382 2.115 20 0 BEADRP CCCCOCCC[NH2+][C@@H]1CCCC[C@@H]1C[NH3+] ZINC000160195291 384655665 /nfs/dbraw/zinc/65/56/65/384655665.db2.gz CKBMTGPZEUQJNU-ZIAGYGMSSA-N 2 0 242.407 2.300 20 0 BEADRP CC[N@H+](CCC1CC1)CC1CC[NH2+]CC1 ZINC000086703081 384679016 /nfs/dbraw/zinc/67/90/16/384679016.db2.gz IGIDSMXMXSWZOJ-UHFFFAOYSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@@H]1[NH2+]CCC[C@@H]1NCc1ccc(F)cc1 ZINC000335358484 384692528 /nfs/dbraw/zinc/69/25/28/384692528.db2.gz RYIMZEHQRKLQTP-GWCFXTLKSA-N 2 0 222.307 2.056 20 0 BEADRP CC1(C[N@@H+]2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)CC1 ZINC000647542819 384704015 /nfs/dbraw/zinc/70/40/15/384704015.db2.gz CKOIFMOWLOMTAG-UONOGXRCSA-N 2 0 236.403 2.498 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@H]1CC[C@@H]1C1CCC1 ZINC000309909407 384705443 /nfs/dbraw/zinc/70/54/43/384705443.db2.gz LTJTVPRCEDSZIW-KGLIPLIRSA-N 2 0 224.392 2.497 20 0 BEADRP FC1(C[N@@H+]2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)CC1 ZINC000647543747 384713455 /nfs/dbraw/zinc/71/34/55/384713455.db2.gz RPJHQPHJYKERLV-QWHCGFSZSA-N 2 0 240.366 2.200 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@H]2CC23CC3)CC1 ZINC000335281914 384714621 /nfs/dbraw/zinc/71/46/21/384714621.db2.gz YYBXBQVEYIZVAJ-LBPRGKRZSA-N 2 0 208.349 2.001 20 0 BEADRP C[NH+](C)CCCC[NH2+]Cc1cc(F)cc(F)c1 ZINC000125626374 384733957 /nfs/dbraw/zinc/73/39/57/384733957.db2.gz ARQZCFQVPZHBHJ-UHFFFAOYSA-N 2 0 242.313 2.396 20 0 BEADRP C[NH+](C)CCC[NH2+][C@@H]1CCC[C@@H]1CCCF ZINC000309957368 384739560 /nfs/dbraw/zinc/73/95/60/384739560.db2.gz JBHNIPNPAOFXJI-CHWSQXEVSA-N 2 0 230.371 2.446 20 0 BEADRP CCSCCC[NH2+][C@H]1CCCC[C@H]1C[NH3+] ZINC000300968118 384740004 /nfs/dbraw/zinc/74/00/04/384740004.db2.gz RNEGOWBMCJJMOR-RYUDHWBXSA-N 2 0 230.421 2.237 20 0 BEADRP C[C@]1(C[N@@H+]2CC[C@H](C3CCC3)C2)CC[NH2+]C1 ZINC000647552013 384757886 /nfs/dbraw/zinc/75/78/86/384757886.db2.gz AHNDZPNZLLLZIB-KBPBESRZSA-N 2 0 222.376 2.108 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]Cc1cccc2cnccc21 ZINC000647552023 384758815 /nfs/dbraw/zinc/75/88/15/384758815.db2.gz AOADMBAAVFLLTI-RYUDHWBXSA-N 2 0 243.354 2.450 20 0 BEADRP C[NH+](C)C1CCC([NH2+][C@@H]2CCCSC2)CC1 ZINC000309983126 384762082 /nfs/dbraw/zinc/76/20/82/384762082.db2.gz XCGXEGGVMVMTAD-OTTFEQOBSA-N 2 0 242.432 2.344 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000423220343 384780181 /nfs/dbraw/zinc/78/01/81/384780181.db2.gz YCQYVZZYHGJRFX-RWMBFGLXSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]1C[C@@H](C[NH2+]CC2CCC(F)CC2)CC[NH2+]1 ZINC000647553117 384765328 /nfs/dbraw/zinc/76/53/28/384765328.db2.gz BLZNABIQLGMAHM-ZIHBUVQPSA-N 2 0 242.382 2.492 20 0 BEADRP Fc1ccc2c(c1)[C@@H]([NH2+]CC[C@H]1CC[NH2+]C1)CC2 ZINC000423241147 384780625 /nfs/dbraw/zinc/78/06/25/384780625.db2.gz DEUKGHDMGRYJJC-ABAIWWIYSA-N 2 0 248.345 2.402 20 0 BEADRP C[C@H]([NH2+]C1CCC(F)(F)CC1)[C@@H]1CCC[NH2+]1 ZINC000335027344 384772314 /nfs/dbraw/zinc/77/23/14/384772314.db2.gz SAMUWJAOJGHRSQ-ONGXEEELSA-N 2 0 232.318 2.294 20 0 BEADRP CC(C)C[C@H](C)C[N@@H+]1CC[C@@H]([C@H](C)[NH3+])C1 ZINC000301013745 384829916 /nfs/dbraw/zinc/82/99/16/384829916.db2.gz ZEZNXFMIMGGYOE-RWMBFGLXSA-N 2 0 212.381 2.338 20 0 BEADRP CCC([NH3+])(CC)C[NH2+][C@H]1CC[C@@H]1C1CC1 ZINC000423289292 384782129 /nfs/dbraw/zinc/78/21/29/384782129.db2.gz ATJLNOUUCMEXHS-NEPJUHHUSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+][C@@H](C)CC[NH+](C)C ZINC000336757410 384871665 /nfs/dbraw/zinc/87/16/65/384871665.db2.gz YYWCOSMDHKRVFQ-NWDGAFQWSA-N 2 0 224.348 2.140 20 0 BEADRP Fc1ccc2c(c1)[C@H]([NH2+]C[C@@H]1CCC[NH2+]C1)CC2 ZINC000335516218 384882960 /nfs/dbraw/zinc/88/29/60/384882960.db2.gz JEWCTRRVQBTQLG-IAQYHMDHSA-N 2 0 248.345 2.402 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000423363737 384842770 /nfs/dbraw/zinc/84/27/70/384842770.db2.gz AGXGGRYEJPPPIL-AVGNSLFASA-N 2 0 233.359 2.311 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCC[C@H]([NH3+])C1)[C@H]1C[C@H]1C ZINC000423370254 384843025 /nfs/dbraw/zinc/84/30/25/384843025.db2.gz PIHRIFTXDKRKEA-FHUSYTEZSA-N 2 0 210.365 2.281 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@@H]([NH3+])C1)c1cncs1 ZINC000423368134 384843331 /nfs/dbraw/zinc/84/33/31/384843331.db2.gz DBPMWNDUYDNTBB-IVZWLZJFSA-N 2 0 225.361 2.064 20 0 BEADRP Cc1cncc([C@H](C)[NH2+][C@H]2CCC[C@@H]([NH3+])C2)c1 ZINC000423373475 384849331 /nfs/dbraw/zinc/84/93/31/384849331.db2.gz HMDAPCYOVQKEBV-YUTCNCBUSA-N 2 0 233.359 2.311 20 0 BEADRP C[C@H](CC[NH2+][C@@H]1CO[C@H](C)C1)[NH+]1CCCCC1 ZINC000647201082 384888730 /nfs/dbraw/zinc/88/87/30/384888730.db2.gz ZUDQYYNJNXVMLR-MCIONIFRSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@H]([NH3+])C1)C1CCSCC1 ZINC000423392455 384853464 /nfs/dbraw/zinc/85/34/64/384853464.db2.gz QFIITLSECDGRNR-DRZSPHRISA-N 2 0 242.432 2.378 20 0 BEADRP C([NH2+]C1CC[NH+](C2CCC2)CC1)C1CC1 ZINC000112344013 384855991 /nfs/dbraw/zinc/85/59/91/384855991.db2.gz JXICXEXAOYIUMW-UHFFFAOYSA-N 2 0 208.349 2.003 20 0 BEADRP CCC[NH+]1CCC([N@H+](C)CCSC)CC1 ZINC000177052441 384856312 /nfs/dbraw/zinc/85/63/12/384856312.db2.gz PMVWAEKMYJAGEL-UHFFFAOYSA-N 2 0 230.421 2.156 20 0 BEADRP CC(C)Oc1ccc(CN[C@@H]2CCC[C@@H]2[NH3+])cc1 ZINC000258920505 384951731 /nfs/dbraw/zinc/95/17/31/384951731.db2.gz ISYGNPHMTYYDOK-LSDHHAIUSA-N 2 0 248.370 2.443 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@@H](C)c1ccc(F)c(F)c1 ZINC000309287417 384899091 /nfs/dbraw/zinc/89/90/91/384899091.db2.gz GSWGDHISUATNPB-IUCAKERBSA-N 2 0 228.286 2.210 20 0 BEADRP C[C@@H]1C[C@H]([NH3+])CC[N@@H+]1Cc1cccs1 ZINC000049712689 384899904 /nfs/dbraw/zinc/89/99/04/384899904.db2.gz RPMZHVZUTQBWJA-NXEZZACHSA-N 2 0 210.346 2.060 20 0 BEADRP CC(C)C[C@H](C)[N@@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC000336268401 384909114 /nfs/dbraw/zinc/90/91/14/384909114.db2.gz IAVNRIPBFNAGDD-KBPBESRZSA-N 2 0 224.392 2.449 20 0 BEADRP C[C@@H](C[NH2+]CCC[NH+](C)C)c1ccc(F)cc1 ZINC000127530692 384911337 /nfs/dbraw/zinc/91/13/37/384911337.db2.gz QAUCPKWQBIAPDD-LBPRGKRZSA-N 2 0 238.350 2.471 20 0 BEADRP COC1(C[N@@H+]2CCC[C@@H]([C@H](C)[NH3+])C2)CCCC1 ZINC000318932278 384916518 /nfs/dbraw/zinc/91/65/18/384916518.db2.gz ANVVYQUHFWOLFB-QWHCGFSZSA-N 2 0 240.391 2.005 20 0 BEADRP COc1ccc(C)cc1CC[NH2+][C@@H]1CCC[C@H]1[NH3+] ZINC000259239215 384959255 /nfs/dbraw/zinc/95/92/55/384959255.db2.gz YHQADCDHTLTGKP-ZIAGYGMSSA-N 2 0 248.370 2.016 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]C[C@@](C)(CC)OC)[C@H](C)C1 ZINC000449474811 384920235 /nfs/dbraw/zinc/92/02/35/384920235.db2.gz KJFNBGKITQRKFO-HZSPNIEDSA-N 2 0 242.407 2.121 20 0 BEADRP CC(C)(C)[C@H]1CCC[N@@H+]1CC[C@H]1CC[NH2+]C1 ZINC000257777260 384926589 /nfs/dbraw/zinc/92/65/89/384926589.db2.gz MRQDOHUKJVNXEE-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)[C@H]1CCCC[N@@H+]1CC[C@H]1CC[NH2+]C1 ZINC000257770884 384927408 /nfs/dbraw/zinc/92/74/08/384927408.db2.gz IFTVDTFCCSQSJX-ZIAGYGMSSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)(C)[C@@H]1CCC[N@@H+]1CC[C@H]1CC[NH2+]C1 ZINC000257777261 384929277 /nfs/dbraw/zinc/92/92/77/384929277.db2.gz MRQDOHUKJVNXEE-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]([NH2+]CC1CC[NH+](C)CC1)c1ccoc1 ZINC000087290073 384935797 /nfs/dbraw/zinc/93/57/97/384935797.db2.gz KUKMUHACWVBQFI-LLVKDONJSA-N 2 0 222.332 2.272 20 0 BEADRP C[NH+]1CCC(C)(C[NH2+][C@H]2CCC2(C)C)CC1 ZINC000309302002 384948372 /nfs/dbraw/zinc/94/83/72/384948372.db2.gz MFSJYTRRZOFDIW-LBPRGKRZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]([NH3+])[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000058041114 384980538 /nfs/dbraw/zinc/98/05/38/384980538.db2.gz IMUMZPSUQCFIOJ-JSGCOSHPSA-N 2 0 218.344 2.246 20 0 BEADRP CO[C@H](C)CC[NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000310336330 384986069 /nfs/dbraw/zinc/98/60/69/384986069.db2.gz MWHPQWUYCLJHPY-HONMWMINSA-N 2 0 234.343 2.146 20 0 BEADRP C[C@@H](NC[C@@H]1CC[N@@H+](C2CC2)C1)c1ccoc1 ZINC000094868873 384988762 /nfs/dbraw/zinc/98/87/62/384988762.db2.gz JAJYPCRNVXSYEQ-NEPJUHHUSA-N 2 0 234.343 2.415 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+][C@@H]1CC[C@@H](C[NH3+])C1 ZINC000423496272 385005538 /nfs/dbraw/zinc/00/55/38/385005538.db2.gz GJJMQGGLCVVTST-NDBYEHHHSA-N 2 0 210.365 2.138 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+]CCc1ccc(Cl)s1 ZINC000259152434 384961232 /nfs/dbraw/zinc/96/12/32/384961232.db2.gz VDAZURWAQQZTTB-VHSXEESVSA-N 2 0 244.791 2.413 20 0 BEADRP CCN1CCC[C@@H]([NH2+][C@@H](C(C)C)C2CC2)C1 ZINC000222590524 384962595 /nfs/dbraw/zinc/96/25/95/384962595.db2.gz BYDCILIPQINVBB-KGLIPLIRSA-N 2 0 224.392 2.495 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@@H](C)[C@H](C[NH3+])C2)cc1 ZINC000163470497 385076425 /nfs/dbraw/zinc/07/64/25/385076425.db2.gz HGWYNHIXNXPMCB-UKRRQHHQSA-N 2 0 232.371 2.412 20 0 BEADRP C[C@H]1C[C@@H](C[NH3+])CN1Cc1cc(F)cc(F)c1 ZINC000157115036 385079534 /nfs/dbraw/zinc/07/95/34/385079534.db2.gz LMVGBAQASXHWRH-ONGXEEELSA-N 2 0 240.297 2.134 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+][C@H]1CCCC[NH2+]C1 ZINC000423567889 385027933 /nfs/dbraw/zinc/02/79/33/385027933.db2.gz VGLMBZKCAPEEFQ-RWMBFGLXSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)[C@H]1CC[C@@H]1[NH2+]CCC1=CC[NH2+]CC1 ZINC000423540920 385031969 /nfs/dbraw/zinc/03/19/69/385031969.db2.gz RDISZQNPILSETO-KGLIPLIRSA-N 2 0 222.376 2.320 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]Cc1ccccc1C(F)(F)F ZINC000310411000 385042426 /nfs/dbraw/zinc/04/24/26/385042426.db2.gz MJIUIDQWENRKAX-SECBINFHSA-N 2 0 246.276 2.390 20 0 BEADRP Cc1cc[nH+]c(NC[C@@H]2CCC[C@@H]([NH3+])C2)c1 ZINC000227673121 385198639 /nfs/dbraw/zinc/19/86/39/385198639.db2.gz MOKGXEHAKHULOK-VXGBXAGGSA-N 2 0 219.332 2.319 20 0 BEADRP [NH3+][C@@H]1CCCC[C@H]1[NH2+][C@H]1CC[C@@H]1C1CC1 ZINC000424370894 385151188 /nfs/dbraw/zinc/15/11/88/385151188.db2.gz DXZOTCXVPJKDLM-FVCCEPFGSA-N 2 0 208.349 2.035 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H]2C[C@@H]2Cc2ccccc2)C1 ZINC000516663571 385152252 /nfs/dbraw/zinc/15/22/52/385152252.db2.gz STKWFTVNBVNGCK-XUWVNRHRSA-N 2 0 244.382 2.477 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CC23CC3)[C@@H]2CCC[C@@H]21 ZINC000424321272 385162822 /nfs/dbraw/zinc/16/28/22/385162822.db2.gz KCMFLPRVTBXEMI-ZDEQEGDKSA-N 2 0 220.360 2.001 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+][C@H]1CCCSC1 ZINC000252714390 385222370 /nfs/dbraw/zinc/22/23/70/385222370.db2.gz RVVIQCLXNZALAC-FVCCEPFGSA-N 2 0 242.432 2.200 20 0 BEADRP CCC1(C[NH2+][C@H]2CC[N@H+](C)C[C@H]2C)CCC1 ZINC000252714912 385223749 /nfs/dbraw/zinc/22/37/49/385223749.db2.gz UAHJAVIUJKEGDE-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H](C[NH2+][C@H](C)CCC1CC1)C[NH+](C)C ZINC000308882097 385235843 /nfs/dbraw/zinc/23/58/43/385235843.db2.gz URAMVUVWISKIBV-VXGBXAGGSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H](C[NH2+][C@@H](C)CCC1CC1)C[NH+](C)C ZINC000308882096 385236537 /nfs/dbraw/zinc/23/65/37/385236537.db2.gz URAMVUVWISKIBV-RYUDHWBXSA-N 2 0 212.381 2.352 20 0 BEADRP Cc1ccc([C@H](C)[NH2+][C@H](C)CCC[NH3+])o1 ZINC000308895986 385251118 /nfs/dbraw/zinc/25/11/18/385251118.db2.gz ZJFNEFCDBRXVRS-KOLCDFICSA-N 2 0 210.321 2.366 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)C1(C)CC1 ZINC000037485299 385302991 /nfs/dbraw/zinc/30/29/91/385302991.db2.gz BTKOKAVPNQUBFC-NWDGAFQWSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@H]([NH2+]CCN)c1cccc2ccccc21 ZINC000037712349 385273230 /nfs/dbraw/zinc/27/32/30/385273230.db2.gz RVKCNXZTXIAGGC-NSHDSACASA-N 2 0 214.312 2.449 20 0 BEADRP CC1(C)CCC[C@@H](C[N@@H+]2CC[C@@H](C[NH3+])C2)C1 ZINC000647490853 385282053 /nfs/dbraw/zinc/28/20/53/385282053.db2.gz VOCAWENLJACLBV-OLZOCXBDSA-N 2 0 224.392 2.483 20 0 BEADRP [NH3+]CC[C@@H]1CCCC[N@@H+]1CCCCCF ZINC000308909144 385284976 /nfs/dbraw/zinc/28/49/76/385284976.db2.gz FYCSJFZWENHSIH-LBPRGKRZSA-N 2 0 216.344 2.330 20 0 BEADRP CC(C)C[C@@H]1CC[N@H+](C[C@@H]2CCC[NH2+]C2)C1 ZINC000307808755 385288652 /nfs/dbraw/zinc/28/86/52/385288652.db2.gz MTJVPLFJLWRXMS-UONOGXRCSA-N 2 0 224.392 2.354 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)C2CCC2)C1 ZINC000178510419 385291263 /nfs/dbraw/zinc/29/12/63/385291263.db2.gz SDQJFFZKWWRFBI-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C2CCC2)[C@@H]2CCC[C@@H]21 ZINC000308924849 385296600 /nfs/dbraw/zinc/29/66/00/385296600.db2.gz HXXNZNYTIBFCLI-AVGNSLFASA-N 2 0 208.349 2.001 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@@H](C)c1ccccc1F ZINC000308993928 385336233 /nfs/dbraw/zinc/33/62/33/385336233.db2.gz OSWUDVYFKQBCGF-UWVGGRQHSA-N 2 0 210.296 2.071 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]C[C@H]1CC=CCC1 ZINC000309024661 385366644 /nfs/dbraw/zinc/36/66/44/385366644.db2.gz XFMMCRRLIUQHDY-STQMWFEESA-N 2 0 210.365 2.450 20 0 BEADRP C[C@H](Cc1ccccc1)C[NH+]1C[C@@H]2C[NH2+]C[C@H]2C1 ZINC000359460150 385367079 /nfs/dbraw/zinc/36/70/79/385367079.db2.gz VXUNRDFYNRUECY-KBMXLJTQSA-N 2 0 244.382 2.016 20 0 BEADRP C[NH+](C)CCC[NH2+][C@H]1CC[C@H]1C(C)(C)C ZINC000309036913 385374508 /nfs/dbraw/zinc/37/45/08/385374508.db2.gz IQPMYGIMBNBBMT-NEPJUHHUSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H]([NH2+]CCC1CC[NH+](C)CC1)C1CCC1 ZINC000178747636 385326548 /nfs/dbraw/zinc/32/65/48/385326548.db2.gz DVXDXMVADPWBFM-GFCCVEGCSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH+](C)CCC[NH2+][C@@H]1CCC[C@H]2C[C@]21C ZINC000309066958 385393003 /nfs/dbraw/zinc/39/30/03/385393003.db2.gz ZZDFYWWCOYGLBM-YNEHKIRRSA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@H](C)C1CCC1 ZINC000309075942 385397431 /nfs/dbraw/zinc/39/74/31/385397431.db2.gz KJOFGXQXLGQLQP-GFCCVEGCSA-N 2 0 212.381 2.495 20 0 BEADRP C[N@H+](CCC[NH3+])Cc1cccc2cnccc21 ZINC000647497036 385398568 /nfs/dbraw/zinc/39/85/68/385398568.db2.gz YTVMIQPFQKNIQZ-UHFFFAOYSA-N 2 0 229.327 2.015 20 0 BEADRP CCc1cc(OC)ccc1C[N@H+](C)CCC[NH3+] ZINC000647497016 385399692 /nfs/dbraw/zinc/39/96/92/385399692.db2.gz RIUDFMGGDRCHAU-UHFFFAOYSA-N 2 0 236.359 2.038 20 0 BEADRP CCCCN(C)C[C@H](C)[NH2+][C@@H](C)C1CC1 ZINC000309172069 385447933 /nfs/dbraw/zinc/44/79/33/385447933.db2.gz LOEORWAWVVRYAX-RYUDHWBXSA-N 2 0 212.381 2.495 20 0 BEADRP [NH3+]CC[C@H]1CCC[N@H+](CCCCCF)C1 ZINC000336720728 385468897 /nfs/dbraw/zinc/46/88/97/385468897.db2.gz ZWVMNMIMLQXGPH-GFCCVEGCSA-N 2 0 216.344 2.187 20 0 BEADRP FCCCC[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000309215407 385483991 /nfs/dbraw/zinc/48/39/91/385483991.db2.gz FJRVQSAYLCMEHV-XQQFMLRXSA-N 2 0 228.355 2.246 20 0 BEADRP C[C@H](CC[NH2+]C[C@@H](C)C[NH3+])c1ccccc1 ZINC000309267710 385503959 /nfs/dbraw/zinc/50/39/59/385503959.db2.gz CKZSLDGNQVLIAJ-QWHCGFSZSA-N 2 0 220.360 2.365 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H](C)CCc1ccccc1 ZINC000309341397 385540205 /nfs/dbraw/zinc/54/02/05/385540205.db2.gz LCRHFOHXBPTHBA-OLZOCXBDSA-N 2 0 220.360 2.192 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H](C)c1cccnc1 ZINC000309313892 385527349 /nfs/dbraw/zinc/52/73/49/385527349.db2.gz FQQZSWFDQPEUCM-NEPJUHHUSA-N 2 0 221.348 2.250 20 0 BEADRP CC(C)[C@H]1C[C@@H]([NH2+]CCN(C)C(C)C)CS1 ZINC000309401535 385571040 /nfs/dbraw/zinc/57/10/40/385571040.db2.gz WIFIMEIVRBAHDV-CHWSQXEVSA-N 2 0 244.448 2.446 20 0 BEADRP C[NH+](C)CCC[N@H+](C)CC1CCCCC1 ZINC000337293288 385586452 /nfs/dbraw/zinc/58/64/52/385586452.db2.gz GRCUOTAKDBWEGS-UHFFFAOYSA-N 2 0 212.381 2.450 20 0 BEADRP C[C@@H](C[NH2+]C[C@H]1CCC[NH2+]1)Cc1ccccc1 ZINC000414849127 385614311 /nfs/dbraw/zinc/61/43/11/385614311.db2.gz QQQKQQVYSCCJSL-UKRRQHHQSA-N 2 0 232.371 2.207 20 0 BEADRP CCCC[C@H](COC)[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000414848843 385618740 /nfs/dbraw/zinc/61/87/40/385618740.db2.gz XNLYTSZVYBHGFB-UONOGXRCSA-N 2 0 242.407 2.171 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H](C)CCC(C)C ZINC000414849303 385625543 /nfs/dbraw/zinc/62/55/43/385625543.db2.gz XYWVNZCDJZGWSU-NWDGAFQWSA-N 2 0 200.370 2.256 20 0 BEADRP C[C@@H](C[NH2+]CCC[NH+](C)C)Cc1ccccc1 ZINC000182049397 385631325 /nfs/dbraw/zinc/63/13/25/385631325.db2.gz ZKZYICQESINYAP-CQSZACIVSA-N 2 0 234.387 2.407 20 0 BEADRP CC[C@@H](C)[NH+]1CCC([C@H]2CCC[NH2+]2)CC1 ZINC000063197445 385613014 /nfs/dbraw/zinc/61/30/14/385613014.db2.gz RNFNZQWYRDDDJC-DGCLKSJQSA-N 2 0 210.365 2.249 20 0 BEADRP COc1cccc(C[NH2+][C@@H](C)[C@@H]2CCC[NH2+]C2)c1 ZINC000414851886 385661885 /nfs/dbraw/zinc/66/18/85/385661885.db2.gz JMQSZCHSJVGXJL-GXTWGEPZSA-N 2 0 248.370 2.173 20 0 BEADRP C[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)C1CCCC1 ZINC000309557242 385695502 /nfs/dbraw/zinc/69/55/02/385695502.db2.gz KAJZLLIYAXEAKU-GFCCVEGCSA-N 2 0 222.376 2.417 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@@H]2CCC[C@@H]21)C1CC1 ZINC000309576754 385708530 /nfs/dbraw/zinc/70/85/30/385708530.db2.gz PEBXKBQERWLNBE-IGHBBLSQSA-N 2 0 222.376 2.247 20 0 BEADRP CCC[C@]1(C)CCC[N@H+](CCC[NH2+]C)C1 ZINC000336689183 385710124 /nfs/dbraw/zinc/71/01/24/385710124.db2.gz VVNGFTPPEGITOQ-CYBMUJFWSA-N 2 0 212.381 2.498 20 0 BEADRP C[NH2+]CCC[NH2+][C@H]1Cc2ccc(Cl)cc2C1 ZINC000414857515 385730346 /nfs/dbraw/zinc/73/03/46/385730346.db2.gz DPPXEAZIFOCSPZ-ZDUSSCGKSA-N 2 0 238.762 2.006 20 0 BEADRP COCC(C)(C)C[NH2+]CC1([NH3+])CCCCCC1 ZINC000414857844 385731781 /nfs/dbraw/zinc/73/17/81/385731781.db2.gz GHFMBRNYEWMMQS-UHFFFAOYSA-N 2 0 242.407 2.300 20 0 BEADRP CC(C)CCC[C@H](C)[NH2+]C[C@H](C)C[NH3+] ZINC000336692384 385734033 /nfs/dbraw/zinc/73/40/33/385734033.db2.gz QGLJMBBBVGDNBD-NEPJUHHUSA-N 2 0 200.370 2.386 20 0 BEADRP CC(C)[C@@H]1CCCC[C@H]1[NH2+]C[C@H](C)C[NH3+] ZINC000336693621 385738418 /nfs/dbraw/zinc/73/84/18/385738418.db2.gz NJKIIFQVBKJLGC-FRRDWIJNSA-N 2 0 212.381 2.386 20 0 BEADRP C[NH2+]CCC[NH2+]Cc1cc(F)cc2cccnc21 ZINC000414859317 385740696 /nfs/dbraw/zinc/74/06/96/385740696.db2.gz MHGKHTJTCKQABS-UHFFFAOYSA-N 2 0 247.317 2.073 20 0 BEADRP CC1(C)CC(C[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)C1 ZINC000647795001 385741989 /nfs/dbraw/zinc/74/19/89/385741989.db2.gz HNAPOYJXRVIWKK-MGPQQGTHSA-N 2 0 236.403 2.400 20 0 BEADRP CC[C@H](Cc1ccccc1)[NH2+]CCC[NH2+]C ZINC000414860956 385743342 /nfs/dbraw/zinc/74/33/42/385743342.db2.gz QYVKRDZFGPFQTF-CQSZACIVSA-N 2 0 220.360 2.207 20 0 BEADRP C[C@@H]([NH2+]Cc1cccc(F)c1)[C@H]1CCC[NH2+]C1 ZINC000414861248 385746617 /nfs/dbraw/zinc/74/66/17/385746617.db2.gz WHSBEKGGAVUHRU-YPMHNXCESA-N 2 0 236.334 2.303 20 0 BEADRP CC[N@H+](CCC(C)C)[C@@H]1CCC[NH2+]CC1 ZINC000309652763 385770018 /nfs/dbraw/zinc/77/00/18/385770018.db2.gz UFRXJYLWLXDERW-CYBMUJFWSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H](C[NH3+])NCc1cc(Cl)cc2cccnc21 ZINC000414943763 385775653 /nfs/dbraw/zinc/77/56/53/385775653.db2.gz MLHLDJOPUKJGAD-VIFPVBQESA-N 2 0 249.745 2.325 20 0 BEADRP CC(C)[C@@H](CN[C@@H]1CC[NH2+]C1)c1ccccc1 ZINC000414866527 385780068 /nfs/dbraw/zinc/78/00/68/385780068.db2.gz FITSDYZSLWXBIL-HUUCEWRRSA-N 2 0 232.371 2.378 20 0 BEADRP F[C@H]1CCC[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000647799633 385798186 /nfs/dbraw/zinc/79/81/86/385798186.db2.gz NHLLTWVJQJOADL-KZKMVBDOSA-N 2 0 226.339 2.140 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@H]1C[C@@H](C)[C@@H]1C ZINC000336711664 385799370 /nfs/dbraw/zinc/79/93/70/385799370.db2.gz UNVDTPIAWDIJFD-AGIUHOORSA-N 2 0 212.381 2.351 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@@H]1CCC[C@H]1C1CC1 ZINC000414947837 385806371 /nfs/dbraw/zinc/80/63/71/385806371.db2.gz XDYATMKOHDZYRA-VZZFWQQMSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]([NH2+]C[C@@H](C)CC(F)F)[C@H]1CCCC[NH2+]1 ZINC000647800560 385807601 /nfs/dbraw/zinc/80/76/01/385807601.db2.gz FGYWEMBRTHSLFL-HBNTYKKESA-N 2 0 234.334 2.398 20 0 BEADRP CC1([NH2+]C/C=C\c2ccccc2)CC[NH2+]CC1 ZINC000414948147 385808197 /nfs/dbraw/zinc/80/81/97/385808197.db2.gz XTRSFXYFBDNDQO-YVMONPNESA-N 2 0 230.355 2.432 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC[NH2+]CC[C@H]1C)CC(F)F ZINC000647801451 385812408 /nfs/dbraw/zinc/81/24/08/385812408.db2.gz WDLZWMHOBGPAAW-AXFHLTTASA-N 2 0 234.334 2.255 20 0 BEADRP C[C@@H]([NH2+]CCC[NH+]1CCCC1)[C@]1(C)CCCO1 ZINC000340178855 385823842 /nfs/dbraw/zinc/82/38/42/385823842.db2.gz AVAMBBISYJFEBE-KGLIPLIRSA-N 2 0 240.391 2.020 20 0 BEADRP CC[NH2+][C@H](C)CN[C@@H](C)Cc1ccccc1F ZINC000414952678 385826469 /nfs/dbraw/zinc/82/64/69/385826469.db2.gz IOTJWLMPOBMHEB-NWDGAFQWSA-N 2 0 238.350 2.344 20 0 BEADRP COc1ccccc1C1([NH2+][C@H](C)C[C@H](C)[NH3+])CC1 ZINC000647802046 385834136 /nfs/dbraw/zinc/83/41/36/385834136.db2.gz CMCJAQVUYDANRC-NWDGAFQWSA-N 2 0 248.370 2.400 20 0 BEADRP COc1cc(C[NH2+][C@@H]2CC[NH2+][C@H](C)C2)ccc1C ZINC000414954134 385834708 /nfs/dbraw/zinc/83/47/08/385834708.db2.gz SIATZFMATPXACP-TZMCWYRMSA-N 2 0 248.370 2.234 20 0 BEADRP Cc1n[nH]cc1[C@@H](C)[NH2+]Cc1ccc(C[NH3+])cc1 ZINC000647803353 385837123 /nfs/dbraw/zinc/83/71/23/385837123.db2.gz YDHHKRAGVMMRDZ-SNVBAGLBSA-N 2 0 244.342 2.028 20 0 BEADRP CO[C@@H]1CCC[C@H]([NH2+]Cc2ccc(C[NH3+])cc2)C1 ZINC000647803233 385839310 /nfs/dbraw/zinc/83/93/10/385839310.db2.gz OVUYGXMHPNSSKD-LSDHHAIUSA-N 2 0 248.370 2.193 20 0 BEADRP CO[C@H]1CCC[C@@H]([NH2+]Cc2ccc(C[NH3+])cc2)C1 ZINC000647803230 385839713 /nfs/dbraw/zinc/83/97/13/385839713.db2.gz OVUYGXMHPNSSKD-CABCVRRESA-N 2 0 248.370 2.193 20 0 BEADRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]CC1CCC(F)CC1 ZINC000647804319 385840894 /nfs/dbraw/zinc/84/08/94/385840894.db2.gz OZXPYIQSBQMRJU-POOIEITISA-N 2 0 228.355 2.232 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]Cc1cnc(C2CCC2)s1 ZINC000414871574 385853587 /nfs/dbraw/zinc/85/35/87/385853587.db2.gz DGBVJRWEGOGEFZ-SECBINFHSA-N 2 0 239.388 2.095 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+]Cc1cc2ccccc2o1 ZINC000414871074 385855603 /nfs/dbraw/zinc/85/56/03/385855603.db2.gz CTQBGVHVSODXBT-JTQLQIEISA-N 2 0 218.300 2.117 20 0 BEADRP C[C@H]([NH3+])[C@H]1CCC[N@H+](CCCCCF)C1 ZINC000336706142 385791363 /nfs/dbraw/zinc/79/13/63/385791363.db2.gz RIDGGTQFTFPFKG-RYUDHWBXSA-N 2 0 216.344 2.185 20 0 BEADRP C[C@@H]([NH3+])[C@@H]1CCC[N@H+](CCCCCF)C1 ZINC000336706143 385791516 /nfs/dbraw/zinc/79/15/16/385791516.db2.gz RIDGGTQFTFPFKG-VXGBXAGGSA-N 2 0 216.344 2.185 20 0 BEADRP CCOc1ccc(C[NH2+][C@@H]2CC[NH2+][C@@H](C)C2)cc1 ZINC000414945788 385793977 /nfs/dbraw/zinc/79/39/77/385793977.db2.gz IWKVQKWDNFKORQ-GXTWGEPZSA-N 2 0 248.370 2.315 20 0 BEADRP C[C@@H](CCC1CCCC1)[NH2+][C@H]1CC[NH2+]C1 ZINC000414867055 385794276 /nfs/dbraw/zinc/79/42/76/385794276.db2.gz FYTUOYQBUBMXIX-AAEUAGOBSA-N 2 0 210.365 2.297 20 0 BEADRP CC(C)C1(C[N@@H+]2CC[C@H](C[NH+](C)C)C2)CC1 ZINC000638077464 385797041 /nfs/dbraw/zinc/79/70/41/385797041.db2.gz TYKVHWIDTYXSNZ-CYBMUJFWSA-N 2 0 224.392 2.306 20 0 BEADRP CCCc1cccc(C[NH2+]C[C@H](C)C[NH3+])c1 ZINC000414874638 385886297 /nfs/dbraw/zinc/88/62/97/385886297.db2.gz IQTVZNJLMZJFQY-GFCCVEGCSA-N 2 0 220.360 2.324 20 0 BEADRP CCCc1cccc(C[NH2+]C[C@@H](C)C[NH3+])c1 ZINC000414874641 385886346 /nfs/dbraw/zinc/88/63/46/385886346.db2.gz IQTVZNJLMZJFQY-LBPRGKRZSA-N 2 0 220.360 2.324 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H](C)CCc1ccsc1 ZINC000414874691 385887794 /nfs/dbraw/zinc/88/77/94/385887794.db2.gz IURDDIMABPPJIH-GHMZBOCLSA-N 2 0 226.389 2.254 20 0 BEADRP CC(C)CCC[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000122132706 385888954 /nfs/dbraw/zinc/88/89/54/385888954.db2.gz GSDHUHDQDJRVIO-OLZOCXBDSA-N 2 0 212.381 2.495 20 0 BEADRP CO[C@@H](C)[C@@H](C)[NH2+]CCCCC[NH+]1CCCC1 ZINC000340479110 385889917 /nfs/dbraw/zinc/88/99/17/385889917.db2.gz VSRHVZYSVKEEJY-KGLIPLIRSA-N 2 0 242.407 2.266 20 0 BEADRP CCC[NH2+]CC[NH2+][C@@H]1CC[C@H](C)[C@@H](C)C1 ZINC000414874961 385890844 /nfs/dbraw/zinc/89/08/44/385890844.db2.gz TZSBUKVGZJMXCY-RWMBFGLXSA-N 2 0 212.381 2.400 20 0 BEADRP C[N@H+](CCC[NH3+])[C@H]1CCCc2ccc(F)cc21 ZINC000647847700 385898770 /nfs/dbraw/zinc/89/87/70/385898770.db2.gz ZXKBVQSOZKYJRJ-AWEZNQCLSA-N 2 0 236.334 2.484 20 0 BEADRP CCCC[C@@H](CC)[NH2+]C[C@@]1(COC)CCC[NH2+]1 ZINC000414963752 385900282 /nfs/dbraw/zinc/90/02/82/385900282.db2.gz XLAHSFUROAVWMJ-ZIAGYGMSSA-N 2 0 242.407 2.313 20 0 BEADRP COC[C@@]1(C[NH2+]C[C@@H](C)CC(C)C)CCC[NH2+]1 ZINC000414965498 385906116 /nfs/dbraw/zinc/90/61/16/385906116.db2.gz ZORDNHXXOCNVJC-KBPBESRZSA-N 2 0 242.407 2.027 20 0 BEADRP CC(C)[NH+]1CCN(c2[nH+]ccc3[nH]ccc32)CC1 ZINC000647855155 385909747 /nfs/dbraw/zinc/90/97/47/385909747.db2.gz VBRPTGNTMXWGBY-UHFFFAOYSA-N 2 0 244.342 2.093 20 0 BEADRP C[C@@H]1C[C@H](C[NH3+])C[N@@H+]1CC1CCCCC1 ZINC000122312460 385910408 /nfs/dbraw/zinc/91/04/08/385910408.db2.gz CGUUJETWSSGYCW-DGCLKSJQSA-N 2 0 210.365 2.236 20 0 BEADRP Cc1c[nH+]ccc1N1CCC[C@@H]([NH+](C)C)CC1 ZINC000335832601 385912298 /nfs/dbraw/zinc/91/22/98/385912298.db2.gz RPMLHVRXTSZYGP-CYBMUJFWSA-N 2 0 233.359 2.311 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+]C[C@@H]1CCCC[C@H]1C ZINC000414965880 385913843 /nfs/dbraw/zinc/91/38/43/385913843.db2.gz WCGHEKWELNWDMR-UPJWGTAASA-N 2 0 212.381 2.400 20 0 BEADRP CN(Cc1ccncc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000285355388 385916810 /nfs/dbraw/zinc/91/68/10/385916810.db2.gz BDUDNUIXXJLRBM-YIONKMFJSA-N 2 0 245.370 2.139 20 0 BEADRP CC(C)Cc1ncc(C[NH2+]C[C@@H](C)C[NH3+])s1 ZINC000414876983 385917378 /nfs/dbraw/zinc/91/73/78/385917378.db2.gz MDZBKFLISFMEDF-JTQLQIEISA-N 2 0 241.404 2.026 20 0 BEADRP Cc1cccc2c1CC[C@H]2[NH2+]CC(C)(C)[NH3+] ZINC000335039254 385930035 /nfs/dbraw/zinc/93/00/35/385930035.db2.gz BJCGFDLMANAQRS-CYBMUJFWSA-N 2 0 218.344 2.309 20 0 BEADRP C[C@@H]1CCC[C@H]1[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000414967257 385926924 /nfs/dbraw/zinc/92/69/24/385926924.db2.gz HFWIZSNUGQWSNB-JHJVBQTASA-N 2 0 210.365 2.297 20 0 BEADRP CCC[NH2+]CC[NH2+]C1C[C@H](C)C[C@@H](C)C1 ZINC000414872398 385866894 /nfs/dbraw/zinc/86/68/94/385866894.db2.gz PVSDKGCBGAOZFQ-VXGBXAGGSA-N 2 0 212.381 2.400 20 0 BEADRP [NH3+]CC[C@@H]1CCC[N@H+](CCCCCF)C1 ZINC000336720731 385880894 /nfs/dbraw/zinc/88/08/94/385880894.db2.gz ZWVMNMIMLQXGPH-LBPRGKRZSA-N 2 0 216.344 2.187 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000414971585 385975381 /nfs/dbraw/zinc/97/53/81/385975381.db2.gz WOULUPOHZOGCEQ-AAEUAGOBSA-N 2 0 210.365 2.297 20 0 BEADRP Cc1cc(N)cc(C[NH2+]C[C@@H]2CC[NH2+][C@@H](C)C2)c1 ZINC000414972419 385984943 /nfs/dbraw/zinc/98/49/43/385984943.db2.gz XWWPWTFTFBTCFD-QWHCGFSZSA-N 2 0 247.386 2.055 20 0 BEADRP [NH3+][C@H]1CCCCC[C@H]1[NH2+]C1Cc2ccccc2C1 ZINC000335040048 385930411 /nfs/dbraw/zinc/93/04/11/385930411.db2.gz OCCJYDYSFUIFSA-JKSUJKDBSA-N 2 0 244.382 2.403 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+]C1CC[NH2+]CC1)CC2 ZINC000335043654 385935663 /nfs/dbraw/zinc/93/56/63/385935663.db2.gz QSNPXPLYYNTILT-OAHLLOKOSA-N 2 0 230.355 2.324 20 0 BEADRP CC1CCC(C[NH2+][C@@H]2CCC[C@@H]2[NH3+])CC1 ZINC000335043587 385937187 /nfs/dbraw/zinc/93/71/87/385937187.db2.gz PIGMUURKJNIFAM-IFWUJCSASA-N 2 0 210.365 2.282 20 0 BEADRP CCCC[C@@H]1CCC[C@H]1[NH2+][C@@H]1CC[NH2+]C1 ZINC000414878886 385943230 /nfs/dbraw/zinc/94/32/30/385943230.db2.gz HYVASTXUDFQHRO-JHJVBQTASA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]1CCC[C@H](C)C1[NH2+]CC1([NH3+])CCC1 ZINC000335051106 385949566 /nfs/dbraw/zinc/94/95/66/385949566.db2.gz BZRFJLBQFTXIJU-QWRGUYRKSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+]C1(CN[C@H]2CCCOc3ccccc32)CCC1 ZINC000335052471 385952195 /nfs/dbraw/zinc/95/21/95/385952195.db2.gz LKRGYMXXNBGVRQ-ZDUSSCGKSA-N 2 0 246.354 2.371 20 0 BEADRP CCC1CC([N@@H+]2C[C@@H](C)[C@](C)(C[NH3+])C2)C1 ZINC000335056471 385956240 /nfs/dbraw/zinc/95/62/40/385956240.db2.gz LEMHVMZIBRHIFE-IKWCTNDRSA-N 2 0 210.365 2.092 20 0 BEADRP CC[NH+](CC)CCC[N@H+](C)[C@@H](CO)CC(C)C ZINC000338297787 385958599 /nfs/dbraw/zinc/95/85/99/385958599.db2.gz XCKDIFSAEXLNMQ-CQSZACIVSA-N 2 0 244.423 2.057 20 0 BEADRP C[C@@H]1COCC[C@@H]1[NH2+]CC1([NH3+])CCCCCC1 ZINC000335058882 385960290 /nfs/dbraw/zinc/96/02/90/385960290.db2.gz MDLVWXOVQDSBDL-OLZOCXBDSA-N 2 0 240.391 2.053 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H](C)[C@@H]1CCCOC1 ZINC000338299322 385960372 /nfs/dbraw/zinc/96/03/72/385960372.db2.gz ZGSLUHUTRDRJIO-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@@H](C)CCc1cccc(F)c1 ZINC000414880437 385967881 /nfs/dbraw/zinc/96/78/81/385967881.db2.gz QRDSVZDVXNIXHA-RYUDHWBXSA-N 2 0 238.350 2.331 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H](C)CCc1cccc(F)c1 ZINC000414880433 385968975 /nfs/dbraw/zinc/96/89/75/385968975.db2.gz QRDSVZDVXNIXHA-NEPJUHHUSA-N 2 0 238.350 2.331 20 0 BEADRP C[C@@H]([NH2+]CCCC[N@H+](C)C1CC1)[C@@H]1C[C@H]1C ZINC000414146338 385994357 /nfs/dbraw/zinc/99/43/57/385994357.db2.gz KYMBWVPWAXNXBQ-YRGRVCCFSA-N 2 0 224.392 2.495 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]Cc1ccc2c(c1)CCCN2 ZINC000335013874 385971018 /nfs/dbraw/zinc/97/10/18/385971018.db2.gz CTZKBLUISFXPAZ-UKRRQHHQSA-N 2 0 245.370 2.014 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+]Cc1ccc2c(c1)CCCN2 ZINC000335013872 385971439 /nfs/dbraw/zinc/97/14/39/385971439.db2.gz CTZKBLUISFXPAZ-DZGCQCFKSA-N 2 0 245.370 2.014 20 0 BEADRP CC[NH+](CC)CCCN1CC(C)(C)OC[C@@H]1C ZINC000338345833 385973756 /nfs/dbraw/zinc/97/37/56/385973756.db2.gz BGTPUVVHNUNZJE-ZDUSSCGKSA-N 2 0 242.407 2.218 20 0 BEADRP Cc1ccsc1C[NH2+][C@H]1CC[NH2+][C@@H](C)C1 ZINC000334866206 385974453 /nfs/dbraw/zinc/97/44/53/385974453.db2.gz ULEOFMHTIFKVHX-QWRGUYRKSA-N 2 0 224.373 2.287 20 0 BEADRP CC[NH+](CC)CCC[N@H+](C)CCCSC ZINC000338345927 385975040 /nfs/dbraw/zinc/97/50/40/385975040.db2.gz IQPIRDFRBAPQMH-UHFFFAOYSA-N 2 0 232.437 2.403 20 0 BEADRP CC(C)CCC[NH2+]CCCC[NH+]1CCOCC1 ZINC000338434728 385998281 /nfs/dbraw/zinc/99/82/81/385998281.db2.gz FDGUHQSSNLDCFJ-UHFFFAOYSA-N 2 0 242.407 2.125 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+]Cc1cccc2c1OC(C)(C)C2 ZINC000414881510 386000543 /nfs/dbraw/zinc/00/05/43/386000543.db2.gz SJZDCLFXYZGMFL-NSHDSACASA-N 2 0 248.370 2.085 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@@H](C)[C@@H]1CC1(C)C ZINC000336750033 386000809 /nfs/dbraw/zinc/00/08/09/386000809.db2.gz FLQMZZWGRZRXFX-WOPDTQHZSA-N 2 0 212.381 2.351 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]Cc1sccc1Cl ZINC000414882364 386010381 /nfs/dbraw/zinc/01/03/81/386010381.db2.gz UDVLVVBHCXIYQO-SSDOTTSWSA-N 2 0 218.753 2.086 20 0 BEADRP C[NH2+]Cc1ccc(NC[C@@H]([NH3+])CC(C)C)cc1 ZINC000414975210 386010524 /nfs/dbraw/zinc/01/05/24/386010524.db2.gz LLTYBPNTCWITQP-ZDUSSCGKSA-N 2 0 235.375 2.191 20 0 BEADRP C[N@@H+]1CCC[C@@H](CC[NH2+][C@H]2CCC2(C)C)C1 ZINC000414168602 386015993 /nfs/dbraw/zinc/01/59/93/386015993.db2.gz ANUPTYXQDIYIGU-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP COCC[C@@H](C)C[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000414181681 386023426 /nfs/dbraw/zinc/02/34/26/386023426.db2.gz AETCRWAPNBFVCX-CYBMUJFWSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)c1cccnc1 ZINC000414185505 386024847 /nfs/dbraw/zinc/02/48/47/386024847.db2.gz OTDAYPUSAYMWGX-KGLIPLIRSA-N 2 0 247.386 2.464 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+]CC1=CC[NH2+]CC1)CC2 ZINC000335060774 386027442 /nfs/dbraw/zinc/02/74/42/386027442.db2.gz QZQWEOWJUZRBMC-MRXNPFEDSA-N 2 0 242.366 2.492 20 0 BEADRP CC1CCC([NH2+]CC2=CC[NH2+]CC2)CC1 ZINC000335061883 386029569 /nfs/dbraw/zinc/02/95/69/386029569.db2.gz YVJWHEHEYLHILD-UHFFFAOYSA-N 2 0 208.349 2.074 20 0 BEADRP CCOc1cccc(C[NH2+][C@H]2CCC[NH2+]CC2)c1 ZINC000129119818 386031985 /nfs/dbraw/zinc/03/19/85/386031985.db2.gz GXLUHOPXSHVGTQ-AWEZNQCLSA-N 2 0 248.370 2.317 20 0 BEADRP Cc1nc2ccc(C[NH2+]C[C@H](C)C[NH3+])cc2s1 ZINC000414883975 386033109 /nfs/dbraw/zinc/03/31/09/386033109.db2.gz VJYDIORANGMZCF-SECBINFHSA-N 2 0 249.383 2.289 20 0 BEADRP C[NH2+]Cc1ccc(N[C@H](C)C[C@@H]2CCC[NH2+]2)cc1 ZINC000414978606 386034295 /nfs/dbraw/zinc/03/42/95/386034295.db2.gz SAJKEXRBTKLKLX-DOMZBBRYSA-N 2 0 247.386 2.349 20 0 BEADRP CC(C)C[N@@H+]1CC[C@@]2(C1)CCC[NH+](C)C2 ZINC000334429122 386039469 /nfs/dbraw/zinc/03/94/69/386039469.db2.gz IRTHRNMXDNCYAN-ZDUSSCGKSA-N 2 0 210.365 2.060 20 0 BEADRP C[C@@H](C[NH2+][C@@H](C)CC[NH3+])Cc1ccccc1 ZINC000414884846 386050330 /nfs/dbraw/zinc/05/03/30/386050330.db2.gz BKLDOASYPOKCKL-OLZOCXBDSA-N 2 0 220.360 2.192 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCc2nc[nH]c2C1)c1cscn1 ZINC000334432465 386050872 /nfs/dbraw/zinc/05/08/72/386050872.db2.gz WVYUERJSKXESID-DTWKUNHWSA-N 2 0 248.355 2.074 20 0 BEADRP Oc1cccc(C[NH2+]CCC[C@H]2CCC[NH2+]2)c1 ZINC000414980375 386052971 /nfs/dbraw/zinc/05/29/71/386052971.db2.gz WKMTZPHNMIBMPZ-ZDUSSCGKSA-N 2 0 234.343 2.014 20 0 BEADRP C[C@H]([NH2+]CCCC[N@H+](C)C1CC1)[C@H]1C[C@H]1C ZINC000414146336 385995651 /nfs/dbraw/zinc/99/56/51/385995651.db2.gz KYMBWVPWAXNXBQ-DYEKYZERSA-N 2 0 224.392 2.495 20 0 BEADRP Cc1c[nH+]ccc1N1C[C@H]([NH+]2CCCC2)C[C@@H]1C ZINC000334455343 386105084 /nfs/dbraw/zinc/10/50/84/386105084.db2.gz OCOSGPUQOJNGBN-UONOGXRCSA-N 2 0 245.370 2.453 20 0 BEADRP C[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)C1CC1 ZINC000336773114 386109300 /nfs/dbraw/zinc/10/93/00/386109300.db2.gz YRQYVKOXBIYQKK-QFWMXSHPSA-N 2 0 210.365 2.247 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+]C2CC[NH2+]CC2)cc1 ZINC000038041492 386119053 /nfs/dbraw/zinc/11/90/53/386119053.db2.gz HHSDHDUBUOEUFB-GFCCVEGCSA-N 2 0 218.344 2.398 20 0 BEADRP C[C@H]1CC([NH2+]C[C@H]([NH3+])C2CC2)C[C@H](C)C1 ZINC000414885951 386067326 /nfs/dbraw/zinc/06/73/26/386067326.db2.gz GXFAIWMVYLXHAM-BREBYQMCSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@H](CCC1CC1)[NH2+]CC1=CC[N@H+](C)CC1 ZINC000336728557 386072299 /nfs/dbraw/zinc/07/22/99/386072299.db2.gz CPHMSNAMRKSQFS-GFCCVEGCSA-N 2 0 222.376 2.417 20 0 BEADRP C[C@@H]1C[N@H+](C[C@@H]2C[C@H]2c2ccccc2)CC[C@H]1[NH3+] ZINC000414653883 386073460 /nfs/dbraw/zinc/07/34/60/386073460.db2.gz FIAUZWUGQSRHIK-SYAUCNOPSA-N 2 0 244.382 2.459 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H]2CS[C@H](C)C2)[C@@H](C)C1 ZINC000414228076 386077127 /nfs/dbraw/zinc/07/71/27/386077127.db2.gz LKFNRXSAYISUGH-RNJOBUHISA-N 2 0 242.432 2.200 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H]2CS[C@@H](C)C2)[C@H](C)C1 ZINC000414228078 386078109 /nfs/dbraw/zinc/07/81/09/386078109.db2.gz LKFNRXSAYISUGH-VOAKCMCISA-N 2 0 242.432 2.200 20 0 BEADRP CSCCC[N@@H+]1CCC[C@H]([NH+](C)C)CC1 ZINC000365402743 386078415 /nfs/dbraw/zinc/07/84/15/386078415.db2.gz KDKJBTJWBCCQHQ-LBPRGKRZSA-N 2 0 230.421 2.156 20 0 BEADRP FC1(F)CC[C@@H](C[N@@H+]2CC[C@@]3(CC[NH2+]C3)C2)C1 ZINC000310087567 386082532 /nfs/dbraw/zinc/08/25/32/386082532.db2.gz BLOPNIZDEWTGOT-VXGBXAGGSA-N 2 0 244.329 2.107 20 0 BEADRP FC1(F)CC[C@H](C[N@@H+]2CC[C@@]3(CC[NH2+]C3)C2)C1 ZINC000310087564 386083126 /nfs/dbraw/zinc/08/31/26/386083126.db2.gz BLOPNIZDEWTGOT-NWDGAFQWSA-N 2 0 244.329 2.107 20 0 BEADRP Cc1ccc2c(c1)[C@@H]([NH2+]CCN(C)C)[C@@H](C)C2 ZINC000286952688 386085558 /nfs/dbraw/zinc/08/55/58/386085558.db2.gz HLQIRHMYPGROQN-WFASDCNBSA-N 2 0 232.371 2.380 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+]CCN(C)C)[C@@H](C)C2 ZINC000286952684 386086933 /nfs/dbraw/zinc/08/69/33/386086933.db2.gz HLQIRHMYPGROQN-SWLSCSKDSA-N 2 0 232.371 2.380 20 0 BEADRP [NH3+][C@H](C[NH2+]CCC1CCCCC1)C1CC1 ZINC000414887835 386093568 /nfs/dbraw/zinc/09/35/68/386093568.db2.gz JBKOWEAJMOPBSA-CYBMUJFWSA-N 2 0 210.365 2.284 20 0 BEADRP C[C@H](C[NH2+]C[C@@H]([NH3+])C1CC1)c1ccc(F)cc1 ZINC000414888492 386097685 /nfs/dbraw/zinc/09/76/85/386097685.db2.gz JWVJCZSSWLFINI-QMTHXVAHSA-N 2 0 236.334 2.256 20 0 BEADRP C[C@@H](CC[NH3+])[NH2+]Cc1cc(F)cc2cccnc21 ZINC000414892178 386147344 /nfs/dbraw/zinc/14/73/44/386147344.db2.gz WTIOVFDSICSBLU-JTQLQIEISA-N 2 0 247.317 2.201 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@H](C)CCc1ccccc1 ZINC000414991462 386154482 /nfs/dbraw/zinc/15/44/82/386154482.db2.gz QEOSIJQXMGQFDR-TZMCWYRMSA-N 2 0 220.360 2.335 20 0 BEADRP CC(C)[N@H+](C[C@@H]1CC[NH2+][C@H](C)C1)C1CC1 ZINC000414677465 386158141 /nfs/dbraw/zinc/15/81/41/386158141.db2.gz OVADFTHQSJGXPT-VXGBXAGGSA-N 2 0 210.365 2.247 20 0 BEADRP C[NH2+][C@H]1CCN(CCCc2ccccc2C)C1 ZINC000430616201 386161139 /nfs/dbraw/zinc/16/11/39/386161139.db2.gz FQPMARYBGYNREQ-HNNXBMFYSA-N 2 0 232.371 2.221 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@H](C)CCC(F)(F)F ZINC000414993658 386161535 /nfs/dbraw/zinc/16/15/35/386161535.db2.gz TUZMCAKIYZMASU-HTQZYQBOSA-N 2 0 212.259 2.044 20 0 BEADRP [NH3+]CCC[N@@H+]1CCC[C@@H]1Cc1ccc(F)cc1 ZINC000414682669 386165690 /nfs/dbraw/zinc/16/56/90/386165690.db2.gz ADVHRYYXIVOZSD-CQSZACIVSA-N 2 0 236.334 2.181 20 0 BEADRP CC[NH+](CC)Cc1cn(-c2cc[nH+]cc2)nc1C ZINC000346139452 386165963 /nfs/dbraw/zinc/16/59/63/386165963.db2.gz VKWGRUHADCHXMY-UHFFFAOYSA-N 2 0 244.342 2.418 20 0 BEADRP COc1ccccc1[C@H]1CCC[N@@H+]1CCC[NH3+] ZINC000414686746 386176861 /nfs/dbraw/zinc/17/68/61/386176861.db2.gz AZGNMRGKWMFEIV-CYBMUJFWSA-N 2 0 234.343 2.181 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@H](C)CCc1cccc(F)c1 ZINC000414995872 386178648 /nfs/dbraw/zinc/17/86/48/386178648.db2.gz WTTSEMXIDZKLSC-BXUZGUMPSA-N 2 0 238.350 2.474 20 0 BEADRP C[C@H]([NH2+]C[C@H]([NH3+])C1CC1)C1CCCCC1 ZINC000414895218 386181782 /nfs/dbraw/zinc/18/17/82/386181782.db2.gz WBTUVBQPWKZLTL-GWCFXTLKSA-N 2 0 210.365 2.282 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@@H](C)Cc1ccccc1C ZINC000414996327 386182118 /nfs/dbraw/zinc/18/21/18/386182118.db2.gz XNDGJVZJCJDJHN-GXTWGEPZSA-N 2 0 220.360 2.253 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@H](C)Cc1ccccc1C ZINC000414996332 386182632 /nfs/dbraw/zinc/18/26/32/386182632.db2.gz XNDGJVZJCJDJHN-TZMCWYRMSA-N 2 0 220.360 2.253 20 0 BEADRP C[C@@H](CC[NH3+])[NH2+]C/C=C/c1ccc(F)cc1F ZINC000414895403 386185426 /nfs/dbraw/zinc/18/54/26/386185426.db2.gz NNACRKREWIRDNY-PBKGFPTLSA-N 2 0 240.297 2.305 20 0 BEADRP CC[N@H+](CCc1cccs1)C[C@@H]1CC[NH2+]C1 ZINC000647879834 386185733 /nfs/dbraw/zinc/18/57/33/386185733.db2.gz IGAFNZOUDUBCQB-GFCCVEGCSA-N 2 0 238.400 2.222 20 0 BEADRP CO[C@@H](C)C[N@H+](C[C@@H]([NH3+])CC(C)C)C(C)C ZINC000414691396 386187411 /nfs/dbraw/zinc/18/74/11/386187411.db2.gz BOJXCHARHXUBSJ-STQMWFEESA-N 2 0 230.396 2.105 20 0 BEADRP CO[C@H](C)C[N@H+](C[C@H]1CC[NH2+][C@@H](C)C1)C(C)C ZINC000414691361 386187825 /nfs/dbraw/zinc/18/78/25/386187825.db2.gz BJWMLFVSFYSUIV-MJBXVCDLSA-N 2 0 242.407 2.120 20 0 BEADRP [NH3+]CCC[N@@H+]1CCC[C@@H]1C1CCCCC1 ZINC000414670290 386136064 /nfs/dbraw/zinc/13/60/64/386136064.db2.gz CWBUKZCFOABMBB-CYBMUJFWSA-N 2 0 210.365 2.380 20 0 BEADRP COc1ccc([C@H](C)[N@H+](C)C[C@H]2CC[NH2+]C2)cc1 ZINC000647874680 386142025 /nfs/dbraw/zinc/14/20/25/386142025.db2.gz MMPZRICYWGCPKN-STQMWFEESA-N 2 0 248.370 2.298 20 0 BEADRP c1ccc(C[C@@H]2CCC[N@H+]2C[C@H]2CC[NH2+]C2)cc1 ZINC000647874684 386142716 /nfs/dbraw/zinc/14/27/16/386142716.db2.gz MQURZDAIBZDRQO-HOTGVXAUSA-N 2 0 244.382 2.303 20 0 BEADRP CC[N@@H+](Cc1ccc(OC)cc1)C[C@H]1CC[NH2+]C1 ZINC000647880940 386201745 /nfs/dbraw/zinc/20/17/45/386201745.db2.gz HOEADKOEFPDYMK-AWEZNQCLSA-N 2 0 248.370 2.127 20 0 BEADRP CCc1ccc(C[N@@H+]2C[C@H](C[NH3+])C[C@@H]2C)cc1 ZINC000131546945 386209811 /nfs/dbraw/zinc/20/98/11/386209811.db2.gz HMBKIVGFRFODGX-WFASDCNBSA-N 2 0 232.371 2.418 20 0 BEADRP Oc1ccc([C@@H]2CCC[N@@H+]2C[C@H]2CC[NH2+]C2)cc1 ZINC000647882072 386217702 /nfs/dbraw/zinc/21/77/02/386217702.db2.gz HZYHKDVUJAMRDZ-WFASDCNBSA-N 2 0 246.354 2.139 20 0 BEADRP CCSCC[N@H+](C)[C@@H]1CCN(C)C[C@@H]1C ZINC000336648795 386259957 /nfs/dbraw/zinc/25/99/57/386259957.db2.gz PPWGSARFHVPBII-NWDGAFQWSA-N 2 0 230.421 2.012 20 0 BEADRP COc1ccccc1/C=C/CN1CCC[C@@H]1C[NH3+] ZINC000347040198 386226155 /nfs/dbraw/zinc/22/61/55/386226155.db2.gz HSPLWJNTIPZGIJ-BTKRWWFXSA-N 2 0 246.354 2.132 20 0 BEADRP c1cncc([C@H]2CCC[N@H+]2CC2CC[NH2+]CC2)c1 ZINC000132292555 386229756 /nfs/dbraw/zinc/22/97/56/386229756.db2.gz JQXKFWINMCNHOS-OAHLLOKOSA-N 2 0 245.370 2.218 20 0 BEADRP C[NH2+][C@H]1CCN(CCCOc2ccccc2C)C1 ZINC000430622383 386234762 /nfs/dbraw/zinc/23/47/62/386234762.db2.gz LJTVPRXJIVHPBZ-AWEZNQCLSA-N 2 0 248.370 2.058 20 0 BEADRP C[NH2+][C@@H]1CCN(CCCOc2ccccc2C)C1 ZINC000430622384 386235055 /nfs/dbraw/zinc/23/50/55/386235055.db2.gz LJTVPRXJIVHPBZ-CQSZACIVSA-N 2 0 248.370 2.058 20 0 BEADRP COc1ccc([C@H](C)C[N@@H+]2CCC[C@H]2CN)cc1 ZINC000347125418 386237371 /nfs/dbraw/zinc/23/73/71/386237371.db2.gz YFVPLCJEWFKGCU-OCCSQVGLSA-N 2 0 248.370 2.222 20 0 BEADRP CCN1C[C@H](C)[C@H]([NH2+][C@H](C)CC(C)(C)OC)C1 ZINC000347141906 386260577 /nfs/dbraw/zinc/26/05/77/386260577.db2.gz HXKPWOLKDLYGLD-YNEHKIRRSA-N 2 0 242.407 2.120 20 0 BEADRP [NH3+]CCCC[NH2+]Cc1ccc(F)c2cccnc12 ZINC000414899364 386242496 /nfs/dbraw/zinc/24/24/96/386242496.db2.gz FSOOXUMQSMTKFW-UHFFFAOYSA-N 2 0 247.317 2.202 20 0 BEADRP Cc1ccsc1CN(C1CC1)[C@@H]1CC[NH2+]C1 ZINC000347141560 386260756 /nfs/dbraw/zinc/26/07/56/386260756.db2.gz WQUZORJTEUDBAQ-GFCCVEGCSA-N 2 0 236.384 2.383 20 0 BEADRP CCCC[C@@H](COC)[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000414899521 386246920 /nfs/dbraw/zinc/24/69/20/386246920.db2.gz CLMDUZITDAASCT-KBPBESRZSA-N 2 0 242.407 2.171 20 0 BEADRP CCCCO[C@@H]1C[C@H]([N@H+](C)CCC[NH3+])C1(C)C ZINC000414696041 386196948 /nfs/dbraw/zinc/19/69/48/386196948.db2.gz AULASGGQKUCTAW-QWHCGFSZSA-N 2 0 242.407 2.251 20 0 BEADRP CC[N@H+](C[C@@H]1CC[NH2+]C1)[C@H](C)c1cccc(O)c1 ZINC000647880365 386197514 /nfs/dbraw/zinc/19/75/14/386197514.db2.gz NSWXFNYNFLZJHY-CHWSQXEVSA-N 2 0 248.370 2.385 20 0 BEADRP COCC1(C[NH2+][C@H](C)CN(C)C(C)C)CCC1 ZINC000310530036 386197607 /nfs/dbraw/zinc/19/76/07/386197607.db2.gz PSMQAQFBUPLMJD-CYBMUJFWSA-N 2 0 242.407 2.121 20 0 BEADRP CCC[C@]1(C)CCC[N@H+](C[C@H]2CC[NH2+]C2)C1 ZINC000647886127 386293555 /nfs/dbraw/zinc/29/35/55/386293555.db2.gz XKWLNKGAINCQJF-UONOGXRCSA-N 2 0 224.392 2.498 20 0 BEADRP CC(C)CCC[NH2+]CC1(C)CC[NH2+]CC1 ZINC000414901420 386299421 /nfs/dbraw/zinc/29/94/21/386299421.db2.gz JTHGHIWVLQKUQM-UHFFFAOYSA-N 2 0 212.381 2.402 20 0 BEADRP C[C@@H]1CC[C@H]([N@H+](C)C[C@@H]2CC[NH2+][C@H](C)C2)C1 ZINC000414737037 386304464 /nfs/dbraw/zinc/30/44/64/386304464.db2.gz IFTNPZXSIFWRBR-SYQHCUMBSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CC2CCCCC2)CC[NH2+]1 ZINC000335261610 386320219 /nfs/dbraw/zinc/32/02/19/386320219.db2.gz OZYHCDQEFBNEDS-YPMHNXCESA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1c2ccccc2CC[N@H+]1C[C@H]1CC[NH2+]C1 ZINC000647884444 386263821 /nfs/dbraw/zinc/26/38/21/386263821.db2.gz QKNNKCOMESBINQ-OLZOCXBDSA-N 2 0 230.355 2.215 20 0 BEADRP Cc1ccncc1CCC[NH2+][C@H](C)CC[NH+](C)C ZINC000289171995 386268185 /nfs/dbraw/zinc/26/81/85/386268185.db2.gz FHGYMRBJASSHDL-CQSZACIVSA-N 2 0 249.402 2.252 20 0 BEADRP C[C@H]([NH2+]Cc1ccc2c[nH+]cn2c1)C1CC1 ZINC000297637009 386270868 /nfs/dbraw/zinc/27/08/68/386270868.db2.gz XBMVYMAWGPTLLI-JTQLQIEISA-N 2 0 215.300 2.222 20 0 BEADRP CC(C)[C@@H]([NH3+])CC[N@H+](C)Cc1cccc(N)c1 ZINC000340581663 386279612 /nfs/dbraw/zinc/27/96/12/386279612.db2.gz DHCYAONWHHGFOE-AWEZNQCLSA-N 2 0 235.375 2.074 20 0 BEADRP CC[C@@H](C)C[N@@H+]1CC2(C[C@H]1C)CC[NH2+]CC2 ZINC000335277587 386344247 /nfs/dbraw/zinc/34/42/47/386344247.db2.gz JSLPTMVEBFTWFR-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP CC1CCC([NH2+]CC[C@H]2CCC[NH2+]2)CC1 ZINC000414904889 386359986 /nfs/dbraw/zinc/35/99/86/386359986.db2.gz MMIFZHQQCFJVBO-OTTFEQOBSA-N 2 0 210.365 2.297 20 0 BEADRP Fc1cccc([C@H]2CCN2C[C@@H]2CC[NH2+]C2)c1 ZINC000647890037 386364620 /nfs/dbraw/zinc/36/46/20/386364620.db2.gz IQBKAUMETFJGEQ-BXUZGUMPSA-N 2 0 234.318 2.182 20 0 BEADRP CSCCC[N@H+](C)CCC[NH+]1CCCC1 ZINC000336693258 386365028 /nfs/dbraw/zinc/36/50/28/386365028.db2.gz CCBCIDJEXPBITD-UHFFFAOYSA-N 2 0 230.421 2.157 20 0 BEADRP CC1(C)C[N@H+](CCC[NH3+])CC[C@@H]1C(F)(F)F ZINC000414751763 386377616 /nfs/dbraw/zinc/37/76/16/386377616.db2.gz AZAUAHCTPOJFGF-VIFPVBQESA-N 2 0 238.297 2.246 20 0 BEADRP C[C@@H]1[C@@H](Cc2ccccc2)CC[N@@H+]1CCC[NH3+] ZINC000414740230 386331372 /nfs/dbraw/zinc/33/13/72/386331372.db2.gz JRCHLIUSXOGVSI-UKRRQHHQSA-N 2 0 232.371 2.288 20 0 BEADRP COCc1cccc(C[NH2+]CC[C@H]2CCC[NH2+]2)c1 ZINC000414903346 386332646 /nfs/dbraw/zinc/33/26/46/386332646.db2.gz JRVYEPSSIUNNEZ-OAHLLOKOSA-N 2 0 248.370 2.065 20 0 BEADRP COC1CC([NH2+]CC[C@H](C)[NH+]2CCCCC2)C1 ZINC000347483315 386438403 /nfs/dbraw/zinc/43/84/03/386438403.db2.gz MKFUMMTTWVQJJC-HSBZDZAISA-N 2 0 240.391 2.018 20 0 BEADRP CC[NH+](CC)CC1CC[NH+]([C@H](C)COC)CC1 ZINC000336719125 386449985 /nfs/dbraw/zinc/44/99/85/386449985.db2.gz XOWBPONWJSPRRP-CYBMUJFWSA-N 2 0 242.407 2.075 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000414907689 386393104 /nfs/dbraw/zinc/39/31/04/386393104.db2.gz QWGAFWOKLPBYHC-UPJWGTAASA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@H]([NH2+][C@@H](C)CC[NH+](C)C)c1ccncc1 ZINC000347419475 386396504 /nfs/dbraw/zinc/39/65/04/386396504.db2.gz NKPZSTPEEPSDIQ-JSGCOSHPSA-N 2 0 235.375 2.463 20 0 BEADRP [NH3+]CCC[N@@H+]1CCC[C@H](Cc2ccccc2)C1 ZINC000414754381 386397046 /nfs/dbraw/zinc/39/70/46/386397046.db2.gz XRASLSUZCZCWLU-OAHLLOKOSA-N 2 0 232.371 2.290 20 0 BEADRP [NH3+]CCC[N@@H+]1CCC[C@@H](Cc2ccccc2)C1 ZINC000414754380 386397231 /nfs/dbraw/zinc/39/72/31/386397231.db2.gz XRASLSUZCZCWLU-HNNXBMFYSA-N 2 0 232.371 2.290 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H]([NH+](C)C)C2)[C@H]1C ZINC000336776735 386400804 /nfs/dbraw/zinc/40/08/04/386400804.db2.gz GMLPXUPROGSJBO-BJJPWKGXSA-N 2 0 224.392 2.493 20 0 BEADRP Cc1ccncc1CCC[N@H+]1CCO[C@@H](C)[C@H]1C ZINC000290188114 386403540 /nfs/dbraw/zinc/40/35/40/386403540.db2.gz ZUAUTFSJRMXLRS-KGLIPLIRSA-N 2 0 248.370 2.432 20 0 BEADRP C[C@@H](CCC(F)(F)F)[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000414909621 386410125 /nfs/dbraw/zinc/41/01/25/386410125.db2.gz TWENQSDEOBWRLI-VHSXEESVSA-N 2 0 238.297 2.449 20 0 BEADRP C[C@@H]1C[C@H]1C[N@H+](CCC[NH3+])Cc1ccccc1 ZINC000339406330 386418532 /nfs/dbraw/zinc/41/85/32/386418532.db2.gz GEGUPNWLMMYFKQ-HIFRSBDPSA-N 2 0 232.371 2.493 20 0 BEADRP C[NH+](C)[C@@H]1CCC[N@H+](CCc2cccnc2)CC1 ZINC000277262350 386421848 /nfs/dbraw/zinc/42/18/48/386421848.db2.gz RAPJYKZASVZDRS-OAHLLOKOSA-N 2 0 247.386 2.040 20 0 BEADRP CC[C@H]1C[C@@H](C)C[N@@H+]1CCC1CC[NH2+]CC1 ZINC000399164030 386427048 /nfs/dbraw/zinc/42/70/48/386427048.db2.gz LUZQSENITHRGKH-OCCSQVGLSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H]1C[C@@H](C)C[N@@H+]1CC[C@@H]1CCC[NH2+]C1 ZINC000399163024 386428869 /nfs/dbraw/zinc/42/88/69/386428869.db2.gz LOLHRVQTVQATEM-HZSPNIEDSA-N 2 0 224.392 2.497 20 0 BEADRP CO[C@@H](C)C[N@H+](CC[C@@H]1CCC[NH+]1C)C(C)C ZINC000336714276 386434358 /nfs/dbraw/zinc/43/43/58/386434358.db2.gz QPHPUVCEJWYRBA-KBPBESRZSA-N 2 0 242.407 2.216 20 0 BEADRP C[C@H](CN(C)C)[NH2+][C@@H]1CC[C@@H]1C1CCC1 ZINC000336742077 386476028 /nfs/dbraw/zinc/47/60/28/386476028.db2.gz WGWHEOLDKVOOJT-RAIGVLPGSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@@H]1CCC[C@H](C)[C@H]1[NH2+]C1CC[NH2+]CC1 ZINC000335425449 386476542 /nfs/dbraw/zinc/47/65/42/386476542.db2.gz LPWGWWSCFFHHCV-PJXYFTJBSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]1CCC[C@H](C)C1[NH2+]C1CC[NH2+]CC1 ZINC000335425450 386477410 /nfs/dbraw/zinc/47/74/10/386477410.db2.gz LPWGWWSCFFHHCV-QWRGUYRKSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@H]1C[N@H+](CCCc2ccncc2)CC[C@@H]1[NH3+] ZINC000647934483 386478177 /nfs/dbraw/zinc/47/81/77/386478177.db2.gz GXQUJUQYYXROGD-GJZGRUSLSA-N 2 0 247.386 2.073 20 0 BEADRP COc1cccc(C[NH2+]C[C@@]2(C)CCC[NH2+]C2)c1 ZINC000414913366 386486007 /nfs/dbraw/zinc/48/60/07/386486007.db2.gz WOVXYOHYNHEXKN-HNNXBMFYSA-N 2 0 248.370 2.175 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]Cc1ccc2c(c1)COC2 ZINC000415012909 386493770 /nfs/dbraw/zinc/49/37/70/386493770.db2.gz JRDCAYILCIPQKB-GFCCVEGCSA-N 2 0 248.370 2.324 20 0 BEADRP CC[C@H](Cc1ccccc1)[NH2+]C1CC[NH2+]CC1 ZINC000414780937 386497930 /nfs/dbraw/zinc/49/79/30/386497930.db2.gz MEQZZQPSRUTPQI-CQSZACIVSA-N 2 0 232.371 2.349 20 0 BEADRP CC1(C)CCC[C@@H]1[NH2+][C@H]1CC[C@H](C[NH3+])C1 ZINC000415042822 386529595 /nfs/dbraw/zinc/52/95/95/386529595.db2.gz RGPCBEMXCBLHED-SRVKXCTJSA-N 2 0 210.365 2.282 20 0 BEADRP Cc1cc(F)ccc1C[NH2+][C@@H]1CC[C@@H](C[NH3+])C1 ZINC000415043419 386529605 /nfs/dbraw/zinc/52/96/05/386529605.db2.gz RWSJNCUWCPSYSA-BXUZGUMPSA-N 2 0 236.334 2.351 20 0 BEADRP COC[C@H](CC(C)C)[NH2+]C[C@@H]1CCC[C@@H]([NH3+])C1 ZINC000415014632 386501138 /nfs/dbraw/zinc/50/11/38/386501138.db2.gz ZYUMULKSTTTXNW-MCIONIFRSA-N 2 0 242.407 2.155 20 0 BEADRP CCc1ncc(C[NH2+][C@H](C)CCCC[NH3+])s1 ZINC000415016455 386503672 /nfs/dbraw/zinc/50/36/72/386503672.db2.gz PTIIUVBMNKMYGJ-SNVBAGLBSA-N 2 0 241.404 2.313 20 0 BEADRP CC(C)[C@@H]1C[C@@H](C[NH2+][C@H](C)CCC[NH3+])CCO1 ZINC000415017452 386503789 /nfs/dbraw/zinc/50/37/89/386503789.db2.gz FMOFCOGGIOMMOP-RDBSUJKOSA-N 2 0 242.407 2.155 20 0 BEADRP CCc1ccc(C[NH2+][C@@H]2CC[C@H](C[NH3+])C2)cc1 ZINC000415049237 386505271 /nfs/dbraw/zinc/50/52/71/386505271.db2.gz XNTVGWABNVVLRS-LSDHHAIUSA-N 2 0 232.371 2.466 20 0 BEADRP CCOc1ccccc1C[NH2+][C@H](C)CCC[NH3+] ZINC000415018937 386506633 /nfs/dbraw/zinc/50/66/33/386506633.db2.gz HOVLAQPASPYGNY-GFCCVEGCSA-N 2 0 236.359 2.302 20 0 BEADRP C[C@]1(C[NH2+]Cc2ccccc2)CCC[NH2+]C1 ZINC000062862279 386529957 /nfs/dbraw/zinc/52/99/57/386529957.db2.gz PDYLFICMGIMWOC-AWEZNQCLSA-N 2 0 218.344 2.166 20 0 BEADRP C[C@@H](CCC(F)(F)F)[NH2+]C1CC[NH2+]CC1 ZINC000414782947 386511809 /nfs/dbraw/zinc/51/18/09/386511809.db2.gz PWDMEXHODAMGQA-QMMMGPOBSA-N 2 0 224.270 2.059 20 0 BEADRP COCc1ccc(C[NH2+][C@@H](C)CCC[NH3+])cc1 ZINC000415026418 386516365 /nfs/dbraw/zinc/51/63/65/386516365.db2.gz UHOLATXOXQSDKG-LBPRGKRZSA-N 2 0 236.359 2.050 20 0 BEADRP Cc1cc(C[NH2+][C@@H]2CC[C@H](C[NH3+])C2)ccc1F ZINC000415027013 386516654 /nfs/dbraw/zinc/51/66/54/386516654.db2.gz APEMPNHTHVSNKN-WCQYABFASA-N 2 0 236.334 2.351 20 0 BEADRP CC(C)CCC[C@@H](C)[NH2+]C[C@H]1C[NH2+]CCCO1 ZINC000415028820 386516737 /nfs/dbraw/zinc/51/67/37/386516737.db2.gz AGXZGOAHRPOSRO-ZIAGYGMSSA-N 2 0 242.407 2.169 20 0 BEADRP CC(C)CCC[C@H](C)[NH2+]C[C@@H]1C[NH2+]CCCO1 ZINC000415028816 386516911 /nfs/dbraw/zinc/51/69/11/386516911.db2.gz AGXZGOAHRPOSRO-KBPBESRZSA-N 2 0 242.407 2.169 20 0 BEADRP CC(C)(C)C1CCC([NH2+][C@@H]2[C@H]3C[NH2+]C[C@H]32)CC1 ZINC000415033483 386521429 /nfs/dbraw/zinc/52/14/29/386521429.db2.gz ITBMOKAFRCGKTE-TWASESMYSA-N 2 0 236.403 2.399 20 0 BEADRP CC(C)CC[N@@H+]1CCCC[C@@H]1[C@@H]1CC[NH2+]C1 ZINC000415041297 386526308 /nfs/dbraw/zinc/52/63/08/386526308.db2.gz LJESLLVSXGLUME-ZIAGYGMSSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H](C[C@H]1CCC[NH2+]1)Nc1ccc(C[NH3+])cc1 ZINC000414916349 386526428 /nfs/dbraw/zinc/52/64/28/386526428.db2.gz SKKFCNYESAQTDL-SMDDNHRTSA-N 2 0 233.359 2.088 20 0 BEADRP Cc1cc([C@H](C)[NH2+]C2CC[NH2+]CC2)cs1 ZINC000335453369 386526564 /nfs/dbraw/zinc/52/65/64/386526564.db2.gz UEMRTEAHDQAQNT-JTQLQIEISA-N 2 0 224.373 2.459 20 0 BEADRP C[C@H](C[NH2+]C1CC[NH2+]CC1)Cc1ccccc1 ZINC000414774344 386464585 /nfs/dbraw/zinc/46/45/85/386464585.db2.gz AXYAQXMEXYYVPZ-ZDUSSCGKSA-N 2 0 232.371 2.207 20 0 BEADRP CC[C@H](C)[N@@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC000647977778 386579027 /nfs/dbraw/zinc/57/90/27/386579027.db2.gz HNSXPYOXGFAIQT-IHRRRGAJSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@]1(C[NH2+]C[C@H]2CCc3ccccc32)CC[NH2+]C1 ZINC000415077697 386586081 /nfs/dbraw/zinc/58/60/81/386586081.db2.gz HVLQIYNQWWNGNV-ZBFHGGJFSA-N 2 0 244.382 2.306 20 0 BEADRP C[C@H]([NH3+])c1ccc(NC[C@@]2(C)CC[NH2+]C2)cc1 ZINC000414800392 386587023 /nfs/dbraw/zinc/58/70/23/386587023.db2.gz HXMGNEOCJSXJLT-FZMZJTMJSA-N 2 0 233.359 2.118 20 0 BEADRP C[C@@]1(C[NH2+]C[C@H]2CCc3ccccc32)CC[NH2+]C1 ZINC000415077694 386587859 /nfs/dbraw/zinc/58/78/59/386587859.db2.gz HVLQIYNQWWNGNV-GDBMZVCRSA-N 2 0 244.382 2.306 20 0 BEADRP C[C@@H](CCC(F)(F)F)[NH2+][C@H](CN)C1CC1 ZINC000414800004 386593348 /nfs/dbraw/zinc/59/33/48/386593348.db2.gz FKMOHXKESBMQOC-IONNQARKSA-N 2 0 224.270 2.044 20 0 BEADRP [NH3+]C[C@@H]1CC[C@H]([NH2+]Cc2ccc(F)c(F)c2)C1 ZINC000415046340 386531404 /nfs/dbraw/zinc/53/14/04/386531404.db2.gz UZXJJTNJZRPUHS-KOLCDFICSA-N 2 0 240.297 2.182 20 0 BEADRP Cc1ccc(CC[C@@H](C)[NH2+][C@@H]2[C@H]3C[NH2+]C[C@H]32)cc1 ZINC000415045608 386531629 /nfs/dbraw/zinc/53/16/29/386531629.db2.gz WEBOJCQLKZCCKQ-OJLVUWQFSA-N 2 0 244.382 2.124 20 0 BEADRP [NH3+]C[C@H]1CC[C@@H]([NH2+]Cc2ccc(F)c(F)c2)C1 ZINC000415046339 386532142 /nfs/dbraw/zinc/53/21/42/386532142.db2.gz UZXJJTNJZRPUHS-GXSJLCMTSA-N 2 0 240.297 2.182 20 0 BEADRP Cc1ccc(CC[C@H](C)[NH2+][C@@H]2[C@H]3C[NH2+]C[C@H]32)cc1 ZINC000415045604 386532203 /nfs/dbraw/zinc/53/22/03/386532203.db2.gz WEBOJCQLKZCCKQ-ARLBYUKCSA-N 2 0 244.382 2.124 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]Cc1cc(F)cc(F)c1 ZINC000414788613 386533875 /nfs/dbraw/zinc/53/38/75/386533875.db2.gz DQLQMMNEIBDXQD-GXFFZTMASA-N 2 0 240.297 2.182 20 0 BEADRP CCC1(C)CC[NH+](C[C@]2(C)CC[NH2+]C2)CC1 ZINC000062959839 386534324 /nfs/dbraw/zinc/53/43/24/386534324.db2.gz YJTIGDSSEKDYBW-CQSZACIVSA-N 2 0 224.392 2.498 20 0 BEADRP CC(C)C[C@H](C)C[NH2+]C[C@H]([NH3+])C(C)C ZINC000414787391 386535617 /nfs/dbraw/zinc/53/56/17/386535617.db2.gz CHDIUZVQRPSAAR-RYUDHWBXSA-N 2 0 200.370 2.242 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCCC23CC3)C1 ZINC000519710469 386539360 /nfs/dbraw/zinc/53/93/60/386539360.db2.gz NSOLOWADUSNXDY-OLZOCXBDSA-N 2 0 222.376 2.251 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCCC23CC3)C1 ZINC000519710464 386540302 /nfs/dbraw/zinc/54/03/02/386540302.db2.gz NSOLOWADUSNXDY-CHWSQXEVSA-N 2 0 222.376 2.251 20 0 BEADRP CCc1ccccc1[C@@H](N)C[NH2+]C(C)C ZINC000415061365 386542319 /nfs/dbraw/zinc/54/23/19/386542319.db2.gz CNDDRMHFDBWSNH-ZDUSSCGKSA-N 2 0 206.333 2.247 20 0 BEADRP CCc1cnc(CN[C@H](C[NH3+])C(C)(C)C)s1 ZINC000415058699 386542573 /nfs/dbraw/zinc/54/25/73/386542573.db2.gz WLFKFAIVCHFSKE-SNVBAGLBSA-N 2 0 241.404 2.169 20 0 BEADRP C[C@H]([NH3+])C[N@@H+]1CC[C@H]([C@H]2CCCC2(C)C)C1 ZINC000647995266 386546696 /nfs/dbraw/zinc/54/66/96/386546696.db2.gz KBDZTNJYZDNYPV-RWMBFGLXSA-N 2 0 224.392 2.482 20 0 BEADRP COC[C@H](CC(C)C)[NH2+][C@H]1CCCC[C@H]1C[NH3+] ZINC000414791613 386547980 /nfs/dbraw/zinc/54/79/80/386547980.db2.gz BPJPLTVQZCNKAW-IHRRRGAJSA-N 2 0 242.407 2.155 20 0 BEADRP FC(F)(F)C[C@@H]1CC[N@H+](CCn2ccnc2)C1 ZINC000278567191 386549412 /nfs/dbraw/zinc/54/94/12/386549412.db2.gz BVUAMGRRFQZUCW-JTQLQIEISA-N 2 0 247.264 2.157 20 0 BEADRP CC(C)C[C@H](C)C[NH2+][C@H]1CCCC[NH2+]C1 ZINC000415069134 386550868 /nfs/dbraw/zinc/55/08/68/386550868.db2.gz GCNWHMOJKUQPEZ-STQMWFEESA-N 2 0 212.381 2.400 20 0 BEADRP Cc1ccc(CCC[NH2+][C@H]2CCCC[NH2+]C2)cn1 ZINC000415068424 386550909 /nfs/dbraw/zinc/55/09/09/386550909.db2.gz DYISRMXHEAFVGM-HNNXBMFYSA-N 3 0 247.386 2.054 20 0 BEADRP CC(C)[N@@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC000647974879 386555198 /nfs/dbraw/zinc/55/51/98/386555198.db2.gz AEWLAVCMRPSYAD-STQMWFEESA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@@H]1CCC[C@@H](C)[C@H]1C ZINC000414794289 386558572 /nfs/dbraw/zinc/55/85/72/386558572.db2.gz LSVJAZJEJIXQTK-FDYHWXHSSA-N 2 0 212.381 2.384 20 0 BEADRP C([NH2+][C@@H]1CCCC[NH2+]C1)C1CCCCC1 ZINC000415073160 386559958 /nfs/dbraw/zinc/55/99/58/386559958.db2.gz XZZGHUCBZMUOHV-CYBMUJFWSA-N 2 0 210.365 2.298 20 0 BEADRP Cc1cccc(OC[C@H](C)[NH2+]C2CC[NH2+]CC2)c1 ZINC000415074967 386569677 /nfs/dbraw/zinc/56/96/77/386569677.db2.gz DGHMQAWOJJCJLA-ZDUSSCGKSA-N 2 0 248.370 2.104 20 0 BEADRP c1ccc2c(c1)CC[C@@H]([NH2+][C@H]1CCCC[NH2+]C1)C2 ZINC000415075688 386569691 /nfs/dbraw/zinc/56/96/91/386569691.db2.gz RDOCLETWJVADEG-CVEARBPZSA-N 2 0 244.382 2.276 20 0 BEADRP CC(C)C[C@@H]([NH3+])CNc1ccc([C@@H](C)[NH3+])cc1 ZINC000414809662 386622382 /nfs/dbraw/zinc/62/23/82/386622382.db2.gz VYSVDNWQCIOKNZ-DGCLKSJQSA-N 2 0 235.375 2.492 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCCC[NH2+]C1)C1CCCC1 ZINC000335497950 386623979 /nfs/dbraw/zinc/62/39/79/386623979.db2.gz BTPZLZUFFOAPGY-WCQYABFASA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCCC[NH2+]C1)C1CCCC1 ZINC000335497949 386624421 /nfs/dbraw/zinc/62/44/21/386624421.db2.gz BTPZLZUFFOAPGY-DGCLKSJQSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1C[C@@H](C[NH2+][C@@]2(C)CC=CCC2)CC[NH2+]1 ZINC000415103049 386624654 /nfs/dbraw/zinc/62/46/54/386624654.db2.gz BVFPMLPXDLSXAA-RDBSUJKOSA-N 2 0 222.376 2.463 20 0 BEADRP C[C@@H]([NH2+]CC1(C)CC[NH+](C)CC1)C1CCC1 ZINC000336759029 386655667 /nfs/dbraw/zinc/65/56/67/386655667.db2.gz ZTZKJBUDBJWZTP-GFCCVEGCSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)C[C@H]([NH3+])C[NH2+]C(C)(C)COC(C)C ZINC000415115534 386630248 /nfs/dbraw/zinc/63/02/48/386630248.db2.gz DWCSMYORBVZADI-LBPRGKRZSA-N 2 0 230.396 2.153 20 0 BEADRP C[C@@H]1Cc2ccccc2[C@H]1[NH2+]CC1=CC[NH2+]CC1 ZINC000335501396 386630399 /nfs/dbraw/zinc/63/03/99/386630399.db2.gz SNUPNBQDHQVURT-WBMJQRKESA-N 2 0 242.366 2.429 20 0 BEADRP C[C@@H]1CC([NH2+]CC2=CC[NH2+]CC2)C[C@@H](C)C1 ZINC000335501362 386630662 /nfs/dbraw/zinc/63/06/62/386630662.db2.gz RYULCHLDJJEOGJ-RYUDHWBXSA-N 2 0 222.376 2.320 20 0 BEADRP CC(C)([NH3+])C[NH2+][C@@H]1CCC[C@@H](C2CC2)C1 ZINC000414810923 386633282 /nfs/dbraw/zinc/63/32/82/386633282.db2.gz YJLDMJNQOCBCOI-VXGBXAGGSA-N 2 0 210.365 2.282 20 0 BEADRP CCOC[C@@H](C)[NH2+]Cc1ccc([C@@H](C)[NH3+])cc1 ZINC000414813146 386642589 /nfs/dbraw/zinc/64/25/89/386642589.db2.gz SLCCZAAYZUHQKH-VXGBXAGGSA-N 2 0 236.359 2.221 20 0 BEADRP Cc1cc(C[NH+]2CCC([NH3+])CC2)c(C)s1 ZINC000049687863 386648964 /nfs/dbraw/zinc/64/89/64/386648964.db2.gz UXNOTSOIXRQIET-UHFFFAOYSA-N 2 0 224.373 2.288 20 0 BEADRP CC(C)([NH3+])C[NH2+]C[C@H]1CCCO[C@@H]1C(C)(C)C ZINC000415084741 386599352 /nfs/dbraw/zinc/59/93/52/386599352.db2.gz PNCBBBHKEVRXED-NEPJUHHUSA-N 2 0 242.407 2.155 20 0 BEADRP FCCC[N@@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000647978565 386606096 /nfs/dbraw/zinc/60/60/96/386606096.db2.gz UWORQOSCYUECBA-OLZOCXBDSA-N 2 0 228.355 2.058 20 0 BEADRP COc1cc(C[NH2+][C@H]2CCC[C@@H]2C[NH3+])ccc1C ZINC000414803869 386606958 /nfs/dbraw/zinc/60/69/58/386606958.db2.gz OIXCADCGJDIFTO-KGLIPLIRSA-N 2 0 248.370 2.221 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H](C)c1ccc(F)cc1F ZINC000336645446 386611748 /nfs/dbraw/zinc/61/17/48/386611748.db2.gz ATNHTQDELNXYOK-BDAKNGLRSA-N 2 0 228.286 2.210 20 0 BEADRP Cc1cscc1C[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000335493449 386614263 /nfs/dbraw/zinc/61/42/63/386614263.db2.gz WEENZQKDAMTVJY-FUNVUKJBSA-N 2 0 236.384 2.429 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CCC[NH2+]C1)c1ccccc1 ZINC000041231976 386665013 /nfs/dbraw/zinc/66/50/13/386665013.db2.gz QNXFKBXEIYLNOW-OLZOCXBDSA-N 2 0 218.344 2.337 20 0 BEADRP C([NH2+][C@H]1CCC[C@@H](C2CC2)C1)[C@@H]1CCC[NH2+]1 ZINC000414820063 386665570 /nfs/dbraw/zinc/66/55/70/386665570.db2.gz ACQVPDXUPYJIQA-RDBSUJKOSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H](CCc1ccsc1)[NH2+]C[C@H]1CCC[NH2+]1 ZINC000414821457 386677034 /nfs/dbraw/zinc/67/70/34/386677034.db2.gz CFNSGBIRDCIXDV-WCQYABFASA-N 2 0 238.400 2.411 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H](C)Cc1ccc(F)cc1 ZINC000414823768 386679885 /nfs/dbraw/zinc/67/98/85/386679885.db2.gz PIYBNEBDNUFYNG-QWRGUYRKSA-N 2 0 224.323 2.084 20 0 BEADRP C[C@H](CCC1CC1)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000414823974 386679969 /nfs/dbraw/zinc/67/99/69/386679969.db2.gz FGUZYJOLQZJDLR-BKQLOGFTSA-N 2 0 222.376 2.438 20 0 BEADRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)C1CCC1 ZINC000414831213 386710211 /nfs/dbraw/zinc/71/02/11/386710211.db2.gz PRVAOHQFXRXKGA-KYTZWMPUSA-N 2 0 208.349 2.048 20 0 BEADRP Clc1ccccc1C[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000414824847 386684094 /nfs/dbraw/zinc/68/40/94/386684094.db2.gz BGZSLCZCNRMVHC-NSHDSACASA-N 2 0 238.762 2.429 20 0 BEADRP C[C@@H]([NH2+]CCCC[NH+](C)C)[C@@H]1CC1(C)C ZINC000336759773 386685809 /nfs/dbraw/zinc/68/58/09/386685809.db2.gz LQNICMAYYSIMDH-NEPJUHHUSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H]1Cc2ccc(Cl)cc2C1 ZINC000414825410 386691136 /nfs/dbraw/zinc/69/11/36/386691136.db2.gz SPZKNPCLVZIWMU-TVQRCGJNSA-N 2 0 238.762 2.134 20 0 BEADRP Clc1cccc(C[NH2+]CC[C@@H]2CC[NH2+]C2)c1 ZINC000414825618 386692013 /nfs/dbraw/zinc/69/20/13/386692013.db2.gz CQSCJZMQWGZSLZ-NSHDSACASA-N 2 0 238.762 2.429 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CC[C@H]2CC[NH2+]C2)[C@@H](C)C1 ZINC000414830467 386707293 /nfs/dbraw/zinc/70/72/93/386707293.db2.gz MDEAZQYETZAVPH-RQJABVFESA-N 2 0 224.392 2.400 20 0 BEADRP Cc1ccc(F)c(C[NH2+]CC[C@H]2CC[NH2+]C2)c1 ZINC000414835958 386731198 /nfs/dbraw/zinc/73/11/98/386731198.db2.gz SGWILVLIPCUZJZ-GFCCVEGCSA-N 2 0 236.334 2.223 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000414837064 386734263 /nfs/dbraw/zinc/73/42/63/386734263.db2.gz UBRXUHJJNQFIAJ-NXEZZACHSA-N 2 0 238.297 2.307 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H](C)C1CCCCC1 ZINC000414840547 386738860 /nfs/dbraw/zinc/73/88/60/386738860.db2.gz MLJPTCMGYKXLKN-NWDGAFQWSA-N 2 0 212.381 2.400 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H](C)CC1CCCC1 ZINC000414833085 386714622 /nfs/dbraw/zinc/71/46/22/386714622.db2.gz GCGBQZBLHZZGIT-RYUDHWBXSA-N 2 0 212.381 2.400 20 0 BEADRP CC(C)[C@@H]1CCC[C@H]1[NH2+]C1CC[NH2+]CC1 ZINC000335484927 386715206 /nfs/dbraw/zinc/71/52/06/386715206.db2.gz XKJHVEIRZDOSIG-QWHCGFSZSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)CC[C@H](C)[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000414832163 386717609 /nfs/dbraw/zinc/71/76/09/386717609.db2.gz NYSYOEOIGOZIJF-STQMWFEESA-N 2 0 212.381 2.400 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CCCC[C@H]1C1CC1 ZINC000414834866 386722936 /nfs/dbraw/zinc/72/29/36/386722936.db2.gz HZKGPGVNBXCIHG-FPMFFAJLSA-N 2 0 224.392 2.400 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H]1CCC[C@H](C2CC2)C1 ZINC000414835810 386726664 /nfs/dbraw/zinc/72/66/64/386726664.db2.gz IPFZYKJKWBYZAF-UBHSHLNASA-N 2 0 224.392 2.400 20 0 BEADRP Cc1cccc(C)c1C[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000414839993 386746503 /nfs/dbraw/zinc/74/65/03/386746503.db2.gz WXJMMSANERRHEZ-CQSZACIVSA-N 2 0 232.371 2.393 20 0 BEADRP CC(C)[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1CCC[NH2+]1 ZINC000414841293 386755204 /nfs/dbraw/zinc/75/52/04/386755204.db2.gz HOBFVCBRHQVGPR-RWMBFGLXSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CCC(F)(F)F)CC[N@@H+]1C ZINC000156617164 386763897 /nfs/dbraw/zinc/76/38/97/386763897.db2.gz WIHKDPFESIUBLM-DTWKUNHWSA-N 2 0 224.270 2.011 20 0 BEADRP CC(C)C1CC([NH2+][C@H]2CC[NH2+][C@@H](C)C2)C1 ZINC000335537781 386743334 /nfs/dbraw/zinc/74/33/34/386743334.db2.gz FGWZNHNNXHASTD-QCXCNERSSA-N 2 0 210.365 2.151 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H]1CC2CCC1CC2 ZINC000336744050 386795989 /nfs/dbraw/zinc/79/59/89/386795989.db2.gz YUZQGSGXEZPPLU-XVSSEFHLSA-N 2 0 210.365 2.282 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CC[C@@H](C)C[C@H]1C ZINC000414844875 386772778 /nfs/dbraw/zinc/77/27/78/386772778.db2.gz RQNBWCGJMHTKAA-YVECIDJPSA-N 2 0 212.381 2.256 20 0 BEADRP CC(C)c1ccc([C@H]([NH3+])CNCC(C)(C)[NH3+])cc1 ZINC000414846653 386817954 /nfs/dbraw/zinc/81/79/54/386817954.db2.gz NTANBTWFGJHEAT-CQSZACIVSA-N 2 0 249.402 2.137 20 0 BEADRP CC[C@@H](COC)[NH2+]CC(C)(C)C[NH+]1CCCC1 ZINC000357847312 386853187 /nfs/dbraw/zinc/85/31/87/386853187.db2.gz IXTDXMQPJOOPBE-ZDUSSCGKSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)c1nccc(NC[C@H]2CCC[N@H+](C)C2)n1 ZINC000301286595 386830420 /nfs/dbraw/zinc/83/04/20/386830420.db2.gz VKLGEBZTTQPWOW-GFCCVEGCSA-N 2 0 248.374 2.354 20 0 BEADRP CCSCCC[NH2+][C@@H](C)[C@H]1CCCC[NH2+]1 ZINC000395078388 386847611 /nfs/dbraw/zinc/84/76/11/386847611.db2.gz NMPHQRODYMNBGT-NWDGAFQWSA-N 2 0 230.421 2.250 20 0 BEADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@H]2CCCc3occc32)C1 ZINC000331398505 386849407 /nfs/dbraw/zinc/84/94/07/386849407.db2.gz RXVMKPARQXBXLV-WZRBSPASSA-N 2 0 234.343 2.374 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@@H]1CC[C@H](C)C[C@H]1C ZINC000414937894 386856868 /nfs/dbraw/zinc/85/68/68/386856868.db2.gz CTFAYSLCCXFWMZ-UMSGYPCISA-N 2 0 212.381 2.399 20 0 BEADRP CS[C@@H]1CC[C@@H]1[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000425350447 386866857 /nfs/dbraw/zinc/86/68/57/386866857.db2.gz LOHMZWWGUVLZGU-NWDGAFQWSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@@H](C)C1CCSCC1 ZINC000336744607 386870411 /nfs/dbraw/zinc/87/04/11/386870411.db2.gz QIEXTXIWYDWZBN-NEPJUHHUSA-N 2 0 244.448 2.448 20 0 BEADRP CSC1(C[NH2+]CC(C)C)CC[NH+](C)CC1 ZINC000336739241 386876394 /nfs/dbraw/zinc/87/63/94/386876394.db2.gz SGFSSPNOXICKKW-UHFFFAOYSA-N 2 0 230.421 2.059 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@H](C)C1CCSCC1 ZINC000336744935 386883984 /nfs/dbraw/zinc/88/39/84/386883984.db2.gz QIEXTXIWYDWZBN-VXGBXAGGSA-N 2 0 244.448 2.448 20 0 BEADRP Cc1ccc(C)c(C[NH2+][C@@H]2CC[NH2+]C[C@@H]2C)c1 ZINC000334859352 386913578 /nfs/dbraw/zinc/91/35/78/386913578.db2.gz YSEFFPUZBZLVNS-DZGCQCFKSA-N 2 0 232.371 2.391 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(F)cc2)CC[NH2+]1 ZINC000334862401 386918301 /nfs/dbraw/zinc/91/83/01/386918301.db2.gz LCXGDWZCOBJYDQ-MFKMUULPSA-N 2 0 222.307 2.056 20 0 BEADRP Cc1cccc(C)c1C[NH2+][C@@H]1CC[NH2+]C[C@@H]1C ZINC000334857821 386910817 /nfs/dbraw/zinc/91/08/17/386910817.db2.gz OTFKQCBYWONIJO-DZGCQCFKSA-N 2 0 232.371 2.391 20 0 BEADRP Cc1ccc(F)cc1C[NH2+][C@H]1CC[NH2+]C[C@@H]1C ZINC000334859678 386913228 /nfs/dbraw/zinc/91/32/28/386913228.db2.gz ZXHQTXOXTWHVNW-FZMZJTMJSA-N 2 0 236.334 2.222 20 0 BEADRP Cc1ccsc1C[NH2+][C@@H]1CC[NH2+][C@H](C)C1 ZINC000334866192 386923426 /nfs/dbraw/zinc/92/34/26/386923426.db2.gz ULEOFMHTIFKVHX-GHMZBOCLSA-N 2 0 224.373 2.287 20 0 BEADRP Cc1ccsc1C[NH2+][C@H]1CC[NH2+][C@H](C)C1 ZINC000334866200 386923834 /nfs/dbraw/zinc/92/38/34/386923834.db2.gz ULEOFMHTIFKVHX-MNOVXSKESA-N 2 0 224.373 2.287 20 0 BEADRP c1cncc(C[N@@H+]2CCCC[C@@H]2[C@@H]2CC[NH2+]C2)c1 ZINC000334867977 386925384 /nfs/dbraw/zinc/92/53/84/386925384.db2.gz HEOBKYZNFJNTQQ-HUUCEWRRSA-N 2 0 245.370 2.046 20 0 BEADRP CC1CCC([NH2+][C@@H]2CC[NH2+][C@@H](C)C2)CC1 ZINC000334867466 386926718 /nfs/dbraw/zinc/92/67/18/386926718.db2.gz GAZAVGXSJNBHAV-PYNQCMFNSA-N 2 0 210.365 2.295 20 0 BEADRP c1ccc(C[N@@H+]2CCCC[C@H]2[C@H]2CC[NH2+]C2)nc1 ZINC000334869664 386928771 /nfs/dbraw/zinc/92/87/71/386928771.db2.gz RMLOORFZAOORPT-ZFWWWQNUSA-N 2 0 245.370 2.046 20 0 BEADRP C[C@H](O)CC(C)(C)C[NH2+][C@H]1CCCCC[C@@H]1[NH3+] ZINC000331968554 386933356 /nfs/dbraw/zinc/93/33/56/386933356.db2.gz LEQGSNVSKSGETK-AVGNSLFASA-N 2 0 242.407 2.033 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2CCCC23CCC3)CC[NH2+]1 ZINC000334816831 386942465 /nfs/dbraw/zinc/94/24/65/386942465.db2.gz BXKZKMZPOMJAIM-CHWSQXEVSA-N 2 0 222.376 2.393 20 0 BEADRP [NH3+]C1(C[NH2+]C2Cc3ccccc3C2)CCCCC1 ZINC000334816897 386943087 /nfs/dbraw/zinc/94/30/87/386943087.db2.gz CVVXWUQELJDUAV-UHFFFAOYSA-N 2 0 244.382 2.405 20 0 BEADRP CS[C@H]1CC[C@@H]1[NH2+]CCC1CC[NH+](C)CC1 ZINC000425361169 386980434 /nfs/dbraw/zinc/98/04/34/386980434.db2.gz TVBSXPPUCVKOFQ-STQMWFEESA-N 2 0 242.432 2.202 20 0 BEADRP C[NH+](C)C[C@H]1CC[N@H+](CCCCCF)C1 ZINC000341876314 386981046 /nfs/dbraw/zinc/98/10/46/386981046.db2.gz NEJBQHYJPWCKHJ-GFCCVEGCSA-N 2 0 216.344 2.010 20 0 BEADRP CC[N@H+](C)C[C@H]1CC[NH+](CCCCCF)C1 ZINC000341885624 386984867 /nfs/dbraw/zinc/98/48/67/386984867.db2.gz FRAWBDLIOAAYIG-CYBMUJFWSA-N 2 0 230.371 2.400 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@@H]([C@@H](C)[NH3+])C2)cc1 ZINC000107934680 387039475 /nfs/dbraw/zinc/03/94/75/387039475.db2.gz ZPZHCIHRZUVCFQ-TZMCWYRMSA-N 2 0 218.344 2.164 20 0 BEADRP COc1ccc(C[N@@H+]2CC[C@@H]([C@@H](C)[NH3+])C2)cc1C ZINC000126873297 387054836 /nfs/dbraw/zinc/05/48/36/387054836.db2.gz JRARVLLLAJZYFS-TZMCWYRMSA-N 2 0 248.370 2.173 20 0 BEADRP CCc1nccn1Cc1cnccc1C ZINC000334978751 387064328 /nfs/dbraw/zinc/06/43/28/387064328.db2.gz MZGRMSLRSVBHPJ-UHFFFAOYSA-N 2 0 201.273 2.197 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CCOCC1CCCC1 ZINC000313253476 387016109 /nfs/dbraw/zinc/01/61/09/387016109.db2.gz MWSMYPXLTGPOND-CYBMUJFWSA-N 2 0 242.407 2.300 20 0 BEADRP CC1(C)C[N@H+](CCC[NH3+])Cc2ccccc21 ZINC000334883272 387025505 /nfs/dbraw/zinc/02/55/05/387025505.db2.gz USBXFAHRCLYCJK-UHFFFAOYSA-N 2 0 218.344 2.129 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CC[N@H+](CCCc2ccccc2)C1 ZINC000165980403 387070488 /nfs/dbraw/zinc/07/04/88/387070488.db2.gz XEVXFIWERNPMFQ-DZGCQCFKSA-N 2 0 232.371 2.288 20 0 BEADRP CC(C)[C@H](CCc1ccccc1)[NH2+]CC1C[NH2+]C1 ZINC000423299750 387130643 /nfs/dbraw/zinc/13/06/43/387130643.db2.gz CFNATHZYHUJCQO-INIZCTEOSA-N 2 0 246.398 2.453 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@H]1CCCNc2ccccc21 ZINC000423299538 387130701 /nfs/dbraw/zinc/13/07/01/387130701.db2.gz BUEHPTDVMVUDME-FZMZJTMJSA-N 2 0 233.359 2.118 20 0 BEADRP Cc1ccc(C[NH+]2CCC([C@H](C)[NH3+])CC2)c(C)n1 ZINC000334998250 387089845 /nfs/dbraw/zinc/08/98/45/387089845.db2.gz MXJULEFADXZNGG-LBPRGKRZSA-N 2 0 247.386 2.258 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CCN(c2cc[nH+]c3ccccc32)C1 ZINC000162207104 387090997 /nfs/dbraw/zinc/09/09/97/387090997.db2.gz HHVHTRMAZJWUAE-NWDGAFQWSA-N 2 0 241.338 2.408 20 0 BEADRP C[C@H]([NH2+]CC1(C)CC[NH2+]CC1)c1nccs1 ZINC000070733562 387091321 /nfs/dbraw/zinc/09/13/21/387091321.db2.gz VCNBGHSHFCVGHA-JTQLQIEISA-N 2 0 239.388 2.183 20 0 BEADRP Cc1cc(F)ccc1C[NH2+]CCC[NH2+]C1CC1 ZINC000228410900 387092514 /nfs/dbraw/zinc/09/25/14/387092514.db2.gz WZQOVPGBKPAXHB-UHFFFAOYSA-N 2 0 236.334 2.366 20 0 BEADRP CCc1ccc(C[NH2+]CCC[NH2+]C2CC2)cc1 ZINC000228407852 387093042 /nfs/dbraw/zinc/09/30/42/387093042.db2.gz GNXZPJXPSGVWOO-UHFFFAOYSA-N 2 0 232.371 2.481 20 0 BEADRP CCOc1ccc(C[NH2+]CCC[NH2+]C2CC2)cc1 ZINC000228408756 387093593 /nfs/dbraw/zinc/09/35/93/387093593.db2.gz JQUQXCRPUSAOMT-UHFFFAOYSA-N 2 0 248.370 2.317 20 0 BEADRP CC(C)(C)C1CC([NH2+][C@@H]2CCC[C@H]2[NH3+])C1 ZINC000335004774 387098885 /nfs/dbraw/zinc/09/88/85/387098885.db2.gz FPNMHTLLUQQXLE-KIDURHIOSA-N 2 0 210.365 2.281 20 0 BEADRP CC1(F)CC([NH2+][C@@H]2CCCCC[C@H]2[NH3+])C1 ZINC000335004820 387099547 /nfs/dbraw/zinc/09/95/47/387099547.db2.gz GNOOHVCJVUYLLJ-BFUDSRACSA-N 2 0 214.328 2.127 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]C1CC(F)(F)C1 ZINC000335006095 387100842 /nfs/dbraw/zinc/10/08/42/387100842.db2.gz ANDKQAQMGQQJLG-ZJUUUORDSA-N 2 0 218.291 2.034 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CC[N@H+](C/C=C/c2ccccc2)C1 ZINC000127228490 387100959 /nfs/dbraw/zinc/10/09/59/387100959.db2.gz HPRVDICNGHPYNR-FFAUQURTSA-N 2 0 230.355 2.369 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+]Cc1cccc(F)c1 ZINC000335010108 387104912 /nfs/dbraw/zinc/10/49/12/387104912.db2.gz NNVVDZIXKWMKLC-FZMZJTMJSA-N 2 0 236.334 2.303 20 0 BEADRP C1CC2(CCCC2)[C@H]1[NH2+]C1CC[NH2+]CC1 ZINC000335010852 387107305 /nfs/dbraw/zinc/10/73/05/387107305.db2.gz RHMZSYORTBYSSK-LBPRGKRZSA-N 2 0 208.349 2.051 20 0 BEADRP Cc1cccc(C[NH2+][C@@H]2CC[NH2+]CC[C@H]2C)c1 ZINC000335025420 387115655 /nfs/dbraw/zinc/11/56/55/387115655.db2.gz RREWFJMJOPTARB-UKRRQHHQSA-N 2 0 232.371 2.473 20 0 BEADRP C[C@@H]1CC(C)(C)C[C@H]1[NH2+]CC1([NH3+])CCC1 ZINC000335026109 387118129 /nfs/dbraw/zinc/11/81/29/387118129.db2.gz XBLSMWFWSCGTIS-GHMZBOCLSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1CC(C)(C)C[C@@H]1[NH2+]CC1([NH3+])CCC1 ZINC000335026110 387118515 /nfs/dbraw/zinc/11/85/15/387118515.db2.gz XBLSMWFWSCGTIS-MNOVXSKESA-N 2 0 210.365 2.282 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CC[NH2+]CC[C@@H]2C)cc1 ZINC000335026558 387119094 /nfs/dbraw/zinc/11/90/94/387119094.db2.gz QFHAQNXLLQZBGT-ZFWWWQNUSA-N 2 0 232.371 2.473 20 0 BEADRP CCOc1ccc(C[N@@H+]2C[C@H](C[NH3+])C[C@H]2C)cc1 ZINC000250639619 387121052 /nfs/dbraw/zinc/12/10/52/387121052.db2.gz WGAVVGBFHSRTLX-OCCSQVGLSA-N 2 0 248.370 2.254 20 0 BEADRP CCOc1cccc(C[N@@H+]2C[C@@H](C[NH3+])C[C@H]2C)c1 ZINC000250507084 387124467 /nfs/dbraw/zinc/12/44/67/387124467.db2.gz FQZNAAUGYWLEPT-TZMCWYRMSA-N 2 0 248.370 2.254 20 0 BEADRP C[C@@H](C[NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1)C(F)(F)F ZINC000643482102 387128510 /nfs/dbraw/zinc/12/85/10/387128510.db2.gz FIKZPXIHJZBSTD-LPEHRKFASA-N 2 0 238.297 2.163 20 0 BEADRP CCCC[C@H]1CCC[C@@H]1[NH2+]CC1C[NH2+]C1 ZINC000423301274 387132479 /nfs/dbraw/zinc/13/24/79/387132479.db2.gz HBIPVSNNTQHOGL-STQMWFEESA-N 2 0 210.365 2.154 20 0 BEADRP Cc1cccc2c1CC[C@@H]2[NH2+]C[C@@H](C)C[NH3+] ZINC000423298573 387129696 /nfs/dbraw/zinc/12/96/96/387129696.db2.gz OOPXJBIGCBAAFW-HZMBPMFUSA-N 2 0 218.344 2.167 20 0 BEADRP COc1ccc([C@@H](C)[NH2+]C[C@@H](C)C[NH3+])c(C)c1 ZINC000423298706 387129967 /nfs/dbraw/zinc/12/99/67/387129967.db2.gz ATSHHWMOLMLSOZ-CMPLNLGQSA-N 2 0 236.359 2.249 20 0 BEADRP COc1ccc([C@H](C)[NH2+]C[C@@H](C)C[NH3+])c(C)c1 ZINC000423298708 387130110 /nfs/dbraw/zinc/13/01/10/387130110.db2.gz ATSHHWMOLMLSOZ-JQWIXIFHSA-N 2 0 236.359 2.249 20 0 BEADRP c1ccc2[nH]c(NCC[C@H]3CCC[NH2+]C3)nc2c1 ZINC000110793436 387068455 /nfs/dbraw/zinc/06/84/55/387068455.db2.gz OADWVPUMJQVGHY-LLVKDONJSA-N 2 0 244.342 2.365 20 0 BEADRP CC(C)CC[C@H]1CCC[C@@H]1[NH2+]CC1C[NH2+]C1 ZINC000423305815 387141659 /nfs/dbraw/zinc/14/16/59/387141659.db2.gz RSEMBBVLXUFDED-KGLIPLIRSA-N 2 0 224.392 2.400 20 0 BEADRP CC[C@@H]1C[C@@H](C)CC[C@@H]1[NH2+]CC1C[NH2+]C1 ZINC000423307348 387142637 /nfs/dbraw/zinc/14/26/37/387142637.db2.gz VTFNBDJTMJMKDH-UHTWSYAYSA-N 2 0 210.365 2.010 20 0 BEADRP Cc1cc(C)c([C@H](C)[NH2+]CC2C[NH2+]C2)cc1C ZINC000423307725 387143486 /nfs/dbraw/zinc/14/34/86/387143486.db2.gz WMCLKCNVSBNLKO-ZDUSSCGKSA-N 2 0 232.371 2.482 20 0 BEADRP C[C@@H](F)CC[N@H+](C)CCC[NH+]1CCCC1 ZINC000352393912 387146256 /nfs/dbraw/zinc/14/62/56/387146256.db2.gz DXMQZHOUTHWDRE-GFCCVEGCSA-N 2 0 216.344 2.152 20 0 BEADRP c1ccc(C[C@H]2CC[C@@H]([NH2+]CC3C[NH2+]C3)C2)cc1 ZINC000423309365 387146583 /nfs/dbraw/zinc/14/65/83/387146583.db2.gz ZGSLSMGJNNFNQA-GDBMZVCRSA-N 2 0 244.382 2.207 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+]CC2C[NH2+]C2)c(C)c1 ZINC000423309072 387146923 /nfs/dbraw/zinc/14/69/23/387146923.db2.gz YSTWDJGAWBSZST-GFCCVEGCSA-N 2 0 218.344 2.173 20 0 BEADRP [NH3+][C@H](C[NH2+][C@@H]1CCCC12CCCC2)C1CC1 ZINC000423310685 387149513 /nfs/dbraw/zinc/14/95/13/387149513.db2.gz ARPKBSQVPLZASF-CHWSQXEVSA-N 2 0 222.376 2.426 20 0 BEADRP CC(C)CC[C@@H]1CC[C@H]([NH2+]CC2C[NH2+]C2)C1 ZINC000423310720 387149811 /nfs/dbraw/zinc/14/98/11/387149811.db2.gz AVTWDKSCEOZMIZ-OCCSQVGLSA-N 2 0 224.392 2.400 20 0 BEADRP CCC[NH2+]CC[NH2+][C@H]1CC[C@@H]1C1CCC1 ZINC000423312641 387150669 /nfs/dbraw/zinc/15/06/69/387150669.db2.gz SGKGTAFAMJUOFS-OLZOCXBDSA-N 2 0 210.365 2.154 20 0 BEADRP Cc1cn2c(n1)[C@H](C[NH2+]Cc1cc[nH]c1)CCC2 ZINC000371133223 387150971 /nfs/dbraw/zinc/15/09/71/387150971.db2.gz JAROZMNYZORVDF-ZDUSSCGKSA-N 2 0 244.342 2.187 20 0 BEADRP [NH3+][C@H](C[NH2+][C@H]1CCCC12CCC2)C1CC1 ZINC000423313890 387150970 /nfs/dbraw/zinc/15/09/70/387150970.db2.gz GGVGFOWCXAXBKZ-NEPJUHHUSA-N 2 0 208.349 2.036 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]([NH3+])C1CC1)C1CCCC1 ZINC000423313107 387151258 /nfs/dbraw/zinc/15/12/58/387151258.db2.gz FAVIYHFAUZMHEK-OLZOCXBDSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H](C)[C@@H]1C[C@H]1c1ccccc1 ZINC000423313955 387151716 /nfs/dbraw/zinc/15/17/16/387151716.db2.gz XMGKBPHKAXJDBS-DHMWGJHJSA-N 2 0 232.371 2.363 20 0 BEADRP CC[C@@H]([NH2+]C[C@H]([NH3+])C1CC1)C1CCCC1 ZINC000423313108 387151781 /nfs/dbraw/zinc/15/17/81/387151781.db2.gz FAVIYHFAUZMHEK-QWHCGFSZSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+][C@H](C[NH2+][C@H]1CCC[C@H]1CCCF)C1CC1 ZINC000423317185 387156969 /nfs/dbraw/zinc/15/69/69/387156969.db2.gz KAWQMZGXGIRGHU-XQQFMLRXSA-N 2 0 228.355 2.232 20 0 BEADRP CCCCO[C@@H]1C[C@@H]([NH2+]C[C@H](C)C[NH3+])C1(C)C ZINC000423316188 387156991 /nfs/dbraw/zinc/15/69/91/387156991.db2.gz ZQTJDWNOMFPSBO-JHJVBQTASA-N 2 0 242.407 2.155 20 0 BEADRP CC(C)O[C@@H]1C[C@H]([NH2+]CC2([NH3+])CCC2)C1(C)C ZINC000423315958 387157401 /nfs/dbraw/zinc/15/74/01/387157401.db2.gz BHVDIRCNJSDQDW-NWDGAFQWSA-N 2 0 240.391 2.050 20 0 BEADRP [NH3+][C@H](C[NH2+][C@@H]1CCC[C@H]1CCCF)C1CC1 ZINC000423317187 387157817 /nfs/dbraw/zinc/15/78/17/387157817.db2.gz KAWQMZGXGIRGHU-YNEHKIRRSA-N 2 0 228.355 2.232 20 0 BEADRP CC[C@@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)C(C)C ZINC000423318662 387158303 /nfs/dbraw/zinc/15/83/03/387158303.db2.gz CUIGTRSULLEHIS-OLZOCXBDSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]([NH3+])C1CC1)C1C(C)(C)C1(C)C ZINC000423318982 387158346 /nfs/dbraw/zinc/15/83/46/387158346.db2.gz LHIKEVOEBKNMOS-MWLCHTKSSA-N 2 0 224.392 2.384 20 0 BEADRP Cc1ccncc1[C@@H](C)[NH2+]CC1(C)CC[NH2+]CC1 ZINC000423318601 387159339 /nfs/dbraw/zinc/15/93/39/387159339.db2.gz CPJPZTGTDRUIRA-CYBMUJFWSA-N 2 0 247.386 2.430 20 0 BEADRP CC[C@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)C1CC1 ZINC000423318161 387159651 /nfs/dbraw/zinc/15/96/51/387159651.db2.gz CFDVBFRFQDUEMN-QWHCGFSZSA-N 2 0 210.365 2.154 20 0 BEADRP CCC[NH2+]CC[NH2+][C@@H]1CCCC12CCC2 ZINC000423317791 387160068 /nfs/dbraw/zinc/16/00/68/387160068.db2.gz YTGSNJXICRKZTA-GFCCVEGCSA-N 2 0 210.365 2.298 20 0 BEADRP C[C@H](CCCc1cccnc1)[NH2+]C[C@H]([NH3+])C1CC1 ZINC000423320239 387160712 /nfs/dbraw/zinc/16/07/12/387160712.db2.gz MFTXSOQQAXFJNA-DOMZBBRYSA-N 2 0 247.386 2.120 20 0 BEADRP [NH3+][C@H](C[NH2+]C1CCC2(CC2)CC1)C1CC1 ZINC000423320740 387161752 /nfs/dbraw/zinc/16/17/52/387161752.db2.gz MOMBLKIEOMLNFL-GFCCVEGCSA-N 2 0 208.349 2.036 20 0 BEADRP [NH3+][C@@H](C[NH2+]C(C1CCC1)C1CCC1)C1CC1 ZINC000423320173 387163066 /nfs/dbraw/zinc/16/30/66/387163066.db2.gz MBWQJVBTGRJITA-ZDUSSCGKSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]Cc1cc(F)c(F)c(F)c1 ZINC000571762297 387164127 /nfs/dbraw/zinc/16/41/27/387164127.db2.gz GGMPURCQBQJZEU-YUMQZZPRSA-N 2 0 246.276 2.319 20 0 BEADRP CCC[C@H]([NH2+]C[C@@H]([NH3+])C1CC1)C1CCC1 ZINC000423324396 387167146 /nfs/dbraw/zinc/16/71/46/387167146.db2.gz PGXIMZCHTMFQBY-OLZOCXBDSA-N 2 0 210.365 2.282 20 0 BEADRP Cc1c([C@@H](C)[NH2+]CCCC[NH3+])cnn1C(C)C ZINC000423343551 387193419 /nfs/dbraw/zinc/19/34/19/387193419.db2.gz ZYGWIHGZPVHRMB-LLVKDONJSA-N 2 0 238.379 2.162 20 0 BEADRP C[C@@H](Cc1ccc(F)cc1)[NH2+]CC1=CC[NH2+]CC1 ZINC000423329551 387172383 /nfs/dbraw/zinc/17/23/83/387172383.db2.gz BGHBVIWXBLAHQO-LBPRGKRZSA-N 2 0 248.345 2.266 20 0 BEADRP [NH3+]C1(C[NH2+][C@H]2CCC[C@@H]2CCCF)CCC1 ZINC000423330698 387174794 /nfs/dbraw/zinc/17/47/94/387174794.db2.gz PSXYDQUJOKDLMT-NEPJUHHUSA-N 2 0 228.355 2.376 20 0 BEADRP CCO[C@@H]1C[C@@H]([NH2+]CCCC[NH3+])C1(CC)CC ZINC000423330644 387176440 /nfs/dbraw/zinc/17/64/40/387176440.db2.gz PMQVMENYYLJADC-CHWSQXEVSA-N 2 0 242.407 2.299 20 0 BEADRP CC(C)(C)[C@@H]1CC[C@H]1[NH2+]C[C@@H]([NH3+])C1CC1 ZINC000423339733 387188749 /nfs/dbraw/zinc/18/87/49/387188749.db2.gz ZPLUEVFGGFZITN-IJLUTSLNSA-N 2 0 210.365 2.138 20 0 BEADRP CCc1ccc([C@H](C)[NH2+]CC2=CC[NH2+]CC2)o1 ZINC000423340338 387189635 /nfs/dbraw/zinc/18/96/35/387189635.db2.gz JKGJKOMVOTYNJJ-NSHDSACASA-N 2 0 234.343 2.412 20 0 BEADRP c1ccc(CCC[N@@H+]2CC[C@@H]3[NH2+]CC[C@@H]3C2)cc1 ZINC000336794650 387189798 /nfs/dbraw/zinc/18/97/98/387189798.db2.gz DPDRBMHDXUSNPD-CVEARBPZSA-N 2 0 244.382 2.303 20 0 BEADRP CC[C@H]([NH2+]CC1C[NH2+]C1)C1CCCCC1 ZINC000423300528 387132867 /nfs/dbraw/zinc/13/28/67/387132867.db2.gz FDJUIXYVKVEYRB-ZDUSSCGKSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H](c1cccnc1)C1CCC1 ZINC000423301791 387135635 /nfs/dbraw/zinc/13/56/35/387135635.db2.gz GNAVGJYSWGBAIO-RISCZKNCSA-N 2 0 233.359 2.107 20 0 BEADRP CC(C)[C@@H]([NH2+]CC1C[NH2+]C1)c1ccccc1 ZINC000423302777 387135676 /nfs/dbraw/zinc/13/56/76/387135676.db2.gz KLZUSJGAAJIRTA-CQSZACIVSA-N 2 0 218.344 2.193 20 0 BEADRP CC1(C)CC([NH2+]CC2C[NH2+]C2)CC(C)(C)C1 ZINC000423303501 387138057 /nfs/dbraw/zinc/13/80/57/387138057.db2.gz LTHYIVUJVUKOSD-UHFFFAOYSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CCCN(C)c1ccccc1 ZINC000336792175 387139718 /nfs/dbraw/zinc/13/97/18/387139718.db2.gz QWVNDRNVCWVWLI-CQSZACIVSA-N 2 0 249.402 2.230 20 0 BEADRP C[C@@H]([NH2+]CC1C[NH2+]C1)C12CC3CC(CC(C3)C1)C2 ZINC000423304671 387139940 /nfs/dbraw/zinc/13/99/40/387139940.db2.gz OQQHDWVPSATIFT-UWJCENJNSA-N 2 0 248.414 2.400 20 0 BEADRP CC[C@@H]([NH2+]CC1=CC[NH2+]CC1)c1ccncc1 ZINC000423353291 387205515 /nfs/dbraw/zinc/20/55/15/387205515.db2.gz LOQPPUZYMVPDQV-CQSZACIVSA-N 2 0 231.343 2.042 20 0 BEADRP c1ccc2c(c1)CCC[C@@H]([NH2+]C1CC[NH2+]CC1)C2 ZINC000643496302 387206445 /nfs/dbraw/zinc/20/64/45/387206445.db2.gz QMQRZQLESQJUHN-MRXNPFEDSA-N 2 0 244.382 2.276 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCC[NH2+]1)C1CCSCC1 ZINC000423357914 387209717 /nfs/dbraw/zinc/20/97/17/387209717.db2.gz IYNUIBUIYUCLAC-WCQYABFASA-N 2 0 242.432 2.250 20 0 BEADRP C(C[C@H]1CCC[NH2+]1)[NH2+][C@H]1CC[C@@H]1C1CCC1 ZINC000423359039 387210924 /nfs/dbraw/zinc/21/09/24/387210924.db2.gz ORXZETKZCJRJTQ-MCIONIFRSA-N 2 0 222.376 2.297 20 0 BEADRP CC[C@H](Cc1cccs1)[NH2+]CCC[NH3+] ZINC000643496684 387217302 /nfs/dbraw/zinc/21/73/02/387217302.db2.gz AFXKDERSJQAVMU-SNVBAGLBSA-N 2 0 212.362 2.008 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCC[C@H]([NH3+])C1)c1ccncc1 ZINC000423368798 387222050 /nfs/dbraw/zinc/22/20/50/387222050.db2.gz NOEWGCGQHBPYFL-MJBXVCDLSA-N 2 0 233.359 2.392 20 0 BEADRP COc1cccc([C@H](C)[NH2+][C@H]2CC[NH2+][C@H](C)C2)c1 ZINC000423372696 387225667 /nfs/dbraw/zinc/22/56/67/387225667.db2.gz IKTDGTPKHASWCF-DYEKYZERSA-N 2 0 248.370 2.486 20 0 BEADRP [NH3+][C@@H]1CC[C@H]2C[N@H+](CCCc3ccccc3)C[C@H]12 ZINC000336796094 387226181 /nfs/dbraw/zinc/22/61/81/387226181.db2.gz PKKFEZHLSSWPSW-HRCADAONSA-N 2 0 244.382 2.288 20 0 BEADRP [NH3+]CCC[N@H+](CCCF)Cc1ccccc1 ZINC000230030881 387228834 /nfs/dbraw/zinc/22/88/34/387228834.db2.gz IEHXSIGVNFGYEV-UHFFFAOYSA-N 2 0 224.323 2.197 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@@H]1CCC[C@@H]2C[C@@]21C ZINC000423396409 387231817 /nfs/dbraw/zinc/23/18/17/387231817.db2.gz NUEZMCAEOHAWTJ-RGDJUOJXSA-N 2 0 222.376 2.153 20 0 BEADRP CC(C)N(C)C[C@@H](C)[NH2+][C@@H](C)[C@H]1CCCOC1 ZINC000353579274 387233285 /nfs/dbraw/zinc/23/32/85/387233285.db2.gz TUDYZPCAZPMTJP-RDBSUJKOSA-N 2 0 242.407 2.120 20 0 BEADRP c1cnc2c(c1)CCC[C@@H]2[NH2+]CC1CC[NH2+]CC1 ZINC000643497454 387239881 /nfs/dbraw/zinc/23/98/81/387239881.db2.gz VLQCFLXUMRPYKS-AWEZNQCLSA-N 2 0 245.370 2.048 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@H]1CCC[C@@H]1CCCF ZINC000423403751 387241507 /nfs/dbraw/zinc/24/15/07/387241507.db2.gz ZMDUSNWGNZGMEB-UPJWGTAASA-N 2 0 230.371 2.492 20 0 BEADRP COC[C@H]([NH2+][C@@H]1CCC[C@H]([NH3+])C1)c1ccccc1 ZINC000423406146 387242525 /nfs/dbraw/zinc/24/25/25/387242525.db2.gz YQFCSKDJCYNZFY-ZNMIVQPWSA-N 2 0 248.370 2.234 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)c1ccncc1 ZINC000423426066 387252001 /nfs/dbraw/zinc/25/20/01/387252001.db2.gz OYXATUMAJCFADH-IHRRRGAJSA-N 2 0 247.386 2.497 20 0 BEADRP CC(C)(C)[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000423425408 387252076 /nfs/dbraw/zinc/25/20/76/387252076.db2.gz GPLWNLAUGGPWKU-BJJPWKGXSA-N 2 0 236.403 2.399 20 0 BEADRP CC(C)(C)[C@@H]1CC[C@H]1[NH2+]CC1([NH3+])CCC1 ZINC000423345363 387194287 /nfs/dbraw/zinc/19/42/87/387194287.db2.gz YWLBWLLRRFDAIZ-GHMZBOCLSA-N 2 0 210.365 2.282 20 0 BEADRP CCc1nc(C)c([C@@H](C)[NH2+]CCCC[NH3+])s1 ZINC000423345609 387194467 /nfs/dbraw/zinc/19/44/67/387194467.db2.gz XWHAMHFNBHXZFK-SECBINFHSA-N 2 0 241.404 2.403 20 0 BEADRP C[NH+](C)C1CCC([NH2+]Cc2cccc(O)c2)CC1 ZINC000353398664 387194718 /nfs/dbraw/zinc/19/47/18/387194718.db2.gz BGETXXBAURLISQ-UHFFFAOYSA-N 2 0 248.370 2.355 20 0 BEADRP C[C@H]([NH2+]CC1(C)CC[NH2+]CC1)[C@@H]1C[C@H]1C ZINC000423345760 387195677 /nfs/dbraw/zinc/19/56/77/387195677.db2.gz ZABMNHLDFUWWIJ-GRYCIOLGSA-N 2 0 210.365 2.010 20 0 BEADRP C1=C(C[NH2+][C@@H]2CCC[C@H]2C2CC2)CC[NH2+]C1 ZINC000423347157 387196662 /nfs/dbraw/zinc/19/66/62/387196662.db2.gz QEYLHSIVKHTCGH-UONOGXRCSA-N 2 0 220.360 2.074 20 0 BEADRP C[C@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)[C@@H]1CC1(C)C ZINC000423346762 387196815 /nfs/dbraw/zinc/19/68/15/387196815.db2.gz QCTGHGVOVXIATH-SGMGOOAPSA-N 2 0 224.392 2.400 20 0 BEADRP CC[C@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)[C@H]1C[C@@H]1C ZINC000423348058 387197112 /nfs/dbraw/zinc/19/71/12/387197112.db2.gz SJXDOBDJSZELOR-XDQVBPFNSA-N 2 0 224.392 2.400 20 0 BEADRP CC[C@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)[C@@H]1C[C@@H]1C ZINC000423348057 387197454 /nfs/dbraw/zinc/19/74/54/387197454.db2.gz SJXDOBDJSZELOR-RFQIPJPRSA-N 2 0 224.392 2.400 20 0 BEADRP C1=C(C[NH2+]C2C3CC4CC(C3)CC2C4)CC[NH2+]C1 ZINC000423346984 387197548 /nfs/dbraw/zinc/19/75/48/387197548.db2.gz PUZIPMZLWCRYEW-UHFFFAOYSA-N 2 0 246.398 2.320 20 0 BEADRP COc1ccccc1[C@@H](C)[NH2+]CC1=CC[NH2+]CC1 ZINC000423349448 387199074 /nfs/dbraw/zinc/19/90/74/387199074.db2.gz WUPREJDPAVJKCP-GFCCVEGCSA-N 2 0 246.354 2.266 20 0 BEADRP CCC[C@@H]([NH2+]CC1=CC[NH2+]CC1)c1ccccn1 ZINC000423349607 387200329 /nfs/dbraw/zinc/20/03/29/387200329.db2.gz XCQJAABNAHVRBI-CQSZACIVSA-N 2 0 245.370 2.432 20 0 BEADRP CCCC[C@H](CC)[NH2+]CC1=CC[NH2+]CC1 ZINC000423348616 387201248 /nfs/dbraw/zinc/20/12/48/387201248.db2.gz UMJXPYUVJLNSJN-ZDUSSCGKSA-N 2 0 210.365 2.465 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H](C)c1ccc2c(c1)COC2 ZINC000423463839 387312780 /nfs/dbraw/zinc/31/27/80/387312780.db2.gz VMHOLSIVZIKOAH-VXGBXAGGSA-N 2 0 248.370 2.495 20 0 BEADRP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)[C@@H]1C[C@H]1C ZINC000321903029 387313188 /nfs/dbraw/zinc/31/31/88/387313188.db2.gz NYSWDCSEBISATE-NCXFDQOBSA-N 2 0 222.376 2.246 20 0 BEADRP C[C@@H](CN)[NH2+][C@@H]1CCCCc2ccccc21 ZINC000423381409 387263567 /nfs/dbraw/zinc/26/35/67/387263567.db2.gz ZRDOZHFTOYMLCE-SMDDNHRTSA-N 2 0 218.344 2.391 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@H]1CCCC12CCC2 ZINC000423382450 387266509 /nfs/dbraw/zinc/26/65/09/387266509.db2.gz IPIGEGVPQDUAFT-NEPJUHHUSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@H]([NH3+])C1)c1cncc(F)c1 ZINC000423385075 387268933 /nfs/dbraw/zinc/26/89/33/387268933.db2.gz LLYQSTHQCCNJFS-XDTLVQLUSA-N 2 0 237.322 2.141 20 0 BEADRP C[C@@H](CC1CCC1)[NH2+]CC1CC[NH2+]CC1 ZINC000643497739 387269578 /nfs/dbraw/zinc/26/95/78/387269578.db2.gz YPSPFPBFWNXRDN-NSHDSACASA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H](CC1CCC1)[NH2+]CC1CC[NH2+]CC1 ZINC000643497734 387269711 /nfs/dbraw/zinc/26/97/11/387269711.db2.gz YPSPFPBFWNXRDN-LLVKDONJSA-N 2 0 210.365 2.154 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000423432030 387283805 /nfs/dbraw/zinc/28/38/05/387283805.db2.gz JBSVFIQWRUQAFF-YXCITZCRSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]([C@H](C)[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21)C1CCCCC1 ZINC000423436643 387285531 /nfs/dbraw/zinc/28/55/31/387285531.db2.gz PZFMGDBCVDOQDK-XSXPHNMFSA-N 2 0 236.403 2.399 20 0 BEADRP CC[C@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)[C@H]1C[C@@H]1C ZINC000423437823 387288476 /nfs/dbraw/zinc/28/84/76/387288476.db2.gz QVBDFSNGYMGWKK-MFGQWXODSA-N 2 0 236.403 2.399 20 0 BEADRP CCCCO[C@@H]1C[C@H]([NH2+][C@H](C)[C@H](C)[NH3+])C1(C)C ZINC000423444714 387294396 /nfs/dbraw/zinc/29/43/96/387294396.db2.gz LYWQAJTWBOWGSP-QNWHQSFQSA-N 2 0 242.407 2.296 20 0 BEADRP CCCCO[C@@H]1C[C@H]([NH2+][C@H](C)[C@@H](C)[NH3+])C1(C)C ZINC000423444711 387295133 /nfs/dbraw/zinc/29/51/33/387295133.db2.gz LYWQAJTWBOWGSP-FVCCEPFGSA-N 2 0 242.407 2.296 20 0 BEADRP CC(C)n1cc([C@@H](C)[NH2+][C@@H](C)C[C@H](C)[NH3+])cn1 ZINC000514854736 387298170 /nfs/dbraw/zinc/29/81/70/387298170.db2.gz HMZXWPVKGHZMHX-SDDRHHMPSA-N 2 0 238.379 2.240 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H](C)C1CCSCC1 ZINC000423451787 387300510 /nfs/dbraw/zinc/30/05/10/387300510.db2.gz IYNFCGJFHICHGR-MNOVXSKESA-N 2 0 230.421 2.235 20 0 BEADRP CCO[C@@H]1C[C@H]([NH2+][C@@H](C)[C@H](C)[NH3+])C12CCCC2 ZINC000423453819 387302512 /nfs/dbraw/zinc/30/25/12/387302512.db2.gz YHCZLOGMNJERAV-ZDEQEGDKSA-N 2 0 240.391 2.050 20 0 BEADRP CCCCO[C@@H]1C[C@@H]([NH2+]C[C@H]([NH3+])CC)C1(C)C ZINC000423455421 387304260 /nfs/dbraw/zinc/30/42/60/387304260.db2.gz CKKQXBGAEHWCAE-JHJVBQTASA-N 2 0 242.407 2.297 20 0 BEADRP CC[C@H]([NH3+])C[NH2+]C(C1CCC1)C1CCC1 ZINC000423456607 387304315 /nfs/dbraw/zinc/30/43/15/387304315.db2.gz DSLOBFFORXPELM-LBPRGKRZSA-N 2 0 210.365 2.282 20 0 BEADRP CCCCO[C@@H]1C[C@H]([NH2+]C[C@H]([NH3+])CC)C1(C)C ZINC000423455420 387304925 /nfs/dbraw/zinc/30/49/25/387304925.db2.gz CKKQXBGAEHWCAE-FRRDWIJNSA-N 2 0 242.407 2.297 20 0 BEADRP C[C@H]([NH3+])[C@H](C)[NH2+][C@@H]1CCCC12CCCC2 ZINC000423457488 387305548 /nfs/dbraw/zinc/30/55/48/387305548.db2.gz FXSHSNBPYMNILU-SDDRHHMPSA-N 2 0 210.365 2.425 20 0 BEADRP CCC[C@@H](C)[C@H](CC)[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000423458685 387306622 /nfs/dbraw/zinc/30/66/22/387306622.db2.gz QLTRSKVIOFGWJW-BNDIWNMDSA-N 2 0 210.365 2.009 20 0 BEADRP C[N@H+](CC1(C)CC1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000514928335 387308307 /nfs/dbraw/zinc/30/83/07/387308307.db2.gz TZDDECPXMXYOIO-FUNVUKJBSA-N 2 0 222.376 2.344 20 0 BEADRP C[C@@H]([NH2+]CCC1=CC[NH2+]CC1)c1cccnc1 ZINC000423537703 387363828 /nfs/dbraw/zinc/36/38/28/387363828.db2.gz KRGKIJXOWKOEHI-GFCCVEGCSA-N 2 0 231.343 2.042 20 0 BEADRP Cc1ccnc([C@@H](C)[NH2+]CCC2=CC[NH2+]CC2)c1 ZINC000423537054 387363850 /nfs/dbraw/zinc/36/38/50/387363850.db2.gz IWCJDRZGDSAARJ-CYBMUJFWSA-N 2 0 245.370 2.350 20 0 BEADRP CC[C@@H]1C[C@@H]([NH2+][C@H](C)[C@H]2CCCC[NH2+]2)CCO1 ZINC000423545647 387370394 /nfs/dbraw/zinc/37/03/94/387370394.db2.gz JTDVKFWQQZYODZ-XJFOESAGSA-N 2 0 240.391 2.064 20 0 BEADRP c1ccc2c(c1)C[C@@H]2C[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000643453498 387370683 /nfs/dbraw/zinc/37/06/83/387370683.db2.gz HNAZBFGLFPJQKB-JKXDFHQYSA-N 2 0 242.366 2.199 20 0 BEADRP CC[C@@H]1C[C@H]([NH2+][C@@H](C)[C@H]2CCCC[NH2+]2)CCO1 ZINC000423545642 387371152 /nfs/dbraw/zinc/37/11/52/387371152.db2.gz JTDVKFWQQZYODZ-REWJHTLYSA-N 2 0 240.391 2.064 20 0 BEADRP CC[C@H]([NH2+]CCC[NH2+]C1CC1)[C@@H]1C[C@@H]1C ZINC000423546525 387371431 /nfs/dbraw/zinc/37/14/31/387371431.db2.gz FLERSVUMBYSYSQ-UHTWSYAYSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@H]([NH2+][C@H]1CCO[C@H](CC)C1)[C@@H]1CCC[NH2+]1 ZINC000423546233 387371444 /nfs/dbraw/zinc/37/14/44/387371444.db2.gz KMBBFUFGOWGYDZ-CRWXNKLISA-N 2 0 240.391 2.064 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)[C@@H]1C[C@@H]1C ZINC000423552856 387373505 /nfs/dbraw/zinc/37/35/05/387373505.db2.gz QDPGHELYHDLFPL-QAIIKZMUSA-N 2 0 236.403 2.399 20 0 BEADRP CC[C@@H]1C[C@H]([NH2+]C2CCC(C[NH3+])CC2)CCO1 ZINC000423561337 387378147 /nfs/dbraw/zinc/37/81/47/387378147.db2.gz VVTHWVUBKOADOH-NWINJMCUSA-N 2 0 240.391 2.051 20 0 BEADRP C1CC([C@H]2CC[C@@H]2[NH2+][C@H]2CCCC[NH2+]C2)C1 ZINC000423568606 387379508 /nfs/dbraw/zinc/37/95/08/387379508.db2.gz VQVXIVYWPIMVQO-MJBXVCDLSA-N 2 0 222.376 2.297 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+]C1CCC(CSC)CC1 ZINC000423475163 387321895 /nfs/dbraw/zinc/32/18/95/387321895.db2.gz RRVNRBFCPGJHDR-MOENNCHZSA-N 2 0 230.421 2.235 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@H](C)CCCc1cccnc1 ZINC000423478939 387326307 /nfs/dbraw/zinc/32/63/07/387326307.db2.gz UXUMQVZZWWQIGU-TZMCWYRMSA-N 2 0 235.375 2.120 20 0 BEADRP C[C@H]([NH3+])CN1CCC[C@@H]1c1ccc(F)cc1 ZINC000336501071 387326521 /nfs/dbraw/zinc/32/65/21/387326521.db2.gz OJAOFZHUAVLAHZ-GXFFZTMASA-N 2 0 222.307 2.310 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](C)c1cncs1 ZINC000423430592 387326766 /nfs/dbraw/zinc/32/67/66/387326766.db2.gz LDKLPOHMAPQQRK-UWVGGRQHSA-N 2 0 227.377 2.311 20 0 BEADRP C[C@H]([NH3+])[C@H](C)[NH2+][C@@H]1CCC[C@H](c2cccnc2)C1 ZINC000423482980 387328766 /nfs/dbraw/zinc/32/87/66/387328766.db2.gz XQHVKEZHOUXRLD-PWNZVWSESA-N 2 0 247.386 2.433 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@H](C[NH3+])C1)c1ccco1 ZINC000423488896 387334242 /nfs/dbraw/zinc/33/42/42/387334242.db2.gz FJLDNGZDHUBVFO-GARJFASQSA-N 2 0 208.305 2.058 20 0 BEADRP CC[C@@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)C1CC1 ZINC000423490976 387335452 /nfs/dbraw/zinc/33/54/52/387335452.db2.gz YGMXGFRLRZLRBL-QWHCGFSZSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H](CCC(C)(C)C)[NH2+]C[C@@H]1C[NH2+]CCCO1 ZINC000423491931 387337026 /nfs/dbraw/zinc/33/70/26/387337026.db2.gz KUHSENJKEFPVQY-OLZOCXBDSA-N 2 0 242.407 2.169 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCN(C)[C@H](C)C2)C[C@H](C)O1 ZINC000515125242 387338262 /nfs/dbraw/zinc/33/82/62/387338262.db2.gz KCGJRBXBXVGYOR-RGDJUOJXSA-N 2 0 240.391 2.015 20 0 BEADRP Cc1nc([C@H](C)[NH2+][C@@H]2CC[C@@H](C[NH3+])C2)cs1 ZINC000423493558 387338615 /nfs/dbraw/zinc/33/86/15/387338615.db2.gz BVWYNUIDJNSPIN-JMJZKYOTSA-N 2 0 239.388 2.230 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])C1)C1CCCC1 ZINC000423494939 387339137 /nfs/dbraw/zinc/33/91/37/387339137.db2.gz SVGYKFWFZXKZDX-GVXVVHGQSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@@H](C)[C@@H]1C[C@H]1C ZINC000321989886 387345109 /nfs/dbraw/zinc/34/51/09/387345109.db2.gz DWWGNUCUHUVTGH-FRRDWIJNSA-N 2 0 212.381 2.351 20 0 BEADRP CCSCC[N@@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000121865942 387423398 /nfs/dbraw/zinc/42/33/98/387423398.db2.gz RUWVDMSCNJBRQB-ZDUSSCGKSA-N 2 0 242.432 2.157 20 0 BEADRP CSC1(C[NH2+][C@H]2CC[N@H+](C)C[C@H]2C)CCC1 ZINC000304004846 387428266 /nfs/dbraw/zinc/42/82/66/387428266.db2.gz SYEMWLFCOLLZIC-NEPJUHHUSA-N 2 0 242.432 2.202 20 0 BEADRP CC[C@@H](C)C[N@@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000121684772 387392429 /nfs/dbraw/zinc/39/24/29/387392429.db2.gz CDPFHFWLGWJEDL-ZIAGYGMSSA-N 2 0 224.392 2.450 20 0 BEADRP Cc1ncc([C@@H](C)[NH2+]C2CCC([NH3+])CC2)s1 ZINC000643503588 387393709 /nfs/dbraw/zinc/39/37/09/387393709.db2.gz HOAJLUISHNCLIG-MFAVDMRSSA-N 2 0 239.388 2.372 20 0 BEADRP Cc1ccc(CCC[NH2+]CCC(C)(C)O)cn1 ZINC000354682398 387415452 /nfs/dbraw/zinc/41/54/52/387415452.db2.gz WGCVJDDXPFFANK-UHFFFAOYSA-N 2 0 236.359 2.073 20 0 BEADRP C[NH+](C)CCC1CC[NH+](CCCF)CC1 ZINC000121834533 387422180 /nfs/dbraw/zinc/42/21/80/387422180.db2.gz RZDAEEDOJWOFAP-UHFFFAOYSA-N 2 0 216.344 2.010 20 0 BEADRP c1cn(CC[N@H+](CC2CC2)C2CCC2)cn1 ZINC000361578046 387498169 /nfs/dbraw/zinc/49/81/69/387498169.db2.gz NHENFEMTNRFFLP-UHFFFAOYSA-N 2 0 219.332 2.148 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000643509290 387501985 /nfs/dbraw/zinc/50/19/85/387501985.db2.gz UWCIHJSVMTXPLR-CHWSQXEVSA-N 2 0 236.359 2.190 20 0 BEADRP CCN(CC)[C@H](C)C[NH2+][C@H](C)[C@H]1CCCOC1 ZINC000355295865 387515279 /nfs/dbraw/zinc/51/52/79/387515279.db2.gz SFJNGIMXPOVDQQ-MCIONIFRSA-N 2 0 242.407 2.121 20 0 BEADRP CO[C@H](C[N@@H+]1C[C@@H](C[NH3+])C[C@@H]1C)c1ccccc1 ZINC000379241319 387532092 /nfs/dbraw/zinc/53/20/92/387532092.db2.gz WZKTUCDRJVNGKP-GZBFAFLISA-N 2 0 248.370 2.043 20 0 BEADRP Cc1cc(C)c(C[NH2+][C@@H]2CCCC[C@@H]2C[NH3+])cn1 ZINC000397026978 387534222 /nfs/dbraw/zinc/53/42/22/387534222.db2.gz OEZDZZFVFZPWOG-UKRRQHHQSA-N 2 0 247.386 2.306 20 0 BEADRP Cc1nccn1CC[N@@H+](C)Cc1cnccc1C ZINC000361444069 387462686 /nfs/dbraw/zinc/46/26/86/387462686.db2.gz GQOPXLDBOZTFAP-UHFFFAOYSA-N 2 0 244.342 2.027 20 0 BEADRP CC(C)C[C@H]1CCC[N@@H+]1CC[C@H]1CC[NH2+]C1 ZINC000396780036 387492530 /nfs/dbraw/zinc/49/25/30/387492530.db2.gz URZICZSHJUQPIL-ZIAGYGMSSA-N 2 0 224.392 2.497 20 0 BEADRP CCSCC[N@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000375763842 387580358 /nfs/dbraw/zinc/58/03/58/387580358.db2.gz NXJCDTOLKUBBMU-FUNVUKJBSA-N 2 0 242.432 2.297 20 0 BEADRP CC[C@H](Cc1cccs1)[NH2+]C[C@@H](C)C[NH3+] ZINC000643514661 387598730 /nfs/dbraw/zinc/59/87/30/387598730.db2.gz LILBHLYEJGHKGM-WDEREUQCSA-N 2 0 226.389 2.254 20 0 BEADRP CC[C@H](Cc1cccs1)[NH2+]C[C@H](C)C[NH3+] ZINC000643514658 387598941 /nfs/dbraw/zinc/59/89/41/387598941.db2.gz LILBHLYEJGHKGM-GHMZBOCLSA-N 2 0 226.389 2.254 20 0 BEADRP Cc1ccc(CC[NH2+][C@H](C)C2C[NH2+]C2)c(C)c1 ZINC000422698943 387614841 /nfs/dbraw/zinc/61/48/41/387614841.db2.gz BWLPBLKOBWIPEZ-CYBMUJFWSA-N 2 0 232.371 2.043 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]C[C@H]1C[C@@H]1C ZINC000422701915 387617431 /nfs/dbraw/zinc/61/74/31/387617431.db2.gz JKRUDGOAADDBFC-JBLDHEPKSA-N 2 0 233.359 2.155 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]Cc1ccc2ccccc2n1 ZINC000422702914 387618195 /nfs/dbraw/zinc/61/81/95/387618195.db2.gz LSMNIJOWKPYJFS-NWDGAFQWSA-N 2 0 243.354 2.450 20 0 BEADRP C[C@@H]([NH2+]CCC[NH3+])c1ccc2c(c1)CCC2 ZINC000037713510 387564906 /nfs/dbraw/zinc/56/49/06/387564906.db2.gz UJPVKJMZPKPHES-LLVKDONJSA-N 2 0 218.344 2.175 20 0 BEADRP CC[C@@H]([NH2+][C@H](C)CCC[NH3+])c1ccncc1 ZINC000422792449 387694489 /nfs/dbraw/zinc/69/44/89/387694489.db2.gz XANIAUASQWFTGW-DGCLKSJQSA-N 2 0 221.348 2.250 20 0 BEADRP CCc1cccc(OCCN2CCC[C@@H]2C[NH3+])c1 ZINC000430595300 387629877 /nfs/dbraw/zinc/62/98/77/387629877.db2.gz XFOZPFHXYRQUBY-CQSZACIVSA-N 2 0 248.370 2.051 20 0 BEADRP CCc1ccc(C[NH2+][C@@](C)(C[NH3+])C2CC2)cc1 ZINC000430599374 387634191 /nfs/dbraw/zinc/63/41/91/387634191.db2.gz PYJMGLGAQAQZES-HNNXBMFYSA-N 2 0 232.371 2.466 20 0 BEADRP CCOCCCC[NH2+][C@H]1CCCCC[C@@H]1[NH3+] ZINC000422726203 387635122 /nfs/dbraw/zinc/63/51/22/387635122.db2.gz ZIFPCODOJHGFHD-STQMWFEESA-N 2 0 228.380 2.053 20 0 BEADRP C[C@H](CCc1ccccc1)[NH2+][C@H](C)C1C[NH2+]C1 ZINC000422730874 387638030 /nfs/dbraw/zinc/63/80/30/387638030.db2.gz MPHPTBIKIKUNBP-CHWSQXEVSA-N 2 0 232.371 2.205 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+]CCCc1ccccc1 ZINC000422732240 387640155 /nfs/dbraw/zinc/64/01/55/387640155.db2.gz NOYPWQICDQRDED-UONOGXRCSA-N 2 0 218.344 2.089 20 0 BEADRP Cc1ncc(C[NH2+]C2CCC(C[NH3+])CC2)s1 ZINC000422739231 387645789 /nfs/dbraw/zinc/64/57/89/387645789.db2.gz KVCRELJUPYJUBN-UHFFFAOYSA-N 2 0 239.388 2.059 20 0 BEADRP Cc1ccccc1OCCC[NH2+][C@H]1CCC[C@@H]1[NH3+] ZINC000422740799 387647644 /nfs/dbraw/zinc/64/76/44/387647644.db2.gz NFLFJMHOJBTKEL-KBPBESRZSA-N 2 0 248.370 2.233 20 0 BEADRP Cc1ccccc1C[C@@H](C)[NH2+][C@H](C)C1C[NH2+]C1 ZINC000422746492 387651200 /nfs/dbraw/zinc/65/12/00/387651200.db2.gz WQWNPQJRPCZTOK-CHWSQXEVSA-N 2 0 232.371 2.124 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]CCc1ccccc1 ZINC000422748878 387653321 /nfs/dbraw/zinc/65/33/21/387653321.db2.gz WOEOOLOKOBTHLC-HUUCEWRRSA-N 2 0 232.371 2.479 20 0 BEADRP C[NH+](C)C[C@@H]1CC[N@H+](C[C@H]2CC=CCC2)C1 ZINC000125464930 387656530 /nfs/dbraw/zinc/65/65/30/387656530.db2.gz LLAYEOXJBXUEQP-KBPBESRZSA-N 2 0 222.376 2.226 20 0 BEADRP CS[C@@H]1CCC[C@H]([NH2+][C@H](C)C[C@H](C)[NH3+])C1 ZINC000422754791 387658981 /nfs/dbraw/zinc/65/89/81/387658981.db2.gz GENZUGMIJVDXRP-WHOHXGKFSA-N 2 0 230.421 2.376 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CCSc1ccccc1 ZINC000422756383 387659990 /nfs/dbraw/zinc/65/99/90/387659990.db2.gz CHLLERLFWYRZCJ-VXGBXAGGSA-N 2 0 238.400 2.494 20 0 BEADRP C[NH2+]C1CC[NH+](CCc2ccc(C)cc2)CC1 ZINC000430937062 387663262 /nfs/dbraw/zinc/66/32/62/387663262.db2.gz YWFKWZBJVRPKTG-UHFFFAOYSA-N 2 0 232.371 2.221 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C ZINC000422760057 387664234 /nfs/dbraw/zinc/66/42/34/387664234.db2.gz LMISRIDRBMPSST-OLZOCXBDSA-N 3 0 243.439 2.070 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CCc1ccccc1F ZINC000422766366 387665155 /nfs/dbraw/zinc/66/51/55/387665155.db2.gz PXNOUENBSNTSED-QWRGUYRKSA-N 2 0 224.323 2.084 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]CCOc1ccccc1 ZINC000422764595 387666326 /nfs/dbraw/zinc/66/63/26/387666326.db2.gz VGXTZCZVNYEQLX-CABCVRRESA-N 2 0 248.370 2.315 20 0 BEADRP [NH3+][C@H]1CCCCC[C@H]1[NH2+]CCOC1CCCC1 ZINC000422763871 387666564 /nfs/dbraw/zinc/66/65/64/387666564.db2.gz NYAMARPHPSIRAJ-UONOGXRCSA-N 2 0 240.391 2.195 20 0 BEADRP CC[C@@H]([NH2+][C@@H](C)C1C[NH2+]C1)c1ccc(OC)cc1 ZINC000422767447 387667766 /nfs/dbraw/zinc/66/77/66/387667766.db2.gz RBNHVCJLHNELPC-XHDPSFHLSA-N 2 0 248.370 2.344 20 0 BEADRP C[C@@H]([NH2+]CC1(c2cccc(F)c2)CC1)C1C[NH2+]C1 ZINC000422770929 387670230 /nfs/dbraw/zinc/67/02/30/387670230.db2.gz QTFQRVNAPGOIEW-LLVKDONJSA-N 2 0 248.345 2.055 20 0 BEADRP CC[C@H](COC)[NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1 ZINC000125971802 387670966 /nfs/dbraw/zinc/67/09/66/387670966.db2.gz MIOZSOGTWIPLKV-ZIAGYGMSSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[C@@H](C)C1)C1C[NH2+]C1 ZINC000422772798 387670994 /nfs/dbraw/zinc/67/09/94/387670994.db2.gz ZOGVWVMIDFPBAH-WOPDTQHZSA-N 2 0 210.365 2.010 20 0 BEADRP COc1cccc(C[NH2+]C2CCC(C[NH3+])CC2)c1 ZINC000422775020 387672252 /nfs/dbraw/zinc/67/22/52/387672252.db2.gz ZLMFNIVGCVOOMZ-UHFFFAOYSA-N 2 0 248.370 2.302 20 0 BEADRP CC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccncc1 ZINC000422781809 387680566 /nfs/dbraw/zinc/68/05/66/387680566.db2.gz KYIHKZSRRNPNEV-IXXDHKBRSA-N 2 0 245.370 2.405 20 0 BEADRP Cc1ccc(O[C@H](C)C[NH2+][C@@H]2CCC[C@H]2[NH3+])cc1 ZINC000422781116 387681049 /nfs/dbraw/zinc/68/10/49/387681049.db2.gz DREJBZWSMXWKBY-BPLDGKMQSA-N 2 0 248.370 2.232 20 0 BEADRP Cc1cccc([C@H](C)C[NH2+][C@@H](C)C2C[NH2+]C2)c1 ZINC000422781032 387681084 /nfs/dbraw/zinc/68/10/84/387681084.db2.gz JZXBAHFTAQORDS-OLZOCXBDSA-N 2 0 232.371 2.296 20 0 BEADRP C[C@@H]([NH2+][C@H](C)C1CCCCC1)C1C[NH2+]C1 ZINC000422784763 387683653 /nfs/dbraw/zinc/68/36/53/387683653.db2.gz OLYPHYDKKSOLQP-GHMZBOCLSA-N 2 0 210.365 2.153 20 0 BEADRP COc1ccc(CCC[NH2+][C@H]2CCC[C@H]2[NH3+])cc1 ZINC000422744176 387691128 /nfs/dbraw/zinc/69/11/28/387691128.db2.gz VQBMRVHXQNUSKX-CABCVRRESA-N 2 0 248.370 2.097 20 0 BEADRP Cc1ncc([C@@H](C)[NH2+]CC2=CC[NH2+]CC2)s1 ZINC000643520333 387691415 /nfs/dbraw/zinc/69/14/15/387691415.db2.gz PBTGCUKHJDADOL-SECBINFHSA-N 2 0 237.372 2.022 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CCCOc1ccccc1 ZINC000422791264 387691910 /nfs/dbraw/zinc/69/19/10/387691910.db2.gz QBENKJURDASRPA-QWHCGFSZSA-N 2 0 236.359 2.171 20 0 BEADRP C1C[C@H]([NH2+][C@@H]2CC[C@H]3CCCC[C@@H]3C2)C[NH2+]1 ZINC000422792378 387692218 /nfs/dbraw/zinc/69/22/18/387692218.db2.gz DQEKDOYOTGQRDT-SYQHCUMBSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CCCOc1ccccc1 ZINC000422791262 387693359 /nfs/dbraw/zinc/69/33/59/387693359.db2.gz QBENKJURDASRPA-CHWSQXEVSA-N 2 0 236.359 2.171 20 0 BEADRP C1=CC[C@H](C[N@@H+]2C[C@@H]3CCC[NH2+][C@@H]3C2)CC1 ZINC000128416249 387745711 /nfs/dbraw/zinc/74/57/11/387745711.db2.gz JTRANVTUCAOJGJ-MELADBBJSA-N 2 0 220.360 2.027 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1CCCS1)[C@@H]1CCC[NH2+]1 ZINC000422871569 387749808 /nfs/dbraw/zinc/74/98/08/387749808.db2.gz DCYXRKPXEYVVBR-SRVKXCTJSA-N 2 0 228.405 2.002 20 0 BEADRP CC(C)CC(CC(C)C)[NH2+]C[C@H](C)[NH3+] ZINC000643526328 387750330 /nfs/dbraw/zinc/75/03/30/387750330.db2.gz ZNSJPLZRROZCQH-NSHDSACASA-N 2 0 200.370 2.384 20 0 BEADRP C[C@@H]([NH2+]C[C@]1(C)CCCS1)[C@@H]1CCCC[NH2+]1 ZINC000422870738 387750741 /nfs/dbraw/zinc/75/07/41/387750741.db2.gz CBVUJVZQMCDJAY-AGIUHOORSA-N 2 0 242.432 2.392 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]C[C@]1(C)CCCS1 ZINC000422873737 387751394 /nfs/dbraw/zinc/75/13/94/387751394.db2.gz LYNRNHDQBWKHIV-AGIUHOORSA-N 2 0 242.432 2.250 20 0 BEADRP COc1cc(C)ccc1C[NH2+][C@H]1CCC[C@@H]1C[NH3+] ZINC000422872256 387753547 /nfs/dbraw/zinc/75/35/47/387753547.db2.gz GINHAFOZPLQMLI-OCCSQVGLSA-N 2 0 248.370 2.221 20 0 BEADRP COc1cc(C)ccc1C[NH2+][C@@H](C)C[C@@H](C)[NH3+] ZINC000422872780 387753596 /nfs/dbraw/zinc/75/35/96/387753596.db2.gz IPRFMBCYLIISRA-NEPJUHHUSA-N 2 0 236.359 2.219 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2CCC[C@@H]2C1)C1C[NH2+]C1 ZINC000422796284 387699980 /nfs/dbraw/zinc/69/99/80/387699980.db2.gz YCHCPNNDFGWCME-CIQGVGRVSA-N 2 0 222.376 2.153 20 0 BEADRP Cc1ccc(C[NH2+][C@@H](C)C[C@@H](C)[NH3+])cc1F ZINC000422800192 387700251 /nfs/dbraw/zinc/70/02/51/387700251.db2.gz ZNMKABDWVCFMIT-MNOVXSKESA-N 2 0 224.323 2.350 20 0 BEADRP CCO[C@@H]1CCC[C@H]1[NH2+]CCC[NH+](CC)CC ZINC000452024037 387704203 /nfs/dbraw/zinc/70/42/03/387704203.db2.gz YSKBZLZIQYLQCH-ZIAGYGMSSA-N 2 0 242.407 2.266 20 0 BEADRP CCO[C@H](CC[NH2+][C@H](C)[C@H]1CCC[NH2+]1)C(C)C ZINC000422806077 387705341 /nfs/dbraw/zinc/70/53/41/387705341.db2.gz HTJWMEJMNJUYRE-MGPQQGTHSA-N 2 0 242.407 2.168 20 0 BEADRP CO[C@H](C[NH2+][C@H]1CC[NH2+]CC[C@H]1C)C(C)(C)C ZINC000422808613 387708308 /nfs/dbraw/zinc/70/83/08/387708308.db2.gz LGJMLRIAUNQJPB-FRRDWIJNSA-N 2 0 242.407 2.025 20 0 BEADRP C[C@@H]([NH2+]CCCC1CCCC1)C1C[NH2+]C1 ZINC000422809238 387709417 /nfs/dbraw/zinc/70/94/17/387709417.db2.gz RMYMXOHIKKEUQK-LLVKDONJSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@]12C[N@H+](CCn3ccnc3)C[C@@H]1[C@@H]1CC[C@H]2C1 ZINC000452042312 387711786 /nfs/dbraw/zinc/71/17/86/387711786.db2.gz FGIWVSBQFIZJAH-LXTVHRRPSA-N 2 0 245.370 2.251 20 0 BEADRP CCO[C@H](CC[NH2+][C@@H]1CCC[C@@H]1C[NH3+])C(C)C ZINC000422811900 387711943 /nfs/dbraw/zinc/71/19/43/387711943.db2.gz PUSGYKYYWDHIEF-MGPQQGTHSA-N 2 0 242.407 2.155 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+][C@H]1CCCSC1 ZINC000422814724 387714511 /nfs/dbraw/zinc/71/45/11/387714511.db2.gz ACIPDDUGKRKPME-QJPTWQEYSA-N 2 0 228.405 2.132 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CC1(CCO)CCCC1 ZINC000422815614 387715263 /nfs/dbraw/zinc/71/52/63/387715263.db2.gz YACNYYJFVCSDEX-CYBMUJFWSA-N 2 0 242.407 2.036 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@@]1(C)CCCC[C@H]1O ZINC000422819462 387716355 /nfs/dbraw/zinc/71/63/55/387716355.db2.gz IIMPEKZBOGNPFZ-MGPQQGTHSA-N 2 0 242.407 2.035 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCC(C)(C)C[C@H]1C)C1C[NH2+]C1 ZINC000422819920 387717918 /nfs/dbraw/zinc/71/79/18/387717918.db2.gz OJULRAXHLHMGNQ-WZRBSPASSA-N 2 0 224.392 2.399 20 0 BEADRP C1CC2(C1)CC[C@@H]2[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000643522287 387719042 /nfs/dbraw/zinc/71/90/42/387719042.db2.gz KVCNRJHSZNLIGS-NEPJUHHUSA-N 2 0 208.349 2.051 20 0 BEADRP CCS[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000422830903 387723996 /nfs/dbraw/zinc/72/39/96/387723996.db2.gz DHLYJHJWIRAQOC-CYZMBNFOSA-N 2 0 242.432 2.248 20 0 BEADRP Cc1ccc([C@H](C)[NH2+][C@@H]2CCC[NH2+]CC2)c(C)n1 ZINC000643522989 387724051 /nfs/dbraw/zinc/72/40/51/387724051.db2.gz VJOXCSDAAAAHBY-UONOGXRCSA-N 2 0 247.386 2.491 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]C[C@H]2CC[C@H](C)O2)CC1 ZINC000127735440 387725293 /nfs/dbraw/zinc/72/52/93/387725293.db2.gz XEYDMXWZGFMNJA-GXTWGEPZSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CCc1cc(F)cc(F)c1 ZINC000422842230 387730684 /nfs/dbraw/zinc/73/06/84/387730684.db2.gz FLLRRXQAGPVGRR-NXEZZACHSA-N 2 0 242.313 2.223 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CCc1cc(F)cc(F)c1 ZINC000422842231 387731909 /nfs/dbraw/zinc/73/19/09/387731909.db2.gz FLLRRXQAGPVGRR-UWVGGRQHSA-N 2 0 242.313 2.223 20 0 BEADRP CO[C@@H]1C[C@H]([NH2+][C@@H]2CCCCC[C@H]2[NH3+])C1(C)C ZINC000422856060 387741213 /nfs/dbraw/zinc/74/12/13/387741213.db2.gz WMSLSBMXFVJWDQ-FVCCEPFGSA-N 2 0 240.391 2.050 20 0 BEADRP COCCC1(C[NH2+][C@H]2CCC[C@H]2[NH3+])CCCC1 ZINC000422892381 387762226 /nfs/dbraw/zinc/76/22/26/387762226.db2.gz YELMHAUQZRADIT-OLZOCXBDSA-N 2 0 240.391 2.053 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]C[C@H]1CCOc2ccccc21 ZINC000422889576 387764439 /nfs/dbraw/zinc/76/44/39/387764439.db2.gz PWJVVRKHZBJQGA-MRVWCRGKSA-N 2 0 246.354 2.022 20 0 BEADRP CC[C@@H]([NH2+]CC1CCCC1)[C@@H]1CCC[NH2+]1 ZINC000422894769 387765471 /nfs/dbraw/zinc/76/54/71/387765471.db2.gz DFUKUYHHTJPJSD-OLZOCXBDSA-N 2 0 210.365 2.297 20 0 BEADRP Cc1ccc(C[NH2+][C@H](C)C[C@@H](C)[NH3+])s1 ZINC000422896095 387766380 /nfs/dbraw/zinc/76/63/80/387766380.db2.gz XJNLBLWWXBGMJV-RKDXNWHRSA-N 2 0 212.362 2.272 20 0 BEADRP CCCOc1ccc(C[NH2+][C@@H](C)C2C[NH2+]C2)cc1 ZINC000422904086 387767431 /nfs/dbraw/zinc/76/74/31/387767431.db2.gz WWWCVADSULTVNK-LBPRGKRZSA-N 2 0 248.370 2.173 20 0 BEADRP COc1ccc([C@H]2C[C@@H]2[C@@H](C)[NH2+]C[C@H](C)[NH3+])cc1 ZINC000643527743 387767720 /nfs/dbraw/zinc/76/77/20/387767720.db2.gz RSAXOVKMPXNXKS-RBDSIQFVSA-N 2 0 248.370 2.124 20 0 BEADRP CSc1ccccc1C[C@@H](C)[NH2+]C[C@H](C)[NH3+] ZINC000643527625 387768199 /nfs/dbraw/zinc/76/81/99/387768199.db2.gz PIDXUNXXONOWOX-WDEREUQCSA-N 2 0 238.400 2.276 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]C[C@H]1CCc2ccccc21 ZINC000422909033 387769447 /nfs/dbraw/zinc/76/94/47/387769447.db2.gz NKBGUJAIULGZMX-BPLDGKMQSA-N 2 0 230.355 2.186 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]C[C@@H]1CCc2ccccc21 ZINC000422912306 387770832 /nfs/dbraw/zinc/77/08/32/387770832.db2.gz VXTQRKMODQERPE-OBJOEFQTSA-N 2 0 232.371 2.432 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CCCc1cccc(F)c1 ZINC000422912917 387770889 /nfs/dbraw/zinc/77/08/89/387770889.db2.gz XJEXNRZPAFNZBK-NWDGAFQWSA-N 2 0 238.350 2.474 20 0 BEADRP C[C@@H]([NH3+])C[NH2+][C@@H](C)CCc1ccc(F)cc1 ZINC000643529030 387771860 /nfs/dbraw/zinc/77/18/60/387771860.db2.gz SZELAAFIKWTLKJ-MNOVXSKESA-N 2 0 224.323 2.084 20 0 BEADRP Cc1ccc(C[C@H]([NH2+]C[C@H](C)[NH3+])C2CC2)cc1 ZINC000643529064 387772092 /nfs/dbraw/zinc/77/20/92/387772092.db2.gz UFPJBUFHJLDTCJ-WFASDCNBSA-N 2 0 232.371 2.253 20 0 BEADRP C[C@H]([NH2+]CC1(C)CC[NH+](C)CC1)[C@@H]1CC12CC2 ZINC000527889014 387772498 /nfs/dbraw/zinc/77/24/98/387772498.db2.gz WQJQZHCYROVFAB-STQMWFEESA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H]([NH3+])C[NH2+][C@@H]1CCC[C@H]1c1ccccc1 ZINC000643529021 387772650 /nfs/dbraw/zinc/77/26/50/387772650.db2.gz SUURVMGGPLSQCF-FPMFFAJLSA-N 2 0 218.344 2.260 20 0 BEADRP CC(C)[C@H]1CC[C@@H]([NH2+]C[C@H](C)[NH3+])C[C@@H]1C ZINC000643529174 387772724 /nfs/dbraw/zinc/77/27/24/387772724.db2.gz WMCWQEBZJUULCR-WUHRBBMRSA-N 2 0 212.381 2.384 20 0 BEADRP C[C@H]([NH2+]CCc1cc2ccccc2o1)C1C[NH2+]C1 ZINC000422917010 387774406 /nfs/dbraw/zinc/77/44/06/387774406.db2.gz FFIGLQUXZASTLQ-NSHDSACASA-N 2 0 244.338 2.173 20 0 BEADRP COc1ccc([C@H](C)[C@@H](C)[NH2+]C[C@H](C)[NH3+])cc1 ZINC000643529432 387776638 /nfs/dbraw/zinc/77/66/38/387776638.db2.gz ZRUFPEVGTFDJDB-QJPTWQEYSA-N 2 0 236.359 2.124 20 0 BEADRP C[C@H]([NH3+])C[NH2+][C@@H](C)Cc1coc2ccccc12 ZINC000643529895 387777009 /nfs/dbraw/zinc/77/70/09/387777009.db2.gz UNBWQVUENFEBQN-QWRGUYRKSA-N 2 0 232.327 2.301 20 0 BEADRP C[C@H]([NH3+])[C@H](Cc1ccccc1)[NH2+]CC1(C)CC1 ZINC000422922148 387777783 /nfs/dbraw/zinc/77/77/83/387777783.db2.gz SCHLNKVVWGXRFM-JSGCOSHPSA-N 2 0 232.371 2.335 20 0 BEADRP CCCC1(C[NH2+][C@@H]2CCC[C@@H]2[NH3+])CCC1 ZINC000422927339 387779036 /nfs/dbraw/zinc/77/90/36/387779036.db2.gz GDYOTBJQVOWYHZ-NWDGAFQWSA-N 2 0 210.365 2.426 20 0 BEADRP CCCC1(C[NH2+][C@H]2CCC[C@H]2[NH3+])CCC1 ZINC000422927338 387779650 /nfs/dbraw/zinc/77/96/50/387779650.db2.gz GDYOTBJQVOWYHZ-NEPJUHHUSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H]1C[C@@H]1Cc1ccccc1 ZINC000422926662 387780000 /nfs/dbraw/zinc/78/00/00/387780000.db2.gz XGPPJCQSYMDSDG-NZBPQXDJSA-N 2 0 232.371 2.333 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[C@@H](C)O[C@@H](C)C1)[C@@H]1CCCC[NH2+]1 ZINC000643477782 387782219 /nfs/dbraw/zinc/78/22/19/387782219.db2.gz SPPVTESGEFCQHW-ITGHMWBKSA-N 2 0 240.391 2.063 20 0 BEADRP CCC1(CC)[C@H]([NH2+][C@@H]2CCC[C@H]2[NH3+])C[C@H]1OC ZINC000422937732 387783252 /nfs/dbraw/zinc/78/32/52/387783252.db2.gz KCKWSUJGTPKFFN-FDYHWXHSSA-N 2 0 240.391 2.050 20 0 BEADRP CC(C)CC(CC(C)C)[NH2+][C@@H]1CC[NH2+]C1 ZINC000422936298 387783384 /nfs/dbraw/zinc/78/33/84/387783384.db2.gz BGRCRBCNPZYBTK-GFCCVEGCSA-N 2 0 212.381 2.399 20 0 BEADRP CCOc1ccc(C[NH2+][C@H](C)C[C@H](C)[NH3+])cc1 ZINC000422901484 387787038 /nfs/dbraw/zinc/78/70/38/387787038.db2.gz LAPXVQVHBZCESG-NWDGAFQWSA-N 2 0 236.359 2.301 20 0 BEADRP CCOc1ccc(C[NH2+][C@H](C)C[C@@H](C)[NH3+])cc1 ZINC000422901486 387787412 /nfs/dbraw/zinc/78/74/12/387787412.db2.gz LAPXVQVHBZCESG-VXGBXAGGSA-N 2 0 236.359 2.301 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]C/C=C/c1ccccc1 ZINC000422980456 387791135 /nfs/dbraw/zinc/79/11/35/387791135.db2.gz PSGKUIVSOSAOPB-YSDIBMRGSA-N 2 0 218.344 2.415 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]C/C=C\c1ccccc1 ZINC000422980455 387791212 /nfs/dbraw/zinc/79/12/12/387791212.db2.gz PSGKUIVSOSAOPB-QDIXBRCLSA-N 2 0 218.344 2.415 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]C/C=C\c1ccccc1 ZINC000422980454 387791557 /nfs/dbraw/zinc/79/15/57/387791557.db2.gz PSGKUIVSOSAOPB-LFCSJDMJSA-N 2 0 218.344 2.415 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]CC1Cc2ccccc2C1 ZINC000422983627 387794098 /nfs/dbraw/zinc/79/40/98/387794098.db2.gz UJJXSTRZRLZHOU-HOTGVXAUSA-N 2 0 244.382 2.118 20 0 BEADRP CSc1cc(C[NH2+][C@@H](C)C[C@@H](C)[NH3+])ccn1 ZINC000422984673 387795605 /nfs/dbraw/zinc/79/56/05/387795605.db2.gz BFPMNRZYCDEPCN-ZJUUUORDSA-N 2 0 239.388 2.019 20 0 BEADRP C[C@@H]([NH2+]CC1Cc2ccccc2C1)[C@H]1CCC[NH2+]1 ZINC000422984762 387796155 /nfs/dbraw/zinc/79/61/55/387796155.db2.gz ZCVQFDBSNTYQHV-MLGOLLRUSA-N 2 0 244.382 2.132 20 0 BEADRP CSc1cc(C[NH2+][C@@H](C)C[C@H](C)[NH3+])ccn1 ZINC000422984669 387796736 /nfs/dbraw/zinc/79/67/36/387796736.db2.gz BFPMNRZYCDEPCN-UWVGGRQHSA-N 2 0 239.388 2.019 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000422965069 387813041 /nfs/dbraw/zinc/81/30/41/387813041.db2.gz NMGZTJKERPNXLN-TUAOUCFPSA-N 2 0 224.348 2.316 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]CC1(Cc2ccccc2)CC1 ZINC000422991278 387800043 /nfs/dbraw/zinc/80/00/43/387800043.db2.gz ASQGUNJLCSAEBL-CABCVRRESA-N 2 0 244.382 2.479 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+][C@H]1CCCC(F)(F)C1 ZINC000422995788 387803143 /nfs/dbraw/zinc/80/31/43/387803143.db2.gz ZEUSMBDFXHKKBQ-DCAQKATOSA-N 2 0 232.318 2.281 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+]CCCc1ccccn1 ZINC000422994483 387803601 /nfs/dbraw/zinc/80/36/01/387803601.db2.gz HVWWTTNLNQOXOJ-HIFRSBDPSA-N 2 0 247.386 2.121 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]CCCc1ccccn1 ZINC000422998357 387805705 /nfs/dbraw/zinc/80/57/05/387805705.db2.gz PZQWYDAJXYISOD-HUUCEWRRSA-N 2 0 247.386 2.264 20 0 BEADRP Cc1ccc2c(c1C)OC[C@@H]2[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000422958082 387809261 /nfs/dbraw/zinc/80/92/61/387809261.db2.gz OMXXVVQNTPRNMA-MJVIPROJSA-N 2 0 248.370 2.452 20 0 BEADRP CC1(C)C[C@@H]1C[NH2+][C@@H]1CCCCC[C@H]1[NH3+] ZINC000422956271 387810007 /nfs/dbraw/zinc/81/00/07/387810007.db2.gz OZFNUNBRVGNVCS-IJLUTSLNSA-N 2 0 210.365 2.282 20 0 BEADRP COc1cccc(C2([NH2+][C@H](C)CCC[NH3+])CC2)c1 ZINC000422959443 387811246 /nfs/dbraw/zinc/81/12/46/387811246.db2.gz RZUHJMWXILVJQZ-GFCCVEGCSA-N 2 0 248.370 2.401 20 0 BEADRP C[C@@H]([NH2+]CCC1CC[NH+](C)CC1)[C@@H]1CC12CC2 ZINC000527857897 387757149 /nfs/dbraw/zinc/75/71/49/387757149.db2.gz FIFWLDHAAQFNOF-OCCSQVGLSA-N 2 0 236.403 2.497 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H]1CC=CCC1)[C@@H]1CCC[NH2+]1 ZINC000422974821 387823243 /nfs/dbraw/zinc/82/32/43/387823243.db2.gz RTZNDSAXOYMLDI-MCIONIFRSA-N 2 0 222.376 2.463 20 0 BEADRP CCC(CC)(CO)C[NH2+][C@@H]1CCCCC[C@H]1[NH3+] ZINC000423003467 387826606 /nfs/dbraw/zinc/82/66/06/387826606.db2.gz MGCOALGUNMECBC-CHWSQXEVSA-N 2 0 242.407 2.035 20 0 BEADRP CC(C)CSCC[NH2+][C@H]1CC[NH2+]CC[C@H]1C ZINC000423008444 387830985 /nfs/dbraw/zinc/83/09/85/387830985.db2.gz AHKPTVBBXWRHSU-OLZOCXBDSA-N 2 0 244.448 2.353 20 0 BEADRP C[C@@H]([NH2+]CC12CCC(CC1)C2)[C@H]1CCC[NH2+]1 ZINC000423008624 387831115 /nfs/dbraw/zinc/83/11/15/387831115.db2.gz ARZZCRUHCGBIBW-NELGMTEASA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H](CCO)C1CCCCC1 ZINC000423011068 387833261 /nfs/dbraw/zinc/83/32/61/387833261.db2.gz YUYUXZZSGMNGDL-TZMCWYRMSA-N 2 0 242.407 2.035 20 0 BEADRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]CC12CCC(CC1)C2 ZINC000423011493 387833417 /nfs/dbraw/zinc/83/34/17/387833417.db2.gz IXEBCGRZMQVUEW-CEUNDQEZSA-N 2 0 222.376 2.284 20 0 BEADRP CC(C)CSCCC[NH2+][C@@H]1CCC[C@@H]1C[NH3+] ZINC000423012188 387835740 /nfs/dbraw/zinc/83/57/40/387835740.db2.gz KGAXVWBRZURPLX-CHWSQXEVSA-N 2 0 244.448 2.483 20 0 BEADRP CC(C)CSCCC[NH2+][C@H]1CCC[C@@H]1[NH3+] ZINC000423013902 387836629 /nfs/dbraw/zinc/83/66/29/387836629.db2.gz NTKMIJJOXLLKKG-RYUDHWBXSA-N 2 0 230.421 2.235 20 0 BEADRP CCc1cnccc1[C@@H](C)[NH2+][C@@H](C)CCC[NH3+] ZINC000423012626 387836744 /nfs/dbraw/zinc/83/67/44/387836744.db2.gz DHNYHSQNXJFDGG-NWDGAFQWSA-N 2 0 235.375 2.422 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]C1CCC(F)(F)CC1 ZINC000423015258 387839303 /nfs/dbraw/zinc/83/93/03/387839303.db2.gz QOQQNVUDZJXWSN-IUCAKERBSA-N 2 0 220.307 2.280 20 0 BEADRP C[C@@H]1C[C@H](C[NH3+])C[N@@H+]1[C@H]1CCc2ccc(F)cc21 ZINC000442779838 387839980 /nfs/dbraw/zinc/83/99/80/387839980.db2.gz JQVCJFMBVCIOKL-HFAKWTLXSA-N 2 0 248.345 2.482 20 0 BEADRP CC[C@H]([NH2+][C@H](C)CCCC[NH3+])[C@H]1CCCO1 ZINC000423017569 387840182 /nfs/dbraw/zinc/84/01/82/387840182.db2.gz WQWNLAIHLVEREJ-FRRDWIJNSA-N 2 0 228.380 2.051 20 0 BEADRP CO[C@@H]1CCC[C@@H]1C[NH2+][C@H]1CCCCC[C@@H]1[NH3+] ZINC000423019144 387840428 /nfs/dbraw/zinc/84/04/28/387840428.db2.gz UEQAMIZLDUMZSW-ZOBORPQBSA-N 2 0 240.391 2.051 20 0 BEADRP CO[C@@H]1CCC[C@@H]1C[NH2+][C@@H]1CCCCC[C@H]1[NH3+] ZINC000423019141 387840644 /nfs/dbraw/zinc/84/06/44/387840644.db2.gz UEQAMIZLDUMZSW-AAVRWANBSA-N 2 0 240.391 2.051 20 0 BEADRP Cc1cc(C[NH+](C)C)cc(N[C@@H]2CCC[C@@H]2[NH3+])c1 ZINC000423028484 387847505 /nfs/dbraw/zinc/84/75/05/387847505.db2.gz QYJREODTLLXBNJ-LSDHHAIUSA-N 2 0 247.386 2.348 20 0 BEADRP CC[C@H]([NH2+][C@H]1CC12CC[NH2+]CC2)C(C)C ZINC000643533808 387849921 /nfs/dbraw/zinc/84/99/21/387849921.db2.gz FEOZRFAEYWSZEK-RYUDHWBXSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CCC[C@@H]1CCCCO1 ZINC000423035472 387850426 /nfs/dbraw/zinc/85/04/26/387850426.db2.gz JOCURWWEOUFBHA-AVGNSLFASA-N 2 0 228.380 2.051 20 0 BEADRP CC[C@H](CC(F)(F)F)[NH2+][C@@H](C)CCC[NH3+] ZINC000423035403 387850872 /nfs/dbraw/zinc/85/08/72/387850872.db2.gz JHZWKDZEGOXULS-DTWKUNHWSA-N 2 0 226.286 2.434 20 0 BEADRP CS[C@H](C[NH2+][C@@H]1CCC[C@H]1C[NH3+])C(C)(C)C ZINC000423038980 387853187 /nfs/dbraw/zinc/85/31/87/387853187.db2.gz ZKLSFPRWHKQNJU-QJPTWQEYSA-N 2 0 244.448 2.481 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CCCCO1)[C@H]1CCCC[NH2+]1 ZINC000423039215 387853202 /nfs/dbraw/zinc/85/32/02/387853202.db2.gz DZGDQUWOSNSQHS-HZSPNIEDSA-N 2 0 240.391 2.066 20 0 BEADRP COCC[C@H]([NH2+][C@@H](C)CCC[NH3+])c1ccco1 ZINC000423041778 387856175 /nfs/dbraw/zinc/85/61/75/387856175.db2.gz JTAKCNVTJKNPEH-RYUDHWBXSA-N 2 0 240.347 2.074 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[NH2+]CC[C@H]1C)C(F)(F)F ZINC000423052052 387860049 /nfs/dbraw/zinc/86/00/49/387860049.db2.gz OYUHSVCZIIFHOA-OPRDCNLKSA-N 2 0 238.297 2.163 20 0 BEADRP C[C@@H](CC(F)(F)F)[NH2+]C1CCC(C[NH3+])CC1 ZINC000423050507 387860085 /nfs/dbraw/zinc/86/00/85/387860085.db2.gz LYFCPYFGJFKTQV-IDKOKCKLSA-N 2 0 238.297 2.434 20 0 BEADRP C[C@H](CC(F)(F)F)[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000423052974 387861087 /nfs/dbraw/zinc/86/10/87/387861087.db2.gz RQFZUBHUBXPZGM-BIIVOSGPSA-N 2 0 212.259 2.043 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)[C@H]1C[C@@H]1C ZINC000643535362 387862384 /nfs/dbraw/zinc/86/23/84/387862384.db2.gz CGRGGSDWSCLXFU-ZDEQEGDKSA-N 2 0 222.376 2.153 20 0 BEADRP CSCCCCC[NH2+][C@H](C)C[C@H](C)[NH3+] ZINC000423056066 387863086 /nfs/dbraw/zinc/86/30/86/387863086.db2.gz WWYUWMLNWQNJQT-WDEREUQCSA-N 2 0 218.410 2.235 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000643535592 387864039 /nfs/dbraw/zinc/86/40/39/387864039.db2.gz NOXWAVTVWGQRSE-JSGCOSHPSA-N 2 0 245.370 2.183 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)C1CCC1 ZINC000643535874 387865304 /nfs/dbraw/zinc/86/53/04/387865304.db2.gz KHVLXEPPCXGCNB-QWHCGFSZSA-N 2 0 222.376 2.297 20 0 BEADRP C/C=C\C[C@H](CO)[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000423057709 387865641 /nfs/dbraw/zinc/86/56/41/387865641.db2.gz ZSFJTIPKNCSAOB-QGLVTVHPSA-N 2 0 246.354 2.048 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1ccc(F)cn1 ZINC000643535849 387865662 /nfs/dbraw/zinc/86/56/62/387865662.db2.gz PKTVXTJLMYOJDS-ZWNOBZJWSA-N 2 0 249.333 2.013 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC[C@@H](C)C1)[C@H]1CCCC[NH2+]1 ZINC000423061215 387865949 /nfs/dbraw/zinc/86/59/49/387865949.db2.gz KFOXVTHZSOXRRX-FDYHWXHSSA-N 2 0 210.365 2.295 20 0 BEADRP C1CC1[C@H]([NH2+][C@H]1CC12CC[NH2+]CC2)C1CCC1 ZINC000643536042 387866178 /nfs/dbraw/zinc/86/61/78/387866178.db2.gz MJMCTLJZJYVENV-UONOGXRCSA-N 2 0 234.387 2.297 20 0 BEADRP C1[C@@H]([NH2+][C@H]2CCCC23CCC3)C12CC[NH2+]CC2 ZINC000643536677 387868699 /nfs/dbraw/zinc/86/86/99/387868699.db2.gz UVDZHYDGBXVWEJ-QWHCGFSZSA-N 2 0 234.387 2.441 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1ccncc1 ZINC000643536623 387869366 /nfs/dbraw/zinc/86/93/66/387869366.db2.gz SWIKIIWLEGGYDI-UONOGXRCSA-N 2 0 245.370 2.264 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@H]2CC[NH2+]CC[C@H]2C)C1 ZINC000423066764 387869797 /nfs/dbraw/zinc/86/97/97/387869797.db2.gz XTVSSYVIXWTZNR-NDBYEHHHSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)=CCC[NH2+][C@H]1CC[NH2+]CC[C@H]1C ZINC000423066913 387870168 /nfs/dbraw/zinc/87/01/68/387870168.db2.gz FTSLAXKYVZFREE-OLZOCXBDSA-N 2 0 210.365 2.320 20 0 BEADRP C[C@H](CCCC(F)(F)F)[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000423074912 387874796 /nfs/dbraw/zinc/87/47/96/387874796.db2.gz NDUVVVJKIMZCRQ-BDAKNGLRSA-N 2 0 238.297 2.305 20 0 BEADRP CC1(C[NH2+]CC2CC[NH+](C3CC3)CC2)CC1 ZINC000309512502 387815785 /nfs/dbraw/zinc/81/57/85/387815785.db2.gz XTKREWWWUAMHMC-UHFFFAOYSA-N 2 0 222.376 2.251 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+]CCc1ccccc1O ZINC000422966942 387816827 /nfs/dbraw/zinc/81/68/27/387816827.db2.gz AXDVNSXROLPEIZ-ZIAGYGMSSA-N 2 0 248.370 2.042 20 0 BEADRP [NH3+]CC1CCC([NH2+]CCc2ccccc2O)CC1 ZINC000422970457 387818882 /nfs/dbraw/zinc/81/88/82/387818882.db2.gz GFNXKJFSRAAWQS-UHFFFAOYSA-N 2 0 248.370 2.042 20 0 BEADRP C[C@H]([NH3+])CN(C1CC1)[C@@H]1CCc2ccccc21 ZINC000442666995 387818884 /nfs/dbraw/zinc/81/88/84/387818884.db2.gz XNYVQHVIYWGTSY-XHDPSFHLSA-N 2 0 230.355 2.486 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+][C@H]1C[C@H](c2ccccc2)C1 ZINC000422970231 387818932 /nfs/dbraw/zinc/81/89/32/387818932.db2.gz VZMNMPHSWGCCRV-TUVASFSCSA-N 2 0 230.355 2.402 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+][C@H]1C[C@H](c2ccccc2)C1 ZINC000422970232 387819209 /nfs/dbraw/zinc/81/92/09/387819209.db2.gz VZMNMPHSWGCCRV-ZQDZILKHSA-N 2 0 230.355 2.402 20 0 BEADRP Cc1cnccc1CC[N@@H+](C)C[C@@H]1CCC[C@@H]1O ZINC000564081159 387819273 /nfs/dbraw/zinc/81/92/73/387819273.db2.gz ZDVPRGORBQBCTH-GJZGRUSLSA-N 2 0 248.370 2.025 20 0 BEADRP C[C@H]([NH2+]CCC1(F)CCC1)[C@H]1CCCC[NH2+]1 ZINC000423105845 387891179 /nfs/dbraw/zinc/89/11/79/387891179.db2.gz IXOZLRFUJLTKPD-NWDGAFQWSA-N 2 0 228.355 2.389 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CCc1cccc2[nH]ccc21 ZINC000423105161 387892043 /nfs/dbraw/zinc/89/20/43/387892043.db2.gz CAKKGNDGJDSLCI-NEPJUHHUSA-N 2 0 245.370 2.426 20 0 BEADRP Cc1cc2cc(C[NH2+][C@H](C)C3C[NH2+]C3)ccc2[nH]1 ZINC000423109601 387894220 /nfs/dbraw/zinc/89/42/20/387894220.db2.gz NWYKQDOQMNBDRE-LLVKDONJSA-N 2 0 243.354 2.174 20 0 BEADRP C[C@@H]([NH2+]C1CC(C)(c2ccccc2)C1)C1C[NH2+]C1 ZINC000423114816 387896067 /nfs/dbraw/zinc/89/60/67/387896067.db2.gz ZWHYOOPSFFHRNM-UWTIGNOOSA-N 2 0 244.382 2.304 20 0 BEADRP CC(C)SCC[NH2+]C1CCC(C[NH3+])CC1 ZINC000423115461 387897032 /nfs/dbraw/zinc/89/70/32/387897032.db2.gz XYUSUQULZNGZSR-UHFFFAOYSA-N 2 0 230.421 2.235 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H]1CCCC12CCOCC2 ZINC000423116693 387897660 /nfs/dbraw/zinc/89/76/60/387897660.db2.gz RCTUAXKNLMWYJE-CHWSQXEVSA-N 2 0 240.391 2.053 20 0 BEADRP COCC[C@H]([NH2+][C@H](C)C[C@H](C)[NH3+])C(C)(C)C ZINC000423116776 387897702 /nfs/dbraw/zinc/89/77/02/387897702.db2.gz RLSNJDIKOVNTKM-TUAOUCFPSA-N 2 0 230.396 2.153 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC12CCCC2)[C@H]1CCC[NH2+]1 ZINC000423075882 387876011 /nfs/dbraw/zinc/87/60/11/387876011.db2.gz PORCEYPISZYIFH-XQQFMLRXSA-N 2 0 222.376 2.439 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@H]1CCC12CCCC2 ZINC000423077823 387876017 /nfs/dbraw/zinc/87/60/17/387876017.db2.gz URYXGSABJVWXEI-TUAOUCFPSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCC12CCCC2)[C@H]1CCC[NH2+]1 ZINC000423075878 387876073 /nfs/dbraw/zinc/87/60/73/387876073.db2.gz PORCEYPISZYIFH-JHJVBQTASA-N 2 0 222.376 2.439 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC12CCCC2)[C@@H]1CCC[NH2+]1 ZINC000423075879 387876748 /nfs/dbraw/zinc/87/67/48/387876748.db2.gz PORCEYPISZYIFH-RWMBFGLXSA-N 2 0 222.376 2.439 20 0 BEADRP CCSCCC[NH2+][C@@H]1CC[NH2+]CC[C@H]1C ZINC000423117734 387898403 /nfs/dbraw/zinc/89/84/03/387898403.db2.gz WXIVKOAAPKANLH-VXGBXAGGSA-N 2 0 230.421 2.107 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@H]1C1CC1)[C@@H]1CCC[NH2+]C1 ZINC000423092751 387882993 /nfs/dbraw/zinc/88/29/93/387882993.db2.gz DHAXNBNCIJTJHK-AHLTXXRQSA-N 2 0 222.376 2.153 20 0 BEADRP CSC1(C[NH2+]C2CCC(C[NH3+])CC2)CCC1 ZINC000423091975 387883494 /nfs/dbraw/zinc/88/34/94/387883494.db2.gz ZXKZQXPARWGOLV-UHFFFAOYSA-N 2 0 242.432 2.379 20 0 BEADRP FC1(F)CC[C@@H](C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000423096410 387884579 /nfs/dbraw/zinc/88/45/79/387884579.db2.gz OUNKAVMQADGMRH-YIBTVLSRSA-N 2 0 244.329 2.294 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC(F)(F)C1)[C@H]1CCC[NH2+]1 ZINC000423095211 387884644 /nfs/dbraw/zinc/88/46/44/387884644.db2.gz LQGHJTMTNXFDSL-GARJFASQSA-N 2 0 232.318 2.152 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC(F)(F)C1)[C@H]1CCC[NH2+]1 ZINC000423095213 387885106 /nfs/dbraw/zinc/88/51/06/387885106.db2.gz LQGHJTMTNXFDSL-HBNTYKKESA-N 2 0 232.318 2.152 20 0 BEADRP CC1(C)C(C[NH2+][C@H]2CCC[C@H]2[NH3+])C1(C)C ZINC000423096407 387886100 /nfs/dbraw/zinc/88/61/00/387886100.db2.gz OUASHTSBMZFNSS-ZJUUUORDSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CCc1cccc2[nH]ccc21 ZINC000423116130 387898677 /nfs/dbraw/zinc/89/86/77/387898677.db2.gz OWTIVDZURJOUTM-GFCCVEGCSA-N 2 0 245.370 2.427 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[C@@H](C)[C@H]1C)C1C[NH2+]C1 ZINC000423101641 387888234 /nfs/dbraw/zinc/88/82/34/387888234.db2.gz WEFRXSNJZQOQKI-FVCCEPFGSA-N 2 0 224.392 2.256 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CC1(C(F)(F)F)CC1 ZINC000423102279 387889305 /nfs/dbraw/zinc/88/93/05/387889305.db2.gz DVDKHOVYTBPBRO-YUMQZZPRSA-N 2 0 224.270 2.044 20 0 BEADRP C[C@H]([NH3+])[C@H](Cc1ccccc1)[NH2+]CCCCF ZINC000423141734 387919164 /nfs/dbraw/zinc/91/91/64/387919164.db2.gz RNULSZPPQLVYBM-JSGCOSHPSA-N 2 0 238.350 2.284 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@@H]1CCCC12CCOCC2 ZINC000423118021 387900265 /nfs/dbraw/zinc/90/02/65/387900265.db2.gz YHOFMQQFMPKYHH-YNEHKIRRSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@H]1CCCC12CCOCC2 ZINC000423118020 387900377 /nfs/dbraw/zinc/90/03/77/387900377.db2.gz YHOFMQQFMPKYHH-XQQFMLRXSA-N 2 0 240.391 2.051 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]C[C@H]1CCCSC1 ZINC000423119356 387900476 /nfs/dbraw/zinc/90/04/76/387900476.db2.gz DQTDHPXXMCUYIQ-UPJWGTAASA-N 2 0 242.432 2.379 20 0 BEADRP C[C@@H]([NH2+]C1CC(C(F)(F)F)C1)[C@H]1CCC[NH2+]1 ZINC000423121043 387901186 /nfs/dbraw/zinc/90/11/86/387901186.db2.gz HUNSGYKVOXDFLQ-SEZDTBSWSA-N 2 0 236.281 2.057 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@H]1CC2CCC1CC2 ZINC000423124202 387902636 /nfs/dbraw/zinc/90/26/36/387902636.db2.gz GCZXDYQFCQDLGT-SYFKIGIZSA-N 2 0 210.365 2.281 20 0 BEADRP COCC(C)(C)CCC[NH2+][C@@H](C)CCC[NH3+] ZINC000423127237 387904926 /nfs/dbraw/zinc/90/49/26/387904926.db2.gz PBZULEXYWZXMBN-LBPRGKRZSA-N 2 0 230.396 2.156 20 0 BEADRP CC[C@H]([NH2+]CC1CC(F)(F)C1)[C@@H]1CCC[NH2+]1 ZINC000423126375 387905221 /nfs/dbraw/zinc/90/52/21/387905221.db2.gz ISADXKVNXOSVIZ-QWRGUYRKSA-N 2 0 232.318 2.152 20 0 BEADRP CCCc1nc(C)c(C[NH2+][C@H](C)CCC[NH3+])o1 ZINC000423130168 387906870 /nfs/dbraw/zinc/90/68/70/387906870.db2.gz MRBSXILEZQPGHD-SNVBAGLBSA-N 2 0 239.363 2.153 20 0 BEADRP Cc1cccnc1C(C)(C)C[NH2+][C@H](C)C[C@@H](C)[NH3+] ZINC000423132741 387908959 /nfs/dbraw/zinc/90/89/59/387908959.db2.gz CCTUIOLCBUFHHX-CHWSQXEVSA-N 2 0 249.402 2.383 20 0 BEADRP CC1(C)CCC[C@@H]1C[NH2+][C@H]1CCC[C@@H]1[NH3+] ZINC000423132616 387909000 /nfs/dbraw/zinc/90/90/00/387909000.db2.gz JNGZILODCCSARW-WOPDTQHZSA-N 2 0 210.365 2.282 20 0 BEADRP CC[C@@H]([NH2+]C[C@H]1CCCSC1)[C@@H]1CCC[NH2+]1 ZINC000423131945 387909089 /nfs/dbraw/zinc/90/90/89/387909089.db2.gz UCNVGRSOGZHSNI-UPJWGTAASA-N 2 0 242.432 2.250 20 0 BEADRP CC(C)[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])C1)C1CC1 ZINC000514667497 387909785 /nfs/dbraw/zinc/90/97/85/387909785.db2.gz VXRZIZQFWPYCCS-DRZSPHRISA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]C[C@H]1CCCSC1 ZINC000423133700 387912710 /nfs/dbraw/zinc/91/27/10/387912710.db2.gz VXCVGQCAMYBYND-UPJWGTAASA-N 2 0 242.432 2.107 20 0 BEADRP CC[C@H]([NH2+]C1CCC(C[NH3+])CC1)C(F)F ZINC000423144557 387919646 /nfs/dbraw/zinc/91/96/46/387919646.db2.gz HMMRWUZVHCYZFC-RTBKNWGFSA-N 2 0 220.307 2.137 20 0 BEADRP CC(C)[C@@H]1C[C@H]1C[NH2+][C@H](C)[C@@H]1CCCC[NH2+]1 ZINC000423151608 387929605 /nfs/dbraw/zinc/92/96/05/387929605.db2.gz KEVQUXBTRQEDEP-RFGFWPKPSA-N 2 0 224.392 2.399 20 0 BEADRP CC/C=C/C[NH2+][C@@H](C)c1ccc(C[NH3+])nc1C ZINC000423152192 387929805 /nfs/dbraw/zinc/92/98/05/387929805.db2.gz DXTNKMUTDPPGFP-QRGHLMKCSA-N 2 0 233.359 2.466 20 0 BEADRP CC(C)[C@@H]1C[C@H]1C[NH2+][C@@H](C)[C@@H]1CCCC[NH2+]1 ZINC000423151610 387930517 /nfs/dbraw/zinc/93/05/17/387930517.db2.gz KEVQUXBTRQEDEP-XUXIUFHCSA-N 2 0 224.392 2.399 20 0 BEADRP CC(C)[C@@H]1C[C@H]1C[NH2+][C@H]1CCCC[C@H]1C[NH3+] ZINC000423153995 387931627 /nfs/dbraw/zinc/93/16/27/387931627.db2.gz OLSALKBFZOWPDR-XUXIUFHCSA-N 2 0 224.392 2.386 20 0 BEADRP CC(C)[C@@H]1C[C@H]1C[NH2+][C@@H]1CC[NH2+]CC[C@@H]1C ZINC000423154337 387933115 /nfs/dbraw/zinc/93/31/15/387933115.db2.gz OQVVGVQHJPVQDZ-XDQVBPFNSA-N 2 0 224.392 2.256 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCC[C@H]1[C@H]1CCC[NH2+]1)C1CC1 ZINC000423156200 387934489 /nfs/dbraw/zinc/93/44/89/387934489.db2.gz KKGABOSSRUNFIV-YXCITZCRSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1)C1CC1 ZINC000423156199 387935418 /nfs/dbraw/zinc/93/54/18/387935418.db2.gz KKGABOSSRUNFIV-VZZFWQQMSA-N 2 0 222.376 2.295 20 0 BEADRP CC[C@@H]1CCC[C@@H]1C[NH2+][C@H]1CCC[C@@H]1[NH3+] ZINC000423156269 387935465 /nfs/dbraw/zinc/93/54/65/387935465.db2.gz KWORSGMFAIKTAB-NDBYEHHHSA-N 2 0 210.365 2.282 20 0 BEADRP CC(F)(F)CC[NH2+][C@@H]1CCCCC[C@@H]1[NH3+] ZINC000423142945 387920149 /nfs/dbraw/zinc/92/01/49/387920149.db2.gz BVSJGFSMWRUCRX-VHSXEESVSA-N 2 0 220.307 2.281 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CSc2ccccc21 ZINC000423142908 387921406 /nfs/dbraw/zinc/92/14/06/387921406.db2.gz BPHRLAIRYCANDY-UHTWSYAYSA-N 2 0 248.395 2.345 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CCCCC1(F)F)C1C[NH2+]C1 ZINC000423144742 387921436 /nfs/dbraw/zinc/92/14/36/387921436.db2.gz HUZGAHDPZSVEES-KOLCDFICSA-N 2 0 232.318 2.009 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+]CCC(C)(F)F ZINC000423145040 387922682 /nfs/dbraw/zinc/92/26/82/387922682.db2.gz ITUGVDSJMWHURG-UWVGGRQHSA-N 2 0 220.307 2.009 20 0 BEADRP F[C@H]1CCC[C@H]1[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000423148181 387924185 /nfs/dbraw/zinc/92/41/85/387924185.db2.gz UTIXIQNJSHIZQA-MBJXGIAVSA-N 2 0 240.366 2.387 20 0 BEADRP Cc1cccnc1CCC[NH2+][C@@H](C)CCCC[NH3+] ZINC000423146897 387925144 /nfs/dbraw/zinc/92/51/44/387925144.db2.gz BQEJSBBLZJNNQE-AWEZNQCLSA-N 2 0 249.402 2.430 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CCCC(C)(F)F ZINC000423147246 387925404 /nfs/dbraw/zinc/92/54/04/387925404.db2.gz RLSITZBFEJPVAP-RKDXNWHRSA-N 2 0 208.296 2.137 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCOC2CCCC2)CC[N@@H+]1C ZINC000156147081 387925993 /nfs/dbraw/zinc/92/59/93/387925993.db2.gz RUICNPXDCJYEDF-OLZOCXBDSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CCCC(C)(F)F ZINC000423147243 387926157 /nfs/dbraw/zinc/92/61/57/387926157.db2.gz RLSITZBFEJPVAP-BDAKNGLRSA-N 2 0 208.296 2.137 20 0 BEADRP C[C@@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]C[C@H]1CCCO1 ZINC000423150642 387929119 /nfs/dbraw/zinc/92/91/19/387929119.db2.gz BOFCXGWBJPMSTJ-MELADBBJSA-N 2 0 240.391 2.066 20 0 BEADRP CC(C)C[C@@H]1C[C@H]1[NH2+][C@H]1CC[NH2+]CC[C@@H]1C ZINC000423167918 387952754 /nfs/dbraw/zinc/95/27/54/387952754.db2.gz GBKUKUXZZZBNOT-RFQIPJPRSA-N 2 0 224.392 2.399 20 0 BEADRP CCSCC[N@@H+]1CC2(C[C@@H]1C)CC[NH2+]CC2 ZINC000424287487 387953481 /nfs/dbraw/zinc/95/34/81/387953481.db2.gz IWKOADFTNLDQRV-LBPRGKRZSA-N 2 0 242.432 2.204 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]CCC1CC(F)(F)C1 ZINC000423169161 387955289 /nfs/dbraw/zinc/95/52/89/387955289.db2.gz VOKSMTRCNBCBTC-ZYHUDNBSSA-N 2 0 246.345 2.400 20 0 BEADRP C[C@H]([NH2+]C1CCC(C[NH3+])CC1)C(C)(F)F ZINC000423158629 387938665 /nfs/dbraw/zinc/93/86/65/387938665.db2.gz OJPHLWAWLPXIAK-IDKOKCKLSA-N 2 0 220.307 2.137 20 0 BEADRP CC[C@]1(C(C)C)C[C@@H]1[NH2+][C@@H](C)[C@H]1CC[NH2+]C1 ZINC000423158208 387939026 /nfs/dbraw/zinc/93/90/26/387939026.db2.gz CJZRDORNNJDBLI-XDQVBPFNSA-N 2 0 224.392 2.399 20 0 BEADRP CC[C@@H](C)[C@@H](C[NH2+]C1CCC(C[NH3+])CC1)OC ZINC000423158655 387939197 /nfs/dbraw/zinc/93/91/97/387939197.db2.gz OLJNBTKZMBCGOG-BLYZHGLHSA-N 2 0 242.407 2.155 20 0 BEADRP CC[C@@H]1CCCC[C@@H]1C[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000423160376 387941336 /nfs/dbraw/zinc/94/13/36/387941336.db2.gz QRYRLCZNIMGSNO-YNEHKIRRSA-N 2 0 224.392 2.400 20 0 BEADRP CC(C)O[C@H]1C[C@@H]([NH2+][C@@H]2CCCCC[C@@H]2[NH3+])C1 ZINC000423161545 387943405 /nfs/dbraw/zinc/94/34/05/387943405.db2.gz JBEPBHDGROGZPK-RFQIPJPRSA-N 2 0 240.391 2.192 20 0 BEADRP C[C@@H](CCC[NH3+])[N@@H+]1CCC[C@]2(CCSC2)C1 ZINC000423161419 387943475 /nfs/dbraw/zinc/94/34/75/387943475.db2.gz NUOBNXWEWZNJFC-STQMWFEESA-N 2 0 242.432 2.333 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1CC[N@H+](CC)C1)[C@@H]1C[C@@H]1C ZINC000321096409 387947130 /nfs/dbraw/zinc/94/71/30/387947130.db2.gz OGMGPKLYCBCSQK-FQUUOJAGSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)[C@H]1CCC[C@@H](C)C1)C1C[NH2+]C1 ZINC000423164950 387948446 /nfs/dbraw/zinc/94/84/46/387948446.db2.gz PBYYZXMJNOVCNV-XQHKEYJVSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@H]([NH2+]C1CCC(C[NH3+])CC1)c1nccs1 ZINC000423171106 387956351 /nfs/dbraw/zinc/95/63/51/387956351.db2.gz NMYFGMGBZZKWDV-WHXUTIOJSA-N 2 0 239.388 2.311 20 0 BEADRP C[C@H](CCCC[NH3+])[N@@H+]1CCC[C@]2(CCOC2)C1 ZINC000423164543 387948719 /nfs/dbraw/zinc/94/87/19/387948719.db2.gz SWPKWSCJPLBVBM-KGLIPLIRSA-N 2 0 240.391 2.006 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CCC1CC(F)(F)C1 ZINC000423166179 387949475 /nfs/dbraw/zinc/94/94/75/387949475.db2.gz QUMGSJWFUBCCJZ-DTWKUNHWSA-N 2 0 220.307 2.137 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1C[C@H]1c1ccccc1F ZINC000423166821 387950806 /nfs/dbraw/zinc/95/08/06/387950806.db2.gz DLJNNQQSYAIAJO-HQRZJTNHSA-N 2 0 248.345 2.399 20 0 BEADRP CC(C)=CCC[C@H](C)[NH2+][C@H](C)C1C[NH2+]C1 ZINC000423165963 387950974 /nfs/dbraw/zinc/95/09/74/387950974.db2.gz YOCXXKPHTVUIDI-NWDGAFQWSA-N 2 0 210.365 2.319 20 0 BEADRP CC[C@H]([NH2+]CC1=CC[N@H+](C)CC1)C1CCC1 ZINC000392298125 387951326 /nfs/dbraw/zinc/95/13/26/387951326.db2.gz WSKCBDORHRKEHA-AWEZNQCLSA-N 2 0 222.376 2.417 20 0 BEADRP COC1CCC([NH2+]C2CCC(C[NH3+])CC2)CC1 ZINC000423171500 387957896 /nfs/dbraw/zinc/95/78/96/387957896.db2.gz ORNJHYVEOBKLPS-UHFFFAOYSA-N 2 0 240.391 2.051 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+][C@@H]1C[C@H]1c1ccccc1F ZINC000423171534 387958751 /nfs/dbraw/zinc/95/87/51/387958751.db2.gz OVLASXNPMJYUQO-IGHBBLSQSA-N 2 0 234.318 2.151 20 0 BEADRP COC1CCC([NH2+][C@H](C)[C@@H]2CCCC[NH2+]2)CC1 ZINC000423172322 387959160 /nfs/dbraw/zinc/95/91/60/387959160.db2.gz SEXYCCGINHVOSS-RYSNWHEDSA-N 2 0 240.391 2.064 20 0 BEADRP C[C@H]([NH2+]C1(C2CCC2)CCC1)[C@H]1CCC[NH2+]1 ZINC000423172670 387959791 /nfs/dbraw/zinc/95/97/91/387959791.db2.gz UPZLVGGQCCFCFS-WCQYABFASA-N 2 0 222.376 2.439 20 0 BEADRP CC(C)[C@@H](Cc1ccccc1)[NH2+]CCC[NH3+] ZINC000423186554 387972078 /nfs/dbraw/zinc/97/20/78/387972078.db2.gz KIYMMKHWFYRQLH-CQSZACIVSA-N 2 0 220.360 2.192 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCC[C@@H]1[NH3+])CC(F)(F)F ZINC000423175254 387962334 /nfs/dbraw/zinc/96/23/34/387962334.db2.gz DNTZOEWUBHUZGD-CIUDSAMLSA-N 2 0 224.270 2.044 20 0 BEADRP C[C@@H]1CC[N@H+](CC[C@H]2CCC[NH+]2C)[C@H]1C ZINC000245603553 387965578 /nfs/dbraw/zinc/96/55/78/387965578.db2.gz JLVCENIRZQBVIT-FRRDWIJNSA-N 2 0 210.365 2.201 20 0 BEADRP CC[C@H]1CC[C@H]1[NH2+]CC1([NH3+])CCCCC1 ZINC000423183387 387967310 /nfs/dbraw/zinc/96/73/10/387967310.db2.gz ROBDGDZOBQKNII-NWDGAFQWSA-N 2 0 210.365 2.426 20 0 BEADRP CC[C@H](C[NH2+][C@@H]1CCC[C@@H]1[NH3+])CC(F)(F)F ZINC000423180935 387968042 /nfs/dbraw/zinc/96/80/42/387968042.db2.gz KXHQZNAUSOPSJG-LPEHRKFASA-N 2 0 238.297 2.434 20 0 BEADRP CC(C)[C@H](Cc1ccccc1)[NH2+]CCC[NH3+] ZINC000423186553 387971264 /nfs/dbraw/zinc/97/12/64/387971264.db2.gz KIYMMKHWFYRQLH-AWEZNQCLSA-N 2 0 220.360 2.192 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C2CC2)C2CCC2)C1 ZINC000453068857 387978705 /nfs/dbraw/zinc/97/87/05/387978705.db2.gz TVYMFRFXPSYVCW-DOMZBBRYSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]1CC[C@@H](C)[C@H]([NH2+]C2CC[NH2+]CC2)C1 ZINC000423195531 387979454 /nfs/dbraw/zinc/97/94/54/387979454.db2.gz ZIWDVPHSXKJVHV-NQBHXWOUSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@H]([NH2+]C2CC[NH2+]CC2)C1 ZINC000423195535 387979600 /nfs/dbraw/zinc/97/96/00/387979600.db2.gz ZIWDVPHSXKJVHV-NTZNESFSSA-N 2 0 210.365 2.153 20 0 BEADRP C[NH+](C)C[C@H]1CC[N@H+](C[C@@H]2CC=CCC2)C1 ZINC000245739379 387979832 /nfs/dbraw/zinc/97/98/32/387979832.db2.gz LLAYEOXJBXUEQP-ZIAGYGMSSA-N 2 0 222.376 2.226 20 0 BEADRP CC(C)(C[NH2+][C@H]1CCC[C@H]1C[NH3+])c1cccnc1 ZINC000423196498 387981206 /nfs/dbraw/zinc/98/12/06/387981206.db2.gz ZVVPLCTWUUERAA-JSGCOSHPSA-N 2 0 247.386 2.076 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+]CCC[NH3+])CCC2 ZINC000423196845 387981373 /nfs/dbraw/zinc/98/13/73/387981373.db2.gz WPECGYWDIFQOIY-CQSZACIVSA-N 2 0 218.344 2.311 20 0 BEADRP CC[C@H](C)[NH2+][C@@H]1CC[N@H+](C)[C@H]2CCC[C@@H]21 ZINC000453051380 387973671 /nfs/dbraw/zinc/97/36/71/387973671.db2.gz BEVUKRLPUUTTCY-LOWDOPEQSA-N 2 0 210.365 2.247 20 0 BEADRP C[NH2+]CCC[NH2+][C@H](C)c1ccc(C)cc1 ZINC000423192464 387978119 /nfs/dbraw/zinc/97/81/19/387978119.db2.gz VKSFJUYKEGZOIX-GFCCVEGCSA-N 2 0 206.333 2.255 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H]1CC[N@H+](CC)C1)c1ccncc1 ZINC000453067923 387978354 /nfs/dbraw/zinc/97/83/54/387978354.db2.gz SFIQSVDKJLMBDD-DZGCQCFKSA-N 2 0 247.386 2.464 20 0 BEADRP CC[C@@H]1C[C@H](C)CC[C@@H]1[NH2+][C@H]1CC[NH2+]C1 ZINC000423201706 387987545 /nfs/dbraw/zinc/98/75/45/387987545.db2.gz JCLYVLMQJXVSEH-NDBYEHHHSA-N 2 0 210.365 2.153 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1CCCc2sccc21 ZINC000423203570 387989248 /nfs/dbraw/zinc/98/92/48/387989248.db2.gz SPKZTOPMFJWGOF-LLVKDONJSA-N 2 0 224.373 2.325 20 0 BEADRP C[NH2+]CCC[NH2+]C1CCC(C(F)F)CC1 ZINC000423202817 387990137 /nfs/dbraw/zinc/99/01/37/387990137.db2.gz RGBVRKLCFUATMG-UHFFFAOYSA-N 2 0 220.307 2.009 20 0 BEADRP CC(C)[C@@H]1C[C@H]([NH2+][C@@H]2CCCC[C@H]2[NH3+])CCO1 ZINC000424364958 387990578 /nfs/dbraw/zinc/99/05/78/387990578.db2.gz FOZANZCAIQVMRL-SYQHCUMBSA-N 2 0 240.391 2.050 20 0 BEADRP Cc1cncc([C@H](C)[NH2+][C@H](C)[C@H]2CCC[NH2+]C2)c1 ZINC000423206827 387991761 /nfs/dbraw/zinc/99/17/61/387991761.db2.gz CEAMMNCCHPPIBK-RDBSUJKOSA-N 2 0 247.386 2.429 20 0 BEADRP CC1(C)CC[C@@H]([NH2+][C@@H]2CCCC[C@H]2[NH3+])C1 ZINC000424368021 387992001 /nfs/dbraw/zinc/99/20/01/387992001.db2.gz OKZIRUKPWMJONU-IJLUTSLNSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+][C@@H]2CCCC[C@H]2[NH3+])C1 ZINC000424367788 387992028 /nfs/dbraw/zinc/99/20/28/387992028.db2.gz NVQUPGQWFQHGHG-FDYHWXHSSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+][C@@H]1C[C@H]1C1CCC1 ZINC000424369728 387993743 /nfs/dbraw/zinc/99/37/43/387993743.db2.gz CFXQFNJODNOIHF-SCUASFONSA-N 2 0 222.376 2.153 20 0 BEADRP C([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)[C@@H]1C[C@H]1C1CCC1 ZINC000424368840 387994025 /nfs/dbraw/zinc/99/40/25/387994025.db2.gz BWZAODOFVYVRNU-WQKZHXONSA-N 2 0 234.387 2.295 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@H](C1CC1)C1CCC1 ZINC000453091318 387982407 /nfs/dbraw/zinc/98/24/07/387982407.db2.gz PPZTVNUFFXCTGQ-AWEZNQCLSA-N 2 0 224.392 2.497 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@@H]2C[C@H]3C[C@H]3C2)[C@@H]2CCC[C@@H]21 ZINC000424342176 387982780 /nfs/dbraw/zinc/98/27/80/387982780.db2.gz FJMJYNNHUHLMOT-IWTMDLJTSA-N 2 0 234.387 2.247 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1CCC[C@@H](C(C)C)C1 ZINC000423198876 387983172 /nfs/dbraw/zinc/98/31/72/387983172.db2.gz IKJXCWCWDIXKRE-CHWSQXEVSA-N 2 0 212.381 2.400 20 0 BEADRP C[NH2+]CCC[NH2+][C@H]1CCc2cc(F)ccc21 ZINC000423198020 387984837 /nfs/dbraw/zinc/98/48/37/387984837.db2.gz COIYUMYGRVSUAU-ZDUSSCGKSA-N 2 0 222.307 2.012 20 0 BEADRP CC[C@H]([NH2+][C@@H]1C[C@H]1C1CCC1)[C@@H]1CCC[NH2+]1 ZINC000424372926 387997120 /nfs/dbraw/zinc/99/71/20/387997120.db2.gz IWGMDQCIKHRMTD-XDQVBPFNSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[NH2+]C1)[C@H]1CCCC[C@H]1C ZINC000423163897 387997850 /nfs/dbraw/zinc/99/78/50/387997850.db2.gz WCBMGJYZCRCOOK-NDBYEHHHSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@H]([NH2+][C@H](C)[C@H]1CCC[NH2+]C1)C1CC1 ZINC000423215284 387998336 /nfs/dbraw/zinc/99/83/36/387998336.db2.gz MVYLCEYVQKNHOP-WXHSDQCUSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCCC[C@H]1[NH3+])[C@H]1C[C@@H]1C ZINC000424376170 387999822 /nfs/dbraw/zinc/99/98/22/387999822.db2.gz OUBLBIYOYPPHSS-IEECTRCBSA-N 2 0 210.365 2.281 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]C[C@@H]1C[C@H]1C1CCC1 ZINC000424375616 388000030 /nfs/dbraw/zinc/00/00/30/388000030.db2.gz KNWORQUUJAFXGG-LFSVMHDDSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H]1c2ccccc2C[C@@H]1C ZINC000423224181 388005678 /nfs/dbraw/zinc/00/56/78/388005678.db2.gz ILHVNIHLEJCRTA-MJVIPROJSA-N 2 0 218.344 2.247 20 0 BEADRP CC[C@@H]([NH2+]CC[C@H](C)[NH3+])c1ccccc1OC ZINC000423223662 388006308 /nfs/dbraw/zinc/00/63/08/388006308.db2.gz HBCHXQAZKFLLJM-WCQYABFASA-N 2 0 236.359 2.473 20 0 BEADRP CC[NH+](CC)C[C@H]1CC[N@H+](CC2CC2)C1 ZINC000156584951 388006440 /nfs/dbraw/zinc/00/64/40/388006440.db2.gz GKLVAASCEAXVPI-CYBMUJFWSA-N 2 0 210.365 2.060 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+]CC[C@H](C)[NH3+])CC2 ZINC000423225368 388007903 /nfs/dbraw/zinc/00/79/03/388007903.db2.gz MMOHXMDMCRVPRS-SMDDNHRTSA-N 2 0 218.344 2.309 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@H]1CCCc2c(O)cccc21 ZINC000423225193 388008380 /nfs/dbraw/zinc/00/83/80/388008380.db2.gz LRHDLCCCJDWLJW-GWCFXTLKSA-N 2 0 234.343 2.097 20 0 BEADRP C[C@@H]([NH2+]CC[C@H](C)[NH3+])c1cc(F)cc(F)c1 ZINC000423226001 388009881 /nfs/dbraw/zinc/00/98/81/388009881.db2.gz PAWSTNPENIAVAH-DTWKUNHWSA-N 2 0 228.286 2.353 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@H]1c2cc(F)ccc2C[C@H]1C ZINC000423227038 388010750 /nfs/dbraw/zinc/01/07/50/388010750.db2.gz UAPHKEQGWBLEJT-ISTVAULSSA-N 2 0 236.334 2.386 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C2CC(C)(F)C2)[C@@H]2CCC[C@@H]21 ZINC000453244820 388023958 /nfs/dbraw/zinc/02/39/58/388023958.db2.gz ZFZJWGIQBMLSQY-XCONPDAUSA-N 2 0 240.366 2.339 20 0 BEADRP C(C[C@H]1CC[NH2+]C1)[NH2+][C@@H](C1CC1)C1CCC1 ZINC000423240577 388024054 /nfs/dbraw/zinc/02/40/54/388024054.db2.gz CJQYZXOECYNFAQ-BXUZGUMPSA-N 2 0 222.376 2.154 20 0 BEADRP Cc1cc([C@H](C)[NH2+]CC[C@H](C)[NH3+])oc1C ZINC000423227532 388011762 /nfs/dbraw/zinc/01/17/62/388011762.db2.gz WDKLAWVPEFZBPQ-UWVGGRQHSA-N 2 0 210.321 2.284 20 0 BEADRP CCC[NH+]1CCC([N@H+](C)CC2CC2)CC1 ZINC000156634780 388013393 /nfs/dbraw/zinc/01/33/93/388013393.db2.gz GFGHLTDQKOOINZ-UHFFFAOYSA-N 2 0 210.365 2.203 20 0 BEADRP C[C@@H](C[NH2+][C@H](C1CC1)C1CCC1)C[NH+](C)C ZINC000453224463 388014419 /nfs/dbraw/zinc/01/44/19/388014419.db2.gz AXGZAGOPMIHUOA-FZMZJTMJSA-N 2 0 224.392 2.352 20 0 BEADRP COc1ccc2c(c1)[C@H]([NH2+]CC[C@H](C)[NH3+])CCC2 ZINC000423229029 388014857 /nfs/dbraw/zinc/01/48/57/388014857.db2.gz GLGJXHPIMQPKRZ-XHDPSFHLSA-N 2 0 248.370 2.400 20 0 BEADRP CNCC[NH2+][C@H]1CC[C@H](c2ccccc2)C1 ZINC000423235442 388018601 /nfs/dbraw/zinc/01/86/01/388018601.db2.gz AZHRNDYUHOCEAL-KBPBESRZSA-N 2 0 218.344 2.132 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H](c1cccnc1)C(C)C ZINC000423269907 388020838 /nfs/dbraw/zinc/02/08/38/388020838.db2.gz HIEYWVOSVWMBDV-JSGCOSHPSA-N 2 0 235.375 2.224 20 0 BEADRP C[C@@H]1CCC[C@@H](C)C1[NH2+]C[C@@H]1CCC[NH2+]1 ZINC000423239577 388022429 /nfs/dbraw/zinc/02/24/29/388022429.db2.gz SHILLKFPUJWPMD-UTUOFQBUSA-N 2 0 210.365 2.153 20 0 BEADRP COc1ccc([C@@H](C)[NH2+]CC[C@H](C)[NH3+])cc1 ZINC000423239698 388022690 /nfs/dbraw/zinc/02/26/90/388022690.db2.gz WJVABARUNNBHSE-WDEREUQCSA-N 2 0 222.332 2.083 20 0 BEADRP CC(C)[C@](C)(C[NH3+])[NH2+]Cc1ccccc1 ZINC000082390064 388032900 /nfs/dbraw/zinc/03/29/00/388032900.db2.gz HBKGSSLRBQURFL-ZDUSSCGKSA-N 2 0 206.333 2.150 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1ccc(F)cc1 ZINC000423254480 388036046 /nfs/dbraw/zinc/03/60/46/388036046.db2.gz YEDLXQUPHUOGNP-NEPJUHHUSA-N 2 0 236.334 2.476 20 0 BEADRP CC[C@H]([NH2+]C[C@H](C)C[NH2+]C)[C@@H]1CC1(C)C ZINC000423255734 388036404 /nfs/dbraw/zinc/03/64/04/388036404.db2.gz APZNKWMKLRQBJB-WOPDTQHZSA-N 2 0 212.381 2.256 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CCc2c1cccc2OC ZINC000423256427 388037005 /nfs/dbraw/zinc/03/70/05/388037005.db2.gz BXKWSHQMMGQBAD-SMDDNHRTSA-N 2 0 248.370 2.128 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H]1CCCc2c(O)cccc21 ZINC000423255607 388037158 /nfs/dbraw/zinc/03/71/58/388037158.db2.gz AJAOEHOODHOFFK-RISCZKNCSA-N 2 0 248.370 2.215 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H](C)c1ccccc1 ZINC000423255727 388037303 /nfs/dbraw/zinc/03/73/03/388037303.db2.gz APXJSANXXIKPMG-NEPJUHHUSA-N 2 0 206.333 2.193 20 0 BEADRP Cc1ccnc([C@H](C)[NH2+]CC[C@H]2CCC[NH2+]C2)c1 ZINC000423256607 388037431 /nfs/dbraw/zinc/03/74/31/388037431.db2.gz CEFOUGZWQGGADI-UONOGXRCSA-N 2 0 247.386 2.430 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@H]1C)C1CC1 ZINC000453298030 388038170 /nfs/dbraw/zinc/03/81/70/388038170.db2.gz WUSBWJKUCHKNBM-LSCVPOLPSA-N 2 0 210.365 2.103 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCC[NH2+]C1)c1cccc(O)c1 ZINC000423262075 388041174 /nfs/dbraw/zinc/04/11/74/388041174.db2.gz UFIFDLUSJGINLH-QWHCGFSZSA-N 2 0 248.370 2.433 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@@H]1CCCC12CCC2 ZINC000423263872 388041352 /nfs/dbraw/zinc/04/13/52/388041352.db2.gz BHISAVZIAKFLJD-VXGBXAGGSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+][C@@H]1CCCC12CCC2 ZINC000423263870 388041837 /nfs/dbraw/zinc/04/18/37/388041837.db2.gz BHISAVZIAKFLJD-NWDGAFQWSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@H]1CC(C)(C)C[C@@H]1C ZINC000423263905 388042988 /nfs/dbraw/zinc/04/29/88/388042988.db2.gz BJPSWMQCMXKOSC-TUAOUCFPSA-N 2 0 212.381 2.384 20 0 BEADRP CC(C)=CCC[C@@H](C)[NH2+]C[C@H]1CCC[NH2+]1 ZINC000423246598 388029942 /nfs/dbraw/zinc/02/99/42/388029942.db2.gz ZLXZRTDVJCNFPO-CHWSQXEVSA-N 2 0 210.365 2.463 20 0 BEADRP Cc1ccnc([C@@H](C)[NH2+]CC[C@@H]2CC[NH2+]C2)c1 ZINC000423247267 388030775 /nfs/dbraw/zinc/03/07/75/388030775.db2.gz KYBWZXBNXYKPEO-OLZOCXBDSA-N 2 0 233.359 2.040 20 0 BEADRP COc1cccc([C@H](C)[NH2+]CC[C@@H]2CC[NH2+]C2)c1 ZINC000423250184 388031113 /nfs/dbraw/zinc/03/11/13/388031113.db2.gz PYCGCZCLLANNOM-STQMWFEESA-N 2 0 248.370 2.345 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@@H](C)CCCc1cccnc1 ZINC000423274165 388054856 /nfs/dbraw/zinc/05/48/56/388054856.db2.gz LMVNKUUYRSXIIJ-DZGCQCFKSA-N 2 0 249.402 2.366 20 0 BEADRP CCC1CC([NH2+][C@H]2CCCC[C@@H]2C[NH3+])C1 ZINC000423277794 388057823 /nfs/dbraw/zinc/05/78/23/388057823.db2.gz OSSYDZKVWVZAKJ-KPFVRQRISA-N 2 0 210.365 2.282 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H](C)c1ccc(OC)cc1 ZINC000423278156 388058814 /nfs/dbraw/zinc/05/88/14/388058814.db2.gz QPHNOPFKDYOYQV-RYUDHWBXSA-N 2 0 236.359 2.201 20 0 BEADRP CCC1(CC)[C@H]([NH2+]C[C@@H]([NH3+])C(C)C)C[C@@H]1OC ZINC000423277450 388059029 /nfs/dbraw/zinc/05/90/29/388059029.db2.gz PPUPOWQEZQOPNN-UPJWGTAASA-N 2 0 242.407 2.153 20 0 BEADRP CC(C)[C@@H]1C[C@H]1C[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000453362255 388059979 /nfs/dbraw/zinc/05/99/79/388059979.db2.gz QYNAGTXDMHYPFM-FQUUOJAGSA-N 2 0 224.392 2.351 20 0 BEADRP CC[C@H]([NH2+]C[C@@H](C)C[NH2+]C)C(C)(C)C ZINC000423278206 388060632 /nfs/dbraw/zinc/06/06/32/388060632.db2.gz QUIOKXFBJHGOFH-QWRGUYRKSA-N 2 0 200.370 2.256 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCC[NH2+]C1)[C@H]1CC1(C)C ZINC000423280046 388061944 /nfs/dbraw/zinc/06/19/44/388061944.db2.gz UEKPTWDEHQGJEX-YNEHKIRRSA-N 2 0 224.392 2.400 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H](C)c1ccc2c(c1)COC2 ZINC000423279711 388062439 /nfs/dbraw/zinc/06/24/39/388062439.db2.gz SVGREXHXFJORHO-RYUDHWBXSA-N 2 0 248.370 2.223 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@H]1CC[C@H]1C1CCC1 ZINC000423285127 388069689 /nfs/dbraw/zinc/06/96/89/388069689.db2.gz YXOJENCXFXNFOE-XQQFMLRXSA-N 2 0 210.365 2.138 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]C1CCC(C(F)F)CC1 ZINC000423285599 388069706 /nfs/dbraw/zinc/06/97/06/388069706.db2.gz ZRELZKUPUIPNRT-KPPDAEKUSA-N 2 0 234.334 2.255 20 0 BEADRP C[C@@H]1CC[C@@H](C)[N@H+](CCC2CC[NH2+]CC2)C1 ZINC000084048326 388069864 /nfs/dbraw/zinc/06/98/64/388069864.db2.gz OKOUGHNLHWSCFE-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CC[C@H](C)[N@H+](CCC2CC[NH2+]CC2)C1 ZINC000084048320 388071020 /nfs/dbraw/zinc/07/10/20/388071020.db2.gz OKOUGHNLHWSCFE-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCCC[N@H+](C)C2CC2)[C@H]1C ZINC000453396859 388071276 /nfs/dbraw/zinc/07/12/76/388071276.db2.gz IWWWADXJWPERAL-DYEKYZERSA-N 2 0 224.392 2.495 20 0 BEADRP CCC([NH3+])(CC)C[NH2+][C@H](COC)C1CCCC1 ZINC000423288592 388072852 /nfs/dbraw/zinc/07/28/52/388072852.db2.gz TWRCTSQXNIDFFC-CYBMUJFWSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H](C)[C@@H]2CCCO2)cc1 ZINC000423289862 388074326 /nfs/dbraw/zinc/07/43/26/388074326.db2.gz BUJLNSRDIPLSRM-HUBLWGQQSA-N 2 0 248.370 2.363 20 0 BEADRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]Cc1cccc(F)c1 ZINC000084218468 388074871 /nfs/dbraw/zinc/07/48/71/388074871.db2.gz ILKOPSIHLNOYFY-YPMHNXCESA-N 2 0 222.307 2.043 20 0 BEADRP Cc1cccc(C[NH2+][C@@H]2CCC[C@@H]2C[NH3+])c1 ZINC000084218105 388075317 /nfs/dbraw/zinc/07/53/17/388075317.db2.gz AVZBYRCZTWTJEO-ZIAGYGMSSA-N 2 0 218.344 2.212 20 0 BEADRP C[C@H]1CCC[C@H](C[NH+]2CCC(C[NH3+])CC2)C1 ZINC000084344474 388076352 /nfs/dbraw/zinc/07/63/52/388076352.db2.gz JXMQOBJKNWUKKV-JSGCOSHPSA-N 2 0 224.392 2.483 20 0 BEADRP C[C@@H]1CCC[C@H](C[N@@H+]2CCC[C@H](C[NH3+])C2)C1 ZINC000084344487 388076601 /nfs/dbraw/zinc/07/66/01/388076601.db2.gz KPKMVIXWUOYEPM-HZSPNIEDSA-N 2 0 224.392 2.483 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H](C)c1ccc2ccccc2n1 ZINC000423294649 388077136 /nfs/dbraw/zinc/07/71/36/388077136.db2.gz CMXLWPJKSFMCJI-VXGBXAGGSA-N 2 0 243.354 2.480 20 0 BEADRP C[C@@H]([NH2+]C[C@@H](C)C[NH3+])c1cc(F)c(F)c(F)c1 ZINC000423295203 388077498 /nfs/dbraw/zinc/07/74/98/388077498.db2.gz DPCYLEPVHNKSKG-JGVFFNPUSA-N 2 0 246.276 2.349 20 0 BEADRP Cc1ccc2c(c1)[C@@H]([NH2+]C[C@@H](C)C[NH3+])CCCO2 ZINC000423296882 388078450 /nfs/dbraw/zinc/07/84/50/388078450.db2.gz HWBVQSTUCHIECS-JSGCOSHPSA-N 2 0 248.370 2.393 20 0 BEADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@@H]2CCO[C@H](C)C2)cc1 ZINC000423295912 388078562 /nfs/dbraw/zinc/07/85/62/388078562.db2.gz XTTYTTZTOLTYAE-LALPHHSUSA-N 2 0 248.370 2.363 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H](C)c1ccccc1 ZINC000336659056 388083072 /nfs/dbraw/zinc/08/30/72/388083072.db2.gz BMCHECFBNHFIKW-NEPJUHHUSA-N 2 0 206.333 2.465 20 0 BEADRP Cc1csc([C@@H](C)[NH2+][C@@H](C)CCC[NH3+])n1 ZINC000336659885 388087149 /nfs/dbraw/zinc/08/71/49/388087149.db2.gz BPQNDKGDHDQTGQ-WCBMZHEXSA-N 2 0 227.377 2.230 20 0 BEADRP CC(C)OC[C@H](C)[NH2+]CCCC[N@H+](C)C1CC1 ZINC000453601804 388089915 /nfs/dbraw/zinc/08/99/15/388089915.db2.gz VXSUWSNQTSBKPO-ZDUSSCGKSA-N 2 0 242.407 2.264 20 0 BEADRP Cc1cc(NC[C@@H]2[N@H+](C)CCCC2(C)C)cc[nH+]1 ZINC000447808877 388094225 /nfs/dbraw/zinc/09/42/25/388094225.db2.gz WUKPYVCPGLOBFK-AWEZNQCLSA-N 2 0 247.386 2.344 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]Cc2ccccc2)C1 ZINC000086401673 388101614 /nfs/dbraw/zinc/10/16/14/388101614.db2.gz CRTKMMPQFUSCPW-CHWSQXEVSA-N 2 0 204.317 2.046 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]Cc2ccccc2)C1 ZINC000086401675 388101646 /nfs/dbraw/zinc/10/16/46/388101646.db2.gz CRTKMMPQFUSCPW-OLZOCXBDSA-N 2 0 204.317 2.046 20 0 BEADRP C[C@@H](CCN[C@H]1CC[NH2+]C1)c1ccccc1 ZINC000086729953 388108076 /nfs/dbraw/zinc/10/80/76/388108076.db2.gz BCXJVEYGINOXNH-JSGCOSHPSA-N 2 0 218.344 2.132 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H]2CS[C@@H](C)C2)CC1 ZINC000086934590 388110841 /nfs/dbraw/zinc/11/08/41/388110841.db2.gz CBMIBYMUMQTBAY-WCQYABFASA-N 2 0 242.432 2.344 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CCc2ccc(OC)cc21 ZINC000423267418 388045265 /nfs/dbraw/zinc/04/52/65/388045265.db2.gz DYWAKBKYFUQDJT-XHDPSFHLSA-N 2 0 248.370 2.128 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@@H]1CCC[C@H]2C[C@]21C ZINC000423267366 388046150 /nfs/dbraw/zinc/04/61/50/388046150.db2.gz FKQUEAMAUCCEOQ-UMSGYPCISA-N 2 0 210.365 2.138 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@@H](C)CC(C)(C)C ZINC000423271314 388049359 /nfs/dbraw/zinc/04/93/59/388049359.db2.gz IXBZUGKOYBWXSF-WDEREUQCSA-N 2 0 200.370 2.384 20 0 BEADRP CC[C@@H]1CC[C@H](C)C[C@H]1[NH2+][C@@H]1CC[NH2+]C1 ZINC000423213882 388050201 /nfs/dbraw/zinc/05/02/01/388050201.db2.gz LVEJYLCQJPMURG-UMSGYPCISA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)[C@H]([NH2+]C1CCC([NH3+])CC1)C1CC1 ZINC000324312489 388116689 /nfs/dbraw/zinc/11/66/89/388116689.db2.gz WRWGJECWUJPPRM-BPCQOVAHSA-N 2 0 210.365 2.281 20 0 BEADRP Cc1cccc(CC[N@H+]2CC[C@@H](C[NH+](C)C)C2)c1 ZINC000449035474 388133776 /nfs/dbraw/zinc/13/37/76/388133776.db2.gz OMJCPMYVFYTHHU-INIZCTEOSA-N 2 0 246.398 2.421 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+][C@@H]1CCN2CCCC[C@H]12 ZINC000449082833 388140335 /nfs/dbraw/zinc/14/03/35/388140335.db2.gz QEQXDSBBTJBWJZ-BPLDGKMQSA-N 2 0 248.370 2.427 20 0 BEADRP CC(C)N(C)CC[NH2+][C@H](C)Cc1ccoc1 ZINC000449112572 388144897 /nfs/dbraw/zinc/14/48/97/388144897.db2.gz RTCHTVTUVFYLLM-GFCCVEGCSA-N 2 0 224.348 2.140 20 0 BEADRP C[N@H+](CC[C@H]1CCC[NH+]1C)[C@H]1CC1(C)C ZINC000489515940 388219489 /nfs/dbraw/zinc/21/94/89/388219489.db2.gz PEKPTJVOGGHHIO-NEPJUHHUSA-N 2 0 210.365 2.201 20 0 BEADRP CSc1ccc(C[NH2+]C2CC[NH2+]CC2)cc1 ZINC000084534799 256565092 /nfs/dbraw/zinc/56/50/92/256565092.db2.gz MXJSLKSPFAXDOW-UHFFFAOYSA-N 2 0 236.384 2.250 20 0 BEADRP CC[NH+](CC)CCC[N@@H+]1CC[C@H](OC)[C@@H](C)C1 ZINC000451578832 388282776 /nfs/dbraw/zinc/28/27/76/388282776.db2.gz XUPVKUBOFRIWIN-KBPBESRZSA-N 2 0 242.407 2.075 20 0 BEADRP CC[NH+](CC)CCC[N@@H+]1CC[C@@H](OC)[C@H](C)C1 ZINC000451579035 388282824 /nfs/dbraw/zinc/28/28/24/388282824.db2.gz XUPVKUBOFRIWIN-ZIAGYGMSSA-N 2 0 242.407 2.075 20 0 BEADRP CC[NH+](CC)CCC[N@@H+]1CC[C@H](SC)C1 ZINC000451327005 388263611 /nfs/dbraw/zinc/26/36/11/388263611.db2.gz RUKJOBWXVILEET-LBPRGKRZSA-N 2 0 230.421 2.156 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@@H]1CS[C@H](C)C1 ZINC000300369668 388362832 /nfs/dbraw/zinc/36/28/32/388362832.db2.gz ZQSKJOLMSWIVDA-NEPJUHHUSA-N 2 0 230.421 2.200 20 0 BEADRP c1csc(C[N@H+]2CC[C@H]3C[NH2+]C[C@H]3CC2)c1 ZINC000335269852 388449109 /nfs/dbraw/zinc/44/91/09/388449109.db2.gz KNVAUGMOUHBZBA-TXEJJXNPSA-N 2 0 236.384 2.180 20 0 BEADRP C[NH+](C)Cc1cccc(C[NH2+]CC2(F)CC2)c1 ZINC000525990533 388452510 /nfs/dbraw/zinc/45/25/10/388452510.db2.gz GNRIERZXMVIHSG-UHFFFAOYSA-N 2 0 236.334 2.340 20 0 BEADRP CS[C@@H]1CC[C@@H]1[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000336696012 388463084 /nfs/dbraw/zinc/46/30/84/388463084.db2.gz LWLTWNFHCPMIDC-FVCCEPFGSA-N 2 0 240.416 2.097 20 0 BEADRP CS[C@@H]1CC[C@@H]1[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000336696015 388463557 /nfs/dbraw/zinc/46/35/57/388463557.db2.gz LWLTWNFHCPMIDC-MROQNXINSA-N 2 0 240.416 2.097 20 0 BEADRP CCN1CCC[C@@H]1C[NH2+][C@H]1CCC1(C)C ZINC000336703113 388464932 /nfs/dbraw/zinc/46/49/32/388464932.db2.gz QIJWIZOSUYZRHM-NEPJUHHUSA-N 2 0 210.365 2.249 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+]C[C@@H]2CC[C@H]3C[C@H]3C2)C1 ZINC000403862762 388415241 /nfs/dbraw/zinc/41/52/41/388415241.db2.gz WSURMDYGKVRAJZ-APIJFGDWSA-N 2 0 236.403 2.354 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCCC1(C)C)[C@@H]1CCC[NH2+]1 ZINC000400656587 256710104 /nfs/dbraw/zinc/71/01/04/256710104.db2.gz RAVSBGBICMONQP-SDDRHHMPSA-N 2 0 210.365 2.295 20 0 BEADRP Cc1cc(C[NH2+]CCCc2cnccc2C)no1 ZINC000573139990 388424005 /nfs/dbraw/zinc/42/40/05/388424005.db2.gz VOPTYEWJVLKYES-UHFFFAOYSA-N 2 0 245.326 2.409 20 0 BEADRP CCc1cc(NCCCn2ccnc2)cc[nH+]1 ZINC000307778502 388426985 /nfs/dbraw/zinc/42/69/85/388426985.db2.gz VZWMGYANLBHBKP-UHFFFAOYSA-N 2 0 230.315 2.343 20 0 BEADRP CCC[C@@H]([NH2+]CCC[NH+](C)C)C1CCC1 ZINC000322462129 388435374 /nfs/dbraw/zinc/43/53/74/388435374.db2.gz LUROGXIJIAOHSS-CYBMUJFWSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H]1CC[C@@H](C)[C@@H]([NH2+]CC2CC[NH2+]CC2)C1 ZINC000517122862 388538812 /nfs/dbraw/zinc/53/88/12/388538812.db2.gz LRJSFFWXMPJOEA-BZPMIXESSA-N 2 0 224.392 2.400 20 0 BEADRP CC[C@@H](C[NH2+]C1CC[NH+](C(C)(C)C)CC1)OC ZINC000353562182 388542873 /nfs/dbraw/zinc/54/28/73/388542873.db2.gz RQQFHNCGAXZNMF-ZDUSSCGKSA-N 2 0 242.407 2.264 20 0 BEADRP CCC[C@H](C[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@@H]1C)OC ZINC000356333487 388547686 /nfs/dbraw/zinc/54/76/86/388547686.db2.gz LDCBHIKUWFPZAU-REWJHTLYSA-N 2 0 242.407 2.120 20 0 BEADRP CC[NH+](CC)CCC[NH2+]C1(C(C)C)CC1 ZINC000339510696 388483715 /nfs/dbraw/zinc/48/37/15/388483715.db2.gz FCSBLRWRXUKJOK-UHFFFAOYSA-N 2 0 212.381 2.497 20 0 BEADRP CCC[C@H](C[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@H]1C)OC ZINC000356333485 388548552 /nfs/dbraw/zinc/54/85/52/388548552.db2.gz LDCBHIKUWFPZAU-AAVRWANBSA-N 2 0 242.407 2.120 20 0 BEADRP CCC[C@H](C[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)OC ZINC000356333474 388548602 /nfs/dbraw/zinc/54/86/02/388548602.db2.gz KYNXDFPWMLXFCU-MGPQQGTHSA-N 2 0 240.391 2.018 20 0 BEADRP CCC[C@@H](C)CN1C[C@@H](F)C[C@H]1C[NH2+]C ZINC000378739831 388493402 /nfs/dbraw/zinc/49/34/02/388493402.db2.gz OOSQZBZMGFRFAJ-WOPDTQHZSA-N 2 0 216.344 2.054 20 0 BEADRP Cc1ccc(C[NH+]2CCC(CC[NH3+])CC2)c(C)n1 ZINC000564338182 388505146 /nfs/dbraw/zinc/50/51/46/388505146.db2.gz XFDAFSULEUEGPM-UHFFFAOYSA-N 2 0 247.386 2.259 20 0 BEADRP Cc1csc(C[NH2+][C@H](C)CCC[NH3+])c1 ZINC000344616077 388507759 /nfs/dbraw/zinc/50/77/59/388507759.db2.gz SUGUKDORDRMIOO-SNVBAGLBSA-N 2 0 212.362 2.274 20 0 BEADRP CC(C)=CCC[NH2+][C@@H]1CCCC[C@@H]1C[NH3+] ZINC000397883429 388508940 /nfs/dbraw/zinc/50/89/40/388508940.db2.gz PAENZUPQOJKEAF-CHWSQXEVSA-N 2 0 210.365 2.450 20 0 BEADRP C[C@@H](CCC1CC1)[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000398043904 388515709 /nfs/dbraw/zinc/51/57/09/388515709.db2.gz AESVLYRUNXIUIZ-WCQYABFASA-N 2 0 210.365 2.154 20 0 BEADRP CC[C@H]1CC[C@H](C)[N@@H+]1CC1CC[NH2+]CC1 ZINC000136185201 388525459 /nfs/dbraw/zinc/52/54/59/388525459.db2.gz CZYLIZODMZHZAZ-AAEUAGOBSA-N 2 0 210.365 2.249 20 0 BEADRP Cc1ccc(CN(CC[NH3+])C(C)C)s1 ZINC000261529654 388529323 /nfs/dbraw/zinc/52/93/23/388529323.db2.gz BGNSDFDECRGYPH-UHFFFAOYSA-N 2 0 212.362 2.226 20 0 BEADRP CCc1cc(N2CC[N@@H+](CC)[C@@H](C)C2)cc[nH+]1 ZINC000649311190 388597910 /nfs/dbraw/zinc/59/79/10/388597910.db2.gz WPCQNOYZAXVWGE-LBPRGKRZSA-N 2 0 233.359 2.174 20 0 BEADRP Cc1ncccc1CN(C)[C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000245744282 388602577 /nfs/dbraw/zinc/60/25/77/388602577.db2.gz MLQYUQGDLANSLB-SWLSCSKDSA-N 2 0 247.386 2.305 20 0 BEADRP CC[N@@H+]1CC[C@@H](CN[C@H](C)c2ccoc2)C1 ZINC000245867565 388609036 /nfs/dbraw/zinc/60/90/36/388609036.db2.gz MFJGSSMDRUOYIC-NEPJUHHUSA-N 2 0 222.332 2.272 20 0 BEADRP C[C@@H]1OCC[C@@H]1[NH2+][C@H](CC[NH+](C)C)C(C)(C)C ZINC000245938833 388611704 /nfs/dbraw/zinc/61/17/04/388611704.db2.gz LVABDRWHUDKYFP-RWMBFGLXSA-N 2 0 242.407 2.120 20 0 BEADRP CCCC[NH2+][C@@H]1CC[N@H+](C)[C@@H]2CCC[C@@H]21 ZINC000367621440 388566139 /nfs/dbraw/zinc/56/61/39/388566139.db2.gz SXDORDIQVCYDBG-JHJVBQTASA-N 2 0 210.365 2.249 20 0 BEADRP Cc1cncc([C@@H](C)[NH2+]C[C@H]2CCCN2C)c1 ZINC000184302840 388575892 /nfs/dbraw/zinc/57/58/92/388575892.db2.gz DDZJNWRVHPHAEK-TZMCWYRMSA-N 2 0 233.359 2.135 20 0 BEADRP Cc1cncc([C@@H](C)[NH2+]C[C@@H]2CCCN2C)c1 ZINC000184302801 388576008 /nfs/dbraw/zinc/57/60/08/388576008.db2.gz DDZJNWRVHPHAEK-OCCSQVGLSA-N 2 0 233.359 2.135 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCOC(C)C)[C@@H](C)C1 ZINC000245412692 388577725 /nfs/dbraw/zinc/57/77/25/388577725.db2.gz AVPLBWSBHOEOPB-UONOGXRCSA-N 2 0 242.407 2.074 20 0 BEADRP CC/C=C/CC[N@@H+]1CC[C@H](C[NH+](C)C)C1 ZINC000184553037 388579494 /nfs/dbraw/zinc/57/94/94/388579494.db2.gz RBWKHNLHBQMAJB-URWSZGRFSA-N 2 0 210.365 2.226 20 0 BEADRP CCC[N@H+](C)C[C@@H]1CC[NH+](CCOC(C)C)C1 ZINC000081569609 388584877 /nfs/dbraw/zinc/58/48/77/388584877.db2.gz GHLWFOQMCPAEQR-AWEZNQCLSA-N 2 0 242.407 2.075 20 0 BEADRP COC[C@H](C)C[N@H+](C)CC[C@H]1CCCC[NH+]1C ZINC000247673365 388668634 /nfs/dbraw/zinc/66/86/34/388668634.db2.gz YWCIIBJJNZHWAI-ZIAGYGMSSA-N 2 0 242.407 2.075 20 0 BEADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]C(C)C)[C@@H](C)C1 ZINC000247977827 388671707 /nfs/dbraw/zinc/67/17/07/388671707.db2.gz LNZCAAJHTOVZHE-UONOGXRCSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC[C@H]2CCCCO2)CC[N@@H+]1C ZINC000248415648 388677627 /nfs/dbraw/zinc/67/76/27/388677627.db2.gz OLSMRPWOAZGNDL-MGPQQGTHSA-N 2 0 240.391 2.018 20 0 BEADRP CCCC[C@@H](C)[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000530176687 388621043 /nfs/dbraw/zinc/62/10/43/388621043.db2.gz JWALNLYBTVJDKM-NEPJUHHUSA-N 2 0 210.365 2.439 20 0 BEADRP COCCC1CC[NH+]([C@@H]2CCC[C@@H]([NH3+])C2)CC1 ZINC000530212180 388628005 /nfs/dbraw/zinc/62/80/05/388628005.db2.gz PLINAWMOTKNOGJ-ZIAGYGMSSA-N 2 0 240.391 2.005 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]CC1CC=CC1 ZINC000530215991 388629615 /nfs/dbraw/zinc/62/96/15/388629615.db2.gz LKHRGPUYSXWMOP-STQMWFEESA-N 2 0 208.349 2.060 20 0 BEADRP CC[C@H](C)[C@@H](C)[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000530216356 388629934 /nfs/dbraw/zinc/62/99/34/388629934.db2.gz AXPAGDWQOXAFPT-TUAOUCFPSA-N 2 0 210.365 2.295 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]CC[C@@H]1CC=CCC1 ZINC000530221901 388633282 /nfs/dbraw/zinc/63/32/82/388633282.db2.gz PQXKORLXXZBFEA-JHJVBQTASA-N 2 0 208.349 2.202 20 0 BEADRP CC1(C)CC(C[N@@H+]2CCC[C@]3(CC[NH2+]C3)C2)C1 ZINC000530223922 388634542 /nfs/dbraw/zinc/63/45/42/388634542.db2.gz IXZSQOAVQVNLET-OAHLLOKOSA-N 2 0 236.403 2.498 20 0 BEADRP CC(C)CCC[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000530245387 388639210 /nfs/dbraw/zinc/63/92/10/388639210.db2.gz XFIQVYVQUAUNKD-LBPRGKRZSA-N 2 0 210.365 2.297 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CCCCSC)[C@@H](C)C1 ZINC000223738209 388658334 /nfs/dbraw/zinc/65/83/34/388658334.db2.gz YGWJQASXJPGHBT-QWHCGFSZSA-N 2 0 244.448 2.450 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000252180560 388761353 /nfs/dbraw/zinc/76/13/53/388761353.db2.gz PYOKJFOPPONBTB-UPJWGTAASA-N 2 0 210.365 2.106 20 0 BEADRP CCC(CC)C[NH2+][C@H]1CC[N@H+](C)C[C@H]1C ZINC000252708761 388772282 /nfs/dbraw/zinc/77/22/82/388772282.db2.gz BAQNCAXKNZVKOY-YPMHNXCESA-N 2 0 212.381 2.352 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@H]2CCCSC2)[C@@H](C)C1 ZINC000252715723 388775372 /nfs/dbraw/zinc/77/53/72/388775372.db2.gz WNFLRZDMGZDMGC-AVGNSLFASA-N 2 0 242.432 2.202 20 0 BEADRP CCC(CC)C[N@@H+]1CC[C@H](C)[C@@H](C[NH3+])C1 ZINC000228988291 388778435 /nfs/dbraw/zinc/77/84/35/388778435.db2.gz ISLWBCJGLUPLAK-AAEUAGOBSA-N 2 0 212.381 2.339 20 0 BEADRP CCOC[C@H](C)[NH2+][C@@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000250479420 388790318 /nfs/dbraw/zinc/79/03/18/388790318.db2.gz FMTKTDGDVANNIN-MELADBBJSA-N 2 0 242.407 2.312 20 0 BEADRP CCC(C)(C)C[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000230676184 388829617 /nfs/dbraw/zinc/82/96/17/388829617.db2.gz DLEFOXAYHPBHOM-NWDGAFQWSA-N 2 0 212.381 2.495 20 0 BEADRP CC[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccncc2C)C1 ZINC000556155984 388869280 /nfs/dbraw/zinc/86/92/80/388869280.db2.gz WXAYMNNGGWADEI-AWEZNQCLSA-N 2 0 247.386 2.212 20 0 BEADRP COCCCCC[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000300408601 533233211 /nfs/dbraw/zinc/23/32/11/533233211.db2.gz CAOAORRTKFXVRY-KGLIPLIRSA-N 2 0 240.391 2.020 20 0 BEADRP C(C[N@@H+]1CC[C@@]2(CC[NH2+]C2)C1)C1CCCC1 ZINC000261569371 533365628 /nfs/dbraw/zinc/36/56/28/533365628.db2.gz GFOFSMRPBNKKLV-CQSZACIVSA-N 2 0 222.376 2.252 20 0 BEADRP C[C@@H]([NH2+]CC1C(C)(C)C1(C)C)[C@@H]1CCC[NH2+]1 ZINC000400498317 533365979 /nfs/dbraw/zinc/36/59/79/533365979.db2.gz BKDBCILJGCFVQW-MNOVXSKESA-N 2 0 224.392 2.399 20 0 BEADRP C([NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1)C1CCC1 ZINC000086494313 533370710 /nfs/dbraw/zinc/37/07/10/533370710.db2.gz WFNOYZNPIPKBKS-HZSPNIEDSA-N 2 0 222.376 2.297 20 0 BEADRP C([NH2+][C@H]1CCC[NH2+]CC1)C1CCCCC1 ZINC000168717401 533371725 /nfs/dbraw/zinc/37/17/25/533371725.db2.gz IKIYLCALZSZWAU-ZDUSSCGKSA-N 2 0 210.365 2.298 20 0 BEADRP C[C@@H]([NH2+]CCCC(C)(F)F)[C@H]1CCC[NH2+]1 ZINC000400323994 533376587 /nfs/dbraw/zinc/37/65/87/533376587.db2.gz BYKMRIRSHDUKTF-NXEZZACHSA-N 2 0 220.307 2.152 20 0 BEADRP C[C@@H]([NH2+]C[C@@H](C)CC(F)(F)F)[C@H]1CCC[NH2+]1 ZINC000400473785 533408430 /nfs/dbraw/zinc/40/84/30/533408430.db2.gz YZTJHIQBGDLQDH-IVZWLZJFSA-N 2 0 238.297 2.305 20 0 BEADRP Cc1cc(N2CC[N@@H+]3CCCC[C@H]3C2)cc[nH+]1 ZINC000274311100 132202936 /nfs/dbraw/zinc/20/29/36/132202936.db2.gz AVFJETPMUFKXMH-AWEZNQCLSA-N 2 0 231.343 2.065 20 0 BEADRP Cc1ccc2[nH+]ccc(N3CC[NH+](C)CC3)c2c1 ZINC000302153858 132261020 /nfs/dbraw/zinc/26/10/20/132261020.db2.gz LQBJPBBVYVHPBJ-UHFFFAOYSA-N 2 0 241.338 2.295 20 0 BEADRP Cc1cc(N2CCC[C@@H]([NH+]3CCCC3)C2)cc[nH+]1 ZINC000302217138 132261938 /nfs/dbraw/zinc/26/19/38/132261938.db2.gz JMJQFFFGTAYMAI-OAHLLOKOSA-N 2 0 245.370 2.455 20 0 BEADRP C[C@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)C1CC1 ZINC000035732801 132339117 /nfs/dbraw/zinc/33/91/17/132339117.db2.gz MFSAIKYPUSSUDQ-LBPRGKRZSA-N 2 0 245.370 2.439 20 0 BEADRP Cc1ccc(C[NH2+]CC2(C)CC[NH+](C)CC2)nc1 ZINC000227328412 133539305 /nfs/dbraw/zinc/53/93/05/133539305.db2.gz YVOQBYOVIZLALA-UHFFFAOYSA-N 2 0 247.386 2.212 20 0 BEADRP C[C@H]1CC[C@@]2(CC[N@H+](CC3CC[NH2+]CC3)C2)C1 ZINC000336054444 134065877 /nfs/dbraw/zinc/06/58/77/134065877.db2.gz AURFSMYCRYCJHB-DZGCQCFKSA-N 2 0 236.403 2.498 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@H](C)[C@H](C[NH3+])C2)s1 ZINC000167596483 134118755 /nfs/dbraw/zinc/11/87/55/134118755.db2.gz CNHUWTXKMZMZPT-CMPLNLGQSA-N 2 0 238.400 2.473 20 0 BEADRP C[C@@H]([NH3+])[C@H]1CC[N@H+](C[C@H]2CCC[C@@H](C)C2)C1 ZINC000168510419 134225065 /nfs/dbraw/zinc/22/50/65/134225065.db2.gz BBLMGAFLDVWLFC-MQYQWHSLSA-N 2 0 224.392 2.482 20 0 BEADRP C[C@H](C[N@@H+]1CCC[C@@H](C[NH3+])C1)c1ccccc1 ZINC000217529700 134248425 /nfs/dbraw/zinc/24/84/25/134248425.db2.gz QIKLPOPRTBEGTO-KGLIPLIRSA-N 2 0 232.371 2.461 20 0 BEADRP C[NH2+]C[C@H]1CCC[N@@H+]1CC1CCC(C)CC1 ZINC000169225440 134250057 /nfs/dbraw/zinc/25/00/57/134250057.db2.gz BCIBQSPLVWXDLI-JXQTWKCFSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)OCCC[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@@H]1C ZINC000217940446 134250966 /nfs/dbraw/zinc/25/09/66/134250966.db2.gz IZZXJKQGTQMQAL-MELADBBJSA-N 2 0 242.407 2.120 20 0 BEADRP C[C@@H]1CCC[C@H](C[N@@H+]2C[C@@H]3CCC[NH2+][C@@H]3C2)C1 ZINC000220396980 134306443 /nfs/dbraw/zinc/30/64/43/134306443.db2.gz GXQFRDSJRVWWGQ-CBBWQLFWSA-N 2 0 236.403 2.497 20 0 BEADRP CCC[C@H]1CCC[N@H+](CC2CC[NH2+]CC2)C1 ZINC000178975668 134314233 /nfs/dbraw/zinc/31/42/33/134314233.db2.gz MIBSUYYMMUNVBV-ZDUSSCGKSA-N 2 0 224.392 2.498 20 0 BEADRP COc1ccc(C)cc1C[NH2+]C[C@@H]1CCCN1C ZINC000221148521 134317136 /nfs/dbraw/zinc/31/71/36/134317136.db2.gz DDRSFKVNRRHGKQ-AWEZNQCLSA-N 2 0 248.370 2.187 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+]C1CC(OC)C1 ZINC000221253085 134322622 /nfs/dbraw/zinc/32/26/22/134322622.db2.gz ZOGUNUCGFJMPMO-HSBZDZAISA-N 2 0 242.407 2.264 20 0 BEADRP CO[C@H](C)[C@@H](C)[NH2+]CCC[N@@H+]1CCCC[C@@H]1C ZINC000221817688 134328053 /nfs/dbraw/zinc/32/80/53/134328053.db2.gz IJROWCHYEGUBNK-BFHYXJOUSA-N 2 0 242.407 2.264 20 0 BEADRP C[C@@H]1CN(C)CC[C@@H]1[NH2+][C@@H]1CC=CCC1 ZINC000222092481 134329099 /nfs/dbraw/zinc/32/90/99/134329099.db2.gz JBPTWSKNXNWMFB-UPJWGTAASA-N 2 0 208.349 2.025 20 0 BEADRP CCC[C@H](CC)[NH2+][C@@H](C)CC[NH+](C)C ZINC000224613906 134349446 /nfs/dbraw/zinc/34/94/46/134349446.db2.gz WDWHDYDSAFOFPF-RYUDHWBXSA-N 2 0 200.370 2.495 20 0 BEADRP CSCCC[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@@H]1C ZINC000225980139 134358121 /nfs/dbraw/zinc/35/81/21/134358121.db2.gz IFWHOFPJBVBQDS-QJPTWQEYSA-N 2 0 230.421 2.058 20 0 BEADRP CC[C@H](Cc1ccccc1)[N@H+](C)CCC[NH3+] ZINC000227741968 134392061 /nfs/dbraw/zinc/39/20/61/134392061.db2.gz UUTKJNGQGLJZHU-CQSZACIVSA-N 2 0 220.360 2.288 20 0 BEADRP CC[C@@H]1CCCC[C@@H]1[NH2+][C@@H](CCC[NH3+])COC ZINC000233907428 134571086 /nfs/dbraw/zinc/57/10/86/134571086.db2.gz QSVJVBPQHAWNKJ-RDBSUJKOSA-N 2 0 242.407 2.299 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+]CC(C)(C)C(C)C ZINC000234778471 134583533 /nfs/dbraw/zinc/58/35/33/134583533.db2.gz RNGNJAVMQUNZJL-LBPRGKRZSA-N 2 0 230.396 2.012 20 0 BEADRP CC[C@H](COC)[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000132126571 134641518 /nfs/dbraw/zinc/64/15/18/134641518.db2.gz IWTSGAQXHPDFOA-DDTOSNHZSA-N 2 0 234.343 2.146 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)CC[NH+](C)C)C1CCCC1 ZINC000054081237 134756127 /nfs/dbraw/zinc/75/61/27/134756127.db2.gz PNRVXCNJSRGDBR-NWDGAFQWSA-N 2 0 212.381 2.495 20 0 BEADRP CC[N@@H+]1CCC[C@H]1CNc1cc[nH+]cc1C ZINC000070046754 134907158 /nfs/dbraw/zinc/90/71/58/134907158.db2.gz HMNLWQLWPMHUQS-LBPRGKRZSA-N 2 0 219.332 2.286 20 0 BEADRP C[C@H]1CCC[C@@H]1[NH2+]CC1CC[NH+](C)CC1 ZINC000070828347 135013894 /nfs/dbraw/zinc/01/38/94/135013894.db2.gz HTPNMBAWTQQIKJ-AAEUAGOBSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]C[C@H]2CCC[NH2+]C2)C1 ZINC000251733696 135075447 /nfs/dbraw/zinc/07/54/47/135075447.db2.gz JACKSXYTNGWUCF-FRRDWIJNSA-N 2 0 210.365 2.154 20 0 BEADRP COc1cccc([C@H](C)[N@@H+]2CC[C@@H]([NH3+])[C@H](C)C2)c1 ZINC000251889673 135080750 /nfs/dbraw/zinc/08/07/50/135080750.db2.gz VKZRCAVKEOWNQG-TYNCELHUSA-N 2 0 248.370 2.425 20 0 BEADRP CC[C@H](C)C[N@H+](C)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000252018431 135082945 /nfs/dbraw/zinc/08/29/45/135082945.db2.gz WYOVUARAIRKMQA-ACJTYDJDSA-N 2 0 210.365 2.247 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C2CC[NH2+]CC2)C[C@H]1C ZINC000251976524 135082966 /nfs/dbraw/zinc/08/29/66/135082966.db2.gz YLIOJJZTNSRMGA-NQBHXWOUSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1CCCC[C@H]1[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000252124097 135084890 /nfs/dbraw/zinc/08/48/90/135084890.db2.gz JUXZVNCDYBRTCN-FRRDWIJNSA-N 2 0 210.365 2.154 20 0 BEADRP CCC(CC)[N@H+](CCOCC[NH3+])CC(C)C ZINC000086453693 135085244 /nfs/dbraw/zinc/08/52/44/135085244.db2.gz ALGNIONGKBJKIN-UHFFFAOYSA-N 2 0 230.396 2.108 20 0 BEADRP CC[C@H](C)C[N@H+](CC)C[C@]1(C)CC[NH2+]C1 ZINC000086440224 135085806 /nfs/dbraw/zinc/08/58/06/135085806.db2.gz YSMFLGKSOAHNRM-QWHCGFSZSA-N 2 0 212.381 2.354 20 0 BEADRP C[C@@H]1CCC[C@H]1[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000252207442 135086929 /nfs/dbraw/zinc/08/69/29/135086929.db2.gz VKJTUBXRAAFNRQ-YRGRVCCFSA-N 2 0 222.376 2.249 20 0 BEADRP C1CC1[NH2+][C@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1 ZINC000086499876 135087653 /nfs/dbraw/zinc/08/76/53/135087653.db2.gz ZKIHBVNAKCCARB-XQQFMLRXSA-N 2 0 208.349 2.049 20 0 BEADRP C[C@H](C[C@H]1CCCCC[NH2+]1)[NH2+]CC1CC1 ZINC000086500510 135088331 /nfs/dbraw/zinc/08/83/31/135088331.db2.gz CHHJNZBQEZVYRN-DGCLKSJQSA-N 2 0 210.365 2.297 20 0 BEADRP Cc1ccsc1C[N@H+](C)CC1CC[NH2+]CC1 ZINC000086701683 135094198 /nfs/dbraw/zinc/09/41/98/135094198.db2.gz QVXOVMJXWVAYQQ-UHFFFAOYSA-N 2 0 238.400 2.488 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1Nc1ccncc1Cl ZINC000086840121 135098582 /nfs/dbraw/zinc/09/85/82/135098582.db2.gz UDZUFQMNSZBVSU-WPRPVWTQSA-N 2 0 225.723 2.274 20 0 BEADRP CC1CC([NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)C1 ZINC000252733124 135105113 /nfs/dbraw/zinc/10/51/13/135105113.db2.gz YACIYMGCMGWNQR-MVKMKZAISA-N 2 0 208.349 2.001 20 0 BEADRP CC[C@H](C)C[N@@H+]1C[C@@H]2CCC[C@H]([NH3+])[C@H]2C1 ZINC000252875211 135115501 /nfs/dbraw/zinc/11/55/01/135115501.db2.gz VOJJTLOLMKSIDR-CYDGBPFRSA-N 2 0 210.365 2.092 20 0 BEADRP COc1cccc(C[NH2+][C@@H]2CC[N@H+](C)C[C@H]2C)c1 ZINC000252895689 135116745 /nfs/dbraw/zinc/11/67/45/135116745.db2.gz ZGYKOAUGHLRSPA-IUODEOHRSA-N 2 0 248.370 2.125 20 0 BEADRP Cc1ccsc1C[NH2+][C@@H]1CCC[C@H]1C[NH3+] ZINC000087308570 135121788 /nfs/dbraw/zinc/12/17/88/135121788.db2.gz HNJBGGSMMDTOLC-WDEREUQCSA-N 2 0 224.373 2.274 20 0 BEADRP C[C@H]1CC[C@H]([NH2+][C@@H]2CCC[C@H]2C[NH3+])CC1 ZINC000253118334 135121835 /nfs/dbraw/zinc/12/18/35/135121835.db2.gz HAOOSEZGYOBHKQ-ZDEQEGDKSA-N 2 0 210.365 2.282 20 0 BEADRP CC1CC([NH2+]C[C@H]2CC[C@H](C[NH3+])CC2)C1 ZINC000253121124 135122142 /nfs/dbraw/zinc/12/21/42/135122142.db2.gz IKROADUVALFAHN-XQSKIALTSA-N 2 0 210.365 2.140 20 0 BEADRP C[C@@H]1CC[N@H+](CCC(C)(C)C)C[C@H]1C[NH3+] ZINC000253246654 135125476 /nfs/dbraw/zinc/12/54/76/135125476.db2.gz SBIHQKKKMLLHFJ-VXGBXAGGSA-N 2 0 212.381 2.339 20 0 BEADRP CC(C)CC[N@@H+]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC000257641471 135137704 /nfs/dbraw/zinc/13/77/04/135137704.db2.gz BAOVWNMCWOKAGQ-ZDUSSCGKSA-N 2 0 210.365 2.108 20 0 BEADRP Cc1ccc(CC[N@@H+]2CC[C@@]3(CC[NH2+]C3)C2)cc1 ZINC000257721869 135141117 /nfs/dbraw/zinc/14/11/17/135141117.db2.gz VSKIHEXWDNBXNH-MRXNPFEDSA-N 2 0 244.382 2.223 20 0 BEADRP CC(C)(C)[C@H]1CCC[N@@H+]1CC1CC[NH2+]CC1 ZINC000257769295 135141531 /nfs/dbraw/zinc/14/15/31/135141531.db2.gz HCZOXZOSZOAYBD-CYBMUJFWSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@H]1CCCC1(C)C ZINC000261530604 135158438 /nfs/dbraw/zinc/15/84/38/135158438.db2.gz CUFCAXXKWVDTMV-WOPDTQHZSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]C[C@H]2CCC[NH2+]2)[C@@H]1C ZINC000261530822 135158903 /nfs/dbraw/zinc/15/89/03/135158903.db2.gz DFSJYTCDCBXGBU-LPWJVIDDSA-N 2 0 210.365 2.153 20 0 BEADRP C([NH2+]C[C@@H]1CCC[NH2+]C1)C1CCCCC1 ZINC000087646350 135161201 /nfs/dbraw/zinc/16/12/01/135161201.db2.gz IDGRFGUOOBFNNR-CYBMUJFWSA-N 2 0 210.365 2.156 20 0 BEADRP C[C@H]1C[N@H+](C[C@H]2CCC[C@@H](C)C2)C[C@@H]1[NH3+] ZINC000261531842 135162026 /nfs/dbraw/zinc/16/20/26/135162026.db2.gz IALMBPNPHJGOON-VOAKCMCISA-N 2 0 210.365 2.092 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2CC[C@H](C)[C@@H](C)C2)CC[NH2+]1 ZINC000261532389 135162447 /nfs/dbraw/zinc/16/24/47/135162447.db2.gz ARXCWQRKBJWRAI-IGQOVBAYSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2CC[C@H](C)[C@H](C)C2)CC[NH2+]1 ZINC000261532390 135162613 /nfs/dbraw/zinc/16/26/13/135162613.db2.gz ARXCWQRKBJWRAI-REWJHTLYSA-N 2 0 224.392 2.352 20 0 BEADRP C1C[NH2+][C@H]([C@@H]2CCC[C@H]2[NH2+][C@H]2CCSC2)C1 ZINC000261532732 135163205 /nfs/dbraw/zinc/16/32/05/135163205.db2.gz DILAQRVEAXCFPM-ZDEQEGDKSA-N 2 0 240.416 2.002 20 0 BEADRP C[C@@H]1CC[C@@H](C[NH2+][C@H]2CCC[NH2+]CC2)C1 ZINC000261533590 135164965 /nfs/dbraw/zinc/16/49/65/135164965.db2.gz KZYQOWMVQMICMK-UPJWGTAASA-N 2 0 210.365 2.154 20 0 BEADRP C[N@H+](C[C@@H]1CCC[NH2+]C1)[C@H]1CCC(C)(C)C1 ZINC000261534481 135166998 /nfs/dbraw/zinc/16/69/98/135166998.db2.gz RDPKKIHJHGFTRL-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP CC1(C)CC[C@H]([NH2+]C2CCC([NH3+])CC2)C1 ZINC000087771634 135167135 /nfs/dbraw/zinc/16/71/35/135167135.db2.gz MBYYORGZCFCHMA-MCIGGMRASA-N 2 0 210.365 2.425 20 0 BEADRP C[C@@H]1C[C@H](C)C[N@@H+](C[C@@H]2CC[NH2+][C@H](C)C2)C1 ZINC000261534737 135167541 /nfs/dbraw/zinc/16/75/41/135167541.db2.gz TYIMXBXKLXKSEE-XJFOESAGSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2CCS[C@H](C)[C@H]2C)CC[NH2+]1 ZINC000261534770 135168007 /nfs/dbraw/zinc/16/80/07/135168007.db2.gz UCIVMCQTDWUCME-FDYHWXHSSA-N 2 0 242.432 2.200 20 0 BEADRP C[C@H]1[C@H]([NH3+])CC[N@@H+]1CC1CCCCCC1 ZINC000261534856 135168406 /nfs/dbraw/zinc/16/84/06/135168406.db2.gz NFHFCLSXMCWUMF-WCQYABFASA-N 2 0 210.365 2.378 20 0 BEADRP C[C@H]1[C@@H]([NH3+])CC[N@@H+]1CC1CCCCCC1 ZINC000261534854 135168473 /nfs/dbraw/zinc/16/84/73/135168473.db2.gz NFHFCLSXMCWUMF-AAEUAGOBSA-N 2 0 210.365 2.378 20 0 BEADRP [NH3+]C[C@H]1CCC[N@H+](CCC2CCCC2)C1 ZINC000261535801 135170708 /nfs/dbraw/zinc/17/07/08/135170708.db2.gz PGAKKJXSOOJLNE-CYBMUJFWSA-N 2 0 210.365 2.237 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+][C@H]2CCC[C@H]2C[NH3+])C1 ZINC000261536502 135171916 /nfs/dbraw/zinc/17/19/16/135171916.db2.gz RZEGZUTXLGLUGV-VOAKCMCISA-N 2 0 210.365 2.140 20 0 BEADRP C[NH2+]C[C@H]1CCC[N@@H+]1CCC1CCCC1 ZINC000261536627 135172120 /nfs/dbraw/zinc/17/21/20/135172120.db2.gz SFGRKPPZYCEDBS-CYBMUJFWSA-N 2 0 210.365 2.251 20 0 BEADRP CC(C)(C)CC[N@@H+]1CC[C@@H]2[NH2+]CC[C@@H]2C1 ZINC000261537102 135172801 /nfs/dbraw/zinc/17/28/01/135172801.db2.gz UWSOULUHYKMPJQ-NEPJUHHUSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@@H]2CCC[NH2+]2)C[C@H]1C ZINC000261537706 135174939 /nfs/dbraw/zinc/17/49/39/135174939.db2.gz WFELSUDSWVFUSN-NDBYEHHHSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)SCC[NH2+][C@@H]1CCCC[C@H]1C[NH3+] ZINC000261538719 135176419 /nfs/dbraw/zinc/17/64/19/135176419.db2.gz ZBJRIAHAIQSIKJ-NWDGAFQWSA-N 2 0 230.421 2.235 20 0 BEADRP C[C@H]1C[N@H+](CC2CCCCCC2)C[C@H]1[NH3+] ZINC000261538931 135176977 /nfs/dbraw/zinc/17/69/77/135176977.db2.gz ZVRBWVXUAJALGW-WCQYABFASA-N 2 0 210.365 2.236 20 0 BEADRP C[C@@H]1C[N@H+](CC2CCCCCC2)C[C@H]1[NH3+] ZINC000261538930 135177264 /nfs/dbraw/zinc/17/72/64/135177264.db2.gz ZVRBWVXUAJALGW-DGCLKSJQSA-N 2 0 210.365 2.236 20 0 BEADRP CC[C@@H]1[C@@H](C)CC[N@@H+]1C[C@]1(C)CC[NH2+]C1 ZINC000261539802 135178943 /nfs/dbraw/zinc/17/89/43/135178943.db2.gz DEPZGYNZQVWNCI-YNEHKIRRSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+][C@@H]1CCc2ccccc21 ZINC000261540969 135179938 /nfs/dbraw/zinc/17/99/38/135179938.db2.gz ASTKXPSEOHVVSF-KCPJHIHWSA-N 2 0 230.355 2.262 20 0 BEADRP C(C[N@@H+]1CC[C@H]2C[NH2+]C[C@@H]2C1)C1CCCCC1 ZINC000261542162 135182692 /nfs/dbraw/zinc/18/26/92/135182692.db2.gz BWNRPYWBTSMEOR-LSDHHAIUSA-N 2 0 236.403 2.498 20 0 BEADRP C[C@H]1C[N@H+](CC2CC[NH2+]CC2)C(C)(C)C1 ZINC000261548690 135187474 /nfs/dbraw/zinc/18/74/74/135187474.db2.gz NVYXZAZJANVJMD-LLVKDONJSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]1C[N@H+](C[C@@H]2CCC[NH2+]C2)C(C)(C)C1 ZINC000261549145 135187591 /nfs/dbraw/zinc/18/75/91/135187591.db2.gz OGHKUTZUFXUHPX-VXGBXAGGSA-N 2 0 210.365 2.106 20 0 BEADRP Cc1ncsc1C[N@@H+]1CCCC[C@H]1CC[NH3+] ZINC000084149530 135188008 /nfs/dbraw/zinc/18/80/08/135188008.db2.gz GGRNWYUNUNONBA-NSHDSACASA-N 2 0 239.388 2.155 20 0 BEADRP CCC(C)(C)CC[N@H+](C)C1CC[NH2+]CC1 ZINC000261550590 135188885 /nfs/dbraw/zinc/18/88/85/135188885.db2.gz PPQRFCXCDFBLOU-UHFFFAOYSA-N 2 0 212.381 2.497 20 0 BEADRP CC1CCC(C[N@@H+]2C[C@@H]3CC[C@H]([NH3+])[C@H]3C2)CC1 ZINC000261550948 135190329 /nfs/dbraw/zinc/19/03/29/135190329.db2.gz LQDLKCGVTBUCIF-HGSUQPQSSA-N 2 0 236.403 2.482 20 0 BEADRP C[C@@H]1C[C@@H](C[N@H+]2C[C@@H]3CCCC[C@@H]3C2)CC[NH2+]1 ZINC000261550985 135190409 /nfs/dbraw/zinc/19/04/09/135190409.db2.gz LRQUZASCMFDBTJ-BARDWOONSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]1CC[C@H]([N@H+](C)C[C@@]2(C)CC[NH2+]C2)C1 ZINC000261552338 135191128 /nfs/dbraw/zinc/19/11/28/135191128.db2.gz RDFBAFBXKNMERM-AGIUHOORSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1CC[C@H]([N@H+](C)C[C@]2(C)CC[NH2+]C2)C1 ZINC000261552339 135191239 /nfs/dbraw/zinc/19/12/39/135191239.db2.gz RDFBAFBXKNMERM-FRRDWIJNSA-N 2 0 210.365 2.106 20 0 BEADRP Cc1cccc(C[N@@H+]2CC[C@@H]3[NH2+]CC[C@H]3C2)c1C ZINC000261553060 135191945 /nfs/dbraw/zinc/19/19/45/135191945.db2.gz ABOOVRFOPLPRTJ-HOTGVXAUSA-N 2 0 244.382 2.487 20 0 BEADRP C(C1CC[NH2+]CC1)[N@@H+]1CCCC12CCC2 ZINC000261552853 135192246 /nfs/dbraw/zinc/19/22/46/135192246.db2.gz RYCGRFDMNUQVOL-UHFFFAOYSA-N 2 0 208.349 2.005 20 0 BEADRP Cc1ncsc1C[NH2+][C@H]1CCCC[C@H]1C[NH3+] ZINC000084216808 135192610 /nfs/dbraw/zinc/19/26/10/135192610.db2.gz NTNYQFDCGIOWMU-QWRGUYRKSA-N 2 0 239.388 2.059 20 0 BEADRP C[C@H](C[N@@H+]1CC[C@@](C)(C[NH3+])C1)c1ccccc1 ZINC000261553592 135192862 /nfs/dbraw/zinc/19/28/62/135192862.db2.gz OBNHSEOTJIGQMB-HIFRSBDPSA-N 2 0 232.371 2.461 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]CCc1cccs1 ZINC000084217775 135193167 /nfs/dbraw/zinc/19/31/67/135193167.db2.gz DZMLAVGRKJTVIB-JQWIXIFHSA-N 2 0 224.373 2.008 20 0 BEADRP C[C@@H]1CC[C@H](C)[N@H+]1CCC1CC[NH2+]CC1 ZINC000261554130 135193743 /nfs/dbraw/zinc/19/37/43/135193743.db2.gz TXQNZAIQLMWEPL-TXEJJXNPSA-N 2 0 210.365 2.249 20 0 BEADRP Cc1ncccc1C[N@@H+]1CCCC[C@H]1CC[NH3+] ZINC000261555231 135194969 /nfs/dbraw/zinc/19/49/69/135194969.db2.gz PNPYHRSLIVLPQN-AWEZNQCLSA-N 2 0 233.359 2.093 20 0 BEADRP CC[N@@H+](Cc1ccccn1)C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000261555996 135195943 /nfs/dbraw/zinc/19/59/43/135195943.db2.gz BTXUGWRIYUOHEO-ZIAGYGMSSA-N 2 0 247.386 2.292 20 0 BEADRP Cc1ccc(C)c(C[N@@H+]2C[C@@H]3CC[C@H]([NH3+])[C@H]3C2)c1 ZINC000261556907 135197107 /nfs/dbraw/zinc/19/71/07/135197107.db2.gz CFRTWQJWHXLSGL-BPUTZDHNSA-N 2 0 244.382 2.473 20 0 BEADRP C[C@H]([NH3+])CN(C)Cc1ccccc1C(F)(F)F ZINC000261558440 135199363 /nfs/dbraw/zinc/19/93/63/135199363.db2.gz SKDNKGPULNYEMB-VIFPVBQESA-N 2 0 246.276 2.484 20 0 BEADRP CCC1(C[NH2+][C@H]2CCC[C@H]([NH3+])C2)CCOCC1 ZINC000261560189 135200789 /nfs/dbraw/zinc/20/07/89/135200789.db2.gz UJEIPOZHPSIFEM-STQMWFEESA-N 2 0 240.391 2.053 20 0 BEADRP CCS[C@@H]1CC[C@@H]([N@H+](C)CC(C)(C)[NH3+])C1 ZINC000261560080 135201085 /nfs/dbraw/zinc/20/10/85/135201085.db2.gz ZNJAYPDIJYZKSN-GHMZBOCLSA-N 2 0 230.421 2.330 20 0 BEADRP C[C@@H]1CCC[C@H](C[N@@H+]2CC[C@@]3(CC[NH2+]C3)C2)C1 ZINC000261560151 135201134 /nfs/dbraw/zinc/20/11/34/135201134.db2.gz UFZXTCGQTKOVBL-QLFBSQMISA-N 2 0 236.403 2.498 20 0 BEADRP Cc1cccc(C[N@@H+]2CC[C@H]3C[NH2+]C[C@@H]3C2)c1 ZINC000261561385 135202867 /nfs/dbraw/zinc/20/28/67/135202867.db2.gz VHFYVHGZICLGLM-LSDHHAIUSA-N 2 0 230.355 2.036 20 0 BEADRP CC(C)C1(C)CC[NH+](CC(C)(C)[NH3+])CC1 ZINC000261562904 135204578 /nfs/dbraw/zinc/20/45/78/135204578.db2.gz BSDAKJZGBPAULS-UHFFFAOYSA-N 2 0 212.381 2.482 20 0 BEADRP C[C@H](C[NH3+])N(C)Cc1ccccc1C(F)(F)F ZINC000261563366 135205036 /nfs/dbraw/zinc/20/50/36/135205036.db2.gz WZKIMYUHEOLYHZ-SECBINFHSA-N 2 0 246.276 2.484 20 0 BEADRP C[C@H](c1ccccc1)[N@@H+]1C[C@@H]2CC[C@@H]([NH3+])[C@H]2C1 ZINC000261562948 135205378 /nfs/dbraw/zinc/20/53/78/135205378.db2.gz WSZJTFIYZKVUHL-UQOMUDLDSA-N 2 0 230.355 2.417 20 0 BEADRP C[C@H]1C[NH2+]CC[C@H]1[NH2+]C1C2CC3CC(C2)CC1C3 ZINC000261565144 135206969 /nfs/dbraw/zinc/20/69/69/135206969.db2.gz HQTBZGOZCRAUJH-IGRMKNIWSA-N 2 0 248.414 2.399 20 0 BEADRP C[C@@H]([NH3+])[C@H](C)[NH2+]C1CCC(C(F)(F)F)CC1 ZINC000261568937 135211361 /nfs/dbraw/zinc/21/13/61/135211361.db2.gz FZRAZBAQRLAIOS-XHHQTKHESA-N 2 0 238.297 2.433 20 0 BEADRP Cc1cccc(OCC[N@@H+]2CC[C@](C)(C[NH3+])C2)c1 ZINC000261569773 135212249 /nfs/dbraw/zinc/21/22/49/135212249.db2.gz KAKIRISKHGLNAC-OAHLLOKOSA-N 2 0 248.370 2.045 20 0 BEADRP CC[C@H]1C[N@H+](CC[C@@H]2CCC[NH2+]C2)CCS1 ZINC000164179408 135214296 /nfs/dbraw/zinc/21/42/96/135214296.db2.gz AOSMSEJPAJJCTA-STQMWFEESA-N 2 0 242.432 2.204 20 0 BEADRP Cc1ccc(C)c(C[N@@H+]2CC[C@@H]3[NH2+]CC[C@H]3C2)c1 ZINC000261574272 135215694 /nfs/dbraw/zinc/21/56/94/135215694.db2.gz MQROYXJMEJMJKV-HOCLYGCPSA-N 2 0 244.382 2.487 20 0 BEADRP Cc1ccsc1C[N@@H+]1C[C@@H]2CC[C@@H]([NH3+])[C@H]2C1 ZINC000261575054 135216659 /nfs/dbraw/zinc/21/66/59/135216659.db2.gz JOKGIOXCQFFCGS-SDDRHHMPSA-N 2 0 236.384 2.226 20 0 BEADRP Cc1ccsc1C[N@@H+]1C[C@@H]2CC[C@H]([NH3+])[C@@H]2C1 ZINC000261575057 135216801 /nfs/dbraw/zinc/21/68/01/135216801.db2.gz JOKGIOXCQFFCGS-TUAOUCFPSA-N 2 0 236.384 2.226 20 0 BEADRP COCC(C)(C)C[NH2+][C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000261576190 135217902 /nfs/dbraw/zinc/21/79/02/135217902.db2.gz NMJPTVXILSGSIB-KBPBESRZSA-N 2 0 248.370 2.393 20 0 BEADRP C[N@H+](CC[C@@H]1CC[NH2+]C1)CC1CCCC1 ZINC000084385916 135217986 /nfs/dbraw/zinc/21/79/86/135217986.db2.gz MTLUKQHIZMXGGE-LBPRGKRZSA-N 2 0 210.365 2.108 20 0 BEADRP CC1(C[N@@H+]2CCC3(C2)CC[NH2+]CC3)CCC1 ZINC000261579596 135220565 /nfs/dbraw/zinc/22/05/65/135220565.db2.gz MJPSIXDFZFDUOD-UHFFFAOYSA-N 2 0 222.376 2.252 20 0 BEADRP C[C@H](C[N@@H+]1CC[C@H]2C[NH2+]C[C@@H]2C1)c1ccccc1 ZINC000261581336 135222207 /nfs/dbraw/zinc/22/22/07/135222207.db2.gz QPBQNOXPLLRNRL-VNQPRFMTSA-N 2 0 244.382 2.331 20 0 BEADRP CCOc1ccc(C[N@@H+]2CC[C@](C)(C[NH3+])C2)cc1 ZINC000261583108 135223911 /nfs/dbraw/zinc/22/39/11/135223911.db2.gz RNQNHBDEPXEVGV-OAHLLOKOSA-N 2 0 248.370 2.256 20 0 BEADRP CCC[C@H](C)C[N@@H+]1C[C@@H]2CCC[C@H]([NH3+])[C@@H]2C1 ZINC000164372775 135224626 /nfs/dbraw/zinc/22/46/26/135224626.db2.gz GIJVFFVYVVHYIS-FQUUOJAGSA-N 2 0 224.392 2.482 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]CC[C@H]2CCOC2)c2ccccc21 ZINC000261585574 135226895 /nfs/dbraw/zinc/22/68/95/135226895.db2.gz TWKVMURXPCOGGI-GLQYFDAESA-N 2 0 246.354 2.147 20 0 BEADRP Cc1[nH+]ccc(N2CC[C@@H]([C@H](C)[NH3+])C2)c1Cl ZINC000261588378 135229241 /nfs/dbraw/zinc/22/92/41/135229241.db2.gz SIFOWTUYLVMLJE-WCBMZHEXSA-N 2 0 239.750 2.217 20 0 BEADRP Cc1[nH+]ccc(N2CC[C@H]([C@H](C)[NH3+])C2)c1Cl ZINC000261588382 135229354 /nfs/dbraw/zinc/22/93/54/135229354.db2.gz SIFOWTUYLVMLJE-WPRPVWTQSA-N 2 0 239.750 2.217 20 0 BEADRP [NH3+][C@@H]1CC[C@@H]2C[N@H+](CCC3CCCC3)C[C@H]12 ZINC000261589701 135230462 /nfs/dbraw/zinc/23/04/62/135230462.db2.gz UCSIQIRFKKDSBG-HZSPNIEDSA-N 2 0 222.376 2.236 20 0 BEADRP C[C@@H]1C[N@H+](CC(C)(C)[NH3+])[C@@H]2CCCC[C@H]21 ZINC000261590900 135230902 /nfs/dbraw/zinc/23/09/02/135230902.db2.gz UVGLJFXHTIZQTK-GRYCIOLGSA-N 2 0 210.365 2.234 20 0 BEADRP Cc1[nH+]ccc(N2C[C@@H](C[NH3+])C[C@H]2C)c1Cl ZINC000261591998 135232502 /nfs/dbraw/zinc/23/25/02/135232502.db2.gz VQDOZLMQYSZORV-PSASIEDQSA-N 2 0 239.750 2.217 20 0 BEADRP Cc1cccc(C)c1C[N@@H+]1CC[C@H]2[NH2+]CC[C@H]2C1 ZINC000261593518 135234102 /nfs/dbraw/zinc/23/41/02/135234102.db2.gz ZFNACOHVQZINRO-GOEBONIOSA-N 2 0 244.382 2.487 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@H]3C[NH2+]C[C@H]3C2)s1 ZINC000261597505 135237184 /nfs/dbraw/zinc/23/71/84/135237184.db2.gz ZDOLFHVFOUEKDZ-RYUDHWBXSA-N 2 0 236.384 2.098 20 0 BEADRP CCC(C)(C)CC[N@@H+]1C[C@H](C[NH3+])C[C@@H]1C ZINC000261546686 135239171 /nfs/dbraw/zinc/23/91/71/135239171.db2.gz LFOTVAFIHORERU-RYUDHWBXSA-N 2 0 212.381 2.482 20 0 BEADRP CC[C@@H]1[C@H](C)CC[N@@H+]1CC1CC[NH2+]CC1 ZINC000261546632 135239188 /nfs/dbraw/zinc/23/91/88/135239188.db2.gz LCGFSXSDRPPVDA-DGCLKSJQSA-N 2 0 210.365 2.106 20 0 BEADRP CCOCC(C)(C)C[NH2+][C@H]1CCCC[C@@H]1C[NH3+] ZINC000261548069 135241863 /nfs/dbraw/zinc/24/18/63/135241863.db2.gz JBCCGAUFHWRMHZ-OLZOCXBDSA-N 2 0 242.407 2.156 20 0 BEADRP CC[C@@H]1C[C@@H](C)C[N@@H+]1C[C@]1(C)CC[NH2+]C1 ZINC000261548187 135242058 /nfs/dbraw/zinc/24/20/58/135242058.db2.gz NHHZWWZUPAFXHY-JHJVBQTASA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@@H]1C[C@H](C)C[N@@H+]1C[C@@]1(C)CC[NH2+]C1 ZINC000261548189 135242119 /nfs/dbraw/zinc/24/21/19/135242119.db2.gz NHHZWWZUPAFXHY-XQQFMLRXSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H](C[N@@H+]1CC[C@H](C[NH3+])C1)c1ccc(F)cc1 ZINC000261652302 135242832 /nfs/dbraw/zinc/24/28/32/135242832.db2.gz BCXWNZFTRRUMCB-NWDGAFQWSA-N 2 0 236.334 2.210 20 0 BEADRP [NH3+]C[C@@H]1C[N@H+](CC2CC2)C[C@H]1c1ccccc1 ZINC000261713578 135247617 /nfs/dbraw/zinc/24/76/17/135247617.db2.gz MTDYJSZWISGLKZ-CABCVRRESA-N 2 0 230.355 2.071 20 0 BEADRP C[C@@H]1CC[C@@]2(CC[N@H+](C[C@@]3(C)CC[NH2+]C3)C2)C1 ZINC000261742114 135249216 /nfs/dbraw/zinc/24/92/16/135249216.db2.gz IPYBQJWJXJRRKF-QLFBSQMISA-N 2 0 236.403 2.498 20 0 BEADRP CCC[C@H]1CCC[N@H+](C[C@]2(C)CC[NH2+]C2)C1 ZINC000261758071 135250391 /nfs/dbraw/zinc/25/03/91/135250391.db2.gz KXDZCGZFQXKGMY-UONOGXRCSA-N 2 0 224.392 2.498 20 0 BEADRP CCc1cccc(F)c1CN1C[C@H]2C[NH2+]C[C@H]2C1 ZINC000261770336 135251714 /nfs/dbraw/zinc/25/17/14/135251714.db2.gz DQAQURHUZIJRFF-BETUJISGSA-N 2 0 248.345 2.039 20 0 BEADRP COc1cc(C[N@@H+]2C[C@@H](C[NH3+])C[C@@H]2C)ccc1C ZINC000261787630 135252631 /nfs/dbraw/zinc/25/26/31/135252631.db2.gz FYYJGFKQUCXKPM-GXTWGEPZSA-N 2 0 248.370 2.173 20 0 BEADRP C[C@H]1CC[N@H+](C[C@H]2CCC[NH2+]C2)CC1(C)C ZINC000261813357 135255306 /nfs/dbraw/zinc/25/53/06/135255306.db2.gz HVAWEDALHFXRML-STQMWFEESA-N 2 0 224.392 2.354 20 0 BEADRP C[C@]1(C[NH3+])CC[N@@H+]([C@@H]2CCc3ccc(F)cc32)C1 ZINC000261815868 135255369 /nfs/dbraw/zinc/25/53/69/135255369.db2.gz PCMFQBMUHYHXNT-HUUCEWRRSA-N 2 0 248.345 2.484 20 0 BEADRP C[C@@]1(C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)CC[NH2+]C1 ZINC000261878425 135259092 /nfs/dbraw/zinc/25/90/92/135259092.db2.gz QJZOMRMSMUUOLH-ZIAGYGMSSA-N 2 0 233.359 2.151 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@]2(C)CC[NH2+]C2)CC12CCC2 ZINC000261917406 135262630 /nfs/dbraw/zinc/26/26/30/135262630.db2.gz ZUHBSANXONROJQ-ZIAGYGMSSA-N 2 0 236.403 2.498 20 0 BEADRP Cc1ccc(C[N@@H+](C)C[C@]2(C)CC[NH2+]C2)s1 ZINC000261953954 135265985 /nfs/dbraw/zinc/26/59/85/135265985.db2.gz GJOWFQNWBMPHSI-CYBMUJFWSA-N 2 0 238.400 2.488 20 0 BEADRP CC[C@@H]1CCC[C@H](C[N@@H+]2C[C@H](C)[C@H]([NH3+])C2)C1 ZINC000261961717 135267217 /nfs/dbraw/zinc/26/72/17/135267217.db2.gz HJGBMLNDKDXVHO-RFQIPJPRSA-N 2 0 224.392 2.482 20 0 BEADRP CC[N@H+](Cc1cnccc1C)[C@@H]1CCC[NH2+]CC1 ZINC000261997006 135270283 /nfs/dbraw/zinc/27/02/83/135270283.db2.gz SXUNKAKEWLPHEY-OAHLLOKOSA-N 2 0 247.386 2.354 20 0 BEADRP CC[NH+](CC)CCOCC[NH2+][C@H]1CCC1(C)C ZINC000342574583 135290941 /nfs/dbraw/zinc/29/09/41/135290941.db2.gz ISFLQZWAUVDGTE-ZDUSSCGKSA-N 2 0 242.407 2.123 20 0 BEADRP CC[C@@H](COC)[NH2+]C[C@H](C)C[NH+]1CCCCC1 ZINC000079713146 135355303 /nfs/dbraw/zinc/35/53/03/135355303.db2.gz YLBGBELYZLKZCT-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP Cc1cccc(C[NH2+][C@H]2CCC[C@@H]2C[NH3+])c1 ZINC000084218109 135467776 /nfs/dbraw/zinc/46/77/76/135467776.db2.gz AVZBYRCZTWTJEO-KGLIPLIRSA-N 2 0 218.344 2.212 20 0 BEADRP CC1(C)CC[NH+](CC[C@@H]2CC[NH2+]C2)CC1 ZINC000084385778 135470796 /nfs/dbraw/zinc/47/07/96/135470796.db2.gz LCRCBIIQNVQUBG-LBPRGKRZSA-N 2 0 210.365 2.108 20 0 BEADRP CC1CCC([NH2+][C@H]2CCC[C@@H]([NH3+])C2)CC1 ZINC000086401865 135491205 /nfs/dbraw/zinc/49/12/05/135491205.db2.gz GUBGSODFOXBQMU-KPFVRQRISA-N 2 0 210.365 2.425 20 0 BEADRP CC(C)C1(C[NH2+][C@H]2CCC[C@H]2C[NH3+])CC1 ZINC000232728251 135668292 /nfs/dbraw/zinc/66/82/92/135668292.db2.gz COTHKTSTCQJBRA-RYUDHWBXSA-N 2 0 210.365 2.140 20 0 BEADRP CC1(C[NH2+]CC2(C)CC[NH2+]CC2)CCC1 ZINC000232854935 135673098 /nfs/dbraw/zinc/67/30/98/135673098.db2.gz KEBJPBIYKHREMM-UHFFFAOYSA-N 2 0 210.365 2.156 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]Cc2cc(F)cc(F)c2)C1 ZINC000334843052 135821257 /nfs/dbraw/zinc/82/12/57/135821257.db2.gz AGJKGSJYHOUOHY-STQMWFEESA-N 2 0 240.297 2.324 20 0 BEADRP Cc1cc(C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)ccc1F ZINC000334846800 135821861 /nfs/dbraw/zinc/82/18/61/135821861.db2.gz PXQBLGJZKYSZJF-QWHCGFSZSA-N 2 0 236.334 2.494 20 0 BEADRP [NH3+]C1(C[NH2+][C@H]2CCCC23CCC3)CCC1 ZINC000335025045 135866938 /nfs/dbraw/zinc/86/69/38/135866938.db2.gz QVQZBHUDOQEBTC-NSHDSACASA-N 2 0 208.349 2.180 20 0 BEADRP CC1(C)CCC([NH2+][C@@H]2CCC[C@H]2[NH3+])CC1 ZINC000335217485 135959547 /nfs/dbraw/zinc/95/95/47/135959547.db2.gz OLDKXGFMORTJIS-VXGBXAGGSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@H]1CC[C@@H]([NH+]2CCC(C[NH+](C)C)CC2)C1 ZINC000335318192 136025916 /nfs/dbraw/zinc/02/59/16/136025916.db2.gz KAKDUWIHZISZLE-GXTWGEPZSA-N 2 0 224.392 2.449 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@H]2C[C@H]2C(F)F)CC1 ZINC000348116392 136037567 /nfs/dbraw/zinc/03/75/67/136037567.db2.gz KOGLPSQPGFYRLF-MNOVXSKESA-N 2 0 232.318 2.102 20 0 BEADRP [NH3+]C[C@H]1CC[N@@H+]([C@H]2CCc3ccc(F)cc32)C1 ZINC000335335943 136056038 /nfs/dbraw/zinc/05/60/38/136056038.db2.gz RDSYXZRREBGUHA-YGRLFVJLSA-N 2 0 234.318 2.094 20 0 BEADRP CC(C)(C)[NH+]1CCC([NH2+][C@@H]2C[C@@H]2C(F)F)CC1 ZINC000348296409 136063181 /nfs/dbraw/zinc/06/31/81/136063181.db2.gz VZYNNEHGCJUVJV-WDEREUQCSA-N 2 0 246.345 2.493 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CC[C@H](F)C2)[C@@H]2CCC[C@@H]21 ZINC000348391217 136076166 /nfs/dbraw/zinc/07/61/66/136076166.db2.gz HUPQOSUVPLTAOD-NDKCEZKHSA-N 2 0 240.366 2.339 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+]CCOCC[NH+](CC)CC ZINC000348396025 136076335 /nfs/dbraw/zinc/07/63/35/136076335.db2.gz MGJHASJRNLULOG-ZIAGYGMSSA-N 2 0 242.407 2.123 20 0 BEADRP [NH3+]C1CCC([NH2+][C@H]2CCC[C@@H](F)C2)CC1 ZINC000335385535 136088786 /nfs/dbraw/zinc/08/87/86/136088786.db2.gz LFINREFOZPWSIH-YYJSSNLHSA-N 2 0 214.328 2.127 20 0 BEADRP [NH3+]CC1CCC([NH2+][C@@H]2CCC[C@H](F)C2)CC1 ZINC000335386995 136089156 /nfs/dbraw/zinc/08/91/56/136089156.db2.gz ORLOLBHOGMJUNL-PYNQCMFNSA-N 2 0 228.355 2.374 20 0 BEADRP Cc1cc(N)cc(C[NH2+][C@@H]2CCCCC[C@H]2[NH3+])c1 ZINC000335364715 136095183 /nfs/dbraw/zinc/09/51/83/136095183.db2.gz WDNQNOWSTWYLEE-HUUCEWRRSA-N 2 0 247.386 2.327 20 0 BEADRP C[C@H]1CC(C)(C)CC[C@H]1[NH2+]CC1C[NH2+]C1 ZINC000335551590 136098025 /nfs/dbraw/zinc/09/80/25/136098025.db2.gz KBXDTSBTDHWMRL-CMPLNLGQSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@H]1CC[C@H]([NH2+]CC2C[NH2+]C2)c2ccccc21 ZINC000335551937 136098558 /nfs/dbraw/zinc/09/85/58/136098558.db2.gz LNJGAAHTZOCBNH-NHYWBVRUSA-N 2 0 230.355 2.434 20 0 BEADRP Cc1ccsc1[C@H](C)[NH2+]C1CC[NH2+]CC1 ZINC000335567011 136107895 /nfs/dbraw/zinc/10/78/95/136107895.db2.gz IBDXBTWKFJIHIF-JTQLQIEISA-N 2 0 224.373 2.459 20 0 BEADRP c1ccc2c(c1)NCCC[C@H]2[NH2+]C1CC[NH2+]CC1 ZINC000335568921 136108648 /nfs/dbraw/zinc/10/86/48/136108648.db2.gz OPNIDFANBOGZSY-OAHLLOKOSA-N 2 0 245.370 2.275 20 0 BEADRP C[C@@H]([NH2+]C1CC[NH2+]CC1)c1ccc2c(c1)COC2 ZINC000335570045 136109010 /nfs/dbraw/zinc/10/90/10/136109010.db2.gz YKPJTEJDFWIKJJ-LLVKDONJSA-N 2 0 246.354 2.119 20 0 BEADRP C[C@@H]1Cc2ccccc2[C@@H]1[NH2+]CC(C)(C)[NH3+] ZINC000335599088 136113792 /nfs/dbraw/zinc/11/37/92/136113792.db2.gz NCVNKOCNDLRPLD-ZWNOBZJWSA-N 2 0 218.344 2.247 20 0 BEADRP Cc1cccc(OCC[NH2+][C@H]2C[C@H]([NH3+])C2(C)C)c1 ZINC000404785180 397732753 /nfs/dbraw/zinc/73/27/53/397732753.db2.gz PHAKUQZHTAPXMQ-KBPBESRZSA-N 2 0 248.370 2.089 20 0 BEADRP C[C@H]1C[C@@H](N)C[N@@H+]1CCC(C)(C)C1CC1 ZINC000405983524 397777971 /nfs/dbraw/zinc/77/79/71/397777971.db2.gz BJERUDWDKUNUDD-CMPLNLGQSA-N 2 0 210.365 2.234 20 0 BEADRP C[NH+](C)CCC[NH2+][C@H]1CC[C@@H]1C(C)(C)C ZINC000309036915 397846796 /nfs/dbraw/zinc/84/67/96/397846796.db2.gz IQPMYGIMBNBBMT-RYUDHWBXSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H]1CCSc2ccccc21 ZINC000309254525 397854913 /nfs/dbraw/zinc/85/49/13/397854913.db2.gz AFHWYLJEXYVGQC-ZYHUDNBSSA-N 2 0 236.384 2.408 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@H](C)c1ccncc1 ZINC000309252842 397855342 /nfs/dbraw/zinc/85/53/42/397855342.db2.gz AMPHVSAJWGBADS-VXGBXAGGSA-N 2 0 221.348 2.250 20 0 BEADRP Cc1ccncc1CN(C)C[C@@H]1CCC[N@H+](C)C1 ZINC000269617643 397958286 /nfs/dbraw/zinc/95/82/86/397958286.db2.gz RQIXXATYNYXPEO-CQSZACIVSA-N 2 0 247.386 2.164 20 0 BEADRP Cc1ccc(CC[N@@H+]2CC[C@@H]3C[NH2+]C[C@@H]3C2)cc1 ZINC000334141480 397999987 /nfs/dbraw/zinc/99/99/87/397999987.db2.gz HMNOKLIRGOARLQ-HZPDHXFCSA-N 2 0 244.382 2.079 20 0 BEADRP C[C@@H]1C[C@H](C[NH3+])C[N@@H+]1C[C@@H]1C[C@H]1c1ccccc1 ZINC000414657547 398005856 /nfs/dbraw/zinc/00/58/56/398005856.db2.gz HQYGHMLFZCKXMH-VDERGJSUSA-N 2 0 244.382 2.459 20 0 BEADRP C[C@H]1C[C@@H](C[NH3+])C[N@@H+]1C[C@@H]1C[C@H]1c1ccccc1 ZINC000414657545 398006006 /nfs/dbraw/zinc/00/60/06/398006006.db2.gz HQYGHMLFZCKXMH-SDADXPQNSA-N 2 0 244.382 2.459 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H](C)Cc1ccc(F)cc1 ZINC000414829699 398050293 /nfs/dbraw/zinc/05/02/93/398050293.db2.gz BHYOYGSMQPJXRL-VXGBXAGGSA-N 2 0 238.350 2.202 20 0 BEADRP C[NH+](C)[C@H]1CCC[N@H+](CCc2ccccn2)CC1 ZINC000277272175 398027288 /nfs/dbraw/zinc/02/72/88/398027288.db2.gz RRFJQCLPCCNSCV-HNNXBMFYSA-N 2 0 247.386 2.040 20 0 BEADRP FC1(F)CCC[N@H+](CCC2CC[NH2+]CC2)CC1 ZINC000629559228 397970586 /nfs/dbraw/zinc/97/05/86/397970586.db2.gz QQSSLCCVGHDOIJ-UHFFFAOYSA-N 2 0 246.345 2.497 20 0 BEADRP Cc1nccn1CCCN1CCCC(F)(F)C1 ZINC000649695156 398043099 /nfs/dbraw/zinc/04/30/99/398043099.db2.gz KBOHLXNDLRVFJN-UHFFFAOYSA-N 2 0 243.301 2.313 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]Cc1ccc(Cl)c(F)c1 ZINC000414838132 398052332 /nfs/dbraw/zinc/05/23/32/398052332.db2.gz KWWNGURCQJNYIV-SECBINFHSA-N 2 0 244.741 2.424 20 0 BEADRP C[C@H](C[C@@H]1CCC[NH2+]1)[NH2+]Cc1cccs1 ZINC000086495076 398055171 /nfs/dbraw/zinc/05/51/71/398055171.db2.gz BGFUIWFWYWWSQS-MNOVXSKESA-N 2 0 224.373 2.368 20 0 BEADRP C1CC([NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)C1 ZINC000086494441 398055370 /nfs/dbraw/zinc/05/53/70/398055370.db2.gz MRUGVJXLUDOKBZ-FRRDWIJNSA-N 2 0 208.349 2.049 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)Cc2ccoc2)C1 ZINC000449089324 398058550 /nfs/dbraw/zinc/05/85/50/398058550.db2.gz JWELQWYAMXSTDC-TZMCWYRMSA-N 2 0 236.359 2.142 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]C[C@H]1CCCC1(F)F ZINC000390837729 398107524 /nfs/dbraw/zinc/10/75/24/398107524.db2.gz AOHDNFSZMCTOAU-HBNTYKKESA-N 2 0 232.318 2.139 20 0 BEADRP C[C@@H](CCc1ccco1)[NH2+][C@H]1CCC[NH2+]CC1 ZINC000128908023 398097876 /nfs/dbraw/zinc/09/78/76/398097876.db2.gz CDVUKLZHBLNSSX-STQMWFEESA-N 2 0 236.359 2.332 20 0 BEADRP CC(C)C1([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)CC1 ZINC000335009300 398124968 /nfs/dbraw/zinc/12/49/68/398124968.db2.gz VTLNQOCUJMOATH-FOSCPWQOSA-N 2 0 208.349 2.048 20 0 BEADRP C[C@H]1C[N@H+](CCC(C)(C)C2CC2)CC[C@@H]1[NH3+] ZINC000382254331 487535982 /nfs/dbraw/zinc/53/59/82/487535982.db2.gz VVZDTUNYIIWSMK-AAEUAGOBSA-N 2 0 224.392 2.482 20 0 BEADRP C[C@@H]1C[N@H+](CCC(C)(C)C2CC2)CC[C@H]1[NH3+] ZINC000382254335 487536022 /nfs/dbraw/zinc/53/60/22/487536022.db2.gz VVZDTUNYIIWSMK-DGCLKSJQSA-N 2 0 224.392 2.482 20 0 BEADRP CC(C)(CC[NH2+]CC1([NH3+])CCC1)C1CC1 ZINC000392906839 487558198 /nfs/dbraw/zinc/55/81/98/487558198.db2.gz UJKLZUPFDMHMII-UHFFFAOYSA-N 2 0 210.365 2.284 20 0 BEADRP CC(C)OCC[NH2+][C@@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000160049956 167245315 /nfs/dbraw/zinc/24/53/15/167245315.db2.gz VALGQLMYHBEMHX-KBPBESRZSA-N 2 0 242.407 2.312 20 0 BEADRP C[NH2+]C[C@H]1CCC[N@@H+]1CCC(C)(C)C1CC1 ZINC000406051030 487585366 /nfs/dbraw/zinc/58/53/66/487585366.db2.gz HHSQWFHRKHVJLW-CYBMUJFWSA-N 2 0 224.392 2.497 20 0 BEADRP C[N@H+](CCC(C)(C)C1CC1)C1CC[NH2+]CC1 ZINC000405950275 487585500 /nfs/dbraw/zinc/58/55/00/487585500.db2.gz AAOFWGIWXWPDAP-UHFFFAOYSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H](Cc1cccc(F)c1)[N@H+](C)CCC[NH3+] ZINC000162599301 487591662 /nfs/dbraw/zinc/59/16/62/487591662.db2.gz LCBDFTVEUUQATM-LLVKDONJSA-N 2 0 224.323 2.037 20 0 BEADRP Clc1sccc1C[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000312764161 322923218 /nfs/dbraw/zinc/92/32/18/322923218.db2.gz LPSHVMJRTARZGF-VIFPVBQESA-N 2 0 244.791 2.491 20 0 BEADRP CC[C@H](CC(F)F)C[N@@H+]1CC[C@@H]([C@H](C)[NH3+])C1 ZINC000662267747 409569756 /nfs/dbraw/zinc/56/97/56/409569756.db2.gz YIDDHVDQEMDAMA-HBNTYKKESA-N 2 0 234.334 2.337 20 0 BEADRP C[C@@H]([NH3+])[C@@H]1CCC[N@H+](CC2CC=CC2)C1 ZINC000662244506 409535899 /nfs/dbraw/zinc/53/58/99/409535899.db2.gz HUDMYJSGVJZGNW-DGCLKSJQSA-N 2 0 208.349 2.012 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](C[C@@H]3C[C@H]4C[C@H]4C3)C[C@@H]21 ZINC000662267431 409569433 /nfs/dbraw/zinc/56/94/33/409569433.db2.gz VVAWXKRJMLLBPD-JSLGZRHDSA-N 2 0 234.387 2.092 20 0 BEADRP C[C@@H]1CCC[N@H+](C[C@@H]2C[C@H]3C[C@H]3C2)[C@@H]1CC[NH3+] ZINC000662285840 409619177 /nfs/dbraw/zinc/61/91/77/409619177.db2.gz NPKQNJLDNOPVGV-UXXRCYHCSA-N 2 0 236.403 2.482 20 0 BEADRP CO[C@H](C[NH+]1CCC(C)([NH3+])CC1)c1ccccc1 ZINC000662270480 409573250 /nfs/dbraw/zinc/57/32/50/409573250.db2.gz LKQOTXFGGWENRV-CQSZACIVSA-N 2 0 248.370 2.187 20 0 BEADRP C([C@@H]1C[C@H]2C[C@H]2C1)[NH+]1CCC2(CC[NH2+]C2)CC1 ZINC000662272595 409577992 /nfs/dbraw/zinc/57/79/92/409577992.db2.gz GIMGPAOIUMMIFL-BTTYYORXSA-N 2 0 234.387 2.108 20 0 BEADRP [NH3+]CCC[N@@H+]1CCC[C@@H](c2ccccc2)C1 ZINC000662285107 409615337 /nfs/dbraw/zinc/61/53/37/409615337.db2.gz WQVYCUYMPLETEB-CQSZACIVSA-N 2 0 218.344 2.215 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H]2CCC[C@@H]2[NH3+])c(C)c1 ZINC000259119737 409732129 /nfs/dbraw/zinc/73/21/29/409732129.db2.gz TVLDIYPECVUTCX-LSDHHAIUSA-N 2 0 232.371 2.315 20 0 BEADRP C[C@H](CC1CCC1)[NH2+]C[C@H](C)C[NH+](C)C ZINC000308911327 409937909 /nfs/dbraw/zinc/93/79/09/409937909.db2.gz MQQRUIKDLVGXBK-NWDGAFQWSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@]1(C[NH3+])CC[N@H+](Cc2cccc3c2CCC3)C1 ZINC000650703104 410332560 /nfs/dbraw/zinc/33/25/60/410332560.db2.gz KZUBPBLLVXIWJR-INIZCTEOSA-N 2 0 244.382 2.346 20 0 BEADRP C[C@]1(C[NH3+])CC[N@H+](Cc2cccc3c2CCC3)C1 ZINC000650703105 410333724 /nfs/dbraw/zinc/33/37/24/410333724.db2.gz KZUBPBLLVXIWJR-MRXNPFEDSA-N 2 0 244.382 2.346 20 0 BEADRP C[C@H]([NH3+])[C@H]1CC[N@H+](Cc2cccc3c2CCC3)C1 ZINC000650703281 410335361 /nfs/dbraw/zinc/33/53/61/410335361.db2.gz SNYHTYYKMFNUCV-JSGCOSHPSA-N 2 0 244.382 2.344 20 0 BEADRP C[C@H]1C[N@H+](Cc2cccc3c2CCC3)CC[C@H]1[NH3+] ZINC000650703245 410335745 /nfs/dbraw/zinc/33/57/45/410335745.db2.gz QYZUBTWLWWUKFV-BLLLJJGKSA-N 2 0 244.382 2.344 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]Cc1cccc2c1CCC2 ZINC000650704340 410336358 /nfs/dbraw/zinc/33/63/58/410336358.db2.gz USBMUZILFWTYGT-GFCCVEGCSA-N 2 0 232.371 2.392 20 0 BEADRP c1cc2c(c(C[NH2+]CCC[NH2+]C3CC3)c1)CCC2 ZINC000650704395 410336661 /nfs/dbraw/zinc/33/66/61/410336661.db2.gz WVPLPOZFXRUTIQ-UHFFFAOYSA-N 2 0 244.382 2.407 20 0 BEADRP C[C@]1(c2cccc(F)c2)CC[N@H+](CCC[NH3+])C1 ZINC000650708786 410340142 /nfs/dbraw/zinc/34/01/42/410340142.db2.gz MIBCLTJSTVPQJG-AWEZNQCLSA-N 2 0 236.334 2.138 20 0 BEADRP COc1ccc(C)cc1C[NH2+]CCC1(C[NH3+])CC1 ZINC000650711929 410341809 /nfs/dbraw/zinc/34/18/09/410341809.db2.gz JLPBYHVPJZKUCS-UHFFFAOYSA-N 2 0 248.370 2.222 20 0 BEADRP Cc1ccc(C[NH2+]CCC2(C[NH3+])CC2)cc1F ZINC000650712362 410342776 /nfs/dbraw/zinc/34/27/76/410342776.db2.gz BLBDFJKYMRCXQL-UHFFFAOYSA-N 2 0 236.334 2.353 20 0 BEADRP C[C@H]1CCC[C@H]([NH2+]CCC2(C[NH3+])CC2)C1 ZINC000650713317 410349718 /nfs/dbraw/zinc/34/97/18/410349718.db2.gz OGSWNRHXQHKCHH-RYUDHWBXSA-N 2 0 210.365 2.284 20 0 BEADRP CC(C)C[N@@H+]1CCCC[C@@H]1[C@@H]1C[C@@H]([NH3+])CCO1 ZINC000650724050 410360904 /nfs/dbraw/zinc/36/09/04/410360904.db2.gz XNCZEOTWMJVPCQ-MJBXVCDLSA-N 2 0 240.391 2.003 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+][C@@H]1C[C@H]1CC(C)(C)C ZINC000650741752 410374963 /nfs/dbraw/zinc/37/49/63/410374963.db2.gz KREJTVTYDVXOIC-YNEHKIRRSA-N 2 0 242.407 2.155 20 0 BEADRP C[C@@H](Cc1cccs1)[NH2+]CCC1(C[NH3+])CC1 ZINC000650743964 410379889 /nfs/dbraw/zinc/37/98/89/410379889.db2.gz CGYKUGYURCAGIC-NSHDSACASA-N 2 0 238.400 2.398 20 0 BEADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H]1C[C@H](C)O[C@@H]1C ZINC000650755230 410402367 /nfs/dbraw/zinc/40/23/67/410402367.db2.gz AEWGBRONGJPPCY-YWPYICTPSA-N 2 0 248.370 2.062 20 0 BEADRP C[NH2+]Cc1ccccc1C[NH2+][C@H](C)CCCC[NH3+] ZINC000650755370 410403197 /nfs/dbraw/zinc/40/31/97/410403197.db2.gz CWBQEZYRPLSMSV-CYBMUJFWSA-N 3 0 249.402 2.013 20 0 BEADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H]1CCO[C@@H](C)C1 ZINC000650757303 410405363 /nfs/dbraw/zinc/40/53/63/410405363.db2.gz UFWSULNAISQWTR-SWLSCSKDSA-N 2 0 248.370 2.063 20 0 BEADRP CC[C@H]([NH2+]CCC1CC[NH2+]CC1)[C@H]1C[C@H]1C ZINC000650762247 410411266 /nfs/dbraw/zinc/41/12/66/410411266.db2.gz XXHPOIWHWXTMAE-XBFCOCLRSA-N 2 0 224.392 2.400 20 0 BEADRP CCCC[C@@H](COC)[NH2+]CCC1CC[NH2+]CC1 ZINC000650763847 410413854 /nfs/dbraw/zinc/41/38/54/410413854.db2.gz KQFQVYXBNCRJLW-AWEZNQCLSA-N 2 0 242.407 2.171 20 0 BEADRP C([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)[C@H]1CCC[C@@H]2C[C@@H]21 ZINC000665263207 410737716 /nfs/dbraw/zinc/73/77/16/410737716.db2.gz IIADTNGVZDHKNU-VWZINJBZSA-N 2 0 234.387 2.295 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]CCCC2CCC2)C1 ZINC000665266706 410739164 /nfs/dbraw/zinc/73/91/64/410739164.db2.gz HYZIAWDGAPAJDF-QWHCGFSZSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]CC[C@]1(C)CC1(F)F ZINC000665266713 410739913 /nfs/dbraw/zinc/73/99/13/410739913.db2.gz IDRLSBGNIMXKOW-GRYCIOLGSA-N 2 0 246.345 2.400 20 0 BEADRP C([NH2+][C@@H]1CCCC12CCC2)C12CC(C1)C[NH2+]2 ZINC000665280251 410754827 /nfs/dbraw/zinc/75/48/27/410754827.db2.gz WSWOQFKTSLWART-MBHSVXNSSA-N 2 0 220.360 2.051 20 0 BEADRP C[C@@H]([NH2+]CCC(C)(F)F)C1CC[NH+](C)CC1 ZINC000393680146 410755412 /nfs/dbraw/zinc/75/54/12/410755412.db2.gz NUGOQJSLFSAYFJ-SNVBAGLBSA-N 2 0 234.334 2.352 20 0 BEADRP CC[C@H]([NH2+]CC[C@@H]([NH3+])C(C)C)[C@H]1C[C@@H]1C ZINC000665282973 410762415 /nfs/dbraw/zinc/76/24/15/410762415.db2.gz FNTZTUVXHNWLQV-RVMXOQNASA-N 2 0 212.381 2.384 20 0 BEADRP C[NH2+]C[C@H](C)[NH2+][C@@H]1CCC[C@@H](c2cccnc2)C1 ZINC000665297726 410816515 /nfs/dbraw/zinc/81/65/15/410816515.db2.gz KJFZKWOTYPAQDX-GZBFAFLISA-N 2 0 247.386 2.305 20 0 BEADRP CC(C)C[NH2+]CCC[N@@H+]1CCCC[C@@H]1C ZINC000019912956 167003598 /nfs/dbraw/zinc/00/35/98/167003598.db2.gz ASPYMTATKKHQCA-ZDUSSCGKSA-N 2 0 212.381 2.497 20 0 BEADRP CC(C)C[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000297589269 167009647 /nfs/dbraw/zinc/00/96/47/167009647.db2.gz SQCJDYPCIGIGQK-UHFFFAOYSA-N 2 0 203.289 2.080 20 0 BEADRP CC(C)Oc1ccc(C[N@@H+]2CC[C@H](C[NH3+])C2)cc1 ZINC000050245496 167294965 /nfs/dbraw/zinc/29/49/65/167294965.db2.gz GYOZIXQGBIVTMI-CQSZACIVSA-N 2 0 248.370 2.254 20 0 BEADRP CC(C)[C@@H](C)[N@H+](C)CC[C@H]1CCC[NH2+]C1 ZINC000251303388 167367216 /nfs/dbraw/zinc/36/72/16/167367216.db2.gz ILCLDUCLYHAHAE-CHWSQXEVSA-N 2 0 212.381 2.352 20 0 BEADRP CC(C)CC[N@H+](C)CCC1CC[NH2+]CC1 ZINC000042457201 411009005 /nfs/dbraw/zinc/00/90/05/411009005.db2.gz YJAXWUFPHAFMTR-UHFFFAOYSA-N 2 0 212.381 2.354 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1C[C@H]1C1CC1)C1CC[NH+](C)CC1 ZINC000651475347 411056846 /nfs/dbraw/zinc/05/68/46/411056846.db2.gz OPNTXBNMVCRLHL-CQDKDKBSSA-N 2 0 236.403 2.352 20 0 BEADRP C[N@H+](CCC(C)(C)C)C[C@@]1(C)CC[NH2+]C1 ZINC000399794555 411065542 /nfs/dbraw/zinc/06/55/42/411065542.db2.gz VSSFUSIHUKQOGK-ZDUSSCGKSA-N 2 0 212.381 2.354 20 0 BEADRP CC(C)(C)[C@H]1CCC[N@@H+]1C[C@@H]1CC[NH2+]C1 ZINC000108324141 411144325 /nfs/dbraw/zinc/14/43/25/411144325.db2.gz JWBAPILCSYUBKG-VXGBXAGGSA-N 2 0 210.365 2.106 20 0 BEADRP C1=C(C[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)CCCC1 ZINC000401003407 411168411 /nfs/dbraw/zinc/16/84/11/411168411.db2.gz AINFASIROIJZHX-QLFBSQMISA-N 2 0 234.387 2.465 20 0 BEADRP C[N@@H+]1CCC[C@H]2C[NH+](CC3CC=CC3)CC[C@H]21 ZINC000660009880 411172964 /nfs/dbraw/zinc/17/29/64/411172964.db2.gz CIIKLEYYTBMOOL-LSDHHAIUSA-N 2 0 234.387 2.369 20 0 BEADRP c1ccc(CC[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)cc1 ZINC000401036495 411173241 /nfs/dbraw/zinc/17/32/41/411173241.db2.gz ZCYSZCNTZSEVKD-OWCLPIDISA-N 2 0 244.382 2.207 20 0 BEADRP C[N@H+](CCC[NH+]1CCCC1)CC1CC=CC1 ZINC000660465462 411173259 /nfs/dbraw/zinc/17/32/59/411173259.db2.gz YYEMUUWCWYQFKV-UHFFFAOYSA-N 2 0 222.376 2.370 20 0 BEADRP Cc1cccc(C[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)c1 ZINC000401032034 411173526 /nfs/dbraw/zinc/17/35/26/411173526.db2.gz XEZUYHWMWVSQFI-ARFHVFGLSA-N 2 0 244.382 2.473 20 0 BEADRP C[N@H+]1CC=C(C[NH2+][C@H]2CCCSCC2)CC1 ZINC000657938880 411174624 /nfs/dbraw/zinc/17/46/24/411174624.db2.gz RJNHHNJDDOQVJF-ZDUSSCGKSA-N 2 0 240.416 2.124 20 0 BEADRP CC[C@H](C)C[N@H+](C1CC1)C1CC[NH2+]CC1 ZINC000310036689 411195874 /nfs/dbraw/zinc/19/58/74/411195874.db2.gz UNEQAVMKDMNAQT-NSHDSACASA-N 2 0 210.365 2.249 20 0 BEADRP CCC(CC)(CCO)C[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000656193078 411198524 /nfs/dbraw/zinc/19/85/24/411198524.db2.gz MBIBRLDNEOWSQN-OLZOCXBDSA-N 2 0 242.407 2.035 20 0 BEADRP CC[C@H]([NH2+][C@H]1CCC[C@@H]([NH3+])C1)C1CCOCC1 ZINC000656197069 411202286 /nfs/dbraw/zinc/20/22/86/411202286.db2.gz BBEPFJGDOUUTOT-RDBSUJKOSA-N 2 0 240.391 2.051 20 0 BEADRP CCOC1CC(CC[NH2+][C@H]2CCC[C@H]([NH3+])C2)C1 ZINC000656198661 411203120 /nfs/dbraw/zinc/20/31/20/411203120.db2.gz BVIUKVDUMYHSMH-QPPOZKHWSA-N 2 0 240.391 2.051 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]Cc2ccc(Cl)cn2)C1 ZINC000656198384 411203146 /nfs/dbraw/zinc/20/31/46/411203146.db2.gz SRLQSURCFKXSMJ-GHMZBOCLSA-N 2 0 239.750 2.095 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]Cc2ccc(Cl)cn2)C1 ZINC000656198393 411203239 /nfs/dbraw/zinc/20/32/39/411203239.db2.gz SRLQSURCFKXSMJ-WDEREUQCSA-N 2 0 239.750 2.095 20 0 BEADRP COc1c(C)cccc1CN[C@H](C)[C@H]1CCC[NH2+]1 ZINC000656201412 411206325 /nfs/dbraw/zinc/20/63/25/411206325.db2.gz WYLGIZXXYWMVBW-TZMCWYRMSA-N 2 0 248.370 2.234 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCC[C@@H]([NH3+])C1)[C@H]1CCCCO1 ZINC000656201508 411206340 /nfs/dbraw/zinc/20/63/40/411206340.db2.gz QJDWSNIDWIQQFC-YIYPIFLZSA-N 2 0 240.391 2.194 20 0 BEADRP CC[C@H]([NH2+][C@@H](C)CCCC[NH3+])[C@@H]1CCCCO1 ZINC000656201848 411207781 /nfs/dbraw/zinc/20/77/81/411207781.db2.gz SYTYIFAYVBMHQY-IHRRRGAJSA-N 2 0 242.407 2.441 20 0 BEADRP CC(C)CC[C@@H]1CCC[N@@H+]1C[C@H]1CC[NH2+]C1 ZINC000652343513 411208257 /nfs/dbraw/zinc/20/82/57/411208257.db2.gz OSBPNTCCVVXXRW-KBPBESRZSA-N 2 0 224.392 2.497 20 0 BEADRP CCC[C@H](C)[C@H]1CCC[N@@H+]1C[C@H]1CC[NH2+]C1 ZINC000652343559 411208476 /nfs/dbraw/zinc/20/84/76/411208476.db2.gz WIOQRHMZQYYXJM-MELADBBJSA-N 2 0 224.392 2.497 20 0 BEADRP CCCC[N@@H+]1CCC[C@H]([C@@H]2C[C@H]([NH3+])CCO2)C1 ZINC000652346354 411209456 /nfs/dbraw/zinc/20/94/56/411209456.db2.gz ZOZVRFAJZHSLEW-MJBXVCDLSA-N 2 0 240.391 2.005 20 0 BEADRP Cc1cccc(NC[C@H]2C[C@@H]([NH+](C)C)C2)[nH+]1 ZINC000656211879 411210750 /nfs/dbraw/zinc/21/07/50/411210750.db2.gz PFYIBOUIFWLVON-TXEJJXNPSA-N 2 0 219.332 2.142 20 0 BEADRP CC[C@H](C)[N@@H+]1CCC[C@H]([C@@H]2C[C@H]([NH3+])CCO2)C1 ZINC000652349530 411211088 /nfs/dbraw/zinc/21/10/88/411211088.db2.gz ROOFPXFKPUEHRV-FQUUOJAGSA-N 2 0 240.391 2.003 20 0 BEADRP C[C@@H]1CCC[N@H+](Cc2cccc(N)c2)[C@@H]1CC[NH3+] ZINC000652356108 411214610 /nfs/dbraw/zinc/21/46/10/411214610.db2.gz SCDOEEXXZNIFLV-IUODEOHRSA-N 2 0 247.386 2.218 20 0 BEADRP Cc1c[nH+]ccc1N[C@@H]1CCC[N@@H+]2CCCC[C@@H]12 ZINC000656226290 411215328 /nfs/dbraw/zinc/21/53/28/411215328.db2.gz LPYMHMQMSGUQNE-CABCVRRESA-N 2 0 245.370 2.241 20 0 BEADRP C([C@H]1CC[NH2+]C1)[N@H+](C1CC1)C1CCCC1 ZINC000309720081 411218850 /nfs/dbraw/zinc/21/88/50/411218850.db2.gz VQJDEJDWVJZTCB-NSHDSACASA-N 2 0 208.349 2.003 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@@H](C)c2ccccn2)CC1 ZINC000658062561 411228001 /nfs/dbraw/zinc/22/80/01/411228001.db2.gz ODVPMLKKGGFYID-CYBMUJFWSA-N 2 0 247.386 2.259 20 0 BEADRP COCCCCC[NH2+][C@@H]1CCCCC[C@@H]1[NH3+] ZINC000422826945 411232801 /nfs/dbraw/zinc/23/28/01/411232801.db2.gz RPQNDQFHNJTEBA-QWHCGFSZSA-N 2 0 228.380 2.053 20 0 BEADRP COCC[C@H](C)C[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000423173432 411235994 /nfs/dbraw/zinc/23/59/94/411235994.db2.gz YOQBHOOUKRDEHW-TUKIKUTGSA-N 2 0 248.370 2.393 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H]2CC[C@@H](C)SC2)C1 ZINC000655693954 411239719 /nfs/dbraw/zinc/23/97/19/411239719.db2.gz BIQKVFOAOLXVQU-UPJWGTAASA-N 2 0 242.432 2.202 20 0 BEADRP CCCCC[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000400907618 411165631 /nfs/dbraw/zinc/16/56/31/411165631.db2.gz CFGKZSGEZMFKOU-FRRDWIJNSA-N 2 0 210.365 2.154 20 0 BEADRP CC(C)[C@H](C)C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000400966520 411166382 /nfs/dbraw/zinc/16/63/82/411166382.db2.gz NJEBQCMTZAOHCV-ZOBORPQBSA-N 2 0 224.392 2.256 20 0 BEADRP CC(C)CCC[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000400967888 411166804 /nfs/dbraw/zinc/16/68/04/411166804.db2.gz NYAFPSZNXWHXLQ-MELADBBJSA-N 2 0 224.392 2.400 20 0 BEADRP C(C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)CC1CC1 ZINC000400950175 411166812 /nfs/dbraw/zinc/16/68/12/411166812.db2.gz FDEJGFDIDBDTJQ-MGPQQGTHSA-N 2 0 222.376 2.154 20 0 BEADRP CCC1(C[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)CC1 ZINC000400977164 411167392 /nfs/dbraw/zinc/16/73/92/411167392.db2.gz PSEMTKIPPOVMGM-FRRDWIJNSA-N 2 0 222.376 2.154 20 0 BEADRP c1ccc([C@H]2CC[N@@H+](C[C@@H]3CC[NH2+]C3)C2)cc1 ZINC000051890179 411284458 /nfs/dbraw/zinc/28/44/58/411284458.db2.gz GVPORTGQBXZZQJ-HIFRSBDPSA-N 2 0 230.355 2.085 20 0 BEADRP CC[N@@H+](Cc1cccs1)C[C@H]1CC[NH2+]C1 ZINC000051890026 411284962 /nfs/dbraw/zinc/28/49/62/411284962.db2.gz NXMYUZSUUCVZKI-NSHDSACASA-N 2 0 224.373 2.180 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+]Cc2ccc(C[NH3+])cc2)C1 ZINC000129447335 411287560 /nfs/dbraw/zinc/28/75/60/411287560.db2.gz IVTUHJFMQDFVBT-SMDDNHRTSA-N 2 0 218.344 2.424 20 0 BEADRP CCC1(C)CC[NH+](C[C@@H]2CC[NH2+]C2)CC1 ZINC000062954020 411329249 /nfs/dbraw/zinc/32/92/49/411329249.db2.gz WLYHSVGLBNEZRW-GFCCVEGCSA-N 2 0 210.365 2.108 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CCc2ccoc2)[C@H]2CCC[C@@H]21 ZINC000658196215 411289272 /nfs/dbraw/zinc/28/92/72/411289272.db2.gz CQPRCVRMHQQWNK-ILXRZTDVSA-N 2 0 248.370 2.285 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C[C@@]2(C)CC2(F)F)CC[N@@H+]1C ZINC000658218637 411298793 /nfs/dbraw/zinc/29/87/93/411298793.db2.gz KJLQNQYKDFGRCZ-OUAUKWLOSA-N 2 0 232.318 2.104 20 0 BEADRP C[C@@H]1CCC[C@H](C[NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)O1 ZINC000658220352 411299266 /nfs/dbraw/zinc/29/92/66/411299266.db2.gz PTSPCOZABSFFQI-RFQIPJPRSA-N 2 0 240.391 2.016 20 0 BEADRP CC[C@@H]([NH2+]CC[C@H]1CCC[N@@H+]1C)C1CC1 ZINC000658236328 411306195 /nfs/dbraw/zinc/30/61/95/411306195.db2.gz INWQLCYMKMXVCQ-CHWSQXEVSA-N 2 0 210.365 2.249 20 0 BEADRP C(=C/C[N@@H+]1CC[C@@H]2C[C@@H]2C1)\C[NH+]1CC[C@@H]2C[C@@H]2C1 ZINC000661965871 411332367 /nfs/dbraw/zinc/33/23/67/411332367.db2.gz BIVCCUWRKBJAHY-JEKYVBGCSA-N 2 0 246.398 2.226 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C[C@H]2C(C)(C)C2(F)F)CC[N@@H+]1C ZINC000658279765 411319374 /nfs/dbraw/zinc/31/93/74/411319374.db2.gz CPDBQPQESAMTIX-VWYCJHECSA-N 2 0 246.345 2.350 20 0 BEADRP c1ccc2c(c1)CCC[N@@H+](C[C@@H]1CC[NH2+]C1)C2 ZINC000062944701 411325058 /nfs/dbraw/zinc/32/50/58/411325058.db2.gz HCOQZDXWFLRSFP-CYBMUJFWSA-N 2 0 230.355 2.044 20 0 BEADRP CC1(C[NH2+]C(C2CC2)C2CC2)CC[NH2+]CC1 ZINC000062841834 411326154 /nfs/dbraw/zinc/32/61/54/411326154.db2.gz UQMDICVBEWDKIV-UHFFFAOYSA-N 2 0 222.376 2.154 20 0 BEADRP CCc1ccc(C[N@@H+]2CC[C@H](C[NH3+])C2)s1 ZINC000050248240 411256119 /nfs/dbraw/zinc/25/61/19/411256119.db2.gz IPRIUBLYWMWBCL-SNVBAGLBSA-N 2 0 224.373 2.091 20 0 BEADRP CC(C)C[C@@H]([NH3+])C[NH2+]C[C@H](C)c1ccccn1 ZINC000656782375 411359765 /nfs/dbraw/zinc/35/97/65/411359765.db2.gz FNWIXUNADCMYQH-QWHCGFSZSA-N 2 0 235.375 2.148 20 0 BEADRP CC(C)C[C@H](C)C[N@H+](C)CC(C)(C)N ZINC000656785363 411360323 /nfs/dbraw/zinc/36/03/23/411360323.db2.gz NSVDOBWRBLHPFA-NSHDSACASA-N 2 0 200.370 2.338 20 0 BEADRP C[C@H](C[C@H]1CCC[NH2+]1)[NH2+]C[C@H](C)c1ccccn1 ZINC000656782018 411360466 /nfs/dbraw/zinc/36/04/66/411360466.db2.gz CQPFEEXOGQDTOR-BFHYXJOUSA-N 2 0 247.386 2.305 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH+]1CCC([C@H]2CCC[NH2+]C2)CC1 ZINC000656784321 411361160 /nfs/dbraw/zinc/36/11/60/411361160.db2.gz AJGXPZJOHZHAFZ-VHDGCEQUSA-N 2 0 236.403 2.354 20 0 BEADRP CC1(C[NH+]2CCC([C@H]3CCC[NH2+]C3)CC2)CC1 ZINC000656786101 411364036 /nfs/dbraw/zinc/36/40/36/411364036.db2.gz KMNFGKRXEWZAOS-AWEZNQCLSA-N 2 0 236.403 2.498 20 0 BEADRP C([C@H]1CCC[NH2+]C1)[NH+]1CCC(C2CCC2)CC1 ZINC000656787537 411365815 /nfs/dbraw/zinc/36/58/15/411365815.db2.gz MABBKPAQLJLFRQ-ZDUSSCGKSA-N 2 0 236.403 2.498 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]CC2([NH3+])CCCC2)C1 ZINC000656789309 411368685 /nfs/dbraw/zinc/36/86/85/411368685.db2.gz MIPDNXYRKRVJRI-NEPJUHHUSA-N 2 0 210.365 2.426 20 0 BEADRP COc1cccc([C@@]2(C)CC[N@H+](CCC[NH3+])C2)c1 ZINC000656791420 411370474 /nfs/dbraw/zinc/37/04/74/411370474.db2.gz GACHHSWXKYBLAA-HNNXBMFYSA-N 2 0 248.370 2.007 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCCc2ccco2)CC[N@@H+]1C ZINC000658327779 411335902 /nfs/dbraw/zinc/33/59/02/411335902.db2.gz RKCPLCCSXOPDOO-OLZOCXBDSA-N 2 0 236.359 2.285 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[C@@H]2C1)[C@@H]1CCCC[NH2+]1 ZINC000403324306 411341914 /nfs/dbraw/zinc/34/19/14/411341914.db2.gz NHWMKFWSTAXABL-MRTXSQPYSA-N 2 0 222.376 2.295 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000403423585 411345082 /nfs/dbraw/zinc/34/50/82/411345082.db2.gz WQPFKCGNXXQKDQ-ITGHMWBKSA-N 2 0 222.376 2.282 20 0 BEADRP CC[N@H+](C[C@H](O)C[NH+](C)C(C)C)[C@@H](C)C(C)C ZINC000659858238 411348257 /nfs/dbraw/zinc/34/82/57/411348257.db2.gz WAPHEKKIELVHOZ-UONOGXRCSA-N 2 0 244.423 2.054 20 0 BEADRP CC1=CC[N@H+](Cc2ccc(C[NH3+])cc2)CC1 ZINC000075423277 168114540 /nfs/dbraw/zinc/11/45/40/168114540.db2.gz IRZBOTUQHBPTJJ-UHFFFAOYSA-N 2 0 216.328 2.297 20 0 BEADRP CC1=CC[C@H]([NH2+][C@H](C)Cn2ccnc2)CC1 ZINC000294260772 168121799 /nfs/dbraw/zinc/12/17/99/168121799.db2.gz NUTSYPPYDNYOLX-OLZOCXBDSA-N 2 0 219.332 2.360 20 0 BEADRP CC1CCC(C[NH2+]C2CC[NH2+]CC2)CC1 ZINC000063144897 168155324 /nfs/dbraw/zinc/15/53/24/168155324.db2.gz AELIQLMWAILUBP-UHFFFAOYSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+]CCC[NH+]1CCC(C)CC1 ZINC000336777967 168179207 /nfs/dbraw/zinc/17/92/07/168179207.db2.gz JZVDVVXEVOOXNL-ZIAGYGMSSA-N 2 0 224.392 2.354 20 0 BEADRP Cc1cccnc1C[N@H+]1CCC[C@H](C)[C@H]1CC[NH3+] ZINC000404286476 411388420 /nfs/dbraw/zinc/38/84/20/411388420.db2.gz IFRGYDIYQKEJGH-DZGCQCFKSA-N 2 0 247.386 2.339 20 0 BEADRP C[N@H+](CC1CC=CC1)C[C@@H]1CCC[NH+](C)C1 ZINC000659945409 411389813 /nfs/dbraw/zinc/38/98/13/411389813.db2.gz BGFGHIZKMQKLMB-CQSZACIVSA-N 2 0 222.376 2.226 20 0 BEADRP C[C@H]([NH2+]CCC1CC[NH2+]CC1)c1nccs1 ZINC000070733418 411384710 /nfs/dbraw/zinc/38/47/10/411384710.db2.gz ROGSSYLMJNZDIE-JTQLQIEISA-N 2 0 239.388 2.183 20 0 BEADRP CC[C@@H]1C[C@H]([NH2+]CCC[NH+](CC)CC)CCO1 ZINC000070344706 411391922 /nfs/dbraw/zinc/39/19/22/411391922.db2.gz DJJDPTRXGMARQR-ZIAGYGMSSA-N 2 0 242.407 2.266 20 0 BEADRP CCC(C)(C)CC[N@@H+]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000357075965 168276955 /nfs/dbraw/zinc/27/69/55/168276955.db2.gz JNKMEHOBIWIRMS-OLZOCXBDSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@H]1CCC[N@H+](CCc2cccnc2)[C@@H]1CC[NH3+] ZINC000404278375 411387407 /nfs/dbraw/zinc/38/74/07/411387407.db2.gz CFKZIHIIIGFBKE-DZGCQCFKSA-N 2 0 247.386 2.073 20 0 BEADRP CC[C@@H]1C[C@H]([NH2+]CCC[NH+]2CCCC2)CCO1 ZINC000070346242 411391994 /nfs/dbraw/zinc/39/19/94/411391994.db2.gz CIONQECJLPLYPO-ZIAGYGMSSA-N 2 0 240.391 2.020 20 0 BEADRP Cc1ccc(C[N@H+]2CCC[C@@H](C)[C@@H]2CC[NH3+])nc1 ZINC000404407978 411394173 /nfs/dbraw/zinc/39/41/73/411394173.db2.gz AZRWPCPQFPQRID-HIFRSBDPSA-N 2 0 247.386 2.339 20 0 BEADRP C[C@@H]1CCC[N@H+](C[C@H]2CCSC2)[C@@H]1CC[NH3+] ZINC000404492787 411399529 /nfs/dbraw/zinc/39/95/29/411399529.db2.gz CMFFBBHWJIJEJW-JHJVBQTASA-N 2 0 242.432 2.189 20 0 BEADRP CC[C@@H](C)[NH2+]Cc1ccccc1C[NH2+]C ZINC000404693468 411404941 /nfs/dbraw/zinc/40/49/41/411404941.db2.gz UKEADHXNDCICAK-LLVKDONJSA-N 2 0 206.333 2.294 20 0 BEADRP C[C@H]1C[N@H+](C[C@H]2CC[NH2+]C2)CCc2ccccc21 ZINC000404880764 411410951 /nfs/dbraw/zinc/41/09/51/411410951.db2.gz FVQYXAYFJZRMOH-KBPBESRZSA-N 2 0 244.382 2.258 20 0 BEADRP C[C@@]1(C[NH+]2CCC3(CC3(F)F)CC2)CC[NH2+]C1 ZINC000405118117 411417451 /nfs/dbraw/zinc/41/74/51/411417451.db2.gz UCEAFJBGVAETAE-LLVKDONJSA-N 2 0 244.329 2.107 20 0 BEADRP CC[C@@H]1C[N@@H+]([C@@H](C)c2ccncc2)CC[C@@H]1[NH3+] ZINC000122287555 411429252 /nfs/dbraw/zinc/42/92/52/411429252.db2.gz CMWOQXROWDZXLO-SCRDCRAPSA-N 2 0 233.359 2.202 20 0 BEADRP C[C@H]1CC[C@H]([NH2+]CC2=CC[N@H+](C)CC2)CS1 ZINC000655738194 411444825 /nfs/dbraw/zinc/44/48/25/411444825.db2.gz JJDJDSLKKHHUNQ-AAEUAGOBSA-N 2 0 240.416 2.122 20 0 BEADRP CC[C@H](C)[NH2+]Cc1ccnn1-c1cc[nH+]cc1 ZINC000657286924 411445786 /nfs/dbraw/zinc/44/57/86/411445786.db2.gz FKEILRWLQYLVQP-NSHDSACASA-N 2 0 230.315 2.155 20 0 BEADRP CCc1cc(OC)ccc1C[NH2+]CC[C@@H](C)[NH3+] ZINC000414824172 411448350 /nfs/dbraw/zinc/44/83/50/411448350.db2.gz QEVRVFDFNYFPKR-LLVKDONJSA-N 2 0 236.359 2.085 20 0 BEADRP CC[C@H]1C[C@@H]([NH2+]C2CC[NH+](C(C)C)CC2)CO1 ZINC000657294089 411450129 /nfs/dbraw/zinc/45/01/29/411450129.db2.gz CYUSROVXKNZVOY-KGLIPLIRSA-N 2 0 240.391 2.016 20 0 BEADRP Cc1ccc(C[NH2+]Cc2cnc3n2CCC3)cc1 ZINC000657289776 411451901 /nfs/dbraw/zinc/45/19/01/411451901.db2.gz HFWXGBGRBQPQTE-UHFFFAOYSA-N 2 0 241.338 2.428 20 0 BEADRP CC1(C)CCCC[C@H]1C[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC000659850922 411477433 /nfs/dbraw/zinc/47/74/33/411477433.db2.gz WSHZNBZKMMGSCH-MJBXVCDLSA-N 2 0 236.403 2.354 20 0 BEADRP C[C@H](CC1CC1)[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000415011672 411488053 /nfs/dbraw/zinc/48/80/53/411488053.db2.gz RFOSTJNMCACCSP-DDTOSNHZSA-N 2 0 222.376 2.153 20 0 BEADRP C[NH+](C)[C@H]1CCC[N@H+](CC2CC=CC2)CC1 ZINC000660415810 411488888 /nfs/dbraw/zinc/48/88/88/411488888.db2.gz JAJZPIPNMCZNNW-AWEZNQCLSA-N 2 0 222.376 2.369 20 0 BEADRP C[NH+](C)[C@@H]1CCC[N@H+](Cc2cccc(N)c2)CC1 ZINC000660415697 411489330 /nfs/dbraw/zinc/48/93/30/411489330.db2.gz IAZCUIFDEUOELQ-OAHLLOKOSA-N 2 0 247.386 2.185 20 0 BEADRP C([C@@H]1CC[N@H+](C[C@@H]2C[C@H]3C[C@H]3C2)C1)[NH+]1CCCC1 ZINC000659948917 411508461 /nfs/dbraw/zinc/50/84/61/411508461.db2.gz UDPRPRAZKXFNKQ-JONQDZQNSA-N 2 0 248.414 2.450 20 0 BEADRP CC1(C)C[C@@H]([N@@H+]2CCC[C@@H](c3ncc[nH]3)C2)CO1 ZINC000660077861 411534835 /nfs/dbraw/zinc/53/48/35/411534835.db2.gz QOWOZFALETTWOD-VXGBXAGGSA-N 2 0 249.358 2.157 20 0 BEADRP CC[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1ccncc1 ZINC000655803770 411518398 /nfs/dbraw/zinc/51/83/98/411518398.db2.gz DFRUIKZXSOLQPX-VHDGCEQUSA-N 2 0 247.386 2.463 20 0 BEADRP CC(C)[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)C1CC1 ZINC000655804909 411519112 /nfs/dbraw/zinc/51/91/12/411519112.db2.gz FWIOYQNXBGMHCL-YUTCNCBUSA-N 2 0 224.392 2.351 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1nccs1 ZINC000655805380 411519166 /nfs/dbraw/zinc/51/91/66/411519166.db2.gz MVDNBKPSSVJHTA-MXWKQRLJSA-N 2 0 239.388 2.134 20 0 BEADRP C[C@@H](Cc1ccoc1)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655804060 411519865 /nfs/dbraw/zinc/51/98/65/411519865.db2.gz NQYFYYMDLJQZNE-FPMFFAJLSA-N 2 0 236.359 2.140 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)C1CCCC1 ZINC000655805970 411520659 /nfs/dbraw/zinc/52/06/59/411520659.db2.gz OJILRRTVLSJNCV-BZPMIXESSA-N 2 0 224.392 2.495 20 0 BEADRP CC1CCC([NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)CC1 ZINC000655807526 411521205 /nfs/dbraw/zinc/52/12/05/411521205.db2.gz OMOZHUOGVLCNJU-LCKMOKORSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H]1CCCC[C@H]1[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655807893 411521752 /nfs/dbraw/zinc/52/17/52/411521752.db2.gz VTXQUOPHQUKIFV-IGQOVBAYSA-N 2 0 224.392 2.495 20 0 BEADRP c1cc(N2CC[NH+](CCC3CCC3)CC2)cc[nH+]1 ZINC000660002926 411526090 /nfs/dbraw/zinc/52/60/90/411526090.db2.gz CHXFZZQDKHKDNY-UHFFFAOYSA-N 2 0 245.370 2.394 20 0 BEADRP COc1cccc(C[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)c1 ZINC000655825811 411527566 /nfs/dbraw/zinc/52/75/66/411527566.db2.gz MRHDUDGVIGRVKF-OKILXGFUSA-N 2 0 248.370 2.125 20 0 BEADRP C[C@H](Cc1ccccn1)[NH2+][C@H]1CCN(C)[C@H](C)C1 ZINC000655836747 411531923 /nfs/dbraw/zinc/53/19/23/411531923.db2.gz NXLOXLSDMFTHBI-NFAWXSAZSA-N 2 0 247.386 2.085 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+]C2CC(C)(C)C2)C1 ZINC000336762606 170007455 /nfs/dbraw/zinc/00/74/55/170007455.db2.gz NZFPTAKRPMRMNC-NSHDSACASA-N 2 0 210.365 2.106 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+]CC2(SC)CCC2)C1 ZINC000304244740 170008133 /nfs/dbraw/zinc/00/81/33/170008133.db2.gz FIXLCYHQUOAEPO-LBPRGKRZSA-N 2 0 242.432 2.204 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H]2CCC2(C)C)C1 ZINC000308785937 170008931 /nfs/dbraw/zinc/00/89/31/170008931.db2.gz FNOTUNHGBBKSLK-NWDGAFQWSA-N 2 0 210.365 2.106 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH+](C)CC(C)C)C[C@@H]1C ZINC000336643811 170010175 /nfs/dbraw/zinc/01/01/75/170010175.db2.gz DSODZKHMPBFUQF-QWHCGFSZSA-N 2 0 212.381 2.447 20 0 BEADRP CC[N@@H+]1CC[C@@H](CN[C@H](C)c2ccco2)C1 ZINC000249370392 170010502 /nfs/dbraw/zinc/01/05/02/170010502.db2.gz ASVIUPXATPTTLE-NEPJUHHUSA-N 2 0 222.332 2.272 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CC2(C(F)F)CC2)[C@@H](C)C1 ZINC000355146726 170010994 /nfs/dbraw/zinc/01/09/94/170010994.db2.gz GTBURPPNQUIYEM-WDEREUQCSA-N 2 0 246.345 2.352 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CCC2(C)C)C1 ZINC000308785941 170016636 /nfs/dbraw/zinc/01/66/36/170016636.db2.gz FNOTUNHGBBKSLK-VXGBXAGGSA-N 2 0 210.365 2.106 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CCC[C@H]3C[C@]32C)C1 ZINC000337378451 170016951 /nfs/dbraw/zinc/01/69/51/170016951.db2.gz HYGNNKWLFWDWOP-LXTVHRRPSA-N 2 0 236.403 2.497 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CC[C@@H]2C2CCC2)C1 ZINC000337983865 170017359 /nfs/dbraw/zinc/01/73/59/170017359.db2.gz CHLOFLOWKSSAKB-BPLDGKMQSA-N 2 0 236.403 2.497 20 0 BEADRP CC[C@H]1C[C@H]([NH2+]CCC[N@H+](C)CC(C)C)CO1 ZINC000657501637 411538631 /nfs/dbraw/zinc/53/86/31/411538631.db2.gz YQWCUPIWVUDQML-KBPBESRZSA-N 2 0 242.407 2.121 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH+](C)CCSC)C[C@@H]1C ZINC000336652066 170017740 /nfs/dbraw/zinc/01/77/40/170017740.db2.gz WGKPKGOZMWTXRM-RYUDHWBXSA-N 2 0 230.421 2.154 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH+](C)CCCCOC)C[C@H]1C ZINC000336718076 170018624 /nfs/dbraw/zinc/01/86/24/170018624.db2.gz ZPSYWRFCHCFCJP-KGLIPLIRSA-N 2 0 242.407 2.218 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH+](C)CCSC)C[C@H]1C ZINC000336652064 170018840 /nfs/dbraw/zinc/01/88/40/170018840.db2.gz WGKPKGOZMWTXRM-NEPJUHHUSA-N 2 0 230.421 2.154 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]C[C@H]2CC2(C)C)[C@H](C)C1 ZINC000309426299 170020303 /nfs/dbraw/zinc/02/03/03/170020303.db2.gz FIFFYMMZZJRRNB-UPJWGTAASA-N 2 0 224.392 2.352 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CCCCCOC)[C@H](C)C1 ZINC000122665771 170021155 /nfs/dbraw/zinc/02/11/55/170021155.db2.gz HQKOAIOWVOXRMZ-KGLIPLIRSA-N 2 0 242.407 2.123 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CCc2ccco2)[C@@H](C)C1 ZINC000359425946 170021338 /nfs/dbraw/zinc/02/13/38/170021338.db2.gz OISFXISJZCXXBA-JSGCOSHPSA-N 2 0 236.359 2.142 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]C[C@@H]2CCSC2)[C@H](C)C1 ZINC000336779016 170021499 /nfs/dbraw/zinc/02/14/99/170021499.db2.gz MZGUFMJUXDOLFG-AGIUHOORSA-N 2 0 242.432 2.059 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H]2CC[C@H]2C)[C@H](C)C1 ZINC000336746412 170022110 /nfs/dbraw/zinc/02/21/10/170022110.db2.gz BKLBCAXYAGYYME-LPWJVIDDSA-N 2 0 210.365 2.105 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H](C)CSC)[C@@H](C)C1 ZINC000336759663 170023141 /nfs/dbraw/zinc/02/31/41/170023141.db2.gz KYOSYHILFYPIDC-SRVKXCTJSA-N 2 0 230.421 2.058 20 0 BEADRP CC[N@@H+]1C[C@@H]2CC[NH+](Cc3ccccc3)C[C@H]2C1 ZINC000307624121 170031636 /nfs/dbraw/zinc/03/16/36/170031636.db2.gz FJTSJNSPVZSZPB-JKSUJKDBSA-N 2 0 244.382 2.460 20 0 BEADRP CC[NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000034822367 170141965 /nfs/dbraw/zinc/14/19/65/170141965.db2.gz DEWAQFBNZSECFB-LBPRGKRZSA-N 2 0 236.359 2.298 20 0 BEADRP CC[NH2+]CC1CC[NH+]([C@@H](C)c2ccncc2)CC1 ZINC000131498477 411546222 /nfs/dbraw/zinc/54/62/22/411546222.db2.gz KLHCEEVUOHHJIE-ZDUSSCGKSA-N 2 0 247.386 2.464 20 0 BEADRP CC(C)(F)CC[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000657645273 411568965 /nfs/dbraw/zinc/56/89/65/411568965.db2.gz QEINEHCLXSVVHO-NEPJUHHUSA-N 2 0 228.355 2.341 20 0 BEADRP c1cc(CC[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)co1 ZINC000657653328 411570246 /nfs/dbraw/zinc/57/02/46/411570246.db2.gz JJZJZAPHNIFSGK-KBPBESRZSA-N 2 0 234.343 2.039 20 0 BEADRP c1cc2c(cc[nH+]c2NCC[NH+]2CCCCC2)[nH]1 ZINC000663390652 411645524 /nfs/dbraw/zinc/64/55/24/411645524.db2.gz RTAMTKDFNRJMDF-UHFFFAOYSA-N 2 0 244.342 2.461 20 0 BEADRP Cc1ncc(C[NH2+][C@H](C(C)C)C2CC2)n1C ZINC000657757312 411590293 /nfs/dbraw/zinc/59/02/93/411590293.db2.gz QDTJKVPEKSPCHC-CYBMUJFWSA-N 2 0 221.348 2.253 20 0 BEADRP C[C@H]([NH2+]CCC[NH+](C)C)C(C)(C)C(F)F ZINC000657816066 411604798 /nfs/dbraw/zinc/60/47/98/411604798.db2.gz HNLGBZWRSKNFEY-VIFPVBQESA-N 2 0 222.323 2.208 20 0 BEADRP C[N@@H+]1CC[C@@]2(CC[NH+](C[C@@H]3C[C@H]4C[C@H]4C3)C2)C1 ZINC000660616371 411607747 /nfs/dbraw/zinc/60/77/47/411607747.db2.gz KNASTAGBDUKUFA-LXTVHRRPSA-N 2 0 234.387 2.060 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+]C2CC(CF)(CF)C2)C1 ZINC000657841045 411609969 /nfs/dbraw/zinc/60/99/69/411609969.db2.gz MKMJRRIXNLRDCR-LLVKDONJSA-N 2 0 246.345 2.006 20 0 BEADRP CC(C)=CC[NH+]1CCC[C@]2(CC[N@@H+](C)C2)C1 ZINC000660653895 411613161 /nfs/dbraw/zinc/61/31/61/411613161.db2.gz DISVALVPVFMDTH-CQSZACIVSA-N 2 0 222.376 2.370 20 0 BEADRP CCCC[N@@H+]1CCC[C@@]2(CC[NH+](C)C2)C1 ZINC000660656768 411614403 /nfs/dbraw/zinc/61/44/03/411614403.db2.gz XPWBGUYTNYFMLJ-ZDUSSCGKSA-N 2 0 210.365 2.204 20 0 BEADRP CC[C@H](C)[N@@H+]1CCC[C@]2(CC[NH+](C)C2)C1 ZINC000660662368 411615503 /nfs/dbraw/zinc/61/55/03/411615503.db2.gz IXACTWLAMYJZHK-QWHCGFSZSA-N 2 0 210.365 2.203 20 0 BEADRP COc1ccc(C[NH2+]CC[C@@H]([NH3+])C(C)C)cc1 ZINC000663497727 411679027 /nfs/dbraw/zinc/67/90/27/411679027.db2.gz FIGIRUSLPKYJMZ-CQSZACIVSA-N 2 0 236.359 2.158 20 0 BEADRP CC[C@H]1CCC[C@H]([NH2+]CC23CC(C2)C[NH2+]3)C1 ZINC000663497768 411679212 /nfs/dbraw/zinc/67/92/12/411679212.db2.gz JVPPRTLRGUKHNS-AHPWVWPOSA-N 2 0 222.376 2.297 20 0 BEADRP CCCC(CCC)[NH2+]CC12CC(C1)C[NH2+]2 ZINC000663497863 411679912 /nfs/dbraw/zinc/67/99/12/411679912.db2.gz LATJCNYVOKNSLD-UHFFFAOYSA-N 2 0 210.365 2.297 20 0 BEADRP CCC[C@@H](C)C[NH2+]CC[C@@H]([NH3+])C(C)C ZINC000663499222 411680535 /nfs/dbraw/zinc/68/05/35/411680535.db2.gz GZACLVSXPIFAEC-VXGBXAGGSA-N 2 0 200.370 2.386 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+]Cc1cc(F)cc(F)c1 ZINC000663500420 411682838 /nfs/dbraw/zinc/68/28/38/411682838.db2.gz RVYMXTSLDWZWIG-CYBMUJFWSA-N 2 0 242.313 2.428 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+]C1Cc2ccccc2C1 ZINC000663504293 411687863 /nfs/dbraw/zinc/68/78/63/411687863.db2.gz YLQOIOKLWCOJGS-OAHLLOKOSA-N 2 0 232.371 2.117 20 0 BEADRP C[NH2+]C[C@H](C)[NH2+][C@@H]1CCC[C@@H](C2CC2)C1 ZINC000663509283 411691905 /nfs/dbraw/zinc/69/19/05/411691905.db2.gz IQJWPNRHMBRXDP-CYZMBNFOSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@H](C)C[C@H](CC)[NH2+][C@H](C)C[NH2+]C ZINC000663514828 411692872 /nfs/dbraw/zinc/69/28/72/411692872.db2.gz UKOQVGFPTSSVHV-TUAOUCFPSA-N 2 0 200.370 2.399 20 0 BEADRP C[C@@H]1C[C@@H](C[N@H+](C)C[C@H]2CC2(C)C)CC[NH2+]1 ZINC000663513122 411694524 /nfs/dbraw/zinc/69/45/24/411694524.db2.gz ILZBCPUDLDCFSU-FRRDWIJNSA-N 2 0 224.392 2.352 20 0 BEADRP CCSCC[C@@H](C)[NH2+][C@H](C)CCC[NH3+] ZINC000308636323 170641860 /nfs/dbraw/zinc/64/18/60/170641860.db2.gz AZUKVNGWLGRDRW-GHMZBOCLSA-N 2 0 218.410 2.235 20 0 BEADRP C[NH+](C)C1(CNc2[nH+]ccc3[nH]ccc32)CC1 ZINC000664022042 411816878 /nfs/dbraw/zinc/81/68/78/411816878.db2.gz NNUKGRYKNGQZHS-UHFFFAOYSA-N 2 0 230.315 2.069 20 0 BEADRP CCc1cc(NC[C@@H]2CC[N@@H+]2C(C)(C)C)cc[nH+]1 ZINC000664139583 411867724 /nfs/dbraw/zinc/86/77/24/411867724.db2.gz WUWRTCHHSQWNKU-AWEZNQCLSA-N 2 0 247.386 2.351 20 0 BEADRP C[C@H]([NH2+]CCn1ccnc1)C1CCC(F)CC1 ZINC000662001426 411938958 /nfs/dbraw/zinc/93/89/58/411938958.db2.gz MIOISTOFGYKLNV-HIFPTAJRSA-N 2 0 239.338 2.390 20 0 BEADRP Cc1cc(N[C@H](C)C[NH+]2CCC(C)CC2)cc[nH+]1 ZINC000664454242 411961317 /nfs/dbraw/zinc/96/13/17/411961317.db2.gz FCLSFCKVUTYKCM-CQSZACIVSA-N 2 0 247.386 2.344 20 0 BEADRP C([C@@H]1C[C@H]2C[C@H]2C1)[N@H+](C1CC1)C1CC[NH2+]CC1 ZINC000662233520 412032186 /nfs/dbraw/zinc/03/21/86/412032186.db2.gz GGUUDGSXXPCQIX-CLLJXQQHSA-N 2 0 234.387 2.249 20 0 BEADRP CC(C)[C@@H]([NH3+])CC[N@H+](C)CC1CC=CC1 ZINC000662247809 412037488 /nfs/dbraw/zinc/03/74/88/412037488.db2.gz LOCKZNMTLZBEJZ-ZDUSSCGKSA-N 2 0 210.365 2.258 20 0 BEADRP c1ccc2c(c1)CC[C@H]2CC[N@@H+]1CCC[NH2+]CC1 ZINC000662240791 412037737 /nfs/dbraw/zinc/03/77/37/412037737.db2.gz MSAGLSJTQKATJY-HNNXBMFYSA-N 2 0 244.382 2.402 20 0 BEADRP CC[NH2+]CC1CC[NH+](CC2CC=CC2)CC1 ZINC000662243389 412039172 /nfs/dbraw/zinc/03/91/72/412039172.db2.gz CSKGDNBVCCATSK-UHFFFAOYSA-N 2 0 222.376 2.274 20 0 BEADRP C1=CCC(C[NH+]2CCC([NH2+]CC3CC3)CC2)C1 ZINC000662243442 412039523 /nfs/dbraw/zinc/03/95/23/412039523.db2.gz BBZZAENADCKMID-UHFFFAOYSA-N 2 0 234.387 2.417 20 0 BEADRP CC[C@H](CC(F)F)C[N@@H+]1CC[C@H]([NH3+])[C@@H](C)C1 ZINC000662245504 412042146 /nfs/dbraw/zinc/04/21/46/412042146.db2.gz RTNWMUKWTVGKCO-AXFHLTTASA-N 2 0 234.334 2.337 20 0 BEADRP CC(C)=CCC[N@H+]1CCC[C@H]([C@H](C)[NH3+])C1 ZINC000662245763 412043175 /nfs/dbraw/zinc/04/31/75/412043175.db2.gz OKZXUSFQLABCMR-STQMWFEESA-N 2 0 210.365 2.402 20 0 BEADRP CC[C@@H](C)N(C)CC[NH2+][C@H]1CC[C@H]1CC ZINC000309176730 171041597 /nfs/dbraw/zinc/04/15/97/171041597.db2.gz MZDCAGBXUCASBM-UPJWGTAASA-N 2 0 212.381 2.495 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]CCN1CC=C(C)CC1 ZINC000336733961 171041864 /nfs/dbraw/zinc/04/18/64/171041864.db2.gz KODKFRSPGRQMKN-KGLIPLIRSA-N 2 0 222.376 2.417 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]C[C@H]1CCC[N@H+](CC)C1 ZINC000310036767 171043927 /nfs/dbraw/zinc/04/39/27/171043927.db2.gz UNXCJDIKDNUZMF-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000310018932 171058832 /nfs/dbraw/zinc/05/88/32/171058832.db2.gz MGCCUOQCNXHRPB-OUCADQQQSA-N 2 0 222.376 2.249 20 0 BEADRP CC[C@H]1C[N@H+](CC2CC=CC2)CC[C@@H]1[NH3+] ZINC000662270853 412062482 /nfs/dbraw/zinc/06/24/82/412062482.db2.gz PZZXQZTUMOPXIU-STQMWFEESA-N 2 0 208.349 2.012 20 0 BEADRP C1=CCC(C[N@@H+]2CCCC[C@H]2[C@@H]2CC[NH2+]C2)C1 ZINC000662276492 412068967 /nfs/dbraw/zinc/06/89/67/412068967.db2.gz NMMNFJQUMUFXIO-CABCVRRESA-N 2 0 234.387 2.417 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]1[NH2+]C[C@@H]1C[C@H]2C[C@H]2C1 ZINC000662278168 412071207 /nfs/dbraw/zinc/07/12/07/412071207.db2.gz XAKHIWVKFUKSII-YVECIDJPSA-N 2 0 222.376 2.010 20 0 BEADRP [NH3+][C@@H]1CCCC[C@H]1[NH2+]C[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000662284726 412074440 /nfs/dbraw/zinc/07/44/40/412074440.db2.gz ZBAOMDHDNDXYFS-RKQHYHRCSA-N 2 0 222.376 2.282 20 0 BEADRP CC[C@H](C)C[NH+]1CCC2(CC[NH2+]C2)CC1 ZINC000335612164 171279603 /nfs/dbraw/zinc/27/96/03/171279603.db2.gz LAKZODKZDOVDCT-LBPRGKRZSA-N 2 0 210.365 2.108 20 0 BEADRP CC[C@H](C)C[NH+]1CCC([C@@H]2CC[NH2+]C2)CC1 ZINC000357047062 171279649 /nfs/dbraw/zinc/27/96/49/171279649.db2.gz IYVLSRPQBPLEQL-GXTWGEPZSA-N 2 0 224.392 2.354 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000335570590 171279729 /nfs/dbraw/zinc/27/97/29/171279729.db2.gz LPCHEWUWSANWQF-LBPRGKRZSA-N 2 0 210.365 2.108 20 0 BEADRP CC[C@H](C)C[C@H](CC)[NH2+][C@@H]1CCN(C)C1 ZINC000042544790 171298888 /nfs/dbraw/zinc/29/88/88/171298888.db2.gz YTZGWYJAGBGQIG-RWMBFGLXSA-N 2 0 212.381 2.495 20 0 BEADRP CC[C@H](C)[NH+]1CCC([C@@H]2CCC[NH2+]C2)CC1 ZINC000662291317 412080353 /nfs/dbraw/zinc/08/03/53/412080353.db2.gz DNDCZGFYYKTLGY-GXTWGEPZSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H](C)[N@@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000662294072 412082128 /nfs/dbraw/zinc/08/21/28/412082128.db2.gz OSDQDVFDNJQEMX-OCCSQVGLSA-N 2 0 224.392 2.497 20 0 BEADRP CC[NH+](CC)CCC[N@@H+]1CC2CC1(C)C2 ZINC000662385629 412138116 /nfs/dbraw/zinc/13/81/16/412138116.db2.gz YLYKOQADXIQBKQ-UHFFFAOYSA-N 2 0 210.365 2.203 20 0 BEADRP CC[C@H](C)[C@H](C)[N@H+](CCC[NH2+]C)C1CC1 ZINC000336674216 171386381 /nfs/dbraw/zinc/38/63/81/171386381.db2.gz KBVBWKQULVASRN-RYUDHWBXSA-N 2 0 212.381 2.495 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCc2ccccc2C(C)(C)C1 ZINC000662299664 412086340 /nfs/dbraw/zinc/08/63/40/412086340.db2.gz UHNVYFRDCPGFLL-UHFFFAOYSA-N 2 0 246.398 2.432 20 0 BEADRP C[C@@H](c1ccc(F)cc1)N1CC2CC1(C[NH3+])C2 ZINC000662304407 412088443 /nfs/dbraw/zinc/08/84/43/412088443.db2.gz RIVGUOHQXNEPPV-IFQILLTASA-N 2 0 234.318 2.310 20 0 BEADRP [NH3+]CC12CC(C1)CN2CCCC1CCCC1 ZINC000662304377 412089072 /nfs/dbraw/zinc/08/90/72/412089072.db2.gz PRMBCCPMNNONRU-UHFFFAOYSA-N 2 0 222.376 2.380 20 0 BEADRP Cc1cccc(C)c1CN1CC2CC1(C[NH3+])C2 ZINC000662304408 412089620 /nfs/dbraw/zinc/08/96/20/412089620.db2.gz RJGFNRUILWHOOR-UHFFFAOYSA-N 2 0 230.355 2.227 20 0 BEADRP FCC[C@H]1CCC[N@H+](CC[C@@H]2CCC[NH2+]C2)C1 ZINC000662312694 412094661 /nfs/dbraw/zinc/09/46/61/412094661.db2.gz YZFNCJNMYYYBBR-UONOGXRCSA-N 2 0 242.382 2.448 20 0 BEADRP CC(C)OCC[N@@H+]1CCC[C@@H](C)[C@H]1CCC[NH3+] ZINC000662315911 412096156 /nfs/dbraw/zinc/09/61/56/412096156.db2.gz VDZFXKDNCXEQOH-ZIAGYGMSSA-N 2 0 242.407 2.251 20 0 BEADRP c1cc(C[N@@H+]2CC[C@@H]3C[C@@H]3C2)c2c(c1)C[NH2+]CC2 ZINC000662315952 412096581 /nfs/dbraw/zinc/09/65/81/412096581.db2.gz RGLKEJQLFXUBKS-IUODEOHRSA-N 2 0 242.366 2.174 20 0 BEADRP C(C[N@@H+]1CCC[C@H](C2CCC2)C1)[C@@H]1CC[NH2+]C1 ZINC000662317277 412098477 /nfs/dbraw/zinc/09/84/77/412098477.db2.gz OBGLBTOOXMSJLK-ZFWWWQNUSA-N 2 0 236.403 2.498 20 0 BEADRP CC12CC(C1)C[N@@H+]2CCCC1CC[NH2+]CC1 ZINC000662336788 412108476 /nfs/dbraw/zinc/10/84/76/412108476.db2.gz GSVLGURDHDESCI-UHFFFAOYSA-N 2 0 222.376 2.251 20 0 BEADRP C[N@H+](CC[C@H]1CCC[NH+]1C)C[C@@H]1CC1(C)C ZINC000662345688 412115116 /nfs/dbraw/zinc/11/51/16/412115116.db2.gz LCEFZRZFNCCBPN-QWHCGFSZSA-N 2 0 224.392 2.449 20 0 BEADRP CC[C@H](COCC1CC1)[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000665236514 412177225 /nfs/dbraw/zinc/17/72/25/412177225.db2.gz OIVGIZYCBDEIEF-MJBXVCDLSA-N 2 0 240.391 2.051 20 0 BEADRP CC[C@H](C)CC[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000665238385 412177761 /nfs/dbraw/zinc/17/77/61/412177761.db2.gz XGCZGQJMJXBMTN-XDQVBPFNSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@H](C)C[C@H](C)C1)C1C[NH2+]C1 ZINC000665239613 412180068 /nfs/dbraw/zinc/18/00/68/412180068.db2.gz VVVMQMFFYUQQIS-XQHKEYJVSA-N 2 0 224.392 2.256 20 0 BEADRP C[C@@H]([NH2+]CC1([NH3+])CCCC1)C1CCCC1 ZINC000665249783 412194998 /nfs/dbraw/zinc/19/49/98/412194998.db2.gz ZFCAIGHOTSQQTH-LLVKDONJSA-N 2 0 210.365 2.426 20 0 BEADRP CC(C)(F)CC[NH2+][C@H]1CCCCC[C@H]1[NH3+] ZINC000665261789 412203782 /nfs/dbraw/zinc/20/37/82/412203782.db2.gz LKPMHRMWNONLPG-MNOVXSKESA-N 2 0 216.344 2.374 20 0 BEADRP CC(C)(F)CC[NH2+]C1CCC(C[NH3+])CC1 ZINC000665261397 412204355 /nfs/dbraw/zinc/20/43/55/412204355.db2.gz BDUGTBBVGOWJCM-UHFFFAOYSA-N 2 0 216.344 2.232 20 0 BEADRP C([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)[C@H]1CCC[C@@H]2C[C@@H]21 ZINC000665263398 412205602 /nfs/dbraw/zinc/20/56/02/412205602.db2.gz LSRWKKJEQCCNBT-FWXGHANASA-N 2 0 248.414 2.400 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]CCCC1CCC1 ZINC000665267236 412210312 /nfs/dbraw/zinc/21/03/12/412210312.db2.gz SIAGYZREEKTJTK-STQMWFEESA-N 2 0 210.365 2.284 20 0 BEADRP C[C@@H]([NH2+]CCCC1CCC1)[C@H]1CCC[NH2+]1 ZINC000665267487 412210779 /nfs/dbraw/zinc/21/07/79/412210779.db2.gz XOFSRDPNADRGNI-DGCLKSJQSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]([NH2+]CCCC1CCC1)[C@@H]1CCC[NH2+]1 ZINC000665267486 412211241 /nfs/dbraw/zinc/21/12/41/412211241.db2.gz XOFSRDPNADRGNI-AAEUAGOBSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]([NH2+][C@@H](C)C1CCC(F)CC1)C1C[NH2+]C1 ZINC000665274648 412213455 /nfs/dbraw/zinc/21/34/55/412213455.db2.gz VCXNTVYCGVGDMI-QKIYJJFGSA-N 2 0 228.355 2.101 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCCCC[C@H]1[NH3+])c1ccccn1 ZINC000665231993 412168371 /nfs/dbraw/zinc/16/83/71/412168371.db2.gz CUYRDYAHPXDTEG-NFAWXSAZSA-N 2 0 247.386 2.435 20 0 BEADRP CC1(C)[C@H](C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)C1(F)F ZINC000665274799 412217045 /nfs/dbraw/zinc/21/70/45/412217045.db2.gz YOYFCEQJVGPCNP-AEJSXWLSSA-N 2 0 232.318 2.137 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]C1CCC2(CC2(F)F)CC1 ZINC000665274347 412217628 /nfs/dbraw/zinc/21/76/28/412217628.db2.gz OOJQBATTXPGHCJ-BFUDSRACSA-N 2 0 244.329 2.424 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+]CC1=CCCC1 ZINC000665274166 412217772 /nfs/dbraw/zinc/21/77/72/412217772.db2.gz LHHOXQVAEMYHHW-OLZOCXBDSA-N 2 0 208.349 2.204 20 0 BEADRP C[C@H]1CCC[C@H](C)C1[NH2+]CC12CC(C1)C[NH2+]2 ZINC000665277552 412220366 /nfs/dbraw/zinc/22/03/66/412220366.db2.gz FHIXUYNPPSMRPT-PZFKGIAWSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]([NH2+]CC12CC(C1)C[NH2+]2)C1C(C)(C)C1(C)C ZINC000665279233 412222786 /nfs/dbraw/zinc/22/27/86/412222786.db2.gz ZTYDIYUAIRNHLA-RWWNRMGGSA-N 2 0 236.403 2.399 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+][C@H](C)c1cccc(O)c1 ZINC000665280412 412225390 /nfs/dbraw/zinc/22/53/90/412225390.db2.gz AHNLQSPSRMVLEA-BXUZGUMPSA-N 2 0 236.359 2.416 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+][C@@H](C)c1ccoc1 ZINC000665281002 412226280 /nfs/dbraw/zinc/22/62/80/412226280.db2.gz RKMCOOPDLKOLRP-CMPLNLGQSA-N 2 0 210.321 2.304 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+][C@H](C(C)C)C1CC1 ZINC000665281312 412226410 /nfs/dbraw/zinc/22/64/10/412226410.db2.gz ZMMTZQBQHFMYLY-CHWSQXEVSA-N 2 0 212.381 2.384 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+][C@@H](C)Cc1ccoc1 ZINC000665282415 412227731 /nfs/dbraw/zinc/22/77/31/412227731.db2.gz XTRAQBIJJFEDJS-WCQYABFASA-N 2 0 224.348 2.174 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+][C@@H]1CCCc2cccnc21 ZINC000665282206 412228018 /nfs/dbraw/zinc/22/80/18/412228018.db2.gz SVOYUKVQXJYRGU-ZIAGYGMSSA-N 2 0 247.386 2.422 20 0 BEADRP CC[C@H]([NH2+]CC[C@@H]([NH3+])C(C)C)c1ccncc1 ZINC000665282536 412228091 /nfs/dbraw/zinc/22/80/91/412228091.db2.gz ZVYYNCKAYHYJIZ-KGLIPLIRSA-N 2 0 235.375 2.496 20 0 BEADRP CC(C)[C@H]([NH3+])CCN[C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000665283717 412228809 /nfs/dbraw/zinc/22/88/09/412228809.db2.gz SUFVRJHMSPORKC-KFWWJZLASA-N 2 0 247.386 2.094 20 0 BEADRP CC[C@H]([NH2+]CCCc1ccco1)[C@@H]1CCC[NH2+]1 ZINC000665283990 412229378 /nfs/dbraw/zinc/22/93/78/412229378.db2.gz YLHNSPVLAUIRGY-KBPBESRZSA-N 2 0 236.359 2.332 20 0 BEADRP c1coc(CCC[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)c1 ZINC000665283723 412229669 /nfs/dbraw/zinc/22/96/69/412229669.db2.gz SWGFDKUNEMOIQW-MGPQQGTHSA-N 2 0 248.370 2.190 20 0 BEADRP COc1cccc(C[NH2+][C@@H](C)C[C@H](C)[NH3+])c1C ZINC000665294830 412240265 /nfs/dbraw/zinc/24/02/65/412240265.db2.gz XIGIGBULIMNYGX-QWRGUYRKSA-N 2 0 236.359 2.219 20 0 BEADRP C[NH2+]C[C@H](C)[NH2+][C@H]1CCCC[C@@H]1C(C)C ZINC000665295467 412243379 /nfs/dbraw/zinc/24/33/79/412243379.db2.gz DTIRZASTWYVXRH-XQQFMLRXSA-N 2 0 212.381 2.399 20 0 BEADRP C[NH2+]C[C@@H](C)[NH2+][C@@H](C)C1C(C)(C)C1(C)C ZINC000665296710 412245241 /nfs/dbraw/zinc/24/52/41/412245241.db2.gz WZMOHBPTTIPVBM-ZJUUUORDSA-N 2 0 212.381 2.255 20 0 BEADRP CC[C@H]1CC[C@H]1[NH2+]CCC[NH+]1CCCC1 ZINC000336764686 171648307 /nfs/dbraw/zinc/64/83/07/171648307.db2.gz QASJUDUEYQRTKS-QWHCGFSZSA-N 2 0 210.365 2.251 20 0 BEADRP CCc1ncc(C[NH2+]CCCC[NH+](C)C)s1 ZINC000045664200 172018243 /nfs/dbraw/zinc/01/82/43/172018243.db2.gz UVZOKLIWELWVHT-UHFFFAOYSA-N 2 0 241.404 2.137 20 0 BEADRP CCc1nccn1Cc1cn2ccccc2n1 ZINC000104287290 172027715 /nfs/dbraw/zinc/02/77/15/172027715.db2.gz FQVBZJJWPSSTQI-UHFFFAOYSA-N 2 0 226.283 2.142 20 0 BEADRP CC[C@@H]([NH2+][C@H](C)C1CC[NH+](C)CC1)C1CC1 ZINC000324512977 487624864 /nfs/dbraw/zinc/62/48/64/487624864.db2.gz USTKKLNBXCSWQX-BXUZGUMPSA-N 2 0 224.392 2.495 20 0 BEADRP C[NH+]1CCC([C@H]2CC[N@H+](Cc3ccco3)C2)CC1 ZINC000290331651 173000009 /nfs/dbraw/zinc/00/00/09/173000009.db2.gz DURYXNJJFIGBHD-AWEZNQCLSA-N 2 0 248.370 2.443 20 0 BEADRP C[N@@H+]1CCC[C@@H]1CC[NH+]1CCC12CCC2 ZINC000336555779 173029126 /nfs/dbraw/zinc/02/91/26/173029126.db2.gz UYCDBVHCCUTNIO-GFCCVEGCSA-N 2 0 208.349 2.099 20 0 BEADRP C[N@@H+]1CCC[C@H]2C[NH+](CCC3CC3)CC[C@@H]21 ZINC000335904936 173059160 /nfs/dbraw/zinc/05/91/60/173059160.db2.gz NYEYWFWAYBDVLA-KBPBESRZSA-N 2 0 222.376 2.203 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CCCCF)[C@@H]2CCC[C@@H]21 ZINC000336763902 173152056 /nfs/dbraw/zinc/15/20/56/173152056.db2.gz MQQDKERDGRPLFF-AVGNSLFASA-N 2 0 228.355 2.199 20 0 BEADRP C[N@H+]1C[C@@H]2C[NH+]([C@@H]3CCC(C)(C)C3)C[C@@H]2C1 ZINC000375733654 173197198 /nfs/dbraw/zinc/19/71/98/173197198.db2.gz BWHAPWVFJWFTFO-FRRDWIJNSA-N 2 0 222.376 2.059 20 0 BEADRP C[NH2+]C1CC[NH+](CCCc2ccccc2)CC1 ZINC000037653810 173322821 /nfs/dbraw/zinc/32/28/21/173322821.db2.gz FNWNXJLKTDSKRL-UHFFFAOYSA-N 2 0 232.371 2.303 20 0 BEADRP C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000054627697 173323563 /nfs/dbraw/zinc/32/35/63/173323563.db2.gz HLTSXIQQDWKWBM-GOOCMWNKSA-N 2 0 230.355 2.401 20 0 BEADRP C[NH2+]CC1CC[NH+]([C@@H](C)c2ccccn2)CC1 ZINC000063158979 173338711 /nfs/dbraw/zinc/33/87/11/173338711.db2.gz FFMSJKLHYXIDOT-LBPRGKRZSA-N 2 0 233.359 2.074 20 0 BEADRP C[NH2+]CC1CC[NH+](CC2CCCCC2)CC1 ZINC000011889138 173338775 /nfs/dbraw/zinc/33/87/75/173338775.db2.gz HTFKDJUBTUXOAQ-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP C[NH2+]CCC[N@H+](C)[C@@H](C)c1ccccc1 ZINC000077299949 173346400 /nfs/dbraw/zinc/34/64/00/173346400.db2.gz UHVUAVYWAXSXBP-LBPRGKRZSA-N 2 0 206.333 2.289 20 0 BEADRP C[NH2+]CCC[NH+](CC(C)C)CC(C)C ZINC000042409737 173346732 /nfs/dbraw/zinc/34/67/32/173346732.db2.gz DWQJLBUAQYZCQB-UHFFFAOYSA-N 2 0 200.370 2.210 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCC[C@H](CC(C)C)C1 ZINC000309651968 173346792 /nfs/dbraw/zinc/34/67/92/173346792.db2.gz UBKZHZPLVKEOQK-CYBMUJFWSA-N 2 0 212.381 2.354 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCC2(C1)CCCCC2 ZINC000308940075 173347561 /nfs/dbraw/zinc/34/75/61/173347561.db2.gz RNBUPAXZUIGSFP-UHFFFAOYSA-N 2 0 210.365 2.252 20 0 BEADRP C[NH2+]CCC[NH2+]Cc1ccc(C)c(C)c1 ZINC000083344896 173349096 /nfs/dbraw/zinc/34/90/96/173349096.db2.gz FLTMGFIZPHHUDO-UHFFFAOYSA-N 2 0 206.333 2.003 20 0 BEADRP C[NH2+]CCN(C)c1cc(C)[nH+]c2ccccc21 ZINC000053663827 173353510 /nfs/dbraw/zinc/35/35/10/173353510.db2.gz NWFNRYPOGHFXLF-UHFFFAOYSA-N 2 0 229.327 2.199 20 0 BEADRP C[NH2+]C[C@@H]1CCC[N@@H+]1C[C@@H](C)CC(C)C ZINC000300967075 173368774 /nfs/dbraw/zinc/36/87/74/173368774.db2.gz RPZLXPUGISVTFU-STQMWFEESA-N 2 0 212.381 2.352 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](C[C@@H]2CCC[C@@H](C)C2)C1 ZINC000227550575 173370689 /nfs/dbraw/zinc/37/06/89/173370689.db2.gz GNDJYIUWQFTCNE-MCIONIFRSA-N 2 0 224.392 2.354 20 0 BEADRP C[NH2+]C[C@H]1CCC[N@H+](Cc2sccc2C)C1 ZINC000040591979 173378477 /nfs/dbraw/zinc/37/84/77/173378477.db2.gz HJQUDXYRXVLKEL-GFCCVEGCSA-N 2 0 238.400 2.488 20 0 BEADRP C[NH2+]C[C@H]1CCC[N@@H+](C2CCC(C)CC2)C1 ZINC000040591847 173378482 /nfs/dbraw/zinc/37/84/82/173378482.db2.gz HACMNYTVYYRJQE-ROKHWSDSSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH2+]C[C@H]1CC[N@H+](CC2CCCCC2)C1 ZINC000053031003 173380802 /nfs/dbraw/zinc/38/08/02/173380802.db2.gz ROSJLRYLMQUSBK-CYBMUJFWSA-N 2 0 210.365 2.108 20 0 BEADRP C[NH2+]C[C@H]1CCN(c2cc[nH+]c3ccccc32)C1 ZINC000071147883 173381598 /nfs/dbraw/zinc/38/15/98/173381598.db2.gz PHUNMXKKBGJOCG-GFCCVEGCSA-N 2 0 241.338 2.281 20 0 BEADRP C[NH2+]C[C@H]1CC[N@H+](C[C@@H](C)CC(C)C)C1 ZINC000300965185 173381956 /nfs/dbraw/zinc/38/19/56/173381956.db2.gz RLIJABTYJGVGLW-QWHCGFSZSA-N 2 0 212.381 2.210 20 0 BEADRP COC1(C[NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)CCCC1 ZINC000336655252 174004513 /nfs/dbraw/zinc/00/45/13/174004513.db2.gz JCVRGXFDFNAUSM-STQMWFEESA-N 2 0 240.391 2.018 20 0 BEADRP COCC1(C[NH2+][C@H](C)CC(C)C)CC[NH2+]CC1 ZINC000336718799 174105589 /nfs/dbraw/zinc/10/55/89/174105589.db2.gz VIAXRMHURBHBGV-CYBMUJFWSA-N 2 0 242.407 2.027 20 0 BEADRP COCCCCC[NH2+][C@@H]1C[C@@H](C)N(C2CC2)C1 ZINC000122758755 174184395 /nfs/dbraw/zinc/18/43/95/174184395.db2.gz MRSIQNVFOCCWDB-CHWSQXEVSA-N 2 0 240.391 2.018 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+][C@@H]1CCC[C@H](C)[C@@H]1C ZINC000300025268 174562211 /nfs/dbraw/zinc/56/22/11/174562211.db2.gz RASCYZZXWDVDSY-XDQVBPFNSA-N 2 0 242.407 2.155 20 0 BEADRP COc1ccc(C[N@H+](C)C[C@@H]2CCC[NH2+]C2)cc1 ZINC000042442232 175096055 /nfs/dbraw/zinc/09/60/55/175096055.db2.gz HVNVOJKQYURHJA-CQSZACIVSA-N 2 0 248.370 2.127 20 0 BEADRP COc1ccc([C@H](C)[NH2+][C@H]2CCC[NH2+]CC2)cc1 ZINC000129301953 175190367 /nfs/dbraw/zinc/19/03/67/175190367.db2.gz FOUYRSURKVHYOR-JSGCOSHPSA-N 2 0 248.370 2.488 20 0 BEADRP COc1cccc([C@@H](C)[NH2+]C[C@H]2CCC[NH2+]C2)c1 ZINC000132187294 175286727 /nfs/dbraw/zinc/28/67/27/175286727.db2.gz LMYCQUOWSZKLPV-OLZOCXBDSA-N 2 0 248.370 2.345 20 0 BEADRP COc1cccc([C@H](C)[NH2+][C@@H]2CCC[NH2+]CC2)c1 ZINC000129131694 175293603 /nfs/dbraw/zinc/29/36/03/175293603.db2.gz JFZOBWXVDUVZDY-GXTWGEPZSA-N 2 0 248.370 2.488 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]C[C@H](c1ccccc1)N(C)C ZINC000310965986 175666209 /nfs/dbraw/zinc/66/62/09/175666209.db2.gz BGOSMTJQEVZLKV-DZGCQCFKSA-N 2 0 249.402 2.006 20 0 BEADRP C[C@@H]([NH2+]CC1CC[NH+](C)CC1)c1cccnc1 ZINC000044515597 175871391 /nfs/dbraw/zinc/87/13/91/175871391.db2.gz SJBVGSUCRBSTBC-GFCCVEGCSA-N 2 0 233.359 2.074 20 0 BEADRP C[C@@H]([NH2+]CCC[NH+](C)C)C1CCCCC1 ZINC000037213664 175875383 /nfs/dbraw/zinc/87/53/83/175875383.db2.gz QFKLUJXQZFBTER-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H](c1ccc(F)cc1)[N@@H+]1CC[C@H](C[NH3+])C1 ZINC000049509036 176015510 /nfs/dbraw/zinc/01/55/10/176015510.db2.gz FGFOVDQKNMJXSB-WDEREUQCSA-N 2 0 222.307 2.167 20 0 BEADRP C[C@@H]1CCCCC[N@@H+]1C[C@@]1(C)CC[NH2+]C1 ZINC000226736999 176063428 /nfs/dbraw/zinc/06/34/28/176063428.db2.gz QIMBGJFXRMUIGM-OLZOCXBDSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[N@@H+]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000357045026 176076562 /nfs/dbraw/zinc/07/65/62/176076562.db2.gz HMEVJWXMEMXBFD-BARDWOONSA-N 2 0 236.403 2.354 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[NH2+]C[C@@H]1CCC[NH2+]1 ZINC000235236081 176077020 /nfs/dbraw/zinc/07/70/20/176077020.db2.gz BMAPOBYHKKYUOD-UPJWGTAASA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1CCCC[C@H]1[NH2+]CC1CC[NH+](C)CC1 ZINC000044515349 176088231 /nfs/dbraw/zinc/08/82/31/176088231.db2.gz YDMOFCIBMUJTAE-TZMCWYRMSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CCC[C@@H](CC[N@@H+]2CC[C@@H](C[NH3+])C2)C1 ZINC000226869766 176117042 /nfs/dbraw/zinc/11/70/42/176117042.db2.gz BNYFRJVVAAVKJT-RDBSUJKOSA-N 2 0 224.392 2.483 20 0 BEADRP C[C@@H]1CCC[C@@H]1C[NH2+][C@H]1CC[N@H+](C)C[C@H]1C ZINC000336775789 176128164 /nfs/dbraw/zinc/12/81/64/176128164.db2.gz CRNNJBUSBORSKR-SYQHCUMBSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1CC[NH+](C/C=C\C[N@H+]2CC[C@@H](C)C2)C1 ZINC000337693636 176167232 /nfs/dbraw/zinc/16/72/32/176167232.db2.gz QRABICHAEBIDEA-JHZNUDOXSA-N 2 0 222.376 2.226 20 0 BEADRP C[C@@H]1CC[N@H+](CCC2CC[NH2+]CC2)[C@H](C)C1 ZINC000051732499 176168915 /nfs/dbraw/zinc/16/89/15/176168915.db2.gz LFIJCLZCMNVQIZ-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000336717144 176217666 /nfs/dbraw/zinc/21/76/66/176217666.db2.gz XUVHLWQQVGGQPA-XQHKEYJVSA-N 2 0 208.349 2.001 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)C1 ZINC000300239966 176227105 /nfs/dbraw/zinc/22/71/05/176227105.db2.gz BTVIILDGYXBOIG-YIYPIFLZSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CCC2CC[NH+](C)CC2)C1 ZINC000122000259 176232881 /nfs/dbraw/zinc/23/28/81/176232881.db2.gz KWFFJIRLPRZMRV-OCCSQVGLSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]C[C@@H]1CCCCS1 ZINC000336781259 176268433 /nfs/dbraw/zinc/26/84/33/176268433.db2.gz UEXONEOUPWBHFP-AGIUHOORSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]C[C@H]1CCCSC1 ZINC000304519494 176269223 /nfs/dbraw/zinc/26/92/23/176269223.db2.gz PEYPHDYBPMHZBG-UPJWGTAASA-N 2 0 242.432 2.059 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]Cc1ccccc1 ZINC000073653773 176269437 /nfs/dbraw/zinc/26/94/37/176269437.db2.gz IOHGIIBXOUYHLW-OCCSQVGLSA-N 2 0 218.344 2.116 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]C[C@@H]1CCCSC1 ZINC000304519490 176270840 /nfs/dbraw/zinc/27/08/40/176270840.db2.gz PEYPHDYBPMHZBG-FRRDWIJNSA-N 2 0 242.432 2.059 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]C[C@H]1CCCCS1 ZINC000336781261 176271138 /nfs/dbraw/zinc/27/11/38/176271138.db2.gz UEXONEOUPWBHFP-JHJVBQTASA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]C[C@@H]1CCCCS1 ZINC000336781260 176271290 /nfs/dbraw/zinc/27/12/90/176271290.db2.gz UEXONEOUPWBHFP-FRRDWIJNSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]CC1CCCC1 ZINC000036908585 176278588 /nfs/dbraw/zinc/27/85/88/176278588.db2.gz ADPPVWLZEVORLJ-YRGRVCCFSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+][C@@H]1CC1(C)C ZINC000045117136 176279707 /nfs/dbraw/zinc/27/97/07/176279707.db2.gz XOLBYBXNFITZAE-DDHJBXDOSA-N 2 0 210.365 2.103 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]C[C@@H]1CCSC1 ZINC000300230003 176279738 /nfs/dbraw/zinc/27/97/38/176279738.db2.gz NPCBEIXOGQZEPK-FVCCEPFGSA-N 2 0 242.432 2.058 20 0 BEADRP C[C@@H]1CSC[C@H]1[NH2+]CCC1CC[NH+](C)CC1 ZINC000304405955 176355062 /nfs/dbraw/zinc/35/50/62/176355062.db2.gz HXLAWPBNISKLAR-DGCLKSJQSA-N 2 0 242.432 2.059 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCCc2ccccn2)CC[N@@H+]1C ZINC000181493624 176375397 /nfs/dbraw/zinc/37/53/97/176375397.db2.gz CUCFFOIDOBUUEB-HIFRSBDPSA-N 2 0 247.386 2.087 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CC2(C)CC[NH+](C)CC2)[C@@H]1C ZINC000309275796 176375454 /nfs/dbraw/zinc/37/54/54/176375454.db2.gz DSSGMGNLLUGMEJ-JHJVBQTASA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCC[NH3+])c2ccccc21 ZINC000336719747 176375541 /nfs/dbraw/zinc/37/55/41/176375541.db2.gz ZCMVZNSAVOSVEX-ZWNOBZJWSA-N 2 0 204.317 2.173 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCC(C)(F)F)CC[N@@H+]1C ZINC000357715630 176375620 /nfs/dbraw/zinc/37/56/20/176375620.db2.gz YFXHLOLOXMWKNZ-ZJUUUORDSA-N 2 0 220.307 2.104 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C[C@H]2CCCSC2)CC[N@@H+]1C ZINC000304332844 176376652 /nfs/dbraw/zinc/37/66/52/176376652.db2.gz AOMXGNCCYIVOQJ-UPJWGTAASA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@H+](CCC[NH3+])Cc1ccccc1 ZINC000339406331 176391945 /nfs/dbraw/zinc/39/19/45/176391945.db2.gz GEGUPNWLMMYFKQ-UKRRQHHQSA-N 2 0 232.371 2.493 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000336782346 176395880 /nfs/dbraw/zinc/39/58/80/176395880.db2.gz XIPKFPWUVBHEFK-DGCLKSJQSA-N 2 0 222.376 2.106 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000336769805 176398185 /nfs/dbraw/zinc/39/81/85/176398185.db2.gz VWNZRIWJHUFLQP-FDYHWXHSSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@H]1Cc2ccccc2O1 ZINC000336792700 176618929 /nfs/dbraw/zinc/61/89/29/176618929.db2.gz TTYBROPMVHMJAS-TZMCWYRMSA-N 2 0 248.370 2.097 20 0 BEADRP C[C@H](Cc1ccccc1)C[NH+]1C[C@H]2C[NH2+]C[C@@H]2C1 ZINC000359460145 176723644 /nfs/dbraw/zinc/72/36/44/176723644.db2.gz VXUNRDFYNRUECY-FVQBIDKESA-N 2 0 244.382 2.016 20 0 BEADRP C[C@H]([NH2+]CCC1CC[NH+](C)CC1)C1(C)CC1 ZINC000122141340 176841394 /nfs/dbraw/zinc/84/13/94/176841394.db2.gz CCWMQBAWKFQSHP-LBPRGKRZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC1(C)C)C1CC[NH+](C)CC1 ZINC000045116886 176893658 /nfs/dbraw/zinc/89/36/58/176893658.db2.gz QOWUDHRBLVHKNP-CMPLNLGQSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@H](c1cccnc1)N(C)C[C@H]1CCC[N@H+](C)C1 ZINC000265915995 177045458 /nfs/dbraw/zinc/04/54/58/177045458.db2.gz BISOGZVZYBOYSU-KGLIPLIRSA-N 2 0 247.386 2.416 20 0 BEADRP C[C@H]1CCCC[C@@]1(C)[NH2+]Cc1cnc[nH]1 ZINC000308692378 177084712 /nfs/dbraw/zinc/08/47/12/177084712.db2.gz AVTJRXXNPYPMOL-CMPLNLGQSA-N 2 0 207.321 2.468 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCCC[C@@H]1C)C[NH+](C)C ZINC000336668028 177088785 /nfs/dbraw/zinc/08/87/85/177088785.db2.gz DZHODBGSMGUHAD-FRRDWIJNSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H]1CCCC[C@H]1[NH2+]CC1=CC[N@H+](C)CC1 ZINC000335607809 177088904 /nfs/dbraw/zinc/08/89/04/177088904.db2.gz HVBMYMZDXBTGKI-GXTWGEPZSA-N 2 0 222.376 2.417 20 0 BEADRP C[C@H]1CCC[C@@H]1[NH2+]CC(C)(C)C[NH+](C)C ZINC000083389619 177125688 /nfs/dbraw/zinc/12/56/88/177125688.db2.gz FGSAQLGDUXHPGX-RYUDHWBXSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H](Cc1ccccc1)C[N@H+]1C[C@H]([NH3+])[C@@H](C)C1 ZINC000340693006 177258248 /nfs/dbraw/zinc/25/82/48/177258248.db2.gz WXKOYBGDRLIFOZ-IPYPFGDCSA-N 2 0 232.371 2.144 20 0 BEADRP C[C@H]1CSC[C@H]1[NH2+]CCC[NH+]1CCCCC1 ZINC000304525024 177306550 /nfs/dbraw/zinc/30/65/50/177306550.db2.gz PSLXSUDGHRZINZ-QWHCGFSZSA-N 2 0 242.432 2.204 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)C1 ZINC000300239965 177332798 /nfs/dbraw/zinc/33/27/98/177332798.db2.gz BTVIILDGYXBOIG-RFGFWPKPSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C2CC[NH2+]CC2)[C@@H](C)C1 ZINC000226170923 177355505 /nfs/dbraw/zinc/35/55/05/177355505.db2.gz VPWYBMUIIVTFQE-MDZLAQPJSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]1C[C@H](C[N@@H+]2CCC3(CCC3)C2)CC[NH2+]1 ZINC000335664644 177362477 /nfs/dbraw/zinc/36/24/77/177362477.db2.gz VXCSALFNQBQIIH-QWHCGFSZSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CCc2cccs2)CC[N@@H+]1C ZINC000129658839 177370372 /nfs/dbraw/zinc/37/03/72/177370372.db2.gz YHDATGJFMAUXTB-NWDGAFQWSA-N 2 0 238.400 2.363 20 0 BEADRP C[C@H](CN(C)C)[NH2+][C@@H]1CC[C@@H](C)[C@@H](C)C1 ZINC000227605605 177371452 /nfs/dbraw/zinc/37/14/52/177371452.db2.gz QWLHOFMKXYBXAW-YVECIDJPSA-N 2 0 212.381 2.351 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+][C@H]1C[C@H](C)N(C2CC2)C1 ZINC000352811022 177371782 /nfs/dbraw/zinc/37/17/82/177371782.db2.gz RGENIGKACDGMLY-DYEKYZERSA-N 2 0 248.370 2.425 20 0 BEADRP C[C@H]1C[C@H]1C[NH2+]C1CCC([NH+](C)C)CC1 ZINC000309113493 177380770 /nfs/dbraw/zinc/38/07/70/177380770.db2.gz KOIQPVLQEMKQKZ-ZSVAQUKISA-N 2 0 210.365 2.105 20 0 BEADRP C[C@H]1C[C@H]1C[NH2+]Cc1ccc(C[NH+](C)C)cc1 ZINC000340173137 177381867 /nfs/dbraw/zinc/38/18/67/177381867.db2.gz DHFCSXUJOLOFSA-WFASDCNBSA-N 2 0 232.371 2.494 20 0 BEADRP C[C@H](C[NH2+]C[C@@H]1C[C@@H]1C)C[NH+]1CCCCC1 ZINC000309740515 177381947 /nfs/dbraw/zinc/38/19/47/177381947.db2.gz HPMAKNMFHDYIJA-RDBSUJKOSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H]1CN(C)C[C@@H]1[NH2+][C@@H]1c2ccccc2C[C@@H]1C ZINC000358145211 177391832 /nfs/dbraw/zinc/39/18/32/177391832.db2.gz ZAIASVKETLNLGF-VZAMPYOESA-N 2 0 244.382 2.460 20 0 BEADRP COCC(C)(C)C[NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1 ZINC000494080719 226260500 /nfs/dbraw/zinc/26/05/00/226260500.db2.gz VJLNAFWSTOVKIU-OLZOCXBDSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCc2ccccc21)[C@@H]1CC[NH2+]C1 ZINC000400342035 226341219 /nfs/dbraw/zinc/34/12/19/226341219.db2.gz GALZRROUMOETGW-NJZAAPMLSA-N 2 0 230.355 2.262 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)c1ccccn1 ZINC000400996300 226352440 /nfs/dbraw/zinc/35/24/40/226352440.db2.gz DYKGCZLYJLWKFG-IGQOVBAYSA-N 2 0 245.370 2.120 20 0 BEADRP C[C@@H]1C[C@H](C)[N@H+](Cc2ccccc2)C[C@@H]1C[NH3+] ZINC000307576056 229216348 /nfs/dbraw/zinc/21/63/48/229216348.db2.gz LWVSSRANZONVSB-IPYPFGDCSA-N 2 0 232.371 2.492 20 0 BEADRP C[C@@H]1C[C@H](C)[N@H+](Cc2ccccc2)C[C@H]1C[NH3+] ZINC000307576062 229216438 /nfs/dbraw/zinc/21/64/38/229216438.db2.gz LWVSSRANZONVSB-VNHYZAJKSA-N 2 0 232.371 2.492 20 0 BEADRP Cc1cccc([C@H](C)N[C@@H](C)[C@H](C)[NH3+])c1 ZINC000309120134 229361328 /nfs/dbraw/zinc/36/13/28/229361328.db2.gz SVHSMZDENDYQCY-SRVKXCTJSA-N 2 0 206.333 2.381 20 0 BEADRP C[NH2+]C1CC[NH+](CCC(C)(C)C2CC2)CC1 ZINC000328427564 487681472 /nfs/dbraw/zinc/68/14/72/487681472.db2.gz MAERJYRNTQOKCC-UHFFFAOYSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)CC[N@H+](CC[C@@H]1CC[NH2+]C1)C1CC1 ZINC000096997296 487684858 /nfs/dbraw/zinc/68/48/58/487684858.db2.gz RUAKSIVNWNHGAX-ZDUSSCGKSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH+]1CCC(C[NH2+]C[C@]2(C)CCCS2)CC1 ZINC000087792806 487686541 /nfs/dbraw/zinc/68/65/41/487686541.db2.gz YZPHPYRDDCXMRD-ZDUSSCGKSA-N 2 0 242.432 2.204 20 0 BEADRP C[C@]1(C[NH2+][C@H]2CCC[C@H]([NH3+])C2)CCCS1 ZINC000087793240 487687650 /nfs/dbraw/zinc/68/76/50/487687650.db2.gz HHTPGKQKZZHSGK-SDDRHHMPSA-N 2 0 228.405 2.132 20 0 BEADRP CCC[C@H](C)[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000233339208 487711139 /nfs/dbraw/zinc/71/11/39/487711139.db2.gz IDVMMLVBKMBHLU-RYUDHWBXSA-N 2 0 210.365 2.439 20 0 BEADRP FC(F)C1CC([NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)C1 ZINC000681112197 487730636 /nfs/dbraw/zinc/73/06/36/487730636.db2.gz BTCWWZWMLVIQLK-ADPBJBESSA-N 2 0 244.329 2.247 20 0 BEADRP C[C@H](c1ccncc1)[N@@H+]1CCC[C@@H]([C@H](C)[NH3+])C1 ZINC000251266704 487752856 /nfs/dbraw/zinc/75/28/56/487752856.db2.gz MUUPRRMLDMJSTE-OUCADQQQSA-N 2 0 233.359 2.202 20 0 BEADRP CC(C)[C@H]1CCCC[N@@H+]1C[C@H]1CC[NH2+]C1 ZINC000251329699 487753829 /nfs/dbraw/zinc/75/38/29/487753829.db2.gz NYNXRHISTOGBHF-QWHCGFSZSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)[C@H]1CC1(F)F ZINC000666229495 487764453 /nfs/dbraw/zinc/76/44/53/487764453.db2.gz OTDYRUWBKJZLNR-HBIQZDMRSA-N 2 0 246.345 2.493 20 0 BEADRP C[N@H+](CCC(C)(C)C)C[C@H]1CCC[NH2+]C1 ZINC000234288896 487793267 /nfs/dbraw/zinc/79/32/67/487793267.db2.gz UGKUOSXWTQCFPD-LBPRGKRZSA-N 2 0 212.381 2.354 20 0 BEADRP CC[C@@H]1C[N@H+](CCC(C)(C)C)CC[C@H]1[NH3+] ZINC000251935414 487808429 /nfs/dbraw/zinc/80/84/29/487808429.db2.gz ZRNVHNGETJENMA-VXGBXAGGSA-N 2 0 212.381 2.482 20 0 BEADRP CC[C@H]1C[N@H+](CCC(C)(C)C)CC[C@H]1[NH3+] ZINC000251935413 487808558 /nfs/dbraw/zinc/80/85/58/487808558.db2.gz ZRNVHNGETJENMA-NWDGAFQWSA-N 2 0 212.381 2.482 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)CS1 ZINC000322749039 487821617 /nfs/dbraw/zinc/82/16/17/487821617.db2.gz WWRJRMKDDPJEJO-FOJMLEQCSA-N 2 0 240.416 2.095 20 0 BEADRP CC[N@H+](CCC[NH3+])[C@@H](C)Cc1ccsc1 ZINC000414759526 487822836 /nfs/dbraw/zinc/82/28/36/487822836.db2.gz OQECBDWIVNABMI-NSHDSACASA-N 2 0 226.389 2.350 20 0 BEADRP Cc1ccc(CCC[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)cn1 ZINC000414932892 487830496 /nfs/dbraw/zinc/83/04/96/487830496.db2.gz WDMANDTWGROWHG-HUUCEWRRSA-N 2 0 247.386 2.182 20 0 BEADRP [NH3+]CCC[NH2+]CCc1ccccc1C(F)(F)F ZINC000415080070 487836672 /nfs/dbraw/zinc/83/66/72/487836672.db2.gz KXGYXIBQDSRBIP-UHFFFAOYSA-N 2 0 246.276 2.186 20 0 BEADRP C[C@@H]([NH2+]C1CC(C)(C)C1)C1CC[NH+](C)CC1 ZINC000395184290 487841347 /nfs/dbraw/zinc/84/13/47/487841347.db2.gz QGLOKSJJIOXIHA-LLVKDONJSA-N 2 0 224.392 2.495 20 0 BEADRP CC[C@@H]1C[N@H+](CCCCCC[NH3+])CCS1 ZINC000133055775 591760907 /nfs/dbraw/zinc/76/09/07/591760907.db2.gz FBQIGRVPGNITEO-GFCCVEGCSA-N 2 0 230.421 2.333 20 0 BEADRP c1ccc2c(c1)ccnc2CN[C@H]1CCC[NH2+]C1 ZINC000666814081 487867614 /nfs/dbraw/zinc/86/76/14/487867614.db2.gz FNXDIPZLMLPRJH-ZDUSSCGKSA-N 2 0 241.338 2.076 20 0 BEADRP C(=C\c1ccccc1)\C[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000666952442 487891676 /nfs/dbraw/zinc/89/16/76/487891676.db2.gz WRDBHKRPTGLZAO-QZDDGCDVSA-N 2 0 242.366 2.432 20 0 BEADRP C[C@@H](C[N@@H+]1CC[C@@](C)(C[NH3+])C1)C(C)(C)C ZINC000309053397 487892190 /nfs/dbraw/zinc/89/21/90/487892190.db2.gz RFIXVGIHCQSDLY-AAEUAGOBSA-N 2 0 212.381 2.339 20 0 BEADRP CN1CC(C[N@H+](C)C/C=C\c2ccc(F)cc2)C1 ZINC000668539737 487905357 /nfs/dbraw/zinc/90/53/57/487905357.db2.gz KHHPBNLKDGVILH-ARJAWSKDSA-N 2 0 248.345 2.332 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]CCC[NH+](C)C)CC1 ZINC000083427150 487910752 /nfs/dbraw/zinc/91/07/52/487910752.db2.gz MJEFXIQNXGDSBI-CHWSQXEVSA-N 2 0 212.381 2.497 20 0 BEADRP CCc1ccc(C[NH2+][C@H]2CC23CC[NH2+]CC3)cc1 ZINC000666950916 487913182 /nfs/dbraw/zinc/91/31/82/487913182.db2.gz QKHRVNFTWNTNMM-HNNXBMFYSA-N 2 0 244.382 2.481 20 0 BEADRP c1cc(N2CC[NH+]([C@H]3C=CCCC3)CC2)cc[nH+]1 ZINC000675500109 487914300 /nfs/dbraw/zinc/91/43/00/487914300.db2.gz YZMXYHGBBOJZPB-AWEZNQCLSA-N 2 0 243.354 2.312 20 0 BEADRP CCC[C@@H](C)C[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000666952368 487914355 /nfs/dbraw/zinc/91/43/55/487914355.db2.gz SYSWMWKGCIKWRM-VXGBXAGGSA-N 2 0 210.365 2.154 20 0 BEADRP Cc1ccc(F)cc1C[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000666953584 487915028 /nfs/dbraw/zinc/91/50/28/487915028.db2.gz BMJGZVPJVKAKKF-CQSZACIVSA-N 2 0 248.345 2.366 20 0 BEADRP C[C@H]1CCC[N@H+](Cc2cccc(O)c2)[C@@H]1CC[NH3+] ZINC000404294061 487917011 /nfs/dbraw/zinc/91/70/11/487917011.db2.gz MROAIQNFCHFBPZ-SWLSCSKDSA-N 2 0 248.370 2.342 20 0 BEADRP C[C@H](C[NH+]1C[C@@H]2C[NH2+]C[C@H]2C1)c1ccc(F)cc1 ZINC000682156081 487917025 /nfs/dbraw/zinc/91/70/25/487917025.db2.gz HXOHQEZCLLSPRD-XBFCOCLRSA-N 2 0 248.345 2.080 20 0 BEADRP C[C@@H](C[NH2+][C@@H]1CCCC[NH2+]C1)C(C)(C)C ZINC000666993003 487923395 /nfs/dbraw/zinc/92/33/95/487923395.db2.gz UHBUHGDJSUZWQO-NWDGAFQWSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)C1 ZINC000666995312 487924950 /nfs/dbraw/zinc/92/49/50/487924950.db2.gz JZCIDWIAWPSZJL-FRRDWIJNSA-N 2 0 222.376 2.439 20 0 BEADRP CC[C@@H](C)C[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000666995620 487925287 /nfs/dbraw/zinc/92/52/87/487925287.db2.gz UJYWVKGVSCKPLI-NEPJUHHUSA-N 2 0 210.365 2.297 20 0 BEADRP CC1(C)CCC[N@H+](C[C@@H]2CC[NH2+]C2)CC1 ZINC000083680594 487927766 /nfs/dbraw/zinc/92/77/66/487927766.db2.gz PCSQBOQVHJAHHA-GFCCVEGCSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@H]1C[C@H](C)[N@H+](CCCC2CC[NH2+]CC2)C1 ZINC000157983117 487931833 /nfs/dbraw/zinc/93/18/33/487931833.db2.gz PZDUFOJIIZFIPY-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)C1CC[NH+](C)CC1)C1CC1 ZINC000035732768 487955934 /nfs/dbraw/zinc/95/59/34/487955934.db2.gz KTZLREMXLATPFC-MNOVXSKESA-N 2 0 210.365 2.105 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)C1CC1)C1CC[NH+](C)CC1 ZINC000035732769 487956125 /nfs/dbraw/zinc/95/61/25/487956125.db2.gz KTZLREMXLATPFC-WDEREUQCSA-N 2 0 210.365 2.105 20 0 BEADRP CC1(C)CCC[C@H](C[NH2+][C@@H]2[C@H]3C[NH2+]C[C@H]32)C1 ZINC000560973658 322993810 /nfs/dbraw/zinc/99/38/10/322993810.db2.gz CIMHUOINLYVBNX-WUHRBBMRSA-N 2 0 222.376 2.010 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000562860785 323032217 /nfs/dbraw/zinc/03/22/17/323032217.db2.gz IPAPRUBREFIBSG-KBPBESRZSA-N 2 0 247.386 2.382 20 0 BEADRP CC(C)[NH2+]CCC[NH2+][C@@H](C)C1CCSCC1 ZINC000562956252 323035015 /nfs/dbraw/zinc/03/50/15/323035015.db2.gz LZRAHENSOVEINJ-LBPRGKRZSA-N 2 0 244.448 2.496 20 0 BEADRP C[C@H]([NH3+])c1ccc(OCCC2CC[NH2+]CC2)cc1 ZINC000569687308 323036978 /nfs/dbraw/zinc/03/69/78/323036978.db2.gz ZBKJQUCNHNWNAU-LBPRGKRZSA-N 2 0 248.370 2.475 20 0 BEADRP C[N@H+]1CC=C(C[NH2+][C@H]2CCCC23CC3)CC1 ZINC000569710116 323038063 /nfs/dbraw/zinc/03/80/63/323038063.db2.gz NCNVSZFXZIJSBN-ZDUSSCGKSA-N 2 0 220.360 2.171 20 0 BEADRP Cc1ccc(OCC[NH2+][C@@H]2CCC[C@H]([NH3+])C2)cc1 ZINC000570463199 323060216 /nfs/dbraw/zinc/06/02/16/323060216.db2.gz UTDJUFIUTGYASH-UONOGXRCSA-N 2 0 248.370 2.233 20 0 BEADRP CCc1cc(N2CC[C@H]([NH+]3CCCC3)C2)cc[nH+]1 ZINC000570594124 323064288 /nfs/dbraw/zinc/06/42/88/323064288.db2.gz UZKOOSLPEQYRPG-HNNXBMFYSA-N 2 0 245.370 2.319 20 0 BEADRP Cc1cccnc1C[N@@H+]1C[C@H](C[NH3+])[C@H](C)C[C@H]1C ZINC000397254632 323077385 /nfs/dbraw/zinc/07/73/85/323077385.db2.gz FAYJGITWBMYPMX-MCIONIFRSA-N 2 0 247.386 2.195 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC000403872200 323077623 /nfs/dbraw/zinc/07/76/23/323077623.db2.gz ZTHNGPPSGCLWIL-MCIONIFRSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]CCCC(C)(F)F ZINC000390089564 323083528 /nfs/dbraw/zinc/08/35/28/323083528.db2.gz IGKGIACKIRRQPA-VIFPVBQESA-N 2 0 208.296 2.139 20 0 BEADRP COC[C@H]([NH2+][C@H]1C[C@H]([NH3+])c2ccccc21)C1CC1 ZINC000397299471 323087394 /nfs/dbraw/zinc/08/73/94/323087394.db2.gz CTTVNRIDWFBGHJ-KKUMJFAQSA-N 2 0 246.354 2.146 20 0 BEADRP CCC1(C[NH2+][C@@H]2C[C@@H]([NH3+])c3ccccc32)COC1 ZINC000393961083 323098927 /nfs/dbraw/zinc/09/89/27/323098927.db2.gz DYKJLIPAHIAQCP-ZIAGYGMSSA-N 2 0 246.354 2.147 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC[N@@H+]1C ZINC000403838005 323128266 /nfs/dbraw/zinc/12/82/66/323128266.db2.gz OQUSEYLSOIFDGP-ARILJUKYSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]Cc1ccnc2ccccc12 ZINC000571296068 323140663 /nfs/dbraw/zinc/14/06/63/323140663.db2.gz QXBMLTVQEYNXME-GFCCVEGCSA-N 2 0 243.354 2.452 20 0 BEADRP C[C@H]1CC(C)(C)C[C@H]1[NH2+]CC1CC[NH2+]CC1 ZINC000571394828 323143290 /nfs/dbraw/zinc/14/32/90/323143290.db2.gz PCKKCHLVYWXWGI-WCQYABFASA-N 2 0 224.392 2.400 20 0 BEADRP CC1(C)CCC[C@@H]1[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000414900391 323151927 /nfs/dbraw/zinc/15/19/27/323151927.db2.gz DIFYEPXYFYJAGG-NEPJUHHUSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]([NH3+])[C@@H](C)[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC000415009642 323152535 /nfs/dbraw/zinc/15/25/35/323152535.db2.gz GDPDHYFFKWDLCO-RFHZTLPTSA-N 2 0 218.344 2.115 20 0 BEADRP Cc1ccncc1CN[C@H](C)[C@@H]1CCCC[NH2+]1 ZINC000395091958 323186948 /nfs/dbraw/zinc/18/69/48/323186948.db2.gz VFAIHQFWQRTACP-OCCSQVGLSA-N 2 0 233.359 2.010 20 0 BEADRP COc1ccc(C[N@@H+]2C[C@@H](C[NH3+])C[C@@H]2C)cc1C ZINC000216060212 323195182 /nfs/dbraw/zinc/19/51/82/323195182.db2.gz HVAODTRYECNVOX-GXTWGEPZSA-N 2 0 248.370 2.173 20 0 BEADRP CC(C)C[C@H]([NH3+])C[N@H+](C)C1CC(C)(C)C1 ZINC000395463568 323227468 /nfs/dbraw/zinc/22/74/68/323227468.db2.gz PYDWFMCRJYLYMY-NSHDSACASA-N 2 0 212.381 2.480 20 0 BEADRP CCC[C@H](C[NH2+][C@@H]1CCCCC[C@@H]1[NH3+])OCC ZINC000530212958 323216504 /nfs/dbraw/zinc/21/65/04/323216504.db2.gz SHMQOPDYGWYGKS-HZSPNIEDSA-N 2 0 242.407 2.441 20 0 BEADRP CC[C@H]([NH2+][C@H]1CC[NH2+]C12CCC2)C1CCC1 ZINC000530214132 323216891 /nfs/dbraw/zinc/21/68/91/323216891.db2.gz BDLUIHJXGPSYNB-STQMWFEESA-N 2 0 222.376 2.439 20 0 BEADRP C[C@@H]1C[C@@H]([NH3+])CC[N@@H+]1CC1CC(C)(C)C1 ZINC000530225304 323219014 /nfs/dbraw/zinc/21/90/14/323219014.db2.gz VNGCNHGMVONRSI-PWSUYJOCSA-N 2 0 210.365 2.234 20 0 BEADRP CC[C@H]1CCC[C@H]1[NH2+]CCN(C)CCCOC ZINC000532523013 323272342 /nfs/dbraw/zinc/27/23/42/323272342.db2.gz QFFZZQWSPSCIOL-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@@H](Cc1ccsc1)[NH2+]CCCC[NH3+] ZINC000571742926 323477026 /nfs/dbraw/zinc/47/70/26/323477026.db2.gz YWLJIFVIBMUEOK-JTQLQIEISA-N 2 0 212.362 2.008 20 0 BEADRP C[C@@H]([NH2+]CC1CC[NH+](C)CC1)[C@H]1CC12CC2 ZINC000527859683 323712202 /nfs/dbraw/zinc/71/22/02/323712202.db2.gz RJTBKIMNXNDCJK-DGCLKSJQSA-N 2 0 222.376 2.106 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]CC2CC=CC2)CC1 ZINC000527942959 323722103 /nfs/dbraw/zinc/72/21/03/323722103.db2.gz HVGUAYMHQBGRFN-UHFFFAOYSA-N 2 0 222.376 2.415 20 0 BEADRP C[C@@H]1C[C@H](C)[N@H+](CC2CCCC2)C[C@H]1C[NH3+] ZINC000397331363 324212352 /nfs/dbraw/zinc/21/23/52/324212352.db2.gz RBIVBSCRVIAOEI-MBNYWOFBSA-N 2 0 224.392 2.482 20 0 BEADRP CCC[C@H](C[NH2+]C1CCC(C[NH3+])CC1)OCC ZINC000530214256 324530449 /nfs/dbraw/zinc/53/04/49/324530449.db2.gz WGUBFVCZQNLVTJ-JXQTWKCFSA-N 2 0 242.407 2.299 20 0 BEADRP CC(C)[N@@H+]1CC[C@H](C[NH2+][C@H]2CSC[C@H]2C)C1 ZINC000304365272 325146242 /nfs/dbraw/zinc/14/62/42/325146242.db2.gz FFYHAEMWNOEDRZ-UPJWGTAASA-N 2 0 242.432 2.058 20 0 BEADRP CC[C@H]1CCC[C@@H]1[NH2+]CCCC[NH+](C)C ZINC000132997414 325259044 /nfs/dbraw/zinc/25/90/44/325259044.db2.gz ZQCQPLYNJYSMQL-STQMWFEESA-N 2 0 212.381 2.497 20 0 BEADRP CSC[C@H](C)[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000134009579 325337519 /nfs/dbraw/zinc/33/75/19/325337519.db2.gz XHZMDQGWCILDJS-NSHDSACASA-N 2 0 230.421 2.200 20 0 BEADRP CC[C@H]1C[N@H+](Cc2ccsc2)CC[C@@H]1[NH3+] ZINC000122221437 487969126 /nfs/dbraw/zinc/96/91/26/487969126.db2.gz IKDYGKRRAHYDRX-RYUDHWBXSA-N 2 0 224.373 2.307 20 0 BEADRP CCC(C)(C)[C@@H](C)[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000565710428 325946691 /nfs/dbraw/zinc/94/66/91/325946691.db2.gz RCAIZGXKQCXDAU-VXGBXAGGSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCC[C@@H]([NH3+])C1)C(F)(F)F ZINC000566481333 326055586 /nfs/dbraw/zinc/05/55/86/326055586.db2.gz HFOXFYKQQASXJW-HLTSFMKQSA-N 2 0 224.270 2.044 20 0 BEADRP CCc1ccc(C[NH2+][C@H](C)C[C@@H](C)[NH3+])cc1 ZINC000567041238 326104955 /nfs/dbraw/zinc/10/49/55/326104955.db2.gz FZVOZVSGGIIDSC-VXGBXAGGSA-N 2 0 220.360 2.464 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCC[C@H]([NH3+])C1)Oc1ccccc1 ZINC000567249495 326150530 /nfs/dbraw/zinc/15/05/30/326150530.db2.gz ICYIUSVSDIRJMI-HZSPNIEDSA-N 2 0 248.370 2.313 20 0 BEADRP C[NH+]1CCC([C@H]2CC[N@H+](CC3(C)CC3)C2)CC1 ZINC000567399472 326183291 /nfs/dbraw/zinc/18/32/91/326183291.db2.gz DZRPBKBGEPWJFB-AWEZNQCLSA-N 2 0 236.403 2.450 20 0 BEADRP Cc1cnc(C[NH2+]C2CCC(C[NH3+])CC2)s1 ZINC000567490012 326203888 /nfs/dbraw/zinc/20/38/88/326203888.db2.gz ATTXHQAWMCKZPF-UHFFFAOYSA-N 2 0 239.388 2.059 20 0 BEADRP C([NH2+][C@@H]1CCC[C@@H]1C1CC1)C1CC[NH2+]CC1 ZINC000567639025 326236178 /nfs/dbraw/zinc/23/61/78/326236178.db2.gz JPPGVHBYNPNLPK-ZIAGYGMSSA-N 2 0 222.376 2.154 20 0 BEADRP COc1ccc(C[NH2+][C@H](C)CCC[NH3+])c(C)c1 ZINC000567646055 326237552 /nfs/dbraw/zinc/23/75/52/326237552.db2.gz RJZZNBSNBFWGFI-GFCCVEGCSA-N 2 0 236.359 2.221 20 0 BEADRP Cc1ccc(F)c(C[NH2+][C@H](C)C[C@H](C)[NH3+])c1 ZINC000567871140 326274134 /nfs/dbraw/zinc/27/41/34/326274134.db2.gz SBNPFWMKQISYAS-WDEREUQCSA-N 2 0 224.323 2.350 20 0 BEADRP CC1(C[NH+]2CCC([C@@H]3CC[NH2+]C3)CC2)CC1 ZINC000567871168 326274146 /nfs/dbraw/zinc/27/41/46/326274146.db2.gz VANNKGZULQYRQV-CYBMUJFWSA-N 2 0 222.376 2.108 20 0 BEADRP [NH3+]Cc1ccc(C[NH2+]C2CCSCC2)cc1 ZINC000568882742 326381332 /nfs/dbraw/zinc/38/13/32/326381332.db2.gz BFBOYXIWDFKYPB-UHFFFAOYSA-N 2 0 236.384 2.131 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+]CC1CC[NH2+]CC1 ZINC000568974321 326384181 /nfs/dbraw/zinc/38/41/81/326384181.db2.gz CTNPDPFNCIQMAR-SECBINFHSA-N 2 0 238.297 2.307 20 0 BEADRP Cn1ccnc1[C@@H]1CC[N@H+](CC2CCC2)C1 ZINC000569235842 326396870 /nfs/dbraw/zinc/39/68/70/326396870.db2.gz ZWEPABXFLNUYBA-GFCCVEGCSA-N 2 0 219.332 2.010 20 0 BEADRP C[C@@H]([NH2+]CCCCC[NH+]1CCCCC1)[C@H](C)O ZINC000572752015 326408790 /nfs/dbraw/zinc/40/87/90/326408790.db2.gz YQTIIXBXASPRER-KGLIPLIRSA-N 2 0 242.407 2.002 20 0 BEADRP C[NH+](C)CCCC[NH2+]Cc1ccncc1Cl ZINC000084084942 487997686 /nfs/dbraw/zinc/99/76/86/487997686.db2.gz QOECWOBSRQAOOR-UHFFFAOYSA-N 2 0 241.766 2.166 20 0 BEADRP Cc1ccc(CC[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)o1 ZINC000677236877 488004093 /nfs/dbraw/zinc/00/40/93/488004093.db2.gz VLBTZYFYIMMGPE-KBPBESRZSA-N 2 0 248.370 2.347 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)C1 ZINC000400964855 488011516 /nfs/dbraw/zinc/01/15/16/488011516.db2.gz HEUYUPBNDSPMNW-QKGCVVFFSA-N 2 0 236.403 2.400 20 0 BEADRP CC[NH+](CC)Cc1ccnn1-c1cc[nH+]cc1 ZINC000667469848 488015868 /nfs/dbraw/zinc/01/58/68/488015868.db2.gz GWKCATGWSUSMSJ-UHFFFAOYSA-N 2 0 230.315 2.109 20 0 BEADRP CC[C@H]1C[N@H+](CCCc2ccc(C)nc2)C[C@@H]1O ZINC000353816856 488021034 /nfs/dbraw/zinc/02/10/34/488021034.db2.gz QALDHSSYSUFAKN-GJZGRUSLSA-N 2 0 248.370 2.025 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@H]2CCC[C@@H]2C[NH3+])C1 ZINC000251975510 488066539 /nfs/dbraw/zinc/06/65/39/488066539.db2.gz YJQHBJYHXIZKCU-NDBYEHHHSA-N 2 0 210.365 2.282 20 0 BEADRP CC1(C)CCC[N@H+](C[C@H]2CCC[NH2+]C2)CC1 ZINC000083680581 488071306 /nfs/dbraw/zinc/07/13/06/488071306.db2.gz JLAKXLNUTQUAGH-ZDUSSCGKSA-N 2 0 224.392 2.498 20 0 BEADRP CC1(C)CCC[N@H+](CC2CC[NH2+]CC2)CC1 ZINC000083680606 488071465 /nfs/dbraw/zinc/07/14/65/488071465.db2.gz SJANSWZUICGECL-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP Cc1ncc(C[N@@H+](C(C)C)C2CCC2)n1C ZINC000667664780 488080114 /nfs/dbraw/zinc/08/01/14/488080114.db2.gz SJHFXJHCGBCHBA-UHFFFAOYSA-N 2 0 221.348 2.491 20 0 BEADRP C1[C@H]([NH2+]C2CCCCCC2)C12CC[NH2+]CC2 ZINC000389823003 488114958 /nfs/dbraw/zinc/11/49/58/488114958.db2.gz QZFYYYSXJRFDNT-ZDUSSCGKSA-N 2 0 222.376 2.441 20 0 BEADRP CC[NH+](CC)CCC[NH2+]C1(CO)CCCCC1 ZINC000683141407 488117474 /nfs/dbraw/zinc/11/74/74/488117474.db2.gz HTLLSATWJMKBHZ-UHFFFAOYSA-N 2 0 242.407 2.003 20 0 BEADRP C([C@@H]1CC[C@@H]2C[C@@H]2C1)[N@@H+]1[C@@H]2CC[C@H]1C[NH2+]CC2 ZINC000403451163 488124567 /nfs/dbraw/zinc/12/45/67/488124567.db2.gz GBJDAVBNRVNALV-QMIVOQANSA-N 2 0 234.387 2.249 20 0 BEADRP CC[N@@H+]1CCC[C@@H](C[NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)C1 ZINC000667820181 488129069 /nfs/dbraw/zinc/12/90/69/488129069.db2.gz RJOHMYOFTQJNCL-LJISPDSOSA-N 2 0 236.403 2.497 20 0 BEADRP CC[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCC[C@@H]3C[C@@H]32)C1 ZINC000667820180 488129198 /nfs/dbraw/zinc/12/91/98/488129198.db2.gz RJOHMYOFTQJNCL-KBXIAJHMSA-N 2 0 236.403 2.497 20 0 BEADRP CC[C@H]([NH2+][C@H]1CCCN(C)C1)[C@@H]1CC1(C)C ZINC000397653404 488129459 /nfs/dbraw/zinc/12/94/59/488129459.db2.gz MGAZSFYNXJMOMP-AVGNSLFASA-N 2 0 224.392 2.495 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H]2CCC[C@@H]3C[C@@H]32)C1 ZINC000382114113 487531386 /nfs/dbraw/zinc/53/13/86/487531386.db2.gz LOBJZUAVAZXHEG-CRWXNKLISA-N 2 0 222.376 2.106 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)C1 ZINC000382102340 487531844 /nfs/dbraw/zinc/53/18/44/487531844.db2.gz HBHQISNRUMLMLV-RFQIPJPRSA-N 2 0 222.376 2.106 20 0 BEADRP C[C@H]1C[N@H+](CCCC2CC[NH2+]CC2)C[C@H]1C ZINC000086015087 487471551 /nfs/dbraw/zinc/47/15/51/487471551.db2.gz OPUDMVATMFGQCF-BETUJISGSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@H]([NH3+])[C@H]1CC[N@H+](CCC(C)(C)C2CC2)C1 ZINC000405986321 487494409 /nfs/dbraw/zinc/49/44/09/487494409.db2.gz CFSYSZQOHFTZDA-RYUDHWBXSA-N 2 0 224.392 2.482 20 0 BEADRP COc1ccc([C@H](C)[NH2+]CC2CC[NH2+]CC2)cc1 ZINC000094010560 487503384 /nfs/dbraw/zinc/50/33/84/487503384.db2.gz SWQHQTWKSJFGLN-LBPRGKRZSA-N 2 0 248.370 2.345 20 0 BEADRP CC[C@@H](CC(F)F)C[N@H+](C)C1CC([NH3+])C1 ZINC000662274263 487523266 /nfs/dbraw/zinc/52/32/66/487523266.db2.gz SJSIHNYCMFDKSY-IDKOKCKLSA-N 2 0 220.307 2.089 20 0 BEADRP CC(C)N(C)CC[NH2+][C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000379777497 488152128 /nfs/dbraw/zinc/15/21/28/488152128.db2.gz AQSSUTLVWGMEDC-FRRDWIJNSA-N 2 0 210.365 2.105 20 0 BEADRP CCCC[N@@H+]1CCC[C@H]([C@H]2CCC[NH2+]2)C1 ZINC000249907249 487725960 /nfs/dbraw/zinc/72/59/60/487725960.db2.gz YXOKMQJJFIBUQN-QWHCGFSZSA-N 2 0 210.365 2.251 20 0 BEADRP Fc1cccc(C[NH2+][C@@H]2CC23CC[NH2+]CC3)c1 ZINC000666950681 487890835 /nfs/dbraw/zinc/89/08/35/487890835.db2.gz ANYQJOPTMOHXCC-CYBMUJFWSA-N 2 0 234.318 2.057 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]Cc1nccc2ccccc21 ZINC000666941475 487908922 /nfs/dbraw/zinc/90/89/22/487908922.db2.gz CAOPCLKEDVMEJR-LBPRGKRZSA-N 2 0 243.354 2.452 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+]CC(C)(C)c1ccccc1 ZINC000258814112 488137367 /nfs/dbraw/zinc/13/73/67/488137367.db2.gz SSCVDOICFXUIQN-LBPRGKRZSA-N 2 0 220.360 2.149 20 0 BEADRP CCc1ccc(CC[NH2+][C@H]2CCC[C@@H]2[NH3+])cc1 ZINC000258874265 488140032 /nfs/dbraw/zinc/14/00/32/488140032.db2.gz GFPZIMBAGJFCLF-GJZGRUSLSA-N 2 0 232.371 2.261 20 0 BEADRP Cc1noc(C)c1[C@H](C)[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000093216533 488140072 /nfs/dbraw/zinc/14/00/72/488140072.db2.gz RXWFKMJEXYHAFC-UWJYBYFXSA-N 2 0 237.347 2.212 20 0 BEADRP Cc1noc(C)c1[C@H](C)[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000223042805 488140131 /nfs/dbraw/zinc/14/01/31/488140131.db2.gz RXWFKMJEXYHAFC-AXTRIDKLSA-N 2 0 237.347 2.212 20 0 BEADRP CCCCN(C)CC[NH2+][C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000667860637 488140697 /nfs/dbraw/zinc/14/06/97/488140697.db2.gz VHMAMHPYLRAFEB-HZSPNIEDSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H](Cc1ccsc1)[NH2+]CC(C)(C)[NH3+] ZINC000379612016 488143848 /nfs/dbraw/zinc/14/38/48/488143848.db2.gz VAUATPOYROWSCI-SECBINFHSA-N 2 0 212.362 2.006 20 0 BEADRP Cc1ccc(CCC[N@@H+]2CCC3(COC3)C2)cn1 ZINC000668720341 488163103 /nfs/dbraw/zinc/16/31/03/488163103.db2.gz RRFWCWIFAUYXCH-UHFFFAOYSA-N 2 0 246.354 2.045 20 0 BEADRP C[C@H](C[N@H+](C)C1CC[NH2+]CC1)C(C)(C)C ZINC000399423752 488189219 /nfs/dbraw/zinc/18/92/19/488189219.db2.gz CFPJCWZBDXFLRJ-LLVKDONJSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H]([NH3+])C1CC[NH+](CCC2CCC2)CC1 ZINC000398799772 488224626 /nfs/dbraw/zinc/22/46/26/488224626.db2.gz NKSFFVYUIYMPEG-NSHDSACASA-N 2 0 210.365 2.236 20 0 BEADRP C[C@@H]1C[C@H](C)[N@H+](CCC2CCC2)C[C@H]1C[NH3+] ZINC000398899101 488225433 /nfs/dbraw/zinc/22/54/33/488225433.db2.gz HDQKYRDYWUNLJW-MBNYWOFBSA-N 2 0 224.392 2.482 20 0 BEADRP CO[C@H](C)[C@H](C)[NH2+]C1CCC(C[NH+](C)C)CC1 ZINC000678604019 488270905 /nfs/dbraw/zinc/27/09/05/488270905.db2.gz VLDYBNZAOYULOZ-MRFVTOPCSA-N 2 0 242.407 2.120 20 0 BEADRP Cc1ccc(C[NH2+]CC2([NH3+])CCCC2)s1 ZINC000050226773 488366468 /nfs/dbraw/zinc/36/64/68/488366468.db2.gz VPTTZUYRDFRHCV-UHFFFAOYSA-N 2 0 224.373 2.418 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+]Cc1ccccc1C1CC1 ZINC000666825924 490097208 /nfs/dbraw/zinc/09/72/08/490097208.db2.gz ABSOAWAKAJSQIH-NSHDSACASA-N 2 0 218.344 2.248 20 0 BEADRP Cc1ccc(C[NH2+]CC[C@@H]2CCC[N@@H+](C)C2)cn1 ZINC000459723581 490132918 /nfs/dbraw/zinc/13/29/18/490132918.db2.gz AERBXNWYGILKDD-AWEZNQCLSA-N 2 0 247.386 2.212 20 0 BEADRP COc1ccc(C[NH+]2CCC(C)([NH3+])CC2)cc1C ZINC000049836572 490195806 /nfs/dbraw/zinc/19/58/06/490195806.db2.gz DWOFQQQZZFOBFK-UHFFFAOYSA-N 2 0 248.370 2.317 20 0 BEADRP CO[C@@H]1CCC[C@@H]([NH2+]CCC[NH+]2CCCC2)C1 ZINC000070327816 490209469 /nfs/dbraw/zinc/20/94/69/490209469.db2.gz DDENLOHGDHQXED-ZIAGYGMSSA-N 2 0 240.391 2.020 20 0 BEADRP CCCC[NH+]1CCC([NH2+][C@@H]2CCCOC2)CC1 ZINC000070464673 490215809 /nfs/dbraw/zinc/21/58/09/490215809.db2.gz WGWPTBIWSDSRQM-CQSZACIVSA-N 2 0 240.391 2.020 20 0 BEADRP CCCN1CC[C@H]([NH2+]C2CCCCC2)C1 ZINC000328507873 490297939 /nfs/dbraw/zinc/29/79/39/490297939.db2.gz MCSXYBXZYWUMDI-ZDUSSCGKSA-N 2 0 210.365 2.393 20 0 BEADRP C[C@H]1CCCCC[C@@H]1[NH2+]CCC[NH+](C)C ZINC000125021426 490410916 /nfs/dbraw/zinc/41/09/16/490410916.db2.gz JVQJLNKFOZZONR-STQMWFEESA-N 2 0 212.381 2.497 20 0 BEADRP c1oc2ccccc2c1C[NH+]1C[C@@H]2C[NH2+]C[C@H]2C1 ZINC000131044380 490471571 /nfs/dbraw/zinc/47/15/71/490471571.db2.gz AYMKZOJLWSBREJ-RYUDHWBXSA-N 2 0 242.322 2.084 20 0 BEADRP CC1(C)CC[C@H]([NH2+][C@@H]2CCC[NH2+]CC2)C1 ZINC000128606533 490583003 /nfs/dbraw/zinc/58/30/03/490583003.db2.gz QOJIGNUDMVFBJB-NEPJUHHUSA-N 2 0 210.365 2.297 20 0 BEADRP Cc1cc(C)c(C[NH+]2C[C@@H]3C[NH2+]C[C@H]3C2)cc1C ZINC000220220043 490593674 /nfs/dbraw/zinc/59/36/74/490593674.db2.gz ITDJZKBRJUMDDF-HOTGVXAUSA-N 2 0 244.382 2.263 20 0 BEADRP CCC[NH2+]CC[NH2+][C@@H]1CC[C@@H](C)C[C@H]1C ZINC000414862855 491111418 /nfs/dbraw/zinc/11/14/18/491111418.db2.gz BCFVMNUQTCHANT-JHJVBQTASA-N 2 0 212.381 2.400 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@@H]1CC[C@@H]1C1CC1 ZINC000309323173 491146924 /nfs/dbraw/zinc/14/69/24/491146924.db2.gz FQTSLOLDAYQWLA-ZIAGYGMSSA-N 2 0 224.392 2.495 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H]2CCS[C@H]2C)[C@H](C)C1 ZINC000309630425 491153218 /nfs/dbraw/zinc/15/32/18/491153218.db2.gz HPUFBJRJMFHBPT-MROQNXINSA-N 2 0 242.432 2.200 20 0 BEADRP Cc1ccc(CC[NH2+][C@H](C)CC[NH+](C)C)cc1 ZINC000310235599 491160916 /nfs/dbraw/zinc/16/09/16/491160916.db2.gz AETOAWZJDTYJOT-CQSZACIVSA-N 2 0 234.387 2.467 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CC[C@@H](C)C1)[C@@H]1CCC[NH2+]1 ZINC000400482278 533908139 /nfs/dbraw/zinc/90/81/39/533908139.db2.gz CIDSBBVCWATRED-VOAKCMCISA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1C[C@H]1C[N@@H+]1CC2(C[C@H]1C)CC[NH2+]CC2 ZINC000424377037 534018859 /nfs/dbraw/zinc/01/88/59/534018859.db2.gz LPAQFAIXCILICM-UPJWGTAASA-N 2 0 222.376 2.106 20 0 BEADRP C[C@@H]1C[C@H]1C[N@@H+]1CC2(C[C@@H]1C)CC[NH2+]CC2 ZINC000424377029 534019337 /nfs/dbraw/zinc/01/93/37/534019337.db2.gz LPAQFAIXCILICM-AGIUHOORSA-N 2 0 222.376 2.106 20 0 BEADRP CC[C@@]1(C)CC[N@H+](CC2CC[NH+](C)CC2)C1 ZINC000892144228 582800572 /nfs/dbraw/zinc/80/05/72/582800572.db2.gz MNSJGBQPFKDHBP-AWEZNQCLSA-N 2 0 224.392 2.450 20 0 BEADRP C[NH2+]C[C@@H]1CCCN1c1cc[nH+]c(C)c1Cl ZINC000261585111 536460274 /nfs/dbraw/zinc/46/02/74/536460274.db2.gz QENBLHFCAZQAQB-JTQLQIEISA-N 2 0 239.750 2.232 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH+](C)C[C@@H]2C[C@H]2C)C[C@@H]1C ZINC000488302149 527833419 /nfs/dbraw/zinc/83/34/19/527833419.db2.gz SEQJWIANPMUGFG-RFGFWPKPSA-N 2 0 224.392 2.447 20 0 BEADRP CCSCC[C@H](C)[NH2+][C@@H](C)[C@@H]1CCC[NH2+]1 ZINC000400364857 529195489 /nfs/dbraw/zinc/19/54/89/529195489.db2.gz DQFCKCXPSBTGKL-SRVKXCTJSA-N 2 0 230.421 2.248 20 0 BEADRP CCSCC[C@H](C)[NH2+][C@@H](C)[C@H]1CCC[NH2+]1 ZINC000400364855 529195596 /nfs/dbraw/zinc/19/55/96/529195596.db2.gz DQFCKCXPSBTGKL-SDDRHHMPSA-N 2 0 230.421 2.248 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)CCCOC)C1 ZINC000178511359 534958974 /nfs/dbraw/zinc/95/89/74/534958974.db2.gz UDVZLZPBVDDEOP-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+]C[C@H]1CCSC1 ZINC000226373791 535003306 /nfs/dbraw/zinc/00/33/06/535003306.db2.gz MRUJVNFTMJHXSL-GFCCVEGCSA-N 2 0 230.421 2.059 20 0 BEADRP CC(C)C[NH2+][C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000169231553 535170996 /nfs/dbraw/zinc/17/09/96/535170996.db2.gz ACTKCCVGUYWYCS-STQMWFEESA-N 2 0 204.317 2.377 20 0 BEADRP CCC(C)(C)CC[N@@H+]1CC[C@H]([C@@H](C)[NH3+])C1 ZINC000261550456 535350856 /nfs/dbraw/zinc/35/08/56/535350856.db2.gz PLYFTMNKMOBEGE-NEPJUHHUSA-N 2 0 212.381 2.482 20 0 BEADRP CC[C@@H](C)[NH+]1CCN(c2cc[nH+]c(C)c2)CC1 ZINC000295899640 535565897 /nfs/dbraw/zinc/56/58/97/535565897.db2.gz FALUZLOKXJIBGO-CYBMUJFWSA-N 2 0 233.359 2.311 20 0 BEADRP CC[NH+](CC)C[C@@H]1CC[N@H+](CC[C@H](C)F)C1 ZINC000352003498 535585683 /nfs/dbraw/zinc/58/56/83/535585683.db2.gz LUVWPEWJXQQIMA-STQMWFEESA-N 2 0 230.371 2.398 20 0 BEADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@H]1CC[C@@H]1CC ZINC000348069917 535596877 /nfs/dbraw/zinc/59/68/77/535596877.db2.gz HBEOIXDVRJKAGP-MJBXVCDLSA-N 2 0 242.407 2.121 20 0 BEADRP CC[C@@H]([NH2+]CCC[NH3+])c1ccc(F)cc1F ZINC000349161525 535803684 /nfs/dbraw/zinc/80/36/84/535803684.db2.gz UONDZTIGQJIUHF-GFCCVEGCSA-N 2 0 228.286 2.354 20 0 BEADRP CCc1ccccc1C[N@@H+]1CC[C@H]2[NH2+]CC[C@H]2C1 ZINC000261576451 535936675 /nfs/dbraw/zinc/93/66/75/535936675.db2.gz NQMWSZNUDYXOOT-JKSUJKDBSA-N 2 0 244.382 2.433 20 0 BEADRP CC[C@H]1CCC[C@H]([NH2+]CCOCC[NH+](C)C)C1 ZINC000226744870 536076855 /nfs/dbraw/zinc/07/68/55/536076855.db2.gz RTPJOXBCXXWEAZ-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP CCc1ccc(CC[N@@H+]2CC[C@@](C)(C[NH3+])C2)cc1 ZINC000261704995 536170807 /nfs/dbraw/zinc/17/08/07/536170807.db2.gz LXCLGEKIBCTOHP-INIZCTEOSA-N 2 0 246.398 2.462 20 0 BEADRP C[N@H+](CCC[NH3+])Cc1cc2ccccc2o1 ZINC000227743708 536342810 /nfs/dbraw/zinc/34/28/10/536342810.db2.gz NSIICAWOHWODRS-UHFFFAOYSA-N 2 0 218.300 2.213 20 0 BEADRP C[N@@H+]1CCCC[C@@H]1CC[NH+]1CCCSCC1 ZINC000335934797 536354316 /nfs/dbraw/zinc/35/43/16/536354316.db2.gz NEQWBPHGMLWJBK-CYBMUJFWSA-N 2 0 242.432 2.300 20 0 BEADRP C[NH2+][C@@H]1CCCN(c2cc[nH+]c3ccccc32)C1 ZINC000053205034 536365790 /nfs/dbraw/zinc/36/57/90/536365790.db2.gz VAADTBUCXPVYOD-GFCCVEGCSA-N 2 0 241.338 2.423 20 0 BEADRP C[N@@H+]1CCC[C@@H]1CC[NH+]1CC[C@H](C2CC2)C1 ZINC000348072812 536370250 /nfs/dbraw/zinc/37/02/50/536370250.db2.gz KVDDBXDTMMDJRG-UONOGXRCSA-N 2 0 222.376 2.203 20 0 BEADRP CO[C@H](C[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21)C1CC1 ZINC000262002033 536645785 /nfs/dbraw/zinc/64/57/85/536645785.db2.gz PXVLFXJALXIERM-RBSFLKMASA-N 2 0 246.354 2.146 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC[C@H]1C1CC1)C[NH+]1CCCC1 ZINC000348106937 566264531 /nfs/dbraw/zinc/26/45/31/566264531.db2.gz PQFUWEFDFVFNCE-SNPRPXQTSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CC[C@H]1CC1(Cl)Cl ZINC000857253849 583136401 /nfs/dbraw/zinc/13/64/01/583136401.db2.gz TYHFFQVUQRVXFD-CIUDSAMLSA-N 2 0 239.190 2.286 20 0 BEADRP C[C@@H]1CCSCC[N@@H+]1CC1CC[NH+](C)CC1 ZINC000894000698 583271507 /nfs/dbraw/zinc/27/15/07/583271507.db2.gz RYOGEZXFEPLNLS-GFCCVEGCSA-N 2 0 242.432 2.156 20 0 BEADRP C[C@H]1CC[N@H+](CC2CC[NH+](C)CC2)CCS1 ZINC000894029883 583281428 /nfs/dbraw/zinc/28/14/28/583281428.db2.gz OATGVWYQRWQMDX-LBPRGKRZSA-N 2 0 242.432 2.156 20 0 BEADRP CC[C@@H]1C[C@@H](C[NH2+]CC[C@@H]([NH3+])C(C)C)CCO1 ZINC000853247177 588728927 /nfs/dbraw/zinc/72/89/27/588728927.db2.gz FUHIXARPIOEQHE-BFHYXJOUSA-N 2 0 242.407 2.155 20 0 BEADRP CC[C@H]1C[C@@H](C[NH2+]CC[C@@H]([NH3+])C(C)C)CCO1 ZINC000853247179 588729148 /nfs/dbraw/zinc/72/91/48/588729148.db2.gz FUHIXARPIOEQHE-MELADBBJSA-N 2 0 242.407 2.155 20 0 BEADRP C[NH2+]C[C@H](C)[NH2+][C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000853248937 588729164 /nfs/dbraw/zinc/72/91/64/588729164.db2.gz LZUKKXGFSOBOBP-AEJSXWLSSA-N 2 0 238.297 2.305 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H]1C=CCC1 ZINC000854221339 588780122 /nfs/dbraw/zinc/78/01/22/588780122.db2.gz KNLNOIUUESTZIF-ZYHUDNBSSA-N 2 0 231.343 2.218 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+]CC1([NH3+])CCCC1 ZINC000854223495 588780230 /nfs/dbraw/zinc/78/02/30/588780230.db2.gz PZZRDJOXIXIXPY-RYUDHWBXSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+]Cc1cccc(-c2cccc3c2CC[NH2+]C3)c1 ZINC000757215359 582560763 /nfs/dbraw/zinc/56/07/63/582560763.db2.gz NTLOZBXRKCZPJS-UHFFFAOYSA-N 2 0 238.334 2.458 20 0 BEADRP CC(C)[N@H+](CC1CC1)CC1CC[NH+](C)CC1 ZINC000891684019 582709911 /nfs/dbraw/zinc/70/99/11/582709911.db2.gz NZOHYWLEEIYIRV-UHFFFAOYSA-N 2 0 224.392 2.449 20 0 BEADRP C[C@@H]1CCC[N@H+](CC2CC[NH+](C)CC2)[C@@H]1C ZINC000891860925 582730448 /nfs/dbraw/zinc/73/04/48/582730448.db2.gz DUIDBGMWSPUHQF-CHWSQXEVSA-N 2 0 224.392 2.449 20 0 BEADRP C[C@@H]1C[C@H](C)C[N@H+]1CC1CC[NH+](C)CC1 ZINC000892105237 582792864 /nfs/dbraw/zinc/79/28/64/582792864.db2.gz XSWFJTQSIBHGRP-NWDGAFQWSA-N 2 0 210.365 2.059 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2CC[C@H](C3CC3)C2)CC1 ZINC000892144398 582799299 /nfs/dbraw/zinc/79/92/99/582799299.db2.gz NWAXUGBZOFYLOU-AWEZNQCLSA-N 2 0 222.376 2.060 20 0 BEADRP CC1(C)CCCC[C@H]1[NH2+]C[C@@H]([NH3+])C1CC1 ZINC000560942798 582840845 /nfs/dbraw/zinc/84/08/45/582840845.db2.gz ILFMZGGJOUBWAT-VXGBXAGGSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1CSCC[N@H+](CC2CC[NH+](C)CC2)C1 ZINC000894009021 583270249 /nfs/dbraw/zinc/27/02/49/583270249.db2.gz JSIULDSUBAHDJG-LBPRGKRZSA-N 2 0 242.432 2.013 20 0 BEADRP Cc1coc(C[N@H+](C)CC2CC[NH+](C)CC2)c1 ZINC000894002247 583272426 /nfs/dbraw/zinc/27/24/26/583272426.db2.gz OHVHBWQSDIYYKI-UHFFFAOYSA-N 2 0 236.359 2.362 20 0 BEADRP C[N@@H+]1CCC[C@H]1CC[NH+]1CCC[C@@H](CF)C1 ZINC000880237081 583505557 /nfs/dbraw/zinc/50/55/57/583505557.db2.gz PQJFWUHTRMIKBL-STQMWFEESA-N 2 0 228.355 2.152 20 0 BEADRP C[NH+](C)Cc1ccc(NCc2c[nH]cn2)c(F)c1 ZINC000894994134 583564577 /nfs/dbraw/zinc/56/45/77/583564577.db2.gz YNCQOHIZVFFXBF-UHFFFAOYSA-N 2 0 248.305 2.223 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2CCC23CCCC3)CC1 ZINC000895137032 583602440 /nfs/dbraw/zinc/60/24/40/583602440.db2.gz GHHICDNVBZAETC-UHFFFAOYSA-N 2 0 222.376 2.347 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2CC[C@@]3(CC3(F)F)C2)CC1 ZINC000895188231 583619616 /nfs/dbraw/zinc/61/96/16/583619616.db2.gz IHUAPEAEZALKCP-GFCCVEGCSA-N 2 0 244.329 2.059 20 0 BEADRP C[C@@H](CC[NH2+]C[C@H]1CC1(Cl)Cl)[NH+](C)C ZINC000895292086 583637811 /nfs/dbraw/zinc/63/78/11/583637811.db2.gz MBNKWFPSUMWJKJ-DTWKUNHWSA-N 2 0 239.190 2.110 20 0 BEADRP C[C@H](CC[NH2+]C[C@@H]1CC1(Cl)Cl)[NH+](C)C ZINC000895292085 583637914 /nfs/dbraw/zinc/63/79/14/583637914.db2.gz MBNKWFPSUMWJKJ-BDAKNGLRSA-N 2 0 239.190 2.110 20 0 BEADRP CC1=CC[C@H]([NH2+]CC[C@H](C)[NH+](C)C)CC1 ZINC000895294352 583638354 /nfs/dbraw/zinc/63/83/54/583638354.db2.gz UJYMSPDZZVTDMJ-STQMWFEESA-N 2 0 210.365 2.415 20 0 BEADRP COC[C@@H](CC(C)(C)C)[NH2+]CC[C@@H](C)[NH+](C)C ZINC000895292591 583639258 /nfs/dbraw/zinc/63/92/58/583639258.db2.gz RAUGZAPBGNUZEZ-CHWSQXEVSA-N 2 0 244.423 2.367 20 0 BEADRP CCCC[C@@H](COC)[NH2+]CC[C@@H](C)[NH+](C)C ZINC000895293033 583639270 /nfs/dbraw/zinc/63/92/70/583639270.db2.gz FUDRPXMKKULNSM-OLZOCXBDSA-N 2 0 230.396 2.121 20 0 BEADRP CC(C)[C@@H]1C[C@H]([NH2+]CC[C@H](C)[NH+](C)C)CS1 ZINC000895293728 583639750 /nfs/dbraw/zinc/63/97/50/583639750.db2.gz KPPKZNQVOXOVQW-AVGNSLFASA-N 2 0 244.448 2.446 20 0 BEADRP CC[C@@H]1C[C@H](C[NH2+]CC[C@H](C)[NH+](C)C)CCO1 ZINC000895296934 583641364 /nfs/dbraw/zinc/64/13/64/583641364.db2.gz RDXPYHAUHHXTMB-BFHYXJOUSA-N 2 0 242.407 2.121 20 0 BEADRP CCCSC[C@@H](C)[NH2+]CC[C@H](C)[NH+](C)C ZINC000895429950 583668942 /nfs/dbraw/zinc/66/89/42/583668942.db2.gz ZRLLWVJPOORITN-NEPJUHHUSA-N 2 0 232.437 2.448 20 0 BEADRP CC1([NH+]2CCC2)CCN(Cc2ccco2)CC1 ZINC000895671014 583706520 /nfs/dbraw/zinc/70/65/20/583706520.db2.gz LVLZZMRGVILYLV-UHFFFAOYSA-N 2 0 234.343 2.340 20 0 BEADRP C[C@H]1[C@H]([NH2+]C[C@@H]2C[C@H]2c2ccccc2)CCN1C ZINC000896555599 583811649 /nfs/dbraw/zinc/81/16/49/583811649.db2.gz PGJPIEQZJSNZCZ-QCEMKRCNSA-N 2 0 244.382 2.472 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CC(C)(C)C2CC2)CC[N@@H+]1C ZINC000897437950 583983619 /nfs/dbraw/zinc/98/36/19/583983619.db2.gz QEFXKVLKTQNATL-AAEUAGOBSA-N 2 0 224.392 2.495 20 0 BEADRP CN1CCC([NH2+][C@@H]2CCSC(C)(C)C2)CC1 ZINC000897797303 584049391 /nfs/dbraw/zinc/04/93/91/584049391.db2.gz FNMVNYLXZKQZLT-GFCCVEGCSA-N 2 0 242.432 2.344 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@@H]2C[C@H]3CCC[C@@H]32)CC1 ZINC000897959815 584067527 /nfs/dbraw/zinc/06/75/27/584067527.db2.gz LTXAYJKGALINAA-HZSPNIEDSA-N 2 0 222.376 2.106 20 0 BEADRP CC[NH+]1CCC([NH2+]CCc2cccnc2C)CC1 ZINC000898253473 584101047 /nfs/dbraw/zinc/10/10/47/584101047.db2.gz PNZUGBBFSFRDRW-UHFFFAOYSA-N 2 0 247.386 2.006 20 0 BEADRP CC1(C)CC[C@@H](C[NH2+][C@@H]2CCCC[C@H]2[NH3+])OC1 ZINC000866667424 584121566 /nfs/dbraw/zinc/12/15/66/584121566.db2.gz LZTZTJBNURNBGM-YNEHKIRRSA-N 2 0 240.391 2.051 20 0 BEADRP CCc1ccc([C@@H](C)[NH2+]C[C@H]2C[C@H]([NH3+])C2)o1 ZINC000873254770 584128000 /nfs/dbraw/zinc/12/80/00/584128000.db2.gz ADLCRZGNMRKGGS-GMTAPVOTSA-N 2 0 222.332 2.230 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccc(Cl)nc1 ZINC000873251399 584128155 /nfs/dbraw/zinc/12/81/55/584128155.db2.gz MHMHAQMWKXDVAG-KKZNHRDASA-N 2 0 239.750 2.123 20 0 BEADRP CC1(C)CO[C@H](C[NH2+][C@@H]2CCCCC[C@@H]2[NH3+])C1 ZINC000873281692 584128480 /nfs/dbraw/zinc/12/84/80/584128480.db2.gz OWFGOQFWLKTRLY-RWMBFGLXSA-N 2 0 240.391 2.051 20 0 BEADRP CC1(C)CO[C@H](C[NH2+][C@H]2CCCCC[C@@H]2[NH3+])C1 ZINC000873281691 584128811 /nfs/dbraw/zinc/12/88/11/584128811.db2.gz OWFGOQFWLKTRLY-AVGNSLFASA-N 2 0 240.391 2.051 20 0 BEADRP C[N@@H+]1CCCC[C@H](C[NH2+][C@H]2CC[C@H]2C2CC2)C1 ZINC000858490871 588960109 /nfs/dbraw/zinc/96/01/09/588960109.db2.gz RILDURTXFMOXBB-SNPRPXQTSA-N 2 0 236.403 2.497 20 0 BEADRP [NH3+][C@@H]1Cc2ccc(C3=C[C@H]4CC[C@@H](C3)[NH2+]4)cc2C1 ZINC000899327760 584197675 /nfs/dbraw/zinc/19/76/75/584197675.db2.gz FVUPZPCBOYMDOA-OAGGEKHMSA-N 2 0 240.350 2.020 20 0 BEADRP CSCC[C@@H](C)[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000902328457 584561348 /nfs/dbraw/zinc/56/13/48/584561348.db2.gz KVONVHZXRKCSDP-VXGBXAGGSA-N 2 0 244.448 2.496 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]([NH2+]C[C@H]2CCC=CO2)C1 ZINC000902375997 584567816 /nfs/dbraw/zinc/56/78/16/584567816.db2.gz GNCWGDSTFGSEAY-CHWSQXEVSA-N 2 0 238.375 2.047 20 0 BEADRP CSC1(C[NH2+][C@@H]2CC[NH2+]CC(C)(C)C2)CC1 ZINC000902385360 584578135 /nfs/dbraw/zinc/57/81/35/584578135.db2.gz ZZBHYIWDFTVBPD-LLVKDONJSA-N 2 0 242.432 2.250 20 0 BEADRP CC(C)SCC[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000902385443 584578400 /nfs/dbraw/zinc/57/84/00/584578400.db2.gz VDDOPBPJOQEUSV-GFCCVEGCSA-N 2 0 244.448 2.496 20 0 BEADRP CC(C)SCC[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000902385444 584578555 /nfs/dbraw/zinc/57/85/55/584578555.db2.gz VDDOPBPJOQEUSV-LBPRGKRZSA-N 2 0 244.448 2.496 20 0 BEADRP CC(F)(F)CC[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000902389758 584580964 /nfs/dbraw/zinc/58/09/64/584580964.db2.gz XNDNXAJRJAYVDN-JTQLQIEISA-N 2 0 234.334 2.400 20 0 BEADRP COCC[C@@H](C)C[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000902390094 584581303 /nfs/dbraw/zinc/58/13/03/584581303.db2.gz GXNLBQGBWJVFQW-OLZOCXBDSA-N 2 0 242.407 2.027 20 0 BEADRP COCC[C@H](C)C[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000902390096 584581474 /nfs/dbraw/zinc/58/14/74/584581474.db2.gz GXNLBQGBWJVFQW-STQMWFEESA-N 2 0 242.407 2.027 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]([NH2+][C@@H]2C[C@H]3C[C@H]3C2)C1 ZINC000902391877 584583024 /nfs/dbraw/zinc/58/30/24/584583024.db2.gz CAAJFAQOSPNUEG-RNJOBUHISA-N 2 0 222.376 2.153 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]([NH2+]CC[C@H]2CC2(F)F)C1 ZINC000902397831 584585389 /nfs/dbraw/zinc/58/53/89/584585389.db2.gz IEUKXEGQQHMHGJ-WDEREUQCSA-N 2 0 246.345 2.400 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]([NH2+]CC[C@@H]2CC2(F)F)C1 ZINC000902396922 584585453 /nfs/dbraw/zinc/58/54/53/584585453.db2.gz IEUKXEGQQHMHGJ-MNOVXSKESA-N 2 0 246.345 2.400 20 0 BEADRP C[C@@H]([NH2+]CC1([NH3+])CC1)C1CCC(F)(F)CC1 ZINC000902403656 584588061 /nfs/dbraw/zinc/58/80/61/584588061.db2.gz AKOCTOVXGBSXSD-SECBINFHSA-N 2 0 232.318 2.281 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]([NH2+]C[C@@H]2C=CCC2)C1 ZINC000902404609 584589143 /nfs/dbraw/zinc/58/91/43/584589143.db2.gz XJIOEFFVEWRTKA-OLZOCXBDSA-N 2 0 222.376 2.320 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CC(C)(C)C1CCOCC1 ZINC000902432232 584595406 /nfs/dbraw/zinc/59/54/06/584595406.db2.gz ORGBKWRYIMIRCR-VXGBXAGGSA-N 2 0 242.407 2.155 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+]CC(C)(C)C1CC1 ZINC000902434681 584596203 /nfs/dbraw/zinc/59/62/03/584596203.db2.gz ZCFDTQAONJZBHU-WCQYABFASA-N 2 0 224.392 2.400 20 0 BEADRP CC1(C)C[NH2+]C[C@@H]1[NH2+]C1CCC2(CC2)CC1 ZINC000902440880 584597935 /nfs/dbraw/zinc/59/79/35/584597935.db2.gz AVIDBGKFUXVHMM-LBPRGKRZSA-N 2 0 222.376 2.297 20 0 BEADRP CC1(C)CC[C@H]([NH2+][C@@H]2C[NH2+]CC2(C)C)C1 ZINC000902443931 584598178 /nfs/dbraw/zinc/59/81/78/584598178.db2.gz MOMUUDFVONAMHK-WDEREUQCSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[NH2+]CC1(C)C)C1CCSCC1 ZINC000902443179 584598246 /nfs/dbraw/zinc/59/82/46/584598246.db2.gz KJHZLFMXRUKFJZ-ZYHUDNBSSA-N 2 0 242.432 2.106 20 0 BEADRP [NH3+]C1(C[NH2+][C@H]2CCC[C@@H]2c2ccccc2)CC1 ZINC000902413750 584599509 /nfs/dbraw/zinc/59/95/09/584599509.db2.gz OFYFNUJXEWAACK-KGLIPLIRSA-N 2 0 230.355 2.404 20 0 BEADRP CC(C)[C@H]([NH2+]CC1([NH3+])CC1)c1ccccc1 ZINC000902413512 584599791 /nfs/dbraw/zinc/59/97/91/584599791.db2.gz NFFLBDHHXHCLKX-ZDUSSCGKSA-N 2 0 218.344 2.465 20 0 BEADRP [NH3+]C1(CN[C@@H]2CCc3ccc(Cl)cc32)CC1 ZINC000902414666 584600349 /nfs/dbraw/zinc/60/03/49/584600349.db2.gz YYPTYULWRKSXPR-GFCCVEGCSA-N 2 0 236.746 2.408 20 0 BEADRP C[C@H]1CCC[C@@H]([NH2+][C@@H]2C[C@H]3CC[C@@H]2[NH2+]3)C1 ZINC000902473238 584601201 /nfs/dbraw/zinc/60/12/01/584601201.db2.gz VUOXQZRVHZKHQU-CKIKVBCHSA-N 2 0 208.349 2.048 20 0 BEADRP CCCCC[C@@H](C)[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902473031 584601401 /nfs/dbraw/zinc/60/14/01/584601401.db2.gz OROLMYWPDORAHG-FVCCEPFGSA-N 2 0 210.365 2.438 20 0 BEADRP C1CC1[C@@H]1CCCC[C@H]1[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902473832 584601986 /nfs/dbraw/zinc/60/19/86/584601986.db2.gz AERUVHRGIZAXCH-QKGCVVFFSA-N 2 0 234.387 2.438 20 0 BEADRP C[C@H](CC1CCCC1)[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902478941 584603504 /nfs/dbraw/zinc/60/35/04/584603504.db2.gz ZAIFDBNFCMJPHW-RUZUBIRVSA-N 2 0 222.376 2.438 20 0 BEADRP CC1(C)C[NH2+]C[C@H]1[NH2+][C@@H]1CCCC12CCC2 ZINC000902447567 584605022 /nfs/dbraw/zinc/60/50/22/584605022.db2.gz ZQWBILILAGTDCJ-VXGBXAGGSA-N 2 0 222.376 2.297 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+][C@H]1C[NH2+]CC1(C)C ZINC000902448119 584605126 /nfs/dbraw/zinc/60/51/26/584605126.db2.gz CJTNEHCTMGCTTM-WOPDTQHZSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)[C@@H]1CCC[C@H]1[NH2+][C@@H]1C[NH2+]CC1(C)C ZINC000902448692 584605632 /nfs/dbraw/zinc/60/56/32/584605632.db2.gz HAOQPMKTGGHQID-YNEHKIRRSA-N 2 0 224.392 2.399 20 0 BEADRP C1[C@H]2CCC[C@H]2[C@H]1[NH2+][C@@H]1CC[NH2+]C12CCCC2 ZINC000902453072 584607726 /nfs/dbraw/zinc/60/77/26/584607726.db2.gz BZDAEOXBCSXJDQ-YIYPIFLZSA-N 2 0 234.387 2.439 20 0 BEADRP C1[C@H]2CCC[C@@H]2[C@H]1[NH2+][C@@H]1CC[NH2+]C12CCCC2 ZINC000902453073 584607739 /nfs/dbraw/zinc/60/77/39/584607739.db2.gz BZDAEOXBCSXJDQ-ZOBORPQBSA-N 2 0 234.387 2.439 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+][C@@H]1C[C@@H]2CCC[C@H]12 ZINC000902453429 584607896 /nfs/dbraw/zinc/60/78/96/584607896.db2.gz CSPDCHMYUKJEPR-PDWCTOEPSA-N 2 0 222.376 2.425 20 0 BEADRP C1[C@H]2CCC[C@H]2[C@@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000902453951 584608818 /nfs/dbraw/zinc/60/88/18/584608818.db2.gz GHVFPSULEBPTOU-GSWZFVNLSA-N 2 0 220.360 2.048 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H]2C[C@@H]3CCC[C@H]23)C1 ZINC000902455431 584609127 /nfs/dbraw/zinc/60/91/27/584609127.db2.gz LZZUHZBATFXQKN-FPYNETTCSA-N 2 0 208.349 2.035 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+][C@@H]1C[C@H]2CCC[C@@H]21 ZINC000902456471 584610253 /nfs/dbraw/zinc/61/02/53/584610253.db2.gz PBAIGSUIPPEPJS-OXSAOZNPSA-N 2 0 234.387 2.281 20 0 BEADRP CC1(C)CCC[C@H](C[NH2+][C@@H]2CCC[C@@H]2C[NH3+])O1 ZINC000902460246 584610827 /nfs/dbraw/zinc/61/08/27/584610827.db2.gz FUSBBYNDOWPVAC-JHJVBQTASA-N 2 0 240.391 2.051 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1C[C@H]2CCC[C@H]21 ZINC000902459122 584610892 /nfs/dbraw/zinc/61/08/92/584610892.db2.gz XGRDUTMVBIHHPB-XHJNMGKDSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+][C@@H]1C[C@H]2CCC[C@H]21 ZINC000902458637 584611155 /nfs/dbraw/zinc/61/11/55/584611155.db2.gz WWWFSEWJTOXJDG-XGFWRYKXSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]C[C@@H]1CCCC(C)(C)O1 ZINC000902460618 584611690 /nfs/dbraw/zinc/61/16/90/584611690.db2.gz HPNKGIDBBAMUSG-TUAOUCFPSA-N 2 0 228.380 2.050 20 0 BEADRP CC(C)[C@H]1CCC[C@@H]1[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902464811 584613078 /nfs/dbraw/zinc/61/30/78/584613078.db2.gz CWNZDDBPJWBSJM-MEBFFEOJSA-N 2 0 222.376 2.294 20 0 BEADRP C[C@H](CCC1CC1)[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902464380 584613349 /nfs/dbraw/zinc/61/33/49/584613349.db2.gz CBMOZIZNPSVKGF-FOUMNBMASA-N 2 0 208.349 2.048 20 0 BEADRP CCC(C)(C)[C@@H](C)[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902466839 584614738 /nfs/dbraw/zinc/61/47/38/584614738.db2.gz NMQXRZQUDPBDFZ-WISYIIOYSA-N 2 0 210.365 2.294 20 0 BEADRP C[C@@H]1CCC[C@@H](C)C1[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902470735 584616227 /nfs/dbraw/zinc/61/62/27/584616227.db2.gz GFSBCSXKHDJQJH-UJPOAAIJSA-N 2 0 222.376 2.294 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+][C@H]2CCc3cc(F)ccc32)C1 ZINC000902489961 584617230 /nfs/dbraw/zinc/61/72/30/584617230.db2.gz SYUOGECXBKIELG-WFBYXXMGSA-N 2 0 234.318 2.140 20 0 BEADRP C1CC1[C@@H]1CCC[C@H]([NH2+][C@@H]2C[C@@H]3CC[C@H]2[NH2+]3)C1 ZINC000902471773 584617743 /nfs/dbraw/zinc/61/77/43/584617743.db2.gz SKGNNNLFNCFHHC-GZBLMMOJSA-N 2 0 234.387 2.438 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+][C@H]2CCC[C@H](C3CC3)C2)C1 ZINC000902491671 584618334 /nfs/dbraw/zinc/61/83/34/584618334.db2.gz YGWFXPYTZSNQKL-PYJNHQTQSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@@H]1CC=CC[C@H]1[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000902503858 584621307 /nfs/dbraw/zinc/62/13/07/584621307.db2.gz LIYUIYKSNGUNCF-GZBLMMOJSA-N 2 0 234.387 2.319 20 0 BEADRP C[C@H](CC1CC1)[NH2+]C[C@H]1CCCCC[NH2+]1 ZINC000902481410 584624331 /nfs/dbraw/zinc/62/43/31/584624331.db2.gz CONKQZDVBPMGEV-DGCLKSJQSA-N 2 0 210.365 2.297 20 0 BEADRP C([NH2+][C@@H]1CC[C@@H]1C1CC1)[C@@H]1CCCCC[NH2+]1 ZINC000902482160 584624337 /nfs/dbraw/zinc/62/43/37/584624337.db2.gz JXOJHVBPPAJUKS-BFHYXJOUSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CCCCC[NH2+]1 ZINC000902485317 584624740 /nfs/dbraw/zinc/62/47/40/584624740.db2.gz ZPMAELGMXOIGLJ-UPJWGTAASA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1CC(C)(C)C[C@H]1[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902484136 584624872 /nfs/dbraw/zinc/62/48/72/584624872.db2.gz DLEQPJVZSWNHNR-DDHJBXDOSA-N 2 0 210.365 2.138 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+][C@@H]2CCCC[C@H]2C2CC2)C1 ZINC000902484111 584624936 /nfs/dbraw/zinc/62/49/36/584624936.db2.gz CVNPFESLQNBRSL-DOERSZECSA-N 2 0 222.376 2.282 20 0 BEADRP CC(C)C[C@@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1ccccn1 ZINC000902485618 584625214 /nfs/dbraw/zinc/62/52/14/584625214.db2.gz BSJZTOXWYCOSFH-UMVBOHGHSA-N 2 0 247.386 2.496 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+][C@H](C2CC2)C2CCCC2)C1 ZINC000902486341 584625233 /nfs/dbraw/zinc/62/52/33/584625233.db2.gz FBLPYBXWXXZJOF-BPNCWPANSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@@H]([NH2+][C@H]2C[C@H](C[NH3+])C2)C1 ZINC000902486126 584625300 /nfs/dbraw/zinc/62/53/00/584625300.db2.gz PWEUGWCPUMLQNC-MLGHIDQZSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H]1Cc2ccccc2[C@H]1[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902485614 584625383 /nfs/dbraw/zinc/62/53/83/584625383.db2.gz BRWIANFTIPXGNU-CVMIBZJCSA-N 2 0 230.355 2.247 20 0 BEADRP C[C@@H]1CC([NH2+][C@H]2C[C@H](C[NH3+])C2)C[C@@H](C)C1 ZINC000902486652 584625901 /nfs/dbraw/zinc/62/59/01/584625901.db2.gz HPXAVNKJRMYRAD-ZPFDUUQYSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@H](Cc1ccc(F)cc1)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902487498 584626641 /nfs/dbraw/zinc/62/66/41/584626641.db2.gz HRWDGFPTGQMVDL-MPKXVKKWSA-N 2 0 236.334 2.084 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+][C@H]2C[C@H](C[NH3+])C2)c(C)n1 ZINC000902487645 584626731 /nfs/dbraw/zinc/62/67/31/584626731.db2.gz LIOQYHMCQDIBQL-JHJVBQTASA-N 2 0 233.359 2.086 20 0 BEADRP C[C@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1ccccc1 ZINC000902488082 584626880 /nfs/dbraw/zinc/62/68/80/584626880.db2.gz JOBRYMVHMGVWOQ-GVXVVHGQSA-N 2 0 204.317 2.075 20 0 BEADRP C[C@@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1cc(F)ccc1F ZINC000902489441 584627271 /nfs/dbraw/zinc/62/72/71/584627271.db2.gz QYVZZNOMHPOVKB-FXPVBKGRSA-N 2 0 240.297 2.353 20 0 BEADRP Cc1cccc2c1CC[C@H]2[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902488834 584627305 /nfs/dbraw/zinc/62/73/05/584627305.db2.gz OUSHHMXTIIWWHU-LALPHHSUSA-N 2 0 230.355 2.309 20 0 BEADRP CCC[C@@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)C1CCC1 ZINC000902489021 584627314 /nfs/dbraw/zinc/62/73/14/584627314.db2.gz PSVZRDYSLDSRLL-RAIGVLPGSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)[C@@H]1CCC[C@@H]1[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902489337 584627356 /nfs/dbraw/zinc/62/73/56/584627356.db2.gz PEKIKEZJZBEBFE-CYDGBPFRSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@H](Cc1cccs1)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902488598 584627364 /nfs/dbraw/zinc/62/73/64/584627364.db2.gz NKFQFBXHYCYXSV-GMTAPVOTSA-N 2 0 224.373 2.006 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+][C@@H](c2ccccc2)C2CC2)C1 ZINC000902488787 584627462 /nfs/dbraw/zinc/62/74/62/584627462.db2.gz NYRBJRHKWHFCNT-CQDKDKBSSA-N 2 0 230.355 2.465 20 0 BEADRP COc1cc(C)ccc1[C@H](C)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902489379 584627511 /nfs/dbraw/zinc/62/75/11/584627511.db2.gz PVWGLGBBLQYNQT-AVGNSLFASA-N 2 0 248.370 2.392 20 0 BEADRP COc1ccc(C)cc1[C@H](C)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902489504 584627722 /nfs/dbraw/zinc/62/77/22/584627722.db2.gz SDTGCGWLXYMMFM-AVGNSLFASA-N 2 0 248.370 2.392 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+][C@H](c2ccccc2)C2CC2)C1 ZINC000902488788 584627756 /nfs/dbraw/zinc/62/77/56/584627756.db2.gz NYRBJRHKWHFCNT-KCPJHIHWSA-N 2 0 230.355 2.465 20 0 BEADRP C[C@@H]([NH2+]C1(C2CCCCC2)CC1)C1C[NH2+]C1 ZINC000902517370 584630093 /nfs/dbraw/zinc/63/00/93/584630093.db2.gz KXJPYNWMIPPEEP-LLVKDONJSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@@H]1C[C@H]2CCC[C@H]2C1 ZINC000902780764 584669652 /nfs/dbraw/zinc/66/96/52/584669652.db2.gz SAHJFJQFFRTGSL-YIYPIFLZSA-N 2 0 224.392 2.495 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@@H]1C[C@H]2CCC[C@H]2C1 ZINC000902780179 584669906 /nfs/dbraw/zinc/66/99/06/584669906.db2.gz BQEYHILVCQEIGS-BTTYYORXSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH+]1CCC(C[NH2+]C2C[C@H]3CCC[C@@H]3C2)CC1 ZINC000902792512 584673533 /nfs/dbraw/zinc/67/35/33/584673533.db2.gz AULMJVHNIAZNTI-ZIAGYGMSSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]1C[C@H]1[C@@H]1C[C@H]1[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000903252500 584739197 /nfs/dbraw/zinc/73/91/97/584739197.db2.gz DITRWFOBDWPRHK-ZAQNNHEOSA-N 2 0 234.387 2.247 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@@H]1CCC[C@@H](C)[C@@H]1C ZINC000903458749 584765167 /nfs/dbraw/zinc/76/51/67/584765167.db2.gz IQQQTQUKVDARLN-PEBLQZBPSA-N 2 0 224.392 2.256 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CC[C@H]([NH3+])C1)C1CCCC1 ZINC000903458950 584765677 /nfs/dbraw/zinc/76/56/77/584765677.db2.gz NVLDDWDEEQKUBC-LOWVWBTDSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C[C@H]2CCC[NH2+]2)[C@@H](C)C1 ZINC000903459766 584765732 /nfs/dbraw/zinc/76/57/32/584765732.db2.gz ZHEQYJQCLGTVCK-YVECIDJPSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@H]1CCCCC1(C)C ZINC000903458887 584765838 /nfs/dbraw/zinc/76/58/38/584765838.db2.gz MKBOSJCBZQACJK-AGIUHOORSA-N 2 0 224.392 2.400 20 0 BEADRP CC[C@@H]1CCC[C@H](C)N1C[C@H]1CCC[NH2+]1 ZINC000903464119 584767516 /nfs/dbraw/zinc/76/75/16/584767516.db2.gz AMXGQZVFGWLXQE-YNEHKIRRSA-N 2 0 210.365 2.391 20 0 BEADRP C[C@@H]([NH3+])[C@H]1CC[N@H+](Cc2ccc3cc[nH]c3c2)C1 ZINC000903447138 584770420 /nfs/dbraw/zinc/77/04/20/584770420.db2.gz GOFGYSHYKISOQK-RISCZKNCSA-N 2 0 243.354 2.337 20 0 BEADRP C[N@H+](C[C@@H]1CC1(C)C)C[C@@H]1CC[C@H]([NH3+])C1 ZINC000903464553 584770881 /nfs/dbraw/zinc/77/08/81/584770881.db2.gz RFXRHYUEHPJVQR-WOPDTQHZSA-N 2 0 210.365 2.092 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1CCCC[C@@H]1[C@@H]1CC[NH2+]C1 ZINC000903454126 584772787 /nfs/dbraw/zinc/77/27/87/584772787.db2.gz VNFPXWVCVABOPR-APIJFGDWSA-N 2 0 236.403 2.497 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1CCC[C@@H]([C@H]2CC[NH2+]C2)C1 ZINC000903453833 584773041 /nfs/dbraw/zinc/77/30/41/584773041.db2.gz NJEYFYSEIRDEMP-BARDWOONSA-N 2 0 236.403 2.354 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1CCCC[C@H]1[C@@H]1CC[NH2+]C1 ZINC000903454128 584773595 /nfs/dbraw/zinc/77/35/95/584773595.db2.gz VNFPXWVCVABOPR-KBXIAJHMSA-N 2 0 236.403 2.497 20 0 BEADRP CC(F)(F)CCC[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000903471605 584775200 /nfs/dbraw/zinc/77/52/00/584775200.db2.gz KNHCYUZYSUOFRD-JTQLQIEISA-N 2 0 232.318 2.296 20 0 BEADRP CCSCCC[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000903472506 584775952 /nfs/dbraw/zinc/77/59/52/584775952.db2.gz ZYXSKEYBTFXGTP-NSHDSACASA-N 2 0 228.405 2.004 20 0 BEADRP CC1(C)[C@@H]([NH3+])c2ccccc2N1C[C@H]1CCC[NH2+]1 ZINC000903476092 584777337 /nfs/dbraw/zinc/77/73/37/584777337.db2.gz NBLSILJSKQCEIR-RISCZKNCSA-N 2 0 245.370 2.037 20 0 BEADRP C[C@H]1C[N@H+](Cc2ccc3cc[nH]c3c2)C[C@H]1C[NH3+] ZINC000903477315 584777817 /nfs/dbraw/zinc/77/78/17/584777817.db2.gz YDZFFDLCOUXABU-SMDDNHRTSA-N 2 0 243.354 2.195 20 0 BEADRP C[C@@H]1C[N@H+](Cc2ccc3cc[nH]c3c2)C[C@H]1C[NH3+] ZINC000903477312 584778120 /nfs/dbraw/zinc/77/81/20/584778120.db2.gz YDZFFDLCOUXABU-BXUZGUMPSA-N 2 0 243.354 2.195 20 0 BEADRP CC1(C)CN([C@@H]2CCc3ccc(F)cc32)C[C@@H]1[NH3+] ZINC000903556322 584782725 /nfs/dbraw/zinc/78/27/25/584782725.db2.gz UVGKJTFHXOFRAF-KGLIPLIRSA-N 2 0 248.345 2.482 20 0 BEADRP CC[NH2+]CC1CC[NH+](CC2CC(C)C2)CC1 ZINC000903717773 584792316 /nfs/dbraw/zinc/79/23/16/584792316.db2.gz WGRFCCDCBIOLRL-UHFFFAOYSA-N 2 0 224.392 2.354 20 0 BEADRP CC1CC(C[N@@H+]2CCCC[C@@H]2CC[NH3+])C1 ZINC000903749395 584795012 /nfs/dbraw/zinc/79/50/12/584795012.db2.gz KKSXQKRTFKOEPS-WXRRBKDZSA-N 2 0 210.365 2.236 20 0 BEADRP CC1CC(C[N@@H+]2CCCC[C@H]2[C@@H]2CC[NH2+]C2)C1 ZINC000903752457 584795776 /nfs/dbraw/zinc/79/57/76/584795776.db2.gz SSGLFIPHTABYHI-CVSAEHQPSA-N 2 0 236.403 2.497 20 0 BEADRP CC1CC(C[N@@H+]2CCC[C@H]([C@H]3CCC[NH2+]3)C2)C1 ZINC000903740888 584795983 /nfs/dbraw/zinc/79/59/83/584795983.db2.gz LTJDSCSDCWYTFY-PFSRBDOWSA-N 2 0 236.403 2.497 20 0 BEADRP CC1CC(C[N@@H+]2CCC3(C2)CC[NH2+]CC3)C1 ZINC000903742561 584796424 /nfs/dbraw/zinc/79/64/24/584796424.db2.gz DHVSUDGJZUKTFW-UHFFFAOYSA-N 2 0 222.376 2.108 20 0 BEADRP CC1CC(C[N@@H+]2C[C@@H]3CCC[C@@H]([NH3+])[C@H]3C2)C1 ZINC000903743086 584796509 /nfs/dbraw/zinc/79/65/09/584796509.db2.gz IEPBWOKAWSQDSP-DMTXQYTPSA-N 2 0 222.376 2.092 20 0 BEADRP FC1(F)C[C@@]12CC[N@H+](C[C@@H]1CCCC[NH2+]C1)C2 ZINC000903768793 584797779 /nfs/dbraw/zinc/79/77/79/584797779.db2.gz QVVYUOSUXMZFHI-VXGBXAGGSA-N 2 0 244.329 2.107 20 0 BEADRP NC[C@]12CC[C@@H]1CCC[N@@H+]2CCc1ccccc1 ZINC000903795034 584799017 /nfs/dbraw/zinc/79/90/17/584799017.db2.gz HXXZJBYKJVMXCS-JKSUJKDBSA-N 2 0 244.382 2.432 20 0 BEADRP C[C@@H]1C[N@H+](Cc2ccccc2CF)C[C@H]1C[NH3+] ZINC000903775006 584799037 /nfs/dbraw/zinc/79/90/37/584799037.db2.gz FCOHJNUKTAHHSA-BXUZGUMPSA-N 2 0 236.334 2.183 20 0 BEADRP CC1(F)CC[NH+](C[C@@H]2CCCC[NH2+]C2)CC1 ZINC000903778173 584799526 /nfs/dbraw/zinc/79/95/26/584799526.db2.gz JZWOMSIKWIEFDF-GFCCVEGCSA-N 2 0 228.355 2.200 20 0 BEADRP CC1CC(C[N@@H+]2CCCC[C@]3(CC[NH2+]C3)C2)C1 ZINC000903784708 584799982 /nfs/dbraw/zinc/79/99/82/584799982.db2.gz QKMZQPXVPJJZLW-YMAMQOFZSA-N 2 0 236.403 2.498 20 0 BEADRP [NH3+]CC1([C@H]2CCCC[N@@H+]2CCCF)CCC1 ZINC000903810300 584803252 /nfs/dbraw/zinc/80/32/52/584803252.db2.gz ADIUMQMVASQPIG-GFCCVEGCSA-N 2 0 228.355 2.330 20 0 BEADRP COCCC[N@@H+]1CCCC[C@@H]1C1(C[NH3+])CCC1 ZINC000903810716 584803301 /nfs/dbraw/zinc/80/33/01/584803301.db2.gz FZYZJIJLIFPBGC-CYBMUJFWSA-N 2 0 240.391 2.006 20 0 BEADRP C[C@H](C[NH2+][C@@H]1C[NH2+]CC1(C)C)C(C)(C)C ZINC000903821640 584804078 /nfs/dbraw/zinc/80/40/78/584804078.db2.gz OLUXVRVWVAWKLL-GHMZBOCLSA-N 2 0 212.381 2.256 20 0 BEADRP C[C@H]1CSCCC[N@@H+]1CCC1CC[NH2+]CC1 ZINC000903829323 584805501 /nfs/dbraw/zinc/80/55/01/584805501.db2.gz CSDZXYNLVCPTKP-LBPRGKRZSA-N 2 0 242.432 2.204 20 0 BEADRP [NH3+][C@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccccc1CF)C2 ZINC000903840968 584807248 /nfs/dbraw/zinc/80/72/48/584807248.db2.gz VLZTWAXMFRAQPU-CQDKDKBSSA-N 2 0 248.345 2.468 20 0 BEADRP CC(C)=CCC[N@@H+]1CC[C@H]2CC[C@]21CN ZINC000903856533 584809377 /nfs/dbraw/zinc/80/93/77/584809377.db2.gz ABFUZHQDEOEACN-OLZOCXBDSA-N 2 0 208.349 2.156 20 0 BEADRP CC1(C)CC(C[N@@H+]2CCC[C@]23CC[NH2+]C3)C1 ZINC000903869322 584814658 /nfs/dbraw/zinc/81/46/58/584814658.db2.gz GXACRTFFIAOPTG-CQSZACIVSA-N 2 0 222.376 2.251 20 0 BEADRP CC1(C[N@@H+]2CCCC[C@@]3(CC[NH2+]C3)C2)CC1 ZINC000903960032 584827472 /nfs/dbraw/zinc/82/74/72/584827472.db2.gz VKOFIAMPJUBKKO-AWEZNQCLSA-N 2 0 222.376 2.252 20 0 BEADRP CC(C)([NH3+])CC[NH2+]Cc1ccc2ncccc2c1 ZINC000903941321 584828906 /nfs/dbraw/zinc/82/89/06/584828906.db2.gz ZFNMENQOYCOVEF-UHFFFAOYSA-N 2 0 243.354 2.452 20 0 BEADRP COc1cc(C[NH2+]CCC(C)(C)[NH3+])ccc1C ZINC000903940033 584829260 /nfs/dbraw/zinc/82/92/60/584829260.db2.gz TXWWJJUDLQJBRX-UHFFFAOYSA-N 2 0 236.359 2.221 20 0 BEADRP C[C@H]1CCC[C@@H]1[NH2+]CC[C@@H]1C[NH2+]C[C@H]1C ZINC000903974798 584832466 /nfs/dbraw/zinc/83/24/66/584832466.db2.gz SUWLNCIMODYCTP-LOWDOPEQSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+]CC[C@@H]1C[NH2+]C[C@H]1C ZINC000903974799 584832559 /nfs/dbraw/zinc/83/25/59/584832559.db2.gz SUWLNCIMODYCTP-LPWJVIDDSA-N 2 0 210.365 2.010 20 0 BEADRP CCCC[C@@H](COC)[NH2+]CC[C@@H]1C[NH2+]C[C@H]1C ZINC000903978873 584832935 /nfs/dbraw/zinc/83/29/35/584832935.db2.gz NXDPZUZAAHELEW-MCIONIFRSA-N 2 0 242.407 2.027 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+][C@H]1CCCC[C@H]1C1CC1 ZINC000903963590 584833562 /nfs/dbraw/zinc/83/35/62/584833562.db2.gz BQFXGNDWFPURBZ-VZZFWQQMSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+]Cc1coc2ccccc12 ZINC000903964363 584833982 /nfs/dbraw/zinc/83/39/82/584833982.db2.gz KFWIWAHZMHHUTF-NEPJUHHUSA-N 2 0 244.338 2.378 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+]Cc1cccc(Cl)c1 ZINC000903963966 584834042 /nfs/dbraw/zinc/83/40/42/584834042.db2.gz BLORSJUCCZCHNI-PWSUYJOCSA-N 2 0 238.762 2.285 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[NH2+]C[C@H]1C)C1CCCCC1 ZINC000903964808 584834325 /nfs/dbraw/zinc/83/43/25/584834325.db2.gz WGMMUELEWJTSMX-NTZNESFSSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)[C@@H]1CCC[C@H]1[NH2+][C@@H]1C[NH2+]C[C@H]1C ZINC000903965050 584834610 /nfs/dbraw/zinc/83/46/10/584834610.db2.gz YUZQWJHRJDZLIN-YVECIDJPSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+]C[C@@H]1CCCC[C@H]1C ZINC000903964885 584834656 /nfs/dbraw/zinc/83/46/56/584834656.db2.gz XSQXRMDQZGUIFT-FVCCEPFGSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+]Cc1cccc2c1CCC2 ZINC000903967681 584834945 /nfs/dbraw/zinc/83/49/45/584834945.db2.gz KOCOEEKINKDNQW-DOMZBBRYSA-N 2 0 244.382 2.120 20 0 BEADRP C[C@@H](CCc1ccccc1)[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000903967345 584834984 /nfs/dbraw/zinc/83/49/84/584834984.db2.gz HUJONFWOMWFCLJ-YCPHGPKFSA-N 2 0 246.398 2.453 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@H]1CC[C@@H](C)[C@H](C)C1 ZINC000903968359 584835227 /nfs/dbraw/zinc/83/52/27/584835227.db2.gz UEIOIWQXMAKOJI-POQQGIQPSA-N 2 0 224.392 2.256 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+]C1CCC(C)(C)CC1 ZINC000903968516 584835241 /nfs/dbraw/zinc/83/52/41/584835241.db2.gz XAJGYXRZCJFXKY-NEPJUHHUSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1C[C@@H](C[NH2+]C(C)(C)/C=C\Cl)CC[NH2+]1 ZINC000903988096 584836037 /nfs/dbraw/zinc/83/60/37/584836037.db2.gz NPKSAUBRCIXXEK-MXFLAHGMSA-N 2 0 230.783 2.495 20 0 BEADRP CCOc1ccc(C[N@H+](C)C[C@H]2C[C@@H]([NH3+])C2)cc1 ZINC000904301444 584861628 /nfs/dbraw/zinc/86/16/28/584861628.db2.gz IBQMGSGBICIZFK-OKILXGFUSA-N 2 0 248.370 2.254 20 0 BEADRP C[N@H+](C[C@H]([NH3+])CCC(C)(C)C)CC1CC1 ZINC000904312154 584862884 /nfs/dbraw/zinc/86/28/84/584862884.db2.gz NACCSPIVKPZPJG-GFCCVEGCSA-N 2 0 212.381 2.482 20 0 BEADRP CCS[C@H]1CCCC[N@H+](C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000904321367 584864198 /nfs/dbraw/zinc/86/41/98/584864198.db2.gz XUAKCJGQIJATFY-XQQFMLRXSA-N 2 0 242.432 2.331 20 0 BEADRP C[C@@H]1c2c(F)cccc2CC[N@H+]1C[C@H]1C[C@@H]([NH3+])C1 ZINC000904322312 584864889 /nfs/dbraw/zinc/86/48/89/584864889.db2.gz WDBAXQNRNYXICZ-WZRBSPASSA-N 2 0 248.345 2.482 20 0 BEADRP C[C@H]1c2c(F)cccc2CC[N@H+]1C[C@H]1C[C@@H]([NH3+])C1 ZINC000904322311 584864948 /nfs/dbraw/zinc/86/49/48/584864948.db2.gz WDBAXQNRNYXICZ-GMXVVIOVSA-N 2 0 248.345 2.482 20 0 BEADRP CC[C@@](C)(CCO)[NH2+]C[C@@H]([NH3+])CCC(C)(C)C ZINC000904329461 584865738 /nfs/dbraw/zinc/86/57/38/584865738.db2.gz NWHXJVAEHRXGJV-JSGCOSHPSA-N 2 0 244.423 2.281 20 0 BEADRP Cc1csc(C(C)(C)[NH2+]C[C@H]2C[C@@H]([NH3+])C2)n1 ZINC000904328568 584865933 /nfs/dbraw/zinc/86/59/33/584865933.db2.gz GYBKZJLODSCOBD-AOOOYVTPSA-N 2 0 239.388 2.014 20 0 BEADRP C[C@@H]1C[N@H+](C[C@H]2C[C@@H]([NH3+])C2)[C@@H]2CCCC[C@@H]21 ZINC000904330688 584866150 /nfs/dbraw/zinc/86/61/50/584866150.db2.gz AKVGUKXDOOBUCG-RKQHYHRCSA-N 2 0 222.376 2.234 20 0 BEADRP C[C@H]1COCCN(C[C@H]([NH3+])CCC(C)(C)C)C1 ZINC000904340130 584866352 /nfs/dbraw/zinc/86/63/52/584866352.db2.gz DLXRAWBSOIZFEV-CHWSQXEVSA-N 2 0 242.407 2.108 20 0 BEADRP C[C@H]1C[C@H](c2cccnc2)[N@H+](C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000904341783 584867045 /nfs/dbraw/zinc/86/70/45/584867045.db2.gz VXVXBZCPKMRNAY-DDHJSBNISA-N 2 0 245.370 2.202 20 0 BEADRP CC1(C)C[NH+](C[C@H]2C[C@@H]([NH3+])C2)CC(C)(C)C1 ZINC000904342008 584867467 /nfs/dbraw/zinc/86/74/67/584867467.db2.gz UGNQAIOSZLVWOU-TXEJJXNPSA-N 2 0 224.392 2.482 20 0 BEADRP Cc1ccc(F)c(C[N@H+](C)C[C@H]2C[C@@H]([NH3+])C2)c1 ZINC000904343285 584867705 /nfs/dbraw/zinc/86/77/05/584867705.db2.gz SDHMCQNOAHCAAP-BJHJDKERSA-N 2 0 236.334 2.303 20 0 BEADRP CCC[C@@]1(COC)CCC[N@@H+]1C[C@H]1C[C@@H]([NH3+])C1 ZINC000904345133 584867854 /nfs/dbraw/zinc/86/78/54/584867854.db2.gz DAQXAJLRHORXLO-MJBXVCDLSA-N 2 0 240.391 2.005 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[N@H+](CC(F)F)CC2CCC2)C1 ZINC000904345541 584868398 /nfs/dbraw/zinc/86/83/98/584868398.db2.gz JMCBQBTZBLOGBT-PHIMTYICSA-N 2 0 232.318 2.091 20 0 BEADRP C[C@@H]1COc2ccccc2C[N@@H+]1C[C@H]1C[C@@H]([NH3+])C1 ZINC000904345333 584868414 /nfs/dbraw/zinc/86/84/14/584868414.db2.gz CWHBYBDSPNVDHB-BZPMIXESSA-N 2 0 246.354 2.007 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[N@@H+]2CC[C@@](F)(c3ccccc3)C2)C1 ZINC000904350978 584869513 /nfs/dbraw/zinc/86/95/13/584869513.db2.gz SSSZQHNVFITXLZ-CFVMTHIKSA-N 2 0 248.345 2.294 20 0 BEADRP [NH3+]CC1CC([NH2+]CCc2cccc(Cl)c2)C1 ZINC000904360439 584871748 /nfs/dbraw/zinc/87/17/48/584871748.db2.gz KROBTZQZACIAAR-UHFFFAOYSA-N 2 0 238.762 2.209 20 0 BEADRP Cc1ccc(CC[NH2+]C[C@H]2C[C@@H]([NH3+])C2)c(C)c1 ZINC000904360671 584872066 /nfs/dbraw/zinc/87/20/66/584872066.db2.gz NSMVJUYGRKWWMH-OTVXOJSOSA-N 2 0 232.371 2.173 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@@H]2C[C@H]2C2CCCCC2)C1 ZINC000904368389 584872501 /nfs/dbraw/zinc/87/25/01/584872501.db2.gz QYBBCOIQWURXLG-AHLTXXRQSA-N 2 0 222.376 2.282 20 0 BEADRP CC(C)(C)CC[C@@H]([NH3+])C[NH2+][C@@H]1CCCOCC1 ZINC000904367525 584872527 /nfs/dbraw/zinc/87/25/27/584872527.db2.gz DQANOELGXLBOFU-CHWSQXEVSA-N 2 0 242.407 2.299 20 0 BEADRP COc1ccc(C)cc1[C@@H](C)[NH2+]C1CC(C[NH3+])C1 ZINC000904371732 584873038 /nfs/dbraw/zinc/87/30/38/584873038.db2.gz SDTGCGWLXYMMFM-PNESKVBLSA-N 2 0 248.370 2.392 20 0 BEADRP C[C@]1(C[NH2+]CCc2cccs2)CCC[NH2+]C1 ZINC000904363971 584874373 /nfs/dbraw/zinc/87/43/73/584874373.db2.gz HFWUSWIQLPSTCK-ZDUSSCGKSA-N 2 0 238.400 2.270 20 0 BEADRP CC(C)Oc1ccc(C[NH2+]C2CC(C[NH3+])C2)cc1 ZINC000904363336 584874473 /nfs/dbraw/zinc/87/44/73/584874473.db2.gz DURPXQULXCRGDH-UHFFFAOYSA-N 2 0 248.370 2.301 20 0 BEADRP C[C@@H](C[NH2+]C1CC(C[NH3+])C1)Cc1cccs1 ZINC000904364820 584874661 /nfs/dbraw/zinc/87/46/61/584874661.db2.gz RICWTMDBVCVQAD-VOMCLLRMSA-N 2 0 238.400 2.254 20 0 BEADRP Cc1ccc2c(c1)[C@@H]([NH2+]C1CC(C[NH3+])C1)CC2 ZINC000904376305 584876051 /nfs/dbraw/zinc/87/60/51/584876051.db2.gz OMPMLBYIZFXIHY-HGMXIMQMSA-N 2 0 230.355 2.309 20 0 BEADRP CC(C)(C)CC[C@@H]([NH3+])CNCC1([NH3+])CCCC1 ZINC000904377242 584876267 /nfs/dbraw/zinc/87/62/67/584876267.db2.gz LMVCAOYDDNPKRP-GFCCVEGCSA-N 2 0 241.423 2.001 20 0 BEADRP C[C@]1(C[NH+]2CCC(CCF)CC2)CCC[NH2+]C1 ZINC000904383934 584877125 /nfs/dbraw/zinc/87/71/25/584877125.db2.gz DINUGNJMJQRYNK-AWEZNQCLSA-N 2 0 242.382 2.448 20 0 BEADRP [NH3+]CC1CC([NH2+][C@H](CF)c2ccc(F)cc2)C1 ZINC000904383760 584877170 /nfs/dbraw/zinc/87/71/70/584877170.db2.gz DJRWMWNNAQPTQD-UTVJUBTNSA-N 2 0 240.297 2.163 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@@H]2c3ccccc3CC[C@@H]2F)C1 ZINC000904386175 584878124 /nfs/dbraw/zinc/87/81/24/584878124.db2.gz RHVIEBZAIHRMPF-MMMKDXCPSA-N 2 0 248.345 2.339 20 0 BEADRP C[C@H]1C[N@H+](Cc2ccsc2)CC[C@@H]1C[NH3+] ZINC000904410874 584879030 /nfs/dbraw/zinc/87/90/30/584879030.db2.gz HBLFFCDXSVGHKK-CMPLNLGQSA-N 2 0 224.373 2.165 20 0 BEADRP C[C@@H]1C[N@H+](CC2(C)CCC2)CC[C@@H]1C[NH3+] ZINC000904409387 584879327 /nfs/dbraw/zinc/87/93/27/584879327.db2.gz ASWKSAOBKIMVPI-VXGBXAGGSA-N 2 0 210.365 2.093 20 0 BEADRP Cc1cc(C[N@@H+]2C[C@@H]3CC[NH2+]C[C@@H]3C2)ccc1F ZINC000904420572 584881884 /nfs/dbraw/zinc/88/18/84/584881884.db2.gz AAZJAVYLQRQECC-UONOGXRCSA-N 2 0 248.345 2.175 20 0 BEADRP CCOc1cccc([C@H](C)[NH2+]CC[C@H](C)[NH3+])c1 ZINC000817952142 584992006 /nfs/dbraw/zinc/99/20/06/584992006.db2.gz HYBMXCIHJYFTTE-RYUDHWBXSA-N 2 0 236.359 2.473 20 0 BEADRP Cc1ccc2c(c1)CC[C@H]2[NH2+]C[C@@H](C)C[NH3+] ZINC000817962453 584992445 /nfs/dbraw/zinc/99/24/45/584992445.db2.gz MJLITHKGROVINV-SMDDNHRTSA-N 2 0 218.344 2.167 20 0 BEADRP COc1cc(C)c([C@H](C)NC[C@@H](C)[NH3+])cc1C ZINC000817972708 584993663 /nfs/dbraw/zinc/99/36/63/584993663.db2.gz NXWABSRWXNJRSX-NEPJUHHUSA-N 2 0 236.359 2.310 20 0 BEADRP C[N@@H+]1CCC[C@H](CC[NH2+]Cc2ccoc2)C1 ZINC000839182660 585096688 /nfs/dbraw/zinc/09/66/88/585096688.db2.gz OSFKUMMOEXJNSQ-GFCCVEGCSA-N 2 0 222.332 2.101 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC000839183329 585096818 /nfs/dbraw/zinc/09/68/18/585096818.db2.gz WMLNHWITVFCXMH-AGIUHOORSA-N 2 0 210.365 2.106 20 0 BEADRP CCCC[C@H](COC)[NH2+]CCN1CCC[C@@H]1C ZINC000766271340 585500252 /nfs/dbraw/zinc/50/02/52/585500252.db2.gz UEHSITNMLCLHAD-UONOGXRCSA-N 2 0 242.407 2.266 20 0 BEADRP Cn1ccnc1[C@H]1CCC[N@H+](C/C=C\Cl)C1 ZINC000770025083 585569876 /nfs/dbraw/zinc/56/98/76/585569876.db2.gz FGBUONIYSRQSAQ-MZBZXASESA-N 2 0 239.750 2.352 20 0 BEADRP c1cc(C[NH2+]CC2CC[NH+](C3CC3)CC2)co1 ZINC000775021913 585670588 /nfs/dbraw/zinc/67/05/88/585670588.db2.gz AUCNLZGDBCISRV-UHFFFAOYSA-N 2 0 234.343 2.244 20 0 BEADRP c1ccc(C2([NH2+]CCN3CCCC3)CC2)cc1 ZINC000775332055 585676007 /nfs/dbraw/zinc/67/60/07/585676007.db2.gz BCBUAXUAFNJBBT-UHFFFAOYSA-N 2 0 230.355 2.361 20 0 BEADRP CCC[C@H](C)C[NH+]1CCC([NH+](C)C)CC1 ZINC000775654266 585682235 /nfs/dbraw/zinc/68/22/35/585682235.db2.gz WBYAPDNBBVQDNP-LBPRGKRZSA-N 2 0 212.381 2.449 20 0 BEADRP CCC[N@H+](C)C[C@@H]1CC[NH+]([C@H](C)C2CC2)C1 ZINC000782185543 585810585 /nfs/dbraw/zinc/81/05/85/585810585.db2.gz HGSNFLPSTGCFKQ-OLZOCXBDSA-N 2 0 224.392 2.449 20 0 BEADRP C[C@H]1CCC[N@H+](CC2CC[NH+](C)CC2)C1 ZINC000788471087 585925253 /nfs/dbraw/zinc/92/52/53/585925253.db2.gz UCTIPNKCMWTLIM-LBPRGKRZSA-N 2 0 210.365 2.060 20 0 BEADRP CC[C@H]1C[N@H+](CC2CC[NH+](C)CC2)CCS1 ZINC000788480635 585925429 /nfs/dbraw/zinc/92/54/29/585925429.db2.gz BWBRTCIMLQIVED-ZDUSSCGKSA-N 2 0 242.432 2.156 20 0 BEADRP CSC[C@@H]1CCC[N@@H+]1CC1CC[NH+](C)CC1 ZINC000788489306 585925517 /nfs/dbraw/zinc/92/55/17/585925517.db2.gz XHFBIDAJFFGHFE-ZDUSSCGKSA-N 2 0 242.432 2.156 20 0 BEADRP C[NH+]1CCC([C@@H]2CC[N@H+](Cc3ccoc3)C2)CC1 ZINC000809756114 586517576 /nfs/dbraw/zinc/51/75/76/586517576.db2.gz PXESPSWXOGXBDW-OAHLLOKOSA-N 2 0 248.370 2.443 20 0 BEADRP C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cc2ccoc2)C1 ZINC000809767224 586518806 /nfs/dbraw/zinc/51/88/06/586518806.db2.gz HTRWFMUTCUUMKN-ZIAGYGMSSA-N 2 0 234.343 2.196 20 0 BEADRP CC[N@H+](CCCc1cnccc1C)[C@H](C)CO ZINC000814170033 586615604 /nfs/dbraw/zinc/61/56/04/586615604.db2.gz QPAPIJAGOBSJKR-CYBMUJFWSA-N 2 0 236.359 2.025 20 0 BEADRP CN1CCC[C@]2(CC[N@H+](C[Si](C)(C)C)C2)C1 ZINC000815146612 586670153 /nfs/dbraw/zinc/67/01/53/586670153.db2.gz SZLSANBDHOHGCY-ZDUSSCGKSA-N 2 0 240.467 2.282 20 0 BEADRP CCCCCC[NH+]1CCC2(CC[NH2+]2)CC1 ZINC000817879817 586832451 /nfs/dbraw/zinc/83/24/51/586832451.db2.gz GRQNTYYJWYUJLM-UHFFFAOYSA-N 2 0 210.365 2.395 20 0 BEADRP Cc1cccc(F)c1C[NH2+][C@H](C)C[C@H](C)[NH3+] ZINC000817896979 586834661 /nfs/dbraw/zinc/83/46/61/586834661.db2.gz AUQMRYXSMNMWPL-WDEREUQCSA-N 2 0 224.323 2.350 20 0 BEADRP Cc1cccc(F)c1C[NH2+][C@@H]1CCC[C@H]1C[NH3+] ZINC000817897159 586834802 /nfs/dbraw/zinc/83/48/02/586834802.db2.gz GJAAPYQWROCPFA-SMDDNHRTSA-N 2 0 236.334 2.351 20 0 BEADRP Cc1cccc(F)c1C[NH2+][C@H]1CCC[C@@H]1C[NH3+] ZINC000817897158 586835324 /nfs/dbraw/zinc/83/53/24/586835324.db2.gz GJAAPYQWROCPFA-RISCZKNCSA-N 2 0 236.334 2.351 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[C@H](SC)C1)[C@@H]1CCC[NH2+]1 ZINC000817897273 586835491 /nfs/dbraw/zinc/83/54/91/586835491.db2.gz JCRXIWYWFCWXND-VOAKCMCISA-N 2 0 242.432 2.391 20 0 BEADRP CSC(C)(C)C[NH2+][C@@H]1CC[NH2+]CC[C@H]1C ZINC000817899291 586835736 /nfs/dbraw/zinc/83/57/36/586835736.db2.gz KVYLSWBWOOJYLP-GHMZBOCLSA-N 2 0 230.421 2.106 20 0 BEADRP CS[C@@H]1CC[C@H]([NH2+][C@H]2CC[NH2+]CC[C@@H]2C)C1 ZINC000817900502 586836320 /nfs/dbraw/zinc/83/63/20/586836320.db2.gz PHDXFVDZAIFMOO-RVMXOQNASA-N 2 0 242.432 2.248 20 0 BEADRP CC[C@@H]([NH2+]CCC1CCC1)[C@@H]1CCC[NH2+]1 ZINC000817907863 586836951 /nfs/dbraw/zinc/83/69/51/586836951.db2.gz XVJXJOFKECRRCK-OLZOCXBDSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CCSC(C)(C)C ZINC000817908952 586837500 /nfs/dbraw/zinc/83/75/00/586837500.db2.gz UKDGHBXVADHSHN-ZJUUUORDSA-N 2 0 218.410 2.234 20 0 BEADRP C[C@H](CSC(C)(C)C)[NH2+]CC[C@H](C)[NH3+] ZINC000817951110 586840908 /nfs/dbraw/zinc/84/09/08/586840908.db2.gz BLXNURFNEIBWRZ-VHSXEESVSA-N 2 0 218.410 2.234 20 0 BEADRP CCOc1cccc([C@@H](C)[NH2+]CCC[NH3+])c1 ZINC000817938738 586843874 /nfs/dbraw/zinc/84/38/74/586843874.db2.gz RCYLWPZHGDVHSD-LLVKDONJSA-N 2 0 222.332 2.085 20 0 BEADRP C[C@H](CSC(C)(C)C)[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000817945539 586846309 /nfs/dbraw/zinc/84/63/09/586846309.db2.gz FWYQBJNSKOGRQD-NEPJUHHUSA-N 2 0 244.448 2.496 20 0 BEADRP Cc1ccc2c(c1)CC[C@@H]2[NH2+]CC(C)(C)[NH3+] ZINC000817960797 586846921 /nfs/dbraw/zinc/84/69/21/586846921.db2.gz QKDDEBWJPMBKAS-ZDUSSCGKSA-N 2 0 218.344 2.309 20 0 BEADRP [NH3+]CCc1ccc(C[NH2+][C@@H]2CC[C@@H]2C2CC2)cc1 ZINC000817947598 586847078 /nfs/dbraw/zinc/84/70/78/586847078.db2.gz BTWWEKHCBKNAAX-HZPDHXFCSA-N 2 0 244.382 2.466 20 0 BEADRP C[C@@H]([NH2+]CC[C@H](C)[NH3+])c1ccc(Cl)nc1 ZINC000817951377 586847587 /nfs/dbraw/zinc/84/75/87/586847587.db2.gz FAASWMMVTPOEON-DTWKUNHWSA-N 2 0 227.739 2.123 20 0 BEADRP Cc1ccc2c(c1)CC[C@@H]2[NH2+]CC[C@H](C)[NH3+] ZINC000817951100 586848034 /nfs/dbraw/zinc/84/80/34/586848034.db2.gz BGIKKEGOHVAYCG-FZMZJTMJSA-N 2 0 218.344 2.309 20 0 BEADRP C[C@H](CSC(C)(C)C)[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000817955530 586850027 /nfs/dbraw/zinc/85/00/27/586850027.db2.gz YAZAKHHLYVBZGP-NEPJUHHUSA-N 2 0 244.448 2.496 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H](C)CSC(C)(C)C ZINC000817961993 586853260 /nfs/dbraw/zinc/85/32/60/586853260.db2.gz GBDSOPBGXLQTGQ-NXEZZACHSA-N 2 0 218.410 2.091 20 0 BEADRP C[C@H](CSC(C)(C)C)[NH2+]C[C@@H]([NH3+])C1CC1 ZINC000817965643 586855431 /nfs/dbraw/zinc/85/54/31/586855431.db2.gz SRDMAZXFGHCDJB-MWLCHTKSSA-N 2 0 230.421 2.234 20 0 BEADRP C[C@H]([NH3+])C[NH2+][C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000817971334 586859264 /nfs/dbraw/zinc/85/92/64/586859264.db2.gz CLSWXNOFFSFQRR-CIUDSAMLSA-N 2 0 224.270 2.044 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000817976677 586860346 /nfs/dbraw/zinc/86/03/46/586860346.db2.gz QYKXNIFRSGVSPD-YNEHKIRRSA-N 2 0 222.376 2.153 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@@H](C)CSC(C)(C)C ZINC000817979547 586862050 /nfs/dbraw/zinc/86/20/50/586862050.db2.gz LOGQAQGTVVYRME-UWVGGRQHSA-N 2 0 218.410 2.234 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@H](C)CSC(C)(C)C ZINC000817979545 586862127 /nfs/dbraw/zinc/86/21/27/586862127.db2.gz LOGQAQGTVVYRME-NXEZZACHSA-N 2 0 218.410 2.234 20 0 BEADRP CO[C@@H]1CC[C@@H]([NH+]2CCC([NH2+]C(C)C)CC2)C1 ZINC000821390354 587115593 /nfs/dbraw/zinc/11/55/93/587115593.db2.gz AFXDWTYFTXKLFW-ZIAGYGMSSA-N 2 0 240.391 2.016 20 0 BEADRP CC[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CSC[C@H]2C)C1 ZINC000823736910 587238765 /nfs/dbraw/zinc/23/87/65/587238765.db2.gz OPBQWUZRPJEWLH-JHJVBQTASA-N 2 0 242.432 2.059 20 0 BEADRP Cc1ncc(C[N@@H+]2CCC3(CCCC3)C2)n1C ZINC000824783047 587287431 /nfs/dbraw/zinc/28/74/31/587287431.db2.gz PZTYXXJPJSQBSO-UHFFFAOYSA-N 2 0 233.359 2.495 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+]CCCC[N@H+](C)C1CC1 ZINC000834909624 587769539 /nfs/dbraw/zinc/76/95/39/587769539.db2.gz SPQUITOBSMPDLN-YPMHNXCESA-N 2 0 210.365 2.249 20 0 BEADRP C[N@H+](CCCC[NH2+]C1CC(C(F)F)C1)C1CC1 ZINC000835064771 587779997 /nfs/dbraw/zinc/77/99/97/587779997.db2.gz ZFCOCQHDBCALAC-UHFFFAOYSA-N 2 0 246.345 2.494 20 0 BEADRP c1ccc2c(c1)cncc2C[NH2+]C1CC[NH2+]CC1 ZINC000841026641 587935228 /nfs/dbraw/zinc/93/52/28/587935228.db2.gz MSJVFNAAJAMKJW-UHFFFAOYSA-N 2 0 241.338 2.076 20 0 BEADRP C[C@@H](CC[NH3+])[NH2+]Cc1cncc2ccccc21 ZINC000841052697 587940173 /nfs/dbraw/zinc/94/01/73/587940173.db2.gz WBVMZQQTFISJAO-NSHDSACASA-N 2 0 229.327 2.062 20 0 BEADRP CC[C@H]([NH3+])CNCc1ccc2c(c1)CC(C)(C)O2 ZINC000841073510 587943883 /nfs/dbraw/zinc/94/38/83/587943883.db2.gz YCOOHSQLSKRSOR-ZDUSSCGKSA-N 2 0 248.370 2.227 20 0 BEADRP CC(C)(C)[C@H](C[NH3+])NCc1cnc(Cl)s1 ZINC000842474956 588028976 /nfs/dbraw/zinc/02/89/76/588028976.db2.gz FUVUENPACBNSHG-QMMMGPOBSA-N 2 0 247.795 2.260 20 0 BEADRP CC[N@H+](CCCCCCC[NH3+])C[C@H]1CCOC1 ZINC000842471691 588029093 /nfs/dbraw/zinc/02/90/93/588029093.db2.gz TUCATCIODVYGAN-CQSZACIVSA-N 2 0 242.407 2.254 20 0 BEADRP CC[C@H]1C[C@H](C[NH2+]C2CCC([NH3+])CC2)CCO1 ZINC000843105559 588081859 /nfs/dbraw/zinc/08/18/59/588081859.db2.gz VXVAYWRUKZAPCB-RYSNWHEDSA-N 2 0 240.391 2.051 20 0 BEADRP [NH3+]CCCCCC[NH2+]Cc1cccc(F)c1 ZINC000843127706 588082322 /nfs/dbraw/zinc/08/23/22/588082322.db2.gz HAQPJBPMBPWYHQ-UHFFFAOYSA-N 2 0 224.323 2.434 20 0 BEADRP COC1CCC([NH2+]CCCCCC[NH3+])CC1 ZINC000843128145 588085060 /nfs/dbraw/zinc/08/50/60/588085060.db2.gz UOCFIJUPWQGPJB-UHFFFAOYSA-N 2 0 228.380 2.053 20 0 BEADRP CO[C@H]1CCC[C@@H]([NH2+]CCCCCC[NH3+])C1 ZINC000843341948 588100907 /nfs/dbraw/zinc/10/09/07/588100907.db2.gz LZDCOSXKZBOBEE-OLZOCXBDSA-N 2 0 228.380 2.053 20 0 BEADRP Cc1ccccc1OCC[NH2+][C@](C)(C[NH3+])C1CC1 ZINC000843356598 588103904 /nfs/dbraw/zinc/10/39/04/588103904.db2.gz YEMHUINPPQPQDD-OAHLLOKOSA-N 2 0 248.370 2.091 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CC[C@@]1(C)C[C@]1(F)Cl ZINC000844923584 588218832 /nfs/dbraw/zinc/21/88/32/588218832.db2.gz LMZAYSWTKXHATN-XWLWVQCSSA-N 2 0 236.762 2.407 20 0 BEADRP CC(C)C[N@H+](C)CCC[NH2+][C@H]1CC[C@H]1C ZINC000845997128 588252729 /nfs/dbraw/zinc/25/27/29/588252729.db2.gz VBDZVUWRSLLURG-OLZOCXBDSA-N 2 0 212.381 2.352 20 0 BEADRP CC(C)C[N@H+](C)CCC[NH2+][C@@H]1CC[C@H]1C ZINC000845997127 588252955 /nfs/dbraw/zinc/25/29/55/588252955.db2.gz VBDZVUWRSLLURG-CHWSQXEVSA-N 2 0 212.381 2.352 20 0 BEADRP [NH3+]CCCCCC[N@@H+]1CCc2ccc(O)cc2C1 ZINC000846217807 588260651 /nfs/dbraw/zinc/26/06/51/588260651.db2.gz CNOAJUURYKXICA-UHFFFAOYSA-N 2 0 248.370 2.269 20 0 BEADRP Cl/C=C\C[NH+]1CCC([C@H]2CC[NH2+]C2)CC1 ZINC000846220583 588261171 /nfs/dbraw/zinc/26/11/71/588261171.db2.gz LTUAUYCYNUXNHG-RSUUKKISSA-N 2 0 228.767 2.060 20 0 BEADRP Cl/C=C/C[N@@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1 ZINC000846221252 588261457 /nfs/dbraw/zinc/26/14/57/588261457.db2.gz VICACEDIOOXPKE-OMJJQCQUSA-N 2 0 228.767 2.060 20 0 BEADRP [NH3+]CCCCCC[N@@H+]1CC[C@]2(CC2(F)F)C1 ZINC000846229304 588261897 /nfs/dbraw/zinc/26/18/97/588261897.db2.gz SMEPWYKJDYKJIN-NSHDSACASA-N 2 0 232.318 2.237 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H]2CC[C@H]2C2CC2)C1 ZINC000848559516 588396900 /nfs/dbraw/zinc/39/69/00/588396900.db2.gz XURQFBOPEALVKX-GHYVTOPFSA-N 2 0 222.376 2.105 20 0 BEADRP Cc1cccc(F)c1C[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000848717398 588407998 /nfs/dbraw/zinc/40/79/98/588407998.db2.gz AOZNIMPUFCWLSQ-NWDGAFQWSA-N 2 0 236.334 2.494 20 0 BEADRP C[C@H]1CCCN1CC[NH2+]C1CC(CF)(CF)C1 ZINC000850440240 588546460 /nfs/dbraw/zinc/54/64/60/588546460.db2.gz YWEUKUULTBLZTD-NSHDSACASA-N 2 0 246.345 2.148 20 0 BEADRP C[C@@H](CN1CCC(C)CC1)[NH2+][C@H]1CC[C@H]1C ZINC000850544236 588559409 /nfs/dbraw/zinc/55/94/09/588559409.db2.gz UVGKAWASYYKWJB-RDBSUJKOSA-N 2 0 224.392 2.495 20 0 BEADRP C[N@@H+]1CCCC[C@H](C[NH2+]C2CC(C(F)F)C2)C1 ZINC000862483593 589217078 /nfs/dbraw/zinc/21/70/78/589217078.db2.gz VDGQZBXKPKTUCC-VOMCLLRMSA-N 2 0 246.345 2.352 20 0 BEADRP CCCCCC[C@H](C)[NH2+]CC1([NH3+])CCOCC1 ZINC000863481184 589292682 /nfs/dbraw/zinc/29/26/82/589292682.db2.gz BJPKETWZSNBTCV-ZDUSSCGKSA-N 2 0 242.407 2.443 20 0 BEADRP CC[C@@H]([NH2+]CCOCCC[NH3+])C1CCCCC1 ZINC000863544775 589297719 /nfs/dbraw/zinc/29/77/19/589297719.db2.gz AQQVPPRBXUULJQ-CQSZACIVSA-N 2 0 242.407 2.300 20 0 BEADRP CCN(CC[NH3+])Cc1cc2cccc(OC)c2o1 ZINC000863644276 589307193 /nfs/dbraw/zinc/30/71/93/589307193.db2.gz PXILEJXXQJAAHJ-UHFFFAOYSA-N 2 0 248.326 2.222 20 0 BEADRP C[C@@H]([NH3+])CN(C)Cc1cc2cc(F)ccc2o1 ZINC000863652055 589307584 /nfs/dbraw/zinc/30/75/84/589307584.db2.gz PIQSLNJOQJUJSQ-SECBINFHSA-N 2 0 236.290 2.351 20 0 BEADRP CCC(CC)NC(=[NH2+])NCC[N@@H+](C)[C@H](C)CC ZINC000864455885 589366996 /nfs/dbraw/zinc/36/69/96/589366996.db2.gz ACLUZUZNVLYGNC-LLVKDONJSA-N 2 0 242.411 2.019 20 0 BEADRP CS[C@H]1C[C@H]([NH2+][C@@H]2CC[N@H+](C)C(C)(C)C2)C1 ZINC000865733314 589459251 /nfs/dbraw/zinc/45/92/51/589459251.db2.gz HNKADOCNNQIIAA-IJLUTSLNSA-N 2 0 242.432 2.343 20 0 BEADRP COCCCC[N@@H+]1CC[C@@](C[NH3+])(C(C)(C)C)C1 ZINC000866707825 589514334 /nfs/dbraw/zinc/51/43/34/589514334.db2.gz XACJOSFPNBNCSL-AWEZNQCLSA-N 2 0 242.407 2.110 20 0 BEADRP CC(C)OCC[N@@H+]1CC[C@](C[NH3+])(C(C)(C)C)C1 ZINC000866705269 589514745 /nfs/dbraw/zinc/51/47/45/589514745.db2.gz WOFJYTOUPWHEJT-CQSZACIVSA-N 2 0 242.407 2.108 20 0 BEADRP CC(C)(C)[C@@]1(C[NH3+])CC[N@H+](Cc2cccnc2)C1 ZINC000866708065 589514711 /nfs/dbraw/zinc/51/47/11/589514711.db2.gz XMMFONZMVDAAOO-OAHLLOKOSA-N 2 0 247.386 2.279 20 0 BEADRP COCC1([N@H+](C)CCCCCCC[NH3+])CCC1 ZINC000872158162 589886344 /nfs/dbraw/zinc/88/63/44/589886344.db2.gz YNSCCCHLCDOHKW-UHFFFAOYSA-N 2 0 242.407 2.397 20 0 BEADRP C[C@H]([NH2+]CCC[NH3+])c1ccc(C(F)(F)F)nc1 ZINC000872155478 589886412 /nfs/dbraw/zinc/88/64/12/589886412.db2.gz UGSJMKZSGQMXRI-QMMMGPOBSA-N 2 0 247.264 2.100 20 0 BEADRP c1cc(N[C@H]2CC[N@@H+](C3CC3)C2)c(C2CC2)c[nH+]1 ZINC000872422319 589938456 /nfs/dbraw/zinc/93/84/56/589938456.db2.gz KNMJMIIATQXQJS-LBPRGKRZSA-N 2 0 243.354 2.030 20 0 BEADRP C[N@@H+]1CCC[C@@H](CNc2cc[nH+]cc2C2CC2)C1 ZINC000872447759 589940075 /nfs/dbraw/zinc/94/00/75/589940075.db2.gz ARYBYRFDPWITLH-LBPRGKRZSA-N 2 0 245.370 2.135 20 0 BEADRP F[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000873216058 589996771 /nfs/dbraw/zinc/99/67/71/589996771.db2.gz IEBDDWJCAFCDMD-MRTXSQPYSA-N 2 0 240.366 2.245 20 0 BEADRP C[C@@H](C[C@@H]1CCC[NH2+]1)[NH2+][C@@H]1CCCC[C@@H]1F ZINC000873217698 589998093 /nfs/dbraw/zinc/99/80/93/589998093.db2.gz PMTCXMBWQYIXPR-ZDEQEGDKSA-N 2 0 228.355 2.387 20 0 BEADRP C[C@H]1C[C@H](C[NH2+][C@@H]2CCCC[C@@H]2F)CC[NH2+]1 ZINC000873215912 589998351 /nfs/dbraw/zinc/99/83/51/589998351.db2.gz HEXDUBOTSZZSLV-QNWHQSFQSA-N 2 0 228.355 2.245 20 0 BEADRP C[C@@H](CCC(F)(F)F)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873251759 589998573 /nfs/dbraw/zinc/99/85/73/589998573.db2.gz NZDRVOPBALJRDB-XHNCKOQMSA-N 2 0 224.270 2.044 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC[C@H](C)C1)C1CC[NH2+]CC1 ZINC000873220209 589998773 /nfs/dbraw/zinc/99/87/73/589998773.db2.gz GXRKCHJPEYRNFU-DMDPSCGWSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)([NH3+])C[N@@H+]1CC[C@]2(CCc3ccccc32)C1 ZINC000873226875 590001275 /nfs/dbraw/zinc/00/12/75/590001275.db2.gz CUGGEASLSNVCDP-MRXNPFEDSA-N 2 0 244.382 2.314 20 0 BEADRP CCC(CC)C[NH2+][C@@]12CCC[C@@H]1[NH2+]CC2 ZINC000873229812 590001861 /nfs/dbraw/zinc/00/18/61/590001861.db2.gz GJORUKXVMMZFSP-QWHCGFSZSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CCCS1)[C@H]1CCC[NH2+]1 ZINC000873242988 590006756 /nfs/dbraw/zinc/00/67/56/590006756.db2.gz HNSOZSVWJBYUHH-IJLUTSLNSA-N 2 0 228.405 2.002 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CC(C)(C)C(C)(F)F ZINC000873251031 590008321 /nfs/dbraw/zinc/00/83/21/590008321.db2.gz IAYTZBGAEIGCFJ-DTWKUNHWSA-N 2 0 222.323 2.383 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)C1C(C)(C)C1(C)C ZINC000873252431 590008834 /nfs/dbraw/zinc/00/88/34/590008834.db2.gz RQVOTLGSLGEAKX-GARJFASQSA-N 2 0 224.392 2.384 20 0 BEADRP C[C@H](CCc1ccsc1)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873253067 590009020 /nfs/dbraw/zinc/00/90/20/590009020.db2.gz YSSXUTZYQRUWLT-RTXFEEFZSA-N 2 0 238.400 2.396 20 0 BEADRP C[C@@H](CCc1ccsc1)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873253068 590009059 /nfs/dbraw/zinc/00/90/59/590009059.db2.gz YSSXUTZYQRUWLT-WCFLWFBJSA-N 2 0 238.400 2.396 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]C[C@H]2C[C@@H]([NH3+])C2)[C@@H]1C ZINC000873252385 590009088 /nfs/dbraw/zinc/00/90/88/590009088.db2.gz QUEDTSSNUPEGCL-NJMOYASZSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]C[C@H]2C[C@@H]([NH3+])C2)[C@H]1C ZINC000873252386 590009159 /nfs/dbraw/zinc/00/91/59/590009159.db2.gz QUEDTSSNUPEGCL-RXGFPQBGSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]C[C@H]2C[C@@H]([NH3+])C2)[C@H]1C ZINC000873252383 590009203 /nfs/dbraw/zinc/00/92/03/590009203.db2.gz QUEDTSSNUPEGCL-FHUSYTEZSA-N 2 0 210.365 2.138 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@@H]2CCC[C@@H](C3CC3)C2)C1 ZINC000873254193 590009364 /nfs/dbraw/zinc/00/93/64/590009364.db2.gz MZTNMQSFCSGLDH-RUZUBIRVSA-N 2 0 222.376 2.282 20 0 BEADRP Cc1ccc2c(c1)[C@@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)CC2 ZINC000873254215 590009498 /nfs/dbraw/zinc/00/94/98/590009498.db2.gz NNYHGUZDJDSHSZ-LNSITVRQSA-N 2 0 230.355 2.309 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@H](Cc2ccccc2)C2CC2)C1 ZINC000873254069 590009518 /nfs/dbraw/zinc/00/95/18/590009518.db2.gz KDYIJZQTAAUSPA-VNQPRFMTSA-N 2 0 244.382 2.335 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1cccc(F)c1 ZINC000873255289 590010088 /nfs/dbraw/zinc/01/00/88/590010088.db2.gz FFWQOAVDNSBSMO-BREBYQMCSA-N 2 0 222.307 2.214 20 0 BEADRP C[C@@H]1CCC[C@@H](C)C1[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873254498 590010091 /nfs/dbraw/zinc/01/00/91/590010091.db2.gz VJFLHOHBCCGIHJ-KKOKHZNYSA-N 2 0 210.365 2.138 20 0 BEADRP Cc1cccc2c1CC[C@@H]2[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873254596 590010335 /nfs/dbraw/zinc/01/03/35/590010335.db2.gz XUXNCCYORLUJMG-ZOWXZIJZSA-N 2 0 230.355 2.309 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@@H]2CCc3cc(F)ccc32)C1 ZINC000873254449 590010345 /nfs/dbraw/zinc/01/03/45/590010345.db2.gz UFPRCEQPDFSFDD-LJWDBELGSA-N 2 0 234.318 2.140 20 0 BEADRP CCc1cccnc1[C@@H](C)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873254945 590010366 /nfs/dbraw/zinc/01/03/66/590010366.db2.gz CAARQDCMYLBCEW-NQBHXWOUSA-N 2 0 233.359 2.032 20 0 BEADRP COc1ccc(C)cc1[C@@H](C)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873255294 590010460 /nfs/dbraw/zinc/01/04/60/590010460.db2.gz FJVQFZLQWAUZBO-UPJWGTAASA-N 2 0 248.370 2.392 20 0 BEADRP C[C@H]1CCC[C@H](C)C1[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873254497 590010498 /nfs/dbraw/zinc/01/04/98/590010498.db2.gz VJFLHOHBCCGIHJ-FIQHERPVSA-N 2 0 210.365 2.138 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+][C@@H]2CCCC23CCCC3)C1 ZINC000873255620 590010652 /nfs/dbraw/zinc/01/06/52/590010652.db2.gz IIZWSJLWRPEYRE-JHJVBQTASA-N 2 0 222.376 2.426 20 0 BEADRP CCOc1ccc([C@H](C)[NH2+]C[C@H]2C[C@@H]([NH3+])C2)cc1 ZINC000873256253 590010774 /nfs/dbraw/zinc/01/07/74/590010774.db2.gz NDNZLGADJABGOW-SGMGOOAPSA-N 2 0 248.370 2.473 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1ccc2c(c1)COC2 ZINC000873255438 590010798 /nfs/dbraw/zinc/01/07/98/590010798.db2.gz GTXBIRLQFOKZSQ-PGUXBMHVSA-N 2 0 246.354 2.105 20 0 BEADRP CC(C)(C)[C@@H]1CC[C@H]1[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873255851 590010898 /nfs/dbraw/zinc/01/08/98/590010898.db2.gz IYVYPYRDRDQZOZ-DDHJBXDOSA-N 2 0 210.365 2.138 20 0 BEADRP CC1(C)CCCC[C@@H]1[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873256140 590011016 /nfs/dbraw/zinc/01/10/16/590011016.db2.gz LYOLKQQXXASAJO-SRVKXCTJSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+][C@H]2CCCc3ccccc3C2)C1 ZINC000873256495 590011393 /nfs/dbraw/zinc/01/13/93/590011393.db2.gz OJQIBVTWFHPPGC-RCBQFDQVSA-N 2 0 244.382 2.261 20 0 BEADRP CC[C@@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)C1CCCC1 ZINC000873256515 590011404 /nfs/dbraw/zinc/01/14/04/590011404.db2.gz OSKOBLVGVBUVOI-RAIGVLPGSA-N 2 0 210.365 2.282 20 0 BEADRP CC[C@@H](Cc1ccccc1)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873256538 590011510 /nfs/dbraw/zinc/01/15/10/590011510.db2.gz OZMJYCGOCOFCKB-ZNMIVQPWSA-N 2 0 232.371 2.335 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)C1CCCCC1 ZINC000873257029 590011812 /nfs/dbraw/zinc/01/18/12/590011812.db2.gz DBSWHSLNKVZMEC-GVXVVHGQSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1cccc(F)c1 ZINC000873257183 590011854 /nfs/dbraw/zinc/01/18/54/590011854.db2.gz FFWQOAVDNSBSMO-KWBADKCTSA-N 2 0 222.307 2.214 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccc(F)cc1F ZINC000873256935 590011881 /nfs/dbraw/zinc/01/18/81/590011881.db2.gz RGQYXANCHZUFMZ-KKZNHRDASA-N 2 0 240.297 2.353 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C[C@H]2C[C@H]([NH3+])C2)C[C@H]1C ZINC000873256476 590011952 /nfs/dbraw/zinc/01/19/52/590011952.db2.gz MXFCUJQKBXLGHR-SYLRKERUSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccc(F)c(F)c1 ZINC000873257701 590012047 /nfs/dbraw/zinc/01/20/47/590012047.db2.gz WRIKPUUEEVVQLJ-KKZNHRDASA-N 2 0 240.297 2.353 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+]C2CCCCCCC2)C1 ZINC000873258040 590012569 /nfs/dbraw/zinc/01/25/69/590012569.db2.gz ZZNMAXHSICWZOU-TXEJJXNPSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]C[C@H]2C[C@H]([NH3+])C2)[C@H]1C ZINC000873258433 590012796 /nfs/dbraw/zinc/01/27/96/590012796.db2.gz QUEDTSSNUPEGCL-MLGHIDQZSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1ccc(F)c(F)c1 ZINC000873258954 590013041 /nfs/dbraw/zinc/01/30/41/590013041.db2.gz WRIKPUUEEVVQLJ-QXEWZRGKSA-N 2 0 240.297 2.353 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1ccc(F)cc1F ZINC000873258526 590013126 /nfs/dbraw/zinc/01/31/26/590013126.db2.gz RGQYXANCHZUFMZ-FXPVBKGRSA-N 2 0 240.297 2.353 20 0 BEADRP CC[C@@H]1CCCC[C@@H]1[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873259120 590013315 /nfs/dbraw/zinc/01/33/15/590013315.db2.gz ZPZVJLJEDOIAMP-LPWJVIDDSA-N 2 0 210.365 2.282 20 0 BEADRP C([NH2+][C@@H]1CC[C@H]1C1CC1)[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000873261807 590014353 /nfs/dbraw/zinc/01/43/53/590014353.db2.gz SBHAOQDVLQLMDJ-WCDYYPSBSA-N 2 0 234.387 2.295 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1cccnc1 ZINC000873262575 590014503 /nfs/dbraw/zinc/01/45/03/590014503.db2.gz AGVIHZZLVDOFFD-RJZRQDKASA-N 2 0 245.370 2.263 20 0 BEADRP CC(C)[C@H]1CC[C@@H]1[NH2+][C@H](C)C1CC[NH2+]CC1 ZINC000873268943 590015364 /nfs/dbraw/zinc/01/53/64/590015364.db2.gz IZBGYNPVXJIYDI-BNOWGMLFSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]C1([C@@H]2CCCCO2)CCC1 ZINC000873277520 590017744 /nfs/dbraw/zinc/01/77/44/590017744.db2.gz TUTAKSXOFHCNMZ-AVGNSLFASA-N 2 0 240.391 2.194 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]Cc1cccc2ncccc12 ZINC000873282337 590018239 /nfs/dbraw/zinc/01/82/39/590018239.db2.gz CGSJKANKBVUZTQ-NEPJUHHUSA-N 2 0 243.354 2.450 20 0 BEADRP C[C@@H]([NH2+]CCC[C@H]1C=CCC1)[C@H]1CCC[NH2+]1 ZINC000873282561 590019914 /nfs/dbraw/zinc/01/99/14/590019914.db2.gz VCSAGZCZLIQOIG-HZSPNIEDSA-N 2 0 222.376 2.463 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]C1CC(Nc2ccccc2)C1 ZINC000873295321 590024184 /nfs/dbraw/zinc/02/41/84/590024184.db2.gz FRYUMYSBLRYALE-CVSAEHQPSA-N 2 0 245.370 2.099 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@H](C)[C@@H]2CCCO2)CC1 ZINC000020205741 590086217 /nfs/dbraw/zinc/08/62/17/590086217.db2.gz DUTVBASHOSXSQJ-OCCSQVGLSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@H](CC1CCCC1)[NH2+][C@@H]1CCN(C)C1 ZINC000125586445 590171769 /nfs/dbraw/zinc/17/17/69/590171769.db2.gz AIWHJZRENOYRIG-DGCLKSJQSA-N 2 0 210.365 2.249 20 0 BEADRP CC[C@@H](C)[C@@H](C[NH+]1CCC([NH+](C)C)CC1)OC ZINC000876596489 590219911 /nfs/dbraw/zinc/21/99/11/590219911.db2.gz RGBUPVIQBLDEAD-TZMCWYRMSA-N 2 0 242.407 2.074 20 0 BEADRP CC(C)CC[N@@H+]1CC[C@H]2[C@H](CC[NH+]2C)C1 ZINC000877740162 590406388 /nfs/dbraw/zinc/40/63/88/590406388.db2.gz IUCZJLMTGKADSU-OLZOCXBDSA-N 2 0 210.365 2.059 20 0 BEADRP CC[C@H](C)C[N@@H+]1CC[C@H]2[C@@H](CC[NH+]2C)C1 ZINC000877742956 590408310 /nfs/dbraw/zinc/40/83/10/590408310.db2.gz SHYKWBFDSJOVBK-AVGNSLFASA-N 2 0 210.365 2.059 20 0 BEADRP CC[C@H](C)C[N@@H+]1CC[C@@H]2[C@@H](CC[NH+]2C)C1 ZINC000877742958 590408492 /nfs/dbraw/zinc/40/84/92/590408492.db2.gz SHYKWBFDSJOVBK-RWMBFGLXSA-N 2 0 210.365 2.059 20 0 BEADRP C[N@H+](CCCC1CC1)C[C@@H]1CCC[NH+](C)C1 ZINC000878125580 590501308 /nfs/dbraw/zinc/50/13/08/590501308.db2.gz QIYJEAJBASUKKV-AWEZNQCLSA-N 2 0 224.392 2.450 20 0 BEADRP C=C/C=C/CC[N@@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000878125831 590502121 /nfs/dbraw/zinc/50/21/21/590502121.db2.gz SFJWRLCOASDRLS-VBROQKIQSA-N 2 0 222.376 2.392 20 0 BEADRP C[N@@H+]1CCC[C@@H]1CC[NH+]1CCC[C@H](CF)C1 ZINC000880237078 590968676 /nfs/dbraw/zinc/96/86/76/590968676.db2.gz PQJFWUHTRMIKBL-CHWSQXEVSA-N 2 0 228.355 2.152 20 0 BEADRP C[C@@H]1C[N@H+](CC2CCC2)CCN1c1cc[nH+]cc1 ZINC000880259088 590979388 /nfs/dbraw/zinc/97/93/88/590979388.db2.gz MKHNKCYSTJKYHC-CYBMUJFWSA-N 2 0 245.370 2.392 20 0 BEADRP c1ccc2c(c1)OCC[C@@H]2[NH2+][C@H]1CCC[NH2+]CC1 ZINC000129046610 591225055 /nfs/dbraw/zinc/22/50/55/591225055.db2.gz YWETUUGZXQICEB-JSGCOSHPSA-N 2 0 246.354 2.242 20 0 BEADRP COCc1ccccc1C[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000129125909 591258872 /nfs/dbraw/zinc/25/88/72/591258872.db2.gz HWHDITNRUWIOBL-OAHLLOKOSA-N 2 0 248.370 2.065 20 0 BEADRP CC[N@H+](CCNc1ncnc(C)c1C)C(C)C ZINC000881905696 591277465 /nfs/dbraw/zinc/27/74/65/591277465.db2.gz VMRDAQIFHIGGQE-UHFFFAOYSA-N 2 0 236.363 2.236 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]C[C@H]2C=CCC2)[C@@H](C)C1 ZINC000883247010 591587962 /nfs/dbraw/zinc/58/79/62/591587962.db2.gz XHBYMRZJMNKGCK-IHRRRGAJSA-N 2 0 222.376 2.273 20 0 BEADRP C=C/C=C/CC[NH2+][C@@H]1CC[N@@H+](CC)C[C@@H]1C ZINC000883267771 591600550 /nfs/dbraw/zinc/60/05/50/591600550.db2.gz POWNVQCDJDBCPQ-HYLRALAJSA-N 2 0 222.376 2.439 20 0 BEADRP CCN1CC[C@H]1C[NH2+][C@@H](C)CCC(F)(F)F ZINC000883354820 591625516 /nfs/dbraw/zinc/62/55/16/591625516.db2.gz CSBOWVTUDUKVRI-UWVGGRQHSA-N 2 0 238.297 2.401 20 0 BEADRP CCc1ccc(NCc2cnc3n2CCC3)nc1 ZINC000883383868 591639584 /nfs/dbraw/zinc/63/95/84/591639584.db2.gz ICSMDDQLNNSFBJ-UHFFFAOYSA-N 2 0 242.326 2.399 20 0 BEADRP C[C@@H]1C[N@H+](CC[C@H]2CCCC2(F)F)CC[C@H]1[NH3+] ZINC000883417808 591654238 /nfs/dbraw/zinc/65/42/38/591654238.db2.gz NSFKDSANWZQVLX-IJLUTSLNSA-N 2 0 246.345 2.481 20 0 BEADRP C[C@@]1(C[NH3+])CC[N@H+](CC[C@@H]2CCCC2(F)F)C1 ZINC000883428200 591660565 /nfs/dbraw/zinc/66/05/65/591660565.db2.gz NXIVYRLGDRRYBW-RYUDHWBXSA-N 2 0 246.345 2.483 20 0 BEADRP C=C/C=C\CC[NH+]1CCC2(CC[NH2+]C2)CC1 ZINC000883428383 591660961 /nfs/dbraw/zinc/66/09/61/591660961.db2.gz SDSAFLIHTCJASM-ARJAWSKDSA-N 2 0 220.360 2.194 20 0 BEADRP CC1(C)Nc2ccccc2[C@H]1[NH2+]C[C@H]1CC[NH2+]C1 ZINC000883462429 591674091 /nfs/dbraw/zinc/67/40/91/591674091.db2.gz QUBSCWDFJXUSDC-SMDDNHRTSA-N 2 0 245.370 2.131 20 0 BEADRP CC1(C)Nc2ccccc2[C@H]1[NH2+]C[C@@H]1CC[NH2+]C1 ZINC000883462426 591674475 /nfs/dbraw/zinc/67/44/75/591674475.db2.gz QUBSCWDFJXUSDC-BXUZGUMPSA-N 2 0 245.370 2.131 20 0 BEADRP Fc1ccc(C[NH2+]C[C@H]2CCC[NH2+]C2)cc1F ZINC000132229626 591694535 /nfs/dbraw/zinc/69/45/35/591694535.db2.gz UHXVZPRMEWFSSE-NSHDSACASA-N 2 0 240.297 2.054 20 0 BEADRP C[NH2+][C@H]1CCN([C@@H](C)c2cccc(C)c2)C1 ZINC000133196072 591776260 /nfs/dbraw/zinc/77/62/60/591776260.db2.gz HPSFYDGFZGLEGP-JSGCOSHPSA-N 2 0 218.344 2.350 20 0 BEADRP CCC1([NH+]2CCC2)CC[NH+](C(C)C)CC1 ZINC000886709681 592308642 /nfs/dbraw/zinc/30/86/42/592308642.db2.gz WJUHESYRMNZDBM-UHFFFAOYSA-N 2 0 210.365 2.345 20 0 BEADRP C[C@H]1CN(C)C[C@@H]1[NH2+][C@H]1CCc2c1cccc2F ZINC000886792420 592324436 /nfs/dbraw/zinc/32/44/36/592324436.db2.gz YVFBDDHZJQUKCO-LKTVYLICSA-N 2 0 248.345 2.353 20 0 BEADRP C(CN1CCC[C@@H]2[NH2+]CC[C@H]21)[C@@H]1C[C@H]1C1CC1 ZINC000886841244 592360302 /nfs/dbraw/zinc/36/03/02/592360302.db2.gz GBRUATQVOPNFJZ-CBBWQLFWSA-N 2 0 234.387 2.249 20 0 BEADRP CC(C)C[N@@H+]1CCCC[C@@]2(CC[NH2+]C2)C1 ZINC000886865793 592374151 /nfs/dbraw/zinc/37/41/51/592374151.db2.gz UWKJFILVHOKFLL-ZDUSSCGKSA-N 2 0 210.365 2.108 20 0 BEADRP COC(C)(C)CC[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000300067103 592502544 /nfs/dbraw/zinc/50/25/44/592502544.db2.gz QTJUNDPTUFDZHM-OLZOCXBDSA-N 2 0 240.391 2.018 20 0 BEADRP CS[C@@H]1CC[C@H]([NH2+][C@H]2CCC[C@@H]([NH3+])C2)C1 ZINC000300392903 592510367 /nfs/dbraw/zinc/51/03/67/592510367.db2.gz WBUCLRYCJBAAIB-NOOOWODRSA-N 2 0 228.405 2.130 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]CC[C@@H]1CCCCO1 ZINC000223779604 592543496 /nfs/dbraw/zinc/54/34/96/592543496.db2.gz NSYQRFYQGDCNLK-MELADBBJSA-N 2 0 240.391 2.053 20 0 BEADRP CC1(C)[C@@H]([NH2+][C@H]2C=CCC2)[C@@H]2CCC[NH2+][C@@H]21 ZINC000925708114 634399458 /nfs/dbraw/zinc/39/94/58/634399458.db2.gz CWFNQHBJMZAQQM-RNJOBUHISA-N 2 0 220.360 2.071 20 0 BEADRP C[C@]1(CC[NH2+][C@@H]2CC[NH2+]C2(C)C)CC1(F)F ZINC000925707417 634395497 /nfs/dbraw/zinc/39/54/97/634395497.db2.gz IZCAMZMGEAOPFL-KOLCDFICSA-N 2 0 232.318 2.152 20 0 BEADRP C[N@H+]1CC=C(C[NH2+][C@@H]2C[C@H]3C=C[C@@H]2CC3)CC1 ZINC000925711797 634413280 /nfs/dbraw/zinc/41/32/80/634413280.db2.gz RQRPHOCXYOZPLT-NWANDNLSSA-N 2 0 232.371 2.193 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@@H](CCC[NH3+])c2ccccc2)CO1 ZINC000925712949 634417501 /nfs/dbraw/zinc/41/75/01/634417501.db2.gz QNBLBWDKLUSHSP-YUELXQCFSA-N 2 0 248.370 2.234 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+]CCCc1ccco1 ZINC000925716387 634448170 /nfs/dbraw/zinc/44/81/70/634448170.db2.gz POZJSLZERQPQCC-DOOHLRMFSA-N 2 0 248.370 2.318 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@H]([NH3+])CC(C)(C)C2)[C@@H](C)O1 ZINC000925726484 634522531 /nfs/dbraw/zinc/52/25/31/634522531.db2.gz SZJVYZKTPOZZNF-LBELIVKGSA-N 2 0 240.391 2.048 20 0 BEADRP [NH3+]CC[C@@H]1CC[N@H+](CCCc2ccccc2)C1 ZINC000125516613 634527245 /nfs/dbraw/zinc/52/72/45/634527245.db2.gz YPGOMTDNDSCHTG-OAHLLOKOSA-N 2 0 232.371 2.290 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+]CCCCC1CC1 ZINC000925734447 634584293 /nfs/dbraw/zinc/58/42/93/634584293.db2.gz PSZUTNAFDKKNEE-GFCCVEGCSA-N 2 0 210.365 2.297 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]C[C@@H]1C=CCC1 ZINC000925733214 634580401 /nfs/dbraw/zinc/58/04/01/634580401.db2.gz UIBHSFPEFOJOFR-UPJWGTAASA-N 2 0 208.349 2.202 20 0 BEADRP CC(C)(C[NH2+][C@H]1CCC[NH2+]CC1)CC(F)F ZINC000925734227 634585646 /nfs/dbraw/zinc/58/56/46/634585646.db2.gz PBGXGGLVUFQWNW-JTQLQIEISA-N 2 0 234.334 2.400 20 0 BEADRP CCC[C@H](C)CC[NH2+][C@@H]1CCOC[C@H]1[C@H](C)[NH3+] ZINC000925735002 634586978 /nfs/dbraw/zinc/58/69/78/634586978.db2.gz XAUXIRMOSBBRDF-XDQVBPFNSA-N 2 0 242.407 2.155 20 0 BEADRP CCC[C@@H]1CCC[C@H]1[NH2+][C@@H]1C[NH2+]C[C@H]1C ZINC000925783889 635296614 /nfs/dbraw/zinc/29/66/14/635296614.db2.gz LPLJWZMIXUOPPZ-FDYHWXHSSA-N 2 0 210.365 2.153 20 0 BEADRP FC(F)(F)[C@@H]1C[C@H]1C[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000925831627 635469873 /nfs/dbraw/zinc/46/98/73/635469873.db2.gz KIMCLULEQHKFEV-IVZWLZJFSA-N 2 0 248.292 2.059 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCS[C@H](C)C1)[C@@H]1CCC[NH2+]1 ZINC000925860900 635556195 /nfs/dbraw/zinc/55/61/95/635556195.db2.gz LWFLKOXAVNMZJQ-NDBYEHHHSA-N 2 0 242.432 2.391 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCS[C@H](C)C1)[C@@H]1CCC[NH2+]C1 ZINC000925862251 635558493 /nfs/dbraw/zinc/55/84/93/635558493.db2.gz ZDLQRAXBIWOTMY-FDYHWXHSSA-N 2 0 242.432 2.248 20 0 BEADRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+][C@@H]1CCCc2cccnc21 ZINC000925871909 635586692 /nfs/dbraw/zinc/58/66/92/635586692.db2.gz LMXSPVZPTHISJL-HZSPNIEDSA-N 2 0 245.370 2.176 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[NH2+][C@@H]2CCc3ccccc3C2)C1 ZINC000925876614 635600146 /nfs/dbraw/zinc/60/01/46/635600146.db2.gz CPDFPJQSDSNUAB-APHBMKBZSA-N 2 0 244.382 2.261 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+]C[C@]23C[C@H]2CCC3)C12CCC2 ZINC000925880664 635608344 /nfs/dbraw/zinc/60/83/44/635608344.db2.gz NAELCLCBCUFIFF-XQHKEYJVSA-N 2 0 220.360 2.036 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]C[C@]23C[C@H]2CCC3)C12CCC2 ZINC000925880661 635608995 /nfs/dbraw/zinc/60/89/95/635608995.db2.gz NAELCLCBCUFIFF-LPWJVIDDSA-N 2 0 220.360 2.036 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]C[C@]12C[C@H]1CCC2 ZINC000925881824 635610364 /nfs/dbraw/zinc/61/03/64/635610364.db2.gz VFOILPVEAJCCCD-SYQHCUMBSA-N 2 0 222.376 2.154 20 0 BEADRP C[C@H]1C[C@H]([NH2+]Cc2cccc(C[NH+](C)C)c2)CO1 ZINC000647169851 631291663 /nfs/dbraw/zinc/29/16/63/631291663.db2.gz DHYMAJCLNAJWAM-WFASDCNBSA-N 2 0 248.370 2.015 20 0 BEADRP C[N@@H+]1C[C@@H]2C[NH+](CCCC(C)(F)F)C[C@]2(C)C1 ZINC000933734764 631494570 /nfs/dbraw/zinc/49/45/70/631494570.db2.gz RKODKHIUQYPUAH-NEPJUHHUSA-N 2 0 246.345 2.305 20 0 BEADRP Cc1ccccc1C[NH+]1C[C@H]2C[N@@H+](C)C[C@@]2(C)C1 ZINC000933744314 631502742 /nfs/dbraw/zinc/50/27/42/631502742.db2.gz FBVTZYJDCSNARK-CVEARBPZSA-N 2 0 244.382 2.379 20 0 BEADRP Cc1ccc(C[NH2+]CCC(C)(C)[NH3+])cc1 ZINC000258675535 631579765 /nfs/dbraw/zinc/57/97/65/631579765.db2.gz HWNNUNRCQUZHHY-UHFFFAOYSA-N 2 0 206.333 2.212 20 0 BEADRP C[N@H+]1C[C@H]2CC[C@@H](C1)C2[NH2+][C@@H]1CCC(F)(F)C1 ZINC000925928609 635641761 /nfs/dbraw/zinc/64/17/61/635641761.db2.gz FHBYDEWJMGHRHL-FBTJUVTCSA-N 2 0 244.329 2.104 20 0 BEADRP C[C@@H]1CC[C@H]1[NH2+]CCC[NH+]1CCCCC1 ZINC000308838038 631677177 /nfs/dbraw/zinc/67/71/77/631677177.db2.gz XAHFEMKBBRJPHU-CHWSQXEVSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@@H]([NH2+]CCF)c1cccc(C[NH+](C)C)c1 ZINC000926347606 631726691 /nfs/dbraw/zinc/72/66/91/631726691.db2.gz GNYCKVLLDGBYEC-LLVKDONJSA-N 2 0 224.323 2.368 20 0 BEADRP C[C@H]1CSCCC[N@@H+]1CC[C@@H]1CCC[NH+]1C ZINC000934303797 631770697 /nfs/dbraw/zinc/77/06/97/631770697.db2.gz MGBJBYKEYXTDQY-STQMWFEESA-N 2 0 242.432 2.298 20 0 BEADRP C[C@@H]1CSCCC[N@@H+]1CC[C@H]1CCC[NH+]1C ZINC000934303794 631771248 /nfs/dbraw/zinc/77/12/48/631771248.db2.gz MGBJBYKEYXTDQY-CHWSQXEVSA-N 2 0 242.432 2.298 20 0 BEADRP C[C@H](Cc1ccsc1)[NH2+]CCC(C)(C)[NH3+] ZINC000308989659 631780794 /nfs/dbraw/zinc/78/07/94/631780794.db2.gz VPALHCRVODNVMK-SNVBAGLBSA-N 2 0 226.389 2.396 20 0 BEADRP C[N@H+](CC1(C)CCC1)C1CCC([NH3+])CC1 ZINC000308988910 631781322 /nfs/dbraw/zinc/78/13/22/631781322.db2.gz MXYFVKZKVBUWJZ-UHFFFAOYSA-N 2 0 210.365 2.378 20 0 BEADRP CSC1(C[NH2+][C@@H]2CCCC[C@@H]2C[NH3+])CCC1 ZINC000235087446 631977590 /nfs/dbraw/zinc/97/75/90/631977590.db2.gz JRPPMSVVLUEXAI-VXGBXAGGSA-N 2 0 242.432 2.379 20 0 BEADRP C[C@H]1CCC[N@@H+]1CCC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000251554177 635704498 /nfs/dbraw/zinc/70/44/98/635704498.db2.gz AAWUXXYWQSWPDH-FUDCBSFHSA-N 2 0 222.376 2.391 20 0 BEADRP C[C@@H](C1CC1)[N@H+](C)C[C@@]1(C)CCC[NH2+]C1 ZINC000219754868 632564808 /nfs/dbraw/zinc/56/48/08/632564808.db2.gz NRYXWBRWGQJGMK-AAEUAGOBSA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@@H]1CCC[N@@H+]1C[C@@]1(C)CCC[NH2+]C1 ZINC000219757666 632567951 /nfs/dbraw/zinc/56/79/51/632567951.db2.gz DFFDOAQXEMRDRC-OLZOCXBDSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@@H]1CCC[C@H](C[N@@H+]2CC[C@H](C[NH3+])C2)C1 ZINC000084344518 632637835 /nfs/dbraw/zinc/63/78/35/632637835.db2.gz KXQMSPQWDLBSJD-FRRDWIJNSA-N 2 0 210.365 2.093 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@@H]2CCC(F)(F)C2)CC1 ZINC000309334756 632944556 /nfs/dbraw/zinc/94/45/56/632944556.db2.gz AJKIRLVBFHDSTJ-LLVKDONJSA-N 2 0 232.318 2.106 20 0 BEADRP Cc1ccc(OCC[N@@H+]2CC[C@@](C)(C[NH3+])C2)cc1 ZINC000311219479 633086006 /nfs/dbraw/zinc/08/60/06/633086006.db2.gz TZEDIRSHDNEMAG-HNNXBMFYSA-N 2 0 248.370 2.045 20 0 BEADRP CC(C)C1(C[NH2+][C@H]2CCC[NH2+]CC2)CC1 ZINC000232727447 636029326 /nfs/dbraw/zinc/02/93/26/636029326.db2.gz PHOHKZFTVYPFSV-LBPRGKRZSA-N 2 0 210.365 2.154 20 0 BEADRP CC1CCC(C[NH2+]C[C@@H]2CCC[NH2+]2)CC1 ZINC000232813962 636053161 /nfs/dbraw/zinc/05/31/61/636053161.db2.gz KNUXEAUPLOBAIY-BPCQOVAHSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+][C@@H]2[C@H]3C[C@H]4C[NH2+][C@H]2[C@H]4C3)C1 ZINC000328420707 633763003 /nfs/dbraw/zinc/76/30/03/633763003.db2.gz JVHYNKGRAPVNNE-QLMDPUNJSA-N 2 0 234.387 2.009 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+][C@H]2[C@@H]3[NH2+]C[C@@H]4C[C@H]2C[C@@H]43)C1 ZINC000328420708 633763663 /nfs/dbraw/zinc/76/36/63/633763663.db2.gz JVHYNKGRAPVNNE-SRGUQECISA-N 2 0 234.387 2.009 20 0 BEADRP CSCCCC[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000925503049 633826600 /nfs/dbraw/zinc/82/66/00/633826600.db2.gz JQRCWPWUZHGURF-LLVKDONJSA-N 2 0 228.405 2.004 20 0 BEADRP CCCC[C@H](COC)[NH2+][C@@H]1C[C@H]([NH3+])C12CCC2 ZINC000925503605 633830498 /nfs/dbraw/zinc/83/04/98/633830498.db2.gz KQIRACGWZXBUFZ-FRRDWIJNSA-N 2 0 240.391 2.051 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H](C)COC ZINC000053172205 633876061 /nfs/dbraw/zinc/87/60/61/633876061.db2.gz FTKIIWICHRJONH-QWHCGFSZSA-N 2 0 230.396 2.121 20 0 BEADRP C[C@H](N)[C@H]([NH2+]CCCC[NH+](C)C)c1ccccc1 ZINC000925522792 633896011 /nfs/dbraw/zinc/89/60/11/633896011.db2.gz USVRWROFZALYSA-ZFWWWQNUSA-N 2 0 249.402 2.006 20 0 BEADRP CCSCC[C@H](C)[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000925528142 633915921 /nfs/dbraw/zinc/91/59/21/633915921.db2.gz TUBPHMFGIMRKET-RYUDHWBXSA-N 2 0 242.432 2.392 20 0 BEADRP C[C@H](C[NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2)c1ccncc1 ZINC000925541114 633955191 /nfs/dbraw/zinc/95/51/91/633955191.db2.gz HMUUOVTWYREYSU-MRVWCRGKSA-N 2 0 245.370 2.045 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[NH2+]C12CCCC2)C1CC1 ZINC000925585311 634091547 /nfs/dbraw/zinc/09/15/47/634091547.db2.gz TUALFIQQZBGTIL-JQWIXIFHSA-N 2 0 208.349 2.049 20 0 BEADRP CCCC1(C[NH2+][C@H]2CC[NH2+]C2(C)C)CC1 ZINC000925589399 634099792 /nfs/dbraw/zinc/09/97/92/634099792.db2.gz YGXGUINDVLATNS-NSHDSACASA-N 2 0 210.365 2.297 20 0 BEADRP CSC1(C[NH2+][C@H]2CC[NH2+]C23CCC3)CCC1 ZINC000925655274 634217731 /nfs/dbraw/zinc/21/77/31/634217731.db2.gz GDTJMAYSOHIXMC-NSHDSACASA-N 2 0 240.416 2.146 20 0 BEADRP C1CC2(C1)[NH2+]CC[C@@H]2[NH2+][C@@H]1CC2CCC1CC2 ZINC000925675903 634262683 /nfs/dbraw/zinc/26/26/83/634262683.db2.gz HDWFSKYGQBKRSC-PQAZSJQKSA-N 2 0 234.387 2.439 20 0 BEADRP FCCCC[NH2+][C@H]1CC[NH2+]C[C@H]1C1CCCC1 ZINC000925677633 634269899 /nfs/dbraw/zinc/26/98/99/634269899.db2.gz XFPHPFIXFLSYBI-KBPBESRZSA-N 2 0 242.382 2.494 20 0 BEADRP CC1(C)C[C@@H]1[NH2+][C@@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925686365 634300366 /nfs/dbraw/zinc/30/03/66/634300366.db2.gz SGFKGORMAOLFTK-AXFHLTTASA-N 2 0 210.365 2.281 20 0 BEADRP C[C@H]([NH2+]CCC(C)(C)[NH3+])c1ccccc1 ZINC000258608098 635171317 /nfs/dbraw/zinc/17/13/17/635171317.db2.gz AXCLJFWKAMJEPQ-NSHDSACASA-N 2 0 206.333 2.465 20 0 BEADRP C[C@@H]([NH2+]CCC(C)(C)[NH3+])c1ccccc1 ZINC000258608097 635171461 /nfs/dbraw/zinc/17/14/61/635171461.db2.gz AXCLJFWKAMJEPQ-LLVKDONJSA-N 2 0 206.333 2.465 20 0 BEADRP Cc1cccc(CC[NH2+]C2CCC([NH3+])CC2)c1 ZINC000094088717 635182630 /nfs/dbraw/zinc/18/26/30/635182630.db2.gz SXTKFQRQIQZZEK-UHFFFAOYSA-N 2 0 232.371 2.397 20 0 BEADRP CC(C)[C@H](Cc1ccccc1)[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000925768153 635187811 /nfs/dbraw/zinc/18/78/11/635187811.db2.gz TVEPVVXCBNZBJL-BBRMVZONSA-N 2 0 246.398 2.451 20 0 BEADRP CC(C)[C@H](Cc1ccccc1)[NH2+][C@H](C)C1C[NH2+]C1 ZINC000925768158 635188150 /nfs/dbraw/zinc/18/81/50/635188150.db2.gz TVEPVVXCBNZBJL-CJNGLKHVSA-N 2 0 246.398 2.451 20 0 BEADRP C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000925772524 635213806 /nfs/dbraw/zinc/21/38/06/635213806.db2.gz IKFQXXZRABMWBB-MBJXGIAVSA-N 2 0 234.387 2.153 20 0 BEADRP Cc1ccccc1C[NH2+]CCC(C)(C)[NH3+] ZINC000258954467 635229515 /nfs/dbraw/zinc/22/95/15/635229515.db2.gz RTAPYGPVUSJLIE-UHFFFAOYSA-N 2 0 206.333 2.212 20 0 BEADRP C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C[NH2+][C@H]1CC[NH2+]C1(C)C ZINC000925774491 635236915 /nfs/dbraw/zinc/23/69/15/635236915.db2.gz VZMHTZWOYLLOSE-SJHCENCUSA-N 2 0 222.376 2.009 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+][C@H]1C[C@H](C)CC[C@H]1C ZINC000925784352 635299329 /nfs/dbraw/zinc/29/93/29/635299329.db2.gz MTVCTSZYMIHUEO-NJMOYASZSA-N 2 0 210.365 2.009 20 0 BEADRP COc1ccc(C[N@@H+]2CC[C@H]([NH3+])[C@H](C)C2)cc1C ZINC000094338849 635299633 /nfs/dbraw/zinc/29/96/33/635299633.db2.gz MANXCNSPESYZGM-OCCSQVGLSA-N 2 0 248.370 2.173 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@H]1C[C@H](C)CC[C@@H]1C ZINC000925785853 635301965 /nfs/dbraw/zinc/30/19/65/635301965.db2.gz PFQNJIOHAJARBD-BJJPWKGXSA-N 2 0 224.392 2.256 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+][C@H]1CC[C@@H]1C(C)(C)C ZINC000925786255 635305509 /nfs/dbraw/zinc/30/55/09/635305509.db2.gz SZKBQQVGKMABRN-NOOOWODRSA-N 2 0 210.365 2.009 20 0 BEADRP COc1ccc([C@@H](C)[NH2+]C[C@@H]2C[NH2+]C[C@H]2C)cc1 ZINC000925793313 635323413 /nfs/dbraw/zinc/32/34/13/635323413.db2.gz XYFSAEHPRZKSNK-BZPMIXESSA-N 2 0 248.370 2.201 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]CC[C@@H]1C[C@H]1C1CC1 ZINC000925802746 635351826 /nfs/dbraw/zinc/35/18/26/635351826.db2.gz QMMDQUGHGQGTQR-RZFFKMDDSA-N 2 0 236.403 2.400 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1C[NH2+]C[C@H]1C)[C@H]1CC1(C)C ZINC000925802772 635354259 /nfs/dbraw/zinc/35/42/59/635354259.db2.gz IQLXNGSAPBUWJH-YVECIDJPSA-N 2 0 224.392 2.256 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1C[NH2+]C[C@H]1C)[C@H]1CC1(C)C ZINC000925802762 635354828 /nfs/dbraw/zinc/35/48/28/635354828.db2.gz IQLXNGSAPBUWJH-FDYHWXHSSA-N 2 0 224.392 2.256 20 0 BEADRP [NH3+]C[C@H]1CC[N@H+](Cc2cccc(C3CC3)c2)C1 ZINC000094522061 635368284 /nfs/dbraw/zinc/36/82/84/635368284.db2.gz VJBMVZVMOBFTNT-CYBMUJFWSA-N 2 0 230.355 2.345 20 0 BEADRP CCCCOCC[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000040506008 635416171 /nfs/dbraw/zinc/41/61/71/635416171.db2.gz SMHSCQJWLRUZOV-UHFFFAOYSA-N 2 0 242.407 2.266 20 0 BEADRP COC[C@@H](C[NH2+][C@H](C)CCCC[NH3+])C(C)C ZINC000925873889 635596248 /nfs/dbraw/zinc/59/62/48/635596248.db2.gz MVDACPMRFWJTDK-CHWSQXEVSA-N 2 0 230.396 2.012 20 0 BEADRP c1csc(C[NH2+]CCC[C@H]2CCC[NH2+]2)c1 ZINC000336745858 635944694 /nfs/dbraw/zinc/94/46/94/635944694.db2.gz BMPAJVWENDEREP-NSHDSACASA-N 2 0 224.373 2.370 20 0 BEADRP CC1(C[NH2+][C@H]2[C@@H]3[NH2+]C[C@H]4C[C@H]2C[C@H]34)CCCC1 ZINC000328573047 636298861 /nfs/dbraw/zinc/29/88/61/636298861.db2.gz VJNJXWIRCXEVJZ-MEBFFEOJSA-N 2 0 234.387 2.153 20 0 BEADRP CNc1ccccc1C[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000902266766 637289062 /nfs/dbraw/zinc/28/90/62/637289062.db2.gz UHFQBHOHBPMOPX-JSGCOSHPSA-N 2 0 247.386 2.301 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+]C2C[C@H]3CCC[C@@H]3C2)C1 ZINC000902751911 637330496 /nfs/dbraw/zinc/33/04/96/637330496.db2.gz DBDKQPGZXWIPKU-MGPQQGTHSA-N 2 0 236.403 2.497 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H]2C[C@H]3CCC[C@H]3C2)C1 ZINC000902751910 637331452 /nfs/dbraw/zinc/33/14/52/637331452.db2.gz DBDKQPGZXWIPKU-APIJFGDWSA-N 2 0 236.403 2.497 20 0 BEADRP Cc1ccc2c(c1)C[N@@H+](C[C@@H]1CC[C@H]([NH3+])C1)CC2 ZINC000903463645 637365187 /nfs/dbraw/zinc/36/51/87/637365187.db2.gz HPEQAEGZKKZQJR-CJNGLKHVSA-N 2 0 244.382 2.481 20 0 BEADRP CC1(CN2CC[C@@]3(C2)CCCC[NH2+]3)CC1 ZINC000904431522 637400150 /nfs/dbraw/zinc/40/01/50/637400150.db2.gz VQQPVNUCJYBROV-CYBMUJFWSA-N 2 0 208.349 2.005 20 0 BEADRP CC1(CN2CC[C@]3(C2)CCCC[NH2+]3)CC1 ZINC000904431523 637401398 /nfs/dbraw/zinc/40/13/98/637401398.db2.gz VQQPVNUCJYBROV-ZDUSSCGKSA-N 2 0 208.349 2.005 20 0 BEADRP COc1ccc([C@@H](C)[NH2+]C2CC(C[NH3+])C2)cc1C ZINC000904443377 637410682 /nfs/dbraw/zinc/41/06/82/637410682.db2.gz HTPLSIOOCDYISR-LKSINWNRSA-N 2 0 248.370 2.392 20 0 BEADRP C[C@@H]([NH2+]C1CC(C[NH3+])C1)c1ccc2c(c1)CCO2 ZINC000904443372 637411912 /nfs/dbraw/zinc/41/19/12/637411912.db2.gz HJYUCAKSNQGVIN-CDWSIMAYSA-N 2 0 246.354 2.009 20 0 BEADRP C[N@@H+]1CCCC[C@@H]1CCOc1ccncc1 ZINC000906508123 638179438 /nfs/dbraw/zinc/17/94/38/638179438.db2.gz VKZSNYCUNHKOGT-GFCCVEGCSA-N 2 0 220.316 2.335 20 0 BEADRP C[N@@H+]1CCCC[C@H]1CCOc1ccncc1 ZINC000906508124 638179572 /nfs/dbraw/zinc/17/95/72/638179572.db2.gz VKZSNYCUNHKOGT-LBPRGKRZSA-N 2 0 220.316 2.335 20 0 BEADRP CCCOc1cccc(C[NH2+]C2CC([NH3+])C2)c1 ZINC000906509195 638181425 /nfs/dbraw/zinc/18/14/25/638181425.db2.gz AACREKMIWNNDTF-UHFFFAOYSA-N 2 0 234.343 2.055 20 0 BEADRP [NH3+]C1CC([NH2+]CCCCCOc2ccccc2)C1 ZINC000906510867 638183086 /nfs/dbraw/zinc/18/30/86/638183086.db2.gz NANVSYSEHRTACQ-UHFFFAOYSA-N 2 0 248.370 2.315 20 0 BEADRP CC[C@@H]1CCC[C@@H](C[NH2+]C2CC([NH3+])C2)C1 ZINC000906510159 638184394 /nfs/dbraw/zinc/18/43/94/638184394.db2.gz OKGWCNLKCSITTF-OKZRHMCRSA-N 2 0 210.365 2.282 20 0 BEADRP CCCCNc1c[nH+]ccc1N1CC[NH+](C)CC1 ZINC000906530137 638185943 /nfs/dbraw/zinc/18/59/43/638185943.db2.gz ZBYDZEKNSIGVJV-UHFFFAOYSA-N 2 0 248.374 2.045 20 0 BEADRP Cc1cc(C[NH2+][C@H]2C[C@H]([NH3+])C2)cc2cccnc12 ZINC000906518321 638187093 /nfs/dbraw/zinc/18/70/93/638187093.db2.gz WJHKAKFBOKVFEJ-HDJSIYSDSA-N 2 0 241.338 2.123 20 0 BEADRP Cc1ccc2cc(C[NH2+][C@H]3C[C@H]([NH3+])C3)ccc2n1 ZINC000906517118 638187378 /nfs/dbraw/zinc/18/73/78/638187378.db2.gz FQLQWNVABWJSFU-HDJSIYSDSA-N 2 0 241.338 2.123 20 0 BEADRP Cc1cc(Cl)ccc1C[NH2+][C@H]1C[C@H]([NH3+])C1 ZINC000906518228 638187414 /nfs/dbraw/zinc/18/74/14/638187414.db2.gz TWTSUHABYVTYJH-HAQNSBGRSA-N 2 0 224.735 2.228 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2C[C@H]([NH3+])C2)cc1Cl ZINC000906517980 638187697 /nfs/dbraw/zinc/18/76/97/638187697.db2.gz LVNXIDORZOPJDW-XYPYZODXSA-N 2 0 224.735 2.228 20 0 BEADRP CC1(C)CCC[C@H](C[NH2+][C@H]2C[C@H]([NH3+])C2)C1 ZINC000906516724 638188069 /nfs/dbraw/zinc/18/80/69/638188069.db2.gz IYUJORVIJPZOLZ-SRVKXCTJSA-N 2 0 210.365 2.282 20 0 BEADRP CCCC[NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1 ZINC000906530043 638189322 /nfs/dbraw/zinc/18/93/22/638189322.db2.gz WHCYDAAHMIRTGD-ZDUSSCGKSA-N 2 0 212.381 2.497 20 0 BEADRP CCCC[NH2+]CC1(SC)CC[NH+](C)CC1 ZINC000906531747 638200256 /nfs/dbraw/zinc/20/02/56/638200256.db2.gz TXIPVQFVDRQDLR-UHFFFAOYSA-N 2 0 230.421 2.204 20 0 BEADRP CCCC[NH2+]C[C@H]1CCN1C1CCCC1 ZINC000906534482 638201486 /nfs/dbraw/zinc/20/14/86/638201486.db2.gz RKKMTHPJVQWGAD-CYBMUJFWSA-N 2 0 210.365 2.393 20 0 BEADRP C[C@@H]1CCC[N@H+](CCOC2CC2)[C@@H]1CCC[NH3+] ZINC000711786410 711466935 /nfs/dbraw/zinc/46/69/35/711466935.db2.gz NVSAUFRSPMEHRT-TZMCWYRMSA-N 2 0 240.391 2.005 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1CCC[C@]2(CC[NH+](C)C2)C1 ZINC000930601077 639816624 /nfs/dbraw/zinc/81/66/24/639816624.db2.gz CUXQJJJZVWZYIP-QLFBSQMISA-N 2 0 236.403 2.450 20 0 BEADRP C[C@@H](C1CC1)[N@@H+]1CCC[C@@]2(CC[NH+](C)C2)C1 ZINC000930602256 639817223 /nfs/dbraw/zinc/81/72/23/639817223.db2.gz OLYWYGRYUYLNBP-JSGCOSHPSA-N 2 0 222.376 2.203 20 0 BEADRP C[C@@H]1CO[C@@H](C)C[N@@H+]1CCCCCCC[NH3+] ZINC000035787403 639945248 /nfs/dbraw/zinc/94/52/48/639945248.db2.gz DVTBGNYSBNZVBI-OLZOCXBDSA-N 2 0 228.380 2.005 20 0 BEADRP CC[C@H](C)C[N@@H+]1C[C@@]2(C)CN(C)C[C@@]2(C)C1 ZINC000931309854 640146513 /nfs/dbraw/zinc/14/65/13/640146513.db2.gz HFYYONGDMCBAFE-MELADBBJSA-N 2 0 224.392 2.306 20 0 BEADRP CN1C[C@]2(C)C[N@@H+]([C@@H]3C=CCCC3)C[C@]2(C)C1 ZINC000931310718 640146708 /nfs/dbraw/zinc/14/67/08/640146708.db2.gz MMEUWTRTHTYHIN-KFWWJZLASA-N 2 0 234.387 2.369 20 0 BEADRP CC1CC(C[NH+]2CCC(C)([NH+](C)C)CC2)C1 ZINC000931355805 640168525 /nfs/dbraw/zinc/16/85/25/640168525.db2.gz AJZSSFAVXZITNV-UHFFFAOYSA-N 2 0 224.392 2.449 20 0 BEADRP CC[C@@H]1C[C@H]1CN1CC[C@@H]2[C@H](CC[N@@H+]2C)C1 ZINC000931545807 640266549 /nfs/dbraw/zinc/26/65/49/640266549.db2.gz GJPZUCFKFZDNSZ-YIYPIFLZSA-N 2 0 222.376 2.059 20 0 BEADRP C[NH+]1CCC(C[NH2+]C[C@@H]2CC=CCC2)CC1 ZINC000044516024 640398956 /nfs/dbraw/zinc/39/89/56/640398956.db2.gz SWSLBSOYBPSTMX-CYBMUJFWSA-N 2 0 222.376 2.274 20 0 BEADRP C[NH+]1CCC(C[NH2+]C2Cc3ccccc3C2)CC1 ZINC000044516322 640399536 /nfs/dbraw/zinc/39/95/36/640399536.db2.gz QFANGRVEAPOHPZ-UHFFFAOYSA-N 2 0 244.382 2.085 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1cnc[nH]1 ZINC000054763211 640403621 /nfs/dbraw/zinc/40/36/21/640403621.db2.gz XBIZATQYWLZZFV-LBPRGKRZSA-N 2 0 238.379 2.010 20 0 BEADRP CC[N@@H+]1CCC[C@H](C[NH2+]C2CCCC2)C1 ZINC000163726708 640414512 /nfs/dbraw/zinc/41/45/12/640414512.db2.gz NQNZUNQUHXQBKY-GFCCVEGCSA-N 2 0 210.365 2.251 20 0 BEADRP COc1ccccc1C[N@H+](C)C1CCC([NH3+])CC1 ZINC000055144478 640439856 /nfs/dbraw/zinc/43/98/56/640439856.db2.gz BXDVGPLVAWYAPC-UHFFFAOYSA-N 2 0 248.370 2.397 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CCC[N@@H+]([C@@H](C)c2ccccn2)C1 ZINC000226331522 640748248 /nfs/dbraw/zinc/74/82/48/640748248.db2.gz AKGQDDMJMODQML-RWMBFGLXSA-N 2 0 233.359 2.202 20 0 BEADRP CC/C=C\CC[N@@H+]1C[C@@H]2C[NH+](C)C[C@]2(C)C1 ZINC000933735230 640758077 /nfs/dbraw/zinc/75/80/77/640758077.db2.gz GXAYAEISPKGERA-MEWZEZIVSA-N 2 0 222.376 2.226 20 0 BEADRP c1ccc([C@H]2CC[N@@H+](C[C@H]3CCC[NH2+]C3)C2)cc1 ZINC000227086539 640815367 /nfs/dbraw/zinc/81/53/67/640815367.db2.gz GMSNDDHMMIXEQL-HOCLYGCPSA-N 2 0 244.382 2.476 20 0 BEADRP C([C@H]1CCC[NH2+]1)[N@@H+]1CCC[C@H]2CCC[C@@H]21 ZINC000227649846 640844074 /nfs/dbraw/zinc/84/40/74/640844074.db2.gz FCBHVLLQMLDUJW-UPJWGTAASA-N 2 0 208.349 2.003 20 0 BEADRP CC1(C)CCC[C@@H]1[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000087647684 640956238 /nfs/dbraw/zinc/95/62/38/640956238.db2.gz HEEYBSKTDRCCHH-NEPJUHHUSA-N 2 0 210.365 2.154 20 0 BEADRP CC1(C)CC[NH+](CCC2CC[NH2+]CC2)CC1 ZINC000061820347 640997022 /nfs/dbraw/zinc/99/70/22/640997022.db2.gz XEPAQOKAHWWWGS-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP CO[C@H]1C[N@H+](CCCCCCC[NH3+])CC[C@@H]1C ZINC000230310672 641045490 /nfs/dbraw/zinc/04/54/90/641045490.db2.gz KSNULFSRECTKKI-KBPBESRZSA-N 2 0 242.407 2.252 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+][C@@H]2CCC[C@@H]2C[NH3+])C1 ZINC000230412279 641052371 /nfs/dbraw/zinc/05/23/71/641052371.db2.gz RZEGZUTXLGLUGV-YVECIDJPSA-N 2 0 210.365 2.140 20 0 BEADRP C[C@H](Cc1cccnc1)[NH2+]CC[C@H]1CCC[N@@H+]1C ZINC000934233020 641109653 /nfs/dbraw/zinc/10/96/53/641109653.db2.gz HNJYTATYGRGVSK-UKRRQHHQSA-N 2 0 247.386 2.087 20 0 BEADRP C[C@@H](Cc1cccnc1)[NH2+]CC[C@@H]1CCC[N@@H+]1C ZINC000934233021 641110016 /nfs/dbraw/zinc/11/00/16/641110016.db2.gz HNJYTATYGRGVSK-ZFWWWQNUSA-N 2 0 247.386 2.087 20 0 BEADRP CC(C)C1CC[NH+](C[C@@H]2C[NH2+]C[C@H]2C)CC1 ZINC000232539440 641296935 /nfs/dbraw/zinc/29/69/35/641296935.db2.gz DPSKHYYTVACKNO-OCCSQVGLSA-N 2 0 224.392 2.210 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+]C[C@@H]1CCCC[NH2+]C1 ZINC000319465490 641603546 /nfs/dbraw/zinc/60/35/46/641603546.db2.gz VQGUEGPCLTXSBO-RWMBFGLXSA-N 2 0 212.381 2.400 20 0 BEADRP CC1(C)CCC[C@@H]([NH2+]C[C@H]2CCC[NH2+]2)C1 ZINC000232782422 641674631 /nfs/dbraw/zinc/67/46/31/641674631.db2.gz JQTDUQWIOUNOBD-VXGBXAGGSA-N 2 0 210.365 2.297 20 0 BEADRP CCc1ccc(C[NH2+]C2CC[NH2+]CC2)s1 ZINC000225164431 641708145 /nfs/dbraw/zinc/70/81/45/641708145.db2.gz RJTJUCDQOXFZHE-UHFFFAOYSA-N 2 0 224.373 2.152 20 0 BEADRP [NH3+]CC[C@@H]1CC[N@H+](Cc2c(F)cccc2F)C1 ZINC000076685511 641820315 /nfs/dbraw/zinc/82/03/15/641820315.db2.gz WBPXJQAICUOCLP-SNVBAGLBSA-N 2 0 240.297 2.136 20 0 BEADRP CCC[NH+](CCC)C[C@H]1CC[NH2+][C@H](C)C1 ZINC000233023954 642642547 /nfs/dbraw/zinc/64/25/47/642642547.db2.gz JAUFTGQMFWOCSB-OLZOCXBDSA-N 2 0 212.381 2.497 20 0 BEADRP CC1(C[NH2+][C@@H]2CCCC[C@H]2C[NH3+])CCC1 ZINC000233020328 642643926 /nfs/dbraw/zinc/64/39/26/642643926.db2.gz WEZYVDQDMLRODJ-NWDGAFQWSA-N 2 0 210.365 2.284 20 0 BEADRP CCC[C@@H](C)[NH2+]Cc1ccc(CC[NH3+])cc1 ZINC000233277583 642655213 /nfs/dbraw/zinc/65/52/13/642655213.db2.gz OGUDJXKVXQKPHG-GFCCVEGCSA-N 2 0 220.360 2.466 20 0 BEADRP CC[N@H+](CC(C)C)C[C@H]1CC[NH2+][C@@H](C)C1 ZINC000233461724 642673123 /nfs/dbraw/zinc/67/31/23/642673123.db2.gz UBVWLVHWMKHXQM-STQMWFEESA-N 2 0 212.381 2.352 20 0 BEADRP CC[N@@H+](Cc1cccs1)C[C@@H]1C[NH2+]C[C@H]1C ZINC000233486963 642675332 /nfs/dbraw/zinc/67/53/32/642675332.db2.gz FWBZMSMQKSSLHI-NEPJUHHUSA-N 2 0 238.400 2.426 20 0 BEADRP CCO[C@@H]1C[C@@H]([NH2+]CC([NH3+])(CC)CC)C1(C)C ZINC000233741917 642692651 /nfs/dbraw/zinc/69/26/51/642692651.db2.gz KRWKKMIULPQXPY-VXGBXAGGSA-N 2 0 242.407 2.297 20 0 BEADRP CC(C)(C)C[NH2+]Cc1ccc(CC[NH3+])cc1 ZINC000070533152 643034336 /nfs/dbraw/zinc/03/43/36/643034336.db2.gz GTGSDHRXIAAFRH-UHFFFAOYSA-N 2 0 220.360 2.324 20 0 BEADRP C[NH+]1CCC(C[NH2+]CC2(C)CCCC2)CC1 ZINC000082619118 643355415 /nfs/dbraw/zinc/35/54/15/643355415.db2.gz LBHJHXDMOCQWCD-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@H]1C[N@H+](C[C@H]2CC[NH2+]C2)Cc2ccccc21 ZINC000843356220 643363369 /nfs/dbraw/zinc/36/33/69/643363369.db2.gz HTVRRHIWVARPAI-STQMWFEESA-N 2 0 230.355 2.215 20 0 BEADRP CC(C)(C[NH2+][C@@H]1CCC[C@H]1[NH3+])c1cccs1 ZINC000259086647 643381453 /nfs/dbraw/zinc/38/14/53/643381453.db2.gz RNHWPKGUEOARJT-GHMZBOCLSA-N 2 0 238.400 2.495 20 0 BEADRP C(C[NH+](CC1CC1)CC1CC1)C1CC[NH2+]CC1 ZINC000070506115 643386261 /nfs/dbraw/zinc/38/62/61/643386261.db2.gz LDUMKAUQWULTHE-UHFFFAOYSA-N 2 0 236.403 2.498 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[NH+]2CCCCCCC2)C1 ZINC000085014481 643523216 /nfs/dbraw/zinc/52/32/16/643523216.db2.gz MVOSJDOAHGRWJN-QWHCGFSZSA-N 2 0 210.365 2.380 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@@H+]1CCC[C@H]2CCC[C@@H]21 ZINC000083701650 643617181 /nfs/dbraw/zinc/61/71/81/643617181.db2.gz MMMVVORZNAAQQD-MQYQWHSLSA-N 2 0 222.376 2.106 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+]CCc1ccsc1 ZINC000084216477 643650384 /nfs/dbraw/zinc/65/03/84/643650384.db2.gz DKIKJVKJVORTIV-CHWSQXEVSA-N 2 0 238.400 2.398 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CCC[C@@H]2C[NH3+])s1 ZINC000084221302 643651161 /nfs/dbraw/zinc/65/11/61/643651161.db2.gz VUWIWYGLJFUFEV-PWSUYJOCSA-N 2 0 224.373 2.274 20 0 BEADRP CSc1ccc(C[N@@H+]2CC[C@@H](C[NH3+])C2)cc1 ZINC000050245421 643660654 /nfs/dbraw/zinc/66/06/54/643660654.db2.gz MNXUTDILRALDNX-LBPRGKRZSA-N 2 0 236.384 2.189 20 0 BEADRP Cc1cc(C)c(C[N@@H+]2CC[C@H](C[NH3+])C2)c(C)c1 ZINC000050245255 643661872 /nfs/dbraw/zinc/66/18/72/643661872.db2.gz ZLLSVMOMWMXVQC-CQSZACIVSA-N 2 0 232.371 2.392 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+][C@@H]2CCCOCC2)c2ccccc21 ZINC000261554994 643664456 /nfs/dbraw/zinc/66/44/56/643664456.db2.gz BEQSXUGPDHYSOC-DFBGVHRSSA-N 2 0 246.354 2.290 20 0 BEADRP CC[NH+](CC)CCC[NH2+]C[C@H]1CCC=CO1 ZINC000050267369 643671451 /nfs/dbraw/zinc/67/14/51/643671451.db2.gz UBUSPVDRHSTMBQ-CYBMUJFWSA-N 2 0 226.364 2.001 20 0 BEADRP C[C@H]([N@H+](C)C[C@@H]1CC[C@H]([NH3+])C1)C(C)(C)C ZINC000085015396 643678909 /nfs/dbraw/zinc/67/89/09/643678909.db2.gz ZIBDKXXTGUPSRV-TUAOUCFPSA-N 2 0 212.381 2.480 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[NH+]2Cc3ccccc3C2)C1 ZINC000085015672 643679138 /nfs/dbraw/zinc/67/91/38/643679138.db2.gz VUZZBMPBSRDMJO-SMDDNHRTSA-N 2 0 216.328 2.130 20 0 BEADRP CC1([NH+]2CCC2)CCC([NH2+]CC2CC2)CC1 ZINC000922847378 644119619 /nfs/dbraw/zinc/11/96/19/644119619.db2.gz NTFNOIVIJREIAR-UHFFFAOYSA-N 2 0 222.376 2.393 20 0 BEADRP CC(C)C1(C[NH2+]C2CCC([NH3+])CC2)CC1 ZINC000232659161 644169159 /nfs/dbraw/zinc/16/91/59/644169159.db2.gz NWJSWMPXAJGUHG-UHFFFAOYSA-N 2 0 210.365 2.282 20 0 BEADRP C([NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)[C@]12C[C@H]1CCC2 ZINC000922962954 644203777 /nfs/dbraw/zinc/20/37/77/644203777.db2.gz OLRPGPXNYVXLTG-QPSCCSFWSA-N 2 0 234.387 2.393 20 0 BEADRP [NH3+]C1(C[NH2+]C[C@H]2CC3CCC2CC3)CCC1 ZINC000923330536 644348855 /nfs/dbraw/zinc/34/88/55/644348855.db2.gz AMOWGPZGWCHCIW-WXRRBKDZSA-N 2 0 222.376 2.284 20 0 BEADRP CCCCCC[C@@H](O)C[NH+]1CCC(C)([NH3+])CC1 ZINC000923346306 644364594 /nfs/dbraw/zinc/36/45/94/644364594.db2.gz PDJYFSZMJLWLES-CYBMUJFWSA-N 2 0 242.407 2.131 20 0 BEADRP CCCCCC[C@H](O)C[N@@H+]1CC[C@@H]([NH3+])C[C@@H]1C ZINC000923392204 644399618 /nfs/dbraw/zinc/39/96/18/644399618.db2.gz IIOZYAKZXCMRGU-MJBXVCDLSA-N 2 0 242.407 2.129 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+]CC1CCCC1 ZINC000084215933 644420346 /nfs/dbraw/zinc/42/03/46/644420346.db2.gz CPAVKGZWKZYTTC-OLZOCXBDSA-N 2 0 210.365 2.284 20 0 BEADRP CCCCCC[C@H](O)C[NH2+][C@@H]1C[C@@H]([NH3+])C1(C)C ZINC000923420265 644425327 /nfs/dbraw/zinc/42/53/27/644425327.db2.gz HFLSFXKHIWXGLI-YNEHKIRRSA-N 2 0 242.407 2.033 20 0 BEADRP C[C@@H]1C[N@H+](CCCCCF)CC[C@H]1C[NH3+] ZINC000923495296 644461012 /nfs/dbraw/zinc/46/10/12/644461012.db2.gz BGEOUJUQBIWVCF-NEPJUHHUSA-N 2 0 216.344 2.043 20 0 BEADRP C[C@H]1C[N@H+](CC2CC(C)(C)C2)CC[C@@H]1C[NH3+] ZINC000923489832 644465512 /nfs/dbraw/zinc/46/55/12/644465512.db2.gz LQHWOVBKBYSZJF-WCQYABFASA-N 2 0 224.392 2.339 20 0 BEADRP C[C@H]1C[N@H+](CCCC2CC2)CC[C@@H]1C[NH3+] ZINC000923492586 644467236 /nfs/dbraw/zinc/46/72/36/644467236.db2.gz XLVNQWHZORKTIB-WCQYABFASA-N 2 0 210.365 2.093 20 0 BEADRP Cc1ccc(CC[N@@H+]2CC[C@H](C[NH3+])[C@@H](C)C2)cc1 ZINC000923498336 644472007 /nfs/dbraw/zinc/47/20/07/644472007.db2.gz OEQOSNWYPHSVLZ-GOEBONIOSA-N 2 0 246.398 2.454 20 0 BEADRP C(C1CCC2(CC2)CC1)[N@@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1 ZINC000923516002 644480550 /nfs/dbraw/zinc/48/05/50/644480550.db2.gz QHBMLJUHDYHQGA-LSDHHAIUSA-N 2 0 248.414 2.498 20 0 BEADRP C[C@@H](C[N@@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1)C(C)(C)C ZINC000923515784 644480599 /nfs/dbraw/zinc/48/05/99/644480599.db2.gz MCNNFYDAQMKNOB-RWMBFGLXSA-N 2 0 224.392 2.210 20 0 BEADRP Cc1ccccc1C[N@@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1 ZINC000923519037 644482407 /nfs/dbraw/zinc/48/24/07/644482407.db2.gz AJGFMFOSYZCSFD-LSDHHAIUSA-N 2 0 230.355 2.036 20 0 BEADRP C[C@H]1CCCC[C@H]1C[N@@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1 ZINC000923518954 644482677 /nfs/dbraw/zinc/48/26/77/644482677.db2.gz HIWPOJOMFQZTPR-ZQDZILKHSA-N 2 0 236.403 2.354 20 0 BEADRP C[C@]1(Cc2cccs2)CCC[N@@H+]1CCC[NH3+] ZINC000923529316 644485114 /nfs/dbraw/zinc/48/51/14/644485114.db2.gz CSISTSMWECEIJJ-CYBMUJFWSA-N 2 0 238.400 2.494 20 0 BEADRP CCc1ccccc1C[NH2+][C@H]1CCC[C@H]1C[NH3+] ZINC000089150769 644536122 /nfs/dbraw/zinc/53/61/22/644536122.db2.gz BBSVNJKWVRTJMH-ZFWWWQNUSA-N 2 0 232.371 2.466 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]CCOc1ccccc1 ZINC000089145807 644536167 /nfs/dbraw/zinc/53/61/67/644536167.db2.gz YDEIBPPIIWZNFA-ZFWWWQNUSA-N 2 0 248.370 2.173 20 0 BEADRP C[N@H+](CC[C@H]1CC[NH2+]C1)Cc1ccc(F)cc1 ZINC000089749198 644565311 /nfs/dbraw/zinc/56/53/11/644565311.db2.gz DPZBKSDBMHRHKP-GFCCVEGCSA-N 2 0 236.334 2.257 20 0 BEADRP C[N@H+](CC[C@@H]1CC[NH2+]C1)Cc1ccccc1F ZINC000089749191 644565539 /nfs/dbraw/zinc/56/55/39/644565539.db2.gz MHJPPKKOIWHZNJ-LBPRGKRZSA-N 2 0 236.334 2.257 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+][C@H]1CCOc2ccccc21 ZINC000250836135 644781980 /nfs/dbraw/zinc/78/19/80/644781980.db2.gz AWKWSYYSTOMYNW-UBHSHLNASA-N 2 0 246.354 2.227 20 0 BEADRP C[C@@H]1C[C@H](C)C[N@@H+](CC[C@H]2CCC[NH2+]C2)C1 ZINC000251764405 644820380 /nfs/dbraw/zinc/82/03/80/644820380.db2.gz DTTPXXKDUUTOLF-HZSPNIEDSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H]1C[N@H+](CC2CCCC2)CC[C@H]1C[NH3+] ZINC000251836167 644825046 /nfs/dbraw/zinc/82/50/46/644825046.db2.gz PZPJIZOQRIANKW-YPMHNXCESA-N 2 0 210.365 2.093 20 0 BEADRP C[C@H]1C[N@H+](CCc2ccccc2)CC[C@H]1C[NH3+] ZINC000251855541 644828011 /nfs/dbraw/zinc/82/80/11/644828011.db2.gz RYAXDYAIASELGX-ZFWWWQNUSA-N 2 0 232.371 2.146 20 0 BEADRP C[C@@H]1CCC[N@H+](CC[C@H]2CCC[NH2+]C2)CC1 ZINC000252140932 644836373 /nfs/dbraw/zinc/83/63/73/644836373.db2.gz MGMANOWYINNTSM-ZIAGYGMSSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@H]1C[C@H]([NH2+]C[C@@H]2CCC[NH2+]C2)C[C@@H](C)C1 ZINC000252183797 644840035 /nfs/dbraw/zinc/84/00/35/644840035.db2.gz TZUOZLUVYYDJNY-RQJABVFESA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[N@H+](C)CC[C@H]1CC[NH2+]C1 ZINC000252175028 644840827 /nfs/dbraw/zinc/84/08/27/644840827.db2.gz OTVUZVBOQLUANX-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1CCCC[N@@H+]1CCC[NH2+][C@H]1CCSC1 ZINC000252196660 644842907 /nfs/dbraw/zinc/84/29/07/644842907.db2.gz SMJFOKQZKVIBGJ-STQMWFEESA-N 2 0 242.432 2.346 20 0 BEADRP CC(C)C[C@H](C)C[N@@H+]1CC[C@@]2(CCC[NH2+]2)C1 ZINC000415141987 644884508 /nfs/dbraw/zinc/88/45/08/644884508.db2.gz QFBKYCGTCAATEG-KBPBESRZSA-N 2 0 224.392 2.497 20 0 BEADRP CCC[C@H](C)C[N@@H+]1CC[C@]2(CCC[NH2+]2)C1 ZINC000415135602 644886014 /nfs/dbraw/zinc/88/60/14/644886014.db2.gz GJNRDVJHXIPHDI-QWHCGFSZSA-N 2 0 210.365 2.251 20 0 BEADRP C[N@H+]1C[C@H]2CC[C@@H](C1)C2[NH2+][C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000926642647 645329699 /nfs/dbraw/zinc/32/96/99/645329699.db2.gz QYJJFECVWKWUBD-SPETUVNMSA-N 2 0 234.387 2.105 20 0 BEADRP C[C@H]([NH2+]CC[C@]1(C)C[C@]1(F)Cl)[C@H]1CCC[NH2+]1 ZINC000844923178 645349351 /nfs/dbraw/zinc/34/93/51/645349351.db2.gz HZGMRXOLAPWDPY-IRCOFANPSA-N 2 0 248.773 2.421 20 0 BEADRP C(CC1CC[NH2+]CC1)[NH2+][C@@H]1CC[C@@H]1C1CC1 ZINC000844927382 645350068 /nfs/dbraw/zinc/35/00/68/645350068.db2.gz ZOUJSSVFTDKRAN-ZIAGYGMSSA-N 2 0 222.376 2.154 20 0 BEADRP C[N@H+]1C[C@H]2CC[C@@H](C1)C2[NH2+]C1CC(C)(C)C1 ZINC000926731286 645393428 /nfs/dbraw/zinc/39/34/28/645393428.db2.gz AKBDVYZFINQXJT-QYJAPNMZSA-N 2 0 222.376 2.105 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C[C@]23C[C@H]2CCC3)CC[N@@H+]1C ZINC000927120142 645555361 /nfs/dbraw/zinc/55/53/61/645555361.db2.gz SSAGLKPLSSTXRY-MQYQWHSLSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+][C@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C ZINC000925482031 645861798 /nfs/dbraw/zinc/86/17/98/645861798.db2.gz PTWDJZVVQCONPX-KVSVUVNWSA-N 2 0 222.376 2.009 20 0 BEADRP C[C@@H](C[NH2+][C@@H](CCC[NH3+])c1ccccc1)N(C)C ZINC000925494610 645924127 /nfs/dbraw/zinc/92/41/27/645924127.db2.gz KPXMDYGPIKHYNU-ZFWWWQNUSA-N 2 0 249.402 2.006 20 0 BEADRP CC(C)[N@@H+](C)CCC[NH2+][C@H](C)Cc1ccccn1 ZINC000924616225 646076468 /nfs/dbraw/zinc/07/64/68/646076468.db2.gz AJXHGCWGWNYEIY-CQSZACIVSA-N 2 0 249.402 2.333 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H]2[C@H](C)CC[C@@H]2C)C1 ZINC000924706232 646093709 /nfs/dbraw/zinc/09/37/09/646093709.db2.gz PCLATHIVVHKISM-RFQIPJPRSA-N 2 0 224.392 2.352 20 0 BEADRP CCOCC[NH2+]C1CC[NH+](CCC(C)C)CC1 ZINC000924697475 646093793 /nfs/dbraw/zinc/09/37/93/646093793.db2.gz JIRGXNXQPZIEQN-UHFFFAOYSA-N 2 0 242.407 2.123 20 0 BEADRP CC1CC(C[N@@H+]2CC[C@H](C[NH+]3CCCC3)C2)C1 ZINC000929696384 646251793 /nfs/dbraw/zinc/25/17/93/646251793.db2.gz LXVZALDTUQWOBI-SHARSMKWSA-N 2 0 236.403 2.450 20 0 BEADRP CC1(C)C[C@@H]([NH2+]C[C@H]2CCCCO2)C[C@@H]([NH3+])C1 ZINC000925477558 646290123 /nfs/dbraw/zinc/29/01/23/646290123.db2.gz BUJKYPMOGHAOLB-FRRDWIJNSA-N 2 0 240.391 2.051 20 0 BEADRP CCOCCCC[NH2+][C@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925482646 646294980 /nfs/dbraw/zinc/29/49/80/646294980.db2.gz WUZFEQSJXFCPPQ-STQMWFEESA-N 2 0 242.407 2.299 20 0 BEADRP CC1(C)C[C@@H]([NH3+])C[C@@H]([NH2+]Cc2cccnc2)C1 ZINC000925494069 646301643 /nfs/dbraw/zinc/30/16/43/646301643.db2.gz MZNDAPHUPGHAGB-QWHCGFSZSA-N 2 0 233.359 2.077 20 0 BEADRP CSC[C@H](C)[NH2+][C@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925505291 646307023 /nfs/dbraw/zinc/30/70/23/646307023.db2.gz QFTLKPJJICWUMD-DCAQKATOSA-N 2 0 230.421 2.234 20 0 BEADRP CC(C)OCCC[NH2+][C@@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925506838 646308058 /nfs/dbraw/zinc/30/80/58/646308058.db2.gz SLIITLHEKYRRIC-QWHCGFSZSA-N 2 0 242.407 2.297 20 0 BEADRP CC(C)OCCC[NH2+][C@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925506839 646309384 /nfs/dbraw/zinc/30/93/84/646309384.db2.gz SLIITLHEKYRRIC-STQMWFEESA-N 2 0 242.407 2.297 20 0 BEADRP Cc1cc(C[NH2+][C@H]2C[C@H]([NH3+])C23CCC3)ccc1F ZINC000925512663 646311058 /nfs/dbraw/zinc/31/10/58/646311058.db2.gz AHGMPEWKLXOJLS-KBPBESRZSA-N 2 0 248.345 2.494 20 0 BEADRP CCCCOCC[NH2+][C@@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925517934 646312823 /nfs/dbraw/zinc/31/28/23/646312823.db2.gz CPRFUSXIAHRVBL-CHWSQXEVSA-N 2 0 242.407 2.299 20 0 BEADRP CC[C@H]([NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2)c1ccncc1 ZINC000925520032 646313561 /nfs/dbraw/zinc/31/35/61/646313561.db2.gz DUBCXRUJZBAUJH-BFHYXJOUSA-N 2 0 245.370 2.392 20 0 BEADRP CCO[C@@H](CC[NH2+][C@@H]1CC[NH2+]C1(C)C)C(C)C ZINC000925526704 646317919 /nfs/dbraw/zinc/31/79/19/646317919.db2.gz KDKLDZSHVNVRHO-QWHCGFSZSA-N 2 0 242.407 2.168 20 0 BEADRP CC1(C)C[C@H]([NH3+])C[C@@H]([NH2+]CC[C@@H]2CCCO2)C1 ZINC000925537674 646322190 /nfs/dbraw/zinc/32/21/90/646322190.db2.gz ZYPYMOBCBXRZJK-UPJWGTAASA-N 2 0 240.391 2.051 20 0 BEADRP C([NH2+][C@@H]1CC[NH2+]C12CCCC2)[C@@H]1CCCS1 ZINC000925553540 646331537 /nfs/dbraw/zinc/33/15/37/646331537.db2.gz TZOVXHUKRDYFJP-NWDGAFQWSA-N 2 0 240.416 2.146 20 0 BEADRP C([NH2+][C@H]1CC[NH2+]C12CCCC2)[C@H]1CCCS1 ZINC000925553539 646332294 /nfs/dbraw/zinc/33/22/94/646332294.db2.gz TZOVXHUKRDYFJP-NEPJUHHUSA-N 2 0 240.416 2.146 20 0 BEADRP CCOCC[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000925560706 646335103 /nfs/dbraw/zinc/33/51/03/646335103.db2.gz GTPJIIVVTFMLIK-CQSZACIVSA-N 2 0 236.359 2.093 20 0 BEADRP CC1(C)C[C@H]([NH3+])C[C@@H]([NH2+]CCC2CC2)C1 ZINC000925572232 646339218 /nfs/dbraw/zinc/33/92/18/646339218.db2.gz HHPQKCWIMSDUMK-VXGBXAGGSA-N 2 0 210.365 2.282 20 0 BEADRP CC1(C)C[C@@H]([NH3+])C[C@H]([NH2+]CCC2CC2)C1 ZINC000925572231 646339772 /nfs/dbraw/zinc/33/97/72/646339772.db2.gz HHPQKCWIMSDUMK-RYUDHWBXSA-N 2 0 210.365 2.282 20 0 BEADRP CC1(C[NH2+][C@@H]2CC[NH2+]C23CCCC3)CCC1 ZINC000925581560 646344751 /nfs/dbraw/zinc/34/47/51/646344751.db2.gz ZYMDDVZRYKINTR-GFCCVEGCSA-N 2 0 222.376 2.441 20 0 BEADRP CC1(C[NH2+][C@H]2CC[NH2+]C23CCCC3)CCC1 ZINC000925581563 646345255 /nfs/dbraw/zinc/34/52/55/646345255.db2.gz ZYMDDVZRYKINTR-LBPRGKRZSA-N 2 0 222.376 2.441 20 0 BEADRP CC1(C)C[C@@H]([NH3+])C[C@@H]([NH2+]C2CCSCC2)C1 ZINC000925592901 646349037 /nfs/dbraw/zinc/34/90/37/646349037.db2.gz ZNFLNYAIRSJMIV-CMPLNLGQSA-N 2 0 242.432 2.378 20 0 BEADRP C([NH2+][C@H]1CC[NH2+]C12CCC2)C1(C2CC2)CC1 ZINC000925589807 646349341 /nfs/dbraw/zinc/34/93/41/646349341.db2.gz KSDBELAFISKIMY-LBPRGKRZSA-N 2 0 220.360 2.051 20 0 BEADRP CC1(C[NH2+][C@@H]2CC[NH2+]C23CCC3)CCCC1 ZINC000925596294 646351024 /nfs/dbraw/zinc/35/10/24/646351024.db2.gz SARBIOKAQUBLQD-GFCCVEGCSA-N 2 0 222.376 2.441 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C)C1 ZINC000929847668 646359437 /nfs/dbraw/zinc/35/94/37/646359437.db2.gz NAJZWNJBDDSNHV-APIJFGDWSA-N 2 0 236.403 2.449 20 0 BEADRP CCC[C@](C)(O)C[NH2+][C@@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925613633 646363561 /nfs/dbraw/zinc/36/35/61/646363561.db2.gz UKUFGCZKXOZKKR-SCRDCRAPSA-N 2 0 242.407 2.033 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@H]([NH3+])CC(C)(C)C2)CCO1 ZINC000925632216 646375672 /nfs/dbraw/zinc/37/56/72/646375672.db2.gz VPRVQWRGANJTTL-YVECIDJPSA-N 2 0 240.391 2.050 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2C[C@@H]([NH3+])CC(C)(C)C2)CCO1 ZINC000925632207 646376975 /nfs/dbraw/zinc/37/69/75/646376975.db2.gz VPRVQWRGANJTTL-LPWJVIDDSA-N 2 0 240.391 2.050 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@H]2CC[NH2+]C23CCCC3)C1 ZINC000925645350 646387557 /nfs/dbraw/zinc/38/75/57/646387557.db2.gz PXMVEHXUXOAJPJ-AGIUHOORSA-N 2 0 222.376 2.439 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]C[C@@H]2CCC(F)(F)C2)C12CCC2 ZINC000925654652 646389419 /nfs/dbraw/zinc/38/94/19/646389419.db2.gz HAZJUJYYMUDWBV-GMTAPVOTSA-N 2 0 244.329 2.281 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]C[C@H]2CCC(F)(F)C2)C12CCC2 ZINC000925654653 646390495 /nfs/dbraw/zinc/39/04/95/646390495.db2.gz HAZJUJYYMUDWBV-HBNTYKKESA-N 2 0 244.329 2.281 20 0 BEADRP CC(C)SCCN[C@@H]1CC[NH2+]C12CCCC2 ZINC000925672188 646403415 /nfs/dbraw/zinc/40/34/15/646403415.db2.gz TZAVHEKCSMJXMM-GFCCVEGCSA-N 2 0 242.432 2.392 20 0 BEADRP C1[C@@H]2[C@H]1CCC[C@@H]2[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000925686003 646413082 /nfs/dbraw/zinc/41/30/82/646413082.db2.gz PGSMOFJSPHHLRY-QNWHQSFQSA-N 2 0 220.360 2.049 20 0 BEADRP C[C@H]1[C@H]2CC[C@@H](C[C@@H]1[NH2+][C@@H]1CCCC[C@H]1F)[NH2+]2 ZINC000925687669 646414397 /nfs/dbraw/zinc/41/43/97/646414397.db2.gz BJQKLKFLGOSPGD-KKKKKVIPSA-N 2 0 240.366 2.386 20 0 BEADRP CC(C)C[C@@H]1C[C@H]1[NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23 ZINC000925690982 646415923 /nfs/dbraw/zinc/41/59/23/646415923.db2.gz HNRLFGUSKCEOSG-NKHBCJIASA-N 2 0 234.387 2.007 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000925694253 646419340 /nfs/dbraw/zinc/41/93/40/646419340.db2.gz RMJOVGIIRFCWRO-HUUCEWRRSA-N 3 0 249.402 2.040 20 0 BEADRP CC1(C)[C@H](CN[C@@H]2CC[NH2+]C2(C)C)C1(F)F ZINC000925704200 646427285 /nfs/dbraw/zinc/42/72/85/646427285.db2.gz CJOLHHNAQTZIID-DTWKUNHWSA-N 2 0 232.318 2.008 20 0 BEADRP CC1(C)[C@H](C[NH2+][C@@H]2C[C@@H]([NH3+])C23CCC3)C1(F)F ZINC000925706541 646430297 /nfs/dbraw/zinc/43/02/97/646430297.db2.gz LLTUUONSHAUPFU-IVZWLZJFSA-N 2 0 244.329 2.137 20 0 BEADRP CC1(C)[C@H]([NH2+][C@@H]2C[C@H]3C[C@H]3C2)[C@@H]2CCC[NH2+][C@@H]21 ZINC000925708052 646432451 /nfs/dbraw/zinc/43/24/51/646432451.db2.gz RCJKCVXVUJPJDT-CLHCLYRXSA-N 2 0 234.387 2.151 20 0 BEADRP C1=C[C@H]([NH2+][C@@H]2CC[NH2+]C[C@H]2C2CCCC2)CC1 ZINC000925708681 646432725 /nfs/dbraw/zinc/43/27/25/646432725.db2.gz CZMUKHXBKTXYQL-SOUVJXGZSA-N 2 0 234.387 2.463 20 0 BEADRP C1[C@H]2CC[C@@H]([NH2+][C@H]3CC[NH2+]C34CCCC4)C[C@@H]12 ZINC000925712834 646435657 /nfs/dbraw/zinc/43/56/57/646435657.db2.gz PXLRZQPAPITWQF-SYQHCUMBSA-N 2 0 234.387 2.439 20 0 BEADRP C[C@@H](C[NH2+][C@@H]1CC[NH2+]C1(C)C)CC(F)F ZINC000925713828 646437943 /nfs/dbraw/zinc/43/79/43/646437943.db2.gz UTVAEGQRLCSJKK-RKDXNWHRSA-N 2 0 220.307 2.008 20 0 BEADRP CC1(C)C[C@@H]([NH3+])C[C@H]([NH2+]Cc2cccc(N)c2)C1 ZINC000925714675 646438134 /nfs/dbraw/zinc/43/81/34/646438134.db2.gz USGLLNWVXHBYMA-KBPBESRZSA-N 2 0 247.386 2.264 20 0 BEADRP CC(C)([NH3+])CC[NH2+][C@@H]1CCC[C@H]1CCF ZINC000925736838 646439019 /nfs/dbraw/zinc/43/90/19/646439019.db2.gz CVYIJPNLVIMBHS-WDEREUQCSA-N 2 0 216.344 2.232 20 0 BEADRP CC1(C)C[C@@H]([NH3+])C[C@@H]([NH2+]Cc2cccc(N)c2)C1 ZINC000925714677 646439586 /nfs/dbraw/zinc/43/95/86/646439586.db2.gz USGLLNWVXHBYMA-UONOGXRCSA-N 2 0 247.386 2.264 20 0 BEADRP CC(C)[C@H]([NH3+])CCN[C@H](c1ccccc1)[C@H](C)[NH3+] ZINC000925715794 646440983 /nfs/dbraw/zinc/44/09/83/646440983.db2.gz MERUTFAAGIXRAR-CFVMTHIKSA-N 2 0 249.402 2.038 20 0 BEADRP [NH3+]C1C[C@H]2CCC[C@@H](C1)C2[NH2+]C[C@H]1C=CCC1 ZINC000925729880 646453616 /nfs/dbraw/zinc/45/36/16/646453616.db2.gz ACVDKLFJHSTBTA-XDYZINJXSA-N 2 0 234.387 2.448 20 0 BEADRP C1=C[C@H](C[NH2+][C@@H]2CC[NH2+]C23CCCC3)CC1 ZINC000925732612 646455750 /nfs/dbraw/zinc/45/57/50/646455750.db2.gz QHPGUUBZNSZQBG-QWHCGFSZSA-N 2 0 220.360 2.217 20 0 BEADRP C1=C[C@H](C[NH2+][C@H]2CC[NH2+]C23CCCC3)CC1 ZINC000925732614 646456617 /nfs/dbraw/zinc/45/66/17/646456617.db2.gz QHPGUUBZNSZQBG-STQMWFEESA-N 2 0 220.360 2.217 20 0 BEADRP CC1(C[NH2+][C@@H]2CC[NH2+]C2(C)C)CC(F)(F)C1 ZINC000925732808 646457020 /nfs/dbraw/zinc/45/70/20/646457020.db2.gz DFGKAKCDGPXWBC-SECBINFHSA-N 2 0 232.318 2.152 20 0 BEADRP C([NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23)C1(CC2CC2)CC1 ZINC000925735317 646457865 /nfs/dbraw/zinc/45/78/65/646457865.db2.gz ZACGWEFIVLPSOO-XPABHHOTSA-N 2 0 246.398 2.153 20 0 BEADRP C[C@H]([NH2+]CC1(CC2CC2)CC1)[C@H]1CC[NH2+]C1 ZINC000925734770 646458696 /nfs/dbraw/zinc/45/86/96/646458696.db2.gz ULQYAGSBJKCRBV-AAEUAGOBSA-N 2 0 222.376 2.154 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]CC2(CC3CC3)CC2)C12CCC2 ZINC000925733896 646459143 /nfs/dbraw/zinc/45/91/43/646459143.db2.gz MMXYDFHEUZTNNE-CHWSQXEVSA-N 2 0 234.387 2.426 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CCCC1(F)F)[C@@H]1CC[NH2+]C1 ZINC000925736282 646461195 /nfs/dbraw/zinc/46/11/95/646461195.db2.gz LDMKKKPMJLVIPF-TUAOUCFPSA-N 2 0 246.345 2.400 20 0 BEADRP CC(C)([NH3+])CC[NH2+][C@H]1CCCc2cccnc21 ZINC000925739593 646461667 /nfs/dbraw/zinc/46/16/67/646461667.db2.gz ZSGTUFHYPLZYLH-LBPRGKRZSA-N 2 0 233.359 2.176 20 0 BEADRP CCO[C@H]1C[C@H]([NH2+]CCC(C)(C)[NH3+])C12CCC2 ZINC000925741822 646461680 /nfs/dbraw/zinc/46/16/80/646461680.db2.gz NQCFZMDBNFHPOA-RYUDHWBXSA-N 2 0 240.391 2.051 20 0 BEADRP CC[C@H]1CC[C@@H]1[NH+]1CCC([NH3+])(CC)CC1 ZINC000925759824 646464779 /nfs/dbraw/zinc/46/47/79/646464779.db2.gz MHJRXOHHMVLSRR-RYUDHWBXSA-N 2 0 210.365 2.378 20 0 BEADRP CCC1([NH3+])CC[NH+]([C@@H](C)[C@@H]2CCCOC2)CC1 ZINC000925760068 646467143 /nfs/dbraw/zinc/46/71/43/646467143.db2.gz NYPZGDLOKZACRF-QWHCGFSZSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@@H]1CCNC[C@H]1[NH2+][C@@H]1C[C@@H]2CCCC[C@H]12 ZINC000925766988 646469030 /nfs/dbraw/zinc/46/90/30/646469030.db2.gz VVMXYDIAEFFGTG-MBJXGIAVSA-N 2 0 222.376 2.153 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1C[NH2+]CCC1(F)F)[C@H]1C[C@H]1C ZINC000925778304 646475425 /nfs/dbraw/zinc/47/54/25/646475425.db2.gz SIWZECZXXKHIST-RHYQMDGZSA-N 2 0 246.345 2.255 20 0 BEADRP C1=CCCC([NH2+][C@@H]2CC[NH2+]C23CCC3)CC1 ZINC000925778890 646476781 /nfs/dbraw/zinc/47/67/81/646476781.db2.gz GXRUSBWVMKTMTP-CYBMUJFWSA-N 2 0 220.360 2.359 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[NH2+]CCC1(F)F)C(C)(C)C ZINC000925782556 646478664 /nfs/dbraw/zinc/47/86/64/646478664.db2.gz MDIOORUXLHIHJE-NXEZZACHSA-N 2 0 234.334 2.255 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+]C1CCC(C(F)F)CC1 ZINC000925782044 646479309 /nfs/dbraw/zinc/47/93/09/646479309.db2.gz CIHNHAMYPFDKJE-AGVGLQIMSA-N 2 0 232.318 2.008 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@H](C1CC1)C1CCCC1 ZINC000925783478 646479919 /nfs/dbraw/zinc/47/99/19/646479919.db2.gz CMEPNGVIPKALPF-UGFHNGPFSA-N 2 0 236.403 2.400 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@H]1CCC[C@@H]1CCCF ZINC000925786506 646483006 /nfs/dbraw/zinc/48/30/06/646483006.db2.gz SXEAPMUTDJAXSM-MQYQWHSLSA-N 2 0 242.382 2.350 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1C[NH2+]C[C@H]1C)c1ccsc1 ZINC000925790906 646485406 /nfs/dbraw/zinc/48/54/06/646485406.db2.gz MYNGBPXYYKSTFX-SCVCMEIPSA-N 2 0 224.373 2.254 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1C[NH2+]C[C@H]1C)c1cccc(F)c1 ZINC000925790044 646485496 /nfs/dbraw/zinc/48/54/96/646485496.db2.gz FKWWYWOBYUHRJD-WZRBSPASSA-N 2 0 236.334 2.332 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+]CC1C[C@H]2CC[C@@H](C1)S2 ZINC000925801501 646486937 /nfs/dbraw/zinc/48/69/37/646486937.db2.gz KNUMQFBKDBSGNB-NTWDBFDFSA-N 2 0 240.416 2.130 20 0 BEADRP C[C@@H]([NH2+]CCC1(c2ccccc2)CC1)C1C[NH2+]C1 ZINC000925804652 646488493 /nfs/dbraw/zinc/48/84/93/646488493.db2.gz LQJDQQQSTYTZDC-CYBMUJFWSA-N 2 0 244.382 2.306 20 0 BEADRP CC(C)[C@H]1CC[C@@H]1[NH2+]CC[C@@H]1C[NH2+]C[C@H]1C ZINC000925803630 646488763 /nfs/dbraw/zinc/48/87/63/646488763.db2.gz SFCWWGYSZRCKNX-SYQHCUMBSA-N 2 0 224.392 2.256 20 0 BEADRP C[C@H]([NH2+]CCC1(c2ccccc2)CC1)C1C[NH2+]C1 ZINC000925804653 646489012 /nfs/dbraw/zinc/48/90/12/646489012.db2.gz LQJDQQQSTYTZDC-ZDUSSCGKSA-N 2 0 244.382 2.306 20 0 BEADRP C[C@@H]1C[C@H]1[C@@H]1C[C@H]1[NH2+][C@H]1CCCCC[C@H]1[NH3+] ZINC000925821269 646495208 /nfs/dbraw/zinc/49/52/08/646495208.db2.gz GMBKOXDWWHSLLD-IKKURHKOSA-N 2 0 222.376 2.281 20 0 BEADRP C[C@@H]1C[C@H]1[C@@H]1C[C@H]1[NH2+][C@H]1CCCCC[C@@H]1[NH3+] ZINC000925821270 646495300 /nfs/dbraw/zinc/49/53/00/646495300.db2.gz GMBKOXDWWHSLLD-NKTODWNOSA-N 2 0 222.376 2.281 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+]CCC1CC=CC1 ZINC000925830308 646501793 /nfs/dbraw/zinc/50/17/93/646501793.db2.gz CMCHGISUZHZGAR-GXTWGEPZSA-N 2 0 222.376 2.320 20 0 BEADRP C[C@H](CC1CC1)[NH2+]C[C@]12CCC[C@H]1[NH2+]CC2 ZINC000925840946 646506321 /nfs/dbraw/zinc/50/63/21/646506321.db2.gz FCSHUQQWMOXRSD-MRVWCRGKSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H]1CC[C@H]([NH2+]C[C@]23CCC[C@H]2[NH2+]CC3)C1 ZINC000925842329 646508475 /nfs/dbraw/zinc/50/84/75/646508475.db2.gz IYGVWFPYIKAIMZ-IGQOVBAYSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CC[NH2+]C2(C)C)CCS1 ZINC000925862036 646514614 /nfs/dbraw/zinc/51/46/14/646514614.db2.gz WKJKAGFQBWWDKN-MXWKQRLJSA-N 2 0 228.405 2.001 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+][C@@H]2CCCc3cccnc32)C1 ZINC000925871770 646523514 /nfs/dbraw/zinc/52/35/14/646523514.db2.gz HDHFVTKIZIWUNC-BFHYXJOUSA-N 2 0 245.370 2.319 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[NH2+][C@@H]2CCc3ccccc32)C1 ZINC000925877961 646527416 /nfs/dbraw/zinc/52/74/16/646527416.db2.gz ZSHXEGJZWSCQGS-NJZAAPMLSA-N 2 0 230.355 2.391 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]C[C@@H]2CC[C@H]([NH3+])C2)C1 ZINC000925877165 646527544 /nfs/dbraw/zinc/52/75/44/646527544.db2.gz NJLZAKPTJUXSMD-NDBYEHHHSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[NH2+][C@@H]2CCC23CCC3)C1 ZINC000925879389 646529103 /nfs/dbraw/zinc/52/91/03/646529103.db2.gz CWEUETAYJZJKCJ-QJPTWQEYSA-N 2 0 208.349 2.036 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+]C[C@]12C[C@H]1CCC2 ZINC000925882233 646531545 /nfs/dbraw/zinc/53/15/45/646531545.db2.gz ZWOBYHKENVCJPI-SYQHCUMBSA-N 2 0 222.376 2.284 20 0 BEADRP CC[C@H](C)[NH2+][C@H]1C[C@@](C[NH3+])(c2ccccc2)C1 ZINC000925887883 646533808 /nfs/dbraw/zinc/53/38/08/646533808.db2.gz OHZANILDWUIHNE-AEGPPILISA-N 2 0 232.371 2.434 20 0 BEADRP C[C@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1ncco1 ZINC000926114611 646575720 /nfs/dbraw/zinc/57/57/20/646575720.db2.gz PNTIQTDCVRVKFR-NSHDSACASA-N 2 0 237.347 2.057 20 0 BEADRP C[N@H+]1C[C@H]2CC[C@@H](C1)C2[NH2+][C@H]1CC12CCCC2 ZINC000926284493 646611283 /nfs/dbraw/zinc/61/12/83/646611283.db2.gz LYKUTIWGPKTACH-WJLOJVBCSA-N 2 0 234.387 2.249 20 0 BEADRP CC(C)N(C)C[C@@H](C)[NH2+][C@H](C)Cc1ccccn1 ZINC000926451170 646642013 /nfs/dbraw/zinc/64/20/13/646642013.db2.gz WRCBVUJKTZVIRO-ZIAGYGMSSA-N 2 0 249.402 2.331 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]CCC1CC=CC1 ZINC000724200691 711569019 /nfs/dbraw/zinc/56/90/19/711569019.db2.gz PVVAMQJWJUCGMC-STQMWFEESA-N 2 0 208.349 2.060 20 0 BEADRP CC(C)C[C@H]1CCC[N@@H+]1C[C@@H]([NH3+])CC(F)F ZINC000396964930 711704550 /nfs/dbraw/zinc/70/45/50/711704550.db2.gz DCDFVDCNAOAGQH-WDEREUQCSA-N 2 0 234.334 2.479 20 0 BEADRP CC[C@@H]1C[C@H](C)C[N@@H+]1C[C@H]([NH3+])CC(F)F ZINC000399143538 711744279 /nfs/dbraw/zinc/74/42/79/711744279.db2.gz CNVXJPQJMMCOLJ-IVZWLZJFSA-N 2 0 220.307 2.089 20 0 BEADRP C[N@H+](CCC[NH2+]C1CC1)CCC(C)(C)C ZINC000399883920 711763054 /nfs/dbraw/zinc/76/30/54/711763054.db2.gz ICTGJTKPJLHJBN-UHFFFAOYSA-N 2 0 212.381 2.497 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]CCC1CCC1 ZINC000229077826 711837522 /nfs/dbraw/zinc/83/75/22/711837522.db2.gz GEQFMEZOYWFATQ-STQMWFEESA-N 2 0 210.365 2.284 20 0 BEADRP CC1(C)C[C@]1(C)C[NH2+][C@H]1CCC[C@@H]1C[NH3+] ZINC000701983933 712034590 /nfs/dbraw/zinc/03/45/90/712034590.db2.gz IZONWNBNWQMXKO-NTZNESFSSA-N 2 0 210.365 2.140 20 0 BEADRP C[C@H](F)CC[NH2+][C@@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C ZINC000702647796 712058770 /nfs/dbraw/zinc/05/87/70/712058770.db2.gz WHOKHOSMUFMGFY-WHOHXGKFSA-N 2 0 228.355 2.101 20 0 BEADRP CCC[C@H](C[NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2)OCC ZINC000705378632 712130183 /nfs/dbraw/zinc/13/01/83/712130183.db2.gz YTUHMTNIGDNSSE-JHJVBQTASA-N 2 0 240.391 2.051 20 0 BEADRP CSC1CC([NH2+][C@@H]2CC[N@@H+]3CCCC[C@H]23)C1 ZINC000706929081 712161668 /nfs/dbraw/zinc/16/16/68/712161668.db2.gz OTPLVKLXKORXCO-FIYWTHMPSA-N 2 0 240.416 2.097 20 0 BEADRP C[C@H]1CCC[N@@H+]1Cc1cc2c(s1)CC[NH2+]C2 ZINC000710945046 712267235 /nfs/dbraw/zinc/26/72/35/712267235.db2.gz UWRHUJWSRSWKCQ-JTQLQIEISA-N 2 0 236.384 2.378 20 0 BEADRP FC[C@@H]1CC[N@H+](CCCC2CC[NH2+]CC2)C1 ZINC000711454915 712303809 /nfs/dbraw/zinc/30/38/09/712303809.db2.gz OSCAFIMHHZXQCK-ZDUSSCGKSA-N 2 0 228.355 2.058 20 0 BEADRP CC(C)(C)[C@@H]1C[C@H]1[N@@H+]1CC[C@@H](CC[NH3+])C1 ZINC000923479477 712334387 /nfs/dbraw/zinc/33/43/87/712334387.db2.gz PPLYVMANKANESH-IJLUTSLNSA-N 2 0 210.365 2.092 20 0 BEADRP C[C@H]1C[N@H+](CC[C@@H]2C[C@H]2C2CC2)CC[C@H]1[NH3+] ZINC000712690929 712448307 /nfs/dbraw/zinc/44/83/07/712448307.db2.gz FYKJAEPDHAXNHX-AHLTXXRQSA-N 2 0 222.376 2.092 20 0 BEADRP C=C/C=C\CC[NH2+][C@@H]1CC[NH2+]CC1(C)C ZINC000713464414 712460637 /nfs/dbraw/zinc/46/06/37/712460637.db2.gz JSGYHVNZIVNYSQ-FOQNGQEVSA-N 2 0 208.349 2.096 20 0 BEADRP C[C@@H]1C[C@@H]([NH3+])CC[N@@H+]1C[C@H]1CCC(C)(C)CO1 ZINC000713583870 712465899 /nfs/dbraw/zinc/46/58/99/712465899.db2.gz BITKUTMHQNPWJR-FRRDWIJNSA-N 2 0 240.391 2.003 20 0 BEADRP C=C/C=C/CC[NH+]1CCC(C[NH2+]CC)CC1 ZINC000713740734 712470617 /nfs/dbraw/zinc/47/06/17/712470617.db2.gz QNDSFWLCPXYEBC-AATRIKPKSA-N 2 0 222.376 2.440 20 0 BEADRP C=C/C=C/CC[NH+]1CCC(CC[NH3+])CC1 ZINC000713729628 712470841 /nfs/dbraw/zinc/47/08/41/712470841.db2.gz BNIZGWZIBUTFML-ONEGZZNKSA-N 2 0 208.349 2.180 20 0 BEADRP C=C/C=C\CC[NH2+]C1CC[NH+](CC)CC1 ZINC000713757622 712471628 /nfs/dbraw/zinc/47/16/28/712471628.db2.gz KJUXPUXKCVBKFB-WAYWQWQTSA-N 2 0 208.349 2.193 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CC[N@H+](C[C@H]2CCCC(C)(C)O2)C1 ZINC000714375478 712484557 /nfs/dbraw/zinc/48/45/57/712484557.db2.gz UFDZXQYYZGCQHZ-YNEHKIRRSA-N 2 0 240.391 2.003 20 0 BEADRP C[N@H+](CCCCCCC[NH3+])Cc1cccnc1 ZINC000036771377 712494672 /nfs/dbraw/zinc/49/46/72/712494672.db2.gz FOLMIIWZECRZIP-UHFFFAOYSA-N 2 0 235.375 2.423 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@H]1[C@H]1C[C@H]1C)[C@@H]1CCC[NH2+]1 ZINC000716528239 712567206 /nfs/dbraw/zinc/56/72/06/712567206.db2.gz DIGXXSRXGWHEFE-WZBKEBKWSA-N 2 0 222.376 2.009 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@H]2CC[C@H]2C)CC1 ZINC000380034510 712683437 /nfs/dbraw/zinc/68/34/37/712683437.db2.gz RKILNQSHPJWLOO-YPMHNXCESA-N 2 0 210.365 2.106 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]C2CCC=CCC2)C12CCC2 ZINC000718132535 712747122 /nfs/dbraw/zinc/74/71/22/712747122.db2.gz BREHLTWLBPUADO-CHWSQXEVSA-N 2 0 220.360 2.345 20 0 BEADRP CC[C@@H]1C[N@H+](CCCC(C)(F)F)CC[C@H]1[NH3+] ZINC000718709708 712777759 /nfs/dbraw/zinc/77/77/59/712777759.db2.gz UZEIRUQDIMJTKU-GHMZBOCLSA-N 2 0 234.334 2.481 20 0 BEADRP C[C@H]([NH3+])[C@H]1CCC[N@H+](CCCC(C)(F)F)C1 ZINC000718710780 712777929 /nfs/dbraw/zinc/77/79/29/712777929.db2.gz XXMGTYVCLJURJV-QWRGUYRKSA-N 2 0 234.334 2.481 20 0 BEADRP COCC(C)(C)CC[NH2+][C@@H]1CCCC[C@H]1C[NH3+] ZINC000718669126 712776728 /nfs/dbraw/zinc/77/67/28/712776728.db2.gz YWBVHJRVHODQQG-QWHCGFSZSA-N 2 0 242.407 2.156 20 0 BEADRP CO[C@H]1CCC[C@H]([NH2+]C2CC([NH+](C)C)C2)CC1 ZINC000718823688 712784192 /nfs/dbraw/zinc/78/41/92/712784192.db2.gz IPKOKMSZBGTIHK-ABXWRUBCSA-N 2 0 240.391 2.016 20 0 BEADRP CCO[C@@H]1CCC[C@H]([NH2+]C[C@H](C)C[NH+](C)C)C1 ZINC000721169347 712894184 /nfs/dbraw/zinc/89/41/84/712894184.db2.gz VUBCFCHTTMXQQO-MELADBBJSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H]1CC[C@H]1[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000381318694 710622843 /nfs/dbraw/zinc/62/28/43/710622843.db2.gz NYQQCAIKKDGFMD-GFJIZPEISA-N 2 0 222.376 2.391 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[N@H+]2C[C@@H]3CC=CC[C@@H]3C2)C1 ZINC000381543546 710653938 /nfs/dbraw/zinc/65/39/38/710653938.db2.gz JBNKMNOIQKRURG-IGQOVBAYSA-N 2 0 220.360 2.012 20 0 BEADRP CC[C@@H]1[C@H](C)CC[N@@H+]1C[C@@H]([NH3+])CC(F)F ZINC000384159231 710671881 /nfs/dbraw/zinc/67/18/81/710671881.db2.gz MZQJUPGTUNZOCV-KXUCPTDWSA-N 2 0 220.307 2.089 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+]Cc1ccsc1 ZINC000722521049 710715628 /nfs/dbraw/zinc/71/56/28/710715628.db2.gz NHXYDSIYGVLILN-ZYHUDNBSSA-N 2 0 224.373 2.083 20 0 BEADRP C[C@@H]1[C@H](C)OCC[N@@H+]1CCCCCCC[NH3+] ZINC000380492807 712901455 /nfs/dbraw/zinc/90/14/55/712901455.db2.gz AYTFQNFSUKSUIY-OLZOCXBDSA-N 2 0 228.380 2.005 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC1(C)C)C1CC[NH+](C)CC1 ZINC000380540992 712901657 /nfs/dbraw/zinc/90/16/57/712901657.db2.gz HECBPOITASSMBH-WCQYABFASA-N 2 0 224.392 2.495 20 0 BEADRP CC[C@@H]1[C@@H](C)CC[N@@H+]1C[C@H]([NH3+])CC(F)F ZINC000384159225 710990716 /nfs/dbraw/zinc/99/07/16/710990716.db2.gz MZQJUPGTUNZOCV-IVZWLZJFSA-N 2 0 220.307 2.089 20 0 BEADRP C[C@@H](C[N@@H+]1CC[C@H](CC[NH3+])C1)c1ccccc1 ZINC000385182909 711007152 /nfs/dbraw/zinc/00/71/52/711007152.db2.gz PIJJKLZRHSZHHV-KBPBESRZSA-N 2 0 232.371 2.461 20 0 BEADRP C[C@H]1CCSCC[N@@H+]1C[C@]1(C)CCC[NH2+]C1 ZINC000385583961 711014304 /nfs/dbraw/zinc/01/43/04/711014304.db2.gz XYKQVEMFCLBLRE-QWHCGFSZSA-N 2 0 242.432 2.204 20 0 BEADRP C[C@@H]([NH2+]CCC1CCC1)[C@H]1CCCC[NH2+]1 ZINC000386139955 711023701 /nfs/dbraw/zinc/02/37/01/711023701.db2.gz QGBISVJWMRZENV-DGCLKSJQSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]1C[N@H+](CCCC(C)(F)F)CC[C@@H]1[NH3+] ZINC000390067678 711104155 /nfs/dbraw/zinc/10/41/55/711104155.db2.gz DIHZGKAVIFLIAG-UWVGGRQHSA-N 2 0 220.307 2.091 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[C@@H]1C)C[NH+]1CCCCC1 ZINC000390459367 711118766 /nfs/dbraw/zinc/11/87/66/711118766.db2.gz BLSZFNDEDZPRQJ-HZSPNIEDSA-N 2 0 224.392 2.497 20 0 BEADRP CC[N@H+](C[C@@H]1CC[C@H]([NH3+])C1)[C@@H](C)C(C)C ZINC000390503924 711122185 /nfs/dbraw/zinc/12/21/85/711122185.db2.gz WBNIYYCVGDYJTA-XQQFMLRXSA-N 2 0 212.381 2.480 20 0 BEADRP C[C@H]1CC[N@H+](CCCC2CC2)C[C@H]1C[NH3+] ZINC000394668600 711196222 /nfs/dbraw/zinc/19/62/22/711196222.db2.gz RAZGDHCSDURKLG-WCQYABFASA-N 2 0 210.365 2.093 20 0 BEADRP C[C@H]([NH2+]Cc1ccc(CC[NH3+])cc1)C1CC1 ZINC000398003490 711399416 /nfs/dbraw/zinc/39/94/16/711399416.db2.gz XQXBRUBEFOBXTL-NSHDSACASA-N 2 0 218.344 2.076 20 0 BEADRP CC[C@@]1(C)CC[N@H+](C[C@@]2(C)CCC[NH2+]C2)C1 ZINC000399452877 711431120 /nfs/dbraw/zinc/43/11/20/711431120.db2.gz IVVJIJRYMFYLDA-KBPBESRZSA-N 2 0 224.392 2.498 20 0 BEADRP CC[C@]1(C)CC[N@H+](CCC[NH2+]C2CC2)C1 ZINC000399386475 711429031 /nfs/dbraw/zinc/42/90/31/711429031.db2.gz RJOVBKCXQDLUER-CYBMUJFWSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+][C@@H]1CC2CCC1CC2 ZINC000381123562 710603482 /nfs/dbraw/zinc/60/34/82/710603482.db2.gz JBCPNIBHPJYCHJ-GFJIZPEISA-N 2 0 224.392 2.495 20 0 BEADRP [NH3+]C1CC([NH2+]Cc2ccc(C(F)(F)F)cc2)C1 ZINC000133279933 710969232 /nfs/dbraw/zinc/96/92/32/710969232.db2.gz VHFNXIOAVGPLNT-UHFFFAOYSA-N 2 0 244.260 2.285 20 0 BEADRP [NH3+]C1CC([NH2+]Cc2cccc3ccccc32)C1 ZINC000133276119 710969399 /nfs/dbraw/zinc/96/93/99/710969399.db2.gz CJHPESILQXIRFR-UHFFFAOYSA-N 2 0 226.323 2.419 20 0 BEADRP C[C@H]([NH2+]C/C=C\Cl)C1CC[NH+](C)CC1 ZINC000396500009 711222658 /nfs/dbraw/zinc/22/26/58/711222658.db2.gz VFNUJBQLXIAZJM-NWPZZWLHSA-N 2 0 216.756 2.059 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](CCCC3CC3)C[C@@H]21 ZINC000394594340 711194857 /nfs/dbraw/zinc/19/48/57/711194857.db2.gz GCIREFZQGXBDIT-HZSPNIEDSA-N 2 0 222.376 2.236 20 0 BEADRP CC(C)C[N@H+](C)CCCCCCC[NH3+] ZINC000037108720 711465620 /nfs/dbraw/zinc/46/56/20/711465620.db2.gz ICLSYODWKFXYET-UHFFFAOYSA-N 2 0 200.370 2.483 20 0 BEADRP C[C@H]1CCC[C@@H](C[N@@H+]2C[C@@H]3C[NH2+]C[C@]3(C)C2)C1 ZINC000720795159 711483940 /nfs/dbraw/zinc/48/39/40/711483940.db2.gz MVRIKWFWDWIGGG-LJISPDSOSA-N 2 0 236.403 2.354 20 0 BEADRP C[C@H]1CCCC[N@H+](C[C@@H]2CC[C@H]([NH3+])C2)C1 ZINC000717904824 711492353 /nfs/dbraw/zinc/49/23/53/711492353.db2.gz IMMSKIBAOKVUFT-XQQFMLRXSA-N 2 0 210.365 2.236 20 0 BEADRP C=C/C=C/CC[N@H+]1CC[C@H](C)[C@@H](C[NH3+])C1 ZINC000713735229 711494269 /nfs/dbraw/zinc/49/42/69/711494269.db2.gz NIMNBNQVYKRJBF-WWKJKZQJSA-N 2 0 208.349 2.035 20 0 BEADRP Cc1ccsc1C[N@@H+]1CC[C@@H](CC[NH3+])C1 ZINC000723713251 711535709 /nfs/dbraw/zinc/53/57/09/711535709.db2.gz WJDPWDIABDUDNU-LLVKDONJSA-N 2 0 224.373 2.227 20 0 BEADRP C[C@@H]([NH2+]CCC1CC=CC1)[C@@H]1CCC[NH2+]1 ZINC000724127735 711563128 /nfs/dbraw/zinc/56/31/28/711563128.db2.gz ARGAEWGESUKRQY-YPMHNXCESA-N 2 0 208.349 2.073 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+]CCC1CC=CC1 ZINC000724203847 711569487 /nfs/dbraw/zinc/56/94/87/711569487.db2.gz VWZFYEKQMDPKCQ-ZIAGYGMSSA-N 2 0 222.376 2.450 20 0 BEADRP CO[C@@H]1CC[C@H]1[N@H+](C)CCCCCCC[NH3+] ZINC000724205273 711569508 /nfs/dbraw/zinc/56/95/08/711569508.db2.gz ADUPICYPVHOILN-CHWSQXEVSA-N 2 0 228.380 2.005 20 0 BEADRP CCc1ccccc1C[N@@H+]1CC[C@@H](C[NH3+])C1 ZINC000052204673 711607600 /nfs/dbraw/zinc/60/76/00/711607600.db2.gz MXNRFBFMXMYBMP-LBPRGKRZSA-N 2 0 218.344 2.030 20 0 BEADRP C[C@H]([NH2+]CCCC[N@H+](C)C1CC1)c1ccnnc1 ZINC000926559854 711646612 /nfs/dbraw/zinc/64/66/12/711646612.db2.gz PJHBOMFFVNAMPB-LBPRGKRZSA-N 2 0 248.374 2.002 20 0 BEADRP CCC1(C[NH2+][C@H]2[C@@H]3[NH2+]C[C@@H]4C[C@H]2C[C@@H]43)CCC1 ZINC000383102743 711668099 /nfs/dbraw/zinc/66/80/99/711668099.db2.gz CFQFWTULDQOANB-QSLWVIQJSA-N 2 0 234.387 2.153 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@@H](C)C(F)(F)F)CC1 ZINC000309473272 711698537 /nfs/dbraw/zinc/69/85/37/711698537.db2.gz RDLAQNWFCACMRT-SECBINFHSA-N 2 0 238.297 2.259 20 0 BEADRP C[C@]1(C[NH2+][C@@H]2C[C@@H]([NH3+])C23CCC3)C[C@H]2C[C@H]2C1 ZINC000925718600 711714581 /nfs/dbraw/zinc/71/45/81/711714581.db2.gz OBMCDVCBILEZCS-ITGHMWBKSA-N 2 0 234.387 2.282 20 0 BEADRP C(C1CCCC1)[N@@H+]1CC[C@]2(C1)CCCC[NH2+]2 ZINC000257644388 711721124 /nfs/dbraw/zinc/72/11/24/711721124.db2.gz BSCDKGGUBMQOAC-AWEZNQCLSA-N 2 0 222.376 2.395 20 0 BEADRP C[C@H]1[C@H]2CC[C@@H](C[C@H]1[NH2+][C@@H]1CCCC[C@@H]1F)[NH2+]2 ZINC000925724575 711728428 /nfs/dbraw/zinc/72/84/28/711728428.db2.gz BJQKLKFLGOSPGD-QEHJDLSMSA-N 2 0 240.366 2.386 20 0 BEADRP C[C@@H]1C[N@H+](CC2CCCCC2)C[C@H]1CC[NH3+] ZINC000723886284 711731103 /nfs/dbraw/zinc/73/11/03/711731103.db2.gz JLSXPPZIWDZSLZ-TZMCWYRMSA-N 2 0 224.392 2.483 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CC1CCC=CCC1 ZINC000925880063 711761862 /nfs/dbraw/zinc/76/18/62/711761862.db2.gz HBVTYMIDAOIMRM-NWDGAFQWSA-N 2 0 210.365 2.448 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+]C1C[C@H](C)C[C@@H](C)C1 ZINC000721903359 711813345 /nfs/dbraw/zinc/81/33/45/711813345.db2.gz ICJJBQHLXTUZHK-PRULPYPASA-N 2 0 210.365 2.009 20 0 BEADRP CC(C)C1(C[NH2+][C@@H]2CCC[NH2+]CC2)CC1 ZINC000232720330 711845472 /nfs/dbraw/zinc/84/54/72/711845472.db2.gz PHOHKZFTVYPFSV-GFCCVEGCSA-N 2 0 210.365 2.154 20 0 BEADRP C1CC1[C@@H]1CC[C@@H]1[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000530216509 711937776 /nfs/dbraw/zinc/93/77/76/711937776.db2.gz PYJSRPWPNRDONH-AVGNSLFASA-N 2 0 220.360 2.049 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000423373356 711958110 /nfs/dbraw/zinc/95/81/10/711958110.db2.gz RXTIOIBODATGPW-CYDGBPFRSA-N 2 0 210.365 2.281 20 0 BEADRP CSC[C@H]1CCC[N@@H+]1C[C@H]1CCCC[NH2+]C1 ZINC000700271376 711988825 /nfs/dbraw/zinc/98/88/25/711988825.db2.gz AVROYTOTEGKLJQ-QWHCGFSZSA-N 2 0 242.432 2.204 20 0 BEADRP C[C@H](CC1CCC1)[NH2+]CC[C@@H](C)[NH+](C)C ZINC000700456705 711995867 /nfs/dbraw/zinc/99/58/67/711995867.db2.gz WVQKSVYDLCIKBS-VXGBXAGGSA-N 2 0 212.381 2.495 20 0 BEADRP C[C@H](CC[NH2+][C@@H]1CCOC2(CCC2)C1)[NH+](C)C ZINC000700604724 712001197 /nfs/dbraw/zinc/00/11/97/712001197.db2.gz DSSNQQFXIJRZNK-CHWSQXEVSA-N 2 0 240.391 2.018 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]CCCC2CCC2)C12CCC2 ZINC000701771991 712028684 /nfs/dbraw/zinc/02/86/84/712028684.db2.gz LSUNUKKPDAVTEG-STQMWFEESA-N 2 0 222.376 2.426 20 0 BEADRP C[C@H]([NH2+]C[C@@]1(C)CC1(C)C)[C@H]1CCC[NH2+]1 ZINC000701943243 712032728 /nfs/dbraw/zinc/03/27/28/712032728.db2.gz ITSYDYRSSIATMW-DMDPSCGWSA-N 2 0 210.365 2.153 20 0 BEADRP CC1(C)C[C@]1(C)C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000701944895 712033261 /nfs/dbraw/zinc/03/32/61/712033261.db2.gz QINXLWHGKDHBMS-RMRHIDDWSA-N 2 0 236.403 2.400 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@@]2(C)CC2(C)C)CC[N@@H+]1C ZINC000701980780 712034737 /nfs/dbraw/zinc/03/47/37/712034737.db2.gz JZWZZYPDMXUBJA-YRGRVCCFSA-N 2 0 224.392 2.495 20 0 BEADRP CC(C)(C)CCC[N@@H+]1C[C@@H]2C[NH2+]C[C@]2(C)C1 ZINC000702052939 712037332 /nfs/dbraw/zinc/03/73/32/712037332.db2.gz DFPPMSMKFAOFBE-GXTWGEPZSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@H](c1ccccc1)[N@@H+]1C[C@@H]2C[NH2+]C[C@]2(C)C1 ZINC000703550691 712078901 /nfs/dbraw/zinc/07/89/01/712078901.db2.gz VKPANEBDKAUNQE-VHDGCEQUSA-N 2 0 230.355 2.289 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[N@@H+]1C[C@@H]2C[NH2+]C[C@]2(C)C1 ZINC000703603202 712081886 /nfs/dbraw/zinc/08/18/86/712081886.db2.gz QXZQGFANMWHGIB-APIJFGDWSA-N 2 0 236.403 2.354 20 0 BEADRP Cc1ccc(OCC[NH+]2CCC(C)([NH3+])CC2)cc1 ZINC000704597145 712112228 /nfs/dbraw/zinc/11/22/28/712112228.db2.gz OVGMQTUSVBPSDL-UHFFFAOYSA-N 2 0 248.370 2.187 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CCSC1)[C@H]1CCCC[NH2+]1 ZINC000704777803 712116083 /nfs/dbraw/zinc/11/60/83/712116083.db2.gz VKZNJWIWFXPVHS-YNEHKIRRSA-N 2 0 242.432 2.250 20 0 BEADRP CCC[C@H](C[NH2+][C@@H]1C[C@H]([NH3+])C12CCC2)OCC ZINC000705378631 712129819 /nfs/dbraw/zinc/12/98/19/712129819.db2.gz YTUHMTNIGDNSSE-FRRDWIJNSA-N 2 0 240.391 2.051 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]C[C@@H]2CCCC23CC3)C12CCC2 ZINC000706300034 712144582 /nfs/dbraw/zinc/14/45/82/712144582.db2.gz XPQVGXFPLBZOGX-YNEHKIRRSA-N 2 0 234.387 2.426 20 0 BEADRP CC[NH+](CC)CCC[NH2+]C1CC(SC)C1 ZINC000706916473 712158258 /nfs/dbraw/zinc/15/82/58/712158258.db2.gz HNOAZJCGIQVNRL-UHFFFAOYSA-N 2 0 230.421 2.202 20 0 BEADRP [NH3+]CCCCCCC[N@@H+]1CC[C@@]2(CCOC2)C1 ZINC000707211404 712167027 /nfs/dbraw/zinc/16/70/27/712167027.db2.gz BBQPYMWXJUBVEV-CQSZACIVSA-N 2 0 240.391 2.008 20 0 BEADRP C[N@H+](C[C@@H]1CC(C)(C)CO1)C1CCC([NH3+])CC1 ZINC000708330005 712187463 /nfs/dbraw/zinc/18/74/63/712187463.db2.gz FSQMDCFETCTSFH-BPCQOVAHSA-N 2 0 240.391 2.003 20 0 BEADRP C([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)[C@]12C[C@H]1CCCC2 ZINC000709427193 712221700 /nfs/dbraw/zinc/22/17/00/712221700.db2.gz SNUZKEWXRADLQA-YYJFMHSASA-N 2 0 234.387 2.439 20 0 BEADRP C[C@H](Cc1ccco1)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000709460895 712222252 /nfs/dbraw/zinc/22/22/52/712222252.db2.gz PPYXNLBLZKIZGU-FKJOKYEKSA-N 2 0 234.343 2.083 20 0 BEADRP CCCCC[N@@H+]1C[C@@H](C[NH3+])[C@H](C(F)(F)F)C1 ZINC000709796934 712227246 /nfs/dbraw/zinc/22/72/46/712227246.db2.gz ZVYWWTYZEJTZFG-NXEZZACHSA-N 2 0 238.297 2.246 20 0 BEADRP C(C[N@@H+]1CC[C@@]2(C1)CCC[NH2+]C2)C1CCC1 ZINC000709893427 712231163 /nfs/dbraw/zinc/23/11/63/712231163.db2.gz SNAKBFLABMTVCG-AWEZNQCLSA-N 2 0 222.376 2.252 20 0 BEADRP C[C@H](CC1CCC1)[NH2+]C[C@@H]1CC[C@H]([NH3+])C1 ZINC000710317922 712251451 /nfs/dbraw/zinc/25/14/51/712251451.db2.gz QLTGWAXPWQPQAB-RTXFEEFZSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@]12C[C@H]1CCC2 ZINC000710484916 712253661 /nfs/dbraw/zinc/25/36/61/712253661.db2.gz LPGIDAXFXOWDQZ-UPJWGTAASA-N 2 0 210.365 2.284 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@@H]2C[C@@H]3CC[C@@H](C3)C2)CC1 ZINC000711203061 712289204 /nfs/dbraw/zinc/28/92/04/712289204.db2.gz MIFLEZCRZBRFTF-QDMKHBRRSA-N 2 0 236.403 2.497 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H]2C[C@@H]3CC[C@@H](C3)C2)C1 ZINC000711205505 712289219 /nfs/dbraw/zinc/28/92/19/712289219.db2.gz YJMPRSZAUJJEDN-LXTVHRRPSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]C[C@H]1CCC(C)(C)CO1 ZINC000711389464 712296608 /nfs/dbraw/zinc/29/66/08/712296608.db2.gz IYXPHVZTYOGQJE-QWHCGFSZSA-N 2 0 242.407 2.299 20 0 BEADRP FC[C@@H]1CCC[N@H+](C[C@H]2CCCC[NH2+]C2)C1 ZINC000711440736 712300807 /nfs/dbraw/zinc/30/08/07/712300807.db2.gz FCTQBAYWJPTYNG-STQMWFEESA-N 2 0 228.355 2.058 20 0 BEADRP FC[C@@H]1CCC[N@H+](CC2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000711442183 712301029 /nfs/dbraw/zinc/30/10/29/712301029.db2.gz IORZAUXUQBILBP-FUDCBSFHSA-N 2 0 240.366 2.199 20 0 BEADRP FC[C@H]1CC[N@H+](Cc2cccc3c2CC[NH2+]C3)C1 ZINC000711512775 712308200 /nfs/dbraw/zinc/30/82/00/712308200.db2.gz JRBWJBSLZDFKDB-GFCCVEGCSA-N 2 0 248.345 2.124 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]C[C@@H]1C=CCC1 ZINC000711670428 712315989 /nfs/dbraw/zinc/31/59/89/712315989.db2.gz VGTOVEJDAHSAHF-AGIUHOORSA-N 2 0 208.349 2.060 20 0 BEADRP CCC[NH+]1CCC([NH2+]C[C@@H]2C=CCC2)CC1 ZINC000711730367 712320328 /nfs/dbraw/zinc/32/03/28/712320328.db2.gz OECQAMRBSHWFBF-CYBMUJFWSA-N 2 0 222.376 2.417 20 0 BEADRP C[C@@H]1c2sccc2CC[N@H+]1C[C@H]1CC[NH2+]C1 ZINC000712263438 712344968 /nfs/dbraw/zinc/34/49/68/712344968.db2.gz HMKZIFCVDRJGEU-MNOVXSKESA-N 2 0 236.384 2.277 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+]C[C@@H]1CCCCC[NH2+]1 ZINC000379789847 712399449 /nfs/dbraw/zinc/39/94/49/712399449.db2.gz IXOQCAZXQPKGDP-RYUDHWBXSA-N 2 0 210.365 2.297 20 0 BEADRP CC[N@@H+]1CC[C@@H]1CNc1nc2ccccc2[nH]1 ZINC000712581133 712433617 /nfs/dbraw/zinc/43/36/17/712433617.db2.gz UBNWIVBNGXFFFZ-SNVBAGLBSA-N 2 0 230.315 2.069 20 0 BEADRP Cc1cc(NC[C@@H]2CC[N@H+]2C)c2ccccc2[nH+]1 ZINC000712525125 712440893 /nfs/dbraw/zinc/44/08/93/712440893.db2.gz BKDBYXIFBPXPKK-LBPRGKRZSA-N 2 0 241.338 2.081 20 0 BEADRP C(C[C@@H]1C[C@H]1C1CC1)[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000712763802 712449378 /nfs/dbraw/zinc/44/93/78/712449378.db2.gz LBNAIDGTHYCZSR-LJIZCISZSA-N 2 0 248.414 2.400 20 0 BEADRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]CC[C@@H]1C[C@H]1C1CC1 ZINC000712751322 712449482 /nfs/dbraw/zinc/44/94/82/712449482.db2.gz RYJIZSMDSREMEA-YIYPIFLZSA-N 2 0 222.376 2.140 20 0 BEADRP CCCCC[N@@H+]1CC[NH2+]CCC12CCC2 ZINC000713167453 712453491 /nfs/dbraw/zinc/45/34/91/712453491.db2.gz IPVJKVABFPIKAU-UHFFFAOYSA-N 2 0 210.365 2.395 20 0 BEADRP C[C@@H]1C[C@H]([NH3+])CC[N@@H+]1C[C@H]1CCC(C)(C)CO1 ZINC000713583871 712466410 /nfs/dbraw/zinc/46/64/10/712466410.db2.gz BITKUTMHQNPWJR-JHJVBQTASA-N 2 0 240.391 2.003 20 0 BEADRP C=C/C=C\CC[NH+]1CCC([C@@H](C)[NH3+])CC1 ZINC000713705417 712469660 /nfs/dbraw/zinc/46/96/60/712469660.db2.gz XCISGBPRDPQBJQ-QMAVJUDZSA-N 2 0 208.349 2.178 20 0 BEADRP C=C/C=C\CC[N@H+]1CCC[C@H](C[NH2+]C)C1 ZINC000713737163 712470409 /nfs/dbraw/zinc/47/04/09/712470409.db2.gz ZSNTWEOBNXZUKP-DSYXLKISSA-N 2 0 208.349 2.050 20 0 BEADRP C=C/C=C\CC[N@H+]1CCC[C@@H](CC[NH3+])C1 ZINC000713729167 712470508 /nfs/dbraw/zinc/47/05/08/712470508.db2.gz AVBPUGFJUPAANG-SCOBNMCVSA-N 2 0 208.349 2.180 20 0 BEADRP C=C/C=C/CC[N@@H+]1C[C@H](C(F)(F)F)[C@@H](C[NH3+])C1 ZINC000713757104 712472039 /nfs/dbraw/zinc/47/20/39/712472039.db2.gz FPZHTRUUYRGFLX-SEUFLZDSSA-N 2 0 248.292 2.188 20 0 BEADRP CCC1([NH3+])CC[NH+](Cc2cccs2)CC1 ZINC000714756707 712497546 /nfs/dbraw/zinc/49/75/46/712497546.db2.gz MFTVUCLTLCKAKY-UHFFFAOYSA-N 2 0 224.373 2.451 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](CC[C@@H]3C[C@H]3C3CC3)C[C@@H]21 ZINC000714856068 712501729 /nfs/dbraw/zinc/50/17/29/712501729.db2.gz ARNQLCQEWQEYMJ-RBGFHDKUSA-N 2 0 248.414 2.482 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32 ZINC000388720997 712501877 /nfs/dbraw/zinc/50/18/77/712501877.db2.gz SKFSSVMVISYWEO-SRGUQECISA-N 2 0 234.387 2.151 20 0 BEADRP C(CC1CC1)CN1CCC[C@H]2C[NH2+]CC[C@H]21 ZINC000714998310 712503426 /nfs/dbraw/zinc/50/34/26/712503426.db2.gz FYCLRGAEUKYYSV-UONOGXRCSA-N 2 0 222.376 2.251 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1cc[nH]n1 ZINC000036900038 712513492 /nfs/dbraw/zinc/51/34/92/712513492.db2.gz AEBLOLAIKFKZGV-LBPRGKRZSA-N 2 0 238.379 2.010 20 0 BEADRP CO[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1 ZINC000715541799 712526603 /nfs/dbraw/zinc/52/66/03/712526603.db2.gz IOXRAMOWKZHGJM-ZOBORPQBSA-N 2 0 240.391 2.016 20 0 BEADRP C(C[C@@H]1CCCS1)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000715635050 712528441 /nfs/dbraw/zinc/52/84/41/712528441.db2.gz HUHXOEHUUYYNAG-HNGCFSAESA-N 2 0 240.416 2.145 20 0 BEADRP CC[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H]([NH+](C)C)C2)CO1 ZINC000715560759 712528971 /nfs/dbraw/zinc/52/89/71/712528971.db2.gz DSWDTWUOPPHTQA-XJFOESAGSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C2CCC(C)([NH+](C)C)CC2)CO1 ZINC000715569354 712529402 /nfs/dbraw/zinc/52/94/02/712529402.db2.gz APVRRMDCMLLDDL-ZIHBUVQPSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@H]1C[C@H]([NH2+]C2CCC(C)([NH+](C)C)CC2)CO1 ZINC000715569341 712529412 /nfs/dbraw/zinc/52/94/12/712529412.db2.gz APVRRMDCMLLDDL-AHPWVWPOSA-N 2 0 240.391 2.016 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]CC[C@H]2CCCS2)C12CCC2 ZINC000715659319 712529828 /nfs/dbraw/zinc/52/98/28/712529828.db2.gz NXFRDKYZUUKENN-IJLUTSLNSA-N 2 0 240.416 2.132 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CC[C@H]1CCCS1 ZINC000715753144 712531988 /nfs/dbraw/zinc/53/19/88/712531988.db2.gz JFBHJYHJZSGRDA-NWDGAFQWSA-N 2 0 230.421 2.379 20 0 BEADRP C[C@H]([NH2+]CCCCC1CC1)[C@@H]1CCC[NH2+]1 ZINC000716371505 712557101 /nfs/dbraw/zinc/55/71/01/712557101.db2.gz XJKORCAWCURDGN-AAEUAGOBSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1C[C@@H]1[C@H]1C[C@H]1C[NH2+]CC1CC[NH+](C)CC1 ZINC000716580245 712564044 /nfs/dbraw/zinc/56/40/44/712564044.db2.gz GHQBPYHCQFGLOE-UNQGMJICSA-N 2 0 236.403 2.210 20 0 BEADRP C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000716528147 712567108 /nfs/dbraw/zinc/56/71/08/712567108.db2.gz CMXWUNUGCUQNPL-MFYZAHMOSA-N 2 0 248.414 2.256 20 0 BEADRP C[C@@H]1C[C@@H]1[C@H]1C[C@H]1C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000716622809 712568189 /nfs/dbraw/zinc/56/81/89/712568189.db2.gz JMZLDYSGVHZZMN-VPVJGASFSA-N 2 0 248.414 2.493 20 0 BEADRP CC(C)C[C@@H](C)[NH2+]C[C@H]1C[NH2+]CCC1(F)F ZINC000717015805 712604605 /nfs/dbraw/zinc/60/46/05/712604605.db2.gz BQRUXEKCVOPOIO-GHMZBOCLSA-N 2 0 234.334 2.255 20 0 BEADRP C(C[C@@H]1CC[C@@H]2C[C@@H]21)[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000717027453 712609639 /nfs/dbraw/zinc/60/96/39/712609639.db2.gz NPNQBIDAHMDJEG-VIAGDVCTSA-N 2 0 248.414 2.400 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@@H]2CC3CCC2CC3)CC1 ZINC000379852509 712616864 /nfs/dbraw/zinc/61/68/64/712616864.db2.gz KTWBIJNDEIYRCX-PESDSKBTSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC[C@@H]2CC[C@H]3C[C@H]32)CC[N@@H+]1C ZINC000717097410 712630782 /nfs/dbraw/zinc/63/07/82/712630782.db2.gz OZWPQHSDTQBRGH-FQKPHLNHSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@@H]([N@H+](C)C[C@@H]1CC[C@H]([NH3+])C1)C1(C)CC1 ZINC000717931262 712734522 /nfs/dbraw/zinc/73/45/22/712734522.db2.gz ZURNTXRXZZPBGU-UTUOFQBUSA-N 2 0 210.365 2.234 20 0 BEADRP CC[C@H]1C[C@@H](C)C[N@@H+]1C[C@@H]1CC[C@H]([NH3+])C1 ZINC000717969666 712735724 /nfs/dbraw/zinc/73/57/24/712735724.db2.gz DKTBHRPLVKANDO-NDBYEHHHSA-N 2 0 210.365 2.234 20 0 BEADRP CC[C@@H]1C[C@@H](C)C[N@@H+]1C[C@@H]1CC[C@H]([NH3+])C1 ZINC000717969664 712735756 /nfs/dbraw/zinc/73/57/56/712735756.db2.gz DKTBHRPLVKANDO-FVCCEPFGSA-N 2 0 210.365 2.234 20 0 BEADRP CC(C)O[C@H]1CCC[N@H+](C[C@@H]2CC[C@H]([NH3+])C2)C1 ZINC000717963227 712735841 /nfs/dbraw/zinc/73/58/41/712735841.db2.gz SYFNQVDXAMDRSJ-RDBSUJKOSA-N 2 0 240.391 2.003 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]C2CCC=CCC2)C12CCC2 ZINC000718132536 712747152 /nfs/dbraw/zinc/74/71/52/712747152.db2.gz BREHLTWLBPUADO-OLZOCXBDSA-N 2 0 220.360 2.345 20 0 BEADRP CC(F)(F)CCC[N@@H+]1CC[C@@]2(C1)CCC[NH2+]C2 ZINC000718610227 712773326 /nfs/dbraw/zinc/77/33/26/712773326.db2.gz HYLFLSYCFDPBJK-ZDUSSCGKSA-N 2 0 246.345 2.497 20 0 BEADRP C[NH2+]C[C@H]1CCC[N@H+](CCCC(C)(F)F)C1 ZINC000718570213 712774703 /nfs/dbraw/zinc/77/47/03/712774703.db2.gz JCHYXXJKYSYPRX-LLVKDONJSA-N 2 0 234.334 2.353 20 0 BEADRP C[N@H+](CCCC(C)(F)F)CC(C)(C)C[NH3+] ZINC000718569755 712774871 /nfs/dbraw/zinc/77/48/71/712774871.db2.gz HJUPIIJEVQMKMG-UHFFFAOYSA-N 2 0 222.323 2.339 20 0 BEADRP C[C@@H]([NH3+])[C@H]1CC[N@H+](CCCC(C)(F)F)C1 ZINC000718569762 712775055 /nfs/dbraw/zinc/77/50/55/712775055.db2.gz HMUWOMKMJAXMFJ-ZJUUUORDSA-N 2 0 220.307 2.091 20 0 BEADRP C[NH2+]CC1CC[NH+](CCCC(C)(F)F)CC1 ZINC000718570371 712775062 /nfs/dbraw/zinc/77/50/62/712775062.db2.gz KCQWVWMPQXEOOI-UHFFFAOYSA-N 2 0 234.334 2.353 20 0 BEADRP C[C@H]([NH3+])C1CC[NH+](CCCC(C)(F)F)CC1 ZINC000718706503 712777991 /nfs/dbraw/zinc/77/79/91/712777991.db2.gz IBKCVWFGCISRNE-JTQLQIEISA-N 2 0 234.334 2.481 20 0 BEADRP C[C@H](C[NH2+]CC1CC1)C[NH+]1CCCCC1 ZINC000038041989 712801127 /nfs/dbraw/zinc/80/11/27/712801127.db2.gz MEKDJBVVIVXABN-GFCCVEGCSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@@H]1[C@H](Nc2cc[nH+]c3ccccc23)CC[N@@H+]1C ZINC000719576715 712811613 /nfs/dbraw/zinc/81/16/13/712811613.db2.gz SEALIFJDIQULKP-DGCLKSJQSA-N 2 0 241.338 2.161 20 0 BEADRP CSC1CCC(C[NH2+][C@H](C)C2C[NH2+]C2)CC1 ZINC000720536169 712849714 /nfs/dbraw/zinc/84/97/14/712849714.db2.gz JGGWKQOPLDMFMV-XSRFYTQQSA-N 2 0 242.432 2.106 20 0 BEADRP C[C@H]1CCCC[C@H]1C[N@@H+]1C[C@@H]2C[NH2+]C[C@]2(C)C1 ZINC000720658033 712861018 /nfs/dbraw/zinc/86/10/18/712861018.db2.gz QXZQGFANMWHGIB-ZQDZILKHSA-N 2 0 236.403 2.354 20 0 BEADRP CCO[C@@H]1CCC[C@@H]([NH2+]C[C@H](C)C[NH+](C)C)C1 ZINC000721169345 712894148 /nfs/dbraw/zinc/89/41/48/712894148.db2.gz VUBCFCHTTMXQQO-BFHYXJOUSA-N 2 0 242.407 2.121 20 0 BEADRP CC[C@H]1CCC[N@H+](C[C@@H]2CCC[NH+](C)C2)C1 ZINC001208608377 957094567 /nfs/dbraw/zinc/09/45/67/957094567.db2.gz IDQJGGCMPZXSIJ-UONOGXRCSA-N 2 0 224.392 2.450 20 0 BEADRP CCC(CC)C[N@@H+]1CCCC[C@H](C[NH3+])C1 ZINC000308846793 959522904 /nfs/dbraw/zinc/52/29/04/959522904.db2.gz LPOARYKWNJFOKF-CYBMUJFWSA-N 2 0 212.381 2.483 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+][C@H](C)C2C[NH2+]C2)s1 ZINC000686245400 960237859 /nfs/dbraw/zinc/23/78/59/960237859.db2.gz CBGQAOLVYQMYKX-NXEZZACHSA-N 2 0 224.373 2.315 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@]2(C)CC=CCC2)CC1 ZINC000398499262 960702540 /nfs/dbraw/zinc/70/25/40/960702540.db2.gz YVLLOJDKERUCGP-CQSZACIVSA-N 2 0 222.376 2.417 20 0 BEADRP C[C@@H]1CC[C@H]([N@H+](C)CC2CC[NH+](C)CC2)C1 ZINC000093088597 963293621 /nfs/dbraw/zinc/29/36/21/963293621.db2.gz OYJNFIGVDDRGHY-OCCSQVGLSA-N 2 0 224.392 2.449 20 0 BEADRP C[NH+](C)C1CCC([N@@H+]2C[C@@H](F)C[C@H]2CF)CC1 ZINC001168315507 964427601 /nfs/dbraw/zinc/42/76/01/964427601.db2.gz XBOSQJDIEJWYNF-WTIISPKJSA-N 2 0 246.345 2.241 20 0 BEADRP Cc1ccc(CCC[NH+]2CCC(C[NH3+])CC2)o1 ZINC001205026212 967143873 /nfs/dbraw/zinc/14/38/73/967143873.db2.gz OTILKDGWKWRCCM-UHFFFAOYSA-N 2 0 236.359 2.191 20 0 BEADRP C[C@H](C[N@@H+]1CCC[C@@](C)([NH3+])CC1)C(F)(F)F ZINC001205255005 967447783 /nfs/dbraw/zinc/44/77/83/967447783.db2.gz DORUXEYVZNXBLV-NXEZZACHSA-N 2 0 238.297 2.388 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCC[C@@H](C[NH3+])[C@@H](C)C1 ZINC001205981469 967921504 /nfs/dbraw/zinc/92/15/04/967921504.db2.gz DHSOUPLQCVPADU-AVGNSLFASA-N 2 0 212.381 2.339 20 0 BEADRP CCCC(CCC)[N@@H+]1CC[C@@H](C[NH2+]C)C1 ZINC000070798674 1165952354 /nfs/dbraw/zinc/95/23/54/1165952354.db2.gz KUGBGCIBSVTUMC-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP C[NH2+]CC[C@@H](C)[N@H+](C)Cc1ccc(C)cc1 ZINC000052424631 1165979074 /nfs/dbraw/zinc/97/90/74/1165979074.db2.gz YKIJJUSGTAMOMV-CYBMUJFWSA-N 2 0 220.360 2.425 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@@H]([NH3+])CC2)cc1 ZINC000075144793 1165997627 /nfs/dbraw/zinc/99/76/27/1165997627.db2.gz MVRXJEUNAKMTQN-CQSZACIVSA-N 2 0 218.344 2.308 20 0 BEADRP CCOC1CC[NH+](CC(C)(C)C[NH+](C)C)CC1 ZINC001207287172 968716281 /nfs/dbraw/zinc/71/62/81/968716281.db2.gz YTIFNNPMANWMLB-UHFFFAOYSA-N 2 0 242.407 2.075 20 0 BEADRP CO[C@@H]1CC[N@H+](CC(C)(C)C[NH+](C)C)[C@@H](C)C1 ZINC001207284146 968718445 /nfs/dbraw/zinc/71/84/45/968718445.db2.gz KIERBJURAMPPAC-QWHCGFSZSA-N 2 0 242.407 2.074 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2CC[C@](C)(CF)C2)CC1 ZINC001207391697 968745690 /nfs/dbraw/zinc/74/56/90/968745690.db2.gz MHCNLPXOOMEHIM-CYBMUJFWSA-N 2 0 228.355 2.010 20 0 BEADRP C[C@H]1C[N@H+](CC2CC[NH+](C)CC2)C2(CC2)C1 ZINC001207399818 968750903 /nfs/dbraw/zinc/75/09/03/968750903.db2.gz UWPNQMWQEZESLD-GFCCVEGCSA-N 2 0 222.376 2.203 20 0 BEADRP C[NH+]1CCC(CC[N@@H+]2CCCC23CC3)CC1 ZINC001207480158 968799140 /nfs/dbraw/zinc/79/91/40/968799140.db2.gz VGMKOJQLKNBBBV-UHFFFAOYSA-N 2 0 222.376 2.347 20 0 BEADRP C[NH+]1CCC(CC[N@@H+]2CC[C@@](C)(CF)C2)CC1 ZINC001207480161 968796177 /nfs/dbraw/zinc/79/61/77/968796177.db2.gz VKGKYQAULQCHEB-AWEZNQCLSA-N 2 0 242.382 2.400 20 0 BEADRP C[NH+]1CCC(C)(C[N@@H+]2CCC[C@H]3C[C@H]32)CC1 ZINC001208110479 969007563 /nfs/dbraw/zinc/00/75/63/969007563.db2.gz DJWGWUVPHLZBFF-QWHCGFSZSA-N 2 0 222.376 2.203 20 0 BEADRP CC1(C)CC[C@H]([NH2+]C[C@@]2(C)CCC[NH2+]2)C1 ZINC000129509605 1166197930 /nfs/dbraw/zinc/19/79/30/1166197930.db2.gz VGMOPPOWLYQCAH-WCQYABFASA-N 2 0 210.365 2.297 20 0 BEADRP Cc1cccc(C[N@H+](C)CCC2C[NH2+]C2)c1 ZINC000129546788 1166201647 /nfs/dbraw/zinc/20/16/47/1166201647.db2.gz HDXGOGZIWBGDDX-UHFFFAOYSA-N 2 0 218.344 2.036 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2CCC(C)(C)C2)CC1 ZINC001208599611 969150282 /nfs/dbraw/zinc/15/02/82/969150282.db2.gz IRWPQSYJYSNKHU-UHFFFAOYSA-N 2 0 224.392 2.450 20 0 BEADRP CC[C@@H](C)[N@H+](C)CC1CC[NH+](CC)CC1 ZINC001208596540 969152915 /nfs/dbraw/zinc/15/29/15/969152915.db2.gz RTCGKZKNKWHEBU-GFCCVEGCSA-N 2 0 212.381 2.449 20 0 BEADRP CSC1CC[NH+](C[C@H]2CCC[N@H+](C)C2)CC1 ZINC001208608007 969165327 /nfs/dbraw/zinc/16/53/27/969165327.db2.gz FAZZEKWGUOECHP-LBPRGKRZSA-N 2 0 242.432 2.156 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH+]2CCC[C@@H](F)CC2)C1 ZINC001208608848 969166076 /nfs/dbraw/zinc/16/60/76/969166076.db2.gz XCVFBYCEANEECL-QWHCGFSZSA-N 2 0 228.355 2.152 20 0 BEADRP Cc1cc(C)[nH+]c(N2CCC[C@@](C)(C[NH3+])C2)c1 ZINC000707981271 1166279495 /nfs/dbraw/zinc/27/94/95/1166279495.db2.gz VJLXVQBIFJAYKC-AWEZNQCLSA-N 2 0 233.359 2.264 20 0 BEADRP CC[C@@H](C)C[C@@H](CC)[N@H+](C)CCC[NH3+] ZINC000227744755 1166308808 /nfs/dbraw/zinc/30/88/08/1166308808.db2.gz NYICZAMSKZTNLI-VXGBXAGGSA-N 2 0 200.370 2.482 20 0 BEADRP CC(C)(C)CC[N@@H+]1C[C@H]2CCC[NH2+][C@H]2C1 ZINC000299893854 1166326351 /nfs/dbraw/zinc/32/63/51/1166326351.db2.gz PQWKLFZYNVQFFC-NEPJUHHUSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@]1(C[N@@H+]2CC[C@H]3CCCC[C@@H]3C2)CC[NH2+]C1 ZINC000250793550 1166431105 /nfs/dbraw/zinc/43/11/05/1166431105.db2.gz KRKXMBZXTGFWRU-KFWWJZLASA-N 2 0 236.403 2.498 20 0 BEADRP C([C@@H]1CC[NH2+]C1)[N@@H+]1CC[C@H]2CCCC[C@@H]2C1 ZINC000250883507 1166443805 /nfs/dbraw/zinc/44/38/05/1166443805.db2.gz VZZSTNBUJKBISN-MGPQQGTHSA-N 2 0 222.376 2.108 20 0 BEADRP CC[C@@H]1CCC[N@@H+]1[C@H]1CCC[NH+](C)CC1 ZINC001254522075 969710891 /nfs/dbraw/zinc/71/08/91/969710891.db2.gz BMSUZWITJLCNIM-OLZOCXBDSA-N 2 0 210.365 2.345 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH+]2CCC(C(F)F)CC2)CC1 ZINC001254526217 969721550 /nfs/dbraw/zinc/72/15/50/969721550.db2.gz PVMJDPQMFXFBSD-LBPRGKRZSA-N 2 0 246.345 2.448 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1Oc1cccc2c1C[NH2+]C2 ZINC001218027900 1166512487 /nfs/dbraw/zinc/51/24/87/1166512487.db2.gz BHIJZWQXCLRKKY-SMDDNHRTSA-N 2 0 246.354 2.057 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCSC1)CC(C)(C)CC[NH3+] ZINC001255275602 970027574 /nfs/dbraw/zinc/02/75/74/970027574.db2.gz ZSYROAXYRUBFPH-RYUDHWBXSA-N 2 0 244.448 2.483 20 0 BEADRP CCCC[C@H](C)[N@@H+]1CCC[C@@H](C[NH2+]C)C1 ZINC000394604446 1166605601 /nfs/dbraw/zinc/60/56/01/1166605601.db2.gz FMWRNVIIJOXCJQ-STQMWFEESA-N 2 0 212.381 2.497 20 0 BEADRP CCCC[C@@H](C)[N@@H+]1C[C@H]2C[C@@]2(C[NH+](C)C)C1 ZINC001255333499 970115923 /nfs/dbraw/zinc/11/59/23/970115923.db2.gz USEJMUIWSRQIMV-MGPQQGTHSA-N 2 0 224.392 2.449 20 0 BEADRP CC(C)CCC[C@@H](C)NC(=[NH2+])SCC[NH3+] ZINC001170060707 970119139 /nfs/dbraw/zinc/11/91/39/970119139.db2.gz CFMXEROCGFDMBR-SNVBAGLBSA-N 2 0 231.409 2.417 20 0 BEADRP C[C@@H]([NH2+]CC1CC[NH+](C)CC1)C1(Cl)CC1 ZINC000695665956 1166663669 /nfs/dbraw/zinc/66/36/69/1166663669.db2.gz FZJGNYKNNPCFJJ-SNVBAGLBSA-N 2 0 230.783 2.078 20 0 BEADRP COC[C@@H](C)[N@H+](C1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001255563509 970346885 /nfs/dbraw/zinc/34/68/85/970346885.db2.gz VMTTXOPSPJSKKY-YRGRVCCFSA-N 2 0 240.391 2.146 20 0 BEADRP C[C@@H]([NH2+]C1CC(C)(C)C1)[C@H]1CCCC[NH2+]1 ZINC000395166100 1166706651 /nfs/dbraw/zinc/70/66/51/1166706651.db2.gz CQCRBVLYXFYEJH-ZYHUDNBSSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@@H](CC(F)(F)F)[NH2+][C@@]1(C)CCCN(C)C1 ZINC001255644126 970417008 /nfs/dbraw/zinc/41/70/08/970417008.db2.gz LCEBVCGIHUNSTL-UWVGGRQHSA-N 2 0 238.297 2.401 20 0 BEADRP C[N@H+](CCC1CC[NH2+]CC1)C1CC(C)(C)C1 ZINC000395503490 1166722702 /nfs/dbraw/zinc/72/27/02/1166722702.db2.gz RMKNGCVLDLLFMT-UHFFFAOYSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H]1CCC[N@@H+]([C@H]2CC[NH2+][C@@H](C)C2)C1 ZINC000252968677 1166774171 /nfs/dbraw/zinc/77/41/71/1166774171.db2.gz YSHLPAJQSFDQCS-XQQFMLRXSA-N 2 0 210.365 2.249 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]CCCSC ZINC001255942087 970565868 /nfs/dbraw/zinc/56/58/68/970565868.db2.gz DFGYABGJJJNZAC-LBPRGKRZSA-N 2 0 232.437 2.450 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]C[C@@H]1CCO[C@@H]1C ZINC001255941001 970572539 /nfs/dbraw/zinc/57/25/39/970572539.db2.gz LDMKNHPDPUEEAM-MJBXVCDLSA-N 2 0 242.407 2.121 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]C[C@]1(C)CCOC1 ZINC001255951293 970581974 /nfs/dbraw/zinc/58/19/74/970581974.db2.gz HULWTIFJULXMSK-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+][C@@H]1CCCC(=O)C1 ZINC001255948063 970582682 /nfs/dbraw/zinc/58/26/82/970582682.db2.gz DLIAROKYRQDEJJ-CHWSQXEVSA-N 2 0 240.391 2.208 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+][C@@]1(C)CCCOC1 ZINC001255955345 970586639 /nfs/dbraw/zinc/58/66/39/970586639.db2.gz RFQMRUAWWQVZQV-KBPBESRZSA-N 2 0 242.407 2.266 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+][C@@H]1C[C@@H]1C1CC1 ZINC001255954454 970588149 /nfs/dbraw/zinc/58/81/49/970588149.db2.gz DSRGRQFTQFCXJE-IACUBPJLSA-N 2 0 224.392 2.495 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[N@H+](C)CC1CC1 ZINC001255954871 970589333 /nfs/dbraw/zinc/58/93/33/970589333.db2.gz JQAAFGCBOVZXRG-LBPRGKRZSA-N 2 0 212.381 2.449 20 0 BEADRP CCC[N@H+](C)[C@H](C)CC[NH+](CC)CC ZINC001255955460 970591438 /nfs/dbraw/zinc/59/14/38/970591438.db2.gz UMHBMVILJJPYNZ-GFCCVEGCSA-N 2 0 200.370 2.449 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCC1(C)C)C1CC[NH2+]CC1 ZINC000400561728 970603012 /nfs/dbraw/zinc/60/30/12/970603012.db2.gz HXYNDBFYNZNHPF-ZYHUDNBSSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH2+]CC1(C)CCC1)C1CC[NH2+]CC1 ZINC000400744993 970624137 /nfs/dbraw/zinc/62/41/37/970624137.db2.gz UJBZHGUOTIFFBG-NSHDSACASA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H]1CC[C@@H]([N@@H+]2CCC3(CCCC3)C2)C[NH2+]1 ZINC000304428693 1166917128 /nfs/dbraw/zinc/91/71/28/1166917128.db2.gz SDZDPUKCZQAGQD-QWHCGFSZSA-N 2 0 222.376 2.393 20 0 BEADRP CCSC[C@H](C)[N@@H+]1CCn2c(cnc2C)C1 ZINC001173302085 975198500 /nfs/dbraw/zinc/19/85/00/975198500.db2.gz OHDYNUYKJBHNPQ-JTQLQIEISA-N 2 0 239.388 2.149 20 0 BEADRP CC[N@H+](CC[C@@H]1CCC[NH2+]C1)C(C)(C)C ZINC000382071032 1167086259 /nfs/dbraw/zinc/08/62/59/1167086259.db2.gz CEZWWVWDRSNNSK-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP CC[N@H+](CC[C@H]1CCC[NH2+]C1)C(C)(C)C ZINC000382071030 1167088029 /nfs/dbraw/zinc/08/80/29/1167088029.db2.gz CEZWWVWDRSNNSK-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP CCSCC[NH2+][C@@H](C)CC[NH+](CC)CC ZINC000309046741 1167243518 /nfs/dbraw/zinc/24/35/18/1167243518.db2.gz PBFYHYUYNGIHPN-LBPRGKRZSA-N 2 0 232.437 2.450 20 0 BEADRP C[C@H](Cc1cccc(Cl)c1)[NH2+]C[C@@H](C)C[NH3+] ZINC000309322879 1167290474 /nfs/dbraw/zinc/29/04/74/1167290474.db2.gz HKZYHKIQAJSOCM-WDEREUQCSA-N 2 0 240.778 2.455 20 0 BEADRP CC[C@H](C)C[N@@H+]1CC[C@H]2[NH2+]CCC[C@H]2C1 ZINC000251532991 1167336899 /nfs/dbraw/zinc/33/68/99/1167336899.db2.gz AVFZLSJOPKRUME-RWMBFGLXSA-N 2 0 210.365 2.106 20 0 BEADRP c1ccc(-c2cc(N3CC[NH2+]CC3)cc[nH+]2)cc1 ZINC000148926830 1167347391 /nfs/dbraw/zinc/34/73/91/1167347391.db2.gz BZRWKYFROYIHJZ-UHFFFAOYSA-N 2 0 239.322 2.158 20 0 BEADRP COC[C@H](C)[NH2+]C1CCC(C)([NH+]2CCC2)CC1 ZINC001335506393 977104551 /nfs/dbraw/zinc/10/45/51/977104551.db2.gz KPCLEHJJKDOSOU-HSBZDZAISA-N 2 0 240.391 2.018 20 0 BEADRP Cc1cccc(CC[N@@H+]2CCC[C@H]([NH3+])CC2)c1 ZINC000215829012 1167481192 /nfs/dbraw/zinc/48/11/92/1167481192.db2.gz BEQMOPCUNZJNDH-HNNXBMFYSA-N 2 0 232.371 2.351 20 0 BEADRP COCC[C@H]([NH3+])C[N@@H+]1CCC2(C1)CCCCC2 ZINC000310212411 1167494244 /nfs/dbraw/zinc/49/42/44/1167494244.db2.gz HDFNHXIJYATZNI-ZDUSSCGKSA-N 2 0 240.391 2.006 20 0 BEADRP CC[C@H](C)[C@@H](C[NH2+]C[C@@]1(C)CCC[NH2+]C1)OC ZINC000381381339 1167547867 /nfs/dbraw/zinc/54/78/67/1167547867.db2.gz LNRPYBLMNRXGIA-MJBXVCDLSA-N 2 0 242.407 2.027 20 0 BEADRP C[C@@H](CC[NH2+]C[C@]1(C)CCCS1)[NH+](C)C ZINC000697886544 1167554425 /nfs/dbraw/zinc/55/44/25/1167554425.db2.gz IAPDAYUWPUOLLJ-RYUDHWBXSA-N 2 0 230.421 2.202 20 0 BEADRP Cc1ccsc1C[NH2+]CC[C@@H](C)[NH+](C)C ZINC000697888961 1167557367 /nfs/dbraw/zinc/55/73/67/1167557367.db2.gz JXVPATZDHHQHOJ-LLVKDONJSA-N 2 0 226.389 2.486 20 0 BEADRP C[C@@H]1CCCC[C@H]1[N@H+](C)C[C@H]1CCC[NH2+]C1 ZINC000252088983 1167588360 /nfs/dbraw/zinc/58/83/60/1167588360.db2.gz DHFGMHRDZVJKGO-HZSPNIEDSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1CC([NH2+]C[C@H]2CC[N@H+](C)C2)C[C@H](C)C1 ZINC000252216061 1167774910 /nfs/dbraw/zinc/77/49/10/1167774910.db2.gz ZFMNGLIWODHPBE-JHJVBQTASA-N 2 0 224.392 2.352 20 0 BEADRP CC/C=C\CCCCC[N@H+]1C[C@@H]2[C@H]([NH3+])[C@@H]2C1 ZINC001235284074 979016835 /nfs/dbraw/zinc/01/68/35/979016835.db2.gz TVDSNXMOPJLDKU-MAUVLDTNSA-N 2 0 222.376 2.402 20 0 BEADRP COc1ccc([C@H](C)[N@H+](C)CCCC[NH3+])cc1 ZINC001235950154 979222017 /nfs/dbraw/zinc/22/20/17/979222017.db2.gz SBBKTWSUHGUXNI-LBPRGKRZSA-N 2 0 236.359 2.427 20 0 BEADRP COc1ccc([C@@H](C)[N@H+](C)CCCC[NH3+])cc1 ZINC001235950153 979222345 /nfs/dbraw/zinc/22/23/45/979222345.db2.gz SBBKTWSUHGUXNI-GFCCVEGCSA-N 2 0 236.359 2.427 20 0 BEADRP CCC(CC)C[N@H+]1C[C@H]2CC[C@@H](C1)[C@@H]2[NH3+] ZINC001235960500 979229016 /nfs/dbraw/zinc/22/90/16/979229016.db2.gz XVEDRQLTLXDARB-CLLJXQQHSA-N 2 0 210.365 2.092 20 0 BEADRP Cc1ccc(Cl)cc1C[NH2+]C1CC[NH2+]CC1 ZINC000335031970 1168290478 /nfs/dbraw/zinc/29/04/78/1168290478.db2.gz UHISLZRSRJFXKQ-UHFFFAOYSA-N 2 0 238.762 2.490 20 0 BEADRP c1cc(-c2cc(N3CC[NH2+]CC3)cc[nH+]2)cs1 ZINC001239510676 1168294826 /nfs/dbraw/zinc/29/48/26/1168294826.db2.gz FFAYYJBDJQAPEN-UHFFFAOYSA-N 2 0 245.351 2.220 20 0 BEADRP COC(C)(C)CC[N@@H+]1CCC[C@@](C)([NH3+])CC1 ZINC001205254830 979730713 /nfs/dbraw/zinc/73/07/13/979730713.db2.gz CATLEJWHRILMCB-CYBMUJFWSA-N 2 0 228.380 2.005 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2CCCCC[C@@H]2C)CC[NH2+]1 ZINC000229548208 1168359714 /nfs/dbraw/zinc/35/97/14/1168359714.db2.gz PWCBBFFZNBJJBI-FRRDWIJNSA-N 2 0 210.365 2.391 20 0 BEADRP C[NH+]1CCC(C[NH2+]C(C)(C2CC2)C2CC2)CC1 ZINC000691498037 1168509779 /nfs/dbraw/zinc/50/97/79/1168509779.db2.gz SJFJZYKJLJAIRE-UHFFFAOYSA-N 2 0 236.403 2.497 20 0 BEADRP Cc1cc2[nH]ccc2c(N2C[C@@H](C)[NH2+][C@H](C)C2)[nH+]1 ZINC001158180705 1168545261 /nfs/dbraw/zinc/54/52/61/1168545261.db2.gz YNJQYQFTSNXTIU-GHMZBOCLSA-N 2 0 244.342 2.058 20 0 BEADRP CC(C)C[N@@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC000257691176 1168600153 /nfs/dbraw/zinc/60/01/53/1168600153.db2.gz JEWPDBOCYOTZIU-UHFFFAOYSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@@H]1C[C@@H]([N@@H+]2C[C@@H]3CC[NH2+][C@@H]3C2)CC(C)(C)C1 ZINC001246651494 1168657723 /nfs/dbraw/zinc/65/77/23/1168657723.db2.gz LTCHPNJDYNGZNY-XJFOESAGSA-N 2 0 236.403 2.495 20 0 BEADRP CC[C@H](C)C[N@@H+]1CC[C@@H](C)[C@@H](C[NH3+])CC1 ZINC001205605139 1168790864 /nfs/dbraw/zinc/79/08/64/1168790864.db2.gz ZFSKTNUGBGMHML-YNEHKIRRSA-N 2 0 212.381 2.339 20 0 BEADRP c1cc(C[NH2+]CCC[NH2+]C2CC2)cc2c1CCC2 ZINC000228409347 1168910880 /nfs/dbraw/zinc/91/08/80/1168910880.db2.gz UJLCIXRSEAHFHE-UHFFFAOYSA-N 2 0 244.382 2.407 20 0 BEADRP CCc1cc(N[C@H]2CCCC[C@H]2[NH+](C)C)cc[nH+]1 ZINC001326491156 1169063608 /nfs/dbraw/zinc/06/36/08/1169063608.db2.gz AXOISBUMNZODQJ-LSDHHAIUSA-N 2 0 247.386 2.351 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2CCCC(C)(C)C2)CC1 ZINC001355214080 983446671 /nfs/dbraw/zinc/44/66/71/983446671.db2.gz GYJKGHXFJHYGIS-UHFFFAOYSA-N 2 0 224.392 2.450 20 0 BEADRP CCCCCC[NH+]1C[C@@H]2C[NH+](CC)C[C@H]2C1 ZINC001201756309 983460821 /nfs/dbraw/zinc/46/08/21/983460821.db2.gz IHDYSOVHQQNHHG-KBPBESRZSA-N 2 0 224.392 2.450 20 0 BEADRP CC(C)CC[C@H](O)C[NH2+]CCC[N@H+](C)C(C)C ZINC001356569831 983631292 /nfs/dbraw/zinc/63/12/92/983631292.db2.gz QAIYWEGUIGZRRC-AWEZNQCLSA-N 2 0 244.423 2.103 20 0 BEADRP CSC1(C[NH2+][C@H](C)C2C[NH2+]C2)CCCCC1 ZINC000686225307 1169102570 /nfs/dbraw/zinc/10/25/70/1169102570.db2.gz HCAVGAAPOIGEMS-LLVKDONJSA-N 2 0 242.432 2.250 20 0 BEADRP CC(C)CC[NH2+]C[C@H](C)C[NH+]1CCCC1 ZINC000057994437 1169155294 /nfs/dbraw/zinc/15/52/94/1169155294.db2.gz NBSOSRXATHGLNU-ZDUSSCGKSA-N 2 0 212.381 2.354 20 0 BEADRP CC(C)CC[NH2+]C[C@@H](C)C[NH+]1CCCC1 ZINC000057994434 1169155320 /nfs/dbraw/zinc/15/53/20/1169155320.db2.gz NBSOSRXATHGLNU-CYBMUJFWSA-N 2 0 212.381 2.354 20 0 BEADRP CCOCC[C@@H](C)[NH2+][C@H]1CC[C@@H]([NH+](C)C)CC1 ZINC001172418058 974692186 /nfs/dbraw/zinc/69/21/86/974692186.db2.gz BMDHQKSAFQCBGY-MCIONIFRSA-N 2 0 242.407 2.264 20 0 BEADRP CCOCC[C@H](C)[N@H+](CC)CCC[NH+](C)C ZINC001172428111 974707493 /nfs/dbraw/zinc/70/74/93/974707493.db2.gz XPGOPHVVIBWFOR-ZDUSSCGKSA-N 2 0 230.396 2.075 20 0 BEADRP CC(C)OCC[C@H](C)[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC001172442815 974802387 /nfs/dbraw/zinc/80/23/87/974802387.db2.gz NNCUHMFVFCEZKN-AVGNSLFASA-N 2 0 228.380 2.050 20 0 BEADRP CC(C)COCC[C@H](C)[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC001172455483 974819834 /nfs/dbraw/zinc/81/98/34/974819834.db2.gz TZAHHOSLBXQLDV-MELADBBJSA-N 2 0 242.407 2.297 20 0 BEADRP C[C@H](CC(F)(F)F)[N@@H+]1CC[C@@H]([NH3+])[C@@H](F)CC1 ZINC001246589576 972986476 /nfs/dbraw/zinc/98/64/76/972986476.db2.gz SSIDMUYCUBALBU-HRDYMLBCSA-N 2 0 242.260 2.089 20 0 BEADRP C[NH2+]CC1C[NH+]([C@H](C)CCC=C(C)C)C1 ZINC001246598346 973012079 /nfs/dbraw/zinc/01/20/79/973012079.db2.gz NZSBAMVGJVMBHC-GFCCVEGCSA-N 2 0 210.365 2.273 20 0 BEADRP CCOc1cccc(C[NH2+]CC[C@H](C)[NH2+]C)c1 ZINC001328678529 973264163 /nfs/dbraw/zinc/26/41/63/973264163.db2.gz XPZHWWUEYLEDPT-LBPRGKRZSA-N 2 0 236.359 2.173 20 0 BEADRP CC(C)CC[C@@H](C)[N@H+]1C[C@H]2C[NH+](C)C[C@H]2C1 ZINC001256371306 970786871 /nfs/dbraw/zinc/78/68/71/970786871.db2.gz MZYFRFWMWRKWSU-MCIONIFRSA-N 2 0 224.392 2.305 20 0 BEADRP CC(C)(C)[NH+]1CCC(n2ccc(C[NH3+])c2)CC1 ZINC001256563330 970862317 /nfs/dbraw/zinc/86/23/17/970862317.db2.gz ABKYCHASQQKTCB-UHFFFAOYSA-N 2 0 235.375 2.382 20 0 BEADRP CC(C)(C)[NH+]1CCC(n2cccc2C[NH3+])CC1 ZINC001256561253 970862668 /nfs/dbraw/zinc/86/26/68/970862668.db2.gz ARNRAHSZFKCVLP-UHFFFAOYSA-N 2 0 235.375 2.382 20 0 BEADRP C[C@H]1C[C@@H](CF)[N@@H+](C2C[C@H]3CC[C@@H](C2)[NH+]3C)C1 ZINC001256623426 970886959 /nfs/dbraw/zinc/88/69/59/970886959.db2.gz PVGIPDVGGSAIIV-MWWBDVBNSA-N 2 0 240.366 2.292 20 0 BEADRP CCOc1ccc(CN2C[C@@H](C)[C@H]([NH3+])C2)c(C)c1 ZINC001206058590 970921340 /nfs/dbraw/zinc/92/13/40/970921340.db2.gz HWDLWNKABJDQAP-IUODEOHRSA-N 2 0 248.370 2.173 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H](C)Cc1ccncc1 ZINC001256717037 970933905 /nfs/dbraw/zinc/93/39/05/970933905.db2.gz XZJBGPXJWBWOEL-CQSZACIVSA-N 2 0 249.402 2.334 20 0 BEADRP C[C@H](Cc1ccncc1)[NH2+][C@H]1CCC[N@H+](C)CC1 ZINC001256721751 970940994 /nfs/dbraw/zinc/94/09/94/970940994.db2.gz UTTNUTXIDOGEHI-HIFRSBDPSA-N 2 0 247.386 2.087 20 0 BEADRP [NH3+]CC[C@@H]1CC[N@H+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)C1 ZINC000403451529 970946690 /nfs/dbraw/zinc/94/66/90/970946690.db2.gz GEEUNFMFRXAMTF-SYQHCUMBSA-N 2 0 222.376 2.093 20 0 BEADRP CC[C@@H]1C[N@H+](C[C@@H]2CC[C@H]([NH3+])C2)[C@H](CC)CO1 ZINC000403760020 971049565 /nfs/dbraw/zinc/04/95/65/971049565.db2.gz AHIXBZJDBPBPAA-XJFOESAGSA-N 2 0 240.391 2.003 20 0 BEADRP C[C@@H]1CC([NH2+]CCCCCCC[NH3+])C[C@@H](C)O1 ZINC001257078355 971073621 /nfs/dbraw/zinc/07/36/21/971073621.db2.gz JCWBNKWGMBOVPZ-CHWSQXEVSA-N 2 0 242.407 2.441 20 0 BEADRP CC(C)[NH+]1CCC(N2C[C@@H](C)[C@@H](F)C2)CC1 ZINC001257215167 971133954 /nfs/dbraw/zinc/13/39/54/971133954.db2.gz UCMXFFQONGPIAO-YPMHNXCESA-N 2 0 228.355 2.149 20 0 BEADRP CCC(CC)NC(=[NH2+])SCCSC(N)=[NH2+] ZINC001257289857 971175745 /nfs/dbraw/zinc/17/57/45/971175745.db2.gz FSJUPLUMEDFXMC-UHFFFAOYSA-N 2 0 248.421 2.059 20 0 BEADRP CC1(C)[C@@H]([NH3+])C[C@@H]1[NH2+]CCc1cccs1 ZINC000404842977 971185835 /nfs/dbraw/zinc/18/58/35/971185835.db2.gz CHPDXWHVAMUQDX-QWRGUYRKSA-N 2 0 224.373 2.006 20 0 BEADRP CCC(CC)[NH+]1C[C@H]2C[NH+](CC)C[C@@H]2C1 ZINC001257301382 971189283 /nfs/dbraw/zinc/18/92/83/971189283.db2.gz DMMHKAQSSZAYPX-VXGBXAGGSA-N 2 0 210.365 2.059 20 0 BEADRP CCC[N@H+]1C[C@@H]2C[NH+](C(CC)CC)C[C@@H]2C1 ZINC001257302588 971193919 /nfs/dbraw/zinc/19/39/19/971193919.db2.gz ZSESQKANHAGKEE-BETUJISGSA-N 2 0 224.392 2.449 20 0 BEADRP CCC[C@H](C)NC(=[NH2+])SCCSC(N)=[NH2+] ZINC001257309709 971202999 /nfs/dbraw/zinc/20/29/99/971202999.db2.gz XAKCDZGLVRMKBG-ZETCQYMHSA-N 2 0 248.421 2.059 20 0 BEADRP CC(C)CSCC[NH2+][C@@H]1C[C@H]([NH3+])C12CCC2 ZINC000405209861 971205279 /nfs/dbraw/zinc/20/52/79/971205279.db2.gz CCOAXHPZXYYHES-NWDGAFQWSA-N 2 0 242.432 2.235 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]C2Cc3ccccc3C2)C12CCC2 ZINC000405238170 971217172 /nfs/dbraw/zinc/21/71/72/971217172.db2.gz GFEBWCCTDGOVFR-HUUCEWRRSA-N 2 0 242.366 2.013 20 0 BEADRP Cc1cccc(C[NH2+][C@H]2C[C@@H]([NH3+])C23CCC3)c1 ZINC000405256269 971218344 /nfs/dbraw/zinc/21/83/44/971218344.db2.gz MLIMGADDYRHEQO-KGLIPLIRSA-N 2 0 230.355 2.355 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]C[C@H]2Cc3ccccc32)C12CCC2 ZINC000405275582 971226910 /nfs/dbraw/zinc/22/69/10/971226910.db2.gz WVLGBYYVFPQGNZ-YUELXQCFSA-N 2 0 242.366 2.186 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]CCc2cccs2)C12CCC2 ZINC000405261662 971227201 /nfs/dbraw/zinc/22/72/01/971227201.db2.gz NLNSWSUMSVFBSK-VXGBXAGGSA-N 2 0 236.384 2.150 20 0 BEADRP Cc1ccccc1C[NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405269584 971228115 /nfs/dbraw/zinc/22/81/15/971228115.db2.gz TZIJZUCUMQTCPS-ZIAGYGMSSA-N 2 0 230.355 2.355 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+][C@@H]2CC23CCCC3)C12CCC2 ZINC000405302372 971230913 /nfs/dbraw/zinc/23/09/13/971230913.db2.gz JERNBFITEPTBLP-GRYCIOLGSA-N 2 0 220.360 2.179 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+][C@H]2CC23CCCC3)C12CCC2 ZINC000405302375 971232126 /nfs/dbraw/zinc/23/21/26/971232126.db2.gz JERNBFITEPTBLP-UTUOFQBUSA-N 2 0 220.360 2.179 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]Cc2ccsc2)C12CCC2 ZINC000405309859 971233187 /nfs/dbraw/zinc/23/31/87/971233187.db2.gz OEIQLEFKAFETQO-MNOVXSKESA-N 2 0 222.357 2.108 20 0 BEADRP CCCCOCCC[NH2+][C@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405343263 971236737 /nfs/dbraw/zinc/23/67/37/971236737.db2.gz JKIQSLKVWSOCFZ-OLZOCXBDSA-N 2 0 240.391 2.053 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]CC2(C3CC3)CCC2)C12CCC2 ZINC000405329411 971237877 /nfs/dbraw/zinc/23/78/77/971237877.db2.gz VZBGTOAXUBXCLM-STQMWFEESA-N 2 0 234.387 2.426 20 0 BEADRP C[C@@H]1CCC[C@@H]1C[NH2+][C@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405366798 971242890 /nfs/dbraw/zinc/24/28/90/971242890.db2.gz WZUUVKMGCVXQTM-LPWJVIDDSA-N 2 0 222.376 2.282 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]CCC2CCCC2)C12CCC2 ZINC000405352584 971243169 /nfs/dbraw/zinc/24/31/69/971243169.db2.gz PEASADJSFIVYMN-OLZOCXBDSA-N 2 0 222.376 2.426 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+]CCCC2CC2)C12CCC2 ZINC000405430239 971255260 /nfs/dbraw/zinc/25/52/60/971255260.db2.gz APYJKRHRJONERA-NWDGAFQWSA-N 2 0 208.349 2.036 20 0 BEADRP CCC(CC)C[NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405465487 971257756 /nfs/dbraw/zinc/25/77/56/971257756.db2.gz JSVJGHXSOKNKQE-VXGBXAGGSA-N 2 0 210.365 2.282 20 0 BEADRP CCC[C@H](CC)[NH2+][C@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405498825 971263822 /nfs/dbraw/zinc/26/38/22/971263822.db2.gz QOULLZXRAMDCMS-TUAOUCFPSA-N 2 0 210.365 2.425 20 0 BEADRP CC1(C[NH2+][C@@H]2C[C@@H]([NH3+])C23CCC3)CCC1 ZINC000405531743 971265107 /nfs/dbraw/zinc/26/51/07/971265107.db2.gz YICCTNBNAOTAEO-GHMZBOCLSA-N 2 0 208.349 2.036 20 0 BEADRP C[N@H+](C1CC1)C1CC[NH+](C2CCCC2)CC1 ZINC001257355622 971272674 /nfs/dbraw/zinc/27/26/74/971272674.db2.gz CLLIJZKUICXGDS-UHFFFAOYSA-N 2 0 222.376 2.488 20 0 BEADRP CCCCCC1CCC([NH2+]C[C@H](O)C[NH3+])CC1 ZINC001257370735 971288810 /nfs/dbraw/zinc/28/88/10/971288810.db2.gz TWIBLOJQLZAOMH-JXQTWKCFSA-N 2 0 242.407 2.035 20 0 BEADRP CCCCCC1CCC([NH2+]C[C@@H](O)C[NH3+])CC1 ZINC001257370736 971289674 /nfs/dbraw/zinc/28/96/74/971289674.db2.gz TWIBLOJQLZAOMH-RUXDESIVSA-N 2 0 242.407 2.035 20 0 BEADRP CC(C)(CC[N@@H+]1CC[C@H](CC[NH3+])C1)C1CC1 ZINC000406016432 971324874 /nfs/dbraw/zinc/32/48/74/971324874.db2.gz WQZCHJIVHCUKEF-LBPRGKRZSA-N 2 0 224.392 2.483 20 0 BEADRP C(CC1CC1)C[N@@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000405935224 971320687 /nfs/dbraw/zinc/32/06/87/971320687.db2.gz AAUILCSMSQXETK-UHFFFAOYSA-N 2 0 222.376 2.252 20 0 BEADRP CC[C@H](C)[NH2+]CC1CC[NH+](C(C)C)CC1 ZINC001257429806 971335967 /nfs/dbraw/zinc/33/59/67/971335967.db2.gz ZPXNEJQROZNMTL-LBPRGKRZSA-N 2 0 212.381 2.495 20 0 BEADRP CC[C@@H](C)[NH+]1CCC([N@H+](C)C2CC2)CC1 ZINC001257446902 971363806 /nfs/dbraw/zinc/36/38/06/971363806.db2.gz SFNSDYVVLWBOLX-LLVKDONJSA-N 2 0 210.365 2.344 20 0 BEADRP CCC[N@H+](CCC[NH+](C)C)[C@H](C)CC ZINC001257446966 971364217 /nfs/dbraw/zinc/36/42/17/971364217.db2.gz UUMXSHCLZSPHGI-GFCCVEGCSA-N 2 0 200.370 2.449 20 0 BEADRP CC[C@@H](C)C[C@@H](CC)[NH+]1CC2(C1)CC[NH2+]C2 ZINC000724058034 971383357 /nfs/dbraw/zinc/38/33/57/971383357.db2.gz WFXIFAJMTPNKEU-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[NH2+]CCC[C@@H]1OCc1cccc(C[NH3+])c1 ZINC001217778170 971400953 /nfs/dbraw/zinc/40/09/53/971400953.db2.gz KPVYGRRFTAQOFQ-DOMZBBRYSA-N 2 0 248.370 2.050 20 0 BEADRP [NH3+]CCCCCCO[C@H]1CCC[C@@]12CC[NH2+]C2 ZINC001217803913 971415317 /nfs/dbraw/zinc/41/53/17/971415317.db2.gz UEQZUHDVAPXRCA-KBPBESRZSA-N 2 0 240.391 2.054 20 0 BEADRP C[C@@H]1CC[C@H](OCCCCCCC[NH3+])C[NH2+]1 ZINC001217914183 971514651 /nfs/dbraw/zinc/51/46/51/971514651.db2.gz XDBABFLPGVEPGY-OLZOCXBDSA-N 2 0 228.380 2.053 20 0 BEADRP [NH3+]CCCCCCCO[C@@H]1C[NH2+]CCC12CC2 ZINC001217914042 971515168 /nfs/dbraw/zinc/51/51/68/971515168.db2.gz PHKPVGBMNNLJSQ-CYBMUJFWSA-N 2 0 240.391 2.054 20 0 BEADRP CCC[N@H+](CCC[NH3+])C1CCC2(COC2)CC1 ZINC001257896399 971531264 /nfs/dbraw/zinc/53/12/64/971531264.db2.gz OQTOFMURKDMSTR-UHFFFAOYSA-N 2 0 240.391 2.006 20 0 BEADRP CC(C)C[NH+]1CCC([N@@H+]2CC[C@@H]2C)CC1 ZINC001258012774 971552267 /nfs/dbraw/zinc/55/22/67/971552267.db2.gz GLSHYZCOUZFFDF-LBPRGKRZSA-N 2 0 210.365 2.201 20 0 BEADRP C[C@@H]1C[NH2+]CCC[C@@H]1Oc1ccc2c(c1)C[NH2+]C2 ZINC001217989085 971560902 /nfs/dbraw/zinc/56/09/02/971560902.db2.gz LZCCFBIJPBUDBM-ABAIWWIYSA-N 2 0 246.354 2.057 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1Oc1ccc2c(c1)C[NH2+]C2 ZINC001218028381 971577821 /nfs/dbraw/zinc/57/78/21/971577821.db2.gz FORGIQDPBXLDQC-XHDPSFHLSA-N 2 0 246.354 2.057 20 0 BEADRP C[C@@H]([NH3+])c1ccc(O[C@@H]2C[NH2+]CC[C@H]2C)cc1 ZINC001218044500 971587671 /nfs/dbraw/zinc/58/76/71/971587671.db2.gz BVXZVIVYQILJEX-JTNHKYCSSA-N 2 0 234.343 2.083 20 0 BEADRP C[C@H]1C[C@H](Oc2ccc([C@@H]3C[C@H]3[NH3+])cc2)CC[NH2+]1 ZINC001218054249 971592677 /nfs/dbraw/zinc/59/26/77/971592677.db2.gz YGSGVZJLOCJJIC-OADPDTJPSA-N 2 0 246.354 2.021 20 0 BEADRP [NH3+]CC1(F)CC[NH+](Cc2ccccc2F)CC1 ZINC001222532114 972536971 /nfs/dbraw/zinc/53/69/71/972536971.db2.gz KIBUXLMIJWPWLF-UHFFFAOYSA-N 2 0 240.297 2.089 20 0 BEADRP C[NH2+][C@H]1CC[C@H](Oc2cccc3c2C[NH2+]C3)CC1 ZINC001218189565 971624129 /nfs/dbraw/zinc/62/41/29/971624129.db2.gz ZBMZLNIXSXDLCA-JOCQHMNTSA-N 2 0 246.354 2.199 20 0 BEADRP CC1(C)[C@@H]2C[C@H]([NH2+]CCC[NH+]3CCCC3)C[C@@H]21 ZINC001170714002 971624879 /nfs/dbraw/zinc/62/48/79/971624879.db2.gz VZDNJGNPLDHUTG-BTTYYORXSA-N 2 0 236.403 2.497 20 0 BEADRP C[NH2+][C@H]1CC[C@H](Oc2cccc(C[NH3+])c2)CC1 ZINC001218190139 971625024 /nfs/dbraw/zinc/62/50/24/971625024.db2.gz XJKRISKYYKGCOX-JOCQHMNTSA-N 2 0 234.343 2.055 20 0 BEADRP C[NH+](C)[C@H]1CC[C@H](Oc2cccc(C[NH3+])c2)CC1 ZINC001218327987 971710250 /nfs/dbraw/zinc/71/02/50/971710250.db2.gz GPQQYQZKSHAVCG-HDJSIYSDSA-N 2 0 248.370 2.397 20 0 BEADRP CC1(C)C[C@H]([NH2+]CCCC[NH+]2CCCC2)CO1 ZINC001172269825 974488070 /nfs/dbraw/zinc/48/80/70/974488070.db2.gz IHNUCNDMCJFZDD-ZDUSSCGKSA-N 2 0 240.391 2.020 20 0 BEADRP C[C@H]([NH3+])c1ccc(O[C@H]2CC[NH2+]C[C@@H]2C)cc1 ZINC001218418805 971795516 /nfs/dbraw/zinc/79/55/16/971795516.db2.gz WSFOWHCEAHSYDY-MJVIPROJSA-N 2 0 234.343 2.083 20 0 BEADRP CC[NH+](CC)CCCC[NH2+][C@@H]1CCCOCC1 ZINC001170774888 971800153 /nfs/dbraw/zinc/80/01/53/971800153.db2.gz FKLZBNRESKSNFD-CQSZACIVSA-N 2 0 242.407 2.267 20 0 BEADRP C[C@H]([NH3+])c1ccc(O[C@@H]2CC[C@@H]3C[NH2+]C[C@H]23)cc1 ZINC001218461833 971824218 /nfs/dbraw/zinc/82/42/18/971824218.db2.gz AZEULKGMQMOMNV-MMMKDXCPSA-N 2 0 246.354 2.083 20 0 BEADRP [NH3+]CC1(F)CC[NH+](CC2CCCCC2)CC1 ZINC001222527073 972539118 /nfs/dbraw/zinc/53/91/18/972539118.db2.gz ILUMOJZONXACQV-UHFFFAOYSA-N 2 0 228.355 2.330 20 0 BEADRP C[NH+](C)Cc1cc(F)cc(C[NH+]2CCCC2)c1 ZINC001232145292 1169682307 /nfs/dbraw/zinc/68/23/07/1169682307.db2.gz NRDNCPQAXXSPDP-UHFFFAOYSA-N 2 0 236.334 2.483 20 0 BEADRP C[NH+](C)Cc1cc(F)cc(C[N@@H+]2C[C@@H]3C[C@@H]3C2)c1 ZINC001232144002 1169682700 /nfs/dbraw/zinc/68/27/00/1169682700.db2.gz FZAZLUHVRJREEK-OKILXGFUSA-N 2 0 248.345 2.339 20 0 BEADRP C[C@@H]([NH3+])CCNc1cc(N2CCCCC2)cc[nH+]1 ZINC001170889184 972035137 /nfs/dbraw/zinc/03/51/37/972035137.db2.gz LJXMEPXVRIVBEI-GFCCVEGCSA-N 2 0 248.374 2.221 20 0 BEADRP CC(C)CC[NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000190775215 972056566 /nfs/dbraw/zinc/05/65/66/972056566.db2.gz BTMBUTNOBRIAGZ-CHWSQXEVSA-N 2 0 212.381 2.495 20 0 BEADRP C[C@@H]([NH3+])CCNc1ccc([C@H]2CC[N@H+](C)C2)cc1 ZINC001170894542 972067245 /nfs/dbraw/zinc/06/72/45/972067245.db2.gz KCIVUQQEYKABJO-OCCSQVGLSA-N 2 0 247.386 2.255 20 0 BEADRP CCCCc1cccc(N[C@H]([NH3+])CCC[NH3+])c1 ZINC001170902498 972078686 /nfs/dbraw/zinc/07/86/86/972078686.db2.gz DTCPWNFPVXVUTL-AWEZNQCLSA-N 2 0 235.375 2.465 20 0 BEADRP [NH3+]CCC[C@H]([NH3+])Nc1cccc(C2CCC2)c1 ZINC001170905082 972079741 /nfs/dbraw/zinc/07/97/41/972079741.db2.gz RDTQLGRVVKRWHZ-CQSZACIVSA-N 2 0 233.359 2.390 20 0 BEADRP CC[C@H]1CC[C@H]([NH2+]CC2([NH3+])CCCC2)C1 ZINC001246076651 972129136 /nfs/dbraw/zinc/12/91/36/972129136.db2.gz QVTDODDFJIPRHR-RYUDHWBXSA-N 2 0 210.365 2.426 20 0 BEADRP [NH3+]Cc1cccc2c1ccn2C1CC[NH2+]CC1 ZINC001246116314 972180071 /nfs/dbraw/zinc/18/00/71/972180071.db2.gz YQQUOHTXQJZFIC-UHFFFAOYSA-N 2 0 229.327 2.025 20 0 BEADRP C[N@@H+]1CCC=C(c2ccc3[nH]cc(C[NH3+])c3c2)C1 ZINC001241571549 1169733915 /nfs/dbraw/zinc/73/39/15/1169733915.db2.gz DEHSQHASYVMZGJ-UHFFFAOYSA-N 2 0 241.338 2.346 20 0 BEADRP CC[C@H]1CC([NH2+]CCCCC[NH3+])C[C@H](CC)[NH2+]1 ZINC001246165450 972202027 /nfs/dbraw/zinc/20/20/27/972202027.db2.gz QZYLXNUSIUCFRF-STQMWFEESA-N 3 0 241.423 2.014 20 0 BEADRP Cc1ccccc1OCC[NH2+][C@H]1CC[NH2+][C@H](C)C1 ZINC001246168274 972203185 /nfs/dbraw/zinc/20/31/85/972203185.db2.gz JMJWXITZQOXZOE-KGLIPLIRSA-N 2 0 248.370 2.104 20 0 BEADRP C[C@H]1C[C@@H]([NH2+][C@H]2C[C@@H]([NH3+])C2)CC(C)(C)C1 ZINC001246190715 972211536 /nfs/dbraw/zinc/21/15/36/972211536.db2.gz RRESNSRJXWDVKA-NNYUYHANSA-N 2 0 210.365 2.281 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C[C@H]2CCC[NH2+]C2)C[C@H]1C ZINC001246215941 972219296 /nfs/dbraw/zinc/21/92/96/972219296.db2.gz ACNARBXHXSZUKL-YIYPIFLZSA-N 2 0 224.392 2.400 20 0 BEADRP Cc1[nH+]c(NC[C@@H]2CCCC[NH2+]2)cc2[nH]ccc21 ZINC001160151269 972219331 /nfs/dbraw/zinc/21/93/31/972219331.db2.gz SJSPYFODNDKMMT-NSHDSACASA-N 2 0 244.342 2.425 20 0 BEADRP Cc1c(F)cccc1C[NH2+][C@@H]1CC[NH2+][C@@H](C)C1 ZINC001246228290 972233637 /nfs/dbraw/zinc/23/36/37/972233637.db2.gz XALGBHYKEIYBOR-GXFFZTMASA-N 2 0 236.334 2.364 20 0 BEADRP Cl/C=C/C[N@@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000692954045 957044886 /nfs/dbraw/zinc/04/48/86/957044886.db2.gz GNOLVKQRLPFNFF-NHEDYWLLSA-N 2 0 242.794 2.451 20 0 BEADRP CC[C@@H]1CCC[N@H+](C[C@@H]2CCC[NH+](C)C2)C1 ZINC001208608378 957087318 /nfs/dbraw/zinc/08/73/18/957087318.db2.gz IDQJGGCMPZXSIJ-ZIAGYGMSSA-N 2 0 224.392 2.450 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH+]2CCC[C@@H](C(F)F)C2)C1 ZINC001208612796 957097435 /nfs/dbraw/zinc/09/74/35/957097435.db2.gz NZDJGQOJYFIZRE-VXGBXAGGSA-N 2 0 246.345 2.305 20 0 BEADRP CCCC[C@@H]1C[C@H](NCC[C@@H]([NH3+])CC)CC[NH2+]1 ZINC001246308887 972270521 /nfs/dbraw/zinc/27/05/21/972270521.db2.gz SXJYMRBJMWSILC-BFHYXJOUSA-N 2 0 241.423 2.014 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@@H]1CCc2cccc(F)c2C1 ZINC001246313171 972272450 /nfs/dbraw/zinc/27/24/50/972272450.db2.gz JELPRQPPPPJQMM-VXGBXAGGSA-N 2 0 236.334 2.010 20 0 BEADRP C[C@@H]1CCC[C@@H](C)[NH+]1C[C@H]1CCC[NH2+]C1 ZINC000252219970 957602288 /nfs/dbraw/zinc/60/22/88/957602288.db2.gz YTQFOZSUKFBQCQ-UPJWGTAASA-N 2 0 210.365 2.249 20 0 BEADRP C[C@H]1CC[C@H](C[NH2+]C2CCCCC2)C[NH2+]1 ZINC000397543175 957679014 /nfs/dbraw/zinc/67/90/14/957679014.db2.gz ZAPBZJVGIOZXED-RYUDHWBXSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]Cc2ccc3ocnc3c2)CC[NH2+]1 ZINC001246332463 972294844 /nfs/dbraw/zinc/29/48/44/972294844.db2.gz MGBPVLOFNZLYOK-JQWIXIFHSA-N 2 0 245.326 2.058 20 0 BEADRP CCCCC[C@H](CC)[NH2+][C@@H]1CC12C[NH2+]C2 ZINC001246441930 972313069 /nfs/dbraw/zinc/31/30/69/972313069.db2.gz ATXQZUFWQQCWSQ-NWDGAFQWSA-N 2 0 210.365 2.297 20 0 BEADRP Cc1cc(C[NH+]2CCC3(C[NH+](C)C3)CC2)oc1C ZINC001204540524 958029602 /nfs/dbraw/zinc/02/96/02/958029602.db2.gz YLCDYNNDQCAQEZ-UHFFFAOYSA-N 2 0 248.370 2.424 20 0 BEADRP CCc1ccc(C[C@@H](C)[NH2+][C@@H]2CC23C[NH2+]C3)cc1 ZINC001246443975 972316187 /nfs/dbraw/zinc/31/61/87/972316187.db2.gz IWHVKVCLKTWVFH-IUODEOHRSA-N 2 0 244.382 2.132 20 0 BEADRP CC[C@]1([NH2+][C@H]2CCC[C@@H](C)C2)CC[NH2+]C1 ZINC001246461870 972336412 /nfs/dbraw/zinc/33/64/12/972336412.db2.gz QHBGXPVPTHBTDF-AGIUHOORSA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@]1([NH2+][C@H]2CCC[C@H](C)C2)CC[NH2+]C1 ZINC001246461876 972337897 /nfs/dbraw/zinc/33/78/97/972337897.db2.gz QHBGXPVPTHBTDF-AVGNSLFASA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@H]1CC[C@H]([NH2+]C[C@@]2(C)CCC[NH2+]2)C1 ZINC001246466026 972341374 /nfs/dbraw/zinc/34/13/74/972341374.db2.gz KEHXUSNSDMBCCS-RWMBFGLXSA-N 2 0 210.365 2.297 20 0 BEADRP CC(C)[C@H]1CCC[N@H+](C[C@H]2C[C@@H]([NH3+])C2)CC1 ZINC000693541978 958734874 /nfs/dbraw/zinc/73/48/74/958734874.db2.gz BDNJKWYHELJVIR-MELADBBJSA-N 2 0 224.392 2.482 20 0 BEADRP Cc1nc(C)c([C@H](C)[NH2+]C[C@H]2C[C@@H]([NH3+])C2)s1 ZINC000693543996 958747375 /nfs/dbraw/zinc/74/73/75/958747375.db2.gz DIUBRACRGFBOBI-BKDNQFJXSA-N 2 0 239.388 2.148 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)S3)C1 ZINC000403674969 958788737 /nfs/dbraw/zinc/78/87/37/958788737.db2.gz PTVHJVIJVCTUQU-KTCIRNNBSA-N 2 0 240.416 2.273 20 0 BEADRP C[C@@H](c1ccccc1)[N@H+](C)C[C@H]1C[C@@H]([NH3+])C1 ZINC000693567020 958860217 /nfs/dbraw/zinc/86/02/17/958860217.db2.gz FYINJYVTAVPRMX-SGMGOOAPSA-N 2 0 218.344 2.417 20 0 BEADRP C[NH+](C)CC(C)(C)C[N@H+](C)CC1CCC1 ZINC001207285696 958881056 /nfs/dbraw/zinc/88/10/56/958881056.db2.gz MVXAOMXLFNOISS-UHFFFAOYSA-N 2 0 212.381 2.306 20 0 BEADRP CC(C)C[NH+](CC(C)C)C[C@H]1C[C@@H]([NH3+])C1 ZINC000693586127 958889284 /nfs/dbraw/zinc/88/92/84/958889284.db2.gz RMVKYGNPRYRUFC-BETUJISGSA-N 2 0 212.381 2.338 20 0 BEADRP Cc1ccc(F)cc1C[N@@H+]1CC[C@H](CC[NH3+])C1 ZINC000690744478 959206458 /nfs/dbraw/zinc/20/64/58/959206458.db2.gz XRMBANVXFHEZTF-LBPRGKRZSA-N 2 0 236.334 2.305 20 0 BEADRP CCOC(C)(C)C[N@@H+]1CCC[C@]12CCC[NH2+]C2 ZINC001222237548 972413176 /nfs/dbraw/zinc/41/31/76/972413176.db2.gz MORCLMZKLURTQM-AWEZNQCLSA-N 2 0 240.391 2.020 20 0 BEADRP C1=C[C@@H]2C[C@H]1C[C@@H]2C[N@@H+]1CCC[C@@]12CCC[NH2+]C2 ZINC001222231893 972416536 /nfs/dbraw/zinc/41/65/36/972416536.db2.gz QJNLKQFBMNSXBZ-ZJIFWQFVSA-N 2 0 246.398 2.417 20 0 BEADRP C1=C[C@@H]2C[C@H]1C[C@H]2C[N@@H+]1CCC[C@]12CCC[NH2+]C2 ZINC001222231887 972417330 /nfs/dbraw/zinc/41/73/30/972417330.db2.gz QJNLKQFBMNSXBZ-FZKCQIBNSA-N 2 0 246.398 2.417 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@H]1CCC12CCCC2 ZINC000693890743 959480898 /nfs/dbraw/zinc/48/08/98/959480898.db2.gz WUVPMVKVQDEFPO-AGIUHOORSA-N 2 0 222.376 2.154 20 0 BEADRP C[C@@H](NCC[C@H]1CCC[N@@H+]1C)c1cncs1 ZINC000693892812 959483741 /nfs/dbraw/zinc/48/37/41/959483741.db2.gz DQKHKBXEQZVGIR-GHMZBOCLSA-N 2 0 239.388 2.278 20 0 BEADRP [NH3+]CCCCCCCO[C@@H]1CC[C@]12CC[NH2+]C2 ZINC001217808566 959618081 /nfs/dbraw/zinc/61/80/81/959618081.db2.gz MTEWFGIUHZCCRT-ZIAGYGMSSA-N 2 0 240.391 2.054 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CCC[C@]2(CCCC[NH2+]2)C1 ZINC001222384811 972450651 /nfs/dbraw/zinc/45/06/51/972450651.db2.gz AALPXTKBUHDCHN-MGPQQGTHSA-N 2 0 222.376 2.251 20 0 BEADRP [NH3+][C@@H]1C[C@H]1c1ccc(O[C@@H]2CCCC[NH2+]C2)cc1 ZINC001217974736 959810052 /nfs/dbraw/zinc/81/00/52/959810052.db2.gz KKEQGCRUZXMXDW-QLFBSQMISA-N 2 0 246.354 2.022 20 0 BEADRP CCCC[C@H](CC)[N@@H+]1C[C@H](C)[C@H](C[NH3+])C1 ZINC000708862457 959985826 /nfs/dbraw/zinc/98/58/26/959985826.db2.gz GYOWGEYBKJEKBX-XQQFMLRXSA-N 2 0 212.381 2.482 20 0 BEADRP C[C@@H]1CC[N@H+](CCCCCCC[NH3+])C[C@H](C)O1 ZINC000694857653 960015860 /nfs/dbraw/zinc/01/58/60/960015860.db2.gz KKVVCGRVECDRJA-KGLIPLIRSA-N 2 0 242.407 2.395 20 0 BEADRP C[C@@H]([NH3+])c1ccc(O[C@H]2CC[C@@H](C)[NH2+]C2)cc1 ZINC001218408097 960064096 /nfs/dbraw/zinc/06/40/96/960064096.db2.gz PWLQNVDOVKYWSM-GYSYKLTISA-N 2 0 234.343 2.226 20 0 BEADRP C[C@@H]([NH3+])c1ccc(O[C@@H]2CC[C@@H](C)[NH2+]C2)cc1 ZINC001218408098 960065000 /nfs/dbraw/zinc/06/50/00/960065000.db2.gz PWLQNVDOVKYWSM-JTNHKYCSSA-N 2 0 234.343 2.226 20 0 BEADRP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)C1(Cl)CC1 ZINC000695648048 960322414 /nfs/dbraw/zinc/32/24/14/960322414.db2.gz LLFLZXYGKFNQBW-WAAKLRNESA-N 2 0 242.794 2.361 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+][C@@H]1CCCC2(CC2)C1 ZINC000695690176 960373816 /nfs/dbraw/zinc/37/38/16/960373816.db2.gz ODAMBDIBVMIXFX-CHWSQXEVSA-N 2 0 240.391 2.053 20 0 BEADRP [NH3+]C1CC[NH+](CC2CCC3(CC3)CC2)CC1 ZINC000695699619 960380379 /nfs/dbraw/zinc/38/03/79/960380379.db2.gz SYSSQGGJEGXTGR-UHFFFAOYSA-N 2 0 222.376 2.380 20 0 BEADRP [NH3+]C[C@H]1CC[N@H+](CC2CCC3(CC3)CC2)C1 ZINC000695720260 960401097 /nfs/dbraw/zinc/40/10/97/960401097.db2.gz ZDSOGFAMSIWHLQ-CYBMUJFWSA-N 2 0 222.376 2.237 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+][C@H]1CCCC2(CC2)C1 ZINC000695765018 960445790 /nfs/dbraw/zinc/44/57/90/960445790.db2.gz SJMJIVGBCPSFMD-RWMBFGLXSA-N 2 0 222.376 2.426 20 0 BEADRP C[C@H](C[NH2+][C@@H]1C[C@H]([NH3+])C12CCC2)c1ccccn1 ZINC000692744334 960563724 /nfs/dbraw/zinc/56/37/24/960563724.db2.gz GBJVNHFLEWBTOZ-KWCYVHTRSA-N 2 0 245.370 2.045 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2CCC3(CCC3)C2)CC[NH2+]1 ZINC000709451162 960612611 /nfs/dbraw/zinc/61/26/11/960612611.db2.gz WRKZAKOIWTZMSD-VXGBXAGGSA-N 2 0 208.349 2.003 20 0 BEADRP C[C@H]1C[C@@H]([N@@H+]2CCC3(CCC3)C2)CC[NH2+]1 ZINC000709451160 960615037 /nfs/dbraw/zinc/61/50/37/960615037.db2.gz WRKZAKOIWTZMSD-RYUDHWBXSA-N 2 0 208.349 2.003 20 0 BEADRP Cc1c[nH]c(C[N@H+](C)CC2CC[NH+](C)CC2)c1C ZINC001140860173 960636627 /nfs/dbraw/zinc/63/66/27/960636627.db2.gz MOJMWUBXSKBOBA-UHFFFAOYSA-N 2 0 249.402 2.405 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[N@H+](CC)C1COC1 ZINC001167833379 961181063 /nfs/dbraw/zinc/18/10/63/961181063.db2.gz ANOZOSMMZXLVKO-CYBMUJFWSA-N 2 0 242.407 2.218 20 0 BEADRP C[N@@H+]1CC[C@@]2(CC[NH+](C[C@@H]3C[C@H]4C=C[C@@H]3C4)C2)C1 ZINC001207631437 961397990 /nfs/dbraw/zinc/39/79/90/961397990.db2.gz HQBPBKHHLRZSMD-XUWVNRHRSA-N 2 0 246.398 2.226 20 0 BEADRP CC1CC[NH+](CCC[NH2+][C@@H]2C[C@H]3C[C@H]3C2)CC1 ZINC001167895960 961522662 /nfs/dbraw/zinc/52/26/62/961522662.db2.gz XZJBGRXEOMUAQZ-QDMKHBRRSA-N 2 0 236.403 2.497 20 0 BEADRP C[N@@H+]1CCC[C@H](CC[NH2+][C@@H]2C[C@H]3C[C@H]3C2)C1 ZINC001167898233 961532259 /nfs/dbraw/zinc/53/22/59/961532259.db2.gz QDGXRGHPYIDNCU-YIYPIFLZSA-N 2 0 222.376 2.106 20 0 BEADRP CCCC[N@H+](C)CCC[NH2+][C@H]1C[C@H]2C[C@H]2C1 ZINC001167899412 961539212 /nfs/dbraw/zinc/53/92/12/961539212.db2.gz ZVDABTCHFSKJQV-WDNDVIMCSA-N 2 0 224.392 2.497 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+]C[C@H](C)C(C)(C)C ZINC000234790480 961645912 /nfs/dbraw/zinc/64/59/12/961645912.db2.gz BNNIEYHEPRVQCF-RYUDHWBXSA-N 2 0 230.396 2.012 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CC[C@H]([NH3+])C2)c(C)n1 ZINC000925883496 961719346 /nfs/dbraw/zinc/71/93/46/961719346.db2.gz WVMRUKWCXCWRDW-BNOWGMLFSA-N 2 0 247.386 2.476 20 0 BEADRP CC(C)C[NH+]1CCC([NH2+][C@H]2C[C@H]3C[C@H]3C2)CC1 ZINC001167910938 961816660 /nfs/dbraw/zinc/81/66/60/961816660.db2.gz XEDVCXMRHYEGMN-NHAGDIPZSA-N 2 0 236.403 2.495 20 0 BEADRP C[NH2+]C[C@H]1CC[N@H+](C[C@H]2CC3CCC2CC3)C1 ZINC000400113404 962245405 /nfs/dbraw/zinc/24/54/05/962245405.db2.gz LGGAQUFIKSPZQB-HXSCFSKGSA-N 2 0 236.403 2.354 20 0 BEADRP CCc1cccc(C[N@@H+]2CCCC[C@@H](C[NH3+])C2)n1 ZINC001206641224 962290498 /nfs/dbraw/zinc/29/04/98/962290498.db2.gz UQNKMKQOANVWML-ZDUSSCGKSA-N 2 0 247.386 2.205 20 0 BEADRP C[C@@H]1CC[NH2+]C[C@H]1C[NH2+][C@@H]1CCC(C)(C)C1 ZINC000710684564 962442132 /nfs/dbraw/zinc/44/21/32/962442132.db2.gz GPJWPNAURAZYRM-FRRDWIJNSA-N 2 0 224.392 2.400 20 0 BEADRP Cc1[nH+]c(NC2(C)CC[NH2+]CC2)cc2[nH]ccc21 ZINC001157402543 963598934 /nfs/dbraw/zinc/59/89/34/963598934.db2.gz DLHVXUBGJVEGHX-UHFFFAOYSA-N 2 0 244.342 2.425 20 0 BEADRP CCCC[N@H+](C)CCC[NH2+][C@@H]1CCO[C@@H](C)C1 ZINC001168075751 963615372 /nfs/dbraw/zinc/61/53/72/963615372.db2.gz QNFXQWAFPUFXMK-UONOGXRCSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CC[C@H]([NH+](C)C)CC2)CCO1 ZINC001168091936 963688199 /nfs/dbraw/zinc/68/81/99/963688199.db2.gz CRQOQLCAKZPSIV-AAVRWANBSA-N 2 0 240.391 2.016 20 0 BEADRP C[NH2+]CC[C@H](C)[NH2+]C[C@@H]1CCCC[C@H]1C ZINC000714413441 963691796 /nfs/dbraw/zinc/69/17/96/963691796.db2.gz QRZAFQBJYAAXBO-AGIUHOORSA-N 2 0 212.381 2.400 20 0 BEADRP Cc1[nH+]c(N2C[C@@H](C)[NH2+][C@H](C)C2)cc2[nH]ccc21 ZINC001158178400 963820310 /nfs/dbraw/zinc/82/03/10/963820310.db2.gz PUTJGHOZAQVUSL-NXEZZACHSA-N 2 0 244.342 2.058 20 0 BEADRP CCOc1cc[nH+]c(N2CCC[C@@](C)(C[NH3+])C2)c1 ZINC001158679827 963902272 /nfs/dbraw/zinc/90/22/72/963902272.db2.gz ZNMHVFNKOWFNEB-AWEZNQCLSA-N 2 0 249.358 2.046 20 0 BEADRP Cc1cc[nH+]c(NC2(C)CC[NH2+]CC2)c1C ZINC001168183896 963938949 /nfs/dbraw/zinc/93/89/49/963938949.db2.gz OFVOGSFMMVBFTE-UHFFFAOYSA-N 2 0 219.332 2.252 20 0 BEADRP C[C@H](CC1CC1)[NH2+]CC[C@H]1CCC[N@@H+]1C ZINC000822123672 963939977 /nfs/dbraw/zinc/93/99/77/963939977.db2.gz ABJLJEBALCUXQJ-DGCLKSJQSA-N 2 0 210.365 2.249 20 0 BEADRP [NH3+]CCc1ccccc1NC1=C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC001159997208 964236384 /nfs/dbraw/zinc/23/63/84/964236384.db2.gz BOPNZBIPPSAHGC-OLZOCXBDSA-N 2 0 243.354 2.008 20 0 BEADRP Cc1cc(Nc2cccc3[nH]cnc32)cc[nH+]1 ZINC001213026060 964404956 /nfs/dbraw/zinc/40/49/56/964404956.db2.gz GQSPJHMFTWAGGK-UHFFFAOYSA-N 2 0 224.267 2.432 20 0 BEADRP COCC[N@H+](C(C)C)C1CCC([NH+](C)C)CC1 ZINC001168322788 964444673 /nfs/dbraw/zinc/44/46/73/964444673.db2.gz IDNJGNWZPVSWFR-UHFFFAOYSA-N 2 0 242.407 2.216 20 0 BEADRP C[NH+](C)C1CCC([N@@H+]2C[C@H]3CC[C@@H]2C3)CC1 ZINC001168326544 964455813 /nfs/dbraw/zinc/45/58/13/964455813.db2.gz ATRHMPSLYDXSCK-GFJIZPEISA-N 2 0 222.376 2.344 20 0 BEADRP C[C@@H](CC[NH2+]C[C@H]1CC=CCC1)[NH+](C)C ZINC000697877837 964602342 /nfs/dbraw/zinc/60/23/42/964602342.db2.gz FPBGTFPLRADVLR-STQMWFEESA-N 2 0 210.365 2.273 20 0 BEADRP Cc1ccc(C[NH2+]CC[C@@H](C)[NH+](C)C)s1 ZINC000697888179 964635448 /nfs/dbraw/zinc/63/54/48/964635448.db2.gz IJCLOTLHQGGONU-SNVBAGLBSA-N 2 0 226.389 2.486 20 0 BEADRP C[C@@H]([NH2+]CCCCCC[NH3+])c1cscn1 ZINC000697905353 964674236 /nfs/dbraw/zinc/67/42/36/964674236.db2.gz LAAGZTLAGZUGCL-SNVBAGLBSA-N 2 0 227.377 2.313 20 0 BEADRP C(C1CC1)[NH+]1CCC([NH2+][C@H]2CC23CCC3)CC1 ZINC001168365485 964714003 /nfs/dbraw/zinc/71/40/03/964714003.db2.gz SJSDYAFARRLZNC-AWEZNQCLSA-N 2 0 234.387 2.393 20 0 BEADRP Cn1ccc2c1[nH+]ccc2NCCCC[NH+](C)C ZINC001161736263 964724126 /nfs/dbraw/zinc/72/41/26/964724126.db2.gz NGFJJHPZCUXLQY-UHFFFAOYSA-N 2 0 246.358 2.327 20 0 BEADRP C[N@@H+]1CCC[C@](C)(Nc2[nH+]ccc3[nH]ccc32)C1 ZINC001162330194 964933002 /nfs/dbraw/zinc/93/30/02/964933002.db2.gz BAYDZBHDCNXGPX-AWEZNQCLSA-N 2 0 244.342 2.459 20 0 BEADRP [NH3+][C@H]1CCC[C@@H](Nc2ccc(C3([NH3+])CC3)cc2)C1 ZINC001162399331 964960519 /nfs/dbraw/zinc/96/05/19/964960519.db2.gz BAXDQRDNHXDOPH-GXTWGEPZSA-N 2 0 245.370 2.316 20 0 BEADRP Cc1cc(NC[C@H]2CCC[NH2+]C[C@H]2C)cc(C)[nH+]1 ZINC001162457461 964985680 /nfs/dbraw/zinc/98/56/80/964985680.db2.gz PHOYEQQGDFQTMT-BXUZGUMPSA-N 2 0 247.386 2.168 20 0 BEADRP Cc1ccc(NC[C@@H]2CCC[NH2+]C[C@H]2C)[nH+]c1N ZINC001162460216 964988607 /nfs/dbraw/zinc/98/86/07/964988607.db2.gz HYGSQTWBFWOCNS-NEPJUHHUSA-N 2 0 248.374 2.020 20 0 BEADRP Cc1ccc(NC[C@@H]2CCC[NH2+]C[C@@H]2C)[nH+]c1N ZINC001162460218 964989630 /nfs/dbraw/zinc/98/96/30/964989630.db2.gz HYGSQTWBFWOCNS-RYUDHWBXSA-N 2 0 248.374 2.020 20 0 BEADRP Cc1ccc(C)c(NC[C@H]2C[NH2+][C@H](C)C2)[nH+]1 ZINC001162554788 965043783 /nfs/dbraw/zinc/04/37/83/965043783.db2.gz HHLKZOJLKFEUJR-VXGBXAGGSA-N 2 0 219.332 2.108 20 0 BEADRP C(C1CC1)[NH+]1CCC([N@@H+]2C[C@H]3CC[C@@H]2C3)CC1 ZINC001168387912 965111868 /nfs/dbraw/zinc/11/18/68/965111868.db2.gz XZXNSSVQNFBANF-DZGCQCFKSA-N 2 0 234.387 2.345 20 0 BEADRP C1=C[C@@H]([NH2+]C2CCN(c3cc[nH+]cc3)CC2)CC1 ZINC000698240595 965124194 /nfs/dbraw/zinc/12/41/94/965124194.db2.gz NIFXDROUGYKUNR-CYBMUJFWSA-N 2 0 243.354 2.359 20 0 BEADRP C[C@H]([NH3+])c1ccc(N[C@@]23CCC[C@@H]2[NH2+]CC3)cc1 ZINC001162983211 965217603 /nfs/dbraw/zinc/21/76/03/965217603.db2.gz RADGGLGZOULDKE-TUKIKUTGSA-N 2 0 245.370 2.403 20 0 BEADRP CCCC(C[NH3+])(CCC)Nc1cccc(N)n1 ZINC001163038886 965237808 /nfs/dbraw/zinc/23/78/08/965237808.db2.gz TVJWRJWZNHLTQU-UHFFFAOYSA-N 2 0 236.363 2.373 20 0 BEADRP C[NH+]1CCC2(C[NH+](C3CCCCC3)C2)CC1 ZINC001257461101 1169866689 /nfs/dbraw/zinc/86/66/89/1169866689.db2.gz INSNSPIEIXGMFR-UHFFFAOYSA-N 2 0 222.376 2.347 20 0 BEADRP Cc1ccc(N(C)CCC[NH+](C)C)[nH+]c1C ZINC001163595205 965466783 /nfs/dbraw/zinc/46/67/83/965466783.db2.gz BGTPGOLQDFCMDA-UHFFFAOYSA-N 2 0 221.348 2.086 20 0 BEADRP Cc1ccc(N[C@@H](C)C[NH+](C)C)c(C[NH+](C)C)c1 ZINC001163785025 965588913 /nfs/dbraw/zinc/58/89/13/965588913.db2.gz ABLFFGWYFNVFTP-ZDUSSCGKSA-N 2 0 249.402 2.419 20 0 BEADRP [NH3+][C@@H]1CCC[N@H+](C[C@@H]2C[C@H]3C=C[C@@H]2C3)CC1 ZINC001205094181 965725745 /nfs/dbraw/zinc/72/57/45/965725745.db2.gz JZCNXXCZYYAIRK-RFQIPJPRSA-N 2 0 220.360 2.012 20 0 BEADRP [NH3+][C@@H]1CCC[N@H+](C[C@H]2C[C@H]3C=C[C@@H]2C3)CC1 ZINC001205094180 965727097 /nfs/dbraw/zinc/72/70/97/965727097.db2.gz JZCNXXCZYYAIRK-REWJHTLYSA-N 2 0 220.360 2.012 20 0 BEADRP CCc1ccc(C[N@@H+]2CCC[C@H]([NH3+])CC2)o1 ZINC001205094986 965735059 /nfs/dbraw/zinc/73/50/59/965735059.db2.gz SLBCMECTSLGESJ-NSHDSACASA-N 2 0 222.332 2.155 20 0 BEADRP CC(C)[C@H]1CC[N@H+](CC2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000699206725 965816980 /nfs/dbraw/zinc/81/69/80/965816980.db2.gz YZVGIHVNUHTNNN-WIGRTHMWSA-N 2 0 236.403 2.495 20 0 BEADRP COc1cc(C)cc(C[N@@H+]2CCC[C@@H]([NH3+])CC2)c1 ZINC001205109552 965831590 /nfs/dbraw/zinc/83/15/90/965831590.db2.gz IKBHWEWYLHZSHK-CQSZACIVSA-N 2 0 248.370 2.317 20 0 BEADRP Cc1cc(C[N@@H+]2CCC[C@H]([NH3+])CC2)ccc1O ZINC001205110122 965834845 /nfs/dbraw/zinc/83/48/45/965834845.db2.gz PCXJUKMCFHACDD-ZDUSSCGKSA-N 2 0 234.343 2.014 20 0 BEADRP Cc1cc(F)cc(C[N@@H+]2CCC[C@H]([NH3+])CC2)c1 ZINC001205110584 965835997 /nfs/dbraw/zinc/83/59/97/965835997.db2.gz WHRYYKJMUWUOMX-AWEZNQCLSA-N 2 0 236.334 2.447 20 0 BEADRP C(C1C[C@H]2CC[C@@H](C1)[NH2+]2)[NH+]1CCCCC1 ZINC000699304933 965839820 /nfs/dbraw/zinc/83/98/20/965839820.db2.gz JMWFBYMRGNIBAP-YHWZYXNKSA-N 2 0 208.349 2.003 20 0 BEADRP CC1=C[C@H](C)[C@H](C[N@H+]2C[C@H]3C[NH2+]C[C@H]3C2)CC1 ZINC001234979706 965983663 /nfs/dbraw/zinc/98/36/63/965983663.db2.gz QVNJVQMNUUYYPP-ZQDZILKHSA-N 2 0 234.387 2.130 20 0 BEADRP CC1=C[C@H](C)[C@@H](C[N@H+]2C[C@H]3C[NH2+]C[C@H]3C2)CC1 ZINC001234979697 965984708 /nfs/dbraw/zinc/98/47/08/965984708.db2.gz QVNJVQMNUUYYPP-LJISPDSOSA-N 2 0 234.387 2.130 20 0 BEADRP Cc1cc(C)[nH+]c(N2CCC3(CC([NH3+])C3)CC2)c1 ZINC001165243940 966007076 /nfs/dbraw/zinc/00/70/76/966007076.db2.gz PTKLPQCGPUJLAY-UHFFFAOYSA-N 2 0 245.370 2.406 20 0 BEADRP C1=C[C@@H]2C[C@H]1C[C@H]2C[N@@H+]1CCCC[C@]12CC[NH2+]C2 ZINC001235124257 966008526 /nfs/dbraw/zinc/00/85/26/966008526.db2.gz LIFMWFYSFIMCAN-XUWVNRHRSA-N 2 0 246.398 2.417 20 0 BEADRP CCC[C@@H](C)C[N@H+]1C[C@H]2CC[C@@H](C1)[C@@H]2[NH3+] ZINC001235959457 966179403 /nfs/dbraw/zinc/17/94/03/966179403.db2.gz QAESLDZBYLAQFO-FVCCEPFGSA-N 2 0 210.365 2.092 20 0 BEADRP CC1(C[NH3+])C[NH+](CC2(C)CCCCC2)C1 ZINC001206710972 966183548 /nfs/dbraw/zinc/18/35/48/966183548.db2.gz BVWFSGPYKYUCHN-UHFFFAOYSA-N 2 0 210.365 2.237 20 0 BEADRP CC[N@@H+]1CCC[C@H](C[NH2+][C@H](C)C2CC2)C1 ZINC000253185308 966225707 /nfs/dbraw/zinc/22/57/07/966225707.db2.gz HZTREZVDQLQLLN-VXGBXAGGSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@]1(C[NH3+])CC[N@H+](C[C@@H]2CC3CCC2CC3)C1 ZINC000691657809 966288118 /nfs/dbraw/zinc/28/81/18/966288118.db2.gz AIGBDFCZIYVSAN-WUCCLRPBSA-N 2 0 236.403 2.483 20 0 BEADRP CC(C)[NH+]1CCC(CNc2cc[nH+]cc2)CC1 ZINC001166594176 966317661 /nfs/dbraw/zinc/31/76/61/966317661.db2.gz LASNFILQUXAZRL-UHFFFAOYSA-N 2 0 233.359 2.036 20 0 BEADRP C/C(=C\C=C\N)[NH2+]CC1CC[NH+](C(C)C)CC1 ZINC001166615994 966331555 /nfs/dbraw/zinc/33/15/55/966331555.db2.gz QBDUOSSLUGKOIN-OLOPGVEZSA-N 2 0 237.391 2.073 20 0 BEADRP C1=C[C@@H]2C[C@H]1C[C@@H]2C[N@H+]1C[C@@H]2CC[NH2+]CC[C@@H]2C1 ZINC001236314188 966366141 /nfs/dbraw/zinc/36/61/41/966366141.db2.gz JRHCZXFJVHDUKD-ZVDSWSACSA-N 2 0 246.398 2.130 20 0 BEADRP [NH3+]C1(c2ccc(C3=CCC[NH2+]CC3)cc2)CC1 ZINC001238941524 966792037 /nfs/dbraw/zinc/79/20/37/966792037.db2.gz NTHDXCWYEFLQCO-UHFFFAOYSA-N 2 0 228.339 2.401 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@H]([NH2+]CC3(C)CCC3)[C@@H]2C1 ZINC001204089352 966891823 /nfs/dbraw/zinc/89/18/23/966891823.db2.gz MGVNUHXCBGEYHC-XQQFMLRXSA-N 2 0 222.376 2.106 20 0 BEADRP CC(C)[C@@H]1C[C@H]1[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC001204128143 966898644 /nfs/dbraw/zinc/89/86/44/966898644.db2.gz IXJUVWXWBVTONI-RFQIPJPRSA-N 2 0 222.376 2.247 20 0 BEADRP CC1=C[C@H](C)[C@H](C[N@@H+]2CC[C@](C)([NH3+])C2)CC1 ZINC001204762772 967150572 /nfs/dbraw/zinc/15/05/72/967150572.db2.gz DFNNKZOISLXKRU-IHRRRGAJSA-N 2 0 222.376 2.402 20 0 BEADRP Cc1cc2[nH]ccc2c(-c2cncc(C[NH3+])c2)[nH+]1 ZINC001239791743 967187502 /nfs/dbraw/zinc/18/75/02/967187502.db2.gz KSSKWQDSSQQTHR-UHFFFAOYSA-N 2 0 238.294 2.392 20 0 BEADRP C[NH+](C)[C@@H]1CCC[C@H]([NH2+][C@@H]2CCCOCC2)C1 ZINC000715584755 967194425 /nfs/dbraw/zinc/19/44/25/967194425.db2.gz RBFCVXPRVOZKBR-HZSPNIEDSA-N 2 0 240.391 2.018 20 0 BEADRP C[NH+](C)C1CCC([NH2+]CCc2ccccn2)CC1 ZINC000715585790 967194567 /nfs/dbraw/zinc/19/45/67/967194567.db2.gz VWHXBGXDNNLLOI-UHFFFAOYSA-N 2 0 247.386 2.087 20 0 BEADRP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+][C@@H]2CCCOCC2)C1 ZINC000715584761 967196532 /nfs/dbraw/zinc/19/65/32/967196532.db2.gz RBFCVXPRVOZKBR-MGPQQGTHSA-N 2 0 240.391 2.018 20 0 BEADRP Cc1cc(O)cc(C)c1C[NH+]1CCC(C[NH3+])CC1 ZINC001205041207 967267730 /nfs/dbraw/zinc/26/77/30/967267730.db2.gz PTCKWPYPZQNGKE-UHFFFAOYSA-N 2 0 248.370 2.180 20 0 BEADRP Cc1cc(C[NH+]2CCC(C[NH3+])CC2)c(C)cc1O ZINC001205040292 967303569 /nfs/dbraw/zinc/30/35/69/967303569.db2.gz DKWIYXVYIVTXTQ-UHFFFAOYSA-N 2 0 248.370 2.180 20 0 BEADRP COc1cc(C)cc(CN2[C@@H](C)CC[C@H]2C[NH3+])c1 ZINC001205075317 967325053 /nfs/dbraw/zinc/32/50/53/967325053.db2.gz HYLCIATXMJEAQA-JSGCOSHPSA-N 2 0 248.370 2.315 20 0 BEADRP Cc1cc(F)cc(CN2[C@@H](C)CC[C@H]2C[NH3+])c1 ZINC001205075278 967328433 /nfs/dbraw/zinc/32/84/33/967328433.db2.gz GPSLNLNWPWBMAO-FZMZJTMJSA-N 2 0 236.334 2.446 20 0 BEADRP Cc1ccc(CCC[N@@H+]2CCC[C@H]([NH3+])CC2)o1 ZINC001205093851 967337244 /nfs/dbraw/zinc/33/72/44/967337244.db2.gz GPDBLQUPGYBFRM-ZDUSSCGKSA-N 2 0 236.359 2.334 20 0 BEADRP Cc1cccc(C[N@@H+]2CCC[C@@H]([NH3+])CC2)c1F ZINC001205103066 967345424 /nfs/dbraw/zinc/34/54/24/967345424.db2.gz XURVOYHCCBIPIA-CYBMUJFWSA-N 2 0 236.334 2.447 20 0 BEADRP Cc1ccc(F)cc1C[N@@H+]1CCC[C@@H]([NH3+])CC1 ZINC001205109276 967351054 /nfs/dbraw/zinc/35/10/54/967351054.db2.gz DIFIVJKCTFVMOK-CQSZACIVSA-N 2 0 236.334 2.447 20 0 BEADRP COc1c(C)cccc1C[N@@H+]1CCC[C@H]([NH3+])CC1 ZINC001205124690 967368666 /nfs/dbraw/zinc/36/86/66/967368666.db2.gz YDMGXNLXYOAHNN-AWEZNQCLSA-N 2 0 248.370 2.317 20 0 BEADRP Cc1csc(C[N@H+]2C[C@H](C)[C@H](C[NH3+])C2)c1 ZINC001205136112 967383251 /nfs/dbraw/zinc/38/32/51/967383251.db2.gz OWXXRNKUIXLNQA-WDEREUQCSA-N 2 0 224.373 2.083 20 0 BEADRP C[C@]1([NH3+])CCC[N@H+](CCCc2cccnc2)CC1 ZINC001205257132 967443541 /nfs/dbraw/zinc/44/35/41/967443541.db2.gz SLZZCWZMHVBOOU-HNNXBMFYSA-N 2 0 247.386 2.218 20 0 BEADRP C[C@@]1([NH3+])CCC[N@H+](CCc2cccs2)CC1 ZINC001205256609 967448255 /nfs/dbraw/zinc/44/82/55/967448255.db2.gz QBKMDZRIPSONPX-CYBMUJFWSA-N 2 0 238.400 2.494 20 0 BEADRP C[NH+](C)CCCc1ccc(C[NH+](C)C)cc1 ZINC001250161298 967453205 /nfs/dbraw/zinc/45/32/05/967453205.db2.gz UFTBFXRWRWHYDY-UHFFFAOYSA-N 2 0 220.360 2.242 20 0 BEADRP Cc1cccc(C[N@@H+]2CCC[C@](C)([NH3+])CC2)n1 ZINC001205263631 967459382 /nfs/dbraw/zinc/45/93/82/967459382.db2.gz AYQPIZZFEYKWLI-AWEZNQCLSA-N 2 0 233.359 2.093 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@](C)([NH3+])CC2)nc1 ZINC001205273154 967467310 /nfs/dbraw/zinc/46/73/10/967467310.db2.gz GIKWPBGQAFHKAB-AWEZNQCLSA-N 2 0 233.359 2.093 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@](C)([NH3+])CC2)cc1O ZINC001205288843 967479319 /nfs/dbraw/zinc/47/93/19/967479319.db2.gz PADJCWIQHYAWOY-HNNXBMFYSA-N 2 0 248.370 2.404 20 0 BEADRP CC(C)CC[N@@H+]1CCC[C@@](F)(C[NH3+])CC1 ZINC001205537483 967674689 /nfs/dbraw/zinc/67/46/89/967674689.db2.gz HMDGCXQWFUXJFB-LBPRGKRZSA-N 2 0 216.344 2.185 20 0 BEADRP [NH3+]C[C@@]1(F)CCC[N@H+](CCC(F)(F)F)CC1 ZINC001205539486 967678795 /nfs/dbraw/zinc/67/87/95/967678795.db2.gz ZQNPHXYEAQQDTP-SECBINFHSA-N 2 0 242.260 2.092 20 0 BEADRP Cc1cnccc1C[N@H+]1CC[C@@H](C)[C@H](C[NH3+])CC1 ZINC001205602630 967717321 /nfs/dbraw/zinc/71/73/21/967717321.db2.gz KSPGCQQEZVNOMB-OCCSQVGLSA-N 2 0 247.386 2.197 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCC[C@H](C[NH3+])[C@H](C)C1 ZINC001205981474 967920645 /nfs/dbraw/zinc/92/06/45/967920645.db2.gz DHSOUPLQCVPADU-YNEHKIRRSA-N 2 0 212.381 2.339 20 0 BEADRP Cc1c[nH]c(C[N@@H+]2CCC[C@H](C[NH3+])[C@@H](C)C2)c1C ZINC001206004358 967956946 /nfs/dbraw/zinc/95/69/46/967956946.db2.gz RWSGPBFJRVLWJX-GXTWGEPZSA-N 2 0 249.402 2.438 20 0 BEADRP C[C@H](C[NH+](C)C)Nc1ccc([C@H]2CCC[NH2+]2)cc1 ZINC001163776567 968113238 /nfs/dbraw/zinc/11/32/38/968113238.db2.gz DLNBXPXMOJSJDG-IUODEOHRSA-N 2 0 247.386 2.473 20 0 BEADRP C[C@@H](C[NH+](C)C)Nc1ccc([C@H]2CCC[NH2+]2)cc1 ZINC001163776568 968114682 /nfs/dbraw/zinc/11/46/82/968114682.db2.gz DLNBXPXMOJSJDG-SWLSCSKDSA-N 2 0 247.386 2.473 20 0 BEADRP COC(C)(C)CC[N@@H+]1CCC[C@@](C)(C[NH3+])CC1 ZINC001206295766 968203425 /nfs/dbraw/zinc/20/34/25/968203425.db2.gz NJKYYQVRQYUWSO-CQSZACIVSA-N 2 0 242.407 2.252 20 0 BEADRP Cc1cc2cc(N3CC[C@@H]([NH3+])C3)ccc2c[nH+]1 ZINC001164289233 968215855 /nfs/dbraw/zinc/21/58/55/968215855.db2.gz WICRMLJGAYIJDY-CYBMUJFWSA-N 2 0 227.311 2.081 20 0 BEADRP C[C@@]1(C[NH3+])CCCC[N@H+](Cc2cccc(O)c2)C1 ZINC001206541843 968365836 /nfs/dbraw/zinc/36/58/36/968365836.db2.gz LOTMGQRYGWNKFA-HNNXBMFYSA-N 2 0 248.370 2.343 20 0 BEADRP Cc1c[nH]c(C[N@@H+]2CCCC[C@@H](C[NH3+])C2)c1C ZINC001206623291 968424987 /nfs/dbraw/zinc/42/49/87/968424987.db2.gz KWBCQLUSHKCQMK-ZDUSSCGKSA-N 2 0 235.375 2.192 20 0 BEADRP CNc1ccc(C[N@@H+]2CCCC[C@H](C[NH3+])C2)cc1 ZINC001206640950 968426225 /nfs/dbraw/zinc/42/62/25/968426225.db2.gz PXKMKYIOTYOEHJ-CQSZACIVSA-N 2 0 247.386 2.289 20 0 BEADRP FC(F)CCC[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC001120044093 968517825 /nfs/dbraw/zinc/51/78/25/968517825.db2.gz ZNJAXSNKONTWQZ-UHFFFAOYSA-N 2 0 246.345 2.496 20 0 BEADRP C[N@H+]1CC[C@H]2C[NH+](CCC3CC3)C[C@H]2CC1 ZINC001276513100 968680029 /nfs/dbraw/zinc/68/00/29/968680029.db2.gz IIBMMGBZVOPSPY-OKILXGFUSA-N 2 0 222.376 2.060 20 0 BEADRP C[C@H]1CCC[N@H+](CC(C)(C)C[NH+](C)C)C1 ZINC001207275798 968714530 /nfs/dbraw/zinc/71/45/30/968714530.db2.gz PQIZGSCZMANBSA-LBPRGKRZSA-N 2 0 212.381 2.306 20 0 BEADRP CO[C@H]1CC[N@H+](CC(C)(C)C[NH+](C)C)[C@H](C)C1 ZINC001207284145 968719944 /nfs/dbraw/zinc/71/99/44/968719944.db2.gz KIERBJURAMPPAC-OLZOCXBDSA-N 2 0 242.407 2.074 20 0 BEADRP CC[C@@H]1CC[N@H+](CC(C)(C)C[NH+](C)C)C1 ZINC001207284955 968720160 /nfs/dbraw/zinc/72/01/60/968720160.db2.gz VZENJDBEWSRTCR-GFCCVEGCSA-N 2 0 212.381 2.306 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2CC[C@@H]3CCC[C@H]3C2)CC1 ZINC001207395509 968752403 /nfs/dbraw/zinc/75/24/03/968752403.db2.gz SHCHXBZWVTZPKJ-GJZGRUSLSA-N 2 0 236.403 2.450 20 0 BEADRP C[NH+]1CCC(C[NH+]2CC3CCC(CC3)C2)CC1 ZINC001207399163 968752450 /nfs/dbraw/zinc/75/24/50/968752450.db2.gz FOTHXNZZCCREBY-UHFFFAOYSA-N 2 0 236.403 2.450 20 0 BEADRP C(=C1CC[NH2+]CC1)c1cccc2c[nH+]cn21 ZINC001240878671 968788542 /nfs/dbraw/zinc/78/85/42/968788542.db2.gz MUHSSWNLZAMMIN-UHFFFAOYSA-N 2 0 213.284 2.101 20 0 BEADRP C[C@@H]1C[N@H+](CCC2CC[NH+](C)CC2)C[C@@H]1F ZINC001207479278 968793116 /nfs/dbraw/zinc/79/31/16/968793116.db2.gz DWADZCTWFYOJEB-YPMHNXCESA-N 2 0 228.355 2.008 20 0 BEADRP C[N@H+](CC1CCCC1)C[C@H]1CCCC[NH2+]C1 ZINC000829275122 968825406 /nfs/dbraw/zinc/82/54/06/968825406.db2.gz KLUYVMYNMVUWLQ-AWEZNQCLSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H](CC[NH2+]C1Cc2ccccc2C1)[NH+](C)C ZINC000829318862 968828694 /nfs/dbraw/zinc/82/86/94/968828694.db2.gz AHXPXWIWEFSRKN-LBPRGKRZSA-N 2 0 232.371 2.084 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@@H]([NH2+]CC3(C)CCCC3)[C@@H]2C1 ZINC001207843936 968899480 /nfs/dbraw/zinc/89/94/80/968899480.db2.gz JBODQXVWOWPHTJ-BFHYXJOUSA-N 2 0 236.403 2.497 20 0 BEADRP CCC[C@H](O)C[NH2+]CCCCC[NH+]1CCCC1 ZINC001252804888 968992036 /nfs/dbraw/zinc/99/20/36/968992036.db2.gz ZEMQKWNTOJZOSN-AWEZNQCLSA-N 2 0 242.407 2.003 20 0 BEADRP C[N@H+](CC1(C)CC[NH+](C)CC1)C(C)(C)C ZINC001208107115 969001809 /nfs/dbraw/zinc/00/18/09/969001809.db2.gz NYPLILKTTPVBMD-UHFFFAOYSA-N 2 0 212.381 2.449 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH+]2C[C@H]3CCCC[C@@H]3C2)C1 ZINC001208608726 969160454 /nfs/dbraw/zinc/16/04/54/969160454.db2.gz WJGJKNNQKBKVAA-RRFJBIMHSA-N 2 0 236.403 2.450 20 0 BEADRP CC/C=C\CC[NH+]1CCC2(C[NH+](C)C2)CC1 ZINC001208730622 969216657 /nfs/dbraw/zinc/21/66/57/969216657.db2.gz ZHZFLHALUWUNNK-PLNGDYQASA-N 2 0 222.376 2.370 20 0 BEADRP CC/C=C\CC[NH+]1C[C@H]2C[NH+](CC)C[C@@H]2C1 ZINC001208733019 969218474 /nfs/dbraw/zinc/21/84/74/969218474.db2.gz AOHOZPHBRQQQJX-HLMASZERSA-N 2 0 222.376 2.226 20 0 BEADRP C[C@@H]1C[N@H+](Cc2ccoc2)CCC[C@@H]1C[NH3+] ZINC001205996332 969303749 /nfs/dbraw/zinc/30/37/49/969303749.db2.gz WGQIDGOMUCXZBF-DGCLKSJQSA-N 2 0 222.332 2.086 20 0 BEADRP CC[N@@H+](CCCc1ccncc1)CCC[NH+](C)C ZINC001209189295 969377721 /nfs/dbraw/zinc/37/77/21/969377721.db2.gz IWFFRQFGMLTMAK-UHFFFAOYSA-N 2 0 249.402 2.288 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+][C@@H]1C[C@H]3CC[C@@H]1C3)C2 ZINC001169099737 969393329 /nfs/dbraw/zinc/39/33/29/969393329.db2.gz UMDBHGFOFYKMFD-ZLCQRPCESA-N 2 0 234.387 2.390 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]C[C@@H]1CC[C@@H](F)C1)C2 ZINC001169081534 969403464 /nfs/dbraw/zinc/40/34/64/969403464.db2.gz SRJIUSUQRHWHPA-KSTCHIGDSA-N 2 0 240.366 2.339 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CCCCCC1)C2 ZINC001169124306 969419942 /nfs/dbraw/zinc/41/99/42/969419942.db2.gz BUSBXTGDXRTUOU-BTTYYORXSA-N 2 0 222.376 2.488 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CC[C@](C)(CF)C1)C2 ZINC001169126498 969430868 /nfs/dbraw/zinc/43/08/68/969430868.db2.gz VHCBWORKGPQETO-XJFOESAGSA-N 2 0 240.366 2.293 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1C[C@H]3CCC[C@@H]3C1)C2 ZINC001169126547 969431912 /nfs/dbraw/zinc/43/19/12/969431912.db2.gz WCSDJRGANQPYBN-ZSAUSMIDSA-N 2 0 234.387 2.344 20 0 BEADRP CC[C@@H](C)[N@H+](C)[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169130909 969436503 /nfs/dbraw/zinc/43/65/03/969436503.db2.gz PWAGAJCAABTMGH-FVCCEPFGSA-N 2 0 210.365 2.342 20 0 BEADRP CC[N@H+](C)C1CC[NH+](CCC(C)(C)OC)CC1 ZINC001209409673 969476385 /nfs/dbraw/zinc/47/63/85/969476385.db2.gz SDMFRAGBMYSSSU-UHFFFAOYSA-N 2 0 242.407 2.218 20 0 BEADRP CC[NH+]1CCC(Nc2ccc(CC[NH3+])cc2)CC1 ZINC001169222081 969491648 /nfs/dbraw/zinc/49/16/48/969491648.db2.gz ZZSWGLSUKWSXMR-UHFFFAOYSA-N 2 0 247.386 2.084 20 0 BEADRP CC[NH+]1CCC(Nc2ccc(C[NH2+]C)cc2)CC1 ZINC001169255545 969545353 /nfs/dbraw/zinc/54/53/53/969545353.db2.gz RMHWXJIBGCAWBY-UHFFFAOYSA-N 2 0 247.386 2.302 20 0 BEADRP Cc1ccc(C[N@H+](C)CC2CC[NH+](C)CC2)[nH]1 ZINC001209572954 969555303 /nfs/dbraw/zinc/55/53/03/969555303.db2.gz KROFBSDNKYKGMB-UHFFFAOYSA-N 2 0 235.375 2.097 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+]C1CCc2ccccc2CC1 ZINC001254455742 969647554 /nfs/dbraw/zinc/64/75/54/969647554.db2.gz FQHWTWQWGIEUIY-JKSUJKDBSA-N 2 0 244.382 2.403 20 0 BEADRP C[N@@H+]1CCC[C@@H](NC(=[NH2+])C(C)(C)C)CC1 ZINC001254499712 969658613 /nfs/dbraw/zinc/65/86/13/969658613.db2.gz OFLIPKXWOPFZFR-SNVBAGLBSA-N 2 0 211.353 2.084 20 0 BEADRP C[C@H]1C[C@@H](CF)[N@@H+]([C@@H]2CCC[NH+](C)CC2)C1 ZINC001254516381 969685058 /nfs/dbraw/zinc/68/50/58/969685058.db2.gz MDTGXOWJOBXZAY-XQQFMLRXSA-N 2 0 228.355 2.151 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH+]2CCCC[C@H](F)C2)CC1 ZINC001254516448 969686582 /nfs/dbraw/zinc/68/65/82/969686582.db2.gz MLMMHUPJBRLPSO-QWHCGFSZSA-N 2 0 228.355 2.295 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH+]2CCC(F)(F)CC2)CC1 ZINC001254515657 969692636 /nfs/dbraw/zinc/69/26/36/969692636.db2.gz AKDJNOLFZBGUTR-NSHDSACASA-N 2 0 232.318 2.202 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH+]2C[C@@H]3[C@H](C2)C3(C)C)CC1 ZINC001254524475 969705352 /nfs/dbraw/zinc/70/53/52/969705352.db2.gz CDHOCYGJUHNHRA-UPJWGTAASA-N 2 0 222.376 2.059 20 0 BEADRP [NH3+]Cc1ccn(-c2cc[nH+]c(C3CC3)c2)c1 ZINC001169726155 969819721 /nfs/dbraw/zinc/81/97/21/969819721.db2.gz UJSXRMWPLHCZKF-UHFFFAOYSA-N 2 0 213.284 2.208 20 0 BEADRP CN1CCC[C@@](C)([NH2+]C2Cc3ccccc3C2)C1 ZINC001255018172 969846807 /nfs/dbraw/zinc/84/68/07/969846807.db2.gz HDFLPHJZFBSHJS-MRXNPFEDSA-N 2 0 244.382 2.228 20 0 BEADRP CCCC[N@H+](C)CCC[NH2+][C@H]1CCSC1 ZINC001255269085 970018048 /nfs/dbraw/zinc/01/80/48/970018048.db2.gz YCGWLDOLAGCAEJ-LBPRGKRZSA-N 2 0 230.421 2.204 20 0 BEADRP [NH3+]CCC[C@H]1CCCC[N@@H+]([C@@H]2CCSC2)C1 ZINC001255280324 970033332 /nfs/dbraw/zinc/03/33/32/970033332.db2.gz YYUDMKSOSWSDCI-CHWSQXEVSA-N 2 0 242.432 2.333 20 0 BEADRP CC(C)CCC[C@@H](C)[NH2+]CCC[N@H+](C)CCO ZINC001170073432 970165779 /nfs/dbraw/zinc/16/57/79/970165779.db2.gz KKVNHILQSBTTGP-CQSZACIVSA-N 2 0 244.423 2.105 20 0 BEADRP COC1CCC([NH2+]Cc2ccccc2C[NH3+])CC1 ZINC001255451213 970184093 /nfs/dbraw/zinc/18/40/93/970184093.db2.gz LBAVSRXHHUQNDB-UHFFFAOYSA-N 2 0 248.370 2.193 20 0 BEADRP C[N@@H+]1CCC[C@@H](n2ccc3c2cccc3C[NH3+])C1 ZINC001255467381 970195184 /nfs/dbraw/zinc/19/51/84/970195184.db2.gz BPAHHYLLZNRYAL-CYBMUJFWSA-N 2 0 243.354 2.367 20 0 BEADRP Cn1c[nH+]cc1Nc1ccc2c(c1)C[N@@H+](C)CC2 ZINC001211254726 970199557 /nfs/dbraw/zinc/19/95/57/970199557.db2.gz ZEGWVXYQIALNKE-UHFFFAOYSA-N 2 0 242.326 2.152 20 0 BEADRP CC(C)(C)C1CCC([NH2+]CCOCC[NH3+])CC1 ZINC001255496006 970262617 /nfs/dbraw/zinc/26/26/17/970262617.db2.gz HAIGWBXBCFGQMH-UHFFFAOYSA-N 2 0 242.407 2.156 20 0 BEADRP C[C@H]1CC[C@H]([NH2+]CCCCC[NH+](C)C)C1 ZINC001170098585 970282212 /nfs/dbraw/zinc/28/22/12/970282212.db2.gz ULIAMVBQOKWNPA-STQMWFEESA-N 2 0 212.381 2.497 20 0 BEADRP CC(C)(C)c1cc(-n2c[nH+]cc2N)cc[nH+]1 ZINC001213162741 970286867 /nfs/dbraw/zinc/28/68/67/970286867.db2.gz KRTDZQKCLHYCFX-UHFFFAOYSA-N 2 0 216.288 2.147 20 0 BEADRP C[C@@H]1C[N@H+](CCC2CCCC2)CC[C@H]1C[NH3+] ZINC000300719219 970300892 /nfs/dbraw/zinc/30/08/92/970300892.db2.gz AUMLOZMBKJYSCR-OCCSQVGLSA-N 2 0 224.392 2.483 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]Cc2ccccc2C[NH3+])C1 ZINC001170111196 970322093 /nfs/dbraw/zinc/32/20/93/970322093.db2.gz AYYFJLFPCJHRPG-RISCZKNCSA-N 2 0 218.344 2.424 20 0 BEADRP C[C@@H]1C[C@@H](F)C[N@@H+]1C1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001255674118 970450731 /nfs/dbraw/zinc/45/07/31/970450731.db2.gz KZXWAIWTQSFWRU-LSGALXMHSA-N 2 0 240.366 2.434 20 0 BEADRP Cc1ccc(C[C@@H](C)[NH2+]CCCC[NH3+])cc1 ZINC001255774569 970480734 /nfs/dbraw/zinc/48/07/34/970480734.db2.gz IDTNQJSDXWFFJZ-CYBMUJFWSA-N 2 0 220.360 2.255 20 0 BEADRP CC[C@@H]1C[C@H]([NH2+]CCCCC[NH+](C)C)CCO1 ZINC001170170663 970549980 /nfs/dbraw/zinc/54/99/80/970549980.db2.gz MZDCAQJSYAYTBR-ZIAGYGMSSA-N 2 0 242.407 2.266 20 0 BEADRP CC[NH+](CC)CCN[C@H](C)CC[NH+](CC)CC ZINC001255940207 970568962 /nfs/dbraw/zinc/56/89/62/970568962.db2.gz SRGPBQWLVIXZAF-CQSZACIVSA-N 2 0 243.439 2.038 20 0 BEADRP CC[NH+](CC)CC[C@H](C)N(CCC[NH3+])C(C)C ZINC001255940437 970569959 /nfs/dbraw/zinc/56/99/59/970569959.db2.gz CALIYQBIJQYBGQ-AWEZNQCLSA-N 2 0 243.439 2.166 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]CC1CCC1 ZINC001255940898 970572233 /nfs/dbraw/zinc/57/22/33/970572233.db2.gz IHOKCIGGDYEGOF-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)c1ccncc1)C1CC[NH2+]CC1 ZINC000400359749 970580819 /nfs/dbraw/zinc/58/08/19/970580819.db2.gz PTTUXCSFDPQFGM-NWDGAFQWSA-N 2 0 233.359 2.120 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+][C@H]1CCO[C@@H](C)C1 ZINC001255954369 970586423 /nfs/dbraw/zinc/58/64/23/970586423.db2.gz VOZQLFCSAXSRIX-IHRRRGAJSA-N 2 0 242.407 2.264 20 0 BEADRP CC[C@H]1C[C@@H]([NH2+][C@H]2CCN(C(C)C)C2)CCO1 ZINC001170197488 970592011 /nfs/dbraw/zinc/59/20/11/970592011.db2.gz OUFBVVNXLNBDQB-IHRRRGAJSA-N 2 0 240.391 2.016 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[N@@H+]1CC[C@H](COC)C1 ZINC001255957067 970592727 /nfs/dbraw/zinc/59/27/27/970592727.db2.gz OQVBVLZDVBZQJB-KBPBESRZSA-N 2 0 242.407 2.075 20 0 BEADRP C[C@@H]([NH2+][C@H](C)C(C)(C)C)C1CC[NH2+]CC1 ZINC000400483274 970595401 /nfs/dbraw/zinc/59/54/01/970595401.db2.gz WTAVEFJODIWYHO-GHMZBOCLSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@H](CC1CC1)[NH2+][C@H](C)C1CC[NH2+]CC1 ZINC000400501910 970594834 /nfs/dbraw/zinc/59/48/34/970594834.db2.gz CGHUXMILBJCRBL-GHMZBOCLSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)C(C)(C)C)C1CC[NH2+]CC1 ZINC000400483277 970595999 /nfs/dbraw/zinc/59/59/99/970595999.db2.gz WTAVEFJODIWYHO-MNOVXSKESA-N 2 0 212.381 2.399 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)C1CCC1)C1CC[NH2+]CC1 ZINC000400493268 970596688 /nfs/dbraw/zinc/59/66/88/970596688.db2.gz AFSIUSSOHYEWBC-WDEREUQCSA-N 2 0 210.365 2.153 20 0 BEADRP Cc1cc(NC[C@@H]2CCCC[NH2+]2)cc(C)[nH+]1 ZINC000304450952 970597043 /nfs/dbraw/zinc/59/70/43/970597043.db2.gz VTUSLVVXQUINLL-LBPRGKRZSA-N 2 0 219.332 2.252 20 0 BEADRP C[C@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)C1CCC1 ZINC000400493261 970597272 /nfs/dbraw/zinc/59/72/72/970597272.db2.gz AFSIUSSOHYEWBC-QWRGUYRKSA-N 2 0 210.365 2.153 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[N@@H+]1C[C@H]2[C@H](CF)[C@H]2C1 ZINC001255965999 970600439 /nfs/dbraw/zinc/60/04/39/970600439.db2.gz IYDYPDMOSBLEIG-SYQHCUMBSA-N 2 0 242.382 2.254 20 0 BEADRP C[C@@H]1CC[N@@H+](C2CCN(C)CC2)[C@@H](C)C1 ZINC001256207262 970708072 /nfs/dbraw/zinc/70/80/72/970708072.db2.gz FNLVBRDAKALFDE-NEPJUHHUSA-N 2 0 210.365 2.201 20 0 BEADRP [NH3+]CC1(F)CC[NH+](Cc2ccc(F)cc2)CC1 ZINC001222531946 972549038 /nfs/dbraw/zinc/54/90/38/972549038.db2.gz GODHNLJYAZFGBO-UHFFFAOYSA-N 2 0 240.297 2.089 20 0 BEADRP CCc1ccc(C[NH+]2CCC(F)(C[NH3+])CC2)o1 ZINC001222531602 972549468 /nfs/dbraw/zinc/54/94/68/972549468.db2.gz DPGSLOORXYLECT-UHFFFAOYSA-N 2 0 240.322 2.105 20 0 BEADRP CC[C@H](C)OCC[C@H](C)[N@@H+]1CCC[C@H]([NH3+])CC1 ZINC001246542248 972569196 /nfs/dbraw/zinc/56/91/96/972569196.db2.gz NZNJWVZWNMQXSB-IHRRRGAJSA-N 2 0 242.407 2.393 20 0 BEADRP [NH3+][C@H]1CCC[N@@H+]([C@@H]2Cc3cccc(F)c3C2)CC1 ZINC001246542998 972583565 /nfs/dbraw/zinc/58/35/65/972583565.db2.gz QWZBYFANCUUZIX-QWHCGFSZSA-N 2 0 248.345 2.106 20 0 BEADRP CCC(CC)[N@@H+]1CCC[C@H](C[NH3+])[C@H](C)C1 ZINC001246570829 972845433 /nfs/dbraw/zinc/84/54/33/972845433.db2.gz WAOYUPUOOVKNMF-VXGBXAGGSA-N 2 0 212.381 2.482 20 0 BEADRP C[N@@H+]1CC[C@H](c2ccc(NCC(C)(C)[NH3+])cc2)C1 ZINC001171194482 972847543 /nfs/dbraw/zinc/84/75/43/972847543.db2.gz PCCGITFQHAUPIO-ZDUSSCGKSA-N 2 0 247.386 2.255 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2CCC[C@](C)(F)CC2)CC[NH2+]1 ZINC001246573133 972857594 /nfs/dbraw/zinc/85/75/94/972857594.db2.gz YUBYOFQTQWTFPD-UPJWGTAASA-N 2 0 228.355 2.341 20 0 BEADRP C[C@@]1(C[NH3+])CCC[N@@H+]([C@H]2C[C@H]3C[C@H]3C2)CC1 ZINC001246577792 972895303 /nfs/dbraw/zinc/89/53/03/972895303.db2.gz PPYPWULJAVSTJH-ZOBORPQBSA-N 2 0 222.376 2.236 20 0 BEADRP C[C@@H]1CC[C@@H](C[NH3+])C[N@@H+]1[C@@H]1C[C@@H]2[C@H](C1)C2(C)C ZINC001246594969 973002504 /nfs/dbraw/zinc/00/25/04/973002504.db2.gz WWVVEEDDQJDVLW-ITGHMWBKSA-N 2 0 236.403 2.480 20 0 BEADRP COCC[C@@H]1CCCC[N@@H+]1[C@@H]1CC[NH2+][C@H](C)C1 ZINC001246780991 973086467 /nfs/dbraw/zinc/08/64/67/973086467.db2.gz DBLNNVGKJGDULP-HZSPNIEDSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@@H]1C[C@@H]([N@@H+]2CC[C@@H](c3ccccn3)C2)CC[NH2+]1 ZINC001246791640 973094791 /nfs/dbraw/zinc/09/47/91/973094791.db2.gz HPVMTQRQRWKPPA-MCIONIFRSA-N 2 0 245.370 2.011 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2[C@H](C1)C2(F)F)[C@H]1CCC[NH2+]1 ZINC001328614499 973195972 /nfs/dbraw/zinc/19/59/72/973195972.db2.gz FROQHWGOKSNIEY-MTVMDMGHSA-N 2 0 244.329 2.150 20 0 BEADRP C[C@H]1CC[C@@H]([NH+]2CC3CCC(CC3)C2)C[NH2+]1 ZINC001246881786 973285664 /nfs/dbraw/zinc/28/56/64/973285664.db2.gz JCNKGSVZDFHVCG-GFJIZPEISA-N 2 0 222.376 2.249 20 0 BEADRP C1[NH2+][C@@H]2C[N@@H+](C3CCC4(CCCC4)CC3)C[C@H]12 ZINC001246913949 973446620 /nfs/dbraw/zinc/44/66/20/973446620.db2.gz BQANWVOZPFQZJG-GXTWGEPZSA-N 2 0 234.387 2.393 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2C[C@@H]3C[NH2+]C[C@H]32)CC(C)(C)C1 ZINC001246919613 973479775 /nfs/dbraw/zinc/47/97/75/973479775.db2.gz NPXLIWBUVIXESV-MROQNXINSA-N 2 0 222.376 2.105 20 0 BEADRP CCCC[C@@H](C)N(CCOC)[C@H]1CCC[NH2+]C1 ZINC001246927744 973538088 /nfs/dbraw/zinc/53/80/88/973538088.db2.gz IAJQVYWOROSQFF-KGLIPLIRSA-N 2 0 242.407 2.266 20 0 BEADRP CCCC[C@H](C)N(CCOC)[C@H]1CCC[NH2+]C1 ZINC001246927743 973538235 /nfs/dbraw/zinc/53/82/35/973538235.db2.gz IAJQVYWOROSQFF-KBPBESRZSA-N 2 0 242.407 2.266 20 0 BEADRP Cc1ccccc1NC(=[NH2+])NCCCC[NH+](C)C ZINC001329225794 973584498 /nfs/dbraw/zinc/58/44/98/973584498.db2.gz MTGUZTGGCJJOLS-UHFFFAOYSA-N 2 0 248.374 2.273 20 0 BEADRP C1CC2(C1)CCC[N@@H+](C1CC[NH2+]CC1)C2 ZINC001246942490 973638888 /nfs/dbraw/zinc/63/88/88/973638888.db2.gz PJBGKHRWRBXZMI-UHFFFAOYSA-N 2 0 208.349 2.005 20 0 BEADRP F[C@@H]1CCC[C@H]([NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)C1 ZINC001329499112 973800065 /nfs/dbraw/zinc/80/00/65/973800065.db2.gz ONQLGWRDYWNVCG-ZOBORPQBSA-N 2 0 240.366 2.484 20 0 BEADRP Cc1cc2[nH+]ccn2cc1NC[C@@H]1CCCC[NH2+]1 ZINC001171332966 973860903 /nfs/dbraw/zinc/86/09/03/973860903.db2.gz BFVMPLMNJNNWJV-LBPRGKRZSA-N 2 0 244.342 2.197 20 0 BEADRP [NH3+]C1(c2ccc(NC[C@@H]3CCCC[NH2+]3)cc2)CC1 ZINC001171334229 973872720 /nfs/dbraw/zinc/87/27/20/973872720.db2.gz KJBMIRRDNMCWOR-AWEZNQCLSA-N 2 0 245.370 2.188 20 0 BEADRP C[C@H]1C[C@H](C[N@H+](C)CCC(F)(F)F)CC[NH2+]1 ZINC000235684748 973883860 /nfs/dbraw/zinc/88/38/60/973883860.db2.gz NJHQWIPDOWSIFV-VHSXEESVSA-N 2 0 238.297 2.259 20 0 BEADRP Cc1ccc(CC[C@@H](C)[NH2+][C@@H]2C[C@H]2N)cc1 ZINC001171660655 974122702 /nfs/dbraw/zinc/12/27/02/974122702.db2.gz NNTRVHJGIUPZCV-MRVWCRGKSA-N 2 0 218.344 2.005 20 0 BEADRP N[C@H]1CC[N@H+](CCC2CCCC2)CC[C@@H]1F ZINC001206156913 974327638 /nfs/dbraw/zinc/32/76/38/974327638.db2.gz UFCPOKZPPHJIOO-STQMWFEESA-N 2 0 228.355 2.328 20 0 BEADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1cccnc1)C2 ZINC001172099216 974340575 /nfs/dbraw/zinc/34/05/75/974340575.db2.gz GODRFKZWHKAECZ-QKDCVEJESA-N 2 0 245.370 2.187 20 0 BEADRP CC(C)C[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172100269 974347892 /nfs/dbraw/zinc/34/78/92/974347892.db2.gz NZDICZAMGZSOLY-XYYAHUGASA-N 2 0 210.365 2.247 20 0 BEADRP C[C@H]([NH3+])c1ccn([C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)n1 ZINC001172106283 974369264 /nfs/dbraw/zinc/36/92/64/974369264.db2.gz OUWSTKBOCHXQDI-RVMXOQNASA-N 2 0 248.374 2.091 20 0 BEADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H](n1cccc1C[NH3+])C2 ZINC001172108343 974373738 /nfs/dbraw/zinc/37/37/38/974373738.db2.gz UWPGUHUPNOCERQ-IMRBUKKESA-N 2 0 233.359 2.135 20 0 BEADRP CN1[C@@H]2CCC[C@H]1C[C@@H]([N@H+](C)CC1CC1)C2 ZINC001172115709 974384587 /nfs/dbraw/zinc/38/45/87/974384587.db2.gz ZAJZZLPKKACMRZ-WDNDVIMCSA-N 2 0 222.376 2.344 20 0 BEADRP CN1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC(F)CC1)C2 ZINC001172115732 974386902 /nfs/dbraw/zinc/38/69/02/974386902.db2.gz ZPLVEAYHSQTMLS-BTTYYORXSA-N 2 0 240.366 2.436 20 0 BEADRP CC[N@@H+]1CC[C@@H](Oc2ccc(C[NH+](C)C)cc2)C1 ZINC001225330968 974409098 /nfs/dbraw/zinc/40/90/98/974409098.db2.gz UXPUVDHSNGZARW-OAHLLOKOSA-N 2 0 248.370 2.221 20 0 BEADRP CCCCC[NH2+]C1CC[NH+](CCCOC)CC1 ZINC001172242021 974506614 /nfs/dbraw/zinc/50/66/14/974506614.db2.gz CRSRRGZKUKUEQD-UHFFFAOYSA-N 2 0 242.407 2.267 20 0 BEADRP CC[C@H](C)OCC[C@@H](C)[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC001172321405 974530245 /nfs/dbraw/zinc/53/02/45/974530245.db2.gz KGOQARZDIXJMSC-ZOBORPQBSA-N 2 0 242.407 2.440 20 0 BEADRP Cc1cc(N2CCC[C@]3(CC[N@@H+](C)C3)C2)cc[nH+]1 ZINC001277063965 974642261 /nfs/dbraw/zinc/64/22/61/974642261.db2.gz CUHLZJINYWOQBG-OAHLLOKOSA-N 2 0 245.370 2.312 20 0 BEADRP C[C@@H]([NH2+]CCCC[NH3+])c1cccnc1Cl ZINC001331833847 974829926 /nfs/dbraw/zinc/82/99/26/974829926.db2.gz IWCJDZVXDHXZQG-SECBINFHSA-N 2 0 227.739 2.125 20 0 BEADRP Cc1ccc2c(c1)C[C@@H]([NH2+]CCCC[NH3+])CC2 ZINC001172834334 974952394 /nfs/dbraw/zinc/95/23/94/974952394.db2.gz FEOPJJARMZJQBO-HNNXBMFYSA-N 2 0 232.371 2.181 20 0 BEADRP CO[C@H]1CCC[C@H]([NH2+]CCCCC[NH+](C)C)C1 ZINC001172917513 974965546 /nfs/dbraw/zinc/96/55/46/974965546.db2.gz NINMRWKJFJDKAZ-KBPBESRZSA-N 2 0 242.407 2.266 20 0 BEADRP CCCOC1CCC([N@H+](C)C[C@H](C)C[NH3+])CC1 ZINC001173095117 975019144 /nfs/dbraw/zinc/01/91/44/975019144.db2.gz YXFKAWZJMWSCEQ-IYXRBSQSSA-N 2 0 242.407 2.251 20 0 BEADRP CCCOC1CCC([N@H+](C)C[C@@H](C)C[NH3+])CC1 ZINC001173095116 975020341 /nfs/dbraw/zinc/02/03/41/975020341.db2.gz YXFKAWZJMWSCEQ-HSBZDZAISA-N 2 0 242.407 2.251 20 0 BEADRP CC[NH+](CC)C1CCC([NH2+]C[C@@H]2CCO2)CC1 ZINC001173101620 975022341 /nfs/dbraw/zinc/02/23/41/975022341.db2.gz LLWWDOJFGBBBIG-RUXDESIVSA-N 2 0 240.391 2.018 20 0 BEADRP CCC(=O)C[NH2+]C1CCC([NH+](CC)CC)CC1 ZINC001173108098 975026706 /nfs/dbraw/zinc/02/67/06/975026706.db2.gz XKLMEDBQADBGPZ-UHFFFAOYSA-N 2 0 240.391 2.208 20 0 BEADRP CC[C@H]1CC[C@H]([NH2+][C@H]2CCC[C@H]([NH3+])C2)C1 ZINC001173274301 975155293 /nfs/dbraw/zinc/15/52/93/975155293.db2.gz PISDPAXZQOFEBA-CYDGBPFRSA-N 2 0 210.365 2.425 20 0 BEADRP CCSC[C@H](C)[N@H+](CCC[NH3+])C(C)C ZINC001173293184 975169686 /nfs/dbraw/zinc/16/96/86/975169686.db2.gz XZJMREWWZMIYJJ-NSHDSACASA-N 2 0 218.410 2.187 20 0 BEADRP CCSC[C@@H](C)[NH2+]C(C)(C)C(C)(C)[NH3+] ZINC001173295783 975177347 /nfs/dbraw/zinc/17/73/47/975177347.db2.gz IPPCATKCXFCRGO-SECBINFHSA-N 2 0 218.410 2.234 20 0 BEADRP CCSC[C@@H](C)[N@@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC001173311906 975226093 /nfs/dbraw/zinc/22/60/93/975226093.db2.gz QZDQVNBTCOLVNS-CHWSQXEVSA-N 2 0 242.432 2.156 20 0 BEADRP CC[N@@H+]1CC[C@H](n2cc(C[NH3+])c3ccccc32)C1 ZINC001173348860 975292307 /nfs/dbraw/zinc/29/23/07/975292307.db2.gz UHZTVIAADQJGJR-ZDUSSCGKSA-N 2 0 243.354 2.367 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+]C[C@H]2CCc3ccccc32)C1 ZINC001334754629 976624290 /nfs/dbraw/zinc/62/42/90/976624290.db2.gz QBGSSEMGCBSDME-BNOWGMLFSA-N 2 0 230.355 2.043 20 0 BEADRP C[NH+](C)[C@@H]1CC[C@H]2C[N@H+](CC3(C)CC3)C[C@H]2C1 ZINC001335133583 976858556 /nfs/dbraw/zinc/85/85/56/976858556.db2.gz JLWNSWFLYXVDNE-BFHYXJOUSA-N 2 0 236.403 2.449 20 0 BEADRP C[C@H]([NH2+]C1CCC(C[NH3+])CC1)c1cncs1 ZINC001335254673 976904383 /nfs/dbraw/zinc/90/43/83/976904383.db2.gz UBOSWDCQIWWALW-WHXUTIOJSA-N 2 0 239.388 2.311 20 0 BEADRP Cc1cc(Nc2c[nH+]ccc2N(C)C)cc[nH+]1 ZINC001174652413 976936184 /nfs/dbraw/zinc/93/61/84/976936184.db2.gz WOLGFDPPSQAOJN-UHFFFAOYSA-N 2 0 228.299 2.017 20 0 BEADRP C[C@@H]1C[C@@H](C)C[NH+](CCCNc2cc[nH+]cc2)C1 ZINC001336396534 977660779 /nfs/dbraw/zinc/66/07/79/977660779.db2.gz MGFZMQOLKOGGTC-ZIAGYGMSSA-N 2 0 247.386 2.283 20 0 BEADRP [NH3+]C[C@@H]1CCC[N@H+](CC2Cc3ccccc3C2)C1 ZINC001574270392 1170024284 /nfs/dbraw/zinc/02/42/84/1170024284.db2.gz FFLRDHMLZWWJSS-ZDUSSCGKSA-N 2 0 244.382 2.072 20 0 BEADRP CN(C)c1cc[nH+]cc1Nc1ccc(C[NH3+])cc1 ZINC001175965242 977833580 /nfs/dbraw/zinc/83/35/80/977833580.db2.gz YBXBNTOLCMCHRC-UHFFFAOYSA-N 2 0 242.326 2.350 20 0 BEADRP C[C@@H]1CC[N@@H+]1Cc1cc2c[nH+]ccc2[nH]1 ZINC001232012224 977840529 /nfs/dbraw/zinc/84/05/29/977840529.db2.gz WKMADQLFMQCYER-SECBINFHSA-N 2 0 201.273 2.157 20 0 BEADRP C[N@H+](Cc1cc2c[nH+]ccc2[nH]1)[C@H]1CCCOC1 ZINC001232017867 977846942 /nfs/dbraw/zinc/84/69/42/977846942.db2.gz AEOUKPGMSPWVFZ-ZDUSSCGKSA-N 2 0 245.326 2.174 20 0 BEADRP C[NH+](C)CCOc1ccc(Nc2[nH]cc[nH+]2)cc1 ZINC001176084512 977884909 /nfs/dbraw/zinc/88/49/09/977884909.db2.gz OSHVBTIWZZJAEU-UHFFFAOYSA-N 2 0 246.314 2.094 20 0 BEADRP C[N@@H+]1CCc2ccc(Nc3[nH]cc[nH+]3)cc2C1 ZINC001176090736 977895020 /nfs/dbraw/zinc/89/50/20/977895020.db2.gz PCRJOUKPSUDPJB-UHFFFAOYSA-N 2 0 228.299 2.141 20 0 BEADRP C[NH+](C)[C@@H]1CC[C@@H]2C[N@H+](Cc3ccoc3)C[C@H]2C1 ZINC001336889258 978030597 /nfs/dbraw/zinc/03/05/97/978030597.db2.gz QITRCIQNIMPIFD-RBSFLKMASA-N 2 0 248.370 2.442 20 0 BEADRP Cc1cccnc1N1C[C@@H]2CC[N@H+](C)CC[C@@H]2C1 ZINC001277707351 978255932 /nfs/dbraw/zinc/25/59/32/978255932.db2.gz BGIXPJVSFOGTPZ-OKILXGFUSA-N 2 0 245.370 2.168 20 0 BEADRP C[C@@]1(C[NH3+])CCC[N@H+](CCC2CC2)CC1 ZINC001206293933 978296358 /nfs/dbraw/zinc/29/63/58/978296358.db2.gz HXUDHZROTPCHCR-CYBMUJFWSA-N 2 0 210.365 2.237 20 0 BEADRP Cc1cc(F)cc(N[C@@H]2CC[C@@H]3C[N@@H+](C)C[C@H]23)n1 ZINC001337431701 978333675 /nfs/dbraw/zinc/33/36/75/978333675.db2.gz LURLWJIBIUMBAM-KGYLQXTDSA-N 2 0 249.333 2.281 20 0 BEADRP C[N@@H+]1Cc2ccccc2[C@@H]1CNc1cc[nH+]cc1 ZINC001337726465 978472906 /nfs/dbraw/zinc/47/29/06/978472906.db2.gz ZUMHPHDBGZSPCS-HNNXBMFYSA-N 2 0 239.322 2.102 20 0 BEADRP C[C@@H]1CC[C@H]1[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC001337805553 978504683 /nfs/dbraw/zinc/50/46/83/978504683.db2.gz NFYZBQQHUOKNKX-IJLUTSLNSA-N 2 0 210.365 2.153 20 0 BEADRP c1ncc(C[NH2+]Cc2ccc3c[nH+]cn3c2)s1 ZINC001178917184 978642800 /nfs/dbraw/zinc/64/28/00/978642800.db2.gz VMUWJNUZCDKLCZ-UHFFFAOYSA-N 2 0 244.323 2.081 20 0 BEADRP CC(C)[NH+]1CCC2(C[NH+](Cc3ccc[nH]3)C2)CC1 ZINC001277796863 978655895 /nfs/dbraw/zinc/65/58/95/978655895.db2.gz KYGFBEPVJFVHJA-UHFFFAOYSA-N 2 0 247.386 2.321 20 0 BEADRP C(CC1CCCC1)CN1CC[C@H]2C[NH2+]C[C@H]21 ZINC001235007435 978951030 /nfs/dbraw/zinc/95/10/30/978951030.db2.gz OPHPQDRQDIJNJN-UONOGXRCSA-N 2 0 222.376 2.251 20 0 BEADRP CCCC[C@H](CC)C[N@@H+]1CCC2(C[NH2+]C2)C1 ZINC001235024916 978956553 /nfs/dbraw/zinc/95/65/53/978956553.db2.gz SNZYEYBAAZIHLR-ZDUSSCGKSA-N 2 0 224.392 2.498 20 0 BEADRP CCCC[N@@H+]1CCCC[C@@]12CCC[NH2+]C2 ZINC001235172293 978990226 /nfs/dbraw/zinc/99/02/26/978990226.db2.gz LEHGQRBFQRMRSP-ZDUSSCGKSA-N 2 0 210.365 2.395 20 0 BEADRP CC(C)(C)c1ccc(C[N@H+]2C[C@@H]3[C@@H]([NH3+])[C@@H]3C2)cc1 ZINC001235209628 978995084 /nfs/dbraw/zinc/99/50/84/978995084.db2.gz FFGMLOLVLNMDKO-FICVDOATSA-N 2 0 244.382 2.373 20 0 BEADRP C([C@H]1CCCC[NH2+]1)[N@@H+]1CC[C@@H]2CCC[C@H]2C1 ZINC001235222652 978999433 /nfs/dbraw/zinc/99/94/33/978999433.db2.gz MRCNRQCQPCGDJG-MELADBBJSA-N 2 0 222.376 2.251 20 0 BEADRP CCCCc1ccc(C[N@H+]2C[C@@H]3[C@@H]([NH3+])[C@@H]3C2)cc1 ZINC001235211500 978999900 /nfs/dbraw/zinc/99/99/00/978999900.db2.gz WSNZVCRKRVCWLQ-ZSHCYNCHSA-N 2 0 244.382 2.418 20 0 BEADRP c1nocc1C[NH+]1CCC([C@@H]2CCCC[NH2+]2)CC1 ZINC001235230067 979000539 /nfs/dbraw/zinc/00/05/39/979000539.db2.gz NHIAKHHOHJEBCJ-AWEZNQCLSA-N 2 0 249.358 2.029 20 0 BEADRP CC1=CC[C@@H](CC[N@H+]2C[C@@H]3[C@H]([NH3+])[C@@H]3C2)C1(C)C ZINC001235282680 979018184 /nfs/dbraw/zinc/01/81/84/979018184.db2.gz GTSSRNQIZOKSQN-FQUUOJAGSA-N 2 0 234.387 2.258 20 0 BEADRP CCCC[C@H](CC)C[N@H+]1C[C@@H]2[C@H]([NH3+])[C@@H]2C1 ZINC001235283253 979018425 /nfs/dbraw/zinc/01/84/25/979018425.db2.gz LUBSBRGFOTUZPH-RVMXOQNASA-N 2 0 210.365 2.092 20 0 BEADRP [NH3+]CCCC[N@@H+]1CC[C@H](c2ccc(F)cc2)C1 ZINC001235949273 979220314 /nfs/dbraw/zinc/22/03/14/979220314.db2.gz BTICWVVQVUAXAH-ZDUSSCGKSA-N 2 0 236.334 2.354 20 0 BEADRP Cc1cccc(C[N@H+]2C[C@H]3CC[C@@H](C2)[C@@H]3[NH3+])c1C ZINC001235960525 979229687 /nfs/dbraw/zinc/22/96/87/979229687.db2.gz YSWKOAAOKBVKSH-MUJYYYPQSA-N 2 0 244.382 2.473 20 0 BEADRP CC(C)[N@H+](CCCC[NH3+])CC(=O)c1ccccc1 ZINC001235961342 979232790 /nfs/dbraw/zinc/23/27/90/979232790.db2.gz AFFFMCNGDZNUBX-UHFFFAOYSA-N 2 0 248.370 2.319 20 0 BEADRP C[C@H](C[N@@H+]1C[C@@H]2CC[C@@]2([NH3+])C1)c1ccccc1 ZINC001235976609 979245767 /nfs/dbraw/zinc/24/57/67/979245767.db2.gz AJMBNGWFBNUNCJ-VHDGCEQUSA-N 2 0 230.355 2.213 20 0 BEADRP Cc1ccc(CN2C[C@H]3CC[C@@H](C2)[NH2+]C3)c(C)c1 ZINC001236060314 979349542 /nfs/dbraw/zinc/34/95/42/979349542.db2.gz NXFYGKJDZCEDKL-HOCLYGCPSA-N 2 0 244.382 2.487 20 0 BEADRP [NH3+]CCCC[NH+]1CCC(Cc2ccncc2)CC1 ZINC001236096445 979385038 /nfs/dbraw/zinc/38/50/38/979385038.db2.gz BFGDZWGGWWDNPR-UHFFFAOYSA-N 2 0 247.386 2.075 20 0 BEADRP CCc1cccc(C)c1CN1CCC[C@@H]1C[NH3+] ZINC001236253370 979471130 /nfs/dbraw/zinc/47/11/30/979471130.db2.gz WANGNBHEUGAYHI-CQSZACIVSA-N 2 0 232.371 2.481 20 0 BEADRP C[N@@H+]1CCC[C@H](CC[NH2+][C@@H]2C[C@@H]3CCC[C@H]23)C1 ZINC001182250408 979482435 /nfs/dbraw/zinc/48/24/35/979482435.db2.gz JKLBVZIULVVZSE-CBBWQLFWSA-N 2 0 236.403 2.497 20 0 BEADRP C(C1CCCCC1)[N@H+]1C[C@@H]2CC[NH2+]CC[C@@H]2C1 ZINC001236314141 979526429 /nfs/dbraw/zinc/52/64/29/979526429.db2.gz HJKVWQQEXCDDPJ-GASCZTMLSA-N 2 0 236.403 2.498 20 0 BEADRP Nc1cccc2c1CC[N@H+](CCCCCC[NH3+])C2 ZINC001236353298 979551509 /nfs/dbraw/zinc/55/15/09/979551509.db2.gz GMKWUOYEJUGMPH-UHFFFAOYSA-N 2 0 247.386 2.146 20 0 BEADRP Cc1ccc(C[N@@H+]2CCCC[C@](C)(C[NH3+])C2)[nH]1 ZINC001206549563 979681223 /nfs/dbraw/zinc/68/12/23/979681223.db2.gz OTQRCAKXRBYHDH-CQSZACIVSA-N 2 0 235.375 2.274 20 0 BEADRP Cc1ccnc(C[N@@H+]2CCCC[C@](C)(C[NH3+])C2)c1 ZINC001206549644 979703033 /nfs/dbraw/zinc/70/30/33/979703033.db2.gz PNKCJMQDRJQDAZ-OAHLLOKOSA-N 2 0 247.386 2.341 20 0 BEADRP CS[C@H](C)CC[N@@H+]1CCC[C@](C)([NH3+])CC1 ZINC001205254680 979730783 /nfs/dbraw/zinc/73/07/83/979730783.db2.gz ACGQGHGTXOAZFP-NEPJUHHUSA-N 2 0 230.421 2.331 20 0 BEADRP CSc1cc(C)cc(CN(C)C[C@H](C)[NH3+])c1 ZINC001236908836 979793905 /nfs/dbraw/zinc/79/39/05/979793905.db2.gz LYIRYTKSGONPQX-NSHDSACASA-N 2 0 238.400 2.496 20 0 BEADRP Cc1cc(C[N@@H+]2CCC[C@](C)([NH3+])CC2)ccc1O ZINC001205273060 979831572 /nfs/dbraw/zinc/83/15/72/979831572.db2.gz DDYGHGOLPAJYIB-HNNXBMFYSA-N 2 0 248.370 2.404 20 0 BEADRP Cc1ccc(CCN2CC3(C2)CC[N@@H+](C)C3)cc1 ZINC001278066324 979845835 /nfs/dbraw/zinc/84/58/35/979845835.db2.gz DMVNFHMTMIBUMF-UHFFFAOYSA-N 2 0 244.382 2.175 20 0 BEADRP CCc1cccc(C[N@@H+]2CCC[C@](C)([NH3+])CC2)n1 ZINC001205287936 979929203 /nfs/dbraw/zinc/92/92/03/979929203.db2.gz DUANUYYXFDWFKV-HNNXBMFYSA-N 2 0 247.386 2.347 20 0 BEADRP CNc1ccc(C[N@@H+]2CCC[C@@](C)([NH3+])CC2)cc1 ZINC001205296101 980061520 /nfs/dbraw/zinc/06/15/20/980061520.db2.gz GVWIMXVHHWHEFH-OAHLLOKOSA-N 2 0 247.386 2.432 20 0 BEADRP C[C@@H]1CCC[N@@H+]1Cc1cccc2cncn21 ZINC001238104715 980155398 /nfs/dbraw/zinc/15/53/98/980155398.db2.gz YVETUDQNQPEYGO-LLVKDONJSA-N 2 0 215.300 2.319 20 0 BEADRP C[NH2+]Cc1ccc(C2=CCC[NH2+]CC2)cc1 ZINC001238945798 980382945 /nfs/dbraw/zinc/38/29/45/980382945.db2.gz FJCHCXUBMDSCRM-UHFFFAOYSA-N 2 0 216.328 2.173 20 0 BEADRP C[C@@H]([NH3+])c1ccccc1C1=CCC[NH2+]CC1 ZINC001238951218 980390884 /nfs/dbraw/zinc/39/08/84/980390884.db2.gz UTNYSJDDUGGRNN-LLVKDONJSA-N 2 0 216.328 2.473 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]Cc1ccc2c(c1)CCC2 ZINC001345104197 980550177 /nfs/dbraw/zinc/55/01/77/980550177.db2.gz LBSQLJWHGHXTSM-LBPRGKRZSA-N 2 0 232.371 2.263 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@@H](C)c1ccccc1N(C)C ZINC001345484656 980618809 /nfs/dbraw/zinc/61/88/09/980618809.db2.gz YQCGWCLGEFIUFQ-STQMWFEESA-N 2 0 249.402 2.401 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]Cc1cccc2c1CCC2 ZINC001346138847 980765495 /nfs/dbraw/zinc/76/54/95/980765495.db2.gz KWPZXHWWUXXUFF-GFCCVEGCSA-N 2 0 232.371 2.120 20 0 BEADRP C[C@@H]([NH3+])c1ccccc1-c1cncc(C[NH3+])c1 ZINC001239809410 980950287 /nfs/dbraw/zinc/95/02/87/980950287.db2.gz QEYZPCVKNDAEGA-SNVBAGLBSA-N 2 0 227.311 2.227 20 0 BEADRP CC(C)CC[N@@H+]1CC[C@@H](C)[C@H](C[NH3+])CC1 ZINC001205601377 981162153 /nfs/dbraw/zinc/16/21/53/981162153.db2.gz DYELBMKBBNTSGJ-OLZOCXBDSA-N 2 0 212.381 2.339 20 0 BEADRP Cc1cccc(C[N@H+]2CC[C@@H](C)[C@@H](C[NH3+])CC2)n1 ZINC001205602651 981166242 /nfs/dbraw/zinc/16/62/42/981166242.db2.gz KXUPRQMEQNUAEM-TZMCWYRMSA-N 2 0 247.386 2.197 20 0 BEADRP c1cc2cccc(C[NH+]3C[C@H]4C[NH2+]C[C@@H]4C3)c2o1 ZINC001347782798 981170623 /nfs/dbraw/zinc/17/06/23/981170623.db2.gz VMWIWPJCJJEHPF-ZIAGYGMSSA-N 2 0 242.322 2.084 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]Cc1c(C)cccc1C ZINC001348516037 981381648 /nfs/dbraw/zinc/38/16/48/981381648.db2.gz RTYJLCXQXUBCES-ZDUSSCGKSA-N 2 0 220.360 2.391 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]C/C=C/c1ccc(F)cc1 ZINC001348515442 981382021 /nfs/dbraw/zinc/38/20/21/981382021.db2.gz MQVQNLZNVMECKQ-PCAWENJQSA-N 2 0 236.334 2.427 20 0 BEADRP [NH3+]C1(c2ccc(C3=CC[NH2+]CC3)cc2)CCC1 ZINC001240466800 981401016 /nfs/dbraw/zinc/40/10/16/981401016.db2.gz HVYIJABTOMNMOE-UHFFFAOYSA-N 2 0 228.339 2.401 20 0 BEADRP C[C@H]([NH3+])c1ccccc1C1=CC[NH2+]CC1 ZINC001240468574 981403591 /nfs/dbraw/zinc/40/35/91/981403591.db2.gz HPMCGLIRKZHZRN-JTQLQIEISA-N 2 0 202.301 2.083 20 0 BEADRP c1ncc(C2=CC[NH2+]CC2)cc1C[NH+]1CCCC1 ZINC001240469595 981405099 /nfs/dbraw/zinc/40/50/99/981405099.db2.gz DXAXBVBOLWCPPT-UHFFFAOYSA-N 2 0 243.354 2.054 20 0 BEADRP CC(C)([NH3+])c1ccc(C2=CCC[NH2+]C2)cc1 ZINC001240670029 981580761 /nfs/dbraw/zinc/58/07/61/981580761.db2.gz CFAYAQYTWRLEPH-UHFFFAOYSA-N 2 0 216.328 2.257 20 0 BEADRP [NH3+]C1(c2cccc(C3=CCC[NH2+]C3)c2)CC1 ZINC001240671437 981582838 /nfs/dbraw/zinc/58/28/38/981582838.db2.gz WWRCROWRLILJAE-UHFFFAOYSA-N 2 0 214.312 2.011 20 0 BEADRP CC(C)[C@@H](C)[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000159024547 981633116 /nfs/dbraw/zinc/63/31/16/981633116.db2.gz HXWXDTRLERSIDM-GFCCVEGCSA-N 2 0 224.392 2.495 20 0 BEADRP c1ccc(C[NH2+]C[C@@H]2CCC[NH2+]CC2)cc1 ZINC001580893180 981723907 /nfs/dbraw/zinc/72/39/07/981723907.db2.gz WKRKUOOGYPWNOT-CQSZACIVSA-N 2 0 218.344 2.166 20 0 BEADRP C(c1cccc2c1C[NH2+]CC2)=C1CC[NH2+]CC1 ZINC001240877296 981925837 /nfs/dbraw/zinc/92/58/37/981925837.db2.gz SOLKQWZPAZCOCQ-UHFFFAOYSA-N 2 0 228.339 2.099 20 0 BEADRP C[C@@H]1[C@H]2CC[C@@H](C[C@@H]1[NH2+][C@H]1CCC[C@@H](F)C1)[NH2+]2 ZINC001350959277 982136901 /nfs/dbraw/zinc/13/69/01/982136901.db2.gz XNODQIRSFIWCIY-WCQYUDONSA-N 2 0 240.366 2.386 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1C[C@@H]2CC[C@@H]([NH+](C)C)C[C@@H]2C1 ZINC001352110515 982474274 /nfs/dbraw/zinc/47/42/74/982474274.db2.gz COIRXVSKMMVWBF-XLWJZTARSA-N 2 0 236.403 2.305 20 0 BEADRP CCC(CC)C[N@@H+]1C[C@H]2CC[NH+](C)C[C@H]2C1 ZINC001196782448 982493632 /nfs/dbraw/zinc/49/36/32/982493632.db2.gz QWTOIJWORXVLOI-KGLIPLIRSA-N 2 0 224.392 2.306 20 0 BEADRP C[NH+]1CCc2ccc(C3=CC[N@H+](C)CC3)cc2C1 ZINC001241331450 982494987 /nfs/dbraw/zinc/49/49/87/982494987.db2.gz AOQKKDQKFMZREQ-UHFFFAOYSA-N 2 0 242.366 2.393 20 0 BEADRP C[C@@H]1CC[C@H](C[NH3+])N(CCCC(F)(F)F)C1 ZINC001205807281 982574196 /nfs/dbraw/zinc/57/41/96/982574196.db2.gz ZNIQEHYDLXCXPS-NXEZZACHSA-N 2 0 238.297 2.388 20 0 BEADRP CNc1ccccc1CN1C[C@H](C)CC[C@H]1C[NH3+] ZINC001205838161 982697799 /nfs/dbraw/zinc/69/77/99/982697799.db2.gz BABYIKWGRISICC-OCCSQVGLSA-N 2 0 247.386 2.288 20 0 BEADRP C[NH2+]Cc1ccc(C2=CCC[N@H+](C)C2)cc1 ZINC001241570985 982821871 /nfs/dbraw/zinc/82/18/71/982821871.db2.gz SMKNXIHJOFEKJR-UHFFFAOYSA-N 2 0 216.328 2.125 20 0 BEADRP C[N@@H+]1CCC=C(c2ccc3c(c2)C[NH2+]C3)C1 ZINC001241570650 982823928 /nfs/dbraw/zinc/82/39/28/982823928.db2.gz MZYDMWQRNZDIAE-UHFFFAOYSA-N 2 0 214.312 2.009 20 0 BEADRP C[N@@H+]1CCC=C(c2ccc3c(c2)[C@@H]([NH3+])CC3)C1 ZINC001241572509 982827028 /nfs/dbraw/zinc/82/70/28/982827028.db2.gz ZKUCSLLAIKPJHC-HNNXBMFYSA-N 2 0 228.339 2.352 20 0 BEADRP C1=CC[C@H](C[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)CC1 ZINC000037408317 982942591 /nfs/dbraw/zinc/94/25/91/982942591.db2.gz LKDBLTXRTTVDRA-KBPBESRZSA-N 2 0 234.387 2.417 20 0 BEADRP CCCC[NH+](CCCC)CCC[NH2+]C[C@H](C)O ZINC001251970003 983056581 /nfs/dbraw/zinc/05/65/81/983056581.db2.gz DLGKIULNNJVCEF-AWEZNQCLSA-N 2 0 244.423 2.249 20 0 BEADRP c1cc(NC[C@H]2CC[N@@H+]2C2CCCCC2)cc[nH+]1 ZINC001354032516 983120374 /nfs/dbraw/zinc/12/03/74/983120374.db2.gz XBTBIXVPTOXBRJ-OAHLLOKOSA-N 2 0 245.370 2.322 20 0 BEADRP CCC(CC)C[N@@H+]1C[C@H]2C[C@@]2(C[NH+](C)C)C1 ZINC001201536345 983292733 /nfs/dbraw/zinc/29/27/33/983292733.db2.gz YZZLKNAAEJNXBX-ZIAGYGMSSA-N 2 0 224.392 2.306 20 0 BEADRP CCC[N@H+]1C[C@@H]2C[NH+](C[C@@H](C)CC)C[C@@H]2C1 ZINC001201516847 983315434 /nfs/dbraw/zinc/31/54/34/983315434.db2.gz DMKPZFXLMQXTJJ-MELADBBJSA-N 2 0 224.392 2.306 20 0 BEADRP CN1CCC[C@H]2C[N@H+](CCc3ccccc3)C[C@H]21 ZINC001201606095 983374366 /nfs/dbraw/zinc/37/43/66/983374366.db2.gz IJZYYHDXBSEGEN-JKSUJKDBSA-N 2 0 244.382 2.255 20 0 BEADRP C[NH+]1CCC2(C[NH+](CCC(C)(C)C)C2)CC1 ZINC001202096829 983557878 /nfs/dbraw/zinc/55/78/78/983557878.db2.gz WDYOMDZKXHMRQY-UHFFFAOYSA-N 2 0 224.392 2.450 20 0 BEADRP CCC[NH+]1C[C@@H]2C[NH+](CC3CCCC3)C[C@H]2C1 ZINC001202189993 983592476 /nfs/dbraw/zinc/59/24/76/983592476.db2.gz ITCUICMXDQUHHD-HUUCEWRRSA-N 2 0 236.403 2.450 20 0 BEADRP CCC[NH+]1C[C@H]2C[NH+](CC3CCCC3)C[C@@H]2C1 ZINC001202189991 983595712 /nfs/dbraw/zinc/59/57/12/983595712.db2.gz ITCUICMXDQUHHD-GJZGRUSLSA-N 2 0 236.403 2.450 20 0 BEADRP CCC[C@H](O)C[NH2+]CCC[N@@H+]1CCCC[C@@H]1C ZINC001252799424 983896009 /nfs/dbraw/zinc/89/60/09/983896009.db2.gz RUVOTADGHHSVMH-KBPBESRZSA-N 2 0 242.407 2.002 20 0 BEADRP C[C@H](C[C@H]1CCC[NH2+]1)[NH2+][C@@H]1C[C@H]1[C@@H]1C[C@H]1C ZINC001575941031 984136482 /nfs/dbraw/zinc/13/64/82/984136482.db2.gz HKNNBYSPOVQFKS-UCKQBZRPSA-N 2 0 222.376 2.151 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@H]1CC[C@@H]2CCC[C@@H]21 ZINC001575953421 984137775 /nfs/dbraw/zinc/13/77/75/984137775.db2.gz ZUIOYFFXOKGGSV-CYDGBPFRSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@@]2(C)CC[NH2+]C2)C[C@@H]1C ZINC001576669905 984178751 /nfs/dbraw/zinc/17/87/51/984178751.db2.gz BZEFTJBPYCDNRQ-RFGFWPKPSA-N 2 0 224.392 2.400 20 0 BEADRP CCC[C@@H](C[N@H+](CCC)C1CC[NH2+]CC1)OC ZINC001577357750 984193982 /nfs/dbraw/zinc/19/39/82/984193982.db2.gz IWXZAPRTDCWLEA-AWEZNQCLSA-N 2 0 242.407 2.266 20 0 BEADRP Cc1ccc(C2=CC[NH2+]CC2)c(C[NH+](C)C)c1 ZINC001240470644 984304025 /nfs/dbraw/zinc/30/40/25/984304025.db2.gz NVCRVMYFGBIHAG-UHFFFAOYSA-N 2 0 230.355 2.433 20 0 BEADRP [NH3+][C@H]1CCc2ccc(C3=CC[NH2+]CC3)cc21 ZINC001240470407 984304038 /nfs/dbraw/zinc/30/40/38/984304038.db2.gz FYNIZRRLPAZFNH-AWEZNQCLSA-N 2 0 214.312 2.009 20 0 BEADRP CC[N@@H+]1Cc2ccccc2C2(CC[NH+](C)CC2)C1 ZINC001275084786 984477384 /nfs/dbraw/zinc/47/73/84/984477384.db2.gz FXRFTTAQPSTZKH-UHFFFAOYSA-N 2 0 244.382 2.486 20 0 BEADRP C1=C(c2ccc([C@H]3CCC[NH2+]3)cc2)C[NH2+]C1 ZINC001243110257 984566022 /nfs/dbraw/zinc/56/60/22/984566022.db2.gz DMZUBQIVXOQRSF-CQSZACIVSA-N 2 0 214.312 2.098 20 0 BEADRP C[N@@H+]1CC[C@H](c2ccc(C3=CC[NH2+]C3)cc2)C1 ZINC001243115483 984587967 /nfs/dbraw/zinc/58/79/67/984587967.db2.gz MGEYQZHAPMWCQZ-HNNXBMFYSA-N 2 0 228.339 2.092 20 0 BEADRP CC(C)[NH2+]CC[NH2+]C1C[C@@H](C)C[C@H](C)C1 ZINC000719345227 984635173 /nfs/dbraw/zinc/63/51/73/984635173.db2.gz HKHXUZSARKWJPA-RYUDHWBXSA-N 2 0 212.381 2.399 20 0 BEADRP [NH3+]CCCC[N@@H+]1CCC[C@@H]1c1nccs1 ZINC000710598914 984808261 /nfs/dbraw/zinc/80/82/61/984808261.db2.gz WRIGTVYBDQEDRM-SNVBAGLBSA-N 2 0 225.361 2.019 20 0 BEADRP Cl/C=C\C[N@@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001326801156 984823579 /nfs/dbraw/zinc/82/35/79/984823579.db2.gz UENXWPGAIBKTAE-KXFIGUGUSA-N 2 0 228.767 2.205 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H]1CCO[C@H](c2ccccc2)C1 ZINC001256799568 984840042 /nfs/dbraw/zinc/84/00/42/984840042.db2.gz VFPQOPOZDXYIDU-SNPRPXQTSA-N 2 0 248.370 2.091 20 0 BEADRP CCOc1ccc(C[NH2+][C@@H](C)CC[NH3+])c(C)c1 ZINC001578179331 984868906 /nfs/dbraw/zinc/86/89/06/984868906.db2.gz CEQRWANERFMWEB-LBPRGKRZSA-N 2 0 236.359 2.221 20 0 BEADRP CCC(CC)[N@@H+]1C[C@H]2C[C@@]2(C[NH+](C)C)C1 ZINC001257303997 984875767 /nfs/dbraw/zinc/87/57/67/984875767.db2.gz WSKOTUNQQGFPIA-DGCLKSJQSA-N 2 0 210.365 2.059 20 0 BEADRP CCC[C@H](C)[NH+]1C[C@H]2C[NH+](CC)C[C@@H]2C1 ZINC001257326534 984897193 /nfs/dbraw/zinc/89/71/93/984897193.db2.gz BITQQQYMGOOJSK-YNEHKIRRSA-N 2 0 210.365 2.059 20 0 BEADRP CCC(C)(C)CC[NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32 ZINC000686307630 985105778 /nfs/dbraw/zinc/10/57/78/985105778.db2.gz ZAHOVVDQGWYJQX-QSLWVIQJSA-N 2 0 236.403 2.399 20 0 BEADRP C[N@H+](Cc1ccc2scnc2c1)C1CC([NH3+])C1 ZINC001578490098 985122034 /nfs/dbraw/zinc/12/20/34/985122034.db2.gz ALHPFFVKQBCLIT-UHFFFAOYSA-N 2 0 247.367 2.218 20 0 BEADRP C[NH2+]C[C@H](C)[NH2+]CC1(CCOC)CCCCC1 ZINC001578638353 985245871 /nfs/dbraw/zinc/24/58/71/985245871.db2.gz LVXQUPRXGYMFDO-ZDUSSCGKSA-N 2 0 242.407 2.171 20 0 BEADRP CSCC[C@H](C)[N@H+](C)C[C@@H]1CC[C@H]([NH3+])C1 ZINC000156891169 985281228 /nfs/dbraw/zinc/28/12/28/985281228.db2.gz QKRRSZBTHZLPGR-TUAOUCFPSA-N 2 0 230.421 2.187 20 0 BEADRP C[NH2+]CCC[N@H+](C)C[C@@H]1CCc2ccccc2C1 ZINC001578687339 985292616 /nfs/dbraw/zinc/29/26/16/985292616.db2.gz JLNAXIPBKQELBK-CQSZACIVSA-N 2 0 246.398 2.333 20 0 BEADRP C[NH2+]CCC[N@H+](C)CCCCOC(C)(C)C ZINC001578687241 985300254 /nfs/dbraw/zinc/30/02/54/985300254.db2.gz CQVAFKYQCXFBRB-UHFFFAOYSA-N 2 0 230.396 2.123 20 0 BEADRP CC(C)C[C@@H](C)C[C@@H](C)[NH2+]CCOCC[NH3+] ZINC001258054407 985355531 /nfs/dbraw/zinc/35/55/31/985355531.db2.gz COFHZKFJBRPKOZ-CHWSQXEVSA-N 2 0 230.396 2.012 20 0 BEADRP CC(C)=CCC[C@@H](C)NC(=[NH2+])SCC[NH3+] ZINC001258075548 985381373 /nfs/dbraw/zinc/38/13/73/985381373.db2.gz COSBJGQHWKHDNI-SNVBAGLBSA-N 2 0 229.393 2.338 20 0 BEADRP CC[C@H](C)[NH2+]Cc1cc2c(s1)CC[NH2+]C2 ZINC000688037623 985507015 /nfs/dbraw/zinc/50/70/15/985507015.db2.gz CBXAJTUESJRZSM-VIFPVBQESA-N 2 0 224.373 2.282 20 0 BEADRP CO[C@]1(C)CCC[N@H+](CCC[NH2+]C2CC2)CC1 ZINC001578925086 985527961 /nfs/dbraw/zinc/52/79/61/985527961.db2.gz ZIQXLSUKPJRSHM-CQSZACIVSA-N 2 0 240.391 2.020 20 0 BEADRP CO[C@@H]1CCC[C@H]([NH2+]CCC[NH2+]C(C)C)CC1 ZINC001578936991 985544885 /nfs/dbraw/zinc/54/48/85/985544885.db2.gz HQJDNLGMVMNZFZ-UONOGXRCSA-N 2 0 242.407 2.312 20 0 BEADRP CO[C@@H]1CCC[C@H]([NH2+]CCCCCC[NH3+])CC1 ZINC001578938370 985551919 /nfs/dbraw/zinc/55/19/19/985551919.db2.gz SKMXMHJTHBKNQM-UONOGXRCSA-N 2 0 242.407 2.443 20 0 BEADRP C(=C/C1CC[NH2+]CC1)\c1[nH+]ccc2c1CCN2 ZINC001243891527 985554878 /nfs/dbraw/zinc/55/48/78/985554878.db2.gz BFHOANBGWAMBQH-OWOJBTEDSA-N 2 0 229.327 2.062 20 0 BEADRP CSCC[C@@H](C)[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC001258199962 985605942 /nfs/dbraw/zinc/60/59/42/985605942.db2.gz LXXROOYSMKWHQP-CHWSQXEVSA-N 2 0 244.448 2.450 20 0 BEADRP CSC(C)(C)C[C@H](C)[NH2+]CCCC[NH3+] ZINC001258320767 985803631 /nfs/dbraw/zinc/80/36/31/985803631.db2.gz CPORBIVZOMQLPV-JTQLQIEISA-N 2 0 218.410 2.235 20 0 BEADRP CSC(C)(C)C[C@H](C)[NH2+][C@@H]1CCC[C@@H]1[NH3+] ZINC001258331393 985809603 /nfs/dbraw/zinc/80/96/03/985809603.db2.gz NJQWBRYBLQDXFN-GARJFASQSA-N 2 0 230.421 2.376 20 0 BEADRP COc1ccc(C[N@@H+]2CC[C@@](C)(C[NH3+])C2)c(C)c1 ZINC001579212573 985822140 /nfs/dbraw/zinc/82/21/40/985822140.db2.gz FDDGPZROOOYABB-HNNXBMFYSA-N 2 0 248.370 2.174 20 0 BEADRP CSC1(C[NH2+]CC[C@H]2CCC[NH2+]CC2)CC1 ZINC001579364838 985860337 /nfs/dbraw/zinc/86/03/37/985860337.db2.gz CIBNGBRCZAJVPR-LBPRGKRZSA-N 2 0 242.432 2.251 20 0 BEADRP C[C@@H]([NH2+]CCC1C[NH2+]C1)c1cccs1 ZINC001579414918 985886882 /nfs/dbraw/zinc/88/68/82/985886882.db2.gz YZODUVKCSPXGFK-SECBINFHSA-N 2 0 210.346 2.008 20 0 BEADRP C[C@@H]1C[N@H+](C[C@@H]2CCc3ccccc3C2)C[C@H]1[NH3+] ZINC001579439961 985930331 /nfs/dbraw/zinc/93/03/31/985930331.db2.gz FTVLUYALSINRQS-XJKCOSOUSA-N 2 0 244.382 2.071 20 0 BEADRP [NH3+]C[C@@H]1CCCC[N@H+](C[C@H]2C[C@H]3C=C[C@@H]2C3)C1 ZINC001206606777 985939368 /nfs/dbraw/zinc/93/93/68/985939368.db2.gz SKGZWBPAJLSXAK-BYNSBNAKSA-N 2 0 234.387 2.259 20 0 BEADRP Cc1cc(C)cc(CC[NH2+]C[C@H]2C[C@H]([NH3+])C2)c1 ZINC001579580300 986094314 /nfs/dbraw/zinc/09/43/14/986094314.db2.gz VBSWOFYTHCDPRN-SHTZXODSSA-N 2 0 232.371 2.173 20 0 BEADRP F[C@H]1CCCC[C@H]1[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC001461679047 986107563 /nfs/dbraw/zinc/10/75/63/986107563.db2.gz UKOXHEIBSBABER-YIYPIFLZSA-N 2 0 240.366 2.484 20 0 BEADRP Cc1cc(C[N@@H+]2C[C@@H]3CCC[C@]3(C[NH3+])C2)c(C)o1 ZINC001579598216 986108335 /nfs/dbraw/zinc/10/83/35/986108335.db2.gz JUCHEUAVCMCREJ-GJZGRUSLSA-N 2 0 248.370 2.457 20 0 BEADRP Cc1cc(C[NH2+][C@@H](C)C2CC[NH2+]CC2)cc(C)n1 ZINC001579600728 986108558 /nfs/dbraw/zinc/10/85/58/986108558.db2.gz BNQOMHOKJSYDDM-ZDUSSCGKSA-N 2 0 247.386 2.176 20 0 BEADRP CC[C@H](C)C[C@H](CC)NC(=[NH2+])NCCCC[NH3+] ZINC001258780030 986170263 /nfs/dbraw/zinc/17/02/63/986170263.db2.gz JHNGZKSPLFJAKZ-RYUDHWBXSA-N 2 0 242.411 2.054 20 0 BEADRP Cc1ccc(C[C@@H](C)[NH2+]C[C@@H]2C[NH2+]C[C@H]2C)cc1 ZINC001579684538 986178726 /nfs/dbraw/zinc/17/87/26/986178726.db2.gz IUXXODGMDJIFTR-FMKPAKJESA-N 2 0 246.398 2.371 20 0 BEADRP Cc1ccccc1CC1C[NH+](CC2(C[NH3+])CC2)C1 ZINC001579798037 986224918 /nfs/dbraw/zinc/22/49/18/986224918.db2.gz VRBJIVVUFDBXHY-UHFFFAOYSA-N 2 0 244.382 2.208 20 0 BEADRP CC[C@H]1C[N@H+](CCCCCC[NH3+])C[C@H](C)O1 ZINC000689190736 986384966 /nfs/dbraw/zinc/38/49/66/986384966.db2.gz MUTHBKLIEHYMGQ-STQMWFEESA-N 2 0 228.380 2.005 20 0 BEADRP Fc1ccc(CC[NH+]2CC3(C2)CC[NH2+]CC3)cc1 ZINC001580030803 986435543 /nfs/dbraw/zinc/43/55/43/986435543.db2.gz SNXUUTVWFKOKPG-UHFFFAOYSA-N 2 0 248.345 2.054 20 0 BEADRP Fc1ccc(CC[N@@H+]2CCC23CC[NH2+]CC3)cc1 ZINC001580030466 986436646 /nfs/dbraw/zinc/43/66/46/986436646.db2.gz NJHVWJZQGDGAEY-UHFFFAOYSA-N 2 0 248.345 2.196 20 0 BEADRP FCC[C@H]1CCC[N@H+](C[C@@H]2CCCC[NH2+]C2)C1 ZINC000689443495 986609403 /nfs/dbraw/zinc/60/94/03/986609403.db2.gz AVGCHCGNLPASQN-ZIAGYGMSSA-N 2 0 242.382 2.448 20 0 BEADRP FC1CC[NH+](Cc2ccc3c(c2)C[NH2+]CC3)CC1 ZINC000689461834 986622358 /nfs/dbraw/zinc/62/23/58/986622358.db2.gz MGLQLOOXFMEZLV-UHFFFAOYSA-N 2 0 248.345 2.266 20 0 BEADRP [NH3+][C@@]12CCC[C@H]1CN(CCc1ccccc1F)C2 ZINC001580158832 986627164 /nfs/dbraw/zinc/62/71/64/986627164.db2.gz XWLXKWMNEHQWFP-DZGCQCFKSA-N 2 0 248.345 2.181 20 0 BEADRP [NH3+][C@]12CCC[C@H]1CN(Cc1ccc(CF)cc1)C2 ZINC001580157746 986627815 /nfs/dbraw/zinc/62/78/15/986627815.db2.gz LRGJACPGFUAPFV-GJZGRUSLSA-N 2 0 248.345 2.469 20 0 BEADRP [NH3+][C@]12CCC[C@@H]1CN(CCc1ccccc1F)C2 ZINC001580158833 986631259 /nfs/dbraw/zinc/63/12/59/986631259.db2.gz XWLXKWMNEHQWFP-HIFRSBDPSA-N 2 0 248.345 2.181 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH+]2CCC[C@H](F)CC2)CC1 ZINC001254517561 986654432 /nfs/dbraw/zinc/65/44/32/986654432.db2.gz VKZZPMXRRGCDMA-STQMWFEESA-N 2 0 228.355 2.295 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH+]2CCC[C@@H](F)CC2)CC1 ZINC001254517559 986654760 /nfs/dbraw/zinc/65/47/60/986654760.db2.gz VKZZPMXRRGCDMA-OLZOCXBDSA-N 2 0 228.355 2.295 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH+]2CC[C@](C)(CF)C2)CC1 ZINC001254515984 986655020 /nfs/dbraw/zinc/65/50/20/986655020.db2.gz ICGJJGDNLROAPS-CHWSQXEVSA-N 2 0 228.355 2.152 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH+]2CC3(C2)CCCC3)CC1 ZINC001254519779 986659748 /nfs/dbraw/zinc/65/97/48/986659748.db2.gz KIGPHJMSGRGHMU-ZDUSSCGKSA-N 2 0 222.376 2.347 20 0 BEADRP [NH3+]CC1CC[NH+]([C@H]2C[C@@H]2c2cccc(F)c2)CC1 ZINC001580265434 986717483 /nfs/dbraw/zinc/71/74/83/986717483.db2.gz IUEAAJJSLCGMAK-CABCVRRESA-N 2 0 248.345 2.352 20 0 BEADRP [NH3+]CC[C@@H]1CC[N@H+](Cc2cccn2C(F)F)C1 ZINC001580288356 986730309 /nfs/dbraw/zinc/73/03/09/986730309.db2.gz KBBIJTVEGCXPEP-SNVBAGLBSA-N 2 0 243.301 2.054 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[NH2+][C@@H]2CC3CCC2CC3)C1 ZINC001580389178 986814621 /nfs/dbraw/zinc/81/46/21/986814621.db2.gz BSURNOWIEHQPKM-IYIPPKHMSA-N 2 0 222.376 2.282 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[NH2+][C@H](c2ccccn2)C2CC2)C1 ZINC001580389543 986816671 /nfs/dbraw/zinc/81/66/71/986816671.db2.gz NZDPBPUMVHVSQP-LNSITVRQSA-N 2 0 245.370 2.250 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+]CCC2Cc3ccccc3C2)C1 ZINC001580421251 986840023 /nfs/dbraw/zinc/84/00/23/986840023.db2.gz FYPPVUHTLGQSHI-AKAXFMLLSA-N 2 0 244.382 2.118 20 0 BEADRP CCCC[C@@H](C)N(CC[NH3+])CC[NH+](CC)CC ZINC001255312907 986906200 /nfs/dbraw/zinc/90/62/00/986906200.db2.gz BMGYQXSMUOVCMR-CQSZACIVSA-N 2 0 243.439 2.168 20 0 BEADRP C[C@H]([NH3+])c1ccc(-c2ccncc2C[NH3+])cc1 ZINC001245556939 986942683 /nfs/dbraw/zinc/94/26/83/986942683.db2.gz BYJWPZIIKKZHNO-JTQLQIEISA-N 2 0 227.311 2.227 20 0 BEADRP CC[NH+](CC)[C@H]1CC[C@H]([NH2+][C@H](C)COC)CC1 ZINC001255566099 987021679 /nfs/dbraw/zinc/02/16/79/987021679.db2.gz AUOYMOQFZZLGHY-MGPQQGTHSA-N 2 0 242.407 2.264 20 0 BEADRP CCCOCC[NH2+][C@H](C)CC[NH+](CC)CC ZINC001255946459 987088913 /nfs/dbraw/zinc/08/89/13/987088913.db2.gz VKLYJPRHKLAXOO-CYBMUJFWSA-N 2 0 230.396 2.123 20 0 BEADRP CCCCC[C@H](O)C[N@@H+]1CCC[C@@](C)([NH3+])CC1 ZINC001246020323 987306407 /nfs/dbraw/zinc/30/64/07/987306407.db2.gz KQOVEPXQNLBHEW-UONOGXRCSA-N 2 0 242.407 2.131 20 0 BEADRP CC(C)(F)CC[NH2+][C@@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C ZINC000693713040 987312320 /nfs/dbraw/zinc/31/23/20/987312320.db2.gz MDQHRPAXQYDVFG-GRYCIOLGSA-N 2 0 242.382 2.491 20 0 BEADRP CC/C=C/C[NH2+][C@@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C ZINC000693718023 987313804 /nfs/dbraw/zinc/31/38/04/987313804.db2.gz BNLWSIMJJCNHEV-OBEQCATISA-N 2 0 222.376 2.319 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H]2CCCC[C@H]2C2CC2)CC1 ZINC000695988522 987338515 /nfs/dbraw/zinc/33/85/15/987338515.db2.gz SUTJKBLPCBWVST-NWDGAFQWSA-N 2 0 208.349 2.036 20 0 BEADRP C[C@H]([NH2+]CC(C)(C)C(C)(F)F)[C@@H]1CCC[NH2+]1 ZINC000696597700 987343530 /nfs/dbraw/zinc/34/35/30/987343530.db2.gz KAXPLWZGFZAGHE-UWVGGRQHSA-N 2 0 234.334 2.398 20 0 BEADRP C[C@@H]([NH2+]CC(C)(C)C(C)(F)F)[C@@H]1CCC[NH2+]1 ZINC000696597706 987345213 /nfs/dbraw/zinc/34/52/13/987345213.db2.gz KAXPLWZGFZAGHE-ZJUUUORDSA-N 2 0 234.334 2.398 20 0 BEADRP C[N@H+](C[C@H]1CCCC[NH2+]C1)CC(C)(C)C ZINC000697050644 987345912 /nfs/dbraw/zinc/34/59/12/987345912.db2.gz FAYQBNNNYTVKNS-LBPRGKRZSA-N 2 0 212.381 2.354 20 0 BEADRP C[C@@H]1CC[C@H](C)[N@H+](C[C@@H]2CCCC[NH2+]C2)C1 ZINC000697052751 987347752 /nfs/dbraw/zinc/34/77/52/987347752.db2.gz QJPMGXYWYNNUTE-HZSPNIEDSA-N 2 0 224.392 2.497 20 0 BEADRP C(C1CC1)[NH+](CC1CC1)C[C@H]1CCCC[NH2+]C1 ZINC000697063032 987348761 /nfs/dbraw/zinc/34/87/61/987348761.db2.gz LXDAEEYMVUSKLA-HNNXBMFYSA-N 2 0 236.403 2.498 20 0 BEADRP C[C@H]1CC(F)(F)CC[N@@H+]1C[C@@H]1CCCC[NH2+]C1 ZINC000697640482 987362263 /nfs/dbraw/zinc/36/22/63/987362263.db2.gz GPYSLCKTCIYFSV-NWDGAFQWSA-N 2 0 246.345 2.496 20 0 BEADRP [NH3+]CCCCCCCC[NH2+][C@H]1CCC[NH2+]CC1 ZINC001246080365 987372012 /nfs/dbraw/zinc/37/20/12/987372012.db2.gz NNHSASCUPFWOOK-AWEZNQCLSA-N 3 0 241.423 2.017 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CCCCCCCC[NH3+])CN1 ZINC001246079528 987372964 /nfs/dbraw/zinc/37/29/64/987372964.db2.gz KPVSASALKWWMFN-KGLIPLIRSA-N 2 0 241.423 2.016 20 0 BEADRP CC1(C[NH2+][C@H]2CCCC[NH2+]C2)CCCC1 ZINC001246083083 987378283 /nfs/dbraw/zinc/37/82/83/987378283.db2.gz SRGUKOAJPITULJ-LBPRGKRZSA-N 2 0 210.365 2.298 20 0 BEADRP CSCC[C@H](C)[NH2+]C[C@@H]1CC[C@@H](C)[NH2+]C1 ZINC001246099002 987413992 /nfs/dbraw/zinc/41/39/92/987413992.db2.gz QYDFQXGMGDCZIQ-GRYCIOLGSA-N 2 0 230.421 2.106 20 0 BEADRP CSCC[C@H](C)[NH2+]C[C@@H]1CC[C@H](C)C[NH2+]1 ZINC001246105087 987431678 /nfs/dbraw/zinc/43/16/78/987431678.db2.gz LPXKMCODMYXWNF-SRVKXCTJSA-N 2 0 230.421 2.106 20 0 BEADRP CSCC[C@H](C)[NH2+]C[C@H]1CCC[NH2+][C@H]1C ZINC001246110950 987444663 /nfs/dbraw/zinc/44/46/63/987444663.db2.gz MYUAWGLFQXCBBP-SDDRHHMPSA-N 2 0 230.421 2.106 20 0 BEADRP [NH3+]Cc1cn([C@@H]2CCC[NH2+]C2)c2ccccc12 ZINC001246111361 987445436 /nfs/dbraw/zinc/44/54/36/987445436.db2.gz YRPSWFHIRSHRQL-GFCCVEGCSA-N 2 0 229.327 2.025 20 0 BEADRP C[C@@H]1C[NH2+]C[C@@H]1C[NH2+][C@H]1CCCC(C)(C)C1 ZINC001246111711 987446359 /nfs/dbraw/zinc/44/63/59/987446359.db2.gz PYEZZNQHHHXZHC-UPJWGTAASA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H]1C[C@H](N[C@@H]2CCOc3ccccc32)CC[NH2+]1 ZINC001246115019 987453935 /nfs/dbraw/zinc/45/39/35/987453935.db2.gz QAMLMHVGCZMTFY-OUCADQQQSA-N 2 0 246.354 2.240 20 0 BEADRP C[C@@H]1CC[C@H](n2ccc3c2cccc3C[NH3+])C[NH2+]1 ZINC001246114396 987455946 /nfs/dbraw/zinc/45/59/46/987455946.db2.gz MBZBIHKNNMWKOG-YPMHNXCESA-N 2 0 243.354 2.413 20 0 BEADRP [NH3+]Cc1cccc2c1ccn2[C@@H]1CCC[NH2+]C1 ZINC001246115288 987456048 /nfs/dbraw/zinc/45/60/48/987456048.db2.gz RIRCFUFKNCGZOF-GFCCVEGCSA-N 2 0 229.327 2.025 20 0 BEADRP C[C@H]1CC[C@H](n2ccc3c2cccc3C[NH3+])C[NH2+]1 ZINC001246114385 987456135 /nfs/dbraw/zinc/45/61/35/987456135.db2.gz MBZBIHKNNMWKOG-AAEUAGOBSA-N 2 0 243.354 2.413 20 0 BEADRP CC(C)C[NH+]1CCC(Nc2cc[nH+]cc2)CC1 ZINC001116177703 987463708 /nfs/dbraw/zinc/46/37/08/987463708.db2.gz UREPYCVBYJCNCK-UHFFFAOYSA-N 2 0 233.359 2.036 20 0 BEADRP CC[C@H](CC(C)C)[NH2+][C@H]1C[NH2+]CC12CC2 ZINC001246132901 987481108 /nfs/dbraw/zinc/48/11/08/987481108.db2.gz NGDGHAAUPZMWDP-NEPJUHHUSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2[C@@H]3C[C@H]2C[NH2+]C3)CC(C)(C)C1 ZINC001246145929 987501573 /nfs/dbraw/zinc/50/15/73/987501573.db2.gz GFYFXSDTJBDMMA-DGTMBMJNSA-N 2 0 236.403 2.399 20 0 BEADRP CCCCC[C@H](CC)[NH2+][C@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001246149919 987508076 /nfs/dbraw/zinc/50/80/76/987508076.db2.gz VCUMPBYJDWGCJZ-RVMXOQNASA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)C[C@H](C)C[C@H](C)[NH2+][C@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001246150685 987512432 /nfs/dbraw/zinc/51/24/32/987512432.db2.gz XLPXBTNZQBOPPA-YHQUGGNUSA-N 2 0 224.392 2.255 20 0 BEADRP C[C@H]1C[C@H](n2c(C[NH3+])cc3ccccc32)CC[NH2+]1 ZINC001246164801 987528048 /nfs/dbraw/zinc/52/80/48/987528048.db2.gz BKOUPDQUXQWDBC-WCQYABFASA-N 2 0 243.354 2.413 20 0 BEADRP [NH3+]Cc1cc2ccccc2n1[C@H]1CCC[NH2+]C1 ZINC001246164641 987528439 /nfs/dbraw/zinc/52/84/39/987528439.db2.gz ACYYNBWVYUQBKY-LBPRGKRZSA-N 2 0 229.327 2.025 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC[NH2+][C@@H](C)C1)c1ccccc1 ZINC001246174262 987543147 /nfs/dbraw/zinc/54/31/47/987543147.db2.gz FCPUWTXTUUUBFP-OUCADQQQSA-N 2 0 218.344 2.478 20 0 BEADRP C[C@H]1C[C@H]([NH2+]C/C=C/c2ccccc2)CC[NH2+]1 ZINC001246177741 987548118 /nfs/dbraw/zinc/54/81/18/987548118.db2.gz DNAQQCYVDJKOBX-FFAUQURTSA-N 2 0 230.355 2.430 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[NH2+]C(C)(C)C1)c1cccc(N)c1 ZINC001246178002 987550402 /nfs/dbraw/zinc/55/04/02/987550402.db2.gz XNMSHELSWXSERG-SMDDNHRTSA-N 2 0 247.386 2.450 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C[C@@H]2CCC[NH2+]2)C[C@H]1C ZINC001246196365 987589885 /nfs/dbraw/zinc/58/98/85/987589885.db2.gz WFELSUDSWVFUSN-LPWJVIDDSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C[C@@H]2CCC[NH2+]2)C[C@@H]1C ZINC001246196366 987590604 /nfs/dbraw/zinc/59/06/04/987590604.db2.gz WFELSUDSWVFUSN-XQHKEYJVSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@H](C)OCC[C@H](C)[NH2+]C[C@H]1CCC[NH2+]C1 ZINC001246198240 987592638 /nfs/dbraw/zinc/59/26/38/987592638.db2.gz OBJXNTOMAHAYRA-IHRRRGAJSA-N 2 0 242.407 2.169 20 0 BEADRP CC1(C)[C@@H]2C[C@H]([NH2+][C@@H]3CCC[C@@H]([NH3+])C3)C[C@@H]21 ZINC001246203645 987600565 /nfs/dbraw/zinc/60/05/65/987600565.db2.gz CDWUZRJZGFAUHU-NJMOYASZSA-N 2 0 222.376 2.281 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[NH2+][C@H](C)C1)c1ccc(O)cc1 ZINC001246205127 987600750 /nfs/dbraw/zinc/60/07/50/987600750.db2.gz RQCCQHWSPPBTIQ-MDZLAQPJSA-N 2 0 234.343 2.183 20 0 BEADRP CCCCCC[C@@H](C)[NH2+][C@@H]1CC[NH2+]C[C@H]1OC ZINC001246217179 987614825 /nfs/dbraw/zinc/61/48/25/987614825.db2.gz FLAHNLOJDASICT-MGPQQGTHSA-N 2 0 242.407 2.312 20 0 BEADRP C[C@H](CCCC(C)(C)O)[NH2+][C@H]1CC[NH2+][C@H](C)C1 ZINC001246230727 987629274 /nfs/dbraw/zinc/62/92/74/987629274.db2.gz LLTSJXCPBKRQKN-UPJWGTAASA-N 2 0 242.407 2.046 20 0 BEADRP C[C@H](CCCC(C)(C)O)[NH2+][C@@H]1CC[NH2+][C@H](C)C1 ZINC001246230724 987630154 /nfs/dbraw/zinc/63/01/54/987630154.db2.gz LLTSJXCPBKRQKN-JHJVBQTASA-N 2 0 242.407 2.046 20 0 BEADRP CC[C@H]([NH2+][C@H]1CC[NH2+][C@H](C)C1)c1cccnc1 ZINC001246240657 987642785 /nfs/dbraw/zinc/64/27/85/987642785.db2.gz SSGUVKUBVZBWMC-XBFCOCLRSA-N 2 0 233.359 2.263 20 0 BEADRP c1[nH]c2ccccc2c1C[NH2+][C@@H]1CCC[NH2+]CC1 ZINC001246242719 987645997 /nfs/dbraw/zinc/64/59/97/987645997.db2.gz GXSKFCNURLXKLO-CYBMUJFWSA-N 2 0 243.354 2.400 20 0 BEADRP CC[C@H]1CC(NCCC(C)(C)[NH3+])C[C@H](CC)[NH2+]1 ZINC001246273704 987669665 /nfs/dbraw/zinc/66/96/65/987669665.db2.gz QNYQVQFZGHGTNS-RYUDHWBXSA-N 2 0 241.423 2.013 20 0 BEADRP CC[C@@H]1C[C@@H](NCCC(C)(C)[NH3+])C[C@H](CC)[NH2+]1 ZINC001246273659 987670947 /nfs/dbraw/zinc/67/09/47/987670947.db2.gz QNYQVQFZGHGTNS-CLLJXQQHSA-N 2 0 241.423 2.013 20 0 BEADRP Fc1ccc([C@H]2C[C@H]2[NH2+]C2CC[NH2+]CC2)cc1 ZINC001246278980 987672541 /nfs/dbraw/zinc/67/25/41/987672541.db2.gz CPQCVYPKYPPUIW-ZIAGYGMSSA-N 2 0 234.318 2.023 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2C[C@H]2c2ccc(F)cc2)CC[NH2+]1 ZINC001246283667 987677489 /nfs/dbraw/zinc/67/74/89/987677489.db2.gz XENXYSUKPLCSPY-RABLLNBGSA-N 2 0 248.345 2.412 20 0 BEADRP Cc1cccc(C(=[NH2+])N[C@H]2CC[C@H](C)[NH2+]C2)c1 ZINC001246285310 987678787 /nfs/dbraw/zinc/67/87/87/987678787.db2.gz RJACSVCMGLWXEA-AAEUAGOBSA-N 2 0 231.343 2.050 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC[NH2+][C@@H](C)C1)c1ccc(N)cc1 ZINC001246293241 987687269 /nfs/dbraw/zinc/68/72/69/987687269.db2.gz BCZHUSBJKRLQRR-MISXGVKJSA-N 2 0 233.359 2.060 20 0 BEADRP CC[C@H]([NH3+])CCNC1C[C@@H](CC)[NH2+][C@H](CC)C1 ZINC001246303946 987702244 /nfs/dbraw/zinc/70/22/44/987702244.db2.gz BMKGONXEVGHFFZ-YNEHKIRRSA-N 2 0 241.423 2.013 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@H]1CCc2cc(F)ccc2C1 ZINC001246305870 987703076 /nfs/dbraw/zinc/70/30/76/987703076.db2.gz OMVDLMYTWMATPA-HZMBPMFUSA-N 2 0 236.334 2.010 20 0 BEADRP CC[NH+](CC)CCOCC[NH2+]CCC(C)(C)C ZINC001474423629 987719623 /nfs/dbraw/zinc/71/96/23/987719623.db2.gz KSUPETCJHMGQTO-UHFFFAOYSA-N 2 0 244.423 2.371 20 0 BEADRP [NH3+]Cc1cccc2ccn(C3CC[NH2+]CC3)c21 ZINC001246322455 987728200 /nfs/dbraw/zinc/72/82/00/987728200.db2.gz ACTQQFYKJNNMTB-UHFFFAOYSA-N 2 0 229.327 2.025 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H](c2cccnc2)C2CC2)CC[NH2+]1 ZINC001246325510 987732113 /nfs/dbraw/zinc/73/21/13/987732113.db2.gz ASEVCPXHEVMUSF-DFBGVHRSSA-N 2 0 245.370 2.263 20 0 BEADRP C[C@H]1CC[C@H](n2ccc3cccc(C[NH3+])c32)C[NH2+]1 ZINC001246327679 987734918 /nfs/dbraw/zinc/73/49/18/987734918.db2.gz UFECQAPVCAIQLH-FZMZJTMJSA-N 2 0 243.354 2.413 20 0 BEADRP Cc1cccc2c1CC[C@@H]([NH2+]C[C@H]([NH3+])C(C)C)C2 ZINC001246332893 987739433 /nfs/dbraw/zinc/73/94/33/987739433.db2.gz NWSQISJVHZDECV-ZBFHGGJFSA-N 2 0 246.398 2.425 20 0 BEADRP Cc1ccc2c(c1)C[C@H]([NH2+]C[C@H]([NH3+])C(C)C)CC2 ZINC001246332566 987740207 /nfs/dbraw/zinc/74/02/07/987740207.db2.gz NPLXSJPKVPAWEB-CVEARBPZSA-N 2 0 246.398 2.425 20 0 BEADRP CC[NH+]1CCC(C[NH2+]CC[C@@H](C)F)CC1 ZINC001474543527 987756708 /nfs/dbraw/zinc/75/67/08/987756708.db2.gz XXXIKEDROWOCHB-LLVKDONJSA-N 2 0 216.344 2.056 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+][C@H]2CC[NH2+][C@@H](C)C2)CC1 ZINC001246358627 987768746 /nfs/dbraw/zinc/76/87/46/987768746.db2.gz GAZAVGXSJNBHAV-RVMXOQNASA-N 2 0 210.365 2.295 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CC2Cc3ccccc3C2)CC[NH2+]1 ZINC001246378648 987775024 /nfs/dbraw/zinc/77/50/24/987775024.db2.gz XXVHFXVHSSFDOW-WBMJQRKESA-N 2 0 244.382 2.132 20 0 BEADRP CC(C)(CC1CC1)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC001246394196 987783862 /nfs/dbraw/zinc/78/38/62/987783862.db2.gz RMOMNQCDFMCCHW-FUNVUKJBSA-N 2 0 222.376 2.438 20 0 BEADRP CCCCCC[C@H](CCC)[NH2+]CCNCC[NH3+] ZINC001246406656 987788118 /nfs/dbraw/zinc/78/81/18/987788118.db2.gz UGVFSHSFSCLILL-AWEZNQCLSA-N 2 0 243.439 2.263 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@H]2CCc3ccccc32)CC[NH2+]1 ZINC001246421631 987796265 /nfs/dbraw/zinc/79/62/65/987796265.db2.gz SGSGQUMGIHZLLZ-BPLDGKMQSA-N 2 0 244.382 2.447 20 0 BEADRP C[C@H]1C[C@H]([NH2+]C(C)(C)Cc2cccnc2)CC[NH2+]1 ZINC001246444650 987802537 /nfs/dbraw/zinc/80/25/37/987802537.db2.gz AQQFKANOXJMZHH-GXTWGEPZSA-N 2 0 247.386 2.133 20 0 BEADRP FC(F)(F)C1CCC([NH2+][C@H]2CC23C[NH2+]C3)CC1 ZINC001246444262 987803194 /nfs/dbraw/zinc/80/31/94/987803194.db2.gz JNIMCBIABUUDAG-RTBKNWGFSA-N 2 0 248.292 2.059 20 0 BEADRP CC[C@H](C[C@@H](C)CC)[NH2+][C@@H]1CC12C[NH2+]C2 ZINC001246445288 987804150 /nfs/dbraw/zinc/80/41/50/987804150.db2.gz NSVMTLAYDUHRQA-QJPTWQEYSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]C[C@@H]2C[NH+]3CCC2CC3)C1 ZINC001474735454 987814693 /nfs/dbraw/zinc/81/46/93/987814693.db2.gz PHRWVRCLQJLYOZ-YUELXQCFSA-N 2 0 236.403 2.497 20 0 BEADRP CC[C@H](CC(C)C)[NH2+]CCC[NH2+]CCCC[NH3+] ZINC001246458048 987817621 /nfs/dbraw/zinc/81/76/21/987817621.db2.gz RJTVDFIHTUCKQI-CQSZACIVSA-N 3 0 243.439 2.119 20 0 BEADRP c1ccc2c(c1)CCC[C@@H]2C[NH2+][C@H]1CCCNC1 ZINC001246463368 987822157 /nfs/dbraw/zinc/82/21/57/987822157.db2.gz DIHSQBAFKFEACC-CABCVRRESA-N 2 0 244.382 2.448 20 0 BEADRP C[C@H]1CCC[C@@H]([NH2+]C[C@@H]2CC[NH2+]C[C@@H]2F)C1 ZINC001246477314 987835279 /nfs/dbraw/zinc/83/52/79/987835279.db2.gz NWICJZDNJAXNNZ-RVMXOQNASA-N 2 0 228.355 2.102 20 0 BEADRP [NH3+]Cc1cc2cccc(F)c2n1[C@@H]1CCC[NH2+]C1 ZINC001246479447 987838925 /nfs/dbraw/zinc/83/89/25/987838925.db2.gz SQDXUGACJYDQQQ-LLVKDONJSA-N 2 0 247.317 2.164 20 0 BEADRP CC[C@H]1CC[C@H]([NH2+]C[C@@H]2CC[NH2+]C[C@@H]2F)C1 ZINC001246478955 987839197 /nfs/dbraw/zinc/83/91/97/987839197.db2.gz ZUGITFQXVUXFOI-CYDGBPFRSA-N 2 0 228.355 2.102 20 0 BEADRP CCCC(C[NH3+])(CCC)N[C@@H]1CC[NH2+][C@H](C)C1 ZINC001246494048 987846660 /nfs/dbraw/zinc/84/66/60/987846660.db2.gz CTWBEPNOSCACRN-CHWSQXEVSA-N 2 0 241.423 2.014 20 0 BEADRP Cc1cncc([C@@H]([NH2+]C2CC[NH2+]CC2)C2CC2)c1 ZINC001246513377 987861805 /nfs/dbraw/zinc/86/18/05/987861805.db2.gz DRXGEWYPPRHBHI-HNNXBMFYSA-N 2 0 245.370 2.183 20 0 BEADRP CC(C)[NH+](C(C)C)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC001246521294 987867714 /nfs/dbraw/zinc/86/77/14/987867714.db2.gz YTFJKUVXZGYUEI-FUNVUKJBSA-N 2 0 210.365 2.388 20 0 BEADRP CCC[N@H+]([C@H](C)CC)[C@H](C)CC[NH2+]C ZINC001246526807 987879950 /nfs/dbraw/zinc/87/99/50/987879950.db2.gz CRIXAFALJCJEMQ-VXGBXAGGSA-N 2 0 200.370 2.495 20 0 BEADRP CC(C)OCC[C@@H](C)[N@@H+]1CCC[C@@H]([NH3+])CC1 ZINC001246538410 987899905 /nfs/dbraw/zinc/89/99/05/987899905.db2.gz BVMVTEZYKXIRQR-CHWSQXEVSA-N 2 0 228.380 2.003 20 0 BEADRP CC(C)COCC[C@H](C)[N@@H+]1CCC[C@H]([NH3+])CC1 ZINC001246541810 987914078 /nfs/dbraw/zinc/91/40/78/987914078.db2.gz NSEKRSUTZPXJSL-KBPBESRZSA-N 2 0 242.407 2.251 20 0 BEADRP C[C@H]1C[N@@H+](C2C[C@H](C)C[C@@H](C)C2)C[C@H]1C[NH3+] ZINC001246544698 987918983 /nfs/dbraw/zinc/91/89/83/987918983.db2.gz YCTKIPWPYCQRNU-FVCCEPFGSA-N 2 0 224.392 2.338 20 0 BEADRP C[C@@H](Cc1ccco1)[N@@H+]1CCC[C@@](C)([NH3+])CC1 ZINC001246547895 987929327 /nfs/dbraw/zinc/92/93/27/987929327.db2.gz CZWUYTFNVDVXFN-GXTWGEPZSA-N 2 0 236.359 2.414 20 0 BEADRP C[C@@H](Cc1cccnc1)[N@@H+]1CCC[C@](C)([NH3+])CC1 ZINC001246548274 987933366 /nfs/dbraw/zinc/93/33/66/987933366.db2.gz FIIQWBBCFLKCNA-ZFWWWQNUSA-N 2 0 247.386 2.216 20 0 BEADRP C[C@H](Cc1cccnc1)[N@@H+]1CCC[C@@](C)([NH3+])CC1 ZINC001246548273 987933887 /nfs/dbraw/zinc/93/38/87/987933887.db2.gz FIIQWBBCFLKCNA-UKRRQHHQSA-N 2 0 247.386 2.216 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2CCC[C@@](C)([NH3+])CC2)C1 ZINC001246549966 987947735 /nfs/dbraw/zinc/94/77/35/987947735.db2.gz IXCDXLRHZATUQO-FRRDWIJNSA-N 2 0 210.365 2.378 20 0 BEADRP CCC[C@@H](C)[N@@H+]1CCC[C@](F)(C[NH3+])CC1 ZINC001246553603 987959829 /nfs/dbraw/zinc/95/98/29/987959829.db2.gz ZKEOBOMTQCNKBM-VXGBXAGGSA-N 2 0 216.344 2.328 20 0 BEADRP CC1(C)CC[C@@H]([N@@H+]2CCC(F)(F)[C@@H](C[NH3+])C2)C1 ZINC001246553310 987960887 /nfs/dbraw/zinc/96/08/87/987960887.db2.gz AUEMDAXSVSUTQF-WDEREUQCSA-N 2 0 246.345 2.481 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]C[C@@H](C)c1ccccc1 ZINC001117954025 987967857 /nfs/dbraw/zinc/96/78/57/987967857.db2.gz XGXFJFZYAUAIRU-OLZOCXBDSA-N 2 0 220.360 2.378 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]Cc1cccc2cnccc21 ZINC001117953136 987969904 /nfs/dbraw/zinc/96/99/04/987969904.db2.gz ARINSJDWDZUUIU-GFCCVEGCSA-N 2 0 243.354 2.180 20 0 BEADRP [NH3+]C[C@H]1CC[C@@H]([NH2+]Cc2ccc3c(c2)CCC3)C1 ZINC001118015861 987981086 /nfs/dbraw/zinc/98/10/86/987981086.db2.gz NURYQDXRMDAZRT-BLLLJJGKSA-N 2 0 244.382 2.392 20 0 BEADRP C[C@@H]1CC[C@@H]([N@@H+]2CCC(F)(F)[C@H](C[NH3+])C2)C1 ZINC001246559823 987986602 /nfs/dbraw/zinc/98/66/02/987986602.db2.gz TZIRKJMWUMGSHA-GMTAPVOTSA-N 2 0 232.318 2.091 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]Cc1ccc2cnccc2c1 ZINC001118020019 987986752 /nfs/dbraw/zinc/98/67/52/987986752.db2.gz SYFAVMMNPQSCCE-GFCCVEGCSA-N 2 0 243.354 2.180 20 0 BEADRP CCCC[C@H](C)[N@@H+]1CCC(F)(F)[C@H](C[NH3+])C1 ZINC001246561637 987990653 /nfs/dbraw/zinc/99/06/53/987990653.db2.gz RLWGXQJROKCINW-WDEREUQCSA-N 2 0 234.334 2.481 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H](C)c1ccc2c(c1)COC2 ZINC001118057301 987994739 /nfs/dbraw/zinc/99/47/39/987994739.db2.gz CKLQRQADWYAYGC-VXGBXAGGSA-N 2 0 248.370 2.365 20 0 BEADRP CCC[C@H](C)[N@@H+]1CC[C@@H](C)[C@H](C[NH3+])CC1 ZINC001246561915 987996444 /nfs/dbraw/zinc/99/64/44/987996444.db2.gz USPCKZLEKUXPRL-AGIUHOORSA-N 2 0 212.381 2.482 20 0 BEADRP CCCC[C@@H](C)[N@@H+]1CCC(F)(F)[C@@H](C[NH3+])C1 ZINC001246561635 987997696 /nfs/dbraw/zinc/99/76/96/987997696.db2.gz RLWGXQJROKCINW-MNOVXSKESA-N 2 0 234.334 2.481 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H]1CCc2c1cccc2F ZINC001118060122 987999438 /nfs/dbraw/zinc/99/94/38/987999438.db2.gz WHLNQSTWAYMGCC-YGRLFVJLSA-N 2 0 236.334 2.401 20 0 BEADRP CCSC[C@H](C)[N@@H+]1CCC[C@@H](C[NH3+])[C@@H](C)C1 ZINC001246563593 988001256 /nfs/dbraw/zinc/00/12/56/988001256.db2.gz RZQZVGUMTJUMJC-AVGNSLFASA-N 2 0 244.448 2.435 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H](C)c1ccc(C)nc1C ZINC001118058477 988001947 /nfs/dbraw/zinc/00/19/47/988001947.db2.gz KONKVPAVUFVXRY-ZYHUDNBSSA-N 2 0 235.375 2.347 20 0 BEADRP C[C@@H]1CC[N@@H+](C2CC[NH2+]CC2)CCC1(F)F ZINC001246563003 988006572 /nfs/dbraw/zinc/00/65/72/988006572.db2.gz BXVLVDZXORPUQI-SNVBAGLBSA-N 2 0 232.318 2.106 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2CC[C@@H](C)C(F)(F)CC2)CC[NH2+]1 ZINC001246563955 988012833 /nfs/dbraw/zinc/01/28/33/988012833.db2.gz DMGBCWRJVBQELN-IJLUTSLNSA-N 2 0 246.345 2.494 20 0 BEADRP C[C@@H]1C[N@@H+](C2CCSCC2)CCC[C@@H]1C[NH3+] ZINC001246564962 988017626 /nfs/dbraw/zinc/01/76/26/988017626.db2.gz GWVNVMNDNQAXHU-VXGBXAGGSA-N 2 0 242.432 2.189 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@@H]1CCc2ccccc21 ZINC001118122348 988020677 /nfs/dbraw/zinc/02/06/77/988020677.db2.gz UTRSXJOEETWLRV-SMDDNHRTSA-N 2 0 218.344 2.262 20 0 BEADRP C[C@@H]1C[C@@H]([N@@H+]2CC[C@@H](C)C(F)(F)CC2)CC[NH2+]1 ZINC001246563962 988021354 /nfs/dbraw/zinc/02/13/54/988021354.db2.gz DMGBCWRJVBQELN-UTUOFQBUSA-N 2 0 246.345 2.494 20 0 BEADRP Cc1cccc2c1CC[C@@H]([N@@H+]1C[C@@H](C)[C@H]([NH3+])C1)C2 ZINC001246568235 988036034 /nfs/dbraw/zinc/03/60/34/988036034.db2.gz QJCJTLUQMLOXAE-XNRPHZJLSA-N 2 0 244.382 2.131 20 0 BEADRP C[C@@H]1C[C@@H]([N@@H+]2CCCC[C@@](C)(F)C2)CC[NH2+]1 ZINC001246571610 988054384 /nfs/dbraw/zinc/05/43/84/988054384.db2.gz DMCFKPUVUHPLSN-FRRDWIJNSA-N 2 0 228.355 2.341 20 0 BEADRP C[C@@H]1C[N@@H+]([C@@H]2C[C@H]3C[C@H]3C2)CCC[C@@H]1C[NH3+] ZINC001246571782 988065780 /nfs/dbraw/zinc/06/57/80/988065780.db2.gz WYZLHAYFWBAYGA-XGFWRYKXSA-N 2 0 222.376 2.092 20 0 BEADRP C[C@@H]1C[C@@H]([N@@H+]2CCC[C@](C)(C[NH3+])CC2)CCO1 ZINC001246576615 988080020 /nfs/dbraw/zinc/08/00/20/988080020.db2.gz LTSHHWBNKMLITL-RDBSUJKOSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2CCC[C@@](C)(C[NH3+])CC2)CCO1 ZINC001246576614 988085671 /nfs/dbraw/zinc/08/56/71/988085671.db2.gz LTSHHWBNKMLITL-MGPQQGTHSA-N 2 0 240.391 2.005 20 0 BEADRP CCSC[C@@H](C)[N@@H+]1CCCC[C@H](C[NH3+])C1 ZINC001246582509 988109158 /nfs/dbraw/zinc/10/91/58/988109158.db2.gz NCWSZHBRWQODCA-VXGBXAGGSA-N 2 0 230.421 2.189 20 0 BEADRP C[C@]1(C[NH3+])CCCC[N@@H+](C2CCCC2)C1 ZINC001246583927 988126629 /nfs/dbraw/zinc/12/66/29/988126629.db2.gz LSJXYXLYZJMCSO-CYBMUJFWSA-N 2 0 210.365 2.380 20 0 BEADRP CC1(C)[C@@H]2C[C@@H]([N@@H+]3CCCC[C@@H](C[NH3+])C3)C[C@@H]21 ZINC001246584950 988133398 /nfs/dbraw/zinc/13/33/98/988133398.db2.gz XBBWFQLWPIYKRX-XDQVBPFNSA-N 2 0 236.403 2.482 20 0 BEADRP CC1(C[NH3+])C[NH+](C2CCc3ccccc3CC2)C1 ZINC001246588085 988155124 /nfs/dbraw/zinc/15/51/24/988155124.db2.gz BUJSDPQZYQEYMV-UHFFFAOYSA-N 2 0 244.382 2.215 20 0 BEADRP CCCOC1CCC([NH+]2CC(C)(C[NH3+])C2)CC1 ZINC001246591729 988177952 /nfs/dbraw/zinc/17/79/52/988177952.db2.gz XCADUPORXNECNV-UHFFFAOYSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@H]1C[C@@H]([NH+]2CC(C)(C[NH3+])C2)CC(C)(C)C1 ZINC001246601272 988203140 /nfs/dbraw/zinc/20/31/40/988203140.db2.gz UNTSXLUKAHVPAW-NWDGAFQWSA-N 2 0 224.392 2.482 20 0 BEADRP CSC(C)(C)C[C@H](C)[NH+]1CC(C)(C[NH3+])C1 ZINC001246601453 988207587 /nfs/dbraw/zinc/20/75/87/988207587.db2.gz VJZIGWPEXQZRND-JTQLQIEISA-N 2 0 230.421 2.187 20 0 BEADRP C[C@@H]1CC[C@@H]([N@@H+]2CCC[C@@]23CCC[NH2+]C3)C1 ZINC001246608775 988222619 /nfs/dbraw/zinc/22/26/19/988222619.db2.gz JQSFOCFCROBADP-MGPQQGTHSA-N 2 0 222.376 2.393 20 0 BEADRP CCCC[C@@H](CC)[N@@H+]1CC[C@@H]2[NH2+]CC[C@H]21 ZINC001246627981 988290311 /nfs/dbraw/zinc/29/03/11/988290311.db2.gz BLWVYKGJPCPNQT-FRRDWIJNSA-N 2 0 210.365 2.391 20 0 BEADRP CCCC[C@@H](C)[NH+]1CCC(F)(C[NH3+])CC1 ZINC001246629839 988305603 /nfs/dbraw/zinc/30/56/03/988305603.db2.gz QCRGRRHTYVLMGM-LLVKDONJSA-N 2 0 216.344 2.328 20 0 BEADRP Cc1ccc(C[C@@H](C)N2CC[C@@H]3[NH2+]CC[C@H]32)cc1 ZINC001246634382 988318070 /nfs/dbraw/zinc/31/80/70/988318070.db2.gz NBLRPAXAKYJHGL-VNQPRFMTSA-N 2 0 244.382 2.362 20 0 BEADRP C[C@H]1C[C@H]([N@@H+]2CC[C@H]3[NH2+]CC[C@H]32)C[C@@H](C)C1 ZINC001246637710 988327815 /nfs/dbraw/zinc/32/78/15/988327815.db2.gz ISDJJFXQPGHPOI-MBJXGIAVSA-N 2 0 222.376 2.247 20 0 BEADRP CCC1CCC([N@@H+]2CC[C@H]3[NH2+]CC[C@H]32)CC1 ZINC001246635539 988332166 /nfs/dbraw/zinc/33/21/66/988332166.db2.gz CKELOYWNQKPCBC-NWINJMCUSA-N 2 0 222.376 2.391 20 0 BEADRP CC[C@@H](C)OCC[C@H](C)N1CC[C@@H]2[NH2+]CC[C@H]21 ZINC001246641471 988348484 /nfs/dbraw/zinc/34/84/84/988348484.db2.gz IIZLUQXGDFMESW-RFQIPJPRSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2CC[C@H]3[NH2+]CC[C@H]32)C[C@H]1C ZINC001246642103 988349658 /nfs/dbraw/zinc/34/96/58/988349658.db2.gz ZEYVORMFGNMNBC-RKQHYHRCSA-N 2 0 222.376 2.247 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2CC[C@H]3C[NH2+]C[C@H]32)C[C@H]1C ZINC001246644882 988355578 /nfs/dbraw/zinc/35/55/78/988355578.db2.gz JKVJDJFCXRXNMX-PEBLQZBPSA-N 2 0 222.376 2.105 20 0 BEADRP CCC1CCC([N@@H+]2CC[C@H]3C[NH2+]C[C@H]32)CC1 ZINC001246648411 988374349 /nfs/dbraw/zinc/37/43/49/988374349.db2.gz YJQXKXAJEKQCRM-GNRIBBGQSA-N 2 0 222.376 2.249 20 0 BEADRP CCC[C@@H](C)CC[C@H](C)[N@H+]1C[C@@H]2[C@@H]([NH3+])[C@@H]2C1 ZINC001246660589 988393898 /nfs/dbraw/zinc/39/38/98/988393898.db2.gz VOMDTPRPHJXJAN-BJJPWKGXSA-N 2 0 224.392 2.480 20 0 BEADRP CCC[C@H](C)CC[C@@H](C)[N@H+]1C[C@@H]2[C@@H]([NH3+])[C@@H]2C1 ZINC001246660590 988394197 /nfs/dbraw/zinc/39/41/97/988394197.db2.gz VOMDTPRPHJXJAN-MEBFFEOJSA-N 2 0 224.392 2.480 20 0 BEADRP CCCC[C@H](CC(C)C)[N@H+]1C[C@@H]2[C@H]([NH3+])[C@@H]2C1 ZINC001246661858 988396523 /nfs/dbraw/zinc/39/65/23/988396523.db2.gz MHCHQAMZUXPSLY-YIYPIFLZSA-N 2 0 224.392 2.480 20 0 BEADRP CC[C@@H](CC(C)C)[N@@H+]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC001246667418 988410996 /nfs/dbraw/zinc/41/09/96/988410996.db2.gz KLKSKHSCSZQZIG-MCIONIFRSA-N 2 0 224.392 2.352 20 0 BEADRP CC1CCC([N@@H+]2C[C@H]3CCC[C@@]3([NH3+])C2)CC1 ZINC001246668171 988411948 /nfs/dbraw/zinc/41/19/48/988411948.db2.gz WNOJQEZRWJVKGK-FKZOYECMSA-N 2 0 222.376 2.378 20 0 BEADRP CCc1ccc(C[C@@H](C)[N@H+]2C[C@@H]3[C@H]([NH3+])[C@@H]3C2)cc1 ZINC001246667056 988412142 /nfs/dbraw/zinc/41/21/42/988412142.db2.gz XPUHYORMDQDULT-BQDHKBFISA-N 2 0 244.382 2.069 20 0 BEADRP C[C@@H]1CC[C@H](N2CC[C@@H](c3ccncc3)C2)C[NH2+]1 ZINC001246775775 988455603 /nfs/dbraw/zinc/45/56/03/988455603.db2.gz LDLUTRWJNWSZJP-YUELXQCFSA-N 2 0 245.370 2.011 20 0 BEADRP C[C@@H]1C[C@@H]([N@@H+]2CCC[C@@H]2c2ccccn2)CC[NH2+]1 ZINC001246786833 988465921 /nfs/dbraw/zinc/46/59/21/988465921.db2.gz AIIFANYEGHNOCQ-VNHYZAJKSA-N 2 0 245.370 2.359 20 0 BEADRP CC[C@@H](CC(C)C)[N@@H+]1CCCC2(C[NH2+]C2)C1 ZINC001246789225 988468102 /nfs/dbraw/zinc/46/81/02/988468102.db2.gz CFXRUDAGLXEZCE-ZDUSSCGKSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CC[C@@H]([N@@H+]2CCCC3(C[NH2+]C3)C2)C[C@H]1C ZINC001246792231 988469804 /nfs/dbraw/zinc/46/98/04/988469804.db2.gz ORBVMOXMLUWNIW-MGPQQGTHSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2CCC[C@@H](C(F)F)C2)CC[NH2+]1 ZINC001246810669 988492290 /nfs/dbraw/zinc/49/22/90/988492290.db2.gz YOMQIUPEFALBEJ-GMTAPVOTSA-N 2 0 232.318 2.104 20 0 BEADRP C[NH2+]CC[C@@H](C)[N@H+](C)CCc1ccc(C)cc1 ZINC001246812989 988494906 /nfs/dbraw/zinc/49/49/06/988494906.db2.gz HBIPLZHKOTYFNS-CQSZACIVSA-N 2 0 234.387 2.467 20 0 BEADRP Fc1cccc([C@H]2CC[N@@H+](C3CC[NH2+]CC3)C2)c1 ZINC001246832789 988526031 /nfs/dbraw/zinc/52/60/31/988526031.db2.gz IURXZCAWELLNCH-ZDUSSCGKSA-N 2 0 248.345 2.367 20 0 BEADRP C[C@@H]1C[C@@H](C)C[NH+]([C@@H]2CC[NH2+][C@H](C)C2)C1 ZINC001246842034 988544187 /nfs/dbraw/zinc/54/41/87/988544187.db2.gz SWIAYLRCUHHJGQ-FDYHWXHSSA-N 2 0 210.365 2.105 20 0 BEADRP CC[C@@H](CC(C)C)[N@H+]1C[C@H]2CC[C@@H](C1)[C@@H]2[NH3+] ZINC001246840161 988546954 /nfs/dbraw/zinc/54/69/54/988546954.db2.gz FKNVMMLJTKGVPX-CRWXNKLISA-N 2 0 224.392 2.480 20 0 BEADRP CC[C@H](Cc1ccccc1)[N@@H+]1C[C@H]2CC[C@]2([NH3+])C1 ZINC001246851721 988572938 /nfs/dbraw/zinc/57/29/38/988572938.db2.gz GSXIIWDIUCXZFA-OAGGEKHMSA-N 2 0 244.382 2.431 20 0 BEADRP CC1(C)CCC([N@@H+]2C[C@@H]3CC[C@]3([NH3+])C2)CC1 ZINC001246859856 988592837 /nfs/dbraw/zinc/59/28/37/988592837.db2.gz KWMLIRXMHSHVCQ-FZMZJTMJSA-N 2 0 222.376 2.378 20 0 BEADRP CCCCC[C@H](C)[N@@H+]1C[C@@H]2CC[C@@]2([NH3+])C1 ZINC001246857567 988595810 /nfs/dbraw/zinc/59/58/10/988595810.db2.gz AZWHTYFKLVCCOG-RWMBFGLXSA-N 2 0 210.365 2.378 20 0 BEADRP [NH3+][C@]12CC[C@H]1C[N@@H+](C1CCC3(CC3)CC1)C2 ZINC001246859341 988595970 /nfs/dbraw/zinc/59/59/70/988595970.db2.gz JWNDMUDRULCZPO-FZMZJTMJSA-N 2 0 220.360 2.132 20 0 BEADRP CC1(C)[C@@H]2C[C@H]([N@@H+]3C[C@H]4CC[C@@H](C3)[NH2+]C4)C[C@@H]21 ZINC001246870720 988637426 /nfs/dbraw/zinc/63/74/26/988637426.db2.gz ZHROHIUXLPRHGH-YHQUGGNUSA-N 2 0 234.387 2.105 20 0 BEADRP C[C@@H]1C[N@H+]([C@H]2CC[NH2+][C@H](C)C2)C2(CC2)C1 ZINC001246895959 988671285 /nfs/dbraw/zinc/67/12/85/988671285.db2.gz RKWFQJWLQWPNCK-TUAOUCFPSA-N 2 0 208.349 2.001 20 0 BEADRP CCCCC[C@@H](CC)[N@H+](C)[C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001246948970 988786802 /nfs/dbraw/zinc/78/68/02/988786802.db2.gz QZBQLRSJQCSGPA-MQYQWHSLSA-N 2 0 224.392 2.495 20 0 BEADRP CC(C)[N@H+](C1CCOCC1)[C@@H]1CC[NH2+][C@H](C)C1 ZINC001246985039 988816682 /nfs/dbraw/zinc/81/66/82/988816682.db2.gz ORVSEZFBDKAZBN-TZMCWYRMSA-N 2 0 240.391 2.016 20 0 BEADRP COc1cccc2c1CC[C@H]2[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC001119091008 988831661 /nfs/dbraw/zinc/83/16/61/988831661.db2.gz UCAFWGMEKWCMCT-JTNHKYCSSA-N 2 0 246.354 2.009 20 0 BEADRP C[C@@H]1CC[C@H](N2CC[C@H]3[NH2+]CCC[C@H]3C2)C1 ZINC001247016398 988842784 /nfs/dbraw/zinc/84/27/84/988842784.db2.gz USGLBMIEVVDJPB-ZOBORPQBSA-N 2 0 222.376 2.249 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]Cc1ccc(SC)cc1 ZINC001325267037 989138865 /nfs/dbraw/zinc/13/88/65/989138865.db2.gz JGBPJPOPLPRSLX-NSHDSACASA-N 2 0 238.400 2.496 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H]1C[C@H](OC(C)C)C1(C)C ZINC001325744816 989247367 /nfs/dbraw/zinc/24/73/67/989247367.db2.gz VLUVJVCFFQDBJZ-AGIUHOORSA-N 2 0 242.407 2.166 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H]1CCc2ccc(OC)cc21 ZINC001325745315 989247717 /nfs/dbraw/zinc/24/77/17/989247717.db2.gz XBGAVPZIJIGMTC-IAQYHMDHSA-N 2 0 248.370 2.270 20 0 BEADRP [NH3+]CCCC[NH2+][C@H]1CCCc2ccccc2C1 ZINC001325755867 989253964 /nfs/dbraw/zinc/25/39/64/989253964.db2.gz JVVZHROZSYQZCM-HNNXBMFYSA-N 2 0 232.371 2.263 20 0 BEADRP C[C@@H]1C[C@@H]1[C@H]1C[C@H]1C[NH2+]C1CCC(C[NH3+])CC1 ZINC001119630481 989266683 /nfs/dbraw/zinc/26/66/83/989266683.db2.gz FSAXXVWDDWFHGA-KEGGDRGHSA-N 2 0 236.403 2.386 20 0 BEADRP C[C@@H]([NH2+]CCCC[NH3+])c1ccnc(Cl)c1 ZINC001326035956 989326668 /nfs/dbraw/zinc/32/66/68/989326668.db2.gz MWKZZIVYOVSSIM-SECBINFHSA-N 2 0 227.739 2.125 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+][C@@H]1CCC[C@@H](F)C1 ZINC001119699096 989346015 /nfs/dbraw/zinc/34/60/15/989346015.db2.gz JBCFMADWUFBSHC-FIGCTBGJSA-N 2 0 240.366 2.373 20 0 BEADRP C[C@@H]1CC[C@H]1[NH2+][C@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C ZINC001119699008 989346039 /nfs/dbraw/zinc/34/60/39/989346039.db2.gz GZKJDUKXRPRXJD-KVSVUVNWSA-N 2 0 222.376 2.151 20 0 BEADRP FC(F)(F)CCC[NH2+][C@@H]1CCn2ccnc2C1 ZINC001120039762 989574702 /nfs/dbraw/zinc/57/47/02/989574702.db2.gz MKJUZPUPAPECCB-SECBINFHSA-N 2 0 247.264 2.130 20 0 BEADRP CC1([NH+]2CCC2)CCC([NH2+]Cc2ccon2)CC1 ZINC001120250521 989616209 /nfs/dbraw/zinc/61/62/09/989616209.db2.gz WKHVZFJMDBUOSU-UHFFFAOYSA-N 2 0 249.358 2.171 20 0 BEADRP F[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)C1 ZINC001326581441 989616571 /nfs/dbraw/zinc/61/65/71/989616571.db2.gz AJVTWERYPGUPPN-XGFWRYKXSA-N 2 0 240.366 2.245 20 0 BEADRP CC[N@H+](CCC[NH2+]C[C@H](C)O)C1CCCCC1 ZINC001120590116 989755644 /nfs/dbraw/zinc/75/56/44/989755644.db2.gz WJEAQGSOCXZYER-ZDUSSCGKSA-N 2 0 242.407 2.002 20 0 BEADRP C[C@H]1CC([NH2+][C@@H]2CCC[C@@H]2[NH3+])C[C@H](C)C1 ZINC001258164805 991058564 /nfs/dbraw/zinc/05/85/64/991058564.db2.gz WZTVUUQWRMTLPN-VCDKRKBESA-N 2 0 210.365 2.281 20 0 BEADRP C[C@H](Cc1ccco1)[NH+]1CCC(N2CCC2)CC1 ZINC001258196800 991110865 /nfs/dbraw/zinc/11/08/65/991110865.db2.gz FPPNQAZUUKZPCE-CYBMUJFWSA-N 2 0 248.370 2.381 20 0 BEADRP CC[N@H+]1C[C@@H]2C[NH+]([C@H](C)Cc3ccco3)C[C@@H]2C1 ZINC001258196977 991110876 /nfs/dbraw/zinc/11/08/76/991110876.db2.gz HKEVKUGZDOXDFL-MCIONIFRSA-N 2 0 248.370 2.094 20 0 BEADRP CC[N@H+]1C[C@@H]2C[NH+]([C@@H](C)Cc3ccco3)C[C@@H]2C1 ZINC001258196978 991111874 /nfs/dbraw/zinc/11/18/74/991111874.db2.gz HKEVKUGZDOXDFL-MELADBBJSA-N 2 0 248.370 2.094 20 0 BEADRP CSCC[C@H](C)[NH2+]C(C)(C)CC[NH+](C)C ZINC001258205207 991125087 /nfs/dbraw/zinc/12/50/87/991125087.db2.gz HAFCOLTVXWVZQD-NSHDSACASA-N 2 0 232.437 2.448 20 0 BEADRP CSCC[C@H](C)[NH2+][C@H]1C[C@H]2CC[N@H+](C1)[C@@H]2C ZINC001258208662 991128445 /nfs/dbraw/zinc/12/84/45/991128445.db2.gz MSKQLJKZVMTVPV-LOWDOPEQSA-N 2 0 242.432 2.200 20 0 BEADRP CSCC[C@H](C)[N@@H+]1C[C@H]2C[C@@]2(C[NH+](C)C)C1 ZINC001258223795 991156222 /nfs/dbraw/zinc/15/62/22/991156222.db2.gz FIJPJGUOIDYLBD-YNEHKIRRSA-N 2 0 242.432 2.012 20 0 BEADRP CSC(C)(C)C[C@@H](C)[N@@H+]1CCC[C@H]([NH3+])C1 ZINC001258321844 991248621 /nfs/dbraw/zinc/24/86/21/991248621.db2.gz RYQNWXGVYYURQU-MNOVXSKESA-N 2 0 230.421 2.330 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[N@H+](C)C[C@@H]12)[C@@H]1C[C@H]1C1CC1 ZINC001308985544 991252316 /nfs/dbraw/zinc/25/23/16/991252316.db2.gz XPHWJMXSDNKKLN-LIADABEKSA-N 2 0 248.414 2.351 20 0 BEADRP CCC[N@H+](CCC[NH+](C)C)CC1(CC)COC1 ZINC001202966673 991350933 /nfs/dbraw/zinc/35/09/33/991350933.db2.gz ZWJRFVUSOWFHDG-UHFFFAOYSA-N 2 0 242.407 2.077 20 0 BEADRP CC/C=C/CC[N@@H+]1C[C@H]2C[NH+](C)C[C@@]2(C)C1 ZINC001560186461 991406074 /nfs/dbraw/zinc/40/60/74/991406074.db2.gz GXAYAEISPKGERA-IHDARNGBSA-N 2 0 222.376 2.226 20 0 BEADRP CC(C)CN1CC[C@H]([NH2+][C@H](C)CC2CC2)C1 ZINC001258455262 991406075 /nfs/dbraw/zinc/40/60/75/991406075.db2.gz WQEPJZZPWSYUIE-OCCSQVGLSA-N 2 0 224.392 2.495 20 0 BEADRP CCC[N@@H+]1C[C@@]23C[NH+](C)C[C@]2(C1)CCCC3 ZINC001560238785 991434228 /nfs/dbraw/zinc/43/42/28/991434228.db2.gz XRSRXAMACVDUSM-OKILXGFUSA-N 2 0 222.376 2.204 20 0 BEADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@@H]1CC[C@@H](C)C1 ZINC001560393549 991466086 /nfs/dbraw/zinc/46/60/86/991466086.db2.gz AYTMFZNCTFJRLB-MGPQQGTHSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H](Cc1cccnc1)[NH2+]CC(C)(C)C[NH+](C)C ZINC001258611290 991533896 /nfs/dbraw/zinc/53/38/96/991533896.db2.gz IBQRXZRVBSUKKH-CYBMUJFWSA-N 2 0 249.402 2.190 20 0 BEADRP CC(C)[N@H+](CCC[NH3+])[C@H](C)Cc1cccnc1 ZINC001258613068 991537001 /nfs/dbraw/zinc/53/70/01/991537001.db2.gz LBDSTIKMJYAKFR-CYBMUJFWSA-N 2 0 235.375 2.072 20 0 BEADRP CCC[C@H](Cc1ccccc1)[N@@H+]1CC[C@@H](N)C1 ZINC001258648998 991581651 /nfs/dbraw/zinc/58/16/51/991581651.db2.gz ATTBYRYHCAQSLZ-HUUCEWRRSA-N 2 0 232.371 2.431 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C[C@H]2C[NH+]3CCC2CC3)C1 ZINC001561033935 991695325 /nfs/dbraw/zinc/69/53/25/991695325.db2.gz AGYHJPYQWTZZLA-KWCYVHTRSA-N 2 0 222.376 2.106 20 0 BEADRP FC(F)CC[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC001561047212 991703261 /nfs/dbraw/zinc/70/32/61/991703261.db2.gz JSONEPQXXURHIH-UHFFFAOYSA-N 2 0 232.318 2.106 20 0 BEADRP C[C@H]1CCC[C@@H]([N@@H+]2C[C@H]3CC[NH+](C)C[C@H]3C2)C1 ZINC001258819998 991840391 /nfs/dbraw/zinc/84/03/91/991840391.db2.gz JEKPQAPIGSKRIY-LJISPDSOSA-N 2 0 236.403 2.449 20 0 BEADRP C[C@@H]1CCC[C@@H]([N@@H+]2C[C@H]3CC[NH+](C)C[C@H]3C2)C1 ZINC001258819996 991840620 /nfs/dbraw/zinc/84/06/20/991840620.db2.gz JEKPQAPIGSKRIY-APIJFGDWSA-N 2 0 236.403 2.449 20 0 BEADRP CC[N@H+]1C[C@@H]2C[NH+]([C@@H]3CCC[C@H](C)C3)C[C@@H]2C1 ZINC001258830992 991864646 /nfs/dbraw/zinc/86/46/46/991864646.db2.gz XGLJTDHKOBUZRD-BYNSBNAKSA-N 2 0 236.403 2.449 20 0 BEADRP CS[C@H]1CC[C@@H]([N@H+](C)CCn2ccnc2)C1 ZINC001319441761 991870214 /nfs/dbraw/zinc/87/02/14/991870214.db2.gz CSCLBPBDZVKHHN-NEPJUHHUSA-N 2 0 239.388 2.099 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H](CO)C(C)C ZINC001258896266 991890411 /nfs/dbraw/zinc/89/04/11/991890411.db2.gz JTWXWDCIRXWHBX-UONOGXRCSA-N 2 0 244.423 2.103 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[N@H+](C)C(C)(C)CN ZINC001258902740 991892559 /nfs/dbraw/zinc/89/25/59/991892559.db2.gz ZBHMPDKCIXFTCZ-ZDUSSCGKSA-N 2 0 243.439 2.166 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)n1cc(C[NH3+])cn1 ZINC001258899220 991894638 /nfs/dbraw/zinc/89/46/38/991894638.db2.gz IDMGTLAGWYXVGU-GFCCVEGCSA-N 2 0 238.379 2.025 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCCOCC1 ZINC001258906852 991894745 /nfs/dbraw/zinc/89/47/45/991894745.db2.gz BKDQHJAVXPMSKU-AWEZNQCLSA-N 2 0 242.407 2.219 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCO[C@@H](C)C1 ZINC001258907560 991897780 /nfs/dbraw/zinc/89/77/80/991897780.db2.gz KMVMPSHGQDNYJK-KGLIPLIRSA-N 2 0 242.407 2.218 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CC(C)(OC)C1 ZINC001258907578 991900385 /nfs/dbraw/zinc/90/03/85/991900385.db2.gz KTHUAQUOAHSHHD-ZDUSSCGKSA-N 2 0 242.407 2.218 20 0 BEADRP CC[N@@H+]1CCC[C@H](C[NH2+][C@H](C)c2ccncc2)C1 ZINC001319691781 991938835 /nfs/dbraw/zinc/93/88/35/991938835.db2.gz VCKDOFBSUNGTAP-ZIAGYGMSSA-N 2 0 247.386 2.464 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]Cc1ccc2cnccc2c1 ZINC001261370257 992277164 /nfs/dbraw/zinc/27/71/64/992277164.db2.gz CUSZZNGGLJKGFM-GFCCVEGCSA-N 2 0 243.354 2.322 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]Cc1ccc2cnccc2c1 ZINC001261370258 992278194 /nfs/dbraw/zinc/27/81/94/992278194.db2.gz CUSZZNGGLJKGFM-LBPRGKRZSA-N 2 0 243.354 2.322 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H]1C[C@@H](C)CC[C@@H]1C ZINC001261424082 992293607 /nfs/dbraw/zinc/29/36/07/992293607.db2.gz MQRDXSFRECWTRA-WUHRBBMRSA-N 2 0 212.381 2.399 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@H]([NH2+][C@@H]3CC[C@@H]3C3CC3)[C@@H]2C1 ZINC001474756469 992512702 /nfs/dbraw/zinc/51/27/02/992512702.db2.gz GSWPMXFINWBMHY-JARUQAPTSA-N 2 0 234.387 2.105 20 0 BEADRP CC(C)(C)OC1CCC([NH2+][C@@H]2CC[NH2+]C2)CC1 ZINC001573469478 992615847 /nfs/dbraw/zinc/61/58/47/992615847.db2.gz PWRKWVOBFKUARZ-OTTFEQOBSA-N 2 0 240.391 2.064 20 0 BEADRP [NH3+][C@H]1C[C@@H]1C1CC[NH+](CC2CCCC2)CC1 ZINC001574269515 992835935 /nfs/dbraw/zinc/83/59/35/992835935.db2.gz ZVKAFHBNHCIDKH-KGLIPLIRSA-N 2 0 222.376 2.236 20 0 BEADRP [NH3+][C@@H]1C[C@H]1C1CC[NH+](CC2CCCC2)CC1 ZINC001574269516 992836706 /nfs/dbraw/zinc/83/67/06/992836706.db2.gz ZVKAFHBNHCIDKH-UONOGXRCSA-N 2 0 222.376 2.236 20 0 BEADRP [NH3+]CC1CC[NH+](CC23CCC(CC2)C3)CC1 ZINC001574276277 992840331 /nfs/dbraw/zinc/84/03/31/992840331.db2.gz CLQNEIFVGGNNOA-UHFFFAOYSA-N 2 0 222.376 2.237 20 0 BEADRP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccc[nH]1 ZINC001262364340 992860051 /nfs/dbraw/zinc/86/00/51/992860051.db2.gz UBIBHJHQWPDLRW-ODWCKFRGSA-N 2 0 233.359 2.291 20 0 BEADRP C[C@H]1CC[N@H+](CC2CC[NH+](C)CC2)C[C@@H]1F ZINC001262365146 992861498 /nfs/dbraw/zinc/86/14/98/992861498.db2.gz SWWBETSVDJVKFP-AAEUAGOBSA-N 2 0 228.355 2.008 20 0 BEADRP C(C1CCC1)[N@@H+]1CCCC[C@]12CCC[NH2+]C2 ZINC001574774987 992900635 /nfs/dbraw/zinc/90/06/35/992900635.db2.gz SIWCOGSEKYFQMI-CQSZACIVSA-N 2 0 222.376 2.395 20 0 BEADRP C1=C[C@H](C[NH2+]CC2C[C@H]3CC[C@@H](C2)[NH2+]3)CC1 ZINC001574775190 992900918 /nfs/dbraw/zinc/90/09/18/992900918.db2.gz XNYFWYWYEQLBAR-FUDCBSFHSA-N 2 0 220.360 2.073 20 0 BEADRP C([NH2+][C@H]1C[C@H]2CCC[C@H]21)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC001574795353 992910757 /nfs/dbraw/zinc/91/07/57/992910757.db2.gz MJKOLJSNYYXOFH-YQYZCKNZSA-N 2 0 234.387 2.295 20 0 BEADRP C([NH2+][C@@H]1CC[C@@H]1C1CC1)[C@@H]1CCC[NH2+]CC1 ZINC001574799782 992911546 /nfs/dbraw/zinc/91/15/46/992911546.db2.gz FPJZBFKFSYJFCL-MRVWCRGKSA-N 2 0 222.376 2.154 20 0 BEADRP C([NH2+][C@@H]1C[C@@H]2CC[C@@H](C2)C1)[C@H]1CCC[NH2+]C1 ZINC001574799935 992914469 /nfs/dbraw/zinc/91/44/69/992914469.db2.gz FZSGPRZIPBOJIV-CRWXNKLISA-N 2 0 222.376 2.154 20 0 BEADRP C1C[C@H]2CC[C@@H]([NH2+][C@]34CCC[C@H]3[NH2+]CC4)[C@H]2C1 ZINC001574816451 992917367 /nfs/dbraw/zinc/91/73/67/992917367.db2.gz FKTARWNCTIRFBD-AHDPXTMNSA-N 2 0 234.387 2.439 20 0 BEADRP CC(C)(C)CC[C@H]([NH3+])C[NH2+]CC[C@H]1CCCO1 ZINC001575130301 992994010 /nfs/dbraw/zinc/99/40/10/992994010.db2.gz JMAVFVUHWRWJRP-QWHCGFSZSA-N 2 0 242.407 2.299 20 0 BEADRP CC(C)(C)CC[C@H]([NH3+])C[NH2+][C@@H]1CCCC[C@H]1O ZINC001575131078 992994248 /nfs/dbraw/zinc/99/42/48/992994248.db2.gz SFJJPJQTKQXKSP-YNEHKIRRSA-N 2 0 242.407 2.033 20 0 BEADRP CC(C)(C)c1ccc(C[NH2+]CC2C[NH2+]C2)s1 ZINC001575275992 993004841 /nfs/dbraw/zinc/00/48/41/993004841.db2.gz VQQCIOBGVPZRLG-UHFFFAOYSA-N 2 0 238.400 2.355 20 0 BEADRP C[C@H](C[NH+]1C[C@H](C)C[C@@H](C)C1)Nc1cc[nH+]cc1 ZINC001262671529 993012923 /nfs/dbraw/zinc/01/29/23/993012923.db2.gz IYBIUDJHOOKODO-MGPQQGTHSA-N 2 0 247.386 2.282 20 0 BEADRP CC(C)(C[NH2+][C@H]1C[C@H]([NH3+])C1(C)C)CC(F)F ZINC001575334775 993013829 /nfs/dbraw/zinc/01/38/29/993013829.db2.gz SNIGQLWAUPGMDW-IUCAKERBSA-N 2 0 234.334 2.383 20 0 BEADRP CC(C)([NH3+])C[NH2+]C[C@H]1C[C@H]1C1CCCC1 ZINC001575358361 993022854 /nfs/dbraw/zinc/02/28/54/993022854.db2.gz PDKDTVKGCQWOHS-NEPJUHHUSA-N 2 0 210.365 2.140 20 0 BEADRP CC(C)([NH3+])c1cc(C[NH2+]C[C@]23C[C@H]2CCC3)on1 ZINC001575365431 993023938 /nfs/dbraw/zinc/02/39/38/993023938.db2.gz IZCKFMSUZINFJC-YGRLFVJLSA-N 2 0 249.358 2.148 20 0 BEADRP CC(C)([NH3+])C[NH2+]C[C@@H]1C[C@H]1C1CCCC1 ZINC001575358363 993025106 /nfs/dbraw/zinc/02/51/06/993025106.db2.gz PDKDTVKGCQWOHS-RYUDHWBXSA-N 2 0 210.365 2.140 20 0 BEADRP CC(C)[C@H](C[NH3+])C[N@@H+]1CC[C@@H](C2CCC2)C1 ZINC001575423818 993041779 /nfs/dbraw/zinc/04/17/79/993041779.db2.gz YPBYGDFYDFQJPZ-ZIAGYGMSSA-N 2 0 224.392 2.339 20 0 BEADRP CC(C)[C@@H]([NH3+])CNCc1ccc2scnc2c1 ZINC001575460596 993044793 /nfs/dbraw/zinc/04/47/93/993044793.db2.gz MISMCJSKGXHNBT-NSHDSACASA-N 2 0 249.383 2.369 20 0 BEADRP CC(C)C([NH2+]CC12CC(C1)C[NH2+]2)C(C)C ZINC001575472438 993049601 /nfs/dbraw/zinc/04/96/01/993049601.db2.gz MWQNJHFJLQMBQO-UHFFFAOYSA-N 2 0 210.365 2.009 20 0 BEADRP CC(C)C([NH2+]C1CC2(C[C@@H]2[NH3+])C1)C(C)C ZINC001575472092 993050285 /nfs/dbraw/zinc/05/02/85/993050285.db2.gz LVSWWTNQPYGXPM-AKJDGMEZSA-N 2 0 210.365 2.136 20 0 BEADRP CC(C)[C@@H]1CC[N@@H+]1C[C@]1(C)CCC[NH2+]C1 ZINC001575508348 993064531 /nfs/dbraw/zinc/06/45/31/993064531.db2.gz SIFOZKDQKXBLQP-QWHCGFSZSA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)OCCC[NH2+]Cc1cccc(C[NH3+])c1 ZINC001575780090 993104792 /nfs/dbraw/zinc/10/47/92/993104792.db2.gz GXLLXMUORWRVSX-UHFFFAOYSA-N 2 0 236.359 2.050 20 0 BEADRP CC(C)OC1(C[NH2+]C[C@H](C[NH3+])C(C)C)CCC1 ZINC001575751704 993104982 /nfs/dbraw/zinc/10/49/82/993104982.db2.gz YCXFIBJJUXUQAR-ZDUSSCGKSA-N 2 0 242.407 2.155 20 0 BEADRP CC(C)c1cccc(C[NH2+][C@H]2C[C@H]([NH3+])C2)c1 ZINC001575859774 993114214 /nfs/dbraw/zinc/11/42/14/993114214.db2.gz OCOXISQJVQTUNX-HDJSIYSDSA-N 2 0 218.344 2.389 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]C/C=C/c1cccc(F)c1 ZINC001575987487 993150609 /nfs/dbraw/zinc/15/06/09/993150609.db2.gz HVBLPFQIEFKTEK-JOAKQRRISA-N 2 0 222.307 2.023 20 0 BEADRP CC(C)[C@H](C[NH2+]C[C@@H](C)[NH3+])c1ccccc1 ZINC001576159241 993198724 /nfs/dbraw/zinc/19/87/24/993198724.db2.gz OAYYXVKEVKHPMO-OCCSQVGLSA-N 2 0 220.360 2.363 20 0 BEADRP CC1(C)[C@H]([NH3+])C[C@@H]1[NH2+]CCC[C@@H]1CCCCO1 ZINC001576380337 993284906 /nfs/dbraw/zinc/28/49/06/993284906.db2.gz OLMFZRAPNQWYSL-XQQFMLRXSA-N 2 0 240.391 2.051 20 0 BEADRP CC[C@@H]1C[C@H]([N@@H+]2CCCC[C@H](C[NH3+])C2)CCO1 ZINC000380075544 993312473 /nfs/dbraw/zinc/31/24/73/993312473.db2.gz RBXVCOGWQJIWAM-MGPQQGTHSA-N 2 0 240.391 2.005 20 0 BEADRP CC1(C)CCC[C@H]1C[NH2+]C[C@@]1(C)CC[NH2+]C1 ZINC001576519864 993331513 /nfs/dbraw/zinc/33/15/13/993331513.db2.gz VAYNCVVHGCEKOS-JSGCOSHPSA-N 2 0 224.392 2.402 20 0 BEADRP C[C@H]1[NH2+]CC[C@@H]1[NH2+]C1C[C@H](C)C[C@@H](C)C1 ZINC001576589035 993359288 /nfs/dbraw/zinc/35/92/88/993359288.db2.gz JYBWYRSPHTXCHH-UZWSLXQKSA-N 2 0 210.365 2.151 20 0 BEADRP C[C@H]1C[C@@H](CNc2ccc3c([nH+]2)CCC3)CC[NH2+]1 ZINC001576596874 993361227 /nfs/dbraw/zinc/36/12/27/993361227.db2.gz BGWDTVGELCENPS-RYUDHWBXSA-N 2 0 245.370 2.370 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2C[C@@H](C3CC3)[C@H]2C2CC2)CC[NH2+]1 ZINC001576598521 993364302 /nfs/dbraw/zinc/36/43/02/993364302.db2.gz MGCDWEBVEFKCJJ-AVRGHOLYSA-N 2 0 248.414 2.495 20 0 BEADRP C[C@H]1C[C@@H]([NH3+])CC[N@@H+]1CC12CCC(CC1)C2 ZINC001576608556 993367156 /nfs/dbraw/zinc/36/71/56/993367156.db2.gz UNJIQEHAFMBHIZ-AHPWVWPOSA-N 2 0 222.376 2.378 20 0 BEADRP C[C@@H]1CC[C@@H](C)C1[NH2+][C@@H]1CCC[N@H+](C)CC1 ZINC000381201656 993380110 /nfs/dbraw/zinc/38/01/10/993380110.db2.gz FJMFIVHKHFQICP-JHJVBQTASA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]CCC2C[NH2+]C2)[C@@H]1C ZINC001576679989 993382456 /nfs/dbraw/zinc/38/24/56/993382456.db2.gz HCVUNTLONSEQTO-WZRBSPASSA-N 2 0 210.365 2.010 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+][C@@H]1CC[C@@H](C)SC1 ZINC001576670840 993389081 /nfs/dbraw/zinc/38/90/81/993389081.db2.gz MXYCVVPVLINIPR-IJLUTSLNSA-N 2 0 230.421 2.234 20 0 BEADRP C[C@@H]1CCC[C@H](C)C[N@H+]1CC1(C[NH3+])CC1 ZINC001576669529 993389302 /nfs/dbraw/zinc/38/93/02/993389302.db2.gz SKZMZDIYHYAIFU-NWDGAFQWSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@H]1CCC[C@@H]([NH2+][C@H]2C[C@H](C[NH3+])C2)CC1 ZINC001576680551 993390554 /nfs/dbraw/zinc/39/05/54/993390554.db2.gz OYXLVMOIDZZAOZ-RVMXOQNASA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1C[N@H+](CCSC(C)(C)C)CC[C@@H]1C[NH3+] ZINC001576807270 993428666 /nfs/dbraw/zinc/42/86/66/993428666.db2.gz OZUNNOSCAGXQDD-VXGBXAGGSA-N 2 0 244.448 2.435 20 0 BEADRP CC[C@@H](C)[C@H](C[NH+]1CCC(CC[NH3+])CC1)OC ZINC001576960579 993467932 /nfs/dbraw/zinc/46/79/32/993467932.db2.gz GCNQXWIWULAHFG-OCCSQVGLSA-N 2 0 242.407 2.108 20 0 BEADRP CC[C@H](C)[C@@H](C)[NH2+]C[C@H]1CCC[NH2+]CC1 ZINC001576962892 993470461 /nfs/dbraw/zinc/47/04/61/993470461.db2.gz WJPAVHVECSBRON-XQQFMLRXSA-N 2 0 212.381 2.400 20 0 BEADRP CCC(CC)(C[NH3+])C[NH2+]CCc1cccnc1C ZINC001577051839 993491228 /nfs/dbraw/zinc/49/12/28/993491228.db2.gz BLELYEQEUTZFBV-UHFFFAOYSA-N 2 0 249.402 2.287 20 0 BEADRP C[C@@H](Cc1ccco1)[N@@H+]1CCCC[C@@H](C[NH3+])C1 ZINC000383652642 993507288 /nfs/dbraw/zinc/50/72/88/993507288.db2.gz DVOCYRQVWNACQJ-STQMWFEESA-N 2 0 236.359 2.271 20 0 BEADRP CCC([NH3+])(CC)C[NH2+]CC1(OC)CCCCC1 ZINC001577109636 993508749 /nfs/dbraw/zinc/50/87/49/993508749.db2.gz RRTSWLVRNLUTPR-UHFFFAOYSA-N 2 0 242.407 2.443 20 0 BEADRP CC[C@H]([NH3+])C[NH2+]C1CC(C)(c2ccccc2)C1 ZINC001577124570 993509584 /nfs/dbraw/zinc/50/95/84/993509584.db2.gz IQIBDWYHBZVZJW-NFOMZHRRSA-N 2 0 232.371 2.434 20 0 BEADRP CC[C@H]([NH3+])C[NH2+]C1CC(c2cccc(F)c2)C1 ZINC001577124501 993511744 /nfs/dbraw/zinc/51/17/44/993511744.db2.gz DYTBNMYZOBISCL-QRMWWUJWSA-N 2 0 236.334 2.399 20 0 BEADRP CC[C@@H]([NH2+][C@H]1C[C@H]2CC[C@@H]1[NH2+]2)C1CCC1 ZINC001577176243 993533543 /nfs/dbraw/zinc/53/35/43/993533543.db2.gz XNLQRWCRSAIUBM-NDBYEHHHSA-N 2 0 208.349 2.048 20 0 BEADRP CC[C@@H]([NH2+]CCCCCC[NH3+])[C@H]1CCCO1 ZINC001577175600 993534679 /nfs/dbraw/zinc/53/46/79/993534679.db2.gz CJRKYLMJBBOASF-CHWSQXEVSA-N 2 0 228.380 2.053 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@@H]2CCC[NH2+][C@@H]2C)C1 ZINC000384206571 993559525 /nfs/dbraw/zinc/55/95/25/993559525.db2.gz BUJKILLMWRIDJM-NDBYEHHHSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]1[NH2+]CCC[C@@H]1C[NH2+]C1CCCCC1 ZINC000384288076 993567696 /nfs/dbraw/zinc/56/76/96/993567696.db2.gz VQOBTCLTPZRQQI-VXGBXAGGSA-N 2 0 210.365 2.297 20 0 BEADRP CCCCC[C@H](C)[N@@H+]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000393792380 994006106 /nfs/dbraw/zinc/00/61/06/994006106.db2.gz MQOOBFZIGQGXCY-MJBXVCDLSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2CCCC(F)(F)CC2)CC[NH2+]1 ZINC000702795775 994050398 /nfs/dbraw/zinc/05/03/98/994050398.db2.gz CHWSYCCGNRHLSC-GHMZBOCLSA-N 2 0 232.318 2.248 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CCC[N@@H+]1C)C1(C)CC1 ZINC000822125226 994417997 /nfs/dbraw/zinc/41/79/97/994417997.db2.gz RYOJCQFGHWWNOL-NEPJUHHUSA-N 2 0 210.365 2.249 20 0 BEADRP C[NH+](C)[C@@H]1CC[C@H]2C[N@H+](CC3CC3)C[C@H]2C1 ZINC001335584613 994819958 /nfs/dbraw/zinc/81/99/58/994819958.db2.gz WXKFMLDIXIFISH-BFHYXJOUSA-N 2 0 222.376 2.059 20 0 BEADRP C[N@@H+]1CCN(c2cc[nH+]cc2)CCC1(C)C ZINC001336935347 995124864 /nfs/dbraw/zinc/12/48/64/995124864.db2.gz YGPSVZSKGPVRNT-UHFFFAOYSA-N 2 0 219.332 2.002 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[C@@H]3C[N@H+](C)C[C@@H]23)C1 ZINC001621108270 1170715690 /nfs/dbraw/zinc/71/56/90/1170715690.db2.gz KWWHDXMPDBDEPF-UXXRCYHCSA-N 2 0 236.403 2.495 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@H]([NH2+]C3CCCCC3)[C@@H]2C1 ZINC001621107917 1170717215 /nfs/dbraw/zinc/71/72/15/1170717215.db2.gz CQWDGDSIFGGARO-YUTCNCBUSA-N 2 0 222.376 2.249 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@H]([NH2+][C@H]3CCC34CCC4)[C@@H]2C1 ZINC001621570234 1170857112 /nfs/dbraw/zinc/85/71/12/1170857112.db2.gz NZOXIQQEMNPGEH-CRWXNKLISA-N 2 0 234.387 2.249 20 0 BEADRP C[C@@H](CCc1ccc(O)cc1)[NH2+]C1CC[NH2+]CC1 ZINC000038041383 1171008407 /nfs/dbraw/zinc/00/84/07/1171008407.db2.gz ZIOIXNQDFCIJAY-LBPRGKRZSA-N 2 0 248.370 2.055 20 0 BEADRP CC(C)C[NH+](CC(C)C)C1CC[NH2+]CC1 ZINC000042034189 1171203005 /nfs/dbraw/zinc/20/30/05/1171203005.db2.gz WSDOXAQRTKAYGO-UHFFFAOYSA-N 2 0 212.381 2.352 20 0 BEADRP CCCCC[C@H](C)[NH2+]C[C@@H](O)C[NH+](CC)CC ZINC000042229491 1171216568 /nfs/dbraw/zinc/21/65/68/1171216568.db2.gz RUXDSMYUOFBAHQ-UONOGXRCSA-N 2 0 244.423 2.248 20 0 BEADRP C[C@H](Cc1ccco1)[NH2+]CCC[NH+]1CCCC1 ZINC000049332599 1171689248 /nfs/dbraw/zinc/68/92/48/1171689248.db2.gz WAKUHRZADGYJDP-CYBMUJFWSA-N 2 0 236.359 2.286 20 0 BEADRP C[NH2+]CC[C@H](C)[N@H+](C)CC1CCCCC1 ZINC000052346744 1171956647 /nfs/dbraw/zinc/95/66/47/1171956647.db2.gz SQWUMYCYNZMVLN-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP C[NH2+]CC[C@@H](C)[N@H+](C)Cc1cccc(C)c1 ZINC000052345989 1171958083 /nfs/dbraw/zinc/95/80/83/1171958083.db2.gz WWXUNQNACWDOLK-CYBMUJFWSA-N 2 0 220.360 2.425 20 0 BEADRP CCCC1CC[NH+]([C@@H](C)CC[NH2+]C)CC1 ZINC000052373912 1171961145 /nfs/dbraw/zinc/96/11/45/1171961145.db2.gz IHUSVONTTXWFEA-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP CC[C@H]([NH3+])C[NH2+]C[C@@H](C)Cc1ccccc1 ZINC000414994225 398137903 /nfs/dbraw/zinc/13/79/03/398137903.db2.gz UOFOSMXCIINPDO-JSGCOSHPSA-N 2 0 220.360 2.192 20 0 BEADRP Cn1cncc1CCC[N@H+](C)Cc1ccco1 ZINC000572420026 398142298 /nfs/dbraw/zinc/14/22/98/398142298.db2.gz GQXQNPNSWSQCMD-UHFFFAOYSA-N 2 0 233.315 2.078 20 0 BEADRP CC[C@@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)C1CCC1 ZINC000322377799 343977682 /nfs/dbraw/zinc/97/76/82/343977682.db2.gz KZXFWZWUQQDDDX-TZMCWYRMSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)C1CCC1 ZINC000322377796 343977903 /nfs/dbraw/zinc/97/79/03/343977903.db2.gz KZXFWZWUQQDDDX-GXTWGEPZSA-N 2 0 224.392 2.497 20 0 BEADRP c1cn(CC[N@@H+]2CCC[C@@H]2C2CCC2)cn1 ZINC000161613198 349476506 /nfs/dbraw/zinc/47/65/06/349476506.db2.gz DNYPKBGLVNXRAQ-CYBMUJFWSA-N 2 0 219.332 2.148 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H](C)C1CC1 ZINC000422942355 398159236 /nfs/dbraw/zinc/15/92/36/398159236.db2.gz PLDJAMFYQPESSH-ZJUUUORDSA-N 2 0 233.359 2.298 20 0 BEADRP Cc1cc(CN2C[C@@H]3C[N@H+](C)C[C@@H]3C2)ccc1F ZINC000194536027 178005576 /nfs/dbraw/zinc/00/55/76/178005576.db2.gz AWZPPNDCHHCYKZ-OKILXGFUSA-N 2 0 248.345 2.128 20 0 BEADRP Cc1cc(CN2C[C@@H]3C[N@H+](C)C[C@@H]3C2)cs1 ZINC000296661625 178006521 /nfs/dbraw/zinc/00/65/21/178006521.db2.gz FEFSWFVLMFLCPT-BETUJISGSA-N 2 0 236.384 2.050 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H](C)C1CC1 ZINC000422942353 398159899 /nfs/dbraw/zinc/15/98/99/398159899.db2.gz PLDJAMFYQPESSH-UWVGGRQHSA-N 2 0 233.359 2.298 20 0 BEADRP CC[N@H+](CC[C@H]1CCC[NH+]1C)CC1CC1 ZINC000161840515 349511837 /nfs/dbraw/zinc/51/18/37/349511837.db2.gz XMMZLKPHQIELNE-CYBMUJFWSA-N 2 0 210.365 2.203 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]C[C@H]1CC=CCC1 ZINC000422976840 398161114 /nfs/dbraw/zinc/16/11/14/398161114.db2.gz VQBKKHYNAZVXCW-HZSPNIEDSA-N 2 0 222.376 2.320 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H]1CCO[C@H](C(C)(C)C)C1 ZINC000423020524 398161970 /nfs/dbraw/zinc/16/19/70/398161970.db2.gz BUGJMQATQBEHBK-RVMXOQNASA-N 2 0 242.407 2.296 20 0 BEADRP c1ccc(C[C@H]([NH2+]C[C@@H]2CCC[NH2+]2)C2CC2)cc1 ZINC000423233403 398165199 /nfs/dbraw/zinc/16/51/99/398165199.db2.gz JTFFZQSDLFVLBA-HOTGVXAUSA-N 2 0 244.382 2.349 20 0 BEADRP CCC[C@@H](C[NH2+]CC1(C)CC[NH+](C)CC1)OC ZINC000385928661 398192521 /nfs/dbraw/zinc/19/25/21/398192521.db2.gz BFGBBBCSVJVUNG-ZDUSSCGKSA-N 2 0 242.407 2.123 20 0 BEADRP CS[C@@H]1CC[C@@H]1[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000336696016 398194146 /nfs/dbraw/zinc/19/41/46/398194146.db2.gz LWLTWNFHCPMIDC-QNWHQSFQSA-N 2 0 240.416 2.097 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCC[NH+]2CCCCC2)[C@@H]1C ZINC000309324720 136218006 /nfs/dbraw/zinc/21/80/06/136218006.db2.gz HVWPKVJHRBRKAZ-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]([NH2+]C[C@@H](C)C1CC1)[C@@H]1CCCC[NH2+]1 ZINC000386090443 398197666 /nfs/dbraw/zinc/19/76/66/398197666.db2.gz IBILQXKYVZLGMM-WZRBSPASSA-N 2 0 210.365 2.153 20 0 BEADRP Cc1cc(N2CC[C@@]3(C2)CCC[N@@H+](C)C3)cc[nH+]1 ZINC000292649740 178119637 /nfs/dbraw/zinc/11/96/37/178119637.db2.gz BNJPEFNVWDWTGU-HNNXBMFYSA-N 2 0 245.370 2.312 20 0 BEADRP Cc1ccccc1C1([NH2+][C@@H](C)C2C[NH2+]C2)CC1 ZINC000647800508 398205900 /nfs/dbraw/zinc/20/59/00/398205900.db2.gz DDCIWQAYXNBPSS-LBPRGKRZSA-N 2 0 230.355 2.182 20 0 BEADRP Cc1cc(NCC[NH+]2CCCCC2)cc[nH+]1 ZINC000229565386 178161562 /nfs/dbraw/zinc/16/15/62/178161562.db2.gz MFMHVSDERRYMLW-UHFFFAOYSA-N 2 0 219.332 2.288 20 0 BEADRP Cc1cc(NCC[C@H]2CCC[NH2+]C2)cc[nH+]1 ZINC000229575108 178162812 /nfs/dbraw/zinc/16/28/12/178162812.db2.gz SUQOTWJDYYUVIX-GFCCVEGCSA-N 2 0 219.332 2.192 20 0 BEADRP Cc1cc(NC[C@H]2CCC[C@H]([NH3+])C2)cc[nH+]1 ZINC000227669869 178169680 /nfs/dbraw/zinc/16/96/80/178169680.db2.gz GIDCZFWPCZKDLD-RYUDHWBXSA-N 2 0 219.332 2.319 20 0 BEADRP Cc1cc(N[C@@H](C)[C@H]2CCC[NH2+]C2)cc[nH+]1 ZINC000229574551 178179036 /nfs/dbraw/zinc/17/90/36/178179036.db2.gz BVBWFXJLZWTIPY-RYUDHWBXSA-N 2 0 219.332 2.190 20 0 BEADRP Cc1cc(N[C@H]2C[C@@H](C)[N@@H+](C3CC3)C2)cc[nH+]1 ZINC000290737957 178191001 /nfs/dbraw/zinc/19/10/01/178191001.db2.gz GUKZSDXCUSNMJS-YPMHNXCESA-N 2 0 231.343 2.427 20 0 BEADRP CCC(CC)C[N@@H+]1C[C@@H]2CC[C@@H]([NH3+])[C@H]2C1 ZINC000336673801 168351803 /nfs/dbraw/zinc/35/18/03/168351803.db2.gz GUGATNDWGMWRTQ-RWMBFGLXSA-N 2 0 210.365 2.092 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H]1CC[C@H](C)C[C@@H]1C ZINC000576458088 365600860 /nfs/dbraw/zinc/60/08/60/365600860.db2.gz IEDJYQUGLXFICV-RWMBFGLXSA-N 2 0 212.381 2.400 20 0 BEADRP CCC(CC)C[N@@H+]1C[C@@H]2CC[C@H]([NH3+])[C@@H]2C1 ZINC000336673803 168354002 /nfs/dbraw/zinc/35/40/02/168354002.db2.gz GUGATNDWGMWRTQ-XQQFMLRXSA-N 2 0 210.365 2.092 20 0 BEADRP Cc1cc([C@@H](C)[NH2+]C[C@@H](C)C[NH3+])c(C)o1 ZINC000309016088 178226000 /nfs/dbraw/zinc/22/60/00/178226000.db2.gz ZMBLRPKBQSCHMK-WCBMZHEXSA-N 2 0 210.321 2.142 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C2CCC([NH+](C)C)CC2)[C@@H](C)O1 ZINC000421365028 192333584 /nfs/dbraw/zinc/33/35/84/192333584.db2.gz AQQDNBHTNPMVNF-AYZDXNEBSA-N 2 0 240.391 2.015 20 0 BEADRP CC[C@H]1CCN(CC[N@@H+]2CC[C@H](CC)C2)C1 ZINC000125166059 323000770 /nfs/dbraw/zinc/00/07/70/323000770.db2.gz QEYCRPLYBKNDRI-KBPBESRZSA-N 2 0 224.392 2.450 20 0 BEADRP CCC(CC)C[NH2+]CCCC[NH+](C)C ZINC000045663027 168359876 /nfs/dbraw/zinc/35/98/76/168359876.db2.gz ZCLPCAPMXMGOFI-UHFFFAOYSA-N 2 0 200.370 2.354 20 0 BEADRP C[C@@H]([NH2+]C1CC([NH+]2CCCCC2)C1)C1CC1 ZINC000370113769 398249742 /nfs/dbraw/zinc/24/97/42/398249742.db2.gz VGOQONXQWMLWDP-LMWSTFAQSA-N 2 0 222.376 2.391 20 0 BEADRP Fc1ccc(C[NH2+]CC[C@@H]2CC[NH2+]C2)c(F)c1 ZINC000259047498 349542988 /nfs/dbraw/zinc/54/29/88/349542988.db2.gz QAQWMZIAZNNKIS-JTQLQIEISA-N 2 0 240.297 2.054 20 0 BEADRP C[C@H](C[N@@H+]1CC[C@@H]2[NH2+]CC[C@H]2C1)C(C)(C)C ZINC000381595575 398265342 /nfs/dbraw/zinc/26/53/42/398265342.db2.gz JRISTSNIMWOORZ-AGIUHOORSA-N 2 0 224.392 2.352 20 0 BEADRP CC[NH+]1CCC(C[NH2+]C2CC(C)C2)CC1 ZINC000231788100 342694772 /nfs/dbraw/zinc/69/47/72/342694772.db2.gz IGDRKRAMDCRDRO-UHFFFAOYSA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)[C@@H](C)[NH2+]CCC[N@H+](C)C(C)C ZINC000166562457 361851685 /nfs/dbraw/zinc/85/16/85/361851685.db2.gz FBUSIUYPLXFZER-GFCCVEGCSA-N 2 0 200.370 2.351 20 0 BEADRP C[C@H]([NH2+][C@H]1CCc2cc(F)ccc21)C1C[NH2+]C1 ZINC000335602400 136235550 /nfs/dbraw/zinc/23/55/50/136235550.db2.gz ZIOQGPGZLJVWPX-XPTSAGLGSA-N 2 0 234.318 2.011 20 0 BEADRP C[C@@H]([NH2+]Cc1ccco1)C1CC[NH+](C)CC1 ZINC000037208433 538961911 /nfs/dbraw/zinc/96/19/11/538961911.db2.gz ASYZKBAXCIPCNA-LLVKDONJSA-N 2 0 222.332 2.100 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@H]1CCC[C@H]1C ZINC000165715111 361844058 /nfs/dbraw/zinc/84/40/58/361844058.db2.gz CERARHALVOMXKN-OLZOCXBDSA-N 2 0 212.381 2.495 20 0 BEADRP CCC(CC)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000026513925 168386609 /nfs/dbraw/zinc/38/66/09/168386609.db2.gz YCGMGHQKLDRPCR-YHWZYXNKSA-N 2 0 210.365 2.390 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)[C@@H]1C[C@@H]1C ZINC000321136982 342751275 /nfs/dbraw/zinc/75/12/75/342751275.db2.gz URTIDVHFBVBIRZ-FQUUOJAGSA-N 2 0 224.392 2.352 20 0 BEADRP CCC[C@H](C)[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000378930214 346862227 /nfs/dbraw/zinc/86/22/27/346862227.db2.gz LFKKQXHBFPFTCU-WUHRBBMRSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH3+])[C@H]1CCC[N@H+](C[C@H]2CCC(F)(F)C2)C1 ZINC000382309833 361895222 /nfs/dbraw/zinc/89/52/22/361895222.db2.gz ICPILYPPTRBBKM-SRVKXCTJSA-N 2 0 246.345 2.481 20 0 BEADRP CC[NH+]1CCC(C[NH2+]Cc2ccc(O)cc2)CC1 ZINC000044517287 538990018 /nfs/dbraw/zinc/99/00/18/538990018.db2.gz UUQTUZMJZSFBFD-UHFFFAOYSA-N 2 0 248.370 2.214 20 0 BEADRP CCN(CC)C[C@@H](C)[NH2+][C@H](C)C(C)C ZINC000045690496 538992838 /nfs/dbraw/zinc/99/28/38/538992838.db2.gz NKJAQYJUORWCSY-VXGBXAGGSA-N 2 0 200.370 2.351 20 0 BEADRP FC1(F)CC[C@H]([NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)C1 ZINC000383928828 539012350 /nfs/dbraw/zinc/01/23/50/539012350.db2.gz BHCOFLJHKWKGTD-GRYCIOLGSA-N 2 0 244.329 2.391 20 0 BEADRP CC(C)[C@H]1CC[C@@H]1[NH2+]CC1CC[NH+](C)CC1 ZINC000381177202 538995837 /nfs/dbraw/zinc/99/58/37/538995837.db2.gz VJPBIMQZZLQPHR-KGLIPLIRSA-N 2 0 224.392 2.352 20 0 BEADRP C/C=C/C[NH2+][C@@H]1CC[N@H+](C)[C@@H]2CCC[C@@H]21 ZINC000624199680 342843288 /nfs/dbraw/zinc/84/32/88/342843288.db2.gz VLZLVMVKNOOHOW-ZUEAMBOYSA-N 2 0 208.349 2.025 20 0 BEADRP C[C@H](CCC(C)(C)C)[NH2+]C[C@@H](C)C[NH3+] ZINC000395092567 398299286 /nfs/dbraw/zinc/29/92/86/398299286.db2.gz AKLPFUDCGRHELJ-WDEREUQCSA-N 2 0 200.370 2.386 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@@H](C)CCC(C)(C)C ZINC000395092565 398299327 /nfs/dbraw/zinc/29/93/27/398299327.db2.gz AKLPFUDCGRHELJ-QWRGUYRKSA-N 2 0 200.370 2.386 20 0 BEADRP CC(C)C1(C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)CC1 ZINC000232721180 342879454 /nfs/dbraw/zinc/87/94/54/342879454.db2.gz FELIBMYCWFOYPT-NWDGAFQWSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H](C[NH2+]Cc1ccc(O)cc1)C[NH+]1CCCC1 ZINC000057993861 398321244 /nfs/dbraw/zinc/32/12/44/398321244.db2.gz SZBGZQICUZJSBL-CYBMUJFWSA-N 2 0 248.370 2.214 20 0 BEADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+]C2CC(C)C2)C1 ZINC000232830220 342886572 /nfs/dbraw/zinc/88/65/72/342886572.db2.gz ZEDGBAYOCCVKCL-CPCZMJQVSA-N 2 0 210.365 2.105 20 0 BEADRP CCC1(C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)CCC1 ZINC000232883868 342887177 /nfs/dbraw/zinc/88/71/77/342887177.db2.gz RNHRJRVJKBCELJ-NEPJUHHUSA-N 2 0 210.365 2.426 20 0 BEADRP CC[NH+]1CCC([NH2+]CC2CCCC2)CC1 ZINC000037258210 342925927 /nfs/dbraw/zinc/92/59/27/342925927.db2.gz SKZCCXUSDFFCIF-UHFFFAOYSA-N 2 0 210.365 2.251 20 0 BEADRP CC(C)[N@@H+]1CC[C@@H](C)[C@@H](n2ccnc2)C1 ZINC000120163337 398336966 /nfs/dbraw/zinc/33/69/66/398336966.db2.gz XVOVMQNCEHJZQP-NEPJUHHUSA-N 2 0 207.321 2.174 20 0 BEADRP C[C@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1cscn1 ZINC000580312082 346893311 /nfs/dbraw/zinc/89/33/11/346893311.db2.gz JBZXBBDNZIAQFR-QWRGUYRKSA-N 2 0 239.388 2.326 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H]1CC[C@H]1C(C)(C)C ZINC000576814630 365690864 /nfs/dbraw/zinc/69/08/64/365690864.db2.gz FXMNNLJGFDILLL-VXGBXAGGSA-N 2 0 212.381 2.400 20 0 BEADRP CCc1cc(NCC[N@H+](C)C2CC2)cc[nH+]1 ZINC000307769264 529555037 /nfs/dbraw/zinc/55/50/37/529555037.db2.gz KPPCGTYFCZYWHM-UHFFFAOYSA-N 2 0 219.332 2.150 20 0 BEADRP CCc1cc(NC[C@@H](C)[NH+](C)C)cc[nH+]1 ZINC000307768283 529556151 /nfs/dbraw/zinc/55/61/51/529556151.db2.gz JOYWCFRGTYXYJR-SNVBAGLBSA-N 2 0 207.321 2.006 20 0 BEADRP CCc1cc(N[C@H](C)CC[NH+](C)C)cc[nH+]1 ZINC000307812308 529561105 /nfs/dbraw/zinc/56/11/05/529561105.db2.gz JCAUYEVQRMXHKD-LLVKDONJSA-N 2 0 221.348 2.396 20 0 BEADRP CCC([NH3+])(CC)CNc1cc[nH+]c(C)c1 ZINC000229576996 168417012 /nfs/dbraw/zinc/41/70/12/168417012.db2.gz CNRDZKYIQXGMNY-UHFFFAOYSA-N 2 0 207.321 2.319 20 0 BEADRP C[C@@H]1C[C@H](C[N@H+]2C[C@@H](C)S[C@@H](C)C2)CC[NH2+]1 ZINC000235369661 343011403 /nfs/dbraw/zinc/01/14/03/343011403.db2.gz WFBPDXIQSQSZEK-FVCCEPFGSA-N 2 0 242.432 2.200 20 0 BEADRP C[C@@H](C[N@H+](C)CCOCC[NH3+])C1CCCCC1 ZINC000384075630 343037926 /nfs/dbraw/zinc/03/79/26/343037926.db2.gz WIJHAECBFDDVHY-ZDUSSCGKSA-N 2 0 242.407 2.110 20 0 BEADRP COCCC(C)(C)C[NH2+][C@@H](C)[C@@H]1CCCC[NH2+]1 ZINC000386468231 343066260 /nfs/dbraw/zinc/06/62/60/343066260.db2.gz QCCSVSIAFMCKPI-STQMWFEESA-N 2 0 242.407 2.169 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCCC[C@H]1C[NH3+])c1ccoc1 ZINC000576861476 365705894 /nfs/dbraw/zinc/70/58/94/365705894.db2.gz XWAFIGLJJHNLKV-GMXVVIOVSA-N 2 0 222.332 2.448 20 0 BEADRP CC[N@H+](Cc1ccc(-n2ccnc2)nc1)C1CC1 ZINC000177254020 346925019 /nfs/dbraw/zinc/92/50/19/346925019.db2.gz LOMCNVVQPXEQKS-UHFFFAOYSA-N 2 0 242.326 2.252 20 0 BEADRP CCCC[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C)C1 ZINC000247116294 343077017 /nfs/dbraw/zinc/07/70/17/343077017.db2.gz AHGYQMWZVZSQAH-STQMWFEESA-N 2 0 210.365 2.203 20 0 BEADRP Cc1cccc(CC[NH2+][C@H]2CCC[C@@H]([NH3+])C2)c1 ZINC000093215806 343150889 /nfs/dbraw/zinc/15/08/89/343150889.db2.gz NDSSOEYVZJXMRE-CABCVRRESA-N 2 0 232.371 2.397 20 0 BEADRP COc1ccc(C)cc1CN1CC[C@H]([NH3+])C[C@@H]1C ZINC000124635247 343163137 /nfs/dbraw/zinc/16/31/37/343163137.db2.gz IYMXFLWAFJIWBC-JSGCOSHPSA-N 2 0 248.370 2.315 20 0 BEADRP C[C@@H]1C[C@@H]1CN1CCC2(CCC[N@@H+]2C)CC1 ZINC000625291165 343223159 /nfs/dbraw/zinc/22/31/59/343223159.db2.gz XSLNPLORXUHXER-CHWSQXEVSA-N 2 0 222.376 2.203 20 0 BEADRP C[C@H]1CCC[N@H+](CCC2CC[NH2+]CC2)CC1 ZINC000082489537 136276743 /nfs/dbraw/zinc/27/67/43/136276743.db2.gz YCBVULRWRVEVFE-ZDUSSCGKSA-N 2 0 224.392 2.498 20 0 BEADRP COC[C@H]([NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21)C(C)C ZINC000132145333 343187592 /nfs/dbraw/zinc/18/75/92/343187592.db2.gz QLNLWLKGTYEBDZ-ZNMIVQPWSA-N 2 0 248.370 2.392 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H]2CC[NH2+]CC[C@@H]2C)o1 ZINC000581997323 343190899 /nfs/dbraw/zinc/19/08/99/343190899.db2.gz WOCVBBBMJKYFMA-SMDDNHRTSA-N 2 0 236.359 2.108 20 0 BEADRP Cc1ccc(CC[NH2+][C@H]2CC[NH2+]CC[C@H]2C)o1 ZINC000581997322 343191110 /nfs/dbraw/zinc/19/11/10/343191110.db2.gz WOCVBBBMJKYFMA-RISCZKNCSA-N 2 0 236.359 2.108 20 0 BEADRP Cc1ccsc1[C@@H](C)[NH2+]CCCC[NH3+] ZINC000069636606 343287250 /nfs/dbraw/zinc/28/72/50/343287250.db2.gz HQUZXZVOSCVQEX-SNVBAGLBSA-N 2 0 212.362 2.446 20 0 BEADRP CC(C)(C)[C@@H]1CCCC[C@H]1[NH2+]CCOCC[NH3+] ZINC000357067658 187255155 /nfs/dbraw/zinc/25/51/55/187255155.db2.gz CVNJNTIBVDDFTD-CHWSQXEVSA-N 2 0 242.407 2.156 20 0 BEADRP Cc1c[nH+]ccc1NCC[N@@H+](C)C(C)C ZINC000070047378 343297404 /nfs/dbraw/zinc/29/74/04/343297404.db2.gz ALBXCMNXKPTZSO-UHFFFAOYSA-N 2 0 207.321 2.142 20 0 BEADRP CC[NH+](CC)CCC[NH2+]C1Cc2ccccc2C1 ZINC000035657918 343301438 /nfs/dbraw/zinc/30/14/38/343301438.db2.gz JWUOWOWYQYUPOD-UHFFFAOYSA-N 2 0 246.398 2.475 20 0 BEADRP COC1CC([N@H+](C)CCCc2ccc(C)nc2)C1 ZINC000348717824 136294660 /nfs/dbraw/zinc/29/46/60/136294660.db2.gz VRKWYKHXLLBMNU-UHFFFAOYSA-N 2 0 248.370 2.432 20 0 BEADRP CCC[C@@H]([NH2+]C[C@H](O)C[N@H+](C)CC)C(C)(C)C ZINC000584061423 343309844 /nfs/dbraw/zinc/30/98/44/343309844.db2.gz KUHSWGITAFUXMT-QWHCGFSZSA-N 2 0 244.423 2.103 20 0 BEADRP C[NH+](C)Cc1ccc(NC2CC[NH+](C)CC2)cc1 ZINC000037141177 343336339 /nfs/dbraw/zinc/33/63/39/343336339.db2.gz OBCLBTSFZNFCQU-UHFFFAOYSA-N 2 0 247.386 2.254 20 0 BEADRP CN1CCC([NH2+]C[C@@H]2CC=CCC2)CC1 ZINC000037248594 343340910 /nfs/dbraw/zinc/34/09/10/343340910.db2.gz MFBSMBSQWQYPHH-GFCCVEGCSA-N 2 0 208.349 2.027 20 0 BEADRP C[C@H]1C[C@H]1C[N@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000348869822 136302493 /nfs/dbraw/zinc/30/24/93/136302493.db2.gz PLSOTKJEAXKTNY-CSHRUCKSSA-N 2 0 222.376 2.199 20 0 BEADRP Cc1ccc(CNC[C@@H]2CC[N@@H+](C3CC3)C2)o1 ZINC000037408312 343344557 /nfs/dbraw/zinc/34/45/57/343344557.db2.gz MSGRZRWQQGXTLQ-LBPRGKRZSA-N 2 0 234.343 2.162 20 0 BEADRP Cc1ccc(C[N@H+](C)CC2CC[NH2+]CC2)cc1 ZINC000020264749 187257791 /nfs/dbraw/zinc/25/77/91/187257791.db2.gz GLHHCFOKVIOSDD-UHFFFAOYSA-N 2 0 232.371 2.426 20 0 BEADRP CC[C@@H]1CCC[C@@H](C[N@H+]2C[C@H]3C[NH2+]C[C@H]3C2)C1 ZINC000394501542 259360446 /nfs/dbraw/zinc/36/04/46/259360446.db2.gz BHVMEHSVEQMXNE-TUVASFSCSA-N 2 0 236.403 2.354 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)C[C@@H]1CCSC1 ZINC000349411463 136345022 /nfs/dbraw/zinc/34/50/22/136345022.db2.gz XKBDPHAAVIMOGM-LBPRGKRZSA-N 2 0 230.421 2.013 20 0 BEADRP CC(C)=CC[NH+]1CC[C@@]2(C1)CCC[N@@H+](C)C2 ZINC000335725612 136346880 /nfs/dbraw/zinc/34/68/80/136346880.db2.gz JLBMWRILPSOCTP-AWEZNQCLSA-N 2 0 222.376 2.370 20 0 BEADRP CC1=C[C@H](C)C[N@H+](CC[C@@H]2CCC[NH+]2C)C1 ZINC000335891850 136358719 /nfs/dbraw/zinc/35/87/19/136358719.db2.gz AYVKIMNBQWTOCX-JSGCOSHPSA-N 2 0 222.376 2.369 20 0 BEADRP C[C@H](F)CC[NH+]1CCC(c2ncc[nH]2)CC1 ZINC000351873038 136371214 /nfs/dbraw/zinc/37/12/14/136371214.db2.gz GQQKRUOAYJWRHK-JTQLQIEISA-N 2 0 225.311 2.337 20 0 BEADRP C[C@@H](F)CC[NH+]1CCC(c2ncc[nH]2)CC1 ZINC000351873039 136371347 /nfs/dbraw/zinc/37/13/47/136371347.db2.gz GQQKRUOAYJWRHK-SNVBAGLBSA-N 2 0 225.311 2.337 20 0 BEADRP C[C@@H]1C[C@@H](C)[N@H+](CCC(F)(F)F)C[C@@H]1C[NH3+] ZINC000397358744 323048598 /nfs/dbraw/zinc/04/85/98/323048598.db2.gz FXCHDWFJEAYAJK-BBBLOLIVSA-N 2 0 238.297 2.244 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CCC[NH+](C)C)[C@H](C)C1 ZINC000082857410 343468732 /nfs/dbraw/zinc/46/87/32/343468732.db2.gz RNQHERPPMCAAGN-JHJVBQTASA-N 2 0 212.381 2.352 20 0 BEADRP c1ccc(SCC[NH2+]C2CC[NH2+]CC2)cc1 ZINC000038041574 187262600 /nfs/dbraw/zinc/26/26/00/187262600.db2.gz YGCWKZLIZYUCCH-UHFFFAOYSA-N 2 0 236.384 2.120 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]Cc1ccc(C[NH3+])cc1 ZINC000580552037 365758550 /nfs/dbraw/zinc/75/85/50/365758550.db2.gz LGTPDWKHXBTWPZ-KGLIPLIRSA-N 2 0 218.344 2.424 20 0 BEADRP C[C@@H]1CC[N@H+](CCC2CCC2)C[C@@H]1C[NH3+] ZINC000398701232 488222331 /nfs/dbraw/zinc/22/23/31/488222331.db2.gz KBUWTBZEIMGUGB-YPMHNXCESA-N 2 0 210.365 2.093 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H](C)Cc1ccsc1 ZINC000379976747 365771708 /nfs/dbraw/zinc/77/17/08/365771708.db2.gz QVUALFNMFKZJMP-GHMZBOCLSA-N 2 0 226.389 2.396 20 0 BEADRP CC(C)CC[C@H](C)[NH2+]CC1CC[NH2+]CC1 ZINC000086700279 343627057 /nfs/dbraw/zinc/62/70/57/343627057.db2.gz SJNIUMZWDJOMKK-LBPRGKRZSA-N 2 0 212.381 2.400 20 0 BEADRP C/C=C/C[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000384648549 343702203 /nfs/dbraw/zinc/70/22/03/343702203.db2.gz ABXPOWKYNNQWGV-APGKFWSWSA-N 2 0 208.349 2.073 20 0 BEADRP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]CC1(C)CCC1 ZINC000090219875 343750355 /nfs/dbraw/zinc/75/03/55/343750355.db2.gz DKCLPCRMJLBEIG-RYUDHWBXSA-N 2 0 210.365 2.106 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@@H](C[NH3+])C2)s1 ZINC000044527731 343781486 /nfs/dbraw/zinc/78/14/86/343781486.db2.gz XLGIBSYEMBNIGU-NSHDSACASA-N 2 0 224.373 2.227 20 0 BEADRP CN1CCC([NH2+]C[C@@H]2CCCC2(C)C)CC1 ZINC000336511542 346981416 /nfs/dbraw/zinc/98/14/16/346981416.db2.gz BYQYPNSBMLQVHQ-LBPRGKRZSA-N 2 0 224.392 2.497 20 0 BEADRP CCCN(CC)CC[NH2+][C@H]1CCC[C@@H](OC)C1 ZINC000233007188 537816662 /nfs/dbraw/zinc/81/66/62/537816662.db2.gz LIZMBZLMBHVOCS-UONOGXRCSA-N 2 0 242.407 2.266 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+]CC2(C)CCC2)C1 ZINC000336683342 537822718 /nfs/dbraw/zinc/82/27/18/537822718.db2.gz JWCCTHOVFKOZFR-LBPRGKRZSA-N 2 0 210.365 2.108 20 0 BEADRP CCN1CCC[C@H]1C[NH2+][C@@H]1CC[C@H](C)C1 ZINC000070748575 343955192 /nfs/dbraw/zinc/95/51/92/343955192.db2.gz PHDNCYGJXMRPRN-XQQFMLRXSA-N 2 0 210.365 2.249 20 0 BEADRP CCC[C@@H](C[NH2+]CCC[NH+]1CCCCC1)OC ZINC000395157406 362281821 /nfs/dbraw/zinc/28/18/21/362281821.db2.gz CLMSTTHAOICXLP-AWEZNQCLSA-N 2 0 242.407 2.267 20 0 BEADRP Cc1ncccc1C[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000634732886 344108138 /nfs/dbraw/zinc/10/81/38/344108138.db2.gz RISBUGWWHVOXHB-AWEZNQCLSA-N 2 0 247.386 2.258 20 0 BEADRP CC[C@H](C)C[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000634733660 344113949 /nfs/dbraw/zinc/11/39/49/344113949.db2.gz KUFJKPATNQWJLU-RYUDHWBXSA-N 2 0 212.381 2.400 20 0 BEADRP C[NH+]1CCC(CC[NH2+][C@H]2CC[C@@H]2C2CC2)CC1 ZINC000348120203 537840043 /nfs/dbraw/zinc/84/00/43/537840043.db2.gz OXSWJFWANQTQIH-CABCVRRESA-N 2 0 236.403 2.497 20 0 BEADRP CC1(C)CC[C@H]([NH2+][C@@H]2CCC[C@@H]2C[NH3+])C1 ZINC000128602540 187285907 /nfs/dbraw/zinc/28/59/07/187285907.db2.gz DIFWHHWQDABYPI-GRYCIOLGSA-N 2 0 210.365 2.282 20 0 BEADRP Cc1ccc(C)c(CN2CCC[C@H]3C[NH2+]C[C@H]32)c1 ZINC000299921432 344148571 /nfs/dbraw/zinc/14/85/71/344148571.db2.gz PYEZLDRUODIISK-GOEBONIOSA-N 2 0 244.382 2.487 20 0 BEADRP CC(C)CCC[N@@H+]1C[C@H]2CCC[C@]2([NH3+])C1 ZINC000622003958 344181413 /nfs/dbraw/zinc/18/14/13/344181413.db2.gz IGJPUIZTOJRVPK-OLZOCXBDSA-N 2 0 210.365 2.236 20 0 BEADRP CC[NH+]1CCC([NH2+]CC2(C)CCC2)CC1 ZINC000132300094 344297781 /nfs/dbraw/zinc/29/77/81/344297781.db2.gz ROWXCVQDZYVHLL-UHFFFAOYSA-N 2 0 210.365 2.251 20 0 BEADRP CC[NH+]1CCC([NH2+]CC2(CC)CC2)CC1 ZINC000132296708 344297804 /nfs/dbraw/zinc/29/78/04/344297804.db2.gz NTQLFBNYKXYXDW-UHFFFAOYSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000093210444 344312115 /nfs/dbraw/zinc/31/21/15/344312115.db2.gz JPLZWDBXRKWRSG-AGIUHOORSA-N 2 0 236.359 2.460 20 0 BEADRP C[C@H]1C[C@@H]([NH3+])CN1Cc1cnc2ccccc2c1 ZINC000385066256 344314316 /nfs/dbraw/zinc/31/43/16/344314316.db2.gz GQYYELGVECCJTM-SMDDNHRTSA-N 2 0 241.338 2.156 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CC2CCC2)CN1C1CC1 ZINC000132863694 344309543 /nfs/dbraw/zinc/30/95/43/344309543.db2.gz ONENFHJQTVEEIY-JQWIXIFHSA-N 2 0 208.349 2.001 20 0 BEADRP CC(C)SCC[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000380608572 344423946 /nfs/dbraw/zinc/42/39/46/344423946.db2.gz XJPVJLCZKTUOKB-LBPRGKRZSA-N 2 0 244.448 2.448 20 0 BEADRP CCc1ccc(CN2C[C@@H]([NH3+])C[C@H]2C)cc1 ZINC000385200179 344376298 /nfs/dbraw/zinc/37/62/98/344376298.db2.gz QYHMDURVEVIISZ-RISCZKNCSA-N 2 0 218.344 2.171 20 0 BEADRP C[C@H](C[NH2+]C1CC[NH2+]CC1)c1ccc(F)cc1 ZINC000215653998 344392928 /nfs/dbraw/zinc/39/29/28/344392928.db2.gz IBXGYPALLSACIH-LLVKDONJSA-N 2 0 236.334 2.271 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@@H]1CC[C@@H]1C1CC1 ZINC000336768390 537844638 /nfs/dbraw/zinc/84/46/38/537844638.db2.gz UPMIDBGBNVBCDK-RAIGVLPGSA-N 2 0 210.365 2.105 20 0 BEADRP C[N@H+](CCC[NH3+])Cc1cccc(Cl)c1 ZINC000042437181 344452883 /nfs/dbraw/zinc/45/28/83/344452883.db2.gz KWFMWDUCHCEPLR-UHFFFAOYSA-N 2 0 212.724 2.121 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+]CC2(C)CCC2)C1 ZINC000336778533 537851595 /nfs/dbraw/zinc/85/15/95/537851595.db2.gz LOBBXXCXFLHMLM-ZDUSSCGKSA-N 2 0 224.392 2.498 20 0 BEADRP CC[C@H]([NH3+])CN[C@@H](C)c1sc(C)nc1C ZINC000049538805 344652067 /nfs/dbraw/zinc/65/20/67/344652067.db2.gz UIFOANBBALSIHK-XVKPBYJWSA-N 2 0 227.377 2.148 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+]C1CCC(C)CC1 ZINC000049551814 344652992 /nfs/dbraw/zinc/65/29/92/344652992.db2.gz HFAPLVMOQHJOGV-CPCZMJQVSA-N 2 0 212.381 2.495 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+]CCC(C)(C)C ZINC000049557029 344653453 /nfs/dbraw/zinc/65/34/53/344653453.db2.gz UGYWAAICIDXFFZ-NSHDSACASA-N 2 0 200.370 2.352 20 0 BEADRP CC(C)=CC[NH+]1CC[C@H]2[C@H](CCC[N@H+]2C)C1 ZINC000158649640 344707459 /nfs/dbraw/zinc/70/74/59/344707459.db2.gz KZTPLPXCGNGXHF-KGLIPLIRSA-N 2 0 222.376 2.369 20 0 BEADRP C[C@@H]1CN(c2cc[nH+]c3ccccc32)C[C@H](C)[NH2+]1 ZINC000053712521 1172050176 /nfs/dbraw/zinc/05/01/76/1172050176.db2.gz QFTXMDKARTTXJM-TXEJJXNPSA-N 2 0 241.338 2.421 20 0 BEADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+]Cc2cccn2C)C1 ZINC000119081056 187294959 /nfs/dbraw/zinc/29/49/59/187294959.db2.gz OOLWYJCVZXKXKH-CQSZACIVSA-N 2 0 249.402 2.235 20 0 BEADRP CC(C)[C@@H](C[NH3+])C[NH2+]Cc1ccc([C@H](C)[NH3+])cc1 ZINC000634994406 345181957 /nfs/dbraw/zinc/18/19/57/345181957.db2.gz BOPUEJDOSFZMHT-WFASDCNBSA-N 3 0 249.402 2.027 20 0 BEADRP C[C@@H]1C[C@H]2CCCC[C@@H]2[N@@H+]1CC12CC(C1)C[NH2+]2 ZINC000634993400 345190703 /nfs/dbraw/zinc/19/07/03/345190703.db2.gz SZDBDWLWLYZWFG-YPHRVZEWSA-N 2 0 234.387 2.391 20 0 BEADRP C[C@H]1CC[N@H+](CC23CC(C2)C[NH2+]3)CC12CCC2 ZINC000634994766 345182822 /nfs/dbraw/zinc/18/28/22/345182822.db2.gz MJYKINTZPRMMAT-OPFPJEHXSA-N 2 0 234.387 2.251 20 0 BEADRP CC(C)[C@@H](C[NH3+])CNc1ccc([C@@H](C)[NH3+])cc1 ZINC000634995036 345183417 /nfs/dbraw/zinc/18/34/17/345183417.db2.gz SOJZPKJGPAWRKC-YPMHNXCESA-N 2 0 235.375 2.349 20 0 BEADRP CCN(CC12CC(C1)C[NH2+]2)C1CC(C)(C)C1 ZINC000634996707 345191211 /nfs/dbraw/zinc/19/12/11/345191211.db2.gz RGFAIENRLPAEIZ-UHFFFAOYSA-N 2 0 222.376 2.249 20 0 BEADRP Cc1cc(F)ccc1CN(C)CC12CC(C1)C[NH2+]2 ZINC000634993815 345192195 /nfs/dbraw/zinc/19/21/95/345192195.db2.gz HGUPDRBWXFBEFQ-UHFFFAOYSA-N 2 0 248.345 2.318 20 0 BEADRP C(C1CC1)N(CC12CC(C1)C[NH2+]2)C1CCC1 ZINC000634993838 345192228 /nfs/dbraw/zinc/19/22/28/345192228.db2.gz HWSXYAQBLDCICM-UHFFFAOYSA-N 2 0 220.360 2.003 20 0 BEADRP [NH3+][C@H]1CCCCCN(Cc2cccs2)C1 ZINC000634997070 345194057 /nfs/dbraw/zinc/19/40/57/345194057.db2.gz CCAWMAUMKKBQOV-NSHDSACASA-N 2 0 224.373 2.451 20 0 BEADRP [NH3+][C@@H]1CCCCCN(Cc2cccc(O)c2)C1 ZINC000634997408 345195223 /nfs/dbraw/zinc/19/52/23/345195223.db2.gz KMFIHIUXSMCOOK-CYBMUJFWSA-N 2 0 234.343 2.096 20 0 BEADRP C[C@H](C[C@H]1CCC[NH2+]1)[NH2+][C@@H]1CCCC12CC2 ZINC000634997611 345197522 /nfs/dbraw/zinc/19/75/22/345197522.db2.gz OZHRGDSBCCWAAX-JHJVBQTASA-N 2 0 222.376 2.439 20 0 BEADRP CCc1ccc(C[N@@H+]2C[C@H](C)[C@H](C[NH3+])C2)s1 ZINC000634998170 345197591 /nfs/dbraw/zinc/19/75/91/345197591.db2.gz BTJGHYYNNDMFQW-WDEREUQCSA-N 2 0 238.400 2.337 20 0 BEADRP C[C@@H]1C[C@H](C[NH2+][C@@H]2CCCC23CC3)CC[NH2+]1 ZINC000634999316 345199104 /nfs/dbraw/zinc/19/91/04/345199104.db2.gz SGKZSBSZJVTOND-JHJVBQTASA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCCC12CC2)[C@@H]1CCCC[NH2+]1 ZINC000635003285 345205307 /nfs/dbraw/zinc/20/53/07/345205307.db2.gz HTYBMDQOTWSZSA-FRRDWIJNSA-N 2 0 222.376 2.439 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCCC12CC2)[C@@H]1CCCC[NH2+]1 ZINC000635003283 345205792 /nfs/dbraw/zinc/20/57/92/345205792.db2.gz HTYBMDQOTWSZSA-AGIUHOORSA-N 2 0 222.376 2.439 20 0 BEADRP CC[C@@H]([NH2+][C@@H]1CCCC12CC2)[C@@H]1CCC[NH2+]1 ZINC000635004482 345207957 /nfs/dbraw/zinc/20/79/57/345207957.db2.gz PFSUHTUTAFZJAG-FRRDWIJNSA-N 2 0 222.376 2.439 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+][C@H]1CCCC12CC2 ZINC000635004842 345208284 /nfs/dbraw/zinc/20/82/84/345208284.db2.gz QCEMGZAFMDUXDS-XQQFMLRXSA-N 2 0 222.376 2.426 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+][C@@H]1CCCC12CC2 ZINC000635004843 345208622 /nfs/dbraw/zinc/20/86/22/345208622.db2.gz QCEMGZAFMDUXDS-YNEHKIRRSA-N 2 0 222.376 2.426 20 0 BEADRP CC[C@H]1CC[C@@H]1[NH2+][C@H]1CC[C@H](C[NH3+])CC1 ZINC000635005035 345209053 /nfs/dbraw/zinc/20/90/53/345209053.db2.gz LJSFZXKQMHEXNP-CYDGBPFRSA-N 2 0 210.365 2.282 20 0 BEADRP COC1CCC([NH2+][C@H]2CC[C@H](C[NH3+])CC2)CC1 ZINC000635005533 345209950 /nfs/dbraw/zinc/20/99/50/345209950.db2.gz ORNJHYVEOBKLPS-HXZBBRIXSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+][C@H]1CC[C@H](C[NH3+])CC1 ZINC000635006462 345210497 /nfs/dbraw/zinc/21/04/97/345210497.db2.gz RJCKGAKQLDSKOL-YRGRVCCFSA-N 2 0 236.359 2.318 20 0 BEADRP C[C@@H](CC1CCC1)[NH2+][C@@H](C)[C@H]1CCC[NH2+]1 ZINC000635011365 345213636 /nfs/dbraw/zinc/21/36/36/345213636.db2.gz FBUAJSQSXDRHFU-GMXVVIOVSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)CC1CCC1)[C@@H]1CCC[NH2+]1 ZINC000635011367 345213653 /nfs/dbraw/zinc/21/36/53/345213653.db2.gz FBUAJSQSXDRHFU-LOWVWBTDSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)c1cncs1 ZINC000635008404 345216228 /nfs/dbraw/zinc/21/62/28/345216228.db2.gz UBOSWDCQIWWALW-DCAQKATOSA-N 2 0 239.388 2.311 20 0 BEADRP CCc1cc(N(CC)CCC[NH+](C)C)cc[nH+]1 ZINC000425258944 192086341 /nfs/dbraw/zinc/08/63/41/192086341.db2.gz UONVDDKTWMJOAX-UHFFFAOYSA-N 2 0 235.375 2.422 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+]CCCC(C)C)C1 ZINC000162089454 345260277 /nfs/dbraw/zinc/26/02/77/345260277.db2.gz IWNCHVWOEANBIM-ZDUSSCGKSA-N 2 0 212.381 2.354 20 0 BEADRP CSCC[C@H](C)[N@H+](C)CC1CC[NH2+]CC1 ZINC000158593280 345353273 /nfs/dbraw/zinc/35/32/73/345353273.db2.gz TVJQWPZLIFKOQQ-NSHDSACASA-N 2 0 230.421 2.059 20 0 BEADRP CC(C)N(C)C[C@H](C)[NH2+][C@H](C)C1CCC1 ZINC000308895460 187306759 /nfs/dbraw/zinc/30/67/59/187306759.db2.gz ZGLGRXZXFVQRRJ-NWDGAFQWSA-N 2 0 212.381 2.493 20 0 BEADRP C[C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C[NH3+] ZINC000252701814 345580169 /nfs/dbraw/zinc/58/01/69/345580169.db2.gz FKMJKEQHUVZBJG-GXTWGEPZSA-N 2 0 218.344 2.103 20 0 BEADRP Cc1ccc(CN(C)[C@@H](C[NH3+])C2CC2)c(C)c1 ZINC000159756965 345518543 /nfs/dbraw/zinc/51/85/43/345518543.db2.gz KWPNEEBEGBFNMU-HNNXBMFYSA-N 2 0 232.371 2.473 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+][C@H](C)[C@@H]1CCC[NH2+]C1 ZINC000319086439 259384059 /nfs/dbraw/zinc/38/40/59/259384059.db2.gz CFDFSSKWACRCEZ-WUHRBBMRSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@H]1CC[NH+](CCC[N@H+]2CC[C@H](C)C2)C1 ZINC000137675704 345685098 /nfs/dbraw/zinc/68/50/98/345685098.db2.gz JSFSIQWVRIGBLS-STQMWFEESA-N 2 0 210.365 2.060 20 0 BEADRP CC[C@@H](C)[C@H](C)[NH2+]CC1(COC)CC[NH2+]CC1 ZINC000319102836 259384538 /nfs/dbraw/zinc/38/45/38/259384538.db2.gz FJSOOYFTZHBRFO-OLZOCXBDSA-N 2 0 242.407 2.027 20 0 BEADRP CCCC(O)(CCC)C[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000577076472 365805844 /nfs/dbraw/zinc/80/58/44/365805844.db2.gz HKEVQXWCGNHTAU-QWHCGFSZSA-N 2 0 242.407 2.177 20 0 BEADRP CC1(C)C[C@@H]1C[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000300358575 345852548 /nfs/dbraw/zinc/85/25/48/345852548.db2.gz IPVXRFFYDJXAEH-UPJWGTAASA-N 2 0 222.376 2.249 20 0 BEADRP c1ccc2c(C[NH2+]C3CC[NH2+]CC3)ccnc2c1 ZINC000141200775 345860160 /nfs/dbraw/zinc/86/01/60/345860160.db2.gz VAFYKQFMGPCBKN-UHFFFAOYSA-N 2 0 241.338 2.076 20 0 BEADRP CC(C)C[C@@H]([NH3+])C[N@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000309933919 187310803 /nfs/dbraw/zinc/31/08/03/187310803.db2.gz XLRJSRLKEFIXKN-HZSPNIEDSA-N 2 0 224.392 2.482 20 0 BEADRP C[C@H](Cc1cccs1)[NH2+]C[C@@H]1CCCN1C ZINC000166877778 345925442 /nfs/dbraw/zinc/92/54/42/345925442.db2.gz XRUDINQYLIRQCG-NEPJUHHUSA-N 2 0 238.400 2.363 20 0 BEADRP CC(C)N(CC[NH2+][C@@H](C)CCCC[NH3+])C(C)C ZINC000310570352 187312507 /nfs/dbraw/zinc/31/25/07/187312507.db2.gz ZACSFPPAIFLYMF-AWEZNQCLSA-N 2 0 243.439 2.212 20 0 BEADRP CC(C)SCC[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000401019074 346033506 /nfs/dbraw/zinc/03/35/06/346033506.db2.gz JYCDEZXYUUMTTG-YNEHKIRRSA-N 2 0 242.432 2.106 20 0 BEADRP CC(C)C[C@H](C)C[N@@H+]1CC[C@@](C)(C[NH3+])C1 ZINC000300986633 187313955 /nfs/dbraw/zinc/31/39/55/187313955.db2.gz UXKYYFSLGMFCAQ-STQMWFEESA-N 2 0 212.381 2.339 20 0 BEADRP CCCC[N@H+](CC)CC[C@@H]1CCC[NH2+]C1 ZINC000051918843 346207307 /nfs/dbraw/zinc/20/73/07/346207307.db2.gz SBKCSPLFWFUIHV-ZDUSSCGKSA-N 2 0 212.381 2.498 20 0 BEADRP CCC[C@@H](C)[N@H+](C)CC[C@@H]1CCC[NH2+]C1 ZINC000051919028 346207741 /nfs/dbraw/zinc/20/77/41/346207741.db2.gz PYEUMORPPLPSMQ-OLZOCXBDSA-N 2 0 212.381 2.497 20 0 BEADRP CC(C)(C[NH2+]C1CC[NH2+]CC1)c1ccccc1 ZINC000038041578 187317961 /nfs/dbraw/zinc/31/79/61/187317961.db2.gz OTHMGZAGHHXPLO-UHFFFAOYSA-N 2 0 232.371 2.306 20 0 BEADRP C1CC([NH2+]C2C3CC4CC(C3)CC2C4)CC[NH2+]1 ZINC000038041175 187318241 /nfs/dbraw/zinc/31/82/41/187318241.db2.gz GWDFQLAGUUNRFK-UHFFFAOYSA-N 2 0 234.387 2.153 20 0 BEADRP C1CC1C([NH2+][C@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)C1CC1 ZINC000401136132 346275986 /nfs/dbraw/zinc/27/59/86/346275986.db2.gz QQSBTSOALYXOCL-RDBSUJKOSA-N 2 0 234.387 2.153 20 0 BEADRP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCCC[NH2+]C1 ZINC000669378418 537965594 /nfs/dbraw/zinc/96/55/94/537965594.db2.gz DOEIRAGADRROJI-QWHCGFSZSA-N 2 0 210.365 2.251 20 0 BEADRP CCC(CC)C[NH+]1CCC(CC[NH3+])CC1 ZINC000069729580 349953894 /nfs/dbraw/zinc/95/38/94/349953894.db2.gz FYPWOOAFEHMRSY-UHFFFAOYSA-N 2 0 212.381 2.483 20 0 BEADRP c1coc(CC[NH2+]C2CC[NH+](CC3CC3)CC2)c1 ZINC000155936691 346356658 /nfs/dbraw/zinc/35/66/58/346356658.db2.gz QQOUXVRKCKJMQT-UHFFFAOYSA-N 2 0 248.370 2.286 20 0 BEADRP CC1(C)CC[NH+](C[C@H]2CCCC[NH2+]C2)CC1 ZINC000669378802 537971371 /nfs/dbraw/zinc/97/13/71/537971371.db2.gz NWLVUTACWKBOKG-ZDUSSCGKSA-N 2 0 224.392 2.498 20 0 BEADRP Cc1cccc(CC[NH2+][C@@H](C)CC[NH+](C)C)c1 ZINC000336686665 179058448 /nfs/dbraw/zinc/05/84/48/179058448.db2.gz GHCLVVHRMSULFF-AWEZNQCLSA-N 2 0 234.387 2.467 20 0 BEADRP Cc1cccc(CC[NH2+][C@H]2CC[N@@H+](C)C[C@H]2C)c1 ZINC000358102291 179059549 /nfs/dbraw/zinc/05/95/49/179059549.db2.gz SWWCGZJOQRVZFE-ZBFHGGJFSA-N 2 0 246.398 2.467 20 0 BEADRP CC[N@H+](CC(C)C)C[C@H]1CCCC[NH2+]C1 ZINC000669379131 537975892 /nfs/dbraw/zinc/97/58/92/537975892.db2.gz SXGIUQIZMWBNFK-ZDUSSCGKSA-N 2 0 212.381 2.354 20 0 BEADRP Cc1cccc(C[N@H+](C)C[C@@H]2CCC[NH2+]C2)c1 ZINC000042435906 179067112 /nfs/dbraw/zinc/06/71/12/179067112.db2.gz ZHZUEBQSNRJURV-OAHLLOKOSA-N 2 0 232.371 2.426 20 0 BEADRP Cc1cccc(C[N@@H+]2CCC[C@H](C[NH3+])C2)c1C ZINC000044528079 179076648 /nfs/dbraw/zinc/07/66/48/179076648.db2.gz JYHYNDJJZHCBIO-CQSZACIVSA-N 2 0 232.371 2.474 20 0 BEADRP C[C@H]1CCC(C)(C)[N@@H+]1CC1CC[NH2+]CC1 ZINC000641794128 362734613 /nfs/dbraw/zinc/73/46/13/362734613.db2.gz QOLKEFOVXDPSBW-NSHDSACASA-N 2 0 210.365 2.249 20 0 BEADRP Cc1cccc(C[NH2+][C@H](C)CC[NH+](C)C)c1 ZINC000049551786 179100290 /nfs/dbraw/zinc/10/02/90/179100290.db2.gz YXOUFIXVHJWMGK-CYBMUJFWSA-N 2 0 220.360 2.425 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCc2ccccc2C1(C)C ZINC000641801469 362755294 /nfs/dbraw/zinc/75/52/94/362755294.db2.gz RADRXGPFEJXKTG-UHFFFAOYSA-N 2 0 232.371 2.389 20 0 BEADRP CC1(C)CC(C[NH2+][C@H]2C[C@H]([NH3+])C2(C)C)C1 ZINC000641801232 362755465 /nfs/dbraw/zinc/75/54/65/362755465.db2.gz OCCJLIVAIPHKQZ-QWRGUYRKSA-N 2 0 210.365 2.138 20 0 BEADRP CC1(C)[C@H]([NH3+])C[C@H]1[NH2+]CCCC1CCC1 ZINC000641802167 362758640 /nfs/dbraw/zinc/75/86/40/362758640.db2.gz YLBAULFOKHMPDH-VXGBXAGGSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)C[C@H](C)C[NH2+][C@H]1C[C@@H]([NH3+])C1(C)C ZINC000641804251 362760979 /nfs/dbraw/zinc/76/09/79/362760979.db2.gz XDAKJJPMQDUGET-TUAOUCFPSA-N 2 0 212.381 2.384 20 0 BEADRP Cc1cc(CN2[C@@H](C)[C@@H](C)CC[C@H]2C[NH3+])ccn1 ZINC000641806404 362764216 /nfs/dbraw/zinc/76/42/16/362764216.db2.gz RQZBKVHLRBCZFM-WHOFXGATSA-N 2 0 247.386 2.338 20 0 BEADRP COc1cc(C)cc(C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)c1 ZINC000577124169 365828947 /nfs/dbraw/zinc/82/89/47/365828947.db2.gz IUUAMHIAKPQZGR-KGLIPLIRSA-N 2 0 248.370 2.363 20 0 BEADRP COc1cc(C)cc(C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)c1 ZINC000577124170 365829191 /nfs/dbraw/zinc/82/91/91/365829191.db2.gz IUUAMHIAKPQZGR-UONOGXRCSA-N 2 0 248.370 2.363 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@@H](C)Cc1ccsc1 ZINC000580182192 346621758 /nfs/dbraw/zinc/62/17/58/346621758.db2.gz RYMZVISCZDSYNX-AXFHLTTASA-N 2 0 226.389 2.395 20 0 BEADRP COC[C@@H](C)C[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C ZINC000187912165 346648478 /nfs/dbraw/zinc/64/84/78/346648478.db2.gz DKOKQKKMLYWWGC-STQMWFEESA-N 2 0 244.423 2.225 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]C2CCSCC2)[C@H](C)C1 ZINC000178095993 346657080 /nfs/dbraw/zinc/65/70/80/346657080.db2.gz IWSORUZLIYYQOS-DGCLKSJQSA-N 2 0 242.432 2.202 20 0 BEADRP CC(C)C[C@@H](C)[NH2+]CCN1CC[C@H](C)C1 ZINC000380065342 365836458 /nfs/dbraw/zinc/83/64/58/365836458.db2.gz BVCDBQFCCWIOAL-QWHCGFSZSA-N 2 0 212.381 2.352 20 0 BEADRP CC(C)C[C@H](C)[NH2+]CCN1CC[C@@H](C)C1 ZINC000380065341 365836480 /nfs/dbraw/zinc/83/64/80/365836480.db2.gz BVCDBQFCCWIOAL-OLZOCXBDSA-N 2 0 212.381 2.352 20 0 BEADRP COc1ccc([C@@H](C)[NH2+]CCCC[NH3+])cc1 ZINC000037714838 346706122 /nfs/dbraw/zinc/70/61/22/346706122.db2.gz REGZDXSUXFISIE-LLVKDONJSA-N 2 0 222.332 2.085 20 0 BEADRP Cc1cccc(NCC(C)(C)C[NH+](C)C)[nH+]1 ZINC000037670522 179143867 /nfs/dbraw/zinc/14/38/67/179143867.db2.gz UAYVQASXOAHOOC-UHFFFAOYSA-N 2 0 221.348 2.390 20 0 BEADRP Cc1cccc(NC[C@]2(C)CCC[NH2+]C2)[nH+]1 ZINC000160005144 179148201 /nfs/dbraw/zinc/14/82/01/179148201.db2.gz WCHGANKDWLNLLP-CYBMUJFWSA-N 2 0 219.332 2.192 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C2CC([NH+](C)C)C2)C[C@@H]1C ZINC000580216036 346701103 /nfs/dbraw/zinc/70/11/03/346701103.db2.gz LEIIGYRSZDWGQV-HEKVYRDFSA-N 2 0 224.392 2.493 20 0 BEADRP C[C@@H](c1ccccc1)[N@@H+]1C[C@H](C[NH3+])C[C@H]1C ZINC000252699704 346780304 /nfs/dbraw/zinc/78/03/04/346780304.db2.gz VTIFYBOKHPLFSV-AGIUHOORSA-N 2 0 218.344 2.417 20 0 BEADRP C[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)c1ccoc1 ZINC000381733177 346772384 /nfs/dbraw/zinc/77/23/84/346772384.db2.gz NXAUZMSYLNCZBB-LLVKDONJSA-N 2 0 220.316 2.192 20 0 BEADRP CC(C)(C)CC[N@@H+]1C[C@H]2CCC[C@@]2([NH3+])C1 ZINC000622003472 370654469 /nfs/dbraw/zinc/65/44/69/370654469.db2.gz AGMNJRNFQMNLGX-DGCLKSJQSA-N 2 0 210.365 2.236 20 0 BEADRP C[N@H+]1CC=C(C[NH2+][C@@H]2CCC[C@H]3C[C@H]32)CC1 ZINC000378669428 346803461 /nfs/dbraw/zinc/80/34/61/346803461.db2.gz IVJMFMAPYMNJAY-BFHYXJOUSA-N 2 0 220.360 2.027 20 0 BEADRP CCC[C@H](C)C[N@@H+]1C[C@H]2CCC[C@]2([NH3+])C1 ZINC000622004476 370656161 /nfs/dbraw/zinc/65/61/61/370656161.db2.gz PGYLMEFOGKNULV-XQQFMLRXSA-N 2 0 210.365 2.236 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+][C@H](C)[C@H]1CCCC[NH2+]1 ZINC000388007555 347152135 /nfs/dbraw/zinc/15/21/35/347152135.db2.gz NAYDPHXIWLRMBS-FVCCEPFGSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+][C@H]1CO[C@H](C)C1 ZINC000402170016 349975485 /nfs/dbraw/zinc/97/54/85/349975485.db2.gz UVDCBERDHIHEAS-YIYPIFLZSA-N 2 0 240.391 2.064 20 0 BEADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+][C@H]1CO[C@@H](C)C1 ZINC000402170018 349975766 /nfs/dbraw/zinc/97/57/66/349975766.db2.gz UVDCBERDHIHEAS-ZOBORPQBSA-N 2 0 240.391 2.064 20 0 BEADRP Cc1cc(C[N@H+]2C[C@H]3C[NH2+]C[C@H]3C2)c(C)s1 ZINC000082238103 347306916 /nfs/dbraw/zinc/30/69/16/347306916.db2.gz HZIKNIUNIWAOCK-BETUJISGSA-N 2 0 236.384 2.016 20 0 BEADRP Cc1ncccc1C[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000310876874 347316652 /nfs/dbraw/zinc/31/66/52/347316652.db2.gz UWMAHHGOSXRKIZ-UHFFFAOYSA-N 2 0 247.386 2.212 20 0 BEADRP CC(C)[C@H](C)[NH2+]CCC[NH+]1CCCCC1 ZINC000020128801 347409101 /nfs/dbraw/zinc/40/91/01/347409101.db2.gz SSFMJODMQCNSGM-ZDUSSCGKSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+]C1CCC([NH3+])CC1 ZINC000051692857 136750175 /nfs/dbraw/zinc/75/01/75/136750175.db2.gz ARRPPWGCSSGOQY-PNESKVBLSA-N 2 0 236.359 2.460 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H]1CCC[NH2+]1)C1CCCC1 ZINC000382792379 347418452 /nfs/dbraw/zinc/41/84/52/347418452.db2.gz QCLBXFIHWKPFNT-QWHCGFSZSA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@H](c1ccccc1)[NH+]1C[C@@H]2C[NH2+]C[C@H]2C1 ZINC000251167583 362842404 /nfs/dbraw/zinc/84/24/04/362842404.db2.gz BCXCOULHNIDEGW-SOUVJXGZSA-N 2 0 230.355 2.289 20 0 BEADRP COCCC[NH+]1CCC(C[N@H+](C)C(C)C)CC1 ZINC000590786253 347556984 /nfs/dbraw/zinc/55/69/84/347556984.db2.gz KMNMBDREGFXPBF-UHFFFAOYSA-N 2 0 242.407 2.075 20 0 BEADRP Cc1ccccc1C[N@H+](C)C[C@H]1CCC[NH2+]C1 ZINC000042436131 179268708 /nfs/dbraw/zinc/26/87/08/179268708.db2.gz NMLWZEONSPXPAG-AWEZNQCLSA-N 2 0 232.371 2.426 20 0 BEADRP Cc1ccccc1C[N@H+]1CC[C@@H](C)[C@@H](C[NH3+])C1 ZINC000229061757 179272983 /nfs/dbraw/zinc/27/29/83/179272983.db2.gz DVWDWYGCPMUCEO-HIFRSBDPSA-N 2 0 232.371 2.412 20 0 BEADRP Cc1ccccc1C[N@H+]1CC[C@H](C)[C@@H](C[NH3+])C1 ZINC000229061773 179275896 /nfs/dbraw/zinc/27/58/96/179275896.db2.gz DVWDWYGCPMUCEO-ZFWWWQNUSA-N 2 0 232.371 2.412 20 0 BEADRP Cc1ccccc1C[N@@H+]1CC[C@H]([NH3+])[C@H](C)C1 ZINC000049712975 179276970 /nfs/dbraw/zinc/27/69/70/179276970.db2.gz RYRFEPQYAFWMQG-OCCSQVGLSA-N 2 0 218.344 2.164 20 0 BEADRP Cc1nc(C)c([C@@H](C)[NH2+]C[C@H](C)C[NH3+])s1 ZINC000054345901 347771223 /nfs/dbraw/zinc/77/12/23/347771223.db2.gz YSEXKBLJRHFAAW-HTQZYQBOSA-N 2 0 227.377 2.005 20 0 BEADRP CC[NH+](CC)CCC[N@H+](CC)CCSC ZINC000592205490 347756842 /nfs/dbraw/zinc/75/68/42/347756842.db2.gz ZWBYHZQNOJEVCC-UHFFFAOYSA-N 2 0 232.437 2.403 20 0 BEADRP Cc1ccccc1C[C@H](C)[NH2+][C@H]1CN(C)C[C@@H]1C ZINC000358002520 179291401 /nfs/dbraw/zinc/29/14/01/179291401.db2.gz GHYJWQNQQKIGBZ-DZKIICNBSA-N 2 0 246.398 2.466 20 0 BEADRP CCS[C@@H]1CC[C@@H]([N@H+](C)C[C@@H]2CC[NH2+]C2)C1 ZINC000592476773 347791367 /nfs/dbraw/zinc/79/13/67/347791367.db2.gz YQOSOLKYZUKUQU-JHJVBQTASA-N 2 0 242.432 2.202 20 0 BEADRP C[NH+](C)CC1CC[NH+](C2CCCC2)CC1 ZINC000202466292 348021052 /nfs/dbraw/zinc/02/10/52/348021052.db2.gz GCEBWQPROXAYTK-UHFFFAOYSA-N 2 0 210.365 2.203 20 0 BEADRP COC[C@H]([NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21)C1CC1 ZINC000397299174 348043876 /nfs/dbraw/zinc/04/38/76/348043876.db2.gz CTTVNRIDWFBGHJ-ILXRZTDVSA-N 2 0 246.354 2.146 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@@H]1CCC[C@H]2C[C@H]21 ZINC000309002552 323184240 /nfs/dbraw/zinc/18/42/40/323184240.db2.gz ZNMRCCKAFUCEGM-YVECIDJPSA-N 2 0 210.365 2.105 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+][C@H]2CCCOCC2)CC1(C)C ZINC000623484839 362909178 /nfs/dbraw/zinc/90/91/78/362909178.db2.gz DKNBOTCNWXWLQW-QWHCGFSZSA-N 2 0 240.391 2.018 20 0 BEADRP CCSC1(C[NH2+][C@@H](C)[C@@H]2CCC[NH2+]2)CC1 ZINC000596652321 348606831 /nfs/dbraw/zinc/60/68/31/348606831.db2.gz PPFAJZRXFSXWQC-QWRGUYRKSA-N 2 0 228.405 2.002 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C2CC(F)(F)C2)CC1(C)C ZINC000623507342 362931656 /nfs/dbraw/zinc/93/16/56/362931656.db2.gz FOJFKDXMBWXTON-VIFPVBQESA-N 2 0 232.318 2.247 20 0 BEADRP CCC[C@H](CC)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000054243864 348961140 /nfs/dbraw/zinc/96/11/40/348961140.db2.gz OQXXNDPFBGVMLY-STQMWFEESA-N 2 0 212.381 2.497 20 0 BEADRP COC1([C@@H](C)[NH2+]C[C@@H](C)C[NH+](C)C)CCCC1 ZINC000421853138 192389893 /nfs/dbraw/zinc/38/98/93/192389893.db2.gz IPHBFUOETMMYHM-CHWSQXEVSA-N 2 0 242.407 2.121 20 0 BEADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+][C@H]2CCCSC2)C1 ZINC000250483678 349171258 /nfs/dbraw/zinc/17/12/58/349171258.db2.gz DEMWUSNSSPWNMW-STQMWFEESA-N 2 0 242.432 2.202 20 0 BEADRP CCOc1cccc(C[N@@H+]2CC[C@@H]([NH3+])C[C@H]2C)c1 ZINC000252687381 349210565 /nfs/dbraw/zinc/21/05/65/349210565.db2.gz LDDBVEJWLULUKB-TZMCWYRMSA-N 2 0 248.370 2.397 20 0 BEADRP CC1(C)CC(C[N@@H+]2CCC[C@H](CC[NH3+])C2)C1 ZINC000530220375 323218181 /nfs/dbraw/zinc/21/81/81/323218181.db2.gz UFQKVZDSVKZGRB-GFCCVEGCSA-N 2 0 224.392 2.483 20 0 BEADRP C[C@@H]1C[N@H+](C/C=C\c2ccccc2)CC[C@H]1[NH3+] ZINC000251928022 349193523 /nfs/dbraw/zinc/19/35/23/349193523.db2.gz YMPMBDKWTYYQOB-VZFGUZNESA-N 2 0 230.355 2.369 20 0 BEADRP C[C@@H]([NH2+]CC(C1CCC1)C1CCC1)C1C[NH2+]C1 ZINC000530213025 323216756 /nfs/dbraw/zinc/21/67/56/323216756.db2.gz SVJNWYXFWPQLLM-LLVKDONJSA-N 2 0 236.403 2.400 20 0 BEADRP [NH3+]CC1CCC([NH2+]CC2CC=CC2)CC1 ZINC000530214830 323216797 /nfs/dbraw/zinc/21/67/97/323216797.db2.gz DBWIDUQYZMGRLL-UHFFFAOYSA-N 2 0 208.349 2.060 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623524327 362944552 /nfs/dbraw/zinc/94/45/52/362944552.db2.gz OASJFEAYKRVBPG-WOPDTQHZSA-N 2 0 210.365 2.247 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000388623666 349274480 /nfs/dbraw/zinc/27/44/80/349274480.db2.gz HZXHLGKKUQGSRF-XQHKEYJVSA-N 2 0 210.365 2.425 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]C2CCCC2)[C@@H](C)C1 ZINC000221694966 349277221 /nfs/dbraw/zinc/27/72/21/349277221.db2.gz OOYRDELLAVVNMI-WCQYABFASA-N 2 0 210.365 2.249 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+][C@H]1CC[NH2+]C[C@H]1C ZINC000388634452 349279098 /nfs/dbraw/zinc/27/90/98/349279098.db2.gz MEHMUEDDJOQREN-NDBYEHHHSA-N 2 0 210.365 2.153 20 0 BEADRP CSC1CC[NH+](CC[C@H]2CCC[NH2+]C2)CC1 ZINC000300868090 349381811 /nfs/dbraw/zinc/38/18/11/349381811.db2.gz QGLYKNLUQJOAAX-GFCCVEGCSA-N 2 0 242.432 2.204 20 0 BEADRP Cc1c[nH+]ccc1NC[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000070489530 350015219 /nfs/dbraw/zinc/01/52/19/350015219.db2.gz CYBWNBZGGVJRSC-LBPRGKRZSA-N 2 0 231.343 2.286 20 0 BEADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+][C@@H]2CC[C@@H](C)C2)C1 ZINC000070643537 350035994 /nfs/dbraw/zinc/03/59/94/350035994.db2.gz ALEZIGMLRIHGLW-HZSPNIEDSA-N 2 0 224.392 2.495 20 0 BEADRP C(CC1CC1)[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000128059309 191008656 /nfs/dbraw/zinc/00/86/56/191008656.db2.gz JWXWUZWMLFWAES-CHWSQXEVSA-N 2 0 208.349 2.003 20 0 BEADRP C[C@H](c1ccncc1)N1CC[C@H](C[NH+](C)C)C1 ZINC000603939453 350056799 /nfs/dbraw/zinc/05/67/99/350056799.db2.gz MDFBZUHXMQTVKY-CHWSQXEVSA-N 2 0 233.359 2.026 20 0 BEADRP C[C@H](C[NH2+][C@@H](C)CC1CC1)C[NH+]1CCCC1 ZINC000132429859 191033515 /nfs/dbraw/zinc/03/35/15/191033515.db2.gz GKOBYFLVQYMMFP-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP CSCCCC[NH2+][C@H]1CC[N@H+](C)C[C@@H]1C ZINC000133641699 191042960 /nfs/dbraw/zinc/04/29/60/191042960.db2.gz WHCKHGSYVBEZFS-RYUDHWBXSA-N 2 0 230.421 2.059 20 0 BEADRP CSCCCC[NH2+][C@H]1CC[N@H+](C)C[C@H]1C ZINC000133641487 191043055 /nfs/dbraw/zinc/04/30/55/191043055.db2.gz WHCKHGSYVBEZFS-NEPJUHHUSA-N 2 0 230.421 2.059 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@H](C1CC1)C1CCC1 ZINC000324790580 323282916 /nfs/dbraw/zinc/28/29/16/323282916.db2.gz JURBLZZWGVVSIU-SWHYSGLUSA-N 2 0 222.376 2.153 20 0 BEADRP Cc1ncc(C[NH2+]C[C@@H]2CCC[C@@H]([NH3+])C2)s1 ZINC000070503292 180152028 /nfs/dbraw/zinc/15/20/28/180152028.db2.gz KQSPSYYFWRJPCM-GHMZBOCLSA-N 2 0 239.388 2.059 20 0 BEADRP Cc1ncc(C[NH2+]Cc2ccc(C[NH3+])cc2)s1 ZINC000049538863 180152759 /nfs/dbraw/zinc/15/27/59/180152759.db2.gz UXXCUHRNGAFZLJ-UHFFFAOYSA-N 2 0 247.367 2.200 20 0 BEADRP Cc1ncccc1CN[C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000368367692 180222650 /nfs/dbraw/zinc/22/26/50/180222650.db2.gz UGDAYLXRJZRJAJ-LSDHHAIUSA-N 2 0 245.370 2.106 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@@H]2CC=CCC2)CC1 ZINC000037977182 350297190 /nfs/dbraw/zinc/29/71/90/350297190.db2.gz SZFPXTHWIKRKFH-CYBMUJFWSA-N 2 0 222.376 2.417 20 0 BEADRP C[C@H](Cc1ccsc1)[NH2+][C@H]1CC[NH2+]C[C@H]1C ZINC000309339127 350322636 /nfs/dbraw/zinc/32/26/36/350322636.db2.gz KHUMXFONCCFESO-WZRBSPASSA-N 2 0 238.400 2.267 20 0 BEADRP Cc1ncn(CCCCn2ccnc2C)c1C ZINC000120817411 180286430 /nfs/dbraw/zinc/28/64/30/180286430.db2.gz ZNTUHJGAYXKGHG-UHFFFAOYSA-N 2 0 232.331 2.485 20 0 BEADRP Cc1ncsc1CN1CCCC[C@H]1[C@H](C)[NH3+] ZINC000228290379 180315251 /nfs/dbraw/zinc/31/52/51/180315251.db2.gz YFBTXLNCFBMDLU-ONGXEEELSA-N 2 0 239.388 2.153 20 0 BEADRP COCC[C@@H]1CCC[C@@H]1[NH2+]CCC[NH2+]C(C)C ZINC000563951255 323329766 /nfs/dbraw/zinc/32/97/66/323329766.db2.gz UKRWGQOIHXGRAY-KBPBESRZSA-N 2 0 242.407 2.169 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CCCc1nccs1 ZINC000391128324 350463754 /nfs/dbraw/zinc/46/37/54/350463754.db2.gz BCOKFOVUUVUEBF-NSHDSACASA-N 2 0 241.404 2.183 20 0 BEADRP C[C@@H]1SCC[C@@H]1[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000300333418 490556874 /nfs/dbraw/zinc/55/68/74/490556874.db2.gz MJFNSLXGICIUJR-RVMXOQNASA-N 2 0 240.416 2.097 20 0 BEADRP C[C@H]([NH3+])[C@H]1CC[N@H+](CCCOc2ccccc2)C1 ZINC000163172290 350508999 /nfs/dbraw/zinc/50/89/99/350508999.db2.gz GZEWUYAOGDGPGK-KBPBESRZSA-N 2 0 248.370 2.125 20 0 BEADRP CO[C@@H](C)[C@@H](C)[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000163250388 350511239 /nfs/dbraw/zinc/51/12/39/350511239.db2.gz IYADKMWGYABFRX-NEPJUHHUSA-N 2 0 242.407 2.262 20 0 BEADRP CC[C@H]1CCC[C@@H]1[NH2+]CC1=CC[NH2+]CC1 ZINC000577483029 365965469 /nfs/dbraw/zinc/96/54/69/365965469.db2.gz GGFZHIRJJQPLED-STQMWFEESA-N 2 0 208.349 2.074 20 0 BEADRP C[C@@H]1CC[C@@H](C[NH2+][C@H]2CC[N@H+](C)C(C)(C)C2)O1 ZINC000623545185 362965409 /nfs/dbraw/zinc/96/54/09/362965409.db2.gz AAXAGOUQTLARPD-AGIUHOORSA-N 2 0 240.391 2.016 20 0 BEADRP CC[C@@H]1CCCC[C@H]1[NH2+]CCN(C)CC ZINC000070558518 350538205 /nfs/dbraw/zinc/53/82/05/350538205.db2.gz SBTNRNRGEAEKCR-CHWSQXEVSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CC[N@H+](C)C(C)(C)C2)CS1 ZINC000623549722 362969528 /nfs/dbraw/zinc/96/95/28/362969528.db2.gz MOSQMNFOWKTOSV-IJLUTSLNSA-N 2 0 242.432 2.343 20 0 BEADRP CC[C@@H](C)C[N@@H+]1CC[C@]2(C1)CCC[NH2+]C2 ZINC000335619799 538097852 /nfs/dbraw/zinc/09/78/52/538097852.db2.gz NASYOPGEMZCVST-CHWSQXEVSA-N 2 0 210.365 2.108 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@H]2CC23CC3)CC1(C)C ZINC000623554619 362974878 /nfs/dbraw/zinc/97/48/78/362974878.db2.gz GZZUOMHELDPEFI-QWRGUYRKSA-N 2 0 208.349 2.001 20 0 BEADRP C[C@@H]1CC[C@H](C)[N@H+]1CC[C@H]1CCC[NH+]1C ZINC000245593203 350823642 /nfs/dbraw/zinc/82/36/42/350823642.db2.gz GTVWDZDQMYCWBA-FRRDWIJNSA-N 2 0 210.365 2.344 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@@H]2COC(C)(C)C2)CC1(C)C ZINC000623561959 362986228 /nfs/dbraw/zinc/98/62/28/362986228.db2.gz DAXNVZBBCLDNEG-RYUDHWBXSA-N 2 0 240.391 2.016 20 0 BEADRP CCC(CC)C[NH+]1CCC([NH2+]CCOC)CC1 ZINC000577616171 366018749 /nfs/dbraw/zinc/01/87/49/366018749.db2.gz KTTFIPXMOMKMIN-UHFFFAOYSA-N 2 0 242.407 2.123 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CCc2ccoc2)CC1(C)C ZINC000623569728 362998516 /nfs/dbraw/zinc/99/85/16/362998516.db2.gz VBTHMYXKIVCFGW-ZDUSSCGKSA-N 2 0 236.359 2.285 20 0 BEADRP CC1(C)CCC[C@@H]1[NH2+]C1CCC([NH3+])CC1 ZINC000086857269 351038073 /nfs/dbraw/zinc/03/80/73/351038073.db2.gz QOKNVVRHVGDENS-MCIGGMRASA-N 2 0 210.365 2.425 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+]C[C@]2(C)CC2(F)F)CC1(C)C ZINC000623570154 362999645 /nfs/dbraw/zinc/99/96/45/362999645.db2.gz JEADXLFZSUGSDX-PWSUYJOCSA-N 2 0 246.345 2.494 20 0 BEADRP CCCN1CC[C@H]([NH2+][C@@H](C)[C@@H]2C[C@H]2C2CC2)C1 ZINC000623572975 363003862 /nfs/dbraw/zinc/00/38/62/363003862.db2.gz TZYQNNRHEUOHEK-MXAVVETBSA-N 2 0 236.403 2.495 20 0 BEADRP CC1CC(C[NH2+][C@H]2CC[N@H+](C)C(C)(C)C2)C1 ZINC000623575804 363005795 /nfs/dbraw/zinc/00/57/95/363005795.db2.gz QIPKHWBKPQWSKR-BPCQOVAHSA-N 2 0 224.392 2.495 20 0 BEADRP Cc1cccc(CN[C@@H](C)[C@H]2CCCC[NH2+]2)n1 ZINC000386552805 363013666 /nfs/dbraw/zinc/01/36/66/363013666.db2.gz HHCSDRGHUWSMML-GXTWGEPZSA-N 2 0 233.359 2.010 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]C[C@]2(C)CCCS2)C1 ZINC000628326974 351263695 /nfs/dbraw/zinc/26/36/95/351263695.db2.gz CZDMTAMSDAFSIC-XQQFMLRXSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@H]1CC[C@H](N(C)Cc2ccccc2)C[NH2+]1 ZINC000306987301 351404350 /nfs/dbraw/zinc/40/43/50/351404350.db2.gz YOHBDVNKHVUXCV-JSGCOSHPSA-N 2 0 218.344 2.259 20 0 BEADRP CC[C@](C)(C[NH+]1CCC(C[NH+](C)C)CC1)OC ZINC000637906704 351776360 /nfs/dbraw/zinc/77/63/60/351776360.db2.gz CTKOIPAVDOIWOG-CQSZACIVSA-N 2 0 242.407 2.075 20 0 BEADRP C[C@@H]1CCC[C@H]1[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000414843509 351830321 /nfs/dbraw/zinc/83/03/21/351830321.db2.gz QAPODJVEDFYESO-JHJVBQTASA-N 2 0 210.365 2.154 20 0 BEADRP CCC[C@@H](C[N@H+](C)C[C@@H]1CCC[NH+](C)C1)OC ZINC000637930615 351806915 /nfs/dbraw/zinc/80/69/15/351806915.db2.gz QGJLDQRSKIHSCS-KGLIPLIRSA-N 2 0 242.407 2.075 20 0 BEADRP CC[C@@](C)(C[N@H+](C)CC1CC[NH+](C)CC1)OC ZINC000638029407 351910352 /nfs/dbraw/zinc/91/03/52/351910352.db2.gz PAFKCNIYWQGHOU-AWEZNQCLSA-N 2 0 242.407 2.075 20 0 BEADRP CCCC[C@H](C)[NH2+]CC1=CC[N@H+](C)CC1 ZINC000336738310 351984983 /nfs/dbraw/zinc/98/49/83/351984983.db2.gz RGSGHKRGJOPWON-LBPRGKRZSA-N 2 0 210.365 2.417 20 0 BEADRP CCC[C@H](C[N@@H+]1CC[C@H](C[NH+](C)CC)C1)OC ZINC000638131891 352001674 /nfs/dbraw/zinc/00/16/74/352001674.db2.gz FDSXJYKNRHGNFJ-ZIAGYGMSSA-N 2 0 242.407 2.075 20 0 BEADRP C[C@@H]([NH2+]CCC[NH+]1CCCCC1)[C@@H]1CC1(F)F ZINC000638306896 352136062 /nfs/dbraw/zinc/13/60/62/352136062.db2.gz HQKXXMVNJPKCNH-NEPJUHHUSA-N 2 0 246.345 2.496 20 0 BEADRP C[C@H]([NH2+]CCC[NH+]1CCCCC1)[C@H]1CC1(F)F ZINC000638307190 352136201 /nfs/dbraw/zinc/13/62/01/352136201.db2.gz HQKXXMVNJPKCNH-NWDGAFQWSA-N 2 0 246.345 2.496 20 0 BEADRP C(C[NH2+]CCC[NH+]1CCCCC1)C[C@@H]1CCO1 ZINC000638308951 352136465 /nfs/dbraw/zinc/13/64/65/352136465.db2.gz OSXMIOBREMFVHL-CQSZACIVSA-N 2 0 240.391 2.021 20 0 BEADRP CC[C@@H](C)[C@@H](C[NH2+]CCC[N@H+](C)C(C)C)OC ZINC000638337035 352154977 /nfs/dbraw/zinc/15/49/77/352154977.db2.gz BOUGLVCJNMSXDN-ZIAGYGMSSA-N 2 0 244.423 2.367 20 0 BEADRP CO[C@@H](C[NH2+]CCC[N@H+](C)C(C)C)CC(C)C ZINC000638337017 352155103 /nfs/dbraw/zinc/15/51/03/352155103.db2.gz BGESOBXYEZSXSR-CQSZACIVSA-N 2 0 244.423 2.367 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@H](C)[C@@H]1CC1(F)F ZINC000638338243 352157813 /nfs/dbraw/zinc/15/78/13/352157813.db2.gz UOEFKCAMYATAKF-MNOVXSKESA-N 2 0 234.334 2.350 20 0 BEADRP CC(C)C1(C[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)CC1 ZINC000638360607 352171636 /nfs/dbraw/zinc/17/16/36/352171636.db2.gz XEHCNWKAHXIJHS-ZDUSSCGKSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H](c1ccccc1)[C@H](C)[NH2+]C[C@@H]1CC[NH2+]C1 ZINC000414899935 352174410 /nfs/dbraw/zinc/17/44/10/352174410.db2.gz CVPXMPBBNBEDCY-MELADBBJSA-N 2 0 232.371 2.378 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)[C@H]1CC1(F)F ZINC000638377108 352188566 /nfs/dbraw/zinc/18/85/66/352188566.db2.gz NHZOOZHKGNMECT-WHOHXGKFSA-N 2 0 244.329 2.247 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)[C@@H]1CC1(F)F ZINC000638377104 352188614 /nfs/dbraw/zinc/18/86/14/352188614.db2.gz NHZOOZHKGNMECT-QCNOEVLYSA-N 2 0 244.329 2.247 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+]CC2CCSCC2)C1 ZINC000638382175 352193699 /nfs/dbraw/zinc/19/36/99/352193699.db2.gz SSDRGVCLVUUSPD-ZDUSSCGKSA-N 2 0 242.432 2.061 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](C)[C@H]2CC2(F)F)C1 ZINC000638408346 352213806 /nfs/dbraw/zinc/21/38/06/352213806.db2.gz AHEYAVYEWULFAT-IJLUTSLNSA-N 2 0 246.345 2.352 20 0 BEADRP C[C@@H](CCc1ccccc1F)[NH2+]CCCC[NH3+] ZINC000414915325 352262187 /nfs/dbraw/zinc/26/21/87/352262187.db2.gz ZCCGVHZZLXNQBX-LBPRGKRZSA-N 2 0 238.350 2.475 20 0 BEADRP C(=C/c1ccccc1)\C[NH2+][C@H]1CCC[NH2+]CC1 ZINC000414919666 352282292 /nfs/dbraw/zinc/28/22/92/352282292.db2.gz VOHJJPQDTGBFIK-LWUPOJRFSA-N 2 0 230.355 2.432 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@H](C)[C@H]2CC2(F)F)CC1 ZINC000638562685 352387651 /nfs/dbraw/zinc/38/76/51/352387651.db2.gz AUWSPQIUGKFBEO-ZYHUDNBSSA-N 2 0 246.345 2.352 20 0 BEADRP Cc1ccc(CC[NH2+]C[C@H]2CCC[N@@H+](C)C2)cc1 ZINC000638589802 352420911 /nfs/dbraw/zinc/42/09/11/352420911.db2.gz YUSQGFPGBTYZDM-MRXNPFEDSA-N 2 0 246.398 2.469 20 0 BEADRP C[C@@H]1C[C@H](C)C[N@H+]([C@H]2CC[NH2+][C@H](C)C2)C1 ZINC000252958516 538103740 /nfs/dbraw/zinc/10/37/40/538103740.db2.gz SWIAYLRCUHHJGQ-XQHKEYJVSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@@H]([NH2+][C@@H](c1ccccc1)C1CC1)C1C[NH2+]C1 ZINC000422805060 192475313 /nfs/dbraw/zinc/47/53/13/192475313.db2.gz LOVUNPZMVQEPJB-ABAIWWIYSA-N 2 0 230.355 2.335 20 0 BEADRP CC(C)C[C@H](C)C[N@@H+]1CC[C@H]([NH3+])[C@H](C)C1 ZINC000300831788 188001679 /nfs/dbraw/zinc/00/16/79/188001679.db2.gz CCWIQMWOKXTLTP-XQQFMLRXSA-N 2 0 212.381 2.338 20 0 BEADRP CC(C)C[C@@H](C)C[N@@H+]1CC[C@](C)(C[NH3+])C1 ZINC000300986630 188001963 /nfs/dbraw/zinc/00/19/63/188001963.db2.gz UXKYYFSLGMFCAQ-CHWSQXEVSA-N 2 0 212.381 2.339 20 0 BEADRP CC(C)C[C@H](C)[NH2+]CC1(C)CC[NH2+]CC1 ZINC000336661005 187992631 /nfs/dbraw/zinc/99/26/31/187992631.db2.gz BXMFRRHJPANTBC-LBPRGKRZSA-N 2 0 212.381 2.400 20 0 BEADRP CCCCC[NH+]1CCC(C[NH2+]CC)CC1 ZINC000053658885 168695135 /nfs/dbraw/zinc/69/51/35/168695135.db2.gz CWEGCEHOTWMLFS-UHFFFAOYSA-N 2 0 212.381 2.498 20 0 BEADRP C(C[N@@H+]1CC[C@@H](C[NH+]2CCCC2)C1)C1CC1 ZINC000336663053 188011513 /nfs/dbraw/zinc/01/15/13/188011513.db2.gz DTRACCJHCKOGMU-AWEZNQCLSA-N 2 0 222.376 2.204 20 0 BEADRP Cc1ccnc([C@H](C)[NH2+]CCCC[NH+](C)C)c1 ZINC000286365605 188034884 /nfs/dbraw/zinc/03/48/84/188034884.db2.gz ZJGMQXADZNYUKO-ZDUSSCGKSA-N 2 0 235.375 2.382 20 0 BEADRP CC(C)[C@@](C)([NH2+]CC[C@@H]1CCC[N@@H+]1C)C(N)=O ZINC000331344258 188046988 /nfs/dbraw/zinc/04/69/88/188046988.db2.gz LECTZHWCMOOBFF-WCQYABFASA-N 2 0 241.379 2.010 20 0 BEADRP CC(C)C[C@@H](C)[N@@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC000336268402 188053841 /nfs/dbraw/zinc/05/38/41/188053841.db2.gz IAVNRIPBFNAGDD-KGLIPLIRSA-N 2 0 224.392 2.449 20 0 BEADRP CC[C@H]([NH2+]CCCC[NH3+])c1ccccc1OC ZINC000037715401 358476521 /nfs/dbraw/zinc/47/65/21/358476521.db2.gz MBDUIFMFWSICCO-ZDUSSCGKSA-N 2 0 236.359 2.475 20 0 BEADRP COc1ccc([C@@H](C)[NH2+]CCCC[NH3+])c(F)c1 ZINC000037715475 358476636 /nfs/dbraw/zinc/47/66/36/358476636.db2.gz FOLDODUAWYQDJC-SNVBAGLBSA-N 2 0 240.322 2.224 20 0 BEADRP CCN1CC[C@@H]([NH2+][C@@H]2CCc3ccccc32)C1 ZINC000328238899 353245742 /nfs/dbraw/zinc/24/57/42/353245742.db2.gz HROVKUAWJDJPKF-UKRRQHHQSA-N 2 0 230.355 2.358 20 0 BEADRP CCO[C@@H]1C[C@@H]1[NH2+][C@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000563700103 353275184 /nfs/dbraw/zinc/27/51/84/353275184.db2.gz FQJLFMUTJZYHGI-YIYPIFLZSA-N 2 0 240.391 2.064 20 0 BEADRP c1coc(CC[NH2+][C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)c1 ZINC000250069962 353267482 /nfs/dbraw/zinc/26/74/82/353267482.db2.gz ACTOBCLKHMPQNO-RBSFLKMASA-N 2 0 248.370 2.332 20 0 BEADRP CC[C@@H](F)CN(C)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000353156907 188233353 /nfs/dbraw/zinc/23/33/53/188233353.db2.gz UCGIOCNOMCNYNG-FKJOKYEKSA-N 2 0 228.355 2.292 20 0 BEADRP C(C1CCCCC1)[N@@H+]1CC[C@@]2(CC[NH2+]C2)C1 ZINC000031994524 188233632 /nfs/dbraw/zinc/23/36/32/188233632.db2.gz CMDIFNVECSBZAR-CQSZACIVSA-N 2 0 222.376 2.252 20 0 BEADRP C[C@@H](Cc1ccsc1)[NH2+]CCC[NH+](C)C ZINC000122115183 324029043 /nfs/dbraw/zinc/02/90/43/324029043.db2.gz ZANSPWJRRKDQNH-NSHDSACASA-N 2 0 226.389 2.220 20 0 BEADRP C[C@@H]1CCC[C@H]([N@H+](C)C[C@H]2CCC[NH2+]C2)C1 ZINC000251779856 353288035 /nfs/dbraw/zinc/28/80/35/353288035.db2.gz LCBANQWDZGQMCW-RDBSUJKOSA-N 2 0 224.392 2.497 20 0 BEADRP FCCCC[NH2+][C@@H]1CCC[C@H]1[C@H]1CCC[NH2+]1 ZINC000309215405 180927097 /nfs/dbraw/zinc/92/70/97/180927097.db2.gz FJRVQSAYLCMEHV-JHJVBQTASA-N 2 0 228.355 2.246 20 0 BEADRP CC(C)[N@H+](CCC[NH3+])Cc1ccc(F)cc1 ZINC000036731987 188255332 /nfs/dbraw/zinc/25/53/32/188255332.db2.gz ZXUZNXDPPZWQGW-UHFFFAOYSA-N 2 0 224.323 2.385 20 0 BEADRP C[C@@H]1C[N@H+](C/C=C/c2ccccc2)CC[C@H]1[NH3+] ZINC000251928019 353293447 /nfs/dbraw/zinc/29/34/47/353293447.db2.gz YMPMBDKWTYYQOB-IEOKHJKGSA-N 2 0 230.355 2.369 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](C[C@H]2CCCC[C@H]2C)C1 ZINC000252128732 353297002 /nfs/dbraw/zinc/29/70/02/353297002.db2.gz KLFHTYXLSZCLRG-HZSPNIEDSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H]1CCC[N@H+](CCC2CC[NH2+]CC2)[C@H]1C ZINC000252219722 353299213 /nfs/dbraw/zinc/29/92/13/353299213.db2.gz YRTHNYBSOKWNCL-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP CS[C@H](C)C[NH2+][C@@H]1CCC[C@H]1[C@H]1CCC[NH2+]1 ZINC000252951170 353313113 /nfs/dbraw/zinc/31/31/13/353313113.db2.gz DPCXQIVTHOEXAU-YVECIDJPSA-N 2 0 242.432 2.248 20 0 BEADRP C1C[C@H]([NH2+][C@@H]2CC[NH2+]C2)C2(C1)CCCCC2 ZINC000313024754 188328672 /nfs/dbraw/zinc/32/86/72/188328672.db2.gz NKXDUEBTVUIQCV-OLZOCXBDSA-N 2 0 222.376 2.441 20 0 BEADRP F[C@@H]1CC[C@@H]([NH2+]Cc2cccc3nccn32)C1 ZINC000334502591 353342486 /nfs/dbraw/zinc/34/24/86/353342486.db2.gz FIFADGXPSAVRSQ-GHMZBOCLSA-N 2 0 233.290 2.315 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccsc3)C[C@@H]21 ZINC000230126773 353473696 /nfs/dbraw/zinc/47/36/96/353473696.db2.gz XBSFAUXONVIAPO-FRRDWIJNSA-N 2 0 236.384 2.307 20 0 BEADRP Cc1cccc(OCC[N@@H+]2CC[C@@H]([NH3+])[C@@H](C)C2)c1 ZINC000220509439 353848043 /nfs/dbraw/zinc/84/80/43/353848043.db2.gz VMLPKQNOTQOUAZ-DZGCQCFKSA-N 2 0 248.370 2.043 20 0 BEADRP CSCCCC[NH2+][C@@H]1CCCC[C@H]1C[NH3+] ZINC000229207824 363273835 /nfs/dbraw/zinc/27/38/35/363273835.db2.gz MSXDMBAIMLCMNU-NWDGAFQWSA-N 2 0 230.421 2.237 20 0 BEADRP CC(C)C1(C[N@H+](C)CCC[NH+](C)C)CC1 ZINC000639167916 354042478 /nfs/dbraw/zinc/04/24/78/354042478.db2.gz MVZOIWUVMACNGX-UHFFFAOYSA-N 2 0 212.381 2.306 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)C[C@H](CC(C)C)OC ZINC000639175269 354194101 /nfs/dbraw/zinc/19/41/01/354194101.db2.gz KDZGVXZETPVWKV-AWEZNQCLSA-N 2 0 244.423 2.321 20 0 BEADRP CCC[N@H+](CCC[NH+](C)C)C[C@H](OC)C1CC1 ZINC000639175800 354207097 /nfs/dbraw/zinc/20/70/97/354207097.db2.gz TUZIPKCOTPGZIG-AWEZNQCLSA-N 2 0 242.407 2.075 20 0 BEADRP CCC[N@@H+]1CCCC2(CC[NH+](C)CC2)C1 ZINC000366862965 354244032 /nfs/dbraw/zinc/24/40/32/354244032.db2.gz DHXRFBAFGLBUCY-UHFFFAOYSA-N 2 0 210.365 2.204 20 0 BEADRP CCC[N@H+](CCC[NH+](C)C)C[C@](C)(CC)OC ZINC000639176216 354219993 /nfs/dbraw/zinc/21/99/93/354219993.db2.gz ZGYWLVPZTHJBPR-AWEZNQCLSA-N 2 0 244.423 2.465 20 0 BEADRP C[C@@H](C[NH2+]C1CC(C)C1)C[NH+]1CCCC1 ZINC000231787570 363353756 /nfs/dbraw/zinc/35/37/56/363353756.db2.gz PZZWEOMDOOYIPO-CPCZMJQVSA-N 2 0 210.365 2.106 20 0 BEADRP CCC[C@H](C[N@H+](C)[C@H]1CCN(C)C[C@@H]1C)OC ZINC000639180427 354278535 /nfs/dbraw/zinc/27/85/35/354278535.db2.gz WSDMMQOMWOFQNG-MJBXVCDLSA-N 2 0 242.407 2.074 20 0 BEADRP CCC[C@H](C)[N@H+](C)C[C@@H]1CC[NH2+][C@@H](C)C1 ZINC000233336165 363399677 /nfs/dbraw/zinc/39/96/77/363399677.db2.gz LWNBUPILRFOOJA-RWMBFGLXSA-N 2 0 212.381 2.495 20 0 BEADRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@H](C)C(C)(C)C ZINC000166032245 354865032 /nfs/dbraw/zinc/86/50/32/354865032.db2.gz NHOSZUCDULHSNH-OLZOCXBDSA-N 2 0 244.423 2.367 20 0 BEADRP COC1CCC([NH2+][C@@H]2CCCN(C)[C@@H]2C)CC1 ZINC000346329418 354898362 /nfs/dbraw/zinc/89/83/62/354898362.db2.gz MQQIDADIKLUGFL-BLYZHGLHSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@@H]([NH2+]C1CCc2ccccc2CC1)C1C[NH2+]C1 ZINC000335174927 354942749 /nfs/dbraw/zinc/94/27/49/354942749.db2.gz DAOLBWWACMJQNG-GFCCVEGCSA-N 2 0 244.382 2.132 20 0 BEADRP C[C@@H]([NH3+])CN1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000335229454 355071739 /nfs/dbraw/zinc/07/17/39/355071739.db2.gz FGOHWTAKSAVABB-PWSUYJOCSA-N 2 0 238.762 2.477 20 0 BEADRP C[C@H]1CC[N@H+](CC2CC[NH2+]CC2)C[C@@H](C)C1 ZINC000346989554 355189478 /nfs/dbraw/zinc/18/94/78/355189478.db2.gz RTLYOWSUIVNMQK-STQMWFEESA-N 2 0 224.392 2.354 20 0 BEADRP Cc1ccccc1C[NH2+][C@@H]1CC[NH2+]CC[C@H]1C ZINC000335256229 355189513 /nfs/dbraw/zinc/18/95/13/355189513.db2.gz FDJAELUVTCOHTB-UKRRQHHQSA-N 2 0 232.371 2.473 20 0 BEADRP CCC[C@H]1CCC[N@H+](C[C@@H]2CCC[NH2+]C2)C1 ZINC000346997595 355196055 /nfs/dbraw/zinc/19/60/55/355196055.db2.gz XMERJWBPIGIDBO-UONOGXRCSA-N 2 0 224.392 2.498 20 0 BEADRP C[NH2+]CCC[NH+]1CCC(OC2CCCC2)CC1 ZINC000435875425 191329055 /nfs/dbraw/zinc/32/90/55/191329055.db2.gz SCYDDRXGPBZCRQ-UHFFFAOYSA-N 2 0 240.391 2.020 20 0 BEADRP COCC[N@H+](CCCc1cnccc1C)C1CC1 ZINC000347619963 355237365 /nfs/dbraw/zinc/23/73/65/355237365.db2.gz WXBZDMHIMXMSGQ-UHFFFAOYSA-N 2 0 248.370 2.433 20 0 BEADRP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)[C@@H]1CC1(F)F ZINC000639245729 355275052 /nfs/dbraw/zinc/27/50/52/355275052.db2.gz BDXPBJKEAAFUSQ-MGMMNNENSA-N 2 0 244.329 2.245 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC[C@H]2CCC[N@H+](C)C2)CS1 ZINC000639256769 355300226 /nfs/dbraw/zinc/30/02/26/355300226.db2.gz FQTDWRMVEBMJDF-UPJWGTAASA-N 2 0 242.432 2.202 20 0 BEADRP CC(C)(C)C[NH+]1CCC2(CC[NH2+]C2)CC1 ZINC000203713038 491078711 /nfs/dbraw/zinc/07/87/11/491078711.db2.gz SWPRBVBCUZFSGL-UHFFFAOYSA-N 2 0 210.365 2.108 20 0 BEADRP CC(C)[N@H+](CC[C@@H]1CC[NH2+]C1)CC1CC1 ZINC000084385417 355360960 /nfs/dbraw/zinc/36/09/60/355360960.db2.gz DHNPASAMMKHCKC-LBPRGKRZSA-N 2 0 210.365 2.106 20 0 BEADRP CC[NH+](CC)CCOCC[NH2+][C@@H]1CC[C@@H](C)C1 ZINC000349698010 355413152 /nfs/dbraw/zinc/41/31/52/355413152.db2.gz XGSLGOXABVLFBI-ZIAGYGMSSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)C[C@H]([NH3+])CNc1ccc([C@H](C)[NH3+])cc1 ZINC000414809661 191577038 /nfs/dbraw/zinc/57/70/38/191577038.db2.gz VYSVDNWQCIOKNZ-AAEUAGOBSA-N 2 0 235.375 2.492 20 0 BEADRP CC(C)C[N@H+](C)CCC[NH2+]CCC[C@H]1CCO1 ZINC000639290881 355465654 /nfs/dbraw/zinc/46/56/54/355465654.db2.gz WNZFHFDCNZLEIC-AWEZNQCLSA-N 2 0 242.407 2.123 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]Cc1cccc(Cl)c1 ZINC000414829072 191590009 /nfs/dbraw/zinc/59/00/09/191590009.db2.gz AJJKXLXZBDGNJV-JTQLQIEISA-N 2 0 226.751 2.285 20 0 BEADRP C[C@H](CC1CC1)[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000414844972 191598792 /nfs/dbraw/zinc/59/87/92/191598792.db2.gz RZPFZROTQMQALF-DGCLKSJQSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[C@@H]([NH3+])C1)C1CCC1 ZINC000414991370 191642610 /nfs/dbraw/zinc/64/26/10/191642610.db2.gz BBPJVLLZIWIYNY-DMDPSCGWSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+][C@@H](C)[C@H](C)[NH3+] ZINC000415013124 191649874 /nfs/dbraw/zinc/64/98/74/191649874.db2.gz KFKHSMVJSWWSHZ-CSMHCCOUSA-N 2 0 212.259 2.043 20 0 BEADRP COC[C@H](CC(C)C)[NH2+][C@H](C)CCCC[NH3+] ZINC000415015640 191651501 /nfs/dbraw/zinc/65/15/01/191651501.db2.gz ONPIEBBTJKMPQN-OLZOCXBDSA-N 2 0 230.396 2.155 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]Cc1cnc2ccccc2c1 ZINC000415023667 191655575 /nfs/dbraw/zinc/65/55/75/191655575.db2.gz NGTBDOBIQJSIGK-LBPRGKRZSA-N 2 0 243.354 2.452 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H]1C[C@H](c2ccccc2)[C@@H]1C ZINC000414869622 191608267 /nfs/dbraw/zinc/60/82/67/191608267.db2.gz AYVDMCVRONKYEU-PAPYEOQZSA-N 2 0 232.371 2.363 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]C[C@@H](C)c1ccc(F)cc1 ZINC000414877736 191612229 /nfs/dbraw/zinc/61/22/29/191612229.db2.gz NEHZRLSKBPIVTB-GHMZBOCLSA-N 2 0 224.323 2.114 20 0 BEADRP CC1(C)CCC([NH2+]C[C@H]([NH3+])C2CC2)CC1 ZINC000414893048 191617841 /nfs/dbraw/zinc/61/78/41/191617841.db2.gz QWNCPFIWAJCIHA-LBPRGKRZSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]Cc1cc(F)cc(F)c1 ZINC000415027979 191656747 /nfs/dbraw/zinc/65/67/47/191656747.db2.gz XPGBCAPDSUPUBY-SECBINFHSA-N 2 0 228.286 2.182 20 0 BEADRP Cc1ccc(C[NH2+]CCC[C@H]2CCC[NH2+]2)nc1 ZINC000414972060 191637488 /nfs/dbraw/zinc/63/74/88/191637488.db2.gz LUTYXRBXRBACGH-ZDUSSCGKSA-N 2 0 233.359 2.012 20 0 BEADRP C[C@@H](F)CC[N@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000352050005 134045804 /nfs/dbraw/zinc/04/58/04/134045804.db2.gz PHZKIIJNTKAAHR-VXGBXAGGSA-N 2 0 216.344 2.008 20 0 BEADRP Cc1cccc(C[NH2+][C@H]2CC[C@@H](C[NH3+])C2)c1 ZINC000415038420 191660132 /nfs/dbraw/zinc/66/01/32/191660132.db2.gz NJNGCQZSJSVJMG-OCCSQVGLSA-N 2 0 218.344 2.212 20 0 BEADRP [NH3+]C[C@H]1CC[C@H]([NH2+]Cc2ccc(F)cc2)C1 ZINC000415047825 191662261 /nfs/dbraw/zinc/66/22/61/191662261.db2.gz WFVCOSABCSHRQY-AAEUAGOBSA-N 2 0 222.307 2.043 20 0 BEADRP CCc1ccccc1C[N@@H+]1C[C@H](C[NH3+])C[C@@H]1C ZINC000215989509 355640813 /nfs/dbraw/zinc/64/08/13/355640813.db2.gz DVDAHRXMHABHPY-STQMWFEESA-N 2 0 232.371 2.418 20 0 BEADRP CC[C@](C)(C[NH2+]C[C@@H]1CCN1C(C)(C)C)OC ZINC000639302503 355647583 /nfs/dbraw/zinc/64/75/83/355647583.db2.gz GZPGYAIRESLXGW-GXTWGEPZSA-N 2 0 242.407 2.264 20 0 BEADRP CC(C)CC[C@](C)(O)C[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000583575716 355657406 /nfs/dbraw/zinc/65/74/06/355657406.db2.gz PYKWVNHSQQSGLX-MJBXVCDLSA-N 2 0 242.407 2.033 20 0 BEADRP CCCN1CCC[C@@H]1C[NH2+][C@@H](C)[C@@H]1CCCO1 ZINC000353971151 355676063 /nfs/dbraw/zinc/67/60/63/355676063.db2.gz IJRHYADKCQAJFC-MJBXVCDLSA-N 2 0 240.391 2.018 20 0 BEADRP C[N@@H+]1CC[C@@]2(CC[NH+]([C@@H]3C=CCCC3)C2)C1 ZINC000335887762 355679578 /nfs/dbraw/zinc/67/95/78/355679578.db2.gz CFBLXFVFIGLAGK-ZIAGYGMSSA-N 2 0 220.360 2.123 20 0 BEADRP CCC[C@H](C[NH2+]C[C@@H]1CCCC[N@H+](C)C1)OC ZINC000639347805 355795121 /nfs/dbraw/zinc/79/51/21/355795121.db2.gz QYOUJVSKGRARKJ-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP Cc1cccc(CN[C@@H]2CC[C@H](C)[NH2+]C2)c1 ZINC000398967896 355806842 /nfs/dbraw/zinc/80/68/42/355806842.db2.gz SNFRJFZMPVVKPN-GXTWGEPZSA-N 2 0 218.344 2.225 20 0 BEADRP CC[C@@]1(C)CC[N@H+](CC[C@H]2CC[NH2+]C2)C1 ZINC000399376571 355867656 /nfs/dbraw/zinc/86/76/56/355867656.db2.gz OBCPRJFPTMFAMU-OLZOCXBDSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@H](F)CC[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000351860768 356098346 /nfs/dbraw/zinc/09/83/46/356098346.db2.gz YSHYGIKCMUCLLZ-LBPRGKRZSA-N 2 0 230.371 2.398 20 0 BEADRP Cc1ccc(CC[N@H+]2CC[C@H]([C@@H](C)[NH3+])C2)cc1 ZINC000351861979 356098859 /nfs/dbraw/zinc/09/88/59/356098859.db2.gz MRYFCJPGDDJQNY-HIFRSBDPSA-N 2 0 232.371 2.207 20 0 BEADRP FCCCC[N@@H+]1CC[C@H](Oc2ccncc2)C1 ZINC000351889863 356153294 /nfs/dbraw/zinc/15/32/94/356153294.db2.gz LUBMOIFEXFJUHL-ZDUSSCGKSA-N 2 0 238.306 2.284 20 0 BEADRP CCc1ccccc1C[NH2+][C@](C)(C[NH3+])C1CC1 ZINC000420295435 192203678 /nfs/dbraw/zinc/20/36/78/192203678.db2.gz VNTXGGYXKOUUBU-OAHLLOKOSA-N 2 0 232.371 2.466 20 0 BEADRP Cc1cccnc1[C@H]([NH2+]CCC[NH3+])C(C)C ZINC000420319575 192195298 /nfs/dbraw/zinc/19/52/98/192195298.db2.gz PHPKWSODAVYJMJ-GFCCVEGCSA-N 2 0 221.348 2.026 20 0 BEADRP [NH3+]CC1CC[NH+](CCCCC(F)(F)F)CC1 ZINC000420273951 192197559 /nfs/dbraw/zinc/19/75/59/192197559.db2.gz NZYJZGBTTVUCEZ-UHFFFAOYSA-N 2 0 238.297 2.390 20 0 BEADRP C[C@@H]([NH3+])C1CC[NH+](CC[C@H]2CCCCO2)CC1 ZINC000420281928 192199964 /nfs/dbraw/zinc/19/99/64/192199964.db2.gz ATUNEAKVPDPYFF-TZMCWYRMSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@@H]([NH2+]C[C@@]1(C)CCCS1)[C@H]1CCC[NH2+]1 ZINC000422876525 192495662 /nfs/dbraw/zinc/49/56/62/192495662.db2.gz QGUVFBCZRQGKST-IJLUTSLNSA-N 2 0 228.405 2.002 20 0 BEADRP C[C@H]([NH3+])[C@H]1CCC[N@H+](CC[C@@H]2CCCCO2)C1 ZINC000420281777 192200097 /nfs/dbraw/zinc/20/00/97/192200097.db2.gz AJWSCCZZTMMPFP-IHRRRGAJSA-N 2 0 240.391 2.005 20 0 BEADRP [NH3+]CC[C@@H]1CCC[N@H+](CC[C@@H]2CCCCO2)C1 ZINC000420321213 192200345 /nfs/dbraw/zinc/20/03/45/192200345.db2.gz ZSZYPPZYGPUWIU-KBPBESRZSA-N 2 0 240.391 2.006 20 0 BEADRP CC[NH+](CC)CCCN(C)CC[C@@H]([NH3+])C(C)C ZINC000420291311 192203236 /nfs/dbraw/zinc/20/32/36/192203236.db2.gz NEWSERODBGBAFG-CQSZACIVSA-N 2 0 243.439 2.024 20 0 BEADRP C[C@@H]1C[C@H](C[NH3+])C[N@@H+]1CCCc1ccsc1 ZINC000420316218 192213466 /nfs/dbraw/zinc/21/34/66/192213466.db2.gz LTTGZTURKISMBO-DGCLKSJQSA-N 2 0 238.400 2.350 20 0 BEADRP C[N@H+](CC[C@@H]1CCCCO1)[C@@H]1CCC[NH2+]CC1 ZINC000420318412 192214046 /nfs/dbraw/zinc/21/40/46/192214046.db2.gz WBEQBIYRLQOHTG-KGLIPLIRSA-N 2 0 240.391 2.020 20 0 BEADRP Cc1cccc(C)c1OCC[N@@H+](C)C1CC([NH3+])C1 ZINC000420331964 192215213 /nfs/dbraw/zinc/21/52/13/192215213.db2.gz MZEMVHPLOWRRFR-UHFFFAOYSA-N 2 0 248.370 2.104 20 0 BEADRP [NH3+]CC[C@H]1CCCC[N@@H+]1CC[C@H]1CCCCO1 ZINC000420307715 192208717 /nfs/dbraw/zinc/20/87/17/192208717.db2.gz CDTUGCHEWSGGHJ-ZIAGYGMSSA-N 2 0 240.391 2.149 20 0 BEADRP [NH3+]CC[C@H]1CCC[N@H+](Cc2ncc(C3CC3)o2)C1 ZINC000420312079 192210158 /nfs/dbraw/zinc/21/01/58/192210158.db2.gz OFMABVDNSYPIBH-LLVKDONJSA-N 2 0 249.358 2.113 20 0 BEADRP C[C@H]([NH3+])[C@H]1CC[N@H+](CCCCC(F)(F)F)C1 ZINC000420312231 192210822 /nfs/dbraw/zinc/21/08/22/192210822.db2.gz RYRRBPFRLOPQTK-UWVGGRQHSA-N 2 0 238.297 2.388 20 0 BEADRP CC(C)[N@H+](CC[C@H]1CC[NH2+]C1)C1CCC1 ZINC000420310441 192210887 /nfs/dbraw/zinc/21/08/87/192210887.db2.gz UYYYLTWSVSWCMS-GFCCVEGCSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H]([NH3+])[C@H]1CC[N@H+](CCCCC(F)(F)F)C1 ZINC000420312233 192211071 /nfs/dbraw/zinc/21/10/71/192211071.db2.gz RYRRBPFRLOPQTK-ZJUUUORDSA-N 2 0 238.297 2.388 20 0 BEADRP COc1ccc([C@@H](C[NH3+])C[N@@H+]2CC[C@@H](C)C2)cc1 ZINC000420317667 192212724 /nfs/dbraw/zinc/21/27/24/192212724.db2.gz NPZDNQOBOLFFPA-OCCSQVGLSA-N 2 0 248.370 2.079 20 0 BEADRP C[C@H]1C[C@@H](C[NH3+])C[N@@H+]1CCCCC(F)(F)F ZINC000420326094 192230347 /nfs/dbraw/zinc/23/03/47/192230347.db2.gz XAWZREKVUNHOHL-UWVGGRQHSA-N 2 0 238.297 2.388 20 0 BEADRP C[C@H]1C[C@H](C[NH3+])C[N@@H+]1CCCCC(F)(F)F ZINC000420326097 192230659 /nfs/dbraw/zinc/23/06/59/192230659.db2.gz XAWZREKVUNHOHL-VHSXEESVSA-N 2 0 238.297 2.388 20 0 BEADRP CC[C@@H]1Cc2ccccc2C[N@@H+]1CCC[NH2+]C ZINC000420365636 192224671 /nfs/dbraw/zinc/22/46/71/192224671.db2.gz SKCYICOJCIDCAW-OAHLLOKOSA-N 2 0 232.371 2.433 20 0 BEADRP CC[C@H]([NH2+]CCC[NH2+]C)c1ccc(OC)cc1 ZINC000420367098 192225595 /nfs/dbraw/zinc/22/55/95/192225595.db2.gz GQNNEHDMFWSHCV-AWEZNQCLSA-N 2 0 236.359 2.345 20 0 BEADRP [NH3+]C[C@@H]1C[N@H+](CCCC2CCCC2)CCCO1 ZINC000420389674 192234635 /nfs/dbraw/zinc/23/46/35/192234635.db2.gz MHYGGKPXEDYSOQ-CQSZACIVSA-N 2 0 240.391 2.006 20 0 BEADRP CC[C@H](C)N1C[C@@H](c2ccccc2F)[C@H]([NH3+])C1 ZINC000420392619 192236318 /nfs/dbraw/zinc/23/63/18/192236318.db2.gz WDESQPRNOYGZEE-VHRBIJSZSA-N 2 0 236.334 2.351 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CC[NH2+]C1)C1CCCC1 ZINC000420403221 192237962 /nfs/dbraw/zinc/23/79/62/192237962.db2.gz KWFUYMZWVAFYMO-NWDGAFQWSA-N 2 0 210.365 2.154 20 0 BEADRP CC[C@@H](C)[C@@H](C)[NH2+]CCC1CC[NH2+]CC1 ZINC000420410187 192238833 /nfs/dbraw/zinc/23/88/33/192238833.db2.gz REQWTDFMHSUSHO-VXGBXAGGSA-N 2 0 212.381 2.400 20 0 BEADRP [NH3+]CCC[NH2+][C@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000420410972 192239820 /nfs/dbraw/zinc/23/98/20/192239820.db2.gz RNOONDRPFTYVAV-DZGCQCFKSA-N 2 0 248.370 2.093 20 0 BEADRP C[C@H]1Cc2ccccc2C[N@@H+]1CCn1ccnc1 ZINC000179463334 366260476 /nfs/dbraw/zinc/26/04/76/366260476.db2.gz KIOHBOCDAOSVJF-ZDUSSCGKSA-N 2 0 241.338 2.330 20 0 BEADRP c1cc(N2CCC[N@@H+](CC3CCC3)CC2)cc[nH+]1 ZINC000639681972 356592279 /nfs/dbraw/zinc/59/22/79/356592279.db2.gz CGOJUKKQXWQPTN-UHFFFAOYSA-N 2 0 245.370 2.394 20 0 BEADRP c1cc(N2CCC[N@@H+](CC3CC3)CC2)cc[nH+]1 ZINC000639681962 356592574 /nfs/dbraw/zinc/59/25/74/356592574.db2.gz BNHKZISLGBUPII-UHFFFAOYSA-N 2 0 231.343 2.004 20 0 BEADRP CCC(CC)[C@H](CC[NH2+][C@H]1CCC[C@@H]1[NH3+])OC ZINC000422991533 192520771 /nfs/dbraw/zinc/52/07/71/192520771.db2.gz BLWFJPORXGOSSB-IHRRRGAJSA-N 2 0 242.407 2.297 20 0 BEADRP CC1(C)C[C@H]1C[NH2+]C1CCC(C[NH3+])CC1 ZINC000422954832 192525855 /nfs/dbraw/zinc/52/58/55/192525855.db2.gz JXYTUEZULXPDPN-CXQJBGSLSA-N 2 0 210.365 2.140 20 0 BEADRP [NH3+][C@H]1CCCCC[C@H]1[NH2+]CCc1ccco1 ZINC000422963174 192526284 /nfs/dbraw/zinc/52/62/84/192526284.db2.gz HVTIJOBBONAOAE-QWHCGFSZSA-N 2 0 222.332 2.072 20 0 BEADRP C[C@H]1C[C@H]1C[N@@H+]1CCCN(c2cc[nH+]cc2)CC1 ZINC000639685930 356601644 /nfs/dbraw/zinc/60/16/44/356601644.db2.gz ZEQBKHTXIBPSGD-KBPBESRZSA-N 2 0 245.370 2.250 20 0 BEADRP [NH3+]CC1CCC([NH2+]CCCC(F)(F)F)CC1 ZINC000422968701 192530730 /nfs/dbraw/zinc/53/07/30/192530730.db2.gz RYCPXFRFYVKUOD-UHFFFAOYSA-N 2 0 238.297 2.436 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CCc1ccccc1O ZINC000422970666 192531877 /nfs/dbraw/zinc/53/18/77/192531877.db2.gz GTKXTYVCOSOEFJ-GFCCVEGCSA-N 2 0 236.359 2.042 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H](C)Cc1ccc(O)cc1 ZINC000422972607 192532644 /nfs/dbraw/zinc/53/26/44/192532644.db2.gz MITLZOUAVIKNQT-NEPJUHHUSA-N 2 0 236.359 2.040 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H](C)Cc1ccc(O)cc1 ZINC000422972612 192532752 /nfs/dbraw/zinc/53/27/52/192532752.db2.gz MITLZOUAVIKNQT-VXGBXAGGSA-N 2 0 236.359 2.040 20 0 BEADRP Cc1ccc(CC[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000422982781 192517587 /nfs/dbraw/zinc/51/75/87/192517587.db2.gz RHUWQFMWBQQYDA-XYPWUTKMSA-N 2 0 244.382 2.410 20 0 BEADRP CC(C)(CO)CCC[NH2+][C@H]1CCCCC[C@H]1[NH3+] ZINC000423006412 192535220 /nfs/dbraw/zinc/53/52/20/192535220.db2.gz OPINTHXFXASKAY-OLZOCXBDSA-N 2 0 242.407 2.035 20 0 BEADRP CC(C)CSCCC[NH2+][C@@H](C)[C@@H]1CCC[NH2+]1 ZINC000423009819 192537545 /nfs/dbraw/zinc/53/75/45/192537545.db2.gz DZQOTFQJIBAXRQ-STQMWFEESA-N 2 0 244.448 2.496 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+][C@@H](C)CCCC[NH3+] ZINC000423007919 192537680 /nfs/dbraw/zinc/53/76/80/192537680.db2.gz RVFNHAGFHTWVBN-NWDGAFQWSA-N 2 0 224.348 2.318 20 0 BEADRP Cc1cnccc1CC[NH2+][C@H]1CCCC[C@@H]1C[NH3+] ZINC000423014107 192539821 /nfs/dbraw/zinc/53/98/21/192539821.db2.gz OHNPXPQKGPCWDU-CABCVRRESA-N 2 0 247.386 2.040 20 0 BEADRP CCc1ccc2[nH+]ccc(NCC[NH+](C)C)c2c1 ZINC000450207731 202095971 /nfs/dbraw/zinc/09/59/71/202095971.db2.gz HEQBKLPIVBVSAQ-UHFFFAOYSA-N 2 0 243.354 2.193 20 0 BEADRP CCc1cc(N2CC[NH+](CC(C)C)CC2)cc[nH+]1 ZINC000450217064 202098817 /nfs/dbraw/zinc/09/88/17/202098817.db2.gz SEFPAZJZYDXVHX-UHFFFAOYSA-N 2 0 247.386 2.422 20 0 BEADRP CS[C@@H](C[NH2+][C@@H](C)CCC[NH3+])C(C)(C)C ZINC000423038684 192548633 /nfs/dbraw/zinc/54/86/33/192548633.db2.gz YZHHXXKWHIBYRK-QWRGUYRKSA-N 2 0 232.437 2.481 20 0 BEADRP C[C@H]([NH2+]CCC[C@H]1CCCCO1)[C@@H]1CCC[NH2+]1 ZINC000423041673 192549707 /nfs/dbraw/zinc/54/97/07/192549707.db2.gz XQHTYDSSVUKAPC-MJBXVCDLSA-N 2 0 240.391 2.066 20 0 BEADRP CCC(CC)C[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000044535273 538466472 /nfs/dbraw/zinc/46/64/72/538466472.db2.gz DWGVKRYHPCDLEX-CYBMUJFWSA-N 2 0 212.381 2.354 20 0 BEADRP CC(C)(C)CC[C@@H](CO)[NH2+]C1CCC([NH3+])CC1 ZINC000423094067 192566222 /nfs/dbraw/zinc/56/62/22/192566222.db2.gz JEYFJEBQHRNYQU-BPCQOVAHSA-N 2 0 242.407 2.033 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+]CCC1(F)CCC1 ZINC000423103006 192568873 /nfs/dbraw/zinc/56/88/73/192568873.db2.gz FWRRGSRNMJPVPV-NWDGAFQWSA-N 2 0 228.355 2.246 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C[C@@H]2CCC[N@H+](C)C2)C1 ZINC000070643709 325020136 /nfs/dbraw/zinc/02/01/36/325020136.db2.gz DSABJECGWJNNGA-FRRDWIJNSA-N 2 0 210.365 2.106 20 0 BEADRP C([NH2+]CC1CCCCCC1)[C@H]1CCC[NH2+]1 ZINC000389491877 356692808 /nfs/dbraw/zinc/69/28/08/356692808.db2.gz SOVNKPINPKOWBH-CYBMUJFWSA-N 2 0 210.365 2.298 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]C[C@H]1CCCC1(F)F ZINC000423146647 192588156 /nfs/dbraw/zinc/58/81/56/192588156.db2.gz BAGKFZYVMDYAIM-LPEHRKFASA-N 2 0 220.307 2.137 20 0 BEADRP C(C[NH+]1CCCC1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000086573156 538557785 /nfs/dbraw/zinc/55/77/85/538557785.db2.gz JDZJGIRQXQUZSH-YHWZYXNKSA-N 2 0 208.349 2.003 20 0 BEADRP C[NH+](C)C[C@@H]1CC[N@H+](CC2=CCCCC2)C1 ZINC000450410541 202158977 /nfs/dbraw/zinc/15/89/77/202158977.db2.gz ZELLQCUZULJREI-AWEZNQCLSA-N 2 0 222.376 2.370 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1)C1CC1 ZINC000623341410 356741925 /nfs/dbraw/zinc/74/19/25/356741925.db2.gz AVRJWNSLIMUOCG-CMPLNLGQSA-N 2 0 210.365 2.247 20 0 BEADRP C[N@H+](CC1CC(F)(F)C1)C[C@H]1CCC[NH+](C)C1 ZINC000450430638 202166326 /nfs/dbraw/zinc/16/63/26/202166326.db2.gz UAVKROHUMJEIFT-NSHDSACASA-N 2 0 246.345 2.305 20 0 BEADRP C[C@H]1C[C@H]([NH+]2CC(C)(C)OC(C)(C)C2)CC[NH2+]1 ZINC000226427742 538611029 /nfs/dbraw/zinc/61/10/29/538611029.db2.gz BHQXZLPBSKAQPN-NWDGAFQWSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@@H]1C[C@H]1C[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623357486 356795094 /nfs/dbraw/zinc/79/50/94/356795094.db2.gz RIPIJAAQJCFTGN-WOPDTQHZSA-N 2 0 210.365 2.105 20 0 BEADRP CCc1cc(N2CC[N@H+](C)[C@H](C(C)C)C2)cc[nH+]1 ZINC000450479461 202179397 /nfs/dbraw/zinc/17/93/97/202179397.db2.gz OIKIJCXSPODXET-HNNXBMFYSA-N 2 0 247.386 2.420 20 0 BEADRP CCc1cc(N2CC[N@@H+](CC)C[C@@H]2C)cc[nH+]1 ZINC000450533122 202190619 /nfs/dbraw/zinc/19/06/19/202190619.db2.gz ZJFGJVNVPKPYEB-LBPRGKRZSA-N 2 0 233.359 2.174 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1)C1CC1 ZINC000623375495 356894877 /nfs/dbraw/zinc/89/48/77/356894877.db2.gz PZFTWUNHJZWXSK-YPMHNXCESA-N 2 0 224.392 2.495 20 0 BEADRP COc1ccc2c(c1)C(C)(C)C[C@@H]2[NH2+]CCC[NH3+] ZINC000423197242 192622699 /nfs/dbraw/zinc/62/26/99/192622699.db2.gz YOPHZYZWASBSCJ-AWEZNQCLSA-N 2 0 248.370 2.356 20 0 BEADRP COc1ccsc1[C@H](C)[NH2+]CC[C@H](C)[NH3+] ZINC000423226728 192637857 /nfs/dbraw/zinc/63/78/57/192637857.db2.gz RZFBXRDKEOBIRK-IUCAKERBSA-N 2 0 228.361 2.145 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+]CC1CCCCCC1 ZINC000389656908 357011586 /nfs/dbraw/zinc/01/15/86/357011586.db2.gz SFBKEUMRNBARFU-CQSZACIVSA-N 2 0 242.407 2.300 20 0 BEADRP C[C@H]1CCN(CC[NH2+][C@@H]2CCCC2(C)C)C1 ZINC000390653473 357109294 /nfs/dbraw/zinc/10/92/94/357109294.db2.gz PYQHRUVJOAUKKR-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP Fc1ccc2c(c1)[C@H]([NH2+]CC[C@H]1CC[NH2+]C1)CC2 ZINC000423241148 192648016 /nfs/dbraw/zinc/64/80/16/192648016.db2.gz DEUKGHDMGRYJJC-IAQYHMDHSA-N 2 0 248.345 2.402 20 0 BEADRP CCC[C@@H](C)C[NH2+]CCN1CC[C@@H](C)C1 ZINC000389904830 357065092 /nfs/dbraw/zinc/06/50/92/357065092.db2.gz GFIMNPBGDKSXFU-CHWSQXEVSA-N 2 0 212.381 2.354 20 0 BEADRP CC(C)[C@@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1cccnc1 ZINC000423243884 192648621 /nfs/dbraw/zinc/64/86/21/192648621.db2.gz GSQYGRZCUIMTFZ-DZGCQCFKSA-N 2 0 247.386 2.368 20 0 BEADRP C[NH+](C)[C@H]1CCC[C@@H]([NH2+]CC2(C)CC2)C1 ZINC000389984729 357079392 /nfs/dbraw/zinc/07/93/92/357079392.db2.gz LJOGETHPNYEUDO-NEPJUHHUSA-N 2 0 210.365 2.249 20 0 BEADRP CC[C@H]([NH2+]CC[C@@H]1CC[NH2+]C1)[C@H]1C[C@H]1C ZINC000423239974 192645401 /nfs/dbraw/zinc/64/54/01/192645401.db2.gz BYNUYKGTHBYVPU-VOAKCMCISA-N 2 0 210.365 2.010 20 0 BEADRP Cc1cncc([C@@H](C)[NH2+]CC[C@H]2CCC[NH2+]C2)c1 ZINC000423258442 192656477 /nfs/dbraw/zinc/65/64/77/192656477.db2.gz MCQHRUBUCOERDO-ZIAGYGMSSA-N 2 0 247.386 2.430 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+]CCC1=CC[NH2+]CC1 ZINC000583687702 357119644 /nfs/dbraw/zinc/11/96/44/357119644.db2.gz JMYZXYQJGVFSOP-KGLIPLIRSA-N 2 0 222.376 2.465 20 0 BEADRP Cc1cc(CN[C@@H]2CC[N@@H+]3CCCC[C@@H]23)ccn1 ZINC000391169750 357125546 /nfs/dbraw/zinc/12/55/46/357125546.db2.gz FQQXUPXYXKQYBK-CABCVRRESA-N 2 0 245.370 2.106 20 0 BEADRP CCc1cccnc1[C@@H](C)[NH2+]CCCC[NH3+] ZINC000423325171 192667480 /nfs/dbraw/zinc/66/74/80/192667480.db2.gz LEAFNRFXQZMJFY-LLVKDONJSA-N 2 0 221.348 2.034 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]CC1CC(C)(C)C1 ZINC000393802924 357300568 /nfs/dbraw/zinc/30/05/68/357300568.db2.gz UPCRDYUVFNVJHH-DGCLKSJQSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@H]([NH2+]Cc1ccc(C[NH3+])cc1)c1ccncc1 ZINC000582667167 357358507 /nfs/dbraw/zinc/35/85/07/357358507.db2.gz XSDMFBIKEQAWSA-LBPRGKRZSA-N 2 0 241.338 2.391 20 0 BEADRP C[C@H]([NH2+]CCCC1CC1)[C@H]1CCCC[NH2+]1 ZINC000395242883 357429634 /nfs/dbraw/zinc/42/96/34/357429634.db2.gz RCZHWKDCNVBHNX-WCQYABFASA-N 2 0 210.365 2.297 20 0 BEADRP C[NH2+]Cc1cccc(N[C@@H]2CCC[C@H]([NH3+])C2)c1 ZINC000582975871 357450129 /nfs/dbraw/zinc/45/01/29/357450129.db2.gz QYAXSSGBEHKJFW-GXTWGEPZSA-N 2 0 233.359 2.088 20 0 BEADRP CCc1cccnc1[C@@H](C)[NH2+]CC1CC[NH2+]CC1 ZINC000583078382 357473627 /nfs/dbraw/zinc/47/36/27/357473627.db2.gz ZESHNWNFGLDEAC-GFCCVEGCSA-N 2 0 247.386 2.294 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]CCC(F)(F)F ZINC000063099443 357525991 /nfs/dbraw/zinc/52/59/91/357525991.db2.gz SFDKIKCLOXLEAA-UTLUCORTSA-N 2 0 238.297 2.257 20 0 BEADRP COC1CCC([NH2+]CCC[N@H+](C)C(C)C)CC1 ZINC000230383614 357532464 /nfs/dbraw/zinc/53/24/64/357532464.db2.gz AAKPISNTIMOUTF-UHFFFAOYSA-N 2 0 242.407 2.264 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@H]2CCC[C@@H]2C)CC1 ZINC000230657351 357545584 /nfs/dbraw/zinc/54/55/84/357545584.db2.gz LNAYWQQDHULVMG-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]([NH2+]CCC[NH+]1CCCCC1)[C@H]1C[C@H]1C ZINC000321553217 357589224 /nfs/dbraw/zinc/58/92/24/357589224.db2.gz MAKBSYBNIGMPEA-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)CCOCC[N@H+](C)[C@@H]1CCC[NH2+]CC1 ZINC000231668613 357618848 /nfs/dbraw/zinc/61/88/48/357618848.db2.gz GZXFROHUJCLFMK-CQSZACIVSA-N 2 0 242.407 2.123 20 0 BEADRP CCC1(C[NH2+][C@@H](CCC[NH3+])COC)CCCC1 ZINC000232992871 357688449 /nfs/dbraw/zinc/68/84/49/357688449.db2.gz VIRNAIICUAYJIR-ZDUSSCGKSA-N 2 0 242.407 2.300 20 0 BEADRP CC(C)(C)C[NH+]1CCC([NH2+]CC2CC2)CC1 ZINC000168532084 134225812 /nfs/dbraw/zinc/22/58/12/134225812.db2.gz BNAVOSFKZHYWKZ-UHFFFAOYSA-N 2 0 224.392 2.497 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+]CCC1=CCCCC1 ZINC000234781603 357829277 /nfs/dbraw/zinc/82/92/77/357829277.db2.gz CEWAOSAINNVXFR-AWEZNQCLSA-N 2 0 240.391 2.220 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+]CC1CCC(C)CC1 ZINC000234780533 357829338 /nfs/dbraw/zinc/82/93/38/357829338.db2.gz HNCCWBYBCBHFDI-RUXDESIVSA-N 2 0 242.407 2.156 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C[C@H]2CC2(C)C)CC1(C)C ZINC000623417042 357868697 /nfs/dbraw/zinc/86/86/97/357868697.db2.gz QKKMFYJFBRKAKS-NEPJUHHUSA-N 2 0 224.392 2.495 20 0 BEADRP Cc1cccc(OCC[N@H+]2CC[C@H]([NH3+])C[C@H]2C)c1 ZINC000218482379 357925294 /nfs/dbraw/zinc/92/52/94/357925294.db2.gz NECPUYJBHXJNAD-KGLIPLIRSA-N 2 0 248.370 2.185 20 0 BEADRP C[NH+](C)CCCC(C)(C)[NH2+]C[C@H]1CCSC1 ZINC000387301217 357913917 /nfs/dbraw/zinc/91/39/17/357913917.db2.gz JUYWBICAIALFSO-GFCCVEGCSA-N 2 0 244.448 2.450 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]CCC2(F)CCC2)C1 ZINC000583763862 357938664 /nfs/dbraw/zinc/93/86/64/357938664.db2.gz MQLGIPDSUMFQBZ-MNOVXSKESA-N 2 0 214.328 2.128 20 0 BEADRP c1csc(CC[NH2+][C@@H]2CCC[NH2+]CC2)c1 ZINC000168703083 134246413 /nfs/dbraw/zinc/24/64/13/134246413.db2.gz IGRLVJGPKUCEGM-LLVKDONJSA-N 2 0 224.373 2.022 20 0 BEADRP Fc1cccc(C[NH2+][C@@H]2CCC[NH2+]CC2)c1 ZINC000168715024 134246673 /nfs/dbraw/zinc/24/66/73/134246673.db2.gz DNTSNOHAWNHBGY-CYBMUJFWSA-N 2 0 222.307 2.057 20 0 BEADRP CS[C@H](C)C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000169085828 134249747 /nfs/dbraw/zinc/24/97/47/134249747.db2.gz DPCXQIVTHOEXAU-FVCCEPFGSA-N 2 0 242.432 2.248 20 0 BEADRP CC[C@@H](C[NH+]1CCC(CC)([NH+](C)C)CC1)OC ZINC000640015762 358069085 /nfs/dbraw/zinc/06/90/85/358069085.db2.gz MPOLYUXRQXLKJP-ZDUSSCGKSA-N 2 0 242.407 2.218 20 0 BEADRP CCCC[C@H](C[NH3+])N[C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000423303410 192692319 /nfs/dbraw/zinc/69/23/19/192692319.db2.gz XBKDXESYTBRTLL-KCPJHIHWSA-N 2 0 247.386 2.238 20 0 BEADRP COc1cc(C)ccc1[C@@H](C)[NH2+]CCCC[NH3+] ZINC000037715518 358092693 /nfs/dbraw/zinc/09/26/93/358092693.db2.gz VTLRNQFRWVQODH-GFCCVEGCSA-N 2 0 236.359 2.393 20 0 BEADRP CC[NH+](CC)C[C@H]1CC[N@H+](CC(C)C)C1 ZINC000076003687 325325300 /nfs/dbraw/zinc/32/53/00/325325300.db2.gz ZRKWVTOJHJSJDV-CYBMUJFWSA-N 2 0 212.381 2.306 20 0 BEADRP CCCOc1ccc(C[NH2+]CCCC[NH3+])cc1 ZINC000037715157 358092912 /nfs/dbraw/zinc/09/29/12/358092912.db2.gz RSBJZZMMHFLVJE-UHFFFAOYSA-N 2 0 236.359 2.304 20 0 BEADRP C[N@@H+]1CCC[C@@H]1CC[NH+]1CCC(C)(F)CC1 ZINC000640071274 358154596 /nfs/dbraw/zinc/15/45/96/358154596.db2.gz HNOVTVLYOYJMPR-GFCCVEGCSA-N 2 0 228.355 2.295 20 0 BEADRP CCC(C)(C)[C@H](C)[NH2+]C[C@H]([NH3+])C(C)C ZINC000584774432 358175061 /nfs/dbraw/zinc/17/50/61/358175061.db2.gz TZVHXZQROKIMCY-QWRGUYRKSA-N 2 0 200.370 2.384 20 0 BEADRP COCC(C)(C)CCC[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000584848883 358208493 /nfs/dbraw/zinc/20/84/93/358208493.db2.gz ATNLSMRELIWWCA-STQMWFEESA-N 2 0 242.407 2.299 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCC[C@@H]([NH3+])C1)c1cccc(O)c1 ZINC000222958894 358216161 /nfs/dbraw/zinc/21/61/61/358216161.db2.gz BMXILSSBTGFDMS-RAIGVLPGSA-N 2 0 234.343 2.313 20 0 BEADRP CCc1ccc(C[NH2+]C[C@@H](C)C[NH2+]C)s1 ZINC000225373559 358240688 /nfs/dbraw/zinc/24/06/88/358240688.db2.gz SFJPZKHVMMAGCS-JTQLQIEISA-N 2 0 226.389 2.256 20 0 BEADRP C[C@H]1CSCC[N@@H+]1Cc1cccc2nccn21 ZINC000180246416 366402958 /nfs/dbraw/zinc/40/29/58/366402958.db2.gz IROUBNGMUNGJPM-NSHDSACASA-N 2 0 247.367 2.272 20 0 BEADRP C[C@@H]1CSCC[N@@H+]1Cc1cccc2nccn21 ZINC000180246397 366403144 /nfs/dbraw/zinc/40/31/44/366403144.db2.gz IROUBNGMUNGJPM-LLVKDONJSA-N 2 0 247.367 2.272 20 0 BEADRP C[C@@]1(C[N@@H+]2CC[C@@H]3CCCC[C@@H]32)CC[NH2+]C1 ZINC000226595327 358340692 /nfs/dbraw/zinc/34/06/92/358340692.db2.gz XUIRUNFHFATIGK-MELADBBJSA-N 2 0 222.376 2.251 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@@H]([NH3+])C[C@H]2C)cc1 ZINC000226873716 358346665 /nfs/dbraw/zinc/34/66/65/358346665.db2.gz MMYZMMWCQQINKD-TZMCWYRMSA-N 2 0 218.344 2.307 20 0 BEADRP CC[N@H+](C)C[C@H]1CC[NH+]([C@H]2C=CCCC2)C1 ZINC000173902838 134278258 /nfs/dbraw/zinc/27/82/58/134278258.db2.gz YVCXIVFZSRNSGZ-KGLIPLIRSA-N 2 0 222.376 2.369 20 0 BEADRP CC[N@H+](C)C[C@@H]1CC[NH+](CC2CCC2)C1 ZINC000173887041 134278445 /nfs/dbraw/zinc/27/84/45/134278445.db2.gz SKOCIVBENXPSCT-ZDUSSCGKSA-N 2 0 210.365 2.060 20 0 BEADRP CC[NH+]1CCC(C[NH2+]C(C2CC2)C2CC2)CC1 ZINC000044517509 358388677 /nfs/dbraw/zinc/38/86/77/358388677.db2.gz IGBXQSWTGXZARZ-UHFFFAOYSA-N 2 0 236.403 2.497 20 0 BEADRP C1CC1C([NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)C1CC1 ZINC000130153320 358610710 /nfs/dbraw/zinc/61/07/10/358610710.db2.gz WPRNTUTZTOAJER-KBPBESRZSA-N 2 0 234.387 2.391 20 0 BEADRP CC[C@H]1CCC[C@@H]1[NH2+]CCN1CCCC1 ZINC000132178365 491134602 /nfs/dbraw/zinc/13/46/02/491134602.db2.gz PIFKAOWPQAVEJR-STQMWFEESA-N 2 0 210.365 2.251 20 0 BEADRP Cc1ccccc1C[NH2+][C@H](C)CC[NH+](C)C ZINC000049551770 358694029 /nfs/dbraw/zinc/69/40/29/358694029.db2.gz YYRLLDOMYLFMHK-CYBMUJFWSA-N 2 0 220.360 2.425 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CCCC(F)(F)F)CC[N@@H+]1C ZINC000132334865 358718627 /nfs/dbraw/zinc/71/86/27/358718627.db2.gz KESZLUBLUSPBQK-UWVGGRQHSA-N 2 0 238.297 2.401 20 0 BEADRP C[NH+](C)CC1CC[NH+](Cc2cccc(O)c2)CC1 ZINC000132799703 358736116 /nfs/dbraw/zinc/73/61/16/358736116.db2.gz NUKGUBYVBQSYQI-UHFFFAOYSA-N 2 0 248.370 2.166 20 0 BEADRP C[NH2+][C@H]1CCCN(CCCOc2ccccc2)C1 ZINC000053203622 358817937 /nfs/dbraw/zinc/81/79/37/358817937.db2.gz JXYHRZQSUZYSQQ-AWEZNQCLSA-N 2 0 248.370 2.139 20 0 BEADRP C[C@H]([NH2+]Cc1ccoc1)C1CC[NH+](C)CC1 ZINC000132532452 491136562 /nfs/dbraw/zinc/13/65/62/491136562.db2.gz PRRVCSGUFLDFEH-NSHDSACASA-N 2 0 222.332 2.100 20 0 BEADRP C[C@@H]1CCC[N@@H+]1C1CC[NH+](CC2CC2)CC1 ZINC000134684917 358801191 /nfs/dbraw/zinc/80/11/91/358801191.db2.gz JVRWROJPYZEGMW-GFCCVEGCSA-N 2 0 222.376 2.345 20 0 BEADRP C[NH+](C)CCC[NH2+]C[C@@H]1CCOc2ccccc21 ZINC000135424941 358837805 /nfs/dbraw/zinc/83/78/05/358837805.db2.gz IEDRROSYTUTWGO-ZDUSSCGKSA-N 2 0 248.370 2.094 20 0 BEADRP C[NH+](C)CCC[NH2+]C[C@H]1C[C@@H]1c1ccccc1 ZINC000135610498 358846543 /nfs/dbraw/zinc/84/65/43/358846543.db2.gz YWGGPAKHNDNXQC-HUUCEWRRSA-N 2 0 232.371 2.331 20 0 BEADRP CCC[NH+]1CCC([NH2+]C[C@H]2C[C@H]2C)CC1 ZINC000132740198 491138133 /nfs/dbraw/zinc/13/81/33/491138133.db2.gz DEYKNBJYLDNMLT-VXGBXAGGSA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)C[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000056521723 358899122 /nfs/dbraw/zinc/89/91/22/358899122.db2.gz VYJPXMWZYZTCLH-UHFFFAOYSA-N 2 0 212.381 2.306 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCC[NH+]2CCCCC2)CCO1 ZINC000070346224 359050772 /nfs/dbraw/zinc/05/07/72/359050772.db2.gz RKKZOFOCILNMLA-ZIAGYGMSSA-N 2 0 240.391 2.020 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CCC[NH+]2CCCCC2)CCO1 ZINC000070346227 359050544 /nfs/dbraw/zinc/05/05/44/359050544.db2.gz RKKZOFOCILNMLA-KBPBESRZSA-N 2 0 240.391 2.020 20 0 BEADRP CC(C)C[C@@H]1CCC[C@@H]([NH2+]CC2C[NH2+]C2)C1 ZINC000423313895 192701089 /nfs/dbraw/zinc/70/10/89/192701089.db2.gz GHLACLWUPNUTDW-GXTWGEPZSA-N 2 0 224.392 2.400 20 0 BEADRP CC[C@H]1CC[C@H]1[NH2+]CC1(C)CC[NH2+]CC1 ZINC000423332987 192713475 /nfs/dbraw/zinc/71/34/75/192713475.db2.gz PPDCIGLCKQHHPU-NWDGAFQWSA-N 2 0 210.365 2.154 20 0 BEADRP CCCCO[C@H]1C[C@H]([NH2+]CCCC[NH3+])C1(C)C ZINC000423322884 192707143 /nfs/dbraw/zinc/70/71/43/192707143.db2.gz JANFVDVZVUAYFI-STQMWFEESA-N 2 0 242.407 2.299 20 0 BEADRP CC[C@@H](C)C[N@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000246464457 359106489 /nfs/dbraw/zinc/10/64/89/359106489.db2.gz ZGLSWMYAQQSKGY-OLZOCXBDSA-N 2 0 212.381 2.306 20 0 BEADRP C[C@H]([NH2+]CC1CC[NH+](C)CC1)c1nccs1 ZINC000070717654 359062765 /nfs/dbraw/zinc/06/27/65/359062765.db2.gz SRTBMXCABBLMPE-JTQLQIEISA-N 2 0 239.388 2.136 20 0 BEADRP CO[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1)C(C)(C)C ZINC000247136579 359196887 /nfs/dbraw/zinc/19/68/87/359196887.db2.gz QPQOCXBSLAJZDJ-JHJVBQTASA-N 2 0 242.407 2.120 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+]CC1(C)CC[NH2+]CC1 ZINC000423344777 192720388 /nfs/dbraw/zinc/72/03/88/192720388.db2.gz XZEGEUKGRXZGMC-GFCCVEGCSA-N 2 0 236.359 2.190 20 0 BEADRP COCCC[C@H](C)[NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000246978379 359180219 /nfs/dbraw/zinc/18/02/19/359180219.db2.gz ISPSKAKNKBEYHR-BFHYXJOUSA-N 2 0 242.407 2.264 20 0 BEADRP [NH3+]CCCC[NH2+][C@@H]1CCCOc2ccccc21 ZINC000423326448 192741271 /nfs/dbraw/zinc/74/12/71/192741271.db2.gz MGRRWKIKLDXOPE-CYBMUJFWSA-N 2 0 234.343 2.229 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@@H]([NH2+]CC2=CC[NH2+]CC2)C1 ZINC000423362765 192731616 /nfs/dbraw/zinc/73/16/16/192731616.db2.gz YBZIMOKBFDDNQM-DYEKYZERSA-N 2 0 222.376 2.320 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@H]2CC[C@@H]2C2CCC2)C1 ZINC000423360602 192731991 /nfs/dbraw/zinc/73/19/91/192731991.db2.gz FWOKTAAENASYJF-RQJABVFESA-N 2 0 222.376 2.425 20 0 BEADRP CC[C@@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)C1CC1 ZINC000423424738 192750604 /nfs/dbraw/zinc/75/06/04/192750604.db2.gz CSXPHOPTSXYWID-BFHYXJOUSA-N 2 0 222.376 2.153 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+][C@H](C)CCC[NH3+] ZINC000423459192 192778744 /nfs/dbraw/zinc/77/87/44/192778744.db2.gz QXKNVJJLZOHJKX-NEPJUHHUSA-N 2 0 221.348 2.168 20 0 BEADRP C[C@H](C[NH2+]CC1(C)CCC1)N(C)C1CC1 ZINC000308917820 491140182 /nfs/dbraw/zinc/14/01/82/491140182.db2.gz OCVSSPSJIFHDEI-LLVKDONJSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@H](C[NH3+])C1)c1ccccc1 ZINC000423492121 192793461 /nfs/dbraw/zinc/79/34/61/192793461.db2.gz LVGSUIXIWBTEQZ-SGMGOOAPSA-N 2 0 218.344 2.465 20 0 BEADRP C(C[NH2+][C@H]1CC[C@@H]1C1CC1)C[C@@H]1CCC[NH2+]1 ZINC000423490421 192792364 /nfs/dbraw/zinc/79/23/64/192792364.db2.gz XTQSGQOQEAVZBT-MJBXVCDLSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000423511079 192799824 /nfs/dbraw/zinc/79/98/24/192799824.db2.gz NCNIFGPHGFSHEB-ZFWWWQNUSA-N 3 0 249.402 2.184 20 0 BEADRP [NH3+]C[C@]12CCC[C@H]1C[N@H+](Cc1ccccc1)C2 ZINC000306287049 359520589 /nfs/dbraw/zinc/52/05/89/359520589.db2.gz ZCCZVFYYURWFIW-GJZGRUSLSA-N 2 0 230.355 2.247 20 0 BEADRP CC1(C)CC[C@@H]([NH2+]CCC2=CC[NH2+]CC2)C1 ZINC000423535351 192806577 /nfs/dbraw/zinc/80/65/77/192806577.db2.gz CRXVFPPADSMXKG-CYBMUJFWSA-N 2 0 222.376 2.465 20 0 BEADRP COCC1(C[NH2+][C@H]2CCC[C@H]([NH3+])C2)CCCC1 ZINC000580451115 359558607 /nfs/dbraw/zinc/55/86/07/359558607.db2.gz YSFAMHVRGQZDLP-STQMWFEESA-N 2 0 240.391 2.053 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+]CCCC[NH+](C)C ZINC000308997546 491142101 /nfs/dbraw/zinc/14/21/01/491142101.db2.gz MYZDZIOBEDCPER-QWHCGFSZSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1)C1CC1 ZINC000132913220 491142128 /nfs/dbraw/zinc/14/21/28/491142128.db2.gz PDOAAVCEEHRMJR-WZRBSPASSA-N 2 0 210.365 2.105 20 0 BEADRP CC[C@H](O)C[NH2+]CCCCC[NH+]1CCCCC1 ZINC000578641078 366616753 /nfs/dbraw/zinc/61/67/53/366616753.db2.gz JSIDMVVGGDSLME-AWEZNQCLSA-N 2 0 242.407 2.003 20 0 BEADRP c1ccc([C@H]2CCC[N@H+]2CC2CC[NH2+]CC2)nc1 ZINC000578596883 366604360 /nfs/dbraw/zinc/60/43/60/366604360.db2.gz TVUKTCMNIYMRTM-OAHLLOKOSA-N 2 0 245.370 2.218 20 0 BEADRP CC[C@H](c1ccccc1)[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC000088249781 359942270 /nfs/dbraw/zinc/94/22/70/359942270.db2.gz BCXCOULHNIDEGW-QLFBSQMISA-N 2 0 230.355 2.289 20 0 BEADRP C[C@H]([NH3+])[C@@H]1COCC[C@H]1[NH2+]CCCC(C)(C)C ZINC000578878479 366664792 /nfs/dbraw/zinc/66/47/92/366664792.db2.gz UWRFQHHHEZIXIY-RWMBFGLXSA-N 2 0 242.407 2.155 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+]Cc1cccc(F)c1 ZINC000089140764 359992522 /nfs/dbraw/zinc/99/25/22/359992522.db2.gz FNRDMDRZUAGEAC-TZMCWYRMSA-N 2 0 236.334 2.433 20 0 BEADRP CC(C)CCOCC[NH2+][C@H]1CCCC[C@@H]1C[NH3+] ZINC000089145910 359993014 /nfs/dbraw/zinc/99/30/14/359993014.db2.gz RUVDUBCSPLZJKU-KGLIPLIRSA-N 2 0 242.407 2.156 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+]CCc1ccc(O)cc1 ZINC000089145567 359993191 /nfs/dbraw/zinc/99/31/91/359993191.db2.gz YJNWSRBUINMXBC-UKRRQHHQSA-N 2 0 248.370 2.042 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@H]1CC[C@@H]1C1CC1 ZINC000309323170 491146862 /nfs/dbraw/zinc/14/68/62/491146862.db2.gz FQTSLOLDAYQWLA-KGLIPLIRSA-N 2 0 224.392 2.495 20 0 BEADRP c1ccc([C@H]2CC[N@@H+](CC[C@@H]3CC[NH2+]C3)C2)cc1 ZINC000089749383 360037273 /nfs/dbraw/zinc/03/72/73/360037273.db2.gz WEHQXUMYSGVZNU-HOCLYGCPSA-N 2 0 244.382 2.476 20 0 BEADRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]Cc1cc(F)ccc1F ZINC000089150685 359994177 /nfs/dbraw/zinc/99/41/77/359994177.db2.gz BXNGBPTVFGXTGZ-NOZJJQNGSA-N 2 0 240.297 2.182 20 0 BEADRP COCc1ccccc1C[NH2+][C@@H]1CCC[C@@H]1C[NH3+] ZINC000089149876 359994408 /nfs/dbraw/zinc/99/44/08/359994408.db2.gz ZCGAEWAIUHBVFQ-IUODEOHRSA-N 2 0 248.370 2.050 20 0 BEADRP Cn1ccnc1C[C@@H]1CCC[N@H+](CCCF)C1 ZINC000090004046 360053254 /nfs/dbraw/zinc/05/32/54/360053254.db2.gz KUILPHASIIXYBS-LBPRGKRZSA-N 2 0 239.338 2.034 20 0 BEADRP COc1ccc2c(c1)[C@@H]([NH2+]CCC[NH3+])CCC2 ZINC000092383691 360166024 /nfs/dbraw/zinc/16/60/24/360166024.db2.gz YTRWCJHBFKXCSR-AWEZNQCLSA-N 2 0 234.343 2.011 20 0 BEADRP COC[C@H](C)C[NH2+][C@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000093516225 360256163 /nfs/dbraw/zinc/25/61/63/360256163.db2.gz WNXBFUHQRUSFIV-MGPQQGTHSA-N 2 0 242.407 2.169 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CC[N@H+](C[C@@H]2C[C@H]2c2ccccc2)C1 ZINC000414665786 200757480 /nfs/dbraw/zinc/75/74/80/200757480.db2.gz VXUYPEYEBPPIFM-UKMLZYKCSA-N 2 0 244.382 2.459 20 0 BEADRP C[C@@H]1C[C@@H](C[N@@H+]2CCCC[C@@H](C)C2)CC[NH2+]1 ZINC000414765494 219881802 /nfs/dbraw/zinc/88/18/02/219881802.db2.gz ZXXREUTUXGURLN-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)[C@@H]1CCC[C@H]1[NH2+][C@@H]1CC[NH2+][C@H]1C ZINC000629407932 361056579 /nfs/dbraw/zinc/05/65/79/361056579.db2.gz NESMMTZNWRKVQZ-WUHRBBMRSA-N 2 0 210.365 2.151 20 0 BEADRP CC[C@H](C[C@@H](C)CC)[NH2+]CC1([NH3+])CCOCC1 ZINC000629388038 361039918 /nfs/dbraw/zinc/03/99/18/361039918.db2.gz PXABDFBEGHTWBW-QWHCGFSZSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@@H]1CC(C)(C)CC[C@@H]1[NH2+]CCOCCC[NH3+] ZINC000629399703 361050864 /nfs/dbraw/zinc/05/08/64/361050864.db2.gz KIKNPGKMOREXBF-OLZOCXBDSA-N 2 0 242.407 2.156 20 0 BEADRP CC[C@H]1CCC[C@@H](C[NH2+]CCOCCC[NH3+])C1 ZINC000629399778 361050953 /nfs/dbraw/zinc/05/09/53/361050953.db2.gz BOIQOQIRBOOVLC-UONOGXRCSA-N 2 0 242.407 2.158 20 0 BEADRP C[C@H]1CC(C)(C)CC[C@H]1[NH2+]CCOCCC[NH3+] ZINC000629399704 361051087 /nfs/dbraw/zinc/05/10/87/361051087.db2.gz KIKNPGKMOREXBF-QWHCGFSZSA-N 2 0 242.407 2.156 20 0 BEADRP Cc1cnccc1CC[NH2+][C@H](C)CCCC[NH3+] ZINC000423016275 200855488 /nfs/dbraw/zinc/85/54/88/200855488.db2.gz SPGYZZMHZVFLNS-CYBMUJFWSA-N 2 0 235.375 2.040 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1[NH2+]C1CCCCCC1 ZINC000629401551 361051845 /nfs/dbraw/zinc/05/18/45/361051845.db2.gz CURHNEJIZFEAIZ-QWHCGFSZSA-N 2 0 210.365 2.439 20 0 BEADRP CC(C)[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[NH2+][C@H]1C ZINC000629407928 361057209 /nfs/dbraw/zinc/05/72/09/361057209.db2.gz NESMMTZNWRKVQZ-RVMXOQNASA-N 2 0 210.365 2.151 20 0 BEADRP CCCC[C@H]1CCC[C@@H]1[NH2+]CCOCC[NH2+]C ZINC000629405812 361053882 /nfs/dbraw/zinc/05/38/82/361053882.db2.gz UATQHFLLQRLQFR-KBPBESRZSA-N 2 0 242.407 2.171 20 0 BEADRP C[NH2+]CCOCC[NH2+][C@H](C)CCC1CCCC1 ZINC000629405852 361054302 /nfs/dbraw/zinc/05/43/02/361054302.db2.gz VQSKGWNMGPFFFN-CYBMUJFWSA-N 2 0 242.407 2.171 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+][C@@H]1CC[C@@H](C)[C@@H](C)C1 ZINC000629406524 361054427 /nfs/dbraw/zinc/05/44/27/361054427.db2.gz NIJYSLSFBKFDLE-KSSYENDESA-N 2 0 210.365 2.151 20 0 BEADRP C[C@@H]1C[N@@H+](CC2CC[NH2+]CC2)C[C@H](C)C1(F)F ZINC000629497105 361099592 /nfs/dbraw/zinc/09/95/92/361099592.db2.gz VEIFAOGHTAJTCO-PHIMTYICSA-N 2 0 246.345 2.209 20 0 BEADRP CCC[C@H](C)CCCN1CCO[C@H]([C@@H](C)[NH3+])C1 ZINC000629515996 361109983 /nfs/dbraw/zinc/10/99/83/361109983.db2.gz YUEYLDTZTDDQKC-MJBXVCDLSA-N 2 0 242.407 2.251 20 0 BEADRP CCC[C@@H](C)CCC[N@H+](C)CCC[NH3+] ZINC000629515006 361112950 /nfs/dbraw/zinc/11/29/50/361112950.db2.gz OTOYFQQLSMUJJE-GFCCVEGCSA-N 2 0 200.370 2.483 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1[NH2+][C@@H](C(C)C)C1CC1 ZINC000629526168 361128494 /nfs/dbraw/zinc/12/84/94/361128494.db2.gz MBASBFRGMVVSJS-XQQFMLRXSA-N 2 0 210.365 2.151 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1[NH2+][C@H]1CCC12CCCC2 ZINC000629527293 361129304 /nfs/dbraw/zinc/12/93/04/361129304.db2.gz QWZQXEKCECLDNY-XQQFMLRXSA-N 2 0 222.376 2.439 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[NH2+][C@H]1CC)[C@@H]1C[C@H]1C ZINC000629528119 361131949 /nfs/dbraw/zinc/13/19/49/361131949.db2.gz PNFYEGIHXFBEBI-NAWOPXAZSA-N 2 0 210.365 2.151 20 0 BEADRP CC(C)[C@@H]([NH2+]CC[C@H]1CC[NH2+]C1)C1CC1 ZINC000578994884 366687506 /nfs/dbraw/zinc/68/75/06/366687506.db2.gz WHVSAMWTPKPILW-DGCLKSJQSA-N 2 0 210.365 2.010 20 0 BEADRP CC[C@@H]([NH2+][C@@H]1CC[NH2+][C@H]1CC)C1CCC1 ZINC000629528432 361137284 /nfs/dbraw/zinc/13/72/84/361137284.db2.gz ZCRYOPWXEOIPRD-FRRDWIJNSA-N 2 0 210.365 2.295 20 0 BEADRP CC[C@@H]1CC[C@H](C)C[C@H]1[NH2+]CCOCC[NH2+]C ZINC000629530235 361143066 /nfs/dbraw/zinc/14/30/66/361143066.db2.gz AIKUMUWRNYCWOW-BFHYXJOUSA-N 2 0 242.407 2.027 20 0 BEADRP C[C@@H](CCC(C)(C)C)[NH2+]CC1([NH3+])CCOCC1 ZINC000629521782 361122157 /nfs/dbraw/zinc/12/21/57/361122157.db2.gz UIGDECPBZZNTLC-LBPRGKRZSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@H]([NH2+]CC1([NH3+])CCOCC1)C1CCCCC1 ZINC000629523306 361124939 /nfs/dbraw/zinc/12/49/39/361124939.db2.gz DHELLFFXYYBATO-LBPRGKRZSA-N 2 0 240.391 2.053 20 0 BEADRP CCSCC[N@H+](C)CC[C@H]([NH3+])C(C)C ZINC000158584728 361204712 /nfs/dbraw/zinc/20/47/12/361204712.db2.gz LQPVYOPCANNBLS-NSHDSACASA-N 2 0 218.410 2.045 20 0 BEADRP CCOCC[N@H+](C)CCCC[NH+]1CCCCC1 ZINC000640530960 361301937 /nfs/dbraw/zinc/30/19/37/361301937.db2.gz JTCGLDCNATUCMR-UHFFFAOYSA-N 2 0 242.407 2.221 20 0 BEADRP C[C@H]([NH2+]CC1CC(C)C1)[C@@H]1CCCC[NH2+]1 ZINC000622044867 370674401 /nfs/dbraw/zinc/67/44/01/370674401.db2.gz WGGDSEXHQAMGHZ-MVKMKZAISA-N 2 0 210.365 2.153 20 0 BEADRP CC1CC(C[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)C1 ZINC000622044315 370675247 /nfs/dbraw/zinc/67/52/47/370675247.db2.gz ARFJHSQZHCHSGC-MYXTYHMWSA-N 2 0 222.376 2.010 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CC[C@H]1CC1(F)F ZINC000622043890 370675400 /nfs/dbraw/zinc/67/54/00/370675400.db2.gz OVEDPSYIISRFBJ-ZJUUUORDSA-N 2 0 220.307 2.139 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]CC[C@@H]1CC1(F)F ZINC000622043842 370676081 /nfs/dbraw/zinc/67/60/81/370676081.db2.gz NNAKMAUQVPWRGI-AXFHLTTASA-N 2 0 232.318 2.139 20 0 BEADRP CC(C)CCC[N@@H+]1CC[C@@H](C[NH+](C)C)C1 ZINC000429043305 201060381 /nfs/dbraw/zinc/06/03/81/201060381.db2.gz FFMPXNJTYDYNKW-ZDUSSCGKSA-N 2 0 212.381 2.306 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@H]1c1ccco1)[C@H]1CCC[NH2+]C1 ZINC000579342031 366761943 /nfs/dbraw/zinc/76/19/43/366761943.db2.gz MXSYJWHIWASPGS-WUHRBBMRSA-N 2 0 234.343 2.113 20 0 BEADRP [NH3+]C1(C[NH2+]CCOC2CCCCCC2)CCC1 ZINC000342112286 181332552 /nfs/dbraw/zinc/33/25/52/181332552.db2.gz VIKGLRDTAORORD-UHFFFAOYSA-N 2 0 240.391 2.197 20 0 BEADRP [NH3+]CCCOCC[NH2+][C@H]1CCCc2ccccc21 ZINC000629539474 361406297 /nfs/dbraw/zinc/40/62/97/361406297.db2.gz MHWJIUJEKHGBDG-HNNXBMFYSA-N 2 0 248.370 2.019 20 0 BEADRP C[C@H]([NH3+])c1ccc(NC(=O)[C@@H]([NH3+])C(C)(C)C)cc1 ZINC000429593165 201120881 /nfs/dbraw/zinc/12/08/81/201120881.db2.gz VGMGOBHJHVFPPQ-JOYOIKCWSA-N 2 0 249.358 2.018 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+]C(C1CCC1)C1CCC1 ZINC000629543806 361413155 /nfs/dbraw/zinc/41/31/55/361413155.db2.gz BSFULPCJOHRSTR-GXFFZTMASA-N 2 0 222.376 2.295 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+]C1CCc2ccccc2CC1 ZINC000629543761 361413430 /nfs/dbraw/zinc/41/34/30/361413430.db2.gz AYGZFBLSJGOQMP-BLLLJJGKSA-N 2 0 244.382 2.274 20 0 BEADRP C[C@@H]([NH2+]CCOCCC[NH3+])C1CCCCCC1 ZINC000629540591 361414309 /nfs/dbraw/zinc/41/43/09/361414309.db2.gz WRDLDWWIQKUYLN-CYBMUJFWSA-N 2 0 242.407 2.300 20 0 BEADRP CCC[C@@H]([NH2+]CCOCCC[NH3+])C1CCCC1 ZINC000629534939 361408331 /nfs/dbraw/zinc/40/83/31/361408331.db2.gz BASKKLNQBRGMPY-CQSZACIVSA-N 2 0 242.407 2.300 20 0 BEADRP CCSCC[N@@H+]1CCC[C@H]([NH+](C)C)CC1 ZINC000429555284 201113607 /nfs/dbraw/zinc/11/36/07/201113607.db2.gz VYFHVYAVIWGZPQ-LBPRGKRZSA-N 2 0 230.421 2.156 20 0 BEADRP CC[C@H]1CCCC[C@H]1[NH2+][C@@H]1CC[NH2+][C@H]1C ZINC000629544290 361420551 /nfs/dbraw/zinc/42/05/51/361420551.db2.gz JBBDGIAWZIJJOG-WUHRBBMRSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1N[C@H](c1cncc(F)c1)C1CC1 ZINC000629546424 361427876 /nfs/dbraw/zinc/42/78/76/361427876.db2.gz PQPFMZDCNOJFJO-FZZIBODNSA-N 2 0 249.333 2.012 20 0 BEADRP CCOc1ccc([C@@H](C)N[C@@H]2CC[NH2+][C@H]2C)cc1 ZINC000629546477 361428088 /nfs/dbraw/zinc/42/80/88/361428088.db2.gz YKCHVMRCLDYKGM-TYNCELHUSA-N 2 0 248.370 2.486 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[NH2+]C1)[C@@H]1CCCC[C@H]1C ZINC000629553333 361439119 /nfs/dbraw/zinc/43/91/19/361439119.db2.gz WCBMGJYZCRCOOK-YVECIDJPSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1C[N@@H+](CC[C@H]2CC[NH2+]C2)C[C@H](C)C1(F)F ZINC000629554152 361439841 /nfs/dbraw/zinc/43/98/41/361439841.db2.gz ZINSNLOLPXMIFK-GRYCIOLGSA-N 2 0 246.345 2.209 20 0 BEADRP CO[C@H]1C[C@@H](C[NH2+][C@@H]2C[C@H]([NH3+])c3ccccc32)C1 ZINC000629555523 361447365 /nfs/dbraw/zinc/44/73/65/361447365.db2.gz WHUPMEWIDANCAV-IDTSFGKNSA-N 2 0 246.354 2.146 20 0 BEADRP CO[C@H]1C[C@@H](C[NH2+][C@H]2C[C@H]([NH3+])c3ccccc32)C1 ZINC000629555524 361447698 /nfs/dbraw/zinc/44/76/98/361447698.db2.gz WHUPMEWIDANCAV-JLUCKKNBSA-N 2 0 246.354 2.146 20 0 BEADRP Cc1ccsc1[C@@H](C)[NH2+]CCOCCC[NH3+] ZINC000629541578 361416571 /nfs/dbraw/zinc/41/65/71/361416571.db2.gz RIFCMSSMPJGITO-LLVKDONJSA-N 2 0 242.388 2.073 20 0 BEADRP CC(C)[C@H]1CCCC[C@H]1[NH2+]CCOCCC[NH3+] ZINC000629541478 361416644 /nfs/dbraw/zinc/41/66/44/361416644.db2.gz PEXZPMKJPMLTGF-ZIAGYGMSSA-N 2 0 242.407 2.156 20 0 BEADRP C(C[NH2+]CC1CCCCC1)C[NH2+]C1CC1 ZINC000163428435 361478114 /nfs/dbraw/zinc/47/81/14/361478114.db2.gz XSJQOYVVGWRXRY-UHFFFAOYSA-N 2 0 210.365 2.298 20 0 BEADRP C[NH2+]CCC[NH2+]Cc1ccc(C)cc1C ZINC000163322848 361454421 /nfs/dbraw/zinc/45/44/21/361454421.db2.gz MNRZHBJYTIGCNZ-UHFFFAOYSA-N 2 0 206.333 2.003 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H]2CC[C@@H]2C(C)C)C1 ZINC000309966767 491158596 /nfs/dbraw/zinc/15/85/96/491158596.db2.gz NVEILGGYULBHNL-MCIONIFRSA-N 2 0 224.392 2.352 20 0 BEADRP C[N@H+](CCOC(C)(C)C)C[C@H]1CCC[NH+](C)C1 ZINC000152434665 201198956 /nfs/dbraw/zinc/19/89/56/201198956.db2.gz RDSKIKHTCINYKK-ZDUSSCGKSA-N 2 0 242.407 2.075 20 0 BEADRP C[C@H]([NH3+])c1ccc(C[NH2+]CC2=CCCOC2)cc1 ZINC000629647913 361538801 /nfs/dbraw/zinc/53/88/01/361538801.db2.gz KCEUINMDEUNPBC-LBPRGKRZSA-N 2 0 246.354 2.143 20 0 BEADRP C[NH2+]Cc1ccccc1C[NH2+]Cc1ccn(C)c1 ZINC000629650365 361547754 /nfs/dbraw/zinc/54/77/54/361547754.db2.gz SMJHHWYIQZVAJA-UHFFFAOYSA-N 2 0 243.354 2.034 20 0 BEADRP C[C@H]1C[C@@H](C[N@@H+]2CCCC(F)(F)CC2)CC[NH2+]1 ZINC000629652792 361551151 /nfs/dbraw/zinc/55/11/51/361551151.db2.gz BIOVLGAXYBWQNA-RYUDHWBXSA-N 2 0 246.345 2.496 20 0 BEADRP CC(C)(C)CC[N@@H+]1C[C@@]2(C)C[NH2+]C[C@@]2(C)C1 ZINC000629666140 361587600 /nfs/dbraw/zinc/58/76/00/361587600.db2.gz MTODKNXQWWVPCR-OKILXGFUSA-N 2 0 224.392 2.354 20 0 BEADRP C[NH2+]C[C@H]1CC[N@H+](C[C@H](C)Cc2ccccc2)C1 ZINC000435377070 201264757 /nfs/dbraw/zinc/26/47/57/201264757.db2.gz XUHHPSSGITZWTN-GDBMZVCRSA-N 2 0 246.398 2.407 20 0 BEADRP [NH3+]C1CCC([NH2+]CC2CCCCC2)CC1 ZINC000051692950 181341229 /nfs/dbraw/zinc/34/12/29/181341229.db2.gz LEWYLIZPAYHPCK-UHFFFAOYSA-N 2 0 210.365 2.426 20 0 BEADRP [NH3+]C1CCC([NH2+]Cc2ccc(F)c(F)c2)CC1 ZINC000051692875 181341252 /nfs/dbraw/zinc/34/12/52/181341252.db2.gz GZTQAEUOXODYPZ-UHFFFAOYSA-N 2 0 240.297 2.324 20 0 BEADRP [NH3+]C1CCC([NH2+]CCOC2CCCCC2)CC1 ZINC000094089093 181341776 /nfs/dbraw/zinc/34/17/76/181341776.db2.gz WCCRSRMZHHSLTC-UHFFFAOYSA-N 2 0 240.391 2.195 20 0 BEADRP CC[NH2+]Cc1cccc(C2=CC[NH2+]CC2)c1 ZINC000629724112 361665599 /nfs/dbraw/zinc/66/55/99/361665599.db2.gz WYLLSAJEQZJIHN-UHFFFAOYSA-N 2 0 216.328 2.173 20 0 BEADRP C[C@H]([NH3+])c1cccc(C2=CC[NH2+]CC2)c1 ZINC000629723808 361666000 /nfs/dbraw/zinc/66/60/00/361666000.db2.gz QWWYQHCAJFWJSM-JTQLQIEISA-N 2 0 202.301 2.083 20 0 BEADRP [NH3+]C1CCC([NH2+][C@H]2CCc3ccccc3C2)CC1 ZINC000051694271 181342345 /nfs/dbraw/zinc/34/23/45/181342345.db2.gz CYKAUQDIQNLMBK-GPANFISMSA-N 2 0 244.382 2.403 20 0 BEADRP Cc1cc(C2=CC[NH2+]CC2)cc(C)c1C[NH3+] ZINC000629722613 361662476 /nfs/dbraw/zinc/66/24/76/361662476.db2.gz DAANIZXDHLWPKT-UHFFFAOYSA-N 2 0 216.328 2.139 20 0 BEADRP C[NH2+]CCC[N@@H+]1CC[C@H](c2ccccc2)[C@H]1C ZINC000435879357 201292396 /nfs/dbraw/zinc/29/23/96/201292396.db2.gz JPFYYYCEZVFKEA-HIFRSBDPSA-N 2 0 232.371 2.474 20 0 BEADRP C[NH2+]CCC[N@@H+]1CC[C@H](c2ccccc2)[C@@H]1C ZINC000435879359 201292876 /nfs/dbraw/zinc/29/28/76/201292876.db2.gz JPFYYYCEZVFKEA-ZFWWWQNUSA-N 2 0 232.371 2.474 20 0 BEADRP CC(C)N(C)CC[NH2+][C@H](C)C(C)(C)C ZINC000155781208 201352615 /nfs/dbraw/zinc/35/26/15/201352615.db2.gz QRCJMONMMIQWGX-LLVKDONJSA-N 2 0 200.370 2.351 20 0 BEADRP CC[C@H](Cc1ccc(C)cc1)[NH2+]CCC[NH3+] ZINC000437768107 201372816 /nfs/dbraw/zinc/37/28/16/201372816.db2.gz AQSXWUWCMMEYMY-CQSZACIVSA-N 2 0 220.360 2.255 20 0 BEADRP CCc1nc(C[NH2+][C@H](C)CCCC[NH3+])cs1 ZINC000328164556 363853174 /nfs/dbraw/zinc/85/31/74/363853174.db2.gz WBQDWHSZLBPJQT-SNVBAGLBSA-N 2 0 241.404 2.313 20 0 BEADRP C(CC1CC[NH2+]CC1)SCC1CC[NH2+]CC1 ZINC000573321631 364797913 /nfs/dbraw/zinc/79/79/13/364797913.db2.gz UFEZHABFXJLOLO-UHFFFAOYSA-N 2 0 242.432 2.109 20 0 BEADRP CCC(C)(C)[C@H](C)[NH2+]CC1=CC[NH2+]CC1 ZINC000573793394 364916295 /nfs/dbraw/zinc/91/62/95/364916295.db2.gz KHPZQIJHEKWEIB-NSHDSACASA-N 2 0 210.365 2.320 20 0 BEADRP CC[NH+](CC)C[C@H]1CC[N@@H+]([C@H](C)CCOC)C1 ZINC000446788797 541391426 /nfs/dbraw/zinc/39/14/26/541391426.db2.gz ZIIAFQBUEKTEAG-ZIAGYGMSSA-N 2 0 242.407 2.075 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C[C@H]2Cc3ccccc32)CC[N@@H+]1C ZINC000247118871 541416055 /nfs/dbraw/zinc/41/60/55/541416055.db2.gz UJPRUQVFDISSBM-YUELXQCFSA-N 2 0 244.382 2.399 20 0 BEADRP CCc1ccc(C[N@@H+]2CC[C@@H]([C@@H](C)[NH3+])C2)s1 ZINC000168493632 364941424 /nfs/dbraw/zinc/94/14/24/364941424.db2.gz NJYPBLKGXSXSQP-GHMZBOCLSA-N 2 0 238.400 2.480 20 0 BEADRP COc1cccc2c1CCC[C@@H]2N[C@@H](C)[C@@H](C)[NH3+] ZINC000573953364 364953976 /nfs/dbraw/zinc/95/39/76/364953976.db2.gz ZVYPQCGCOSRBJV-SUNKGSAMSA-N 2 0 248.370 2.398 20 0 BEADRP COc1cccc2c1CCC[C@@H]2N[C@H](C)[C@@H](C)[NH3+] ZINC000573953362 364954011 /nfs/dbraw/zinc/95/40/11/364954011.db2.gz ZVYPQCGCOSRBJV-GYSYKLTISA-N 2 0 248.370 2.398 20 0 BEADRP C[N@H+](CCC[NH3+])Cc1ccc(OCC2CC2)cc1 ZINC000573966348 364955849 /nfs/dbraw/zinc/95/58/49/364955849.db2.gz VATYKHDCRAIOGT-UHFFFAOYSA-N 2 0 248.370 2.256 20 0 BEADRP [NH3+]CCC[N@H+](CC1CC1)C1CCCCC1 ZINC000036765324 181380056 /nfs/dbraw/zinc/38/00/56/181380056.db2.gz YEXHZRJGGLWHTL-UHFFFAOYSA-N 2 0 210.365 2.380 20 0 BEADRP CC[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1)C1CC1 ZINC000574206608 365011065 /nfs/dbraw/zinc/01/10/65/365011065.db2.gz YXRLJOPEIJCNBA-CQSZACIVSA-N 2 0 218.344 2.424 20 0 BEADRP [NH3+]CCC[N@@H+]1CCC[C@@H]1c1ccccc1 ZINC000034492708 181381346 /nfs/dbraw/zinc/38/13/46/181381346.db2.gz PLCSEZLEEKMIDY-CYBMUJFWSA-N 2 0 204.317 2.172 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]CC2(C(F)(F)F)CC2)C1 ZINC000574415529 365059055 /nfs/dbraw/zinc/05/90/55/365059055.db2.gz YVGBSNZZCVZJCZ-BDAKNGLRSA-N 2 0 236.281 2.188 20 0 BEADRP CC(C)N(C)C[C@@H](C)[NH2+][C@H]1C[C@@H](C)O[C@@H](C)C1 ZINC000574482996 365073200 /nfs/dbraw/zinc/07/32/00/365073200.db2.gz DZYVMOQKXHKLOK-MQYQWHSLSA-N 2 0 242.407 2.261 20 0 BEADRP C[N@@H+]1CCC[C@H](CC[NH2+]CC2(C)CC2)C1 ZINC000574617154 365102428 /nfs/dbraw/zinc/10/24/28/365102428.db2.gz YVDCOPZBLNSLFZ-GFCCVEGCSA-N 2 0 210.365 2.108 20 0 BEADRP CC[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCC[C@H]3C[C@H]32)C1 ZINC000575197934 365239002 /nfs/dbraw/zinc/23/90/02/365239002.db2.gz RJOHMYOFTQJNCL-BARDWOONSA-N 2 0 236.403 2.497 20 0 BEADRP CC(C)(C)CC[C@H](CO)[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000575195678 365236834 /nfs/dbraw/zinc/23/68/34/365236834.db2.gz RHJMVTWOEPKKJT-RWMBFGLXSA-N 2 0 242.407 2.033 20 0 BEADRP CC(C)(C)CC[C@H](CO)[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000575195679 365237123 /nfs/dbraw/zinc/23/71/23/365237123.db2.gz RHJMVTWOEPKKJT-YNEHKIRRSA-N 2 0 242.407 2.033 20 0 BEADRP CC(C)(C)CC[C@H](CO)[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000575195676 365237723 /nfs/dbraw/zinc/23/77/23/365237723.db2.gz RHJMVTWOEPKKJT-FRRDWIJNSA-N 2 0 242.407 2.033 20 0 BEADRP CC[C@@H]([NH2+]CCC[NH+]1CCCC1)[C@H]1CCCO1 ZINC000182330887 366887295 /nfs/dbraw/zinc/88/72/95/366887295.db2.gz CUKRRPJXKRCUNA-ZIAGYGMSSA-N 2 0 240.391 2.020 20 0 BEADRP COC[C@@H](C)[NH2+]CCCCC[NH+]1CCCCC1 ZINC000174077030 365468917 /nfs/dbraw/zinc/46/89/17/365468917.db2.gz FHHJTFPXTZJCNL-CQSZACIVSA-N 2 0 242.407 2.267 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H]1C[C@H](C)CC[C@@H]1C ZINC000576099193 365482488 /nfs/dbraw/zinc/48/24/88/365482488.db2.gz HEHUBINCOWDRDZ-FRRDWIJNSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CCCc1cccs1 ZINC000579945022 367095470 /nfs/dbraw/zinc/09/54/70/367095470.db2.gz DQAKXEZSEOAUCP-LLVKDONJSA-N 2 0 226.389 2.398 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H]1C[C@H](OC)C1(CC)CC ZINC000580827655 367177785 /nfs/dbraw/zinc/17/77/85/367177785.db2.gz XVQJCRUDGDTDGA-OLZOCXBDSA-N 2 0 242.407 2.169 20 0 BEADRP C[C@@H](Cc1ccsc1)[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000581178723 367284245 /nfs/dbraw/zinc/28/42/45/367284245.db2.gz IXUWFUQMPMRMML-NWDGAFQWSA-N 2 0 238.400 2.268 20 0 BEADRP C[C@@H]1C[N@H+](C[C@H]2CC[NH2+][C@@H](C)C2)C(C)(C)C1 ZINC000380504658 367226130 /nfs/dbraw/zinc/22/61/30/367226130.db2.gz IDPWOPIMJBAKRU-AVGNSLFASA-N 2 0 224.392 2.495 20 0 BEADRP CC(C)C[C@H](N)C[N@@H+]1C[C@H](C)CC1(C)C ZINC000380576896 367245715 /nfs/dbraw/zinc/24/57/15/367245715.db2.gz VIWIKQWORONPNJ-NEPJUHHUSA-N 2 0 212.381 2.480 20 0 BEADRP c1csc(CCC[NH2+]C2CC[NH2+]CC2)c1 ZINC000581364252 367394011 /nfs/dbraw/zinc/39/40/11/367394011.db2.gz QCUOILHVVGBDGL-UHFFFAOYSA-N 2 0 224.373 2.022 20 0 BEADRP Cc1cc([C@H](C)[NH2+]CCCC[NH3+])cs1 ZINC000381746616 367454391 /nfs/dbraw/zinc/45/43/91/367454391.db2.gz MWDJKTMUZPOFMF-JTQLQIEISA-N 2 0 212.362 2.446 20 0 BEADRP C[NH2+]CCC[NH2+]C/C=C\c1ccc(F)cc1 ZINC000382848376 367563620 /nfs/dbraw/zinc/56/36/20/367563620.db2.gz VAPGVSLGYJDEKW-RQOWECAXSA-N 2 0 222.307 2.038 20 0 BEADRP CCc1ccccc1CN(C)[C@@H](C)C[NH3+] ZINC000382983230 367580353 /nfs/dbraw/zinc/58/03/53/367580353.db2.gz YNMNQIHTWROQHG-NSHDSACASA-N 2 0 206.333 2.028 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+][C@@H](C)CC(C)(C)C ZINC000384569655 367700492 /nfs/dbraw/zinc/70/04/92/367700492.db2.gz UPCXCVRVJFXVCN-RYUDHWBXSA-N 2 0 230.396 2.155 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+][C@H](C)CC(C)(C)C ZINC000384569657 367700970 /nfs/dbraw/zinc/70/09/70/367700970.db2.gz UPCXCVRVJFXVCN-VXGBXAGGSA-N 2 0 230.396 2.155 20 0 BEADRP CC[C@@H]1[C@@H](C)CC[N@@H+]1CCC1CC[NH2+]CC1 ZINC000384026594 367669817 /nfs/dbraw/zinc/66/98/17/367669817.db2.gz YEZMKPBYPQIIJL-GXTWGEPZSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H]1[C@H](C)CC[N@@H+]1C[C@H]1CC[NH2+][C@@H](C)C1 ZINC000384156549 367673254 /nfs/dbraw/zinc/67/32/54/367673254.db2.gz LPKOOOMJKVLJIL-ZOBORPQBSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H](CC(C)(C)C)[NH2+]CCC[NH+](C)C ZINC000384801179 367733708 /nfs/dbraw/zinc/73/37/08/367733708.db2.gz SSSZRZXZIHDOBT-NSHDSACASA-N 2 0 200.370 2.352 20 0 BEADRP CC/C=C\C[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000384889885 367752038 /nfs/dbraw/zinc/75/20/38/367752038.db2.gz SZQBPCLDVKAEIE-JXLSXLBDSA-N 2 0 208.349 2.169 20 0 BEADRP CC/C=C\C[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000384889883 367752303 /nfs/dbraw/zinc/75/23/03/367752303.db2.gz SZQBPCLDVKAEIE-FGTRRKKMSA-N 2 0 208.349 2.169 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCc2ccccc21 ZINC000227134938 181432502 /nfs/dbraw/zinc/43/25/02/181432502.db2.gz MAZDANFVIUBXLZ-AEGPPILISA-N 2 0 230.355 2.391 20 0 BEADRP C[N@H+](Cc1ccc2c(c1)CCC2)C1CC([NH3+])C1 ZINC000385023820 367774072 /nfs/dbraw/zinc/77/40/72/367774072.db2.gz OVSBXCVZAZXALA-UHFFFAOYSA-N 2 0 230.355 2.097 20 0 BEADRP CC[NH+]1CCC(C[NH2+]Cc2ccncc2C)CC1 ZINC000385162627 367803906 /nfs/dbraw/zinc/80/39/06/367803906.db2.gz LKEMHQJPKRBWTJ-UHFFFAOYSA-N 2 0 247.386 2.212 20 0 BEADRP CSCC1CCC([NH2+][C@@H](C)[C@@H](C)[NH3+])CC1 ZINC000385864417 367870871 /nfs/dbraw/zinc/87/08/71/367870871.db2.gz STCINPPKCRNPHI-QKEWWQLBSA-N 2 0 230.421 2.234 20 0 BEADRP CSCC1CCC([NH2+][C@@H](C)[C@H](C)[NH3+])CC1 ZINC000385864409 367871303 /nfs/dbraw/zinc/87/13/03/367871303.db2.gz STCINPPKCRNPHI-JYBOHDQNSA-N 2 0 230.421 2.234 20 0 BEADRP COCCC[C@@H](C)[NH2+]Cc1ccc(C[NH3+])cc1 ZINC000581884877 367875441 /nfs/dbraw/zinc/87/54/41/367875441.db2.gz KGHNEXRQGHFBRE-GFCCVEGCSA-N 2 0 236.359 2.050 20 0 BEADRP Cc1cc(C[NH2+]C[C@@H](C)C[NH3+])c(C)s1 ZINC000581773457 367824470 /nfs/dbraw/zinc/82/44/70/367824470.db2.gz AZKMQEXSLBNUTK-QMMMGPOBSA-N 2 0 212.362 2.049 20 0 BEADRP C[C@@H]([N@H+](C)CC[C@H]1CCC[NH2+]C1)C1(C)CC1 ZINC000385417289 367827380 /nfs/dbraw/zinc/82/73/80/367827380.db2.gz ZHKIHCMJHOJTFF-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]Cc1scnc1C1CC1 ZINC000581824189 367832270 /nfs/dbraw/zinc/83/22/70/367832270.db2.gz AXNFSIAXDPSIOT-RKDXNWHRSA-N 2 0 239.388 2.236 20 0 BEADRP CC[N@H+](CCC1CC1)C[C@@H]1CC[NH2+][C@@H](C)C1 ZINC000385489127 367835213 /nfs/dbraw/zinc/83/52/13/367835213.db2.gz DXBFFHYIWKLTDL-GXTWGEPZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CC1(C)C)[C@@H]1CCCC[NH2+]1 ZINC000386100090 367912778 /nfs/dbraw/zinc/91/27/78/367912778.db2.gz JQHZTZLVKPOQFY-TUAOUCFPSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH2+]CC1(C)CCC1)[C@H]1CCCC[NH2+]1 ZINC000386127259 367916262 /nfs/dbraw/zinc/91/62/62/367916262.db2.gz NXXBKFVXXHSRPO-NWDGAFQWSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]([NH2+]CC1CCSCC1)[C@H]1CCCC[NH2+]1 ZINC000386567240 367993855 /nfs/dbraw/zinc/99/38/55/367993855.db2.gz KNPUPANPQBIODX-DGCLKSJQSA-N 2 0 242.432 2.250 20 0 BEADRP CSCCCC[NH2+][C@@H](C)[C@H]1CCCC[NH2+]1 ZINC000386596411 367997882 /nfs/dbraw/zinc/99/78/82/367997882.db2.gz SVENNJIBXAMGCM-NWDGAFQWSA-N 2 0 230.421 2.250 20 0 BEADRP CSCCCC[NH2+][C@H](C)[C@H]1CCCC[NH2+]1 ZINC000386596414 367998434 /nfs/dbraw/zinc/99/84/34/367998434.db2.gz SVENNJIBXAMGCM-VXGBXAGGSA-N 2 0 230.421 2.250 20 0 BEADRP CSCCCC[NH2+][C@@H](C)[C@@H]1CCCC[NH2+]1 ZINC000386596412 367998980 /nfs/dbraw/zinc/99/89/80/367998980.db2.gz SVENNJIBXAMGCM-RYUDHWBXSA-N 2 0 230.421 2.250 20 0 BEADRP CCCCOCCC[NH2+][C@H](C)[C@@H]1CCCC[NH2+]1 ZINC000386367310 367956253 /nfs/dbraw/zinc/95/62/53/367956253.db2.gz AUKLDDMUSMSKOF-KGLIPLIRSA-N 2 0 242.407 2.313 20 0 BEADRP CC[C@H]([NH2+][C@H](C)C[C@@H]1CCCCC[NH2+]1)[C@H](C)O ZINC000386835788 368025937 /nfs/dbraw/zinc/02/59/37/368025937.db2.gz IOKZGIZXRVLWKV-RFGFWPKPSA-N 2 0 242.407 2.046 20 0 BEADRP C[C@@H]1CC(C)(C)C[C@@H]1[NH2+]C1CC([NH+](C)C)C1 ZINC000566805611 326084950 /nfs/dbraw/zinc/08/49/50/326084950.db2.gz JAAYFIDMJCOXHL-XVSSEFHLSA-N 2 0 224.392 2.493 20 0 BEADRP CCc1ccc(C[NH2+][C@H](C)C[C@H](C)[NH3+])cc1 ZINC000567041236 326104715 /nfs/dbraw/zinc/10/47/15/326104715.db2.gz FZVOZVSGGIIDSC-NWDGAFQWSA-N 2 0 220.360 2.464 20 0 BEADRP [NH3+]CCCC[NH2+]Cc1ccnc2ccccc12 ZINC000111753945 368861726 /nfs/dbraw/zinc/86/17/26/368861726.db2.gz PAKKZUASXNBXAG-UHFFFAOYSA-N 2 0 229.327 2.063 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]CCc2cccs2)C1 ZINC000086402014 368879902 /nfs/dbraw/zinc/87/99/02/368879902.db2.gz KCILGDIMEMQHAH-MNOVXSKESA-N 2 0 224.373 2.150 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]CCc2cccs2)C1 ZINC000086402010 368879919 /nfs/dbraw/zinc/87/99/19/368879919.db2.gz KCILGDIMEMQHAH-QWRGUYRKSA-N 2 0 224.373 2.150 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CC2CC[NH2+]CC2)C[C@@H]1C ZINC000086701337 368883595 /nfs/dbraw/zinc/88/35/95/368883595.db2.gz CISCQNBHAADBOS-MBNYWOFBSA-N 2 0 224.392 2.400 20 0 BEADRP c1ccc2c(c1)CCC[N@@H+](CC[C@H]1CC[NH2+]C1)C2 ZINC000089749454 368952630 /nfs/dbraw/zinc/95/26/30/368952630.db2.gz KGRJRGUZHNYRDU-CQSZACIVSA-N 2 0 244.382 2.434 20 0 BEADRP c1ccc2c(c1)CCC[N@@H+](CC[C@@H]1CC[NH2+]C1)C2 ZINC000089749453 368953190 /nfs/dbraw/zinc/95/31/90/368953190.db2.gz KGRJRGUZHNYRDU-AWEZNQCLSA-N 2 0 244.382 2.434 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)[C@H]1C[C@H]1C ZINC000623657272 368997496 /nfs/dbraw/zinc/99/74/96/368997496.db2.gz MNZNXGOUYWTIMB-RQJABVFESA-N 2 0 224.392 2.352 20 0 BEADRP C[N@@H+]1CCCC[C@H](C[NH2+][C@H]2CCCSC2)C1 ZINC000623656991 368997585 /nfs/dbraw/zinc/99/75/85/368997585.db2.gz HHZAHOAAHCZMRE-OLZOCXBDSA-N 2 0 242.432 2.204 20 0 BEADRP Cc1cc(C[NH2+]C[C@@H]2CCCC[N@@H+](C)C2)ccn1 ZINC000623657555 368998024 /nfs/dbraw/zinc/99/80/24/368998024.db2.gz UKGSQLURKQZGGH-HNNXBMFYSA-N 2 0 247.386 2.212 20 0 BEADRP CC(C)OC[C@@H](C)[NH2+]C[C@@H]1CCCC[N@H+](C)C1 ZINC000623657094 368998077 /nfs/dbraw/zinc/99/80/77/368998077.db2.gz JRBYVINUVSXNDU-KGLIPLIRSA-N 2 0 242.407 2.121 20 0 BEADRP CC[C@@H](C)C[NH2+]C[C@@H]1CCCC[N@H+](C)C1 ZINC000623657779 368998790 /nfs/dbraw/zinc/99/87/90/368998790.db2.gz YXPRIKOCMUWOGH-OLZOCXBDSA-N 2 0 212.381 2.354 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)C1CC1 ZINC000623655836 368991423 /nfs/dbraw/zinc/99/14/23/368991423.db2.gz GZPJSKKWKHMYDS-NWDGAFQWSA-N 2 0 210.365 2.106 20 0 BEADRP Cc1ccc(F)cc1C[N@@H+]1C[C@@H](C[NH3+])[C@H](C)C1 ZINC000631837384 369093889 /nfs/dbraw/zinc/09/38/89/369093889.db2.gz BADIHTYRQLVLSP-DGCLKSJQSA-N 2 0 236.334 2.161 20 0 BEADRP C[C@@H]1C[N@H+](C[C@@H]2CCCC[C@@H]2C)C[C@H]1C[NH3+] ZINC000631837324 369096672 /nfs/dbraw/zinc/09/66/72/369096672.db2.gz QSJAIXGKHHEXPK-RFQIPJPRSA-N 2 0 224.392 2.339 20 0 BEADRP CC(C)[N@H+](C)CC1CC[NH+](C(C)C)CC1 ZINC000201324679 369386710 /nfs/dbraw/zinc/38/67/10/369386710.db2.gz SXOADAHNMMFAGX-UHFFFAOYSA-N 2 0 212.381 2.447 20 0 BEADRP C[C@H]([NH2+]CC(C1CC1)C1CC1)[C@H]1CCC[NH2+]1 ZINC000400631318 369351516 /nfs/dbraw/zinc/35/15/16/369351516.db2.gz LTBKAWNRIMEAJT-IINYFYTJSA-N 2 0 222.376 2.153 20 0 BEADRP CC(C)c1ccc(C[NH+]2C[C@H]3C[NH2+]C[C@@H]3C2)cc1 ZINC000107573386 369353936 /nfs/dbraw/zinc/35/39/36/369353936.db2.gz HSGXPOGQUMUOHX-HZPDHXFCSA-N 2 0 244.382 2.461 20 0 BEADRP Cc1cccc([C@H](C)[NH+]2C[C@H]3C[NH2+]C[C@@H]3C2)c1 ZINC000203597038 369473312 /nfs/dbraw/zinc/47/33/12/369473312.db2.gz XBPHPELGIVYRHC-NWANDNLSSA-N 2 0 230.355 2.207 20 0 BEADRP C[C@@H]1CCC[C@H]1[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC000459730292 203345661 /nfs/dbraw/zinc/34/56/61/203345661.db2.gz KDTKJUNAPPZDIW-HZSPNIEDSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)c1ccccn1 ZINC000459737342 203346970 /nfs/dbraw/zinc/34/69/70/203346970.db2.gz QYFSBWACOJJVCO-ZIAGYGMSSA-N 2 0 247.386 2.464 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)C1CC1 ZINC000459779700 203365951 /nfs/dbraw/zinc/36/59/51/203365951.db2.gz LNDYZWCONYDWEF-VXGBXAGGSA-N 2 0 210.365 2.106 20 0 BEADRP CCC[NH+]1CCC(C[NH2+][C@H](C)C2CC2)CC1 ZINC000165293041 203382754 /nfs/dbraw/zinc/38/27/54/203382754.db2.gz NKTOYLQJPZVONT-GFCCVEGCSA-N 2 0 224.392 2.497 20 0 BEADRP C[N@@H+]1CCC[C@H](CC[NH2+]C2CC(C)(C)C2)C1 ZINC000459780976 203367554 /nfs/dbraw/zinc/36/75/54/203367554.db2.gz MEKJZBZXWOZNPF-GFCCVEGCSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC[C@@H]2CCC[N@H+](C)C2)[C@H]1C ZINC000459783933 203368345 /nfs/dbraw/zinc/36/83/45/203368345.db2.gz NMJWWDMVZUDEFV-RFGFWPKPSA-N 2 0 224.392 2.352 20 0 BEADRP C[N@@H+]1CCC[C@@H](CC[NH2+]C[C@@H]2CCSC2)C1 ZINC000459794364 203369184 /nfs/dbraw/zinc/36/91/84/203369184.db2.gz UMBJWLKKCMPLEN-STQMWFEESA-N 2 0 242.432 2.061 20 0 BEADRP C[C@@H]1CCC[C@@H]([N@H+](C)CC[C@H]2CC[NH2+]C2)C1 ZINC000251724765 369913183 /nfs/dbraw/zinc/91/31/83/369913183.db2.gz IRNIRGJUUPXTHA-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP c1ccc2c(c1)CCC[C@@H]2[NH+]1C[C@@H]2C[NH2+]C[C@H]2C1 ZINC000252453628 370045666 /nfs/dbraw/zinc/04/56/66/370045666.db2.gz PUJHUFLTTXDVAQ-DZKIICNBSA-N 2 0 242.366 2.215 20 0 BEADRP CC[C@@H](C[NH2+][C@]12CCC[C@@H]1C[NH2+]C2)CC(F)F ZINC000631867189 370212270 /nfs/dbraw/zinc/21/22/70/370212270.db2.gz MCUODCFFXVLBAL-WZRBSPASSA-N 2 0 246.345 2.400 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CC1(F)F)C1CC[NH+](C)CC1 ZINC000621769667 370512759 /nfs/dbraw/zinc/51/27/59/370512759.db2.gz FJIHLYIEWUIEJJ-CMPLNLGQSA-N 2 0 246.345 2.352 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]CC[C@@H]2CC2(F)F)CC1 ZINC000621734275 370490975 /nfs/dbraw/zinc/49/09/75/370490975.db2.gz JLTKAVLCDQHKEO-LLVKDONJSA-N 2 0 246.345 2.494 20 0 BEADRP [NH3+][C@@]12CCC[C@H]1C[N@H+](CC1CCCCC1)C2 ZINC000621777651 370527442 /nfs/dbraw/zinc/52/74/42/370527442.db2.gz DJBVHYATJHXSHZ-UONOGXRCSA-N 2 0 222.376 2.380 20 0 BEADRP CCC[C@@H](C)[NH2+]C[C@H]1CCCC[N@H+](C)C1 ZINC000624120033 371319979 /nfs/dbraw/zinc/31/99/79/371319979.db2.gz QEFGPVZCTRNONB-CHWSQXEVSA-N 2 0 212.381 2.497 20 0 BEADRP C[N@@H+]1CCCC[C@H](C[NH2+][C@H]2CCC[C@H]3C[C@H]32)C1 ZINC000624123890 371324235 /nfs/dbraw/zinc/32/42/35/371324235.db2.gz SNBGIOCXBXMITM-BARDWOONSA-N 2 0 236.403 2.497 20 0 BEADRP C/C=C/C[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000624197250 371384685 /nfs/dbraw/zinc/38/46/85/371384685.db2.gz GTEWQFOGMPAADU-NSCUHMNNSA-N 2 0 208.349 2.027 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]Cc2ccccc2)C12CCC2 ZINC000405376883 372156252 /nfs/dbraw/zinc/15/62/52/372156252.db2.gz BQCBAMXXVGRKBG-OLZOCXBDSA-N 2 0 216.328 2.046 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CC(C)(C)F)[C@@H]2CCC[C@@H]21 ZINC000631665965 372491107 /nfs/dbraw/zinc/49/11/07/372491107.db2.gz ZWTNVFBMOAAQNR-SRVKXCTJSA-N 2 0 228.355 2.197 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CC(C)(C)F)[C@H]2CCC[C@H]21 ZINC000631665961 372491288 /nfs/dbraw/zinc/49/12/88/372491288.db2.gz ZWTNVFBMOAAQNR-GRYCIOLGSA-N 2 0 228.355 2.197 20 0 BEADRP Cc1cc(C)c(CN2CC[NH2+]CC2(C)C)c(C)n1 ZINC000631821521 372594704 /nfs/dbraw/zinc/59/47/04/372594704.db2.gz AITYUAFCILLWDC-UHFFFAOYSA-N 2 0 247.386 2.191 20 0 BEADRP Cc1cc(C)c(C[N@H+]2CC[C@@H]([NH3+])C[C@@H]2C)c(C)n1 ZINC000631829359 372610964 /nfs/dbraw/zinc/61/09/64/372610964.db2.gz OTKUWJCLZGCBDU-GXTWGEPZSA-N 2 0 247.386 2.318 20 0 BEADRP Cc1cc(C)c(C[N@H+]2CC[C@H]([NH3+])C[C@@H]2C)c(C)n1 ZINC000631829360 372611227 /nfs/dbraw/zinc/61/12/27/372611227.db2.gz OTKUWJCLZGCBDU-JSGCOSHPSA-N 2 0 247.386 2.318 20 0 BEADRP Cc1ccc(C[N@@H+]2C[C@@H](C[NH3+])[C@H](C)C2)cc1F ZINC000631837506 372627886 /nfs/dbraw/zinc/62/78/86/372627886.db2.gz SYSAUBMJBJPESZ-DGCLKSJQSA-N 2 0 236.334 2.161 20 0 BEADRP Cc1cc(C)c(C[N@@H+]2C[C@@H](C[NH3+])[C@H](C)C2)c(C)n1 ZINC000631837374 372627916 /nfs/dbraw/zinc/62/79/16/372627916.db2.gz RQHKSHDMLQEHAJ-BXUZGUMPSA-N 2 0 247.386 2.033 20 0 BEADRP C[C@@H]1C[N@H+](CCCc2ccsc2)C[C@H]1C[NH3+] ZINC000631838175 372631479 /nfs/dbraw/zinc/63/14/79/372631479.db2.gz JYZGCQODLNGQKP-DGCLKSJQSA-N 2 0 238.400 2.207 20 0 BEADRP C[C@@H](c1ccccc1)[N@H+]1C[C@@H](C[NH3+])[C@H](C)C1 ZINC000631843059 372640246 /nfs/dbraw/zinc/64/02/46/372640246.db2.gz IYTBBTLFGLFRGA-MBNYWOFBSA-N 2 0 218.344 2.274 20 0 BEADRP Cc1cc(C)cc(C[N@@H+]2C[C@@H](C[NH3+])[C@H](C)C2)c1 ZINC000631844459 372643393 /nfs/dbraw/zinc/64/33/93/372643393.db2.gz XLDPZFZRFUFVRV-UKRRQHHQSA-N 2 0 232.371 2.330 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]1[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC000631826999 372606167 /nfs/dbraw/zinc/60/61/67/372606167.db2.gz CCZNEMWSAILFQR-MNOVXSKESA-N 2 0 246.345 2.400 20 0 BEADRP C[C@@H]1C[C@H]([NH3+])CN1CCCCC(F)(F)F ZINC000631862521 372663486 /nfs/dbraw/zinc/66/34/86/372663486.db2.gz QKNXVKJGJGDOMA-BDAKNGLRSA-N 2 0 224.270 2.141 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCC[C@@H](C2CCC2)CC1 ZINC000631872413 372673528 /nfs/dbraw/zinc/67/35/28/372673528.db2.gz AIPXEVPYANMVEH-CQSZACIVSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@H](CC1CCCC1)[NH2+]C[C@@H]([NH3+])C1CC1 ZINC000414891360 205779610 /nfs/dbraw/zinc/77/96/10/205779610.db2.gz NXFMCBFDRFXBKX-ZWNOBZJWSA-N 2 0 210.365 2.282 20 0 BEADRP CCN(CC[NH3+])Cc1cccc2cccnc21 ZINC000041160362 374116395 /nfs/dbraw/zinc/11/63/95/374116395.db2.gz ISMBKWDNAIWPIB-UHFFFAOYSA-N 2 0 229.327 2.015 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+][C@H]2CC23CC3)c2ccccc21 ZINC000424378112 206039161 /nfs/dbraw/zinc/03/91/61/206039161.db2.gz SCQKFUVMMFOPEF-UPJWGTAASA-N 2 0 214.312 2.273 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCC[C@H](C2CC2)C1)C1C[NH2+]C1 ZINC000424379861 206040477 /nfs/dbraw/zinc/04/04/77/206040477.db2.gz PJVYANFGTFWXTN-SCDSUCTJSA-N 2 0 222.376 2.153 20 0 BEADRP CSc1ccc(C[NH2+][C@H](C)CC[NH3+])cc1 ZINC000220518870 134309792 /nfs/dbraw/zinc/30/97/92/134309792.db2.gz HKXYYRHBHFDAOA-SNVBAGLBSA-N 2 0 224.373 2.235 20 0 BEADRP CCC[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000123276010 169186776 /nfs/dbraw/zinc/18/67/76/169186776.db2.gz CPURHULLVFBQID-UHFFFAOYSA-N 2 0 212.381 2.450 20 0 BEADRP CCC[NH+]1CCC([NH2+]CC2CCC2)CC1 ZINC000037180270 169188857 /nfs/dbraw/zinc/18/88/57/169188857.db2.gz FQYDIWWIQLRRCG-UHFFFAOYSA-N 2 0 210.365 2.251 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H](C)CCCCO)CC1 ZINC000352701777 169190257 /nfs/dbraw/zinc/19/02/57/169190257.db2.gz NXWHWFTYGUBNOW-CYBMUJFWSA-N 2 0 242.407 2.002 20 0 BEADRP c1cc(C[NH+]2CCC([C@H]3CCC[NH2+]3)CC2)ccn1 ZINC000063197526 183339680 /nfs/dbraw/zinc/33/96/80/183339680.db2.gz UUDLRRBVNVORNL-OAHLLOKOSA-N 2 0 245.370 2.046 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H]2CCC2(C)C)C1 ZINC000309946601 169206308 /nfs/dbraw/zinc/20/63/08/169206308.db2.gz DOXOSQANLWWOOE-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+]C[C@H]2CCSC2)C1 ZINC000309942949 169206960 /nfs/dbraw/zinc/20/69/60/169206960.db2.gz CGXZLYTYHQSSOW-QWHCGFSZSA-N 2 0 242.432 2.061 20 0 BEADRP c1ccc(CCC[N@@H+]2CC[C@H]3C[NH2+]C[C@H]3C2)cc1 ZINC000336786237 183392192 /nfs/dbraw/zinc/39/21/92/183392192.db2.gz BLSBULBRIMFOLM-HOTGVXAUSA-N 2 0 244.382 2.161 20 0 BEADRP CCC[NH2+][C@@H](C)CCC[NH+](CC)CC ZINC000019915218 169275275 /nfs/dbraw/zinc/27/52/75/169275275.db2.gz HWZXTGYOKNVBBZ-LBPRGKRZSA-N 2 0 200.370 2.497 20 0 BEADRP c1ccc2c(NC[C@@H]3CC[NH2+]C3)cc[nH+]c2c1 ZINC000133796353 183438646 /nfs/dbraw/zinc/43/86/46/183438646.db2.gz FRKYBGMXLGMGFZ-LLVKDONJSA-N 2 0 227.311 2.256 20 0 BEADRP CCC[NH2+][C@H]1CC[N@H+](CCCOCC)C[C@@H]1C ZINC000049709337 169291775 /nfs/dbraw/zinc/29/17/75/169291775.db2.gz SSLVMFMCBUQXMV-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP c1csc(C[NH2+]CC[C@H]2CCC[NH2+]C2)c1 ZINC000054309141 183519177 /nfs/dbraw/zinc/51/91/77/183519177.db2.gz ATTOEZWCOMFAED-LLVKDONJSA-N 2 0 224.373 2.227 20 0 BEADRP CC[NH2+]CC1CC[NH+](Cc2cccc(N)c2)CC1 ZINC000261644530 535460017 /nfs/dbraw/zinc/46/00/17/535460017.db2.gz GTQXKENDXRDESP-UHFFFAOYSA-N 2 0 247.386 2.090 20 0 BEADRP C[C@@H]([NH2+]CC1(C)CC[NH+](C)CC1)C1(C)CC1 ZINC000227495208 134381216 /nfs/dbraw/zinc/38/12/16/134381216.db2.gz XUWICAWLOLHTQI-GFCCVEGCSA-N 2 0 224.392 2.497 20 0 BEADRP [NH3+]CC[C@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000069723892 383840451 /nfs/dbraw/zinc/84/04/51/383840451.db2.gz MQCQBUTZPGTWDC-LLVKDONJSA-N 2 0 224.373 2.309 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CCC[NH2+]C1)c1cccs1 ZINC000087646193 383856935 /nfs/dbraw/zinc/85/69/35/383856935.db2.gz INIYIAWWOFTMKA-GHMZBOCLSA-N 2 0 224.373 2.398 20 0 BEADRP [NH3+][C@H]1CCC[C@H](C[NH2+]Cc2cccs2)C1 ZINC000070503173 383930432 /nfs/dbraw/zinc/93/04/32/383930432.db2.gz OCLMMCLMGDALIW-QWRGUYRKSA-N 2 0 224.373 2.355 20 0 BEADRP Cc1ncc([C@H](C)[NH2+][C@@H]2CC[C@H](C[NH3+])C2)s1 ZINC000643542729 383984466 /nfs/dbraw/zinc/98/44/66/383984466.db2.gz LKZMUSQWJIFFFQ-INTQDDNPSA-N 2 0 239.388 2.230 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)C1CC1 ZINC000643546099 384017545 /nfs/dbraw/zinc/01/75/45/384017545.db2.gz IHIXTCBPLMOQKZ-ZYHUDNBSSA-N 2 0 208.349 2.049 20 0 BEADRP C[NH+](C)C[C@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000114478116 384039157 /nfs/dbraw/zinc/03/91/57/384039157.db2.gz LWPGKSJFJFIKBO-OAHLLOKOSA-N 2 0 232.371 2.113 20 0 BEADRP Cc1nc(CC[NH2+][C@H](C)CCCC[NH3+])cs1 ZINC000309406057 384064032 /nfs/dbraw/zinc/06/40/32/384064032.db2.gz UYIOIRAENBPZJU-SNVBAGLBSA-N 2 0 241.404 2.101 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]CC1(C2CC2)CC1 ZINC000090773014 384074098 /nfs/dbraw/zinc/07/40/98/384074098.db2.gz FOXCHWRXMNTXEQ-BZPMIXESSA-N 2 0 236.403 2.495 20 0 BEADRP CC[NH2+][C@@H]1CCCC[C@@H]1C[NH+](CC)CC ZINC000060720694 134392580 /nfs/dbraw/zinc/39/25/80/134392580.db2.gz NNLSWNZYQXHCHB-CHWSQXEVSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H]([NH+](C)C)C2)[C@@H](C)O1 ZINC000449178571 384206000 /nfs/dbraw/zinc/20/60/00/384206000.db2.gz XPNPLKVPIHHRMZ-KSTCHIGDSA-N 2 0 240.391 2.015 20 0 BEADRP C[N@@H+](Cc1ccccc1F)CC1CC[NH2+]CC1 ZINC000042436875 384220986 /nfs/dbraw/zinc/22/09/86/384220986.db2.gz FKKVSZSJNQAAIT-UHFFFAOYSA-N 2 0 236.334 2.257 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1)CC(F)F ZINC000647318594 384247335 /nfs/dbraw/zinc/24/73/35/384247335.db2.gz UKDHTQSXOGFTNU-DCAQKATOSA-N 2 0 234.334 2.350 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1)CC(F)F ZINC000647318593 384247690 /nfs/dbraw/zinc/24/76/90/384247690.db2.gz UKDHTQSXOGFTNU-AXFHLTTASA-N 2 0 234.334 2.350 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3F)C[C@H]21 ZINC000228473991 384257455 /nfs/dbraw/zinc/25/74/55/384257455.db2.gz BKFMLEFIOYCBQP-NJZAAPMLSA-N 2 0 248.345 2.385 20 0 BEADRP CC[C@H]([NH2+]CCC[NH+]1CCCC1)C1CC1 ZINC000083054545 384278761 /nfs/dbraw/zinc/27/87/61/384278761.db2.gz WZYKIKHOPUODKO-ZDUSSCGKSA-N 2 0 210.365 2.251 20 0 BEADRP c1ccc2c(c1)CCC[C@@H]2[N@@H+]1CCC[NH2+]CC1 ZINC000034444888 384280588 /nfs/dbraw/zinc/28/05/88/384280588.db2.gz VIZVUUXHGLJMQQ-HNNXBMFYSA-N 2 0 230.355 2.359 20 0 BEADRP CCCC[N@H+](CC)C[C@H]1CC[NH2+][C@H](C)C1 ZINC000300056884 384285805 /nfs/dbraw/zinc/28/58/05/384285805.db2.gz VPMCHYHOFSVVDF-OLZOCXBDSA-N 2 0 212.381 2.497 20 0 BEADRP [NH3+][C@@H]1CCN([C@@H]2CCCc3ccccc32)C1 ZINC000224187852 384289124 /nfs/dbraw/zinc/28/91/24/384289124.db2.gz RJGTXTWFZPHABU-TZMCWYRMSA-N 2 0 216.328 2.097 20 0 BEADRP CSCC[N@H+](C)CC[C@@H]1CCCC[NH+]1C ZINC000173962703 384291511 /nfs/dbraw/zinc/29/15/11/384291511.db2.gz NDCZETXQLAABOW-LBPRGKRZSA-N 2 0 230.421 2.156 20 0 BEADRP CC(C)C[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000075835952 384357958 /nfs/dbraw/zinc/35/79/58/384357958.db2.gz IXGJBPWTMYVJNX-CQSZACIVSA-N 2 0 224.392 2.450 20 0 BEADRP C/C=C\C[NH2+][C@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000384731855 384362725 /nfs/dbraw/zinc/36/27/25/384362725.db2.gz JVAYRUGJWSTPJC-JXLSXLBDSA-N 2 0 210.365 2.463 20 0 BEADRP CCSCC[N@H+](C)[C@H]1CC[NH+](CC)C[C@H]1C ZINC000174780915 384362826 /nfs/dbraw/zinc/36/28/26/384362826.db2.gz ZBRAWCMEJDBGLS-OLZOCXBDSA-N 2 0 244.448 2.402 20 0 BEADRP COc1cc(CN2CC[C@H]([NH3+])C[C@H]2C)ccc1C ZINC000569619097 384363919 /nfs/dbraw/zinc/36/39/19/384363919.db2.gz OKUMDCDACQSCHM-OCCSQVGLSA-N 2 0 248.370 2.315 20 0 BEADRP C[C@H](Cc1ccccc1F)[NH2+]CCC[NH+](C)C ZINC000134047651 384328243 /nfs/dbraw/zinc/32/82/43/384328243.db2.gz OOJOPKWCUATTJO-GFCCVEGCSA-N 2 0 238.350 2.298 20 0 BEADRP CC1(C)[C@H]([NH3+])C[C@H]1[NH2+]CCCc1ccccc1 ZINC000405431079 384332879 /nfs/dbraw/zinc/33/28/79/384332879.db2.gz AXRFRLMRLQEOND-ZIAGYGMSSA-N 2 0 232.371 2.335 20 0 BEADRP C[C@@H]([NH2+]CCC1CC[NH+](C)CC1)c1ccccn1 ZINC000159013986 384333090 /nfs/dbraw/zinc/33/30/90/384333090.db2.gz SHZKZICFRGNPKA-CYBMUJFWSA-N 2 0 247.386 2.464 20 0 BEADRP CCN(C)CC[NH2+]C[C@@H]1CCC[C@H](C)C1 ZINC000084342737 384391802 /nfs/dbraw/zinc/39/18/02/384391802.db2.gz OHKRTDLXXXAIOO-QWHCGFSZSA-N 2 0 212.381 2.354 20 0 BEADRP CC[C@@H](C)C[N@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000121124972 384397971 /nfs/dbraw/zinc/39/79/71/384397971.db2.gz ZGLSWMYAQQSKGY-CHWSQXEVSA-N 2 0 212.381 2.306 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@H]2CCC2(C)C)CC1 ZINC000308843700 384377246 /nfs/dbraw/zinc/37/72/46/384377246.db2.gz ZDZWNCSZYKBUMN-LBPRGKRZSA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)C1([NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)CC1 ZINC000334195348 384388642 /nfs/dbraw/zinc/38/86/42/384388642.db2.gz KFACJIPGTSLVCL-CHWSQXEVSA-N 2 0 222.376 2.391 20 0 BEADRP C[C@]1(C[N@@H+]2CCC[C@@H]2c2ccccn2)CC[NH2+]C1 ZINC000647513931 384428136 /nfs/dbraw/zinc/42/81/36/384428136.db2.gz VFSUKTQOSUAQAF-CABCVRRESA-N 2 0 245.370 2.218 20 0 BEADRP CCC[C@H](C)[NH2+]CCC1CC[NH+](C)CC1 ZINC000122137571 384460232 /nfs/dbraw/zinc/46/02/32/384460232.db2.gz MEWBKRVDOMOSPR-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H]2CC=C(C)CC2)C1 ZINC000556816631 384503509 /nfs/dbraw/zinc/50/35/09/384503509.db2.gz FMIXTCSQHNRAQL-KGLIPLIRSA-N 2 0 222.376 2.417 20 0 BEADRP COC(C)(C)[C@H](C)[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000306054373 384513139 /nfs/dbraw/zinc/51/31/39/384513139.db2.gz XAQZVUJOQIIIHY-LBPRGKRZSA-N 2 0 242.407 2.262 20 0 BEADRP C[C@H]1C[C@@H](C[N@H+](C)C2CC(C)(C)C2)CC[NH2+]1 ZINC000334623378 384527572 /nfs/dbraw/zinc/52/75/72/384527572.db2.gz UHPKNIHBNHWLAC-RYUDHWBXSA-N 2 0 224.392 2.495 20 0 BEADRP [NH3+]CC[C@H]1CCC[N@H+](C[C@@H]2CCC(F)(F)C2)C1 ZINC000305994998 384562850 /nfs/dbraw/zinc/56/28/50/384562850.db2.gz MQKYNOGSDZFYER-VXGBXAGGSA-N 2 0 246.345 2.483 20 0 BEADRP C[NH2+][C@H]1CCN(Cc2ccc(C)c(C)c2)C1 ZINC000150058132 384556818 /nfs/dbraw/zinc/55/68/18/384556818.db2.gz MVMJMMPQCYYCPJ-AWEZNQCLSA-N 2 0 218.344 2.097 20 0 BEADRP C[NH2+]C[C@@H]1CCC[N@H+](C[C@H]2CCC(F)(F)C2)C1 ZINC000306049648 384567949 /nfs/dbraw/zinc/56/79/49/384567949.db2.gz VVGLVEWRQQBXLB-RYUDHWBXSA-N 2 0 246.345 2.353 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@@H]2CCC(F)(F)C2)C[C@@H]1C[NH3+] ZINC000306053943 384569174 /nfs/dbraw/zinc/56/91/74/384569174.db2.gz WXWNKODGXHLZMY-UTUOFQBUSA-N 2 0 246.345 2.339 20 0 BEADRP CC[C@@](C)(C[NH2+]C[C@@H]1CC[N@@H+](C(C)C)C1)OC ZINC000319894241 384573026 /nfs/dbraw/zinc/57/30/26/384573026.db2.gz PJQSRSISNFXFPI-KBPBESRZSA-N 2 0 242.407 2.121 20 0 BEADRP Cc1ccc(F)cc1C[N@@H+]1CC[C@@](C)(C[NH3+])C1 ZINC000235786326 384578344 /nfs/dbraw/zinc/57/83/44/384578344.db2.gz LQWXVXDRWPCHBV-AWEZNQCLSA-N 2 0 236.334 2.305 20 0 BEADRP c1ccc(C[NH2+]CCC[NH+]2CCCC2)cc1 ZINC000020129132 384582260 /nfs/dbraw/zinc/58/22/60/384582260.db2.gz AALQCSNILIQQBA-UHFFFAOYSA-N 2 0 218.344 2.262 20 0 BEADRP Cc1cccc(CC[NH2+][C@@H]2CCCC[C@@H]2C[NH3+])n1 ZINC000423087189 384565712 /nfs/dbraw/zinc/56/57/12/384565712.db2.gz OYTOHPRLWLQLLY-UKRRQHHQSA-N 2 0 247.386 2.040 20 0 BEADRP [NH3+]CCC1CC[NH+](CC[C@H]2CCCCO2)CC1 ZINC000564461031 384630411 /nfs/dbraw/zinc/63/04/11/384630411.db2.gz GVROHIMBFNWEOO-CQSZACIVSA-N 2 0 240.391 2.006 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCC2(F)CCC2)CC[N@@H+]1C ZINC000309808497 384635755 /nfs/dbraw/zinc/63/57/55/384635755.db2.gz SUFSYYKKHQJNID-VXGBXAGGSA-N 2 0 228.355 2.341 20 0 BEADRP C[C@H](C[N@@H+]1CC[C@H]2CC[NH2+][C@H]2C1)C(C)(C)C ZINC000647533984 384646236 /nfs/dbraw/zinc/64/62/36/384646236.db2.gz CZDJFDPZPMTZOZ-UPJWGTAASA-N 2 0 224.392 2.352 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@H]([NH3+])C1)C1CCCC1 ZINC000086404363 384646573 /nfs/dbraw/zinc/64/65/73/384646573.db2.gz SMPRYMGHYAGJJI-DRZSPHRISA-N 2 0 210.365 2.425 20 0 BEADRP C[C@@H]1CCC[C@H](C[N@@H+]2CC[C@@H]3CC[NH2+][C@H]3C2)C1 ZINC000647534540 384647057 /nfs/dbraw/zinc/64/70/57/384647057.db2.gz QDUWHPUUIDELQL-QPSCCSFWSA-N 2 0 236.403 2.497 20 0 BEADRP CC(F)(F)CC[NH2+][C@@H]1CCCC[C@H]1C[NH3+] ZINC000357716676 384682355 /nfs/dbraw/zinc/68/23/55/384682355.db2.gz OWQBZLCFGJGDKC-VHSXEESVSA-N 2 0 220.307 2.139 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H]2CC[C@H]2C2CC2)CCCCC1 ZINC000423174576 384688052 /nfs/dbraw/zinc/68/80/52/384688052.db2.gz BDCDVXBVOAMRIG-QWHCGFSZSA-N 2 0 222.376 2.426 20 0 BEADRP [NH3+]C1(C[NH2+][C@H]2CC[C@H]2C2CC2)CCCCC1 ZINC000423174577 384690476 /nfs/dbraw/zinc/69/04/76/384690476.db2.gz BDCDVXBVOAMRIG-STQMWFEESA-N 2 0 222.376 2.426 20 0 BEADRP C[N@H+](Cc1ccccc1)[C@H]1CCC[NH2+]CC1 ZINC000082666636 384701596 /nfs/dbraw/zinc/70/15/96/384701596.db2.gz YICRVFXFCKIOTE-AWEZNQCLSA-N 2 0 218.344 2.261 20 0 BEADRP CC(C)(C)CCC[N@@H+]1CC[C@@](C)(C[NH3+])C1 ZINC000300921865 384712292 /nfs/dbraw/zinc/71/22/92/384712292.db2.gz TZRQBFJFHFVKSN-ZDUSSCGKSA-N 2 0 212.381 2.483 20 0 BEADRP CCSCC[NH2+]CCC[NH+]1CCC(C)CC1 ZINC000309942824 384734342 /nfs/dbraw/zinc/73/43/42/384734342.db2.gz CFRSTJQXZNLQMT-UHFFFAOYSA-N 2 0 244.448 2.451 20 0 BEADRP CC[C@@H](C)C[NH2+]Cc1ccc(C[NH3+])cc1 ZINC000054488717 384735299 /nfs/dbraw/zinc/73/52/99/384735299.db2.gz SCJNDQOYIHXVTR-LLVKDONJSA-N 2 0 206.333 2.281 20 0 BEADRP CCSCCC[NH2+][C@H]1CCCC[C@@H]1C[NH3+] ZINC000300968116 384740741 /nfs/dbraw/zinc/74/07/41/384740741.db2.gz RNEGOWBMCJJMOR-NEPJUHHUSA-N 2 0 230.421 2.237 20 0 BEADRP C[NH+](C)CC(C)(C)C[NH2+][C@H]1CCC12CCC2 ZINC000309959998 384743279 /nfs/dbraw/zinc/74/32/79/384743279.db2.gz KPBUGWYBXSSOJL-LBPRGKRZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)[C@@H]1CC1(C)C ZINC000397596461 384756605 /nfs/dbraw/zinc/75/66/05/384756605.db2.gz KIGJCEIXIAHZAF-OBJOEFQTSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]Cc1ccc2cnccc2c1 ZINC000647552278 384756720 /nfs/dbraw/zinc/75/67/20/384756720.db2.gz ORAZQCJKKCLVJT-VXGBXAGGSA-N 2 0 243.354 2.450 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]Cc1cccc2cnccc21 ZINC000647552021 384759010 /nfs/dbraw/zinc/75/90/10/384759010.db2.gz AOADMBAAVFLLTI-NEPJUHHUSA-N 2 0 243.354 2.450 20 0 BEADRP [NH3+]C1CCC([NH2+]CC2CCC(F)CC2)CC1 ZINC000647553093 384765054 /nfs/dbraw/zinc/76/50/54/384765054.db2.gz ATBQEKNFRAQVCA-UHFFFAOYSA-N 2 0 228.355 2.374 20 0 BEADRP FC1CCC(C[NH2+][C@@H]2CCC[NH2+]CC2)CC1 ZINC000647553101 384765986 /nfs/dbraw/zinc/76/59/86/384765986.db2.gz AYZBKVNBDVNFKK-WXRRBKDZSA-N 2 0 228.355 2.246 20 0 BEADRP Cc1ccc(C[NH2+]C2CCC([NH3+])CC2)s1 ZINC000051693132 384768821 /nfs/dbraw/zinc/76/88/21/384768821.db2.gz UTHKCXIREZUHFI-UHFFFAOYSA-N 2 0 224.373 2.416 20 0 BEADRP CC[C@H](C)C[NH2+][C@H]1CC[NH2+]C12CCCC2 ZINC000647554299 384771274 /nfs/dbraw/zinc/77/12/74/384771274.db2.gz WGJANKGXQFXNNP-RYUDHWBXSA-N 2 0 210.365 2.297 20 0 BEADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H](C)C2CC2)C1 ZINC000247388219 384837414 /nfs/dbraw/zinc/83/74/14/384837414.db2.gz VKQGXOPBVUMMTB-CHWSQXEVSA-N 2 0 224.392 2.495 20 0 BEADRP CC(C)[C@H]([NH3+])CN[C@@H]1CCc2ccc(F)cc21 ZINC000423277110 384786686 /nfs/dbraw/zinc/78/66/86/384786686.db2.gz PESBIOMICRXYPN-ZIAGYGMSSA-N 2 0 236.334 2.386 20 0 BEADRP CCC1CC([NH2+][C@@H]2C[C@H](C)N(C3CC3)C2)C1 ZINC000310023788 384790288 /nfs/dbraw/zinc/79/02/88/384790288.db2.gz OLHJBMQJQDOVPN-YWPUVAFDSA-N 2 0 222.376 2.390 20 0 BEADRP CCC[NH2+]CCN[C@H]1CCc2ccc(F)cc21 ZINC000423312298 384796666 /nfs/dbraw/zinc/79/66/66/384796666.db2.gz RNAHXXCQBPVKHC-AWEZNQCLSA-N 2 0 236.334 2.402 20 0 BEADRP [NH3+]CCCC[NH2+][C@@H]1CCc2ccc(F)cc21 ZINC000423331611 384801885 /nfs/dbraw/zinc/80/18/85/384801885.db2.gz MRRMHCVWJVZOSR-CYBMUJFWSA-N 2 0 222.307 2.142 20 0 BEADRP CC1(C[NH2+][C@H]2CC[C@H]2C2CC2)CC[NH2+]CC1 ZINC000423338731 384814674 /nfs/dbraw/zinc/81/46/74/384814674.db2.gz UVFJEUWXONIARI-STQMWFEESA-N 2 0 222.376 2.154 20 0 BEADRP C1CC1[C@H]1CC[C@@H]1[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000423437613 384871480 /nfs/dbraw/zinc/87/14/80/384871480.db2.gz MLNZXOKQJQKWKO-CBBWQLFWSA-N 2 0 234.387 2.153 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000423363741 384841020 /nfs/dbraw/zinc/84/10/20/384841020.db2.gz AGXGGRYEJPPPIL-XQQFMLRXSA-N 2 0 233.359 2.311 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@@H]2CCC23CCC3)C1 ZINC000423370324 384842327 /nfs/dbraw/zinc/84/23/27/384842327.db2.gz PLJKVYRNZLYMMK-IJLUTSLNSA-N 2 0 208.349 2.179 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@@H]([NH3+])C1)c1cccc(CO)c1 ZINC000423376900 384849221 /nfs/dbraw/zinc/84/92/21/384849221.db2.gz JFWWSVNWHWOYPO-NILFDRSVSA-N 2 0 248.370 2.099 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@H]1CCc2ccc(F)cc21 ZINC000423402015 384853815 /nfs/dbraw/zinc/85/38/15/384853815.db2.gz RDLVVAVNAMTAKY-ONERCXAPSA-N 2 0 248.345 2.401 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+][C@@H]1CC[NH2+][C@H](C)C1 ZINC000423388128 384854046 /nfs/dbraw/zinc/85/40/46/384854046.db2.gz TUSPGBCJOHOJBW-NDBYEHHHSA-N 2 0 210.365 2.151 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CCOc1ccccc1 ZINC000310197320 384888922 /nfs/dbraw/zinc/88/89/22/384888922.db2.gz BCAKZLALEKXCNW-CYBMUJFWSA-N 2 0 236.359 2.173 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CCCC[C@@H]2C[NH3+])nc1C ZINC000314214877 384858785 /nfs/dbraw/zinc/85/87/85/384858785.db2.gz UAQORMYYJXKYKL-UKRRQHHQSA-N 2 0 247.386 2.306 20 0 BEADRP CC[C@@H](C)[C@@H](C[NH2+]C1CC[NH+](CC)CC1)OC ZINC000362976822 384861292 /nfs/dbraw/zinc/86/12/92/384861292.db2.gz MFJBAPFFUKWDSE-TZMCWYRMSA-N 2 0 242.407 2.121 20 0 BEADRP Cc1ccc(CNCC(C)(C)[NH3+])cc1C ZINC000258925380 384950527 /nfs/dbraw/zinc/95/05/27/384950527.db2.gz UVVICMXIKYGYSV-UHFFFAOYSA-N 2 0 206.333 2.130 20 0 BEADRP CC(C)(C[NH2+][C@H]1CCC[C@H]1[NH3+])C1CCC1 ZINC000258988127 384955516 /nfs/dbraw/zinc/95/55/16/384955516.db2.gz MKXPORWBYZOVCE-NEPJUHHUSA-N 2 0 210.365 2.282 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH2+][C@H]2CCCC2(C)C)C1 ZINC000086857121 384893444 /nfs/dbraw/zinc/89/34/44/384893444.db2.gz DTPQYFLXSWBZLC-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H](C)Cc1ccc(F)cc1 ZINC000310201243 384901722 /nfs/dbraw/zinc/90/17/22/384901722.db2.gz BWRNYTLONURTFA-NEPJUHHUSA-N 2 0 238.350 2.474 20 0 BEADRP CC[C@@H](CSC)[NH2+][C@H](C)CCCC[NH3+] ZINC000308661015 384904670 /nfs/dbraw/zinc/90/46/70/384904670.db2.gz PUCNFKKZHASZDS-MNOVXSKESA-N 2 0 218.410 2.235 20 0 BEADRP CC[C@H]([NH2+][C@@H](C)CN(C)C(C)C)[C@H]1CCOC1 ZINC000310236580 384917423 /nfs/dbraw/zinc/91/74/23/384917423.db2.gz AJENJELJLLXGHH-IHRRRGAJSA-N 2 0 242.407 2.120 20 0 BEADRP CC[C@@H](O)C[NH2+]CCCC[N@@H+]1CCCC[C@@H]1C ZINC000644522375 384926594 /nfs/dbraw/zinc/92/65/94/384926594.db2.gz QXRZLJLVOVPQAK-UONOGXRCSA-N 2 0 242.407 2.002 20 0 BEADRP c1csc(CN[C@@H]2CC[N@@H+]3CCC[C@@H]3C2)c1 ZINC000106868249 384936315 /nfs/dbraw/zinc/93/63/15/384936315.db2.gz JXMYQZUILFWILN-VXGBXAGGSA-N 2 0 236.384 2.465 20 0 BEADRP C[NH2+]CCC[N@H+](C)CCc1ccc(C)cc1 ZINC000258755097 384940362 /nfs/dbraw/zinc/94/03/62/384940362.db2.gz MMTVCNIHHFPPCZ-UHFFFAOYSA-N 2 0 220.360 2.079 20 0 BEADRP C[C@@H]1CC[C@H](C[N@@H+]2CCC[C@@H](C)[C@@H]2CC[NH3+])O1 ZINC000404274815 384965722 /nfs/dbraw/zinc/96/57/22/384965722.db2.gz AHFGYRZBYAPEPR-SYQHCUMBSA-N 2 0 240.391 2.003 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@@H]2CSC[C@H]2C)CC1 ZINC000304354305 259660591 /nfs/dbraw/zinc/66/05/91/259660591.db2.gz CWBQIOBMXGBZNN-DGCLKSJQSA-N 2 0 242.432 2.059 20 0 BEADRP Cc1cnccc1C[N@H+]1CCC[C@@H](C)[C@H]1CC[NH3+] ZINC000404265926 384967053 /nfs/dbraw/zinc/96/70/53/384967053.db2.gz HHTKPNIPEAPNGK-IUODEOHRSA-N 2 0 247.386 2.339 20 0 BEADRP CC[NH+]1CCC(NCc2cc(C)ns2)CC1 ZINC000404424835 384992274 /nfs/dbraw/zinc/99/22/74/384992274.db2.gz XSMCSELVIQJREF-UHFFFAOYSA-N 2 0 239.388 2.025 20 0 BEADRP CC1(C)[C@H]([NH3+])C[C@@H]1[NH2+]Cc1cccc(F)c1 ZINC000404779645 385055987 /nfs/dbraw/zinc/05/59/87/385055987.db2.gz MTCGITAXMBCQGA-NEPJUHHUSA-N 2 0 222.307 2.041 20 0 BEADRP Cc1ccc(F)cc1C[N@@H+]1CCC[C@@H](C[NH3+])C1 ZINC000157056798 385057104 /nfs/dbraw/zinc/05/71/04/385057104.db2.gz MCBLFAZGSCRNIM-LBPRGKRZSA-N 2 0 236.334 2.305 20 0 BEADRP CC(C)C1([NH2+][C@@H]2C[C@@H](C)N(C3CC3)C2)CC1 ZINC000340477812 385069264 /nfs/dbraw/zinc/06/92/64/385069264.db2.gz IKCDAFYKCOINQS-VXGBXAGGSA-N 2 0 222.376 2.390 20 0 BEADRP CC[C@H](C)C[N@@H+]1C[C@H](C[NH3+])[C@H](C)C[C@H]1C ZINC000397324448 385082189 /nfs/dbraw/zinc/08/21/89/385082189.db2.gz OFGFDTAYXTZXAB-LOWDOPEQSA-N 2 0 212.381 2.338 20 0 BEADRP C[C@@H]1CC[N@H+](CC[C@H]2CCCC[NH+]2C)C1 ZINC000336347244 385142535 /nfs/dbraw/zinc/14/25/35/385142535.db2.gz AXBYJNWFTCSNGK-CHWSQXEVSA-N 2 0 210.365 2.203 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@H]([NH3+])[C@@H](C)C2)c(C)c1 ZINC000227056258 385086669 /nfs/dbraw/zinc/08/66/69/385086669.db2.gz LTOCQTFKTFIULR-ZFWWWQNUSA-N 2 0 232.371 2.473 20 0 BEADRP CSC1(C[NH2+]CCC[N@H+](C)C(C)C)CC1 ZINC000308778511 385090918 /nfs/dbraw/zinc/09/09/18/385090918.db2.gz BOOVAIIPKCRFFW-UHFFFAOYSA-N 2 0 230.421 2.202 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+][C@@H]1CC[C@@H](C)C[C@H]1C ZINC000300025154 385093420 /nfs/dbraw/zinc/09/34/20/385093420.db2.gz QVSMPQDQXSQHAQ-YIYPIFLZSA-N 2 0 242.407 2.155 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CCc1ccc(O)cc1 ZINC000310504563 385097637 /nfs/dbraw/zinc/09/76/37/385097637.db2.gz IUIHUSGUQMOQSB-LBPRGKRZSA-N 2 0 236.359 2.042 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CC[N@H+](C[C@@H](C)c2ccccc2)C1 ZINC000227200532 385106318 /nfs/dbraw/zinc/10/63/18/385106318.db2.gz WAJVGTQPDLBEFU-VNHYZAJKSA-N 2 0 232.371 2.459 20 0 BEADRP Cc1cncc(CN(C)C[C@@H]2CCC[N@H+](C)C2)c1 ZINC000189898188 385196000 /nfs/dbraw/zinc/19/60/00/385196000.db2.gz JCMRABCHRDPHHH-CQSZACIVSA-N 2 0 247.386 2.164 20 0 BEADRP Cc1c[nH+]ccc1NC[C@@H]1CCC[C@H]([NH3+])C1 ZINC000227674089 385199270 /nfs/dbraw/zinc/19/92/70/385199270.db2.gz SWSHSLHFTFVLLL-NEPJUHHUSA-N 2 0 219.332 2.319 20 0 BEADRP C[C@@H](C[NH2+][C@@H](C)c1ccncc1)C[NH+]1CCCC1 ZINC000062077884 385153661 /nfs/dbraw/zinc/15/36/61/385153661.db2.gz GCOLSOMOVMLPGT-KBPBESRZSA-N 2 0 247.386 2.464 20 0 BEADRP C1CC12C[C@@H]2[NH2+][C@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000424373153 385154258 /nfs/dbraw/zinc/15/42/58/385154258.db2.gz IZVPWJXHJSGRMG-CYDGBPFRSA-N 2 0 220.360 2.049 20 0 BEADRP C[C@H](C[C@H]1CCCCC[NH2+]1)[NH2+][C@H]1CC12CC2 ZINC000424373919 385154358 /nfs/dbraw/zinc/15/43/58/385154358.db2.gz KFICGXOWJWLBKU-UPJWGTAASA-N 2 0 222.376 2.439 20 0 BEADRP C1CC12C[C@@H]2[NH2+][C@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1 ZINC000424372892 385155444 /nfs/dbraw/zinc/15/54/44/385155444.db2.gz ITYISLYWBVHBDA-CRWXNKLISA-N 2 0 234.387 2.439 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CC23CC3)[C@H]2CCC[C@H]21 ZINC000424321271 385164165 /nfs/dbraw/zinc/16/41/65/385164165.db2.gz KCMFLPRVTBXEMI-YVECIDJPSA-N 2 0 220.360 2.001 20 0 BEADRP C[C@@H](Cc1ccoc1)[NH2+]CC1CC[NH+](C)CC1 ZINC000449133533 385208981 /nfs/dbraw/zinc/20/89/81/385208981.db2.gz YUCAOPVDXKLQPM-LBPRGKRZSA-N 2 0 236.359 2.142 20 0 BEADRP CC(C)C[C@H](C)C[N@@H+]1C[C@H](C[NH3+])C[C@H]1C ZINC000300988785 385221764 /nfs/dbraw/zinc/22/17/64/385221764.db2.gz VEXJHFDRUGUPBX-XQQFMLRXSA-N 2 0 212.381 2.338 20 0 BEADRP CCC1(C[NH2+][C@@H]2CC[N@H+](C)C[C@H]2C)CCC1 ZINC000252714911 385225531 /nfs/dbraw/zinc/22/55/31/385225531.db2.gz UAHJAVIUJKEGDE-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1ccc(C[NH2+][C@@H](C)CCC[NH3+])cc1 ZINC000308896769 385249440 /nfs/dbraw/zinc/24/94/40/385249440.db2.gz ZPQYRCRLVGGQSF-LBPRGKRZSA-N 2 0 206.333 2.212 20 0 BEADRP Cc1ccc(C[NH2+][C@H](C)CCC[NH3+])cc1 ZINC000308896767 385249572 /nfs/dbraw/zinc/24/95/72/385249572.db2.gz ZPQYRCRLVGGQSF-GFCCVEGCSA-N 2 0 206.333 2.212 20 0 BEADRP Cc1ccc(C[N@H+]2C[C@@H](C[NH3+])C[C@H]2C)c(C)c1 ZINC000228065150 385324046 /nfs/dbraw/zinc/32/40/46/385324046.db2.gz GZXLNDPIBQVYBH-ZIAGYGMSSA-N 2 0 232.371 2.473 20 0 BEADRP [NH3+]C[C@@H]1CC[N@H+](Cc2ccnc3ccccc23)C1 ZINC000065461368 385313876 /nfs/dbraw/zinc/31/38/76/385313876.db2.gz OFQDAAAUSJUOQN-LBPRGKRZSA-N 2 0 241.338 2.015 20 0 BEADRP CCC[N@H+](Cc1ccc(C)nc1)C1CC[NH2+]CC1 ZINC000347106846 385271160 /nfs/dbraw/zinc/27/11/60/385271160.db2.gz NUWZLLHJMPEYLK-UHFFFAOYSA-N 2 0 247.386 2.354 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@H]([C@H](C)[NH3+])C2)cc1C ZINC000228152741 385350183 /nfs/dbraw/zinc/35/01/83/385350183.db2.gz PRCNGZXCSUWUII-ZFWWWQNUSA-N 2 0 232.371 2.473 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@@H]1CC=CCC1 ZINC000309024658 385366560 /nfs/dbraw/zinc/36/65/60/385366560.db2.gz XFMMCRRLIUQHDY-CHWSQXEVSA-N 2 0 210.365 2.450 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]Cc1cccc(F)c1 ZINC000309020443 385374063 /nfs/dbraw/zinc/37/40/63/385374063.db2.gz UGMFVKXLGQRZDJ-JTQLQIEISA-N 2 0 210.296 2.043 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CCC[N@@H+]1C)C(C)(C)C ZINC000179470089 385377109 /nfs/dbraw/zinc/37/71/09/385377109.db2.gz NUWWEYNZAVGDQA-VXGBXAGGSA-N 2 0 212.381 2.495 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]CC1C(C)(C)C1(C)C ZINC000308983241 385326011 /nfs/dbraw/zinc/32/60/11/385326011.db2.gz FSWZSISNWUEMGA-JTQLQIEISA-N 2 0 212.381 2.386 20 0 BEADRP CS[C@H](C)C[NH2+][C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000169087652 385405183 /nfs/dbraw/zinc/40/51/83/385405183.db2.gz HHIFPTUBNVWPMY-ICCXJUOJSA-N 2 0 236.384 2.472 20 0 BEADRP FCCCC[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000309215406 385484521 /nfs/dbraw/zinc/48/45/21/385484521.db2.gz FJRVQSAYLCMEHV-UPJWGTAASA-N 2 0 228.355 2.246 20 0 BEADRP CCC(CC)C[NH2+][C@H]1CC[NH2+]CC[C@H]1C ZINC000422863275 385463908 /nfs/dbraw/zinc/46/39/08/385463908.db2.gz RNXPPDVLBYQAGJ-YPMHNXCESA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+]CC[C@H](C)c1ccccc1 ZINC000309267711 385504337 /nfs/dbraw/zinc/50/43/37/385504337.db2.gz CKZSLDGNQVLIAJ-STQMWFEESA-N 2 0 220.360 2.365 20 0 BEADRP CC[C@@H](CSC)[NH2+]C1CCN(C2CC2)CC1 ZINC000309293317 385513267 /nfs/dbraw/zinc/51/32/67/385513267.db2.gz WKHZONBVUUQROV-NSHDSACASA-N 2 0 242.432 2.344 20 0 BEADRP CC[C@@H](C)[C@@H](C)[NH2+]CC1=CC[N@H+](C)CC1 ZINC000336729580 385533776 /nfs/dbraw/zinc/53/37/76/385533776.db2.gz JDKSUNLPZLSPQU-VXGBXAGGSA-N 2 0 210.365 2.273 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000319020015 385538990 /nfs/dbraw/zinc/53/89/90/385538990.db2.gz QSQKDZZZCNABLS-SRVKXCTJSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H](C)CCc1ccccc1 ZINC000309341394 385540642 /nfs/dbraw/zinc/54/06/42/385540642.db2.gz LCRHFOHXBPTHBA-CHWSQXEVSA-N 2 0 220.360 2.192 20 0 BEADRP CC[NH+](CC)CCSCCCn1ccnc1 ZINC000180437840 385522922 /nfs/dbraw/zinc/52/29/22/385522922.db2.gz FMHNNXXQQOEVEU-UHFFFAOYSA-N 2 0 241.404 2.348 20 0 BEADRP CC(C)(C)CCC[N@@H+]1C[C@@H]2CC[C@@H]([NH3+])[C@@H]2C1 ZINC000309388812 385559879 /nfs/dbraw/zinc/55/98/79/385559879.db2.gz SPOTUJVGAJGNGR-YNEHKIRRSA-N 2 0 224.392 2.482 20 0 BEADRP c1ccc(CN[C@H]2CC[N@@H+]3CCCC[C@H]23)cc1 ZINC000036996691 385594754 /nfs/dbraw/zinc/59/47/54/385594754.db2.gz MCCRATQBGIGFLN-LSDHHAIUSA-N 2 0 230.355 2.403 20 0 BEADRP C[C@]1(C[NH2+]Cc2ccsc2)CCC[NH2+]C1 ZINC000063147387 385602014 /nfs/dbraw/zinc/60/20/14/385602014.db2.gz DBVIMRLNYGLIGU-LBPRGKRZSA-N 2 0 224.373 2.227 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)[C@@H]1C ZINC000336650098 385604079 /nfs/dbraw/zinc/60/40/79/385604079.db2.gz DLMNUWGYZLETME-NMKXLXIOSA-N 2 0 222.376 2.105 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCCN(C)[C@@H]1C)[C@@H]1CC1(C)C ZINC000309458197 385590038 /nfs/dbraw/zinc/59/00/38/385590038.db2.gz OAWIODQMGZWHNT-QNWHQSFQSA-N 2 0 224.392 2.493 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H](C)Cc1ccccc1C ZINC000414848360 385615542 /nfs/dbraw/zinc/61/55/42/385615542.db2.gz WUSYOGZZOSGAHC-OCCSQVGLSA-N 2 0 234.387 2.371 20 0 BEADRP CCCC[NH+]1CCC([NH2+]C[C@H]2C[C@@H]2C)CC1 ZINC000336724477 385615768 /nfs/dbraw/zinc/61/57/68/385615768.db2.gz FJDPJSYXCFGAST-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP CCCC[C@@H](COC)[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000414848839 385618907 /nfs/dbraw/zinc/61/89/07/385618907.db2.gz XNLYTSZVYBHGFB-KBPBESRZSA-N 2 0 242.407 2.171 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H]1C[C@H](C)C[C@H](C)C1 ZINC000414850974 385646953 /nfs/dbraw/zinc/64/69/53/385646953.db2.gz ZWPSPBILWPUERV-XQHKEYJVSA-N 2 0 212.381 2.256 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+]CC(C)(C)C(C)(C)C ZINC000336652692 385647783 /nfs/dbraw/zinc/64/77/83/385647783.db2.gz DBYJYORUPFTSKB-GFCCVEGCSA-N 2 0 244.423 2.402 20 0 BEADRP C([NH2+][C@@H]1CCC12CCC2)[C@H]1CC[N@@H+](C2CC2)C1 ZINC000337399693 385648508 /nfs/dbraw/zinc/64/85/08/385648508.db2.gz PEZLIFTZOIISPA-TZMCWYRMSA-N 2 0 234.387 2.393 20 0 BEADRP C[C@@H]([NH2+]Cc1ccc(F)cc1)[C@H]1CCC[NH2+]C1 ZINC000414851880 385659361 /nfs/dbraw/zinc/65/93/61/385659361.db2.gz JLVWGJCBTSYUPH-YPMHNXCESA-N 2 0 236.334 2.303 20 0 BEADRP CCS[C@@H]1CCCC[N@H+](CCC[NH2+]C)C1 ZINC000309540729 385673762 /nfs/dbraw/zinc/67/37/62/385673762.db2.gz YFCLINMSDPHISE-GFCCVEGCSA-N 2 0 230.421 2.204 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)o1 ZINC000647792826 385696109 /nfs/dbraw/zinc/69/61/09/385696109.db2.gz AEXKJEUXUPRZQN-HZSPNIEDSA-N 2 0 248.370 2.108 20 0 BEADRP Cc1csc(C[NH2+]CCC[C@H]2CCC[NH2+]2)n1 ZINC000336686143 385698059 /nfs/dbraw/zinc/69/80/59/385698059.db2.gz UMXGIPUPCODKIT-NSHDSACASA-N 2 0 239.388 2.073 20 0 BEADRP CC[C@@H]([NH2+]C[C@H](C)C[NH3+])c1ccc(OC)cc1 ZINC000336691920 385729687 /nfs/dbraw/zinc/72/96/87/385729687.db2.gz HPPLNZMQDDLCJW-BXUZGUMPSA-N 2 0 236.359 2.331 20 0 BEADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+]C[C@H]2C[C@H]2C)C1 ZINC000336691814 385729915 /nfs/dbraw/zinc/72/99/15/385729915.db2.gz WYZJPLUFHVWFMT-MGPQQGTHSA-N 2 0 224.392 2.352 20 0 BEADRP [NH3+]C1(C[NH2+]CC[C@@H]2CCOC2)CCCCCC1 ZINC000414857435 385729960 /nfs/dbraw/zinc/72/99/60/385729960.db2.gz DGRVXPWPUNWKFF-CYBMUJFWSA-N 2 0 240.391 2.054 20 0 BEADRP C([NH2+]C1CCCC1)C1CC[NH+](C2CC2)CC1 ZINC000336693325 385738143 /nfs/dbraw/zinc/73/81/43/385738143.db2.gz XTULOWZUQWJVLY-UHFFFAOYSA-N 2 0 222.376 2.393 20 0 BEADRP C[C@H]([NH2+]Cc1ccsc1)[C@H]1CCC[NH2+]C1 ZINC000414859854 385738079 /nfs/dbraw/zinc/73/80/79/385738079.db2.gz UTNREXLVBZHBCP-JQWIXIFHSA-N 2 0 224.373 2.226 20 0 BEADRP CC[N@H+](CCn1ccnc1C)CC(C)C ZINC000270789398 385744785 /nfs/dbraw/zinc/74/47/85/385744785.db2.gz CDCMIIVQMPUKSF-UHFFFAOYSA-N 2 0 209.337 2.169 20 0 BEADRP C[C@H]([NH2+]Cc1cccc(F)c1)[C@@H]1CCC[NH2+]C1 ZINC000414861246 385745658 /nfs/dbraw/zinc/74/56/58/385745658.db2.gz WHSBEKGGAVUHRU-WCQYABFASA-N 2 0 236.334 2.303 20 0 BEADRP C[NH2+]CCC[NH2+]C[C@@H](C)Cc1ccccc1 ZINC000414862057 385749005 /nfs/dbraw/zinc/74/90/05/385749005.db2.gz UMOYOZIBICCJSV-ZDUSSCGKSA-N 2 0 220.360 2.064 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H](C)CCCC(F)(F)F ZINC000414863075 385755505 /nfs/dbraw/zinc/75/55/05/385755505.db2.gz WRVDNELMRYJKSF-VIFPVBQESA-N 2 0 226.286 2.307 20 0 BEADRP CC[NH2+]Cc1cccc(N[C@@H]2CCC[NH2+]CC2)c1 ZINC000414863242 385760291 /nfs/dbraw/zinc/76/02/91/385760291.db2.gz IJRBQQPZXHQNBX-CQSZACIVSA-N 2 0 247.386 2.350 20 0 BEADRP c1ccc([C@@H]2C[C@H]2C[NH2+]C[C@H]2CCC[NH2+]C2)cc1 ZINC000414864520 385763788 /nfs/dbraw/zinc/76/37/88/385763788.db2.gz YROFYAIFYRMXCU-BPUTZDHNSA-N 2 0 244.382 2.379 20 0 BEADRP C([NH2+][C@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)[C@@H]1C[C@H]1C1CC1 ZINC000647800015 385802563 /nfs/dbraw/zinc/80/25/63/385802563.db2.gz XEYUXKQAFZGIMV-QTVXIADOSA-N 2 0 234.387 2.010 20 0 BEADRP C[C@@H]1C[C@H]1C[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000336740523 385803599 /nfs/dbraw/zinc/80/35/99/385803599.db2.gz MIDNCOFZYYCSCA-KBHBFKLGSA-N 2 0 222.376 2.249 20 0 BEADRP C1[C@@H]([NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)[C@@H]1C1CCC1 ZINC000647799702 385803757 /nfs/dbraw/zinc/80/37/57/385803757.db2.gz OLNOFDBQVWFPLR-QKGCVVFFSA-N 2 0 234.387 2.153 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@@H]1CCC[C@@H]1C1CC1 ZINC000414947835 385805933 /nfs/dbraw/zinc/80/59/33/385805933.db2.gz XDYATMKOHDZYRA-RUZUBIRVSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@H]1CCC[C@@H]1C1CC1 ZINC000414947838 385806072 /nfs/dbraw/zinc/80/60/72/385806072.db2.gz XDYATMKOHDZYRA-ZZVYKPCYSA-N 2 0 222.376 2.153 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]C[C@H]1C[C@@H]1c1ccccc1 ZINC000647800413 385806498 /nfs/dbraw/zinc/80/64/98/385806498.db2.gz AVTYFZJRPLYGSL-KBUPBQIOSA-N 2 0 230.355 2.260 20 0 BEADRP C[C@@H]([NH2+]C[C@@H](C)CC(F)F)[C@@H]1CCCC[NH2+]1 ZINC000647800556 385807413 /nfs/dbraw/zinc/80/74/13/385807413.db2.gz FGYWEMBRTHSLFL-AXFHLTTASA-N 2 0 234.334 2.398 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]C[C@H]1CC2CCC1CC2 ZINC000647801084 385808556 /nfs/dbraw/zinc/80/85/56/385808556.db2.gz NWIYROLOKZFFRV-YTPFDHIKSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)CC(F)F ZINC000647800715 385809525 /nfs/dbraw/zinc/80/95/25/385809525.db2.gz JJESZKLCHVRUBQ-NNYUYHANSA-N 2 0 246.345 2.255 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CC2CCC1CC2 ZINC000647801083 385810024 /nfs/dbraw/zinc/81/00/24/385810024.db2.gz NWIYROLOKZFFRV-YAWVXEGQSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)CC(F)F ZINC000647800716 385810397 /nfs/dbraw/zinc/81/03/97/385810397.db2.gz JJESZKLCHVRUBQ-WHOHXGKFSA-N 2 0 246.345 2.255 20 0 BEADRP CC1(C)CCC[C@@H](C[NH2+][C@H]2CC[NH2+]C2)C1 ZINC000414867660 385811019 /nfs/dbraw/zinc/81/10/19/385811019.db2.gz GVNXBNQYBSBIRC-NEPJUHHUSA-N 2 0 210.365 2.154 20 0 BEADRP Cc1cc(Cl)ccc1C[NH2+]C[C@@H](C)C[NH3+] ZINC000414871631 385857255 /nfs/dbraw/zinc/85/72/55/385857255.db2.gz DQUBJKREFAFGFN-VIFPVBQESA-N 2 0 226.751 2.333 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CCCC[C@@H]2C)CC[NH2+]1 ZINC000414954539 385829835 /nfs/dbraw/zinc/82/98/35/385829835.db2.gz SQSCZDJTWXXKFS-LOWDOPEQSA-N 2 0 210.365 2.295 20 0 BEADRP C[NH2+]Cc1cccc(NC2CCC(C[NH3+])CC2)c1 ZINC000414869443 385832669 /nfs/dbraw/zinc/83/26/69/385832669.db2.gz QSQYVRDSYMFJQG-UHFFFAOYSA-N 2 0 247.386 2.335 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+][C@@H]1CC[NH2+][C@H](C)C1 ZINC000414955469 385837136 /nfs/dbraw/zinc/83/71/36/385837136.db2.gz UHYKELUTEWLRJY-OPRDCNLKSA-N 2 0 238.297 2.448 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H]1C[C@@H](c2ccccc2)[C@H]1C ZINC000414869624 385838317 /nfs/dbraw/zinc/83/83/17/385838317.db2.gz AYVDMCVRONKYEU-QHSBEEBCSA-N 2 0 232.371 2.363 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]CC1CCC(F)CC1 ZINC000647804641 385838999 /nfs/dbraw/zinc/83/89/99/385838999.db2.gz WHYGTOXMOPHGRS-RYSNWHEDSA-N 2 0 242.382 2.492 20 0 BEADRP CC[C@H]([NH2+][C@H]1CCS[C@H]1C)[C@@H]1CCC[NH2+]1 ZINC000647804566 385840363 /nfs/dbraw/zinc/84/03/63/385840363.db2.gz UZQRBUMVNPNLTJ-BJDJZHNGSA-N 2 0 228.405 2.001 20 0 BEADRP CC(C)CC[N@@H+]1C[C@@H]2CCC[C@@H]([NH3+])[C@@H]2C1 ZINC000228475162 385841324 /nfs/dbraw/zinc/84/13/24/385841324.db2.gz NUCLYPABRYEUJQ-YNEHKIRRSA-N 2 0 210.365 2.092 20 0 BEADRP C[C@H](CCc1ccc(F)cc1)[NH2+]C[C@@H](C)C[NH3+] ZINC000414869838 385841619 /nfs/dbraw/zinc/84/16/19/385841619.db2.gz BHNHYHFEAUOYHZ-NWDGAFQWSA-N 2 0 238.350 2.331 20 0 BEADRP CC[C@H](Cc1ccccc1)[NH2+]C[C@@H](C)C[NH3+] ZINC000414870687 385848952 /nfs/dbraw/zinc/84/89/52/385848952.db2.gz CDUSHZDIAVOZLV-GXTWGEPZSA-N 2 0 220.360 2.192 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H](C)[C@@]1(C)CCCO1 ZINC000340462344 385850575 /nfs/dbraw/zinc/85/05/75/385850575.db2.gz LTNNGYLZHGSPQM-UONOGXRCSA-N 2 0 242.407 2.266 20 0 BEADRP CCC[C@H](C[N@H+](C)[C@@H]1CCN(C)[C@H](C)C1)OC ZINC000638115763 385851448 /nfs/dbraw/zinc/85/14/48/385851448.db2.gz FYYOFSZPRHDMAM-MGPQQGTHSA-N 2 0 242.407 2.216 20 0 BEADRP CC(C)C1([NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)CC1 ZINC000647797902 385792051 /nfs/dbraw/zinc/79/20/51/385792051.db2.gz GUPGWCKHNOLXIU-FRRDWIJNSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H](CCc1ccsc1)N[C@@H]1CC[NH2+]C1 ZINC000414867137 385792331 /nfs/dbraw/zinc/79/23/31/385792331.db2.gz GFBNJYDXTFQBJO-ZYHUDNBSSA-N 2 0 224.373 2.021 20 0 BEADRP CC[C@@H](C)C[NH2+]CC1(SC)CC[NH+](C)CC1 ZINC000309690862 385795556 /nfs/dbraw/zinc/79/55/56/385795556.db2.gz JEVZYVKUEGYSEW-GFCCVEGCSA-N 2 0 244.448 2.450 20 0 BEADRP C[NH2+]Cc1cccc(NC[C@@H]2CC[NH2+][C@@H](C)C2)c1 ZINC000414874248 385883869 /nfs/dbraw/zinc/88/38/69/385883869.db2.gz YYFINYGUDQCIHT-GXTWGEPZSA-N 2 0 247.386 2.206 20 0 BEADRP C[NH2+]Cc1cccc(NC[C@H]2CC[NH2+][C@@H](C)C2)c1 ZINC000414874710 385884898 /nfs/dbraw/zinc/88/48/98/385884898.db2.gz YYFINYGUDQCIHT-JSGCOSHPSA-N 2 0 247.386 2.206 20 0 BEADRP CC(C)c1ncc(C[NH2+][C@H](C)CC[NH3+])s1 ZINC000414877972 385928546 /nfs/dbraw/zinc/92/85/46/385928546.db2.gz GRBFKXGNYBNENF-SECBINFHSA-N 2 0 227.377 2.093 20 0 BEADRP CC[C@@H](COC)[NH2+]CCCCC[NH+]1CCCC1 ZINC000340476549 385886241 /nfs/dbraw/zinc/88/62/41/385886241.db2.gz RZSPDQBGXYBFKT-AWEZNQCLSA-N 2 0 242.407 2.267 20 0 BEADRP C[C@@H]([NH3+])c1ccc(NC(=O)CCC(C)(C)[NH3+])cc1 ZINC000647840232 385886738 /nfs/dbraw/zinc/88/67/38/385886738.db2.gz WIPMSPBTKNYFAN-SNVBAGLBSA-N 2 0 249.358 2.162 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@H]1C[C@H](C)C[C@H](C)C1 ZINC000414962901 385887187 /nfs/dbraw/zinc/88/71/87/385887187.db2.gz SUMOAJJIMCUDMP-XQHKEYJVSA-N 2 0 212.381 2.399 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+]C[C@H]1CCCC[C@@H]1C ZINC000414965885 385913730 /nfs/dbraw/zinc/91/37/30/385913730.db2.gz WCGHEKWELNWDMR-YNEHKIRRSA-N 2 0 212.381 2.400 20 0 BEADRP CCCC[C@@H](COC)[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000414965226 385914361 /nfs/dbraw/zinc/91/43/61/385914361.db2.gz NJOJKVSXGCMGIT-KBPBESRZSA-N 2 0 242.407 2.313 20 0 BEADRP COc1ccccc1/C=C/C[NH2+][C@@H](C)CC[NH3+] ZINC000414877065 385917458 /nfs/dbraw/zinc/91/74/58/385917458.db2.gz FKRQKCPABNRZCE-PZBABLGHSA-N 2 0 234.343 2.035 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H]2CCC[C@H](C3CC3)C2)CCC1 ZINC000414871921 385860389 /nfs/dbraw/zinc/86/03/89/385860389.db2.gz DSIBWLATJSEGCN-QWHCGFSZSA-N 2 0 222.376 2.426 20 0 BEADRP CCOC[C@H](C)[NH2+]CCCCC[NH+]1CCCC1 ZINC000340472453 385867089 /nfs/dbraw/zinc/86/70/89/385867089.db2.gz BBWQYRYYXMELNB-AWEZNQCLSA-N 2 0 242.407 2.267 20 0 BEADRP CC(C)c1ncc(C[NH2+][C@@H](C)CC[NH3+])s1 ZINC000414877974 385927894 /nfs/dbraw/zinc/92/78/94/385927894.db2.gz GRBFKXGNYBNENF-VIFPVBQESA-N 2 0 227.377 2.093 20 0 BEADRP C[C@@H](C[NH2+]CC1([NH3+])CCC1)Cc1ccccc1 ZINC000414874054 385879356 /nfs/dbraw/zinc/87/93/56/385879356.db2.gz HXIZVWGGZRZZFF-CYBMUJFWSA-N 2 0 232.371 2.336 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]Cc1ccsc1 ZINC000335037577 385928469 /nfs/dbraw/zinc/92/84/69/385928469.db2.gz FDLJJAVYSOIFOF-PWSUYJOCSA-N 2 0 224.373 2.226 20 0 BEADRP C[C@H](CC1CC1)[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000414971587 385976263 /nfs/dbraw/zinc/97/62/63/385976263.db2.gz WOULUPOHZOGCEQ-DGCLKSJQSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCCc2ccc(F)cc21)C1C[NH2+]C1 ZINC000335023575 385984257 /nfs/dbraw/zinc/98/42/57/385984257.db2.gz SBAYCGWWGDDVEJ-BMIGLBTASA-N 2 0 248.345 2.401 20 0 BEADRP C[NH+](C)CCC[NH2+][C@H]1CCCC12CCC2 ZINC000394728177 385938384 /nfs/dbraw/zinc/93/83/84/385938384.db2.gz JONNEDMAAFDSMT-LBPRGKRZSA-N 2 0 210.365 2.251 20 0 BEADRP CC1(C[NH2+][C@H]2CCC[C@H]2[NH3+])Cc2ccccc2C1 ZINC000335044212 385939260 /nfs/dbraw/zinc/93/92/60/385939260.db2.gz XSERYUWLPRWJBH-CABCVRRESA-N 2 0 244.382 2.261 20 0 BEADRP C[C@H](CCc1ccccc1)[NH2+]CC1([NH3+])CCC1 ZINC000342146418 385945306 /nfs/dbraw/zinc/94/53/06/385945306.db2.gz SVCZIAPPSQIGFO-CYBMUJFWSA-N 2 0 232.371 2.479 20 0 BEADRP C[C@H](CC[NH3+])[NH2+]Cc1ccccc1OCC1CC1 ZINC000414879367 385950815 /nfs/dbraw/zinc/95/08/15/385950815.db2.gz IMPCGLHCFGSUIP-GFCCVEGCSA-N 2 0 248.370 2.302 20 0 BEADRP CC(C)[C@@H]1CCC[C@H]1[NH2+]CC1([NH3+])CCC1 ZINC000414880034 385958085 /nfs/dbraw/zinc/95/80/85/385958085.db2.gz QJEBWVIKTQTKDN-NWDGAFQWSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]C[C@H]1CCCCS1 ZINC000251283017 385960544 /nfs/dbraw/zinc/96/05/44/385960544.db2.gz MXKZNYGZJMQMJP-XQQFMLRXSA-N 2 0 242.432 2.379 20 0 BEADRP Cc1cc(C[NH2+]C[C@@H](C)C[NH3+])cc2cccnc12 ZINC000414879970 385961453 /nfs/dbraw/zinc/96/14/53/385961453.db2.gz QCJAHYLHJFRDFN-NSHDSACASA-N 2 0 243.354 2.228 20 0 BEADRP c1ccc2c(c1)CC([NH2+]CCC[C@@H]1CCC[NH2+]1)C2 ZINC000414970861 385967755 /nfs/dbraw/zinc/96/77/55/385967755.db2.gz KUUNYTBLVLFATA-HNNXBMFYSA-N 2 0 244.382 2.276 20 0 BEADRP CC(C)CCOCC[NH+]1CCC([C@@H](C)[NH3+])CC1 ZINC000111612396 385969089 /nfs/dbraw/zinc/96/90/89/385969089.db2.gz BRRUKPUGKYUNKN-CYBMUJFWSA-N 2 0 242.407 2.108 20 0 BEADRP Fc1ccccc1C[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000414971489 385973376 /nfs/dbraw/zinc/97/33/76/385973376.db2.gz LKFVZSVSOHKAAE-ZDUSSCGKSA-N 2 0 236.334 2.448 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCC[C@@H]1C1CC1)C[NH+](C)C ZINC000336749619 385997635 /nfs/dbraw/zinc/99/76/35/385997635.db2.gz UIGXOOCJHJODND-BNOWGMLFSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@@H](C)[C@H]1CC1(C)C ZINC000336750027 386000987 /nfs/dbraw/zinc/00/09/87/386000987.db2.gz FLQMZZWGRZRXFX-GRYCIOLGSA-N 2 0 212.381 2.351 20 0 BEADRP CCN1CCCC[C@@H]1C[NH2+][C@H](C)[C@@H]1C[C@H]1C ZINC000414111670 386006452 /nfs/dbraw/zinc/00/64/52/386006452.db2.gz JDHQPLQNDFNEKP-AAVRWANBSA-N 2 0 224.392 2.495 20 0 BEADRP C[NH2+]Cc1ccc(NC[C@H]([NH3+])CC(C)C)cc1 ZINC000414975209 386010434 /nfs/dbraw/zinc/01/04/34/386010434.db2.gz LLTYBPNTCWITQP-CYBMUJFWSA-N 2 0 235.375 2.191 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H]1C[C@@H](C)CC(C)(C)C1 ZINC000414882309 386012803 /nfs/dbraw/zinc/01/28/03/386012803.db2.gz UABUVFZZEQUROJ-UTUOFQBUSA-N 2 0 212.381 2.386 20 0 BEADRP C[C@@H](CCc1ccsc1)[NH2+]CCC[NH3+] ZINC000336751966 386013378 /nfs/dbraw/zinc/01/33/78/386013378.db2.gz GTTKYJOCICZSBW-JTQLQIEISA-N 2 0 212.362 2.008 20 0 BEADRP C[C@H](Cc1ccc(F)cc1)[NH2+]C[C@@H]([NH3+])C1CC1 ZINC000414882590 386017310 /nfs/dbraw/zinc/01/73/10/386017310.db2.gz BYFXOBCWTBOLKS-QMTHXVAHSA-N 2 0 236.334 2.084 20 0 BEADRP C[C@@H]([NH2+]Cc1ccc2c[nH+]cn2c1)[C@@H]1C[C@H]1C ZINC000414180584 386023356 /nfs/dbraw/zinc/02/33/56/386023356.db2.gz LFGVWTFHLQPVNK-JTNHKYCSSA-N 2 0 229.327 2.468 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)c1cccnc1 ZINC000414185507 386024619 /nfs/dbraw/zinc/02/46/19/386024619.db2.gz OTDAYPUSAYMWGX-ZIAGYGMSSA-N 2 0 247.386 2.464 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCCc2sccc21)C1C[NH2+]C1 ZINC000335062196 386029982 /nfs/dbraw/zinc/02/99/82/386029982.db2.gz YUVAADFOVVIXOG-SKDRFNHKSA-N 2 0 236.384 2.323 20 0 BEADRP COCc1cccc(C[NH2+][C@@H]2CCC[NH2+]CC2)c1 ZINC000129158207 386034209 /nfs/dbraw/zinc/03/42/09/386034209.db2.gz QOODTTGJSIOZBA-OAHLLOKOSA-N 2 0 248.370 2.065 20 0 BEADRP C[C@H](CCc1ccccc1)[NH2+]C[C@H]([NH3+])C1CC1 ZINC000414883823 386036274 /nfs/dbraw/zinc/03/62/74/386036274.db2.gz DQDWMGNMBRUZMM-DOMZBBRYSA-N 2 0 232.371 2.335 20 0 BEADRP CN(c1ccccn1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000286443522 386037057 /nfs/dbraw/zinc/03/70/57/386037057.db2.gz RNFDFCQSXOMMOK-FUNVUKJBSA-N 2 0 231.343 2.143 20 0 BEADRP COC(C)(C)[C@H](C)[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000414200218 386038644 /nfs/dbraw/zinc/03/86/44/386038644.db2.gz ZMBWKGDULZXCGS-NSHDSACASA-N 2 0 247.342 2.237 20 0 BEADRP C[C@H](C[NH2+]CC1([NH3+])CCC1)c1ccc(F)cc1 ZINC000414884615 386041346 /nfs/dbraw/zinc/04/13/46/386041346.db2.gz VYPXWAGTOGTJEU-LLVKDONJSA-N 2 0 236.334 2.400 20 0 BEADRP C[NH2+]Cc1ccc(NC[C@H]2CC[NH2+][C@H](C)C2)cc1 ZINC000414979043 386048892 /nfs/dbraw/zinc/04/88/92/386048892.db2.gz TUZNTUAVZIQGJD-OCCSQVGLSA-N 2 0 247.386 2.206 20 0 BEADRP C[C@H](C[NH2+][C@@H](C)CC[NH3+])Cc1ccccc1 ZINC000414884849 386049414 /nfs/dbraw/zinc/04/94/14/386049414.db2.gz BKLDOASYPOKCKL-STQMWFEESA-N 2 0 220.360 2.192 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@H]2CC3CCC2CC3)C1 ZINC000309520710 386051029 /nfs/dbraw/zinc/05/10/29/386051029.db2.gz UBCXZFNSVIPCGJ-YAWVXEGQSA-N 2 0 222.376 2.425 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCC[C@@H]1C1CC1)C[NH+](C)C ZINC000336749621 385996863 /nfs/dbraw/zinc/99/68/63/385996863.db2.gz UIGXOOCJHJODND-MRVWCRGKSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H](CC[NH3+])[NH2+]Cc1ccc(C2CC2)cc1 ZINC000414889190 386112485 /nfs/dbraw/zinc/11/24/85/386112485.db2.gz GAHRPVHLBNCDJA-NSHDSACASA-N 2 0 218.344 2.391 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@H]1CCC[C@H](C2CC2)C1 ZINC000414986712 386113094 /nfs/dbraw/zinc/11/30/94/386113094.db2.gz YCQPCAQVNAKKKY-AVGNSLFASA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]1CC([NH2+]C[C@@H]([NH3+])C2CC2)C[C@H](C)C1 ZINC000414885955 386066486 /nfs/dbraw/zinc/06/64/86/386066486.db2.gz GXFAIWMVYLXHAM-GIPNMCIBSA-N 2 0 210.365 2.138 20 0 BEADRP C[NH+](C)[C@@H]1CCC[N@H+](CCOC(C)(C)C)CC1 ZINC000365382121 386071808 /nfs/dbraw/zinc/07/18/08/386071808.db2.gz WJBNXTBYDMREMJ-CYBMUJFWSA-N 2 0 242.407 2.218 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@H]2CC2(C)C)[C@H]2CCC[C@H]21 ZINC000414217394 386073816 /nfs/dbraw/zinc/07/38/16/386073816.db2.gz CCSCJFYWAXFXHA-XQHKEYJVSA-N 2 0 222.376 2.247 20 0 BEADRP CC[C@H]([NH3+])CNCc1cccc(OC(C)C)c1 ZINC000414987922 386122423 /nfs/dbraw/zinc/12/24/23/386122423.db2.gz ZLLWUSDJCKDHNE-ZDUSSCGKSA-N 2 0 236.359 2.301 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H]2CS[C@H](C)C2)[C@H](C)C1 ZINC000414228073 386077612 /nfs/dbraw/zinc/07/76/12/386077612.db2.gz LKFNRXSAYISUGH-NDBYEHHHSA-N 2 0 242.432 2.200 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H](C)[C@@H](C)c1ccccc1 ZINC000414887751 386094671 /nfs/dbraw/zinc/09/46/71/386094671.db2.gz ZKEHWASEYRQDAF-UPJWGTAASA-N 2 0 220.360 2.363 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H](C)[C@H](C)c1ccccc1 ZINC000414887749 386095044 /nfs/dbraw/zinc/09/50/44/386095044.db2.gz ZKEHWASEYRQDAF-FRRDWIJNSA-N 2 0 220.360 2.363 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+]C1CCC2(CCOCC2)CC1 ZINC000414986150 386100611 /nfs/dbraw/zinc/10/06/11/386100611.db2.gz XKHIHKWDSVWOFT-GFCCVEGCSA-N 2 0 240.391 2.053 20 0 BEADRP C[C@H](CC[NH3+])[NH2+]Cc1cc(F)cc2cccnc21 ZINC000414892179 386147700 /nfs/dbraw/zinc/14/77/00/386147700.db2.gz WTIOVFDSICSBLU-SNVBAGLBSA-N 2 0 247.317 2.201 20 0 BEADRP C[C@@H](CCc1ccsc1)[NH2+]C[C@@H]([NH3+])C1CC1 ZINC000414891864 386147800 /nfs/dbraw/zinc/14/78/00/386147800.db2.gz OTDSKJMVJCQRJE-GXFFZTMASA-N 2 0 238.400 2.396 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[C@H]([NH3+])C1)C1CCC1 ZINC000414991373 386154666 /nfs/dbraw/zinc/15/46/66/386154666.db2.gz BBPJVLLZIWIYNY-GVXVVHGQSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+][C@H](C[NH2+][C@H]1CCC[C@H](C2CC2)C1)C1CC1 ZINC000414894272 386170289 /nfs/dbraw/zinc/17/02/89/386170289.db2.gz SQKBGUBKUWLBFS-MELADBBJSA-N 2 0 222.376 2.282 20 0 BEADRP [NH3+][C@H](C[NH2+][C@@H]1CCCC[C@@H]1C1CC1)C1CC1 ZINC000414894263 386170568 /nfs/dbraw/zinc/17/05/68/386170568.db2.gz SQJSBYRHXKTXDW-MGPQQGTHSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@H](CCCC(F)(F)F)[NH2+]C[C@H]([NH3+])C1CC1 ZINC000414895254 386182931 /nfs/dbraw/zinc/18/29/31/386182931.db2.gz WKBXEVRWQMWLJB-SCZZXKLOSA-N 2 0 238.297 2.434 20 0 BEADRP CC(C)N(C)C[C@@H](C)[NH2+][C@@H]1CCOC(C)(C)C1 ZINC000310429083 386184514 /nfs/dbraw/zinc/18/45/14/386184514.db2.gz MSKQCNUTWGXNMQ-CHWSQXEVSA-N 2 0 242.407 2.262 20 0 BEADRP CO[C@H](C)C[N@H+](C[C@H]([NH3+])CC(C)C)C(C)C ZINC000414691393 386188250 /nfs/dbraw/zinc/18/82/50/386188250.db2.gz BOJXCHARHXUBSJ-CHWSQXEVSA-N 2 0 230.396 2.105 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+][C@@H]1C[C@H]1c1ccco1 ZINC000414328832 386124995 /nfs/dbraw/zinc/12/49/95/386124995.db2.gz CTMJQMQISORYRZ-DHGKCCLASA-N 2 0 248.370 2.454 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+][C@@H]2C[C@H]2c2ccco2)[C@@H](C)C1 ZINC000414335091 386128003 /nfs/dbraw/zinc/12/80/03/386128003.db2.gz IZMKKGFLGZRAAZ-REWJHTLYSA-N 2 0 248.370 2.455 20 0 BEADRP [NH3+][C@H]1CCN(Cc2csc3ccccc23)C1 ZINC000054465537 386127971 /nfs/dbraw/zinc/12/79/71/386127971.db2.gz PSDUHOQYEJOABO-NSHDSACASA-N 2 0 232.352 2.434 20 0 BEADRP [NH3+][C@@H]1CCN(Cc2csc3ccccc23)C1 ZINC000054465539 386128239 /nfs/dbraw/zinc/12/82/39/386128239.db2.gz PSDUHOQYEJOABO-LLVKDONJSA-N 2 0 232.352 2.434 20 0 BEADRP C[C@@H](c1ccc(F)cc1)[N@H+](C)C[C@H]1CC[NH2+]C1 ZINC000647874409 386134998 /nfs/dbraw/zinc/13/49/98/386134998.db2.gz RZFCFJDUKODIBQ-RYUDHWBXSA-N 2 0 236.334 2.428 20 0 BEADRP CO[C@H](C)C[N@H+](C[C@@H]([NH3+])CC(C)C)C(C)C ZINC000414691394 386189324 /nfs/dbraw/zinc/18/93/24/386189324.db2.gz BOJXCHARHXUBSJ-OLZOCXBDSA-N 2 0 230.396 2.105 20 0 BEADRP COc1ccc([C@@H](C)C[NH2+]CCCC[NH3+])cc1 ZINC000414896845 386210001 /nfs/dbraw/zinc/21/00/01/386210001.db2.gz AISXQTIUAHLYHA-LBPRGKRZSA-N 2 0 236.359 2.127 20 0 BEADRP C[C@H](c1ccccn1)[N@H+](C)C[C@H]1CC[NH2+][C@H](C)C1 ZINC000414702603 386211559 /nfs/dbraw/zinc/21/15/59/386211559.db2.gz ICUZAHJLTBWGLW-MCIONIFRSA-N 2 0 247.386 2.463 20 0 BEADRP C[C@]1(c2ccccc2)CCC[N@H+](CCC[NH3+])C1 ZINC000414704707 386213464 /nfs/dbraw/zinc/21/34/64/386213464.db2.gz WJZYKWIDHIXNDL-HNNXBMFYSA-N 2 0 232.371 2.389 20 0 BEADRP C[C@@]1(c2ccccc2)CCC[N@H+](CCC[NH3+])C1 ZINC000414704709 386213810 /nfs/dbraw/zinc/21/38/10/386213810.db2.gz WJZYKWIDHIXNDL-OAHLLOKOSA-N 2 0 232.371 2.389 20 0 BEADRP C[C@H]1C[C@@H](c2ccc(F)cc2)C[N@@H+]1CCC[NH3+] ZINC000414707115 386216365 /nfs/dbraw/zinc/21/63/65/386216365.db2.gz PBKJOHPPOVUFOY-WCQYABFASA-N 2 0 236.334 2.352 20 0 BEADRP [NH3+][C@H](CNCc1cc2cc(F)ccc2o1)C1CC1 ZINC000414897299 386216591 /nfs/dbraw/zinc/21/65/91/386216591.db2.gz RCYLTERYJJZQFW-CYBMUJFWSA-N 2 0 248.301 2.399 20 0 BEADRP c1ccc2c(c1)CC[C@@H]2[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000132016171 386219212 /nfs/dbraw/zinc/21/92/12/386219212.db2.gz PENMQFUCTYRLGJ-WFASDCNBSA-N 2 0 230.355 2.263 20 0 BEADRP CC[C@H](C[N@@H+]1CC[C@H](C[NH3+])C1)c1ccccc1 ZINC000347028712 386220622 /nfs/dbraw/zinc/22/06/22/386220622.db2.gz VWDBSXWWFHBUOT-ZIAGYGMSSA-N 2 0 232.371 2.461 20 0 BEADRP CCC(O)(CC)C[NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000132147477 386221740 /nfs/dbraw/zinc/22/17/40/386221740.db2.gz WVNRRMKMQACGDR-KGLIPLIRSA-N 2 0 248.370 2.272 20 0 BEADRP [NH3+]CCC[N@@H+]1CC[C@H](Cc2ccc(F)cc2)C1 ZINC000414708640 386225696 /nfs/dbraw/zinc/22/56/96/386225696.db2.gz QGSPBAKFTQZRJI-CYBMUJFWSA-N 2 0 236.334 2.039 20 0 BEADRP CCc1ccccc1C[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000132271109 386228792 /nfs/dbraw/zinc/22/87/92/386228792.db2.gz QQVHXKFVJXLRRR-CYBMUJFWSA-N 2 0 232.371 2.338 20 0 BEADRP CCN1C[C@H](C)[C@H]([NH2+][C@@H](C)CC(C)(C)OC)C1 ZINC000347141902 386260398 /nfs/dbraw/zinc/26/03/98/386260398.db2.gz HXKPWOLKDLYGLD-RWMBFGLXSA-N 2 0 242.407 2.120 20 0 BEADRP CC(C)(C)C[C@H]1CCC[N@@H+]1C[C@@H]1CC[NH2+]C1 ZINC000647882632 386234456 /nfs/dbraw/zinc/23/44/56/386234456.db2.gz HSGABDGIDCGDKI-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)(C)C[C@H]1CCC[N@@H+]1C[C@H]1CC[NH2+]C1 ZINC000647882634 386234625 /nfs/dbraw/zinc/23/46/25/386234625.db2.gz HSGABDGIDCGDKI-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP CCSCC[N@H+](C)[C@H]1CCN(C)C[C@@H]1C ZINC000336648796 386260551 /nfs/dbraw/zinc/26/05/51/386260551.db2.gz PPWGSARFHVPBII-RYUDHWBXSA-N 2 0 230.421 2.012 20 0 BEADRP C[C@H]1SCC[N@H+](CCC2CC[NH2+]CC2)[C@@H]1C ZINC000132526082 386240686 /nfs/dbraw/zinc/24/06/86/386240686.db2.gz YPQKENNBTPTURS-VXGBXAGGSA-N 2 0 242.432 2.202 20 0 BEADRP CCCC[C@H](COC)[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000414899529 386247426 /nfs/dbraw/zinc/24/74/26/386247426.db2.gz CLMDUZITDAASCT-ZIAGYGMSSA-N 2 0 242.407 2.171 20 0 BEADRP COc1cccc(C[NH2+]C[C@H]2CCC[C@@H]([NH3+])C2)c1 ZINC000415003488 386253924 /nfs/dbraw/zinc/25/39/24/386253924.db2.gz XICNRPCTZUFEDC-GXTWGEPZSA-N 2 0 248.370 2.302 20 0 BEADRP COc1ccc(CN(C2CC2)[C@H]2CC[NH2+]C2)cc1 ZINC000347155545 386263266 /nfs/dbraw/zinc/26/32/66/386263266.db2.gz CYHLWURDDWMNGL-AWEZNQCLSA-N 2 0 246.354 2.022 20 0 BEADRP c1cc2c(s1)CCC[N@@H+](C[C@H]1CC[NH2+]C1)C2 ZINC000647884610 386263853 /nfs/dbraw/zinc/26/38/53/386263853.db2.gz OBUXZNSJBCMYEF-NSHDSACASA-N 2 0 236.384 2.106 20 0 BEADRP C[C@@H]1C[C@H](C[N@H+](C)[C@@H]2CC2(C)C)CC[NH2+]1 ZINC000414741520 386324144 /nfs/dbraw/zinc/32/41/44/386324144.db2.gz MNYYBZLLZOINKV-IJLUTSLNSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@@H]1[C@@H](N2CCCC2)CC[N@@H+]1CCC1CC1 ZINC000347349106 386342613 /nfs/dbraw/zinc/34/26/13/386342613.db2.gz VEXXCMNBFDWXFZ-OCCSQVGLSA-N 2 0 222.376 2.345 20 0 BEADRP CCC[C@H](C)C[NH2+]CC1(C)CC[NH2+]CC1 ZINC000414903893 386344704 /nfs/dbraw/zinc/34/47/04/386344704.db2.gz MPSUMVXIMKIJJJ-LBPRGKRZSA-N 2 0 212.381 2.402 20 0 BEADRP Cc1cc(C[NH2+]CCCC[NH3+])cc2cccnc12 ZINC000414903810 386344954 /nfs/dbraw/zinc/34/49/54/386344954.db2.gz LSVMHUUMRVVEPW-UHFFFAOYSA-N 2 0 243.354 2.372 20 0 BEADRP CN(CC[C@H]1CCC[N@@H+]1C)CCC(F)(F)F ZINC000336687006 386348039 /nfs/dbraw/zinc/34/80/39/386348039.db2.gz XETJMCBHKGBBEU-SNVBAGLBSA-N 2 0 238.297 2.355 20 0 BEADRP C[N@@H+](Cc1cc2ccccc2o1)C[C@@H]1CC[NH2+]C1 ZINC000647889299 386357093 /nfs/dbraw/zinc/35/70/93/386357093.db2.gz CQFPUQSJJYSKSO-GFCCVEGCSA-N 2 0 244.338 2.474 20 0 BEADRP C[C@@H]([NH3+])[C@H](C)[NH2+][C@H](C)CCCC(F)(F)F ZINC000415007332 386358134 /nfs/dbraw/zinc/35/81/34/386358134.db2.gz CPXGNJFFYVGKPG-HLTSFMKQSA-N 2 0 226.286 2.433 20 0 BEADRP C[C@H](CCCC(F)(F)F)[NH2+][C@@H](C)[C@H](C)[NH3+] ZINC000415007339 386358686 /nfs/dbraw/zinc/35/86/86/386358686.db2.gz CPXGNJFFYVGKPG-VGMNWLOBSA-N 2 0 226.286 2.433 20 0 BEADRP Fc1cc(F)cc(CNCC[C@H]2CCC[NH2+]2)c1 ZINC000414904907 386359869 /nfs/dbraw/zinc/35/98/69/386359869.db2.gz MRJSEWMAIVFVSA-CYBMUJFWSA-N 2 0 240.297 2.197 20 0 BEADRP CCC[C@@H]1[C@H](C)CCC[N@@H+]1C[C@@H]1CC[NH2+]C1 ZINC000647889972 386363271 /nfs/dbraw/zinc/36/32/71/386363271.db2.gz CDCZOTCMALWEMK-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]CC1(C2CC2)CCC1 ZINC000391466615 386325555 /nfs/dbraw/zinc/32/55/55/386325555.db2.gz QJAWKAMHTIVXGP-AAEUAGOBSA-N 2 0 222.376 2.284 20 0 BEADRP Cc1ccc(C[NH2+]CC2(C)CC[NH2+]CC2)cc1 ZINC000414902626 386329825 /nfs/dbraw/zinc/32/98/25/386329825.db2.gz KFDUNCQBRJFKEG-UHFFFAOYSA-N 2 0 232.371 2.474 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccc(F)cc3)C[C@@H]21 ZINC000230045737 386335187 /nfs/dbraw/zinc/33/51/87/386335187.db2.gz CJUGFXOBRUGASE-AEGPPILISA-N 2 0 248.345 2.385 20 0 BEADRP [NH3+]CCC[NH+]1CCC(c2ccsc2)CC1 ZINC000414743960 386337594 /nfs/dbraw/zinc/33/75/94/386337594.db2.gz NTSKURONHMIWPO-UHFFFAOYSA-N 2 0 224.373 2.276 20 0 BEADRP C[NH+]1CCC(N[C@H]2C[C@]2(F)c2ccccc2)CC1 ZINC000335279458 386391633 /nfs/dbraw/zinc/39/16/33/386391633.db2.gz HUXQOPPQLKRTTL-GJZGRUSLSA-N 2 0 248.345 2.308 20 0 BEADRP [NH3+]CCCC[NH2+]C/C=C\c1ccc(F)cc1 ZINC000414907731 386393851 /nfs/dbraw/zinc/39/38/51/386393851.db2.gz PVORVBUZAYUYDX-ARJAWSKDSA-N 2 0 222.307 2.167 20 0 BEADRP CC[C@@H](C)C[NH+]1CCC(OCC[NH+](C)C)CC1 ZINC000336707409 386411525 /nfs/dbraw/zinc/41/15/25/386411525.db2.gz GXAURVJFNYLLIE-CYBMUJFWSA-N 2 0 242.407 2.075 20 0 BEADRP C[C@H]([NH3+])C[N@@H+]1C[C@@H](c2ccccc2)C[C@H]1C ZINC000442664586 386420987 /nfs/dbraw/zinc/42/09/87/386420987.db2.gz MNYGRXUINYDJFF-SCRDCRAPSA-N 2 0 218.344 2.212 20 0 BEADRP C[N@H+](CC1CC1)C[C@@H]1CC[NH+](CC2CC2)C1 ZINC000336710394 386425259 /nfs/dbraw/zinc/42/52/59/386425259.db2.gz YYVXWPOAHDMOOT-AWEZNQCLSA-N 2 0 222.376 2.060 20 0 BEADRP C[C@@]1(C[NH2+]Cc2ccccc2)CCC[NH2+]C1 ZINC000062862280 386528546 /nfs/dbraw/zinc/52/85/46/386528546.db2.gz PDYLFICMGIMWOC-CQSZACIVSA-N 2 0 218.344 2.166 20 0 BEADRP CC[C@H]1C[N@H+](Cc2ccc(C)nc2C)CC[C@H]1[NH3+] ZINC000647934379 386471970 /nfs/dbraw/zinc/47/19/70/386471970.db2.gz CQEPVKNIAQYODB-DZGCQCFKSA-N 2 0 247.386 2.258 20 0 BEADRP CC[C@@H]1C[N@H+](CC[C@H]2CCCCO2)CC[C@H]1[NH3+] ZINC000647934369 386472294 /nfs/dbraw/zinc/47/22/94/386472294.db2.gz CDDABYTUTIGYMC-MGPQQGTHSA-N 2 0 240.391 2.005 20 0 BEADRP CC[C@@H]1C[N@H+](Cc2ccc(C)nc2C)CC[C@@H]1[NH3+] ZINC000647934380 386473788 /nfs/dbraw/zinc/47/37/88/386473788.db2.gz CQEPVKNIAQYODB-HIFRSBDPSA-N 2 0 247.386 2.258 20 0 BEADRP c1ccc2c(c1)CC[C@@H]([NH2+]CC[C@H]1CCC[NH2+]1)C2 ZINC000414912997 386477606 /nfs/dbraw/zinc/47/76/06/386477606.db2.gz ZFTRZLMDKKLALL-HZPDHXFCSA-N 2 0 244.382 2.276 20 0 BEADRP C[C@@H](Cc1ccccc1F)[NH2+]C1CC[NH2+]CC1 ZINC000414776539 386480640 /nfs/dbraw/zinc/48/06/40/386480640.db2.gz FOQMEGDOROMOTA-NSHDSACASA-N 2 0 236.334 2.098 20 0 BEADRP [NH3+]CCCC[NH2+]C/C=C/c1ccc(F)cc1F ZINC000414912966 386483142 /nfs/dbraw/zinc/48/31/42/386483142.db2.gz VKLDAIIXDWUAHU-ONEGZZNKSA-N 2 0 240.297 2.307 20 0 BEADRP C[C@H](Cc1ccc(F)cc1)[NH2+]C1CC[NH2+]CC1 ZINC000062050500 386489943 /nfs/dbraw/zinc/48/99/43/386489943.db2.gz ZVRDTUXVCWNHLQ-LLVKDONJSA-N 2 0 236.334 2.098 20 0 BEADRP COc1cccc(C[NH2+]CC2(C)CC[NH2+]CC2)c1 ZINC000414913676 386494750 /nfs/dbraw/zinc/49/47/50/386494750.db2.gz WMQGNGITTGZTKS-UHFFFAOYSA-N 2 0 248.370 2.175 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)C1CCC1 ZINC000415016111 386500750 /nfs/dbraw/zinc/50/07/50/386500750.db2.gz ZOHAVOQQJYJMBJ-DDTOSNHZSA-N 2 0 222.376 2.153 20 0 BEADRP c1csc(C[NH2+][C@@H]2C[C@H]2C2CC[NH2+]CC2)c1 ZINC000415015080 386500798 /nfs/dbraw/zinc/50/07/98/386500798.db2.gz YBYQAGPKAKCBEL-QWHCGFSZSA-N 2 0 236.384 2.226 20 0 BEADRP Cc1ccc(F)c(C[NH2+][C@@H](C)CCC[NH3+])c1 ZINC000415015446 386501322 /nfs/dbraw/zinc/50/13/22/386501322.db2.gz ARWBGMCWPWXVFK-NSHDSACASA-N 2 0 224.323 2.351 20 0 BEADRP CCc1ncc(C[NH2+][C@@H](C)CCCC[NH3+])s1 ZINC000415016454 386503849 /nfs/dbraw/zinc/50/38/49/386503849.db2.gz PTIIUVBMNKMYGJ-JTQLQIEISA-N 2 0 241.404 2.313 20 0 BEADRP CC(C)c1ncc(C[NH2+]CCCC[NH3+])s1 ZINC000414914934 386505253 /nfs/dbraw/zinc/50/52/53/386505253.db2.gz YMBBACTZWLSBRP-UHFFFAOYSA-N 2 0 227.377 2.095 20 0 BEADRP C[C@H]1[C@@H]([NH3+])CC[N@@H+]1C[C@@H]1CCC[C@@H](C)C1 ZINC000415050484 386505560 /nfs/dbraw/zinc/50/55/60/386505560.db2.gz CWZZBTQGWYSFDC-XQHKEYJVSA-N 2 0 210.365 2.234 20 0 BEADRP [NH3+]C[C@H]1CC[C@@H]([NH2+]Cc2ccccc2F)C1 ZINC000415051264 386508790 /nfs/dbraw/zinc/50/87/90/386508790.db2.gz ZBMPASYBZOVWRS-CMPLNLGQSA-N 2 0 222.307 2.043 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[C@@H](C[NH3+])C2)C1 ZINC000415051376 386509408 /nfs/dbraw/zinc/50/94/08/386509408.db2.gz ZIOSAHUNHQNMHS-FVCCEPFGSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@@H](C)Cc1ccccc1F ZINC000415020599 386510975 /nfs/dbraw/zinc/51/09/75/386510975.db2.gz JOSQRWCBOYTEJD-RYUDHWBXSA-N 2 0 238.350 2.474 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H](C)Cc1ccccc1F ZINC000415020597 386511230 /nfs/dbraw/zinc/51/12/30/386511230.db2.gz JOSQRWCBOYTEJD-NEPJUHHUSA-N 2 0 238.350 2.474 20 0 BEADRP CC[C@@H]1C[C@@H](C[NH2+][C@H](C)CCCC[NH3+])CCO1 ZINC000415021998 386511261 /nfs/dbraw/zinc/51/12/61/386511261.db2.gz ZFXJYASSCKJOES-HZSPNIEDSA-N 2 0 242.407 2.299 20 0 BEADRP CCOc1ccc(C[NH2+][C@@H](C)CCC[NH3+])cc1 ZINC000415023646 386513090 /nfs/dbraw/zinc/51/30/90/386513090.db2.gz NESSSGCDIVTEFK-LBPRGKRZSA-N 2 0 236.359 2.302 20 0 BEADRP CCCc1csc(C[NH2+][C@@H](C)CCC[NH3+])n1 ZINC000415024784 386514821 /nfs/dbraw/zinc/51/48/21/386514821.db2.gz PNIUYRNICFJSPX-JTQLQIEISA-N 2 0 241.404 2.313 20 0 BEADRP Cc1ccc(C[NH2+]C[C@H]2CC[C@H](C[NH3+])CC2)nc1 ZINC000415026901 386516178 /nfs/dbraw/zinc/51/61/78/386516178.db2.gz VGTHWBKXGRDJRV-HDJSIYSDSA-N 2 0 247.386 2.245 20 0 BEADRP CCc1cc(NCC[N@@H+](CC)C2CC2)nc(C)n1 ZINC000227865299 386519642 /nfs/dbraw/zinc/51/96/42/386519642.db2.gz JDADMMODXUWWNN-UHFFFAOYSA-N 2 0 248.374 2.244 20 0 BEADRP CCC1(C)CCC([NH2+][C@@H]2[C@H]3C[NH2+]C[C@H]32)CC1 ZINC000415034473 386521276 /nfs/dbraw/zinc/52/12/76/386521276.db2.gz JRARZUYLYLDQPR-XCDXQOEGSA-N 2 0 222.376 2.153 20 0 BEADRP CC(C)[C@@H]1CC[C@H]([NH2+][C@@H]2[C@H]3C[NH2+]C[C@H]32)C[C@@H]1C ZINC000415034962 386521510 /nfs/dbraw/zinc/52/15/10/386521510.db2.gz KGRLQOOJPXJMKB-GXYBRJDSSA-N 2 0 236.403 2.255 20 0 BEADRP Cc1cccc(CC[C@@H](C)[NH2+][C@@H]2[C@H]3C[NH2+]C[C@H]32)c1 ZINC000415036339 386523608 /nfs/dbraw/zinc/52/36/08/386523608.db2.gz LRLATOFMROHFHI-OJLVUWQFSA-N 2 0 244.382 2.124 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CC[C@H](C[NH3+])C2)cc1 ZINC000415036896 386524595 /nfs/dbraw/zinc/52/45/95/386524595.db2.gz LTDQMFHXCRGVQG-UONOGXRCSA-N 2 0 218.344 2.212 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+][C@@H]1CC[C@H](C[NH3+])C1 ZINC000415039898 386527514 /nfs/dbraw/zinc/52/75/14/386527514.db2.gz OPKXUPCHOMCGED-KXUCPTDWSA-N 2 0 238.297 2.434 20 0 BEADRP CC(C)(C)[C@@H]1CC[C@@H]1[NH2+]C1CC[NH2+]CC1 ZINC000335453495 386528232 /nfs/dbraw/zinc/52/82/32/386528232.db2.gz WCBVSGQJGSXFMG-NEPJUHHUSA-N 2 0 210.365 2.153 20 0 BEADRP CCCc1cccc(CN[C@H](C[NH3+])C2CC2)c1 ZINC000414799046 386574629 /nfs/dbraw/zinc/57/46/29/386574629.db2.gz DCBJVRSPWVFNIN-OAHLLOKOSA-N 2 0 232.371 2.466 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@@H]1CCC[C@H]1C(C)C ZINC000414799086 386575279 /nfs/dbraw/zinc/57/52/79/386575279.db2.gz RBHIHPVOVWAWOY-YNEHKIRRSA-N 2 0 212.381 2.384 20 0 BEADRP Cc1cccc(C)c1CC[NH2+]C[C@@]1(C)CC[NH2+]C1 ZINC000415077133 386577852 /nfs/dbraw/zinc/57/78/52/386577852.db2.gz DVYWCCUOBSVJIP-MRXNPFEDSA-N 2 0 246.398 2.435 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]C1CCC(C[NH3+])CC1 ZINC000415076486 386580956 /nfs/dbraw/zinc/58/09/56/386580956.db2.gz COCLSGSRAKTWMS-PKSQDBQZSA-N 2 0 210.365 2.282 20 0 BEADRP C[NH+]1CCC2(CCC[N@@H+]2Cc2ccccn2)CC1 ZINC000335415102 386581991 /nfs/dbraw/zinc/58/19/91/386581991.db2.gz WCSQWWGUZWJYKW-UHFFFAOYSA-N 2 0 245.370 2.142 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@H](C)Cc1ccoc1 ZINC000336757412 386586100 /nfs/dbraw/zinc/58/61/00/386586100.db2.gz YYWCOSMDHKRVFQ-VXGBXAGGSA-N 2 0 224.348 2.140 20 0 BEADRP CCCC[N@@H+]1C[C@H](C[NH3+])[C@@H](c2ccccc2)C1 ZINC000337043375 386592254 /nfs/dbraw/zinc/59/22/54/386592254.db2.gz CVEFKETZJLARFP-LSDHHAIUSA-N 2 0 232.371 2.461 20 0 BEADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(F)c(F)c2)C1 ZINC000415046341 386532216 /nfs/dbraw/zinc/53/22/16/386532216.db2.gz UZXJJTNJZRPUHS-MWLCHTKSSA-N 2 0 240.297 2.182 20 0 BEADRP CC(C)C[C@H](C)C[C@@H](C)[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000415046543 386532353 /nfs/dbraw/zinc/53/23/53/386532353.db2.gz XLPXBTNZQBOPPA-MEBFFEOJSA-N 2 0 224.392 2.255 20 0 BEADRP [NH3+]C[C@H]1CC[C@H]([NH2+]Cc2ccc(F)c(F)c2)C1 ZINC000415046342 386532384 /nfs/dbraw/zinc/53/23/84/386532384.db2.gz UZXJJTNJZRPUHS-ONGXEEELSA-N 2 0 240.297 2.182 20 0 BEADRP CC1(C)CC[C@H]([NH2+][C@@H]2CC[C@@H](C[NH3+])C2)C1 ZINC000415047382 386534394 /nfs/dbraw/zinc/53/43/94/386534394.db2.gz WAKTZXPOYKPXFT-UTUOFQBUSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@]1(C[N@@H+]2CCCc3ccccc3C2)CC[NH2+]C1 ZINC000062946197 386534649 /nfs/dbraw/zinc/53/46/49/386534649.db2.gz PFPWCMMGWKIOPL-INIZCTEOSA-N 2 0 244.382 2.434 20 0 BEADRP CCC1(C)CC[NH+](C[C@H]2CCC[NH2+]C2)CC1 ZINC000062953996 386534707 /nfs/dbraw/zinc/53/47/07/386534707.db2.gz PEZRWIOKHNSKOF-ZDUSSCGKSA-N 2 0 224.392 2.498 20 0 BEADRP CCC1(C)CC[NH+](C[C@@]2(C)CC[NH2+]C2)CC1 ZINC000062959840 386535451 /nfs/dbraw/zinc/53/54/51/386535451.db2.gz YJTIGDSSEKDYBW-AWEZNQCLSA-N 2 0 224.392 2.498 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCC[C@@H]([C@H]2CC[NH2+]C2)C1 ZINC000414789070 386536142 /nfs/dbraw/zinc/53/61/42/386536142.db2.gz XUFANYGWCGZELO-MELADBBJSA-N 2 0 224.392 2.354 20 0 BEADRP c1ccc(C[NH2+]CC2CC[NH+](C3CC3)CC2)nc1 ZINC000278499329 386537193 /nfs/dbraw/zinc/53/71/93/386537193.db2.gz NGGIHVMBTGSPFH-UHFFFAOYSA-N 2 0 245.370 2.046 20 0 BEADRP CC1(C)CCC[C@H]1[C@H]1CC[N@H+](CCN)C1 ZINC000647995412 386539597 /nfs/dbraw/zinc/53/95/97/386539597.db2.gz VVLGEQQQTKVPKV-RYUDHWBXSA-N 2 0 210.365 2.093 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH2+][C@H]2CCCC23CC3)C1 ZINC000519710490 386543447 /nfs/dbraw/zinc/54/34/47/386543447.db2.gz NSOLOWADUSNXDY-STQMWFEESA-N 2 0 222.376 2.251 20 0 BEADRP Cc1ccc(C)c2c1CCC[C@H]2[NH2+]CC1C[NH2+]C1 ZINC000335461750 386543514 /nfs/dbraw/zinc/54/35/14/386543514.db2.gz NVGSDUHMJPEOTA-OAHLLOKOSA-N 2 0 244.382 2.490 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC2C[NH2+]C2)c2ccccc21 ZINC000335463624 386548097 /nfs/dbraw/zinc/54/80/97/386548097.db2.gz YYPIXXDAUAPPGT-YGRLFVJLSA-N 2 0 216.328 2.044 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CC2C[NH2+]C2)c2sccc21 ZINC000335463607 386548457 /nfs/dbraw/zinc/54/84/57/386548457.db2.gz YSOLHXNEMFQVFA-SKDRFNHKSA-N 2 0 236.384 2.496 20 0 BEADRP CCCC[N@@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000647975302 386550076 /nfs/dbraw/zinc/55/00/76/386550076.db2.gz VNNXJHPPAJRXTC-KGLIPLIRSA-N 2 0 224.392 2.498 20 0 BEADRP CC(C)C[C@H](C)C[NH2+][C@@H]1CCCC[NH2+]C1 ZINC000415069133 386551539 /nfs/dbraw/zinc/55/15/39/386551539.db2.gz GCNWHMOJKUQPEZ-QWHCGFSZSA-N 2 0 212.381 2.400 20 0 BEADRP CC(C)C[C@@H](C)C[C@@H](C)[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000415069687 386551765 /nfs/dbraw/zinc/55/17/65/386551765.db2.gz XLPXBTNZQBOPPA-POQQGIQPSA-N 2 0 224.392 2.255 20 0 BEADRP CCC([NH3+])(CC)C[NH2+][C@@H]1CCO[C@@H](C(C)C)C1 ZINC000414802532 386597339 /nfs/dbraw/zinc/59/73/39/386597339.db2.gz BVUFOQMXCDCQJP-CHWSQXEVSA-N 2 0 242.407 2.297 20 0 BEADRP COc1ccc(C)cc1C[NH2+][C@H]1CCC[C@@H]1C[NH3+] ZINC000414791210 386553774 /nfs/dbraw/zinc/55/37/74/386553774.db2.gz HIZFUVVBXZUNDU-OCCSQVGLSA-N 2 0 248.370 2.221 20 0 BEADRP CC(C)[N@@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC000647974878 386555886 /nfs/dbraw/zinc/55/58/86/386555886.db2.gz AEWLAVCMRPSYAD-QWHCGFSZSA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)C1CCC([NH2+][C@H]2CCN(C)C2)CC1 ZINC000054556397 386557518 /nfs/dbraw/zinc/55/75/18/386557518.db2.gz XOLZPLLUGQOKJW-RUXDESIVSA-N 2 0 224.392 2.495 20 0 BEADRP Cc1oc2ccccc2c1CN1CC[C@H]([NH3+])C1 ZINC000123574139 386559029 /nfs/dbraw/zinc/55/90/29/386559029.db2.gz NEDUMIJPAAIDEU-NSHDSACASA-N 2 0 230.311 2.274 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@@H](C)Cc1ccccc1F ZINC000414794394 386561031 /nfs/dbraw/zinc/56/10/31/386561031.db2.gz LZRNTEZWSYELGY-SMDDNHRTSA-N 2 0 238.350 2.330 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+]CC(C)(C)[NH3+] ZINC000414796000 386564831 /nfs/dbraw/zinc/56/48/31/386564831.db2.gz BJNNXLHQDCSLDA-SSDOTTSWSA-N 2 0 212.259 2.044 20 0 BEADRP Cc1cccc(OC[C@@H](C)[NH2+]C2CC[NH2+]CC2)c1 ZINC000415074966 386569737 /nfs/dbraw/zinc/56/97/37/386569737.db2.gz DGHMQAWOJJCJLA-CYBMUJFWSA-N 2 0 248.370 2.104 20 0 BEADRP CCCC[C@H](COC)[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000414924375 386624152 /nfs/dbraw/zinc/62/41/52/386624152.db2.gz KBASYSREZRFGCM-FRRDWIJNSA-N 2 0 228.380 2.051 20 0 BEADRP CC(C)([NH3+])C[NH2+]C[C@@H]1CCO[C@H]1c1ccccc1 ZINC000415101210 386624380 /nfs/dbraw/zinc/62/43/80/386624380.db2.gz HGDNJWZUPVKCRO-KBPBESRZSA-N 2 0 248.370 2.091 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCOC2CCCC2)CC[N@@H+]1C ZINC000156146854 386625586 /nfs/dbraw/zinc/62/55/86/386625586.db2.gz RUICNPXDCJYEDF-CHWSQXEVSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC[NH2+]C1)C1CCC(F)(F)CC1 ZINC000335498955 386626422 /nfs/dbraw/zinc/62/64/22/386626422.db2.gz ZQVFLSCSDVMWDP-MWLCHTKSSA-N 2 0 232.318 2.152 20 0 BEADRP C[C@H]1CC(C)(C)C[N@@H+]1C[C@H]1CC[NH2+][C@H](C)C1 ZINC000415127045 386626493 /nfs/dbraw/zinc/62/64/93/386626493.db2.gz RKFOPLUKZOQFBL-AGIUHOORSA-N 2 0 224.392 2.495 20 0 BEADRP Cc1ccncc1[C@@H](C)[NH2+]C1CCC([NH3+])CC1 ZINC000335499832 386628081 /nfs/dbraw/zinc/62/80/81/386628081.db2.gz KRTQYKOIVQPXJP-PNESKVBLSA-N 2 0 233.359 2.311 20 0 BEADRP C[C@H]1CC(C)(C)C[N@@H+]1C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000415127047 386629040 /nfs/dbraw/zinc/62/90/40/386629040.db2.gz RKFOPLUKZOQFBL-FRRDWIJNSA-N 2 0 224.392 2.495 20 0 BEADRP CCc1ccc(CC[N@@H+]2C[C@H](C[NH3+])C[C@H]2C)cc1 ZINC000442759902 386629995 /nfs/dbraw/zinc/62/99/95/386629995.db2.gz SPXRBCGITHWYBN-CJNGLKHVSA-N 2 0 246.398 2.461 20 0 BEADRP C[N@H+]1CC=C(C[NH2+]CCC(C)(C)C)CC1 ZINC000336758422 386634677 /nfs/dbraw/zinc/63/46/77/386634677.db2.gz JVAHGDYLNDGKRN-UHFFFAOYSA-N 2 0 210.365 2.274 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCC12CCC2)C[NH+](C)C ZINC000336758917 386644636 /nfs/dbraw/zinc/64/46/36/386644636.db2.gz KXQGXZKTUSBWMS-VXGBXAGGSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]([NH3+])c1ccc(C[NH2+]C[C@@H]2C[C@@H]2C)cc1 ZINC000414814598 386646412 /nfs/dbraw/zinc/64/64/12/386646412.db2.gz OFCKIABUGURSOF-MJVIPROJSA-N 2 0 218.344 2.452 20 0 BEADRP C[C@H]([NH3+])c1ccc(C[NH2+]C[C@H]2C[C@H]2C)cc1 ZINC000414814848 386650707 /nfs/dbraw/zinc/65/07/07/386650707.db2.gz OFCKIABUGURSOF-UHIISALHSA-N 2 0 218.344 2.452 20 0 BEADRP C[C@@H](CCc1ccc(F)cc1)[NH2+]CC(C)(C)[NH3+] ZINC000414804125 386605318 /nfs/dbraw/zinc/60/53/18/386605318.db2.gz MVZHGVCANCODDI-NSHDSACASA-N 2 0 238.350 2.474 20 0 BEADRP COc1cc(C[NH2+][C@@H]2CCC[C@@H]2C[NH3+])ccc1C ZINC000414803871 386605847 /nfs/dbraw/zinc/60/58/47/386605847.db2.gz OIXCADCGJDIFTO-ZIAGYGMSSA-N 2 0 248.370 2.221 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@H](C)CCC(F)(F)F ZINC000414803863 386606213 /nfs/dbraw/zinc/60/62/13/386606213.db2.gz WYAKXFVDUZSYTR-RKDXNWHRSA-N 2 0 226.286 2.290 20 0 BEADRP Cc1ccccc1CC[NH2+]C[C@]1(C)CC[NH2+]C1 ZINC000415093494 386613119 /nfs/dbraw/zinc/61/31/19/386613119.db2.gz VKHDADZOIUETQW-HNNXBMFYSA-N 2 0 232.371 2.127 20 0 BEADRP NC[C@H]([NH2+][C@@H]1CCC[C@H](C2CC2)C1)C1CC1 ZINC000414807423 386617931 /nfs/dbraw/zinc/61/79/31/386617931.db2.gz QYXBSALLLMEMSR-MJBXVCDLSA-N 2 0 222.376 2.282 20 0 BEADRP NC[C@H]([NH2+][C@H]1CCC[C@H](C2CC2)C1)C1CC1 ZINC000414807419 386618920 /nfs/dbraw/zinc/61/89/20/386618920.db2.gz QYXBSALLLMEMSR-IHRRRGAJSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000414819729 386660222 /nfs/dbraw/zinc/66/02/22/386660222.db2.gz IETCONFINBWLCD-GUBZILKMSA-N 2 0 238.297 2.434 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000414819732 386660926 /nfs/dbraw/zinc/66/09/26/386660926.db2.gz IETCONFINBWLCD-LPEHRKFASA-N 2 0 238.297 2.434 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+]CC1(CC(C)C)CC1 ZINC000391804762 386662231 /nfs/dbraw/zinc/66/22/31/386662231.db2.gz FNBGZGBFZFRUBX-CYBMUJFWSA-N 2 0 242.407 2.156 20 0 BEADRP C([NH2+][C@H]1CCC[C@H](C2CC2)C1)[C@@H]1CCC[NH2+]1 ZINC000414820060 386663420 /nfs/dbraw/zinc/66/34/20/386663420.db2.gz ACQVPDXUPYJIQA-IHRRRGAJSA-N 2 0 222.376 2.297 20 0 BEADRP Fc1ccc2c(c1)CC[C@@H]2[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000335523197 386664551 /nfs/dbraw/zinc/66/45/51/386664551.db2.gz XMUSSNDKLVDOMY-NHYWBVRUSA-N 2 0 248.345 2.402 20 0 BEADRP C[C@@H](CCC(F)(F)F)[NH2+]C[C@H]1CCC[NH2+]1 ZINC000414820343 386665593 /nfs/dbraw/zinc/66/55/93/386665593.db2.gz AMUJHORBCOENIZ-DTWKUNHWSA-N 2 0 224.270 2.059 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[NH2+]C1)c1ccccc1 ZINC000041231974 386666247 /nfs/dbraw/zinc/66/62/47/386666247.db2.gz QNXFKBXEIYLNOW-STQMWFEESA-N 2 0 218.344 2.337 20 0 BEADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@@H]2CCCOCC2)cc1 ZINC000414818948 386666907 /nfs/dbraw/zinc/66/69/07/386666907.db2.gz XGLSEKQTKGNRDO-IUODEOHRSA-N 2 0 248.370 2.365 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000414822085 386671567 /nfs/dbraw/zinc/67/15/67/386671567.db2.gz BYNLQTWKNLTODK-KYTZWMPUSA-N 2 0 208.349 2.048 20 0 BEADRP C[C@@H](C[NH2+][C@@H]1CCC1(C)C)C[NH+]1CCCC1 ZINC000336648487 386685299 /nfs/dbraw/zinc/68/52/99/386685299.db2.gz GEHLQYZNHRLLBE-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP Fc1ccc(/C=C\C[NH2+]C[C@H]2CCC[NH2+]C2)cc1 ZINC000414826927 386687174 /nfs/dbraw/zinc/68/71/74/386687174.db2.gz KASMKRLUWOIBMC-NPPUXFBVSA-N 2 0 248.345 2.428 20 0 BEADRP CC[C@@H](C)[N@@H+]1CC[C@@H](OCC[NH+](CC)CC)C1 ZINC000337260813 386694307 /nfs/dbraw/zinc/69/43/07/386694307.db2.gz XKODXWDSCRPPTK-ZIAGYGMSSA-N 2 0 242.407 2.218 20 0 BEADRP COC[C@H](CC(C)C)[NH2+][C@H](C)[C@H]1CCC[NH2+]C1 ZINC000414826206 386694576 /nfs/dbraw/zinc/69/45/76/386694576.db2.gz VDYFEDVHYVIHMY-RDBSUJKOSA-N 2 0 242.407 2.025 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@H](C)c1nccs1 ZINC000336648755 386697018 /nfs/dbraw/zinc/69/70/18/386697018.db2.gz GPXYATAARUKJPL-WDEREUQCSA-N 2 0 241.404 2.354 20 0 BEADRP Fc1cc(F)cc(C[NH2+]CC[C@@H]2CC[NH2+]C2)c1 ZINC000414829174 386700242 /nfs/dbraw/zinc/70/02/42/386700242.db2.gz KIJBIHWVKWJZRZ-JTQLQIEISA-N 2 0 240.297 2.054 20 0 BEADRP CCNCC[NH2+][C@H]1C[C@H](C)CC(C)(C)C1 ZINC000414830243 386707402 /nfs/dbraw/zinc/70/74/02/386707402.db2.gz NRTAWVNNNDKWJP-RYUDHWBXSA-N 2 0 212.381 2.400 20 0 BEADRP [NH3+]CCOCC[N@@H+]1CCC[C@H]1C1CCCCC1 ZINC000357067278 386707747 /nfs/dbraw/zinc/70/77/47/386707747.db2.gz DMKMMOKKEOCKLW-AWEZNQCLSA-N 2 0 240.391 2.006 20 0 BEADRP CCCC[C@@H](COC)[NH2+]CC1([NH3+])CCCCC1 ZINC000414837367 386733525 /nfs/dbraw/zinc/73/35/25/386733525.db2.gz GZQKIVACESVUCP-ZDUSSCGKSA-N 2 0 242.407 2.443 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000414837070 386734049 /nfs/dbraw/zinc/73/40/49/386734049.db2.gz UBRXUHJJNQFIAJ-ZJUUUORDSA-N 2 0 238.297 2.307 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]C/C=C\c1ccccc1OC ZINC000414833102 386713948 /nfs/dbraw/zinc/71/39/48/386713948.db2.gz GDEWUTMFHNMDDA-FWPCIQOSSA-N 2 0 248.370 2.154 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]C/C=C\c1ccccc1OC ZINC000414833105 386714399 /nfs/dbraw/zinc/71/43/99/386714399.db2.gz GDEWUTMFHNMDDA-WOLRVDTOSA-N 2 0 248.370 2.154 20 0 BEADRP CC(C)CC[C@H](C)[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000414831831 386718474 /nfs/dbraw/zinc/71/84/74/386718474.db2.gz NYSYOEOIGOZIJF-QWHCGFSZSA-N 2 0 212.381 2.400 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CCC[C@H](C2CC2)C1 ZINC000414835808 386727358 /nfs/dbraw/zinc/72/73/58/386727358.db2.gz IPFZYKJKWBYZAF-FPMFFAJLSA-N 2 0 224.392 2.400 20 0 BEADRP CC[C@@H](Cc1ccccc1)[NH2+]C[C@@H]1CCC[NH2+]1 ZINC000414841885 386749929 /nfs/dbraw/zinc/74/99/29/386749929.db2.gz IFSIESOFPUGREP-GJZGRUSLSA-N 2 0 232.371 2.349 20 0 BEADRP CCOc1cccc(C[NH2+]C2(C)CC[NH2+]CC2)c1 ZINC000414931438 386760862 /nfs/dbraw/zinc/76/08/62/386760862.db2.gz BTLISZJIOZRHJR-UHFFFAOYSA-N 2 0 248.370 2.317 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]Cc1cc(F)ccc1C ZINC000414845305 386789926 /nfs/dbraw/zinc/78/99/26/386789926.db2.gz SDASFVGPXILAKG-SNVBAGLBSA-N 2 0 224.323 2.079 20 0 BEADRP C[C@H](NCC[C@H]1CCCC[N@@H+]1C)c1ccon1 ZINC000349204814 386791187 /nfs/dbraw/zinc/79/11/87/386791187.db2.gz VIRKRWRILIKOPB-NWDGAFQWSA-N 2 0 237.347 2.200 20 0 BEADRP Cc1ccncc1C[N@@H+]1C[C@H](C[NH3+])[C@H](C)C[C@@H]1C ZINC000397259240 386772118 /nfs/dbraw/zinc/77/21/18/386772118.db2.gz GQAFCUSFRGGFQM-RDBSUJKOSA-N 2 0 247.386 2.195 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@H]1CCC1(C)C ZINC000336666504 386778962 /nfs/dbraw/zinc/77/89/62/386778962.db2.gz DLOASOGNUXHFFU-LBPRGKRZSA-N 2 0 212.381 2.495 20 0 BEADRP c1ccc(C[NH2+]CCCCC[NH+]2CCCC2)nc1 ZINC000293210750 386787347 /nfs/dbraw/zinc/78/73/47/386787347.db2.gz YGHBCLVVSKIUOW-UHFFFAOYSA-N 2 0 247.386 2.437 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+][C@H]1CC[NH2+]C[C@H]1C ZINC000414933272 386788059 /nfs/dbraw/zinc/78/80/59/386788059.db2.gz DLNKPLWWVPATLC-BBBLOLIVSA-N 2 0 238.297 2.305 20 0 BEADRP COc1cc(C[NH2+]C[C@H]2CCC[NH2+]C2)ccc1C ZINC000414846264 386817585 /nfs/dbraw/zinc/81/75/85/386817585.db2.gz DVLKGKGVQLGGBL-AWEZNQCLSA-N 2 0 248.370 2.093 20 0 BEADRP CCc1cc(N2CC[C@H]3CC[N@H+](C)C[C@@H]32)cc[nH+]1 ZINC000334790247 386853083 /nfs/dbraw/zinc/85/30/83/386853083.db2.gz MJNXZWLNSIKTCV-DOMZBBRYSA-N 2 0 245.370 2.174 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H]2CC[C@H]2SC)C1 ZINC000425339402 386840267 /nfs/dbraw/zinc/84/02/67/386840267.db2.gz CMWXOWQZOJUBOP-FRRDWIJNSA-N 2 0 242.432 2.202 20 0 BEADRP CS[C@@H]1CC[C@H]1[NH2+]C[C@H](C)C[NH+]1CCCC1 ZINC000425340153 386843301 /nfs/dbraw/zinc/84/33/01/386843301.db2.gz DLYDFDFLBIASPX-YNEHKIRRSA-N 2 0 242.432 2.202 20 0 BEADRP CS[C@@H]1CC[C@@H]1[NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000425341737 386845972 /nfs/dbraw/zinc/84/59/72/386845972.db2.gz GBNSOEVIKUBAQH-QNWHQSFQSA-N 2 0 242.432 2.343 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]Cc1ccc(F)cc1F ZINC000336674532 386852682 /nfs/dbraw/zinc/85/26/82/386852682.db2.gz UUQBKHNOHMVAHH-VIFPVBQESA-N 2 0 228.286 2.182 20 0 BEADRP CCc1cc(N2CC[C@@H]3CC[N@H+](C)C[C@@H]32)cc[nH+]1 ZINC000334790258 386854133 /nfs/dbraw/zinc/85/41/33/386854133.db2.gz MJNXZWLNSIKTCV-WFASDCNBSA-N 2 0 245.370 2.174 20 0 BEADRP CO[C@H](C)[C@H](C)[NH2+]CC(C)(C)C[NH+]1CCCC1 ZINC000357842142 386854338 /nfs/dbraw/zinc/85/43/38/386854338.db2.gz ATSPRGWKKWSTLZ-QWHCGFSZSA-N 2 0 242.407 2.121 20 0 BEADRP CCN1CCCC[C@@H]1C[NH2+][C@@H]1CC[C@H]1SC ZINC000425343415 386856067 /nfs/dbraw/zinc/85/60/67/386856067.db2.gz IFXNJAQUKNRXJE-JHJVBQTASA-N 2 0 242.432 2.344 20 0 BEADRP CC[C@H]1CC[C@@H]1[NH2+]CCC1CC[NH+](C)CC1 ZINC000336744449 386856559 /nfs/dbraw/zinc/85/65/59/386856559.db2.gz UYVCLFXUGCCYCG-KBPBESRZSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1cc(C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)ccc1F ZINC000334846798 386894141 /nfs/dbraw/zinc/89/41/41/386894141.db2.gz PXQBLGJZKYSZJF-CHWSQXEVSA-N 2 0 236.334 2.494 20 0 BEADRP C[N@H+](CCF)Cc1ccc(-n2ccnc2)cc1 ZINC000293702280 386863062 /nfs/dbraw/zinc/86/30/62/386863062.db2.gz RSZJWSUKKQMNOU-UHFFFAOYSA-N 2 0 233.290 2.274 20 0 BEADRP CS[C@@H]1CC[C@H]1[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000425350452 386866870 /nfs/dbraw/zinc/86/68/70/386866870.db2.gz LOHMZWWGUVLZGU-VXGBXAGGSA-N 2 0 242.432 2.202 20 0 BEADRP c1ccc2c(c1)C[NH+](CC[C@H]1CCC[NH2+]C1)C2 ZINC000051919697 386872320 /nfs/dbraw/zinc/87/23/20/386872320.db2.gz ZTXGFQSVHMHZPL-CYBMUJFWSA-N 2 0 230.355 2.392 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+][C@@H](C)C1CCSCC1 ZINC000336744933 386882982 /nfs/dbraw/zinc/88/29/82/386882982.db2.gz QIEXTXIWYDWZBN-RYUDHWBXSA-N 2 0 244.448 2.448 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[NH2+]C[C@@H]1C)Cc1ccccc1 ZINC000414943918 386901749 /nfs/dbraw/zinc/90/17/49/386901749.db2.gz OOBAHWILXJOVSE-OFQRWUPVSA-N 2 0 246.398 2.453 20 0 BEADRP Cc1cc(C[NH2+][C@H]2CC[NH2+]C[C@H]2C)ccc1F ZINC000334852830 386901945 /nfs/dbraw/zinc/90/19/45/386901945.db2.gz ATJRQRFDJNQIMX-RISCZKNCSA-N 2 0 236.334 2.222 20 0 BEADRP C[C@H]1CC(C)(C)C[N@@H+]1CC1CC[NH2+]CC1 ZINC000334856446 386908575 /nfs/dbraw/zinc/90/85/75/386908575.db2.gz XPBAATXZVRSCCD-NSHDSACASA-N 2 0 210.365 2.106 20 0 BEADRP Cc1cc(F)ccc1C[NH2+][C@@H]1CC[NH2+]C[C@@H]1C ZINC000334859674 386912913 /nfs/dbraw/zinc/91/29/13/386912913.db2.gz ZWOXBBQUGZXNCL-SMDDNHRTSA-N 2 0 236.334 2.222 20 0 BEADRP COc1cccc2c1CC[C@@H]2[NH2+]C1CC[NH2+]CC1 ZINC000334867143 386923939 /nfs/dbraw/zinc/92/39/39/386923939.db2.gz UIHJAGRJHVRBGX-AWEZNQCLSA-N 2 0 246.354 2.024 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+][C@@H]1CN(C)C[C@H]1C ZINC000358390337 386947379 /nfs/dbraw/zinc/94/73/79/386947379.db2.gz BXJZLSAGVJSFHN-YRGRVCCFSA-N 2 0 236.359 2.140 20 0 BEADRP CC1CCC([NH2+][C@@H]2CC[NH2+][C@H](C)C2)CC1 ZINC000334867465 386925410 /nfs/dbraw/zinc/92/54/10/386925410.db2.gz GAZAVGXSJNBHAV-POOIEITISA-N 2 0 210.365 2.295 20 0 BEADRP CS[C@H]1CC[C@@H]1[NH2+]CCC[N@H+](C)C(C)C ZINC000425359397 386977438 /nfs/dbraw/zinc/97/74/38/386977438.db2.gz PXXPEUNPIYTMNL-RYUDHWBXSA-N 2 0 230.421 2.200 20 0 BEADRP C[N@H+](CCCCCF)C[C@H]1CCC[NH+](C)C1 ZINC000341883275 386985247 /nfs/dbraw/zinc/98/52/47/386985247.db2.gz NUFWCLGHQZKPSB-CYBMUJFWSA-N 2 0 230.371 2.400 20 0 BEADRP Cc1ccc(CN[C@@H]2CC[N@@H+](C)C[C@@H]2C)nc1C ZINC000314760263 386999117 /nfs/dbraw/zinc/99/91/17/386999117.db2.gz KASJLUQPKGJINY-SWLSCSKDSA-N 2 0 247.386 2.128 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CC2(C)CC[NH2+]CC2)[C@H]1C ZINC000395157270 386948523 /nfs/dbraw/zinc/94/85/23/386948523.db2.gz LNXPRNGOFLWPRB-GRYCIOLGSA-N 2 0 210.365 2.010 20 0 BEADRP c1ccc2c(c1)CCC[C@@H]2[N@@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC000107856101 387036526 /nfs/dbraw/zinc/03/65/26/387036526.db2.gz PUJHUFLTTXDVAQ-LZWOXQAQSA-N 2 0 242.366 2.215 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CC2CC(F)(F)C2)[C@H](C)C1 ZINC000425957013 387045965 /nfs/dbraw/zinc/04/59/65/387045965.db2.gz ZNQKZYYBVOWSPW-PWSUYJOCSA-N 2 0 246.345 2.352 20 0 BEADRP CC[C@H]1CC[C@@H]1[NH2+]CCC[NH+]1CCCC1 ZINC000336764687 387053067 /nfs/dbraw/zinc/05/30/67/387053067.db2.gz QASJUDUEYQRTKS-STQMWFEESA-N 2 0 210.365 2.251 20 0 BEADRP CC(C)[C@](C)([NH2+]CC[C@H]1CCC[N@@H+]1C)C(N)=O ZINC000331344259 387016627 /nfs/dbraw/zinc/01/66/27/387016627.db2.gz LECTZHWCMOOBFF-YPMHNXCESA-N 2 0 241.379 2.010 20 0 BEADRP C(C1CCC1)[N@@H+]1CCCC[C@@H]1[C@@H]1CC[NH2+]C1 ZINC000334983479 387069427 /nfs/dbraw/zinc/06/94/27/387069427.db2.gz MRKFJDNIHQLZGQ-ZIAGYGMSSA-N 2 0 222.376 2.251 20 0 BEADRP C(C1CCC1)[N@@H+]1CCCC[C@@H]1[C@H]1CC[NH2+]C1 ZINC000334983478 387070031 /nfs/dbraw/zinc/07/00/31/387070031.db2.gz MRKFJDNIHQLZGQ-UONOGXRCSA-N 2 0 222.376 2.251 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@@H]([C@@H](C)[NH3+])C2)cc1C ZINC000126922775 387074067 /nfs/dbraw/zinc/07/40/67/387074067.db2.gz PRCNGZXCSUWUII-UKRRQHHQSA-N 2 0 232.371 2.473 20 0 BEADRP C[C@@H]([NH3+])[C@H]1CC[N@H+](CCCc2ccccc2)C1 ZINC000165980751 387075788 /nfs/dbraw/zinc/07/57/88/387075788.db2.gz XEVXFIWERNPMFQ-HIFRSBDPSA-N 2 0 232.371 2.288 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CCC[N@H+](Cc2ccc(F)cc2)C1 ZINC000070977042 387085318 /nfs/dbraw/zinc/08/53/18/387085318.db2.gz YWFCVJBBGWFRJN-WCQYABFASA-N 2 0 236.334 2.385 20 0 BEADRP C[C@@H]([NH2+]CC1(C)CC[NH2+]CC1)c1nccs1 ZINC000070733563 387091137 /nfs/dbraw/zinc/09/11/37/387091137.db2.gz VCNBGHSHFCVGHA-SNVBAGLBSA-N 2 0 239.388 2.183 20 0 BEADRP COCC[C@H](C)[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000370132973 387092670 /nfs/dbraw/zinc/09/26/70/387092670.db2.gz PUUMVWOQUFQBOS-HSBZDZAISA-N 2 0 240.391 2.018 20 0 BEADRP COc1cc(C[NH2+]CCC[NH2+]C2CC2)ccc1C ZINC000228407328 387094185 /nfs/dbraw/zinc/09/41/85/387094185.db2.gz HTDODRCAKFNEES-UHFFFAOYSA-N 2 0 248.370 2.235 20 0 BEADRP CC(C)(C)C1CC([NH2+][C@H]2CCC[C@H]2[NH3+])C1 ZINC000335004773 387098620 /nfs/dbraw/zinc/09/86/20/387098620.db2.gz FPNMHTLLUQQXLE-HCWSGVFWSA-N 2 0 210.365 2.281 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H]2CC[C@@H](OC)C2)CC1 ZINC000188817810 387105271 /nfs/dbraw/zinc/10/52/71/387105271.db2.gz MGCBSLNPGAJOTL-UONOGXRCSA-N 2 0 240.391 2.018 20 0 BEADRP CO[C@@H]1CC[C@H]([NH2+]C2CC[NH+](C(C)C)CC2)C1 ZINC000188799406 387106010 /nfs/dbraw/zinc/10/60/10/387106010.db2.gz XYWUTYSOLVQBGF-UONOGXRCSA-N 2 0 240.391 2.016 20 0 BEADRP CCc1ccccc1C[N@@H+]1CC[C@H](C[NH2+]C)C1 ZINC000112706339 387108658 /nfs/dbraw/zinc/10/86/58/387108658.db2.gz IEFHJPYMZNTKOK-CYBMUJFWSA-N 2 0 232.371 2.290 20 0 BEADRP Cc1cc(C)c(CN2CCC[NH2+]CC2)cc1C ZINC000071536595 387109023 /nfs/dbraw/zinc/10/90/23/387109023.db2.gz UPZSPRUDRVNQAA-UHFFFAOYSA-N 2 0 232.371 2.407 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+]C1CCC(F)(F)CC1 ZINC000335028050 387120968 /nfs/dbraw/zinc/12/09/68/387120968.db2.gz VUGFMIXHXYJRNF-VHSXEESVSA-N 2 0 218.291 2.034 20 0 BEADRP Cc1cc(C[NH2+][C@@H]2CC[NH2+]CC[C@@H]2C)cc(C)n1 ZINC000335029124 387121889 /nfs/dbraw/zinc/12/18/89/387121889.db2.gz NHVQBHUAMXAIHK-XHDPSFHLSA-N 2 0 247.386 2.176 20 0 BEADRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]C1CCC(F)(F)CC1 ZINC000335028648 387122921 /nfs/dbraw/zinc/12/29/21/387122921.db2.gz XTVUNFJAGIUUKQ-KOLCDFICSA-N 2 0 232.318 2.281 20 0 BEADRP c1ccc(C[C@H]2CCC[C@H]2[NH2+]CC2C[NH2+]C2)cc1 ZINC000423301537 387132340 /nfs/dbraw/zinc/13/23/40/387132340.db2.gz HKHRHVOOWUBGJH-HZPDHXFCSA-N 2 0 244.382 2.207 20 0 BEADRP C[C@H](C[NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1)C(F)(F)F ZINC000643482101 387128240 /nfs/dbraw/zinc/12/82/40/387128240.db2.gz FIKZPXIHJZBSTD-KXUCPTDWSA-N 2 0 238.297 2.163 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H]1C[C@H](C)c2ccccc21 ZINC000423299619 387129437 /nfs/dbraw/zinc/12/94/37/387129437.db2.gz CCRWVTQJACDXOC-UHIISALHSA-N 2 0 218.344 2.419 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H]1C[C@@H](C)c2ccccc21 ZINC000423299617 387129605 /nfs/dbraw/zinc/12/96/05/387129605.db2.gz CCRWVTQJACDXOC-JTNHKYCSSA-N 2 0 218.344 2.419 20 0 BEADRP C[C@@H](Cc1ccc(Cl)cc1)[NH2+]CC1C[NH2+]C1 ZINC000423306140 387141790 /nfs/dbraw/zinc/14/17/90/387141790.db2.gz SCBNWHIYMONQRZ-JTQLQIEISA-N 2 0 238.762 2.080 20 0 BEADRP CCC[NH2+]CC[NH2+]C1CCC(CSC)CC1 ZINC000423308389 387143683 /nfs/dbraw/zinc/14/36/83/387143683.db2.gz JJKDSEOOWCHDDD-UHFFFAOYSA-N 2 0 244.448 2.497 20 0 BEADRP C[C@@H]([NH2+]CC1C[NH2+]C1)C1CCCCCC1 ZINC000423307409 387144433 /nfs/dbraw/zinc/14/44/33/387144433.db2.gz VZUSCLCNYAMXMH-LLVKDONJSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H](C)c1cccc(F)c1F ZINC000423310016 387145514 /nfs/dbraw/zinc/14/55/14/387145514.db2.gz RCTMCBVMZVSSGD-BDAKNGLRSA-N 2 0 228.286 2.210 20 0 BEADRP c1ccc(C[C@@H]2CC[C@@H]([NH2+]CC3C[NH2+]C3)C2)cc1 ZINC000423309366 387146618 /nfs/dbraw/zinc/14/66/18/387146618.db2.gz ZGSLSMGJNNFNQA-GOEBONIOSA-N 2 0 244.382 2.207 20 0 BEADRP C[C@H]([NH2+]CC1C[NH2+]C1)c1ccc2c(c1)CCC2 ZINC000423309051 387146656 /nfs/dbraw/zinc/14/66/56/387146656.db2.gz YRSCHKZAQCJDCJ-NSHDSACASA-N 2 0 230.355 2.045 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]C[C@@H]1Cc2ccccc2O1 ZINC000336792698 387147009 /nfs/dbraw/zinc/14/70/09/387147009.db2.gz TTYBROPMVHMJAS-JSGCOSHPSA-N 2 0 248.370 2.097 20 0 BEADRP CC[C@@H]([NH2+]C[C@H](C)C[NH3+])c1ccsc1 ZINC000423309230 387147103 /nfs/dbraw/zinc/14/71/03/387147103.db2.gz PXVYTPPUSWFWFV-MWLCHTKSSA-N 2 0 212.362 2.384 20 0 BEADRP CCC[NH2+]CC[NH2+][C@@H]1CC[C@H]1C(C)(C)C ZINC000423309031 387147114 /nfs/dbraw/zinc/14/71/14/387147114.db2.gz KUGCHSQSZAXCCI-VXGBXAGGSA-N 2 0 212.381 2.400 20 0 BEADRP [NH3+][C@@H](C[NH2+][C@H]1CCCC12CCCC2)C1CC1 ZINC000423310688 387148034 /nfs/dbraw/zinc/14/80/34/387148034.db2.gz ARPKBSQVPLZASF-STQMWFEESA-N 2 0 222.376 2.426 20 0 BEADRP CCC[NH2+]CC[NH2+][C@@H]1CCC[C@@H]2C[C@@]21C ZINC000423310789 387149795 /nfs/dbraw/zinc/14/97/95/387149795.db2.gz OLDDGODVOYNZMI-UPJWGTAASA-N 2 0 210.365 2.154 20 0 BEADRP CC(C)C[C@@H]1CCC[C@H]([NH2+]CC2C[NH2+]C2)C1 ZINC000423313896 387150700 /nfs/dbraw/zinc/15/07/00/387150700.db2.gz GHLACLWUPNUTDW-JSGCOSHPSA-N 2 0 224.392 2.400 20 0 BEADRP Cc1ccc(CN2CC[C@@H](C[NH+](C)C)C2)c(C)n1 ZINC000187037482 387152842 /nfs/dbraw/zinc/15/28/42/387152842.db2.gz NVKADUDPOILNBD-AWEZNQCLSA-N 2 0 247.386 2.082 20 0 BEADRP C[C@@H]1Cc2ccccc2[C@@H]1[NH2+]C[C@@H]([NH3+])C1CC1 ZINC000423314846 387153710 /nfs/dbraw/zinc/15/37/10/387153710.db2.gz HXZDLNSSXCOXSR-VCTAVGKDSA-N 2 0 230.355 2.247 20 0 BEADRP Cc1ncsc1CC[NH2+][C@@H](C)CCCC[NH3+] ZINC000391227273 387155828 /nfs/dbraw/zinc/15/58/28/387155828.db2.gz FDVSORYTQVZZTQ-JTQLQIEISA-N 2 0 241.404 2.101 20 0 BEADRP [NH3+]CCCC[NH2+][C@H](C1CC1)C1CCCC1 ZINC000423319362 387159161 /nfs/dbraw/zinc/15/91/61/387159161.db2.gz FCJGGIZVAPPSGI-ZDUSSCGKSA-N 2 0 210.365 2.284 20 0 BEADRP C[C@@H]([NH2+]CCCC[NH3+])c1ccc(Cl)cn1 ZINC000423317677 387159772 /nfs/dbraw/zinc/15/97/72/387159772.db2.gz CWTOSXDBPDZXLG-SECBINFHSA-N 2 0 227.739 2.125 20 0 BEADRP CC[C@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)C(C)C ZINC000423318664 387159919 /nfs/dbraw/zinc/15/99/19/387159919.db2.gz CUIGTRSULLEHIS-STQMWFEESA-N 2 0 212.381 2.400 20 0 BEADRP COc1ccsc1[C@@H](C)[NH2+]CCCC[NH3+] ZINC000423322909 387165693 /nfs/dbraw/zinc/16/56/93/387165693.db2.gz JEYSIPDROYKPJS-SECBINFHSA-N 2 0 228.361 2.146 20 0 BEADRP C[C@H]([NH2+]CC1C[NH2+]C1)c1cccc(C2CC2)c1 ZINC000423328124 387169329 /nfs/dbraw/zinc/16/93/29/387169329.db2.gz SAYLUYDERVPMAY-NSHDSACASA-N 2 0 230.355 2.434 20 0 BEADRP CCC[C@@H]([NH2+]C[C@H]1CC[NH2+]C1)C(C)(C)C ZINC000423330725 387175212 /nfs/dbraw/zinc/17/52/12/387175212.db2.gz GBVQJSJGBLFEDY-NWDGAFQWSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H](CCCc1cccnc1)[NH2+]CC1([NH3+])CCC1 ZINC000423331058 387176434 /nfs/dbraw/zinc/17/64/34/387176434.db2.gz OCKUQBUVENMZEW-ZDUSSCGKSA-N 2 0 247.386 2.264 20 0 BEADRP CCC[C@H]([NH2+]CC1C[NH2+]C1)C1CCCC1 ZINC000423331667 387176476 /nfs/dbraw/zinc/17/64/76/387176476.db2.gz USYUAMDBUPIKRO-ZDUSSCGKSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CCC[C@H]2C[NH+](C)CC[C@@H]21 ZINC000571842982 387181077 /nfs/dbraw/zinc/18/10/77/387181077.db2.gz YUXDJVKZWFCMJM-RQJABVFESA-N 2 0 222.376 2.059 20 0 BEADRP C[C@@H]1Cc2ccc(F)cc2[C@@H]1[NH2+]C[C@H]1CC[NH2+]C1 ZINC000423333660 387181194 /nfs/dbraw/zinc/18/11/94/387181194.db2.gz HZBQNJQDEXIIJH-JRPNMDOOSA-N 2 0 248.345 2.258 20 0 BEADRP CCCC(CCC)[NH2+]CC1=CC[NH2+]CC1 ZINC000423334877 387181574 /nfs/dbraw/zinc/18/15/74/387181574.db2.gz GCJPNLGUYMWGRA-UHFFFAOYSA-N 2 0 210.365 2.465 20 0 BEADRP C[C@H]([NH2+]CC1C[NH2+]C1)[C@H]1CCCC[C@H]1C ZINC000423334542 387181688 /nfs/dbraw/zinc/18/16/88/387181688.db2.gz WREWZSXIFUHTGE-MDZLAQPJSA-N 2 0 210.365 2.010 20 0 BEADRP CC(C)(C)[C@@H]1CC[C@H]1[NH2+]C[C@H]([NH3+])C1CC1 ZINC000423339732 387187186 /nfs/dbraw/zinc/18/71/86/387187186.db2.gz ZPLUEVFGGFZITN-GRYCIOLGSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H]([NH2+]CC1(C)CC[NH2+]CC1)C(C)(C)C ZINC000423338739 387187963 /nfs/dbraw/zinc/18/79/63/387187963.db2.gz UWCPXIJZZXSTFO-LLVKDONJSA-N 2 0 212.381 2.400 20 0 BEADRP CC(C)(C)[C@@H]1CC[C@@H]1[NH2+]C[C@@H]([NH3+])C1CC1 ZINC000423339734 387188936 /nfs/dbraw/zinc/18/89/36/387188936.db2.gz ZPLUEVFGGFZITN-UTUOFQBUSA-N 2 0 210.365 2.138 20 0 BEADRP CC[C@@H]([NH2+]CC1(C)CC[NH2+]CC1)C(C)C ZINC000423341016 387189660 /nfs/dbraw/zinc/18/96/60/387189660.db2.gz WHFDUINQFBHWLY-GFCCVEGCSA-N 2 0 212.381 2.400 20 0 BEADRP C1=C(C[NH2+][C@@H](C2CC2)C2CCCC2)CC[NH2+]C1 ZINC000423342084 387190052 /nfs/dbraw/zinc/19/00/52/387190052.db2.gz CSGCDPDPRJDBPR-OAHLLOKOSA-N 2 0 234.387 2.465 20 0 BEADRP CC[C@H]1CCC[C@@H]([NH2+]CC2=CC[NH2+]CC2)C1 ZINC000423340329 387190174 /nfs/dbraw/zinc/19/01/74/387190174.db2.gz JJXJVMVNJNHWMJ-GXTWGEPZSA-N 2 0 222.376 2.465 20 0 BEADRP CC[C@@H]([NH2+]CC1=CC[NH2+]CC1)c1ccc(F)cn1 ZINC000423341823 387190218 /nfs/dbraw/zinc/19/02/18/387190218.db2.gz KKDSTCYGUKZKNJ-CYBMUJFWSA-N 2 0 249.333 2.181 20 0 BEADRP C[C@@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)c1cccc(O)c1 ZINC000423341737 387190994 /nfs/dbraw/zinc/19/09/94/387190994.db2.gz MUDWVIXFJRGLLY-IUODEOHRSA-N 2 0 248.370 2.433 20 0 BEADRP C[C@H]([NH2+]CC1=CC[NH2+]CC1)C1CCCCC1 ZINC000423341109 387191105 /nfs/dbraw/zinc/19/11/05/387191105.db2.gz JXRNOWZJGKHLMQ-LBPRGKRZSA-N 2 0 222.376 2.465 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H]1c2ccccc2C[C@H]1C ZINC000423299936 387133031 /nfs/dbraw/zinc/13/30/31/387133031.db2.gz QODDEZIJDQBZIP-JTNHKYCSSA-N 2 0 218.344 2.104 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@@H](c1cccnc1)C1CCC1 ZINC000423301792 387134903 /nfs/dbraw/zinc/13/49/03/387134903.db2.gz GNAVGJYSWGBAIO-SMDDNHRTSA-N 2 0 233.359 2.107 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H](c1cccnc1)C1CCC1 ZINC000423301789 387135762 /nfs/dbraw/zinc/13/57/62/387135762.db2.gz GNAVGJYSWGBAIO-BXUZGUMPSA-N 2 0 233.359 2.107 20 0 BEADRP C[C@H](CCC1CCCC1)[NH2+]CC1C[NH2+]C1 ZINC000423302745 387135776 /nfs/dbraw/zinc/13/57/76/387135776.db2.gz KFTNCDPNKVYBHE-LLVKDONJSA-N 2 0 210.365 2.154 20 0 BEADRP COC[C@H](CC(C)C)[NH2+]CCC[N@H+](C)C(C)C ZINC000359636243 387137926 /nfs/dbraw/zinc/13/79/26/387137926.db2.gz HFUGSZAAFQLKLI-AWEZNQCLSA-N 2 0 244.423 2.367 20 0 BEADRP CC[C@H]([NH2+]CC1C[NH2+]C1)c1cccs1 ZINC000423304703 387139314 /nfs/dbraw/zinc/13/93/14/387139314.db2.gz OVOSVBPYZAXRKM-JTQLQIEISA-N 2 0 210.346 2.008 20 0 BEADRP C[C@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)c1cccnc1 ZINC000423351168 387203159 /nfs/dbraw/zinc/20/31/59/387203159.db2.gz YQHMLPQYSROWQJ-JSGCOSHPSA-N 2 0 233.359 2.122 20 0 BEADRP C1=C(C[NH2+][C@H](C2CC2)C2CCC2)CC[NH2+]C1 ZINC000423351767 387203718 /nfs/dbraw/zinc/20/37/18/387203718.db2.gz IZRQVQGRKGPNTE-AWEZNQCLSA-N 2 0 220.360 2.074 20 0 BEADRP C1=C(C[NH2+][C@@H]2CC[C@@H]2C2CCC2)CC[NH2+]C1 ZINC000423356411 387207017 /nfs/dbraw/zinc/20/70/17/387207017.db2.gz QOQIOLLPBBPMIM-ZIAGYGMSSA-N 2 0 220.360 2.074 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[NH2+]C[C@@H]1C)c1ccncc1 ZINC000423364603 387216467 /nfs/dbraw/zinc/21/64/67/387216467.db2.gz CNTOHMZDXWYFOT-FPMFFAJLSA-N 2 0 233.359 2.120 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@H](C)C1CCSCC1 ZINC000423367338 387217619 /nfs/dbraw/zinc/21/76/19/387217619.db2.gz AELMIUMZIQRCPZ-GHMZBOCLSA-N 2 0 230.421 2.106 20 0 BEADRP CC[N@H+](C)C[C@H]1CCN(Cc2ncccc2C)C1 ZINC000093178912 387218422 /nfs/dbraw/zinc/21/84/22/387218422.db2.gz NABVUUZITKKYKQ-CQSZACIVSA-N 2 0 247.386 2.164 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[NH2+][C@H](C)C1)c1ccccc1 ZINC000423368279 387221479 /nfs/dbraw/zinc/22/14/79/387221479.db2.gz FCPUWTXTUUUBFP-DYEKYZERSA-N 2 0 218.344 2.478 20 0 BEADRP COCC1CCC([NH2+][C@@H]2CCC[C@H]([NH3+])C2)CC1 ZINC000423368811 387221499 /nfs/dbraw/zinc/22/14/99/387221499.db2.gz NPNOGEPQLPFAHN-GNRIBBGQSA-N 2 0 240.391 2.051 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)[C@H]1C[C@H]1C ZINC000423368511 387221881 /nfs/dbraw/zinc/22/18/81/387221881.db2.gz BANWUWMLPXQWMB-KVSVUVNWSA-N 2 0 210.365 2.151 20 0 BEADRP CC[NH+](CC)CCSC[C@@H]1CC[N@H+](C)C1 ZINC000187690436 387223174 /nfs/dbraw/zinc/22/31/74/387223174.db2.gz NUILRHXYZKYIHZ-GFCCVEGCSA-N 2 0 230.421 2.013 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000423369350 387223638 /nfs/dbraw/zinc/22/36/38/387223638.db2.gz OKRJDZUFSVUMDP-RAIGVLPGSA-N 2 0 222.332 2.070 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)C1CCCC1 ZINC000423372289 387227203 /nfs/dbraw/zinc/22/72/03/387227203.db2.gz IFNUUSONVZECMX-NTZNESFSSA-N 2 0 210.365 2.295 20 0 BEADRP CC[C@@H]([NH2+]CCCC[NH+](C)C)C1CCC1 ZINC000322500317 259708073 /nfs/dbraw/zinc/70/80/73/259708073.db2.gz CCSLYIABXGZLHM-CYBMUJFWSA-N 2 0 212.381 2.497 20 0 BEADRP COc1ccc([C@H](C)[NH2+][C@H]2CC[NH2+][C@H](C)C2)cc1 ZINC000423398221 387231546 /nfs/dbraw/zinc/23/15/46/387231546.db2.gz VDBYKDPINWEYRS-DYEKYZERSA-N 2 0 248.370 2.486 20 0 BEADRP COc1ccc([C@H](C)[NH2+][C@@H]2CC[NH2+][C@H](C)C2)cc1 ZINC000423398222 387232688 /nfs/dbraw/zinc/23/26/88/387232688.db2.gz VDBYKDPINWEYRS-MBNYWOFBSA-N 2 0 248.370 2.486 20 0 BEADRP CC(C)CC[N@H+](C)CCC[NH+]1CCCC1 ZINC000120389285 387234030 /nfs/dbraw/zinc/23/40/30/387234030.db2.gz OQFHUZQDUUAZEJ-UHFFFAOYSA-N 2 0 212.381 2.450 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)CCCC[NH3+])c1ccncc1F ZINC000423428903 387253855 /nfs/dbraw/zinc/25/38/55/387253855.db2.gz JRVXMRCEORLYCX-WDEREUQCSA-N 2 0 239.338 2.389 20 0 BEADRP COC[C@H]([NH2+][C@H](C)CCCC[NH3+])C1CCCC1 ZINC000423425500 387251899 /nfs/dbraw/zinc/25/18/99/387251899.db2.gz GYVIOXURIMNTLY-OCCSQVGLSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@H]([NH2+]CC1=CC[NH2+]CC1)c1ccccc1 ZINC000423345916 387194880 /nfs/dbraw/zinc/19/48/80/387194880.db2.gz ONRPRYKZGBMVRO-LBPRGKRZSA-N 2 0 216.328 2.257 20 0 BEADRP Cc1cc([C@@H](C)[NH2+]CC2=CC[NH2+]CC2)c(C)o1 ZINC000423347559 387198083 /nfs/dbraw/zinc/19/80/83/387198083.db2.gz QPARKOHKQPLTHY-LLVKDONJSA-N 2 0 234.343 2.467 20 0 BEADRP C[C@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)[C@H]1C[C@H]1C ZINC000423348662 387200232 /nfs/dbraw/zinc/20/02/32/387200232.db2.gz UGXARFUCYAZQJI-MROQNXINSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+]C1CC(OC(C)(C)C)C1 ZINC000352556251 387309874 /nfs/dbraw/zinc/30/98/74/387309874.db2.gz XJGCFWFIFNSXDW-HIFPTAJRSA-N 2 0 242.407 2.262 20 0 BEADRP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)[C@H]1C[C@H]1C ZINC000321903022 387312844 /nfs/dbraw/zinc/31/28/44/387312844.db2.gz NYSWDCSEBISATE-JRBXHMHVSA-N 2 0 222.376 2.246 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCC[C@H]2CCC[NH2+]2)c2nccn21 ZINC000423472795 387319177 /nfs/dbraw/zinc/31/91/77/387319177.db2.gz GEFLBDPKKUIPIO-UPJWGTAASA-N 2 0 248.374 2.011 20 0 BEADRP CC(C)[C@@H]1CCC[C@@H]([NH2+][C@@H]2[C@H]3C[NH2+]C[C@H]32)C1 ZINC000423430238 387254209 /nfs/dbraw/zinc/25/42/09/387254209.db2.gz KSUATGJIRZMREP-POQQGIQPSA-N 2 0 222.376 2.009 20 0 BEADRP CCCC[C@H](C)[C@H](C)[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000423429479 387255242 /nfs/dbraw/zinc/25/52/42/387255242.db2.gz LOAZXTDEYORYOM-JZRPKSSGSA-N 2 0 210.365 2.009 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@H](c1ccccc1)C1CC1 ZINC000423470354 387316959 /nfs/dbraw/zinc/31/69/59/387316959.db2.gz PFTPWVSRNGPWAU-UONOGXRCSA-N 2 0 218.344 2.465 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CCCC2CC2)CC[N@@H+]1C ZINC000161713446 387259238 /nfs/dbraw/zinc/25/92/38/387259238.db2.gz WSAYBROODFHCRM-AAEUAGOBSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CCCC2CC2)CC[N@@H+]1C ZINC000161713193 387259808 /nfs/dbraw/zinc/25/98/08/387259808.db2.gz WSAYBROODFHCRM-WCQYABFASA-N 2 0 210.365 2.249 20 0 BEADRP CCCC[NH+]1CCC([NH2+][C@H]2CCO[C@H]2C)CC1 ZINC000120659276 387261569 /nfs/dbraw/zinc/26/15/69/387261569.db2.gz KKTSYRFGLFLFPN-JSGCOSHPSA-N 2 0 240.391 2.018 20 0 BEADRP COc1ccc([C@@H]([NH2+][C@@H](C)CN)C(C)C)cc1 ZINC000423380410 387261731 /nfs/dbraw/zinc/26/17/31/387261731.db2.gz YRSKUIBECDJYMX-FZMZJTMJSA-N 2 0 236.359 2.329 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCC23CCC3)CC[NH2+]1 ZINC000423388038 387270307 /nfs/dbraw/zinc/27/03/07/387270307.db2.gz SXGHAGWDAKVCBN-FRRDWIJNSA-N 2 0 222.376 2.439 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]CCc1ccccc1)C2 ZINC000263589584 387273321 /nfs/dbraw/zinc/27/33/21/387273321.db2.gz NIFBNIANYCOETB-MUJYYYPQSA-N 2 0 244.382 2.444 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H](C2CC2)C2CCC2)CC[NH2+]1 ZINC000423388158 387274190 /nfs/dbraw/zinc/27/41/90/387274190.db2.gz TZBXPDYGUAJKAP-LERXQTSPSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@@H]1CCC12CCCC2 ZINC000423389755 387274841 /nfs/dbraw/zinc/27/48/41/387274841.db2.gz JQMOGUDYFBUPFX-FRRDWIJNSA-N 2 0 222.376 2.297 20 0 BEADRP C[NH2+]CCC[NH2+][C@H]1CCCc2ccccc2C1 ZINC000643498559 387277970 /nfs/dbraw/zinc/27/79/70/387277970.db2.gz APMYSAHNPIKXQV-HNNXBMFYSA-N 2 0 232.371 2.133 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+]C1CCC2(CC2)CC1 ZINC000423392425 387279815 /nfs/dbraw/zinc/27/98/15/387279815.db2.gz QLPUIGIOONOUQU-LLVKDONJSA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@H]([NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21)C1CCCCC1 ZINC000423435076 387286239 /nfs/dbraw/zinc/28/62/39/387286239.db2.gz OPNVMVARBNFQEG-RFQIPJPRSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H]([NH2+]CC1(C)CC[NH+](C)CC1)[C@@H]1C[C@H]1C ZINC000321621603 387287080 /nfs/dbraw/zinc/28/70/80/387287080.db2.gz SEEWARAHKMMGKF-FRRDWIJNSA-N 2 0 224.392 2.352 20 0 BEADRP CCO[C@@H]1C[C@H]([NH2+][C@H](C)[C@H](C)[NH3+])C1(CC)CC ZINC000423439759 387289588 /nfs/dbraw/zinc/28/95/88/387289588.db2.gz IBNYYBBHXIOYHV-QNWHQSFQSA-N 2 0 242.407 2.296 20 0 BEADRP C[C@H]([NH3+])[C@H](C)[NH2+][C@@H]1CCC[C@H]1CCCF ZINC000423441263 387290673 /nfs/dbraw/zinc/29/06/73/387290673.db2.gz BESAOVKQPCWNNY-FIQHERPVSA-N 2 0 216.344 2.230 20 0 BEADRP CCSCC[N@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000121033880 387290755 /nfs/dbraw/zinc/29/07/55/387290755.db2.gz PLJLBKPLNICDAH-GFCCVEGCSA-N 2 0 230.421 2.013 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H]1CCCC12CCC2 ZINC000423446958 387294295 /nfs/dbraw/zinc/29/42/95/387294295.db2.gz CXSUCDKSUQVUBL-NEPJUHHUSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@H]([NH2+]CCC1=CC[NH2+]CC1)c1ccccn1 ZINC000423535399 387361013 /nfs/dbraw/zinc/36/10/13/387361013.db2.gz CXOSBKJEPVHMSY-LBPRGKRZSA-N 2 0 231.343 2.042 20 0 BEADRP C[C@@H]([NH2+]CCC[C@H]1CCC[NH2+]1)C1(C)CC1 ZINC000423480853 387361939 /nfs/dbraw/zinc/36/19/39/387361939.db2.gz NPYPZDTVJOAXIP-NEPJUHHUSA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@H]1C[C@@H](OCC(C)C)C1(C)C ZINC000423481617 387364131 /nfs/dbraw/zinc/36/41/31/387364131.db2.gz XAEABDCCFHBTPM-RWMBFGLXSA-N 2 0 242.407 2.153 20 0 BEADRP C[C@H]([NH2+]CCC1=CC[NH2+]CC1)c1ccc(F)cn1 ZINC000423538644 387364422 /nfs/dbraw/zinc/36/44/22/387364422.db2.gz NRVPCFSHMDEJAV-NSHDSACASA-N 2 0 249.333 2.181 20 0 BEADRP C[C@@H]([NH2+]CCC1=CC[NH2+]CC1)c1cncs1 ZINC000423540465 387365465 /nfs/dbraw/zinc/36/54/65/387365465.db2.gz QKHKCFKBAPNFIC-SNVBAGLBSA-N 2 0 237.372 2.104 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]CCC1=CC[NH2+]CC1 ZINC000423542052 387366078 /nfs/dbraw/zinc/36/60/78/387366078.db2.gz SRINUPDGDPXTEK-NSHDSACASA-N 2 0 208.349 2.074 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+]CCC1=CC[NH2+]CC1 ZINC000423542751 387368867 /nfs/dbraw/zinc/36/88/67/387368867.db2.gz UECONQDCULAEBD-CHWSQXEVSA-N 2 0 208.349 2.074 20 0 BEADRP Cc1cc(C[NH2+][C@H]2CCCC[C@@H]2C[NH3+])cc(C)n1 ZINC000423548889 387370145 /nfs/dbraw/zinc/37/01/45/387370145.db2.gz NAZZABMVZSNTTQ-CABCVRRESA-N 2 0 247.386 2.306 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCCC[NH2+]C1)[C@@H]1C[C@H]1C ZINC000423557695 387376369 /nfs/dbraw/zinc/37/63/69/387376369.db2.gz NNWLFXHMKXNBQH-LPWJVIDDSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]C[C@H]1CC12CCSCC2 ZINC000423564693 387377876 /nfs/dbraw/zinc/37/78/76/387377876.db2.gz YADHTHRCLWTXAS-QJPTWQEYSA-N 2 0 242.432 2.235 20 0 BEADRP C1CC([C@H]2CC[C@H]2[NH2+][C@H]2CCCC[NH2+]C2)C1 ZINC000423568603 387380839 /nfs/dbraw/zinc/38/08/39/387380839.db2.gz VQVXIVYWPIMVQO-BFHYXJOUSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[C@H]([NH3+])C1)c1cncs1 ZINC000423475547 387321091 /nfs/dbraw/zinc/32/10/91/387321091.db2.gz PYXUKNIXWPFKFX-DCAQKATOSA-N 2 0 239.388 2.311 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[C@@H]([NH3+])C1)c1cncs1 ZINC000423475548 387322012 /nfs/dbraw/zinc/32/20/12/387322012.db2.gz PYXUKNIXWPFKFX-GARJFASQSA-N 2 0 239.388 2.311 20 0 BEADRP C[C@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1ccncc1 ZINC000423477758 387323953 /nfs/dbraw/zinc/32/39/53/387323953.db2.gz KITUDVZOMFYHEP-JSGCOSHPSA-N 2 0 233.359 2.264 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@H](C)c1cncs1 ZINC000423430591 387325940 /nfs/dbraw/zinc/32/59/40/387325940.db2.gz LDKLPOHMAPQQRK-NXEZZACHSA-N 2 0 227.377 2.311 20 0 BEADRP C[C@@H]([NH3+])CN1CCC[C@@H]1c1ccc(F)cc1 ZINC000336501073 387326827 /nfs/dbraw/zinc/32/68/27/387326827.db2.gz OJAOFZHUAVLAHZ-ZWNOBZJWSA-N 2 0 222.307 2.310 20 0 BEADRP C[C@H]([NH2+]CCC[C@H]1CCC[NH2+]1)[C@H]1C[C@H]1C ZINC000423482676 387328250 /nfs/dbraw/zinc/32/82/50/387328250.db2.gz PNDLYVUITVUYNJ-VOAKCMCISA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H](Cc1ccoc1)[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000423487340 387334487 /nfs/dbraw/zinc/33/44/87/387334487.db2.gz UDKGYHYYLYAPSR-JSGCOSHPSA-N 2 0 236.359 2.332 20 0 BEADRP CCC[C@H]([NH2+]C[C@@H]1C[NH2+]CCCO1)C(C)(C)C ZINC000423495708 387337504 /nfs/dbraw/zinc/33/75/04/387337504.db2.gz UZZAQJOSCSPFDD-STQMWFEESA-N 2 0 242.407 2.169 20 0 BEADRP CCC[C@H]([NH2+]C[C@H]1C[NH2+]CCCO1)C(C)(C)C ZINC000423495706 387338176 /nfs/dbraw/zinc/33/81/76/387338176.db2.gz UZZAQJOSCSPFDD-OLZOCXBDSA-N 2 0 242.407 2.169 20 0 BEADRP COc1cccc([C@H](C)[NH2+][C@@H]2CC[C@@H](C[NH3+])C2)c1 ZINC000423496339 387338935 /nfs/dbraw/zinc/33/89/35/387338935.db2.gz WKVMDOKKNXKOEJ-OUCADQQQSA-N 2 0 248.370 2.473 20 0 BEADRP Cc1ccnc([C@H](C)[NH2+][C@H]2CC[C@@H](C[NH3+])C2)c1 ZINC000423501311 387339808 /nfs/dbraw/zinc/33/98/08/387339808.db2.gz JKDCLTHCUWRBIX-XQQFMLRXSA-N 2 0 233.359 2.168 20 0 BEADRP CC[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])C1)C1CCC1 ZINC000423499183 387340207 /nfs/dbraw/zinc/34/02/07/387340207.db2.gz HNVYOVCXHUDRMY-DRZSPHRISA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)=CCC[C@@H](C)[NH2+]C[C@H]1C[NH2+]CCCO1 ZINC000423506462 387344749 /nfs/dbraw/zinc/34/47/49/387344749.db2.gz GXSKKGYTBKSPPE-ZIAGYGMSSA-N 2 0 240.391 2.089 20 0 BEADRP CCOC[C@@H]1CCC[C@H]1[NH2+]CCCC[NH+](C)C ZINC000354211425 387346535 /nfs/dbraw/zinc/34/65/35/387346535.db2.gz MWEBYNWGJBECRM-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP CC[C@H]([NH2+]C1CCC([NH3+])CC1)[C@H]1C[C@H]1C ZINC000322006408 387350168 /nfs/dbraw/zinc/35/01/68/387350168.db2.gz HRQRJIVNKMTLCS-ZMZXKLSGSA-N 2 0 210.365 2.281 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+][C@H]1CC[C@@H](C[NH3+])C1 ZINC000423518605 387353485 /nfs/dbraw/zinc/35/34/85/387353485.db2.gz UZQMCWBFPZSTIK-XQQFMLRXSA-N 2 0 233.359 2.168 20 0 BEADRP CC(C)C1CC([NH2+][C@H]2CC[C@@H](C[NH3+])C2)C1 ZINC000423520451 387353837 /nfs/dbraw/zinc/35/38/37/387353837.db2.gz WBETWZODGNHYED-IGJPJIBNSA-N 2 0 210.365 2.138 20 0 BEADRP Cc1ccncc1CN(C)CC[C@H]1CCC[N@@H+]1C ZINC000361411876 387456690 /nfs/dbraw/zinc/45/66/90/387456690.db2.gz CMSAPRLVSLKYCA-OAHLLOKOSA-N 2 0 247.386 2.306 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H](C)c1ccc(OC)cc1 ZINC000515483276 387386854 /nfs/dbraw/zinc/38/68/54/387386854.db2.gz DBYZPVJYWDYZLM-LBPRGKRZSA-N 2 0 236.359 2.345 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CC(C)(C)[C@H]1CCCCO1 ZINC000643466830 387389727 /nfs/dbraw/zinc/38/97/27/387389727.db2.gz PTCAOPJZMLWNHQ-RWMBFGLXSA-N 2 0 242.407 2.297 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCCCC[C@@H]1[NH3+])C1CC1 ZINC000643468288 387419414 /nfs/dbraw/zinc/41/94/14/387419414.db2.gz IYGIPPILIMDYQG-KGYLQXTDSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)CCOCC[NH+]1CCC(CC[NH3+])CC1 ZINC000042427817 387508948 /nfs/dbraw/zinc/50/89/48/387508948.db2.gz HNGTVWCLPCZIJS-UHFFFAOYSA-N 2 0 242.407 2.110 20 0 BEADRP CO[C@@H]1CCC[C@H]([NH2+][C@H](C)CCCC[NH3+])C1 ZINC000643475371 387509139 /nfs/dbraw/zinc/50/91/39/387509139.db2.gz NPVCAZJSTKYHBG-FRRDWIJNSA-N 2 0 228.380 2.051 20 0 BEADRP CO[C@@H]1CCC[C@H]([NH2+][C@H]2CCCC[C@H]2C[NH3+])C1 ZINC000643475297 387509408 /nfs/dbraw/zinc/50/94/08/387509408.db2.gz CDZLOZZTSGAYSM-FQUUOJAGSA-N 2 0 240.391 2.051 20 0 BEADRP CO[C@H](C[N@@H+]1CC[C@H]([NH3+])[C@H](C)C1)c1ccccc1 ZINC000379181736 387524312 /nfs/dbraw/zinc/52/43/12/387524312.db2.gz GOZMZMXFSFDUDY-VHDGCEQUSA-N 2 0 248.370 2.043 20 0 BEADRP Cc1cc(C)c(C[NH2+][C@H]2CCCC[C@@H]2C[NH3+])cn1 ZINC000397026976 387533474 /nfs/dbraw/zinc/53/34/74/387533474.db2.gz OEZDZZFVFZPWOG-HIFRSBDPSA-N 2 0 247.386 2.306 20 0 BEADRP C[N@H+](CC1CC1)C[C@@H]1CCN(CC2(F)CC2)C1 ZINC000527219399 387538041 /nfs/dbraw/zinc/53/80/41/387538041.db2.gz WUWBHSYVJPIPOJ-ZDUSSCGKSA-N 2 0 240.366 2.152 20 0 BEADRP Cc1occc1C[NH2+][C@@H](C)CCCC[NH3+] ZINC000643472155 387485119 /nfs/dbraw/zinc/48/51/19/387485119.db2.gz AHEUWIYKRGXPBP-JTQLQIEISA-N 2 0 210.321 2.195 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CSC[C@@H]1C)C[NH+]1CCCC1 ZINC000304500477 387489986 /nfs/dbraw/zinc/48/99/86/387489986.db2.gz NFHKQLWMICYMIO-FRRDWIJNSA-N 2 0 242.432 2.059 20 0 BEADRP CC(C)C[C@@H]([NH3+])C[N@@H+]1CCSC[C@H](C)C1 ZINC000379553238 387585660 /nfs/dbraw/zinc/58/56/60/387585660.db2.gz VUEYIAAWISJDKH-VXGBXAGGSA-N 2 0 230.421 2.045 20 0 BEADRP CCC[NH+]1CCC(N(C)CC2(F)CC2)CC1 ZINC000527509616 387586718 /nfs/dbraw/zinc/58/67/18/387586718.db2.gz HAKWXAUIOKAWNL-UHFFFAOYSA-N 2 0 228.355 2.295 20 0 BEADRP CC[N@H+](C)C[C@H]1CCN(CCC(F)(F)F)C1 ZINC000355881391 387590052 /nfs/dbraw/zinc/59/00/52/387590052.db2.gz PTTWUJSNQAPNAO-SNVBAGLBSA-N 2 0 238.297 2.212 20 0 BEADRP CCC([NH3+])(CC)C[NH2+][C@@H]1CCC[C@@H](OC)C1 ZINC000643513775 387597743 /nfs/dbraw/zinc/59/77/43/387597743.db2.gz MSGDSLJOMVDWGB-VXGBXAGGSA-N 2 0 228.380 2.051 20 0 BEADRP CC[C@@H](Cc1cccs1)[NH2+]C[C@H](C)C[NH3+] ZINC000643514659 387599053 /nfs/dbraw/zinc/59/90/53/387599053.db2.gz LILBHLYEJGHKGM-MNOVXSKESA-N 2 0 226.389 2.254 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+]Cc1cccc(C2CC2)c1 ZINC000422551246 387599620 /nfs/dbraw/zinc/59/96/20/387599620.db2.gz DHWCZQQMDMTCKU-NSHDSACASA-N 2 0 218.344 2.248 20 0 BEADRP CC(C)C[C@@H](C)C[NH+]1CCC2(CC[NH2+]2)CC1 ZINC000422560674 387602272 /nfs/dbraw/zinc/60/22/72/387602272.db2.gz HMSVSLLDQCXJGV-CYBMUJFWSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[C@@H](C)[N@H+](Cc2cccc(N)c2)C[C@H]1C[NH3+] ZINC000422641334 387609945 /nfs/dbraw/zinc/60/99/45/387609945.db2.gz XQUJCNFXBUZMJN-YRGRVCCFSA-N 2 0 247.386 2.074 20 0 BEADRP CC(C)OCCC[N@@H+]1C[C@H](C[NH3+])[C@H](C)C[C@@H]1C ZINC000422639444 387609960 /nfs/dbraw/zinc/60/99/60/387609960.db2.gz STWJQDBILPSPEE-RDBSUJKOSA-N 2 0 242.407 2.107 20 0 BEADRP CSC1(C[NH+]2CCC([NH+](C)C)CC2)CCC1 ZINC000356086233 387614124 /nfs/dbraw/zinc/61/41/24/387614124.db2.gz AFEGPKYMXKUUOU-UHFFFAOYSA-N 2 0 242.432 2.298 20 0 BEADRP C[N@H+](CCC1CC[NH2+]CC1)Cc1cccc(O)c1 ZINC000567271799 387629408 /nfs/dbraw/zinc/62/94/08/387629408.db2.gz VMULNZRNMHHGAR-UHFFFAOYSA-N 2 0 248.370 2.214 20 0 BEADRP c1ccc([C@H](CC2CC2)[NH2+]CC2C[NH2+]C2)cc1 ZINC000643516015 387618538 /nfs/dbraw/zinc/61/85/38/387618538.db2.gz MRVOMEDJMAAUFP-HNNXBMFYSA-N 2 0 230.355 2.337 20 0 BEADRP CC[C@H](Cc1cccs1)[NH2+]C[C@@H]([NH3+])C1CC1 ZINC000643516416 387622558 /nfs/dbraw/zinc/62/25/58/387622558.db2.gz RNBGFFNRNHXVOY-DGCLKSJQSA-N 2 0 238.400 2.396 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[NH2+][C@@H]1CCC[C@@H]1[NH3+] ZINC000422708164 387623609 /nfs/dbraw/zinc/62/36/09/387623609.db2.gz XECHHJYFFCUHPW-FVCCEPFGSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[NH2+][C@@H]1CCC[C@H]1[NH3+] ZINC000422708163 387623976 /nfs/dbraw/zinc/62/39/76/387623976.db2.gz XECHHJYFFCUHPW-FDYHWXHSSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]Cc1cccc(N(C)C)c1 ZINC000422711943 387625428 /nfs/dbraw/zinc/62/54/28/387625428.db2.gz HVKZHEYSVAQYPW-ZDUSSCGKSA-N 2 0 249.402 2.360 20 0 BEADRP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)C(C)(C)C ZINC000422711561 387626721 /nfs/dbraw/zinc/62/67/21/387626721.db2.gz MWBJSEPZFLYZKN-YIBTVLSRSA-N 2 0 210.365 2.294 20 0 BEADRP CC(C)[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[NH2+]C2)C1 ZINC000422719358 387633376 /nfs/dbraw/zinc/63/33/76/387633376.db2.gz QWCMMFGDBNGKSZ-FRRDWIJNSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)[C@@H]1CCC[C@@H]([NH2+][C@@H]2CC[NH2+]C2)C1 ZINC000422719359 387633555 /nfs/dbraw/zinc/63/35/55/387633555.db2.gz QWCMMFGDBNGKSZ-JHJVBQTASA-N 2 0 210.365 2.153 20 0 BEADRP CCCCOCCC[NH2+]C1CCC(C[NH3+])CC1 ZINC000422725440 387635071 /nfs/dbraw/zinc/63/50/71/387635071.db2.gz BKESWTHLHOMPKA-UHFFFAOYSA-N 2 0 242.407 2.300 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCCC[C@H]1C)[C@H]1CCC[NH2+]1 ZINC000422726826 387635105 /nfs/dbraw/zinc/63/51/05/387635105.db2.gz GAMKZSUXASMUTL-YVECIDJPSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)C1CCCC1 ZINC000422732584 387639937 /nfs/dbraw/zinc/63/99/37/387639937.db2.gz PYPPABOGIADVLG-BKQLOGFTSA-N 2 0 222.376 2.438 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]CCCc1ccccc1 ZINC000422732241 387639994 /nfs/dbraw/zinc/63/99/94/387639994.db2.gz NOYPWQICDQRDED-ZIAGYGMSSA-N 2 0 218.344 2.089 20 0 BEADRP CC[C@H]([NH2+]CC1CCSCC1)[C@@H]1CCC[NH2+]1 ZINC000422735753 387642940 /nfs/dbraw/zinc/64/29/40/387642940.db2.gz VCVVOVZHUHYANH-STQMWFEESA-N 2 0 242.432 2.250 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H](C)C[C@@H](C)[NH3+] ZINC000422736014 387643141 /nfs/dbraw/zinc/64/31/41/387643141.db2.gz VMLJCKQWDAKJLG-RDBSUJKOSA-N 3 0 243.439 2.212 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCC[C@@H](C)C1)C1C[NH2+]C1 ZINC000422741250 387648363 /nfs/dbraw/zinc/64/83/63/387648363.db2.gz DBHYFYBYHBNFAW-FRRDWIJNSA-N 2 0 224.392 2.400 20 0 BEADRP Cc1ccccc1OCCC[NH2+][C@@H]1CCC[C@@H]1[NH3+] ZINC000422740801 387649049 /nfs/dbraw/zinc/64/90/49/387649049.db2.gz NFLFJMHOJBTKEL-UONOGXRCSA-N 2 0 248.370 2.233 20 0 BEADRP FCCCC[N@@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000377153637 387695452 /nfs/dbraw/zinc/69/54/52/387695452.db2.gz JZISHNCEROWBPW-CYBMUJFWSA-N 2 0 228.355 2.154 20 0 BEADRP Cc1ccccc1CC[NH2+][C@H](C)C[C@H](C)[NH3+] ZINC000422749866 387655995 /nfs/dbraw/zinc/65/59/95/387655995.db2.gz BFSQIZBMBUCPOP-QWHCGFSZSA-N 2 0 220.360 2.253 20 0 BEADRP COc1cc(C[NH2+][C@H](C)C[C@H](C)[NH3+])ccc1C ZINC000422753124 387659247 /nfs/dbraw/zinc/65/92/47/387659247.db2.gz DQGKNGBSBMZICD-NWDGAFQWSA-N 2 0 236.359 2.219 20 0 BEADRP CCOC[C@@H](C)[NH2+]C[C@H](C)C[NH+]1CCCCC1 ZINC000125627608 387659964 /nfs/dbraw/zinc/65/99/64/387659964.db2.gz ACSRTCXIIKNBKM-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP Cc1ccc(OCC[NH2+][C@H]2CCC[C@H]2C[NH3+])cc1 ZINC000422757442 387660116 /nfs/dbraw/zinc/66/01/16/387660116.db2.gz MUBCAQRKROLPJD-ZFWWWQNUSA-N 2 0 248.370 2.091 20 0 BEADRP CCOC[C@H](C)[NH2+]C[C@H](C)C[NH+]1CCCCC1 ZINC000125627768 387660365 /nfs/dbraw/zinc/66/03/65/387660365.db2.gz ACSRTCXIIKNBKM-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP CSCCCC[NH2+][C@H]1CC[NH2+]CC[C@H]1C ZINC000422758137 387660721 /nfs/dbraw/zinc/66/07/21/387660721.db2.gz NNQYTFCWTWQVHJ-NEPJUHHUSA-N 2 0 230.421 2.107 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]CCSc1ccccc1 ZINC000422756389 387660775 /nfs/dbraw/zinc/66/07/75/387660775.db2.gz CICKDKIUDCTSDV-OLZOCXBDSA-N 2 0 236.384 2.248 20 0 BEADRP CS[C@@H]1CCC[C@@H]([NH2+][C@H](C)[C@H]2CCC[NH2+]2)C1 ZINC000422758839 387661178 /nfs/dbraw/zinc/66/11/78/387661178.db2.gz KDMVPOLFLCCCOR-FDYHWXHSSA-N 2 0 242.432 2.391 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]CCc1cccc(Cl)c1 ZINC000422758390 387661912 /nfs/dbraw/zinc/66/19/12/387661912.db2.gz IYIXGXRXXGDAKT-CHWSQXEVSA-N 2 0 238.762 2.352 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CCc1cccs1 ZINC000422759457 387664009 /nfs/dbraw/zinc/66/40/09/387664009.db2.gz PCBKIXVGQJIRGA-VHSXEESVSA-N 2 0 212.362 2.006 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CCc1cccs1 ZINC000422759456 387664261 /nfs/dbraw/zinc/66/42/61/387664261.db2.gz PCBKIXVGQJIRGA-UWVGGRQHSA-N 2 0 212.362 2.006 20 0 BEADRP [NH3+][C@H]1CCCCC[C@H]1[NH2+]CCOc1ccccc1 ZINC000422764604 387664880 /nfs/dbraw/zinc/66/48/80/387664880.db2.gz VGXTZCZVNYEQLX-LSDHHAIUSA-N 2 0 248.370 2.315 20 0 BEADRP CC[C@H]([NH2+][C@@H](C)C1C[NH2+]C1)c1ccc(OC)cc1 ZINC000422767446 387668018 /nfs/dbraw/zinc/66/80/18/387668018.db2.gz RBNHVCJLHNELPC-NHYWBVRUSA-N 2 0 248.370 2.344 20 0 BEADRP CCO[C@@H]1C[C@H]([NH2+][C@H](C)CCC[NH3+])C12CCC2 ZINC000422788625 387668671 /nfs/dbraw/zinc/66/86/71/387668671.db2.gz VUTNHQOJXBPXQQ-FRRDWIJNSA-N 2 0 240.391 2.051 20 0 BEADRP COC(C)(C)[C@@H](C)[NH2+]CCC[NH+]1CCCCC1 ZINC000305970409 387668661 /nfs/dbraw/zinc/66/86/61/387668661.db2.gz JTDQOVJFYNJAMN-CYBMUJFWSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[C@@H](C)C1)C1C[NH2+]C1 ZINC000422772795 387669807 /nfs/dbraw/zinc/66/98/07/387669807.db2.gz ZOGVWVMIDFPBAH-GRYCIOLGSA-N 2 0 210.365 2.010 20 0 BEADRP CC(C)[C@H](C)C[NH2+][C@H]1CC[NH2+]CC[C@H]1C ZINC000422772765 387670182 /nfs/dbraw/zinc/67/01/82/387670182.db2.gz SVINCNQCXLYDNY-UPJWGTAASA-N 2 0 212.381 2.256 20 0 BEADRP CC(C)OCCC[NH2+][C@H]1CCCCC[C@@H]1[NH3+] ZINC000422773427 387670951 /nfs/dbraw/zinc/67/09/51/387670951.db2.gz ZVRPOTUNHNKTNS-STQMWFEESA-N 2 0 228.380 2.051 20 0 BEADRP CC[C@H]([NH2+]C[C@@H](C)C(C)C)[C@@H]1CCC[NH2+]1 ZINC000422774631 387672320 /nfs/dbraw/zinc/67/23/20/387672320.db2.gz XURLALZVJHHOEE-AGIUHOORSA-N 2 0 212.381 2.399 20 0 BEADRP CC(C)[C@H](C)C[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000422774351 387673348 /nfs/dbraw/zinc/67/33/48/387673348.db2.gz WRSBQVPAACCVCE-FKJOKYEKSA-N 2 0 210.365 2.151 20 0 BEADRP Cc1ccccc1O[C@H](C)C[NH2+][C@@H]1CCC[C@H]1[NH3+] ZINC000422795548 387695976 /nfs/dbraw/zinc/69/59/76/387695976.db2.gz VYCUWKIIKOHHGF-MGPQQGTHSA-N 2 0 248.370 2.232 20 0 BEADRP COc1ccc([C@H](C)[NH2+][C@@H](C)C[C@@H](C)[NH3+])cc1 ZINC000422777275 387674024 /nfs/dbraw/zinc/67/40/24/387674024.db2.gz FGIVLPMDBJETIX-WOPDTQHZSA-N 2 0 236.359 2.472 20 0 BEADRP [NH3+][C@H]1CCCCC[C@@H]1[NH2+]CCCOCC1CC1 ZINC000422780029 387678282 /nfs/dbraw/zinc/67/82/82/387678282.db2.gz GQSIKYSVFIMZNE-KBPBESRZSA-N 2 0 240.391 2.053 20 0 BEADRP CC(C)COCCC[NH2+][C@H]1CCCCC[C@H]1[NH3+] ZINC000422781380 387681293 /nfs/dbraw/zinc/68/12/93/387681293.db2.gz ITNLZLLBXWRWFT-KGLIPLIRSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]Cc1cccc2cccnc21 ZINC000422781217 387681462 /nfs/dbraw/zinc/68/14/62/387681462.db2.gz LDUSBSMSUQJFKN-VXGBXAGGSA-N 2 0 243.354 2.450 20 0 BEADRP Cc1cc(C)cc(CC[NH2+][C@@H]2CCC[C@@H]2[NH3+])c1 ZINC000422783817 387684756 /nfs/dbraw/zinc/68/47/56/387684756.db2.gz NGVXXFMBIKPJHT-LSDHHAIUSA-N 2 0 232.371 2.315 20 0 BEADRP C[C@@H]([NH2+]CC1CC[NH+](C)CC1)c1ccncc1 ZINC000044515593 387684901 /nfs/dbraw/zinc/68/49/01/387684901.db2.gz USSWGNXEVAJQDE-GFCCVEGCSA-N 2 0 233.359 2.074 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCC[C@H]1[NH3+])c1ccc(F)cc1 ZINC000422744192 387691326 /nfs/dbraw/zinc/69/13/26/387691326.db2.gz SOGZBOHENDYSGU-LERXQTSPSA-N 2 0 236.334 2.399 20 0 BEADRP CC[C@H]([NH2+][C@@H](C)CCC[NH3+])c1ccncc1 ZINC000422792448 387693072 /nfs/dbraw/zinc/69/30/72/387693072.db2.gz XANIAUASQWFTGW-AAEUAGOBSA-N 2 0 221.348 2.250 20 0 BEADRP CC(C)COCCC[NH2+][C@@H]1CC[NH2+]CC[C@@H]1C ZINC000422795072 387696685 /nfs/dbraw/zinc/69/66/85/387696685.db2.gz ZPFIJJYQQFAXNM-UONOGXRCSA-N 2 0 242.407 2.027 20 0 BEADRP CCc1ccccc1C[NH2+][C@H](C)C[C@@H](C)[NH3+] ZINC000422790583 387693904 /nfs/dbraw/zinc/69/39/04/387693904.db2.gz VBGKFUMGDQOELI-VXGBXAGGSA-N 2 0 220.360 2.464 20 0 BEADRP Cc1ccc(OCCC[NH2+][C@@H]2CCC[C@H]2[NH3+])cc1 ZINC000422860461 387744076 /nfs/dbraw/zinc/74/40/76/387744076.db2.gz MKBRHGMIVQSKFR-HUUCEWRRSA-N 2 0 248.370 2.233 20 0 BEADRP CC[C@H]([NH2+][C@@H](C)[C@@H]1CC[NH2+]C1)C(C)(C)C ZINC000422865613 387746694 /nfs/dbraw/zinc/74/66/94/387746694.db2.gz YTYKUMRDLFDCSW-TUAOUCFPSA-N 2 0 212.381 2.399 20 0 BEADRP CC[C@H]([NH2+][C@H](C)[C@H]1CC[NH2+]C1)C(C)(C)C ZINC000422865615 387747144 /nfs/dbraw/zinc/74/71/44/387747144.db2.gz YTYKUMRDLFDCSW-WOPDTQHZSA-N 2 0 212.381 2.399 20 0 BEADRP Cc1cc(F)ccc1CC[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000422867938 387750726 /nfs/dbraw/zinc/75/07/26/387750726.db2.gz TWSMJRNFZJBVBF-RYUDHWBXSA-N 2 0 238.350 2.392 20 0 BEADRP COC[C@H](C)[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000123497859 387700884 /nfs/dbraw/zinc/70/08/84/387700884.db2.gz BHJQUVGLQWGWAG-ZDUSSCGKSA-N 2 0 242.407 2.075 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCCc2ccccc21)C1C[NH2+]C1 ZINC000422802588 387701597 /nfs/dbraw/zinc/70/15/97/387701597.db2.gz HNVVPNJICZFQMU-GXTWGEPZSA-N 2 0 244.382 2.304 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCCc2ccccc21)C1C[NH2+]C1 ZINC000422802589 387702329 /nfs/dbraw/zinc/70/23/29/387702329.db2.gz HNVVPNJICZFQMU-JSGCOSHPSA-N 2 0 244.382 2.304 20 0 BEADRP COC[C@@H](C)[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000123498107 387703176 /nfs/dbraw/zinc/70/31/76/387703176.db2.gz BHJQUVGLQWGWAG-CYBMUJFWSA-N 2 0 242.407 2.075 20 0 BEADRP CCO[C@@H](CC[NH2+][C@@H](C)[C@@H]1CCC[NH2+]1)C(C)C ZINC000422806074 387704925 /nfs/dbraw/zinc/70/49/25/387704925.db2.gz HTJWMEJMNJUYRE-IHRRRGAJSA-N 2 0 242.407 2.168 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]Cc1cccc(F)c1 ZINC000422805570 387705067 /nfs/dbraw/zinc/70/50/67/387705067.db2.gz JMLPLGGWTPRHRT-ZJUUUORDSA-N 2 0 210.296 2.041 20 0 BEADRP C[C@H](Cc1cccs1)[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000422809411 387707780 /nfs/dbraw/zinc/70/77/80/387707780.db2.gz PQLCXJTXHUUGCC-GARJFASQSA-N 2 0 226.389 2.395 20 0 BEADRP CC(C)CCC[NH2+][C@H]1CC[NH2+]CC[C@@H]1C ZINC000422812914 387711049 /nfs/dbraw/zinc/71/10/49/387711049.db2.gz YIOYZIYDPVJBBU-STQMWFEESA-N 2 0 212.381 2.400 20 0 BEADRP C[C@]12C[N@H+](CCn3ccnc3)C[C@H]1[C@@H]1CC[C@H]2C1 ZINC000452042311 387711357 /nfs/dbraw/zinc/71/13/57/387711357.db2.gz FGIWVSBQFIZJAH-CBBWQLFWSA-N 2 0 245.370 2.251 20 0 BEADRP CC[C@@H]1CCCC[C@@H]1[NH2+][C@H](C)C1C[NH2+]C1 ZINC000422812165 387712288 /nfs/dbraw/zinc/71/22/88/387712288.db2.gz QBMLRZBXOLTTSF-WZRBSPASSA-N 2 0 210.365 2.153 20 0 BEADRP CC[NH+](CC)CCC[N@@H+]1CCCC[C@@H]1COC ZINC000452047184 387713221 /nfs/dbraw/zinc/71/32/21/387713221.db2.gz ZKRHDIFZKVWJSE-CQSZACIVSA-N 2 0 242.407 2.219 20 0 BEADRP CC[NH+](CC)CCC[N@@H+]1CCCC[C@H]1COC ZINC000452047183 387713756 /nfs/dbraw/zinc/71/37/56/387713756.db2.gz ZKRHDIFZKVWJSE-AWEZNQCLSA-N 2 0 242.407 2.219 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[NH2+]CC1)C1CCSCC1 ZINC000643522571 387718619 /nfs/dbraw/zinc/71/86/19/387718619.db2.gz PNMJAISLZFFNCE-WCQYABFASA-N 2 0 242.432 2.250 20 0 BEADRP Cc1cncc([C@H](C)[NH2+][C@@H]2CCC[NH2+]CC2)c1 ZINC000643523303 387722928 /nfs/dbraw/zinc/72/29/28/387722928.db2.gz ZYTZSDZAFUNRCJ-GXTWGEPZSA-N 2 0 233.359 2.183 20 0 BEADRP COCc1cccc(C[NH2+][C@@H](C)C[C@@H](C)[NH3+])c1 ZINC000422879376 387755639 /nfs/dbraw/zinc/75/56/39/387755639.db2.gz KHUITWSUTCHGBV-NEPJUHHUSA-N 2 0 236.359 2.048 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)[C@H]1CC12CC2 ZINC000527862165 387738175 /nfs/dbraw/zinc/73/81/75/387738175.db2.gz NKFANLPBBKSVMO-RWMBFGLXSA-N 2 0 222.376 2.106 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)[C@@H]1CC12CC2 ZINC000527862162 387738618 /nfs/dbraw/zinc/73/86/18/387738618.db2.gz NKFANLPBBKSVMO-AVGNSLFASA-N 2 0 222.376 2.106 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@H](C)[C@@H]1CCCOC1 ZINC000356877081 387739212 /nfs/dbraw/zinc/73/92/12/387739212.db2.gz RVNCSHIRFXTCBH-ZIAGYGMSSA-N 2 0 242.407 2.121 20 0 BEADRP Cc1ccc([C@H](C)[NH2+][C@H]2CC[NH2+]C[C@@H]2C)c(C)n1 ZINC000643524916 387741365 /nfs/dbraw/zinc/74/13/65/387741365.db2.gz WXBPPUUHUSJOEW-XEGUGMAKSA-N 2 0 247.386 2.347 20 0 BEADRP C[C@H]([NH3+])C[NH2+][C@H]1CCCCC12CCCC2 ZINC000643527599 387764894 /nfs/dbraw/zinc/76/48/94/387764894.db2.gz OZYABOPWSTVTKP-RYUDHWBXSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@H]([NH3+])C[NH2+][C@@H](C)CCc1ccsc1 ZINC000643527935 387765199 /nfs/dbraw/zinc/76/51/99/387765199.db2.gz VULBDYDQUYAISJ-UWVGGRQHSA-N 2 0 212.362 2.006 20 0 BEADRP CSc1ccccc1C[C@H](C)[NH2+]C[C@@H](C)[NH3+] ZINC000643527623 387767026 /nfs/dbraw/zinc/76/70/26/387767026.db2.gz PIDXUNXXONOWOX-MNOVXSKESA-N 2 0 238.400 2.276 20 0 BEADRP C[N@@H+]1CC[C@@]2(CC[NH+](CC3=CCCC3)C2)C1 ZINC000645922183 387767188 /nfs/dbraw/zinc/76/71/88/387767188.db2.gz HKIGDKAWUUUWOG-CQSZACIVSA-N 2 0 220.360 2.124 20 0 BEADRP C[C@H](C[C@@H]1CCCO1)[NH2+][C@H]1CCCC[C@H]1C[NH3+] ZINC000422904442 387767677 /nfs/dbraw/zinc/76/76/77/387767677.db2.gz PYLOCCUTFQRFSC-RFGFWPKPSA-N 2 0 240.391 2.051 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CCc2ccccc21 ZINC000422909039 387768489 /nfs/dbraw/zinc/76/84/89/387768489.db2.gz NKBGUJAIULGZMX-CFVMTHIKSA-N 2 0 230.355 2.186 20 0 BEADRP Cc1ccc(C[C@H]([NH2+]C[C@H](C)[NH3+])C(C)C)cc1 ZINC000643528628 387768833 /nfs/dbraw/zinc/76/88/33/387768833.db2.gz MENAHISGNFWWND-ZFWWWQNUSA-N 2 0 234.387 2.499 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CCc2ccccc21)[C@@H]1CCC[NH2+]1 ZINC000422909021 387769946 /nfs/dbraw/zinc/76/99/46/387769946.db2.gz NITNSTQYKYTYMU-XPKDYRNWSA-N 2 0 244.382 2.447 20 0 BEADRP CC[C@H](Cc1ccc(C)cc1)[NH2+]C[C@H](C)[NH3+] ZINC000643528559 387770392 /nfs/dbraw/zinc/77/03/92/387770392.db2.gz LLLGZSHSIXNOJW-GXTWGEPZSA-N 2 0 220.360 2.253 20 0 BEADRP C[C@@H]([NH2+]CC1(C)CC[NH+](C)CC1)[C@H]1CC12CC2 ZINC000527889011 387772469 /nfs/dbraw/zinc/77/24/69/387772469.db2.gz WQJQZHCYROVFAB-CHWSQXEVSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]([NH3+])C[NH2+][C@H]1CCCC12CCCCC2 ZINC000643529606 387776481 /nfs/dbraw/zinc/77/64/81/387776481.db2.gz GEDDXKIVKAPUMB-NEPJUHHUSA-N 2 0 210.365 2.426 20 0 BEADRP CCC[C@H](Cc1ccccc1)[NH2+]C[C@H](C)[NH3+] ZINC000643529319 387777580 /nfs/dbraw/zinc/77/75/80/387777580.db2.gz YNLWHDNZFRAJMI-GXTWGEPZSA-N 2 0 220.360 2.335 20 0 BEADRP C[C@H]([NH2+]CCC1=CCCCC1)C1C[NH2+]C1 ZINC000422961627 387812442 /nfs/dbraw/zinc/81/24/42/387812442.db2.gz COJSLXUPBHGAKP-NSHDSACASA-N 2 0 208.349 2.074 20 0 BEADRP C[C@H]1CN(C2CC2)C[C@H]1[NH2+]CC1CC=CC1 ZINC000527942040 387781671 /nfs/dbraw/zinc/78/16/71/387781671.db2.gz APHRRBBWKPBFLN-SMDDNHRTSA-N 2 0 220.360 2.025 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+]CC1(C2CC2)CC1 ZINC000422937756 387782917 /nfs/dbraw/zinc/78/29/17/387782917.db2.gz OPWOBFKZMOXHQJ-AAEUAGOBSA-N 2 0 222.376 2.154 20 0 BEADRP CCOCCC1(C[NH2+][C@@H]2CCC[C@H]2[NH3+])CCC1 ZINC000422937993 387783491 /nfs/dbraw/zinc/78/34/91/387783491.db2.gz KKVCJMVWKZMXJL-CHWSQXEVSA-N 2 0 240.391 2.053 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H]1CCc2c1cccc2O ZINC000422979134 387789448 /nfs/dbraw/zinc/78/94/48/387789448.db2.gz LJHJUUUCGLCREL-ZWNOBZJWSA-N 2 0 234.343 2.097 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@H]1CCc2c1cccc2O ZINC000422981458 387793229 /nfs/dbraw/zinc/79/32/29/387793229.db2.gz SWVCEXZTWDJUBS-CWSCBRNRSA-N 2 0 234.343 2.095 20 0 BEADRP Cc1ccc(CC[NH2+][C@H]2CCC[C@H]2C[NH3+])cc1 ZINC000422983810 387793993 /nfs/dbraw/zinc/79/39/93/387793993.db2.gz VDCNUTOGDNGUQD-GJZGRUSLSA-N 2 0 232.371 2.255 20 0 BEADRP C[C@@H]([NH2+]CCN1CC[C@H](C)C1)C1CCCC1 ZINC000309506223 387812939 /nfs/dbraw/zinc/81/29/39/387812939.db2.gz VZBOYDTZHKNVSZ-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]([NH2+]CC1Cc2ccccc2C1)[C@H]1CCC[NH2+]1 ZINC000422984760 387795233 /nfs/dbraw/zinc/79/52/33/387795233.db2.gz ZCVQFDBSNTYQHV-BLLLJJGKSA-N 2 0 244.382 2.132 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@H]1CCCC(F)(F)C1 ZINC000422985917 387795970 /nfs/dbraw/zinc/79/59/70/387795970.db2.gz BAJLYLBUKMCFSZ-AEJSXWLSSA-N 2 0 220.307 2.280 20 0 BEADRP CCC[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1)OCC ZINC000527934707 387796523 /nfs/dbraw/zinc/79/65/23/387796523.db2.gz SZSVQYPRCSWBCR-MGPQQGTHSA-N 2 0 242.407 2.264 20 0 BEADRP C[C@@H]1C[C@H](C[NH2+][C@H]2CCCCC[C@@H]2[NH3+])CCO1 ZINC000422985566 387796707 /nfs/dbraw/zinc/79/67/07/387796707.db2.gz FIKMFECAKCDVRV-MQYQWHSLSA-N 2 0 240.391 2.051 20 0 BEADRP CCOc1cccc(CC[NH2+][C@@H]2CCC[C@H]2[NH3+])c1 ZINC000422991761 387799550 /nfs/dbraw/zinc/79/95/50/387799550.db2.gz BOFBPJDKMPRAEN-HUUCEWRRSA-N 2 0 248.370 2.097 20 0 BEADRP CCOc1cccc(CC[NH2+][C@H]2CCC[C@H]2[NH3+])c1 ZINC000422991759 387799804 /nfs/dbraw/zinc/79/98/04/387799804.db2.gz BOFBPJDKMPRAEN-CABCVRRESA-N 2 0 248.370 2.097 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+][C@@H]1CC=CCC1 ZINC000422991135 387800546 /nfs/dbraw/zinc/80/05/46/387800546.db2.gz OHYOMKDOEAKCIF-UPJWGTAASA-N 2 0 208.349 2.345 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC=CCC1)[C@@H]1CCCC[NH2+]1 ZINC000422990514 387800722 /nfs/dbraw/zinc/80/07/22/387800722.db2.gz NQUMITAELWXBJG-AGIUHOORSA-N 2 0 208.349 2.215 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC=CCC1)[C@@H]1CCCC[NH2+]1 ZINC000422990517 387801060 /nfs/dbraw/zinc/80/10/60/387801060.db2.gz NQUMITAELWXBJG-UPJWGTAASA-N 2 0 208.349 2.215 20 0 BEADRP CCC(CC)[C@@H](CC[NH2+][C@@H](C)C1C[NH2+]C1)OC ZINC000422995567 387801665 /nfs/dbraw/zinc/80/16/65/387801665.db2.gz KJJJPETUQVBIJO-SMDDNHRTSA-N 2 0 242.407 2.025 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CCCc1ccccn1 ZINC000422996349 387801684 /nfs/dbraw/zinc/80/16/84/387801684.db2.gz LLXJKCJVOPHZEX-CYBMUJFWSA-N 2 0 235.375 2.121 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CCc2ccccc2C1 ZINC000643478048 387802703 /nfs/dbraw/zinc/80/27/03/387802703.db2.gz PURWDMFUIIFXDD-WQVCFCJDSA-N 2 0 244.382 2.261 20 0 BEADRP CC[C@H]([NH2+]CCCc1ccccn1)[C@@H]1CCC[NH2+]1 ZINC000422994879 387803179 /nfs/dbraw/zinc/80/31/79/387803179.db2.gz IVRANDIWIYBLHX-GJZGRUSLSA-N 2 0 247.386 2.134 20 0 BEADRP Cc1cccc(C)c1OCC[NH2+][C@@H]1CCC[C@@H]1[NH3+] ZINC000422948670 387807769 /nfs/dbraw/zinc/80/77/69/387807769.db2.gz RVFCMYDZOWRZOH-UONOGXRCSA-N 2 0 248.370 2.152 20 0 BEADRP Cc1ccc2c(c1C)OC[C@@H]2[NH2+][C@H](C)C[C@H](C)[NH3+] ZINC000422958084 387810124 /nfs/dbraw/zinc/81/01/24/387810124.db2.gz OMXXVVQNTPRNMA-WDMOLILDSA-N 2 0 248.370 2.452 20 0 BEADRP CSC1(C[NH2+]C2CC[NH+](C(C)C)CC2)CC1 ZINC000193827360 387810408 /nfs/dbraw/zinc/81/04/08/387810408.db2.gz LWQVRCATNRWNKT-UHFFFAOYSA-N 2 0 242.432 2.344 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)CCc1ccco1)[C@@H]1CCC[NH2+]1 ZINC000422961983 387810894 /nfs/dbraw/zinc/81/08/94/387810894.db2.gz DRRIMISLMSPQNS-SCRDCRAPSA-N 2 0 236.359 2.331 20 0 BEADRP CCOc1cccc(C[NH2+][C@@H](C)C[C@@H](C)[NH3+])c1 ZINC000422882721 387758290 /nfs/dbraw/zinc/75/82/90/387758290.db2.gz SUUZKDWFRSFKIK-NEPJUHHUSA-N 2 0 236.359 2.301 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@@H](C)[C@@H]2CC23CC3)CC1 ZINC000527859003 387758487 /nfs/dbraw/zinc/75/84/87/387758487.db2.gz NXTXMFZJFALOKQ-JSGCOSHPSA-N 2 0 236.403 2.497 20 0 BEADRP COc1cccc2c1CC[C@@H]2[NH2+][C@@H](C)CCC[NH3+] ZINC000422887166 387760230 /nfs/dbraw/zinc/76/02/30/387760230.db2.gz KENNDBHBIFBXAD-FZMZJTMJSA-N 2 0 248.370 2.400 20 0 BEADRP C[C@H]([NH3+])CN(Cc1cccc(F)c1)C1CC1 ZINC000442665790 387820173 /nfs/dbraw/zinc/82/01/73/387820173.db2.gz NXYLBDCVIZMMRB-JTQLQIEISA-N 2 0 222.307 2.137 20 0 BEADRP Cc1occc1C[NH2+]CCC1CC[NH+](C)CC1 ZINC000320973959 387821356 /nfs/dbraw/zinc/82/13/56/387821356.db2.gz GOXZSHLQBVXPBR-UHFFFAOYSA-N 2 0 236.359 2.410 20 0 BEADRP C[C@@H]1C[C@H]1C[N@@H+]1CCC[C@@H]([NH+](C)C)CC1 ZINC000432796993 387821666 /nfs/dbraw/zinc/82/16/66/387821666.db2.gz JMJIMIQSQHVICG-FRRDWIJNSA-N 2 0 210.365 2.059 20 0 BEADRP CCCC(O)(CCC)C[NH2+][C@H]1CCC[C@@H]1C[NH3+] ZINC000422974981 387824137 /nfs/dbraw/zinc/82/41/37/387824137.db2.gz FVTBDCJFIAHTPN-OLZOCXBDSA-N 2 0 242.407 2.035 20 0 BEADRP CCC(CC)(CO)C[NH2+][C@H]1CCCCC[C@@H]1[NH3+] ZINC000423003470 387826929 /nfs/dbraw/zinc/82/69/29/387826929.db2.gz MGCOALGUNMECBC-STQMWFEESA-N 2 0 242.407 2.035 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](C)Cc1ccoc1 ZINC000423007920 387831757 /nfs/dbraw/zinc/83/17/57/387831757.db2.gz RVFNHAGFHTWVBN-RYUDHWBXSA-N 2 0 224.348 2.318 20 0 BEADRP CC(C)CSCCC[NH2+][C@@H]1CCC[C@H]1C[NH3+] ZINC000423012190 387835662 /nfs/dbraw/zinc/83/56/62/387835662.db2.gz KGAXVWBRZURPLX-QWHCGFSZSA-N 2 0 244.448 2.483 20 0 BEADRP CCc1cnccc1[C@@H](C)[NH2+][C@H](C)CCC[NH3+] ZINC000423012628 387836302 /nfs/dbraw/zinc/83/63/02/387836302.db2.gz DHNYHSQNXJFDGG-VXGBXAGGSA-N 2 0 235.375 2.422 20 0 BEADRP COc1cc(F)cc(C[NH2+][C@@H](C)C[C@@H](C)[NH3+])c1 ZINC000423015676 387838032 /nfs/dbraw/zinc/83/80/32/387838032.db2.gz LDYZBIUTJYEXMB-ZJUUUORDSA-N 2 0 240.322 2.050 20 0 BEADRP CC[C@H]([NH2+][C@H](C)C[C@H](C)[NH3+])c1c(C)noc1C ZINC000423015251 387838239 /nfs/dbraw/zinc/83/82/39/387838239.db2.gz QOFGEFJVXCXNJQ-SBMIAAHKSA-N 2 0 239.363 2.458 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]1[NH2+]CCC1Cc2ccccc2C1 ZINC000423016290 387838987 /nfs/dbraw/zinc/83/89/87/387838987.db2.gz SRZBDSFWJZUVOT-HOTGVXAUSA-N 2 0 244.382 2.261 20 0 BEADRP Cc1ccsc1CC[NH2+][C@@H](C)CCC[NH3+] ZINC000423015189 387839442 /nfs/dbraw/zinc/83/94/42/387839442.db2.gz KFGGILPEGIHEPS-NSHDSACASA-N 2 0 226.389 2.316 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@H](c1cccnc1)C1CC1 ZINC000423017029 387841723 /nfs/dbraw/zinc/84/17/23/387841723.db2.gz VHSJCMDYMBKXNJ-FZMZJTMJSA-N 2 0 233.359 2.250 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]CC12CCC(CC1)C2 ZINC000423018758 387841997 /nfs/dbraw/zinc/84/19/97/387841997.db2.gz ZQIFPHIMFYWNMI-HIFPTAJRSA-N 2 0 210.365 2.284 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CC12CCC(CC1)C2 ZINC000423018759 387842093 /nfs/dbraw/zinc/84/20/93/387842093.db2.gz ZQIFPHIMFYWNMI-PNESKVBLSA-N 2 0 210.365 2.284 20 0 BEADRP CS[C@@H](C[NH2+][C@@H](C)[C@H]1CCC[NH2+]1)C(C)(C)C ZINC000423025909 387843091 /nfs/dbraw/zinc/84/30/91/387843091.db2.gz AGIKMNRPPJPYJF-TUAOUCFPSA-N 2 0 244.448 2.494 20 0 BEADRP CS[C@@H](C[NH2+][C@H](C)[C@H]1CCC[NH2+]1)C(C)(C)C ZINC000423025911 387843463 /nfs/dbraw/zinc/84/34/63/387843463.db2.gz AGIKMNRPPJPYJF-UTUOFQBUSA-N 2 0 244.448 2.494 20 0 BEADRP CS[C@@H](C[NH2+][C@@H](C)[C@@H]1CCC[NH2+]1)C(C)(C)C ZINC000423025908 387843617 /nfs/dbraw/zinc/84/36/17/387843617.db2.gz AGIKMNRPPJPYJF-SRVKXCTJSA-N 2 0 244.448 2.494 20 0 BEADRP CS[C@@H](C[NH2+][C@H](C)[C@@H]1CCC[NH2+]1)C(C)(C)C ZINC000423025913 387843631 /nfs/dbraw/zinc/84/36/31/387843631.db2.gz AGIKMNRPPJPYJF-WOPDTQHZSA-N 2 0 244.448 2.494 20 0 BEADRP C[C@@H](CCCC(F)(F)F)[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000423074914 387873803 /nfs/dbraw/zinc/87/38/03/387873803.db2.gz NDUVVVJKIMZCRQ-IUCAKERBSA-N 2 0 238.297 2.305 20 0 BEADRP CC(C)OCCCC[NH2+][C@H]1CC[NH2+]CC[C@@H]1C ZINC000423031530 387845330 /nfs/dbraw/zinc/84/53/30/387845330.db2.gz LGBGSPBQFUXURI-KBPBESRZSA-N 2 0 242.407 2.169 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]C[C@@H]1CCCCS1 ZINC000423029072 387845455 /nfs/dbraw/zinc/84/54/55/387845455.db2.gz HPCLHZDZBVWAPZ-AGIUHOORSA-N 2 0 242.432 2.250 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]CCC[C@H]1CCCCO1 ZINC000423029447 387845870 /nfs/dbraw/zinc/84/58/70/387845870.db2.gz AHTMFABTBLGJMZ-MJBXVCDLSA-N 2 0 240.391 2.053 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](CO)CC1CCCC1 ZINC000423031104 387846103 /nfs/dbraw/zinc/84/61/03/387846103.db2.gz WPILXFTZUAGVAY-GXTWGEPZSA-N 2 0 242.407 2.035 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@H](CO)CC1CCCC1 ZINC000423031108 387846375 /nfs/dbraw/zinc/84/63/75/387846375.db2.gz WPILXFTZUAGVAY-OCCSQVGLSA-N 2 0 242.407 2.035 20 0 BEADRP CC(C)(C)[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H]2[NH3+])CCO1 ZINC000423031268 387847132 /nfs/dbraw/zinc/84/71/32/387847132.db2.gz WXPUKOQJWPPIRE-LPWJVIDDSA-N 2 0 240.391 2.050 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]CCC[C@@H]1CCCCO1 ZINC000423029446 387847160 /nfs/dbraw/zinc/84/71/60/387847160.db2.gz AHTMFABTBLGJMZ-MELADBBJSA-N 2 0 240.391 2.053 20 0 BEADRP Cc1csc([C@H](C)C[NH2+][C@@H]2CCC[C@H]2[NH3+])n1 ZINC000423034321 387849226 /nfs/dbraw/zinc/84/92/26/387849226.db2.gz HSNPNTIUTDYMRN-FBIMIBRVSA-N 2 0 239.388 2.024 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+][C@@H]2CC23CC[NH2+]CC3)o1 ZINC000643533743 387849224 /nfs/dbraw/zinc/84/92/24/387849224.db2.gz CPKZAQMNLLKCKO-DGCLKSJQSA-N 2 0 234.343 2.381 20 0 BEADRP COC1CCC(CC[NH2+][C@H](C)CCC[NH3+])CC1 ZINC000423032491 387849389 /nfs/dbraw/zinc/84/93/89/387849389.db2.gz FLUZEJCRRMDWLS-IYXRBSQSSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@H](C[NH2+][C@@H](C)C1(C)CC1)C[NH+]1CCCC1 ZINC000062078306 387849727 /nfs/dbraw/zinc/84/97/27/387849727.db2.gz QKXHHRZJTHTSHS-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]CCC[C@@H]1CCCCO1 ZINC000423031797 387849723 /nfs/dbraw/zinc/84/97/23/387849723.db2.gz DQTBSLSLLRGQQD-STQMWFEESA-N 2 0 228.380 2.053 20 0 BEADRP C[C@@H](CCc1ccco1)[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000643533997 387850310 /nfs/dbraw/zinc/85/03/10/387850310.db2.gz JGCHSKUPZGIWPX-JSGCOSHPSA-N 2 0 248.370 2.332 20 0 BEADRP CC(C)OCCCC[NH2+][C@H]1CCCCC[C@H]1[NH3+] ZINC000423036395 387851142 /nfs/dbraw/zinc/85/11/42/387851142.db2.gz TYSYJHMCNSBAGF-KGLIPLIRSA-N 2 0 242.407 2.441 20 0 BEADRP C([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)[C@H]1CCCCS1 ZINC000423037464 387851574 /nfs/dbraw/zinc/85/15/74/387851574.db2.gz VZNVQULMNNASET-ZGVCCVRISA-N 2 0 240.416 2.145 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1ccco1 ZINC000643534514 387852398 /nfs/dbraw/zinc/85/23/98/387852398.db2.gz WQUYDBJIIYEGJB-PWSUYJOCSA-N 2 0 220.316 2.072 20 0 BEADRP C[C@H]([NH2+]C1CCC(C[NH3+])CC1)[C@@H]1CCCCO1 ZINC000423041001 387853555 /nfs/dbraw/zinc/85/35/55/387853555.db2.gz IHVSVMMKNFOHCG-ABXWRUBCSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H]([NH2+]CCC[C@@H]1CCCCO1)[C@@H]1CCC[NH2+]1 ZINC000423041674 387855865 /nfs/dbraw/zinc/85/58/65/387855865.db2.gz XQHTYDSSVUKAPC-RDBSUJKOSA-N 2 0 240.391 2.066 20 0 BEADRP CC[C@H](CC(F)(F)F)[NH2+][C@H](C)C[C@H](C)[NH3+] ZINC000423041246 387856156 /nfs/dbraw/zinc/85/61/56/387856156.db2.gz WQYKMTHLFRJYJD-DJLDLDEBSA-N 2 0 226.286 2.433 20 0 BEADRP CC(C)O[C@H]1C[C@@H]([NH2+][C@H](C)CCC[NH3+])C1(C)C ZINC000423046449 387857834 /nfs/dbraw/zinc/85/78/34/387857834.db2.gz FFZODYILQWCUJK-UPJWGTAASA-N 2 0 242.407 2.296 20 0 BEADRP C[C@H](NC1(Cc2ccccc2)CC1)[C@@H]1CCC[NH2+]1 ZINC000423049682 387858631 /nfs/dbraw/zinc/85/86/31/387858631.db2.gz KFIMTNOUTZJWND-ZFWWWQNUSA-N 2 0 244.382 2.492 20 0 BEADRP CSCCCCC[NH2+][C@@H]1CC[NH2+]CC[C@@H]1C ZINC000423049925 387859355 /nfs/dbraw/zinc/85/93/55/387859355.db2.gz KIIRTQPLWKBNDS-QWHCGFSZSA-N 2 0 244.448 2.497 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1cncc(F)c1 ZINC000643534757 387860311 /nfs/dbraw/zinc/86/03/11/387860311.db2.gz CHOPXEQYJQEBHT-MFKMUULPSA-N 2 0 249.333 2.013 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1cncc(F)c1 ZINC000643534758 387860495 /nfs/dbraw/zinc/86/04/95/387860495.db2.gz CHOPXEQYJQEBHT-ZWNOBZJWSA-N 2 0 249.333 2.013 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@H]1C)C1CC1 ZINC000036908634 387861313 /nfs/dbraw/zinc/86/13/13/387861313.db2.gz WUSBWJKUCHKNBM-MPPDQPJWSA-N 2 0 210.365 2.103 20 0 BEADRP C1[C@@H]([NH2+][C@H]2CCC23CCC3)C12CC[NH2+]CC2 ZINC000643535378 387862635 /nfs/dbraw/zinc/86/26/35/387862635.db2.gz CXBTWFPBZDIGRJ-NWDGAFQWSA-N 2 0 220.360 2.051 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]C1(Cc2ccccc2)CC1 ZINC000423054743 387863449 /nfs/dbraw/zinc/86/34/49/387863449.db2.gz UYADGWXOSJXTNY-CHWSQXEVSA-N 2 0 232.371 2.477 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC[C@@H](C)C1)[C@@H]1CCCC[NH2+]1 ZINC000423061216 387865161 /nfs/dbraw/zinc/86/51/61/387865161.db2.gz KFOXVTHZSOXRRX-LPWJVIDDSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)C(C)(C)C ZINC000643536501 387868619 /nfs/dbraw/zinc/86/86/19/387868619.db2.gz UKQGDVIWQYPBAY-WDEREUQCSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H]1C[C@H](F)CN1)c1cccs1 ZINC000643537579 387870528 /nfs/dbraw/zinc/87/05/28/387870528.db2.gz MAZQPXHZLJPQIZ-GARJFASQSA-N 2 0 242.363 2.489 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[NH2+]CC[C@@H]2C)C1 ZINC000423066763 387870751 /nfs/dbraw/zinc/87/07/51/387870751.db2.gz XTVSSYVIXWTZNR-MROQNXINSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@@H]1CCC[C@H]1[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000643537085 387871132 /nfs/dbraw/zinc/87/11/32/387871132.db2.gz ZBERQYIVKBFTMY-JHJVBQTASA-N 2 0 222.376 2.297 20 0 BEADRP C1[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)C12CCCC2 ZINC000423071551 387871521 /nfs/dbraw/zinc/87/15/21/387871521.db2.gz FLEFDCVUTWZMNE-ZGVCCVRISA-N 2 0 220.360 2.192 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]1[NH2+]CCC1=CCCCC1 ZINC000422965123 387814973 /nfs/dbraw/zinc/81/49/73/387814973.db2.gz NTZKOFZSJAQXPX-STQMWFEESA-N 2 0 208.349 2.346 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]CCc1ccccc1O ZINC000422966938 387816660 /nfs/dbraw/zinc/81/66/60/387816660.db2.gz AXDVNSXROLPEIZ-KBPBESRZSA-N 2 0 248.370 2.042 20 0 BEADRP CC(C)SCC[NH2+][C@H]1CCCCC[C@H]1[NH3+] ZINC000423105356 387890476 /nfs/dbraw/zinc/89/04/76/387890476.db2.gz IFPNUQOBKBFBLC-NEPJUHHUSA-N 2 0 230.421 2.378 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+][C@H]1CCCCC[C@@H]1[NH3+] ZINC000423104992 387890602 /nfs/dbraw/zinc/89/06/02/387890602.db2.gz HZAVXWHTTMXIKV-SRVKXCTJSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@H]1CCO[C@H](C2CC2)C1 ZINC000423054582 387891209 /nfs/dbraw/zinc/89/12/09/387891209.db2.gz VAGIAWWYEUYZRR-XBFCOCLRSA-N 2 0 240.391 2.051 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+]CC1(C(F)(F)F)CCC1 ZINC000423107000 387892114 /nfs/dbraw/zinc/89/21/14/387892114.db2.gz KFLIFQYPUJUOLO-DTWKUNHWSA-N 2 0 236.281 2.188 20 0 BEADRP C[C@@H](C[NH2+]C1CCC([NH3+])CC1)C(F)(F)F ZINC000423054479 387892157 /nfs/dbraw/zinc/89/21/57/387892157.db2.gz UQDPIIUNNWBVNT-UEJVZZJDSA-N 2 0 224.270 2.044 20 0 BEADRP C[C@@H]1C[C@@H](CC[NH2+][C@@H]2CCC[C@H]2[NH3+])C[C@H](C)O1 ZINC000423106838 387892169 /nfs/dbraw/zinc/89/21/69/387892169.db2.gz DLVCCCPPJLKORV-XVIXHAIJSA-N 2 0 240.391 2.050 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC1(C)C)[C@@H]1CCC[NH2+]C1 ZINC000423110188 387892616 /nfs/dbraw/zinc/89/26/16/387892616.db2.gz OTBOSISQXQQYRC-QJPTWQEYSA-N 2 0 210.365 2.153 20 0 BEADRP CCSCCC[NH2+][C@@H]1CCCCC[C@H]1[NH3+] ZINC000423110691 387893080 /nfs/dbraw/zinc/89/30/80/387893080.db2.gz IICLVNRFMIFNSF-VXGBXAGGSA-N 2 0 230.421 2.379 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CCC[C@H]1C)[C@@H]1CCC[NH2+]1 ZINC000423110911 387893183 /nfs/dbraw/zinc/89/31/83/387893183.db2.gz WGIWZWNGRBSHMD-NDBYEHHHSA-N 2 0 210.365 2.153 20 0 BEADRP FC(F)[C@H]1C[C@@H]1[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000423116076 387897712 /nfs/dbraw/zinc/89/77/12/387897712.db2.gz ZKTSEQGCBFSHDM-IIRVCBMXSA-N 2 0 244.329 2.150 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CC[C@@H]1C[C@@H](C)O[C@@H](C)C1 ZINC000423116317 387897971 /nfs/dbraw/zinc/89/79/71/387897971.db2.gz PIIZLFZBBGJJBT-YIYPIFLZSA-N 2 0 242.407 2.297 20 0 BEADRP CC1(CC[NH2+][C@H]2CCCCC[C@H]2[NH3+])CC1 ZINC000423084723 387878992 /nfs/dbraw/zinc/87/89/92/387878992.db2.gz IQBRHWVEJROOBO-NEPJUHHUSA-N 2 0 210.365 2.426 20 0 BEADRP Cc1cscc1C[NH2+][C@@H](C)C[C@@H](C)[NH3+] ZINC000423091758 387882412 /nfs/dbraw/zinc/88/24/12/387882412.db2.gz YQNPCOLTORLKIB-ZJUUUORDSA-N 2 0 212.362 2.272 20 0 BEADRP CC[C@H]([NH2+][C@H](C)CC[NH+](C)C)[C@@H]1C[C@@H]1C ZINC000322072365 387883139 /nfs/dbraw/zinc/88/31/39/387883139.db2.gz SRBDLCRMKUCZNC-LOWDOPEQSA-N 2 0 212.381 2.351 20 0 BEADRP Cc1cscc1C[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000423091756 387883417 /nfs/dbraw/zinc/88/34/17/387883417.db2.gz YQNPCOLTORLKIB-UWVGGRQHSA-N 2 0 212.362 2.272 20 0 BEADRP CC[C@H]([NH2+][C@H](C)CC[NH+](C)C)[C@H]1C[C@@H]1C ZINC000322072368 387884323 /nfs/dbraw/zinc/88/43/23/387884323.db2.gz SRBDLCRMKUCZNC-RNJOBUHISA-N 2 0 212.381 2.351 20 0 BEADRP CC[C@@H]([NH2+]CCC1(F)CCC1)[C@@H]1CCC[NH2+]1 ZINC000423101127 387887396 /nfs/dbraw/zinc/88/73/96/387887396.db2.gz CLOLVCMMVKYCJJ-NEPJUHHUSA-N 2 0 228.355 2.389 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+][C@@H]2CC[NH2+]CC[C@@H]2C)C1 ZINC000423101936 387889358 /nfs/dbraw/zinc/88/93/58/387889358.db2.gz WOJZJTZIKKLENX-ZOBORPQBSA-N 2 0 224.392 2.400 20 0 BEADRP C=Cc1ccc(CC[NH2+][C@@H](C)C2C[NH2+]C2)cc1 ZINC000423141597 387917797 /nfs/dbraw/zinc/91/77/97/387917797.db2.gz QTQYYESBYZFDEA-LBPRGKRZSA-N 2 0 230.355 2.070 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CCCSC1)[C@H]1CCCC[NH2+]1 ZINC000423119052 387900289 /nfs/dbraw/zinc/90/02/89/387900289.db2.gz CXYXMIGLJNMLMB-FRRDWIJNSA-N 2 0 242.432 2.250 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CCC1C[C@H](C)O[C@@H](C)C1 ZINC000423118050 387901157 /nfs/dbraw/zinc/90/11/57/387901157.db2.gz YOTKNDDJHFAZQH-CYDGBPFRSA-N 2 0 242.407 2.296 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]C[C@H]1CCCSC1 ZINC000423119354 387901387 /nfs/dbraw/zinc/90/13/87/387901387.db2.gz DQTDHPXXMCUYIQ-JHJVBQTASA-N 2 0 242.432 2.379 20 0 BEADRP [NH3+]CC1CCC([NH2+]C[C@H]2CCCSC2)CC1 ZINC000423119596 387901727 /nfs/dbraw/zinc/90/17/27/387901727.db2.gz FAAMNWSQEAHPKQ-OTTFEQOBSA-N 2 0 242.432 2.237 20 0 BEADRP COCC(C)(C)CCC[NH2+][C@@H](C)C[C@@H](C)[NH3+] ZINC000423122563 387902330 /nfs/dbraw/zinc/90/23/30/387902330.db2.gz JZTCLLIKSXBSCB-NEPJUHHUSA-N 2 0 230.396 2.155 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]Cc1ccc2cc[nH]c2n1 ZINC000423123601 387902405 /nfs/dbraw/zinc/90/24/05/387902405.db2.gz MZOCIBOAHQTKLF-NSHDSACASA-N 2 0 246.358 2.170 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]Cc1ccc2cc[nH]c2n1 ZINC000423123600 387902776 /nfs/dbraw/zinc/90/27/76/387902776.db2.gz MZOCIBOAHQTKLF-LLVKDONJSA-N 2 0 246.358 2.170 20 0 BEADRP CC[C@H]1CC[C@H]([NH2+][C@H](CCC[NH3+])COC)CC1 ZINC000423124645 387902781 /nfs/dbraw/zinc/90/27/81/387902781.db2.gz GTGMMSBHMUMVGB-MGPQQGTHSA-N 2 0 242.407 2.299 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+]CCC1(F)CCC1 ZINC000423125150 387903099 /nfs/dbraw/zinc/90/30/99/387903099.db2.gz NBIMOAVRAJJYFT-NEPJUHHUSA-N 2 0 228.355 2.376 20 0 BEADRP COCC(C)(C)CCC[NH2+][C@H](C)C[C@H](C)[NH3+] ZINC000423122564 387903353 /nfs/dbraw/zinc/90/33/53/387903353.db2.gz JZTCLLIKSXBSCB-NWDGAFQWSA-N 2 0 230.396 2.155 20 0 BEADRP CCOCC(C)(C)C[NH2+][C@H]1CCCCC[C@H]1[NH3+] ZINC000423130496 387907034 /nfs/dbraw/zinc/90/70/34/387907034.db2.gz YQENEDVSCGENCB-OLZOCXBDSA-N 2 0 242.407 2.299 20 0 BEADRP CC(C)(CC[NH2+][C@H]1CCC[C@H]1[NH3+])C1CC1 ZINC000423128767 387907617 /nfs/dbraw/zinc/90/76/17/387907617.db2.gz DLBJQNAHVLMXGN-NEPJUHHUSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+][C@H]1CC[C@H](F)C1 ZINC000423132457 387909474 /nfs/dbraw/zinc/90/94/74/387909474.db2.gz UQESBBGVCMZKCG-YFKTTZPYSA-N 2 0 214.328 2.127 20 0 BEADRP C[C@H]([NH2+]C[C@H](c1ccccc1)C1CC1)C1C[NH2+]C1 ZINC000423133325 387911532 /nfs/dbraw/zinc/91/15/32/387911532.db2.gz QDKNXXMCPNFOFX-BLLLJJGKSA-N 2 0 244.382 2.378 20 0 BEADRP C=Cc1ccc(CC[NH2+][C@@H]2CCC[C@H]2[NH3+])cc1 ZINC000423134692 387912741 /nfs/dbraw/zinc/91/27/41/387912741.db2.gz DXSFYMRHJIWMLC-HUUCEWRRSA-N 2 0 230.355 2.342 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCCC1(C)C)C1C[NH2+]C1 ZINC000423135907 387913587 /nfs/dbraw/zinc/91/35/87/387913587.db2.gz OOWYJNXGPSXSFC-JQWIXIFHSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC2CCC1CC2)[C@@H]1CCC[NH2+]1 ZINC000423139126 387915764 /nfs/dbraw/zinc/91/57/64/387915764.db2.gz YVEBUJKQOROWDE-UUFIZFKYSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@H]([NH2+]CCC(C)(C)C1CC1)C1C[NH2+]C1 ZINC000423138805 387916272 /nfs/dbraw/zinc/91/62/72/387916272.db2.gz UFBOLCRSBRTHMB-JTQLQIEISA-N 2 0 210.365 2.010 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+]C1CCC(C[NH3+])CC1 ZINC000423156005 387935477 /nfs/dbraw/zinc/93/54/77/387935477.db2.gz RLUFQGXCBKGQPH-QBHFIFKDSA-N 2 0 210.365 2.140 20 0 BEADRP Cc1cccnc1CCC[NH2+][C@@H]1CCC[C@H]1C[NH3+] ZINC000423155543 387935588 /nfs/dbraw/zinc/93/55/88/387935588.db2.gz QQWMARWJKGRSLO-DZGCQCFKSA-N 2 0 247.386 2.040 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CCCC(C)(C)C1)C1C[NH2+]C1 ZINC000423157870 387936715 /nfs/dbraw/zinc/93/67/15/387936715.db2.gz BTKCKWBMIWQKOV-NEPJUHHUSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]C[C@@H]1CCCC1(F)F ZINC000423156386 387936755 /nfs/dbraw/zinc/93/67/55/387936755.db2.gz SILLMZKOBQILJP-WOPDTQHZSA-N 2 0 246.345 2.400 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CC(C)(C)c1ccccn1 ZINC000423143833 387920470 /nfs/dbraw/zinc/92/04/70/387920470.db2.gz DZGRXGFBOISFQH-NEPJUHHUSA-N 2 0 235.375 2.075 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CSc2ccccc21)C1C[NH2+]C1 ZINC000423143332 387921520 /nfs/dbraw/zinc/92/15/20/387921520.db2.gz CQHQIUKZQJUQPY-PWSUYJOCSA-N 2 0 248.395 2.073 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]CCCC(C)(F)F ZINC000423147497 387925671 /nfs/dbraw/zinc/92/56/71/387925671.db2.gz SGXCKAVDFKJWLV-GHMZBOCLSA-N 2 0 234.334 2.400 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+]CCCC(C)(F)F ZINC000423147600 387925713 /nfs/dbraw/zinc/92/57/13/387925713.db2.gz SGXCKAVDFKJWLV-WDEREUQCSA-N 2 0 234.334 2.400 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2C[C@H]2C2CCC2)CC[N@@H+]1C ZINC000424287755 387951827 /nfs/dbraw/zinc/95/18/27/387951827.db2.gz HWUZDLKXFKCEFO-UNQGMJICSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@H]1C[C@H]([NH2+]C[C@@H]2C[C@H]2C2CCC2)CC[N@@H+]1C ZINC000424287753 387951923 /nfs/dbraw/zinc/95/19/23/387951923.db2.gz HWUZDLKXFKCEFO-MHEUCROKSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]C[C@@H]1C[C@H]1C1CCC1 ZINC000424288179 387952310 /nfs/dbraw/zinc/95/23/10/387952310.db2.gz IGLOJIYQASLAGX-UNQGMJICSA-N 2 0 236.403 2.352 20 0 BEADRP CC(C)C[C@@H]1C[C@H]1[NH2+][C@@H]1CC[NH2+]CC[C@H]1C ZINC000423167916 387953107 /nfs/dbraw/zinc/95/31/07/387953107.db2.gz GBKUKUXZZZBNOT-AAVRWANBSA-N 2 0 224.392 2.399 20 0 BEADRP CC(C)C[C@@H]1C[C@H]1[NH2+][C@@H]1CC[NH2+]CC[C@@H]1C ZINC000423167917 387953178 /nfs/dbraw/zinc/95/31/78/387953178.db2.gz GBKUKUXZZZBNOT-REWJHTLYSA-N 2 0 224.392 2.399 20 0 BEADRP CC(C)C[C@@H]1C[C@H]1[NH2+][C@H]1CCC[C@@H]1C[NH3+] ZINC000423169741 387954906 /nfs/dbraw/zinc/95/49/06/387954906.db2.gz KJJMILUNTKEYAG-FVCCEPFGSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)[C@H]1C[C@H]1C ZINC000321159187 387955222 /nfs/dbraw/zinc/95/52/22/387955222.db2.gz XBTPULVAWUTXJN-HTOAHKCRSA-N 2 0 222.376 2.247 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)C1(C)CC1 ZINC000044533954 387938184 /nfs/dbraw/zinc/93/81/84/387938184.db2.gz HQTBDDFTVQZHTD-VXGBXAGGSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]1CN(C2CC2)C[C@H]1[NH2+]C[C@@H]1C[C@H]1C1CCC1 ZINC000424295616 387956178 /nfs/dbraw/zinc/95/61/78/387956178.db2.gz PVURWBDBSMYFCV-DLKVLKDVSA-N 2 0 248.414 2.495 20 0 BEADRP Cc1ccc(CC[NH2+][C@H]2CCCCC[C@@H]2[NH3+])nc1 ZINC000423160970 387940321 /nfs/dbraw/zinc/94/03/21/387940321.db2.gz IFKVNZSMZPRDKY-GJZGRUSLSA-N 2 0 247.386 2.182 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H]2CCCCC[C@@H]2[NH3+])nc1 ZINC000423160972 387940961 /nfs/dbraw/zinc/94/09/61/387940961.db2.gz IFKVNZSMZPRDKY-LSDHHAIUSA-N 2 0 247.386 2.182 20 0 BEADRP CC[C@H](C)[C@H](C[NH2+][C@H]1CC[NH2+]CC[C@@H]1C)OC ZINC000423159426 387941668 /nfs/dbraw/zinc/94/16/68/387941668.db2.gz PFKPXIIYTDIFNH-XUXIUFHCSA-N 2 0 242.407 2.025 20 0 BEADRP CC(C)O[C@H]1C[C@@H]([NH2+][C@@H]2CCCCC[C@H]2[NH3+])C1 ZINC000423161547 387944306 /nfs/dbraw/zinc/94/43/06/387944306.db2.gz JBEPBHDGROGZPK-XJFOESAGSA-N 2 0 240.391 2.192 20 0 BEADRP C[C@@H]1CCC[NH+]1CCC[N@H+]1CCC[C@H]1C ZINC000245439485 387945638 /nfs/dbraw/zinc/94/56/38/387945638.db2.gz FVXDOWTUIMMQKR-CHWSQXEVSA-N 2 0 210.365 2.345 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)[C@H]1C[C@H]1C ZINC000321098384 387946931 /nfs/dbraw/zinc/94/69/31/387946931.db2.gz ONXSTUJIIKINSD-UHXUPSOCSA-N 2 0 222.376 2.105 20 0 BEADRP CC[C@H]([NH2+]CC1CC[NH+](C)CC1)[C@@H]1C[C@@H]1C ZINC000321096240 387947327 /nfs/dbraw/zinc/94/73/27/387947327.db2.gz ODMMUELXAMYRND-YUTCNCBUSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)[C@H]1C[C@H]1C ZINC000321098383 387948268 /nfs/dbraw/zinc/94/82/68/387948268.db2.gz ONXSTUJIIKINSD-NMKXLXIOSA-N 2 0 222.376 2.105 20 0 BEADRP CCC[C@@H]([NH2+][C@@H](C)C1C[NH2+]C1)C(C)(C)C ZINC000423164624 387948942 /nfs/dbraw/zinc/94/89/42/387948942.db2.gz XGUKXFFGNJBZKZ-CMPLNLGQSA-N 2 0 212.381 2.399 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]C[C@@H]1C[C@H]1C1CC1 ZINC000423170956 387958262 /nfs/dbraw/zinc/95/82/62/387958262.db2.gz ZCDNVKUFHBDXEZ-FQUUOJAGSA-N 2 0 222.376 2.282 20 0 BEADRP CC[C@@H]1C[N@H+](CC[C@H]2CCC[NH+]2C)CCS1 ZINC000245692288 387971994 /nfs/dbraw/zinc/97/19/94/387971994.db2.gz WGUJUCNFUCPKTN-CHWSQXEVSA-N 2 0 242.432 2.298 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H]1C[C@H]1c1ccco1 ZINC000423176548 387962865 /nfs/dbraw/zinc/96/28/65/387962865.db2.gz GJPLONMTFMMGBK-QJPTWQEYSA-N 2 0 222.332 2.243 20 0 BEADRP Cc1ccc(C[C@@H]([NH2+]CCC[NH3+])C2CC2)cc1 ZINC000423181097 387967869 /nfs/dbraw/zinc/96/78/69/387967869.db2.gz FLQMDRWJMJYSTF-OAHLLOKOSA-N 2 0 232.371 2.255 20 0 BEADRP Cc1ccc(C[C@H]([NH2+]CCC[NH3+])C2CC2)cc1 ZINC000423181096 387968089 /nfs/dbraw/zinc/96/80/89/387968089.db2.gz FLQMDRWJMJYSTF-HNNXBMFYSA-N 2 0 232.371 2.255 20 0 BEADRP C[C@@H]1C[C@H](C[NH2+][C@@H]2CCCCC[C@@H]2[NH3+])[C@H](C)O1 ZINC000423183599 387969458 /nfs/dbraw/zinc/96/94/58/387969458.db2.gz MSDBSSKNCFJJES-XHJNMGKDSA-N 2 0 240.391 2.050 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+][C@@H]1C[C@H]1c1ccco1 ZINC000423185527 387970475 /nfs/dbraw/zinc/97/04/75/387970475.db2.gz NWHYQZPCQCSSIM-FDYHWXHSSA-N 2 0 234.343 2.243 20 0 BEADRP CC[C@H]([NH2+]C1CC[NH2+]CC1)c1cccc(OC)c1 ZINC000423186401 387971069 /nfs/dbraw/zinc/97/10/69/387971069.db2.gz NYNXTVJBLFXMNZ-HNNXBMFYSA-N 2 0 248.370 2.488 20 0 BEADRP COc1ccc([C@H]2C[C@@H]2[C@H](C)[NH2+]CCC[NH3+])cc1 ZINC000423187594 387971722 /nfs/dbraw/zinc/97/17/22/387971722.db2.gz KXCASEAQHQWQJD-NILFDRSVSA-N 2 0 248.370 2.126 20 0 BEADRP Cc1ccc(C)c(CN(C)[C@@H](C)C[NH3+])c1 ZINC000158512048 387956777 /nfs/dbraw/zinc/95/67/77/387956777.db2.gz MWZCLSZNSZLLHT-LBPRGKRZSA-N 2 0 206.333 2.082 20 0 BEADRP [NH3+][C@H]1CCCCC[C@H]1[NH2+]C[C@@H]1C[C@H]1C1CC1 ZINC000423170958 387957499 /nfs/dbraw/zinc/95/74/99/387957499.db2.gz ZCDNVKUFHBDXEZ-XDQVBPFNSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H]1C[C@H]1c1ccccc1F ZINC000423170641 387957815 /nfs/dbraw/zinc/95/78/15/387957815.db2.gz MMRKZWAVXDQKCS-JYYRZZBQSA-N 2 0 236.334 2.397 20 0 BEADRP [NH3+]CCC[NH2+][C@@H]1CCC[C@H](c2cccnc2)C1 ZINC000423194865 387979256 /nfs/dbraw/zinc/97/92/56/387979256.db2.gz RYPLXRBIBGKWJF-GXTWGEPZSA-N 2 0 233.359 2.046 20 0 BEADRP [NH3+]CCC[NH2+][C@@H]1CC[C@H](c2ccccc2)C1 ZINC000423193917 387979486 /nfs/dbraw/zinc/97/94/86/387979486.db2.gz QZVOJWFFACVTDQ-UONOGXRCSA-N 2 0 218.344 2.261 20 0 BEADRP c1cncc([C@@H]([NH2+]C2CC[NH2+]CC2)C2CCC2)c1 ZINC000423195204 387979657 /nfs/dbraw/zinc/97/96/57/387979657.db2.gz YUVZUAGOUZDMBM-HNNXBMFYSA-N 2 0 245.370 2.264 20 0 BEADRP Cc1cc2c(cc1C)[C@H]([NH2+]CCC[NH3+])CCCO2 ZINC000423197443 387981313 /nfs/dbraw/zinc/98/13/13/387981313.db2.gz ZLDLJFNSGFTRHI-CQSZACIVSA-N 2 0 248.370 2.456 20 0 BEADRP Cc1ccccc1C[C@@H]([NH2+]CCC[NH3+])C1CC1 ZINC000423189152 387973528 /nfs/dbraw/zinc/97/35/28/387973528.db2.gz MOXKXCQKWXBVKP-OAHLLOKOSA-N 2 0 232.371 2.255 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCCC[C@@H]2[NH3+])CS1 ZINC000423189904 387974316 /nfs/dbraw/zinc/97/43/16/387974316.db2.gz RMHKHGUVWPVCQE-NOOOWODRSA-N 2 0 228.405 2.130 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+][C@@H]1CCCC[C@H]1F ZINC000423193217 387977366 /nfs/dbraw/zinc/97/73/66/387977366.db2.gz VLUIETFLJUKJDQ-FDYHWXHSSA-N 2 0 228.355 2.245 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+][C@@H]1CCCC[C@H]1F ZINC000423193218 387978358 /nfs/dbraw/zinc/97/83/58/387978358.db2.gz VLUIETFLJUKJDQ-FVCCEPFGSA-N 2 0 228.355 2.245 20 0 BEADRP C[NH2+]CCC[NH2+][C@H](C)[C@@H]1C[C@H]1c1ccccc1 ZINC000423201679 387987682 /nfs/dbraw/zinc/98/76/82/387987682.db2.gz PMRKUWYCJDQJEP-SNPRPXQTSA-N 2 0 232.371 2.378 20 0 BEADRP C[NH2+]CCC[NH2+][C@H](C)[C@H]1CCCC[C@@H]1C ZINC000423201886 387988303 /nfs/dbraw/zinc/98/83/03/387988303.db2.gz QDTTVSTUNYNGIA-XQQFMLRXSA-N 2 0 212.381 2.400 20 0 BEADRP C[NH2+]CCC[NH2+][C@H]1c2cc(C)ccc2C[C@H]1C ZINC000423203680 387989110 /nfs/dbraw/zinc/98/91/10/387989110.db2.gz SXQLMVMCEJDHQI-IUODEOHRSA-N 2 0 232.371 2.427 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1CCC[NH2+]C1)[C@@H]1C[C@H]1C ZINC000423205623 387990618 /nfs/dbraw/zinc/99/06/18/387990618.db2.gz FGIYLXSMNBIONZ-LPWJVIDDSA-N 2 0 210.365 2.010 20 0 BEADRP CC[C@@H]1C[C@H](C)CC[C@H]1[NH2+]CCC[NH2+]C ZINC000423205039 387991695 /nfs/dbraw/zinc/99/16/95/387991695.db2.gz VBYYVRYGRDSEFL-JHJVBQTASA-N 2 0 212.381 2.400 20 0 BEADRP C[NH2+]CCC[NH2+][C@H]1CCC[C@H]1CCCF ZINC000423206406 387992130 /nfs/dbraw/zinc/99/21/30/387992130.db2.gz WSTMJOBANMTMKE-RYUDHWBXSA-N 2 0 216.344 2.104 20 0 BEADRP CO[C@@H](C)[C@H](C)[NH2+]CC1([NH3+])CCCCCC1 ZINC000423207688 387993180 /nfs/dbraw/zinc/99/31/80/387993180.db2.gz YEFLYOSHUCXCGT-RYUDHWBXSA-N 2 0 228.380 2.051 20 0 BEADRP CC[C@H](N[C@@H]1CC[NH2+]C1)c1cccc(F)c1 ZINC000423212514 387995189 /nfs/dbraw/zinc/99/51/89/387995189.db2.gz JRZZTOXQPXNDGK-OLZOCXBDSA-N 2 0 222.307 2.228 20 0 BEADRP Cc1cccnc1[C@H]1CCC[C@H]([NH2+]CCC[NH3+])C1 ZINC000423196598 387982260 /nfs/dbraw/zinc/98/22/60/387982260.db2.gz VQMSDFHMKOCHNL-KBPBESRZSA-N 2 0 247.386 2.355 20 0 BEADRP CCC[C@H]([NH2+]CCC[NH2+]C)c1cccnc1 ZINC000423198092 387983126 /nfs/dbraw/zinc/98/31/26/387983126.db2.gz DAUDUZCFBCAJIL-ZDUSSCGKSA-N 2 0 221.348 2.122 20 0 BEADRP C[NH2+]CCC[NH2+][C@H](Cc1ccccc1)C(C)C ZINC000423198214 387983483 /nfs/dbraw/zinc/98/34/83/387983483.db2.gz DSGIQCUMPASXOK-OAHLLOKOSA-N 2 0 234.387 2.453 20 0 BEADRP [NH3+]CCC[NH2+][C@@H]1CCc2ccc(Cl)cc21 ZINC000423197570 387983979 /nfs/dbraw/zinc/98/39/79/387983979.db2.gz ZWRGRZKEVOTHRC-GFCCVEGCSA-N 2 0 224.735 2.266 20 0 BEADRP CCO[C@H]1C[C@H]([NH2+]CCC[NH2+]C)C1(CC)CC ZINC000423198090 387984202 /nfs/dbraw/zinc/98/42/02/387984202.db2.gz CZWZJNACGOBRBD-STQMWFEESA-N 2 0 242.407 2.169 20 0 BEADRP COC[C@H]([NH2+]CC1([NH3+])CCCCCC1)C(C)C ZINC000423198729 387984442 /nfs/dbraw/zinc/98/44/42/387984442.db2.gz HNHVKMQMKQTZRE-ZDUSSCGKSA-N 2 0 242.407 2.299 20 0 BEADRP CCO[C@@H]1C[C@H]([NH2+]CCC[NH2+]C)C1(CC)CC ZINC000423198089 387984457 /nfs/dbraw/zinc/98/44/57/387984457.db2.gz CZWZJNACGOBRBD-QWHCGFSZSA-N 2 0 242.407 2.169 20 0 BEADRP C[C@@H]([NH2+]CC1([NH3+])CCCCCC1)[C@H]1CCCO1 ZINC000423198818 387984516 /nfs/dbraw/zinc/98/45/16/387984516.db2.gz ICHQBGINITYKHA-CHWSQXEVSA-N 2 0 240.391 2.195 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H]2C[C@H]3C[C@H]3C2)[C@@H](C)C1 ZINC000424349609 387985708 /nfs/dbraw/zinc/98/57/08/387985708.db2.gz MDGUAVMUJOPKOE-HPCHECBXSA-N 2 0 222.376 2.105 20 0 BEADRP C[NH2+]CCC[NH2+][C@H](C)c1sccc1C ZINC000423198968 387986305 /nfs/dbraw/zinc/98/63/05/387986305.db2.gz IWBHFLZLSKRWEQ-SNVBAGLBSA-N 2 0 212.362 2.317 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H](C)CCC(C)(C)C ZINC000395092562 387986596 /nfs/dbraw/zinc/98/65/96/387986596.db2.gz AKLPFUDCGRHELJ-GHMZBOCLSA-N 2 0 200.370 2.386 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1 ZINC000423214311 387997074 /nfs/dbraw/zinc/99/70/74/387997074.db2.gz LDNGBPZCILXVKQ-MELADBBJSA-N 2 0 247.386 2.429 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC[NH2+]C1)[C@H]1CCCC[C@H]1C ZINC000423163895 387998130 /nfs/dbraw/zinc/99/81/30/387998130.db2.gz WCBMGJYZCRCOOK-LPWJVIDDSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[NH2+]C1)[C@H]1C[C@H]1C ZINC000423216064 387998501 /nfs/dbraw/zinc/99/85/01/387998501.db2.gz NYLFJHSSVPZARB-MOLYVOAJSA-N 2 0 210.365 2.009 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCCC[C@H]1[NH3+])[C@H]1C[C@H]1C ZINC000424376173 387998677 /nfs/dbraw/zinc/99/86/77/387998677.db2.gz OUBLBIYOYPPHSS-RXGFPQBGSA-N 2 0 210.365 2.281 20 0 BEADRP [NH3+][C@H]1CCCCC[C@H]1[NH2+][C@@H]1C[C@H]1C1CCC1 ZINC000424376122 387998715 /nfs/dbraw/zinc/99/87/15/387998715.db2.gz OORBRKTULWOGIW-IGQOVBAYSA-N 2 0 222.376 2.425 20 0 BEADRP Cc1ccc(CC[N@H+]2CC[C@H](C)[C@H](C[NH3+])C2)cc1 ZINC000420408090 387999066 /nfs/dbraw/zinc/99/90/66/387999066.db2.gz OWXZEAQXPHNQEF-GOEBONIOSA-N 2 0 246.398 2.454 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1C[C@H]1C1CCC1 ZINC000424375368 387999657 /nfs/dbraw/zinc/99/96/57/387999657.db2.gz MYEWDDQAYCZNOI-KGYLQXTDSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+][C@@H]1C[C@H]1C1CCC1 ZINC000424376123 387999897 /nfs/dbraw/zinc/99/98/97/387999897.db2.gz OORBRKTULWOGIW-REWJHTLYSA-N 2 0 222.376 2.425 20 0 BEADRP CC[C@@H]([NH2+]C[C@H]1CCC[NH2+]C1)c1ccncc1 ZINC000423217704 388000558 /nfs/dbraw/zinc/00/05/58/388000558.db2.gz UJWBRUNOEVQGKW-GXTWGEPZSA-N 2 0 233.359 2.122 20 0 BEADRP CCc1cc(N[C@@H]2C[C@H](C)[N@@H+](C3CC3)C2)cc[nH+]1 ZINC000450373554 388000951 /nfs/dbraw/zinc/00/09/51/388000951.db2.gz CSHDLHDSVVURMK-SMDDNHRTSA-N 2 0 245.370 2.103 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H]1CCC[C@H](c2cccnc2)C1 ZINC000423222634 388004006 /nfs/dbraw/zinc/00/40/06/388004006.db2.gz BXQZYKYFDAJPDR-KCQAQPDRSA-N 2 0 247.386 2.435 20 0 BEADRP Cc1cccc([C@H](C)[NH2+]CC[C@H](C)[NH3+])c1 ZINC000423223822 388005100 /nfs/dbraw/zinc/00/51/00/388005100.db2.gz ATBWMVSSSGTMMJ-RYUDHWBXSA-N 2 0 206.333 2.383 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H]1CCCc2sccc21 ZINC000423223505 388005790 /nfs/dbraw/zinc/00/57/90/388005790.db2.gz AHAVRPNQKAQGOY-GXSJLCMTSA-N 2 0 224.373 2.452 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H]1CCCOc2ccccc21 ZINC000423227014 388011139 /nfs/dbraw/zinc/01/11/39/388011139.db2.gz TYRCKYAANYNZIF-WCQYABFASA-N 2 0 234.343 2.227 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H](c1ccccc1)C1CC1 ZINC000423225163 388007279 /nfs/dbraw/zinc/00/72/79/388007279.db2.gz LOCFAACVSUCLKY-FZMZJTMJSA-N 2 0 218.344 2.465 20 0 BEADRP Cc1cc([C@@H](C)[NH2+]CC[C@H](C)[NH3+])c(C)o1 ZINC000423225432 388007879 /nfs/dbraw/zinc/00/78/79/388007879.db2.gz MUBRRDYTLOCYDT-WCBMZHEXSA-N 2 0 210.321 2.284 20 0 BEADRP Cc1ccc2c(c1)[C@@H]([NH2+]CC[C@H](C)[NH3+])CC2 ZINC000423225366 388008278 /nfs/dbraw/zinc/00/82/78/388008278.db2.gz MMOHXMDMCRVPRS-FZMZJTMJSA-N 2 0 218.344 2.309 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H](C)c1ccccc1N(C)C ZINC000423225800 388009185 /nfs/dbraw/zinc/00/91/85/388009185.db2.gz OHIFIHOHIHABSK-RYUDHWBXSA-N 2 0 235.375 2.141 20 0 BEADRP CC[C@H]([NH2+][C@H](C)[C@@H]1CCC[NH2+]C1)[C@H]1C[C@@H]1C ZINC000423215942 387996848 /nfs/dbraw/zinc/99/68/48/387996848.db2.gz NUWIJEVQRSGBFO-ZSLBOAEBSA-N 2 0 224.392 2.399 20 0 BEADRP Cc1nc([C@@H](C)[NH2+]CC[C@@H]2CC[NH2+]C2)cs1 ZINC000423240724 388024068 /nfs/dbraw/zinc/02/40/68/388024068.db2.gz CRDWUFCCAZXSQE-KOLCDFICSA-N 2 0 239.388 2.102 20 0 BEADRP COc1ccc(C)cc1[C@H](C)[NH2+]CC[C@H](C)[NH3+] ZINC000423227155 388011329 /nfs/dbraw/zinc/01/13/29/388011329.db2.gz UQHSMTGOPIQNAI-RYUDHWBXSA-N 2 0 236.359 2.392 20 0 BEADRP COc1ccsc1[C@@H](C)[NH2+]CC[C@H](C)[NH3+] ZINC000423226727 388011629 /nfs/dbraw/zinc/01/16/29/388011629.db2.gz RZFBXRDKEOBIRK-DTWKUNHWSA-N 2 0 228.361 2.145 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCC(F)(F)F)CC[N@@H+]1C ZINC000156617287 388011620 /nfs/dbraw/zinc/01/16/20/388011620.db2.gz WIHKDPFESIUBLM-BDAKNGLRSA-N 2 0 224.270 2.011 20 0 BEADRP CCC[N@H+](C)C[C@@H]1CC[NH+](CC2CC2)C1 ZINC000156630405 388012343 /nfs/dbraw/zinc/01/23/43/388012343.db2.gz WDLWPLOVQWTOFC-ZDUSSCGKSA-N 2 0 210.365 2.060 20 0 BEADRP COc1cc([C@@H](C)[NH2+]CC[C@H](C)[NH3+])ccc1F ZINC000423228488 388013850 /nfs/dbraw/zinc/01/38/50/388013850.db2.gz ZVLMNBOASSUGFC-VHSXEESVSA-N 2 0 240.322 2.222 20 0 BEADRP C([NH2+][C@H](C1CC1)C1CCCC1)[C@H]1CCC[NH2+]1 ZINC000423229409 388015081 /nfs/dbraw/zinc/01/50/81/388015081.db2.gz BFASKISWGDPVFK-KGLIPLIRSA-N 2 0 222.376 2.297 20 0 BEADRP C([NH2+][C@@H](C1CC1)C1CCCC1)[C@@H]1CCC[NH2+]1 ZINC000423229410 388015315 /nfs/dbraw/zinc/01/53/15/388015315.db2.gz BFASKISWGDPVFK-UONOGXRCSA-N 2 0 222.376 2.297 20 0 BEADRP CC(C)(C)[C@@H]1CC[C@@H]1[NH2+]C[C@@H]1CCC[NH2+]1 ZINC000423231148 388017112 /nfs/dbraw/zinc/01/71/12/388017112.db2.gz FUJKJUGEEOHOPV-TUAOUCFPSA-N 2 0 210.365 2.153 20 0 BEADRP CCOc1ccc([C@H](C)[NH2+]CC[C@H](C)[NH3+])cc1 ZINC000423235272 388019300 /nfs/dbraw/zinc/01/93/00/388019300.db2.gz QRDNFRKTDHSEPF-RYUDHWBXSA-N 2 0 236.359 2.473 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H]1CCc2ccccc21 ZINC000423236163 388020039 /nfs/dbraw/zinc/02/00/39/388020039.db2.gz RPSPRASMLWZZCJ-GXFFZTMASA-N 2 0 204.317 2.001 20 0 BEADRP CCc1cccnc1[C@H](C)[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000423248748 388032127 /nfs/dbraw/zinc/03/21/27/388032127.db2.gz NSFWFAOMQGTTNS-QWHCGFSZSA-N 2 0 247.386 2.294 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1cccc(F)c1 ZINC000423249731 388032294 /nfs/dbraw/zinc/03/22/94/388032294.db2.gz PNSFGZWHBZQLRZ-NWDGAFQWSA-N 2 0 236.334 2.476 20 0 BEADRP CCc1cccnc1[C@H](C)[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000423248749 388032344 /nfs/dbraw/zinc/03/23/44/388032344.db2.gz NSFWFAOMQGTTNS-STQMWFEESA-N 2 0 247.386 2.294 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H](C)c1ccccc1 ZINC000423255728 388037091 /nfs/dbraw/zinc/03/70/91/388037091.db2.gz APXJSANXXIKPMG-NWDGAFQWSA-N 2 0 206.333 2.193 20 0 BEADRP Cc1cncc([C@@H](C)[NH2+]CC[C@@H]2CCC[NH2+]C2)c1 ZINC000423258439 388039406 /nfs/dbraw/zinc/03/94/06/388039406.db2.gz MCQHRUBUCOERDO-KGLIPLIRSA-N 2 0 247.386 2.430 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](CN)C1CCCCC1 ZINC000423262186 388041125 /nfs/dbraw/zinc/04/11/25/388041125.db2.gz LYEAELALORBXBM-JSGCOSHPSA-N 2 0 241.423 2.001 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@@H]1CC[C@@H]1C(C)(C)C ZINC000423264882 388041392 /nfs/dbraw/zinc/04/13/92/388041392.db2.gz CLFHWHRVRQCFED-QJPTWQEYSA-N 2 0 212.381 2.384 20 0 BEADRP CSCCCC[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000159982666 388041931 /nfs/dbraw/zinc/04/19/31/388041931.db2.gz BVZGTHZHIBGPLJ-CHWSQXEVSA-N 2 0 242.432 2.346 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@@H]1c2ccccc2C[C@H]1C ZINC000423264522 388042133 /nfs/dbraw/zinc/04/21/33/388042133.db2.gz CDXDHYJCRURPRR-DFBGVHRSSA-N 2 0 232.371 2.493 20 0 BEADRP Cc1ccncc1[C@@H](C)[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000423264421 388042946 /nfs/dbraw/zinc/04/29/46/388042946.db2.gz YSVDLPZCFPZMPJ-KGLIPLIRSA-N 2 0 247.386 2.430 20 0 BEADRP c1ccc2c(c1)CC[C@H]2[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000423246072 388029755 /nfs/dbraw/zinc/02/97/55/388029755.db2.gz JUPKWHWOKXGBKQ-SWLSCSKDSA-N 2 0 230.355 2.263 20 0 BEADRP Cc1ccnc([C@@H](C)[NH2+]CC[C@H]2CC[NH2+]C2)c1 ZINC000423247266 388030440 /nfs/dbraw/zinc/03/04/40/388030440.db2.gz KYBWZXBNXYKPEO-CHWSQXEVSA-N 2 0 233.359 2.040 20 0 BEADRP CC(C)=CCC[C@H](C)[NH2+]C[C@H]1CCC[NH2+]1 ZINC000423246600 388030566 /nfs/dbraw/zinc/03/05/66/388030566.db2.gz ZLXZRTDVJCNFPO-QWHCGFSZSA-N 2 0 210.365 2.463 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H](c1cccnc1)C1CCC1 ZINC000423274347 388055167 /nfs/dbraw/zinc/05/51/67/388055167.db2.gz MAEQWABKMGQBLA-DOMZBBRYSA-N 2 0 247.386 2.368 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H]1CC[C@H]1C(C)(C)C ZINC000423276148 388056126 /nfs/dbraw/zinc/05/61/26/388056126.db2.gz OFDNJCZWQMEMAT-TUAOUCFPSA-N 2 0 212.381 2.256 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CC[C@H]1C(C)(C)C ZINC000423276145 388057021 /nfs/dbraw/zinc/05/70/21/388057021.db2.gz OFDNJCZWQMEMAT-QJPTWQEYSA-N 2 0 212.381 2.256 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H](C)c1ccc(OC)cc1 ZINC000423278157 388058913 /nfs/dbraw/zinc/05/89/13/388058913.db2.gz QPHNOPFKDYOYQV-VXGBXAGGSA-N 2 0 236.359 2.201 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H](C)c1ccc(F)c(F)c1 ZINC000423277611 388058962 /nfs/dbraw/zinc/05/89/62/388058962.db2.gz QCMZHGZEQSYTOW-UWVGGRQHSA-N 2 0 242.313 2.471 20 0 BEADRP CSCC1CCC([NH2+]C[C@H]([NH3+])C(C)C)CC1 ZINC000423278265 388059989 /nfs/dbraw/zinc/05/99/89/388059989.db2.gz QLVTYRNNYJLUPZ-BPCQOVAHSA-N 2 0 244.448 2.481 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H](C)c1cccc(OC)c1 ZINC000423279684 388062175 /nfs/dbraw/zinc/06/21/75/388062175.db2.gz SSKKMPMYBJRUSI-VXGBXAGGSA-N 2 0 236.359 2.201 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H]1CCCC(C)(C)C1 ZINC000423280282 388062367 /nfs/dbraw/zinc/06/23/67/388062367.db2.gz UISHVJHHUHJQTF-VXGBXAGGSA-N 2 0 212.381 2.400 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H]1CCC[C@@H]1CCCF ZINC000423281020 388063919 /nfs/dbraw/zinc/06/39/19/388063919.db2.gz VHUIDXIUOZLWBV-XQQFMLRXSA-N 2 0 230.371 2.350 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@H]1CCC12CCCC2 ZINC000423281148 388064202 /nfs/dbraw/zinc/06/42/02/388064202.db2.gz UZDOQVGEMVPQSY-NEPJUHHUSA-N 2 0 210.365 2.282 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+][C@H]1CCCC[C@H]1C[NH3+] ZINC000423283449 388064709 /nfs/dbraw/zinc/06/47/09/388064709.db2.gz WEIRWKOZZNLVCV-VOAKCMCISA-N 2 0 210.365 2.282 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H](C1CC1)C1CCCC1 ZINC000423283115 388065363 /nfs/dbraw/zinc/06/53/63/388065363.db2.gz XFRSNHLYAAVQPN-BXUZGUMPSA-N 2 0 224.392 2.400 20 0 BEADRP FCC[C@@H]1CCC[C@H]1[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000423283616 388066011 /nfs/dbraw/zinc/06/60/11/388066011.db2.gz XPQHXWPVUOVYJQ-HZSPNIEDSA-N 2 0 242.382 2.494 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCC[NH2+]C1)[C@H]1C[C@H]1C ZINC000423284667 388067067 /nfs/dbraw/zinc/06/70/67/388067067.db2.gz YRCUSVNRAQHQKY-XQHKEYJVSA-N 2 0 210.365 2.010 20 0 BEADRP CC[C@@H]1CCCC[C@@H]1[NH2+]C[C@H](C)C[NH2+]C ZINC000423284417 388067860 /nfs/dbraw/zinc/06/78/60/388067860.db2.gz YLDWFLKRNPIIHJ-UPJWGTAASA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H]([NH2+][C@H]1CCCC[C@H]1C[NH3+])[C@H]1C[C@H]1C ZINC000423285227 388069768 /nfs/dbraw/zinc/06/97/68/388069768.db2.gz YBASZRXTOPYMDA-MOLYVOAJSA-N 2 0 210.365 2.138 20 0 BEADRP CC[C@H](F)C[NH+]1CCC(C[NH+](C)C)CC1 ZINC000440700900 388071348 /nfs/dbraw/zinc/07/13/48/388071348.db2.gz ZLOISITULIOSHG-LBPRGKRZSA-N 2 0 216.344 2.008 20 0 BEADRP Cc1ccsc1[C@@H](C)[NH2+]CC(C)(C)[NH3+] ZINC000423286284 388071639 /nfs/dbraw/zinc/07/16/39/388071639.db2.gz GKPYGOTYKLBCLK-SECBINFHSA-N 2 0 212.362 2.444 20 0 BEADRP CCO[C@@H]1C[C@@H]([NH2+]CC(C)(C)[NH3+])C1(CC)CC ZINC000423286908 388071704 /nfs/dbraw/zinc/07/17/04/388071704.db2.gz JJFWQRNYHGVTQN-VXGBXAGGSA-N 2 0 242.407 2.297 20 0 BEADRP CC(C)[C@@H](C)[NH2+]CCCC[N@H+](C)C1CC1 ZINC000453398179 388072564 /nfs/dbraw/zinc/07/25/64/388072564.db2.gz KHXIKXVRSQEMIZ-GFCCVEGCSA-N 2 0 212.381 2.495 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]Cc1ccc([C@H](C)[NH3+])cc1 ZINC000423290712 388075027 /nfs/dbraw/zinc/07/50/27/388075027.db2.gz FDHKYNDYBYMOGS-OLZOCXBDSA-N 3 0 249.402 2.313 20 0 BEADRP CCC([NH3+])(CC)C[NH2+][C@H]1CCC[C@H]1CCOC ZINC000423292283 388075389 /nfs/dbraw/zinc/07/53/89/388075389.db2.gz MILDJLDMRDCUPT-STQMWFEESA-N 2 0 242.407 2.299 20 0 BEADRP CCOc1ccccc1[C@H](C)[NH2+]C[C@H](C)C[NH3+] ZINC000423294053 388075571 /nfs/dbraw/zinc/07/55/71/388075571.db2.gz BCAFETOABXVAMG-NEPJUHHUSA-N 2 0 236.359 2.331 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CCC[C@H]2C[NH3+])cc1 ZINC000084217907 388075707 /nfs/dbraw/zinc/07/57/07/388075707.db2.gz SZHJUTMGBIUKFH-UONOGXRCSA-N 2 0 218.344 2.212 20 0 BEADRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]Cc1ccc(F)cc1 ZINC000084217743 388075714 /nfs/dbraw/zinc/07/57/14/388075714.db2.gz ADVNANUONCYZQX-YPMHNXCESA-N 2 0 222.307 2.043 20 0 BEADRP C[N@H+](CCCC[NH2+][C@@H]1CCCSC1)C1CC1 ZINC000453411697 388077180 /nfs/dbraw/zinc/07/71/80/388077180.db2.gz VZDLYQCCRAZZQH-GFCCVEGCSA-N 2 0 242.432 2.346 20 0 BEADRP CSC[C@H](C)[NH2+][C@@H]1CC[N@H+](C)[C@@H]2CCC[C@H]21 ZINC000336658278 388077427 /nfs/dbraw/zinc/07/74/27/388077427.db2.gz BHMPUCLPWKORBM-WUHRBBMRSA-N 2 0 242.432 2.200 20 0 BEADRP Cc1cc(C)c(C[NH2+]C2CC[NH2+]CC2)c(C)c1 ZINC000084517094 388078730 /nfs/dbraw/zinc/07/87/30/388078730.db2.gz QMFQVLPQLBVEAN-UHFFFAOYSA-N 2 0 232.371 2.453 20 0 BEADRP CCN1C[C@@H](C)[C@@H]([NH2+][C@@H](C)C2CCCC2)C1 ZINC000453424489 388080422 /nfs/dbraw/zinc/08/04/22/388080422.db2.gz YDCFSQBHCHZUSN-DYEKYZERSA-N 2 0 224.392 2.495 20 0 BEADRP CCN1C[C@@H](C)[C@H]([NH2+][C@@H](C)C2CCCC2)C1 ZINC000453424490 388080707 /nfs/dbraw/zinc/08/07/07/388080707.db2.gz YDCFSQBHCHZUSN-MBNYWOFBSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CCC2CC(F)(F)C2)CC[N@@H+]1C ZINC000453426111 388081378 /nfs/dbraw/zinc/08/13/78/388081378.db2.gz ONXPCSTXDPIJTF-JQWIXIFHSA-N 2 0 246.345 2.494 20 0 BEADRP CCO[C@@H]1C[C@H]([NH2+][C@@H](C)CC[NH+](C)C)C1(C)C ZINC000085397920 388087407 /nfs/dbraw/zinc/08/74/07/388087407.db2.gz XBEJJXFMNBEPLX-RWMBFGLXSA-N 2 0 242.407 2.120 20 0 BEADRP CC[C@@H](C)C[NH2+]CCCC[N@H+](C)C1CC1 ZINC000453593524 388088864 /nfs/dbraw/zinc/08/88/64/388088864.db2.gz GOFSCFBGQVAJAX-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H]1CSC[C@H]1[NH2+]CCCC[N@H+](C)C1CC1 ZINC000453593595 388089004 /nfs/dbraw/zinc/08/90/04/388089004.db2.gz GWQAGDSOTHXION-DGCLKSJQSA-N 2 0 242.432 2.202 20 0 BEADRP C[N@H+](CCCC[NH2+]C[C@@H]1CCSC1)C1CC1 ZINC000453604210 388091016 /nfs/dbraw/zinc/09/10/16/388091016.db2.gz YCVJCGFCTWBYAN-LBPRGKRZSA-N 2 0 242.432 2.204 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]Cc2ccc(F)cc2)C1 ZINC000086401979 388101505 /nfs/dbraw/zinc/10/15/05/388101505.db2.gz DUWYZRDMEYIYJF-STQMWFEESA-N 2 0 222.307 2.185 20 0 BEADRP C(C[NH2+][C@H]1CCCOCC1)C[NH+]1CCCCC1 ZINC000086869872 388109443 /nfs/dbraw/zinc/10/94/43/388109443.db2.gz ZMZPAKIURSMHCS-AWEZNQCLSA-N 2 0 240.391 2.021 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H]1C[C@H](OC(C)C)C1(C)C ZINC000423266961 388045057 /nfs/dbraw/zinc/04/50/57/388045057.db2.gz DMNAFMLJFLMRDR-AVGNSLFASA-N 2 0 242.407 2.024 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+]C1CCC2(CC2)CC1 ZINC000423267721 388045906 /nfs/dbraw/zinc/04/59/06/388045906.db2.gz FQLYYJUMORFAHK-GFCCVEGCSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@@H]1CCC[C@@H]1CCCF ZINC000423266950 388045982 /nfs/dbraw/zinc/04/59/82/388045982.db2.gz FACRDQBSYQZYNE-JHJVBQTASA-N 2 0 230.371 2.478 20 0 BEADRP Cc1cc(C)cc([C@@H](C)[NH2+]CCC[NH3+])c1 ZINC000148358272 388046047 /nfs/dbraw/zinc/04/60/47/388046047.db2.gz QDLJBDHEFPDHKP-GFCCVEGCSA-N 2 0 206.333 2.303 20 0 BEADRP CC[C@@H]1CC[C@H](C)C[C@@H]1[NH2+][C@@H]1CC[NH2+]C1 ZINC000423213879 388048723 /nfs/dbraw/zinc/04/87/23/388048723.db2.gz LVEJYLCQJPMURG-LOWDOPEQSA-N 2 0 210.365 2.153 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CCCOc2ccccc21 ZINC000423269574 388049286 /nfs/dbraw/zinc/04/92/86/388049286.db2.gz HFSCRIKNXMXSKD-GXTWGEPZSA-N 2 0 248.370 2.345 20 0 BEADRP CCCN1CCC[C@H]1C[NH2+][C@@H]1C[C@@H](C)O[C@@H]1C ZINC000449322365 388172681 /nfs/dbraw/zinc/17/26/81/388172681.db2.gz XFHNTRXAPBJWRK-YIYPIFLZSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC000488464204 388181134 /nfs/dbraw/zinc/18/11/34/388181134.db2.gz RGNFRHTYQQQAFB-IUODEOHRSA-N 2 0 232.371 2.494 20 0 BEADRP C1CC1[C@@H]([NH2+][C@@H]1CCC[NH2+]CC1)C1CCC1 ZINC000324843455 388124816 /nfs/dbraw/zinc/12/48/16/388124816.db2.gz XESHORAVMSBKMS-KGLIPLIRSA-N 2 0 222.376 2.297 20 0 BEADRP C1CC1[C@H]([NH2+][C@H]1CCC[NH2+]CC1)C1CCC1 ZINC000324843456 388124950 /nfs/dbraw/zinc/12/49/50/388124950.db2.gz XESHORAVMSBKMS-UONOGXRCSA-N 2 0 222.376 2.297 20 0 BEADRP CCSCCC[NH2+][C@H]1CC[N@H+](C)C[C@@H]1C ZINC000164021958 388132396 /nfs/dbraw/zinc/13/23/96/388132396.db2.gz CIMDOSMHFSGGJD-RYUDHWBXSA-N 2 0 230.421 2.059 20 0 BEADRP COCC[N@H+](C)CCC[NH2+][C@H](C)CC(C)(C)C ZINC000449076456 388139668 /nfs/dbraw/zinc/13/96/68/388139668.db2.gz HMVQNIOBLRQHTP-CYBMUJFWSA-N 2 0 244.423 2.369 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H]2CSC[C@@H]2C)C1 ZINC000449095307 388141361 /nfs/dbraw/zinc/14/13/61/388141361.db2.gz XQSKYQIGFNPCGJ-XQQFMLRXSA-N 2 0 242.432 2.059 20 0 BEADRP Cc1cccc(CC[NH2+]CCN(C)C(C)C)c1 ZINC000449113889 388144311 /nfs/dbraw/zinc/14/43/11/388144311.db2.gz YAQMJSRKFBMHNM-UHFFFAOYSA-N 2 0 234.387 2.467 20 0 BEADRP CC[C@H](O)[C@H](CC)[NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000313148077 256541508 /nfs/dbraw/zinc/54/15/08/256541508.db2.gz KCZRBEDUXQFOLH-QPSCCSFWSA-N 2 0 248.370 2.270 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+][C@@H](C)C2CC2)[C@@H](C)C1 ZINC000449445645 388207915 /nfs/dbraw/zinc/20/79/15/388207915.db2.gz KAAVRKKGRUQBIK-GMXVVIOVSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+]C(C)(C)CCC[NH+](C)C ZINC000449529815 388218142 /nfs/dbraw/zinc/21/81/42/388218142.db2.gz ZZSFSOVEFXURAK-VXGBXAGGSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]CC1(C)CCC1 ZINC000090220111 256558190 /nfs/dbraw/zinc/55/81/90/256558190.db2.gz PBUWGGJZFXEGCN-JHJVBQTASA-N 2 0 224.392 2.495 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@@H]2C[C@H]2C(C)C)CC1 ZINC000449552073 388230535 /nfs/dbraw/zinc/23/05/35/388230535.db2.gz IGELUQCRLUTYRT-JSGCOSHPSA-N 2 0 224.392 2.352 20 0 BEADRP CCC(CC)C[N@@H+]1CC[C@H](C)[C@H](C[NH3+])C1 ZINC000164666219 388242434 /nfs/dbraw/zinc/24/24/34/388242434.db2.gz ISLWBCJGLUPLAK-WCQYABFASA-N 2 0 212.381 2.339 20 0 BEADRP CC1(C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)CCCC1 ZINC000086404245 388348358 /nfs/dbraw/zinc/34/83/58/388348358.db2.gz JWTCIMSZIBUOQC-NEPJUHHUSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@@H](C[NH3+])N[C@@H](C)c1ccccc1OC(F)F ZINC000235145933 388365046 /nfs/dbraw/zinc/36/50/46/388365046.db2.gz UZOGNVREASGQQE-IUCAKERBSA-N 2 0 244.285 2.286 20 0 BEADRP C[C@H](CN)[NH2+]CC[C@H](C)c1ccccc1 ZINC000235451864 388369476 /nfs/dbraw/zinc/36/94/76/388369476.db2.gz IYPBDLLXAHPNQN-NWDGAFQWSA-N 2 0 206.333 2.117 20 0 BEADRP Cc1ccc(CCC[NH2+][C@@H](C)C[C@H](C)[NH3+])cn1 ZINC000572721725 388370900 /nfs/dbraw/zinc/37/09/00/388370900.db2.gz BVONCVDYMLCBQJ-AAEUAGOBSA-N 2 0 235.375 2.038 20 0 BEADRP C[NH+](C)Cc1ccc(C[NH2+]CC2(F)CC2)cc1 ZINC000525981885 388447043 /nfs/dbraw/zinc/44/70/43/388447043.db2.gz GWMKJQIGZKBLDI-UHFFFAOYSA-N 2 0 236.334 2.340 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@H]3C[NH2+]C[C@H]3CC2)cc1 ZINC000335270658 388449164 /nfs/dbraw/zinc/44/91/64/388449164.db2.gz QISKAQSQBSFHBC-IYBDPMFKSA-N 2 0 244.382 2.426 20 0 BEADRP COCC[C@@H](C)[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C ZINC000176078642 388450331 /nfs/dbraw/zinc/45/03/31/388450331.db2.gz WXLBYJNPRLYMDV-OLZOCXBDSA-N 2 0 244.423 2.367 20 0 BEADRP Cc1ccc(C[N@@H+]2C[C@H](C[NH3+])[C@H](C)C[C@@H]2C)cn1 ZINC000397304648 388458457 /nfs/dbraw/zinc/45/84/57/388458457.db2.gz LYEUKELYWFBAQR-ZLDLUXBVSA-N 2 0 247.386 2.195 20 0 BEADRP CCc1ccc([C@H](C)[NH2+]C[C@H](C)C[NH3+])cc1 ZINC000336673901 388461511 /nfs/dbraw/zinc/46/15/11/388461511.db2.gz OVTNHVDXOIUFED-NEPJUHHUSA-N 2 0 220.360 2.494 20 0 BEADRP CCC[C@H](C)C[N@@H+]1CC[C@]2(CC[NH2+]C2)C1 ZINC000336717618 388467750 /nfs/dbraw/zinc/46/77/50/388467750.db2.gz YCMUJNBEBMDCNA-STQMWFEESA-N 2 0 210.365 2.108 20 0 BEADRP C[C@@H](c1ccccc1)[N@H+](C)C[C@@H]1CC[NH2+]C1 ZINC000034620096 388476423 /nfs/dbraw/zinc/47/64/23/388476423.db2.gz YAQVUKXLGVEJBT-QWHCGFSZSA-N 2 0 218.344 2.289 20 0 BEADRP CC1CCC([NH2+]C2CC([NH+](C)C)C2)CC1 ZINC000573106407 388420059 /nfs/dbraw/zinc/42/00/59/388420059.db2.gz KGAYOVIILRKYFI-UHFFFAOYSA-N 2 0 210.365 2.247 20 0 BEADRP C[N@@H+]1CCC[C@@H]2C[NH+](C3CCCC3)CC[C@H]21 ZINC000245630668 388426015 /nfs/dbraw/zinc/42/60/15/388426015.db2.gz PYGVYQQLMWTVOK-TZMCWYRMSA-N 2 0 222.376 2.345 20 0 BEADRP CC[C@@H]([NH2+]C[C@H]1CC[N@H+](CC)C1)C1CCC1 ZINC000322367552 388433231 /nfs/dbraw/zinc/43/32/31/388433231.db2.gz ILUDRGCICOCQMY-TZMCWYRMSA-N 2 0 224.392 2.497 20 0 BEADRP CCC1([NH2+]C2CC[NH+](CC3CC3)CC2)CC1 ZINC000514913178 256725316 /nfs/dbraw/zinc/72/53/16/256725316.db2.gz XBDRSYZJLAVKAO-UHFFFAOYSA-N 2 0 222.376 2.393 20 0 BEADRP CC[C@](C)(C[NH2+]C1CC[NH+](C(C)C)CC1)OC ZINC000322491160 388436351 /nfs/dbraw/zinc/43/63/51/388436351.db2.gz CCPNOUZPCFYIJN-CQSZACIVSA-N 2 0 242.407 2.264 20 0 BEADRP CC[C@](C)(C[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)OC ZINC000322514412 388437369 /nfs/dbraw/zinc/43/73/69/388437369.db2.gz JTUQVBUJCCDHNK-BFHYXJOUSA-N 2 0 240.391 2.018 20 0 BEADRP CC[C@H](C[NH2+]C1CC[NH+](C(C)(C)C)CC1)OC ZINC000353562181 388542601 /nfs/dbraw/zinc/54/26/01/388542601.db2.gz RQQFHNCGAXZNMF-CYBMUJFWSA-N 2 0 242.407 2.264 20 0 BEADRP CCC[C@@H]([NH2+]CCN(C)C)[C@@H]1CC1(C)C ZINC000397853325 388506691 /nfs/dbraw/zinc/50/66/91/388506691.db2.gz SMYDREKUJYQFCF-NWDGAFQWSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H]([NH2+]CCC[NH2+]C1CC1)[C@@H]1CC1(C)C ZINC000397867826 388507587 /nfs/dbraw/zinc/50/75/87/388507587.db2.gz ZHGCHGBBQHNUBG-JQWIXIFHSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@@H]1CCC[C@H](C[N@@H+]2CC[C@@H](C[NH3+])C2)C1 ZINC000347093882 388521878 /nfs/dbraw/zinc/52/18/78/388521878.db2.gz GUQGYRUDRCRMGF-RDBSUJKOSA-N 2 0 224.392 2.483 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H]2C[C@@H]2C(F)F)CC1 ZINC000348150422 388525683 /nfs/dbraw/zinc/52/56/83/388525683.db2.gz LCECRWBWFKUZHI-QWRGUYRKSA-N 2 0 232.318 2.104 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+][C@H](C)Cc1ccsc1 ZINC000516958066 388528493 /nfs/dbraw/zinc/52/84/93/388528493.db2.gz YNKHQQNHILPZAV-PWSUYJOCSA-N 2 0 226.389 2.252 20 0 BEADRP CO[C@H](C[N@@H+]1CC[C@@H]([NH3+])[C@@H](C)C1)c1ccccc1 ZINC000379181735 388595841 /nfs/dbraw/zinc/59/58/41/388595841.db2.gz GOZMZMXFSFDUDY-NWANDNLSSA-N 2 0 248.370 2.043 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@H]2CCC[C@H]2F)[C@H]2CCC[C@@H]21 ZINC000550934147 388617539 /nfs/dbraw/zinc/61/75/39/388617539.db2.gz WVMNOXKPDVJCNZ-DGTMBMJNSA-N 2 0 240.366 2.339 20 0 BEADRP CCC[C@H](C)C[NH+]1CCC([NH2+]CCOC)CC1 ZINC000548881185 388568473 /nfs/dbraw/zinc/56/84/73/388568473.db2.gz DAJZTGOZOSSLPO-ZDUSSCGKSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@@H]1CC(F)(F)CC[N@@H+]1CCCn1ccnc1 ZINC000528765781 388569700 /nfs/dbraw/zinc/56/97/00/388569700.db2.gz FRDLUFXPTYAFCK-LLVKDONJSA-N 2 0 243.301 2.393 20 0 BEADRP CCC[N@H+](C)C[C@H]1CC[NH+](CC(C)C)C1 ZINC000081572168 388584163 /nfs/dbraw/zinc/58/41/63/388584163.db2.gz BERZUPDNUKPJPD-CYBMUJFWSA-N 2 0 212.381 2.306 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)cn1 ZINC000248062011 388673173 /nfs/dbraw/zinc/67/31/73/388673173.db2.gz LWSSCNPFALWXKV-DZGCQCFKSA-N 2 0 247.386 2.005 20 0 BEADRP C[C@@H](CC1CCC1)[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000530176281 388620886 /nfs/dbraw/zinc/62/08/86/388620886.db2.gz AKINQRPZNMKSAE-AAEUAGOBSA-N 2 0 222.376 2.439 20 0 BEADRP COc1ccccc1CN[C@@H]1CC[NH2+]C12CCC2 ZINC000530177642 388621190 /nfs/dbraw/zinc/62/11/90/388621190.db2.gz LLARZYZZPTUBNH-CQSZACIVSA-N 2 0 246.354 2.069 20 0 BEADRP CCCC[C@H](C)[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000530176689 388621586 /nfs/dbraw/zinc/62/15/86/388621586.db2.gz JWALNLYBTVJDKM-NWDGAFQWSA-N 2 0 210.365 2.439 20 0 BEADRP C[C@@H](CCc1ccco1)N[C@@H]1CC[NH2+]C12CCC2 ZINC000530178660 388622193 /nfs/dbraw/zinc/62/21/93/388622193.db2.gz PNNCRCNOMWMRSK-GXTWGEPZSA-N 2 0 248.370 2.475 20 0 BEADRP COCC[C@H](C)[NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1 ZINC000125963792 388684125 /nfs/dbraw/zinc/68/41/25/388684125.db2.gz NOLJLDROLZGZEV-UONOGXRCSA-N 2 0 242.407 2.121 20 0 BEADRP COCC[N@H+](C)CCC[NH2+][C@@H]1CC=C(C)CC1 ZINC000551264970 388624686 /nfs/dbraw/zinc/62/46/86/388624686.db2.gz HNHBEJHDKHIQDC-CQSZACIVSA-N 2 0 240.391 2.043 20 0 BEADRP C[C@@H]1CC(F)(F)CC[N@@H+]1CC1CC[NH2+]CC1 ZINC000530208511 388626838 /nfs/dbraw/zinc/62/68/38/388626838.db2.gz UGQNGIFFXHIJDP-SNVBAGLBSA-N 2 0 232.318 2.106 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[NH2+]C12CCC2)C(C)C ZINC000530217455 388629911 /nfs/dbraw/zinc/62/99/11/388629911.db2.gz GQBWZNLADXFZKB-NWDGAFQWSA-N 2 0 210.365 2.295 20 0 BEADRP CC1(C)CC(C[N@@H+]2C[C@@H]3CCC[C@H]([NH3+])[C@H]3C2)C1 ZINC000530217093 388629917 /nfs/dbraw/zinc/62/99/17/388629917.db2.gz FIGDJMSYWHYERA-IHRRRGAJSA-N 2 0 236.403 2.482 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[NH2+]C12CCC2)[C@H]1C[C@H]1C ZINC000530216140 388629948 /nfs/dbraw/zinc/62/99/48/388629948.db2.gz MVYIMMVHRFWUKG-MROQNXINSA-N 2 0 222.376 2.295 20 0 BEADRP CC[C@H]1C[N@H+](CC2CC(C)(C)C2)CC[C@@H]1[NH3+] ZINC000530217920 388630838 /nfs/dbraw/zinc/63/08/38/388630838.db2.gz JCWDBKXJBDBPEG-STQMWFEESA-N 2 0 224.392 2.482 20 0 BEADRP [NH3+][C@H]1CCCCC[C@H]1[NH2+]CC1CC=CC1 ZINC000530218778 388631568 /nfs/dbraw/zinc/63/15/68/388631568.db2.gz XEPGPYNNEVLWAH-QWHCGFSZSA-N 2 0 208.349 2.202 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000530221202 388633078 /nfs/dbraw/zinc/63/30/78/388633078.db2.gz OTNSCSGUROBYFI-FRRDWIJNSA-N 2 0 222.376 2.439 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000530221200 388633258 /nfs/dbraw/zinc/63/32/58/388633258.db2.gz OTNSCSGUROBYFI-AGIUHOORSA-N 2 0 222.376 2.439 20 0 BEADRP C1CC1C([NH2+][C@H]1CC[NH2+]C12CCC2)C1CC1 ZINC000530224181 388633627 /nfs/dbraw/zinc/63/36/27/388633627.db2.gz VCXSEPZVWWCAKA-LBPRGKRZSA-N 2 0 220.360 2.049 20 0 BEADRP CSCCCC[NH2+][C@@H]1CC[N@H+](C)C[C@@H]1C ZINC000223738935 388657656 /nfs/dbraw/zinc/65/76/56/388657656.db2.gz WHCKHGSYVBEZFS-NWDGAFQWSA-N 2 0 230.421 2.059 20 0 BEADRP CSCCCC[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@@H]1C ZINC000223738667 388657937 /nfs/dbraw/zinc/65/79/37/388657937.db2.gz QIMVZSBPEYEUFG-RWMBFGLXSA-N 2 0 244.448 2.448 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000423285365 388690100 /nfs/dbraw/zinc/69/01/00/388690100.db2.gz ZLMSDOPXOHPATC-HZSPNIEDSA-N 2 0 224.392 2.400 20 0 BEADRP [NH3+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000521398902 388704536 /nfs/dbraw/zinc/70/45/36/388704536.db2.gz GMASNXQZSDUFSG-AWEZNQCLSA-N 2 0 230.355 2.247 20 0 BEADRP CC[C@H]1CCC[C@H]1[NH2+]C1CCC([NH3+])CC1 ZINC000229635451 388797158 /nfs/dbraw/zinc/79/71/58/388797158.db2.gz CDDVDRWNVAXSTF-YWPUVAFDSA-N 2 0 210.365 2.425 20 0 BEADRP CSC1(C[NH2+][C@@H]2C[C@@H](C)[N@H+](C)C[C@@H]2C)CC1 ZINC000228023092 388766139 /nfs/dbraw/zinc/76/61/39/388766139.db2.gz PIQKAGGOXVZLQP-QJPTWQEYSA-N 2 0 242.432 2.200 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)CC2CC2)C1 ZINC000252715821 388774605 /nfs/dbraw/zinc/77/46/05/388774605.db2.gz WUOLIKCKIWIPNN-DGCLKSJQSA-N 2 0 210.365 2.106 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)CC2CC2)C1 ZINC000252715822 388775559 /nfs/dbraw/zinc/77/55/59/388775559.db2.gz WUOLIKCKIWIPNN-YPMHNXCESA-N 2 0 210.365 2.106 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](CC)C2CC2)C1 ZINC000252717144 388775570 /nfs/dbraw/zinc/77/55/70/388775570.db2.gz ZWAFCOFRNMHMNP-GXTWGEPZSA-N 2 0 224.392 2.497 20 0 BEADRP CC[N@H+](CC1CCC1)C[C@]1(C)CC[NH2+]C1 ZINC000230320746 388824058 /nfs/dbraw/zinc/82/40/58/388824058.db2.gz QQPCKLALTDCBNT-CYBMUJFWSA-N 2 0 210.365 2.108 20 0 BEADRP CCC(C)(C)C[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000230676188 388829300 /nfs/dbraw/zinc/82/93/00/388829300.db2.gz DLEFOXAYHPBHOM-RYUDHWBXSA-N 2 0 212.381 2.495 20 0 BEADRP CC(C)COCCC[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000129838596 388871756 /nfs/dbraw/zinc/87/17/56/388871756.db2.gz ALMFLNALDHYSHP-UONOGXRCSA-N 2 0 242.407 2.121 20 0 BEADRP CC(C)COCCC[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000129838359 388872212 /nfs/dbraw/zinc/87/22/12/388872212.db2.gz ALMFLNALDHYSHP-ZIAGYGMSSA-N 2 0 242.407 2.121 20 0 BEADRP CC(C)C1CC([NH2+]CC2CC[NH+](C)CC2)C1 ZINC000232536711 388851122 /nfs/dbraw/zinc/85/11/22/388851122.db2.gz QXFOEHCWRLCOKR-UHFFFAOYSA-N 2 0 224.392 2.352 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]CC2Cc3ccccc3C2)C1 ZINC000565609814 388958529 /nfs/dbraw/zinc/95/85/29/388958529.db2.gz RMZYZPZDDDHLKW-JKSUJKDBSA-N 2 0 244.382 2.261 20 0 BEADRP CC[C@H]([NH2+]Cc1ccc(C[NH3+])cc1)[C@@H]1CCOC1 ZINC000565421908 388942766 /nfs/dbraw/zinc/94/27/66/388942766.db2.gz IPXYFINXZQLMJJ-CABCVRRESA-N 2 0 248.370 2.050 20 0 BEADRP Cc1cc(F)ccc1C[NH2+][C@H](C)C[C@@H](C)[NH3+] ZINC000565951137 388980430 /nfs/dbraw/zinc/98/04/30/388980430.db2.gz KRJKKJXFABFKHF-GHMZBOCLSA-N 2 0 224.323 2.350 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H](C)c1cccs1 ZINC000566088379 388984412 /nfs/dbraw/zinc/98/44/12/388984412.db2.gz YUNYXEVWJZPFTO-SNVBAGLBSA-N 2 0 212.362 2.398 20 0 BEADRP COCCCCC[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000166395484 533231825 /nfs/dbraw/zinc/23/18/25/533231825.db2.gz CAOAORRTKFXVRY-ZIAGYGMSSA-N 2 0 240.391 2.020 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)C1CCCC1)[C@@H]1CCC[NH2+]1 ZINC000400378478 533494925 /nfs/dbraw/zinc/49/49/25/533494925.db2.gz JMFGYNGFYSLMHM-LOWVWBTDSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)[C@H]1CCC[NH2+]1)C1CCCC1 ZINC000400378482 533499560 /nfs/dbraw/zinc/49/95/60/533499560.db2.gz JMFGYNGFYSLMHM-NTZNESFSSA-N 2 0 210.365 2.295 20 0 BEADRP Cc1cc(N2CC[N@@H+]3CCCC[C@@H]3C2)cc[nH+]1 ZINC000274311101 132202769 /nfs/dbraw/zinc/20/27/69/132202769.db2.gz AVFJETPMUFKXMH-CQSZACIVSA-N 2 0 231.343 2.065 20 0 BEADRP Cc1cc(N2CC[NH+](CC(C)C)CC2)cc[nH+]1 ZINC000274755620 132203983 /nfs/dbraw/zinc/20/39/83/132203983.db2.gz NSQSXXZDPRHICG-UHFFFAOYSA-N 2 0 233.359 2.168 20 0 BEADRP Cc1cc(N2CCC[C@H]([NH+]3CCCC3)C2)cc[nH+]1 ZINC000302217137 132261795 /nfs/dbraw/zinc/26/17/95/132261795.db2.gz JMJQFFFGTAYMAI-HNNXBMFYSA-N 2 0 245.370 2.455 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000334317522 132296232 /nfs/dbraw/zinc/29/62/32/132296232.db2.gz VAOUZCKDNVAKTM-DOMZBBRYSA-N 2 0 245.370 2.439 20 0 BEADRP CC[NH+]1CCC(C[NH2+]Cc2cccc(O)c2)CC1 ZINC000044517562 322840671 /nfs/dbraw/zinc/84/06/71/322840671.db2.gz SNMXQTHOYPZDDV-UHFFFAOYSA-N 2 0 248.370 2.214 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@H]1C[NH3+])C1CCCC1 ZINC000088162886 133551548 /nfs/dbraw/zinc/55/15/48/133551548.db2.gz LOBYTSRXOANCBY-WCFLWFBJSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H](F)CC[N@@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000352051357 134048192 /nfs/dbraw/zinc/04/81/92/134048192.db2.gz ZJQXEEBMTKIPAA-STQMWFEESA-N 2 0 228.355 2.152 20 0 BEADRP Cc1c[nH+]ccc1N1CCC[C@H]([NH+]2CCCC2)C1 ZINC000336103249 134084325 /nfs/dbraw/zinc/08/43/25/134084325.db2.gz UBWSFIXTWYYXEH-AWEZNQCLSA-N 2 0 245.370 2.455 20 0 BEADRP CC[C@@H](C)[NH+]1CCC([NH2+]CC2CC2)CC1 ZINC000168534228 134225734 /nfs/dbraw/zinc/22/57/34/134225734.db2.gz APOSOWWVTPRGRM-LLVKDONJSA-N 2 0 210.365 2.249 20 0 BEADRP CC1(C)CCC[C@@H]1[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000168770059 134247681 /nfs/dbraw/zinc/24/76/81/134247681.db2.gz VQBZZFNQTVKSCA-NEPJUHHUSA-N 2 0 210.365 2.297 20 0 BEADRP Cc1cc(C[NH2+][C@@H](C)CC[NH3+])ccc1Cl ZINC000220484662 134305203 /nfs/dbraw/zinc/30/52/03/134305203.db2.gz KGLNXMSATDCRQT-JTQLQIEISA-N 2 0 226.751 2.475 20 0 BEADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@@H](C)C1CCC1 ZINC000178377513 134309407 /nfs/dbraw/zinc/30/94/07/134309407.db2.gz OXQREBQKAOWKCT-GXTWGEPZSA-N 2 0 242.407 2.121 20 0 BEADRP Cc1cc(C)cc(C[NH2+][C@H](C)CC[NH3+])c1 ZINC000220538963 134309782 /nfs/dbraw/zinc/30/97/82/134309782.db2.gz TYZQARIIERWZTL-GFCCVEGCSA-N 2 0 206.333 2.130 20 0 BEADRP C[N@@H+]1CCC[C@H]2C[NH+](C[Si](C)(C)C)CC[C@@H]21 ZINC000178629240 134312139 /nfs/dbraw/zinc/31/21/39/134312139.db2.gz FWVDWNAGQWSCES-STQMWFEESA-N 2 0 240.467 2.280 20 0 BEADRP CSCC[C@@H](C)[N@H+](C)C[C@@]1(C)CC[NH2+]C1 ZINC000222338488 134328945 /nfs/dbraw/zinc/32/89/45/134328945.db2.gz SHEVVPZFANWOON-NEPJUHHUSA-N 2 0 230.421 2.059 20 0 BEADRP CC1(C)C[C@@H]1C[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000222028982 134329374 /nfs/dbraw/zinc/32/93/74/134329374.db2.gz IPVXRFFYDJXAEH-JHJVBQTASA-N 2 0 222.376 2.249 20 0 BEADRP CC[C@H](C)C[N@H+](CC)C[C@@]1(C)CC[NH2+]C1 ZINC000223399930 134338810 /nfs/dbraw/zinc/33/88/10/134338810.db2.gz YSMFLGKSOAHNRM-STQMWFEESA-N 2 0 212.381 2.354 20 0 BEADRP C[NH+]1CCC(CC[NH2+]C[C@H]2CCSC2)CC1 ZINC000224480053 134348218 /nfs/dbraw/zinc/34/82/18/134348218.db2.gz ZIRWYSSAGJIRFY-CYBMUJFWSA-N 2 0 242.432 2.061 20 0 BEADRP COCC[C@@H](C)[NH2+]CC1(C[NH+](C)C)CCCC1 ZINC000184474690 134364264 /nfs/dbraw/zinc/36/42/64/134364264.db2.gz SRZBRSZRKJQOEW-CYBMUJFWSA-N 2 0 242.407 2.123 20 0 BEADRP CCCN(CC)CC[NH2+]C[C@H]1CCSC1 ZINC000226383915 134364868 /nfs/dbraw/zinc/36/48/68/134364868.db2.gz VXAHVVBULYXJSZ-GFCCVEGCSA-N 2 0 230.421 2.061 20 0 BEADRP CCN(C)CC[NH2+][C@@H]1C[C@H](OC(C)C)C1(C)C ZINC000185207502 134375112 /nfs/dbraw/zinc/37/51/12/134375112.db2.gz CWUPJPBVOZIXOA-OLZOCXBDSA-N 2 0 242.407 2.120 20 0 BEADRP C[NH+]1CCC(C)(C[NH2+]C2CCSCC2)CC1 ZINC000227329684 134377981 /nfs/dbraw/zinc/37/79/81/134377981.db2.gz ITPSYUMIMLCDBB-UHFFFAOYSA-N 2 0 242.432 2.204 20 0 BEADRP CC(C)C(C)(C)C[NH2+][C@H]1CCC[C@H]1C[NH3+] ZINC000232788883 134556366 /nfs/dbraw/zinc/55/63/66/134556366.db2.gz ZXMPPKZCOLCJJP-RYUDHWBXSA-N 2 0 212.381 2.386 20 0 BEADRP C[C@@H](CC[NH3+])[NH2+]Cc1ccc2ncccc2c1 ZINC000136137743 134764663 /nfs/dbraw/zinc/76/46/63/134764663.db2.gz PTAFBSIIUIIMOX-NSHDSACASA-N 2 0 229.327 2.062 20 0 BEADRP [NH3+]CCCC[NH2+][C@@H]1CCCc2sccc21 ZINC000061328170 134796888 /nfs/dbraw/zinc/79/68/88/134796888.db2.gz YUGFPTBBDAPGHY-LLVKDONJSA-N 2 0 224.373 2.454 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CC2CC[NH+](C)CC2)C1 ZINC000070643695 135001394 /nfs/dbraw/zinc/00/13/94/135001394.db2.gz YVWMRLHIXNECMJ-YPMHNXCESA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1CCC[C@H]1[NH2+]CC1CC[NH+](C)CC1 ZINC000070828350 135014141 /nfs/dbraw/zinc/01/41/41/135014141.db2.gz HTPNMBAWTQQIKJ-DGCLKSJQSA-N 2 0 210.365 2.106 20 0 BEADRP CC[NH+](CC)CCC[NH2+]C[C@@H]1CCSC1 ZINC000163619979 135021293 /nfs/dbraw/zinc/02/12/93/135021293.db2.gz WCWJLNWPSCWMTD-LBPRGKRZSA-N 2 0 230.421 2.061 20 0 BEADRP CCN1CCC[C@@H]1C[NH2+][C@H](C)C1(C)CC1 ZINC000248897562 135026658 /nfs/dbraw/zinc/02/66/58/135026658.db2.gz MYABEOKOYGZXEH-VXGBXAGGSA-N 2 0 210.365 2.249 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H]2CCCC2(C)C)C1 ZINC000250346254 135052528 /nfs/dbraw/zinc/05/25/28/135052528.db2.gz QNAAKZYHTIAQJO-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)CCC[N@@H+]1CCC[C@@H]([C@H](C)[NH3+])C1 ZINC000250508840 135056264 /nfs/dbraw/zinc/05/62/64/135056264.db2.gz AVYBVBKYXPLCCL-QWHCGFSZSA-N 2 0 212.381 2.482 20 0 BEADRP C[C@@H]1CCCC[N@@H+]1CCC[NH2+][C@H]1CCCOC1 ZINC000251556863 135071062 /nfs/dbraw/zinc/07/10/62/135071062.db2.gz ADVDMASHOYPGNI-KGLIPLIRSA-N 2 0 240.391 2.020 20 0 BEADRP CC[C@H](C)C[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@H]1C ZINC000251763027 135076424 /nfs/dbraw/zinc/07/64/24/135076424.db2.gz HTLOIIFJKSVNMK-UMSGYPCISA-N 2 0 212.381 2.351 20 0 BEADRP CC[C@H](C)C[N@H+](CC)CC[C@H]1CC[NH2+]C1 ZINC000251857883 135078695 /nfs/dbraw/zinc/07/86/95/135078695.db2.gz OALCMGZWMITPMO-QWHCGFSZSA-N 2 0 212.381 2.354 20 0 BEADRP CC[C@H](C)C[N@H+](CC)C[C@H]1CCC[NH2+]C1 ZINC000251844467 135079060 /nfs/dbraw/zinc/07/90/60/135079060.db2.gz LYOJSVUYWGMXOV-STQMWFEESA-N 2 0 212.381 2.354 20 0 BEADRP CC[C@H](C)[C@@H](C)[NH2+][C@H](C)CC[NH+](C)C ZINC000252033279 135082712 /nfs/dbraw/zinc/08/27/12/135082712.db2.gz ZSKOACMGGWVAJB-QJPTWQEYSA-N 2 0 200.370 2.351 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000252124096 135085012 /nfs/dbraw/zinc/08/50/12/135085012.db2.gz JUXZVNCDYBRTCN-AGIUHOORSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+][C@H]1CCN2CCCC[C@@H]12 ZINC000252171360 135086118 /nfs/dbraw/zinc/08/61/18/135086118.db2.gz OACOQGIYOAHRGI-RFGFWPKPSA-N 2 0 222.376 2.391 20 0 BEADRP CC(C)C[C@H](N)C[NH+]1C[C@@H](C)C[C@H](C)C1 ZINC000252156466 135086139 /nfs/dbraw/zinc/08/61/39/135086139.db2.gz PFEXFQONOYGOKR-AVGNSLFASA-N 2 0 212.381 2.338 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+][C@H]1CCCC[C@@H]1C[NH3+] ZINC000252215430 135087725 /nfs/dbraw/zinc/08/77/25/135087725.db2.gz XNDMLUZBOMACPW-NDBYEHHHSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1OCC[C@H]1[NH2+]CCC[N@@H+]1CCCC[C@H]1C ZINC000252691061 135096762 /nfs/dbraw/zinc/09/67/62/135096762.db2.gz WUSWMRASACCZSY-HZSPNIEDSA-N 2 0 240.391 2.018 20 0 BEADRP Cc1ccsc1C[N@@H+]1CC[C@@H]([NH3+])[C@H](C)C1 ZINC000086884477 135099454 /nfs/dbraw/zinc/09/94/54/135099454.db2.gz SNXWKUQNDKWVLI-GHMZBOCLSA-N 2 0 224.373 2.226 20 0 BEADRP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]CC1CCCC1 ZINC000252711814 135101002 /nfs/dbraw/zinc/10/10/02/135101002.db2.gz KRLJCZIYNXKGSH-WCQYABFASA-N 2 0 210.365 2.106 20 0 BEADRP CCC[C@@H]1C[C@@H]1[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@H]1C ZINC000252732529 135104546 /nfs/dbraw/zinc/10/45/46/135104546.db2.gz VNTJYJUWWWZKQF-ITGHMWBKSA-N 2 0 224.392 2.493 20 0 BEADRP C[C@H](C[C@H]1CCCCC[NH2+]1)[NH2+][C@@H](C)C[C@H](C)O ZINC000252751542 135107756 /nfs/dbraw/zinc/10/77/56/135107756.db2.gz GRXBOFOXLFVHJM-RFQIPJPRSA-N 2 0 242.407 2.046 20 0 BEADRP CSCC[C@H](C)[N@H+](C)CC[C@H]1CCC[NH2+]C1 ZINC000253065096 135119899 /nfs/dbraw/zinc/11/98/99/135119899.db2.gz IBLBEKZCDIDESR-QWHCGFSZSA-N 2 0 244.448 2.450 20 0 BEADRP Cc1ccsc1C[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000087309991 135121563 /nfs/dbraw/zinc/12/15/63/135121563.db2.gz UZPMKFJIHFCMHK-LLVKDONJSA-N 2 0 224.373 2.146 20 0 BEADRP Cc1ccsc1C[NH2+]C[C@@]1(C)CC[NH2+]C1 ZINC000087309982 135122041 /nfs/dbraw/zinc/12/20/41/135122041.db2.gz XJRPUGXIHFBHOF-LBPRGKRZSA-N 2 0 224.373 2.146 20 0 BEADRP C[C@H]1CC[C@H]([NH2+]C2CCC([NH3+])CC2)CC1 ZINC000253137168 135122227 /nfs/dbraw/zinc/12/22/27/135122227.db2.gz TYLOJYIIWLGSLH-RUXNMCCTSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@H](c1ccccc1)[N@@H+]1CC[C@@]2(CC[NH2+]C2)C1 ZINC000257690570 135139060 /nfs/dbraw/zinc/13/90/60/135139060.db2.gz JBACJOGWDMWQSV-UKRRQHHQSA-N 2 0 230.355 2.433 20 0 BEADRP C(C1CCCC1)[N@@H+]1CC[C@]2(C1)CCC[NH2+]C2 ZINC000257703392 135140221 /nfs/dbraw/zinc/14/02/21/135140221.db2.gz QRUQXZVRHHYQEQ-CQSZACIVSA-N 2 0 222.376 2.252 20 0 BEADRP C[C@H](c1ccccn1)[NH+]1CCC2(CC[NH2+]C2)CC1 ZINC000257710315 135140999 /nfs/dbraw/zinc/14/09/99/135140999.db2.gz NPNRVLHWEANPFH-CYBMUJFWSA-N 2 0 245.370 2.218 20 0 BEADRP Cc1cc(C)cc(C[N@@H+]2CC[C@]3(CC[NH2+]C3)C2)c1 ZINC000257712243 135141060 /nfs/dbraw/zinc/14/10/60/135141060.db2.gz TVAOOOMHXZPLEV-INIZCTEOSA-N 2 0 244.382 2.489 20 0 BEADRP Cc1ccsc1C[N@@H+]1CC[C@]2(CC[NH2+]C2)C1 ZINC000257739732 135141205 /nfs/dbraw/zinc/14/12/05/135141205.db2.gz YRVXABDGTABFLC-ZDUSSCGKSA-N 2 0 236.384 2.242 20 0 BEADRP CC(C)[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH2+]C1 ZINC000257789556 135141608 /nfs/dbraw/zinc/14/16/08/135141608.db2.gz XGYZEFMDIWROOC-KBPBESRZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[C@H](C)[N@H+](C[C@@H]2CC[NH2+][C@H](C)C2)C1 ZINC000261530777 135158989 /nfs/dbraw/zinc/15/89/89/135158989.db2.gz DAOGTQJETADWAV-FVCCEPFGSA-N 2 0 210.365 2.105 20 0 BEADRP CC(C)[C@H](C)[N@H+](C)C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000261530859 135159202 /nfs/dbraw/zinc/15/92/02/135159202.db2.gz DIDRAFOUPUORSR-FRRDWIJNSA-N 2 0 212.381 2.351 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000261531567 135160642 /nfs/dbraw/zinc/16/06/42/135160642.db2.gz HAZUMUGSLKMAEA-RYUDHWBXSA-N 2 0 210.365 2.154 20 0 BEADRP CCC[N@H+](C[C@@H]1CC[NH2+][C@H](C)C1)C1CC1 ZINC000261531468 135161133 /nfs/dbraw/zinc/16/11/33/135161133.db2.gz GPNZLNQFZJBTSS-VXGBXAGGSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CCC[NH2+]C1)c1ccsc1 ZINC000087647147 135161432 /nfs/dbraw/zinc/16/14/32/135161432.db2.gz NXOQPCAYDCRWMB-MNOVXSKESA-N 2 0 224.373 2.398 20 0 BEADRP C[NH2+]C[C@@H]1CCC[N@H+](CC2(C)CCC2)C1 ZINC000261531957 135161468 /nfs/dbraw/zinc/16/14/68/135161468.db2.gz IMSJZIIUFRFYEE-LBPRGKRZSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@H](C[NH2+]CC(C)(C)[NH3+])c1ccccc1 ZINC000261532041 135161828 /nfs/dbraw/zinc/16/18/28/135161828.db2.gz IVYQHQBGKDMDHU-LLVKDONJSA-N 2 0 206.333 2.117 20 0 BEADRP C[C@@H](C[NH2+]CC(C)(C)[NH3+])c1ccccc1 ZINC000261532042 135161919 /nfs/dbraw/zinc/16/19/19/135161919.db2.gz IVYQHQBGKDMDHU-NSHDSACASA-N 2 0 206.333 2.117 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]C[C@@H]1CCCS1 ZINC000087667828 135162688 /nfs/dbraw/zinc/16/26/88/135162688.db2.gz GQOHRAQPBBWBEP-FVCCEPFGSA-N 2 0 242.432 2.200 20 0 BEADRP C[C@@H]1CC[C@H](C)[N@H+](C[C@@H]2CC[NH2+][C@H](C)C2)C1 ZINC000261532753 135163033 /nfs/dbraw/zinc/16/30/33/135163033.db2.gz DWKNIUVZVJBHKL-YIYPIFLZSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H](CN1C[C@H]([NH3+])[C@@H](C)C1)c1ccccc1 ZINC000261533332 135165239 /nfs/dbraw/zinc/16/52/39/135165239.db2.gz GPMHLKIBQHNTNL-DYEKYZERSA-N 2 0 218.344 2.069 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2CCC[C@H](C)[C@H]2C)CC[NH2+]1 ZINC000261533910 135165720 /nfs/dbraw/zinc/16/57/20/135165720.db2.gz LDGOYXDXDFYFRM-REWJHTLYSA-N 2 0 224.392 2.495 20 0 BEADRP CC(C)[C@@H]1CCC[N@@H+]1C[C@H]1CC[NH2+][C@H](C)C1 ZINC000261533672 135166022 /nfs/dbraw/zinc/16/60/22/135166022.db2.gz JSPHLAMKDGFSQD-RDBSUJKOSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2CCS[C@@H](C)[C@H]2C)CC[NH2+]1 ZINC000261534772 135167633 /nfs/dbraw/zinc/16/76/33/135167633.db2.gz UCIVMCQTDWUCME-FVCCEPFGSA-N 2 0 242.432 2.200 20 0 BEADRP C[C@@H]1[C@@H]([NH3+])CC[N@@H+]1CC1CCCCCC1 ZINC000261534857 135168803 /nfs/dbraw/zinc/16/88/03/135168803.db2.gz NFHFCLSXMCWUMF-YPMHNXCESA-N 2 0 210.365 2.378 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[NH2+]C[C@H]1C)c1cccs1 ZINC000261535069 135169102 /nfs/dbraw/zinc/16/91/02/135169102.db2.gz NRIIARWNIVDMOJ-OUAUKWLOSA-N 2 0 224.373 2.397 20 0 BEADRP CC(C)[C@@H]1CC[N@H+](C[C@@H]2CC[NH2+][C@H](C)C2)C1 ZINC000261535242 135169466 /nfs/dbraw/zinc/16/94/66/135169466.db2.gz XECAGSGUGWSYDN-MGPQQGTHSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@H]([NH2+]C1CCCCCC1)[C@H]1CC[NH2+]C1 ZINC000261536671 135171928 /nfs/dbraw/zinc/17/19/28/135171928.db2.gz SKYWOOLCFUAMMB-RYUDHWBXSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+][C@H]2CCC[C@@H]2C[NH3+])C1 ZINC000261536503 135171929 /nfs/dbraw/zinc/17/19/29/135171929.db2.gz RZEGZUTXLGLUGV-XQHKEYJVSA-N 2 0 210.365 2.140 20 0 BEADRP CC(C)([NH3+])C[NH2+][C@H]1CCc2ccccc21 ZINC000261537389 135173942 /nfs/dbraw/zinc/17/39/42/135173942.db2.gz VLXXLKNKDUNNIX-LBPRGKRZSA-N 2 0 204.317 2.001 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+]CC1CCCCC1 ZINC000261538482 135176049 /nfs/dbraw/zinc/17/60/49/135176049.db2.gz YGBVPRXODRERLQ-YPMHNXCESA-N 2 0 210.365 2.154 20 0 BEADRP CC[C@H]1C[C@@H](C)C[N@@H+]1CC1CC[NH2+]CC1 ZINC000261539021 135177068 /nfs/dbraw/zinc/17/70/68/135177068.db2.gz BJONZPNEMNGSHX-YPMHNXCESA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H](C[NH3+])N(C)CCSc1ccccc1 ZINC000261539702 135178434 /nfs/dbraw/zinc/17/84/34/135178434.db2.gz DAAAAHLQGLKJTG-NSHDSACASA-N 2 0 224.373 2.058 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[NH2+]C[C@@H]1C)c1ccccc1 ZINC000261540471 135179429 /nfs/dbraw/zinc/17/94/29/135179429.db2.gz AGBXKHCZLDHUEK-VNHYZAJKSA-N 2 0 232.371 2.378 20 0 BEADRP Cc1ccc(F)c(C[N@H+]2CC[C@H]([C@H](C)[NH3+])C2)c1 ZINC000261541954 135182030 /nfs/dbraw/zinc/18/20/30/135182030.db2.gz MYNLWWMGHNEGSJ-RYUDHWBXSA-N 2 0 236.334 2.303 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]1[NH2+]CCc1ccccc1 ZINC000261543981 135184621 /nfs/dbraw/zinc/18/46/21/135184621.db2.gz DJNKWOSTHVOHDB-AWEZNQCLSA-N 2 0 232.371 2.207 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[NH2+]C[C@H]1C)c1cccc(F)c1 ZINC000261550639 135189122 /nfs/dbraw/zinc/18/91/22/135189122.db2.gz LIKUGSIBXPTPGL-UHIISALHSA-N 2 0 236.334 2.474 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[NH2+]C[C@H]1C)c1cccc(F)c1 ZINC000261550638 135189543 /nfs/dbraw/zinc/18/95/43/135189543.db2.gz LIKUGSIBXPTPGL-SUNKGSAMSA-N 2 0 236.334 2.474 20 0 BEADRP C[C@@H]1CCC[C@H](C[N@@H+]2CC[C@@H]3C[NH2+]C[C@@H]3C2)C1 ZINC000261552268 135190929 /nfs/dbraw/zinc/19/09/29/135190929.db2.gz MUTRJUVAGIAKIB-LXTVHRRPSA-N 2 0 236.403 2.354 20 0 BEADRP CCC(C)(C)CC[N@@H+]1CCC[C@@H]1C[NH2+]C ZINC000261552914 135192146 /nfs/dbraw/zinc/19/21/46/135192146.db2.gz SBKRNRRZJPYGCU-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H]1CC[C@@H](C)[NH+]1CCC1CC[NH2+]CC1 ZINC000261554131 135193473 /nfs/dbraw/zinc/19/34/73/135193473.db2.gz TXQNZAIQLMWEPL-VXGBXAGGSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@H]1CC[C@H](C)[NH+]1CCC1CC[NH2+]CC1 ZINC000261554129 135194048 /nfs/dbraw/zinc/19/40/48/135194048.db2.gz TXQNZAIQLMWEPL-RYUDHWBXSA-N 2 0 210.365 2.249 20 0 BEADRP CC[N@@H+](Cc1ccccn1)C[C@H]1CC[NH2+][C@H](C)C1 ZINC000261555994 135196436 /nfs/dbraw/zinc/19/64/36/135196436.db2.gz BTXUGWRIYUOHEO-KGLIPLIRSA-N 2 0 247.386 2.292 20 0 BEADRP CCOc1cccc(C[N@@H+]2CC[C@@](C)(C[NH3+])C2)c1 ZINC000261556930 135197049 /nfs/dbraw/zinc/19/70/49/135197049.db2.gz CGKXMIJCPYXGPC-HNNXBMFYSA-N 2 0 248.370 2.256 20 0 BEADRP C[C@@H]1COCC[C@@H]1[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000261558246 135198883 /nfs/dbraw/zinc/19/88/83/135198883.db2.gz DBXMRYFZEVHEII-SDJAHQOYSA-N 2 0 246.354 2.146 20 0 BEADRP C[C@@H]1CCC[C@H](C[N@@H+]2CC[C@]3(CC[NH2+]C3)C2)C1 ZINC000261560149 135201525 /nfs/dbraw/zinc/20/15/25/135201525.db2.gz UFZXTCGQTKOVBL-ILXRZTDVSA-N 2 0 236.403 2.498 20 0 BEADRP Cc1cccc(C[N@@H+]2CC[C@@H]3C[NH2+]C[C@H]3C2)c1 ZINC000261561382 135203019 /nfs/dbraw/zinc/20/30/19/135203019.db2.gz VHFYVHGZICLGLM-CABCVRRESA-N 2 0 230.355 2.036 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@H]3C[NH2+]C[C@@H]3C2)cc1 ZINC000261562011 135203840 /nfs/dbraw/zinc/20/38/40/135203840.db2.gz VXJZSGZBIAIVKM-LSDHHAIUSA-N 2 0 230.355 2.036 20 0 BEADRP Cc1cc(N2CC[C@H]([NH3+])[C@H]2C)c2ccccc2[nH+]1 ZINC000261562606 135204143 /nfs/dbraw/zinc/20/41/43/135204143.db2.gz GNFVTDZSDCNIIE-YPMHNXCESA-N 2 0 241.338 2.469 20 0 BEADRP Cc1nc(C)c(C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)s1 ZINC000261562663 135204367 /nfs/dbraw/zinc/20/43/67/135204367.db2.gz BMIOJCCBDGOZQC-MNOVXSKESA-N 2 0 239.388 2.119 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[NH2+][C@@H]1CC[NH2+]C[C@@H]1C ZINC000261562836 135204574 /nfs/dbraw/zinc/20/45/74/135204574.db2.gz BQJMWPCPNFEZPE-XJFOESAGSA-N 2 0 224.392 2.400 20 0 BEADRP Cc1cc(N2CC[C@H]([NH3+])[C@@H]2C)c2ccccc2[nH+]1 ZINC000261562594 135204695 /nfs/dbraw/zinc/20/46/95/135204695.db2.gz GNFVTDZSDCNIIE-AAEUAGOBSA-N 2 0 241.338 2.469 20 0 BEADRP C[C@@H]1C[C@H](c2ccccc2F)N(CC[NH3+])C1 ZINC000261563803 135205217 /nfs/dbraw/zinc/20/52/17/135205217.db2.gz BZXIJBHHBIFYKN-ZWNOBZJWSA-N 2 0 222.307 2.167 20 0 BEADRP COc1cccc([C@@H](C)[N@@H+]2CC[C@](C)(C[NH3+])C2)c1 ZINC000261563963 135206185 /nfs/dbraw/zinc/20/61/85/135206185.db2.gz HDIKRDYLWVKQSC-IUODEOHRSA-N 2 0 248.370 2.427 20 0 BEADRP CCC[N@H+](Cc1cccnc1C)C1CC[NH2+]CC1 ZINC000261564730 135206884 /nfs/dbraw/zinc/20/68/84/135206884.db2.gz HLDKPNUUAOHGFX-UHFFFAOYSA-N 2 0 247.386 2.354 20 0 BEADRP Cc1cccc(C[N@@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@@H]3C2)c1C ZINC000261565663 135207638 /nfs/dbraw/zinc/20/76/38/135207638.db2.gz HXAQDRVUJNSRLH-ARFHVFGLSA-N 2 0 244.382 2.473 20 0 BEADRP C[C@@H](C[C@H]1CCCCC[NH2+]1)[NH2+]CCC(C)(C)O ZINC000261565389 135207843 /nfs/dbraw/zinc/20/78/43/135207843.db2.gz YHTZCBYCWZMHEN-QWHCGFSZSA-N 2 0 242.407 2.048 20 0 BEADRP Cc1ccccc1C[N@@H+]1C[C@@H]2CC[C@@H]([NH3+])[C@@H]2C1 ZINC000261566583 135208351 /nfs/dbraw/zinc/20/83/51/135208351.db2.gz ZDDYZVFSBJPZBM-RRFJBIMHSA-N 2 0 230.355 2.164 20 0 BEADRP Cc1ccccc1C[N@@H+]1C[C@@H]2CC[C@H]([NH3+])[C@H]2C1 ZINC000261566582 135208873 /nfs/dbraw/zinc/20/88/73/135208873.db2.gz ZDDYZVFSBJPZBM-KKUMJFAQSA-N 2 0 230.355 2.164 20 0 BEADRP C[C@@H]1CCC[C@H](C[NH+]2CCC([NH3+])CC2)C1 ZINC000084344408 135210352 /nfs/dbraw/zinc/21/03/52/135210352.db2.gz XZOHCXNNXJSUOL-NEPJUHHUSA-N 2 0 210.365 2.236 20 0 BEADRP Cc1ccc(C[N@@H+]2C[C@@H]3CC[C@H]([NH3+])[C@@H]3C2)cc1C ZINC000261569199 135211224 /nfs/dbraw/zinc/21/12/24/135211224.db2.gz JPTRGPMHCOVEIA-XHSDSOJGSA-N 2 0 244.382 2.473 20 0 BEADRP C(C[N@@H+]1CC[C@]2(CC[NH2+]C2)C1)C1CCCC1 ZINC000261569370 135211467 /nfs/dbraw/zinc/21/14/67/135211467.db2.gz GFOFSMRPBNKKLV-AWEZNQCLSA-N 2 0 222.376 2.252 20 0 BEADRP Cc1ccccc1C[NH2+][C@@](C)(C[NH3+])C(C)C ZINC000261571046 135212805 /nfs/dbraw/zinc/21/28/05/135212805.db2.gz HIRCRNYTAPIZMN-AWEZNQCLSA-N 2 0 220.360 2.458 20 0 BEADRP C[C@@H]1[C@H](C)SCC[N@@H+]1CC[C@@H]1CCC[NH2+]C1 ZINC000164176394 135214306 /nfs/dbraw/zinc/21/43/06/135214306.db2.gz WKCYGPCGWMNDGQ-AGIUHOORSA-N 2 0 242.432 2.202 20 0 BEADRP CCOc1cccc(C[NH2+][C@H]2CC[NH2+]C[C@@H]2C)c1 ZINC000261572569 135214487 /nfs/dbraw/zinc/21/44/87/135214487.db2.gz LSPMPVJPXHKCLD-WFASDCNBSA-N 2 0 248.370 2.173 20 0 BEADRP C[NH2+]CCC1CC[NH+](CC2(C)CCC2)CC1 ZINC000261573807 135216139 /nfs/dbraw/zinc/21/61/39/135216139.db2.gz IZJAMCCQLVDWMU-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP [NH3+][C@@H]1CC[C@H]2C[N@H+](CC3CCCCC3)C[C@H]12 ZINC000261574652 135216542 /nfs/dbraw/zinc/21/65/42/135216542.db2.gz JKCGDQCQVPLBHE-MELADBBJSA-N 2 0 222.376 2.236 20 0 BEADRP Cc1cccc(CN2CC[C@@H]([NH3+])[C@@H]2C)c1C ZINC000261576594 135217232 /nfs/dbraw/zinc/21/72/32/135217232.db2.gz KKGGXUAVNQYDLW-GXTWGEPZSA-N 2 0 218.344 2.225 20 0 BEADRP C(C[NH+]1CCCCCCC1)[C@@H]1CC[NH2+]C1 ZINC000084384612 135218239 /nfs/dbraw/zinc/21/82/39/135218239.db2.gz GNCRTPYALRVRCY-ZDUSSCGKSA-N 2 0 210.365 2.252 20 0 BEADRP C[N@H+](CC[C@H]1CC[NH2+]C1)CC1CCCC1 ZINC000084385920 135218426 /nfs/dbraw/zinc/21/84/26/135218426.db2.gz MTLUKQHIZMXGGE-GFCCVEGCSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@H]([NH3+])[C@H](C)[NH2+][C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000261578273 135218927 /nfs/dbraw/zinc/21/89/27/135218927.db2.gz LQQKZMLEMUQVKO-XKNYDFJKSA-N 2 0 238.297 2.433 20 0 BEADRP C[C@H]([NH3+])[C@H](C)[NH2+][C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000261578270 135219205 /nfs/dbraw/zinc/21/92/05/135219205.db2.gz LQQKZMLEMUQVKO-AATLWQCWSA-N 2 0 238.297 2.433 20 0 BEADRP Cc1cccc(C[N@@H+]2CC[C@]3(CC[NH2+]C3)C2)c1C ZINC000261578956 135219767 /nfs/dbraw/zinc/21/97/67/135219767.db2.gz PFJODEJQBYDGGN-INIZCTEOSA-N 2 0 244.382 2.489 20 0 BEADRP C[C@@H](C[N@@H+]1CC[C@]2(CC[NH2+]C2)C1)c1ccccc1 ZINC000261581614 135222074 /nfs/dbraw/zinc/22/20/74/135222074.db2.gz QUQXQJTYSSOGPQ-HOCLYGCPSA-N 2 0 244.382 2.476 20 0 BEADRP CCc1ccc(C[N@@H+]2CC[C@H]3[NH2+]CC[C@H]3C2)cc1 ZINC000261585236 135225794 /nfs/dbraw/zinc/22/57/94/135225794.db2.gz SWJQHFZZMYXRIT-JKSUJKDBSA-N 2 0 244.382 2.433 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+][C@H]1CC[C@@H](C)[C@@H](C)C1 ZINC000261586989 135228529 /nfs/dbraw/zinc/22/85/29/135228529.db2.gz RLOLMQJTJSSXLZ-XHJNMGKDSA-N 2 0 224.392 2.399 20 0 BEADRP Cc1cc(C[N@@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@@H]3C2)ccc1F ZINC000261592129 135232932 /nfs/dbraw/zinc/23/29/32/135232932.db2.gz YIEBXURHNIYXSA-GZBFAFLISA-N 2 0 248.345 2.303 20 0 BEADRP C[C@@H]1CC[N@H+](CCC2CCCC2)C[C@@H]1C[NH3+] ZINC000261599726 135237627 /nfs/dbraw/zinc/23/76/27/135237627.db2.gz ZZCHRKGNHGFAAW-OCCSQVGLSA-N 2 0 224.392 2.483 20 0 BEADRP CCC(C)(C)CC[N@@H+]1C[C@@H](C[NH3+])C[C@H]1C ZINC000261546687 135239453 /nfs/dbraw/zinc/23/94/53/135239453.db2.gz LFOTVAFIHORERU-VXGBXAGGSA-N 2 0 212.381 2.482 20 0 BEADRP C[C@@H]1CCC[C@H](C[N@@H+]2C[C@@H]3CC[C@H]([NH3+])[C@@H]3C2)C1 ZINC000261547434 135239942 /nfs/dbraw/zinc/23/99/42/135239942.db2.gz IAFVTQCAASSGGK-FQKPHLNHSA-N 2 0 236.403 2.482 20 0 BEADRP CC[N@H+](CCC1CC1)C[C@@]1(C)CC[NH2+]C1 ZINC000261547959 135240830 /nfs/dbraw/zinc/24/08/30/135240830.db2.gz MWZXEZFLNHGMEZ-ZDUSSCGKSA-N 2 0 210.365 2.108 20 0 BEADRP CCOCC(C)(C)C[NH2+][C@@H]1CCCC[C@H]1C[NH3+] ZINC000261548070 135242001 /nfs/dbraw/zinc/24/20/01/135242001.db2.gz JBCCGAUFHWRMHZ-QWHCGFSZSA-N 2 0 242.407 2.156 20 0 BEADRP Cc1ccc(CC[N@@H+]2CC[C@](C)(C[NH3+])C2)cc1 ZINC000261754119 135250197 /nfs/dbraw/zinc/25/01/97/135250197.db2.gz LKAJZHDAFGZPQC-OAHLLOKOSA-N 2 0 232.371 2.208 20 0 BEADRP CS[C@H]1CCCC[N@H+](C[C@]2(C)CC[NH2+]C2)C1 ZINC000261759666 135250297 /nfs/dbraw/zinc/25/02/97/135250297.db2.gz LDLMSKSTNMGGJA-QWHCGFSZSA-N 2 0 242.432 2.204 20 0 BEADRP CS[C@@H]1CCCC[N@H+](C[C@@]2(C)CC[NH2+]C2)C1 ZINC000261759663 135250435 /nfs/dbraw/zinc/25/04/35/135250435.db2.gz LDLMSKSTNMGGJA-OLZOCXBDSA-N 2 0 242.432 2.204 20 0 BEADRP CCC[N@H+](Cc1cnccc1C)C1CC[NH2+]CC1 ZINC000261787885 135252575 /nfs/dbraw/zinc/25/25/75/135252575.db2.gz FZUAIRPSIBQZEO-UHFFFAOYSA-N 2 0 247.386 2.354 20 0 BEADRP C[C@H]1CC[N@H+](C[C@@H]2CCC[NH2+]C2)CC1(C)C ZINC000261813355 135255097 /nfs/dbraw/zinc/25/50/97/135255097.db2.gz HVAWEDALHFXRML-QWHCGFSZSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@H]1CC[N@H+](C[C@]2(C)CC[NH2+]C2)CC12CCC2 ZINC000261917405 135262576 /nfs/dbraw/zinc/26/25/76/135262576.db2.gz ZUHBSANXONROJQ-UONOGXRCSA-N 2 0 236.403 2.498 20 0 BEADRP CCc1cccc(F)c1CN1C[C@H]([NH3+])[C@@H](C)C1 ZINC000261964057 135267210 /nfs/dbraw/zinc/26/72/10/135267210.db2.gz HOEVBLRMYFBDPR-HZMBPMFUSA-N 2 0 236.334 2.167 20 0 BEADRP C[C@H]1CC[N@H+](C[C@H]2CCC[NH2+]C2)CC12CCC2 ZINC000262012348 135272321 /nfs/dbraw/zinc/27/23/21/135272321.db2.gz VEJYUCKSNDTXOY-KBPBESRZSA-N 2 0 236.403 2.498 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@H]2CCC[NH2+]C2)CC12CCC2 ZINC000262012349 135272482 /nfs/dbraw/zinc/27/24/82/135272482.db2.gz VEJYUCKSNDTXOY-KGLIPLIRSA-N 2 0 236.403 2.498 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2CC[C@@H]3CCC[C@@H]32)CC[NH2+]1 ZINC000262013531 135273337 /nfs/dbraw/zinc/27/33/37/135273337.db2.gz UZPGLQJZOLKUSJ-MQYQWHSLSA-N 2 0 222.376 2.249 20 0 BEADRP C[N@H+](C[C@@]1(C)CC[NH2+]C1)[C@@H]1CCC(C)(C)C1 ZINC000262075162 135277940 /nfs/dbraw/zinc/27/79/40/135277940.db2.gz SKYXHOWRNMGDKB-OCCSQVGLSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)C[C@@H]1CC[N@H+](C[C@]2(C)CC[NH2+]C2)C1 ZINC000262149964 135282152 /nfs/dbraw/zinc/28/21/52/135282152.db2.gz ZVCRQDHQDAAVBI-UONOGXRCSA-N 2 0 224.392 2.354 20 0 BEADRP Cc1nccn1CC[N@H+]1CCC[C@H](C)CC1 ZINC000334168204 135324396 /nfs/dbraw/zinc/32/43/96/135324396.db2.gz ALCFZQNYJBNXBH-LBPRGKRZSA-N 2 0 221.348 2.314 20 0 BEADRP C[C@H]1SCCN(CC[NH3+])[C@H]1c1ccccc1 ZINC000262952178 135324717 /nfs/dbraw/zinc/32/47/17/135324717.db2.gz JTWNYDGYAHEMCB-DGCLKSJQSA-N 2 0 236.384 2.124 20 0 BEADRP C[C@@H]1SCCN(CC[NH3+])[C@@H]1c1ccccc1 ZINC000262952177 135325032 /nfs/dbraw/zinc/32/50/32/135325032.db2.gz JTWNYDGYAHEMCB-AAEUAGOBSA-N 2 0 236.384 2.124 20 0 BEADRP C(C1CCCCC1)[N@@H+]1C[C@H]2CCC[NH2+][C@H]2C1 ZINC000299892914 135380602 /nfs/dbraw/zinc/38/06/02/135380602.db2.gz FSANDADYTGBVNK-KGLIPLIRSA-N 2 0 222.376 2.251 20 0 BEADRP Cc1nc(C)c(C[NH2+]CCCC[NH+](C)C)s1 ZINC000080694231 135384284 /nfs/dbraw/zinc/38/42/84/135384284.db2.gz IBFQMGHHDJTJJT-UHFFFAOYSA-N 2 0 241.404 2.191 20 0 BEADRP [NH3+]CCCC[NH2+][C@H]1CCC[C@H](C2CC2)C1 ZINC000081635529 135428671 /nfs/dbraw/zinc/42/86/71/135428671.db2.gz MECRISAHVXUBEQ-STQMWFEESA-N 2 0 210.365 2.284 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C2CC[NH2+]CC2)C[C@@H]1C ZINC000082845888 135441273 /nfs/dbraw/zinc/44/12/73/135441273.db2.gz YLIOJJZTNSRMGA-NTZNESFSSA-N 2 0 210.365 2.153 20 0 BEADRP CC1(C)CCC[N@H+](CC[C@@H]2CC[NH2+]C2)CC1 ZINC000084386220 135470481 /nfs/dbraw/zinc/47/04/81/135470481.db2.gz XDHGCTPBSKFALH-ZDUSSCGKSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H]([NH2+]CC1CC[NH2+]CC1)C1CCCC1 ZINC000086701241 135494691 /nfs/dbraw/zinc/49/46/91/135494691.db2.gz WDSMQWOHRHIYNQ-LLVKDONJSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H]1CC[C@H](C[NH2+]C2CCC([NH3+])CC2)C1 ZINC000230412530 135535445 /nfs/dbraw/zinc/53/54/45/135535445.db2.gz MWLCJROPNXIADJ-ZSVAQUKISA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+]C1CC[NH+](C[C@@H]2C[C@H]2c2ccccc2)CC1 ZINC000334587370 135759394 /nfs/dbraw/zinc/75/93/94/135759394.db2.gz WTAYFLBGPOKORW-ZFWWWQNUSA-N 2 0 230.355 2.213 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCCc2sccc21)C1C[NH2+]C1 ZINC000335062194 135886470 /nfs/dbraw/zinc/88/64/70/135886470.db2.gz YUVAADFOVVIXOG-JOYOIKCWSA-N 2 0 236.384 2.323 20 0 BEADRP C[C@@H]1CN(C2CC2)C[C@@H]1[NH2+][C@H]1CC[C@@H]1C1CC1 ZINC000348086567 136034733 /nfs/dbraw/zinc/03/47/33/136034733.db2.gz PWJOFWVDNJNBMT-RABLLNBGSA-N 2 0 234.387 2.247 20 0 BEADRP C[C@@H]1CN(C2CC2)C[C@@H]1[NH2+][C@@H]1CC[C@H]1C1CC1 ZINC000348086564 136034864 /nfs/dbraw/zinc/03/48/64/136034864.db2.gz PWJOFWVDNJNBMT-KAOXEZKKSA-N 2 0 234.387 2.247 20 0 BEADRP Cc1cc(N)cc(C[NH2+][C@H]2CC[N@@H+](C)C[C@@H]2C)c1 ZINC000335356518 136062043 /nfs/dbraw/zinc/06/20/43/136062043.db2.gz DKUGESOVWICPHD-WFASDCNBSA-N 2 0 247.386 2.007 20 0 BEADRP CSC1(C[N@H+](C)CCC[NH+]2CCCC2)CC1 ZINC000348333921 136075351 /nfs/dbraw/zinc/07/53/51/136075351.db2.gz CUECQXSKJYNSFL-UHFFFAOYSA-N 2 0 242.432 2.300 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CC[C@H](F)C2)[C@H]2CCC[C@H]21 ZINC000348391214 136076180 /nfs/dbraw/zinc/07/61/80/136076180.db2.gz HUPQOSUVPLTAOD-MQLXINIDSA-N 2 0 240.366 2.339 20 0 BEADRP Cc1cnc([C@@H](C)[NH+]2CCC([C@H](C)[NH3+])CC2)o1 ZINC000335387066 136089343 /nfs/dbraw/zinc/08/93/43/136089343.db2.gz QEUGEGDAEJYZFU-WDEREUQCSA-N 2 0 237.347 2.103 20 0 BEADRP Cc1cnc([C@H](C)[NH+]2CCC([C@@H](C)[NH3+])CC2)o1 ZINC000335387064 136089488 /nfs/dbraw/zinc/08/94/88/136089488.db2.gz QEUGEGDAEJYZFU-MNOVXSKESA-N 2 0 237.347 2.103 20 0 BEADRP Cc1cc(N)cc(C[NH2+][C@H]2CC[NH2+]CC[C@H]2C)c1 ZINC000335363899 136095146 /nfs/dbraw/zinc/09/51/46/136095146.db2.gz UAJUFNFNOKJHHD-DOMZBBRYSA-N 2 0 247.386 2.055 20 0 BEADRP c1cc(N2CCC([NH2+][C@@H]3CC34CC4)CC2)cc[nH+]1 ZINC000335548316 136097234 /nfs/dbraw/zinc/09/72/34/136097234.db2.gz ABZISZSJTOYESG-CQSZACIVSA-N 2 0 243.354 2.193 20 0 BEADRP Clc1ccc2c(c1)CC[C@@H]2[NH2+]CC1C[NH2+]C1 ZINC000335552530 136098324 /nfs/dbraw/zinc/09/83/24/136098324.db2.gz OHCRABMMYXCAAR-ZDUSSCGKSA-N 2 0 236.746 2.136 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+]C1CC(c2ccccc2)C1 ZINC000335562406 136106783 /nfs/dbraw/zinc/10/67/83/136106783.db2.gz VZMNMPHSWGCCRV-PFSRBDOWSA-N 2 0 230.355 2.402 20 0 BEADRP Cc1ccc2[nH]c3c(c2c1)CCC[C@H]3NCC[NH3+] ZINC000335563647 136107077 /nfs/dbraw/zinc/10/70/77/136107077.db2.gz GSRLYANSNMMYEA-CQSZACIVSA-N 2 0 243.354 2.402 20 0 BEADRP C[C@H]1CC(C)(C)C[C@@H]1[NH2+]C1CC[NH2+]CC1 ZINC000335568956 136108683 /nfs/dbraw/zinc/10/86/83/136108683.db2.gz PCZKTZUIPVQUGA-JQWIXIFHSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000388106836 397871463 /nfs/dbraw/zinc/87/14/63/397871463.db2.gz XVXHKKGSJKJTOS-XJFOESAGSA-N 2 0 222.376 2.249 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H](Nc2cc[nH+]c3ccccc23)C1 ZINC000382460033 397951286 /nfs/dbraw/zinc/95/12/86/397951286.db2.gz URADUHFKVCDZGB-VXGBXAGGSA-N 2 0 241.338 2.339 20 0 BEADRP CC(C)CCOCC[NH2+][C@@H]1CC[NH2+]CC1(C)C ZINC000302317853 397911150 /nfs/dbraw/zinc/91/11/50/397911150.db2.gz LDBHSTPCGGCNGL-CYBMUJFWSA-N 2 0 242.407 2.027 20 0 BEADRP CC[C@](C)(C[N@H+](C)C[C@@H]1CCC[NH+](C)C1)OC ZINC000637929437 398044338 /nfs/dbraw/zinc/04/43/38/398044338.db2.gz ADWHLXJXDRJUGB-ZIAGYGMSSA-N 2 0 242.407 2.075 20 0 BEADRP C[C@@H]1C[C@H](C[N@H+](C)C(C2CC2)C2CC2)CC[NH2+]1 ZINC000414689753 398019891 /nfs/dbraw/zinc/01/98/91/398019891.db2.gz GVFHWZLLHGMGDN-VXGBXAGGSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CC1(CO)CCCCC1 ZINC000383620586 398031110 /nfs/dbraw/zinc/03/11/10/398031110.db2.gz VBWHVTSZABVCRE-ZDUSSCGKSA-N 2 0 242.407 2.036 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+]C[C@H]1CCC[C@@H](C)C1 ZINC000414792075 398038776 /nfs/dbraw/zinc/03/87/76/398038776.db2.gz IMQJEGDAABTTSW-AGIUHOORSA-N 2 0 212.381 2.386 20 0 BEADRP C[C@@H](C[N@H+](C)C[C@H]1CC[NH2+]C1)c1ccccc1 ZINC000382752859 397971710 /nfs/dbraw/zinc/97/17/10/397971710.db2.gz JDZDRUHLAKLCCE-KBPBESRZSA-N 2 0 232.371 2.331 20 0 BEADRP C[C@@H](C[N@H+](C)C[C@@H]1CC[NH2+]C1)c1ccccc1 ZINC000382752864 397972511 /nfs/dbraw/zinc/97/25/11/397972511.db2.gz JDZDRUHLAKLCCE-UONOGXRCSA-N 2 0 232.371 2.331 20 0 BEADRP C[C@H](CC1CC1)[NH2+][C@@H](C)[C@H]1CCC[NH2+]C1 ZINC000414817721 398042340 /nfs/dbraw/zinc/04/23/40/398042340.db2.gz BOJPSUKBSUYLNT-MDZLAQPJSA-N 2 0 210.365 2.153 20 0 BEADRP Cc1ccoc1CN1CC[C@H]2CC[N@@H+](C)C[C@H]21 ZINC000272625687 397980534 /nfs/dbraw/zinc/98/05/34/397980534.db2.gz MNNJFUBWGPABCX-CHWSQXEVSA-N 2 0 234.343 2.114 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[C@@H](C)C1)[C@@H]1CCC[NH2+]C1 ZINC000414853993 398062165 /nfs/dbraw/zinc/06/21/65/398062165.db2.gz LSHPHKKEOGPEBM-LPWJVIDDSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)[C@H](C)C[NH2+][C@@H]1CC[N@H+](C)C[C@@H]1C ZINC000223996330 398101754 /nfs/dbraw/zinc/10/17/54/398101754.db2.gz ZJMYMCNKXRGTBL-FRRDWIJNSA-N 2 0 212.381 2.208 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1CCCC1(F)F ZINC000390837728 398107606 /nfs/dbraw/zinc/10/76/06/398107606.db2.gz AOHDNFSZMCTOAU-GARJFASQSA-N 2 0 232.318 2.139 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H]1CCc2ccccc2C1 ZINC000521607539 398097651 /nfs/dbraw/zinc/09/76/51/398097651.db2.gz WYUWZTHRPYANSP-OAHLLOKOSA-N 2 0 232.371 2.133 20 0 BEADRP C[C@H]([NH2+]CCCCF)C1CC[NH+](C)CC1 ZINC000389608100 398116103 /nfs/dbraw/zinc/11/61/03/398116103.db2.gz ZNNPCJJLPKVKST-NSHDSACASA-N 2 0 216.344 2.056 20 0 BEADRP COc1ccc(C)cc1C[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000414932452 398111849 /nfs/dbraw/zinc/11/18/49/398111849.db2.gz VTQYHCCQCTUQAW-KBPBESRZSA-N 2 0 248.370 2.363 20 0 BEADRP C1[C@@H]2C[C@@H]([NH2+][C@@H]3CCC[C@H]3[C@@H]3CCC[NH2+]3)C[C@H]12 ZINC000397732295 398122749 /nfs/dbraw/zinc/12/27/49/398122749.db2.gz DOMGTMBZGSJMEV-JLZCTACVSA-N 2 0 234.387 2.295 20 0 BEADRP C[C@]1(C[N@@H+]2CC[C@@H]3CCCC[C@@H]3C2)CC[NH2+]C1 ZINC000062911299 1172788804 /nfs/dbraw/zinc/78/88/04/1172788804.db2.gz KRKXMBZXTGFWRU-ZNMIVQPWSA-N 2 0 236.403 2.498 20 0 BEADRP [NH3+][C@H]1CCC[C@H](C[NH2+]Cc2ccsc2)C1 ZINC000063147380 1172802553 /nfs/dbraw/zinc/80/25/53/1172802553.db2.gz NEKWJVZABGSRKT-JQWIXIFHSA-N 2 0 224.373 2.355 20 0 BEADRP C[C@H]([NH2+]CC1CC[NH+](C)CC1)c1ccoc1 ZINC000087290072 322876109 /nfs/dbraw/zinc/87/61/09/322876109.db2.gz KUKMUHACWVBQFI-NSHDSACASA-N 2 0 222.332 2.272 20 0 BEADRP Cc1ccccc1C[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000258864245 322879228 /nfs/dbraw/zinc/87/92/28/322879228.db2.gz AFHRWBRGMRMCOU-CQSZACIVSA-N 2 0 232.371 2.474 20 0 BEADRP Fc1ccc(F)c(C[NH2+]CC[C@H]2CC[NH2+]C2)c1 ZINC000258967281 322880330 /nfs/dbraw/zinc/88/03/30/322880330.db2.gz JZZHYDNWWJNBDC-SNVBAGLBSA-N 2 0 240.297 2.054 20 0 BEADRP Cc1ccc(F)cc1C[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000334845225 487572654 /nfs/dbraw/zinc/57/26/54/487572654.db2.gz KCHXTHNRQCHSET-UONOGXRCSA-N 2 0 236.334 2.494 20 0 BEADRP CC(C)OCCC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000020524045 167221543 /nfs/dbraw/zinc/22/15/43/167221543.db2.gz HPIIGXYXKKDYJQ-AGUYFDCRSA-N 2 0 240.391 2.016 20 0 BEADRP CC(C)(CC[N@@H+]1CC[C@]2(CC[NH2+]C2)C1)C1CC1 ZINC000406018895 487585409 /nfs/dbraw/zinc/58/54/09/487585409.db2.gz CPVFNGYRKKFBDH-HNNXBMFYSA-N 2 0 236.403 2.498 20 0 BEADRP CC(C)OC[C@@H](C)[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000337253982 167254186 /nfs/dbraw/zinc/25/41/86/167254186.db2.gz MDAFEWIAQMRBFV-CYBMUJFWSA-N 2 0 242.407 2.121 20 0 BEADRP CC(C)OC[C@@H](C)[NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1 ZINC000337348555 167256497 /nfs/dbraw/zinc/25/64/97/167256497.db2.gz ZBPDHKAFFLOSDY-MCIONIFRSA-N 2 0 242.407 2.262 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCC[NH+]2CCCCC2)CS1 ZINC000086934484 487590877 /nfs/dbraw/zinc/59/08/77/487590877.db2.gz XAKSNOVJLZIJKD-CHWSQXEVSA-N 2 0 242.432 2.346 20 0 BEADRP C[C@@H]1C[C@H]1C[NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000668820996 487596455 /nfs/dbraw/zinc/59/64/55/487596455.db2.gz ZZCGQSMIIVMAOT-SNPRPXQTSA-N 2 0 236.403 2.354 20 0 BEADRP COCC[C@H](C)[N@H+](C)CC[C@@H]1CCCC[NH+]1C ZINC000531780033 487602171 /nfs/dbraw/zinc/60/21/71/487602171.db2.gz ZEBCUCWWHIPQQA-KBPBESRZSA-N 2 0 242.407 2.218 20 0 BEADRP CC[C@H](CC(F)F)C[N@@H+]1CC[C@]2(CC[NH2+]C2)C1 ZINC000662264459 409561972 /nfs/dbraw/zinc/56/19/72/409561972.db2.gz DHAXZANEWPIOHJ-YPMHNXCESA-N 2 0 246.345 2.353 20 0 BEADRP C[C@@H]([NH3+])C1CC[NH+](Cc2cc(C3CC3)no2)CC1 ZINC000662245557 409538734 /nfs/dbraw/zinc/53/87/34/409538734.db2.gz KNIYMOWVDCMCAG-SNVBAGLBSA-N 2 0 249.358 2.111 20 0 BEADRP CC(C)=CCC[N@@H+]1C[C@@H]2CCC[C@]2(C[NH3+])C1 ZINC000662286152 409618793 /nfs/dbraw/zinc/61/87/93/409618793.db2.gz OUNAJLCQCYREDN-KBPBESRZSA-N 2 0 222.376 2.404 20 0 BEADRP C[C@@H]1CCC[N@H+](Cc2ccon2)[C@@H]1CCC[NH3+] ZINC000662318462 409636993 /nfs/dbraw/zinc/63/69/93/409636993.db2.gz ZVDZIGMEAZHCMI-DGCLKSJQSA-N 2 0 237.347 2.014 20 0 BEADRP [NH3+]CC[C@H]1CCC[N@H+](C[C@@H]2C[C@H]3C[C@H]3C2)C1 ZINC000662270978 409574178 /nfs/dbraw/zinc/57/41/78/409574178.db2.gz CYBCLAYQEHRRMO-YIYPIFLZSA-N 2 0 222.376 2.093 20 0 BEADRP CC[C@@H](CC(F)F)C[N@@H+]1CC[C@@](C)(C[NH3+])C1 ZINC000662272874 409579128 /nfs/dbraw/zinc/57/91/28/409579128.db2.gz JNKHIPRRSUWAOL-JQWIXIFHSA-N 2 0 234.334 2.339 20 0 BEADRP C1=CCC(C[NH+]2CCC3(CC[NH2+]C3)CC2)C1 ZINC000662272636 409580709 /nfs/dbraw/zinc/58/07/09/409580709.db2.gz GMZNEKVFABCDLV-UHFFFAOYSA-N 2 0 220.360 2.028 20 0 BEADRP C(C[N@@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1)C1CCC1 ZINC000662275056 409584085 /nfs/dbraw/zinc/58/40/85/409584085.db2.gz QOTMYEVXRKBPDE-GJZGRUSLSA-N 2 0 236.403 2.498 20 0 BEADRP C(C[N@@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1)C1CCC1 ZINC000662275055 409584564 /nfs/dbraw/zinc/58/45/64/409584564.db2.gz QOTMYEVXRKBPDE-CABCVRRESA-N 2 0 236.403 2.498 20 0 BEADRP C([C@@H]1CC[C@@H]2C[C@@H]2C1)[N@@H+]1CCC[C@]2(CC[NH2+]C2)C1 ZINC000662277865 409593989 /nfs/dbraw/zinc/59/39/89/409593989.db2.gz SIYZZLOOXXMYCZ-LVQVYYBASA-N 2 0 248.414 2.498 20 0 BEADRP C(C[N@@H+]1CCC[C@]2(CC[NH2+]C2)C1)C1CCC1 ZINC000662278451 409596835 /nfs/dbraw/zinc/59/68/35/409596835.db2.gz XRUUNZCOWCLYMD-CQSZACIVSA-N 2 0 222.376 2.252 20 0 BEADRP CC(C)SCC[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@@H]1C ZINC000309408773 167332042 /nfs/dbraw/zinc/33/20/42/167332042.db2.gz VGUWPJDESYXNGT-RWMBFGLXSA-N 2 0 244.448 2.446 20 0 BEADRP C[C@H](C[NH2+]Cc1cccc2c1CCC2)C[NH+](C)C ZINC000651967361 409807323 /nfs/dbraw/zinc/80/73/23/409807323.db2.gz CARGOTKDJQGYCR-CYBMUJFWSA-N 2 0 246.398 2.463 20 0 BEADRP C[NH2+]Cc1ccccc1C[NH2+]CC(C)C ZINC000650719232 410355030 /nfs/dbraw/zinc/35/50/30/410355030.db2.gz IRPPPCNZNKNBND-UHFFFAOYSA-N 2 0 206.333 2.152 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](Cc2cccc3c2CCC3)C1 ZINC000650702789 410333498 /nfs/dbraw/zinc/33/34/98/410333498.db2.gz VAYHJRDYOSELLZ-ZDUSSCGKSA-N 2 0 244.382 2.217 20 0 BEADRP C[C@@H]1C[N@H+](Cc2cccc3c2CCC3)CC[C@H]1[NH3+] ZINC000650703247 410334837 /nfs/dbraw/zinc/33/48/37/410334837.db2.gz QYZUBTWLWWUKFV-MLGOLLRUSA-N 2 0 244.382 2.344 20 0 BEADRP CCOc1cccc(C[NH2+]CCC2(C[NH3+])CC2)c1 ZINC000650711905 410342100 /nfs/dbraw/zinc/34/21/00/410342100.db2.gz INMMLIPLYKKHGR-UHFFFAOYSA-N 2 0 248.370 2.304 20 0 BEADRP [NH3+]CC1(CC[NH2+]C/C=C/c2ccccc2)CC1 ZINC000650712500 410342771 /nfs/dbraw/zinc/34/27/71/410342771.db2.gz GOKATNWQEYGGFS-QPJJXVBHSA-N 2 0 230.355 2.418 20 0 BEADRP [NH3+]CC1(CC[NH2+]CC2CCCCC2)CC1 ZINC000650712657 410343238 /nfs/dbraw/zinc/34/32/38/410343238.db2.gz NLJYYHNECPBPKM-UHFFFAOYSA-N 2 0 210.365 2.285 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]CCC2(C[NH3+])CC2)C1 ZINC000650713318 410349789 /nfs/dbraw/zinc/34/97/89/410349789.db2.gz OGSWNRHXQHKCHH-VXGBXAGGSA-N 2 0 210.365 2.284 20 0 BEADRP C[NH2+]Cc1ccccc1C[NH2+]C[C@@H]1C[C@@H]1C ZINC000650720309 410358060 /nfs/dbraw/zinc/35/80/60/410358060.db2.gz LEPLBIUSAKMETE-FZMZJTMJSA-N 2 0 218.344 2.152 20 0 BEADRP CC(C)C[C@@H]([NH3+])CN1C[C@@H](C)OCC12CCC2 ZINC000650720709 410361264 /nfs/dbraw/zinc/36/12/64/410361264.db2.gz ZENQAOVXMRFHND-CHWSQXEVSA-N 2 0 240.391 2.003 20 0 BEADRP COc1ccc([C@H](C)[NH2+]CCC2(C[NH3+])CC2)cc1 ZINC000650742625 410377274 /nfs/dbraw/zinc/37/72/74/410377274.db2.gz AIWGEHZXJBLKNQ-LBPRGKRZSA-N 2 0 248.370 2.475 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+]CCC1(C[NH3+])CC1 ZINC000650745245 410380703 /nfs/dbraw/zinc/38/07/03/410380703.db2.gz CDDVBVUJROATFJ-LBPRGKRZSA-N 2 0 233.359 2.170 20 0 BEADRP CC[C@H]1CCC[C@@H]1[NH2+]CCC1(C[NH3+])CC1 ZINC000650745649 410382706 /nfs/dbraw/zinc/38/27/06/410382706.db2.gz LCTMRAMXGYTLBX-RYUDHWBXSA-N 2 0 210.365 2.284 20 0 BEADRP [NH3+]CC1(CC[NH2+]C2CCC3(CC3)CC2)CC1 ZINC000650746975 410384349 /nfs/dbraw/zinc/38/43/49/410384349.db2.gz ORRMFARMKGGGOG-UHFFFAOYSA-N 2 0 222.376 2.428 20 0 BEADRP C[C@]12C[C@H]1CCC[C@H]2[NH2+]CCC1(C[NH3+])CC1 ZINC000650746714 410384417 /nfs/dbraw/zinc/38/44/17/410384417.db2.gz JKQFKQBCVLSVRZ-UPJWGTAASA-N 2 0 222.376 2.284 20 0 BEADRP Cc1cncc([C@H](C)[NH2+]CCC2(C[NH3+])CC2)c1 ZINC000650747073 410385533 /nfs/dbraw/zinc/38/55/33/410385533.db2.gz QZJFKNPJNRICNS-LBPRGKRZSA-N 2 0 233.359 2.170 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]Cc2ccc(C[NH3+])cc2F)[C@@H]1C ZINC000650755592 410401430 /nfs/dbraw/zinc/40/14/30/410401430.db2.gz IJUDNPHNKKEECP-RULNRJAQSA-N 2 0 236.334 2.419 20 0 BEADRP C[C@H]([NH2+]CCC1CC[NH2+]CC1)[C@@H]1C[C@H]1C ZINC000650761910 410409730 /nfs/dbraw/zinc/40/97/30/410409730.db2.gz NJHHUOASYVZJSH-NTZNESFSSA-N 2 0 210.365 2.010 20 0 BEADRP COC[C@@H](CC(C)C)[NH2+]CCC1CC[NH2+]CC1 ZINC000650763834 410411251 /nfs/dbraw/zinc/41/12/51/410411251.db2.gz KINNHSAKCPROEY-CQSZACIVSA-N 2 0 242.407 2.027 20 0 BEADRP CC[C@H]([NH2+]CCC1CC[NH2+]CC1)[C@@H]1C[C@H]1C ZINC000650762245 410411386 /nfs/dbraw/zinc/41/13/86/410411386.db2.gz XXHPOIWHWXTMAE-BNOWGMLFSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H]([NH2+]CCC1CC[NH2+]CC1)c1cccc(O)c1 ZINC000650763203 410411465 /nfs/dbraw/zinc/41/14/65/410411465.db2.gz UPVZRLLURUPWTH-LBPRGKRZSA-N 2 0 248.370 2.433 20 0 BEADRP C[C@H]([NH2+]CCC1CC[NH2+]CC1)c1ccncc1 ZINC000650762762 410412266 /nfs/dbraw/zinc/41/22/66/410412266.db2.gz JHIYHPRDIHYNOS-LBPRGKRZSA-N 2 0 233.359 2.122 20 0 BEADRP C[C@H]([NH2+]CCC1CC[NH2+]CC1)c1ccco1 ZINC000650763854 410414302 /nfs/dbraw/zinc/41/43/02/410414302.db2.gz KSACJQGXJQBLLC-NSHDSACASA-N 2 0 222.332 2.320 20 0 BEADRP CS[C@H](C)C[NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000228900414 410451177 /nfs/dbraw/zinc/45/11/77/410451177.db2.gz HHIFPTUBNVWPMY-WQAKAFBOSA-N 2 0 236.384 2.472 20 0 BEADRP C[C@@H]1C[C@@H](C)[N@H+](Cc2cccc(O)c2)C[C@H]1C[NH3+] ZINC000397251759 410534724 /nfs/dbraw/zinc/53/47/24/410534724.db2.gz CWFMYBCJYQGPAS-YRGRVCCFSA-N 2 0 248.370 2.197 20 0 BEADRP CC(C)C1CC([NH2+]CC2([NH3+])CCCC2)C1 ZINC000665246794 410730296 /nfs/dbraw/zinc/73/02/96/410730296.db2.gz NXZZRFADIRJIIX-UHFFFAOYSA-N 2 0 210.365 2.282 20 0 BEADRP CC[C@H]([NH2+]C[C@@]1(C)CC1(F)F)[C@@H]1CCC[NH2+]1 ZINC000665267546 410739305 /nfs/dbraw/zinc/73/93/05/410739305.db2.gz YKXPKORFLUJJFA-GARJFASQSA-N 2 0 232.318 2.152 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]C[C@@H]1C(C)(C)C1(F)F ZINC000665274235 410742126 /nfs/dbraw/zinc/74/21/26/410742126.db2.gz MBZCVZXQGXPWOG-VHSXEESVSA-N 2 0 234.334 2.385 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@H]1C(C)(C)C1(F)F ZINC000665274236 410744182 /nfs/dbraw/zinc/74/41/82/410744182.db2.gz MBZCVZXQGXPWOG-ZJUUUORDSA-N 2 0 234.334 2.385 20 0 BEADRP CC[C@@H]1C[N@H+](CCCCCF)CC[C@@H]1[NH3+] ZINC000308916722 410813606 /nfs/dbraw/zinc/81/36/06/410813606.db2.gz INEBBGKPIJBPOK-NEPJUHHUSA-N 2 0 216.344 2.185 20 0 BEADRP CC(C)[NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000053656068 410861100 /nfs/dbraw/zinc/86/11/00/410861100.db2.gz TXODJEAQRABGOV-ZDUSSCGKSA-N 2 0 210.365 2.106 20 0 BEADRP C[NH2+]C[C@H](C)[NH2+][C@@H]1CCCc2ccccc2C1 ZINC000665297451 410818641 /nfs/dbraw/zinc/81/86/41/410818641.db2.gz GBDVKVGJBFUKKI-SWLSCSKDSA-N 2 0 232.371 2.132 20 0 BEADRP C[C@H]([NH2+]CC1CC(F)(F)C1)C1CC[NH+](C)CC1 ZINC000394729768 410818954 /nfs/dbraw/zinc/81/89/54/410818954.db2.gz KFORILKNNIZCAM-JTQLQIEISA-N 2 0 246.345 2.352 20 0 BEADRP CC(C)OC[C@@H](C)[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000374325888 167259082 /nfs/dbraw/zinc/25/90/82/167259082.db2.gz CYTZAOKQVUYKID-HZSPNIEDSA-N 2 0 240.391 2.016 20 0 BEADRP CC(C)[C@@H](C)[NH2+]CCN1CCCC[C@@H]1C ZINC000226769674 167379523 /nfs/dbraw/zinc/37/95/23/167379523.db2.gz SKBLASTUPTVFOX-QWHCGFSZSA-N 2 0 212.381 2.495 20 0 BEADRP Cc1cc(NCCC[N@@H+](C)CC(C)C)cc[nH+]1 ZINC000651363328 410952772 /nfs/dbraw/zinc/95/27/72/410952772.db2.gz USDDPJMSQOLFPA-UHFFFAOYSA-N 2 0 235.375 2.202 20 0 BEADRP CC[C@H]([NH2+][C@H](C)C1CC[NH+](C)CC1)C(F)F ZINC000651364331 410952900 /nfs/dbraw/zinc/95/29/00/410952900.db2.gz HFOZFYUMZXOCTQ-KOLCDFICSA-N 2 0 234.334 2.350 20 0 BEADRP COC[C@H](CC(C)(C)C)[NH2+][C@@H]1CCCN(C)C1 ZINC000651684979 411135973 /nfs/dbraw/zinc/13/59/73/411135973.db2.gz DYWQHMXBYGJZDR-OLZOCXBDSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H](c1ccncc1)[N@@H+]1CCC[C@H](CC[NH3+])C1 ZINC000070169533 411137198 /nfs/dbraw/zinc/13/71/98/411137198.db2.gz LNVKLPADSXMBRT-CHWSQXEVSA-N 2 0 233.359 2.203 20 0 BEADRP CC(C)CC[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000400936408 411163570 /nfs/dbraw/zinc/16/35/70/411163570.db2.gz QWKCWAATIBEFOH-YNEHKIRRSA-N 2 0 210.365 2.010 20 0 BEADRP CC(C)C[N@H+](C)CCC[NH2+]C[C@@H]1CCSC1 ZINC000651865996 411147805 /nfs/dbraw/zinc/14/78/05/411147805.db2.gz PSALBMVCDLESEM-ZDUSSCGKSA-N 2 0 244.448 2.307 20 0 BEADRP CC(C)C[N@H+](C)CCC[NH2+]C[C@H]1C[C@H]1C ZINC000651865868 411148056 /nfs/dbraw/zinc/14/80/56/411148056.db2.gz KQLCMTSALPHJOK-CHWSQXEVSA-N 2 0 212.381 2.210 20 0 BEADRP CC(C)C[N@H+](C)CCC[NH2+][C@H]1CCSC1 ZINC000651865690 411148083 /nfs/dbraw/zinc/14/80/83/411148083.db2.gz DNCWUENLYACNDP-LBPRGKRZSA-N 2 0 230.421 2.059 20 0 BEADRP CC[N@H+](C)C[C@@H]1CC[NH+](CC2CC=CC2)C1 ZINC000659989851 411158198 /nfs/dbraw/zinc/15/81/98/411158198.db2.gz UYRFLLUYSIKYGV-AWEZNQCLSA-N 2 0 222.376 2.226 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)C1CC1 ZINC000400993551 411168407 /nfs/dbraw/zinc/16/84/07/411168407.db2.gz ZPDMTCIWMVTUJI-VZZFWQQMSA-N 2 0 222.376 2.010 20 0 BEADRP C1[C@H]([NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)C12CCCC2 ZINC000400989609 411168599 /nfs/dbraw/zinc/16/85/99/411168599.db2.gz XVRMTHOBRZGHFT-DGAVXFQQSA-N 2 0 234.387 2.297 20 0 BEADRP CC[C@@]1(C)CCC[C@H]1[NH2+]CCOCC[NH+](C)C ZINC000652192597 411168856 /nfs/dbraw/zinc/16/88/56/411168856.db2.gz GDEMGRBUIHOPFH-KGLIPLIRSA-N 2 0 242.407 2.123 20 0 BEADRP C([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)C(C1CC1)C1CC1 ZINC000401020675 411173215 /nfs/dbraw/zinc/17/32/15/411173215.db2.gz KQOXETPTBOKVQR-QLFBSQMISA-N 2 0 248.414 2.400 20 0 BEADRP CC(C)C[N@H+](C)CCC[NH2+][C@H]1CCOC1(C)C ZINC000652222384 411175850 /nfs/dbraw/zinc/17/58/50/411175850.db2.gz MUUKBJVALXKKIB-ZDUSSCGKSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H](Cc1ccccn1)[NH2+]C1CCC(C[NH3+])CC1 ZINC000656193831 411199634 /nfs/dbraw/zinc/19/96/34/411199634.db2.gz VHRZSBQBJYSGKZ-IYXRBSQSSA-N 2 0 247.386 2.120 20 0 BEADRP COC[C@H](CC(C)(C)C)[NH2+]CC1CC[NH2+]CC1 ZINC000656193331 411200448 /nfs/dbraw/zinc/20/04/48/411200448.db2.gz GLFVUHJJKIZHAZ-ZDUSSCGKSA-N 2 0 242.407 2.027 20 0 BEADRP C[C@H](Cc1ccccn1)[NH2+][C@H](C)C[C@@H]1CCC[NH2+]1 ZINC000656193318 411201070 /nfs/dbraw/zinc/20/10/70/411201070.db2.gz GCGODLMABMJLTI-NFAWXSAZSA-N 2 0 247.386 2.133 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]Cc2ccc(Cl)cn2)C1 ZINC000656198390 411203087 /nfs/dbraw/zinc/20/30/87/411203087.db2.gz SRLQSURCFKXSMJ-MNOVXSKESA-N 2 0 239.750 2.095 20 0 BEADRP CC[C@H]([NH2+][C@H](C)C[C@H](C)[NH3+])[C@H]1CCCCO1 ZINC000656201601 411206357 /nfs/dbraw/zinc/20/63/57/411206357.db2.gz SGONCTAFQAEJFN-QNWHQSFQSA-N 2 0 228.380 2.050 20 0 BEADRP CC[C@H]([NH2+][C@H](C)C[C@@H](C)[NH3+])[C@H]1CCCCO1 ZINC000656201599 411206365 /nfs/dbraw/zinc/20/63/65/411206365.db2.gz SGONCTAFQAEJFN-FVCCEPFGSA-N 2 0 228.380 2.050 20 0 BEADRP C[C@@H]([NH2+][C@H](C)C1CCC(F)(F)CC1)C1C[NH2+]C1 ZINC000656201951 411207467 /nfs/dbraw/zinc/20/74/67/411207467.db2.gz VUEKZNURSFHTJN-NXEZZACHSA-N 2 0 246.345 2.398 20 0 BEADRP Cc1cc[nH+]c(NC[C@H]2C[C@@H]([NH+](C)C)C2)c1 ZINC000656212046 411210709 /nfs/dbraw/zinc/21/07/09/411210709.db2.gz XNTLOCLPISAEJG-TXEJJXNPSA-N 2 0 219.332 2.142 20 0 BEADRP Cc1cc(N[C@H]2CCC[N@@H+]3CCCC[C@H]23)cc[nH+]1 ZINC000656226757 411213485 /nfs/dbraw/zinc/21/34/85/411213485.db2.gz OAWJTKRTNXJYQG-LSDHHAIUSA-N 2 0 245.370 2.241 20 0 BEADRP CC(C)OCCC[N@@H+]1CCC[C@@H](C)[C@H]1CC[NH3+] ZINC000652355013 411215095 /nfs/dbraw/zinc/21/50/95/411215095.db2.gz MRFVCJVZZFABEV-ZIAGYGMSSA-N 2 0 242.407 2.251 20 0 BEADRP CCCC[N@@H+]1CCCC[C@@H]1[C@@H]1C[C@@H]([NH3+])CCO1 ZINC000652360349 411218829 /nfs/dbraw/zinc/21/88/29/411218829.db2.gz FXFKFCJNKNJLMK-MJBXVCDLSA-N 2 0 240.391 2.147 20 0 BEADRP Cc1noc(C)c1[C@H](C)[NH2+][C@@H](C)CCCC[NH3+] ZINC000310262095 411231455 /nfs/dbraw/zinc/23/14/55/411231455.db2.gz MBBFHFCYCIFFBL-UWVGGRQHSA-N 2 0 239.363 2.460 20 0 BEADRP CCC[C@H](C)[NH2+][C@@H](C)CN(C)CCC[NH+](C)C ZINC000658106863 411247652 /nfs/dbraw/zinc/24/76/52/411247652.db2.gz GDRDMAWVGMDCJU-KBPBESRZSA-N 2 0 243.439 2.037 20 0 BEADRP CC[C@H]([NH2+]CC1C[NH2+]C1)c1ccc(F)cc1 ZINC000423307063 411238724 /nfs/dbraw/zinc/23/87/24/411238724.db2.gz VEHVZYTURZXXRK-ZDUSSCGKSA-N 2 0 222.307 2.086 20 0 BEADRP CC(C)[C@@H]1CCCC[C@@H]1[NH2+]CC1C[NH2+]C1 ZINC000423307028 411238800 /nfs/dbraw/zinc/23/88/00/411238800.db2.gz UZKLMJWBWFGPAN-STQMWFEESA-N 2 0 210.365 2.010 20 0 BEADRP C[C@H]([NH2+][C@H]1CCN(C(C)(C)C)C1)[C@@H]1CCCO1 ZINC000658094704 411241953 /nfs/dbraw/zinc/24/19/53/411241953.db2.gz AKQFNJPRCGYOOC-AVGNSLFASA-N 2 0 240.391 2.016 20 0 BEADRP C1=CC[C@H]([NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)CC1 ZINC000400979962 411167494 /nfs/dbraw/zinc/16/74/94/411167494.db2.gz RGRKSZYPNXMZPY-RFQIPJPRSA-N 2 0 220.360 2.073 20 0 BEADRP CCC[C@@H]1CCC[N@H+](C[C@@H]2CC[NH2+]C2)C1 ZINC000309843139 411276566 /nfs/dbraw/zinc/27/65/66/411276566.db2.gz RAMQXRTWIOZHSD-CHWSQXEVSA-N 2 0 210.365 2.108 20 0 BEADRP c1cnc2c(c1)CCC[C@H]2[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000643509386 411280016 /nfs/dbraw/zinc/28/00/16/411280016.db2.gz KWVIBUFGROXQAQ-GXTWGEPZSA-N 2 0 245.370 2.048 20 0 BEADRP CC[C@H]1CCC[N@H+](C[C@@H]2CC[NH2+]C2)CC1 ZINC000070652738 411284807 /nfs/dbraw/zinc/28/48/07/411284807.db2.gz KDPTYCOQBZDIDX-QWHCGFSZSA-N 2 0 210.365 2.108 20 0 BEADRP C[N@H+](C[C@@H]1CC[NH2+]C1)C1CCCCCC1 ZINC000051889541 411285219 /nfs/dbraw/zinc/28/52/19/411285219.db2.gz FFITTXVYOFQKCB-GFCCVEGCSA-N 2 0 210.365 2.251 20 0 BEADRP C[N@H+](C[C@@H]1CC[NH2+]C1)CC1CCCCC1 ZINC000051889666 411285236 /nfs/dbraw/zinc/28/52/36/411285236.db2.gz OTRFTXIJRNRZPT-CYBMUJFWSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@@H]1CCCC[C@H]1[N@H+](C)C[C@@H]1CC[NH2+]C1 ZINC000051889825 411285274 /nfs/dbraw/zinc/28/52/74/411285274.db2.gz KBOIENMSRJEDCI-JHJVBQTASA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1CCC[C@H](C[NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)O1 ZINC000658220350 411299738 /nfs/dbraw/zinc/29/97/38/411299738.db2.gz PTSPCOZABSFFQI-REWJHTLYSA-N 2 0 240.391 2.016 20 0 BEADRP CC[C@@H]([NH2+]CC[C@@H]1CCC[N@@H+]1C)C1CC1 ZINC000658236332 411305973 /nfs/dbraw/zinc/30/59/73/411305973.db2.gz INWQLCYMKMXVCQ-QWHCGFSZSA-N 2 0 210.365 2.249 20 0 BEADRP CCC[C@H](C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)OC ZINC000393415653 411312079 /nfs/dbraw/zinc/31/20/79/411312079.db2.gz AKFPITFVLRHIPY-WTUNAVPPSA-N 2 0 240.391 2.016 20 0 BEADRP C([C@H]1CC[NH2+]C1)[N@@H+]1CCC2(C1)CCCCC2 ZINC000303391623 411318227 /nfs/dbraw/zinc/31/82/27/411318227.db2.gz OXRYXYAKBKMREJ-ZDUSSCGKSA-N 2 0 222.376 2.252 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@@H]2C(C)(C)C2(F)F)CC1 ZINC000658282065 411321496 /nfs/dbraw/zinc/32/14/96/411321496.db2.gz DTHSQJLSIUATEJ-LLVKDONJSA-N 2 0 246.345 2.352 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCC[C@H](C2CC2)C1 ZINC000424388833 411249976 /nfs/dbraw/zinc/24/99/76/411249976.db2.gz ZTBAOSTVEGJWDO-DGAVXFQQSA-N 2 0 222.376 2.425 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[C@H](C)SC1)C[NH+](C)C ZINC000655769876 411252242 /nfs/dbraw/zinc/25/22/42/411252242.db2.gz RFKTVQZBYLBNNF-GRYCIOLGSA-N 2 0 230.421 2.058 20 0 BEADRP Cc1ccncc1CC[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000658127167 411254268 /nfs/dbraw/zinc/25/42/68/411254268.db2.gz SEFHSWLNTFSASC-DZGCQCFKSA-N 2 0 247.386 2.005 20 0 BEADRP CC1(C)CC[C@H]([NH2+]CC[C@H]2CC[NH2+]C2)C1 ZINC000129538437 167940695 /nfs/dbraw/zinc/94/06/95/167940695.db2.gz LPLWZBQZGZJUEG-NEPJUHHUSA-N 2 0 210.365 2.154 20 0 BEADRP CC1(C[N@@H+]2CCC[C@@H](C3CC[NH2+]CC3)C2)CC1 ZINC000656782404 411359844 /nfs/dbraw/zinc/35/98/44/411359844.db2.gz FZHUTDSIIJMWAW-CQSZACIVSA-N 2 0 236.403 2.498 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH+]1CCC([C@@H]2CCC[NH2+]C2)CC1 ZINC000656784318 411361274 /nfs/dbraw/zinc/36/12/74/411361274.db2.gz AJGXPZJOHZHAFZ-BPLDGKMQSA-N 2 0 236.403 2.354 20 0 BEADRP CN(C[C@H]1CCOc2ccccc21)CC(C)(C)[NH3+] ZINC000656784621 411361721 /nfs/dbraw/zinc/36/17/21/411361721.db2.gz FXKGLOYPXMSGLR-GFCCVEGCSA-N 2 0 248.370 2.222 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]Cc2cccc(N)c2)CC1 ZINC000656785895 411364788 /nfs/dbraw/zinc/36/47/88/411364788.db2.gz SIHXNSBQYLWGBU-UHFFFAOYSA-N 2 0 247.386 2.231 20 0 BEADRP C[C@H]1CCCC[C@H]1[NH2+]CC1([NH3+])CCCC1 ZINC000656789586 411368738 /nfs/dbraw/zinc/36/87/38/411368738.db2.gz RQDULMDZWLSFPT-NWDGAFQWSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2CCC[C@@H](CCF)C2)CC[NH2+]1 ZINC000656790831 411370822 /nfs/dbraw/zinc/37/08/22/411370822.db2.gz BITBVESPENEHOB-HZSPNIEDSA-N 2 0 242.382 2.446 20 0 BEADRP C[NH2+]CCC1CC[NH+]([C@H](C)c2ccncc2)CC1 ZINC000070188969 411371485 /nfs/dbraw/zinc/37/14/85/411371485.db2.gz PCQBNLCVZDLKKQ-CYBMUJFWSA-N 2 0 247.386 2.464 20 0 BEADRP C[C@H]1CN(C2CC2)C[C@H]1[NH2+]CCCc1ccco1 ZINC000658328048 411335596 /nfs/dbraw/zinc/33/55/96/411335596.db2.gz TWJCLPJULRXLAN-SWLSCSKDSA-N 2 0 248.370 2.285 20 0 BEADRP C[C@@H]1CN(C2CC2)C[C@H]1[NH2+]CCCc1ccco1 ZINC000658328047 411336051 /nfs/dbraw/zinc/33/60/51/411336051.db2.gz TWJCLPJULRXLAN-IUODEOHRSA-N 2 0 248.370 2.285 20 0 BEADRP [NH3+]CCC[N@@H+](Cc1ccccc1F)CC1CC1 ZINC000656791763 411372146 /nfs/dbraw/zinc/37/21/46/411372146.db2.gz JTLNCCCGDXRODI-UHFFFAOYSA-N 2 0 236.334 2.387 20 0 BEADRP CC(C)c1cccc(C[N@H+]2C[C@H]3C[NH2+]C[C@H]3C2)c1 ZINC000659849011 411341258 /nfs/dbraw/zinc/34/12/58/411341258.db2.gz DPSTWOWLAUNDFK-IYBDPMFKSA-N 2 0 244.382 2.461 20 0 BEADRP CC1=C[C@H](C)C[C@H](C[NH+]2C[C@H]3C[NH+](C)C[C@@H]3C2)C1 ZINC000356392081 168130963 /nfs/dbraw/zinc/13/09/63/168130963.db2.gz JRXNXWFSZXHSLI-ARLBYUKCSA-N 2 0 248.414 2.472 20 0 BEADRP CC1CC([NH2+]CC2CC[NH+](C3CC3)CC2)C1 ZINC000336738569 168145195 /nfs/dbraw/zinc/14/51/95/168145195.db2.gz KIUWSWKDEOJVDS-UHFFFAOYSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@H]([NH3+])[C@H]1CC[N@H+](CC2CCC(C)CC2)C1 ZINC000227204930 168153344 /nfs/dbraw/zinc/15/33/44/168153344.db2.gz CMCMKDNEIOXJQH-YIOUJQMASA-N 2 0 224.392 2.482 20 0 BEADRP CC1CCC([N@H+](CCOCC[NH3+])C2CC2)CC1 ZINC000357075409 168160360 /nfs/dbraw/zinc/16/03/60/168160360.db2.gz HOPGNWWBVMDKQP-UHFFFAOYSA-N 2 0 240.391 2.005 20 0 BEADRP CC(C)CC[N@@H+]1CCC[C@H](C)[C@H]1CC[NH3+] ZINC000404321812 411390532 /nfs/dbraw/zinc/39/05/32/411390532.db2.gz RFYCWGKIGNNWMX-QWHCGFSZSA-N 2 0 212.381 2.482 20 0 BEADRP CCC(C)(C)CC[N@@H+]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000357075967 168276594 /nfs/dbraw/zinc/27/65/94/168276594.db2.gz JNKMEHOBIWIRMS-STQMWFEESA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H]1CCC[N@H+](Cc2cncs2)[C@H]1CC[NH3+] ZINC000404277096 411387362 /nfs/dbraw/zinc/38/73/62/411387362.db2.gz BEPXJVMDIFBRJT-PWSUYJOCSA-N 2 0 239.388 2.092 20 0 BEADRP C[C@H]1CCC[N@H+](CCc2cccnc2)[C@H]1CC[NH3+] ZINC000404278380 411387609 /nfs/dbraw/zinc/38/76/09/411387609.db2.gz CFKZIHIIIGFBKE-ZFWWWQNUSA-N 2 0 247.386 2.073 20 0 BEADRP C[C@H]1CCC[N@H+](CC2CCC2)[C@H]1CC[NH3+] ZINC000404392554 411393328 /nfs/dbraw/zinc/39/33/28/411393328.db2.gz YWNJMKYYKWIFNA-AAEUAGOBSA-N 2 0 210.365 2.236 20 0 BEADRP CC(C)COCC[N@@H+]1CCC[C@@H](C)[C@H]1CC[NH3+] ZINC000404406133 411394233 /nfs/dbraw/zinc/39/42/33/411394233.db2.gz UZLWCNFQDNEXNM-ZIAGYGMSSA-N 2 0 242.407 2.108 20 0 BEADRP C[C@@H]1CCC[N@H+](C[C@@H]2CCSC2)[C@@H]1CC[NH3+] ZINC000404492786 411399634 /nfs/dbraw/zinc/39/96/34/411399634.db2.gz CMFFBBHWJIJEJW-FRRDWIJNSA-N 2 0 242.432 2.189 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CC2=CC[N@H+](C)CC2)CS1 ZINC000655738195 411444134 /nfs/dbraw/zinc/44/41/34/411444134.db2.gz JJDJDSLKKHHUNQ-DGCLKSJQSA-N 2 0 240.416 2.122 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H](C)CCc1cccc(F)c1 ZINC000414824672 411448815 /nfs/dbraw/zinc/44/88/15/411448815.db2.gz RFOWLTZWPSEECY-RYUDHWBXSA-N 2 0 238.350 2.474 20 0 BEADRP CC(C)CCC[NH2+][C@H](C)[C@H]1CCC[NH2+]C1 ZINC000414825839 411449969 /nfs/dbraw/zinc/44/99/69/411449969.db2.gz UJEWTUBPAPQBDW-OLZOCXBDSA-N 2 0 212.381 2.400 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H]2CO[C@H](CC)C2)CC1 ZINC000657294023 411450147 /nfs/dbraw/zinc/45/01/47/411450147.db2.gz AHVGVGGPEYOXSV-UONOGXRCSA-N 2 0 240.391 2.018 20 0 BEADRP c1cc(C[NH2+]CC2CCC2)n(-c2cc[nH+]cc2)n1 ZINC000657331669 411468506 /nfs/dbraw/zinc/46/85/06/411468506.db2.gz KYWKYXCJZQDHNG-UHFFFAOYSA-N 2 0 242.326 2.157 20 0 BEADRP Fc1cccc(C[NH2+]CCC[C@H]2CCC[NH2+]2)c1 ZINC000414970175 411476654 /nfs/dbraw/zinc/47/66/54/411476654.db2.gz KCLWJGGIXZSCBF-AWEZNQCLSA-N 2 0 236.334 2.448 20 0 BEADRP CC1(C)CCCC[C@@H]1C[NH+]1C[C@@H]2C[NH2+]C[C@H]2C1 ZINC000659850917 411477345 /nfs/dbraw/zinc/47/73/45/411477345.db2.gz WSHZNBZKMMGSCH-MELADBBJSA-N 2 0 236.403 2.354 20 0 BEADRP CC1CC([NH2+]Cc2ccnn2-c2cc[nH+]cc2)C1 ZINC000657384327 411488820 /nfs/dbraw/zinc/48/88/20/411488820.db2.gz OVFCWSNLXSNCAI-UHFFFAOYSA-N 2 0 242.326 2.155 20 0 BEADRP CC1(C)CC[C@@H]([NH2+]CC2CC[NH2+]CC2)C1 ZINC000128597294 411493074 /nfs/dbraw/zinc/49/30/74/411493074.db2.gz ADKPNAFFJRKMBI-GFCCVEGCSA-N 2 0 210.365 2.154 20 0 BEADRP CC[C@H]1C[C@@H]([NH2+]C2CCC([NH+](C)C)CC2)CO1 ZINC000657493464 411534291 /nfs/dbraw/zinc/53/42/91/411534291.db2.gz DIRPNJUYQCOAOH-HHTDUIENSA-N 2 0 240.391 2.016 20 0 BEADRP CC[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1ccncc1 ZINC000655803766 411518329 /nfs/dbraw/zinc/51/83/29/411518329.db2.gz DFRUIKZXSOLQPX-CFVMTHIKSA-N 2 0 247.386 2.463 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H]2CCC[C@@H]3C[C@@]32C)C1 ZINC000655804267 411519371 /nfs/dbraw/zinc/51/93/71/411519371.db2.gz RKBYZLZQKFRBSQ-QMIVOQANSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@@H]1CCC[C@H]1[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655805441 411519491 /nfs/dbraw/zinc/51/94/91/411519491.db2.gz HIQANMUBMMPGSW-FVCCEPFGSA-N 2 0 210.365 2.105 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655805417 411519605 /nfs/dbraw/zinc/51/96/05/411519605.db2.gz NLPWLSHHLDTFQR-MQYQWHSLSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H]1CCCC[C@@H]1[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655807892 411521185 /nfs/dbraw/zinc/52/11/85/411521185.db2.gz VTXQUOPHQUKIFV-FQUUOJAGSA-N 2 0 224.392 2.495 20 0 BEADRP CC[C@H](C)[C@@H](C)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655807909 411521418 /nfs/dbraw/zinc/52/14/18/411521418.db2.gz WAXSJMCHRLSVQL-QNWHQSFQSA-N 2 0 212.381 2.351 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655807894 411521522 /nfs/dbraw/zinc/52/15/22/411521522.db2.gz VTXQUOPHQUKIFV-MQYQWHSLSA-N 2 0 224.392 2.495 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]Cc2ccccc2)C1 ZINC000655826100 411525798 /nfs/dbraw/zinc/52/57/98/411525798.db2.gz PXFNWVMSQHXFKD-OKILXGFUSA-N 2 0 218.344 2.116 20 0 BEADRP CCC(CC)C[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655825614 411527153 /nfs/dbraw/zinc/52/71/53/411527153.db2.gz KGQXBNLCQGKODC-BETUJISGSA-N 2 0 212.381 2.352 20 0 BEADRP Cc1ccc(C[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)cc1 ZINC000655826219 411529991 /nfs/dbraw/zinc/52/99/91/411529991.db2.gz SQFFBCFJCSIRCH-GASCZTMLSA-N 2 0 232.371 2.425 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]Cc2cccc(F)c2)C1 ZINC000655826666 411530018 /nfs/dbraw/zinc/53/00/18/411530018.db2.gz XCEPGDKFLQRHDI-XBXGTLAGSA-N 2 0 236.334 2.256 20 0 BEADRP CC1(C)C[C@@H]1[NH2+]Cc1ccnn1-c1cc[nH+]cc1 ZINC000657326491 411465848 /nfs/dbraw/zinc/46/58/48/411465848.db2.gz NKFAHDNLGNBJHW-ZDUSSCGKSA-N 2 0 242.326 2.155 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2sccc2C)C1 ZINC000037484199 170008677 /nfs/dbraw/zinc/00/86/77/170008677.db2.gz DJINSBWVKLWPMV-LBPRGKRZSA-N 2 0 238.400 2.488 20 0 BEADRP CC[N@@H+]1CC[C@@H](CN[C@H](C)c2cc(C)ccn2)C1 ZINC000285592667 170010408 /nfs/dbraw/zinc/01/04/08/170010408.db2.gz JHASWGZVNOYRCJ-KGLIPLIRSA-N 2 0 247.386 2.382 20 0 BEADRP CC[N@@H+]1CC[C@@H](NCc2cnccc2C)[C@@H](C)C1 ZINC000354498460 170011620 /nfs/dbraw/zinc/01/16/20/170011620.db2.gz JPEQTURNMXVFNZ-DZGCQCFKSA-N 2 0 247.386 2.210 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+]C2CCCCC2)C1 ZINC000037484160 170015334 /nfs/dbraw/zinc/01/53/34/170015334.db2.gz TXCWOFAVPNFTLP-GFCCVEGCSA-N 2 0 210.365 2.251 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+]Cc2cccc(F)c2)C1 ZINC000037643765 170017199 /nfs/dbraw/zinc/01/71/99/170017199.db2.gz MLTRXASPVGIIQH-CYBMUJFWSA-N 2 0 236.334 2.257 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]C[C@H]2CCSC2)[C@@H](C)C1 ZINC000336779019 170020561 /nfs/dbraw/zinc/02/05/61/170020561.db2.gz MZGUFMJUXDOLFG-XQQFMLRXSA-N 2 0 242.432 2.059 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H]2CC[C@@H](F)C2)[C@H](C)C1 ZINC000336778104 170021771 /nfs/dbraw/zinc/02/17/71/170021771.db2.gz KIXGLWUAOLWXGN-LPWJVIDDSA-N 2 0 228.355 2.197 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@H](C)CSC)[C@H](C)C1 ZINC000336759665 170022999 /nfs/dbraw/zinc/02/29/99/170022999.db2.gz KYOSYHILFYPIDC-UTUOFQBUSA-N 2 0 230.421 2.058 20 0 BEADRP CC[NH2+]CC1CC[NH+](CC2CCCC2)CC1 ZINC000053659098 170110926 /nfs/dbraw/zinc/11/09/26/170110926.db2.gz BMOJZINSTGLSKH-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP CC[NH2+]CC1CC[NH+]([C@H](C)c2cccnc2)CC1 ZINC000131463369 170111669 /nfs/dbraw/zinc/11/16/69/170111669.db2.gz YGRYQHBTCVSWJR-CYBMUJFWSA-N 2 0 247.386 2.464 20 0 BEADRP CC[NH2+][C@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000034819471 170159573 /nfs/dbraw/zinc/15/95/73/170159573.db2.gz WMOUEPBSGXJGNB-GFCCVEGCSA-N 2 0 236.359 2.298 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)C1CC1 ZINC000663346266 411634241 /nfs/dbraw/zinc/63/42/41/411634241.db2.gz RUJBOCFBQVTNAD-TZMCWYRMSA-N 2 0 236.403 2.497 20 0 BEADRP C1C[C@@H]2[C@H](C1)[C@@H]2[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000657734112 411587726 /nfs/dbraw/zinc/58/77/26/411587726.db2.gz FNPDESKYLFJAOM-YHQUGGNUSA-N 2 0 220.360 2.001 20 0 BEADRP CC([NH2+]Cc1cnc2n1CCC2)(C1CC1)C1CC1 ZINC000657755209 411590311 /nfs/dbraw/zinc/59/03/11/411590311.db2.gz HOGZAUOUNBXNON-UHFFFAOYSA-N 2 0 245.370 2.498 20 0 BEADRP c1coc(CCC[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)c1 ZINC000657781642 411597259 /nfs/dbraw/zinc/59/72/59/411597259.db2.gz FOAJYVQJXKACJN-UONOGXRCSA-N 2 0 248.370 2.429 20 0 BEADRP FCC1(CF)CC([NH2+]CCC[NH+]2CCCC2)C1 ZINC000657823422 411607320 /nfs/dbraw/zinc/60/73/20/411607320.db2.gz FVYFMMZTXRMYMT-UHFFFAOYSA-N 2 0 246.345 2.150 20 0 BEADRP C[N@@H+]1CC[C@]2(CC[NH+](CCC3CCC3)C2)C1 ZINC000660616331 411608342 /nfs/dbraw/zinc/60/83/42/411608342.db2.gz JWEFADYYSQOHJG-AWEZNQCLSA-N 2 0 222.376 2.204 20 0 BEADRP COC1([C@H](C)[NH2+]CCC[N@H+](C)C(C)C)CCC1 ZINC000657829873 411609094 /nfs/dbraw/zinc/60/90/94/411609094.db2.gz ATTJOQAHOZGALA-ZDUSSCGKSA-N 2 0 242.407 2.264 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H]2CCCSCC2)C1 ZINC000657843493 411610713 /nfs/dbraw/zinc/61/07/13/411610713.db2.gz ZDNNABBLQLFZOC-OLZOCXBDSA-N 2 0 242.432 2.204 20 0 BEADRP C[NH+](C)CCCC[NH2+]C1CC(CF)(CF)C1 ZINC000657857585 411612673 /nfs/dbraw/zinc/61/26/73/411612673.db2.gz AKPQPLKTCOBUQI-UHFFFAOYSA-N 2 0 234.334 2.006 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@@H]2CCCSCC2)CC1 ZINC000657873970 411615353 /nfs/dbraw/zinc/61/53/53/411615353.db2.gz XCLKMFCEKBJURU-CYBMUJFWSA-N 2 0 242.432 2.204 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]CC23CC(C2)C[NH2+]3)[C@@H]1C ZINC000663497079 411678577 /nfs/dbraw/zinc/67/85/77/411678577.db2.gz BDMVKBJVQPCNAQ-LRUBOHGLSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]1CCCC[C@H]1C[NH2+]CC12CC(C1)C[NH2+]2 ZINC000663497542 411678661 /nfs/dbraw/zinc/67/86/61/411678661.db2.gz HAZCJZYIPLTFGA-ZIHBUVQPSA-N 2 0 222.376 2.154 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CC23CC(C2)C[NH2+]3)[C@@H](C)C1 ZINC000663497816 411678865 /nfs/dbraw/zinc/67/88/65/411678865.db2.gz KGKHFYFPOJTHQD-IGYKFCIQSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]CC23CC(C2)C[NH2+]3)[C@H]1C ZINC000663497080 411679157 /nfs/dbraw/zinc/67/91/57/411679157.db2.gz BDMVKBJVQPCNAQ-NFMDPKQHSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H]([NH2+]CC12CC(C1)C[NH2+]2)C1CCCCC1 ZINC000663499668 411683207 /nfs/dbraw/zinc/68/32/07/411683207.db2.gz FVPLKIJJXREBHR-DCBWTQNWSA-N 2 0 222.376 2.297 20 0 BEADRP Cc1cccc2c1CCC[C@H]2[NH2+]CCC[NH3+] ZINC000663504533 411687077 /nfs/dbraw/zinc/68/70/77/411687077.db2.gz ZQTQQFUPHQDRFJ-CQSZACIVSA-N 2 0 218.344 2.311 20 0 BEADRP Cc1cccc(CN2CC[C@@H](F)[C@H]([NH3+])C2)c1C ZINC000663506956 411690949 /nfs/dbraw/zinc/69/09/49/411690949.db2.gz PQMYDHHEIFFFBC-ZIAGYGMSSA-N 2 0 236.334 2.175 20 0 BEADRP CC[C@@H]1CCC[C@@H](C[NH2+][C@H](C)C[NH2+]C)C1 ZINC000663509429 411692137 /nfs/dbraw/zinc/69/21/37/411692137.db2.gz KJZZZCXZHMZLNL-JHJVBQTASA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H]1C[C@@H](C[N@H+](C)C[C@@H]2CC2(C)C)CC[NH2+]1 ZINC000663513119 411694303 /nfs/dbraw/zinc/69/43/03/411694303.db2.gz ILZBCPUDLDCFSU-AGIUHOORSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@H](CC[N@@H+]1CC[C@@H]2C[C@@H]2C1)[NH+]1CC[C@@H]2C[C@@H]2C1 ZINC000661970399 411927107 /nfs/dbraw/zinc/92/71/07/411927107.db2.gz LFXKSGXKZNGCPF-OXGONZEZSA-N 2 0 248.414 2.449 20 0 BEADRP C(CC1CCC1)C[N@@H+]1CC[C@@]2(CC[NH2+]C2)C1 ZINC000662265817 412059069 /nfs/dbraw/zinc/05/90/69/412059069.db2.gz IYZJPGPGMXYIET-CQSZACIVSA-N 2 0 222.376 2.252 20 0 BEADRP CO[C@H](C[N@@H+]1CCCC[C@H]1[C@@H](C)[NH3+])C1CCC1 ZINC000662236387 412034518 /nfs/dbraw/zinc/03/45/18/412034518.db2.gz XCHSBDKAPOXROO-KWCYVHTRSA-N 2 0 240.391 2.003 20 0 BEADRP C[NH2+]C[C@H]1CCC[N@H+](CCC=C(C)C)C1 ZINC000662238830 412034934 /nfs/dbraw/zinc/03/49/34/412034934.db2.gz XXMJTTROLVDWET-CYBMUJFWSA-N 2 0 210.365 2.274 20 0 BEADRP CC[C@H](CC(F)F)C[NH+]1CCC(C[NH3+])CC1 ZINC000662236215 412035871 /nfs/dbraw/zinc/03/58/71/412035871.db2.gz VTDXBQGVIPHIQG-SNVBAGLBSA-N 2 0 234.334 2.339 20 0 BEADRP CC[C@@H](CC(F)F)C[N@@H+]1CC[C@H](C[NH2+]C)C1 ZINC000662244108 412039452 /nfs/dbraw/zinc/03/94/52/412039452.db2.gz BUEQYIWFVWSILS-WDEREUQCSA-N 2 0 234.334 2.209 20 0 BEADRP C[N@H+](CCC[NH3+])CCc1nsc2ccccc21 ZINC000662245662 412041973 /nfs/dbraw/zinc/04/19/73/412041973.db2.gz NVCQSELGFRJETO-UHFFFAOYSA-N 2 0 249.383 2.119 20 0 BEADRP CC(C)[C@@H]([NH3+])CC[N@H+](C)C[C@@H]1C[C@H]2C[C@H]2C1 ZINC000662248012 412045885 /nfs/dbraw/zinc/04/58/85/412045885.db2.gz QWTGXOVNRDPFHI-CRWXNKLISA-N 2 0 224.392 2.338 20 0 BEADRP CC[C@H](CC(F)F)C[N@@H+]1C[C@@H](C[NH3+])C[C@@H]1C ZINC000662263449 412056089 /nfs/dbraw/zinc/05/60/89/412056089.db2.gz BHSBLUQHHPYEKX-HBNTYKKESA-N 2 0 234.334 2.337 20 0 BEADRP C(CC1CCC1)C[N@@H+]1CC[C@]2(CC[NH2+]C2)C1 ZINC000662265813 412057893 /nfs/dbraw/zinc/05/78/93/412057893.db2.gz IYZJPGPGMXYIET-AWEZNQCLSA-N 2 0 222.376 2.252 20 0 BEADRP CC[C@@H]1CC[C@H](C)[N@@H+]1CC1CC[NH2+]CC1 ZINC000136185165 171053464 /nfs/dbraw/zinc/05/34/64/171053464.db2.gz CZYLIZODMZHZAZ-WCQYABFASA-N 2 0 210.365 2.249 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+]C[C@@H]1CC[N@H+](CC)C1 ZINC000308937991 171058602 /nfs/dbraw/zinc/05/86/02/171058602.db2.gz LKKPIDGUGLGYST-YNEHKIRRSA-N 2 0 210.365 2.106 20 0 BEADRP [NH3+]CC[C@H]1CCC[N@H+](Cc2cc(C3CC3)no2)C1 ZINC000662271444 412062491 /nfs/dbraw/zinc/06/24/91/412062491.db2.gz GWDOYZVKHRCQBS-LLVKDONJSA-N 2 0 249.358 2.113 20 0 BEADRP CC[C@@H]1C[N@H+](CC2CC=CC2)CC[C@@H]1[NH3+] ZINC000662270851 412063212 /nfs/dbraw/zinc/06/32/12/412063212.db2.gz PZZXQZTUMOPXIU-OLZOCXBDSA-N 2 0 208.349 2.012 20 0 BEADRP CO[C@H](C[N@@H+]1CCCC[C@H]1CC[NH3+])C1CCC1 ZINC000662272588 412063951 /nfs/dbraw/zinc/06/39/51/412063951.db2.gz GVECBOWEVMPQIZ-UONOGXRCSA-N 2 0 240.391 2.005 20 0 BEADRP CC(C)=CCC[N@@H+]1CCC[C@H](CC[NH3+])C1 ZINC000662272779 412065829 /nfs/dbraw/zinc/06/58/29/412065829.db2.gz POBGOYJCNKEADM-CYBMUJFWSA-N 2 0 210.365 2.404 20 0 BEADRP C1=CCC(C[N@@H+]2CCCC[C@@H]2[C@@H]2CC[NH2+]C2)C1 ZINC000662276495 412069755 /nfs/dbraw/zinc/06/97/55/412069755.db2.gz NMMNFJQUMUFXIO-HUUCEWRRSA-N 2 0 234.387 2.417 20 0 BEADRP C[C@@H]1CC2(C[N@@H+]1CC1CC=CC1)CC[NH2+]CC2 ZINC000662284157 412075025 /nfs/dbraw/zinc/07/50/25/412075025.db2.gz UCZNMXIHDNUVPW-CYBMUJFWSA-N 2 0 234.387 2.417 20 0 BEADRP CC[C@H](C)C[N@H+](C)CCC1CC[NH2+]CC1 ZINC000037173371 171272358 /nfs/dbraw/zinc/27/23/58/171272358.db2.gz KDMKVQKIAHBUEY-LBPRGKRZSA-N 2 0 212.381 2.354 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCC[C@@H]2C[NH+](C)CC[C@@H]21 ZINC000336686541 171281193 /nfs/dbraw/zinc/28/11/93/171281193.db2.gz WNVIOSPCKKQOTF-MJBXVCDLSA-N 2 0 224.392 2.449 20 0 BEADRP CC[C@H](C)C[N@@H+]1CC[C@@]2(C1)CCC[NH2+]C2 ZINC000335619802 171282522 /nfs/dbraw/zinc/28/25/22/171282522.db2.gz NASYOPGEMZCVST-STQMWFEESA-N 2 0 210.365 2.108 20 0 BEADRP CC[C@H](C)C[NH2+][C@H]1CC[N@H+](CC)C[C@@H]1C ZINC000309220311 171287532 /nfs/dbraw/zinc/28/75/32/171287532.db2.gz VDABTMBQWNUWGD-AVGNSLFASA-N 2 0 212.381 2.352 20 0 BEADRP [NH3+]CCOCC[NH2+][C@@H]1CCCC12CCCCC2 ZINC000662294890 412084664 /nfs/dbraw/zinc/08/46/64/412084664.db2.gz GKBUVYNXNHSTBR-CYBMUJFWSA-N 2 0 240.391 2.054 20 0 BEADRP CC[C@H](C)[NH2+]CCCCn1ccnc1C ZINC000164666843 171340324 /nfs/dbraw/zinc/34/03/24/171340324.db2.gz WKFVIPSXGADKHY-NSHDSACASA-N 2 0 209.337 2.360 20 0 BEADRP CCCC[NH+]1CCC([C@@H]2CCC[NH2+]C2)CC1 ZINC000662290149 412079071 /nfs/dbraw/zinc/07/90/71/412079071.db2.gz LIFQUMBBTRBNAY-CQSZACIVSA-N 2 0 224.392 2.498 20 0 BEADRP CC[C@H](C)[C@@H](C)[NH2+]CCCC[NH+](C)C ZINC000045663730 171365089 /nfs/dbraw/zinc/36/50/89/171365089.db2.gz AAYZRUKGPNNXKR-NWDGAFQWSA-N 2 0 200.370 2.352 20 0 BEADRP FCCC[NH+]1CCC([C@@H]2CCC[NH2+]C2)CC1 ZINC000662291539 412082227 /nfs/dbraw/zinc/08/22/27/412082227.db2.gz HWHWDNKBLRQXIL-CYBMUJFWSA-N 2 0 228.355 2.058 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000037485310 171389056 /nfs/dbraw/zinc/38/90/56/171389056.db2.gz OZWIZDBLMKUSEG-AVGNSLFASA-N 2 0 224.392 2.495 20 0 BEADRP c1cc2c(cc1C[N@@H+]1CC[C@@H]3C[C@@H]3C1)C[NH2+]CC2 ZINC000662316000 412095935 /nfs/dbraw/zinc/09/59/35/412095935.db2.gz TZIIWYGXEYOSEH-GDBMZVCRSA-N 2 0 242.366 2.174 20 0 BEADRP C[C@@H]1CCC[N@H+](Cc2cccnc2)[C@@H]1CCC[NH3+] ZINC000662315711 412096841 /nfs/dbraw/zinc/09/68/41/412096841.db2.gz UWZYADQJWKELSJ-UKRRQHHQSA-N 2 0 247.386 2.421 20 0 BEADRP CCC[C@@H](C)[N@@H+]1CCO[C@H](CCC[NH+](C)C)C1 ZINC000662322714 412101579 /nfs/dbraw/zinc/10/15/79/412101579.db2.gz ILIBASPUKWGJOT-ZIAGYGMSSA-N 2 0 242.407 2.218 20 0 BEADRP CCC[C@H](C)[N@@H+]1CCO[C@@H](CCC[NH+](C)C)C1 ZINC000662322518 412101606 /nfs/dbraw/zinc/10/16/06/412101606.db2.gz ILIBASPUKWGJOT-KBPBESRZSA-N 2 0 242.407 2.218 20 0 BEADRP CC[C@H](C)CC[NH2+][C@H]1CC[NH2+]CC[C@H]1C ZINC000665238194 412178264 /nfs/dbraw/zinc/17/82/64/412178264.db2.gz SVKKCHKVNNVKOY-XQQFMLRXSA-N 2 0 212.381 2.400 20 0 BEADRP CC(C)[C@H]1CCCC[C@@H]1[NH2+][C@H]1CC[NH2+]C1 ZINC000665242748 412187596 /nfs/dbraw/zinc/18/75/96/412187596.db2.gz JHDLNWFINJHWCL-XQQFMLRXSA-N 2 0 210.365 2.153 20 0 BEADRP Cc1cc(C)cc(C[NH2+][C@H](C)C2C[NH2+]C2)c1 ZINC000665245953 412190870 /nfs/dbraw/zinc/19/08/70/412190870.db2.gz VOJWLXRAYQOCCD-GFCCVEGCSA-N 2 0 218.344 2.001 20 0 BEADRP C[C@H]([NH2+]CC1([NH3+])CCCC1)[C@H]1CC1(C)C ZINC000665246826 412191102 /nfs/dbraw/zinc/19/11/02/412191102.db2.gz OYYDGTODHTZNOX-WDEREUQCSA-N 2 0 210.365 2.282 20 0 BEADRP CC[C@H]([NH2+]CC1([NH3+])CCCC1)[C@@H]1C[C@@H]1C ZINC000665246424 412191414 /nfs/dbraw/zinc/19/14/14/412191414.db2.gz FLLBUJPWUDLUET-TUAOUCFPSA-N 2 0 210.365 2.282 20 0 BEADRP CC[C@@H]([NH2+]CC1([NH3+])CCCC1)C1CCC1 ZINC000665246990 412191636 /nfs/dbraw/zinc/19/16/36/412191636.db2.gz SKBHWUHOUCXVBA-GFCCVEGCSA-N 2 0 210.365 2.426 20 0 BEADRP CC[C@@H]([NH2+]CCC(C)(C)F)[C@@H]1CCC[NH2+]1 ZINC000665262311 412205175 /nfs/dbraw/zinc/20/51/75/412205175.db2.gz YHZGTWNAGKNKCL-MNOVXSKESA-N 2 0 216.344 2.245 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]C[C@@H]2CCC[C@@H]3C[C@@H]32)C1 ZINC000665264002 412206948 /nfs/dbraw/zinc/20/69/48/412206948.db2.gz ZZVJCLQLDTUAFN-BJJPWKGXSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@@H]1CCC[C@H](C[NH2+][C@H]2CCCCC[C@@H]2[NH3+])O1 ZINC000665264651 412207333 /nfs/dbraw/zinc/20/73/33/412207333.db2.gz FLQUQBLQPUOMLF-MQYQWHSLSA-N 2 0 240.391 2.194 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]C[C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000665263901 412207591 /nfs/dbraw/zinc/20/75/91/412207591.db2.gz XSTVZKVYYSQWCO-MRLBHPIUSA-N 2 0 236.403 2.400 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]C[C@@H]1CCC[C@H]2C[C@H]21 ZINC000665263900 412207940 /nfs/dbraw/zinc/20/79/40/412207940.db2.gz XSTVZKVYYSQWCO-FQKPHLNHSA-N 2 0 236.403 2.400 20 0 BEADRP C[C@H]1CCC[C@H](C[NH2+]C2CCC(C[NH3+])CC2)O1 ZINC000665265380 412208429 /nfs/dbraw/zinc/20/84/29/412208429.db2.gz WQQKZHSVXXUBPR-GFJIZPEISA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H]1CCC[C@H](C[NH2+]C2CCC(C[NH3+])CC2)O1 ZINC000665265379 412208547 /nfs/dbraw/zinc/20/85/47/412208547.db2.gz WQQKZHSVXXUBPR-BLYZHGLHSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H]1CCC[C@@H](C[NH2+]C2CCC(C[NH3+])CC2)O1 ZINC000665265381 412209184 /nfs/dbraw/zinc/20/91/84/412209184.db2.gz WQQKZHSVXXUBPR-RYSNWHEDSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@]1(CC[NH2+][C@@H]2CCC[C@H]2C[NH3+])CC1(F)F ZINC000665266820 412210437 /nfs/dbraw/zinc/21/04/37/412210437.db2.gz KIWVYMVKOIAFAC-AXFHLTTASA-N 2 0 232.318 2.139 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]C[C@@H]1C(C)(C)C1(F)F ZINC000665273815 412215592 /nfs/dbraw/zinc/21/55/92/412215592.db2.gz DRXQSZFSIMHKJJ-OUAUKWLOSA-N 2 0 246.345 2.255 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCCCC[C@@H]1[NH3+])c1ccccn1 ZINC000665231995 412168481 /nfs/dbraw/zinc/16/84/81/412168481.db2.gz CUYRDYAHPXDTEG-VNHYZAJKSA-N 2 0 247.386 2.435 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]CC1=CCCC1 ZINC000665273873 412216111 /nfs/dbraw/zinc/21/61/11/412216111.db2.gz FZLFKNMVHLDKMU-YPMHNXCESA-N 2 0 208.349 2.074 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]CC1=CCCC1 ZINC000665274167 412216686 /nfs/dbraw/zinc/21/66/86/412216686.db2.gz LHHOXQVAEMYHHW-QWHCGFSZSA-N 2 0 208.349 2.204 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]C1CCC2(CC2(F)F)CC1 ZINC000665274349 412216755 /nfs/dbraw/zinc/21/67/55/412216755.db2.gz OOJQBATTXPGHCJ-UPOSSJBDSA-N 2 0 244.329 2.424 20 0 BEADRP CC1(C)[C@H](C[NH2+][C@H]2CCCC[C@@H]2C[NH3+])C1(F)F ZINC000665274100 412216888 /nfs/dbraw/zinc/21/68/88/412216888.db2.gz JMOVZXYTSIZFRJ-VWYCJHECSA-N 2 0 246.345 2.385 20 0 BEADRP C[C@@H]([NH2+][C@H](C)C1CCC(F)CC1)C1C[NH2+]C1 ZINC000665274646 412217475 /nfs/dbraw/zinc/21/74/75/412217475.db2.gz VCXNTVYCGVGDMI-IXYVEGFRSA-N 2 0 228.355 2.101 20 0 BEADRP CC1(C)[C@H](C[NH2+][C@@H]2CCCC[C@@H]2C[NH3+])C1(F)F ZINC000665274099 412218049 /nfs/dbraw/zinc/21/80/49/412218049.db2.gz JMOVZXYTSIZFRJ-MXWKQRLJSA-N 2 0 246.345 2.385 20 0 BEADRP CO[C@H](C[NH2+][C@@H]1CCC[C@H]([NH3+])C1)C1CCCC1 ZINC000665275763 412219460 /nfs/dbraw/zinc/21/94/60/412219460.db2.gz RCBRABSKMWWZFP-BFHYXJOUSA-N 2 0 240.391 2.051 20 0 BEADRP CC(C)=CCC[C@@H](C)[NH2+]CC12CC(C1)C[NH2+]2 ZINC000665276791 412219685 /nfs/dbraw/zinc/21/96/85/412219685.db2.gz MWHAHHMMMUOZMZ-IYXRBSQSSA-N 2 0 222.376 2.463 20 0 BEADRP CC(C)(C)[C@@H]1CC[C@@H]1[NH2+]CC12CC(C1)C[NH2+]2 ZINC000665279531 412220912 /nfs/dbraw/zinc/22/09/12/412220912.db2.gz FSKGIXKNCCSKMZ-BEVNXUHPSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@@H]([NH2+]CC23CC(C2)C[NH2+]3)C1 ZINC000665279646 412222532 /nfs/dbraw/zinc/22/25/32/412222532.db2.gz IJEVFMARUQCIJN-IGYKFCIQSA-N 2 0 222.376 2.153 20 0 BEADRP FCCC[C@H]1CCC[C@H]1[NH2+]CC12CC(C1)C[NH2+]2 ZINC000665280059 412224299 /nfs/dbraw/zinc/22/42/99/412224299.db2.gz SBEFKJDMPIUPNG-CEUNDQEZSA-N 2 0 240.366 2.246 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+][C@@H](C)C1CCSCC1 ZINC000665281498 412225964 /nfs/dbraw/zinc/22/59/64/412225964.db2.gz FHILEGOUZKWITE-WCQYABFASA-N 2 0 244.448 2.481 20 0 BEADRP CO[C@H](C[NH2+][C@H](C)C[C@H](C)[NH3+])C1CCCCC1 ZINC000665284039 412228777 /nfs/dbraw/zinc/22/87/77/412228777.db2.gz ZKGQUJILDRGBID-OUCADQQQSA-N 2 0 242.407 2.297 20 0 BEADRP c1coc(CCC[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)c1 ZINC000665283721 412229969 /nfs/dbraw/zinc/22/99/69/412229969.db2.gz SWGFDKUNEMOIQW-HZSPNIEDSA-N 2 0 248.370 2.190 20 0 BEADRP COc1cccc(C[NH2+][C@H](C)C[C@@H](C)[NH3+])c1C ZINC000665294828 412241545 /nfs/dbraw/zinc/24/15/45/412241545.db2.gz XIGIGBULIMNYGX-GHMZBOCLSA-N 2 0 236.359 2.219 20 0 BEADRP CCC[C@H](C)[C@@H](CC)[NH2+][C@@H](C)C[NH2+]C ZINC000665296421 412242864 /nfs/dbraw/zinc/24/28/64/412242864.db2.gz SIENRVHIYJYHGP-SDDRHHMPSA-N 2 0 200.370 2.399 20 0 BEADRP C[NH2+]C[C@H](C)[NH2+][C@@H](C)C1C(C)(C)C1(C)C ZINC000665296708 412244981 /nfs/dbraw/zinc/24/49/81/412244981.db2.gz WZMOHBPTTIPVBM-UWVGGRQHSA-N 2 0 212.381 2.255 20 0 BEADRP C[NH2+]C[C@@H](C)[NH2+][C@@H]1CCCC12CCCC2 ZINC000665297306 412245216 /nfs/dbraw/zinc/24/52/16/412245216.db2.gz CXDBMLQYHYSNBZ-VXGBXAGGSA-N 2 0 210.365 2.297 20 0 BEADRP C[NH2+]C[C@H](C)[NH2+][C@H](C1CC1)C1CCCC1 ZINC000665298572 412246906 /nfs/dbraw/zinc/24/69/06/412246906.db2.gz YKPCYKYMMOPCOY-GWCFXTLKSA-N 2 0 210.365 2.153 20 0 BEADRP C[NH+](C)CCCC[NH2+]Cc1ccc(F)cc1 ZINC000045598352 172428917 /nfs/dbraw/zinc/42/89/17/172428917.db2.gz QSDWSXUECNSYHM-UHFFFAOYSA-N 2 0 224.323 2.257 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@H]2CCC23CCC3)CC1 ZINC000309679339 172987493 /nfs/dbraw/zinc/98/74/93/172987493.db2.gz YZGBDNZYDXCHPX-ZDUSSCGKSA-N 2 0 222.376 2.251 20 0 BEADRP Cn1cccc1C[N@@H+]1CCCC12CC[NH+](C)CC2 ZINC000336068395 173002816 /nfs/dbraw/zinc/00/28/16/173002816.db2.gz CTDSABNPCUOCMX-UHFFFAOYSA-N 2 0 247.386 2.085 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH2+]Cc2cccs2)CC1 ZINC000076673902 173020632 /nfs/dbraw/zinc/02/06/32/173020632.db2.gz AQGMTOYRBVOPJC-LLVKDONJSA-N 2 0 224.373 2.322 20 0 BEADRP CN1CCC[C@@H]([NH2+]CC2CCCCC2)C1 ZINC000040671788 173020713 /nfs/dbraw/zinc/02/07/13/173020713.db2.gz NYLVQMULNMSLSH-CYBMUJFWSA-N 2 0 210.365 2.251 20 0 BEADRP C[N@@H+]1CCC[C@@H]2C[NH+](CC3CCC3)CC[C@H]21 ZINC000336585048 173035680 /nfs/dbraw/zinc/03/56/80/173035680.db2.gz BIGZDHSREYJGTI-ZIAGYGMSSA-N 2 0 222.376 2.203 20 0 BEADRP C[N@@H+]1CCC[C@H]2C[NH+](C3CCCC3)CC[C@@H]21 ZINC000120117495 173060490 /nfs/dbraw/zinc/06/04/90/173060490.db2.gz PYGVYQQLMWTVOK-JSGCOSHPSA-N 2 0 222.376 2.345 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CCCCF)[C@@H]2CCC[C@H]21 ZINC000336763904 173152265 /nfs/dbraw/zinc/15/22/65/173152265.db2.gz MQQDKERDGRPLFF-RWMBFGLXSA-N 2 0 228.355 2.199 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]Cc2ccco2)[C@H]2CCC[C@H]21 ZINC000367619977 173152382 /nfs/dbraw/zinc/15/23/82/173152382.db2.gz XMQUOFYVMVJZKM-HZSPNIEDSA-N 2 0 234.343 2.242 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CCc2ccco2)[C@H]2CCC[C@@H]21 ZINC000353432130 173153400 /nfs/dbraw/zinc/15/34/00/173153400.db2.gz AQNCMAZFNAOPQE-ILXRZTDVSA-N 2 0 248.370 2.285 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CCC[C@@H]2F)[C@H]2CCC[C@@H]21 ZINC000340525606 173154099 /nfs/dbraw/zinc/15/40/99/173154099.db2.gz WVMNOXKPDVJCNZ-HTOAHKCRSA-N 2 0 240.366 2.339 20 0 BEADRP C[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2Cc2ccco2)C1 ZINC000290372141 173163328 /nfs/dbraw/zinc/16/33/28/173163328.db2.gz HMYDIICSMWIZDL-OCCSQVGLSA-N 2 0 234.343 2.196 20 0 BEADRP C[NH2+]CC1CC[NH+](CCCCCF)CC1 ZINC000336656162 173338283 /nfs/dbraw/zinc/33/82/83/173338283.db2.gz AGVDFWPSIQABLR-UHFFFAOYSA-N 2 0 216.344 2.058 20 0 BEADRP C[NH2+]CC1CC[NH+](Cc2ccc(C)cc2)CC1 ZINC000011889153 173338375 /nfs/dbraw/zinc/33/83/75/173338375.db2.gz PKFVOLOLWFRYNQ-UHFFFAOYSA-N 2 0 232.371 2.426 20 0 BEADRP C[NH2+]CC1CC[NH+]([C@@H](C)c2cccnc2)CC1 ZINC000063158784 173338569 /nfs/dbraw/zinc/33/85/69/173338569.db2.gz UZYXYCNZSDXXSM-LBPRGKRZSA-N 2 0 233.359 2.074 20 0 BEADRP C[NH2+]CCC1CC[NH+](Cc2ccc(C)nc2)CC1 ZINC000228858976 173342982 /nfs/dbraw/zinc/34/29/82/173342982.db2.gz SIMOUOWYDWOWNP-UHFFFAOYSA-N 2 0 247.386 2.212 20 0 BEADRP C[NH2+]CCC[N@H+](C)[C@@H](C)c1ccc(OC)cc1 ZINC000124777145 173346326 /nfs/dbraw/zinc/34/63/26/173346326.db2.gz DNPQAZSOXVYNGK-LBPRGKRZSA-N 2 0 236.359 2.298 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](Cc2cc(C)ccc2C)C1 ZINC000071142632 173370291 /nfs/dbraw/zinc/37/02/91/173370291.db2.gz XEUIYDIGGZWCKR-AWEZNQCLSA-N 2 0 232.371 2.345 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](C[C@H]2CCC[C@H](C)C2)C1 ZINC000251672424 173371087 /nfs/dbraw/zinc/37/10/87/173371087.db2.gz GNDJYIUWQFTCNE-IHRRRGAJSA-N 2 0 224.392 2.354 20 0 BEADRP C[NH2+]C[C@H]1CCC[N@H+](Cc2ccc(C)s2)C1 ZINC000040591682 173378468 /nfs/dbraw/zinc/37/84/68/173378468.db2.gz HGWQFXDDFBRTCP-GFCCVEGCSA-N 2 0 238.400 2.488 20 0 BEADRP C[NH2+]C[C@H]1CCC[N@@H+]1C[C@H](C)CC(C)C ZINC000300967070 173379629 /nfs/dbraw/zinc/37/96/29/173379629.db2.gz RPZLXPUGISVTFU-CHWSQXEVSA-N 2 0 212.381 2.352 20 0 BEADRP C[NH2+]C[C@H]1CC[N@H+](CCCC(C)(C)C)C1 ZINC000300886143 173380963 /nfs/dbraw/zinc/38/09/63/173380963.db2.gz PDQIULHKIQIYCF-GFCCVEGCSA-N 2 0 212.381 2.354 20 0 BEADRP C[NH2+]C[C@H]1CC[N@@H+]([C@H]2CCc3ccc(F)cc32)C1 ZINC000336578216 173381421 /nfs/dbraw/zinc/38/14/21/173381421.db2.gz XWAMORDMIVXZQN-ABAIWWIYSA-N 2 0 248.345 2.354 20 0 BEADRP C[NH2+]C[C@H]1CC[N@H+](Cc2ccc(OC)c(C)c2)C1 ZINC000071142502 173381579 /nfs/dbraw/zinc/38/15/79/173381579.db2.gz JPTRKFDCWTXOIS-CQSZACIVSA-N 2 0 248.370 2.045 20 0 BEADRP C[NH2+]C[C@H]1CC[N@H+](Cc2coc3ccccc23)C1 ZINC000131033155 173381916 /nfs/dbraw/zinc/38/19/16/173381916.db2.gz HPFWIPDSJIIIHT-GFCCVEGCSA-N 2 0 244.338 2.474 20 0 BEADRP C[NH2+]C[C@H]1CC[N@H+](C[C@H](C)CC(C)C)C1 ZINC000300965181 173382129 /nfs/dbraw/zinc/38/21/29/173382129.db2.gz RLIJABTYJGVGLW-CHWSQXEVSA-N 2 0 212.381 2.210 20 0 BEADRP C[NH2+]C[C@H]1CC[N@H+](C[C@@H](C)c2ccccc2)C1 ZINC000071142562 173382303 /nfs/dbraw/zinc/38/23/03/173382303.db2.gz GCKDVGNWRPGYLR-ZIAGYGMSSA-N 2 0 232.371 2.331 20 0 BEADRP COC1(C[NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)CCCC1 ZINC000336655249 174004482 /nfs/dbraw/zinc/00/44/82/174004482.db2.gz JCVRGXFDFNAUSM-OLZOCXBDSA-N 2 0 240.391 2.018 20 0 BEADRP COCCC(C)(C)C[NH2+][C@@H]1CCCC[C@H]1C[NH3+] ZINC000234682677 174143462 /nfs/dbraw/zinc/14/34/62/174143462.db2.gz AGCYRJWHSURBTJ-QWHCGFSZSA-N 2 0 242.407 2.156 20 0 BEADRP COCCC(C)(C)C[NH2+][C@H]1CCCC[C@H]1C[NH3+] ZINC000234690685 174143866 /nfs/dbraw/zinc/14/38/66/174143866.db2.gz AGCYRJWHSURBTJ-STQMWFEESA-N 2 0 242.407 2.156 20 0 BEADRP COCCC(C)(C)C[NH2+][C@H]1CCCC[C@@H]1C[NH3+] ZINC000234690417 174144002 /nfs/dbraw/zinc/14/40/02/174144002.db2.gz AGCYRJWHSURBTJ-OLZOCXBDSA-N 2 0 242.407 2.156 20 0 BEADRP COCCCCC[NH+]1CCC([NH2+]C(C)C)CC1 ZINC000116878591 174177623 /nfs/dbraw/zinc/17/76/23/174177623.db2.gz ACRMNQMPMVQIFY-UHFFFAOYSA-N 2 0 242.407 2.266 20 0 BEADRP COCCCCC[N@@H+]1CCCC[C@H]1CC[NH3+] ZINC000352496517 174178233 /nfs/dbraw/zinc/17/82/33/174178233.db2.gz WWYNKQLWEPMRGG-ZDUSSCGKSA-N 2 0 228.380 2.006 20 0 BEADRP COCC[C@@H]1CCC[C@@H]1[NH2+]CCCC[NH+](C)C ZINC000337500028 174396130 /nfs/dbraw/zinc/39/61/30/174396130.db2.gz AOKMYXNIOAUHRT-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP COCC[C@@H]1CCC[C@H]1[NH2+]CCN(C)C(C)C ZINC000337387142 174397560 /nfs/dbraw/zinc/39/75/60/174397560.db2.gz IKSQIMOABMDTBV-UONOGXRCSA-N 2 0 242.407 2.121 20 0 BEADRP COC[C@H]([NH2+]C1CCC([NH3+])CC1)c1ccccc1 ZINC000234730870 174578878 /nfs/dbraw/zinc/57/88/78/174578878.db2.gz IKLHGQBNXHOCGD-NRXISQOPSA-N 2 0 248.370 2.234 20 0 BEADRP COc1ccc(C)cc1C[N@@H+]1CCC[C@H](C[NH3+])C1 ZINC000044530035 175074427 /nfs/dbraw/zinc/07/44/27/175074427.db2.gz IYAXYRIEBWOIBS-CYBMUJFWSA-N 2 0 248.370 2.174 20 0 BEADRP COc1ccc(C)cc1C[N@@H+]1CC[C@@H]([C@@H](C)[NH3+])C1 ZINC000163209928 175074536 /nfs/dbraw/zinc/07/45/36/175074536.db2.gz ZKKNUYLSCFVGML-CHWSQXEVSA-N 2 0 248.370 2.173 20 0 BEADRP COc1ccc(C[NH2+][C@@H](C)CCCC[NH3+])cc1 ZINC000310228654 175109114 /nfs/dbraw/zinc/10/91/14/175109114.db2.gz HEGHSJKNJGHKPY-LBPRGKRZSA-N 2 0 236.359 2.302 20 0 BEADRP COc1ccc(C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)cc1 ZINC000093209642 175109840 /nfs/dbraw/zinc/10/98/40/175109840.db2.gz DIOOHLZCSWWPID-CHWSQXEVSA-N 2 0 234.343 2.055 20 0 BEADRP COc1ccc(C[NH2+][C@H](C)CCCC[NH3+])cc1 ZINC000310228653 175111046 /nfs/dbraw/zinc/11/10/46/175111046.db2.gz HEGHSJKNJGHKPY-GFCCVEGCSA-N 2 0 236.359 2.302 20 0 BEADRP COc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[NH2+]C2)cc1 ZINC000107786853 175188584 /nfs/dbraw/zinc/18/85/84/175188584.db2.gz CNNVLLABCHYLHR-QWHCGFSZSA-N 2 0 248.370 2.345 20 0 BEADRP COc1ccc([C@H](C)[NH2+][C@H]2CCC[C@@H]2C[NH3+])cc1 ZINC000090339650 175190202 /nfs/dbraw/zinc/19/02/02/175190202.db2.gz IVPAUBUHIADKKF-LNSITVRQSA-N 2 0 248.370 2.473 20 0 BEADRP COc1cccc(C[NH2+]CCCC[NH+](C)C)c1 ZINC000045598368 175264884 /nfs/dbraw/zinc/26/48/84/175264884.db2.gz UTIPSBWCORUBOA-UHFFFAOYSA-N 2 0 236.359 2.127 20 0 BEADRP COc1cccc(C[NH2+][C@H]2CCC[C@H]([NH3+])C2)c1 ZINC000093214542 175268236 /nfs/dbraw/zinc/26/82/36/175268236.db2.gz SSJFJUWKCOAKFB-STQMWFEESA-N 2 0 234.343 2.055 20 0 BEADRP COc1cccc([C@@H](C)[NH2+][C@@H](C)CCC[NH3+])c1 ZINC000310389105 175287461 /nfs/dbraw/zinc/28/74/61/175287461.db2.gz KRXYRVFLWTXHOL-NWDGAFQWSA-N 2 0 236.359 2.473 20 0 BEADRP COc1cccc([C@@H](C)[NH2+][C@H](C)CCC[NH3+])c1 ZINC000310389106 175287988 /nfs/dbraw/zinc/28/79/88/175287988.db2.gz KRXYRVFLWTXHOL-VXGBXAGGSA-N 2 0 236.359 2.473 20 0 BEADRP COc1cccc([C@H](C)[N@@H+]2CC[C@@H]([NH3+])[C@@H](C)C2)c1 ZINC000227056241 175292252 /nfs/dbraw/zinc/29/22/52/175292252.db2.gz VKZRCAVKEOWNQG-SLEUVZQESA-N 2 0 248.370 2.425 20 0 BEADRP COc1cccc([C@H](C)[N@@H+]2CC[C@H]([C@@H](C)[NH3+])C2)c1 ZINC000163200163 175292315 /nfs/dbraw/zinc/29/23/15/175292315.db2.gz HLUMIFWZKIFFGL-DYEKYZERSA-N 2 0 248.370 2.425 20 0 BEADRP COc1cccc([C@H](C)[NH2+][C@@H](C)CCC[NH3+])c1 ZINC000310514711 175293634 /nfs/dbraw/zinc/29/36/34/175293634.db2.gz KRXYRVFLWTXHOL-RYUDHWBXSA-N 2 0 236.359 2.473 20 0 BEADRP COc1ccccc1C[N@@H+]1CCC[C@@H]([C@H](C)[NH3+])C1 ZINC000113655513 175328324 /nfs/dbraw/zinc/32/83/24/175328324.db2.gz KWZVMWUXGYEKGM-QWHCGFSZSA-N 2 0 248.370 2.254 20 0 BEADRP COc1ccccc1[C@H](C)[NH2+]CC1CC[NH2+]CC1 ZINC000094009539 175350815 /nfs/dbraw/zinc/35/08/15/175350815.db2.gz PORUBJCIYQFLAY-LBPRGKRZSA-N 2 0 248.370 2.345 20 0 BEADRP CS[C@@H]1CC[C@H]1[NH2+]C1CCC([NH+](C)C)CC1 ZINC000336721718 175551737 /nfs/dbraw/zinc/55/17/37/175551737.db2.gz ZZNZWYQSQVQUMX-FIYWTHMPSA-N 2 0 242.432 2.343 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]C[C@H]1CCCC(C)(C)C1 ZINC000556932267 322931404 /nfs/dbraw/zinc/93/14/04/322931404.db2.gz NEOSOOUHKHOTIB-NEPJUHHUSA-N 2 0 212.381 2.387 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]CCCN(C)c1ccccc1 ZINC000336792174 175664834 /nfs/dbraw/zinc/66/48/34/175664834.db2.gz QWVNDRNVCWVWLI-AWEZNQCLSA-N 2 0 249.402 2.230 20 0 BEADRP C[C@@H](c1ccccc1)[N@@H+]1CCC[C@@H](C[NH3+])C1 ZINC000114410053 176021286 /nfs/dbraw/zinc/02/12/86/176021286.db2.gz NVTLGACRAYICGY-STQMWFEESA-N 2 0 218.344 2.418 20 0 BEADRP C[C@@H](c1ccccc1F)[N@@H+]1CC[C@H](C[NH3+])C1 ZINC000049530940 176025289 /nfs/dbraw/zinc/02/52/89/176025289.db2.gz DCZNYNSJWHXWJD-WDEREUQCSA-N 2 0 222.307 2.167 20 0 BEADRP C[C@@H](c1ccccn1)[N@@H+]1CC[C@@H](C)[C@@H](C[NH3+])C1 ZINC000163484347 176027979 /nfs/dbraw/zinc/02/79/79/176027979.db2.gz PGNPCXMABTXDFZ-AGIUHOORSA-N 2 0 233.359 2.059 20 0 BEADRP C[C@@H]([NH3+])C1CC[NH+]([C@@H](C)c2cccnc2)CC1 ZINC000110643851 176028906 /nfs/dbraw/zinc/02/89/06/176028906.db2.gz CBINASZVGXFCBM-NEPJUHHUSA-N 2 0 233.359 2.202 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[N@@H+]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000357045038 176076483 /nfs/dbraw/zinc/07/64/83/176076483.db2.gz HMEVJWXMEMXBFD-TUVASFSCSA-N 2 0 236.403 2.354 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]CC2CC[NH+](C)CC2)C1 ZINC000044515365 176123185 /nfs/dbraw/zinc/12/31/85/176123185.db2.gz ZSHWUEAKMWSPOC-TZMCWYRMSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+]CC1=CC[N@H+](C)CC1 ZINC000335604331 176130923 /nfs/dbraw/zinc/13/09/23/176130923.db2.gz WYQKMICPHZGGRJ-YPMHNXCESA-N 2 0 208.349 2.027 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]Cc2cnc[nH]2)[C@@H]1C ZINC000054763359 176144127 /nfs/dbraw/zinc/14/41/27/176144127.db2.gz CAGJPCCRFKAEFN-FOGDFJRCSA-N 2 0 207.321 2.324 20 0 BEADRP C[C@H](c1ccccn1)[N@@H+]1CC[C@@H](C)[C@@H](C[NH3+])C1 ZINC000229066915 176180694 /nfs/dbraw/zinc/18/06/94/176180694.db2.gz PGNPCXMABTXDFZ-UPJWGTAASA-N 2 0 233.359 2.059 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CCC[C@H]2CCC[NH2+]2)C1 ZINC000308979406 176212502 /nfs/dbraw/zinc/21/25/02/176212502.db2.gz HQOQAWNRKJXHMO-JHJVBQTASA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@]2(C)CCC[NH2+]C2)C1 ZINC000129451757 176233435 /nfs/dbraw/zinc/23/34/35/176233435.db2.gz GKFHYUGQQKIDFD-FRRDWIJNSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]CC1(C2CC2)CCC1 ZINC000358351120 176269421 /nfs/dbraw/zinc/26/94/21/176269421.db2.gz JWINGNHVDHBKRN-TZMCWYRMSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]CCc1ccco1 ZINC000036908627 176278309 /nfs/dbraw/zinc/27/83/09/176278309.db2.gz WUWZQZXYEXMLPH-BZPMIXESSA-N 2 0 236.359 2.140 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]CCC1(C)CC1 ZINC000309767176 176279068 /nfs/dbraw/zinc/27/90/68/176279068.db2.gz JRPIXFPFXLUVHB-JHJVBQTASA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]C[C@@H]1CC1(C)C ZINC000300359328 176279143 /nfs/dbraw/zinc/27/91/43/176279143.db2.gz OHJGLPWHFQIFKO-NDBYEHHHSA-N 2 0 224.392 2.351 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]C[C@H]1CC1(C)C ZINC000300359325 176281021 /nfs/dbraw/zinc/28/10/21/176281021.db2.gz OHJGLPWHFQIFKO-FDYHWXHSSA-N 2 0 224.392 2.351 20 0 BEADRP C[C@@H]1C[N@H+](CC[C@@H]2CCC[NH2+]C2)C(C)(C)C1 ZINC000335664604 176293134 /nfs/dbraw/zinc/29/31/34/176293134.db2.gz UIYFUXVTSOJEHF-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[C@@H](C)[C@@H](C)[N@H+](CC2CC[NH2+]CC2)C1 ZINC000229421062 176365991 /nfs/dbraw/zinc/36/59/91/176365991.db2.gz DYOKXNYRPWMRNI-JHJVBQTASA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@H+](CCC[NH3+])CC1CCCC1 ZINC000352539482 176391644 /nfs/dbraw/zinc/39/16/44/176391644.db2.gz BCUPORVVHDLWTI-TZMCWYRMSA-N 2 0 224.392 2.483 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CC1C(C)(C)C1(C)C ZINC000308983242 176620111 /nfs/dbraw/zinc/62/01/11/176620111.db2.gz FSWZSISNWUEMGA-SNVBAGLBSA-N 2 0 212.381 2.386 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CCc1cccc(F)c1 ZINC000336668959 176620376 /nfs/dbraw/zinc/62/03/76/176620376.db2.gz RBQPJAGUVSWVQT-LLVKDONJSA-N 2 0 224.323 2.085 20 0 BEADRP C[C@H](C[NH+]1CCC([NH3+])CC1)c1ccccc1 ZINC000040240923 176664552 /nfs/dbraw/zinc/66/45/52/176664552.db2.gz SKVZZWBTPAMAJC-GFCCVEGCSA-N 2 0 218.344 2.213 20 0 BEADRP C[C@@H]([NH2+]C1CCC([NH3+])CC1)c1ccoc1 ZINC000087290153 487635828 /nfs/dbraw/zinc/63/58/28/487635828.db2.gz SINSLDMRTOLDBU-OIKLOGQESA-N 2 0 208.305 2.200 20 0 BEADRP C[C@H](c1ccccc1)[NH+]1CCC(C[NH3+])CC1 ZINC000044511694 177038928 /nfs/dbraw/zinc/03/89/28/177038928.db2.gz NXCMPFSESDRDOU-GFCCVEGCSA-N 2 0 218.344 2.418 20 0 BEADRP C[C@H](c1ccccn1)[N@H+](C)CC1CC[NH2+]CC1 ZINC000094011046 177043000 /nfs/dbraw/zinc/04/30/00/177043000.db2.gz KLJIBVNLPWHNNS-GFCCVEGCSA-N 2 0 233.359 2.074 20 0 BEADRP C[C@H]1CCC[C@@H]1[NH2+]C1CCC(C[NH3+])CC1 ZINC000335046133 177125683 /nfs/dbraw/zinc/12/56/83/177125683.db2.gz ZSCWNVGPPUHOEK-WTIISPKJSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]1CCC[C@H]1[NH2+]CC1=CC[N@H+](C)CC1 ZINC000335604329 177141970 /nfs/dbraw/zinc/14/19/70/177141970.db2.gz WYQKMICPHZGGRJ-WCQYABFASA-N 2 0 208.349 2.027 20 0 BEADRP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]CCC1(C)CC1 ZINC000336763770 177233704 /nfs/dbraw/zinc/23/37/04/177233704.db2.gz PNIBBQFTASDSIT-NWDGAFQWSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CCC(C)(F)F)CC[N@@H+]1C ZINC000357715628 177330667 /nfs/dbraw/zinc/33/06/67/177330667.db2.gz YFXHLOLOXMWKNZ-UWVGGRQHSA-N 2 0 220.307 2.104 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]CCC1(C)CC1 ZINC000309767174 177330804 /nfs/dbraw/zinc/33/08/04/177330804.db2.gz JRPIXFPFXLUVHB-FRRDWIJNSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CCC[NH+](C)C)C[C@@H]1C ZINC000082835947 177330854 /nfs/dbraw/zinc/33/08/54/177330854.db2.gz HZVHIPHFEIJXIH-AGIUHOORSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]C1CC(F)(F)C1 ZINC000336781419 177330942 /nfs/dbraw/zinc/33/09/42/177330942.db2.gz UPZKXKVCIPUXBL-WCABBAIRSA-N 2 0 232.318 2.102 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@@H]2CCC[NH2+]2)C[C@@H]1C ZINC000235331411 177331718 /nfs/dbraw/zinc/33/17/18/177331718.db2.gz WFELSUDSWVFUSN-VOAKCMCISA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]1C[C@@H]1C[N@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000348869823 177342676 /nfs/dbraw/zinc/34/26/76/177342676.db2.gz PLSOTKJEAXKTNY-IZXDZPFWSA-N 2 0 222.376 2.199 20 0 BEADRP C[C@H]1C[C@@H]1C[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000309793530 177344636 /nfs/dbraw/zinc/34/46/36/177344636.db2.gz PRIYQOQKXAXYEY-NWDGAFQWSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@H](C[NH2+]C[C@H]1C[C@@H]1C)C[NH+]1CCCCC1 ZINC000309740512 177345614 /nfs/dbraw/zinc/34/56/14/177345614.db2.gz HPMAKNMFHDYIJA-HZSPNIEDSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@H]1C[C@@H]1C[NH2+]Cc1ccc(C[NH+](C)C)cc1 ZINC000340173136 177345666 /nfs/dbraw/zinc/34/56/66/177345666.db2.gz DHFCSXUJOLOFSA-SWLSCSKDSA-N 2 0 232.371 2.494 20 0 BEADRP C[C@H]1C[C@H]([NH3+])CC[N@@H+]1CCC1CCCC1 ZINC000049713044 177365149 /nfs/dbraw/zinc/36/51/49/177365149.db2.gz OCGLWQCRBLRXMP-WCQYABFASA-N 2 0 210.365 2.378 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CCCc2ccccn2)CC[N@@H+]1C ZINC000181493606 177369281 /nfs/dbraw/zinc/36/92/81/177369281.db2.gz CUCFFOIDOBUUEB-DZGCQCFKSA-N 2 0 247.386 2.087 20 0 BEADRP C[C@H]1C[C@H]([NH2+]Cc2ccccc2)CC[N@@H+]1C ZINC000073655697 177370621 /nfs/dbraw/zinc/37/06/21/177370621.db2.gz KZTLAVPYGULHBC-GXTWGEPZSA-N 2 0 218.344 2.259 20 0 BEADRP CC(C)OC[C@@H](C)[NH2+]C[C@H]1CC[N@@H+](C(C)C)C1 ZINC000669680749 487644039 /nfs/dbraw/zinc/64/40/39/487644039.db2.gz HYWARZBBPNYRDY-ZIAGYGMSSA-N 2 0 242.407 2.120 20 0 BEADRP C[NH+](C)CCCC[NH2+]C/C=C\c1ccncc1 ZINC000486937925 225274075 /nfs/dbraw/zinc/27/40/75/225274075.db2.gz MGEJLTUHNUWTAG-WAYWQWQTSA-N 2 0 233.359 2.026 20 0 BEADRP C[C@H]([NH2+]CC1(C)CCCC1)[C@@H]1CCC[NH2+]1 ZINC000400422271 225245692 /nfs/dbraw/zinc/24/56/92/225245692.db2.gz XIRJLEUSBKHJRM-RYUDHWBXSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1C[C@H]1C[N@@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000488352454 225382719 /nfs/dbraw/zinc/38/27/19/225382719.db2.gz NVTPFPNJCWPNTO-SNPRPXQTSA-N 2 0 236.403 2.306 20 0 BEADRP C[C@H]([NH2+]C[C@]1(C)CCCS1)[C@H]1CCC[NH2+]1 ZINC000400579514 226346660 /nfs/dbraw/zinc/34/66/60/226346660.db2.gz QGUVFBCZRQGKST-TUAOUCFPSA-N 2 0 228.405 2.002 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)c1cccnc1 ZINC000401010794 226352702 /nfs/dbraw/zinc/35/27/02/226352702.db2.gz MGGWVYSVUITLCE-SPWCGHHHSA-N 2 0 245.370 2.120 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)[C@@H]1CC1(C)C ZINC000401171452 226353201 /nfs/dbraw/zinc/35/32/01/226353201.db2.gz WXRWJAAEBLVMLT-MRTXSQPYSA-N 2 0 236.403 2.399 20 0 BEADRP C[C@@H]1CN(C)C[C@H]1[NH2+]Cc1cccc2[nH]ccc21 ZINC000674912610 487653477 /nfs/dbraw/zinc/65/34/77/487653477.db2.gz JQELBKSYRJLUQO-IAQYHMDHSA-N 2 0 243.354 2.208 20 0 BEADRP Cc1cccc([C@@H](C)[NH2+]C[C@H](C)C[NH3+])c1 ZINC000309007999 229297872 /nfs/dbraw/zinc/29/78/72/229297872.db2.gz VKAHROZEMLYNSW-VXGBXAGGSA-N 2 0 206.333 2.240 20 0 BEADRP Cc1cccc([C@H](C)N[C@H](C)[C@@H](C)[NH3+])c1 ZINC000309120136 229360668 /nfs/dbraw/zinc/36/06/68/229360668.db2.gz SVHSMZDENDYQCY-UTUOFQBUSA-N 2 0 206.333 2.381 20 0 BEADRP C[C@H](C[N@@H+]1CC[C@H]([NH3+])[C@H](C)C1)C(C)(C)C ZINC000162967762 487675530 /nfs/dbraw/zinc/67/55/30/487675530.db2.gz VLHMVHRYGDRJCN-UTUOFQBUSA-N 2 0 212.381 2.338 20 0 BEADRP CCCCCC[C@@H](CCCC)[NH2+]C[C@H](O)C[NH3+] ZINC001172510517 974865865 /nfs/dbraw/zinc/86/58/65/974865865.db2.gz DPTTUBHYIYECGO-ZIAGYGMSSA-N 2 0 244.423 2.425 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]CC1CCCCCC1 ZINC000414838094 487693232 /nfs/dbraw/zinc/69/32/32/487693232.db2.gz KUBAAHHJLKPTTM-LBPRGKRZSA-N 2 0 212.381 2.402 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)[C@@H]1C[C@H]1C1CC1 ZINC000527636766 262868017 /nfs/dbraw/zinc/86/80/17/262868017.db2.gz DPTFUOZMFVDAFT-MPTQWLOMSA-N 2 0 248.414 2.495 20 0 BEADRP CCC[C@H](C[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1)OCC ZINC000527934706 262896591 /nfs/dbraw/zinc/89/65/91/262896591.db2.gz SZSVQYPRCSWBCR-MELADBBJSA-N 2 0 242.407 2.264 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]C[C@H]1CCC[C@@H](C)C1 ZINC000414851159 487710295 /nfs/dbraw/zinc/71/02/95/487710295.db2.gz OQANYDUFWXNJIL-AGIUHOORSA-N 2 0 212.381 2.258 20 0 BEADRP CC(C)(CC[N@@H+]1CCC[C@@H]([NH3+])C1)C1CC1 ZINC000328573718 487716536 /nfs/dbraw/zinc/71/65/36/487716536.db2.gz WDIRIWGXBIJBOU-GFCCVEGCSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@H]2CCC[C@@H]21)C1CC1 ZINC000671743656 487718662 /nfs/dbraw/zinc/71/86/62/487718662.db2.gz GRRBHUQTUIWGHG-NGFQHRJXSA-N 2 0 236.403 2.495 20 0 BEADRP CC[C@H]1C[N@H+](CCOCCC(C)C)CC[C@H]1[NH3+] ZINC000251583893 487772123 /nfs/dbraw/zinc/77/21/23/487772123.db2.gz CLAJCXVFQVBKOT-UONOGXRCSA-N 2 0 242.407 2.108 20 0 BEADRP C[C@@H]1C[C@H]([NH3+])CC[N@@H+]1CCC1CCCC1 ZINC000049713043 487777205 /nfs/dbraw/zinc/77/72/05/487777205.db2.gz OCGLWQCRBLRXMP-DGCLKSJQSA-N 2 0 210.365 2.378 20 0 BEADRP CC[C@@H]1CCC[N@H+](C[C@H]2CC[NH2+]C2)CC1 ZINC000251725278 487792608 /nfs/dbraw/zinc/79/26/08/487792608.db2.gz KDPTYCOQBZDIDX-OLZOCXBDSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1)c1ccncc1 ZINC000675926987 487793381 /nfs/dbraw/zinc/79/33/81/487793381.db2.gz KAAQCZPAILROKT-NFAWXSAZSA-N 2 0 247.386 2.257 20 0 BEADRP C[N@@H+]1CCC[C@H](CC[NH2+][C@H]2CC[C@@H]2C2CC2)C1 ZINC000459799675 487800629 /nfs/dbraw/zinc/80/06/29/487800629.db2.gz YVRRDOGOSXHFLN-YUELXQCFSA-N 2 0 236.403 2.497 20 0 BEADRP CC[C@@]1(C)CCC[C@@H]1[NH2+]CCC[NH+](C)C ZINC000651666855 487813147 /nfs/dbraw/zinc/81/31/47/487813147.db2.gz QFRWGWIOGRAXRG-STQMWFEESA-N 2 0 212.381 2.497 20 0 BEADRP CC[C@@]1(C)CCC[C@H]1[NH2+]CCC[NH+](C)C ZINC000651666853 487813000 /nfs/dbraw/zinc/81/30/00/487813000.db2.gz QFRWGWIOGRAXRG-OLZOCXBDSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@H](c1ccncc1)[N@@H+]1CC[C@@H](C)[C@@H](C[NH3+])C1 ZINC000229066935 487813504 /nfs/dbraw/zinc/81/35/04/487813504.db2.gz JYLRZAJAQQIHCS-BZPMIXESSA-N 2 0 233.359 2.059 20 0 BEADRP CC[C@@H](C)[N@H+](CC)CC[C@@H]1CCC[NH2+]C1 ZINC000051918978 487817355 /nfs/dbraw/zinc/81/73/55/487817355.db2.gz OSROTPFDVIGAMR-OLZOCXBDSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H]1CC[N@H+](CC[C@@H]2CCC[NH2+]C2)[C@H](C)C1 ZINC000051919699 487817370 /nfs/dbraw/zinc/81/73/70/487817370.db2.gz WAEQMMVZWAVTNX-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP [NH3+]CCC[NH2+]C1(c2ccccc2)CCCC1 ZINC000414707509 487818631 /nfs/dbraw/zinc/81/86/31/487818631.db2.gz MQLJZYGCHRWNBV-UHFFFAOYSA-N 2 0 218.344 2.394 20 0 BEADRP Cc1cc(C)cc([C@@H]2CC[N@H+](CCC[NH3+])C2)c1 ZINC000414716677 487819029 /nfs/dbraw/zinc/81/90/29/487819029.db2.gz SNFQKYTYAWCTGM-CQSZACIVSA-N 2 0 232.371 2.442 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCCC[C@H]1C[NH3+])C1CC1 ZINC000252910326 487837550 /nfs/dbraw/zinc/83/75/50/487837550.db2.gz CQAWMUIBBGEBEE-WXHSDQCUSA-N 2 0 210.365 2.140 20 0 BEADRP C[C@H](C[NH2+]CCC[NH3+])c1ccc(F)cc1F ZINC000415099671 487837085 /nfs/dbraw/zinc/83/70/85/487837085.db2.gz GYIATNFOQMWSQW-SECBINFHSA-N 2 0 228.286 2.007 20 0 BEADRP C[C@H]([NH2+]C1CC(C)(C)C1)C1CC[NH+](C)CC1 ZINC000395184292 487842037 /nfs/dbraw/zinc/84/20/37/487842037.db2.gz QGLOKSJJIOXIHA-NSHDSACASA-N 2 0 224.392 2.495 20 0 BEADRP CC(C)[C@H](C)[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000401141578 528971654 /nfs/dbraw/zinc/97/16/54/528971654.db2.gz GXMFZNZDBKDRQO-UMSGYPCISA-N 2 0 210.365 2.009 20 0 BEADRP CCc1ccc(C[NH2+][C@H]2CC[NH2+]C[C@H]2C)s1 ZINC000309331796 487867480 /nfs/dbraw/zinc/86/74/80/487867480.db2.gz IYPGJGPJIAKXAB-MFKMUULPSA-N 2 0 238.400 2.398 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+]C[C@H]1CCOc2ccccc21 ZINC000666741418 487869688 /nfs/dbraw/zinc/86/96/88/487869688.db2.gz QSSFMGHPVYOZOY-TZMCWYRMSA-N 2 0 248.370 2.126 20 0 BEADRP Cc1ccc(F)cc1C[NH2+][C@H]1CCC[NH2+]CC1 ZINC000666856545 487890272 /nfs/dbraw/zinc/89/02/72/487890272.db2.gz OVOUAKDLOYLRAP-AWEZNQCLSA-N 2 0 236.334 2.366 20 0 BEADRP Cc1cc(C[NH2+][C@H]2CC23CC[NH2+]CC3)ccc1F ZINC000666952381 487890916 /nfs/dbraw/zinc/89/09/16/487890916.db2.gz URWSUOQBLFSTID-AWEZNQCLSA-N 2 0 248.345 2.366 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)C1CCC1 ZINC000666993715 487901955 /nfs/dbraw/zinc/90/19/55/487901955.db2.gz GCICGJIIJAOKGT-YPMHNXCESA-N 2 0 222.376 2.439 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C1C[C@H](C)O[C@@H](C)C1 ZINC000666936659 487907774 /nfs/dbraw/zinc/90/77/74/487907774.db2.gz VYBXUTOBQPQUJF-WOPDTQHZSA-N 2 0 228.380 2.050 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+][C@@H]2CC23CC[NH2+]CC3)C1 ZINC000666954074 487915975 /nfs/dbraw/zinc/91/59/75/487915975.db2.gz PCQXMQXUNNQPLT-JHJVBQTASA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC12CC[NH2+]CC2)C(C)(C)C ZINC000666955496 487916534 /nfs/dbraw/zinc/91/65/34/487916534.db2.gz RLNXLVHHFXDDBJ-VXGBXAGGSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H]1CCC[N@H+](Cc2cccc(O)c2)[C@H]1CC[NH3+] ZINC000404294064 487917135 /nfs/dbraw/zinc/91/71/35/487917135.db2.gz MROAIQNFCHFBPZ-WFASDCNBSA-N 2 0 248.370 2.342 20 0 BEADRP C[C@H](CC1CCC1)[NH2+][C@H]1CC[C@@H](C[NH3+])C1 ZINC000666963979 487919957 /nfs/dbraw/zinc/91/99/57/487919957.db2.gz UNEIISCTHULNNJ-RTXFEEFZSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)(C)C[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000666998368 487924684 /nfs/dbraw/zinc/92/46/84/487924684.db2.gz PSLOJAMSIMGNOT-LLVKDONJSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1CCC[C@H]1[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000666995572 487924813 /nfs/dbraw/zinc/92/48/13/487924813.db2.gz SHPPVWJEGYJTOH-FRRDWIJNSA-N 2 0 222.376 2.439 20 0 BEADRP C[C@H]([NH3+])CN1CCc2ccc(F)cc2[C@@H](C)C1 ZINC000652363293 487933409 /nfs/dbraw/zinc/93/34/09/487933409.db2.gz ACBPZOJQYCIBOG-QWRGUYRKSA-N 2 0 236.334 2.135 20 0 BEADRP C(C1CCC1)[N@@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]2)C1 ZINC000083839908 487942039 /nfs/dbraw/zinc/94/20/39/487942039.db2.gz YMTNIUSCZAGENU-KGLIPLIRSA-N 2 0 222.376 2.251 20 0 BEADRP [NH3+]Cc1ccc(C[NH2+][C@H]2CC[C@@H]2C2CC2)cc1 ZINC000564729926 323011892 /nfs/dbraw/zinc/01/18/92/323011892.db2.gz VYUMOEKDWROAKQ-CABCVRRESA-N 2 0 230.355 2.424 20 0 BEADRP CC1(C[N@@H+]2CC[C@@H](Oc3ccncc3)C2)CC1 ZINC000562427437 323019671 /nfs/dbraw/zinc/01/96/71/323019671.db2.gz SKTVYCOVFZZFEH-CYBMUJFWSA-N 2 0 232.327 2.335 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000562860787 323032174 /nfs/dbraw/zinc/03/21/74/323032174.db2.gz IPAPRUBREFIBSG-UONOGXRCSA-N 2 0 247.386 2.382 20 0 BEADRP Cc1ccncc1[C@@H](C)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000562860786 323032248 /nfs/dbraw/zinc/03/22/48/323032248.db2.gz IPAPRUBREFIBSG-KGLIPLIRSA-N 2 0 247.386 2.382 20 0 BEADRP Cc1nc([C@@H](C)[NH2+]CC2CC[NH2+]CC2)cs1 ZINC000567638908 323034304 /nfs/dbraw/zinc/03/43/04/323034304.db2.gz VEDOBXJFZDXZME-SECBINFHSA-N 2 0 239.388 2.102 20 0 BEADRP C([NH2+][C@H]1CCC12CCCC2)C1CC[NH2+]CC1 ZINC000562956404 323034796 /nfs/dbraw/zinc/03/47/96/323034796.db2.gz ZYKDRIUPLPVURY-ZDUSSCGKSA-N 2 0 222.376 2.298 20 0 BEADRP C[C@@H]1C[C@H](C)[N@H+](C[C@H]2CCSC2)C[C@@H]1C[NH3+] ZINC000397252917 323043071 /nfs/dbraw/zinc/04/30/71/323043071.db2.gz DHOZJYSHRXSKHC-XQHKEYJVSA-N 2 0 242.432 2.045 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCCC2(F)F)CC[N@@H+]1C ZINC000394491613 323055318 /nfs/dbraw/zinc/05/53/18/323055318.db2.gz CPDFKCAMEVZNRW-GRYCIOLGSA-N 2 0 246.345 2.494 20 0 BEADRP C[N@@H+](C/C=C/c1ccc(F)cc1)CCC[NH3+] ZINC000570450522 323059861 /nfs/dbraw/zinc/05/98/61/323059861.db2.gz IFWNLIMTPBSCST-DUXPYHPUSA-N 2 0 222.307 2.120 20 0 BEADRP CC(C)N(Cc1ccccn1)CC(C)(C)[NH3+] ZINC000570569776 323063494 /nfs/dbraw/zinc/06/34/94/323063494.db2.gz BMOMWMNGMJQKSF-UHFFFAOYSA-N 2 0 221.348 2.029 20 0 BEADRP CCc1cc(N2CC[C@@H]([NH+]3CCCC3)C2)cc[nH+]1 ZINC000570594127 323064361 /nfs/dbraw/zinc/06/43/61/323064361.db2.gz UZKOOSLPEQYRPG-OAHLLOKOSA-N 2 0 245.370 2.319 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]Cc2cnc3n2CCCC3)[C@H]1C ZINC000570775941 323069850 /nfs/dbraw/zinc/06/98/50/323069850.db2.gz NZASTMZPOYDQIK-MDZLAQPJSA-N 2 0 233.359 2.354 20 0 BEADRP C[C@H]1CC[NH+](CCCC[N@H+]2CC[C@H](C)C2)C1 ZINC000536541729 323077367 /nfs/dbraw/zinc/07/73/67/323077367.db2.gz QMTQHOFMGVBTGA-KBPBESRZSA-N 2 0 224.392 2.450 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]Cc1cnc(C2CC2)s1 ZINC000563135906 323094942 /nfs/dbraw/zinc/09/49/42/323094942.db2.gz VYQHOZXYYOHHPS-DTWKUNHWSA-N 2 0 239.388 2.236 20 0 BEADRP CC[NH2+]Cc1cccc(N[C@@H]2CCC[C@@H]([NH3+])C2)c1 ZINC000563423562 323124214 /nfs/dbraw/zinc/12/42/14/323124214.db2.gz GVRHHOFPMCQHAM-UKRRQHHQSA-N 2 0 247.386 2.478 20 0 BEADRP C[C@@H]1CC(C)(C)C[C@@H]1[NH2+]CC1CC[NH2+]CC1 ZINC000571394829 323143318 /nfs/dbraw/zinc/14/33/18/323143318.db2.gz PCKKCHLVYWXWGI-YPMHNXCESA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+]C/C=C/c1ccccc1 ZINC000414956077 323152234 /nfs/dbraw/zinc/15/22/34/323152234.db2.gz MZHDQHASTMSHAA-JGOVJGDKSA-N 2 0 230.355 2.287 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@@H]1CCC[C@H](C)[C@@H]1C ZINC000414956062 323152252 /nfs/dbraw/zinc/15/22/52/323152252.db2.gz MYDYOJBIRPJJCD-QNWHQSFQSA-N 2 0 212.381 2.399 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)o1 ZINC000531940793 323156029 /nfs/dbraw/zinc/15/60/29/323156029.db2.gz MRBLERYZRSCBKY-DGCLKSJQSA-N 2 0 236.359 2.203 20 0 BEADRP C[C@@H]1CCCC[C@H]1[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000530179170 323205445 /nfs/dbraw/zinc/20/54/45/323205445.db2.gz UVYVXXPSBXXJJZ-UPJWGTAASA-N 2 0 222.376 2.439 20 0 BEADRP CC[C@@]1(C)CC[N@H+](C[C@H]([NH3+])CC(C)C)C1 ZINC000399422496 323206035 /nfs/dbraw/zinc/20/60/35/323206035.db2.gz VKEABJNQPGHWIN-OLZOCXBDSA-N 2 0 212.381 2.482 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]CC[C@@H]1CCCOC1 ZINC000530212668 323216400 /nfs/dbraw/zinc/21/64/00/323216400.db2.gz RXEGVFGUMRKCIN-BFHYXJOUSA-N 2 0 240.391 2.053 20 0 BEADRP Cc1ccc(CC[NH2+][C@H]2CC[N@@H+](C)C[C@H]2C)o1 ZINC000532450369 323265221 /nfs/dbraw/zinc/26/52/21/323265221.db2.gz CVFGAVALJIIATO-RISCZKNCSA-N 2 0 236.359 2.060 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+]CCN(C)CCCOC ZINC000532523012 323272600 /nfs/dbraw/zinc/27/26/00/323272600.db2.gz QFFZZQWSPSCIOL-KGLIPLIRSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@H]([NH2+]CCC1CC[NH+](C)CC1)[C@@H]1C[C@H]1C ZINC000321569512 323384870 /nfs/dbraw/zinc/38/48/70/323384870.db2.gz UPNJEFOVKYHMNZ-MBNYWOFBSA-N 2 0 224.392 2.352 20 0 BEADRP COC[C@@H](C)[NH2+]CCC[NH+](C(C)C)C(C)C ZINC000122291083 324034328 /nfs/dbraw/zinc/03/43/28/324034328.db2.gz HJFMNOAPAXUHQS-CYBMUJFWSA-N 2 0 230.396 2.120 20 0 BEADRP CC(C)[C@H](C)[NH2+][C@H]1CCC[C@H]([NH+](C)C)C1 ZINC000122589024 324050009 /nfs/dbraw/zinc/05/00/09/324050009.db2.gz JICUYKZJQAUSGO-AVGNSLFASA-N 2 0 212.381 2.493 20 0 BEADRP CC(C)(C)[C@H]1CC[C@@H]1[NH2+]CC1CC[NH2+]CC1 ZINC000572510486 324136775 /nfs/dbraw/zinc/13/67/75/324136775.db2.gz RNOAEPFUPXNHJG-STQMWFEESA-N 2 0 224.392 2.400 20 0 BEADRP [NH3+]CC/C=C/c1ccc(C2=CC[NH2+]CC2)cc1 ZINC000530248630 324558736 /nfs/dbraw/zinc/55/87/36/324558736.db2.gz QGUOOPMOVASHJC-HNQUOIGGSA-N 2 0 228.339 2.425 20 0 BEADRP COCc1cccc(C[N@@H+]2CC[C@@H]([NH3+])C[C@H]2C)c1 ZINC000131439954 325151781 /nfs/dbraw/zinc/15/17/81/325151781.db2.gz VVEDYSANBGIZTE-IUODEOHRSA-N 2 0 248.370 2.145 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CC[N@H+](CC)C1 ZINC000132428610 325216068 /nfs/dbraw/zinc/21/60/68/325216068.db2.gz PKIHKCWZYWMVAU-MJBXVCDLSA-N 2 0 224.392 2.497 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+][C@@H]2C[C@H]2C2CCC2)C1 ZINC000566630584 326070616 /nfs/dbraw/zinc/07/06/16/326070616.db2.gz XLBWRYQSSDPHKZ-QNWHQSFQSA-N 2 0 208.349 2.035 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+][C@@H]2C[C@H]2C2CCC2)C1 ZINC000566630585 326070643 /nfs/dbraw/zinc/07/06/43/326070643.db2.gz XLBWRYQSSDPHKZ-ZDEQEGDKSA-N 2 0 208.349 2.035 20 0 BEADRP CCc1ccc(C[NH2+][C@@H](C)C[C@@H](C)[NH3+])cc1 ZINC000567041235 326105007 /nfs/dbraw/zinc/10/50/07/326105007.db2.gz FZVOZVSGGIIDSC-NEPJUHHUSA-N 2 0 220.360 2.464 20 0 BEADRP CC(C)(C[NH2+][C@H]1CCC[C@H]1[NH3+])C(F)(F)F ZINC000567226695 326140256 /nfs/dbraw/zinc/14/02/56/326140256.db2.gz JZHWNQDOTWNEHV-SFYZADRCSA-N 2 0 224.270 2.044 20 0 BEADRP C[C@H](Cc1ccsc1)[NH2+][C@H]1CC[C@H](C[NH3+])C1 ZINC000567220627 326144286 /nfs/dbraw/zinc/14/42/86/326144286.db2.gz HHUSJJQLNFUYMQ-MDZLAQPJSA-N 2 0 238.400 2.396 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CC[C@H]2C2CC2)C1 ZINC000309987665 326178336 /nfs/dbraw/zinc/17/83/36/326178336.db2.gz ZEXSSEKPTANXGG-KWCYVHTRSA-N 2 0 222.376 2.106 20 0 BEADRP CC(C)[C@H]1CCC[C@H]1[NH2+]CC1CC[NH2+]CC1 ZINC000567639134 326235206 /nfs/dbraw/zinc/23/52/06/326235206.db2.gz YCOZRGHRSHOPAK-ZIAGYGMSSA-N 2 0 224.392 2.400 20 0 BEADRP CC(C)[C@@H]1CCC[C@H]1[NH2+]CC1CC[NH2+]CC1 ZINC000567639133 326236100 /nfs/dbraw/zinc/23/61/00/326236100.db2.gz YCOZRGHRSHOPAK-UONOGXRCSA-N 2 0 224.392 2.400 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]CCCC1CC1 ZINC000567647711 326237976 /nfs/dbraw/zinc/23/79/76/326237976.db2.gz OOPAZXOTCGSFMK-CHWSQXEVSA-N 2 0 210.365 2.426 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+][C@H]1CCC[NH2+]CC1 ZINC000388621075 487972018 /nfs/dbraw/zinc/97/20/18/487972018.db2.gz HGSIIDFDJUXJJO-AGIUHOORSA-N 2 0 210.365 2.297 20 0 BEADRP CCCC[C@H](COC)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000158199110 326311410 /nfs/dbraw/zinc/31/14/10/326311410.db2.gz WWMVQRXHQORWGW-ZIAGYGMSSA-N 2 0 242.407 2.123 20 0 BEADRP C[N@@H+]1CCC[C@H]1CC[NH2+][C@H]1CCC1(C)C ZINC000568182727 326322323 /nfs/dbraw/zinc/32/23/23/326322323.db2.gz ZOXVEXZVBDTGDJ-RYUDHWBXSA-N 2 0 210.365 2.249 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@@H]2CCC[C@H]2OC(F)F)C1 ZINC000568248073 326334312 /nfs/dbraw/zinc/33/43/12/326334312.db2.gz GVHYLXGXGFDZRK-GWOFURMSSA-N 2 0 248.317 2.006 20 0 BEADRP c1ccc(C[C@H]2CC[C@H]([NH2+][C@H]3CC[NH2+]C3)C2)cc1 ZINC000568260444 326336712 /nfs/dbraw/zinc/33/67/12/326336712.db2.gz SPDZRFKCYIEFBF-PMPSAXMXSA-N 2 0 244.382 2.349 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+]CCCC[NH+]1CCOCC1 ZINC000158739940 326341238 /nfs/dbraw/zinc/34/12/38/326341238.db2.gz GFVOZJSLPNZGNM-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@H]2CC[C@H]2C2CC2)CC1 ZINC000568310739 326343895 /nfs/dbraw/zinc/34/38/95/326343895.db2.gz QEJZIFAOQFGQQD-GJZGRUSLSA-N 2 0 236.403 2.497 20 0 BEADRP Cc1ccc(F)cc1C[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000569002507 326386050 /nfs/dbraw/zinc/38/60/50/326386050.db2.gz BXRQKQBANDQAKS-QWRGUYRKSA-N 2 0 224.323 2.350 20 0 BEADRP CC[NH2+]CCC[NH2+]C1C2CC3CC(C2)CC1C3 ZINC000569093449 326389362 /nfs/dbraw/zinc/38/93/62/326389362.db2.gz WTZNXTOJWJFOCW-UHFFFAOYSA-N 2 0 236.403 2.400 20 0 BEADRP C[C@H]([NH2+]CC1(C)CC[NH2+]CC1)c1ccoc1 ZINC000569093173 326389376 /nfs/dbraw/zinc/38/93/76/326389376.db2.gz ASFBPTBJJIKJBA-NSHDSACASA-N 2 0 222.332 2.320 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H]1CCC[C@@H]1CCCF ZINC000569211336 326395049 /nfs/dbraw/zinc/39/50/49/326395049.db2.gz FDZVDUUDFMIDON-OLZOCXBDSA-N 2 0 230.371 2.494 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H]1CCC[C@@H]1CCCF ZINC000569211333 326395066 /nfs/dbraw/zinc/39/50/66/326395066.db2.gz FDZVDUUDFMIDON-CHWSQXEVSA-N 2 0 230.371 2.494 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@H+](C)CC[C@@H]1CCCC[NH+]1C ZINC000488336107 533714576 /nfs/dbraw/zinc/71/45/76/533714576.db2.gz SYXMAGKAVCJLJL-MCIONIFRSA-N 2 0 224.392 2.449 20 0 BEADRP CC1(C[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)CCC1 ZINC000400964495 488011784 /nfs/dbraw/zinc/01/17/84/488011784.db2.gz JYPYJIBJUPGAPI-FRRDWIJNSA-N 2 0 222.376 2.154 20 0 BEADRP CC1(C[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)CCC1 ZINC000400964507 488011818 /nfs/dbraw/zinc/01/18/18/488011818.db2.gz JYPYJIBJUPGAPI-YNEHKIRRSA-N 2 0 222.376 2.154 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH+]1CCC([NH+]2CCCC2)CC1 ZINC000488310161 533715826 /nfs/dbraw/zinc/71/58/26/533715826.db2.gz PQCORMYVNHRIFI-CHWSQXEVSA-N 2 0 222.376 2.203 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CC2(C[C@@H]1C)CC[NH2+]CC2 ZINC000424377032 533716489 /nfs/dbraw/zinc/71/64/89/533716489.db2.gz LPAQFAIXCILICM-FRRDWIJNSA-N 2 0 222.376 2.106 20 0 BEADRP CC(C)C[N@H+](C)Cc1ccnn1-c1cc[nH+]cc1 ZINC000667496444 488029211 /nfs/dbraw/zinc/02/92/11/488029211.db2.gz VAIVALGWVKOJKB-UHFFFAOYSA-N 2 0 244.342 2.355 20 0 BEADRP CC[C@@H]1CCC[N@@H+]1Cc1cnc2n1CCC2 ZINC000667545124 488041849 /nfs/dbraw/zinc/04/18/49/488041849.db2.gz YCDMJJGIEOAJFM-LLVKDONJSA-N 2 0 219.332 2.204 20 0 BEADRP C[C@H](CCc1ccccc1)[NH2+]CC12CC(C1)C[NH2+]2 ZINC000663497082 488045895 /nfs/dbraw/zinc/04/58/95/488045895.db2.gz BFOIFAOCEVBEAA-IUDNXUCKSA-N 2 0 244.382 2.349 20 0 BEADRP C[C@@H]1CC[N@H+](CC[C@@H]2CC[NH2+]C2)[C@H](C)C1 ZINC000084385692 488050022 /nfs/dbraw/zinc/05/00/22/488050022.db2.gz IDXVHGFARSKHLW-UPJWGTAASA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)CC[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1 ZINC000084478515 488053655 /nfs/dbraw/zinc/05/36/55/488053655.db2.gz UQBUNANRKPVVNO-LBPRGKRZSA-N 2 0 212.381 2.495 20 0 BEADRP CC[C@@H]1C[N@H+](Cc2cccs2)CC[C@@H]1[NH3+] ZINC000166087302 488054118 /nfs/dbraw/zinc/05/41/18/488054118.db2.gz QZIHNVAVIARPDN-PWSUYJOCSA-N 2 0 224.373 2.307 20 0 BEADRP CCC(CC)[N@H+](CC)C[C@H](O)C[NH+](C)C(C)C ZINC000660559988 488064494 /nfs/dbraw/zinc/06/44/94/488064494.db2.gz FWHQOCFFNACBCR-CQSZACIVSA-N 2 0 244.423 2.198 20 0 BEADRP COC[C@H](CC(C)(C)C)[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000656200847 488066947 /nfs/dbraw/zinc/06/69/47/488066947.db2.gz GKAGVWFMSIVVSP-SRVKXCTJSA-N 2 0 230.396 2.153 20 0 BEADRP C[C@@H]1C[C@H](C)C[N@H+]1Cc1cnc2n1CCC2 ZINC000667664539 488079862 /nfs/dbraw/zinc/07/98/62/488079862.db2.gz NLPVPLZAWZTGIK-WDEREUQCSA-N 2 0 219.332 2.060 20 0 BEADRP C[C@@H](c1ccncc1)[NH+]1CCC2(CC[NH2+]C2)CC1 ZINC000257692591 488082587 /nfs/dbraw/zinc/08/25/87/488082587.db2.gz JNNBVXHBUMXJIV-ZDUSSCGKSA-N 2 0 245.370 2.218 20 0 BEADRP C([NH2+][C@H]1CCC[C@@H]2C[C@@H]21)[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000378890529 488109950 /nfs/dbraw/zinc/10/99/50/488109950.db2.gz PVMWLGVKMFPXLZ-NEBZKDRISA-N 2 0 234.387 2.249 20 0 BEADRP C[C@]1(C[NH3+])CC[N@H+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)C1 ZINC000403602591 488128296 /nfs/dbraw/zinc/12/82/96/488128296.db2.gz GYGIGTMICGFJPS-YIYPIFLZSA-N 2 0 222.376 2.093 20 0 BEADRP CC[C@H]([NH2+][C@H]1CCCN(C)C1)[C@H]1CC1(C)C ZINC000397653410 488129046 /nfs/dbraw/zinc/12/90/46/488129046.db2.gz MGAZSFYNXJMOMP-XQQFMLRXSA-N 2 0 224.392 2.495 20 0 BEADRP CCOc1ccc(C[N@H+](C)C[C@H]2CC[NH2+]C2)cc1 ZINC000258778962 488133152 /nfs/dbraw/zinc/13/31/52/488133152.db2.gz BEWAAKBGSLTVEE-AWEZNQCLSA-N 2 0 248.370 2.127 20 0 BEADRP CCc1ccc(CC[N@H+](C)CCC[NH3+])cc1 ZINC000258774145 488133732 /nfs/dbraw/zinc/13/37/32/488133732.db2.gz OLJPVECYUGUTDH-UHFFFAOYSA-N 2 0 220.360 2.072 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H]2CCC[C@@H]3C[C@@H]32)C1 ZINC000382114116 487531374 /nfs/dbraw/zinc/53/13/74/487531374.db2.gz LOBJZUAVAZXHEG-MQYQWHSLSA-N 2 0 222.376 2.106 20 0 BEADRP C[C@@H](C[C@H]1CCCCC[NH2+]1)[NH2+]C[C@@H]1CCCO1 ZINC000093496301 487471704 /nfs/dbraw/zinc/47/17/04/487471704.db2.gz BOFCXGWBJPMSTJ-MJBXVCDLSA-N 2 0 240.391 2.066 20 0 BEADRP Cc1cc(C[NH2+][C@@H](C)C2CC[NH+](C)CC2)ccn1 ZINC000391232514 487473761 /nfs/dbraw/zinc/47/37/61/487473761.db2.gz RUWHYHLLTDCKSN-ZDUSSCGKSA-N 2 0 247.386 2.210 20 0 BEADRP Cc1cc(C[NH2+][C@H](C)C2CC[NH+](C)CC2)ccn1 ZINC000391232513 487473789 /nfs/dbraw/zinc/47/37/89/487473789.db2.gz RUWHYHLLTDCKSN-CYBMUJFWSA-N 2 0 247.386 2.210 20 0 BEADRP CC(C)CCC[N@@H+]1C[C@@H]2CCC[C@]2(C[NH3+])C1 ZINC000380971965 487491858 /nfs/dbraw/zinc/49/18/58/487491858.db2.gz AQZDJSYBZHRYDD-KBPBESRZSA-N 2 0 224.392 2.483 20 0 BEADRP CC(C)CC[N@H+](C)C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000300056253 487499079 /nfs/dbraw/zinc/49/90/79/487499079.db2.gz OLWLZWUYGMVJAW-CHWSQXEVSA-N 2 0 212.381 2.352 20 0 BEADRP COc1ccc([C@@H](C)[NH2+]CC2CC[NH2+]CC2)cc1 ZINC000094010561 487503454 /nfs/dbraw/zinc/50/34/54/487503454.db2.gz SWQHQTWKSJFGLN-GFCCVEGCSA-N 2 0 248.370 2.345 20 0 BEADRP C[C@@H]([NH2+]CCC(F)(F)F)C1CC[NH+](C)CC1 ZINC000063099372 487513133 /nfs/dbraw/zinc/51/31/33/487513133.db2.gz ZXFGYOZSLMWSQK-SECBINFHSA-N 2 0 238.297 2.259 20 0 BEADRP CC(C)=CCC[N@@H+]1CC[C@@]2(CC[NH2+]C2)C1 ZINC000662267829 487508997 /nfs/dbraw/zinc/50/89/97/487508997.db2.gz ZGDWBUJIALLDFW-CYBMUJFWSA-N 2 0 208.349 2.028 20 0 BEADRP CC(C)=CCC[N@@H+]1CC[C@]2(CC[NH2+]C2)C1 ZINC000662267832 487509723 /nfs/dbraw/zinc/50/97/23/487509723.db2.gz ZGDWBUJIALLDFW-ZDUSSCGKSA-N 2 0 208.349 2.028 20 0 BEADRP CCO[C@@H]1C[C@H]([NH2+]CC2([NH3+])CCCC2)C1(C)C ZINC000300629164 487524117 /nfs/dbraw/zinc/52/41/17/487524117.db2.gz LOTNNEUPSUEOBI-NWDGAFQWSA-N 2 0 240.391 2.051 20 0 BEADRP Cc1ccc(C[NH2+]C[C@H]2CC[C@H](C[NH3+])CC2)cn1 ZINC000415017989 487834077 /nfs/dbraw/zinc/83/40/77/487834077.db2.gz AYMPITXMZPDGES-HDJSIYSDSA-N 2 0 247.386 2.245 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]Cc1nccc2ccccc21 ZINC000666941474 487908953 /nfs/dbraw/zinc/90/89/53/487908953.db2.gz CAOPCLKEDVMEJR-GFCCVEGCSA-N 2 0 243.354 2.452 20 0 BEADRP [NH3+]CC[C@@H]1CCC[N@H+](C[C@@H]2CC[C@H]3C[C@H]3C2)C1 ZINC000403788611 488138496 /nfs/dbraw/zinc/13/84/96/488138496.db2.gz ZWLKYKNHMYQPSF-LJISPDSOSA-N 2 0 236.403 2.483 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@H]([NH3+])C1)c1cccc(O)c1 ZINC000093214292 488139127 /nfs/dbraw/zinc/13/91/27/488139127.db2.gz BMXILSSBTGFDMS-WCFLWFBJSA-N 2 0 234.343 2.313 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H]2CCC[C@@H]2[NH3+])cc1C ZINC000258852626 488139419 /nfs/dbraw/zinc/13/94/19/488139419.db2.gz FEWCIMOYSDFQQW-LSDHHAIUSA-N 2 0 232.371 2.315 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H]2CCC[C@H]2[NH3+])cc1C ZINC000258852623 488139682 /nfs/dbraw/zinc/13/96/82/488139682.db2.gz FEWCIMOYSDFQQW-HUUCEWRRSA-N 2 0 232.371 2.315 20 0 BEADRP CCc1ccc(CC[NH2+][C@H]2CCC[C@H]2[NH3+])cc1 ZINC000258874263 488140234 /nfs/dbraw/zinc/14/02/34/488140234.db2.gz GFPZIMBAGJFCLF-CABCVRRESA-N 2 0 232.371 2.261 20 0 BEADRP CCc1ccc(CC[NH2+][C@@H]2CCC[C@@H]2[NH3+])cc1 ZINC000258874269 488140808 /nfs/dbraw/zinc/14/08/08/488140808.db2.gz GFPZIMBAGJFCLF-LSDHHAIUSA-N 2 0 232.371 2.261 20 0 BEADRP CCc1ccc(CC[NH2+]C2CC[NH2+]CC2)cc1 ZINC000258991035 488145407 /nfs/dbraw/zinc/14/54/07/488145407.db2.gz MMVMQSCVEWNLCF-UHFFFAOYSA-N 2 0 232.371 2.133 20 0 BEADRP CN(Cc1ccc(F)c(F)c1)C[C@H]1CC[NH2+]C1 ZINC000259033019 488148429 /nfs/dbraw/zinc/14/84/29/488148429.db2.gz ZUGJJVKYLVYADI-NSHDSACASA-N 2 0 240.297 2.006 20 0 BEADRP CC[C@@](C)(C[NH2+][C@@H](C)C1CC[NH+](C)CC1)OC ZINC000322568091 488191894 /nfs/dbraw/zinc/19/18/94/488191894.db2.gz YOQHTALEZQKKEY-JSGCOSHPSA-N 2 0 242.407 2.121 20 0 BEADRP C/C(=C\c1ccccc1)C[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC000678343293 488243252 /nfs/dbraw/zinc/24/32/52/488243252.db2.gz PBPJUZAWZYWQDZ-WVHJRZPWSA-N 2 0 242.366 2.241 20 0 BEADRP Cc1ccc([C@H](C)[NH2+]C2CCN(C)CC2)c(C)n1 ZINC000678411728 488251859 /nfs/dbraw/zinc/25/18/59/488251859.db2.gz KOTYFKWDLDWACV-ZDUSSCGKSA-N 2 0 247.386 2.443 20 0 BEADRP Cc1c[nH+]ccc1N1CCC[C@H]([NH2+]C(C)C)C1 ZINC000684570217 488327863 /nfs/dbraw/zinc/32/78/63/488327863.db2.gz HKRWZTWEBOGFSH-ZDUSSCGKSA-N 2 0 233.359 2.357 20 0 BEADRP Cc1c[nH+]ccc1N1CCC[C@@H]([NH2+]C(C)C)C1 ZINC000684570216 488327882 /nfs/dbraw/zinc/32/78/82/488327882.db2.gz HKRWZTWEBOGFSH-CYBMUJFWSA-N 2 0 233.359 2.357 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](CC)C1)C1CC1 ZINC000121862258 490111672 /nfs/dbraw/zinc/11/16/72/490111672.db2.gz AYNYFHNCHHIAKD-JSGCOSHPSA-N 2 0 224.392 2.497 20 0 BEADRP C[N@H+](C[C@@H]1C[C@H]2C[C@H]2C1)C[C@H]1CCC[NH+](C)C1 ZINC000659949743 490113207 /nfs/dbraw/zinc/11/32/07/490113207.db2.gz VTYZPKAXOHUPHL-XQLPTFJDSA-N 2 0 236.403 2.306 20 0 BEADRP c1ccc(CCCC[NH+]2C[C@@H]3C[NH2+]C[C@H]3C2)cc1 ZINC000122194471 490128398 /nfs/dbraw/zinc/12/83/98/490128398.db2.gz BUFPEFBIOZRFKX-HOTGVXAUSA-N 2 0 244.382 2.161 20 0 BEADRP CCCCOCCN1CCC[C@@H]([NH2+]C(C)C)C1 ZINC000071201383 490258711 /nfs/dbraw/zinc/25/87/11/490258711.db2.gz WVWORBCUZFJGGV-CQSZACIVSA-N 2 0 242.407 2.266 20 0 BEADRP CCCN1CC[C@@H]([NH2+]C2CCCCC2)C1 ZINC000328507872 490297666 /nfs/dbraw/zinc/29/76/66/490297666.db2.gz MCSXYBXZYWUMDI-CYBMUJFWSA-N 2 0 210.365 2.393 20 0 BEADRP C1=CCC([NH2+]C2CCN(c3cc[nH+]cc3)CC2)C1 ZINC000125039353 490411719 /nfs/dbraw/zinc/41/17/19/490411719.db2.gz SUUZEWYRFDAIDB-UHFFFAOYSA-N 2 0 243.354 2.359 20 0 BEADRP CC1(C)CC[C@H]([NH2+][C@H]2CCC[NH2+]CC2)C1 ZINC000128606961 490583073 /nfs/dbraw/zinc/58/30/73/490583073.db2.gz QOJIGNUDMVFBJB-RYUDHWBXSA-N 2 0 210.365 2.297 20 0 BEADRP C[N@H+](CCC[NH3+])CCCc1c(F)cccc1F ZINC000655937915 491098768 /nfs/dbraw/zinc/09/87/68/491098768.db2.gz IDONKSSCZGHAEM-UHFFFAOYSA-N 2 0 242.313 2.178 20 0 BEADRP CC[NH+](CC)C[C@H]1CC[N@@H+]([C@@H](C)CCOC)C1 ZINC000088536716 491104844 /nfs/dbraw/zinc/10/48/44/491104844.db2.gz ZIIAFQBUEKTEAG-UONOGXRCSA-N 2 0 242.407 2.075 20 0 BEADRP CC(C)[C@H]1CC[C@@H]1[NH2+]CCC[NH+]1CCCC1 ZINC000309671282 491153608 /nfs/dbraw/zinc/15/36/08/491153608.db2.gz JXHSDEQPOKWFRC-KGLIPLIRSA-N 2 0 224.392 2.497 20 0 BEADRP CCCCC[N@@H+]1CCC[C@]12CCC[NH2+]C2 ZINC000757127729 582503581 /nfs/dbraw/zinc/50/35/81/582503581.db2.gz HVPNJFWZYAYDPY-ZDUSSCGKSA-N 2 0 210.365 2.395 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000400987789 533794088 /nfs/dbraw/zinc/79/40/88/533794088.db2.gz WIRCYEOTEMFWCJ-KSTCHIGDSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)[C@@H]1C ZINC000401108370 533964117 /nfs/dbraw/zinc/96/41/17/533964117.db2.gz GMBYZQHPGSZNTP-HUXGKSLCSA-N 2 0 222.376 2.009 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)[C@H]1C ZINC000401108382 533964464 /nfs/dbraw/zinc/96/44/64/533964464.db2.gz GMBYZQHPGSZNTP-WZBKEBKWSA-N 2 0 222.376 2.009 20 0 BEADRP CO[C@@H]1CCC[C@H]([NH2+]CCCCC[NH+](C)C)C1 ZINC001172917520 974964823 /nfs/dbraw/zinc/96/48/23/974964823.db2.gz NINMRWKJFJDKAZ-UONOGXRCSA-N 2 0 242.407 2.266 20 0 BEADRP C1[NH2+]C[C@@H]2C[C@H]([NH2+]C3CCCCC3)CC[C@@H]12 ZINC000401051226 526424267 /nfs/dbraw/zinc/42/42/67/526424267.db2.gz PKZYBDWFAYUMJF-SGMGOOAPSA-N 2 0 222.376 2.297 20 0 BEADRP CCC[N@H+](C)C[C@@H]1CC[NH+](C[C@@H]2C[C@H]2C)C1 ZINC000488321748 527837645 /nfs/dbraw/zinc/83/76/45/527837645.db2.gz NRIMXTQTWXXTBZ-RDBSUJKOSA-N 2 0 224.392 2.306 20 0 BEADRP CCC(C)(C)OCC[NH2+][C@H]1CC[N@H+](C)C[C@@H]1C ZINC000308715884 528592819 /nfs/dbraw/zinc/59/28/19/528592819.db2.gz BDQPBCKLVUCEBI-STQMWFEESA-N 2 0 242.407 2.121 20 0 BEADRP CC[NH+]1CCC([NH2+]C/C=C\c2ccncc2)CC1 ZINC000486933750 528987178 /nfs/dbraw/zinc/98/71/78/528987178.db2.gz AOJNLXPEMNCZBP-ARJAWSKDSA-N 2 0 245.370 2.169 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000400982818 529032043 /nfs/dbraw/zinc/03/20/43/529032043.db2.gz SXCBFSXDMKWVLG-LOWDOPEQSA-N 2 0 222.376 2.153 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000400982821 529032312 /nfs/dbraw/zinc/03/23/12/529032312.db2.gz SXCBFSXDMKWVLG-XQHKEYJVSA-N 2 0 222.376 2.153 20 0 BEADRP CCSCC[C@H](C)[NH2+][C@H](C)[C@H]1CCC[NH2+]1 ZINC000400364853 529195399 /nfs/dbraw/zinc/19/53/99/529195399.db2.gz DQFCKCXPSBTGKL-QJPTWQEYSA-N 2 0 230.421 2.248 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+][C@@H](C)[C@H]1CCC[NH2+]1 ZINC000400461627 529312151 /nfs/dbraw/zinc/31/21/51/529312151.db2.gz RSAIEVRAIFJBHI-LOWDOPEQSA-N 2 0 210.365 2.295 20 0 BEADRP CC[C@H](C[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1)c1ccccc1 ZINC000479953104 529336243 /nfs/dbraw/zinc/33/62/43/529336243.db2.gz GQUGJXMIQJGODG-BMFZPTHFSA-N 2 0 244.382 2.331 20 0 BEADRP CC(C)[N@H+](CC1CCC1)C[C@]1(C)CC[NH2+]C1 ZINC000261729288 535047354 /nfs/dbraw/zinc/04/73/54/535047354.db2.gz GZEBEOGEZAKHKO-CQSZACIVSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)(C)[C@@H]1CCC[N@H+](CCC[NH3+])CC1 ZINC000070652723 535073704 /nfs/dbraw/zinc/07/37/04/535073704.db2.gz ZFUNVBHLIYGHKK-GFCCVEGCSA-N 2 0 212.381 2.483 20 0 BEADRP CC(C)C[N@@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000172644668 535135368 /nfs/dbraw/zinc/13/53/68/535135368.db2.gz YTCJOWMAXCTESQ-CYBMUJFWSA-N 2 0 210.365 2.060 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]C[C@@H]2CCSC2)CC1 ZINC000224305986 535161436 /nfs/dbraw/zinc/16/14/36/535161436.db2.gz XNCACQCZDGVGGP-LBPRGKRZSA-N 2 0 242.432 2.202 20 0 BEADRP CCC([NH3+])(CC)CNc1cc[nH+]cc1C ZINC000168512232 535195417 /nfs/dbraw/zinc/19/54/17/535195417.db2.gz SZWYCPXGUIKVTI-UHFFFAOYSA-N 2 0 207.321 2.319 20 0 BEADRP CC(C)([NH3+])C[NH2+]C1CCC(C(F)(F)F)CC1 ZINC000261564808 535209873 /nfs/dbraw/zinc/20/98/73/535209873.db2.gz CSMRTXUVAKEAPD-UHFFFAOYSA-N 2 0 238.297 2.434 20 0 BEADRP CC[NH2+]CC1CCN(c2cc[nH+]c(C)c2)CC1 ZINC000162903953 535461327 /nfs/dbraw/zinc/46/13/27/535461327.db2.gz CNYQIZBWEDSIRH-UHFFFAOYSA-N 2 0 233.359 2.216 20 0 BEADRP CC[NH+](CC)C[C@@H]1CCCC[C@H]1[NH2+]CCOC ZINC000348309347 535580159 /nfs/dbraw/zinc/58/01/59/535580159.db2.gz FXHVBTOTABMMEX-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP CCc1ccccc1C[N@@H+]1C[C@@H]2CC[C@H]([NH3+])[C@H]2C1 ZINC000261565582 535935670 /nfs/dbraw/zinc/93/56/70/535935670.db2.gz HSZXYQZIMWVNBK-JYJNAYRXSA-N 2 0 244.382 2.418 20 0 BEADRP CC[C@H](CCO)C[NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000227542264 536091199 /nfs/dbraw/zinc/09/11/99/536091199.db2.gz MBRODTKYPCJFLK-DFBGVHRSSA-N 2 0 248.370 2.129 20 0 BEADRP CCc1ccc(C[N@@H+]2CC[C@@H]3[NH2+]CC[C@H]3C2)cc1 ZINC000261585234 536178906 /nfs/dbraw/zinc/17/89/06/536178906.db2.gz SWJQHFZZMYXRIT-HOTGVXAUSA-N 2 0 244.382 2.433 20 0 BEADRP C[NH+]1CCC2(CCC[N@@H+]2Cc2ccncc2)CC1 ZINC000334408582 536348561 /nfs/dbraw/zinc/34/85/61/536348561.db2.gz IEGZSAQIDLQASC-UHFFFAOYSA-N 2 0 245.370 2.142 20 0 BEADRP C[NH2+][C@H](C)CNc1cc[nH+]c(C)c1Cl ZINC000261529369 536404289 /nfs/dbraw/zinc/40/42/89/536404289.db2.gz RQTMAQICZMETET-SSDOTTSWSA-N 2 0 213.712 2.063 20 0 BEADRP C[NH2+][C@H](C)CNc1cc[nH+]c2ccccc12 ZINC000261573805 536404599 /nfs/dbraw/zinc/40/45/99/536404599.db2.gz IZINWYXEFYETCC-SNVBAGLBSA-N 2 0 215.300 2.255 20 0 BEADRP C[NH2+]C[C@@H]1CCC[N@@H+]1CCC1CCCC1 ZINC000261536628 536458849 /nfs/dbraw/zinc/45/88/49/536458849.db2.gz SFGRKPPZYCEDBS-ZDUSSCGKSA-N 2 0 210.365 2.251 20 0 BEADRP CO[C@H](C[NH2+][C@H]1C[C@H]([NH3+])c2ccccc21)C1CC1 ZINC000262002035 536647674 /nfs/dbraw/zinc/64/76/74/536647674.db2.gz PXVLFXJALXIERM-SOUVJXGZSA-N 2 0 246.354 2.146 20 0 BEADRP COCCCCC[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@@H]1C ZINC000222977784 536878765 /nfs/dbraw/zinc/87/87/65/536878765.db2.gz YZQSYCIJLHGKED-MELADBBJSA-N 2 0 242.407 2.121 20 0 BEADRP [NH3+][C@@H]1CCCC[C@H]1[NH2+]CCC1SCCS1 ZINC000853023506 588716559 /nfs/dbraw/zinc/71/65/59/588716559.db2.gz ZJLBZDFYDRUKNY-NXEZZACHSA-N 2 0 246.445 2.042 20 0 BEADRP C[NH2+]C[C@H](C)[NH2+][C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000853248938 588728872 /nfs/dbraw/zinc/72/88/72/588728872.db2.gz LZUKKXGFSOBOBP-GUBZILKMSA-N 2 0 238.297 2.305 20 0 BEADRP CC(C)C(N)=[NH+]OC[C@@H]1CCCC[N@H+]1C(C)C ZINC000853684945 588755969 /nfs/dbraw/zinc/75/59/69/588755969.db2.gz NCEQJLVDKFTTLL-LBPRGKRZSA-N 2 0 241.379 2.404 20 0 BEADRP CN1CC[C@H]([NH2+]Cc2ccnc3ccccc23)C1 ZINC000111728707 588769509 /nfs/dbraw/zinc/76/95/09/588769509.db2.gz VDFOENSJPOCRFX-ZDUSSCGKSA-N 2 0 241.338 2.029 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+][C@H]1CC[C@@H]1C(C)C ZINC000854229934 588781063 /nfs/dbraw/zinc/78/10/63/588781063.db2.gz ARQQKANOQRCKRZ-UPJWGTAASA-N 2 0 212.381 2.384 20 0 BEADRP CCC[C@H](C)[N@@H+]1CCC[C@@]12CCC[NH2+]C2 ZINC000757135097 582514303 /nfs/dbraw/zinc/51/43/03/582514303.db2.gz YKEFQTJKBYWEMV-QWHCGFSZSA-N 2 0 210.365 2.393 20 0 BEADRP [NH3+]CCCCCC[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000843344090 582533117 /nfs/dbraw/zinc/53/31/17/582533117.db2.gz QAEBFSLSWHGMJC-LSDHHAIUSA-N 3 0 247.386 2.240 20 0 BEADRP CC[N@H+](CC1CC1)CC1CC[NH+](C)CC1 ZINC000892036056 582769448 /nfs/dbraw/zinc/76/94/48/582769448.db2.gz QZYUSFHFSZQLQD-UHFFFAOYSA-N 2 0 210.365 2.060 20 0 BEADRP C[NH+]1CCC(C[NH+]2CCC(C(F)F)CC2)CC1 ZINC000892057610 582777242 /nfs/dbraw/zinc/77/72/42/582777242.db2.gz IZBSRUBWIRMEFZ-UHFFFAOYSA-N 2 0 246.345 2.305 20 0 BEADRP C[C@H]1CC[C@H](C)[N@H+](CC2CC[NH+](C)CC2)C1 ZINC000892069317 582784054 /nfs/dbraw/zinc/78/40/54/582784054.db2.gz HWQYRMNCUJPWDC-STQMWFEESA-N 2 0 224.392 2.449 20 0 BEADRP CCN(Cc1ccc(C)c(F)c1)[C@H]1CC[NH2+]C1 ZINC000104329031 582793579 /nfs/dbraw/zinc/79/35/79/582793579.db2.gz LTAUNZFCCHJNJU-ZDUSSCGKSA-N 2 0 236.334 2.318 20 0 BEADRP CC[C@@H]1CC[N@H+](CC2CC[NH+](C)CC2)C1 ZINC000892222249 582808903 /nfs/dbraw/zinc/80/89/03/582808903.db2.gz QRNCGXABLWJVKY-GFCCVEGCSA-N 2 0 210.365 2.060 20 0 BEADRP C[C@H]1CC[C@H](C)[NH+]1CC1CC[NH+](C)CC1 ZINC000892224571 582810068 /nfs/dbraw/zinc/81/00/68/582810068.db2.gz XSPSXUNVTSYELF-RYUDHWBXSA-N 2 0 210.365 2.201 20 0 BEADRP [NH3+][C@@]12CCC[C@H]1CN(CCc1cccs1)C2 ZINC000857086553 588886777 /nfs/dbraw/zinc/88/67/77/588886777.db2.gz LRRMGOWWVLEMJF-WCQYABFASA-N 2 0 236.384 2.104 20 0 BEADRP [NH3+][C@]12CCC[C@@H]1CN(CCc1cccs1)C2 ZINC000857086555 588887164 /nfs/dbraw/zinc/88/71/64/588887164.db2.gz LRRMGOWWVLEMJF-YPMHNXCESA-N 2 0 236.384 2.104 20 0 BEADRP Cc1ncoc1C[N@@H+]1CCC[C@H](n2ccnc2)C1 ZINC000893994430 583268177 /nfs/dbraw/zinc/26/81/77/583268177.db2.gz LUFPAIXEOVZFAL-LBPRGKRZSA-N 2 0 246.314 2.017 20 0 BEADRP C[C@H]1CCSCC[N@@H+]1CC1CC[NH+](C)CC1 ZINC000894000699 583271623 /nfs/dbraw/zinc/27/16/23/583271623.db2.gz RYOGEZXFEPLNLS-LBPRGKRZSA-N 2 0 242.432 2.156 20 0 BEADRP C[C@@H]1CC[N@H+](CC2CC[NH+](C)CC2)CCS1 ZINC000894029882 583281448 /nfs/dbraw/zinc/28/14/48/583281448.db2.gz OATGVWYQRWQMDX-GFCCVEGCSA-N 2 0 242.432 2.156 20 0 BEADRP C[C@H](c1cccnc1)[N@H+](C)CC1CC[NH+](C)CC1 ZINC000738312922 583378999 /nfs/dbraw/zinc/37/89/99/583378999.db2.gz ZMFVFCHDKNEIEP-CYBMUJFWSA-N 2 0 247.386 2.416 20 0 BEADRP CC(C)(CC[N@@H+]1CC[C@H](C[NH3+])C1)C1CC1 ZINC000328546364 583415002 /nfs/dbraw/zinc/41/50/02/583415002.db2.gz NRJILYPQDYKFNW-LLVKDONJSA-N 2 0 210.365 2.093 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@@H]2CCCC[C@H]2F)CC1 ZINC000894912612 583554766 /nfs/dbraw/zinc/55/47/66/583554766.db2.gz GVPFDCCOACYDMQ-CHWSQXEVSA-N 2 0 228.355 2.199 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2CC[C@H](C3CCC3)C2)CC1 ZINC000894948791 583559227 /nfs/dbraw/zinc/55/92/27/583559227.db2.gz NVBKVHCUQIQPRP-HNNXBMFYSA-N 2 0 236.403 2.450 20 0 BEADRP CNc1cc(CNc2cc(C)nc(C)n2)ccn1 ZINC000895255646 583633938 /nfs/dbraw/zinc/63/39/38/583633938.db2.gz JJEMGYNYBLEKOZ-UHFFFAOYSA-N 2 0 243.314 2.142 20 0 BEADRP CN1CC(C[N@H+](C)C/C=C/c2cccc(F)c2)C1 ZINC000895261481 583634105 /nfs/dbraw/zinc/63/41/05/583634105.db2.gz YEHBYOCSEMSWEP-GQCTYLIASA-N 2 0 248.345 2.332 20 0 BEADRP Cc1ccc(CCC[NH2+]CC[C@H](C)[NH+](C)C)cn1 ZINC000895292970 583639130 /nfs/dbraw/zinc/63/91/30/583639130.db2.gz FBPNIUYUSDTLOE-AWEZNQCLSA-N 2 0 249.402 2.252 20 0 BEADRP COCC1CCC([NH2+]CC[C@@H](C)[NH+](C)C)CC1 ZINC000895293767 583639843 /nfs/dbraw/zinc/63/98/43/583639843.db2.gz PZXHTBKGQUVLJG-IYXRBSQSSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H]1C[N@H+](CC2(C)CC2)CCN1c1cc[nH+]cc1 ZINC000895556308 583690664 /nfs/dbraw/zinc/69/06/64/583690664.db2.gz HBNGOHXVYDBMDH-ZDUSSCGKSA-N 2 0 245.370 2.392 20 0 BEADRP C[N@@H+]1CC[C@H]1CNc1cc[nH+]c2cc(F)ccc12 ZINC000895770733 583725005 /nfs/dbraw/zinc/72/50/05/583725005.db2.gz DHUKIXHJXISTGH-NSHDSACASA-N 2 0 245.301 2.490 20 0 BEADRP CCC[N@@H+]1CCCN(c2cc[nH+]cc2)CC1 ZINC000673710694 583928114 /nfs/dbraw/zinc/92/81/14/583928114.db2.gz CRSHPCQTBSVKEG-UHFFFAOYSA-N 2 0 219.332 2.004 20 0 BEADRP C[NH+]1CCC(C[NH2+]CC(C)(C)C2CC2)CC1 ZINC000897435652 583976238 /nfs/dbraw/zinc/97/62/38/583976238.db2.gz PESZSMXMTWAQGZ-UHFFFAOYSA-N 2 0 224.392 2.354 20 0 BEADRP F[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000865697170 584027048 /nfs/dbraw/zinc/02/70/48/584027048.db2.gz UKOXHEIBSBABER-RQJABVFESA-N 2 0 240.366 2.484 20 0 BEADRP C[C@H](CC1CC1)[NH2+]Cc1ccc(CC[NH3+])cc1 ZINC000841032256 584031913 /nfs/dbraw/zinc/03/19/13/584031913.db2.gz AQCBBZXQIJHVKM-GFCCVEGCSA-N 2 0 232.371 2.466 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]Cc1ccc(CC[NH3+])cc1 ZINC000841032262 584031922 /nfs/dbraw/zinc/03/19/22/584031922.db2.gz AQCBBZXQIJHVKM-LBPRGKRZSA-N 2 0 232.371 2.466 20 0 BEADRP CC1(C[NH+]2CCC([NH2+]C3CCC3)CC2)CC1 ZINC000897982693 584072357 /nfs/dbraw/zinc/07/23/57/584072357.db2.gz PCSQDBMYRLRLKR-UHFFFAOYSA-N 2 0 222.376 2.393 20 0 BEADRP CC[C@](C)(C[N@H+](C)CC(C)(C)C[NH+](C)C)OC ZINC000898308224 584109424 /nfs/dbraw/zinc/10/94/24/584109424.db2.gz SVLDKSJYBRAEDT-CQSZACIVSA-N 2 0 244.423 2.321 20 0 BEADRP COc1cccc2cc(C[NH2+][C@@H](C)CC[NH3+])oc21 ZINC000841051471 584125372 /nfs/dbraw/zinc/12/53/72/584125372.db2.gz OKUKWKLNQOVLKL-JTQLQIEISA-N 2 0 248.326 2.268 20 0 BEADRP COc1cccc2cc(C[NH2+][C@H](C)CC[NH3+])oc21 ZINC000841051472 584125453 /nfs/dbraw/zinc/12/54/53/584125453.db2.gz OKUKWKLNQOVLKL-SNVBAGLBSA-N 2 0 248.326 2.268 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+]C[C@H]2C[C@H]([NH3+])C2)c(C)n1 ZINC000873255431 584128019 /nfs/dbraw/zinc/12/80/19/584128019.db2.gz GNBORFZZXCRNON-RAIGVLPGSA-N 2 0 233.359 2.086 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccc(Cl)nc1 ZINC000873251398 584128026 /nfs/dbraw/zinc/12/80/26/584128026.db2.gz MHMHAQMWKXDVAG-ATZCPNFKSA-N 2 0 239.750 2.123 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@H]2CCc3ccccc32)C1 ZINC000873257800 584128326 /nfs/dbraw/zinc/12/83/26/584128326.db2.gz XNTNGMIFHFMION-SUHUHFCYSA-N 2 0 216.328 2.001 20 0 BEADRP C[C@H](Cc1ccccc1F)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873251206 584128334 /nfs/dbraw/zinc/12/83/34/584128334.db2.gz VDQJBRRBSLOOJU-WZRBSPASSA-N 2 0 236.334 2.084 20 0 BEADRP CCN1CCC[C@H]1C[NH2+]Cc1ccccc1NC ZINC000902033611 584519126 /nfs/dbraw/zinc/51/91/26/584519126.db2.gz GEYHUTLBMWWPFF-AWEZNQCLSA-N 2 0 247.386 2.302 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+]Cc2ccccc2NC)C1 ZINC000902078457 584520835 /nfs/dbraw/zinc/52/08/35/584520835.db2.gz LZXUXAUMRIKEJY-CYBMUJFWSA-N 2 0 247.386 2.160 20 0 BEADRP CNc1ccccc1C[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000902224696 584541408 /nfs/dbraw/zinc/54/14/08/584541408.db2.gz RZBKFUOZVMTZON-ZDUSSCGKSA-N 2 0 247.386 2.160 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]([NH2+]CCC(F)(F)F)C1 ZINC000902345182 584558487 /nfs/dbraw/zinc/55/84/87/584558487.db2.gz AQBWZRJPEPGAOO-SECBINFHSA-N 2 0 238.297 2.307 20 0 BEADRP CCCCOCC[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000902333800 584563360 /nfs/dbraw/zinc/56/33/60/584563360.db2.gz ODJPHAFPGAPXAC-CYBMUJFWSA-N 2 0 242.407 2.171 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]([NH2+]C[C@@H]2CCC=CO2)C1 ZINC000902376020 584567961 /nfs/dbraw/zinc/56/79/61/584567961.db2.gz GNCWGDSTFGSEAY-STQMWFEESA-N 2 0 238.375 2.047 20 0 BEADRP Cc1occc1C[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000902364993 584573468 /nfs/dbraw/zinc/57/34/68/584573468.db2.gz WCEGWKQNNQHTOK-CYBMUJFWSA-N 2 0 236.359 2.456 20 0 BEADRP C[C@@H]1C[C@H]1[C@@H]1C[C@H]1[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000902406857 584574068 /nfs/dbraw/zinc/57/40/68/584574068.db2.gz VIJCJZSSCVYPAJ-XHJNMGKDSA-N 2 0 236.403 2.399 20 0 BEADRP CC[C@@H]1CC[C@H](C)C[C@H]1[NH2+]CC1([NH3+])CC1 ZINC000902406544 584574119 /nfs/dbraw/zinc/57/41/19/584574119.db2.gz NSLSSOIEAALIOF-QJPTWQEYSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)[C@@H]1CCCC[C@H]1[NH2+]CC1([NH3+])CC1 ZINC000902412544 584575974 /nfs/dbraw/zinc/57/59/74/584575974.db2.gz CUHIYSXKKZSHHW-NWDGAFQWSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)[C@H]1CCCC[C@@H]1[NH2+]CC1([NH3+])CC1 ZINC000902412543 584576291 /nfs/dbraw/zinc/57/62/91/584576291.db2.gz CUHIYSXKKZSHHW-NEPJUHHUSA-N 2 0 210.365 2.282 20 0 BEADRP CC/C=C/C[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000902387431 584579476 /nfs/dbraw/zinc/57/94/76/584579476.db2.gz KSKOEYCUFALQLT-FYJFLYSWSA-N 2 0 210.365 2.320 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]([NH2+]Cc2cccc(N)c2)C1 ZINC000902391147 584582277 /nfs/dbraw/zinc/58/22/77/584582277.db2.gz COQVTRCLHZSEGQ-AWEZNQCLSA-N 2 0 247.386 2.137 20 0 BEADRP [NH3+]C1(C[NH2+][C@H](Cc2ccccc2)C2CC2)CC1 ZINC000902412839 584584998 /nfs/dbraw/zinc/58/49/98/584584998.db2.gz GLALJWSUHMHZKM-CQSZACIVSA-N 2 0 230.355 2.089 20 0 BEADRP CC(C)(F)C[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000902398387 584586274 /nfs/dbraw/zinc/58/62/74/584586274.db2.gz OZQKLEIFVJXYBH-JTQLQIEISA-N 2 0 216.344 2.102 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@H](C)c1ccc2c(c1)CCO2 ZINC000902405368 584588755 /nfs/dbraw/zinc/58/87/55/584588755.db2.gz MSXXOWBRPMAEAB-QJPTWQEYSA-N 2 0 248.370 2.398 20 0 BEADRP C[C@@H]([NH2+]CC(C)(C)C1CC1)[C@H]1CCC[NH2+]1 ZINC000902430908 584595317 /nfs/dbraw/zinc/59/53/17/584595317.db2.gz JSJQPCLKMZIXFC-ZYHUDNBSSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)(C[NH2+][C@H]1CCC[C@H]1C[NH3+])C1CC1 ZINC000902432802 584595358 /nfs/dbraw/zinc/59/53/58/584595358.db2.gz PZGBYRIPPIXPBP-JQWIXIFHSA-N 2 0 210.365 2.140 20 0 BEADRP CC(C)(C[NH2+][C@H]1CC[NH2+]C1(C)C)C1CC1 ZINC000902433972 584595995 /nfs/dbraw/zinc/59/59/95/584595995.db2.gz WNHYSIMKTVOZIQ-NSHDSACASA-N 2 0 210.365 2.153 20 0 BEADRP CCC(C)(C)[C@H](C)[NH2+][C@@H]1C[NH2+]CC1(C)C ZINC000902440907 584597772 /nfs/dbraw/zinc/59/77/72/584597772.db2.gz BEOYVNGAYPWNPJ-WDEREUQCSA-N 2 0 212.381 2.399 20 0 BEADRP CC1(C)C[NH2+]C[C@H]1[NH2+]C1CCC(C(F)F)CC1 ZINC000902442476 584597969 /nfs/dbraw/zinc/59/79/69/584597969.db2.gz IMJQERPTWFNVJZ-VQXHTEKXSA-N 2 0 246.345 2.398 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+][C@@H]2C[NH2+]CC2(C)C)C1 ZINC000902445371 584598897 /nfs/dbraw/zinc/59/88/97/584598897.db2.gz LUPBFPQUTUNIRX-IJLUTSLNSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]([NH2+]CC1([NH3+])CC1)C1C(C)(C)C1(C)C ZINC000902413547 584599808 /nfs/dbraw/zinc/59/98/08/584599808.db2.gz NZVPKJSYXSXUTG-SECBINFHSA-N 2 0 210.365 2.138 20 0 BEADRP CCCC[C@H]1CCC[C@@H]1[NH2+]CC1(N)CC1 ZINC000902414732 584600200 /nfs/dbraw/zinc/60/02/00/584600200.db2.gz ZWOITHJQOWGZHB-RYUDHWBXSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@H](CCc1ccccc1)[NH2+]CC1(N)CC1 ZINC000902414983 584600485 /nfs/dbraw/zinc/60/04/85/584600485.db2.gz IRBNOCMSKNMLDL-GFCCVEGCSA-N 2 0 218.344 2.089 20 0 BEADRP Cc1cccc(C[C@H]([NH2+]CC2(N)CC2)C2CC2)c1 ZINC000902414624 584600750 /nfs/dbraw/zinc/60/07/50/584600750.db2.gz YRMFFAQOPGBVDT-HNNXBMFYSA-N 2 0 244.382 2.397 20 0 BEADRP CCC1CCC([NH2+][C@@H]2C[C@H]3CC[C@@H]2[NH2+]3)CC1 ZINC000902472738 584601348 /nfs/dbraw/zinc/60/13/48/584601348.db2.gz GVLIHMFGCJGEGI-MYXTYHMWSA-N 2 0 222.376 2.438 20 0 BEADRP C[C@H]1CC([NH2+][C@@H]2C[C@H]3CC[C@@H]2[NH2+]3)C[C@H](C)C1 ZINC000902476834 584602674 /nfs/dbraw/zinc/60/26/74/584602674.db2.gz PVZJMBYHYYMXLZ-KLKTVBQGSA-N 2 0 222.376 2.294 20 0 BEADRP C[C@H](CC1CCC1)[NH2+][C@@H]1C[NH2+]CC1(C)C ZINC000902448113 584604530 /nfs/dbraw/zinc/60/45/30/584604530.db2.gz CHJHUMPZIHLBHU-ZYHUDNBSSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)(C)[C@@H]1CC[C@H]1[NH2+][C@@H]1C[NH2+]CC1(C)C ZINC000902447501 584604769 /nfs/dbraw/zinc/60/47/69/584604769.db2.gz YPSXDOJMFFMBFA-IJLUTSLNSA-N 2 0 224.392 2.399 20 0 BEADRP CC1(C)C[NH2+]C[C@@H]1[NH2+][C@H](C1CC1)C1CCC1 ZINC000902447551 584604892 /nfs/dbraw/zinc/60/48/92/584604892.db2.gz ZLXUKTCQXDCLIZ-STQMWFEESA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]([NH2+][C@H]1C[NH2+]CC1(C)C)C1CCCC1 ZINC000902448733 584605575 /nfs/dbraw/zinc/60/55/75/584605575.db2.gz HZDBHCVCLKYFGL-PWSUYJOCSA-N 2 0 210.365 2.153 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+][C@H]1CCCC2(CC2)C1 ZINC000902450020 584606102 /nfs/dbraw/zinc/60/61/02/584606102.db2.gz BRDOTKFJUQAGMJ-TUAOUCFPSA-N 2 0 208.349 2.179 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCSC(C)(C)C1)[C@H]1CCC[NH2+]1 ZINC000902450047 584606418 /nfs/dbraw/zinc/60/64/18/584606418.db2.gz CBWZHSFVSQGIST-QJPTWQEYSA-N 2 0 242.432 2.391 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+][C@@H]1CCSC(C)(C)C1 ZINC000902453250 584607718 /nfs/dbraw/zinc/60/77/18/584607718.db2.gz OGZDIPJFTIDBFL-MNOVXSKESA-N 2 0 242.432 2.391 20 0 BEADRP C[C@@H]1[C@H]2CC[C@@H](C[C@@H]1[NH2+][C@@H]1C[C@H]3CCC[C@H]31)[NH2+]2 ZINC000902453027 584607962 /nfs/dbraw/zinc/60/79/62/584607962.db2.gz BPULQWQDPXJHGW-LLMNZUDISA-N 2 0 234.387 2.294 20 0 BEADRP C1CC2(C1)[NH2+]CC[C@H]2[NH2+][C@H]1C[C@H]2CCC[C@H]21 ZINC000902453078 584608304 /nfs/dbraw/zinc/60/83/04/584608304.db2.gz CCZDWXCZWPQYNP-FVCCEPFGSA-N 2 0 220.360 2.049 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+][C@H]1CCCC2(CC2)C1 ZINC000902455779 584609225 /nfs/dbraw/zinc/60/92/25/584609225.db2.gz YYWDZILGKGLGOC-NWDGAFQWSA-N 2 0 222.376 2.439 20 0 BEADRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)S2)[C@H]1CCC[NH2+]1 ZINC000902455698 584609374 /nfs/dbraw/zinc/60/93/74/584609374.db2.gz YIVBMHNFYYSJEE-OFIBSPLFSA-N 2 0 240.416 2.143 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCC(F)(F)C1)C1C[NH2+]C1 ZINC000902457582 584610010 /nfs/dbraw/zinc/61/00/10/584610010.db2.gz UWXWUVWIWKWNPF-VHSXEESVSA-N 2 0 232.318 2.009 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1C[C@@H]2CCC[C@@H]12 ZINC000902459121 584610820 /nfs/dbraw/zinc/61/08/20/584610820.db2.gz XGRDUTMVBIHHPB-PDWCTOEPSA-N 2 0 222.376 2.282 20 0 BEADRP CC1(C)CCC[C@H](C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)O1 ZINC000902461203 584611719 /nfs/dbraw/zinc/61/17/19/584611719.db2.gz LXEHLFWVZSHEQL-JHJVBQTASA-N 2 0 240.391 2.194 20 0 BEADRP C[C@@H]1CC[C@@H](C)[C@@H]([NH2+][C@@H]2C[C@@H]3CC[C@H]2[NH2+]3)C1 ZINC000902462986 584612270 /nfs/dbraw/zinc/61/22/70/584612270.db2.gz YLNXSWLIRCAFNO-IKKURHKOSA-N 2 0 222.376 2.294 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@@H]1CCCC(C)(C)O1 ZINC000902462636 584612643 /nfs/dbraw/zinc/61/26/43/584612643.db2.gz WOBJWPJOLAQZQS-OLZOCXBDSA-N 2 0 242.407 2.441 20 0 BEADRP CC[C@@H]1CCC[C@H]([NH2+][C@@H]2C[C@@H]3CC[C@H]2[NH2+]3)C1 ZINC000902465008 584613426 /nfs/dbraw/zinc/61/34/26/584613426.db2.gz FOPVYEHJMIKGJA-MBJXGIAVSA-N 2 0 222.376 2.438 20 0 BEADRP C1CC12CCC([NH2+][C@@H]1C[C@H]3CC[C@@H]1[NH2+]3)CC2 ZINC000902464793 584613496 /nfs/dbraw/zinc/61/34/96/584613496.db2.gz CTHZDBQZMBSHRQ-FRRDWIJNSA-N 2 0 220.360 2.192 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+][C@@H]2C[C@@H]3CC[C@H]2[NH2+]3)[C@@H]1C ZINC000902465893 584613652 /nfs/dbraw/zinc/61/36/52/584613652.db2.gz HIBYDIQCAAKJHP-BUCHIQEDSA-N 2 0 222.376 2.294 20 0 BEADRP C1CC([C@@H]2CC[C@@H]2[NH2+][C@@H]2C[C@H]3CC[C@@H]2[NH2+]3)C1 ZINC000902466933 584614507 /nfs/dbraw/zinc/61/45/07/584614507.db2.gz OYORRMAFKJNXQV-IKOXMDCHSA-N 2 0 220.360 2.048 20 0 BEADRP CC(C)(C)[C@@H]1CC[C@@H]1[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902468204 584614555 /nfs/dbraw/zinc/61/45/55/584614555.db2.gz MVJZKIJXKGQQQX-OBPIAQAESA-N 2 0 222.376 2.294 20 0 BEADRP CC(C)(C)[C@@H]1CC[C@H]1[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902468205 584614584 /nfs/dbraw/zinc/61/45/84/584614584.db2.gz MVJZKIJXKGQQQX-ZOLYEBIHSA-N 2 0 222.376 2.294 20 0 BEADRP C1CC1[C@H]([NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2)C1CCCC1 ZINC000902467684 584614936 /nfs/dbraw/zinc/61/49/36/584614936.db2.gz RHYWBBQMKLBXKP-LXTVHRRPSA-N 2 0 234.387 2.438 20 0 BEADRP C1CC1[C@@H]([NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2)C1CCCC1 ZINC000902467682 584615002 /nfs/dbraw/zinc/61/50/02/584615002.db2.gz RHYWBBQMKLBXKP-BARDWOONSA-N 2 0 234.387 2.438 20 0 BEADRP FCCC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902467613 584615065 /nfs/dbraw/zinc/61/50/65/584615065.db2.gz PNQVAKVWKCXYGA-ZUWCUPBKSA-N 2 0 240.366 2.387 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@@H]2C[C@@H]3CC[C@H]2[NH2+]3)[C@@H](C)C1 ZINC000902470485 584616292 /nfs/dbraw/zinc/61/62/92/584616292.db2.gz YOXYJNCGPKQTEZ-BBMNEWJDSA-N 2 0 222.376 2.294 20 0 BEADRP CC[C@@H]1CCCC[C@H]1[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902470484 584616411 /nfs/dbraw/zinc/61/64/11/584616411.db2.gz YOVOAPNUAKDCFW-XVIXHAIJSA-N 2 0 222.376 2.438 20 0 BEADRP Cc1nc([C@H](C)[NH2+][C@H]2C[C@H](C[NH3+])C2)c(C)s1 ZINC000902489968 584617300 /nfs/dbraw/zinc/61/73/00/584617300.db2.gz QKRAXXFNKXQDKT-SWPVVBRQSA-N 2 0 239.388 2.148 20 0 BEADRP C[C@@H](CC1CCC1)[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902471511 584617455 /nfs/dbraw/zinc/61/74/55/584617455.db2.gz PVNIUNKRARNTIQ-FTYKPCCVSA-N 2 0 208.349 2.048 20 0 BEADRP C[C@H](CC1CCC1)[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902471512 584617532 /nfs/dbraw/zinc/61/75/32/584617532.db2.gz PVNIUNKRARNTIQ-GWNIPJSYSA-N 2 0 208.349 2.048 20 0 BEADRP C[C@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1ccc(Cl)nc1 ZINC000902491409 584618060 /nfs/dbraw/zinc/61/80/60/584618060.db2.gz XBMCCGNPRJNPIW-QXEWZRGKSA-N 2 0 239.750 2.123 20 0 BEADRP C[C@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1ccc2c(c1)COC2 ZINC000902490802 584618341 /nfs/dbraw/zinc/61/83/41/584618341.db2.gz UBWYGAROZZZWNU-PGUXBMHVSA-N 2 0 246.354 2.105 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+][C@@H]2CCCc3ccccc32)C1 ZINC000902490958 584618359 /nfs/dbraw/zinc/61/83/59/584618359.db2.gz ZHYCZNVMXQQSBO-UXIGCNINSA-N 2 0 230.355 2.391 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1CCCCC[NH2+]1)C1CC1 ZINC000902482432 584623988 /nfs/dbraw/zinc/62/39/88/584623988.db2.gz LDWMDRWWCLFHEE-STQMWFEESA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1cccc(F)c1F ZINC000902485485 584625157 /nfs/dbraw/zinc/62/51/57/584625157.db2.gz LBDGSFXSQVEKCX-GUBZILKMSA-N 2 0 240.297 2.353 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+][C@@H](C2CC2)C2CCCC2)C1 ZINC000902486342 584625444 /nfs/dbraw/zinc/62/54/44/584625444.db2.gz FBLPYBXWXXZJOF-LERXQTSPSA-N 2 0 222.376 2.282 20 0 BEADRP CC(C)(C)[C@H]1CC[C@H]1[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902485697 584625489 /nfs/dbraw/zinc/62/54/89/584625489.db2.gz MWZZQMHMOIOVBS-FIQHERPVSA-N 2 0 210.365 2.138 20 0 BEADRP CC(C)(C)[C@@H]1CC[C@H]1[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902485696 584625496 /nfs/dbraw/zinc/62/54/96/584625496.db2.gz MWZZQMHMOIOVBS-DDHJBXDOSA-N 2 0 210.365 2.138 20 0 BEADRP CC(C)=CCC[C@@H](C)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902486589 584626061 /nfs/dbraw/zinc/62/60/61/584626061.db2.gz ANOHQTZRZDDUIP-JHJVBQTASA-N 2 0 210.365 2.448 20 0 BEADRP C[C@H]1CC([NH2+][C@H]2C[C@H](C[NH3+])C2)C[C@H](C)C1 ZINC000902486649 584626129 /nfs/dbraw/zinc/62/61/29/584626129.db2.gz HPXAVNKJRMYRAD-PRULPYPASA-N 2 0 210.365 2.138 20 0 BEADRP C[C@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1cc(F)cc(F)c1 ZINC000902488113 584626727 /nfs/dbraw/zinc/62/67/27/584626727.db2.gz KGOOAOWRPULQBP-RVBZMBCESA-N 2 0 240.297 2.353 20 0 BEADRP C[C@@H](Cc1ccc(F)cc1)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902487497 584626807 /nfs/dbraw/zinc/62/68/07/584626807.db2.gz HRWDGFPTGQMVDL-JKOKRWQUSA-N 2 0 236.334 2.084 20 0 BEADRP Cc1ncccc1CC[NH2+][C@@H](C)CCCC[NH3+] ZINC000902514104 584629359 /nfs/dbraw/zinc/62/93/59/584629359.db2.gz PWQHUWCUKSFFHS-LBPRGKRZSA-N 2 0 235.375 2.040 20 0 BEADRP CC1(C)C[C@@H]([NH2+]C/C=C/Cl)C[C@@H]([NH3+])C1 ZINC000902517469 584630013 /nfs/dbraw/zinc/63/00/13/584630013.db2.gz HZJWOXNOWALPMO-OKWQPMOJSA-N 2 0 216.756 2.235 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]([NH2+]C/C=C/Cl)C1 ZINC000902521773 584631544 /nfs/dbraw/zinc/63/15/44/584631544.db2.gz UOMAPLIFVKIEKL-GFAPAMAISA-N 2 0 216.756 2.107 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]C/C=C\Cl ZINC000902522043 584631578 /nfs/dbraw/zinc/63/15/78/584631578.db2.gz VPAJFKAIXCHDGE-JVBZPZKUSA-N 2 0 239.750 2.252 20 0 BEADRP CCO[C@H]1CCC[C@H]([NH2+]C[C@H]2CCCN2C)C1 ZINC000903063621 584722979 /nfs/dbraw/zinc/72/29/79/584722979.db2.gz GSVCSFJBWGRPLB-MJBXVCDLSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@H](F)CC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C1CC1 ZINC000903178617 584733125 /nfs/dbraw/zinc/73/31/25/584733125.db2.gz XQNLUYXSNNQOMW-CRMUJIHISA-N 2 0 240.366 2.482 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@H]1[C@@H]1C[C@H]1C)C1CC[NH+](C)CC1 ZINC000903252132 584738767 /nfs/dbraw/zinc/73/87/67/584738767.db2.gz AUHCAFDJWVHHHM-QFCKPIOYSA-N 2 0 236.403 2.351 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H]2C[C@H]2[C@@H]2C[C@H]2C)CC1 ZINC000903254329 584739697 /nfs/dbraw/zinc/73/96/97/584739697.db2.gz SDQSXCUQZUOYPL-REBRKWNGSA-N 2 0 236.403 2.495 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+][C@@H]2C[C@H]2[C@@H]2C[C@H]2C)[C@@H](C)C1 ZINC000903255664 584739804 /nfs/dbraw/zinc/73/98/04/584739804.db2.gz YSZZSTBPMUCYSR-ARSDKDGVSA-N 2 0 236.403 2.351 20 0 BEADRP C[C@@H]1C[C@H]1[C@@H]1C[C@H]1[NH2+][C@@H]1CC[N@H+](C)[C@H]2CCC[C@@H]21 ZINC000903255685 584740061 /nfs/dbraw/zinc/74/00/61/584740061.db2.gz ZEXTZWBFZORWJL-ZPHYEXBNSA-N 2 0 248.414 2.493 20 0 BEADRP C[N@H+]1C[C@H]2CC[C@@H](C1)C2[NH2+][C@@H]1C[C@H]2CCC[C@H]21 ZINC000903319500 584746189 /nfs/dbraw/zinc/74/61/89/584746189.db2.gz VAKYJBIYYMWXEY-SPETUVNMSA-N 2 0 234.387 2.105 20 0 BEADRP COC(C)(C)[C@@H](C)[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC000903330427 584753855 /nfs/dbraw/zinc/75/38/55/584753855.db2.gz JZYHAKHGSSAZBV-VXGBXAGGSA-N 2 0 242.407 2.262 20 0 BEADRP COC(C)(C)[C@H](C)[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC000903330425 584753900 /nfs/dbraw/zinc/75/39/00/584753900.db2.gz JZYHAKHGSSAZBV-NWDGAFQWSA-N 2 0 242.407 2.262 20 0 BEADRP Cc1cc([C@@H]2CCC[N@@H+]2C[C@@H]2CC[C@H]([NH3+])C2)no1 ZINC000903430932 584761681 /nfs/dbraw/zinc/76/16/81/584761681.db2.gz JMFCNMPUVXMELC-DYEKYZERSA-N 2 0 249.358 2.247 20 0 BEADRP C[N@H+](C[C@@H]1CC[C@H]([NH3+])C1)C1Cc2ccccc2C1 ZINC000903432646 584762065 /nfs/dbraw/zinc/76/20/65/584762065.db2.gz IQIHPHGYHRVZKV-DOMZBBRYSA-N 2 0 244.382 2.213 20 0 BEADRP Cc1cccc2c1CC[N@@H+](C[C@@H]1C[NH2+]C[C@H]1C)C2 ZINC000903434601 584762384 /nfs/dbraw/zinc/76/23/84/584762384.db2.gz IPQJHQSKIQSBGG-HIFRSBDPSA-N 2 0 244.382 2.209 20 0 BEADRP CC1(C)CCC[C@H]1[NH2+]C[C@@H]1CC[C@H]([NH3+])C1 ZINC000903458758 584766177 /nfs/dbraw/zinc/76/61/77/584766177.db2.gz IUUFMSKKOKZQIJ-GRYCIOLGSA-N 2 0 210.365 2.282 20 0 BEADRP Cl/C=C\C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C1CC1 ZINC000903445129 584769587 /nfs/dbraw/zinc/76/95/87/584769587.db2.gz RSWNVAZPVMPOLN-XDTAVLJNSA-N 2 0 240.778 2.486 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@@H+]1CCCC2(CCCC2)C1 ZINC000903454800 584773410 /nfs/dbraw/zinc/77/34/10/584773410.db2.gz JXHRRVUQRZEXJH-KGLIPLIRSA-N 2 0 236.403 2.498 20 0 BEADRP CC1(C)CN([C@H]2CCc3ccc(F)cc32)C[C@H]1[NH3+] ZINC000903556323 584782914 /nfs/dbraw/zinc/78/29/14/584782914.db2.gz UVGKJTFHXOFRAF-UONOGXRCSA-N 2 0 248.345 2.482 20 0 BEADRP CCc1cccc(CN2C[C@H]([NH3+])C(C)(C)C2)c1 ZINC000903556670 584782971 /nfs/dbraw/zinc/78/29/71/584782971.db2.gz DMSJBXBBGLQWQE-AWEZNQCLSA-N 2 0 232.371 2.418 20 0 BEADRP C[C@@H]1C[N@H+](Cc2ccccc2CF)CC[C@@H]1[NH3+] ZINC000903716020 584794181 /nfs/dbraw/zinc/79/41/81/584794181.db2.gz GCIMUIGWBYCARK-RISCZKNCSA-N 2 0 236.334 2.325 20 0 BEADRP C[C@@H]1C[N@H+](Cc2ccccc2CF)CC[C@H]1[NH3+] ZINC000903716018 584794253 /nfs/dbraw/zinc/79/42/53/584794253.db2.gz GCIMUIGWBYCARK-BXUZGUMPSA-N 2 0 236.334 2.325 20 0 BEADRP CC1CC(C[N@@H+]2CCC[C@]3(CC[NH2+]C3)C2)C1 ZINC000903751210 584795410 /nfs/dbraw/zinc/79/54/10/584795410.db2.gz FTKYSOJGLFOXSX-JXQTWKCFSA-N 2 0 222.376 2.108 20 0 BEADRP C[C@H]([NH3+])[C@H]1CC[N@H+](Cc2ccccc2CF)C1 ZINC000903744716 584796722 /nfs/dbraw/zinc/79/67/22/584796722.db2.gz XMXQSWWXBFPOSJ-AAEUAGOBSA-N 2 0 236.334 2.325 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CC[N@H+](Cc2ccccc2CF)C1 ZINC000903744718 584796742 /nfs/dbraw/zinc/79/67/42/584796742.db2.gz XMXQSWWXBFPOSJ-WCQYABFASA-N 2 0 236.334 2.325 20 0 BEADRP CC1CC(C[N@@H+]2CC3(C[C@@H]2C)CC[NH2+]CC3)C1 ZINC000903762546 584797636 /nfs/dbraw/zinc/79/76/36/584797636.db2.gz AECIWTCCRRAILJ-MOKVOYLWSA-N 2 0 236.403 2.497 20 0 BEADRP C[N@H+](C[C@H]1CC1(C)C)C[C@H]1CCCC[NH2+]C1 ZINC000903769893 584797971 /nfs/dbraw/zinc/79/79/71/584797971.db2.gz QXQRTESYMMNWKE-QWHCGFSZSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@]12C[N@H+](CCC[NH2+]C3CC3)C[C@H]1[C@H]1CC[C@@H]2C1 ZINC000903826482 584804922 /nfs/dbraw/zinc/80/49/22/584804922.db2.gz KGPPPWRCOZRNLD-LQKXBSAESA-N 2 0 248.414 2.497 20 0 BEADRP C[C@]12C[N@H+](C[C@@H]3CC[C@H]([NH3+])C3)C[C@H]1[C@H]1CC[C@@H]2C1 ZINC000903826310 584804964 /nfs/dbraw/zinc/80/49/64/584804964.db2.gz HVLHWGGPEVHFIH-YUDUXTHKSA-N 2 0 248.414 2.482 20 0 BEADRP C[C@]12C[N@H+](CC[C@@H]3CC[NH2+]C3)C[C@H]1[C@H]1CC[C@@H]2C1 ZINC000903827195 584805010 /nfs/dbraw/zinc/80/50/10/584805010.db2.gz QGEBYSHKSWLOAP-ARKGTOAJSA-N 2 0 248.414 2.354 20 0 BEADRP C[C@]12C[N@H+](CCC[NH2+]C3CC3)C[C@H]1[C@H]1C=C[C@@H]2C1 ZINC000903826953 584805031 /nfs/dbraw/zinc/80/50/31/584805031.db2.gz OYHYBMAYDPLOCR-LQKXBSAESA-N 2 0 246.398 2.273 20 0 BEADRP C[C@@H]1CSCCC[N@@H+]1CCCCCC[NH3+] ZINC000903829788 584805738 /nfs/dbraw/zinc/80/57/38/584805738.db2.gz KMWJYMVEMRPQSZ-GFCCVEGCSA-N 2 0 230.421 2.333 20 0 BEADRP CC(C)=CCC[N@@H+]1CC[C@H]2CC[C@@]21CN ZINC000903856531 584809488 /nfs/dbraw/zinc/80/94/88/584809488.db2.gz ABFUZHQDEOEACN-CHWSQXEVSA-N 2 0 208.349 2.156 20 0 BEADRP [NH3+]Cc1ccc(NCC2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000903918771 584822921 /nfs/dbraw/zinc/82/29/21/584822921.db2.gz HOQAECLLZMAXKH-LQDVMPOASA-N 2 0 245.370 2.088 20 0 BEADRP CC(C)([NH3+])CC[NH2+]Cc1cnc2ccccc2c1 ZINC000903939171 584823065 /nfs/dbraw/zinc/82/30/65/584823065.db2.gz SLEQTSNYLNITRA-UHFFFAOYSA-N 2 0 243.354 2.452 20 0 BEADRP C[C@H]1CC([NH2+]C[C@@H]([NH3+])CC(F)F)C[C@H](C)C1 ZINC000903922124 584823150 /nfs/dbraw/zinc/82/31/50/584823150.db2.gz VEHXOBNBEJVSOC-BBBLOLIVSA-N 2 0 234.334 2.383 20 0 BEADRP CC(C)([NH3+])CC[NH2+]C[C@H]1CCOc2ccccc21 ZINC000903939143 584823248 /nfs/dbraw/zinc/82/32/48/584823248.db2.gz RJUDHLFYBFOCKK-GFCCVEGCSA-N 2 0 248.370 2.270 20 0 BEADRP C[C@H](Cc1cccs1)[NH2+]C[C@H]([NH3+])CC(F)F ZINC000903923259 584823751 /nfs/dbraw/zinc/82/37/51/584823751.db2.gz OZMFWTRPCSLLCO-RKDXNWHRSA-N 2 0 248.342 2.251 20 0 BEADRP CC(C)([NH3+])CC[NH2+]C/C=C\c1ccccc1 ZINC000903938438 584826162 /nfs/dbraw/zinc/82/61/62/584826162.db2.gz ALUIROFNHAVJJS-TWGQIWQCSA-N 2 0 218.344 2.417 20 0 BEADRP C[C@H]1CC2(CCC2)CN1C[C@@H]([NH3+])CC(F)F ZINC000903917812 584827066 /nfs/dbraw/zinc/82/70/66/584827066.db2.gz NSSSCYXVEWBTGX-UWVGGRQHSA-N 2 0 232.318 2.233 20 0 BEADRP CC(C)c1ncc(C[NH2+]CCC(C)(C)[NH3+])s1 ZINC000903938742 584827277 /nfs/dbraw/zinc/82/72/77/584827277.db2.gz IXOXBJNVNVKJLL-UHFFFAOYSA-N 2 0 241.404 2.484 20 0 BEADRP C[C@@H](Cc1ccccc1F)[NH2+]CCC(C)(C)[NH3+] ZINC000903939832 584828937 /nfs/dbraw/zinc/82/89/37/584828937.db2.gz OAQYEZRYPVEIEZ-NSHDSACASA-N 2 0 238.350 2.474 20 0 BEADRP C[C@H]1C[C@H](C[NH2+]Cc2cc(C3CC3)no2)CC[NH2+]1 ZINC000903954097 584831379 /nfs/dbraw/zinc/83/13/79/584831379.db2.gz QAARVUBPEMDOAN-WDEREUQCSA-N 2 0 249.358 2.030 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+]Cc1ccccc1F ZINC000903974250 584832592 /nfs/dbraw/zinc/83/25/92/584832592.db2.gz NFKZGDHUGZDZMU-VXGBXAGGSA-N 2 0 236.334 2.161 20 0 BEADRP C[C@H](CC1CC1)[NH2+]CC[C@@H]1C[NH2+]C[C@H]1C ZINC000903974432 584832723 /nfs/dbraw/zinc/83/27/23/584832723.db2.gz MPBFSVYLMYANCA-NQBHXWOUSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]CC[C@@H]1C[NH2+]C[C@H]1C ZINC000903974433 584832746 /nfs/dbraw/zinc/83/27/46/584832746.db2.gz MPBFSVYLMYANCA-NTZNESFSSA-N 2 0 210.365 2.010 20 0 BEADRP CC[C@@H]1CCC[C@@H]([NH2+][C@@H]2C[NH2+]C[C@H]2C)C1 ZINC000903964090 584833812 /nfs/dbraw/zinc/83/38/12/584833812.db2.gz LHTFSQQFQJEZLJ-FDYHWXHSSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+]Cc1ccc(Cl)cc1 ZINC000903963999 584833877 /nfs/dbraw/zinc/83/38/77/584833877.db2.gz DDJZHQDORTUCDH-PWSUYJOCSA-N 2 0 238.762 2.285 20 0 BEADRP Cc1ccc(C[NH2+]C[C@@H]2C[NH2+]C[C@H]2C)cc1F ZINC000903964015 584833995 /nfs/dbraw/zinc/83/39/95/584833995.db2.gz DXUAXNVLIACOMQ-YPMHNXCESA-N 2 0 236.334 2.079 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+][C@@H]1CCC[C@@H](C)[C@H]1C ZINC000903964109 584834222 /nfs/dbraw/zinc/83/42/22/584834222.db2.gz LXPUGVWQDGQARB-SYLRKERUSA-N 2 0 210.365 2.009 20 0 BEADRP Cc1cc(C[NH2+]C[C@@H]2C[NH2+]C[C@H]2C)ccc1F ZINC000903964656 584834247 /nfs/dbraw/zinc/83/42/47/584834247.db2.gz NHXJDSIKBRVOPK-YPMHNXCESA-N 2 0 236.334 2.079 20 0 BEADRP CC[C@H]1CCC[C@@H]([NH2+]C[C@@H]2C[NH2+]C[C@H]2C)C1 ZINC000903967052 584834475 /nfs/dbraw/zinc/83/44/75/584834475.db2.gz FONGHLKMWMPSAU-ZOBORPQBSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+][C@@H]1CC[C@@H](C)C[C@@H]1C ZINC000903965018 584834769 /nfs/dbraw/zinc/83/47/69/584834769.db2.gz YHXJEIJDYIDYDB-NZEXEKPDSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+]C[C@@H]1CCC[C@@H](C)C1 ZINC000903968318 584834906 /nfs/dbraw/zinc/83/49/06/584834906.db2.gz SEHKKPCVNBLELM-SYQHCUMBSA-N 2 0 224.392 2.258 20 0 BEADRP CC(C)[C@H]1CCC[C@@H]1[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000903968510 584835098 /nfs/dbraw/zinc/83/50/98/584835098.db2.gz XAAGGGOBUVJCKU-RQJABVFESA-N 2 0 224.392 2.256 20 0 BEADRP CC(C)[C@H]1CCC[C@H]1[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000903968512 584835197 /nfs/dbraw/zinc/83/51/97/584835197.db2.gz XAAGGGOBUVJCKU-XJFOESAGSA-N 2 0 224.392 2.256 20 0 BEADRP CCc1ccc(C[N@H+](C)C[C@H]2C[C@@H]([NH3+])C2)cc1 ZINC000904302279 584861858 /nfs/dbraw/zinc/86/18/58/584861858.db2.gz UIXWBESBMADBKX-GASCZTMLSA-N 2 0 232.371 2.418 20 0 BEADRP C[N@H+](CCCOc1ccccc1)C[C@H]1C[C@@H]([NH3+])C1 ZINC000904311438 584862524 /nfs/dbraw/zinc/86/25/24/584862524.db2.gz BNHNSVZUROKYQY-OKILXGFUSA-N 2 0 248.370 2.125 20 0 BEADRP CCS[C@@H]1CCCC[N@H+](C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000904321366 584863899 /nfs/dbraw/zinc/86/38/99/584863899.db2.gz XUAKCJGQIJATFY-FRRDWIJNSA-N 2 0 242.432 2.331 20 0 BEADRP C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@@H+]1C[C@H]1C[C@@H]([NH3+])C1 ZINC000904321320 584864129 /nfs/dbraw/zinc/86/41/29/584864129.db2.gz WKZXERGMKPHTTR-DGTMBMJNSA-N 2 0 222.376 2.377 20 0 BEADRP C[C@H]1Cc2ccccc2C[N@@H+]1C[C@H]1C[C@@H]([NH3+])C1 ZINC000904323756 584865017 /nfs/dbraw/zinc/86/50/17/584865017.db2.gz RXPLEBMVAOTOHE-SLEUVZQESA-N 2 0 230.355 2.171 20 0 BEADRP CCSCC[C@@H](C)[N@H+](C)C[C@H]1C[C@@H]([NH3+])C1 ZINC000904327011 584865358 /nfs/dbraw/zinc/86/53/58/584865358.db2.gz WSHBILUMXCZOJZ-UTUOFQBUSA-N 2 0 230.421 2.187 20 0 BEADRP CCS[C@H]1CC[C@H]([N@H+](C)C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000904325959 584865589 /nfs/dbraw/zinc/86/55/89/584865589.db2.gz AAKKGWVSOXTOGV-RNJOBUHISA-N 2 0 242.432 2.330 20 0 BEADRP COCC(C)(C)[NH2+]C[C@H]([NH3+])CCC(C)(C)C ZINC000904328526 584865650 /nfs/dbraw/zinc/86/56/50/584865650.db2.gz QKISAHJUDBAXIZ-LLVKDONJSA-N 2 0 230.396 2.155 20 0 BEADRP COc1ccccc1C(C)(C)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000904328723 584865746 /nfs/dbraw/zinc/86/57/46/584865746.db2.gz RQLDAAIOZNPQRP-TXEJJXNPSA-N 2 0 248.370 2.257 20 0 BEADRP CC[C@](C)([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1nccs1 ZINC000904329202 584866107 /nfs/dbraw/zinc/86/61/07/584866107.db2.gz MNUVUDPCJBOIMI-UMNHJUIQSA-N 2 0 239.388 2.095 20 0 BEADRP CCC[C@@](C)(CO)[NH2+]C[C@H]([NH3+])CCC(C)(C)C ZINC000904330037 584866197 /nfs/dbraw/zinc/86/61/97/584866197.db2.gz XJNUHWJVHBFKKA-OCCSQVGLSA-N 2 0 244.423 2.281 20 0 BEADRP C[C@@H]1COCCN(C[C@@H]([NH3+])CCC(C)(C)C)C1 ZINC000904340133 584866360 /nfs/dbraw/zinc/86/63/60/584866360.db2.gz DLXRAWBSOIZFEV-STQMWFEESA-N 2 0 242.407 2.108 20 0 BEADRP C[NH2+]CCNCc1ccc(C(F)F)c(F)c1 ZINC000904353458 584869843 /nfs/dbraw/zinc/86/98/43/584869843.db2.gz NGJJLTMIGWKBDM-UHFFFAOYSA-N 2 0 232.249 2.072 20 0 BEADRP Cc1ccc(CC[NH2+]C2CC(C[NH3+])C2)c(C)c1 ZINC000904359835 584871763 /nfs/dbraw/zinc/87/17/63/584871763.db2.gz DXGTWIHPAAAXKZ-UHFFFAOYSA-N 2 0 232.371 2.173 20 0 BEADRP CC(C)(C)CC[C@H]([NH3+])CN[C@H](C[NH3+])C(C)(C)C ZINC000904357688 584871996 /nfs/dbraw/zinc/87/19/96/584871996.db2.gz ADFLAMVBUQUDAB-NWDGAFQWSA-N 2 0 243.439 2.103 20 0 BEADRP [NH3+]CC1CC([NH2+][C@H]2C[C@@H]2C2CCCCC2)C1 ZINC000904367572 584872758 /nfs/dbraw/zinc/87/27/58/584872758.db2.gz FIOFGXZGUHRILF-HOFDXXJLSA-N 2 0 222.376 2.282 20 0 BEADRP [NH3+]CC1CC([NH2+][C@@H]2C[C@H]2C2CCCCC2)C1 ZINC000904367569 584872792 /nfs/dbraw/zinc/87/27/92/584872792.db2.gz FIOFGXZGUHRILF-AKUTZHFWSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@@H]1CC[C@@H](C[NH2+]C[C@H]([NH3+])CCC(C)(C)C)O1 ZINC000904370540 584873307 /nfs/dbraw/zinc/87/33/07/584873307.db2.gz AIGQTHGZHQCFPI-UPJWGTAASA-N 2 0 242.407 2.297 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+]CCc2ccc(Cl)s2)C1 ZINC000904363100 584874362 /nfs/dbraw/zinc/87/43/62/584874362.db2.gz BDHMMFDUFAEZBQ-DTORHVGOSA-N 2 0 244.791 2.271 20 0 BEADRP [NH3+]CC1CC([NH2+]Cc2c(F)cccc2Cl)C1 ZINC000904363083 584874568 /nfs/dbraw/zinc/87/45/68/584874568.db2.gz AOILNLGDGXIFSD-UHFFFAOYSA-N 2 0 242.725 2.306 20 0 BEADRP [NH3+]CC1CC([NH2+][C@@H]2CCc3c2cccc3F)C1 ZINC000904366808 584874665 /nfs/dbraw/zinc/87/46/65/584874665.db2.gz PWFLLTSRQKWLAE-RPFQZYLTSA-N 2 0 234.318 2.140 20 0 BEADRP CC(C)C[N@@H+](Cc1ccccn1)C[C@H]1C[C@@H]([NH3+])C1 ZINC000904388407 584874878 /nfs/dbraw/zinc/87/48/78/584874878.db2.gz IVDCSCLAGOGUCB-OKILXGFUSA-N 2 0 247.386 2.277 20 0 BEADRP CC(C)(C)CC[C@H]([NH3+])C[NH2+][C@H]1C=CCC1 ZINC000904377790 584875851 /nfs/dbraw/zinc/87/58/51/584875851.db2.gz YUKVBXLKCXOKHL-RYUDHWBXSA-N 2 0 210.365 2.448 20 0 BEADRP C[C@H]1C[N@H+](C[C@H]2C[C@@H]([NH3+])C2)Cc2ccccc21 ZINC000904383809 584877117 /nfs/dbraw/zinc/87/71/17/584877117.db2.gz DXMXDHYKGPHWPQ-SGMGOOAPSA-N 2 0 230.355 2.343 20 0 BEADRP C/C=C\C[C@@H]1CCC[N@H+](C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000904381648 584877234 /nfs/dbraw/zinc/87/72/34/584877234.db2.gz QRVGJGHZWPZDOR-IYIFEETDSA-N 2 0 222.376 2.402 20 0 BEADRP CC[C@@H]([NH2+]C1CC(C[NH3+])C1)c1ccccc1OC ZINC000904385283 584877962 /nfs/dbraw/zinc/87/79/62/584877962.db2.gz UQOCPKNPBZRSII-ORHYLEIMSA-N 2 0 248.370 2.473 20 0 BEADRP [NH3+]CC1CC([NH2+][C@H]2c3ccccc3CC[C@@H]2F)C1 ZINC000904386020 584877992 /nfs/dbraw/zinc/87/79/92/584877992.db2.gz MZEISRLQRYBSNO-HCJITBMDSA-N 2 0 248.345 2.339 20 0 BEADRP [NH3+]CC[C@@H]1CC[N@H+](Cc2cccc3c2CCC3)C1 ZINC000904406269 584878278 /nfs/dbraw/zinc/87/82/78/584878278.db2.gz DKLIQDPFLWVDGP-CYBMUJFWSA-N 2 0 244.382 2.346 20 0 BEADRP C[C@@H]1C[N@H+](CC2(C)CCC2)CC[C@H]1C[NH3+] ZINC000904409384 584879156 /nfs/dbraw/zinc/87/91/56/584879156.db2.gz ASWKSAOBKIMVPI-NEPJUHHUSA-N 2 0 210.365 2.093 20 0 BEADRP C[C@H]1C[N@H+](Cc2ccsc2)CC[C@H]1C[NH3+] ZINC000904410875 584879288 /nfs/dbraw/zinc/87/92/88/584879288.db2.gz HBLFFCDXSVGHKK-JQWIXIFHSA-N 2 0 224.373 2.165 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@@H](C[NH3+])[C@H](C)C2)s1 ZINC000904412779 584879688 /nfs/dbraw/zinc/87/96/88/584879688.db2.gz XPOVGVRLOZEMHS-PWSUYJOCSA-N 2 0 238.400 2.473 20 0 BEADRP C[N@@H+]1CCC[C@@H](CC[NH2+]C[C@@H]2CCC=CO2)C1 ZINC000839181971 585096696 /nfs/dbraw/zinc/09/66/96/585096696.db2.gz KVZGWZUMVYZUQT-KBPBESRZSA-N 2 0 238.375 2.001 20 0 BEADRP C[N@H+](CC1CC1)C[C@@H]1CCN(C/C=C/Cl)C1 ZINC000747530974 585180479 /nfs/dbraw/zinc/18/04/79/585180479.db2.gz ASXONKRLFQMDAK-NHEDYWLLSA-N 2 0 242.794 2.403 20 0 BEADRP C[NH+](C)[C@H]1CCC[C@@H]([NH2+]C2CC(C(F)F)C2)C1 ZINC000769528249 585558793 /nfs/dbraw/zinc/55/87/93/585558793.db2.gz UVNQZSGLPGKCLI-RSJDFQLWSA-N 2 0 246.345 2.493 20 0 BEADRP CC[N@@H+]1CCC[C@@H](C[NH2+]C[C@H]2CCC=CO2)C1 ZINC000774988687 585670117 /nfs/dbraw/zinc/67/01/17/585670117.db2.gz FNNIGHGXKYCZPY-UONOGXRCSA-N 2 0 238.375 2.001 20 0 BEADRP CC[N@@H+]1CCC[C@@H](C[NH2+]C[C@@H]2CCC=CO2)C1 ZINC000774988684 585670204 /nfs/dbraw/zinc/67/02/04/585670204.db2.gz FNNIGHGXKYCZPY-KBPBESRZSA-N 2 0 238.375 2.001 20 0 BEADRP C[C@@H](C1CC1)[N@@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000782182456 585810089 /nfs/dbraw/zinc/81/00/89/585810089.db2.gz HDFFEUIWFGNBND-QWHCGFSZSA-N 2 0 222.376 2.203 20 0 BEADRP CCC[N@H+](C)C[C@@H]1CC[NH+]([C@@H](C)C2CC2)C1 ZINC000782185548 585810258 /nfs/dbraw/zinc/81/02/58/585810258.db2.gz HGSNFLPSTGCFKQ-STQMWFEESA-N 2 0 224.392 2.449 20 0 BEADRP C[C@@H](C1CC1)[N@@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000782182457 585810323 /nfs/dbraw/zinc/81/03/23/585810323.db2.gz HDFFEUIWFGNBND-STQMWFEESA-N 2 0 222.376 2.203 20 0 BEADRP CC(C)[C@@H](C)[N@H+](C)CC1CC[NH+](C)CC1 ZINC000782183267 585810839 /nfs/dbraw/zinc/81/08/39/585810839.db2.gz JRAPDXNPCIWQKA-GFCCVEGCSA-N 2 0 212.381 2.305 20 0 BEADRP CC[C@@H]1CCC[N@H+](CC2CC[NH+](C)CC2)C1 ZINC000788471701 585925201 /nfs/dbraw/zinc/92/52/01/585925201.db2.gz YBLXCRTWAFKZEW-CYBMUJFWSA-N 2 0 224.392 2.450 20 0 BEADRP C[NH+]1CCC2(CCC[N@@H+]2Cc2ccoc2)CC1 ZINC000789559617 585944171 /nfs/dbraw/zinc/94/41/71/585944171.db2.gz QWUFVCUONZXTBJ-UHFFFAOYSA-N 2 0 234.343 2.340 20 0 BEADRP CC(C)CC(N)=[NH+]OCCC[NH+]1CCCCC1 ZINC000808254634 586469061 /nfs/dbraw/zinc/46/90/61/586469061.db2.gz MDBQDHDLBTXVPT-UHFFFAOYSA-N 2 0 241.379 2.407 20 0 BEADRP c1csc(CC[NH+]2CCC3(CC[NH2+]3)CC2)c1 ZINC000817880414 586832227 /nfs/dbraw/zinc/83/22/27/586832227.db2.gz SNUGCOBVUAGXGJ-UHFFFAOYSA-N 2 0 236.384 2.119 20 0 BEADRP Cc1cccc(F)c1C[NH2+][C@@H](C)C[C@@H](C)[NH3+] ZINC000817896977 586835092 /nfs/dbraw/zinc/83/50/92/586835092.db2.gz AUQMRYXSMNMWPL-MNOVXSKESA-N 2 0 224.323 2.350 20 0 BEADRP CSC(C)(C)C[NH2+]C1CCC(C[NH3+])CC1 ZINC000817897989 586835204 /nfs/dbraw/zinc/83/52/04/586835204.db2.gz BCZOFDQBEYHSGG-UHFFFAOYSA-N 2 0 230.421 2.235 20 0 BEADRP CSC(C)(C)C[NH2+][C@@H]1CCCCC[C@@H]1[NH3+] ZINC000817900318 586836470 /nfs/dbraw/zinc/83/64/70/586836470.db2.gz ODHXNDRQGVGNSF-WDEREUQCSA-N 2 0 230.421 2.378 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]CCSC(C)(C)C ZINC000817907649 586836689 /nfs/dbraw/zinc/83/66/89/586836689.db2.gz GZZKDTQVEUNYOX-VXGBXAGGSA-N 2 0 244.448 2.496 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]CCC1CCC1 ZINC000817907875 586836999 /nfs/dbraw/zinc/83/69/99/586836999.db2.gz YBTPFUXVVYFQCQ-OLZOCXBDSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@@H](CSC(C)(C)C)[NH2+]C1CC[NH2+]CC1 ZINC000817936875 586844584 /nfs/dbraw/zinc/84/45/84/586844584.db2.gz RYANTABBUIZTDE-JTQLQIEISA-N 2 0 230.421 2.248 20 0 BEADRP CCOc1cccc([C@H](C)[NH2+]CCC[NH2+]C)c1 ZINC000817941269 586845029 /nfs/dbraw/zinc/84/50/29/586845029.db2.gz QTSKMECOLKFKNE-LBPRGKRZSA-N 2 0 236.359 2.345 20 0 BEADRP CC[C@@H]([NH2+]CCC[NH2+]C)c1ccc2c(c1)CCO2 ZINC000817941332 586845036 /nfs/dbraw/zinc/84/50/36/586845036.db2.gz SUAVFEYYHRVALB-CQSZACIVSA-N 2 0 248.370 2.272 20 0 BEADRP C[C@H](CSC(C)(C)C)[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000817945542 586845866 /nfs/dbraw/zinc/84/58/66/586845866.db2.gz FWYQBJNSKOGRQD-VXGBXAGGSA-N 2 0 244.448 2.496 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H](C)c1ccc2c(c1)CCO2 ZINC000817944011 586846266 /nfs/dbraw/zinc/84/62/66/586846266.db2.gz VREZQYRNWKMHFL-LBPRGKRZSA-N 2 0 248.370 2.272 20 0 BEADRP CC[C@@H]([NH2+]Cc1ccc(CC[NH3+])cc1)C1CC1 ZINC000817949944 586847177 /nfs/dbraw/zinc/84/71/77/586847177.db2.gz URIANJCRQNJNIH-OAHLLOKOSA-N 2 0 232.371 2.466 20 0 BEADRP C[C@@H](CSC(C)(C)C)[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000817955532 586849713 /nfs/dbraw/zinc/84/97/13/586849713.db2.gz YAZAKHHLYVBZGP-RYUDHWBXSA-N 2 0 244.448 2.496 20 0 BEADRP C[C@H](CSC(C)(C)C)[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000817955533 586849769 /nfs/dbraw/zinc/84/97/69/586849769.db2.gz YAZAKHHLYVBZGP-VXGBXAGGSA-N 2 0 244.448 2.496 20 0 BEADRP Cc1cc(F)ccc1[C@H](C)[NH2+]C[C@H](C)C[NH3+] ZINC000817961617 586853117 /nfs/dbraw/zinc/85/31/17/586853117.db2.gz AZMVEYLYAZMDDD-KOLCDFICSA-N 2 0 224.323 2.380 20 0 BEADRP CCOc1cccc([C@@H](C)[NH2+]C[C@H](C)C[NH3+])c1 ZINC000817961831 586853348 /nfs/dbraw/zinc/85/33/48/586853348.db2.gz DHKHZPCIIUSOAO-VXGBXAGGSA-N 2 0 236.359 2.331 20 0 BEADRP Cc1ccc2c(c1)CC[C@H]2[NH2+]CC1([NH3+])CCC1 ZINC000817965772 586854957 /nfs/dbraw/zinc/85/49/57/586854957.db2.gz ZVKRUEJQBKWLLA-CQSZACIVSA-N 2 0 230.355 2.453 20 0 BEADRP C[C@H]([NH3+])C[NH2+]C1CCC(C(F)(F)F)CC1 ZINC000817971341 586859173 /nfs/dbraw/zinc/85/91/73/586859173.db2.gz CNTAMPREEPUCCR-UEJVZZJDSA-N 2 0 224.270 2.044 20 0 BEADRP Cc1cccc2c1CC[N@H+](CC1CC[NH2+]CC1)C2 ZINC000823596473 587232420 /nfs/dbraw/zinc/23/24/20/587232420.db2.gz NRZZWZZWLAXXDL-UHFFFAOYSA-N 2 0 244.382 2.353 20 0 BEADRP CC[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CSC[C@@H]2C)C1 ZINC000823736913 587238654 /nfs/dbraw/zinc/23/86/54/587238654.db2.gz OPBQWUZRPJEWLH-YNEHKIRRSA-N 2 0 242.432 2.059 20 0 BEADRP CC[N@@H+]1CCC[C@H](C[NH2+][C@H]2CSC[C@H]2C)C1 ZINC000823736911 587238738 /nfs/dbraw/zinc/23/87/38/587238738.db2.gz OPBQWUZRPJEWLH-UPJWGTAASA-N 2 0 242.432 2.059 20 0 BEADRP CCCN1CCC[C@H]1C[NH2+][C@H]1CSC[C@@H]1C ZINC000824377073 587268304 /nfs/dbraw/zinc/26/83/04/587268304.db2.gz SQTXMNBNZRFSHP-AVGNSLFASA-N 2 0 242.432 2.202 20 0 BEADRP C[N@H+](CCC[NH2+][C@@H]1CCOC1)C1CCCCC1 ZINC000104064887 587930191 /nfs/dbraw/zinc/93/01/91/587930191.db2.gz RQGGDWVDYWKZGQ-CYBMUJFWSA-N 2 0 240.391 2.020 20 0 BEADRP CC[C@@](C)([NH2+]CCC[NH3+])c1ccccc1 ZINC000841010922 587935347 /nfs/dbraw/zinc/93/53/47/587935347.db2.gz WGINNGDCMFUJFL-CYBMUJFWSA-N 2 0 206.333 2.250 20 0 BEADRP Cc1cc(C[NH2+][C@H](C)CCC[NH3+])cnc1Cl ZINC000841078925 587944622 /nfs/dbraw/zinc/94/46/22/587944622.db2.gz DJVMOJLUOBKHMO-SNVBAGLBSA-N 2 0 241.766 2.260 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]Cc1cncc2ccccc21 ZINC000841080758 587944938 /nfs/dbraw/zinc/94/49/38/587944938.db2.gz PZWSSPVSSKBAQZ-GFCCVEGCSA-N 2 0 243.354 2.452 20 0 BEADRP CCCCCC[C@@H](C)[NH2+]C[C@@H]1C[NH2+]CCCO1 ZINC000841085440 587945638 /nfs/dbraw/zinc/94/56/38/587945638.db2.gz CLDOZFCXAJZUFY-KGLIPLIRSA-N 2 0 242.407 2.313 20 0 BEADRP CCCCCC[C@H](C)[NH2+]C[C@H]1C[NH2+]CCCO1 ZINC000841085441 587945821 /nfs/dbraw/zinc/94/58/21/587945821.db2.gz CLDOZFCXAJZUFY-UONOGXRCSA-N 2 0 242.407 2.313 20 0 BEADRP Cc1cc([C@H]2CCC[N@@H+]2CC[C@H]2CC[NH2+]C2)no1 ZINC000842471444 588029329 /nfs/dbraw/zinc/02/93/29/588029329.db2.gz BJRKOSCIOVSKER-TZMCWYRMSA-N 2 0 249.358 2.120 20 0 BEADRP CC(C)[C@H]1C[C@@H]([NH2+]CCCCCC[NH3+])CCO1 ZINC000843128185 588082587 /nfs/dbraw/zinc/08/25/87/588082587.db2.gz VEHNXNBHDLVEPE-UONOGXRCSA-N 2 0 242.407 2.299 20 0 BEADRP CC[C@H]1C[C@H](C[NH2+]CCCCCC[NH3+])CCO1 ZINC000843127992 588085083 /nfs/dbraw/zinc/08/50/83/588085083.db2.gz SNNPNCPPAAJNRN-KGLIPLIRSA-N 2 0 242.407 2.300 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]Cc1cncc2ccccc21 ZINC000843127996 588085333 /nfs/dbraw/zinc/08/53/33/588085333.db2.gz GRGFQYNYFKDEHF-RYUDHWBXSA-N 2 0 243.354 2.450 20 0 BEADRP CCn1ccnc1[C@@H](C)[NH2+]CCCCCC[NH3+] ZINC000843342094 588101030 /nfs/dbraw/zinc/10/10/30/588101030.db2.gz NHTBIMGUEQWRPL-GFCCVEGCSA-N 2 0 238.379 2.073 20 0 BEADRP COCC[C@@H]1CCC[C@@H]1[NH2+]CCCCCC[NH3+] ZINC000843342912 588101398 /nfs/dbraw/zinc/10/13/98/588101398.db2.gz VCYRYHAYGAIKRQ-KBPBESRZSA-N 2 0 242.407 2.300 20 0 BEADRP [NH3+]CCCCCC[NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000843344087 588101438 /nfs/dbraw/zinc/10/14/38/588101438.db2.gz QAEBFSLSWHGMJC-CABCVRRESA-N 3 0 247.386 2.240 20 0 BEADRP C[N@H+](CCCCCCC[NH3+])C1CCC([NH3+])CC1 ZINC000843354930 588103319 /nfs/dbraw/zinc/10/33/19/588103319.db2.gz MBZDPKAUEJFDHM-UHFFFAOYSA-N 3 0 241.423 2.097 20 0 BEADRP C[N@H+](C[C@@H]1CC[NH2+]C1)[C@H]1CCc2ccccc2C1 ZINC000843358333 588103636 /nfs/dbraw/zinc/10/36/36/588103636.db2.gz KYGNBVCLBFKWFG-CJNGLKHVSA-N 2 0 244.382 2.085 20 0 BEADRP [NH3+]CCCCCCC[N@@H+]1CCCC[C@H]1CC[NH3+] ZINC000843384587 588105808 /nfs/dbraw/zinc/10/58/08/588105808.db2.gz UKZITKRQDMAKEO-AWEZNQCLSA-N 2 0 241.423 2.099 20 0 BEADRP CC[N@H+](CCCCCC[NH3+])CCc1ccccn1 ZINC000846219889 588260723 /nfs/dbraw/zinc/26/07/23/588260723.db2.gz AYRQJJSNSZZEGY-UHFFFAOYSA-N 2 0 249.402 2.465 20 0 BEADRP [NH3+]CCCCCC[N@@H+]1CCC[C@H]2COCC[C@H]21 ZINC000846219038 588260848 /nfs/dbraw/zinc/26/08/48/588260848.db2.gz DFPBIWTYDBQHEH-UONOGXRCSA-N 2 0 240.391 2.006 20 0 BEADRP C[C@@H]1CC2(C[N@@H+]1C/C=C\Cl)CC[NH2+]CC2 ZINC000846224461 588261799 /nfs/dbraw/zinc/26/17/99/588261799.db2.gz XSVZKOZBQZQQDA-SRMRHOMVSA-N 2 0 228.767 2.203 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H]2CC[C@@H]2C2CC2)C1 ZINC000848559515 588397172 /nfs/dbraw/zinc/39/71/72/588397172.db2.gz XURQFBOPEALVKX-CABNGKKXSA-N 2 0 222.376 2.105 20 0 BEADRP CC[C@@H]1C[C@H](C[NH2+]CC2([NH3+])CCCC2)CCO1 ZINC000849349555 588474177 /nfs/dbraw/zinc/47/41/77/588474177.db2.gz AGYUFFFULSZEHO-CHWSQXEVSA-N 2 0 240.391 2.053 20 0 BEADRP C1=C[C@H]([NH2+]C2CC[NH+](CC3CC3)CC2)CC1 ZINC000850511954 588555878 /nfs/dbraw/zinc/55/58/78/588555878.db2.gz RNZRXSFRIIQUHG-ZDUSSCGKSA-N 2 0 220.360 2.169 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@H]2C=CCC2)[C@@H](C)C1 ZINC000850512180 588555895 /nfs/dbraw/zinc/55/58/95/588555895.db2.gz XFVUSODSKGYYES-AVGNSLFASA-N 2 0 208.349 2.025 20 0 BEADRP C1=C[C@@H]([NH2+]C2CC[NH+](CC3CC3)CC2)CC1 ZINC000850511953 588556161 /nfs/dbraw/zinc/55/61/61/588556161.db2.gz RNZRXSFRIIQUHG-CYBMUJFWSA-N 2 0 220.360 2.169 20 0 BEADRP CCC(CC)NC(=[NH2+])NCC[N@H+](CC)C(C)C ZINC000864456738 589367610 /nfs/dbraw/zinc/36/76/10/589367610.db2.gz LDALOMWUYSSBAE-UHFFFAOYSA-N 2 0 242.411 2.019 20 0 BEADRP C[N@H+](CC1CC[NH+](C)CC1)C1CCCC1 ZINC000120089507 589375772 /nfs/dbraw/zinc/37/57/72/589375772.db2.gz ADNLKLCHQZWTTL-UHFFFAOYSA-N 2 0 210.365 2.203 20 0 BEADRP C[C@H](CCc1cccnc1)[NH2+][C@@H](C)CC[NH+](C)C ZINC000866250215 589482835 /nfs/dbraw/zinc/48/28/35/589482835.db2.gz WOBVRYJPWUCNNM-KGLIPLIRSA-N 2 0 249.402 2.333 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H]2C[C@H](SC)C2)CC1 ZINC000866486694 589496238 /nfs/dbraw/zinc/49/62/38/589496238.db2.gz OFLYLVFNNQZRON-JOCQHMNTSA-N 2 0 242.432 2.344 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+][C@H]2C[C@H](SC)C2)[C@@H](C)C1 ZINC000866486623 589496603 /nfs/dbraw/zinc/49/66/03/589496603.db2.gz MPAZCTVLTBBWCJ-ZDEQEGDKSA-N 2 0 242.432 2.200 20 0 BEADRP N[C@H]1CCCCC[N@H+](CCCCCCC[NH3+])C1 ZINC000866671695 589510652 /nfs/dbraw/zinc/51/06/52/589510652.db2.gz YLVZRVORNFAXNO-AWEZNQCLSA-N 2 0 241.423 2.099 20 0 BEADRP C[N@@H+](Cc1ccc2cc[nH]c2c1)C[C@@H]1CC[NH2+]C1 ZINC000866717785 589515129 /nfs/dbraw/zinc/51/51/29/589515129.db2.gz OYRVFUYAKYPBOD-CYBMUJFWSA-N 2 0 243.354 2.209 20 0 BEADRP C[C@@H]([NH2+]CCC[NH3+])c1ccc(C(F)(F)F)nc1 ZINC000872155477 589886182 /nfs/dbraw/zinc/88/61/82/589886182.db2.gz UGSJMKZSGQMXRI-MRVPVSSYSA-N 2 0 247.264 2.100 20 0 BEADRP COCC1([N@H+](C)CCCCCC[NH3+])CCC1 ZINC000872157640 589886211 /nfs/dbraw/zinc/88/62/11/589886211.db2.gz OVXBXKLQUIXGQS-UHFFFAOYSA-N 2 0 228.380 2.006 20 0 BEADRP CC[N@@H+]1CCC[C@@H]1CNc1cc[nH+]cc1C1CC1 ZINC000872388504 589930991 /nfs/dbraw/zinc/93/09/91/589930991.db2.gz RQVNVDRCWURHFV-CYBMUJFWSA-N 2 0 245.370 2.277 20 0 BEADRP C[NH+](C)C(C)(C)CNc1cc[nH+]cc1C1CC1 ZINC000872390710 589931213 /nfs/dbraw/zinc/93/12/13/589931213.db2.gz IXYIHGUCOYGTPC-UHFFFAOYSA-N 2 0 233.359 2.133 20 0 BEADRP c1cc(N[C@@H]2CC[N@@H+](C3CC3)C2)c(C2CC2)c[nH+]1 ZINC000872422317 589938616 /nfs/dbraw/zinc/93/86/16/589938616.db2.gz KNMJMIIATQXQJS-GFCCVEGCSA-N 2 0 243.354 2.030 20 0 BEADRP CC(C)[N@H+](C)CCNc1cc[nH+]cc1C1CC1 ZINC000872439916 589939926 /nfs/dbraw/zinc/93/99/26/589939926.db2.gz SSKPJDRGELKRIM-UHFFFAOYSA-N 2 0 233.359 2.133 20 0 BEADRP C[N@H+]1CC=C(CNc2cc[nH+]cc2C2CC2)CC1 ZINC000872502819 589945083 /nfs/dbraw/zinc/94/50/83/589945083.db2.gz PZMUVVXOHCRVIJ-UHFFFAOYSA-N 2 0 243.354 2.055 20 0 BEADRP Cc1cc(N2CC[C@@H]3[C@@H]2CCC[N@H+]3C)cc[nH+]1 ZINC000872780118 589969769 /nfs/dbraw/zinc/96/97/69/589969769.db2.gz JQLNXHOTOOJGPE-KGLIPLIRSA-N 2 0 231.343 2.063 20 0 BEADRP Cc1cc(N2CC[C@@H]3[C@H]2CCC[N@H+]3C)cc[nH+]1 ZINC000872780120 589969826 /nfs/dbraw/zinc/96/98/26/589969826.db2.gz JQLNXHOTOOJGPE-ZIAGYGMSSA-N 2 0 231.343 2.063 20 0 BEADRP C[NH+](C)CCCCCCC[NH2+]Cc1ccon1 ZINC000873024494 589980252 /nfs/dbraw/zinc/98/02/52/589980252.db2.gz SKSXQWPECAUWNV-UHFFFAOYSA-N 2 0 239.363 2.276 20 0 BEADRP CC(C)(C)[NH2+]CCN1CC[C@H]2CSC[C@H]2C1 ZINC000873221918 589999960 /nfs/dbraw/zinc/99/99/60/589999960.db2.gz TYOKECOOZIEUIP-NWDGAFQWSA-N 2 0 242.432 2.059 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[C@H](C)C1)C1CC[NH2+]CC1 ZINC000873222217 590000129 /nfs/dbraw/zinc/00/01/29/590000129.db2.gz GXRKCHJPEYRNFU-GVXVVHGQSA-N 2 0 210.365 2.153 20 0 BEADRP COCCC1([NH2+]CCCC(C)C)CC[NH2+]CC1 ZINC000873224646 590000378 /nfs/dbraw/zinc/00/03/78/590000378.db2.gz DPQPEOHBKPBALX-UHFFFAOYSA-N 2 0 242.407 2.171 20 0 BEADRP CC(C)(C)[C@@]1(C[NH3+])CC[N@H+](CC2(C)CC2)C1 ZINC000873223961 590001294 /nfs/dbraw/zinc/00/12/94/590001294.db2.gz VTVJESDEZYHQLR-CQSZACIVSA-N 2 0 224.392 2.483 20 0 BEADRP CCC(CC)C[NH2+][C@]12CCC[C@@H]1[NH2+]CC2 ZINC000873229813 590002390 /nfs/dbraw/zinc/00/23/90/590002390.db2.gz GJORUKXVMMZFSP-STQMWFEESA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@H]([NH2+]CC[C@H]1CCCS1)[C@@H]1CCC[NH2+]1 ZINC000873243867 590007109 /nfs/dbraw/zinc/00/71/09/590007109.db2.gz NXDCQTOCYGCLCA-AGIUHOORSA-N 2 0 242.432 2.392 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C[C@H]2C[C@@H]([NH3+])C2)C[C@@H]1C ZINC000873251670 590008492 /nfs/dbraw/zinc/00/84/92/590008492.db2.gz MXFCUJQKBXLGHR-RXGFPQBGSA-N 2 0 210.365 2.138 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+]C2CCc3ccccc3CC2)C1 ZINC000873251613 590009013 /nfs/dbraw/zinc/00/90/13/590009013.db2.gz XMDSJXARKYPGQV-JNSHFYNHSA-N 2 0 244.382 2.261 20 0 BEADRP C[C@@H](CCCC(F)(F)F)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873252444 590009037 /nfs/dbraw/zinc/00/90/37/590009037.db2.gz RUVKFLQRAMDJSJ-LPEHRKFASA-N 2 0 238.297 2.434 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@H]2C[C@@H]([NH3+])C2)[C@@H](C)C1 ZINC000873252419 590009067 /nfs/dbraw/zinc/00/90/67/590009067.db2.gz RNQUMRGMMYZKEM-FHUSYTEZSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C[C@H]2C[C@@H]([NH3+])C2)[C@H](C)C1 ZINC000873252421 590009157 /nfs/dbraw/zinc/00/91/57/590009157.db2.gz RNQUMRGMMYZKEM-NJMOYASZSA-N 2 0 210.365 2.138 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@H]2CCC[C@H](C3CC3)C2)C1 ZINC000873254192 590009456 /nfs/dbraw/zinc/00/94/56/590009456.db2.gz MZTNMQSFCSGLDH-DEQVHRJGSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@H](Cc1cccs1)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873253955 590009554 /nfs/dbraw/zinc/00/95/54/590009554.db2.gz HWAHWRIFKNEVRY-MXWKQRLJSA-N 2 0 224.373 2.006 20 0 BEADRP CC[C@H]1CCCC[C@@H]1[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873253170 590009835 /nfs/dbraw/zinc/00/98/35/590009835.db2.gz ZPZVJLJEDOIAMP-RVMXOQNASA-N 2 0 210.365 2.282 20 0 BEADRP CC[C@@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccc(OC)cc1 ZINC000873254686 590010288 /nfs/dbraw/zinc/01/02/88/590010288.db2.gz AKJYZDZHQBZMJF-OSAQELSMSA-N 2 0 248.370 2.473 20 0 BEADRP COc1cccc2c1CC[C@H]2[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873254446 590010338 /nfs/dbraw/zinc/01/03/38/590010338.db2.gz UCAFWGMEKWCMCT-UHIISALHSA-N 2 0 246.354 2.009 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+][C@@H](c2ccccc2)C2CC2)C1 ZINC000873256274 590010565 /nfs/dbraw/zinc/01/05/65/590010565.db2.gz MKLZTHIRUASVRA-CQDKDKBSSA-N 2 0 230.355 2.465 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccc(F)cc1 ZINC000873256221 590010597 /nfs/dbraw/zinc/01/05/97/590010597.db2.gz MVFBMRQRDVARPR-OUJBWJOFSA-N 2 0 222.307 2.214 20 0 BEADRP COc1cc(C)ccc1[C@@H](C)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873256249 590010760 /nfs/dbraw/zinc/01/07/60/590010760.db2.gz NCKCQZHCMGFLCY-UPJWGTAASA-N 2 0 248.370 2.392 20 0 BEADRP CCOc1cccc([C@@H](C)[NH2+]C[C@H]2C[C@H]([NH3+])C2)c1 ZINC000873255407 590010888 /nfs/dbraw/zinc/01/08/88/590010888.db2.gz FZPQMXAXFBVJQM-YRGRVCCFSA-N 2 0 248.370 2.473 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccccc1F ZINC000873256420 590010957 /nfs/dbraw/zinc/01/09/57/590010957.db2.gz NLXXHKRBFYMRHH-GARJFASQSA-N 2 0 222.307 2.214 20 0 BEADRP CC[C@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccccc1 ZINC000873255870 590011176 /nfs/dbraw/zinc/01/11/76/590011176.db2.gz JMSJBBPUUXMTKH-YUTCNCBUSA-N 2 0 218.344 2.465 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873256779 590011367 /nfs/dbraw/zinc/01/13/67/590011367.db2.gz NZDRVOPBALJRDB-IWSPIJDZSA-N 2 0 224.270 2.044 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+]C2C3CC4CC(C3)CC2C4)C1 ZINC000873256880 590011655 /nfs/dbraw/zinc/01/16/55/590011655.db2.gz QOWLLKLHLMSNSD-UOLSSPMKSA-N 2 0 234.387 2.138 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+][C@@H]2CCCOc3ccccc32)C1 ZINC000873256309 590011755 /nfs/dbraw/zinc/01/17/55/590011755.db2.gz NFURSPRREYRLMV-YRGRVCCFSA-N 2 0 246.354 2.227 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+][C@H]2CCCNc3ccccc32)C1 ZINC000873256786 590011821 /nfs/dbraw/zinc/01/18/21/590011821.db2.gz OFFIOEDLNONAHT-HUBLWGQQSA-N 2 0 245.370 2.260 20 0 BEADRP CSCC1CCC([NH2+]C[C@H]2C[C@H]([NH3+])C2)CC1 ZINC000873256960 590011945 /nfs/dbraw/zinc/01/19/45/590011945.db2.gz RMULLHPUYZORCP-XQSKIALTSA-N 2 0 242.432 2.235 20 0 BEADRP C[C@@H](Cc1ccc(F)cc1)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873258055 590012058 /nfs/dbraw/zinc/01/20/58/590012058.db2.gz LQLPUOVMMJWWCI-JKOKRWQUSA-N 2 0 236.334 2.084 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@@H]2CCc3ccccc32)C1 ZINC000873257798 590012208 /nfs/dbraw/zinc/01/22/08/590012208.db2.gz XNTNGMIFHFMION-SCDSUCTJSA-N 2 0 216.328 2.001 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1ccccc1F ZINC000873258175 590012232 /nfs/dbraw/zinc/01/22/32/590012232.db2.gz NLXXHKRBFYMRHH-GMTAPVOTSA-N 2 0 222.307 2.214 20 0 BEADRP C[C@H]1CCC[C@H](C)C1[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873257845 590012421 /nfs/dbraw/zinc/01/24/21/590012421.db2.gz VJFLHOHBCCGIHJ-BJDJZHNGSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@H]2C[C@H]([NH3+])C2)[C@@H](C)C1 ZINC000873258484 590012679 /nfs/dbraw/zinc/01/26/79/590012679.db2.gz RNQUMRGMMYZKEM-MLGHIDQZSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1ccccc1 ZINC000873258327 590012801 /nfs/dbraw/zinc/01/28/01/590012801.db2.gz OAJRSNPMTWZTHI-GVXVVHGQSA-N 2 0 204.317 2.075 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C[C@H]2C[C@H]([NH3+])C2)[C@H](C)C1 ZINC000873258486 590012891 /nfs/dbraw/zinc/01/28/91/590012891.db2.gz RNQUMRGMMYZKEM-SYLRKERUSA-N 2 0 210.365 2.138 20 0 BEADRP CC(C)=CCC[C@H](C)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873258344 590013036 /nfs/dbraw/zinc/01/30/36/590013036.db2.gz ONHBJOZZTUNFHE-AVGNSLFASA-N 2 0 210.365 2.448 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+][C@H]2CCc3c2cccc3F)C1 ZINC000873259148 590013147 /nfs/dbraw/zinc/01/31/47/590013147.db2.gz YBOJGXRNZVBGPZ-BHDSKKPTSA-N 2 0 234.318 2.140 20 0 BEADRP C[C@H](CCCC(F)(F)F)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873258497 590013178 /nfs/dbraw/zinc/01/31/78/590013178.db2.gz RUVKFLQRAMDJSJ-OPRDCNLKSA-N 2 0 238.297 2.434 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC[C@@H]1C1CC1)C1CC[NH2+]CC1 ZINC000873269149 590015355 /nfs/dbraw/zinc/01/53/55/590015355.db2.gz MSEIFWBPFLXYLD-LERXQTSPSA-N 2 0 222.376 2.153 20 0 BEADRP CC[C@@H](C)[C@@H](C)[NH2+][C@@H](C)C1CC[NH2+]CC1 ZINC000873269333 590015464 /nfs/dbraw/zinc/01/54/64/590015464.db2.gz FYIWMLOGRPXATH-UTUOFQBUSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC[C@H]1C1CC1)C1CC[NH2+]CC1 ZINC000873269147 590015604 /nfs/dbraw/zinc/01/56/04/590015604.db2.gz MSEIFWBPFLXYLD-DDTOSNHZSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)c1cncs1)C1CC[NH2+]CC1 ZINC000873268545 590015730 /nfs/dbraw/zinc/01/57/30/590015730.db2.gz WWZSYIFWLUGVDU-ZJUUUORDSA-N 2 0 239.388 2.182 20 0 BEADRP COc1ccccc1[C@@H](C)[NH2+][C@@H](C)C[C@@H](C)[NH3+] ZINC000873273586 590016814 /nfs/dbraw/zinc/01/68/14/590016814.db2.gz JATDGUDWOBOXPK-GRYCIOLGSA-N 2 0 236.359 2.472 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+]CCC[C@@H]1C=CCC1 ZINC000873280913 590018516 /nfs/dbraw/zinc/01/85/16/590018516.db2.gz FAHNCRAAJKCKMZ-KGLIPLIRSA-N 2 0 240.391 2.076 20 0 BEADRP COCC(C)(C)CC[NH2+][C@H]1CCCCC[C@H]1[NH3+] ZINC000873281454 590018817 /nfs/dbraw/zinc/01/88/17/590018817.db2.gz JGBJQJBMCATYAT-OLZOCXBDSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@@H]([NH2+]CCC[C@H]1C=CCC1)[C@@H]1CCC[NH2+]1 ZINC000873282567 590019197 /nfs/dbraw/zinc/01/91/97/590019197.db2.gz VCSAGZCZLIQOIG-RDBSUJKOSA-N 2 0 222.376 2.463 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]Cc1cc(N)cc(F)c1 ZINC000873291539 590023340 /nfs/dbraw/zinc/02/33/40/590023340.db2.gz WYIZUJCLHPYORZ-SNVBAGLBSA-N 2 0 239.338 2.015 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]C(C)C ZINC000019915114 590044214 /nfs/dbraw/zinc/04/42/14/590044214.db2.gz PSDFDIBRBOBBIJ-GFCCVEGCSA-N 2 0 200.370 2.495 20 0 BEADRP C[N@@H+]1CC[C@@H]2C[NH+](CC3(C)CCC3)CC[C@@H]21 ZINC000877738384 590404260 /nfs/dbraw/zinc/40/42/60/590404260.db2.gz BIZNZLSLIKUGBS-OLZOCXBDSA-N 2 0 222.376 2.203 20 0 BEADRP C[N@@H+]1CC[C@@H]2C[NH+](CCc3ccccc3)CC[C@H]21 ZINC000877743494 590411994 /nfs/dbraw/zinc/41/19/94/590411994.db2.gz WJSQAVRBSNHSPY-HZPDHXFCSA-N 2 0 244.382 2.255 20 0 BEADRP C=C/C=C/CC[NH+]1CC[C@@H](C[N@@H+](C)CC)C1 ZINC000878167688 590513730 /nfs/dbraw/zinc/51/37/30/590513730.db2.gz XTAQYJGBDQPQLC-UZYOAWRESA-N 2 0 222.376 2.392 20 0 BEADRP CSCC[NH+]1CCC2(CC[NH+](C)CC2)CC1 ZINC000879248838 590720549 /nfs/dbraw/zinc/72/05/49/590720549.db2.gz VVATYAQRSYDRLP-UHFFFAOYSA-N 2 0 242.432 2.157 20 0 BEADRP C[N@@H+]1CCC[C@@H]1CC[NH+]1C[C@@H]2CC=CC[C@@H]2C1 ZINC000879529964 590791780 /nfs/dbraw/zinc/79/17/80/590791780.db2.gz HQKOEXGVTYGOCV-QLFBSQMISA-N 2 0 234.387 2.369 20 0 BEADRP C[N@@H+]1C[C@@H]2C[NH+](Cc3ccccc3)C[C@]2(C)C1 ZINC000880020509 590910515 /nfs/dbraw/zinc/91/05/15/590910515.db2.gz KUPAPFSFBZRTDY-CABCVRRESA-N 2 0 230.355 2.070 20 0 BEADRP CC(C)C[N@@H+]1CCN(c2cc[nH+]cc2)[C@H](C)C1 ZINC000880261078 590980790 /nfs/dbraw/zinc/98/07/90/590980790.db2.gz HVGCZWIWJRSAEF-CYBMUJFWSA-N 2 0 233.359 2.248 20 0 BEADRP CC[C@H](C)[NH+]1CCC(C)([NH+]2CCC2)CC1 ZINC000880473799 591037592 /nfs/dbraw/zinc/03/75/92/591037592.db2.gz OVQGJRYAQTZDJR-LBPRGKRZSA-N 2 0 210.365 2.345 20 0 BEADRP c1ccc2c(c1)CC[C@@H]([NH2+][C@@H]1CCC[NH2+]CC1)C2 ZINC000129220548 591270542 /nfs/dbraw/zinc/27/05/42/591270542.db2.gz AESJTXFICXVWMF-HZPDHXFCSA-N 2 0 244.382 2.276 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C[C@H]2C=CCC2)CC1(C)C ZINC000883236707 591582302 /nfs/dbraw/zinc/58/23/02/591582302.db2.gz IWGMXYIJANPITI-STQMWFEESA-N 2 0 222.376 2.415 20 0 BEADRP [NH3+]C[C@@H]1CCCN1Cc1coc2ccccc12 ZINC000131407428 591607651 /nfs/dbraw/zinc/60/76/51/591607651.db2.gz DWLQYAJQHHFVTK-LBPRGKRZSA-N 2 0 230.311 2.356 20 0 BEADRP [NH3+]C[C@H]1CC[N@H+](CC[C@@H]2CCCC2(F)F)C1 ZINC000883417169 591653013 /nfs/dbraw/zinc/65/30/13/591653013.db2.gz PUBFCCGRABVPQD-MNOVXSKESA-N 2 0 232.318 2.093 20 0 BEADRP Cc1nc(C)c(CN(C2CC2)C2CC[NH2+]CC2)o1 ZINC000883415761 591653125 /nfs/dbraw/zinc/65/31/25/591653125.db2.gz DFPKUAVGQQWOFU-UHFFFAOYSA-N 2 0 249.358 2.008 20 0 BEADRP C=C/C=C\CC[N@@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000883424621 591658908 /nfs/dbraw/zinc/65/89/08/591658908.db2.gz YCNLGTBRHWSFPZ-ARJAWSKDSA-N 2 0 220.360 2.194 20 0 BEADRP C=C/C=C\CC[N@@H+]1CCC[C@]2(CC[NH2+]C2)C1 ZINC000883429910 591662206 /nfs/dbraw/zinc/66/22/06/591662206.db2.gz HZRJEFBBPYKIBK-VQTKUKTRSA-N 2 0 220.360 2.194 20 0 BEADRP C[NH2+]CCC[NH2+][C@H]1c2ccccc2NC1(C)C ZINC000883464340 591674440 /nfs/dbraw/zinc/67/44/40/591674440.db2.gz KWBDFCRJIKFICS-ZDUSSCGKSA-N 2 0 233.359 2.131 20 0 BEADRP C([NH2+]C1C2CC3CC(C2)CC1C3)[C@H]1CCC[NH2+]C1 ZINC000132111298 591687887 /nfs/dbraw/zinc/68/78/87/591687887.db2.gz RMBALCRMIDJFKC-MGWQBKBZSA-N 2 0 248.414 2.400 20 0 BEADRP C[C@H]1SCC[N@H+](CCCCCC[NH3+])[C@@H]1C ZINC000132463304 591710589 /nfs/dbraw/zinc/71/05/89/591710589.db2.gz VTWGLIPVOOXWIY-VXGBXAGGSA-N 2 0 230.421 2.331 20 0 BEADRP C[C@H](C[NH3+])N(C)Cc1cccc2cccnc21 ZINC000135295850 592003879 /nfs/dbraw/zinc/00/38/79/592003879.db2.gz HOVDLXJYPWNAPE-LLVKDONJSA-N 2 0 229.327 2.014 20 0 BEADRP C[NH+](C)C1CC[NH+](CC[C@@H]2C[C@H]2C2CC2)CC1 ZINC000885954285 592114929 /nfs/dbraw/zinc/11/49/29/592114929.db2.gz SRQOKZKBSHPQCN-HIFRSBDPSA-N 2 0 236.403 2.449 20 0 BEADRP CC(CC[NH+]1C[C@@H]2C[C@@H]2C1)CC[N@@H+]1C[C@@H]2C[C@@H]2C1 ZINC000886348918 592214481 /nfs/dbraw/zinc/21/44/81/592214481.db2.gz VDIXYPMIERPROA-GEEKYZPCSA-N 2 0 248.414 2.306 20 0 BEADRP CN(CC[C@@H]1CCCC[N@@H+]1C)Cc1ccccn1 ZINC000075860153 592313769 /nfs/dbraw/zinc/31/37/69/592313769.db2.gz GPZYGALZQOBNNF-HNNXBMFYSA-N 2 0 247.386 2.388 20 0 BEADRP CCCC[N@@H+]1CCCC[C@@]2(CC[NH2+]C2)C1 ZINC000886865506 592373666 /nfs/dbraw/zinc/37/36/66/592373666.db2.gz MJZHFTUMEFQLLO-ZDUSSCGKSA-N 2 0 210.365 2.252 20 0 BEADRP CC[C@H](C)[N@@H+]1CCCC[C@@]2(CC[NH2+]C2)C1 ZINC000886874560 592376676 /nfs/dbraw/zinc/37/66/76/592376676.db2.gz QGGITXSBTYCGGS-STQMWFEESA-N 2 0 210.365 2.251 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CCCC[C@]2(CC[NH2+]C2)C1 ZINC000886873927 592378189 /nfs/dbraw/zinc/37/81/89/592378189.db2.gz BOFYTCMINVOAHK-MGPQQGTHSA-N 2 0 222.376 2.108 20 0 BEADRP FC(F)CN(CCn1ccnc1)C1CCC1 ZINC000887100600 592441292 /nfs/dbraw/zinc/44/12/92/592441292.db2.gz IZMVPOVRLQXIJV-UHFFFAOYSA-N 2 0 229.274 2.003 20 0 BEADRP C[C@@H]1CN(c2cc[nH+]cc2)CC[N@@H+]1CC1CCC1 ZINC000887132840 592449309 /nfs/dbraw/zinc/44/93/09/592449309.db2.gz OKITZONQYXIDDT-CYBMUJFWSA-N 2 0 245.370 2.392 20 0 BEADRP CS[C@@H]1CC[C@H]([NH2+][C@H]2CCC[C@H]([NH3+])C2)C1 ZINC000300392902 592509795 /nfs/dbraw/zinc/50/97/95/592509795.db2.gz WBUCLRYCJBAAIB-FIQHERPVSA-N 2 0 228.405 2.130 20 0 BEADRP CS[C@@H]1CC[C@H]([NH2+][C@@H]2CCCC[C@H]2C[NH3+])C1 ZINC000300387868 592510026 /nfs/dbraw/zinc/51/00/26/592510026.db2.gz NHDAINSJQPXXNM-WUHRBBMRSA-N 2 0 242.432 2.378 20 0 BEADRP C[C@@H]([NH2+][C@H]1C[C@H]([NH3+])C12CCC2)C(C)(C)C ZINC000925703451 634380832 /nfs/dbraw/zinc/38/08/32/634380832.db2.gz VDHWAOURLYALMO-VWYCJHECSA-N 2 0 210.365 2.281 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+][C@@H]2C[C@H]2C2CCC2)C12CCC2 ZINC000925707724 634396435 /nfs/dbraw/zinc/39/64/35/634396435.db2.gz QZXNVASNDYFOIH-LOWDOPEQSA-N 2 0 220.360 2.035 20 0 BEADRP C[C@]1(CC[NH2+][C@H]2CC[NH2+]C23CCC3)CC1(F)F ZINC000925709006 634404443 /nfs/dbraw/zinc/40/44/43/634404443.db2.gz NFABHHGITHXFHG-QWRGUYRKSA-N 2 0 244.329 2.296 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@H]1[NH2+]CC1=CC[N@H+](C)CC1 ZINC000925712393 634414468 /nfs/dbraw/zinc/41/44/68/634414468.db2.gz UHWACPWZMRYHEK-IMRBUKKESA-N 2 0 222.376 2.273 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+]C[C@@]1(C)C[C@H]2C[C@H]2C1 ZINC000925716296 634445119 /nfs/dbraw/zinc/44/51/19/634445119.db2.gz CPTFCJRGTIIGCK-KZVDOYCCSA-N 2 0 222.376 2.153 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+]C[C@@]1(C)C[C@H]2C[C@H]2C1 ZINC000925716294 634445240 /nfs/dbraw/zinc/44/52/40/634445240.db2.gz CPTFCJRGTIIGCK-CZXHOFHRSA-N 2 0 222.376 2.153 20 0 BEADRP COCc1cccc(C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)c1 ZINC000093215211 634463697 /nfs/dbraw/zinc/46/36/97/634463697.db2.gz MFWANOTZGAZYPG-CABCVRRESA-N 2 0 248.370 2.193 20 0 BEADRP CC1(C)C[C@@H]([NH2+]C[C@H]2C=CCC2)C[C@@H]([NH3+])C1 ZINC000925732218 634570008 /nfs/dbraw/zinc/57/00/08/634570008.db2.gz PBPLTVPSXPFENY-XQQFMLRXSA-N 2 0 222.376 2.448 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CC(C)(C)CC(F)F ZINC000925734747 634584918 /nfs/dbraw/zinc/58/49/18/634584918.db2.gz UIVCKKJRYNJLIT-IUCAKERBSA-N 2 0 222.323 2.383 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]C[C@H]1C=CCC1 ZINC000925733215 634578084 /nfs/dbraw/zinc/57/80/84/634578084.db2.gz UIBHSFPEFOJOFR-XQQFMLRXSA-N 2 0 208.349 2.202 20 0 BEADRP CCC[C@H](C)CC[NH2+][C@@H]1CCOC[C@@H]1[C@@H](C)[NH3+] ZINC000925735000 634584175 /nfs/dbraw/zinc/58/41/75/634584175.db2.gz XAUXIRMOSBBRDF-REWJHTLYSA-N 2 0 242.407 2.155 20 0 BEADRP CC(C)([NH3+])CC[NH2+][C@@H]1CCCc2ccc(O)cc21 ZINC000925736579 634590634 /nfs/dbraw/zinc/59/06/34/634590634.db2.gz BTDXDFLXMYBNSM-CQSZACIVSA-N 2 0 248.370 2.487 20 0 BEADRP Cc1ccc(OCC[N@@H+]2CC[C@@H]([NH3+])[C@@H](C)C2)cc1 ZINC000227072516 635446128 /nfs/dbraw/zinc/44/61/28/635446128.db2.gz XKAZSVCGPVKIFB-DZGCQCFKSA-N 2 0 248.370 2.043 20 0 BEADRP COc1ccc([C@H](C)[NH2+]C2CC[NH2+]CC2)cc1C ZINC000925828780 635455865 /nfs/dbraw/zinc/45/58/65/635455865.db2.gz IBZNNGCXGFEDHQ-LBPRGKRZSA-N 2 0 248.370 2.406 20 0 BEADRP FC(F)(F)[C@@H]1C[C@H]1C[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000925831624 635473725 /nfs/dbraw/zinc/47/37/25/635473725.db2.gz KIMCLULEQHKFEV-AEJSXWLSSA-N 2 0 248.292 2.059 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCS[C@H](C)C1)[C@H]1CCCC[NH2+]1 ZINC000925861591 635556072 /nfs/dbraw/zinc/55/60/72/635556072.db2.gz QJQXRVLDKSDYJN-YVECIDJPSA-N 2 0 242.432 2.391 20 0 BEADRP CC[C@H]([NH2+][C@H]1CCS[C@H](C)C1)[C@@H]1CCC[NH2+]1 ZINC000925860902 635556994 /nfs/dbraw/zinc/55/69/94/635556994.db2.gz LWFLKOXAVNMZJQ-VOAKCMCISA-N 2 0 242.432 2.391 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCS[C@H](C)C1)[C@H]1CCCC[NH2+]1 ZINC000925861584 635557262 /nfs/dbraw/zinc/55/72/62/635557262.db2.gz QJQXRVLDKSDYJN-FDYHWXHSSA-N 2 0 242.432 2.391 20 0 BEADRP [NH3+]C[C@H]1CCC[C@H]1[NH2+][C@@H]1CCCc2cccnc21 ZINC000925871911 635587501 /nfs/dbraw/zinc/58/75/01/635587501.db2.gz LMXSPVZPTHISJL-MGPQQGTHSA-N 2 0 245.370 2.176 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[NH2+][C@H]2CCc3ccccc3C2)C1 ZINC000925876615 635598760 /nfs/dbraw/zinc/59/87/60/635598760.db2.gz CPDFPJQSDSNUAB-MAZHCROVSA-N 2 0 244.382 2.261 20 0 BEADRP C[C@]12C[C@H]1CCC[C@H]2[NH2+]C[C@@H]1CC[C@H]([NH3+])C1 ZINC000925880431 635607989 /nfs/dbraw/zinc/60/79/89/635607989.db2.gz RNAVXLSZNDVPHU-RGDJUOJXSA-N 2 0 222.376 2.282 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]C[C@]23C[C@H]2CCC3)C12CCC2 ZINC000925880662 635609313 /nfs/dbraw/zinc/60/93/13/635609313.db2.gz NAELCLCBCUFIFF-VOAKCMCISA-N 2 0 220.360 2.036 20 0 BEADRP C([C@H]1CCC[NH2+]C1)[N@@H+]1CCC2(CCCC2)C1 ZINC000303390821 635614661 /nfs/dbraw/zinc/61/46/61/635614661.db2.gz BVOKYTCRNLSDCY-ZDUSSCGKSA-N 2 0 222.376 2.252 20 0 BEADRP C[NH+]1CCC(C[NH2+]C(C)(C)C2CC2)CC1 ZINC000234311332 631237824 /nfs/dbraw/zinc/23/78/24/631237824.db2.gz KEXSMGBMPUIISR-UHFFFAOYSA-N 2 0 210.365 2.106 20 0 BEADRP Cc1ncsc1C[N@@H+](C)C1CCC([NH3+])CC1 ZINC000082633223 631407513 /nfs/dbraw/zinc/40/75/13/631407513.db2.gz HTHPZZBYDBMYKN-UHFFFAOYSA-N 2 0 239.388 2.153 20 0 BEADRP CCCCCC[N@@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1 ZINC000308789364 631647994 /nfs/dbraw/zinc/64/79/94/631647994.db2.gz APUZGSHIQZPRIN-QWHCGFSZSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@H](C[N@@H+]1CCC[C@@H](C[NH3+])C1)C(C)(C)C ZINC000308839011 631899225 /nfs/dbraw/zinc/89/92/25/631899225.db2.gz XUZNTULKTWUHMB-NEPJUHHUSA-N 2 0 212.381 2.339 20 0 BEADRP C[C@@H]1C[C@H](C[NH2+]C2CCCCC2)CC[NH2+]1 ZINC000235371475 632029224 /nfs/dbraw/zinc/02/92/24/632029224.db2.gz BHKUCAXBACCRSY-VXGBXAGGSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H](c1ccccn1)[N@@H+]1CCC[C@@H]([C@H](C)[NH3+])C1 ZINC000251227934 632545389 /nfs/dbraw/zinc/54/53/89/632545389.db2.gz AKGQDDMJMODQML-YNEHKIRRSA-N 2 0 233.359 2.202 20 0 BEADRP CCCCCC[N@H+]1CC[C@H]2C[NH2+]C[C@H]2CC1 ZINC000309593882 632554420 /nfs/dbraw/zinc/55/44/20/632554420.db2.gz TYGOISUBMVEGSC-OKILXGFUSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H]1C[C@@H](C)C[NH+](C[C@@]2(C)CCC[NH2+]C2)C1 ZINC000219751097 632562065 /nfs/dbraw/zinc/56/20/65/632562065.db2.gz STIHNLVQLMFBQI-MCIONIFRSA-N 2 0 224.392 2.354 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H]2C[C@H](OCC)C2)CC1 ZINC000658160037 632681570 /nfs/dbraw/zinc/68/15/70/632681570.db2.gz CUENKFYYSODIEW-HDJSIYSDSA-N 2 0 240.391 2.018 20 0 BEADRP COc1ccccc1[C@H](C)[NH2+]CCC(C)(C)[NH3+] ZINC000310131880 632701864 /nfs/dbraw/zinc/70/18/64/632701864.db2.gz HTUXNRKJOMGJMV-NSHDSACASA-N 2 0 236.359 2.473 20 0 BEADRP C(C[N@@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1)C1CCCC1 ZINC000309251445 632842577 /nfs/dbraw/zinc/84/25/77/632842577.db2.gz AGDQYIOFTCHKOF-UONOGXRCSA-N 2 0 222.376 2.108 20 0 BEADRP CSCC[C@@H](C)[N@H+](C)C[C@@H]1CC[C@H]([NH3+])C1 ZINC000156891304 632893913 /nfs/dbraw/zinc/89/39/13/632893913.db2.gz QKRRSZBTHZLPGR-UTUOFQBUSA-N 2 0 230.421 2.187 20 0 BEADRP C[C@@H]1CC[N@H+](CCc2cccs2)C[C@@H]1C[NH3+] ZINC000167664556 633131120 /nfs/dbraw/zinc/13/11/20/633131120.db2.gz YXIKOPUIGYRLET-NEPJUHHUSA-N 2 0 238.400 2.207 20 0 BEADRP COCCC[NH+]1CCC([NH2+]C2CCCC2)CC1 ZINC000237196495 636048255 /nfs/dbraw/zinc/04/82/55/636048255.db2.gz XAXIKDZUOJQBPB-UHFFFAOYSA-N 2 0 240.391 2.020 20 0 BEADRP C[C@H](CC[NH2+][C@@H](C)C1CC(F)(F)C1)[NH+](C)C ZINC000895291033 636131261 /nfs/dbraw/zinc/13/12/61/636131261.db2.gz YQDMKQXVHUGFLS-ZJUUUORDSA-N 2 0 234.334 2.350 20 0 BEADRP Cc1ccc(CC[NH2+]CC[C@H](C)[NH+](C)C)cc1 ZINC000895291921 636132335 /nfs/dbraw/zinc/13/23/35/636132335.db2.gz KFTRKMZDUMGEJS-AWEZNQCLSA-N 2 0 234.387 2.467 20 0 BEADRP CC[C@H](C)C[C@H](C)[NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32 ZINC000328239238 633747416 /nfs/dbraw/zinc/74/74/16/633747416.db2.gz AQORXONMTIEWKH-SFWGVHFYSA-N 2 0 236.403 2.397 20 0 BEADRP C(CC1CCCC1)[NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23 ZINC000328457874 633764868 /nfs/dbraw/zinc/76/48/68/633764868.db2.gz SGORSYOZBOVLFE-XPABHHOTSA-N 2 0 234.387 2.153 20 0 BEADRP CCC(C)(C)C[NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23 ZINC000328460803 633766818 /nfs/dbraw/zinc/76/68/18/633766818.db2.gz UNMIBZFSQFCIHR-OBPIAQAESA-N 2 0 222.376 2.009 20 0 BEADRP CSCCC[NH2+][C@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925503456 633828313 /nfs/dbraw/zinc/82/83/13/633828313.db2.gz KLJRITHDHIYRFV-MNOVXSKESA-N 2 0 230.421 2.235 20 0 BEADRP CS[C@@H]1CCC[C@@H]([NH2+][C@@H]2CC[NH2+]C2(C)C)C1 ZINC000925507591 633840708 /nfs/dbraw/zinc/84/07/08/633840708.db2.gz ZFQAYUISYCCJQU-IJLUTSLNSA-N 2 0 242.432 2.391 20 0 BEADRP C[C@@H](N)[C@@H]([NH2+]CCCC[NH+](C)C)c1ccccc1 ZINC000925522791 633896418 /nfs/dbraw/zinc/89/64/18/633896418.db2.gz USVRWROFZALYSA-UKRRQHHQSA-N 2 0 249.402 2.006 20 0 BEADRP C[C@@H](N)[C@H]([NH2+]CCCC[NH+](C)C)c1ccccc1 ZINC000925522790 633897013 /nfs/dbraw/zinc/89/70/13/633897013.db2.gz USVRWROFZALYSA-HIFRSBDPSA-N 2 0 249.402 2.006 20 0 BEADRP C[C@@H](C1CC1)[N@@H+]1CC[C@@]2(C1)CCC[NH+](C)C2 ZINC000930575996 633906439 /nfs/dbraw/zinc/90/64/39/633906439.db2.gz AVXSLDMLKSYHIE-JSGCOSHPSA-N 2 0 222.376 2.203 20 0 BEADRP CCC1(C[NH2+][C@@H]2CC[NH2+]C2(C)C)CCC1 ZINC000925542864 633965958 /nfs/dbraw/zinc/96/59/58/633965958.db2.gz RACCOFPFPJBFIL-LLVKDONJSA-N 2 0 210.365 2.297 20 0 BEADRP COC[C@@H](C)[NH2+]CCC[N@H+](C)C1CCCCC1 ZINC000053196115 634070051 /nfs/dbraw/zinc/07/00/51/634070051.db2.gz UFFNYIHTNVQZIR-CYBMUJFWSA-N 2 0 242.407 2.266 20 0 BEADRP CC1(C[NH2+][C@@H]2C[C@@H]([NH3+])CC(C)(C)C2)CC1 ZINC000925576691 634077038 /nfs/dbraw/zinc/07/70/38/634077038.db2.gz MBCLOXREKHVDET-GHMZBOCLSA-N 2 0 210.365 2.282 20 0 BEADRP CCC1(C[NH2+][C@@H]2CC[NH2+]C23CCCC3)CC1 ZINC000925579276 634079892 /nfs/dbraw/zinc/07/98/92/634079892.db2.gz KYBODZYRKBMKON-GFCCVEGCSA-N 2 0 222.376 2.441 20 0 BEADRP CCC1(C[NH2+][C@H]2CC[NH2+]C23CCC3)CC1 ZINC000925581045 634085412 /nfs/dbraw/zinc/08/54/12/634085412.db2.gz VBWBDQGCLZCBFG-NSHDSACASA-N 2 0 208.349 2.051 20 0 BEADRP CCC[C@@H]1C[C@H]1[NH2+][C@H]1C[C@H]([NH3+])C12CCC2 ZINC000925603956 634132393 /nfs/dbraw/zinc/13/23/93/634132393.db2.gz GSEQXEHJIIULQA-WYUUTHIRSA-N 2 0 208.349 2.035 20 0 BEADRP [NH3+]CCC[C@H]([NH2+]CCCF)c1ccccc1 ZINC000925619205 634178022 /nfs/dbraw/zinc/17/80/22/634178022.db2.gz LTRBDULXPQVIGD-ZDUSSCGKSA-N 2 0 224.323 2.416 20 0 BEADRP CC1(C)C[C@H]([NH3+])C[C@@H]([NH2+]C[C@@H]2CCC=CO2)C1 ZINC000925642356 634192457 /nfs/dbraw/zinc/19/24/57/634192457.db2.gz GGFVHXQURZHRPJ-UPJWGTAASA-N 2 0 238.375 2.175 20 0 BEADRP CSC1(C[NH2+][C@@H]2C[C@@H]([NH3+])CC(C)(C)C2)CC1 ZINC000925657293 634221168 /nfs/dbraw/zinc/22/11/68/634221168.db2.gz MOCRTJLLMOCJIA-GHMZBOCLSA-N 2 0 242.432 2.378 20 0 BEADRP CC[C@H]([NH2+][C@@H]1C[C@@H]([NH3+])CC(C)(C)C1)C(C)(C)O ZINC000925674446 634259012 /nfs/dbraw/zinc/25/90/12/634259012.db2.gz JPZGAKPTHGUNHU-UTUOFQBUSA-N 2 0 242.407 2.032 20 0 BEADRP CCC[C@H](C[NH2+][C@H]1C[C@H]([NH3+])CC(C)(C)C1)OC ZINC000925680241 634278956 /nfs/dbraw/zinc/27/89/56/634278956.db2.gz NPBBVTYPMLBCJM-RWMBFGLXSA-N 2 0 242.407 2.297 20 0 BEADRP C1CC(C2([NH2+][C@@H]3[C@H]4C[C@H]5C[NH2+][C@H]3[C@H]5C4)CCC2)C1 ZINC000925684372 634294164 /nfs/dbraw/zinc/29/41/64/634294164.db2.gz ALCCQQFBTWQFEM-RCZQDCHWSA-N 2 0 246.398 2.295 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+][C@H]2C[C@@H]([NH3+])CC(C)(C)C2)O1 ZINC000925696922 634356490 /nfs/dbraw/zinc/35/64/90/634356490.db2.gz VTCWZEOFBRVSTP-FVCCEPFGSA-N 2 0 240.391 2.050 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+][C@@H]2C[C@H]([NH3+])CC(C)(C)C2)O1 ZINC000925696924 634357963 /nfs/dbraw/zinc/35/79/63/634357963.db2.gz VTCWZEOFBRVSTP-YVECIDJPSA-N 2 0 240.391 2.050 20 0 BEADRP CCCC[C@H](C[NH3+])N[C@H](c1ccccc1)[C@@H](C)[NH3+] ZINC000925696793 634358458 /nfs/dbraw/zinc/35/84/58/634358458.db2.gz AWGLYODVLMHJPO-YUELXQCFSA-N 2 0 249.402 2.182 20 0 BEADRP CCCC[C@H](C[NH3+])N[C@H](c1ccccc1)[C@H](C)[NH3+] ZINC000925696789 634358795 /nfs/dbraw/zinc/35/87/95/634358795.db2.gz AWGLYODVLMHJPO-CFVMTHIKSA-N 2 0 249.402 2.182 20 0 BEADRP C[N@H+](CCc1cccc(F)c1)CC(C)(C)C[NH3+] ZINC000258703744 635190636 /nfs/dbraw/zinc/19/06/36/635190636.db2.gz HBCFLXKEIKZXTD-UHFFFAOYSA-N 2 0 238.350 2.285 20 0 BEADRP COc1ccc(Cl)cc1C[NH2+]C[C@@H](C)C[NH3+] ZINC000258836983 635211508 /nfs/dbraw/zinc/21/15/08/635211508.db2.gz VSYVOZGQCBLPRP-VIFPVBQESA-N 2 0 242.750 2.033 20 0 BEADRP FC1(F)CC[NH2+]C[C@@H]1C[NH2+][C@@H]1CC[C@H]1C1CC1 ZINC000925778182 635263992 /nfs/dbraw/zinc/26/39/92/635263992.db2.gz RWNCMSKWMMCJRZ-GRYCIOLGSA-N 2 0 244.329 2.009 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+][C@@H]1CCCC(C)(C)C1 ZINC000925782573 635278646 /nfs/dbraw/zinc/27/86/46/635278646.db2.gz LFUJWJYVAUJIEK-IJLUTSLNSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+][C@H]1C[C@H](C)CC[C@@H]1C ZINC000925784355 635298785 /nfs/dbraw/zinc/29/87/85/635298785.db2.gz MTVCTSZYMIHUEO-RXGFPQBGSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@@H]1C[C@H](C)CC[C@@H]1C ZINC000925785856 635302575 /nfs/dbraw/zinc/30/25/75/635302575.db2.gz PFQNJIOHAJARBD-XHJNMGKDSA-N 2 0 224.392 2.256 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CC1C[C@H]2CC[C@@H](C1)S2 ZINC000925800323 635342478 /nfs/dbraw/zinc/34/24/78/635342478.db2.gz FKLHQSLKDJALRP-XQHREUISSA-N 2 0 242.432 2.376 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]CC[C@@H]1CC[C@@H]2C[C@@H]21 ZINC000925804437 635356373 /nfs/dbraw/zinc/35/63/73/635356373.db2.gz HJKNLJMWUYWGGT-KHMAMNHCSA-N 2 0 236.403 2.400 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+]CC[C@@H]1C[NH2+]C[C@H]1C ZINC000925803824 635356565 /nfs/dbraw/zinc/35/65/65/635356565.db2.gz VZJOLUCHMYRHFO-FDYHWXHSSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1C[C@H]1[C@@H]1C[C@H]1C ZINC000925824962 635417315 /nfs/dbraw/zinc/41/73/15/635417315.db2.gz XIXNEJOKLNAUED-NJMOYASZSA-N 2 0 210.365 2.138 20 0 BEADRP COC[C@H](C[NH2+][C@H](C)[C@H]1CCCC[NH2+]1)C(C)C ZINC000925874404 635594779 /nfs/dbraw/zinc/59/47/79/635594779.db2.gz RKCNJGZZEZPBHY-HZSPNIEDSA-N 2 0 242.407 2.025 20 0 BEADRP [NH3+]CCCCCC[N@@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC000126323985 635767962 /nfs/dbraw/zinc/76/79/62/635767962.db2.gz QODLZNPLHARTHM-BETUJISGSA-N 2 0 210.365 2.237 20 0 BEADRP C[C@@H]([NH2+]Cc1cccc(O)c1)C1CC[NH+](C)CC1 ZINC000154461265 636632425 /nfs/dbraw/zinc/63/24/25/636632425.db2.gz DUOVEQNJYOOCLJ-GFCCVEGCSA-N 2 0 248.370 2.212 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]Cc2cccc(F)c2)C1 ZINC000086402571 636886517 /nfs/dbraw/zinc/88/65/17/636886517.db2.gz HLGJHGLYWZBHLJ-QWHCGFSZSA-N 2 0 222.307 2.185 20 0 BEADRP CC1([NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)CC(F)(F)C1 ZINC000873197957 636980477 /nfs/dbraw/zinc/98/04/77/636980477.db2.gz WXFHROSEPOFNTE-GHMZBOCLSA-N 2 0 244.329 2.391 20 0 BEADRP CSCC[C@H](C)[N@H+](C)CCC[NH2+]C1CC1 ZINC000156910703 637084413 /nfs/dbraw/zinc/08/44/13/637084413.db2.gz PZOUPIOWRUKOQQ-NSHDSACASA-N 2 0 230.421 2.202 20 0 BEADRP CNc1ccccc1C[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000902266765 637288547 /nfs/dbraw/zinc/28/85/47/637288547.db2.gz UHFQBHOHBPMOPX-GXTWGEPZSA-N 2 0 247.386 2.301 20 0 BEADRP CC[C@@H](CSC)[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000902367213 637295430 /nfs/dbraw/zinc/29/54/30/637295430.db2.gz AQKXHOGJRJJBAA-NWDGAFQWSA-N 2 0 244.448 2.496 20 0 BEADRP CC1(C)C[C@@H]1C[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000902363308 637299927 /nfs/dbraw/zinc/29/99/27/637299927.db2.gz KUBYCEHYNWQBHS-NEPJUHHUSA-N 2 0 224.392 2.400 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]([NH2+][C@H]2CC=CCC2)C1 ZINC000902362648 637300007 /nfs/dbraw/zinc/30/00/07/637300007.db2.gz RCPVJXWOVBBXHF-STQMWFEESA-N 2 0 222.376 2.463 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+]C2C[C@@H]3CCC[C@H]3C2)C1 ZINC000902751912 637330008 /nfs/dbraw/zinc/33/00/08/637330008.db2.gz DBDKQPGZXWIPKU-RDBSUJKOSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@@H+]1C[C@H]1CCC[NH2+]1 ZINC000903436752 637360335 /nfs/dbraw/zinc/36/03/35/637360335.db2.gz BFWRXEQQTZLPQR-RQJABVFESA-N 2 0 222.376 2.391 20 0 BEADRP COc1cccc([C@H](C)[NH2+]C[C@@H]2CC[C@H]([NH3+])C2)c1 ZINC000903461473 637363063 /nfs/dbraw/zinc/36/30/63/637363063.db2.gz UWOVODNHZXLIBV-SCRDCRAPSA-N 2 0 248.370 2.473 20 0 BEADRP [NH3+]CC[C@@H]1CC[N@H+](Cc2ccccc2CF)C1 ZINC000903788970 637384537 /nfs/dbraw/zinc/38/45/37/637384537.db2.gz SGIOBLCWRBOJQW-GFCCVEGCSA-N 2 0 236.334 2.327 20 0 BEADRP C[C@]12C[N@H+](CC34CC(C3)C[NH2+]4)C[C@H]1[C@H]1CC[C@@H]2C1 ZINC000904465365 637408569 /nfs/dbraw/zinc/40/85/69/637408569.db2.gz ZPPUJAJYMKTNTR-ZIXXKZBOSA-N 2 0 246.398 2.106 20 0 BEADRP Cn1ccc(C[NH+]2CCC(C(C)(C)C[NH3+])CC2)c1 ZINC000904444589 637412715 /nfs/dbraw/zinc/41/27/15/637412715.db2.gz NWYXRJZWNDPTSW-UHFFFAOYSA-N 2 0 249.402 2.222 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[N@@H+]2Cc3cccc(Cl)c3C2)C1 ZINC000904468688 637422813 /nfs/dbraw/zinc/42/28/13/637422813.db2.gz FBKWCGLGIBCDKK-JGZJWPJOSA-N 2 0 236.746 2.393 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+]C2(C3CCCCC3)CC2)C1 ZINC000904473551 637425212 /nfs/dbraw/zinc/42/52/12/637425212.db2.gz UAPARUDICOOPLU-BJHJDKERSA-N 2 0 222.376 2.426 20 0 BEADRP CC(C)([NH3+])c1ccc(N[C@H]2CCC[NH2+]C2)cc1 ZINC000904471064 637426507 /nfs/dbraw/zinc/42/65/07/637426507.db2.gz WFVMZOQPULOOCP-ZDUSSCGKSA-N 2 0 233.359 2.044 20 0 BEADRP CC(C)([NH3+])c1ccc(NCC23CC(C2)C[NH2+]3)cc1 ZINC000904477402 637426947 /nfs/dbraw/zinc/42/69/47/637426947.db2.gz VNQASAMMSRKHLU-UHFFFAOYSA-N 2 0 245.370 2.044 20 0 BEADRP CC(C)COc1ccc(C[NH2+][C@H]2C[C@H]([NH3+])C2)cc1 ZINC000906508017 638178731 /nfs/dbraw/zinc/17/87/31/638178731.db2.gz HKDSMXTWOSQZBM-HDJSIYSDSA-N 2 0 248.370 2.301 20 0 BEADRP CCCCOc1ccc(C[NH2+][C@H]2C[C@H]([NH3+])C2)cc1 ZINC000906508679 638181035 /nfs/dbraw/zinc/18/10/35/638181035.db2.gz UNUZXOIJCQMWJY-HDJSIYSDSA-N 2 0 248.370 2.445 20 0 BEADRP Cc1cc(C)c(C[NH2+][C@H]2C[C@H]([NH3+])C2)cc1C ZINC000906508741 638181207 /nfs/dbraw/zinc/18/12/07/638181207.db2.gz XHVGQUKSIPANJZ-HDJSIYSDSA-N 2 0 218.344 2.191 20 0 BEADRP CC[C@H](C[NH2+]C1CC([NH3+])C1)c1ccccc1 ZINC000906509205 638181499 /nfs/dbraw/zinc/18/14/99/638181499.db2.gz AKNRPROZUPCGMU-LMWSTFAQSA-N 2 0 218.344 2.260 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]Cc2ccc(C(F)(F)F)cc2)C1 ZINC000906508699 638181702 /nfs/dbraw/zinc/18/17/02/638181702.db2.gz VHFNXIOAVGPLNT-XYPYZODXSA-N 2 0 244.260 2.285 20 0 BEADRP Cc1cc(C[NH2+]C2CC([NH3+])C2)cc2cccnc12 ZINC000906510770 638184242 /nfs/dbraw/zinc/18/42/42/638184242.db2.gz WJHKAKFBOKVFEJ-UHFFFAOYSA-N 2 0 241.338 2.123 20 0 BEADRP [NH3+]C1CC([NH2+]CCC2CCCCCC2)C1 ZINC000906511034 638184287 /nfs/dbraw/zinc/18/42/87/638184287.db2.gz QMQCQKILQXJDPM-UHFFFAOYSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@H](C[NH2+]C1CC([NH3+])C1)c1ccc(F)cc1 ZINC000906510563 638184372 /nfs/dbraw/zinc/18/43/72/638184372.db2.gz LSTSCBWGSXOMJP-UHEGKEBESA-N 2 0 222.307 2.009 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]C/C=C\c2ccc(F)cc2F)C1 ZINC000906517801 638186991 /nfs/dbraw/zinc/18/69/91/638186991.db2.gz RVKQAIGPFPXGOV-QDZDSHPKSA-N 2 0 238.281 2.057 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]CCCCCOc2ccccc2)C1 ZINC000906518014 638187325 /nfs/dbraw/zinc/18/73/25/638187325.db2.gz NANVSYSEHRTACQ-HDJSIYSDSA-N 2 0 248.370 2.315 20 0 BEADRP C[C@@H](C[NH2+][C@H]1C[C@H]([NH3+])C1)c1ccc(F)cc1 ZINC000906517978 638187385 /nfs/dbraw/zinc/18/73/85/638187385.db2.gz LSTSCBWGSXOMJP-XDTLVQLUSA-N 2 0 222.307 2.009 20 0 BEADRP CCCC[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000906533881 638202305 /nfs/dbraw/zinc/20/23/05/638202305.db2.gz IUTJPKWXZBIIJX-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP CC1CC(C[N@@H+]2CC[C@@]3(CC[NH+](C)C3)C2)C1 ZINC000930554448 639810568 /nfs/dbraw/zinc/81/05/68/639810568.db2.gz GZNAWOMTVWJPIV-JXQTWKCFSA-N 2 0 222.376 2.060 20 0 BEADRP C[C@H]([NH3+])c1ccc(NC(=O)CC(C)(C)C[NH3+])cc1 ZINC000911846308 639856162 /nfs/dbraw/zinc/85/61/62/639856162.db2.gz MWVAYEVRCCEBAP-JTQLQIEISA-N 2 0 249.358 2.020 20 0 BEADRP CN1C[C@@]2(C)C[NH+](Cc3ccccc3)C[C@]2(C)C1 ZINC000931213533 640105734 /nfs/dbraw/zinc/10/57/34/640105734.db2.gz BKUDRQRPXYWSKT-HOTGVXAUSA-N 2 0 244.382 2.460 20 0 BEADRP C[C@@H](c1cccc(F)c1)N1C[C@H]2[C@@H](C1)[C@@H]2[NH+](C)C ZINC000931280271 640132197 /nfs/dbraw/zinc/13/21/97/640132197.db2.gz VOJSIFCYQYUSBL-BSLXNSKLSA-N 2 0 248.345 2.379 20 0 BEADRP CSCCC[NH+]1CCC(C)([NH+](C)C)CC1 ZINC000931352033 640167935 /nfs/dbraw/zinc/16/79/35/640167935.db2.gz ZOKJFWNTEBEZEP-UHFFFAOYSA-N 2 0 230.421 2.156 20 0 BEADRP C[NH+](C)C1(C)CC[NH+](C2CCCC2)CC1 ZINC000931353239 640168297 /nfs/dbraw/zinc/16/82/97/640168297.db2.gz BTWYCWUJOIXHPB-UHFFFAOYSA-N 2 0 210.365 2.345 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH+]1CCC(C)([NH+](C)C)CC1 ZINC000931357294 640170997 /nfs/dbraw/zinc/17/09/97/640170997.db2.gz VCLGQYJAYSFRGB-OLZOCXBDSA-N 2 0 224.392 2.449 20 0 BEADRP C[N@@H+]1CC[C@@H]2C[NH+](CCCCCF)C[C@@H]2C1 ZINC000931436274 640202338 /nfs/dbraw/zinc/20/23/38/640202338.db2.gz GKEQRFNMXLISNF-OLZOCXBDSA-N 2 0 228.355 2.010 20 0 BEADRP CC(C)C[C@@H](C)[N@@H+]1C[C@@H]2CC[NH+](C)C[C@@H]2C1 ZINC000931435859 640203936 /nfs/dbraw/zinc/20/39/36/640203936.db2.gz DYCKRVVAAYYIBG-HZSPNIEDSA-N 2 0 224.392 2.305 20 0 BEADRP C[N@@H+]1CC[C@@H]2C[NH+](CC3(C)CCC3)C[C@@H]2C1 ZINC000931439296 640207436 /nfs/dbraw/zinc/20/74/36/640207436.db2.gz TZKAOUXJZITRAC-OLZOCXBDSA-N 2 0 222.376 2.060 20 0 BEADRP CN1CC[C@@H]2CC[C@H](C1)[N@@H+]2[C@@H]1C=CCCC1 ZINC000931726182 640338145 /nfs/dbraw/zinc/33/81/45/640338145.db2.gz DKDMDBKVHIXAPJ-HZSPNIEDSA-N 2 0 220.360 2.264 20 0 BEADRP CN1CC[C@@H]2CC[C@H](C1)[N@@H+]2[C@H]1C=CCCC1 ZINC000931726184 640340697 /nfs/dbraw/zinc/34/06/97/640340697.db2.gz DKDMDBKVHIXAPJ-MELADBBJSA-N 2 0 220.360 2.264 20 0 BEADRP CN1CC[C@@H]2CC[C@H](C1)[N@@H+]2C[Si](C)(C)C ZINC000931726346 640341762 /nfs/dbraw/zinc/34/17/62/640341762.db2.gz HHDVJWZBBLSTMI-NWDGAFQWSA-N 2 0 226.440 2.032 20 0 BEADRP C[NH+]1CCC(C[NH2+]C2CCCCC2)CC1 ZINC000044515195 640398460 /nfs/dbraw/zinc/39/84/60/640398460.db2.gz LSANLBRZZWKKDR-UHFFFAOYSA-N 2 0 210.365 2.251 20 0 BEADRP CC[C@H]([NH2+]CC1CC[NH+](C)CC1)C(C)C ZINC000044516571 640400090 /nfs/dbraw/zinc/40/00/90/640400090.db2.gz JTSRGXMCSFCRFV-ZDUSSCGKSA-N 2 0 212.381 2.352 20 0 BEADRP CS[C@@H]1CC[C@H]([NH2+][C@@H]2CCN(C)[C@@H](C)C2)C1 ZINC000224268621 640607239 /nfs/dbraw/zinc/60/72/39/640607239.db2.gz RADYXVCYMWTTSN-WUHRBBMRSA-N 2 0 242.432 2.343 20 0 BEADRP CC(C)[C@H]1CC[N@H+](CCCCCC[NH3+])C1 ZINC000166308620 640627937 /nfs/dbraw/zinc/62/79/37/640627937.db2.gz CGIXYOLXWYMQEV-ZDUSSCGKSA-N 2 0 212.381 2.483 20 0 BEADRP C[C@H]([NH3+])[C@H]1CCC[N@@H+]([C@@H](C)c2ccccn2)C1 ZINC000226331526 640748662 /nfs/dbraw/zinc/74/86/62/640748662.db2.gz AKGQDDMJMODQML-AVGNSLFASA-N 2 0 233.359 2.202 20 0 BEADRP C[N@@H+]1C[C@@H]2C[NH+](C[C@@H]3CC[C@H]4C[C@H]4C3)C[C@]2(C)C1 ZINC000933735356 640759046 /nfs/dbraw/zinc/75/90/46/640759046.db2.gz WDCMZXOVJIETGR-JKJDWNRSSA-N 2 0 248.414 2.306 20 0 BEADRP CC(C)[C@H]1CCC[N@@H+]1C[C@@]1(C)CCC[NH2+]C1 ZINC000226564327 640776337 /nfs/dbraw/zinc/77/63/37/640776337.db2.gz IWKCFUXWOQMEID-KGLIPLIRSA-N 2 0 224.392 2.497 20 0 BEADRP CC1(C)CCC[C@@H]1[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000226990319 640809742 /nfs/dbraw/zinc/80/97/42/640809742.db2.gz BWYNURIUZDFMIQ-WOPDTQHZSA-N 2 0 210.365 2.425 20 0 BEADRP Cc1ccc(C[N@@H+](C)C[C@@H]2C[NH2+]C[C@H]2C)cc1 ZINC000227171012 640817048 /nfs/dbraw/zinc/81/70/48/640817048.db2.gz OVTKIVHCBPDFHQ-HIFRSBDPSA-N 2 0 232.371 2.282 20 0 BEADRP Cc1cccc(C[N@@H+](C)C[C@@H]2C[NH2+]C[C@H]2C)c1 ZINC000227171324 640817176 /nfs/dbraw/zinc/81/71/76/640817176.db2.gz MZCXROUPCLETAT-HIFRSBDPSA-N 2 0 232.371 2.282 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]CCCCCCO)CC1 ZINC000227877518 640852717 /nfs/dbraw/zinc/85/27/17/640852717.db2.gz DKEXAPIISLXXNW-UHFFFAOYSA-N 2 0 242.407 2.002 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@@H+]1CCC[C@@H]2CCC[C@H]21 ZINC000228029489 640856988 /nfs/dbraw/zinc/85/69/88/640856988.db2.gz MMMVVORZNAAQQD-ZOBORPQBSA-N 2 0 222.376 2.106 20 0 BEADRP Cc1cscc1C[NH2+]CC1CC[NH+](C)CC1 ZINC000087309268 640870745 /nfs/dbraw/zinc/87/07/45/640870745.db2.gz FAGBUGPJKBVHKY-UHFFFAOYSA-N 2 0 238.400 2.488 20 0 BEADRP Cc1ccccc1OCC[N@H+]1CC[C@@H]([NH3+])C[C@H]1C ZINC000228348559 640872106 /nfs/dbraw/zinc/87/21/06/640872106.db2.gz BOKZDPXUVZSEBS-ZIAGYGMSSA-N 2 0 248.370 2.185 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@@H](C)[C@@H](C[NH3+])C2)cc1 ZINC000229064963 640919557 /nfs/dbraw/zinc/91/95/57/640919557.db2.gz HGWYNHIXNXPMCB-HIFRSBDPSA-N 2 0 232.371 2.412 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+]C2CCC([NH3+])CC2)C1 ZINC000230412527 641052147 /nfs/dbraw/zinc/05/21/47/641052147.db2.gz MWLCJROPNXIADJ-IALDZJHCSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]1CCC[C@@H]1C[NH2+]CC1CC[NH+](C)CC1 ZINC000230664534 641082890 /nfs/dbraw/zinc/08/28/90/641082890.db2.gz MRXRTSUCEKRWSP-GXTWGEPZSA-N 2 0 224.392 2.354 20 0 BEADRP CC(C)(C)CCC[NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23 ZINC000313247864 641543810 /nfs/dbraw/zinc/54/38/10/641543810.db2.gz ABFXLUVWZMQWEE-MEBFFEOJSA-N 2 0 236.403 2.399 20 0 BEADRP CC(C)C(C)(C)C[NH2+][C@@H]1CCC[C@H]1C[NH3+] ZINC000232773326 641570652 /nfs/dbraw/zinc/57/06/52/641570652.db2.gz ZXMPPKZCOLCJJP-NWDGAFQWSA-N 2 0 212.381 2.386 20 0 BEADRP CC1(C)CCC[C@H]([NH2+]C[C@H]2CCC[NH2+]2)C1 ZINC000232806169 641693647 /nfs/dbraw/zinc/69/36/47/641693647.db2.gz JQTDUQWIOUNOBD-NWDGAFQWSA-N 2 0 210.365 2.297 20 0 BEADRP CCC(=O)CC[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000190197145 641850501 /nfs/dbraw/zinc/85/05/01/641850501.db2.gz SKTZCOOEBHXPRZ-UHFFFAOYSA-N 2 0 240.391 2.019 20 0 BEADRP CC(C)([NH3+])CC[NH2+][C@@H](C1CC1)C1CCC1 ZINC000324562641 641880024 /nfs/dbraw/zinc/88/00/24/641880024.db2.gz ASARLBJPDSERNO-GFCCVEGCSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)([NH3+])CC[NH2+][C@H](C1CC1)C1CCC1 ZINC000324562642 641880399 /nfs/dbraw/zinc/88/03/99/641880399.db2.gz ASARLBJPDSERNO-LBPRGKRZSA-N 2 0 210.365 2.282 20 0 BEADRP CCC1(C[NH2+][C@H]2CCC[NH2+]CC2)CCC1 ZINC000232881954 642074983 /nfs/dbraw/zinc/07/49/83/642074983.db2.gz IIJRDHPOZWMCQF-LBPRGKRZSA-N 2 0 210.365 2.298 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@@H]1CCC(C)(C)C1 ZINC000129573591 642198211 /nfs/dbraw/zinc/19/82/11/642198211.db2.gz BXCQXXAYDAQSFU-GRYCIOLGSA-N 2 0 210.365 2.010 20 0 BEADRP CC1(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)CC1 ZINC000232916406 642388437 /nfs/dbraw/zinc/38/84/37/642388437.db2.gz GFYJRLHVLPZXMT-RWMBFGLXSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+][C@H]1CC[NH2+]C[C@H]1C1CCCC1 ZINC000925472194 642391337 /nfs/dbraw/zinc/39/13/37/642391337.db2.gz AYURWSFHGMQMMW-RZFFKMDDSA-N 2 0 236.403 2.400 20 0 BEADRP C[C@@H]1C[N@@H+](C[C@]2(C)CCC[NH2+]C2)C[C@H](C)S1 ZINC000069910100 642415334 /nfs/dbraw/zinc/41/53/34/642415334.db2.gz WCFJTWBLMOOWIT-FRRDWIJNSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@H]1CC[N@H+](CC2CCCCC2)C[C@H]1C[NH3+] ZINC000253237394 642631901 /nfs/dbraw/zinc/63/19/01/642631901.db2.gz OWAHAIVCQBLUKP-GXTWGEPZSA-N 2 0 224.392 2.483 20 0 BEADRP CCO[C@H]1C[C@@H]([NH2+]CC([NH3+])(CC)CC)C1(C)C ZINC000233777600 642695121 /nfs/dbraw/zinc/69/51/21/642695121.db2.gz KRWKKMIULPQXPY-NEPJUHHUSA-N 2 0 242.407 2.297 20 0 BEADRP C[C@@H]([NH2+]CCCCCC[NH3+])c1nccs1 ZINC000070733415 643068095 /nfs/dbraw/zinc/06/80/95/643068095.db2.gz LRIJZASONZCBPE-SNVBAGLBSA-N 2 0 227.377 2.313 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C[C@H]2CCCCC[NH2+]2)C1 ZINC000253310286 643191897 /nfs/dbraw/zinc/19/18/97/643191897.db2.gz UDXLALDOCZBSJW-JHJVBQTASA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]1CCC[N@H+](C[C@]2(C)CCC[NH2+]C2)CC1 ZINC000082491037 643325973 /nfs/dbraw/zinc/32/59/73/643325973.db2.gz VXOJCELMRUMVMI-UONOGXRCSA-N 2 0 224.392 2.498 20 0 BEADRP Fc1ccc(C[N@@H+]2CCC3(C2)CC[NH2+]CC3)cc1 ZINC000082554244 643341678 /nfs/dbraw/zinc/34/16/78/643341678.db2.gz YCQBRMCRVQULTB-UHFFFAOYSA-N 2 0 248.345 2.401 20 0 BEADRP C[C@@H]([NH3+])C1CC[NH+](CCc2cccs2)CC1 ZINC000082602697 643353777 /nfs/dbraw/zinc/35/37/77/643353777.db2.gz SDHAJKBBZGVJKY-LLVKDONJSA-N 2 0 238.400 2.350 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH2+]CC2(C)CCCC2)C1 ZINC000082619091 643354775 /nfs/dbraw/zinc/35/47/75/643354775.db2.gz CATQODMDFABCAT-ZDUSSCGKSA-N 2 0 224.392 2.498 20 0 BEADRP CCC(CC)(CC)[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000083388685 643443868 /nfs/dbraw/zinc/44/38/68/643443868.db2.gz LBGSRCRMSMCXQN-NEPJUHHUSA-N 2 0 212.381 2.400 20 0 BEADRP C[N@H+](CCCCCC[NH3+])C[C@@H]1CCCCO1 ZINC000042466628 643509052 /nfs/dbraw/zinc/50/90/52/643509052.db2.gz WALCPGYBJJCNAJ-ZDUSSCGKSA-N 2 0 228.380 2.006 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+]C1CCCCC1 ZINC000084215367 643550697 /nfs/dbraw/zinc/55/06/97/643550697.db2.gz UZWDNUCEGSYSIH-DGCLKSJQSA-N 2 0 210.365 2.426 20 0 BEADRP CC1CCC([NH2+][C@H]2CCC[C@H]2C[NH3+])CC1 ZINC000084217600 643650156 /nfs/dbraw/zinc/65/01/56/643650156.db2.gz HAOOSEZGYOBHKQ-MVKMKZAISA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]C1CCCCCC1 ZINC000084218025 643650509 /nfs/dbraw/zinc/65/05/09/643650509.db2.gz FWRCVRNRZGGPKZ-YPMHNXCESA-N 2 0 210.365 2.426 20 0 BEADRP CCC1(C)CC[NH+](CC[C@H]2CC[NH2+]C2)CC1 ZINC000084385830 643659765 /nfs/dbraw/zinc/65/97/65/643659765.db2.gz LKLKCUVXHFRKBH-CYBMUJFWSA-N 2 0 224.392 2.498 20 0 BEADRP CC1CCC([N@H+](C)CC[C@H]2CC[NH2+]C2)CC1 ZINC000084385174 643660048 /nfs/dbraw/zinc/66/00/48/643660048.db2.gz NMUFDYLITGTMSI-ROKHWSDSSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1ccc(C)c(C[N@@H+]2CC[C@@H](C[NH3+])C2)c1 ZINC000050245568 643661551 /nfs/dbraw/zinc/66/15/51/643661551.db2.gz GYMXVSVUCVJFTA-ZDUSSCGKSA-N 2 0 218.344 2.084 20 0 BEADRP CC[C@@H](C)C[N@H+](CC)CCC[NH2+]C1CC1 ZINC000086437503 644133975 /nfs/dbraw/zinc/13/39/75/644133975.db2.gz AQKVJQJPXSFKLR-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP CCCCCC[N@H+](C)CC(C)(C)C[NH3+] ZINC000086637193 644157404 /nfs/dbraw/zinc/15/74/04/644157404.db2.gz ZYZMJAOZLSRBMN-UHFFFAOYSA-N 2 0 200.370 2.483 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+]C[C@@H]2CCC=CO2)C1 ZINC000194261442 644311423 /nfs/dbraw/zinc/31/14/23/644311423.db2.gz SGNLVVLKHPCFDX-KBPBESRZSA-N 2 0 238.375 2.001 20 0 BEADRP CCCCCC[C@H](O)C[NH2+][C@](C)(C[NH3+])C(C)C ZINC000923296243 644335039 /nfs/dbraw/zinc/33/50/39/644335039.db2.gz PZESOZVGVUYMRA-UONOGXRCSA-N 2 0 244.423 2.281 20 0 BEADRP CC(C)CC[C@@H](O)C[N@H+](C)CC[C@H]([NH3+])C(C)C ZINC000923298988 644337851 /nfs/dbraw/zinc/33/78/51/644337851.db2.gz VWERRYRLOORYNW-KGLIPLIRSA-N 2 0 244.423 2.089 20 0 BEADRP CCCCCC[C@H](O)C[NH+]1CCC(C)([NH3+])CC1 ZINC000923346309 644365106 /nfs/dbraw/zinc/36/51/06/644365106.db2.gz PDJYFSZMJLWLES-ZDUSSCGKSA-N 2 0 242.407 2.131 20 0 BEADRP C[C@@H]1CC[C@H](C)CN1CC[NH2+]C(C)(C)C ZINC000084047068 644415971 /nfs/dbraw/zinc/41/59/71/644415971.db2.gz IKXIBSPLKGSXMV-NWDGAFQWSA-N 2 0 212.381 2.495 20 0 BEADRP C[N@H+](CC[C@H]1CC[NH2+]C1)Cc1cccs1 ZINC000084384766 644421899 /nfs/dbraw/zinc/42/18/99/644421899.db2.gz PMDYIFJVUQRDBD-LLVKDONJSA-N 2 0 224.373 2.180 20 0 BEADRP C[C@@H]1CC[C@@H](C)[N@H+](C[C@@H]2CC[C@H]([NH3+])C2)C1 ZINC000085016290 644434640 /nfs/dbraw/zinc/43/46/40/644434640.db2.gz OTICXAHIGWGDEF-LPWJVIDDSA-N 2 0 210.365 2.234 20 0 BEADRP C[C@@H]1C[N@H+](CC=C(Cl)Cl)CC[C@@H]1C[NH3+] ZINC000923488757 644464558 /nfs/dbraw/zinc/46/45/58/644464558.db2.gz GEDLVMKOTBXFLQ-RKDXNWHRSA-N 2 0 237.174 2.222 20 0 BEADRP CC1(C)C(C[NH2+][C@H]2CCC[C@@H]2C[NH3+])C1(C)C ZINC000086239369 644457940 /nfs/dbraw/zinc/45/79/40/644457940.db2.gz OPBQTRQDAUQQDK-MNOVXSKESA-N 2 0 224.392 2.386 20 0 BEADRP CC(C)=CCC[N@@H+]1CC[C@H](C[NH3+])[C@H](C)C1 ZINC000923490970 644465966 /nfs/dbraw/zinc/46/59/66/644465966.db2.gz PLBHVZLLVNZGJM-CHWSQXEVSA-N 2 0 210.365 2.259 20 0 BEADRP C[C@H]1C[N@H+](CCCC2CC2)CC[C@H]1C[NH3+] ZINC000923492583 644468881 /nfs/dbraw/zinc/46/88/81/644468881.db2.gz XLVNQWHZORKTIB-AAEUAGOBSA-N 2 0 210.365 2.093 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@@H](C[NH3+])[C@H](C)C2)c(C)n1 ZINC000923494915 644470309 /nfs/dbraw/zinc/47/03/09/644470309.db2.gz QMGWSQYMFXMAAQ-RISCZKNCSA-N 2 0 247.386 2.115 20 0 BEADRP CC(C)[NH+]1CCC([C@H]2CCC[NH2+]CC2)CC1 ZINC000923509987 644477230 /nfs/dbraw/zinc/47/72/30/644477230.db2.gz RXJABIAHZGVUJO-ZDUSSCGKSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H](c1cccc(F)c1)[N@@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1 ZINC000923517893 644479135 /nfs/dbraw/zinc/47/91/35/644479135.db2.gz HCDHAVVBIKGNDL-KWCYVHTRSA-N 2 0 248.345 2.428 20 0 BEADRP CC(C)[C@@H](C)[N@@H+]1CC[C@]2(C1)CCCC[NH2+]2 ZINC000923533724 644490542 /nfs/dbraw/zinc/49/05/42/644490542.db2.gz NTCZIMVQRRNAMK-OLZOCXBDSA-N 2 0 210.365 2.249 20 0 BEADRP [NH3+]CCCCCC[N@@H+]1CCOC[C@H]1CC1CC1 ZINC000923551594 644495355 /nfs/dbraw/zinc/49/53/55/644495355.db2.gz ABOHMCNTJWMJLE-CQSZACIVSA-N 2 0 240.391 2.006 20 0 BEADRP COc1ccc(C[N@H+](C)C[C@@H]2CC[C@H]([NH3+])C2)cc1 ZINC000091546091 644628726 /nfs/dbraw/zinc/62/87/26/644628726.db2.gz JCZHMCMURBXNDO-KGLIPLIRSA-N 2 0 248.370 2.254 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+]C[C@H]2CCC=CO2)C1 ZINC000249035448 644709507 /nfs/dbraw/zinc/70/95/07/644709507.db2.gz SGNLVVLKHPCFDX-UONOGXRCSA-N 2 0 238.375 2.001 20 0 BEADRP C[C@H](Cc1ccco1)[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000250981191 644788248 /nfs/dbraw/zinc/78/82/48/644788248.db2.gz IXQPFNUDQZJJIQ-RDBSUJKOSA-N 2 0 248.370 2.427 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@H]1C[NH3+])c1cccc(O)c1 ZINC000251554833 644809237 /nfs/dbraw/zinc/80/92/37/644809237.db2.gz REHLVQKFVNCCTM-VHRBIJSZSA-N 2 0 234.343 2.170 20 0 BEADRP C[C@@H]1C[N@H+](CCC(C)(C)C)CC[C@H]1C[NH3+] ZINC000251773597 644822502 /nfs/dbraw/zinc/82/25/02/644822502.db2.gz MNOXUMAHZZXGNV-NEPJUHHUSA-N 2 0 212.381 2.339 20 0 BEADRP CSC(C)(C)C[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000252703081 644886430 /nfs/dbraw/zinc/88/64/30/644886430.db2.gz FIDBJERYUMMKLC-RYUDHWBXSA-N 2 0 242.432 2.344 20 0 BEADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+][C@H]1CCO[C@H]1C ZINC000252751884 644899291 /nfs/dbraw/zinc/89/92/91/644899291.db2.gz XCCWNUHXDJDGHV-RFGFWPKPSA-N 2 0 240.391 2.064 20 0 BEADRP C[N@H+]1C[C@H]2CC[C@@H](C1)C2[NH2+][C@@H]1CC[C@H]2C[C@H]2C1 ZINC000926642646 645328853 /nfs/dbraw/zinc/32/88/53/645328853.db2.gz QYJJFECVWKWUBD-SIOPTORSSA-N 2 0 234.387 2.105 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@H]1[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000926665535 645343841 /nfs/dbraw/zinc/34/38/41/645343841.db2.gz GTZYLVKGSUUFAH-KCLGILNXSA-N 2 0 224.392 2.351 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+]CCC1(C[NH3+])CC1 ZINC000844920182 645349275 /nfs/dbraw/zinc/34/92/75/645349275.db2.gz KQHPAUVGEUXNGO-NWDGAFQWSA-N 2 0 210.365 2.140 20 0 BEADRP C(CC1CC[NH2+]CC1)[NH2+][C@H]1CC[C@@H]1C1CC1 ZINC000844927380 645350591 /nfs/dbraw/zinc/35/05/91/645350591.db2.gz ZOUJSSVFTDKRAN-KGLIPLIRSA-N 2 0 222.376 2.154 20 0 BEADRP CCC[NH2+][C@@H]1CC[NH2+]C[C@H]1C1CCCC1 ZINC000925487333 645466236 /nfs/dbraw/zinc/46/62/36/645466236.db2.gz CIAUVUZZQVLPHM-QWHCGFSZSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H]1CN(C2CC2)C[C@H]1[NH2+]CCC1CC=CC1 ZINC000926951952 645497897 /nfs/dbraw/zinc/49/78/97/645497897.db2.gz HLRCAXZNJPRGEA-SWLSCSKDSA-N 2 0 234.387 2.415 20 0 BEADRP C[C@@H]([NH2+]C[C@]12C[C@H]1CCC2)C1CC[NH+](C)CC1 ZINC000927120568 645556046 /nfs/dbraw/zinc/55/60/46/645556046.db2.gz UESSQEMOGSAYLW-YUELXQCFSA-N 2 0 236.403 2.497 20 0 BEADRP CCc1cc(N2CC[C@@H]3[C@H]2CCC[N@@H+]3C)cc[nH+]1 ZINC000872779765 645768405 /nfs/dbraw/zinc/76/84/05/645768405.db2.gz TUCARJRVVRZZLD-HUUCEWRRSA-N 2 0 245.370 2.317 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH+]1CCC(C[NH+](C)C)CC1 ZINC000929283327 646058335 /nfs/dbraw/zinc/05/83/35/646058335.db2.gz PXCYBAOIOMCQCJ-KGLIPLIRSA-N 2 0 224.392 2.306 20 0 BEADRP CC1CC(C[NH+]2CCC(C[NH+](C)C)CC2)C1 ZINC000929283946 646059925 /nfs/dbraw/zinc/05/99/25/646059925.db2.gz WKPKFMZGPKEZRG-UHFFFAOYSA-N 2 0 224.392 2.306 20 0 BEADRP C1=C[C@@H]2CC[C@H]1C[C@@H]2[NH2+][C@@H]1CCN(CC2CC2)C1 ZINC000925009263 646156940 /nfs/dbraw/zinc/15/69/40/646156940.db2.gz BKOWTHHLGUAOSC-XZDPQHSOSA-N 2 0 246.398 2.415 20 0 BEADRP C[C@@H]1C[C@@H]1[NH2+][C@@H]1CC[NH2+]C[C@H]1C1CCCC1 ZINC000925493395 646299493 /nfs/dbraw/zinc/29/94/93/646299493.db2.gz XMMJOLSBMOSNJY-CABNGKKXSA-N 2 0 222.376 2.153 20 0 BEADRP CC1(C)C[C@@H]([NH3+])C[C@@H](NCc2nccs2)C1 ZINC000925487816 646300288 /nfs/dbraw/zinc/30/02/88/646300288.db2.gz XJPOKOFFRHKMLM-VHSXEESVSA-N 2 0 239.388 2.139 20 0 BEADRP CC1(C)C[C@H]([NH3+])C[C@@H]([NH2+]Cc2cccnc2)C1 ZINC000925494065 646302237 /nfs/dbraw/zinc/30/22/37/646302237.db2.gz MZNDAPHUPGHAGB-CHWSQXEVSA-N 2 0 233.359 2.077 20 0 BEADRP CC[NH+](CC)CCN[C@H](c1ccccc1)[C@@H](C)[NH3+] ZINC000925505486 646305276 /nfs/dbraw/zinc/30/52/76/646305276.db2.gz UJINXFYTBFFBDC-HIFRSBDPSA-N 2 0 249.402 2.006 20 0 BEADRP CC1(C)C[C@H]([NH3+])C[C@@H]([NH2+]Cc2ccco2)C1 ZINC000925506025 646305591 /nfs/dbraw/zinc/30/55/91/646305591.db2.gz WSPVOBXMFJMFPU-GHMZBOCLSA-N 2 0 222.332 2.275 20 0 BEADRP CSC[C@H](C)[NH2+][C@@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925505292 646306549 /nfs/dbraw/zinc/30/65/49/646306549.db2.gz QFTLKPJJICWUMD-GARJFASQSA-N 2 0 230.421 2.234 20 0 BEADRP CC1(C)C[C@@H]([NH3+])C[C@H]([NH2+]Cc2ccco2)C1 ZINC000925506027 646306571 /nfs/dbraw/zinc/30/65/71/646306571.db2.gz WSPVOBXMFJMFPU-QWRGUYRKSA-N 2 0 222.332 2.275 20 0 BEADRP CC(C)OCCC[NH2+][C@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925506837 646308520 /nfs/dbraw/zinc/30/85/20/646308520.db2.gz SLIITLHEKYRRIC-OLZOCXBDSA-N 2 0 242.407 2.297 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+]CC(C1CC1)C1CC1 ZINC000925514308 646311440 /nfs/dbraw/zinc/31/14/40/646311440.db2.gz KKIAKTHPZYEVDA-ZDUSSCGKSA-N 2 0 222.376 2.153 20 0 BEADRP CC[C@H]([NH2+][C@H]1C[C@@H]([NH3+])C12CCC2)c1ccncc1 ZINC000925520045 646313553 /nfs/dbraw/zinc/31/35/53/646313553.db2.gz DUBCXRUJZBAUJH-MJBXVCDLSA-N 2 0 245.370 2.392 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+]CCCC1CC1 ZINC000925569457 646337555 /nfs/dbraw/zinc/33/75/55/646337555.db2.gz QXVRFWFHFJWDEL-VTXSZYRJSA-N 2 0 222.376 2.282 20 0 BEADRP CC1(C)[C@H]([NH2+]CCC2CC2)[C@@H]2CCC[NH2+][C@@H]21 ZINC000925575252 646341270 /nfs/dbraw/zinc/34/12/70/646341270.db2.gz YSDZQSPPURFADK-FRRDWIJNSA-N 2 0 222.376 2.153 20 0 BEADRP CC(C)C1(C[NH2+][C@H]2CC[NH2+]C23CCC3)CC1 ZINC000925579674 646344351 /nfs/dbraw/zinc/34/43/51/646344351.db2.gz NUUFCDZTZBEJJU-LBPRGKRZSA-N 2 0 222.376 2.297 20 0 BEADRP CC1(C)C[C@@H]([NH3+])C[C@H]([NH2+]C2CCSCC2)C1 ZINC000925592904 646348766 /nfs/dbraw/zinc/34/87/66/646348766.db2.gz ZNFLNYAIRSJMIV-JQWIXIFHSA-N 2 0 242.432 2.378 20 0 BEADRP C[C@@H]([NH2+][C@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C)C1CC1 ZINC000925589626 646348814 /nfs/dbraw/zinc/34/88/14/646348814.db2.gz ZTVXILKERKCTKW-XEZLXBQYSA-N 2 0 222.376 2.151 20 0 BEADRP C[C@@H]([NH2+][C@@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C)C1CC1 ZINC000925589623 646349269 /nfs/dbraw/zinc/34/92/69/646349269.db2.gz ZTVXILKERKCTKW-FOUMNBMASA-N 2 0 222.376 2.151 20 0 BEADRP C[C@H]1CC[C@H]([NH2+][C@@H]2CC[NH2+]C23CCC3)CC1 ZINC000925597990 646350647 /nfs/dbraw/zinc/35/06/47/646350647.db2.gz ZRGRVGDJABHNRD-JHJVBQTASA-N 2 0 222.376 2.439 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C)C1 ZINC000929847670 646358020 /nfs/dbraw/zinc/35/80/20/646358020.db2.gz NAJZWNJBDDSNHV-KBXIAJHMSA-N 2 0 236.403 2.449 20 0 BEADRP CC1(C)C[C@@H]([NH3+])C[C@H]([NH2+]CCc2ccco2)C1 ZINC000925611292 646360944 /nfs/dbraw/zinc/36/09/44/646360944.db2.gz LUICVKWAQFABPO-RYUDHWBXSA-N 2 0 236.359 2.318 20 0 BEADRP CCC[C@](C)(O)C[NH2+][C@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925613631 646362005 /nfs/dbraw/zinc/36/20/05/646362005.db2.gz UKUFGCZKXOZKKR-DYEKYZERSA-N 2 0 242.407 2.033 20 0 BEADRP C1=CC[C@H](C[NH2+][C@H]2CC[NH2+]C23CCC3)CC1 ZINC000925618860 646364808 /nfs/dbraw/zinc/36/48/08/646364808.db2.gz YQMICPZXFDFKHX-STQMWFEESA-N 2 0 220.360 2.217 20 0 BEADRP FCCC[NH2+][C@@H]1CC[NH2+]C[C@@H]1C1CCCC1 ZINC000925621066 646368506 /nfs/dbraw/zinc/36/85/06/646368506.db2.gz YHEWPQARQHKHSR-CHWSQXEVSA-N 2 0 228.355 2.104 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]CC23CCC(CC2)C3)C12CCC2 ZINC000925627046 646374879 /nfs/dbraw/zinc/37/48/79/646374879.db2.gz VVOMWAKXGIMLGH-CEUNDQEZSA-N 2 0 234.387 2.426 20 0 BEADRP CC(C)[NH2+]C1CC[NH+]([C@@H](C)C2CC2)CC1 ZINC000929962398 646378546 /nfs/dbraw/zinc/37/85/46/646378546.db2.gz SZOGQSAQWHEEDH-NSHDSACASA-N 2 0 210.365 2.247 20 0 BEADRP CC(C)OCCCC[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000925633687 646378604 /nfs/dbraw/zinc/37/86/04/646378604.db2.gz GFXOJCJVTNDYLJ-CYBMUJFWSA-N 2 0 240.391 2.066 20 0 BEADRP CSCCCCC[NH2+][C@H]1CC[NH2+]C1(C)C ZINC000925647550 646386150 /nfs/dbraw/zinc/38/61/50/646386150.db2.gz YWSSPJZVNHFKJR-NSHDSACASA-N 2 0 230.421 2.250 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+]C[C@H]1CCC(F)(F)C1 ZINC000925652026 646391585 /nfs/dbraw/zinc/39/15/85/646391585.db2.gz AZDRDOCQNMEOKP-UWVGGRQHSA-N 2 0 232.318 2.152 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC000925652028 646391628 /nfs/dbraw/zinc/39/16/28/646391628.db2.gz AZDRDOCQNMEOKP-ZJUUUORDSA-N 2 0 232.318 2.152 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC000925652025 646392001 /nfs/dbraw/zinc/39/20/01/646392001.db2.gz AZDRDOCQNMEOKP-NXEZZACHSA-N 2 0 232.318 2.152 20 0 BEADRP C[C@@H]1CCC[C@@H]1C[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000925656160 646394363 /nfs/dbraw/zinc/39/43/63/646394363.db2.gz VZBBZGHBNMTJBB-UPJWGTAASA-N 2 0 222.376 2.297 20 0 BEADRP CC(C)=CC[NH2+][C@@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925659071 646395741 /nfs/dbraw/zinc/39/57/41/646395741.db2.gz SWFIEZLBCDGDMR-VXGBXAGGSA-N 2 0 210.365 2.448 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]CC2(C(F)(F)F)CC2)C12CCC2 ZINC000925673872 646403116 /nfs/dbraw/zinc/40/31/16/646403116.db2.gz ZJMVQAYFEKCZHG-IUCAKERBSA-N 2 0 248.292 2.188 20 0 BEADRP CC(C)(C)C1CC([NH2+][C@H]2[C@@H]3[NH2+]C[C@H]4C[C@H]2C[C@H]34)C1 ZINC000925677081 646405532 /nfs/dbraw/zinc/40/55/32/646405532.db2.gz NRPOPUXAFPRETF-BBOKLGPLSA-N 2 0 248.414 2.397 20 0 BEADRP C1[C@@H]2[C@H]1CCC[C@@H]2[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000925686004 646413038 /nfs/dbraw/zinc/41/30/38/646413038.db2.gz PGSMOFJSPHHLRY-RNJOBUHISA-N 2 0 220.360 2.049 20 0 BEADRP C([NH2+][C@H]1CC[NH2+]C12CCCC2)[C@@H]1C[C@H]1C1CC1 ZINC000925688449 646414526 /nfs/dbraw/zinc/41/45/26/646414526.db2.gz CQQOOQYHMCYVQZ-IHRRRGAJSA-N 2 0 234.387 2.297 20 0 BEADRP CC1(C)C[C@H]([NH3+])C[C@@H]([NH2+][C@@H]2C[C@H]3C[C@H]3C2)C1 ZINC000925706069 646430884 /nfs/dbraw/zinc/43/08/84/646430884.db2.gz LAYXWSNLMIRDOR-NZEXEKPDSA-N 2 0 222.376 2.281 20 0 BEADRP Cc1cc(C[NH2+][C@H]2C[C@H]([NH3+])C23CCC3)cc(C)n1 ZINC000925706578 646431146 /nfs/dbraw/zinc/43/11/46/646431146.db2.gz MPQMVWYRPSUXFT-KBPBESRZSA-N 2 0 245.370 2.058 20 0 BEADRP CC1(C)[C@H]([NH2+]CCc2ccoc2)[C@@H]2CCC[NH2+][C@@H]21 ZINC000925709053 646434369 /nfs/dbraw/zinc/43/43/69/646434369.db2.gz NWUBSGCGEHLFFS-HZSPNIEDSA-N 2 0 248.370 2.188 20 0 BEADRP CC1(C)[C@@H]([NH2+]CCc2ccoc2)[C@@H]2CCC[NH2+][C@@H]21 ZINC000925709056 646434728 /nfs/dbraw/zinc/43/47/28/646434728.db2.gz NWUBSGCGEHLFFS-RDBSUJKOSA-N 2 0 248.370 2.188 20 0 BEADRP C[C@@H](N)[C@@H]([NH2+][C@H](C)CCCC[NH3+])c1ccccc1 ZINC000925711828 646437667 /nfs/dbraw/zinc/43/76/67/646437667.db2.gz SJWCDQQVADYOBC-UMVBOHGHSA-N 2 0 249.402 2.182 20 0 BEADRP FC1CCC(C[NH2+][C@H]2CC[NH2+]C23CCC3)CC1 ZINC000925714557 646438100 /nfs/dbraw/zinc/43/81/00/646438100.db2.gz ZLQVDUSCCSPOIY-BPCQOVAHSA-N 2 0 240.366 2.389 20 0 BEADRP C/C=C\C[NH2+][C@@H]1CC[NH2+]C[C@@H]1C1CCCC1 ZINC000925720119 646444586 /nfs/dbraw/zinc/44/45/86/646444586.db2.gz WPZIOCUAPOHMQF-DTSKHDKYSA-N 2 0 222.376 2.320 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+]CC[C@@H]1CC1(F)F ZINC000925721989 646446623 /nfs/dbraw/zinc/44/66/23/646446623.db2.gz SBFVRDRUENXSTA-CFMPPFMSSA-N 2 0 244.329 2.137 20 0 BEADRP C(C[C@@H]1CCCS1)[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000925723417 646448367 /nfs/dbraw/zinc/44/83/67/646448367.db2.gz UYAPHHLOMIXTGB-RYUDHWBXSA-N 2 0 240.416 2.146 20 0 BEADRP C(C[C@H]1CCSC1)[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000925724805 646449059 /nfs/dbraw/zinc/44/90/59/646449059.db2.gz NFKSQEZRYFVIGK-RYUDHWBXSA-N 2 0 240.416 2.004 20 0 BEADRP CCC[C@H](CCO)[NH2+][C@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925725195 646449184 /nfs/dbraw/zinc/44/91/84/646449184.db2.gz RRAINFGFWROSFT-UPJWGTAASA-N 2 0 242.407 2.033 20 0 BEADRP C(C[C@@H]1CCSC1)[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000925724801 646449954 /nfs/dbraw/zinc/44/99/54/646449954.db2.gz NFKSQEZRYFVIGK-NEPJUHHUSA-N 2 0 240.416 2.004 20 0 BEADRP CC(C)(C[NH2+][C@H]1CCC[C@H]1C[NH3+])CC(F)F ZINC000925735362 646453746 /nfs/dbraw/zinc/45/37/46/646453746.db2.gz ZMIVAINKEQEYGS-UWVGGRQHSA-N 2 0 234.334 2.385 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+]CCC[C@@H]1C=CCC1 ZINC000925729652 646454227 /nfs/dbraw/zinc/45/42/27/646454227.db2.gz LGWNGMMLTCFGCN-OLZOCXBDSA-N 2 0 222.376 2.463 20 0 BEADRP C[C@@H]([NH2+]C[C@]1(C)CC1(C)C)[C@@H]1CCC[NH2+]1 ZINC000925733423 646455909 /nfs/dbraw/zinc/45/59/09/646455909.db2.gz ITSYDYRSSIATMW-MDZLAQPJSA-N 2 0 210.365 2.153 20 0 BEADRP [NH3+]C1CCC([NH2+]CC2(CC3CC3)CC2)CC1 ZINC000925732799 646456683 /nfs/dbraw/zinc/45/66/83/646456683.db2.gz DBKWCVWPJSXAQK-UHFFFAOYSA-N 2 0 222.376 2.426 20 0 BEADRP C[C@@H]([NH2+]C[C@@]1(C)CC1(C)C)[C@@H]1CCC[NH2+]1 ZINC000925733425 646456992 /nfs/dbraw/zinc/45/69/92/646456992.db2.gz ITSYDYRSSIATMW-NTZNESFSSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]([NH2+]CC(C)(C)CC(F)F)[C@@H]1CC[NH2+]C1 ZINC000925735352 646457929 /nfs/dbraw/zinc/45/79/29/646457929.db2.gz ZIXMDGPTOCVIMA-NXEZZACHSA-N 2 0 234.334 2.255 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]CC2(CC3CC3)CC2)C12CCC2 ZINC000925733899 646457972 /nfs/dbraw/zinc/45/79/72/646457972.db2.gz MMXYDFHEUZTNNE-STQMWFEESA-N 2 0 234.387 2.426 20 0 BEADRP CCC[C@H](C)CC[NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23 ZINC000925734959 646458630 /nfs/dbraw/zinc/45/86/30/646458630.db2.gz WDXPVZNQSPURAZ-XDSHMYFISA-N 2 0 236.403 2.399 20 0 BEADRP CCC[C@H](C)CC[NH2+][C@@H](C)[C@H]1CC[NH2+]C1 ZINC000925735244 646459017 /nfs/dbraw/zinc/45/90/17/646459017.db2.gz XVXLJCVSQMVVKC-AVGNSLFASA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H]([NH2+]CC(C)(C)CC(F)F)[C@H]1CCC[NH2+]1 ZINC000925735327 646459136 /nfs/dbraw/zinc/45/91/36/646459136.db2.gz ZDKUGSGLWFJWGB-NXEZZACHSA-N 2 0 234.334 2.398 20 0 BEADRP CCO[C@@H]1C[C@@H]([NH2+]CCC(C)(C)[NH3+])C12CCC2 ZINC000925741823 646462572 /nfs/dbraw/zinc/46/25/72/646462572.db2.gz NQCFZMDBNFHPOA-VXGBXAGGSA-N 2 0 240.391 2.051 20 0 BEADRP Cc1ccncc1[C@@H](C)[NH2+]CCC(C)(C)[NH3+] ZINC000925742285 646462608 /nfs/dbraw/zinc/46/26/08/646462608.db2.gz RWDFKEUJVDJRGV-LLVKDONJSA-N 2 0 221.348 2.168 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+]CCC(C)(C)[NH3+] ZINC000925742286 646464279 /nfs/dbraw/zinc/46/42/79/646464279.db2.gz RWDFKEUJVDJRGV-NSHDSACASA-N 2 0 221.348 2.168 20 0 BEADRP CC[C@H]1CCCC[C@H]1[NH2+][C@@H]1C[NH2+]C[C@H]1C ZINC000925784413 646464876 /nfs/dbraw/zinc/46/48/76/646464876.db2.gz NJBMFBRECJEWBO-YVECIDJPSA-N 2 0 210.365 2.153 20 0 BEADRP CCC1([NH3+])CC[NH+]([C@@H](C)C2CCOCC2)CC1 ZINC000925757949 646466052 /nfs/dbraw/zinc/46/60/52/646466052.db2.gz XINBJMMHYMXBDI-LBPRGKRZSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@@H]1CCNC[C@@H]1[NH2+][C@@H]1C[C@@H]2CCCC[C@H]12 ZINC000925766986 646469356 /nfs/dbraw/zinc/46/93/56/646469356.db2.gz VVMXYDIAEFFGTG-HTOAHKCRSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1C[C@H]1[C@H]1C[C@H]1C)[C@@H]1CCCC[NH2+]1 ZINC000925771314 646471327 /nfs/dbraw/zinc/47/13/27/646471327.db2.gz ATAGNTRXLCHCLL-YRKSKIDTSA-N 2 0 236.403 2.399 20 0 BEADRP CC[C@@H]([NH2+]CC[C@H]1CCCO1)[C@H]1CCCC[NH2+]1 ZINC000925773692 646474064 /nfs/dbraw/zinc/47/40/64/646474064.db2.gz FNUOYXRBACWPRI-MGPQQGTHSA-N 2 0 240.391 2.066 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]Cc1cc(C2CC2)no1 ZINC000925775059 646474752 /nfs/dbraw/zinc/47/47/52/646474752.db2.gz ZNPDUFOYLQGFBL-JTQLQIEISA-N 2 0 237.347 2.159 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+][C@H]1CC(C)(C)C[C@@H]1C ZINC000925782444 646479454 /nfs/dbraw/zinc/47/94/54/646479454.db2.gz GMPHLOCSBCCGAV-WHOHXGKFSA-N 2 0 210.365 2.009 20 0 BEADRP CCC[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000925785251 646480760 /nfs/dbraw/zinc/48/07/60/646480760.db2.gz MHZLUEIQBOVWNK-MQYQWHSLSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@H]1CCCC(C)(C)C1 ZINC000925785893 646480860 /nfs/dbraw/zinc/48/08/60/646480860.db2.gz PYEZZNQHHHXZHC-AGIUHOORSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@H]1CC[C@@H]1C(C)(C)C ZINC000925786349 646481571 /nfs/dbraw/zinc/48/15/71/646481571.db2.gz ROOFYJCLYALUIW-VOAKCMCISA-N 2 0 224.392 2.256 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+]C1[C@@H](C)CCC[C@@H]1C ZINC000925786110 646483265 /nfs/dbraw/zinc/48/32/65/646483265.db2.gz NYILBJNHHPPZDD-NNYUYHANSA-N 2 0 210.365 2.009 20 0 BEADRP Cc1cccc2c1CC[C@@H]2[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000925790836 646485140 /nfs/dbraw/zinc/48/51/40/646485140.db2.gz LCTBADUKPGBELD-WWGRRREGSA-N 2 0 244.382 2.427 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1C[NH2+]C[C@H]1C)C1CCCC1 ZINC000925797339 646486296 /nfs/dbraw/zinc/48/62/96/646486296.db2.gz GCHPZEMFHZVRQJ-MBNYWOFBSA-N 2 0 224.392 2.400 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]CC1C[C@H]2CC[C@@H](C1)S2 ZINC000925802274 646486698 /nfs/dbraw/zinc/48/66/98/646486698.db2.gz KNUMQFBKDBSGNB-ZLOUSURVSA-N 2 0 240.416 2.130 20 0 BEADRP Cc1ccc([C@H](C)[NH2+]CC[C@@H]2C[NH2+]C[C@H]2C)o1 ZINC000925801097 646486906 /nfs/dbraw/zinc/48/69/06/646486906.db2.gz UANMJXPAOQAUTG-KGYLQXTDSA-N 2 0 236.359 2.484 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+]CC[C@@H]2C[NH2+]C[C@H]2C)o1 ZINC000925801098 646487139 /nfs/dbraw/zinc/48/71/39/646487139.db2.gz UANMJXPAOQAUTG-RAIGVLPGSA-N 2 0 236.359 2.484 20 0 BEADRP CC(C)[C@@H]([NH2+]CC[C@@H]1C[NH2+]C[C@H]1C)C1CC1 ZINC000925797389 646487459 /nfs/dbraw/zinc/48/74/59/646487459.db2.gz NUGAXDBMQLGNEG-MRVWCRGKSA-N 2 0 224.392 2.256 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[C@H]1[C@@H]1C[C@H]1C)[C@@H]1CCCC[NH2+]1 ZINC000925822988 646496669 /nfs/dbraw/zinc/49/66/69/646496669.db2.gz NFUFVRFMIBMXFC-IZMFDJJNSA-N 2 0 222.376 2.151 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[C@H]1[C@@H]1C[C@H]1C)[C@H]1CCCC[NH2+]1 ZINC000925822991 646496723 /nfs/dbraw/zinc/49/67/23/646496723.db2.gz NFUFVRFMIBMXFC-YOVYLDAJSA-N 2 0 222.376 2.151 20 0 BEADRP COc1ccc([C@H](C)[NH2+][C@H](C)C2C[NH2+]C2)cc1C ZINC000925833129 646503127 /nfs/dbraw/zinc/50/31/27/646503127.db2.gz ZMMYRWZXEZNGBK-NWDGAFQWSA-N 2 0 248.370 2.262 20 0 BEADRP Cc1cnc(C[NH2+][C@@H]2CC[NH2+]CC[C@H]2C)c(C)c1 ZINC000925838564 646506469 /nfs/dbraw/zinc/50/64/69/646506469.db2.gz YUCAYRHKQNGVSM-TZMCWYRMSA-N 2 0 247.386 2.176 20 0 BEADRP C[C@H]([NH2+]C[C@]12CCC[C@H]1[NH2+]CC2)c1cccnc1 ZINC000925846559 646509416 /nfs/dbraw/zinc/50/94/16/646509416.db2.gz QCEOIDIFICMIGQ-NWANDNLSSA-N 2 0 245.370 2.264 20 0 BEADRP CCC[C@H](O)CC[NH2+][C@@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925856100 646510709 /nfs/dbraw/zinc/51/07/09/646510709.db2.gz JEZGXRAYDTXMDA-XQQFMLRXSA-N 2 0 242.407 2.033 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+][C@@H]1CCSC2(CCC2)C1 ZINC000925857802 646511464 /nfs/dbraw/zinc/51/14/64/646511464.db2.gz IYOFYWDBPRZQAB-IJLUTSLNSA-N 2 0 240.416 2.274 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1CCS[C@@H](C)C1 ZINC000925861193 646514403 /nfs/dbraw/zinc/51/44/03/646514403.db2.gz OFLBOZKUQSDFIB-GRYCIOLGSA-N 2 0 230.421 2.378 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@@H]1CCCc2cccnc21 ZINC000925871673 646521441 /nfs/dbraw/zinc/52/14/41/646521441.db2.gz DKFLBYSPMJICBX-DMDPSCGWSA-N 2 0 233.359 2.174 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+][C@@H]2CCCc3cccnc32)C1 ZINC000925871772 646524800 /nfs/dbraw/zinc/52/48/00/646524800.db2.gz HDHFVTKIZIWUNC-MELADBBJSA-N 2 0 245.370 2.319 20 0 BEADRP COC[C@H](C[NH2+][C@@H]1CCCC[C@@H]1C[NH3+])C(C)C ZINC000925875109 646526535 /nfs/dbraw/zinc/52/65/35/646526535.db2.gz ZRAWAQILYCUPEK-HZSPNIEDSA-N 2 0 242.407 2.012 20 0 BEADRP C([NH2+][C@H]1CC[NH2+]C12CCCC2)[C@]12C[C@H]1CCC2 ZINC000925879640 646528829 /nfs/dbraw/zinc/52/88/29/646528829.db2.gz BEGCTBUBAFYXBP-RDBSUJKOSA-N 2 0 234.387 2.441 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CC[C@H]([NH3+])C1)[C@@H]1CC1(C)C ZINC000925880175 646528938 /nfs/dbraw/zinc/52/89/38/646528938.db2.gz PGZAGMVZINNIHQ-WYUUTHIRSA-N 2 0 210.365 2.138 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1CC[C@H]([NH3+])C1)[C@H]1C[C@@H]1C ZINC000925879486 646528956 /nfs/dbraw/zinc/52/89/56/646528956.db2.gz FQYLSTPUVGBBGO-PPCPHDFISA-N 2 0 210.365 2.138 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[NH2+][C@@H]2CC[C@@H]2C2CCC2)C1 ZINC000925880612 646530620 /nfs/dbraw/zinc/53/06/20/646530620.db2.gz UONFVHAPIMJPRV-IGHBBLSQSA-N 2 0 222.376 2.282 20 0 BEADRP Cc1cncc([C@@H](C)[NH2+]C[C@@H]2CC[C@H]([NH3+])C2)c1 ZINC000925881467 646531255 /nfs/dbraw/zinc/53/12/55/646531255.db2.gz BLKIAHMJDGDABS-BZPMIXESSA-N 2 0 233.359 2.168 20 0 BEADRP CC(C)[NH2+][C@H]1C[C@@](C[NH3+])(c2ccccc2)C1 ZINC000925886429 646533151 /nfs/dbraw/zinc/53/31/51/646533151.db2.gz GSXRYSAMRPLQLY-OKILXGFUSA-N 2 0 218.344 2.044 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCc2nc[nH]c2C1)c1ccns1 ZINC000926451162 646641464 /nfs/dbraw/zinc/64/14/64/646641464.db2.gz WPBOFRKQLDPJQW-RKDXNWHRSA-N 2 0 248.355 2.074 20 0 BEADRP CCSCC[C@@H](C)[NH2+]CC1CC[NH+](C)CC1 ZINC000133799660 711641142 /nfs/dbraw/zinc/64/11/42/711641142.db2.gz JCNRRORLSJEFCI-GFCCVEGCSA-N 2 0 244.448 2.450 20 0 BEADRP CSC(C)(C)C[NH2+][C@H]1CCCC[C@@H]1C[NH3+] ZINC000229083508 711837582 /nfs/dbraw/zinc/83/75/82/711837582.db2.gz DKWQBQAFSMAKRA-MNOVXSKESA-N 2 0 230.421 2.235 20 0 BEADRP C[NH+]1CCC(C[NH+]2CCC(C)(C)CC2)CC1 ZINC000060313615 711930725 /nfs/dbraw/zinc/93/07/25/711930725.db2.gz FGBSDEIVANJREE-UHFFFAOYSA-N 2 0 224.392 2.450 20 0 BEADRP C[C@@H]1C[N@H+](C[C@@H]2CCC[C@@H](C)C2)C[C@H]1C[NH3+] ZINC000708208569 712184095 /nfs/dbraw/zinc/18/40/95/712184095.db2.gz YKJLQUOWKUPZSJ-AAVRWANBSA-N 2 0 224.392 2.339 20 0 BEADRP CC1(C)CO[C@H](C[N@@H+]2CCCC[C@@H]2CC[NH3+])C1 ZINC000708325997 712186979 /nfs/dbraw/zinc/18/69/79/712186979.db2.gz ZBTPOEPRXBBSNA-OLZOCXBDSA-N 2 0 240.391 2.005 20 0 BEADRP CC(C)[C@@H]1C[N@H+](CCCCCCC[NH3+])CCO1 ZINC000709019471 712206133 /nfs/dbraw/zinc/20/61/33/712206133.db2.gz MQJCIZOTSARXET-AWEZNQCLSA-N 2 0 242.407 2.252 20 0 BEADRP C[C@H]1CC[N@H+](Cc2cc3c(s2)CC[NH2+]C3)C1 ZINC000710943159 712266658 /nfs/dbraw/zinc/26/66/58/712266658.db2.gz JSXFDLAYQPLYQT-JTQLQIEISA-N 2 0 236.384 2.236 20 0 BEADRP C[C@@H]1CC[N@H+](Cc2cc3c(s2)CC[NH2+]C3)C1 ZINC000710943160 712266663 /nfs/dbraw/zinc/26/66/63/712266663.db2.gz JSXFDLAYQPLYQT-SNVBAGLBSA-N 2 0 236.384 2.236 20 0 BEADRP C[C@@H]1C[C@@H](C[N@@H+]2CCC[C@@H](CF)C2)CC[NH2+]1 ZINC000711463301 712304479 /nfs/dbraw/zinc/30/44/79/712304479.db2.gz VTLNKBUPHFJMJA-AGIUHOORSA-N 2 0 228.355 2.056 20 0 BEADRP [NH3+]CC[C@H]1CC[N@H+](CCCc2ccsc2)C1 ZINC000923479845 712334391 /nfs/dbraw/zinc/33/43/91/712334391.db2.gz DGNWBVRJDZWJCM-LBPRGKRZSA-N 2 0 238.400 2.351 20 0 BEADRP Cc1csc(C[NH2+]CC2CC[NH+](C)CC2)c1 ZINC000379145973 712370122 /nfs/dbraw/zinc/37/01/22/712370122.db2.gz UKMIKTVMBPUDAO-UHFFFAOYSA-N 2 0 238.400 2.488 20 0 BEADRP C[C@@H]1CC[C@H]1[NH2+]CCCCn1ccnc1 ZINC000379780213 712398996 /nfs/dbraw/zinc/39/89/96/712398996.db2.gz BZXSKLAPOGMFBU-VXGBXAGGSA-N 2 0 207.321 2.051 20 0 BEADRP C=C/C=C\CC[N@H+]1C[C@@H]2CCC[C@]2(C[NH3+])C1 ZINC000713738588 712470582 /nfs/dbraw/zinc/47/05/82/712470582.db2.gz FUUFJUFUTBMFJF-NMEQGOOXSA-N 2 0 220.360 2.180 20 0 BEADRP C=C/C=C\CC[N@H+]1CC[C@H](C)[C@H](C[NH3+])C1 ZINC000713735222 712470379 /nfs/dbraw/zinc/47/03/79/712470379.db2.gz NIMNBNQVYKRJBF-OEFFGFFESA-N 2 0 208.349 2.035 20 0 BEADRP CC1(C)CCC[C@H](C[N@@H+]2CC[C@H](CC[NH3+])C2)O1 ZINC000714339380 712482724 /nfs/dbraw/zinc/48/27/24/712482724.db2.gz SHVLJHFDPXOIEG-QWHCGFSZSA-N 2 0 240.391 2.005 20 0 BEADRP CC(C)C1CC([NH2+][C@H](C)C2CC[NH2+]CC2)C1 ZINC000714621377 712488701 /nfs/dbraw/zinc/48/87/01/712488701.db2.gz YVFIQICDOCFPJA-LMWSTFAQSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CC[C@H]1CCCS1 ZINC000715753153 712532020 /nfs/dbraw/zinc/53/20/20/712532020.db2.gz JFBHJYHJZSGRDA-VXGBXAGGSA-N 2 0 230.421 2.379 20 0 BEADRP C[C@@H]([NH2+]CC1CC[NH+](C)CC1)c1ccns1 ZINC000716046269 712548119 /nfs/dbraw/zinc/54/81/19/712548119.db2.gz GFUDTTFAIBHBFF-SNVBAGLBSA-N 2 0 239.388 2.136 20 0 BEADRP C[N@H+](CCCF)CCC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000716767141 712572788 /nfs/dbraw/zinc/57/27/88/712572788.db2.gz WELWGEGCNCJSLF-YHWZYXNKSA-N 2 0 228.355 2.199 20 0 BEADRP CCC(CC)C[NH2+]C[C@H]1C[NH2+]CCC1(F)F ZINC000717311519 712646186 /nfs/dbraw/zinc/64/61/86/712646186.db2.gz YPCKHUSOOYLQDC-LLVKDONJSA-N 2 0 234.334 2.257 20 0 BEADRP CC(F)(F)CCC[N@@H+]1CCC[C@H](C[NH3+])C1 ZINC000718570712 712774691 /nfs/dbraw/zinc/77/46/91/712774691.db2.gz KKNRIBJQRJOSPO-SNVBAGLBSA-N 2 0 220.307 2.093 20 0 BEADRP C[C@H]1CC[N@H+](CCCC(C)(F)F)C[C@H]1C[NH3+] ZINC000718570268 712775249 /nfs/dbraw/zinc/77/52/49/712775249.db2.gz JJFKHMLOJIXFSL-WDEREUQCSA-N 2 0 234.334 2.339 20 0 BEADRP CC(F)(F)CCC[N@@H+]1C[C@@H]2CCC[C@H]([NH3+])[C@@H]2C1 ZINC000718583536 712775769 /nfs/dbraw/zinc/77/57/69/712775769.db2.gz KRSJONZQHOAUDX-TUAOUCFPSA-N 2 0 246.345 2.481 20 0 BEADRP CO[C@@H]1CCC[C@@H]([NH2+]C2CC([NH+](C)C)C2)CC1 ZINC000718823692 712783842 /nfs/dbraw/zinc/78/38/42/712783842.db2.gz IPKOKMSZBGTIHK-BLYZHGLHSA-N 2 0 240.391 2.016 20 0 BEADRP CO[C@@H]1CCC[C@@H]([NH2+]C[C@H](C)C[NH+](C)C)CC1 ZINC000718845829 712786063 /nfs/dbraw/zinc/78/60/63/712786063.db2.gz XJVJNUBIDHMDND-BFHYXJOUSA-N 2 0 242.407 2.121 20 0 BEADRP CCC[C@@H](C)[NH2+]Cc1ncc(CN(C)C)s1 ZINC000381407084 710633031 /nfs/dbraw/zinc/63/30/31/710633031.db2.gz SQPTUFAMKKMSKG-SNVBAGLBSA-N 2 0 241.404 2.483 20 0 BEADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H]2CC[C@H]2C)C1 ZINC000381531626 710651477 /nfs/dbraw/zinc/65/14/77/710651477.db2.gz ZIPXNWAKXMKKGR-RDBSUJKOSA-N 2 0 224.392 2.495 20 0 BEADRP CC[C@@H]1[C@H](C)CC[N@@H+]1C[C@H]([NH3+])CC(F)F ZINC000384159243 710672232 /nfs/dbraw/zinc/67/22/32/710672232.db2.gz MZQJUPGTUNZOCV-OPRDCNLKSA-N 2 0 220.307 2.089 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1C[NH2+]C[C@H]1C)c1cscn1 ZINC000722529116 710715598 /nfs/dbraw/zinc/71/55/98/710715598.db2.gz LDQUVBRFNYCGSP-OUAUKWLOSA-N 2 0 239.388 2.039 20 0 BEADRP CCCC[C@@H](C)[NH2+]CC[C@@H]1C[NH2+]C[C@H]1C ZINC000722555214 710715943 /nfs/dbraw/zinc/71/59/43/710715943.db2.gz WFZLZIGAZXHLKB-JHJVBQTASA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1C[NH2+]C[C@H]1C)c1cscn1 ZINC000722529115 710716081 /nfs/dbraw/zinc/71/60/81/710716081.db2.gz LDQUVBRFNYCGSP-GMTAPVOTSA-N 2 0 239.388 2.039 20 0 BEADRP C[C@@H]1SCC[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000381825925 710725118 /nfs/dbraw/zinc/72/51/18/710725118.db2.gz MHNOWAFARQPAGV-OFIBSPLFSA-N 2 0 240.416 2.095 20 0 BEADRP CC(C)(C)[C@H]1CC[N@H+](C[C@H]([NH3+])CC(F)F)C1 ZINC000380612378 712901982 /nfs/dbraw/zinc/90/19/82/712901982.db2.gz YMTHLMKMMAUMHQ-VHSXEESVSA-N 2 0 234.334 2.337 20 0 BEADRP [NH3+]C1CC([NH2+]Cc2cccc(C(F)(F)F)c2)C1 ZINC000133134393 710967631 /nfs/dbraw/zinc/96/76/31/710967631.db2.gz VYVYWBOLJBATPR-UHFFFAOYSA-N 2 0 244.260 2.285 20 0 BEADRP CSC(C)(C)CC[NH2+][C@H](C)CC[NH+](C)C ZINC000385258499 711009096 /nfs/dbraw/zinc/00/90/96/711009096.db2.gz UOLLJFANTJRGGY-LLVKDONJSA-N 2 0 232.437 2.448 20 0 BEADRP C[C@H]([N@H+](C)C[C@]1(C)CCC[NH2+]C1)C1(C)CC1 ZINC000385467756 711013644 /nfs/dbraw/zinc/01/36/44/711013644.db2.gz ORWSYBSOILDMJJ-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH+]1CCC(C[NH2+]C[C@@H]2CCC(F)(F)C2)CC1 ZINC000390711345 711132765 /nfs/dbraw/zinc/13/27/65/711132765.db2.gz XLBYDIPDHUAFPV-GFCCVEGCSA-N 2 0 246.345 2.353 20 0 BEADRP CCCCCC[NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32 ZINC000392806653 711151941 /nfs/dbraw/zinc/15/19/41/711151941.db2.gz CRTTYHFXABKPRY-QSLWVIQJSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@@H]2[C@H]3C[C@H]4C[NH2+][C@H]2[C@H]4C3)C1 ZINC000392816594 711152558 /nfs/dbraw/zinc/15/25/58/711152558.db2.gz ANNOJOUXQBLVBW-QLMDPUNJSA-N 2 0 234.387 2.151 20 0 BEADRP CC1(C)CCC[C@@H]1[NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32 ZINC000392859072 711153241 /nfs/dbraw/zinc/15/32/41/711153241.db2.gz DGEDSFVGFFMQPT-SNIKSBKOSA-N 2 0 234.387 2.151 20 0 BEADRP CC(C)(C)CC[NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2 ZINC000392832584 711153467 /nfs/dbraw/zinc/15/34/67/711153467.db2.gz IILKKDWLCJDWNA-NWBUJAPZSA-N 2 0 222.376 2.009 20 0 BEADRP [NH3+]CC[C@H]1CCCC[N@@H+]1CCCC1CC1 ZINC000394502772 711193502 /nfs/dbraw/zinc/19/35/02/711193502.db2.gz RPYVCTHWZWBEFJ-CYBMUJFWSA-N 2 0 210.365 2.380 20 0 BEADRP CC[C@H]1C[N@H+](CCCC2CC2)CC[C@H]1[NH3+] ZINC000394569089 711195622 /nfs/dbraw/zinc/19/56/22/711195622.db2.gz PDFMDFMPYRTMJC-QWHCGFSZSA-N 2 0 210.365 2.236 20 0 BEADRP CC[C@H]1C[N@H+](CCCC2CC2)CC[C@@H]1[NH3+] ZINC000394569092 711195876 /nfs/dbraw/zinc/19/58/76/711195876.db2.gz PDFMDFMPYRTMJC-STQMWFEESA-N 2 0 210.365 2.236 20 0 BEADRP CC(C)[C@H]([NH3+])CC[N@H+](C)CCCC1CC1 ZINC000394631785 711196488 /nfs/dbraw/zinc/19/64/88/711196488.db2.gz VILRMDADNFIDQF-CYBMUJFWSA-N 2 0 212.381 2.482 20 0 BEADRP CSC(C)(C)C[NH2+][C@H](C)[C@@H]1CCCC[NH2+]1 ZINC000395092417 711201373 /nfs/dbraw/zinc/20/13/73/711201373.db2.gz VLUCRZWPHOXDFN-MNOVXSKESA-N 2 0 230.421 2.248 20 0 BEADRP C[N@H+](C[C@H]([NH3+])CC(F)F)C1CC(C)(C)C1 ZINC000395467795 711211797 /nfs/dbraw/zinc/21/17/97/711211797.db2.gz SOWSDUWJGOUUGH-MRVPVSSYSA-N 2 0 220.307 2.089 20 0 BEADRP CC[C@]1(C)CC[N@H+](C[C@@H]2CC[C@H]([NH3+])C2)C1 ZINC000399383996 711429197 /nfs/dbraw/zinc/42/91/97/711429197.db2.gz PZPCTBPFMUTAJJ-FRRDWIJNSA-N 2 0 210.365 2.236 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1CC[C@@H]([NH3+])[C@@H](CC)C1 ZINC000723119091 710725752 /nfs/dbraw/zinc/72/57/52/710725752.db2.gz WPJIOWAVRJUGPP-MROQNXINSA-N 2 0 210.365 2.092 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H]2CC3CCC2CC3)C1 ZINC000394214667 711188692 /nfs/dbraw/zinc/18/86/92/711188692.db2.gz CZJMYWCOHGBGQE-JYVUQVBGSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H](C[NH2+][C@@H]1CC2CCC1CC2)N(C)C ZINC000394337149 711190299 /nfs/dbraw/zinc/19/02/99/711190299.db2.gz YTAOENOOEOJPNI-YWPUVAFDSA-N 2 0 210.365 2.105 20 0 BEADRP Cc1cccc(OCCN[C@H]2CCC[NH2+][C@H]2C)c1 ZINC000396693475 711365361 /nfs/dbraw/zinc/36/53/61/711365361.db2.gz LUNHBWMRLBKOIG-ZFWWWQNUSA-N 2 0 248.370 2.104 20 0 BEADRP C(C[C@@H]1C[C@H]1C1CC1)[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000712763801 711450044 /nfs/dbraw/zinc/45/00/44/711450044.db2.gz LBNAIDGTHYCZSR-JKJDWNRSSA-N 2 0 248.414 2.400 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1CCC[C@H]([C@H]2CCC[NH2+]2)C1 ZINC000723132746 711506520 /nfs/dbraw/zinc/50/65/20/711506520.db2.gz CMXYLIOAFQATHT-CBBWQLFWSA-N 2 0 236.403 2.497 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1CCC[C@H]([C@@H]2CCC[NH2+]2)C1 ZINC000723132750 711506609 /nfs/dbraw/zinc/50/66/09/711506609.db2.gz CMXYLIOAFQATHT-QPSCCSFWSA-N 2 0 236.403 2.497 20 0 BEADRP COc1ccc(C[N@@H+]2CC[C@H](CC[NH3+])C2)cc1C ZINC000723690544 711533867 /nfs/dbraw/zinc/53/38/67/711533867.db2.gz RLQWWWPDZTWOFH-ZDUSSCGKSA-N 2 0 248.370 2.174 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[N@@H+]1CC[C@@H](CC[NH3+])C1 ZINC000723678358 711534056 /nfs/dbraw/zinc/53/40/56/711534056.db2.gz JZZPOORMCCEWGF-MGPQQGTHSA-N 2 0 224.392 2.483 20 0 BEADRP [NH3+]CC[C@@H]1CC[N@H+](C/C=C/c2ccccc2)C1 ZINC000723713938 711535910 /nfs/dbraw/zinc/53/59/10/711535910.db2.gz XSYUVDCQQFZHEX-NFBGWVBBSA-N 2 0 230.355 2.371 20 0 BEADRP C[C@@H]1C[N@H+](CCCC2CC2)C[C@H]1CC[NH3+] ZINC000723895600 711543988 /nfs/dbraw/zinc/54/39/88/711543988.db2.gz XSCMFUUSGYWNRD-DGCLKSJQSA-N 2 0 210.365 2.093 20 0 BEADRP Cc1ccc(C[N@H+]2C[C@@H](C)[C@H](CC[NH3+])C2)cc1 ZINC000723910542 711545079 /nfs/dbraw/zinc/54/50/79/711545079.db2.gz VIZTZJUEJGGADX-UKRRQHHQSA-N 2 0 232.371 2.412 20 0 BEADRP CCCC1(C[NH2+][C@@H]2[C@H]3C[C@H]4C[NH2+][C@H]2[C@H]4C3)CC1 ZINC000383303511 711550715 /nfs/dbraw/zinc/55/07/15/711550715.db2.gz MIHZRTRDDSDZET-YHQUGGNUSA-N 2 0 234.387 2.153 20 0 BEADRP CC[C@H]([NH2+][C@@H](C)CCCC[NH3+])[C@@H]1CCCOC1 ZINC000724008812 711555269 /nfs/dbraw/zinc/55/52/69/711555269.db2.gz MKPRTJDYRLBESJ-MJBXVCDLSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCC2CC=CC2)CC[N@@H+]1C ZINC000724184475 711566948 /nfs/dbraw/zinc/56/69/48/711566948.db2.gz IXZAAVISTJCOKR-TZMCWYRMSA-N 2 0 222.376 2.415 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23 ZINC000383374305 711646053 /nfs/dbraw/zinc/64/60/53/711646053.db2.gz ZNXOWAFXCQOQNO-MRKIUDBFSA-N 2 0 234.387 2.151 20 0 BEADRP CSC1(C[NH2+]C2CCC([NH3+])CC2)CCC1 ZINC000235219414 711648723 /nfs/dbraw/zinc/64/87/23/711648723.db2.gz DYSNWUFDKAGFFQ-UHFFFAOYSA-N 2 0 228.405 2.132 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21)[C@H]1CCCO1 ZINC000252757543 711651325 /nfs/dbraw/zinc/65/13/25/711651325.db2.gz CBNLGONBJZJDIS-CJYSPXJISA-N 2 0 246.354 2.288 20 0 BEADRP [NH3+]CCCOC1CC[NH+](CCCC2CC2)CC1 ZINC000394537826 711688599 /nfs/dbraw/zinc/68/85/99/711688599.db2.gz VMHMYDMPZZMONX-UHFFFAOYSA-N 2 0 240.391 2.006 20 0 BEADRP CSC(C)(C)C[NH2+][C@@H](C)[C@@H]1CCCC[NH2+]1 ZINC000395092424 711692405 /nfs/dbraw/zinc/69/24/05/711692405.db2.gz VLUCRZWPHOXDFN-QWRGUYRKSA-N 2 0 230.421 2.248 20 0 BEADRP CC1(C)C[C@@H]([NH3+])C[C@@H]([NH2+]CC2CC=CC2)C1 ZINC000925722743 711726247 /nfs/dbraw/zinc/72/62/47/711726247.db2.gz KRDGDYDNMBQKHD-QWHCGFSZSA-N 2 0 222.376 2.448 20 0 BEADRP C1CC12CCC[C@@H]2[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000925723947 711727082 /nfs/dbraw/zinc/72/70/82/711727082.db2.gz FQVDVSMJRHRJCV-RYUDHWBXSA-N 2 0 220.360 2.193 20 0 BEADRP CC[C@]1(C)CC[N@H+](C[C@]2(C)CCC[NH2+]C2)C1 ZINC000399452881 711747434 /nfs/dbraw/zinc/74/74/34/711747434.db2.gz IVVJIJRYMFYLDA-ZIAGYGMSSA-N 2 0 224.392 2.498 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]C[C@@H]2C[C@H]2C(F)(F)F)C1 ZINC000925833524 711759975 /nfs/dbraw/zinc/75/99/75/711759975.db2.gz SSMDIYSITHEIIO-AXTSPUMRSA-N 2 0 236.281 2.044 20 0 BEADRP [NH3+][C@H]1CCCCC[C@H]1[NH2+]C[C@]12C[C@H]1CCC2 ZINC000925880318 711761858 /nfs/dbraw/zinc/76/18/58/711761858.db2.gz JEIZWHNQPZDPRS-RQJABVFESA-N 2 0 222.376 2.426 20 0 BEADRP CCO[C@@H]1CCC[C@H]([NH2+]C2CC([NH+](C)C)C2)C1 ZINC000721273135 711881569 /nfs/dbraw/zinc/88/15/69/711881569.db2.gz NMEIRHGGVXZHEB-GFJIZPEISA-N 2 0 240.391 2.016 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000530216027 711937986 /nfs/dbraw/zinc/93/79/86/711937986.db2.gz LYDPGWVAMMGFGG-XQQFMLRXSA-N 2 0 222.376 2.295 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000530216028 711938013 /nfs/dbraw/zinc/93/80/13/711938013.db2.gz LYDPGWVAMMGFGG-YNEHKIRRSA-N 2 0 222.376 2.295 20 0 BEADRP CC[N@H+](CCC(F)(F)F)C[C@@H]1CC[C@H]([NH3+])C1 ZINC000708324952 711956053 /nfs/dbraw/zinc/95/60/53/711956053.db2.gz DZCRENGMZAMOOH-ZJUUUORDSA-N 2 0 238.297 2.388 20 0 BEADRP CCC[C@H](C)[N@H+](C)C[C@@H]1CCCC[NH2+]C1 ZINC000700256314 711989383 /nfs/dbraw/zinc/98/93/83/711989383.db2.gz GADDYEBBHZIUJL-QWHCGFSZSA-N 2 0 212.381 2.497 20 0 BEADRP CCSC1(C[NH2+][C@H]2CCCN[C@@H]2C)CC1 ZINC000700796463 712006031 /nfs/dbraw/zinc/00/60/31/712006031.db2.gz WVDBGVFJOXGJQX-MNOVXSKESA-N 2 0 228.405 2.002 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+]CCCC2CCC2)C12CCC2 ZINC000701771987 712028753 /nfs/dbraw/zinc/02/87/53/712028753.db2.gz LSUNUKKPDAVTEG-QWHCGFSZSA-N 2 0 222.376 2.426 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[N@@H+]2CCC[C@@H](CCF)C2)C1 ZINC000701895187 712031851 /nfs/dbraw/zinc/03/18/51/712031851.db2.gz CHDLQOCNUXNZNK-RWMBFGLXSA-N 2 0 228.355 2.185 20 0 BEADRP CC1(C)CC(C[NH2+][C@H]2C[C@@H]([NH3+])C23CCC3)C1 ZINC000702008077 712036483 /nfs/dbraw/zinc/03/64/83/712036483.db2.gz UFCLKWPIZRBXSI-NEPJUHHUSA-N 2 0 222.376 2.282 20 0 BEADRP CC(C)(CC[N@@H+]1C[C@@H]2C[NH2+]C[C@]2(C)C1)C1CC1 ZINC000702105038 712038506 /nfs/dbraw/zinc/03/85/06/712038506.db2.gz VKMPHHRMVAAOSW-DZGCQCFKSA-N 2 0 236.403 2.354 20 0 BEADRP CCC[C@H]1CCCC[N@@H+]1C[C@H]1C[C@@H]([NH3+])C1 ZINC000703447522 712075809 /nfs/dbraw/zinc/07/58/09/712075809.db2.gz LVZWXAISRKHMIO-XQQFMLRXSA-N 2 0 210.365 2.378 20 0 BEADRP Cc1ccccc1C[N@@H+]1C[C@@H]2C[NH2+]C[C@]2(C)C1 ZINC000703549684 712078798 /nfs/dbraw/zinc/07/87/98/712078798.db2.gz KOQOKZDVZLESIC-LSDHHAIUSA-N 2 0 230.355 2.036 20 0 BEADRP Cc1ccc(C[N@@H+]2C[C@@H]3C[NH2+]C[C@]3(C)C2)cc1 ZINC000703550958 712078864 /nfs/dbraw/zinc/07/88/64/712078864.db2.gz ZTNWXMYLMOLITP-LSDHHAIUSA-N 2 0 230.355 2.036 20 0 BEADRP C[C@H]1CCCC[N@H+](CCC[NH2+]C2CC2)C1 ZINC000703659607 712082714 /nfs/dbraw/zinc/08/27/14/712082714.db2.gz BAQDEUCIOQZFBR-LBPRGKRZSA-N 2 0 210.365 2.251 20 0 BEADRP CC[N@H+](CC1CC1)CC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000703798093 712087299 /nfs/dbraw/zinc/08/72/99/712087299.db2.gz XJVWVGBXGKUBPJ-AGUYFDCRSA-N 2 0 222.376 2.249 20 0 BEADRP CC[C@@H](C)C[N@H+](C)CC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000703893634 712092800 /nfs/dbraw/zinc/09/28/00/712092800.db2.gz GAHYCIRASKJNGH-RLAWYHOSSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+]C[C@@H]1CC[C@H]([NH3+])C1 ZINC000704831627 712115786 /nfs/dbraw/zinc/11/57/86/712115786.db2.gz ADIJDTGBZBVZIX-NDBYEHHHSA-N 2 0 210.365 2.282 20 0 BEADRP CSC1CC([NH2+]C2CC[NH+](C(C)C)CC2)C1 ZINC000706927408 712161431 /nfs/dbraw/zinc/16/14/31/712161431.db2.gz JZPLPZUPGYFDAI-UHFFFAOYSA-N 2 0 242.432 2.343 20 0 BEADRP CCC[NH+]1CCC([NH2+]C2CC(SC)C2)CC1 ZINC000706928583 712161470 /nfs/dbraw/zinc/16/14/70/712161470.db2.gz OFLYLVFNNQZRON-UHFFFAOYSA-N 2 0 242.432 2.344 20 0 BEADRP CSC1CC([NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)C1 ZINC000706927319 712161474 /nfs/dbraw/zinc/16/14/74/712161474.db2.gz GSQRQQHTWZHUQP-GMKTYKIGSA-N 2 0 240.416 2.097 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+][C@@H]2CCCC23CC3)C12CCC2 ZINC000706949930 712163121 /nfs/dbraw/zinc/16/31/21/712163121.db2.gz WHYIBVYKKDREPV-IJLUTSLNSA-N 2 0 220.360 2.179 20 0 BEADRP CCC[C@@H]1CCC[N@H+](C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000708522019 712212254 /nfs/dbraw/zinc/21/22/54/712212254.db2.gz ZPBZHTJQYKPWOB-UPJWGTAASA-N 2 0 210.365 2.236 20 0 BEADRP CC1(C)C[C@]1(C)C[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000709287396 712219304 /nfs/dbraw/zinc/21/93/04/712219304.db2.gz LBEULNSQFSAVLS-IIKSMHAQSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@@H]1[C@H]2CC[C@@H](C[C@H]1[NH2+][C@@H]1CCCC13CC3)[NH2+]2 ZINC000709371533 712220547 /nfs/dbraw/zinc/22/05/47/712220547.db2.gz MAJCOLGVYIUSRG-XVIXHAIJSA-N 2 0 234.387 2.438 20 0 BEADRP C[C@H](CC1CCC1)[NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2 ZINC000710264556 712250495 /nfs/dbraw/zinc/25/04/95/712250495.db2.gz XBVIBKPAJICNIK-BBAYZTIDSA-N 2 0 234.387 2.151 20 0 BEADRP C[C@H](CC[NH2+][C@@H]1C[C@@H]2CC[C@@H](C2)C1)[NH+](C)C ZINC000710931261 712266135 /nfs/dbraw/zinc/26/61/35/712266135.db2.gz QINSFXWXPNBOSZ-YIYPIFLZSA-N 2 0 224.392 2.495 20 0 BEADRP [NH3+]CCCCCC[N@H+]1C[C@@H]2CC=CC[C@@H]2C1 ZINC000382871277 712282281 /nfs/dbraw/zinc/28/22/81/712282281.db2.gz PGLCEYSHPMQRHO-OKILXGFUSA-N 2 0 222.376 2.404 20 0 BEADRP FC[C@@H]1CCC[N@H+](CC[C@@H]2CCC[NH2+]C2)C1 ZINC000711444814 712300592 /nfs/dbraw/zinc/30/05/92/712300592.db2.gz RBAGMAGMPGNHIT-STQMWFEESA-N 2 0 228.355 2.058 20 0 BEADRP [NH3+]CCCCCC[N@@H+]1CCC[C@@H](CF)C1 ZINC000711484472 712306323 /nfs/dbraw/zinc/30/63/23/712306323.db2.gz MIAAYJUXWWWXRJ-LBPRGKRZSA-N 2 0 216.344 2.187 20 0 BEADRP FC[C@@H]1CC[N@H+](CCC2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000711507113 712307951 /nfs/dbraw/zinc/30/79/51/712307951.db2.gz IHLARTCAIRHOIB-PBNFFQIGSA-N 2 0 240.366 2.199 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@H]1CC2CCC1CC2 ZINC000379461132 712385157 /nfs/dbraw/zinc/38/51/57/712385157.db2.gz SORXZSLLHVFANU-RUXDESIVSA-N 2 0 224.392 2.497 20 0 BEADRP C1[C@@H]([NH2+][C@H]2[C@@H]3[NH2+]C[C@@H]4C[C@H]2C[C@@H]43)[C@H]2CCCC[C@@H]12 ZINC000712399783 712429114 /nfs/dbraw/zinc/42/91/14/712429114.db2.gz AGPRSBPHFCOHQT-UDRKCNRUSA-N 2 0 246.398 2.151 20 0 BEADRP C1[C@@H]([NH2+][C@H]2[C@@H]3[NH2+]C[C@H]4C[C@H]2C[C@H]34)[C@H]2CCCC[C@@H]12 ZINC000712399784 712429218 /nfs/dbraw/zinc/42/92/18/712429218.db2.gz AGPRSBPHFCOHQT-WOVBXOTESA-N 2 0 246.398 2.151 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@@H]2CCCC[C@H]12)[C@@H]1CCC[NH2+]1 ZINC000712473440 712430606 /nfs/dbraw/zinc/43/06/06/712430606.db2.gz WXPNEDPGBUCRQD-HTVCTNPSSA-N 2 0 222.376 2.295 20 0 BEADRP C(C1CCCC1)[N@@H+]1CC[NH2+]CCC12CCC2 ZINC000713172757 712453146 /nfs/dbraw/zinc/45/31/46/712453146.db2.gz BKLLQRGJANCREI-UHFFFAOYSA-N 2 0 222.376 2.395 20 0 BEADRP C(C1CCC1)[N@@H+]1CC[NH2+]CCC12CCC2 ZINC000713158508 712453384 /nfs/dbraw/zinc/45/33/84/712453384.db2.gz NDARWRDINCTJMA-UHFFFAOYSA-N 2 0 208.349 2.005 20 0 BEADRP CC1(C)CC[C@H](C[NH+]2CCC(C)([NH3+])CC2)OC1 ZINC000713595933 712465933 /nfs/dbraw/zinc/46/59/33/712465933.db2.gz JOTKTRHTRBKNSE-GFCCVEGCSA-N 2 0 240.391 2.005 20 0 BEADRP C=C/C=C/CC[N@@H+]1C[C@@]2(C)C[NH2+]C[C@@]2(C)C1 ZINC000713640267 712467764 /nfs/dbraw/zinc/46/77/64/712467764.db2.gz FJVKZSNFYFOAIF-DLPZHFSESA-N 2 0 220.360 2.050 20 0 BEADRP C=C/C=C/CC[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000713695074 712469312 /nfs/dbraw/zinc/46/93/12/712469312.db2.gz MKBCMSACPBRSGO-GFUIURDCSA-N 2 0 222.376 2.439 20 0 BEADRP C=C/C=C\CC[N@@H+]1CC[NH2+]CCC12CCC2 ZINC000713756964 712471923 /nfs/dbraw/zinc/47/19/23/712471923.db2.gz XNUUPSRQYYQRKD-ARJAWSKDSA-N 2 0 220.360 2.337 20 0 BEADRP CC(C)OCC[NH+]1CCC(C(C)(C)C[NH3+])CC1 ZINC000714443897 712489347 /nfs/dbraw/zinc/48/93/47/712489347.db2.gz CIVMMTHXRDVCNV-UHFFFAOYSA-N 2 0 242.407 2.108 20 0 BEADRP CC[C@@H]1C[N@H+](CCCCCCC[NH3+])CCO1 ZINC000036770110 712494851 /nfs/dbraw/zinc/49/48/51/712494851.db2.gz NANGEKXMUDYCNI-CYBMUJFWSA-N 2 0 228.380 2.006 20 0 BEADRP CO[C@H]1C[C@H](C[NH2+][C@@H]2C[C@H]([NH3+])c3ccccc32)C1 ZINC000714708615 712496472 /nfs/dbraw/zinc/49/64/72/712496472.db2.gz WHUPMEWIDANCAV-LWWSYDQCSA-N 2 0 246.354 2.146 20 0 BEADRP CO[C@H](C)[C@@H](C)[NH2+]C1CCC(C)([NH+](C)C)CC1 ZINC000715511219 712524304 /nfs/dbraw/zinc/52/43/04/712524304.db2.gz UMFHELYOPGRIFD-IWMBGFJWSA-N 2 0 242.407 2.262 20 0 BEADRP CO[C@@H]1CCC[C@@H]1[NH2+][C@H]1CCC[C@H]([NH+](C)C)C1 ZINC000715541796 712526775 /nfs/dbraw/zinc/52/67/75/712526775.db2.gz IOXRAMOWKZHGJM-XDQVBPFNSA-N 2 0 240.391 2.016 20 0 BEADRP CO[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000715541798 712526875 /nfs/dbraw/zinc/52/68/75/712526875.db2.gz IOXRAMOWKZHGJM-YIYPIFLZSA-N 2 0 240.391 2.016 20 0 BEADRP CSC1CC([NH2+][C@@H]2CCC[C@@H]([NH+](C)C)C2)C1 ZINC000715545638 712527145 /nfs/dbraw/zinc/52/71/45/712527145.db2.gz ZSKPAEYAKUIIOJ-CQLXCSJHSA-N 2 0 242.432 2.343 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CCCS1)[C@H]1CCC[NH2+]1 ZINC000715656540 712529690 /nfs/dbraw/zinc/52/96/90/712529690.db2.gz HNSOZSVWJBYUHH-SDDRHHMPSA-N 2 0 228.405 2.002 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]CC1CC1 ZINC000037118294 712545684 /nfs/dbraw/zinc/54/56/84/712545684.db2.gz MCLANKSREJGEAP-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP Cc1ccc([C@@H](C)NC2CC[NH+](C)CC2)o1 ZINC000037249137 712558597 /nfs/dbraw/zinc/55/85/97/712558597.db2.gz NGWYFWQLQVRJOR-LLVKDONJSA-N 2 0 222.332 2.333 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]CCCCC2CC2)C1 ZINC000716412939 712559393 /nfs/dbraw/zinc/55/93/93/712559393.db2.gz LIFRQWXMRCNVIK-CHWSQXEVSA-N 2 0 210.365 2.426 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]CCCCC2CC2)C1 ZINC000716412943 712559422 /nfs/dbraw/zinc/55/94/22/712559422.db2.gz LIFRQWXMRCNVIK-QWHCGFSZSA-N 2 0 210.365 2.426 20 0 BEADRP C(C[C@@H]1CC[C@@H]2C[C@@H]21)[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000717027451 712609378 /nfs/dbraw/zinc/60/93/78/712609378.db2.gz NPNQBIDAHMDJEG-RCZWDNKTSA-N 2 0 248.414 2.400 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]CC[C@@H]1CC[C@H]2C[C@H]21 ZINC000717070358 712628017 /nfs/dbraw/zinc/62/80/17/712628017.db2.gz SFASGJXIUSGEIX-PEDHHIEDSA-N 2 0 222.376 2.140 20 0 BEADRP CC[NH+]1CCC([NH2+]CC[C@@H]2CC[C@H]3C[C@H]32)CC1 ZINC000717091802 712630338 /nfs/dbraw/zinc/63/03/38/712630338.db2.gz DAQLWIKJHHYWLX-YDHLFZDLSA-N 2 0 236.403 2.497 20 0 BEADRP CCCC[C@H](C)[NH2+]C[C@H]1C[NH2+]CCC1(F)F ZINC000717303989 712645707 /nfs/dbraw/zinc/64/57/07/712645707.db2.gz LJTRTXVYEMPTDA-WDEREUQCSA-N 2 0 234.334 2.400 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]C[C@@H]2CCC=CO2)c2ccccc21 ZINC000380030307 712683600 /nfs/dbraw/zinc/68/36/00/712683600.db2.gz YVCMSVADYWBNMR-NILFDRSVSA-N 2 0 244.338 2.414 20 0 BEADRP CC1(C)C[C@@H]([NH2+]CCc2ccccn2)C[C@@H]([NH3+])C1 ZINC000925494812 712696292 /nfs/dbraw/zinc/69/62/92/712696292.db2.gz MFWNLYJONDZXAS-OCCSQVGLSA-N 2 0 247.386 2.120 20 0 BEADRP C[C@H]1CC(F)(F)CC[N@@H+]1C[C@@H]1CC[C@H]([NH3+])C1 ZINC000717925896 712734025 /nfs/dbraw/zinc/73/40/25/712734025.db2.gz ZQGOJOJUKFQWLT-AXFHLTTASA-N 2 0 232.318 2.233 20 0 BEADRP C1=CCCC([NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)CC1 ZINC000718019529 712736563 /nfs/dbraw/zinc/73/65/63/712736563.db2.gz OGFIROAVMCLREQ-VNHYZAJKSA-N 2 0 234.387 2.463 20 0 BEADRP C[C@H]([NH2+]C1CCC=CCC1)[C@H]1CCC[NH2+]1 ZINC000718020719 712736665 /nfs/dbraw/zinc/73/66/65/712736665.db2.gz VVZIAKPUBUUPTQ-WCQYABFASA-N 2 0 208.349 2.215 20 0 BEADRP Cc1coc(C[NH2+]CC2(C)CC[NH+](C)CC2)c1 ZINC000718027167 712736752 /nfs/dbraw/zinc/73/67/52/712736752.db2.gz STLYYSKIMSHJCP-UHFFFAOYSA-N 2 0 236.359 2.410 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]C2CCC=CCC2)C1 ZINC000718065934 712741056 /nfs/dbraw/zinc/74/10/56/712741056.db2.gz DRGGMGUPPJMTGF-YPMHNXCESA-N 2 0 208.349 2.345 20 0 BEADRP C1=CCCC([NH2+][C@H]2[C@@H]3[NH2+]C[C@H]4C[C@H]2C[C@H]34)CC1 ZINC000718098091 712742986 /nfs/dbraw/zinc/74/29/86/712742986.db2.gz LSIOTDZKJQJJMA-WPTOEGHWSA-N 2 0 232.371 2.071 20 0 BEADRP C[C@@H]([NH2+]C[C@H](C)C[NH+]1CCCCC1)C1CC1 ZINC000038041776 712801125 /nfs/dbraw/zinc/80/11/25/712801125.db2.gz RPTNWAKTFJXHQR-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H]1CCCC[C@@H]1[NH2+]C1CC[NH2+]CC1 ZINC000038041116 712801131 /nfs/dbraw/zinc/80/11/31/712801131.db2.gz VANCXQXZPWKDJR-YPMHNXCESA-N 2 0 210.365 2.297 20 0 BEADRP CSCC1CC[NH+](C[C@H]2CCC[NH2+]C2)CC1 ZINC000719266158 712802160 /nfs/dbraw/zinc/80/21/60/712802160.db2.gz JOJRXNYENSCAEZ-ZDUSSCGKSA-N 2 0 242.432 2.061 20 0 BEADRP CC(C)([NH3+])CC[NH2+]Cc1ccnc2ccccc12 ZINC000719535112 712809460 /nfs/dbraw/zinc/80/94/60/712809460.db2.gz JRQRIFQFACIOEJ-UHFFFAOYSA-N 2 0 243.354 2.452 20 0 BEADRP C[N@H+](CCCCCC[NH3+])CCc1ccns1 ZINC000719873226 712824780 /nfs/dbraw/zinc/82/47/80/712824780.db2.gz PTYUZGVZFWJCDZ-UHFFFAOYSA-N 2 0 241.404 2.137 20 0 BEADRP CC(C)CC[N@H+]1C[C@H](C(F)(F)F)[C@@H](C[NH3+])C1 ZINC000720806739 712867333 /nfs/dbraw/zinc/86/73/33/712867333.db2.gz RAOPMJCQJXMOQS-UWVGGRQHSA-N 2 0 238.297 2.102 20 0 BEADRP C[C@@H]([NH2+]CC1(C)CC(F)(F)C1)[C@H]1CCC[NH2+]1 ZINC000720899250 712875275 /nfs/dbraw/zinc/87/52/75/712875275.db2.gz GKMNSUCWCFSUHQ-NXEZZACHSA-N 2 0 232.318 2.152 20 0 BEADRP CC1(C[NH2+][C@@H]2CCC[C@@H]2C[NH3+])CC(F)(F)C1 ZINC000720912883 712877747 /nfs/dbraw/zinc/87/77/47/712877747.db2.gz QYRPJRNIKFHNFM-NXEZZACHSA-N 2 0 232.318 2.139 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CC2(C)CC(F)(F)C2)CC[N@@H+]1C ZINC000720934285 712879922 /nfs/dbraw/zinc/87/99/22/712879922.db2.gz FUVCJNYCPMLIEE-MNOVXSKESA-N 2 0 246.345 2.494 20 0 BEADRP CC[C@H](C)[C@@H](C)[NH2+]CC[C@@H]1C[NH2+]C[C@H]1C ZINC000721120717 712892022 /nfs/dbraw/zinc/89/20/22/712892022.db2.gz JEOYRDSGIBWUIK-UMSGYPCISA-N 2 0 212.381 2.256 20 0 BEADRP C[C@H]1CCCC[N@H+](C[C@@H]2CCC[NH+](C)C2)C1 ZINC001208607295 957094705 /nfs/dbraw/zinc/09/47/05/957094705.db2.gz LHZBQFMSYMRETG-UONOGXRCSA-N 2 0 224.392 2.450 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[N@@H+]2CCC[C@H](C3CCC3)C2)C1 ZINC000692980159 957203967 /nfs/dbraw/zinc/20/39/67/957203967.db2.gz SMUOWSQKTGFRGB-FPMFFAJLSA-N 2 0 222.376 2.236 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]CCC2SCCS2)C1 ZINC000693778506 959278703 /nfs/dbraw/zinc/27/87/03/959278703.db2.gz YYJDOKOXQCWLEL-UWVGGRQHSA-N 2 0 246.445 2.042 20 0 BEADRP C[C@H]([NH2+][C@H]1C[C@@H]([NH3+])C12CCC2)C1CCCC1 ZINC000405356470 959441546 /nfs/dbraw/zinc/44/15/46/959441546.db2.gz RHXHTQRWDMFCEP-UHTWSYAYSA-N 2 0 222.376 2.425 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[NH2+]C2CCC3(CC3)CC2)C1 ZINC000695646244 960317855 /nfs/dbraw/zinc/31/78/55/960317855.db2.gz GFMCLYKRWVWDGG-NWDGAFQWSA-N 2 0 222.376 2.426 20 0 BEADRP C[C@H]1C[C@H]([N@@H+]2CCC3(CCC3)C2)CC[NH2+]1 ZINC000709451159 960610859 /nfs/dbraw/zinc/61/08/59/960610859.db2.gz WRKZAKOIWTZMSD-NWDGAFQWSA-N 2 0 208.349 2.003 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@H]2CC[C@H]([NH+](C)C)CC2)CCO1 ZINC001168091939 963687597 /nfs/dbraw/zinc/68/75/97/963687597.db2.gz CRQOQLCAKZPSIV-YIYPIFLZSA-N 2 0 240.391 2.016 20 0 BEADRP CCC[N@H+](CCOC)C1CCC([NH+](C)C)CC1 ZINC001168315763 964422838 /nfs/dbraw/zinc/42/28/38/964422838.db2.gz NYLQQHAAPYRFQL-UHFFFAOYSA-N 2 0 242.407 2.218 20 0 BEADRP C[C@H](CC[NH2+][C@@H]1CCCSCC1)[NH+](C)C ZINC000697846256 964565928 /nfs/dbraw/zinc/56/59/28/964565928.db2.gz BZIIGUOBLCEKMP-VXGBXAGGSA-N 2 0 230.421 2.202 20 0 BEADRP C[C@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)c1cscn1 ZINC000697892762 964652467 /nfs/dbraw/zinc/65/24/67/964652467.db2.gz QTYXYHZGBUOPDO-UWVGGRQHSA-N 2 0 239.388 2.182 20 0 BEADRP [NH3+][C@H]1CCC[N@H+](C[C@@H]2C[C@H]3C=C[C@@H]2C3)CC1 ZINC001205094178 965724488 /nfs/dbraw/zinc/72/44/88/965724488.db2.gz JZCNXXCZYYAIRK-CRWXNKLISA-N 2 0 220.360 2.012 20 0 BEADRP C([NH2+]C1CCCCCC1)[C@@H]1CCC[NH2+]C1 ZINC000040397406 965729010 /nfs/dbraw/zinc/72/90/10/965729010.db2.gz BSNGJERMQQZLOF-GFCCVEGCSA-N 2 0 210.365 2.298 20 0 BEADRP CCc1ccc(C[N@@H+]2CCC[C@@H]([NH3+])CC2)o1 ZINC001205094985 965734036 /nfs/dbraw/zinc/73/40/36/965734036.db2.gz SLBCMECTSLGESJ-LLVKDONJSA-N 2 0 222.332 2.155 20 0 BEADRP Cc1cc(C[N@@H+]2CCC[C@@H]([NH3+])CC2)cs1 ZINC001205124200 965886970 /nfs/dbraw/zinc/88/69/70/965886970.db2.gz LIACYQGJVIKDFB-GFCCVEGCSA-N 2 0 224.373 2.370 20 0 BEADRP [NH3+]CCCC[N@H+](Cc1ccccc1)C1CC1 ZINC000036128191 1165873952 /nfs/dbraw/zinc/87/39/52/1165873952.db2.gz IYEJDJUNCSOXSI-UHFFFAOYSA-N 2 0 218.344 2.390 20 0 BEADRP CCCCC[C@H](C)[NH2+]C[C@@H](C)C[NH2+]C ZINC000086070523 1165901203 /nfs/dbraw/zinc/90/12/03/1165901203.db2.gz DKKIACASKXZLFA-RYUDHWBXSA-N 2 0 200.370 2.400 20 0 BEADRP C[C@H]([NH2+]CC(C)(C)C(C)(F)F)[C@H]1CCC[NH2+]1 ZINC000696597703 967978065 /nfs/dbraw/zinc/97/80/65/967978065.db2.gz KAXPLWZGFZAGHE-VHSXEESVSA-N 2 0 234.334 2.398 20 0 BEADRP CC/C=C\CCC[N@@H+]1CC[C@@H](C)[C@H]([NH3+])C1 ZINC001206037993 967997717 /nfs/dbraw/zinc/99/77/17/967997717.db2.gz ZUPIKXIMGMFAQE-DIABFLQPSA-N 2 0 210.365 2.402 20 0 BEADRP C[C@]1(C[NH3+])CCC[N@H+](C[C@H]2CCCCO2)CC1 ZINC001206297259 968204577 /nfs/dbraw/zinc/20/45/77/968204577.db2.gz XAJUKPBXVFTJBG-KGLIPLIRSA-N 2 0 240.391 2.006 20 0 BEADRP CC(C)(C)C[N@@H+]1CCC[C@@](C)(C[NH3+])CC1 ZINC001206297272 968204975 /nfs/dbraw/zinc/20/49/75/968204975.db2.gz XEFGZQVEVRGSGM-CYBMUJFWSA-N 2 0 212.381 2.483 20 0 BEADRP C[NH2+]CC[C@H]1CCCC[N@@H+]1CC1CCC1 ZINC000083839997 1165934821 /nfs/dbraw/zinc/93/48/21/1165934821.db2.gz QVGJUZIJYZOTRL-CYBMUJFWSA-N 2 0 210.365 2.251 20 0 BEADRP CS[C@H](C)CC[N@@H+]1CCCC[C@](F)(CN)C1 ZINC001206334963 968237770 /nfs/dbraw/zinc/23/77/70/968237770.db2.gz BIVFUTXTSFMPHV-NEPJUHHUSA-N 2 0 248.411 2.281 20 0 BEADRP C[N@@H+]1CC[C@H](C[NH2+][C@H]2CCCC(C)(C)C2)C1 ZINC000070628980 1165940229 /nfs/dbraw/zinc/94/02/29/1165940229.db2.gz ROPAHKDLQPTULG-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)[N@H+](CCCCCO)[C@H]1CCC[NH2+]CC1 ZINC001206582908 968401271 /nfs/dbraw/zinc/40/12/71/968401271.db2.gz PUALVPGVHMKOIW-AWEZNQCLSA-N 2 0 242.407 2.002 20 0 BEADRP C[C@@H]1CC[C@@H]([N@H+](C)C2CCC([NH3+])CC2)C1 ZINC000085869184 968508205 /nfs/dbraw/zinc/50/82/05/968508205.db2.gz GLRZLXGJJPLQRQ-IKWCTNDRSA-N 2 0 210.365 2.377 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]C[C@H]1C[C@H]1C ZINC000389914037 1166053155 /nfs/dbraw/zinc/05/31/55/1166053155.db2.gz LTZJUFCOZNCNAV-FRRDWIJNSA-N 2 0 212.381 2.352 20 0 BEADRP [NH3+]CCCC[N@@H+]1CCc2cc(Cl)ccc2C1 ZINC000082790937 1166080176 /nfs/dbraw/zinc/08/01/76/1166080176.db2.gz UCERYENIPYPEHN-UHFFFAOYSA-N 2 0 238.762 2.437 20 0 BEADRP c1csc(CN2CC[C@H]3[NH2+]CCC[C@H]3C2)c1 ZINC000250080357 1166085508 /nfs/dbraw/zinc/08/55/08/1166085508.db2.gz ICZBDOCCOOFFDD-WCQYABFASA-N 2 0 236.384 2.322 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2CC[C@](C)(F)[C@@H](F)C2)CC1 ZINC001207395046 968751378 /nfs/dbraw/zinc/75/13/78/968751378.db2.gz OJXSXWNQMFYGCH-STQMWFEESA-N 2 0 246.345 2.100 20 0 BEADRP C1C[C@@H]2CCC[N@@H+]([C@@H]3CCC[NH2+]C3)[C@@H]2C1 ZINC000083701099 1166114652 /nfs/dbraw/zinc/11/46/52/1166114652.db2.gz DBLMOVNQZLUWJV-JHJVBQTASA-N 2 0 208.349 2.003 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2CCC[C@H]3CCC[C@@H]32)C[NH2+]1 ZINC000083701226 1166114868 /nfs/dbraw/zinc/11/48/68/1166114868.db2.gz VEUCWUGYRDUPKE-MQYQWHSLSA-N 2 0 222.376 2.391 20 0 BEADRP C[N@H+](CCC1CC[NH+](C)CC1)C1CC(F)(F)C1 ZINC001207479409 968792997 /nfs/dbraw/zinc/79/29/97/968792997.db2.gz IEXJELVFLDSVEC-UHFFFAOYSA-N 2 0 246.345 2.448 20 0 BEADRP C[N@@H+]1CCC[C@@]2(CCCN(c3cc[nH+]cc3)C2)C1 ZINC000224245886 1166218930 /nfs/dbraw/zinc/21/89/30/1166218930.db2.gz ISOSLUUSNASCCE-OAHLLOKOSA-N 2 0 245.370 2.394 20 0 BEADRP CS[C@H](C)CC[N@H+]1C[C@H]2[C@H](C1)CCCN2C ZINC001208151182 969075737 /nfs/dbraw/zinc/07/57/37/969075737.db2.gz SYVHKGRQADSZJL-AGIUHOORSA-N 2 0 242.432 2.154 20 0 BEADRP CSCC[C@H](C)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000228873536 1166223863 /nfs/dbraw/zinc/22/38/63/1166223863.db2.gz MUPGEYUWBCQWLZ-RYUDHWBXSA-N 2 0 230.421 2.059 20 0 BEADRP CS[C@H](C)CC[N@@H+]1C[C@H]2C[C@@]2(C[NH+](C)C)C1 ZINC001208156702 969083882 /nfs/dbraw/zinc/08/38/82/969083882.db2.gz YBFWXPVZJIXRLM-JHJVBQTASA-N 2 0 242.432 2.012 20 0 BEADRP CC1C[NH+](CC2(C[NH+](C)C)CCCC2)C1 ZINC001208183431 969116280 /nfs/dbraw/zinc/11/62/80/969116280.db2.gz CZDQPHBGPIIXSW-UHFFFAOYSA-N 2 0 210.365 2.060 20 0 BEADRP C[C@H]1CC[N@@H+]1CC1(C[NH+](C)C)CCCC1 ZINC001208185288 969117746 /nfs/dbraw/zinc/11/77/46/969117746.db2.gz ZPLXZWBEQJPZAI-LBPRGKRZSA-N 2 0 210.365 2.203 20 0 BEADRP CSCC[C@H](C)[NH2+]CCC[NH+]1CCCC1 ZINC000228916699 1166265406 /nfs/dbraw/zinc/26/54/06/1166265406.db2.gz HLXBFOXGUZOQHW-LBPRGKRZSA-N 2 0 230.421 2.204 20 0 BEADRP [NH3+]Cc1cccn1-c1cc[nH+]c(C2CC2)c1 ZINC001167595648 1166296997 /nfs/dbraw/zinc/29/69/97/1166296997.db2.gz JCCNJTUJBHUFIY-UHFFFAOYSA-N 2 0 213.284 2.208 20 0 BEADRP FC(F)(F)CCN1CC[C@H]2[NH2+]CCC[C@@H]2C1 ZINC000226918690 1166378715 /nfs/dbraw/zinc/37/87/15/1166378715.db2.gz IHEMAWVUQUULFZ-NXEZZACHSA-N 2 0 236.281 2.013 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]C1CCSCC1)C2 ZINC001169092212 969413633 /nfs/dbraw/zinc/41/36/33/969413633.db2.gz ZYBXHPOQEWPRAR-CLLJXQQHSA-N 2 0 240.416 2.097 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH2+][C@@H]2C[C@@H]3CC[C@H]2C3)CC1 ZINC001254511874 969684192 /nfs/dbraw/zinc/68/41/92/969684192.db2.gz GSRQPTMSBXOFLW-XJFOESAGSA-N 2 0 222.376 2.249 20 0 BEADRP CCC1([NH2+][C@H]2CCC[N@H+](C)CC2)CCOCC1 ZINC001254513064 969684292 /nfs/dbraw/zinc/68/42/92/969684292.db2.gz WKHOWMVETVZNPI-ZDUSSCGKSA-N 2 0 240.391 2.020 20 0 BEADRP C[C@H]1CCC[N@@H+]([C@H]2CCC[NH+](C)CC2)C1 ZINC001254516483 969687765 /nfs/dbraw/zinc/68/77/65/969687765.db2.gz MUROCHZCGBCAPW-STQMWFEESA-N 2 0 210.365 2.203 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH+]2CCC(C)(C)C2)CC1 ZINC001254522612 969709399 /nfs/dbraw/zinc/70/93/99/969709399.db2.gz HSIOWBZMHLIUJF-GFCCVEGCSA-N 2 0 210.365 2.203 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH+]2CCC[C@@H](C(F)F)C2)CC1 ZINC001254525428 969716273 /nfs/dbraw/zinc/71/62/73/969716273.db2.gz IETKYSJNCQSNSZ-VXGBXAGGSA-N 2 0 246.345 2.448 20 0 BEADRP C[C@@H]1C[N@H+]([C@@H]2CCC[NH+](C)CC2)C2(CC2)C1 ZINC001254530048 969728351 /nfs/dbraw/zinc/72/83/51/969728351.db2.gz UDMHKGVOPLFVEW-QWHCGFSZSA-N 2 0 222.376 2.345 20 0 BEADRP C[C@H]1C[C@H]([N@H+](C)CC2CC(F)(F)C2)CC[NH2+]1 ZINC000394748723 1166613347 /nfs/dbraw/zinc/61/33/47/1166613347.db2.gz ZMYXJFDBTQJAJP-GXSJLCMTSA-N 2 0 232.318 2.104 20 0 BEADRP Cc1cc(C[N@H+]2CC[C@@H]([C@H](C)[NH3+])C2)cs1 ZINC000379804094 1166788633 /nfs/dbraw/zinc/78/86/33/1166788633.db2.gz NGYUNVRQWFYTBL-CMPLNLGQSA-N 2 0 224.373 2.226 20 0 BEADRP CC[C@@H]1C[C@@H]([NH2+]CCCCCCC[NH3+])CCO1 ZINC001170178094 970554613 /nfs/dbraw/zinc/55/46/13/970554613.db2.gz MZNJIGUJMNPGDF-UONOGXRCSA-N 2 0 242.407 2.443 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]C1CC(F)(F)C1 ZINC001255941895 970575762 /nfs/dbraw/zinc/57/57/62/970575762.db2.gz ZBZUDOIUKXSIQI-SNVBAGLBSA-N 2 0 234.334 2.494 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]C[C@@H]1CCCCO1 ZINC001255944171 970576990 /nfs/dbraw/zinc/57/69/90/970576990.db2.gz SHDFOJWMFGVXQZ-KGLIPLIRSA-N 2 0 242.407 2.266 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]CCSC ZINC001255942013 970577687 /nfs/dbraw/zinc/57/76/87/970577687.db2.gz CWKFHVYTWIHBLH-NSHDSACASA-N 2 0 218.410 2.059 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]C[C@@H]1CC(C)(C)O1 ZINC001255947587 970584563 /nfs/dbraw/zinc/58/45/63/970584563.db2.gz SXBLCPNRIYUXMQ-OLZOCXBDSA-N 2 0 242.407 2.264 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]C[C@@]1(C)CCOC1 ZINC001255951300 970587887 /nfs/dbraw/zinc/58/78/87/970587887.db2.gz HULWTIFJULXMSK-ZIAGYGMSSA-N 2 0 242.407 2.123 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)NC(C)(C)C(C)(C)[NH3+] ZINC001255953143 970589558 /nfs/dbraw/zinc/58/95/58/970589558.db2.gz XKHXSXDEEYFTPK-GFCCVEGCSA-N 2 0 243.439 2.212 20 0 BEADRP CC(C)[C@@H]1CCC[C@@H]([NH2+][C@@H]2C[NH2+]C[C@H]2C)C1 ZINC000925784859 1166833907 /nfs/dbraw/zinc/83/39/07/1166833907.db2.gz OIDHSXDPFVAVLJ-AAVRWANBSA-N 2 0 224.392 2.399 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[N@@H+]1CC[C@@H](COC)C1 ZINC001255957073 970593619 /nfs/dbraw/zinc/59/36/19/970593619.db2.gz OQVBVLZDVBZQJB-UONOGXRCSA-N 2 0 242.407 2.075 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[N@H+](CCOC)C(C)C ZINC001255959962 970604092 /nfs/dbraw/zinc/60/40/92/970604092.db2.gz BZOLWEOVDNSTOB-AWEZNQCLSA-N 2 0 244.423 2.464 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[N@H+](C)[C@@H]1CCCOC1 ZINC001255969067 970609719 /nfs/dbraw/zinc/60/97/19/970609719.db2.gz STUBICAUXABXCL-UONOGXRCSA-N 2 0 242.407 2.218 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H]2C[C@H]3C[C@H]3C2)CC1 ZINC001167897925 1166896564 /nfs/dbraw/zinc/89/65/64/1166896564.db2.gz OKONILILGRPGMK-IMRBUKKESA-N 2 0 222.376 2.249 20 0 BEADRP CC[NH+](CC)C1CCC([NH2+][C@@H](C)COC)CC1 ZINC001173103401 975021582 /nfs/dbraw/zinc/02/15/82/975021582.db2.gz AUOYMOQFZZLGHY-HSBZDZAISA-N 2 0 242.407 2.264 20 0 BEADRP CCSC[C@H](C)[NH+]1CCC(C[NH+](C)C)CC1 ZINC001173306855 975212082 /nfs/dbraw/zinc/21/20/82/975212082.db2.gz YYEMBDBWIDTNRG-LBPRGKRZSA-N 2 0 244.448 2.402 20 0 BEADRP CCSC[C@@H](C)[N@H+](CC)CCC[NH+](C)C ZINC001173316884 975303717 /nfs/dbraw/zinc/30/37/17/975303717.db2.gz ZVBAVPLORMKHCB-GFCCVEGCSA-N 2 0 232.437 2.402 20 0 BEADRP CSCC[C@H](C)[N@H+](C)CCC[NH+](C)C ZINC000336676496 1167102975 /nfs/dbraw/zinc/10/29/75/1167102975.db2.gz YFYMXAUMEYKYJQ-NSHDSACASA-N 2 0 218.410 2.012 20 0 BEADRP C(C[N@H+]1C[C@H]2C[NH2+]CC[C@@H]2C1)C1CCCCC1 ZINC000310407054 1167105433 /nfs/dbraw/zinc/10/54/33/1167105433.db2.gz OKNLORWCPXABKS-HUUCEWRRSA-N 2 0 236.403 2.498 20 0 BEADRP CC(C)[C@@H]1CCC[N@@H+]1C[C@H]1CC[C@@H]([NH3+])C1 ZINC000251404051 1167142940 /nfs/dbraw/zinc/14/29/40/1167142940.db2.gz MMDWAOAFCKDENK-XQQFMLRXSA-N 2 0 210.365 2.234 20 0 BEADRP [NH3+]Cc1ccc(CC[NH+]2CCCCC2)cc1 ZINC000212998633 1167176121 /nfs/dbraw/zinc/17/61/21/1167176121.db2.gz FVBNKXYABORJSI-UHFFFAOYSA-N 2 0 218.344 2.174 20 0 BEADRP C[C@H](CC(F)(F)F)[NH2+]CCCC[NH+](C)C ZINC000308893813 1167215755 /nfs/dbraw/zinc/21/57/55/1167215755.db2.gz YSYZATYEOVWBRF-SECBINFHSA-N 2 0 226.286 2.259 20 0 BEADRP C[NH+](C)CC(C)(C)C[NH2+]C1CC(C)(C)C1 ZINC000309036342 1167244467 /nfs/dbraw/zinc/24/44/67/1167244467.db2.gz IJKIVNQNVPANLO-UHFFFAOYSA-N 2 0 212.381 2.352 20 0 BEADRP CC[C@H](C)[NH2+][C@@H]1CC[N@@H+](C(C)C)C[C@@H]1C ZINC000309236978 1167271426 /nfs/dbraw/zinc/27/14/26/1167271426.db2.gz XSKHLAYIAOYXFS-RWMBFGLXSA-N 2 0 212.381 2.493 20 0 BEADRP C[C@@H]1C[C@@H](C)C[NH+](C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000309348287 1167293342 /nfs/dbraw/zinc/29/33/42/1167293342.db2.gz MTYKLAZXLVDAAH-LSGALXMHSA-N 2 0 222.376 2.247 20 0 BEADRP CCCC(CCC)[N@@H+]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000309405892 1167300616 /nfs/dbraw/zinc/30/06/16/1167300616.db2.gz JPXJJGGHVUABTL-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH2+]CC2CC(F)(F)C2)CC1 ZINC000309660736 1167334814 /nfs/dbraw/zinc/33/48/14/1167334814.db2.gz RETIKMYNHOHSEB-NSHDSACASA-N 2 0 232.318 2.106 20 0 BEADRP C[N@H+](CCCCCCC[NH3+])CC1=CCCOC1 ZINC000696890023 1167341099 /nfs/dbraw/zinc/34/10/99/1167341099.db2.gz SYBVMHXLMZKFMA-UHFFFAOYSA-N 2 0 240.391 2.174 20 0 BEADRP [NH3+]CC1CCC([NH2+][C@@H]2CCCC[C@@H]2F)CC1 ZINC001335948080 977379057 /nfs/dbraw/zinc/37/90/57/977379057.db2.gz MZDWWCQDSQDURK-IFWUJCSASA-N 2 0 228.355 2.374 20 0 BEADRP [NH3+][C@@H]1CCC[N@H+](CC2CCCCC2)CC1 ZINC000215787577 1167478754 /nfs/dbraw/zinc/47/87/54/1167478754.db2.gz NESCTUXHFZOEPS-CYBMUJFWSA-N 2 0 210.365 2.380 20 0 BEADRP COCC[C@@H]([NH3+])C[N@@H+]1CCC2(C1)CCCCC2 ZINC000310212410 1167494660 /nfs/dbraw/zinc/49/46/60/1167494660.db2.gz HDFNHXIJYATZNI-CYBMUJFWSA-N 2 0 240.391 2.006 20 0 BEADRP CC[C@H](C)[C@H](C[NH2+]C[C@@]1(C)CCC[NH2+]C1)OC ZINC000381381336 1167547819 /nfs/dbraw/zinc/54/78/19/1167547819.db2.gz LNRPYBLMNRXGIA-IHRRRGAJSA-N 2 0 242.407 2.027 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH2+]CCC2CCC2)CC1 ZINC000161870075 1167551936 /nfs/dbraw/zinc/55/19/36/1167551936.db2.gz CELBCQBGDBFVRX-CYBMUJFWSA-N 2 0 210.365 2.251 20 0 BEADRP CC1(C)CCC([N@@H+]2CC[C@@H]3C[NH2+]C[C@@H]3C2)CC1 ZINC000310226825 1167570975 /nfs/dbraw/zinc/57/09/75/1167570975.db2.gz GWBLZWLATNWHSC-CHWSQXEVSA-N 2 0 236.403 2.497 20 0 BEADRP C(C1CC1)[NH+]1CCC([N@@H+]2CCCC23CC3)CC1 ZINC001168372346 1167607103 /nfs/dbraw/zinc/60/71/03/1167607103.db2.gz VIDNGBILXCCMCJ-UHFFFAOYSA-N 2 0 234.387 2.489 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+]CCCC(F)F)CC1(C)C ZINC001336776533 977946075 /nfs/dbraw/zinc/94/60/75/977946075.db2.gz GNNPKGVTQMANAT-SNVBAGLBSA-N 2 0 234.334 2.494 20 0 BEADRP C(CC1CC1)[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000132285543 1167742871 /nfs/dbraw/zinc/74/28/71/1167742871.db2.gz ZERSKTNRECLYLV-UHFFFAOYSA-N 2 0 222.376 2.251 20 0 BEADRP Cc1cccc(F)c1C[N@@H+]1CCC[C@H]([NH3+])CC1 ZINC001205117508 1167771315 /nfs/dbraw/zinc/77/13/15/1167771315.db2.gz PRQDUWCEYMRSIL-LBPRGKRZSA-N 2 0 236.334 2.447 20 0 BEADRP CC1(C)C[C@H]([N@@H+]2CCCC[C@@H](C[NH3+])C2)CCO1 ZINC000310449330 1167773978 /nfs/dbraw/zinc/77/39/78/1167773978.db2.gz XRJQEQNYZTUYCW-QWHCGFSZSA-N 2 0 240.391 2.005 20 0 BEADRP CC1(C)C[C@@H]([N@@H+]2CCCC[C@H](C[NH3+])C2)CCO1 ZINC000310449328 1167773492 /nfs/dbraw/zinc/77/34/92/1167773492.db2.gz XRJQEQNYZTUYCW-OLZOCXBDSA-N 2 0 240.391 2.005 20 0 BEADRP C([NH2+][C@H]1CC12CCCCC2)C1CC[NH2+]CC1 ZINC000386958138 1167789151 /nfs/dbraw/zinc/78/91/51/1167789151.db2.gz YGWOSYDQNBCIRJ-ZDUSSCGKSA-N 2 0 222.376 2.298 20 0 BEADRP C([C@@H]1CCC[NH2+]1)[N@@H+]1CC[C@H]2CCCC[C@H]2C1 ZINC000252371756 1167825576 /nfs/dbraw/zinc/82/55/76/1167825576.db2.gz DBZSIGILGQEISC-RDBSUJKOSA-N 2 0 222.376 2.251 20 0 BEADRP [NH3+][C@]12CC[C@H]1C[N@H+](CCCC1CCCC1)C2 ZINC001235979955 979234375 /nfs/dbraw/zinc/23/43/75/979234375.db2.gz OWEGJMGHCIYZIY-KBPBESRZSA-N 2 0 222.376 2.380 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[N@H+](C)CC1)c1cccnc1 ZINC000086817291 1168310543 /nfs/dbraw/zinc/31/05/43/1168310543.db2.gz CYDDIDRXYKEDOO-JSGCOSHPSA-N 2 0 233.359 2.217 20 0 BEADRP [NH3+]C[C@H]1CCC[N@@H+]([C@@H]2CCc3c2cccc3F)C1 ZINC000149341668 1168319388 /nfs/dbraw/zinc/31/93/88/1168319388.db2.gz QUIIGZGLMSQFLK-IAQYHMDHSA-N 2 0 248.345 2.484 20 0 BEADRP CC[C@H](C)[N@H+](CC)C[C@H]1CCCC[NH2+]C1 ZINC000697040185 1168406514 /nfs/dbraw/zinc/40/65/14/1168406514.db2.gz HKEARXNAGHAXBQ-STQMWFEESA-N 2 0 212.381 2.497 20 0 BEADRP CC(C)CC[N@@H+]1CCC[C@@]12CCC[NH2+]C2 ZINC000257685170 1168587374 /nfs/dbraw/zinc/58/73/74/1168587374.db2.gz LZYRPRQFRTXESR-CYBMUJFWSA-N 2 0 210.365 2.251 20 0 BEADRP C1C[N@H+]([C@@H]2CCCSC2)[C@]2(C1)CCC[NH2+]C2 ZINC000257696480 1168607990 /nfs/dbraw/zinc/60/79/90/1168607990.db2.gz KHNUJBKVWPHHAZ-OLZOCXBDSA-N 2 0 240.416 2.100 20 0 BEADRP Cc1cccc(CN(C)[C@H]2CCC[NH2+]C2)c1C ZINC000110926772 1168983720 /nfs/dbraw/zinc/98/37/20/1168983720.db2.gz UTAFLRTUHHEWEQ-HNNXBMFYSA-N 2 0 232.371 2.487 20 0 BEADRP CCc1ccccc1CN(C)[C@H]1CCC[NH2+]C1 ZINC000110925968 1168983951 /nfs/dbraw/zinc/98/39/51/1168983951.db2.gz MCYSTDBUIVZTSI-HNNXBMFYSA-N 2 0 232.371 2.433 20 0 BEADRP C[NH2+][C@@]12CC[C@@]([NH2+]C[C@@H]3C[C@@H]3C)(C1)CCC2 ZINC001276034042 1169064676 /nfs/dbraw/zinc/06/46/76/1169064676.db2.gz QFKSNLKVDXOEKZ-XDQVBPFNSA-N 2 0 222.376 2.297 20 0 BEADRP CCCC[N@H+]1C[C@H]2C[NH+](CCC)C[C@H]2C1 ZINC001201717226 983424914 /nfs/dbraw/zinc/42/49/14/983424914.db2.gz GUDVYAPPAJVZHF-BETUJISGSA-N 2 0 210.365 2.060 20 0 BEADRP CCCCCC[N@H+](C)CCC[NH+](C)C ZINC001201743219 983448778 /nfs/dbraw/zinc/44/87/78/983448778.db2.gz NESUHKIDEKWMQT-UHFFFAOYSA-N 2 0 200.370 2.450 20 0 BEADRP CCCCCC[C@@H](C)NC(=[NH2+])NCCCC[NH3+] ZINC001257362788 1169079380 /nfs/dbraw/zinc/07/93/80/1169079380.db2.gz FSBVCGMLQWYVPP-GFCCVEGCSA-N 2 0 242.411 2.198 20 0 BEADRP CCOCC[C@@H](C)[N@H+](CC)CCC[NH+](C)C ZINC001172428110 974701698 /nfs/dbraw/zinc/70/16/98/974701698.db2.gz XPGOPHVVIBWFOR-CYBMUJFWSA-N 2 0 230.396 2.075 20 0 BEADRP CC(C)OCC[C@H](C)[NH2+]CC(C)(C)C[NH+](C)C ZINC001172446640 974808671 /nfs/dbraw/zinc/80/86/71/974808671.db2.gz CZQKRGGWQVXLKO-ZDUSSCGKSA-N 2 0 244.423 2.367 20 0 BEADRP COc1cc[nH+]c(NC2CC3(C2)CCC[NH2+]C3)c1 ZINC001162980947 1169452989 /nfs/dbraw/zinc/45/29/89/1169452989.db2.gz HCBSPFXINUAUTQ-UHFFFAOYSA-N 2 0 247.342 2.034 20 0 BEADRP CC(C)(C)[NH+]1CCC([NH2+]C2CC(F)C2)CC1 ZINC001256555343 970860943 /nfs/dbraw/zinc/86/09/43/970860943.db2.gz WNVQEMGMICNCHP-UHFFFAOYSA-N 2 0 228.355 2.339 20 0 BEADRP CCC[C@@H](C)C[N@@H+]1CCC(F)(F)[C@@H](C[NH3+])C1 ZINC000403136476 970883189 /nfs/dbraw/zinc/88/31/89/970883189.db2.gz BWWZNONVSCAWDX-MNOVXSKESA-N 2 0 234.334 2.339 20 0 BEADRP CCC(CC)C[N@@H+]1CCC(F)(F)[C@@H](C[NH3+])C1 ZINC000403196024 970892965 /nfs/dbraw/zinc/89/29/65/970892965.db2.gz XTZDHFBZCWUVPF-NSHDSACASA-N 2 0 234.334 2.339 20 0 BEADRP CCC(CC)C[N@@H+]1CCC(F)(F)[C@H](C[NH3+])C1 ZINC000403196022 970894542 /nfs/dbraw/zinc/89/45/42/970894542.db2.gz XTZDHFBZCWUVPF-LLVKDONJSA-N 2 0 234.334 2.339 20 0 BEADRP C[C@H](Cc1ccncc1)[NH2+]CCCCC[NH+](C)C ZINC001256720820 970940113 /nfs/dbraw/zinc/94/01/13/970940113.db2.gz YVAYXYPWBHERPM-CQSZACIVSA-N 2 0 249.402 2.334 20 0 BEADRP [NH3+]CC[C@@H]1CC[N@H+](C[C@@H]2CC[C@H]3C[C@H]3C2)C1 ZINC000403451533 970946003 /nfs/dbraw/zinc/94/60/03/970946003.db2.gz GEEUNFMFRXAMTF-YIYPIFLZSA-N 2 0 222.376 2.093 20 0 BEADRP C[NH+](C)Cc1cccc(Nc2cc[nH+]cc2)c1F ZINC001216226792 970996473 /nfs/dbraw/zinc/99/64/73/970996473.db2.gz ABZYIKUTOSRNKL-UHFFFAOYSA-N 2 0 245.301 2.448 20 0 BEADRP [NH3+]C1(c2ccc(C3=C[NH2+]CCC3)cc2)CC1 ZINC001243949309 971040410 /nfs/dbraw/zinc/04/04/10/971040410.db2.gz FXOITZNQAMNKDT-UHFFFAOYSA-N 2 0 214.312 2.359 20 0 BEADRP C[C@H]([NH3+])c1ccc(C2=C[NH2+]CCC2)cc1 ZINC001243950742 971040960 /nfs/dbraw/zinc/04/09/60/971040960.db2.gz MBKPRNFLFGDIDO-JTQLQIEISA-N 2 0 202.301 2.431 20 0 BEADRP CC[NH+](CC)C[C@H](C)OC[C@@H]1CCCC[N@@H+]1C ZINC001224703952 973871713 /nfs/dbraw/zinc/87/17/13/973871713.db2.gz VYLOMZYUVHZGHO-KBPBESRZSA-N 2 0 242.407 2.218 20 0 BEADRP CC(C)[N@H+](CCC[NH3+])C1C[C@@H](C)O[C@H](C)C1 ZINC001257073827 971089592 /nfs/dbraw/zinc/08/95/92/971089592.db2.gz WIZZKVSGXAHAQB-VXGBXAGGSA-N 2 0 228.380 2.002 20 0 BEADRP CC[C@H]1C[N@H+](CCCCCCC[NH3+])[C@@H](C)CO1 ZINC000403915622 971090145 /nfs/dbraw/zinc/09/01/45/971090145.db2.gz OPDNKBAPYNHXIM-KBPBESRZSA-N 2 0 242.407 2.395 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C(C)(C)CC[NH+](C)C)C[C@H](C)O1 ZINC001257082230 971094214 /nfs/dbraw/zinc/09/42/14/971094214.db2.gz WSTFDXUUCVARPW-CLLJXQQHSA-N 2 0 242.407 2.262 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)C1C[C@@H](C)O[C@H](C)C1 ZINC001257101295 971115411 /nfs/dbraw/zinc/11/54/11/971115411.db2.gz GISKVYMLXJQGGZ-CHWSQXEVSA-N 2 0 242.407 2.216 20 0 BEADRP CC(C)[NH+]1CCC(n2cccc2CC[NH3+])CC1 ZINC001257210370 971128644 /nfs/dbraw/zinc/12/86/44/971128644.db2.gz LQWODCJAPIIKDR-UHFFFAOYSA-N 2 0 235.375 2.035 20 0 BEADRP CCC[C@H](CC)[N@H+](C)CCC[NH+](C)C ZINC001257257429 971156880 /nfs/dbraw/zinc/15/68/80/971156880.db2.gz QOEYLIJGZSIVGX-LBPRGKRZSA-N 2 0 200.370 2.449 20 0 BEADRP CCC(CC)[NH+]1C[C@@H]2C[NH+](CC)C[C@H]2C1 ZINC001257301380 971187892 /nfs/dbraw/zinc/18/78/92/971187892.db2.gz DMMHKAQSSZAYPX-RYUDHWBXSA-N 2 0 210.365 2.059 20 0 BEADRP COc1ccc(C[NH2+][C@H]2C[C@H]([NH3+])C23CCC3)cc1 ZINC000405208521 971208071 /nfs/dbraw/zinc/20/80/71/971208071.db2.gz HFDIVVGTVNEVAV-KBPBESRZSA-N 2 0 246.354 2.055 20 0 BEADRP CCC[C@H](C)[N@H+](C1COC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001257312586 971206526 /nfs/dbraw/zinc/20/65/26/971206526.db2.gz ZEPMMQWGASQVBL-AVGNSLFASA-N 2 0 240.391 2.146 20 0 BEADRP CC(C)CSCC[NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405209863 971210646 /nfs/dbraw/zinc/21/06/46/971210646.db2.gz CCOAXHPZXYYHES-VXGBXAGGSA-N 2 0 242.432 2.235 20 0 BEADRP CC(F)(F)CCC[NH2+][C@@H]1C[C@@H]([NH3+])C1(C)C ZINC000405223956 971212107 /nfs/dbraw/zinc/21/21/07/971212107.db2.gz NSPRIRDDRNJZOA-RKDXNWHRSA-N 2 0 220.307 2.137 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+][C@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405224821 971212950 /nfs/dbraw/zinc/21/29/50/971212950.db2.gz OBMJTKRADVSEHM-BNOWGMLFSA-N 2 0 248.370 2.460 20 0 BEADRP CSCCCCC[NH2+][C@@H]1C[C@H]([NH3+])C12CCC2 ZINC000405236762 971214228 /nfs/dbraw/zinc/21/42/28/971214228.db2.gz FBRDRALJKOSGGL-NWDGAFQWSA-N 2 0 242.432 2.379 20 0 BEADRP C[C@H](CC(F)(F)F)[NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405272492 971227757 /nfs/dbraw/zinc/22/77/57/971227757.db2.gz SPYFWCCDKKZEQG-IWSPIJDZSA-N 2 0 236.281 2.187 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]Cc2cccc(F)c2)C12CCC2 ZINC000405326113 971235356 /nfs/dbraw/zinc/23/53/56/971235356.db2.gz UKALJMZXFHUZII-STQMWFEESA-N 2 0 234.318 2.185 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1C[C@H]([NH3+])C12CCC2 ZINC000405333927 971239286 /nfs/dbraw/zinc/23/92/86/971239286.db2.gz FQYSCPJTMCSBGK-MROQNXINSA-N 2 0 222.376 2.425 20 0 BEADRP C[C@@H]1CCC[C@@H]1C[NH2+][C@H]1C[C@H]([NH3+])C12CCC2 ZINC000405366799 971240668 /nfs/dbraw/zinc/24/06/68/971240668.db2.gz WZUUVKMGCVXQTM-NDBYEHHHSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@H]([NH2+][C@H]1C[C@H]([NH3+])C12CCC2)C1CCCC1 ZINC000405356466 971242025 /nfs/dbraw/zinc/24/20/25/971242025.db2.gz RHXHTQRWDMFCEP-DRZSPHRISA-N 2 0 222.376 2.425 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+][C@H]2C[C@H]([NH3+])C23CCC3)C1 ZINC000405348432 971242227 /nfs/dbraw/zinc/24/22/27/971242227.db2.gz MLUUHVPJTBUJQK-VOAKCMCISA-N 2 0 222.376 2.282 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[C@H]([NH3+])C12CCC2)C1CCCC1 ZINC000405356467 971244411 /nfs/dbraw/zinc/24/44/11/971244411.db2.gz RHXHTQRWDMFCEP-KGYLQXTDSA-N 2 0 222.376 2.425 20 0 BEADRP CC(C)=CCC[NH2+][C@@H]1C[C@H]([NH3+])C12CCC2 ZINC000405380319 971251081 /nfs/dbraw/zinc/25/10/81/971251081.db2.gz IVSKCVHPYXSRNM-NWDGAFQWSA-N 2 0 208.349 2.202 20 0 BEADRP CCCC(CCC)[N@H+]1C[C@H]2C[NH+](C)C[C@H]2C1 ZINC001257340890 971252683 /nfs/dbraw/zinc/25/26/83/971252683.db2.gz OSBLUDUULZUMSY-BETUJISGSA-N 2 0 224.392 2.449 20 0 BEADRP CC(C)(C)CC[NH2+][C@H]1C[C@H]([NH3+])C12CCC2 ZINC000405439412 971255931 /nfs/dbraw/zinc/25/59/31/971255931.db2.gz DGFVGPJOXZRWNE-QWRGUYRKSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)CCC[NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405459920 971258739 /nfs/dbraw/zinc/25/87/39/971258739.db2.gz ILUZQHLOMZGPIL-VXGBXAGGSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2)C1CCC1 ZINC000405469379 971259173 /nfs/dbraw/zinc/25/91/73/971259173.db2.gz KOBPGWDZWBLXCE-MVWJERBFSA-N 2 0 208.349 2.035 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]CC2CCCC2)C12CCC2 ZINC000405473277 971260513 /nfs/dbraw/zinc/26/05/13/971260513.db2.gz LHIMNMDBGKJRCA-RYUDHWBXSA-N 2 0 208.349 2.036 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+][C@@H]1C[C@H]([NH3+])C12CCC2 ZINC000405516198 971263592 /nfs/dbraw/zinc/26/35/92/971263592.db2.gz UQJLCHUSVDKOIX-GARJFASQSA-N 2 0 208.349 2.035 20 0 BEADRP C(C1CC1)[N@@H+]1CCC2(CN(C3CCCC3)C2)C1 ZINC001257350138 971263527 /nfs/dbraw/zinc/26/35/27/971263527.db2.gz KRNJHBKYXZYWPU-UHFFFAOYSA-N 2 0 234.387 2.347 20 0 BEADRP CCC[NH+]1C[C@H]2C[NH+](C3CCCC3)C[C@@H]2C1 ZINC001257355255 971269206 /nfs/dbraw/zinc/26/92/06/971269206.db2.gz SHRANNRJCPDDJE-STQMWFEESA-N 2 0 222.376 2.203 20 0 BEADRP CCCCCC[C@@H](C)[NH2+]CCC[N@H+](C)CCO ZINC001257359259 971276387 /nfs/dbraw/zinc/27/63/87/971276387.db2.gz NJBZNYWXYWXABY-CQSZACIVSA-N 2 0 244.423 2.249 20 0 BEADRP CCCC[C@@H](CC)[N@H+]1C[C@H]2C[NH+](C)C[C@H]2C1 ZINC001257424428 971325263 /nfs/dbraw/zinc/32/52/63/971325263.db2.gz DYLYVBPKKZMYFK-HZSPNIEDSA-N 2 0 224.392 2.449 20 0 BEADRP C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C[C@@H]1C[C@H]2C=C[C@@H]1C2 ZINC001276758551 971323743 /nfs/dbraw/zinc/32/37/43/971323743.db2.gz FAFZSUFLMHZDEO-UCHDVTTGSA-N 2 0 246.398 2.413 20 0 BEADRP [NH3+][C@@H]1CCc2c1cccc2N[C@@H]1CCC[C@H]([NH3+])C1 ZINC001170623199 971377899 /nfs/dbraw/zinc/37/78/99/971377899.db2.gz QNAJFPMAUQWCNZ-MISXGVKJSA-N 2 0 245.370 2.314 20 0 BEADRP CC[C@H](C[C@@H](C)CC)[NH+]1CC2(C1)CC[NH2+]C2 ZINC000724058040 971384153 /nfs/dbraw/zinc/38/41/53/971384153.db2.gz WFXIFAJMTPNKEU-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H](OCCCCCCC[NH3+])C1CC[NH2+]CC1 ZINC001217777419 971387328 /nfs/dbraw/zinc/38/73/28/971387328.db2.gz KTXCPQFKWBIATB-ZDUSSCGKSA-N 2 0 242.407 2.300 20 0 BEADRP CC[NH+]1C[C@@H]2C[NH+](C3CCCCC3)C[C@H]2C1 ZINC001257467097 971391605 /nfs/dbraw/zinc/39/16/05/971391605.db2.gz UWYVOZAPIBRXKR-CHWSQXEVSA-N 2 0 222.376 2.203 20 0 BEADRP [NH3+]CCCCCCO[C@H]1CCC[C@]12CC[NH2+]C2 ZINC001217803915 971414113 /nfs/dbraw/zinc/41/41/13/971414113.db2.gz UEQZUHDVAPXRCA-UONOGXRCSA-N 2 0 240.391 2.054 20 0 BEADRP C[C@H]1C[C@@H]([NH+]2CC3(C2)CC[NH2+]C3)CC(C)(C)C1 ZINC000724057020 971436073 /nfs/dbraw/zinc/43/60/73/971436073.db2.gz OLHOREFDXVWTPD-QWHCGFSZSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]1C[C@@H]([NH+]2CC3(C2)CC[NH2+]C3)CC(C)(C)C1 ZINC000724057016 971436955 /nfs/dbraw/zinc/43/69/55/971436955.db2.gz OLHOREFDXVWTPD-CHWSQXEVSA-N 2 0 236.403 2.497 20 0 BEADRP [NH3+]Cc1ccccc1C[NH2+][C@@H]1CCCSC1 ZINC001257663506 971462282 /nfs/dbraw/zinc/46/22/82/971462282.db2.gz APUPCBFBPUGURP-CYBMUJFWSA-N 2 0 236.384 2.131 20 0 BEADRP [NH3+]CCCCCCC[NH2+][C@H]1CCCSC1 ZINC001257665210 971467285 /nfs/dbraw/zinc/46/72/85/971467285.db2.gz ZNNPZWVXLVNQPP-LBPRGKRZSA-N 2 0 230.421 2.381 20 0 BEADRP CC(C)OC1CCC([N@@H+]2CCC[C@H]2CN)CC1 ZINC001257872454 971512292 /nfs/dbraw/zinc/51/22/92/971512292.db2.gz YRNHXHVHQUGPCE-MOKVOYLWSA-N 2 0 240.391 2.146 20 0 BEADRP CC(C)C[NH+]1CCC([NH2+]C2(C)CC2)CC1 ZINC001258001146 971554456 /nfs/dbraw/zinc/55/44/56/971554456.db2.gz FJFCARKCJHCPGP-UHFFFAOYSA-N 2 0 210.365 2.249 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@H]2C[C@@H]3[C@H](C2)C3(C)C)CC1 ZINC001170713034 971620354 /nfs/dbraw/zinc/62/03/54/971620354.db2.gz MDCCYRQBOMWHLC-BTTYYORXSA-N 2 0 236.403 2.352 20 0 BEADRP CC[NH+](CC)C[C@H](C)Oc1cccc(C[NH3+])c1 ZINC001218194472 971622620 /nfs/dbraw/zinc/62/26/20/971622620.db2.gz UWEXMFZTRIBPAV-LBPRGKRZSA-N 2 0 236.359 2.254 20 0 BEADRP CC(C)[N@H+](CCC[NH3+])[C@H]1C[C@@H]2[C@H](C1)C2(C)C ZINC001170716133 971634050 /nfs/dbraw/zinc/63/40/50/971634050.db2.gz PFAGJODHIWOWPI-CLLJXQQHSA-N 2 0 224.392 2.480 20 0 BEADRP CCC[N@H+](CCC[NH3+])[C@H]1C[C@@H]2[C@H](C1)C2(C)C ZINC001170715256 971634840 /nfs/dbraw/zinc/63/48/40/971634840.db2.gz FGOHLHUTUWZJQM-CLLJXQQHSA-N 2 0 224.392 2.482 20 0 BEADRP CC1(C)[C@@H]2C[C@H]([NH2+]CC34CC[NH+](CC3)CC4)C[C@@H]21 ZINC001170724561 971658657 /nfs/dbraw/zinc/65/86/57/971658657.db2.gz MKZROEZSZCQEDT-BTTYYORXSA-N 2 0 248.414 2.497 20 0 BEADRP C[C@@H](c1cccc(O[C@H]2CCC[NH2+]C2)c1)[NH+](C)C ZINC001218283066 971676734 /nfs/dbraw/zinc/67/67/34/971676734.db2.gz DMRUUBUJZHSMIJ-WFASDCNBSA-N 2 0 248.370 2.440 20 0 BEADRP C[NH+](C)C1CC[NH+]([C@@H]2C[C@@H]3[C@H](C2)C3(C)C)CC1 ZINC001170742129 971695942 /nfs/dbraw/zinc/69/59/42/971695942.db2.gz YQZGUAUEDOBPNU-ZSOGYDGISA-N 2 0 236.403 2.447 20 0 BEADRP CN(C)c1cc[nH+]cc1NC=CC1CC[NH2+]CC1 ZINC001159171801 971721933 /nfs/dbraw/zinc/72/19/33/971721933.db2.gz SQFQBUZJRSEVBR-BJMVGYQFSA-N 2 0 246.358 2.073 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+][C@H](C)[C@@H](C)OC ZINC000309676112 971753970 /nfs/dbraw/zinc/75/39/70/971753970.db2.gz XSMZELCBZXOQBB-YNEHKIRRSA-N 2 0 230.396 2.120 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+][C@@H](C)[C@@H](C)OC ZINC000309676110 971754888 /nfs/dbraw/zinc/75/48/88/971754888.db2.gz XSMZELCBZXOQBB-RWMBFGLXSA-N 2 0 230.396 2.120 20 0 BEADRP C[C@H]([NH3+])c1ccc(O[C@@H]2CC[NH2+]C[C@@H]2C)cc1 ZINC001218418804 971793961 /nfs/dbraw/zinc/79/39/61/971793961.db2.gz WSFOWHCEAHSYDY-COPLHBTASA-N 2 0 234.343 2.083 20 0 BEADRP CC1(C)C[C@@H](Oc2cccc3c2C[NH2+]C3)CC[NH2+]1 ZINC001218477796 971827265 /nfs/dbraw/zinc/82/72/65/971827265.db2.gz ROKDXKKCZDNTTK-LBPRGKRZSA-N 2 0 246.354 2.199 20 0 BEADRP CC1(C)C[C@@H](Oc2ccccc2C[NH3+])CC[NH2+]1 ZINC001218477852 971828222 /nfs/dbraw/zinc/82/82/22/971828222.db2.gz SXFHIYILAAFKCZ-LBPRGKRZSA-N 2 0 234.343 2.055 20 0 BEADRP CC[C@@H](C)OCC[C@H](C)[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC001172321402 974530377 /nfs/dbraw/zinc/53/03/77/974530377.db2.gz KGOQARZDIXJMSC-RFQIPJPRSA-N 2 0 242.407 2.440 20 0 BEADRP [NH3+]CCCCCCC[NH2+][C@H]1CCCOCC1 ZINC001170791726 971833058 /nfs/dbraw/zinc/83/30/58/971833058.db2.gz CQAFDVVSCFWLTG-ZDUSSCGKSA-N 2 0 228.380 2.054 20 0 BEADRP CC[C@H](C)OCC[C@@H](C)[N@H+](C)C[C@H](C)C[NH3+] ZINC001172326029 974531599 /nfs/dbraw/zinc/53/15/99/974531599.db2.gz ABXKNBXOUHCQKK-UPJWGTAASA-N 2 0 230.396 2.107 20 0 BEADRP CC[C@@H](C)OCC[C@H](C)[N@@H+]1CCC[C@H]1CN ZINC001172323268 974534191 /nfs/dbraw/zinc/53/41/91/974534191.db2.gz BPAHRCAQOGYXJF-XQQFMLRXSA-N 2 0 228.380 2.003 20 0 BEADRP CSC1(C[NH2+]CCC(C)C)CC[NH+](C)CC1 ZINC000309886676 971875019 /nfs/dbraw/zinc/87/50/19/971875019.db2.gz YRULSQMUCLINFD-UHFFFAOYSA-N 2 0 244.448 2.450 20 0 BEADRP CCCCCC[C@H](CCC)[NH2+]C[C@@H](O)C[NH3+] ZINC001172379220 974583341 /nfs/dbraw/zinc/58/33/41/974583341.db2.gz SEHFZEBJFJVBAT-STQMWFEESA-N 2 0 230.396 2.035 20 0 BEADRP CCc1ccc(C[N@@H+]2CCCC[C@@H](C[NH3+])C2)o1 ZINC000310292099 971968980 /nfs/dbraw/zinc/96/89/80/971968980.db2.gz RULWLGZHLAXJPA-LBPRGKRZSA-N 2 0 236.359 2.403 20 0 BEADRP CC[C@@]([NH3+])(CO)Nc1ccc2c[nH+]c(C)cc2c1 ZINC001170866205 971998097 /nfs/dbraw/zinc/99/80/97/971998097.db2.gz PILLXUINYLLKSX-AWEZNQCLSA-N 2 0 245.326 2.012 20 0 BEADRP Cc1cc(N[C@H]([NH3+])CCC[NH3+])cc(C)c1C ZINC001170898574 972059979 /nfs/dbraw/zinc/05/99/79/972059979.db2.gz FCURUOHQHXEFII-ZDUSSCGKSA-N 2 0 221.348 2.047 20 0 BEADRP Cc1cc(C)c(N[C@H]([NH3+])CCC[NH3+])c(C)c1 ZINC001170900544 972066393 /nfs/dbraw/zinc/06/63/93/972066393.db2.gz VSSQZGYVPAXMFC-LBPRGKRZSA-N 2 0 221.348 2.047 20 0 BEADRP CC(C)COCC[C@H](C)[NH2+][C@H]1CCCC[NH2+]C1 ZINC001246091934 972146304 /nfs/dbraw/zinc/14/63/04/972146304.db2.gz RAXPWJZIJVDOFN-KBPBESRZSA-N 2 0 242.407 2.169 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CCSCC[NH3+])C[C@H]1C ZINC001172365147 974642582 /nfs/dbraw/zinc/64/25/82/974642582.db2.gz CRQPNALZAICAAC-IJLUTSLNSA-N 2 0 230.421 2.093 20 0 BEADRP CC[C@@H]1CC[C@H]([NH2+]C[C@H]2C[NH2+]C[C@@H](C)C2)C1 ZINC001246103853 972163776 /nfs/dbraw/zinc/16/37/76/972163776.db2.gz TZLCKVBNRJGOLZ-DGAVXFQQSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H](CC1CC1)[NH2+]C[C@@H]1CC[C@@H](C)C[NH2+]1 ZINC001246106362 972170718 /nfs/dbraw/zinc/17/07/18/972170718.db2.gz PPHNKCQJZVKRFW-WZRBSPASSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1[NH2+]CCC[C@@H]1C[NH2+][C@@H]1C[C@@H]2[C@H](C1)C2(C)C ZINC001246112009 972177753 /nfs/dbraw/zinc/17/77/53/972177753.db2.gz QEZLZMJXUPUWBL-ZUWCUPBKSA-N 2 0 236.403 2.399 20 0 BEADRP CCCC[C@H](CC)[NH2+][C@@H]1C[NH2+]CC12CC2 ZINC001246133533 972190278 /nfs/dbraw/zinc/19/02/78/972190278.db2.gz OEJBEZRYJIXBNA-NWDGAFQWSA-N 2 0 210.365 2.297 20 0 BEADRP Cc1ccccc1OCC[NH2+][C@@H]1CC[NH2+][C@@H](C)C1 ZINC001246168276 972204181 /nfs/dbraw/zinc/20/41/81/972204181.db2.gz JMJWXITZQOXZOE-UONOGXRCSA-N 2 0 248.370 2.104 20 0 BEADRP C[C@@H]1CC([NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]23)C[C@@H](C)C1 ZINC001246178639 972207221 /nfs/dbraw/zinc/20/72/21/972207221.db2.gz PADVIRTYXYECEK-ZZVJUGKHSA-N 2 0 236.403 2.399 20 0 BEADRP Cc1ccc2c(c1)C[C@@H]([NH2+]C[C@H]1CCC[NH2+]1)CC2 ZINC001246185639 972210171 /nfs/dbraw/zinc/21/01/71/972210171.db2.gz CLIXUDFKXBMVTF-JKSUJKDBSA-N 2 0 244.382 2.194 20 0 BEADRP C[C@H]1C[C@H]([NH2+][C@H]2C[C@@H]([NH3+])C2)CC(C)(C)C1 ZINC001246190719 972212771 /nfs/dbraw/zinc/21/27/71/972212771.db2.gz RRESNSRJXWDVKA-YFKTTZPYSA-N 2 0 210.365 2.281 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C2(Cc3ccccc3)CC2)CC[NH2+]1 ZINC001246187047 972213159 /nfs/dbraw/zinc/21/31/59/972213159.db2.gz FPYQQIHGEMKXTG-HIFRSBDPSA-N 2 0 244.382 2.492 20 0 BEADRP Cc1cc2[nH]ccc2c(NC[C@H]2CCCC[NH2+]2)[nH+]1 ZINC001160148234 972219279 /nfs/dbraw/zinc/21/92/79/972219279.db2.gz PPBKTXLDKNCCKE-LLVKDONJSA-N 2 0 244.342 2.425 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@H]2CCNc3ccccc32)CC[NH2+]1 ZINC001246228762 972233727 /nfs/dbraw/zinc/23/37/27/972233727.db2.gz JFBOHFMJROZWTK-XUJVJEKNSA-N 2 0 245.370 2.273 20 0 BEADRP CS[C@@H](C)CC[N@@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC001208154614 957035469 /nfs/dbraw/zinc/03/54/69/957035469.db2.gz MVEPZLSYFWHMFU-STQMWFEESA-N 2 0 242.432 2.156 20 0 BEADRP CC1C[C@H]2CC[C@@H](C1)[N@H+]2C[C@H]1CCC[NH2+]1 ZINC000692952170 957039702 /nfs/dbraw/zinc/03/97/02/957039702.db2.gz BBRINWAXLFDDNO-HYWTVENDSA-N 2 0 208.349 2.001 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH+]2CCC3(CCC3)C2)C1 ZINC001208612279 957097881 /nfs/dbraw/zinc/09/78/81/957097881.db2.gz MAKSEXCJHWESJY-ZDUSSCGKSA-N 2 0 222.376 2.204 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH+]2CCC3(CCC3)C2)C1 ZINC001208612278 957102581 /nfs/dbraw/zinc/10/25/81/957102581.db2.gz MAKSEXCJHWESJY-CYBMUJFWSA-N 2 0 222.376 2.204 20 0 BEADRP COc1ccc(C[N@@H+]2CC[C@@H](C)[C@H](C[NH3+])C2)cc1 ZINC000253176845 957109604 /nfs/dbraw/zinc/10/96/04/957109604.db2.gz AKYHEKAJWVADHZ-TZMCWYRMSA-N 2 0 248.370 2.112 20 0 BEADRP CCOC(C)(C)C[N@H+](C)CCC[NH+]1CCCC1 ZINC001209074539 957310656 /nfs/dbraw/zinc/31/06/56/957310656.db2.gz HEXGDXBBFACIJD-UHFFFAOYSA-N 2 0 242.407 2.219 20 0 BEADRP C[C@@H]1C[C@@H](C[N@@H+]2CCC[C@@H]([NH3+])CC2)C[C@H](C)O1 ZINC000724501243 957317348 /nfs/dbraw/zinc/31/73/48/957317348.db2.gz JKLWLUYTUFTJCB-XJFOESAGSA-N 2 0 240.391 2.003 20 0 BEADRP CCCCc1nc(C)cc(N[C@H]2CC[N@H+](C)C2)n1 ZINC001167272707 957616433 /nfs/dbraw/zinc/61/64/33/957616433.db2.gz ANYNNUCAIKTDED-LBPRGKRZSA-N 2 0 248.374 2.244 20 0 BEADRP CO[C@H](C[N@H+](C)CCCCCC[NH3+])C1CCC1 ZINC000692247786 957647735 /nfs/dbraw/zinc/64/77/35/957647735.db2.gz DQGOOSZVDMRNCZ-CQSZACIVSA-N 2 0 242.407 2.252 20 0 BEADRP [NH3+][C@@H](CC(F)F)C[N@@H+]1CC[C@@H]2CCCC[C@@H]21 ZINC000400916783 957715055 /nfs/dbraw/zinc/71/50/55/957715055.db2.gz SZKMGAHVRQWZDP-DCAQKATOSA-N 2 0 232.318 2.233 20 0 BEADRP C[NH2+]CC[C@@H](C)[NH2+]C[C@@H]1CCc2ccccc2N1 ZINC001246353186 972300550 /nfs/dbraw/zinc/30/05/50/972300550.db2.gz QDQHLWMNCZIWBJ-OCCSQVGLSA-N 2 0 247.386 2.001 20 0 BEADRP CCc1ccc(C[C@H](C)[NH2+][C@@H]2CC23C[NH2+]C3)cc1 ZINC001246443976 972316738 /nfs/dbraw/zinc/31/67/38/972316738.db2.gz IWHVKVCLKTWVFH-SWLSCSKDSA-N 2 0 244.382 2.132 20 0 BEADRP Cn1c[nH+]cc1Nc1c[nH+]ccc1N1CCCC1 ZINC001211248073 958113267 /nfs/dbraw/zinc/11/32/67/958113267.db2.gz IPMTVBGKQASOAH-UHFFFAOYSA-N 2 0 243.314 2.159 20 0 BEADRP [NH3+]CCCC[NH2+]CCC[NH2+]C1CCCCCC1 ZINC001246458040 972326841 /nfs/dbraw/zinc/32/68/41/972326841.db2.gz RAVNUWZHIKZNHX-UHFFFAOYSA-N 3 0 241.423 2.017 20 0 BEADRP CC[C@H](CC(C)C)[NH2+]CC[NH2+]C(C)C ZINC001246461283 972335447 /nfs/dbraw/zinc/33/54/47/972335447.db2.gz OONBISMFGFAAGB-GFCCVEGCSA-N 2 0 200.370 2.399 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C[C@@H]2CC[NH2+]C[C@@H]2F)C[C@H]1C ZINC001246475444 972347467 /nfs/dbraw/zinc/34/74/67/972347467.db2.gz FTTNYWKZDGMJSN-RGDJUOJXSA-N 2 0 242.382 2.348 20 0 BEADRP [NH3+]C[C@@H]1C[N@H+](CCC2CCCC2)CCC1(F)F ZINC000403285768 958440922 /nfs/dbraw/zinc/44/09/22/958440922.db2.gz QXPQDCJGLSBYJT-GFCCVEGCSA-N 2 0 246.345 2.483 20 0 BEADRP C[N@H+](CCCCCC[NH3+])CCOC(C)(C)C ZINC000690081271 958581307 /nfs/dbraw/zinc/58/13/07/958581307.db2.gz GNRUYFQHEHHCRF-UHFFFAOYSA-N 2 0 230.396 2.252 20 0 BEADRP C1CC2(CCCC2)[N@@H+]1C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000707652649 958643799 /nfs/dbraw/zinc/64/37/99/958643799.db2.gz YHKSIBZAUCBEBE-FUNVUKJBSA-N 2 0 220.360 2.288 20 0 BEADRP CC[N@H+](C[C@H]1C[C@@H]([NH3+])C1)C1CCCCC1 ZINC000693577247 958868081 /nfs/dbraw/zinc/86/80/81/958868081.db2.gz CPHNKWVFNOONFW-TXEJJXNPSA-N 2 0 210.365 2.378 20 0 BEADRP CC1(C)CCC[N@H+](C[C@H]2C[C@@H]([NH3+])C2)CC1 ZINC000693577751 958868177 /nfs/dbraw/zinc/86/81/77/958868177.db2.gz HCKRFHGTQWTRRE-TXEJJXNPSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@H]1CC[C@H]1[NH2+]CC1(N(C)C)CCCC1 ZINC000309044626 958887515 /nfs/dbraw/zinc/88/75/15/958887515.db2.gz MFAZMKOYNSSASL-NWDGAFQWSA-N 2 0 210.365 2.249 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@]23C[C@H]2CCC3)CC1 ZINC000693619427 959011007 /nfs/dbraw/zinc/01/10/07/959011007.db2.gz KEKIPHMQDNIMLI-OCCSQVGLSA-N 2 0 222.376 2.251 20 0 BEADRP CC1(C)C[C@@H]1[NH2+][C@@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C ZINC000693755310 959268457 /nfs/dbraw/zinc/26/84/57/959268457.db2.gz DYVPEKBFGUIYSW-NOOOWODRSA-N 2 0 222.376 2.151 20 0 BEADRP Cc1c[nH]c(CN2CCC[C@]23CCC[NH2+]C3)c1C ZINC001222242918 972419503 /nfs/dbraw/zinc/41/95/03/972419503.db2.gz HZVVHGYPCRYQKS-HNNXBMFYSA-N 2 0 247.386 2.350 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@H+](C)[C@H]1CCC[C@H](C)C1 ZINC000300357224 959378827 /nfs/dbraw/zinc/37/88/27/959378827.db2.gz WFQNINHMWRBAKM-CRWXNKLISA-N 2 0 224.392 2.352 20 0 BEADRP [NH3+]CC[C@H]1CC[N@H+](C[C@@H]2CCC(F)(F)C2)C1 ZINC000300952081 959388586 /nfs/dbraw/zinc/38/85/86/959388586.db2.gz OKCHGWJKYFRSME-WDEREUQCSA-N 2 0 232.318 2.093 20 0 BEADRP C[C@H]([NH2+][C@H]1C[C@H]([NH3+])C12CCC2)c1cccnc1 ZINC000405254073 959423215 /nfs/dbraw/zinc/42/32/15/959423215.db2.gz LJTYEXWMQXWGAV-DRZSPHRISA-N 2 0 231.343 2.002 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@H]([NH3+])C12CCC2)C1CCCC1 ZINC000405356471 959445287 /nfs/dbraw/zinc/44/52/87/959445287.db2.gz RHXHTQRWDMFCEP-WCFLWFBJSA-N 2 0 222.376 2.425 20 0 BEADRP CC(C)(CC[N@@H+]1CCC[C@H](C[NH3+])C1)C1CC1 ZINC000406084223 959573962 /nfs/dbraw/zinc/57/39/62/959573962.db2.gz YXGIHURWKCSKJD-GFCCVEGCSA-N 2 0 224.392 2.483 20 0 BEADRP C[C@H]1C[NH2+]CCC[C@@H]1OCCCCCCC[NH3+] ZINC001217776059 959587662 /nfs/dbraw/zinc/58/76/62/959587662.db2.gz FDHXIOSMNPRMCX-KBPBESRZSA-N 2 0 242.407 2.300 20 0 BEADRP Cc1cccc2c1CC[C@@H]([N@@H+]1CC[C@@](C)([NH3+])C1)C2 ZINC001246532152 972443672 /nfs/dbraw/zinc/44/36/72/972443672.db2.gz UMHJDLRHOHQENJ-GDBMZVCRSA-N 2 0 244.382 2.275 20 0 BEADRP C[C@@H]1CC([NH2+]C[C@H]2C[C@H]([NH3+])C2)C[C@@H](C)C1 ZINC000719376280 959820281 /nfs/dbraw/zinc/82/02/81/959820281.db2.gz GHVQZSADHVUGSC-BJDJZHNGSA-N 2 0 210.365 2.138 20 0 BEADRP [NH3+]CCCC[N@@H+]1CCCC2(CCCC2)C1 ZINC001222400880 972461868 /nfs/dbraw/zinc/46/18/68/972461868.db2.gz MDCFIVWVZFZKEN-UHFFFAOYSA-N 2 0 210.365 2.382 20 0 BEADRP C[C@H]1C[N@@H+]([C@H]2CCC[C@@H](C)C2)C[C@H]1C[NH3+] ZINC000708829792 959860385 /nfs/dbraw/zinc/86/03/85/959860385.db2.gz HECQLJLNRQBCLU-XQHKEYJVSA-N 2 0 210.365 2.092 20 0 BEADRP C1=C[C@@H]2C[C@H]1C[C@H]2C[N@@H+]1CC[C@]2(C1)CCCC[NH2+]2 ZINC001222422474 972471594 /nfs/dbraw/zinc/47/15/94/972471594.db2.gz VBLWAPXEEVNXIA-FZKCQIBNSA-N 2 0 246.398 2.417 20 0 BEADRP C[C@H]1C[N@@H+]([C@H]2CC[C@@H](C)[C@@H](C)C2)C[C@H]1C[NH3+] ZINC000708870663 959992862 /nfs/dbraw/zinc/99/28/62/959992862.db2.gz MNKURBWAUIAWSS-HTOAHKCRSA-N 2 0 224.392 2.338 20 0 BEADRP C[C@H]1C[N@H+](CCC2CCCCC2)C[C@H]1C[NH3+] ZINC000708887761 960077923 /nfs/dbraw/zinc/07/79/23/960077923.db2.gz YVAMNDZWZCJLHG-GXTWGEPZSA-N 2 0 224.392 2.483 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+]C1CCC(F)(F)CC1 ZINC000925631933 960479537 /nfs/dbraw/zinc/47/95/37/960479537.db2.gz ZBNIRCIQIYPTGL-SNVBAGLBSA-N 2 0 232.318 2.294 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCCOc2ccccc2)CC[NH2+]1 ZINC000709358889 960532724 /nfs/dbraw/zinc/53/27/24/960532724.db2.gz WJKHQLLHHHGBOD-ZIAGYGMSSA-N 2 0 248.370 2.186 20 0 BEADRP C[C@@H]1CCCC[N@@H+]1CCCNc1ccc[n+](C)c1 ZINC001167753315 960542946 /nfs/dbraw/zinc/54/29/46/960542946.db2.gz HDPLSAHAXRMWHG-CQSZACIVSA-N 2 0 248.394 2.188 20 0 BEADRP CC(C)(C)OCCC[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000709464745 960616000 /nfs/dbraw/zinc/61/60/00/960616000.db2.gz VYVKBEROLMATGS-FUNVUKJBSA-N 2 0 240.391 2.064 20 0 BEADRP Cc1c[nH]c(C[NH+]2CCC3(C[NH+](C)C3)CC2)c1C ZINC001140861414 960644032 /nfs/dbraw/zinc/64/40/32/960644032.db2.gz GHURHANGUWFOCP-UHFFFAOYSA-N 2 0 247.386 2.159 20 0 BEADRP [NH3+]CC[C@H]1CC[N@H+](CCCOc2ccccc2)C1 ZINC000125535125 960834468 /nfs/dbraw/zinc/83/44/68/960834468.db2.gz IUMDFRGEPOEWNO-AWEZNQCLSA-N 2 0 248.370 2.126 20 0 BEADRP Nc1[nH+]c2ccccc2n1-c1ccc(C[NH3+])cc1 ZINC000075948104 961174402 /nfs/dbraw/zinc/17/44/02/961174402.db2.gz DHZDVBPVQLRXBO-UHFFFAOYSA-N 2 0 238.294 2.066 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[N@H+](CC)C1COC1 ZINC001167833380 961181773 /nfs/dbraw/zinc/18/17/73/961181773.db2.gz ANOZOSMMZXLVKO-ZDUSSCGKSA-N 2 0 242.407 2.218 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[N@H+](C)C1(C)COC1 ZINC001167838110 961220667 /nfs/dbraw/zinc/22/06/67/961220667.db2.gz QHSAMZVRNIFOCB-CYBMUJFWSA-N 2 0 242.407 2.218 20 0 BEADRP CCc1ccc(C[N@@H+]2CCCC[C@H](C[NH3+])C2)o1 ZINC000310292080 961512437 /nfs/dbraw/zinc/51/24/37/961512437.db2.gz RULWLGZHLAXJPA-GFCCVEGCSA-N 2 0 236.359 2.403 20 0 BEADRP C[NH+](C)CCCCC[NH2+][C@H]1C[C@H]2C[C@H]2C1 ZINC001167894614 961514424 /nfs/dbraw/zinc/51/44/24/961514424.db2.gz PQMNGABRXCAZSA-ITGUQSILSA-N 2 0 210.365 2.106 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@@H]2C[C@H]3C[C@H]3C2)CC1 ZINC001167896321 961524496 /nfs/dbraw/zinc/52/44/96/961524496.db2.gz AZMLENWOPPUPNC-BTTYYORXSA-N 2 0 222.376 2.106 20 0 BEADRP [NH3+]Cc1ccccc1C[NH2+][C@@H]1C[C@H]2C[C@H]2C1 ZINC001167908249 961806025 /nfs/dbraw/zinc/80/60/25/961806025.db2.gz CEVICBIJCOWMKY-BTTYYORXSA-N 2 0 216.328 2.033 20 0 BEADRP C[NH+](C)CC1CC[NH+]([C@@H]2C[C@H]3C[C@H]3C2)CC1 ZINC001167941014 962180346 /nfs/dbraw/zinc/18/03/46/962180346.db2.gz UBSRCFQGKUPLDU-BTTYYORXSA-N 2 0 222.376 2.059 20 0 BEADRP C[C@@H]1CC[C@H]([NH+]2CC3(C2)CCC[NH2+]C3)C[C@@H]1C ZINC000709984280 962210553 /nfs/dbraw/zinc/21/05/53/962210553.db2.gz RHKAKHHIZYEJAX-RDBSUJKOSA-N 2 0 236.403 2.497 20 0 BEADRP CCC(CC)C[NH+]1CC2(C1)CCC[NH2+]C2 ZINC000710016321 962216487 /nfs/dbraw/zinc/21/64/87/962216487.db2.gz QOSIZLJJAYXOQO-UHFFFAOYSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@@H]1CC[NH2+]C[C@@H]1C[NH2+][C@@H]1CCC(C)(C)C1 ZINC000710684565 962439736 /nfs/dbraw/zinc/43/97/36/962439736.db2.gz GPJWPNAURAZYRM-JHJVBQTASA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1CCCC[N@@H+]1C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000710797202 962474561 /nfs/dbraw/zinc/47/45/61/962474561.db2.gz ZWBJYYMCMSTLDQ-FKJOKYEKSA-N 2 0 208.349 2.144 20 0 BEADRP CC[N@H+](C)C1CC[NH+]([C@@H]2C[C@H]3C[C@H]3C2)CC1 ZINC001167947629 962564203 /nfs/dbraw/zinc/56/42/03/962564203.db2.gz CKNGHVYARXIMLR-DABQJJPHSA-N 2 0 222.376 2.201 20 0 BEADRP C[C@@H]1C[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167959899 962843801 /nfs/dbraw/zinc/84/38/01/962843801.db2.gz UMYZOAQTMHNCJC-JHYKVQOGSA-N 2 0 234.387 2.390 20 0 BEADRP Cc1cc(C)[nH+]c(N2C[C@H]3C[C@@]3(C[NH+](C)C)C2)c1 ZINC001156375241 963322759 /nfs/dbraw/zinc/32/27/59/963322759.db2.gz AXMMXIDEVOZZSP-UKRRQHHQSA-N 2 0 245.370 2.086 20 0 BEADRP C[C@@H]1C[N@H+](C[C@@H]2CCC(F)(F)C2)CC[C@@H]1C[NH3+] ZINC000302389069 963365386 /nfs/dbraw/zinc/36/53/86/963365386.db2.gz IZSJTNIPULOJFQ-IJLUTSLNSA-N 2 0 246.345 2.339 20 0 BEADRP C[C@@H]([N@H+](C)C[C@H]1CCCC[NH2+]C1)C1(C)CC1 ZINC000697013839 963640023 /nfs/dbraw/zinc/64/00/23/963640023.db2.gz AIHCYNJVRWHKCY-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)[C@@H](C)[N@H+](C)C[C@@H]1CCCC[NH2+]C1 ZINC000697038388 963666486 /nfs/dbraw/zinc/66/64/86/963666486.db2.gz CJHIPYOXYNVMFA-CHWSQXEVSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H]1C[C@@H](C)[N@H+](C[C@H]2CCCC[NH2+]C2)C1 ZINC000697043521 963668491 /nfs/dbraw/zinc/66/84/91/963668491.db2.gz WPHMLVHMZILBKJ-UPJWGTAASA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)C[N@H+](C[C@H]1CCCC[NH2+]C1)C1CC1 ZINC000697052636 963679932 /nfs/dbraw/zinc/67/99/32/963679932.db2.gz OCJMCKIKYNXZJV-ZDUSSCGKSA-N 2 0 224.392 2.497 20 0 BEADRP CCC1(Nc2[nH+]c(C)cc3[nH]ccc32)C[NH2+]C1 ZINC001157785048 963724543 /nfs/dbraw/zinc/72/45/43/963724543.db2.gz QPAZPJOEPPBIDR-UHFFFAOYSA-N 2 0 230.315 2.035 20 0 BEADRP CCC[N@H+](CCC[NH+](C)C)[C@@H]1CCO[C@H](C)C1 ZINC001168141955 963847499 /nfs/dbraw/zinc/84/74/99/963847499.db2.gz KNPYWDCFKWTLDR-ZIAGYGMSSA-N 2 0 242.407 2.218 20 0 BEADRP CCOc1cc[nH+]c(NCC[C@H]2CCC[NH2+]2)c1 ZINC001158627100 963894848 /nfs/dbraw/zinc/89/48/48/963894848.db2.gz DWECFZYVPYAWHL-LLVKDONJSA-N 2 0 235.331 2.034 20 0 BEADRP Cc1c[nH+]c(NCC[C@H]2CCC[NH2+]2)cc1C ZINC001158626784 963896722 /nfs/dbraw/zinc/89/67/22/963896722.db2.gz BPBQRUPIGABKSY-GFCCVEGCSA-N 2 0 219.332 2.252 20 0 BEADRP Cc1[nH]c2ccc(NC3(C)CC[NH2+]CC3)cc2[nH+]1 ZINC001168187480 963946926 /nfs/dbraw/zinc/94/69/26/963946926.db2.gz RAHBYGOUWREPOQ-UHFFFAOYSA-N 2 0 244.342 2.425 20 0 BEADRP CC(C)(C[NH3+])c1ccc(NC2=CCC[NH2+]C2)cc1 ZINC001159579882 964124121 /nfs/dbraw/zinc/12/41/21/964124121.db2.gz JTSGTAIODMJHBT-UHFFFAOYSA-N 2 0 245.370 2.212 20 0 BEADRP [NH3+]CCc1cccc(NC2=C[C@H]3CC[C@@H](C2)[NH2+]3)c1 ZINC001159671746 964145572 /nfs/dbraw/zinc/14/55/72/964145572.db2.gz GFMGTWZWZJQIFH-KGLIPLIRSA-N 2 0 243.354 2.008 20 0 BEADRP [NH3+]C1(c2ccc(NC3=CCC[NH2+]C3)cc2)CCC1 ZINC001159731013 964167470 /nfs/dbraw/zinc/16/74/70/964167470.db2.gz UVHDTTOPNBELBJ-UHFFFAOYSA-N 2 0 243.354 2.314 20 0 BEADRP Cc1[nH+]c(NCC[C@@H](C)[NH3+])cc2[nH]ccc21 ZINC001159778236 964190866 /nfs/dbraw/zinc/19/08/66/964190866.db2.gz JEHQSFREMYRKFL-MRVPVSSYSA-N 2 0 218.304 2.021 20 0 BEADRP c1cc2c[nH+]c(NC[C@@H]3CCCC[NH2+]3)cc2[nH]1 ZINC001160145197 964253743 /nfs/dbraw/zinc/25/37/43/964253743.db2.gz OPHRGMDDSYZQLU-NSHDSACASA-N 2 0 230.315 2.117 20 0 BEADRP C[NH+](C)C1CCC([N@H+](C)Cc2cccnc2)CC1 ZINC001168314262 964421274 /nfs/dbraw/zinc/42/12/74/964421274.db2.gz AGGASXFHSDWHMR-UHFFFAOYSA-N 2 0 247.386 2.386 20 0 BEADRP CC(C)[NH+]1CC(Nc2cc[nH+]c(C3CC3)c2)C1 ZINC001168317641 964434715 /nfs/dbraw/zinc/43/47/15/964434715.db2.gz PXTZSBINIBMQGB-UHFFFAOYSA-N 2 0 231.343 2.464 20 0 BEADRP CCOc1cc[nH+]c(NCC[C@H]2CCC[N@@H+]2C)c1 ZINC001160963110 964454358 /nfs/dbraw/zinc/45/43/58/964454358.db2.gz ALPPZEXIRZTVLU-GFCCVEGCSA-N 2 0 249.358 2.377 20 0 BEADRP Cc1cc2ccccc2c(NC/C=C/C[NH3+])[nH+]1 ZINC001160982656 964466538 /nfs/dbraw/zinc/46/65/38/964466538.db2.gz HDKVRMGQPVFXOK-SNAWJCMRSA-N 2 0 227.311 2.470 20 0 BEADRP C[C@H](C[NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2)CC(F)F ZINC000697705837 964502199 /nfs/dbraw/zinc/50/21/99/964502199.db2.gz DCXNBXSLJVUXRW-IVZWLZJFSA-N 2 0 232.318 2.137 20 0 BEADRP CC[C@@H]([NH2+]CC[C@@H](C)[NH+](C)C)C1CCC1 ZINC000697824826 964545347 /nfs/dbraw/zinc/54/53/47/964545347.db2.gz MGNANTMEDBIDTH-DGCLKSJQSA-N 2 0 212.381 2.495 20 0 BEADRP C[C@H](CC[NH2+][C@H]1CCC(C)(C)C1)[NH+](C)C ZINC000697879254 964604455 /nfs/dbraw/zinc/60/44/55/964604455.db2.gz NEGORBXNZKGEKB-NEPJUHHUSA-N 2 0 212.381 2.495 20 0 BEADRP c1ccc([C@@H]2C[C@H]2[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000149714348 964614115 /nfs/dbraw/zinc/61/41/15/964614115.db2.gz OOUPHCVQCFQHLO-BLNMRFBMSA-N 2 0 242.366 2.415 20 0 BEADRP CC[NH+](CC)C[C@@H](C)OCCC[NH+]1CCCC1 ZINC001224745227 964916789 /nfs/dbraw/zinc/91/67/89/964916789.db2.gz YZFHTQHOBPKHCL-CQSZACIVSA-N 2 0 242.407 2.219 20 0 BEADRP [NH3+][C@H]1CCC[C@H](Nc2c[nH+]cc3cc[nH]c32)C1 ZINC001162396448 964955993 /nfs/dbraw/zinc/95/59/93/964955993.db2.gz JJMOZTVQHVQLDO-QWRGUYRKSA-N 2 0 230.315 2.245 20 0 BEADRP [NH3+][C@H]1CCc2c1cccc2N[C@@H]1CCC[C@@H]([NH3+])C1 ZINC001162404764 964963895 /nfs/dbraw/zinc/96/38/95/964963895.db2.gz QNAJFPMAUQWCNZ-GYSYKLTISA-N 2 0 245.370 2.314 20 0 BEADRP Cn1ccc2c1[nH+]ccc2N[C@@H]1CCC[C@H]([NH3+])C1 ZINC001162405698 964965809 /nfs/dbraw/zinc/96/58/09/964965809.db2.gz WUQCXSYDBXOSEL-WDEREUQCSA-N 2 0 244.342 2.255 20 0 BEADRP Cc1c[nH+]c(Nc2ccc(C[NH3+])c(F)c2)cc1N ZINC001162529172 965026429 /nfs/dbraw/zinc/02/64/29/965026429.db2.gz WPKALINTOFQIBN-UHFFFAOYSA-N 2 0 246.289 2.314 20 0 BEADRP C[C@@H]1C[C@@H](CNc2ccc(C3([NH3+])CC3)cc2)C[NH2+]1 ZINC001162556442 965046338 /nfs/dbraw/zinc/04/63/38/965046338.db2.gz CXCPBNZPVGEENA-VXGBXAGGSA-N 2 0 245.370 2.044 20 0 BEADRP Cc1[nH]c2ccc(NC[C@H]3C[NH2+][C@H](C)C3)cc2[nH+]1 ZINC001162557444 965048651 /nfs/dbraw/zinc/04/86/51/965048651.db2.gz GPBQLBNIRGFLFM-MWLCHTKSSA-N 2 0 244.342 2.281 20 0 BEADRP Cc1cccnc1NC[C@@]1(F)CCCC[NH2+]C1 ZINC001162574252 965053070 /nfs/dbraw/zinc/05/30/70/965053070.db2.gz XAVQNQDUSFYMNL-CYBMUJFWSA-N 2 0 237.322 2.284 20 0 BEADRP [NH3+][C@@H]1Cc2ccccc2N(c2cc[nH+]cc2)C1 ZINC001162841655 965192420 /nfs/dbraw/zinc/19/24/20/965192420.db2.gz LGQYHPOIVASWJW-GFCCVEGCSA-N 2 0 225.295 2.103 20 0 BEADRP c1ccc(C2C[NH+](CC3CC[NH2+]CC3)C2)cc1 ZINC000093963573 965204157 /nfs/dbraw/zinc/20/41/57/965204157.db2.gz GWKQEIFHCZRCOF-UHFFFAOYSA-N 2 0 230.355 2.085 20 0 BEADRP [NH3+]CC1CC([NH2+]C[C@H]2CCc3ccccc32)C1 ZINC001120370972 965282906 /nfs/dbraw/zinc/28/29/06/965282906.db2.gz LLTZQYWRCRXPRC-HRDQMINSSA-N 2 0 230.355 2.043 20 0 BEADRP c1cc(N[C@H]2CC[C@@H]3C[NH2+]C[C@@H]32)cc(C2CC2)[nH+]1 ZINC001163268085 965323686 /nfs/dbraw/zinc/32/36/86/965323686.db2.gz AELZMUNZEFJWIK-XBFCOCLRSA-N 2 0 243.354 2.369 20 0 BEADRP Cc1cc(C)[nH+]c(N(C)CCC[NH+](C)C)c1 ZINC001163595104 965473267 /nfs/dbraw/zinc/47/32/67/965473267.db2.gz BJOLZYNGETWWHS-UHFFFAOYSA-N 2 0 221.348 2.086 20 0 BEADRP [NH3+][C@H]1CCC[N@H+](C[C@H]2C[C@H]3C=C[C@@H]2C3)CC1 ZINC001205094179 965726547 /nfs/dbraw/zinc/72/65/47/965726547.db2.gz JZCNXXCZYYAIRK-DGAVXFQQSA-N 2 0 220.360 2.012 20 0 BEADRP Cc1cc[nH+]c(N(CCC[NH3+])C(C)C)c1C ZINC001164122260 965743680 /nfs/dbraw/zinc/74/36/80/965743680.db2.gz BENPTPKTMSTVNA-UHFFFAOYSA-N 2 0 221.348 2.262 20 0 BEADRP Cc1cc2[nH+]ccn2cc1N(CCC[NH3+])C(C)C ZINC001164126636 965750268 /nfs/dbraw/zinc/75/02/68/965750268.db2.gz BNEKLAADQAOKMS-UHFFFAOYSA-N 2 0 246.358 2.206 20 0 BEADRP [NH3+][C@H]1CCC[N@H+](Cc2cc3ccccc3[nH]2)CC1 ZINC001205101194 965801386 /nfs/dbraw/zinc/80/13/86/965801386.db2.gz BFYXYLSSWRTQPA-ZDUSSCGKSA-N 2 0 243.354 2.481 20 0 BEADRP C(C[N@@H+]1CC[C@@H]2C[C@@H]2C1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000699265293 965829265 /nfs/dbraw/zinc/82/92/65/965829265.db2.gz IEJPUDIGWNIMFR-CVFKAICRSA-N 2 0 234.387 2.249 20 0 BEADRP CNc1ccccc1C[N@@H+]1CCC[C@H]([NH3+])CC1 ZINC001205117806 965871721 /nfs/dbraw/zinc/87/17/21/965871721.db2.gz VWZXVFWTFFKKHO-ZDUSSCGKSA-N 2 0 233.359 2.042 20 0 BEADRP C[C@H]1CC[C@H](C[NH3+])CN1c1[nH+]ccc2[nH]ccc21 ZINC001164456855 965891034 /nfs/dbraw/zinc/89/10/34/965891034.db2.gz TUYOITFPQGEGCK-WDEREUQCSA-N 2 0 244.342 2.127 20 0 BEADRP Cc1ccc(CCC[N@H+]2C[C@H](C)[C@H](C[NH3+])C2)o1 ZINC001205131233 965936081 /nfs/dbraw/zinc/93/60/81/965936081.db2.gz VFWKKSREMYCPGN-WCQYABFASA-N 2 0 236.359 2.047 20 0 BEADRP C[C@H]1C[C@H]([NH3+])CN(Cc2cccc3c2CCC3)C1 ZINC001236052304 966255530 /nfs/dbraw/zinc/25/55/30/966255530.db2.gz PYSVZUZMDRQCMR-WFASDCNBSA-N 2 0 244.382 2.344 20 0 BEADRP CC(C)[NH+]1CCC(CNc2ccc[n+](C)c2)CC1 ZINC001166635411 966344497 /nfs/dbraw/zinc/34/44/97/966344497.db2.gz DARFQCFZLKNSMC-UHFFFAOYSA-N 2 0 248.394 2.043 20 0 BEADRP C[NH+]1CCC2(C[NH+](Cc3ccccc3F)C2)CC1 ZINC001203357324 966612367 /nfs/dbraw/zinc/61/23/67/966612367.db2.gz KMLHCJGUQJIRDD-UHFFFAOYSA-N 2 0 248.345 2.353 20 0 BEADRP Cc1ccc2c(CN(C)C[C@H](C)[NH3+])c[nH]c2c1 ZINC001236885886 966615442 /nfs/dbraw/zinc/61/54/42/966615442.db2.gz WVMZCTPXGPLMNM-NSHDSACASA-N 2 0 231.343 2.255 20 0 BEADRP C[C@@H](Cc1cccc(F)c1)[NH2+]CCCC[NH3+] ZINC000162531835 966768894 /nfs/dbraw/zinc/76/88/94/966768894.db2.gz JJYSLOQEHKATBQ-NSHDSACASA-N 2 0 224.323 2.085 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@@H]([NH2+]CC3(C)CCC3)[C@H]2C1 ZINC001204089351 966890713 /nfs/dbraw/zinc/89/07/13/966890713.db2.gz MGVNUHXCBGEYHC-RWMBFGLXSA-N 2 0 222.376 2.106 20 0 BEADRP CCC1(Nc2ccccc2C(C)(C)[NH3+])C[NH2+]C1 ZINC001168582052 966921123 /nfs/dbraw/zinc/92/11/23/966921123.db2.gz GOGUSJMVYHFJKQ-UHFFFAOYSA-N 2 0 233.359 2.044 20 0 BEADRP CCC1(Nc2ccc([C@H]3CCC[NH2+]3)cc2)C[NH2+]C1 ZINC001168582937 966925700 /nfs/dbraw/zinc/92/57/00/966925700.db2.gz DSFQIJWUAQVXJA-CQSZACIVSA-N 2 0 245.370 2.275 20 0 BEADRP CCC1(Nc2ccc3[nH]c(C)[nH+]c3c2)C[NH2+]C1 ZINC001168583163 966927315 /nfs/dbraw/zinc/92/73/15/966927315.db2.gz HHEHEJKPWPJWLN-UHFFFAOYSA-N 2 0 230.315 2.035 20 0 BEADRP CCC1(Nc2ccc([C@@H]3CCC[NH2+]3)cc2)C[NH2+]C1 ZINC001168582936 966927914 /nfs/dbraw/zinc/92/79/14/966927914.db2.gz DSFQIJWUAQVXJA-AWEZNQCLSA-N 2 0 245.370 2.275 20 0 BEADRP C[NH+](C)Cc1ccc(-c2cc(C[NH3+])ccn2)cc1 ZINC001204598172 967097348 /nfs/dbraw/zinc/09/73/48/967097348.db2.gz RWCGUMZAROWXRY-UHFFFAOYSA-N 2 0 241.338 2.269 20 0 BEADRP C/C=C(\NC=[NH2+])c1ccc(C[NH+](C)C)cc1 ZINC001204606569 967105144 /nfs/dbraw/zinc/10/51/44/967105144.db2.gz MICJIAOTWRZMOC-PQMHYQBVSA-N 2 0 217.316 2.306 20 0 BEADRP C[NH+](C)C1CCC(NC(=[NH2+])C(C)(C)C)CC1 ZINC000715541851 967154157 /nfs/dbraw/zinc/15/41/57/967154157.db2.gz JHVLPNYJZCXQKZ-UHFFFAOYSA-N 2 0 225.380 2.472 20 0 BEADRP [NH3+]CC1CC[NH+](Cc2cccc3[nH]ccc32)CC1 ZINC001205033361 967220606 /nfs/dbraw/zinc/22/06/06/967220606.db2.gz CPWGXFCWXHUKFU-UHFFFAOYSA-N 2 0 243.354 2.339 20 0 BEADRP COc1ccc(C)c(C[NH+]2CCC(C[NH3+])CC2)c1 ZINC001205053025 967309496 /nfs/dbraw/zinc/30/94/96/967309496.db2.gz HBHDTYICTOZHNM-UHFFFAOYSA-N 2 0 248.370 2.174 20 0 BEADRP C[C@H]1CC[C@@H](C[NH3+])N1CCc1ccc(F)cc1 ZINC001205058928 967312280 /nfs/dbraw/zinc/31/22/80/967312280.db2.gz YQLPHMOUMMRSCY-FZMZJTMJSA-N 2 0 236.334 2.180 20 0 BEADRP [NH3+][C@H]1CCC[N@H+](CCc2cccs2)CC1 ZINC001205093765 967338815 /nfs/dbraw/zinc/33/88/15/967338815.db2.gz FWCWPMWNJQZIIK-NSHDSACASA-N 2 0 224.373 2.104 20 0 BEADRP Cc1cc(C[N@@H+]2CCC[C@H]([NH3+])CC2)cc(C)c1O ZINC001205109157 967351637 /nfs/dbraw/zinc/35/16/37/967351637.db2.gz BREWFHNQDBEIHN-AWEZNQCLSA-N 2 0 248.370 2.322 20 0 BEADRP Cc1cc(C[N@@H+]2CCC[C@H]([NH3+])CC2)cnc1C ZINC001205117105 967365629 /nfs/dbraw/zinc/36/56/29/967365629.db2.gz KSMIRLYDGLJKHM-AWEZNQCLSA-N 2 0 233.359 2.012 20 0 BEADRP C[C@H]1C[N@H+](Cc2cccc3occc32)C[C@H]1C[NH3+] ZINC001205150729 967394465 /nfs/dbraw/zinc/39/44/65/967394465.db2.gz IWXHZWFWKBNALR-WCQYABFASA-N 2 0 244.338 2.459 20 0 BEADRP COc1cc(C)c(CN2CC[C@@H]([NH3+])[C@H]2C)c(C)c1 ZINC001205189966 967418185 /nfs/dbraw/zinc/41/81/85/967418185.db2.gz IWILYAGMPMOAPU-IUODEOHRSA-N 2 0 248.370 2.234 20 0 BEADRP C[C@@]1([NH3+])CCC[N@H+](CC2CCCC2)CC1 ZINC001205255085 967441126 /nfs/dbraw/zinc/44/11/26/967441126.db2.gz GJYSUNJZJUGJOC-CYBMUJFWSA-N 2 0 210.365 2.380 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@@](C)([NH3+])CC2)o1 ZINC001205255141 967445181 /nfs/dbraw/zinc/44/51/81/967445181.db2.gz HHOAHIISZDWRLB-CYBMUJFWSA-N 2 0 222.332 2.291 20 0 BEADRP CCC(=O)C(C)(C)C[N@@H+]1CCC[C@@](C)([NH3+])CC1 ZINC001205256829 967447137 /nfs/dbraw/zinc/44/71/37/967447137.db2.gz QMTRJWYXBMMASJ-CQSZACIVSA-N 2 0 240.391 2.195 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@](C)([NH3+])CC2)[nH]1 ZINC001205265256 967454872 /nfs/dbraw/zinc/45/48/72/967454872.db2.gz PCZMFBVRGYZMGH-ZDUSSCGKSA-N 2 0 221.348 2.026 20 0 BEADRP C[NH+](C)Cc1ccc(CC[NH+]2CCCC2)cc1 ZINC001250167071 967465987 /nfs/dbraw/zinc/46/59/87/967465987.db2.gz ZCAUYUMTMAEPMD-UHFFFAOYSA-N 2 0 232.371 2.387 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@@](C)([NH3+])CC2)cn1 ZINC001205273243 967467579 /nfs/dbraw/zinc/46/75/79/967467579.db2.gz IQATYQCDYIWKKV-CQSZACIVSA-N 2 0 233.359 2.093 20 0 BEADRP Cc1c(O)cccc1C[N@@H+]1CCC[C@@](C)([NH3+])CC1 ZINC001205280898 967469851 /nfs/dbraw/zinc/46/98/51/967469851.db2.gz LGUZZPCNHRESSR-OAHLLOKOSA-N 2 0 248.370 2.404 20 0 BEADRP Cc1cnsc1C[N@@H+]1CCC[C@@](C)([NH3+])CC1 ZINC001205288352 967484724 /nfs/dbraw/zinc/48/47/24/967484724.db2.gz JIXOEHNATXLRPE-GFCCVEGCSA-N 2 0 239.388 2.155 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@H]2C[C@H]3C=C[C@@H]2C3)C[C@H]1C[NH3+] ZINC001205297123 967498783 /nfs/dbraw/zinc/49/87/83/967498783.db2.gz ZKBTVZOWGRVMSJ-XLWJZTARSA-N 2 0 234.387 2.115 20 0 BEADRP CC[C@@H](C)C[N@@H+]1CCC[C@](F)(C[NH3+])CC1 ZINC001205536733 967667943 /nfs/dbraw/zinc/66/79/43/967667943.db2.gz ACXRJZMQXDUUDS-VXGBXAGGSA-N 2 0 216.344 2.185 20 0 BEADRP CC(C)CC[N@@H+]1CCC[C@](F)(C[NH3+])CC1 ZINC001205537482 967668127 /nfs/dbraw/zinc/66/81/27/967668127.db2.gz HMDGCXQWFUXJFB-GFCCVEGCSA-N 2 0 216.344 2.185 20 0 BEADRP C[C@H]1CC[N@H+](Cc2ccco2)CC[C@@H]1C[NH3+] ZINC001205601951 967716693 /nfs/dbraw/zinc/71/66/93/967716693.db2.gz HCMMXMUGGXKSRQ-NWDGAFQWSA-N 2 0 222.332 2.086 20 0 BEADRP Cc1cc(C[N@H+]2CC[C@@H](C)[C@@H](C[NH3+])CC2)ccn1 ZINC001205617567 967723964 /nfs/dbraw/zinc/72/39/64/967723964.db2.gz KZNMVPWQPNSPCK-IUODEOHRSA-N 2 0 247.386 2.197 20 0 BEADRP Cc1cc(C[N@H+]2CC[C@H](C)[C@@H](C[NH3+])CC2)ccn1 ZINC001205617568 967729728 /nfs/dbraw/zinc/72/97/28/967729728.db2.gz KZNMVPWQPNSPCK-SWLSCSKDSA-N 2 0 247.386 2.197 20 0 BEADRP CCC(F)(F)CN(C)CCCCCC[NH3+] ZINC000701292274 967809538 /nfs/dbraw/zinc/80/95/38/967809538.db2.gz VHVQFHZZLGMNGE-UHFFFAOYSA-N 2 0 222.323 2.483 20 0 BEADRP CCO[C@H]1CC[N@H+](CCCCCCC[NH3+])C1 ZINC000701754281 967818220 /nfs/dbraw/zinc/81/82/20/967818220.db2.gz WCVQJRWDNWEXRM-ZDUSSCGKSA-N 2 0 228.380 2.006 20 0 BEADRP Cc1cc[nH+]c(N[C@@H]2CCC[C@@H]([NH3+])C2)c1C ZINC001162390943 967821978 /nfs/dbraw/zinc/82/19/78/967821978.db2.gz KCNYTORFAPBCGN-VXGBXAGGSA-N 2 0 219.332 2.380 20 0 BEADRP C[C@@H]1[C@@H](C[NH3+])CCC[N@@H+]1CCC(C)(C)C ZINC001205902204 967874595 /nfs/dbraw/zinc/87/45/95/967874595.db2.gz IPVCJWQKXORWNY-VXGBXAGGSA-N 2 0 212.381 2.482 20 0 BEADRP CCCCC[N@@H+]1CCC[C@H](C[NH3+])[C@@H](C)C1 ZINC001205984688 967928099 /nfs/dbraw/zinc/92/80/99/967928099.db2.gz UEBGOAMDNHBMQM-QWHCGFSZSA-N 2 0 212.381 2.483 20 0 BEADRP CCOC(C)(C)C[N@@H+]1CCC[C@@H](C[NH3+])[C@H](C)C1 ZINC001205982591 967928607 /nfs/dbraw/zinc/92/86/07/967928607.db2.gz MMAPRRONMHICOK-OLZOCXBDSA-N 2 0 242.407 2.108 20 0 BEADRP Cc1cccnc1C[N@@H+]1CCC[C@@H](C[NH3+])[C@@H](C)C1 ZINC001205996547 967953158 /nfs/dbraw/zinc/95/31/58/967953158.db2.gz XEXVYGVTGIQLPQ-KBPBESRZSA-N 2 0 247.386 2.197 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@H](C[NH3+])[C@@H](C)C2)nc1 ZINC001206003768 967955124 /nfs/dbraw/zinc/95/51/24/967955124.db2.gz MKJKRTVFOPQJDG-UONOGXRCSA-N 2 0 247.386 2.197 20 0 BEADRP Cc1c[nH]c(C[N@@H+]2CCC[C@@H](C[NH3+])[C@H](C)C2)c1C ZINC001206004360 967957122 /nfs/dbraw/zinc/95/71/22/967957122.db2.gz RWSGPBFJRVLWJX-OCCSQVGLSA-N 2 0 249.402 2.438 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@@H](C[NH3+])[C@H](C)C2)cn1 ZINC001206003526 967961929 /nfs/dbraw/zinc/96/19/29/967961929.db2.gz IZYZPZBPWCOLCK-DOMZBBRYSA-N 2 0 247.386 2.197 20 0 BEADRP CCCC[C@@H](C)[NH2+]CC[C@H](C)[NH+](C)C ZINC000697868671 968142889 /nfs/dbraw/zinc/14/28/89/968142889.db2.gz CKOTXFUXPXHAKE-NEPJUHHUSA-N 2 0 200.370 2.495 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H](C)Cc1ccccc1F ZINC001331820921 968245474 /nfs/dbraw/zinc/24/54/74/968245474.db2.gz KMUBDWGWYYVBDS-VXGBXAGGSA-N 2 0 238.350 2.344 20 0 BEADRP Cc1ccncc1C[N@@H+]1CCCC[C@](C)(C[NH3+])C1 ZINC001206554546 968381545 /nfs/dbraw/zinc/38/15/45/968381545.db2.gz FCXSXAWZTOHNRK-OAHLLOKOSA-N 2 0 247.386 2.341 20 0 BEADRP Cc1c[nH]c(C[N@@H+]2CCCC[C@H](C[NH3+])C2)c1C ZINC001206623289 968422832 /nfs/dbraw/zinc/42/28/32/968422832.db2.gz KWBCQLUSHKCQMK-CYBMUJFWSA-N 2 0 235.375 2.192 20 0 BEADRP CCCC[C@@H](O)C[NH2+]CCCC[NH+]1CCCC1 ZINC001252108127 968588743 /nfs/dbraw/zinc/58/87/43/968588743.db2.gz KPZNSUCJEYLGJX-CQSZACIVSA-N 2 0 242.407 2.003 20 0 BEADRP C[NH+](C)CC(C)(C)C[N@@H+]1CCC[C@@H](F)CC1 ZINC001207275222 968705482 /nfs/dbraw/zinc/70/54/82/968705482.db2.gz KHERJZPFYGQGIC-GFCCVEGCSA-N 2 0 230.371 2.398 20 0 BEADRP C[NH+](C)CC(C)(C)C[N@H+](CC1CC1)C1CC1 ZINC001207287414 968715392 /nfs/dbraw/zinc/71/53/92/968715392.db2.gz DLWFPBLKMGAGOD-UHFFFAOYSA-N 2 0 224.392 2.449 20 0 BEADRP C[NH+](C)CC(C)(C)C[N@H+]1C[C@@H]2[C@H](C1)C2(C)C ZINC001207283487 968717476 /nfs/dbraw/zinc/71/74/76/968717476.db2.gz ZGJAZOPMUWBIBA-TXEJJXNPSA-N 2 0 224.392 2.162 20 0 BEADRP C[NH+](C)CC(C)(C)C[N@H+](C)C1CCCC1 ZINC001207287136 968717892 /nfs/dbraw/zinc/71/78/92/968717892.db2.gz YEQUGPBPCRAMEN-UHFFFAOYSA-N 2 0 212.381 2.449 20 0 BEADRP CC(C)O[C@@H]1CC[N@H+](CC(C)(C)C[NH+](C)C)C1 ZINC001207282903 968719052 /nfs/dbraw/zinc/71/90/52/968719052.db2.gz QMJMXAJPUANYCY-CYBMUJFWSA-N 2 0 242.407 2.074 20 0 BEADRP CC[C@@H]1CCC[N@@H+]1CC(C)(C)C[NH+](C)C ZINC001207286402 968720020 /nfs/dbraw/zinc/72/00/20/968720020.db2.gz RANHSUUFQIQTLV-GFCCVEGCSA-N 2 0 212.381 2.449 20 0 BEADRP C[C@@H]1CC[N@H+](CC2CC[NH+](C)CC2)C[C@H]1F ZINC001207392013 968746702 /nfs/dbraw/zinc/74/67/02/968746702.db2.gz SWWBETSVDJVKFP-DGCLKSJQSA-N 2 0 228.355 2.008 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2CCCCC23CC3)CC1 ZINC001207398571 968753342 /nfs/dbraw/zinc/75/33/42/968753342.db2.gz AMIHZQWONKJHRB-UHFFFAOYSA-N 2 0 222.376 2.347 20 0 BEADRP C[NH+]1CCC(CC[N@@H+]2C[C@@H]3C[C@H]2C[C@H]3F)CC1 ZINC001207485728 968797919 /nfs/dbraw/zinc/79/79/19/968797919.db2.gz XIEPTVIBJICQPH-MELADBBJSA-N 2 0 240.366 2.151 20 0 BEADRP CC(C)[C@@H]1CCC[N@@H+]1C[C@H]1CCCC[NH2+]C1 ZINC000829274388 968824895 /nfs/dbraw/zinc/82/48/95/968824895.db2.gz DCHQHNYNBPYUFW-KBPBESRZSA-N 2 0 224.392 2.497 20 0 BEADRP [NH3+][C@@H]1CCC[C@H](Nc2cc3[nH]ccc3c[nH+]2)C1 ZINC001154978354 968831372 /nfs/dbraw/zinc/83/13/72/968831372.db2.gz RILGWHWCORXFIX-MNOVXSKESA-N 2 0 230.315 2.245 20 0 BEADRP C[NH+]1CCC2(C[NH+](C[C@@H]3C[C@H]4C=C[C@@H]3C4)C2)CC1 ZINC001207631386 968848005 /nfs/dbraw/zinc/84/80/05/968848005.db2.gz GYYVZYNJYMNONL-ZNMIVQPWSA-N 2 0 246.398 2.226 20 0 BEADRP C[NH+]1CCC2(C[NH+](C[C@H]3C[C@H]4C=C[C@@H]3C4)C2)CC1 ZINC001207631382 968848345 /nfs/dbraw/zinc/84/83/45/968848345.db2.gz GYYVZYNJYMNONL-RRFJBIMHSA-N 2 0 246.398 2.226 20 0 BEADRP Cc1c[nH+]c(NC[C@H]2CCC[NH2+]C[C@H]2C)cc1N ZINC001155034958 968859085 /nfs/dbraw/zinc/85/90/85/968859085.db2.gz ZHXBCUATWJAZLR-ZYHUDNBSSA-N 2 0 248.374 2.020 20 0 BEADRP CC[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)C2CC2)C1 ZINC000165277794 968868444 /nfs/dbraw/zinc/86/84/44/968868444.db2.gz HZTREZVDQLQLLN-NWDGAFQWSA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+][C@H]1C[C@H]([NH3+])C12CCC2 ZINC000404521624 968897093 /nfs/dbraw/zinc/89/70/93/968897093.db2.gz PVVWTCOOLKXBAL-BJDJZHNGSA-N 2 0 210.365 2.281 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]CCCC(F)(F)F)C12CCC2 ZINC000405226228 968966526 /nfs/dbraw/zinc/96/65/26/968966526.db2.gz DEMQUCSPXNJCKQ-BDAKNGLRSA-N 2 0 236.281 2.188 20 0 BEADRP C[N@H+](Cc1ccncc1)CC1(C)CC[NH+](C)CC1 ZINC001208108081 969000330 /nfs/dbraw/zinc/00/03/30/969000330.db2.gz PPOKAONGQHRYRB-UHFFFAOYSA-N 2 0 247.386 2.245 20 0 BEADRP C[NH+]1CCC(C)(C[NH+]2C[C@H]3CCC[C@@H]3C2)CC1 ZINC001208102316 969003782 /nfs/dbraw/zinc/00/37/82/969003782.db2.gz DRPAIIVMDUHELG-ZIAGYGMSSA-N 2 0 236.403 2.450 20 0 BEADRP CC[C@@H]1CC[N@H+](CC2(C)CC[NH+](C)CC2)C1 ZINC001208116251 969009770 /nfs/dbraw/zinc/00/97/70/969009770.db2.gz SRULZOMRSPLAID-CYBMUJFWSA-N 2 0 224.392 2.450 20 0 BEADRP CS[C@H](C)CCN1CC[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001208154752 969076586 /nfs/dbraw/zinc/07/65/86/969076586.db2.gz NREOALQGIJAPMM-UPJWGTAASA-N 2 0 242.432 2.297 20 0 BEADRP C[NH+](C)CC1(C[NH+]2CCCC2)CCCC1 ZINC001208182498 969114252 /nfs/dbraw/zinc/11/42/52/969114252.db2.gz YISKGGZUWUNICG-UHFFFAOYSA-N 2 0 210.365 2.204 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]C/C=C/C2CC2)CC1 ZINC000378788257 969144476 /nfs/dbraw/zinc/14/44/76/969144476.db2.gz LAYQEHIFJHBILA-ONEGZZNKSA-N 2 0 222.376 2.415 20 0 BEADRP C[C@H]1CCC[N@H+](C[C@H]2CCC[NH+](C)C2)CC1 ZINC001208608484 969146969 /nfs/dbraw/zinc/14/69/69/969146969.db2.gz UFHROKJUYYZTTE-KBPBESRZSA-N 2 0 224.392 2.450 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2C[C@@H]3C[C@H]2C[C@H]3F)CC1 ZINC001208599605 969149996 /nfs/dbraw/zinc/14/99/96/969149996.db2.gz ILVCRDHPZJGQDP-MELADBBJSA-N 2 0 240.366 2.151 20 0 BEADRP CC[C@H](C)[N@H+](C)CC1CC[NH+](CC)CC1 ZINC001208596541 969150530 /nfs/dbraw/zinc/15/05/30/969150530.db2.gz RTCGKZKNKWHEBU-LBPRGKRZSA-N 2 0 212.381 2.449 20 0 BEADRP CC[N@H+](CC1CC[NH+](CC)CC1)C(C)C ZINC001208595486 969152016 /nfs/dbraw/zinc/15/20/16/969152016.db2.gz USBLTDHTMRBEQV-UHFFFAOYSA-N 2 0 212.381 2.449 20 0 BEADRP CC[NH+]1CCC(C[NH+]2C[C@H]3CCC[C@@H]3C2)CC1 ZINC001208594873 969152493 /nfs/dbraw/zinc/15/24/93/969152493.db2.gz OWUCCDBHNKTVKM-HUUCEWRRSA-N 2 0 236.403 2.450 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH+]2CC[C@H]3CCC[C@@H]3C2)C1 ZINC001208605178 969158948 /nfs/dbraw/zinc/15/89/48/969158948.db2.gz AJMCXDZMFNZIRN-RRFJBIMHSA-N 2 0 236.403 2.450 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH+]2CC3CCC(CC3)C2)C1 ZINC001208615554 969167834 /nfs/dbraw/zinc/16/78/34/969167834.db2.gz HXSDZIQULRLTQS-YMAMQOFZSA-N 2 0 236.403 2.450 20 0 BEADRP CCCCC[C@H](O)C[NH2+]CCC[NH+]1CCCC1 ZINC001253517120 969196651 /nfs/dbraw/zinc/19/66/51/969196651.db2.gz DLGOXIFNOPQFCQ-AWEZNQCLSA-N 2 0 242.407 2.003 20 0 BEADRP Cc1cc(C[N@@H+]2CCC[C@@H](C[NH3+])[C@@H](C)C2)ccn1 ZINC001205991632 969211664 /nfs/dbraw/zinc/21/16/64/969211664.db2.gz BCMLJZUQJNZGKH-WFASDCNBSA-N 2 0 247.386 2.197 20 0 BEADRP CCCCC[C@@H](O)C[NH2+][C@H]1CCC[N@H+](C)CC1 ZINC001253549801 969221805 /nfs/dbraw/zinc/22/18/05/969221805.db2.gz GCEBBQNWXWIKLB-UONOGXRCSA-N 2 0 242.407 2.002 20 0 BEADRP Cc1ccnc(C[N@@H+]2CCC[C@H](C[NH3+])[C@H](C)C2)c1 ZINC001205994406 969254427 /nfs/dbraw/zinc/25/44/27/969254427.db2.gz LJYSWOTUGOTCTE-ZIAGYGMSSA-N 2 0 247.386 2.197 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]C(C1CC1)C1CC1)C2 ZINC001169098162 969388848 /nfs/dbraw/zinc/38/88/48/969388848.db2.gz GHMNZECHUHLJQE-BTTYYORXSA-N 2 0 234.387 2.390 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+][C@@H]1C[C@H]3CC[C@@H]1C3)C2 ZINC001169099736 969390826 /nfs/dbraw/zinc/39/08/26/969390826.db2.gz UMDBHGFOFYKMFD-PMKSJIGOSA-N 2 0 234.387 2.390 20 0 BEADRP CCCOCCC[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169099487 969391541 /nfs/dbraw/zinc/39/15/41/969391541.db2.gz SYBTTWWTBOUXEW-ZSOGYDGISA-N 2 0 240.391 2.018 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]C1(C)CCC1)C2 ZINC001169096413 969394473 /nfs/dbraw/zinc/39/44/73/969394473.db2.gz WDIHFCXULBAIEI-ZSBIGDGJSA-N 2 0 208.349 2.144 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]C1CC(C)(C)C1)C2 ZINC001169101513 969396749 /nfs/dbraw/zinc/39/67/49/969396749.db2.gz TVMAUXHXXSPYDW-LMKPVCQUSA-N 2 0 222.376 2.390 20 0 BEADRP CCC(C)(C)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169078829 969398447 /nfs/dbraw/zinc/39/84/47/969398447.db2.gz HVMZTHQGGVSIKU-CNDDSTCGSA-N 2 0 210.365 2.390 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+][C@@H]1CCCC[C@H]1F)C2 ZINC001169081316 969402964 /nfs/dbraw/zinc/40/29/64/969402964.db2.gz QVRLKSPZVIHRDH-RKQHYHRCSA-N 2 0 240.366 2.482 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](NC(=[NH2+])C(C)(C)C)C2 ZINC001169081517 969403122 /nfs/dbraw/zinc/40/31/22/969403122.db2.gz SHASHOSWQOJNJO-JGPRNRPPSA-N 2 0 223.364 2.225 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)C1CCC1 ZINC001169118768 969413568 /nfs/dbraw/zinc/41/35/68/969413568.db2.gz NFYCYGBPVWDOJO-DOERSZECSA-N 2 0 222.376 2.390 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+][C@@H]1C[C@@H]3CC[C@H]1C3)C2 ZINC001169119561 969413984 /nfs/dbraw/zinc/41/39/84/969413984.db2.gz UMDBHGFOFYKMFD-ARSDKDGVSA-N 2 0 234.387 2.390 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+][C@H]1CC13CCC3)C2 ZINC001169116573 969414019 /nfs/dbraw/zinc/41/40/19/969414019.db2.gz RDVRBPYOQUAPQL-RNJOBUHISA-N 2 0 220.360 2.144 20 0 BEADRP C[C@H]1C[C@@H](CF)[N@@H+]([C@@H]2C[C@H]3CC[C@@H](C2)[NH+]3C)C1 ZINC001169126117 969427826 /nfs/dbraw/zinc/42/78/26/969427826.db2.gz PVGIPDVGGSAIIV-HPCHECBXSA-N 2 0 240.366 2.292 20 0 BEADRP CCC[N@H+](CC)[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169125021 969428170 /nfs/dbraw/zinc/42/81/70/969428170.db2.gz WHKCAERBVZNHLL-CLLJXQQHSA-N 2 0 210.365 2.344 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CC3(CCC3)C1)C2 ZINC001169131181 969440754 /nfs/dbraw/zinc/44/07/54/969440754.db2.gz REISESMQUMFHCL-CLLJXQQHSA-N 2 0 220.360 2.098 20 0 BEADRP CC[C@H](C)[N@H+](C)[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169131130 969441681 /nfs/dbraw/zinc/44/16/81/969441681.db2.gz PWAGAJCAABTMGH-WUHRBBMRSA-N 2 0 210.365 2.342 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CCC(CF)CC1)C2 ZINC001169139382 969449271 /nfs/dbraw/zinc/44/92/71/969449271.db2.gz BQETXVJOYSIGGV-BTTYYORXSA-N 2 0 240.366 2.293 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1C[C@H]3CC[C@@H]1C3)C2 ZINC001169148089 969467395 /nfs/dbraw/zinc/46/73/95/969467395.db2.gz YJLZGUKQTQBEGS-QNSTZXKLSA-N 2 0 220.360 2.096 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1C[C@@H]3C[C@H]1C[C@@H]3F)C2 ZINC001169155861 969471481 /nfs/dbraw/zinc/47/14/81/969471481.db2.gz VKBKDWHNFCUOEH-XQZGEAEESA-N 2 0 238.350 2.044 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@@H]2CC[C@@H](F)C2)CC1 ZINC001169219481 969488160 /nfs/dbraw/zinc/48/81/60/969488160.db2.gz CCQVXXSKZMPGTO-VXGBXAGGSA-N 2 0 228.355 2.199 20 0 BEADRP CC[N@H+](C)C1CC[NH+](C[C@@H]2C[C@H]2C)CC1 ZINC001209427101 969496024 /nfs/dbraw/zinc/49/60/24/969496024.db2.gz OKBCGBXLPYYFHP-NEPJUHHUSA-N 2 0 210.365 2.059 20 0 BEADRP COCC[N@H+](CCC[NH+]1CCCCC1)C(C)C ZINC001209448611 969518758 /nfs/dbraw/zinc/51/87/58/969518758.db2.gz FWJINSDIWAAJJK-UHFFFAOYSA-N 2 0 242.407 2.219 20 0 BEADRP CC[NH+]1CCC(Nc2cccc(C[NH2+]C)c2)CC1 ZINC001169265679 969525004 /nfs/dbraw/zinc/52/50/04/969525004.db2.gz OWALKZZXDFRUGF-UHFFFAOYSA-N 2 0 247.386 2.302 20 0 BEADRP CCN1CCC([NH+]2C[C@@H]3CCC[C@H]3C2)CC1 ZINC001169246678 969533755 /nfs/dbraw/zinc/53/37/55/969533755.db2.gz UOVRTILIAQFLPG-STQMWFEESA-N 2 0 222.376 2.203 20 0 BEADRP OCc1cc(Nc2ccc3[nH]cnc3c2)cc[nH+]1 ZINC001209844979 969654058 /nfs/dbraw/zinc/65/40/58/969654058.db2.gz SQZVMZVQSWXTIY-UHFFFAOYSA-N 2 0 240.266 2.194 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[N@H+](C)CC1)c1cccc(N)c1 ZINC001254509306 969683039 /nfs/dbraw/zinc/68/30/39/969683039.db2.gz YMTHBOPDNQPZEY-WFASDCNBSA-N 2 0 247.386 2.404 20 0 BEADRP C[C@@H]1CCC[N@@H+]([C@@H]2CCC[NH+](C)CC2)C1 ZINC001254516480 969685115 /nfs/dbraw/zinc/68/51/15/969685115.db2.gz MUROCHZCGBCAPW-CHWSQXEVSA-N 2 0 210.365 2.203 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH+]2CCC(F)(F)CC2)CC1 ZINC001254515656 969688081 /nfs/dbraw/zinc/68/80/81/969688081.db2.gz AKDJNOLFZBGUTR-LLVKDONJSA-N 2 0 232.318 2.202 20 0 BEADRP C[N@H+](CCc1ccncc1)[C@@H]1CCC[NH+](C)CC1 ZINC001254522154 969710000 /nfs/dbraw/zinc/71/00/00/969710000.db2.gz CZYPOMNLTUHXCK-OAHLLOKOSA-N 2 0 247.386 2.040 20 0 BEADRP [NH3+]C1(c2ccc(NCC[C@H]3CCC[NH2+]3)cc2)CC1 ZINC001169564230 969760203 /nfs/dbraw/zinc/76/02/03/969760203.db2.gz MHFUPQZVGIDYOB-CYBMUJFWSA-N 2 0 245.370 2.188 20 0 BEADRP CC1(C)CC([NH3+])CC(C)(C)[NH+]1C1CCOCC1 ZINC001255032367 969856227 /nfs/dbraw/zinc/85/62/27/969856227.db2.gz ZZYISOVSEGTIFM-UHFFFAOYSA-N 2 0 240.391 2.146 20 0 BEADRP [NH3+]CCCCCCC[NH2+]C1CCSCC1 ZINC001255082114 969874597 /nfs/dbraw/zinc/87/45/97/969874597.db2.gz QYNMFCQTTNUDFD-UHFFFAOYSA-N 2 0 230.421 2.381 20 0 BEADRP C[NH2+]CC1C[NH+](C[C@H]2CCC(C)=C[C@@H]2C)C1 ZINC001210560881 969939467 /nfs/dbraw/zinc/93/94/67/969939467.db2.gz BNUHSIDPNVHUSM-GXTWGEPZSA-N 2 0 222.376 2.130 20 0 BEADRP [NH2+]=CN[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001255126490 969945209 /nfs/dbraw/zinc/94/52/09/969945209.db2.gz MUULPGPNIPZGQT-QKDCVEJESA-N 2 0 243.354 2.379 20 0 BEADRP c1cc(NC2=CC[C@H]([NH+]3CCCC3)CC2)cc[nH+]1 ZINC001210704209 969999678 /nfs/dbraw/zinc/99/96/78/969999678.db2.gz HZJAIRDVZAJPMS-HNNXBMFYSA-N 2 0 243.354 2.448 20 0 BEADRP c1cc(NC2=CC[C@@H]([NH+]3CCCC3)CC2)cc[nH+]1 ZINC001210704210 969999924 /nfs/dbraw/zinc/99/99/24/969999924.db2.gz HZJAIRDVZAJPMS-OAHLLOKOSA-N 2 0 243.354 2.448 20 0 BEADRP [NH3+]CCC[N@H+]([C@@H]1CCSC1)C1CCCCC1 ZINC001255269062 970018821 /nfs/dbraw/zinc/01/88/21/970018821.db2.gz WQWUFAMAFXMYAF-CYBMUJFWSA-N 2 0 242.432 2.475 20 0 BEADRP C[N@@H+]1CC[C@@H](n2c(C[NH3+])cc3cccc(F)c32)C1 ZINC001255426291 970148907 /nfs/dbraw/zinc/14/89/07/970148907.db2.gz MSBUDZBIMHDIEE-LLVKDONJSA-N 2 0 247.317 2.116 20 0 BEADRP C[NH2+]Cc1cccc(Nc2cc[nH+]c(CO)c2)c1 ZINC001211138010 970158756 /nfs/dbraw/zinc/15/87/56/970158756.db2.gz XKQAOYWJMWCZTI-UHFFFAOYSA-N 2 0 243.310 2.037 20 0 BEADRP C[N@@H+]1CCC[C@H](n2ccc3cc(C[NH3+])ccc32)C1 ZINC001255466257 970194881 /nfs/dbraw/zinc/19/48/81/970194881.db2.gz LYSOKTAQGRPGCB-AWEZNQCLSA-N 2 0 243.354 2.367 20 0 BEADRP CC(C)([NH3+])C(C)(C)[NH2+][C@@H]1CCOC(C)(C)C1 ZINC001255533252 970295138 /nfs/dbraw/zinc/29/51/38/970295138.db2.gz YHTNUTJDIZQCGE-SNVBAGLBSA-N 2 0 228.380 2.050 20 0 BEADRP C[C@H]1CC[C@H]([NH2+]Cc2ccccc2C[NH3+])C1 ZINC001170111189 970319517 /nfs/dbraw/zinc/31/95/17/970319517.db2.gz AYYFJLFPCJHRPG-FZMZJTMJSA-N 2 0 218.344 2.424 20 0 BEADRP C1=C(c2ccccc2C[NH+]2CCCC2)C[NH2+]C1 ZINC001243108083 970341928 /nfs/dbraw/zinc/34/19/28/970341928.db2.gz BTHSAUMQNZNMDU-UHFFFAOYSA-N 2 0 228.339 2.269 20 0 BEADRP C1=C(c2cnccc2C[NH+]2CCCCC2)C[NH2+]C1 ZINC001243114295 970365452 /nfs/dbraw/zinc/36/54/52/970365452.db2.gz AEQIRQYQZQDDCV-UHFFFAOYSA-N 2 0 243.354 2.054 20 0 BEADRP C[C@@H](CC(F)(F)F)[NH2+][C@]1(C)CCCN(C)C1 ZINC001255644127 970415131 /nfs/dbraw/zinc/41/51/31/970415131.db2.gz LCEBVCGIHUNSTL-VHSXEESVSA-N 2 0 238.297 2.401 20 0 BEADRP C[C@@H]1CC[C@H]([NH+]2CC3(C2)CC[NH+](C)CC3)C1 ZINC001170147181 970441133 /nfs/dbraw/zinc/44/11/33/970441133.db2.gz APDOMUDSKVSGHB-OLZOCXBDSA-N 2 0 222.376 2.203 20 0 BEADRP C[C@H]1CC[C@@H]([NH+]2CC3(C2)CC[NH+](C)CC3)C1 ZINC001170147182 970442445 /nfs/dbraw/zinc/44/24/45/970442445.db2.gz APDOMUDSKVSGHB-QWHCGFSZSA-N 2 0 222.376 2.203 20 0 BEADRP C[C@H]1CC[C@H]([NH+]2CCC3(C[NH+](C)C3)CC2)C1 ZINC001170152947 970464561 /nfs/dbraw/zinc/46/45/61/970464561.db2.gz YGUNCFNNKPJRDL-STQMWFEESA-N 2 0 222.376 2.203 20 0 BEADRP CC[C@@H]1C[C@H]([NH2+]C(C)(C)CC[NH+](C)C)CCO1 ZINC001170176041 970548063 /nfs/dbraw/zinc/54/80/63/970548063.db2.gz OUIBNYHZJGVCHM-CHWSQXEVSA-N 2 0 242.407 2.264 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+][C@H](COC)C(C)C ZINC001255941601 970565118 /nfs/dbraw/zinc/56/51/18/970565118.db2.gz UQMAQIOLWDIDAG-ZIAGYGMSSA-N 2 0 244.423 2.367 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]C1CC(F)C1 ZINC001255940601 970565241 /nfs/dbraw/zinc/56/52/41/970565241.db2.gz DWCNAPJHOLCWNE-VOMCLLRMSA-N 2 0 216.344 2.197 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]CC1(C)CC1 ZINC001255940937 970573765 /nfs/dbraw/zinc/57/37/65/970573765.db2.gz JJHSVOAFJBCULS-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+][C@H]1CCCC(=O)C1 ZINC001255948066 970581647 /nfs/dbraw/zinc/58/16/47/970581647.db2.gz DLIAROKYRQDEJJ-STQMWFEESA-N 2 0 240.391 2.208 20 0 BEADRP Cc1ccccc1C[NH2+][C@H](C)C1CC[NH2+]CC1 ZINC000400347894 970581885 /nfs/dbraw/zinc/58/18/85/970581885.db2.gz LGYXHQDXXZUWPB-CYBMUJFWSA-N 2 0 232.371 2.473 20 0 BEADRP Cc1ccc(C[NH2+][C@@H](C)C2CC[NH2+]CC2)cc1 ZINC000400366072 970583200 /nfs/dbraw/zinc/58/32/00/970583200.db2.gz RSRSAHPHJHZNCH-ZDUSSCGKSA-N 2 0 232.371 2.473 20 0 BEADRP CC[NH+]1CCC(C[NH2+]CCSC(C)C)CC1 ZINC000304369352 970586606 /nfs/dbraw/zinc/58/66/06/970586606.db2.gz ZXPYKJFSWRMQRV-UHFFFAOYSA-N 2 0 244.448 2.450 20 0 BEADRP C[C@@H]([NH2+]CC1(C)CCC1)C1CC[NH2+]CC1 ZINC000400744986 970622741 /nfs/dbraw/zinc/62/27/41/970622741.db2.gz UJBZHGUOTIFFBG-LLVKDONJSA-N 2 0 210.365 2.154 20 0 BEADRP COc1cccc(C[C@@H](C)[NH2+][C@@H]2CCC[C@@H]2[NH3+])c1 ZINC001256154727 970675562 /nfs/dbraw/zinc/67/55/62/970675562.db2.gz AVLABJGZTGJEIG-BYCMXARLSA-N 2 0 248.370 2.096 20 0 BEADRP Cc1cc(C[NH+]2CCC(F)(C[NH3+])CC2)oc1C ZINC001222533436 972556309 /nfs/dbraw/zinc/55/63/09/972556309.db2.gz ZECICRFVUKVWCL-UHFFFAOYSA-N 2 0 240.322 2.159 20 0 BEADRP Cc1cc(C[NH+]2CCC(F)(C[NH3+])CC2)cs1 ZINC001222552350 972564125 /nfs/dbraw/zinc/56/41/25/972564125.db2.gz BQQLNQXDMWJEQU-UHFFFAOYSA-N 2 0 242.363 2.319 20 0 BEADRP CC[C@H](C)OCC[C@H](C)[N@@H+]1CCC[C@@H]([NH3+])CC1 ZINC001246542256 972568728 /nfs/dbraw/zinc/56/87/28/972568728.db2.gz NZNJWVZWNMQXSB-MELADBBJSA-N 2 0 242.407 2.393 20 0 BEADRP C[C@@H]1CC[C@@H]([N@@H+]2CCC[C@](F)(C[NH3+])CC2)C1 ZINC001246548262 972682493 /nfs/dbraw/zinc/68/24/93/972682493.db2.gz JVTMBMAWZAFVAJ-JHJVBQTASA-N 2 0 228.355 2.328 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@H]1CCCc2c(O)cccc21 ZINC001327841779 972756744 /nfs/dbraw/zinc/75/67/44/972756744.db2.gz ZMRFYFTZMOPSKS-FZMZJTMJSA-N 2 0 248.370 2.357 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2CCCC[C@H](C)C2)CC[NH2+]1 ZINC001246557335 972775981 /nfs/dbraw/zinc/77/59/81/972775981.db2.gz KOSKHMSFXIPAOB-YNEHKIRRSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@H](CC(F)(F)F)[N@H+]1CC[C@@H](F)[C@@H]([NH3+])CC1 ZINC001246589570 972989804 /nfs/dbraw/zinc/98/98/04/972989804.db2.gz SSIDMUYCUBALBU-HLTSFMKQSA-N 2 0 242.260 2.089 20 0 BEADRP CCC[C@@H](C)CC[C@@H](C)[N@H+]1C[C@@H]2[C@H]([NH3+])[C@@H]2C1 ZINC001246665975 973072982 /nfs/dbraw/zinc/07/29/82/973072982.db2.gz VOMDTPRPHJXJAN-XGFWRYKXSA-N 2 0 224.392 2.480 20 0 BEADRP CC(C)(C)C1CCC([N@H+]2C[C@@H]3[C@@H]([NH3+])[C@@H]3C2)CC1 ZINC001246660563 973073910 /nfs/dbraw/zinc/07/39/10/973073910.db2.gz VJERIBYKBCXEJA-TWASESMYSA-N 2 0 236.403 2.480 20 0 BEADRP COCC[C@@H]1CCCC[N@@H+]1[C@@H]1CC[NH2+][C@@H](C)C1 ZINC001246781032 973089076 /nfs/dbraw/zinc/08/90/76/973089076.db2.gz DBLNNVGKJGDULP-MELADBBJSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@@H]1CC([N@@H+]2CCCC3(C[NH2+]C3)C2)C[C@@H](C)C1 ZINC001246794266 973097801 /nfs/dbraw/zinc/09/78/01/973097801.db2.gz ZMEGEUCAROVEQS-STQMWFEESA-N 2 0 236.403 2.497 20 0 BEADRP CCOc1cccc(C[NH2+]CC[C@@H](C)[NH2+]C)c1 ZINC001328678528 973268396 /nfs/dbraw/zinc/26/83/96/973268396.db2.gz XPZHWWUEYLEDPT-GFCCVEGCSA-N 2 0 236.359 2.173 20 0 BEADRP C/C=C(\NC=[NH2+])n1c(CC[NH3+])cc2ccccc21 ZINC001171300672 973488684 /nfs/dbraw/zinc/48/86/84/973488684.db2.gz DAZIXKBQEWJRDJ-JLZUIIAYSA-N 2 0 242.326 2.157 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CC2(C)CC(F)(F)C2)CC[NH2+]1 ZINC000720921531 973633422 /nfs/dbraw/zinc/63/34/22/973633422.db2.gz CTDCGGVNXWTWDL-ZJUUUORDSA-N 2 0 232.318 2.152 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH2+]CC2(C)CC(F)(F)C2)CC1 ZINC000720935288 973666316 /nfs/dbraw/zinc/66/63/16/973666316.db2.gz NDRYZTILOMKOJX-NSHDSACASA-N 2 0 246.345 2.496 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+]C[C@@H](C)C(C)(C)C ZINC000234722869 973716069 /nfs/dbraw/zinc/71/60/69/973716069.db2.gz BNNIEYHEPRVQCF-VXGBXAGGSA-N 2 0 230.396 2.012 20 0 BEADRP c1cc2c[nH+]cc(NC[C@H]3CCCC[NH2+]3)c2[nH]1 ZINC001171334332 973862782 /nfs/dbraw/zinc/86/27/82/973862782.db2.gz LLZSFOIDHMDPRL-LLVKDONJSA-N 2 0 230.315 2.117 20 0 BEADRP C[NH+]1C(C)(C)CC([NH+]2CCC2)CC1(C)C ZINC001171629517 974107783 /nfs/dbraw/zinc/10/77/83/974107783.db2.gz VCLFJLMBEJPXBZ-UHFFFAOYSA-N 2 0 210.365 2.344 20 0 BEADRP C[NH+]1C(C)(C)CC([NH2+]C[C@H]2CCO2)CC1(C)C ZINC001171622254 974112828 /nfs/dbraw/zinc/11/28/28/974112828.db2.gz YJXUHFQIYCXDHH-GFCCVEGCSA-N 2 0 240.391 2.016 20 0 BEADRP CC1([NH3+])CC[NH+]([C@@H]2Cc3cccc(F)c3C2)CC1 ZINC001171782914 974170411 /nfs/dbraw/zinc/17/04/11/974170411.db2.gz HHTKZBAGKBNONF-GFCCVEGCSA-N 2 0 248.345 2.106 20 0 BEADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H](NC1(CF)CC1)C2 ZINC001172101178 974333195 /nfs/dbraw/zinc/33/31/95/974333195.db2.gz XESAEWKNTLPRTL-ZSBIGDGJSA-N 2 0 226.339 2.093 20 0 BEADRP N[C@@H]1CC[N@H+](C[C@H]2CC=CCC2)CC[C@@H]1F ZINC001206155567 974334986 /nfs/dbraw/zinc/33/49/86/974334986.db2.gz MGGVDBYUVHOCRS-RWMBFGLXSA-N 2 0 226.339 2.104 20 0 BEADRP C[C@@H]([NH3+])c1nccn1[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172098428 974340939 /nfs/dbraw/zinc/34/09/39/974340939.db2.gz DWPHZWXIDWHONC-FVCCEPFGSA-N 2 0 248.374 2.091 20 0 BEADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1C[C@H]3CC[C@@H]1C3)C2 ZINC001172125154 974349999 /nfs/dbraw/zinc/34/99/99/974349999.db2.gz OUOHUDGPTIGBIO-VQJWOFKYSA-N 2 0 234.387 2.486 20 0 BEADRP CCSCC[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172102712 974360852 /nfs/dbraw/zinc/36/08/52/974360852.db2.gz OKBFBGMNCLSQPV-XYYAHUGASA-N 2 0 242.432 2.344 20 0 BEADRP COC(C)(C)C[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172103573 974364878 /nfs/dbraw/zinc/36/48/78/974364878.db2.gz VYPNVELKWGTELW-CLLJXQQHSA-N 2 0 240.391 2.016 20 0 BEADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H](n1cccc1CC[NH3+])C2 ZINC001172113371 974385376 /nfs/dbraw/zinc/38/53/76/974385376.db2.gz CKYKJECCAVAAPC-QDMKHBRRSA-N 2 0 247.386 2.177 20 0 BEADRP CC[C@@H](C)OCC[C@@H](C)[NH2+][C@@H]1CCC[C@@H]1[NH3+] ZINC001172326705 974537549 /nfs/dbraw/zinc/53/75/49/974537549.db2.gz BFXFVBIXDUZUOO-FVCCEPFGSA-N 2 0 228.380 2.050 20 0 BEADRP C[C@@H]1CC[C@H]([N@H+]2C[C@H]3C[NH+](C)C[C@H]3C2)C[C@H]1C ZINC001172380128 974583526 /nfs/dbraw/zinc/58/35/26/974583526.db2.gz RHQBLNLGDJNJDQ-ZSAUSMIDSA-N 2 0 236.403 2.305 20 0 BEADRP CC[C@H](C)OCC[C@H](C)[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC001172342119 974607502 /nfs/dbraw/zinc/60/75/02/974607502.db2.gz KGOQARZDIXJMSC-XUXIUFHCSA-N 2 0 242.407 2.440 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CCSCC[NH3+])C[C@H]1C ZINC001172365148 974643139 /nfs/dbraw/zinc/64/31/39/974643139.db2.gz CRQPNALZAICAAC-UTUOFQBUSA-N 2 0 230.421 2.093 20 0 BEADRP C[NH2+][C@@]12CC[C@@](Nc3cc[nH+]c(C)c3)(C1)CCC2 ZINC001277064464 974644194 /nfs/dbraw/zinc/64/41/94/974644194.db2.gz KXSNVZBYWZEZDI-LSDHHAIUSA-N 2 0 245.370 2.289 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+][C@@H]2CCC[C@@H]2[NH3+])C[C@H]1C ZINC001172366647 974645806 /nfs/dbraw/zinc/64/58/06/974645806.db2.gz GVVMRKSATKDHTQ-NJMOYASZSA-N 2 0 210.365 2.281 20 0 BEADRP CCOCC[C@@H](C)[NH2+]CCC1CC[NH+](C)CC1 ZINC001172406011 974660947 /nfs/dbraw/zinc/66/09/47/974660947.db2.gz FRRFWLFWEAJZRX-CYBMUJFWSA-N 2 0 242.407 2.123 20 0 BEADRP CCOCC[C@H](C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001172409666 974670712 /nfs/dbraw/zinc/67/07/12/974670712.db2.gz ATQKSWOAUZTXFK-FQUUOJAGSA-N 2 0 240.391 2.016 20 0 BEADRP CCOCC[C@@H](C)[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC001172410560 974673014 /nfs/dbraw/zinc/67/30/14/974673014.db2.gz HUPCLGUULQNZKY-ZIAGYGMSSA-N 2 0 242.407 2.123 20 0 BEADRP CCOc1ccc(C[NH2+]CC[C@@H](C)[NH2+]C)cc1 ZINC001331420751 974713892 /nfs/dbraw/zinc/71/38/92/974713892.db2.gz ZIJBGBHZYBOUQH-GFCCVEGCSA-N 2 0 236.359 2.173 20 0 BEADRP CCOCC[C@@H](C)[NH+]1CCC([N@H+](C)CC)CC1 ZINC001172432646 974718064 /nfs/dbraw/zinc/71/80/64/974718064.db2.gz XNRMQDLCCATLNY-CYBMUJFWSA-N 2 0 242.407 2.218 20 0 BEADRP CC(C)COCC[C@H](C)[N@H+](C)CCC[NH+](C)C ZINC001172468893 974765600 /nfs/dbraw/zinc/76/56/00/974765600.db2.gz PYSLZAURQXFZLC-AWEZNQCLSA-N 2 0 244.423 2.321 20 0 BEADRP CC(C)OCC[C@@H](C)[NH2+][C@@H]1CCC[N@H+](C)CC1 ZINC001172437791 974793728 /nfs/dbraw/zinc/79/37/28/974793728.db2.gz JGKDOPFLVYICLU-ZIAGYGMSSA-N 2 0 242.407 2.264 20 0 BEADRP CCCCCC[C@@H](CCCC)[NH2+]C[C@@H](O)C[NH3+] ZINC001172510515 974864298 /nfs/dbraw/zinc/86/42/98/974864298.db2.gz DPTTUBHYIYECGO-KGLIPLIRSA-N 2 0 244.423 2.425 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@H]([NH2+]C[C@@H]3CC=CCC3)[C@H]2C1 ZINC001204089637 974879855 /nfs/dbraw/zinc/87/98/55/974879855.db2.gz PUGZMSHURQBHBW-QPSCCSFWSA-N 2 0 234.387 2.273 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)[C@@H]1CCC[C@@H](OC)C1 ZINC001172951536 975007083 /nfs/dbraw/zinc/00/70/83/975007083.db2.gz RGOGUERIASWQJG-ZIAGYGMSSA-N 2 0 242.407 2.218 20 0 BEADRP CCCOC1CCC([N@@H+]2CCC[C@H]([NH3+])C2)CC1 ZINC001173092578 975016750 /nfs/dbraw/zinc/01/67/50/975016750.db2.gz VMGOKYRZNCKEPO-HSBZDZAISA-N 2 0 240.391 2.147 20 0 BEADRP CC[NH+](CC)C1CCC([N@H+]2C=C(N)C=CC2)CC1 ZINC001173105121 975021211 /nfs/dbraw/zinc/02/12/11/975021211.db2.gz ANYQTCPRTYJTEG-UHFFFAOYSA-N 2 0 249.402 2.311 20 0 BEADRP CC[C@H]1CC[C@@H]([NH2+]C[C@H]2CCC[N@H+](C)C2)C1 ZINC001173262393 975117941 /nfs/dbraw/zinc/11/79/41/975117941.db2.gz GOVANNKDETXSBV-BFHYXJOUSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@H]1CC[C@@H]([NH2+][C@H]2CCC[C@H]([NH3+])C2)C1 ZINC001173274307 975157816 /nfs/dbraw/zinc/15/78/16/975157816.db2.gz PISDPAXZQOFEBA-ZDEQEGDKSA-N 2 0 210.365 2.425 20 0 BEADRP CCc1ccc(C[C@@H](C)[NH2+]C[C@H](C)C[NH3+])cc1 ZINC001173241572 975166226 /nfs/dbraw/zinc/16/62/26/975166226.db2.gz OJKYVVIHYXRRLU-CHWSQXEVSA-N 2 0 234.387 2.364 20 0 BEADRP CCSC[C@@H](C)[N@H+]1C[C@H]2C[NH+](CC)C[C@H]2C1 ZINC001173307682 975215307 /nfs/dbraw/zinc/21/53/07/975215307.db2.gz IRLUJQRTHQEAAV-UPJWGTAASA-N 2 0 242.432 2.012 20 0 BEADRP CCSC[C@H](C)[N@H+]1C[C@H]2C[NH+](CC)C[C@H]2C1 ZINC001173307681 975216637 /nfs/dbraw/zinc/21/66/37/975216637.db2.gz IRLUJQRTHQEAAV-RWMBFGLXSA-N 2 0 242.432 2.012 20 0 BEADRP CC[N@@H+]1CC[C@H](n2ccc3cc(C[NH3+])ccc32)C1 ZINC001173347953 975288336 /nfs/dbraw/zinc/28/83/36/975288336.db2.gz KMVUDFOWLGAZAC-AWEZNQCLSA-N 2 0 243.354 2.367 20 0 BEADRP CC[N@@H+]1CC[C@@H](n2ccc3ccc(C[NH3+])cc32)C1 ZINC001173351812 975298996 /nfs/dbraw/zinc/29/89/96/975298996.db2.gz ZGOMBODPHKKULZ-CQSZACIVSA-N 2 0 243.354 2.367 20 0 BEADRP Cc1ccc(CC[NH2+][C@H]2C[C@@H]([NH3+])C23CCC3)cc1 ZINC001332877635 975305554 /nfs/dbraw/zinc/30/55/54/975305554.db2.gz IPQWTGWOGMJESN-CABCVRRESA-N 2 0 244.382 2.397 20 0 BEADRP COC1(C[NH2+]C(C)(C)CCC[NH+](C)C)CCC1 ZINC001333372531 975724081 /nfs/dbraw/zinc/72/40/81/975724081.db2.gz WSYGSWCGFSPFKU-UHFFFAOYSA-N 2 0 242.407 2.266 20 0 BEADRP C[NH+](C)Cc1ccccc1O[C@@H]1CCC[N@H+](C)C1 ZINC001229699277 976950964 /nfs/dbraw/zinc/95/09/64/976950964.db2.gz MIJKMXOPJICLCI-CQSZACIVSA-N 2 0 248.370 2.221 20 0 BEADRP CC[N@@H+]1CC[C@@H](Oc2ccccc2C[NH+](C)C)C1 ZINC001229699993 976952054 /nfs/dbraw/zinc/95/20/54/976952054.db2.gz UJRNYRJWGOBWDG-CQSZACIVSA-N 2 0 248.370 2.221 20 0 BEADRP C[N@H+](Cc1cc2c[nH+]ccc2[nH]1)[C@@H]1CCCOC1 ZINC001232017866 977844523 /nfs/dbraw/zinc/84/45/23/977844523.db2.gz AEOUKPGMSPWVFZ-CYBMUJFWSA-N 2 0 245.326 2.174 20 0 BEADRP C[NH+]1CCC(C[NH2+]CCNc2ccccc2)CC1 ZINC001336737676 977897956 /nfs/dbraw/zinc/89/79/56/977897956.db2.gz XHVMQIMJZOAPPY-UHFFFAOYSA-N 2 0 247.386 2.030 20 0 BEADRP CC/C=C\CCC[N@@H+]1CC[NH2+]C[C@H](C)C1 ZINC001206269520 978016497 /nfs/dbraw/zinc/01/64/97/978016497.db2.gz POKNZHHJIQSWKS-ZFDPJTLLSA-N 2 0 210.365 2.274 20 0 BEADRP C[NH+](C)[C@@H]1CC[C@H]2C[N@H+](Cc3ccoc3)C[C@H]2C1 ZINC001336889259 978028708 /nfs/dbraw/zinc/02/87/08/978028708.db2.gz QITRCIQNIMPIFD-RRFJBIMHSA-N 2 0 248.370 2.442 20 0 BEADRP Cc1cc(C)[nH+]c(N2C[C@H](C[NH3+])CC[C@@H]2C)c1 ZINC000721831043 978043222 /nfs/dbraw/zinc/04/32/22/978043222.db2.gz SYHDOVJHJRSFHJ-STQMWFEESA-N 2 0 233.359 2.262 20 0 BEADRP C[C@@H]1C[C@H]([NH+]2CCCC2)CN1c1cc[nH+]cc1 ZINC001336908700 978048050 /nfs/dbraw/zinc/04/80/50/978048050.db2.gz GVRINRUBFFVBER-OCCSQVGLSA-N 2 0 231.343 2.145 20 0 BEADRP Cc1cccnc1C[N@@H+]1CCC[C@](C)(C[NH3+])CC1 ZINC001206303124 978348125 /nfs/dbraw/zinc/34/81/25/978348125.db2.gz BMBGLRZVBJFKJE-HNNXBMFYSA-N 2 0 247.386 2.341 20 0 BEADRP c1cc(C[NH2+]Cc2ccc3c[nH+]cn3c2)co1 ZINC001178916872 978643125 /nfs/dbraw/zinc/64/31/25/978643125.db2.gz QAIFSIDHIFUMPR-UHFFFAOYSA-N 2 0 227.267 2.217 20 0 BEADRP Cl/C=C\C[NH2+]Cc1ccnn1-c1cc[nH+]cc1 ZINC001179747912 978749115 /nfs/dbraw/zinc/74/91/15/978749115.db2.gz QYZOJWXGWRBVEO-KTAJNNJTSA-N 2 0 248.717 2.109 20 0 BEADRP CO[C@H]1CCC[C@H]([N@H+](CCC[NH3+])C(C)C)C1 ZINC000069846607 978764125 /nfs/dbraw/zinc/76/41/25/978764125.db2.gz FCPFWIUHKPLWFT-STQMWFEESA-N 2 0 228.380 2.003 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2C[C@@H](C)C[C@@H]2C)CC1 ZINC001179898653 978781035 /nfs/dbraw/zinc/78/10/35/978781035.db2.gz RKRJEWMOMYGVLV-STQMWFEESA-N 2 0 224.392 2.449 20 0 BEADRP CC(C)[NH+](CCCNc1cc[nH+]cc1)C(C)C ZINC001339451674 978853591 /nfs/dbraw/zinc/85/35/91/978853591.db2.gz XVMIBDCQJCEDES-UHFFFAOYSA-N 2 0 235.375 2.424 20 0 BEADRP CN(c1cc[nH+]cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001339458967 978854703 /nfs/dbraw/zinc/85/47/03/978854703.db2.gz UIISQQJVOBGGCW-PBWFPOADSA-N 2 0 231.343 2.143 20 0 BEADRP CCN(CCC[NH+]1CCCC1)c1cc[nH+]cc1 ZINC001339464900 978855113 /nfs/dbraw/zinc/85/51/13/978855113.db2.gz OTQYVKOHUWWBAQ-UHFFFAOYSA-N 2 0 233.359 2.394 20 0 BEADRP C[C@H]1CN(c2cc[nH+]cc2)CC[N@@H+](C2CCC2)C1 ZINC001339458379 978855233 /nfs/dbraw/zinc/85/52/33/978855233.db2.gz IYPYTFRMLARDRE-CYBMUJFWSA-N 2 0 245.370 2.392 20 0 BEADRP CCSCC[N@H+]1C[C@@H]2CC[NH+](C)CC[C@@H]2C1 ZINC001277914369 978946074 /nfs/dbraw/zinc/94/60/74/978946074.db2.gz RZGMIJUVHDMJDD-BETUJISGSA-N 2 0 242.432 2.013 20 0 BEADRP CCc1cccc(C)c1CN1CC[C@@H]2[NH2+]CC[C@@H]21 ZINC001235004972 978949177 /nfs/dbraw/zinc/94/91/77/978949177.db2.gz VHLDPXACHANZCF-HOTGVXAUSA-N 2 0 244.382 2.494 20 0 BEADRP Cc1cc(C)c(CN2CC[C@H]3C[NH2+]C[C@H]32)cc1C ZINC001235007797 978950813 /nfs/dbraw/zinc/95/08/13/978950813.db2.gz RKXXXQXCAUZTBC-GOEBONIOSA-N 2 0 244.382 2.406 20 0 BEADRP c1ccc(CCCCN2CC[C@H]3C[NH2+]C[C@H]32)cc1 ZINC001235008411 978951318 /nfs/dbraw/zinc/95/13/18/978951318.db2.gz UQWMEOWBVWLSPU-JKSUJKDBSA-N 2 0 244.382 2.303 20 0 BEADRP CCCC[C@@H](CC)C[N@@H+]1CCC2(C[NH2+]C2)C1 ZINC001235024915 978955953 /nfs/dbraw/zinc/95/59/53/978955953.db2.gz SNZYEYBAAZIHLR-CYBMUJFWSA-N 2 0 224.392 2.498 20 0 BEADRP CC1=C[C@@H](C)[C@@H](C[N@@H+]2CCC3(C[NH2+]C3)C2)CC1 ZINC001235024001 978956293 /nfs/dbraw/zinc/95/62/93/978956293.db2.gz JGHYLWARNPBBDX-ZIAGYGMSSA-N 2 0 234.387 2.274 20 0 BEADRP CC1=C[C@H](C)[C@H](C[N@@H+]2CCC3(C[NH2+]C3)C2)CC1 ZINC001235023998 978956343 /nfs/dbraw/zinc/95/63/43/978956343.db2.gz JGHYLWARNPBBDX-KBPBESRZSA-N 2 0 234.387 2.274 20 0 BEADRP c1c[nH]c(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C2CC2)c1 ZINC001277922311 978974109 /nfs/dbraw/zinc/97/41/09/978974109.db2.gz KHJAXXRGKVRTGV-LQDVMPOASA-N 2 0 245.370 2.262 20 0 BEADRP C1CC1[NH+]1CCC2(C[NH+](C3CCCC3)C2)CC1 ZINC001277923687 978975414 /nfs/dbraw/zinc/97/54/14/978975414.db2.gz HICNFEMSKBWZOF-UHFFFAOYSA-N 2 0 234.387 2.489 20 0 BEADRP C[NH2+]CCN1CCC2(CCc3ccccc32)CC1 ZINC001235152932 978984124 /nfs/dbraw/zinc/98/41/24/978984124.db2.gz PWVNTMWBOGMQKG-UHFFFAOYSA-N 2 0 244.382 2.186 20 0 BEADRP Cc1cc(CN2CC[C@H]3C[C@@]3([NH3+])C2)c(C)s1 ZINC001235161228 978985146 /nfs/dbraw/zinc/98/51/46/978985146.db2.gz OASSOYLGMBMVDL-QWHCGFSZSA-N 2 0 236.384 2.288 20 0 BEADRP C[N@H+]1CC[C@H]2C[NH+](C3CCCC3)C[C@H]2CC1 ZINC001277928638 978989144 /nfs/dbraw/zinc/98/91/44/978989144.db2.gz LGYQVRDWYOZLDW-BETUJISGSA-N 2 0 222.376 2.203 20 0 BEADRP C[C@@H](CC[N@H+]1C[C@@H]2[C@@H]([NH3+])[C@@H]2C1)CC(C)(C)C ZINC001235211544 978998722 /nfs/dbraw/zinc/99/87/22/978998722.db2.gz XLWWUBYWJDUQTE-WUHRBBMRSA-N 2 0 224.392 2.338 20 0 BEADRP c1cc(C[NH+]2CCC([C@@H]3CCCC[NH2+]3)CC2)c[nH]1 ZINC001235229598 978998752 /nfs/dbraw/zinc/99/87/52/978998752.db2.gz RGJRUVLWXXRTAI-HNNXBMFYSA-N 2 0 247.386 2.369 20 0 BEADRP C([C@H]1CCCC[NH2+]1)[N@@H+]1CC[C@H]2CCC[C@H]2C1 ZINC001235222649 978999811 /nfs/dbraw/zinc/99/98/11/978999811.db2.gz MRCNRQCQPCGDJG-HZSPNIEDSA-N 2 0 222.376 2.251 20 0 BEADRP CCCC[C@H](CC)C[N@@H+]1C[C@H]2C[NH2+]CC[C@H]21 ZINC001235256718 979009668 /nfs/dbraw/zinc/00/96/68/979009668.db2.gz GKKHGQNUBMECQU-BFHYXJOUSA-N 2 0 224.392 2.497 20 0 BEADRP CCCC[C@H](CC)C[N@@H+]1C[C@@H]2C[NH2+]CC[C@H]21 ZINC001235256723 979010650 /nfs/dbraw/zinc/01/06/50/979010650.db2.gz GKKHGQNUBMECQU-MELADBBJSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)=CCC[C@@H](C)C[N@H+]1C[C@@H]2[C@H]([NH3+])[C@@H]2C1 ZINC001235284139 979017467 /nfs/dbraw/zinc/01/74/67/979017467.db2.gz UGLNMQLGIGRNLH-YIYPIFLZSA-N 2 0 222.376 2.258 20 0 BEADRP CCC(CC)C[N@@H+]1CC[C@@]2(C1)C[NH2+]CC[C@@H]2F ZINC001235404152 979037457 /nfs/dbraw/zinc/03/74/57/979037457.db2.gz MTHQUWHGGKRQOU-KBPBESRZSA-N 2 0 242.382 2.446 20 0 BEADRP C[C@@H]1CCC[N@H+](CC[C@H]2COC(C)(C)N2)[C@@H]1C ZINC001235694714 979125439 /nfs/dbraw/zinc/12/54/39/979125439.db2.gz ITAFKYVRPPQQCB-UPJWGTAASA-N 2 0 240.391 2.221 20 0 BEADRP Cc1cccc(C)c1C[N@@H+]1CCCC2(C[NH2+]C2)C1 ZINC001235711233 979129526 /nfs/dbraw/zinc/12/95/26/979129526.db2.gz NQESMACPJYUEFT-UHFFFAOYSA-N 2 0 244.382 2.489 20 0 BEADRP CC1(C[N@H+]2C[C@H]3C[NH2+]CC[C@@H]3C2)CCCCC1 ZINC001235929046 979211533 /nfs/dbraw/zinc/21/15/33/979211533.db2.gz GMTWGVKMPSBEQV-ZIAGYGMSSA-N 2 0 236.403 2.498 20 0 BEADRP CC1(C[N@@H+]2C[C@@H]3CC[NH2+]C[C@H]3C2)CCCCC1 ZINC001235929043 979212685 /nfs/dbraw/zinc/21/26/85/979212685.db2.gz GMTWGVKMPSBEQV-KBPBESRZSA-N 2 0 236.403 2.498 20 0 BEADRP CCc1ccc(C[N@H+]2C[C@H]3CC[C@@H](C2)[C@@H]3[NH3+])cc1 ZINC001235958235 979225570 /nfs/dbraw/zinc/22/55/70/979225570.db2.gz AWYRPYUDRJZUJG-MUJYYYPQSA-N 2 0 244.382 2.418 20 0 BEADRP Cc1cccc(CC[N@H+]2C[C@H]3CC[C@@H](C2)[C@@H]3[NH3+])c1 ZINC001235958692 979225840 /nfs/dbraw/zinc/22/58/40/979225840.db2.gz ITYYRPCSEBWWOW-MUJYYYPQSA-N 2 0 244.382 2.207 20 0 BEADRP Cc1ccc(C[N@H+]2C[C@H]3CC[C@@H](C2)[C@@H]3[NH3+])c(C)c1 ZINC001235960473 979230560 /nfs/dbraw/zinc/23/05/60/979230560.db2.gz WRTRFRFBWNJDAF-MUJYYYPQSA-N 2 0 244.382 2.473 20 0 BEADRP COc1ccccc1[C@H](C)[N@H+](C)CCCC[NH3+] ZINC001235963535 979237264 /nfs/dbraw/zinc/23/72/64/979237264.db2.gz WLXXRFNHCYHWPH-LBPRGKRZSA-N 2 0 236.359 2.427 20 0 BEADRP [NH3+]CCCC[N@@H+]1CCCC2(CC(F)C2)CC1 ZINC001235991752 979277614 /nfs/dbraw/zinc/27/76/14/979277614.db2.gz HIWUSCJEDDHXIW-UHFFFAOYSA-N 2 0 228.355 2.330 20 0 BEADRP CCc1ccccc1CN1C[C@H]2CC[C@@H](C1)[NH2+]C2 ZINC001236060191 979347787 /nfs/dbraw/zinc/34/77/87/979347787.db2.gz BHEHNJDQKFOQGR-BBRMVZONSA-N 2 0 244.382 2.433 20 0 BEADRP CC1CC(C[N@@H+]2CCC[C@H]([NH+](C)C)CC2)C1 ZINC001341375592 979363328 /nfs/dbraw/zinc/36/33/28/979363328.db2.gz OFGMKYZPFJTEOL-RUXDESIVSA-N 2 0 224.392 2.449 20 0 BEADRP CC[N@H+](CCCC[NH3+])Cc1ccc(OC)cc1 ZINC001236102961 979389556 /nfs/dbraw/zinc/38/95/56/979389556.db2.gz SMYPUMWCTIDNFV-UHFFFAOYSA-N 2 0 236.359 2.256 20 0 BEADRP Cc1cccc2[nH]cc(CN3CCC[C@@H]3C[NH3+])c21 ZINC001236244917 979464080 /nfs/dbraw/zinc/46/40/80/979464080.db2.gz GPROTSXMRJEJSS-CYBMUJFWSA-N 2 0 243.354 2.399 20 0 BEADRP Cc1cc(F)cc(C)c1CN1CCC[C@@H]1C[NH3+] ZINC001236251983 979470004 /nfs/dbraw/zinc/47/00/04/979470004.db2.gz BAODWXWLABDRBG-CYBMUJFWSA-N 2 0 236.334 2.366 20 0 BEADRP [NH3+]C[C@H]1CCCN1Cc1cccc2ncsc21 ZINC001236251372 979471739 /nfs/dbraw/zinc/47/17/39/979471739.db2.gz SMHQATUGBSGCLN-LLVKDONJSA-N 2 0 247.367 2.219 20 0 BEADRP CCC[C@@H](C)C[N@H+]1C[C@@H]2CC[NH2+]CC[C@@H]2C1 ZINC001236314456 979523960 /nfs/dbraw/zinc/52/39/60/979523960.db2.gz NGDLGQVBWKUJLC-MCIONIFRSA-N 2 0 224.392 2.354 20 0 BEADRP Fc1cccc(C[N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)c1 ZINC001236314209 979524804 /nfs/dbraw/zinc/52/48/04/979524804.db2.gz LAKVGFZYMITKTP-OKILXGFUSA-N 2 0 248.345 2.257 20 0 BEADRP c1ccc(CC[N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)cc1 ZINC001236315284 979528894 /nfs/dbraw/zinc/52/88/94/979528894.db2.gz ZJZPPHMHALAIPZ-IYBDPMFKSA-N 2 0 244.382 2.161 20 0 BEADRP C[N@H+](CC1(C)CCCCC1)[C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001236412012 979586503 /nfs/dbraw/zinc/58/65/03/979586503.db2.gz ITWLTZKCAXMGKV-ITGUQSILSA-N 2 0 222.376 2.106 20 0 BEADRP C/C=C(\NC=[NH2+])c1cccc(C[NH+](C)C)c1 ZINC001236413264 979587431 /nfs/dbraw/zinc/58/74/31/979587431.db2.gz GGPNMFUIBWSEEV-PQMHYQBVSA-N 2 0 217.316 2.306 20 0 BEADRP C[C@]1(C[NH3+])CCCC[N@H+](Cc2ccoc2)C1 ZINC001206542366 979671280 /nfs/dbraw/zinc/67/12/80/979671280.db2.gz ZGURPBUNRHEMEB-CYBMUJFWSA-N 2 0 222.332 2.231 20 0 BEADRP CS[C@@H](C)CC[N@@H+]1CCC[C@](C)([NH3+])CC1 ZINC001205254700 979731320 /nfs/dbraw/zinc/73/13/20/979731320.db2.gz ACGQGHGTXOAZFP-RYUDHWBXSA-N 2 0 230.421 2.331 20 0 BEADRP C[C@@]1([NH3+])CCC[N@H+](C[C@@H]2C[C@H]3C=C[C@@H]2C3)CC1 ZINC001205257231 979756871 /nfs/dbraw/zinc/75/68/71/979756871.db2.gz UQGWMVJBVZGARO-LJISPDSOSA-N 2 0 234.387 2.402 20 0 BEADRP CCOC(C)(C)C[N@@H+]1CCC[C@@](C)([NH3+])CC1 ZINC001205257945 979782159 /nfs/dbraw/zinc/78/21/59/979782159.db2.gz ZGBCFUPYURGRBO-CYBMUJFWSA-N 2 0 228.380 2.005 20 0 BEADRP Cc1cc(F)cc(C)c1CN(C)C[C@H](C)[NH3+] ZINC001236909655 979790047 /nfs/dbraw/zinc/79/00/47/979790047.db2.gz UFKZWXRNNTVTIT-NSHDSACASA-N 2 0 224.323 2.222 20 0 BEADRP C[C@H]([NH3+])CN(C)Cc1cc(O)cc2ccccc21 ZINC001236908946 979793861 /nfs/dbraw/zinc/79/38/61/979793861.db2.gz NKQXWLMYPSWYKY-NSHDSACASA-N 2 0 244.338 2.324 20 0 BEADRP Cc1cccnc1C[N@@H+]1CCC[C@](C)([NH3+])CC1 ZINC001205263609 979801900 /nfs/dbraw/zinc/80/19/00/979801900.db2.gz AKIMNACPVUSOST-AWEZNQCLSA-N 2 0 233.359 2.093 20 0 BEADRP Cc1cccnc1C[N@@H+]1CCC[C@@](C)([NH3+])CC1 ZINC001205263610 979802041 /nfs/dbraw/zinc/80/20/41/979802041.db2.gz AKIMNACPVUSOST-CQSZACIVSA-N 2 0 233.359 2.093 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1C[NH+]2CCC1CC2)C1CCC1 ZINC001184135093 979945231 /nfs/dbraw/zinc/94/52/31/979945231.db2.gz KRJMJUPTUZTPQY-CABCVRRESA-N 2 0 236.403 2.497 20 0 BEADRP C1=CC[C@@H](C[NH2+]C[C@H]2C[NH+]3CCC2CC3)CC1 ZINC001184135742 979946886 /nfs/dbraw/zinc/94/68/86/979946886.db2.gz VPMJAMFFALEXTC-HIFRSBDPSA-N 2 0 234.387 2.274 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1C[NH+]2CCC1CC2)c1ccccn1 ZINC001184135717 979947402 /nfs/dbraw/zinc/94/74/02/979947402.db2.gz UOLFCHJFYYMJAH-GXTWGEPZSA-N 2 0 245.370 2.074 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@H]([NH2+]C[C@@H]3CC[C@@H]4C[C@@H]4C3)[C@@H]2C1 ZINC001184388522 980063257 /nfs/dbraw/zinc/06/32/57/980063257.db2.gz RBCSLZRMNBMZNS-XMEMRUQMSA-N 2 0 248.414 2.352 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+][C@@H]1COC(C)(C)C1 ZINC001184417508 980081716 /nfs/dbraw/zinc/08/17/16/980081716.db2.gz DZIZSBVRDFQWNK-OLZOCXBDSA-N 2 0 242.407 2.264 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+][C@@H]1CCCOCC1 ZINC001184419315 980082747 /nfs/dbraw/zinc/08/27/47/980082747.db2.gz ZLTPHWPRJQRJFK-ZIAGYGMSSA-N 2 0 242.407 2.266 20 0 BEADRP c1cc2c(cc1C1=CCC[NH2+]CC1)C[NH2+]CC2 ZINC001238941020 980379454 /nfs/dbraw/zinc/37/94/54/980379454.db2.gz YPKRFDJEROHONX-UHFFFAOYSA-N 2 0 228.339 2.099 20 0 BEADRP C[C@@H]([NH3+])c1ccc(C2=CCC[NH2+]CC2)cc1 ZINC001238944003 980380726 /nfs/dbraw/zinc/38/07/26/980380726.db2.gz AMULOIYPRSGYJZ-LLVKDONJSA-N 2 0 216.328 2.473 20 0 BEADRP Cc1cccc2c1C1(C[C@@H]2[NH3+])CC[NH2+]CC1 ZINC001239321418 980531545 /nfs/dbraw/zinc/53/15/45/980531545.db2.gz RETVYYZIJKWQDP-LBPRGKRZSA-N 2 0 216.328 2.020 20 0 BEADRP COc1cccc2c1CC[C@H]2[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC001345097410 980547773 /nfs/dbraw/zinc/54/77/73/980547773.db2.gz KVOVJIRUTAAXIR-JTNHKYCSSA-N 2 0 246.354 2.009 20 0 BEADRP CC[C@H](Cc1cccs1)[NH2+]CCCC[NH3+] ZINC001345482983 980617558 /nfs/dbraw/zinc/61/75/58/980617558.db2.gz PTTVKUKCNYEUJS-LLVKDONJSA-N 2 0 226.389 2.398 20 0 BEADRP [NH3+]Cc1cncc(-c2cccc3c2CC[C@H]3[NH3+])c1 ZINC001239804531 980941258 /nfs/dbraw/zinc/94/12/58/980941258.db2.gz RTJKZMWRBCYSFL-OAHLLOKOSA-N 2 0 239.322 2.153 20 0 BEADRP [NH3+]Cc1ccc(-c2csc(C[NH3+])c2)s1 ZINC001347475692 981090215 /nfs/dbraw/zinc/09/02/15/981090215.db2.gz ZUAXYCMWQQRTDJ-UHFFFAOYSA-N 2 0 224.354 2.394 20 0 BEADRP C[C@@H](CNc1cc[nH+]cc1)[N@@H+]1CCC[C@@H](C)C1 ZINC001347773127 981167938 /nfs/dbraw/zinc/16/79/38/981167938.db2.gz UBXIWHSLLFJHHY-OLZOCXBDSA-N 2 0 233.359 2.036 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]C/C=C\c1ccc(F)cc1 ZINC001348515440 981379948 /nfs/dbraw/zinc/37/99/48/981379948.db2.gz MQVQNLZNVMECKQ-MVZIDQBPSA-N 2 0 236.334 2.427 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]C/C=C/c1ccc(F)cc1 ZINC001348515439 981380682 /nfs/dbraw/zinc/38/06/82/981380682.db2.gz MQVQNLZNVMECKQ-AAOUONPWSA-N 2 0 236.334 2.427 20 0 BEADRP C[N@H+](Cc1ccc(C2=CC[NH2+]CC2)nc1)C1CC1 ZINC001240466393 981398600 /nfs/dbraw/zinc/39/86/00/981398600.db2.gz GARHFYCNOBZGDW-UHFFFAOYSA-N 2 0 243.354 2.053 20 0 BEADRP C[N@@H+]1CCc2ccc(C3=CC[NH2+]CC3)cc2C1 ZINC001240470857 981407183 /nfs/dbraw/zinc/40/71/83/981407183.db2.gz VPBLUVJECOPCMH-UHFFFAOYSA-N 2 0 228.339 2.051 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H]1CCC[C@@H]1C(C)C ZINC001348839626 981455303 /nfs/dbraw/zinc/45/53/03/981455303.db2.gz DJXCQEANTNKWKK-JHJVBQTASA-N 2 0 212.381 2.399 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H](C)c1ccc2c(c1)CCO2 ZINC001348852456 981458592 /nfs/dbraw/zinc/45/85/92/981458592.db2.gz MJIUJLHUGPLTPZ-VXGBXAGGSA-N 2 0 248.370 2.270 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H](C)CC(C)(C)C ZINC001348853678 981461071 /nfs/dbraw/zinc/46/10/71/981461071.db2.gz URSMHWGEPCZUFK-MNOVXSKESA-N 2 0 200.370 2.399 20 0 BEADRP C[N@@H+]1CC[C@H](c2ccc(C3=CCC[NH2+]C3)cc2)C1 ZINC001240671350 981582220 /nfs/dbraw/zinc/58/22/20/981582220.db2.gz SNZAUJHHZMJEHY-INIZCTEOSA-N 2 0 242.366 2.482 20 0 BEADRP C[C@@H]([NH3+])c1ccccc1C1=CCC[NH2+]C1 ZINC001240680728 981583784 /nfs/dbraw/zinc/58/37/84/981583784.db2.gz XPZCTKQQCLBIJM-SNVBAGLBSA-N 2 0 202.301 2.083 20 0 BEADRP C(c1cc2[nH]ccc2c[nH+]1)=C1CC[NH2+]CC1 ZINC001240874138 981917546 /nfs/dbraw/zinc/91/75/46/981917546.db2.gz QEOPBNVUHPTUBG-UHFFFAOYSA-N 2 0 213.284 2.330 20 0 BEADRP Cc1ccc(C[NH+]2CC3(C2)CC[NH+](C)CC3)o1 ZINC001203302275 982349377 /nfs/dbraw/zinc/34/93/77/982349377.db2.gz XYUFRVROKVHTIP-UHFFFAOYSA-N 2 0 234.343 2.116 20 0 BEADRP C[NH+](C)Cc1cccc(C2=CC[N@H+](C)CC2)c1 ZINC001241319244 982474212 /nfs/dbraw/zinc/47/42/12/982474212.db2.gz FSPMRTYSLDSVDP-UHFFFAOYSA-N 2 0 230.355 2.467 20 0 BEADRP C[N@H+]1CC=C(c2cccc3c2C[NH2+]CC3)CC1 ZINC001241328096 982487118 /nfs/dbraw/zinc/48/71/18/982487118.db2.gz WYJJMQUTUDBTCY-UHFFFAOYSA-N 2 0 228.339 2.051 20 0 BEADRP CNc1ccccc1CN1C[C@@H](C)CC[C@H]1C[NH3+] ZINC001205838159 982698033 /nfs/dbraw/zinc/69/80/33/982698033.db2.gz BABYIKWGRISICC-JSGCOSHPSA-N 2 0 247.386 2.288 20 0 BEADRP C1=CC[C@@H](C[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)CC1 ZINC000037408316 982941194 /nfs/dbraw/zinc/94/11/94/982941194.db2.gz LKDBLTXRTTVDRA-KGLIPLIRSA-N 2 0 234.387 2.417 20 0 BEADRP C[N@@H+]1CCCC(C)(C)[C@@H]1CNc1cc[nH+]cc1 ZINC001354019911 983117768 /nfs/dbraw/zinc/11/77/68/983117768.db2.gz XTOBXIRDLMNPDX-ZDUSSCGKSA-N 2 0 233.359 2.036 20 0 BEADRP [NH3+]Cc1ccc(-c2[nH+]ccc3c2CCN3)cc1 ZINC001241912640 983127062 /nfs/dbraw/zinc/12/70/62/983127062.db2.gz RMUPMMYMLNVYPT-UHFFFAOYSA-N 2 0 225.295 2.175 20 0 BEADRP [NH3+]Cc1ccc(-c2ccc3c(c2)C[NH2+]CC3)cc1 ZINC001241913338 983130307 /nfs/dbraw/zinc/13/03/07/983130307.db2.gz SKWUBDQPYUGCSA-UHFFFAOYSA-N 2 0 238.334 2.458 20 0 BEADRP COc1cc(Nc2ccc(N)nc2)[nH+]cc1C ZINC001201279959 983158906 /nfs/dbraw/zinc/15/89/06/983158906.db2.gz WOOKTPUQFOMGTN-UHFFFAOYSA-N 2 0 230.271 2.119 20 0 BEADRP C[C@H]([NH3+])c1ccc(C2=C[C@H]3CC[C@@H](C2)[NH2+]3)cn1 ZINC001242027882 983238179 /nfs/dbraw/zinc/23/81/79/983238179.db2.gz PQHDQOMNGHOVKM-BIMULSAOSA-N 2 0 229.327 2.009 20 0 BEADRP C[NH+]1CC2(C1)CC[NH+](CC(C)(C)C)CC2 ZINC001201441377 983246730 /nfs/dbraw/zinc/24/67/30/983246730.db2.gz DCJQUDKRBCGPSG-UHFFFAOYSA-N 2 0 210.365 2.060 20 0 BEADRP CCC[C@@H](C)C[N@@H+]1C[C@H]2CC[NH+](C)C[C@H]2C1 ZINC001201542917 983302893 /nfs/dbraw/zinc/30/28/93/983302893.db2.gz MYSAHGCEGIKMII-MCIONIFRSA-N 2 0 224.392 2.306 20 0 BEADRP CCC(CC)C[N@H+]1C[C@H]2C[NH+](CC)C[C@H]2C1 ZINC001201534208 983326392 /nfs/dbraw/zinc/32/63/92/983326392.db2.gz DSWAXHLETSZXTF-OKILXGFUSA-N 2 0 224.392 2.306 20 0 BEADRP CC[N@H+](C)C1CC[NH+](CCC(C)C)CC1 ZINC001201630042 983359933 /nfs/dbraw/zinc/35/99/33/983359933.db2.gz JABUQYJMWJSWAI-UHFFFAOYSA-N 2 0 212.381 2.449 20 0 BEADRP CCCC[C@@H](O)C[N@H+](CCC)CCC[NH+](C)C ZINC001252098412 983556160 /nfs/dbraw/zinc/55/61/60/983556160.db2.gz VFPNWNYQUYFIBM-CQSZACIVSA-N 2 0 244.423 2.201 20 0 BEADRP C[NH+]1CCC2(C[NH+](CC3CCCC3)C2)CC1 ZINC001202177873 983583988 /nfs/dbraw/zinc/58/39/88/983583988.db2.gz CSUVCQFHIQLGDJ-UHFFFAOYSA-N 2 0 222.376 2.204 20 0 BEADRP CC1(C)CCCC[C@H]1C[N@@H+]1CC[C@@H]2C[NH2+]C[C@@H]21 ZINC000852749668 983758315 /nfs/dbraw/zinc/75/83/15/983758315.db2.gz OXEXSJZIBCCVRD-RDBSUJKOSA-N 2 0 236.403 2.497 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CC[C@@H]3C[N@@H+](C)C[C@H]23)cc1 ZINC001474302674 983901677 /nfs/dbraw/zinc/90/16/77/983901677.db2.gz CKULLGIGSYMHSY-OWCLPIDISA-N 2 0 244.382 2.425 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H](Oc1cccc(C[NH3+])c1)C2 ZINC000150044189 983965334 /nfs/dbraw/zinc/96/53/34/983965334.db2.gz VNEUTDVWEUAGTD-AGGWBTHJSA-N 2 0 246.354 2.149 20 0 BEADRP C[C@@H]1CC[C@@H]([N@@H+]2CC[C@]3(CC[NH+](C)C3)C2)C1 ZINC000339211247 984022015 /nfs/dbraw/zinc/02/20/15/984022015.db2.gz GUJCFSZJSRVAHS-MCIONIFRSA-N 2 0 222.376 2.203 20 0 BEADRP CC(C)n1cncc1C[NH2+][C@H](C)CCCC[NH3+] ZINC001575942726 984137516 /nfs/dbraw/zinc/13/75/16/984137516.db2.gz HSZDAJQSMOCRLY-GFCCVEGCSA-N 2 0 238.379 2.071 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@]2(C)CC[NH2+]C2)C[C@H]1C ZINC001576669906 984178266 /nfs/dbraw/zinc/17/82/66/984178266.db2.gz BZEFTJBPYCDNRQ-YIYPIFLZSA-N 2 0 224.392 2.400 20 0 BEADRP CCCCC[C@@H](O)C[NH2+]CCC[NH+](CC)CC ZINC001253522362 984192757 /nfs/dbraw/zinc/19/27/57/984192757.db2.gz KSZHMNSDFCZXSX-CQSZACIVSA-N 2 0 244.423 2.249 20 0 BEADRP C[C@@H]1C[N@H+](CC2CCC2)CCC[C@H]1C[NH3+] ZINC001205983891 984214329 /nfs/dbraw/zinc/21/43/29/984214329.db2.gz PVOLCLPQHRVRIP-YPMHNXCESA-N 2 0 210.365 2.093 20 0 BEADRP [NH3+]CC[C@@H]1CC[N@H+](C[C@@H]2C[C@@H]2c2ccccc2)C1 ZINC001580288773 984498846 /nfs/dbraw/zinc/49/88/46/984498846.db2.gz XMZPOFUAJMLHHK-VNQPRFMTSA-N 2 0 244.382 2.461 20 0 BEADRP C[N@@H+]1CCCC[C@@H]1c1ccc(C2=CC[NH2+]C2)nc1 ZINC001243108276 984556828 /nfs/dbraw/zinc/55/68/28/984556828.db2.gz NYLJPWKBALKAOS-OAHLLOKOSA-N 2 0 243.354 2.225 20 0 BEADRP [NH3+]C1(c2cccc(C3=CC[NH2+]C3)c2)CCC1 ZINC001243112309 984583324 /nfs/dbraw/zinc/58/33/24/984583324.db2.gz WRMZFIACQYVNDM-UHFFFAOYSA-N 2 0 214.312 2.011 20 0 BEADRP Cc1ccc(C2=CC[NH2+]C2)c(C[NH+](C)C)c1 ZINC001243116053 984587162 /nfs/dbraw/zinc/58/71/62/984587162.db2.gz PPYVOIRAOXHLJU-UHFFFAOYSA-N 2 0 216.328 2.043 20 0 BEADRP C[C@@H](Cc1ccncc1)[NH2+]CC(C)(C)C[NH+](C)C ZINC001256723545 984769414 /nfs/dbraw/zinc/76/94/14/984769414.db2.gz WBBSPJUBSHXTAI-ZDUSSCGKSA-N 2 0 249.402 2.190 20 0 BEADRP C[N@@H+]1CCCC2(CC[NH+](Cc3cc[nH]c3)CC2)C1 ZINC001276103786 984817451 /nfs/dbraw/zinc/81/74/51/984817451.db2.gz POHIGQMYTCOGLS-UHFFFAOYSA-N 2 0 247.386 2.323 20 0 BEADRP Cl/C=C/C[N@@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001326801159 984823977 /nfs/dbraw/zinc/82/39/77/984823977.db2.gz UENXWPGAIBKTAE-QHHAFSJGSA-N 2 0 228.767 2.205 20 0 BEADRP CCS[C@H]1CCCC[C@H]1[NH2+]C[C@H]1CCC[NH2+]1 ZINC001578217082 984870591 /nfs/dbraw/zinc/87/05/91/984870591.db2.gz YXTSNXITQOIOPW-UPJWGTAASA-N 2 0 242.432 2.392 20 0 BEADRP CCc1cccc(C[NH2+][C@@H]2C[C@@H]([NH3+])C2(C)C)c1 ZINC001578266173 984904495 /nfs/dbraw/zinc/90/44/95/984904495.db2.gz BSKHEGWEMMMUKP-ZIAGYGMSSA-N 2 0 232.371 2.464 20 0 BEADRP CCc1ccc(C[N@@H+]2CC[C@@H](C[NH3+])[C@H](C)C2)nc1 ZINC001578260056 984910480 /nfs/dbraw/zinc/91/04/80/984910480.db2.gz ZXIYFMNJBGNITB-OCCSQVGLSA-N 2 0 247.386 2.061 20 0 BEADRP CCc1ccc(C[N@@H+]2CC[C@@H](C[NH3+])[C@@H](C)C2)nc1 ZINC001578260055 984913147 /nfs/dbraw/zinc/91/31/47/984913147.db2.gz ZXIYFMNJBGNITB-JSGCOSHPSA-N 2 0 247.386 2.061 20 0 BEADRP CO[C@H](C[NH2+]C1(C[NH3+])CCCCC1)CC(C)C ZINC001578912591 985517407 /nfs/dbraw/zinc/51/74/07/985517407.db2.gz JNLSGTLRSCCDPZ-ZDUSSCGKSA-N 2 0 242.407 2.299 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[N@@H+]2CCC[C@H]2C2CCC2)C1 ZINC000688148501 985571778 /nfs/dbraw/zinc/57/17/78/985571778.db2.gz OECYIUVFQQBJML-YUTCNCBUSA-N 2 0 222.376 2.378 20 0 BEADRP c1cc(C2=C[NH2+]CCC2)cc2c1C[NH2+]C2 ZINC001243949334 985638803 /nfs/dbraw/zinc/63/88/03/985638803.db2.gz GIBGFVNUUGSPSS-UHFFFAOYSA-N 2 0 200.285 2.014 20 0 BEADRP Nc1[nH+]ccn1-c1ccc(C2=C[NH2+]CCC2)cc1 ZINC001243952863 985660998 /nfs/dbraw/zinc/66/09/98/985660998.db2.gz WWXGFPZKWKYPRY-UHFFFAOYSA-N 2 0 240.310 2.179 20 0 BEADRP C[NH2+]Cc1ccccc1C1=C[NH2+]CCC1 ZINC001243954089 985668521 /nfs/dbraw/zinc/66/85/21/985668521.db2.gz PWZLZIWXDUJYKR-UHFFFAOYSA-N 2 0 202.301 2.130 20 0 BEADRP CS[C@H]1C[C@H]([NH2+]Cc2cccc(C[NH3+])c2)C1 ZINC001579385311 985869090 /nfs/dbraw/zinc/86/90/90/985869090.db2.gz YFHDPVZMRSVKLE-JOCQHMNTSA-N 2 0 236.384 2.129 20 0 BEADRP C[C@@H]([NH2+]CCOCC[NH3+])c1ccc(Cl)s1 ZINC001579414493 985887117 /nfs/dbraw/zinc/88/71/17/985887117.db2.gz ADHNUAWVNDOLNN-MRVPVSSYSA-N 2 0 248.779 2.027 20 0 BEADRP CCC(CC)C[N@@H+]1C[C@H]2C[NH+](C)C[C@@]2(C)C1 ZINC001460864755 985923765 /nfs/dbraw/zinc/92/37/65/985923765.db2.gz RKYYYQGRRIOHQB-KGLIPLIRSA-N 2 0 224.392 2.306 20 0 BEADRP C[C@@H](CC1CC1)[NH+]1CCC2(C[NH+](C)C2)CC1 ZINC001258474403 985943158 /nfs/dbraw/zinc/94/31/58/985943158.db2.gz TYZCILWVTHJAEN-LBPRGKRZSA-N 2 0 222.376 2.203 20 0 BEADRP C[C@H]([NH2+]CCOCC[NH3+])c1ccc(Cl)s1 ZINC001579485603 986007499 /nfs/dbraw/zinc/00/74/99/986007499.db2.gz ADHNUAWVNDOLNN-QMMMGPOBSA-N 2 0 248.779 2.027 20 0 BEADRP Cc1cc(C[N@H+]2CCC[C@@H]([C@H](C)[NH3+])C2)cc(C)n1 ZINC001579598175 986113094 /nfs/dbraw/zinc/11/30/94/986113094.db2.gz GYXKIMXDXZRSCI-DZGCQCFKSA-N 2 0 247.386 2.258 20 0 BEADRP Cc1ccc(C2CC([NH2+][C@@H]3[C@H]4C[NH2+]C[C@H]43)C2)cc1 ZINC001579677883 986173248 /nfs/dbraw/zinc/17/32/48/986173248.db2.gz FEMAUAWUSFUZAB-LISQQWEMSA-N 2 0 242.366 2.048 20 0 BEADRP CC[C@@H](C)C[C@H](CC)NC(=[NH2+])NCCCC[NH3+] ZINC001258779961 986174291 /nfs/dbraw/zinc/17/42/91/986174291.db2.gz JHNGZKSPLFJAKZ-NEPJUHHUSA-N 2 0 242.411 2.054 20 0 BEADRP Cc1ccc(C[NH2+]CC2(C[NH3+])CCC2)cc1F ZINC001579696801 986194592 /nfs/dbraw/zinc/19/45/92/986194592.db2.gz GBZDXZBRBHZBTE-UHFFFAOYSA-N 2 0 236.334 2.353 20 0 BEADRP Cc1cccc(C[N@H+](C)CCC2C[NH2+]C2)c1C ZINC001579760413 986218541 /nfs/dbraw/zinc/21/85/41/986218541.db2.gz AUTSMPBFLIVJJR-UHFFFAOYSA-N 2 0 232.371 2.345 20 0 BEADRP Cc1cccnc1[C@@H](C)[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC001579808118 986223000 /nfs/dbraw/zinc/22/30/00/986223000.db2.gz ZKLGXQFVVGMIOP-ZIAGYGMSSA-N 2 0 247.386 2.430 20 0 BEADRP Cc1c[nH+]ccc1N1CC[NH+](CC2CCC2)CC1 ZINC001202792159 986309085 /nfs/dbraw/zinc/30/90/85/986309085.db2.gz JYKJUKLWXCHUAG-UHFFFAOYSA-N 2 0 245.370 2.312 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[N@H+](CC)CCOC ZINC001258907623 986310294 /nfs/dbraw/zinc/31/02/94/986310294.db2.gz LKWNEPLGCGCMCY-CQSZACIVSA-N 2 0 244.423 2.465 20 0 BEADRP CC[NH+]1CCC(C[NH2+]C2CC=CC2)CC1 ZINC001462408214 986378025 /nfs/dbraw/zinc/37/80/25/986378025.db2.gz COKXQGVWDQMMNS-UHFFFAOYSA-N 2 0 208.349 2.027 20 0 BEADRP FC(F)(F)CCC[NH2+]C[C@@H]1CCC[NH2+]CC1 ZINC001580018281 986417416 /nfs/dbraw/zinc/41/74/16/986417416.db2.gz FLHLSFDGRHROKA-SNVBAGLBSA-N 2 0 238.297 2.308 20 0 BEADRP C[C@@H]1CCCC[C@H]1[NH2+]C[C@H]1C[NH+]2CCC1CC2 ZINC001462635599 986462944 /nfs/dbraw/zinc/46/29/44/986462944.db2.gz MHQWSMOQYMMCIG-VHDGCEQUSA-N 2 0 236.403 2.497 20 0 BEADRP CO[C@@H](C)C[NH2+]C1CCC(C)([NH+]2CCC2)CC1 ZINC001462629520 986466348 /nfs/dbraw/zinc/46/63/48/986466348.db2.gz BSNLLHCGMAOZEU-HSBZDZAISA-N 2 0 240.391 2.018 20 0 BEADRP [NH3+][C@H](C[NH2+]CC1CCC=CCC1)CC(F)F ZINC001580132950 986597810 /nfs/dbraw/zinc/59/78/10/986597810.db2.gz SEEVLANYIDNSQG-NSHDSACASA-N 2 0 232.318 2.305 20 0 BEADRP [NH3+]C1(C[NH2+][C@H]2C[C@@H]3CCC[C@@H]32)CCCC1 ZINC001580152751 986626057 /nfs/dbraw/zinc/62/60/57/986626057.db2.gz UERCRXLDMMGTQO-SRVKXCTJSA-N 2 0 208.349 2.036 20 0 BEADRP [NH3+]C1CC([NH2+]CCC[C@H]2CC2(Cl)Cl)C1 ZINC001580167019 986642097 /nfs/dbraw/zinc/64/20/97/986642097.db2.gz ZAJJGPOMOWFHHD-UEJVZZJDSA-N 2 0 237.174 2.040 20 0 BEADRP [NH3+][C@@H]1CC12CC([NH2+]C[C@H]1C[C@@H]1C1CCCC1)C2 ZINC001580167205 986644309 /nfs/dbraw/zinc/64/43/09/986644309.db2.gz VQZJLMJACAYBNK-HNBOJAAESA-N 2 0 234.387 2.282 20 0 BEADRP [NH3+][C@@H]1C[C@H]2C[C@@H](C1)[N@H+](CC1CC3(CCC3)C1)C2 ZINC001580169460 986646172 /nfs/dbraw/zinc/64/61/72/986646172.db2.gz FYWGLMSFTTYTGQ-YUTCNCBUSA-N 2 0 234.387 2.378 20 0 BEADRP [NH3+]CC1(C[N@@H+]2CC[C@H]2Cc2ccccc2)CC1 ZINC001580243956 986694386 /nfs/dbraw/zinc/69/43/86/986694386.db2.gz NGNMWYLETCDJJB-AWEZNQCLSA-N 2 0 230.355 2.042 20 0 BEADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@@H]2C[C@]2(F)c2ccccc2)C1 ZINC001580258256 986716549 /nfs/dbraw/zinc/71/65/49/986716549.db2.gz LGXPSWIIKGJBMB-BEAPCOKYSA-N 2 0 248.345 2.341 20 0 BEADRP Cc1cc(C)c(C[NH+]2CCC3(C[NH+](C)C3)CC2)[nH]1 ZINC001137331253 986790111 /nfs/dbraw/zinc/79/01/11/986790111.db2.gz WYWNMEURINKLNS-UHFFFAOYSA-N 2 0 247.386 2.159 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[NH2+][C@@H](c2cccnc2)C2CC2)C1 ZINC001580389496 986816879 /nfs/dbraw/zinc/81/68/79/986816879.db2.gz KJWWQWUFTJRZNF-NILFDRSVSA-N 2 0 245.370 2.250 20 0 BEADRP [NH3+]Cc1cnccc1-c1cccc2c1CC[C@H]2[NH3+] ZINC001245559898 986953881 /nfs/dbraw/zinc/95/38/81/986953881.db2.gz IKBLMPWXPWFNRG-OAHLLOKOSA-N 2 0 239.322 2.153 20 0 BEADRP CCC[N@H+](CCC[NH3+])[C@H](C)CC(F)(F)F ZINC001255632507 987032910 /nfs/dbraw/zinc/03/29/10/987032910.db2.gz AYUWWMHABFTHFQ-SECBINFHSA-N 2 0 226.286 2.388 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[N@H+](CCCO)C(C)C ZINC001255964432 987102053 /nfs/dbraw/zinc/10/20/53/987102053.db2.gz SIGWSCAXHAVEAE-AWEZNQCLSA-N 2 0 244.423 2.200 20 0 BEADRP CC(C)([NH3+])c1ccc(-c2ccnc(C[NH3+])c2)cc1 ZINC001245909383 987135111 /nfs/dbraw/zinc/13/51/11/987135111.db2.gz NPPGRXUIVRZQDV-UHFFFAOYSA-N 2 0 241.338 2.401 20 0 BEADRP C[C@H]([NH3+])[C@H]1CC[N@H+](C[C@@H]2CC3CCC2CC3)C1 ZINC000691657812 987288527 /nfs/dbraw/zinc/28/85/27/987288527.db2.gz AIQKXNBCFRNUME-IIZVFWCOSA-N 2 0 236.403 2.482 20 0 BEADRP CCC(C)(C)[C@H](C)[NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23 ZINC000695155655 987334410 /nfs/dbraw/zinc/33/44/10/987334410.db2.gz ZMEUBRDOPVCUAK-BSCCGWMCSA-N 2 0 236.403 2.397 20 0 BEADRP C[C@@H]([NH2+]CC(C)(C)C(C)(F)F)[C@H]1CCC[NH2+]1 ZINC000696597696 987344021 /nfs/dbraw/zinc/34/40/21/987344021.db2.gz KAXPLWZGFZAGHE-NXEZZACHSA-N 2 0 234.334 2.398 20 0 BEADRP CC(C)[C@@H]1CC[N@H+](C[C@H]2CCCC[NH2+]C2)C1 ZINC000697052267 987346430 /nfs/dbraw/zinc/34/64/30/987346430.db2.gz MKKSDCIUTCTBJR-UONOGXRCSA-N 2 0 224.392 2.354 20 0 BEADRP CC[C@@H]1C[C@@H](C)C[N@@H+]1C[C@H]1CCCC[NH2+]C1 ZINC000697037160 987347069 /nfs/dbraw/zinc/34/70/69/987347069.db2.gz OBGWUAAIFFDMND-HZSPNIEDSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)[C@H]1CC[N@H+](C[C@H]2CCCC[NH2+]C2)C1 ZINC000697052264 987347150 /nfs/dbraw/zinc/34/71/50/987347150.db2.gz MKKSDCIUTCTBJR-KBPBESRZSA-N 2 0 224.392 2.354 20 0 BEADRP CC1(C)C[N@H+](C[C@H]2CCCC[NH2+]C2)CCS1 ZINC000697054715 987347174 /nfs/dbraw/zinc/34/71/74/987347174.db2.gz DSPWJTZBILRIJP-LBPRGKRZSA-N 2 0 242.432 2.204 20 0 BEADRP CC(C)CC[N@H+](C)C[C@@H]1CCCC[NH2+]C1 ZINC000697041140 987347589 /nfs/dbraw/zinc/34/75/89/987347589.db2.gz LQTGFVOFLVZTRO-CYBMUJFWSA-N 2 0 212.381 2.354 20 0 BEADRP C(C1CC1)[NH+](CC1CC1)C[C@@H]1CCCC[NH2+]C1 ZINC000697063035 987348281 /nfs/dbraw/zinc/34/82/81/987348281.db2.gz LXDAEEYMVUSKLA-OAHLLOKOSA-N 2 0 236.403 2.498 20 0 BEADRP CC1(C)CC[N@H+](C[C@H]2CCCC[NH2+]C2)C1 ZINC000697038342 987348824 /nfs/dbraw/zinc/34/88/24/987348824.db2.gz BRJHIZFSNVCKBA-LBPRGKRZSA-N 2 0 210.365 2.108 20 0 BEADRP CC1(C)[C@@H]2C[C@H]([NH2+]CC3([NH3+])CCCC3)C[C@@H]21 ZINC001246075057 987364604 /nfs/dbraw/zinc/36/46/04/987364604.db2.gz GXMKHANAMULJBL-ZSBIGDGJSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CCCCCCCC[NH3+])CC[NH2+]1 ZINC001246074655 987364877 /nfs/dbraw/zinc/36/48/77/987364877.db2.gz BDLSUIIZKKVMNN-UONOGXRCSA-N 3 0 241.423 2.016 20 0 BEADRP C[C@H](CC[NH2+]CC1(C)CCCC1)[NH+](C)C ZINC000697823885 987365790 /nfs/dbraw/zinc/36/57/90/987365790.db2.gz JLKXBZPTDOUSQC-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@H]1CC[C@H]([NH2+]CC2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000699314186 987372716 /nfs/dbraw/zinc/37/27/16/987372716.db2.gz JDZGVEDESPXGLI-FJCXZIGKSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@@H]1CC[C@H](n2ccc3cc(C[NH3+])ccc32)C[NH2+]1 ZINC001246085400 987387233 /nfs/dbraw/zinc/38/72/33/987387233.db2.gz QPKAFUUDYXSVGS-RISCZKNCSA-N 2 0 243.354 2.413 20 0 BEADRP [NH3+]Cc1ccc2c(ccn2[C@H]2CCC[NH2+]C2)c1 ZINC001246087616 987388705 /nfs/dbraw/zinc/38/87/05/987388705.db2.gz ZGZYFFAMCKSBMG-ZDUSSCGKSA-N 2 0 229.327 2.025 20 0 BEADRP CCSC[C@H](C)[NH2+]C[C@@H]1CC[C@@H](C)[NH2+]C1 ZINC001246091237 987397979 /nfs/dbraw/zinc/39/79/79/987397979.db2.gz HJOISSTTYCGNMM-GRYCIOLGSA-N 2 0 230.421 2.106 20 0 BEADRP Cc1ccc(CC[NH2+][C@H]2CC[NH2+][C@H](C)C2)cc1 ZINC001246094066 987402340 /nfs/dbraw/zinc/40/23/40/987402340.db2.gz FORSHUAZPVABPG-HIFRSBDPSA-N 2 0 232.371 2.268 20 0 BEADRP C[C@H]1CC[C@H](C[NH2+]C2Cc3ccccc3C2)C[NH2+]1 ZINC001246095093 987405448 /nfs/dbraw/zinc/40/54/48/987405448.db2.gz JSJHPOTWGPEVBL-STQMWFEESA-N 2 0 244.382 2.132 20 0 BEADRP CSCC[C@H](C)[NH2+]C[C@H]1CC[C@@H](C)[NH2+]C1 ZINC001246099007 987413294 /nfs/dbraw/zinc/41/32/94/987413294.db2.gz QYDFQXGMGDCZIQ-WOPDTQHZSA-N 2 0 230.421 2.106 20 0 BEADRP C[C@@H]1CC[C@@H](C[NH2+][C@@H]2C[C@@H]3[C@H](C2)C3(C)C)C[NH2+]1 ZINC001246098915 987414691 /nfs/dbraw/zinc/41/46/91/987414691.db2.gz QKGVTEMIRQWZTH-KSTCHIGDSA-N 2 0 236.403 2.399 20 0 BEADRP CCC[C@H](CC)[NH2+]C[C@H]1C[NH2+]C[C@@H](C)C1 ZINC001246105738 987433887 /nfs/dbraw/zinc/43/38/87/987433887.db2.gz WPSXYEUDHYDKAZ-XQQFMLRXSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H](CC1CC1)[NH2+]C[C@@H]1C[NH2+]C[C@@H](C)C1 ZINC001246107188 987437697 /nfs/dbraw/zinc/43/76/97/987437697.db2.gz ZITXRHSFIMEARC-LOWVWBTDSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@H]1CC[C@H](n2cc(C[NH3+])c3ccccc32)C[NH2+]1 ZINC001246109275 987442001 /nfs/dbraw/zinc/44/20/01/987442001.db2.gz NDQNMEDHIDIKDG-AAEUAGOBSA-N 2 0 243.354 2.413 20 0 BEADRP [NH3+]Cc1cn([C@H]2CCC[NH2+]C2)c2ccccc12 ZINC001246111362 987444674 /nfs/dbraw/zinc/44/46/74/987444674.db2.gz YRPSWFHIRSHRQL-LBPRGKRZSA-N 2 0 229.327 2.025 20 0 BEADRP CCC[C@H](CC)[NH2+]C[C@@H]1C[NH2+]CC[C@H]1C ZINC001246116544 987460477 /nfs/dbraw/zinc/46/04/77/987460477.db2.gz WKVDUMBYZJBGHQ-AGIUHOORSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H]1C[NH2+]C[C@@H]1C[NH2+][C@@H]1CCCC(C)(C)C1 ZINC001246111692 987447893 /nfs/dbraw/zinc/44/78/93/987447893.db2.gz PYEZZNQHHHXZHC-JHJVBQTASA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H](CC1CC1)[NH2+]C[C@H]1C[NH2+]CC[C@@H]1C ZINC001246113427 987449015 /nfs/dbraw/zinc/44/90/15/987449015.db2.gz QUPXKJGNOSJSHK-DMDPSCGWSA-N 2 0 210.365 2.010 20 0 BEADRP CCC[C@H](CC)[NH2+]C[C@@H]1C[NH2+]CC[C@@H]1C ZINC001246116546 987458656 /nfs/dbraw/zinc/45/86/56/987458656.db2.gz WKVDUMBYZJBGHQ-AVGNSLFASA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H]1CCC[C@@H]([NH2+][C@H]2CCCC[NH2+]C2)C1 ZINC001246117625 987458878 /nfs/dbraw/zinc/45/88/78/987458878.db2.gz RZPNTTPNBWRBBY-XQQFMLRXSA-N 2 0 210.365 2.297 20 0 BEADRP CCCCC(CCCC)[NH2+]CCC1(O)C[NH2+]C1 ZINC001246118019 987463922 /nfs/dbraw/zinc/46/39/22/987463922.db2.gz NWDIWJYPOHREIJ-UHFFFAOYSA-N 2 0 242.407 2.049 20 0 BEADRP C[C@@H]1CC[NH2+]C[C@@H]1C[NH2+][C@@H]1C[C@@H]2[C@H](C1)C2(C)C ZINC001246121491 987468420 /nfs/dbraw/zinc/46/84/20/987468420.db2.gz RIKVQOMZWZZTJL-KSTCHIGDSA-N 2 0 236.403 2.256 20 0 BEADRP CC[C@@H](C)[NH2+][C@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246123369 987472277 /nfs/dbraw/zinc/47/22/77/987472277.db2.gz AKSHBXPLXDYBMB-NEPJUHHUSA-N 2 0 210.365 2.297 20 0 BEADRP C1CC12CCC([NH2+][C@H]1C[NH2+]CC13CC3)CC2 ZINC001246133408 987489455 /nfs/dbraw/zinc/48/94/55/987489455.db2.gz NUMVBNNELROZRA-LBPRGKRZSA-N 2 0 220.360 2.051 20 0 BEADRP C1C[C@@H]([NH2+][C@@H]2CCC3(C2)CC[NH2+]CC3)CS1 ZINC001246133798 987489555 /nfs/dbraw/zinc/48/95/55/987489555.db2.gz QSPDMMLEPBLNNF-VXGBXAGGSA-N 2 0 240.416 2.004 20 0 BEADRP C1CC12C[NH2+]C[C@H]2[NH2+]C1CCCCCC1 ZINC001246137163 987492542 /nfs/dbraw/zinc/49/25/42/987492542.db2.gz ZKOWSNMRURQFPB-GFCCVEGCSA-N 2 0 208.349 2.051 20 0 BEADRP CCC[C@H](C)CC[C@@H](C)[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001246147888 987501803 /nfs/dbraw/zinc/50/18/03/987501803.db2.gz LBHJASKSCWHGJJ-MEBFFEOJSA-N 2 0 224.392 2.399 20 0 BEADRP CCCC[C@H](CCC)[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001246144917 987503876 /nfs/dbraw/zinc/50/38/76/987503876.db2.gz BZUNSYDGWLAUQX-WUHRBBMRSA-N 2 0 210.365 2.153 20 0 BEADRP [NH3+]Cc1ccc2ccn(C3CC[NH2+]CC3)c2c1 ZINC001246171968 987537227 /nfs/dbraw/zinc/53/72/27/987537227.db2.gz XXADOMUWEHDCAT-UHFFFAOYSA-N 2 0 229.327 2.025 20 0 BEADRP CCC1CCC([NH2+][C@H]2C[NH2+][C@H](C)C2)CC1 ZINC001246174034 987538021 /nfs/dbraw/zinc/53/80/21/987538021.db2.gz WDGWBOFLIVYSAX-IKWCTNDRSA-N 2 0 210.365 2.295 20 0 BEADRP CCC1CCC([NH2+][C@@H]2C[NH2+][C@H](C)C2)CC1 ZINC001246174036 987538818 /nfs/dbraw/zinc/53/88/18/987538818.db2.gz WDGWBOFLIVYSAX-XVSSEFHLSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CCCc2cccs2)CC[NH2+]1 ZINC001246171512 987540248 /nfs/dbraw/zinc/54/02/48/987540248.db2.gz WHLQINKITSLFKF-NWDGAFQWSA-N 2 0 238.400 2.411 20 0 BEADRP C[C@H]([NH2+]C1C[C@@H](C)[NH2+][C@H](C)C1)c1cccc(N)c1 ZINC001246177567 987546805 /nfs/dbraw/zinc/54/68/05/987546805.db2.gz UGHLVUHRIYOBPG-UTUOFQBUSA-N 2 0 247.386 2.448 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[NH2+]C(C)(C)C1)c1cccc(N)c1 ZINC001246178000 987547763 /nfs/dbraw/zinc/54/77/63/987547763.db2.gz XNMSHELSWXSERG-FZMZJTMJSA-N 2 0 247.386 2.450 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[NH2+]C(C)(C)C1)c1cccc(N)c1 ZINC001246178001 987549139 /nfs/dbraw/zinc/54/91/39/987549139.db2.gz XNMSHELSWXSERG-RISCZKNCSA-N 2 0 247.386 2.450 20 0 BEADRP Cc1cccc2c1CC[C@H]([NH2+]C[C@H]1CCC[NH2+]1)C2 ZINC001246188403 987571314 /nfs/dbraw/zinc/57/13/14/987571314.db2.gz WNIFTBWSROALRJ-LSDHHAIUSA-N 2 0 244.382 2.194 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CC[NH2+]2)CC(C)(C)C1 ZINC001246192669 987577832 /nfs/dbraw/zinc/57/78/32/987577832.db2.gz JHPGLFIUQJOVBS-GRYCIOLGSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]1C[C@H]([NH2+][C@@H]2CCc3ccccc32)CC[NH2+]1 ZINC001246189709 987579776 /nfs/dbraw/zinc/57/97/76/987579776.db2.gz JHXCZYYSHXFYTG-NJZAAPMLSA-N 2 0 230.355 2.404 20 0 BEADRP CC1(C)[C@@H]2C[C@H]([NH2+]C[C@H]3CCC[NH2+]C3)C[C@@H]21 ZINC001246199641 987594135 /nfs/dbraw/zinc/59/41/35/987594135.db2.gz YDALLTRUGBPJNN-RVMXOQNASA-N 2 0 222.376 2.010 20 0 BEADRP CC[C@H](CC(C)C)[NH2+]C[C@H]1CCC[NH2+]C1 ZINC001246199708 987595664 /nfs/dbraw/zinc/59/56/64/987595664.db2.gz ZDTAHDHVJMODHH-QWHCGFSZSA-N 2 0 212.381 2.400 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@H]2Cc3cccc(F)c3C2)C1 ZINC001246205273 987599627 /nfs/dbraw/zinc/59/96/27/987599627.db2.gz KMKDATUIJBEPIS-UPJWGTAASA-N 2 0 248.345 2.152 20 0 BEADRP C[C@@H]1CC[C@@H](N[C@@H]2CCNc3ccccc32)C[NH2+]1 ZINC001246229910 987627430 /nfs/dbraw/zinc/62/74/30/987627430.db2.gz LWTPRBXLSTYHSA-LALPHHSUSA-N 2 0 245.370 2.273 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]Cc2c[nH]c3ccccc23)CC[NH2+]1 ZINC001246238271 987639130 /nfs/dbraw/zinc/63/91/30/987639130.db2.gz FPVIWBYERNKEEG-YPMHNXCESA-N 2 0 243.354 2.398 20 0 BEADRP CCC1([NH2+][C@@H]2C[NH2+][C@@H](C)C2)CCCCC1 ZINC001246253245 987653930 /nfs/dbraw/zinc/65/39/30/987653930.db2.gz DDLJPYKBZYOWQK-RYUDHWBXSA-N 2 0 210.365 2.439 20 0 BEADRP C[C@H]1CC[C@H]([NH2+][C@@H]2CCCC[NH2+]C2)CC1 ZINC001246264694 987658014 /nfs/dbraw/zinc/65/80/14/987658014.db2.gz OPSPVZOOYBNHSQ-JHJVBQTASA-N 2 0 210.365 2.297 20 0 BEADRP CCC[NH2+]CC[NH2+][C@H](CC)CC(C)C ZINC001246273329 987665319 /nfs/dbraw/zinc/66/53/19/987665319.db2.gz YXNOZVFXUVHHGT-GFCCVEGCSA-N 2 0 200.370 2.400 20 0 BEADRP C[C@H]1C[C@H](N[C@@H]2CCc3ccc(O)cc32)CC[NH2+]1 ZINC001246285039 987677856 /nfs/dbraw/zinc/67/78/56/987677856.db2.gz FDWCCVPCWHXMTQ-JVLSTEMRSA-N 2 0 246.354 2.110 20 0 BEADRP Cc1cccc(C(=[NH2+])N[C@@H]2CC[NH2+][C@H](C)C2)c1 ZINC001246286352 987678897 /nfs/dbraw/zinc/67/88/97/987678897.db2.gz WVPHVKSNOFORRI-DGCLKSJQSA-N 2 0 231.343 2.050 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@H]1CCO[C@@H](c2ccccc2)C1 ZINC001246302710 987700121 /nfs/dbraw/zinc/70/01/21/987700121.db2.gz AGJKZKKTNKLCQS-AEGPPILISA-N 2 0 248.370 2.234 20 0 BEADRP CSC(C)(C)C[C@@H](C)[NH2+]CC[C@H](C)[NH3+] ZINC001246303285 987700781 /nfs/dbraw/zinc/70/07/81/987700781.db2.gz GEIZCNLOXRXRDV-VHSXEESVSA-N 2 0 218.410 2.234 20 0 BEADRP Cc1ccc2c(c1)C[C@H]([NH2+]CC[C@H](C)[NH3+])CC2 ZINC001246302525 987700865 /nfs/dbraw/zinc/70/08/65/987700865.db2.gz ZCYXYRZVJRKRPX-SWLSCSKDSA-N 2 0 232.371 2.179 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@@H]1CCc2c(C)cccc2C1 ZINC001246315725 987720268 /nfs/dbraw/zinc/72/02/68/987720268.db2.gz VPUGFHTVZIDSJU-ZIAGYGMSSA-N 2 0 232.371 2.179 20 0 BEADRP [NH3+]CCc1cc2ccccc2n1[C@H]1CCC[NH2+]C1 ZINC001246319786 987723221 /nfs/dbraw/zinc/72/32/21/987723221.db2.gz OMYWGKCTWFDCPG-AWEZNQCLSA-N 2 0 243.354 2.067 20 0 BEADRP C[C@H]1C[C@H](n2ccc3cccc(C[NH3+])c32)CC[NH2+]1 ZINC001246325906 987732803 /nfs/dbraw/zinc/73/28/03/987732803.db2.gz KISDGNYIKRWDEW-SMDDNHRTSA-N 2 0 243.354 2.413 20 0 BEADRP C[C@H]1C[C@H]([NH2+]C(C)(C)c2ccncc2)CC[NH2+]1 ZINC001246329025 987734649 /nfs/dbraw/zinc/73/46/49/987734649.db2.gz MWGLSKBINULLTL-WCQYABFASA-N 2 0 233.359 2.047 20 0 BEADRP Cc1ccc(C[C@@H](C)[NH2+]C[C@H]([NH3+])C(C)C)cc1 ZINC001246333504 987741609 /nfs/dbraw/zinc/74/16/09/987741609.db2.gz RABNKXOZUHFBTK-HIFRSBDPSA-N 2 0 234.387 2.499 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCC[C@@H]2C)CC[NH2+]1 ZINC001246333956 987743203 /nfs/dbraw/zinc/74/32/03/987743203.db2.gz SQSCZDJTWXXKFS-QNWHQSFQSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@@H]1CCCC[C@H]1[NH2+][C@H]1CC[NH2+][C@@H](C)C1 ZINC001246336137 987746423 /nfs/dbraw/zinc/74/64/23/987746423.db2.gz SQSCZDJTWXXKFS-MROQNXINSA-N 2 0 210.365 2.295 20 0 BEADRP CCOCC[C@@H](C)[NH2+][C@@]12CC[C@@]([NH3+])(C1)CCC2 ZINC001246343413 987751595 /nfs/dbraw/zinc/75/15/95/987751595.db2.gz XZXYKVDSLJNUMB-MCIONIFRSA-N 2 0 240.391 2.195 20 0 BEADRP COCc1ccc(C[NH2+][C@H]2CC[NH2+][C@H](C)C2)cc1 ZINC001246368028 987770101 /nfs/dbraw/zinc/77/01/01/987770101.db2.gz NPVDZHBTXALIFR-DOMZBBRYSA-N 2 0 248.370 2.063 20 0 BEADRP COCc1ccc(C[NH2+][C@@H]2CC[NH2+][C@H](C)C2)cc1 ZINC001246368031 987770342 /nfs/dbraw/zinc/77/03/42/987770342.db2.gz NPVDZHBTXALIFR-IUODEOHRSA-N 2 0 248.370 2.063 20 0 BEADRP CCC1([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)CCC1 ZINC001246390436 987779196 /nfs/dbraw/zinc/77/91/96/987779196.db2.gz YDAJZNKEBCBKAK-FOSCPWQOSA-N 2 0 208.349 2.192 20 0 BEADRP Fc1ccc2c(c1)C[C@H]([NH2+]C1CC[NH2+]CC1)CC2 ZINC001246399568 987784370 /nfs/dbraw/zinc/78/43/70/987784370.db2.gz ZKOOEWOGJYJDOU-OAHLLOKOSA-N 2 0 248.345 2.025 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]C(C)(C)Cc2ccncc2)CC[NH2+]1 ZINC001246410862 987789761 /nfs/dbraw/zinc/78/97/61/987789761.db2.gz YEMGNGIQEFXSTH-JSGCOSHPSA-N 2 0 247.386 2.133 20 0 BEADRP c1ccc2c(c1)CC[C@H]2C[NH2+][C@H]1CCCC[NH2+]C1 ZINC001246418599 987792286 /nfs/dbraw/zinc/79/22/86/987792286.db2.gz DUAZVJBUJIJFOB-GJZGRUSLSA-N 2 0 244.382 2.448 20 0 BEADRP CC(C)(C[NH2+]C1CC[NH2+]CC1)CC1CC1 ZINC001246431574 987796074 /nfs/dbraw/zinc/79/60/74/987796074.db2.gz LJQSDCQAVWFHEY-UHFFFAOYSA-N 2 0 210.365 2.154 20 0 BEADRP C[NH2+]CC[C@@H](C)[NH2+]C[C@H]1CCC(C)(C)C1 ZINC001246432887 987798271 /nfs/dbraw/zinc/79/82/71/987798271.db2.gz IQJWVICSWHZZCS-NEPJUHHUSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C2(CC3CC3)CC2)CC[NH2+]1 ZINC001246445157 987804095 /nfs/dbraw/zinc/80/40/95/987804095.db2.gz MYLCSHXSGNBDJQ-PWSUYJOCSA-N 2 0 208.349 2.049 20 0 BEADRP CCCCC[C@H](CC)[NH2+]CCCNCCC[NH3+] ZINC001246452613 987809730 /nfs/dbraw/zinc/80/97/30/987809730.db2.gz KOKYVWBAWHWRTK-AWEZNQCLSA-N 2 0 243.439 2.263 20 0 BEADRP CC[C@@]1([NH2+]C2CCC(C)CC2)CC[NH2+]C1 ZINC001246459184 987816813 /nfs/dbraw/zinc/81/68/13/987816813.db2.gz JMJQNPQHLPWONF-WXRRBKDZSA-N 2 0 210.365 2.297 20 0 BEADRP C[NH2+][C@H]1C[C@H]([NH2+]C2CCCCCCC2)C1 ZINC001246459367 987817404 /nfs/dbraw/zinc/81/74/04/987817404.db2.gz GJZIBMHLBLJDNS-JOCQHMNTSA-N 2 0 210.365 2.439 20 0 BEADRP c1ccc2c(c1)CCC[C@@H]2C[NH2+][C@@H]1CCCNC1 ZINC001246463370 987823709 /nfs/dbraw/zinc/82/37/09/987823709.db2.gz DIHSQBAFKFEACC-HUUCEWRRSA-N 2 0 244.382 2.448 20 0 BEADRP CC(C)[NH2+]CC[NH2+][C@@H]1CC[C@@H](C)[C@@H](C)C1 ZINC001246467629 987825800 /nfs/dbraw/zinc/82/58/00/987825800.db2.gz ZJJFXJNEVGWQBZ-FRRDWIJNSA-N 2 0 212.381 2.399 20 0 BEADRP CC[C@H]1CC[C@@H]([NH2+][C@H]2CCCC[C@H]2[NH3+])C1 ZINC001246479892 987837265 /nfs/dbraw/zinc/83/72/65/987837265.db2.gz VSRVHAGHMYWQNG-LOWDOPEQSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@H]1[NH2+][C@H]1CC[NH2+][C@H](C)C1 ZINC001246493605 987846377 /nfs/dbraw/zinc/84/63/77/987846377.db2.gz ILPDFIFQCOYMSG-FHUSYTEZSA-N 2 0 210.365 2.151 20 0 BEADRP C[NH2+][C@H]1C[C@@H]([NH2+]C2CCCCCCC2)C1 ZINC001246493826 987846457 /nfs/dbraw/zinc/84/64/57/987846457.db2.gz GJZIBMHLBLJDNS-BETUJISGSA-N 2 0 210.365 2.439 20 0 BEADRP C[C@@H]1CC[C@@H](C)C1[NH2+][C@@H]1CCCC[NH2+]C1 ZINC001246493384 987847118 /nfs/dbraw/zinc/84/71/18/987847118.db2.gz GOVMAEDMWJGYGY-IJLUTSLNSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1CC[C@@H](C)C1[NH2+][C@@H]1CC[NH2+][C@H](C)C1 ZINC001246493604 987847683 /nfs/dbraw/zinc/84/76/83/987847683.db2.gz ILPDFIFQCOYMSG-DDHJBXDOSA-N 2 0 210.365 2.151 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@H]1[NH2+][C@@H]1CCCC[NH2+]C1 ZINC001246493392 987847759 /nfs/dbraw/zinc/84/77/59/987847759.db2.gz GOVMAEDMWJGYGY-XQHKEYJVSA-N 2 0 210.365 2.153 20 0 BEADRP CCCC(C[NH3+])(CCC)N[C@H]1CCC[NH2+]CC1 ZINC001246494152 987850125 /nfs/dbraw/zinc/85/01/25/987850125.db2.gz FKZZYRRELZCXSO-ZDUSSCGKSA-N 2 0 241.423 2.016 20 0 BEADRP C[NH2+][C@H]1C[C@@H]([NH2+][C@H](C)CCC=C(C)C)C1 ZINC001246495312 987851039 /nfs/dbraw/zinc/85/10/39/987851039.db2.gz JCMQCZMQVGTARB-UPJWGTAASA-N 2 0 210.365 2.461 20 0 BEADRP C[NH2+][C@H]1C[C@@H]([NH2+][C@@H]2CCc3c(C)cccc3C2)C1 ZINC001246496212 987851280 /nfs/dbraw/zinc/85/12/80/987851280.db2.gz NNFVKQZKIDPQQP-KFWWJZLASA-N 2 0 244.382 2.192 20 0 BEADRP CC[C@@H](C)C[C@H](CC)[NH2+]C12CC([NH3+])(C1)C2 ZINC001246506488 987860096 /nfs/dbraw/zinc/86/00/96/987860096.db2.gz WFOVEZBQPWHGSE-IALDZJHCSA-N 2 0 210.365 2.425 20 0 BEADRP Cc1ccc(C[C@@H](C)N2CC[C@](C)([NH3+])C2)cc1 ZINC001246526777 987876123 /nfs/dbraw/zinc/87/61/23/987876123.db2.gz BTBZSQIMPJGXKD-HIFRSBDPSA-N 2 0 232.371 2.349 20 0 BEADRP CCCC[C@H](CCC)[N@@H+]1CCO[C@@H](CC[NH3+])C1 ZINC001246536316 987895609 /nfs/dbraw/zinc/89/56/09/987895609.db2.gz ULRNRQAORQYOND-KBPBESRZSA-N 2 0 242.407 2.395 20 0 BEADRP CC[C@H](C)OCC[C@H](C)[NH+]1CCC(C[NH3+])CC1 ZINC001246540961 987906032 /nfs/dbraw/zinc/90/60/32/987906032.db2.gz XKPAJIUNGIWMSR-STQMWFEESA-N 2 0 242.407 2.251 20 0 BEADRP CC[C@@H](CC(C)C)[NH+]1CCC(C[NH3+])CC1 ZINC001246541763 987909118 /nfs/dbraw/zinc/90/91/18/987909118.db2.gz ZMZCDGOHQXSBLG-ZDUSSCGKSA-N 2 0 212.381 2.482 20 0 BEADRP CCOCC[C@@H](C)[N@@H+]1CCC[C@@](C)([NH3+])CC1 ZINC001246547998 987936435 /nfs/dbraw/zinc/93/64/35/987936435.db2.gz DXPWUPNHGZJTIH-CHWSQXEVSA-N 2 0 228.380 2.005 20 0 BEADRP C[NH2+]C[C@@H]1CCC[N@@H+]([C@@H]2C[C@@H]3[C@H](C2)C3(C)C)C1 ZINC001246549964 987941711 /nfs/dbraw/zinc/94/17/11/987941711.db2.gz LAQBWAJWQVJKGT-XDQVBPFNSA-N 2 0 236.403 2.352 20 0 BEADRP CC1(F)CC[NH+](C2C[C@H]3CC[C@@H](C2)[NH2+]3)CC1 ZINC001246553034 987953458 /nfs/dbraw/zinc/95/34/58/987953458.db2.gz RDFBRNGTQNQHKU-FOSCPWQOSA-N 2 0 226.339 2.093 20 0 BEADRP C[C@@H](CC1CC1)[N@@H+]1CCC[C@@](F)(C[NH3+])CC1 ZINC001246552844 987954992 /nfs/dbraw/zinc/95/49/92/987954992.db2.gz VVDUYNXMIGZXFI-AAEUAGOBSA-N 2 0 228.355 2.328 20 0 BEADRP CCC[C@@H](C)[N@@H+]1CCC[C@@](F)(C[NH3+])CC1 ZINC001246553600 987957979 /nfs/dbraw/zinc/95/79/79/987957979.db2.gz ZKEOBOMTQCNKBM-NEPJUHHUSA-N 2 0 216.344 2.328 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]Cc1cccc2cnccc21 ZINC001117953137 987967115 /nfs/dbraw/zinc/96/71/15/987967115.db2.gz ARINSJDWDZUUIU-LBPRGKRZSA-N 2 0 243.354 2.180 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]Cc1ccc(F)cc1C ZINC001117953390 987968700 /nfs/dbraw/zinc/96/87/00/987968700.db2.gz GBKIGGPTXJPQTQ-LLVKDONJSA-N 2 0 224.323 2.222 20 0 BEADRP [NH3+]CCCC[NH2+]Cc1cscc1Cl ZINC001117953969 987969107 /nfs/dbraw/zinc/96/91/07/987969107.db2.gz VSMJITFNANDFDV-UHFFFAOYSA-N 2 0 218.753 2.230 20 0 BEADRP CCSC[C@H](C)[N@@H+]1CCC[C@@](C)([NH3+])CC1 ZINC001246556421 987969781 /nfs/dbraw/zinc/96/97/81/987969781.db2.gz ZRJCJXVVEBJJOO-NWDGAFQWSA-N 2 0 230.421 2.331 20 0 BEADRP CCOCC[C@H](C)[N@@H+]1CC[C@@H](C)[C@@H](C[NH3+])CC1 ZINC001246557350 987976134 /nfs/dbraw/zinc/97/61/34/987976134.db2.gz KQYSUULNKBPTPX-HZSPNIEDSA-N 2 0 242.407 2.108 20 0 BEADRP CSCC[C@H](C)[N@@H+]1CCC[C@H](C[NH3+])[C@H](C)C1 ZINC001246559540 987982631 /nfs/dbraw/zinc/98/26/31/987982631.db2.gz BFLYFGWCWZSRHI-FRRDWIJNSA-N 2 0 244.448 2.435 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]Cc1ccc(C)c(C)c1 ZINC001118019656 987984714 /nfs/dbraw/zinc/98/47/14/987984714.db2.gz QRWQIHNFKKANLJ-ZDUSSCGKSA-N 2 0 220.360 2.391 20 0 BEADRP C[C@@H](NCc1ccc2c(c1)CCC2)[C@H]1CCC[NH2+]1 ZINC001118057290 987989997 /nfs/dbraw/zinc/98/99/97/987989997.db2.gz CGOQPYMDHDSUQR-MLGOLLRUSA-N 2 0 244.382 2.405 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2CC[C@H](C)[C@@H](C[NH3+])CC2)C1 ZINC001246561457 987990915 /nfs/dbraw/zinc/99/09/15/987990915.db2.gz SUMGDYFFCQGTCT-RQJABVFESA-N 2 0 224.392 2.482 20 0 BEADRP CCCC(CCC)[N@@H+]1CCCC[C@@](O)(C[NH3+])C1 ZINC001246561601 987992285 /nfs/dbraw/zinc/99/22/85/987992285.db2.gz QXDCCRQHVFCSQV-CQSZACIVSA-N 2 0 242.407 2.131 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@@H](C)c1ccc(OC)cc1 ZINC001118060134 988000440 /nfs/dbraw/zinc/00/04/40/988000440.db2.gz WRVLZGQEBAHPKJ-RYUDHWBXSA-N 2 0 236.359 2.344 20 0 BEADRP CCSC[C@H](C)[N@@H+]1CCC[C@H](C[NH3+])[C@H](C)C1 ZINC001246563596 988008605 /nfs/dbraw/zinc/00/86/05/988008605.db2.gz RZQZVGUMTJUMJC-FRRDWIJNSA-N 2 0 244.448 2.435 20 0 BEADRP C[C@H]1CC[N@@H+](C2CC[NH2+]CC2)CCC1(F)F ZINC001246563000 988008720 /nfs/dbraw/zinc/00/87/20/988008720.db2.gz BXVLVDZXORPUQI-JTQLQIEISA-N 2 0 232.318 2.106 20 0 BEADRP C[C@@H]1C[N@@H+](C2CCSCC2)CCC[C@H]1C[NH3+] ZINC001246564951 988012051 /nfs/dbraw/zinc/01/20/51/988012051.db2.gz GWVNVMNDNQAXHU-NEPJUHHUSA-N 2 0 242.432 2.189 20 0 BEADRP CC1([NH2+][C@H]2C[C@@H]([NH3+])c3ccccc32)CC1 ZINC001118118914 988021962 /nfs/dbraw/zinc/02/19/62/988021962.db2.gz KQDNVEDJDQBJML-NEPJUHHUSA-N 2 0 202.301 2.273 20 0 BEADRP C[C@@H]1CC[N@@H+]([C@H]2CCCSC2)CC[C@H]1C[NH3+] ZINC001246564763 988022171 /nfs/dbraw/zinc/02/21/71/988022171.db2.gz ZVISTNWUKMFYAQ-AGIUHOORSA-N 2 0 242.432 2.189 20 0 BEADRP CS[C@@H]1CC[C@H]([NH2+]C2CCC(C[NH3+])CC2)C1 ZINC001118118889 988023261 /nfs/dbraw/zinc/02/32/61/988023261.db2.gz KLIHEUQBRCOTFP-IFWUJCSASA-N 2 0 242.432 2.378 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@H](C)c1ccc(F)cc1 ZINC001118121981 988023954 /nfs/dbraw/zinc/02/39/54/988023954.db2.gz MBHOKJJILFOKEZ-WDEREUQCSA-N 2 0 224.323 2.474 20 0 BEADRP Cc1cccc2c1C[N@H+]([C@@H]1CC[NH2+][C@H](C)C1)C2 ZINC001246566666 988032421 /nfs/dbraw/zinc/03/24/21/988032421.db2.gz IPSNYJRUCORMBQ-TZMCWYRMSA-N 2 0 230.355 2.451 20 0 BEADRP C[C@]1(F)CCCN(C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC001246570959 988052130 /nfs/dbraw/zinc/05/21/30/988052130.db2.gz BYQFCCHESVNQIN-HNGCFSAESA-N 2 0 226.339 2.093 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2CCC[C@@H](C)[C@@H](C)C2)CC[NH2+]1 ZINC001246578157 988091241 /nfs/dbraw/zinc/09/12/41/988091241.db2.gz YJQMPHGCOLYBLB-XJFOESAGSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H]1C[C@H]([N@@H+]2CCC[C@](C)(C[NH3+])CC2)CCO1 ZINC001246579849 988100683 /nfs/dbraw/zinc/10/06/83/988100683.db2.gz LTSHHWBNKMLITL-MJBXVCDLSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@]1(C[NH3+])CCCC[N@@H+](C2CCSCC2)C1 ZINC001246579706 988103847 /nfs/dbraw/zinc/10/38/47/988103847.db2.gz GPLRYBNYTMVHLH-CYBMUJFWSA-N 2 0 242.432 2.333 20 0 BEADRP C[C@@H]1CC[C@@H]([NH+]2CC(C)(C[NH3+])C2)C[C@H]1C ZINC001246586493 988150112 /nfs/dbraw/zinc/15/01/12/988150112.db2.gz BFKBSLADLIXBPI-IJLUTSLNSA-N 2 0 210.365 2.092 20 0 BEADRP CCC[C@@H](C)CC[C@H](C)[NH+]1CC(C[NH3+])C1 ZINC001246594087 988189942 /nfs/dbraw/zinc/18/99/42/988189942.db2.gz JSJLJIJMPVOTKF-NEPJUHHUSA-N 2 0 212.381 2.482 20 0 BEADRP CC(C)=CCC[C@H](C)[NH+]1CC(C)(C[NH3+])C1 ZINC001246601433 988211137 /nfs/dbraw/zinc/21/11/37/988211137.db2.gz VGQSVTVEDCHLSX-LBPRGKRZSA-N 2 0 210.365 2.402 20 0 BEADRP CCCC[C@@H](CCC)[NH+]1CC(C[NH2+]C)C1 ZINC001246601469 988207315 /nfs/dbraw/zinc/20/73/15/988207315.db2.gz UDYMHYYXSMPTQZ-CYBMUJFWSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H](CC1CC1)[N@@H+]1CCC[C@@]12CCC[NH2+]C2 ZINC001246613395 988238309 /nfs/dbraw/zinc/23/83/09/988238309.db2.gz YWYDPKQYAJYZID-GXTWGEPZSA-N 2 0 222.376 2.393 20 0 BEADRP CC[C@H](C[C@@H](C)CC)[N@@H+]1CCC2(C[NH2+]C2)C1 ZINC001246631534 988303495 /nfs/dbraw/zinc/30/34/95/988303495.db2.gz QHWNROSGGDKQJX-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H](C)C[C@H](CC)[N@@H+]1CCC2(C[NH2+]C2)C1 ZINC001246631533 988306443 /nfs/dbraw/zinc/30/64/43/988306443.db2.gz QHWNROSGGDKQJX-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@H](CC(C)C)[N@@H+]1CC[C@H]2[NH2+]CC[C@H]21 ZINC001246635133 988324680 /nfs/dbraw/zinc/32/46/80/988324680.db2.gz BSZFQDLWTPNLJJ-JHJVBQTASA-N 2 0 210.365 2.247 20 0 BEADRP C[C@H]1CC[C@@H]([N@H+]2C[C@@H]3CC(F)(F)C[C@@H]3C2)C[NH2+]1 ZINC001246640475 988338255 /nfs/dbraw/zinc/33/82/55/988338255.db2.gz UONSFSKAHKTOKM-NNYUYHANSA-N 2 0 244.329 2.104 20 0 BEADRP CC[C@@H]1CC[C@H]([N@@H+]2CC[C@@H]3[NH2+]CC[C@H]32)C1 ZINC001246644305 988355843 /nfs/dbraw/zinc/35/58/43/988355843.db2.gz SBRGLLAOYXLWIT-MROQNXINSA-N 2 0 208.349 2.001 20 0 BEADRP C[C@@H]1CC[C@@H]([N@@H+]2CC[C@H]3C[NH2+]C[C@H]32)C[C@@H]1C ZINC001246644880 988356085 /nfs/dbraw/zinc/35/60/85/988356085.db2.gz JKVJDJFCXRXNMX-MBJXGIAVSA-N 2 0 222.376 2.105 20 0 BEADRP CC1(C)CCC([N@@H+]2C[C@@H]3CC[NH2+][C@@H]3C2)CC1 ZINC001246654112 988378534 /nfs/dbraw/zinc/37/85/34/988378534.db2.gz UJGSUBGZPRQSQY-WCQYABFASA-N 2 0 222.376 2.249 20 0 BEADRP CC[C@@H](Cc1ccccc1)[N@@H+]1CC[C@H]2C[C@@]2([NH3+])C1 ZINC001246654337 988378881 /nfs/dbraw/zinc/37/88/81/988378881.db2.gz KARGKMPFJVUQKI-HRCADAONSA-N 2 0 244.382 2.431 20 0 BEADRP C1C[C@H]2C[N@@H+](C3CCCCCCC3)C[C@H]2[NH2+]1 ZINC001246652162 988381432 /nfs/dbraw/zinc/38/14/32/988381432.db2.gz NXKOQECLXIKXLJ-GXTWGEPZSA-N 2 0 222.376 2.393 20 0 BEADRP C[C@@H]1C[C@@H]([N@@H+]2C[C@H]3CC[NH2+]C[C@H]32)CC(C)(C)C1 ZINC001246666983 988412318 /nfs/dbraw/zinc/41/23/18/988412318.db2.gz WPTVHIXJEFJZDV-AAVRWANBSA-N 2 0 236.403 2.495 20 0 BEADRP CC[C@H](C)C[C@H](CC)[N@@H+]1C[C@@H]2C[NH2+]CC[C@H]21 ZINC001246678697 988424095 /nfs/dbraw/zinc/42/40/95/988424095.db2.gz YHNIMPGABQSGSR-XDQVBPFNSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1CC[C@@H](N2CC[C@H](c3ccncc3)C2)C[NH2+]1 ZINC001246775773 988453371 /nfs/dbraw/zinc/45/33/71/988453371.db2.gz LDLUTRWJNWSZJP-VHDGCEQUSA-N 2 0 245.370 2.011 20 0 BEADRP CCCC[N@H+](CCC)[C@@H](C)CC[NH2+]C ZINC001246773956 988456999 /nfs/dbraw/zinc/45/69/99/988456999.db2.gz DLJNWFRNIVMSQM-LBPRGKRZSA-N 2 0 200.370 2.497 20 0 BEADRP CCc1cc(NC[C@H]2CCC[N@@H+](CC)C2)cc[nH+]1 ZINC001118579327 988463067 /nfs/dbraw/zinc/46/30/67/988463067.db2.gz DTKDJSRWFKLBQB-CYBMUJFWSA-N 2 0 247.386 2.210 20 0 BEADRP CCCOC1CC[NH+]([C@H]2CC[NH2+][C@H](C)C2)CC1 ZINC001246788744 988467988 /nfs/dbraw/zinc/46/79/88/988467988.db2.gz ILBKGFYXUYPZJH-OLZOCXBDSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@@H]1C[C@@H]([N@@H+]2CCC[C@H]2c2ccccn2)CC[NH2+]1 ZINC001246786828 988470263 /nfs/dbraw/zinc/47/02/63/988470263.db2.gz AIIFANYEGHNOCQ-IPYPFGDCSA-N 2 0 245.370 2.359 20 0 BEADRP CC(C)C[C@@H](C)C[C@@H](C)N1CCO[C@@H](C[NH3+])C1 ZINC001246822523 988512574 /nfs/dbraw/zinc/51/25/74/988512574.db2.gz BKPBOBWWVZKDJI-MCIONIFRSA-N 2 0 242.407 2.107 20 0 BEADRP CC[C@H](Cc1ccccc1)[N@@H+]1C[C@@H]2CC[C@@]2([NH3+])C1 ZINC001246851719 988573327 /nfs/dbraw/zinc/57/33/27/988573327.db2.gz GSXIIWDIUCXZFA-ARFHVFGLSA-N 2 0 244.382 2.431 20 0 BEADRP CC1(C)CCC[C@H]([N@@H+]2C[C@H]3CC[C@@]3([NH3+])C2)C1 ZINC001246857030 988579253 /nfs/dbraw/zinc/57/92/53/988579253.db2.gz ZBAXGEYHZXYKBB-MBNYWOFBSA-N 2 0 222.376 2.378 20 0 BEADRP [NH3+][C@@]12CC[C@@H]1C[N@@H+](C1CCC3(CC3)CC1)C2 ZINC001246859340 988587626 /nfs/dbraw/zinc/58/76/26/988587626.db2.gz JWNDMUDRULCZPO-BXUZGUMPSA-N 2 0 220.360 2.132 20 0 BEADRP CCCC[C@H](CC)[N@@H+]1C[C@H]2CC[C@@]2([NH3+])C1 ZINC001246863995 988614280 /nfs/dbraw/zinc/61/42/80/988614280.db2.gz STXCJZAOWKDXBZ-FRRDWIJNSA-N 2 0 210.365 2.378 20 0 BEADRP C[N@H+](CC/C=C/c1cccnc1)C1CC[NH2+]CC1 ZINC001246881162 988649267 /nfs/dbraw/zinc/64/92/67/988649267.db2.gz YGGODFQXOIRQEF-GORDUTHDSA-N 2 0 245.370 2.169 20 0 BEADRP C[C@H]1C[N@H+]([C@@H]2CC[NH2+][C@H](C)C2)C2(CC2)C1 ZINC001246895949 988670021 /nfs/dbraw/zinc/67/00/21/988670021.db2.gz RKWFQJWLQWPNCK-IJLUTSLNSA-N 2 0 208.349 2.001 20 0 BEADRP C[C@H]1CC[C@H]([NH+]2C[C@@H]3CCCC[C@H]3C2)C[NH2+]1 ZINC001246896147 988670508 /nfs/dbraw/zinc/67/05/08/988670508.db2.gz TUNRRUSMSJINLX-XUXIUFHCSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@H]1C[N@H+](C2C[C@H]3CC[C@@H](C2)[NH2+]3)C2(CC2)C1 ZINC001246897930 988671084 /nfs/dbraw/zinc/67/10/84/988671084.db2.gz WOCNTFMVVPZHRR-FKJOKYEKSA-N 2 0 220.360 2.144 20 0 BEADRP CCCC[C@@H](C)[N@H+]1C[C@@H]2CC[NH2+]CC[C@@H]2C1 ZINC001246929341 988751892 /nfs/dbraw/zinc/75/18/92/988751892.db2.gz FHANOZZIZYYEHX-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP CCCC[C@H](C)[N@H+]1C[C@@H]2CC[NH2+]CC[C@@H]2C1 ZINC001246929342 988754440 /nfs/dbraw/zinc/75/44/40/988754440.db2.gz FHANOZZIZYYEHX-MELADBBJSA-N 2 0 224.392 2.497 20 0 BEADRP CCC[C@H](C)[N@H+]1C[C@@H]2CC[NH2+]CC[C@@H]2C1 ZINC001246936751 988768886 /nfs/dbraw/zinc/76/88/86/988768886.db2.gz XAFFUMJKPHXISK-RWMBFGLXSA-N 2 0 210.365 2.106 20 0 BEADRP CCCC[C@@H](CCC)[N@H+](C)[C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001246946816 988783414 /nfs/dbraw/zinc/78/34/14/988783414.db2.gz HVFDKURMROLXKI-MQYQWHSLSA-N 2 0 224.392 2.495 20 0 BEADRP CCCCC[C@H](CC)[N@H+](C)[C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001246948968 988789102 /nfs/dbraw/zinc/78/91/02/988789102.db2.gz QZBQLRSJQCSGPA-IGQOVBAYSA-N 2 0 224.392 2.495 20 0 BEADRP CC[C@H](N)C[N@H+](C)[C@@H](C)CCC[NH+](CC)CC ZINC001246974758 988804540 /nfs/dbraw/zinc/80/45/40/988804540.db2.gz QUIUSHAUDDJGIM-KBPBESRZSA-N 2 0 243.439 2.166 20 0 BEADRP CC(C)[N@H+](C1CCOCC1)[C@H]1CC[NH2+][C@H](C)C1 ZINC001246985034 988815837 /nfs/dbraw/zinc/81/58/37/988815837.db2.gz ORVSEZFBDKAZBN-OCCSQVGLSA-N 2 0 240.391 2.016 20 0 BEADRP CCCCC[C@H](CCC)[N@H+]1C[C@@H](OC)[C@@H](N)C1 ZINC001246983503 988816856 /nfs/dbraw/zinc/81/68/56/988816856.db2.gz SMWBDHIOFFWJKB-MELADBBJSA-N 2 0 242.407 2.393 20 0 BEADRP C[NH2+]CC[C@@H](C)[N@H+](C)[C@H]1CC[C@H](C)CC1 ZINC001247003606 988837109 /nfs/dbraw/zinc/83/71/09/988837109.db2.gz MXHAIUGQRLFYNB-JHJVBQTASA-N 2 0 212.381 2.495 20 0 BEADRP C[C@H]([NH3+])C[N@@H+]1CCC[C@]1(C)c1ccccc1 ZINC001119347949 988993889 /nfs/dbraw/zinc/99/38/89/988993889.db2.gz UAUSQICEFMZEQO-GXTWGEPZSA-N 2 0 218.344 2.345 20 0 BEADRP C[C@H]([NH3+])C[N@@H+]1CCC[C@@]1(C)c1ccccc1 ZINC001119347950 988994187 /nfs/dbraw/zinc/99/41/87/988994187.db2.gz UAUSQICEFMZEQO-JSGCOSHPSA-N 2 0 218.344 2.345 20 0 BEADRP [NH3+]CCCC[NH2+]Cc1nccc2ccccc21 ZINC001325273692 989137531 /nfs/dbraw/zinc/13/75/31/989137531.db2.gz SKYYTEHGQZIMFQ-UHFFFAOYSA-N 2 0 229.327 2.063 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]Cc1ccc(F)c(C)c1 ZINC001325266789 989137978 /nfs/dbraw/zinc/13/79/78/989137978.db2.gz FNLADFVZSLYSLQ-NSHDSACASA-N 2 0 224.323 2.222 20 0 BEADRP CC[NH+](CC)CC[C@H](C)Nc1cc[nH+]cc1 ZINC001516802772 989174126 /nfs/dbraw/zinc/17/41/26/989174126.db2.gz JCXDCGBZVQAHBX-LBPRGKRZSA-N 2 0 221.348 2.036 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)Nc1cc[nH+]cc1 ZINC001516802763 989175137 /nfs/dbraw/zinc/17/51/37/989175137.db2.gz JCXDCGBZVQAHBX-GFCCVEGCSA-N 2 0 221.348 2.036 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H]1CC[C@@H](C)[C@H](C)C1 ZINC001325715349 989237049 /nfs/dbraw/zinc/23/70/49/989237049.db2.gz BOIBJIFEGRZBRM-FDYHWXHSSA-N 2 0 212.381 2.399 20 0 BEADRP CC[C@H]([NH2+]CC[C@@H](C)[NH2+]C)c1ccncc1 ZINC001325723356 989243764 /nfs/dbraw/zinc/24/37/64/989243764.db2.gz RGPBKMFTAKDAJT-YPMHNXCESA-N 2 0 221.348 2.120 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H]1CC[C@H]1C1CCC1 ZINC001325722355 989244644 /nfs/dbraw/zinc/24/46/44/989244644.db2.gz MCGGUWCEISTOCR-WXHSDQCUSA-N 2 0 210.365 2.153 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H]1CCCc2ccccc2C1 ZINC001326034824 989334606 /nfs/dbraw/zinc/33/46/06/989334606.db2.gz AIMNAAMOEXXBSL-CJNGLKHVSA-N 2 0 246.398 2.379 20 0 BEADRP C[NH+](C)C[C@@H]1CCN(CCCC(F)(F)F)C1 ZINC001119930628 989486029 /nfs/dbraw/zinc/48/60/29/989486029.db2.gz AUGLUAMLCFBTJY-JTQLQIEISA-N 2 0 238.297 2.212 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]Cc1cccc2c1CCC2 ZINC001326414418 989551512 /nfs/dbraw/zinc/55/15/12/989551512.db2.gz RBBKEXHYQVVUIS-GFCCVEGCSA-N 2 0 232.371 2.263 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]Cc1ccc2c(c1)CCC2 ZINC001326459425 989568093 /nfs/dbraw/zinc/56/80/93/989568093.db2.gz OIUNSCVMIMNJSE-NWDGAFQWSA-N 2 0 232.371 2.391 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]C1(C)CC1 ZINC001326459538 989568431 /nfs/dbraw/zinc/56/84/31/989568431.db2.gz RGPXPIUZLMRXRD-SNVBAGLBSA-N 2 0 219.332 2.052 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]Cc1ccc2c(c1)CCC2 ZINC001326459426 989568622 /nfs/dbraw/zinc/56/86/22/989568622.db2.gz OIUNSCVMIMNJSE-RYUDHWBXSA-N 2 0 232.371 2.391 20 0 BEADRP C[N@@H+](Cc1cc(F)cc(F)c1)C[C@H]1C[C@@H]([NH3+])C1 ZINC001120269569 989624165 /nfs/dbraw/zinc/62/41/65/989624165.db2.gz TZJUHHYWXWQBSY-GSJFWJNXSA-N 2 0 240.297 2.134 20 0 BEADRP C[N@@H+]1CC[C@@H]2[C@@H](CCCN2c2cc[nH+]cc2)C1 ZINC001120860871 989931129 /nfs/dbraw/zinc/93/11/29/989931129.db2.gz UVVNCXLHLGVRCM-GXTWGEPZSA-N 2 0 231.343 2.002 20 0 BEADRP C[N@@H+]1CC[C@H]2[C@H](CCCN2c2cc[nH+]cc2)C1 ZINC001120860873 989931214 /nfs/dbraw/zinc/93/12/14/989931214.db2.gz UVVNCXLHLGVRCM-OCCSQVGLSA-N 2 0 231.343 2.002 20 0 BEADRP CC(C)=CCC[C@H](C)[NH2+]CCSCC[NH3+] ZINC001258083878 990984544 /nfs/dbraw/zinc/98/45/44/990984544.db2.gz OJRAFEDJBFXPFP-LBPRGKRZSA-N 2 0 230.421 2.403 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@H]([NH2+]Cc3cccc(F)c3)[C@@H]2C1 ZINC001308554300 991036789 /nfs/dbraw/zinc/03/67/89/991036789.db2.gz NVQJHFJYTGZLGU-CFVMTHIKSA-N 2 0 248.345 2.256 20 0 BEADRP C[C@@H](Cc1ccco1)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001258176202 991073310 /nfs/dbraw/zinc/07/33/10/991073310.db2.gz MRJOUFIMPYYTRA-FQUUOJAGSA-N 2 0 248.370 2.425 20 0 BEADRP CC(C)[N@H+](CCC[NH3+])[C@H](C)Cc1ccco1 ZINC001258176454 991075268 /nfs/dbraw/zinc/07/52/68/991075268.db2.gz VYEADXLWBIEPHD-GFCCVEGCSA-N 2 0 224.348 2.270 20 0 BEADRP C[C@H](Cc1ccco1)[N@@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC001258194861 991105180 /nfs/dbraw/zinc/10/51/80/991105180.db2.gz LRTNSWINLFIYFC-HIFRSBDPSA-N 2 0 248.370 2.238 20 0 BEADRP C[C@@H](Cc1ccco1)[N@@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC001258194858 991107777 /nfs/dbraw/zinc/10/77/77/991107777.db2.gz LRTNSWINLFIYFC-DZGCQCFKSA-N 2 0 248.370 2.238 20 0 BEADRP CCC[N@H+](CCC[NH3+])[C@H](C)CCSC ZINC001258200852 991118649 /nfs/dbraw/zinc/11/86/49/991118649.db2.gz XSRXJXOSJVKQJS-LLVKDONJSA-N 2 0 218.410 2.189 20 0 BEADRP CSCC[C@H](C)[NH2+]CC12CC[NH+](CC1)CC2 ZINC001258206057 991122775 /nfs/dbraw/zinc/12/27/75/991122775.db2.gz NLJHSCAZDVUVGV-LBPRGKRZSA-N 2 0 242.432 2.204 20 0 BEADRP CC[NH+]1CCC(C[NH2+]C2(C(C)C)CC2)CC1 ZINC001308776488 991129197 /nfs/dbraw/zinc/12/91/97/991129197.db2.gz GYKPPCBFLZUCJK-UHFFFAOYSA-N 2 0 224.392 2.497 20 0 BEADRP CSCC[C@H](C)[N@@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC001258226765 991158641 /nfs/dbraw/zinc/15/86/41/991158641.db2.gz RHHBGBGAQLLMOE-QWHCGFSZSA-N 2 0 242.432 2.156 20 0 BEADRP CC1(C)CCC[C@H]([NH2+][C@@H]2CCC[C@@H]2[NH3+])C1 ZINC001258284153 991215385 /nfs/dbraw/zinc/21/53/85/991215385.db2.gz ZWHXIBXPCWVCQJ-SDDRHHMPSA-N 2 0 210.365 2.425 20 0 BEADRP CC(C)C[C@@H](C)[NH2+]C[C@@H]1C[NH+]2CCC1CC2 ZINC001308966006 991233531 /nfs/dbraw/zinc/23/35/31/991233531.db2.gz KVGCQIDOJIZXCI-TZMCWYRMSA-N 2 0 224.392 2.352 20 0 BEADRP CCCCC[C@H](CC)NC(=[NH2+])NCCCC[NH3+] ZINC001258429605 991355033 /nfs/dbraw/zinc/35/50/33/991355033.db2.gz ZUPKSAXTZUBNEU-LBPRGKRZSA-N 2 0 242.411 2.198 20 0 BEADRP CC/C=C\CC[N@@H+]1C[C@H]2C[NH+](C)C[C@@]2(C)C1 ZINC001560186462 991405074 /nfs/dbraw/zinc/40/50/74/991405074.db2.gz GXAYAEISPKGERA-QJTIAFMVSA-N 2 0 222.376 2.226 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]Cc1ccccc1C[NH3+] ZINC001258455412 991406638 /nfs/dbraw/zinc/40/66/38/991406638.db2.gz PMLCILCUBZSCNC-NSHDSACASA-N 2 0 218.344 2.424 20 0 BEADRP CC[NH+]1C[C@@H]2C[NH+]([C@H]3CCC(C)(C)C3)C[C@H]2C1 ZINC001258608389 991526287 /nfs/dbraw/zinc/52/62/87/991526287.db2.gz JECLOKGOOUMQIR-MCIONIFRSA-N 2 0 236.403 2.449 20 0 BEADRP CCC[C@@H](Cc1ccccc1)[N@@H+]1CC[C@H](N)C1 ZINC001258648997 991582516 /nfs/dbraw/zinc/58/25/16/991582516.db2.gz ATTBYRYHCAQSLZ-GJZGRUSLSA-N 2 0 232.371 2.431 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2CCS[C@H](C)C2)CC1 ZINC001560980058 991676149 /nfs/dbraw/zinc/67/61/49/991676149.db2.gz XBMGFGSMVBFVNI-GFCCVEGCSA-N 2 0 242.432 2.156 20 0 BEADRP CC(C)C1CCC([NH2+]CCSCC[NH3+])CC1 ZINC001258801974 991798748 /nfs/dbraw/zinc/79/87/48/991798748.db2.gz FJLBDDZHCUSEIF-UHFFFAOYSA-N 2 0 244.448 2.483 20 0 BEADRP CS[C@H]1CC[C@H]([N@H+](C)CCn2ccnc2)C1 ZINC001319441770 991869277 /nfs/dbraw/zinc/86/92/77/991869277.db2.gz CSCLBPBDZVKHHN-RYUDHWBXSA-N 2 0 239.388 2.099 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+]C1(CC)COC1 ZINC001258899023 991892773 /nfs/dbraw/zinc/89/27/73/991892773.db2.gz BBJPNFIFNCMYPP-ZDUSSCGKSA-N 2 0 242.407 2.266 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]CCC1COC1 ZINC001258900117 991894960 /nfs/dbraw/zinc/89/49/60/991894960.db2.gz CXWBAOARZOBFFH-CYBMUJFWSA-N 2 0 242.407 2.123 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@]1(C)CCOC1 ZINC001258904892 991895842 /nfs/dbraw/zinc/89/58/42/991895842.db2.gz MNBSTKUKSMZHOX-UONOGXRCSA-N 2 0 242.407 2.266 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+]CC1CC(=O)C1 ZINC001258899251 991896571 /nfs/dbraw/zinc/89/65/71/991896571.db2.gz IUDXWKCYJKVYBL-LBPRGKRZSA-N 2 0 240.391 2.066 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[N@H+](C)CCOC ZINC001258906830 991896621 /nfs/dbraw/zinc/89/66/21/991896621.db2.gz BANLLIDKBKHZSN-CYBMUJFWSA-N 2 0 230.396 2.075 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@@H](C)CSC(C)(C)C ZINC001261423966 992293428 /nfs/dbraw/zinc/29/34/28/992293428.db2.gz JWQXYUOJQMHRRU-QWRGUYRKSA-N 2 0 232.437 2.494 20 0 BEADRP [NH3+]CC1CCC([NH2+]C/C=C/C2CC2)CC1 ZINC001261424011 992293516 /nfs/dbraw/zinc/29/35/16/992293516.db2.gz LDRHLRFSMNGRLT-OWOJBTEDSA-N 2 0 208.349 2.060 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H]1C[C@@H](C)CC[C@H]1C ZINC001261424081 992295088 /nfs/dbraw/zinc/29/50/88/992295088.db2.gz MQRDXSFRECWTRA-UMSGYPCISA-N 2 0 212.381 2.399 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@H](C)CSC(C)(C)C ZINC001261423967 992296075 /nfs/dbraw/zinc/29/60/75/992296075.db2.gz JWQXYUOJQMHRRU-WDEREUQCSA-N 2 0 232.437 2.494 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H]1CCc2cc(C)ccc21 ZINC001261423935 992298641 /nfs/dbraw/zinc/29/86/41/992298641.db2.gz JBEAKDVOAZDMPV-IUODEOHRSA-N 2 0 232.371 2.427 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CCCC(F)F)[C@H](C)C1 ZINC001262160373 992721766 /nfs/dbraw/zinc/72/17/66/992721766.db2.gz CMQJDTGLAYGOSD-GHMZBOCLSA-N 2 0 234.334 2.352 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CCCC(F)F)[C@@H](C)C1 ZINC001262160375 992724371 /nfs/dbraw/zinc/72/43/71/992724371.db2.gz CMQJDTGLAYGOSD-QWRGUYRKSA-N 2 0 234.334 2.352 20 0 BEADRP C[NH+](C)[C@@H]1CC[C@@H]2C[N@H+](Cc3ccco3)C[C@@H]2C1 ZINC001262378399 992870820 /nfs/dbraw/zinc/87/08/20/992870820.db2.gz AULHWUJQRZADQH-HZSPNIEDSA-N 2 0 248.370 2.442 20 0 BEADRP C[NH+](C)[C@@H]1CC[C@H]2C[N@H+](Cc3ccco3)C[C@H]2C1 ZINC001262378398 992871741 /nfs/dbraw/zinc/87/17/41/992871741.db2.gz AULHWUJQRZADQH-BFHYXJOUSA-N 2 0 248.370 2.442 20 0 BEADRP C1=CO[C@H](C[NH2+]CC[C@@H]2CCC[NH2+]CC2)CC1 ZINC001574774407 992899655 /nfs/dbraw/zinc/89/96/55/992899655.db2.gz MRMWSWXFTIDJJW-KGLIPLIRSA-N 2 0 238.375 2.049 20 0 BEADRP C([N@@H+]1CCCC2(CCCC2)C1)[C@]12C[C@H]1C[NH2+]C2 ZINC001574800990 992914303 /nfs/dbraw/zinc/91/43/03/992914303.db2.gz MNRVDVBYTJRKHZ-DZGCQCFKSA-N 2 0 234.387 2.252 20 0 BEADRP C=C/C=C/CC[NH2+]CC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC001574889634 992938606 /nfs/dbraw/zinc/93/86/06/992938606.db2.gz TZYSSDCTUATHEU-RXVMTUIBSA-N 2 0 220.360 2.239 20 0 BEADRP CC(C)(C)C1CC([NH2+]CC2(C[NH3+])CC2)C1 ZINC001575120714 992989000 /nfs/dbraw/zinc/98/90/00/992989000.db2.gz WTWIWDMZCLQVLS-UHFFFAOYSA-N 2 0 210.365 2.140 20 0 BEADRP CC(C)(C)Oc1cccc(C[NH2+][C@H]2C[C@@H]([NH3+])C2)c1 ZINC001575258952 993002236 /nfs/dbraw/zinc/00/22/36/993002236.db2.gz OUCPCCBPOWGKHE-BETUJISGSA-N 2 0 248.370 2.443 20 0 BEADRP C[NH+](C)[C@@H](CNc1cc[nH+]cc1)c1ccsc1 ZINC001262671771 993012962 /nfs/dbraw/zinc/01/29/62/993012962.db2.gz SPEJRKGOTMPBBM-ZDUSSCGKSA-N 2 0 247.367 2.280 20 0 BEADRP CC(C)(C[NH2+][C@H]1C[C@@H]([NH3+])C1(C)C)C1CC1 ZINC001575334958 993013864 /nfs/dbraw/zinc/01/38/64/993013864.db2.gz WLJALPAQBGFRQQ-MNOVXSKESA-N 2 0 210.365 2.138 20 0 BEADRP CC(C)([NH3+])C[NH2+]CCc1c(F)cccc1Cl ZINC001575357593 993019300 /nfs/dbraw/zinc/01/93/00/993019300.db2.gz BYHHFAHFNAXYSW-UHFFFAOYSA-N 2 0 244.741 2.349 20 0 BEADRP C[NH+](C)[C@@H]1CC[C@H]2CN(c3cc[nH+]cc3)C[C@@H]2C1 ZINC001262674990 993019335 /nfs/dbraw/zinc/01/93/35/993019335.db2.gz SHZJZUIDRQFBRZ-KCQAQPDRSA-N 2 0 245.370 2.248 20 0 BEADRP CC(C)([NH3+])C[NH2+]C[C@@H]1C[C@@H]1C1CCCC1 ZINC001575358362 993023859 /nfs/dbraw/zinc/02/38/59/993023859.db2.gz PDKDTVKGCQWOHS-NWDGAFQWSA-N 2 0 210.365 2.140 20 0 BEADRP CC(C)=CC[N@H+]1CC2(C[C@H]1C)CC[NH2+]CC2 ZINC001575391741 993035194 /nfs/dbraw/zinc/03/51/94/993035194.db2.gz QNWIMEKUNQIMGT-CYBMUJFWSA-N 2 0 222.376 2.417 20 0 BEADRP CC(C)[C@H](C[NH3+])C[N@@H+]1CC[C@H](C2CCC2)C1 ZINC001575423817 993040891 /nfs/dbraw/zinc/04/08/91/993040891.db2.gz YPBYGDFYDFQJPZ-UONOGXRCSA-N 2 0 224.392 2.339 20 0 BEADRP CC(C)[C@H]1[N@H+](CC2(C[NH3+])CCC2)CC1(C)C ZINC001575519979 993064182 /nfs/dbraw/zinc/06/41/82/993064182.db2.gz HSIOHSAZLWELKL-GFCCVEGCSA-N 2 0 224.392 2.482 20 0 BEADRP C[C@@H](CCc1ccccc1)C[NH2+]CC1C[NH2+]C1 ZINC001575965594 993143760 /nfs/dbraw/zinc/14/37/60/993143760.db2.gz AGIUXFGRXKIFFV-ZDUSSCGKSA-N 2 0 232.371 2.064 20 0 BEADRP C[C@H](C[NH+]1CC2(C1)CC[NH2+]CC2)C(C)(C)C ZINC001576004804 993155110 /nfs/dbraw/zinc/15/51/10/993155110.db2.gz GYWGWBSEETYLQR-GFCCVEGCSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H](C[NH2+]Cc1cccc(N)c1)C[NH+]1CCCC1 ZINC001576033071 993158576 /nfs/dbraw/zinc/15/85/76/993158576.db2.gz LNIJWYMNODCJKM-ZDUSSCGKSA-N 2 0 247.386 2.090 20 0 BEADRP C[C@@H](C[NH2+]CCOCCC[NH3+])C1CCCCC1 ZINC001576033862 993162655 /nfs/dbraw/zinc/16/26/55/993162655.db2.gz XDAJXPSCKIRCEO-ZDUSSCGKSA-N 2 0 242.407 2.158 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)C[C@H](C)[NH3+])[C@@H]1C[C@H]1C1CC1 ZINC001576152468 993190713 /nfs/dbraw/zinc/19/07/13/993190713.db2.gz IIYTVUUWYMKTIA-DQYMBCKPSA-N 2 0 210.365 2.136 20 0 BEADRP COc1ccc(C)cc1C[N@@H+]1CCC[C@@H]([NH3+])CC1 ZINC000378788707 993203337 /nfs/dbraw/zinc/20/33/37/993203337.db2.gz MJYKBHDFJMFDSX-CQSZACIVSA-N 2 0 248.370 2.317 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@@H]([NH3+])C1(C)C)C1CCSCC1 ZINC001576234858 993225201 /nfs/dbraw/zinc/22/52/01/993225201.db2.gz ATOZAKASHFUDKE-MVWJERBFSA-N 2 0 242.432 2.234 20 0 BEADRP C[C@@H]([NH2+][C@H]1C[C@H]([NH3+])C1)[C@@H]1CC2CCC1CC2 ZINC001576250371 993234716 /nfs/dbraw/zinc/23/47/16/993234716.db2.gz FKSGFBLSOYHODS-VKKCZRNHSA-N 2 0 222.376 2.281 20 0 BEADRP CC1(C)[C@@H]([NH3+])C[C@@H]1[NH2+][C@@H]1CCSC(C)(C)C1 ZINC001576393188 993281510 /nfs/dbraw/zinc/28/15/10/993281510.db2.gz DIVSMHUOXIAOKI-VWYCJHECSA-N 2 0 242.432 2.376 20 0 BEADRP CC1(C)[C@H]([NH3+])C[C@@H]1[NH2+]CCC[C@H]1CCCCO1 ZINC001576380336 993286750 /nfs/dbraw/zinc/28/67/50/993286750.db2.gz OLMFZRAPNQWYSL-UPJWGTAASA-N 2 0 240.391 2.051 20 0 BEADRP CC1(C)[C@H]([NH3+])C[C@H]1[NH2+]CCC[C@@H]1CCCCO1 ZINC001576380338 993288077 /nfs/dbraw/zinc/28/80/77/993288077.db2.gz OLMFZRAPNQWYSL-YNEHKIRRSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H](CC1CC1)[N@@H+]1CCCC[C@@H](C[NH3+])C1 ZINC000379855303 993289224 /nfs/dbraw/zinc/28/92/24/993289224.db2.gz BSZWEZJIMBIUCZ-AAEUAGOBSA-N 2 0 210.365 2.236 20 0 BEADRP [NH3+]C[C@@H]1CCCC[N@H+](Cc2ccsc2)C1 ZINC000379908978 993292520 /nfs/dbraw/zinc/29/25/20/993292520.db2.gz LJSBZNFMPKHUJB-NSHDSACASA-N 2 0 224.373 2.309 20 0 BEADRP C[C@@]1(C[N@@H+]2CCCCC[C@@H]([NH3+])C2)CCCCO1 ZINC001576502660 993325797 /nfs/dbraw/zinc/32/57/97/993325797.db2.gz DVHZOBNXMMAFGJ-KGLIPLIRSA-N 2 0 240.391 2.149 20 0 BEADRP C[C@]1(CNc2cc3c(c[nH+]2)CCCC3)CC[NH2+]C1 ZINC001576525564 993329362 /nfs/dbraw/zinc/32/93/62/993329362.db2.gz GHCUMHPNNAHFGE-HNNXBMFYSA-N 2 0 245.370 2.372 20 0 BEADRP CC1=CC[C@H]([NH2+][C@H](C)C2CC[NH2+]CC2)CC1 ZINC001576555059 993343496 /nfs/dbraw/zinc/34/34/96/993343496.db2.gz CWURHLFXZWTIJW-OCCSQVGLSA-N 2 0 222.376 2.463 20 0 BEADRP C[C@@H]1CC(C)(C)CC[C@H]1[NH2+][C@H]1C[C@@H]([NH3+])C1 ZINC001576588577 993358437 /nfs/dbraw/zinc/35/84/37/993358437.db2.gz BUKAKPVVHFVGJM-WISYIIOYSA-N 2 0 210.365 2.281 20 0 BEADRP C[C@H]1CC(CC[NH2+]CC(C)(C)C[NH3+])C[C@H](C)O1 ZINC001576599861 993364194 /nfs/dbraw/zinc/36/41/94/993364194.db2.gz VYKOLVVETDXNML-RYUDHWBXSA-N 2 0 242.407 2.155 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+][C@@H]1CC[C@H](C)SC1 ZINC001576670841 993388093 /nfs/dbraw/zinc/38/80/93/993388093.db2.gz MXYCVVPVLINIPR-QJPTWQEYSA-N 2 0 230.421 2.234 20 0 BEADRP C[C@H]1C[C@@H]([N@H+]2C[C@@H]3CCCC[C@@H]3C2)CC[NH2+]1 ZINC000381877406 993429413 /nfs/dbraw/zinc/42/94/13/993429413.db2.gz NMNXCDDLJRNACS-FQUUOJAGSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@@H]1C[C@H]([N@H+]2C[C@@H]3CCCC[C@@H]3C2)CC[NH2+]1 ZINC000381877409 993430572 /nfs/dbraw/zinc/43/05/72/993430572.db2.gz NMNXCDDLJRNACS-YIYPIFLZSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C/C=C\C2CC2)CC[N@@H+]1C ZINC000382312861 993449041 /nfs/dbraw/zinc/44/90/41/993449041.db2.gz QPCUKPDTDLLCIG-CWBMUHOVSA-N 2 0 208.349 2.025 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+][C@@H](C)C1CC1 ZINC000382356210 993453348 /nfs/dbraw/zinc/45/33/48/993453348.db2.gz IJGQKTAKXYVQMR-NEPJUHHUSA-N 2 0 212.381 2.495 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+]C[C@H]1CCC[NH2+]CC1 ZINC001576962889 993470804 /nfs/dbraw/zinc/47/08/04/993470804.db2.gz WJPAVHVECSBRON-AVGNSLFASA-N 2 0 212.381 2.400 20 0 BEADRP CCC(CC)(C[NH3+])C[NH2+]Cc1ccnc(F)c1 ZINC001577052359 993490135 /nfs/dbraw/zinc/49/01/35/993490135.db2.gz NTMGBTZZMZDPDW-UHFFFAOYSA-N 2 0 239.338 2.075 20 0 BEADRP CC[C@H]([NH3+])CN(C)Cc1sccc1C ZINC000383609012 993504943 /nfs/dbraw/zinc/50/49/43/993504943.db2.gz DVGLVCNBQHIIAV-JTQLQIEISA-N 2 0 212.362 2.226 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2CC[C@@H]3C[NH2+]C[C@@H]3C2)C[C@@H]1C ZINC000383574632 993500686 /nfs/dbraw/zinc/50/06/86/993500686.db2.gz KROHLJIPCZFNHG-KHMAMNHCSA-N 2 0 236.403 2.352 20 0 BEADRP C[C@H](CC(F)(F)F)[NH2+]C[C@@H]1CCC[NH2+][C@@H]1C ZINC000384344978 993576562 /nfs/dbraw/zinc/57/65/62/993576562.db2.gz CZOINTIMUAOCMU-BBBLOLIVSA-N 2 0 238.297 2.305 20 0 BEADRP C[C@H](Cc1ccco1)[NH2+]C[C@H]1CCC[NH2+][C@@H]1C ZINC000384501866 993590402 /nfs/dbraw/zinc/59/04/02/993590402.db2.gz XGZFJQHKJRMXJW-JHJVBQTASA-N 2 0 236.359 2.188 20 0 BEADRP CCC[C@H](C)CC[NH2+]C[C@]12C[C@H]1C[NH2+]C2 ZINC001577340701 993605201 /nfs/dbraw/zinc/60/52/01/993605201.db2.gz HYSVGMJGGCSPOW-AVGNSLFASA-N 2 0 210.365 2.012 20 0 BEADRP CCC[NH+]1CCC([C@@H]2[NH2+]CC23CCC3)CC1 ZINC001577531278 993679865 /nfs/dbraw/zinc/67/98/65/993679865.db2.gz ZHEOSWLMLYKFDF-ZDUSSCGKSA-N 2 0 222.376 2.251 20 0 BEADRP CCCSC[C@H](C)[NH2+]CCC1(C[NH3+])CC1 ZINC001577596701 993690961 /nfs/dbraw/zinc/69/09/61/993690961.db2.gz DBKFXWNJCGXJLR-NSHDSACASA-N 2 0 230.421 2.237 20 0 BEADRP CCCOc1ccc(C[NH2+][C@H]2C[C@@H]([NH3+])C2)cc1 ZINC001577586177 993691936 /nfs/dbraw/zinc/69/19/36/993691936.db2.gz NAJQQQYTQFWFGY-BETUJISGSA-N 2 0 234.343 2.055 20 0 BEADRP [NH3+][C@H]1CCC[N@H+](CCOCc2ccccc2)CC1 ZINC000393230943 993912927 /nfs/dbraw/zinc/91/29/27/993912927.db2.gz FLAAVNUUZWUACW-HNNXBMFYSA-N 2 0 248.370 2.016 20 0 BEADRP FC1(F)CCC[N@@H+](C2C[C@H]3CC[C@@H](C2)[NH2+]3)CC1 ZINC000702855530 994053504 /nfs/dbraw/zinc/05/35/04/994053504.db2.gz CMCPPQVYFVODMK-FOSCPWQOSA-N 2 0 244.329 2.391 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C2CCC(C[NH3+])CC2)CCS1 ZINC001332419394 994083418 /nfs/dbraw/zinc/08/34/18/994083418.db2.gz CVDYVIGCJMRKQA-IKWCTNDRSA-N 2 0 242.432 2.378 20 0 BEADRP C[N@H+]1C[C@H]2CC[C@@H](C1)C2[NH2+][C@H]1CCC[C@@H](F)C1 ZINC001332897843 994388728 /nfs/dbraw/zinc/38/87/28/994388728.db2.gz LPYNKALKDMUNLU-ZBBUEOHVSA-N 2 0 240.366 2.197 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCC[N@@H+]1C)C1(C)CC1 ZINC000822125228 994419414 /nfs/dbraw/zinc/41/94/14/994419414.db2.gz RYOJCQFGHWWNOL-NWDGAFQWSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CCC[N@@H+]1C)C1(C)CC1 ZINC000822125229 994421538 /nfs/dbraw/zinc/42/15/38/994421538.db2.gz RYOJCQFGHWWNOL-RYUDHWBXSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@H](CCc1ccccc1)[NH+]1CCC([NH3+])CC1 ZINC000020521501 1170114724 /nfs/dbraw/zinc/11/47/24/1170114724.db2.gz SYOBKRNLFLJXAN-CYBMUJFWSA-N 2 0 232.371 2.431 20 0 BEADRP C[C@@H](CCc1ccccc1)[NH+]1CCC([NH3+])CC1 ZINC000020521500 1170115010 /nfs/dbraw/zinc/11/50/10/1170115010.db2.gz SYOBKRNLFLJXAN-ZDUSSCGKSA-N 2 0 232.371 2.431 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]C[C@@H]1CCOC1 ZINC000019915186 1170140673 /nfs/dbraw/zinc/14/06/73/1170140673.db2.gz YNIBCTQHAMFVRH-KGLIPLIRSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[C@@H]3C[N@H+](C)C[C@H]23)C1 ZINC001621108269 1170716786 /nfs/dbraw/zinc/71/67/86/1170716786.db2.gz KWWHDXMPDBDEPF-NIFZNCRKSA-N 2 0 236.403 2.495 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@@H]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC001621424468 1170804158 /nfs/dbraw/zinc/80/41/58/1170804158.db2.gz YAAMPPZXZXHSPE-RBSFLKMASA-N 2 0 236.403 2.497 20 0 BEADRP C[N@H+](CCCC[NH3+])CCCc1ccccc1 ZINC000036199134 1170911818 /nfs/dbraw/zinc/91/18/18/1170911818.db2.gz RLCHPTUXXCKDAX-UHFFFAOYSA-N 2 0 220.360 2.290 20 0 BEADRP CCCC[C@H](CC)C[N@H+](C)CCC[NH3+] ZINC000043454489 1171287713 /nfs/dbraw/zinc/28/77/13/1171287713.db2.gz HXASIGVEWQOPLT-LBPRGKRZSA-N 2 0 200.370 2.483 20 0 BEADRP C[NH2+]CC[C@@H](C)[N@H+](C)CC1CCCCC1 ZINC000052346745 1171956958 /nfs/dbraw/zinc/95/69/58/1171956958.db2.gz SQWUMYCYNZMVLN-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP CC[NH+](CC)CCC[N@@H+]1C[C@@H](C)C[C@H]1C ZINC000548918498 398138871 /nfs/dbraw/zinc/13/88/71/398138871.db2.gz AWNOTSNGIQMCNR-QWHCGFSZSA-N 2 0 212.381 2.449 20 0 BEADRP CC(C)C[C@@H](C)C[N@@H+]1CCC[C@H](C[NH3+])C1 ZINC000300932629 349452749 /nfs/dbraw/zinc/45/27/49/349452749.db2.gz NYEIBRCAASJISC-CHWSQXEVSA-N 2 0 212.381 2.339 20 0 BEADRP COC1CCC([NH2+]C[C@@H]2CCC[C@@H]([NH3+])C2)CC1 ZINC000415012467 398153633 /nfs/dbraw/zinc/15/36/33/398153633.db2.gz XHMRDXLEWDZWAX-IWMBGFJWSA-N 2 0 240.391 2.051 20 0 BEADRP Fc1ccccc1C[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000415012363 398153812 /nfs/dbraw/zinc/15/38/12/398153812.db2.gz SKQWROZACJKOCN-DZGCQCFKSA-N 2 0 248.345 2.303 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CCOC1CCCCC1 ZINC000422941833 398159423 /nfs/dbraw/zinc/15/94/23/398159423.db2.gz IPSZMPDKWDSSGN-VXGBXAGGSA-N 2 0 228.380 2.051 20 0 BEADRP Cc1ccc(CC[NH2+]CCCC[NH+](C)C)cc1 ZINC000390062997 398157610 /nfs/dbraw/zinc/15/76/10/398157610.db2.gz BQNFLIVUECFTMD-UHFFFAOYSA-N 2 0 234.387 2.469 20 0 BEADRP Cc1cc(C[NH2+]CC2=CC[N@H+](C)CC2)ccc1F ZINC000271798522 178020733 /nfs/dbraw/zinc/02/07/33/178020733.db2.gz IMSWNWBFCWQMCX-UHFFFAOYSA-N 2 0 248.345 2.486 20 0 BEADRP Cc1cc(C[NH2+]CC2CC[NH+](C)CC2)cs1 ZINC000309288251 178020837 /nfs/dbraw/zinc/02/08/37/178020837.db2.gz JBJNOEKCEIAECC-UHFFFAOYSA-N 2 0 238.400 2.488 20 0 BEADRP C[C@@H](C[N@@H+]1C[C@H](C[NH3+])C[C@H]1C)C(C)(C)C ZINC000379814611 398170442 /nfs/dbraw/zinc/17/04/42/398170442.db2.gz PTZUNLMPGVRZRO-TUAOUCFPSA-N 2 0 212.381 2.338 20 0 BEADRP Cc1ccoc1C[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000380031864 398180867 /nfs/dbraw/zinc/18/08/67/398180867.db2.gz GPBMSCHXMORHOL-LBPRGKRZSA-N 2 0 236.359 2.408 20 0 BEADRP CCc1cnccc1[C@H](C)[NH2+][C@H](C)C[C@H](C)[NH3+] ZINC000423019930 398161130 /nfs/dbraw/zinc/16/11/30/398161130.db2.gz XVYVBJLLAAZTNT-TUAOUCFPSA-N 2 0 235.375 2.420 20 0 BEADRP COCCC[NH2+][C@@H]1CCN[C@@H](c2ccccc2)C1 ZINC000415097783 398161717 /nfs/dbraw/zinc/16/17/17/398161717.db2.gz DLOKLWPKJAGIJT-HUUCEWRRSA-N 2 0 248.370 2.106 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@H]1CCO[C@@H](C(C)(C)C)C1 ZINC000423020526 398162010 /nfs/dbraw/zinc/16/20/10/398162010.db2.gz BUGJMQATQBEHBK-ZDEQEGDKSA-N 2 0 242.407 2.296 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H]1CCO[C@H](C(C)(C)C)C1 ZINC000423023742 398163006 /nfs/dbraw/zinc/16/30/06/398163006.db2.gz KLUXWNUFJJHPBP-AGIUHOORSA-N 2 0 242.407 2.297 20 0 BEADRP C[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000083390568 398185637 /nfs/dbraw/zinc/18/56/37/398185637.db2.gz VKJTUBXRAAFNRQ-MBNYWOFBSA-N 2 0 222.376 2.249 20 0 BEADRP CCC[C@H](C[NH2+]CC1(C)CC[NH+](C)CC1)OC ZINC000385928660 398192435 /nfs/dbraw/zinc/19/24/35/398192435.db2.gz BFGBBBCSVJVUNG-CYBMUJFWSA-N 2 0 242.407 2.123 20 0 BEADRP Cc1cc(N(C)CC2([NH+](C)C)CCC2)cc[nH+]1 ZINC000276676669 178096003 /nfs/dbraw/zinc/09/60/03/178096003.db2.gz FHEIYCFJHNOVGV-UHFFFAOYSA-N 2 0 233.359 2.311 20 0 BEADRP Cc1cc(N(C)C[C@@H]2CCC[N@H+](C)C2)cc[nH+]1 ZINC000274931770 178098433 /nfs/dbraw/zinc/09/84/33/178098433.db2.gz QZYFVXKONXIJGO-CYBMUJFWSA-N 2 0 233.359 2.168 20 0 BEADRP Cc1cc(N2CC[C@@H](C[NH+]3CCCC3)C2)cc[nH+]1 ZINC000293133094 178118110 /nfs/dbraw/zinc/11/81/10/178118110.db2.gz RUIXMCMJUJPKOS-AWEZNQCLSA-N 2 0 245.370 2.312 20 0 BEADRP Cc1cc(N2CC[C@]3(C2)CCC[N@@H+](C)C3)cc[nH+]1 ZINC000292649745 178118386 /nfs/dbraw/zinc/11/83/86/178118386.db2.gz BNJPEFNVWDWTGU-OAHLLOKOSA-N 2 0 245.370 2.312 20 0 BEADRP FC1(CC[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)CCC1 ZINC000647796769 398201504 /nfs/dbraw/zinc/20/15/04/398201504.db2.gz NBIZHHULIBHZAH-FRRDWIJNSA-N 2 0 240.366 2.246 20 0 BEADRP CC1(CC[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)CC1 ZINC000647796801 398201682 /nfs/dbraw/zinc/20/16/82/398201682.db2.gz ODABGRMLPOXSJM-FRRDWIJNSA-N 2 0 222.376 2.154 20 0 BEADRP Cc1cc(N2C[C@@H]([NH+]3CCCC3)C[C@@H]2C)cc[nH+]1 ZINC000286206202 178120749 /nfs/dbraw/zinc/12/07/49/178120749.db2.gz CATFQGMZEDRUML-ZFWWWQNUSA-N 2 0 245.370 2.453 20 0 BEADRP Cc1cc(N2C[C@@H](C)[C@@H]([NH3+])C2)c2ccccc2[nH+]1 ZINC000235377797 178121497 /nfs/dbraw/zinc/12/14/97/178121497.db2.gz SDXFWNMPBOQFLG-MFKMUULPSA-N 2 0 241.338 2.327 20 0 BEADRP Cc1cc(N2C[C@H]([NH3+])[C@@H](C)C2)c2ccccc2[nH+]1 ZINC000235704121 178122692 /nfs/dbraw/zinc/12/26/92/178122692.db2.gz SDXFWNMPBOQFLG-GWCFXTLKSA-N 2 0 241.338 2.327 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H](CO)C1CCCCC1 ZINC000386276974 398204248 /nfs/dbraw/zinc/20/42/48/398204248.db2.gz QCVRBWGQTXRTLT-OCCSQVGLSA-N 2 0 242.407 2.035 20 0 BEADRP CO[C@@H]1CCC[C@@H]([NH2+]CC2([NH3+])CCCCC2)C1 ZINC000643496600 398205710 /nfs/dbraw/zinc/20/57/10/398205710.db2.gz CQYMDWSRZVMBPE-CHWSQXEVSA-N 2 0 240.391 2.195 20 0 BEADRP C1=C[C@H]([NH+]2C[C@@H]3C[NH2+]C[C@H]3C2)CCCCC1 ZINC000380800365 398208725 /nfs/dbraw/zinc/20/87/25/398208725.db2.gz HBLDTPIKOLNFJG-IHRRRGAJSA-N 2 0 220.360 2.027 20 0 BEADRP COc1ccc(CN(C)CCC[NH3+])c(Cl)c1 ZINC000258812393 349518470 /nfs/dbraw/zinc/51/84/70/349518470.db2.gz SRFHZZRRTQTOLI-UHFFFAOYSA-N 2 0 242.750 2.129 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]Cc1noc2ccccc12 ZINC000576411495 365590906 /nfs/dbraw/zinc/59/09/06/365590906.db2.gz FWVCUPDTEXPZRD-SNVBAGLBSA-N 2 0 233.315 2.045 20 0 BEADRP Cc1cc(N[C@@H](C[NH3+])C2CCCC2)cc[nH+]1 ZINC000235833199 178180355 /nfs/dbraw/zinc/18/03/55/178180355.db2.gz ICDDXWFIJYCPLC-ZDUSSCGKSA-N 2 0 219.332 2.319 20 0 BEADRP C[C@@](C[NH3+])([NH2+]Cc1ccc2c(c1)CCC2)C1CC1 ZINC000430572558 398229038 /nfs/dbraw/zinc/22/90/38/398229038.db2.gz KGWBYWWCLHGIGJ-INIZCTEOSA-N 2 0 244.382 2.392 20 0 BEADRP CC(C)CCC[NH+]1CCC(OCCC[NH3+])CC1 ZINC000165551870 136227406 /nfs/dbraw/zinc/22/74/06/136227406.db2.gz CJNBCHAQEDJREM-UHFFFAOYSA-N 2 0 242.407 2.252 20 0 BEADRP CCC(CC)C[NH2+]C[C@@H]1CC[N@H+](CC)C1 ZINC000037484202 168361785 /nfs/dbraw/zinc/36/17/85/168361785.db2.gz RYZVBBIRIGTSLU-ZDUSSCGKSA-N 2 0 212.381 2.354 20 0 BEADRP C[C@@H]1C[C@H](C)C[N@H+]([C@@H]2CC[NH2+][C@@H](C)C2)C1 ZINC000229539491 538939311 /nfs/dbraw/zinc/93/93/11/538939311.db2.gz SWIAYLRCUHHJGQ-QNWHQSFQSA-N 2 0 210.365 2.105 20 0 BEADRP CCC(CC)[N@H+](C)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000040746575 168367722 /nfs/dbraw/zinc/36/77/22/168367722.db2.gz SEAMSYHJASKPBS-QYJAPNMZSA-N 2 0 210.365 2.390 20 0 BEADRP C[C@H](Cc1cccs1)[NH2+][C@H]1CC[NH2+]C[C@H]1C ZINC000380746789 398251898 /nfs/dbraw/zinc/25/18/98/398251898.db2.gz SUURLBFAFWATPP-WZRBSPASSA-N 2 0 238.400 2.267 20 0 BEADRP CC(C)n1ccc(C[NH2+][C@@H](C)CCCC[NH3+])n1 ZINC000576695071 365659459 /nfs/dbraw/zinc/65/94/59/365659459.db2.gz BSPBZXKAXKBYQN-LBPRGKRZSA-N 2 0 238.379 2.071 20 0 BEADRP CC(C)n1ccc(C[NH2+][C@H](C)CCCC[NH3+])n1 ZINC000576695066 365659690 /nfs/dbraw/zinc/65/96/90/365659690.db2.gz BSPBZXKAXKBYQN-GFCCVEGCSA-N 2 0 238.379 2.071 20 0 BEADRP C[C@@H]1CCC[C@@H](C)[N@H+](C[C@@H]2CC[NH2+]C2)C1 ZINC000381615840 398266807 /nfs/dbraw/zinc/26/68/07/398266807.db2.gz VEZKRZHDMVYNPY-JHJVBQTASA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H](CNc1cc[nH+]c2c(O)cccc12)[NH+](C)C ZINC000649469871 398269515 /nfs/dbraw/zinc/26/95/15/398269515.db2.gz MBUISOGPTNOGLP-JTQLQIEISA-N 2 0 245.326 2.302 20 0 BEADRP CCSCC[NH2+]C[C@H]1CCN1C1CCCC1 ZINC000600204193 342701422 /nfs/dbraw/zinc/70/14/22/342701422.db2.gz PIUYVHHMQXDBOZ-CYBMUJFWSA-N 2 0 242.432 2.346 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCc2cc(F)ccc21)C1C[NH2+]C1 ZINC000335602399 136235660 /nfs/dbraw/zinc/23/56/60/136235660.db2.gz ZIOQGPGZLJVWPX-OTYXRUKQSA-N 2 0 234.318 2.011 20 0 BEADRP CCC[C@H](C)[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000037209012 538961850 /nfs/dbraw/zinc/96/18/50/538961850.db2.gz LQEHKJWGWAWLSZ-RYUDHWBXSA-N 2 0 212.381 2.495 20 0 BEADRP C[C@@H]([NH2+]CC1CCC1)C1CC[NH+](C)CC1 ZINC000037222303 538962067 /nfs/dbraw/zinc/96/20/67/538962067.db2.gz KXRVARXKXCFXMO-LLVKDONJSA-N 2 0 210.365 2.106 20 0 BEADRP CCC(CC)[NH2+]CCN(C)[C@@H](C)CC ZINC000053377527 168387481 /nfs/dbraw/zinc/38/74/81/168387481.db2.gz BVIZMKHEMAGEAJ-NSHDSACASA-N 2 0 200.370 2.495 20 0 BEADRP Cc1cc(N)cc(C[NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)c1 ZINC000335365117 398286994 /nfs/dbraw/zinc/28/69/94/398286994.db2.gz YIPJPUXLBHJZCZ-DOMZBBRYSA-N 2 0 247.386 2.150 20 0 BEADRP C[C@H]([NH2+]CC(C)(C)C)C1CC[NH+](C)CC1 ZINC000040492814 538971871 /nfs/dbraw/zinc/97/18/71/538971871.db2.gz PSVRGXWLCANASJ-NSHDSACASA-N 2 0 212.381 2.352 20 0 BEADRP CC1(C)CCC[C@H]1[NH2+][C@@H]1CCc2nc[nH]c2C1 ZINC000336479886 342807506 /nfs/dbraw/zinc/80/75/06/342807506.db2.gz UAXSQQANBZSOBY-ZWNOBZJWSA-N 2 0 233.359 2.435 20 0 BEADRP C[C@H]([NH2+][C@H]1CSC1(C)C)C1CC[NH+](C)CC1 ZINC000381470402 539001606 /nfs/dbraw/zinc/00/16/06/539001606.db2.gz OGMPNTPZHPBAOX-JQWIXIFHSA-N 2 0 242.432 2.200 20 0 BEADRP C[N@H+](CCC[NH3+])CC(C)(C)c1ccccc1 ZINC000382058813 398302527 /nfs/dbraw/zinc/30/25/27/398302527.db2.gz BYVADHBZYPUSSZ-UHFFFAOYSA-N 2 0 220.360 2.245 20 0 BEADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+]C[C@H]2CCSC2)C1 ZINC000300231805 259326841 /nfs/dbraw/zinc/32/68/41/259326841.db2.gz IWYPRVVTNGZCAG-QWHCGFSZSA-N 2 0 242.432 2.059 20 0 BEADRP CCCC1(C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)CC1 ZINC000233035393 342894028 /nfs/dbraw/zinc/89/40/28/342894028.db2.gz IUFFVMRGJQZGMO-NWDGAFQWSA-N 2 0 210.365 2.426 20 0 BEADRP C(C1CC1)[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000134871375 342909986 /nfs/dbraw/zinc/90/99/86/342909986.db2.gz CSKBTEYENJBTKP-HIFRSBDPSA-N 2 0 234.387 2.345 20 0 BEADRP Clc1ccccc1CC[NH2+]C1CC[NH2+]CC1 ZINC000215905800 346878655 /nfs/dbraw/zinc/87/86/55/346878655.db2.gz UKPAPVBFCAHDHK-UHFFFAOYSA-N 2 0 238.762 2.224 20 0 BEADRP CCC[C@@H](C)[NH2+]CCN(C)[C@@H](C)CC ZINC000053377502 346888132 /nfs/dbraw/zinc/88/81/32/346888132.db2.gz ZMRGFQRRUUOHKN-NEPJUHHUSA-N 2 0 200.370 2.495 20 0 BEADRP CC[C@@H](c1ccccc1)[N@@H+]1CCCO[C@@H](C[NH3+])C1 ZINC000313350933 259333848 /nfs/dbraw/zinc/33/38/48/259333848.db2.gz LDLYUAKFCZJNSB-GJZGRUSLSA-N 2 0 248.370 2.187 20 0 BEADRP CC[NH+]1CCC([NH2+]CCc2cccs2)CC1 ZINC000019948534 342964264 /nfs/dbraw/zinc/96/42/64/342964264.db2.gz CFQGXTHMIDIZED-UHFFFAOYSA-N 2 0 238.400 2.365 20 0 BEADRP CC(C)CC[C@H](C)[NH2+]CCC[NH+](C)C ZINC000019959239 342964606 /nfs/dbraw/zinc/96/46/06/342964606.db2.gz BRVMVMCXQAVHRZ-LBPRGKRZSA-N 2 0 200.370 2.352 20 0 BEADRP Cc1ccc(C[NH2+]CCC[NH+](C)C)c(C)c1 ZINC000019958089 342964624 /nfs/dbraw/zinc/96/46/24/342964624.db2.gz KLLSARPJEKMQHP-UHFFFAOYSA-N 2 0 220.360 2.345 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH+](C)CC[C@@H](C)F)[C@@H](C)C1 ZINC000351852919 136257662 /nfs/dbraw/zinc/25/76/62/136257662.db2.gz AZTGJKZVZIHOEC-XQQFMLRXSA-N 2 0 230.371 2.397 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH+](C)CC[C@@H](C)F)[C@H](C)C1 ZINC000351852917 136257681 /nfs/dbraw/zinc/25/76/81/136257681.db2.gz AZTGJKZVZIHOEC-UPJWGTAASA-N 2 0 230.371 2.397 20 0 BEADRP CSC1(C[NH2+]C[C@H]2CCC[N@H+](C)C2)CCC1 ZINC000235256208 342999548 /nfs/dbraw/zinc/99/95/48/342999548.db2.gz GQFDOZJNPALASQ-GFCCVEGCSA-N 2 0 242.432 2.204 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)C1CC1 ZINC000400961835 529661215 /nfs/dbraw/zinc/66/12/15/529661215.db2.gz MWWMNFOQJNUIKY-DGAVXFQQSA-N 2 0 222.376 2.153 20 0 BEADRP C[N@H+](CCC1CC[NH2+]CC1)C1CCCC1 ZINC000020593542 349795412 /nfs/dbraw/zinc/79/54/12/349795412.db2.gz OWXPOPNRUICEMZ-UHFFFAOYSA-N 2 0 210.365 2.251 20 0 BEADRP CC[N@H+](C)Cc1ccc(OCC[NH+](C)C)cc1 ZINC000678134331 488203219 /nfs/dbraw/zinc/20/32/19/488203219.db2.gz YFKWOVFSFQSYAO-UHFFFAOYSA-N 2 0 236.359 2.079 20 0 BEADRP C[N@@H+]1CCCC[C@@H]1CC[NH+]1CC[C@H](C(F)F)C1 ZINC000677729298 488204579 /nfs/dbraw/zinc/20/45/79/488204579.db2.gz BUNUNYHOHPUMGE-NWDGAFQWSA-N 2 0 246.345 2.448 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]CCc2ccccc2F)C1 ZINC000093209730 343150904 /nfs/dbraw/zinc/15/09/04/343150904.db2.gz GKTZXNQQPJAUQJ-OLZOCXBDSA-N 2 0 236.334 2.228 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]CCc2ccc(F)cc2)C1 ZINC000093209417 343151356 /nfs/dbraw/zinc/15/13/56/343151356.db2.gz AUUPBNPVJDPSPD-KGLIPLIRSA-N 2 0 236.334 2.228 20 0 BEADRP c1cc2c(o1)CCC[C@H]2[NH2+]CC1CC[NH2+]CC1 ZINC000094009652 343151752 /nfs/dbraw/zinc/15/17/52/343151752.db2.gz UJSTUVNFZYXOCY-CYBMUJFWSA-N 2 0 234.343 2.246 20 0 BEADRP C[C@@H]1CCC[N@H+](CCC2CC[NH2+]CC2)CC1 ZINC000082489535 136276729 /nfs/dbraw/zinc/27/67/29/136276729.db2.gz YCBVULRWRVEVFE-CYBMUJFWSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@H]1C[C@H]1CN1CCC2(CCC[N@@H+]2C)CC1 ZINC000625291170 343223074 /nfs/dbraw/zinc/22/30/74/343223074.db2.gz XSLNPLORXUHXER-STQMWFEESA-N 2 0 222.376 2.203 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@@H](C)CC2CC2)CC1 ZINC000133287236 343190384 /nfs/dbraw/zinc/19/03/84/343190384.db2.gz SHSULJMXESIBDO-LBPRGKRZSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1ccc(CC[NH2+][C@H]2CC[NH2+]CC[C@@H]2C)o1 ZINC000581997321 343191202 /nfs/dbraw/zinc/19/12/02/343191202.db2.gz WOCVBBBMJKYFMA-FZMZJTMJSA-N 2 0 236.359 2.108 20 0 BEADRP CC[NH+]1CCC(C[NH2+]Cc2occc2C)CC1 ZINC000135174469 343192991 /nfs/dbraw/zinc/19/29/91/343192991.db2.gz KNPBYHINZFAERY-UHFFFAOYSA-N 2 0 236.359 2.410 20 0 BEADRP Cc1ccsc1C[NH2+][C@H]1CCC[C@@H]1C[NH3+] ZINC000087308569 136281285 /nfs/dbraw/zinc/28/12/85/136281285.db2.gz HNJBGGSMMDTOLC-MNOVXSKESA-N 2 0 224.373 2.274 20 0 BEADRP Cc1ccsc1C[NH2+][C@@H]1CCC[C@@H]1C[NH3+] ZINC000087308568 136281297 /nfs/dbraw/zinc/28/12/97/136281297.db2.gz HNJBGGSMMDTOLC-GHMZBOCLSA-N 2 0 224.373 2.274 20 0 BEADRP C[NH2+]CCC[N@H+](C)C[C@H]1CCC[C@H](C)C1 ZINC000087472192 136281587 /nfs/dbraw/zinc/28/15/87/136281587.db2.gz WFJBAPHIRXNMPB-STQMWFEESA-N 2 0 212.381 2.354 20 0 BEADRP C[C@H](CC1CC1)[NH2+]CCC[NH+]1CCCC1 ZINC000069666273 343288566 /nfs/dbraw/zinc/28/85/66/343288566.db2.gz IXXGKDBHKLFXGW-GFCCVEGCSA-N 2 0 210.365 2.251 20 0 BEADRP CCC(CC)C[N@@H+]1CCC[C@@H](CC[NH3+])C1 ZINC000069723840 343290194 /nfs/dbraw/zinc/29/01/94/343290194.db2.gz FFNYQSKCUKJQAA-ZDUSSCGKSA-N 2 0 212.381 2.483 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]C1CCC(C(F)F)CC1 ZINC000335617739 136296522 /nfs/dbraw/zinc/29/65/22/136296522.db2.gz YVXQLAOCVJSVIM-JPPWEJMLSA-N 2 0 232.318 2.280 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCC[C@@H](C(C)C)CC1 ZINC000070613307 343334343 /nfs/dbraw/zinc/33/43/43/343334343.db2.gz DEHFDMWESCZQTN-CYBMUJFWSA-N 2 0 212.381 2.354 20 0 BEADRP C[C@@H](CCc1ccco1)[NH2+]CCC[NH+](C)C ZINC000035451285 343296983 /nfs/dbraw/zinc/29/69/83/343296983.db2.gz YIWVQEZDORWFMY-LBPRGKRZSA-N 2 0 224.348 2.142 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]CC1CC(F)(F)C1 ZINC000335613057 136295406 /nfs/dbraw/zinc/29/54/06/136295406.db2.gz RWLYBTLHCIWDAM-MWLCHTKSSA-N 2 0 232.318 2.009 20 0 BEADRP C1[C@H]([NH2+]C2CC[NH2+]CC2)[C@@H]1C1CCCCC1 ZINC000335650718 136305419 /nfs/dbraw/zinc/30/54/19/136305419.db2.gz XUQFUYGXJHWPBD-KBPBESRZSA-N 2 0 222.376 2.297 20 0 BEADRP CC[C@@H]1CCCC[C@@H]1[NH2+]CCC[NH+](C)C ZINC000070558352 343334621 /nfs/dbraw/zinc/33/46/21/343334621.db2.gz FJPCOORIBUSJRQ-OLZOCXBDSA-N 2 0 212.381 2.497 20 0 BEADRP Fc1cccc(CN[C@H]2CCCC[NH2+]C2)c1 ZINC000335642388 136309116 /nfs/dbraw/zinc/30/91/16/136309116.db2.gz JJRZZNUOGGVHFG-ZDUSSCGKSA-N 2 0 222.307 2.057 20 0 BEADRP CC(C)[C@@H]1CC[N@H+](CCC2CC[NH2+]CC2)C1 ZINC000166266818 136325215 /nfs/dbraw/zinc/32/52/15/136325215.db2.gz PCHOBAPSDPBUGF-CQSZACIVSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CC[C@@H](C2CC[NH+](C)CC2)C1 ZINC000349157519 136327743 /nfs/dbraw/zinc/32/77/43/136327743.db2.gz YTPCJFVNDMXXMU-BPLDGKMQSA-N 2 0 236.403 2.306 20 0 BEADRP CCC[N@H+](CCC[NH+](C)C)CC(C)(C)COC ZINC000349412318 136345465 /nfs/dbraw/zinc/34/54/65/136345465.db2.gz BQLMTAZBPOWWMI-UHFFFAOYSA-N 2 0 244.423 2.323 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)C[C@H]1CCSC1 ZINC000349411462 136345495 /nfs/dbraw/zinc/34/54/95/136345495.db2.gz XKBDPHAAVIMOGM-GFCCVEGCSA-N 2 0 230.421 2.013 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@H]2COC(C)(C)C2)CC1 ZINC000335656184 136376136 /nfs/dbraw/zinc/37/61/36/136376136.db2.gz JIFQJBDPOJTVQF-CYBMUJFWSA-N 2 0 240.391 2.016 20 0 BEADRP CC(C)CCC[N@@H+]1CC[C@]2(CC[NH2+]C2)C1 ZINC000083987794 343513006 /nfs/dbraw/zinc/51/30/06/343513006.db2.gz FEFKKCCEPOQMMN-ZDUSSCGKSA-N 2 0 210.365 2.108 20 0 BEADRP CC[C@H]1CC[C@@H]1[NH2+]Cc1ccc(C[NH3+])cc1 ZINC000580552036 365758904 /nfs/dbraw/zinc/75/89/04/365758904.db2.gz LGTPDWKHXBTWPZ-KBPBESRZSA-N 2 0 218.344 2.424 20 0 BEADRP CC(C)(C)CC[NH2+][C@H]1CCN(C2CC2)C1 ZINC000084498143 343532345 /nfs/dbraw/zinc/53/23/45/343532345.db2.gz KWIPZVMVMUPDJI-NSHDSACASA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+][C@H]1CCc2ccccc2C1 ZINC000049554210 343602611 /nfs/dbraw/zinc/60/26/11/343602611.db2.gz HZRUXQBFVIHDJL-BBRMVZONSA-N 2 0 246.398 2.474 20 0 BEADRP C[C@H]([N@H+](C)CC1CC[NH2+]CC1)C1(C)CC1 ZINC000087365094 343645561 /nfs/dbraw/zinc/64/55/61/343645561.db2.gz XOICYZCTNLUBCX-NSHDSACASA-N 2 0 210.365 2.106 20 0 BEADRP CC[N@H+](C)C[C@@H](O)C[NH2+]C(C)(C)CC(C)(C)C ZINC000380002030 365794752 /nfs/dbraw/zinc/79/47/52/365794752.db2.gz YBRKQMWGPHSNTP-LBPRGKRZSA-N 2 0 244.423 2.103 20 0 BEADRP CC[NH+]1CCC([NH2+]CCC2(C)CC2)CC1 ZINC000309050240 346957107 /nfs/dbraw/zinc/95/71/07/346957107.db2.gz QQFTVSXZSAOTSF-UHFFFAOYSA-N 2 0 210.365 2.251 20 0 BEADRP CCC[NH+]1CCC([NH2+]C2(C)CCC2)CC1 ZINC000154431324 537803143 /nfs/dbraw/zinc/80/31/43/537803143.db2.gz RZGWPIYUEPKHEO-UHFFFAOYSA-N 2 0 210.365 2.393 20 0 BEADRP C[C@@H]1C[C@H](C)[N@H+](C/C=C\Cl)C[C@@H]1C[NH3+] ZINC000397245510 343775065 /nfs/dbraw/zinc/77/50/65/343775065.db2.gz AQJLGTGIJXHSEB-UOMVISFLSA-N 2 0 216.756 2.044 20 0 BEADRP C[C@H](C[N@@H+]1CCC[C@H](C[NH3+])C1)c1ccccc1 ZINC000044528047 343781244 /nfs/dbraw/zinc/78/12/44/343781244.db2.gz QIKLPOPRTBEGTO-ZIAGYGMSSA-N 2 0 232.371 2.461 20 0 BEADRP C[C@H](C[NH2+]CC1(C)CCC1)C[NH+]1CCCC1 ZINC000336646188 537820255 /nfs/dbraw/zinc/82/02/55/537820255.db2.gz BDFQIVZFYMPNDJ-CYBMUJFWSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H](C[NH2+]CC1(C)CCC1)C[NH+]1CCCC1 ZINC000336646189 537819963 /nfs/dbraw/zinc/81/99/63/537819963.db2.gz BDFQIVZFYMPNDJ-ZDUSSCGKSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](C)c1cscn1 ZINC000570562628 323063204 /nfs/dbraw/zinc/06/32/04/323063204.db2.gz IEZBALPMFORWBE-UWVGGRQHSA-N 2 0 227.377 2.311 20 0 BEADRP Cc1ccc(CC[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)o1 ZINC000577170817 343901663 /nfs/dbraw/zinc/90/16/63/343901663.db2.gz BXMAWFPACNFDHE-FUNVUKJBSA-N 2 0 234.343 2.003 20 0 BEADRP CC(C)=CCC[N@@H+]1C[C@H]2CCC[C@@]2([NH3+])C1 ZINC000621784629 343907493 /nfs/dbraw/zinc/90/74/93/343907493.db2.gz RSKAIWMUROVPGF-CHWSQXEVSA-N 2 0 208.349 2.156 20 0 BEADRP CC(C)(C)C[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000634732485 344107614 /nfs/dbraw/zinc/10/76/14/344107614.db2.gz HOSSPSFMUCNMAP-LLVKDONJSA-N 2 0 212.381 2.400 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]([NH2+]C2CCSCC2)C1 ZINC000634732816 344108105 /nfs/dbraw/zinc/10/81/05/344108105.db2.gz PLVJGVFBUZUNST-LBPRGKRZSA-N 2 0 242.432 2.250 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]([NH2+]C2CCSCC2)C1 ZINC000634732815 344108155 /nfs/dbraw/zinc/10/81/55/344108155.db2.gz PLVJGVFBUZUNST-GFCCVEGCSA-N 2 0 242.432 2.250 20 0 BEADRP CC[C@@H](C)C[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000634733658 344113959 /nfs/dbraw/zinc/11/39/59/344113959.db2.gz KUFJKPATNQWJLU-NEPJUHHUSA-N 2 0 212.381 2.400 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]([NH2+]C[C@H]2CCSC2)C1 ZINC000634733552 344113985 /nfs/dbraw/zinc/11/39/85/344113985.db2.gz IFRUGNZJBBGVSD-VXGBXAGGSA-N 2 0 242.432 2.107 20 0 BEADRP CC(C)N(C)CC[NH2+][C@@H]1CC[C@H]1C1CC1 ZINC000336748713 537840156 /nfs/dbraw/zinc/84/01/56/537840156.db2.gz DOJZZCHRIYYPAE-QWHCGFSZSA-N 2 0 210.365 2.105 20 0 BEADRP CC(C)CCC[N@@H+]1C[C@@H]2CCC[C@@]2([NH3+])C1 ZINC000622003959 344181280 /nfs/dbraw/zinc/18/12/80/344181280.db2.gz IGJPUIZTOJRVPK-QWHCGFSZSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@H]1CC[C@@H]1C1CC1 ZINC000336768391 537843763 /nfs/dbraw/zinc/84/37/63/537843763.db2.gz UPMIDBGBNVBCDK-RTXFEEFZSA-N 2 0 210.365 2.105 20 0 BEADRP Cc1cc([C@@H](C)[NH2+][C@@H]2C[C@H]2C2CC[NH2+]CC2)no1 ZINC000569567477 344319722 /nfs/dbraw/zinc/31/97/22/344319722.db2.gz QJVKEMRPBBRDJN-SCDSUCTJSA-N 2 0 249.358 2.022 20 0 BEADRP C[N@H+](C[C@H]1CCSC1)C[C@@H]1CCC[NH+](C)C1 ZINC000495060196 529972348 /nfs/dbraw/zinc/97/23/48/529972348.db2.gz PZLZHIVKCRPXJB-CHWSQXEVSA-N 2 0 242.432 2.013 20 0 BEADRP CCC1CCC([NH2+]C2CC[NH2+]CC2)CC1 ZINC000042577396 344459163 /nfs/dbraw/zinc/45/91/63/344459163.db2.gz UASLJDUKYGRCMU-UHFFFAOYSA-N 2 0 210.365 2.297 20 0 BEADRP CC(C)=CC[NH2+][C@@H]1C[C@H](C)[N@@H+](C)C[C@@H]1C ZINC000228317848 259376104 /nfs/dbraw/zinc/37/61/04/259376104.db2.gz SEWJFTQOHIWECQ-RWMBFGLXSA-N 2 0 210.365 2.271 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H]1CC[C@@H]1C1CC1 ZINC000336775299 537847857 /nfs/dbraw/zinc/84/78/57/537847857.db2.gz YQLRBDVDSJKBTB-KGLIPLIRSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]C1CCC(C)(C)CC1 ZINC000414847939 529985189 /nfs/dbraw/zinc/98/51/89/529985189.db2.gz WLZLWKVTEVVJFC-LLVKDONJSA-N 2 0 212.381 2.400 20 0 BEADRP CC(C)(N)C[N@@H+]1CCC[C@@H]1C1CCCC1 ZINC000045089776 344558046 /nfs/dbraw/zinc/55/80/46/344558046.db2.gz KDWRZFNFVFKUDU-GFCCVEGCSA-N 2 0 210.365 2.378 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+]CC2(C)CCC2)C1 ZINC000336778532 537851817 /nfs/dbraw/zinc/85/18/17/537851817.db2.gz LOBBXXCXFLHMLM-CYBMUJFWSA-N 2 0 224.392 2.498 20 0 BEADRP Cc1nc(C)c([C@@H](C)[NH2+]CCCC[NH3+])s1 ZINC000049538727 344651869 /nfs/dbraw/zinc/65/18/69/344651869.db2.gz PUBFGACEJPFBIG-MRVPVSSYSA-N 2 0 227.377 2.149 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+]CC1CCCCC1 ZINC000049551922 344652615 /nfs/dbraw/zinc/65/26/15/344652615.db2.gz WHQRFIYIKPTLKP-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP CCC(CC)C[NH2+][C@H](C)CC[NH+](C)C ZINC000049551921 344652952 /nfs/dbraw/zinc/65/29/52/344652952.db2.gz RKDOTCRJESLXQW-LLVKDONJSA-N 2 0 200.370 2.352 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H]1[C@@H](C)[C@H](C)O[C@H]1C ZINC000625975928 344640315 /nfs/dbraw/zinc/64/03/15/344640315.db2.gz FRCUZDVTUIUZNZ-XUXIUFHCSA-N 2 0 242.407 2.120 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CCCC(C)(F)F)CC[N@@H+]1C ZINC000390110263 259380506 /nfs/dbraw/zinc/38/05/06/259380506.db2.gz WNOJMMRJKPLLIH-QWRGUYRKSA-N 2 0 234.334 2.494 20 0 BEADRP CCOCCC[N@H+](C)CC[C@@H]1CCCC[NH+]1C ZINC000075860660 344785943 /nfs/dbraw/zinc/78/59/43/344785943.db2.gz CKYGOAWUPHQVEA-AWEZNQCLSA-N 2 0 242.407 2.219 20 0 BEADRP CC[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH3+] ZINC000039102034 344850335 /nfs/dbraw/zinc/85/03/35/344850335.db2.gz OXJYWERKFNGMGY-KBPBESRZSA-N 2 0 218.344 2.246 20 0 BEADRP C[N@H+](C[C@H]1CCC[NH+](C)C1)CC1(C)CCC1 ZINC000432833663 537869180 /nfs/dbraw/zinc/86/91/80/537869180.db2.gz DYMNSCNVNPQOQR-ZDUSSCGKSA-N 2 0 224.392 2.450 20 0 BEADRP Cc1ccc([C@H](C)C[NH+]2C[C@@H]3C[NH2+]C[C@H]3C2)cc1 ZINC000628191884 344946580 /nfs/dbraw/zinc/94/65/80/344946580.db2.gz YGSYAXSUPOHCLI-KBMXLJTQSA-N 2 0 244.382 2.250 20 0 BEADRP CO[C@@H]1CCC[C@@H]([NH2+]CCC[N@H+](C)C(C)C)C1 ZINC000234838914 537879698 /nfs/dbraw/zinc/87/96/98/537879698.db2.gz YZCYVKTWFCDCSX-ZIAGYGMSSA-N 2 0 242.407 2.264 20 0 BEADRP C[C@H](c1cccs1)[N@H+](C)C[C@H]1CC[NH2+]C1 ZINC000248089924 345037069 /nfs/dbraw/zinc/03/70/69/345037069.db2.gz UWQCPGDFYYIQES-MNOVXSKESA-N 2 0 224.373 2.350 20 0 BEADRP C(C1CC1)[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000156527990 345176969 /nfs/dbraw/zinc/17/69/69/345176969.db2.gz FPSVKDIZUXOLBH-AWEZNQCLSA-N 2 0 222.376 2.204 20 0 BEADRP C[NH2+]Cc1cccc(NC[C@@H](C[NH3+])C(C)C)c1 ZINC000634995425 345184472 /nfs/dbraw/zinc/18/44/72/345184472.db2.gz DQLOTMCXTKWJGJ-CYBMUJFWSA-N 2 0 235.375 2.049 20 0 BEADRP CC[NH2+]Cc1cccc(NC[C@@H](C[NH3+])C(C)C)c1 ZINC000634995456 345185240 /nfs/dbraw/zinc/18/52/40/345185240.db2.gz FKQPOQMJGNGBMR-CQSZACIVSA-N 2 0 249.402 2.439 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1ccon1 ZINC000634948911 345125394 /nfs/dbraw/zinc/12/53/94/345125394.db2.gz APQMBTSLINQTLA-LBPRGKRZSA-N 2 0 239.363 2.275 20 0 BEADRP C/C=C/C[C@@H]1CCCN(CC23CC(C2)C[NH2+]3)C1 ZINC000634997045 345193837 /nfs/dbraw/zinc/19/38/37/345193837.db2.gz BOHQHWUXFLHQOD-OESAVHMQSA-N 2 0 234.387 2.417 20 0 BEADRP Cc1ccc(C[N@@H+]2C[C@@H](C[NH3+])[C@H](C)C2)s1 ZINC000634998709 345198603 /nfs/dbraw/zinc/19/86/03/345198603.db2.gz JNKPVLKOTDWMFG-MWLCHTKSSA-N 2 0 224.373 2.083 20 0 BEADRP Cc1cc(C[N@@H+]2C[C@@H](C[NH3+])[C@H](C)C2)ccc1F ZINC000634998868 345199022 /nfs/dbraw/zinc/19/90/22/345199022.db2.gz LZPQSPUSFSCADX-DGCLKSJQSA-N 2 0 236.334 2.161 20 0 BEADRP C[C@@H]1C[N@H+](C/C=C/c2ccc(F)cc2)C[C@H]1C[NH3+] ZINC000634998760 345199083 /nfs/dbraw/zinc/19/90/83/345199083.db2.gz KORNVFXDYKFDHQ-SDEBIZQBSA-N 2 0 248.345 2.366 20 0 BEADRP Cc1ccsc1C[N@@H+]1C[C@@H](C[NH3+])[C@H](C)C1 ZINC000634999741 345200106 /nfs/dbraw/zinc/20/01/06/345200106.db2.gz YNWZGCQEXRIFHS-GHMZBOCLSA-N 2 0 224.373 2.083 20 0 BEADRP Cc1cc(F)ccc1C[N@H+]1C[C@H](C)[C@H](C[NH3+])C1 ZINC000634999666 345200592 /nfs/dbraw/zinc/20/05/92/345200592.db2.gz XOCUEKZOXISMEW-WCQYABFASA-N 2 0 236.334 2.161 20 0 BEADRP CCOc1ccccc1C[N@@H+]1C[C@H](C)[C@H](C[NH3+])C1 ZINC000635000501 345202172 /nfs/dbraw/zinc/20/21/72/345202172.db2.gz PSMVAUYCAWYXCW-GXTWGEPZSA-N 2 0 248.370 2.112 20 0 BEADRP C1CC12CCC[C@@H]2[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000634998046 345202921 /nfs/dbraw/zinc/20/29/21/345202921.db2.gz ZTRVOEFXMQDBJV-NEPJUHHUSA-N 2 0 208.349 2.051 20 0 BEADRP C[C@H]([NH2+]Cc1cccc2c1CC[NH2+]C2)[C@H]1C[C@H]1C ZINC000635002897 345205579 /nfs/dbraw/zinc/20/55/79/345205579.db2.gz AYSPRIQVLVUVIC-WQGACYEGSA-N 2 0 244.382 2.466 20 0 BEADRP C[C@H](CC1CC1)[NH2+][C@H]1CC[C@H](C[NH3+])CC1 ZINC000635004159 345206999 /nfs/dbraw/zinc/20/69/99/345206999.db2.gz COCLSGSRAKTWMS-RAIGVLPGSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+][C@H]1CCCC12CC2 ZINC000635004316 345207521 /nfs/dbraw/zinc/20/75/21/345207521.db2.gz OGBBHHGKVYFOSK-TUAOUCFPSA-N 2 0 208.349 2.036 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CC(C)(C)F ZINC000635004485 345207640 /nfs/dbraw/zinc/20/76/40/345207640.db2.gz PIKIRKRKDPLWOD-VIFPVBQESA-N 2 0 239.338 2.247 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)c1ccoc1 ZINC000635005540 345209776 /nfs/dbraw/zinc/20/97/76/345209776.db2.gz JFHOKUKYWUJOGB-GVXVVHGQSA-N 2 0 222.332 2.448 20 0 BEADRP CC(C)(F)C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000635006494 345210581 /nfs/dbraw/zinc/21/05/81/345210581.db2.gz YWAONWNFLDVRLK-GRYCIOLGSA-N 2 0 228.355 2.245 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+][C@H]2CC[C@H](C[NH3+])CC2)C1 ZINC000635006357 345210814 /nfs/dbraw/zinc/21/08/14/345210814.db2.gz MEMYPDZSIWWHDY-ZDEQEGDKSA-N 2 0 210.365 2.282 20 0 BEADRP CO[C@@H]1CCC[C@@H]([NH2+][C@H]2CC[C@H](C[NH3+])CC2)C1 ZINC000635006900 345211041 /nfs/dbraw/zinc/21/10/41/345211041.db2.gz ULOHTKZCUWSZDC-AAVRWANBSA-N 2 0 240.391 2.051 20 0 BEADRP COCCC[C@@H](C)[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000635010526 345212668 /nfs/dbraw/zinc/21/26/68/345212668.db2.gz KCJPBQAVPDBFGF-CHWSQXEVSA-N 2 0 242.407 2.169 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]Cc1ccc2cccnc2c1 ZINC000635020083 345222586 /nfs/dbraw/zinc/22/25/86/345222586.db2.gz JPJUARNHGKMZPP-NWDGAFQWSA-N 2 0 243.354 2.450 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]Cc1ccc2cccnc2c1 ZINC000635020085 345222695 /nfs/dbraw/zinc/22/26/95/345222695.db2.gz JPJUARNHGKMZPP-VXGBXAGGSA-N 2 0 243.354 2.450 20 0 BEADRP CCCC[N@@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000081632178 345488733 /nfs/dbraw/zinc/48/87/33/345488733.db2.gz VONPVOBDSDIYSW-AWEZNQCLSA-N 2 0 224.392 2.450 20 0 BEADRP Cc1cc(NC(C)(C)c2ncc[nH]2)nc(C)n1 ZINC000641663245 362586282 /nfs/dbraw/zinc/58/62/82/362586282.db2.gz SABJIXPTQQQNSX-UHFFFAOYSA-N 2 0 231.303 2.164 20 0 BEADRP C[C@@H](CC[NH3+])[NH2+]Cc1ccnc2ccccc12 ZINC000136136226 345480092 /nfs/dbraw/zinc/48/00/92/345480092.db2.gz AOOHPKZBXCSNQB-NSHDSACASA-N 2 0 229.327 2.062 20 0 BEADRP Cc1ccc(CN(C)[C@H](C[NH3+])C2CC2)c(C)c1 ZINC000159757108 345518225 /nfs/dbraw/zinc/51/82/25/345518225.db2.gz KWPNEEBEGBFNMU-OAHLLOKOSA-N 2 0 232.371 2.473 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCCF)[C@H](C)C1 ZINC000137645863 345668150 /nfs/dbraw/zinc/66/81/50/345668150.db2.gz XZJBOUXEAOGVHO-VXGBXAGGSA-N 2 0 216.344 2.008 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@H]1CC[C@@H](C)C1 ZINC000164421871 535004237 /nfs/dbraw/zinc/00/42/37/535004237.db2.gz PTECQPJVAUOSNZ-OLZOCXBDSA-N 2 0 212.381 2.495 20 0 BEADRP CCCC(O)(CCC)C[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000577076473 365805954 /nfs/dbraw/zinc/80/59/54/365805954.db2.gz HKEVQXWCGNHTAU-STQMWFEESA-N 2 0 242.407 2.177 20 0 BEADRP C[N@@H+]1CC[C@@]2(CC[NH+](CC(C)(C)C)C2)C1 ZINC000145267900 345710617 /nfs/dbraw/zinc/71/06/17/345710617.db2.gz SCIHQICGGGREFL-CYBMUJFWSA-N 2 0 210.365 2.060 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+]CCC1=CC[NH2+]CC1 ZINC000319178520 259386284 /nfs/dbraw/zinc/38/62/84/259386284.db2.gz NWQIZBGHABRZEF-RYUDHWBXSA-N 2 0 210.365 2.320 20 0 BEADRP C[C@H]1C[C@@H](NCc2cnc(C3CC3)o2)CC[N@@H+]1C ZINC000628223411 345964317 /nfs/dbraw/zinc/96/43/17/345964317.db2.gz CYPPSQQJZIHXGW-JQWIXIFHSA-N 2 0 249.358 2.124 20 0 BEADRP C(C1CC1)[NH+]1CCC([NH2+][C@@H]2CC23CC3)CC1 ZINC000569685504 345975452 /nfs/dbraw/zinc/97/54/52/345975452.db2.gz WCJITYWFVFEKDV-CYBMUJFWSA-N 2 0 220.360 2.003 20 0 BEADRP CC[C@H](CSC)[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000401008674 346030823 /nfs/dbraw/zinc/03/08/23/346030823.db2.gz FVLNTVPPICRYKC-YVECIDJPSA-N 2 0 242.432 2.106 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)[C@@H]1CC1(C)C ZINC000381492590 346077337 /nfs/dbraw/zinc/07/73/37/346077337.db2.gz YTEWIFGUFMQDDG-XQQFMLRXSA-N 2 0 224.392 2.352 20 0 BEADRP CCC1(C[NH2+][C@H](C)C2CC[NH+](C)CC2)CC1 ZINC000090219716 537955902 /nfs/dbraw/zinc/95/59/02/537955902.db2.gz TYDQRCPVOJRPDE-GFCCVEGCSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1cccc(C)c1C[N@H+]1CC[C@@H]([C@H](C)[NH3+])C1 ZINC000228203941 179036219 /nfs/dbraw/zinc/03/62/19/179036219.db2.gz IPURWBODKIZTEQ-UONOGXRCSA-N 2 0 232.371 2.473 20 0 BEADRP CC(C)[C@@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)C1CC1 ZINC000563348530 323119826 /nfs/dbraw/zinc/11/98/26/323119826.db2.gz BTFIMBDCIPTINL-RAIGVLPGSA-N 2 0 210.365 2.151 20 0 BEADRP C[C@@H]1CCC[N@H+](C[C@H]2CCCC[NH2+]C2)[C@@H]1C ZINC000669378552 537968993 /nfs/dbraw/zinc/96/89/93/537968993.db2.gz GODLHYWPBQHANE-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1cccc(C[N@@H+]2CCC[C@@H](C[NH3+])C2)c1C ZINC000044528080 179074796 /nfs/dbraw/zinc/07/47/96/179074796.db2.gz JYHYNDJJZHCBIO-AWEZNQCLSA-N 2 0 232.371 2.474 20 0 BEADRP Cc1cccc(C[N@H+]2CC[C@@H]([NH3+])C[C@@H]2C)c1 ZINC000049713004 179078605 /nfs/dbraw/zinc/07/86/05/179078605.db2.gz OGAWICBJXCBKIG-GXTWGEPZSA-N 2 0 218.344 2.307 20 0 BEADRP Cc1cccc(C[N@H+]2CC[C@@H](C)[C@@H](C[NH3+])C2)c1 ZINC000229060496 179080057 /nfs/dbraw/zinc/08/00/57/179080057.db2.gz PZQZIZURPBSUOU-HIFRSBDPSA-N 2 0 232.371 2.412 20 0 BEADRP Cc1cccc(C[N@H+]2CC[C@@H]([C@H](C)[NH3+])C2)c1C ZINC000228151531 179081487 /nfs/dbraw/zinc/08/14/87/179081487.db2.gz ZFEKOWXRNGNBGA-DZGCQCFKSA-N 2 0 232.371 2.473 20 0 BEADRP Cc1cccc(C[N@H+]2C[C@H](C[NH3+])C[C@H]2C)c1 ZINC000228078139 179083840 /nfs/dbraw/zinc/08/38/40/179083840.db2.gz UKQFXGDBFGXMLS-OCCSQVGLSA-N 2 0 218.344 2.164 20 0 BEADRP Cc1cccc(C[NH2+]C2CCC([NH3+])CC2)c1 ZINC000051692868 179090075 /nfs/dbraw/zinc/09/00/75/179090075.db2.gz OVHDJFQIAVVZQI-UHFFFAOYSA-N 2 0 218.344 2.355 20 0 BEADRP Cc1cccc(C[NH2+]CCCC[NH+](C)C)c1 ZINC000045598384 179090454 /nfs/dbraw/zinc/09/04/54/179090454.db2.gz ZAPQXNUSXKOIRK-UHFFFAOYSA-N 2 0 220.360 2.426 20 0 BEADRP Cc1cccc(C[NH2+]C[C@H](C)C[NH+](C)C)c1 ZINC000291638181 179094140 /nfs/dbraw/zinc/09/41/40/179094140.db2.gz BCVGNSDQCSVNNG-ZDUSSCGKSA-N 2 0 220.360 2.282 20 0 BEADRP CO[C@H](C[NH2+][C@H]1C[C@@H]([NH3+])C1(C)C)c1ccccc1 ZINC000641801101 362755234 /nfs/dbraw/zinc/75/52/34/362755234.db2.gz NBYMOGMNNLOWQI-MCIONIFRSA-N 2 0 248.370 2.090 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H]1CC[C@@H]1C1CCC1 ZINC000574981065 346488300 /nfs/dbraw/zinc/48/83/00/346488300.db2.gz WOFODTDJNBOYJT-OLZOCXBDSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H](CCC1CC1)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000186330258 346501606 /nfs/dbraw/zinc/50/16/06/346501606.db2.gz WYEBNRITZBTHBZ-TZMCWYRMSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H](CCC1CC1)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000186330223 346501629 /nfs/dbraw/zinc/50/16/29/346501629.db2.gz WYEBNRITZBTHBZ-OCCSQVGLSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1cnccc1CN1[C@@H](C)[C@@H](C)CC[C@H]1C[NH3+] ZINC000641806384 362764260 /nfs/dbraw/zinc/76/42/60/362764260.db2.gz RIPAHFCEZSMLRI-WHOFXGATSA-N 2 0 247.386 2.338 20 0 BEADRP COC[C@@H](C)[NH2+]CCCC[N@@H+]1CCCC[C@H]1C ZINC000345163078 365822208 /nfs/dbraw/zinc/82/22/08/365822208.db2.gz TXPQUMGADNBVOA-ZIAGYGMSSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H](C)Cc1ccsc1 ZINC000580182193 346621653 /nfs/dbraw/zinc/62/16/53/346621653.db2.gz RYMZVISCZDSYNX-DCAQKATOSA-N 2 0 226.389 2.395 20 0 BEADRP COC[C@H](C)C[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C ZINC000187912194 346648713 /nfs/dbraw/zinc/64/87/13/346648713.db2.gz DKOKQKKMLYWWGC-OLZOCXBDSA-N 2 0 244.423 2.225 20 0 BEADRP Cc1cccc(OCC[N@@H+]2CCC[C@H](C[NH3+])C2)c1 ZINC000011888581 179166576 /nfs/dbraw/zinc/16/65/76/179166576.db2.gz BHWFXGULFDAUQU-CQSZACIVSA-N 2 0 248.370 2.045 20 0 BEADRP COC[C@H](C)C[NH2+]CC[C@@H](C)[NH+]1CCCCC1 ZINC000188377921 346806238 /nfs/dbraw/zinc/80/62/38/346806238.db2.gz XIGZKNLIUUBHLM-ZIAGYGMSSA-N 2 0 242.407 2.123 20 0 BEADRP CCC[C@H](C)C[N@@H+]1C[C@@H]2CCC[C@@]2([NH3+])C1 ZINC000622004475 370654182 /nfs/dbraw/zinc/65/41/82/370654182.db2.gz PGYLMEFOGKNULV-RWMBFGLXSA-N 2 0 210.365 2.236 20 0 BEADRP Cc1cc(F)ccc1CN1C[C@H]2CCC[C@]2([NH3+])C1 ZINC000622004667 370655961 /nfs/dbraw/zinc/65/59/61/370655961.db2.gz SHDLVZOGITZRBL-HIFRSBDPSA-N 2 0 248.345 2.447 20 0 BEADRP Cc1cc(F)ccc1CN1C[C@H]2CCC[C@@]2([NH3+])C1 ZINC000622004668 370656237 /nfs/dbraw/zinc/65/62/37/370656237.db2.gz SHDLVZOGITZRBL-UKRRQHHQSA-N 2 0 248.345 2.447 20 0 BEADRP CC[C@@H]([NH2+][C@@H]1CCc2nc[nH]c2C1)C1CC1 ZINC000310041306 347223441 /nfs/dbraw/zinc/22/34/41/347223441.db2.gz YMFXFPJUGDICHE-GHMZBOCLSA-N 2 0 219.332 2.045 20 0 BEADRP C[C@@H](CCCCO)[NH2+]CCC[NH+]1CCCCC1 ZINC000679330512 488340451 /nfs/dbraw/zinc/34/04/51/488340451.db2.gz LNTFMHDDRQHPAM-AWEZNQCLSA-N 2 0 242.407 2.003 20 0 BEADRP CC[C@H](C)[C@@H](C)[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000319245573 347340407 /nfs/dbraw/zinc/34/04/07/347340407.db2.gz WZTIUWXMZSDMDH-YNEHKIRRSA-N 2 0 212.381 2.400 20 0 BEADRP C(C[NH2+]C1CCCCC1)C[NH+]1CCCC1 ZINC000020129138 347408241 /nfs/dbraw/zinc/40/82/41/347408241.db2.gz HIVQRIJPEOZWFU-UHFFFAOYSA-N 2 0 210.365 2.395 20 0 BEADRP COc1ccc(C[N@@H+]2CC[C@@H]([C@H](C)[NH3+])C2)cc1C ZINC000252774305 347434865 /nfs/dbraw/zinc/43/48/65/347434865.db2.gz JRARVLLLAJZYFS-GXTWGEPZSA-N 2 0 248.370 2.173 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+]C[C@@H]1CCCC1(C)C ZINC000388512092 347437481 /nfs/dbraw/zinc/43/74/81/347437481.db2.gz VSGSQZLDSIEOGX-QWHCGFSZSA-N 2 0 242.407 2.156 20 0 BEADRP Cc1ccccc1CC[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000132284149 179265850 /nfs/dbraw/zinc/26/58/50/179265850.db2.gz WWENZJHFZDHLMN-AWEZNQCLSA-N 2 0 232.371 2.127 20 0 BEADRP Cc1ccccc1CC[NH2+][C@H]1CCC[C@@H]1C[NH3+] ZINC000094182725 179267325 /nfs/dbraw/zinc/26/73/25/179267325.db2.gz KSNYARNHFBWAAD-CABCVRRESA-N 2 0 232.371 2.255 20 0 BEADRP Cc1ccccc1C[N@H+]1CC[C@@H](C)[C@H](C[NH3+])C1 ZINC000163438135 179274697 /nfs/dbraw/zinc/27/46/97/179274697.db2.gz DVWDWYGCPMUCEO-UKRRQHHQSA-N 2 0 232.371 2.412 20 0 BEADRP C[C@H]([NH3+])[C@H](C)[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC000415009641 323152517 /nfs/dbraw/zinc/15/25/17/323152517.db2.gz GDPDHYFFKWDLCO-IMIFBBOLSA-N 2 0 218.344 2.115 20 0 BEADRP Cc1ccccc1C[C@H](C)[NH2+]C[C@@H](C)C[NH3+] ZINC000309396109 179290706 /nfs/dbraw/zinc/29/07/06/179290706.db2.gz UMINDUQADLDYRK-AAEUAGOBSA-N 2 0 220.360 2.110 20 0 BEADRP CSC1(C[NH2+]CCC[N@H+](C)CC(C)C)CC1 ZINC000593645378 347926096 /nfs/dbraw/zinc/92/60/96/347926096.db2.gz IBXRKXJDFSJPMO-UHFFFAOYSA-N 2 0 244.448 2.450 20 0 BEADRP C[N@H+](CCC1CCC1)C[C@@H]1CCC[NH+](C)C1 ZINC000659949757 490113015 /nfs/dbraw/zinc/11/30/15/490113015.db2.gz VYSQWASIBDEMAI-CQSZACIVSA-N 2 0 224.392 2.450 20 0 BEADRP Cc1ccccc1[C@H](C)[NH2+]C[C@@H](C)C[NH3+] ZINC000309003979 179337349 /nfs/dbraw/zinc/33/73/49/179337349.db2.gz STIVIZNYQUKWGV-JQWIXIFHSA-N 2 0 206.333 2.240 20 0 BEADRP CCSCC[NH2+][C@H]1CCCN2CCCC[C@@H]12 ZINC000594611920 348082400 /nfs/dbraw/zinc/08/24/00/348082400.db2.gz PGXTYLZATNFFGA-STQMWFEESA-N 2 0 242.432 2.346 20 0 BEADRP CSC1(C[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)CCC1 ZINC000594616354 348084057 /nfs/dbraw/zinc/08/40/57/348084057.db2.gz YOEUGWOZLYKCRI-TXEJJXNPSA-N 2 0 242.432 2.202 20 0 BEADRP CCc1ccc([C@H](C)[NH2+]CC2CC[NH2+]CC2)o1 ZINC000571669347 323177062 /nfs/dbraw/zinc/17/70/62/323177062.db2.gz HTSJBJKSEBJYGE-NSHDSACASA-N 2 0 236.359 2.492 20 0 BEADRP CSC1(C[NH2+]Cc2cnc(C)n2C)CCC1 ZINC000594936608 348141901 /nfs/dbraw/zinc/14/19/01/348141901.db2.gz FSSQRTYGORBSLB-UHFFFAOYSA-N 2 0 239.388 2.104 20 0 BEADRP C[C@@H](CSCCF)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000595015443 348186036 /nfs/dbraw/zinc/18/60/36/348186036.db2.gz FEDNYMWKBFDATF-NWDGAFQWSA-N 2 0 248.411 2.009 20 0 BEADRP CCSC1(C[NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)CC1 ZINC000595100236 348195007 /nfs/dbraw/zinc/19/50/07/348195007.db2.gz QDCHLMZEFHPJME-RYUDHWBXSA-N 2 0 242.432 2.344 20 0 BEADRP CC(C)[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000123402697 187389140 /nfs/dbraw/zinc/38/91/40/187389140.db2.gz HFLCQXFJPFBEFZ-UHFFFAOYSA-N 2 0 212.381 2.449 20 0 BEADRP CCCCOCC[N@H+](C)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000049264134 187395905 /nfs/dbraw/zinc/39/59/05/187395905.db2.gz RWTMHOKUUNZINY-PBWFPOADSA-N 2 0 240.391 2.018 20 0 BEADRP CC(C)(C)[C@@H]1CCC[N@@H+]1C[C@@H]1CCC[NH2+]C1 ZINC000257782416 535075447 /nfs/dbraw/zinc/07/54/47/535075447.db2.gz QLPVATVGLHXTPK-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP CCSC1(C[NH2+][C@@H]2CC[NH2+]CC[C@H]2C)CC1 ZINC000596650121 348605303 /nfs/dbraw/zinc/60/53/03/348605303.db2.gz GURNUVWSIHAHOM-VXGBXAGGSA-N 2 0 242.432 2.250 20 0 BEADRP CCSC1(C[NH2+][C@@H]2CCCC[C@@H]2C[NH3+])CC1 ZINC000596649017 348605489 /nfs/dbraw/zinc/60/54/89/348605489.db2.gz ACGDEQWQABVQRJ-VXGBXAGGSA-N 2 0 242.432 2.379 20 0 BEADRP CSCC1(CC[NH2+][C@@H]2CCC[C@H]([NH3+])C2)CC1 ZINC000596651879 348606006 /nfs/dbraw/zinc/60/60/06/348606006.db2.gz RHODEEIGOCFSHP-NWDGAFQWSA-N 2 0 242.432 2.379 20 0 BEADRP CCSC1(C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)CC1 ZINC000596652889 348606704 /nfs/dbraw/zinc/60/67/04/348606704.db2.gz QNRCQODGEVXXOY-GHMZBOCLSA-N 2 0 228.405 2.132 20 0 BEADRP CCSC1(C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)CC1 ZINC000596652892 348606821 /nfs/dbraw/zinc/60/68/21/348606821.db2.gz QNRCQODGEVXXOY-WDEREUQCSA-N 2 0 228.405 2.132 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CC2(C(F)F)CC2)CC1(C)C ZINC000623510611 362936690 /nfs/dbraw/zinc/93/66/90/362936690.db2.gz CQSLIHSIKQWPLT-JTQLQIEISA-N 2 0 246.345 2.494 20 0 BEADRP CS[C@H](C)C[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1 ZINC000598970266 349069545 /nfs/dbraw/zinc/06/95/45/349069545.db2.gz LTJXBYHQSDDLMV-MNOVXSKESA-N 2 0 230.421 2.200 20 0 BEADRP CS[C@@H](C)C[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1 ZINC000598970267 349069569 /nfs/dbraw/zinc/06/95/69/349069569.db2.gz LTJXBYHQSDDLMV-QWRGUYRKSA-N 2 0 230.421 2.200 20 0 BEADRP CC[C@]1(C)CC[N@H+](C[C@@H]([NH3+])CC(C)C)C1 ZINC000399422498 323206045 /nfs/dbraw/zinc/20/60/45/323206045.db2.gz VKEABJNQPGHWIN-QWHCGFSZSA-N 2 0 212.381 2.482 20 0 BEADRP C[C@@H]([N@H+](C)C[C@H]1CCC[NH2+]C1)C(C)(C)C ZINC000251028809 349181624 /nfs/dbraw/zinc/18/16/24/349181624.db2.gz HJRDZGYJMGOCRP-NEPJUHHUSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H]1CC[C@H]([NH2+][C@H]2CCC[C@@H]([NH3+])C2)CC1 ZINC000253117811 349224515 /nfs/dbraw/zinc/22/45/15/349224515.db2.gz GUBGSODFOXBQMU-LPWJVIDDSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@@H]1CSC[C@@H]1[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623521705 362943645 /nfs/dbraw/zinc/94/36/45/362943645.db2.gz CJTQDWCIBSNVHW-UTUOFQBUSA-N 2 0 242.432 2.200 20 0 BEADRP CC(C)[N@@H+]1CC[C@H](C[NH2+][C@@H]2CCC[C@H]2C)C1 ZINC000252107119 349196026 /nfs/dbraw/zinc/19/60/26/349196026.db2.gz HEWSJGGECOMNGV-MGPQQGTHSA-N 2 0 224.392 2.495 20 0 BEADRP Cc1cscc1C[NH2+][C@H](C)CCC[NH3+] ZINC000336679969 179805987 /nfs/dbraw/zinc/80/59/87/179805987.db2.gz FWNJYXNFGCNMLY-SNVBAGLBSA-N 2 0 212.362 2.274 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[NH2+]C[C@@H]1C ZINC000388634450 349279248 /nfs/dbraw/zinc/27/92/48/349279248.db2.gz MEHMUEDDJOQREN-LOWDOPEQSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)(C)CCC[N@@H+]1CCC[C@H](C[NH3+])C1 ZINC000300835213 349357344 /nfs/dbraw/zinc/35/73/44/349357344.db2.gz ILTZZZLQAAWTPN-GFCCVEGCSA-N 2 0 212.381 2.483 20 0 BEADRP C[C@H](CC1CC1)[NH2+]CC(C)(C)C[NH+](C)C ZINC000131887203 191017708 /nfs/dbraw/zinc/01/77/08/191017708.db2.gz SVEPCUZRUDKDIN-LLVKDONJSA-N 2 0 212.381 2.352 20 0 BEADRP C1CC2(C1)C[C@H]([NH2+]C1CCCC1)CC[NH2+]2 ZINC000129779227 490347586 /nfs/dbraw/zinc/34/75/86/490347586.db2.gz RCEMGCWLUQAWRP-GFCCVEGCSA-N 2 0 208.349 2.193 20 0 BEADRP CC[C@H]([NH2+][C@@H](C)CC[NH+](C)C)C1CCOCC1 ZINC000532491505 323269081 /nfs/dbraw/zinc/26/90/81/323269081.db2.gz BSNHVBIHFSELJS-JSGCOSHPSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H]([NH2+]CC1CC[NH+](C)CC1)C1CCC1 ZINC000133334584 191039661 /nfs/dbraw/zinc/03/96/61/191039661.db2.gz HOLCJMILHLWXGI-LLVKDONJSA-N 2 0 210.365 2.106 20 0 BEADRP CSCCCC[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@H]1C ZINC000133637609 191042687 /nfs/dbraw/zinc/04/26/87/191042687.db2.gz QIMVZSBPEYEUFG-FRRDWIJNSA-N 2 0 244.448 2.448 20 0 BEADRP Cc1ncc(C[N@@H+]2CCC[C@H](CC[NH3+])C2)s1 ZINC000069724472 180144184 /nfs/dbraw/zinc/14/41/84/180144184.db2.gz HACGSOIEGNJFIG-LLVKDONJSA-N 2 0 239.388 2.012 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+][C@H](C1CC1)C1CCC1 ZINC000324790578 323282446 /nfs/dbraw/zinc/28/24/46/323282446.db2.gz JURBLZZWGVVSIU-HONMWMINSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCC[C@@H]1C)C[NH+]1CCCC1 ZINC000083402360 350195524 /nfs/dbraw/zinc/19/55/24/350195524.db2.gz WMRXFPXICXMAJT-RDBSUJKOSA-N 2 0 224.392 2.497 20 0 BEADRP CCC[C@H]([NH2+]C[C@@H]1CCC[NH2+]1)C1CCC1 ZINC000324929727 323306480 /nfs/dbraw/zinc/30/64/80/323306480.db2.gz NHHWMVXWFBSPLD-STQMWFEESA-N 2 0 210.365 2.297 20 0 BEADRP Cc1ccc(OCC[NH2+][C@@H](C)CCC[NH3+])cc1 ZINC000422750885 192454128 /nfs/dbraw/zinc/45/41/28/192454128.db2.gz DUXMKNUXOSYDTK-ZDUSSCGKSA-N 2 0 236.359 2.091 20 0 BEADRP C[C@@H]1C[C@@H]1c1ccc(CN2C[C@H]3C[NH2+]C[C@@H]3C2)o1 ZINC000252218697 538086410 /nfs/dbraw/zinc/08/64/10/538086410.db2.gz ZUGDNDALWTXABJ-BYNQJWBRSA-N 2 0 246.354 2.054 20 0 BEADRP CC(C)[C@@H](C)[NH2+]Cc1ccc(C[NH3+])cc1 ZINC000319251418 350265499 /nfs/dbraw/zinc/26/54/99/350265499.db2.gz XTIGSKVAVVXQOG-LLVKDONJSA-N 2 0 206.333 2.279 20 0 BEADRP CC(C)C1CC([NH2+]CCN2CC[C@@H](C)C2)C1 ZINC000309305252 350275934 /nfs/dbraw/zinc/27/59/34/350275934.db2.gz AOSMPMIZSMVNLC-IYXRBSQSSA-N 2 0 224.392 2.352 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@H]2CC=CCC2)CC1 ZINC000037977181 350297284 /nfs/dbraw/zinc/29/72/84/350297284.db2.gz SZFPXTHWIKRKFH-ZDUSSCGKSA-N 2 0 222.376 2.417 20 0 BEADRP Cc1ncsc1CN1CCC[C@@H](C)[C@H]1C[NH3+] ZINC000228290494 180316410 /nfs/dbraw/zinc/31/64/10/180316410.db2.gz PRBUBWTUBUPDTO-MWLCHTKSSA-N 2 0 239.388 2.011 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CCOC2(C)C)CC1(C)C ZINC000623537452 362957018 /nfs/dbraw/zinc/95/70/18/362957018.db2.gz YKSCGTVDUBYYDO-NWDGAFQWSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CCCc1nccs1 ZINC000391128320 350463779 /nfs/dbraw/zinc/46/37/79/350463779.db2.gz BCOKFOVUUVUEBF-LLVKDONJSA-N 2 0 241.404 2.183 20 0 BEADRP CC[C@](C)(C[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1)OC ZINC000623538711 362958329 /nfs/dbraw/zinc/95/83/29/362958329.db2.gz RIBKIFNNWZBMRI-GXTWGEPZSA-N 2 0 242.407 2.264 20 0 BEADRP C[C@@H]([NH3+])[C@H]1CC[N@H+](CCCOc2ccccc2)C1 ZINC000163172387 350508833 /nfs/dbraw/zinc/50/88/33/350508833.db2.gz GZEWUYAOGDGPGK-KGLIPLIRSA-N 2 0 248.370 2.125 20 0 BEADRP CCC(C)(C)CC[N@@H+]1CC[C@H]2[NH2+]CC[C@@H]2C1 ZINC000428029317 191109607 /nfs/dbraw/zinc/10/96/07/191109607.db2.gz ABSCJAUJNRPTGF-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)C2(C)CC2)C1 ZINC000151131211 191114628 /nfs/dbraw/zinc/11/46/28/191114628.db2.gz FDIJKVHFAQEVSH-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)CCC[NH+]1CCC(CC[NH3+])CC1 ZINC000124158533 350684581 /nfs/dbraw/zinc/68/45/81/350684581.db2.gz LFZYQUURCRVMLJ-UHFFFAOYSA-N 2 0 212.381 2.483 20 0 BEADRP C[N@H+](C[C@@]1(C)CC[NH2+]C1)C1CC(C)(C)C1 ZINC000334620982 350726298 /nfs/dbraw/zinc/72/62/98/350726298.db2.gz HLFXYDNJFSFCJO-ZDUSSCGKSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1SCC[C@H]1[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623558515 362980882 /nfs/dbraw/zinc/98/08/82/362980882.db2.gz AGILQMCDTQNJIW-QJPTWQEYSA-N 2 0 242.432 2.343 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)CC2CCC2)C1 ZINC000252709095 538099570 /nfs/dbraw/zinc/09/95/70/538099570.db2.gz CAFGXXFNXDRBOX-TZMCWYRMSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+]Cc1ccccc1 ZINC000129224603 351008712 /nfs/dbraw/zinc/00/87/12/351008712.db2.gz CXAIPSWWKFQZEX-CYBMUJFWSA-N 2 0 206.333 2.150 20 0 BEADRP CCCC[C@@H](C)[NH2+]C[C@@H](C)C[NH+](C)C ZINC000336691301 350984277 /nfs/dbraw/zinc/98/42/77/350984277.db2.gz PSFRJFLOSHKMGP-VXGBXAGGSA-N 2 0 200.370 2.352 20 0 BEADRP COc1c(C)cc(CN(C)[C@H]2CC[NH2+]C2)cc1C ZINC000259235820 351068895 /nfs/dbraw/zinc/06/88/95/351068895.db2.gz YCQCVGSVFWMLIA-AWEZNQCLSA-N 2 0 248.370 2.106 20 0 BEADRP CN1CC(C[N@H+](C)Cc2ccc3[nH]ccc3c2)C1 ZINC000628338628 351285686 /nfs/dbraw/zinc/28/56/86/351285686.db2.gz QSYLGLNSQRIXAS-UHFFFAOYSA-N 2 0 243.354 2.161 20 0 BEADRP COCCC[NH+]1CCC([NH2+]CC(C)(C)C)CC1 ZINC000237194537 351362168 /nfs/dbraw/zinc/36/21/68/351362168.db2.gz KROJHCLMDWIPEQ-UHFFFAOYSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]C[C@H]2CCCS2)CC1 ZINC000087668005 535162147 /nfs/dbraw/zinc/16/21/47/535162147.db2.gz ZAGRZPBNAUBBEU-CYBMUJFWSA-N 2 0 242.432 2.344 20 0 BEADRP C[C@H]([NH2+]Cc1ccc(C[NH3+])cc1)c1cncs1 ZINC000577731078 366046729 /nfs/dbraw/zinc/04/67/29/366046729.db2.gz YALPHXGWAAYPCR-JTQLQIEISA-N 2 0 247.367 2.453 20 0 BEADRP Cc1ccc(CN[C@@H](C[NH3+])C2CCCCC2)nc1 ZINC000414854736 351905756 /nfs/dbraw/zinc/90/57/56/351905756.db2.gz VHHQSTNRYZDAAX-HNNXBMFYSA-N 2 0 247.386 2.387 20 0 BEADRP C[N@H+](CCOC(C)(C)C)C[C@@H]1CCC[NH+](C)C1 ZINC000152434547 191153046 /nfs/dbraw/zinc/15/30/46/191153046.db2.gz RDSKIKHTCINYKK-CYBMUJFWSA-N 2 0 242.407 2.075 20 0 BEADRP C(C[NH2+]CCC[NH+]1CCCCC1)C[C@H]1CCO1 ZINC000638308949 352136215 /nfs/dbraw/zinc/13/62/15/352136215.db2.gz OSXMIOBREMFVHL-AWEZNQCLSA-N 2 0 240.391 2.021 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@H](C)[C@H]1CC1(F)F ZINC000638338242 352158278 /nfs/dbraw/zinc/15/82/78/352158278.db2.gz UOEFKCAMYATAKF-GHMZBOCLSA-N 2 0 234.334 2.350 20 0 BEADRP CC[C@H](C[NH2+]C[C@](C)(CC)OC)N1CCCC1 ZINC000638353524 352167551 /nfs/dbraw/zinc/16/75/51/352167551.db2.gz APBFZMRNCQUGEX-KGLIPLIRSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)[C@@H]1CC1(F)F ZINC000638361025 352171718 /nfs/dbraw/zinc/17/17/18/352171718.db2.gz ZHTKRSCRDQNMFE-NHCYSSNCSA-N 2 0 244.329 2.104 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+]CCc2ccc(C)cc2)C1 ZINC000638380687 352190649 /nfs/dbraw/zinc/19/06/49/352190649.db2.gz FDRIFCPBZLKPQA-INIZCTEOSA-N 2 0 246.398 2.469 20 0 BEADRP C[C@@H]([NH2+]CCC1=CC[NH2+]CC1)c1ccoc1 ZINC000564560174 363127818 /nfs/dbraw/zinc/12/78/18/363127818.db2.gz OUIPYFIPCDPAGB-LLVKDONJSA-N 2 0 220.316 2.240 20 0 BEADRP CC[N@@H+]1CCC[C@@H](C[NH2+]C[C@@](C)(CC)OC)C1 ZINC000638452316 352263327 /nfs/dbraw/zinc/26/33/27/352263327.db2.gz XCLAYRJMVFJIIB-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)(C)CC[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000414916685 352270916 /nfs/dbraw/zinc/27/09/16/352270916.db2.gz QCOOLQXKRRZBRX-CYBMUJFWSA-N 2 0 212.381 2.402 20 0 BEADRP COc1cc(C[NH2+][C@H]2CCC[NH2+]CC2)ccc1C ZINC000414918284 352273509 /nfs/dbraw/zinc/27/35/09/352273509.db2.gz RVCFHEAZVWFVSI-AWEZNQCLSA-N 2 0 248.370 2.235 20 0 BEADRP CC(C)(C)OCC[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000252761151 538102541 /nfs/dbraw/zinc/10/25/41/538102541.db2.gz XHJKFHXMYOGRDK-STQMWFEESA-N 2 0 240.391 2.018 20 0 BEADRP CCc1ccc(C[NH2+][C@@H]2CC[NH2+][C@H](C)C2)cc1 ZINC000414944570 352367335 /nfs/dbraw/zinc/36/73/35/352367335.db2.gz HATYUZJYSSWCJI-IUODEOHRSA-N 2 0 232.371 2.479 20 0 BEADRP Cn1cccc1C[NH2+]CCCCC[NH+]1CCCC1 ZINC000293147801 180730214 /nfs/dbraw/zinc/73/02/14/180730214.db2.gz UQXAVIMEWNYAOS-UHFFFAOYSA-N 2 0 249.402 2.381 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@@H]2C[C@H]3C[C@H]3C2)CC[N@@H+]1C ZINC000638711290 352548833 /nfs/dbraw/zinc/54/88/33/352548833.db2.gz YLDGCOPNPRQKIZ-RKQHYHRCSA-N 2 0 222.376 2.105 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H]1CCC[C@@H]2C[C@@H]21 ZINC000378968285 352553936 /nfs/dbraw/zinc/55/39/36/352553936.db2.gz XHFIRKZAOWCESN-RDBSUJKOSA-N 2 0 224.392 2.497 20 0 BEADRP C[N@H+](CCc1ccccc1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000040746568 352603419 /nfs/dbraw/zinc/60/34/19/352603419.db2.gz OJQYDPPXUUNCTB-XYPWUTKMSA-N 2 0 244.382 2.444 20 0 BEADRP CC[NH+](CC)CCC[NH2+]C[C@@](C)(OC)C1CC1 ZINC000638863767 353038026 /nfs/dbraw/zinc/03/80/26/353038026.db2.gz MGUDFHMBMZZSMD-CQSZACIVSA-N 2 0 242.407 2.123 20 0 BEADRP Cc1ccc(OCC[N@@H+]2CCC[C@H](C[NH3+])C2)cc1 ZINC000011888590 188105181 /nfs/dbraw/zinc/10/51/81/188105181.db2.gz XGGJKPRMFOWHAD-CQSZACIVSA-N 2 0 248.370 2.045 20 0 BEADRP CC(C)[N@@H+]1CC[C@H](C[NH2+]C2CCSCC2)C1 ZINC000040622655 188118316 /nfs/dbraw/zinc/11/83/16/188118316.db2.gz GBLVZYISLAPOAF-GFCCVEGCSA-N 2 0 242.432 2.202 20 0 BEADRP CC(=O)Nc1cccc([C@H](C)[NH2+]CCCC[NH3+])c1 ZINC000037715171 358476650 /nfs/dbraw/zinc/47/66/50/358476650.db2.gz ZBOMHZDOOLUWDL-NSHDSACASA-N 2 0 249.358 2.035 20 0 BEADRP C(C[N@@H+]1CCC[NH2+]CC1)C1CCCCC1 ZINC000049660631 188153344 /nfs/dbraw/zinc/15/33/44/188153344.db2.gz VWSZWJWPMCJLIN-UHFFFAOYSA-N 2 0 210.365 2.252 20 0 BEADRP CCC[C@H](CC)[NH2+]CCCn1ccnc1 ZINC000050403233 188154142 /nfs/dbraw/zinc/15/41/42/188154142.db2.gz XHLCCPDQEMQDLR-LBPRGKRZSA-N 2 0 209.337 2.442 20 0 BEADRP CC(C)[C@H]1CCC[N@@H+]1C[C@@]1(C)CC[NH2+]C1 ZINC000226558054 188155617 /nfs/dbraw/zinc/15/56/17/188155617.db2.gz DGFYXAXNYDSJPT-OLZOCXBDSA-N 2 0 210.365 2.106 20 0 BEADRP CCOc1ccc([C@@H](C)[NH2+]CCCC[NH3+])cc1 ZINC000037714909 358476396 /nfs/dbraw/zinc/47/63/96/358476396.db2.gz ORKCRXAPHWDDII-GFCCVEGCSA-N 2 0 236.359 2.475 20 0 BEADRP C(C[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)CC1CC1 ZINC000161703355 538111663 /nfs/dbraw/zinc/11/16/63/538111663.db2.gz PFODZOTXPQGLFC-UONOGXRCSA-N 2 0 222.376 2.393 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C2CCC2)[C@@H]2CCC[C@H]21 ZINC000308924858 188165493 /nfs/dbraw/zinc/16/54/93/188165493.db2.gz HXXNZNYTIBFCLI-RWMBFGLXSA-N 2 0 208.349 2.001 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@@H]2C[C@@H](C)[C@@H]2C)CC1 ZINC000309279143 188167578 /nfs/dbraw/zinc/16/75/78/188167578.db2.gz FFXSFYMFCPPWDM-MBNYWOFBSA-N 2 0 224.392 2.493 20 0 BEADRP C1[C@@H]([NH2+]C2CC[NH2+]CC2)[C@H]1C1CCCCC1 ZINC000335650721 188170899 /nfs/dbraw/zinc/17/08/99/188170899.db2.gz XUQFUYGXJHWPBD-ZIAGYGMSSA-N 2 0 222.376 2.297 20 0 BEADRP CC1(C)CC[C@H]([NH2+][C@H]2CCC[C@H]([NH3+])C2)C1 ZINC000128573376 188220945 /nfs/dbraw/zinc/22/09/45/188220945.db2.gz WREZXLNJRZAORT-SRVKXCTJSA-N 2 0 210.365 2.425 20 0 BEADRP C([NH2+][C@@H]1CCC[C@H]1[C@H]1CCC[NH2+]1)C1CCC1 ZINC000250674222 188221304 /nfs/dbraw/zinc/22/13/04/188221304.db2.gz WFNOYZNPIPKBKS-BFHYXJOUSA-N 2 0 222.376 2.297 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000336769190 353284264 /nfs/dbraw/zinc/28/42/64/353284264.db2.gz VIQWLZCMOKQWQJ-RYUDHWBXSA-N 2 0 210.365 2.297 20 0 BEADRP CCC1(C[NH2+][C@H]2CC[N@H+](C)C[C@@H]2C)CCC1 ZINC000122720800 324054367 /nfs/dbraw/zinc/05/43/67/324054367.db2.gz UAHJAVIUJKEGDE-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)CCC[N@H+](C)[C@@H]1CCC[NH2+]CC1 ZINC000226468777 363219167 /nfs/dbraw/zinc/21/91/67/363219167.db2.gz OFDNAWPZTLTFAO-CYBMUJFWSA-N 2 0 212.381 2.497 20 0 BEADRP CC[N@@H+]1CCC[C@@H](C[NH2+]C[C@@H]2CCSC2)C1 ZINC000336773923 353420621 /nfs/dbraw/zinc/42/06/21/353420621.db2.gz WLNLAMAGYRFKIQ-STQMWFEESA-N 2 0 242.432 2.061 20 0 BEADRP CC[C@@H]1C[C@@H](C)C[N@@H+]1CCCn1ccnc1 ZINC000343306096 353524827 /nfs/dbraw/zinc/52/48/27/353524827.db2.gz UPDMOSXZSHPAFQ-CHWSQXEVSA-N 2 0 221.348 2.394 20 0 BEADRP CCc1nc(C)cc(NC[C@@H](C)[N@H+](C)C2CC2)n1 ZINC000288006482 353596017 /nfs/dbraw/zinc/59/60/17/353596017.db2.gz SEKOCNTVKJBAPD-LLVKDONJSA-N 2 0 248.374 2.242 20 0 BEADRP CO[C@@H](C)C[N@H+](CCCn1ccnc1)C(C)C ZINC000343323215 353698355 /nfs/dbraw/zinc/69/83/55/353698355.db2.gz UGLZRJXLFOUZHP-ZDUSSCGKSA-N 2 0 239.363 2.019 20 0 BEADRP CC(C)[C@H]1CC[N@H+](CCCn2ccnc2)C1 ZINC000343324789 353707538 /nfs/dbraw/zinc/70/75/38/353707538.db2.gz XRCDXRAIRWNYML-ZDUSSCGKSA-N 2 0 221.348 2.251 20 0 BEADRP C[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)C1CC(F)(F)C1 ZINC000529544401 324333244 /nfs/dbraw/zinc/33/32/44/324333244.db2.gz NYNSMIBMCXTOPD-SNVBAGLBSA-N 2 0 244.329 2.272 20 0 BEADRP CCC[NH+]1CCC([NH2+]C[C@@H]2C[C@H]2C2CC2)CC1 ZINC000449742647 202018466 /nfs/dbraw/zinc/01/84/66/202018466.db2.gz PXHRCEMHDGRURN-ZFWWWQNUSA-N 2 0 236.403 2.497 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]C[C@@H]2C[C@H]2C2CC2)CC1 ZINC000449743166 202017588 /nfs/dbraw/zinc/01/75/88/202017588.db2.gz VJJBVTYHQCNPPT-ZFWWWQNUSA-N 2 0 236.403 2.495 20 0 BEADRP C([NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)[C@@H]1C[C@H]1C1CC1 ZINC000449743393 202017698 /nfs/dbraw/zinc/01/76/98/202017698.db2.gz XFZJFYVDUMPKFH-YJNKXOJESA-N 2 0 234.387 2.249 20 0 BEADRP CCC[N@H+](CCC[NH+](C)C)C[C@@H](OC)C1CC1 ZINC000639175801 354207276 /nfs/dbraw/zinc/20/72/76/354207276.db2.gz TUZIPKCOTPGZIG-CQSZACIVSA-N 2 0 242.407 2.075 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]CCc1cc(F)ccc1F ZINC000422829461 192482541 /nfs/dbraw/zinc/48/25/41/192482541.db2.gz UOJGSRQPLPYSRD-JTQLQIEISA-N 2 0 242.313 2.224 20 0 BEADRP Cc1csc(C[NH+]2CCC(CC[NH3+])CC2)n1 ZINC000087391383 366144599 /nfs/dbraw/zinc/14/45/99/366144599.db2.gz VFOYLRPYEORWOQ-UHFFFAOYSA-N 2 0 239.388 2.012 20 0 BEADRP CC[C@](C)(C[N@H+](C)[C@@H]1CCN(C)C[C@H]1C)OC ZINC000639179544 354272822 /nfs/dbraw/zinc/27/28/22/354272822.db2.gz UCTSGLMUNNYPBY-MGPQQGTHSA-N 2 0 242.407 2.074 20 0 BEADRP C[C@H]1CCCC[C@@H]1C[NH2+]C[C@H]1CCCN1C ZINC000623634731 366199152 /nfs/dbraw/zinc/19/91/52/366199152.db2.gz YGQYWGSFXQSUSW-BFHYXJOUSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1cnccc1C[NH+]1CCC(C[NH+](C)C)CC1 ZINC000578022517 366185929 /nfs/dbraw/zinc/18/59/29/366185929.db2.gz YHIROAPLNBPLRL-UHFFFAOYSA-N 2 0 247.386 2.164 20 0 BEADRP C[C@@H]1CN(C)C[C@H]1[NH2+]CC1=CCCCC1 ZINC000334654497 354448145 /nfs/dbraw/zinc/44/81/45/354448145.db2.gz VVJRHSQAPKLWBG-DGCLKSJQSA-N 2 0 208.349 2.027 20 0 BEADRP CCOC1CC(C[NH2+][C@H](C)CN(C)C(C)C)C1 ZINC000639191416 354512631 /nfs/dbraw/zinc/51/26/31/354512631.db2.gz JILXNBGEIGDNAB-IYXRBSQSSA-N 2 0 242.407 2.120 20 0 BEADRP CC(C)C1(C[N@@H+]2CC[C@@]3(CC[NH+](C)C3)C2)CC1 ZINC000639202663 354607583 /nfs/dbraw/zinc/60/75/83/354607583.db2.gz AAPDONKNTCRTSY-CQSZACIVSA-N 2 0 236.403 2.450 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCCCC1(C)C)C1C[NH2+]C1 ZINC000335145919 354856408 /nfs/dbraw/zinc/85/64/08/354856408.db2.gz JRYBAXWVULJNIO-PWSUYJOCSA-N 2 0 210.365 2.153 20 0 BEADRP COC1CCC([NH2+][C@H]2CCCN(C)[C@@H]2C)CC1 ZINC000346329421 354898350 /nfs/dbraw/zinc/89/83/50/354898350.db2.gz MQQIDADIKLUGFL-RYSNWHEDSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@@H]([NH3+])[C@@H](C)[NH2+]C1CCC2(CCOCC2)CC1 ZINC000335160462 354911957 /nfs/dbraw/zinc/91/19/57/354911957.db2.gz XYDMRPAMZLZWKG-VXGBXAGGSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H]([NH2+]C1CCC2(CCOCC2)CC1)[C@H](C)[NH3+] ZINC000335160460 354912236 /nfs/dbraw/zinc/91/22/36/354912236.db2.gz XYDMRPAMZLZWKG-NWDGAFQWSA-N 2 0 240.391 2.051 20 0 BEADRP Cc1ccc(F)cc1C[NH2+]C1(C)CC[NH2+]CC1 ZINC000335171491 354936185 /nfs/dbraw/zinc/93/61/85/354936185.db2.gz KRSSAOGOCJOLPU-UHFFFAOYSA-N 2 0 236.334 2.366 20 0 BEADRP CC1(C)CC(C[NH+]2CCC3(CC[NH2+]C3)CC2)C1 ZINC000530218946 324537021 /nfs/dbraw/zinc/53/70/21/324537021.db2.gz IFHFJLRBBQWRNN-UHFFFAOYSA-N 2 0 236.403 2.498 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CC=CCC1)[C@H]1CCC[NH2+]1 ZINC000530217550 324535078 /nfs/dbraw/zinc/53/50/78/324535078.db2.gz HXBMABMNCBNPFG-HZSPNIEDSA-N 2 0 222.376 2.463 20 0 BEADRP CC1(C)CCC([NH2+][C@H]2CCC[C@@H]2[NH3+])CC1 ZINC000335217484 355056356 /nfs/dbraw/zinc/05/63/56/355056356.db2.gz OLDKXGFMORTJIS-RYUDHWBXSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]Cc1cccs1 ZINC000335219645 355059643 /nfs/dbraw/zinc/05/96/43/355059643.db2.gz UNCJWUNSANICJT-ZYHUDNBSSA-N 2 0 224.373 2.226 20 0 BEADRP Fc1ccc2c(c1)CC[N@@H+](CC[C@H]1CC[NH2+]C1)C2 ZINC000335238307 355099997 /nfs/dbraw/zinc/09/99/97/355099997.db2.gz FKNFGLQBQZRWEX-GFCCVEGCSA-N 2 0 248.345 2.183 20 0 BEADRP Cc1cnc(C[NH2+]C(C)(C)CCC[NH+](C)C)o1 ZINC000639230542 355168158 /nfs/dbraw/zinc/16/81/58/355168158.db2.gz CCVDNVFUGQNSCA-UHFFFAOYSA-N 2 0 239.363 2.193 20 0 BEADRP C[C@@H]1Cc2ccccc2C[N@@H+]1C[C@H]1CCC[NH2+]C1 ZINC000346975491 355209270 /nfs/dbraw/zinc/20/92/70/355209270.db2.gz JEOZXBLISFPACL-KGLIPLIRSA-N 2 0 244.382 2.433 20 0 BEADRP C[C@@H]1CC[C@]2(CC[N@H+](C[C@H]3CCC[NH2+]C3)C2)C1 ZINC000347000063 355197068 /nfs/dbraw/zinc/19/70/68/355197068.db2.gz YKRJHKIOIJPCIJ-ILXRZTDVSA-N 2 0 236.403 2.498 20 0 BEADRP C[C@@H]1C[N@H+](CC2CC[NH2+]CC2)[C@H]2CCCC[C@H]12 ZINC000347000584 355198191 /nfs/dbraw/zinc/19/81/91/355198191.db2.gz GMIODMFGYKLEMG-YUELXQCFSA-N 2 0 236.403 2.497 20 0 BEADRP CC[C@](C)(C[NH2+]CCCC[N@H+](C)C1CC1)OC ZINC000639243874 355232231 /nfs/dbraw/zinc/23/22/31/355232231.db2.gz DUMNFCKJIMAFFU-CQSZACIVSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)[C@H]1CC1(F)F ZINC000639257179 355301862 /nfs/dbraw/zinc/30/18/62/355301862.db2.gz JYTZGNILVMPYGV-QJPTWQEYSA-N 2 0 246.345 2.352 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]Cc2ccc3c[nH+]cn3c2)CS1 ZINC000639257222 355301995 /nfs/dbraw/zinc/30/19/95/355301995.db2.gz RPHUHHZVBHULPW-PWSUYJOCSA-N 2 0 247.367 2.318 20 0 BEADRP C[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)[C@@H]1C[C@H]1C ZINC000414159818 191462301 /nfs/dbraw/zinc/46/23/01/191462301.db2.gz YTEIEWYEWOYAJE-TYNCELHUSA-N 2 0 236.403 2.495 20 0 BEADRP CC[NH+](CC)CCOCC[NH2+][C@@H](C)C1(C)CC1 ZINC000349696692 355413115 /nfs/dbraw/zinc/41/31/15/355413115.db2.gz VIHZSSDHUXUHQV-ZDUSSCGKSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)C[N@H+](C)CCC[NH2+][C@H]1CS[C@H](C)C1 ZINC000639290059 355444248 /nfs/dbraw/zinc/44/42/48/355444248.db2.gz PTSRBDLLOLSHAA-CHWSQXEVSA-N 2 0 244.448 2.448 20 0 BEADRP C[C@H]([NH3+])c1ccc(NC[C@@H]2CCC[NH2+]C2)cc1 ZINC000414813271 191579356 /nfs/dbraw/zinc/57/93/56/191579356.db2.gz QOYMVGFDBNHJPH-NWDGAFQWSA-N 2 0 233.359 2.118 20 0 BEADRP Clc1cccc(C[NH2+]CC[C@H]2CC[NH2+]C2)c1 ZINC000414825615 191587860 /nfs/dbraw/zinc/58/78/60/191587860.db2.gz CQSCJZMQWGZSLZ-LLVKDONJSA-N 2 0 238.762 2.429 20 0 BEADRP COC[C@@H](CC(C)C)[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000414841449 191597454 /nfs/dbraw/zinc/59/74/54/191597454.db2.gz OIHZDIYRIJTBBL-ZIAGYGMSSA-N 2 0 242.407 2.027 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000414844971 191597936 /nfs/dbraw/zinc/59/79/36/191597936.db2.gz RZPFZROTQMQALF-AAEUAGOBSA-N 2 0 210.365 2.154 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H](C[NH2+]Cc2cccc(F)c2)C1 ZINC000414990754 191643258 /nfs/dbraw/zinc/64/32/58/191643258.db2.gz JBAUHSSHERZZGJ-TZMCWYRMSA-N 2 0 236.334 2.433 20 0 BEADRP Cc1ccccc1C[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000415010664 191649568 /nfs/dbraw/zinc/64/95/68/191649568.db2.gz PQYMTWAWGTYXRK-JKSUJKDBSA-N 2 0 244.382 2.473 20 0 BEADRP COc1cc(C[NH2+][C@@H]2CC[C@@H](C[NH3+])C2)ccc1C ZINC000415049147 191653226 /nfs/dbraw/zinc/65/32/26/191653226.db2.gz XKCIKCZKMAMSCW-TZMCWYRMSA-N 2 0 248.370 2.221 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@H]2CC[C@@H](C[NH3+])C2)C1 ZINC000415051379 191653635 /nfs/dbraw/zinc/65/36/35/191653635.db2.gz ZIOSAHUNHQNMHS-NDBYEHHHSA-N 2 0 210.365 2.282 20 0 BEADRP COCc1cccc(C[NH2+][C@H]2CC[C@H](C[NH3+])C2)c1 ZINC000415029192 191656113 /nfs/dbraw/zinc/65/61/13/191656113.db2.gz DNEQTNBYIJWJNI-WFASDCNBSA-N 2 0 248.370 2.050 20 0 BEADRP C[NH2+]Cc1cccc(NC[C@@H]2CC[NH2+][C@H](C)C2)c1 ZINC000414874713 191611031 /nfs/dbraw/zinc/61/10/31/191611031.db2.gz YYFINYGUDQCIHT-TZMCWYRMSA-N 2 0 247.386 2.206 20 0 BEADRP [NH3+][C@@H](C[NH2+]CCC1CCCCC1)C1CC1 ZINC000414887838 191615654 /nfs/dbraw/zinc/61/56/54/191615654.db2.gz JBKOWEAJMOPBSA-ZDUSSCGKSA-N 2 0 210.365 2.284 20 0 BEADRP Cc1ccccc1C[NH2+]C[C@H]1CC[NH2+][C@H](C)C1 ZINC000415092652 191676747 /nfs/dbraw/zinc/67/67/47/191676747.db2.gz UBSUUXITIAXNLK-KGLIPLIRSA-N 2 0 232.371 2.473 20 0 BEADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@@H]2CCC[C@H]2C2CC2)C1 ZINC000415046372 191662607 /nfs/dbraw/zinc/66/26/07/191662607.db2.gz VCNCHVZLOGMRCL-VZZFWQQMSA-N 2 0 222.376 2.282 20 0 BEADRP CCc1ccccc1C[N@@H+]1C[C@@H](C[NH3+])C[C@@H]1C ZINC000215989554 355640789 /nfs/dbraw/zinc/64/07/89/355640789.db2.gz DVDAHRXMHABHPY-QWHCGFSZSA-N 2 0 232.371 2.418 20 0 BEADRP CCOc1ccccc1C[N@@H+]1C[C@@H](C[NH3+])C[C@@H]1C ZINC000215969101 355644166 /nfs/dbraw/zinc/64/41/66/355644166.db2.gz GWXAQLAIUSSMOU-QWHCGFSZSA-N 2 0 248.370 2.254 20 0 BEADRP C[NH+](C)CC1CC[NH+](Cc2ccco2)CC1 ZINC000350221687 355650774 /nfs/dbraw/zinc/65/07/74/355650774.db2.gz OYWFAILSIWXETO-UHFFFAOYSA-N 2 0 222.332 2.053 20 0 BEADRP CCC[C@H](C[NH2+]C[C@H]1CCN1C(C)(C)C)OC ZINC000639303219 355653063 /nfs/dbraw/zinc/65/30/63/355653063.db2.gz NYECCODFQCPNOW-CHWSQXEVSA-N 2 0 242.407 2.264 20 0 BEADRP CC(C)CC[C@](C)(O)C[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000583575714 355657480 /nfs/dbraw/zinc/65/74/80/355657480.db2.gz PYKWVNHSQQSGLX-IHRRRGAJSA-N 2 0 242.407 2.033 20 0 BEADRP CCCC[N@@H+]1CC[C@@H](OCC[NH+](CC)CC)C1 ZINC000350179932 355621466 /nfs/dbraw/zinc/62/14/66/355621466.db2.gz AXCLGKOCVDKULZ-CQSZACIVSA-N 2 0 242.407 2.219 20 0 BEADRP CCCN1CCC[C@@H]1C[NH2+][C@H](C)[C@H]1CCCO1 ZINC000353971150 355676073 /nfs/dbraw/zinc/67/60/73/355676073.db2.gz IJRHYADKCQAJFC-MGPQQGTHSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@H]2CCCC[N@H+](C)C2)CS1 ZINC000639346601 355793371 /nfs/dbraw/zinc/79/33/71/355793371.db2.gz HMKUZJWSOYHEFS-UPJWGTAASA-N 2 0 242.432 2.202 20 0 BEADRP CS[C@@H]1CC[C@@H]1[NH2+]CCC1CC[NH+](C)CC1 ZINC000425361168 191825075 /nfs/dbraw/zinc/82/50/75/191825075.db2.gz TVBSXPPUCVKOFQ-QWHCGFSZSA-N 2 0 242.432 2.202 20 0 BEADRP CS[C@@H]1CC[C@@H]1[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC000425372836 191826155 /nfs/dbraw/zinc/82/61/55/191826155.db2.gz UFLLNTWOFWNUBK-RWMBFGLXSA-N 2 0 242.432 2.202 20 0 BEADRP Cc1ccc(C[N@H+]2C[C@@H](C[NH3+])C[C@@H]2C)c(C)c1 ZINC000216042880 355802439 /nfs/dbraw/zinc/80/24/39/355802439.db2.gz GZXLNDPIBQVYBH-UONOGXRCSA-N 2 0 232.371 2.473 20 0 BEADRP CCN1CCC([NH2+]C2(C3CC3)CC2)CC1 ZINC000309064263 355989369 /nfs/dbraw/zinc/98/93/69/355989369.db2.gz YKJZLRMEMNQBGL-UHFFFAOYSA-N 2 0 208.349 2.003 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH+](C)CCCCF)[C@H](C)C1 ZINC000351866489 356102312 /nfs/dbraw/zinc/10/23/12/356102312.db2.gz XDHSWVOCAXCIEJ-OLZOCXBDSA-N 2 0 230.371 2.398 20 0 BEADRP CC[N@H+](CC[C@H]1CCCO1)[C@@H]1CCC[NH2+]CC1 ZINC000420300996 192207355 /nfs/dbraw/zinc/20/73/55/192207355.db2.gz ABEHWVCBGQZIDF-ZIAGYGMSSA-N 2 0 240.391 2.020 20 0 BEADRP COCCC1(C[NH2+][C@@H](C)CCC[NH3+])CCCC1 ZINC000422891917 192499220 /nfs/dbraw/zinc/49/92/20/192499220.db2.gz WVKSYJCNSBTNER-ZDUSSCGKSA-N 2 0 242.407 2.300 20 0 BEADRP C[NH2+]C[C@H]1CC[N@H+](CCCc2ccsc2)C1 ZINC000420302787 192206766 /nfs/dbraw/zinc/20/67/66/192206766.db2.gz WVEVTPGXMXLTAI-CYBMUJFWSA-N 2 0 238.400 2.222 20 0 BEADRP CCc1cccc(C[N@@H+]2CC[C@@H]([C@H](C)[NH3+])C2)c1 ZINC000420302425 192206234 /nfs/dbraw/zinc/20/62/34/192206234.db2.gz GAXPOEPHCSXRPQ-SWLSCSKDSA-N 2 0 232.371 2.418 20 0 BEADRP C[C@@]1(C[NH3+])CC[N@H+](CCCCC(F)(F)F)C1 ZINC000420319183 192195453 /nfs/dbraw/zinc/19/54/53/192195453.db2.gz RHGGLRLDZHEGDK-JTQLQIEISA-N 2 0 238.297 2.390 20 0 BEADRP FCCCCC[N@@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1 ZINC000420320280 192196071 /nfs/dbraw/zinc/19/60/71/192196071.db2.gz BCVRBFWKCCPIBQ-KBPBESRZSA-N 2 0 242.382 2.448 20 0 BEADRP FCCCCC[N@@H+]1CCC[C@@H]([C@@H]2CC[NH2+]C2)C1 ZINC000420320287 192196239 /nfs/dbraw/zinc/19/62/39/192196239.db2.gz BCVRBFWKCCPIBQ-ZIAGYGMSSA-N 2 0 242.382 2.448 20 0 BEADRP [NH3+]CC[C@H]1CCC[N@H+](CC[C@H]2CCCCO2)C1 ZINC000420321221 192199488 /nfs/dbraw/zinc/19/94/88/192199488.db2.gz ZSZYPPZYGPUWIU-ZIAGYGMSSA-N 2 0 240.391 2.006 20 0 BEADRP CC(C)[C@@H]([NH3+])CC[N@H+](C)CC[C@H]1CCCCO1 ZINC000420289680 192200730 /nfs/dbraw/zinc/20/07/30/192200730.db2.gz KSOJGSFBBMKUJV-KGLIPLIRSA-N 2 0 242.407 2.251 20 0 BEADRP CCOc1cccc(C[NH2+][C@@H](C)C[C@H](C)[NH3+])c1 ZINC000422882723 192497483 /nfs/dbraw/zinc/49/74/83/192497483.db2.gz SUUZKDWFRSFKIK-RYUDHWBXSA-N 2 0 236.359 2.301 20 0 BEADRP C[C@@H]([NH3+])[C@@H]1CC[N@H+](CCCc2ccsc2)C1 ZINC000420317251 192213081 /nfs/dbraw/zinc/21/30/81/192213081.db2.gz ZDCHSSBBTFFCLY-DGCLKSJQSA-N 2 0 238.400 2.350 20 0 BEADRP C[N@H+](CC[C@H]1CCCCO1)[C@@H]1CCC[NH2+]CC1 ZINC000420318415 192213768 /nfs/dbraw/zinc/21/37/68/192213768.db2.gz WBEQBIYRLQOHTG-ZIAGYGMSSA-N 2 0 240.391 2.020 20 0 BEADRP COc1ccccc1[C@H](C)[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000420371679 192214158 /nfs/dbraw/zinc/21/41/58/192214158.db2.gz KWQVAWZESSFEDQ-STQMWFEESA-N 2 0 248.370 2.345 20 0 BEADRP C[C@@H]1CCCC[C@@H]1OCC[N@H+](C)C1CC([NH3+])C1 ZINC000420331890 192214249 /nfs/dbraw/zinc/21/42/49/192214249.db2.gz MSHPCCSPRHOZGO-RYSNWHEDSA-N 2 0 240.391 2.003 20 0 BEADRP CO[C@@H](C)C[N@H+](CC[C@@H]1CCC[NH2+]C1)C(C)C ZINC000420307606 192208241 /nfs/dbraw/zinc/20/82/41/192208241.db2.gz RNVPFAFZGIYJSK-KBPBESRZSA-N 2 0 242.407 2.121 20 0 BEADRP [NH3+]CC[C@@H]1CCC[N@H+](CCCc2ccncc2)C1 ZINC000420305076 192209292 /nfs/dbraw/zinc/20/92/92/192209292.db2.gz FVSLCVWQSHQTTB-HNNXBMFYSA-N 2 0 247.386 2.075 20 0 BEADRP COc1ccc([C@H](C[NH3+])C[N@@H+]2CCC[C@H]2C)cc1 ZINC000420306613 192209600 /nfs/dbraw/zinc/20/96/00/192209600.db2.gz QNBBTOONRRNWPM-TZMCWYRMSA-N 2 0 248.370 2.222 20 0 BEADRP Cc1ccc(C[N@H+](C)CC[C@@H]2CC[NH2+]C2)s1 ZINC000420312850 192210194 /nfs/dbraw/zinc/21/01/94/192210194.db2.gz XKDGAOUKZCQLLB-LBPRGKRZSA-N 2 0 238.400 2.488 20 0 BEADRP CC[C@]1(C)CCC[N@H+](CC[C@@H]2CC[NH2+]C2)C1 ZINC000420313590 192212104 /nfs/dbraw/zinc/21/21/04/192212104.db2.gz YDEUDSHVFBQQLP-UONOGXRCSA-N 2 0 224.392 2.498 20 0 BEADRP CC[C@@H]([NH2+]C[C@H]1CC[NH2+]C1)c1ccc(OC)cc1 ZINC000420366609 192226071 /nfs/dbraw/zinc/22/60/71/192226071.db2.gz GFZSNGSPCJDSDR-SWLSCSKDSA-N 2 0 248.370 2.345 20 0 BEADRP C[C@H]1CCCC[N@H+](CC[C@H]2CCC[NH2+]C2)C1 ZINC000420364051 192224551 /nfs/dbraw/zinc/22/45/51/192224551.db2.gz CLTBCXGPIAAXRB-UONOGXRCSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@H]1[C@@H]([NH3+])CC[N@@H+]1[C@@H]1CCCc2ccccc21 ZINC000420362927 192224580 /nfs/dbraw/zinc/22/45/80/192224580.db2.gz ZVFRRNKQNCACIM-TUKIKUTGSA-N 2 0 230.355 2.486 20 0 BEADRP CCC(C)(C)[C@H]1CCC[N@@H+]1CCC[NH2+]C ZINC000420363128 192224655 /nfs/dbraw/zinc/22/46/55/192224655.db2.gz BEVLNIVDFSKRQH-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP CCCC[NH+]1CCC([C@@H]2C[C@@H]([NH3+])CCO2)CC1 ZINC000420383138 192234996 /nfs/dbraw/zinc/23/49/96/192234996.db2.gz FEOWEDCDRSLDBO-KBPBESRZSA-N 2 0 240.391 2.005 20 0 BEADRP CC(C)[C@@H]([NH2+]C[C@@H](C)[NH3+])c1ccccc1 ZINC000420382891 192235484 /nfs/dbraw/zinc/23/54/84/192235484.db2.gz YYYQCQXHWOLZLA-DGCLKSJQSA-N 2 0 206.333 2.321 20 0 BEADRP C[NH2+]CCC[NH2+][C@H]1CCCC[C@@H]1C(C)C ZINC000420395541 192236457 /nfs/dbraw/zinc/23/64/57/192236457.db2.gz DMSQANOYWNOLPB-OLZOCXBDSA-N 2 0 212.381 2.400 20 0 BEADRP Cc1cc(C)c(C[N@@H+]2CCC[C@](C)(O)C2)c(C)n1 ZINC000639556289 356459283 /nfs/dbraw/zinc/45/92/83/356459283.db2.gz YJQMVZVZFAEDFO-HNNXBMFYSA-N 2 0 248.370 2.354 20 0 BEADRP [NH3+]C1CCC([NH2+][C@H]2CCC[C@H]2C2CC2)CC1 ZINC000336165708 134113156 /nfs/dbraw/zinc/11/31/56/134113156.db2.gz VGASIBRIFFOXQS-HOAMVYINSA-N 2 0 222.376 2.425 20 0 BEADRP C[C@@H]1Cc2ccccc2C[N@@H+]1CCn1ccnc1 ZINC000179463326 366259760 /nfs/dbraw/zinc/25/97/60/366259760.db2.gz KIOHBOCDAOSVJF-CYBMUJFWSA-N 2 0 241.338 2.330 20 0 BEADRP Cc1cc(C)c(C[N@@H+]2C[C@H](O)C(C)(C)C2)c(C)n1 ZINC000639618632 356536352 /nfs/dbraw/zinc/53/63/52/356536352.db2.gz QSHQNJJQPFMYDT-AWEZNQCLSA-N 2 0 248.370 2.210 20 0 BEADRP Cc1nccn1C[C@@H]1CCCC[N@H+]1C(C)C ZINC000336194072 134125348 /nfs/dbraw/zinc/12/53/48/134125348.db2.gz QYCMKNLDGYBLLZ-ZDUSSCGKSA-N 2 0 221.348 2.454 20 0 BEADRP CC[C@H]([NH2+][C@H](C)C1C[NH2+]C1)c1cccs1 ZINC000422935791 192510459 /nfs/dbraw/zinc/51/04/59/192510459.db2.gz DRJXLPKKLBUGNK-KOLCDFICSA-N 2 0 224.373 2.397 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@H](C)C[C@H]1CCCO1 ZINC000422899726 192513296 /nfs/dbraw/zinc/51/32/96/192513296.db2.gz IDURCOONUSERTA-JHJVBQTASA-N 2 0 228.380 2.051 20 0 BEADRP CC(C)CSCC[NH2+]C1CCC(C[NH3+])CC1 ZINC000423013500 192538865 /nfs/dbraw/zinc/53/88/65/192538865.db2.gz MZMSVEJQSAMIBN-UHFFFAOYSA-N 2 0 244.448 2.483 20 0 BEADRP CCc1cnccc1[C@H](C)[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000423019929 192541856 /nfs/dbraw/zinc/54/18/56/192541856.db2.gz XVYVBJLLAAZTNT-SRVKXCTJSA-N 2 0 235.375 2.420 20 0 BEADRP CCC[NH+]1CCN(c2cc[nH+]c(CC)c2)CC1 ZINC000450213466 202098268 /nfs/dbraw/zinc/09/82/68/202098268.db2.gz GFNUDKUWTIQHKN-UHFFFAOYSA-N 2 0 233.359 2.176 20 0 BEADRP CC[C@@H]([NH2+]CCC1(C)CC1)[C@@H]1CCC[NH2+]1 ZINC000423083221 192561869 /nfs/dbraw/zinc/56/18/69/192561869.db2.gz FQOPRNKHOGLDBN-NEPJUHHUSA-N 2 0 210.365 2.297 20 0 BEADRP CSC1(C[NH2+][C@H]2CCCCC[C@H]2[NH3+])CC1 ZINC000423085914 192562435 /nfs/dbraw/zinc/56/24/35/192562435.db2.gz KTDKKXNRJIVSAM-MNOVXSKESA-N 2 0 228.405 2.132 20 0 BEADRP CCc1cc(N2CC[NH+](CC3CC3)CC2)cc[nH+]1 ZINC000450264183 202115088 /nfs/dbraw/zinc/11/50/88/202115088.db2.gz FCEHKLFJNUWZBI-UHFFFAOYSA-N 2 0 245.370 2.176 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC000423096041 192566520 /nfs/dbraw/zinc/56/65/20/192566520.db2.gz NVADBMZYXOFBKB-IVZWLZJFSA-N 2 0 220.307 2.137 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@H](CO)CCC(C)(C)C ZINC000423098816 192567206 /nfs/dbraw/zinc/56/72/06/192567206.db2.gz SMSRWKNDEQBZCF-OLZOCXBDSA-N 2 0 244.423 2.281 20 0 BEADRP C[C@H]1C[C@H]1C[N@@H+]1CCC2(C1)CC[NH+](C)CC2 ZINC000639757073 356663621 /nfs/dbraw/zinc/66/36/21/356663621.db2.gz FANOKISXSYABJS-STQMWFEESA-N 2 0 222.376 2.060 20 0 BEADRP C[NH+]1CCC2(CC[N@H+](C[C@@H]3C[C@H]4C[C@H]4C3)C2)CC1 ZINC000639755851 356659091 /nfs/dbraw/zinc/65/90/91/356659091.db2.gz OTACTIKRPBOPCT-QDMKHBRRSA-N 2 0 248.414 2.450 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CC[C@@H](C)F ZINC000423140126 192583060 /nfs/dbraw/zinc/58/30/60/192583060.db2.gz XKMIXFZUIAEWPZ-NXEZZACHSA-N 2 0 239.338 2.247 20 0 BEADRP CC[C@H]1CC[C@H]([NH2+][C@H](C)C2C[NH2+]C2)CC1 ZINC000423137034 192583103 /nfs/dbraw/zinc/58/31/03/192583103.db2.gz VWNDXEFKXAORQQ-NQBHXWOUSA-N 2 0 210.365 2.153 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+]C1CC(C(C)(C)C)C1 ZINC000423140676 192584354 /nfs/dbraw/zinc/58/43/54/192584354.db2.gz ZCSGOHXCYLUTJK-CPCZMJQVSA-N 2 0 242.407 2.155 20 0 BEADRP C[C@@H]1C[C@H]([NH+]2CC(C)(C)OC(C)(C)C2)CC[NH2+]1 ZINC000226427739 538610962 /nfs/dbraw/zinc/61/09/62/538610962.db2.gz BHQXZLPBSKAQPN-VXGBXAGGSA-N 2 0 240.391 2.016 20 0 BEADRP CCOCCCC[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000166221716 538616180 /nfs/dbraw/zinc/61/61/80/538616180.db2.gz SFEZTFSMGHFBTK-ZIAGYGMSSA-N 2 0 240.391 2.020 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+][C@H]2CC2(C)C)CC1(C)C ZINC000623371749 356880766 /nfs/dbraw/zinc/88/07/66/356880766.db2.gz QASGQYUHENUMBV-MNOVXSKESA-N 2 0 210.365 2.247 20 0 BEADRP COCC1CCC([NH2+][C@@H](C)CCCC[NH3+])CC1 ZINC000423185521 192615492 /nfs/dbraw/zinc/61/54/92/192615492.db2.gz NUVGHADTPBVQDC-HSBZDZAISA-N 2 0 242.407 2.299 20 0 BEADRP CCC(C)(C)CC[N@@H+]1CC[C@](C)(C[NH3+])C1 ZINC000261545997 535350513 /nfs/dbraw/zinc/35/05/13/535350513.db2.gz KMKSIBKBLSXORL-CYBMUJFWSA-N 2 0 212.381 2.483 20 0 BEADRP CCC(C)(C)CC[N@@H+]1CC[C@H]([NH3+])[C@@H](C)C1 ZINC000261554484 535350525 /nfs/dbraw/zinc/35/05/25/535350525.db2.gz UGIBISMUQVEHSQ-RYUDHWBXSA-N 2 0 212.381 2.482 20 0 BEADRP CC(C)(C[NH2+][C@@H]1CCC[C@H]1C[NH3+])c1cccnc1 ZINC000423196497 192622828 /nfs/dbraw/zinc/62/28/28/192622828.db2.gz ZVVPLCTWUUERAA-GXTWGEPZSA-N 2 0 247.386 2.076 20 0 BEADRP CCC(C)(C)CC[N@@H+]1CC[C@H](C[NH2+]C)C1 ZINC000261548171 535351054 /nfs/dbraw/zinc/35/10/54/535351054.db2.gz NFKHWXDREUKDDK-GFCCVEGCSA-N 2 0 212.381 2.354 20 0 BEADRP C[C@H](CC(C)(C)C)[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000423238391 192646059 /nfs/dbraw/zinc/64/60/59/192646059.db2.gz ACZVINVNVPZTIO-VXGBXAGGSA-N 2 0 212.381 2.400 20 0 BEADRP CO[C@H](C[NH2+][C@@H]1CCC[C@@H]1[NH3+])C1CCCCC1 ZINC000665282854 491107841 /nfs/dbraw/zinc/10/78/41/491107841.db2.gz CVXHHSYHAKOWLD-BFHYXJOUSA-N 2 0 240.391 2.051 20 0 BEADRP Fc1cccc2c1CC[C@@H]2[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000423251999 192653389 /nfs/dbraw/zinc/65/33/89/192653389.db2.gz SSTBELKZTFEADS-NHYWBVRUSA-N 2 0 248.345 2.402 20 0 BEADRP CCC(C)(C)[N@H+](C)C[C@H]1CC[NH2+][C@H](C)C1 ZINC000261535051 535355077 /nfs/dbraw/zinc/35/50/77/535355077.db2.gz NPAIHMJSYRRMLS-NEPJUHHUSA-N 2 0 212.381 2.495 20 0 BEADRP Cc1ccnc([C@H](C)[NH2+][C@@H]2CCC[C@H]2C[NH3+])c1 ZINC000423265851 192659002 /nfs/dbraw/zinc/65/90/02/192659002.db2.gz DBUKNNMVMQHQOD-RWMBFGLXSA-N 2 0 233.359 2.168 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]C1CCC(CSC)CC1 ZINC000423271656 192664417 /nfs/dbraw/zinc/66/44/17/192664417.db2.gz JEPVDFGAFWMSSY-PNESKVBLSA-N 2 0 244.448 2.353 20 0 BEADRP CCN1CCC[C@H]1C[NH2+][C@H]1C[C@@H](C)O[C@@H](C)C1 ZINC000582706289 357375034 /nfs/dbraw/zinc/37/50/34/357375034.db2.gz RBVZRNSDDVFQJT-DGAVXFQQSA-N 2 0 240.391 2.016 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+]C[C@H](C)C[NH3+])CC2 ZINC000423297492 192687336 /nfs/dbraw/zinc/68/73/36/192687336.db2.gz KNBQADDCOZHGAK-BXUZGUMPSA-N 2 0 218.344 2.167 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]C1CC(C)(C)C1 ZINC000395193026 357417158 /nfs/dbraw/zinc/41/71/58/357417158.db2.gz ZCSATZOTOPTCNG-MDZLAQPJSA-N 2 0 224.392 2.493 20 0 BEADRP CCOC[C@@H]1CCC[C@@H]1[NH2+]CCC[NH2+]C(C)C ZINC000582899106 357424714 /nfs/dbraw/zinc/42/47/14/357424714.db2.gz YQPPILHVGODZGU-KBPBESRZSA-N 2 0 242.407 2.169 20 0 BEADRP Cc1ccnc([C@H](C)[NH2+]CC2CC[NH2+]CC2)c1 ZINC000583138273 357499533 /nfs/dbraw/zinc/49/95/33/357499533.db2.gz OENWKBANKMIBEE-LBPRGKRZSA-N 2 0 233.359 2.040 20 0 BEADRP CC[N@H+](C)C[C@@H]1CC[NH+](CC2(C)CC2)C1 ZINC000584386855 357480877 /nfs/dbraw/zinc/48/08/77/357480877.db2.gz FZZBCXDQRBYDAA-LBPRGKRZSA-N 2 0 210.365 2.060 20 0 BEADRP Cc1cc(C)c(C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)cn1 ZINC000396976190 357488056 /nfs/dbraw/zinc/48/80/56/357488056.db2.gz KIGTZSXIGROPKK-KGLIPLIRSA-N 2 0 233.359 2.058 20 0 BEADRP C[C@@H]([NH2+]CCOCC[NH+](C)C)C1CCCCC1 ZINC000231786898 357628886 /nfs/dbraw/zinc/62/88/86/357628886.db2.gz GLZHQKGKOSFRNR-CYBMUJFWSA-N 2 0 242.407 2.123 20 0 BEADRP CC[NH+](CC)CCC[N@@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC000191545763 357784796 /nfs/dbraw/zinc/78/47/96/357784796.db2.gz GGCUZXIREOCWQQ-OKILXGFUSA-N 2 0 224.392 2.450 20 0 BEADRP Cc1ccsc1C[N@H+]1CC[C@H]([C@@H](C)[NH3+])C1 ZINC000168519344 134225535 /nfs/dbraw/zinc/22/55/35/134225535.db2.gz PMGFEGCVGCHVNX-MNOVXSKESA-N 2 0 224.373 2.226 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+]CC(C)(C)C(C)C ZINC000234711697 357825941 /nfs/dbraw/zinc/82/59/41/357825941.db2.gz RNGNJAVMQUNZJL-GFCCVEGCSA-N 2 0 230.396 2.012 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+]C1CCCCCC1 ZINC000234709772 357826386 /nfs/dbraw/zinc/82/63/86/357826386.db2.gz PFYWXYJXMCJQFH-CYBMUJFWSA-N 2 0 228.380 2.053 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+][C@H]1CCc2ccccc21 ZINC000234703354 357826415 /nfs/dbraw/zinc/82/64/15/357826415.db2.gz NTEKBXWYHYLCMO-ZFWWWQNUSA-N 2 0 248.370 2.017 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+][C@@H]1CCc2ccccc21 ZINC000234808321 357831971 /nfs/dbraw/zinc/83/19/71/357831971.db2.gz NTEKBXWYHYLCMO-DZGCQCFKSA-N 2 0 248.370 2.017 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+][C@H](C)c1ccccc1 ZINC000234751371 357834236 /nfs/dbraw/zinc/83/42/36/357834236.db2.gz GKSCJGJMMBHNJM-TZMCWYRMSA-N 2 0 236.359 2.091 20 0 BEADRP C[C@@H](CCC1CC1)[NH2+]CC1CC[NH2+]CC1 ZINC000398110039 357842927 /nfs/dbraw/zinc/84/29/27/357842927.db2.gz WUQVUUBRHJOEHA-NSHDSACASA-N 2 0 210.365 2.154 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@H]([C@@H](C)[NH3+])C2)s1 ZINC000168501527 134224645 /nfs/dbraw/zinc/22/46/45/134224645.db2.gz ZFGHCPBRMVQXCP-MNOVXSKESA-N 2 0 224.373 2.226 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+]C[C@H]2CC2(C)C)CC1(C)C ZINC000623417045 357868728 /nfs/dbraw/zinc/86/87/28/357868728.db2.gz QKKMFYJFBRKAKS-VXGBXAGGSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@]1(C[NH3+])CC[N@H+](CCCc2ccccc2)C1 ZINC000235438507 357869412 /nfs/dbraw/zinc/86/94/12/357869412.db2.gz SHWVVQUCWWAYNM-HNNXBMFYSA-N 2 0 232.371 2.290 20 0 BEADRP CC(C)[N@@H+]1CC[C@H](C[NH2+][C@H](C)CC2CC2)C1 ZINC000229692405 491119248 /nfs/dbraw/zinc/11/92/48/491119248.db2.gz HRPADKIECJKYNH-TZMCWYRMSA-N 2 0 224.392 2.495 20 0 BEADRP Cc1ccsc1C[NH2+][C@H]1CCC[NH2+]CC1 ZINC000168771719 134247626 /nfs/dbraw/zinc/24/76/26/134247626.db2.gz UTVHXAAMPYIYDO-NSHDSACASA-N 2 0 224.373 2.288 20 0 BEADRP CC1(C)CCC[C@@H]1[NH2+][C@H]1CCC[NH2+]CC1 ZINC000168770248 134247642 /nfs/dbraw/zinc/24/76/42/134247642.db2.gz VQBZZFNQTVKSCA-RYUDHWBXSA-N 2 0 210.365 2.297 20 0 BEADRP Fc1ccc(C[NH2+][C@@H]2CCC[NH2+]CC2)cc1 ZINC000168701904 134246487 /nfs/dbraw/zinc/24/64/87/134246487.db2.gz VMVJRXIONGRXBH-CYBMUJFWSA-N 2 0 222.307 2.057 20 0 BEADRP Fc1cccc(C[NH2+][C@H]2CCC[NH2+]CC2)c1 ZINC000168715105 134246600 /nfs/dbraw/zinc/24/66/00/134246600.db2.gz DNTSNOHAWNHBGY-ZDUSSCGKSA-N 2 0 222.307 2.057 20 0 BEADRP C[NH+](C)CC(C)(C)C[NH2+]C(C1CC1)C1CC1 ZINC000037466508 358070555 /nfs/dbraw/zinc/07/05/55/358070555.db2.gz JWRHWJDNHAOHBS-UHFFFAOYSA-N 2 0 224.392 2.352 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]CC2CC2)c2ccccc21 ZINC000169232564 134249958 /nfs/dbraw/zinc/24/99/58/134249958.db2.gz MUEQIPSIOVLDGY-CHWSQXEVSA-N 2 0 202.301 2.131 20 0 BEADRP CS[C@@H](C)C[NH2+][C@H](C)C1CC[NH+](C)CC1 ZINC000090726322 363597148 /nfs/dbraw/zinc/59/71/48/363597148.db2.gz SGNCVLZVJYFPNS-WDEREUQCSA-N 2 0 230.421 2.058 20 0 BEADRP CC(C)C[C@@H]1C[C@H]1[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000583882366 358117199 /nfs/dbraw/zinc/11/71/99/358117199.db2.gz DLJQDDXYFLUMFU-YVECIDJPSA-N 2 0 210.365 2.281 20 0 BEADRP C[C@@H](C[NH2+][C@@H](C)Cc1cccs1)C[NH+](C)C ZINC000390372782 491122110 /nfs/dbraw/zinc/12/21/10/491122110.db2.gz WIAAKQJBKNOCTN-RYUDHWBXSA-N 2 0 240.416 2.466 20 0 BEADRP COc1cccc2c1CCC[C@H]2[NH2+]CC[C@H](C)[NH3+] ZINC000584834125 358196970 /nfs/dbraw/zinc/19/69/70/358196970.db2.gz ZNNRVPBQBVCWEP-SMDDNHRTSA-N 2 0 248.370 2.400 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000222907773 358216064 /nfs/dbraw/zinc/21/60/64/358216064.db2.gz JPLZWDBXRKWRSG-UPJWGTAASA-N 2 0 236.359 2.460 20 0 BEADRP CC[NH+]1CCC(C[NH2+]C[C@H]2CCSC2)CC1 ZINC000224405842 358233292 /nfs/dbraw/zinc/23/32/92/358233292.db2.gz MERFHNGRVOJQJQ-CYBMUJFWSA-N 2 0 242.432 2.061 20 0 BEADRP CCC(CC)[NH2+]CC1CC[NH+](CC)CC1 ZINC000044517500 358388652 /nfs/dbraw/zinc/38/86/52/358388652.db2.gz YCQOMJWGTRVJDA-UHFFFAOYSA-N 2 0 212.381 2.497 20 0 BEADRP CCC[C@@H](C)[NH2+]CC1CC[NH+](CC)CC1 ZINC000044517261 358388838 /nfs/dbraw/zinc/38/88/38/358388838.db2.gz KLZDWACVMQYVJR-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP CSCCC[N@@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000173786622 134277455 /nfs/dbraw/zinc/27/74/55/134277455.db2.gz DMLIDCUXROEJKB-ZDUSSCGKSA-N 2 0 242.432 2.157 20 0 BEADRP COC[C@@H](C)[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000131978343 358702740 /nfs/dbraw/zinc/70/27/40/358702740.db2.gz AIPPANKBBDAJKT-GFCCVEGCSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@@H](Cn1ccnc1)Nc1nc2ccccc2[nH]1 ZINC000049235883 358677109 /nfs/dbraw/zinc/67/71/09/358677109.db2.gz DLCBRPVYSAHKAP-JTQLQIEISA-N 2 0 241.298 2.260 20 0 BEADRP C[C@@H]1C[C@@H](C[NH3+])C[N@@H+]1CCCc1ccccc1 ZINC000131486606 358678523 /nfs/dbraw/zinc/67/85/23/358678523.db2.gz AOEROUQKYHJYKH-HIFRSBDPSA-N 2 0 232.371 2.288 20 0 BEADRP CC[NH+]1CCC([NH2+]CCCC(F)(F)F)CC1 ZINC000132348002 358719419 /nfs/dbraw/zinc/71/94/19/358719419.db2.gz WBGJVJAUYFIFKF-UHFFFAOYSA-N 2 0 238.297 2.403 20 0 BEADRP Cc1cc(F)ccc1C[NH2+][C@H]1CCN(C2CC2)C1 ZINC000050577703 358733241 /nfs/dbraw/zinc/73/32/41/358733241.db2.gz MFJYXHQTNZOVGK-AWEZNQCLSA-N 2 0 248.345 2.460 20 0 BEADRP FCCC[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000134870324 358809235 /nfs/dbraw/zinc/80/92/35/358809235.db2.gz VIKBEPBGGQMULS-JSGCOSHPSA-N 2 0 240.366 2.295 20 0 BEADRP C[NH+](C)CCC[NH2+]C[C@H]1CCOc2ccccc21 ZINC000135424963 358837694 /nfs/dbraw/zinc/83/76/94/358837694.db2.gz IEDRROSYTUTWGO-CYBMUJFWSA-N 2 0 248.370 2.094 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)C2CCCC2)C1 ZINC000054080426 358851243 /nfs/dbraw/zinc/85/12/43/358851243.db2.gz LZAIZORQRWKKMC-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1cccc(CC[NH2+]CC2CC[NH+](C)CC2)c1 ZINC000054243905 358857073 /nfs/dbraw/zinc/85/70/73/358857073.db2.gz QIDRKUKVJGQVIF-UHFFFAOYSA-N 2 0 246.398 2.469 20 0 BEADRP CCC[NH+]1CCC([NH2+]C[C@@H]2C[C@@H]2C)CC1 ZINC000132739568 491138159 /nfs/dbraw/zinc/13/81/59/491138159.db2.gz DEYKNBJYLDNMLT-RYUDHWBXSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@]12C[C@H]1CCC[C@H]2[NH2+]CC1=CC[NH2+]CC1 ZINC000423343965 192720656 /nfs/dbraw/zinc/72/06/56/192720656.db2.gz DVUUIXSUBZUJLI-MCIONIFRSA-N 2 0 220.360 2.074 20 0 BEADRP CC[C@@H]([NH2+]CC1=CC[NH2+]CC1)C1CCCC1 ZINC000423360514 192732052 /nfs/dbraw/zinc/73/20/52/192732052.db2.gz WBLZPDHZZQNFMA-CQSZACIVSA-N 2 0 222.376 2.465 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+]CC1CCSCC1 ZINC000308885915 491139683 /nfs/dbraw/zinc/13/96/83/491139683.db2.gz VWMJLKXBLKKHSW-LLVKDONJSA-N 2 0 230.421 2.059 20 0 BEADRP C[C@@H]1CCC[C@@H](C)C1[NH2+][C@H]1CC[NH2+]C[C@H]1C ZINC000423407838 192748278 /nfs/dbraw/zinc/74/82/78/192748278.db2.gz WKQCSZSYFLWSON-LPWJVIDDSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@H](C2CC2)C2CCC2)CC[NH2+]1 ZINC000423388159 192762085 /nfs/dbraw/zinc/76/20/85/192762085.db2.gz TZBXPDYGUAJKAP-SWHYSGLUSA-N 2 0 222.376 2.295 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+][C@@H]2CCCSC2)CC1(C)C ZINC000623439387 359332757 /nfs/dbraw/zinc/33/27/57/359332757.db2.gz GRPPWZBOXXFELC-VXGBXAGGSA-N 2 0 242.432 2.344 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+]C2(C3CC3)CC2)CC1(C)C ZINC000623449460 359342364 /nfs/dbraw/zinc/34/23/64/359342364.db2.gz WNRDDENAGARSIJ-GFCCVEGCSA-N 2 0 222.376 2.391 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)C1(C)CC1 ZINC000423442996 192772380 /nfs/dbraw/zinc/77/23/80/192772380.db2.gz PYXHBYQMJPGIGM-KGYLQXTDSA-N 2 0 222.376 2.153 20 0 BEADRP CC[C@@H]1C[C@@H](C)CC[C@H]1[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000423454106 192776178 /nfs/dbraw/zinc/77/61/78/192776178.db2.gz KJGQPUPLHRULNS-XADZXUCXSA-N 2 0 222.376 2.009 20 0 BEADRP CCN1CCC([NH2+][C@@H]2CCC[C@H](OC)C2)CC1 ZINC000223816914 491140601 /nfs/dbraw/zinc/14/06/01/491140601.db2.gz LBYXVLIOFXMVBU-KGLIPLIRSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@@H]([NH2+]CCC1=CC[NH2+]CC1)[C@H]1CC1(C)C ZINC000423535181 192807069 /nfs/dbraw/zinc/80/70/69/192807069.db2.gz CGJIYIMQIZBLCH-DGCLKSJQSA-N 2 0 222.376 2.320 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[C@@H](C[NH3+])C1)c1ccncc1 ZINC000423499669 192795337 /nfs/dbraw/zinc/79/53/37/192795337.db2.gz HZFMXWNYAFPQHM-BNOWGMLFSA-N 2 0 233.359 2.250 20 0 BEADRP C[C@@H]1C[C@@H](C[N@@H+]2CCS[C@H](C)CC2)CC[NH2+]1 ZINC000379545547 359541622 /nfs/dbraw/zinc/54/16/22/359541622.db2.gz YZESPCWETWGNNT-UPJWGTAASA-N 2 0 242.432 2.202 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]CC2=CCCCC2)C1 ZINC000379591795 359557476 /nfs/dbraw/zinc/55/74/76/359557476.db2.gz YCMNUBHVPOMYFX-CHWSQXEVSA-N 2 0 208.349 2.346 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]CC1=CCCCC1 ZINC000379586399 359560562 /nfs/dbraw/zinc/56/05/62/359560562.db2.gz JMEUAZXHBHJUEH-STQMWFEESA-N 2 0 208.349 2.204 20 0 BEADRP C[C@@H]1CSCC[N@H+](CC[C@H]2CCC[NH+]2C)C1 ZINC000249034018 359616122 /nfs/dbraw/zinc/61/61/22/359616122.db2.gz MHJLRLZVPMOKKX-QWHCGFSZSA-N 2 0 242.432 2.156 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+]CCCC[NH+](C)C ZINC000308997547 491142107 /nfs/dbraw/zinc/14/21/07/491142107.db2.gz MYZDZIOBEDCPER-STQMWFEESA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H](C[NH2+][C@@H](C)C1CC[NH+](C)CC1)C1CC1 ZINC000132958768 491143820 /nfs/dbraw/zinc/14/38/20/491143820.db2.gz QAGWRMDAEJLANU-NEPJUHHUSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000087646944 359922236 /nfs/dbraw/zinc/92/22/36/359922236.db2.gz LLZKBJNVLGPPPU-MGPQQGTHSA-N 2 0 224.392 2.402 20 0 BEADRP CC[C@@H](c1ccccc1)[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC000088249780 359942835 /nfs/dbraw/zinc/94/28/35/359942835.db2.gz BCXCOULHNIDEGW-ZNMIVQPWSA-N 2 0 230.355 2.289 20 0 BEADRP COc1cccc(C[NH2+][C@H]2CCCC[C@@H]2C[NH3+])c1 ZINC000089144603 359992545 /nfs/dbraw/zinc/99/25/45/359992545.db2.gz HGLJZYKPAIQEFO-HIFRSBDPSA-N 2 0 248.370 2.302 20 0 BEADRP CC(C)CCOCC[NH2+][C@@H]1CCCC[C@@H]1C[NH3+] ZINC000089145909 359993061 /nfs/dbraw/zinc/99/30/61/359993061.db2.gz RUVDUBCSPLZJKU-ZIAGYGMSSA-N 2 0 242.407 2.156 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]Cc1ccc(F)c(F)c1 ZINC000089150405 359993710 /nfs/dbraw/zinc/99/37/10/359993710.db2.gz VFKMFTFOCZBGEG-GXFFZTMASA-N 2 0 240.297 2.182 20 0 BEADRP COc1ccccc1C[N@H+](C)CC[C@H]1CC[NH2+]C1 ZINC000089749239 360037246 /nfs/dbraw/zinc/03/72/46/360037246.db2.gz LSWBSPSXKBVGFI-CYBMUJFWSA-N 2 0 248.370 2.127 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]Cc2ccc(F)cc2F)C1 ZINC000093215774 360223497 /nfs/dbraw/zinc/22/34/97/360223497.db2.gz PFPUWPSGCZAFKO-VXGBXAGGSA-N 2 0 240.297 2.324 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@@H]1CC(C)(C)OC1(C)C ZINC000094424254 360307307 /nfs/dbraw/zinc/30/73/07/360307307.db2.gz QDWPUGVKIYIYGX-GFCCVEGCSA-N 2 0 242.407 2.264 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CC[N@H+](C)C(C)(C)C2)CCO1 ZINC000623481309 360444006 /nfs/dbraw/zinc/44/40/06/360444006.db2.gz ZLLZYFCKQAVUSA-UPJWGTAASA-N 2 0 240.391 2.016 20 0 BEADRP C[C@@H]1C[C@H](C)[N@H+](C/C=C/Cl)C[C@@H]1C[NH3+] ZINC000306546858 360417760 /nfs/dbraw/zinc/41/77/60/360417760.db2.gz AQJLGTGIJXHSEB-QDVNPKLESA-N 2 0 216.756 2.044 20 0 BEADRP C[C@H](CC1CCC1)[NH2+]CC1=CC[N@H+](C)CC1 ZINC000309520312 491149870 /nfs/dbraw/zinc/14/98/70/491149870.db2.gz ZUZGMZOPDKTBHU-GFCCVEGCSA-N 2 0 222.376 2.417 20 0 BEADRP c1cn(CCC[NH2+][C@H]2CC[C@H]2C2CC2)cn1 ZINC000309577997 491152018 /nfs/dbraw/zinc/15/20/18/491152018.db2.gz RAAZKNKTMVYXAA-STQMWFEESA-N 2 0 219.332 2.051 20 0 BEADRP C[C@@]1(c2ccccc2)CC[C@H]([NH2+]CCC[NH3+])C1 ZINC000414759326 200761764 /nfs/dbraw/zinc/76/17/64/200761764.db2.gz ZXAXVPLEGXDSEA-LSDHHAIUSA-N 2 0 232.371 2.435 20 0 BEADRP CC[C@H](C)C[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000156086660 360947346 /nfs/dbraw/zinc/94/73/46/360947346.db2.gz YVGHZDKCZGZPLW-RWMBFGLXSA-N 2 0 210.365 2.249 20 0 BEADRP CN1CCC[C@H]([NH2+]C2CCC3(CC3)CC2)C1 ZINC000309634745 491153282 /nfs/dbraw/zinc/15/32/82/491153282.db2.gz JAGXMCFBMJDWJO-ZDUSSCGKSA-N 2 0 222.376 2.393 20 0 BEADRP C[C@@H](CC1CCC1)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000133406559 491153318 /nfs/dbraw/zinc/15/33/18/491153318.db2.gz HERDWVCQHCTQSK-GXTWGEPZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1C[NH+](CCC2CC[NH2+]CC2)C[C@H](C)S1 ZINC000069910109 361018195 /nfs/dbraw/zinc/01/81/95/361018195.db2.gz SNRBWXQYTPMIJT-RYUDHWBXSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+][C@H]1CC[C@@H](C)[C@H](C)C1 ZINC000629406526 361055051 /nfs/dbraw/zinc/05/50/51/361055051.db2.gz NIJYSLSFBKFDLE-NAWOPXAZSA-N 2 0 210.365 2.151 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+][C@@H]1CCCC(C)(C)C1 ZINC000629406516 361055177 /nfs/dbraw/zinc/05/51/77/361055177.db2.gz NGTSEZQKCRAKBU-QJPTWQEYSA-N 2 0 210.365 2.295 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1[NH2+][C@H]1CCCC[C@@H]1C ZINC000629390398 361037651 /nfs/dbraw/zinc/03/76/51/361037651.db2.gz DXGNJMGBZWWQMZ-ZDEQEGDKSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H](CC1CCCC1)[NH2+]CC1([NH3+])CCOCC1 ZINC000629387857 361040027 /nfs/dbraw/zinc/04/00/27/361040027.db2.gz LLCKFRWVGQYEDU-GFCCVEGCSA-N 2 0 240.391 2.053 20 0 BEADRP CC[C@@H](C)C[C@@H](CC)[NH2+]CC1([NH3+])CCOCC1 ZINC000629388035 361040167 /nfs/dbraw/zinc/04/01/67/361040167.db2.gz PXABDFBEGHTWBW-CHWSQXEVSA-N 2 0 242.407 2.299 20 0 BEADRP CC1(C)CCC[C@@H](C[NH2+]CCOCCC[NH3+])C1 ZINC000629399176 361047024 /nfs/dbraw/zinc/04/70/24/361047024.db2.gz NMTHMBWCWRVILJ-CYBMUJFWSA-N 2 0 242.407 2.158 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+][C@@H]1CC[C@@H](C)C[C@@H]1C ZINC000629407672 361057068 /nfs/dbraw/zinc/05/70/68/361057068.db2.gz HSSABVYBYMRZBP-KSSYENDESA-N 2 0 210.365 2.151 20 0 BEADRP C[C@H]1CC(C)(C)CC[C@@H]1[NH2+]CCOCCC[NH3+] ZINC000629399705 361050966 /nfs/dbraw/zinc/05/09/66/361050966.db2.gz KIKNPGKMOREXBF-STQMWFEESA-N 2 0 242.407 2.156 20 0 BEADRP CCCC[C@@H]1CCC[C@H]1[NH2+]CCOCCC[NH3+] ZINC000629400485 361051934 /nfs/dbraw/zinc/05/19/34/361051934.db2.gz ZECKBSXVMSPKHK-ZIAGYGMSSA-N 2 0 242.407 2.300 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H](c1cccnc1)C1CC1 ZINC000423017027 200855590 /nfs/dbraw/zinc/85/55/90/200855590.db2.gz VHSJCMDYMBKXNJ-BXUZGUMPSA-N 2 0 233.359 2.250 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+][C@H]1CC[C@@H](C)NC1 ZINC000629418400 361063275 /nfs/dbraw/zinc/06/32/75/361063275.db2.gz XTXSZKVBKTVICO-BBBLOLIVSA-N 2 0 238.297 2.448 20 0 BEADRP C[C@@H](CCC(F)(F)F)[NH2+][C@H]1CC[C@@H](C)NC1 ZINC000629418403 361063311 /nfs/dbraw/zinc/06/33/11/361063311.db2.gz XTXSZKVBKTVICO-UTLUCORTSA-N 2 0 238.297 2.448 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[NH2+]C12CCC2)C1CCCC1 ZINC000629521172 361117743 /nfs/dbraw/zinc/11/77/43/361117743.db2.gz RXKMVFQZIWZOOM-AAEUAGOBSA-N 2 0 222.376 2.439 20 0 BEADRP COc1cccc2c1C[N@H+](CC1CC[NH2+]CC1)C2 ZINC000629500506 361101277 /nfs/dbraw/zinc/10/12/77/361101277.db2.gz CWWOJHUXALNPBL-UHFFFAOYSA-N 2 0 246.354 2.010 20 0 BEADRP CCC[C@H](C)CCC[N@@H+]1CC[C@H](C[NH3+])C1 ZINC000629511421 361106212 /nfs/dbraw/zinc/10/62/12/361106212.db2.gz ILYMBJYWXVFXCP-QWHCGFSZSA-N 2 0 212.381 2.483 20 0 BEADRP Cc1ccc2ncc(CN(C)[C@H](C)C[NH3+])cc2c1 ZINC000629510423 361108361 /nfs/dbraw/zinc/10/83/61/361108361.db2.gz UAUMOJHPQOVGMU-GFCCVEGCSA-N 2 0 243.354 2.322 20 0 BEADRP Cc1nc(C(C)C)ccc1CN(C)CCC[NH3+] ZINC000629516210 361110430 /nfs/dbraw/zinc/11/04/30/361110430.db2.gz ZTNBQEMFEUOVTB-UHFFFAOYSA-N 2 0 235.375 2.294 20 0 BEADRP CC(C)=CCC[C@@H](C)[NH2+]CC1([NH3+])CCOCC1 ZINC000629520212 361114937 /nfs/dbraw/zinc/11/49/37/361114937.db2.gz DHUMZGBNJVLDKB-CYBMUJFWSA-N 2 0 240.391 2.219 20 0 BEADRP CC(C)[C@H]([NH2+]CC[C@@H]1CC[NH2+]C1)C1CC1 ZINC000578994883 366686849 /nfs/dbraw/zinc/68/68/49/366686849.db2.gz WHVSAMWTPKPILW-AAEUAGOBSA-N 2 0 210.365 2.010 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[NH2+][C@H]1CC)C1CCC1 ZINC000629528433 361137389 /nfs/dbraw/zinc/13/73/89/361137389.db2.gz ZCRYOPWXEOIPRD-RWMBFGLXSA-N 2 0 210.365 2.295 20 0 BEADRP C[NH2+]CCOCC[NH2+][C@H]1CCCC[C@H]1C(C)C ZINC000629529947 361146573 /nfs/dbraw/zinc/14/65/73/361146573.db2.gz REWXQNWXIHROGQ-KBPBESRZSA-N 2 0 242.407 2.027 20 0 BEADRP C1CC1C1([NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)CC1 ZINC000309697899 491154610 /nfs/dbraw/zinc/15/46/10/491154610.db2.gz RXSVCAUIELJUKA-OLZOCXBDSA-N 2 0 220.360 2.145 20 0 BEADRP CC[C@@H]([NH2+]CC1([NH3+])CCOCC1)c1ccccc1 ZINC000629523854 361121792 /nfs/dbraw/zinc/12/17/92/361121792.db2.gz JZXOSCMFRMOIJQ-CQSZACIVSA-N 2 0 248.370 2.235 20 0 BEADRP CC[C@H]1CCC[C@H]1[NH2+][C@@H]1CC[NH2+][C@H]1CC ZINC000629526280 361127767 /nfs/dbraw/zinc/12/77/67/361127767.db2.gz OTEGGOFFBJMZGW-WUHRBBMRSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H]1C[C@@]1(F)c1ccccc1 ZINC000424375324 200925110 /nfs/dbraw/zinc/92/51/10/200925110.db2.gz MUJJTVOLNUKRQD-KWCYVHTRSA-N 2 0 236.334 2.341 20 0 BEADRP Cc1nccn1CCC[N@@H+](C)[C@H](C)C1CC1 ZINC000579070214 366703304 /nfs/dbraw/zinc/70/33/04/366703304.db2.gz IPENVZMBPXVJOL-LLVKDONJSA-N 2 0 221.348 2.312 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CC1(F)F)[C@@H]1CCCC[NH2+]1 ZINC000622043659 370674458 /nfs/dbraw/zinc/67/44/58/370674458.db2.gz HFLQJAMDQSNUNR-AXFHLTTASA-N 2 0 232.318 2.152 20 0 BEADRP FC1(F)C[C@@H]1CC[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000622043719 370675526 /nfs/dbraw/zinc/67/55/26/370675526.db2.gz IQQINODSPYCCTB-NOOOWODRSA-N 2 0 244.329 2.009 20 0 BEADRP CC[C@H]([NH2+]CC[C@@H]1CC1(F)F)[C@@H]1CCC[NH2+]1 ZINC000622044111 370675533 /nfs/dbraw/zinc/67/55/33/370675533.db2.gz VINMLNFUTVYFHD-VWYCJHECSA-N 2 0 232.318 2.152 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CC1(F)F)[C@H]1CCCC[NH2+]1 ZINC000622043662 370675686 /nfs/dbraw/zinc/67/56/86/370675686.db2.gz HFLQJAMDQSNUNR-GMTAPVOTSA-N 2 0 232.318 2.152 20 0 BEADRP CO[C@@H](c1ccccc1)[C@@H](C)[NH2+]CC[C@H](C)[NH3+] ZINC000622044839 370676777 /nfs/dbraw/zinc/67/67/77/370676777.db2.gz UVNZJBCRKUMVQD-OUCADQQQSA-N 2 0 236.359 2.090 20 0 BEADRP CC1CC(C[NH2+][C@@H]2CCCCC[C@H]2[NH3+])C1 ZINC000622044645 370677554 /nfs/dbraw/zinc/67/75/54/370677554.db2.gz NWYKFPWCEPEVMC-FIYWTHMPSA-N 2 0 210.365 2.282 20 0 BEADRP CCCCO[C@H]1C[C@H]([NH2+]CC[C@H](C)[NH3+])C1(C)C ZINC000622045307 370679723 /nfs/dbraw/zinc/67/97/23/370679723.db2.gz LURWZBYMPMUOIV-AVGNSLFASA-N 2 0 242.407 2.297 20 0 BEADRP CC[C@@H]1C[C@@H](C)CC[C@@H]1[NH2+]CCOCCC[NH3+] ZINC000629537236 361401101 /nfs/dbraw/zinc/40/11/01/361401101.db2.gz JFIKCLDMTDVASS-MJBXVCDLSA-N 2 0 242.407 2.156 20 0 BEADRP C[C@@H]([NH2+]C[C@]1(C)C[C@H]2C[C@H]2C1)[C@H]1CCC[NH2+]1 ZINC000629538105 361402632 /nfs/dbraw/zinc/40/26/32/361402632.db2.gz NIAGFBHKFYABOT-RKQHYHRCSA-N 2 0 222.376 2.153 20 0 BEADRP CCC[C@@](C)([NH3+])C(=O)Nc1ccc([C@H](C)[NH3+])cc1 ZINC000429573221 201117903 /nfs/dbraw/zinc/11/79/03/201117903.db2.gz YFXOGACSBNCGFM-IINYFYTJSA-N 2 0 249.358 2.162 20 0 BEADRP C[C@H]([NH2+]CCOCCC[NH3+])C1CCCCCC1 ZINC000629540981 361414218 /nfs/dbraw/zinc/41/42/18/361414218.db2.gz WRDLDWWIQKUYLN-ZDUSSCGKSA-N 2 0 242.407 2.300 20 0 BEADRP CC[C@H]([NH2+]C1C[C@H](C)O[C@@H](C)C1)[C@@H]1CCC[NH2+]1 ZINC000579461668 366813028 /nfs/dbraw/zinc/81/30/28/366813028.db2.gz MZZRUXTVXZYNEH-IMIFBBOLSA-N 2 0 240.391 2.063 20 0 BEADRP CC[C@H]([NH2+]CCOCCC[NH3+])c1ccsc1 ZINC000629540778 361415715 /nfs/dbraw/zinc/41/57/15/361415715.db2.gz XNKBJTAAMUKLKF-LBPRGKRZSA-N 2 0 242.388 2.154 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1N[C@@H]1CCCc2ccc(O)cc21 ZINC000629546419 361427366 /nfs/dbraw/zinc/42/73/66/361427366.db2.gz PPMPXRAKWJFQDI-COLVAYQJSA-N 2 0 246.354 2.110 20 0 BEADRP C[C@@H]1C[N@@H+](CC[C@@H]2CC[NH2+]C2)C[C@H](C)C1(F)F ZINC000629554303 361439677 /nfs/dbraw/zinc/43/96/77/361439677.db2.gz ZINSNLOLPXMIFK-TUAOUCFPSA-N 2 0 246.345 2.209 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CCCC12CC2)[C@@H]1CCC[NH2+]1 ZINC000629554281 361439751 /nfs/dbraw/zinc/43/97/51/361439751.db2.gz HGYIPMFUXMZEAZ-UPJWGTAASA-N 2 0 222.376 2.297 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]C[C@H]2CCCC23CC3)C1 ZINC000629554433 361439769 /nfs/dbraw/zinc/43/97/69/361439769.db2.gz ITRBPWJYTSOFRO-UPJWGTAASA-N 2 0 222.376 2.426 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]C[C@@H]2CCCC23CC3)C1 ZINC000629554435 361440186 /nfs/dbraw/zinc/44/01/86/361440186.db2.gz ITRBPWJYTSOFRO-YNEHKIRRSA-N 2 0 222.376 2.426 20 0 BEADRP CO[C@H]1C[C@@H](C[NH2+][C@H]2C[C@@H]([NH3+])c3ccccc32)C1 ZINC000629555522 361447768 /nfs/dbraw/zinc/44/77/68/361447768.db2.gz WHUPMEWIDANCAV-BVIHXZOGSA-N 2 0 246.354 2.146 20 0 BEADRP C[C@H]1C[C@H]1C[N@@H+]1CCC[C@@H](C)[C@H]1CCC[NH3+] ZINC000629544041 361417655 /nfs/dbraw/zinc/41/76/55/361417655.db2.gz DAQVGCIEWFGFJB-ZOBORPQBSA-N 2 0 224.392 2.482 20 0 BEADRP C[NH2+]CCOCC[N@H+](C)CCC1CCCCC1 ZINC000629570288 361459439 /nfs/dbraw/zinc/45/94/39/361459439.db2.gz BRNXEHMKLUKURW-UHFFFAOYSA-N 2 0 242.407 2.125 20 0 BEADRP C[C@@H]1CCC[C@@H](CC[N@H+](C)CCOCC[NH3+])C1 ZINC000629576870 361467609 /nfs/dbraw/zinc/46/76/09/361467609.db2.gz DRTBLMQPXGDSLA-KGLIPLIRSA-N 2 0 242.407 2.110 20 0 BEADRP Cc1cccc(C[N@@H+]2C[C@@]3(C)C[NH2+]C[C@@]3(C)C2)c1 ZINC000629584858 361473938 /nfs/dbraw/zinc/47/39/38/361473938.db2.gz VZJUVPWAJPSJDZ-IYBDPMFKSA-N 2 0 244.382 2.426 20 0 BEADRP CCN(CC[NH3+])CCCc1c(F)cccc1F ZINC000629558222 361452975 /nfs/dbraw/zinc/45/29/75/361452975.db2.gz UBKOVWHWORQMCS-UHFFFAOYSA-N 2 0 242.313 2.178 20 0 BEADRP CC[C@H](C)[N@@H+]1CC[C@@H](C(F)(F)F)[C@H](C[NH3+])C1 ZINC000629562477 361456119 /nfs/dbraw/zinc/45/61/19/361456119.db2.gz NJTGPKHQWSSJMX-IVZWLZJFSA-N 2 0 238.297 2.244 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)C(C)(C)C ZINC000152459578 201199985 /nfs/dbraw/zinc/19/99/85/201199985.db2.gz VGHMXPUWMHNNPU-VXGBXAGGSA-N 2 0 224.392 2.495 20 0 BEADRP Cc1ccc(CCC[NH2+][C@H]2CC[C@@H](C)NC2)cn1 ZINC000629659774 361564197 /nfs/dbraw/zinc/56/41/97/361564197.db2.gz GTQPDJHTPKMLHH-HIFRSBDPSA-N 2 0 247.386 2.053 20 0 BEADRP C[C@H](N)C[N@@H+]1CCC[C@@H](C(C)(C)C)CC1 ZINC000163732654 361566017 /nfs/dbraw/zinc/56/60/17/361566017.db2.gz RRBBVQLKKYUXCM-NWDGAFQWSA-N 2 0 212.381 2.482 20 0 BEADRP C[C@H]1C[C@H](C[N@@H+]2CCCC(F)(F)CC2)CC[NH2+]1 ZINC000629652790 361551527 /nfs/dbraw/zinc/55/15/27/361551527.db2.gz BIOVLGAXYBWQNA-NWDGAFQWSA-N 2 0 246.345 2.496 20 0 BEADRP CC1(C[N@@H+]2C[C@@]3(C)C[NH2+]C[C@@]3(C)C2)CCC1 ZINC000629661479 361594867 /nfs/dbraw/zinc/59/48/67/361594867.db2.gz BJETUEGLORQACW-OKILXGFUSA-N 2 0 222.376 2.108 20 0 BEADRP [NH3+]C/C=C\c1ccc(C2=CC[NH2+]CC2)cc1 ZINC000629724152 361664499 /nfs/dbraw/zinc/66/44/99/361664499.db2.gz YTVTXBANCGJCRT-UPHRSURJSA-N 2 0 214.312 2.035 20 0 BEADRP [NH3+][C@H]1C[C@H](c2ccc(C3=CC[NH2+]CC3)cc2)C1 ZINC000629723490 361664574 /nfs/dbraw/zinc/66/45/74/361664574.db2.gz MTGNXXREOOEGSP-SHTZXODSSA-N 2 0 228.339 2.268 20 0 BEADRP CC[N@H+](CCCCCOC)[C@@H]1CCC[NH2+]CC1 ZINC000435612308 201280137 /nfs/dbraw/zinc/28/01/37/201280137.db2.gz FMQIEEOGWYDWAB-CQSZACIVSA-N 2 0 242.407 2.267 20 0 BEADRP C[NH2+]CCC[N@@H+](Cc1cccc(O)c1)CC1CC1 ZINC000435871035 201289970 /nfs/dbraw/zinc/28/99/70/201289970.db2.gz IRUIXMHUCQNRFA-UHFFFAOYSA-N 2 0 248.370 2.214 20 0 BEADRP C[NH2+]CC1(c2ccc(C3=CC[NH2+]CC3)cc2)CC1 ZINC000629722503 361662315 /nfs/dbraw/zinc/66/23/15/361662315.db2.gz BCKXGLSVECEKCQ-UHFFFAOYSA-N 2 0 242.366 2.314 20 0 BEADRP CC[N@H+](CCC[NH2+]C)[C@@H](C)c1cccc(O)c1 ZINC000435875127 201292528 /nfs/dbraw/zinc/29/25/28/201292528.db2.gz QHHAFXQWMJRIGO-LBPRGKRZSA-N 2 0 236.359 2.385 20 0 BEADRP [NH3+]C1CC[NH+](Cc2ccc3c(c2)CCC3)CC1 ZINC000071029476 181345316 /nfs/dbraw/zinc/34/53/16/181345316.db2.gz XDRVYPUAOKIURV-UHFFFAOYSA-N 2 0 230.355 2.098 20 0 BEADRP C[C@H](CCc1ccc(F)cc1)[NH2+]CCC[NH3+] ZINC000437767718 201372236 /nfs/dbraw/zinc/37/22/36/201372236.db2.gz AXUWZYVOHDCIOC-LLVKDONJSA-N 2 0 224.323 2.085 20 0 BEADRP [NH3+]CCC[NH2+][C@H]1CCC[C@H]1Cc1ccccc1 ZINC000437771097 201372965 /nfs/dbraw/zinc/37/29/65/201372965.db2.gz GSVFCTLJGAUSLQ-GJZGRUSLSA-N 2 0 232.371 2.336 20 0 BEADRP [NH3+]CC1CCC([NH2+]Cc2ccccc2)CC1 ZINC000148032466 181363798 /nfs/dbraw/zinc/36/37/98/181363798.db2.gz NYVPCFPEJPFZSJ-UHFFFAOYSA-N 2 0 218.344 2.294 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH+](C)CC2(C)CC2)[C@@H](C)C1 ZINC000573633585 364880094 /nfs/dbraw/zinc/88/00/94/364880094.db2.gz HDMHDWVVFURXKB-STQMWFEESA-N 2 0 224.392 2.449 20 0 BEADRP COC1CCC(C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)CC1 ZINC000573696558 364896958 /nfs/dbraw/zinc/89/69/58/364896958.db2.gz JVQFQZAPCNVPAG-DKNRTOFZSA-N 2 0 240.391 2.051 20 0 BEADRP [NH3+]CCCC[N@@H+]1CCC[C@@H]2CCCC[C@@H]21 ZINC000036826507 181376305 /nfs/dbraw/zinc/37/63/05/181376305.db2.gz WRNWAXPGEMRLNZ-STQMWFEESA-N 2 0 210.365 2.380 20 0 BEADRP [NH3+]CCC[N@@H+](Cc1cccnc1)CC1CCCC1 ZINC000352504614 181379500 /nfs/dbraw/zinc/37/95/00/181379500.db2.gz SGAGOKXCLDYJSS-UHFFFAOYSA-N 2 0 247.386 2.423 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]Cc1cc(C)sc1C ZINC000574174958 365004145 /nfs/dbraw/zinc/00/41/45/365004145.db2.gz HLGPKXBLLWOILL-SECBINFHSA-N 2 0 226.389 2.310 20 0 BEADRP C[C@@H]1C[N@@H+](CCCn2ccnc2)C[C@H](C)S1 ZINC000574227500 365015135 /nfs/dbraw/zinc/01/51/35/365015135.db2.gz VJAHQFNWLQRMPG-TXEJJXNPSA-N 2 0 239.388 2.099 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@H]1CCC12CCOCC2 ZINC000574392336 365047306 /nfs/dbraw/zinc/04/73/06/365047306.db2.gz OZBKNFLIMQXBFR-STQMWFEESA-N 2 0 240.391 2.053 20 0 BEADRP C[C@@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1ccoc1 ZINC000574269159 365023836 /nfs/dbraw/zinc/02/38/36/365023836.db2.gz LBQXRGUQMFZJHX-DGCLKSJQSA-N 2 0 222.332 2.462 20 0 BEADRP CC(C)[NH2+]CCC(=O)Nc1ccc([C@H](C)[NH3+])cc1 ZINC000574548553 365087896 /nfs/dbraw/zinc/08/78/96/365087896.db2.gz IOCJEOJRLPHYIZ-NSHDSACASA-N 2 0 249.358 2.033 20 0 BEADRP c1c2cccnc2oc1C[NH2+]CCCN1CCC1 ZINC000574651518 365114479 /nfs/dbraw/zinc/11/44/79/365114479.db2.gz QXSGFPZJJYGLDC-UHFFFAOYSA-N 2 0 245.326 2.013 20 0 BEADRP CC[NH+](CC)CCC[N@H+](C)CC1CCOCC1 ZINC000171829483 365245086 /nfs/dbraw/zinc/24/50/86/365245086.db2.gz ZROAKURTQUBJHQ-UHFFFAOYSA-N 2 0 242.407 2.077 20 0 BEADRP CC[NH+](CC)C[C@@H]1CC[N@H+](CC2(C)CC2)C1 ZINC000575427332 365317411 /nfs/dbraw/zinc/31/74/11/365317411.db2.gz IQDPYNZYZNYRBT-ZDUSSCGKSA-N 2 0 224.392 2.450 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H]1CCC[C@@H]2C[C@@]21C ZINC000575742107 365347984 /nfs/dbraw/zinc/34/79/84/365347984.db2.gz FGHQHFKGIVFTDE-UPJWGTAASA-N 2 0 210.365 2.154 20 0 BEADRP C[N@H+](CCC[NH3+])CCSCc1ccccc1 ZINC000575749386 365352451 /nfs/dbraw/zinc/35/24/51/365352451.db2.gz QXTSJGSIKMWPRS-UHFFFAOYSA-N 2 0 238.400 2.200 20 0 BEADRP C[N@@H+]1CCC[C@@H](CC[NH2+]C(C2CC2)C2CC2)C1 ZINC000579567401 366877590 /nfs/dbraw/zinc/87/75/90/366877590.db2.gz VULVWLOPXVMCPL-LBPRGKRZSA-N 2 0 236.403 2.497 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H]1C[C@@H](OC(C)C)C1(C)C ZINC000581065718 367249840 /nfs/dbraw/zinc/24/98/40/367249840.db2.gz HYJJQPGFLQAQPH-QWHCGFSZSA-N 2 0 242.407 2.168 20 0 BEADRP C[C@H](C[NH2+]CC1(C)CC1)C[NH+]1CCCCC1 ZINC000381332296 367382607 /nfs/dbraw/zinc/38/26/07/367382607.db2.gz UHFJIRPHGFBZPC-CYBMUJFWSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)NCc1noc2ccccc12 ZINC000581440235 367472473 /nfs/dbraw/zinc/47/24/73/367472473.db2.gz ZJAHTOHVSZWSQW-NXEZZACHSA-N 2 0 233.315 2.043 20 0 BEADRP C[C@H]([NH2+]CCC[NH2+]C1CC1)C1CCCC1 ZINC000382577155 367543421 /nfs/dbraw/zinc/54/34/21/367543421.db2.gz BEYCPGPRZVOEHM-NSHDSACASA-N 2 0 210.365 2.297 20 0 BEADRP C(C[NH2+][C@H](C1CC1)C1CCC1)C[NH2+]C1CC1 ZINC000382587102 367545153 /nfs/dbraw/zinc/54/51/53/367545153.db2.gz USTLPUKHTZPXSW-AWEZNQCLSA-N 2 0 222.376 2.297 20 0 BEADRP CC[C@@H]([NH2+][C@H](CCC[NH3+])COC)C1CCCC1 ZINC000382796446 367558195 /nfs/dbraw/zinc/55/81/95/367558195.db2.gz UXGGQJNOIUPTEN-ZIAGYGMSSA-N 2 0 242.407 2.299 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+]C[C@@H](C)C[NH+](C)C ZINC000382366850 367512645 /nfs/dbraw/zinc/51/26/45/367512645.db2.gz WQBGUGOUMOJDAY-UPJWGTAASA-N 2 0 212.381 2.352 20 0 BEADRP CCC[NH2+]CC[NH2+]C[C@@H]1CCC[C@H](C)C1 ZINC000383112718 367598456 /nfs/dbraw/zinc/59/84/56/367598456.db2.gz IDESIYQXLOEIHT-QWHCGFSZSA-N 2 0 212.381 2.402 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]CC1CC(F)(F)C1 ZINC000383149442 367601066 /nfs/dbraw/zinc/60/10/66/367601066.db2.gz ODGSBXOOELDCEW-JFGNBEQYSA-N 2 0 246.345 2.350 20 0 BEADRP CC[C@H]1[C@H](C)CCN1CC[NH2+]C(C)(C)C ZINC000384009025 367668011 /nfs/dbraw/zinc/66/80/11/367668011.db2.gz KAGFZARRBRTRCG-NEPJUHHUSA-N 2 0 212.381 2.495 20 0 BEADRP CC[C@@H]1[C@H](C)CC[N@@H+]1CC[C@@H]1CCC[NH2+]C1 ZINC000384027839 367669195 /nfs/dbraw/zinc/66/91/95/367669195.db2.gz ZECUUGQBEKPSEW-HZSPNIEDSA-N 2 0 224.392 2.497 20 0 BEADRP CCCCC[N@H+](C[C@@H](O)CN(C)CC)C(C)C ZINC000384049831 367669385 /nfs/dbraw/zinc/66/93/85/367669385.db2.gz WLXLNYDUXRPNOF-AWEZNQCLSA-N 2 0 244.423 2.200 20 0 BEADRP CC[C@@H]1[C@@H](C)CC[N@@H+]1CC[C@H]1CC[NH2+]C1 ZINC000384106624 367672357 /nfs/dbraw/zinc/67/23/57/367672357.db2.gz DRPMDANYDMCDFE-YNEHKIRRSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H](CC(C)(C)C)[NH2+]CC1CC[NH2+]CC1 ZINC000384533081 367697262 /nfs/dbraw/zinc/69/72/62/367697262.db2.gz MQROYJWGIUSVNX-LLVKDONJSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H](CC(C)(C)C)[NH2+]CCC[NH+](C)C ZINC000384801177 367734295 /nfs/dbraw/zinc/73/42/95/367734295.db2.gz SSSZRZXZIHDOBT-LLVKDONJSA-N 2 0 200.370 2.352 20 0 BEADRP C[N@H+](Cc1ccc(C2CC2)cc1)C1CC([NH3+])C1 ZINC000384828918 367739055 /nfs/dbraw/zinc/73/90/55/367739055.db2.gz GMZLDBBFTFQILM-UHFFFAOYSA-N 2 0 230.355 2.486 20 0 BEADRP Cc1cccc(C)c1C[N@@H+](C)C1CC([NH3+])C1 ZINC000384907918 367754645 /nfs/dbraw/zinc/75/46/45/367754645.db2.gz XZBFGMLUNLCGHG-UHFFFAOYSA-N 2 0 218.344 2.225 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H]2C[C@@H](C)O[C@@H]2C)CC1 ZINC000384940045 367761917 /nfs/dbraw/zinc/76/19/17/367761917.db2.gz QSJQFYDBEXNQBJ-YRGRVCCFSA-N 2 0 240.391 2.016 20 0 BEADRP CCCOc1cccc(C[N@H+](C)C2CC([NH3+])C2)c1 ZINC000385111526 367794602 /nfs/dbraw/zinc/79/46/02/367794602.db2.gz DBBSZKUHKNTFBO-UHFFFAOYSA-N 2 0 248.370 2.397 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)[C@H]1C ZINC000385668370 367853631 /nfs/dbraw/zinc/85/36/31/367853631.db2.gz PHYKOMFUNCNUIC-BVMMLCNSSA-N 2 0 222.376 2.246 20 0 BEADRP CSCC1CCC([NH2+][C@H](C)[C@@H](C)[NH3+])CC1 ZINC000385864423 367871136 /nfs/dbraw/zinc/87/11/36/367871136.db2.gz STCINPPKCRNPHI-QYNFOATHSA-N 2 0 230.421 2.234 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCC[C@@H]2C[NH3+])[C@@H]1C ZINC000385617904 367847014 /nfs/dbraw/zinc/84/70/14/367847014.db2.gz ICDWINKKKHJHTB-VEGXAWMVSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCC[C@@H]([NH3+])C2)[C@H]1C ZINC000386080299 367909844 /nfs/dbraw/zinc/90/98/44/367909844.db2.gz DACAMVMKCCNNGB-MLGHIDQZSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC[C@H]2CCC[NH2+]C2)[C@@H]1C ZINC000386171667 367922535 /nfs/dbraw/zinc/92/25/35/367922535.db2.gz YYLAHLUJDJLVRZ-LPWJVIDDSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CCCCO1)[C@H]1CCCC[NH2+]1 ZINC000385958788 367890067 /nfs/dbraw/zinc/89/00/67/367890067.db2.gz DZGDQUWOSNSQHS-MELADBBJSA-N 2 0 240.391 2.066 20 0 BEADRP C[C@H]([NH2+]CC1CCCC1)[C@@H]1CCCC[NH2+]1 ZINC000385984599 367892289 /nfs/dbraw/zinc/89/22/89/367892289.db2.gz DBWNCRRILBDTRG-AAEUAGOBSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]([NH2+]CC1CC(F)(F)C1)[C@@H]1CCCC[NH2+]1 ZINC000386010516 367897666 /nfs/dbraw/zinc/89/76/66/367897666.db2.gz MMGITVLBYFNUSV-ONGXEEELSA-N 2 0 232.318 2.152 20 0 BEADRP C[C@@H]1CC[C@@H](N[C@H]2CCCc3occc32)C[NH2+]1 ZINC000399283574 368066796 /nfs/dbraw/zinc/06/67/96/368066796.db2.gz YHSWKJUWRGSOCD-WZRBSPASSA-N 2 0 234.343 2.387 20 0 BEADRP C[NH+](C)CCCC(C)(C)[NH2+]C[C@@H]1CCSC1 ZINC000387301222 368145857 /nfs/dbraw/zinc/14/58/57/368145857.db2.gz JUYWBICAIALFSO-LBPRGKRZSA-N 2 0 244.448 2.450 20 0 BEADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@@H]2CCCc3occc32)C1 ZINC000331398498 181435766 /nfs/dbraw/zinc/43/57/66/181435766.db2.gz RXVMKPARQXBXLV-NQBHXWOUSA-N 2 0 234.343 2.374 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]CCc2ccccc2)C1 ZINC000086401893 368880352 /nfs/dbraw/zinc/88/03/52/368880352.db2.gz QISVAEBUPQPFHA-KGLIPLIRSA-N 2 0 218.344 2.089 20 0 BEADRP C[NH+](C)CCC[NH2+]Cc1ccnc2ccccc12 ZINC000113650159 368899184 /nfs/dbraw/zinc/89/91/84/368899184.db2.gz NEIJGRTVMLDJID-UHFFFAOYSA-N 2 0 243.354 2.276 20 0 BEADRP C[N@@H+]1CCCC[C@H](C[NH2+]CC2(C)CC2)C1 ZINC000623657113 368997214 /nfs/dbraw/zinc/99/72/14/368997214.db2.gz KASYQPNCMNYYIV-GFCCVEGCSA-N 2 0 210.365 2.108 20 0 BEADRP CCn1cccc1C[NH2+]C[C@@H]1CC[N@@H+](C(C)C)C1 ZINC000091025827 369003934 /nfs/dbraw/zinc/00/39/34/369003934.db2.gz NGTGRSDDOGIJQL-AWEZNQCLSA-N 2 0 249.402 2.328 20 0 BEADRP Cc1cc(C)c(C[N@H+]2CC[C@@H]([C@@H](C)[NH3+])C2)c(C)n1 ZINC000631824194 368987362 /nfs/dbraw/zinc/98/73/62/368987362.db2.gz YJQASIAHMPZSQK-TZMCWYRMSA-N 2 0 247.386 2.176 20 0 BEADRP C[N@@H+]1CCCC[C@@H](C[NH2+]C2CCSCC2)C1 ZINC000623655812 368991707 /nfs/dbraw/zinc/99/17/07/368991707.db2.gz GBLOMNPUHTVLAE-LBPRGKRZSA-N 2 0 242.432 2.204 20 0 BEADRP Cc1cc(C)c(CN2C[C@@H](C)[NH2+]C[C@@H]2C)c(C)n1 ZINC000631827501 368994240 /nfs/dbraw/zinc/99/42/40/368994240.db2.gz PLTCGBYRSYWGAG-OLZOCXBDSA-N 2 0 247.386 2.189 20 0 BEADRP Cc1cc(C)c(CN2C[C@@H](C)[NH2+]C[C@H]2C)c(C)n1 ZINC000631827500 368994279 /nfs/dbraw/zinc/99/42/79/368994279.db2.gz PLTCGBYRSYWGAG-CHWSQXEVSA-N 2 0 247.386 2.189 20 0 BEADRP CCc1ccc(C[N@H+]2C[C@@H](C[NH3+])[C@H](C)C2)cc1 ZINC000631837391 369094464 /nfs/dbraw/zinc/09/44/64/369094464.db2.gz RZXVYIYBLMLVIM-IUODEOHRSA-N 2 0 232.371 2.276 20 0 BEADRP C[C@@H]1C[N@H+](Cc2cc3ccccc3o2)C[C@H]1C[NH3+] ZINC000631838116 369116789 /nfs/dbraw/zinc/11/67/89/369116789.db2.gz JCFAJTAOGPHUTK-DGCLKSJQSA-N 2 0 244.338 2.459 20 0 BEADRP C[C@H]1C[N@H+](Cc2cc3ccccc3o2)C[C@H]1C[NH3+] ZINC000631838117 369116972 /nfs/dbraw/zinc/11/69/72/369116972.db2.gz JCFAJTAOGPHUTK-WCQYABFASA-N 2 0 244.338 2.459 20 0 BEADRP C[C@@H]1C[N@H+](CCCCC(F)(F)F)C[C@H]1C[NH3+] ZINC000631837994 369112744 /nfs/dbraw/zinc/11/27/44/369112744.db2.gz IDHNFSPAPASCQX-NXEZZACHSA-N 2 0 238.297 2.246 20 0 BEADRP Cc1cc(C[NH2+]C(C)(C)CCC[NH+](C)C)no1 ZINC000459560511 203300705 /nfs/dbraw/zinc/30/07/05/203300705.db2.gz AOQFSVOFTVHDEG-UHFFFAOYSA-N 2 0 239.363 2.193 20 0 BEADRP C[C@@H]1C[C@H]1C[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000459656184 203330274 /nfs/dbraw/zinc/33/02/74/203330274.db2.gz FXPLJWSRZDQASC-PWSUYJOCSA-N 2 0 215.300 2.080 20 0 BEADRP CC[C@H](C)C[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC000459723600 203341519 /nfs/dbraw/zinc/34/15/19/203341519.db2.gz AGPISJSQXYJKFF-STQMWFEESA-N 2 0 212.381 2.354 20 0 BEADRP Cc1ccoc1C[NH2+]CC[C@H]1CCC[N@@H+](C)C1 ZINC000459734144 203347370 /nfs/dbraw/zinc/34/73/70/203347370.db2.gz OFINLGIZZDWWAH-CYBMUJFWSA-N 2 0 236.359 2.410 20 0 BEADRP Cc1ccc(C[NH2+]CC[C@@H]2CCC[N@@H+](C)C2)nc1 ZINC000459735036 203347503 /nfs/dbraw/zinc/34/75/03/203347503.db2.gz PJKFPCHGSALLEW-AWEZNQCLSA-N 2 0 247.386 2.212 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC000459776117 203366182 /nfs/dbraw/zinc/36/61/82/203366182.db2.gz KCANJWWJJMKGRC-BFHYXJOUSA-N 2 0 224.392 2.497 20 0 BEADRP CCC[C@@H](C)[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC000459742362 203352274 /nfs/dbraw/zinc/35/22/74/203352274.db2.gz VVIVBYGCKLAKNH-CHWSQXEVSA-N 2 0 212.381 2.497 20 0 BEADRP CCC[C@H](C)[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC000459742365 203352640 /nfs/dbraw/zinc/35/26/40/203352640.db2.gz VVIVBYGCKLAKNH-STQMWFEESA-N 2 0 212.381 2.497 20 0 BEADRP CC(C)OC[C@H](C)[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC000459784000 203367572 /nfs/dbraw/zinc/36/75/72/203367572.db2.gz NSWPMSRNVOFYRG-UONOGXRCSA-N 2 0 242.407 2.121 20 0 BEADRP Cc1ccncc1C[NH2+]CC[C@H]1CCC[N@@H+](C)C1 ZINC000459787783 203369194 /nfs/dbraw/zinc/36/91/94/203369194.db2.gz PYZXKVVUTDDLQU-CQSZACIVSA-N 2 0 247.386 2.212 20 0 BEADRP C[C@@H]([NH2+]C[C@H](C1CC1)N(C)C)C1CCCC1 ZINC000166319576 203387486 /nfs/dbraw/zinc/38/74/86/203387486.db2.gz WZTGERVXOBRHLU-BXUZGUMPSA-N 2 0 224.392 2.495 20 0 BEADRP CC[C@H]([NH2+]C[C@H](C1CC1)N(C)C)C1CC1 ZINC000166324414 203388096 /nfs/dbraw/zinc/38/80/96/203388096.db2.gz CFKMIRVWOIUUAP-QWHCGFSZSA-N 2 0 210.365 2.105 20 0 BEADRP CCCc1ccc(C[N@H+]2C[C@H]3C[NH2+]C[C@H]3C2)cc1 ZINC000620278349 369794005 /nfs/dbraw/zinc/79/40/05/369794005.db2.gz NVKHDLAONOFRHR-IYBDPMFKSA-N 2 0 244.382 2.290 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]CC1CC[NH+](CC)CC1 ZINC000310024673 370290439 /nfs/dbraw/zinc/29/04/39/370290439.db2.gz OQTWQXYZJREBFX-KGLIPLIRSA-N 2 0 224.392 2.497 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CC2CC(C)C2)[C@H](C)C1 ZINC000621739716 370497166 /nfs/dbraw/zinc/49/71/66/370497166.db2.gz UHDXQWVWWIRZHZ-HHTDUIENSA-N 2 0 224.392 2.352 20 0 BEADRP Cc1cc(C[N@H+]2CCC[C@@H](C)[C@H]2CC[NH3+])ccn1 ZINC000621776326 370524588 /nfs/dbraw/zinc/52/45/88/370524588.db2.gz JCDVDBSOLBTJKP-IUODEOHRSA-N 2 0 247.386 2.339 20 0 BEADRP Cc1ccc(CC[N@@H+]2C[C@@H]3CCC[C@]3([NH3+])C2)cc1 ZINC000621782844 370532168 /nfs/dbraw/zinc/53/21/68/370532168.db2.gz TVGOQMRIPVEGAX-HOTGVXAUSA-N 2 0 244.382 2.351 20 0 BEADRP C[C@H]([NH2+]CC(C)(C)C[NH+](C)C)[C@@H]1CCCCO1 ZINC000623849204 371124186 /nfs/dbraw/zinc/12/41/86/371124186.db2.gz YWZXEZLSBUQCQM-STQMWFEESA-N 2 0 242.407 2.121 20 0 BEADRP Cc1nccn1CC[NH2+]Cc1ccc(C)cc1F ZINC000631056711 371180553 /nfs/dbraw/zinc/18/05/53/371180553.db2.gz NUESKIZHAMJBJO-UHFFFAOYSA-N 2 0 247.317 2.429 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]Cc2ccc(F)c(F)c2)C1 ZINC000093215566 181583409 /nfs/dbraw/zinc/58/34/09/181583409.db2.gz DHLPWEFTDVFWTA-MNOVXSKESA-N 2 0 240.297 2.324 20 0 BEADRP C[NH+](C)C1CCC([NH2+]Cc2ccns2)CC1 ZINC000624046910 371271339 /nfs/dbraw/zinc/27/13/39/371271339.db2.gz PUUSLWWAMNCFLX-UHFFFAOYSA-N 2 0 239.388 2.106 20 0 BEADRP CC1CC([NH2+]C[C@@H]2CCCC[N@H+](C)C2)C1 ZINC000624121671 371322639 /nfs/dbraw/zinc/32/26/39/371322639.db2.gz ARLKEHGZLFFORK-CPCZMJQVSA-N 2 0 210.365 2.106 20 0 BEADRP C[N@@H+]1CCCC[C@H](C[NH2+][C@H]2CCC2(C)C)C1 ZINC000624123393 371324271 /nfs/dbraw/zinc/32/42/71/371324271.db2.gz LCPHBRXYOJQBIG-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP COC(C)(C)[C@@H](C)[NH2+]C[C@@H]1CCCC[N@H+](C)C1 ZINC000624123196 371324594 /nfs/dbraw/zinc/32/45/94/371324594.db2.gz HSICNQFWVAIFLH-OLZOCXBDSA-N 2 0 242.407 2.121 20 0 BEADRP C/C=C\C[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000624197659 371386040 /nfs/dbraw/zinc/38/60/40/371386040.db2.gz SOCPGOPIOIANRU-WAYWQWQTSA-N 2 0 210.365 2.415 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1cn[nH]c1 ZINC000624211338 371398256 /nfs/dbraw/zinc/39/82/56/371398256.db2.gz YAOALRLUVFOWEH-GFCCVEGCSA-N 2 0 238.379 2.010 20 0 BEADRP CC[C@H](CSC)[NH2+][C@H](C)C1CC[NH+](C)CC1 ZINC000162359384 371663926 /nfs/dbraw/zinc/66/39/26/371663926.db2.gz GRSIQDAYYFSEFR-DGCLKSJQSA-N 2 0 244.448 2.448 20 0 BEADRP Cc1cc(C)c(C[NH2+][C@H](C)CC[NH3+])c(C)c1 ZINC000220497309 134305606 /nfs/dbraw/zinc/30/56/06/134305606.db2.gz AHQYOXCXKVQSKI-CYBMUJFWSA-N 2 0 220.360 2.439 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@@H]1CCCc2ncccc21 ZINC000631577457 372437362 /nfs/dbraw/zinc/43/73/62/372437362.db2.gz SJUDRONUEFVOOH-CQSZACIVSA-N 2 0 247.386 2.390 20 0 BEADRP Cc1cc(C)c(C[N@@H+]2CC[C@](C)(C[NH3+])C2)c(C)n1 ZINC000631825156 372603341 /nfs/dbraw/zinc/60/33/41/372603341.db2.gz APRJKFAUDNVIKA-OAHLLOKOSA-N 2 0 247.386 2.178 20 0 BEADRP Cc1cc(C)c(C[N@H+]2C[C@@H](C[NH3+])C[C@@H]2C)c(C)n1 ZINC000631822439 372598486 /nfs/dbraw/zinc/59/84/86/372598486.db2.gz DETYDOCUIBQAKA-GXTWGEPZSA-N 2 0 247.386 2.176 20 0 BEADRP C[C@@H]1C[N@@H+]([C@@H]2CCc3ccc(F)cc32)C[C@H]1C[NH3+] ZINC000631839210 372633478 /nfs/dbraw/zinc/63/34/78/372633478.db2.gz BXJCUHVVGDPCLF-IXPVHAAZSA-N 2 0 248.345 2.340 20 0 BEADRP CCc1ccccc1C[N@H+]1C[C@@H](C[NH3+])[C@H](C)C1 ZINC000631839060 372634456 /nfs/dbraw/zinc/63/44/56/372634456.db2.gz ZJCXDUNNDPNVOU-IUODEOHRSA-N 2 0 232.371 2.276 20 0 BEADRP C[C@@H]1C[N@H+](Cc2ccccc2Cl)C[C@H]1C[NH3+] ZINC000631844034 372643474 /nfs/dbraw/zinc/64/34/74/372643474.db2.gz DXBHQLGCDSWKSM-ZYHUDNBSSA-N 2 0 238.762 2.367 20 0 BEADRP COc1ccc(C)cc1C[N@@H+]1C[C@H](C)[C@H](C[NH3+])C1 ZINC000631844377 372643712 /nfs/dbraw/zinc/64/37/12/372643712.db2.gz WZUUEYUNOOBRKB-GXTWGEPZSA-N 2 0 248.370 2.030 20 0 BEADRP CC(C)=CCC[NH2+][C@]12CCC[C@@H]1C[NH2+]C2 ZINC000631867264 372669406 /nfs/dbraw/zinc/66/94/06/372669406.db2.gz OEJWEUUNFFJDDA-OLZOCXBDSA-N 2 0 208.349 2.074 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCC[C@@H]2C[NH2+]CC[C@H]21 ZINC000631887537 372673238 /nfs/dbraw/zinc/67/32/38/372673238.db2.gz NVKONUTZIAXXLH-YNEHKIRRSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H](C[N@H+](C)CCC[NH3+])C1CCCCC1 ZINC000379981674 373099070 /nfs/dbraw/zinc/09/90/70/373099070.db2.gz HSHLEADPMODECW-GFCCVEGCSA-N 2 0 212.381 2.483 20 0 BEADRP COC[C@H](CC(C)C)[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000414961084 205795212 /nfs/dbraw/zinc/79/52/12/205795212.db2.gz IHNFNNIUBIPRGO-KBPBESRZSA-N 2 0 242.407 2.169 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCCC[C@H]1[NH3+])[C@@H]1CC1(C)C ZINC000424369430 206040218 /nfs/dbraw/zinc/04/02/18/206040218.db2.gz BUNZTNPTDQRVSO-WRWGMCAJSA-N 2 0 210.365 2.281 20 0 BEADRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]C[C@@H]1C[C@H]1C1CCC1 ZINC000424382231 206040366 /nfs/dbraw/zinc/04/03/66/206040366.db2.gz RXIWRTXCSBYYOH-RFGFWPKPSA-N 2 0 222.376 2.140 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+][C@@H]1C[C@H]1C1CCC1 ZINC000424381317 206040392 /nfs/dbraw/zinc/04/03/92/206040392.db2.gz YJXAVLUQEQUKPS-XJFOESAGSA-N 2 0 222.376 2.282 20 0 BEADRP CCC[N@H+](CC)C[C@@H](C)Nc1cc[nH+]cc1C ZINC000357794708 169125051 /nfs/dbraw/zinc/12/50/51/169125051.db2.gz CRHLVRKPGDPNFD-CYBMUJFWSA-N 2 0 235.375 2.344 20 0 BEADRP Oc1ccc(C[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000106868643 183270049 /nfs/dbraw/zinc/27/00/49/183270049.db2.gz YBWMVOTYQJDMMG-UONOGXRCSA-N 2 0 246.354 2.109 20 0 BEADRP CCC[N@H+](CCC1CC[NH2+]CC1)C1CC1 ZINC000038076087 169153635 /nfs/dbraw/zinc/15/36/35/169153635.db2.gz QVDZUHNMUMBKDM-UHFFFAOYSA-N 2 0 210.365 2.251 20 0 BEADRP CCC[NH+]1CCC([NH2+]C[C@H]2CCC=CO2)CC1 ZINC000050267751 169188109 /nfs/dbraw/zinc/18/81/09/169188109.db2.gz LIWSWRMBLPIMIU-CQSZACIVSA-N 2 0 238.375 2.143 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H]2CC[C@H](F)C2)CC1 ZINC000336742727 169189259 /nfs/dbraw/zinc/18/92/59/169189259.db2.gz SHCXHPXTZVDVGW-AAEUAGOBSA-N 2 0 228.355 2.341 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H]2CC2(C)C)CC1 ZINC000045115428 169189375 /nfs/dbraw/zinc/18/93/75/169189375.db2.gz BAVGBLMOAITGRS-GFCCVEGCSA-N 2 0 210.365 2.249 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H]2CC2(C)C)CC1 ZINC000045115431 169190333 /nfs/dbraw/zinc/19/03/33/169190333.db2.gz BAVGBLMOAITGRS-LBPRGKRZSA-N 2 0 210.365 2.249 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccncc2C)C1 ZINC000296599210 169206892 /nfs/dbraw/zinc/20/68/92/169206892.db2.gz YGGQFNCROPDQOX-AWEZNQCLSA-N 2 0 247.386 2.212 20 0 BEADRP c1cc(C[N@H+]2C[C@H]3C[NH2+]C[C@H]3C2)cc(C2CC2)c1 ZINC000094522261 183348416 /nfs/dbraw/zinc/34/84/16/183348416.db2.gz JVXFIFBWPSWNAN-IYBDPMFKSA-N 2 0 242.366 2.215 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CC[C@H]2CC)C1 ZINC000336782973 169209133 /nfs/dbraw/zinc/20/91/33/169209133.db2.gz ZDIVGGNMCSDJIH-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H]2CC[C@@H]2CC)C1 ZINC000336782974 169209291 /nfs/dbraw/zinc/20/92/91/169209291.db2.gz ZDIVGGNMCSDJIH-RDBSUJKOSA-N 2 0 224.392 2.497 20 0 BEADRP c1cc(C[NH2+]CC[C@H]2CCC[NH2+]C2)cs1 ZINC000063147353 183350012 /nfs/dbraw/zinc/35/00/12/183350012.db2.gz UORRBEXCRHDENH-LLVKDONJSA-N 2 0 224.373 2.227 20 0 BEADRP c1cc2c(o1)CCC[C@@H]2[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000132035621 183372207 /nfs/dbraw/zinc/37/22/07/183372207.db2.gz YZQVWJPQYVNPHK-YPMHNXCESA-N 2 0 234.343 2.246 20 0 BEADRP c1cc2c(o1)CCC[C@H]2[NH2+][C@H]1CCC[NH2+]CC1 ZINC000128924982 183373801 /nfs/dbraw/zinc/37/38/01/183373801.db2.gz DIOABYGLEZNHLJ-WCQYABFASA-N 2 0 234.343 2.389 20 0 BEADRP CCCOc1cccc(C[N@@H+]2CC[C@H](C[NH3+])C2)c1 ZINC000052921813 169325093 /nfs/dbraw/zinc/32/50/93/169325093.db2.gz JNSAWJJWYGSGPY-CQSZACIVSA-N 2 0 248.370 2.256 20 0 BEADRP CCC[C@@H](C)C[NH2+]CC1=CC[N@H+](C)CC1 ZINC000309092799 169358702 /nfs/dbraw/zinc/35/87/02/169358702.db2.gz CTTZXXVJOXXKEJ-GFCCVEGCSA-N 2 0 210.365 2.274 20 0 BEADRP CCC[C@@H](C)C[N@@H+]1CC[C@@]2(CC[NH2+]C2)C1 ZINC000336717611 169359272 /nfs/dbraw/zinc/35/92/72/169359272.db2.gz YCMUJNBEBMDCNA-CHWSQXEVSA-N 2 0 210.365 2.108 20 0 BEADRP CCC[C@@H](C)C[N@@H+]1CC[C@]2(CC[NH2+]C2)C1 ZINC000336717614 169359455 /nfs/dbraw/zinc/35/94/55/169359455.db2.gz YCMUJNBEBMDCNA-OLZOCXBDSA-N 2 0 210.365 2.108 20 0 BEADRP CC[C@H](C)C[N@H+](C)CC[C@@H]1CCC[NH+]1C ZINC000179309658 134320370 /nfs/dbraw/zinc/32/03/70/134320370.db2.gz FYJRRRQXCOKMFO-STQMWFEESA-N 2 0 212.381 2.449 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CC2(C)C)CC[N@@H+]1C ZINC000222043112 134329256 /nfs/dbraw/zinc/32/92/56/134329256.db2.gz YHHRVYUEZBNPDP-WOPDTQHZSA-N 2 0 210.365 2.105 20 0 BEADRP CCN(C)CC[NH2+][C@@H]1C[C@@H](C)CC[C@@H]1C ZINC000222060431 134329456 /nfs/dbraw/zinc/32/94/56/134329456.db2.gz PERBTEJGTXYEST-RWMBFGLXSA-N 2 0 212.381 2.352 20 0 BEADRP CO[C@@H](C)C[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000182384393 134345105 /nfs/dbraw/zinc/34/51/05/134345105.db2.gz BGMXSJDGVIPULZ-ZDUSSCGKSA-N 2 0 242.407 2.075 20 0 BEADRP CCCC[NH+](CCCC)CC[C@@H]1C[NH2+]CCO1 ZINC000059955208 1172588344 /nfs/dbraw/zinc/58/83/44/1172588344.db2.gz CPFWVTQCXDZPHF-CQSZACIVSA-N 2 0 242.407 2.267 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](CCCC2CCCC2)C1 ZINC000226420546 134365505 /nfs/dbraw/zinc/36/55/05/134365505.db2.gz GTZAVXMUPXISKN-AWEZNQCLSA-N 2 0 224.392 2.498 20 0 BEADRP CC(C)[C@H]1C[C@@H]([NH2+][C@H](C)CC[NH+](C)C)CCO1 ZINC000226592997 134367740 /nfs/dbraw/zinc/36/77/40/134367740.db2.gz GDCZFBDZZJVULH-HZSPNIEDSA-N 2 0 242.407 2.120 20 0 BEADRP CC(C)[C@@H]1C[C@H]([NH2+][C@H](C)CC[NH+](C)C)CCO1 ZINC000227104461 134372968 /nfs/dbraw/zinc/37/29/68/134372968.db2.gz GDCZFBDZZJVULH-MCIONIFRSA-N 2 0 242.407 2.120 20 0 BEADRP CC[C@H](C)C[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000227329574 134378030 /nfs/dbraw/zinc/37/80/30/134378030.db2.gz VNRPLXBQALJWOD-LBPRGKRZSA-N 2 0 212.381 2.354 20 0 BEADRP CC1(C)CCC[N@H+](C[C@@H]2CCC[NH2+]C2)C1 ZINC000069793370 383845748 /nfs/dbraw/zinc/84/57/48/383845748.db2.gz JFSSCGNQBVCDDO-GFCCVEGCSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@@]1(C[N@@H+]2CCCC(C)(C)C2)CC[NH2+]C1 ZINC000069794524 383845972 /nfs/dbraw/zinc/84/59/72/383845972.db2.gz GWRRDFXIQNEKCQ-CYBMUJFWSA-N 2 0 210.365 2.108 20 0 BEADRP CC(C)(C)CC[N@@H+]1CCC[C@@H](CC[NH3+])C1 ZINC000069626401 383832988 /nfs/dbraw/zinc/83/29/88/383832988.db2.gz KMRQHWDTQAQZKV-LBPRGKRZSA-N 2 0 212.381 2.483 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1cccnc1 ZINC000037649301 383989226 /nfs/dbraw/zinc/98/92/26/383989226.db2.gz VAFQSEQIYZGGOX-STQMWFEESA-N 2 0 245.370 2.217 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1cccnc1 ZINC000037649304 383989573 /nfs/dbraw/zinc/98/95/73/383989573.db2.gz VAFQSEQIYZGGOX-CHWSQXEVSA-N 2 0 245.370 2.217 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)C1CC1 ZINC000643546097 384016988 /nfs/dbraw/zinc/01/69/88/384016988.db2.gz IHIXTCBPLMOQKZ-JQWIXIFHSA-N 2 0 208.349 2.049 20 0 BEADRP CC(C)(C)C[N@@H+]1CCC[C@]2(CC[NH2+]C2)C1 ZINC000072167903 384018586 /nfs/dbraw/zinc/01/85/86/384018586.db2.gz GLTCEZRXURMIEY-CYBMUJFWSA-N 2 0 210.365 2.108 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@](C)(C[NH3+])C2)cc1 ZINC000235887565 384032053 /nfs/dbraw/zinc/03/20/53/384032053.db2.gz PMEDIVMXDBBAEA-CQSZACIVSA-N 2 0 218.344 2.166 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000643547194 384033866 /nfs/dbraw/zinc/03/38/66/384033866.db2.gz AYWABYHZASYTHH-NEPJUHHUSA-N 2 0 222.376 2.439 20 0 BEADRP Cn1ccc(C[NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)c1 ZINC000091007286 384090658 /nfs/dbraw/zinc/09/06/58/384090658.db2.gz YVZKDUFICLUSMT-UHFFFAOYSA-N 2 0 249.402 2.424 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CCN(Cc2ccc(F)cc2F)C1 ZINC000163178501 384070666 /nfs/dbraw/zinc/07/06/66/384070666.db2.gz QQKRNXZNTYMRFW-VHSXEESVSA-N 2 0 240.297 2.134 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC(C)(C)OC1(C)C)C[NH+](C)C ZINC000310254474 384107395 /nfs/dbraw/zinc/10/73/95/384107395.db2.gz OWADLSAUFKUFKO-VXGBXAGGSA-N 2 0 242.407 2.120 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H]1CC[C@@H](C)C1 ZINC000070748376 384136128 /nfs/dbraw/zinc/13/61/28/384136128.db2.gz CIAKVSYCOLMDBW-OLZOCXBDSA-N 2 0 212.381 2.497 20 0 BEADRP Cc1ccc(C)c(C[N@H+]2CC[C@@H]([C@@H](C)[NH3+])C2)c1 ZINC000163206201 384166119 /nfs/dbraw/zinc/16/61/19/384166119.db2.gz NPBQKRQRYPCKBR-ZIAGYGMSSA-N 2 0 232.371 2.473 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@@H]([NH3+])[C@H](C)C2)s1 ZINC000050225596 384167258 /nfs/dbraw/zinc/16/72/58/384167258.db2.gz SFSULZYIBGSAOM-BXKDBHETSA-N 2 0 224.373 2.226 20 0 BEADRP Cc1ccc(C[NH2+]C[C@@H]2CCC[NH2+]C2)s1 ZINC000050226768 384167330 /nfs/dbraw/zinc/16/73/30/384167330.db2.gz YZUKZCRYOOMNCL-LLVKDONJSA-N 2 0 224.373 2.146 20 0 BEADRP C[NH2+]CCC[N@@H+]1[C@H](C)C[C@H]2CCCC[C@H]21 ZINC000309636650 384184992 /nfs/dbraw/zinc/18/49/92/384184992.db2.gz MYGIERPFAZSWBT-JHJVBQTASA-N 2 0 210.365 2.249 20 0 BEADRP C[C@H]([NH2+]CCCn1ccnc1)C(C)(C)C ZINC000133294897 384238945 /nfs/dbraw/zinc/23/89/45/384238945.db2.gz AMTGXEOZHNHFGG-NSHDSACASA-N 2 0 209.337 2.297 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CCC1CC1 ZINC000422916858 384216242 /nfs/dbraw/zinc/21/62/42/384216242.db2.gz BSLZCPCOMBDPGZ-JTQLQIEISA-N 2 0 233.359 2.299 20 0 BEADRP C[C@@H]([NH2+]C1CC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000132627516 384240545 /nfs/dbraw/zinc/24/05/45/384240545.db2.gz INAWFOBLRVKIOT-GFCCVEGCSA-N 2 0 248.370 2.440 20 0 BEADRP [NH3+]CC[C@@H]1CCCC[N@@H+]1CC1CCCC1 ZINC000082594454 384240734 /nfs/dbraw/zinc/24/07/34/384240734.db2.gz MFBPVWPFHZLZMN-ZDUSSCGKSA-N 2 0 210.365 2.380 20 0 BEADRP CN(CC[C@H]1CCCC[N@@H+]1C)Cc1ccn(C)c1 ZINC000093660009 384257560 /nfs/dbraw/zinc/25/75/60/384257560.db2.gz DURGPPWIKFIECY-OAHLLOKOSA-N 2 0 249.402 2.331 20 0 BEADRP CC[N@H+](Cc1ccncc1)[C@H]1CCC[NH2+]CC1 ZINC000113712504 384261037 /nfs/dbraw/zinc/26/10/37/384261037.db2.gz BAYXAEPCUIDNRS-AWEZNQCLSA-N 2 0 233.359 2.046 20 0 BEADRP Cc1ccc(C[NH2+]C[C@@H](C)C[NH+](C)C)s1 ZINC000291630798 384262032 /nfs/dbraw/zinc/26/20/32/384262032.db2.gz ANCFOIHVBZJIDX-SNVBAGLBSA-N 2 0 226.389 2.344 20 0 BEADRP C[C@H]([NH2+]C[C@H]1Cc2ccccc21)[C@H]1CCC[NH2+]1 ZINC000400444315 384277896 /nfs/dbraw/zinc/27/78/96/384277896.db2.gz PEOKZEDOZXISFR-NJZAAPMLSA-N 2 0 230.355 2.056 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccsc3)C[C@H]21 ZINC000228537573 384272365 /nfs/dbraw/zinc/27/23/65/384272365.db2.gz XBSFAUXONVIAPO-YNEHKIRRSA-N 2 0 236.384 2.307 20 0 BEADRP CC[NH+](CC)C[C@H]1CC[N@H+](CCSC)C1 ZINC000174228857 384313046 /nfs/dbraw/zinc/31/30/46/384313046.db2.gz BNRPRVBOEDBOJA-GFCCVEGCSA-N 2 0 230.421 2.013 20 0 BEADRP C[C@H]([NH2+]CCCC[NH+](C)C)c1nccs1 ZINC000083143268 384284290 /nfs/dbraw/zinc/28/42/90/384284290.db2.gz KCKUSNONPBHEGI-JTQLQIEISA-N 2 0 227.377 2.136 20 0 BEADRP CCC[C@H](C)[N@H+](C)C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000300055979 384285071 /nfs/dbraw/zinc/28/50/71/384285071.db2.gz LWNBUPILRFOOJA-FRRDWIJNSA-N 2 0 212.381 2.495 20 0 BEADRP C[N@H+](CC1CC[NH2+]CC1)C1Cc2ccccc2C1 ZINC000094010873 384287639 /nfs/dbraw/zinc/28/76/39/384287639.db2.gz GLCJGMREYGSWQI-UHFFFAOYSA-N 2 0 244.382 2.085 20 0 BEADRP [NH3+]C[C@H]1CCN(Cc2ccc(Cl)cc2)C1 ZINC000011891303 384300793 /nfs/dbraw/zinc/30/07/93/384300793.db2.gz QIGPQZKPXZPTHC-LLVKDONJSA-N 2 0 224.735 2.121 20 0 BEADRP CC[NH2+]CC1CC[NH+](CC2CCC2)CC1 ZINC000083839421 384339761 /nfs/dbraw/zinc/33/97/61/384339761.db2.gz HLADTJXHKZZLGS-UHFFFAOYSA-N 2 0 210.365 2.108 20 0 BEADRP CC[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1CCCN1C ZINC000166889746 384346722 /nfs/dbraw/zinc/34/67/22/384346722.db2.gz FSEAPMJZVPWKTA-FRRDWIJNSA-N 2 0 210.365 2.249 20 0 BEADRP COC(C)(C)C[N@H+](C)CC[C@H]1CCCC[NH+]1C ZINC000533479199 384363368 /nfs/dbraw/zinc/36/33/68/384363368.db2.gz SCDZZNHYCUFKNY-CYBMUJFWSA-N 2 0 242.407 2.218 20 0 BEADRP CCOC(C)(C)C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000159196961 384363765 /nfs/dbraw/zinc/36/37/65/384363765.db2.gz GHQFIIRCVIDJQA-YHWZYXNKSA-N 2 0 240.391 2.016 20 0 BEADRP COc1cc(CN2CC[C@@H]([NH3+])C[C@H]2C)ccc1C ZINC000569619099 384364997 /nfs/dbraw/zinc/36/49/97/384364997.db2.gz OKUMDCDACQSCHM-TZMCWYRMSA-N 2 0 248.370 2.315 20 0 BEADRP CC1(C)[C@H]([NH3+])C[C@H]1[NH2+]CCCCC(F)(F)F ZINC000405472056 384367842 /nfs/dbraw/zinc/36/78/42/384367842.db2.gz LBXWLWOHGLLRRV-RKDXNWHRSA-N 2 0 238.297 2.434 20 0 BEADRP C[NH+]1CCC(C[NH2+]C2CC(C)(C)C2)CC1 ZINC000335600527 384370261 /nfs/dbraw/zinc/37/02/61/384370261.db2.gz IZQHEFKVHFTNOH-UHFFFAOYSA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)[C@@H]1CCC[N@@H+]1C[C@@H]1CCC[NH2+]C1 ZINC000084126066 384371217 /nfs/dbraw/zinc/37/12/17/384371217.db2.gz FNLXSRQDEQGQDY-OLZOCXBDSA-N 2 0 210.365 2.106 20 0 BEADRP Cc1ccoc1CNC[C@@H](C)C[NH+]1CCCC1 ZINC000135152619 384419584 /nfs/dbraw/zinc/41/95/84/384419584.db2.gz IPYCMAMWKDJUCM-GFCCVEGCSA-N 2 0 236.359 2.410 20 0 BEADRP CCN(CC)C[C@H](C)[NH2+][C@@H]1C[C@H](C)[C@H]1C ZINC000336718423 384378319 /nfs/dbraw/zinc/37/83/19/384378319.db2.gz YKBLUGZUZLXIHS-WUHRBBMRSA-N 2 0 212.381 2.351 20 0 BEADRP CCC[N@H+](C)C[C@@H]1CC[NH+](CCCSC)C1 ZINC000174966576 384381250 /nfs/dbraw/zinc/38/12/50/384381250.db2.gz GIMLPFOPPJYJJU-ZDUSSCGKSA-N 2 0 244.448 2.403 20 0 BEADRP CC[C@@H](C)C[NH+]1CCC2(CC[NH2+]C2)CC1 ZINC000335612163 384386227 /nfs/dbraw/zinc/38/62/27/384386227.db2.gz LAKZODKZDOVDCT-GFCCVEGCSA-N 2 0 210.365 2.108 20 0 BEADRP CC[C@@H](C)[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000181116351 384447561 /nfs/dbraw/zinc/44/75/61/384447561.db2.gz STWPNIFUTBWOQR-GFCCVEGCSA-N 2 0 212.381 2.449 20 0 BEADRP CC[C@@H](C)[N@@H+]1CC[C@H](C[NH+](CC)CC)C1 ZINC000181134014 384456344 /nfs/dbraw/zinc/45/63/44/384456344.db2.gz NBMUDDKVYMFFPT-CHWSQXEVSA-N 2 0 212.381 2.449 20 0 BEADRP CN1CCC[C@H]([NH2+]C2CCC(F)(F)CC2)C1 ZINC000647175014 384468704 /nfs/dbraw/zinc/46/87/04/384468704.db2.gz UHLIOKFSNFHZJJ-NSHDSACASA-N 2 0 232.318 2.248 20 0 BEADRP CC[C@@](C)(C[NH2+]CCC1CC[NH+](C)CC1)OC ZINC000319805877 384486384 /nfs/dbraw/zinc/48/63/84/384486384.db2.gz GULOEGCQGRYMOZ-AWEZNQCLSA-N 2 0 242.407 2.123 20 0 BEADRP CC1(C[NH2+]C[C@H]2CC[C@H](C[NH3+])CC2)CC1 ZINC000300371384 384506569 /nfs/dbraw/zinc/50/65/69/384506569.db2.gz LRDZLONVGPHISG-HAQNSBGRSA-N 2 0 210.365 2.141 20 0 BEADRP CC(C)CSCC[NH2+][C@H]1CCC[C@@H]1C[NH3+] ZINC000397341832 384508031 /nfs/dbraw/zinc/50/80/31/384508031.db2.gz QMLDXLZKVPFHIC-NEPJUHHUSA-N 2 0 230.421 2.093 20 0 BEADRP CC(C)CSCC[NH2+][C@@H]1CCC[C@H]1C[NH3+] ZINC000397341836 384508901 /nfs/dbraw/zinc/50/89/01/384508901.db2.gz QMLDXLZKVPFHIC-NWDGAFQWSA-N 2 0 230.421 2.093 20 0 BEADRP CC[C@H]1CC[C@@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000449561481 384536019 /nfs/dbraw/zinc/53/60/19/384536019.db2.gz VNWBGGMUHYIRLH-WYTNZGFTSA-N 2 0 222.376 2.390 20 0 BEADRP C[C@H](C[NH2+]C1CC(C)(C)C1)C[NH+]1CCCC1 ZINC000309565435 384517810 /nfs/dbraw/zinc/51/78/10/384517810.db2.gz MCOZKPGGERGSPI-GFCCVEGCSA-N 2 0 224.392 2.497 20 0 BEADRP Fc1ccc2c(c1)[C@@H]([NH2+]CC1=CC[NH2+]CC1)CC2 ZINC000335059723 384520973 /nfs/dbraw/zinc/52/09/73/384520973.db2.gz NOSIAXXTXZBBBU-HNNXBMFYSA-N 2 0 246.329 2.322 20 0 BEADRP CC1(C)C[N@H+](CC[C@H]2CCC[NH2+]C2)CCS1 ZINC000164180656 384546660 /nfs/dbraw/zinc/54/66/60/384546660.db2.gz RRTKNIATRDSCRD-GFCCVEGCSA-N 2 0 242.432 2.204 20 0 BEADRP CC[C@@H]1CCCC[C@@H]1C[NH+]1C[C@@H]2C[NH2+]C[C@H]2C1 ZINC000401436755 384550546 /nfs/dbraw/zinc/55/05/46/384550546.db2.gz JZYDKHNXRJFDNF-KBXIAJHMSA-N 2 0 236.403 2.354 20 0 BEADRP CC[C@@H]1CCCC[C@@H]1C[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC000401436757 384550584 /nfs/dbraw/zinc/55/05/84/384550584.db2.gz JZYDKHNXRJFDNF-TUVASFSCSA-N 2 0 236.403 2.354 20 0 BEADRP C[NH+](C)CC(C)(C)C[NH2+]C1CCCCC1 ZINC000019905909 384555501 /nfs/dbraw/zinc/55/55/01/384555501.db2.gz QCBXYICAROZWBI-UHFFFAOYSA-N 2 0 212.381 2.497 20 0 BEADRP [NH3+]CC[C@@H]1CCC[N@H+](C[C@H]2CCC(F)(F)C2)C1 ZINC000305994995 384561688 /nfs/dbraw/zinc/56/16/88/384561688.db2.gz MQKYNOGSDZFYER-RYUDHWBXSA-N 2 0 246.345 2.483 20 0 BEADRP CC[C@@H]([NH2+]CCC[N@H+](C)CCOC)C1CCC1 ZINC000449080497 384537685 /nfs/dbraw/zinc/53/76/85/384537685.db2.gz WQWYDVGZVFHYNK-CQSZACIVSA-N 2 0 242.407 2.123 20 0 BEADRP C[NH+](C)CCCC1CC[NH+](CCCF)CC1 ZINC000123643094 384572728 /nfs/dbraw/zinc/57/27/28/384572728.db2.gz YGNJPNYWMJWYID-UHFFFAOYSA-N 2 0 230.371 2.400 20 0 BEADRP Cc1cccc(CC[NH2+][C@H]2CCCC[C@@H]2C[NH3+])n1 ZINC000423087188 384564793 /nfs/dbraw/zinc/56/47/93/384564793.db2.gz OYTOHPRLWLQLLY-HIFRSBDPSA-N 2 0 247.386 2.040 20 0 BEADRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccncc1 ZINC000020523963 384618668 /nfs/dbraw/zinc/61/86/68/384618668.db2.gz NMYGGOLFSINENC-PRTUASRFSA-N 2 0 245.370 2.357 20 0 BEADRP C[C@H](CC[NH2+]Cc1cc[nH]c1)[NH+]1CCCCC1 ZINC000184339624 384594508 /nfs/dbraw/zinc/59/45/08/384594508.db2.gz UDYSYNHAISLVAV-CYBMUJFWSA-N 2 0 235.375 2.369 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]C2CC(C(F)(F)F)C2)C1 ZINC000568247597 384602419 /nfs/dbraw/zinc/60/24/19/384602419.db2.gz RDYJLWNVSPXOJA-APTHBXDWSA-N 2 0 236.281 2.187 20 0 BEADRP Cc1nc(C)c(C)c(NC[C@H](C)[N@H+](C)C2CC2)n1 ZINC000301713727 384668548 /nfs/dbraw/zinc/66/85/48/384668548.db2.gz YZEDKVIAJHIDNY-VIFPVBQESA-N 2 0 248.374 2.296 20 0 BEADRP CCC[C@H]1[C@@H](C)CCC[N@@H+]1CCC[NH2+]C ZINC000309852661 384670705 /nfs/dbraw/zinc/67/07/05/384670705.db2.gz YQEKRGJPOBHMKI-STQMWFEESA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]CC1(C)CCC1 ZINC000090220112 384636205 /nfs/dbraw/zinc/63/62/05/384636205.db2.gz PBUWGGJZFXEGCN-FRRDWIJNSA-N 2 0 224.392 2.495 20 0 BEADRP CCCC[NH+]1CCC(NCc2cccn2C)CC1 ZINC000050595795 384636481 /nfs/dbraw/zinc/63/64/81/384636481.db2.gz APJLSRILPONZBX-UHFFFAOYSA-N 2 0 249.402 2.379 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H]2CC[C@@H]3C[C@@H]3C2)[C@H](C)C1 ZINC000647357252 384644364 /nfs/dbraw/zinc/64/43/64/384644364.db2.gz ZOTMAKFBMAYVIM-RYPNDVFKSA-N 2 0 236.403 2.495 20 0 BEADRP CN1CCCC(C)(C)[C@H]1C[NH2+][C@H]1CCSC1 ZINC000309978708 384681664 /nfs/dbraw/zinc/68/16/64/384681664.db2.gz VCJJUOPJEOBHRY-NWDGAFQWSA-N 2 0 242.432 2.202 20 0 BEADRP CC(F)(F)CC[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000357718316 384683319 /nfs/dbraw/zinc/68/33/19/384683319.db2.gz VUOHEWMHNYBVDU-GHMZBOCLSA-N 2 0 232.318 2.248 20 0 BEADRP CO[C@@H]1CCC[C@H]1[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000050368931 384700244 /nfs/dbraw/zinc/70/02/44/384700244.db2.gz VCZXRWLOERRCJP-ZIAGYGMSSA-N 2 0 240.391 2.016 20 0 BEADRP CC1(C[N@@H+]2CCC[C@H]([C@H]3CCC[NH2+]C3)C2)CC1 ZINC000647542817 384701948 /nfs/dbraw/zinc/70/19/48/384701948.db2.gz CKOIFMOWLOMTAG-KBPBESRZSA-N 2 0 236.403 2.498 20 0 BEADRP C([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000403498497 384707005 /nfs/dbraw/zinc/70/70/05/384707005.db2.gz XKZVTOGRPNIVET-OWDFPOFWSA-N 2 0 248.414 2.400 20 0 BEADRP CC(C)(C)[C@H]1CCCC[C@H]1[NH2+]CCOCC[NH3+] ZINC000357067664 384774632 /nfs/dbraw/zinc/77/46/32/384774632.db2.gz CVNJNTIBVDDFTD-QWHCGFSZSA-N 2 0 242.407 2.156 20 0 BEADRP C[N@H+](CCCCCF)CC(C)(C)C[NH3+] ZINC000308454630 384729019 /nfs/dbraw/zinc/72/90/19/384729019.db2.gz DIQOBTRYIPWSAF-UHFFFAOYSA-N 2 0 204.333 2.043 20 0 BEADRP CCSCCC[NH2+][C@@H]1CCCC[C@@H]1C[NH3+] ZINC000300968119 384739845 /nfs/dbraw/zinc/73/98/45/384739845.db2.gz RNEGOWBMCJJMOR-VXGBXAGGSA-N 2 0 230.421 2.237 20 0 BEADRP CCN1CCC[C@H]1C[NH2+][C@H]1CCCC12CC2 ZINC000568274950 384744233 /nfs/dbraw/zinc/74/42/33/384744233.db2.gz INXDISANLULUEP-STQMWFEESA-N 2 0 222.376 2.393 20 0 BEADRP C[NH+](C)C1CCC([NH2+]Cc2cscn2)CC1 ZINC000309970871 384747335 /nfs/dbraw/zinc/74/73/35/384747335.db2.gz PKMIOLVREYZOAD-UHFFFAOYSA-N 2 0 239.388 2.106 20 0 BEADRP CC[NH+]1CCC(C[NH2+]C[C@](C)(CC)OC)CC1 ZINC000319961389 384752862 /nfs/dbraw/zinc/75/28/62/384752862.db2.gz VYWVUBPGJQXKFJ-AWEZNQCLSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@]1(C[N@@H+]2CC[C@@H](C3CCC3)C2)CC[NH2+]C1 ZINC000647552014 384757918 /nfs/dbraw/zinc/75/79/18/384757918.db2.gz AHNDZPNZLLLZIB-KGLIPLIRSA-N 2 0 222.376 2.108 20 0 BEADRP CC1(C)CCC[C@H]1[C@@H]1CC[N@H+](CCC[NH3+])C1 ZINC000647552760 384760997 /nfs/dbraw/zinc/76/09/97/384760997.db2.gz VNDBGEMJNTYZRJ-OLZOCXBDSA-N 2 0 224.392 2.483 20 0 BEADRP C[C@H](CC1CC1)[NH2+]Cc1ccc(C[NH3+])cc1 ZINC000647553376 384768372 /nfs/dbraw/zinc/76/83/72/384768372.db2.gz XYIWMGLOFHMYSR-LLVKDONJSA-N 2 0 218.344 2.424 20 0 BEADRP C[C@]1(C[NH2+]CC2CCC(F)CC2)CC[NH2+]C1 ZINC000647553290 384769412 /nfs/dbraw/zinc/76/94/12/384769412.db2.gz PSZWEURHBHHIFH-BPCQOVAHSA-N 2 0 228.355 2.104 20 0 BEADRP CC[C@H](C)C[NH2+][C@@H]1CC[NH2+]C12CCCC2 ZINC000647554298 384770966 /nfs/dbraw/zinc/77/09/66/384770966.db2.gz WGJANKGXQFXNNP-NWDGAFQWSA-N 2 0 210.365 2.297 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000423357622 384833630 /nfs/dbraw/zinc/83/36/30/384833630.db2.gz MKSAMRZQZIUTGL-AGIUHOORSA-N 2 0 210.365 2.153 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H]1CCc2ccc(F)cc21 ZINC000423280274 384788797 /nfs/dbraw/zinc/78/87/97/384788797.db2.gz UHSVKDNOLNAGSV-QMTHXVAHSA-N 2 0 236.334 2.258 20 0 BEADRP CCC1CC([NH2+][C@H]2C[C@H](C)N(C3CC3)C2)C1 ZINC000310023777 384788913 /nfs/dbraw/zinc/78/89/13/384788913.db2.gz OLHJBMQJQDOVPN-WTIISPKJSA-N 2 0 222.376 2.390 20 0 BEADRP C[C@H](CCC1CC1)[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000398087837 384799688 /nfs/dbraw/zinc/79/96/88/384799688.db2.gz OIXUWNZVIAKZEC-RTXFEEFZSA-N 2 0 210.365 2.425 20 0 BEADRP C[N@H+]1CC=C(C[NH2+]C2CCC(F)(F)CC2)CC1 ZINC000647199088 384869922 /nfs/dbraw/zinc/86/99/22/384869922.db2.gz MFHJBTVXYLSUMS-UHFFFAOYSA-N 2 0 244.329 2.416 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000423363739 384841419 /nfs/dbraw/zinc/84/14/19/384841419.db2.gz AGXGGRYEJPPPIL-RWMBFGLXSA-N 2 0 233.359 2.311 20 0 BEADRP CC1CC([NH2+]C2CCN(c3cc[nH+]cc3)CC2)C1 ZINC000163673676 384843367 /nfs/dbraw/zinc/84/33/67/384843367.db2.gz GYGQGFXCWICIOV-UHFFFAOYSA-N 2 0 245.370 2.439 20 0 BEADRP C[NH+](C)CCCC[NH2+]C[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000403777013 384857451 /nfs/dbraw/zinc/85/74/51/384857451.db2.gz WMTAPSBGOWPAGU-MCIONIFRSA-N 2 0 224.392 2.354 20 0 BEADRP Cc1ccc(C[NH2+]CCC2CC[NH+](C)CC2)o1 ZINC000105454817 384867384 /nfs/dbraw/zinc/86/73/84/384867384.db2.gz SNWMOIHZSKXUKZ-UHFFFAOYSA-N 2 0 236.359 2.410 20 0 BEADRP CS[C@H]1CC[C@@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000309843849 384869587 /nfs/dbraw/zinc/86/95/87/384869587.db2.gz FRZJGCDKIVRGRC-DMGDTADUSA-N 2 0 240.416 2.095 20 0 BEADRP CCSCCC[NH2+][C@H](C)CCCC[NH3+] ZINC000308646535 384896780 /nfs/dbraw/zinc/89/67/80/384896780.db2.gz HQZOXTOTGDQSBJ-LLVKDONJSA-N 2 0 218.410 2.237 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@@H](C)Cc1ccc(F)cc1 ZINC000310201248 384902063 /nfs/dbraw/zinc/90/20/63/384902063.db2.gz BWRNYTLONURTFA-RYUDHWBXSA-N 2 0 238.350 2.474 20 0 BEADRP CC1(C[NH+]2CCC([NH2+]CC3CC3)CC2)CC1 ZINC000566227661 384922663 /nfs/dbraw/zinc/92/26/63/384922663.db2.gz KHJCITHLCTXTIR-UHFFFAOYSA-N 2 0 222.376 2.251 20 0 BEADRP c1csc(CN[C@H]2CC[N@@H+]3CCC[C@@H]3C2)c1 ZINC000106868252 384937059 /nfs/dbraw/zinc/93/70/59/384937059.db2.gz JXMYQZUILFWILN-NWDGAFQWSA-N 2 0 236.384 2.465 20 0 BEADRP CC[C@H](CSC)[NH2+][C@@H]1CN(CC)C[C@@H]1C ZINC000336762001 384995952 /nfs/dbraw/zinc/99/59/52/384995952.db2.gz NIPZYGBEDSQWKQ-QJPTWQEYSA-N 2 0 230.421 2.058 20 0 BEADRP C(C[NH2+][C@@H]1CC[C@H]1C1CC1)C[C@@H]1CCC[NH2+]1 ZINC000423490420 384999344 /nfs/dbraw/zinc/99/93/44/384999344.db2.gz XTQSGQOQEAVZBT-MELADBBJSA-N 2 0 222.376 2.297 20 0 BEADRP C1=C(CC[NH2+][C@@H]2CC[C@@H]2C2CC2)CC[NH2+]C1 ZINC000423543715 385023158 /nfs/dbraw/zinc/02/31/58/385023158.db2.gz VPKLVEQVUQVGMN-ZIAGYGMSSA-N 2 0 220.360 2.074 20 0 BEADRP CC(C)C1([NH2+]CC[C@H]2CCC[N@@H+]2C)CC1 ZINC000339521302 385014917 /nfs/dbraw/zinc/01/49/17/385014917.db2.gz JZKQEWAFRLAUMJ-GFCCVEGCSA-N 2 0 210.365 2.249 20 0 BEADRP CC1(C)CC(C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)C1 ZINC000518396288 385049062 /nfs/dbraw/zinc/04/90/62/385049062.db2.gz BTNVCBJTQYUILV-NWDGAFQWSA-N 2 0 210.365 2.282 20 0 BEADRP COc1cccc([C@H](C)[NH2+][C@H]2C[C@@H]([NH3+])C2(C)C)c1 ZINC000404759383 385050591 /nfs/dbraw/zinc/05/05/91/385050591.db2.gz BHHBBSQUIFHBIA-GDLCADMTSA-N 2 0 248.370 2.472 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H](C)C(C)(C)OC ZINC000300919368 385061458 /nfs/dbraw/zinc/06/14/58/385061458.db2.gz DSQBICFWPZOPFZ-GFCCVEGCSA-N 2 0 230.396 2.121 20 0 BEADRP C[N@H+](Cc1cccc2cccnc21)C1CC([NH3+])C1 ZINC000336233499 385064373 /nfs/dbraw/zinc/06/43/73/385064373.db2.gz UUNHIKBJCNXUTP-UHFFFAOYSA-N 2 0 241.338 2.156 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CCOC1CCCCC1 ZINC000310453541 385067039 /nfs/dbraw/zinc/06/70/39/385067039.db2.gz YPMUFONWSLLZIS-CYBMUJFWSA-N 2 0 242.407 2.443 20 0 BEADRP CC[C@H]([NH2+]CCc1cn(C)cn1)[C@H]1CC1(C)C ZINC000397617011 385068364 /nfs/dbraw/zinc/06/83/64/385068364.db2.gz CTOIFJDLKFIHDY-OLZOCXBDSA-N 2 0 235.375 2.377 20 0 BEADRP C1=C(CC[NH2+][C@H]2CC[C@H]2C2CC2)CC[NH2+]C1 ZINC000423543712 385024713 /nfs/dbraw/zinc/02/47/13/385024713.db2.gz VPKLVEQVUQVGMN-KBPBESRZSA-N 2 0 220.360 2.074 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)C1CCC1 ZINC000177943946 385140937 /nfs/dbraw/zinc/14/09/37/385140937.db2.gz FHNBTYNGADTUSR-RYUDHWBXSA-N 2 0 222.376 2.249 20 0 BEADRP Cc1cncc(CN(C)C[C@H]2CCC[N@H+](C)C2)c1 ZINC000189898210 385195658 /nfs/dbraw/zinc/19/56/58/385195658.db2.gz JCMRABCHRDPHHH-AWEZNQCLSA-N 2 0 247.386 2.164 20 0 BEADRP Cc1c[nH+]ccc1NC[C@H]1CCC[C@H]([NH3+])C1 ZINC000227674093 385198695 /nfs/dbraw/zinc/19/86/95/385198695.db2.gz SWSHSLHFTFVLLL-RYUDHWBXSA-N 2 0 219.332 2.319 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H]2C[C@H]2Cc2ccccc2)C1 ZINC000516663569 385151118 /nfs/dbraw/zinc/15/11/18/385151118.db2.gz STKWFTVNBVNGCK-LVQVYYBASA-N 2 0 244.382 2.477 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CCC[C@H]([C@@H]2CCC[NH2+]2)C1 ZINC000647479295 385151777 /nfs/dbraw/zinc/15/17/77/385151777.db2.gz AVRCXUDKDQWCCJ-RQJABVFESA-N 2 0 222.376 2.106 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CCC[C@H]([C@H]2CCC[NH2+]2)C1 ZINC000647479297 385152584 /nfs/dbraw/zinc/15/25/84/385152584.db2.gz AVRCXUDKDQWCCJ-XJFOESAGSA-N 2 0 222.376 2.106 20 0 BEADRP C[C@H](C[NH2+][C@H](C)c1ccncc1)C[NH+]1CCCC1 ZINC000062077889 385153429 /nfs/dbraw/zinc/15/34/29/385153429.db2.gz GCOLSOMOVMLPGT-ZIAGYGMSSA-N 2 0 247.386 2.464 20 0 BEADRP C1CC12C[C@H]2[NH2+][C@@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1 ZINC000424372901 385154932 /nfs/dbraw/zinc/15/49/32/385154932.db2.gz ITYISLYWBVHBDA-REWJHTLYSA-N 2 0 234.387 2.439 20 0 BEADRP Cc1nc(C[NH2+][C@@H](C)CCCC[NH3+])cs1 ZINC000308811196 385178558 /nfs/dbraw/zinc/17/85/58/385178558.db2.gz HFVGMXHAVKUIIW-VIFPVBQESA-N 2 0 227.377 2.059 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)CCCC[NH3+])c1ccco1 ZINC000308808940 385179194 /nfs/dbraw/zinc/17/91/94/385179194.db2.gz GQDMJWFQDXDXSE-WDEREUQCSA-N 2 0 210.321 2.448 20 0 BEADRP C[NH+](C)C1CCC([NH2+][C@@H]2CCCOCC2)CC1 ZINC000336380134 385208807 /nfs/dbraw/zinc/20/88/07/385208807.db2.gz SXPKMQDDOVQVJT-IYXRBSQSSA-N 2 0 240.391 2.018 20 0 BEADRP CC[C@@H]1CCC[C@H]1[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000252713575 385218177 /nfs/dbraw/zinc/21/81/77/385218177.db2.gz PNXCHEIBBIVVKW-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]CCc1cccs1 ZINC000252714847 385224683 /nfs/dbraw/zinc/22/46/83/385224683.db2.gz TWTGHOCNHXNVQK-WCQYABFASA-N 2 0 238.400 2.220 20 0 BEADRP CSCCCC[NH2+][C@@H]1CC[N@H+](C)C[C@H]1C ZINC000252715654 385225556 /nfs/dbraw/zinc/22/55/56/385225556.db2.gz WHCKHGSYVBEZFS-VXGBXAGGSA-N 2 0 230.421 2.059 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]C[C@@H](c1ccccc1)N(C)C ZINC000310965989 385257031 /nfs/dbraw/zinc/25/70/31/385257031.db2.gz BGOSMTJQEVZLKV-ZFWWWQNUSA-N 2 0 249.402 2.006 20 0 BEADRP C[C@H](CCC1CC1)[NH2+]C[C@H](C)C[NH+](C)C ZINC000308882095 385236530 /nfs/dbraw/zinc/23/65/30/385236530.db2.gz URAMVUVWISKIBV-NWDGAFQWSA-N 2 0 212.381 2.352 20 0 BEADRP CC[C@H]([NH2+]C[C@H](C)C[NH3+])c1ccccc1 ZINC000308981062 385322533 /nfs/dbraw/zinc/32/25/33/385322533.db2.gz KIPJQNJOOSEZJX-YPMHNXCESA-N 2 0 206.333 2.322 20 0 BEADRP Cc1ccc(C[NH2+]CCCC[NH+](C)C)s1 ZINC000045598340 385270186 /nfs/dbraw/zinc/27/01/86/385270186.db2.gz VROHQZZIIKTJEU-UHFFFAOYSA-N 2 0 226.389 2.488 20 0 BEADRP CC(C)[C@H]([NH3+])CC[N@H+](C)CCCCCF ZINC000308924206 385296482 /nfs/dbraw/zinc/29/64/82/385296482.db2.gz LOJSPZWQFJRIIT-GFCCVEGCSA-N 2 0 218.360 2.431 20 0 BEADRP CC[C@@H](C)[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000308930159 385300994 /nfs/dbraw/zinc/30/09/94/385300994.db2.gz JHTSEFKXPIVZSL-PNESKVBLSA-N 2 0 210.365 2.391 20 0 BEADRP Cc1ccc(CC[N@@H+]2CC[C@H]3[NH2+]CC[C@H]3C2)cc1 ZINC000335906402 385336789 /nfs/dbraw/zinc/33/67/89/385336789.db2.gz DDUNNXGGHUFYTG-JKSUJKDBSA-N 2 0 244.382 2.221 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@@H]1CCCCS1 ZINC000308998274 385338547 /nfs/dbraw/zinc/33/85/47/385338547.db2.gz KOOYOGDLGGRCPD-NEPJUHHUSA-N 2 0 230.421 2.379 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+]C[C@@H](C)C[NH3+])cc1 ZINC000309013153 385368920 /nfs/dbraw/zinc/36/89/20/385368920.db2.gz YDOGSQURYXDPBO-NWDGAFQWSA-N 2 0 206.333 2.240 20 0 BEADRP CC[C@@H](C)C[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000180203950 385384895 /nfs/dbraw/zinc/38/48/95/385384895.db2.gz KRXYKFVDUCLPGV-GFCCVEGCSA-N 2 0 224.392 2.497 20 0 BEADRP COC1(C[NH2+]C2CC[NH+](C(C)C)CC2)CCC1 ZINC000180464229 385391848 /nfs/dbraw/zinc/39/18/48/385391848.db2.gz DFQPDBHMXCQTQS-UHFFFAOYSA-N 2 0 240.391 2.018 20 0 BEADRP C[NH+](C)CCC[NH2+][C@@H]1CCC[C@@H]2C[C@@]21C ZINC000309066956 385392729 /nfs/dbraw/zinc/39/27/29/385392729.db2.gz ZZDFYWWCOYGLBM-UPJWGTAASA-N 2 0 210.365 2.106 20 0 BEADRP CCSCC[NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000309061026 385397666 /nfs/dbraw/zinc/39/76/66/385397666.db2.gz WPPWAWBUMMQVFN-NWDGAFQWSA-N 2 0 230.421 2.202 20 0 BEADRP CCc1ccc(C[NH2+]CCC[NH+](C)C)s1 ZINC000020054187 385409064 /nfs/dbraw/zinc/40/90/64/385409064.db2.gz KGDLVSRZLMHQDA-UHFFFAOYSA-N 2 0 226.389 2.352 20 0 BEADRP CC[C@@H](C)[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000309168150 385446192 /nfs/dbraw/zinc/44/61/92/385446192.db2.gz JYPNMLCFQAXORH-LLVKDONJSA-N 2 0 210.365 2.391 20 0 BEADRP CCC1CC([NH2+][C@H](C)CN(C)C(C)C)C1 ZINC000309142802 385434305 /nfs/dbraw/zinc/43/43/05/385434305.db2.gz HPNMJLQVWVZUBB-PNESKVBLSA-N 2 0 212.381 2.493 20 0 BEADRP CC(C)=CCC[NH2+][C@H]1CC[N@@H+](C)C[C@@H]1C ZINC000309145780 385438077 /nfs/dbraw/zinc/43/80/77/385438077.db2.gz VCOQMJZTAISERF-STQMWFEESA-N 2 0 210.365 2.273 20 0 BEADRP FCCCC[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000309215408 385484171 /nfs/dbraw/zinc/48/41/71/385484171.db2.gz FJRVQSAYLCMEHV-YNEHKIRRSA-N 2 0 228.355 2.246 20 0 BEADRP C[C@H]([NH2+]CCC1CC[NH+](C)CC1)c1ccncc1 ZINC000156611520 385460783 /nfs/dbraw/zinc/46/07/83/385460783.db2.gz ZYODZQDIFWKBIC-ZDUSSCGKSA-N 2 0 247.386 2.464 20 0 BEADRP CC[N@H+](CCNc1ccnc(C(C)C)n1)C1CC1 ZINC000110481030 385492899 /nfs/dbraw/zinc/49/28/99/385492899.db2.gz PNNIYRAJNLUCMU-UHFFFAOYSA-N 2 0 248.374 2.496 20 0 BEADRP CC(C)(C)CCC[N@@H+]1CC[C@H]2[NH2+]CC[C@@H]2C1 ZINC000309290351 385516380 /nfs/dbraw/zinc/51/63/80/385516380.db2.gz PZVUZXYRHMXSLG-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)CC[N@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000172351225 385531450 /nfs/dbraw/zinc/53/14/50/385531450.db2.gz HVWHADZVSWNFEZ-ZDUSSCGKSA-N 2 0 212.381 2.306 20 0 BEADRP CC[NH+](CC)CCCN(C)CCc1ccccn1 ZINC000171940781 385535956 /nfs/dbraw/zinc/53/59/56/385535956.db2.gz HWOHQIXBBOOYGO-UHFFFAOYSA-N 2 0 249.402 2.288 20 0 BEADRP Cc1c[nH+]ccc1N[C@@H]1CCC[N@H+](C)[C@@H]1C ZINC000309375701 385555857 /nfs/dbraw/zinc/55/58/57/385555857.db2.gz COWGXTJESPAESA-DGCLKSJQSA-N 2 0 219.332 2.285 20 0 BEADRP C[C@H](c1ccccc1)[C@H](C)[NH2+]CCC[NH3+] ZINC000309376649 385558118 /nfs/dbraw/zinc/55/81/18/385558118.db2.gz CTKALDBATMGIKM-RYUDHWBXSA-N 2 0 206.333 2.117 20 0 BEADRP CCSCC[NH2+]C[C@@H](C)C[NH+]1CCCCC1 ZINC000309409117 385572877 /nfs/dbraw/zinc/57/28/77/385572877.db2.gz BMKRBKZJGZKVNS-CYBMUJFWSA-N 2 0 244.448 2.451 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]CCSc1ccccc1 ZINC000309428873 385581720 /nfs/dbraw/zinc/58/17/20/385581720.db2.gz MCVGTCLOHPGAMH-LBPRGKRZSA-N 2 0 238.400 2.496 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H]1C[C@@H](C)[C@H]1C ZINC000336677601 385609215 /nfs/dbraw/zinc/60/92/15/385609215.db2.gz HYUQVQFHFTULJT-JHJVBQTASA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H]1C[C@H]1C[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC000309506954 385639789 /nfs/dbraw/zinc/63/97/89/385639789.db2.gz WCUPNCZEXPWPDP-YJBUHQLJSA-N 2 0 222.376 2.247 20 0 BEADRP C[C@@H](CCCC(F)(F)F)[NH2+]C[C@H]1CCC[NH2+]1 ZINC000414853368 385689185 /nfs/dbraw/zinc/68/91/85/385689185.db2.gz XUAVWZRBWPBWSQ-VHSXEESVSA-N 2 0 238.297 2.449 20 0 BEADRP c1cn(CCC[N@@H+]2CCc3sccc3C2)cn1 ZINC000182620064 385690153 /nfs/dbraw/zinc/69/01/53/385690153.db2.gz VQRIGHAFVVYQRE-UHFFFAOYSA-N 2 0 247.367 2.393 20 0 BEADRP C[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)[C@H]1CC1(C)C ZINC000309568675 385705283 /nfs/dbraw/zinc/70/52/83/385705283.db2.gz MZZWRWWWEZDYFM-DGCLKSJQSA-N 2 0 222.376 2.273 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1CCC(C)(C)C[C@@H]1C ZINC000414857549 385729455 /nfs/dbraw/zinc/72/94/55/385729455.db2.gz DWJOJOXAGRYJEV-NWDGAFQWSA-N 2 0 212.381 2.400 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H](C)C[NH3+])c1ccc(OC)cc1 ZINC000336691948 385731517 /nfs/dbraw/zinc/73/15/17/385731517.db2.gz HPPLNZMQDDLCJW-SMDDNHRTSA-N 2 0 236.359 2.331 20 0 BEADRP COc1ccc(C[NH2+][C@H](C)[C@H]2CCC[NH2+]C2)cc1 ZINC000414858353 385734314 /nfs/dbraw/zinc/73/43/14/385734314.db2.gz RMXJDRWSTUXOOQ-OCCSQVGLSA-N 2 0 248.370 2.173 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000488291045 385734638 /nfs/dbraw/zinc/73/46/38/385734638.db2.gz GVRPXNXETTZCDX-MGPQQGTHSA-N 2 0 222.376 2.060 20 0 BEADRP C[NH2+]CCC[NH2+]Cc1c(C)oc2ccccc21 ZINC000414858215 385735119 /nfs/dbraw/zinc/73/51/19/385735119.db2.gz IDPXCICRDMNRMC-UHFFFAOYSA-N 2 0 232.327 2.440 20 0 BEADRP Cc1ccc(C[NH2+][C@H](C)[C@@H]2CCC[NH2+]C2)cc1 ZINC000414858581 385735900 /nfs/dbraw/zinc/73/59/00/385735900.db2.gz SAVIIHZESYJWGW-UKRRQHHQSA-N 2 0 232.371 2.473 20 0 BEADRP C[NH2+]CCC[NH2+]C/C=C/c1ccc(F)cc1F ZINC000414858731 385736256 /nfs/dbraw/zinc/73/62/56/385736256.db2.gz KVWHVMISACRTRJ-DUXPYHPUSA-N 2 0 240.297 2.177 20 0 BEADRP C[NH2+]CCC[NH2+]Cc1ccc2nc(C)sc2c1 ZINC000414858478 385737034 /nfs/dbraw/zinc/73/70/34/385737034.db2.gz JONBNVOIAXJMLX-UHFFFAOYSA-N 2 0 249.383 2.304 20 0 BEADRP C[NH2+]CCC[NH2+]Cc1ccc(F)c2cccnc12 ZINC000414859715 385739091 /nfs/dbraw/zinc/73/90/91/385739091.db2.gz NFLLFAZPASBTET-UHFFFAOYSA-N 2 0 247.317 2.073 20 0 BEADRP CC[C@@H](C)C[C@@H](CC)[NH2+]CCC[NH2+]C ZINC000414859350 385740494 /nfs/dbraw/zinc/74/04/94/385740494.db2.gz MOIOYRMSZGAQHK-VXGBXAGGSA-N 2 0 200.370 2.400 20 0 BEADRP CC[C@H](C[C@@H](C)CC)[NH2+]CCC[NH2+]C ZINC000414859348 385741734 /nfs/dbraw/zinc/74/17/34/385741734.db2.gz MOIOYRMSZGAQHK-NWDGAFQWSA-N 2 0 200.370 2.400 20 0 BEADRP C[NH2+]CCC[NH2+][C@H]1CCCC[C@@H]1C1CC1 ZINC000414861320 385749888 /nfs/dbraw/zinc/74/98/88/385749888.db2.gz RWOKNLHQRGNTDE-OLZOCXBDSA-N 2 0 210.365 2.154 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H](C)[C@@H](C)c1ccccc1 ZINC000414861667 385752916 /nfs/dbraw/zinc/75/29/16/385752916.db2.gz SSHMKSQTACKNKQ-OLZOCXBDSA-N 2 0 220.360 2.378 20 0 BEADRP c1ccc([C@@H]2C[C@H]2C[NH2+]C[C@@H]2CCC[NH2+]C2)cc1 ZINC000414864521 385763190 /nfs/dbraw/zinc/76/31/90/385763190.db2.gz YROFYAIFYRMXCU-KBMXLJTQSA-N 2 0 244.382 2.379 20 0 BEADRP CCN(CC[C@@H]1CCC[N@@H+]1C)Cc1ccncc1 ZINC000271029958 385772499 /nfs/dbraw/zinc/77/24/99/385772499.db2.gz QCOJTHDGBHALOT-HNNXBMFYSA-N 2 0 247.386 2.388 20 0 BEADRP CC(C)[C@@H]1CCC[C@@H]1[NH2+][C@H]1CCCNC1 ZINC000414866514 385780519 /nfs/dbraw/zinc/78/05/19/385780519.db2.gz NATUJLVBXAPYSU-AVGNSLFASA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H](C[NH2+]Cc1cccc2cc[nH]c21)C[NH+](C)C ZINC000291804026 385721519 /nfs/dbraw/zinc/72/15/19/385721519.db2.gz XMWVLGMCRRZBBC-LBPRGKRZSA-N 2 0 245.370 2.455 20 0 BEADRP COc1cc(C[NH2+]C2(C)CC[NH2+]CC2)ccc1C ZINC000414947256 385802531 /nfs/dbraw/zinc/80/25/31/385802531.db2.gz VYBMXWIYJWMVKO-UHFFFAOYSA-N 2 0 248.370 2.235 20 0 BEADRP C[C@H](C[NH2+][C@@H](C)[C@H]1CCCC[NH2+]1)CC(F)F ZINC000647800558 385807897 /nfs/dbraw/zinc/80/78/97/385807897.db2.gz FGYWEMBRTHSLFL-GARJFASQSA-N 2 0 234.334 2.398 20 0 BEADRP C[C@@H](CCC1CC1)[NH2+][C@@H]1CC[NH2+][C@H](C)C1 ZINC000414948670 385809341 /nfs/dbraw/zinc/80/93/41/385809341.db2.gz MNMLGEDEPBQZFQ-DMDPSCGWSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H](C[NH2+][C@@H](C)[C@@H]1CCC[NH2+]1)CC(F)F ZINC000647801555 385811241 /nfs/dbraw/zinc/81/12/41/385811241.db2.gz YHJIKSWIJOICPY-GUBZILKMSA-N 2 0 220.307 2.008 20 0 BEADRP CC[NH2+][C@H](C)CN[C@H](C)Cc1ccccc1F ZINC000414952679 385826038 /nfs/dbraw/zinc/82/60/38/385826038.db2.gz IOTJWLMPOBMHEB-VXGBXAGGSA-N 2 0 238.350 2.344 20 0 BEADRP COCc1cccc(C[NH2+][C@H]2CC[NH2+][C@H](C)C2)c1 ZINC000414952438 385826734 /nfs/dbraw/zinc/82/67/34/385826734.db2.gz QSTCZMYEAMXXEM-DOMZBBRYSA-N 2 0 248.370 2.063 20 0 BEADRP Cc1ccc(CN[C@H]2CC[NH2+]C2)cc1Cl ZINC000335640906 385829480 /nfs/dbraw/zinc/82/94/80/385829480.db2.gz DTFWZKIPVXQIEF-NSHDSACASA-N 2 0 224.735 2.100 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CCCC[C@H]2C)CC[NH2+]1 ZINC000414954542 385829585 /nfs/dbraw/zinc/82/95/85/385829585.db2.gz SQSCZDJTWXXKFS-LPWJVIDDSA-N 2 0 210.365 2.295 20 0 BEADRP COc1ccccc1C1([NH2+][C@H](C)C[C@@H](C)[NH3+])CC1 ZINC000647802048 385833269 /nfs/dbraw/zinc/83/32/69/385833269.db2.gz CMCJAQVUYDANRC-VXGBXAGGSA-N 2 0 248.370 2.400 20 0 BEADRP C[C@@H]([NH2+]C1(c2cccc(F)c2)CCC1)C1C[NH2+]C1 ZINC000647802266 385835695 /nfs/dbraw/zinc/83/56/95/385835695.db2.gz HQKXTQHCMPNWIF-LLVKDONJSA-N 2 0 248.345 2.402 20 0 BEADRP Cc1n[nH]cc1[C@H](C)[NH2+]Cc1ccc(C[NH3+])cc1 ZINC000647803352 385837367 /nfs/dbraw/zinc/83/73/67/385837367.db2.gz YDHHKRAGVMMRDZ-JTQLQIEISA-N 2 0 244.342 2.028 20 0 BEADRP Cc1oc2ccccc2c1C[NH2+]C[C@@H](C)C[NH3+] ZINC000414869588 385837544 /nfs/dbraw/zinc/83/75/44/385837544.db2.gz ARADTSKHQNCXDN-JTQLQIEISA-N 2 0 232.327 2.426 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[C@H]2C1)[C@@H]1CCCC[NH2+]1 ZINC000647804279 385840661 /nfs/dbraw/zinc/84/06/61/385840661.db2.gz NHWMKFWSTAXABL-YHQUGGNUSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CC1(C2CC2)CC1 ZINC000336718511 385843757 /nfs/dbraw/zinc/84/37/57/385843757.db2.gz YOLSUMGMTMVDBI-NSHDSACASA-N 2 0 210.365 2.284 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@@H](C)[C@]1(C)CCCO1 ZINC000340469490 385858719 /nfs/dbraw/zinc/85/87/19/385858719.db2.gz KEFWBJLGRACTON-KBPBESRZSA-N 2 0 242.407 2.264 20 0 BEADRP CCC[C@H](C[N@H+](C)[C@H]1CCN(C)[C@H](C)C1)OC ZINC000638115761 385850229 /nfs/dbraw/zinc/85/02/29/385850229.db2.gz FYYOFSZPRHDMAM-HZSPNIEDSA-N 2 0 242.407 2.216 20 0 BEADRP C[C@H](C[NH2+]C/C=C\c1ccccc1)C[NH+](C)C ZINC000336719683 385852749 /nfs/dbraw/zinc/85/27/49/385852749.db2.gz RRHKEBGDNZIGKA-JKEYDSJLSA-N 2 0 232.371 2.487 20 0 BEADRP CCN(C)CC[NH2+][C@@H]1CS[C@@H](C(C)(C)C)C1 ZINC000309678847 385791442 /nfs/dbraw/zinc/79/14/42/385791442.db2.gz YXLNXNOXBDVVFF-NWDGAFQWSA-N 2 0 244.448 2.448 20 0 BEADRP CCN(C)CC[NH2+][C@@H]1CS[C@H](C(C)(C)C)C1 ZINC000309678848 385792436 /nfs/dbraw/zinc/79/24/36/385792436.db2.gz YXLNXNOXBDVVFF-RYUDHWBXSA-N 2 0 244.448 2.448 20 0 BEADRP CSCCCCC[NH2+][C@H]1CC[N@H+](C)C[C@H]1C ZINC000309689601 385792742 /nfs/dbraw/zinc/79/27/42/385792742.db2.gz ISMFLIFWMSACGS-OLZOCXBDSA-N 2 0 244.448 2.450 20 0 BEADRP C[C@@H]([NH3+])[C@H]1CCC[N@H+](CCCCCF)C1 ZINC000336706140 385792922 /nfs/dbraw/zinc/79/29/22/385792922.db2.gz RIDGGTQFTFPFKG-NEPJUHHUSA-N 2 0 216.344 2.185 20 0 BEADRP C1CC([NH2+][C@@H]2CCC[C@@H]2[C@H]2CCCC[NH2+]2)C1 ZINC000250806168 385928528 /nfs/dbraw/zinc/92/85/28/385928528.db2.gz CNGPJEIAUDUBLH-MGPQQGTHSA-N 2 0 222.376 2.439 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+]C1C[C@H](C)C[C@@H](C)C1 ZINC000414962899 385886898 /nfs/dbraw/zinc/88/68/98/385886898.db2.gz SUMOAJJIMCUDMP-IJLUTSLNSA-N 2 0 212.381 2.399 20 0 BEADRP CCc1cccc(F)c1C[NH2+]C[C@@H](C)C[NH3+] ZINC000414874785 385889730 /nfs/dbraw/zinc/88/97/30/385889730.db2.gz JEABFHSONIPVGU-JTQLQIEISA-N 2 0 224.323 2.073 20 0 BEADRP CCC[NH2+]CC[NH2+][C@@H]1CC[C@@H](C)[C@H](C)C1 ZINC000414874960 385891011 /nfs/dbraw/zinc/89/10/11/385891011.db2.gz TZSBUKVGZJMXCY-JHJVBQTASA-N 2 0 212.381 2.400 20 0 BEADRP CCc1cccc(C[N@H+](C)CCC[NH3+])c1 ZINC000647847323 385896987 /nfs/dbraw/zinc/89/69/87/385896987.db2.gz JIMOGONNNGBVNZ-UHFFFAOYSA-N 2 0 206.333 2.030 20 0 BEADRP C[NH+](C)C(C)(C)CNc1[nH+]ccc2[nH]ccc21 ZINC000647847258 385897168 /nfs/dbraw/zinc/89/71/68/385897168.db2.gz BQNVGPWUUOTFOA-UHFFFAOYSA-N 2 0 232.331 2.315 20 0 BEADRP CCCC[C@@H](CC)[NH2+]C[C@]1(COC)CCC[NH2+]1 ZINC000414963750 385899190 /nfs/dbraw/zinc/89/91/90/385899190.db2.gz XLAHSFUROAVWMJ-KGLIPLIRSA-N 2 0 242.407 2.313 20 0 BEADRP CCCC[C@H](CC)[NH2+]C[C@]1(COC)CCC[NH2+]1 ZINC000414963749 385899690 /nfs/dbraw/zinc/89/96/90/385899690.db2.gz XLAHSFUROAVWMJ-KBPBESRZSA-N 2 0 242.407 2.313 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+]C/C=C/c1ccc(F)cc1 ZINC000414964268 385903521 /nfs/dbraw/zinc/90/35/21/385903521.db2.gz UQGMCOZCQFWLTN-FKZRYSJHSA-N 2 0 248.345 2.427 20 0 BEADRP CC1(C[NH2+][C@@H]2CCCCC[C@H]2[NH3+])CCOCC1 ZINC000335038133 385929301 /nfs/dbraw/zinc/92/93/01/385929301.db2.gz HCAZAQJUWDEHRI-CHWSQXEVSA-N 2 0 240.391 2.053 20 0 BEADRP FC1(F)CC(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)C1 ZINC000334492147 385907940 /nfs/dbraw/zinc/90/79/40/385907940.db2.gz FCEYWOREDMHCNS-NEPJUHHUSA-N 2 0 244.329 2.248 20 0 BEADRP C[C@@H](CC[NH3+])[NH2+]Cc1ccc(F)c2cccnc12 ZINC000414876792 385915628 /nfs/dbraw/zinc/91/56/28/385915628.db2.gz DXWKHSYDJYJOOE-JTQLQIEISA-N 2 0 247.317 2.201 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@@H]1CCC[C@@H]1C1CC1 ZINC000414967620 385929809 /nfs/dbraw/zinc/92/98/09/385929809.db2.gz XWHKVTAUWJPBHA-RAIGVLPGSA-N 2 0 210.365 2.153 20 0 BEADRP COc1ccccc1/C=C\C[NH2+][C@@H](C)CC[NH3+] ZINC000414877064 385917370 /nfs/dbraw/zinc/91/73/70/385917370.db2.gz FKRQKCPABNRZCE-HWPRWLFBSA-N 2 0 234.343 2.035 20 0 BEADRP COc1ccccc1/C=C\C[NH2+][C@H](C)CC[NH3+] ZINC000414877066 385917508 /nfs/dbraw/zinc/91/75/08/385917508.db2.gz FKRQKCPABNRZCE-SMYYYNMVSA-N 2 0 234.343 2.035 20 0 BEADRP CC1(C)[C@@H]2C[N@@H+](CCC[NH+]3CCCCC3)C[C@@H]21 ZINC000189047743 385919743 /nfs/dbraw/zinc/91/97/43/385919743.db2.gz LUIMPEVLQAAEMS-OKILXGFUSA-N 2 0 236.403 2.450 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]CC1(C)CCC1 ZINC000335034028 385922930 /nfs/dbraw/zinc/92/29/30/385922930.db2.gz STUAYAFNUJSHHW-VXGBXAGGSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+]CC1(C)CCC1 ZINC000335034026 385923821 /nfs/dbraw/zinc/92/38/21/385923821.db2.gz STUAYAFNUJSHHW-NWDGAFQWSA-N 2 0 210.365 2.154 20 0 BEADRP Cc1ccsc1C[NH2+]C[C@H](C)C[NH+](C)C ZINC000291731878 385925035 /nfs/dbraw/zinc/92/50/35/385925035.db2.gz NYGOXTZKGUXXHC-JTQLQIEISA-N 2 0 226.389 2.344 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+][C@H]1CCc2ccccc2C1 ZINC000250840165 385927144 /nfs/dbraw/zinc/92/71/44/385927144.db2.gz DUKTYZWRNQUQGG-HRCADAONSA-N 2 0 244.382 2.261 20 0 BEADRP c1ccc([C@H]2CC[N@@H+](CC[C@H]3CC[NH2+]C3)C2)cc1 ZINC000250825001 385927440 /nfs/dbraw/zinc/92/74/40/385927440.db2.gz WEHQXUMYSGVZNU-ZBFHGGJFSA-N 2 0 244.382 2.476 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000414967253 385927506 /nfs/dbraw/zinc/92/75/06/385927506.db2.gz HFWIZSNUGQWSNB-AGIUHOORSA-N 2 0 210.365 2.297 20 0 BEADRP C[N@H+](CCCn1ccnc1)Cc1cccs1 ZINC000272027946 385869668 /nfs/dbraw/zinc/86/96/68/385869668.db2.gz WFAFVFNLWZHOOQ-UHFFFAOYSA-N 2 0 235.356 2.467 20 0 BEADRP C[C@H]([NH2+]CC(C)(C)C[NH+](C)C)[C@@]1(C)CCCO1 ZINC000340473673 385876886 /nfs/dbraw/zinc/87/68/86/385876886.db2.gz KGRRBPBTBATRJF-GXTWGEPZSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+]C[C@@H](C)Cc1ccccc1 ZINC000414873524 385877864 /nfs/dbraw/zinc/87/78/64/385877864.db2.gz HKPQPRSXGJNWQC-STQMWFEESA-N 2 0 220.360 2.050 20 0 BEADRP CC1(C)CC[C@H]1[NH2+]C1CCC(C[NH3+])CC1 ZINC000335017624 385975364 /nfs/dbraw/zinc/97/53/64/385975364.db2.gz KZVULMAGPODGFM-HTAVTVPLSA-N 2 0 210.365 2.282 20 0 BEADRP Cc1cccc(OCC[NH+]2CCC(C)([NH3+])CC2)c1 ZINC000647926635 385983163 /nfs/dbraw/zinc/98/31/63/385983163.db2.gz HKYTXFBBJGWJNN-UHFFFAOYSA-N 2 0 248.370 2.187 20 0 BEADRP CC1(C)CC([NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)C1 ZINC000336748375 385985797 /nfs/dbraw/zinc/98/57/97/385985797.db2.gz SRMZXJSTFOXGOM-NSHDSACASA-N 2 0 222.376 2.249 20 0 BEADRP CC[NH+](CC)CCC[N@@H+]1CCC[C@@](C)(OC)C1 ZINC000338389956 385987299 /nfs/dbraw/zinc/98/72/99/385987299.db2.gz TWCNBZHUBOAWLC-CQSZACIVSA-N 2 0 242.407 2.219 20 0 BEADRP CCC[NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000335042678 385936282 /nfs/dbraw/zinc/93/62/82/385936282.db2.gz UHCRMSIDNWSARO-UKRRQHHQSA-N 2 0 246.354 2.242 20 0 BEADRP C[C@H]([NH2+]C1CC[NH+](CC2CC2)CC1)[C@H]1C[C@H]1C ZINC000414060997 385936477 /nfs/dbraw/zinc/93/64/77/385936477.db2.gz BDFHNDILENGUDI-XUJVJEKNSA-N 2 0 236.403 2.495 20 0 BEADRP CC[NH2+][C@H](C)CNCc1cc(F)ccc1C ZINC000414968166 385936835 /nfs/dbraw/zinc/93/68/35/385936835.db2.gz YBESTXQLPOHNJQ-LLVKDONJSA-N 2 0 224.323 2.222 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]C1Cc2ccccc2C1 ZINC000335044247 385938867 /nfs/dbraw/zinc/93/88/67/385938867.db2.gz XWUARBRLFUUIBF-WBMJQRKESA-N 2 0 244.382 2.132 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](C)[C@@H]2C[C@@H]2C)C1 ZINC000414066981 385941951 /nfs/dbraw/zinc/94/19/51/385941951.db2.gz IMGYRMKSBHITDD-REWJHTLYSA-N 2 0 224.392 2.352 20 0 BEADRP [NH3+]C1(C[NH2+][C@H]2CCc3ccccc32)CCC1 ZINC000335054680 385954231 /nfs/dbraw/zinc/95/42/31/385954231.db2.gz UIHVUYLMZUGXFE-ZDUSSCGKSA-N 2 0 216.328 2.145 20 0 BEADRP Cc1ccc2c(c1)[C@@H]([NH2+]CC1([NH3+])CCC1)CC2 ZINC000335054621 385954429 /nfs/dbraw/zinc/95/44/29/385954429.db2.gz RZQUGLCSNQFGBR-AWEZNQCLSA-N 2 0 230.355 2.453 20 0 BEADRP CC(C)[C@@H]1CCC[C@@H]1[NH2+]CC1([NH3+])CCC1 ZINC000414880035 385956408 /nfs/dbraw/zinc/95/64/08/385956408.db2.gz QJEBWVIKTQTKDN-RYUDHWBXSA-N 2 0 210.365 2.282 20 0 BEADRP c1ccc2c(c1)CC[C@@H]([NH2+]CC1=CC[NH2+]CC1)C2 ZINC000335057545 385958558 /nfs/dbraw/zinc/95/85/58/385958558.db2.gz GFCFKUDPXUHKRW-MRXNPFEDSA-N 2 0 242.366 2.053 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]1[NH2+]Cc1ccc2c(c1)CCCN2 ZINC000335013875 385970676 /nfs/dbraw/zinc/97/06/76/385970676.db2.gz CTZKBLUISFXPAZ-ZFWWWQNUSA-N 2 0 245.370 2.014 20 0 BEADRP CCC[C@@H](C)C[NH2+][C@@H]1CC[NH2+]CC1(C)C ZINC000414973973 385999965 /nfs/dbraw/zinc/99/99/65/385999965.db2.gz NGSLSTYQESIHKN-VXGBXAGGSA-N 2 0 212.381 2.400 20 0 BEADRP CCC[C@H](C)C[NH2+][C@H]1CC[NH2+]CC1(C)C ZINC000414973972 386000307 /nfs/dbraw/zinc/00/03/07/386000307.db2.gz NGSLSTYQESIHKN-RYUDHWBXSA-N 2 0 212.381 2.400 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CN(C2CC2)C[C@@H]1C)[C@H]1C[C@@H]1C ZINC000414111180 386005735 /nfs/dbraw/zinc/00/57/35/386005735.db2.gz MDOXRRHTFMQLAO-IXDBCEGASA-N 2 0 236.403 2.493 20 0 BEADRP CCN1CCCC[C@@H]1C[NH2+][C@H](C)[C@H]1C[C@@H]1C ZINC000414111672 386006600 /nfs/dbraw/zinc/00/66/00/386006600.db2.gz JDHQPLQNDFNEKP-DGAVXFQQSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H](Cc1ccc(F)cc1)[NH2+]C[C@H]([NH3+])C1CC1 ZINC000414882584 386016618 /nfs/dbraw/zinc/01/66/18/386016618.db2.gz BYFXOBCWTBOLKS-HZMBPMFUSA-N 2 0 236.334 2.084 20 0 BEADRP C[C@@H]([NH2+]Cc1ccc2c[nH+]cn2c1)[C@H]1C[C@H]1C ZINC000414180582 386023459 /nfs/dbraw/zinc/02/34/59/386023459.db2.gz LFGVWTFHLQPVNK-GYSYKLTISA-N 2 0 229.327 2.468 20 0 BEADRP Cc1nocc1C[NH+]1CCC(c2ncc[nH]2)CC1 ZINC000295397879 386026764 /nfs/dbraw/zinc/02/67/64/386026764.db2.gz QJCMIKCAHPUUOI-UHFFFAOYSA-N 2 0 246.314 2.086 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)[C@H]1C[C@H]1C ZINC000414191451 386029559 /nfs/dbraw/zinc/02/95/59/386029559.db2.gz RYPGHNVLTJJKGS-SYQHCUMBSA-N 2 0 224.392 2.352 20 0 BEADRP C[NH2+]Cc1ccc(NC2CCC(C[NH3+])CC2)cc1 ZINC000414977471 386031617 /nfs/dbraw/zinc/03/16/17/386031617.db2.gz PWDWLOOPQVZEDW-UHFFFAOYSA-N 2 0 247.386 2.335 20 0 BEADRP C[NH2+][C@H]1CCN(c2cc(C)[nH+]c3ccccc32)C1 ZINC000129124074 386031834 /nfs/dbraw/zinc/03/18/34/386031834.db2.gz IOAUEYUPBAHNRG-LBPRGKRZSA-N 2 0 241.338 2.341 20 0 BEADRP C[NH2+]Cc1ccc(N[C@H](C)C[C@H]2CCC[NH2+]2)cc1 ZINC000414978608 386034338 /nfs/dbraw/zinc/03/43/38/386034338.db2.gz SAJKEXRBTKLKLX-IUODEOHRSA-N 2 0 247.386 2.349 20 0 BEADRP C[C@@H](CCc1ccccc1)[NH2+]C[C@@H]([NH3+])C1CC1 ZINC000414883826 386035389 /nfs/dbraw/zinc/03/53/89/386035389.db2.gz DQDWMGNMBRUZMM-SWLSCSKDSA-N 2 0 232.371 2.335 20 0 BEADRP C[C@H](CC[NH3+])[NH2+]C[C@@H](C)Cc1ccccc1 ZINC000414884847 386049077 /nfs/dbraw/zinc/04/90/77/386049077.db2.gz BKLDOASYPOKCKL-QWHCGFSZSA-N 2 0 220.360 2.192 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@H]2CC3CCC2CC3)C1 ZINC000309520703 386051584 /nfs/dbraw/zinc/05/15/84/386051584.db2.gz UBCXZFNSVIPCGJ-LSUUEXMVSA-N 2 0 222.376 2.425 20 0 BEADRP Oc1cccc(C[NH2+]CCC[C@@H]2CCC[NH2+]2)c1 ZINC000414980374 386053336 /nfs/dbraw/zinc/05/33/36/386053336.db2.gz WKMTZPHNMIBMPZ-CYBMUJFWSA-N 2 0 234.343 2.014 20 0 BEADRP F[C@@H]1CCCC[C@H]1[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000414291499 386101891 /nfs/dbraw/zinc/10/18/91/386101891.db2.gz UKOXHEIBSBABER-XJFOESAGSA-N 2 0 240.366 2.484 20 0 BEADRP C[C@@H]([NH3+])[C@H](C)[NH2+]C1CCC2(CCOCC2)CC1 ZINC000335160459 386105420 /nfs/dbraw/zinc/10/54/20/386105420.db2.gz XYDMRPAMZLZWKG-NEPJUHHUSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@@H]([NH3+])C2CC2)[C@H](C)C1 ZINC000414889131 386107300 /nfs/dbraw/zinc/10/73/00/386107300.db2.gz KVQZPCJTPGDDTG-WFFHOREQSA-N 2 0 210.365 2.138 20 0 BEADRP [NH3+][C@H](C[NH2+]CC1CCCCCC1)C1CC1 ZINC000414889398 386112758 /nfs/dbraw/zinc/11/27/58/386112758.db2.gz GKRZDNYJQZARKP-CYBMUJFWSA-N 2 0 210.365 2.284 20 0 BEADRP CCCCN(CC[NH3+])Cc1ccccc1 ZINC000038033230 386114879 /nfs/dbraw/zinc/11/48/79/386114879.db2.gz IHJWTFPSDOUJBO-UHFFFAOYSA-N 2 0 206.333 2.247 20 0 BEADRP CC[C@H]1CC[C@H]1[NH2+]CCC[N@H+](C)C(C)C ZINC000336771829 386061990 /nfs/dbraw/zinc/06/19/90/386061990.db2.gz WZUVBHZLWLONQL-QWHCGFSZSA-N 2 0 212.381 2.495 20 0 BEADRP COc1ccccc1C[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000414982654 386062509 /nfs/dbraw/zinc/06/25/09/386062509.db2.gz YRWXXMSRDPOTGZ-AWEZNQCLSA-N 2 0 248.370 2.317 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCC12CCC2)N(C)C1CC1 ZINC000336728774 386081102 /nfs/dbraw/zinc/08/11/02/386081102.db2.gz CRGKMCVQRDCNEL-DGCLKSJQSA-N 2 0 222.376 2.391 20 0 BEADRP CCc1ccc(CCN2CC[C@@H]([NH2+]C)C2)cc1 ZINC000430602341 386082318 /nfs/dbraw/zinc/08/23/18/386082318.db2.gz GRIRRNWVGQAXSU-OAHLLOKOSA-N 2 0 232.371 2.085 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+]CCN(C)C)[C@H](C)C2 ZINC000286952681 386086826 /nfs/dbraw/zinc/08/68/26/386086826.db2.gz HLQIRHMYPGROQN-IUODEOHRSA-N 2 0 232.371 2.380 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@H](C)CCc1ccsc1 ZINC000414984340 386092070 /nfs/dbraw/zinc/09/20/70/386092070.db2.gz GDMCCDZGPRUZDM-ZYHUDNBSSA-N 2 0 226.389 2.396 20 0 BEADRP [NH3+]C1(C[NH2+][C@H]2CCC[C@H]2C2CC2)CCC1 ZINC000414887754 386095416 /nfs/dbraw/zinc/09/54/16/386095416.db2.gz ZKEQJSVRANXWFS-RYUDHWBXSA-N 2 0 208.349 2.036 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@@H](C)Cc1ccc(Cl)cc1 ZINC000414887746 386095745 /nfs/dbraw/zinc/09/57/45/386095745.db2.gz ZJPKECVKKXZPOP-QWRGUYRKSA-N 2 0 240.778 2.455 20 0 BEADRP COC(C)(C)[C@H](C)[NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000340260983 386147400 /nfs/dbraw/zinc/14/74/00/386147400.db2.gz UDZNQAUVUAVVIO-RWMBFGLXSA-N 2 0 242.407 2.262 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@@H](C)CCc1ccccc1 ZINC000414991459 386154099 /nfs/dbraw/zinc/15/40/99/386154099.db2.gz QEOSIJQXMGQFDR-JSGCOSHPSA-N 2 0 220.360 2.335 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@H](C)CCc1ccccc1 ZINC000414991460 386154284 /nfs/dbraw/zinc/15/42/84/386154284.db2.gz QEOSIJQXMGQFDR-OCCSQVGLSA-N 2 0 220.360 2.335 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000414992441 386155965 /nfs/dbraw/zinc/15/59/65/386155965.db2.gz ROXAHGCGLPFZDX-UTLUCORTSA-N 2 0 238.297 2.434 20 0 BEADRP CC[C@H]([NH3+])C[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC000414994657 386172122 /nfs/dbraw/zinc/17/21/22/386172122.db2.gz VCFXFHDMQJUKFA-IHRRRGAJSA-N 2 0 218.344 2.117 20 0 BEADRP CC(C)Oc1ccccc1C[NH2+]C[C@@H](C)C[NH3+] ZINC000414894354 386173169 /nfs/dbraw/zinc/17/31/69/386173169.db2.gz ZNQPHPDMTCKNMW-LBPRGKRZSA-N 2 0 236.359 2.158 20 0 BEADRP CC(C)N(C)C[C@H](C)[NH2+][C@@H]1CCOC(C)(C)C1 ZINC000310429086 386183993 /nfs/dbraw/zinc/18/39/93/386183993.db2.gz MSKQCNUTWGXNMQ-QWHCGFSZSA-N 2 0 242.407 2.262 20 0 BEADRP COC1CCC([N@H+](C)C[C@@H](N)CC(C)C)CC1 ZINC000414691033 386184780 /nfs/dbraw/zinc/18/47/80/386184780.db2.gz IKFUGRJNFDAAJZ-HSBZDZAISA-N 2 0 242.407 2.249 20 0 BEADRP C[C@@H](CC[NH3+])[NH2+]C/C=C/c1ccccc1 ZINC000414890639 386131935 /nfs/dbraw/zinc/13/19/35/386131935.db2.gz UKQGSOOBOCNTCU-ZCRIDZFUSA-N 2 0 204.317 2.027 20 0 BEADRP [NH3+]CCC[N@@H+]1CCC[C@H]1C1CCCCC1 ZINC000414670292 386133965 /nfs/dbraw/zinc/13/39/65/386133965.db2.gz CWBUKZCFOABMBB-ZDUSSCGKSA-N 2 0 210.365 2.380 20 0 BEADRP C[C@@H](c1ccc(F)cc1)[N@H+](C)C[C@@H]1CC[NH2+]C1 ZINC000647874408 386136242 /nfs/dbraw/zinc/13/62/42/386136242.db2.gz RZFCFJDUKODIBQ-NWDGAFQWSA-N 2 0 236.334 2.428 20 0 BEADRP CCCC[N@H+](CCOC)C[C@H]1CC[NH2+][C@@H](C)C1 ZINC000414701164 386201598 /nfs/dbraw/zinc/20/15/98/386201598.db2.gz UBNVRQYRPRSPKU-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP CC[N@H+](C[C@H]1CC[NH2+][C@H](C)C1)C1CCC1 ZINC000414704293 386213852 /nfs/dbraw/zinc/21/38/52/386213852.db2.gz MVBZBSBYDOSZIV-NEPJUHHUSA-N 2 0 210.365 2.249 20 0 BEADRP COc1ccccc1CNC[C@]1(C)CCC[NH2+]C1 ZINC000414897651 386214980 /nfs/dbraw/zinc/21/49/80/386214980.db2.gz FDWAISWISZGALL-OAHLLOKOSA-N 2 0 248.370 2.175 20 0 BEADRP CCO[C@@H]1C[C@@H]([N@H+](C)CCC[NH3+])C1(CC)CC ZINC000414704071 386215957 /nfs/dbraw/zinc/21/59/57/386215957.db2.gz JEXHXUNDIIFAGS-CHWSQXEVSA-N 2 0 242.407 2.251 20 0 BEADRP C[C@@H]1[C@H](c2ccccc2)CC[N@@H+]1CCC[NH3+] ZINC000414707057 386216135 /nfs/dbraw/zinc/21/61/35/386216135.db2.gz NJOIFMFQZSCKFU-TZMCWYRMSA-N 2 0 218.344 2.213 20 0 BEADRP c1ccc2c(c1)CC[C@@H]2[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000132015808 386218883 /nfs/dbraw/zinc/21/88/83/386218883.db2.gz PENMQFUCTYRLGJ-DOMZBBRYSA-N 2 0 230.355 2.263 20 0 BEADRP CC[C@H](C[N@@H+]1CC[C@@H](C[NH3+])C1)c1ccccc1 ZINC000347028711 386221277 /nfs/dbraw/zinc/22/12/77/386221277.db2.gz VWDBSXWWFHBUOT-UONOGXRCSA-N 2 0 232.371 2.461 20 0 BEADRP Cc1ccsc1CN(C1CC1)[C@H]1CC[NH2+]C1 ZINC000347141566 386260039 /nfs/dbraw/zinc/26/00/39/386260039.db2.gz WQUZORJTEUDBAQ-LBPRGKRZSA-N 2 0 236.384 2.383 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CCC[NH2+]C1)c1cccc(O)c1 ZINC000132168140 386226181 /nfs/dbraw/zinc/22/61/81/386226181.db2.gz DKXHJSHHDLEMAY-NEPJUHHUSA-N 2 0 234.343 2.042 20 0 BEADRP COc1ccccc1/C=C\CN1CCC[C@H]1C[NH3+] ZINC000347040201 386227168 /nfs/dbraw/zinc/22/71/68/386227168.db2.gz HSPLWJNTIPZGIJ-ZBKLQPJUSA-N 2 0 246.354 2.132 20 0 BEADRP C(C[C@H]1CCC[NH2+]1)[NH2+][C@H]1CCC[C@@H]1C1CC1 ZINC000414898991 386239410 /nfs/dbraw/zinc/23/94/10/386239410.db2.gz BPIFSDQZXGIONK-MCIONIFRSA-N 2 0 222.376 2.297 20 0 BEADRP CCCCC[N@@H+]1C[C@@H]2CCC[C@H]([NH3+])[C@@H]2C1 ZINC000125344994 386250123 /nfs/dbraw/zinc/25/01/23/386250123.db2.gz AGNNIWCLQKYANJ-XQQFMLRXSA-N 2 0 210.365 2.236 20 0 BEADRP COc1cccc(C[NH2+]C[C@H]2CCC[C@H]([NH3+])C2)c1 ZINC000415003490 386253810 /nfs/dbraw/zinc/25/38/10/386253810.db2.gz XICNRPCTZUFEDC-JSGCOSHPSA-N 2 0 248.370 2.302 20 0 BEADRP CC[N@H+](CCn1ccnc1C)C1CCC1 ZINC000336649092 386261337 /nfs/dbraw/zinc/26/13/37/386261337.db2.gz QHUAVTMGGFZVNO-UHFFFAOYSA-N 2 0 207.321 2.066 20 0 BEADRP CCC[N@H+](CCC[NH3+])[C@H]1C[C@@H](OCC)C1(C)C ZINC000414693092 386192707 /nfs/dbraw/zinc/19/27/07/386192707.db2.gz DLNHAMLHEMFOJN-QWHCGFSZSA-N 2 0 242.407 2.251 20 0 BEADRP CC(C)[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]([NH3+])C1CC1 ZINC000414895683 386193360 /nfs/dbraw/zinc/19/33/60/386193360.db2.gz YORFMDNICIFGOB-XQQFMLRXSA-N 2 0 210.365 2.138 20 0 BEADRP CCCCO[C@H]1C[C@H]([N@H+](C)CCC[NH3+])C1(C)C ZINC000414696044 386195656 /nfs/dbraw/zinc/19/56/56/386195656.db2.gz AULASGGQKUCTAW-STQMWFEESA-N 2 0 242.407 2.251 20 0 BEADRP COCC1(C[NH2+]CCC[N@H+](C)C(C)C)CCC1 ZINC000310535689 386195800 /nfs/dbraw/zinc/19/58/00/386195800.db2.gz RDFQQUAPUWSGIO-UHFFFAOYSA-N 2 0 242.407 2.123 20 0 BEADRP Cc1ccccc1C[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000414896046 386196436 /nfs/dbraw/zinc/19/64/36/386196436.db2.gz AVPUQAGBEPSLMG-OAHLLOKOSA-N 2 0 232.371 2.474 20 0 BEADRP CCC[C@H](C)[N@H+](C)CCc1cncn1C ZINC000297877342 386284173 /nfs/dbraw/zinc/28/41/73/386284173.db2.gz QFHLKVWAWJCKBZ-NSHDSACASA-N 2 0 209.337 2.083 20 0 BEADRP Cc1ccc(C[C@@H](C)[N@H+](C)C[C@H]2CC[NH2+]C2)cc1 ZINC000647886092 386294180 /nfs/dbraw/zinc/29/41/80/386294180.db2.gz PZSZCUFLZUATQV-ZBFHGGJFSA-N 2 0 246.398 2.467 20 0 BEADRP C[C@@H]1C[C@H](c2ccccc2)C[N@@H+]1C[C@H]1CC[NH2+]C1 ZINC000647885885 386297108 /nfs/dbraw/zinc/29/71/08/386297108.db2.gz DRFTWKROMNKOCK-YCPHGPKFSA-N 2 0 244.382 2.474 20 0 BEADRP CCn1cncc1CNc1cccc(C)n1 ZINC000416425913 386301252 /nfs/dbraw/zinc/30/12/52/386301252.db2.gz KBWORNQWJQAXAN-UHFFFAOYSA-N 2 0 216.288 2.219 20 0 BEADRP Cc1ccncc1C[N@@H+](C)C[C@H]1CC[NH2+][C@@H](C)C1 ZINC000414738289 386316272 /nfs/dbraw/zinc/31/62/72/386316272.db2.gz JAWYYYCAMWOYLV-KBPBESRZSA-N 2 0 247.386 2.210 20 0 BEADRP C[C@@H](C1CCCCC1)[N@H+](C)C[C@H]1CC[NH2+]C1 ZINC000647988777 386319625 /nfs/dbraw/zinc/31/96/25/386319625.db2.gz KSPAVCSDHUAPEM-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP C(=C\c1ccccc1)\C[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000414902406 386320184 /nfs/dbraw/zinc/32/01/84/386320184.db2.gz HYRATPWPVRECBC-UFRMUOTOSA-N 2 0 230.355 2.432 20 0 BEADRP CC1(C[NH2+]Cc2cccc(F)c2)CC[NH2+]CC1 ZINC000414900306 386268306 /nfs/dbraw/zinc/26/83/06/386268306.db2.gz GXWBUBNRCOBHSQ-UHFFFAOYSA-N 2 0 236.334 2.305 20 0 BEADRP C[C@@H]([NH2+]Cc1ccc2c[nH+]cn2c1)C1CC1 ZINC000297637013 386269033 /nfs/dbraw/zinc/26/90/33/386269033.db2.gz XBMVYMAWGPTLLI-SNVBAGLBSA-N 2 0 215.300 2.222 20 0 BEADRP C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@@H+]1C[C@@H]1CC[NH2+]C1 ZINC000647884994 386270697 /nfs/dbraw/zinc/27/06/97/386270697.db2.gz VJZIPQPXLXQQED-MQYQWHSLSA-N 2 0 222.376 2.249 20 0 BEADRP CC[NH+](CC)CC1CC[NH+](CCSC)CC1 ZINC000336685673 386343982 /nfs/dbraw/zinc/34/39/82/386343982.db2.gz VLYKONIWAMSGQG-UHFFFAOYSA-N 2 0 244.448 2.403 20 0 BEADRP CC(C)CCC[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000414905081 386351846 /nfs/dbraw/zinc/35/18/46/386351846.db2.gz LDMIPIYPHBPNHK-ZDUSSCGKSA-N 2 0 212.381 2.402 20 0 BEADRP CC(C)CCC[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000414905080 386351953 /nfs/dbraw/zinc/35/19/53/386351953.db2.gz LDMIPIYPHBPNHK-CYBMUJFWSA-N 2 0 212.381 2.402 20 0 BEADRP C[C@@H]([NH3+])[C@@H](C)[NH2+]CCSCc1ccccc1 ZINC000415007420 386359738 /nfs/dbraw/zinc/35/97/38/386359738.db2.gz CSEGCGISVAZURS-VXGBXAGGSA-N 2 0 238.400 2.245 20 0 BEADRP C[C@@H]([NH2+]CCSCc1ccccc1)[C@H](C)[NH3+] ZINC000415007414 386360651 /nfs/dbraw/zinc/36/06/51/386360651.db2.gz CSEGCGISVAZURS-NWDGAFQWSA-N 2 0 238.400 2.245 20 0 BEADRP C[C@]1(C[NH2+]Cc2cccc(F)c2)CCC[NH2+]C1 ZINC000414906002 386368355 /nfs/dbraw/zinc/36/83/55/386368355.db2.gz PLEGWOBFWAQKHW-AWEZNQCLSA-N 2 0 236.334 2.305 20 0 BEADRP CC[N@H+](C)C[C@@H]1CC[NH+](CCC2CC2)C1 ZINC000336696119 386373957 /nfs/dbraw/zinc/37/39/57/386373957.db2.gz IHIWISKNEILLDL-ZDUSSCGKSA-N 2 0 210.365 2.060 20 0 BEADRP C[C@@H]([NH3+])[C@@H](C)[NH2+][C@H](C)CCc1cccc(F)c1 ZINC000415006384 386325806 /nfs/dbraw/zinc/32/58/06/386325806.db2.gz BIRQPBREOHWHCB-IJLUTSLNSA-N 2 0 238.350 2.472 20 0 BEADRP Cc1ccc(F)cc1C[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000414903470 386334784 /nfs/dbraw/zinc/33/47/84/386334784.db2.gz JXMIANZIXPYTQB-CQSZACIVSA-N 2 0 236.334 2.366 20 0 BEADRP CC(C)CC[N@@H+]1CC2(C[C@H]1C)CC[NH2+]CC2 ZINC000335275901 386336336 /nfs/dbraw/zinc/33/63/36/386336336.db2.gz BCEJLUOANBYPCP-CYBMUJFWSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CC1CC(F)(F)C1 ZINC000394812870 386442749 /nfs/dbraw/zinc/44/27/49/386442749.db2.gz PJHHQYXAMOUKKE-VIFPVBQESA-N 2 0 220.307 2.139 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H]([NH+](C)C)C2)[C@H]1C ZINC000336776736 386398958 /nfs/dbraw/zinc/39/89/58/386398958.db2.gz GMLPXUPROGSJBO-ITGHMWBKSA-N 2 0 224.392 2.493 20 0 BEADRP Cc1ccncc1CCC[N@H+]1CCO[C@@H](C)[C@@H]1C ZINC000290188111 386404560 /nfs/dbraw/zinc/40/45/60/386404560.db2.gz ZUAUTFSJRMXLRS-KBPBESRZSA-N 2 0 248.370 2.432 20 0 BEADRP CC[NH+](CC)CC1CC[NH+](CC2CC2)CC1 ZINC000336702323 386405399 /nfs/dbraw/zinc/40/53/99/386405399.db2.gz NCWLQORUDKEYBC-UHFFFAOYSA-N 2 0 224.392 2.450 20 0 BEADRP CCOC1CC([N@H+](C)CCC[NH+](CC)CC)C1 ZINC000347443672 386406489 /nfs/dbraw/zinc/40/64/89/386406489.db2.gz GBVRFDCYVJMZRD-UHFFFAOYSA-N 2 0 242.407 2.218 20 0 BEADRP C[C@H](C[C@H]1CCCCC[NH2+]1)[NH2+]C[C@@H]1CCCO1 ZINC000093496302 386415548 /nfs/dbraw/zinc/41/55/48/386415548.db2.gz BOFCXGWBJPMSTJ-MCIONIFRSA-N 2 0 240.391 2.066 20 0 BEADRP CCSCC[N@@H+]1CC[C@@]2(C1)CCC[NH+](C)C2 ZINC000339434377 386425260 /nfs/dbraw/zinc/42/52/60/386425260.db2.gz JYSWUILMXVVVOE-ZDUSSCGKSA-N 2 0 242.432 2.157 20 0 BEADRP Cc1ccc(CNC2C[C@H]3CC[C@@H](C2)[N@H+]3C)nc1 ZINC000322822191 386469307 /nfs/dbraw/zinc/46/93/07/386469307.db2.gz CSBKHTIBPBMXSY-GOOCMWNKSA-N 2 0 245.370 2.105 20 0 BEADRP Cc1cc(CNC2CC[NH+](C(C)C)CC2)ccn1 ZINC000391190779 386474221 /nfs/dbraw/zinc/47/42/21/386474221.db2.gz ODAVBIMQFVOASE-UHFFFAOYSA-N 2 0 247.386 2.352 20 0 BEADRP CC[C@@H]1C[N@H+](CCCc2ccncc2)CC[C@@H]1[NH3+] ZINC000647934482 386479453 /nfs/dbraw/zinc/47/94/53/386479453.db2.gz GXQUJUQYYXROGD-CABCVRRESA-N 2 0 247.386 2.073 20 0 BEADRP [NH3+]CCCC[NH2+]Cc1cc2cc(F)ccc2o1 ZINC000414912906 386479960 /nfs/dbraw/zinc/47/99/60/386479960.db2.gz VGBPTVISYPYWET-UHFFFAOYSA-N 2 0 236.290 2.400 20 0 BEADRP CCc1cc(OC)ccc1C[N@H+](C)C1CC([NH3+])C1 ZINC000414779458 386491195 /nfs/dbraw/zinc/49/11/95/386491195.db2.gz REWLZBBTSOFAIO-UHFFFAOYSA-N 2 0 248.370 2.179 20 0 BEADRP C[C@@H]([NH3+])[C@H](C)[NH2+][C@H](C)CCc1ccsc1 ZINC000415013200 386495311 /nfs/dbraw/zinc/49/53/11/386495311.db2.gz KNZHREREWXJIOY-MXWKQRLJSA-N 2 0 226.389 2.395 20 0 BEADRP CC(C)CCC[N@@H+]1CCC[C@@H]([C@@H](C)[NH3+])C1 ZINC000165030623 386496159 /nfs/dbraw/zinc/49/61/59/386496159.db2.gz AVYBVBKYXPLCCL-CHWSQXEVSA-N 2 0 212.381 2.482 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000415014760 386499541 /nfs/dbraw/zinc/49/95/41/386499541.db2.gz XKAYHQJUDBUKIV-VZZFWQQMSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]1CCC[C@H]1[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000415014761 386500575 /nfs/dbraw/zinc/50/05/75/386500575.db2.gz XKAYHQJUDBUKIV-YXCITZCRSA-N 2 0 222.376 2.153 20 0 BEADRP COc1ccccc1/C=C/C[NH2+][C@H](C)CCC[NH3+] ZINC000415016851 386503690 /nfs/dbraw/zinc/50/36/90/386503690.db2.gz DHHMPVWNVJOTOB-YSKGHYERSA-N 2 0 248.370 2.425 20 0 BEADRP CC[C@H](C)C[C@H](CC)[NH2+]C[C@@H]1C[NH2+]CCCO1 ZINC000415049418 386505151 /nfs/dbraw/zinc/50/51/51/386505151.db2.gz YCAOZBGDADRHLD-IHRRRGAJSA-N 2 0 242.407 2.169 20 0 BEADRP CC[C@H](C[C@@H](C)CC)[NH2+]C[C@@H]1C[NH2+]CCCO1 ZINC000415049423 386505963 /nfs/dbraw/zinc/50/59/63/386505963.db2.gz YCAOZBGDADRHLD-MJBXVCDLSA-N 2 0 242.407 2.169 20 0 BEADRP CCc1ccc(C[NH2+][C@H]2CC[C@H](C[NH3+])C2)cc1 ZINC000415049235 386506642 /nfs/dbraw/zinc/50/66/42/386506642.db2.gz XNTVGWABNVVLRS-GJZGRUSLSA-N 2 0 232.371 2.466 20 0 BEADRP CC[C@H](C)C[C@H](CC)[NH2+]C[C@H]1C[NH2+]CCCO1 ZINC000415049421 386506948 /nfs/dbraw/zinc/50/69/48/386506948.db2.gz YCAOZBGDADRHLD-MELADBBJSA-N 2 0 242.407 2.169 20 0 BEADRP [NH3+]C[C@H]1CC[C@H]([NH2+]Cc2ccccc2F)C1 ZINC000415051267 386508867 /nfs/dbraw/zinc/50/88/67/386508867.db2.gz ZBMPASYBZOVWRS-JQWIXIFHSA-N 2 0 222.307 2.043 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]Cc1cc(F)c(F)c(F)c1 ZINC000415021197 386511221 /nfs/dbraw/zinc/51/12/21/386511221.db2.gz KCGKVVGZMUYSBA-QMMMGPOBSA-N 2 0 246.276 2.321 20 0 BEADRP CCC(CC)(CC)C[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000415021105 386511662 /nfs/dbraw/zinc/51/16/62/386511662.db2.gz BOBVMPUXKGSRGD-GDNZZTSVSA-N 2 0 210.365 2.010 20 0 BEADRP COc1ccc(C[NH2+][C@@H](C)CCC[NH3+])cc1F ZINC000415025071 386514637 /nfs/dbraw/zinc/51/46/37/386514637.db2.gz QDBMZXXBUXNBQZ-JTQLQIEISA-N 2 0 240.322 2.051 20 0 BEADRP CCOc1ccc(C[NH2+][C@H]2CC[C@H](C[NH3+])C2)cc1 ZINC000415029942 386515995 /nfs/dbraw/zinc/51/59/95/386515995.db2.gz FDSBXTXJIAMHHE-KBPBESRZSA-N 2 0 248.370 2.302 20 0 BEADRP CCC(C)(C)[C@H](C)[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000519643952 386516147 /nfs/dbraw/zinc/51/61/47/386516147.db2.gz WHVUNHNLEUTACD-NWDGAFQWSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]Cc1ncc(Cl)s1 ZINC000415027054 386516830 /nfs/dbraw/zinc/51/68/30/386516830.db2.gz VTTREVJLSRYJSS-ZETCQYMHSA-N 2 0 233.768 2.014 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CC[C@@H](C[NH3+])C2)cc1F ZINC000415028143 386516930 /nfs/dbraw/zinc/51/69/30/386516930.db2.gz CGZCFQFTWIHHGM-YPMHNXCESA-N 2 0 236.334 2.351 20 0 BEADRP C[N@H+](CCC1CC[NH2+]CC1)CC1CCC1 ZINC000061482963 386517796 /nfs/dbraw/zinc/51/77/96/386517796.db2.gz RUDLECZIYVRORI-UHFFFAOYSA-N 2 0 210.365 2.108 20 0 BEADRP CCOc1cccc(C[NH2+][C@@H]2CC[C@@H](C[NH3+])C2)c1 ZINC000415039875 386526337 /nfs/dbraw/zinc/52/63/37/386526337.db2.gz OMDFRQXKJLKIMT-TZMCWYRMSA-N 2 0 248.370 2.302 20 0 BEADRP CC1(C)CCC(C[NH2+][C@@H]2[C@H]3C[NH2+]C[C@H]32)CC1 ZINC000415039226 386526649 /nfs/dbraw/zinc/52/66/49/386526649.db2.gz OVQJJMVPOGRLBL-ITGUQSILSA-N 2 0 222.376 2.010 20 0 BEADRP C[C@H](C[C@@H]1CCC[NH2+]1)Nc1ccc(C[NH3+])cc1 ZINC000414916348 386527004 /nfs/dbraw/zinc/52/70/04/386527004.db2.gz SKKFCNYESAQTDL-RISCZKNCSA-N 2 0 233.359 2.088 20 0 BEADRP c1c(CCNc2ccccn2)nc2n1CCCC2 ZINC000134887301 386454678 /nfs/dbraw/zinc/45/46/78/386454678.db2.gz KTNABGKHHOCHGZ-UHFFFAOYSA-N 2 0 242.326 2.269 20 0 BEADRP Cc1ccc([C@H](C)[NH2+]C[C@@H](C)C[NH3+])s1 ZINC000308604109 386575824 /nfs/dbraw/zinc/57/58/24/386575824.db2.gz GKCUCTZWOLDXQK-WPRPVWTQSA-N 2 0 212.362 2.302 20 0 BEADRP CCCc1cccc(CN[C@@H](C[NH3+])C2CC2)c1 ZINC000414799044 386576151 /nfs/dbraw/zinc/57/61/51/386576151.db2.gz DCBJVRSPWVFNIN-HNNXBMFYSA-N 2 0 232.371 2.466 20 0 BEADRP C[C@H](CC1CC1)[NH2+]C1CCC(C[NH3+])CC1 ZINC000415076487 386580749 /nfs/dbraw/zinc/58/07/49/386580749.db2.gz COCLSGSRAKTWMS-QFWMXSHPSA-N 2 0 210.365 2.282 20 0 BEADRP c1ccc2c(c1)CC[C@@H]2C[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000415081647 386590605 /nfs/dbraw/zinc/59/06/05/386590605.db2.gz NBSFGMNTRZANOQ-DZGCQCFKSA-N 2 0 244.382 2.306 20 0 BEADRP C[C@H](CC1CC1)[NH2+]C[C@@H]1CC[NH2+][C@@H](C)C1 ZINC000415079568 386591361 /nfs/dbraw/zinc/59/13/61/386591361.db2.gz IJAMIRMEINRIHV-DMDPSCGWSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)([NH3+])C[NH2+]C[C@@H]1CCCO[C@H]1C(C)(C)C ZINC000415084742 386598777 /nfs/dbraw/zinc/59/87/77/386598777.db2.gz PNCBBBHKEVRXED-NWDGAFQWSA-N 2 0 242.407 2.155 20 0 BEADRP CCCC[N@@H+]1C[C@@H](C[NH3+])[C@@H](c2ccccc2)C1 ZINC000337043374 386592846 /nfs/dbraw/zinc/59/28/46/386592846.db2.gz CVEFKETZJLARFP-HUUCEWRRSA-N 2 0 232.371 2.461 20 0 BEADRP Cc1nocc1C[NH+]1CCC(c2c[nH]cn2)CC1 ZINC000329013270 386596175 /nfs/dbraw/zinc/59/61/75/386596175.db2.gz PGBAKYZPYGBYSB-UHFFFAOYSA-N 2 0 246.314 2.086 20 0 BEADRP [NH3+]C[C@@H]1CC[C@H]([NH2+]Cc2ncc(Cl)s2)C1 ZINC000415045504 386531498 /nfs/dbraw/zinc/53/14/98/386531498.db2.gz UDKVTEREIJTVBJ-SFYZADRCSA-N 2 0 245.779 2.014 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1 ZINC000414789072 386536968 /nfs/dbraw/zinc/53/69/68/386536968.db2.gz XUFANYGWCGZELO-MJBXVCDLSA-N 2 0 224.392 2.354 20 0 BEADRP CC[C@@H]1C[C@@H](C[NH2+][C@H](CN)C(C)(C)C)CCO1 ZINC000415056046 386538480 /nfs/dbraw/zinc/53/84/80/386538480.db2.gz PDXNFQBDIMHKJM-YNEHKIRRSA-N 2 0 242.407 2.155 20 0 BEADRP CC[C@@]1(C)CC[N@H+](CC[C@@H]2CCC[NH2+]C2)C1 ZINC000399386456 386540699 /nfs/dbraw/zinc/54/06/99/386540699.db2.gz RIUVNBMEEYTJOP-KBPBESRZSA-N 2 0 224.392 2.498 20 0 BEADRP C([NH2+][C@@H]1CCCC12CCCCC2)C1C[NH2+]C1 ZINC000335462703 386544621 /nfs/dbraw/zinc/54/46/21/386544621.db2.gz UAGMGMZKFOJCBD-CYBMUJFWSA-N 2 0 222.376 2.298 20 0 BEADRP c1ncn2c1C[N@H+](C[C@@H]1CC=CCC1)CC2 ZINC000291436663 386546000 /nfs/dbraw/zinc/54/60/00/386546000.db2.gz BPCIARGWEQETSZ-GFCCVEGCSA-N 2 0 217.316 2.055 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CC2C[NH2+]C2)c2ccccc21 ZINC000335463623 386547607 /nfs/dbraw/zinc/54/76/07/386547607.db2.gz YYPIXXDAUAPPGT-QMTHXVAHSA-N 2 0 216.328 2.044 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+]CC2C[NH2+]C2)c2sccc21 ZINC000335463605 386548484 /nfs/dbraw/zinc/54/84/84/386548484.db2.gz YSOLHXNEMFQVFA-JOYOIKCWSA-N 2 0 236.384 2.496 20 0 BEADRP COC[C@H](CC(C)C)[NH2+][C@@H]1CCCC[C@@H]1C[NH3+] ZINC000414791611 386548730 /nfs/dbraw/zinc/54/87/30/386548730.db2.gz BPJPLTVQZCNKAW-HZSPNIEDSA-N 2 0 242.407 2.155 20 0 BEADRP Cc1ccc(CCC[NH2+][C@@H]2CCCC[NH2+]C2)cn1 ZINC000415068425 386552056 /nfs/dbraw/zinc/55/20/56/386552056.db2.gz DYISRMXHEAFVGM-OAHLLOKOSA-N 3 0 247.386 2.054 20 0 BEADRP COc1ccc(C)cc1C[NH2+][C@@H]1CCC[C@H]1C[NH3+] ZINC000414791206 386553494 /nfs/dbraw/zinc/55/34/94/386553494.db2.gz HIZFUVVBXZUNDU-GXTWGEPZSA-N 2 0 248.370 2.221 20 0 BEADRP CC(C)CC[C@H](C)[NH2+]C[C@@H]([NH3+])C(C)C ZINC000414791275 386554973 /nfs/dbraw/zinc/55/49/73/386554973.db2.gz HMYMTISQZDSKPF-NWDGAFQWSA-N 2 0 200.370 2.384 20 0 BEADRP CC(C)CC[C@H](C)[NH2+]C[C@H]([NH3+])C(C)C ZINC000414791277 386555419 /nfs/dbraw/zinc/55/54/19/386555419.db2.gz HMYMTISQZDSKPF-RYUDHWBXSA-N 2 0 200.370 2.384 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@@H]1CCC[C@H]1C1CC1 ZINC000414793343 386563814 /nfs/dbraw/zinc/56/38/14/386563814.db2.gz KGTVFSUEVOIZQV-YNEHKIRRSA-N 2 0 210.365 2.138 20 0 BEADRP C[NH2+]CCC[NH2+]C1(c2cccc(F)c2)CCC1 ZINC000647996254 386570763 /nfs/dbraw/zinc/57/07/63/386570763.db2.gz DNYRDMOYXMPGQO-UHFFFAOYSA-N 2 0 236.334 2.404 20 0 BEADRP C(C1CCC1)[N@@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000647976491 386571457 /nfs/dbraw/zinc/57/14/57/386571457.db2.gz PMUQGZKWINISHH-HUUCEWRRSA-N 2 0 236.403 2.498 20 0 BEADRP COCc1ccc(C[NH2+][C@@H]2CCC[C@H]2C[NH3+])cc1 ZINC000414795563 386573030 /nfs/dbraw/zinc/57/30/30/386573030.db2.gz MYOITAUEVJOTMQ-LSDHHAIUSA-N 2 0 248.370 2.050 20 0 BEADRP C[C@H](C[C@H]1CCC[NH2+]1)[NH2+][C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000415111123 386619310 /nfs/dbraw/zinc/61/93/10/386619310.db2.gz OHQWBDTXVXHCGJ-XGFWRYKXSA-N 2 0 222.376 2.295 20 0 BEADRP CC(C)[C@H](Cc1ccc(F)cc1)[NH2+]CCC[NH3+] ZINC000415113141 386622016 /nfs/dbraw/zinc/62/20/16/386622016.db2.gz SMWJNVYDPZNWPQ-AWEZNQCLSA-N 2 0 238.350 2.331 20 0 BEADRP CC[N@H+](C[C@@]1(C)CC[NH2+]C1)C1CC(C)(C)C1 ZINC000415122794 386627164 /nfs/dbraw/zinc/62/71/64/386627164.db2.gz LXMXBHBWZCVSPK-AWEZNQCLSA-N 2 0 224.392 2.497 20 0 BEADRP CC1(C)CCCC[C@@H]1[NH2+]CC1=CC[NH2+]CC1 ZINC000335502043 386630294 /nfs/dbraw/zinc/63/02/94/386630294.db2.gz UGPYLEHTQUWZEQ-ZDUSSCGKSA-N 2 0 222.376 2.465 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@H]([NH3+])[C@H](C)C2)cc1 ZINC000049708876 386637181 /nfs/dbraw/zinc/63/71/81/386637181.db2.gz PYOLQBREACEXHT-OCCSQVGLSA-N 2 0 218.344 2.164 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]C[C@@H]2CC23CC3)[C@@H](C)C1 ZINC000417372116 386642994 /nfs/dbraw/zinc/64/29/94/386642994.db2.gz WNMBSRCMFOYHCV-AVGNSLFASA-N 2 0 222.376 2.106 20 0 BEADRP CC(C)C[C@H](C)C[NH+]1C[C@@H]2C[NH+](C)C[C@H]2C1 ZINC000337200562 386648278 /nfs/dbraw/zinc/64/82/78/386648278.db2.gz FHROTHHTNXIBRX-IHRRRGAJSA-N 2 0 224.392 2.162 20 0 BEADRP CC(C)Oc1ccccc1CNCC(C)(C)[NH3+] ZINC000414803677 386599742 /nfs/dbraw/zinc/59/97/42/386599742.db2.gz MLVNTAPSZLRTEU-UHFFFAOYSA-N 2 0 236.359 2.301 20 0 BEADRP CC(C)([NH3+])CNCc1ccc(OCC2CC2)cc1 ZINC000414803647 386600689 /nfs/dbraw/zinc/60/06/89/386600689.db2.gz MGOFVCSRNRUSHM-UHFFFAOYSA-N 2 0 248.370 2.302 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@@H](C)CCC(F)(F)F ZINC000414803859 386606786 /nfs/dbraw/zinc/60/67/86/386606786.db2.gz WYAKXFVDUZSYTR-DTWKUNHWSA-N 2 0 226.286 2.290 20 0 BEADRP Cc1ccccc1C[NH2+]C[C@]1(C)CC[NH2+]C1 ZINC000415091825 386611626 /nfs/dbraw/zinc/61/16/26/386611626.db2.gz RDYLAOXKPMMOTR-CQSZACIVSA-N 2 0 218.344 2.084 20 0 BEADRP COC1CCC([NH2+][C@H]2CCCC[C@H]2C[NH3+])CC1 ZINC000414805363 386611691 /nfs/dbraw/zinc/61/16/91/386611691.db2.gz POZSNNNWDOPWOB-ABXWRUBCSA-N 2 0 240.391 2.051 20 0 BEADRP [NH3+]C[C@@H](NC/C=C/c1ccc(F)cc1)C1CC1 ZINC000414807924 386612755 /nfs/dbraw/zinc/61/27/55/386612755.db2.gz RTSPXHBBRLXOIZ-VSZDKKFSSA-N 2 0 234.318 2.166 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H](C)c1ccc(F)cc1F ZINC000336645453 386613331 /nfs/dbraw/zinc/61/33/31/386613331.db2.gz ATNHTQDELNXYOK-RKDXNWHRSA-N 2 0 228.286 2.210 20 0 BEADRP CC(C)([NH3+])C[NH2+][C@@H]1C[C@@H]1C1CCCCC1 ZINC000415108053 386617191 /nfs/dbraw/zinc/61/71/91/386617191.db2.gz ONZJMJUVTPYVLH-VXGBXAGGSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@]1(C[NH2+]CC2CCCCC2)CC[NH2+]C1 ZINC000415098527 386617917 /nfs/dbraw/zinc/61/79/17/386617917.db2.gz FMFLZNMIVYORQE-CYBMUJFWSA-N 2 0 210.365 2.156 20 0 BEADRP CC1(C)CC[NH+](CCn2ccnc2)CC1 ZINC000335521462 386660812 /nfs/dbraw/zinc/66/08/12/386660812.db2.gz YAHNOLBAEJGGLL-UHFFFAOYSA-N 2 0 207.321 2.005 20 0 BEADRP CN(C)c1ccccc1C[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000414927722 386709827 /nfs/dbraw/zinc/70/98/27/386709827.db2.gz PGOGHSIOPQRAEY-UONOGXRCSA-N 2 0 247.386 2.112 20 0 BEADRP C[C@@H](C[NH2+]C[C@H]1CCC[NH2+]C1)Cc1ccccc1 ZINC000414831009 386711208 /nfs/dbraw/zinc/71/12/08/386711208.db2.gz PBRBLCAFMCIHOU-ZBFHGGJFSA-N 2 0 246.398 2.454 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CC[C@@H]2CC[NH2+]C2)C[C@@H]1C ZINC000414824538 386683117 /nfs/dbraw/zinc/68/31/17/386683117.db2.gz AUVWIUYUHOVFCD-RFGFWPKPSA-N 2 0 224.392 2.400 20 0 BEADRP Fc1ccc(/C=C/C[NH2+]C[C@@H]2CCC[NH2+]C2)cc1 ZINC000414826930 386688840 /nfs/dbraw/zinc/68/88/40/386688840.db2.gz KASMKRLUWOIBMC-YOUVMVQBSA-N 2 0 248.345 2.428 20 0 BEADRP C[NH2+]CCC[N@H+](C)C[C@H]1CCCC[C@@H]1C ZINC000394834717 386691697 /nfs/dbraw/zinc/69/16/97/386691697.db2.gz QDKDOBKEPNTEEC-QWHCGFSZSA-N 2 0 212.381 2.354 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]CC[C@@H]2CC[NH2+]C2)C1 ZINC000414827900 386694929 /nfs/dbraw/zinc/69/49/29/386694929.db2.gz IBMAHNPPLUQSHK-FRRDWIJNSA-N 2 0 210.365 2.154 20 0 BEADRP CCC[C@@H](CC)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000414827420 386695646 /nfs/dbraw/zinc/69/56/46/386695646.db2.gz KQLVJQJMRNIQEA-FKJOKYEKSA-N 2 0 210.365 2.438 20 0 BEADRP C[C@@H]1CCC[C@H](C[NH2+]CC[C@@H]2CC[NH2+]C2)C1 ZINC000414827593 386695702 /nfs/dbraw/zinc/69/57/02/386695702.db2.gz HJPQBBDRQOITIM-RDBSUJKOSA-N 2 0 224.392 2.402 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H]1CCC[C@H]1C(C)C ZINC000414833681 386712517 /nfs/dbraw/zinc/71/25/17/386712517.db2.gz GQACPMYDYDOSFD-AVGNSLFASA-N 2 0 212.381 2.256 20 0 BEADRP C[C@H](CCCC(F)(F)F)[NH2+]CC[C@H](C)[NH3+] ZINC000414828146 386698469 /nfs/dbraw/zinc/69/84/69/386698469.db2.gz ZAYZKKFPVBQLQX-DTWKUNHWSA-N 2 0 226.286 2.434 20 0 BEADRP CC[C@@H](C)C[NH+]1CCC([C@H]2CC[NH2+]C2)CC1 ZINC000357047069 386699438 /nfs/dbraw/zinc/69/94/38/386699438.db2.gz IYVLSRPQBPLEQL-OCCSQVGLSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@H]([NH2+]CCCC[NH+](C)C)C(C)(C)C ZINC000336648947 386702207 /nfs/dbraw/zinc/70/22/07/386702207.db2.gz HBOZXOVKKWBYNZ-NSHDSACASA-N 2 0 200.370 2.352 20 0 BEADRP Cc1cc(C)cc(C[NH2+]C[C@H]2CCC[NH2+]C2)c1 ZINC000414827284 386704081 /nfs/dbraw/zinc/70/40/81/386704081.db2.gz KHEPPLKBZVRMPR-AWEZNQCLSA-N 2 0 232.371 2.393 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CC[C@@H]2CC[NH2+]C2)[C@@H](C)C1 ZINC000414830466 386706192 /nfs/dbraw/zinc/70/61/92/386706192.db2.gz MDEAZQYETZAVPH-RFGFWPKPSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CC[C@@H]2CC[NH2+]C2)[C@H](C)C1 ZINC000414830463 386706380 /nfs/dbraw/zinc/70/63/80/386706380.db2.gz MDEAZQYETZAVPH-MQYQWHSLSA-N 2 0 224.392 2.400 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]C/C=C\c1ccccc1 ZINC000414830755 386708855 /nfs/dbraw/zinc/70/88/55/386708855.db2.gz CKGODURFDLENPY-OYVUYXNMSA-N 2 0 218.344 2.145 20 0 BEADRP CNCC[NH2+]C[C@@H](C)CCc1ccccc1 ZINC000414836822 386730628 /nfs/dbraw/zinc/73/06/28/386730628.db2.gz WLQXXSOTXFBUNL-ZDUSSCGKSA-N 2 0 220.360 2.064 20 0 BEADRP COC[C@H](CC(C)C)[NH2+][C@@H](CN)CC(C)C ZINC000414836710 386731903 /nfs/dbraw/zinc/73/19/03/386731903.db2.gz IXIFYKWKYDTXIB-OLZOCXBDSA-N 2 0 230.396 2.011 20 0 BEADRP Cc1c[nH+]ccc1NC1CC([NH+]2CCCCC2)C1 ZINC000335536695 386739165 /nfs/dbraw/zinc/73/91/65/386739165.db2.gz MQEAOLMDCTXELF-UHFFFAOYSA-N 2 0 245.370 2.241 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]Cc1ccc(Cl)cc1 ZINC000414833740 386713452 /nfs/dbraw/zinc/71/34/52/386713452.db2.gz GSYZHOVHZHYXQL-SNVBAGLBSA-N 2 0 226.751 2.285 20 0 BEADRP CC(C)[C@@H]1CCC[C@@H]1[NH2+]C1CC[NH2+]CC1 ZINC000335484928 386714163 /nfs/dbraw/zinc/71/41/63/386714163.db2.gz XKJHVEIRZDOSIG-STQMWFEESA-N 2 0 210.365 2.153 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CCC[C@@H]1C1CC1 ZINC000414832175 386716110 /nfs/dbraw/zinc/71/61/10/386716110.db2.gz FAFCOMXZRHJONC-CYZMBNFOSA-N 2 0 210.365 2.010 20 0 BEADRP C1CC1[C@H]1CCC[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000414831926 386716674 /nfs/dbraw/zinc/71/66/74/386716674.db2.gz QJWSLNRTYNZUIC-JSPOSNOBSA-N 2 0 234.387 2.438 20 0 BEADRP Cc1cc(F)ccc1C[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000414835250 386726787 /nfs/dbraw/zinc/72/67/87/386726787.db2.gz RIACZLHYZXRFAU-GFCCVEGCSA-N 2 0 236.334 2.223 20 0 BEADRP CC(C)C[C@@H](C)C[NH2+]C1(C)CC[NH2+]CC1 ZINC000414930015 386746831 /nfs/dbraw/zinc/74/68/31/386746831.db2.gz AJVUBRICUWSKKP-GFCCVEGCSA-N 2 0 212.381 2.400 20 0 BEADRP CCCC[C@H](CC)[NH2+]C[C@@H](C)C[NH2+]C ZINC000414840839 386750996 /nfs/dbraw/zinc/75/09/96/386750996.db2.gz NPPCPPDOCSEUPT-RYUDHWBXSA-N 2 0 200.370 2.400 20 0 BEADRP COC1(CC[NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)CCC1 ZINC000336663985 386753731 /nfs/dbraw/zinc/75/37/31/386753731.db2.gz WSABQULOYXKJDD-QWHCGFSZSA-N 2 0 240.391 2.018 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]Cc1ccc2ncccc2c1 ZINC000414843154 386757876 /nfs/dbraw/zinc/75/78/76/386757876.db2.gz PTXNGTLGCPRNNY-GFCCVEGCSA-N 2 0 243.354 2.180 20 0 BEADRP CO[C@H](C)CC[NH2+][C@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000336665800 386772948 /nfs/dbraw/zinc/77/29/48/386772948.db2.gz ZDDODYITPHTZJY-MGPQQGTHSA-N 2 0 242.407 2.312 20 0 BEADRP Cc1ccncc1C[N@@H+]1C[C@H](C[NH3+])[C@@H](C)C[C@@H]1C ZINC000397259229 386774816 /nfs/dbraw/zinc/77/48/16/386774816.db2.gz GQAFCUSFRGGFQM-IHRRRGAJSA-N 2 0 247.386 2.195 20 0 BEADRP Cc1ccncc1C[N@@H+]1C[C@H](C[NH3+])[C@@H](C)C[C@H]1C ZINC000397259236 386775444 /nfs/dbraw/zinc/77/54/44/386775444.db2.gz GQAFCUSFRGGFQM-MJBXVCDLSA-N 2 0 247.386 2.195 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCCC[C@H]1C)C[NH+](C)C ZINC000336668029 386786517 /nfs/dbraw/zinc/78/65/17/386786517.db2.gz DZHODBGSMGUHAD-JHJVBQTASA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H]1C[N@H+](Cc2ccc(-n3ccnc3)nc2)[C@H]1C ZINC000293415243 386816578 /nfs/dbraw/zinc/81/65/78/386816578.db2.gz MTTVJRTUCJZBLC-NEPJUHHUSA-N 2 0 242.326 2.108 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH2+]Cc2cccc(F)c2)C1 ZINC000044535441 386822912 /nfs/dbraw/zinc/82/29/12/386822912.db2.gz LTGKJPKMHFOWFL-ZDUSSCGKSA-N 2 0 236.334 2.257 20 0 BEADRP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+][C@@H]2COC(C)(C)C2)C1 ZINC000417959254 386824378 /nfs/dbraw/zinc/82/43/78/386824378.db2.gz LPGYIAOLQDSPCB-FRRDWIJNSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@@H](C[NH2+][C@@H]1CCc2ccccc21)C[NH+](C)C ZINC000293303835 386812602 /nfs/dbraw/zinc/81/26/02/386812602.db2.gz DURDTMUZBCXRBN-SWLSCSKDSA-N 2 0 232.371 2.461 20 0 BEADRP CCC[C@H](C)C[NH2+][C@@H](C)[C@H]1CCC[NH2+]C1 ZINC000414847538 386837846 /nfs/dbraw/zinc/83/78/46/386837846.db2.gz FSWLXOVYRCLVTL-AVGNSLFASA-N 2 0 212.381 2.400 20 0 BEADRP CCCC[N@H+](C)C[C@@H](C)Nc1cc[nH+]cc1C ZINC000341134857 386845777 /nfs/dbraw/zinc/84/57/77/386845777.db2.gz GMIYANINDSGYQB-CYBMUJFWSA-N 2 0 235.375 2.344 20 0 BEADRP CCOC[C@@H](C)[NH2+]CC(C)(C)C[NH+]1CCCC1 ZINC000357847509 386853676 /nfs/dbraw/zinc/85/36/76/386853676.db2.gz JGHAFTKPPDQHQY-CYBMUJFWSA-N 2 0 242.407 2.123 20 0 BEADRP [NH3+]CC1CCC([NH2+][C@@H]2COc3ccccc32)CC1 ZINC000334844936 386892650 /nfs/dbraw/zinc/89/26/50/386892650.db2.gz WRDQUPVLWQBDQW-ORHYLEIMSA-N 2 0 246.354 2.227 20 0 BEADRP CC(C)(C)CC[NH+]1CCC2(CC[NH2+]C2)CC1 ZINC000335743007 386860488 /nfs/dbraw/zinc/86/04/88/386860488.db2.gz KNAGUGOHHLJOET-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP C[NH+](C)CC1CC[NH+](Cc2ccccc2)CC1 ZINC000341192808 386860746 /nfs/dbraw/zinc/86/07/46/386860746.db2.gz RRKKFNQMTUUDIU-UHFFFAOYSA-N 2 0 232.371 2.460 20 0 BEADRP CC[C@H]([NH2+][C@H]1CCCC[C@@H]1C[NH3+])C1CC1 ZINC000324313612 386872064 /nfs/dbraw/zinc/87/20/64/386872064.db2.gz NASPJRMKEDEWDP-AGIUHOORSA-N 2 0 210.365 2.282 20 0 BEADRP c1ccc2c(c1)C[NH+](CC[C@@H]1CCC[NH2+]C1)C2 ZINC000051919695 386873695 /nfs/dbraw/zinc/87/36/95/386873695.db2.gz ZTXGFQSVHMHZPL-ZDUSSCGKSA-N 2 0 230.355 2.392 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@H]2CCCC2(C)C)CC[NH2+]1 ZINC000414939939 386875554 /nfs/dbraw/zinc/87/55/54/386875554.db2.gz BKUGRDWJBHIVLM-WOPDTQHZSA-N 2 0 210.365 2.295 20 0 BEADRP CC1(C)CCC[NH2+][C@@H]1C[NH2+]C1CCSCC1 ZINC000334862348 386914836 /nfs/dbraw/zinc/91/48/36/386914836.db2.gz KJKBXRRTKRIDNV-GFCCVEGCSA-N 2 0 242.432 2.250 20 0 BEADRP CC1CCC([NH2+][C@H]2CC[C@@H](C[NH3+])C2)CC1 ZINC000334863370 386917810 /nfs/dbraw/zinc/91/78/10/386917810.db2.gz MWKQCUKLDSPZTG-KPFVRQRISA-N 2 0 210.365 2.282 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)cc1F ZINC000334847484 386896010 /nfs/dbraw/zinc/89/60/10/386896010.db2.gz USNAYYCZUGVFIF-OLZOCXBDSA-N 2 0 236.334 2.494 20 0 BEADRP Fc1cc(CN[C@@H]2CCC[NH2+]C2)ccc1Cl ZINC000334850883 386899973 /nfs/dbraw/zinc/89/99/73/386899973.db2.gz XRYBFKMNPFDIEK-SNVBAGLBSA-N 2 0 242.725 2.321 20 0 BEADRP Cc1cccc(C[NH2+][C@@H]2CC[NH2+]C[C@@H]2C)c1C ZINC000334857192 386909295 /nfs/dbraw/zinc/90/92/95/386909295.db2.gz LSGQOHCCGOXRKC-SWLSCSKDSA-N 2 0 232.371 2.391 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CC[NH2+]C[C@@H]2C)cc1C ZINC000334857333 386909323 /nfs/dbraw/zinc/90/93/23/386909323.db2.gz NEPOYLPQYAEHLU-ZFWWWQNUSA-N 2 0 232.371 2.391 20 0 BEADRP c1cncc(C[N@@H+]2CCCC[C@@H]2[C@H]2CC[NH2+]C2)c1 ZINC000334867978 386926721 /nfs/dbraw/zinc/92/67/21/386926721.db2.gz HEOBKYZNFJNTQQ-LSDHHAIUSA-N 2 0 245.370 2.046 20 0 BEADRP CC(C)(C)C[C@H](O)C[NH2+][C@H]1CCCCC[C@@H]1[NH3+] ZINC000332018334 386942739 /nfs/dbraw/zinc/94/27/39/386942739.db2.gz QNTCPCDHUQXRPN-AVGNSLFASA-N 2 0 242.407 2.033 20 0 BEADRP C[C@@H]1CC[C@]2(CC[N@H+](CCn3ccnc3)C2)C1 ZINC000334890102 386962559 /nfs/dbraw/zinc/96/25/59/386962559.db2.gz MSJUVDAKKWLQKF-KGLIPLIRSA-N 2 0 233.359 2.395 20 0 BEADRP CS[C@@H]1CC[C@H]1[NH2+]CCC1CC[NH+](C)CC1 ZINC000425361165 386980714 /nfs/dbraw/zinc/98/07/14/386980714.db2.gz TVBSXPPUCVKOFQ-CHWSQXEVSA-N 2 0 242.432 2.202 20 0 BEADRP C[NH+](C)C[C@@H]1CC[N@H+](CCCCCF)C1 ZINC000341876315 386980979 /nfs/dbraw/zinc/98/09/79/386980979.db2.gz NEJBQHYJPWCKHJ-LBPRGKRZSA-N 2 0 216.344 2.010 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@@H]1CC[C@@H]1C1CCC1 ZINC000336745333 386984913 /nfs/dbraw/zinc/98/49/13/386984913.db2.gz QRHUDXNKTKWCRD-MRVWCRGKSA-N 2 0 224.392 2.495 20 0 BEADRP C(C1CC1)[NH+](CC1CC1)CC1CC[NH2+]CC1 ZINC000070064254 387043935 /nfs/dbraw/zinc/04/39/35/387043935.db2.gz NFLAQSJXVQMZPH-UHFFFAOYSA-N 2 0 222.376 2.108 20 0 BEADRP CCOc1cccc(C[N@@H+]2CC[C@H]([C@@H](C)[NH3+])C2)c1 ZINC000126795804 387048462 /nfs/dbraw/zinc/04/84/62/387048462.db2.gz XULNXZAYXDGLLO-OCCSQVGLSA-N 2 0 248.370 2.254 20 0 BEADRP Cc1cc(C)c2c(c1)CN(C[C@@H](C)[NH3+])CC2 ZINC000334967702 387051528 /nfs/dbraw/zinc/05/15/28/387051528.db2.gz JHQNMKFIVJYJTR-GFCCVEGCSA-N 2 0 218.344 2.009 20 0 BEADRP CN(CC[NH3+])[C@@H]1CCCc2ccc(F)cc21 ZINC000334971578 387056961 /nfs/dbraw/zinc/05/69/61/387056961.db2.gz JTBGKXIVGCQVBG-CYBMUJFWSA-N 2 0 222.307 2.094 20 0 BEADRP CC(C)[C@@](C)([NH2+]CC[C@H]1CCC[N@@H+]1C)C(N)=O ZINC000331344257 387017020 /nfs/dbraw/zinc/01/70/20/387017020.db2.gz LECTZHWCMOOBFF-DGCLKSJQSA-N 2 0 241.379 2.010 20 0 BEADRP COCc1cccc(C[N@@H+]2C[C@@H](C[NH3+])C[C@@H]2C)c1 ZINC000216074618 387028128 /nfs/dbraw/zinc/02/81/28/387028128.db2.gz VZZIDNWGCVDTRL-SWLSCSKDSA-N 2 0 248.370 2.002 20 0 BEADRP COc1ccsc1[C@@H](C)[NH2+]C[C@@H](C)C[NH3+] ZINC000423299882 387130224 /nfs/dbraw/zinc/13/02/24/387130224.db2.gz CMVRKQQBZWIOCC-DTWKUNHWSA-N 2 0 228.361 2.002 20 0 BEADRP C(C1CCC1)[N@@H+]1CCCC[C@H]1[C@@H]1CC[NH2+]C1 ZINC000334983476 387069768 /nfs/dbraw/zinc/06/97/68/387069768.db2.gz MRKFJDNIHQLZGQ-KGLIPLIRSA-N 2 0 222.376 2.251 20 0 BEADRP CCCC[C@H](C)[C@H](C)[NH2+]C[C@@H](C)C[NH3+] ZINC000423299832 387130526 /nfs/dbraw/zinc/13/05/26/387130526.db2.gz CEAXQGRRBNURJR-SRVKXCTJSA-N 2 0 200.370 2.386 20 0 BEADRP C[C@H]([NH3+])C1CC[NH+](CCc2ccccc2)CC1 ZINC000111611490 387084663 /nfs/dbraw/zinc/08/46/63/387084663.db2.gz MMHBYTQADPVQIA-ZDUSSCGKSA-N 2 0 232.371 2.288 20 0 BEADRP CC[C@H]([NH2+]CC1CC[NH2+]CC1)c1nccs1 ZINC000070733280 387089949 /nfs/dbraw/zinc/08/99/49/387089949.db2.gz GHOOLVLXEBFWMH-NSHDSACASA-N 2 0 239.388 2.183 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+]C1CCC(C(F)F)CC1 ZINC000335004053 387098170 /nfs/dbraw/zinc/09/81/70/387098170.db2.gz AIELBXVYDMTZMQ-YYJSSNLHSA-N 2 0 246.345 2.398 20 0 BEADRP [NH3+][C@H]1CCCCC[C@@H]1[NH2+]C1CC(F)(F)C1 ZINC000335006091 387099900 /nfs/dbraw/zinc/09/99/00/387099900.db2.gz ANDKQAQMGQQJLG-UWVGGRQHSA-N 2 0 218.291 2.034 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+]CC1=CCCCC1 ZINC000335004788 387099948 /nfs/dbraw/zinc/09/99/48/387099948.db2.gz GAXYEUKHVRWNLV-JSGCOSHPSA-N 2 0 222.376 2.465 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]Cc1cccc(F)c1 ZINC000335010107 387105143 /nfs/dbraw/zinc/10/51/43/387105143.db2.gz NNVVDZIXKWMKLC-BXUZGUMPSA-N 2 0 236.334 2.303 20 0 BEADRP C[C@H]([NH2+]C1CCC2(CC2)CC1)[C@H]1CCC[NH2+]1 ZINC000335010070 387105242 /nfs/dbraw/zinc/10/52/42/387105242.db2.gz MSPACGURZKSVRC-WCQYABFASA-N 2 0 222.376 2.439 20 0 BEADRP C1CC2(CCCC2)[C@H]1[NH2+][C@H]1CCC[NH2+]CC1 ZINC000335011863 387106022 /nfs/dbraw/zinc/10/60/22/387106022.db2.gz VXMTVMDPVLDCJX-STQMWFEESA-N 2 0 222.376 2.441 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@@H]2C[C@@H](C)[N@H+](C)C[C@@H]2C)C1 ZINC000228909346 387127287 /nfs/dbraw/zinc/12/72/87/387127287.db2.gz JXRCHDMRMSOKSP-XHJNMGKDSA-N 2 0 224.392 2.493 20 0 BEADRP CCC[C@H](C)[C@@H](CC)[NH2+]C[C@H](C)C[NH3+] ZINC000423299155 387129390 /nfs/dbraw/zinc/12/93/90/387129390.db2.gz PLIHWRKUJQIUIS-GRYCIOLGSA-N 2 0 200.370 2.386 20 0 BEADRP C[NH+](C)CC1CC[NH+]([C@H]2C=CCCC2)CC1 ZINC000336228683 387068184 /nfs/dbraw/zinc/06/81/84/387068184.db2.gz DIBWUYMVNDNDRX-AWEZNQCLSA-N 2 0 222.376 2.369 20 0 BEADRP CCc1cccc(CN2C[C@@H](C)[C@H]([NH3+])C2)c1 ZINC000334980907 387068475 /nfs/dbraw/zinc/06/84/75/387068475.db2.gz QTUWQOWIWPBGDH-BXUZGUMPSA-N 2 0 218.344 2.028 20 0 BEADRP CC(C)CC[C@@H]1CCC[C@H]1[NH2+]CC1C[NH2+]C1 ZINC000423305816 387141774 /nfs/dbraw/zinc/14/17/74/387141774.db2.gz RSEMBBVLXUFDED-UONOGXRCSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@@H](C)C1CCC(F)(F)CC1 ZINC000423306524 387141827 /nfs/dbraw/zinc/14/18/27/387141827.db2.gz LPOXTYKBUAQDIM-UWVGGRQHSA-N 2 0 234.334 2.385 20 0 BEADRP CC(C)Oc1ccc([C@@H](C)[NH2+]CC2C[NH2+]C2)cc1 ZINC000423308377 387142802 /nfs/dbraw/zinc/14/28/02/387142802.db2.gz XQOWFQRHJZLONS-GFCCVEGCSA-N 2 0 248.370 2.344 20 0 BEADRP Fc1ccc([C@H]([NH2+]CC2C[NH2+]C2)C2CC2)cc1 ZINC000423307397 387143109 /nfs/dbraw/zinc/14/31/09/387143109.db2.gz VXLVPUBXJVRHDR-CQSZACIVSA-N 2 0 234.318 2.086 20 0 BEADRP C[C@H]([NH2+][C@H]1CCn2ccnc2C1)C1CCCC1 ZINC000336319200 387143273 /nfs/dbraw/zinc/14/32/73/387143273.db2.gz VBFZIZPCHDOVII-AAEUAGOBSA-N 2 0 233.359 2.366 20 0 BEADRP CCC[C@@H](Cc1ccccc1)[NH2+]CC1C[NH2+]C1 ZINC000423308680 387143446 /nfs/dbraw/zinc/14/34/46/387143446.db2.gz YDCDDXAQBBPCFL-HNNXBMFYSA-N 2 0 232.371 2.207 20 0 BEADRP C[C@@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]CCCCCO ZINC000229110368 387143935 /nfs/dbraw/zinc/14/39/35/387143935.db2.gz ZUOSHXWHIDEXOJ-KBPBESRZSA-N 2 0 242.407 2.049 20 0 BEADRP CC(C)C[C@@H](C)C[C@@H](C)[NH2+]CC1C[NH2+]C1 ZINC000423308750 387144397 /nfs/dbraw/zinc/14/43/97/387144397.db2.gz YGFAEYZJSZHEQQ-VXGBXAGGSA-N 2 0 212.381 2.256 20 0 BEADRP c1ccc(C[C@H]2CC[C@H]([NH2+]CC3C[NH2+]C3)C2)cc1 ZINC000423309368 387145528 /nfs/dbraw/zinc/14/55/28/387145528.db2.gz ZGSLSMGJNNFNQA-ZBFHGGJFSA-N 2 0 244.382 2.207 20 0 BEADRP C[C@H](F)CC[N@H+](C)CCC[NH+]1CCCC1 ZINC000352393913 387145579 /nfs/dbraw/zinc/14/55/79/387145579.db2.gz DXMQZHOUTHWDRE-LBPRGKRZSA-N 2 0 216.344 2.152 20 0 BEADRP CCC[C@@H]([NH2+]CC1C[NH2+]C1)c1ccsc1 ZINC000423309390 387146456 /nfs/dbraw/zinc/14/64/56/387146456.db2.gz ZKSKDIFSVKKQRS-GFCCVEGCSA-N 2 0 224.373 2.398 20 0 BEADRP CC(C)CC[C@H]1CC[C@@H]([NH2+]CC2C[NH2+]C2)C1 ZINC000423310718 387148083 /nfs/dbraw/zinc/14/80/83/387148083.db2.gz AVTWDKSCEOZMIZ-GXTWGEPZSA-N 2 0 224.392 2.400 20 0 BEADRP CC(C)CO[C@@H]1C[C@H]([NH2+]C[C@H](C)C[NH3+])C1(C)C ZINC000423311485 387149091 /nfs/dbraw/zinc/14/90/91/387149091.db2.gz UBELJDWFSNBGFQ-FRRDWIJNSA-N 2 0 242.407 2.011 20 0 BEADRP CCC[NH2+]CC[NH2+][C@@H]1CC[C@H]1C1CCC1 ZINC000423312642 387150790 /nfs/dbraw/zinc/15/07/90/387150790.db2.gz SGKGTAFAMJUOFS-QWHCGFSZSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@@H]1CCCC12CCCC2 ZINC000423313245 387151124 /nfs/dbraw/zinc/15/11/24/387151124.db2.gz WQSYEGOIFPEXQV-NWDGAFQWSA-N 2 0 210.365 2.284 20 0 BEADRP CC[C@H]([NH2+]C[C@H]([NH3+])C1CC1)C1CCCC1 ZINC000423313109 387151351 /nfs/dbraw/zinc/15/13/51/387151351.db2.gz FAVIYHFAUZMHEK-STQMWFEESA-N 2 0 210.365 2.282 20 0 BEADRP Cc1c([C@H](C)[NH2+]C[C@@H](C)C[NH3+])cnn1C(C)C ZINC000423313242 387152054 /nfs/dbraw/zinc/15/20/54/387152054.db2.gz WQRCTPDLTBOXAH-QWRGUYRKSA-N 2 0 238.379 2.018 20 0 BEADRP CC(C)[C@@H]1CCC[C@H]([NH2+]C[C@H](C)C[NH3+])C1 ZINC000423312959 387152240 /nfs/dbraw/zinc/15/22/40/387152240.db2.gz VVKCYCSMMMYRQB-UPJWGTAASA-N 2 0 212.381 2.386 20 0 BEADRP CCC[NH2+]CC[NH2+][C@H]1CC[C@H]1C1CCC1 ZINC000423312643 387152587 /nfs/dbraw/zinc/15/25/87/387152587.db2.gz SGKGTAFAMJUOFS-STQMWFEESA-N 2 0 210.365 2.154 20 0 BEADRP CC[C@H]([NH2+]CC1([NH3+])CCC1)C1CCCC1 ZINC000423319122 387159852 /nfs/dbraw/zinc/15/98/52/387159852.db2.gz CWYJQTAOHFDAAQ-LBPRGKRZSA-N 2 0 210.365 2.426 20 0 BEADRP [NH3+]CCCC[NH2+][C@@H](Cc1ccccc1)C1CC1 ZINC000423320912 387161466 /nfs/dbraw/zinc/16/14/66/387161466.db2.gz GTTDLHCILHZYPJ-HNNXBMFYSA-N 2 0 232.371 2.336 20 0 BEADRP C[C@H]([NH2+]CCCC[NH3+])c1cc(F)c(F)c(F)c1 ZINC000423321799 387166068 /nfs/dbraw/zinc/16/60/68/387166068.db2.gz GBDBUMSEZBMCMN-QMMMGPOBSA-N 2 0 246.276 2.493 20 0 BEADRP C[C@@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)c1ccncc1 ZINC000423328487 387169543 /nfs/dbraw/zinc/16/95/43/387169543.db2.gz DSHDMUDFWMWQMJ-TZMCWYRMSA-N 2 0 233.359 2.122 20 0 BEADRP CC[C@H]([NH2+]CC1(C)CC[NH2+]CC1)[C@H]1C[C@@H]1C ZINC000423332738 387177824 /nfs/dbraw/zinc/17/78/24/387177824.db2.gz PHJGNZNPXVMKDN-AVGNSLFASA-N 2 0 224.392 2.400 20 0 BEADRP CSCC1CCC([NH2+]C[C@H]([NH3+])C2CC2)CC1 ZINC000423332444 387177848 /nfs/dbraw/zinc/17/78/48/387177848.db2.gz VEKANFGAYYQVJN-GDKBPFBDSA-N 2 0 242.432 2.235 20 0 BEADRP C[C@@H]([NH2+]CC1C[NH2+]C1)[C@@H]1CCCC[C@H]1C ZINC000423334544 387180586 /nfs/dbraw/zinc/18/05/86/387180586.db2.gz WREWZSXIFUHTGE-NQBHXWOUSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)C1(C)CC1 ZINC000423334782 387180600 /nfs/dbraw/zinc/18/06/00/387180600.db2.gz RFEFLVCQOOUMRW-NEPJUHHUSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H]([NH2+]CC1=CC[NH2+]CC1)c1cccc(F)c1 ZINC000423334072 387180693 /nfs/dbraw/zinc/18/06/93/387180693.db2.gz FMTPVXDUSLKFLQ-NSHDSACASA-N 2 0 234.318 2.396 20 0 BEADRP [NH3+]C1(C[NH2+]C2CCC(C(F)F)CC2)CCC1 ZINC000423335088 387182940 /nfs/dbraw/zinc/18/29/40/387182940.db2.gz TZQPRVQMBRAKFT-UHFFFAOYSA-N 2 0 232.318 2.281 20 0 BEADRP CC[C@H]([NH2+]CC1CC[NH+](C)CC1)C1CCC1 ZINC000322358495 259705856 /nfs/dbraw/zinc/70/58/56/259705856.db2.gz GMOPIWDHTDMYBA-AWEZNQCLSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H](CCCc1cccnc1)[NH2+]CCCC[NH3+] ZINC000423337425 387186380 /nfs/dbraw/zinc/18/63/80/387186380.db2.gz VOPGILDCQOCHPU-ZDUSSCGKSA-N 2 0 235.375 2.121 20 0 BEADRP CC(C)=CCC[C@@H](C)[NH2+]C[C@@H]([NH3+])C1CC1 ZINC000423339966 387187727 /nfs/dbraw/zinc/18/77/27/387187727.db2.gz ZZZLGQDADCQVHG-DGCLKSJQSA-N 2 0 210.365 2.448 20 0 BEADRP CC[C@@H]1CC[C@H](C)C[C@@H]1[NH2+]CC1C[NH2+]C1 ZINC000423339205 387188380 /nfs/dbraw/zinc/18/83/80/387188380.db2.gz ZIZDSPBOUYEDGA-UHTWSYAYSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]([NH2+]CC1=CC[NH2+]CC1)c1ccccc1F ZINC000423338630 387188955 /nfs/dbraw/zinc/18/89/55/387188955.db2.gz IEBHAVUSJLYHHO-LLVKDONJSA-N 2 0 234.318 2.396 20 0 BEADRP CCC1(CC)[C@H]([NH2+]CCCC[NH3+])[C@@H](C)[C@H]1OC ZINC000423341850 387190596 /nfs/dbraw/zinc/19/05/96/387190596.db2.gz YDMHTEILQNLIAE-JHJVBQTASA-N 2 0 242.407 2.155 20 0 BEADRP [NH3+]CCCC[NH2+][C@H]1CCc2c1c(F)ccc2F ZINC000423340525 387190742 /nfs/dbraw/zinc/19/07/42/387190742.db2.gz XIHFLNPLJVRZQH-LBPRGKRZSA-N 2 0 240.297 2.281 20 0 BEADRP CC[C@@H]1CC[C@H](C)C[C@@H]1[NH2+]C[C@@H](C)C[NH3+] ZINC000423299910 387132704 /nfs/dbraw/zinc/13/27/04/387132704.db2.gz CQHQTWTXEIYSNU-RVMXOQNASA-N 2 0 212.381 2.386 20 0 BEADRP Fc1ccc([C@@H]2CCC[C@H]2[NH2+]CC2C[NH2+]C2)cc1 ZINC000423300744 387133279 /nfs/dbraw/zinc/13/32/79/387133279.db2.gz FGMLCSBYASDAIJ-LSDHHAIUSA-N 2 0 248.345 2.271 20 0 BEADRP Cc1ccc(CC[C@H](C)[NH2+]CC2C[NH2+]C2)cc1 ZINC000423300522 387133368 /nfs/dbraw/zinc/13/33/68/387133368.db2.gz FCRWLODICAMIKR-ZDUSSCGKSA-N 2 0 232.371 2.125 20 0 BEADRP Cc1ccc([C@H]([NH2+]CC2C[NH2+]C2)C2CC2)cc1 ZINC000423301912 387134204 /nfs/dbraw/zinc/13/42/04/387134204.db2.gz IQBBUZFBQRIQBT-HNNXBMFYSA-N 2 0 230.355 2.255 20 0 BEADRP CC(C)[C@@H]1CC[C@H]([NH2+]CC2C[NH2+]C2)C[C@@H]1C ZINC000423302463 387135031 /nfs/dbraw/zinc/13/50/31/387135031.db2.gz JPFFPZAIMOHQJT-UBHSHLNASA-N 2 0 224.392 2.256 20 0 BEADRP COc1ccc([C@H](C)[NH2+]C[C@H](C)C[NH3+])c(F)c1 ZINC000423303908 387136944 /nfs/dbraw/zinc/13/69/44/387136944.db2.gz XQLXONZVJHFBEH-ZJUUUORDSA-N 2 0 240.322 2.080 20 0 BEADRP C[C@H]([NH2+]CC1C[NH2+]C1)c1ccc(Cl)cc1 ZINC000423303697 387137601 /nfs/dbraw/zinc/13/76/01/387137601.db2.gz MNKSTQVUHFQOCB-VIFPVBQESA-N 2 0 224.735 2.210 20 0 BEADRP CCC[NH2+]CC[NH2+][C@@H]1C[C@H](C)CC[C@H]1C ZINC000423305458 387139111 /nfs/dbraw/zinc/13/91/11/387139111.db2.gz BZYUVRFELLVELG-JHJVBQTASA-N 2 0 212.381 2.400 20 0 BEADRP CCC[NH2+]CC[NH2+][C@H](C)CC(C)(C)C ZINC000423305063 387139969 /nfs/dbraw/zinc/13/99/69/387139969.db2.gz AUOLTMFHHMLUDF-LLVKDONJSA-N 2 0 200.370 2.400 20 0 BEADRP C[C@@H]([NH2+]C[C@@H](C)C[NH3+])C1CCC(F)(F)CC1 ZINC000423306525 387140993 /nfs/dbraw/zinc/14/09/93/387140993.db2.gz LPOXTYKBUAQDIM-VHSXEESVSA-N 2 0 234.334 2.385 20 0 BEADRP CC[C@@H]([NH2+]CC[C@H]1CCC[NH2+]1)c1ccncc1 ZINC000423352746 387202970 /nfs/dbraw/zinc/20/29/70/387202970.db2.gz BLFPYSSBQKMMKF-ZIAGYGMSSA-N 2 0 233.359 2.264 20 0 BEADRP C(C[C@H]1CCC[NH2+]1)[NH2+][C@@H](C1CC1)C1CCC1 ZINC000423352524 387203760 /nfs/dbraw/zinc/20/37/60/387203760.db2.gz BJQLDYGWVWSVQP-ZIAGYGMSSA-N 2 0 222.376 2.297 20 0 BEADRP CC(C)C1CC([NH2+]CC[C@H]2CCC[NH2+]2)C1 ZINC000423353261 387204959 /nfs/dbraw/zinc/20/49/59/387204959.db2.gz BHJIRHIQYPUIBG-OTTFEQOBSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)CC(CC(C)C)[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000423425726 387252582 /nfs/dbraw/zinc/25/25/82/387252582.db2.gz GZSBYAQDERGZSS-WDNDVIMCSA-N 2 0 224.392 2.255 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@H]1CCCc2cc(N)ccc21 ZINC000423354981 387205922 /nfs/dbraw/zinc/20/59/22/387205922.db2.gz DLIFMHKVIOBPOC-RWSFTLGLSA-N 2 0 247.386 2.362 20 0 BEADRP c1ccc2c(c1)CC[C@@H]2[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000423353663 387206219 /nfs/dbraw/zinc/20/62/19/387206219.db2.gz BWQIAXZHGNIKJG-HIFRSBDPSA-N 2 0 230.355 2.406 20 0 BEADRP CC(C)(C)[C@@H]1CCCC[C@H]1[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000423425409 387252689 /nfs/dbraw/zinc/25/26/89/387252689.db2.gz GPLWNLAUGGPWKU-ITGHMWBKSA-N 2 0 236.403 2.399 20 0 BEADRP FCC[C@H]1CCC[C@@H]1[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000423359018 387210615 /nfs/dbraw/zinc/21/06/15/387210615.db2.gz OPJTXJUGVCGZGO-UPJWGTAASA-N 2 0 228.355 2.246 20 0 BEADRP C(C[C@H]1CCC[NH2+]1)[NH2+][C@@H]1CC[C@@H]1C1CCC1 ZINC000423359292 387210870 /nfs/dbraw/zinc/21/08/70/387210870.db2.gz ORXZETKZCJRJTQ-MGPQQGTHSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCC[NH2+]1)[C@H]1CC1(C)C ZINC000423362673 387214670 /nfs/dbraw/zinc/21/46/70/387214670.db2.gz NIEUJAMJEGXAAG-QJPTWQEYSA-N 2 0 210.365 2.153 20 0 BEADRP Cc1cncc([C@H](C)[NH2+][C@@H]2CC[NH2+]C[C@H]2C)c1 ZINC000423363217 387215570 /nfs/dbraw/zinc/21/55/70/387215570.db2.gz BOJGTQKOUJTPJJ-MBNYWOFBSA-N 2 0 233.359 2.039 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CCC[NH2+]1)[C@@H]1CC1(C)C ZINC000423362675 387216109 /nfs/dbraw/zinc/21/61/09/387216109.db2.gz NIEUJAMJEGXAAG-UTUOFQBUSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCC[C@@H]([NH3+])C1)c1ccncc1 ZINC000423368797 387220618 /nfs/dbraw/zinc/22/06/18/387220618.db2.gz NOEWGCGQHBPYFL-MCIONIFRSA-N 2 0 233.359 2.392 20 0 BEADRP COCC1CCC([NH2+][C@H]2CCC[C@@H]([NH3+])C2)CC1 ZINC000423368812 387220941 /nfs/dbraw/zinc/22/09/41/387220941.db2.gz NPNOGEPQLPFAHN-HHTDUIENSA-N 2 0 240.391 2.051 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@H]([NH3+])[C@H](C)C2)c(C)c1 ZINC000094338949 387222169 /nfs/dbraw/zinc/22/21/69/387222169.db2.gz LTOCQTFKTFIULR-HIFRSBDPSA-N 2 0 232.371 2.473 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000423369352 387222830 /nfs/dbraw/zinc/22/28/30/387222830.db2.gz OKRJDZUFSVUMDP-WXHSDQCUSA-N 2 0 222.332 2.070 20 0 BEADRP CCOc1cccc(C[N@@H+]2CC[C@@H]([NH3+])[C@H](C)C2)c1 ZINC000094339172 387223230 /nfs/dbraw/zinc/22/32/30/387223230.db2.gz QJMRYCNSBGAUPI-IUODEOHRSA-N 2 0 248.370 2.254 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[NH2+][C@H](C)C1)C1CCCC1 ZINC000423372291 387225676 /nfs/dbraw/zinc/22/56/76/387225676.db2.gz IFNUUSONVZECMX-WZRBSPASSA-N 2 0 210.365 2.295 20 0 BEADRP [NH3+][C@@H]1CC[C@H]2C[N@H+](CCCc3ccccc3)C[C@@H]12 ZINC000336796092 387225769 /nfs/dbraw/zinc/22/57/69/387225769.db2.gz PKKFEZHLSSWPSW-ARFHVFGLSA-N 2 0 244.382 2.288 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@H]2CCc3ccccc32)CC[NH2+]1 ZINC000423373675 387229364 /nfs/dbraw/zinc/22/93/64/387229364.db2.gz JHXCZYYSHXFYTG-ZLDLUXBVSA-N 2 0 230.355 2.404 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCc3ccccc32)CC[NH2+]1 ZINC000423373673 387229883 /nfs/dbraw/zinc/22/98/83/387229883.db2.gz JHXCZYYSHXFYTG-OSAQELSMSA-N 2 0 230.355 2.404 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@@H]1CCC[C@@H]1CCCF ZINC000423396996 387232150 /nfs/dbraw/zinc/23/21/50/387232150.db2.gz NYWWEQUZRSUURU-YIYPIFLZSA-N 2 0 242.382 2.492 20 0 BEADRP CC(C)[C@H]([NH2+][C@@H]1CC[NH2+]C[C@@H]1C)c1cccnc1 ZINC000423399463 387234175 /nfs/dbraw/zinc/23/41/75/387234175.db2.gz PNWHEKSVUGJKKQ-CFVMTHIKSA-N 2 0 247.386 2.366 20 0 BEADRP FCCC[C@H]1CCC[C@H]1[NH2+]CC1CC[NH2+]CC1 ZINC000643497418 387239277 /nfs/dbraw/zinc/23/92/77/387239277.db2.gz QJLMCAWBILNBEA-ZIAGYGMSSA-N 2 0 242.382 2.494 20 0 BEADRP FCCC[C@@H]1CCC[C@H]1[NH2+]CC1CC[NH2+]CC1 ZINC000643497417 387239850 /nfs/dbraw/zinc/23/98/50/387239850.db2.gz QJLMCAWBILNBEA-UONOGXRCSA-N 2 0 242.382 2.494 20 0 BEADRP c1cnc2c(c1)CCC[C@H]2[NH2+]CC1CC[NH2+]CC1 ZINC000643497455 387240322 /nfs/dbraw/zinc/24/03/22/387240322.db2.gz VLQCFLXUMRPYKS-CQSZACIVSA-N 2 0 245.370 2.048 20 0 BEADRP Cc1ccc(CC[NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)cn1 ZINC000161545593 387240846 /nfs/dbraw/zinc/24/08/46/387240846.db2.gz LWSSCNPFALWXKV-HIFRSBDPSA-N 2 0 247.386 2.005 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@H]1CCC[C@H]1CCCF ZINC000423403747 387241017 /nfs/dbraw/zinc/24/10/17/387241017.db2.gz ZMDUSNWGNZGMEB-AGIUHOORSA-N 2 0 230.371 2.492 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)cn1 ZINC000161545478 387241410 /nfs/dbraw/zinc/24/14/10/387241410.db2.gz LWSSCNPFALWXKV-UKRRQHHQSA-N 2 0 247.386 2.005 20 0 BEADRP C[C@H]([NH2+]CCN1CCCC1(C)C)[C@@H]1CCCO1 ZINC000063074096 387247880 /nfs/dbraw/zinc/24/78/80/387247880.db2.gz AEORBYSNRBZWGE-STQMWFEESA-N 2 0 240.391 2.018 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@H](C)c1ccncc1F ZINC000423428900 387253817 /nfs/dbraw/zinc/25/38/17/387253817.db2.gz JRVXMRCEORLYCX-GHMZBOCLSA-N 2 0 239.338 2.389 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)c1ccccn1 ZINC000423421849 387250263 /nfs/dbraw/zinc/25/02/63/387250263.db2.gz BCUCNOLXTRBTTM-CORIIIEPSA-N 2 0 245.370 2.120 20 0 BEADRP C[C@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)C(C)(C)C ZINC000423346359 387195259 /nfs/dbraw/zinc/19/52/59/387195259.db2.gz ZZQFNROFPMBOIM-WCQYABFASA-N 2 0 212.381 2.400 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@H]2CC[C@H]2C2CC2)C1 ZINC000423374928 387254385 /nfs/dbraw/zinc/25/43/85/387254385.db2.gz UCTBTNVHIILGEC-VOAKCMCISA-N 2 0 208.349 2.035 20 0 BEADRP COCC[C@@H]1CCC[C@H]1[NH2+][C@@H](C)CCCC[NH3+] ZINC000423428876 387255567 /nfs/dbraw/zinc/25/55/67/387255567.db2.gz JQSAYOMNFCFLOM-MELADBBJSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@@H]1C[C@@H]1[NH2+]C1CCN(Cc2cccnc2)CC1 ZINC000120557978 387255655 /nfs/dbraw/zinc/25/56/55/387255655.db2.gz RJRXLWNUIJSZSZ-DOMZBBRYSA-N 2 0 245.370 2.044 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+]C1CCC(CSC)CC1 ZINC000423377280 387260031 /nfs/dbraw/zinc/26/00/31/387260031.db2.gz FDLWJDMNTDZVPW-PNESKVBLSA-N 2 0 244.448 2.496 20 0 BEADRP C[C@@H]1CC(C)(C)C[C@@H]1[NH2+][C@H]1CC[NH2+]C[C@H]1C ZINC000423384413 387268893 /nfs/dbraw/zinc/26/88/93/387268893.db2.gz FXGFCNFPEGTXAJ-NDBYEHHHSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@H](CCCCO)[NH2+]CC1([NH3+])CCCCCC1 ZINC000643498735 387277032 /nfs/dbraw/zinc/27/70/32/387277032.db2.gz MQLGWYGOMODIQF-CYBMUJFWSA-N 2 0 242.407 2.179 20 0 BEADRP CC[C@@H](Cc1cccs1)[NH2+]CCC[NH2+]C ZINC000643498383 387277720 /nfs/dbraw/zinc/27/77/20/387277720.db2.gz ONOCWAVEGYYCQW-NSHDSACASA-N 2 0 226.389 2.268 20 0 BEADRP CC[C@H]([NH2+][C@H]1CC[NH2+][C@H](C)C1)C1CCC1 ZINC000423392100 387278130 /nfs/dbraw/zinc/27/81/30/387278130.db2.gz XLCQTPIPMGMLPB-WXHSDQCUSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)[C@H]1C[C@H]1C ZINC000423435522 387286986 /nfs/dbraw/zinc/28/69/86/387286986.db2.gz OTSDAEFSAFPAFZ-SJVBDLOYSA-N 2 0 222.376 2.009 20 0 BEADRP C[C@@H]([NH2+]CC1(C)CC[NH+](C)CC1)[C@@H]1C[C@H]1C ZINC000321621605 387287077 /nfs/dbraw/zinc/28/70/77/387287077.db2.gz SEEWARAHKMMGKF-JHJVBQTASA-N 2 0 224.392 2.352 20 0 BEADRP C[NH2+]CCC[NH2+]Cc1cc(C)sc1C ZINC000572257681 387289594 /nfs/dbraw/zinc/28/95/94/387289594.db2.gz ATNUWPIQSRKDQZ-UHFFFAOYSA-N 2 0 212.362 2.064 20 0 BEADRP C[C@@H](CCC(C)(C)C)[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000423442552 387293264 /nfs/dbraw/zinc/29/32/64/387293264.db2.gz ZEQUWEBVUDBNII-NNYUYHANSA-N 2 0 210.365 2.009 20 0 BEADRP CC(C)n1cc([C@H](C)[NH2+][C@H](C)C[C@H](C)[NH3+])cn1 ZINC000514854738 387296868 /nfs/dbraw/zinc/29/68/68/387296868.db2.gz HMZXWPVKGHZMHX-TUAOUCFPSA-N 2 0 238.379 2.240 20 0 BEADRP Cc1ccc(CCC[NH2+]C[C@H]2CCCO2)cn1 ZINC000353915029 387297148 /nfs/dbraw/zinc/29/71/48/387297148.db2.gz MAOHZOQHIRUPCT-CQSZACIVSA-N 2 0 234.343 2.091 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H](C)C1CCSCC1 ZINC000423451782 387299254 /nfs/dbraw/zinc/29/92/54/387299254.db2.gz IYNFCGJFHICHGR-GHMZBOCLSA-N 2 0 230.421 2.235 20 0 BEADRP C[C@H]([NH3+])[C@H](C)[NH2+][C@H]1CCCC[C@H]1C1CC1 ZINC000423452765 387299820 /nfs/dbraw/zinc/29/98/20/387299820.db2.gz WWEGYCFCQMQODP-UKJIMTQDSA-N 2 0 210.365 2.281 20 0 BEADRP CO[C@H](C)[C@@H](C)[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000360500749 387301302 /nfs/dbraw/zinc/30/13/02/387301302.db2.gz OJLZJTSUFCFHSP-VXGBXAGGSA-N 2 0 240.391 2.016 20 0 BEADRP CCc1cccnc1[C@H](C)[NH2+][C@H](C)CCC[NH3+] ZINC000423454444 387301831 /nfs/dbraw/zinc/30/18/31/387301831.db2.gz LOZWETZSCCAHCH-NEPJUHHUSA-N 2 0 235.375 2.422 20 0 BEADRP C[C@@H]([NH3+])[C@@H](C)[NH2+]C1CCC(C(F)F)CC1 ZINC000423455282 387303343 /nfs/dbraw/zinc/30/33/43/387303343.db2.gz CGDYKQJRWDPODX-LGUIWLBCSA-N 2 0 220.307 2.136 20 0 BEADRP CC[C@H]([NH2+][C@H](C)CCC[NH3+])c1ccc(F)cn1 ZINC000423457762 387305607 /nfs/dbraw/zinc/30/56/07/387305607.db2.gz PMOCTIPCSNEPFL-PWSUYJOCSA-N 2 0 239.338 2.389 20 0 BEADRP CC(C)C1CC([NH2+][C@@H]2CC[C@@H](C[NH3+])C2)C1 ZINC000423520449 387354170 /nfs/dbraw/zinc/35/41/70/387354170.db2.gz WBETWZODGNHYED-CQLXCSJHSA-N 2 0 210.365 2.138 20 0 BEADRP C1=C(CC[NH2+][C@H]2CCC[C@@H]2C2CC2)CC[NH2+]C1 ZINC000423535034 387360318 /nfs/dbraw/zinc/36/03/18/387360318.db2.gz BQTAFYNMHXPQAK-CABCVRRESA-N 2 0 234.387 2.465 20 0 BEADRP C[C@@H]([NH2+]CCC1=CC[NH2+]CC1)[C@@H]1CC1(C)C ZINC000423535183 387360345 /nfs/dbraw/zinc/36/03/45/387360345.db2.gz CGJIYIMQIZBLCH-YPMHNXCESA-N 2 0 222.376 2.320 20 0 BEADRP C[C@@H]([NH2+]CCC1=CC[NH2+]CC1)c1ccccn1 ZINC000423535398 387361154 /nfs/dbraw/zinc/36/11/54/387361154.db2.gz CXOSBKJEPVHMSY-GFCCVEGCSA-N 2 0 231.343 2.042 20 0 BEADRP C1=C(CC[NH2+][C@H]2CC[C@@H]2C2CCC2)CC[NH2+]C1 ZINC000423534547 387361310 /nfs/dbraw/zinc/36/13/10/387361310.db2.gz ACOBNMRXAKVZPV-CABCVRRESA-N 2 0 234.387 2.465 20 0 BEADRP C1CC1[C@@H]1CC[C@H]1[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000423538685 387363397 /nfs/dbraw/zinc/36/33/97/387363397.db2.gz GVRGPIJYNYZQHM-QKGCVVFFSA-N 2 0 234.387 2.153 20 0 BEADRP CCC[C@H](CC)[NH2+]CCC1=CC[NH2+]CC1 ZINC000423537640 387363805 /nfs/dbraw/zinc/36/38/05/387363805.db2.gz KJTATGSCLCFNEF-ZDUSSCGKSA-N 2 0 210.365 2.465 20 0 BEADRP CC[C@@H]([NH2+]CCC1=CC[NH2+]CC1)c1ccncc1 ZINC000423537805 387363896 /nfs/dbraw/zinc/36/38/96/387363896.db2.gz LBSHYEPSUFGZNM-OAHLLOKOSA-N 2 0 245.370 2.432 20 0 BEADRP C[C@@H]([NH2+]CCC1=CC[NH2+]CC1)c1ccncc1 ZINC000423539626 387365917 /nfs/dbraw/zinc/36/59/17/387365917.db2.gz OZYLMWQWIODVGM-GFCCVEGCSA-N 2 0 231.343 2.042 20 0 BEADRP CCC1CC([NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)C1 ZINC000423541143 387365946 /nfs/dbraw/zinc/36/59/46/387365946.db2.gz FFEBLKWSRUAJBJ-XLICRZQSSA-N 2 0 222.376 2.153 20 0 BEADRP CC[C@H]([NH2+]CCC1=CC[NH2+]CC1)[C@H]1C[C@@H]1C ZINC000423540447 387366537 /nfs/dbraw/zinc/36/65/37/387366537.db2.gz QIOPYQWOZVOWHL-UBHSHLNASA-N 2 0 222.376 2.320 20 0 BEADRP C[C@H]([NH2+]CCC1=CC[NH2+]CC1)c1nccs1 ZINC000423543316 387368118 /nfs/dbraw/zinc/36/81/18/387368118.db2.gz UYNSNTKAAFXCLR-JTQLQIEISA-N 2 0 237.372 2.104 20 0 BEADRP C[C@@H]([NH2+]CCC1=CC[NH2+]CC1)C(C)(C)C ZINC000423542850 387368138 /nfs/dbraw/zinc/36/81/38/387368138.db2.gz UJZYUYFCWPDNJI-LLVKDONJSA-N 2 0 210.365 2.320 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]CCC1=CC[NH2+]CC1 ZINC000423542752 387368755 /nfs/dbraw/zinc/36/87/55/387368755.db2.gz UECONQDCULAEBD-OLZOCXBDSA-N 2 0 208.349 2.074 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+]CCC1=CC[NH2+]CC1 ZINC000423546727 387369653 /nfs/dbraw/zinc/36/96/53/387369653.db2.gz ZHMNIHIFJGJELS-GFCCVEGCSA-N 2 0 234.343 2.110 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H]1Cc2ccccc21)[C@@H]1CCC[NH2+]1 ZINC000643453639 387369955 /nfs/dbraw/zinc/36/99/55/387369955.db2.gz OKZXJFFVFJRGEE-IMJJTQAJSA-N 2 0 244.382 2.447 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]C[C@H]1CC12CCSCC2 ZINC000423547213 387370266 /nfs/dbraw/zinc/37/02/66/387370266.db2.gz LEWAGNPDBZOVDQ-VXGBXAGGSA-N 2 0 242.432 2.237 20 0 BEADRP C(C[NH2+]C1CC1)C[NH2+][C@@H]1CCC12CCCC2 ZINC000423547109 387370762 /nfs/dbraw/zinc/37/07/62/387370762.db2.gz FTFVTOKMZLFJQJ-CYBMUJFWSA-N 2 0 222.376 2.441 20 0 BEADRP Cc1cc(C[NH2+][C@@H]2CCCC[C@@H]2C[NH3+])cc(C)n1 ZINC000423548891 387371359 /nfs/dbraw/zinc/37/13/59/387371359.db2.gz NAZZABMVZSNTTQ-HUUCEWRRSA-N 2 0 247.386 2.306 20 0 BEADRP CC[C@@H]1C[C@@H]([NH2+][C@@H](C)[C@@H]2CCCC[NH2+]2)CCO1 ZINC000423545638 387371468 /nfs/dbraw/zinc/37/14/68/387371468.db2.gz JTDVKFWQQZYODZ-FQUUOJAGSA-N 2 0 240.391 2.064 20 0 BEADRP CC[C@@H]1C[C@H]([NH2+][C@H]2CCCCC[C@@H]2[NH3+])CCO1 ZINC000423554057 387373333 /nfs/dbraw/zinc/37/33/33/387373333.db2.gz RGMLGIXQYGVVNJ-MQYQWHSLSA-N 2 0 240.391 2.194 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000423555060 387374645 /nfs/dbraw/zinc/37/46/45/387374645.db2.gz XRJOYBLCGVIYSY-RGDJUOJXSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000423566419 387377052 /nfs/dbraw/zinc/37/70/52/387377052.db2.gz ZJQOAGHXODJUEG-REBRKWNGSA-N 2 0 248.370 2.188 20 0 BEADRP CC[C@H]1C[C@H]([NH2+]C2CCC(C[NH3+])CC2)CCO1 ZINC000423561338 387377853 /nfs/dbraw/zinc/37/78/53/387377853.db2.gz VVTHWVUBKOADOH-PQAZSJQKSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000423566421 387378081 /nfs/dbraw/zinc/37/80/81/387378081.db2.gz ZJQOAGHXODJUEG-UQOMUDLDSA-N 2 0 248.370 2.188 20 0 BEADRP C[C@@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1ccccn1 ZINC000423474358 387322612 /nfs/dbraw/zinc/32/26/12/387322612.db2.gz HFZZVPZCMNNBSK-OLZOCXBDSA-N 2 0 233.359 2.264 20 0 BEADRP CCO[C@@H]1C[C@@H]([NH2+]C[C@@H]([NH3+])CC)C1(CC)CC ZINC000423477846 387324029 /nfs/dbraw/zinc/32/40/29/387324029.db2.gz UEKGISGVKANQGH-YNEHKIRRSA-N 2 0 242.407 2.297 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H](C[NH3+])C1)c1ccco1 ZINC000423488897 387333550 /nfs/dbraw/zinc/33/35/50/387333550.db2.gz FJLDNGZDHUBVFO-HBNTYKKESA-N 2 0 208.305 2.058 20 0 BEADRP CCCC[C@H](C)[C@@H](C)[NH2+]C[C@H]1C[NH2+]CCCO1 ZINC000423492163 387335333 /nfs/dbraw/zinc/33/53/33/387335333.db2.gz LYRVASGHYNKSJU-BFHYXJOUSA-N 2 0 242.407 2.169 20 0 BEADRP CC(C)[C@H]([NH2+][C@@H]1CC[C@@H](C[NH3+])C1)c1cccnc1 ZINC000423491905 387335381 /nfs/dbraw/zinc/33/53/81/387335381.db2.gz KRVFQOTZGBWVSR-YUELXQCFSA-N 2 0 247.386 2.496 20 0 BEADRP CC[C@@H](C)C[N@@H+]1CCC[C@@H]([NH+](C)C)CC1 ZINC000372992402 387338401 /nfs/dbraw/zinc/33/84/01/387338401.db2.gz WYOSFVZSHGKXMG-CHWSQXEVSA-N 2 0 212.381 2.449 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[C@@H](C[NH3+])C1)C1CCSCC1 ZINC000423501293 387339934 /nfs/dbraw/zinc/33/99/34/387339934.db2.gz JHVWNAKZXBHWEK-LOWVWBTDSA-N 2 0 242.432 2.235 20 0 BEADRP Cc1ccnc([C@H](C)[NH2+][C@@H]2CC[C@@H](C[NH3+])C2)c1 ZINC000423501312 387340360 /nfs/dbraw/zinc/34/03/60/387340360.db2.gz JKDCLTHCUWRBIX-YNEHKIRRSA-N 2 0 233.359 2.168 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@H](C)[C@H]1C[C@H]1C ZINC000321989896 387345317 /nfs/dbraw/zinc/34/53/17/387345317.db2.gz DWWGNUCUHUVTGH-UPJWGTAASA-N 2 0 212.381 2.351 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H](C)[C@@H]1C[C@H]1C ZINC000322002898 387346746 /nfs/dbraw/zinc/34/67/46/387346746.db2.gz HDLLEAMLQZYHLW-JHJVBQTASA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000423511078 387347496 /nfs/dbraw/zinc/34/74/96/387347496.db2.gz NCNIFGPHGFSHEB-UKRRQHHQSA-N 3 0 249.402 2.184 20 0 BEADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@@H](C2CC2)C2CCC2)C1 ZINC000423511312 387348840 /nfs/dbraw/zinc/34/88/40/387348840.db2.gz PXZWVJVKMGFLBC-LERXQTSPSA-N 2 0 222.376 2.282 20 0 BEADRP CSC1(C[NH2+][C@@H]2CC[N@H+](C)C[C@@H]2C)CCC1 ZINC000304004848 387428002 /nfs/dbraw/zinc/42/80/02/387428002.db2.gz SYEMWLFCOLLZIC-NWDGAFQWSA-N 2 0 242.432 2.202 20 0 BEADRP Cc1ccncc1CCC[N@@H+]1CCC[C@H](O)CC1 ZINC000354750979 387428149 /nfs/dbraw/zinc/42/81/49/387428149.db2.gz XAFLVTKPUJQMRD-HNNXBMFYSA-N 2 0 248.370 2.169 20 0 BEADRP CSC1(C[NH2+]C[C@@H](C)C[NH+]2CCCC2)CC1 ZINC000304255635 387455887 /nfs/dbraw/zinc/45/58/87/387455887.db2.gz IDFDIELMWYERJK-GFCCVEGCSA-N 2 0 242.432 2.204 20 0 BEADRP CC(C)c1cc(C[NH2+][C@H](C)CCCC[NH3+])on1 ZINC000643455027 387392521 /nfs/dbraw/zinc/39/25/21/387392521.db2.gz UFUJYIFHAAVFKI-LLVKDONJSA-N 2 0 239.363 2.405 20 0 BEADRP CC(C)c1cc(C[NH2+][C@@H](C)CCCC[NH3+])on1 ZINC000643455028 387393050 /nfs/dbraw/zinc/39/30/50/387393050.db2.gz UFUJYIFHAAVFKI-NSHDSACASA-N 2 0 239.363 2.405 20 0 BEADRP CO[C@H](C)[C@H](C)[NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1 ZINC000361071065 387396804 /nfs/dbraw/zinc/39/68/04/387396804.db2.gz ZVGFHAZYWLXNTB-MJBXVCDLSA-N 2 0 242.407 2.120 20 0 BEADRP CC[C@H]([NH2+]C[C@@H](C)C1CC1)[C@@H]1CCC[NH2+]1 ZINC000643468352 387419158 /nfs/dbraw/zinc/41/91/58/387419158.db2.gz SYEDNKKBLJKCDK-WXHSDQCUSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCCCC[C@H]1[NH3+])C1CC1 ZINC000643468289 387419363 /nfs/dbraw/zinc/41/93/63/387419363.db2.gz IYGIPPILIMDYQG-RAIGVLPGSA-N 2 0 210.365 2.282 20 0 BEADRP Cc1n[nH]cc1[C@H](C)NC[C@@H]([NH3+])c1ccccc1 ZINC000643508854 387500151 /nfs/dbraw/zinc/50/01/51/387500151.db2.gz JAPOXYAENZSWBM-IINYFYTJSA-N 2 0 244.342 2.069 20 0 BEADRP Cc1ccc([C@H](C)[NH2+]CC[C@@H]2CC[NH2+]C2)c(C)n1 ZINC000643509170 387506519 /nfs/dbraw/zinc/50/65/19/387506519.db2.gz CDFXYYURGZQYSC-JSGCOSHPSA-N 2 0 247.386 2.349 20 0 BEADRP CC(C)OC1CCC([NH2+][C@H]2CCC[C@H]2[NH3+])CC1 ZINC000643475925 387513666 /nfs/dbraw/zinc/51/36/66/387513666.db2.gz XMQVEDDQNQALEH-PQAZSJQKSA-N 2 0 240.391 2.192 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCC[C@@H]1C[NH3+])CC(F)(F)F ZINC000396917959 387515674 /nfs/dbraw/zinc/51/56/74/387515674.db2.gz VXZHOEQCXKNEFM-AEJSXWLSSA-N 2 0 238.297 2.292 20 0 BEADRP CO[C@@H]1CCCC[C@H]1[NH2+]CC[C@H]1CCC[N@@H+]1C ZINC000361748988 387529883 /nfs/dbraw/zinc/52/98/83/387529883.db2.gz CRUKYFZISLRMCM-MGPQQGTHSA-N 2 0 240.391 2.018 20 0 BEADRP C1CC(C([NH2+]C2CC[NH2+]CC2)C2CCC2)C1 ZINC000324828894 387532421 /nfs/dbraw/zinc/53/24/21/387532421.db2.gz URBAMOYOTHVLRE-UHFFFAOYSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]1CC[N@H+](CC2(F)CC2)C[C@@H]1n1ccnc1 ZINC000527220054 387535187 /nfs/dbraw/zinc/53/51/87/387535187.db2.gz RQXBENSFSZHNFW-NEPJUHHUSA-N 2 0 237.322 2.268 20 0 BEADRP CC(C)([NH3+])C[NH2+]C(C1CCC1)C1CCC1 ZINC000324839654 387535853 /nfs/dbraw/zinc/53/58/53/387535853.db2.gz WPASVPLNRWZHID-UHFFFAOYSA-N 2 0 210.365 2.282 20 0 BEADRP COCCC[C@@H](C)[NH2+]C1CCC([NH+](C)C)CC1 ZINC000421892416 387467659 /nfs/dbraw/zinc/46/76/59/387467659.db2.gz ZCFCUQWNCFISSI-IYXRBSQSSA-N 2 0 242.407 2.264 20 0 BEADRP CC(C)[NH+](CCC[NH2+]CC1(C)COC1)C(C)C ZINC000352755219 387471093 /nfs/dbraw/zinc/47/10/93/387471093.db2.gz MIKSFKDNHSIZDE-UHFFFAOYSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H]1CC([NH2+][C@@H]2CCCCC[C@H]2[NH3+])C[C@@H](C)O1 ZINC000516173947 387476849 /nfs/dbraw/zinc/47/68/49/387476849.db2.gz PCRMRBKUSDYQRG-HBJVGIJOSA-N 2 0 240.391 2.192 20 0 BEADRP CO[C@H](C)[C@H](C)[NH2+][C@H](CC[NH+](C)C)C(C)(C)C ZINC000361523834 387480647 /nfs/dbraw/zinc/48/06/47/387480647.db2.gz GWDQUHHTTJKQAR-YNEHKIRRSA-N 2 0 244.423 2.366 20 0 BEADRP C[NH2+][C@H]1CCN(Cc2cccc3cccnc32)C1 ZINC000211644084 387587639 /nfs/dbraw/zinc/58/76/39/387587639.db2.gz DHSZFVKSSQZHKE-AWEZNQCLSA-N 2 0 241.338 2.029 20 0 BEADRP COc1cccc([C@H](C)[NH2+][C@H](C)C[C@@H](C)[NH3+])c1 ZINC000422714721 387628716 /nfs/dbraw/zinc/62/87/16/387628716.db2.gz RIQDJJREDJPIRV-UTUOFQBUSA-N 2 0 236.359 2.472 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]CCCC(F)(F)F ZINC000123893177 387597640 /nfs/dbraw/zinc/59/76/40/387597640.db2.gz SMJKDMUMNOPJIX-VHSXEESVSA-N 2 0 238.297 2.436 20 0 BEADRP CCC([NH3+])(CC)C[NH2+][C@H]1CCC[C@@H](OC)C1 ZINC000643513773 387597722 /nfs/dbraw/zinc/59/77/22/387597722.db2.gz MSGDSLJOMVDWGB-NWDGAFQWSA-N 2 0 228.380 2.051 20 0 BEADRP CC(C)n1cc([C@H](C)[NH2+][C@@H](C)CCC[NH3+])cn1 ZINC000422716662 387628825 /nfs/dbraw/zinc/62/88/25/387628825.db2.gz UVUMOLPHXXGASQ-RYUDHWBXSA-N 2 0 238.379 2.242 20 0 BEADRP C[C@@H](C[NH2+]C(C)(C)CC[NH3+])CC1CCOCC1 ZINC000422559169 387600130 /nfs/dbraw/zinc/60/01/30/387600130.db2.gz CNJXWRRJWLZIAD-GFCCVEGCSA-N 2 0 242.407 2.156 20 0 BEADRP C[C@H](C[NH2+]C(C)(C)CC[NH3+])CC1CCOCC1 ZINC000422559170 387600620 /nfs/dbraw/zinc/60/06/20/387600620.db2.gz CNJXWRRJWLZIAD-LBPRGKRZSA-N 2 0 242.407 2.156 20 0 BEADRP CCC(CC)[C@H](O)C[NH2+][C@H]1CCCCC[C@@H]1[NH3+] ZINC000422700753 387614964 /nfs/dbraw/zinc/61/49/64/387614964.db2.gz ANCRXIVQAYBNEK-MELADBBJSA-N 2 0 242.407 2.033 20 0 BEADRP C[C@@H]1CCCC[C@@H]1OCCN1CCC[C@@H]1C[NH3+] ZINC000430593103 387629522 /nfs/dbraw/zinc/62/95/22/387629522.db2.gz DDPJCMFQLQAVTR-MCIONIFRSA-N 2 0 240.391 2.005 20 0 BEADRP CC[C@@H](Cc1cccs1)[NH2+]C[C@@H]([NH3+])C1CC1 ZINC000643516417 387622946 /nfs/dbraw/zinc/62/29/46/387622946.db2.gz RNBGFFNRNHXVOY-WCQYABFASA-N 2 0 238.400 2.396 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+]C1[C@@H](C)CCC[C@@H]1C ZINC000422708770 387623540 /nfs/dbraw/zinc/62/35/40/387623540.db2.gz YEJHWSODOFMDLG-AVGNSLFASA-N 2 0 242.407 2.155 20 0 BEADRP C[C@]1(C[NH2+][C@H]2C[C@H]([NH3+])c3ccccc32)CCOC1 ZINC000397153315 387547864 /nfs/dbraw/zinc/54/78/64/387547864.db2.gz LIENLMBGBQGXIZ-SOUVJXGZSA-N 2 0 246.354 2.147 20 0 BEADRP Cc1cc(C)c(C[NH2+]CCCC[NH3+])cc1C ZINC000037715491 387564813 /nfs/dbraw/zinc/56/48/13/387564813.db2.gz WHSNTPXJDJPVHM-UHFFFAOYSA-N 2 0 220.360 2.440 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@@H](CN(C)C)c1ccccc1 ZINC000336789918 387578166 /nfs/dbraw/zinc/57/81/66/387578166.db2.gz KDUGFJDPLSSHSZ-ZFWWWQNUSA-N 2 0 249.402 2.006 20 0 BEADRP [NH3+][C@@H](C[NH2+][C@H]1CCCc2ccccc2C1)C1CC1 ZINC000643516687 387630207 /nfs/dbraw/zinc/63/02/07/387630207.db2.gz JWHRNYZQAIAEFY-HOTGVXAUSA-N 2 0 244.382 2.261 20 0 BEADRP CC(C)[C@@H]1CCC[C@H]([NH2+][C@@H](C)C2C[NH2+]C2)C1 ZINC000422722239 387632892 /nfs/dbraw/zinc/63/28/92/387632892.db2.gz XHLVEIOHEXDYKY-SCRDCRAPSA-N 2 0 224.392 2.399 20 0 BEADRP CCc1ccc(CC[N@@H+]2CCC[C@H](C[NH3+])C2)cc1 ZINC000430610691 387633398 /nfs/dbraw/zinc/63/33/98/387633398.db2.gz LJIKLRCNLFBMFW-MRXNPFEDSA-N 2 0 246.398 2.462 20 0 BEADRP CCCC[NH2+][C@@H](C)c1ccc(C[NH3+])nc1C ZINC000422728086 387635146 /nfs/dbraw/zinc/63/51/46/387635146.db2.gz FASCSZXOIZFSGY-JTQLQIEISA-N 2 0 221.348 2.299 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCCC[C@H]1C)[C@@H]1CCC[NH2+]1 ZINC000422726824 387635341 /nfs/dbraw/zinc/63/53/41/387635341.db2.gz GAMKZSUXASMUTL-LPWJVIDDSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]Cc1ccc(F)cc1 ZINC000422726837 387637061 /nfs/dbraw/zinc/63/70/61/387637061.db2.gz GBRLFURZZWMGFV-UWVGGRQHSA-N 2 0 210.296 2.041 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CCCC[C@H]1C)C1C[NH2+]C1 ZINC000422726159 387637093 /nfs/dbraw/zinc/63/70/93/387637093.db2.gz DGOJYWOXTRTAMO-UPJWGTAASA-N 2 0 224.392 2.400 20 0 BEADRP C[NH+](C)[C@H]1CCC[N@H+](C[C@@H]2CCC=CO2)CC1 ZINC000376475691 387637938 /nfs/dbraw/zinc/63/79/38/387637938.db2.gz BPNLQFIYHSROMQ-KBPBESRZSA-N 2 0 238.375 2.095 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@@H](C)[C@@H]1C)C1C[NH2+]C1 ZINC000422729329 387638614 /nfs/dbraw/zinc/63/86/14/387638614.db2.gz KMXFUSMUUJSPGA-BLFANLJRSA-N 2 0 210.365 2.009 20 0 BEADRP Cc1ccoc1C[NH2+]CC1CC[NH+](C)CC1 ZINC000126776765 387695017 /nfs/dbraw/zinc/69/50/17/387695017.db2.gz SMUABXRUHQURHS-UHFFFAOYSA-N 2 0 222.332 2.019 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CC(C)C ZINC000422733793 387640165 /nfs/dbraw/zinc/64/01/65/387640165.db2.gz RIFQHCSFHKIJSO-JTQLQIEISA-N 2 0 221.348 2.155 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CCc1c[nH]c2ccccc12 ZINC000422732984 387640344 /nfs/dbraw/zinc/64/03/44/387640344.db2.gz PYRVXJHJTPAPFB-NWDGAFQWSA-N 2 0 245.370 2.426 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CCc1ccc(F)cc1 ZINC000422735457 387643614 /nfs/dbraw/zinc/64/36/14/387643614.db2.gz UVMPOXMCBDQTGX-WDEREUQCSA-N 2 0 224.323 2.084 20 0 BEADRP CO[C@H](C[NH2+][C@@H]1CCC[C@H]1C[NH3+])c1ccccc1 ZINC000422738672 387645552 /nfs/dbraw/zinc/64/55/52/387645552.db2.gz JSLIVWWHKWPRQL-RRFJBIMHSA-N 2 0 248.370 2.091 20 0 BEADRP CCCCOCCC[NH2+][C@@H]1CCCCC[C@H]1[NH3+] ZINC000422737302 387645889 /nfs/dbraw/zinc/64/58/89/387645889.db2.gz XFRKEXXYIDOSAV-ZIAGYGMSSA-N 2 0 242.407 2.443 20 0 BEADRP CCOc1ccccc1C[NH2+][C@H]1CCC[C@H]1C[NH3+] ZINC000422740515 387647575 /nfs/dbraw/zinc/64/75/75/387647575.db2.gz NQZNOJUCUCTGGG-JSGCOSHPSA-N 2 0 248.370 2.302 20 0 BEADRP CCOc1ccccc1C[NH2+][C@H](C)C[C@@H](C)[NH3+] ZINC000422745429 387649120 /nfs/dbraw/zinc/64/91/20/387649120.db2.gz XQWDWGCYKZTSEJ-VXGBXAGGSA-N 2 0 236.359 2.301 20 0 BEADRP CC[C@H](C)[NH2+][C@H](C)c1ccc(C[NH3+])nc1C ZINC000422746338 387651460 /nfs/dbraw/zinc/65/14/60/387651460.db2.gz NTBJRQNPJNTDLL-VHSXEESVSA-N 2 0 221.348 2.298 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]CCc1ccccc1Cl ZINC000422788511 387653029 /nfs/dbraw/zinc/65/30/29/387653029.db2.gz VMARNGRWBIDXOS-OLZOCXBDSA-N 2 0 238.762 2.352 20 0 BEADRP Cc1ccccc1CC[NH2+][C@@H](C)C[C@@H](C)[NH3+] ZINC000422749865 387656104 /nfs/dbraw/zinc/65/61/04/387656104.db2.gz BFSQIZBMBUCPOP-OLZOCXBDSA-N 2 0 220.360 2.253 20 0 BEADRP Cc1ccc(OCC[NH2+][C@H](C)C[C@H](C)[NH3+])cc1 ZINC000422753888 387657731 /nfs/dbraw/zinc/65/77/31/387657731.db2.gz IYUAUAYUFSUAAD-QWHCGFSZSA-N 2 0 236.359 2.089 20 0 BEADRP C[C@H]([NH2+]CC1=CC[N@H+](C)CC1)[C@@H]1C[C@H]1C1CC1 ZINC000527686843 387657877 /nfs/dbraw/zinc/65/78/77/387657877.db2.gz XTGPEDRPGKZJEF-CQDKDKBSSA-N 2 0 234.387 2.273 20 0 BEADRP COc1ccccc1[C@H](C)[NH2+][C@H](C)C[C@@H](C)[NH3+] ZINC000422753926 387658970 /nfs/dbraw/zinc/65/89/70/387658970.db2.gz JATDGUDWOBOXPK-UTUOFQBUSA-N 2 0 236.359 2.472 20 0 BEADRP Cc1ccc(C[C@H](C)[NH2+][C@H](C)C2C[NH2+]C2)s1 ZINC000422757307 387661004 /nfs/dbraw/zinc/66/10/04/387661004.db2.gz HUZMYKBLTROEOF-GXSJLCMTSA-N 2 0 238.400 2.185 20 0 BEADRP CSCCCC[NH2+][C@H]1CC[NH2+]CC[C@@H]1C ZINC000422758139 387661145 /nfs/dbraw/zinc/66/11/45/387661145.db2.gz NNQYTFCWTWQVHJ-RYUDHWBXSA-N 2 0 230.421 2.107 20 0 BEADRP Cc1ccc(OCC[NH2+][C@@H]2CCC[C@@H]2C[NH3+])cc1 ZINC000422757440 387661416 /nfs/dbraw/zinc/66/14/16/387661416.db2.gz MUBCAQRKROLPJD-UKRRQHHQSA-N 2 0 248.370 2.091 20 0 BEADRP C[C@H]([NH2+]CC1CC[NH+](C)CC1)[C@@H]1C[C@H]1C1CC1 ZINC000527653929 387661533 /nfs/dbraw/zinc/66/15/33/387661533.db2.gz NLSFVQZSNLMUTD-CQDKDKBSSA-N 2 0 236.403 2.352 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)[C@@H]1C[C@H]1C1CC1 ZINC000527656712 387661645 /nfs/dbraw/zinc/66/16/45/387661645.db2.gz JBDSYYVYTCHZHH-UXOAXIEHSA-N 2 0 236.403 2.352 20 0 BEADRP CCc1ccc(CC[N@@H+]2CC[C@H](C[NH3+])C2)cc1 ZINC000430924476 387661872 /nfs/dbraw/zinc/66/18/72/387661872.db2.gz IHYWJEMLJLRUAW-OAHLLOKOSA-N 2 0 232.371 2.072 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCc2ccccc2C1 ZINC000422761419 387663260 /nfs/dbraw/zinc/66/32/60/387663260.db2.gz RHLBSTJGDFSORN-KFWWJZLASA-N 2 0 230.355 2.013 20 0 BEADRP CCc1ccc(CC[N@@H+]2CC[C@H]([NH3+])[C@@H](C)C2)cc1 ZINC000430953863 387663513 /nfs/dbraw/zinc/66/35/13/387663513.db2.gz DBSYYHOIQGLIPA-BBRMVZONSA-N 2 0 246.398 2.461 20 0 BEADRP [NH3+]CC1CCC([NH2+]CCOC2CCCC2)CC1 ZINC000422762342 387663693 /nfs/dbraw/zinc/66/36/93/387663693.db2.gz MRWZTZXOOLTZOJ-UHFFFAOYSA-N 2 0 240.391 2.053 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+]CCOc1ccccc1 ZINC000422761200 387663799 /nfs/dbraw/zinc/66/37/99/387663799.db2.gz QWEODVWJDSIJAE-ZFWWWQNUSA-N 2 0 248.370 2.043 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+][C@H]1CCc2ccccc2C1 ZINC000422761422 387664026 /nfs/dbraw/zinc/66/40/26/387664026.db2.gz RHLBSTJGDFSORN-ZNMIVQPWSA-N 2 0 230.355 2.013 20 0 BEADRP C[C@@H]1CCC[C@H](C[NH2+][C@@H]2CCC[C@H]2[NH3+])C1 ZINC000422765641 387666086 /nfs/dbraw/zinc/66/60/86/387666086.db2.gz QZNDPTWWBPRSIL-YVECIDJPSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)[C@@H](C)C[NH2+][C@@H](C)[C@@H]1CCCC[NH2+]1 ZINC000422773170 387669950 /nfs/dbraw/zinc/66/99/50/387669950.db2.gz TWAVFVOTNYPPMK-AVGNSLFASA-N 2 0 212.381 2.399 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CCOC1CCCCCC1 ZINC000422770003 387670066 /nfs/dbraw/zinc/67/00/66/387670066.db2.gz WCQSOUVFDBECCR-QWHCGFSZSA-N 2 0 242.407 2.441 20 0 BEADRP CC(C)[C@H](C)C[NH2+]C1CCC(C[NH3+])CC1 ZINC000422773196 387670266 /nfs/dbraw/zinc/67/02/66/387670266.db2.gz TZRNAGNWXBUMMK-PNESKVBLSA-N 2 0 212.381 2.386 20 0 BEADRP CC(C)[C@H](C)C[NH2+][C@@H]1CC[NH2+]CC[C@@H]1C ZINC000422772767 387670447 /nfs/dbraw/zinc/67/04/47/387670447.db2.gz SVINCNQCXLYDNY-YNEHKIRRSA-N 2 0 212.381 2.256 20 0 BEADRP CC[C@@H](COC)[NH2+][C@H](CC[NH+](C)C)C(C)(C)C ZINC000125997556 387671260 /nfs/dbraw/zinc/67/12/60/387671260.db2.gz KYNWBZZUHHIEKF-QWHCGFSZSA-N 2 0 244.423 2.367 20 0 BEADRP Cc1ccccc1C[NH2+][C@H](C)C[C@@H](C)[NH3+] ZINC000422770625 387671327 /nfs/dbraw/zinc/67/13/27/387671327.db2.gz UYIRLGUQRYHJGZ-VXGBXAGGSA-N 2 0 206.333 2.210 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]CCCOCC1CC1 ZINC000422780032 387679462 /nfs/dbraw/zinc/67/94/62/387679462.db2.gz GQSIKYSVFIMZNE-ZIAGYGMSSA-N 2 0 240.391 2.053 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+]CC1=CC[NH2+]CC1 ZINC000643520148 387679645 /nfs/dbraw/zinc/67/96/45/387679645.db2.gz POELSGKDZIPQMQ-GFCCVEGCSA-N 2 0 234.343 2.110 20 0 BEADRP CC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccncc1 ZINC000422781810 387679895 /nfs/dbraw/zinc/67/98/95/387679895.db2.gz KYIHKZSRRNPNEV-IZGVIRRGSA-N 2 0 245.370 2.405 20 0 BEADRP Cc1cccc([C@@H](C)C[NH2+][C@H](C)C2C[NH2+]C2)c1 ZINC000422781033 387680715 /nfs/dbraw/zinc/68/07/15/387680715.db2.gz JZXBAHFTAQORDS-QWHCGFSZSA-N 2 0 232.371 2.296 20 0 BEADRP CC(C)COCCC[NH2+][C@@H]1CCCCC[C@H]1[NH3+] ZINC000422781382 387681723 /nfs/dbraw/zinc/68/17/23/387681723.db2.gz ITNLZLLBXWRWFT-ZIAGYGMSSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)C1CCCCC1)C1C[NH2+]C1 ZINC000422784766 387683769 /nfs/dbraw/zinc/68/37/69/387683769.db2.gz OLYPHYDKKSOLQP-WDEREUQCSA-N 2 0 210.365 2.153 20 0 BEADRP Cc1cc(C)cc(CC[NH2+][C@@H](C)C2C[NH2+]C2)c1 ZINC000422785140 387684463 /nfs/dbraw/zinc/68/44/63/387684463.db2.gz OZMDDISLIOUSIW-ZDUSSCGKSA-N 2 0 232.371 2.043 20 0 BEADRP C[C@H]([NH2+][C@@H](C)C1CCCCC1)C1C[NH2+]C1 ZINC000422784765 387684505 /nfs/dbraw/zinc/68/45/05/387684505.db2.gz OLYPHYDKKSOLQP-QWRGUYRKSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH2+]CC1CC[NH+](C)CC1)c1ccco1 ZINC000044515655 387684999 /nfs/dbraw/zinc/68/49/99/387684999.db2.gz GBECDCZEHXOACT-NSHDSACASA-N 2 0 222.332 2.272 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CCCOC1CCCCC1 ZINC000422786929 387686436 /nfs/dbraw/zinc/68/64/36/387686436.db2.gz PHUIBKAGDFKOKW-OLZOCXBDSA-N 2 0 242.407 2.441 20 0 BEADRP COc1ccc(CCC[NH2+][C@@H]2CCC[C@@H]2[NH3+])cc1 ZINC000422744182 387688612 /nfs/dbraw/zinc/68/86/12/387688612.db2.gz VQBMRVHXQNUSKX-LSDHHAIUSA-N 2 0 248.370 2.097 20 0 BEADRP Cc1ccc([C@H](C)[NH2+]CC2=CC[NH2+]CC2)c(C)n1 ZINC000643520312 387691058 /nfs/dbraw/zinc/69/10/58/387691058.db2.gz KFRAYVRCDBQENX-LBPRGKRZSA-N 2 0 245.370 2.269 20 0 BEADRP CCc1ccccc1C[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000422790581 387692944 /nfs/dbraw/zinc/69/29/44/387692944.db2.gz VBGKFUMGDQOELI-RYUDHWBXSA-N 2 0 220.360 2.464 20 0 BEADRP C1C[C@@H]([NH2+][C@@H]2CC[C@@H]3CCCC[C@@H]3C2)C[NH2+]1 ZINC000422792377 387693453 /nfs/dbraw/zinc/69/34/53/387693453.db2.gz DQEKDOYOTGQRDT-REWJHTLYSA-N 2 0 222.376 2.297 20 0 BEADRP [NH3+]CC1CCC([NH2+]Cc2ccsc2)CC1 ZINC000422859958 387743614 /nfs/dbraw/zinc/74/36/14/387743614.db2.gz KSSCCYMZJLPHAA-UHFFFAOYSA-N 2 0 224.373 2.355 20 0 BEADRP COc1cc(C)ccc1C[NH2+][C@@H]1CCC[C@H]1C[NH3+] ZINC000422872254 387748833 /nfs/dbraw/zinc/74/88/33/387748833.db2.gz GINHAFOZPLQMLI-GXTWGEPZSA-N 2 0 248.370 2.221 20 0 BEADRP CO[C@H](C)[C@@H](C)[NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000128532290 387749592 /nfs/dbraw/zinc/74/95/92/387749592.db2.gz YETHDJPOROILNJ-GHMZBOCLSA-N 2 0 242.407 2.309 20 0 BEADRP CO[C@@H](C)[C@H](C)[NH2+]CCC[NH+]1CCC(C)CC1 ZINC000128592884 387750644 /nfs/dbraw/zinc/75/06/44/387750644.db2.gz SBKDAWBAJXUAMZ-KBPBESRZSA-N 2 0 242.407 2.121 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000422872310 387752210 /nfs/dbraw/zinc/75/22/10/387752210.db2.gz GNVKNQUDYPHVDQ-YIPFDTCYSA-N 2 0 222.376 2.438 20 0 BEADRP CC[C@@H]1CCC[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000422872309 387752277 /nfs/dbraw/zinc/75/22/77/387752277.db2.gz GNVKNQUDYPHVDQ-SYCZCVCYSA-N 2 0 222.376 2.438 20 0 BEADRP C[C@@]1(C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)CCCS1 ZINC000422874638 387753345 /nfs/dbraw/zinc/75/33/45/387753345.db2.gz OARFCPQSTSSPNH-HNGCFSAESA-N 2 0 240.416 2.145 20 0 BEADRP C[C@]1(C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)CCCS1 ZINC000422874639 387753622 /nfs/dbraw/zinc/75/36/22/387753622.db2.gz OARFCPQSTSSPNH-ZGVCCVRISA-N 2 0 240.416 2.145 20 0 BEADRP Cc1cccc(C[NH2+][C@@H](C)C[C@@H](C)[NH3+])c1 ZINC000422801497 387702350 /nfs/dbraw/zinc/70/23/50/387702350.db2.gz FOTKQBFYUHLZKG-NEPJUHHUSA-N 2 0 206.333 2.210 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]Cc1cccc(F)c1 ZINC000422805569 387705271 /nfs/dbraw/zinc/70/52/71/387705271.db2.gz JMLPLGGWTPRHRT-VHSXEESVSA-N 2 0 210.296 2.041 20 0 BEADRP COCc1ccc(C[NH2+][C@@H](C)C[C@@H](C)[NH3+])cc1 ZINC000422807006 387706446 /nfs/dbraw/zinc/70/64/46/387706446.db2.gz LOMJRABGOLZIOT-NEPJUHHUSA-N 2 0 236.359 2.048 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@@H](C)Cc1cccs1 ZINC000422809409 387707617 /nfs/dbraw/zinc/70/76/17/387707617.db2.gz PQLCXJTXHUUGCC-AXFHLTTASA-N 2 0 226.389 2.395 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]CC1(c2ccccc2)CC1 ZINC000422808432 387708862 /nfs/dbraw/zinc/70/88/62/387708862.db2.gz LDKNQQHAVSBAAC-ZIAGYGMSSA-N 2 0 230.355 2.188 20 0 BEADRP CCSCC[C@H](C)[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000422812433 387710532 /nfs/dbraw/zinc/71/05/32/387710532.db2.gz WGEUAHVWEAPNGA-DCAQKATOSA-N 2 0 218.410 2.234 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CC1(c2ccccc2)CC1 ZINC000422813785 387711820 /nfs/dbraw/zinc/71/18/20/387711820.db2.gz SJNODHNSEFVEQE-OLZOCXBDSA-N 2 0 232.371 2.434 20 0 BEADRP COCc1ccccc1C[NH2+][C@H](C)C[C@H](C)[NH3+] ZINC000422812660 387712249 /nfs/dbraw/zinc/71/22/49/387712249.db2.gz YDPMDFIMESNQLB-NWDGAFQWSA-N 2 0 236.359 2.048 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]CC1(c2ccccc2)CC1 ZINC000422816194 387714073 /nfs/dbraw/zinc/71/40/73/387714073.db2.gz ZIENQSPDUCPRSK-ZFWWWQNUSA-N 2 0 244.382 2.435 20 0 BEADRP C[C@H]([NH2+][C@@H](C)C1C[NH2+]C1)[C@@H](C)c1ccccc1 ZINC000422817835 387714110 /nfs/dbraw/zinc/71/41/10/387714110.db2.gz DXRTWTCVZKKCEA-AGIUHOORSA-N 2 0 232.371 2.376 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+][C@H]1CCCSC1 ZINC000422814726 387714437 /nfs/dbraw/zinc/71/44/37/387714437.db2.gz ACIPDDUGKRKPME-TUAOUCFPSA-N 2 0 228.405 2.132 20 0 BEADRP CCS[C@@H]1CCC[C@H]([NH2+][C@H](C)C2C[NH2+]C2)C1 ZINC000422820417 387717624 /nfs/dbraw/zinc/71/76/24/387717624.db2.gz QMANJIOBHPQBHS-KGYLQXTDSA-N 2 0 242.432 2.248 20 0 BEADRP CCS[C@@H]1CCC[C@@H]([NH2+][C@H](C)C2C[NH2+]C2)C1 ZINC000422820418 387718543 /nfs/dbraw/zinc/71/85/43/387718543.db2.gz QMANJIOBHPQBHS-RAIGVLPGSA-N 2 0 242.432 2.248 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCC[NH2+]CC1)C1CCSCC1 ZINC000643522572 387719238 /nfs/dbraw/zinc/71/92/38/387719238.db2.gz PNMJAISLZFFNCE-YPMHNXCESA-N 2 0 242.432 2.250 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+][C@H]2CCC[NH2+]CC2)c(C)n1 ZINC000643522987 387725715 /nfs/dbraw/zinc/72/57/15/387725715.db2.gz VJOXCSDAAAAHBY-KGLIPLIRSA-N 2 0 247.386 2.491 20 0 BEADRP C1CC([C@H]2CC[C@H]2[NH2+][C@@H]2CCC[NH2+]CC2)C1 ZINC000643522879 387725883 /nfs/dbraw/zinc/72/58/83/387725883.db2.gz UFIVGUJALDAIKB-MGPQQGTHSA-N 2 0 222.376 2.297 20 0 BEADRP Cc1cc(C[NH2+][C@H](C)C[C@@H](C)[NH3+])ccc1F ZINC000422789683 387731816 /nfs/dbraw/zinc/73/18/16/387731816.db2.gz BKZLHXBQMLPSON-GHMZBOCLSA-N 2 0 224.323 2.350 20 0 BEADRP CC(C)CCOCC[NH2+][C@@H]1CCCCC[C@H]1[NH3+] ZINC000422788943 387732154 /nfs/dbraw/zinc/73/21/54/387732154.db2.gz WFHCSKMGLITYLM-ZIAGYGMSSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CCc1cc(F)cc(F)c1 ZINC000422842233 387732361 /nfs/dbraw/zinc/73/23/61/387732361.db2.gz FLLRRXQAGPVGRR-ZJUUUORDSA-N 2 0 242.313 2.223 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@H]([NH3+])C1)c1ccoc1 ZINC000643523950 387733984 /nfs/dbraw/zinc/73/39/84/387733984.db2.gz PMNHFGBUSYHAKF-DLOVCJGASA-N 2 0 208.305 2.200 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@H]2CCCc3cccnc32)C1 ZINC000643524090 387736090 /nfs/dbraw/zinc/73/60/90/387736090.db2.gz HDHFVTKIZIWUNC-MCIONIFRSA-N 2 0 245.370 2.319 20 0 BEADRP Cc1ccc([C@H](C)[NH2+][C@H]2CC[NH2+]C[C@H]2C)c(C)n1 ZINC000643524913 387740003 /nfs/dbraw/zinc/74/00/03/387740003.db2.gz WXBPPUUHUSJOEW-DGFSRKRXSA-N 2 0 247.386 2.347 20 0 BEADRP Cc1ccccc1C(C)(C)C[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000422857275 387742251 /nfs/dbraw/zinc/74/22/51/387742251.db2.gz GPYQZLMPPLBULJ-ZDUSSCGKSA-N 2 0 246.398 2.470 20 0 BEADRP CC(C)C[C@H](C)C[C@@H](C)[NH2+]C[C@H](C)[NH3+] ZINC000643527122 387763274 /nfs/dbraw/zinc/76/32/74/387763274.db2.gz JYVUJTRHRQSIQS-SDDRHHMPSA-N 2 0 200.370 2.384 20 0 BEADRP CC(C)c1csc(C[NH2+][C@@H](C)CCC[NH3+])n1 ZINC000422893746 387763527 /nfs/dbraw/zinc/76/35/27/387763527.db2.gz RDKGWKDOQFRXDF-JTQLQIEISA-N 2 0 241.404 2.484 20 0 BEADRP C[C@H](CCc1ccccc1F)[NH2+]C[C@H](C)[NH3+] ZINC000643528326 387767483 /nfs/dbraw/zinc/76/74/83/387767483.db2.gz HAUVSKVRIFENCT-WDEREUQCSA-N 2 0 224.323 2.084 20 0 BEADRP C[N@@H+]1CC[C@]2(CC[NH+](CC3=CCCC3)C2)C1 ZINC000645922182 387767929 /nfs/dbraw/zinc/76/79/29/387767929.db2.gz HKIGDKAWUUUWOG-AWEZNQCLSA-N 2 0 220.360 2.124 20 0 BEADRP C[C@@H]([NH2+]CC(C)(C)Cc1ccccc1)C1C[NH2+]C1 ZINC000422910983 387768782 /nfs/dbraw/zinc/76/87/82/387768782.db2.gz JSBRTOFICGOXQO-CYBMUJFWSA-N 2 0 246.398 2.453 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCc2ccccc21)[C@@H]1CCC[NH2+]1 ZINC000422909019 387768923 /nfs/dbraw/zinc/76/89/23/387768923.db2.gz NITNSTQYKYTYMU-NOLJZWGESA-N 2 0 244.382 2.447 20 0 BEADRP Cc1cccc(C[C@H]([NH2+]C[C@H](C)[NH3+])C2CC2)c1 ZINC000643528660 387769811 /nfs/dbraw/zinc/76/98/11/387769811.db2.gz MORVMGXQTJWMLT-WFASDCNBSA-N 2 0 232.371 2.253 20 0 BEADRP COc1cccc(C2([NH2+][C@@H](C)CCC[NH3+])CC2)c1 ZINC000422959444 387811963 /nfs/dbraw/zinc/81/19/63/387811963.db2.gz RZUHJMWXILVJQZ-LBPRGKRZSA-N 2 0 248.370 2.401 20 0 BEADRP c1ccc(C[C@@H]([NH2+]C2CC[NH2+]CC2)C2CC2)cc1 ZINC000422912030 387771084 /nfs/dbraw/zinc/77/10/84/387771084.db2.gz MERZZCDGCOQOHV-MRXNPFEDSA-N 2 0 244.382 2.349 20 0 BEADRP Cc1ccc(CC[C@@H](C)[NH2+]C[C@@H](C)[NH3+])cc1 ZINC000643528745 387771937 /nfs/dbraw/zinc/77/19/37/387771937.db2.gz ODQCLZJQHWOEKI-CHWSQXEVSA-N 2 0 220.360 2.253 20 0 BEADRP C[C@H]([NH3+])C[NH2+][C@@H]1CCC[C@@H]1c1ccccc1 ZINC000643529022 387772642 /nfs/dbraw/zinc/77/26/42/387772642.db2.gz SUURVMGGPLSQCF-IACUBPJLSA-N 2 0 218.344 2.260 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]Cc1cnc2ccccc2c1 ZINC000422915793 387773464 /nfs/dbraw/zinc/77/34/64/387773464.db2.gz ZAAPOTFLOMUFAM-RYUDHWBXSA-N 2 0 243.354 2.450 20 0 BEADRP CCC1(C[NH2+][C@@H]2CCCCC[C@@H]2[NH3+])CC1 ZINC000422918613 387773628 /nfs/dbraw/zinc/77/36/28/387773628.db2.gz HUICXQIOTIJKFQ-NWDGAFQWSA-N 2 0 210.365 2.426 20 0 BEADRP CCC1(C[NH2+][C@H]2CCCCC[C@@H]2[NH3+])CC1 ZINC000422918614 387773636 /nfs/dbraw/zinc/77/36/36/387773636.db2.gz HUICXQIOTIJKFQ-RYUDHWBXSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@@H]([NH2+]CCc1cc2ccccc2o1)C1C[NH2+]C1 ZINC000422917009 387773657 /nfs/dbraw/zinc/77/36/57/387773657.db2.gz FFIGLQUXZASTLQ-LLVKDONJSA-N 2 0 244.338 2.173 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CC1(C)CC1 ZINC000422917127 387774078 /nfs/dbraw/zinc/77/40/78/387774078.db2.gz CNGUGESCOUFINH-JTQLQIEISA-N 2 0 233.359 2.299 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CCc1cccc(F)c1F ZINC000422961016 387812233 /nfs/dbraw/zinc/81/22/33/387812233.db2.gz YDRJDAAVLFPSGC-VHSXEESVSA-N 2 0 242.313 2.223 20 0 BEADRP CCC1(C[NH2+]C2CCC(C[NH3+])CC2)CC1 ZINC000422919074 387775534 /nfs/dbraw/zinc/77/55/34/387775534.db2.gz JBZZCQMUCQAXTD-UHFFFAOYSA-N 2 0 210.365 2.284 20 0 BEADRP CCC[C@@H](Cc1ccccc1)[NH2+]C[C@H](C)[NH3+] ZINC000643529320 387777102 /nfs/dbraw/zinc/77/71/02/387777102.db2.gz YNLWHDNZFRAJMI-JSGCOSHPSA-N 2 0 220.360 2.335 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1C[C@@H]1Cc1ccccc1 ZINC000422926614 387779052 /nfs/dbraw/zinc/77/90/52/387779052.db2.gz XBQPMZCSVZZFBH-YHUYYLMFSA-N 2 0 244.382 2.335 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@H]1C[C@H]1Cc1ccccc1 ZINC000422926663 387779576 /nfs/dbraw/zinc/77/95/76/387779576.db2.gz XGPPJCQSYMDSDG-VIRABCJISA-N 2 0 232.371 2.333 20 0 BEADRP C[C@H]([NH2+]CC1(C)CCCCC1)C1C[NH2+]C1 ZINC000422930619 387780648 /nfs/dbraw/zinc/78/06/48/387780648.db2.gz VGCNEWSUAPVVBG-NSHDSACASA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@@H](C)O[C@@H](C)C1)[C@@H]1CCCC[NH2+]1 ZINC000643477783 387781601 /nfs/dbraw/zinc/78/16/01/387781601.db2.gz SPPVTESGEFCQHW-NDKCEZKHSA-N 2 0 240.391 2.063 20 0 BEADRP [NH3+][C@H]1CCCCC[C@H]1[NH2+]CC1(C2CC2)CC1 ZINC000422932631 387782180 /nfs/dbraw/zinc/78/21/80/387782180.db2.gz GDSHQDFFSHTLDX-QWHCGFSZSA-N 2 0 222.376 2.426 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]CC1(C2CC2)CC1 ZINC000422937757 387782730 /nfs/dbraw/zinc/78/27/30/387782730.db2.gz OPWOBFKZMOXHQJ-DGCLKSJQSA-N 2 0 222.376 2.154 20 0 BEADRP C[C@H]([NH2+]C1(c2ccccc2)CCC1)C1C[NH2+]C1 ZINC000422937970 387783529 /nfs/dbraw/zinc/78/35/29/387783529.db2.gz KGQNSBBDLLAFEV-LBPRGKRZSA-N 2 0 230.355 2.263 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+]C1(c2ccccc2)CC1 ZINC000422944153 387784773 /nfs/dbraw/zinc/78/47/73/387784773.db2.gz ZGXHPISOWZFHHY-CQSZACIVSA-N 2 0 248.370 2.019 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CC1Cc2ccccc2C1 ZINC000422977797 387789456 /nfs/dbraw/zinc/78/94/56/387789456.db2.gz GGCKFTRPKVYZKO-GFCCVEGCSA-N 2 0 232.371 2.118 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@@H]1CCc2c1cccc2O ZINC000422981460 387793339 /nfs/dbraw/zinc/79/33/39/387793339.db2.gz SWVCEXZTWDJUBS-OPQQBVKSSA-N 2 0 234.343 2.095 20 0 BEADRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]CC1Cc2ccccc2C1 ZINC000422983626 387794383 /nfs/dbraw/zinc/79/43/83/387794383.db2.gz UJJXSTRZRLZHOU-CVEARBPZSA-N 2 0 244.382 2.118 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CCC[C@H]1CCCC[C@H]1O ZINC000422988945 387797337 /nfs/dbraw/zinc/79/73/37/387797337.db2.gz JYCSKAKYMGBRES-MGPQQGTHSA-N 2 0 242.407 2.035 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]CCc1ccc(O)cc1 ZINC000422990779 387799459 /nfs/dbraw/zinc/79/94/59/387799459.db2.gz NYTZLLBGKBDPKG-CABCVRRESA-N 2 0 248.370 2.184 20 0 BEADRP CCC(CC)[C@H](CC[NH2+][C@H]1CCC[C@H]1[NH3+])OC ZINC000422991536 387800147 /nfs/dbraw/zinc/80/01/47/387800147.db2.gz BLWFJPORXGOSSB-RDBSUJKOSA-N 2 0 242.407 2.297 20 0 BEADRP CSc1cc(C[NH2+][C@@H](C)CCC[NH3+])ccn1 ZINC000422991701 387800692 /nfs/dbraw/zinc/80/06/92/387800692.db2.gz PDGNRALEPXAOTR-JTQLQIEISA-N 2 0 239.388 2.021 20 0 BEADRP CC(C)=CC[N@@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000152484099 387801952 /nfs/dbraw/zinc/80/19/52/387801952.db2.gz ZRSQSFWIABCRTH-CYBMUJFWSA-N 2 0 210.365 2.226 20 0 BEADRP COc1cccc(CCC[NH2+][C@H]2CCC[C@@H]2[NH3+])c1 ZINC000422949482 387807751 /nfs/dbraw/zinc/80/77/51/387807751.db2.gz VGFBBEZNNWKGEH-GJZGRUSLSA-N 2 0 248.370 2.097 20 0 BEADRP CCn1ccnc1CNc1ncccc1C ZINC000309497250 387808881 /nfs/dbraw/zinc/80/88/81/387808881.db2.gz YTKLWKCZWWISMA-UHFFFAOYSA-N 2 0 216.288 2.219 20 0 BEADRP CC1(C)C[C@@H]1C[NH2+][C@@H]1CCCCC[C@@H]1[NH3+] ZINC000422956270 387809001 /nfs/dbraw/zinc/80/90/01/387809001.db2.gz OZFNUNBRVGNVCS-GRYCIOLGSA-N 2 0 210.365 2.282 20 0 BEADRP COC[C@@H]([NH2+][C@H](C)CCC[NH3+])c1ccccc1 ZINC000422956676 387809381 /nfs/dbraw/zinc/80/93/81/387809381.db2.gz QDXBSYQYOAOUNM-TZMCWYRMSA-N 2 0 236.359 2.091 20 0 BEADRP C[C@@H](CCc1ccco1)[NH2+][C@@H](C)[C@@H]1CCC[NH2+]1 ZINC000422961981 387811606 /nfs/dbraw/zinc/81/16/06/387811606.db2.gz DRRIMISLMSPQNS-OBJOEFQTSA-N 2 0 236.359 2.331 20 0 BEADRP C[C@H]([NH2+]CCC1CC[NH+](C)CC1)[C@H]1CC12CC2 ZINC000527857894 387758544 /nfs/dbraw/zinc/75/85/44/387758544.db2.gz FIFWLDHAAQFNOF-GXTWGEPZSA-N 2 0 236.403 2.497 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)[C@@H]2CC23CC3)C1 ZINC000527855962 387758645 /nfs/dbraw/zinc/75/86/45/387758645.db2.gz XKJUXRAHAQPYRP-MJBXVCDLSA-N 2 0 236.403 2.497 20 0 BEADRP CC[C@H](Cc1cccs1)[NH2+]C[C@@H](C)[NH3+] ZINC000643526859 387760380 /nfs/dbraw/zinc/76/03/80/387760380.db2.gz AUTONPBYJQLUJJ-NXEZZACHSA-N 2 0 212.362 2.006 20 0 BEADRP Cc1nc(CC[NH2+][C@H](C)C[C@@H](C)[NH3+])sc1C ZINC000422889364 387760546 /nfs/dbraw/zinc/76/05/46/387760546.db2.gz GBUOJFTZKCLMKI-RKDXNWHRSA-N 2 0 241.404 2.018 20 0 BEADRP C[C@H]([NH3+])C[NH2+][C@H]1CC[C@@H](c2ccccc2)C1 ZINC000643526735 387760806 /nfs/dbraw/zinc/76/08/06/387760806.db2.gz FQEZWUVPXFOSJF-YUTCNCBUSA-N 2 0 218.344 2.260 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@@H](C)Cc1ccc(O)cc1 ZINC000422972610 387821223 /nfs/dbraw/zinc/82/12/23/387821223.db2.gz MITLZOUAVIKNQT-RYUDHWBXSA-N 2 0 236.359 2.040 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CC=CCC1)[C@@H]1CCC[NH2+]1 ZINC000422972552 387822131 /nfs/dbraw/zinc/82/21/31/387822131.db2.gz MCRKSBSPNHELHB-UPJWGTAASA-N 2 0 208.349 2.073 20 0 BEADRP CC(C)[C@H](O)C(C)(C)C[NH2+][C@@H](C)CCCC[NH3+] ZINC000423006618 387828022 /nfs/dbraw/zinc/82/80/22/387828022.db2.gz WBDGFIJYTJIBEQ-STQMWFEESA-N 2 0 244.423 2.137 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CC1(C2CC2)CCC1 ZINC000423008231 387830781 /nfs/dbraw/zinc/83/07/81/387830781.db2.gz ZLFBRUZMVDURIG-QWRGUYRKSA-N 2 0 210.365 2.282 20 0 BEADRP CC[C@@H](C)[C@H]([NH3+])C(=O)Nc1ccc([C@H](C)[NH3+])cc1 ZINC000442732059 387830931 /nfs/dbraw/zinc/83/09/31/387830931.db2.gz USDHWQPKHDGZCK-NRUUGDAUSA-N 2 0 249.358 2.018 20 0 BEADRP CC(C)CSCC[NH2+][C@@H]1CC[NH2+]CC[C@@H]1C ZINC000423008445 387831032 /nfs/dbraw/zinc/83/10/32/387831032.db2.gz AHKPTVBBXWRHSU-QWHCGFSZSA-N 2 0 244.448 2.353 20 0 BEADRP C[C@H]([NH2+][C@@H](c1cccnc1)C1CC1)[C@H]1CC[NH2+]C1 ZINC000423009475 387832969 /nfs/dbraw/zinc/83/29/69/387832969.db2.gz CXWMAHPTRNOXPI-CORIIIEPSA-N 2 0 245.370 2.120 20 0 BEADRP C[C@H]([NH2+]CC1CCC(C)(C)CC1)C1C[NH2+]C1 ZINC000423010719 387834321 /nfs/dbraw/zinc/83/43/21/387834321.db2.gz HGUIDVBGFRGJNL-NSHDSACASA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]Cc1ccc(Cl)cn1 ZINC000423011619 387834536 /nfs/dbraw/zinc/83/45/36/387834536.db2.gz BDONVRVZPUOBKF-SNVBAGLBSA-N 2 0 241.766 2.342 20 0 BEADRP CCc1cnccc1[C@H](C)[NH2+][C@@H](C)CCC[NH3+] ZINC000423012627 387835671 /nfs/dbraw/zinc/83/56/71/387835671.db2.gz DHNYHSQNXJFDGG-RYUDHWBXSA-N 2 0 235.375 2.422 20 0 BEADRP CC(C)CSCC[NH2+][C@H](C)C[C@H](C)[NH3+] ZINC000423012171 387836321 /nfs/dbraw/zinc/83/63/21/387836321.db2.gz KEPWUQMNBSBKCT-WDEREUQCSA-N 2 0 218.410 2.091 20 0 BEADRP CCc1cnccc1[C@H](C)[NH2+][C@H](C)CCC[NH3+] ZINC000423012625 387836636 /nfs/dbraw/zinc/83/66/36/387836636.db2.gz DHNYHSQNXJFDGG-NEPJUHHUSA-N 2 0 235.375 2.422 20 0 BEADRP Cc1ccsc1CC[NH2+][C@H](C)CCC[NH3+] ZINC000423015188 387838673 /nfs/dbraw/zinc/83/86/73/387838673.db2.gz KFGGILPEGIHEPS-LLVKDONJSA-N 2 0 226.389 2.316 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC1(C)C)[C@@H]1CCCC[NH2+]1 ZINC000423027122 387844155 /nfs/dbraw/zinc/84/41/55/387844155.db2.gz OHZLVFQWMIGWAH-SDDRHHMPSA-N 2 0 210.365 2.295 20 0 BEADRP CC(C)OCCCC[NH2+][C@@H]1CC[NH2+]CC[C@H]1C ZINC000423031533 387847127 /nfs/dbraw/zinc/84/71/27/387847127.db2.gz LGBGSPBQFUXURI-ZIAGYGMSSA-N 2 0 242.407 2.169 20 0 BEADRP C[C@@H]([NH2+]C[C@H](C)C[NH+]1CCCC1)C1(C)CC1 ZINC000062078308 387849445 /nfs/dbraw/zinc/84/94/45/387849445.db2.gz QKXHHRZJTHTSHS-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)OCCCC[NH2+][C@H]1CCCCC[C@@H]1[NH3+] ZINC000423036394 387850657 /nfs/dbraw/zinc/85/06/57/387850657.db2.gz TYSYJHMCNSBAGF-KBPBESRZSA-N 2 0 242.407 2.441 20 0 BEADRP COC1CCC(CC[NH2+][C@H](C)C[C@H](C)[NH3+])CC1 ZINC000423036695 387850958 /nfs/dbraw/zinc/85/09/58/387850958.db2.gz LHKVAFMZXAKUFM-MRFVTOPCSA-N 2 0 242.407 2.297 20 0 BEADRP Cc1csc([C@@H](C)C[NH2+][C@@H](C)CCC[NH3+])n1 ZINC000423036363 387851520 /nfs/dbraw/zinc/85/15/20/387851520.db2.gz KWJMPGWXNPTXGL-UWVGGRQHSA-N 2 0 241.404 2.272 20 0 BEADRP COCCC(C)(C)C[NH2+][C@@H]1CCCCC[C@@H]1[NH3+] ZINC000423035711 387851775 /nfs/dbraw/zinc/85/17/75/387851775.db2.gz JTMZRWIJHNPWBT-QWHCGFSZSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1ccco1 ZINC000643534513 387852238 /nfs/dbraw/zinc/85/22/38/387852238.db2.gz WQUYDBJIIYEGJB-JQWIXIFHSA-N 2 0 220.316 2.072 20 0 BEADRP COC1CCC(CC[NH2+][C@@H]2CCC[C@@H]2[NH3+])CC1 ZINC000423039514 387852902 /nfs/dbraw/zinc/85/29/02/387852902.db2.gz QORPWIHMWBKOFR-CLRIEMFWSA-N 2 0 240.391 2.051 20 0 BEADRP CS[C@H](C[NH2+][C@@H](C)CCC[NH3+])C(C)(C)C ZINC000423038685 387854032 /nfs/dbraw/zinc/85/40/32/387854032.db2.gz YZHHXXKWHIBYRK-WDEREUQCSA-N 2 0 232.437 2.481 20 0 BEADRP CC[C@H]([NH2+]CC[C@@H]1CCCCO1)[C@@H]1CCC[NH2+]1 ZINC000423043312 387854677 /nfs/dbraw/zinc/85/46/77/387854677.db2.gz OHKKOTZKFCLRHP-IHRRRGAJSA-N 2 0 240.391 2.066 20 0 BEADRP C[C@@H]([NH2+]CCC[C@H]1CCCCO1)[C@H]1CCC[NH2+]1 ZINC000423041672 387854872 /nfs/dbraw/zinc/85/48/72/387854872.db2.gz XQHTYDSSVUKAPC-MGPQQGTHSA-N 2 0 240.391 2.066 20 0 BEADRP CC(C)C[C@@H]1C[C@H]([NH2+][C@@H](C)CCC[NH3+])CCO1 ZINC000423043288 387855396 /nfs/dbraw/zinc/85/53/96/387855396.db2.gz OEGFKRQBSKSHKG-BFHYXJOUSA-N 2 0 242.407 2.297 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[NH2+]CC[C@@H]1C)c1ccncc1 ZINC000643460297 387874292 /nfs/dbraw/zinc/87/42/92/387874292.db2.gz NDMCWUSBDJAMGC-GZBFAFLISA-N 2 0 247.386 2.163 20 0 BEADRP CC(C)O[C@H]1C[C@H]([NH2+][C@H](C)CCC[NH3+])C1(C)C ZINC000423046446 387858028 /nfs/dbraw/zinc/85/80/28/387858028.db2.gz FFZODYILQWCUJK-AGIUHOORSA-N 2 0 242.407 2.296 20 0 BEADRP C[C@@H](NC1(Cc2ccccc2)CC1)[C@@H]1CCC[NH2+]1 ZINC000423049680 387858531 /nfs/dbraw/zinc/85/85/31/387858531.db2.gz KFIMTNOUTZJWND-HIFRSBDPSA-N 2 0 244.382 2.492 20 0 BEADRP CSCCCCC[NH2+][C@@H]1CNCC[C@@H]1C ZINC000423049090 387858652 /nfs/dbraw/zinc/85/86/52/387858652.db2.gz IVVXBFMYAZZTCX-NWDGAFQWSA-N 2 0 230.421 2.107 20 0 BEADRP C1[C@H]([NH2+][C@@H]2CCC23CCCC3)C12CC[NH2+]CC2 ZINC000643534686 387859781 /nfs/dbraw/zinc/85/97/81/387859781.db2.gz ABRJHRYVSVZOKZ-OLZOCXBDSA-N 2 0 234.387 2.441 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCCC[C@H]1C[NH3+])c1ccncc1 ZINC000643460393 387874365 /nfs/dbraw/zinc/87/43/65/387874365.db2.gz YUNBEFQZZJMEBC-SNPRPXQTSA-N 2 0 247.386 2.292 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]C1(Cc2ccccc2)CC1 ZINC000423054746 387861656 /nfs/dbraw/zinc/86/16/56/387861656.db2.gz UYADGWXOSJXTNY-STQMWFEESA-N 2 0 232.371 2.477 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@@H](C)C(F)(F)F ZINC000423057558 387861911 /nfs/dbraw/zinc/86/19/11/387861911.db2.gz ZNXVIQFQORTHLA-RKDXNWHRSA-N 2 0 226.286 2.292 20 0 BEADRP CSCCCCC[NH2+][C@@H](C)C[C@@H](C)[NH3+] ZINC000423056064 387861971 /nfs/dbraw/zinc/86/19/71/387861971.db2.gz WWYUWMLNWQNJQT-MNOVXSKESA-N 2 0 218.410 2.235 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCCCC[C@@H]1[NH3+])c1ccncc1 ZINC000643460224 387874477 /nfs/dbraw/zinc/87/44/77/387874477.db2.gz CORXTPCROLADHC-SNPRPXQTSA-N 2 0 247.386 2.435 20 0 BEADRP C1[C@H]([NH2+][C@H]2CCC23CCC3)C12CC[NH2+]CC2 ZINC000643535379 387862777 /nfs/dbraw/zinc/86/27/77/387862777.db2.gz CXBTWFPBZDIGRJ-RYUDHWBXSA-N 2 0 220.360 2.051 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H](C)C1)[C@@H]1CCCC[NH2+]1 ZINC000423061217 387865323 /nfs/dbraw/zinc/86/53/23/387865323.db2.gz KFOXVTHZSOXRRX-XQHKEYJVSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1ccc(F)cn1 ZINC000643535847 387865520 /nfs/dbraw/zinc/86/55/20/387865520.db2.gz PKTVXTJLMYOJDS-MFKMUULPSA-N 2 0 249.333 2.013 20 0 BEADRP CCC[C@H](C)C[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000157784027 387874601 /nfs/dbraw/zinc/87/46/01/387874601.db2.gz ZAJNUGLUQJHGEL-XQQFMLRXSA-N 2 0 212.381 2.495 20 0 BEADRP C1CC1[C@@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)C1CCC1 ZINC000643536041 387865954 /nfs/dbraw/zinc/86/59/54/387865954.db2.gz MJMCTLJZJYVENV-KGLIPLIRSA-N 2 0 234.387 2.297 20 0 BEADRP Cc1cncc([C@H](C)[NH2+][C@@H]2CC23CC[NH2+]CC3)c1 ZINC000643535836 387866539 /nfs/dbraw/zinc/86/65/39/387866539.db2.gz PJMPRACDDYCWRD-GXTWGEPZSA-N 2 0 245.370 2.183 20 0 BEADRP COc1ccc(F)cc1C[NH2+][C@H](C)CCC[NH3+] ZINC000423062945 387866634 /nfs/dbraw/zinc/86/66/34/387866634.db2.gz NXPDSTYDPAPKOU-SNVBAGLBSA-N 2 0 240.322 2.051 20 0 BEADRP C[C@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1ccc(F)cn1 ZINC000643535844 387866665 /nfs/dbraw/zinc/86/66/65/387866665.db2.gz PKTVXTJLMYOJDS-GWCFXTLKSA-N 2 0 249.333 2.013 20 0 BEADRP Cc1cncc([C@H](C)[NH2+][C@H]2CC23CC[NH2+]CC3)c1 ZINC000643535837 387866716 /nfs/dbraw/zinc/86/67/16/387866716.db2.gz PJMPRACDDYCWRD-JSGCOSHPSA-N 2 0 245.370 2.183 20 0 BEADRP CO[C@H](C)[C@H](C)[NH2+][C@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000423064978 387867495 /nfs/dbraw/zinc/86/74/95/387867495.db2.gz AKZUMSHHSGBLFG-XJFOESAGSA-N 2 0 242.407 2.310 20 0 BEADRP C[C@H]([NH2+][C@H]1CC12CC[NH2+]CC2)C1CCCC1 ZINC000643536950 387869305 /nfs/dbraw/zinc/86/93/05/387869305.db2.gz XLZIJKNCTYMDDP-AAEUAGOBSA-N 2 0 222.376 2.297 20 0 BEADRP CC(C)=CCC[NH2+][C@@H]1CC[NH2+]CC[C@H]1C ZINC000423066912 387869657 /nfs/dbraw/zinc/86/96/57/387869657.db2.gz FTSLAXKYVZFREE-CHWSQXEVSA-N 2 0 210.365 2.320 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[NH2+]CC[C@H]2C)C1 ZINC000423066762 387870069 /nfs/dbraw/zinc/87/00/69/387870069.db2.gz XTVSSYVIXWTZNR-FVCCEPFGSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)C1CC([NH2+][C@@H]2CC23CC[NH2+]CC3)C1 ZINC000643536977 387871179 /nfs/dbraw/zinc/87/11/79/387871179.db2.gz ZSOVWWSFWAKJLF-WXRRBKDZSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC12CCCC2)[C@@H]1CC[NH2+]C1 ZINC000423069746 387871326 /nfs/dbraw/zinc/87/13/26/387871326.db2.gz BSTDSOLTQOUYQX-XQQFMLRXSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC12CCCC2)[C@@H]1CC[NH2+]C1 ZINC000423069747 387871941 /nfs/dbraw/zinc/87/19/41/387871941.db2.gz BSTDSOLTQOUYQX-YNEHKIRRSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]Cc1ccc2c(n1)CCCC2 ZINC000423072119 387872351 /nfs/dbraw/zinc/87/23/51/387872351.db2.gz GTMZUTZRMLZFNU-LBPRGKRZSA-N 2 0 247.386 2.177 20 0 BEADRP [NH3+][C@H]1CCCCC[C@H]1[NH2+]CCc1ccccc1O ZINC000422966920 387816022 /nfs/dbraw/zinc/81/60/22/387816022.db2.gz AVQHWUUMFWRBSO-UONOGXRCSA-N 2 0 248.370 2.184 20 0 BEADRP CCC(CC)[C@H](CN[C@H](C)C[C@@H](C)[NH3+])[NH+](C)C ZINC000422965470 387816635 /nfs/dbraw/zinc/81/66/35/387816635.db2.gz OTPRGTVAFWKSEK-BZPMIXESSA-N 2 0 243.439 2.068 20 0 BEADRP C[C@H]([NH2+]CC1(Cc2ccccc2)CC1)C1C[NH2+]C1 ZINC000423002728 387818633 /nfs/dbraw/zinc/81/86/33/387818633.db2.gz ZJSPGKPOIDWHNN-ZDUSSCGKSA-N 2 0 244.382 2.207 20 0 BEADRP C[C@@H]([NH3+])C[NH2+]C(C)(C)CCc1ccccc1 ZINC000442667508 387818827 /nfs/dbraw/zinc/81/88/27/387818827.db2.gz XSASVCKKCBLPMB-GFCCVEGCSA-N 2 0 220.360 2.335 20 0 BEADRP C[C@@H]([NH3+])CN(C1CC1)[C@@H]1CCc2ccccc21 ZINC000442666991 387818919 /nfs/dbraw/zinc/81/89/19/387818919.db2.gz XNYVQHVIYWGTSY-IAQYHMDHSA-N 2 0 230.355 2.486 20 0 BEADRP COc1cccc([C@H]2CCCN2C[C@H](C)[NH3+])c1 ZINC000442667147 387819116 /nfs/dbraw/zinc/81/91/16/387819116.db2.gz YGJAXQUTODAHIU-SMDDNHRTSA-N 2 0 234.343 2.179 20 0 BEADRP C[C@H]([NH3+])CN(C1CC1)[C@H]1CCc2ccccc21 ZINC000442666993 387819421 /nfs/dbraw/zinc/81/94/21/387819421.db2.gz XNYVQHVIYWGTSY-NHYWBVRUSA-N 2 0 230.355 2.486 20 0 BEADRP C[C@@H]([NH3+])CN(C1CC1)[C@H]1CCc2ccccc21 ZINC000442666989 387819598 /nfs/dbraw/zinc/81/95/98/387819598.db2.gz XNYVQHVIYWGTSY-ABAIWWIYSA-N 2 0 230.355 2.486 20 0 BEADRP Cc1cccc(CCC[NH2+][C@H](C)CCCC[NH3+])n1 ZINC000423104321 387889490 /nfs/dbraw/zinc/88/94/90/387889490.db2.gz LSWGVJGHVSVMHG-CYBMUJFWSA-N 2 0 249.402 2.430 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CC1(c2ccccn2)CCC1 ZINC000423101874 387889960 /nfs/dbraw/zinc/88/99/60/387889960.db2.gz DJWXHIXMYFIWIZ-STQMWFEESA-N 2 0 247.386 2.219 20 0 BEADRP CC(C)SCC[NH2+][C@H]1CCCCC[C@@H]1[NH3+] ZINC000423105358 387890448 /nfs/dbraw/zinc/89/04/48/387890448.db2.gz IFPNUQOBKBFBLC-RYUDHWBXSA-N 2 0 230.421 2.378 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CCc1cccc2[nH]ccc21 ZINC000423105162 387890629 /nfs/dbraw/zinc/89/06/29/387890629.db2.gz CAKKGNDGJDSLCI-NWDGAFQWSA-N 2 0 245.370 2.426 20 0 BEADRP C[C@@H]([NH2+]CCC1(F)CCC1)[C@H]1CCCC[NH2+]1 ZINC000423105847 387891024 /nfs/dbraw/zinc/89/10/24/387891024.db2.gz IXOZLRFUJLTKPD-VXGBXAGGSA-N 2 0 228.355 2.389 20 0 BEADRP C[C@H](C[NH2+]C1CCC([NH3+])CC1)C(F)(F)F ZINC000423054477 387891744 /nfs/dbraw/zinc/89/17/44/387891744.db2.gz UQDPIIUNNWBVNT-AFPNSQJFSA-N 2 0 224.270 2.044 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+][C@@H]1CCCCC[C@H]1[NH3+] ZINC000423104994 387891952 /nfs/dbraw/zinc/89/19/52/387891952.db2.gz HZAVXWHTTMXIKV-UTUOFQBUSA-N 2 0 210.365 2.425 20 0 BEADRP CC1=CCC[C@H](C)[C@@H]1C[N@H+]1C[C@H]2C[NH+](C)C[C@H]2C1 ZINC000194543060 387893221 /nfs/dbraw/zinc/89/32/21/387893221.db2.gz ADKJSMTXAOIOAS-CAOSSQGBSA-N 2 0 248.414 2.472 20 0 BEADRP Cc1ccccc1[C@H]1C[C@H]([NH2+][C@@H](C)C2C[NH2+]C2)C1 ZINC000423109854 387893676 /nfs/dbraw/zinc/89/36/76/387893676.db2.gz VFQULCCINFGUFR-YDHLFZDLSA-N 2 0 244.382 2.439 20 0 BEADRP CC[C@H]([NH2+][C@H]1CCC1(C)C)[C@@H]1CCC[NH2+]1 ZINC000423111950 387895925 /nfs/dbraw/zinc/89/59/25/387895925.db2.gz RIXKGOXWWOSRCI-SRVKXCTJSA-N 2 0 210.365 2.295 20 0 BEADRP CCSCCC[NH2+]C1CCC(C[NH3+])CC1 ZINC000423114893 387896421 /nfs/dbraw/zinc/89/64/21/387896421.db2.gz MKKYPLNGHSFSNP-UHFFFAOYSA-N 2 0 230.421 2.237 20 0 BEADRP CCSCCC[NH2+][C@H]1CC[NH2+]CC[C@H]1C ZINC000423117731 387898171 /nfs/dbraw/zinc/89/81/71/387898171.db2.gz WXIVKOAAPKANLH-NEPJUHHUSA-N 2 0 230.421 2.107 20 0 BEADRP CCC(C)(C)C[NH2+][C@@H]1CC[NH2+]CC[C@@H]1C ZINC000423076295 387876094 /nfs/dbraw/zinc/87/60/94/387876094.db2.gz QTMUIJWYCQLTQO-NWDGAFQWSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]C1CCC2(CC2)CC1 ZINC000423078799 387876259 /nfs/dbraw/zinc/87/62/59/387876259.db2.gz WTYLAYKIQWWARP-QWRGUYRKSA-N 2 0 210.365 2.425 20 0 BEADRP C1[C@@H]([NH2+][C@@H]2CC[C@H]2C2CCC2)C12CC[NH2+]CC2 ZINC000643536864 387876269 /nfs/dbraw/zinc/87/62/69/387876269.db2.gz XBSLULVLLJWNOI-BFHYXJOUSA-N 2 0 234.387 2.297 20 0 BEADRP Cc1ccc([C@H](C)[NH2+][C@@H](C)CCC[NH3+])c(C)n1 ZINC000643539200 387879672 /nfs/dbraw/zinc/87/96/72/387879672.db2.gz FYBABBZMHRJSGN-JQWIXIFHSA-N 2 0 235.375 2.476 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+][C@@H](C)CCC[NH3+])c(C)n1 ZINC000643539199 387879861 /nfs/dbraw/zinc/87/98/61/387879861.db2.gz FYBABBZMHRJSGN-CMPLNLGQSA-N 2 0 235.375 2.476 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+]CCC1(C)CC1 ZINC000423087946 387880676 /nfs/dbraw/zinc/88/06/76/387880676.db2.gz QPSYKTLJDLLBHB-NWDGAFQWSA-N 2 0 210.365 2.154 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@H](C)Cc1cccs1 ZINC000643540246 387881922 /nfs/dbraw/zinc/88/19/22/387881922.db2.gz LJBQMNUNXBDCIC-NXEZZACHSA-N 2 0 212.362 2.006 20 0 BEADRP Cc1cscc1C[NH2+][C@H](C)C[C@@H](C)[NH3+] ZINC000423091755 387882734 /nfs/dbraw/zinc/88/27/34/387882734.db2.gz YQNPCOLTORLKIB-NXEZZACHSA-N 2 0 212.362 2.272 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@@H]1CCCc2ccccc2C1 ZINC000643540808 387883369 /nfs/dbraw/zinc/88/33/69/387883369.db2.gz VIZJOEIYSXOWKU-HUUCEWRRSA-N 2 0 232.371 2.261 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CC[C@@H](C)C1)[C@@H]1CCC[NH2+]1 ZINC000423092550 387883425 /nfs/dbraw/zinc/88/34/25/387883425.db2.gz CIDSBBVCWATRED-LPWJVIDDSA-N 2 0 210.365 2.153 20 0 BEADRP Cc1cscc1C[NH2+][C@H](C)C[C@H](C)[NH3+] ZINC000423091757 387883537 /nfs/dbraw/zinc/88/35/37/387883537.db2.gz YQNPCOLTORLKIB-VHSXEESVSA-N 2 0 212.362 2.272 20 0 BEADRP CC(C)(C)CC[C@H](CO)[NH2+]C1CCC([NH3+])CC1 ZINC000423094068 387884227 /nfs/dbraw/zinc/88/42/27/387884227.db2.gz JEYFJEBQHRNYQU-WXRRBKDZSA-N 2 0 242.407 2.033 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC000423095195 387885078 /nfs/dbraw/zinc/88/50/78/387885078.db2.gz LPGRFRWWFNRXKY-VHSXEESVSA-N 2 0 220.307 2.139 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CC[C@H]1C1CC1 ZINC000423095868 387885935 /nfs/dbraw/zinc/88/59/35/387885935.db2.gz NHHROIYZSRSNOA-XUXIUFHCSA-N 2 0 222.376 2.282 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]1[NH2+]CCCc1ccccc1F ZINC000423097886 387886278 /nfs/dbraw/zinc/88/62/78/387886278.db2.gz RIUUFAXDKIRNCA-KBPBESRZSA-N 2 0 236.334 2.228 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CC1(C(F)(F)F)CC1 ZINC000423102277 387888775 /nfs/dbraw/zinc/88/87/75/387888775.db2.gz DVDKHOVYTBPBRO-JGVFFNPUSA-N 2 0 224.270 2.044 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CCCC(F)(F)C1 ZINC000423103426 387888938 /nfs/dbraw/zinc/88/89/38/387888938.db2.gz AKLCYSLOVMEJNB-AXFHLTTASA-N 2 0 232.318 2.281 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CC1(C(F)(F)F)CC1 ZINC000423102278 387889430 /nfs/dbraw/zinc/88/94/30/387889430.db2.gz DVDKHOVYTBPBRO-SFYZADRCSA-N 2 0 224.270 2.044 20 0 BEADRP C[C@@H]([NH3+])[C@H](Cc1ccccc1)[NH2+]CCCCF ZINC000423141735 387917831 /nfs/dbraw/zinc/91/78/31/387917831.db2.gz RNULSZPPQLVYBM-OCCSQVGLSA-N 2 0 238.350 2.284 20 0 BEADRP Cc1c[nH+]ccc1N1CC[NH+](CC(C)C)CC1 ZINC000195334767 387918051 /nfs/dbraw/zinc/91/80/51/387918051.db2.gz OORIYBRFWNMXCE-UHFFFAOYSA-N 2 0 233.359 2.168 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CC[C@@H](C)F ZINC000423140129 387918370 /nfs/dbraw/zinc/91/83/70/387918370.db2.gz XKMIXFZUIAEWPZ-ZJUUUORDSA-N 2 0 239.338 2.247 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]CCc1cccc2[nH]ccc21 ZINC000423116131 387899412 /nfs/dbraw/zinc/89/94/12/387899412.db2.gz OWTIVDZURJOUTM-LBPRGKRZSA-N 2 0 245.370 2.427 20 0 BEADRP C/C(Cl)=C/C[NH+]1CCC(C[NH+](C)C)CC1 ZINC000528352253 387905133 /nfs/dbraw/zinc/90/51/33/387905133.db2.gz FOEXMKFVVIVJLT-WCIBSUBMSA-N 2 0 230.783 2.403 20 0 BEADRP C[C@H]([NH2+]C[C@]1(C)C[C@H]1c1ccccc1)C1C[NH2+]C1 ZINC000423129156 387906780 /nfs/dbraw/zinc/90/67/80/387906780.db2.gz DVOCIGNMKHYQDL-RCBQFDQVSA-N 2 0 244.382 2.378 20 0 BEADRP CC[N@@H+]1CCC[C@@H](CNCc2ccc(C)o2)C1 ZINC000236861811 387909230 /nfs/dbraw/zinc/90/92/30/387909230.db2.gz YYEBBXJGFFEWBS-ZDUSSCGKSA-N 2 0 236.359 2.410 20 0 BEADRP Cc1cccnc1C(C)(C)C[NH2+][C@@H]1CCC[C@@H]1[NH3+] ZINC000423133228 387909211 /nfs/dbraw/zinc/90/92/11/387909211.db2.gz CMYPLAFRVROGFQ-QWHCGFSZSA-N 2 0 247.386 2.137 20 0 BEADRP COCC1(C[NH2+][C@@H](C)CCC[NH3+])CCCCC1 ZINC000423134245 387912006 /nfs/dbraw/zinc/91/20/06/387912006.db2.gz DUFLTUIOXYPBSJ-ZDUSSCGKSA-N 2 0 242.407 2.300 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]C[C@H]1CCCSC1 ZINC000423133699 387912068 /nfs/dbraw/zinc/91/20/68/387912068.db2.gz VXCVGQCAMYBYND-JHJVBQTASA-N 2 0 242.432 2.107 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]C1CC(C(F)(F)F)C1 ZINC000423136856 387914365 /nfs/dbraw/zinc/91/43/65/387914365.db2.gz ZQEYQKSYSLWRNF-AUXWQGHOSA-N 2 0 236.281 2.044 20 0 BEADRP CC(C)[C@@H]1C[C@H]1C[NH2+][C@@H]1CCCC[C@@H]1C[NH3+] ZINC000423153996 387931916 /nfs/dbraw/zinc/93/19/16/387931916.db2.gz OLSALKBFZOWPDR-ZOBORPQBSA-N 2 0 224.392 2.386 20 0 BEADRP CC[C@H](C)[C@H](C[NH2+][C@H]1CCCCC[C@@H]1[NH3+])OC ZINC000423156265 387934020 /nfs/dbraw/zinc/93/40/20/387934020.db2.gz KWBCDWNPBJRVOZ-XUXIUFHCSA-N 2 0 242.407 2.297 20 0 BEADRP CC[C@H](C)[C@H](C[NH2+][C@@H]1CCCCC[C@H]1[NH3+])OC ZINC000423156263 387934181 /nfs/dbraw/zinc/93/41/81/387934181.db2.gz KWBCDWNPBJRVOZ-DGAVXFQQSA-N 2 0 242.407 2.297 20 0 BEADRP CC[C@H](C)[C@H](C[NH2+][C@@H]1CCCCC[C@@H]1[NH3+])OC ZINC000423156264 387935377 /nfs/dbraw/zinc/93/53/77/387935377.db2.gz KWBCDWNPBJRVOZ-FQUUOJAGSA-N 2 0 242.407 2.297 20 0 BEADRP CO[C@@H]1CCC[C@H]1[NH2+][C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000423156632 387936498 /nfs/dbraw/zinc/93/64/98/387936498.db2.gz SVZUKDWXJXUJDS-LJISPDSOSA-N 2 0 246.354 2.288 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CC(C)(C)c1ccccn1 ZINC000423143835 387920038 /nfs/dbraw/zinc/92/00/38/387920038.db2.gz DZGRXGFBOISFQH-RYUDHWBXSA-N 2 0 235.375 2.075 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CC(C)(C)c1ccccn1 ZINC000423143834 387920946 /nfs/dbraw/zinc/92/09/46/387920946.db2.gz DZGRXGFBOISFQH-NWDGAFQWSA-N 2 0 235.375 2.075 20 0 BEADRP CC[C@@H]([NH2+]C1CCC(C[NH3+])CC1)C(F)F ZINC000423144558 387921423 /nfs/dbraw/zinc/92/14/23/387921423.db2.gz HMMRWUZVHCYZFC-UDNWOFFPSA-N 2 0 220.307 2.137 20 0 BEADRP Cc1cccc2c1OC[C@H]([NH2+][C@H](C)C[C@@H](C)[NH3+])C2 ZINC000423144413 387921482 /nfs/dbraw/zinc/92/14/82/387921482.db2.gz YWIZXVORNITQEH-YRGRVCCFSA-N 2 0 248.370 2.014 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CCCC(C)(F)F ZINC000423147244 387924000 /nfs/dbraw/zinc/92/40/00/387924000.db2.gz RLSITZBFEJPVAP-DTWKUNHWSA-N 2 0 208.296 2.137 20 0 BEADRP Cc1ccc(F)c(CC[NH2+][C@H](C)C[C@H](C)[NH3+])c1 ZINC000423147027 387924906 /nfs/dbraw/zinc/92/49/06/387924906.db2.gz BTJNDKRHKWZXJQ-NWDGAFQWSA-N 2 0 238.350 2.392 20 0 BEADRP Cc1cc(C)c(C[NH2+]C2CCC(C[NH3+])CC2)cn1 ZINC000423148975 387927366 /nfs/dbraw/zinc/92/73/66/387927366.db2.gz AAVAEUUNBSMBSJ-UHFFFAOYSA-N 2 0 247.386 2.306 20 0 BEADRP CC(C)[C@@H]1C[C@H](C[NH2+][C@@H](C)C[C@H](C)[NH3+])CCO1 ZINC000423150121 387927712 /nfs/dbraw/zinc/92/77/12/387927712.db2.gz IDHWOQQVYMLGDS-FQUUOJAGSA-N 2 0 242.407 2.153 20 0 BEADRP CC(C)[C@H]1C[C@@H](C[NH2+][C@@H](C)C[C@H](C)[NH3+])CCO1 ZINC000423150124 387928246 /nfs/dbraw/zinc/92/82/46/387928246.db2.gz IDHWOQQVYMLGDS-XDQVBPFNSA-N 2 0 242.407 2.153 20 0 BEADRP CC[C@H]([NH2+]CC1(N(C)C)CCC1)[C@@H]1C[C@@H]1C ZINC000321153038 387953419 /nfs/dbraw/zinc/95/34/19/387953419.db2.gz WLISNLOWYLUVIV-XQQFMLRXSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)[C@H]1C[C@H]1C ZINC000321159186 387954449 /nfs/dbraw/zinc/95/44/49/387954449.db2.gz XBTPULVAWUTXJN-BJJPWKGXSA-N 2 0 222.376 2.247 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+]C1(C2CCC2)CCC1 ZINC000423169945 387955541 /nfs/dbraw/zinc/95/55/41/387955541.db2.gz KQNAOTYCEQYEDQ-ZDUSSCGKSA-N 2 0 240.391 2.053 20 0 BEADRP C[C@@H]([NH2+]CC1(C2CCC2)CCC1)C1C[NH2+]C1 ZINC000423159075 387938050 /nfs/dbraw/zinc/93/80/50/387938050.db2.gz FFJFNSSHRDKXCW-LLVKDONJSA-N 2 0 222.376 2.154 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000044535197 387938264 /nfs/dbraw/zinc/93/82/64/387938264.db2.gz ONXDOIKKFHVVQH-RDBSUJKOSA-N 2 0 224.392 2.497 20 0 BEADRP COCC1(C[NH2+][C@H](C)CCCC[NH3+])CCCC1 ZINC000423158536 387938308 /nfs/dbraw/zinc/93/83/08/387938308.db2.gz DCWMPRBZHVQMSG-CYBMUJFWSA-N 2 0 242.407 2.300 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000044534266 387938435 /nfs/dbraw/zinc/93/84/35/387938435.db2.gz VTVODVMDYDBBOP-AVGNSLFASA-N 2 0 212.381 2.352 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH2+]C(C2CC2)C2CC2)C1 ZINC000044534434 387938520 /nfs/dbraw/zinc/93/85/20/387938520.db2.gz VNFMKHHNONJAKW-NSHDSACASA-N 2 0 222.376 2.106 20 0 BEADRP C[C@@H]([NH2+]CC1CCCCCC1)C1C[NH2+]C1 ZINC000423158059 387938713 /nfs/dbraw/zinc/93/87/13/387938713.db2.gz WCTJKOLOKIQDQS-LLVKDONJSA-N 2 0 210.365 2.154 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]CCC[C@H]1CCOC1 ZINC000423161057 387942915 /nfs/dbraw/zinc/94/29/15/387942915.db2.gz NDNMFXBYWUUMLM-BFHYXJOUSA-N 2 0 240.391 2.053 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+]C[C@@H]1C[C@H]1C1CC1 ZINC000423162396 387944462 /nfs/dbraw/zinc/94/44/62/387944462.db2.gz LAHCWWPJWNOWLQ-RFGFWPKPSA-N 2 0 222.376 2.140 20 0 BEADRP CC[C@H]([NH2+]CCCC[NH+](C)C)[C@@H]1C[C@@H]1C ZINC000321084400 387944701 /nfs/dbraw/zinc/94/47/01/387944701.db2.gz MGYZQQPJGYRCMS-XQQFMLRXSA-N 2 0 212.381 2.352 20 0 BEADRP CCC[C@H]([NH2+][C@H]1CC[NH2+]C1)C1CCCC1 ZINC000423171397 387956326 /nfs/dbraw/zinc/95/63/26/387956326.db2.gz OHGQQAZWJNVGDS-STQMWFEESA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@@H]1CCC[C@H]1C[NH2+][C@@H](CCC[NH3+])COC ZINC000423164612 387947741 /nfs/dbraw/zinc/94/77/41/387947741.db2.gz XEXMABMJGWPACN-RDBSUJKOSA-N 2 0 242.407 2.156 20 0 BEADRP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[C@@H](C)C1)C1C[NH2+]C1 ZINC000423164948 387948337 /nfs/dbraw/zinc/94/83/37/387948337.db2.gz PBYYZXMJNOVCNV-MROQNXINSA-N 2 0 224.392 2.399 20 0 BEADRP CCCc1ncc(C[NH2+][C@@H](C)CCCC[NH3+])o1 ZINC000423165347 387948670 /nfs/dbraw/zinc/94/86/70/387948670.db2.gz UJTQOEGSKRVVQM-NSHDSACASA-N 2 0 239.363 2.234 20 0 BEADRP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[C@@H](C)C1)C1C[NH2+]C1 ZINC000423164949 387948741 /nfs/dbraw/zinc/94/87/41/387948741.db2.gz PBYYZXMJNOVCNV-VOAKCMCISA-N 2 0 224.392 2.399 20 0 BEADRP CC[C@@H]1CCC[C@@H]1C[NH2+][C@@H](CCC[NH3+])COC ZINC000423164610 387948913 /nfs/dbraw/zinc/94/89/13/387948913.db2.gz XEXMABMJGWPACN-MCIONIFRSA-N 2 0 242.407 2.156 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H](C)CCCC[NH3+])nc1 ZINC000423171169 387956396 /nfs/dbraw/zinc/95/63/96/387956396.db2.gz ZOHKOJPFNAPNFE-ZDUSSCGKSA-N 2 0 235.375 2.040 20 0 BEADRP CC(C)O[C@H]1C[C@@H]([NH2+][C@H]2CCCC[C@@H]2C[NH3+])C1 ZINC000423170243 387958038 /nfs/dbraw/zinc/95/80/38/387958038.db2.gz XODAPFOZHRVMIF-MQYQWHSLSA-N 2 0 240.391 2.050 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+][C@@H]1C[C@H]1c1ccccc1F ZINC000423171532 387959703 /nfs/dbraw/zinc/95/97/03/387959703.db2.gz OVLASXNPMJYUQO-AHLTXXRQSA-N 2 0 234.318 2.151 20 0 BEADRP CO[C@@H]1C[C@@H]([NH2+][C@@H](C)CCCC[NH3+])C12CCC2 ZINC000423172999 387960740 /nfs/dbraw/zinc/96/07/40/387960740.db2.gz WKQIVEKSMWEDMI-YNEHKIRRSA-N 2 0 240.391 2.051 20 0 BEADRP CC[C@H]([NH2+]C1CCC(OC)CC1)[C@@H]1CCC[NH2+]1 ZINC000423173119 387960812 /nfs/dbraw/zinc/96/08/12/387960812.db2.gz WZXUMBYSZFGMBA-HOAMVYINSA-N 2 0 240.391 2.064 20 0 BEADRP COCCC[C@@H](C)[NH2+]CC1([NH3+])CCCCC1 ZINC000423176084 387961784 /nfs/dbraw/zinc/96/17/84/387961784.db2.gz FZRICZHINDJYKV-GFCCVEGCSA-N 2 0 228.380 2.053 20 0 BEADRP CSC[C@@H]1CCC[N@@H+]1CC[C@@H]1CCC[NH+]1C ZINC000245574847 387961926 /nfs/dbraw/zinc/96/19/26/387961926.db2.gz ARGGKVNYOWZTOQ-STQMWFEESA-N 2 0 242.432 2.298 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CCCC[C@H]1F ZINC000423180886 387965395 /nfs/dbraw/zinc/96/53/95/387965395.db2.gz KQSVPWGASAJAKJ-QNWHQSFQSA-N 2 0 228.355 2.374 20 0 BEADRP CC[C@@H]([NH2+]CCC[NH3+])c1cc(C)ccc1OC ZINC000423179421 387965668 /nfs/dbraw/zinc/96/56/68/387965668.db2.gz DDEPZFMFVJPEGD-CYBMUJFWSA-N 2 0 236.359 2.393 20 0 BEADRP CO[C@H](c1ccccc1)[C@H](C)[NH2+]C1CC[NH2+]CC1 ZINC000423184632 387970092 /nfs/dbraw/zinc/97/00/92/387970092.db2.gz MJMGEOKUXGKGHY-WFASDCNBSA-N 2 0 248.370 2.104 20 0 BEADRP CC[C@@H](C[NH2+][C@H](C)C1C[NH2+]C1)CC(F)(F)F ZINC000423185578 387970592 /nfs/dbraw/zinc/97/05/92/387970592.db2.gz NYNWPLNYDRYOKM-RKDXNWHRSA-N 2 0 238.297 2.163 20 0 BEADRP [NH3+]CC1CCC([NH2+][C@@H]2C[C@H]2c2ccco2)CC1 ZINC000423186379 387970872 /nfs/dbraw/zinc/97/08/72/387970872.db2.gz OORXUUXZUZJARO-FIYWTHMPSA-N 2 0 234.343 2.243 20 0 BEADRP C[C@@H]([NH2+]CC1([NH3+])CCCCC1)C1(C)CC1 ZINC000423187242 387971446 /nfs/dbraw/zinc/97/14/46/387971446.db2.gz XOUFKDBRZAMWDS-LLVKDONJSA-N 2 0 210.365 2.426 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H](C)c1cccc(F)c1 ZINC000423187835 387971764 /nfs/dbraw/zinc/97/17/64/387971764.db2.gz NATGQOJDHLQRHM-JTQLQIEISA-N 2 0 210.296 2.086 20 0 BEADRP [NH3+]CCC[NH2+][C@H]1CC[C@@H](c2ccccc2)C1 ZINC000423193916 387979350 /nfs/dbraw/zinc/97/93/50/387979350.db2.gz QZVOJWFFACVTDQ-KGLIPLIRSA-N 2 0 218.344 2.261 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+][C@@H]1C[C@H]1c1ccco1 ZINC000423194542 387979446 /nfs/dbraw/zinc/97/94/46/387979446.db2.gz WTDLUGGTFVYHKE-UMSGYPCISA-N 2 0 234.343 2.113 20 0 BEADRP C[C@H](CCCc1cccnc1)[NH2+]CCC[NH+](C)C ZINC000453054723 387973596 /nfs/dbraw/zinc/97/35/96/387973596.db2.gz HZSGSOVZPMRHHW-CQSZACIVSA-N 2 0 249.402 2.334 20 0 BEADRP CCC[C@@H]([NH2+]CCC[NH3+])c1ccc(OC)cc1 ZINC000423188457 387974537 /nfs/dbraw/zinc/97/45/37/387974537.db2.gz ZGKHJGARVUQGPV-CQSZACIVSA-N 2 0 236.359 2.475 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H](C)c1ccc(F)cc1 ZINC000423191598 387976241 /nfs/dbraw/zinc/97/62/41/387976241.db2.gz SZBCXJVCTCJUKZ-JTQLQIEISA-N 2 0 210.296 2.086 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H](C)[C@@H]1C[C@H]1c1ccccc1 ZINC000423201678 387988198 /nfs/dbraw/zinc/98/81/98/387988198.db2.gz PMRKUWYCJDQJEP-QEJZJMRPSA-N 2 0 232.371 2.378 20 0 BEADRP C[NH2+]CCC[NH2+][C@H](C)c1ccc(OC)cc1C ZINC000423203317 387988806 /nfs/dbraw/zinc/98/88/06/387988806.db2.gz SKOCGHBZURQLDO-GFCCVEGCSA-N 2 0 236.359 2.264 20 0 BEADRP CC(C)[C@@H]([NH2+]C[C@@H]1CCC[NH2+]C1)c1cccnc1 ZINC000423202616 387990101 /nfs/dbraw/zinc/99/01/01/387990101.db2.gz BEGPTABTNDTKRS-UKRRQHHQSA-N 2 0 247.386 2.368 20 0 BEADRP Cc1ccncc1[C@@H](C)[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000423208855 387993587 /nfs/dbraw/zinc/99/35/87/387993587.db2.gz IBUIDRBIPOMKGG-CHWSQXEVSA-N 2 0 233.359 2.040 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@H]1C1CCC1)[C@H]1CCCC[NH2+]1 ZINC000424370553 387994208 /nfs/dbraw/zinc/99/42/08/387994208.db2.gz DQDGGZGNTHVTNS-SCUASFONSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@H](CCC[NH3+])Nc1ccc2c(c1)CCN2 ZINC000423212926 387995085 /nfs/dbraw/zinc/99/50/85/387995085.db2.gz JFJFGLFBDMDKFR-SNVBAGLBSA-N 2 0 219.332 2.194 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CCC[NH2+]C1)C1CCSCC1 ZINC000423210082 387995343 /nfs/dbraw/zinc/99/53/43/387995343.db2.gz JPJSTADEPCQPIE-NEPJUHHUSA-N 2 0 242.432 2.107 20 0 BEADRP COc1ccc([C@H](C)[NH2+]CCC[NH3+])c(C)c1 ZINC000423197054 387982160 /nfs/dbraw/zinc/98/21/60/387982160.db2.gz XPEXJFVIYQDIEX-NSHDSACASA-N 2 0 222.332 2.003 20 0 BEADRP CC[C@@H]([NH2+]CCCC[NH+](C)C)c1ccncc1 ZINC000453090553 387982089 /nfs/dbraw/zinc/98/20/89/387982089.db2.gz PENIXYUUPZTVNR-CQSZACIVSA-N 2 0 235.375 2.464 20 0 BEADRP Cc1cccnc1[C@@H]1CCC[C@@H]([NH2+]CCC[NH3+])C1 ZINC000423196601 387982182 /nfs/dbraw/zinc/98/21/82/387982182.db2.gz VQMSDFHMKOCHNL-ZIAGYGMSSA-N 2 0 247.386 2.355 20 0 BEADRP CCC1(C[NH2+][C@H](C)[C@H]2CCC[NH2+]2)CCC1 ZINC000400501364 387983292 /nfs/dbraw/zinc/98/32/92/387983292.db2.gz FZXGDQUOHJLBPU-VXGBXAGGSA-N 2 0 210.365 2.297 20 0 BEADRP [NH3+]CCC[NH2+][C@H]1CCc2ccc(Cl)cc21 ZINC000423197571 387983421 /nfs/dbraw/zinc/98/34/21/387983421.db2.gz ZWRGRZKEVOTHRC-LBPRGKRZSA-N 2 0 224.735 2.266 20 0 BEADRP CC[C@@H]([NH2+]CCC[NH2+]C)c1cccc(F)c1 ZINC000423197689 387984219 /nfs/dbraw/zinc/98/42/19/387984219.db2.gz APXKIPVCSRHGSS-CYBMUJFWSA-N 2 0 224.323 2.476 20 0 BEADRP CCC[C@@H]([NH2+]CCC[NH2+]C)c1cccnc1 ZINC000423198091 387984273 /nfs/dbraw/zinc/98/42/73/387984273.db2.gz DAUDUZCFBCAJIL-CYBMUJFWSA-N 2 0 221.348 2.122 20 0 BEADRP C[C@H]([NH2+]CC1([NH3+])CCCCCC1)[C@@H]1CCCO1 ZINC000423198821 387984341 /nfs/dbraw/zinc/98/43/41/387984341.db2.gz ICHQBGINITYKHA-STQMWFEESA-N 2 0 240.391 2.195 20 0 BEADRP C[NH2+]CCC[NH2+][C@H]1CCC[C@H](C(C)C)C1 ZINC000423198879 387985251 /nfs/dbraw/zinc/98/52/51/387985251.db2.gz IKJXCWCWDIXKRE-STQMWFEESA-N 2 0 212.381 2.400 20 0 BEADRP C[NH2+]CCC[NH2+][C@H]1CCC[C@H](c2cccnc2)C1 ZINC000423198919 387985259 /nfs/dbraw/zinc/98/52/59/387985259.db2.gz IQVRSKMZULYAAL-ZFWWWQNUSA-N 2 0 247.386 2.307 20 0 BEADRP CCC[C@@H]([NH2+]CCC[NH2+]C)C(C)(C)C ZINC000423198893 387986404 /nfs/dbraw/zinc/98/64/04/387986404.db2.gz IOGGPLFHEKTMGB-LLVKDONJSA-N 2 0 200.370 2.400 20 0 BEADRP CCCC[C@@H](C)[C@@H](C)[NH2+]CCC[NH2+]C ZINC000423201440 387987144 /nfs/dbraw/zinc/98/71/44/387987144.db2.gz ORJRCERJMKJQOX-VXGBXAGGSA-N 2 0 200.370 2.400 20 0 BEADRP CCC[C@@H]([NH2+]CC[C@H](C)[NH3+])c1cccnc1 ZINC000423226950 388011005 /nfs/dbraw/zinc/01/10/05/388011005.db2.gz SWYCQESDJDFLCR-WCQYABFASA-N 2 0 221.348 2.250 20 0 BEADRP C[C@H](CCC1CC1)[NH2+][C@@H]1CCCC[C@H]1[NH3+] ZINC000424373315 387997607 /nfs/dbraw/zinc/99/76/07/387997607.db2.gz XOHOKTUMUHOMED-RAIGVLPGSA-N 2 0 210.365 2.425 20 0 BEADRP Cc1cncc([C@H](C)[NH2+]C[C@H]2CCC[NH2+]C2)c1 ZINC000423214046 387997941 /nfs/dbraw/zinc/99/79/41/387997941.db2.gz OFPGYPRJHZNAOL-STQMWFEESA-N 2 0 233.359 2.040 20 0 BEADRP Cc1ccc(CC[N@H+]2CC[C@@H](C)[C@H](C[NH3+])C2)cc1 ZINC000420408085 387998756 /nfs/dbraw/zinc/99/87/56/387998756.db2.gz OWXZEAQXPHNQEF-GDBMZVCRSA-N 2 0 246.398 2.454 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H]1CCO[C@H]1C ZINC000245974418 387999830 /nfs/dbraw/zinc/99/98/30/387999830.db2.gz WPNXLYXNQGIWOR-MELADBBJSA-N 2 0 242.407 2.264 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCCC[C@H]1[NH3+])C1CCSCC1 ZINC000424376411 387999924 /nfs/dbraw/zinc/99/99/24/387999924.db2.gz PADUSKJVOHVWLH-RAIGVLPGSA-N 2 0 242.432 2.378 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@H]([NH2+]C[C@H]2CCC[NH2+]C2)C1 ZINC000423216380 388000136 /nfs/dbraw/zinc/00/01/36/388000136.db2.gz RUXOWTVGXJXQJI-ZOBORPQBSA-N 2 0 224.392 2.400 20 0 BEADRP CC(C)CC[C@@H]([NH2+][C@H]1CC[NH2+]C1)C1CC1 ZINC000423216998 388000725 /nfs/dbraw/zinc/00/07/25/388000725.db2.gz RCAGKLJZFRCENM-QWHCGFSZSA-N 2 0 210.365 2.153 20 0 BEADRP CC[N@H+]1C[C@H](Nc2ccc3c(c2)CCN3)[C@@H](C)C1 ZINC000423222102 388001667 /nfs/dbraw/zinc/00/16/67/388001667.db2.gz ZRVRZFMNICRMQJ-NHYWBVRUSA-N 2 0 245.370 2.407 20 0 BEADRP CC(C)CO[C@@H]1C[C@@H]([NH2+]CC[C@H](C)[NH3+])C1(C)C ZINC000423223347 388003541 /nfs/dbraw/zinc/00/35/41/388003541.db2.gz GCNUALCOZHTVAF-YNEHKIRRSA-N 2 0 242.407 2.153 20 0 BEADRP CC[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)c1ccncc1 ZINC000453182894 388004642 /nfs/dbraw/zinc/00/46/42/388004642.db2.gz SRHPFTUUMXCDGC-OAHLLOKOSA-N 2 0 245.370 2.384 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H]1CCCNc2ccccc21 ZINC000423227607 388011071 /nfs/dbraw/zinc/01/10/71/388011071.db2.gz WITIOSGMARHOCT-SMDDNHRTSA-N 2 0 233.359 2.260 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@H]1c2ccccc2C[C@H]1C ZINC000423224183 388005890 /nfs/dbraw/zinc/00/58/90/388005890.db2.gz ILHVNIHLEJCRTA-UHIISALHSA-N 2 0 218.344 2.247 20 0 BEADRP Cc1cc([C@H](C)[NH2+]CC[C@H](C)[NH3+])c(C)o1 ZINC000423225433 388007022 /nfs/dbraw/zinc/00/70/22/388007022.db2.gz MUBRRDYTLOCYDT-WPRPVWTQSA-N 2 0 210.321 2.284 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@H](c1ccccc1)C1CC1 ZINC000423225165 388007503 /nfs/dbraw/zinc/00/75/03/388007503.db2.gz LOCFAACVSUCLKY-SMDDNHRTSA-N 2 0 218.344 2.465 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@H]1CCCOc2ccccc21 ZINC000423227012 388011185 /nfs/dbraw/zinc/01/11/85/388011185.db2.gz TYRCKYAANYNZIF-AAEUAGOBSA-N 2 0 234.343 2.227 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@H]1CCCc2ccc(O)cc21 ZINC000423225949 388008979 /nfs/dbraw/zinc/00/89/79/388008979.db2.gz OVTZWHGAWUYBMN-HZMBPMFUSA-N 2 0 234.343 2.097 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C2CC(C)(F)C2)[C@H]2CCC[C@H]21 ZINC000453244800 388023798 /nfs/dbraw/zinc/02/37/98/388023798.db2.gz ZFZJWGIQBMLSQY-ANNIKCPVSA-N 2 0 240.366 2.339 20 0 BEADRP Cc1cc([C@@H](C)[NH2+]CC[C@H](C)[NH3+])oc1C ZINC000423227533 388011901 /nfs/dbraw/zinc/01/19/01/388011901.db2.gz WDKLAWVPEFZBPQ-VHSXEESVSA-N 2 0 210.321 2.284 20 0 BEADRP CC[C@H]([NH2+]CC[C@H](C)[NH3+])c1cccc(OC)c1 ZINC000423227109 388012046 /nfs/dbraw/zinc/01/20/46/388012046.db2.gz UMTRIWFBWXTZSH-FZMZJTMJSA-N 2 0 236.359 2.473 20 0 BEADRP CC(C)(C)C[NH2+]C[C@H]1CC[C@H](C[NH3+])CC1 ZINC000253130925 135122461 /nfs/dbraw/zinc/12/24/61/135122461.db2.gz ONDGGNHZIUIPQO-HAQNSBGRSA-N 2 0 212.381 2.387 20 0 BEADRP COc1cccc([C@@H](C)[NH2+]CC[C@H](C)[NH3+])c1 ZINC000423228581 388013841 /nfs/dbraw/zinc/01/38/41/388013841.db2.gz DEWWUVDIFQHGOS-WDEREUQCSA-N 2 0 222.332 2.083 20 0 BEADRP C[C@H](CCCc1cccnc1)[NH2+]C[C@H]1CCC[NH2+]1 ZINC000423229772 388014934 /nfs/dbraw/zinc/01/49/34/388014934.db2.gz BZXUZKMIIFDCQQ-UKRRQHHQSA-N 2 0 247.386 2.134 20 0 BEADRP C[C@@H]([NH2+]CC[C@H](C)[NH3+])c1cccc(F)c1 ZINC000423232509 388016416 /nfs/dbraw/zinc/01/64/16/388016416.db2.gz MWSLFINCCHDPJV-VHSXEESVSA-N 2 0 210.296 2.214 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H](c1cccnc1)C(C)C ZINC000423269909 388021528 /nfs/dbraw/zinc/02/15/28/388021528.db2.gz HIEYWVOSVWMBDV-TZMCWYRMSA-N 2 0 235.375 2.224 20 0 BEADRP Cc1cncc([C@@H](C)[NH2+]CC[C@H]2CC[NH2+]C2)c1 ZINC000423238440 388022369 /nfs/dbraw/zinc/02/23/69/388022369.db2.gz AJKYWOONZNVBRN-CHWSQXEVSA-N 2 0 233.359 2.040 20 0 BEADRP c1ccc2c(c1)CCC([NH2+]C[C@H]1CCC[NH2+]1)CC2 ZINC000423238617 388022403 /nfs/dbraw/zinc/02/24/03/388022403.db2.gz RHNRZNLFUQRGPM-MRXNPFEDSA-N 2 0 244.382 2.276 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C2CC(C)(F)C2)[C@H]2CCC[C@@H]21 ZINC000453244809 388023379 /nfs/dbraw/zinc/02/33/79/388023379.db2.gz ZFZJWGIQBMLSQY-FRAWFVRRSA-N 2 0 240.366 2.339 20 0 BEADRP Cc1ccnc([C@H](C)[NH2+][C@H]2CCC[C@@H]2C[NH3+])c1 ZINC000423265852 388044347 /nfs/dbraw/zinc/04/43/47/388044347.db2.gz DBUKNNMVMQHQOD-XQQFMLRXSA-N 2 0 233.359 2.168 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@H]([NH2+]CC[C@@H]2CC[NH2+]C2)C1 ZINC000423252074 388034038 /nfs/dbraw/zinc/03/40/38/388034038.db2.gz TULHNNKOBXLWIT-ZOBORPQBSA-N 2 0 224.392 2.400 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H]1CCc2c1cccc2OC ZINC000423256426 388037470 /nfs/dbraw/zinc/03/74/70/388037470.db2.gz BXKWSHQMMGQBAD-RISCZKNCSA-N 2 0 248.370 2.128 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+][C@@H]1CC[N@H+](C)[C@H]2CCC[C@H]21 ZINC000453303015 388039631 /nfs/dbraw/zinc/03/96/31/388039631.db2.gz BAXWELFZJNIBHZ-FQKPHLNHSA-N 2 0 236.403 2.495 20 0 BEADRP CC[C@H]([NH2+]CC[C@H]1CCC[NH2+]C1)C(C)C ZINC000423262348 388040734 /nfs/dbraw/zinc/04/07/34/388040734.db2.gz VFKHJWBSQBVRKL-OLZOCXBDSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)c1ccncc1 ZINC000423262283 388041031 /nfs/dbraw/zinc/04/10/31/388041031.db2.gz UXLDJUJEJIWGJF-STQMWFEESA-N 2 0 233.359 2.122 20 0 BEADRP CC(C)O[C@@H]1C[C@@H]([NH2+]C[C@@H]([NH3+])C(C)C)C1(C)C ZINC000423263343 388042976 /nfs/dbraw/zinc/04/29/76/388042976.db2.gz AZMOFQPZXHWVTA-JHJVBQTASA-N 2 0 242.407 2.151 20 0 BEADRP c1coc(C[NH2+]CC2CC[NH+](C3CC3)CC2)c1 ZINC000446891542 388043698 /nfs/dbraw/zinc/04/36/98/388043698.db2.gz ZYZASWQBYVNUHE-UHFFFAOYSA-N 2 0 234.343 2.244 20 0 BEADRP C[C@@H]1CCC[C@@H](C)C1[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000423244573 388028132 /nfs/dbraw/zinc/02/81/32/388028132.db2.gz HSZZMKPQCRKERY-JHJVBQTASA-N 2 0 224.392 2.400 20 0 BEADRP FCCC[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CCC[NH2+]1 ZINC000423245958 388028769 /nfs/dbraw/zinc/02/87/69/388028769.db2.gz YZJSTHJMJJBSPV-AVGNSLFASA-N 2 0 228.355 2.246 20 0 BEADRP Cc1ccnc([C@H](C)[NH2+][C@H]2CCC[C@H]2C[NH3+])c1 ZINC000423265850 388044234 /nfs/dbraw/zinc/04/42/34/388044234.db2.gz DBUKNNMVMQHQOD-AVGNSLFASA-N 2 0 233.359 2.168 20 0 BEADRP C(C[C@@H]1CC[NH2+]C1)[NH2+][C@@H]1CCC12CCCC2 ZINC000423249319 388031354 /nfs/dbraw/zinc/03/13/54/388031354.db2.gz OQDYFABIYFDMJD-QWHCGFSZSA-N 2 0 222.376 2.298 20 0 BEADRP Fc1ccc2c(c1)CC[C@H]2[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000423249259 388031486 /nfs/dbraw/zinc/03/14/86/388031486.db2.gz OITSFVJRALOYFC-IAQYHMDHSA-N 2 0 248.345 2.402 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H](C)CC(C)(C)C ZINC000423271966 388052090 /nfs/dbraw/zinc/05/20/90/388052090.db2.gz JMZVNNMWNVPPRE-QWRGUYRKSA-N 2 0 200.370 2.256 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CC(C)(C)C[C@@H]1C ZINC000423273273 388054008 /nfs/dbraw/zinc/05/40/08/388054008.db2.gz KNOLHKKIHJPQJX-SDDRHHMPSA-N 2 0 212.381 2.256 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CCc2ccc(C)cc21 ZINC000423274632 388055486 /nfs/dbraw/zinc/05/54/86/388055486.db2.gz MEPKJRWQZXOMBW-SWLSCSKDSA-N 2 0 232.371 2.427 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H](C)c1cccs1 ZINC000423275160 388056563 /nfs/dbraw/zinc/05/65/63/388056563.db2.gz MPYRJNVOOCGUMJ-VHSXEESVSA-N 2 0 212.362 2.254 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H]1CCCNc2ccccc21 ZINC000423275167 388057551 /nfs/dbraw/zinc/05/75/51/388057551.db2.gz MRAPVGPWLNJPBI-WFASDCNBSA-N 2 0 247.386 2.379 20 0 BEADRP CCC1(CC)[C@H]([NH2+]C[C@@H]([NH3+])C(C)C)C[C@H]1OC ZINC000423277449 388059071 /nfs/dbraw/zinc/05/90/71/388059071.db2.gz PPUPOWQEZQOPNN-JHJVBQTASA-N 2 0 242.407 2.153 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000423279404 388060813 /nfs/dbraw/zinc/06/08/13/388060813.db2.gz SJTPNYRPNRQNKX-XQQFMLRXSA-N 2 0 210.365 2.154 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H](C)c1cccc(OC)c1 ZINC000423279681 388061392 /nfs/dbraw/zinc/06/13/92/388061392.db2.gz SSKKMPMYBJRUSI-NEPJUHHUSA-N 2 0 236.359 2.201 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+][C@H]1CCCC[C@@H]1C[NH3+] ZINC000423279563 388061497 /nfs/dbraw/zinc/06/14/97/388061497.db2.gz RNEYPUVCNWQOJC-BNOWGMLFSA-N 2 0 236.359 2.318 20 0 BEADRP CCC[C@@H]([NH2+]C[C@H](C)C[NH2+]C)c1cccnc1 ZINC000423279971 388062270 /nfs/dbraw/zinc/06/22/70/388062270.db2.gz TVRCPUJJHXQXHD-TZMCWYRMSA-N 2 0 235.375 2.368 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H]1CC[C@@H]1C1CCC1 ZINC000423280612 388062611 /nfs/dbraw/zinc/06/26/11/388062611.db2.gz UXMUPOCNCWJEAM-UHTWSYAYSA-N 2 0 210.365 2.010 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H](C)c1ccc2c(c1)COC2 ZINC000423279710 388062624 /nfs/dbraw/zinc/06/26/24/388062624.db2.gz SVGREXHXFJORHO-NWDGAFQWSA-N 2 0 248.370 2.223 20 0 BEADRP Cc1cc([C@@H](C)[NH2+]CC[C@H]2CCC[NH2+]C2)no1 ZINC000423281930 388063492 /nfs/dbraw/zinc/06/34/92/388063492.db2.gz VYXRFMSLRYITPO-VXGBXAGGSA-N 2 0 237.347 2.023 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+][C@@H]1CCCC[C@H]1C[NH3+] ZINC000423283450 388064764 /nfs/dbraw/zinc/06/47/64/388064764.db2.gz WEIRWKOZZNLVCV-XQHKEYJVSA-N 2 0 210.365 2.282 20 0 BEADRP FCC[C@@H]1CCC[C@@H]1[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000423283619 388064949 /nfs/dbraw/zinc/06/49/49/388064949.db2.gz XPQHXWPVUOVYJQ-RDBSUJKOSA-N 2 0 242.382 2.494 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C[C@@H]2C[C@H]2C2CC2)[C@@H]2CCC[C@@H]21 ZINC000453382900 388066184 /nfs/dbraw/zinc/06/61/84/388066184.db2.gz LXBFBWLBWXKZJU-QXKUPLGCSA-N 2 0 248.414 2.495 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)[C@H]1C[C@H]1C ZINC000423284665 388067213 /nfs/dbraw/zinc/06/72/13/388067213.db2.gz YRCUSVNRAQHQKY-NDBYEHHHSA-N 2 0 210.365 2.010 20 0 BEADRP CCO[C@@H]1C[C@H]([NH2+]CC(C)(C)[NH3+])C1(CC)CC ZINC000423286906 388071800 /nfs/dbraw/zinc/07/18/00/388071800.db2.gz JJFWQRNYHGVTQN-NWDGAFQWSA-N 2 0 242.407 2.297 20 0 BEADRP CC(C)([NH3+])C[NH2+][C@@H]1CCC[C@H](c2cccnc2)C1 ZINC000423287673 388072937 /nfs/dbraw/zinc/07/29/37/388072937.db2.gz NVAAYUCKNMYPAY-GXTWGEPZSA-N 2 0 247.386 2.435 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CCC[C@H]2C[NH3+])cc1 ZINC000084217910 388074972 /nfs/dbraw/zinc/07/49/72/388074972.db2.gz SZHJUTMGBIUKFH-KBPBESRZSA-N 2 0 218.344 2.212 20 0 BEADRP CCC([NH3+])(CC)C[NH2+][C@@H](C)Cc1ccoc1 ZINC000423291193 388075902 /nfs/dbraw/zinc/07/59/02/388075902.db2.gz HFSLCWLUMRJMHG-NSHDSACASA-N 2 0 224.348 2.318 20 0 BEADRP CCOc1ccccc1[C@H](C)[NH2+]C[C@@H](C)C[NH3+] ZINC000423294055 388076391 /nfs/dbraw/zinc/07/63/91/388076391.db2.gz BCAFETOABXVAMG-RYUDHWBXSA-N 2 0 236.359 2.331 20 0 BEADRP CCC([NH3+])(CC)C[NH2+][C@@H]1CCC[C@H]1CCOC ZINC000423292282 388076517 /nfs/dbraw/zinc/07/65/17/388076517.db2.gz MILDJLDMRDCUPT-QWHCGFSZSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@@H]1CCC[C@@H](C[NH+]2CCC(C[NH3+])CC2)C1 ZINC000084344478 388076928 /nfs/dbraw/zinc/07/69/28/388076928.db2.gz JXMQOBJKNWUKKV-TZMCWYRMSA-N 2 0 224.392 2.483 20 0 BEADRP CO[C@H](C)[C@@H](C)[NH2+]Cc1ccc([C@@H](C)[NH3+])cc1 ZINC000423296448 388078227 /nfs/dbraw/zinc/07/82/27/388078227.db2.gz ZGNPQJFNZNEWLP-IJLUTSLNSA-N 2 0 236.359 2.219 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H]1CC(C)(C)Cc2occc21 ZINC000423297009 388078314 /nfs/dbraw/zinc/07/83/14/388078314.db2.gz IIZCPLGCAQHSPI-ZYHUDNBSSA-N 2 0 236.359 2.478 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+]C[C@@H](C)C[NH3+])CCCO2 ZINC000423296881 388078610 /nfs/dbraw/zinc/07/86/10/388078610.db2.gz HWBVQSTUCHIECS-GXTWGEPZSA-N 2 0 248.370 2.393 20 0 BEADRP C[C@@H]([NH2+]C[C@@H](C)C[NH3+])c1cc(F)cc(F)c1 ZINC000423296661 388078709 /nfs/dbraw/zinc/07/87/09/388078709.db2.gz HGZUQJIRCQPNRD-DTWKUNHWSA-N 2 0 228.286 2.210 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+]C[C@@H](C)C[NH3+])CC2 ZINC000423297495 388079258 /nfs/dbraw/zinc/07/92/58/388079258.db2.gz KNBQADDCOZHGAK-SMDDNHRTSA-N 2 0 218.344 2.167 20 0 BEADRP Cc1cc(C)c(C[NH2+]C2CC[NH2+]CC2)cc1C ZINC000084517095 388079485 /nfs/dbraw/zinc/07/94/85/388079485.db2.gz SWXFASCDDCDMRK-UHFFFAOYSA-N 2 0 232.371 2.453 20 0 BEADRP Cc1ccc2c(c1)[C@@H]([NH2+]C[C@H](C)C[NH3+])CC2 ZINC000423297494 388080321 /nfs/dbraw/zinc/08/03/21/388080321.db2.gz KNBQADDCOZHGAK-RISCZKNCSA-N 2 0 218.344 2.167 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCC2CC(F)(F)C2)CC[N@@H+]1C ZINC000453426114 388081078 /nfs/dbraw/zinc/08/10/78/388081078.db2.gz ONXPCSTXDPIJTF-ZYHUDNBSSA-N 2 0 246.345 2.494 20 0 BEADRP CSC1(C[NH2+]CC2=CC[N@H+](C)CC2)CCC1 ZINC000336659805 388087721 /nfs/dbraw/zinc/08/77/21/388087721.db2.gz CHOVSXZXENSAQK-UHFFFAOYSA-N 2 0 240.416 2.124 20 0 BEADRP C[C@H]1CSC[C@H]1[NH2+]CCCC[N@H+](C)C1CC1 ZINC000453593596 388088979 /nfs/dbraw/zinc/08/89/79/388088979.db2.gz GWQAGDSOTHXION-WCQYABFASA-N 2 0 242.432 2.202 20 0 BEADRP CCO[C@H]1C[C@H]([NH2+]CCCC[NH3+])C12CCCC2 ZINC000085679969 388094575 /nfs/dbraw/zinc/09/45/75/388094575.db2.gz VVOPJGPEZDUQSJ-STQMWFEESA-N 2 0 240.391 2.053 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]Cc2ccccc2F)C1 ZINC000086402021 388101530 /nfs/dbraw/zinc/10/15/30/388101530.db2.gz JNPMFFSRAHBNFZ-VXGBXAGGSA-N 2 0 222.307 2.185 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]Cc2ccccc2F)C1 ZINC000086402024 388101560 /nfs/dbraw/zinc/10/15/60/388101560.db2.gz JNPMFFSRAHBNFZ-NEPJUHHUSA-N 2 0 222.307 2.185 20 0 BEADRP CC[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)C1CC1 ZINC000083055512 388044764 /nfs/dbraw/zinc/04/47/64/388044764.db2.gz GNWFSRFGQZOYQH-RISCZKNCSA-N 2 0 222.376 2.249 20 0 BEADRP C[N@@H+]1CCCC[C@@H]1CC[NH+]1C[C@@H]2[C@H](C1)C2(C)C ZINC000533294811 388045516 /nfs/dbraw/zinc/04/55/16/388045516.db2.gz GAYFOJISCDWUGJ-MCIONIFRSA-N 2 0 236.403 2.449 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1C[C@@H](OC(C)C)C1(C)C ZINC000423266966 388046018 /nfs/dbraw/zinc/04/60/18/388046018.db2.gz DMNAFMLJFLMRDR-YNEHKIRRSA-N 2 0 242.407 2.024 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H]1CCc2ccc(OC)cc21 ZINC000423267415 388046324 /nfs/dbraw/zinc/04/63/24/388046324.db2.gz DYWAKBKYFUQDJT-ABAIWWIYSA-N 2 0 248.370 2.128 20 0 BEADRP C[N@@H+]1CCCC[C@H]1CC[NH+]1C[C@@H]2[C@H](C1)C2(C)C ZINC000533294816 388046280 /nfs/dbraw/zinc/04/62/80/388046280.db2.gz GAYFOJISCDWUGJ-MELADBBJSA-N 2 0 236.403 2.449 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@@H](C)C1CCSCC1 ZINC000423269464 388047483 /nfs/dbraw/zinc/04/74/83/388047483.db2.gz HGPIHIDAHYBWSD-CMPLNLGQSA-N 2 0 230.421 2.091 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H]1[C@H](C)CCC[C@@H]1C ZINC000423269139 388048174 /nfs/dbraw/zinc/04/81/74/388048174.db2.gz GSHSMNARHZMQGW-WUHRBBMRSA-N 2 0 212.381 2.256 20 0 BEADRP CCCN1CCC[C@H]1C[NH2+][C@@H]1C[C@@H](C)O[C@H]1C ZINC000449322366 388172676 /nfs/dbraw/zinc/17/26/76/388172676.db2.gz XFHNTRXAPBJWRK-ZOBORPQBSA-N 2 0 240.391 2.016 20 0 BEADRP CC[C@@H]([NH2+][C@@H]1CCC[NH2+]CC1)C1CCC1 ZINC000324875042 388125393 /nfs/dbraw/zinc/12/53/93/388125393.db2.gz CPDSLZNPEKIOKM-CHWSQXEVSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H]([NH+](C)C)C2)[C@H](C)O1 ZINC000449178570 388153178 /nfs/dbraw/zinc/15/31/78/388153178.db2.gz XPNPLKVPIHHRMZ-ITGHMWBKSA-N 2 0 240.391 2.015 20 0 BEADRP C[C@H]1C[C@@H]1C[NH2+]C(C)(C)CCC[NH+](C)C ZINC000449529813 388224788 /nfs/dbraw/zinc/22/47/88/388224788.db2.gz ZZSFSOVEFXURAK-NWDGAFQWSA-N 2 0 212.381 2.352 20 0 BEADRP CC(C)OC[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000449560640 388232181 /nfs/dbraw/zinc/23/21/81/388232181.db2.gz NXZJSZOCIQFJRE-FUDCBSFHSA-N 2 0 240.391 2.015 20 0 BEADRP Cc1ccc(CCC[NH2+]CCC2(CO)CC2)cn1 ZINC000449581061 388237857 /nfs/dbraw/zinc/23/78/57/388237857.db2.gz WTFOAIMWHCMQPT-UHFFFAOYSA-N 2 0 248.370 2.075 20 0 BEADRP CC[NH+](CC)CCC[N@@H+]1CC[C@H](OC)[C@H](C)C1 ZINC000451578833 388282698 /nfs/dbraw/zinc/28/26/98/388282698.db2.gz XUPVKUBOFRIWIN-KGLIPLIRSA-N 2 0 242.407 2.075 20 0 BEADRP CC(C)[NH2+]CCC[NH2+][C@H]1CCC12CCC2 ZINC000521025830 256609337 /nfs/dbraw/zinc/60/93/37/256609337.db2.gz SLKWROIEBDAGAQ-LBPRGKRZSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H](C[NH3+])N[C@H](C)c1cc2ccccc2o1 ZINC000235462767 388369882 /nfs/dbraw/zinc/36/98/82/388369882.db2.gz GQICDCXOSFCUDQ-NXEZZACHSA-N 2 0 218.300 2.431 20 0 BEADRP CC(C)[N@@H+]1CC[C@H](C[NH2+][C@H]2CC[C@@H]2C2CC2)C1 ZINC000572887576 388384751 /nfs/dbraw/zinc/38/47/51/388384751.db2.gz USSUOHFJZKCOKO-YUELXQCFSA-N 2 0 236.403 2.495 20 0 BEADRP C[NH+]1CCC(C)(C[NH2+][C@H]2CCCSC2)CC1 ZINC000228808649 388388407 /nfs/dbraw/zinc/38/84/07/388388407.db2.gz VVFAPSHODZWBRG-LBPRGKRZSA-N 2 0 242.432 2.204 20 0 BEADRP CC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)C1CC1 ZINC000322753804 388445882 /nfs/dbraw/zinc/44/58/82/388445882.db2.gz XTLGHHWVQRCXPI-GSPSYOTPSA-N 2 0 222.376 2.390 20 0 BEADRP CC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)C1CC1 ZINC000322753806 388446507 /nfs/dbraw/zinc/44/65/07/388446507.db2.gz XTLGHHWVQRCXPI-WTUNAVPPSA-N 2 0 222.376 2.390 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@@H]2C[C@H]3C[C@H]3C2)CC1 ZINC000335660301 388452747 /nfs/dbraw/zinc/45/27/47/388452747.db2.gz BHSKBNIYFRUWPQ-DABQJJPHSA-N 2 0 222.376 2.247 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H]1CCC1(C)C ZINC000336658816 388460315 /nfs/dbraw/zinc/46/03/15/388460315.db2.gz BGFNFGGZFFWHCA-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP CCOc1ccc([C@H](C)[NH2+]C[C@H](C)C[NH3+])cc1 ZINC000336705560 388465615 /nfs/dbraw/zinc/46/56/15/388465615.db2.gz LCOPWXNACSVPQR-NEPJUHHUSA-N 2 0 236.359 2.331 20 0 BEADRP CC(C)C[C@H]1CC[N@H+](CC[C@H]2CC[NH2+]C2)C1 ZINC000307824519 388427309 /nfs/dbraw/zinc/42/73/09/388427309.db2.gz XIOYNJJQUXQFRW-ZIAGYGMSSA-N 2 0 224.392 2.354 20 0 BEADRP Cc1cccc(C[NH2+][C@@H]2C[C@@H]([NH3+])C2(C)C)c1 ZINC000404781577 388433632 /nfs/dbraw/zinc/43/36/32/388433632.db2.gz NKGGWAXUSVIZLX-CHWSQXEVSA-N 2 0 218.344 2.210 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H]1CCC12CCCC2 ZINC000573234885 388435012 /nfs/dbraw/zinc/43/50/12/388435012.db2.gz MPXWAVPRYSMZHZ-LBPRGKRZSA-N 2 0 210.365 2.298 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H]1CCC12CCCC2 ZINC000573234884 388435254 /nfs/dbraw/zinc/43/52/54/388435254.db2.gz MPXWAVPRYSMZHZ-GFCCVEGCSA-N 2 0 210.365 2.298 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[NH2+]C1)[C@@H]1CC1(C)C ZINC000397789646 388499777 /nfs/dbraw/zinc/49/97/77/388499777.db2.gz KSYJMSKCIOUJTN-TUAOUCFPSA-N 2 0 210.365 2.010 20 0 BEADRP CC[C@@H](C)[NH+](C)CCOCC[N@@H+](C)[C@@H](C)CC ZINC000178628884 388503154 /nfs/dbraw/zinc/50/31/54/388503154.db2.gz VRNHFRHCOCSYRN-OKILXGFUSA-N 2 0 244.423 2.464 20 0 BEADRP C[NH+](C)C[C@@H]1CC[N@H+](CC2CC(C)(C)C2)C1 ZINC000528379305 388518538 /nfs/dbraw/zinc/51/85/38/388518538.db2.gz GGDOTSWMQWPLMK-LBPRGKRZSA-N 2 0 224.392 2.306 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]Cc1noc2ccccc12 ZINC000564348510 388531247 /nfs/dbraw/zinc/53/12/47/388531247.db2.gz LODACMFCFVECSQ-NSHDSACASA-N 2 0 247.342 2.435 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+]C[C@H](C)CC)C1 ZINC000245547005 388588235 /nfs/dbraw/zinc/58/82/35/388588235.db2.gz XAFHMGNHQRVWDG-CHWSQXEVSA-N 2 0 212.381 2.354 20 0 BEADRP CO[C@H](C[N@@H+]1CC[C@H]([NH3+])C[C@@H]1C)c1ccccc1 ZINC000379171133 388594458 /nfs/dbraw/zinc/59/44/58/388594458.db2.gz DIKNAXKSMCFXGE-AEGPPILISA-N 2 0 248.370 2.186 20 0 BEADRP CC(C)[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)C1CC1 ZINC000401055220 388605300 /nfs/dbraw/zinc/60/53/00/388605300.db2.gz DIGZRSDIHXBIOA-BARDWOONSA-N 2 0 236.403 2.399 20 0 BEADRP CC(C)[NH2+][C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000245891528 388609914 /nfs/dbraw/zinc/60/99/14/388609914.db2.gz MFJDGGVFISXFHS-KGLIPLIRSA-N 2 0 218.344 2.430 20 0 BEADRP CCC[C@@H]1C[C@H]1[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@@H]1C ZINC000222164212 388614012 /nfs/dbraw/zinc/61/40/12/388614012.db2.gz VNTJYJUWWWZKQF-RYMFRWLXSA-N 2 0 224.392 2.493 20 0 BEADRP Cc1ccc(C[N@@H+]2C[C@@H](C[NH3+])[C@H](C)C2)cc1 ZINC000631843891 388614097 /nfs/dbraw/zinc/61/40/97/388614097.db2.gz SYWXCOLVSSPUKJ-TZMCWYRMSA-N 2 0 218.344 2.022 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H](C)[C@@H]1CCCCO1 ZINC000356693287 388551195 /nfs/dbraw/zinc/55/11/95/388551195.db2.gz IZDVAKCMCNAZGN-AGIUHOORSA-N 2 0 228.380 2.051 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])C1)c1ccoc1 ZINC000517553983 388553316 /nfs/dbraw/zinc/55/33/16/388553316.db2.gz LCSQLDZCXSSHIL-NHCYSSNCSA-N 2 0 208.305 2.058 20 0 BEADRP CO[C@H](C[NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21)C(C)C ZINC000362975010 388562370 /nfs/dbraw/zinc/56/23/70/388562370.db2.gz CZGUXIHUSHUSFI-QLFBSQMISA-N 2 0 248.370 2.392 20 0 BEADRP CS[C@H]1CC[N@H+](CC[C@@H]2CCCC[NH+]2C)C1 ZINC000521192235 388564391 /nfs/dbraw/zinc/56/43/91/388564391.db2.gz OCILFBUQBHIHSM-STQMWFEESA-N 2 0 242.432 2.298 20 0 BEADRP CCCC[NH2+][C@@H]1CC[N@H+](C)[C@@H]2CCC[C@H]21 ZINC000367621443 388566322 /nfs/dbraw/zinc/56/63/22/388566322.db2.gz SXDORDIQVCYDBG-YNEHKIRRSA-N 2 0 210.365 2.249 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C2CCCC2)[C@H]2CCC[C@H]21 ZINC000367625807 388566439 /nfs/dbraw/zinc/56/64/39/388566439.db2.gz ZAJPPFXMGKLSJP-HZSPNIEDSA-N 2 0 222.376 2.391 20 0 BEADRP CCCC[N@H+](C)[C@H]1CC[NH+](CC)C[C@H]1C ZINC000245412385 388577327 /nfs/dbraw/zinc/57/73/27/388577327.db2.gz ALXVSQKROVXQKK-OLZOCXBDSA-N 2 0 212.381 2.449 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH+](C)CCCSC)[C@@H](C)C1 ZINC000245423593 388577927 /nfs/dbraw/zinc/57/79/27/388577927.db2.gz JOGBDUCKUMMYFF-STQMWFEESA-N 2 0 244.448 2.402 20 0 BEADRP C[C@@H](CC1CCC1)[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000530176287 388620078 /nfs/dbraw/zinc/62/00/78/388620078.db2.gz AKINQRPZNMKSAE-WCQYABFASA-N 2 0 222.376 2.439 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000530176643 388621310 /nfs/dbraw/zinc/62/13/10/388621310.db2.gz DUTYDDDUOQFXQM-GRYCIOLGSA-N 2 0 208.349 2.049 20 0 BEADRP CC1(C)CCC[C@H]1[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000530177317 388621785 /nfs/dbraw/zinc/62/17/85/388621785.db2.gz FYBJECJREZRIJO-NEPJUHHUSA-N 2 0 222.376 2.439 20 0 BEADRP CCC(CC)C[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000530179108 388621939 /nfs/dbraw/zinc/62/19/39/388621939.db2.gz TXLHBEDXFOJJJI-LBPRGKRZSA-N 2 0 210.365 2.297 20 0 BEADRP COCC[N@H+](C)CCC[NH2+][C@H]1CC=C(C)CC1 ZINC000551264969 388624666 /nfs/dbraw/zinc/62/46/66/388624666.db2.gz HNHBEJHDKHIQDC-AWEZNQCLSA-N 2 0 240.391 2.043 20 0 BEADRP C[NH2+]C[C@H]1CCC[N@@H+]1CC1CC(C)(C)C1 ZINC000530207808 388626163 /nfs/dbraw/zinc/62/61/63/388626163.db2.gz DOUQZQDYVDUERR-GFCCVEGCSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]C[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000530206307 388626416 /nfs/dbraw/zinc/62/64/16/388626416.db2.gz AJVYDLUVHZJVKM-YYHQMBLXSA-N 2 0 210.365 2.138 20 0 BEADRP CCC[C@H](C[NH2+][C@H]1CCCC[C@H]1C[NH3+])OCC ZINC000530206572 388626690 /nfs/dbraw/zinc/62/66/90/388626690.db2.gz APOIPLXOJUFKTD-MJBXVCDLSA-N 2 0 242.407 2.299 20 0 BEADRP COCCC1CC[NH+]([C@H]2CCC[C@H]([NH3+])C2)CC1 ZINC000530212177 388627333 /nfs/dbraw/zinc/62/73/33/388627333.db2.gz PLINAWMOTKNOGJ-KBPBESRZSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[NH2+]C12CCC2)[C@@H]1CC1(C)C ZINC000530217645 388630106 /nfs/dbraw/zinc/63/01/06/388630106.db2.gz URYMNCVXKJUVGO-SDDRHHMPSA-N 2 0 222.376 2.295 20 0 BEADRP CC[C@H]([NH2+]CC1CC=CC1)[C@@H]1CCC[NH2+]1 ZINC000530217666 388630124 /nfs/dbraw/zinc/63/01/24/388630124.db2.gz UZTIMXDAEHYCCJ-STQMWFEESA-N 2 0 208.349 2.073 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CC=CCC1)[C@@H]1CCC[NH2+]1 ZINC000530217788 388630182 /nfs/dbraw/zinc/63/01/82/388630182.db2.gz HXBMABMNCBNPFG-RDBSUJKOSA-N 2 0 222.376 2.463 20 0 BEADRP C[C@H]([NH2+]CC1CC=CC1)[C@@H]1CCCC[NH2+]1 ZINC000530217411 388630555 /nfs/dbraw/zinc/63/05/55/388630555.db2.gz STIMROBEFVYYAC-AAEUAGOBSA-N 2 0 208.349 2.073 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000530216353 388630880 /nfs/dbraw/zinc/63/08/80/388630880.db2.gz AXPAGDWQOXAFPT-SDDRHHMPSA-N 2 0 210.365 2.295 20 0 BEADRP CC1(C)CC(C[N@@H+]2CC[C@](C)(C[NH3+])C2)C1 ZINC000530218223 388631743 /nfs/dbraw/zinc/63/17/43/388631743.db2.gz KNSYTYFJPHHGPY-CYBMUJFWSA-N 2 0 210.365 2.093 20 0 BEADRP CC1(C)CC(C[N@@H+]2CC[C@@](C)(C[NH3+])C2)C1 ZINC000530218225 388631763 /nfs/dbraw/zinc/63/17/63/388631763.db2.gz KNSYTYFJPHHGPY-ZDUSSCGKSA-N 2 0 210.365 2.093 20 0 BEADRP C[C@H]1C[C@H](C[NH3+])C[N@@H+]1CC1CC(C)(C)C1 ZINC000530225159 388636017 /nfs/dbraw/zinc/63/60/17/388636017.db2.gz WUSFEQSWPMLIBB-WDEREUQCSA-N 2 0 210.365 2.092 20 0 BEADRP Cc1ncccc1C[NH2+][C@H](C)C[C@H]1CCC[NH2+]1 ZINC000530243340 388638682 /nfs/dbraw/zinc/63/86/82/388638682.db2.gz HPBUZPFAJKISHS-BXUZGUMPSA-N 2 0 233.359 2.010 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](C)C2(C)CC2)C1 ZINC000246886053 388654368 /nfs/dbraw/zinc/65/43/68/388654368.db2.gz FDIJKVHFAQEVSH-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)C2CCC2)C1 ZINC000247183479 388659717 /nfs/dbraw/zinc/65/97/17/388659717.db2.gz VIUJXJAPEZGCBH-VXGBXAGGSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C[C@H]2CCC[N@H+](C)C2)C1 ZINC000251763256 388752854 /nfs/dbraw/zinc/75/28/54/388752854.db2.gz DSABJECGWJNNGA-JHJVBQTASA-N 2 0 210.365 2.106 20 0 BEADRP COC[C@H]([NH2+]CC[C@@H]1CCCC[N@@H+]1C)C(C)C ZINC000086700181 388691101 /nfs/dbraw/zinc/69/11/01/388691101.db2.gz IBXWHIZYGKGFTE-KBPBESRZSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H]([NH2+]CC1CC[NH+](C)CC1)c1cncs1 ZINC000126247796 388692615 /nfs/dbraw/zinc/69/26/15/388692615.db2.gz LWHUYFXICLVBRC-SNVBAGLBSA-N 2 0 239.388 2.136 20 0 BEADRP C[C@@H](C[NH2+]C1CCC2(CCCO2)CC1)N(C)C ZINC000648771014 388858821 /nfs/dbraw/zinc/85/88/21/388858821.db2.gz MWLMJXYHYUBGAN-HSBZDZAISA-N 2 0 240.391 2.018 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CCCC2CC2)[C@H](C)C1 ZINC000129727713 388868527 /nfs/dbraw/zinc/86/85/27/388868527.db2.gz RSXUKPMYRCLOON-OCCSQVGLSA-N 2 0 224.392 2.497 20 0 BEADRP CC1(C[NH+]2CCC([C@H]3CCC[NH2+]3)CC2)CC1 ZINC000564969095 388903535 /nfs/dbraw/zinc/90/35/35/388903535.db2.gz QTSNDCMUUWOAFM-CYBMUJFWSA-N 2 0 222.376 2.251 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]CCC2CC(F)(F)C2)C1 ZINC000565226875 388929533 /nfs/dbraw/zinc/92/95/33/388929533.db2.gz OSVUKDXUMKVVAC-QWRGUYRKSA-N 2 0 232.318 2.281 20 0 BEADRP C([NH2+][C@@H]1CCCC12CC2)[C@H]1CC[N@@H+](C2CC2)C1 ZINC000565242672 388930530 /nfs/dbraw/zinc/93/05/30/388930530.db2.gz GVQSIDLWXWHNPR-TZMCWYRMSA-N 2 0 234.387 2.393 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+][C@@H]2CCCC[C@H]2F)C1 ZINC000565313673 388937150 /nfs/dbraw/zinc/93/71/50/388937150.db2.gz MNCABZDSHFMZSD-IRCOFANPSA-N 2 0 214.328 2.127 20 0 BEADRP C([NH2+][C@@H]1CCCC12CC2)[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000565242666 388930840 /nfs/dbraw/zinc/93/08/40/388930840.db2.gz GVQSIDLWXWHNPR-GXTWGEPZSA-N 2 0 234.387 2.393 20 0 BEADRP CC[C@H]([NH2+]Cc1ccc(C[NH3+])cc1)[C@H]1CCOC1 ZINC000565421920 388942808 /nfs/dbraw/zinc/94/28/08/388942808.db2.gz IPXYFINXZQLMJJ-GJZGRUSLSA-N 2 0 248.370 2.050 20 0 BEADRP [NH3+]Cc1ccc(OC[C@H]2CC[C@H](C[NH3+])CC2)cc1 ZINC000566103426 388986755 /nfs/dbraw/zinc/98/67/55/388986755.db2.gz NXHINOUXBAMXLJ-MQMHXKEQSA-N 2 0 248.370 2.289 20 0 BEADRP C[C@H]([NH2+]CC1CC(C)(C)C1)[C@@H]1CCC[NH2+]1 ZINC000566091243 388987185 /nfs/dbraw/zinc/98/71/85/388987185.db2.gz KFTBCMQUZHCAGH-JQWIXIFHSA-N 2 0 210.365 2.153 20 0 BEADRP Cc1c[nH+]ccc1NCC1([NH+](C)C)CCCCC1 ZINC000359361303 177650514 /nfs/dbraw/zinc/65/05/14/177650514.db2.gz HYDJFVWSYQJPNZ-UHFFFAOYSA-N 2 0 247.386 2.488 20 0 BEADRP Cc1ccc(F)c(C[NH2+]CC2=CC[N@H+](C)CC2)c1 ZINC000271837676 389026841 /nfs/dbraw/zinc/02/68/41/389026841.db2.gz QEHKTDCAMVTKBO-UHFFFAOYSA-N 2 0 248.345 2.486 20 0 BEADRP C[N@H+]1CC=C(C[NH2+]Cc2ccc(F)cc2)CC1 ZINC000271874091 389026870 /nfs/dbraw/zinc/02/68/70/389026870.db2.gz YTLMNTIGORTPMX-UHFFFAOYSA-N 2 0 234.318 2.177 20 0 BEADRP C[C@@H]([NH2+]CC1(C)CCCC1)[C@H]1CCC[NH2+]1 ZINC000400422272 533355122 /nfs/dbraw/zinc/35/51/22/533355122.db2.gz XIRJLEUSBKHJRM-VXGBXAGGSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)[C@@H]1CCC[NH2+]1)C1CCCC1 ZINC000400378480 533499978 /nfs/dbraw/zinc/49/99/78/533499978.db2.gz JMFGYNGFYSLMHM-MDZLAQPJSA-N 2 0 210.365 2.295 20 0 BEADRP Cc1cc(N2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)cc[nH+]1 ZINC000274918801 132204369 /nfs/dbraw/zinc/20/43/69/132204369.db2.gz OTPKBPGOFJQGFP-UKRRQHHQSA-N 2 0 245.370 2.311 20 0 BEADRP Cc1cc(N2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)cc[nH+]1 ZINC000274918797 132204498 /nfs/dbraw/zinc/20/44/98/132204498.db2.gz OTPKBPGOFJQGFP-DZGCQCFKSA-N 2 0 245.370 2.311 20 0 BEADRP C[C@@H]1CN(c2cc[nH+]c3ccccc32)CC[C@@H]1[NH3+] ZINC000094342414 132239269 /nfs/dbraw/zinc/23/92/69/132239269.db2.gz WQSGBYFGDNVMSD-YPMHNXCESA-N 2 0 241.338 2.408 20 0 BEADRP Cc1cc(N2CCC([NH3+])CC2)c2ccccc2[nH+]1 ZINC000035697517 132268705 /nfs/dbraw/zinc/26/87/05/132268705.db2.gz UUFSENHKHJLEPI-UHFFFAOYSA-N 2 0 241.338 2.471 20 0 BEADRP CC1(C)C[C@@H]1[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000045116846 132354748 /nfs/dbraw/zinc/35/47/48/132354748.db2.gz RTQDSGZKWSCWOI-AWEZNQCLSA-N 2 0 245.370 2.439 20 0 BEADRP C[C@@H]1C[C@@H]1[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000052272856 132362146 /nfs/dbraw/zinc/36/21/46/132362146.db2.gz UHCJZRGFPDMTLK-RISCZKNCSA-N 2 0 231.343 2.048 20 0 BEADRP [NH3+]C[C@@H]1CC[C@H]([NH2+]C2CCC3(CC3)CC2)C1 ZINC000335486512 133882282 /nfs/dbraw/zinc/88/22/82/133882282.db2.gz HEOQTAGNJPAKMO-YPMHNXCESA-N 2 0 222.376 2.426 20 0 BEADRP C[NH+](C)C1CCC([NH2+]Cc2cccnc2)CC1 ZINC000351521545 133973265 /nfs/dbraw/zinc/97/32/65/133973265.db2.gz HYBOFNZHSQABIU-UHFFFAOYSA-N 2 0 233.359 2.044 20 0 BEADRP Cc1ccsc1C[N@H+]1CC[C@@H]([C@@H](C)[NH3+])C1 ZINC000168519451 134225480 /nfs/dbraw/zinc/22/54/80/134225480.db2.gz PMGFEGCVGCHVNX-GHMZBOCLSA-N 2 0 224.373 2.226 20 0 BEADRP C1CCCC([NH2+][C@H]2CCC[NH2+]CC2)CC1 ZINC000168708111 134246461 /nfs/dbraw/zinc/24/64/61/134246461.db2.gz BYQGIHLCIULUCR-ZDUSSCGKSA-N 2 0 210.365 2.441 20 0 BEADRP C1CCCC([NH2+][C@@H]2CCC[NH2+]CC2)CC1 ZINC000168708026 134246505 /nfs/dbraw/zinc/24/65/05/134246505.db2.gz BYQGIHLCIULUCR-CYBMUJFWSA-N 2 0 210.365 2.441 20 0 BEADRP c1csc(CC[NH2+][C@H]2CCC[NH2+]CC2)c1 ZINC000168703175 134246534 /nfs/dbraw/zinc/24/65/34/134246534.db2.gz IGRLVJGPKUCEGM-NSHDSACASA-N 2 0 224.373 2.022 20 0 BEADRP C[C@]1(C[NH2+][C@H]2CCC[NH2+]CC2)CCCS1 ZINC000168774165 134247905 /nfs/dbraw/zinc/24/79/05/134247905.db2.gz WFKCVLPTDWTVHJ-NWDGAFQWSA-N 2 0 228.405 2.004 20 0 BEADRP C[C@H](c1cccc(F)c1)[N@@H+]1CC[C@@H](C[NH3+])C1 ZINC000219122340 134274872 /nfs/dbraw/zinc/27/48/72/134274872.db2.gz XMRDWBJBEDGNIL-MNOVXSKESA-N 2 0 222.307 2.167 20 0 BEADRP CC[N@H+](C)C[C@@H]1CC[NH+]([C@H]2C=CCCC2)C1 ZINC000173902828 134278660 /nfs/dbraw/zinc/27/86/60/134278660.db2.gz YVCXIVFZSRNSGZ-KBPBESRZSA-N 2 0 222.376 2.369 20 0 BEADRP Cc1cc(Cl)ccc1C[N@@H+]1CC[C@@H](C[NH3+])C1 ZINC000219843555 134292376 /nfs/dbraw/zinc/29/23/76/134292376.db2.gz IRUQXDSSJHUDKS-NSHDSACASA-N 2 0 238.762 2.429 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CCCOC(C)C)[C@H](C)C1 ZINC000178192053 134304409 /nfs/dbraw/zinc/30/44/09/134304409.db2.gz HYMMUXZRUMTPQI-ZIAGYGMSSA-N 2 0 242.407 2.121 20 0 BEADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@H](C)C1CCC1 ZINC000178377533 134309089 /nfs/dbraw/zinc/30/90/89/134309089.db2.gz OXQREBQKAOWKCT-TZMCWYRMSA-N 2 0 242.407 2.121 20 0 BEADRP Cc1ccc(C[NH2+][C@H](C)CC[NH3+])cc1Cl ZINC000220509822 134309856 /nfs/dbraw/zinc/30/98/56/134309856.db2.gz WNGYTTAGDNZALK-SNVBAGLBSA-N 2 0 226.751 2.475 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CCC[NH+](C)C)[C@@H](C)C1 ZINC000221649018 134325660 /nfs/dbraw/zinc/32/56/60/134325660.db2.gz RNQHERPPMCAAGN-AGIUHOORSA-N 2 0 212.381 2.352 20 0 BEADRP CC(C)CCC[NH2+][C@@H]1CC[N@H+](C)C[C@@H]1C ZINC000221874653 134328519 /nfs/dbraw/zinc/32/85/19/134328519.db2.gz VEYBWBHZRZJHAJ-QWHCGFSZSA-N 2 0 212.381 2.352 20 0 BEADRP COc1cccc(C[NH2+][C@@H]2CC[N@H+](C)C[C@@H]2C)c1 ZINC000222075421 134329122 /nfs/dbraw/zinc/32/91/22/134329122.db2.gz ZGYKOAUGHLRSPA-SWLSCSKDSA-N 2 0 248.370 2.125 20 0 BEADRP CCSCC[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C)C1 ZINC000224012811 134344107 /nfs/dbraw/zinc/34/41/07/134344107.db2.gz CATCVZCDHXHIPW-QWHCGFSZSA-N 2 0 242.432 2.156 20 0 BEADRP CC(C)[C@H](C)[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000227495678 134381234 /nfs/dbraw/zinc/38/12/34/134381234.db2.gz LLTKYUABTINAAH-LBPRGKRZSA-N 2 0 212.381 2.352 20 0 BEADRP COCC[C@H](C)[NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000227541273 134382679 /nfs/dbraw/zinc/38/26/79/134382679.db2.gz PGHKVUVKERTPKP-GDLCADMTSA-N 2 0 234.343 2.146 20 0 BEADRP COc1ccc([C@H](C)[N@H+](C)CCC[NH3+])cc1 ZINC000227744294 134392193 /nfs/dbraw/zinc/39/21/93/134392193.db2.gz ZKDIMNBAQPZYBP-NSHDSACASA-N 2 0 222.332 2.037 20 0 BEADRP CC1CC([NH2+]CCC[NH+]2CCC(C)CC2)C1 ZINC000231787171 134545397 /nfs/dbraw/zinc/54/53/97/134545397.db2.gz VDHZECOJKGCPEP-UHFFFAOYSA-N 2 0 224.392 2.497 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+][C@H]1CCc2ccccc21 ZINC000234755729 134583410 /nfs/dbraw/zinc/58/34/10/134583410.db2.gz NTEKBXWYHYLCMO-HIFRSBDPSA-N 2 0 248.370 2.017 20 0 BEADRP C[NH+](C)CCC[NH2+]C[C@H]1C[C@H]1c1ccccc1 ZINC000135610536 134752250 /nfs/dbraw/zinc/75/22/50/134752250.db2.gz YWGGPAKHNDNXQC-CABCVRRESA-N 2 0 232.371 2.331 20 0 BEADRP CC[C@@H]1CC[C@@H]([NH2+]CC2CC[NH+](C)CC2)C1 ZINC000070643693 135001499 /nfs/dbraw/zinc/00/14/99/135001499.db2.gz KBWOQPWHNNAUAO-TZMCWYRMSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CC2CC[NH+](C)CC2)C1 ZINC000070643697 135002079 /nfs/dbraw/zinc/00/20/79/135002079.db2.gz YVWMRLHIXNECMJ-DGCLKSJQSA-N 2 0 210.365 2.106 20 0 BEADRP CCOC(C)(C)C[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000249128302 135035272 /nfs/dbraw/zinc/03/52/72/135035272.db2.gz RMQKLACBZCGNJY-OLZOCXBDSA-N 2 0 240.391 2.018 20 0 BEADRP c1coc(CC[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)c1 ZINC000250090127 135049354 /nfs/dbraw/zinc/04/93/54/135049354.db2.gz OUOOAHJYDHTKBJ-STQMWFEESA-N 2 0 234.343 2.039 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CCC[C@H]2C)C1 ZINC000250257088 135051311 /nfs/dbraw/zinc/05/13/11/135051311.db2.gz JFCSKVSNNWQWRT-JHJVBQTASA-N 2 0 210.365 2.106 20 0 BEADRP C([NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)C1CCCC1 ZINC000251586182 135072140 /nfs/dbraw/zinc/07/21/40/135072140.db2.gz YYUPDPZZLUYRJG-KBPBESRZSA-N 2 0 222.376 2.393 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)C1 ZINC000251685502 135074887 /nfs/dbraw/zinc/07/48/87/135074887.db2.gz AQBRMURSNBXWDD-UPJWGTAASA-N 2 0 222.376 2.249 20 0 BEADRP C[C@@H]1C[N@H+](Cc2ccc3c(c2)CCC3)CC[C@H]1[NH3+] ZINC000251837179 135079332 /nfs/dbraw/zinc/07/93/32/135079332.db2.gz QBTLNIVLAUZURD-MLGOLLRUSA-N 2 0 244.382 2.344 20 0 BEADRP C[C@@H]1CCC[C@H](C)[C@H]1[NH2+]CCC[NH+](C)C ZINC000252100952 135083786 /nfs/dbraw/zinc/08/37/86/135083786.db2.gz GGGJVALCHITYFW-ITGUQSILSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H]1C[C@H]([NH2+]C2CC[NH2+]CC2)C[C@@H](C)C1 ZINC000252100168 135083953 /nfs/dbraw/zinc/08/39/53/135083953.db2.gz IGZACBDQKKCLEO-PJXYFTJBSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@H](C)C[NH2+]CC1CCC(C[NH3+])CC1 ZINC000086478840 135085485 /nfs/dbraw/zinc/08/54/85/135085485.db2.gz QULVLTCGCGLZED-HIFPTAJRSA-N 2 0 212.381 2.387 20 0 BEADRP C[C@H]1CCC[N@H+](CC[C@H]2CC[NH2+]C2)CC1 ZINC000252208135 135086720 /nfs/dbraw/zinc/08/67/20/135086720.db2.gz VOSPQWKXVQJGNG-QWHCGFSZSA-N 2 0 210.365 2.108 20 0 BEADRP C([NH2+][C@H]1CCC[C@@H]1[C@H]1CCCC[NH2+]1)C1CC1 ZINC000086499926 135087262 /nfs/dbraw/zinc/08/72/62/135087262.db2.gz YQHOUZQDMVWJLZ-MCIONIFRSA-N 2 0 222.376 2.297 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)CC(C)C)C1 ZINC000252439443 135089047 /nfs/dbraw/zinc/08/90/47/135089047.db2.gz ORTXDMHKCCWORW-OLZOCXBDSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)C1 ZINC000252513591 135092147 /nfs/dbraw/zinc/09/21/47/135092147.db2.gz ZMTKJJBHRHCCOM-RFGFWPKPSA-N 2 0 222.376 2.391 20 0 BEADRP C[C@@H]1CC[C@@H]([N@H+](C)CC2CC[NH2+]CC2)C1 ZINC000086701592 135093936 /nfs/dbraw/zinc/09/39/36/135093936.db2.gz DRZJUWLMSHKWQF-DGCLKSJQSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]1CCCC[C@H]1[NH2+]CC1CC[NH2+]CC1 ZINC000086700222 135095448 /nfs/dbraw/zinc/09/54/48/135095448.db2.gz RQTPKIDVJMASPH-WCQYABFASA-N 2 0 210.365 2.154 20 0 BEADRP CC[C@H]([NH2+]C1CCC([NH3+])CC1)c1nccs1 ZINC000086730378 135096088 /nfs/dbraw/zinc/09/60/88/135096088.db2.gz RHGQEURIVLGCGG-ILDUYXDCSA-N 2 0 239.388 2.454 20 0 BEADRP CC1(C[NH2+]C2CCC([NH3+])CC2)CCCC1 ZINC000086730134 135096093 /nfs/dbraw/zinc/09/60/93/135096093.db2.gz KGXGYDSEVKGBET-UHFFFAOYSA-N 2 0 210.365 2.426 20 0 BEADRP [NH3+]C[C@H]1CCC[C@H]1Nc1ccncc1Cl ZINC000086840114 135098631 /nfs/dbraw/zinc/09/86/31/135098631.db2.gz UDZUFQMNSZBVSU-PSASIEDQSA-N 2 0 225.723 2.274 20 0 BEADRP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]CCC(C)(C)C ZINC000252709647 135099335 /nfs/dbraw/zinc/09/93/35/135099335.db2.gz DKIJWELMUNGWSK-NWDGAFQWSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]CC1CCSCC1 ZINC000252712998 135100976 /nfs/dbraw/zinc/10/09/76/135100976.db2.gz NZWHJVMLTLSMDL-DGCLKSJQSA-N 2 0 242.432 2.059 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]CC1(C)CCC1 ZINC000252728926 135103964 /nfs/dbraw/zinc/10/39/64/135103964.db2.gz DKCLPCRMJLBEIG-VXGBXAGGSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1C[C@@H]1[NH2+][C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000252787833 135109810 /nfs/dbraw/zinc/10/98/10/135109810.db2.gz QRRFUAMNLPDOMP-YJRXYDGGSA-N 2 0 202.301 2.129 20 0 BEADRP CCCCC[N@@H+]1C[C@@H]2CCC[C@@H]([NH3+])[C@H]2C1 ZINC000252838325 135111635 /nfs/dbraw/zinc/11/16/35/135111635.db2.gz AGNNIWCLQKYANJ-RWMBFGLXSA-N 2 0 210.365 2.236 20 0 BEADRP CCC[C@H](C)C[N@@H+]1C[C@@H]2CCC[C@@H]([NH3+])[C@H]2C1 ZINC000252848006 135112510 /nfs/dbraw/zinc/11/25/10/135112510.db2.gz GIJVFFVYVVHYIS-XDQVBPFNSA-N 2 0 224.392 2.482 20 0 BEADRP CCC(CC)C[N@@H+]1C[C@@H]2CCC[C@H]([NH3+])[C@H]2C1 ZINC000252843100 135113333 /nfs/dbraw/zinc/11/33/33/135113333.db2.gz CXNWCHNUDGIZSF-IHRRRGAJSA-N 2 0 224.392 2.482 20 0 BEADRP C[C@@H]1C[C@@H](C)[N@H+](CC[C@H]2CCC[NH2+]C2)C1 ZINC000253063071 135120603 /nfs/dbraw/zinc/12/06/03/135120603.db2.gz GIYRGRDOZNJLRL-JHJVBQTASA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]1CC[N@H+](Cc2cccs2)C[C@H]1C[NH3+] ZINC000253183486 135122897 /nfs/dbraw/zinc/12/28/97/135122897.db2.gz GOSSCKJLDSKVQF-WDEREUQCSA-N 2 0 224.373 2.165 20 0 BEADRP Cc1ccsc1C[NH2+][C@@H]1CCCC[C@H]1[NH3+] ZINC000258804710 135134622 /nfs/dbraw/zinc/13/46/22/135134622.db2.gz CJBDBCIVYHOTPM-GHMZBOCLSA-N 2 0 224.373 2.416 20 0 BEADRP C[C@@H](c1cccnc1)[N@@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000257651018 135138734 /nfs/dbraw/zinc/13/87/34/135138734.db2.gz ADGBKMSAKZQNBP-ZDUSSCGKSA-N 2 0 245.370 2.218 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@]3(CC[NH2+]C3)C2)c(C)c1 ZINC000257686247 135139043 /nfs/dbraw/zinc/13/90/43/135139043.db2.gz MHJQGNBHBHBNPT-INIZCTEOSA-N 2 0 244.382 2.489 20 0 BEADRP C[C@@H](c1ccccc1)[N@@H+]1CC[C@]2(CC[NH2+]C2)C1 ZINC000257690571 135139230 /nfs/dbraw/zinc/13/92/30/135139230.db2.gz JBACJOGWDMWQSV-ZFWWWQNUSA-N 2 0 230.355 2.433 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@@]3(CC[NH2+]C3)C2)cc1C ZINC000257684127 135139267 /nfs/dbraw/zinc/13/92/67/135139267.db2.gz LSTXSQCSZOEVFO-MRXNPFEDSA-N 2 0 244.382 2.489 20 0 BEADRP Fc1ccccc1C[NH+]1CCC2(CC[NH2+]C2)CC1 ZINC000257709071 135141114 /nfs/dbraw/zinc/14/11/14/135141114.db2.gz SIGBWKJUFXBVFJ-UHFFFAOYSA-N 2 0 248.345 2.401 20 0 BEADRP c1csc(C[NH+]2CCC3(CC[NH2+]C3)CC2)c1 ZINC000257723785 135141155 /nfs/dbraw/zinc/14/11/55/135141155.db2.gz WBWJRVWVEKKPQA-UHFFFAOYSA-N 2 0 236.384 2.324 20 0 BEADRP CC[C@H](C)[NH+]1CCC([C@@H]2CC[NH2+]C2)CC1 ZINC000259321277 135142854 /nfs/dbraw/zinc/14/28/54/135142854.db2.gz QUNYTQYOVSDZED-WCQYABFASA-N 2 0 210.365 2.106 20 0 BEADRP C[NH2+]CCCN(C)Cc1ccc(F)cc1C ZINC000087472326 135143617 /nfs/dbraw/zinc/14/36/17/135143617.db2.gz LWLKIIHOQBAIBZ-UHFFFAOYSA-N 2 0 224.323 2.175 20 0 BEADRP CC1(C[N@@H+]2CCC[C@@H](CC[NH3+])C2)CCC1 ZINC000261530139 135157606 /nfs/dbraw/zinc/15/76/06/135157606.db2.gz CBZLHOMRLOOPRT-LBPRGKRZSA-N 2 0 210.365 2.237 20 0 BEADRP C[C@@H]1C[C@H](C)[N@H+](C[C@H]2CC[NH2+][C@@H](C)C2)C1 ZINC000261530779 135158716 /nfs/dbraw/zinc/15/87/16/135158716.db2.gz DAOGTQJETADWAV-VOAKCMCISA-N 2 0 210.365 2.105 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+]C1CCCCCC1 ZINC000261531029 135158960 /nfs/dbraw/zinc/15/89/60/135158960.db2.gz DXNOHFVBMYCCIG-YPMHNXCESA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[NH2+]C[C@H]1C)C1CCCC1 ZINC000261531170 135160013 /nfs/dbraw/zinc/16/00/13/135160013.db2.gz FLOPIFHKIVAEEP-NTZNESFSSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]([NH3+])[C@@H](C)[NH2+]C[C@@H](C)c1ccccc1 ZINC000261531655 135161076 /nfs/dbraw/zinc/16/10/76/135161076.db2.gz HKLLTGQAVHNDHM-IJLUTSLNSA-N 2 0 206.333 2.115 20 0 BEADRP CC1(C)CCC[C@@H]1[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000087647688 135161459 /nfs/dbraw/zinc/16/14/59/135161459.db2.gz HEEYBSKTDRCCHH-RYUDHWBXSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@@H]2CCC[NH2+]C2)[C@H](C)C1 ZINC000087647294 135161462 /nfs/dbraw/zinc/16/14/62/135161462.db2.gz IGYZBENVAABSJN-SYQHCUMBSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H]1C[N@H+](CC2CCC(C)CC2)C[C@H]1[NH3+] ZINC000261531874 135161627 /nfs/dbraw/zinc/16/16/27/135161627.db2.gz IDYCQYCDURYUMF-PYNQCMFNSA-N 2 0 210.365 2.092 20 0 BEADRP CS[C@@H]1CCC[C@H]([NH2+][C@H]2CCC[NH2+]CC2)C1 ZINC000261532377 135162575 /nfs/dbraw/zinc/16/25/75/135162575.db2.gz AFMCSOSOKCQECM-RWMBFGLXSA-N 2 0 242.432 2.392 20 0 BEADRP CC[C@@H]1CCC[N@H+](C[C@@H]2CC[NH2+][C@H](C)C2)C1 ZINC000261532728 135163138 /nfs/dbraw/zinc/16/31/38/135163138.db2.gz DIKLLNDKUDNXFW-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CC[C@H](C)[N@H+](C[C@H]2CC[NH2+][C@H](C)C2)C1 ZINC000261532751 135163581 /nfs/dbraw/zinc/16/35/81/135163581.db2.gz DWKNIUVZVJBHKL-MQYQWHSLSA-N 2 0 224.392 2.495 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]C[C@@H]1CCCCS1 ZINC000087682942 135164214 /nfs/dbraw/zinc/16/42/14/135164214.db2.gz MXKZNYGZJMQMJP-RWMBFGLXSA-N 2 0 242.432 2.379 20 0 BEADRP C[C@@H]1CC[N@H+](CCC2CC[NH2+]CC2)[C@@H]1C ZINC000261533513 135164773 /nfs/dbraw/zinc/16/47/73/135164773.db2.gz BEUSTCWIWJNKHW-VXGBXAGGSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]1CC[N@H+](CCC2CC[NH2+]CC2)[C@H]1C ZINC000261533512 135164821 /nfs/dbraw/zinc/16/48/21/135164821.db2.gz BEUSTCWIWJNKHW-RYUDHWBXSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1[C@@H](C)CC[N@@H+]1CCC1CC[NH2+]CC1 ZINC000261533511 135164862 /nfs/dbraw/zinc/16/48/62/135164862.db2.gz BEUSTCWIWJNKHW-NWDGAFQWSA-N 2 0 210.365 2.106 20 0 BEADRP CC1(C)CC[C@H]1[NH2+]CC1(C)CC[NH2+]CC1 ZINC000261533566 135165145 /nfs/dbraw/zinc/16/51/45/135165145.db2.gz KXYGIGSNMFOGLW-LLVKDONJSA-N 2 0 210.365 2.154 20 0 BEADRP Cc1ccc(CN2C[C@H](C)[C@H]([NH3+])C2)c(C)c1 ZINC000261534311 135166661 /nfs/dbraw/zinc/16/66/61/135166661.db2.gz PVDVYHSYHAJGHT-GXTWGEPZSA-N 2 0 218.344 2.082 20 0 BEADRP CC(C)[C@H]1CC[N@H+](C[C@@H]2CC[NH2+][C@H](C)C2)C1 ZINC000261535241 135169519 /nfs/dbraw/zinc/16/95/19/135169519.db2.gz XECAGSGUGWSYDN-MCIONIFRSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+][C@@H]2CCC[C@H]2C[NH3+])C1 ZINC000261536501 135172126 /nfs/dbraw/zinc/17/21/26/135172126.db2.gz RZEGZUTXLGLUGV-MROQNXINSA-N 2 0 210.365 2.140 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]C2CC[NH2+]CC2)CC1 ZINC000261536977 135172940 /nfs/dbraw/zinc/17/29/40/135172940.db2.gz ULBIUFNMPDAOQF-NEPJUHHUSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]1C[NH2+]CC[C@@H]1[NH2+]CC1CCCCC1 ZINC000261538479 135176150 /nfs/dbraw/zinc/17/61/50/135176150.db2.gz YGBVPRXODRERLQ-AAEUAGOBSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H]([NH3+])[C@H]1CCC[N@H+](CC2(C)CCC2)C1 ZINC000261538374 135176284 /nfs/dbraw/zinc/17/62/84/135176284.db2.gz XWGFWHCZJIHZGQ-RYUDHWBXSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CCC[N@H+](CC2(C)CCC2)C1 ZINC000261538373 135176674 /nfs/dbraw/zinc/17/66/74/135176674.db2.gz XWGFWHCZJIHZGQ-NWDGAFQWSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@@H]2CCC[NH2+]2)[C@H](C)C1 ZINC000261538779 135177046 /nfs/dbraw/zinc/17/70/46/135177046.db2.gz ZHEQYJQCLGTVCK-NDBYEHHHSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@@H]1[C@H](C)CC[N@@H+]1C[C@]1(C)CC[NH2+]C1 ZINC000261539799 135178811 /nfs/dbraw/zinc/17/88/11/135178811.db2.gz DEPZGYNZQVWNCI-JHJVBQTASA-N 2 0 210.365 2.106 20 0 BEADRP Cc1ncsc1C[N@@H+]1CCCC[C@@H]1CC[NH3+] ZINC000084149529 135188528 /nfs/dbraw/zinc/18/85/28/135188528.db2.gz GGRNWYUNUNONBA-LLVKDONJSA-N 2 0 239.388 2.155 20 0 BEADRP C[C@@H]1CCCC[N@H+](CC2CC[NH2+]CC2)C1 ZINC000261549496 135188651 /nfs/dbraw/zinc/18/86/51/135188651.db2.gz ORMCVSNPTSCJNU-GFCCVEGCSA-N 2 0 210.365 2.108 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]C1Cc2ccccc2C1 ZINC000261550764 135189380 /nfs/dbraw/zinc/18/93/80/135189380.db2.gz QJJCELYJVZYYEX-GOEBONIOSA-N 2 0 244.382 2.261 20 0 BEADRP C(C1CCCCCC1)[N@@H+]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000261553548 135193056 /nfs/dbraw/zinc/19/30/56/135193056.db2.gz NZMDATUUTGIFAF-GJZGRUSLSA-N 2 0 236.403 2.498 20 0 BEADRP C(C1CCCCCC1)[N@@H+]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000261553549 135193163 /nfs/dbraw/zinc/19/31/63/135193163.db2.gz NZMDATUUTGIFAF-HUUCEWRRSA-N 2 0 236.403 2.498 20 0 BEADRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]CCc1cccs1 ZINC000084217772 135193206 /nfs/dbraw/zinc/19/32/06/135193206.db2.gz DZMLAVGRKJTVIB-ZYHUDNBSSA-N 2 0 224.373 2.008 20 0 BEADRP Cc1ccc(F)c(CN2CC[C@@](C)(C[NH3+])C2)c1 ZINC000261555545 135194919 /nfs/dbraw/zinc/19/49/19/135194919.db2.gz PWPAMEGXNMVWFK-AWEZNQCLSA-N 2 0 236.334 2.305 20 0 BEADRP CC[N@H+](CCC1CC[NH2+]CC1)C1CCC1 ZINC000261555404 135195599 /nfs/dbraw/zinc/19/55/99/135195599.db2.gz UWNMNPZOESDFLH-UHFFFAOYSA-N 2 0 210.365 2.251 20 0 BEADRP Cc1ccc(F)c(CN2CC[C@](C)(C[NH3+])C2)c1 ZINC000261555546 135195720 /nfs/dbraw/zinc/19/57/20/135195720.db2.gz PWPAMEGXNMVWFK-CQSZACIVSA-N 2 0 236.334 2.305 20 0 BEADRP Cc1ccc(C)c(C[N@@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@H]3C2)c1 ZINC000261556908 135196688 /nfs/dbraw/zinc/19/66/88/135196688.db2.gz CFRTWQJWHXLSGL-CWRNSKLLSA-N 2 0 244.382 2.473 20 0 BEADRP CC(C)[C@](C)(C[NH3+])[NH2+]CCOc1ccccc1 ZINC000261556492 135196925 /nfs/dbraw/zinc/19/69/25/135196925.db2.gz QVGKOKUJVJTMRN-AWEZNQCLSA-N 2 0 236.359 2.028 20 0 BEADRP CCOc1cccc(C[N@@H+]2CC[C@](C)(C[NH3+])C2)c1 ZINC000261556931 135197278 /nfs/dbraw/zinc/19/72/78/135197278.db2.gz CGKXMIJCPYXGPC-OAHLLOKOSA-N 2 0 248.370 2.256 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]1[NH2+]Cc1ccc(F)cc1 ZINC000261557487 135198083 /nfs/dbraw/zinc/19/80/83/135198083.db2.gz RUDMLMWHZLONDB-ZDUSSCGKSA-N 2 0 236.334 2.303 20 0 BEADRP C[C@@H]1COCC[C@@H]1[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000261558244 135198663 /nfs/dbraw/zinc/19/86/63/135198663.db2.gz DBXMRYFZEVHEII-QPKOPYBWSA-N 2 0 246.354 2.146 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[NH2+]C[C@H]1C)c1ccc(F)cc1 ZINC000261558432 135199850 /nfs/dbraw/zinc/19/98/50/135199850.db2.gz SJMSFSURCXEBPR-UHIISALHSA-N 2 0 236.334 2.474 20 0 BEADRP CCc1ccc(C[N@@H+]2CC[C@H]3C[NH2+]C[C@@H]3C2)cc1 ZINC000261561598 135202809 /nfs/dbraw/zinc/20/28/09/135202809.db2.gz FZSFWDYBRZCXMJ-JKSUJKDBSA-N 2 0 244.382 2.290 20 0 BEADRP Cc1cc(N2CC[C@@H]([NH3+])[C@@H]2C)c2ccccc2[nH+]1 ZINC000261562602 135204068 /nfs/dbraw/zinc/20/40/68/135204068.db2.gz GNFVTDZSDCNIIE-WCQYABFASA-N 2 0 241.338 2.469 20 0 BEADRP Cc1[nH+]ccc(N(C)CC(C)(C)C[NH3+])c1Cl ZINC000261564433 135205838 /nfs/dbraw/zinc/20/58/38/135205838.db2.gz CNPUFMDDPCNDDD-UHFFFAOYSA-N 2 0 241.766 2.465 20 0 BEADRP COc1cccc([C@H](C)[N@@H+]2CC[C@](C)(C[NH3+])C2)c1 ZINC000261563964 135206073 /nfs/dbraw/zinc/20/60/73/135206073.db2.gz HDIKRDYLWVKQSC-SWLSCSKDSA-N 2 0 248.370 2.427 20 0 BEADRP Cc1cccc(C[N@@H+]2C[C@@H]3CC[C@H]([NH3+])[C@@H]3C2)c1C ZINC000261565667 135207450 /nfs/dbraw/zinc/20/74/50/135207450.db2.gz HXAQDRVUJNSRLH-XHSDSOJGSA-N 2 0 244.382 2.473 20 0 BEADRP C[C@H](C[C@H]1CCCCC[NH2+]1)[NH2+]CCC(C)(C)O ZINC000261565385 135207685 /nfs/dbraw/zinc/20/76/85/135207685.db2.gz YHTZCBYCWZMHEN-CHWSQXEVSA-N 2 0 242.407 2.048 20 0 BEADRP Cc1ccccc1C[C@H](C)[NH2+][C@H](C)[C@H](C)[NH3+] ZINC000261568615 135210509 /nfs/dbraw/zinc/21/05/09/135210509.db2.gz FQOYLXKHECKHQT-RWMBFGLXSA-N 2 0 220.360 2.251 20 0 BEADRP CCSCCC[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000164012730 135211842 /nfs/dbraw/zinc/21/18/42/135211842.db2.gz KMJVVIQMIYHQLA-QWHCGFSZSA-N 2 0 242.432 2.346 20 0 BEADRP [NH3+]C[C@H]1CCN(Cc2cc(Cl)ccc2F)C1 ZINC000164138178 135212976 /nfs/dbraw/zinc/21/29/76/135212976.db2.gz NCEXBMVIAUASGD-SECBINFHSA-N 2 0 242.725 2.260 20 0 BEADRP C[C@@H]([NH3+])[C@@H](C)[NH2+][C@H](C)Cc1ccc(F)cc1 ZINC000261572839 135214889 /nfs/dbraw/zinc/21/48/89/135214889.db2.gz IJKRPGZGKQCBNE-GMTAPVOTSA-N 2 0 224.323 2.082 20 0 BEADRP Cc1ccc(C)c(C[N@@H+]2CC[C@@H]3[NH2+]CC[C@@H]3C2)c1 ZINC000261574273 135215516 /nfs/dbraw/zinc/21/55/16/135215516.db2.gz MQROYXJMEJMJKV-ZBFHGGJFSA-N 2 0 244.382 2.487 20 0 BEADRP Cc1cccc(CN2CC[C@H]([NH3+])[C@@H]2C)c1C ZINC000261576595 135217611 /nfs/dbraw/zinc/21/76/11/135217611.db2.gz KKGGXUAVNQYDLW-JSGCOSHPSA-N 2 0 218.344 2.225 20 0 BEADRP Cc1cccc(CN2CC[C@@H]([NH3+])[C@H]2C)c1C ZINC000261576597 135217745 /nfs/dbraw/zinc/21/77/45/135217745.db2.gz KKGGXUAVNQYDLW-TZMCWYRMSA-N 2 0 218.344 2.225 20 0 BEADRP C[C@H]1C[NH2+]CC[C@@H]1[NH2+]Cc1cccc(Cl)c1 ZINC000261578209 135219200 /nfs/dbraw/zinc/21/92/00/135219200.db2.gz LOOKKXWRUKCZRG-GWCFXTLKSA-N 2 0 238.762 2.428 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+][C@H]2CC[NH2+]C[C@H]2C)[C@H]1C ZINC000261579860 135220819 /nfs/dbraw/zinc/22/08/19/135220819.db2.gz MMOFBQOOYKBZPI-PEBLQZBPSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@H](C[N@@H+]1CC[C@@H]2[NH2+]CC[C@H]2C1)c1ccccc1 ZINC000261581569 135222491 /nfs/dbraw/zinc/22/24/91/135222491.db2.gz QSNZEXOQHWFZSE-KBMXLJTQSA-N 2 0 244.382 2.474 20 0 BEADRP CC1CCC(C[NH2+][C@@H]2CC[NH2+]C[C@H]2C)CC1 ZINC000261582807 135223638 /nfs/dbraw/zinc/22/36/38/135223638.db2.gz OSIRHHWQUXRDMM-FKZOYECMSA-N 2 0 224.392 2.400 20 0 BEADRP Cc1cc(F)ccc1C[N@@H+]1C[C@@H]2CC[C@@H]([NH3+])[C@H]2C1 ZINC000261585269 135225660 /nfs/dbraw/zinc/22/56/60/135225660.db2.gz SYCOEISHVRGNQR-AEGPPILISA-N 2 0 248.345 2.303 20 0 BEADRP Cc1cc(F)ccc1C[N@@H+]1C[C@@H]2CC[C@H]([NH3+])[C@H]2C1 ZINC000261585272 135225797 /nfs/dbraw/zinc/22/57/97/135225797.db2.gz SYCOEISHVRGNQR-QEJZJMRPSA-N 2 0 248.345 2.303 20 0 BEADRP CCc1ccc(C[N@@H+]2CC[C@H]3[NH2+]CC[C@@H]3C2)cc1 ZINC000261585235 135225836 /nfs/dbraw/zinc/22/58/36/135225836.db2.gz SWJQHFZZMYXRIT-HZPDHXFCSA-N 2 0 244.382 2.433 20 0 BEADRP [NH3+][C@@H]1CC[C@@H]2C[N@H+](C/C=C/c3ccccc3)C[C@@H]12 ZINC000261589262 135229938 /nfs/dbraw/zinc/22/99/38/135229938.db2.gz WEYFXHHMOUYZGT-BKBYIFCJSA-N 2 0 242.366 2.369 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@H]3C[NH2+]C[C@@H]3C2)cc1C ZINC000261590725 135231083 /nfs/dbraw/zinc/23/10/83/135231083.db2.gz XEPPAELUYCIUJT-JKSUJKDBSA-N 2 0 244.382 2.345 20 0 BEADRP C[C@H]1CCC[C@@H](C[N@H+](C)C2CC[NH2+]CC2)C1 ZINC000261592013 135232608 /nfs/dbraw/zinc/23/26/08/135232608.db2.gz VQTSRFLOSWNUPG-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H]1C[C@@H](C)C[N@@H+]1C[C@@H]1CCC[NH2+]C1 ZINC000261546362 135238486 /nfs/dbraw/zinc/23/84/86/135238486.db2.gz KWYUBRNJUFHSOI-JHJVBQTASA-N 2 0 210.365 2.106 20 0 BEADRP CC[N@H+](CCC1CC1)C[C@]1(C)CC[NH2+]C1 ZINC000261547958 135240878 /nfs/dbraw/zinc/24/08/78/135240878.db2.gz MWZXEZFLNHGMEZ-CYBMUJFWSA-N 2 0 210.365 2.108 20 0 BEADRP [NH3+]CC1CC[NH+](Cc2ccc3c(c2)CCC3)CC1 ZINC000078793937 135242317 /nfs/dbraw/zinc/24/23/17/135242317.db2.gz XBPLRARBRGMJMC-UHFFFAOYSA-N 2 0 244.382 2.346 20 0 BEADRP COc1cc(C[N@@H+]2CC[C@@H]([C@H](C)[NH3+])C2)ccc1C ZINC000261644284 135242795 /nfs/dbraw/zinc/24/27/95/135242795.db2.gz AMBUYKXAVCXQEB-GXTWGEPZSA-N 2 0 248.370 2.173 20 0 BEADRP C[C@@H]1CC[C@@]2(CC[N@H+](C[C@]3(C)CC[NH2+]C3)C2)C1 ZINC000261742115 135248916 /nfs/dbraw/zinc/24/89/16/135248916.db2.gz IPYBQJWJXJRRKF-RBSFLKMASA-N 2 0 236.403 2.498 20 0 BEADRP Cc1ccc(CC[N@@H+]2CC[C@@](C)(C[NH3+])C2)cc1 ZINC000261754116 135249798 /nfs/dbraw/zinc/24/97/98/135249798.db2.gz LKAJZHDAFGZPQC-HNNXBMFYSA-N 2 0 232.371 2.208 20 0 BEADRP CCC[C@H]1CCC[N@H+](C[C@@]2(C)CC[NH2+]C2)C1 ZINC000261756366 135250139 /nfs/dbraw/zinc/25/01/39/135250139.db2.gz KXDZCGZFQXKGMY-KBPBESRZSA-N 2 0 224.392 2.498 20 0 BEADRP CS[C@@H]1CCCC[N@H+](C[C@]2(C)CC[NH2+]C2)C1 ZINC000261759659 135250907 /nfs/dbraw/zinc/25/09/07/135250907.db2.gz LDLMSKSTNMGGJA-CHWSQXEVSA-N 2 0 242.432 2.204 20 0 BEADRP Cc1nc2ccc(CN(C)[C@H](C)C[NH3+])cc2s1 ZINC000261803567 135254478 /nfs/dbraw/zinc/25/44/78/135254478.db2.gz HCHDWPXEZGRNJX-SECBINFHSA-N 2 0 249.383 2.384 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@H]2CCC[NH2+]C2)CC1(C)C ZINC000261813352 135255549 /nfs/dbraw/zinc/25/55/49/135255549.db2.gz HVAWEDALHFXRML-OLZOCXBDSA-N 2 0 224.392 2.354 20 0 BEADRP CC1(C)CCCC[N@H+](CC2CC[NH2+]CC2)C1 ZINC000261831579 135256127 /nfs/dbraw/zinc/25/61/27/135256127.db2.gz JCRMSSIXQWRNPO-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP Cn1cccc1[C@H]1CCC[N@@H+]1C[C@]1(C)CC[NH2+]C1 ZINC000261867953 135257903 /nfs/dbraw/zinc/25/79/03/135257903.db2.gz OGEBFWIOUGWAFJ-HUUCEWRRSA-N 2 0 247.386 2.162 20 0 BEADRP C[C@@H]1CC2(CCC2)C[N@@H+]1CC1CC[NH2+]CC1 ZINC000261864441 135258165 /nfs/dbraw/zinc/25/81/65/135258165.db2.gz UPXJDYBQYUOFQH-GFCCVEGCSA-N 2 0 222.376 2.251 20 0 BEADRP [NH3+]C1CCC([NH2+][C@H]2CCC[C@@H]3C[C@@H]32)CC1 ZINC000261879190 135259080 /nfs/dbraw/zinc/25/90/80/135259080.db2.gz UAVPUJIQVJHXJD-ZMZXKLSGSA-N 2 0 208.349 2.035 20 0 BEADRP CC(C)[C@@H]1CCC[N@H+](C[C@@]2(C)CC[NH2+]C2)C1 ZINC000261984038 135269780 /nfs/dbraw/zinc/26/97/80/135269780.db2.gz JMJBEQXJISNDLP-KGLIPLIRSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2CC[C@@H]3CCC[C@H]32)CC[NH2+]1 ZINC000262013536 135272878 /nfs/dbraw/zinc/27/28/78/135272878.db2.gz UZPGLQJZOLKUSJ-YIYPIFLZSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@@H]1CCC[C@H](C)[N@H+](C[C@@]2(C)CC[NH2+]C2)C1 ZINC000262043240 135275802 /nfs/dbraw/zinc/27/58/02/135275802.db2.gz PJMDZKLQCWQFGX-RDBSUJKOSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CCCC[C@H]1C[N@@H+]1CC[C@@]2(CC[NH2+]C2)C1 ZINC000262122206 135280181 /nfs/dbraw/zinc/28/01/81/135280181.db2.gz XJDGNGXMHKAPOG-QLFBSQMISA-N 2 0 236.403 2.498 20 0 BEADRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@H]1CCC1(C)C ZINC000342735911 135316968 /nfs/dbraw/zinc/31/69/68/135316968.db2.gz PTWMSWLWOSOTJE-STQMWFEESA-N 2 0 242.407 2.121 20 0 BEADRP [NH3+]CCN1CCC[C@@]2(CCCc3ccccc32)C1 ZINC000262990136 135325431 /nfs/dbraw/zinc/32/54/31/135325431.db2.gz NOUSLCSHYOBKIR-INIZCTEOSA-N 2 0 244.382 2.315 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCc2nc[nH]c2C1)c1ccccn1 ZINC000334405931 135393792 /nfs/dbraw/zinc/39/37/92/135393792.db2.gz HOJPAJTUFDPULV-GHMZBOCLSA-N 2 0 242.326 2.013 20 0 BEADRP C[N@H+](CC[C@H]1CC[NH2+]C1)C1CCCCC1 ZINC000084384511 135471146 /nfs/dbraw/zinc/47/11/46/135471146.db2.gz JXGKCFBQXJRURJ-GFCCVEGCSA-N 2 0 210.365 2.251 20 0 BEADRP C[NH+](C)C1CCC([NH2+][C@@H]2CCOC2(C)C)CC1 ZINC000334894770 135836878 /nfs/dbraw/zinc/83/68/78/135836878.db2.gz HBKUHRUJPRVCST-WXRRBKDZSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@H]1CCCC[N@H+](CC[C@@H]2CC[NH2+]C2)C1 ZINC000334966026 135852645 /nfs/dbraw/zinc/85/26/45/135852645.db2.gz DNPNFIITOIVFAB-STQMWFEESA-N 2 0 210.365 2.108 20 0 BEADRP C[C@@H]1CC[C@H]([NH+]2CCC(C[NH+](C)C)CC2)C1 ZINC000335318196 136025795 /nfs/dbraw/zinc/02/57/95/136025795.db2.gz KAKDUWIHZISZLE-OCCSQVGLSA-N 2 0 224.392 2.449 20 0 BEADRP C[N@@H+]1CCC[C@@H]1CC[NH+]1CCCC12CCC2 ZINC000335311878 136030177 /nfs/dbraw/zinc/03/01/77/136030177.db2.gz NYEDWNKQLHDRBK-CYBMUJFWSA-N 2 0 222.376 2.489 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@@H]2C[C@@H]2C(F)F)[C@@H]2CCC[C@H]21 ZINC000348253792 136057516 /nfs/dbraw/zinc/05/75/16/136057516.db2.gz FNDHLNSTAPQOMF-KKJSVHSVSA-N 2 0 244.329 2.102 20 0 BEADRP CC[C@H]1CC[C@@H]1[NH2+]CCOCC[NH+](CC)CC ZINC000348396022 136076188 /nfs/dbraw/zinc/07/61/88/136076188.db2.gz MGJHASJRNLULOG-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP CC1(F)CC([NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)C1 ZINC000335373836 136084708 /nfs/dbraw/zinc/08/47/08/136084708.db2.gz OHBCBYZXPSWXOA-QCXCNERSSA-N 2 0 226.339 2.093 20 0 BEADRP [NH3+]C1CCC([NH2+][C@@H]2CCC[C@H](F)C2)CC1 ZINC000335385531 136088940 /nfs/dbraw/zinc/08/89/40/136088940.db2.gz LFINREFOZPWSIH-WNYYMSAVSA-N 2 0 214.328 2.127 20 0 BEADRP C[C@@H]1CC(C)(C)CC[C@H]1[NH2+]CC1C[NH2+]C1 ZINC000335551593 136098018 /nfs/dbraw/zinc/09/80/18/136098018.db2.gz KBXDTSBTDHWMRL-ZYHUDNBSSA-N 2 0 210.365 2.010 20 0 BEADRP Cc1cccc2c1[C@@H](C)C[C@@H]2[NH2+]CC1C[NH2+]C1 ZINC000335551538 136098137 /nfs/dbraw/zinc/09/81/37/136098137.db2.gz HKYVJVUJEWOGIN-FZMZJTMJSA-N 2 0 230.355 2.352 20 0 BEADRP C[C@@H]1CCc2c(F)cccc2[C@@H]1[NH2+]CC1C[NH2+]C1 ZINC000335553063 136098960 /nfs/dbraw/zinc/09/89/60/136098960.db2.gz STZVDGFCNOPRGJ-MEBBXXQBSA-N 2 0 248.345 2.258 20 0 BEADRP CC(C)([NH3+])C[NH2+][C@H]1CCCC12CCCC2 ZINC000335596096 136105148 /nfs/dbraw/zinc/10/51/48/136105148.db2.gz CXOCXFSAARVHKS-NSHDSACASA-N 2 0 210.365 2.426 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]C1CC(c2ccccc2)C1 ZINC000335562404 136106859 /nfs/dbraw/zinc/10/68/59/136106859.db2.gz VZMNMPHSWGCCRV-CVSAEHQPSA-N 2 0 230.355 2.402 20 0 BEADRP C[C@@H]1CC(C)(C)C[C@@H]1[NH2+]C1CC[NH2+]CC1 ZINC000335568958 136108572 /nfs/dbraw/zinc/10/85/72/136108572.db2.gz PCZKTZUIPVQUGA-PWSUYJOCSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1CC(C)(C)C[C@H]1[NH2+]C1CC[NH2+]CC1 ZINC000335568960 136108598 /nfs/dbraw/zinc/10/85/98/136108598.db2.gz PCZKTZUIPVQUGA-ZYHUDNBSSA-N 2 0 210.365 2.153 20 0 BEADRP CC[NH+]1CCC(CC[NH2+]Cc2cccnc2)CC1 ZINC001647028732 1172751209 /nfs/dbraw/zinc/75/12/09/1172751209.db2.gz KTYOKQNESHOVMV-UHFFFAOYSA-N 2 0 247.386 2.293 20 0 BEADRP C[C@H]([NH2+][C@H]1C[C@H]([NH3+])C1(C)C)c1ccccc1 ZINC000404806258 397734756 /nfs/dbraw/zinc/73/47/56/397734756.db2.gz YNXQUBXJMXKOQW-DRZSPHRISA-N 2 0 218.344 2.463 20 0 BEADRP C[C@H](Cc1cccs1)[NH2+][C@@H]1CC[NH2+]C[C@H]1C ZINC000380746777 397883928 /nfs/dbraw/zinc/88/39/28/397883928.db2.gz SUURLBFAFWATPP-NQBHXWOUSA-N 2 0 238.400 2.267 20 0 BEADRP CC[C@H]1CC[C@H](C)[N@@H+]1CCn1ccnc1C ZINC000357525647 397937590 /nfs/dbraw/zinc/93/75/90/397937590.db2.gz FAEXDRCPKLIXAV-AAEUAGOBSA-N 2 0 221.348 2.454 20 0 BEADRP [NH3+][C@@H]1CCC[C@H](Nc2cc[nH+]c3ccccc23)C1 ZINC000382460030 397951241 /nfs/dbraw/zinc/95/12/41/397951241.db2.gz URADUHFKVCDZGB-NEPJUHHUSA-N 2 0 241.338 2.339 20 0 BEADRP [NH3+][C@H]1CCC[C@@H](Nc2cc[nH+]c3ccccc23)C1 ZINC000382460031 397951313 /nfs/dbraw/zinc/95/13/13/397951313.db2.gz URADUHFKVCDZGB-NWDGAFQWSA-N 2 0 241.338 2.339 20 0 BEADRP Cc1ccncc1CN(C)C[C@H]1CCC[N@H+](C)C1 ZINC000269617642 397958026 /nfs/dbraw/zinc/95/80/26/397958026.db2.gz RQIXXATYNYXPEO-AWEZNQCLSA-N 2 0 247.386 2.164 20 0 BEADRP C[C@@H]1CCC[C@@H](CC[N@H+](C)CCC[NH3+])C1 ZINC000390477605 397891156 /nfs/dbraw/zinc/89/11/56/397891156.db2.gz LJEXWSGWVJYGOE-OLZOCXBDSA-N 2 0 212.381 2.483 20 0 BEADRP C[C@@H]1CCC[C@H](CC[N@H+](C)CCC[NH3+])C1 ZINC000390477604 397891203 /nfs/dbraw/zinc/89/12/03/397891203.db2.gz LJEXWSGWVJYGOE-CHWSQXEVSA-N 2 0 212.381 2.483 20 0 BEADRP C[C@]12C[NH2+]C[C@@]1(C)CN(Cc1ccc(F)cc1)C2 ZINC000197882574 398021978 /nfs/dbraw/zinc/02/19/78/398021978.db2.gz PBCDGPKXHSSZIP-GASCZTMLSA-N 2 0 248.345 2.257 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H](C)Cc1ccccc1F ZINC000414851555 398059557 /nfs/dbraw/zinc/05/95/57/398059557.db2.gz PISVINQRJWRIIA-NWDGAFQWSA-N 2 0 238.350 2.202 20 0 BEADRP C[C@@H]([NH2+]C1CCC([NH3+])CC1)c1ccco1 ZINC000051693188 398057209 /nfs/dbraw/zinc/05/72/09/398057209.db2.gz ATRGEZAPTSAXQR-KPPDAEKUSA-N 2 0 208.305 2.200 20 0 BEADRP CCOc1ccc(C[NH2+][C@H]2CCC[C@H]([NH3+])C2)cc1 ZINC000414925335 398103787 /nfs/dbraw/zinc/10/37/87/398103787.db2.gz LOUVAYPEQJWNGH-KBPBESRZSA-N 2 0 248.370 2.445 20 0 BEADRP C[C@@H]1C[C@H](C)[N@H+](CC2CCC2)C[C@@H]1C[NH3+] ZINC000397321473 398120693 /nfs/dbraw/zinc/12/06/93/398120693.db2.gz SXUIMHBGRVDDCH-MDZLAQPJSA-N 2 0 210.365 2.092 20 0 BEADRP CC[C@@H]1C[N@H+](CC2(C)CCC2)CC[C@@H]1[NH3+] ZINC000389693477 398125199 /nfs/dbraw/zinc/12/51/99/398125199.db2.gz IFOAPNIPAXYCBQ-NEPJUHHUSA-N 2 0 210.365 2.236 20 0 BEADRP COc1ccc(C)cc1C[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000258950976 322880500 /nfs/dbraw/zinc/88/05/00/322880500.db2.gz IPFXHJDEXKLMTO-ZDUSSCGKSA-N 2 0 248.370 2.093 20 0 BEADRP C[C@H]1C[N@H+](CCC(C)(C)C2CC2)CC[C@H]1[NH3+] ZINC000382254336 487536037 /nfs/dbraw/zinc/53/60/37/487536037.db2.gz VVZDTUNYIIWSMK-WCQYABFASA-N 2 0 224.392 2.482 20 0 BEADRP CCc1ccc(C[NH2+]CC[C@H]2CCC[NH2+]2)cc1 ZINC000259104561 322881755 /nfs/dbraw/zinc/88/17/55/322881755.db2.gz UUMSTOXEFPEVOT-OAHLLOKOSA-N 2 0 232.371 2.481 20 0 BEADRP CCOc1ccc(C[NH2+]CC[C@@H]2CC[NH2+]C2)cc1 ZINC000259156190 322882191 /nfs/dbraw/zinc/88/21/91/322882191.db2.gz XTCUKHGOJBASPK-CQSZACIVSA-N 2 0 248.370 2.175 20 0 BEADRP [NH3+]CCC[N@@H+]1CCC[C@]2(CC=CCC2)C1 ZINC000334859475 487572081 /nfs/dbraw/zinc/57/20/81/487572081.db2.gz ZBOWYESBRNDSMN-CYBMUJFWSA-N 2 0 208.349 2.158 20 0 BEADRP CC(C)OCC[NH2+][C@@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000160050224 167244493 /nfs/dbraw/zinc/24/44/93/167244493.db2.gz VALGQLMYHBEMHX-UONOGXRCSA-N 2 0 242.407 2.312 20 0 BEADRP CC1=C[C@H](C)C[C@H](C[NH+]2C[C@H]3C[NH2+]C[C@@H]3C2)C1 ZINC000685839073 487585358 /nfs/dbraw/zinc/58/53/58/487585358.db2.gz YWFMQHHTNUNLGK-SPWCGHHHSA-N 2 0 234.387 2.130 20 0 BEADRP CC1=C[C@H](C)C[C@@H](C[N@H+]2C[C@H]3C[NH2+]C[C@H]3C2)C1 ZINC000685839072 487585576 /nfs/dbraw/zinc/58/55/76/487585576.db2.gz YWFMQHHTNUNLGK-PMOUVXMZSA-N 2 0 234.387 2.130 20 0 BEADRP C([C@@H]1C[C@H]2C[C@H]2C1)[N@@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]2)C1 ZINC000662265604 409563816 /nfs/dbraw/zinc/56/38/16/409563816.db2.gz SDGNNQZPKNRPBN-LJIZCISZSA-N 2 0 248.414 2.497 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CCC[N@H+](C[C@@H]2C[C@H]3C[C@H]3C2)C1 ZINC000662244084 409534825 /nfs/dbraw/zinc/53/48/25/409534825.db2.gz GLQCSASNHIOFRR-QNSTZXKLSA-N 2 0 222.376 2.092 20 0 BEADRP CO[C@@H](C[N@H+](C)CC(C)(C)C[NH3+])C1CCCC1 ZINC000662247904 409545433 /nfs/dbraw/zinc/54/54/33/409545433.db2.gz ODKGBZMWEAJDTE-ZDUSSCGKSA-N 2 0 242.407 2.108 20 0 BEADRP FCC[C@H]1CCC[N@H+](CC[C@@H]2CC[NH2+]C2)C1 ZINC000662310141 409633335 /nfs/dbraw/zinc/63/33/35/409633335.db2.gz HNWZVAKUMNKLJA-QWHCGFSZSA-N 2 0 228.355 2.058 20 0 BEADRP CC[C@@H]1C[N@H+](CCC=C(C)C)CC[C@H]1[NH3+] ZINC000662269672 409572909 /nfs/dbraw/zinc/57/29/09/409572909.db2.gz CVFFTEVARRAWNN-CHWSQXEVSA-N 2 0 210.365 2.402 20 0 BEADRP [NH3+]CC[C@H]1CCCC[N@@H+]1C[C@@H]1C[C@H]2C[C@H]2C1 ZINC000662272621 409576648 /nfs/dbraw/zinc/57/66/48/409576648.db2.gz GXRCAYTYSXGQPE-XJFOESAGSA-N 2 0 222.376 2.236 20 0 BEADRP CC[C@H](CC(F)F)C[N@@H+]1CC[C@H]([NH3+])C[C@H]1C ZINC000662282907 409607385 /nfs/dbraw/zinc/60/73/85/409607385.db2.gz DGAUQYCKLCWKPF-MXWKQRLJSA-N 2 0 234.334 2.479 20 0 BEADRP C[C@H]1C[C@H]([NH3+])CC[N@@H+]1CCCC1CCC1 ZINC000662284755 409615164 /nfs/dbraw/zinc/61/51/64/409615164.db2.gz PGFADEHBDLHCQR-WCQYABFASA-N 2 0 210.365 2.378 20 0 BEADRP CC(C)SCC[NH2+][C@@H](C)CCCC[NH3+] ZINC000336680791 167331791 /nfs/dbraw/zinc/33/17/91/167331791.db2.gz GXBBJASVXVOPAO-NSHDSACASA-N 2 0 218.410 2.235 20 0 BEADRP CC(C)SCC[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000304325758 167331320 /nfs/dbraw/zinc/33/13/20/167331320.db2.gz SVLFBSJFILVEQY-OLZOCXBDSA-N 2 0 242.432 2.344 20 0 BEADRP C[C@@H](C[N@H+]1CC[C@H]([C@H](C)[NH3+])C1)C(C)(C)C ZINC000308778196 409904846 /nfs/dbraw/zinc/90/48/46/409904846.db2.gz BITYDJCGAZNBRK-SRVKXCTJSA-N 2 0 212.381 2.338 20 0 BEADRP CC(C)C[C@H]([NH3+])CN1CCC[C@H](OC(C)C)C1 ZINC000404502543 409884174 /nfs/dbraw/zinc/88/41/74/409884174.db2.gz FBAVXFNRRXHQJJ-KBPBESRZSA-N 2 0 242.407 2.249 20 0 BEADRP CC[C@H]1C[N@H+](CCCCCF)CC[C@H]1[NH3+] ZINC000308916723 409936186 /nfs/dbraw/zinc/93/61/86/409936186.db2.gz INEBBGKPIJBPOK-NWDGAFQWSA-N 2 0 216.344 2.185 20 0 BEADRP C[C@@H]1C[C@H]1C[NH2+]Cc1ccc(C[NH3+])cc1F ZINC000650717073 410355189 /nfs/dbraw/zinc/35/51/89/410355189.db2.gz QZSVQCSUMACINP-SKDRFNHKSA-N 2 0 222.307 2.030 20 0 BEADRP [NH3+]C1CC[NH+](Cc2cccc3c2CCC3)CC1 ZINC000650702442 410333782 /nfs/dbraw/zinc/33/37/82/410333782.db2.gz HHXIYJRCMYVFDF-UHFFFAOYSA-N 2 0 230.355 2.098 20 0 BEADRP C[NH2+]CCC[N@H+](C)Cc1cccc2c1CCC2 ZINC000650704155 410335837 /nfs/dbraw/zinc/33/58/37/410335837.db2.gz KJLGGDIYEVIZHC-UHFFFAOYSA-N 2 0 232.371 2.217 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+]Cc1cccc2c1CCC2 ZINC000650703864 410336140 /nfs/dbraw/zinc/33/61/40/410336140.db2.gz VOULDSMBYVILMX-MLGOLLRUSA-N 2 0 244.382 2.263 20 0 BEADRP [NH3+]CC1(CC[NH2+]Cc2ccc(F)cc2)CC1 ZINC000650712264 410341667 /nfs/dbraw/zinc/34/16/67/410341667.db2.gz YBFVMVVLJCRMDT-UHFFFAOYSA-N 2 0 222.307 2.044 20 0 BEADRP [NH3+]CC1(CC[NH2+]Cc2ccc(F)cc2F)CC1 ZINC000650711974 410342660 /nfs/dbraw/zinc/34/26/60/410342660.db2.gz LFNIJAJTIZROFF-UHFFFAOYSA-N 2 0 240.297 2.183 20 0 BEADRP CCOc1ccc(C[NH2+]CCC2(C[NH3+])CC2)cc1 ZINC000650711754 410343033 /nfs/dbraw/zinc/34/30/33/410343033.db2.gz CCCTUNITBUTTET-UHFFFAOYSA-N 2 0 248.370 2.304 20 0 BEADRP CC1(C)CCC[C@H]1[NH2+]CCC1(C[NH3+])CC1 ZINC000650713675 410344208 /nfs/dbraw/zinc/34/42/08/410344208.db2.gz ZOLKGHXUUZYYIA-LLVKDONJSA-N 2 0 210.365 2.284 20 0 BEADRP C[C@@H](Cc1ccsc1)[NH2+]CCC1(C[NH3+])CC1 ZINC000650713538 410344742 /nfs/dbraw/zinc/34/47/42/410344742.db2.gz VZGPFNGFPBNSRG-NSHDSACASA-N 2 0 238.400 2.398 20 0 BEADRP Cc1ccc(CCC[NH2+]CCC2(C[NH3+])CC2)cn1 ZINC000650714194 410346439 /nfs/dbraw/zinc/34/64/39/410346439.db2.gz VOJKDQLFNWCEMQ-UHFFFAOYSA-N 2 0 247.386 2.041 20 0 BEADRP C[NH2+]Cc1ccccc1C[NH2+][C@H]1CCCOCC1 ZINC000650719184 410355841 /nfs/dbraw/zinc/35/58/41/410355841.db2.gz GXMYOLZNQDUSLL-HNNXBMFYSA-N 2 0 248.370 2.065 20 0 BEADRP CC[C@H]([NH2+]CCC1CC[NH2+]CC1)C1CC1 ZINC000650763550 410414945 /nfs/dbraw/zinc/41/49/45/410414945.db2.gz DFRZWMLNQMLOJO-ZDUSSCGKSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]([NH2+]CCC1(C[NH3+])CC1)c1ccccc1 ZINC000650743486 410377128 /nfs/dbraw/zinc/37/71/28/410377128.db2.gz UNWULMLRBDXOPZ-GFCCVEGCSA-N 2 0 218.344 2.466 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+]CCC2(C[NH3+])CC2)o1 ZINC000650743656 410377844 /nfs/dbraw/zinc/37/78/44/410377844.db2.gz YKMFKDNZPCJAHH-LLVKDONJSA-N 2 0 222.332 2.368 20 0 BEADRP CC(C)[C@H]([NH2+]CCC1(C[NH3+])CC1)c1cccnc1 ZINC000650745822 410383378 /nfs/dbraw/zinc/38/33/78/410383378.db2.gz OLDJKZFXCUHCAO-AWEZNQCLSA-N 2 0 247.386 2.497 20 0 BEADRP C[C@@H]([NH2+]CCC1(C[NH3+])CC1)C1CCSCC1 ZINC000650746590 410384271 /nfs/dbraw/zinc/38/42/71/410384271.db2.gz FYSFCBZLBXUWGW-LLVKDONJSA-N 2 0 242.432 2.237 20 0 BEADRP C[C@@H]([NH2+]CCC1(C[NH3+])CC1)c1ccc(F)cn1 ZINC000650745906 410385617 /nfs/dbraw/zinc/38/56/17/410385617.db2.gz QQAURNKXEHHVLX-SNVBAGLBSA-N 2 0 237.322 2.000 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@H]1CNc2ccccc2C1 ZINC000650748573 410390112 /nfs/dbraw/zinc/39/01/12/410390112.db2.gz XHEMYRCLIJZJEV-GXTWGEPZSA-N 2 0 247.386 2.130 20 0 BEADRP CC[C@@H]([NH2+]CCC1(C[NH3+])CC1)c1ccncc1 ZINC000650748361 410390360 /nfs/dbraw/zinc/39/03/60/410390360.db2.gz SFPZIWRLVKVJGC-CYBMUJFWSA-N 2 0 233.359 2.251 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@H]1CNc2ccccc2C1 ZINC000650748576 410390451 /nfs/dbraw/zinc/39/04/51/410390451.db2.gz XHEMYRCLIJZJEV-TZMCWYRMSA-N 2 0 247.386 2.130 20 0 BEADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H]1CCO[C@H](C)C1 ZINC000650757302 410404977 /nfs/dbraw/zinc/40/49/77/410404977.db2.gz UFWSULNAISQWTR-IUODEOHRSA-N 2 0 248.370 2.063 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)C(C)(C)C ZINC000650760431 410407194 /nfs/dbraw/zinc/40/71/94/410407194.db2.gz CVGDWUYQCLWXQT-YVECIDJPSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@H]([NH2+]CCC1CC[NH2+]CC1)[C@H]1C[C@H]1C ZINC000650761908 410408999 /nfs/dbraw/zinc/40/89/99/410408999.db2.gz NJHHUOASYVZJSH-MDZLAQPJSA-N 2 0 210.365 2.010 20 0 BEADRP Cc1ccncc1[C@@H](C)[NH2+]CCC1CC[NH2+]CC1 ZINC000650762565 410409047 /nfs/dbraw/zinc/40/90/47/410409047.db2.gz DVBBKZQGSIWFLS-CYBMUJFWSA-N 2 0 247.386 2.430 20 0 BEADRP C[C@@H]([NH2+]CCC1CC[NH2+]CC1)[C@@H]1C[C@H]1C ZINC000650761909 410410188 /nfs/dbraw/zinc/41/01/88/410410188.db2.gz NJHHUOASYVZJSH-NQBHXWOUSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]([NH2+]CCC1CC[NH2+]CC1)c1ccoc1 ZINC000650763507 410414070 /nfs/dbraw/zinc/41/40/70/410414070.db2.gz CEIIGDBVISTJOJ-LLVKDONJSA-N 2 0 222.332 2.320 20 0 BEADRP CC(C)C[C@H](C)[NH2+]CCC1CC[NH2+]CC1 ZINC000650763610 410414627 /nfs/dbraw/zinc/41/46/27/410414627.db2.gz FKJKTORYWSKTCJ-LBPRGKRZSA-N 2 0 212.381 2.400 20 0 BEADRP CN(C[C@@H]1CCC[N@@H+]1C)c1[nH+]ccc2[nH]ccc21 ZINC000664029574 410437887 /nfs/dbraw/zinc/43/78/87/410437887.db2.gz RAXVZCQUTBHRDF-NSHDSACASA-N 2 0 244.342 2.093 20 0 BEADRP CC[C@H]([NH2+]C[C@]1(C)CC1(F)F)[C@@H]1CCC[NH2+]1 ZINC000665267545 410739345 /nfs/dbraw/zinc/73/93/45/410739345.db2.gz YKXPKORFLUJJFA-DCAQKATOSA-N 2 0 232.318 2.152 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]CCCc2ccco2)C1 ZINC000665283611 410765324 /nfs/dbraw/zinc/76/53/24/410765324.db2.gz QTASPWLDAXWSLE-NEPJUHHUSA-N 2 0 222.332 2.072 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]CCCc2ccco2)C1 ZINC000665283614 410766986 /nfs/dbraw/zinc/76/69/86/410766986.db2.gz QTASPWLDAXWSLE-VXGBXAGGSA-N 2 0 222.332 2.072 20 0 BEADRP COc1cccc(C[NH2+][C@@H]2CCC[C@@H]2C[NH3+])c1C ZINC000665294854 410787571 /nfs/dbraw/zinc/78/75/71/410787571.db2.gz XPGCKEHSDMXZON-TZMCWYRMSA-N 2 0 248.370 2.221 20 0 BEADRP C[NH2+]C[C@H](C)[NH2+][C@@H]1CCC[C@H](c2cccnc2)C1 ZINC000665297727 410816500 /nfs/dbraw/zinc/81/65/00/410816500.db2.gz KJFZKWOTYPAQDX-KCQAQPDRSA-N 2 0 247.386 2.305 20 0 BEADRP C[NH2+]C[C@@H](C)[NH2+][C@@H](C1CC1)C1CCCC1 ZINC000665298575 410832789 /nfs/dbraw/zinc/83/27/89/410832789.db2.gz YKPCYKYMMOPCOY-ZWNOBZJWSA-N 2 0 210.365 2.153 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H](C)[C@@H]1CCCOC1 ZINC000338299362 169775197 /nfs/dbraw/zinc/77/51/97/169775197.db2.gz ZGSLUHUTRDRJIO-ZIAGYGMSSA-N 2 0 242.407 2.123 20 0 BEADRP CC[C@@H]1CC[C@H](C)C[C@H]1[NH2+][C@@H](C)C[NH2+]C ZINC000665297633 410819740 /nfs/dbraw/zinc/81/97/40/410819740.db2.gz JBDIVHPLYZLPHC-WUHRBBMRSA-N 2 0 212.381 2.399 20 0 BEADRP CC(C)C[NH2+]CC1(C[NH+](C)C)CCCC1 ZINC000051214396 167002291 /nfs/dbraw/zinc/00/22/91/167002291.db2.gz UVXDHWMAIZQGSF-UHFFFAOYSA-N 2 0 212.381 2.354 20 0 BEADRP CC(C)C[NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000052380105 167003945 /nfs/dbraw/zinc/00/39/45/167003945.db2.gz JSSLNGAUHRZVNL-ZIAGYGMSSA-N 2 0 242.407 2.121 20 0 BEADRP CC(C)[NH2+]C1CC[NH+](CCC2CC2)CC1 ZINC000336698685 167095044 /nfs/dbraw/zinc/09/50/44/167095044.db2.gz SQTAODJLZOHTPX-UHFFFAOYSA-N 2 0 210.365 2.249 20 0 BEADRP CC(C)[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000053664704 167099770 /nfs/dbraw/zinc/09/97/70/167099770.db2.gz OHWPGGNQPVWHRS-UHFFFAOYSA-N 2 0 233.359 2.296 20 0 BEADRP CC(C)OCCCC[NH2+][C@@H]1CC[N@H+](C)C[C@@H]1C ZINC000341277153 167207566 /nfs/dbraw/zinc/20/75/66/167207566.db2.gz KFIIORXNPSJKSN-UONOGXRCSA-N 2 0 242.407 2.121 20 0 BEADRP CC(C)Oc1ccc(C[N@@H+]2CC[C@@H](C[NH3+])C2)cc1 ZINC000050245497 167294341 /nfs/dbraw/zinc/29/43/41/167294341.db2.gz GYOZIXQGBIVTMI-AWEZNQCLSA-N 2 0 248.370 2.254 20 0 BEADRP CC(C)SCC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000309223827 167329839 /nfs/dbraw/zinc/32/98/39/167329839.db2.gz RITBMDUBBOKDBF-YHWZYXNKSA-N 2 0 242.432 2.343 20 0 BEADRP CC(C)SCC[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000336685113 167331538 /nfs/dbraw/zinc/33/15/38/167331538.db2.gz KNZAKNAAAHXDGF-VXGBXAGGSA-N 2 0 230.421 2.200 20 0 BEADRP CC(C)SCC[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000336685107 167334014 /nfs/dbraw/zinc/33/40/14/167334014.db2.gz KNZAKNAAAHXDGF-NEPJUHHUSA-N 2 0 230.421 2.200 20 0 BEADRP CC(C)[C@@H](C)[NH2+]CCN1CCC[C@@H](C)C1 ZINC000226770318 167380406 /nfs/dbraw/zinc/38/04/06/167380406.db2.gz OIYBBWVDDUZKPI-CHWSQXEVSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@H]2C[C@H]2C1)C1CC[NH+](C)CC1 ZINC000397720216 410931930 /nfs/dbraw/zinc/93/19/30/410931930.db2.gz AUJRSKQBFNZEJJ-DEQVHRJGSA-N 2 0 222.376 2.105 20 0 BEADRP COC[C@@H](CC(C)(C)C)[NH2+][C@@H]1CCCN(C)C1 ZINC000651684978 411136006 /nfs/dbraw/zinc/13/60/06/411136006.db2.gz DYWQHMXBYGJZDR-CHWSQXEVSA-N 2 0 242.407 2.121 20 0 BEADRP COC[C@@H](CC(C)(C)C)[NH2+][C@@H](C)CC[NH+](C)C ZINC000651693980 411136774 /nfs/dbraw/zinc/13/67/74/411136774.db2.gz LCBVNZNYILANDF-QWHCGFSZSA-N 2 0 244.423 2.367 20 0 BEADRP CC(C)C[N@H+](C)CCC[NH2+][C@H]1CSC[C@@H]1C ZINC000651865232 411148156 /nfs/dbraw/zinc/14/81/56/411148156.db2.gz RDKCXAAOHKVTSR-STQMWFEESA-N 2 0 244.448 2.305 20 0 BEADRP [NH3+]CCC[N@@H+]1CCC[C@H]1CC1CCCC1 ZINC000655948836 411161122 /nfs/dbraw/zinc/16/11/22/411161122.db2.gz FRDLYCVHWGLLMY-ZDUSSCGKSA-N 2 0 210.365 2.380 20 0 BEADRP CC(C)C1(C[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)CC1 ZINC000401005633 411169677 /nfs/dbraw/zinc/16/96/77/411169677.db2.gz PBVVYSFZWJKIJC-MELADBBJSA-N 2 0 236.403 2.400 20 0 BEADRP Cc1ccccc1C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000401027317 411173103 /nfs/dbraw/zinc/17/31/03/411173103.db2.gz VEBDDQUJXRXUQP-OWCLPIDISA-N 2 0 244.382 2.473 20 0 BEADRP CCC(CC)[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000401038278 411173668 /nfs/dbraw/zinc/17/36/68/411173668.db2.gz IJUDTTMKSHPQNH-NQBHXWOUSA-N 2 0 210.365 2.153 20 0 BEADRP C([NH2+][C@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)C1(C2CC2)CC1 ZINC000401056590 411174329 /nfs/dbraw/zinc/17/43/29/411174329.db2.gz CNLCVXNWSSEDDS-BZPMIXESSA-N 2 0 234.387 2.154 20 0 BEADRP FC1(F)CC(C[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)C1 ZINC000401040848 411174765 /nfs/dbraw/zinc/17/47/65/411174765.db2.gz TYFXYXXGPJATSY-GRYCIOLGSA-N 2 0 244.329 2.009 20 0 BEADRP CC[C@@H](C)[NH2+]CCC[N@H+](C)CC(C)C ZINC000652221211 411175606 /nfs/dbraw/zinc/17/56/06/411175606.db2.gz SZNJJQUVCVTSHM-GFCCVEGCSA-N 2 0 200.370 2.352 20 0 BEADRP Fc1ccc(C[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)cc1 ZINC000401074686 411176782 /nfs/dbraw/zinc/17/67/82/411176782.db2.gz OJLPJDXPFBCHFK-VNHYZAJKSA-N 2 0 248.345 2.303 20 0 BEADRP Fc1ccc(C[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)cc1 ZINC000401074681 411177150 /nfs/dbraw/zinc/17/71/50/411177150.db2.gz OJLPJDXPFBCHFK-GZBFAFLISA-N 2 0 248.345 2.303 20 0 BEADRP Fc1cccc(C[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)c1 ZINC000401079160 411177175 /nfs/dbraw/zinc/17/71/75/411177175.db2.gz QGNJIKCVTASXTH-UMVBOHGHSA-N 2 0 248.345 2.303 20 0 BEADRP c1csc(C[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)c1 ZINC000401071181 411177183 /nfs/dbraw/zinc/17/71/83/411177183.db2.gz NCFASXAHJZENGW-IJLUTSLNSA-N 2 0 236.384 2.226 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCCSCC1)C[NH+](C)C ZINC000658018452 411198886 /nfs/dbraw/zinc/19/88/86/411198886.db2.gz QSYPHZIEBYZAJB-VXGBXAGGSA-N 2 0 230.421 2.059 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCCSCC1)C[NH+](C)C ZINC000658018447 411198964 /nfs/dbraw/zinc/19/89/64/411198964.db2.gz QSYPHZIEBYZAJB-NEPJUHHUSA-N 2 0 230.421 2.059 20 0 BEADRP COc1c(C)cccc1CN[C@@H](C)[C@@H]1CCC[NH2+]1 ZINC000656201410 411206179 /nfs/dbraw/zinc/20/61/79/411206179.db2.gz WYLGIZXXYWMVBW-JSGCOSHPSA-N 2 0 248.370 2.234 20 0 BEADRP COc1c(C)cccc1C[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000656201086 411206770 /nfs/dbraw/zinc/20/67/70/411206770.db2.gz SDFXNLIHINUENN-UONOGXRCSA-N 2 0 248.370 2.363 20 0 BEADRP Cc1ccccc1C[NH+]1CCC(C)([NH3+])CC1 ZINC000049816970 411245988 /nfs/dbraw/zinc/24/59/88/411245988.db2.gz VYNNLGGRQUPDHW-UHFFFAOYSA-N 2 0 218.344 2.308 20 0 BEADRP COCCCCC[N@@H+]1CCC[C@H](C)[C@H]1CC[NH3+] ZINC000652355024 411214922 /nfs/dbraw/zinc/21/49/22/411214922.db2.gz MYTHCFBWJZHZNO-UONOGXRCSA-N 2 0 242.407 2.252 20 0 BEADRP Cc1c[nH+]ccc1N[C@@H]1CCC[N@@H+]2CCCC[C@H]12 ZINC000656226292 411215855 /nfs/dbraw/zinc/21/58/55/411215855.db2.gz LPYMHMQMSGUQNE-HUUCEWRRSA-N 2 0 245.370 2.241 20 0 BEADRP CCCC[N@@H+]1CCCC[C@@H]1[C@@H]1C[C@H]([NH3+])CCO1 ZINC000652360347 411218020 /nfs/dbraw/zinc/21/80/20/411218020.db2.gz FXFKFCJNKNJLMK-MCIONIFRSA-N 2 0 240.391 2.147 20 0 BEADRP [NH3+]CCCC[NH2+][C@H](c1cncc(F)c1)C1CC1 ZINC000423326856 411238641 /nfs/dbraw/zinc/23/86/41/411238641.db2.gz MMRNXTVYTXDHDH-ZDUSSCGKSA-N 2 0 237.322 2.000 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H]1CCC[C@@H](c2cccnc2)C1 ZINC000423307129 411238848 /nfs/dbraw/zinc/23/88/48/411238848.db2.gz MMZLZRVGLLBHLI-NFAWXSAZSA-N 2 0 247.386 2.292 20 0 BEADRP CCC[N@H+](CC)CCCC1CC[NH2+]CC1 ZINC000050952558 411269435 /nfs/dbraw/zinc/26/94/35/411269435.db2.gz JGXPRSVABXIUMG-UHFFFAOYSA-N 2 0 212.381 2.498 20 0 BEADRP C[C@H]1CC[C@H]([NH2+]CC2CC[NH+](C)CC2)CS1 ZINC000655716962 411273310 /nfs/dbraw/zinc/27/33/10/411273310.db2.gz QWUYCMVICAQYMI-AAEUAGOBSA-N 2 0 242.432 2.202 20 0 BEADRP c1cnc2c(c1)CCC[C@H]2[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000643509389 411279888 /nfs/dbraw/zinc/27/98/88/411279888.db2.gz KWVIBUFGROXQAQ-TZMCWYRMSA-N 2 0 245.370 2.048 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCCOC(C)(C)C)CC[N@@H+]1C ZINC000658188031 411284225 /nfs/dbraw/zinc/28/42/25/411284225.db2.gz ZDCDYYZCBAKYGS-CHWSQXEVSA-N 2 0 242.407 2.264 20 0 BEADRP CCCC[NH+](CCCC)C[C@H]1CC[NH2+]C1 ZINC000051889410 411284931 /nfs/dbraw/zinc/28/49/31/411284931.db2.gz PRQCWOZWFFMUCU-ZDUSSCGKSA-N 2 0 212.381 2.498 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(C[NH3+])cc2)C1 ZINC000129447122 411287254 /nfs/dbraw/zinc/28/72/54/411287254.db2.gz IVTUHJFMQDFVBT-BXUZGUMPSA-N 2 0 218.344 2.424 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CCC(C)(C)F)[C@@H](C)C1 ZINC000658193404 411288191 /nfs/dbraw/zinc/28/81/91/411288191.db2.gz UNMRRPBMMIOHCU-NWDGAFQWSA-N 2 0 230.371 2.445 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CCC(C)(C)F)CC[N@@H+]1C ZINC000658193780 411288270 /nfs/dbraw/zinc/28/82/70/411288270.db2.gz YONYOEUHWPJUGN-WDEREUQCSA-N 2 0 216.344 2.197 20 0 BEADRP CC(C)C1(C[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)CC1 ZINC000401005635 411333186 /nfs/dbraw/zinc/33/31/86/411333186.db2.gz PBVVYSFZWJKIJC-MGPQQGTHSA-N 2 0 236.403 2.400 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]C[C@@]2(C)CC2(F)F)[C@H](C)C1 ZINC000658220091 411299667 /nfs/dbraw/zinc/29/96/67/411299667.db2.gz OXOSJYMRQCLCQR-GRYCIOLGSA-N 2 0 246.345 2.352 20 0 BEADRP C[C@@H]1CCC[C@H](C[NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)O1 ZINC000658220354 411299822 /nfs/dbraw/zinc/29/98/22/411299822.db2.gz PTSPCOZABSFFQI-YIYPIFLZSA-N 2 0 240.391 2.016 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@@H]2CCC[C@H](C)O2)CC1 ZINC000658222930 411302396 /nfs/dbraw/zinc/30/23/96/411302396.db2.gz YSVTXOAIFXPLRQ-JSGCOSHPSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@H](c1ccccn1)[N@@H+]1C[C@@H]2CCC[C@]2(C[NH3+])C1 ZINC000310967340 411302492 /nfs/dbraw/zinc/30/24/92/411302492.db2.gz HORZNFLBPSRGMN-IPYPFGDCSA-N 2 0 245.370 2.203 20 0 BEADRP C[C@H]1CC[C@H]([NH2+]CCCC[NH+](C)C)CS1 ZINC000655703021 411253149 /nfs/dbraw/zinc/25/31/49/411253149.db2.gz IWNWOEKZWLNYHK-RYUDHWBXSA-N 2 0 230.421 2.202 20 0 BEADRP C[N@@H+]1CC[C@]2(CC[NH+](C[C@@H]3C[C@H]4C[C@H]4C3)C2)C1 ZINC000660616372 411355924 /nfs/dbraw/zinc/35/59/24/411355924.db2.gz KNASTAGBDUKUFA-XGUBFFRZSA-N 2 0 234.387 2.060 20 0 BEADRP CC(C)C[C@@H]([NH3+])C[NH2+]C[C@@H](C)c1ccccn1 ZINC000656782372 411359442 /nfs/dbraw/zinc/35/94/42/411359442.db2.gz FNWIXUNADCMYQH-CHWSQXEVSA-N 2 0 235.375 2.148 20 0 BEADRP C[C@H](C[C@H]1CCC[NH2+]1)[NH2+]C[C@@H](C)c1ccccn1 ZINC000656782020 411360379 /nfs/dbraw/zinc/36/03/79/411360379.db2.gz CQPFEEXOGQDTOR-MGPQQGTHSA-N 2 0 247.386 2.305 20 0 BEADRP C(C1CC1)[N@@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000656784731 411360953 /nfs/dbraw/zinc/36/09/53/411360953.db2.gz GNDWHVUYALPZFZ-CQSZACIVSA-N 2 0 222.376 2.108 20 0 BEADRP CC[C@H]1C[N@H+](Cc2ccc(OC)cc2)CC[C@@H]1[NH3+] ZINC000130728889 411361021 /nfs/dbraw/zinc/36/10/21/411361021.db2.gz MLFBPYQMOPIRBW-ZFWWWQNUSA-N 2 0 248.370 2.254 20 0 BEADRP FC1(C[NH+]2CCC([C@@H]3CCC[NH2+]C3)CC2)CC1 ZINC000656785866 411364391 /nfs/dbraw/zinc/36/43/91/411364391.db2.gz KHNNQJWDZMUNFR-CYBMUJFWSA-N 2 0 240.366 2.200 20 0 BEADRP Cc1ccc2c(c1)C[N@@H+](C[C@@]1(C)CC[NH2+]C1)CC2 ZINC000656787374 411365630 /nfs/dbraw/zinc/36/56/30/411365630.db2.gz JRMNPHCDQRAALW-INIZCTEOSA-N 2 0 244.382 2.353 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]([NH2+][C@H]2CC[NH2+]C2)C[C@H]1C ZINC000656787996 411367046 /nfs/dbraw/zinc/36/70/46/411367046.db2.gz DALAORDJZASFSE-MQYQWHSLSA-N 2 0 224.392 2.399 20 0 BEADRP [NH3+]C1(C[NH2+]CC2CCCCC2)CCCC1 ZINC000656788147 411367069 /nfs/dbraw/zinc/36/70/69/411367069.db2.gz DYHANBKYHNBKTP-UHFFFAOYSA-N 2 0 210.365 2.428 20 0 BEADRP C[C@H]1CC(C)(C)CC[C@H]1[NH2+][C@H]1CC[NH2+]C1 ZINC000656788230 411367122 /nfs/dbraw/zinc/36/71/22/411367122.db2.gz XTTFRFQIQSMPEX-SDDRHHMPSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H](C[N@@H+]1CC[C@@]2(CC[NH2+]C2)C1)C(C)(C)C ZINC000304503591 411368958 /nfs/dbraw/zinc/36/89/58/411368958.db2.gz IUPANPHFWVSSRW-GXTWGEPZSA-N 2 0 224.392 2.354 20 0 BEADRP [NH3+]CCC[N@@H+]1CC[C@@H](C2CCCCC2)C1 ZINC000656790634 411370629 /nfs/dbraw/zinc/37/06/29/411370629.db2.gz FQLXAUVCVXEVES-CYBMUJFWSA-N 2 0 210.365 2.237 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[C@@H]2C1)[C@H]1CCCC[NH2+]1 ZINC000403324498 411341921 /nfs/dbraw/zinc/34/19/21/411341921.db2.gz NHWMKFWSTAXABL-RYMFRWLXSA-N 2 0 222.376 2.295 20 0 BEADRP CC(C)(C)[NH2+]CCN1CCC[C@@H](CCF)C1 ZINC000656792434 411372380 /nfs/dbraw/zinc/37/23/80/411372380.db2.gz QLHLHFRHTNGFPS-LBPRGKRZSA-N 2 0 230.371 2.446 20 0 BEADRP CC1=CC[C@H]([NH2+]CC2CC[NH+](C)CC2)CC1 ZINC000335600544 168120304 /nfs/dbraw/zinc/12/03/04/168120304.db2.gz NKWWAGJZGPXWGI-AWEZNQCLSA-N 2 0 222.376 2.417 20 0 BEADRP CC1=CC[C@H]([NH2+]CC2=CC[N@H+](C)CC2)CC1 ZINC000285274557 168120774 /nfs/dbraw/zinc/12/07/74/168120774.db2.gz QZKKOIMNEFLQOR-AWEZNQCLSA-N 2 0 220.360 2.337 20 0 BEADRP CC1CC([NH2+]C2CCC([NH+](C)C)CC2)C1 ZINC000335607508 168145244 /nfs/dbraw/zinc/14/52/44/168145244.db2.gz XMJLYLKROMCMFY-UHFFFAOYSA-N 2 0 210.365 2.247 20 0 BEADRP CC1CC([NH2+]C2CC[NH+](C3CCC3)CC2)C1 ZINC000309811926 168145492 /nfs/dbraw/zinc/14/54/92/168145492.db2.gz UKHHYVHWEVLDLV-UHFFFAOYSA-N 2 0 222.376 2.391 20 0 BEADRP CC1CCC([N@H+](C)C[C@H]2CC[NH2+]C2)CC1 ZINC000051889638 168159371 /nfs/dbraw/zinc/15/93/71/168159371.db2.gz GQENONUDWHNNHU-CPCZMJQVSA-N 2 0 210.365 2.106 20 0 BEADRP CC1CC[NH+](CCC[NH2+][C@H]2CCSC2)CC1 ZINC000020146237 168178899 /nfs/dbraw/zinc/17/88/99/168178899.db2.gz MWLVSNJYNNDQRZ-ZDUSSCGKSA-N 2 0 242.432 2.204 20 0 BEADRP COC(C)(C)C[N@H+](C)CCCC1CC[NH2+]CC1 ZINC000404308172 411390321 /nfs/dbraw/zinc/39/03/21/411390321.db2.gz LMQLNKATSKVDNJ-UHFFFAOYSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@@H]1CCC[N@H+](Cc2cncs2)[C@@H]1CC[NH3+] ZINC000404277097 411387851 /nfs/dbraw/zinc/38/78/51/411387851.db2.gz BEPXJVMDIFBRJT-ZYHUDNBSSA-N 2 0 239.388 2.092 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+]Cc1ccnn1-c1cc[nH+]cc1 ZINC000657309807 411459620 /nfs/dbraw/zinc/45/96/20/411459620.db2.gz IDRKWEROVVIYHI-VXGBXAGGSA-N 2 0 242.326 2.013 20 0 BEADRP CC1(C)C[C@H]([NH2+]CCC[NH+]2CCCC2)CCO1 ZINC000070346240 411392046 /nfs/dbraw/zinc/39/20/46/411392046.db2.gz JFKFUQGOVUVUJN-CYBMUJFWSA-N 2 0 240.391 2.020 20 0 BEADRP CC(C)COCC[N@@H+]1CCC[C@H](C)[C@H]1CC[NH3+] ZINC000404406131 411394336 /nfs/dbraw/zinc/39/43/36/411394336.db2.gz UZLWCNFQDNEXNM-UONOGXRCSA-N 2 0 242.407 2.108 20 0 BEADRP Cc1ccncc1C[N@H+]1CCC[C@H](C)[C@H]1CC[NH3+] ZINC000404410474 411394859 /nfs/dbraw/zinc/39/48/59/411394859.db2.gz CESGPANJFKOMOZ-DZGCQCFKSA-N 2 0 247.386 2.339 20 0 BEADRP C[C@]1(C[NH+]2CCC3(CC3(F)F)CC2)CC[NH2+]C1 ZINC000405118118 411417846 /nfs/dbraw/zinc/41/78/46/411417846.db2.gz UCEAFJBGVAETAE-NSHDSACASA-N 2 0 244.329 2.107 20 0 BEADRP CC(C)CCC[NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1 ZINC000414825840 411449819 /nfs/dbraw/zinc/44/98/19/411449819.db2.gz UJEWTUBPAPQBDW-QWHCGFSZSA-N 2 0 212.381 2.400 20 0 BEADRP C[NH+](C)CC1CC[NH+](C[C@@H]2C[C@H]3C[C@H]3C2)CC1 ZINC000659845160 411475347 /nfs/dbraw/zinc/47/53/47/411475347.db2.gz RDEGRBPHZHIIPU-QDMKHBRRSA-N 2 0 236.403 2.306 20 0 BEADRP CC[N@H+](CCCC1CC[NH2+]CC1)CC1CC1 ZINC000068947650 411476431 /nfs/dbraw/zinc/47/64/31/411476431.db2.gz PAMPWWGJBZTQSB-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP CC(C)c1cccc(C[NH+]2C[C@@H]3C[NH2+]C[C@H]3C2)c1 ZINC000659849009 411476569 /nfs/dbraw/zinc/47/65/69/411476569.db2.gz DPSTWOWLAUNDFK-HOTGVXAUSA-N 2 0 244.382 2.461 20 0 BEADRP CC[N@H+](C[C@@H](O)C[NH+](C)C(C)C)[C@H](C)C(C)C ZINC000659858237 411480517 /nfs/dbraw/zinc/48/05/17/411480517.db2.gz WAPHEKKIELVHOZ-KGLIPLIRSA-N 2 0 244.423 2.054 20 0 BEADRP COc1cc(C[NH2+]C[C@@]2(C)CC[NH2+]C2)ccc1C ZINC000415089186 411491697 /nfs/dbraw/zinc/49/16/97/411491697.db2.gz YLHCPJPTANMAIO-HNNXBMFYSA-N 2 0 248.370 2.093 20 0 BEADRP Cc1ncccc1NCc1cnc2n1CCC2 ZINC000657412545 411498392 /nfs/dbraw/zinc/49/83/92/411498392.db2.gz GQHNZLBBKXHOHS-UHFFFAOYSA-N 2 0 228.299 2.145 20 0 BEADRP C[NH+](C)C[C@@H]1CC[N@H+](C[C@@H]2CC[C@H]3C[C@H]3C2)C1 ZINC000659929028 411502424 /nfs/dbraw/zinc/50/24/24/411502424.db2.gz WIUBLJJAGMIQEW-CBBWQLFWSA-N 2 0 236.403 2.306 20 0 BEADRP CC[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)C1CCC1 ZINC000655802734 411518775 /nfs/dbraw/zinc/51/87/75/411518775.db2.gz ILKVQLZNLGQPDJ-KWCYVHTRSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H]1CCC[C@@H]1[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655805443 411519224 /nfs/dbraw/zinc/51/92/24/411519224.db2.gz HIQANMUBMMPGSW-RVMXOQNASA-N 2 0 210.365 2.105 20 0 BEADRP Cc1cncc([C@@H](C)[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)c1 ZINC000655804940 411519278 /nfs/dbraw/zinc/51/92/78/411519278.db2.gz GRTZVJCXCIFQEE-NFAWXSAZSA-N 2 0 247.386 2.381 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H]2CCCC2(C)C)C1 ZINC000655805107 411519385 /nfs/dbraw/zinc/51/93/85/411519385.db2.gz BXSMNWXNIVHQPV-XQQFMLRXSA-N 2 0 224.392 2.495 20 0 BEADRP CC[C@H]1CC[C@H]1[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655804111 411519432 /nfs/dbraw/zinc/51/94/32/411519432.db2.gz PTIKRTWWBGKMFP-WUHRBBMRSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)C1CCC1 ZINC000655805462 411519738 /nfs/dbraw/zinc/51/97/38/411519738.db2.gz HSFWQGWAAWYSJB-WZRBSPASSA-N 2 0 210.365 2.105 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H]2CCC[C@H]3C[C@]32C)C1 ZINC000655804269 411519833 /nfs/dbraw/zinc/51/98/33/411519833.db2.gz RKBYZLZQKFRBSQ-VQJWOFKYSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)C1CCCC1 ZINC000655805971 411520297 /nfs/dbraw/zinc/52/02/97/411520297.db2.gz OJILRRTVLSJNCV-SGMGOOAPSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H]1CC[C@H]([NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)C1 ZINC000655805876 411520335 /nfs/dbraw/zinc/52/03/35/411520335.db2.gz MRQDEJNWCYPTPE-ZDEQEGDKSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1ccoc1 ZINC000655806253 411520416 /nfs/dbraw/zinc/52/04/16/411520416.db2.gz SQQCIMQWNYWPNT-WZRBSPASSA-N 2 0 222.332 2.270 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1ccccn1 ZINC000655805730 411520436 /nfs/dbraw/zinc/52/04/36/411520436.db2.gz RRQOZLFBPBZPLJ-RWMBFGLXSA-N 2 0 233.359 2.072 20 0 BEADRP CCC[C@H](CC)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655805977 411520734 /nfs/dbraw/zinc/52/07/34/411520734.db2.gz VQVOUUTWRXWSIX-RWMBFGLXSA-N 2 0 212.381 2.495 20 0 BEADRP FCCCC[NH2+]Cc1ccnn1-c1cc[nH+]cc1 ZINC000657470463 411521680 /nfs/dbraw/zinc/52/16/80/411521680.db2.gz PWAAJMJGCHAUFX-UHFFFAOYSA-N 2 0 248.305 2.107 20 0 BEADRP C[C@H](Cc1ccccn1)[NH2+][C@@H]1CCN(C)[C@H](C)C1 ZINC000655836748 411531909 /nfs/dbraw/zinc/53/19/09/411531909.db2.gz NXLOXLSDMFTHBI-UMVBOHGHSA-N 2 0 247.386 2.085 20 0 BEADRP CC1(C)C[C@H]1[NH2+]Cc1ccnn1-c1cc[nH+]cc1 ZINC000657326490 411465887 /nfs/dbraw/zinc/46/58/87/411465887.db2.gz NKFAHDNLGNBJHW-CYBMUJFWSA-N 2 0 242.326 2.155 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+]CCC(C)(C)C)C1 ZINC000037731404 170008558 /nfs/dbraw/zinc/00/85/58/170008558.db2.gz IPLYMIOKLANOGR-LBPRGKRZSA-N 2 0 212.381 2.354 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCCCOC)C[C@@H]1C ZINC000336718077 170008913 /nfs/dbraw/zinc/00/89/13/170008913.db2.gz ZPSYWRFCHCFCJP-UONOGXRCSA-N 2 0 242.407 2.218 20 0 BEADRP CC[N@@H+]1CC[C@@H](CN[C@H](C)c2nccs2)C1 ZINC000246669018 170009530 /nfs/dbraw/zinc/00/95/30/170009530.db2.gz APLJEGWVJFUQMX-MNOVXSKESA-N 2 0 239.388 2.136 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CCC(F)(F)F)[C@H](C)C1 ZINC000122755962 170012705 /nfs/dbraw/zinc/01/27/05/170012705.db2.gz YUTKJCWMDZNYID-NXEZZACHSA-N 2 0 238.297 2.259 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CC2(C)CC2)[C@H](C)C1 ZINC000309054341 170012721 /nfs/dbraw/zinc/01/27/21/170012721.db2.gz SSWVVRAKGVDXIG-VXGBXAGGSA-N 2 0 210.365 2.106 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(C)s2)C1 ZINC000037484276 170015955 /nfs/dbraw/zinc/01/59/55/170015955.db2.gz KOGRKLCIVMRCDU-GFCCVEGCSA-N 2 0 238.400 2.488 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH+](C)CCOC(C)C)C[C@@H]1C ZINC000336689341 170019524 /nfs/dbraw/zinc/01/95/24/170019524.db2.gz HMLXROQIFOBNGX-KBPBESRZSA-N 2 0 242.407 2.216 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CCC(F)(F)F)[C@H](C)C1 ZINC000122755735 170020289 /nfs/dbraw/zinc/02/02/89/170020289.db2.gz YUTKJCWMDZNYID-ZJUUUORDSA-N 2 0 238.297 2.259 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CCC2(C)CC2)[C@H](C)C1 ZINC000309465820 170020438 /nfs/dbraw/zinc/02/04/38/170020438.db2.gz PGMQVWHAKVLQAX-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H]2CC[C@H](C)C2)[C@@H](C)C1 ZINC000309620835 170022994 /nfs/dbraw/zinc/02/29/94/170022994.db2.gz FFNHLSVBHCUBBS-FQUUOJAGSA-N 2 0 224.392 2.495 20 0 BEADRP Cc1cnccc1C[NH2+]C[C@@H]1CCN1C(C)(C)C ZINC000657526143 411542859 /nfs/dbraw/zinc/54/28/59/411542859.db2.gz AWLBGSGDTGCUHO-AWEZNQCLSA-N 2 0 247.386 2.352 20 0 BEADRP CC[C@H]1C[C@@H]([NH2+]CCC[N@H+](C)CC(C)C)CO1 ZINC000657501638 411538056 /nfs/dbraw/zinc/53/80/56/411538056.db2.gz YQWCUPIWVUDQML-KGLIPLIRSA-N 2 0 242.407 2.121 20 0 BEADRP CC[NH2+][C@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000034822368 170159753 /nfs/dbraw/zinc/15/97/53/170159753.db2.gz DEWAQFBNZSECFB-GFCCVEGCSA-N 2 0 236.359 2.298 20 0 BEADRP CCOCCC[N@H+](C)[C@H]1CC[NH+](CC)[C@@H](C)C1 ZINC000336707748 170370245 /nfs/dbraw/zinc/37/02/45/170370245.db2.gz HYBIOIAXSRUMFK-KBPBESRZSA-N 2 0 242.407 2.218 20 0 BEADRP CC(C)(F)CC[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000657645275 411568780 /nfs/dbraw/zinc/56/87/80/411568780.db2.gz QEINEHCLXSVVHO-RYUDHWBXSA-N 2 0 228.355 2.341 20 0 BEADRP Cc1cc(NC[C@H](C(C)C)[NH+]2CCCC2)cc[nH+]1 ZINC000663377434 411642069 /nfs/dbraw/zinc/64/20/69/411642069.db2.gz ACRLREAOLRRBQJ-OAHLLOKOSA-N 2 0 247.386 2.344 20 0 BEADRP CCOC[C@H]1CCC[C@@H]1[NH2+]CCCC[NH+](C)C ZINC000354211424 170456193 /nfs/dbraw/zinc/45/61/93/170456193.db2.gz MWEBYNWGJBECRM-KGLIPLIRSA-N 2 0 242.407 2.123 20 0 BEADRP C[NH+](C)CCC[NH2+][C@@H]1[C@@H]2CCC[C@@H]2C1(C)C ZINC000657818336 411606227 /nfs/dbraw/zinc/60/62/27/411606227.db2.gz SNDCAIUXFFAPNR-FRRDWIJNSA-N 2 0 224.392 2.352 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+]C2CC(CF)(CF)C2)C1 ZINC000657841047 411610083 /nfs/dbraw/zinc/61/00/83/411610083.db2.gz MKMJRRIXNLRDCR-NSHDSACASA-N 2 0 246.345 2.006 20 0 BEADRP c1cc2c(cc[nH+]c2N[C@H]2CC[N@@H+](C3CC3)C2)[nH]1 ZINC000663424983 411655159 /nfs/dbraw/zinc/65/51/59/411655159.db2.gz MZNMKMKRVYMFJN-JTQLQIEISA-N 2 0 242.326 2.212 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[NH2+]CC12CC(C1)C[NH2+]2 ZINC000663497539 411678749 /nfs/dbraw/zinc/67/87/49/411678749.db2.gz HAZCJZYIPLTFGA-NELGMTEASA-N 2 0 222.376 2.154 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CC23CC(C2)C[NH2+]3)[C@@H](C)C1 ZINC000663497821 411679347 /nfs/dbraw/zinc/67/93/47/411679347.db2.gz KGKHFYFPOJTHQD-NFMDPKQHSA-N 2 0 222.376 2.153 20 0 BEADRP CC(C)(C[NH2+]CC12CC(C1)C[NH2+]2)c1ccccc1 ZINC000663499513 411682829 /nfs/dbraw/zinc/68/28/29/411682829.db2.gz XQWONRQAAUDRSL-UHFFFAOYSA-N 2 0 244.382 2.306 20 0 BEADRP CC1(C)CCC([NH2+]CC23CC(C2)C[NH2+]3)CC1 ZINC000663499552 411683064 /nfs/dbraw/zinc/68/30/64/411683064.db2.gz YGNCLKGGWSOZBT-UHFFFAOYSA-N 2 0 222.376 2.297 20 0 BEADRP CC[C@@H]1CCC[C@@H](C[NH2+][C@@H](C)C[NH2+]C)C1 ZINC000663509432 411689309 /nfs/dbraw/zinc/68/93/09/411689309.db2.gz KJZZZCXZHMZLNL-YNEHKIRRSA-N 2 0 212.381 2.400 20 0 BEADRP CCC(C)(C)[C@H](C)[NH2+]C[C@H](O)C[N@H+](C)C(C)C ZINC000661231554 411737683 /nfs/dbraw/zinc/73/76/83/411737683.db2.gz NXAZCLHHNYMOSO-STQMWFEESA-N 2 0 244.423 2.102 20 0 BEADRP CCOc1ccccc1[C@@H](C)[NH2+]CCCC[NH3+] ZINC000037714972 170597205 /nfs/dbraw/zinc/59/72/05/170597205.db2.gz SZJAYYSBVOJETJ-GFCCVEGCSA-N 2 0 236.359 2.475 20 0 BEADRP C[NH+](C)C1(CNc2[nH+]ccc3[nH]ccc32)CCC1 ZINC000663833426 411755950 /nfs/dbraw/zinc/75/59/50/411755950.db2.gz IFHOYJGZJMVPJP-UHFFFAOYSA-N 2 0 244.342 2.459 20 0 BEADRP CCSCC[NH+]1CCC([C@@H]2CC[NH2+]C2)CC1 ZINC000357092490 170632583 /nfs/dbraw/zinc/63/25/83/170632583.db2.gz XEOGIPUUXQPVNW-CYBMUJFWSA-N 2 0 242.432 2.061 20 0 BEADRP Cc1c[nH+]ccc1NC[C@H]1CC[N@@H+]1C(C)(C)C ZINC000664142380 411870246 /nfs/dbraw/zinc/87/02/46/411870246.db2.gz JHBRCGLKHSDDDQ-GFCCVEGCSA-N 2 0 233.359 2.097 20 0 BEADRP CCCN(C)CC(C)(C)[NH2+]CCCCF ZINC000662176571 412018558 /nfs/dbraw/zinc/01/85/58/412018558.db2.gz CLQORSKBHNNRCL-UHFFFAOYSA-N 2 0 218.360 2.446 20 0 BEADRP CO[C@H](C[N@@H+]1CCCC[C@@H]1[C@H](C)[NH3+])C1CCC1 ZINC000662236384 412035310 /nfs/dbraw/zinc/03/53/10/412035310.db2.gz XCHSBDKAPOXROO-IACUBPJLSA-N 2 0 240.391 2.003 20 0 BEADRP CO[C@@H](CN1CCC[C@H]([NH3+])C1)C1CCCCC1 ZINC000662235335 412035641 /nfs/dbraw/zinc/03/56/41/412035641.db2.gz QOFLJDLDHOEXEU-KBPBESRZSA-N 2 0 240.391 2.005 20 0 BEADRP CC[C@@H](CC(F)F)C[NH+]1CCC([NH3+])CC1 ZINC000662239711 412037011 /nfs/dbraw/zinc/03/70/11/412037011.db2.gz FWHPMCYKDIBCSE-VIFPVBQESA-N 2 0 220.307 2.091 20 0 BEADRP CC[C@@H](CC(F)F)C[NH+]1CCC([NH2+]C)CC1 ZINC000662243306 412039537 /nfs/dbraw/zinc/03/95/37/412039537.db2.gz HZRTWAISQGRHKN-JTQLQIEISA-N 2 0 234.334 2.352 20 0 BEADRP C([NH2+]C1CC[NH+](C[C@@H]2C[C@H]3C[C@H]3C2)CC1)C1CC1 ZINC000662244010 412039949 /nfs/dbraw/zinc/03/99/49/412039949.db2.gz FQYYNHZRMNYBAN-QDMKHBRRSA-N 2 0 248.414 2.497 20 0 BEADRP CC(C)=CCC[N@H+]1CCC[C@@H]([C@H](C)[NH3+])C1 ZINC000662245761 412043489 /nfs/dbraw/zinc/04/34/89/412043489.db2.gz OKZXUSFQLABCMR-QWHCGFSZSA-N 2 0 210.365 2.402 20 0 BEADRP CC[C@@H](CC(F)F)CN1CCC[C@@H]([NH2+]C)C1 ZINC000662247200 412045118 /nfs/dbraw/zinc/04/51/18/412045118.db2.gz VHUUSLAFMWWLCV-WDEREUQCSA-N 2 0 234.334 2.352 20 0 BEADRP CO[C@@H](C[NH2+][C@](C)(C[NH3+])C(C)C)C1CCCC1 ZINC000662248710 412047267 /nfs/dbraw/zinc/04/72/67/412047267.db2.gz BLKOLIGCVNBZDZ-UONOGXRCSA-N 2 0 242.407 2.155 20 0 BEADRP CC[C@@H]1CC[N@H+](CC[C@H]2CCC[NH2+]C2)C1 ZINC000251555179 171011984 /nfs/dbraw/zinc/01/19/84/171011984.db2.gz BHADWANLCZZVIL-CHWSQXEVSA-N 2 0 210.365 2.108 20 0 BEADRP CC[C@@H]1CC[N@H+](CC[C@@H]2CCC[NH2+]C2)C1 ZINC000108324261 171012947 /nfs/dbraw/zinc/01/29/47/171012947.db2.gz BHADWANLCZZVIL-OLZOCXBDSA-N 2 0 210.365 2.108 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+]CC1CC[NH+](C)CC1 ZINC000336766194 171057421 /nfs/dbraw/zinc/05/74/21/171057421.db2.gz RKOSTJQRYWNFKZ-CHWSQXEVSA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)=CCC[N@@H+]1CC[C@@H]2[NH2+]CC[C@H]2C1 ZINC000662274743 412068222 /nfs/dbraw/zinc/06/82/22/412068222.db2.gz WPSLGAKCNXRNBY-STQMWFEESA-N 2 0 208.349 2.027 20 0 BEADRP c1ccc([C@@H]2CCC[N@@H+](C[C@H]3CC[NH2+]C3)C2)cc1 ZINC000662282506 412071970 /nfs/dbraw/zinc/07/19/70/412071970.db2.gz AZFZFKFYHOWDPE-GOEBONIOSA-N 2 0 244.382 2.476 20 0 BEADRP CC[C@H](CC(F)F)C[N@@H+]1CC[C@@H]([NH3+])C[C@H]1C ZINC000662282905 412071985 /nfs/dbraw/zinc/07/19/85/412071985.db2.gz DGAUQYCKLCWKPF-GMTAPVOTSA-N 2 0 234.334 2.479 20 0 BEADRP c1ccc([C@@H]2CCC[N@@H+](C[C@@H]3CC[NH2+]C3)C2)cc1 ZINC000662282505 412073118 /nfs/dbraw/zinc/07/31/18/412073118.db2.gz AZFZFKFYHOWDPE-GDBMZVCRSA-N 2 0 244.382 2.476 20 0 BEADRP CC(C)=CCC[NH+]1CCC2(CC[NH2+]2)CC1 ZINC000662284154 412075937 /nfs/dbraw/zinc/07/59/37/412075937.db2.gz UCKFNQUZKCNIQH-UHFFFAOYSA-N 2 0 208.349 2.171 20 0 BEADRP CC[C@H](C)C[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000020189449 171283601 /nfs/dbraw/zinc/28/36/01/171283601.db2.gz SRBVELMIHKSAQS-LBPRGKRZSA-N 2 0 212.381 2.495 20 0 BEADRP CC[C@H](C)C[NH2+]CCC[NH+]1CCCCC1 ZINC000020128882 171284463 /nfs/dbraw/zinc/28/44/63/171284463.db2.gz NHJOYRPXENCDQY-ZDUSSCGKSA-N 2 0 212.381 2.498 20 0 BEADRP CC[C@H](C)C[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000297387638 171286074 /nfs/dbraw/zinc/28/60/74/171286074.db2.gz BCRSGORRDUKTMK-NSHDSACASA-N 2 0 217.316 2.470 20 0 BEADRP CC[C@H](C)[NH2+]CCC1CC[NH+](CC)CC1 ZINC000121762668 171340118 /nfs/dbraw/zinc/34/01/18/171340118.db2.gz CUKSDWSDFZJHKD-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP CC[N@@H+](Cc1ccc(C)cc1)C[C@H]1CC[NH2+]C1 ZINC000662304067 412088730 /nfs/dbraw/zinc/08/87/30/412088730.db2.gz FAPGJGHAOHAYOF-HNNXBMFYSA-N 2 0 232.371 2.426 20 0 BEADRP CC(C)C[C@H](C)C[N@@H+]1CC2CC1(C[NH3+])C2 ZINC000662306334 412090185 /nfs/dbraw/zinc/09/01/85/412090185.db2.gz QOOCJWUIEMKLCJ-HIFPTAJRSA-N 2 0 210.365 2.092 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[N@@H+]1CC2CC1(C[NH3+])C2 ZINC000662306309 412090768 /nfs/dbraw/zinc/09/07/68/412090768.db2.gz QEZUUWLVEZLVRM-NELGMTEASA-N 2 0 222.376 2.236 20 0 BEADRP COCCCC[N@@H+]1CCC[C@@H](C)[C@H]1CCC[NH3+] ZINC000662312505 412093775 /nfs/dbraw/zinc/09/37/75/412093775.db2.gz GYTRWDWOSXKPAE-ZIAGYGMSSA-N 2 0 242.407 2.252 20 0 BEADRP CCC(CC)CCC[N@H+](C)CCC[NH3+] ZINC000662315755 412096468 /nfs/dbraw/zinc/09/64/68/412096468.db2.gz HFKJKSRQXKRDKR-UHFFFAOYSA-N 2 0 200.370 2.483 20 0 BEADRP CCC(CC)CCC[N@H+](C)C[C@](C)(O)C[NH2+]C ZINC000662317737 412098061 /nfs/dbraw/zinc/09/80/61/412098061.db2.gz RMJGTMBTRRWDQN-CQSZACIVSA-N 2 0 244.423 2.105 20 0 BEADRP CC[C@H](COCC1CC1)[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000665236512 412176112 /nfs/dbraw/zinc/17/61/12/412176112.db2.gz OIVGIZYCBDEIEF-MCIONIFRSA-N 2 0 240.391 2.051 20 0 BEADRP CC[C@H]([NH2+]CC1([NH3+])CCCC1)C1CCC1 ZINC000665246991 412191204 /nfs/dbraw/zinc/19/12/04/412191204.db2.gz SKBHWUHOUCXVBA-LBPRGKRZSA-N 2 0 210.365 2.426 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]CC1=CCCC1 ZINC000665274039 412215015 /nfs/dbraw/zinc/21/50/15/412215015.db2.gz IMEQJYQTHFWTDO-OLZOCXBDSA-N 2 0 208.349 2.346 20 0 BEADRP CC[C@H]1CCC[C@@H]1[NH2+]CC1([NH3+])CCCC1 ZINC000665249279 412195543 /nfs/dbraw/zinc/19/55/43/412195543.db2.gz MKUZLENVDJAEBS-RYUDHWBXSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@H]1CCC[C@@H](C)O1 ZINC000665265532 412201893 /nfs/dbraw/zinc/20/18/93/412201893.db2.gz XOZVKRQTLGKZFC-JHJVBQTASA-N 2 0 228.380 2.051 20 0 BEADRP COCc1csc(C[NH2+][C@H](C)C[C@H](C)[NH3+])c1 ZINC000665263456 412205146 /nfs/dbraw/zinc/20/51/46/412205146.db2.gz MLCXYXHZRCZNBV-VHSXEESVSA-N 2 0 242.388 2.110 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[C@H]2C[C@H]21)[C@H]1CCC[NH2+]1 ZINC000665263048 412205345 /nfs/dbraw/zinc/20/53/45/412205345.db2.gz FDRATALTNLTQEE-QSLWVIQJSA-N 2 0 222.376 2.153 20 0 BEADRP COCc1csc(C[NH2+][C@@H](C)C[C@H](C)[NH3+])c1 ZINC000665263455 412206354 /nfs/dbraw/zinc/20/63/54/412206354.db2.gz MLCXYXHZRCZNBV-UWVGGRQHSA-N 2 0 242.388 2.110 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@H]1CCC[C@H](C)O1 ZINC000665265531 412209589 /nfs/dbraw/zinc/20/95/89/412209589.db2.gz XOZVKRQTLGKZFC-FRRDWIJNSA-N 2 0 228.380 2.051 20 0 BEADRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]CCCC1CCC1 ZINC000665267234 412210012 /nfs/dbraw/zinc/21/00/12/412210012.db2.gz SIAGYZREEKTJTK-OLZOCXBDSA-N 2 0 210.365 2.284 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@@]1(C)CC1(F)F ZINC000665266978 412210021 /nfs/dbraw/zinc/21/00/21/412210021.db2.gz NENHYUCKILBLIZ-NXEZZACHSA-N 2 0 220.307 2.139 20 0 BEADRP C[C@]1(CC[NH2+][C@@H]2CCC[C@H]([NH3+])C2)CC1(F)F ZINC000665266855 412210289 /nfs/dbraw/zinc/21/02/89/412210289.db2.gz KXFMJNLRLAOIBK-AXFHLTTASA-N 2 0 232.318 2.281 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCCCC[C@H]1[NH3+])c1ccccn1 ZINC000665231994 412168069 /nfs/dbraw/zinc/16/80/69/412168069.db2.gz CUYRDYAHPXDTEG-UMVBOHGHSA-N 2 0 247.386 2.435 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CCc1noc2ccccc12 ZINC000665231882 412170393 /nfs/dbraw/zinc/17/03/93/412170393.db2.gz ABCAZDPKJYFCDC-WDEREUQCSA-N 2 0 247.342 2.086 20 0 BEADRP CCC(C)(C)[C@H](C)[NH2+][C@H](CCC[NH3+])COC ZINC000665235859 412173734 /nfs/dbraw/zinc/17/37/34/412173734.db2.gz BELHRKFYSDBIMF-NWDGAFQWSA-N 2 0 230.396 2.155 20 0 BEADRP CCC(C)(C)[C@H](C)[NH2+][C@@H](CCC[NH3+])COC ZINC000665235860 412174378 /nfs/dbraw/zinc/17/43/78/412174378.db2.gz BELHRKFYSDBIMF-RYUDHWBXSA-N 2 0 230.396 2.155 20 0 BEADRP [NH3+][C@H]1CCCCC[C@H]1[NH2+]CC1=CCCC1 ZINC000665274040 412216173 /nfs/dbraw/zinc/21/61/73/412216173.db2.gz IMEQJYQTHFWTDO-QWHCGFSZSA-N 2 0 208.349 2.346 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+]CC[C@@H]([NH3+])C(C)C ZINC000665279330 412222370 /nfs/dbraw/zinc/22/23/70/412222370.db2.gz ANAABICCSJWKKR-SDDRHHMPSA-N 2 0 200.370 2.384 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+][C@@H]1CCC12CCC2 ZINC000665282054 412226095 /nfs/dbraw/zinc/22/60/95/412226095.db2.gz PSFYQRVCXLJUQT-VXGBXAGGSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+][C@H](C)Cc1ccoc1 ZINC000665282414 412227424 /nfs/dbraw/zinc/22/74/24/412227424.db2.gz XTRAQBIJJFEDJS-DGCLKSJQSA-N 2 0 224.348 2.174 20 0 BEADRP C[C@@H]([NH2+]C[C@@H](C)C1CCCCC1)C1C[NH2+]C1 ZINC000665283643 412229291 /nfs/dbraw/zinc/22/92/91/412229291.db2.gz RMVCEAHFWJBPHW-VXGBXAGGSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H](C[NH2+][C@@H](C)C1C[NH2+]C1)C1CCCCC1 ZINC000665283642 412229315 /nfs/dbraw/zinc/22/93/15/412229315.db2.gz RMVCEAHFWJBPHW-RYUDHWBXSA-N 2 0 224.392 2.400 20 0 BEADRP CCC[C@H](C)[C@H](CC)[NH2+][C@@H](C)C[NH2+]C ZINC000665296422 412242516 /nfs/dbraw/zinc/24/25/16/412242516.db2.gz SIENRVHIYJYHGP-SRVKXCTJSA-N 2 0 200.370 2.399 20 0 BEADRP C[NH2+]C[C@@H](C)[NH2+][C@H]1CCCC12CCCC2 ZINC000665297303 412244190 /nfs/dbraw/zinc/24/41/90/412244190.db2.gz CXDBMLQYHYSNBZ-NEPJUHHUSA-N 2 0 210.365 2.297 20 0 BEADRP CC(C)(C[NH2+][C@@H]1CCC[C@@H]1[NH3+])CC(F)(F)F ZINC000665301231 412250075 /nfs/dbraw/zinc/25/00/75/412250075.db2.gz RWZAMJFDKQUWEC-DTWKUNHWSA-N 2 0 238.297 2.434 20 0 BEADRP CCc1ccc(C[N@@H+]2CC[C@@H](C[NH3+])C2)cc1 ZINC000050245254 171800963 /nfs/dbraw/zinc/80/09/63/171800963.db2.gz CJOZKHJYPOJMTI-AWEZNQCLSA-N 2 0 218.344 2.030 20 0 BEADRP C[NH+]1CCC(CC[NH2+]C2CC(C)(C)C2)CC1 ZINC000336775762 172983442 /nfs/dbraw/zinc/98/34/42/172983442.db2.gz ZXQRHNXDIMEJJY-UHFFFAOYSA-N 2 0 224.392 2.497 20 0 BEADRP C[N@@H+]1CCC[C@@H]1CC[NH+]1CCC2(CC2)CC1 ZINC000363459912 173028042 /nfs/dbraw/zinc/02/80/42/173028042.db2.gz TYFLMHYZGPZBRW-CYBMUJFWSA-N 2 0 222.376 2.347 20 0 BEADRP C[N@@H+]1CCC[C@@H]2C[NH+](CC3CCC3)CC[C@@H]21 ZINC000336585046 173037377 /nfs/dbraw/zinc/03/73/77/173037377.db2.gz BIGZDHSREYJGTI-KGLIPLIRSA-N 2 0 222.376 2.203 20 0 BEADRP C[N@@H+]1CCC[C@H]1CC[NH+]1CCC2(CC2)CC1 ZINC000363459913 173051936 /nfs/dbraw/zinc/05/19/36/173051936.db2.gz TYFLMHYZGPZBRW-ZDUSSCGKSA-N 2 0 222.376 2.347 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CCCCF)[C@H]2CCC[C@@H]21 ZINC000336763901 173152159 /nfs/dbraw/zinc/15/21/59/173152159.db2.gz MQQDKERDGRPLFF-AGIUHOORSA-N 2 0 228.355 2.199 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CC2(C)C)[C@H]2CCC[C@H]21 ZINC000336726550 173153858 /nfs/dbraw/zinc/15/38/58/173153858.db2.gz CCSCJFYWAXFXHA-YVECIDJPSA-N 2 0 222.376 2.247 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]Cc2ccoc2)[C@H]2CCC[C@H]21 ZINC000367527912 173154538 /nfs/dbraw/zinc/15/45/38/173154538.db2.gz UHCYEEHGFMMIJS-HZSPNIEDSA-N 2 0 234.343 2.242 20 0 BEADRP C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CCC(C)C ZINC000054627348 173324518 /nfs/dbraw/zinc/32/45/18/173324518.db2.gz TUNBHHCYUMZQTJ-YHWZYXNKSA-N 2 0 210.365 2.247 20 0 BEADRP C[NH2+]CC1CC[NH+](Cc2cccc(OC)c2)CC1 ZINC000011889188 173338746 /nfs/dbraw/zinc/33/87/46/173338746.db2.gz LMQGFUFOQCFWIL-UHFFFAOYSA-N 2 0 248.370 2.127 20 0 BEADRP C[NH2+]CCC1CC[NH+](CCCCCOC)CC1 ZINC000354271079 173343181 /nfs/dbraw/zinc/34/31/81/173343181.db2.gz IZJNSFDYBJCDER-UHFFFAOYSA-N 2 0 242.407 2.125 20 0 BEADRP C[NH2+]CCC[N@H+](C)Cc1ccc(C)cc1 ZINC000042409428 173346222 /nfs/dbraw/zinc/34/62/22/173346222.db2.gz LGKYUIMNERCVHR-UHFFFAOYSA-N 2 0 206.333 2.036 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCC[C@H]1CC(C)(C)C ZINC000309660814 173346872 /nfs/dbraw/zinc/34/68/72/173346872.db2.gz XTBCZAPSJQLURP-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCC[C@@H]1CC(C)(C)C ZINC000309660813 173347093 /nfs/dbraw/zinc/34/70/93/173347093.db2.gz XTBCZAPSJQLURP-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP C[NH2+]CCC[NH2+]Cc1cc(C)cc(C)c1 ZINC000083344898 173349113 /nfs/dbraw/zinc/34/91/13/173349113.db2.gz KFFWCCBWCKWKEV-UHFFFAOYSA-N 2 0 206.333 2.003 20 0 BEADRP C[NH2+]CCCN[C@@H](C)c1sc(C)nc1C ZINC000043606513 173349563 /nfs/dbraw/zinc/34/95/63/173349563.db2.gz NXQBWMVQXSJEEE-QMMMGPOBSA-N 2 0 227.377 2.020 20 0 BEADRP C[NH2+]C[C@@H]1CCC[N@H+](Cc2ccccc2C)C1 ZINC000011888674 173368236 /nfs/dbraw/zinc/36/82/36/173368236.db2.gz CFKBBMDKVJFXRF-AWEZNQCLSA-N 2 0 232.371 2.426 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](C[C@H]2CCC[C@@H](C)C2)C1 ZINC000251672432 173370517 /nfs/dbraw/zinc/37/05/17/173370517.db2.gz GNDJYIUWQFTCNE-RDBSUJKOSA-N 2 0 224.392 2.354 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](Cc2c(C)cccc2C)C1 ZINC000130889203 173370798 /nfs/dbraw/zinc/37/07/98/173370798.db2.gz IXLWMDCLZLETNO-AWEZNQCLSA-N 2 0 232.371 2.345 20 0 BEADRP C[NH2+]C[C@H]1CCCN1CCCC(C)(C)C ZINC000300935880 173380126 /nfs/dbraw/zinc/38/01/26/173380126.db2.gz VNLGLEIKGAGLDV-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP C[NH2+]C[C@H]1CC[N@H+](CCC2CCCC2)C1 ZINC000053031455 173380549 /nfs/dbraw/zinc/38/05/49/173380549.db2.gz IQULHYFLHXGSDS-CYBMUJFWSA-N 2 0 210.365 2.108 20 0 BEADRP C[NH2+]C[C@H]1CC[N@H+](Cc2ccc(C)cc2)C1 ZINC000011891913 173382079 /nfs/dbraw/zinc/38/20/79/173382079.db2.gz MUPCTGVRWFSYKH-CQSZACIVSA-N 2 0 218.344 2.036 20 0 BEADRP COCCC[C@H](C)[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000356782033 174263334 /nfs/dbraw/zinc/26/33/34/174263334.db2.gz KFKGPIODQPCNTM-ZDUSSCGKSA-N 2 0 242.407 2.123 20 0 BEADRP COCCC[C@H](C)[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000363546411 174264791 /nfs/dbraw/zinc/26/47/91/174264791.db2.gz RKZOAPLDPKJKKU-MELADBBJSA-N 2 0 240.391 2.018 20 0 BEADRP COCC[C@@H](C)[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000370132974 174382469 /nfs/dbraw/zinc/38/24/69/174382469.db2.gz PUUMVWOQUFQBOS-IYXRBSQSSA-N 2 0 240.391 2.018 20 0 BEADRP COCC[C@@H]1CCC[C@@H]1[NH2+][C@@H](C)CC[NH+](C)C ZINC000337410442 174396261 /nfs/dbraw/zinc/39/62/61/174396261.db2.gz VSTIAZZMUOGERX-IHRRRGAJSA-N 2 0 242.407 2.121 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+][C@@H]1CCC[C@@H](C)[C@H]1C ZINC000300025269 174562310 /nfs/dbraw/zinc/56/23/10/174562310.db2.gz RASCYZZXWDVDSY-YIYPIFLZSA-N 2 0 242.407 2.155 20 0 BEADRP COc1ccc(C[N@H+](C)C[C@H]2CCC[NH2+]C2)cc1 ZINC000042442234 175095545 /nfs/dbraw/zinc/09/55/45/175095545.db2.gz HVNVOJKQYURHJA-AWEZNQCLSA-N 2 0 248.370 2.127 20 0 BEADRP COc1ccc(C[N@@H+]2CCCC[C@H]2CC[NH3+])cc1 ZINC000104314174 175098921 /nfs/dbraw/zinc/09/89/21/175098921.db2.gz DJAUMOVNOBFYDK-AWEZNQCLSA-N 2 0 248.370 2.399 20 0 BEADRP COc1cccc(C[N@H+](C)[C@@H]2CCC[NH2+]CC2)c1 ZINC000113712678 175255862 /nfs/dbraw/zinc/25/58/62/175255862.db2.gz GWBGTVVFRTUEIP-CQSZACIVSA-N 2 0 248.370 2.269 20 0 BEADRP COc1cccc(C[N@@H+]2CC[C@@H]([NH3+])C[C@@H]2C)c1 ZINC000049713132 175260833 /nfs/dbraw/zinc/26/08/33/175260833.db2.gz PPNDBIXHMNCWLQ-WCQYABFASA-N 2 0 234.343 2.007 20 0 BEADRP COc1cccc(C[NH2+]CC2=CC[N@H+](C)CC2)c1 ZINC000271854490 175262933 /nfs/dbraw/zinc/26/29/33/175262933.db2.gz UKWSJTRJHHJTGG-UHFFFAOYSA-N 2 0 246.354 2.047 20 0 BEADRP COc1cccc([C@@H](C)[NH2+]C2CC[NH2+]CC2)c1 ZINC000038041495 175286451 /nfs/dbraw/zinc/28/64/51/175286451.db2.gz HFHBEEMVCNODLN-LLVKDONJSA-N 2 0 234.343 2.098 20 0 BEADRP COc1cccc([C@@H](C)[N@@H+]2CC[C@@H](C[NH3+])C2)c1 ZINC000224194727 175286934 /nfs/dbraw/zinc/28/69/34/175286934.db2.gz VCXTXKXNJZLDCD-NEPJUHHUSA-N 2 0 234.343 2.037 20 0 BEADRP COc1cccc([C@@H](C)[NH2+][C@@H]2CCC[NH2+]CC2)c1 ZINC000129131915 175288040 /nfs/dbraw/zinc/28/80/40/175288040.db2.gz JFZOBWXVDUVZDY-TZMCWYRMSA-N 2 0 248.370 2.488 20 0 BEADRP COc1ccccc1C[N@@H+]1CCC[C@H](CC[NH3+])C1 ZINC000070074261 175327111 /nfs/dbraw/zinc/32/71/11/175327111.db2.gz YDHZFMPUQMHEPK-CYBMUJFWSA-N 2 0 248.370 2.256 20 0 BEADRP COc1ccccc1C[N@@H+]1CCC[C@@H]([C@@H](C)[NH3+])C1 ZINC000113655516 175327645 /nfs/dbraw/zinc/32/76/45/175327645.db2.gz KWZVMWUXGYEKGM-CHWSQXEVSA-N 2 0 248.370 2.254 20 0 BEADRP COc1ccccc1C[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000093209369 175331248 /nfs/dbraw/zinc/33/12/48/175331248.db2.gz FBMQDGFQGCOZEV-STQMWFEESA-N 2 0 234.343 2.055 20 0 BEADRP COc1ccccc1[C@@H](C)[NH2+][C@@H](C)CCC[NH3+] ZINC000310347513 175346126 /nfs/dbraw/zinc/34/61/26/175346126.db2.gz GICWDQSXUGDCNP-NWDGAFQWSA-N 2 0 236.359 2.473 20 0 BEADRP COc1ccncc1Cn1ccnc1C(C)C ZINC000286513375 175372880 /nfs/dbraw/zinc/37/28/80/175372880.db2.gz MTSIJLJVPGPASI-UHFFFAOYSA-N 2 0 231.299 2.458 20 0 BEADRP C[C@@H]([NH2+]CC1CC[NH+](C)CC1)C1CCCC1 ZINC000054081306 175870037 /nfs/dbraw/zinc/87/00/37/175870037.db2.gz MXSOFSIJINBKEJ-GFCCVEGCSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H](c1cccc(O)c1)[N@H+](C)C[C@@H]1CCC[NH2+]C1 ZINC000226437841 176019303 /nfs/dbraw/zinc/01/93/03/176019303.db2.gz GSNRSUJSCLGWQC-QWHCGFSZSA-N 2 0 248.370 2.385 20 0 BEADRP C[C@@H](c1ccccc1)[N@@H+]1CC[C@H]([NH3+])[C@H](C)C1 ZINC000049708457 176021548 /nfs/dbraw/zinc/02/15/48/176021548.db2.gz DEXULUOWZSCBAU-DYEKYZERSA-N 2 0 218.344 2.417 20 0 BEADRP C[C@@H](c1cccnc1)[N@@H+]1CCC[C@H](CC[NH3+])C1 ZINC000070169736 176030716 /nfs/dbraw/zinc/03/07/16/176030716.db2.gz GDEORWNAMOOVFX-QWHCGFSZSA-N 2 0 233.359 2.203 20 0 BEADRP C[C@@H]1CCCC[N@@H+]1CCC[NH2+]C1CCOCC1 ZINC000036303941 176071943 /nfs/dbraw/zinc/07/19/43/176071943.db2.gz ZASZWSQBCTXXJW-CYBMUJFWSA-N 2 0 240.391 2.020 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[N@@H+]1CCCNCC1 ZINC000044417862 176075000 /nfs/dbraw/zinc/07/50/00/176075000.db2.gz HYITYJGCPKRCMF-CHWSQXEVSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[N@@H+]1C[C@H]2CCC[NH2+][C@@H]2C1 ZINC000346158793 176076460 /nfs/dbraw/zinc/07/64/60/176076460.db2.gz AJRHWVIPXWLCCF-KBUPBQIOSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[N@H+](C)CC1CC[NH2+]CC1 ZINC000042610995 176079080 /nfs/dbraw/zinc/07/90/80/176079080.db2.gz JBVPRWCQBUWEBS-OCCSQVGLSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CCC[C@H]1C[NH3+] ZINC000251566345 176081282 /nfs/dbraw/zinc/08/12/82/176081282.db2.gz AMVCXRFNOSPKSL-MROQNXINSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1CCCC[C@H]1OCCN1CCC[C@@H]([NH3+])C1 ZINC000346101488 176089142 /nfs/dbraw/zinc/08/91/42/176089142.db2.gz UEJVAOVQEDJOHQ-MGPQQGTHSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@@H]1CCCC[C@]1(C)[NH2+]Cc1cnc[nH]1 ZINC000308692380 176090337 /nfs/dbraw/zinc/09/03/37/176090337.db2.gz AVTJRXXNPYPMOL-PWSUYJOCSA-N 2 0 207.321 2.468 20 0 BEADRP C[C@@H]1C[C@@H](C[N@@H+]2CCC[C@@H](C)CC2)CC[NH2+]1 ZINC000235312926 176100267 /nfs/dbraw/zinc/10/02/67/176100267.db2.gz IASXGRNIGYYJPC-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CN(C)C[C@@H]1[NH2+]C1[C@H](C)CCC[C@H]1C ZINC000336777609 176114191 /nfs/dbraw/zinc/11/41/91/176114191.db2.gz IZBDOKUIKQCSQA-LPWJVIDDSA-N 2 0 224.392 2.351 20 0 BEADRP C[C@@H]1CCC[C@@H](C[N@@H+]2CCC[C@@H](C[NH3+])C2)C1 ZINC000227572203 176117569 /nfs/dbraw/zinc/11/75/69/176117569.db2.gz KPKMVIXWUOYEPM-MCIONIFRSA-N 2 0 224.392 2.483 20 0 BEADRP C[C@@H]1CCC[C@@H](C[NH2+]C2CC[NH2+]CC2)C1 ZINC000235295669 176118479 /nfs/dbraw/zinc/11/84/79/176118479.db2.gz AZNKFFCOWTVZBM-VXGBXAGGSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1CCC[C@@H]1C[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000300244541 176128539 /nfs/dbraw/zinc/12/85/39/176128539.db2.gz YBPNIFVWULNFES-AAVRWANBSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+]CC[C@H]1CCC[N@@H+]1C ZINC000309154115 176131052 /nfs/dbraw/zinc/13/10/52/176131052.db2.gz WZBDZGKDNVMHTC-UPJWGTAASA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H]1CCC[C@H](C[NH2+]C[C@@H]2CCC[NH2+]2)C1 ZINC000235297323 176138425 /nfs/dbraw/zinc/13/84/25/176138425.db2.gz AJHJJCDWPYBIEO-AGIUHOORSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1CCC[C@H](C[NH2+]C[C@@H]2CCC[NH2+]C2)C1 ZINC000235297373 176138739 /nfs/dbraw/zinc/13/87/39/176138739.db2.gz PVNWYCUYEUDGIX-HZSPNIEDSA-N 2 0 224.392 2.402 20 0 BEADRP C[C@@H]1CN(C)C[C@@H]1[NH2+][C@H]1CCC[C@@H](C)C1 ZINC000309162803 176145445 /nfs/dbraw/zinc/14/54/45/176145445.db2.gz ZUECKLPEXPVAIG-NDBYEHHHSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@@H]1CC[N@H+](Cc2cccc(F)c2)C[C@@H]1C[NH3+] ZINC000163472692 176175922 /nfs/dbraw/zinc/17/59/22/176175922.db2.gz WCKKLOUOPSZFKP-YPMHNXCESA-N 2 0 236.334 2.242 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CC2([NH3+])CCCCC2)C1 ZINC000129454859 176211853 /nfs/dbraw/zinc/21/18/53/176211853.db2.gz MCGCXODUHPXTSL-VXGBXAGGSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CC2=CC[N@H+](C)CC2)C1 ZINC000309105911 176212109 /nfs/dbraw/zinc/21/21/09/176212109.db2.gz HWKXDEILZBQEHM-DGCLKSJQSA-N 2 0 208.349 2.027 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+][C@@H]1CC[N@H+](C)[C@@H]2CCC[C@H]21 ZINC000309829088 176218238 /nfs/dbraw/zinc/21/82/38/176218238.db2.gz YBQKDAGYLWXZHS-MBJXGIAVSA-N 2 0 222.376 2.247 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@@H]2CCC[C@H]([NH3+])C2)C1 ZINC000129350650 176233940 /nfs/dbraw/zinc/23/39/40/176233940.db2.gz AOVLIHADRRDYJF-NDBYEHHHSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]CC1CCCCC1 ZINC000131996955 176269931 /nfs/dbraw/zinc/26/99/31/176269931.db2.gz GPLNZMMVGDJOCD-OCCSQVGLSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]C[C@H]1CC1(C)C ZINC000300359327 176278352 /nfs/dbraw/zinc/27/83/52/176278352.db2.gz OHJGLPWHFQIFKO-LPWJVIDDSA-N 2 0 224.392 2.351 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]CC1CCC1 ZINC000036908572 176278531 /nfs/dbraw/zinc/27/85/31/176278531.db2.gz JKIVNZGGCZWCHQ-NQBHXWOUSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@@H]1C[C@@H](C[N@H+](C)CC2CCC2)CC[NH2+]1 ZINC000235378938 176367292 /nfs/dbraw/zinc/36/72/92/176367292.db2.gz XXOBGIURTPNGSY-YPMHNXCESA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1C[C@@H](C[NH+](CC2CC2)CC2CC2)CC[NH2+]1 ZINC000235410935 176367988 /nfs/dbraw/zinc/36/79/88/176367988.db2.gz MOOKYWPFFGTPOI-DOMZBBRYSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]1C[C@@H](C[N@@H+]2CCC3(CCC3)C2)CC[NH2+]1 ZINC000335664643 176368599 /nfs/dbraw/zinc/36/85/99/176368599.db2.gz VXCSALFNQBQIIH-OLZOCXBDSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@@H]1C[C@@H](C[NH+]2CCC(C)(C)CC2)CC[NH2+]1 ZINC000235380688 176369327 /nfs/dbraw/zinc/36/93/27/176369327.db2.gz TUFVVJRPBBRDJW-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[C@@H]([NH3+])CC[N@@H+]1CCCc1ccccc1 ZINC000049713023 176371839 /nfs/dbraw/zinc/37/18/39/176371839.db2.gz MTTCZJGUWUHMSE-HIFRSBDPSA-N 2 0 232.371 2.431 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C[C@H]2CCC(F)(F)C2)CC[N@@H+]1C ZINC000302212382 176376038 /nfs/dbraw/zinc/37/60/38/176376038.db2.gz PYMQNPWHXDBPDP-WOPDTQHZSA-N 2 0 246.345 2.494 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCC(F)(F)C2)CC[N@@H+]1C ZINC000302212379 176376670 /nfs/dbraw/zinc/37/66/70/176376670.db2.gz PYMQNPWHXDBPDP-UTUOFQBUSA-N 2 0 246.345 2.494 20 0 BEADRP C[C@H](c1ccc(F)cc1)[N@@H+]1CC[C@H](C[NH3+])C1 ZINC000049509038 177034790 /nfs/dbraw/zinc/03/47/90/177034790.db2.gz FGFOVDQKNMJXSB-GHMZBOCLSA-N 2 0 222.307 2.167 20 0 BEADRP C[C@H]1CCCC[C@@H]1[NH2+]CC1CC[NH+](C)CC1 ZINC000044515347 177082789 /nfs/dbraw/zinc/08/27/89/177082789.db2.gz YDMOFCIBMUJTAE-JSGCOSHPSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1CC[N@H+](CCCCCF)C[C@H]1C[NH3+] ZINC000336695468 177161252 /nfs/dbraw/zinc/16/12/52/177161252.db2.gz NWIANVCSFZTACX-NWDGAFQWSA-N 2 0 216.344 2.043 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+]CC1CCCC1 ZINC000335197167 177174761 /nfs/dbraw/zinc/17/47/61/177174761.db2.gz RBMNJCASVNWZHE-AAEUAGOBSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+]CC2([NH3+])CCCCC2)C1 ZINC000129455072 177193632 /nfs/dbraw/zinc/19/36/32/177193632.db2.gz MCGCXODUHPXTSL-NWDGAFQWSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@H]1CC[C@]2(CC[N@H+](CC3CC[NH2+]CC3)C2)C1 ZINC000336054447 177208498 /nfs/dbraw/zinc/20/84/98/177208498.db2.gz AURFSMYCRYCJHB-ZFWWWQNUSA-N 2 0 236.403 2.498 20 0 BEADRP C[C@H]1CSC[C@@H]1[NH2+]CCC1CC[NH+](C)CC1 ZINC000304405954 177305687 /nfs/dbraw/zinc/30/56/87/177305687.db2.gz HXLAWPBNISKLAR-AAEUAGOBSA-N 2 0 242.432 2.059 20 0 BEADRP C[C@H]1C[C@@H](C[N@@H+]2CCC3(CCC3)C2)CC[NH2+]1 ZINC000335664645 177324517 /nfs/dbraw/zinc/32/45/17/177324517.db2.gz VXCSALFNQBQIIH-STQMWFEESA-N 2 0 222.376 2.251 20 0 BEADRP C[C@H]1C[C@@H]([NH3+])CC[N@@H+]1CCCc1ccccc1 ZINC000049713024 177326472 /nfs/dbraw/zinc/32/64/72/177326472.db2.gz MTTCZJGUWUHMSE-ZFWWWQNUSA-N 2 0 232.371 2.431 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CCC[NH3+])c2ccccc21 ZINC000336719745 177330521 /nfs/dbraw/zinc/33/05/21/177330521.db2.gz ZCMVZNSAVOSVEX-GXFFZTMASA-N 2 0 204.317 2.173 20 0 BEADRP C[C@H](CN1CCCCC1)[NH2+][C@@H]1C[C@H](C)[C@H]1C ZINC000309415419 177333432 /nfs/dbraw/zinc/33/34/32/177333432.db2.gz XHGOQNHXRXFECN-REWJHTLYSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H]1C[C@@H]1C[NH2+]CCCCC[NH+]1CCCC1 ZINC000354235437 177344944 /nfs/dbraw/zinc/34/49/44/177344944.db2.gz GDKPETCAGNPGFQ-UONOGXRCSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@H]1C[C@@H]1C[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC000309506951 177345102 /nfs/dbraw/zinc/34/51/02/177345102.db2.gz WCUPNCZEXPWPDP-PJIALRRASA-N 2 0 222.376 2.247 20 0 BEADRP C[C@H]1C[C@H](C[NH+]2CCC(C)(C)CC2)CC[NH2+]1 ZINC000235661412 177362437 /nfs/dbraw/zinc/36/24/37/177362437.db2.gz TUFVVJRPBBRDJW-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1ccsc1C[N@H+]1CC[C@@H]([NH3+])C[C@@H]1C ZINC000087310879 487639594 /nfs/dbraw/zinc/63/95/94/487639594.db2.gz CUYFBTRQWPWLET-WDEREUQCSA-N 2 0 224.373 2.368 20 0 BEADRP C[C@@H](CCC1CC1)[NH2+]CC1CC[NH+](C)CC1 ZINC000186321662 224631090 /nfs/dbraw/zinc/63/10/90/224631090.db2.gz KLDGHBYBSYDCHB-LBPRGKRZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1CCC[C@@H](CC[N@H+]2C[C@H]3C[NH2+]C[C@H]3C2)C1 ZINC000479767289 225192420 /nfs/dbraw/zinc/19/24/20/225192420.db2.gz AUVFLLAFSVICSF-ZQDZILKHSA-N 2 0 236.403 2.354 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C)C1 ZINC000488310705 225366363 /nfs/dbraw/zinc/36/63/63/225366363.db2.gz HJMONTNTFAWEAR-RQJABVFESA-N 2 0 222.376 2.059 20 0 BEADRP CC[N@H+](C[C@@H](O)C[NH+](C)C(C)C)CC(C)(C)C ZINC000383610857 487647701 /nfs/dbraw/zinc/64/77/01/487647701.db2.gz SPCKFJQWGSOIEF-ZDUSSCGKSA-N 2 0 244.423 2.056 20 0 BEADRP Cc1cc(C)cc(C[NH2+][C@@H]2CN(C)C[C@H]2C)c1 ZINC000674913005 487653207 /nfs/dbraw/zinc/65/32/07/487653207.db2.gz UFPHQMPSBYREFB-UKRRQHHQSA-N 2 0 232.371 2.343 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[NH2+]C[C@H]1C)[C@@H]1CC1(C)C ZINC000397775114 262745718 /nfs/dbraw/zinc/74/57/18/262745718.db2.gz IBNOOGJUFAAIOI-RHYQMDGZSA-N 2 0 210.365 2.009 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+]C[C@@H](C)C(C)(C)C ZINC000163005117 487677731 /nfs/dbraw/zinc/67/77/31/487677731.db2.gz NGDZCINGBKVDGB-MNOVXSKESA-N 2 0 200.370 2.242 20 0 BEADRP CCCN1CC[C@H]([NH2+]CC(CC)CC)C1 ZINC000328465348 487694015 /nfs/dbraw/zinc/69/40/15/487694015.db2.gz JALCGXQZGFMRMA-ZDUSSCGKSA-N 2 0 212.381 2.497 20 0 BEADRP C[NH2+]CCC1CC[NH+](Cc2cncc(C)c2)CC1 ZINC000228620457 487695033 /nfs/dbraw/zinc/69/50/33/487695033.db2.gz MEVAMOBURBOBFZ-UHFFFAOYSA-N 2 0 247.386 2.212 20 0 BEADRP C[NH+](C)CCC[NH2+][C@H](C1CC1)C1CCC1 ZINC000324757236 262795463 /nfs/dbraw/zinc/79/54/63/262795463.db2.gz WNGCNNQPZKMRSF-ZDUSSCGKSA-N 2 0 210.365 2.106 20 0 BEADRP Cc1cc(C[NH2+]CC[C@@H]2CCC[N@@H+](C)C2)ccn1 ZINC000527720038 262875936 /nfs/dbraw/zinc/87/59/36/262875936.db2.gz KWTXUDRRMNSWHW-AWEZNQCLSA-N 2 0 247.386 2.212 20 0 BEADRP C[NH+](C)C1(CNc2cc[nH+]c3ccccc23)CC1 ZINC000397824210 262935994 /nfs/dbraw/zinc/93/59/94/262935994.db2.gz ALCBEAJAXNYNSS-UHFFFAOYSA-N 2 0 241.338 2.163 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@H]1CS[C@@H](C)C1 ZINC000226330596 487712862 /nfs/dbraw/zinc/71/28/62/487712862.db2.gz ZQSKJOLMSWIVDA-NWDGAFQWSA-N 2 0 230.421 2.200 20 0 BEADRP c1cc(N2CCC([NH2+]CCC3CC3)CC2)cc[nH+]1 ZINC000088455081 487726843 /nfs/dbraw/zinc/72/68/43/487726843.db2.gz CHWDYFLFWSZRJL-UHFFFAOYSA-N 2 0 245.370 2.440 20 0 BEADRP CCCOc1ccc(C[N@@H+]2CC[C@@H](C[NH3+])C2)cc1 ZINC000052920450 487732448 /nfs/dbraw/zinc/73/24/48/487732448.db2.gz QAJZATKFMFKIEX-AWEZNQCLSA-N 2 0 248.370 2.256 20 0 BEADRP CC[C@]1(C)CCC[N@H+](C[C@H]2CC[NH2+]C2)C1 ZINC000379462402 487734460 /nfs/dbraw/zinc/73/44/60/487734460.db2.gz UKWLVJVPNUJENT-QWHCGFSZSA-N 2 0 210.365 2.108 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]C[C@H]2Cc3ccccc32)C1 ZINC000250853005 487742128 /nfs/dbraw/zinc/74/21/28/487742128.db2.gz NDLQVFLMAHWMFA-MGPQQGTHSA-N 2 0 230.355 2.186 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]C[C@H]1Cc2ccccc21 ZINC000250859522 487742019 /nfs/dbraw/zinc/74/20/19/487742019.db2.gz RONDBQFZNZFUGK-GZBFAFLISA-N 2 0 230.355 2.043 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]C[C@H]1Cc2ccccc21 ZINC000250869256 487743239 /nfs/dbraw/zinc/74/32/39/487743239.db2.gz YAYUQTHOLNSXAG-SQWLQELKSA-N 2 0 244.382 2.433 20 0 BEADRP CC/C=C\C[NH2+][C@H](C)C1CC[NH+](C)CC1 ZINC000384814458 487747920 /nfs/dbraw/zinc/74/79/20/487747920.db2.gz CWTLIVADHXJLHD-FOQNGQEVSA-N 2 0 210.365 2.273 20 0 BEADRP CC(C)[C@H]([NH3+])CC[N@H+](C)[C@H](C)c1ccncc1 ZINC000251357692 487754706 /nfs/dbraw/zinc/75/47/06/487754706.db2.gz UQTGCGLPEDRPQH-TZMCWYRMSA-N 2 0 235.375 2.448 20 0 BEADRP C[NH2+]C1CC[NH+](C[C@@H](C)C(C)(C)C)CC1 ZINC000162967129 487794517 /nfs/dbraw/zinc/79/45/17/487794517.db2.gz MPLJPIKWGRWBHY-LLVKDONJSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H](C[NH2+]CCC[NH2+]C1CC1)C(C)(C)C ZINC000163005522 487796625 /nfs/dbraw/zinc/79/66/25/487796625.db2.gz DOYSJWAEMPZKOG-LLVKDONJSA-N 2 0 212.381 2.400 20 0 BEADRP CC[C@H]1C[N@H+](CCOc2ccccc2)CC[C@H]1[NH3+] ZINC000251788156 487799187 /nfs/dbraw/zinc/79/91/87/487799187.db2.gz NKLWUJXOMGINSY-DZGCQCFKSA-N 2 0 248.370 2.125 20 0 BEADRP CC[C@@H]1C[N@H+](Cc2cccs2)CC[C@H]1[NH3+] ZINC000251843172 487803198 /nfs/dbraw/zinc/80/31/98/487803198.db2.gz QZIHNVAVIARPDN-ZYHUDNBSSA-N 2 0 224.373 2.307 20 0 BEADRP CC[C@@H]1C[N@@H+]([C@H](C)c2ccccn2)CC[C@@H]1[NH3+] ZINC000251884537 487805778 /nfs/dbraw/zinc/80/57/78/487805778.db2.gz VMGMNDIWKUHLMT-UPJWGTAASA-N 2 0 233.359 2.202 20 0 BEADRP C[C@H](C[N@@H+]1CC[C@@H]([NH3+])[C@H](C)C1)C(C)(C)C ZINC000251889688 487805807 /nfs/dbraw/zinc/80/58/07/487805807.db2.gz VLHMVHRYGDRJCN-IJLUTSLNSA-N 2 0 212.381 2.338 20 0 BEADRP CC(C)([NH2+]CCC[NH3+])c1ccc(F)c(F)c1 ZINC000414707153 487819171 /nfs/dbraw/zinc/81/91/71/487819171.db2.gz MOUTXUJWOZUXCG-UHFFFAOYSA-N 2 0 228.286 2.138 20 0 BEADRP [NH3+]CCC[NH+]1CCC(F)(c2ccccc2)CC1 ZINC000414743000 487821038 /nfs/dbraw/zinc/82/10/38/487821038.db2.gz GURADWOVXUNRMX-UHFFFAOYSA-N 2 0 236.334 2.296 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)CS1 ZINC000322749037 487821929 /nfs/dbraw/zinc/82/19/29/487821929.db2.gz WWRJRMKDDPJEJO-AAGQIVHDSA-N 2 0 240.416 2.095 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCC2CC[NH2+]CC2)[C@@H]1C ZINC000386135598 487830310 /nfs/dbraw/zinc/83/03/10/487830310.db2.gz PLAITAHGQHYWDP-WZRBSPASSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCC2CC[NH2+]CC2)[C@H]1C ZINC000386135595 487830548 /nfs/dbraw/zinc/83/05/48/487830548.db2.gz PLAITAHGQHYWDP-MDZLAQPJSA-N 2 0 210.365 2.010 20 0 BEADRP COc1ccsc1C[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000414936639 487831423 /nfs/dbraw/zinc/83/14/23/487831423.db2.gz ZIVLUQQKEGYQKK-VHSXEESVSA-N 2 0 240.372 2.116 20 0 BEADRP CCCC[N@@H+]1CC[C@](C[NH3+])(C(C)(C)C)C1 ZINC000866703334 589513177 /nfs/dbraw/zinc/51/31/77/589513177.db2.gz LMTXGACBHOBLBV-CYBMUJFWSA-N 2 0 212.381 2.483 20 0 BEADRP CC[C@@H]1c2ccccc2CC[N@H+]1CCC[NH3+] ZINC000666640938 487849328 /nfs/dbraw/zinc/84/93/28/487849328.db2.gz FPVRHKNBYOIMST-CQSZACIVSA-N 2 0 218.344 2.345 20 0 BEADRP CCN(CC[NH3+])Cc1ccc(Cl)c(F)c1 ZINC000233454278 487852110 /nfs/dbraw/zinc/85/21/10/487852110.db2.gz JKXAMSQXNAQQMT-UHFFFAOYSA-N 2 0 230.714 2.260 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+]C[C@@H]1CCOc2ccccc21 ZINC000666741416 487869768 /nfs/dbraw/zinc/86/97/68/487869768.db2.gz QSSFMGHPVYOZOY-JSGCOSHPSA-N 2 0 248.370 2.126 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]Cc1cccc(F)c1F ZINC000666743842 487869785 /nfs/dbraw/zinc/86/97/85/487869785.db2.gz HAKRREHEDIKUJN-CABZTGNLSA-N 2 0 240.297 2.182 20 0 BEADRP C[C@@H](CC1CCC1)[NH2+][C@H]1CC[NH2+][C@H](C)C1 ZINC000666874199 487874722 /nfs/dbraw/zinc/87/47/22/487874722.db2.gz APOAXRRAYBATEA-MDZLAQPJSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]CCc1ccc(F)cc1F ZINC000569555858 322970072 /nfs/dbraw/zinc/97/00/72/322970072.db2.gz CLNMMNJABSQLMK-JTQLQIEISA-N 2 0 242.313 2.224 20 0 BEADRP C[NH2+]CCC[NH2+]Cc1ccccc1C1CC1 ZINC000666806919 487883570 /nfs/dbraw/zinc/88/35/70/487883570.db2.gz ASHZWWWYODRJTB-UHFFFAOYSA-N 2 0 218.344 2.263 20 0 BEADRP [NH3+]C1(C[NH2+]C[C@@H]2CCOc3ccccc32)CCC1 ZINC000666828773 487888568 /nfs/dbraw/zinc/88/85/68/487888568.db2.gz OLYBQQWAOFRFPP-LBPRGKRZSA-N 2 0 246.354 2.024 20 0 BEADRP C[C@@H](CC1CCC1)[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000666953739 487891472 /nfs/dbraw/zinc/89/14/72/487891472.db2.gz GORCUQYISKUIKN-AAEUAGOBSA-N 2 0 222.376 2.297 20 0 BEADRP CC(C)C[C@H](C)C[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000666858970 487891871 /nfs/dbraw/zinc/89/18/71/487891871.db2.gz PVIMAQWVTCHRCK-QWHCGFSZSA-N 2 0 212.381 2.400 20 0 BEADRP CC(C)C[C@@H](C)C[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000666955542 487892750 /nfs/dbraw/zinc/89/27/50/487892750.db2.gz YJLHOGUBEONHQD-OLZOCXBDSA-N 2 0 224.392 2.400 20 0 BEADRP C(C[NH2+]CC1CCSCC1)C[NH+]1CCCC1 ZINC000229260418 487900206 /nfs/dbraw/zinc/90/02/06/487900206.db2.gz KQFFUYJDVOLMSV-UHFFFAOYSA-N 2 0 242.432 2.205 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+]C[C@]1(C)CCCS1 ZINC000925553742 646330534 /nfs/dbraw/zinc/33/05/34/646330534.db2.gz VHECMVWAZSCCGR-JQWIXIFHSA-N 2 0 228.405 2.002 20 0 BEADRP C[C@H]1CCC[C@H]([NH2+]CCC[NH+](C)C)CC1 ZINC000083427149 487909454 /nfs/dbraw/zinc/90/94/54/487909454.db2.gz MJEFXIQNXGDSBI-STQMWFEESA-N 2 0 212.381 2.497 20 0 BEADRP CC1(C)CC[C@@H]([NH2+][C@H]2CC23CC[NH2+]CC3)C1 ZINC000666953689 487914930 /nfs/dbraw/zinc/91/49/30/487914930.db2.gz FBSVDOOHTBBQGY-NEPJUHHUSA-N 2 0 222.376 2.297 20 0 BEADRP CC1(C)CC[C@@H]([NH2+][C@@H]2CC23CC[NH2+]CC3)C1 ZINC000666953692 487915905 /nfs/dbraw/zinc/91/59/05/487915905.db2.gz FBSVDOOHTBBQGY-VXGBXAGGSA-N 2 0 222.376 2.297 20 0 BEADRP CC(C)C[C@@H](C)C[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000666955541 487916673 /nfs/dbraw/zinc/91/66/73/487916673.db2.gz YJLHOGUBEONHQD-CHWSQXEVSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+][C@H]2CC[NH2+]C3(CCC3)C2)C1 ZINC000666995314 487924483 /nfs/dbraw/zinc/92/44/83/487924483.db2.gz JZCIDWIAWPSZJL-UPJWGTAASA-N 2 0 222.376 2.439 20 0 BEADRP CC[C@@H]1C[N@H+](CCC(C)(C)C)CC[C@@H]1[NH3+] ZINC000157894742 487927882 /nfs/dbraw/zinc/92/78/82/487927882.db2.gz ZRNVHNGETJENMA-NEPJUHHUSA-N 2 0 212.381 2.482 20 0 BEADRP CC(C)C[C@@H]([NH3+])C[N@@H+]1CC[C@H](C2CCC2)C1 ZINC000667060729 487929862 /nfs/dbraw/zinc/92/98/62/487929862.db2.gz HZIYSMVTKOUQFW-UONOGXRCSA-N 2 0 224.392 2.482 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCC[C@@H]2C[C@@H]21)C1CC[NH+](C)CC1 ZINC000396445560 487933572 /nfs/dbraw/zinc/93/35/72/487933572.db2.gz DKQLUYHHQOMBBZ-RZFFKMDDSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@@H]([NH2+][C@H]1CS[C@H](C)C1)C1CC[NH+](C)CC1 ZINC000396470948 487935242 /nfs/dbraw/zinc/93/52/42/487935242.db2.gz XEBIOURAYRUCOU-NQBHXWOUSA-N 2 0 242.432 2.200 20 0 BEADRP CC(C)[C@H]1CCCC[C@@H]1[NH2+][C@@H]1CC[NH2+]C1 ZINC000126023315 487938329 /nfs/dbraw/zinc/93/83/29/487938329.db2.gz JHDLNWFINJHWCL-UPJWGTAASA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH2+][C@@H](C)C1CC[NH+](C)CC1)C1CC1 ZINC000035732767 487955954 /nfs/dbraw/zinc/95/59/54/487955954.db2.gz KTZLREMXLATPFC-QWRGUYRKSA-N 2 0 210.365 2.105 20 0 BEADRP CC1(C)CCCC[C@H]1[NH2+]C[C@H]([NH3+])C1CC1 ZINC000560942796 322993626 /nfs/dbraw/zinc/99/36/26/322993626.db2.gz ILFMZGGJOUBWAT-NWDGAFQWSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]C[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000403208551 323000248 /nfs/dbraw/zinc/00/02/48/323000248.db2.gz HNOVFBZIPPLUDT-ZSAUSMIDSA-N 2 0 236.403 2.352 20 0 BEADRP COCC1(CC[NH2+][C@H]2CCC[C@H]([NH3+])C2)CCC1 ZINC000566480840 323001044 /nfs/dbraw/zinc/00/10/44/323001044.db2.gz BBVGCRDWOYDSJY-STQMWFEESA-N 2 0 240.391 2.053 20 0 BEADRP CCC[C@H](C)[N@@H+]1CC[C@@H](c2nccn2C)C1 ZINC000564736284 323014419 /nfs/dbraw/zinc/01/44/19/323014419.db2.gz NQRFKYRAPDDCRK-NWDGAFQWSA-N 2 0 221.348 2.398 20 0 BEADRP Cc1cncc([C@@H](C)[NH2+]CC2CC[NH2+]CC2)c1 ZINC000562956056 323034971 /nfs/dbraw/zinc/03/49/71/323034971.db2.gz BJKWXHLGRSQYCC-GFCCVEGCSA-N 2 0 233.359 2.040 20 0 BEADRP Fc1ccc2c(c1)CC[C@H]2[NH2+]CC1CC[NH2+]CC1 ZINC000572712684 323035359 /nfs/dbraw/zinc/03/53/59/323035359.db2.gz QPSVOKCHTQBTTI-OAHLLOKOSA-N 2 0 248.345 2.402 20 0 BEADRP C[N@H+]1CC=C(C[NH2+][C@@H]2CCCC23CC3)CC1 ZINC000569710115 323038104 /nfs/dbraw/zinc/03/81/04/323038104.db2.gz NCNVSZFXZIJSBN-CYBMUJFWSA-N 2 0 220.360 2.171 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]CCCc1cccs1 ZINC000569801917 323041034 /nfs/dbraw/zinc/04/10/34/323041034.db2.gz RXQZBSBBKMFFBB-WCQYABFASA-N 2 0 238.400 2.398 20 0 BEADRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]CCCc1cccs1 ZINC000569801916 323041118 /nfs/dbraw/zinc/04/11/18/323041118.db2.gz RXQZBSBBKMFFBB-DGCLKSJQSA-N 2 0 238.400 2.398 20 0 BEADRP CC[N@H+](CC[C@H]1CCCC[NH+]1C)C[C@H](C)OC ZINC000569897533 323043636 /nfs/dbraw/zinc/04/36/36/323043636.db2.gz PASRFZRZWZUBOW-UONOGXRCSA-N 2 0 242.407 2.218 20 0 BEADRP C[N@@H+]1CCC[C@H]2C[NH+](CC3(C)CC3)CC[C@@H]21 ZINC000569904073 323043972 /nfs/dbraw/zinc/04/39/72/323043972.db2.gz CVXSMHBKIYJEFW-STQMWFEESA-N 2 0 222.376 2.203 20 0 BEADRP C[C@H](Cc1ccc(O)cc1)[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000570107605 323050292 /nfs/dbraw/zinc/05/02/92/323050292.db2.gz XURHFGCJIMBPDJ-XBFCOCLRSA-N 2 0 248.370 2.183 20 0 BEADRP C[C@H](Cc1ccsc1)[NH2+]CC[C@H](C)[NH3+] ZINC000570663007 323066447 /nfs/dbraw/zinc/06/64/47/323066447.db2.gz YDMPPAXXSNSNLR-VHSXEESVSA-N 2 0 212.362 2.006 20 0 BEADRP C(C1CC1)[NH+]1CCC([NH2+][C@@H]2C[C@H]3C[C@H]3C2)CC1 ZINC000562968511 323070177 /nfs/dbraw/zinc/07/01/77/323070177.db2.gz HGCHPPKIIUMBCD-AGGWBTHJSA-N 2 0 234.387 2.249 20 0 BEADRP COc1ccccc1/C=C/C[NH2+][C@H](C)C[C@H](C)[NH3+] ZINC000563135336 323094597 /nfs/dbraw/zinc/09/45/97/323094597.db2.gz JHDYFYLATFTSRJ-FRNKVXGRSA-N 2 0 248.370 2.424 20 0 BEADRP CCOCCC1(C[NH2+][C@H]2CCC[C@H]([NH3+])C2)CC1 ZINC000563423085 323124208 /nfs/dbraw/zinc/12/42/08/323124208.db2.gz DBIKTNWZZXFJIB-STQMWFEESA-N 2 0 240.391 2.053 20 0 BEADRP C([NH2+]C1CC[NH+](CC2CC2)CC1)[C@@H]1CC12CC2 ZINC000563572316 323130371 /nfs/dbraw/zinc/13/03/71/323130371.db2.gz SNYAGTFPVFPKOK-ZDUSSCGKSA-N 2 0 234.387 2.251 20 0 BEADRP C([NH2+]C1CC[NH+](CC2CC2)CC1)[C@H]1CC12CC2 ZINC000563572290 323130424 /nfs/dbraw/zinc/13/04/24/323130424.db2.gz SNYAGTFPVFPKOK-CYBMUJFWSA-N 2 0 234.387 2.251 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)c1ccoc1 ZINC000563616066 323131635 /nfs/dbraw/zinc/13/16/35/323131635.db2.gz QNYRMMFSPIWNKF-AUZPSNTRSA-N 2 0 234.343 2.318 20 0 BEADRP COc1ccc2c(c1)CCCN(CC(C)(C)[NH3+])C2 ZINC000571209349 323138562 /nfs/dbraw/zinc/13/85/62/323138562.db2.gz TVIGNPVWDJHWFI-UHFFFAOYSA-N 2 0 248.370 2.181 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](C(C)C)C2CC2)C1 ZINC000163304920 323144163 /nfs/dbraw/zinc/14/41/63/323144163.db2.gz ILCPYOIJGLQQJT-GXTWGEPZSA-N 2 0 224.392 2.352 20 0 BEADRP Cc1cc(C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)cc(C)n1 ZINC000571462090 323145390 /nfs/dbraw/zinc/14/53/90/323145390.db2.gz PIBSKGOGBVGHSO-ZIAGYGMSSA-N 2 0 233.359 2.058 20 0 BEADRP CC(C)(C)CC[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000259087921 323146618 /nfs/dbraw/zinc/14/66/18/323146618.db2.gz TYRGQHHGUVJUTC-GFCCVEGCSA-N 2 0 212.381 2.402 20 0 BEADRP C[C@@H](CCc1ccccc1)C[NH2+]C[C@@H]1CC[NH2+]C1 ZINC000414919150 323152001 /nfs/dbraw/zinc/15/20/01/323152001.db2.gz WHGNBPZRXXMOMX-GOEBONIOSA-N 2 0 246.398 2.454 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@@H](C)CCC(C)C ZINC000414956073 323152259 /nfs/dbraw/zinc/15/22/59/323152259.db2.gz MYRMVKVZADHXAZ-NWDGAFQWSA-N 2 0 200.370 2.399 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H](C)c1ccc2c(c1)COC2 ZINC000571669353 323177051 /nfs/dbraw/zinc/17/70/51/323177051.db2.gz IHGIMZFJAGSKRL-LBPRGKRZSA-N 2 0 248.370 2.367 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CCN2CC[C@H](C)C2)C1 ZINC000308824571 323179399 /nfs/dbraw/zinc/17/93/99/323179399.db2.gz DGYBHMZVWBAVEN-FRRDWIJNSA-N 2 0 210.365 2.106 20 0 BEADRP C[N@@H+]1CCC[C@H]1CC[NH2+]C1(C2CC2)CC1 ZINC000308923527 323181712 /nfs/dbraw/zinc/18/17/12/323181712.db2.gz HOJSIGJOAXYSAI-LBPRGKRZSA-N 2 0 208.349 2.003 20 0 BEADRP C[C@H](O)C[C@H](C)C[NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000398578334 323186825 /nfs/dbraw/zinc/18/68/25/323186825.db2.gz LAPFPTIBGQDUBM-AZHAFVHUSA-N 2 0 248.370 2.128 20 0 BEADRP CCC[C@H](C[NH2+][C@@H]1CCCCC[C@H]1[NH3+])OCC ZINC000530212960 323216552 /nfs/dbraw/zinc/21/65/52/323216552.db2.gz SHMQOPDYGWYGKS-MGPQQGTHSA-N 2 0 242.407 2.441 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]CC[C@H]1CC=CCC1 ZINC000530221905 323218485 /nfs/dbraw/zinc/21/84/85/323218485.db2.gz PQXKORLXXZBFEA-YNEHKIRRSA-N 2 0 208.349 2.202 20 0 BEADRP CC(C)C[C@@H]([NH3+])C[N@H+](C)C1CC(C)(C)C1 ZINC000395463121 323227432 /nfs/dbraw/zinc/22/74/32/323227432.db2.gz PYDWFMCRJYLYMY-LLVKDONJSA-N 2 0 212.381 2.480 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+]C(C1CCC1)C1CCC1 ZINC000324712295 323265935 /nfs/dbraw/zinc/26/59/35/323265935.db2.gz CJGXFFGJNIPSSN-JTQLQIEISA-N 2 0 210.365 2.140 20 0 BEADRP CC(C)[N@H+](C)CC1CC[NH+](CCCF)CC1 ZINC000532502454 323271707 /nfs/dbraw/zinc/27/17/07/323271707.db2.gz PHXDAKWYVNBYEF-UHFFFAOYSA-N 2 0 230.371 2.398 20 0 BEADRP CC[C@@H]1CCC[C@H]1[NH2+]CCN(C)CCCOC ZINC000532523014 323272225 /nfs/dbraw/zinc/27/22/25/323272225.db2.gz QFFZZQWSPSCIOL-ZIAGYGMSSA-N 2 0 242.407 2.123 20 0 BEADRP CC[C@H]1CCC[C@@H]1[NH2+]CCN(C)CCCOC ZINC000532523011 323272509 /nfs/dbraw/zinc/27/25/09/323272509.db2.gz QFFZZQWSPSCIOL-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP CCC[C@@H]([NH2+]C[C@H]1CCC[NH2+]1)C1CCC1 ZINC000324929722 323306267 /nfs/dbraw/zinc/30/62/67/323306267.db2.gz NHHWMVXWFBSPLD-CHWSQXEVSA-N 2 0 210.365 2.297 20 0 BEADRP CC[NH+]1CCC([NH2+]CC2CC=CC2)CC1 ZINC000527947367 323723695 /nfs/dbraw/zinc/72/36/95/323723695.db2.gz YMAPNCAOLNYRFD-UHFFFAOYSA-N 2 0 208.349 2.027 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H]1CCc2ccc(OC)cc21 ZINC000572832508 324132430 /nfs/dbraw/zinc/13/24/30/324132430.db2.gz ATECNQRYBDYUDB-HNNXBMFYSA-N 2 0 248.370 2.272 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+]CCCc1cccs1 ZINC000517731001 324176579 /nfs/dbraw/zinc/17/65/79/324176579.db2.gz YLTGVHBNWHRBSJ-NWDGAFQWSA-N 2 0 224.373 2.150 20 0 BEADRP COCC1([NH2+][C@@H](C)C[C@H]2CCCCC[NH2+]2)CC1 ZINC000517730965 324176743 /nfs/dbraw/zinc/17/67/43/324176743.db2.gz ROFIFPVGFFKMLB-QWHCGFSZSA-N 2 0 240.391 2.066 20 0 BEADRP C[C@@H]1C[C@@H](C)[N@H+](CC2CCCC2)C[C@H]1C[NH3+] ZINC000397331364 324211870 /nfs/dbraw/zinc/21/18/70/324211870.db2.gz RBIVBSCRVIAOEI-YRGRVCCFSA-N 2 0 224.392 2.482 20 0 BEADRP CCN1CCC([NH2+][C@H](C)C2CC(F)(F)C2)CC1 ZINC000529537047 324322147 /nfs/dbraw/zinc/32/21/47/324322147.db2.gz SPSFDAJBPYDLKL-SNVBAGLBSA-N 2 0 246.345 2.494 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)C2CC(F)(F)C2)C1 ZINC000529530148 324325716 /nfs/dbraw/zinc/32/57/16/324325716.db2.gz GHIMTBUHIQLVQC-GHMZBOCLSA-N 2 0 246.345 2.352 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)C2CC(F)(F)C2)C1 ZINC000529530150 324326025 /nfs/dbraw/zinc/32/60/25/324326025.db2.gz GHIMTBUHIQLVQC-QWRGUYRKSA-N 2 0 246.345 2.352 20 0 BEADRP C[C@@H]([NH2+]CC1CC[NH+](C)CC1)C1CC(F)(F)C1 ZINC000529537882 324330022 /nfs/dbraw/zinc/33/00/22/324330022.db2.gz IGRLRWNJLZJAEL-SNVBAGLBSA-N 2 0 246.345 2.352 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CC=CCC1)[C@@H]1CCC[NH2+]1 ZINC000530217551 324534513 /nfs/dbraw/zinc/53/45/13/324534513.db2.gz HXBMABMNCBNPFG-IHRRRGAJSA-N 2 0 222.376 2.463 20 0 BEADRP CSCCC[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000075644997 325304849 /nfs/dbraw/zinc/30/48/49/325304849.db2.gz DPDWTJGTMJMLCG-UHFFFAOYSA-N 2 0 244.448 2.403 20 0 BEADRP CCSCC[N@@H+]1CC[C@@H](C[NH+](CC)CC)C1 ZINC000076002912 325325503 /nfs/dbraw/zinc/32/55/03/325325503.db2.gz UZJHEXOIRIRWQG-ZDUSSCGKSA-N 2 0 244.448 2.403 20 0 BEADRP C[C@@H]1C[C@@H](C)[NH+]1CC[C@@H]1CCCC[N@@H+]1C ZINC000547769860 325391635 /nfs/dbraw/zinc/39/16/35/325391635.db2.gz UQGAMNQTQFQKPM-UPJWGTAASA-N 2 0 210.365 2.344 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]Cc1noc2ccccc12 ZINC000564348508 325451142 /nfs/dbraw/zinc/45/11/42/325451142.db2.gz LODACMFCFVECSQ-LLVKDONJSA-N 2 0 247.342 2.435 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]CC2Cc3ccccc3C2)C1 ZINC000565609813 325935101 /nfs/dbraw/zinc/93/51/01/325935101.db2.gz RMZYZPZDDDHLKW-HZPDHXFCSA-N 2 0 244.382 2.261 20 0 BEADRP Cc1cc(F)ccc1C[NH2+][C@@H](C)C[C@@H](C)[NH3+] ZINC000565951145 325977450 /nfs/dbraw/zinc/97/74/50/325977450.db2.gz KRJKKJXFABFKHF-MNOVXSKESA-N 2 0 224.323 2.350 20 0 BEADRP C[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1)[C@@H]1C[C@H]1C ZINC000566068843 325988152 /nfs/dbraw/zinc/98/81/52/325988152.db2.gz GXWVCEJOQAPQIS-JTNHKYCSSA-N 2 0 218.344 2.279 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H](C)c1cccc(OC)c1 ZINC000566088322 325992271 /nfs/dbraw/zinc/99/22/71/325992271.db2.gz QZYDBKSRQQOKHS-LBPRGKRZSA-N 2 0 236.359 2.345 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]C2CCC(F)(F)CC2)C1 ZINC000566483160 326056319 /nfs/dbraw/zinc/05/63/19/326056319.db2.gz ZHFNKSSXVBBWHK-MWLCHTKSSA-N 2 0 232.318 2.424 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H](C)C1CCSCC1 ZINC000567159352 326126153 /nfs/dbraw/zinc/12/61/53/326126153.db2.gz MGRGPKGFTAYRCY-LLVKDONJSA-N 2 0 230.421 2.107 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCC[C@H]([NH3+])C1)Oc1ccccc1 ZINC000567249498 326150636 /nfs/dbraw/zinc/15/06/36/326150636.db2.gz ICYIUSVSDIRJMI-RDBSUJKOSA-N 2 0 248.370 2.313 20 0 BEADRP CCC[NH+]1CCC([NH2+]C2(C3CC3)CC2)CC1 ZINC000309553809 326158713 /nfs/dbraw/zinc/15/87/13/326158713.db2.gz JBJBLRJTAZBLGW-UHFFFAOYSA-N 2 0 222.376 2.393 20 0 BEADRP C[NH+]1CCC([C@@H]2CC[N@H+](CC3(C)CC3)C2)CC1 ZINC000567399473 326183522 /nfs/dbraw/zinc/18/35/22/326183522.db2.gz DZRPBKBGEPWJFB-CQSZACIVSA-N 2 0 236.403 2.450 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H]2CCCCC[C@H]2[NH3+])o1 ZINC000567579782 326221117 /nfs/dbraw/zinc/22/11/17/326221117.db2.gz CBTSXSXGCOWFJV-ZIAGYGMSSA-N 2 0 236.359 2.380 20 0 BEADRP CC(C)[NH2+]CCC[NH2+][C@H](C)Cc1ccoc1 ZINC000567579929 326221751 /nfs/dbraw/zinc/22/17/51/326221751.db2.gz YHKSFRHSBFQATD-GFCCVEGCSA-N 2 0 224.348 2.188 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CC(C2CC2)C2CC2)CC[N@@H+]1C ZINC000156602642 326236995 /nfs/dbraw/zinc/23/69/95/326236995.db2.gz IUESWCRPDJRQHM-FZMZJTMJSA-N 2 0 236.403 2.495 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]CCCC1CC1 ZINC000156834285 326243950 /nfs/dbraw/zinc/24/39/50/326243950.db2.gz FKEYESGGJDKEDA-STQMWFEESA-N 2 0 210.365 2.284 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CCC[C@H](F)C1 ZINC000567735665 326253213 /nfs/dbraw/zinc/25/32/13/326253213.db2.gz OQJSYQNPUFPWCW-RVMXOQNASA-N 2 0 228.355 2.374 20 0 BEADRP FCCCCC[N@@H+]1CC[C@]2(C1)CCC[NH2+]C2 ZINC000567889766 326277089 /nfs/dbraw/zinc/27/70/89/326277089.db2.gz TZUNBSLMRMULNO-CYBMUJFWSA-N 2 0 228.355 2.202 20 0 BEADRP FCCCCC[N@@H+]1CC[C@@]2(C1)CCC[NH2+]C2 ZINC000567889767 326277242 /nfs/dbraw/zinc/27/72/42/326277242.db2.gz TZUNBSLMRMULNO-ZDUSSCGKSA-N 2 0 228.355 2.202 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H]2CCC[C@H]([NH3+])C2)cc1 ZINC000568248483 326334179 /nfs/dbraw/zinc/33/41/79/326334179.db2.gz SGWHHHOAJIYABY-LSDHHAIUSA-N 2 0 232.371 2.397 20 0 BEADRP CC[NH+]1CCC(C[NH2+]Cc2ccc(C)nc2)CC1 ZINC000158643019 326335232 /nfs/dbraw/zinc/33/52/32/326335232.db2.gz KHSSARWIQJKAPP-UHFFFAOYSA-N 2 0 247.386 2.212 20 0 BEADRP C[C@@H](C[NH2+][C@@H]1CCCC12CC2)C[NH+](C)C ZINC000568277317 326339962 /nfs/dbraw/zinc/33/99/62/326339962.db2.gz VNFQAFWJGBKORS-NWDGAFQWSA-N 2 0 210.365 2.106 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@@H]2CC[C@@H]2C2CC2)CC1 ZINC000568310740 326344013 /nfs/dbraw/zinc/34/40/13/326344013.db2.gz QEJZIFAOQFGQQD-HUUCEWRRSA-N 2 0 236.403 2.497 20 0 BEADRP CC[C@@H]1C[C@H](C[N@H+](C)CCC[NH+](C)C)CCO1 ZINC000569290965 326398985 /nfs/dbraw/zinc/39/89/85/326398985.db2.gz OEGNOKNKBPXYDT-ZIAGYGMSSA-N 2 0 242.407 2.075 20 0 BEADRP CCCC[C@H](C)[NH2+][C@H](C)CC[NH+](C)C ZINC000049554155 488018668 /nfs/dbraw/zinc/01/86/68/488018668.db2.gz DLDYLXCBJIPGBJ-NWDGAFQWSA-N 2 0 200.370 2.495 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000488324044 533717009 /nfs/dbraw/zinc/71/70/09/533717009.db2.gz CPGFRFKLHPNIRK-UKRRQHHQSA-N 2 0 236.403 2.450 20 0 BEADRP CC[C@@H](C)[N@H+](C)Cc1ccnn1-c1cc[nH+]cc1 ZINC000667505279 488032806 /nfs/dbraw/zinc/03/28/06/488032806.db2.gz KHQJBBUQWGIJEL-GFCCVEGCSA-N 2 0 244.342 2.498 20 0 BEADRP CC1(C)CCCC[C@@H]1[NH2+]CC12CC(C1)C[NH2+]2 ZINC000663499000 488047668 /nfs/dbraw/zinc/04/76/68/488047668.db2.gz UAWCEIQBMPTCED-LXVYMNJGSA-N 2 0 222.376 2.297 20 0 BEADRP C[N@H+](CC[C@H]1CC[NH2+]C1)Cc1ccsc1 ZINC000084384772 488050072 /nfs/dbraw/zinc/05/00/72/488050072.db2.gz MFVNTZRXJHHGFK-LLVKDONJSA-N 2 0 224.373 2.180 20 0 BEADRP C[N@@H+]1CC[C@@H](NCc2cccnc2)CC1(C)C ZINC000084519281 488056760 /nfs/dbraw/zinc/05/67/60/488056760.db2.gz XWNFUGRHEFRBMB-CYBMUJFWSA-N 2 0 233.359 2.044 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCC[C@@H]([NH3+])C1)CC(F)F ZINC000656200902 488067752 /nfs/dbraw/zinc/06/77/52/488067752.db2.gz YGSXIKLLANMCQM-IVZWLZJFSA-N 2 0 220.307 2.137 20 0 BEADRP Cc1ncn(CC[N@H+]2C[C@H](C)C[C@H](C)C2)c1C ZINC000319813690 488070000 /nfs/dbraw/zinc/07/00/00/488070000.db2.gz VHOGIHOXDZWPMX-TXEJJXNPSA-N 2 0 235.375 2.478 20 0 BEADRP C[C@H](c1ccncc1)[NH+]1CCC2(CC[NH2+]C2)CC1 ZINC000257692590 488082367 /nfs/dbraw/zinc/08/23/67/488082367.db2.gz JNNBVXHBUMXJIV-CYBMUJFWSA-N 2 0 245.370 2.218 20 0 BEADRP C[N@H+](CCC[NH3+])Cc1ccnc2ccccc12 ZINC000092347457 488090192 /nfs/dbraw/zinc/09/01/92/488090192.db2.gz LRKSOYWGSGCWAQ-UHFFFAOYSA-N 2 0 229.327 2.015 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H]2CCCN(C)C2)cc1 ZINC000076679571 488129282 /nfs/dbraw/zinc/12/92/82/488129282.db2.gz IJNUBUDHDDYMMR-OAHLLOKOSA-N 2 0 232.371 2.221 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CCC[N@H+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)C1 ZINC000403637625 488131520 /nfs/dbraw/zinc/13/15/20/488131520.db2.gz OQKDMFNBXQTYKB-JARUQAPTSA-N 2 0 236.403 2.482 20 0 BEADRP Cc1nccn1CCC[N@@H+]1CC[C@@H](C(F)F)C1 ZINC000677819647 488134098 /nfs/dbraw/zinc/13/40/98/488134098.db2.gz IFBCZSHCDAUHQH-LLVKDONJSA-N 2 0 243.301 2.169 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCC[C@@H]3C[C@@H]32)C1 ZINC000382102339 487531770 /nfs/dbraw/zinc/53/17/70/487531770.db2.gz HBHQISNRUMLMLV-MQYQWHSLSA-N 2 0 222.376 2.106 20 0 BEADRP C[C@@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]C[C@@H]1CCCO1 ZINC000093496299 487471553 /nfs/dbraw/zinc/47/15/53/487471553.db2.gz BOFCXGWBJPMSTJ-IHRRRGAJSA-N 2 0 240.391 2.066 20 0 BEADRP CCN(CC[NH3+])Cc1ccccc1C(F)(F)F ZINC000231819046 487477757 /nfs/dbraw/zinc/47/77/57/487477757.db2.gz PUCXECJMRDYNOY-UHFFFAOYSA-N 2 0 246.276 2.486 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CC[N@H+](CCC(C)(C)C2CC2)C1 ZINC000405986320 487494434 /nfs/dbraw/zinc/49/44/34/487494434.db2.gz CFSYSZQOHFTZDA-NWDGAFQWSA-N 2 0 224.392 2.482 20 0 BEADRP C[C@@H]([NH3+])[C@@H]1CC[N@H+](CCC(C)(C)C2CC2)C1 ZINC000405986322 487494446 /nfs/dbraw/zinc/49/44/46/487494446.db2.gz CFSYSZQOHFTZDA-VXGBXAGGSA-N 2 0 224.392 2.482 20 0 BEADRP C[N@H+](CCC(C)(C)C1CC1)C1CC([NH3+])C1 ZINC000405988796 487494468 /nfs/dbraw/zinc/49/44/68/487494468.db2.gz LKVANICCWYLESG-UHFFFAOYSA-N 2 0 210.365 2.234 20 0 BEADRP C[C@H]1C[C@H](C[NH3+])C[N@@H+]1CCC(C)(C)C1CC1 ZINC000405967609 487495507 /nfs/dbraw/zinc/49/55/07/487495507.db2.gz SGUILRAHMAVFPG-NWDGAFQWSA-N 2 0 224.392 2.482 20 0 BEADRP C[C@H]1C[C@@H](C[NH3+])C[N@@H+]1CCC(C)(C)C1CC1 ZINC000405967612 487495673 /nfs/dbraw/zinc/49/56/73/487495673.db2.gz SGUILRAHMAVFPG-RYUDHWBXSA-N 2 0 224.392 2.482 20 0 BEADRP CC[C@@H]1C[N@H+](CCCC(C)C)CC[C@@H]1[NH3+] ZINC000161559780 487503002 /nfs/dbraw/zinc/50/30/02/487503002.db2.gz JYGUWFSKABZEFL-OLZOCXBDSA-N 2 0 212.381 2.482 20 0 BEADRP C[C@H]([NH2+]CCC(F)(F)F)C1CC[NH+](C)CC1 ZINC000063099371 487513284 /nfs/dbraw/zinc/51/32/84/487513284.db2.gz ZXFGYOZSLMWSQK-VIFPVBQESA-N 2 0 238.297 2.259 20 0 BEADRP C(CC1CCC1)C[N@@H+]1CC[C@H]2[NH2+]CC[C@H]2C1 ZINC000662274480 487523102 /nfs/dbraw/zinc/52/31/02/487523102.db2.gz UPXDSNJUUCTVHL-UONOGXRCSA-N 2 0 222.376 2.251 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H]1C[C@@H](C)O[C@@H](C)C1 ZINC000249989597 487726611 /nfs/dbraw/zinc/72/66/11/487726611.db2.gz TVKLRNVZPJYTDY-BTTYYORXSA-N 2 0 242.407 2.264 20 0 BEADRP Cc1nccn1CCC[N@@H+]1CC[C@H](C(F)F)C1 ZINC000677819648 488134490 /nfs/dbraw/zinc/13/44/90/488134490.db2.gz IFBCZSHCDAUHQH-NSHDSACASA-N 2 0 243.301 2.169 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@H]2[C@@H]3CCC[C@@H]32)CC1 ZINC000390124366 488137960 /nfs/dbraw/zinc/13/79/60/488137960.db2.gz HEKHJCLWWDRFGX-WDNDVIMCSA-N 2 0 222.376 2.247 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[NH2+]C[C@H]1C)C(C)(C)C ZINC000379943455 488161954 /nfs/dbraw/zinc/16/19/54/488161954.db2.gz CPMSHDHIYYEHRC-IJLUTSLNSA-N 2 0 212.381 2.256 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CC2=CCCC2)CC[N@@H+]1C ZINC000401173879 488183046 /nfs/dbraw/zinc/18/30/46/488183046.db2.gz UWKIDIDXDNCMFL-AAEUAGOBSA-N 2 0 208.349 2.169 20 0 BEADRP C[NH+](C)CCOc1ccc(C[N@H+](C)C2CC2)cc1 ZINC000678140171 488204922 /nfs/dbraw/zinc/20/49/22/488204922.db2.gz LCUXBYRFJPDEQS-UHFFFAOYSA-N 2 0 248.370 2.221 20 0 BEADRP CC[C@H]1C[N@H+](CCC2CCC2)CC[C@H]1[NH3+] ZINC000398751679 488223591 /nfs/dbraw/zinc/22/35/91/488223591.db2.gz BYSHWFOIHCZORA-QWHCGFSZSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@@H]([NH3+])[C@@H]1CCC[N@H+](CCC2CCC2)C1 ZINC000398799006 488224685 /nfs/dbraw/zinc/22/46/85/488224685.db2.gz NDJLOEGAYJAMKA-DGCLKSJQSA-N 2 0 210.365 2.236 20 0 BEADRP CCc1ccc(C[NH2+]C[C@H]2CCC[NH2+]C2)s1 ZINC000225139832 488230055 /nfs/dbraw/zinc/23/00/55/488230055.db2.gz JCTGIVNJZLEIJX-NSHDSACASA-N 2 0 238.400 2.400 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@]2(C)CCCOC2)CC1 ZINC000678772901 488281539 /nfs/dbraw/zinc/28/15/39/488281539.db2.gz AFMBMBNYZPETOI-AWEZNQCLSA-N 2 0 240.391 2.020 20 0 BEADRP C[C@H](CCCCO)[NH2+]CCC[NH+]1CCCCC1 ZINC000679330513 488340197 /nfs/dbraw/zinc/34/01/97/488340197.db2.gz LNTFMHDDRQHPAM-CQSZACIVSA-N 2 0 242.407 2.003 20 0 BEADRP CC(C)C[N@H+](C)Cc1ccc2c(c1)C[NH2+]CC2 ZINC000211945392 488352964 /nfs/dbraw/zinc/35/29/64/488352964.db2.gz XZFSWQLOWRZVTN-UHFFFAOYSA-N 2 0 232.371 2.420 20 0 BEADRP CC[C@H]([NH2+]C[C@H]1CCC[N@H+](CC)C1)C1CC1 ZINC000121862518 490111918 /nfs/dbraw/zinc/11/19/18/490111918.db2.gz AYNYFHNCHHIAKD-OCCSQVGLSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]C2CC=CC2)CC1 ZINC000122118840 490125970 /nfs/dbraw/zinc/12/59/70/490125970.db2.gz TYGLFMKPGXLACK-UHFFFAOYSA-N 2 0 208.349 2.167 20 0 BEADRP CCc1ccc(CN2CCC[NH2+]CC2)cc1 ZINC000038086938 490147985 /nfs/dbraw/zinc/14/79/85/490147985.db2.gz OKAISHODQJEHHU-UHFFFAOYSA-N 2 0 218.344 2.044 20 0 BEADRP COC1CCC([NH2+]CC(C)(C)C[NH+](C)C)CC1 ZINC000129805546 490170770 /nfs/dbraw/zinc/17/07/70/490170770.db2.gz KCLFFVWBSZLUMR-UHFFFAOYSA-N 2 0 242.407 2.121 20 0 BEADRP CO[C@H]1CCC[C@@H]([NH2+]CC(C)(C)C[NH+](C)C)C1 ZINC000070325462 490205446 /nfs/dbraw/zinc/20/54/46/490205446.db2.gz LDLPAUBQMZAVII-OLZOCXBDSA-N 2 0 242.407 2.121 20 0 BEADRP CO[C@@H]1CCC[C@H]([NH2+]CCC[NH+]2CCCC2)C1 ZINC000070327812 490209622 /nfs/dbraw/zinc/20/96/22/490209622.db2.gz DDENLOHGDHQXED-UONOGXRCSA-N 2 0 240.391 2.020 20 0 BEADRP CO[C@H]1CCC[C@@H]([NH2+]CCC[NH+]2CCCC2)C1 ZINC000070327818 490210005 /nfs/dbraw/zinc/21/00/05/490210005.db2.gz DDENLOHGDHQXED-KGLIPLIRSA-N 2 0 240.391 2.020 20 0 BEADRP Cc1cccc(CC[NH2+][C@@H](C)C[C@@H]2CCC[NH2+]2)n1 ZINC000415111195 490214681 /nfs/dbraw/zinc/21/46/81/490214681.db2.gz UCYNSSHDNIBOCN-ZFWWWQNUSA-N 2 0 247.386 2.053 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1)c1ccncc1 ZINC000675926989 490253616 /nfs/dbraw/zinc/25/36/16/490253616.db2.gz KAAQCZPAILROKT-VNHYZAJKSA-N 2 0 247.386 2.257 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCC[C@@H]3C[C@@]32C)C1 ZINC000558621438 490282096 /nfs/dbraw/zinc/28/20/96/490282096.db2.gz MWRCRLXLBNEOAH-TUVASFSCSA-N 2 0 236.403 2.497 20 0 BEADRP CC[C@@H]([NH2+]C[C@H]1CC[N@@H+](C(C)C)C1)C1CC1 ZINC000083055798 490318397 /nfs/dbraw/zinc/31/83/97/490318397.db2.gz KUBAUVWQDBVZGI-TZMCWYRMSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H](CC1CCC1)[NH2+]CC1(N(C)C)CC1 ZINC000397825368 490540044 /nfs/dbraw/zinc/54/00/44/490540044.db2.gz AWRPKRKGFVNXTL-LLVKDONJSA-N 2 0 210.365 2.249 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CCC2CC2)[C@@H](C)C1 ZINC000222133542 490574982 /nfs/dbraw/zinc/57/49/82/490574982.db2.gz SVFYJPMEJDTZRF-WCQYABFASA-N 2 0 210.365 2.106 20 0 BEADRP c1ccc2c(c1)CC[C@H]2[NH2+][C@H]1CCC[NH2+]CC1 ZINC000128895983 490593592 /nfs/dbraw/zinc/59/35/92/490593592.db2.gz NAURYGMRUPFCLB-DZGCQCFKSA-N 2 0 230.355 2.406 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CCCS1)C1CC[NH+](C)CC1 ZINC000087667953 491091208 /nfs/dbraw/zinc/09/12/08/491091208.db2.gz WLVOMAXEKYGJFA-DGCLKSJQSA-N 2 0 242.432 2.202 20 0 BEADRP CCC[N@H+](C[C@H]1CC[C@@H](C)O1)C1CC[NH2+]CC1 ZINC000232018157 491123792 /nfs/dbraw/zinc/12/37/92/491123792.db2.gz XMZYAULPWGHSIR-TZMCWYRMSA-N 2 0 240.391 2.018 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+]CCN1CCCC1 ZINC000132178183 491134636 /nfs/dbraw/zinc/13/46/36/491134636.db2.gz PIFKAOWPQAVEJR-OLZOCXBDSA-N 2 0 210.365 2.251 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H]2CCS[C@@H]2C)[C@@H](C)C1 ZINC000309630426 491153215 /nfs/dbraw/zinc/15/32/15/491153215.db2.gz HPUFBJRJMFHBPT-QNWHQSFQSA-N 2 0 242.432 2.200 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H](C)CC[NH+](C)C)cc1 ZINC000310235593 491160880 /nfs/dbraw/zinc/16/08/80/491160880.db2.gz AETOAWZJDTYJOT-AWEZNQCLSA-N 2 0 234.387 2.467 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000488352456 533722212 /nfs/dbraw/zinc/72/22/12/533722212.db2.gz NVTPFPNJCWPNTO-VHDGCEQUSA-N 2 0 236.403 2.306 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000488358715 533722463 /nfs/dbraw/zinc/72/24/63/533722463.db2.gz XZNGOGZDKFIUBI-QLFBSQMISA-N 2 0 236.403 2.450 20 0 BEADRP CSC[C@@H]1CCC[N@@H+]1C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000400115084 533749310 /nfs/dbraw/zinc/74/93/10/533749310.db2.gz JDWCSERQAQQCNM-UPJWGTAASA-N 2 0 242.432 2.202 20 0 BEADRP C[C@H](CC1CC1)[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000400940940 533767471 /nfs/dbraw/zinc/76/74/71/533767471.db2.gz BEUXOMBTGKPRMC-FMKGYKFTSA-N 2 0 222.376 2.153 20 0 BEADRP CSC[C@H]1CCC[N@@H+]1C[C@@H]([NH3+])CC(C)C ZINC000400010303 533816553 /nfs/dbraw/zinc/81/65/53/533816553.db2.gz VLFZEFHMCMCZIZ-NWDGAFQWSA-N 2 0 230.421 2.187 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CC=CCC1)[C@H]1CCC[NH2+]1 ZINC000400386907 533905412 /nfs/dbraw/zinc/90/54/12/533905412.db2.gz MCRKSBSPNHELHB-RWMBFGLXSA-N 2 0 208.349 2.073 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)[C@@H]1C ZINC000401108378 533964959 /nfs/dbraw/zinc/96/49/59/533964959.db2.gz GMBYZQHPGSZNTP-UQPQVDFHSA-N 2 0 222.376 2.009 20 0 BEADRP CCC[C@H](C)C[N@@H+]1CCC[C@H]([C@H](C)[NH3+])C1 ZINC000251286606 535610513 /nfs/dbraw/zinc/61/05/13/535610513.db2.gz GXYFGUWHCPGMAY-AVGNSLFASA-N 2 0 212.381 2.482 20 0 BEADRP CCOC[C@@H]([NH2+]CC[C@@H]1CCC[N@@H+]1C)C(C)C ZINC000348481045 535669167 /nfs/dbraw/zinc/66/91/67/535669167.db2.gz SXWCOHUZHMGNOO-UONOGXRCSA-N 2 0 242.407 2.121 20 0 BEADRP CC[C@H]1CC[C@H]1[NH2+]CCOCC[NH+](CC)CC ZINC000348396024 536099310 /nfs/dbraw/zinc/09/93/10/536099310.db2.gz MGJHASJRNLULOG-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP CC[C@@H]1C[C@H](C)C[N@@H+]1CC1CC[NH+](C)CC1 ZINC000892068937 582784482 /nfs/dbraw/zinc/78/44/82/582784482.db2.gz WPFSVMAEUONXSZ-GXTWGEPZSA-N 2 0 224.392 2.449 20 0 BEADRP C[C@@H]1C[C@H](C)C[N@@H+](CC[C@H]2CCCC[NH2+]2)C1 ZINC000242463552 525384315 /nfs/dbraw/zinc/38/43/15/525384315.db2.gz DFIGHHKRSRRDCH-HZSPNIEDSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH2+]C[C@@H]1CCC[N@@H+]1CC1CCC(C)CC1 ZINC000169225517 536457802 /nfs/dbraw/zinc/45/78/02/536457802.db2.gz BCIBQSPLVWXDLI-RUXDESIVSA-N 2 0 224.392 2.497 20 0 BEADRP [NH3+]CCCC[NH2+]Cc1ccc(Cl)s1 ZINC000037715152 527177391 /nfs/dbraw/zinc/17/73/91/527177391.db2.gz YQPAGXGGTFTRSS-UHFFFAOYSA-N 2 0 218.753 2.230 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+]C/C=C/c2ccncc2)C1 ZINC000486986782 527814125 /nfs/dbraw/zinc/81/41/25/527814125.db2.gz ZKHLNODXCAUKFB-NHZBNJEXSA-N 2 0 245.370 2.026 20 0 BEADRP CC(C)C[C@@H](C)C[N@@H+]1C[C@@H]2CCC[NH2+][C@@H]2C1 ZINC000300987392 528252039 /nfs/dbraw/zinc/25/20/39/528252039.db2.gz VBERXDRECRSPLG-HZSPNIEDSA-N 2 0 224.392 2.352 20 0 BEADRP CCCC[N@@H+]1CC[C@@H](C[NH+](C)CCC)C1 ZINC000174949754 528485881 /nfs/dbraw/zinc/48/58/81/528485881.db2.gz OVGZZTOFLTZDQC-ZDUSSCGKSA-N 2 0 212.381 2.450 20 0 BEADRP CC(C)C[C@H]([NH3+])C[N@@H+]1CC[C@H](C2CC2)C1 ZINC000400006187 528554145 /nfs/dbraw/zinc/55/41/45/528554145.db2.gz RLKLPELXYBQTEU-STQMWFEESA-N 2 0 210.365 2.092 20 0 BEADRP CC(C)[NH+]1CCC([N@H+](C)C[C@H]2C[C@@H]2C)CC1 ZINC000488354936 528990342 /nfs/dbraw/zinc/99/03/42/528990342.db2.gz WYFWKMZAESQJGI-QWHCGFSZSA-N 2 0 224.392 2.447 20 0 BEADRP CC(C)[C@H](C)[N@H+](C[C@H]1CCC[NH2+]C1)C1CC1 ZINC000261532704 534955500 /nfs/dbraw/zinc/95/55/00/534955500.db2.gz CREYAENNOCTFLF-STQMWFEESA-N 2 0 224.392 2.495 20 0 BEADRP CC(C)C[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000036960323 535168411 /nfs/dbraw/zinc/16/84/11/535168411.db2.gz YJKZUTTYNAUOAT-UHFFFAOYSA-N 2 0 233.359 2.296 20 0 BEADRP CCO[C@@H]1C[C@@H]([NH2+][C@H](C)CC[NH+](C)C)C1(C)C ZINC000250574839 535416018 /nfs/dbraw/zinc/41/60/18/535416018.db2.gz XBEJJXFMNBEPLX-JHJVBQTASA-N 2 0 242.407 2.120 20 0 BEADRP CC[C@@H](C)C[N@H+](CC)C[C@]1(C)CC[NH2+]C1 ZINC000086440222 535510654 /nfs/dbraw/zinc/51/06/54/535510654.db2.gz YSMFLGKSOAHNRM-CHWSQXEVSA-N 2 0 212.381 2.354 20 0 BEADRP CC[C@@H]([NH2+]CC(C)(C)[NH3+])c1ccc(OC)cc1 ZINC000261551313 535802978 /nfs/dbraw/zinc/80/29/78/535802978.db2.gz MCKFBVPSICEVEY-CYBMUJFWSA-N 2 0 236.359 2.473 20 0 BEADRP CC[C@@H]([NH2+]CCC[NH3+])c1ccccc1F ZINC000168116524 535803609 /nfs/dbraw/zinc/80/36/09/535803609.db2.gz UWUHBSAGCOXETC-GFCCVEGCSA-N 2 0 210.296 2.215 20 0 BEADRP CC[C@@H]([NH2+]CCC[NH3+])c1cccc(F)c1 ZINC000164078114 535803727 /nfs/dbraw/zinc/80/37/27/535803727.db2.gz FLOLMDDWLKVYTC-GFCCVEGCSA-N 2 0 210.296 2.215 20 0 BEADRP CC[C@@H]1CCCC[C@H]1[NH2+]CCOCC[NH+](C)C ZINC000219319176 535819233 /nfs/dbraw/zinc/81/92/33/535819233.db2.gz ADUSIJYVSWWVMT-ZIAGYGMSSA-N 2 0 242.407 2.123 20 0 BEADRP CC[C@@H]1CCC[N@@H+]1C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000261536479 535820402 /nfs/dbraw/zinc/82/04/02/535820402.db2.gz RWNYEXCVPFQXRV-JHJVBQTASA-N 2 0 210.365 2.249 20 0 BEADRP CC[C@@H]1CCC[C@H]([NH2+]C[C@H]2CCC[NH2+]2)C1 ZINC000261533591 535822012 /nfs/dbraw/zinc/82/20/12/535822012.db2.gz LAIOAKFFYIYTPX-FRRDWIJNSA-N 2 0 210.365 2.297 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@H]1CCCC1(C)C ZINC000086857191 535832029 /nfs/dbraw/zinc/83/20/29/535832029.db2.gz INWBNQXSOPKSJE-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP CC[C@H]([NH2+]CC1(C)CC[NH+](C)CC1)C1CC1 ZINC000227498001 535898069 /nfs/dbraw/zinc/89/80/69/535898069.db2.gz XGVLPTAKVYCZTO-ZDUSSCGKSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@]1(C)CC[N@H+](C[C@@H]2CCC[NH2+]C2)C1 ZINC000261554799 535908414 /nfs/dbraw/zinc/90/84/14/535908414.db2.gz UPQHMGHJFJKKTG-CHWSQXEVSA-N 2 0 210.365 2.108 20 0 BEADRP CCc1ccccc1C[N@@H+]1C[C@@H]2CC[C@@H]([NH3+])[C@H]2C1 ZINC000261565580 535936958 /nfs/dbraw/zinc/93/69/58/535936958.db2.gz HSZXYQZIMWVNBK-HRCADAONSA-N 2 0 244.382 2.418 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)C1CC1 ZINC000251378293 535937443 /nfs/dbraw/zinc/93/74/43/535937443.db2.gz SKLBFACROWMELS-RDBSUJKOSA-N 2 0 222.376 2.391 20 0 BEADRP CC[C@@]1(C)CC[N@H+](C[C@H]2CCC[NH2+]C2)C1 ZINC000261554802 536048386 /nfs/dbraw/zinc/04/83/86/536048386.db2.gz UPQHMGHJFJKKTG-STQMWFEESA-N 2 0 210.365 2.108 20 0 BEADRP CC[C@H](CSC)[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000252730746 536127112 /nfs/dbraw/zinc/12/71/12/536127112.db2.gz MRYSGFNAQBSGMJ-AGIUHOORSA-N 2 0 242.432 2.344 20 0 BEADRP C[N@H+](CC1CC1)C[C@@H]1CC[NH+](CCCCF)C1 ZINC000352011219 536180987 /nfs/dbraw/zinc/18/09/87/536180987.db2.gz ACTNQOWWZCJFML-AWEZNQCLSA-N 2 0 242.382 2.400 20 0 BEADRP C[N@@H+]1CCC[C@H]1CC[NH+]1C[C@@H]2[C@H](C1)C2(C)C ZINC000348204967 536389768 /nfs/dbraw/zinc/38/97/68/536389768.db2.gz VZRTUGDZVJDDRO-RWMBFGLXSA-N 2 0 222.376 2.059 20 0 BEADRP CCCSC[C@@H](C)[NH2+]C[C@@H]1CC[N@H+](CC)C1 ZINC000892612543 582929151 /nfs/dbraw/zinc/92/91/51/582929151.db2.gz ARTMWRMCVYPGGB-OLZOCXBDSA-N 2 0 244.448 2.450 20 0 BEADRP COc1cc(C[N@@H+]2CC[C@H]([C@@H](C)[NH3+])C2)ccc1C ZINC000261644286 536773700 /nfs/dbraw/zinc/77/37/00/536773700.db2.gz AMBUYKXAVCXQEB-OCCSQVGLSA-N 2 0 248.370 2.173 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+]Cc1ccc(Cl)nc1 ZINC000853247714 588728939 /nfs/dbraw/zinc/72/89/39/588728939.db2.gz YPBYBCSGIIHDKP-LLVKDONJSA-N 2 0 241.766 2.198 20 0 BEADRP CCN1CCCC[C@H]1C[NH2+]C1CCCC1 ZINC000111392783 588747386 /nfs/dbraw/zinc/74/73/86/588747386.db2.gz GWNZBCNMRHRCIH-ZDUSSCGKSA-N 2 0 210.365 2.393 20 0 BEADRP CCN1CCCC[C@@H]1C[NH2+]C1CCCC1 ZINC000111392781 588747426 /nfs/dbraw/zinc/74/74/26/588747426.db2.gz GWNZBCNMRHRCIH-CYBMUJFWSA-N 2 0 210.365 2.393 20 0 BEADRP [NH3+]C1(C[NH2+][C@H]2CC[C@@H]2C2CC2)CCCC1 ZINC000854224387 588780575 /nfs/dbraw/zinc/78/05/75/588780575.db2.gz VYRQZVXDYQGTIN-NEPJUHHUSA-N 2 0 208.349 2.036 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2CCC[C@H]2C2CC2)CC1 ZINC000891934139 582740233 /nfs/dbraw/zinc/74/02/33/582740233.db2.gz WYPMUCBKTFYXPB-AWEZNQCLSA-N 2 0 222.376 2.203 20 0 BEADRP CCCOc1ccc(C[NH2+]C[C@@H](C)C[NH3+])cc1 ZINC000560942771 582841182 /nfs/dbraw/zinc/84/11/82/582841182.db2.gz CEDZWDULYCGCLD-LBPRGKRZSA-N 2 0 236.359 2.160 20 0 BEADRP CCCSC[C@H](C)[NH2+]CCCC[NH+](C)C ZINC000892740625 582974567 /nfs/dbraw/zinc/97/45/67/582974567.db2.gz KDHDAPMABQGEEA-LBPRGKRZSA-N 2 0 232.437 2.450 20 0 BEADRP CC[C@@H]1[C@@H](C)CC[N@@H+]1CC1CC[NH+](C)CC1 ZINC000893674299 583193449 /nfs/dbraw/zinc/19/34/49/583193449.db2.gz YUNFREATYGOHLA-GXTWGEPZSA-N 2 0 224.392 2.449 20 0 BEADRP Cc1ncoc1C[N@@H+]1CCC[C@@H](n2ccnc2)C1 ZINC000893994429 583267664 /nfs/dbraw/zinc/26/76/64/583267664.db2.gz LUFPAIXEOVZFAL-GFCCVEGCSA-N 2 0 246.314 2.017 20 0 BEADRP CC1=C(C)C[N@H+](CC2CC[NH+](C)CC2)CC1 ZINC000894194907 583333525 /nfs/dbraw/zinc/33/35/25/583333525.db2.gz NLFKZDVHORRXHE-UHFFFAOYSA-N 2 0 222.376 2.370 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]CC[C@H]1CC1(Cl)Cl ZINC000857253694 588901443 /nfs/dbraw/zinc/90/14/43/588901443.db2.gz RLGKADOSOZJDRI-YIZRAAEISA-N 2 0 237.174 2.040 20 0 BEADRP COc1ccc(C[N@H+](C)CCCn2ccnc2)o1 ZINC000894475271 583469745 /nfs/dbraw/zinc/46/97/45/583469745.db2.gz ANKZDIDHQSMKJD-UHFFFAOYSA-N 2 0 249.314 2.007 20 0 BEADRP C(=C/c1ccccc1)\CC[NH+]1C[C@@H]2C[NH2+]C[C@H]2C1 ZINC000323665567 583532395 /nfs/dbraw/zinc/53/23/95/583532395.db2.gz DMKRXWINOLZRMX-FXEMMDDYSA-N 2 0 242.366 2.241 20 0 BEADRP Cc1cc(C)cc(C[N@H+](C)C[C@H]2CC[NH2+]C2)c1 ZINC000647990348 583582437 /nfs/dbraw/zinc/58/24/37/583582437.db2.gz OLKWGUDBRSKZMC-AWEZNQCLSA-N 2 0 232.371 2.345 20 0 BEADRP CCC[N@H+](CC1CC[NH+](C)CC1)C(C)C ZINC000895204878 583624879 /nfs/dbraw/zinc/62/48/79/583624879.db2.gz IMVCBKGUNOPYCJ-UHFFFAOYSA-N 2 0 212.381 2.449 20 0 BEADRP CCCC[C@H](COC)[NH2+]CC[C@H](C)[NH+](C)C ZINC000895293036 583638912 /nfs/dbraw/zinc/63/89/12/583638912.db2.gz FUDRPXMKKULNSM-QWHCGFSZSA-N 2 0 230.396 2.121 20 0 BEADRP CCc1cc(N[C@H]2CC[N@H+](C)[C@H]2C)nc(CC)n1 ZINC000895734393 583717012 /nfs/dbraw/zinc/71/70/12/583717012.db2.gz LSONOUXOLLJVJJ-JQWIXIFHSA-N 2 0 248.374 2.106 20 0 BEADRP CCc1cc(N[C@H]2CC[N@H+](C)[C@@H]2C)nc(CC)n1 ZINC000895734395 583717235 /nfs/dbraw/zinc/71/72/35/583717235.db2.gz LSONOUXOLLJVJJ-PWSUYJOCSA-N 2 0 248.374 2.106 20 0 BEADRP C[NH+]1CCC(C[NH2+]CC2(CC3CC3)CC2)CC1 ZINC000895994682 583761239 /nfs/dbraw/zinc/76/12/39/583761239.db2.gz MQLJWXPGKQIIOB-UHFFFAOYSA-N 2 0 236.403 2.498 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CC2CC[NH+](C)CC2)CCS1 ZINC000896951842 583864173 /nfs/dbraw/zinc/86/41/73/583864173.db2.gz LZHJRWQOMNGUTA-WCQYABFASA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CC2CC[NH+](C)CC2)CCS1 ZINC000896951844 583864175 /nfs/dbraw/zinc/86/41/75/583864175.db2.gz LZHJRWQOMNGUTA-YPMHNXCESA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC(C)(C)C2CC2)CC[N@@H+]1C ZINC000897437951 583983809 /nfs/dbraw/zinc/98/38/09/583983809.db2.gz QEFXKVLKTQNATL-DGCLKSJQSA-N 2 0 224.392 2.495 20 0 BEADRP C1[C@H]2CCC[C@@H]2[C@H]1[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000897955448 584065440 /nfs/dbraw/zinc/06/54/40/584065440.db2.gz UVAGLQKMQOTMSJ-MRLBHPIUSA-N 2 0 234.387 2.391 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@@H]2C[C@@H]3CCC[C@@H]23)CC1 ZINC000897959814 584067698 /nfs/dbraw/zinc/06/76/98/584067698.db2.gz LTXAYJKGALINAA-BFHYXJOUSA-N 2 0 222.376 2.106 20 0 BEADRP CSCC(C)(C)[NH2+]CC1CC[NH+](C)CC1 ZINC000898305310 584109184 /nfs/dbraw/zinc/10/91/84/584109184.db2.gz XRXLLNHYDNBJRY-UHFFFAOYSA-N 2 0 230.421 2.059 20 0 BEADRP CCSCC[N@H+](C)CC(C)(C)C[NH+](C)C ZINC000898308220 584109540 /nfs/dbraw/zinc/10/95/40/584109540.db2.gz SQDXHCMHXYTYQP-UHFFFAOYSA-N 2 0 232.437 2.259 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@@H]2CCC[C@@H]2CCCF)C1 ZINC000873251844 584128167 /nfs/dbraw/zinc/12/81/67/584128167.db2.gz XNIYCGRFIGVLMD-FVCCEPFGSA-N 2 0 228.355 2.232 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccc(Cl)cn1 ZINC000873249509 584128328 /nfs/dbraw/zinc/12/83/28/584128328.db2.gz ATERNKTVZKEUPO-ATZCPNFKSA-N 2 0 239.750 2.123 20 0 BEADRP C[N@@H+]1CCCC[C@H](C[NH2+][C@@H]2CC[C@H]2C2CC2)C1 ZINC000858490872 588960089 /nfs/dbraw/zinc/96/00/89/588960089.db2.gz RILDURTXFMOXBB-VHDGCEQUSA-N 2 0 236.403 2.497 20 0 BEADRP CNc1ccccc1C[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000902224694 584541286 /nfs/dbraw/zinc/54/12/86/584541286.db2.gz RZBKFUOZVMTZON-CYBMUJFWSA-N 2 0 247.386 2.160 20 0 BEADRP CSCC[C@H](C)[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000902328453 584560975 /nfs/dbraw/zinc/56/09/75/584560975.db2.gz KVONVHZXRKCSDP-NWDGAFQWSA-N 2 0 244.448 2.496 20 0 BEADRP CO[C@H](C[NH2+][C@H]1CC[NH2+]CC(C)(C)C1)C(C)C ZINC000902333891 584563392 /nfs/dbraw/zinc/56/33/92/584563392.db2.gz MVGRWUMGNVHXAK-QWHCGFSZSA-N 2 0 242.407 2.025 20 0 BEADRP CC[C@@H]1CC[C@@H](C)C[C@H]1[NH2+]CC1([NH3+])CC1 ZINC000902406543 584573890 /nfs/dbraw/zinc/57/38/90/584573890.db2.gz NSLSSOIEAALIOF-IJLUTSLNSA-N 2 0 210.365 2.282 20 0 BEADRP CC[C@@H]1CC[C@H](C)C[C@@H]1[NH2+]CC1([NH3+])CC1 ZINC000902406545 584573959 /nfs/dbraw/zinc/57/39/59/584573959.db2.gz NSLSSOIEAALIOF-TUAOUCFPSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+]C1(C[NH2+][C@H]2CCCc3ccccc3C2)CC1 ZINC000902407096 584574045 /nfs/dbraw/zinc/57/40/45/584574045.db2.gz PHEVXXKKAQRZAS-AWEZNQCLSA-N 2 0 230.355 2.015 20 0 BEADRP C[C@@H]1C[C@H]1[C@@H]1C[C@H]1[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000902406856 584574331 /nfs/dbraw/zinc/57/43/31/584574331.db2.gz VIJCJZSSCVYPAJ-XGFWRYKXSA-N 2 0 236.403 2.399 20 0 BEADRP CC(C)[C@H]1CCCC[C@H]1[NH2+]CC1([NH3+])CC1 ZINC000902412746 584576144 /nfs/dbraw/zinc/57/61/44/584576144.db2.gz CUHIYSXKKZSHHW-VXGBXAGGSA-N 2 0 210.365 2.282 20 0 BEADRP CSC1(C[NH2+][C@H]2CC[NH2+]CC(C)(C)C2)CC1 ZINC000902385361 584578249 /nfs/dbraw/zinc/57/82/49/584578249.db2.gz ZZBHYIWDFTVBPD-NSHDSACASA-N 2 0 242.432 2.250 20 0 BEADRP CCC[C@H](C[NH2+][C@H]1CC[NH2+]CC(C)(C)C1)OC ZINC000902389229 584580317 /nfs/dbraw/zinc/58/03/17/584580317.db2.gz TTYFTWRBQCYEEQ-QWHCGFSZSA-N 2 0 242.407 2.169 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[NH2+]CC(C)(C)C2)CS1 ZINC000902391307 584582019 /nfs/dbraw/zinc/58/20/19/584582019.db2.gz VBJCSHVWDRJPSI-UTUOFQBUSA-N 2 0 242.432 2.248 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]([NH2+][C@@H]2C=CCC2)C1 ZINC000902391565 584582323 /nfs/dbraw/zinc/58/23/23/584582323.db2.gz GYCQKXXUBCLVQA-NEPJUHHUSA-N 2 0 208.349 2.073 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]([NH2+]Cc2cccc(N)c2)C1 ZINC000902391148 584582395 /nfs/dbraw/zinc/58/23/95/584582395.db2.gz COQVTRCLHZSEGQ-CQSZACIVSA-N 2 0 247.386 2.137 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]([NH2+]CC[C@@H]2CC2(F)F)C1 ZINC000902396920 584585642 /nfs/dbraw/zinc/58/56/42/584585642.db2.gz IEUKXEGQQHMHGJ-GHMZBOCLSA-N 2 0 246.345 2.400 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CC[C@@H]1CCCC[C@@H]1O ZINC000902430743 584594640 /nfs/dbraw/zinc/59/46/40/584594640.db2.gz DIIXXYGESMUAOF-RDBSUJKOSA-N 2 0 242.407 2.035 20 0 BEADRP CC(C)(C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)C1CC1 ZINC000902432240 584595382 /nfs/dbraw/zinc/59/53/82/584595382.db2.gz OWJOCPDTBMGSJV-SGMGOOAPSA-N 2 0 236.403 2.400 20 0 BEADRP C[C@@H](CC(C)(C)C)[NH2+][C@H]1C[NH2+]CC1(C)C ZINC000902444239 584598377 /nfs/dbraw/zinc/59/83/77/584598377.db2.gz MWOZPMFXSNJPBF-QWRGUYRKSA-N 2 0 212.381 2.399 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H]2CCC[C@@H]2c2ccccc2)CC1 ZINC000902413752 584599444 /nfs/dbraw/zinc/59/94/44/584599444.db2.gz OFYFNUJXEWAACK-ZIAGYGMSSA-N 2 0 230.355 2.404 20 0 BEADRP CC(C)[C@@H]([NH2+]CC1([NH3+])CC1)c1ccccc1 ZINC000902413511 584599762 /nfs/dbraw/zinc/59/97/62/584599762.db2.gz NFFLBDHHXHCLKX-CYBMUJFWSA-N 2 0 218.344 2.465 20 0 BEADRP CCO[C@H]1C[C@@H]([NH2+]CC2([NH3+])CC2)C1(CC)CC ZINC000902414534 584600307 /nfs/dbraw/zinc/60/03/07/584600307.db2.gz WSYSMGYZKDLWIT-NEPJUHHUSA-N 2 0 240.391 2.051 20 0 BEADRP [NH3+]C1(CN[C@@H]2CCSc3ccccc32)CC1 ZINC000902414480 584600387 /nfs/dbraw/zinc/60/03/87/584600387.db2.gz BHKKEXSWPANKLE-LLVKDONJSA-N 2 0 234.368 2.304 20 0 BEADRP C[C@@H](NCC1([NH3+])CC1)c1ccc2c(c1)CCC2 ZINC000902414517 584600527 /nfs/dbraw/zinc/60/05/27/584600527.db2.gz CEOMHGCHEUYRCV-LLVKDONJSA-N 2 0 230.355 2.317 20 0 BEADRP C[C@H]1CCCC[C@@H]1[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902472720 584600837 /nfs/dbraw/zinc/60/08/37/584600837.db2.gz GFJVSAVZOJHVKI-FPYNETTCSA-N 2 0 208.349 2.048 20 0 BEADRP C[C@H](CC1CCCC1)[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902472212 584600934 /nfs/dbraw/zinc/60/09/34/584600934.db2.gz ZAIFDBNFCMJPHW-YXCITZCRSA-N 2 0 222.376 2.438 20 0 BEADRP CCCC[C@@H](CC)[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902472676 584601143 /nfs/dbraw/zinc/60/11/43/584601143.db2.gz FELSKFYJAMIZST-FVCCEPFGSA-N 2 0 210.365 2.438 20 0 BEADRP C[C@H]1C[C@H]([NH2+][C@@H]2C[C@H]3CC[C@@H]2[NH2+]3)C[C@@H](C)C1 ZINC000902476835 584602456 /nfs/dbraw/zinc/60/24/56/584602456.db2.gz PVZJMBYHYYMXLZ-QTJJRWQNSA-N 2 0 222.376 2.294 20 0 BEADRP CC1(C)C[NH2+]C[C@@H]1[NH2+][C@H]1CC[C@H]1C1CCC1 ZINC000902447225 584603922 /nfs/dbraw/zinc/60/39/22/584603922.db2.gz XIUMIYQMGDXVHV-AVGNSLFASA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCSC(C)(C)C1)[C@@H]1CCC[NH2+]1 ZINC000902450051 584606154 /nfs/dbraw/zinc/60/61/54/584606154.db2.gz CBWZHSFVSQGIST-UTUOFQBUSA-N 2 0 242.432 2.391 20 0 BEADRP C[C@H]([NH2+][C@H]1CCSC(C)(C)C1)[C@H]1CCC[NH2+]1 ZINC000902450048 584606281 /nfs/dbraw/zinc/60/62/81/584606281.db2.gz CBWZHSFVSQGIST-SDDRHHMPSA-N 2 0 242.432 2.391 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1C[C@@H]2CCC[C@@H]12 ZINC000902453496 584607704 /nfs/dbraw/zinc/60/77/04/584607704.db2.gz DGCOOBHLDACQBB-YVECIDJPSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]CC[C@@H]1CCC(F)(F)C1 ZINC000902452738 584607926 /nfs/dbraw/zinc/60/79/26/584607926.db2.gz AGFVGYMUXGJSTH-AXFHLTTASA-N 2 0 232.318 2.281 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CCC(F)(F)C1)C1C[NH2+]C1 ZINC000902457581 584610177 /nfs/dbraw/zinc/61/01/77/584610177.db2.gz UWXWUVWIWKWNPF-UWVGGRQHSA-N 2 0 232.318 2.009 20 0 BEADRP CC[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@H]21)[C@@H]1CCC[NH2+]1 ZINC000902459187 584610815 /nfs/dbraw/zinc/61/08/15/584610815.db2.gz YLAVISXYYIZOPX-PEBLQZBPSA-N 2 0 222.376 2.295 20 0 BEADRP C1CC1[C@H]([NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2)C1CCC1 ZINC000902459604 584610831 /nfs/dbraw/zinc/61/08/31/584610831.db2.gz CXGWZVDBZQNZDB-REWJHTLYSA-N 2 0 220.360 2.048 20 0 BEADRP CC1(C)CCC[C@H](C[NH2+][C@@H]2CCC[C@H]2C[NH3+])O1 ZINC000902460249 584610902 /nfs/dbraw/zinc/61/09/02/584610902.db2.gz FUSBBYNDOWPVAC-YNEHKIRRSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]C[C@@H]1CCCC(C)(C)O1 ZINC000902460617 584611602 /nfs/dbraw/zinc/61/16/02/584611602.db2.gz HPNKGIDBBAMUSG-SRVKXCTJSA-N 2 0 228.380 2.050 20 0 BEADRP C[C@@H](CCC1CC1)[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902463980 584612198 /nfs/dbraw/zinc/61/21/98/584612198.db2.gz CBMOZIZNPSVKGF-FTYKPCCVSA-N 2 0 208.349 2.048 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@@H]([NH2+][C@@H]2C[C@@H]3CC[C@H]2[NH2+]3)C1 ZINC000902462985 584612616 /nfs/dbraw/zinc/61/26/16/584612616.db2.gz YLNXSWLIRCAFNO-GUDWOMEESA-N 2 0 222.376 2.294 20 0 BEADRP C1CC12CCC([NH2+][C@@H]1C[C@@H]3CC[C@H]1[NH2+]3)CC2 ZINC000902464338 584613220 /nfs/dbraw/zinc/61/32/20/584613220.db2.gz CTHZDBQZMBSHRQ-YNEHKIRRSA-N 2 0 220.360 2.192 20 0 BEADRP C[C@H]1CC(C)(C)C[C@H]1[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902465090 584613529 /nfs/dbraw/zinc/61/35/29/584613529.db2.gz DCLJUSHROQSXBY-KIJLLGNVSA-N 2 0 222.376 2.294 20 0 BEADRP CCC1CCC([NH2+][C@@H]2C[C@@H]3CC[C@H]2[NH2+]3)CC1 ZINC000902465900 584613868 /nfs/dbraw/zinc/61/38/68/584613868.db2.gz GVLIHMFGCJGEGI-PNKMZZHYSA-N 2 0 222.376 2.438 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+][C@@H]2C[C@@H]3CC[C@H]2[NH2+]3)[C@H]1C ZINC000902465895 584613970 /nfs/dbraw/zinc/61/39/70/584613970.db2.gz HIBYDIQCAAKJHP-GSZZWUTPSA-N 2 0 222.376 2.294 20 0 BEADRP CC(C)(C)[C@H]1CC[C@H]1[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902466798 584614238 /nfs/dbraw/zinc/61/42/38/584614238.db2.gz MVJZKIJXKGQQQX-RXGFPQBGSA-N 2 0 222.376 2.294 20 0 BEADRP C1CC([C@@H]2CC[C@H]2[NH2+][C@@H]2C[C@H]3CC[C@@H]2[NH2+]3)C1 ZINC000902467586 584615015 /nfs/dbraw/zinc/61/50/15/584615015.db2.gz OYORRMAFKJNXQV-XHJNMGKDSA-N 2 0 220.360 2.048 20 0 BEADRP C1CC([C@H]2CC[C@@H]2[NH2+][C@@H]2C[C@@H]3CC[C@H]2[NH2+]3)C1 ZINC000902469073 584615474 /nfs/dbraw/zinc/61/54/74/584615474.db2.gz OYORRMAFKJNXQV-MEBFFEOJSA-N 2 0 220.360 2.048 20 0 BEADRP CC1(C)CCC[C@H]1[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902468514 584615805 /nfs/dbraw/zinc/61/58/05/584615805.db2.gz UXJGZPPURBFECI-IRCOFANPSA-N 2 0 208.349 2.048 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2)C1CCSCC1 ZINC000902469913 584616680 /nfs/dbraw/zinc/61/66/80/584616680.db2.gz SPAWFYYAJUDTTC-FTYKPCCVSA-N 2 0 240.416 2.001 20 0 BEADRP CC[C@H]1CCC[C@@H]1[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902471313 584616759 /nfs/dbraw/zinc/61/67/59/584616759.db2.gz MVPABWCNFDHBDF-JZRPKSSGSA-N 2 0 208.349 2.048 20 0 BEADRP CC[C@@H]1CCC[C@H]1[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902471316 584616909 /nfs/dbraw/zinc/61/69/09/584616909.db2.gz MVPABWCNFDHBDF-NZEXEKPDSA-N 2 0 208.349 2.048 20 0 BEADRP C[C@H]1C[C@H]([NH2+][C@@H]2C[C@@H]3CC[C@H]2[NH2+]3)C[C@@H](C)C1 ZINC000902471515 584617068 /nfs/dbraw/zinc/61/70/68/584617068.db2.gz PVZJMBYHYYMXLZ-XADZXUCXSA-N 2 0 222.376 2.294 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+][C@H]2C[C@H](C[NH3+])C2)s1 ZINC000902490035 584617247 /nfs/dbraw/zinc/61/72/47/584617247.db2.gz UPFGYIOYNHUTIQ-GMTAPVOTSA-N 2 0 224.373 2.444 20 0 BEADRP C[C@@H](CSC(C)(C)C)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902490040 584617327 /nfs/dbraw/zinc/61/73/27/584617327.db2.gz REQVQPQOSZTPEG-DCAQKATOSA-N 2 0 230.421 2.234 20 0 BEADRP C[C@@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1cccc(F)c1 ZINC000902490528 584618217 /nfs/dbraw/zinc/61/82/17/584618217.db2.gz WAQTYMAYIFEIGI-GIPNMCIBSA-N 2 0 222.307 2.214 20 0 BEADRP Cc1ccc([C@H](C)[NH2+][C@H]2C[C@H](C[NH3+])C2)cc1 ZINC000902490921 584618327 /nfs/dbraw/zinc/61/83/27/584618327.db2.gz YODCLHJMGXOMIR-OBJOEFQTSA-N 2 0 218.344 2.383 20 0 BEADRP CC(C)[NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000902503916 584621325 /nfs/dbraw/zinc/62/13/25/584621325.db2.gz TXIWVTMQNYHZKH-DZGCQCFKSA-N 2 0 246.354 2.240 20 0 BEADRP CO[C@@H]1CCC[C@@H]([NH2+]C[C@H]2CCCCC[NH2+]2)C1 ZINC000902482426 584623845 /nfs/dbraw/zinc/62/38/45/584623845.db2.gz LDVCYJWBJIRZEM-MGPQQGTHSA-N 2 0 240.391 2.066 20 0 BEADRP C([NH2+][C@H]1CC[C@H]1C1CC1)[C@@H]1CCCCC[NH2+]1 ZINC000902482161 584624253 /nfs/dbraw/zinc/62/42/53/584624253.db2.gz JXOJHVBPPAJUKS-IHRRRGAJSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]C[C@@H]1CCCCC[NH2+]1 ZINC000902481409 584624307 /nfs/dbraw/zinc/62/43/07/584624307.db2.gz CONKQZDVBPMGEV-AAEUAGOBSA-N 2 0 210.365 2.297 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+][C@H]2CCCNc3ccccc32)C1 ZINC000902484123 584624636 /nfs/dbraw/zinc/62/46/36/584624636.db2.gz DCCXPUNENGCEMV-HUBLWGQQSA-N 2 0 245.370 2.260 20 0 BEADRP C[C@@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1ccc(Cl)cn1 ZINC000902485200 584624699 /nfs/dbraw/zinc/62/46/99/584624699.db2.gz JAHXYGRHWDDNJC-FXPVBKGRSA-N 2 0 239.750 2.123 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+][C@H]2CCCC[C@@H]2C2CC2)C1 ZINC000902484114 584624866 /nfs/dbraw/zinc/62/48/66/584624866.db2.gz CVNPFESLQNBRSL-ZRJCITRHSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@H]2C[C@H](C[NH3+])C2)[C@H](C)C1 ZINC000902485361 584624893 /nfs/dbraw/zinc/62/48/93/584624893.db2.gz JXTJJECHTITXKL-VEGXAWMVSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H]1CCC[C@@H](C)C1[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902486378 584625213 /nfs/dbraw/zinc/62/52/13/584625213.db2.gz GFROLQFEONZFGL-DDHJBXDOSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H](CCCc1cccnc1)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902486087 584625245 /nfs/dbraw/zinc/62/52/45/584625245.db2.gz PCZIPWOPBMFWNC-QEJZJMRPSA-N 2 0 247.386 2.120 20 0 BEADRP C[C@@H](CCC(F)(F)F)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902485436 584625448 /nfs/dbraw/zinc/62/54/48/584625448.db2.gz KOIOPACZXASYPB-CIUDSAMLSA-N 2 0 224.270 2.044 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+][C@@H]2CCCc3ccc(O)cc32)C1 ZINC000902486088 584625516 /nfs/dbraw/zinc/62/55/16/584625516.db2.gz PDAYZPOVWRDLLM-IXPVHAAZSA-N 2 0 246.354 2.097 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+][C@H]2CCCc3ccc(O)cc32)C1 ZINC000902486089 584625520 /nfs/dbraw/zinc/62/55/20/584625520.db2.gz PDAYZPOVWRDLLM-WBIUFABUSA-N 2 0 246.354 2.097 20 0 BEADRP CC[C@@H](Cc1ccccc1)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902486872 584625932 /nfs/dbraw/zinc/62/59/32/584625932.db2.gz DLUGYZAGKZHTPV-KKUMJFAQSA-N 2 0 232.371 2.335 20 0 BEADRP COc1ccc([C@@H](C)[NH2+][C@H]2C[C@H](C[NH3+])C2)c(C)c1 ZINC000902487693 584626522 /nfs/dbraw/zinc/62/65/22/584626522.db2.gz LXHLAECRUBBWTM-JHJVBQTASA-N 2 0 248.370 2.392 20 0 BEADRP COc1ccc2c(c1)[C@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)CC2 ZINC000902487482 584626582 /nfs/dbraw/zinc/62/65/82/584626582.db2.gz HIMARUWFVLKSQT-IXPVHAAZSA-N 2 0 246.354 2.009 20 0 BEADRP C[C@@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1cc(F)cc(F)c1 ZINC000902488112 584626765 /nfs/dbraw/zinc/62/67/65/584626765.db2.gz KGOOAOWRPULQBP-JRKPZEMJSA-N 2 0 240.297 2.353 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+][C@@H]2CCC23CCCC3)C1 ZINC000902487984 584626985 /nfs/dbraw/zinc/62/69/85/584626985.db2.gz WKWOSLCZMKQTND-IJLUTSLNSA-N 2 0 208.349 2.036 20 0 BEADRP CC[C@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1ccc(OC)cc1 ZINC000902488531 584627391 /nfs/dbraw/zinc/62/73/91/584627391.db2.gz NCBOAFXFGJSFQV-WHOFXGATSA-N 2 0 248.370 2.473 20 0 BEADRP CC[C@H](Cc1cccs1)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902488785 584627483 /nfs/dbraw/zinc/62/74/83/584627483.db2.gz NXOOZEBWKFFQGL-IJLUTSLNSA-N 2 0 238.400 2.396 20 0 BEADRP CC(C)[C@H]1CCC[C@H]1[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902489338 584627538 /nfs/dbraw/zinc/62/75/38/584627538.db2.gz PEKIKEZJZBEBFE-FDYHWXHSSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@H](CC1CCCC1)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902489406 584627540 /nfs/dbraw/zinc/62/75/40/584627540.db2.gz PUFFEZQCLIDVJK-RAIGVLPGSA-N 2 0 210.365 2.282 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]C/C=C\Cl ZINC000902522044 584631474 /nfs/dbraw/zinc/63/14/74/584631474.db2.gz VPAJFKAIXCHDGE-RWIWAZIYSA-N 2 0 239.750 2.252 20 0 BEADRP C[C@H](C[NH2+]C1C[C@H]2CCC[C@@H]2C1)C[NH+](C)C ZINC000902999214 584715015 /nfs/dbraw/zinc/71/50/15/584715015.db2.gz MRAKNVWDEAUTNQ-JHJVBQTASA-N 2 0 224.392 2.352 20 0 BEADRP CC(C)C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C1CC1 ZINC000903055821 584722006 /nfs/dbraw/zinc/72/20/06/584722006.db2.gz MFSZPJGRWFUSBK-QXMXGUDHSA-N 2 0 222.376 2.390 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H]21)C1CC[NH+](C)CC1 ZINC000903319211 584746264 /nfs/dbraw/zinc/74/62/64/584746264.db2.gz TZJSPUBRFBGCBO-PMOUVXMZSA-N 2 0 236.403 2.495 20 0 BEADRP CC[N@H+](CCc1ccccc1)C[C@@H]1C[NH2+]C[C@H]1C ZINC000903430939 584761401 /nfs/dbraw/zinc/76/14/01/584761401.db2.gz JUGUFHCKMBCLKG-ZBFHGGJFSA-N 2 0 246.398 2.407 20 0 BEADRP C[N@H+](C[C@@H]1CC[C@H]([NH3+])C1)C(C1CC1)C1CC1 ZINC000903432816 584761934 /nfs/dbraw/zinc/76/19/34/584761934.db2.gz LPAAUSURWHQDDU-MFKMUULPSA-N 2 0 222.376 2.234 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@H]1CCC[C@@H](C)[C@H]1C ZINC000903458750 584765204 /nfs/dbraw/zinc/76/52/04/584765204.db2.gz IQQQTQUKVDARLN-POQQGIQPSA-N 2 0 224.392 2.256 20 0 BEADRP CC[C@H]1CCC[C@H]1[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000903459179 584765696 /nfs/dbraw/zinc/76/56/96/584765696.db2.gz RLORPNNJDUQDMR-MROQNXINSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@@H+]1CCC[C@H]1c1ccccn1 ZINC000903442206 584767060 /nfs/dbraw/zinc/76/70/60/584767060.db2.gz KIWWNHANWCGOHU-IPYPFGDCSA-N 2 0 245.370 2.074 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[N@@H+]2CCC[C@H]2c2ccccn2)C1 ZINC000903442213 584767150 /nfs/dbraw/zinc/76/71/50/584767150.db2.gz KXULJCGIHFUAFZ-GUTXKFCHSA-N 2 0 245.370 2.346 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C/C=C\Cl)[C@@H]2CCC[C@@H]21 ZINC000903443515 584768531 /nfs/dbraw/zinc/76/85/31/584768531.db2.gz HSZBAFZEITXKRQ-DHBYLJOMSA-N 2 0 228.767 2.201 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CC[N@H+](Cc2ccc3cc[nH]c3c2)C1 ZINC000903447139 584770786 /nfs/dbraw/zinc/77/07/86/584770786.db2.gz GOFGYSHYKISOQK-SMDDNHRTSA-N 2 0 243.354 2.337 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH+]1CCC2(CC[NH2+]C2)CC1 ZINC000903451636 584772130 /nfs/dbraw/zinc/77/21/30/584772130.db2.gz CBXRZDVSLBVWTD-OLZOCXBDSA-N 2 0 222.376 2.108 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1CCC[C@]2(CC[NH2+]C2)C1 ZINC000903453908 584772855 /nfs/dbraw/zinc/77/28/55/584772855.db2.gz PCZREMFLPYEYBR-HZSPNIEDSA-N 2 0 222.376 2.108 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1CCC[C@@H]([C@@H]2CC[NH2+]C2)C1 ZINC000903453836 584773027 /nfs/dbraw/zinc/77/30/27/584773027.db2.gz NJEYFYSEIRDEMP-TUVASFSCSA-N 2 0 236.403 2.354 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1CCCC[C@H]1[C@H]1CC[NH2+]C1 ZINC000903454129 584773549 /nfs/dbraw/zinc/77/35/49/584773549.db2.gz VNFPXWVCVABOPR-QPSCCSFWSA-N 2 0 236.403 2.497 20 0 BEADRP FC1(F)CC[C@H](C[NH2+][C@@H]2CC[NH2+]C23CCC3)C1 ZINC000903472321 584775873 /nfs/dbraw/zinc/77/58/73/584775873.db2.gz RWEIUCGEDHCVME-WDEREUQCSA-N 2 0 244.329 2.296 20 0 BEADRP FC1(F)CC[C@H](C[NH2+][C@H]2CC[NH2+]C23CCC3)C1 ZINC000903472320 584776072 /nfs/dbraw/zinc/77/60/72/584776072.db2.gz RWEIUCGEDHCVME-QWRGUYRKSA-N 2 0 244.329 2.296 20 0 BEADRP C(C[NH2+][C@@H]1CC[NH2+]C12CCCC2)CC1CC1 ZINC000903482000 584779077 /nfs/dbraw/zinc/77/90/77/584779077.db2.gz UDNDKKGEKWNEHS-CYBMUJFWSA-N 2 0 222.376 2.441 20 0 BEADRP CC(C)OCCC[NH2+][C@@H]1CC[NH2+]C12CCCC2 ZINC000903484044 584779320 /nfs/dbraw/zinc/77/93/20/584779320.db2.gz OMTYRPUYIDKGKC-CYBMUJFWSA-N 2 0 240.391 2.066 20 0 BEADRP C[N@H+](C[C@H]1CCCC[NH2+]C1)C(C1CC1)C1CC1 ZINC000903727314 584793235 /nfs/dbraw/zinc/79/32/35/584793235.db2.gz SGESEHOSKJGGQH-LBPRGKRZSA-N 2 0 236.403 2.497 20 0 BEADRP CC1CC(C[N@@H+]2CCC[C@H]([C@H]3CC[NH2+]C3)C2)C1 ZINC000903748906 584794814 /nfs/dbraw/zinc/79/48/14/584794814.db2.gz CUUQQBJNKKENCY-WUCCLRPBSA-N 2 0 236.403 2.354 20 0 BEADRP CC1CC(C[N@@H+]2CCC[C@@H]([C@H]3CCC[NH2+]3)C2)C1 ZINC000903740887 584795919 /nfs/dbraw/zinc/79/59/19/584795919.db2.gz LTJDSCSDCWYTFY-NEXFUWMNSA-N 2 0 236.403 2.497 20 0 BEADRP FC1(F)C[C@@]12CC[N@H+](C[C@H]1CCCC[NH2+]C1)C2 ZINC000903768791 584798142 /nfs/dbraw/zinc/79/81/42/584798142.db2.gz QVVYUOSUXMZFHI-NWDGAFQWSA-N 2 0 244.329 2.107 20 0 BEADRP C1=CC[C@@H]2C[N@@H+](C[C@@H]3CCCC[NH2+]C3)C[C@@H]2C1 ZINC000903778044 584799906 /nfs/dbraw/zinc/79/99/06/584799906.db2.gz JFYAOWZPFTYNKU-KFWWJZLASA-N 2 0 234.387 2.274 20 0 BEADRP Cc1cc(C)nc(CN2CC[C@H]3CC[C@]32C[NH3+])c1 ZINC000903862623 584813421 /nfs/dbraw/zinc/81/34/21/584813421.db2.gz AUHYGBABKRSADG-HIFRSBDPSA-N 2 0 245.370 2.012 20 0 BEADRP CC(C)C[C@@H](C)C[N@@H+]1CCC[C@]12CC[NH2+]C2 ZINC000903872282 584815371 /nfs/dbraw/zinc/81/53/71/584815371.db2.gz YGSBZOAJFBGTFW-ZIAGYGMSSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@]1(C2CC2)COCC[N@@H+]1CCCCCC[NH3+] ZINC000903883662 584818365 /nfs/dbraw/zinc/81/83/65/584818365.db2.gz ZBEGIYANTBHGCQ-CQSZACIVSA-N 2 0 240.391 2.006 20 0 BEADRP C[C@@H]1C[N@H+](C[C@H]([NH3+])CC(F)F)[C@@H]2CCCC[C@@H]21 ZINC000903903512 584820822 /nfs/dbraw/zinc/82/08/22/584820822.db2.gz UXFQUUBPMLZLGQ-DDHJBXDOSA-N 2 0 246.345 2.479 20 0 BEADRP C[C@H](Cc1cccs1)[NH2+]C[C@@H]([NH3+])CC(F)F ZINC000903923256 584823887 /nfs/dbraw/zinc/82/38/87/584823887.db2.gz OZMFWTRPCSLLCO-BDAKNGLRSA-N 2 0 248.342 2.251 20 0 BEADRP C[C@@H]1CC(C)(C)CN1C[C@@H]([NH3+])CC(F)F ZINC000903929182 584824237 /nfs/dbraw/zinc/82/42/37/584824237.db2.gz BMZXJIGGAGSABT-BDAKNGLRSA-N 2 0 220.307 2.089 20 0 BEADRP C[N@H+](C[C@@H]1CC1(C)C)CC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000903932959 584824738 /nfs/dbraw/zinc/82/47/38/584824738.db2.gz IMPZCIDVLGNXAQ-PBNFFQIGSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@H](C[C@H]1CCCCC[NH2+]1)NCCC(C)(C)[NH3+] ZINC000903939436 584825363 /nfs/dbraw/zinc/82/53/63/584825363.db2.gz HKQSTWLKVZNXHO-CHWSQXEVSA-N 2 0 241.423 2.014 20 0 BEADRP F[C@@H]1CCCC[C@@H]1[NH2+]CC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000903935976 584825699 /nfs/dbraw/zinc/82/56/99/584825699.db2.gz WWYKFJMOGFCXGP-YUSLTOFOSA-N 2 0 240.366 2.387 20 0 BEADRP C[C@@H]1CC2(CCC2)CN1C[C@H]([NH3+])CC(F)F ZINC000903917809 584827268 /nfs/dbraw/zinc/82/72/68/584827268.db2.gz NSSSCYXVEWBTGX-NXEZZACHSA-N 2 0 232.318 2.233 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+]CC1CCCCCC1 ZINC000903960777 584828112 /nfs/dbraw/zinc/82/81/12/584828112.db2.gz ZHUQXPSXHUFMBB-DGCLKSJQSA-N 2 0 210.365 2.154 20 0 BEADRP FC1(F)CC[NH2+]C[C@H]1C[NH2+]CC1CCCCC1 ZINC000903954936 584831848 /nfs/dbraw/zinc/83/18/48/584831848.db2.gz IZAARXRYEKBUDF-LBPRGKRZSA-N 2 0 246.345 2.401 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+]Cc1ccc(F)cc1 ZINC000903974274 584832681 /nfs/dbraw/zinc/83/26/81/584832681.db2.gz NUBPLXOOISXSRK-DGCLKSJQSA-N 2 0 236.334 2.161 20 0 BEADRP CCC[C@H](C)C[NH2+]CC[C@@H]1C[NH2+]C[C@H]1C ZINC000903974146 584832685 /nfs/dbraw/zinc/83/26/85/584832685.db2.gz KCVOVWVNWVZKQY-YNEHKIRRSA-N 2 0 212.381 2.258 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+]C1CCC(C)CC1 ZINC000903973520 584832744 /nfs/dbraw/zinc/83/27/44/584832744.db2.gz FEMUPKAOUOALBM-CEUNDQEZSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H](CCCC(F)(F)F)[NH2+][C@@H]1C[NH2+]C[C@H]1C ZINC000903963709 584833454 /nfs/dbraw/zinc/83/34/54/584833454.db2.gz GNVLYFZQLVICAY-OPRDCNLKSA-N 2 0 238.297 2.305 20 0 BEADRP CC[C@@H](C)C[C@H](CC)[NH2+][C@@H]1C[NH2+]C[C@H]1C ZINC000903963606 584833619 /nfs/dbraw/zinc/83/36/19/584833619.db2.gz BZPHTLXVGIGPLH-FVCCEPFGSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+]CCCCOc1ccccc1 ZINC000903964066 584833794 /nfs/dbraw/zinc/83/37/94/584833794.db2.gz KOTZOHBDRKSEOW-UKRRQHHQSA-N 2 0 248.370 2.043 20 0 BEADRP C[C@@H]1C[C@H](C[NH2+]C2CCC=CCC2)CC[NH2+]1 ZINC000903964559 584834012 /nfs/dbraw/zinc/83/40/12/584834012.db2.gz UGLXIAAHRHRKNL-CHWSQXEVSA-N 2 0 222.376 2.463 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+]C/C=C\c1ccc(F)cc1 ZINC000903964241 584834015 /nfs/dbraw/zinc/83/40/15/584834015.db2.gz GCNFGUZQNSMJCU-BTBCPRSTSA-N 2 0 248.345 2.284 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+][C@@H]1CCCCC1(C)C ZINC000903964370 584834075 /nfs/dbraw/zinc/83/40/75/584834075.db2.gz OEILRYWFPLEBES-IJLUTSLNSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+][C@H]1CCC[C@@H](C)[C@H]1C ZINC000903964108 584834180 /nfs/dbraw/zinc/83/41/80/584834180.db2.gz LXPUGVWQDGQARB-NJMOYASZSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+][C@@H]1CC[C@@H](C)[C@@H](C)C1 ZINC000903964096 584834198 /nfs/dbraw/zinc/83/41/98/584834198.db2.gz LJADWHKUEKEHNH-NZEXEKPDSA-N 2 0 210.365 2.009 20 0 BEADRP CC[C@@H]1CCC[C@H]([NH2+]C[C@@H]2C[NH2+]C[C@H]2C)C1 ZINC000903967049 584834345 /nfs/dbraw/zinc/83/43/45/584834345.db2.gz FONGHLKMWMPSAU-MQYQWHSLSA-N 2 0 224.392 2.400 20 0 BEADRP Cc1cc(C[NH2+]C[C@@H]2C[NH2+]C[C@H]2C)c(C)s1 ZINC000903965108 584834416 /nfs/dbraw/zinc/83/44/16/584834416.db2.gz VNPGGNHUOXGQEW-RNCFNFMXSA-N 2 0 238.400 2.310 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+]C[C@@H]1CCCC[C@@H]1C ZINC000903964886 584834566 /nfs/dbraw/zinc/83/45/66/584834566.db2.gz XSQXRMDQZGUIFT-QNWHQSFQSA-N 2 0 210.365 2.010 20 0 BEADRP CC(C)C[C@H](C)C[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000903966738 584834662 /nfs/dbraw/zinc/83/46/62/584834662.db2.gz AOEJKYXURSVMKT-YNEHKIRRSA-N 2 0 212.381 2.114 20 0 BEADRP Cc1ccccc1C[C@@H](C)[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000903968290 584835009 /nfs/dbraw/zinc/83/50/09/584835009.db2.gz SAULRSCCAPWEBR-FMKPAKJESA-N 2 0 246.398 2.371 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@H]1CCC[C@H](C)C1 ZINC000903968399 584835190 /nfs/dbraw/zinc/83/51/90/584835190.db2.gz UYRZRRNUIYTUOR-RNJOBUHISA-N 2 0 210.365 2.010 20 0 BEADRP CCC[N@H+](C)C[C@@H]([NH3+])CCC(C)(C)C ZINC000904307710 584862475 /nfs/dbraw/zinc/86/24/75/584862475.db2.gz UIBROLKOMLRUPP-NSHDSACASA-N 2 0 200.370 2.482 20 0 BEADRP CC(C)(C)[C@H]1CCC[N@@H+]1C[C@H]1C[C@@H]([NH3+])C1 ZINC000904317481 584864019 /nfs/dbraw/zinc/86/40/19/584864019.db2.gz ZEKOXOARYRTTMR-GRYCIOLGSA-N 2 0 210.365 2.234 20 0 BEADRP C[C@@H]1COCCN(C[C@H]([NH3+])CCC(C)(C)C)C1 ZINC000904340132 584866468 /nfs/dbraw/zinc/86/64/68/584866468.db2.gz DLXRAWBSOIZFEV-QWHCGFSZSA-N 2 0 242.407 2.108 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[N@H+](CC2CC2)CC2CCC2)C1 ZINC000904350381 584869117 /nfs/dbraw/zinc/86/91/17/584869117.db2.gz KBGWLZDFSSIOCA-OKILXGFUSA-N 2 0 222.376 2.236 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[N@@H+]2CC[C@](F)(c3ccccc3)C2)C1 ZINC000904350979 584869541 /nfs/dbraw/zinc/86/95/41/584869541.db2.gz SSSZQHNVFITXLZ-VHDGCEQUSA-N 2 0 248.345 2.294 20 0 BEADRP C[NH2+]Cc1ccc(NC[C@]2(C)CCC[NH2+]C2)cc1 ZINC000904354277 584870338 /nfs/dbraw/zinc/87/03/38/584870338.db2.gz DCNQZSDCBNRYRN-OAHLLOKOSA-N 2 0 247.386 2.208 20 0 BEADRP CC(C)(C)CC[C@H]([NH3+])CN[C@@H](C[NH3+])C(C)(C)C ZINC000904357689 584871853 /nfs/dbraw/zinc/87/18/53/584871853.db2.gz ADFLAMVBUQUDAB-RYUDHWBXSA-N 2 0 243.439 2.103 20 0 BEADRP CC(C)(C)CC[C@@H]([NH3+])C[NH2+][C@H]1C=CCC1 ZINC000904377788 584875823 /nfs/dbraw/zinc/87/58/23/584875823.db2.gz YUKVBXLKCXOKHL-NEPJUHHUSA-N 2 0 210.365 2.448 20 0 BEADRP CC(C)[C@H]([NH3+])CCNC[C@@H]([NH3+])CCC(C)(C)C ZINC000904380002 584876809 /nfs/dbraw/zinc/87/68/09/584876809.db2.gz ZFCCGQNKZRAERZ-QWHCGFSZSA-N 2 0 243.439 2.103 20 0 BEADRP C[C@@]1(C[NH2+][C@@H]2CCCC[C@@H]2F)CCC[NH2+]C1 ZINC000904383973 584877032 /nfs/dbraw/zinc/87/70/32/584877032.db2.gz FNMADLVCOBLZIS-YNEHKIRRSA-N 2 0 228.355 2.246 20 0 BEADRP C[C@@H]1C[N@H+](Cc2ccsc2)CC[C@H]1C[NH3+] ZINC000904410876 584879006 /nfs/dbraw/zinc/87/90/06/584879006.db2.gz HBLFFCDXSVGHKK-PWSUYJOCSA-N 2 0 224.373 2.165 20 0 BEADRP COc1ccccc1C[N@@H+]1CC[C@H](C[NH3+])[C@H](C)C1 ZINC000904411856 584879487 /nfs/dbraw/zinc/87/94/87/584879487.db2.gz OLYMYHISTWAKOF-CHWSQXEVSA-N 2 0 248.370 2.112 20 0 BEADRP C[C@@H]1C[N@H+](Cc2cccs2)CC[C@@H]1C[NH3+] ZINC000904412786 584879672 /nfs/dbraw/zinc/87/96/72/584879672.db2.gz XTGVCKCWFCJMGY-GHMZBOCLSA-N 2 0 224.373 2.165 20 0 BEADRP Cc1cccc(C[N@H+](C)CC2CC[NH+](C)CC2)n1 ZINC000738312313 585042793 /nfs/dbraw/zinc/04/27/93/585042793.db2.gz PGURMQXNAKLKCR-UHFFFAOYSA-N 2 0 247.386 2.164 20 0 BEADRP C[N@@H+]1CCC[C@@H](CC[NH2+]C2CC(C(F)F)C2)C1 ZINC000839183211 585096617 /nfs/dbraw/zinc/09/66/17/585096617.db2.gz UWYCUEQGVCMOAA-UNXYVOJBSA-N 2 0 246.345 2.352 20 0 BEADRP C[C@@H]1CC[C@H]1[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC000839183332 585096837 /nfs/dbraw/zinc/09/68/37/585096837.db2.gz WMLNHWITVFCXMH-JHJVBQTASA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]([N@H+](C)CC1CC[NH+](C)CC1)C1(C)CC1 ZINC000782184102 585810810 /nfs/dbraw/zinc/81/08/10/585810810.db2.gz QVSQWNBIKBLKCX-LBPRGKRZSA-N 2 0 224.392 2.449 20 0 BEADRP CCC[N@H+](C)C[C@H]1CC[NH+]([C@H](C)C2CC2)C1 ZINC000782185542 585810815 /nfs/dbraw/zinc/81/08/15/585810815.db2.gz HGSNFLPSTGCFKQ-CHWSQXEVSA-N 2 0 224.392 2.449 20 0 BEADRP CC[N@H+](C)C[C@H]1CC[NH+]([C@H](C)C2CC2)C1 ZINC000782191549 585811808 /nfs/dbraw/zinc/81/18/08/585811808.db2.gz XAVGKFIIMJSRHD-VXGBXAGGSA-N 2 0 210.365 2.059 20 0 BEADRP CS[C@@H]1CC[C@@H]([NH2+][C@H](C)[C@H]2CCCC[NH2+]2)C1 ZINC000817897221 586834540 /nfs/dbraw/zinc/83/45/40/586834540.db2.gz HGUTYKXJBXOMLM-FDYHWXHSSA-N 2 0 242.432 2.391 20 0 BEADRP CC[C@H]([NH2+]CC(C)(C)SC)[C@@H]1CCC[NH2+]1 ZINC000817898314 586835109 /nfs/dbraw/zinc/83/51/09/586835109.db2.gz FJDZGWHHEXRYCT-QWRGUYRKSA-N 2 0 230.421 2.248 20 0 BEADRP CC[C@H]([NH2+][C@H]1CC[C@@H](SC)C1)[C@@H]1CCC[NH2+]1 ZINC000817897272 586835510 /nfs/dbraw/zinc/83/55/10/586835510.db2.gz JCRXIWYWFCWXND-RNJOBUHISA-N 2 0 242.432 2.391 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]CCNc1ccccc1 ZINC000817900077 586835843 /nfs/dbraw/zinc/83/58/43/586835843.db2.gz KCTFUGMOVDZONE-UKRRQHHQSA-N 2 0 247.386 2.076 20 0 BEADRP [NH3+][C@H]1CCCCC[C@H]1[NH2+]CCNc1ccccc1 ZINC000817900314 586836125 /nfs/dbraw/zinc/83/61/25/586836125.db2.gz MFPGFLSIOUBNCF-LSDHHAIUSA-N 2 0 247.386 2.348 20 0 BEADRP CS[C@@H]1CC[C@H]([NH2+][C@@H]2CC[NH2+]CC[C@@H]2C)C1 ZINC000817900503 586836268 /nfs/dbraw/zinc/83/62/68/586836268.db2.gz PHDXFVDZAIFMOO-WUHRBBMRSA-N 2 0 242.432 2.248 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]CCC1CCC1 ZINC000817906748 586836844 /nfs/dbraw/zinc/83/68/44/586836844.db2.gz FEBYWKPSRBGQTL-YPMHNXCESA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]CCC1CCC1 ZINC000817906746 586837368 /nfs/dbraw/zinc/83/73/68/586837368.db2.gz FEBYWKPSRBGQTL-DGCLKSJQSA-N 2 0 210.365 2.154 20 0 BEADRP [NH3+][C@H]1CCCCC[C@@H]1[NH2+]CCC1CCC1 ZINC000817907878 586837599 /nfs/dbraw/zinc/83/75/99/586837599.db2.gz YBTPFUXVVYFQCQ-STQMWFEESA-N 2 0 210.365 2.426 20 0 BEADRP CSCCCCCC[NH2+][C@@H]1CCC[C@H]1[NH3+] ZINC000817922094 586840184 /nfs/dbraw/zinc/84/01/84/586840184.db2.gz PTTIYACAALEELO-VXGBXAGGSA-N 2 0 230.421 2.379 20 0 BEADRP COc1cc(C)c([C@@H](C)[NH2+]CCC[NH3+])cc1C ZINC000817938986 586844477 /nfs/dbraw/zinc/84/44/77/586844477.db2.gz XCHNLCCFLYWMNI-GFCCVEGCSA-N 2 0 236.359 2.311 20 0 BEADRP C[C@H](CSC(C)(C)C)[NH2+]CC1CC[NH2+]CC1 ZINC000817941219 586844971 /nfs/dbraw/zinc/84/49/71/586844971.db2.gz NPCAKCHIUJXQEO-LLVKDONJSA-N 2 0 244.448 2.496 20 0 BEADRP C[NH2+]CCC[NH2+][C@H](C)CSC(C)(C)C ZINC000817939887 586845636 /nfs/dbraw/zinc/84/56/36/586845636.db2.gz HUQXFDNUMTYAOV-SNVBAGLBSA-N 2 0 218.410 2.106 20 0 BEADRP C[C@H](N[C@@H](C[NH3+])C1CC1)c1ccc2c(c1)CCO2 ZINC000817959102 586851556 /nfs/dbraw/zinc/85/15/56/586851556.db2.gz CGKIJAZJVNYGFR-HZMBPMFUSA-N 2 0 246.354 2.009 20 0 BEADRP C[C@@H](CSC(C)(C)C)[NH2+]C[C@@H]([NH3+])C1CC1 ZINC000817965638 586855252 /nfs/dbraw/zinc/85/52/52/586855252.db2.gz SRDMAZXFGHCDJB-GXSJLCMTSA-N 2 0 230.421 2.234 20 0 BEADRP C[C@H](CSC(C)(C)C)[NH2+]CC1=CC[NH2+]CC1 ZINC000817968750 586856317 /nfs/dbraw/zinc/85/63/17/586856317.db2.gz XMJZSEVHRPYOGC-LLVKDONJSA-N 2 0 242.432 2.416 20 0 BEADRP C[C@H]([NH3+])C[NH2+][C@@H]1CC[C@H]2CCCC[C@@H]2C1 ZINC000817971265 586858987 /nfs/dbraw/zinc/85/89/87/586858987.db2.gz LNBBKTHCMGCMOI-UMSGYPCISA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H](CCCc1cccnc1)[NH2+][C@@H]1CCN(C)C1 ZINC000834566693 587759630 /nfs/dbraw/zinc/75/96/30/587759630.db2.gz QHAQKAHDUCKMMJ-UKRRQHHQSA-N 2 0 247.386 2.087 20 0 BEADRP C[N@H+](CCCC[NH2+]Cc1ccoc1)C1CC1 ZINC000835061263 587779814 /nfs/dbraw/zinc/77/98/14/587779814.db2.gz GREIXLJLZDENPP-UHFFFAOYSA-N 2 0 222.332 2.244 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+]CC1CCCC1 ZINC000841076473 587943402 /nfs/dbraw/zinc/94/34/02/587943402.db2.gz YTXFAQXRMOFSQN-VTXSZYRJSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]Cc1ccc(Cl)nc1 ZINC000841079906 587944749 /nfs/dbraw/zinc/94/47/49/587944749.db2.gz OGYPGXVFGXQJTA-JTQLQIEISA-N 2 0 241.766 2.342 20 0 BEADRP CCCCCC[C@H](C)[NH2+]C[C@@H]1C[NH2+]CCCO1 ZINC000841085439 587946102 /nfs/dbraw/zinc/94/61/02/587946102.db2.gz CLDOZFCXAJZUFY-KBPBESRZSA-N 2 0 242.407 2.313 20 0 BEADRP CO[C@@H]1CCC[C@@H]([NH2+]CCCCCC[NH3+])C1 ZINC000843341946 588100880 /nfs/dbraw/zinc/10/08/80/588100880.db2.gz LZDCOSXKZBOBEE-CHWSQXEVSA-N 2 0 228.380 2.053 20 0 BEADRP C[C@@H]([NH2+]CCCCCC[NH3+])c1ccco1 ZINC000843342345 588101073 /nfs/dbraw/zinc/10/10/73/588101073.db2.gz KTFOBHHQLHCNFA-LLVKDONJSA-N 2 0 210.321 2.449 20 0 BEADRP CO[C@H]1CCC[C@H]([NH2+]CCCCCC[NH3+])C1 ZINC000843341951 588101130 /nfs/dbraw/zinc/10/11/30/588101130.db2.gz LZDCOSXKZBOBEE-STQMWFEESA-N 2 0 228.380 2.053 20 0 BEADRP C[C@H]([NH2+]CCCCCC[NH3+])c1ccncc1 ZINC000843340629 588101222 /nfs/dbraw/zinc/10/12/22/588101222.db2.gz CPDBVSOZBJGZLB-LBPRGKRZSA-N 2 0 221.348 2.251 20 0 BEADRP C[C@H]([NH2+]CCCCCC[NH3+])c1ccccn1 ZINC000843342521 588101539 /nfs/dbraw/zinc/10/15/39/588101539.db2.gz RNDFWZFWZFUMKP-LBPRGKRZSA-N 2 0 221.348 2.251 20 0 BEADRP [NH3+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2CCCCCF ZINC000843360139 588104294 /nfs/dbraw/zinc/10/42/94/588104294.db2.gz AUXYWTYAGGJARF-YHWZYXNKSA-N 2 0 228.355 2.470 20 0 BEADRP [NH3+]C[C@H]1CCC[N@H+](Cc2cccc3c2CCC3)C1 ZINC000844901689 588218960 /nfs/dbraw/zinc/21/89/60/588218960.db2.gz HWHLYBHVMLAFOZ-CYBMUJFWSA-N 2 0 244.382 2.346 20 0 BEADRP CC(C)C[N@H+](C)CCC[NH2+]C[C@H]1CCC=CO1 ZINC000845996034 588252778 /nfs/dbraw/zinc/25/27/78/588252778.db2.gz JJVZFLAZDWOLPL-CQSZACIVSA-N 2 0 240.391 2.247 20 0 BEADRP CCCCCC[NH+]1CCC([NH2+]CCOC)CC1 ZINC000846221696 588259944 /nfs/dbraw/zinc/25/99/44/588259944.db2.gz BWRVOYCABOOSJT-UHFFFAOYSA-N 2 0 242.407 2.267 20 0 BEADRP NC[C@H]([NH2+]CCCCCC[NH3+])C1CCCCC1 ZINC000846221043 588261372 /nfs/dbraw/zinc/26/13/72/588261372.db2.gz RERVLTWNIYRXEE-AWEZNQCLSA-N 2 0 241.423 2.003 20 0 BEADRP CC[C@@H]([NH2+]CCN1CCCC1)[C@H]1CCCCO1 ZINC000847089861 588305755 /nfs/dbraw/zinc/30/57/55/588305755.db2.gz LJZPEALHZUSGGI-ZIAGYGMSSA-N 2 0 240.391 2.020 20 0 BEADRP CC[C@H]1CC[N@H+](CC[C@@H]2CCC[NH2+]C2)C1 ZINC000108324264 588460640 /nfs/dbraw/zinc/46/06/40/588460640.db2.gz BHADWANLCZZVIL-STQMWFEESA-N 2 0 210.365 2.108 20 0 BEADRP C([NH2+][C@H]1CC[NH2+]C12CCC2)C1CCCC1 ZINC000863482756 589292546 /nfs/dbraw/zinc/29/25/46/589292546.db2.gz KTTMFCYTFFYBJJ-LBPRGKRZSA-N 2 0 208.349 2.051 20 0 BEADRP Cc1cc(CN(C)C[C@H](C)[NH3+])cc2cccnc12 ZINC000863652080 589307351 /nfs/dbraw/zinc/30/73/51/589307351.db2.gz PWHLCNOMRFOLNP-LBPRGKRZSA-N 2 0 243.354 2.322 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+][C@H]2C[C@H](SC)C2)[C@H](C)C1 ZINC000866486621 589496663 /nfs/dbraw/zinc/49/66/63/589496663.db2.gz MPAZCTVLTBBWCJ-FDYHWXHSSA-N 2 0 242.432 2.200 20 0 BEADRP CC(C)[C@](C)(C[NH3+])[NH2+]C[C@H]1CCC(C)(C)CO1 ZINC000866661825 589508947 /nfs/dbraw/zinc/50/89/47/589508947.db2.gz VOQUJQURKJSYJN-OCCSQVGLSA-N 2 0 242.407 2.155 20 0 BEADRP CC(C)(C)[C@@]1(C[NH3+])CC[N@H+](Cc2ccccn2)C1 ZINC000866705933 589514700 /nfs/dbraw/zinc/51/47/00/589514700.db2.gz JTGYQAVPNUOTAS-OAHLLOKOSA-N 2 0 247.386 2.279 20 0 BEADRP COCCCC[N@@H+]1CC[C@](C[NH3+])(C(C)(C)C)C1 ZINC000866707826 589514830 /nfs/dbraw/zinc/51/48/30/589514830.db2.gz XACJOSFPNBNCSL-CQSZACIVSA-N 2 0 242.407 2.110 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CC(C)(C)SC)[C@H](C)C1 ZINC000122160331 589558024 /nfs/dbraw/zinc/55/80/24/589558024.db2.gz GREXUTXZCBMEMX-VXGBXAGGSA-N 2 0 244.448 2.448 20 0 BEADRP CC[C@H]([NH2+]CCOCC[NH+](C)C)C(C)(C)CC ZINC000872064837 589863608 /nfs/dbraw/zinc/86/36/08/589863608.db2.gz MWLPLQFARCIHGF-ZDUSSCGKSA-N 2 0 244.423 2.369 20 0 BEADRP C[N@@H+]1CCC[C@H](CNc2cc[nH+]cc2C2CC2)C1 ZINC000872447758 589940397 /nfs/dbraw/zinc/94/03/97/589940397.db2.gz ARYBYRFDPWITLH-GFCCVEGCSA-N 2 0 245.370 2.135 20 0 BEADRP CC[N@@H+]1CCN(c2cc[nH+]cc2C2CC2)C[C@@H]1C ZINC000872492132 589944369 /nfs/dbraw/zinc/94/43/69/589944369.db2.gz CLHTUCODGWBRLZ-LBPRGKRZSA-N 2 0 245.370 2.489 20 0 BEADRP COC[C@H](CC(C)C)[NH2+][C@H](C)C1CC[NH2+]CC1 ZINC000873220678 589999034 /nfs/dbraw/zinc/99/90/34/589999034.db2.gz RAPAOKMHEMLGJS-OCCSQVGLSA-N 2 0 242.407 2.025 20 0 BEADRP CCC[C@H](C)C[NH2+][C@]12CCC[C@@H]1[NH2+]CC2 ZINC000873229722 590002437 /nfs/dbraw/zinc/00/24/37/590002437.db2.gz FDZYGZAJVWAQML-AVGNSLFASA-N 2 0 210.365 2.297 20 0 BEADRP CC(C)(C)CC[NH2+][C@]12CCC[C@H]1[NH2+]CC2 ZINC000873232337 590002595 /nfs/dbraw/zinc/00/25/95/590002595.db2.gz WSSALVBCKZKCFE-YPMHNXCESA-N 2 0 210.365 2.297 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]CC[C@H]1CCSC1 ZINC000873234394 590004071 /nfs/dbraw/zinc/00/40/71/590004071.db2.gz CGPIEOKCHNKTJZ-YNEHKIRRSA-N 2 0 242.432 2.379 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CCCS1)[C@H]1CCCC[NH2+]1 ZINC000873244351 590004317 /nfs/dbraw/zinc/00/43/17/590004317.db2.gz RGZDHSIRQFEBQA-JHJVBQTASA-N 2 0 242.432 2.392 20 0 BEADRP CC[C@@H]([NH2+]CC[C@@H]1CCCS1)[C@@H]1CCC[NH2+]1 ZINC000873243872 590006877 /nfs/dbraw/zinc/00/68/77/590006877.db2.gz NXDCQTOCYGCLCA-XQQFMLRXSA-N 2 0 242.432 2.392 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]1[NH2+]CC1CCC2(CC2)CC1 ZINC000873242755 590007086 /nfs/dbraw/zinc/00/70/86/590007086.db2.gz SDNKBWAEHSIUAR-STQMWFEESA-N 2 0 222.376 2.426 20 0 BEADRP CCC[C@@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)C1CCC1 ZINC000873256540 590007115 /nfs/dbraw/zinc/00/71/15/590007115.db2.gz PECIZHDJZAHPBX-RAIGVLPGSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)(C)[C@H]1CC[C@@H]1[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873249231 590007201 /nfs/dbraw/zinc/00/72/01/590007201.db2.gz IYVYPYRDRDQZOZ-USZNOCQGSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]C[C@H]2C[C@H]([NH3+])C2)[C@@H]1C ZINC000873258439 590007824 /nfs/dbraw/zinc/00/78/24/590007824.db2.gz QUEDTSSNUPEGCL-SYLRKERUSA-N 2 0 210.365 2.138 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@H](C2CC2)C2CCCC2)C1 ZINC000873250904 590008170 /nfs/dbraw/zinc/00/81/70/590008170.db2.gz RLGOABNWDPSFQW-GDLCADMTSA-N 2 0 222.376 2.282 20 0 BEADRP Cc1nc([C@@H](C)[NH2+]C[C@H]2C[C@@H]([NH3+])C2)c(C)s1 ZINC000873252191 590008792 /nfs/dbraw/zinc/00/87/92/590008792.db2.gz PTITZRARSJAUQI-ONOSFVFSSA-N 2 0 239.388 2.148 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@H](c2cccnc2)C2CCC2)C1 ZINC000873252115 590008922 /nfs/dbraw/zinc/00/89/22/590008922.db2.gz ZXPOIDONMASEPN-GLQYFDAESA-N 2 0 245.370 2.250 20 0 BEADRP Cc1ccc2c(c1)CC[C@H]2[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873253827 590009466 /nfs/dbraw/zinc/00/94/66/590009466.db2.gz FRWXMRMVQJOLMK-OSAQELSMSA-N 2 0 230.355 2.309 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@H]2CCc3cc(F)ccc32)C1 ZINC000873254448 590010072 /nfs/dbraw/zinc/01/00/72/590010072.db2.gz UFPRCEQPDFSFDD-BHYNMZESSA-N 2 0 234.318 2.140 20 0 BEADRP COc1ccc2c(c1)[C@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)CC2 ZINC000873254500 590010085 /nfs/dbraw/zinc/01/00/85/590010085.db2.gz VKQMSSYDFGHENY-IFUGULHKSA-N 2 0 246.354 2.009 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+][C@H]2CCCC23CCC3)C1 ZINC000873254684 590010399 /nfs/dbraw/zinc/01/03/99/590010399.db2.gz AJJAOZWCAKBMSZ-SRVKXCTJSA-N 2 0 208.349 2.036 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@H]2CCc3c2cccc3F)C1 ZINC000873254604 590010451 /nfs/dbraw/zinc/01/04/51/590010451.db2.gz YBOJGXRNZVBGPZ-RBZYPMLTSA-N 2 0 234.318 2.140 20 0 BEADRP CO[C@@H](c1ccccc1)[C@@H](C)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873254964 590010455 /nfs/dbraw/zinc/01/04/55/590010455.db2.gz CISVZULNZXASCX-QHSBEEBCSA-N 2 0 248.370 2.090 20 0 BEADRP C[C@H]1CC(C)(C)C[C@H]1[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873255260 590010466 /nfs/dbraw/zinc/01/04/66/590010466.db2.gz FMQBQXHCGRBNAY-FIQHERPVSA-N 2 0 210.365 2.138 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+][C@@H](Cc2ccccc2)C2CC2)C1 ZINC000873255784 590011013 /nfs/dbraw/zinc/01/10/13/590011013.db2.gz KDYIJZQTAAUSPA-BPUTZDHNSA-N 2 0 244.382 2.335 20 0 BEADRP CC(C)(C)[C@H]1CC[C@H]1[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873255852 590011059 /nfs/dbraw/zinc/01/10/59/590011059.db2.gz IYVYPYRDRDQZOZ-FIQHERPVSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1cccnc1Cl ZINC000873257080 590011457 /nfs/dbraw/zinc/01/14/57/590011457.db2.gz QOAAWZNZOZGLSL-OPRDCNLKSA-N 2 0 239.750 2.123 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+][C@H]2CCC[C@@H](C3CC3)C2)C1 ZINC000873256303 590011533 /nfs/dbraw/zinc/01/15/33/590011533.db2.gz MZTNMQSFCSGLDH-ZRJCITRHSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1cccs1 ZINC000873257392 590012172 /nfs/dbraw/zinc/01/21/72/590012172.db2.gz UKIVWNPORSWYKJ-LPEHRKFASA-N 2 0 210.346 2.136 20 0 BEADRP COc1ccc([C@H](C)[NH2+]C[C@H]2C[C@H]([NH3+])C2)c(C)c1 ZINC000873257860 590012386 /nfs/dbraw/zinc/01/23/86/590012386.db2.gz YBFWSFHPQRHJNH-AVGNSLFASA-N 2 0 248.370 2.392 20 0 BEADRP Cc1ccc2c(c1)[C@@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)CC2 ZINC000873258184 590012400 /nfs/dbraw/zinc/01/24/00/590012400.db2.gz NNYHGUZDJDSHSZ-WHOFXGATSA-N 2 0 230.355 2.309 20 0 BEADRP Cc1cccc([C@@H](C)[NH2+]C[C@H]2C[C@H]([NH3+])C2)c1 ZINC000873257870 590012501 /nfs/dbraw/zinc/01/25/01/590012501.db2.gz LHWBYDMOIXIYJK-YRGRVCCFSA-N 2 0 218.344 2.383 20 0 BEADRP CC[C@@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1ccccc1 ZINC000873257718 590012577 /nfs/dbraw/zinc/01/25/77/590012577.db2.gz JMSJBBPUUXMTKH-MRVWCRGKSA-N 2 0 218.344 2.465 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]C[C@H]2C[C@H]([NH3+])C2)[C@H]1C ZINC000873258436 590012874 /nfs/dbraw/zinc/01/28/74/590012874.db2.gz QUEDTSSNUPEGCL-NZEXEKPDSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H](CCCC(F)(F)F)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873258496 590012682 /nfs/dbraw/zinc/01/26/82/590012682.db2.gz RUVKFLQRAMDJSJ-GUBZILKMSA-N 2 0 238.297 2.434 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1ccc2c(c1)CCO2 ZINC000873258524 590012807 /nfs/dbraw/zinc/01/28/07/590012807.db2.gz RCGXIFLJVMFKJT-JTNHKYCSSA-N 2 0 246.354 2.009 20 0 BEADRP C([NH2+]C1CCSCC1)[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000873259618 590013428 /nfs/dbraw/zinc/01/34/28/590013428.db2.gz IIGYYZGODVTDJB-LMKPVCQUSA-N 2 0 240.416 2.002 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccoc1 ZINC000873259504 590013549 /nfs/dbraw/zinc/01/35/49/590013549.db2.gz GAWPXXMDPHRNRJ-MHDGFBEUSA-N 2 0 234.343 2.461 20 0 BEADRP CC(C)[C@@H](C)[NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000873259962 590013597 /nfs/dbraw/zinc/01/35/97/590013597.db2.gz PNNRNRXGSKRFJY-FVCCEPFGSA-N 2 0 210.365 2.151 20 0 BEADRP CC[C@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)C1CC1 ZINC000873262733 590014017 /nfs/dbraw/zinc/01/40/17/590014017.db2.gz BRASZEVJAVINLD-GHYVTOPFSA-N 2 0 222.376 2.295 20 0 BEADRP CC[C@H]1CC[C@@H]1[NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000873262353 590014049 /nfs/dbraw/zinc/01/40/49/590014049.db2.gz XOQJQHRMAUQMFB-HPCHECBXSA-N 2 0 222.376 2.295 20 0 BEADRP CC[C@@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)C1CC1 ZINC000873262735 590014232 /nfs/dbraw/zinc/01/42/32/590014232.db2.gz BRASZEVJAVINLD-YXCITZCRSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCC12CCC2)C1CC[NH2+]CC1 ZINC000873269534 590015423 /nfs/dbraw/zinc/01/54/23/590015423.db2.gz RFCJVYCSNKIPGQ-DGCLKSJQSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCC12CCC2)C1CC[NH2+]CC1 ZINC000873269535 590015623 /nfs/dbraw/zinc/01/56/23/590015623.db2.gz RFCJVYCSNKIPGQ-YPMHNXCESA-N 2 0 222.376 2.297 20 0 BEADRP Cc1cc([C@@H](C)[NH2+][C@H](C)C2CC[NH2+]CC2)no1 ZINC000873269045 590015634 /nfs/dbraw/zinc/01/56/34/590015634.db2.gz KGMRNJDPDQHWRY-GHMZBOCLSA-N 2 0 237.347 2.022 20 0 BEADRP CC(C)[C@H]1CC[C@H]1[NH2+][C@@H](C)C1CC[NH2+]CC1 ZINC000873271524 590016109 /nfs/dbraw/zinc/01/61/09/590016109.db2.gz IZBGYNPVXJIYDI-IACUBPJLSA-N 2 0 224.392 2.399 20 0 BEADRP CC[C@H]([NH2+][C@H](C)C1CC[NH2+]CC1)[C@H]1C[C@H]1C ZINC000873270636 590016316 /nfs/dbraw/zinc/01/63/16/590016316.db2.gz YRHGFCWHUWIQHL-RFHZTLPTSA-N 2 0 224.392 2.399 20 0 BEADRP COc1ccccc1[C@@H](C)[NH2+][C@H](C)C[C@H](C)[NH3+] ZINC000873273588 590016618 /nfs/dbraw/zinc/01/66/18/590016618.db2.gz JATDGUDWOBOXPK-QJPTWQEYSA-N 2 0 236.359 2.472 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]CCC[C@H]1C=CCC1 ZINC000873282306 590018539 /nfs/dbraw/zinc/01/85/39/590018539.db2.gz SYOMZMQSLIKMDE-IHRRRGAJSA-N 2 0 222.376 2.450 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]Cc1cccc2ncccc12 ZINC000873282339 590018561 /nfs/dbraw/zinc/01/85/61/590018561.db2.gz CGSJKANKBVUZTQ-RYUDHWBXSA-N 2 0 243.354 2.450 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]Cc1cccc2ncccc12 ZINC000873282338 590019091 /nfs/dbraw/zinc/01/90/91/590019091.db2.gz CGSJKANKBVUZTQ-NWDGAFQWSA-N 2 0 243.354 2.450 20 0 BEADRP C[C@H]([NH2+]CCC[C@@H]1C=CCC1)[C@@H]1CCC[NH2+]1 ZINC000873282566 590019459 /nfs/dbraw/zinc/01/94/59/590019459.db2.gz VCSAGZCZLIQOIG-MJBXVCDLSA-N 2 0 222.376 2.463 20 0 BEADRP C[C@H]([NH2+]CCC[C@@H]1C=CCC1)[C@H]1CCC[NH2+]1 ZINC000873282560 590019586 /nfs/dbraw/zinc/01/95/86/590019586.db2.gz VCSAGZCZLIQOIG-BFHYXJOUSA-N 2 0 222.376 2.463 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]C1CC(Nc2ccccc2)C1 ZINC000873295291 590023959 /nfs/dbraw/zinc/02/39/59/590023959.db2.gz DZJCTGJEOGJGPX-CZWNDGCPSA-N 2 0 247.386 2.345 20 0 BEADRP CC(C)CC[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000019911844 590043810 /nfs/dbraw/zinc/04/38/10/590043810.db2.gz WYVJWBDNBSMTOB-UHFFFAOYSA-N 2 0 212.381 2.495 20 0 BEADRP CC[C@@H](C)[C@H](C)[NH2+]CCC[NH+]1CCCC1 ZINC000020129211 590075850 /nfs/dbraw/zinc/07/58/50/590075850.db2.gz FZLSSQOESNOILK-OLZOCXBDSA-N 2 0 212.381 2.497 20 0 BEADRP CC[C@H](C)[C@@H](C[NH2+]C[C@H]1CCCN1CC)OC ZINC000876882026 590252835 /nfs/dbraw/zinc/25/28/35/590252835.db2.gz XPVXHUXSDOATPF-BFHYXJOUSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1)[C@H]1CC1(F)F ZINC000877073697 590278235 /nfs/dbraw/zinc/27/82/35/590278235.db2.gz QRGYZRBQUYSKBE-WHOHXGKFSA-N 2 0 246.345 2.493 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1)[C@@H]1CC1(F)F ZINC000877073695 590278395 /nfs/dbraw/zinc/27/83/95/590278395.db2.gz QRGYZRBQUYSKBE-QCNOEVLYSA-N 2 0 246.345 2.493 20 0 BEADRP C[N@H+]1CC=C(C[NH2+]C[C@H]2CC2(Cl)Cl)CC1 ZINC000877137900 590291199 /nfs/dbraw/zinc/29/11/99/590291199.db2.gz FAZDRPBFTNJRFR-SNVBAGLBSA-N 2 0 249.185 2.032 20 0 BEADRP C[N@@H+]1CC[C@@H]2C[NH+](CC3(C)CCC3)CC[C@H]21 ZINC000877738383 590405528 /nfs/dbraw/zinc/40/55/28/590405528.db2.gz BIZNZLSLIKUGBS-CHWSQXEVSA-N 2 0 222.376 2.203 20 0 BEADRP CC(C)C1(C[N@@H+]2CC[C@H]3[C@@H](CC[NH+]3C)C2)CC1 ZINC000877738842 590406332 /nfs/dbraw/zinc/40/63/32/590406332.db2.gz MOAAABAGEOMOJB-KBPBESRZSA-N 2 0 236.403 2.449 20 0 BEADRP C=C/C=C/CC[NH+]1CCC(C[NH+](C)C)CC1 ZINC000877969775 590462552 /nfs/dbraw/zinc/46/25/52/590462552.db2.gz HMLYDALFATXAFH-AATRIKPKSA-N 2 0 222.376 2.392 20 0 BEADRP C=C/C=C/CC[N@H+]1CC[C@@H](C[NH+](C)C)C1 ZINC000878103598 590494832 /nfs/dbraw/zinc/49/48/32/590494832.db2.gz GMXBCEJXXFXAKP-GFUIURDCSA-N 2 0 208.349 2.002 20 0 BEADRP C[N@H+](CCCC1CC1)C[C@H]1CCC[NH+](C)C1 ZINC000878125582 590501488 /nfs/dbraw/zinc/50/14/88/590501488.db2.gz QIYJEAJBASUKKV-CQSZACIVSA-N 2 0 224.392 2.450 20 0 BEADRP C=C/C=C/CC[N@@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000878125829 590501767 /nfs/dbraw/zinc/50/17/67/590501767.db2.gz SFJWRLCOASDRLS-GJBLVYBDSA-N 2 0 222.376 2.392 20 0 BEADRP C=C/C=C\CC[NH+]1CC[C@H](C[N@@H+](C)CC)C1 ZINC000878167686 590514275 /nfs/dbraw/zinc/51/42/75/590514275.db2.gz XTAQYJGBDQPQLC-LMVHVUTASA-N 2 0 222.376 2.392 20 0 BEADRP Cc1conc1CN(C)CCCn1ccnc1C ZINC000878288001 590534001 /nfs/dbraw/zinc/53/40/01/590534001.db2.gz LORDBCQGKVSOQQ-UHFFFAOYSA-N 2 0 248.330 2.010 20 0 BEADRP CC[C@H](C)[N@@H+]1CCN(c2cc[nH+]cc2)[C@H](C)C1 ZINC000880258905 590979371 /nfs/dbraw/zinc/97/93/71/590979371.db2.gz DTDKOFKGIJKAIV-QWHCGFSZSA-N 2 0 233.359 2.391 20 0 BEADRP CCCC[N@@H+]1CCN(c2cc[nH+]cc2)[C@H](C)C1 ZINC000880262604 590980226 /nfs/dbraw/zinc/98/02/26/590980226.db2.gz QELUMYRJUPIPRU-CYBMUJFWSA-N 2 0 233.359 2.392 20 0 BEADRP Fc1ccc(CC[NH2+][C@H]2CCC[NH2+]CC2)cc1 ZINC000128840750 591167663 /nfs/dbraw/zinc/16/76/63/591167663.db2.gz ILBDOZGYUNRNRH-AWEZNQCLSA-N 2 0 236.334 2.100 20 0 BEADRP c1ccc2c(c1)CC[C@@H]2[NH2+][C@H]1CCC[NH2+]CC1 ZINC000128895791 591176674 /nfs/dbraw/zinc/17/66/74/591176674.db2.gz NAURYGMRUPFCLB-ZFWWWQNUSA-N 2 0 230.355 2.406 20 0 BEADRP C[C@H]1[C@H]([NH2+]C2CC2)CCN1Cc1ccccc1 ZINC000211491363 591177606 /nfs/dbraw/zinc/17/76/06/591177606.db2.gz ZTHHDIVOPLDQQO-SWLSCSKDSA-N 2 0 230.355 2.401 20 0 BEADRP c1ccc2c(c1)OCC[C@H]2[NH2+][C@H]1CCC[NH2+]CC1 ZINC000129046370 591224767 /nfs/dbraw/zinc/22/47/67/591224767.db2.gz YWETUUGZXQICEB-GXTWGEPZSA-N 2 0 246.354 2.242 20 0 BEADRP COCc1ccccc1C[NH2+][C@H]1CCC[NH2+]CC1 ZINC000129126098 591259774 /nfs/dbraw/zinc/25/97/74/591259774.db2.gz HWHDITNRUWIOBL-HNNXBMFYSA-N 2 0 248.370 2.065 20 0 BEADRP Cc1ncnc(NCC2([NH+](C)C)CCCC2)c1C ZINC000881800186 591271769 /nfs/dbraw/zinc/27/17/69/591271769.db2.gz SRDBKRCCGYPTOQ-UHFFFAOYSA-N 2 0 248.374 2.380 20 0 BEADRP Cc1c[nH+]ccc1N1CCC(C)([NH+]2CCC2)CC1 ZINC000882963110 591486835 /nfs/dbraw/zinc/48/68/35/591486835.db2.gz OACLKQRCADIVOK-UHFFFAOYSA-N 2 0 245.370 2.455 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C[C@@H]2C=CCC2)[C@@H]2CCC[C@H]21 ZINC000883245585 591585723 /nfs/dbraw/zinc/58/57/23/591585723.db2.gz NYJLBENQQMZIOY-CBBWQLFWSA-N 2 0 234.387 2.415 20 0 BEADRP CCN1CC[C@@H]1C[NH2+][C@H](C)CCC1CC1 ZINC000883355316 591625890 /nfs/dbraw/zinc/62/58/90/591625890.db2.gz OEQGGBSREGOLJZ-DGCLKSJQSA-N 2 0 210.365 2.249 20 0 BEADRP C=C/C=C/CC[N@H+](C1CC1)C1CC[NH2+]CC1 ZINC000883415764 591652277 /nfs/dbraw/zinc/65/22/77/591652277.db2.gz DMPPJOIDAIIIDZ-ONEGZZNKSA-N 2 0 220.360 2.335 20 0 BEADRP [NH3+]C1CC[NH+](CC[C@@H]2CCCC2(F)F)CC1 ZINC000883414959 591652675 /nfs/dbraw/zinc/65/26/75/591652675.db2.gz KIZKGIBHRDLRRJ-JTQLQIEISA-N 2 0 232.318 2.235 20 0 BEADRP [NH3+][C@@H]1CCCN(CC[C@H]2CCCC2(F)F)C1 ZINC000883415814 591652969 /nfs/dbraw/zinc/65/29/69/591652969.db2.gz FOJPERARWAISLY-GHMZBOCLSA-N 2 0 232.318 2.235 20 0 BEADRP [NH3+]C[C@H]1CC[N@H+](CC[C@H]2CCCC2(F)F)C1 ZINC000883417168 591653006 /nfs/dbraw/zinc/65/30/06/591653006.db2.gz PUBFCCGRABVPQD-GHMZBOCLSA-N 2 0 232.318 2.093 20 0 BEADRP Cc1ccccc1C1(NC[C@@H]2C[C@H](F)C[NH2+]2)CC1 ZINC000883434091 591664713 /nfs/dbraw/zinc/66/47/13/591664713.db2.gz GQSDAOFMDBKURE-STQMWFEESA-N 2 0 248.345 2.274 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]CC2CCOCC2)c2ccccc21 ZINC000132112046 591687962 /nfs/dbraw/zinc/68/79/62/591687962.db2.gz VHXCYVVKDQKBIP-GJZGRUSLSA-N 2 0 246.354 2.147 20 0 BEADRP C[C@H]1SCC[N@H+](CCCCCC[NH3+])[C@H]1C ZINC000132463504 591709739 /nfs/dbraw/zinc/70/97/39/591709739.db2.gz VTWGLIPVOOXWIY-NWDGAFQWSA-N 2 0 230.421 2.331 20 0 BEADRP C[C@@H]1SCC[N@H+](CCCCCC[NH3+])[C@H]1C ZINC000132463114 591710244 /nfs/dbraw/zinc/71/02/44/591710244.db2.gz VTWGLIPVOOXWIY-RYUDHWBXSA-N 2 0 230.421 2.331 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]Cc2ccc(CC[NH3+])cc2)C1 ZINC000133100999 591765148 /nfs/dbraw/zinc/76/51/48/591765148.db2.gz YRECSQCWAXJVOH-DOMZBBRYSA-N 2 0 232.371 2.466 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(CC[NH3+])cc2)C1 ZINC000133101357 591765517 /nfs/dbraw/zinc/76/55/17/591765517.db2.gz YRECSQCWAXJVOH-IUODEOHRSA-N 2 0 232.371 2.466 20 0 BEADRP CCc1nccc(NCC[C@H]2CCC[N@H+](C)C2)n1 ZINC000884528473 591967665 /nfs/dbraw/zinc/96/76/65/591967665.db2.gz PUJCVHOXZCTKMD-GFCCVEGCSA-N 2 0 248.374 2.183 20 0 BEADRP C[C@@H](C[NH3+])N(C)Cc1cccc2cccnc21 ZINC000135295833 592003909 /nfs/dbraw/zinc/00/39/09/592003909.db2.gz HOVDLXJYPWNAPE-NSHDSACASA-N 2 0 229.327 2.014 20 0 BEADRP Cc1coc(C[NH2+]CC[C@@H]2CCC[N@@H+](C)C2)c1 ZINC000886142509 592162693 /nfs/dbraw/zinc/16/26/93/592162693.db2.gz DRDDWUTWAYEQBX-ZDUSSCGKSA-N 2 0 236.359 2.410 20 0 BEADRP CC[NH+](CC)CCC[N@@H+]1C[C@@H]2CSC[C@@H]2C1 ZINC000886568121 592261737 /nfs/dbraw/zinc/26/17/37/592261737.db2.gz APTWHSGIUWENME-BETUJISGSA-N 2 0 242.432 2.013 20 0 BEADRP [NH3+]C1CCC([NH2+]Cc2ncc(Cl)s2)CC1 ZINC000220816842 592357020 /nfs/dbraw/zinc/35/70/20/592357020.db2.gz YFZCSNFHJAFJCO-UHFFFAOYSA-N 2 0 245.779 2.156 20 0 BEADRP C(CN1CCC[C@H]2[NH2+]CC[C@H]21)[C@@H]1C[C@H]1C1CC1 ZINC000886841245 592359730 /nfs/dbraw/zinc/35/97/30/592359730.db2.gz GBRUATQVOPNFJZ-LXTVHRRPSA-N 2 0 234.387 2.249 20 0 BEADRP C[C@@H](Cc1cccc(F)c1)[NH2+]CCC[NH+](C)C ZINC000221705715 592440523 /nfs/dbraw/zinc/44/05/23/592440523.db2.gz NCBCTMVMIMSXCE-LBPRGKRZSA-N 2 0 238.350 2.298 20 0 BEADRP [NH3+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C[C@H]1CCSC1 ZINC000300230370 592505406 /nfs/dbraw/zinc/50/54/06/592505406.db2.gz XQAXZPDYJYRJCR-ODWCKFRGSA-N 2 0 240.416 2.084 20 0 BEADRP CC(C)=CCC[C@@H](C)[NH2+]CCSCC[NH3+] ZINC001258083877 990981486 /nfs/dbraw/zinc/98/14/86/990981486.db2.gz OJRAFEDJBFXPFP-GFCCVEGCSA-N 2 0 230.421 2.403 20 0 BEADRP CCc1ccc(C[N@@H+]2CC[C@H](CC[NH3+])C2)cc1 ZINC000125545432 634539689 /nfs/dbraw/zinc/53/96/89/634539689.db2.gz NEPNKNBNGJSGHB-HNNXBMFYSA-N 2 0 232.371 2.420 20 0 BEADRP CC[C@H]([NH2+]C[C@H]1C=CCC1)[C@H]1CCCC[NH2+]1 ZINC000925733162 634575423 /nfs/dbraw/zinc/57/54/23/634575423.db2.gz SXHHWQUMKHYJOP-MELADBBJSA-N 2 0 222.376 2.463 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CC1(C)CC(F)(F)C1 ZINC000925733862 634581483 /nfs/dbraw/zinc/58/14/83/634581483.db2.gz LVDDKGSWUGKXRV-BDAKNGLRSA-N 2 0 220.307 2.137 20 0 BEADRP CC1(C[NH2+][C@@H]2CC[NH2+]C23CCC3)CC(F)(F)C1 ZINC000925733855 634583169 /nfs/dbraw/zinc/58/31/69/634583169.db2.gz LPTORYLZGLNKQC-SNVBAGLBSA-N 2 0 244.329 2.296 20 0 BEADRP CC[C@H]([NH2+]CCC(C)(C)[NH3+])c1ccncc1 ZINC000925736484 634590441 /nfs/dbraw/zinc/59/04/41/634590441.db2.gz AJFZJEHXWOFFFV-LBPRGKRZSA-N 2 0 221.348 2.250 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H]1C[NH2+]C[C@H]1C)C1CCC1 ZINC000925783978 635295139 /nfs/dbraw/zinc/29/51/39/635295139.db2.gz HICKGGILJZQLOM-KGYLQXTDSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]1C[C@H]1[C@@H]1C[C@H]1[NH2+][C@@H]1CC[NH2+]C12CCCC2 ZINC000925824393 635411677 /nfs/dbraw/zinc/41/16/77/635411677.db2.gz SKACZQRCZKZPRZ-RKQHYHRCSA-N 2 0 234.387 2.295 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+]CCC1CC=CC1 ZINC000925829857 635461983 /nfs/dbraw/zinc/46/19/83/635461983.db2.gz AGTHMORLJRSJFO-LBPRGKRZSA-N 2 0 208.349 2.073 20 0 BEADRP C[NH+]1CCC(C[NH2+]CCC2=CCCC2)CC1 ZINC000228588128 635463083 /nfs/dbraw/zinc/46/30/83/635463083.db2.gz HDGGIEDIAINVEG-UHFFFAOYSA-N 2 0 222.376 2.418 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C2CCC([NH3+])CC2)CCS1 ZINC000925861807 635556136 /nfs/dbraw/zinc/55/61/36/635556136.db2.gz STLQXENCRTXOOJ-YYJSSNLHSA-N 2 0 228.405 2.130 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCS[C@@H](C)C1)[C@@H]1CCC[NH2+]1 ZINC000925860901 635557484 /nfs/dbraw/zinc/55/74/84/635557484.db2.gz LWFLKOXAVNMZJQ-RNJOBUHISA-N 2 0 242.432 2.391 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]C[C@]12C[C@H]1CCC2 ZINC000925880492 635608908 /nfs/dbraw/zinc/60/89/08/635608908.db2.gz LPGIDAXFXOWDQZ-XQQFMLRXSA-N 2 0 210.365 2.284 20 0 BEADRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]CC1CCC=CCC1 ZINC000925882141 635610601 /nfs/dbraw/zinc/61/06/01/635610601.db2.gz XOPSCLFYSLDVBU-KGLIPLIRSA-N 2 0 222.376 2.450 20 0 BEADRP CC(C)([NH3+])CC[NH2+]Cc1ccc(F)cc1 ZINC000258896119 631669629 /nfs/dbraw/zinc/66/96/29/631669629.db2.gz LTQHALSTFYUGJH-UHFFFAOYSA-N 2 0 210.296 2.043 20 0 BEADRP C[C@@H]1[C@@H](C)CC[N@@H+]1CC1CC[NH+](C)CC1 ZINC000892212797 631788105 /nfs/dbraw/zinc/78/81/05/631788105.db2.gz UMCXTCYVOLKYRG-NWDGAFQWSA-N 2 0 210.365 2.059 20 0 BEADRP CCCC[NH+]1CCC([NH2+]C2CCC2)CC1 ZINC000044481658 631817657 /nfs/dbraw/zinc/81/76/57/631817657.db2.gz ZTWSJGSLNZXKMA-UHFFFAOYSA-N 2 0 210.365 2.393 20 0 BEADRP CC[C@H](c1ccccc1)[N@@H+]1CC[C@@H](C[NH3+])C1 ZINC000224195971 632008198 /nfs/dbraw/zinc/00/81/98/632008198.db2.gz DQIKBATVYWXJMY-GXTWGEPZSA-N 2 0 218.344 2.418 20 0 BEADRP CS[C@@H]1CCC[C@@H]([NH2+]CCC[NH+](C)C)C1 ZINC000235116759 632008223 /nfs/dbraw/zinc/00/82/23/632008223.db2.gz MGLKCEMYSKLBBO-VXGBXAGGSA-N 2 0 230.421 2.202 20 0 BEADRP CC[C@@H]1CCC[N@@H+]1CC[C@@H]1CCC[NH2+]C1 ZINC000051919085 632012803 /nfs/dbraw/zinc/01/28/03/632012803.db2.gz XXHXHORAPOSYLZ-QWHCGFSZSA-N 2 0 210.365 2.251 20 0 BEADRP C[N@@H+](Cc1ccccc1F)C[C@@H]1CC[C@H]([NH3+])C1 ZINC000091544808 632069021 /nfs/dbraw/zinc/06/90/21/632069021.db2.gz VDQIPAVMHKRSTJ-YPMHNXCESA-N 2 0 236.334 2.385 20 0 BEADRP C[C@@H]1CCC[C@@H](C[N@@H+]2CC[C@@H](CC[NH3+])C2)C1 ZINC000309480282 632420425 /nfs/dbraw/zinc/42/04/25/632420425.db2.gz WNQIBEFJYSKGLK-MGPQQGTHSA-N 2 0 224.392 2.483 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@H]1CCC(C)(C)C1 ZINC000235268457 632600136 /nfs/dbraw/zinc/60/01/36/632600136.db2.gz BXCQXXAYDAQSFU-WOPDTQHZSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@H]1CC[C@@H]1[NH2+]CC(C)(C)C[NH+]1CCCC1 ZINC000309761839 632667760 /nfs/dbraw/zinc/66/77/60/632667760.db2.gz IVMRXQJOHKBYEF-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[C@H](C[NH2+]C2(C)CCCC2)CC[NH2+]1 ZINC000235370236 632678777 /nfs/dbraw/zinc/67/87/77/632678777.db2.gz WWYNKOJFJWMGOR-VXGBXAGGSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2CC[C@@H](C)[C@@H](C)C2)CC[NH2+]1 ZINC000235369385 632680539 /nfs/dbraw/zinc/68/05/39/632680539.db2.gz ARXCWQRKBJWRAI-XJFOESAGSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2CCSC(C)(C)C2)CC[NH2+]1 ZINC000235369075 632680587 /nfs/dbraw/zinc/68/05/87/632680587.db2.gz SIMNHEALXOFQPG-VXGBXAGGSA-N 2 0 242.432 2.202 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+]Cc1ccc(CC[NH3+])cc1 ZINC000310387640 632734470 /nfs/dbraw/zinc/73/44/70/632734470.db2.gz QTOVLNWYEUZMKH-AWEZNQCLSA-N 2 0 232.371 2.466 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]CC[C@@H]2CCOC2)c2ccccc21 ZINC000236302532 632914938 /nfs/dbraw/zinc/91/49/38/632914938.db2.gz TWKVMURXPCOGGI-KCPJHIHWSA-N 2 0 246.354 2.147 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[N@@H+]2CCC3(CCCC3)C2)C1 ZINC000304391480 635940278 /nfs/dbraw/zinc/94/02/78/635940278.db2.gz MQILDFYEMHXNOG-QWHCGFSZSA-N 2 0 222.376 2.380 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@@H](CC[NH3+])C2)cc1C ZINC000125534886 636024515 /nfs/dbraw/zinc/02/45/15/636024515.db2.gz MPGIDDMOXZUUOS-CQSZACIVSA-N 2 0 232.371 2.474 20 0 BEADRP C[C@@H]([NH2+]CC[C@H](C)[NH+](C)C)C1CC(F)(F)C1 ZINC000895291032 636131987 /nfs/dbraw/zinc/13/19/87/636131987.db2.gz YQDMKQXVHUGFLS-VHSXEESVSA-N 2 0 234.334 2.350 20 0 BEADRP CCC(CC)C[NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2 ZINC000328471692 633768005 /nfs/dbraw/zinc/76/80/05/633768005.db2.gz ADXJWOYQMHSVQI-YHQUGGNUSA-N 2 0 222.376 2.009 20 0 BEADRP CCC[C@H](CC)[NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23 ZINC000328522012 633771402 /nfs/dbraw/zinc/77/14/02/633771402.db2.gz HLFORLNECHWHLP-XNBXPENISA-N 2 0 222.376 2.151 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23 ZINC000328566134 633775196 /nfs/dbraw/zinc/77/51/96/633775196.db2.gz MKQBBMCWFBZSNM-ISCIKXKRSA-N 2 0 222.376 2.007 20 0 BEADRP C[C@H]1C[C@H]([NH2+][C@@H]2[C@H]3C[C@H]4C[NH2+][C@H]2[C@H]4C3)C[C@@H](C)C1 ZINC000328576961 633778293 /nfs/dbraw/zinc/77/82/93/633778293.db2.gz ZSFZWHFUHQUNMY-ZGNUMKAHSA-N 2 0 248.414 2.397 20 0 BEADRP CSC[C@H](C)[NH2+][C@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C ZINC000925502357 633826102 /nfs/dbraw/zinc/82/61/02/633826102.db2.gz GVEBZRFFQQYYCC-USZNOCQGSA-N 2 0 242.432 2.104 20 0 BEADRP CC[NH+]1CCC(CC[NH2+][C@H]2CC[C@@H]2C)CC1 ZINC000309942831 633967023 /nfs/dbraw/zinc/96/70/23/633967023.db2.gz CFZWYWZYOWWPDW-JSGCOSHPSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@]1(C[NH2+][C@@H]2CC[NH2+]C23CCC3)CCCS1 ZINC000925550818 633996325 /nfs/dbraw/zinc/99/63/25/633996325.db2.gz CPIVJEBWGWFTPR-NEPJUHHUSA-N 2 0 240.416 2.146 20 0 BEADRP CC1(C[NH2+][C@H]2C[C@H]([NH3+])CC(C)(C)C2)CC1 ZINC000925576693 634076714 /nfs/dbraw/zinc/07/67/14/634076714.db2.gz MBCLOXREKHVDET-QWRGUYRKSA-N 2 0 210.365 2.282 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CC3CCC2CC3)C1 ZINC000310169252 634083412 /nfs/dbraw/zinc/08/34/12/634083412.db2.gz OZIRMGBPYVHIBX-HXSCFSKGSA-N 2 0 236.403 2.497 20 0 BEADRP CS[C@H](C)C[NH2+][C@@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925588610 634100684 /nfs/dbraw/zinc/10/06/84/634100684.db2.gz YHJRDOBRVCXPLM-OUAUKWLOSA-N 2 0 230.421 2.234 20 0 BEADRP CO[C@@H](C)C[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000925646289 634203001 /nfs/dbraw/zinc/20/30/01/634203001.db2.gz UWMOGFHKICNCJL-GXTWGEPZSA-N 2 0 236.359 2.091 20 0 BEADRP CSC1(C[NH2+][C@H]2CC[NH2+]C23CCCC3)CC1 ZINC000925654701 634215664 /nfs/dbraw/zinc/21/56/64/634215664.db2.gz BQKZLMOLZARQIP-NSHDSACASA-N 2 0 240.416 2.146 20 0 BEADRP CSC1(C[NH2+][C@@H]2C[C@H]([NH3+])CC(C)(C)C2)CC1 ZINC000925657296 634219780 /nfs/dbraw/zinc/21/97/80/634219780.db2.gz MOCRTJLLMOCJIA-WDEREUQCSA-N 2 0 242.432 2.378 20 0 BEADRP CSC1(C[NH2+][C@H]2C[C@@H]([NH3+])CC(C)(C)C2)CC1 ZINC000925657294 634221227 /nfs/dbraw/zinc/22/12/27/634221227.db2.gz MOCRTJLLMOCJIA-MNOVXSKESA-N 2 0 242.432 2.378 20 0 BEADRP CC(F)(F)CC[NH2+][C@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C ZINC000925677855 634269751 /nfs/dbraw/zinc/26/97/51/634269751.db2.gz BFRCELXKOFUDPW-VWYCJHECSA-N 2 0 246.345 2.398 20 0 BEADRP CC[C@@H]1CCC[C@@H]1C[NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23 ZINC000925679691 634275701 /nfs/dbraw/zinc/27/57/01/634275701.db2.gz LSAJYYOZZABUFH-GBIHRFPISA-N 2 0 248.414 2.399 20 0 BEADRP C[C@@H]([NH2+][C@H]1C[C@H]([NH3+])CC(C)(C)C1)C1CC1 ZINC000925679434 634275714 /nfs/dbraw/zinc/27/57/14/634275714.db2.gz CGQORXPWNNTIAZ-USWWRNFRSA-N 2 0 210.365 2.281 20 0 BEADRP CC[C@@H]1CCC[C@@H]1C[NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2 ZINC000925679692 634276203 /nfs/dbraw/zinc/27/62/03/634276203.db2.gz LSAJYYOZZABUFH-KDELZDPKSA-N 2 0 248.414 2.399 20 0 BEADRP CC/C=C/C[NH2+][C@@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925682145 634285142 /nfs/dbraw/zinc/28/51/42/634285142.db2.gz UDDHKBIFAICJPP-CYLBZQBVSA-N 2 0 210.365 2.448 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+][C@H]2CCC[C@@H]3C[C@@H]32)C12CCC2 ZINC000925686912 634300203 /nfs/dbraw/zinc/30/02/03/634300203.db2.gz XNFASBSKGYGBIK-SJHCENCUSA-N 2 0 220.360 2.035 20 0 BEADRP CC(C)[NH2+]CCCN[C@H](c1ccccc1)[C@H](C)[NH3+] ZINC000925695259 634346022 /nfs/dbraw/zinc/34/60/22/634346022.db2.gz VBASZSGIUZCEJP-ZFWWWQNUSA-N 2 0 249.402 2.053 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2C[C@@H]([NH3+])CC(C)(C)C2)CS1 ZINC000925697069 634360349 /nfs/dbraw/zinc/36/03/49/634360349.db2.gz MJXVSZGAXTYEFO-WYUUTHIRSA-N 2 0 242.432 2.376 20 0 BEADRP CC(C)[C@@H](Cc1ccccc1)[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000925768161 635188827 /nfs/dbraw/zinc/18/88/27/635188827.db2.gz TVEPVVXCBNZBJL-XJKSGUPXSA-N 2 0 246.398 2.451 20 0 BEADRP COc1ccc(C)cc1C[NH2+]CCC(C)(C)[NH3+] ZINC000258859200 635215413 /nfs/dbraw/zinc/21/54/13/635215413.db2.gz IPHBXUUUNFIJQU-UHFFFAOYSA-N 2 0 236.359 2.221 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[NH2+]C[C@H]1C)[C@@H]1CCCC[C@H]1C ZINC000925783646 635292172 /nfs/dbraw/zinc/29/21/72/635292172.db2.gz KOCIZMIMSLXSNA-DHGKCCLASA-N 2 0 224.392 2.399 20 0 BEADRP CC[C@@H]1CCCC[C@H]1[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000925783759 635293824 /nfs/dbraw/zinc/29/38/24/635293824.db2.gz GSSOXVKQIXDYML-YIYPIFLZSA-N 2 0 224.392 2.400 20 0 BEADRP Cc1ccc(C)c(C[N@@H+]2CC[C@@H]([NH3+])[C@H](C)C2)c1 ZINC000094338884 635298712 /nfs/dbraw/zinc/29/87/12/635298712.db2.gz CNATUTXXMAPJHG-UKRRQHHQSA-N 2 0 232.371 2.473 20 0 BEADRP C[C@H]1Cc2ccccc2[C@@H]1[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000925790321 635314983 /nfs/dbraw/zinc/31/49/83/635314983.db2.gz GZEZJDSULBHEIV-CQJJVWNLSA-N 2 0 244.382 2.365 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+][C@H]1CCC[C@@H]1CCF ZINC000925802034 635350804 /nfs/dbraw/zinc/35/08/04/635350804.db2.gz CSBOJYVVRFBUGR-SYQHCUMBSA-N 2 0 242.382 2.350 20 0 BEADRP C[NH+]1CCC(C[NH+]2CC(C3CCCC3)C2)CC1 ZINC000894835878 635944849 /nfs/dbraw/zinc/94/48/49/635944849.db2.gz MBFALBPWJDELJT-UHFFFAOYSA-N 2 0 236.403 2.450 20 0 BEADRP C[NH+]1CCC(C[NH2+]C[C@@H]2Cc3ccccc32)CC1 ZINC000054242784 636238458 /nfs/dbraw/zinc/23/84/58/636238458.db2.gz KTEREGXZTVVUGY-HNNXBMFYSA-N 2 0 244.382 2.258 20 0 BEADRP C[NH+]1CCC(C[NH2+]C[C@H]2Cc3ccccc32)CC1 ZINC000054242785 636240307 /nfs/dbraw/zinc/24/03/07/636240307.db2.gz KTEREGXZTVVUGY-OAHLLOKOSA-N 2 0 244.382 2.258 20 0 BEADRP CC[N@H+](C)C[C@@H]1CC[NH+](CC2CC(F)(F)C2)C1 ZINC000450470906 636443120 /nfs/dbraw/zinc/44/31/20/636443120.db2.gz JJHLYVGQHMITLB-NSHDSACASA-N 2 0 246.345 2.305 20 0 BEADRP C[N@H+](CCC1C[C@H]2CC[C@@H](C1)[NH2+]2)C1CCC1 ZINC000127503198 636591269 /nfs/dbraw/zinc/59/12/69/636591269.db2.gz OSCKYWUOTSTRNE-YHWZYXNKSA-N 2 0 222.376 2.391 20 0 BEADRP C[C@H]1CCC[N@H+](CCC[NH2+]C2CC2)[C@H]1C ZINC000252175613 636780379 /nfs/dbraw/zinc/78/03/79/636780379.db2.gz OXFMRIAUDDFZDK-RYUDHWBXSA-N 2 0 210.365 2.249 20 0 BEADRP Cc1ccccc1C[NH2+][C@@H]1CCC[C@@H]1C[NH3+] ZINC000084219922 636875231 /nfs/dbraw/zinc/87/52/31/636875231.db2.gz BMHLNQXEHZJINE-TZMCWYRMSA-N 2 0 218.344 2.212 20 0 BEADRP C[N@H+](CC[C@@H]1CC[NH2+]C1)Cc1ccccc1 ZINC000084384487 636875625 /nfs/dbraw/zinc/87/56/25/636875625.db2.gz FMLJZRITSJKSAH-ZDUSSCGKSA-N 2 0 218.344 2.118 20 0 BEADRP Cc1ccccc1C[NH2+][C@H]1CCC[C@@H]1C[NH3+] ZINC000084219926 636875841 /nfs/dbraw/zinc/87/58/41/636875841.db2.gz BMHLNQXEHZJINE-OCCSQVGLSA-N 2 0 218.344 2.212 20 0 BEADRP CC(C)(C)C[NH2+]CCC[NH+]1CCCCC1 ZINC000041051164 636959732 /nfs/dbraw/zinc/95/97/32/636959732.db2.gz JJJDSTJHFJFWEC-UHFFFAOYSA-N 2 0 212.381 2.498 20 0 BEADRP C[C@@H]1C[C@H]2CCCC[C@H]2[N@@H+]1C[C@H]1CCC[NH2+]1 ZINC000903436751 637360066 /nfs/dbraw/zinc/36/00/66/637360066.db2.gz BFWRXEQQTZLPQR-AAVRWANBSA-N 2 0 222.376 2.391 20 0 BEADRP C[C@@H]1C[C@@H]2CCCC[C@H]2[N@@H+]1C[C@@H]1C[NH2+]C[C@H]1C ZINC000903437850 637362263 /nfs/dbraw/zinc/36/22/63/637362263.db2.gz NQGPBMOGAPQCIK-NIFZNCRKSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@H+]1C[C@@H](C)C(F)(F)[C@@H](C)C1 ZINC000903464821 637362357 /nfs/dbraw/zinc/36/23/57/637362357.db2.gz XYGKRIADMQHBKQ-WYUUTHIRSA-N 2 0 246.345 2.065 20 0 BEADRP [NH3+]CCC[NH2+][C@H]1CC2(CCC2)Oc2ccccc21 ZINC000903565231 637370949 /nfs/dbraw/zinc/37/09/49/637370949.db2.gz HCBGIMOHRLSKJY-ZDUSSCGKSA-N 2 0 246.354 2.371 20 0 BEADRP [NH3+]CCC[NH2+][C@@H]1CC2(CCC2)Oc2ccccc21 ZINC000903565230 637372430 /nfs/dbraw/zinc/37/24/30/637372430.db2.gz HCBGIMOHRLSKJY-CYBMUJFWSA-N 2 0 246.354 2.371 20 0 BEADRP C[C@H]1C[NH2+]C[C@H](Nc2ccc(C(C)(C)[NH3+])cc2)C1 ZINC000904475573 637425058 /nfs/dbraw/zinc/42/50/58/637425058.db2.gz LWBLEWDPHKYMQN-BXUZGUMPSA-N 2 0 247.386 2.290 20 0 BEADRP CC(C)c1ccc(C[NH2+][C@H]2C[C@H]([NH3+])C2)cc1 ZINC000906507801 638178696 /nfs/dbraw/zinc/17/86/96/638178696.db2.gz CQJUIZHICWJBDA-HDJSIYSDSA-N 2 0 218.344 2.389 20 0 BEADRP C[C@@H](CCc1ccccc1)C[NH2+]C1CC([NH3+])C1 ZINC000906510786 638183013 /nfs/dbraw/zinc/18/30/13/638183013.db2.gz XDDSTAHYIAENGA-GRTSSRMGSA-N 2 0 232.371 2.335 20 0 BEADRP Cc1ccc2cc(C[NH2+]C3CC([NH3+])C3)ccc2n1 ZINC000906509957 638184002 /nfs/dbraw/zinc/18/40/02/638184002.db2.gz FQLQWNVABWJSFU-UHFFFAOYSA-N 2 0 241.338 2.123 20 0 BEADRP [NH3+]C1CC([NH2+]Cc2cc3ccccc3s2)C1 ZINC000906510186 638184065 /nfs/dbraw/zinc/18/40/65/638184065.db2.gz QEDCKVNIZORFBC-UHFFFAOYSA-N 2 0 232.352 2.481 20 0 BEADRP Cc1cc(Cl)ccc1C[NH2+]C1CC([NH3+])C1 ZINC000906510735 638184211 /nfs/dbraw/zinc/18/42/11/638184211.db2.gz TWTSUHABYVTYJH-UHFFFAOYSA-N 2 0 224.735 2.228 20 0 BEADRP [NH3+]C1CC([NH2+][C@H]2CC[C@H](Cc3ccccc3)C2)C1 ZINC000906511066 638184492 /nfs/dbraw/zinc/18/44/92/638184492.db2.gz RTHCOXLWLZVHKK-CIDNJEQPSA-N 2 0 244.382 2.477 20 0 BEADRP [NH3+]C1CC([NH2+]Cc2ccc(C3CC3)cc2)C1 ZINC000906511476 638185833 /nfs/dbraw/zinc/18/58/33/638185833.db2.gz WAPAIPAADONVST-UHFFFAOYSA-N 2 0 216.328 2.143 20 0 BEADRP CC[C@H]1CCC[C@H](C[NH2+][C@H]2C[C@H]([NH3+])C2)C1 ZINC000906517738 638187547 /nfs/dbraw/zinc/18/75/47/638187547.db2.gz OKGWCNLKCSITTF-CYDGBPFRSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)C(N)=[NH+]OCC[C@@H]1CCCC[N@@H+]1C ZINC000906502962 638196711 /nfs/dbraw/zinc/19/67/11/638196711.db2.gz LYYCZRBMNNGEML-NSHDSACASA-N 2 0 227.352 2.015 20 0 BEADRP CCCC[NH2+][C@@H](C)CN(CC)CCC ZINC000906532059 638199734 /nfs/dbraw/zinc/19/97/34/638199734.db2.gz XUPJRZYXCFTNQZ-LBPRGKRZSA-N 2 0 200.370 2.497 20 0 BEADRP CC1CC(C[N@@H+]2CC[C@@]3(C2)CCC[NH+](C)C3)C1 ZINC000930576022 639812952 /nfs/dbraw/zinc/81/29/52/639812952.db2.gz GZHCHLOLNFKVBK-NRXISQOPSA-N 2 0 236.403 2.450 20 0 BEADRP C[C@@H]([NH3+])c1ccc(NC(=O)CC(C)(C)C[NH3+])cc1 ZINC000911846309 639857284 /nfs/dbraw/zinc/85/72/84/639857284.db2.gz MWVAYEVRCCEBAP-SNVBAGLBSA-N 2 0 249.358 2.020 20 0 BEADRP CCCCC[N@@H+]1C[C@@]2(C)CN(C)C[C@@]2(C)C1 ZINC000931311366 640147934 /nfs/dbraw/zinc/14/79/34/640147934.db2.gz OPJROCNOYBXHCF-OKILXGFUSA-N 2 0 224.392 2.450 20 0 BEADRP Cc1ccc(C[NH+]2C[C@H]3CC[N@@H+](C)C[C@H]3C2)cc1 ZINC000931432085 640199134 /nfs/dbraw/zinc/19/91/34/640199134.db2.gz HTJVERRCOJJWKD-CVEARBPZSA-N 2 0 244.382 2.379 20 0 BEADRP C[C@@H](c1cccnc1)[N@@H+]1C[C@@H]2CC[NH+](C)C[C@@H]2C1 ZINC000931433427 640201757 /nfs/dbraw/zinc/20/17/57/640201757.db2.gz BOAKPLVMAMDKDZ-AEGPPILISA-N 2 0 245.370 2.026 20 0 BEADRP CC[C@@H]1C[C@H]1CN1CC[C@H]2[C@H](CC[N@@H+]2C)C1 ZINC000931545805 640267545 /nfs/dbraw/zinc/26/75/45/640267545.db2.gz GJPZUCFKFZDNSZ-MQYQWHSLSA-N 2 0 222.376 2.059 20 0 BEADRP C[C@H](C1CC1)[N@@H+]1CCN(c2cc[nH+]cc2)[C@@H](C)C1 ZINC000931683202 640313379 /nfs/dbraw/zinc/31/33/79/640313379.db2.gz HKVUHGNJNLWFCL-QWHCGFSZSA-N 2 0 245.370 2.391 20 0 BEADRP C[C@@H](C1CC1)[N@@H+]1CCN(c2cc[nH+]cc2)[C@H](C)C1 ZINC000931683201 640314032 /nfs/dbraw/zinc/31/40/32/640314032.db2.gz HKVUHGNJNLWFCL-OLZOCXBDSA-N 2 0 245.370 2.391 20 0 BEADRP C[NH+]1CCC(C[NH2+]CC2CCCCC2)CC1 ZINC000044515399 640399844 /nfs/dbraw/zinc/39/98/44/640399844.db2.gz RSLRKUPLZDHFOH-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP COc1ccc(C[N@H+](C)C2CCC([NH3+])CC2)cc1 ZINC000055144473 640439091 /nfs/dbraw/zinc/43/90/91/640439091.db2.gz KUILPUHTGXUHJK-UHFFFAOYSA-N 2 0 248.370 2.397 20 0 BEADRP CSCC[C@@H](C)[N@H+](C)C[C@@]1(C)CCC[NH2+]C1 ZINC000222341551 640482224 /nfs/dbraw/zinc/48/22/24/640482224.db2.gz CITRJNVQDBHUGK-OLZOCXBDSA-N 2 0 244.448 2.450 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@H+](C)[C@@H]1CCC[C@@H](C)C1 ZINC000223932214 640593802 /nfs/dbraw/zinc/59/38/02/640593802.db2.gz WFQNINHMWRBAKM-YIYPIFLZSA-N 2 0 224.392 2.352 20 0 BEADRP CC(C)[C@@H]1CC[N@H+](CCC[NH2+]C2CC2)C1 ZINC000166049673 640608629 /nfs/dbraw/zinc/60/86/29/640608629.db2.gz POUWHQWQTCVVHM-GFCCVEGCSA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@H]1C[C@H](C)C[N@@H+]1C[C@@H]1CC[C@H]([NH3+])C1 ZINC000717969667 711492783 /nfs/dbraw/zinc/49/27/83/711492783.db2.gz DKTBHRPLVKANDO-RNJOBUHISA-N 2 0 210.365 2.234 20 0 BEADRP COc1ccc(C[N@@H+]2CC[C@@H]([NH3+])[C@@H](C)C2)cc1C ZINC000227055467 640812760 /nfs/dbraw/zinc/81/27/60/640812760.db2.gz MANXCNSPESYZGM-GXTWGEPZSA-N 2 0 248.370 2.173 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+][C@@H]1CC=CCC1 ZINC000227117111 640815527 /nfs/dbraw/zinc/81/55/27/640815527.db2.gz RBKJUNLGYOPURY-YNEHKIRRSA-N 2 0 208.349 2.202 20 0 BEADRP CCCCCC[N@@H+]1CC[C@H](C[NH+](C)C)C1 ZINC000158147695 640819554 /nfs/dbraw/zinc/81/95/54/640819554.db2.gz KJRUKXHXZRQFLR-CYBMUJFWSA-N 2 0 212.381 2.450 20 0 BEADRP CCC(CC)C[N@@H+]1CC[C@H](C[NH3+])[C@@H](C)C1 ZINC000227536060 640838618 /nfs/dbraw/zinc/83/86/18/640838618.db2.gz ROVTWRBUJWSQQL-WCQYABFASA-N 2 0 212.381 2.339 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21)[C@@H]1CCCO1 ZINC000227535806 640838918 /nfs/dbraw/zinc/83/89/18/640838918.db2.gz CBNLGONBJZJDIS-QOWREQOWSA-N 2 0 246.354 2.288 20 0 BEADRP Cc1ccc(OCC[N@H+]2CC[C@H]([C@H](C)[NH3+])C2)cc1 ZINC000228202475 640866512 /nfs/dbraw/zinc/86/65/12/640866512.db2.gz LLBUTRIDTFBXIY-KBPBESRZSA-N 2 0 248.370 2.043 20 0 BEADRP CC1(C)CCC[C@H]1[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000087647686 640955683 /nfs/dbraw/zinc/95/56/83/640955683.db2.gz HEEYBSKTDRCCHH-VXGBXAGGSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]([NH2+]C[C@H](C)C[NH+]1CCCC1)C1CC1 ZINC000062077353 641017803 /nfs/dbraw/zinc/01/78/03/641017803.db2.gz IADIBYAEKCXQIV-NWDGAFQWSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H](C[NH2+]CC(C)(C)C)C[NH+]1CCCC1 ZINC000062079213 641020019 /nfs/dbraw/zinc/02/00/19/641020019.db2.gz QTPMKOZJTPKPLX-GFCCVEGCSA-N 2 0 212.381 2.354 20 0 BEADRP Cc1nc(C)c([C@H](C)[NH2+]C[C@@H]2CC[NH2+]C2)s1 ZINC000062117084 641023790 /nfs/dbraw/zinc/02/37/90/641023790.db2.gz DJHBSPROLIXLDI-GZMMTYOYSA-N 2 0 239.388 2.020 20 0 BEADRP C[C@H]1CC[C@@H](C[NH2+]CC2CC[NH+](C)CC2)C1 ZINC000230411995 641052847 /nfs/dbraw/zinc/05/28/47/641052847.db2.gz ANRJPGYCJHOIOI-GXTWGEPZSA-N 2 0 224.392 2.354 20 0 BEADRP CCC1CC[NH+](C[C@@]2(C)CCC[NH2+]C2)CC1 ZINC000062862426 641100549 /nfs/dbraw/zinc/10/05/49/641100549.db2.gz NGRCDJBPRXJIQL-AWEZNQCLSA-N 2 0 224.392 2.498 20 0 BEADRP CC1CC[NH+](C[C@@]2(C)CCC[NH2+]C2)CC1 ZINC000062861591 641101222 /nfs/dbraw/zinc/10/12/22/641101222.db2.gz TYBCDKCOVKUTEW-ZDUSSCGKSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@@H](Cc1cccnc1)[NH2+]CC[C@H]1CCC[N@@H+]1C ZINC000934233016 641109778 /nfs/dbraw/zinc/10/97/78/641109778.db2.gz HNJYTATYGRGVSK-DZGCQCFKSA-N 2 0 247.386 2.087 20 0 BEADRP CC(C)C1CC[NH+](CC[C@H]2CC[NH2+]C2)CC1 ZINC000232538689 641297691 /nfs/dbraw/zinc/29/76/91/641297691.db2.gz RKLVNXANHONWHG-CYBMUJFWSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@H]1C[NH3+])c1ccco1 ZINC000088169565 641320796 /nfs/dbraw/zinc/32/07/96/641320796.db2.gz NTUXZPQNSBPZOO-DCAQKATOSA-N 2 0 208.305 2.058 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@H+](C)CC[C@@H]([NH3+])C(C)C ZINC000723082415 711501196 /nfs/dbraw/zinc/50/11/96/711501196.db2.gz YZUQQZHXUVDJBV-FRRDWIJNSA-N 2 0 212.381 2.338 20 0 BEADRP C[NH+](C)C[C@@H]1CC[N@H+](CCCC(C)(F)F)C1 ZINC000929637614 641383123 /nfs/dbraw/zinc/38/31/23/641383123.db2.gz LKHOCHGLGIKXTO-NSHDSACASA-N 2 0 234.334 2.305 20 0 BEADRP CC[C@@H]1CO[C@@H](C)C[N@@H+]1CCCCCCC[NH3+] ZINC000042452101 641551704 /nfs/dbraw/zinc/55/17/04/641551704.db2.gz GQAXKTIRMLKWPH-UONOGXRCSA-N 2 0 242.407 2.395 20 0 BEADRP CC[NH+](CC)CCSC[C@@H]1CCC[N@@H+]1C ZINC000917110470 642011106 /nfs/dbraw/zinc/01/11/06/642011106.db2.gz RXVOEECXBLUPHN-LBPRGKRZSA-N 2 0 230.421 2.156 20 0 BEADRP CCC(C)(C)C[NH2+]C[C@@H]1CC[NH2+][C@@H](C)C1 ZINC000232887309 642145367 /nfs/dbraw/zinc/14/53/67/642145367.db2.gz ITPPKPSDCANYHT-NWDGAFQWSA-N 2 0 212.381 2.400 20 0 BEADRP CCC1(C[NH2+][C@H]2CCC[C@H]2C[NH3+])CCC1 ZINC000232886714 642148403 /nfs/dbraw/zinc/14/84/03/642148403.db2.gz RNHBYXAFBASJEN-RYUDHWBXSA-N 2 0 210.365 2.284 20 0 BEADRP CCC1CC[NH+](C[C@@H]2CC[NH2+][C@H](C)C2)CC1 ZINC000232898102 642203462 /nfs/dbraw/zinc/20/34/62/642203462.db2.gz QZZQNDADZFUXJA-TZMCWYRMSA-N 2 0 224.392 2.497 20 0 BEADRP C(C1CCCCC1)[N@@H+]1CCC[C@@]12CC[NH2+]C2 ZINC000257643765 642486337 /nfs/dbraw/zinc/48/63/37/642486337.db2.gz BNAPVEQNMGNZDY-AWEZNQCLSA-N 2 0 222.376 2.395 20 0 BEADRP CCCC1(C[NH2+]C2CCC([NH3+])CC2)CC1 ZINC000232951771 642637642 /nfs/dbraw/zinc/63/76/42/642637642.db2.gz CKUBKNJFAFNRPN-UHFFFAOYSA-N 2 0 210.365 2.426 20 0 BEADRP CC[C@@H]1CC[C@@H](C)[N@@H+]1C[C@@H]1C[NH2+]C[C@H]1C ZINC000233922406 642707771 /nfs/dbraw/zinc/70/77/71/642707771.db2.gz ZQPDWNWZPNJULC-FVCCEPFGSA-N 2 0 210.365 2.105 20 0 BEADRP CC[C@@H]1CCCC[N@@H+]1C[C@@H]1C[NH2+]C[C@H]1C ZINC000233909008 642709836 /nfs/dbraw/zinc/70/98/36/642709836.db2.gz PBDPOLWDOLGFDK-FRRDWIJNSA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)[C@@H]1C[C@@H]([NH2+]C2CCC([NH3+])CC2)CCO1 ZINC000070361136 643019640 /nfs/dbraw/zinc/01/96/40/643019640.db2.gz GQNYVJBRMKNFHP-HOAMVYINSA-N 2 0 240.391 2.050 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CCC2CCC2)[C@H](C)C1 ZINC000090233324 643077180 /nfs/dbraw/zinc/07/71/80/643077180.db2.gz AQOKPWXPDOWZQA-TZMCWYRMSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+][C@H]2CCC[NH2+]CC2)C1 ZINC000252770863 643113336 /nfs/dbraw/zinc/11/33/36/643113336.db2.gz ICPPAPNNHHPOIQ-FRRDWIJNSA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@H]1CCCCC[N@@H+]1C[C@@H]1C[NH2+]C[C@H]1C ZINC000234035423 643310372 /nfs/dbraw/zinc/31/03/72/643310372.db2.gz SDGHLUSWAUZFMA-RDBSUJKOSA-N 2 0 224.392 2.497 20 0 BEADRP C[N@H+](CC1CCCC1)C[C@@]1(C)CCC[NH2+]C1 ZINC000082493388 643326510 /nfs/dbraw/zinc/32/65/10/643326510.db2.gz ADEUNTZEQHKVIE-AWEZNQCLSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@H]([N@H+](C)C[C@@H]1C[NH2+]C[C@H]1C)C(C)(C)C ZINC000082568239 643345736 /nfs/dbraw/zinc/34/57/36/643345736.db2.gz BIUUQZIYJSHQDQ-WOPDTQHZSA-N 2 0 212.381 2.208 20 0 BEADRP CC[C@H]1CC[C@H](C)[N@@H+]1C[C@@H]1C[NH2+]C[C@H]1C ZINC000234047963 643356273 /nfs/dbraw/zinc/35/62/73/643356273.db2.gz ZQPDWNWZPNJULC-VOAKCMCISA-N 2 0 210.365 2.105 20 0 BEADRP C[NH+](C)CCC[NH2+]Cc1cccc2[nH]ccc21 ZINC000070938504 643395211 /nfs/dbraw/zinc/39/52/11/643395211.db2.gz JKVISBGFCJERRO-UHFFFAOYSA-N 2 0 231.343 2.209 20 0 BEADRP CCc1ccc(C[NH2+][C@H]2CCC[C@@H]2C[NH3+])cc1 ZINC000234150411 643522874 /nfs/dbraw/zinc/52/28/74/643522874.db2.gz YNCBUWBCNGHUSR-CABCVRRESA-N 2 0 232.371 2.466 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@@H+]1CCCC(C)(C)CC1 ZINC000083680878 643609267 /nfs/dbraw/zinc/60/92/67/643609267.db2.gz LNXRQZYKCAQQLH-OLZOCXBDSA-N 2 0 224.392 2.354 20 0 BEADRP Cl/C=C/C[N@@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000846220066 643649626 /nfs/dbraw/zinc/64/96/26/643649626.db2.gz ABCIQJUHVCROQD-OIOWFRMASA-N 2 0 242.794 2.451 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]C[C@H]1CC=CCC1 ZINC000084216612 643650821 /nfs/dbraw/zinc/65/08/21/643650821.db2.gz BZASSFVPXIYXQK-MELADBBJSA-N 2 0 222.376 2.450 20 0 BEADRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]CCc1ccsc1 ZINC000084220713 643651215 /nfs/dbraw/zinc/65/12/15/643651215.db2.gz NOWVUAWGECPQFE-NEPJUHHUSA-N 2 0 224.373 2.008 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@@H]1C[NH3+])c1ccccc1 ZINC000084217287 643651940 /nfs/dbraw/zinc/65/19/40/643651940.db2.gz RQALVUIAUHFWBW-IACUBPJLSA-N 2 0 218.344 2.465 20 0 BEADRP C[N@H+](CC[C@@H]1CC[NH2+]C1)CC1CCCCC1 ZINC000084385232 643660004 /nfs/dbraw/zinc/66/00/04/643660004.db2.gz JSDXHTFRLCXBKZ-ZDUSSCGKSA-N 2 0 224.392 2.498 20 0 BEADRP CC1(C)CC[NH+](CC[C@H]2CC[NH2+]C2)CC1 ZINC000084385781 643660649 /nfs/dbraw/zinc/66/06/49/643660649.db2.gz LCRCBIIQNVQUBG-GFCCVEGCSA-N 2 0 210.365 2.108 20 0 BEADRP CCc1ccc(C[N@@H+]2CC[C@H](C[NH3+])C2)cc1 ZINC000050245253 643661222 /nfs/dbraw/zinc/66/12/22/643661222.db2.gz CJOZKHJYPOJMTI-CQSZACIVSA-N 2 0 218.344 2.030 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@H](C[NH3+])C2)cc1C ZINC000050245458 643661346 /nfs/dbraw/zinc/66/13/46/643661346.db2.gz QYQVTZWGNRXXOR-CQSZACIVSA-N 2 0 218.344 2.084 20 0 BEADRP Cc1nc(C[N@@H+](C)C2CCC([NH3+])CC2)cs1 ZINC000055144660 643677470 /nfs/dbraw/zinc/67/74/70/643677470.db2.gz RUKVXRXGUXPNIA-UHFFFAOYSA-N 2 0 239.388 2.153 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[NH2+]C2CCCCCC2)C1 ZINC000085014787 643678919 /nfs/dbraw/zinc/67/89/19/643678919.db2.gz VIEIDINNNVOUSA-NWDGAFQWSA-N 2 0 210.365 2.426 20 0 BEADRP C[N@H+](CCc1cccs1)C1CCC([NH3+])CC1 ZINC000085870077 643824379 /nfs/dbraw/zinc/82/43/79/643824379.db2.gz MXVAUWWFTCHMHQ-UHFFFAOYSA-N 2 0 238.400 2.492 20 0 BEADRP C[C@H]([NH2+]CC12CC3CC(CC(C3)C1)C2)C1C[NH2+]C1 ZINC000422753194 643882543 /nfs/dbraw/zinc/88/25/43/643882543.db2.gz ICXCMSZQOGOGGQ-IKMFHRHGSA-N 2 0 248.414 2.400 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]Cc2cccs2)C1 ZINC000086402360 644130701 /nfs/dbraw/zinc/13/07/01/644130701.db2.gz OOMHDUHLHGEJSH-NXEZZACHSA-N 2 0 210.346 2.108 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)s1 ZINC000086403903 644130763 /nfs/dbraw/zinc/13/07/63/644130763.db2.gz AOUQYENQOIZUFK-GHMZBOCLSA-N 2 0 224.373 2.416 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@H+](C)CCc1cccs1 ZINC000086442241 644137307 /nfs/dbraw/zinc/13/73/07/644137307.db2.gz RBZHGKOYBNZPHJ-NEPJUHHUSA-N 2 0 238.400 2.078 20 0 BEADRP CCCCCC[C@@H](O)C[NH2+][C@](C)(C[NH3+])C1CC1 ZINC000923295667 644331861 /nfs/dbraw/zinc/33/18/61/644331861.db2.gz DGWIHGLJZPMTGM-ZIAGYGMSSA-N 2 0 242.407 2.035 20 0 BEADRP C[C@H]1[C@@H]([NH3+])CC[N@@H+]1CC1CCC2(CC2)CC1 ZINC000923367301 644377523 /nfs/dbraw/zinc/37/75/23/644377523.db2.gz GGEBOSMETPTJAE-AAEUAGOBSA-N 2 0 222.376 2.378 20 0 BEADRP c1ccc([C@H]2CCN(CCC[NH2+]C3CC3)C2)nc1 ZINC000923370231 644380657 /nfs/dbraw/zinc/38/06/57/644380657.db2.gz SPMIGTRPFIOVLX-ZDUSSCGKSA-N 2 0 245.370 2.013 20 0 BEADRP [NH3+]CC12CC(C1)C[N@@H+]2CC1CCC2(CC2)CC1 ZINC000923392673 644397272 /nfs/dbraw/zinc/39/72/72/644397272.db2.gz YXCTZIBOFKHHMJ-UHFFFAOYSA-N 2 0 234.387 2.380 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]CCC1CCCC1 ZINC000084219987 644420514 /nfs/dbraw/zinc/42/05/14/644420514.db2.gz SXANWZHUBKQYQH-QWHCGFSZSA-N 2 0 210.365 2.284 20 0 BEADRP C[C@@H]1CCC[N@H+](CC[C@@H]2CC[NH2+]C2)[C@@H]1C ZINC000084385657 644423104 /nfs/dbraw/zinc/42/31/04/644423104.db2.gz SMNWGLPOTAGPIU-UPJWGTAASA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1CC[C@H](C)C[N@H+]1C[C@@H]1CC[C@H]([NH3+])C1 ZINC000085016293 644435451 /nfs/dbraw/zinc/43/54/51/644435451.db2.gz OTICXAHIGWGDEF-LOWDOPEQSA-N 2 0 210.365 2.234 20 0 BEADRP C[C@@H]1CCCC[C@H]1C[N@@H+]1CC[C@@H]2CC[NH2+][C@@H]2C1 ZINC000923455566 644435816 /nfs/dbraw/zinc/43/58/16/644435816.db2.gz YAAYCYPJVHIZHV-CBBWQLFWSA-N 2 0 236.403 2.497 20 0 BEADRP CC1(C)C(C[NH2+]C2CC[NH2+]CC2)C1(C)C ZINC000086239413 644459330 /nfs/dbraw/zinc/45/93/30/644459330.db2.gz OZRWIJFSYRPRTJ-UHFFFAOYSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@H](c1ccccn1)[N@@H+]1CC[C@@H](C[NH3+])[C@H](C)C1 ZINC000923495974 644462927 /nfs/dbraw/zinc/46/29/27/644462927.db2.gz FMHPLDUQRAEAKO-UPJWGTAASA-N 2 0 233.359 2.059 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@H]([NH3+])C1)c1ccccn1 ZINC000086402269 644467346 /nfs/dbraw/zinc/46/73/46/644467346.db2.gz LGKOQUBDLUAPSB-SDDRHHMPSA-N 2 0 219.332 2.002 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]Cc2cccs2)C1 ZINC000086402356 644467363 /nfs/dbraw/zinc/46/73/63/644467363.db2.gz OOMHDUHLHGEJSH-VHSXEESVSA-N 2 0 210.346 2.108 20 0 BEADRP C[C@@H]1C[N@H+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC[C@@H]1C[NH3+] ZINC000923494515 644469478 /nfs/dbraw/zinc/46/94/78/644469478.db2.gz NMCZWBJSLGRXDG-RYPNDVFKSA-N 2 0 236.403 2.339 20 0 BEADRP C[C@@H](c1ccncc1)[N@@H+]1CC[C@@H](C[NH3+])[C@H](C)C1 ZINC000923500272 644471936 /nfs/dbraw/zinc/47/19/36/644471936.db2.gz NDAXBXDKJAZILY-DYEKYZERSA-N 2 0 233.359 2.059 20 0 BEADRP C[C@@H]1C[N@H+](Cc2cccc(F)c2)CC[C@@H]1C[NH3+] ZINC000923498335 644472554 /nfs/dbraw/zinc/47/25/54/644472554.db2.gz HICJHAOKZXJCIE-DGCLKSJQSA-N 2 0 236.334 2.242 20 0 BEADRP C[C@@H](c1ccncc1)[N@@H+]1CC[C@H](C[NH3+])[C@H](C)C1 ZINC000923500274 644473228 /nfs/dbraw/zinc/47/32/28/644473228.db2.gz NDAXBXDKJAZILY-MBNYWOFBSA-N 2 0 233.359 2.059 20 0 BEADRP FCCC[NH+]1CCC([C@@H]2CCC[NH2+]CC2)CC1 ZINC000923507443 644475477 /nfs/dbraw/zinc/47/54/77/644475477.db2.gz OGWMLOIEGDZWMK-CYBMUJFWSA-N 2 0 242.382 2.448 20 0 BEADRP CC[C@@H](CC(F)F)C[N@@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1 ZINC000923515623 644479207 /nfs/dbraw/zinc/47/92/07/644479207.db2.gz IOSJGNHGRVMGSV-SDDRHHMPSA-N 2 0 246.345 2.209 20 0 BEADRP CCc1ccc(C[N@@H+]2C[C@@H]3CC[NH2+]C[C@@H]3C2)cc1 ZINC000923515773 644480319 /nfs/dbraw/zinc/48/03/19/644480319.db2.gz LWXICKXFPPABMI-JKSUJKDBSA-N 2 0 244.382 2.290 20 0 BEADRP C[C@@]1(Cc2cccs2)CCC[N@@H+]1CCC[NH3+] ZINC000923529317 644485552 /nfs/dbraw/zinc/48/55/52/644485552.db2.gz CSISTSMWECEIJJ-ZDUSSCGKSA-N 2 0 238.400 2.494 20 0 BEADRP COc1ccccc1C[NH2+][C@H]1CCCC[C@H]1C[NH3+] ZINC000089139038 644535790 /nfs/dbraw/zinc/53/57/90/644535790.db2.gz IQYRKEYSFDNPEV-JSGCOSHPSA-N 2 0 248.370 2.302 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+]Cc1ccccc1F ZINC000089139615 644535926 /nfs/dbraw/zinc/53/59/26/644535926.db2.gz OUVFNDFJZTTXNJ-BXUZGUMPSA-N 2 0 236.334 2.433 20 0 BEADRP CCC(CC)[N@H+](CCOC)C[C@@H]1CC[C@H]([NH3+])C1 ZINC000091546521 644629231 /nfs/dbraw/zinc/62/92/31/644629231.db2.gz SFZRFTZIFDSTHQ-OLZOCXBDSA-N 2 0 242.407 2.251 20 0 BEADRP Cc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@H]2C[NH3+])o1 ZINC000251213992 644796747 /nfs/dbraw/zinc/79/67/47/644796747.db2.gz DXXSUNNSNXKZDW-SDDRHHMPSA-N 2 0 222.332 2.366 20 0 BEADRP C[C@H]1C[N@H+](CC2CCCCC2)CC[C@H]1C[NH3+] ZINC000251624969 644813161 /nfs/dbraw/zinc/81/31/61/644813161.db2.gz FCPMWKGCNOGEJL-JSGCOSHPSA-N 2 0 224.392 2.483 20 0 BEADRP CC[C@@H]1CC[C@@H](C)[N@H+](C[C@@H]2C[NH2+]C[C@H]2C)C1 ZINC000304357465 644895036 /nfs/dbraw/zinc/89/50/36/644895036.db2.gz LXPBDVXWHHNHST-SYQHCUMBSA-N 2 0 224.392 2.352 20 0 BEADRP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+][C@H]2CCCSC2)C1 ZINC000252807616 644910480 /nfs/dbraw/zinc/91/04/80/644910480.db2.gz CYTVXHVKYVZDFE-FRRDWIJNSA-N 2 0 242.432 2.344 20 0 BEADRP CSC[C@H](C)[NH2+][C@@H]1CCC[C@H]1[C@H]1CCC[NH2+]1 ZINC000252918621 644924918 /nfs/dbraw/zinc/92/49/18/644924918.db2.gz ZEOFZEXEBFIPGS-WUHRBBMRSA-N 2 0 242.432 2.248 20 0 BEADRP CC(C)CC[NH2+][C@@H]1CC[NH2+]C12CCCC2 ZINC000843129096 645266401 /nfs/dbraw/zinc/26/64/01/645266401.db2.gz RDAXIABBGPVBIA-GFCCVEGCSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)c1ncco1 ZINC000926606015 645311505 /nfs/dbraw/zinc/31/15/05/645311505.db2.gz HPBPDZOWJNVVAS-VOMCLLRMSA-N 2 0 237.347 2.198 20 0 BEADRP CC(C)[C@H]1CC[C@@H]1[NH2+]CCC1(C[NH3+])CC1 ZINC000844920180 645347706 /nfs/dbraw/zinc/34/77/06/645347706.db2.gz KQHPAUVGEUXNGO-NEPJUHHUSA-N 2 0 210.365 2.140 20 0 BEADRP C[C@H]([NH2+]CC[C@@]1(C)C[C@]1(F)Cl)[C@@H]1CCC[NH2+]1 ZINC000844923177 645347852 /nfs/dbraw/zinc/34/78/52/645347852.db2.gz HZGMRXOLAPWDPY-FIQHERPVSA-N 2 0 248.773 2.421 20 0 BEADRP CC(C)[C@H]1CC[C@H]1[NH2+]CCC1CC[NH2+]CC1 ZINC000844922870 645348283 /nfs/dbraw/zinc/34/82/83/645348283.db2.gz BYXOPFFQUMZPTQ-ZIAGYGMSSA-N 2 0 224.392 2.400 20 0 BEADRP C[N@H+]1C[C@H]2CC[C@@H](C1)C2[NH2+]CCCc1ccco1 ZINC000926729369 645390485 /nfs/dbraw/zinc/39/04/85/645390485.db2.gz WRBWETVNUFPGAO-NNQSOWQGSA-N 2 0 248.370 2.142 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]C[C@]23C[C@H]2CCC3)[C@@H](C)C1 ZINC000927119012 645554572 /nfs/dbraw/zinc/55/45/72/645554572.db2.gz IOLOFGPWTKYOJT-XGUBFFRZSA-N 2 0 236.403 2.497 20 0 BEADRP CC1(C)C[C@H]([NH3+])C[C@@H]([NH2+]CCc2ccccn2)C1 ZINC000925494816 645925480 /nfs/dbraw/zinc/92/54/80/645925480.db2.gz MFWNLYJONDZXAS-TZMCWYRMSA-N 2 0 247.386 2.120 20 0 BEADRP COCCC[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000925496601 645941374 /nfs/dbraw/zinc/94/13/74/645941374.db2.gz WUMJZRWMIISZNY-CQSZACIVSA-N 2 0 236.359 2.093 20 0 BEADRP COC[C@H](C)[NH2+]C1CC[NH+](CCC(C)C)CC1 ZINC000924524710 646046349 /nfs/dbraw/zinc/04/63/49/646046349.db2.gz AWWRQMCMDPRIKH-ZDUSSCGKSA-N 2 0 242.407 2.121 20 0 BEADRP CC[C@@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CCOC ZINC000924538034 646056651 /nfs/dbraw/zinc/05/66/51/646056651.db2.gz QZRGWGHCTFNZIQ-RLAWYHOSSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@H]1[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000924646783 646084241 /nfs/dbraw/zinc/08/42/41/646084241.db2.gz HGBYFLNIJIGYAC-SFDCQRBFSA-N 2 0 236.403 2.495 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2C[C@H]3C=C[C@@H]2CC3)C1 ZINC000925012915 646156869 /nfs/dbraw/zinc/15/68/69/646156869.db2.gz XSIKXARIZMZJKI-GBJTYRQASA-N 2 0 234.387 2.273 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH2+][C@@H]2C[C@H]3C=C[C@@H]2CC3)C1 ZINC000925012914 646158171 /nfs/dbraw/zinc/15/81/71/646158171.db2.gz XSIKXARIZMZJKI-BYNSBNAKSA-N 2 0 234.387 2.273 20 0 BEADRP CC1CC(C[N@@H+]2CC[C@@H](C[NH+]3CCCC3)C2)C1 ZINC000929696385 646253387 /nfs/dbraw/zinc/25/33/87/646253387.db2.gz LXVZALDTUQWOBI-SLTAFYQDSA-N 2 0 236.403 2.450 20 0 BEADRP CCOCCCC[NH2+][C@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925482644 646294853 /nfs/dbraw/zinc/29/48/53/646294853.db2.gz WUZFEQSJXFCPPQ-OLZOCXBDSA-N 2 0 242.407 2.299 20 0 BEADRP CC(C)C[NH2+][C@@H]1CC[NH2+]C[C@H]1C1CCCC1 ZINC000925492070 646299139 /nfs/dbraw/zinc/29/91/39/646299139.db2.gz FGZJGNXGXAAVML-UONOGXRCSA-N 2 0 224.392 2.400 20 0 BEADRP CSCC[C@H](C)[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000925510386 646309445 /nfs/dbraw/zinc/30/94/45/646309445.db2.gz VPQHAOVGCHDDME-WDEREUQCSA-N 2 0 228.405 2.002 20 0 BEADRP CS[C@@H]1CC[C@@H]([NH2+][C@H]2CC[NH2+]C23CCC3)C1 ZINC000925520923 646312572 /nfs/dbraw/zinc/31/25/72/646312572.db2.gz BHRLHNMEULFCHB-UTUOFQBUSA-N 2 0 240.416 2.145 20 0 BEADRP CCCCOCC[NH2+][C@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925517940 646313356 /nfs/dbraw/zinc/31/33/56/646313356.db2.gz CPRFUSXIAHRVBL-STQMWFEESA-N 2 0 242.407 2.299 20 0 BEADRP COC[C@H]([NH2+][C@@H]1C[C@@H]([NH3+])CC(C)(C)C1)C(C)C ZINC000925518488 646313708 /nfs/dbraw/zinc/31/37/08/646313708.db2.gz RATWSPIHQCKJMJ-UPJWGTAASA-N 2 0 242.407 2.153 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+]CCC(F)(F)F ZINC000925574492 646341953 /nfs/dbraw/zinc/34/19/53/646341953.db2.gz UWOSIFJPPYOMJJ-BQKDNTBBSA-N 2 0 236.281 2.044 20 0 BEADRP C[C@@H](C[NH2+][C@@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C)C1CC1 ZINC000925585972 646346364 /nfs/dbraw/zinc/34/63/64/646346364.db2.gz QLRDQYOHZVLJLK-AHLTXXRQSA-N 2 0 236.403 2.399 20 0 BEADRP CC[C@H](O)CCC[NH2+][C@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925582715 646347034 /nfs/dbraw/zinc/34/70/34/646347034.db2.gz ZCIXVYCZBPMZEG-AVGNSLFASA-N 2 0 242.407 2.033 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+]CC1Cc2ccccc2C1 ZINC000925602432 646352423 /nfs/dbraw/zinc/35/24/23/646352423.db2.gz SYCIJLWKZDWDTC-HNNXBMFYSA-N 2 0 244.382 2.132 20 0 BEADRP CC1(C)C[C@@H]([NH3+])C[C@H]([NH2+]Cc2ccoc2)C1 ZINC000925613827 646361871 /nfs/dbraw/zinc/36/18/71/646361871.db2.gz SVSQENVVJDKNKW-RYUDHWBXSA-N 2 0 222.332 2.275 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCOC1)c1cccc(C[NH+](C)C)c1 ZINC000925614794 646362146 /nfs/dbraw/zinc/36/21/46/646362146.db2.gz CKHUEWBNMCLBLK-SWLSCSKDSA-N 2 0 248.370 2.188 20 0 BEADRP C1=CC[C@H](C[NH2+][C@@H]2CC[NH2+]C23CCC3)CC1 ZINC000925618858 646364735 /nfs/dbraw/zinc/36/47/35/646364735.db2.gz YQMICPZXFDFKHX-QWHCGFSZSA-N 2 0 220.360 2.217 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+]C[C@H]1CC=CCC1 ZINC000925617021 646365509 /nfs/dbraw/zinc/36/55/09/646365509.db2.gz PEJJIQBMPLRTPR-XDYZINJXSA-N 2 0 234.387 2.448 20 0 BEADRP C([NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32)C12CCC(CC1)C2 ZINC000925624984 646370282 /nfs/dbraw/zinc/37/02/82/646370282.db2.gz FJRBIPFOJONXDT-HJUHPGBDSA-N 2 0 246.398 2.153 20 0 BEADRP CC1(C)C[C@H]([NH3+])C[C@@H]([NH2+][C@@H]2CCCOCC2)C1 ZINC000925636481 646380993 /nfs/dbraw/zinc/38/09/93/646380993.db2.gz SRLLOTZNQRNNQP-JHJVBQTASA-N 2 0 240.391 2.051 20 0 BEADRP CS[C@H](C[NH2+][C@H]1CC[NH2+]C1(C)C)C(C)(C)C ZINC000925636141 646381061 /nfs/dbraw/zinc/38/10/61/646381061.db2.gz AETAZGNNYZHTIQ-WDEREUQCSA-N 2 0 244.448 2.494 20 0 BEADRP CC1(C)[C@@H]([NH2+]C2CC(F)(F)C2)[C@@H]2CCC[NH2+][C@@H]21 ZINC000925651384 646390627 /nfs/dbraw/zinc/39/06/27/646390627.db2.gz BONCFTFNYPGPMZ-VWYCJHECSA-N 2 0 244.329 2.150 20 0 BEADRP CC1(C)C[C@H]([NH3+])C[C@@H]([NH2+]C[C@@H]2CCSC2)C1 ZINC000925652874 646391501 /nfs/dbraw/zinc/39/15/01/646391501.db2.gz HWQHPGLTCUWOFW-QJPTWQEYSA-N 2 0 242.432 2.235 20 0 BEADRP C[C@@H]1CC[C@@H](C[NH2+][C@H]2CC[NH2+]C23CCC3)C1 ZINC000925661198 646395808 /nfs/dbraw/zinc/39/58/08/646395808.db2.gz BTMKVJPLHCYWKK-UPJWGTAASA-N 2 0 222.376 2.297 20 0 BEADRP CC(C)=CC[NH2+][C@@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925659069 646396687 /nfs/dbraw/zinc/39/66/87/646396687.db2.gz SWFIEZLBCDGDMR-NWDGAFQWSA-N 2 0 210.365 2.448 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+][C@H]2CC[NH2+]C23CCC3)C1 ZINC000925661189 646397121 /nfs/dbraw/zinc/39/71/21/646397121.db2.gz BTMKVJPLHCYWKK-AGIUHOORSA-N 2 0 222.376 2.297 20 0 BEADRP COCC(C)(C)CCC[NH2+][C@H]1CC[NH2+]C1(C)C ZINC000925670918 646400881 /nfs/dbraw/zinc/40/08/81/646400881.db2.gz AREPWGXYTDXWGT-LBPRGKRZSA-N 2 0 242.407 2.169 20 0 BEADRP CC(C)(C)C1CC([NH2+][C@@H]2[C@H]3C[C@H]4C[NH2+][C@H]2[C@H]4C3)C1 ZINC000925677083 646404656 /nfs/dbraw/zinc/40/46/56/646404656.db2.gz NRPOPUXAFPRETF-MARYMYHZSA-N 2 0 248.414 2.397 20 0 BEADRP C[C@H](F)CC[NH2+][C@@H]1CC[NH2+]C[C@@H]1C1CCCC1 ZINC000925678176 646406918 /nfs/dbraw/zinc/40/69/18/646406918.db2.gz SJWZGBOLSZQDON-IACUBPJLSA-N 2 0 242.382 2.492 20 0 BEADRP CC[C@@H]1OCC[C@H]1[NH2+][C@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925684429 646410760 /nfs/dbraw/zinc/41/07/60/646410760.db2.gz AYBCDKDPJOSGLR-RVMXOQNASA-N 2 0 240.391 2.050 20 0 BEADRP Cc1ccncc1C[NH2+][C@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925689367 646414293 /nfs/dbraw/zinc/41/42/93/646414293.db2.gz IESRDSOOINPOQO-KBPBESRZSA-N 2 0 247.386 2.386 20 0 BEADRP CC(C)C[C@@H]1C[C@H]1[NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32 ZINC000925690979 646416696 /nfs/dbraw/zinc/41/66/96/646416696.db2.gz HNRLFGUSKCEOSG-CCEZWXGKSA-N 2 0 234.387 2.007 20 0 BEADRP CC(C)[C@@H]1C[C@H]1C[NH2+][C@H]1C[C@@H]([NH3+])C12CCC2 ZINC000925693358 646417846 /nfs/dbraw/zinc/41/78/46/646417846.db2.gz RWXDLXMXCKEAJX-RVMXOQNASA-N 2 0 222.376 2.138 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+][C@@H]1CCCC[C@H]1F ZINC000925694406 646420674 /nfs/dbraw/zinc/42/06/74/646420674.db2.gz VYHSXAWWVXPUGX-KYKFVJMVSA-N 2 0 240.366 2.373 20 0 BEADRP CC1(C)C[C@@H]([NH2+][C@@H]2CC23CC3)C[C@@H]([NH3+])C1 ZINC000925702446 646427909 /nfs/dbraw/zinc/42/79/09/646427909.db2.gz CZFMMEGWMAWLQF-OUAUKWLOSA-N 2 0 208.349 2.035 20 0 BEADRP C[C@H](N)[C@H]([NH2+]CCCCCC[NH3+])c1ccccc1 ZINC000925713408 646438538 /nfs/dbraw/zinc/43/85/38/646438538.db2.gz RVWBYZXSLGEPPO-ZFWWWQNUSA-N 2 0 249.402 2.184 20 0 BEADRP CC(C)(F)CC[NH2+][C@H]1CC[NH2+]C12CCCC2 ZINC000925712663 646438992 /nfs/dbraw/zinc/43/89/92/646438992.db2.gz YWEXUAHCXUBAQG-NSHDSACASA-N 2 0 228.355 2.389 20 0 BEADRP FC1CCC(C[NH2+][C@@H]2CC[NH2+]C23CCC3)CC1 ZINC000925714558 646439401 /nfs/dbraw/zinc/43/94/01/646439401.db2.gz ZLQVDUSCCSPOIY-WXRRBKDZSA-N 2 0 240.366 2.389 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+]C[C@@H]1CC[C@H]2C[C@H]2C1 ZINC000925720078 646444144 /nfs/dbraw/zinc/44/41/44/646444144.db2.gz FHOAGPNZAYWYSM-XQHKEYJVSA-N 2 0 222.376 2.153 20 0 BEADRP C(C[C@H]1CCCS1)[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000925723315 646448627 /nfs/dbraw/zinc/44/86/27/646448627.db2.gz UYAPHHLOMIXTGB-NEPJUHHUSA-N 2 0 240.416 2.146 20 0 BEADRP CCC[C@H](CN[C@@H]1CC[NH2+]C12CCC2)OCC ZINC000925724023 646449733 /nfs/dbraw/zinc/44/97/33/646449733.db2.gz VRNYRNQJEOZAEL-CHWSQXEVSA-N 2 0 240.391 2.066 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]CC1(CC2CC2)CC1 ZINC000925734532 646451937 /nfs/dbraw/zinc/45/19/37/646451937.db2.gz SCLHBRKSQWPAPJ-NEPJUHHUSA-N 2 0 208.349 2.036 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+]CCC[C@H]1C=CCC1 ZINC000925729654 646453500 /nfs/dbraw/zinc/45/35/00/646453500.db2.gz LGWNGMMLTCFGCN-STQMWFEESA-N 2 0 222.376 2.463 20 0 BEADRP CC(C)(C[NH2+][C@H]1CCC[C@@H]1C[NH3+])CC(F)F ZINC000925735364 646454574 /nfs/dbraw/zinc/45/45/74/646454574.db2.gz ZMIVAINKEQEYGS-ZJUUUORDSA-N 2 0 234.334 2.385 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C=CCC1)[C@@H]1CCCC[NH2+]1 ZINC000925731524 646455827 /nfs/dbraw/zinc/45/58/27/646455827.db2.gz LTDYEMPQCXLTDJ-AGIUHOORSA-N 2 0 208.349 2.073 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]CC2(CC3CC3)CC2)C1 ZINC000925732843 646456066 /nfs/dbraw/zinc/45/60/66/646456066.db2.gz DQVFBQITWUQHAC-OLZOCXBDSA-N 2 0 222.376 2.426 20 0 BEADRP C[C@@H]([NH2+]C[C@]1(C)CC1(C)C)[C@H]1CCC[NH2+]1 ZINC000925733426 646456474 /nfs/dbraw/zinc/45/64/74/646456474.db2.gz ITSYDYRSSIATMW-WZRBSPASSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1C=CCC1)[C@H]1CCCC[NH2+]1 ZINC000925731526 646456492 /nfs/dbraw/zinc/45/64/92/646456492.db2.gz LTDYEMPQCXLTDJ-JHJVBQTASA-N 2 0 208.349 2.073 20 0 BEADRP CC1(C)C[C@@]1(C)C[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000925733359 646456822 /nfs/dbraw/zinc/45/68/22/646456822.db2.gz HGSDDFFXJLZTFL-YPMHNXCESA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]([NH2+]CC(C)(C)CC(F)F)[C@@H]1CCC[NH2+]1 ZINC000925735331 646457572 /nfs/dbraw/zinc/45/75/72/646457572.db2.gz ZDKUGSGLWFJWGB-ZJUUUORDSA-N 2 0 234.334 2.398 20 0 BEADRP C([NH2+][C@H]1CC[NH2+]C12CCC2)C1(CC2CC2)CC1 ZINC000925734990 646457603 /nfs/dbraw/zinc/45/76/03/646457603.db2.gz WPJGWKBTRNQNQT-ZDUSSCGKSA-N 2 0 234.387 2.441 20 0 BEADRP C[C@@H]([NH2+]CC(C)(C)CC(F)F)[C@H]1CC[NH2+]C1 ZINC000925735355 646457787 /nfs/dbraw/zinc/45/77/87/646457787.db2.gz ZIXMDGPTOCVIMA-ZJUUUORDSA-N 2 0 234.334 2.255 20 0 BEADRP CC(C)([NH3+])CC[NH2+][C@@H]1CCCC12CCC2 ZINC000925736868 646460823 /nfs/dbraw/zinc/46/08/23/646460823.db2.gz DURLIZCYYBMHHT-LLVKDONJSA-N 2 0 210.365 2.426 20 0 BEADRP CCC1(CC)[C@H](OC)C[C@@H]1[NH2+]CCC(C)(C)[NH3+] ZINC000925740781 646461766 /nfs/dbraw/zinc/46/17/66/646461766.db2.gz LJRUNPXDCBVOAP-NWDGAFQWSA-N 2 0 242.407 2.297 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H]1C[NH2+]C[C@H]1C)C(C)(C)C ZINC000925786566 646464260 /nfs/dbraw/zinc/46/42/60/646464260.db2.gz UFJRJOKSQZRZIF-GRYCIOLGSA-N 2 0 212.381 2.256 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1C[C@H]1[C@H]1C[C@H]1C)[C@@H]1CCC[NH2+]1 ZINC000925771837 646472868 /nfs/dbraw/zinc/47/28/68/646472868.db2.gz DIGXXSRXGWHEFE-WFQJECDVSA-N 2 0 222.376 2.009 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]Cc1cc(C2CC2)no1 ZINC000925775060 646475906 /nfs/dbraw/zinc/47/59/06/646475906.db2.gz ZNPDUFOYLQGFBL-SNVBAGLBSA-N 2 0 237.347 2.159 20 0 BEADRP CCC[C@@H](C)[C@H](CC)[NH2+][C@@H]1C[NH2+]C[C@H]1C ZINC000925782227 646478772 /nfs/dbraw/zinc/47/87/72/646478772.db2.gz ITYCLHHQZYSIEA-FVCCEPFGSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1C[NH2+]CCC1(F)F)C(C)(C)C ZINC000925782579 646479301 /nfs/dbraw/zinc/47/93/01/646479301.db2.gz MDIOORUXLHIHJE-UWVGGRQHSA-N 2 0 234.334 2.255 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1C[NH2+]CCC1(F)F)C1CCCC1 ZINC000925781656 646479338 /nfs/dbraw/zinc/47/93/38/646479338.db2.gz JDGKEYHOFWYSQZ-JQWIXIFHSA-N 2 0 246.345 2.400 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[NH2+]CCC1(F)F)C(C)(C)C ZINC000925782581 646479623 /nfs/dbraw/zinc/47/96/23/646479623.db2.gz MDIOORUXLHIHJE-VHSXEESVSA-N 2 0 234.334 2.255 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1C[NH2+]CCC1(F)F)C(C)(C)C ZINC000925782582 646480025 /nfs/dbraw/zinc/48/00/25/646480025.db2.gz MDIOORUXLHIHJE-ZJUUUORDSA-N 2 0 234.334 2.255 20 0 BEADRP C[C@H](CC(C)(C)C)[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000925785471 646480969 /nfs/dbraw/zinc/48/09/69/646480969.db2.gz NMHLAVSLMVHGJT-UTUOFQBUSA-N 2 0 212.381 2.256 20 0 BEADRP CCCC[C@H](C)[C@H](C)[NH2+][C@@H]1C[NH2+]C[C@H]1C ZINC000925785505 646481044 /nfs/dbraw/zinc/48/10/44/646481044.db2.gz PLJRYAGMRCVNHY-QNWHQSFQSA-N 2 0 212.381 2.399 20 0 BEADRP CC(C)CC[C@@H]([NH2+][C@@H]1C[NH2+]C[C@H]1C)C1CC1 ZINC000925784925 646481222 /nfs/dbraw/zinc/48/12/22/646481222.db2.gz OSEQXVVYNJZWCH-MRVWCRGKSA-N 2 0 224.392 2.399 20 0 BEADRP CC(C)CC[C@H]([NH2+][C@@H]1C[NH2+]C[C@H]1C)C1CC1 ZINC000925784923 646481891 /nfs/dbraw/zinc/48/18/91/646481891.db2.gz OSEQXVVYNJZWCH-KWCYVHTRSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+][C@@H]1CCC[C@H]1CCCF ZINC000925787120 646482733 /nfs/dbraw/zinc/48/27/33/646482733.db2.gz XCAVYZBACUEAGG-YVECIDJPSA-N 2 0 228.355 2.102 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[NH2+]C[C@H]1C)C1CCC(F)(F)CC1 ZINC000925786750 646483718 /nfs/dbraw/zinc/48/37/18/646483718.db2.gz VTMJQZGYFPMNII-JFGNBEQYSA-N 2 0 246.345 2.398 20 0 BEADRP C[C@@H](CSC(C)(C)C)[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000925793278 646485774 /nfs/dbraw/zinc/48/57/74/646485774.db2.gz XTEOODZRVWCMIL-WOPDTQHZSA-N 2 0 244.448 2.352 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1C[NH2+]C[C@H]1C)c1cncs1 ZINC000925800178 646487316 /nfs/dbraw/zinc/48/73/16/646487316.db2.gz WHBNTSUBENMXFG-OUAUKWLOSA-N 2 0 239.388 2.039 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CC[C@H]2C[C@H]21)[C@@H]1CCC[NH2+]1 ZINC000925805490 646488189 /nfs/dbraw/zinc/48/81/89/646488189.db2.gz UIUJZJPCTHXSDB-PEDHHIEDSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+][C@@H]1CC[C@H]1C1CCC1 ZINC000925803804 646488952 /nfs/dbraw/zinc/48/89/52/646488952.db2.gz VSXNDJZJYFMAOE-REBRKWNGSA-N 2 0 236.403 2.400 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+][C@@H]1CC[C@@H]1C1CCC1 ZINC000925803803 646489105 /nfs/dbraw/zinc/48/91/05/646489105.db2.gz VSXNDJZJYFMAOE-NMFUWQPSSA-N 2 0 236.403 2.400 20 0 BEADRP C[C@@H]1C[C@H]1[C@@H]1C[C@H]1[NH2+][C@@H]1CCCCC[C@@H]1[NH3+] ZINC000925821271 646494978 /nfs/dbraw/zinc/49/49/78/646494978.db2.gz GMBKOXDWWHSLLD-UYYXNEDZSA-N 2 0 222.376 2.281 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]C[C@]12CCC[C@H]1[NH2+]CC2 ZINC000925840945 646505830 /nfs/dbraw/zinc/50/58/30/646505830.db2.gz FCSHUQQWMOXRSD-IACUBPJLSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]([NH2+]C[C@]12CCC[C@H]1[NH2+]CC2)c1cccnc1 ZINC000925846558 646510192 /nfs/dbraw/zinc/51/01/92/646510192.db2.gz QCEOIDIFICMIGQ-BPLDGKMQSA-N 2 0 245.370 2.264 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCS[C@H](C)C1)[C@@H]1CCC[NH2+]1 ZINC000925862236 646514250 /nfs/dbraw/zinc/51/42/50/646514250.db2.gz YPARFCYHLDQACE-KXNHARMFSA-N 2 0 228.405 2.001 20 0 BEADRP C[C@H]([NH2+][C@H]1CCS[C@H](C)C1)[C@@H]1CCC[NH2+]1 ZINC000925862238 646514578 /nfs/dbraw/zinc/51/45/78/646514578.db2.gz YPARFCYHLDQACE-RHYQMDGZSA-N 2 0 228.405 2.001 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CC[C@H]([NH3+])C1)c1ccco1 ZINC000925877120 646527583 /nfs/dbraw/zinc/52/75/83/646527583.db2.gz LTOWLMFGTGQADF-MXWKQRLJSA-N 2 0 208.305 2.058 20 0 BEADRP COc1ccc([C@H](C)[NH2+]C[C@@H]2CC[C@H]([NH3+])C2)cc1 ZINC000925877533 646527665 /nfs/dbraw/zinc/52/76/65/646527665.db2.gz RMNARTZOTQFLLT-SCRDCRAPSA-N 2 0 248.370 2.473 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[NH2+][C@H]2CCc3ccccc32)C1 ZINC000925877960 646527967 /nfs/dbraw/zinc/52/79/67/646527967.db2.gz ZSHXEGJZWSCQGS-LNSITVRQSA-N 2 0 230.355 2.391 20 0 BEADRP C[C@]12C[C@H]1CCC[C@@H]2[NH2+]C[C@@H]1CC[C@H]([NH3+])C1 ZINC000925880428 646529229 /nfs/dbraw/zinc/52/92/29/646529229.db2.gz RNAVXLSZNDVPHU-DGTMBMJNSA-N 2 0 222.376 2.282 20 0 BEADRP Cc1nc([C@H](C)[NH2+]C[C@@H]2CC[C@H]([NH3+])C2)cs1 ZINC000925879940 646529778 /nfs/dbraw/zinc/52/97/78/646529778.db2.gz MSCFIAXCTLASLV-GDPRMGEGSA-N 2 0 239.388 2.230 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+]C[C@@H]1CC[C@H]([NH3+])C1 ZINC000925879396 646529806 /nfs/dbraw/zinc/52/98/06/646529806.db2.gz DAZMBEHVLPZDQW-MROQNXINSA-N 2 0 210.365 2.138 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1CC[C@H]([NH3+])C1)[C@H]1C[C@H]1C ZINC000925879483 646529909 /nfs/dbraw/zinc/52/99/09/646529909.db2.gz FQYLSTPUVGBBGO-BNDIWNMDSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H](CCC(F)(F)F)[NH2+]C[C@@H]1CC[C@H]([NH3+])C1 ZINC000925881989 646530355 /nfs/dbraw/zinc/53/03/55/646530355.db2.gz ICZJOCFUILTXPO-AEJSXWLSSA-N 2 0 238.297 2.434 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CC[C@H]([NH3+])C1)C1CCSCC1 ZINC000925882518 646530672 /nfs/dbraw/zinc/53/06/72/646530672.db2.gz NYJORFVMIREFHP-WZRBSPASSA-N 2 0 242.432 2.235 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]C1([C@H]2CCCCO2)CC1 ZINC000925893921 646534657 /nfs/dbraw/zinc/53/46/57/646534657.db2.gz SFYFNOJYZGQAIJ-QWHCGFSZSA-N 2 0 240.391 2.195 20 0 BEADRP CCN1C[C@H](C)[C@H]([NH2+][C@H]2C[C@H]3C=C[C@@H]2CC3)C1 ZINC000925929242 646544285 /nfs/dbraw/zinc/54/42/85/646544285.db2.gz LGMPFIHNDFYKRX-SBJFKYEJSA-N 2 0 234.387 2.271 20 0 BEADRP C[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ncco1 ZINC000926308176 646614487 /nfs/dbraw/zinc/61/44/87/646614487.db2.gz NDCIUUBAJMJZMF-NSHDSACASA-N 2 0 249.358 2.200 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@H]1[NH2+][C@H]1CCc2nc[nH]c2C1 ZINC000926450623 646642582 /nfs/dbraw/zinc/64/25/82/646642582.db2.gz PMYBQZSFWZYOTN-BBGACYKPSA-N 2 0 233.359 2.291 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+]CC[C@@H]1CCCS1 ZINC000925722834 711726485 /nfs/dbraw/zinc/72/64/85/711726485.db2.gz NQNGSGXUJGGNEJ-WDEREUQCSA-N 2 0 228.405 2.002 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CC1CCC=CCC1 ZINC000925880064 711761937 /nfs/dbraw/zinc/76/19/37/711761937.db2.gz HBVTYMIDAOIMRM-RYUDHWBXSA-N 2 0 210.365 2.448 20 0 BEADRP CCO[C@H]1CCC[C@H]([NH2+]C2CC([NH+](C)C)C2)C1 ZINC000721273133 711881853 /nfs/dbraw/zinc/88/18/53/711881853.db2.gz NMEIRHGGVXZHEB-ABXWRUBCSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@@H]1CCC[C@@H]1C[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000230665218 711938033 /nfs/dbraw/zinc/93/80/33/711938033.db2.gz XRHLLWRCHKVNGJ-JHJVBQTASA-N 2 0 210.365 2.154 20 0 BEADRP CC1(C)C[C@]1(C)C[NH2+][C@@H]1CCC[C@@H]1C[NH3+] ZINC000701983932 712034623 /nfs/dbraw/zinc/03/46/23/712034623.db2.gz IZONWNBNWQMXKO-NQBHXWOUSA-N 2 0 210.365 2.140 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@@]2(C)CC2(C)C)CC1 ZINC000701982479 712034772 /nfs/dbraw/zinc/03/47/72/712034772.db2.gz RFSOOFNWJINESX-CQSZACIVSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH+]1CCC(C[NH2+]CCC2(F)CCC2)CC1 ZINC000702470637 712053672 /nfs/dbraw/zinc/05/36/72/712053672.db2.gz BTWXSAPVZRQKRN-UHFFFAOYSA-N 2 0 228.355 2.200 20 0 BEADRP CSC1CC([NH2+]C[C@H](C)C[NH+]2CCCC2)C1 ZINC000706918571 712158212 /nfs/dbraw/zinc/15/82/12/712158212.db2.gz PWVKSLCYNMCZAA-HIFPTAJRSA-N 2 0 242.432 2.202 20 0 BEADRP CSC1CC([NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)C1 ZINC000706927317 712161613 /nfs/dbraw/zinc/16/16/13/712161613.db2.gz GSQRQQHTWZHUQP-CQLXCSJHSA-N 2 0 240.416 2.097 20 0 BEADRP C[NH+]1CCC(C[NH2+]C[C@@H]2CCCC23CC3)CC1 ZINC000707100137 712164782 /nfs/dbraw/zinc/16/47/82/712164782.db2.gz IQHMXOTUEGPVDZ-AWEZNQCLSA-N 2 0 236.403 2.498 20 0 BEADRP CC1(C)CO[C@@H](C[N@@H+]2CCCC[C@@H]2CC[NH3+])C1 ZINC000708325991 712187770 /nfs/dbraw/zinc/18/77/70/712187770.db2.gz ZBTPOEPRXBBSNA-CHWSQXEVSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@H]1[C@H]2CC[C@@H](C[C@@H]1[NH2+]C1CCCC1)[NH2+]2 ZINC000709374471 712220555 /nfs/dbraw/zinc/22/05/55/712220555.db2.gz QNEMBIZBDMAUOD-SYEHKZFSSA-N 2 0 208.349 2.048 20 0 BEADRP C(C[N@@H+]1CC[C@]2(C1)CCC[NH2+]C2)C1CCC1 ZINC000709893429 712231334 /nfs/dbraw/zinc/23/13/34/712231334.db2.gz SNAKBFLABMTVCG-CQSZACIVSA-N 2 0 222.376 2.252 20 0 BEADRP C[N@H+](CCCCCC[NH3+])C[C@@H]1CC1(C)C ZINC000710800732 712257112 /nfs/dbraw/zinc/25/71/12/712257112.db2.gz XNNRWDHOSPTUAT-LBPRGKRZSA-N 2 0 212.381 2.483 20 0 BEADRP C[C@H]1CC[C@H]1[NH2+]CCCCn1ccnc1 ZINC000379780210 712398897 /nfs/dbraw/zinc/39/88/97/712398897.db2.gz BZXSKLAPOGMFBU-NWDGAFQWSA-N 2 0 207.321 2.051 20 0 BEADRP C[C@@H]1C[N@H+](CC[C@@H]2C[C@H]2C2CC2)CC[C@H]1[NH3+] ZINC000712683218 712440614 /nfs/dbraw/zinc/44/06/14/712440614.db2.gz FYKJAEPDHAXNHX-RUZUBIRVSA-N 2 0 222.376 2.092 20 0 BEADRP CC1(C)CC[C@@H](CN2CCCC[C@@H]2C[NH3+])OC1 ZINC000713588081 712466048 /nfs/dbraw/zinc/46/60/48/712466048.db2.gz SQSFRCMAPSODOH-OLZOCXBDSA-N 2 0 240.391 2.005 20 0 BEADRP C=C/C=C/CC[N@H+]1CCC[C@H](C[NH2+]C)C1 ZINC000713737165 712470573 /nfs/dbraw/zinc/47/05/73/712470573.db2.gz ZSNTWEOBNXZUKP-MUBLQREKSA-N 2 0 208.349 2.050 20 0 BEADRP C[N@H+](C[C@H]1CCCC(C)(C)O1)CC(C)(C)C[NH3+] ZINC000714379846 712480130 /nfs/dbraw/zinc/48/01/30/712480130.db2.gz LUDIVIZJJGKFOA-GFCCVEGCSA-N 2 0 242.407 2.251 20 0 BEADRP CC(C)C[NH+]1CCC(C(C)(C)C[NH3+])CC1 ZINC000714407273 712485015 /nfs/dbraw/zinc/48/50/15/712485015.db2.gz WTTUPEJBOCROSA-UHFFFAOYSA-N 2 0 212.381 2.339 20 0 BEADRP C[C@@H]1C[C@@H]([NH3+])CC[N@@H+]1C[C@H]1CCCC(C)(C)O1 ZINC000714374718 712484459 /nfs/dbraw/zinc/48/44/59/712484459.db2.gz NRVRVZLBYLUQPJ-FRRDWIJNSA-N 2 0 240.391 2.146 20 0 BEADRP C[C@@H]1C[C@H]([NH3+])CC[N@@H+]1C[C@@H]1CCCC(C)(C)O1 ZINC000714374720 712484727 /nfs/dbraw/zinc/48/47/27/712484727.db2.gz NRVRVZLBYLUQPJ-UPJWGTAASA-N 2 0 240.391 2.146 20 0 BEADRP CCSCC[NH+]1CCC(C(C)(C)C[NH3+])CC1 ZINC000714431928 712486055 /nfs/dbraw/zinc/48/60/55/712486055.db2.gz VRLOJNWFDSFZPE-UHFFFAOYSA-N 2 0 244.448 2.436 20 0 BEADRP C[N@H+](CC[C@@H]1C[C@H]1C1CC1)C1CC[NH2+]CC1 ZINC000714853803 712502005 /nfs/dbraw/zinc/50/20/05/712502005.db2.gz YPMDMJGWUXPEMY-OCCSQVGLSA-N 2 0 222.376 2.106 20 0 BEADRP C[NH2+]CC1CC[NH+](CC[C@@H]2C[C@H]2C2CC2)CC1 ZINC000714867756 712502092 /nfs/dbraw/zinc/50/20/92/712502092.db2.gz VHKPGRGMYGQECC-CABCVRRESA-N 2 0 236.403 2.354 20 0 BEADRP CCC[C@H](C[NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1)OC ZINC000715532489 712526184 /nfs/dbraw/zinc/52/61/84/712526184.db2.gz MLNDFDKCAGEFDD-HZSPNIEDSA-N 2 0 242.407 2.264 20 0 BEADRP CSC1CC([NH2+][C@H]2CCC[C@H]([NH+](C)C)C2)C1 ZINC000715545641 712527195 /nfs/dbraw/zinc/52/71/95/712527195.db2.gz ZSKPAEYAKUIIOJ-QCXCNERSSA-N 2 0 242.432 2.343 20 0 BEADRP CO[C@H]1CCC[C@@H]1[NH2+]C1CCC([NH+](C)C)CC1 ZINC000715551255 712528173 /nfs/dbraw/zinc/52/81/73/712528173.db2.gz HEFBLDNYNAFDHX-HOAMVYINSA-N 2 0 240.391 2.016 20 0 BEADRP C(C[C@H]1CCCS1)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000715635051 712528299 /nfs/dbraw/zinc/52/82/99/712528299.db2.gz HUHXOEHUUYYNAG-ZGVCCVRISA-N 2 0 240.416 2.145 20 0 BEADRP CCCC[NH+]1CCC([NH2+][C@@H]2CCSC2)CC1 ZINC000037149989 712547564 /nfs/dbraw/zinc/54/75/64/712547564.db2.gz PBGDDHGFBGZSNT-CYBMUJFWSA-N 2 0 242.432 2.346 20 0 BEADRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]CCCCC1CC1 ZINC000716412066 712559189 /nfs/dbraw/zinc/55/91/89/712559189.db2.gz GOOWIQICFNLJSZ-CHWSQXEVSA-N 2 0 210.365 2.284 20 0 BEADRP CC1(C)CC[C@H]([NH2+]C[C@@H]2C[NH2+]CCC2(F)F)C1 ZINC000717317979 712646697 /nfs/dbraw/zinc/64/66/97/712646697.db2.gz UHNUJEAHBRWBCP-QWRGUYRKSA-N 2 0 246.345 2.400 20 0 BEADRP CCCC[C@H](C)[NH2+]C[C@H]1CC[N@H+](CC)C1 ZINC000037484315 712650824 /nfs/dbraw/zinc/65/08/24/712650824.db2.gz GALKURQDIPGZHO-QWHCGFSZSA-N 2 0 212.381 2.497 20 0 BEADRP CC[C@@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)C(C)C ZINC000037485284 712650954 /nfs/dbraw/zinc/65/09/54/712650954.db2.gz PMMGYGRRPBRKBX-TZMCWYRMSA-N 2 0 224.392 2.495 20 0 BEADRP C[N@H+](CCCC(C)(F)F)C1CC[NH2+]CC1 ZINC000718570081 712774775 /nfs/dbraw/zinc/77/47/75/712774775.db2.gz IMZFLZBFJQRDKC-UHFFFAOYSA-N 2 0 220.307 2.106 20 0 BEADRP C[C@H]([NH3+])[C@H]1CC[N@H+](CCCC(C)(F)F)C1 ZINC000718569759 712775008 /nfs/dbraw/zinc/77/50/08/712775008.db2.gz HMUWOMKMJAXMFJ-UWVGGRQHSA-N 2 0 220.307 2.091 20 0 BEADRP COCC(C)(C)CC[NH2+][C@@H]1CCCC[C@@H]1C[NH3+] ZINC000718668899 712776611 /nfs/dbraw/zinc/77/66/11/712776611.db2.gz YWBVHJRVHODQQG-CHWSQXEVSA-N 2 0 242.407 2.156 20 0 BEADRP CC(C)(C)CC[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000037904459 712785469 /nfs/dbraw/zinc/78/54/69/712785469.db2.gz LKGKXUMZAJWBFS-GFCCVEGCSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CC([NH2+]C[C@H]2C[C@@H]([NH3+])C2)C[C@@H](C)C1 ZINC000719376286 712806531 /nfs/dbraw/zinc/80/65/31/712806531.db2.gz GHVQZSADHVUGSC-FIQHERPVSA-N 2 0 210.365 2.138 20 0 BEADRP CCC[C@H](C)[NH2+]Cc1ncc(CN(C)C)s1 ZINC000381407078 710633012 /nfs/dbraw/zinc/63/30/12/710633012.db2.gz SQPTUFAMKKMSKG-JTQLQIEISA-N 2 0 241.404 2.483 20 0 BEADRP Cc1ccc(C[NH2+]CC[C@@H]2C[NH2+]C[C@H]2C)s1 ZINC000722513296 710714516 /nfs/dbraw/zinc/71/45/16/710714516.db2.gz HIUYXSIEIFWZBH-ZYHUDNBSSA-N 2 0 238.400 2.392 20 0 BEADRP C[C@H]1OCC[N@H+](CCCCCCC[NH3+])[C@H]1C ZINC000380492808 712901197 /nfs/dbraw/zinc/90/11/97/712901197.db2.gz AYTFQNFSUKSUIY-QWHCGFSZSA-N 2 0 228.380 2.005 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH+]1CCC([NH2+]CC2CC2)CC1 ZINC000723099730 710726967 /nfs/dbraw/zinc/72/69/67/710726967.db2.gz YJCDUCNHLBBGFT-KGLIPLIRSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]1C[N@H+](C[C@H]2CCC[C@H](C)C2)C[C@H]1[NH3+] ZINC000723469762 710727760 /nfs/dbraw/zinc/72/77/60/710727760.db2.gz IALMBPNPHJGOON-QNWHQSFQSA-N 2 0 210.365 2.092 20 0 BEADRP CC[C@@H]1[C@H](C)CC[N@@H+]1C[C@]1(C)CCC[NH2+]C1 ZINC000383994984 710988129 /nfs/dbraw/zinc/98/81/29/710988129.db2.gz AATPGSLGIGAVAH-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP CSC(C)(C)CC[NH2+]CCn1ccnc1C ZINC000385346671 711011729 /nfs/dbraw/zinc/01/17/29/711011729.db2.gz ZLVHWFQZYGGYGO-UHFFFAOYSA-N 2 0 241.404 2.313 20 0 BEADRP C[C@H]([N@H+](C)C[C@@]1(C)CCC[NH2+]C1)C1(C)CC1 ZINC000385467757 711013439 /nfs/dbraw/zinc/01/34/39/711013439.db2.gz ORWSYBSOILDMJJ-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@H]2[C@@H]3[NH2+]C[C@H]4C[C@H]2C[C@H]34)[C@H]1C ZINC000385667814 711016222 /nfs/dbraw/zinc/01/62/22/711016222.db2.gz YSVWIGMYPGDVSZ-XMMDLHNASA-N 2 0 248.414 2.397 20 0 BEADRP C[C@@H]([NH3+])CN(C)CC[C@H](C)c1ccccc1 ZINC000390257110 711109669 /nfs/dbraw/zinc/10/96/69/711109669.db2.gz XESDDBMZYRPISB-QWHCGFSZSA-N 2 0 220.360 2.459 20 0 BEADRP CC(C)CC1(C[NH2+][C@H]2[C@@H]3[NH2+]C[C@H]4C[C@H]2C[C@H]34)CC1 ZINC000391779706 711140007 /nfs/dbraw/zinc/14/00/07/711140007.db2.gz NCIXOTNFMNTPQA-XPABHHOTSA-N 2 0 248.414 2.399 20 0 BEADRP CC(C)CC1(C[NH2+][C@H]2[C@@H]3[NH2+]C[C@@H]4C[C@H]2C[C@@H]43)CC1 ZINC000391779698 711140614 /nfs/dbraw/zinc/14/06/14/711140614.db2.gz NCIXOTNFMNTPQA-BTFPBAQTSA-N 2 0 248.414 2.399 20 0 BEADRP CC1(C)CCC[C@@H]1[NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23 ZINC000392859075 711153050 /nfs/dbraw/zinc/15/30/50/711153050.db2.gz DGEDSFVGFFMQPT-XNBXPENISA-N 2 0 234.387 2.151 20 0 BEADRP [NH3+]CC[C@H]1CCC[N@H+](CCCC2CC2)C1 ZINC000394493368 711194068 /nfs/dbraw/zinc/19/40/68/711194068.db2.gz LRVFNSOINNWDTL-CYBMUJFWSA-N 2 0 210.365 2.237 20 0 BEADRP C1[NH2+][C@H]2[C@H]([NH2+]C3CCCCCC3)[C@H]3C[C@@H]1[C@@H]2C3 ZINC000392980159 711154615 /nfs/dbraw/zinc/15/46/15/711154615.db2.gz ZRDJTCPUMGSHSK-XSXPHNMFSA-N 2 0 234.387 2.295 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@@H]2CCCC2(F)F)CC1 ZINC000398008597 711400100 /nfs/dbraw/zinc/40/01/00/711400100.db2.gz RKQSOCWGTYVIGY-LLVKDONJSA-N 2 0 232.318 2.106 20 0 BEADRP C(C[N@@H+]1CCC2(C1)CC[NH2+]CC2)C1CCC1 ZINC000398647561 711413583 /nfs/dbraw/zinc/41/35/83/711413583.db2.gz AGZFNSHGZXUCEV-UHFFFAOYSA-N 2 0 222.376 2.252 20 0 BEADRP CC[C@@H]1[C@H](C)CC[N@@H+]1CCC[NH2+]C1CC1 ZINC000383629484 710984051 /nfs/dbraw/zinc/98/40/51/710984051.db2.gz VPBUXESKMDTAMC-DGCLKSJQSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H]1CCSCC[N@@H+]1C[C@@]1(C)CCC[NH2+]C1 ZINC000385583960 711014197 /nfs/dbraw/zinc/01/41/97/711014197.db2.gz XYKQVEMFCLBLRE-OLZOCXBDSA-N 2 0 242.432 2.204 20 0 BEADRP CS[C@@H]1CC[C@H]([NH2+][C@H](C)[C@@H]2CCCC[NH2+]2)C1 ZINC000386552793 711032834 /nfs/dbraw/zinc/03/28/34/711032834.db2.gz HGUTYKXJBXOMLM-XQHKEYJVSA-N 2 0 242.432 2.391 20 0 BEADRP C[C@@H]1C[C@H](C)[N@H+](CCCC2CC2)C[C@H]1C[NH3+] ZINC000397476385 711384281 /nfs/dbraw/zinc/38/42/81/711384281.db2.gz HFQJAQPCDHNTBE-MBNYWOFBSA-N 2 0 224.392 2.482 20 0 BEADRP C([NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32)C1CCCCC1 ZINC000383232507 711481630 /nfs/dbraw/zinc/48/16/30/711481630.db2.gz BNUYGRPQEJXIQG-BTFPBAQTSA-N 2 0 234.387 2.153 20 0 BEADRP [NH3+]C[C@@H]1CC[N@H+](CCSc2ccccc2)C1 ZINC000050249346 711493642 /nfs/dbraw/zinc/49/36/42/711493642.db2.gz UKEZDFJHILYANW-LBPRGKRZSA-N 2 0 236.384 2.059 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH+]1CCC([C@H]2CCC[NH2+]2)CC1 ZINC000723087467 711501467 /nfs/dbraw/zinc/50/14/67/711501467.db2.gz FRWZLGUZCBYLAC-VHDGCEQUSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H](C[NH2+][C@H]1CCCC2(CC2)C1)C[NH+](C)C ZINC000723560995 711517910 /nfs/dbraw/zinc/51/79/10/711517910.db2.gz VLBUHXOTRUCWKF-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1CC[NH3+] ZINC000723608751 711525143 /nfs/dbraw/zinc/52/51/43/711525143.db2.gz QYVHEEKPHOBNCG-TZMCWYRMSA-N 2 0 218.344 2.103 20 0 BEADRP C([NH2+][C@H]1CC[C@H]2CCCC[C@@H]2C1)C1C[NH2+]C1 ZINC000723659715 711532436 /nfs/dbraw/zinc/53/24/36/711532436.db2.gz VMXVIGOOHJIIJV-MCIONIFRSA-N 2 0 222.376 2.154 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[N@@H+]1CC[C@H](CC[NH3+])C1 ZINC000723678356 711534139 /nfs/dbraw/zinc/53/41/39/711534139.db2.gz JZZPOORMCCEWGF-HZSPNIEDSA-N 2 0 224.392 2.483 20 0 BEADRP Cc1cc(C)nc(C[N@@H+]2CCC[C@H](CC[NH3+])C2)c1 ZINC000723846369 711538919 /nfs/dbraw/zinc/53/89/19/711538919.db2.gz RGEKRTOFARIMDP-CQSZACIVSA-N 2 0 247.386 2.259 20 0 BEADRP Cc1cc(C)nc(C[N@H+]2C[C@@H](C)[C@H](CC[NH3+])C2)c1 ZINC000723879485 711541941 /nfs/dbraw/zinc/54/19/41/711541941.db2.gz PAGFVOMLOPMFCA-TZMCWYRMSA-N 2 0 247.386 2.115 20 0 BEADRP COc1cccc(C[N@@H+]2C[C@@H](C)[C@H](CC[NH3+])C2)c1 ZINC000723901044 711544046 /nfs/dbraw/zinc/54/40/46/711544046.db2.gz MKRZYCZAOARFJG-TZMCWYRMSA-N 2 0 248.370 2.112 20 0 BEADRP C[C@@H]1C[N@H+](Cc2ccc(F)cc2)C[C@H]1CC[NH3+] ZINC000723909609 711544628 /nfs/dbraw/zinc/54/46/28/711544628.db2.gz RKGNYBHOJIELBH-DGCLKSJQSA-N 2 0 236.334 2.242 20 0 BEADRP C[C@@H]1C[N@H+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)C[C@H]1CC[NH3+] ZINC000723902478 711544764 /nfs/dbraw/zinc/54/47/64/711544764.db2.gz OYLXSTVZMYINIB-RYPNDVFKSA-N 2 0 236.403 2.339 20 0 BEADRP C[C@@H]1C[N@H+](CCC2CCC2)C[C@H]1CC[NH3+] ZINC000723902249 711545250 /nfs/dbraw/zinc/54/52/50/711545250.db2.gz NVIGIAKQIZCGKL-DGCLKSJQSA-N 2 0 210.365 2.093 20 0 BEADRP C[C@@H]1C[N@H+](C[C@@H]2CC[C@H]3C[C@H]3C2)C[C@H]1CC[NH3+] ZINC000723929565 711545854 /nfs/dbraw/zinc/54/58/54/711545854.db2.gz OYLXSTVZMYINIB-UXXRCYHCSA-N 2 0 236.403 2.339 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCC[C@H]([NH3+])C1)[C@H]1CCCOC1 ZINC000723986898 711550981 /nfs/dbraw/zinc/55/09/81/711550981.db2.gz LXDNEZGPUBYMJK-FQUUOJAGSA-N 2 0 240.391 2.051 20 0 BEADRP C1=CCC(CC[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)C1 ZINC000724127664 711563071 /nfs/dbraw/zinc/56/30/71/711563071.db2.gz ACJNPBJNIOCOKO-RBSFLKMASA-N 2 0 234.387 2.320 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]CCC2CC=CC2)C12CCC2 ZINC000724221182 711570420 /nfs/dbraw/zinc/57/04/20/711570420.db2.gz ZELNLUKWMXSHKQ-CHWSQXEVSA-N 2 0 220.360 2.202 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32 ZINC000383374307 711646047 /nfs/dbraw/zinc/64/60/47/711646047.db2.gz ZNXOWAFXCQOQNO-SRGUQECISA-N 2 0 234.387 2.151 20 0 BEADRP CSC1CC([NH2+]Cc2ccc3c[nH+]cn3c2)C1 ZINC000926566987 711650698 /nfs/dbraw/zinc/65/06/98/711650698.db2.gz IUWVYGXVQRWSHF-UHFFFAOYSA-N 2 0 247.367 2.318 20 0 BEADRP CC[N@H+](C)C[C@@H]1CCN(C/C=C/Cl)C1 ZINC000177838624 711672376 /nfs/dbraw/zinc/67/23/76/711672376.db2.gz RBEMUYUFAXJCER-MALLOTDXSA-N 2 0 216.756 2.013 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@H](C)C(F)(F)F)CC1 ZINC000309473274 711698399 /nfs/dbraw/zinc/69/83/99/711698399.db2.gz RDLAQNWFCACMRT-VIFPVBQESA-N 2 0 238.297 2.259 20 0 BEADRP CCCC[NH2+]C[C@H](C(C)C)[NH+]1CCCC1 ZINC000020200897 711708106 /nfs/dbraw/zinc/70/81/06/711708106.db2.gz FSIBBZPZTOOYRL-CYBMUJFWSA-N 2 0 212.381 2.497 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]CC2CCC(F)CC2)C12CCC2 ZINC000925711290 711711433 /nfs/dbraw/zinc/71/14/33/711711433.db2.gz LYIQHEJDUNLJEV-TYUFSLCMSA-N 2 0 240.366 2.374 20 0 BEADRP C(C1CCCC1)[N@@H+]1CC[C@@]2(C1)CCCC[NH2+]2 ZINC000257644389 711720699 /nfs/dbraw/zinc/72/06/99/711720699.db2.gz BSCDKGGUBMQOAC-CQSZACIVSA-N 2 0 222.376 2.395 20 0 BEADRP C[C@H]1[C@H]2CC[C@@H](C[C@@H]1[NH2+][C@@H]1CCCC[C@@H]1F)[NH2+]2 ZINC000925724578 711728394 /nfs/dbraw/zinc/72/83/94/711728394.db2.gz BJQKLKFLGOSPGD-QQKNPXLJSA-N 2 0 240.366 2.386 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@@H]1CC[C@H](C2CC2)O1 ZINC000722316083 711735033 /nfs/dbraw/zinc/73/50/33/711735033.db2.gz LGQYWENUHGKRHD-KWCYVHTRSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CC[C@@H]2C[NH2+]C[C@H]2C)C1 ZINC000722552710 711761288 /nfs/dbraw/zinc/76/12/88/711761288.db2.gz BKHOEIDBRBZLAU-FDYHWXHSSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+]CC[C@@H]2C[NH2+]C[C@H]2C)C1 ZINC000722552716 711761335 /nfs/dbraw/zinc/76/13/35/711761335.db2.gz BKHOEIDBRBZLAU-UMSGYPCISA-N 2 0 210.365 2.010 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+]CCC1CCC1 ZINC000229077850 711837597 /nfs/dbraw/zinc/83/75/97/711837597.db2.gz GEQFMEZOYWFATQ-CHWSQXEVSA-N 2 0 210.365 2.284 20 0 BEADRP CC(C)C1(C[NH2+][C@@H]2CCC[C@@H]2C[NH3+])CC1 ZINC000232720892 711845517 /nfs/dbraw/zinc/84/55/17/711845517.db2.gz COTHKTSTCQJBRA-VXGBXAGGSA-N 2 0 210.365 2.140 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+]CCC2(F)CCC2)C12CCC2 ZINC000705282021 711900680 /nfs/dbraw/zinc/90/06/80/711900680.db2.gz XINIDPRJMIMLHU-WDEREUQCSA-N 2 0 226.339 2.128 20 0 BEADRP CSC[C@H]1CCC[N@@H+]1C[C@@H]1CCCC[NH2+]C1 ZINC000700271366 711989287 /nfs/dbraw/zinc/98/92/87/711989287.db2.gz AVROYTOTEGKLJQ-CHWSQXEVSA-N 2 0 242.432 2.204 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@H]2C=CCC2)CC1 ZINC000700503910 711995019 /nfs/dbraw/zinc/99/50/19/711995019.db2.gz XAIFLVRXUNWXEY-LBPRGKRZSA-N 2 0 208.349 2.167 20 0 BEADRP C[N@@H+]1CCCC[C@H](C[NH2+]C[C@H]2CCC=CO2)C1 ZINC000700812280 712006894 /nfs/dbraw/zinc/00/68/94/712006894.db2.gz HRXWHALCXXTDFG-ZIAGYGMSSA-N 2 0 238.375 2.001 20 0 BEADRP C[C@H]([NH2+]C[C@]1(C)CC1(C)C)[C@@H]1CCC[NH2+]1 ZINC000701943245 712032796 /nfs/dbraw/zinc/03/27/96/712032796.db2.gz ITSYDYRSSIATMW-GVXVVHGQSA-N 2 0 210.365 2.153 20 0 BEADRP CC1(C)C[C@]1(C)C[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000701986306 712035212 /nfs/dbraw/zinc/03/52/12/712035212.db2.gz NWLFNIWKRXJCNJ-NQBHXWOUSA-N 2 0 210.365 2.282 20 0 BEADRP CC1(C)C[C@]1(C)C[NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32 ZINC000701986355 712035248 /nfs/dbraw/zinc/03/52/48/712035248.db2.gz OBNIBRQJMDHROC-AQLBILIWSA-N 2 0 234.387 2.009 20 0 BEADRP CC1(C)C[C@]1(C)C[NH2+][C@H]1C[C@@H]([NH3+])C12CCC2 ZINC000702000064 712036076 /nfs/dbraw/zinc/03/60/76/712036076.db2.gz BHQIZRHNGHRIJT-NTZNESFSSA-N 2 0 222.376 2.282 20 0 BEADRP CC1(C)CC(C[NH2+][C@H]2C[C@H]([NH3+])C23CCC3)C1 ZINC000702008082 712036777 /nfs/dbraw/zinc/03/67/77/712036777.db2.gz UFCLKWPIZRBXSI-RYUDHWBXSA-N 2 0 222.376 2.282 20 0 BEADRP CCCCCC[N@@H+]1C[C@@H]2C[NH2+]C[C@]2(C)C1 ZINC000702119062 712039477 /nfs/dbraw/zinc/03/94/77/712039477.db2.gz CUHPXWUOQIHPKP-QWHCGFSZSA-N 2 0 210.365 2.108 20 0 BEADRP FC1(F)CCC[N@H+](CCC[NH2+]C2CC2)CC1 ZINC000702834394 712061366 /nfs/dbraw/zinc/06/13/66/712061366.db2.gz DJBPJNYYWMSIMQ-UHFFFAOYSA-N 2 0 232.318 2.250 20 0 BEADRP C[C@H]1CCCC[N@H+](C[C@H]2CCCC[NH2+]C2)C1 ZINC000703211901 712068419 /nfs/dbraw/zinc/06/84/19/712068419.db2.gz HRWDVYVROHUVLB-KBPBESRZSA-N 2 0 224.392 2.498 20 0 BEADRP Cc1ccsc1C[N@@H+]1C[C@@H]2C[NH2+]C[C@]2(C)C1 ZINC000703538671 712078837 /nfs/dbraw/zinc/07/88/37/712078837.db2.gz PUNNPEIBZKGNGT-WCQYABFASA-N 2 0 236.384 2.098 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]CC[C@@H]1CCSC1 ZINC000704797964 712117850 /nfs/dbraw/zinc/11/78/50/712117850.db2.gz OHMRMFJRKQRKCX-FRRDWIJNSA-N 2 0 242.432 2.237 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]C[C@H]2CCCC23CC3)C12CCC2 ZINC000706300029 712144586 /nfs/dbraw/zinc/14/45/86/712144586.db2.gz XPQVGXFPLBZOGX-UPJWGTAASA-N 2 0 234.387 2.426 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]C[C@@H]2CCCC23CC3)C12CCC2 ZINC000706300031 712144606 /nfs/dbraw/zinc/14/46/06/712144606.db2.gz XPQVGXFPLBZOGX-XQQFMLRXSA-N 2 0 234.387 2.426 20 0 BEADRP CC[N@H+](CCC[NH2+]C1CC1)[C@@H](C)C(C)C ZINC000706481197 712147502 /nfs/dbraw/zinc/14/75/02/712147502.db2.gz QLNZUHYTADAENI-LBPRGKRZSA-N 2 0 212.381 2.495 20 0 BEADRP C[C@@H]1C[N@H+](C[C@H]2CCC[C@H](C)C2)C[C@H]1C[NH3+] ZINC000708208571 712183777 /nfs/dbraw/zinc/18/37/77/712183777.db2.gz YKJLQUOWKUPZSJ-RFQIPJPRSA-N 2 0 224.392 2.339 20 0 BEADRP CCC[C@H]1C[N@H+](CCCCCCC[NH3+])CCO1 ZINC000708896437 712202474 /nfs/dbraw/zinc/20/24/74/712202474.db2.gz DEZOFMWXTJWKSM-AWEZNQCLSA-N 2 0 242.407 2.397 20 0 BEADRP C[C@H](C[N@@H+]1CCCO[C@@H](C[NH3+])C1)CC(C)(C)C ZINC000709179894 712204449 /nfs/dbraw/zinc/20/44/49/712204449.db2.gz VCHZTLBBVNVQNA-STQMWFEESA-N 2 0 242.407 2.108 20 0 BEADRP C[C@@H](C[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1)CC(C)(C)C ZINC000709121834 712209233 /nfs/dbraw/zinc/20/92/33/712209233.db2.gz GQAIAHUKIZPULE-UPJWGTAASA-N 2 0 224.392 2.210 20 0 BEADRP C[C@@H]1[C@H]2CC[C@@H](C[C@@H]1[NH2+][C@H]1CC13CCCC3)[NH2+]2 ZINC000709389786 712220865 /nfs/dbraw/zinc/22/08/65/712220865.db2.gz SPWJAIZIYQRGNT-BJJPWKGXSA-N 2 0 234.387 2.438 20 0 BEADRP C[C@H]1[C@H]2CC[C@@H](C[C@@H]1[NH2+]C1CCCCC1)[NH2+]2 ZINC000709432882 712221643 /nfs/dbraw/zinc/22/16/43/712221643.db2.gz FSUALWQUPCACLV-DEQVHRJGSA-N 2 0 222.376 2.438 20 0 BEADRP C([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)[C@]12C[C@H]1CCC2 ZINC000709424037 712221761 /nfs/dbraw/zinc/22/17/61/712221761.db2.gz MSLCIPQGTWNDFS-YIPFDTCYSA-N 2 0 220.360 2.049 20 0 BEADRP C[C@@H]1[C@H]2CC[C@@H](C[C@@H]1[NH2+][C@@H]1CC=CCC1)[NH2+]2 ZINC000709436641 712222010 /nfs/dbraw/zinc/22/20/10/712222010.db2.gz MEXTWBRWVZWUTQ-RGDJUOJXSA-N 2 0 220.360 2.214 20 0 BEADRP C[C@@]1(C(F)(F)F)CCN(CC23CC(C2)C[NH2+]3)C1 ZINC000709637721 712226306 /nfs/dbraw/zinc/22/63/06/712226306.db2.gz KPXYEPNVADPXIF-HSOILSAZSA-N 2 0 248.292 2.013 20 0 BEADRP [NH3+][C@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccc(F)cc1)C2 ZINC000709839952 712229457 /nfs/dbraw/zinc/22/94/57/712229457.db2.gz ZVTFALRIYXVHNJ-UBHSHLNASA-N 2 0 234.318 2.137 20 0 BEADRP C([C@@H]1CC[C@H]2C[C@H]2C1)[N@@H+]1CC[C@@]2(C1)CCC[NH2+]C2 ZINC000709893794 712231263 /nfs/dbraw/zinc/23/12/63/712231263.db2.gz VAUDDRZCPDJDIT-QXSJWSMHSA-N 2 0 248.414 2.498 20 0 BEADRP C[C@H](CC1CCC1)[NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23 ZINC000710264560 712250380 /nfs/dbraw/zinc/25/03/80/712250380.db2.gz XBVIBKPAJICNIK-KJCZUFAUSA-N 2 0 234.387 2.151 20 0 BEADRP Cc1ncccc1C[N@H+](C)CCCCCC[NH3+] ZINC000710706692 712254936 /nfs/dbraw/zinc/25/49/36/712254936.db2.gz WZTFBLDFFQVDQH-UHFFFAOYSA-N 2 0 235.375 2.341 20 0 BEADRP COCC(C)(C)C[N@H+](C)CCCCCC[NH3+] ZINC000710798662 712257285 /nfs/dbraw/zinc/25/72/85/712257285.db2.gz LAHTWOWQZXCCFX-UHFFFAOYSA-N 2 0 230.396 2.110 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH2+][C@H]2C[C@@H]3CC[C@@H](C3)C2)C1 ZINC000711204762 712289164 /nfs/dbraw/zinc/28/91/64/712289164.db2.gz TXJKOQQCAQSMJR-LJISPDSOSA-N 2 0 236.403 2.497 20 0 BEADRP FC[C@@H]1CC[N@H+](Cc2ccc3c(c2)C[NH2+]CC3)C1 ZINC000711511846 712308271 /nfs/dbraw/zinc/30/82/71/712308271.db2.gz FLWNALPTNBNEKH-ZDUSSCGKSA-N 2 0 248.345 2.124 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@H]2C=CCC2)CC1 ZINC000711670534 712315722 /nfs/dbraw/zinc/31/57/22/712315722.db2.gz VXHNCAYMNNGETC-LBPRGKRZSA-N 2 0 208.349 2.027 20 0 BEADRP CCC[NH+]1CCC([NH2+]C[C@H]2C=CCC2)CC1 ZINC000711730371 712320092 /nfs/dbraw/zinc/32/00/92/712320092.db2.gz OECQAMRBSHWFBF-ZDUSSCGKSA-N 2 0 222.376 2.417 20 0 BEADRP C1=C[C@H](C[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)CC1 ZINC000711790618 712331071 /nfs/dbraw/zinc/33/10/71/712331071.db2.gz ZKIPUQDUEIALNL-GBJTYRQASA-N 2 0 234.387 2.463 20 0 BEADRP [NH3+]CC[C@@H]1CC[N@H+](Cc2ccc3cc[nH]c3c2)C1 ZINC000923479454 712334532 /nfs/dbraw/zinc/33/45/32/712334532.db2.gz PCJQJFZLCGIDLC-GFCCVEGCSA-N 2 0 243.354 2.339 20 0 BEADRP Cc1cc(C)c(C[N@@H+]2CC[C@H](CC[NH3+])C2)c(C)n1 ZINC000923478711 712334751 /nfs/dbraw/zinc/33/47/51/712334751.db2.gz HNYHODHMFVRNHE-AWEZNQCLSA-N 2 0 247.386 2.178 20 0 BEADRP C[C@@H]1c2sccc2CC[N@H+]1C[C@@H]1CC[NH2+]C1 ZINC000712263436 712344937 /nfs/dbraw/zinc/34/49/37/712344937.db2.gz HMKZIFCVDRJGEU-GHMZBOCLSA-N 2 0 236.384 2.277 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@H]1CCC[C@@H]2C[C@@H]21 ZINC000378907012 712367063 /nfs/dbraw/zinc/36/70/63/712367063.db2.gz ZNMRCCKAFUCEGM-NDBYEHHHSA-N 2 0 210.365 2.105 20 0 BEADRP CSC(C)(C)C[NH2+][C@H](C)CCCC[NH3+] ZINC000379523756 712387062 /nfs/dbraw/zinc/38/70/62/712387062.db2.gz FEOYBTPEOXTQHN-SNVBAGLBSA-N 2 0 218.410 2.235 20 0 BEADRP C[C@H]1CSCC[N@H+](C[C@]2(C)CCC[NH2+]C2)C1 ZINC000379538597 712387474 /nfs/dbraw/zinc/38/74/74/712387474.db2.gz DRSYCTADWCUIAM-CHWSQXEVSA-N 2 0 242.432 2.061 20 0 BEADRP CC1(C)CC[C@H]1[NH2+]C[C@@H]1CCCCC[NH2+]1 ZINC000379789845 712399421 /nfs/dbraw/zinc/39/94/21/712399421.db2.gz IXOQCAZXQPKGDP-NWDGAFQWSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]([NH2+][C@H](C)C1(C)CC1)C1CC[NH+](C)CC1 ZINC000390516477 712420081 /nfs/dbraw/zinc/42/00/81/712420081.db2.gz DBRSWKKCMHEYBG-VXGBXAGGSA-N 2 0 224.392 2.495 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H]2C[C@@H]3CCCC[C@H]23)C1 ZINC000712370886 712428232 /nfs/dbraw/zinc/42/82/32/712428232.db2.gz ANJWLCCQJNMVLR-ZUWCUPBKSA-N 2 0 222.376 2.425 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+][C@@H]1C[C@@H]2CCCC[C@H]12 ZINC000712378710 712428701 /nfs/dbraw/zinc/42/87/01/712428701.db2.gz RHUPXNVQXLIWRY-QSLWVIQJSA-N 2 0 222.376 2.282 20 0 BEADRP C(C[C@@H]1C[C@H]1C1CC1)[NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32 ZINC000712677379 712440512 /nfs/dbraw/zinc/44/05/12/712440512.db2.gz ZYJRJGOPAUGYLT-UQYNZRTDSA-N 2 0 246.398 2.009 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]CC[C@@H]1C[C@H]1C1CC1 ZINC000712734926 712448796 /nfs/dbraw/zinc/44/87/96/712448796.db2.gz RYJIZSMDSREMEA-RFGFWPKPSA-N 2 0 222.376 2.140 20 0 BEADRP C[C@@H]1C[C@@H]([NH3+])CC[N@@H+]1C[C@@H]1CCC(C)(C)CO1 ZINC000713583869 712465922 /nfs/dbraw/zinc/46/59/22/712465922.db2.gz BITKUTMHQNPWJR-AGIUHOORSA-N 2 0 240.391 2.003 20 0 BEADRP C=C/C=C\CC[N@@H+]1C[C@@]2(C)C[NH2+]C[C@@]2(C)C1 ZINC000713640269 712467875 /nfs/dbraw/zinc/46/78/75/712467875.db2.gz FJVKZSNFYFOAIF-YOQOKRQFSA-N 2 0 220.360 2.050 20 0 BEADRP C=C/C=C/CC[N@H+]1CCC[C@H]([C@@H](C)[NH3+])C1 ZINC000713700480 712469193 /nfs/dbraw/zinc/46/91/93/712469193.db2.gz CENYBCZWMXCIQY-DRHCNIFCSA-N 2 0 208.349 2.178 20 0 BEADRP C=C/C=C\CC[NH+]1CCC([C@H](C)[NH3+])CC1 ZINC000713705419 712469669 /nfs/dbraw/zinc/46/96/69/712469669.db2.gz XCISGBPRDPQBJQ-RXNFCKPNSA-N 2 0 208.349 2.178 20 0 BEADRP C=C/C=C/CC[NH+]1CCC(C[NH2+]C)CC1 ZINC000713735115 712470355 /nfs/dbraw/zinc/47/03/55/712470355.db2.gz MJCSCQAZRPJMOZ-SNAWJCMRSA-N 2 0 208.349 2.050 20 0 BEADRP C=C/C=C/CC[N@@H+]1CC[NH2+]CCC12CCC2 ZINC000713756966 712471781 /nfs/dbraw/zinc/47/17/81/712471781.db2.gz XNUUPSRQYYQRKD-ONEGZZNKSA-N 2 0 220.360 2.337 20 0 BEADRP C[C@@]1(C[NH3+])CC[N@H+](C[C@H]2CCCC(C)(C)O2)C1 ZINC000714375221 712484490 /nfs/dbraw/zinc/48/44/90/712484490.db2.gz SEHQGDIAUYSEIS-OCCSQVGLSA-N 2 0 240.391 2.005 20 0 BEADRP COCC[C@@H](C)[NH+]1CCC(C(C)(C)C[NH3+])CC1 ZINC000714442754 712489362 /nfs/dbraw/zinc/48/93/62/712489362.db2.gz AMHWTLYUJMRBMF-GFCCVEGCSA-N 2 0 242.407 2.108 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]2C[N@H+](CC[C@@H]3C[C@H]3C3CC3)C[C@@H]21 ZINC000714930387 712500663 /nfs/dbraw/zinc/50/06/63/712500663.db2.gz ARNQLCQEWQEYMJ-OLMNGRFOSA-N 2 0 248.414 2.482 20 0 BEADRP C[C@@H]([NH3+])C1CC[NH+](CC[C@@H]2C[C@H]2C2CC2)CC1 ZINC000714834092 712501009 /nfs/dbraw/zinc/50/10/09/712501009.db2.gz VYOFIGQBOMLAPI-DFBGVHRSSA-N 2 0 236.403 2.482 20 0 BEADRP CC[C@H]1C[N@H+](CC[C@@H]2C[C@H]2C2CC2)CC[C@@H]1[NH3+] ZINC000714833102 712501377 /nfs/dbraw/zinc/50/13/77/712501377.db2.gz RZKKEVAVSHJDMS-ATGSNQNLSA-N 2 0 236.403 2.482 20 0 BEADRP C[NH+](C)C1(C)CCC([NH2+]Cc2ccon2)CC1 ZINC000715250822 712514270 /nfs/dbraw/zinc/51/42/70/712514270.db2.gz BLNQFFDKIVQDDM-UHFFFAOYSA-N 2 0 237.347 2.027 20 0 BEADRP CC(C)C[NH2+]C1CCC(C)([NH+](C)C)CC1 ZINC000715489603 712522703 /nfs/dbraw/zinc/52/27/03/712522703.db2.gz DYYSBWXGOQIVAQ-UHFFFAOYSA-N 2 0 212.381 2.495 20 0 BEADRP C[NH+](C)C1CCC([NH2+]C[C@H]2CCC=CO2)CC1 ZINC000715489036 712523024 /nfs/dbraw/zinc/52/30/24/712523024.db2.gz BPNGUVAJPORTPP-JXQTWKCFSA-N 2 0 238.375 2.142 20 0 BEADRP C[C@@H]1C[C@H]1C[NH2+]C1CCC(C)([NH+](C)C)CC1 ZINC000715491936 712523033 /nfs/dbraw/zinc/52/30/33/712523033.db2.gz RIBJFLZSAVSULW-KBHBFKLGSA-N 2 0 224.392 2.495 20 0 BEADRP CSC1CC([NH2+]C2CCC([NH+](C)C)CC2)C1 ZINC000715543981 712527071 /nfs/dbraw/zinc/52/70/71/712527071.db2.gz PJUHELMMYQSYAV-UHFFFAOYSA-N 2 0 242.432 2.343 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]CC[C@@H]1CCCS1 ZINC000715600094 712527746 /nfs/dbraw/zinc/52/77/46/712527746.db2.gz ICKMLSBPIRKXSS-AVGNSLFASA-N 2 0 242.432 2.379 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@H]1[C@H]1C[C@H]1C)[C@H]1CCC[NH2+]1 ZINC000716528238 712567154 /nfs/dbraw/zinc/56/71/54/712567154.db2.gz DIGXXSRXGWHEFE-QQOHENMQSA-N 2 0 222.376 2.009 20 0 BEADRP C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000716622807 712568023 /nfs/dbraw/zinc/56/80/23/712568023.db2.gz JMZLDYSGVHZZMN-HHEPCMPZSA-N 2 0 248.414 2.493 20 0 BEADRP C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000716639554 712568488 /nfs/dbraw/zinc/56/84/88/712568488.db2.gz VZPXEEGEBCECHF-SDSMMKDESA-N 2 0 248.414 2.495 20 0 BEADRP CC[C@H](C)[C@@H](C)[NH2+]C[C@H]1C[NH2+]CCC1(F)F ZINC000717045338 712624779 /nfs/dbraw/zinc/62/47/79/712624779.db2.gz HYWJFQHLZIVSFX-HBNTYKKESA-N 2 0 234.334 2.255 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]CC[C@@H]1CC[C@@H]2C[C@@H]21 ZINC000717070359 712628023 /nfs/dbraw/zinc/62/80/23/712628023.db2.gz SFASGJXIUSGEIX-VJTDZRGJSA-N 2 0 222.376 2.140 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CC[C@@H]1CC(C)(C)CO1 ZINC000717291427 712645398 /nfs/dbraw/zinc/64/53/98/712645398.db2.gz JVMNOSJANFULTC-QWHCGFSZSA-N 2 0 242.407 2.299 20 0 BEADRP CC1(C)CC[C@H]1[NH2+]C[C@@H]1C[NH2+]CCC1(F)F ZINC000717305469 712645981 /nfs/dbraw/zinc/64/59/81/712645981.db2.gz NVFCCPNPVNIXGJ-VHSXEESVSA-N 2 0 232.318 2.009 20 0 BEADRP CC[C@@]1(C)CC[N@H+](C[C@@H]2CC[C@H]([NH3+])C2)C1 ZINC000717970622 712736117 /nfs/dbraw/zinc/73/61/17/712736117.db2.gz PZPCTBPFMUTAJJ-AGIUHOORSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@@H]([NH2+]C1CCC=CCC1)[C@@H]1CCC[NH2+]1 ZINC000718020720 712736764 /nfs/dbraw/zinc/73/67/64/712736764.db2.gz VVZIAKPUBUUPTQ-YPMHNXCESA-N 2 0 208.349 2.215 20 0 BEADRP Cc1coc(C[NH2+]CCCC[NH+](C)C)c1 ZINC000718115036 712743881 /nfs/dbraw/zinc/74/38/81/712743881.db2.gz PIFBXMCOHFWXIO-UHFFFAOYSA-N 2 0 210.321 2.019 20 0 BEADRP CC(F)(F)CCC[N@@H+]1CCC[C@@H](CC[NH3+])C1 ZINC000718568319 712774272 /nfs/dbraw/zinc/77/42/72/712774272.db2.gz ATBKWNAMVPEMSP-NSHDSACASA-N 2 0 234.334 2.483 20 0 BEADRP CC(F)(F)CCC[N@@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000718570690 712774713 /nfs/dbraw/zinc/77/47/13/712774713.db2.gz KDBQLODOGWYQFE-UHFFFAOYSA-N 2 0 246.345 2.497 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCSC1)C[NH+]1CCCCC1 ZINC000038041654 712801459 /nfs/dbraw/zinc/80/14/59/712801459.db2.gz GIKKLCGTDAZDLJ-OLZOCXBDSA-N 2 0 242.432 2.204 20 0 BEADRP CSC1CCC(C[NH2+][C@@H](C)C2C[NH2+]C2)CC1 ZINC000720536172 712849635 /nfs/dbraw/zinc/84/96/35/712849635.db2.gz JGGWKQOPLDMFMV-ZBOXLXRLSA-N 2 0 242.432 2.106 20 0 BEADRP C[C@H]1CCCC[C@@H]1C[N@@H+]1C[C@@H]2C[NH2+]C[C@]2(C)C1 ZINC000720658028 712860889 /nfs/dbraw/zinc/86/08/89/712860889.db2.gz QXZQGFANMWHGIB-LJISPDSOSA-N 2 0 236.403 2.354 20 0 BEADRP CC1(C[NH2+][C@H]2C[C@@H]([NH3+])C23CCC3)CC(F)(F)C1 ZINC000720900592 712875294 /nfs/dbraw/zinc/87/52/94/712875294.db2.gz ODXNAWZYZVVONG-ZJUUUORDSA-N 2 0 244.329 2.281 20 0 BEADRP CCO[C@@H]1CCC[C@H]([NH2+][C@@H](C)CC[NH+](C)C)C1 ZINC000721169975 712894795 /nfs/dbraw/zinc/89/47/95/712894795.db2.gz WJTADHOUQCEKJG-MELADBBJSA-N 2 0 242.407 2.264 20 0 BEADRP CS[C@H](C)CC[NH+]1CCC2(C[NH+](C)C2)CC1 ZINC001208155992 957036468 /nfs/dbraw/zinc/03/64/68/957036468.db2.gz USMFHAZGALPGSU-GFCCVEGCSA-N 2 0 242.432 2.156 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H](C[NH2+]C2CCCCC2)C1 ZINC000398808948 958396403 /nfs/dbraw/zinc/39/64/03/958396403.db2.gz OPXNYVQNCMMJFS-NWDGAFQWSA-N 2 0 210.365 2.154 20 0 BEADRP CC(C)[C@@H]1CCC[N@H+](C[C@H]2C[C@@H]([NH3+])C2)CC1 ZINC000693541977 958735617 /nfs/dbraw/zinc/73/56/17/958735617.db2.gz BDNJKWYHELJVIR-MCIONIFRSA-N 2 0 224.392 2.482 20 0 BEADRP C[NH2+]CCC[N@H+](C)CC1CCC2(CC2)CC1 ZINC000695598969 960295092 /nfs/dbraw/zinc/29/50/92/960295092.db2.gz PUBHMHHUWBKQQC-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+]C1CCC2(CC2)CC1 ZINC000695647814 960322269 /nfs/dbraw/zinc/32/22/69/960322269.db2.gz SBYVIOADNAJCCC-NEPJUHHUSA-N 2 0 222.376 2.154 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CC[C@H]2CCC[N@@H+]2C)C1 ZINC000710448751 962379577 /nfs/dbraw/zinc/37/95/77/962379577.db2.gz ZTNXAKBDJYQRAY-JHJVBQTASA-N 2 0 210.365 2.249 20 0 BEADRP CC(C)(C[NH2+][C@H]1CCC[C@H]1C[NH3+])C(C)(F)F ZINC000696621527 963299250 /nfs/dbraw/zinc/29/92/50/963299250.db2.gz RJYLEFCIUUIXJE-UWVGGRQHSA-N 2 0 234.334 2.385 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]CC[C@@H]1CCC[N@@H+]1C ZINC000822123671 963939380 /nfs/dbraw/zinc/93/93/80/963939380.db2.gz ABJLJEBALCUXQJ-AAEUAGOBSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H](C[NH3+])C[N@H+](C)[C@@H](C)Cc1cccc(F)c1 ZINC001168465697 965811300 /nfs/dbraw/zinc/81/13/00/965811300.db2.gz VGVYVYHVFCXZTQ-RYUDHWBXSA-N 2 0 238.350 2.283 20 0 BEADRP Cc1nc(C[NH2+]CCCCCC[NH3+])cs1 ZINC000049539029 1165742052 /nfs/dbraw/zinc/74/20/52/1165742052.db2.gz UBLDCVRHDSXRLK-UHFFFAOYSA-N 2 0 227.377 2.060 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H]([NH+](C)C)C2)CCO1 ZINC000715583356 967195224 /nfs/dbraw/zinc/19/52/24/967195224.db2.gz JWTVQZNMMYOURA-SYQHCUMBSA-N 2 0 240.391 2.016 20 0 BEADRP C[N@H+](CCC[NH+]1CCCC1)CC(C)(C)C ZINC000120498482 1165842700 /nfs/dbraw/zinc/84/27/00/1165842700.db2.gz BVDCZKDRZFUBCL-UHFFFAOYSA-N 2 0 212.381 2.450 20 0 BEADRP C[C@H](CC[NH2+][C@@H]1CCCOC1)[NH+]1CCCCC1 ZINC001205391967 967619610 /nfs/dbraw/zinc/61/96/10/967619610.db2.gz XXESBNMUZGWNEF-ZIAGYGMSSA-N 2 0 240.391 2.020 20 0 BEADRP C[C@H]1CC[N@H+](CC(C)(C)C)CC[C@@H]1C[NH3+] ZINC001205599963 967717986 /nfs/dbraw/zinc/71/79/86/967717986.db2.gz ATMOFOCWWZEMDQ-NWDGAFQWSA-N 2 0 212.381 2.339 20 0 BEADRP C[C@@H](CC[NH2+][C@@H]1CCC[C@@H](C)C1)[NH+](C)C ZINC000697878751 968050425 /nfs/dbraw/zinc/05/04/25/968050425.db2.gz LMQCEVGFNWGBSM-FRRDWIJNSA-N 2 0 212.381 2.495 20 0 BEADRP Clc1ccc(C[NH2+]C[C@@H]2CC[NH2+]C2)s1 ZINC000070600357 1165930966 /nfs/dbraw/zinc/93/09/66/1165930966.db2.gz BRDYWJHINPVFOF-MRVPVSSYSA-N 2 0 230.764 2.101 20 0 BEADRP C[C@@]1(C[NH3+])CCC[N@H+](Cc2ccco2)CC1 ZINC001206296764 968197830 /nfs/dbraw/zinc/19/78/30/968197830.db2.gz URMFLIYDYKDDRJ-CYBMUJFWSA-N 2 0 222.332 2.231 20 0 BEADRP CC(C)CC[N@@H+]1CCC[C@@](C)(C[NH3+])CC1 ZINC001206292456 968200629 /nfs/dbraw/zinc/20/06/29/968200629.db2.gz BFJJCTVHWBDPMX-CYBMUJFWSA-N 2 0 212.381 2.483 20 0 BEADRP Cc1c[nH+]ccc1Nc1cc[nH+]c(N)c1 ZINC000257655423 1166067960 /nfs/dbraw/zinc/06/79/60/1166067960.db2.gz HHKXNEFTFMBBEJ-UHFFFAOYSA-N 2 0 200.245 2.111 20 0 BEADRP C[NH+](C)CC(C)(C)C[N@@H+]1CCC[C@@H]2C[C@@H]21 ZINC001207283588 968718412 /nfs/dbraw/zinc/71/84/12/968718412.db2.gz AHNKKKVETOFFJT-NEPJUHHUSA-N 2 0 210.365 2.059 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+]C[C@H]2C[NH2+]C[C@@H](C)C2)C1 ZINC000398777303 1166090174 /nfs/dbraw/zinc/09/01/74/1166090174.db2.gz HCNLDBWWCRWZKH-WUHRBBMRSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@H]2C[NH2+]C[C@@H](C)C2)C1 ZINC000398777308 1166090351 /nfs/dbraw/zinc/09/03/51/1166090351.db2.gz HCNLDBWWCRWZKH-XQHKEYJVSA-N 2 0 210.365 2.010 20 0 BEADRP C[NH+]1CCC(C[N@H+](CC2CC2)C2CC2)CC1 ZINC001207399815 968750884 /nfs/dbraw/zinc/75/08/84/968750884.db2.gz UVAQLPMDWGYOGI-UHFFFAOYSA-N 2 0 222.376 2.203 20 0 BEADRP CCC[C@H](O)C[NH2+][C@@H](C)CCC[NH+](CC)CC ZINC001252801004 968985472 /nfs/dbraw/zinc/98/54/72/968985472.db2.gz SFFNUVSRVUWLTL-KBPBESRZSA-N 2 0 244.423 2.248 20 0 BEADRP CCC[N@H+](CCOC)CC1(C)CC[NH+](C)CC1 ZINC001208102319 968999739 /nfs/dbraw/zinc/99/97/39/968999739.db2.gz DVOOTVSIDMSOSV-UHFFFAOYSA-N 2 0 242.407 2.077 20 0 BEADRP CC[N@H+](CC1(C)CC[NH+](C)CC1)C1CC1 ZINC001208104992 969004083 /nfs/dbraw/zinc/00/40/83/969004083.db2.gz QIBLSFSOSBVGFF-UHFFFAOYSA-N 2 0 210.365 2.203 20 0 BEADRP CS[C@@H](C)CC[N@H+](C)CCC[NH+](C)C ZINC001208136722 969041880 /nfs/dbraw/zinc/04/18/80/969041880.db2.gz CLOOSCBZDZFIPJ-NSHDSACASA-N 2 0 218.410 2.012 20 0 BEADRP CS[C@H](C)CC[NH+]1CCC(C[NH+](C)C)CC1 ZINC001208144368 969069512 /nfs/dbraw/zinc/06/95/12/969069512.db2.gz XJESXIKFLXGRIF-GFCCVEGCSA-N 2 0 244.448 2.402 20 0 BEADRP C(C[N@@H+]1CC[C@H]2CCCC[C@@H]2C1)[C@@H]1CC[NH2+]C1 ZINC000227640649 1166227309 /nfs/dbraw/zinc/22/73/09/1166227309.db2.gz VLIVCRKCAJPVRO-RRFJBIMHSA-N 2 0 236.403 2.498 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2CC[C@@](C)(CF)C2)CC1 ZINC001208593560 969150347 /nfs/dbraw/zinc/15/03/47/969150347.db2.gz WMQUFQFESMRITI-AWEZNQCLSA-N 2 0 242.382 2.400 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2CCC[C@H]2C)CC1 ZINC001208594209 969152884 /nfs/dbraw/zinc/15/28/84/969152884.db2.gz LNOFXUJPXOTUAJ-GFCCVEGCSA-N 2 0 210.365 2.203 20 0 BEADRP C[C@@H]1[C@@H](C)[C@H](C)C[N@@H+]1CCC[NH2+]C1CC1 ZINC000399667437 1166250497 /nfs/dbraw/zinc/25/04/97/1166250497.db2.gz MRNMZDUNXGKPEF-GRYCIOLGSA-N 2 0 210.365 2.105 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH+]2CCC[C@H](F)CC2)C1 ZINC001208608847 969160847 /nfs/dbraw/zinc/16/08/47/969160847.db2.gz XCVFBYCEANEECL-OLZOCXBDSA-N 2 0 228.355 2.152 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH+]2CCC[C@@H](C(F)F)C2)C1 ZINC001208612794 969173804 /nfs/dbraw/zinc/17/38/04/969173804.db2.gz NZDJGQOJYFIZRE-NWDGAFQWSA-N 2 0 246.345 2.305 20 0 BEADRP CC[C@@H]1C[NH2+][C@@H](CC)CN1c1cc(C)nc(C)n1 ZINC000086466404 1166278115 /nfs/dbraw/zinc/27/81/15/1166278115.db2.gz PNXKHVHSLZYFPS-QWHCGFSZSA-N 2 0 248.374 2.060 20 0 BEADRP C[C@H]1C[C@@H]([N@H+](C)CCC[NH3+])CC(C)(C)C1 ZINC000227741933 1166307302 /nfs/dbraw/zinc/30/73/02/1166307302.db2.gz JKIWMZIRWASWGS-NWDGAFQWSA-N 2 0 212.381 2.482 20 0 BEADRP C[NH+](C)C1CC[NH+](C2Cc3ccccc3C2)CC1 ZINC000148546025 1166338572 /nfs/dbraw/zinc/33/85/72/1166338572.db2.gz FCJPUIRTJNKVGT-UHFFFAOYSA-N 2 0 244.382 2.180 20 0 BEADRP CC[C@@H](C)C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169078820 969399743 /nfs/dbraw/zinc/39/97/43/969399743.db2.gz HNSQLEUDVURXFO-LPWJVIDDSA-N 2 0 210.365 2.247 20 0 BEADRP CC(C)[C@@H](C)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169080945 969403537 /nfs/dbraw/zinc/40/35/37/969403537.db2.gz NYAKOTKWVZUILG-LPWJVIDDSA-N 2 0 210.365 2.246 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]Cc2cccs2)C12CCC2 ZINC000405207789 1166403747 /nfs/dbraw/zinc/40/37/47/1166403747.db2.gz BDGTZVJIFLSLJQ-QWRGUYRKSA-N 2 0 222.357 2.108 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]CCc2ccc(F)cc2)C12CCC2 ZINC000405201581 1166403938 /nfs/dbraw/zinc/40/39/38/1166403938.db2.gz CVSATXQTDRYVJX-KBPBESRZSA-N 2 0 248.345 2.228 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]CCc2ccc(F)cc2)C12CCC2 ZINC000405201594 1166403965 /nfs/dbraw/zinc/40/39/65/1166403965.db2.gz CVSATXQTDRYVJX-ZIAGYGMSSA-N 2 0 248.345 2.228 20 0 BEADRP CC[N@H+](CCC(C)(C)OC)C1CCN(C)CC1 ZINC001209407382 969470580 /nfs/dbraw/zinc/47/05/80/969470580.db2.gz CGTMJPUOLXTDAS-UHFFFAOYSA-N 2 0 242.407 2.218 20 0 BEADRP C[C@@H]1C[C@@H]([N@@H+]2CCCCC[C@H]2C)CC[NH2+]1 ZINC000252952868 1166448970 /nfs/dbraw/zinc/44/89/70/1166448970.db2.gz PWCBBFFZNBJJBI-UPJWGTAASA-N 2 0 210.365 2.391 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+][C@@H]1CCSC1 ZINC000309044782 1166471708 /nfs/dbraw/zinc/47/17/08/1166471708.db2.gz NSHHPLAJFGSSND-VXGBXAGGSA-N 2 0 230.421 2.202 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH2+]C2(CC3CC3)CC2)CC1 ZINC001254511964 969681670 /nfs/dbraw/zinc/68/16/70/969681670.db2.gz HNSNJVONZXPFMW-ZDUSSCGKSA-N 2 0 222.376 2.393 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH+]2CCCCCC2)CC1 ZINC001254516020 969687669 /nfs/dbraw/zinc/68/76/69/969687669.db2.gz IPWLFGAPRFRCQZ-CYBMUJFWSA-N 2 0 210.365 2.347 20 0 BEADRP C[N@H+](CCC[NH+]1CCCC1)C1CCSCC1 ZINC001255093280 969929382 /nfs/dbraw/zinc/92/93/82/969929382.db2.gz SERIVOUHSIQJJL-UHFFFAOYSA-N 2 0 242.432 2.300 20 0 BEADRP C(=C\C1CC1)\C[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000378861346 1166564544 /nfs/dbraw/zinc/56/45/44/1166564544.db2.gz QVVGXEKHXSEPPN-PPUMEHJOSA-N 2 0 220.360 2.169 20 0 BEADRP CCCC[C@@H](C)[N@@H+]1C[C@H]2CC[NH+](C)C[C@H]2C1 ZINC001255324868 970102237 /nfs/dbraw/zinc/10/22/37/970102237.db2.gz GXOOZGXZFKRSKI-MCIONIFRSA-N 2 0 224.392 2.449 20 0 BEADRP Cc1c[nH+]ccc1N[C@@H]1CC[N@@H+]2CCCC[C@@H]12 ZINC000226992677 1166604042 /nfs/dbraw/zinc/60/40/42/1166604042.db2.gz AVFQHOVGCABVBO-KGLIPLIRSA-N 2 0 231.343 2.429 20 0 BEADRP CCCC[C@@H](C)[N@@H+]1CCC[C@@H](C[NH2+]C)C1 ZINC000394604438 1166605315 /nfs/dbraw/zinc/60/53/15/1166605315.db2.gz FMWRNVIIJOXCJQ-OLZOCXBDSA-N 2 0 212.381 2.497 20 0 BEADRP COC1CCC([NH2+]CCCCC[NH+](C)C)CC1 ZINC001255445972 970181399 /nfs/dbraw/zinc/18/13/99/970181399.db2.gz UANZGJLNKFNYBP-UHFFFAOYSA-N 2 0 242.407 2.266 20 0 BEADRP CCOCCC[NH2+][C@@H](C)CC[NH+](CC)CC ZINC001255939846 970572348 /nfs/dbraw/zinc/57/23/48/970572348.db2.gz KTLQMIMYDOFQJE-ZDUSSCGKSA-N 2 0 230.396 2.123 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+][C@H]1CCO[C@H](C)C1 ZINC001255954371 970576325 /nfs/dbraw/zinc/57/63/25/970576325.db2.gz VOZQLFCSAXSRIX-MJBXVCDLSA-N 2 0 242.407 2.264 20 0 BEADRP CC[C@H](C)[C@@H](CO)[NH2+][C@@H](C)CC[NH+](CC)CC ZINC001255943568 970578524 /nfs/dbraw/zinc/57/85/24/970578524.db2.gz OBELEOGVZFPWAS-MELADBBJSA-N 2 0 244.423 2.103 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+][C@@H]1CCCC(=O)C1 ZINC001255948065 970580576 /nfs/dbraw/zinc/58/05/76/970580576.db2.gz DLIAROKYRQDEJJ-QWHCGFSZSA-N 2 0 240.391 2.208 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+][C@@H]1CCOC[C@H]1C ZINC001255948096 970582058 /nfs/dbraw/zinc/58/20/58/970582058.db2.gz DYJCSMHPZPFWJY-HZSPNIEDSA-N 2 0 242.407 2.121 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+][C@]1(C)CCCOC1 ZINC001255955348 970586287 /nfs/dbraw/zinc/58/62/87/970586287.db2.gz RFQMRUAWWQVZQV-ZIAGYGMSSA-N 2 0 242.407 2.266 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH+]1CCC(OC)CC1 ZINC001255955164 970587304 /nfs/dbraw/zinc/58/73/04/970587304.db2.gz PHFHOTBKSXKENI-CYBMUJFWSA-N 2 0 242.407 2.218 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[N@@H+]1CC[C@@H](COC)C1 ZINC001255957074 970592228 /nfs/dbraw/zinc/59/22/28/970592228.db2.gz OQVBVLZDVBZQJB-ZIAGYGMSSA-N 2 0 242.407 2.075 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+][C@@H](C)[C@@H]1CCCO1 ZINC001255955637 970593463 /nfs/dbraw/zinc/59/34/63/970593463.db2.gz VVDWTFRHROQINK-RDBSUJKOSA-N 2 0 242.407 2.264 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[N@@H+]1CC[C@@H](C)C1 ZINC001255956749 970594866 /nfs/dbraw/zinc/59/48/66/970594866.db2.gz MCXFSMOPAAOKLB-CHWSQXEVSA-N 2 0 212.381 2.449 20 0 BEADRP C1CCC([NH2+][C@@H]2CC[NH2+]C23CCCC3)C1 ZINC000401360802 970683738 /nfs/dbraw/zinc/68/37/38/970683738.db2.gz CLRPHGTVBTTYKX-GFCCVEGCSA-N 2 0 208.349 2.193 20 0 BEADRP C[C@H]1CC[C@H]([N@@H+]2CCC3(CCCC3)C2)C[NH2+]1 ZINC000304428694 1166917346 /nfs/dbraw/zinc/91/73/46/1166917346.db2.gz SDZDPUKCZQAGQD-STQMWFEESA-N 2 0 222.376 2.393 20 0 BEADRP C[C@@H]1C[N@@H+](C2CCN(C)CC2)CCC1(F)F ZINC001256202728 970705103 /nfs/dbraw/zinc/70/51/03/970705103.db2.gz LHRVUXGEPNYNKA-SNVBAGLBSA-N 2 0 232.318 2.058 20 0 BEADRP CC[NH+](CC)C1CCC([NH2+][C@H]2CCOC2)CC1 ZINC001173104615 975021596 /nfs/dbraw/zinc/02/15/96/975021596.db2.gz JPBGEOUSCXPMTI-MOKVOYLWSA-N 2 0 240.391 2.018 20 0 BEADRP CCC[N@H+]1C[C@@H]2C[NH+]([C@H]3C[C@H]4C[C@H]4C3)C[C@@H]2C1 ZINC001167949401 1167005482 /nfs/dbraw/zinc/00/54/82/1167005482.db2.gz WWQTWCMGXFKSCW-OYQDBORRSA-N 2 0 234.387 2.059 20 0 BEADRP CS[C@H]1CC[N@H+](CCCCCCC[NH3+])C1 ZINC000382903057 1167112282 /nfs/dbraw/zinc/11/22/82/1167112282.db2.gz CGWQYBXQACLESZ-LBPRGKRZSA-N 2 0 230.421 2.333 20 0 BEADRP C[C@@H]1CC[C@@H]([N@@H+]2CCCC[C@H](C[NH3+])C2)C1 ZINC000308800138 1167200145 /nfs/dbraw/zinc/20/01/45/1167200145.db2.gz DJVGPPMTVMUBFL-JHJVBQTASA-N 2 0 210.365 2.236 20 0 BEADRP C[NH2+]C[C@H]1CCC[N@@H+]1[C@H](C)CCC(C)C ZINC000169240295 1167452716 /nfs/dbraw/zinc/45/27/16/1167452716.db2.gz NEIUOPNINPGMPK-CHWSQXEVSA-N 2 0 212.381 2.495 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@@H+]([C@@H]2CC[C@@H](C)[C@H](C)C2)C1 ZINC000251990290 1167468360 /nfs/dbraw/zinc/46/83/60/1167468360.db2.gz ZGUMAYXONPMNFO-YIYPIFLZSA-N 2 0 224.392 2.352 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]Cc1cc[nH]c1 ZINC000381346601 1167543915 /nfs/dbraw/zinc/54/39/15/1167543915.db2.gz ZGHWQQDRZXGBQN-GFCCVEGCSA-N 2 0 223.364 2.225 20 0 BEADRP CC[C@H](C)[C@@H](C[NH2+]C[C@]1(C)CCC[NH2+]C1)OC ZINC000381381334 1167547758 /nfs/dbraw/zinc/54/77/58/1167547758.db2.gz LNRPYBLMNRXGIA-BFHYXJOUSA-N 2 0 242.407 2.027 20 0 BEADRP C[C@H](CC[NH2+]C[C@]1(C)CCCS1)[NH+](C)C ZINC000697886540 1167554284 /nfs/dbraw/zinc/55/42/84/1167554284.db2.gz IAPDAYUWPUOLLJ-NEPJUHHUSA-N 2 0 230.421 2.202 20 0 BEADRP CCC(CC)[N@H+](CC)CC1CC[NH2+]CC1 ZINC000086701844 1167640324 /nfs/dbraw/zinc/64/03/24/1167640324.db2.gz CNAQJFBUXSAFMW-UHFFFAOYSA-N 2 0 212.381 2.497 20 0 BEADRP [NH3+][C@@H]1C[C@@H](N[C@H]2C=CCC2)c2ccccc21 ZINC000698268336 1167643840 /nfs/dbraw/zinc/64/38/40/1167643840.db2.gz WNMUSLHFJSKRSR-ZLKJLUDKSA-N 2 0 214.312 2.439 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2C[C@@H]3CC[NH2+]C[C@H]3C2)C[C@H]1C ZINC000310397860 1167682860 /nfs/dbraw/zinc/68/28/60/1167682860.db2.gz MIFPGUTWJHAJDJ-MRLBHPIUSA-N 2 0 236.403 2.352 20 0 BEADRP C(CC1CCC1)[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000400961317 1167708369 /nfs/dbraw/zinc/70/83/69/1167708369.db2.gz ISLRZWQQFPOTBT-HZSPNIEDSA-N 2 0 222.376 2.154 20 0 BEADRP C[N@H+](CCNc1cc[nH+]cc1)Cc1ccccc1 ZINC000386758987 1167728273 /nfs/dbraw/zinc/72/82/73/1167728273.db2.gz IAEQFZCOOPQVNO-UHFFFAOYSA-N 2 0 241.338 2.047 20 0 BEADRP C[C@H]1C[C@H]([NH2+]C[C@@H]2CC[N@H+](C)C2)C[C@@H](C)C1 ZINC000252216063 1167773561 /nfs/dbraw/zinc/77/35/61/1167773561.db2.gz ZFMNGLIWODHPBE-RFQIPJPRSA-N 2 0 224.392 2.352 20 0 BEADRP C([NH2+][C@@H]1CC12CCCCC2)C1CC[NH2+]CC1 ZINC000386958136 1167788589 /nfs/dbraw/zinc/78/85/89/1167788589.db2.gz YGWOSYDQNBCIRJ-CYBMUJFWSA-N 2 0 222.376 2.298 20 0 BEADRP CCC(CC)C[N@@H+]1CCCC2(C[NH2+]C2)C1 ZINC001235710876 979129504 /nfs/dbraw/zinc/12/95/04/979129504.db2.gz JGQKLDDOLHFYDZ-UHFFFAOYSA-N 2 0 210.365 2.108 20 0 BEADRP CC[N@H+](CCCC[NH3+])Cc1ccccc1F ZINC001235960753 979224687 /nfs/dbraw/zinc/22/46/87/979224687.db2.gz NKKMIJGDNYPXFU-UHFFFAOYSA-N 2 0 224.323 2.387 20 0 BEADRP CC(C)[C@@H](C[NH3+])C[N@@H+]1CCC[C@H]1C(C)C ZINC000251435569 1168238119 /nfs/dbraw/zinc/23/81/19/1168238119.db2.gz UBQHAICHLBADPT-STQMWFEESA-N 2 0 212.381 2.338 20 0 BEADRP [NH3+]C[C@H]1CCC[N@@H+]([C@H]2CCc3c2cccc3F)C1 ZINC000149341504 1168320295 /nfs/dbraw/zinc/32/02/95/1168320295.db2.gz QUIIGZGLMSQFLK-ABAIWWIYSA-N 2 0 248.345 2.484 20 0 BEADRP CC[C@@H](C)C[C@@H](CC)[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC000085282118 1168324032 /nfs/dbraw/zinc/32/40/32/1168324032.db2.gz JTUSFFHWBKBKNJ-YIYPIFLZSA-N 2 0 224.392 2.352 20 0 BEADRP CCC1CCC([N@H+](C)C[C@H](C)C[NH3+])CC1 ZINC000042515302 1168394015 /nfs/dbraw/zinc/39/40/15/1168394015.db2.gz HQWJCBBOXMQRAQ-PNESKVBLSA-N 2 0 212.381 2.482 20 0 BEADRP C[C@H](C[NH2+][C@H]1C[C@H]([NH3+])C12CCC2)CC(F)F ZINC000697705450 1168410727 /nfs/dbraw/zinc/41/07/27/1168410727.db2.gz DCXNBXSLJVUXRW-GUBZILKMSA-N 2 0 232.318 2.137 20 0 BEADRP CCCC(CCC)[NH2+]C[C@@H]1CC[N@H+](C)C1 ZINC000037484549 1168418732 /nfs/dbraw/zinc/41/87/32/1168418732.db2.gz QFBWTJWQNAFPPM-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP CCC1CCC([NH2+]C[C@H]2CC[N@H+](C)C2)CC1 ZINC000037484624 1168418934 /nfs/dbraw/zinc/41/89/34/1168418934.db2.gz GVVAQYJZJYDSAJ-ROKHWSDSSA-N 2 0 224.392 2.497 20 0 BEADRP CCC1CCC([NH2+]C[C@@H]2CC[N@H+](C)C2)CC1 ZINC000037484623 1168418175 /nfs/dbraw/zinc/41/81/75/1168418175.db2.gz GVVAQYJZJYDSAJ-MOKVOYLWSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1c2sccc2CC[N@H+]1CCC[NH3+] ZINC000712269302 1168423502 /nfs/dbraw/zinc/42/35/02/1168423502.db2.gz ZTPLQBFOYCCVEQ-VIFPVBQESA-N 2 0 210.346 2.016 20 0 BEADRP C[NH2+][C@@]12CC[C@@]([NH2+]CCCCF)(C1)CCC2 ZINC001278208807 980232013 /nfs/dbraw/zinc/23/20/13/980232013.db2.gz YVJBCCNPAXXBKY-QWHCGFSZSA-N 2 0 228.355 2.391 20 0 BEADRP C(CC[NH+]1CCCC1)C[NH2+][C@H]1CCCOCC1 ZINC001170776486 1168595358 /nfs/dbraw/zinc/59/53/58/1168595358.db2.gz QJTMSDHGNHAEGZ-AWEZNQCLSA-N 2 0 240.391 2.021 20 0 BEADRP [NH3+]C[C@]1(F)CCC[N@H+](Cc2cccs2)CC1 ZINC001205545270 980945069 /nfs/dbraw/zinc/94/50/69/980945069.db2.gz BOJIFIOAUJKAGB-LBPRGKRZSA-N 2 0 242.363 2.401 20 0 BEADRP C1C[N@H+]([C@H]2CCCSC2)[C@@]2(C1)CCC[NH2+]C2 ZINC000257696481 1168608249 /nfs/dbraw/zinc/60/82/49/1168608249.db2.gz KHNUJBKVWPHHAZ-QWHCGFSZSA-N 2 0 240.416 2.100 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2C[C@@H]3CC[NH2+][C@@H]3C2)CC(C)(C)C1 ZINC001246651498 1168657231 /nfs/dbraw/zinc/65/72/31/1168657231.db2.gz LTCHPNJDYNGZNY-ZOBORPQBSA-N 2 0 236.403 2.495 20 0 BEADRP CC[C@H](C)C[NH+]1CCC([N@H+](C)CC)CC1 ZINC001201517247 983315218 /nfs/dbraw/zinc/31/52/18/983315218.db2.gz OSHNZFQZUIXVBW-LBPRGKRZSA-N 2 0 212.381 2.449 20 0 BEADRP CCCC[NH+]1CCC([N@H+](C)C2CC2)CC1 ZINC001201717229 983421605 /nfs/dbraw/zinc/42/16/05/983421605.db2.gz GYQDTRMOCAXDON-UHFFFAOYSA-N 2 0 210.365 2.345 20 0 BEADRP CCCCCC[N@@H+]1C[C@H]2C[C@@]2(C[NH+](C)C)C1 ZINC001201755902 983457873 /nfs/dbraw/zinc/45/78/73/983457873.db2.gz BGLZWBPRNJTNFC-ZIAGYGMSSA-N 2 0 224.392 2.450 20 0 BEADRP C[C@H](Cc1ccco1)[NH2+]CC1([NH3+])CCCC1 ZINC000042594174 1169086495 /nfs/dbraw/zinc/08/64/95/1169086495.db2.gz LTYOXJFFDQYUEH-LLVKDONJSA-N 2 0 222.332 2.072 20 0 BEADRP CCCC[C@H](O)C[NH2+]C1CC[NH+](CCC)CC1 ZINC001252107176 983670441 /nfs/dbraw/zinc/67/04/41/983670441.db2.gz GDVMYENAMQCPCJ-AWEZNQCLSA-N 2 0 242.407 2.002 20 0 BEADRP CC(C)n1cncc1C[NH2+][C@@H](C)CCCC[NH3+] ZINC001575942737 984137026 /nfs/dbraw/zinc/13/70/26/984137026.db2.gz HSZDAJQSMOCRLY-LBPRGKRZSA-N 2 0 238.379 2.071 20 0 BEADRP CCOCC[C@@H](C)[N@H+](CC)CCn1ccnc1 ZINC001172426902 974702770 /nfs/dbraw/zinc/70/27/70/974702770.db2.gz JKIYZZOWGLUDTL-CYBMUJFWSA-N 2 0 239.363 2.020 20 0 BEADRP C[C@@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]C1(C)CC1 ZINC001327837747 972744779 /nfs/dbraw/zinc/74/47/79/972744779.db2.gz BKAPGOSCLNPDDR-RYUDHWBXSA-N 2 0 210.365 2.439 20 0 BEADRP C[C@H](CC(F)(F)F)[N@@H+]1CCCC[C@H](C[NH3+])C1 ZINC001246596743 973015035 /nfs/dbraw/zinc/01/50/35/973015035.db2.gz VJLKEMZPRRWOHH-NXEZZACHSA-N 2 0 238.297 2.388 20 0 BEADRP CCC[N@H+](CCC[NH3+])[C@H](C)Cc1ccccn1 ZINC001256397552 970806354 /nfs/dbraw/zinc/80/63/54/970806354.db2.gz SFNZJISSRGEHLY-CYBMUJFWSA-N 2 0 235.375 2.073 20 0 BEADRP C[C@H](Cc1ccccn1)[NH2+]CCCCC[NH+](C)C ZINC001256397047 970803877 /nfs/dbraw/zinc/80/38/77/970803877.db2.gz NXYRPXAILYZTCT-CQSZACIVSA-N 2 0 249.402 2.334 20 0 BEADRP CCCOCC[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC001256561965 970862095 /nfs/dbraw/zinc/86/20/95/970862095.db2.gz RLOIDBHXPFENSM-UHFFFAOYSA-N 2 0 242.407 2.266 20 0 BEADRP C[NH+]1CC2(C1)CC[NH+](Cc1ccc(F)cc1)CC2 ZINC001203915139 1169470089 /nfs/dbraw/zinc/47/00/89/1169470089.db2.gz KIQZLOUQKOGHEW-UHFFFAOYSA-N 2 0 248.345 2.353 20 0 BEADRP CC[C@@H](C)[NH2+]C1CCC([NH+]2CCOCC2)CC1 ZINC001256679052 970918358 /nfs/dbraw/zinc/91/83/58/970918358.db2.gz AIENKDXAUWTTET-IYXRBSQSSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@@H](Cc1ccncc1)[NH2+]CC[C@@H]1CCC[N@@H+]1C ZINC001256722949 970942964 /nfs/dbraw/zinc/94/29/64/970942964.db2.gz LZGOOLKVGVOWEH-ZFWWWQNUSA-N 2 0 247.386 2.087 20 0 BEADRP C[C@H](Cc1ccncc1)[NH2+]CC[C@H]1CCC[N@@H+]1C ZINC001256722948 970945261 /nfs/dbraw/zinc/94/52/61/970945261.db2.gz LZGOOLKVGVOWEH-UKRRQHHQSA-N 2 0 247.386 2.087 20 0 BEADRP CC(C)[N@H+](C)C1CCN(c2cc[nH+]cc2)CC1 ZINC001256855351 970999143 /nfs/dbraw/zinc/99/91/43/970999143.db2.gz JQTDYVDDGSMFGF-UHFFFAOYSA-N 2 0 233.359 2.391 20 0 BEADRP FCC1([NH2+]C2CCN(c3cc[nH+]cc3)CC2)CC1 ZINC001256848923 970999387 /nfs/dbraw/zinc/99/93/87/970999387.db2.gz LAHDBMZVAINJEP-UHFFFAOYSA-N 2 0 249.333 2.142 20 0 BEADRP [NH3+]CC[C@H]1CCC[N@H+](CC=C(Cl)Cl)C1 ZINC000403643119 971001518 /nfs/dbraw/zinc/00/15/18/971001518.db2.gz PSUGNNLAYXKMQB-SECBINFHSA-N 2 0 237.174 2.366 20 0 BEADRP [NH3+]CC[C@@H]1CCC[N@H+](CC=C(Cl)Cl)C1 ZINC000403643122 971002577 /nfs/dbraw/zinc/00/25/77/971002577.db2.gz PSUGNNLAYXKMQB-VIFPVBQESA-N 2 0 237.174 2.366 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+]C1C[C@H]2CC[C@@H](C1)S2 ZINC000403650702 971005053 /nfs/dbraw/zinc/00/50/53/971005053.db2.gz UPHYIVYTKULVPU-ODWCKFRGSA-N 2 0 242.432 2.343 20 0 BEADRP c1cc2c(c(C3=C[NH2+]CCC3)c1)C[NH2+]CC2 ZINC001243949347 971037942 /nfs/dbraw/zinc/03/79/42/971037942.db2.gz BQXSMVZBSXOQMJ-UHFFFAOYSA-N 2 0 214.312 2.057 20 0 BEADRP c1cc([C@H]2CC[NH2+]C2)ccc1C1=C[NH2+]CCC1 ZINC001243951227 971041157 /nfs/dbraw/zinc/04/11/57/971041157.db2.gz DHXMGZBFKZWRAQ-HNNXBMFYSA-N 2 0 228.339 2.488 20 0 BEADRP C[NH+](C)CCOc1cccc(C2=C[NH2+]CCC2)c1 ZINC001243952108 971050429 /nfs/dbraw/zinc/05/04/29/971050429.db2.gz MAJPHWWTWREGFI-UHFFFAOYSA-N 2 0 246.354 2.351 20 0 BEADRP CCc1cc(Nc2cc[nH+]c(NC)c2)cc[nH+]1 ZINC001216334287 971048914 /nfs/dbraw/zinc/04/89/14/971048914.db2.gz SJRUVWYLIZZPLT-UHFFFAOYSA-N 2 0 228.299 2.246 20 0 BEADRP CC[C@@H]1C[N@H+](CCCCCC[NH3+])[C@H](C)CO1 ZINC000403862634 971073611 /nfs/dbraw/zinc/07/36/11/971073611.db2.gz WJLPSIAEFMPDGK-CHWSQXEVSA-N 2 0 228.380 2.005 20 0 BEADRP CC(C)[N@H+](CCC[NH3+])[C@@H]1C[C@@H](C)O[C@@H](C)C1 ZINC001257073825 971088895 /nfs/dbraw/zinc/08/88/95/971088895.db2.gz WIZZKVSGXAHAQB-CLLJXQQHSA-N 2 0 228.380 2.002 20 0 BEADRP C[C@@H]1CC([NH2+]CCCCC[NH+](C)C)C[C@@H](C)O1 ZINC001257073731 971089485 /nfs/dbraw/zinc/08/94/85/971089485.db2.gz UEJVIEPPWRVNDS-CHWSQXEVSA-N 2 0 242.407 2.264 20 0 BEADRP C[C@@H]1CC([NH2+]Cc2ccccc2C[NH3+])C[C@@H](C)O1 ZINC001257078381 971092211 /nfs/dbraw/zinc/09/22/11/971092211.db2.gz JTSIMKHSNBOTJN-VXGBXAGGSA-N 2 0 248.370 2.191 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C(C)(C)C(C)(C)[NH3+])C[C@H](C)O1 ZINC001257082856 971097396 /nfs/dbraw/zinc/09/73/96/971097396.db2.gz CGSKMYNZGSUPFF-JGPRNRPPSA-N 2 0 228.380 2.048 20 0 BEADRP CCC[C@@H](CC)NC(=[NH2+])NCC[NH+](CC)CC ZINC001257252967 971149950 /nfs/dbraw/zinc/14/99/50/971149950.db2.gz JZKLZXQRRVYLBA-GFCCVEGCSA-N 2 0 242.411 2.021 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+][C@@H]1C[C@H]([NH3+])C12CCC2 ZINC000404521625 971169375 /nfs/dbraw/zinc/16/93/75/971169375.db2.gz PVVWTCOOLKXBAL-FIQHERPVSA-N 2 0 210.365 2.281 20 0 BEADRP CC(C)O[C@@H]1CCC[N@H+](CCCCCC[NH3+])C1 ZINC000404519257 971170596 /nfs/dbraw/zinc/17/05/96/971170596.db2.gz OKOGANPOJZYKQG-CQSZACIVSA-N 2 0 242.407 2.395 20 0 BEADRP CCC[C@@H](C)[NH2+]CC12CC[NH+](CC1)CC2 ZINC001257308883 971199209 /nfs/dbraw/zinc/19/92/09/971199209.db2.gz LPDWMOUJIYNNJR-GFCCVEGCSA-N 2 0 210.365 2.251 20 0 BEADRP CCC1(C[NH2+][C@H]2C[C@@H]([NH3+])C23CCC3)CCC1 ZINC000405201036 971206122 /nfs/dbraw/zinc/20/61/22/971206122.db2.gz AOAUARYTPCZZCG-NEPJUHHUSA-N 2 0 222.376 2.426 20 0 BEADRP CSCCCCC[NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405236765 971212828 /nfs/dbraw/zinc/21/28/28/971212828.db2.gz FBRDRALJKOSGGL-VXGBXAGGSA-N 2 0 242.432 2.379 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]C[C@H]2CCCCS2)C12CCC2 ZINC000405237646 971214592 /nfs/dbraw/zinc/21/45/92/971214592.db2.gz FTWUESPRIBYKMF-UTUOFQBUSA-N 2 0 240.416 2.132 20 0 BEADRP CSCCCCC[NH2+][C@H]1C[C@H]([NH3+])C12CCC2 ZINC000405236763 971215855 /nfs/dbraw/zinc/21/58/55/971215855.db2.gz FBRDRALJKOSGGL-RYUDHWBXSA-N 2 0 242.432 2.379 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2C[C@H]([NH3+])C23CCC3)s1 ZINC000405247860 971217814 /nfs/dbraw/zinc/21/78/14/971217814.db2.gz GQQFWZNKGUPBPE-RYUDHWBXSA-N 2 0 236.384 2.416 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405265066 971220383 /nfs/dbraw/zinc/22/03/83/971220383.db2.gz PCSPCOPVOJCMJF-YVECIDJPSA-N 2 0 222.376 2.425 20 0 BEADRP C[C@H](Cc1ccco1)[NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405282323 971223970 /nfs/dbraw/zinc/22/39/70/971223970.db2.gz CHNARPUXLOHGKV-RAIGVLPGSA-N 2 0 234.343 2.070 20 0 BEADRP CSC1(C[NH2+][C@@H]2C[C@@H]([NH3+])C23CCC3)CCC1 ZINC000405281378 971224074 /nfs/dbraw/zinc/22/40/74/971224074.db2.gz ZPYASJRWRYRHFP-GHMZBOCLSA-N 2 0 240.416 2.132 20 0 BEADRP Cc1ccccc1C[NH2+][C@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405269581 971224324 /nfs/dbraw/zinc/22/43/24/971224324.db2.gz TZIJZUCUMQTCPS-KGLIPLIRSA-N 2 0 230.355 2.355 20 0 BEADRP CCC[C@@H](C)[N@@H+]1C[C@H]2C[C@@]2(C[NH+](C)C)C1 ZINC001257324903 971226629 /nfs/dbraw/zinc/22/66/29/971226629.db2.gz WUEUTYRHXVAGGU-JHJVBQTASA-N 2 0 210.365 2.059 20 0 BEADRP C[C@H](CCC1CC1)[NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405304455 971230147 /nfs/dbraw/zinc/23/01/47/971230147.db2.gz LKLNQCHGCXGVBU-RAIGVLPGSA-N 2 0 222.376 2.425 20 0 BEADRP CCCCOCCC[NH2+][C@@H]1C[C@H]([NH3+])C12CCC2 ZINC000405343265 971238784 /nfs/dbraw/zinc/23/87/84/971238784.db2.gz JKIQSLKVWSOCFZ-QWHCGFSZSA-N 2 0 240.391 2.053 20 0 BEADRP CC1(C[NH2+][C@@H]2C[C@H]([NH3+])C23CCC3)CCCC1 ZINC000405355448 971242993 /nfs/dbraw/zinc/24/29/93/971242993.db2.gz QPTHUUZGNDDXMB-NWDGAFQWSA-N 2 0 222.376 2.426 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@@H]2C[C@@H]([NH3+])C23CCC3)C1 ZINC000405443668 971253200 /nfs/dbraw/zinc/25/32/00/971253200.db2.gz FFOPFBZZUUYUDF-WRWGMCAJSA-N 2 0 208.349 2.035 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]CCC2CCC2)C12CCC2 ZINC000405430952 971253421 /nfs/dbraw/zinc/25/34/21/971253421.db2.gz AWKXXUKSMIHNGU-NEPJUHHUSA-N 2 0 208.349 2.036 20 0 BEADRP CCC(C)(C)C[NH2+][C@@H]1C[C@H]([NH3+])C12CCC2 ZINC000405437921 971253857 /nfs/dbraw/zinc/25/38/57/971253857.db2.gz CSSGQADGYHJOEP-WDEREUQCSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]CC2CCCC2)C12CCC2 ZINC000405473282 971258892 /nfs/dbraw/zinc/25/88/92/971258892.db2.gz LHIMNMDBGKJRCA-VXGBXAGGSA-N 2 0 208.349 2.036 20 0 BEADRP CC(C)CCC[NH2+][C@H]1C[C@H]([NH3+])C12CCC2 ZINC000405459919 971262057 /nfs/dbraw/zinc/26/20/57/971262057.db2.gz ILUZQHLOMZGPIL-RYUDHWBXSA-N 2 0 210.365 2.282 20 0 BEADRP CCC[C@H](CC)[NH2+][C@@H]1C[C@H]([NH3+])C12CCC2 ZINC000405498822 971262920 /nfs/dbraw/zinc/26/29/20/971262920.db2.gz QOULLZXRAMDCMS-SDDRHHMPSA-N 2 0 210.365 2.425 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+][C@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405516200 971267142 /nfs/dbraw/zinc/26/71/42/971267142.db2.gz UQJLCHUSVDKOIX-VWYCJHECSA-N 2 0 208.349 2.035 20 0 BEADRP CCC[NH+]1C[C@@H]2C[NH+](C3CCCC3)C[C@H]2C1 ZINC001257355254 971271160 /nfs/dbraw/zinc/27/11/60/971271160.db2.gz SHRANNRJCPDDJE-CHWSQXEVSA-N 2 0 222.376 2.203 20 0 BEADRP c1cn(C2CCCC2)c([C@@H]2CCC[NH2+]C2)n1 ZINC001257355636 971271780 /nfs/dbraw/zinc/27/17/80/971271780.db2.gz CWOPUQJNBUHBDJ-LLVKDONJSA-N 2 0 219.332 2.465 20 0 BEADRP C[C@H]1C[NH2+]CCC[C@H]1OCc1ccc(C[NH3+])cc1 ZINC001217772185 971395940 /nfs/dbraw/zinc/39/59/40/971395940.db2.gz ANSXENFKHGDMJM-SWLSCSKDSA-N 2 0 248.370 2.050 20 0 BEADRP C[C@@H]1C[NH2+]CCC[C@@H]1OCc1ccc(C[NH3+])cc1 ZINC001217772183 971397380 /nfs/dbraw/zinc/39/73/80/971397380.db2.gz ANSXENFKHGDMJM-DOMZBBRYSA-N 2 0 248.370 2.050 20 0 BEADRP C[C@@H]1C[NH2+]CCC[C@H]1OCc1cccc(C[NH3+])c1 ZINC001217778172 971399605 /nfs/dbraw/zinc/39/96/05/971399605.db2.gz KPVYGRRFTAQOFQ-IUODEOHRSA-N 2 0 248.370 2.050 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1OCCCCCCC[NH3+] ZINC001217792154 971410419 /nfs/dbraw/zinc/41/04/19/971410419.db2.gz ZPEMJTZPDKSNFY-ZIAGYGMSSA-N 2 0 242.407 2.300 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1OCCCCCCC[NH3+] ZINC001217792152 971411579 /nfs/dbraw/zinc/41/15/79/971411579.db2.gz ZPEMJTZPDKSNFY-KGLIPLIRSA-N 2 0 242.407 2.300 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]1OCc1cccc(C[NH3+])c1 ZINC001217875743 971471819 /nfs/dbraw/zinc/47/18/19/971471819.db2.gz DGQMUMULEVUVMV-CQSZACIVSA-N 2 0 248.370 2.050 20 0 BEADRP CC(C)[N@H+](CCC[NH3+])C1CCC2(COC2)CC1 ZINC001257895947 971529007 /nfs/dbraw/zinc/52/90/07/971529007.db2.gz AVTJWENRHYDTGT-UHFFFAOYSA-N 2 0 240.391 2.005 20 0 BEADRP CC1(C)C[C@@H](OCc2ccccc2C[NH3+])CC[NH2+]1 ZINC001217939708 971538181 /nfs/dbraw/zinc/53/81/81/971538181.db2.gz XPWTYSOWMHKDQT-AWEZNQCLSA-N 2 0 248.370 2.193 20 0 BEADRP CC1(C)C[C@H](OCc2ccccc2C[NH3+])CC[NH2+]1 ZINC001217939709 971539271 /nfs/dbraw/zinc/53/92/71/971539271.db2.gz XPWTYSOWMHKDQT-CQSZACIVSA-N 2 0 248.370 2.193 20 0 BEADRP CC1(C)C[C@@H](OCc2ccc(C[NH3+])cc2)CC[NH2+]1 ZINC001217936695 971539578 /nfs/dbraw/zinc/53/95/78/971539578.db2.gz PCDHZODYCSCJMZ-AWEZNQCLSA-N 2 0 248.370 2.193 20 0 BEADRP CC1(C)C[C@H](OCc2ccc(C[NH3+])cc2)CC[NH2+]1 ZINC001217936698 971539702 /nfs/dbraw/zinc/53/97/02/971539702.db2.gz PCDHZODYCSCJMZ-CQSZACIVSA-N 2 0 248.370 2.193 20 0 BEADRP CC(C)C[NH+]1CCC([N@@H+]2CC[C@H](C)C2)CC1 ZINC001258013815 971549023 /nfs/dbraw/zinc/54/90/23/971549023.db2.gz XQLNMGDSLGYVQQ-ZDUSSCGKSA-N 2 0 224.392 2.449 20 0 BEADRP [NH3+][C@@H]1C[C@H]1c1ccc(O[C@@H]2CCC[NH2+]CC2)cc1 ZINC001217998809 971566461 /nfs/dbraw/zinc/56/64/61/971566461.db2.gz FEYCZEDSRWWKSE-VHDGCEQUSA-N 2 0 246.354 2.022 20 0 BEADRP [NH3+]Cc1ccccc1O[C@@H]1CCC12CC[NH2+]CC2 ZINC001218085519 971597715 /nfs/dbraw/zinc/59/77/15/971597715.db2.gz SAZPKCBHBGJSLC-CQSZACIVSA-N 2 0 246.354 2.056 20 0 BEADRP [NH3+]Cc1cccc(OC2CC3(C2)CC[NH2+]CC3)c1 ZINC001218105671 971601576 /nfs/dbraw/zinc/60/15/76/971601576.db2.gz DREKNQZFXJHJDU-UHFFFAOYSA-N 2 0 246.354 2.056 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@@H]2C[C@@H]3[C@H](C2)C3(C)C)CC1 ZINC001170713037 971620948 /nfs/dbraw/zinc/62/09/48/971620948.db2.gz MDCCYRQBOMWHLC-ZSOGYDGISA-N 2 0 236.403 2.352 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH2+][C@H]2C[C@@H]3[C@H](C2)C3(C)C)C1 ZINC001170714786 971628812 /nfs/dbraw/zinc/62/88/12/971628812.db2.gz ALBXIKFEYCXRIR-FQUUOJAGSA-N 2 0 236.403 2.352 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH2+][C@@H]2C[C@@H]3[C@H](C2)C3(C)C)C1 ZINC001170714788 971628963 /nfs/dbraw/zinc/62/89/63/971628963.db2.gz ALBXIKFEYCXRIR-XDQVBPFNSA-N 2 0 236.403 2.352 20 0 BEADRP [NH3+]Cc1ccc(OC2CCC3(C[NH2+]C3)CC2)cc1 ZINC001218264141 971667177 /nfs/dbraw/zinc/66/71/77/971667177.db2.gz SFVCPKWBWVKBCE-UHFFFAOYSA-N 2 0 246.354 2.056 20 0 BEADRP [NH3+]Cc1ccc(O[C@H]2CC[NH2+]C3(CCC3)C2)cc1 ZINC001218309347 971702102 /nfs/dbraw/zinc/70/21/02/971702102.db2.gz NZCYEGZXVDDHKP-AWEZNQCLSA-N 2 0 246.354 2.199 20 0 BEADRP C[C@H]([NH3+])c1ccc(O[C@@H]2CC[NH2+]CC2(C)C)cc1 ZINC001218317900 971707456 /nfs/dbraw/zinc/70/74/56/971707456.db2.gz RJXUNRHUVKKDRT-SMDDNHRTSA-N 2 0 248.370 2.473 20 0 BEADRP CC[N@@H+]1CCC[C@H](Oc2cccc(C[NH3+])c2)C1 ZINC001218348456 971721492 /nfs/dbraw/zinc/72/14/92/971721492.db2.gz QQALXIFQXCEMEM-AWEZNQCLSA-N 2 0 234.343 2.008 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+][C@H](C)CCOC ZINC000309654796 971724406 /nfs/dbraw/zinc/72/44/06/971724406.db2.gz PHCHBOQBUATWPV-CHWSQXEVSA-N 2 0 230.396 2.121 20 0 BEADRP C[C@H]1CC[C@H](Oc2ccc([C@@H]3C[C@H]3[NH3+])cc2)C[NH2+]1 ZINC001218410415 971783080 /nfs/dbraw/zinc/78/30/80/971783080.db2.gz ZTSGULMYQFCCTR-FBUXBERBSA-N 2 0 246.354 2.021 20 0 BEADRP CCCCCC[NH+]1CCC(F)(C[NH3+])CC1 ZINC001222526472 972540148 /nfs/dbraw/zinc/54/01/48/972540148.db2.gz BNWKQKSODWWWMC-UHFFFAOYSA-N 2 0 216.344 2.330 20 0 BEADRP CC1(C)C[C@H](Oc2ccc3c(c2)C[NH2+]C3)CC[NH2+]1 ZINC001218473391 971828752 /nfs/dbraw/zinc/82/87/52/971828752.db2.gz YDNNKUMAMUACQE-CQSZACIVSA-N 2 0 246.354 2.199 20 0 BEADRP CC[C@H](C)OCC[C@H](C)[N@H+](C)C[C@H](C)C[NH3+] ZINC001172326022 974530422 /nfs/dbraw/zinc/53/04/22/974530422.db2.gz ABXKNBXOUHCQKK-AGIUHOORSA-N 2 0 230.396 2.107 20 0 BEADRP CC1C[NH+](Cc2cc(F)cc(C[NH+](C)C)c2)C1 ZINC001232144195 1169682719 /nfs/dbraw/zinc/68/27/19/1169682719.db2.gz HENKKWWUBWPYGX-UHFFFAOYSA-N 2 0 236.334 2.339 20 0 BEADRP C[NH+](C)[C@@H]1CCC[C@@H](Nc2cc[nH+]cc2)C1 ZINC000309981938 971907280 /nfs/dbraw/zinc/90/72/80/971907280.db2.gz WLVYGQGBBVVANU-CHWSQXEVSA-N 2 0 219.332 2.366 20 0 BEADRP C[NH+](C)C1CCC([NH2+][C@@H]2C[C@@H]2C2CC2)CC1 ZINC000309984366 971911607 /nfs/dbraw/zinc/91/16/07/971911607.db2.gz XRRMBRLJAHUWEM-NWINJMCUSA-N 2 0 222.376 2.247 20 0 BEADRP CC[C@@]([NH3+])(CO)Nc1ccc2c(C)ccnc2c1 ZINC001170864076 971998306 /nfs/dbraw/zinc/99/83/06/971998306.db2.gz RBYSBZRNCDDSGQ-AWEZNQCLSA-N 2 0 245.326 2.012 20 0 BEADRP CC(C)c1ccccc1N[C@H]([NH3+])CCC[NH3+] ZINC001170898030 972056447 /nfs/dbraw/zinc/05/64/47/972056447.db2.gz BCAFCAOHXCMTRB-ZDUSSCGKSA-N 2 0 221.348 2.246 20 0 BEADRP Cc1cc(Cl)cc(N[C@@H]([NH3+])CCC[NH3+])c1 ZINC001170900274 972065408 /nfs/dbraw/zinc/06/54/08/972065408.db2.gz JWMCQTFZBXMCHW-LLVKDONJSA-N 2 0 227.739 2.084 20 0 BEADRP CCCc1ccc(N[C@H]([NH3+])CCC[NH3+])cc1 ZINC001170900588 972065775 /nfs/dbraw/zinc/06/57/75/972065775.db2.gz MKJPTCQFBYDQJI-ZDUSSCGKSA-N 2 0 221.348 2.075 20 0 BEADRP C[C@@H]([NH3+])CCNc1cccc(C2=[NH+]CCC2)c1 ZINC001170895254 972068913 /nfs/dbraw/zinc/06/89/13/972068913.db2.gz QPNYQTBYTLBAGV-LLVKDONJSA-N 2 0 231.343 2.419 20 0 BEADRP C[C@@H]([NH3+])CCNc1ccc([C@@H]2CC[N@H+](C)C2)cc1 ZINC001170894543 972070172 /nfs/dbraw/zinc/07/01/72/972070172.db2.gz KCIVUQQEYKABJO-TZMCWYRMSA-N 2 0 247.386 2.255 20 0 BEADRP CCn1ccc2cc(N[C@@H]([NH3+])CCC[NH3+])ccc21 ZINC001170902879 972073762 /nfs/dbraw/zinc/07/37/62/972073762.db2.gz GSIZZMNCEDUDEG-CQSZACIVSA-N 2 0 246.358 2.097 20 0 BEADRP CSc1cc(N[C@H]([NH3+])CCC[NH3+])ccc1C ZINC001170903261 972074873 /nfs/dbraw/zinc/07/48/73/972074873.db2.gz ISCCFYUJHFPYBC-LBPRGKRZSA-N 2 0 239.388 2.153 20 0 BEADRP CC[C@@H](C)C[C@@H](CC)[NH2+][C@@H]1C[NH2+]C[C@@H]1C ZINC001246113525 972177068 /nfs/dbraw/zinc/17/70/68/972177068.db2.gz BZPHTLXVGIGPLH-YVECIDJPSA-N 2 0 212.381 2.399 20 0 BEADRP CCCC(CCC)[NH2+][C@H]1C[NH2+]CC12CC2 ZINC001246136369 972191280 /nfs/dbraw/zinc/19/12/80/972191280.db2.gz WMPOUODSHDVEDS-LBPRGKRZSA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@@H]1C[C@H]([NH2+]CCCCC[NH3+])C[C@H](CC)[NH2+]1 ZINC001246165451 972201220 /nfs/dbraw/zinc/20/12/20/972201220.db2.gz QZYLXNUSIUCFRF-WDNDVIMCSA-N 3 0 241.423 2.014 20 0 BEADRP Cc1ccc2c(c1)C[C@H]([NH2+]C[C@H]1CCC[NH2+]1)CC2 ZINC001246185635 972210901 /nfs/dbraw/zinc/21/09/01/972210901.db2.gz CLIXUDFKXBMVTF-HZPDHXFCSA-N 2 0 244.382 2.194 20 0 BEADRP C[C@H]1C[C@H]([NH2+]C2(Cc3ccccc3)CC2)CC[NH2+]1 ZINC001246187046 972212330 /nfs/dbraw/zinc/21/23/30/972212330.db2.gz FPYQQIHGEMKXTG-DZGCQCFKSA-N 2 0 244.382 2.492 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2C[C@H]([NH3+])C2)CC(C)(C)C1 ZINC001246190714 972212830 /nfs/dbraw/zinc/21/28/30/972212830.db2.gz RRESNSRJXWDVKA-KKOKHZNYSA-N 2 0 210.365 2.281 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]C2(Cc3ccccc3)CC2)CC[NH2+]1 ZINC001246187049 972213013 /nfs/dbraw/zinc/21/30/13/972213013.db2.gz FPYQQIHGEMKXTG-ZFWWWQNUSA-N 2 0 244.382 2.492 20 0 BEADRP C[C@H]1C[C@H]([NH2+]C[C@@H]2CC[NH2+]2)CC(C)(C)C1 ZINC001246216908 972218708 /nfs/dbraw/zinc/21/87/08/972218708.db2.gz JHPGLFIUQJOVBS-SRVKXCTJSA-N 2 0 210.365 2.153 20 0 BEADRP CS[C@@H](C)CC[N@@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC001208154608 957033517 /nfs/dbraw/zinc/03/35/17/957033517.db2.gz MVEPZLSYFWHMFU-QWHCGFSZSA-N 2 0 242.432 2.156 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH+]2CC[C@@]3(CC3(F)F)C2)C1 ZINC001208608034 957086789 /nfs/dbraw/zinc/08/67/89/957086789.db2.gz FFWLNUVBWLTUMV-NWDGAFQWSA-N 2 0 244.329 2.059 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH+]2CCC(C)(C)C2)C1 ZINC001208606393 957087953 /nfs/dbraw/zinc/08/79/53/957087953.db2.gz FSYCBTWJDMUSJX-GFCCVEGCSA-N 2 0 210.365 2.060 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH+]2CCC(C)(C)C2)C1 ZINC001208606395 957093527 /nfs/dbraw/zinc/09/35/27/957093527.db2.gz FSYCBTWJDMUSJX-LBPRGKRZSA-N 2 0 210.365 2.060 20 0 BEADRP C[N@H+]1C[C@@H]2C[NH+](CC3(C)CCCCC3)C[C@@H]2C1 ZINC001208902026 957232801 /nfs/dbraw/zinc/23/28/01/957232801.db2.gz FUDJLONZTWVVMK-OKILXGFUSA-N 2 0 236.403 2.450 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@H]2CC[C@@H](C)[NH2+]C2)C1 ZINC000397535110 957682699 /nfs/dbraw/zinc/68/26/99/957682699.db2.gz OJPMJGGSUIIWTO-NDBYEHHHSA-N 2 0 210.365 2.153 20 0 BEADRP Cc1ccc2c(c1)C[C@@H]([NH2+]C[C@@H]([NH3+])C(C)C)CC2 ZINC001246332572 972292539 /nfs/dbraw/zinc/29/25/39/972292539.db2.gz NPLXSJPKVPAWEB-JKSUJKDBSA-N 2 0 246.398 2.425 20 0 BEADRP Cc1ccc(CC[C@H](C)[NH2+][C@H]2CC23C[NH2+]C3)cc1 ZINC001246445257 972312986 /nfs/dbraw/zinc/31/29/86/972312986.db2.gz NEPOVSUAVOJIFP-ZFWWWQNUSA-N 2 0 244.382 2.268 20 0 BEADRP CCCCC[C@H](CC)[NH2+][C@H]1CC12C[NH2+]C2 ZINC001246441931 972313850 /nfs/dbraw/zinc/31/38/50/972313850.db2.gz ATXQZUFWQQCWSQ-RYUDHWBXSA-N 2 0 210.365 2.297 20 0 BEADRP CCCCCC[C@H](C)[NH2+]CCCNCCC[NH3+] ZINC001246451657 972320598 /nfs/dbraw/zinc/32/05/98/972320598.db2.gz HYSGKDMBARLKIC-AWEZNQCLSA-N 2 0 243.439 2.263 20 0 BEADRP CC[C@@H]1CC[C@H]([NH2+]C[C@@]2(C)CCC[NH2+]2)C1 ZINC001246466024 972338991 /nfs/dbraw/zinc/33/89/91/972338991.db2.gz KEHXUSNSDMBCCS-FRRDWIJNSA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@@H]1CC[C@@H]([NH2+]C[C@@]2(C)CCC[NH2+]2)C1 ZINC001246466025 972340609 /nfs/dbraw/zinc/34/06/09/972340609.db2.gz KEHXUSNSDMBCCS-JHJVBQTASA-N 2 0 210.365 2.297 20 0 BEADRP CCCC[C@H](C)[NH2+]C[C@@H]1C[NH2+]C[C@H](C)C1 ZINC000398720948 958372920 /nfs/dbraw/zinc/37/29/20/958372920.db2.gz AYWDCGKCEZKRIC-AGIUHOORSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H](Cc1ccco1)[NH2+]C[C@H]1C[NH2+]C[C@@H](C)C1 ZINC000398805635 958397103 /nfs/dbraw/zinc/39/71/03/958397103.db2.gz PHFDSOQEVYHZHT-YNEHKIRRSA-N 2 0 236.359 2.046 20 0 BEADRP C(C1CC[NH2+]CC1)[NH+]1C2CCCC1CCC2 ZINC000707229091 958418637 /nfs/dbraw/zinc/41/86/37/958418637.db2.gz ZYLQJKMXXWFUNO-UHFFFAOYSA-N 2 0 222.376 2.393 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]C[C@]23C[C@H]2CCC3)C12CCC2 ZINC000693558478 958793967 /nfs/dbraw/zinc/79/39/67/958793967.db2.gz NAELCLCBCUFIFF-NDBYEHHHSA-N 2 0 220.360 2.036 20 0 BEADRP CSCC[C@@H](C)[NH2+]CC[C@@H]1CCC[N@@H+]1C ZINC000707909428 958812317 /nfs/dbraw/zinc/81/23/17/958812317.db2.gz HXMJSQJESRDPSZ-NEPJUHHUSA-N 2 0 230.421 2.202 20 0 BEADRP CSCC[C@H](C)[NH2+]CC[C@H]1CCC[N@@H+]1C ZINC000707909430 958810508 /nfs/dbraw/zinc/81/05/08/958810508.db2.gz HXMJSQJESRDPSZ-NWDGAFQWSA-N 2 0 230.421 2.202 20 0 BEADRP CC(C)C1CC[NH+](C[C@H]2C[C@@H]([NH3+])C2)CC1 ZINC000693568991 958862132 /nfs/dbraw/zinc/86/21/32/958862132.db2.gz OPIPVPYSFDDEOD-BJHJDKERSA-N 2 0 210.365 2.092 20 0 BEADRP C[C@H]([NH2+]C[C@@]12C[C@@H]1CCCC2)[C@H]1CCC[NH2+]1 ZINC000693569802 958865017 /nfs/dbraw/zinc/86/50/17/958865017.db2.gz WPRCYSDAVYEGLZ-IGQOVBAYSA-N 2 0 222.376 2.297 20 0 BEADRP CC[C@H]1CCCCC[N@@H+]1C[C@H]1C[C@@H]([NH3+])C1 ZINC000693577153 958867904 /nfs/dbraw/zinc/86/79/04/958867904.db2.gz BWMHRGIQKFVTHU-XQQFMLRXSA-N 2 0 210.365 2.378 20 0 BEADRP CC(C)(C)[C@@H]1CC[N@H+](C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000693578101 958869139 /nfs/dbraw/zinc/86/91/39/958869139.db2.gz JBBUAUFYLDPQAJ-UTUOFQBUSA-N 2 0 210.365 2.092 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]C[C@]23C[C@H]2CCC3)C1 ZINC000693592060 958902530 /nfs/dbraw/zinc/90/25/30/958902530.db2.gz OUNGAGPKROCGPB-NDBYEHHHSA-N 2 0 208.349 2.036 20 0 BEADRP C1=C[C@@H]2C[C@H]1C[C@H]2C[N@@H+]1CC[C@]2(C1)CCC[NH2+]C2 ZINC001222141452 972386863 /nfs/dbraw/zinc/38/68/63/972386863.db2.gz MJDLCTPHQVJXFB-XUWVNRHRSA-N 2 0 246.398 2.274 20 0 BEADRP [NH3+]Cc1cccn1-c1ccc([C@@H]2CCC[NH2+]2)cc1 ZINC001167593264 958990850 /nfs/dbraw/zinc/99/08/50/958990850.db2.gz OIGORKZRIUMGLD-HNNXBMFYSA-N 2 0 241.338 2.361 20 0 BEADRP CS[C@H](C)C[NH2+][C@@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C ZINC000693665902 959180797 /nfs/dbraw/zinc/18/07/97/959180797.db2.gz WJIZYLZXXSDAMR-WISYIIOYSA-N 2 0 242.432 2.104 20 0 BEADRP Cc1noc(C)c1[C@H](C)[NH2+]CCCC[NH+](C)C ZINC000690747682 959205221 /nfs/dbraw/zinc/20/52/21/959205221.db2.gz LWCMHJTZMHWGQY-JTQLQIEISA-N 2 0 239.363 2.284 20 0 BEADRP Cc1cc(F)ccc1C[N@@H+]1CC[C@@H](CC[NH3+])C1 ZINC000690744617 959206956 /nfs/dbraw/zinc/20/69/56/959206956.db2.gz YPPMGYSAEXLXCL-GFCCVEGCSA-N 2 0 236.334 2.305 20 0 BEADRP Cc1ccc(F)cc1C[N@@H+]1CC[C@@H](CC[NH3+])C1 ZINC000690744455 959208492 /nfs/dbraw/zinc/20/84/92/959208492.db2.gz XRMBANVXFHEZTF-GFCCVEGCSA-N 2 0 236.334 2.305 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCC[C@@]12CCC[NH2+]C2 ZINC001222232898 972414487 /nfs/dbraw/zinc/41/44/87/972414487.db2.gz YKXBGZNFJAGNPV-QWHCGFSZSA-N 2 0 210.365 2.251 20 0 BEADRP Cc1cccc(CC[NH2+][C@@H]2C[C@@H]([NH3+])C23CCC3)c1 ZINC000405277428 959430907 /nfs/dbraw/zinc/43/09/07/959430907.db2.gz XSQZRAUPZPFBKA-HUUCEWRRSA-N 2 0 244.382 2.397 20 0 BEADRP C[C@H](NCC[C@@H]1CCC[N@@H+]1C)c1cncs1 ZINC000693892815 959483908 /nfs/dbraw/zinc/48/39/08/959483908.db2.gz DQKHKBXEQZVGIR-QWRGUYRKSA-N 2 0 239.388 2.278 20 0 BEADRP CCC[C@@H](C)C[N@@H+]1CCCC[C@H](C[NH3+])C1 ZINC000308799150 959504910 /nfs/dbraw/zinc/50/49/10/959504910.db2.gz DFKZPGBYUUELOQ-CHWSQXEVSA-N 2 0 212.381 2.483 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1OCc1ccccc1C[NH3+] ZINC001217781438 959593862 /nfs/dbraw/zinc/59/38/62/959593862.db2.gz LAMBCTMCSJKPMM-SWLSCSKDSA-N 2 0 248.370 2.050 20 0 BEADRP C[C@H]1C[N@@H+](C2CCC3(CC3)CC2)C[C@H]1C[NH3+] ZINC000708829636 959859949 /nfs/dbraw/zinc/85/99/49/959859949.db2.gz FDPXNDIBZSBUEV-NWDGAFQWSA-N 2 0 222.376 2.236 20 0 BEADRP [NH3+]Cc1cccc(O[C@@H]2CCC[C@]23CC[NH2+]C3)c1 ZINC001218098678 959863461 /nfs/dbraw/zinc/86/34/61/959863461.db2.gz YQUJFHBUPXJUTL-HUUCEWRRSA-N 2 0 246.354 2.056 20 0 BEADRP C[C@H]1C[N@@H+](C2CCC(C)(C)CC2)C[C@H]1C[NH3+] ZINC000708875847 960002803 /nfs/dbraw/zinc/00/28/03/960002803.db2.gz RQOMNYCPBKGQEN-NWDGAFQWSA-N 2 0 224.392 2.482 20 0 BEADRP CC1(C)[C@@H]2C[C@@H]([NH+]3CCC(C[NH3+])CC3)C[C@@H]21 ZINC001246537182 972479176 /nfs/dbraw/zinc/47/91/76/972479176.db2.gz FVPGRLZGGYNGBR-XYYAHUGASA-N 2 0 222.376 2.092 20 0 BEADRP CO[C@H]1CCC[C@@H]1[NH2+]CCC[NH+]1CCCCC1 ZINC000695446392 960259478 /nfs/dbraw/zinc/25/94/78/960259478.db2.gz BFEHGFQNNKRIAJ-KBPBESRZSA-N 2 0 240.391 2.020 20 0 BEADRP C[N@H+](CCC1CC[NH+](C)CC1)Cc1cccnc1 ZINC001207479779 960356443 /nfs/dbraw/zinc/35/64/43/960356443.db2.gz NMKGDBCDBQQGRA-UHFFFAOYSA-N 2 0 247.386 2.245 20 0 BEADRP C1CC12CCC[C@H]([NH2+][C@@H]1[C@H]3C[C@H]4C[NH2+][C@H]1[C@H]4C3)C2 ZINC000695700217 960383140 /nfs/dbraw/zinc/38/31/40/960383140.db2.gz MFUYDCITWRGZLE-UQGHGMQMSA-N 2 0 246.398 2.295 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+][C@H]1CCCC2(CC2)C1 ZINC000695765017 960442943 /nfs/dbraw/zinc/44/29/43/960442943.db2.gz SJMJIVGBCPSFMD-AVGNSLFASA-N 2 0 222.376 2.426 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+][C@H]2CC3CCC2CC3)C1 ZINC000310169253 961160087 /nfs/dbraw/zinc/16/00/87/961160087.db2.gz OZIRMGBPYVHIBX-JYVUQVBGSA-N 2 0 236.403 2.497 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[N@H+](C)CCF ZINC001167835280 961211350 /nfs/dbraw/zinc/21/13/50/961211350.db2.gz QSRDMBPNSKHYFV-GFCCVEGCSA-N 2 0 218.360 2.398 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CC[C@H]1COC ZINC001167834912 961208338 /nfs/dbraw/zinc/20/83/38/961208338.db2.gz NTYNWZGZUFOKQM-KBPBESRZSA-N 2 0 242.407 2.218 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CC[C@H]1COC ZINC001167834913 961212606 /nfs/dbraw/zinc/21/26/06/961212606.db2.gz NTYNWZGZUFOKQM-KGLIPLIRSA-N 2 0 242.407 2.218 20 0 BEADRP Cl/C=C/C[NH+]1CCC([C@@H]2CCC[NH2+]C2)CC1 ZINC000692915157 961321371 /nfs/dbraw/zinc/32/13/71/961321371.db2.gz LSKNFKZVXNRRAH-ZABGRMTBSA-N 2 0 242.794 2.451 20 0 BEADRP Cl/C=C/C[NH+]1CCC([C@H]2CCC[NH2+]C2)CC1 ZINC000692915154 961322089 /nfs/dbraw/zinc/32/20/89/961322089.db2.gz LSKNFKZVXNRRAH-NHEDYWLLSA-N 2 0 242.794 2.451 20 0 BEADRP [NH2+]=CNc1ccc2c(c1)C1(CC2)CC[NH2+]CC1 ZINC001167864322 961328769 /nfs/dbraw/zinc/32/87/69/961328769.db2.gz FXMABDBVITXYFP-UHFFFAOYSA-N 2 0 229.327 2.273 20 0 BEADRP C[N@@H+]1CC[C@]2(CC[NH+](C[C@@H]3C[C@H]4C=C[C@@H]3C4)C2)C1 ZINC001207631435 961394872 /nfs/dbraw/zinc/39/48/72/961394872.db2.gz HQBPBKHHLRZSMD-FZKCQIBNSA-N 2 0 246.398 2.226 20 0 BEADRP C[NH+](C)C[C@@]12C[C@@H]1C[N@H+](C[C@@H]1C[C@H]3C=C[C@@H]1C3)C2 ZINC001207631592 961402382 /nfs/dbraw/zinc/40/23/82/961402382.db2.gz JNEWPUYQDCNBRE-ZVDSWSACSA-N 2 0 246.398 2.082 20 0 BEADRP CC(C)CC[C@@H](C)[NH+]1CC2(C1)CCC[NH2+]C2 ZINC000709791083 961578409 /nfs/dbraw/zinc/57/84/09/961578409.db2.gz SXFNENHRJUTLEF-CYBMUJFWSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1ccncc1[C@@H](C)[NH2+]C[C@@H]1CC[C@H]([NH3+])C1 ZINC000925883976 961728371 /nfs/dbraw/zinc/72/83/71/961728371.db2.gz ZSYQBZOFNIMXRX-UPJWGTAASA-N 2 0 233.359 2.168 20 0 BEADRP [NH2+]=C(Nc1ccc2c(c1)C=CC2)SCC[NH3+] ZINC001167911911 961816079 /nfs/dbraw/zinc/81/60/79/961816079.db2.gz GVANHLJCUNEJPA-UHFFFAOYSA-N 2 0 233.340 2.294 20 0 BEADRP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+][C@H]2C[C@H]3C[C@H]3C2)C1 ZINC001167914958 961839777 /nfs/dbraw/zinc/83/97/77/961839777.db2.gz ZDKLQCZROABFFU-XHJNMGKDSA-N 2 0 222.376 2.247 20 0 BEADRP [NH3+]C1(CC2CC2)CC[NH+]([C@@H]2C[C@H]3C[C@H]3C2)CC1 ZINC001167916144 961862308 /nfs/dbraw/zinc/86/23/08/961862308.db2.gz FWZOKSVOCWNPGI-BTTYYORXSA-N 2 0 234.387 2.378 20 0 BEADRP C[NH+](C)[C@H]1CC[C@@H]([NH2+][C@H]2C[C@H]3C[C@H]3C2)CC1 ZINC001167919174 961921864 /nfs/dbraw/zinc/92/18/64/961921864.db2.gz UQMFDFXIMDBYII-KCLGILNXSA-N 2 0 222.376 2.247 20 0 BEADRP C[NH+](C)CC1CCC([NH2+][C@@H]2C[C@H]3C[C@H]3C2)CC1 ZINC001167923450 961986581 /nfs/dbraw/zinc/98/65/81/961986581.db2.gz DMGLPQLPQLERQE-WRDRVURWSA-N 2 0 236.403 2.495 20 0 BEADRP C[NH+](C)CC1CC[NH+]([C@H]2C[C@H]3C[C@H]3C2)CC1 ZINC001167941016 962175928 /nfs/dbraw/zinc/17/59/28/962175928.db2.gz UBSRCFQGKUPLDU-WDNDVIMCSA-N 2 0 222.376 2.059 20 0 BEADRP C[C@@H]1CC[C@@H]([NH+]2CC3(C2)CCC[NH2+]C3)C[C@H]1C ZINC000709984274 962211476 /nfs/dbraw/zinc/21/14/76/962211476.db2.gz RHKAKHHIZYEJAX-MGPQQGTHSA-N 2 0 236.403 2.497 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH2+]CCCc2ccccn2)CC1 ZINC000710433512 962378478 /nfs/dbraw/zinc/37/84/78/962378478.db2.gz IRDQULXGMBLAQC-OAHLLOKOSA-N 2 0 247.386 2.088 20 0 BEADRP [NH3+]CC1C[NH+](CCC23CC4CC(CC(C4)C2)C3)C1 ZINC000712534496 962914055 /nfs/dbraw/zinc/91/40/55/962914055.db2.gz YNKJFAAKCDCWJJ-UHFFFAOYSA-N 2 0 248.414 2.483 20 0 BEADRP Cc1cc2[nH]ccc2c(NC[C@H]2C[NH2+][C@H](C)C2)[nH+]1 ZINC001155101893 962979813 /nfs/dbraw/zinc/97/98/13/962979813.db2.gz NUKVHCVLAUINQL-MWLCHTKSSA-N 2 0 244.342 2.281 20 0 BEADRP Cc1c[nH+]c(NC(=[NH2+])C(C)(C)C)cc1N ZINC001155180422 963008077 /nfs/dbraw/zinc/00/80/77/963008077.db2.gz XKSQLCFIZPQEFL-UHFFFAOYSA-N 2 0 206.293 2.407 20 0 BEADRP [NH3+]CC[C@@H]1CC[N@H+](C[C@@H]2CCC(F)(F)C2)C1 ZINC000300952074 963043625 /nfs/dbraw/zinc/04/36/25/963043625.db2.gz OKCHGWJKYFRSME-GHMZBOCLSA-N 2 0 232.318 2.093 20 0 BEADRP Cc1[nH+]c(N[C@H](C)C[NH+](C)C)cc2[nH]ccc21 ZINC001155921539 963206064 /nfs/dbraw/zinc/20/60/64/963206064.db2.gz NPHQAXYKHVXDOL-SECBINFHSA-N 2 0 232.331 2.233 20 0 BEADRP CC(C)N(CCC[NH3+])c1[nH+]ccc2c1ccn2C ZINC001156118440 963263226 /nfs/dbraw/zinc/26/32/26/963263226.db2.gz KJJDIOMMCWFFKQ-UHFFFAOYSA-N 2 0 246.358 2.137 20 0 BEADRP Cc1[nH+]c(N(C)C2CC[NH2+]CC2)cc2[nH]ccc21 ZINC001156176344 963276853 /nfs/dbraw/zinc/27/68/53/963276853.db2.gz YVHLNNSWGHDCFW-UHFFFAOYSA-N 2 0 244.342 2.060 20 0 BEADRP C[C@H]1CC[C@@H]([N@H+](C)CC2CC[NH+](C)CC2)C1 ZINC000093088604 963292644 /nfs/dbraw/zinc/29/26/44/963292644.db2.gz OYJNFIGVDDRGHY-GXTWGEPZSA-N 2 0 224.392 2.449 20 0 BEADRP CN(c1[nH+]ccc2[nH]ccc21)[C@]1(C)CCC[NH2+]C1 ZINC001156956944 963502734 /nfs/dbraw/zinc/50/27/34/963502734.db2.gz SQZLTYYSIZMZKW-CQSZACIVSA-N 2 0 244.342 2.141 20 0 BEADRP C[C@H]([N@H+](C)C[C@@H]1CCCC[NH2+]C1)C1(C)CC1 ZINC000697013844 963639998 /nfs/dbraw/zinc/63/99/98/963639998.db2.gz AIHCYNJVRWHKCY-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1[nH+]c(N2C[C@H](C)[NH2+][C@@H](C)C2)cc2[nH]ccc21 ZINC001158178402 963821210 /nfs/dbraw/zinc/82/12/10/963821210.db2.gz PUTJGHOZAQVUSL-UWVGGRQHSA-N 2 0 244.342 2.058 20 0 BEADRP C[C@@]1(C[NH3+])CCCN(c2cc3[nH]ccc3c[nH+]2)C1 ZINC001158675654 963900581 /nfs/dbraw/zinc/90/05/81/963900581.db2.gz OMWWGHRJFOEINF-AWEZNQCLSA-N 2 0 244.342 2.128 20 0 BEADRP Cc1[nH+]c(-n2ccc(C[NH3+])c2)cc2[nH]ccc21 ZINC001158767020 963921402 /nfs/dbraw/zinc/92/14/02/963921402.db2.gz PJEIXRLGKTZDOG-UHFFFAOYSA-N 2 0 226.283 2.121 20 0 BEADRP Cc1[nH+]c(N(C)C(C)(C)C[NH3+])cc2[nH]ccc21 ZINC001159055447 963989605 /nfs/dbraw/zinc/98/96/05/963989605.db2.gz NYKKAPCQPNBUFF-UHFFFAOYSA-N 2 0 232.331 2.045 20 0 BEADRP CC1CCC([N@@H+]2C[C@H]3C[C@@]3(C[NH+](C)C)C2)CC1 ZINC001168222138 964003367 /nfs/dbraw/zinc/00/33/67/964003367.db2.gz ZFCKSMNKLCYLNJ-HXSCFSKGSA-N 2 0 236.403 2.449 20 0 BEADRP Cc1cccc2[nH+]cc(NC3=CCC[NH2+]CC3)n21 ZINC001159363828 964068312 /nfs/dbraw/zinc/06/83/12/964068312.db2.gz AMTCTUHZWHDASG-UHFFFAOYSA-N 2 0 242.326 2.322 20 0 BEADRP Cc1cc2[nH]ccc2c(NCC[C@@H](C)[NH3+])[nH+]1 ZINC001159772453 964187472 /nfs/dbraw/zinc/18/74/72/964187472.db2.gz CKMTVBKFMPJTGP-MRVPVSSYSA-N 2 0 218.304 2.021 20 0 BEADRP c1cc([C@@H]2CC[NH2+]C2)ccc1NC1=CC[NH2+]CC1 ZINC001159775469 964189808 /nfs/dbraw/zinc/18/98/08/964189808.db2.gz KIVXFAHJYSZNLV-CYBMUJFWSA-N 2 0 243.354 2.053 20 0 BEADRP CC[NH2+]Cc1cccc(NC=C2CC[NH2+]CC2)c1 ZINC001159955158 964232045 /nfs/dbraw/zinc/23/20/45/964232045.db2.gz BBRUFQIKLOFDLR-UHFFFAOYSA-N 2 0 245.370 2.475 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)[C@@H](C)Cc1ccncc1 ZINC001256747087 1169836811 /nfs/dbraw/zinc/83/68/11/1169836811.db2.gz CLJNPUWJPHQDEK-AWEZNQCLSA-N 2 0 249.402 2.286 20 0 BEADRP C[C@H]([NH2+]C1CCC([NH+](C)C)CC1)c1ccno1 ZINC001168315707 964422545 /nfs/dbraw/zinc/42/25/45/964422545.db2.gz LCUOUVRYYVKRIV-UNXYVOJBSA-N 2 0 237.347 2.198 20 0 BEADRP C[NH+](C)C1CCC([NH2+][C@@]2(C)CCCOC2)CC1 ZINC001168316098 964436162 /nfs/dbraw/zinc/43/61/62/964436162.db2.gz VSDFNSADTSXAKO-RUXDESIVSA-N 2 0 240.391 2.018 20 0 BEADRP C[NH+](C)C1CCC([N@H+]2C[C@@H]3[C@H](C2)C3(C)C)CC1 ZINC001168324720 964444656 /nfs/dbraw/zinc/44/46/56/964444656.db2.gz VUAYJDRTOSBGOE-LLZFXZEUSA-N 2 0 236.403 2.447 20 0 BEADRP C[NH+](C)C1CCC([N@@H+]2C[C@@H]3C[C@H]2C[C@H]3F)CC1 ZINC001168323230 964447476 /nfs/dbraw/zinc/44/74/76/964447476.db2.gz VXAYUSZDJCJXLZ-FDZXDKCCSA-N 2 0 240.366 2.292 20 0 BEADRP CC(C)CCC[NH2+]CC[C@H](C)[NH+](C)C ZINC000697825491 964549359 /nfs/dbraw/zinc/54/93/59/964549359.db2.gz PBJDXOMPLYHXOW-LBPRGKRZSA-N 2 0 200.370 2.352 20 0 BEADRP C[C@H](CC[NH2+][C@@H]1CCC[C@@H]2C[C@@H]21)[NH+](C)C ZINC000697869828 964594815 /nfs/dbraw/zinc/59/48/15/964594815.db2.gz IXSHDOMEIHBGTQ-FVCCEPFGSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@H](CC[NH2+]CCC(C)(C)C)[NH+](C)C ZINC000697870462 964595505 /nfs/dbraw/zinc/59/55/05/964595505.db2.gz LOBOEMVOVBBKPZ-LLVKDONJSA-N 2 0 200.370 2.352 20 0 BEADRP CCC(CC)C[NH2+]CC[C@H](C)[NH+](C)C ZINC000697869339 964595737 /nfs/dbraw/zinc/59/57/37/964595737.db2.gz FHQPQDLNYMCFNC-NSHDSACASA-N 2 0 200.370 2.352 20 0 BEADRP C[NH+](C)CCNc1cc(N2CCCCC2)cc[nH+]1 ZINC001161666036 964670239 /nfs/dbraw/zinc/67/02/39/964670239.db2.gz CKJMEBBTJGEUHD-UHFFFAOYSA-N 2 0 248.374 2.045 20 0 BEADRP C[NH+](C)CCCCNc1cccn2c[nH+]cc12 ZINC001161730611 964719619 /nfs/dbraw/zinc/71/96/19/964719619.db2.gz MCSNEXOLNFIQKP-UHFFFAOYSA-N 2 0 232.331 2.088 20 0 BEADRP CC(C)(C)[NH+]1CC(Nc2cc3[nH]ccc3c[nH+]2)C1 ZINC001162219810 964876253 /nfs/dbraw/zinc/87/62/53/964876253.db2.gz DXOZYHSWFWQDGI-UHFFFAOYSA-N 2 0 244.342 2.458 20 0 BEADRP [NH3+][C@@H]1CCC[C@H](Nc2ccc(C3([NH3+])CC3)cc2)C1 ZINC001162399335 964960009 /nfs/dbraw/zinc/96/00/09/964960009.db2.gz BAXDQRDNHXDOPH-OCCSQVGLSA-N 2 0 245.370 2.316 20 0 BEADRP [NH3+][C@@H]1CCc2c1cccc2N[C@@H]1CCC[C@@H]([NH3+])C1 ZINC001162404765 964962372 /nfs/dbraw/zinc/96/23/72/964962372.db2.gz QNAJFPMAUQWCNZ-JTNHKYCSSA-N 2 0 245.370 2.314 20 0 BEADRP Cn1ccc2c1[nH+]ccc2N[C@H]1CCC[C@@H]([NH3+])C1 ZINC001162405696 964965051 /nfs/dbraw/zinc/96/50/51/964965051.db2.gz WUQCXSYDBXOSEL-MNOVXSKESA-N 2 0 244.342 2.255 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H]2C=CCC2)CC1 ZINC000698207867 965105483 /nfs/dbraw/zinc/10/54/83/965105483.db2.gz YDUXKRGJOPFMNX-GFCCVEGCSA-N 2 0 208.349 2.169 20 0 BEADRP C[C@H]1[NH2+]CC[C@H]1Nc1ccc(C2([NH3+])CCC2)cc1 ZINC001162677437 965109295 /nfs/dbraw/zinc/10/92/95/965109295.db2.gz HYQCCEYLEXRYCM-BXUZGUMPSA-N 2 0 245.370 2.187 20 0 BEADRP Cc1c[nH+]c(NC[C@@H]2CC[NH2+]C[C@@H]2F)c(C)c1 ZINC001162804968 965188401 /nfs/dbraw/zinc/18/84/01/965188401.db2.gz CECBOSMLJAQBOK-RYUDHWBXSA-N 2 0 237.322 2.058 20 0 BEADRP CC(C)[C@@H]([NH3+])CC[N@H+](C)CC1CC(C)C1 ZINC000691033368 965269504 /nfs/dbraw/zinc/26/95/04/965269504.db2.gz NAYCNFXWKUZTLV-BPCQOVAHSA-N 2 0 212.381 2.338 20 0 BEADRP C[N@H+](CCc1ccccc1)C1CCC([NH3+])CC1 ZINC000088195514 965444188 /nfs/dbraw/zinc/44/41/88/965444188.db2.gz OQDRBGHSEFTYAA-UHFFFAOYSA-N 2 0 232.371 2.431 20 0 BEADRP CC[N@@H+]1CCCN(c2cc3[nH]ccc3c[nH+]2)CC1 ZINC001163771346 965575607 /nfs/dbraw/zinc/57/56/07/965575607.db2.gz PIAVHLDSWNSUBT-UHFFFAOYSA-N 2 0 244.342 2.095 20 0 BEADRP C[C@H](C[NH+](C)C)Nc1ccc2c(N)cc[nH+]c2c1 ZINC001163783031 965589778 /nfs/dbraw/zinc/58/97/78/965589778.db2.gz XETIVEGAABZITI-SNVBAGLBSA-N 2 0 244.342 2.179 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@@H]([NH3+])CC2)cc1F ZINC001205093654 965719490 /nfs/dbraw/zinc/71/94/90/965719490.db2.gz DFXQJSFNIMEMMD-CYBMUJFWSA-N 2 0 236.334 2.447 20 0 BEADRP C[C@H]1CC[C@@H](C[NH3+])N(c2cc3[nH]ccc3c[nH+]2)C1 ZINC001164060841 965725333 /nfs/dbraw/zinc/72/53/33/965725333.db2.gz CGNXTXPWJIRNDS-JQWIXIFHSA-N 2 0 244.342 2.127 20 0 BEADRP COc1cc[nH+]c(N2CCC[C@@](C)(C[NH3+])CC2)c1 ZINC001164243132 965809077 /nfs/dbraw/zinc/80/90/77/965809077.db2.gz XIKHUJMBKWFLDG-CQSZACIVSA-N 2 0 249.358 2.046 20 0 BEADRP C[N@@H+](Cc1cccnc1)CC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000699261408 965826324 /nfs/dbraw/zinc/82/63/24/965826324.db2.gz RHTXHVUNHDBBCL-GOOCMWNKSA-N 2 0 245.370 2.044 20 0 BEADRP C([NH2+][C@]12C[C@H]1CCC2)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000699291200 965835578 /nfs/dbraw/zinc/83/55/78/965835578.db2.gz JTNTWCRIXGMBQA-URSGVKGYSA-N 2 0 220.360 2.049 20 0 BEADRP Cc1cc(C[N@@H+]2CCC[C@@H]([NH3+])CC2)c(C)cc1O ZINC001205110302 965836098 /nfs/dbraw/zinc/83/60/98/965836098.db2.gz RECAWZPLLLURDK-CQSZACIVSA-N 2 0 248.370 2.322 20 0 BEADRP C[N@H+](CC1C[C@H]2CC[C@@H](C1)[NH2+]2)C1CCC1 ZINC000699305556 965843306 /nfs/dbraw/zinc/84/33/06/965843306.db2.gz ODKBWQYDICKZBT-YOGCLGLASA-N 2 0 208.349 2.001 20 0 BEADRP Cc1c[nH+]c(N2C[C@@H](C[NH3+])CC[C@H]2C)cc1C ZINC001164474578 965894918 /nfs/dbraw/zinc/89/49/18/965894918.db2.gz SBZMHFACJRXZBQ-CHWSQXEVSA-N 2 0 233.359 2.262 20 0 BEADRP CC1=C[C@H](C)[C@@H](CN2CC[C@@H]3[NH2+]CC[C@H]32)CC1 ZINC001235039603 965986897 /nfs/dbraw/zinc/98/68/97/965986897.db2.gz VWBYIUXOKAPWBI-LJISPDSOSA-N 2 0 234.387 2.415 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCCC[C@@]12CC[NH2+]C2 ZINC001235123366 966008607 /nfs/dbraw/zinc/00/86/07/966008607.db2.gz JIRJCLONQSZDNO-STQMWFEESA-N 2 0 210.365 2.251 20 0 BEADRP CC/C=C\CCC[N@H+]1C[C@H]2CC[C@@H](C1)[C@@H]2[NH3+] ZINC001235958529 966181406 /nfs/dbraw/zinc/18/14/06/966181406.db2.gz HFRGQSADDLXXPF-MAUVLDTNSA-N 2 0 222.376 2.402 20 0 BEADRP [NH3+][C@@]12CC[C@H]1C[N@H+](CCCCc1ccccc1)C2 ZINC001235978874 966188148 /nfs/dbraw/zinc/18/81/48/966188148.db2.gz LBYLDNWZBSVJEP-JKSUJKDBSA-N 2 0 244.382 2.432 20 0 BEADRP CCC1(Nc2ccc(C)cc2C[NH+](C)C)C[NH2+]C1 ZINC001168586910 966942485 /nfs/dbraw/zinc/94/24/85/966942485.db2.gz NJIPCDJLYOKGBP-UHFFFAOYSA-N 2 0 247.386 2.221 20 0 BEADRP CCCC[C@@H](CC)C[N@@H+]1CCO[C@@H](CC[NH3+])C1 ZINC001204748756 967148609 /nfs/dbraw/zinc/14/86/09/967148609.db2.gz SYTXQQLRBHCOHR-KGLIPLIRSA-N 2 0 242.407 2.252 20 0 BEADRP [NH3+]CC1CC[NH+](Cc2ccc3[nH]ccc3c2)CC1 ZINC001205033546 967220293 /nfs/dbraw/zinc/22/02/93/967220293.db2.gz JEHRBZOKLIWVQU-UHFFFAOYSA-N 2 0 243.354 2.339 20 0 BEADRP COc1ccc(CC[N@@H+]2[C@@H](C)CC[C@H]2CN)cc1 ZINC001205058926 967312427 /nfs/dbraw/zinc/31/24/27/967312427.db2.gz YODXDDFFUWNRKC-JSGCOSHPSA-N 2 0 248.370 2.049 20 0 BEADRP CNc1ccc(CN2[C@@H](C)CC[C@H]2C[NH3+])cc1 ZINC001205087734 967330065 /nfs/dbraw/zinc/33/00/65/967330065.db2.gz INWKMLHYMWZTGU-FZMZJTMJSA-N 2 0 233.359 2.040 20 0 BEADRP COc1ccsc1C[N@@H+]1CCC[C@H]([NH3+])CC1 ZINC001205110267 967358528 /nfs/dbraw/zinc/35/85/28/967358528.db2.gz QLUPPDGYUOBMOS-JTQLQIEISA-N 2 0 240.372 2.070 20 0 BEADRP COCc1ccc(C[N@@H+]2CCC[C@@H]([NH3+])CC2)cc1 ZINC001205116624 967363774 /nfs/dbraw/zinc/36/37/74/967363774.db2.gz FBHACXZNJLKTLY-OAHLLOKOSA-N 2 0 248.370 2.146 20 0 BEADRP Cc1cc(C[N@@H+]2CCC[C@@](C)([NH3+])CC2)ccn1 ZINC001205263640 967456630 /nfs/dbraw/zinc/45/66/30/967456630.db2.gz BCQBDNLEDOUEIT-CQSZACIVSA-N 2 0 233.359 2.093 20 0 BEADRP C[NH2+]Cc1cccc(CCC[NH+](C)C)c1F ZINC001250164419 967460093 /nfs/dbraw/zinc/46/00/93/967460093.db2.gz OBYVQDGGWAYZKQ-UHFFFAOYSA-N 2 0 224.323 2.039 20 0 BEADRP Cc1cc(C[N@H+]2C[C@H](C)[C@H](C[NH3+])C2)cs1 ZINC000708864162 967681449 /nfs/dbraw/zinc/68/14/49/967681449.db2.gz XGBZLTOOERYNPF-JOYOIKCWSA-N 2 0 224.373 2.083 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2CCC=C(C)C2)CC1 ZINC001205548522 967686559 /nfs/dbraw/zinc/68/65/59/967686559.db2.gz WWYGXZKNYGUNQF-UHFFFAOYSA-N 2 0 222.376 2.370 20 0 BEADRP Cc1cnccc1C[N@H+]1CC[C@H](C)[C@@H](C[NH3+])CC1 ZINC001205602628 967719187 /nfs/dbraw/zinc/71/91/87/967719187.db2.gz KSPGCQQEZVNOMB-GXTWGEPZSA-N 2 0 247.386 2.197 20 0 BEADRP CS[C@H](C)CC[N@@H+]1CC[C@H](C)[C@@H](C[NH3+])CC1 ZINC001205602589 967720819 /nfs/dbraw/zinc/72/08/19/967720819.db2.gz KBRQRGRPMILCNH-YNEHKIRRSA-N 2 0 244.448 2.435 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@@H](C[NH3+])[C@@H](C)CC2)nc1 ZINC001205626749 967735081 /nfs/dbraw/zinc/73/50/81/967735081.db2.gz IVWSSYLWYITVOC-KBPBESRZSA-N 2 0 247.386 2.197 20 0 BEADRP CCN(CCC[NH+](C)C)Cc1ncccc1C ZINC001205813668 967833974 /nfs/dbraw/zinc/83/39/74/967833974.db2.gz DHEPFAWOLGWOHR-UHFFFAOYSA-N 2 0 235.375 2.164 20 0 BEADRP CS[C@H](C)CC[N@@H+]1CCC[C@H](C[NH3+])[C@H](C)C1 ZINC001205981709 967900763 /nfs/dbraw/zinc/90/07/63/967900763.db2.gz FWRPTWBQSGLAHA-JHJVBQTASA-N 2 0 244.448 2.435 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H](C)c1cccc(F)c1 ZINC001118059711 967920147 /nfs/dbraw/zinc/92/01/47/967920147.db2.gz SLJLQRBRUADJNL-GHMZBOCLSA-N 2 0 224.323 2.474 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@@H](C)c1cccc(F)c1 ZINC001118059716 967920929 /nfs/dbraw/zinc/92/09/29/967920929.db2.gz SLJLQRBRUADJNL-QWRGUYRKSA-N 2 0 224.323 2.474 20 0 BEADRP CCCCC[N@@H+]1CCC[C@@H](C[NH3+])[C@H](C)C1 ZINC001205984687 967934901 /nfs/dbraw/zinc/93/49/01/967934901.db2.gz UEBGOAMDNHBMQM-OLZOCXBDSA-N 2 0 212.381 2.483 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@H](C[NH3+])[C@@H](C)C2)[nH]1 ZINC001205995476 967951797 /nfs/dbraw/zinc/95/17/97/967951797.db2.gz OIPQBBFNQYVEDB-WCQYABFASA-N 2 0 235.375 2.130 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@@H](C[NH3+])[C@H](C)C2)nc1 ZINC001206003767 967962406 /nfs/dbraw/zinc/96/24/06/967962406.db2.gz MKJKRTVFOPQJDG-KGLIPLIRSA-N 2 0 247.386 2.197 20 0 BEADRP C[C@@H]1C[N@H+](Cc2cccc(N)c2)CCC[C@@H]1C[NH3+] ZINC001206013478 967970123 /nfs/dbraw/zinc/97/01/23/967970123.db2.gz ROHKQXXPBVZDSF-TZMCWYRMSA-N 2 0 247.386 2.076 20 0 BEADRP C[C@@]1(C[N@@H+]2CCCC3(CC3)C2)CCC[NH2+]C1 ZINC000695132509 967972217 /nfs/dbraw/zinc/97/22/17/967972217.db2.gz UGCLXRHFHQAYQX-CYBMUJFWSA-N 2 0 222.376 2.252 20 0 BEADRP CC[NH+]1CCC(C[NH+]2CC(C3CC3)C2)CC1 ZINC001206021897 967982045 /nfs/dbraw/zinc/98/20/45/967982045.db2.gz CLVMNHHURZNUGS-UHFFFAOYSA-N 2 0 222.376 2.060 20 0 BEADRP C([NH2+]C1CCCCC1)[C@]12CCC[C@H]1[NH2+]CC2 ZINC000711232924 968004314 /nfs/dbraw/zinc/00/43/14/968004314.db2.gz FUBCCOJJAWYZJC-ZIAGYGMSSA-N 2 0 222.376 2.441 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@H]1CCc2cc(F)ccc21 ZINC001118122104 968010325 /nfs/dbraw/zinc/01/03/25/968010325.db2.gz PEVZFXNYJIFNEI-HZMBPMFUSA-N 2 0 236.334 2.401 20 0 BEADRP Cc1ccc(NC(=[NH2+])NCCCC[NH+](C)C)cc1 ZINC001118410845 968148607 /nfs/dbraw/zinc/14/86/07/968148607.db2.gz IGNGRQFOGWYCQV-UHFFFAOYSA-N 2 0 248.374 2.273 20 0 BEADRP CC/C=C\CC[N@@H+]1CCCC[C@@](F)(CN)C1 ZINC001206335325 968238698 /nfs/dbraw/zinc/23/86/98/968238698.db2.gz FAZPLCCATPNGBI-DHCBQETCSA-N 2 0 228.355 2.496 20 0 BEADRP Nc1cc(Nc2ccc3[nH+]ccn3c2)cc[nH+]1 ZINC001206528304 968353450 /nfs/dbraw/zinc/35/34/50/968353450.db2.gz JUHJDSOKXIWRIP-UHFFFAOYSA-N 2 0 225.255 2.055 20 0 BEADRP CC[C@@H](C)C[N@@H+]1CCCC[C@](C)(C[NH3+])C1 ZINC001206541871 968366071 /nfs/dbraw/zinc/36/60/71/968366071.db2.gz MHFHLFXPOHUYID-CHWSQXEVSA-N 2 0 212.381 2.483 20 0 BEADRP CC(C)(C)C[N@@H+]1CCCC[C@](C)(C[NH3+])C1 ZINC001206541430 968369156 /nfs/dbraw/zinc/36/91/56/968369156.db2.gz HKXUHYUNBFACCT-CYBMUJFWSA-N 2 0 212.381 2.483 20 0 BEADRP C[C@@]1(C[NH3+])CCCC[N@H+](CCC2CC2)C1 ZINC001206542035 968369317 /nfs/dbraw/zinc/36/93/17/968369317.db2.gz PMUIOVBXZHUYFM-ZDUSSCGKSA-N 2 0 210.365 2.237 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCCC[C@@](C)(C[NH3+])C1 ZINC001206541874 968369544 /nfs/dbraw/zinc/36/95/44/968369544.db2.gz MHFHLFXPOHUYID-STQMWFEESA-N 2 0 212.381 2.483 20 0 BEADRP C[C@@]1(C[NH3+])CCCC[N@H+](C[C@H]2CCCCO2)C1 ZINC001206542013 968369788 /nfs/dbraw/zinc/36/97/88/968369788.db2.gz PEVATNWFQNBGIR-KGLIPLIRSA-N 2 0 240.391 2.006 20 0 BEADRP Cc1ncccc1C[N@@H+]1CCCC[C@@](C)(C[NH3+])C1 ZINC001206548965 968373135 /nfs/dbraw/zinc/37/31/35/968373135.db2.gz LERHUQOSYBPJSN-HNNXBMFYSA-N 2 0 247.386 2.341 20 0 BEADRP C[C@]1(C[NH3+])CCCC[N@H+](Cc2ccccc2N)C1 ZINC001206575772 968394642 /nfs/dbraw/zinc/39/46/42/968394642.db2.gz YFNHFENTEPPMKS-OAHLLOKOSA-N 2 0 247.386 2.220 20 0 BEADRP CNc1ccc(C[N@@H+]2CCCC[C@@H](C[NH3+])C2)cc1 ZINC001206640949 968425998 /nfs/dbraw/zinc/42/59/98/968425998.db2.gz PXKMKYIOTYOEHJ-AWEZNQCLSA-N 2 0 247.386 2.289 20 0 BEADRP C[NH+](C)CC(C)(C)C[N@@H+]1CCCC1(C)C ZINC001207274755 968693820 /nfs/dbraw/zinc/69/38/20/968693820.db2.gz GCOKQOSKHABHEL-UHFFFAOYSA-N 2 0 212.381 2.449 20 0 BEADRP C[NH+](C)CC(C)(C)C[NH+]1C[C@H]2CCC[C@@H]2C1 ZINC001207275244 968707965 /nfs/dbraw/zinc/70/79/65/968707965.db2.gz LELPIYTYORAEMQ-CHWSQXEVSA-N 2 0 224.392 2.306 20 0 BEADRP CC[N@@H+](Cc1cccnc1)CC1CC[NH+](C)CC1 ZINC001207398343 968751214 /nfs/dbraw/zinc/75/12/14/968751214.db2.gz JHWPOMYDNYKRHG-UHFFFAOYSA-N 2 0 247.386 2.245 20 0 BEADRP [NH3+]C1(c2ccc(C=C3CC[NH2+]CC3)cc2)CC1 ZINC001240878526 968790885 /nfs/dbraw/zinc/79/08/85/968790885.db2.gz QGMRKHKAYDAQKN-UHFFFAOYSA-N 2 0 228.339 2.401 20 0 BEADRP C[NH+]1CCC(CC[N@@H+]2C[C@@H]3C[C@@H]3[C@@H](F)C2)CC1 ZINC001207481505 968793087 /nfs/dbraw/zinc/79/30/87/968793087.db2.gz JMFFQUXYMSTKJH-IHRRRGAJSA-N 2 0 240.366 2.008 20 0 BEADRP CC[N@H+](CCC1CC[NH+](C)CC1)C1CC1 ZINC001207479418 968794451 /nfs/dbraw/zinc/79/44/51/968794451.db2.gz IOLPXRXQYQLWOA-UHFFFAOYSA-N 2 0 210.365 2.203 20 0 BEADRP C[NH+]1CCC(CC[NH+]2CC(C)(C)C2)CC1 ZINC001207480202 968797966 /nfs/dbraw/zinc/79/79/66/968797966.db2.gz WVGVRBKJVLVLPY-UHFFFAOYSA-N 2 0 210.365 2.060 20 0 BEADRP C[NH+]1CCC(CC[N@@H+]2CCC[C@@H]2CF)CC1 ZINC001207488509 968803011 /nfs/dbraw/zinc/80/30/11/968803011.db2.gz LUKPXODKGSLQFW-CYBMUJFWSA-N 2 0 228.355 2.152 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)C[C@H]1C[C@H]2C=C[C@@H]1C2 ZINC001207632930 968853353 /nfs/dbraw/zinc/85/33/53/968853353.db2.gz WAAJVZFKAQSXOP-RRFJBIMHSA-N 2 0 236.403 2.472 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+]C[C@H]1C[NH+]2CCC1CC2 ZINC001207723689 968869159 /nfs/dbraw/zinc/86/91/59/968869159.db2.gz MUPSPEHMLSTJOB-OBJOEFQTSA-N 2 0 224.392 2.352 20 0 BEADRP C[NH+]1CCC(C)(C[N@@H+]2CC[C@](C)(CF)C2)CC1 ZINC001208107908 969001851 /nfs/dbraw/zinc/00/18/51/969001851.db2.gz MEVLHURLISYTHN-CQSZACIVSA-N 2 0 242.382 2.400 20 0 BEADRP C[C@@H]1CCC[N@H+](CC2(C)CC[NH+](C)CC2)C1 ZINC001208104261 969002459 /nfs/dbraw/zinc/00/24/59/969002459.db2.gz KJLZWBRAGXWAAR-CYBMUJFWSA-N 2 0 224.392 2.450 20 0 BEADRP C[NH+]1CCC(C)(C[N@@H+]2CCn3cccc3C2)CC1 ZINC001208107176 969002651 /nfs/dbraw/zinc/00/26/51/969002651.db2.gz PPQPCYOOFIZWMZ-UHFFFAOYSA-N 2 0 247.386 2.036 20 0 BEADRP CC(C)(C)[NH2+]C[C@@H](O)C[NH2+]C1(C)CCCCC1 ZINC001253384081 969146826 /nfs/dbraw/zinc/14/68/26/969146826.db2.gz OCYKDWZSVZVQRA-GFCCVEGCSA-N 2 0 242.407 2.048 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2CCC[C@H](F)C2)CC1 ZINC001208597432 969150095 /nfs/dbraw/zinc/15/00/95/969150095.db2.gz HKBLOCYQFLJSHJ-ZDUSSCGKSA-N 2 0 228.355 2.152 20 0 BEADRP CC[NH+]1CCC(C[NH+]2C[C@@H]3CCC[C@H]3C2)CC1 ZINC001208594872 969151272 /nfs/dbraw/zinc/15/12/72/969151272.db2.gz OWUCCDBHNKTVKM-GJZGRUSLSA-N 2 0 236.403 2.450 20 0 BEADRP C[N@H+](C[C@@H]1CC1(C)C)C[C@@H]1CCC[NH+](C)C1 ZINC001208607574 969165227 /nfs/dbraw/zinc/16/52/27/969165227.db2.gz DDHQDWOCYUXIQC-OLZOCXBDSA-N 2 0 224.392 2.306 20 0 BEADRP Cc1c[nH+]ccc1N1CC[NH+](CCC2CC2)CC1 ZINC001208686546 969195260 /nfs/dbraw/zinc/19/52/60/969195260.db2.gz MYKAGQGBBPUSOG-UHFFFAOYSA-N 2 0 245.370 2.312 20 0 BEADRP C[NH+](C)Cc1ccccc1NC1=CC[N@H+](C)CC1 ZINC001208910334 969296257 /nfs/dbraw/zinc/29/62/57/969296257.db2.gz NTUHIUYNDVUDFP-UHFFFAOYSA-N 2 0 245.370 2.380 20 0 BEADRP C[C@H]1C[N@H+](Cc2ccoc2)CCC[C@@H]1C[NH3+] ZINC001205996333 969304437 /nfs/dbraw/zinc/30/44/37/969304437.db2.gz WGQIDGOMUCXZBF-WCQYABFASA-N 2 0 222.332 2.086 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]C1CCC(F)CC1)C2 ZINC001169079243 969400534 /nfs/dbraw/zinc/40/05/34/969400534.db2.gz KIRXHLZLGCJSQN-MOIJGLSHSA-N 2 0 240.366 2.482 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+][C@H]1CC[C@@H](F)C1)C2 ZINC001169080306 969401891 /nfs/dbraw/zinc/40/18/91/969401891.db2.gz MKXOZRKMGONXRD-MLGHIDQZSA-N 2 0 226.339 2.092 20 0 BEADRP CC(C)[C@@H](C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169080944 969402494 /nfs/dbraw/zinc/40/24/94/969402494.db2.gz NYAKOTKWVZUILG-FVCCEPFGSA-N 2 0 210.365 2.246 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+][C@@H]1CCC[C@@H](F)C1)C2 ZINC001169081361 969402952 /nfs/dbraw/zinc/40/29/52/969402952.db2.gz RYWKNOQICIUYQJ-XGFWRYKXSA-N 2 0 240.366 2.482 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+][C@H]1CCC(F)(F)C1)C2 ZINC001169081775 969403435 /nfs/dbraw/zinc/40/34/35/969403435.db2.gz WHIMNTJBEJATAL-FIQHERPVSA-N 2 0 244.329 2.389 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]Cc1cccs1)C2 ZINC001169080942 969404414 /nfs/dbraw/zinc/40/44/14/969404414.db2.gz NXHYULAMQYJKFI-ZSBIGDGJSA-N 2 0 236.384 2.463 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+][C@@H]1CC13CCC3)C2 ZINC001169116578 969411448 /nfs/dbraw/zinc/41/14/48/969411448.db2.gz RDVRBPYOQUAPQL-YVECIDJPSA-N 2 0 220.360 2.144 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CCC[C@@H](F)CC1)C2 ZINC001169124921 969426834 /nfs/dbraw/zinc/42/68/34/969426834.db2.gz HDTROSXKIQMMOY-MQYQWHSLSA-N 2 0 240.366 2.436 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CC3(C1)CCCC3)C2 ZINC001169129859 969436851 /nfs/dbraw/zinc/43/68/51/969436851.db2.gz KYWOUGLHXMCYIC-BTTYYORXSA-N 2 0 234.387 2.488 20 0 BEADRP CC[NH+]1CCC(Nc2cccc(C[NH3+])c2)CC1 ZINC001169225319 969494467 /nfs/dbraw/zinc/49/44/67/969494467.db2.gz SFGISVJRZOOSTH-UHFFFAOYSA-N 2 0 233.359 2.042 20 0 BEADRP CC[NH+]1CCC(NC(=[NH2+])c2cccc(C)c2)CC1 ZINC001169230062 969502394 /nfs/dbraw/zinc/50/23/94/969502394.db2.gz MSSWHWHAYVPCDU-UHFFFAOYSA-N 2 0 245.370 2.394 20 0 BEADRP C[C@@H]([NH3+])c1ccn(-c2ccccc2C(C)(C)[NH3+])n1 ZINC001169234019 969513639 /nfs/dbraw/zinc/51/36/39/969513639.db2.gz DHBMAJVFYRCOQE-SNVBAGLBSA-N 2 0 244.342 2.086 20 0 BEADRP Cc1ccc(C[NH+]2CCC(C[NH+](C)C)CC2)[nH]1 ZINC001209572246 969553513 /nfs/dbraw/zinc/55/35/13/969553513.db2.gz DYIKRKCQMWAFJC-UHFFFAOYSA-N 2 0 235.375 2.097 20 0 BEADRP [NH3+]C1CC([NH2+]C2CCc3ccccc3CC2)C1 ZINC001254454618 969645157 /nfs/dbraw/zinc/64/51/57/969645157.db2.gz DQGOCNYQJAXOJO-UHFFFAOYSA-N 2 0 230.355 2.013 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH2+][C@@H]2CCC[C@@H](F)C2)CC1 ZINC001254497177 969662279 /nfs/dbraw/zinc/66/22/79/969662279.db2.gz HPJFAEOHMLAYAD-FRRDWIJNSA-N 2 0 228.355 2.341 20 0 BEADRP CC[C@@H]1CCC[N@@H+]1[C@@H]1CCC[NH+](C)CC1 ZINC001254522073 969705930 /nfs/dbraw/zinc/70/59/30/969705930.db2.gz BMSUZWITJLCNIM-CHWSQXEVSA-N 2 0 210.365 2.345 20 0 BEADRP C[NH2+]Cc1cccc(N[C@H]2CCC[N@H+](C)CC2)c1 ZINC001254526997 969719439 /nfs/dbraw/zinc/71/94/39/969719439.db2.gz VJLRYGQSVZKQPM-AWEZNQCLSA-N 2 0 247.386 2.302 20 0 BEADRP C[NH+](C)CCC(C)(C)Nc1ccccn1 ZINC001169711625 969828553 /nfs/dbraw/zinc/82/85/53/969828553.db2.gz NUSNYSHEDGALKF-UHFFFAOYSA-N 2 0 207.321 2.224 20 0 BEADRP CC(C)[N@H+](CCC[NH3+])C1Cc2ccccc2C1 ZINC001255012058 969844725 /nfs/dbraw/zinc/84/47/25/969844725.db2.gz KEEFHZGGYSBTCY-UHFFFAOYSA-N 2 0 232.371 2.213 20 0 BEADRP C[NH+](C)Cc1cccc(C[NH2+]C2CCOCC2)c1 ZINC001255030885 969855207 /nfs/dbraw/zinc/85/52/07/969855207.db2.gz WBHYRHFXGPNGHB-UHFFFAOYSA-N 2 0 248.370 2.017 20 0 BEADRP Cc1c[nH+]c(NCC[C@@H]2CCC[N@@H+](C)C2)cc1N ZINC001156388525 969873599 /nfs/dbraw/zinc/87/35/99/969873599.db2.gz LINICUZGBRRDAN-LBPRGKRZSA-N 2 0 248.374 2.116 20 0 BEADRP Cc1cccc(C)c1C[N@@H+]1CC[NH2+][C@@H](C)CC1 ZINC001210476638 969901555 /nfs/dbraw/zinc/90/15/55/969901555.db2.gz WLVHUKFEHXARLY-AWEZNQCLSA-N 2 0 232.371 2.487 20 0 BEADRP C[C@H](CC[NH+]1CC(C[NH3+])C1)CC(C)(C)C ZINC001210545117 969933322 /nfs/dbraw/zinc/93/33/22/969933322.db2.gz NYZJFRKNWBUDQB-LLVKDONJSA-N 2 0 212.381 2.339 20 0 BEADRP CCC[N@H+](CCC[NH+](C)C)[C@H]1CCSC1 ZINC001255295479 970059464 /nfs/dbraw/zinc/05/94/64/970059464.db2.gz YEGLHXLRWJTDJO-LBPRGKRZSA-N 2 0 230.421 2.156 20 0 BEADRP CC1(C)CCC(NC(=[NH2+])SCC[NH3+])CC1 ZINC001255297646 970063326 /nfs/dbraw/zinc/06/33/26/970063326.db2.gz FDBGRSFLLPPBQQ-UHFFFAOYSA-N 2 0 229.393 2.171 20 0 BEADRP C[N@@H+]1CC[C@H](n2ccc3cc(CC[NH3+])ccc32)C1 ZINC001255423235 970145580 /nfs/dbraw/zinc/14/55/80/970145580.db2.gz JVZIUIQQKQCMMK-AWEZNQCLSA-N 2 0 243.354 2.019 20 0 BEADRP C[N@@H+]1CCC[C@@H](n2ccc3cccc(C[NH3+])c32)C1 ZINC001255474681 970207624 /nfs/dbraw/zinc/20/76/24/970207624.db2.gz HYMVWTKXLSWBOW-CQSZACIVSA-N 2 0 243.354 2.367 20 0 BEADRP COC[C@H](C)[NH2+][C@@H]1CC(C)(C)C[C@@](C)(C[NH3+])C1 ZINC001255559970 970338154 /nfs/dbraw/zinc/33/81/54/970338154.db2.gz LAONCNLQOUOAPX-SCRDCRAPSA-N 2 0 242.407 2.155 20 0 BEADRP COCCC1([NH3+])CC[NH+]([C@@H]2CC[C@H](C)C2)CC1 ZINC001170124277 970367321 /nfs/dbraw/zinc/36/73/21/970367321.db2.gz XARULVVURSTMBA-QWHCGFSZSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2C[C@H]3CC[NH+](C)C[C@H]3C2)C1 ZINC001170134626 970404755 /nfs/dbraw/zinc/40/47/55/970404755.db2.gz CUMNUOVRIVWWJU-MQYQWHSLSA-N 2 0 222.376 2.059 20 0 BEADRP Cc1ccc(C[C@H](C)[NH2+]C[C@H]2CC[N@H+](C)C2)cc1 ZINC001255773956 970477588 /nfs/dbraw/zinc/47/75/88/970477588.db2.gz SHSVAGDAKJAAGA-GOEBONIOSA-N 2 0 246.398 2.467 20 0 BEADRP C(C1CC[NH2+]CC1)[NH+]1C[C@@H]2CCCC[C@H]2C1 ZINC000178973709 970487325 /nfs/dbraw/zinc/48/73/25/970487325.db2.gz FHMKDQXBRHBIIJ-KBPBESRZSA-N 2 0 222.376 2.108 20 0 BEADRP CCC[NH+]1C[C@@H]2C[NH+]([C@@H]3CC[C@H](C)C3)C[C@H]2C1 ZINC001170159242 970488952 /nfs/dbraw/zinc/48/89/52/970488952.db2.gz RTQGBAPBCMRDDT-GBJTYRQASA-N 2 0 236.403 2.449 20 0 BEADRP CCC[N@H+]1C[C@@H]2C[NH+]([C@@H]3CC[C@H](C)C3)C[C@@H]2C1 ZINC001170159241 970490597 /nfs/dbraw/zinc/49/05/97/970490597.db2.gz RTQGBAPBCMRDDT-BYNSBNAKSA-N 2 0 236.403 2.449 20 0 BEADRP C[NH2+]C1CC[NH+](C[C@@H]2CC3CCC2CC3)CC1 ZINC000400124196 970553179 /nfs/dbraw/zinc/55/31/79/970553179.db2.gz RAMXOWAWFSGAEZ-RUXDESIVSA-N 2 0 236.403 2.497 20 0 BEADRP CCC[N@H+](CCC[NH3+])[C@H]1CCO[C@@H](CC)C1 ZINC001170172494 970564657 /nfs/dbraw/zinc/56/46/57/970564657.db2.gz ZQBJNKWRRPRBPD-STQMWFEESA-N 2 0 228.380 2.005 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]CCOC(C)C ZINC001255941320 970571725 /nfs/dbraw/zinc/57/17/25/970571725.db2.gz OGUBPVIUIJFFPA-ZDUSSCGKSA-N 2 0 230.396 2.121 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]C[C@@H]1C[C@H]1C ZINC001255941227 970571769 /nfs/dbraw/zinc/57/17/69/970571769.db2.gz LTZJUFCOZNCNAV-UPJWGTAASA-N 2 0 212.381 2.352 20 0 BEADRP CC(C)C[C@@H](C)[NH2+][C@@H](C)C1CC[NH2+]CC1 ZINC000400336377 970577134 /nfs/dbraw/zinc/57/71/34/970577134.db2.gz GAKRLZLJPDQQQJ-NEPJUHHUSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@H]([NH2+]C(C1CC1)C1CC1)C1CC[NH2+]CC1 ZINC000400326431 970578585 /nfs/dbraw/zinc/57/85/85/970578585.db2.gz BMQRXAWDBMGHNP-JTQLQIEISA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)c1ccco1)C1CC[NH2+]CC1 ZINC000400325915 970579421 /nfs/dbraw/zinc/57/94/21/970579421.db2.gz AHZJFLDICDRAML-MNOVXSKESA-N 2 0 222.332 2.318 20 0 BEADRP Cc1ccccc1C[NH2+][C@@H](C)C1CC[NH2+]CC1 ZINC000400347895 970580659 /nfs/dbraw/zinc/58/06/59/970580659.db2.gz LGYXHQDXXZUWPB-ZDUSSCGKSA-N 2 0 232.371 2.473 20 0 BEADRP C[C@H]([NH2+]Cc1ccsc1)C1CC[NH2+]CC1 ZINC000400359659 970580926 /nfs/dbraw/zinc/58/09/26/970580926.db2.gz PRMZBCVLDLDZFZ-JTQLQIEISA-N 2 0 224.373 2.226 20 0 BEADRP C[C@@H]([NH2+]C1Cc2ccccc2C1)C1CC[NH2+]CC1 ZINC000400370787 970583541 /nfs/dbraw/zinc/58/35/41/970583541.db2.gz AIPCZCDBJPWMJV-GFCCVEGCSA-N 2 0 244.382 2.132 20 0 BEADRP C[C@@H]([NH2+][C@H](C)C1CC[NH2+]CC1)c1cccc(O)c1 ZINC000400437895 970590213 /nfs/dbraw/zinc/59/02/13/970590213.db2.gz NFAQIKMBFCXYSP-VXGBXAGGSA-N 2 0 248.370 2.431 20 0 BEADRP C[C@H](Cc1ccco1)[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000400996877 970652890 /nfs/dbraw/zinc/65/28/90/970652890.db2.gz CFXNCAZMYSJWHT-YIYPIFLZSA-N 2 0 248.370 2.188 20 0 BEADRP C1CCC([NH2+][C@H]2CC[NH2+]C23CCCC3)C1 ZINC000401360804 970681893 /nfs/dbraw/zinc/68/18/93/970681893.db2.gz CLRPHGTVBTTYKX-LBPRGKRZSA-N 2 0 208.349 2.193 20 0 BEADRP C[C@H]1C[N@@H+](C2CCN(C)CC2)CCC1(F)F ZINC001256202727 970703487 /nfs/dbraw/zinc/70/34/87/970703487.db2.gz LHRVUXGEPNYNKA-JTQLQIEISA-N 2 0 232.318 2.058 20 0 BEADRP CN1CCC([N@@H+]2CCC[C@H]2c2ccncc2)CC1 ZINC001256207219 970712017 /nfs/dbraw/zinc/71/20/17/970712017.db2.gz COHVNYLAQHRVNG-HNNXBMFYSA-N 2 0 245.370 2.313 20 0 BEADRP [NH3+][C@H]1CCC[N@@H+]([C@H]2Cc3cccc(F)c3C2)CC1 ZINC001246543003 972586195 /nfs/dbraw/zinc/58/61/95/972586195.db2.gz QWZBYFANCUUZIX-STQMWFEESA-N 2 0 248.345 2.106 20 0 BEADRP COC1CCC([N@@H+]2CCC[C@@](C)([NH3+])CC2)CC1 ZINC001246553390 972750711 /nfs/dbraw/zinc/75/07/11/972750711.db2.gz RKBGGVAEFGIRAT-JXQTWKCFSA-N 2 0 240.391 2.147 20 0 BEADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]C1(C)CC1 ZINC001327837743 972754118 /nfs/dbraw/zinc/75/41/18/972754118.db2.gz BKAPGOSCLNPDDR-NEPJUHHUSA-N 2 0 210.365 2.439 20 0 BEADRP C[C@@H]1CC[N@@H+](C2CCSCC2)CC[C@@H]1C[NH3+] ZINC001246557252 972773550 /nfs/dbraw/zinc/77/35/50/972773550.db2.gz KFXFTQMWIMDWRS-VXGBXAGGSA-N 2 0 242.432 2.189 20 0 BEADRP CCC[C@H](C)[N@@H+]1CCC[C@H](C[NH3+])[C@@H](C)C1 ZINC001246562890 972788333 /nfs/dbraw/zinc/78/83/33/972788333.db2.gz BQVAXCISEYNAQT-RWMBFGLXSA-N 2 0 212.381 2.482 20 0 BEADRP C[C@]1(F)CCC[N@@H+](C2C[C@H]3CC[C@@H](C2)[NH2+]3)CC1 ZINC001246566875 972817252 /nfs/dbraw/zinc/81/72/52/972817252.db2.gz JPPVJRGKQQRRDS-PIGZVRMJSA-N 2 0 240.366 2.484 20 0 BEADRP CC(C)([NH3+])CNc1ccc([C@@H]2CCC[NH2+]2)cc1 ZINC001171192944 972842085 /nfs/dbraw/zinc/84/20/85/972842085.db2.gz OKKOBMGEKWVACM-ZDUSSCGKSA-N 2 0 233.359 2.260 20 0 BEADRP C[C@@]1(C[NH3+])CCC[N@@H+]([C@H]2CCCOCC2)CC1 ZINC001246574618 972871464 /nfs/dbraw/zinc/87/14/64/972871464.db2.gz IIBSCVFZIZNWKB-UONOGXRCSA-N 2 0 240.391 2.006 20 0 BEADRP C1[C@@H]2C[C@@H]([N@@H+]3CCC[C@@]34CCC[NH2+]C4)C[C@H]12 ZINC001246605945 973028075 /nfs/dbraw/zinc/02/80/75/973028075.db2.gz CZAMZKQOJJLUEE-XJFOESAGSA-N 2 0 220.360 2.003 20 0 BEADRP COCC[C@@H]1CCCC[N@@H+]1[C@H]1CC[NH2+][C@@H](C)C1 ZINC001246781007 973090224 /nfs/dbraw/zinc/09/02/24/973090224.db2.gz DBLNNVGKJGDULP-IHRRRGAJSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@H]1C[C@H]([N@H+]2C[C@H]3CC[C@@H](C2)[C@@H]3[NH3+])C[C@@H](C)C1 ZINC001246839066 973140973 /nfs/dbraw/zinc/14/09/73/973140973.db2.gz APYZHVUHTQJOEZ-LEYGVYNDSA-N 2 0 236.403 2.480 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H]2CC[C@@H]3[C@H](C2)C3(F)F)C1 ZINC001328616292 973196161 /nfs/dbraw/zinc/19/61/61/973196161.db2.gz USJAZXGRVROKJT-ROHXPCBUSA-N 2 0 244.329 2.280 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H](C)c1ccc2c(c1)CCO2 ZINC001329022300 973432182 /nfs/dbraw/zinc/43/21/82/973432182.db2.gz CZSGLWPFAORSAK-NWDGAFQWSA-N 2 0 248.370 2.128 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H](C)c1ccc2c(c1)CCO2 ZINC001329022304 973433538 /nfs/dbraw/zinc/43/35/38/973433538.db2.gz CZSGLWPFAORSAK-VXGBXAGGSA-N 2 0 248.370 2.128 20 0 BEADRP CCCC[C@@H](C)N(CCOC)[C@@H]1CCC[NH2+]C1 ZINC001246927753 973536853 /nfs/dbraw/zinc/53/68/53/973536853.db2.gz IAJQVYWOROSQFF-ZIAGYGMSSA-N 2 0 242.407 2.266 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+][C@@H]1CCc2c(F)cccc2C1 ZINC001171418453 974032199 /nfs/dbraw/zinc/03/21/99/974032199.db2.gz KOESYJGXJQYCFT-BYCMXARLSA-N 2 0 248.345 2.152 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+][C@H]2Cc3cccc(F)c3C2)C1 ZINC001171773395 974156714 /nfs/dbraw/zinc/15/67/14/974156714.db2.gz KMKDATUIJBEPIS-XQQFMLRXSA-N 2 0 248.345 2.152 20 0 BEADRP N[C@@H]1CC[N@H+](CCC2CCCC2)CC[C@H]1F ZINC001206156906 974331541 /nfs/dbraw/zinc/33/15/41/974331541.db2.gz UFCPOKZPPHJIOO-CHWSQXEVSA-N 2 0 228.355 2.328 20 0 BEADRP C[C@@H]([NH3+])c1nccn1[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172098429 974335746 /nfs/dbraw/zinc/33/57/46/974335746.db2.gz DWPHZWXIDWHONC-NDBYEHHHSA-N 2 0 248.374 2.091 20 0 BEADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1ccoc1)C2 ZINC001172104774 974364560 /nfs/dbraw/zinc/36/45/60/974364560.db2.gz GAYPWFWSNCXZNH-ZSOGYDGISA-N 2 0 234.343 2.385 20 0 BEADRP C[C@@H]1C[N@@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3C)C[C@@H]1F ZINC001172117370 974378592 /nfs/dbraw/zinc/37/85/92/974378592.db2.gz GMUVBRSUCUXINJ-DGTMBMJNSA-N 2 0 240.366 2.292 20 0 BEADRP CC[C@H](COC)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)N2C ZINC001172115204 974381350 /nfs/dbraw/zinc/38/13/50/974381350.db2.gz RZPJPGUREFEPIF-YIYPIFLZSA-N 2 0 240.391 2.016 20 0 BEADRP C[NH+](C)Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC001225330757 974406897 /nfs/dbraw/zinc/40/68/97/974406897.db2.gz PYLCBOCFPCENSH-UHFFFAOYSA-N 2 0 248.370 2.221 20 0 BEADRP C[C@H](C[NH+](C)C)Oc1ccc(C[NH+](C)C)cc1 ZINC001225335331 974415071 /nfs/dbraw/zinc/41/50/71/974415071.db2.gz ZSZLSTAACUCPDD-GFCCVEGCSA-N 2 0 236.359 2.077 20 0 BEADRP CCCC[N@H+](C)CCC[NH2+][C@H]1COC(C)(C)C1 ZINC001172269557 974486970 /nfs/dbraw/zinc/48/69/70/974486970.db2.gz FWVWHTDCBWWGOJ-CYBMUJFWSA-N 2 0 242.407 2.266 20 0 BEADRP Cc1csc(C[N@@H+]2CC[C@@H]([NH3+])[C@@H](F)CC2)c1 ZINC001206163805 974512908 /nfs/dbraw/zinc/51/29/08/974512908.db2.gz GCTDDVXZXGKPLO-NWDGAFQWSA-N 2 0 242.363 2.318 20 0 BEADRP CC[C@H](C)OCC[C@H](C)[NH2+]C[C@@H]1CC[N@H+](C)C1 ZINC001172315675 974520929 /nfs/dbraw/zinc/52/09/29/974520929.db2.gz CLAYFPBLKAVOLF-IHRRRGAJSA-N 2 0 242.407 2.121 20 0 BEADRP CC[C@@H](C)OCC[C@@H](C)[NH2+]CCC[NH+](C)C ZINC001172315460 974523058 /nfs/dbraw/zinc/52/30/58/974523058.db2.gz KFYWCBYUMNUOCR-CHWSQXEVSA-N 2 0 230.396 2.121 20 0 BEADRP C[C@@H]1CC[C@H]([N@H+]2C[C@H]3C[NH+](C)C[C@H]3C2)C[C@@H]1C ZINC001172380127 974586868 /nfs/dbraw/zinc/58/68/68/974586868.db2.gz RHQBLNLGDJNJDQ-SEBNEYGDSA-N 2 0 236.403 2.305 20 0 BEADRP CC[C@@H](C)OCC[C@@H](C)[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC001172342113 974607626 /nfs/dbraw/zinc/60/76/26/974607626.db2.gz KGOQARZDIXJMSC-MQYQWHSLSA-N 2 0 242.407 2.440 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CCSCC[NH3+])C[C@@H]1C ZINC001172365146 974643807 /nfs/dbraw/zinc/64/38/07/974643807.db2.gz CRQPNALZAICAAC-GRYCIOLGSA-N 2 0 230.421 2.093 20 0 BEADRP CCOCC[C@@H](C)[NH2+]CCC[NH+](CC)CC ZINC001172406987 974662656 /nfs/dbraw/zinc/66/26/56/974662656.db2.gz RNEFPNHBCNKWDA-CYBMUJFWSA-N 2 0 230.396 2.123 20 0 BEADRP CCOCC[C@H](C)[NH2+]CCCCC[NH+](C)C ZINC001172409511 974670395 /nfs/dbraw/zinc/67/03/95/974670395.db2.gz VTOJNVPPNMXPNA-ZDUSSCGKSA-N 2 0 230.396 2.123 20 0 BEADRP CCOCC[C@H](C)[NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1 ZINC001172414677 974681865 /nfs/dbraw/zinc/68/18/65/974681865.db2.gz GWOITIFXJWGAKA-MELADBBJSA-N 2 0 242.407 2.264 20 0 BEADRP CCOCC[C@H](C)[NH2+][C@H]1CCC[C@H]([NH+](C)C)C1 ZINC001172414673 974682286 /nfs/dbraw/zinc/68/22/86/974682286.db2.gz GWOITIFXJWGAKA-IHRRRGAJSA-N 2 0 242.407 2.264 20 0 BEADRP CCOCC[C@@H](C)[N@H+](C)CC1CC[NH+](C)CC1 ZINC001172425071 974700200 /nfs/dbraw/zinc/70/02/00/974700200.db2.gz STGFYTBOHUPQGI-CYBMUJFWSA-N 2 0 242.407 2.075 20 0 BEADRP CCOCC[C@@H](C)[N@H+](CC)C1CCN(C)CC1 ZINC001172426511 974704572 /nfs/dbraw/zinc/70/45/72/974704572.db2.gz YPNSUPVVOCGTHF-CYBMUJFWSA-N 2 0 242.407 2.218 20 0 BEADRP CC(C)OCC[C@H](C)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC001172439080 974794587 /nfs/dbraw/zinc/79/45/87/974794587.db2.gz XSMKMYPTGNXKDR-KBPBESRZSA-N 2 0 242.407 2.121 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]Cc1ccc2c(c1)CCC2 ZINC001331822595 974827945 /nfs/dbraw/zinc/82/79/45/974827945.db2.gz SGRHECQTYYNBQQ-JKSUJKDBSA-N 2 0 244.382 2.392 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H]1CCc2ccccc2C1 ZINC001331820720 974828615 /nfs/dbraw/zinc/82/86/15/974828615.db2.gz ILULFXUGRZWWIP-IUODEOHRSA-N 2 0 232.371 2.132 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H](C)C1CCSCC1 ZINC001331833957 974829425 /nfs/dbraw/zinc/82/94/25/974829425.db2.gz KAEJBYIAPOZHFS-MNOVXSKESA-N 2 0 230.421 2.106 20 0 BEADRP CCCCCC[C@H](CCCC)[NH2+]C[C@@H](O)C[NH3+] ZINC001172510514 974865255 /nfs/dbraw/zinc/86/52/55/974865255.db2.gz DPTTUBHYIYECGO-KBPBESRZSA-N 2 0 244.423 2.425 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@H]([NH2+]C[C@H]3CC=CCC3)[C@@H]2C1 ZINC001204089638 974878006 /nfs/dbraw/zinc/87/80/06/974878006.db2.gz PUGZMSHURQBHBW-XQLPTFJDSA-N 2 0 234.387 2.273 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)[C@@H]1CCC[C@H](OC)C1 ZINC001172951534 975006335 /nfs/dbraw/zinc/00/63/35/975006335.db2.gz RGOGUERIASWQJG-KGLIPLIRSA-N 2 0 242.407 2.218 20 0 BEADRP C[C@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H]([NH+](C)C)C2)CCO1 ZINC001173170134 975062283 /nfs/dbraw/zinc/06/22/83/975062283.db2.gz JWTVQZNMMYOURA-REWJHTLYSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@H]1C[C@H]([NH2+][C@H]2CCC[C@@H]([NH+](C)C)C2)CCO1 ZINC001173170133 975062383 /nfs/dbraw/zinc/06/23/83/975062383.db2.gz JWTVQZNMMYOURA-IGQOVBAYSA-N 2 0 240.391 2.016 20 0 BEADRP CCCC[C@H](CC(C)C)[N@@H+]1CCO[C@@H](C[NH3+])C1 ZINC001173251036 975089668 /nfs/dbraw/zinc/08/96/68/975089668.db2.gz YDRWUODHYCFCPD-KGLIPLIRSA-N 2 0 242.407 2.251 20 0 BEADRP CC[C@H]1CC[C@H]([NH2+]C[C@H]2CCC[N@H+](C)C2)C1 ZINC001173262394 975117468 /nfs/dbraw/zinc/11/74/68/975117468.db2.gz GOVANNKDETXSBV-MJBXVCDLSA-N 2 0 224.392 2.497 20 0 BEADRP CCc1ccc(C[C@H](C)[NH2+]C2CC([NH3+])C2)cc1 ZINC001173237817 975161538 /nfs/dbraw/zinc/16/15/38/975161538.db2.gz FGICKVIRYVILAR-QGLTVNCISA-N 2 0 232.371 2.259 20 0 BEADRP CCSC[C@@H](C)[NH2+]Cc1ccccc1C[NH3+] ZINC001173298159 975186753 /nfs/dbraw/zinc/18/67/53/975186753.db2.gz LGUBCVUYUGUKFI-LLVKDONJSA-N 2 0 238.400 2.377 20 0 BEADRP CCSC[C@H](C)[NH2+]CCC[NH+](CC)CC ZINC001173284697 975242041 /nfs/dbraw/zinc/24/20/41/975242041.db2.gz HVIRZTCTVFKCFP-LBPRGKRZSA-N 2 0 232.437 2.450 20 0 BEADRP CCSC[C@H](C)[NH2+]CC12CC[NH+](CC1)CC2 ZINC001173289064 975253207 /nfs/dbraw/zinc/25/32/07/975253207.db2.gz AXISOCRPVQWZFT-LBPRGKRZSA-N 2 0 242.432 2.204 20 0 BEADRP CCSC[C@@H](C)[NH2+]CC12CC[NH+](CC1)CC2 ZINC001173289063 975253267 /nfs/dbraw/zinc/25/32/67/975253267.db2.gz AXISOCRPVQWZFT-GFCCVEGCSA-N 2 0 242.432 2.204 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H](F)C2)C12CCC2 ZINC001332875576 975303336 /nfs/dbraw/zinc/30/33/36/975303336.db2.gz BVZAKCWYQGWMNG-QCNOEVLYSA-N 2 0 226.339 2.127 20 0 BEADRP CC[N@@H+]1CC[C@H](n2ccc3cccc(C[NH3+])c32)C1 ZINC001173356504 975317508 /nfs/dbraw/zinc/31/75/08/975317508.db2.gz DLTPIVQJKSDUKU-AWEZNQCLSA-N 2 0 243.354 2.367 20 0 BEADRP C([C@@H]1CCC[NH2+]C1)[N@@H+]1C[C@H](C2CC2)C[C@@H]1C1CC1 ZINC001333529760 975834897 /nfs/dbraw/zinc/83/48/97/975834897.db2.gz QWICAXAWCMFCLG-DAXOMENPSA-N 2 0 248.414 2.497 20 0 BEADRP C[C@@H]([NH2+]C1CCC(C[NH3+])CC1)c1cncs1 ZINC001335254671 976902683 /nfs/dbraw/zinc/90/26/83/976902683.db2.gz UBOSWDCQIWWALW-KPPDAEKUSA-N 2 0 239.388 2.311 20 0 BEADRP C[C@H](C[NH+](C)C)Oc1ccccc1C[NH+](C)C ZINC001229699416 976949519 /nfs/dbraw/zinc/94/95/19/976949519.db2.gz NJZVIHMYHHKJDS-GFCCVEGCSA-N 2 0 236.359 2.077 20 0 BEADRP CCC[C@H](C)[N@@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC000429015169 976981480 /nfs/dbraw/zinc/98/14/80/976981480.db2.gz XGDYMJUCCIUBIY-STQMWFEESA-N 2 0 210.365 2.203 20 0 BEADRP COC[C@@H](C)[NH2+]C1CCC(C)([NH+]2CCC2)CC1 ZINC001335506395 977106547 /nfs/dbraw/zinc/10/65/47/977106547.db2.gz KPCLEHJJKDOSOU-IYXRBSQSSA-N 2 0 240.391 2.018 20 0 BEADRP C[NH+](C)Cc1cccc(NC2=CCC[N@H+](C)C2)c1 ZINC001175576791 977585417 /nfs/dbraw/zinc/58/54/17/977585417.db2.gz TYFJYQHWXDGUHY-UHFFFAOYSA-N 2 0 245.370 2.380 20 0 BEADRP CC1([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C2CC2)CC1 ZINC001336269196 977606615 /nfs/dbraw/zinc/60/66/15/977606615.db2.gz ARZFNGLXIWYOLV-VGPLMAKISA-N 2 0 220.360 2.286 20 0 BEADRP c1c[nH+]c(Nc2cc[nH+]c(N3CCCC3)c2)[nH]1 ZINC001176082199 977880277 /nfs/dbraw/zinc/88/02/77/977880277.db2.gz ZCUAFBKBVKJOJZ-UHFFFAOYSA-N 2 0 229.287 2.149 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]CCCC(F)(F)F)C1 ZINC001336823282 977988647 /nfs/dbraw/zinc/98/86/47/977988647.db2.gz ACJQXVIDECWOFD-AOOOYVTPSA-N 2 0 238.297 2.259 20 0 BEADRP C[N@@H+]1CCCC12CCN(c1cc[nH+]cc1)CC2 ZINC001336909368 978047574 /nfs/dbraw/zinc/04/75/74/978047574.db2.gz NNSJIGIRYZNPKQ-UHFFFAOYSA-N 2 0 231.343 2.146 20 0 BEADRP Cc1cc(C)[nH+]c(N[C@H]2CCC[C@@H]([NH3+])C2)c1 ZINC000721838717 978052374 /nfs/dbraw/zinc/05/23/74/978052374.db2.gz STPZQWDJVDQFNI-NEPJUHHUSA-N 2 0 219.332 2.380 20 0 BEADRP Cn1c[nH+]cc1Nc1cccnc1N1CCCC1 ZINC001176750753 978171582 /nfs/dbraw/zinc/17/15/82/978171582.db2.gz VRYWTJMXCYRIOO-UHFFFAOYSA-N 2 0 243.314 2.159 20 0 BEADRP c1cc(N2CC3(C2)C[NH+](C2CCCC2)C3)cc[nH+]1 ZINC001277693479 978205369 /nfs/dbraw/zinc/20/53/69/978205369.db2.gz IOOJNMVHCPEQDT-UHFFFAOYSA-N 2 0 243.354 2.146 20 0 BEADRP C[C@@]1(C[NH3+])CCC[N@H+](CCC(F)(F)F)CC1 ZINC001206293145 978292294 /nfs/dbraw/zinc/29/22/94/978292294.db2.gz GJXATGNLIXMBKE-SNVBAGLBSA-N 2 0 238.297 2.390 20 0 BEADRP Cc1cc(F)cc(N[C@@H]2CC[C@H]3C[N@@H+](C)C[C@H]32)n1 ZINC001337431700 978335410 /nfs/dbraw/zinc/33/54/10/978335410.db2.gz LURLWJIBIUMBAM-CYZMBNFOSA-N 2 0 249.333 2.281 20 0 BEADRP C[C@]1(C[NH3+])CCC[N@H+](Cc2nccs2)CC1 ZINC001206305104 978385463 /nfs/dbraw/zinc/38/54/63/978385463.db2.gz SYZPNMNVFDODPY-LBPRGKRZSA-N 2 0 239.388 2.094 20 0 BEADRP CC1CC[NH+](CCCNc2cc[nH+]cc2)CC1 ZINC001337637640 978438266 /nfs/dbraw/zinc/43/82/66/978438266.db2.gz PGLCXFHJEUXNCP-UHFFFAOYSA-N 2 0 233.359 2.037 20 0 BEADRP C[N@@H+](Cc1cc2ccccc2[nH]1)C[C@H]1C[C@@H]([NH3+])C1 ZINC001337837559 978519694 /nfs/dbraw/zinc/51/96/94/978519694.db2.gz CGWBETWOYIOYNS-BJHJDKERSA-N 2 0 243.354 2.337 20 0 BEADRP CC[C@H](C)[NH2+][C@@]12CC[C@@]([NH2+]C)(C1)CCC2 ZINC001277807807 978697187 /nfs/dbraw/zinc/69/71/87/978697187.db2.gz QQOGGQMAELTCEB-XQQFMLRXSA-N 2 0 210.365 2.439 20 0 BEADRP CC[C@@H](CNc1cc[nH+]cc1C)[NH+]1CCCC1 ZINC001339534933 978862682 /nfs/dbraw/zinc/86/26/82/978862682.db2.gz VWZVEGQZDPJLLC-ZDUSSCGKSA-N 2 0 233.359 2.098 20 0 BEADRP CCc1cccc(C)c1C[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC001234979399 978942482 /nfs/dbraw/zinc/94/24/82/978942482.db2.gz FGCDPWQDIYYIPP-GASCZTMLSA-N 2 0 244.382 2.209 20 0 BEADRP F[C@@H]1CCC[C@H]([NH2+][C@H]2CC[NH2+]C23CCC3)C1 ZINC001340065402 978963565 /nfs/dbraw/zinc/96/35/65/978963565.db2.gz TYUYCBBEEQMATC-WOPDTQHZSA-N 2 0 226.339 2.141 20 0 BEADRP CC1=C[C@H](C)[C@@H](C[N@@H+]2CC[C@]3(CC[NH2+]3)C2)CC1 ZINC001235062685 978967039 /nfs/dbraw/zinc/96/70/39/978967039.db2.gz BTCKIVOANMOZEJ-RRFJBIMHSA-N 2 0 234.387 2.417 20 0 BEADRP c1c[nH]c(C[NH+]2CC3(C2)CC[NH+](C2CC2)CC3)c1 ZINC001277923500 978976397 /nfs/dbraw/zinc/97/63/97/978976397.db2.gz YSQNGOLZMULSFW-UHFFFAOYSA-N 2 0 245.370 2.075 20 0 BEADRP CC1=C[C@H](C)[C@H](C[N@@H+]2C[C@@H]3CC[NH2+][C@@H]3C2)CC1 ZINC001235189213 978993746 /nfs/dbraw/zinc/99/37/46/978993746.db2.gz XSGUAPZLSMQTMR-ZQDZILKHSA-N 2 0 234.387 2.273 20 0 BEADRP CC(C)=CCC[C@H](C)C[N@H+]1C[C@@H]2[C@@H]([NH3+])[C@@H]2C1 ZINC001235211077 978996355 /nfs/dbraw/zinc/99/63/55/978996355.db2.gz UGLNMQLGIGRNLH-IGQOVBAYSA-N 2 0 222.376 2.258 20 0 BEADRP CC(C)=CCC[C@@H](C)C[N@H+]1C[C@@H]2[C@@H]([NH3+])[C@@H]2C1 ZINC001235211078 978996789 /nfs/dbraw/zinc/99/67/89/978996789.db2.gz UGLNMQLGIGRNLH-MQYQWHSLSA-N 2 0 222.376 2.258 20 0 BEADRP CC1=C[C@H](C)[C@@H](CN2CC[C@H]3[NH2+]CC[C@@H]32)CC1 ZINC001235236244 979002252 /nfs/dbraw/zinc/00/22/52/979002252.db2.gz VWBYIUXOKAPWBI-YJNKXOJESA-N 2 0 234.387 2.415 20 0 BEADRP Cc1ccccc1O[C@@H]1CC[N@H+](CCCC[NH3+])C1 ZINC001235675023 979113289 /nfs/dbraw/zinc/11/32/89/979113289.db2.gz MRIHHIAMNWVUNX-CQSZACIVSA-N 2 0 248.370 2.187 20 0 BEADRP [NH3+]CCCC[N@@H+]1CC[C@H](Cc2ccccc2)C1 ZINC001235713441 979128043 /nfs/dbraw/zinc/12/80/43/979128043.db2.gz AHDANAPFQMAREO-OAHLLOKOSA-N 2 0 232.371 2.290 20 0 BEADRP CC/C=C\CCC[N@@H+]1CCCC2(C[NH2+]C2)C1 ZINC001235711154 979129707 /nfs/dbraw/zinc/12/97/07/979129707.db2.gz KQWWZWKLEMXQJU-ARJAWSKDSA-N 2 0 222.376 2.418 20 0 BEADRP [NH3+]CCCC[N@@H+]1CC[C@@H](c2cccc(F)c2)C1 ZINC001235934257 979210199 /nfs/dbraw/zinc/21/01/99/979210199.db2.gz KVOAVJUMGKAORW-CYBMUJFWSA-N 2 0 236.334 2.354 20 0 BEADRP C(CC1CCCC1)C[N@@H+]1C[C@H]2CC[NH2+]C[C@H]2C1 ZINC001235929329 979213175 /nfs/dbraw/zinc/21/31/75/979213175.db2.gz MCKSDXMAFQAWIU-CABCVRRESA-N 2 0 236.403 2.498 20 0 BEADRP CC1(C[N@@H+]2C[C@H]3CC[NH2+]C[C@H]3C2)CCCCC1 ZINC001235929044 979213716 /nfs/dbraw/zinc/21/37/16/979213716.db2.gz GMTWGVKMPSBEQV-KGLIPLIRSA-N 2 0 236.403 2.498 20 0 BEADRP C[N@H+](CC[C@@H]1CCCC[NH2+]1)C[C@@H]1CC1(C)C ZINC001235959557 979224060 /nfs/dbraw/zinc/22/40/60/979224060.db2.gz YRUHZIIAFDIEPQ-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP CCC[N@H+](CCCC[NH3+])CCc1ccccn1 ZINC001235961250 979236278 /nfs/dbraw/zinc/23/62/78/979236278.db2.gz CIGBUFIRYLATNA-UHFFFAOYSA-N 2 0 235.375 2.075 20 0 BEADRP [NH3+]CCCC[NH+]1CCC2(CC[C@H](F)C2)CC1 ZINC001235984028 979265322 /nfs/dbraw/zinc/26/53/22/979265322.db2.gz AYBIOIYOTVKBCB-LBPRGKRZSA-N 2 0 228.355 2.330 20 0 BEADRP CC/C=C\CCC[N@@H+]1C[C@H](C)C[C@@H]([NH3+])C1 ZINC001236043962 979332877 /nfs/dbraw/zinc/33/28/77/979332877.db2.gz HBNDFKIVQOTBMG-DIABFLQPSA-N 2 0 210.365 2.402 20 0 BEADRP CC(C)(C)CC[N@H+]1C[C@@H]2CC[NH2+]CC[C@@H]2C1 ZINC001236314522 979523437 /nfs/dbraw/zinc/52/34/37/979523437.db2.gz PREULPGMXCTSEG-BETUJISGSA-N 2 0 224.392 2.354 20 0 BEADRP Cc1c[nH+]c(-c2cccc3c2CC[NH2+]C3)cc1N ZINC001236339762 979540311 /nfs/dbraw/zinc/54/03/11/979540311.db2.gz JIPGWCLNNRRMIW-UHFFFAOYSA-N 2 0 239.322 2.285 20 0 BEADRP C[C@]1(C[NH3+])CCCC[N@H+](Cc2ccco2)C1 ZINC001206541511 979641515 /nfs/dbraw/zinc/64/15/15/979641515.db2.gz IDCBBULVIDIZOO-CYBMUJFWSA-N 2 0 222.332 2.231 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CCCC[C@@](C)(C[NH3+])C1 ZINC001206542135 979650359 /nfs/dbraw/zinc/65/03/59/979650359.db2.gz SEOUNJNWKIDIHM-UPJWGTAASA-N 2 0 210.365 2.093 20 0 BEADRP COc1ccc(C[N@@H+]2CCC[C@](C)([NH3+])CC2)cc1 ZINC001205265168 979821629 /nfs/dbraw/zinc/82/16/29/979821629.db2.gz OAGLBVPCJSDTEP-HNNXBMFYSA-N 2 0 248.370 2.399 20 0 BEADRP CC[C@@H]([NH2+]C[C@H]1C[NH+]2CCC1CC2)C1CCC1 ZINC001184135099 979945324 /nfs/dbraw/zinc/94/53/24/979945324.db2.gz KRJMJUPTUZTPQY-LSDHHAIUSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[NH+]2CCC1CC2)c1ccccn1 ZINC001184135719 979947311 /nfs/dbraw/zinc/94/73/11/979947311.db2.gz UOLFCHJFYYMJAH-OCCSQVGLSA-N 2 0 245.370 2.074 20 0 BEADRP C[C@H](CC1CC1)[NH2+]C[C@H]1C[NH+]2CCC1CC2 ZINC001184134137 979948078 /nfs/dbraw/zinc/94/80/78/979948078.db2.gz AHRHRYGKCMJBFI-RISCZKNCSA-N 2 0 222.376 2.106 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+][C@H]1CCCOCC1 ZINC001184419311 980082326 /nfs/dbraw/zinc/08/23/26/980082326.db2.gz ZLTPHWPRJQRJFK-KBPBESRZSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@H]([NH3+])c1ccc(C2=CCC[NH2+]CC2)cc1 ZINC001238944004 980380791 /nfs/dbraw/zinc/38/07/91/980380791.db2.gz AMULOIYPRSGYJZ-NSHDSACASA-N 2 0 216.328 2.473 20 0 BEADRP [NH3+]C1(c2cccc(C3=CCC[NH2+]CC3)c2)CC1 ZINC001238946724 980386903 /nfs/dbraw/zinc/38/69/03/980386903.db2.gz SQIPNKZUUIQHQR-UHFFFAOYSA-N 2 0 228.339 2.401 20 0 BEADRP [NH3+]Cc1c[nH]c2ccc(C3=CCC[NH2+]CC3)cc12 ZINC001238951123 980390756 /nfs/dbraw/zinc/39/07/56/980390756.db2.gz SMIKTPGQOJEVFS-UHFFFAOYSA-N 2 0 241.338 2.393 20 0 BEADRP C[NH+](C)Cc1ccccc1-c1ccc(C[NH3+])nc1 ZINC001239684196 980840770 /nfs/dbraw/zinc/84/07/70/980840770.db2.gz LUKLXGLIMKEHTH-UHFFFAOYSA-N 2 0 241.338 2.269 20 0 BEADRP C[NH+](C)Cc1ccccc1-c1cncc(C[NH3+])c1 ZINC001239790398 980929910 /nfs/dbraw/zinc/92/99/10/980929910.db2.gz IYXQRHXJNJLHQU-UHFFFAOYSA-N 2 0 241.338 2.269 20 0 BEADRP [NH3+]Cc1cncc(-c2c[nH+]cc3cc[nH]c32)c1 ZINC001239799657 980938568 /nfs/dbraw/zinc/93/85/68/980938568.db2.gz ZSKPSHXDADAMCJ-UHFFFAOYSA-N 2 0 224.267 2.084 20 0 BEADRP CC(C)([NH3+])c1cccc(-c2cncc(C[NH3+])c2)c1 ZINC001239807383 980943980 /nfs/dbraw/zinc/94/39/80/980943980.db2.gz YKJXHUPNOIPNKU-UHFFFAOYSA-N 2 0 241.338 2.401 20 0 BEADRP CC(C)([NH3+])c1ccc(-c2cncc(C[NH3+])c2)cc1 ZINC001239807291 980945266 /nfs/dbraw/zinc/94/52/66/980945266.db2.gz WSLDJFBYDOFQKD-UHFFFAOYSA-N 2 0 241.338 2.401 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H]1CC[C@H]2[C@@H](C1)C2(F)F ZINC001347281725 981030460 /nfs/dbraw/zinc/03/04/60/981030460.db2.gz LDOSIYVQXZFSCS-QUARPLMYSA-N 2 0 232.318 2.136 20 0 BEADRP C[C@H]1CC[N@H+](CCC2CC2)CC[C@@H]1C[NH3+] ZINC001205600447 981154449 /nfs/dbraw/zinc/15/44/49/981154449.db2.gz BSVWGBBXAWSABE-WCQYABFASA-N 2 0 210.365 2.093 20 0 BEADRP C[C@H](CNc1cc[nH+]cc1)[N@@H+]1CCC[C@@H](C)C1 ZINC001347773104 981169733 /nfs/dbraw/zinc/16/97/33/981169733.db2.gz UBXIWHSLLFJHHY-CHWSQXEVSA-N 2 0 233.359 2.036 20 0 BEADRP Cc1cccnc1C[N@H+]1CC[C@@H](C)[C@@H](C[NH3+])CC1 ZINC001205603992 981174010 /nfs/dbraw/zinc/17/40/10/981174010.db2.gz SXSIKGFAADBTGI-TZMCWYRMSA-N 2 0 247.386 2.197 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@H](C)[C@@H](C[NH3+])CC2)o1 ZINC001205604820 981180355 /nfs/dbraw/zinc/18/03/55/981180355.db2.gz XUUMHOKJVIUUML-WCQYABFASA-N 2 0 236.359 2.395 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]C[C@@H]1CCOc2ccccc21 ZINC001348516703 981382138 /nfs/dbraw/zinc/38/21/38/981382138.db2.gz WKQRMLYPSZCYHR-OLZOCXBDSA-N 2 0 248.370 2.140 20 0 BEADRP [NH3+][C@H]1CCc2c1cccc2C1=CCC[NH2+]C1 ZINC001240670041 981579741 /nfs/dbraw/zinc/57/97/41/981579741.db2.gz CVJUZPNEWMUXJF-AWEZNQCLSA-N 2 0 214.312 2.009 20 0 BEADRP C[NH+](C)Cc1cccc(C2=CCC[NH2+]C2)c1F ZINC001240670629 981579857 /nfs/dbraw/zinc/57/98/57/981579857.db2.gz KRKIHMGBVGLJQO-UHFFFAOYSA-N 2 0 234.318 2.264 20 0 BEADRP c1cc(C[NH2+]CC2C[NH2+]C2)cc(CC2CCC2)c1 ZINC001580888084 981703863 /nfs/dbraw/zinc/70/38/63/981703863.db2.gz QOHLFWOAFUIYOR-UHFFFAOYSA-N 2 0 244.382 2.338 20 0 BEADRP CCC(CC)[NH2+]C1CC[NH+](CCCOC)CC1 ZINC000159195937 981855721 /nfs/dbraw/zinc/85/57/21/981855721.db2.gz UPVQPYZRTRAKBK-UHFFFAOYSA-N 2 0 242.407 2.266 20 0 BEADRP C(=C1CC[NH2+]CC1)c1[nH+]ccc2[nH]ccc21 ZINC001240873199 981913907 /nfs/dbraw/zinc/91/39/07/981913907.db2.gz VIZCIMQRRCGWGV-UHFFFAOYSA-N 2 0 213.284 2.330 20 0 BEADRP C(c1cccc2c1C[NH2+]C2)=C1CC[NH2+]CC1 ZINC001240876700 981921703 /nfs/dbraw/zinc/92/17/03/981921703.db2.gz DWRSACFIHQGWIO-UHFFFAOYSA-N 2 0 214.312 2.057 20 0 BEADRP C(c1c[nH+]cc2cc[nH]c21)=C1CC[NH2+]CC1 ZINC001240877603 981930341 /nfs/dbraw/zinc/93/03/41/981930341.db2.gz DGZNXYVFROKUIG-UHFFFAOYSA-N 2 0 213.284 2.330 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)CC(C)(C)C ZINC000336685948 982050671 /nfs/dbraw/zinc/05/06/71/982050671.db2.gz LJLVDBAMGZHLAR-UHFFFAOYSA-N 2 0 200.370 2.306 20 0 BEADRP CC(C)C[N@@H+]1C[C@@H]2CC[C@@H]([NH+](C)C)C[C@H]2C1 ZINC001352113659 982473755 /nfs/dbraw/zinc/47/37/55/982473755.db2.gz TUJRLEINIGBMQF-MELADBBJSA-N 2 0 224.392 2.305 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1C[C@@H]2CC[C@H]([NH+](C)C)C[C@H]2C1 ZINC001352110512 982474026 /nfs/dbraw/zinc/47/40/26/982474026.db2.gz COIRXVSKMMVWBF-SEBNEYGDSA-N 2 0 236.403 2.305 20 0 BEADRP C[NH+](C)Cc1ccccc1C1=CC[N@H+](C)CC1 ZINC001241318074 982477034 /nfs/dbraw/zinc/47/70/34/982477034.db2.gz WWDGBIWJZGBVJP-UHFFFAOYSA-N 2 0 230.355 2.467 20 0 BEADRP c1csc(C[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)c1 ZINC000037408330 982940407 /nfs/dbraw/zinc/94/04/07/982940407.db2.gz VJDJVKPNJQLTSI-NSHDSACASA-N 2 0 236.384 2.322 20 0 BEADRP Fc1ccc(C[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000037408211 982941017 /nfs/dbraw/zinc/94/10/17/982941017.db2.gz INAOTRDGMAUPPL-CYBMUJFWSA-N 2 0 248.345 2.400 20 0 BEADRP [NH3+]Cc1ccc(-c2ccc3c[nH+]cn3c2)cc1 ZINC001241913191 983131805 /nfs/dbraw/zinc/13/18/05/983131805.db2.gz NSGCELJNHUKOQT-UHFFFAOYSA-N 2 0 223.279 2.460 20 0 BEADRP C[C@H]([NH3+])c1ccc(-c2ccc(C[NH3+])cc2)cn1 ZINC001241918103 983139792 /nfs/dbraw/zinc/13/97/92/983139792.db2.gz TXWJZFUUKJHPJV-JTQLQIEISA-N 2 0 227.311 2.227 20 0 BEADRP C[NH+]1CCC2(C[NH+](C[C@H]3CC=CCC3)C2)CC1 ZINC001201421534 983221374 /nfs/dbraw/zinc/22/13/74/983221374.db2.gz CLBMDYZZDPQQRU-AWEZNQCLSA-N 2 0 234.387 2.370 20 0 BEADRP c1cn2c(n1)CC[N@H+](C[C@@H]1CC=CCC1)CC2 ZINC001201423945 983224201 /nfs/dbraw/zinc/22/42/01/983224201.db2.gz YEYDDTZUSBMVEQ-CYBMUJFWSA-N 2 0 231.343 2.098 20 0 BEADRP CC[N@H+](C)C1CC[NH+](CC(C)(C)C)CC1 ZINC001201446250 983250181 /nfs/dbraw/zinc/25/01/81/983250181.db2.gz ATPBLFKNTZRXGC-UHFFFAOYSA-N 2 0 212.381 2.449 20 0 BEADRP CC(C)CN1CC2(C1)CC[N@H+](CC1CC1)C2 ZINC001201471864 983282766 /nfs/dbraw/zinc/28/27/66/983282766.db2.gz ZHKKWWVYCMFLGS-UHFFFAOYSA-N 2 0 222.376 2.060 20 0 BEADRP CCC[C@H](C)C[N@H+]1CCc2nccn2CC1 ZINC001201552974 983311429 /nfs/dbraw/zinc/31/14/29/983311429.db2.gz XDGQGWIFDNWELR-LBPRGKRZSA-N 2 0 221.348 2.177 20 0 BEADRP CCC[NH+]1C[C@@H]2C[NH+](C[C@@H](C)CC)C[C@H]2C1 ZINC001201516845 983314310 /nfs/dbraw/zinc/31/43/10/983314310.db2.gz DMKPZFXLMQXTJJ-BFHYXJOUSA-N 2 0 224.392 2.306 20 0 BEADRP CCC(CC)C[NH+]1C[C@@H]2C[NH+](CC)C[C@H]2C1 ZINC001201534207 983327026 /nfs/dbraw/zinc/32/70/26/983327026.db2.gz DSWAXHLETSZXTF-KBPBESRZSA-N 2 0 224.392 2.306 20 0 BEADRP CC(C)CC[NH+]1CC2(C1)CC[NH+](C)CC2 ZINC001201627305 983380754 /nfs/dbraw/zinc/38/07/54/983380754.db2.gz UGRARIPVRKGIHG-UHFFFAOYSA-N 2 0 210.365 2.060 20 0 BEADRP CCC[NH+]1C[C@H]2C[NH+](Cc3ccccc3)C[C@@H]2C1 ZINC001201643353 983399638 /nfs/dbraw/zinc/39/96/38/983399638.db2.gz GZIULWRJHNMFMH-HOTGVXAUSA-N 2 0 244.382 2.460 20 0 BEADRP CCC[N@H+]1C[C@@H]2C[NH+](CCCSC)C[C@@H]2C1 ZINC001201697877 983413539 /nfs/dbraw/zinc/41/35/39/983413539.db2.gz RYEJOWLTQPRQJM-BETUJISGSA-N 2 0 242.432 2.013 20 0 BEADRP CCCCC[N@@H+]1C[C@H]2CCCN(C)[C@@H]2C1 ZINC001201737328 983444840 /nfs/dbraw/zinc/44/48/40/983444840.db2.gz IQEHDCHAHXTDRX-CHWSQXEVSA-N 2 0 210.365 2.203 20 0 BEADRP CCCCC[N@H+]1C[C@H]2C[NH+](CCC)C[C@H]2C1 ZINC001201743954 983450534 /nfs/dbraw/zinc/45/05/34/983450534.db2.gz AZLAMSKOZHQDJD-OKILXGFUSA-N 2 0 224.392 2.450 20 0 BEADRP CC[N@H+](CC1CC[NH+](C)CC1)C(C)(C)C ZINC001355321097 983469715 /nfs/dbraw/zinc/46/97/15/983469715.db2.gz HWLUZYIMCHZVEQ-UHFFFAOYSA-N 2 0 212.381 2.449 20 0 BEADRP CCC[C@@H](O)C[NH2+]CCC[N@@H+]1CCCC[C@H]1C ZINC001252799432 983894981 /nfs/dbraw/zinc/89/49/81/983894981.db2.gz RUVOTADGHHSVMH-ZIAGYGMSSA-N 2 0 242.407 2.002 20 0 BEADRP C[C@@H]1CC[C@@H]([N@@H+]2CC[C@@]3(CC[NH+](C)C3)C2)C1 ZINC000339211248 984023055 /nfs/dbraw/zinc/02/30/55/984023055.db2.gz GUJCFSZJSRVAHS-MGPQQGTHSA-N 2 0 222.376 2.203 20 0 BEADRP [NH3+]CCc1ccccc1-c1ccc2c(c1)C[NH2+]C2 ZINC001242674840 984041532 /nfs/dbraw/zinc/04/15/32/984041532.db2.gz YKOBGDUKSYAHIE-UHFFFAOYSA-N 2 0 238.334 2.458 20 0 BEADRP CCC[C@H](C[N@H+](CCC)C1CC[NH2+]CC1)OC ZINC001577357751 984192659 /nfs/dbraw/zinc/19/26/59/984192659.db2.gz IWXZAPRTDCWLEA-CQSZACIVSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@H]1C[N@H+](CC2CCC2)CCC[C@@H]1C[NH3+] ZINC001205983888 984214405 /nfs/dbraw/zinc/21/44/05/984214405.db2.gz PVOLCLPQHRVRIP-WCQYABFASA-N 2 0 210.365 2.093 20 0 BEADRP [NH3+]CC1(C[NH2+]CC[C@@H]2CCC(F)(F)C2)CC1 ZINC001580244108 984471676 /nfs/dbraw/zinc/47/16/76/984471676.db2.gz POTGPGOAWNYREW-JTQLQIEISA-N 2 0 232.318 2.140 20 0 BEADRP CC(C)CC[NH+]1CCC2(CC[N@H+](C)C2)CC1 ZINC001275096809 984483872 /nfs/dbraw/zinc/48/38/72/984483872.db2.gz TXRLFVNVRQWDAA-UHFFFAOYSA-N 2 0 224.392 2.450 20 0 BEADRP C[N@@H+]1CCCC[C@H]1c1ccc(C2=CC[NH2+]C2)nc1 ZINC001243108274 984555794 /nfs/dbraw/zinc/55/57/94/984555794.db2.gz NYLJPWKBALKAOS-HNNXBMFYSA-N 2 0 243.354 2.225 20 0 BEADRP C[N@@H+]1CC[C@@H](c2ccc(C3=CC[NH2+]C3)cc2)C1 ZINC001243115484 984587815 /nfs/dbraw/zinc/58/78/15/984587815.db2.gz MGEYQZHAPMWCQZ-OAHLLOKOSA-N 2 0 228.339 2.092 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CCC[C@@]2(CCC[NH+](C)C2)C1 ZINC001276032787 984790444 /nfs/dbraw/zinc/79/04/44/984790444.db2.gz LNLFTYNRKVMFDL-RBSFLKMASA-N 2 0 236.403 2.450 20 0 BEADRP CCO[C@@H]1CCCC[C@H]1[NH2+][C@@H]1CC[C@H](C[NH3+])C1 ZINC001578148913 984854432 /nfs/dbraw/zinc/85/44/32/984854432.db2.gz NSWHANSRSOOYAX-REWJHTLYSA-N 2 0 240.391 2.051 20 0 BEADRP CCO[C@@H]1CCCC[C@H]1[NH2+]CCCCCC[NH3+] ZINC001578148930 984855686 /nfs/dbraw/zinc/85/56/86/984855686.db2.gz OLIRTOWEMOHPMA-ZIAGYGMSSA-N 2 0 242.407 2.443 20 0 BEADRP CCc1ccc(C[NH2+][C@@H](C)C2CC[NH2+]CC2)o1 ZINC001578259763 984899838 /nfs/dbraw/zinc/89/98/38/984899838.db2.gz IPFDWHMXLIVWMP-NSHDSACASA-N 2 0 236.359 2.320 20 0 BEADRP CCc1cccc(C[NH2+][C@@H]2C[C@H]([NH3+])C2(C)C)c1 ZINC001578266172 984900095 /nfs/dbraw/zinc/90/00/95/984900095.db2.gz BSKHEGWEMMMUKP-UONOGXRCSA-N 2 0 232.371 2.464 20 0 BEADRP CCc1ccc(C[NH2+][C@H](C)C2CC[NH2+]CC2)o1 ZINC001578259762 984905300 /nfs/dbraw/zinc/90/53/00/984905300.db2.gz IPFDWHMXLIVWMP-LLVKDONJSA-N 2 0 236.359 2.320 20 0 BEADRP CCCCC[C@@H](C)[N@H+]1C[C@H]2C[NH+](C)C[C@H]2C1 ZINC001257517321 985192498 /nfs/dbraw/zinc/19/24/98/985192498.db2.gz UVRABRFMNCFKEI-MCIONIFRSA-N 2 0 224.392 2.449 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@@H]1C[C@@H]2CC[C@@H](C2)C1 ZINC001578572034 985207750 /nfs/dbraw/zinc/20/77/50/985207750.db2.gz ZUYDHGFEXUQMEJ-RVMXOQNASA-N 2 0 210.365 2.153 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]Cc1cccc2ncccc12 ZINC001578571480 985210754 /nfs/dbraw/zinc/21/07/54/985210754.db2.gz PCZXZMCDEDWXGU-LBPRGKRZSA-N 2 0 243.354 2.322 20 0 BEADRP C/C=C(\NC=[NH2+])c1cccc(OCC[NH+](C)C)c1 ZINC001243753042 985281876 /nfs/dbraw/zinc/28/18/76/985281876.db2.gz YYBFOFJOHHYLHF-CPSFFCFKSA-N 2 0 247.342 2.184 20 0 BEADRP CNc1ccc(C)cc1C[NH2+][C@H](C)C[C@H](C)[NH3+] ZINC001578757610 985328437 /nfs/dbraw/zinc/32/84/37/985328437.db2.gz UUDQPNOPIMLVDT-NWDGAFQWSA-N 2 0 235.375 2.252 20 0 BEADRP CNc1ccccc1C[NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2 ZINC001578764564 985330196 /nfs/dbraw/zinc/33/01/96/985330196.db2.gz YROSKFNUNUMIEY-ZIAGYGMSSA-N 2 0 245.370 2.088 20 0 BEADRP CO[C@](C)(C[N@@H+]1CCCCC[C@H]([NH3+])C1)C1CC1 ZINC001578897015 985475265 /nfs/dbraw/zinc/47/52/65/985475265.db2.gz HVOXVDSLPDWEOV-UONOGXRCSA-N 2 0 240.391 2.005 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H]1COC[C@@H]1C ZINC000688024900 985503264 /nfs/dbraw/zinc/50/32/64/985503264.db2.gz NHDFUYDRZSKKOT-IHRRRGAJSA-N 2 0 242.407 2.121 20 0 BEADRP C(=C/C1CC[NH2+]CC1)\c1ccc2c[nH+]cn2c1 ZINC001243893502 985561424 /nfs/dbraw/zinc/56/14/24/985561424.db2.gz PCNRTZQCHSCHPJ-OWOJBTEDSA-N 2 0 227.311 2.347 20 0 BEADRP COC[C@H]([NH2+]C[C@H]1CC[C@@H]([NH3+])C1)c1ccccc1 ZINC001578970562 985596903 /nfs/dbraw/zinc/59/69/03/985596903.db2.gz WXUKBJYUSNBPGA-CFVMTHIKSA-N 2 0 248.370 2.091 20 0 BEADRP C[C@H](CC[NH2+]C1CCC(F)(F)CC1)[NH+](C)C ZINC000688319899 985609307 /nfs/dbraw/zinc/60/93/07/985609307.db2.gz WZFDKONTUYQHAZ-SNVBAGLBSA-N 2 0 234.334 2.494 20 0 BEADRP C[NH+](C)Cc1cccc(C2=C[NH2+]CCC2)c1 ZINC001243952210 985660477 /nfs/dbraw/zinc/66/04/77/985660477.db2.gz GYXHCUNKNFVKAV-UHFFFAOYSA-N 2 0 216.328 2.473 20 0 BEADRP c1cc2c(cc1C1=C[NH2+]CCC1)CC[NH2+]C2 ZINC001243953493 985666510 /nfs/dbraw/zinc/66/65/10/985666510.db2.gz YXRBFSLGYPHWDD-UHFFFAOYSA-N 2 0 214.312 2.057 20 0 BEADRP CCSC1(C[NH2+][C@@H]2C[C@@H]([NH3+])C23CCC3)CC1 ZINC000691863994 985703786 /nfs/dbraw/zinc/70/37/86/985703786.db2.gz GXZNEULGDRPZCQ-GHMZBOCLSA-N 2 0 240.416 2.132 20 0 BEADRP CCSC1(C[NH2+][C@H]2C[C@H]([NH3+])C23CCC3)CC1 ZINC000691864001 985704450 /nfs/dbraw/zinc/70/44/50/985704450.db2.gz GXZNEULGDRPZCQ-QWRGUYRKSA-N 2 0 240.416 2.132 20 0 BEADRP COc1ccc(C[N@@H+]2CC[C@](C)(C[NH3+])C2)c(C)c1 ZINC001579212574 985821692 /nfs/dbraw/zinc/82/16/92/985821692.db2.gz FDDGPZROOOYABB-OAHLLOKOSA-N 2 0 248.370 2.174 20 0 BEADRP CSC1(C[NH2+][C@@H]2Cc3ccccc3[C@H]2N)CC1 ZINC001579365926 985860506 /nfs/dbraw/zinc/86/05/06/985860506.db2.gz XDGLDUYAWCRJEJ-CHWSQXEVSA-N 2 0 248.395 2.096 20 0 BEADRP C[C@@H]1C[N@H+](C[C@H]2CCc3ccccc3C2)C[C@H]1[NH3+] ZINC001579439960 985927413 /nfs/dbraw/zinc/92/74/13/985927413.db2.gz FTVLUYALSINRQS-DVOMOZLQSA-N 2 0 244.382 2.071 20 0 BEADRP [NH3+]C[C@H]1CCCC[N@H+](C[C@H]2C[C@H]3C=C[C@@H]2C3)C1 ZINC001206606778 985937683 /nfs/dbraw/zinc/93/76/83/985937683.db2.gz SKGZWBPAJLSXAK-GBJTYRQASA-N 2 0 234.387 2.259 20 0 BEADRP C[C@H](CC1CC1)[N@@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC001258473545 985939249 /nfs/dbraw/zinc/93/92/49/985939249.db2.gz NKSKXIOMMNKXRW-TZMCWYRMSA-N 2 0 222.376 2.203 20 0 BEADRP CCC[NH+]1C[C@@H]2C[NH+]([C@@H](C)CC3CC3)C[C@H]2C1 ZINC001258471339 985939439 /nfs/dbraw/zinc/93/94/39/985939439.db2.gz ZERXJVPKXWGKGA-NWANDNLSSA-N 2 0 236.403 2.449 20 0 BEADRP C[C@H](CC1CC1)[NH+]1CC2(C1)CC[NH+](C)CC2 ZINC001258475007 985944978 /nfs/dbraw/zinc/94/49/78/985944978.db2.gz ZZCAJRBZBLHSNG-GFCCVEGCSA-N 2 0 222.376 2.203 20 0 BEADRP [NH3+]CCOc1cccc(-c2ccccc2C[NH3+])c1 ZINC001244325547 985953113 /nfs/dbraw/zinc/95/31/13/985953113.db2.gz VWUMTSMBEVKDMX-UHFFFAOYSA-N 2 0 242.322 2.150 20 0 BEADRP C[C@H](Cc1cccnc1)[NH2+]CCC[NH+]1CCCC1 ZINC001258609930 985986496 /nfs/dbraw/zinc/98/64/96/985986496.db2.gz YLSFRPSFVXWWTB-CQSZACIVSA-N 2 0 247.386 2.088 20 0 BEADRP Cc1ccc2c(c1)CC[N@@H+](C[C@@H]1C[NH2+]C[C@H]1C)C2 ZINC001579738420 986205393 /nfs/dbraw/zinc/20/53/93/986205393.db2.gz PJWGDCXFRIJROE-CJNGLKHVSA-N 2 0 244.382 2.209 20 0 BEADRP Cc1ccsc1CC[NH2+][C@@H]1CC[C@@H](C[NH3+])C1 ZINC001579816196 986236365 /nfs/dbraw/zinc/23/63/65/986236365.db2.gz YLWYPURZTKDXHG-VXGBXAGGSA-N 2 0 238.400 2.316 20 0 BEADRP CC[NH+]1CCC(C[N@H+](C)Cc2cccn2C)CC1 ZINC001461936417 986237360 /nfs/dbraw/zinc/23/73/60/986237360.db2.gz OYVCRKSAUNZRMX-UHFFFAOYSA-N 2 0 249.402 2.189 20 0 BEADRP C[C@@H]1CCC[C@@H]([N@H+]2C[C@H]3C[NH+](C)C[C@H]3C2)C1 ZINC001258825535 986290420 /nfs/dbraw/zinc/29/04/20/986290420.db2.gz DBHSJPLDWQMPCL-YIYPIFLZSA-N 2 0 222.376 2.059 20 0 BEADRP C[NH2+]Cc1cccc(-c2cc(N)c(C)c[nH+]2)c1F ZINC001244859828 986405759 /nfs/dbraw/zinc/40/57/59/986405759.db2.gz LNLHODCOUADOSJ-UHFFFAOYSA-N 2 0 245.301 2.498 20 0 BEADRP FC(F)(F)CCC[NH2+][C@]12CCC[C@H]1[NH2+]CC2 ZINC001580018397 986418331 /nfs/dbraw/zinc/41/83/31/986418331.db2.gz GUNLFMODEKOLLQ-ZJUUUORDSA-N 2 0 236.281 2.203 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1C[NH+]2CCC1CC2)C1CCCC1 ZINC001462632594 986466152 /nfs/dbraw/zinc/46/61/52/986466152.db2.gz DTYNQGKLUYDCTA-IUODEOHRSA-N 2 0 236.403 2.497 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]C[C@@H]1CCC=CO1 ZINC001462672612 986503176 /nfs/dbraw/zinc/50/31/76/986503176.db2.gz KPWLWWQZVCXEDQ-KGLIPLIRSA-N 2 0 240.391 2.389 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]C[C@@H]1CCC=CO1 ZINC001462672603 986506971 /nfs/dbraw/zinc/50/69/71/986506971.db2.gz KPWLWWQZVCXEDQ-KBPBESRZSA-N 2 0 240.391 2.389 20 0 BEADRP [NH3+]CCCCCCC[NH+]1CCC(F)CC1 ZINC000689448726 986619156 /nfs/dbraw/zinc/61/91/56/986619156.db2.gz VHUWEXNSYPPTJL-UHFFFAOYSA-N 2 0 216.344 2.330 20 0 BEADRP [NH3+][C@@H]1CC12CC([NH2+]C[C@H]1C[C@H]1C1CCCC1)C2 ZINC001580167206 986642736 /nfs/dbraw/zinc/64/27/36/986642736.db2.gz VQZJLMJACAYBNK-NSWUILHUSA-N 2 0 234.387 2.282 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH+]2C[C@@H]3CCC[C@H]3C2)CC1 ZINC001254515813 986664567 /nfs/dbraw/zinc/66/45/67/986664567.db2.gz DJLYCFKHCUMNKO-IHRRRGAJSA-N 2 0 222.376 2.203 20 0 BEADRP C[C@H]1CCCC[N@@H+]1[C@@H]1CCC[NH+](C)CC1 ZINC001254515818 986671663 /nfs/dbraw/zinc/67/16/63/986671663.db2.gz DKZZQTDVHDGXDD-QWHCGFSZSA-N 2 0 210.365 2.345 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[NH2+][C@H](c2ccncc2)C2CC2)C1 ZINC001580389239 986815365 /nfs/dbraw/zinc/81/53/65/986815365.db2.gz FHHXISKLBGZZRC-GLQYFDAESA-N 2 0 245.370 2.250 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+]Cc2cc3cc(F)ccc3o2)C1 ZINC001580421832 986839704 /nfs/dbraw/zinc/83/97/04/986839704.db2.gz RJMILDYIROGJFG-WVSHTKLVSA-N 2 0 248.301 2.399 20 0 BEADRP CCCC[C@H](C)[N@H+]1C[C@H]2C[NH+](CC)C[C@H]2C1 ZINC001255334044 986932373 /nfs/dbraw/zinc/93/23/73/986932373.db2.gz KXGLLGPODUIAFA-MELADBBJSA-N 2 0 224.392 2.449 20 0 BEADRP CC(C)([NH3+])c1ccccc1-c1ccncc1C[NH3+] ZINC001245561564 986958340 /nfs/dbraw/zinc/95/83/40/986958340.db2.gz YFFAOHLMYWNKDL-UHFFFAOYSA-N 2 0 241.338 2.401 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]C(C)(C)CC(C)=O ZINC001255950003 987094753 /nfs/dbraw/zinc/09/47/53/987094753.db2.gz DWQZRSDJXUVITH-LBPRGKRZSA-N 2 0 242.407 2.454 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[N@H+](CCCO)C(C)C ZINC001255964433 987103103 /nfs/dbraw/zinc/10/31/03/987103103.db2.gz SIGWSCAXHAVEAE-CQSZACIVSA-N 2 0 244.423 2.200 20 0 BEADRP c1[nH+]cn2cc(-c3[nH+]ccc4c3CCN4)ccc12 ZINC001245897011 987124940 /nfs/dbraw/zinc/12/49/40/987124940.db2.gz YLHNOQPLYMARNI-UHFFFAOYSA-N 2 0 236.278 2.364 20 0 BEADRP CC(C)([NH3+])c1ccc(-c2ccc(C[NH3+])nc2)cc1 ZINC001245911981 987139972 /nfs/dbraw/zinc/13/99/72/987139972.db2.gz GCWADMRQOCEURL-UHFFFAOYSA-N 2 0 241.338 2.401 20 0 BEADRP C[C@@H]1NCCC[C@@H]1[NH2+]C[C@]12C[C@H]1CCCC2 ZINC000693563219 987312919 /nfs/dbraw/zinc/31/29/19/987312919.db2.gz AUABHAFMHXPEGN-CRWXNKLISA-N 2 0 222.376 2.297 20 0 BEADRP CC(C)C[NH2+][C@@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C ZINC000693752039 987314512 /nfs/dbraw/zinc/31/45/12/987314512.db2.gz JZPACIXYLGYUFR-GRYCIOLGSA-N 2 0 210.365 2.009 20 0 BEADRP CC[C@H]1CCC[N@@H+]1C[C@H]1CCCC[NH2+]C1 ZINC000697041066 987347782 /nfs/dbraw/zinc/34/77/82/987347782.db2.gz KJOOQLGPFYHEDJ-STQMWFEESA-N 2 0 210.365 2.251 20 0 BEADRP c1ccc2c(c1)CN(C[C@H]1CCCC[NH2+]C1)C2 ZINC000697058591 987348653 /nfs/dbraw/zinc/34/86/53/987348653.db2.gz RMENEDHRIMETCE-ZDUSSCGKSA-N 2 0 230.355 2.392 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCCCCCCC[NH3+])CC[NH2+]1 ZINC001246074656 987364053 /nfs/dbraw/zinc/36/40/53/987364053.db2.gz BDLSUIIZKKVMNN-ZIAGYGMSSA-N 3 0 241.423 2.016 20 0 BEADRP C[C@H]1C[C@H]([NH2+]Cc2ccc3c(c2)CCC3)CC[NH2+]1 ZINC001246078952 987370654 /nfs/dbraw/zinc/37/06/54/987370654.db2.gz IKTMJHUHSVEDGH-BLLLJJGKSA-N 2 0 244.382 2.405 20 0 BEADRP CC1(C)CC[N@H+](CC2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000699309681 987373128 /nfs/dbraw/zinc/37/31/28/987373128.db2.gz COZZPPCXZQWTSM-YHWZYXNKSA-N 2 0 222.376 2.249 20 0 BEADRP CC1(C[NH2+][C@@H]2CCCC[NH2+]C2)CCCC1 ZINC001246083081 987381301 /nfs/dbraw/zinc/38/13/01/987381301.db2.gz SRGUKOAJPITULJ-GFCCVEGCSA-N 2 0 210.365 2.298 20 0 BEADRP C[C@H]1C[C@H](n2ccc3cc(C[NH3+])ccc32)CC[NH2+]1 ZINC001246086827 987386603 /nfs/dbraw/zinc/38/66/03/987386603.db2.gz WCQOLTDHYKIZJX-SMDDNHRTSA-N 2 0 243.354 2.413 20 0 BEADRP CC[C@H](C[C@@H](C)CC)[NH2+][C@H]1C[NH2+]C[C@@H]1C ZINC001246105672 987432103 /nfs/dbraw/zinc/43/21/03/987432103.db2.gz BZPHTLXVGIGPLH-RVMXOQNASA-N 2 0 212.381 2.399 20 0 BEADRP CSCC[C@H](C)[NH2+]C[C@H]1CC[C@H](C)C[NH2+]1 ZINC001246105084 987432615 /nfs/dbraw/zinc/43/26/15/987432615.db2.gz LPXKMCODMYXWNF-SDDRHHMPSA-N 2 0 230.421 2.106 20 0 BEADRP C[C@H]1C[NH2+]C[C@@H]1[NH2+][C@H]1C[C@H](C)CC(C)(C)C1 ZINC001246108741 987442864 /nfs/dbraw/zinc/44/28/64/987442864.db2.gz MRTLBRBZQWCLME-CYDGBPFRSA-N 2 0 224.392 2.399 20 0 BEADRP CSCC[C@H](C)[NH2+]C[C@H]1CCC[NH2+][C@@H]1C ZINC001246110949 987444313 /nfs/dbraw/zinc/44/43/13/987444313.db2.gz MYUAWGLFQXCBBP-QJPTWQEYSA-N 2 0 230.421 2.106 20 0 BEADRP CC1CCC([NH2+]C[C@H]2C[NH2+]CC[C@H]2C)CC1 ZINC001246117251 987461202 /nfs/dbraw/zinc/46/12/02/987461202.db2.gz YPTWZPOORIRRSU-CEUNDQEZSA-N 2 0 224.392 2.400 20 0 BEADRP Cc1ccc(C[C@@H](C)[NH2+][C@H]2CCCNC2)cc1 ZINC001246121394 987466617 /nfs/dbraw/zinc/46/66/17/987466617.db2.gz YWSHWSBBCBUQGZ-HIFRSBDPSA-N 2 0 232.371 2.268 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@H]2C[NH2+]CC23CC3)C[C@@H]1C ZINC001246135232 987488408 /nfs/dbraw/zinc/48/84/08/987488408.db2.gz SYORIVJODBGVPE-VOAKCMCISA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C[C@@]2(F)CC[NH2+]C2)CC(C)(C)C1 ZINC001246142537 987499561 /nfs/dbraw/zinc/49/95/61/987499561.db2.gz IVEADAAXDLXMNB-YRGRVCCFSA-N 2 0 242.382 2.492 20 0 BEADRP CCC[C@@H](C)CC[C@H](C)[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001246147886 987503341 /nfs/dbraw/zinc/50/33/41/987503341.db2.gz LBHJASKSCWHGJJ-BJJPWKGXSA-N 2 0 224.392 2.399 20 0 BEADRP CC(C)C1CCC([NH2+][C@H]2[C@@H]3C[C@H]2C[NH2+]C3)CC1 ZINC001246145867 987503635 /nfs/dbraw/zinc/50/36/35/987503635.db2.gz FSFNMQOAUJFHCP-AFRBZQCXSA-N 2 0 236.403 2.399 20 0 BEADRP C[C@@H]1C[C@@H](n2c(C[NH3+])cc3ccccc32)CC[NH2+]1 ZINC001246164804 987526829 /nfs/dbraw/zinc/52/68/29/987526829.db2.gz BKOUPDQUXQWDBC-YPMHNXCESA-N 2 0 243.354 2.413 20 0 BEADRP Cn1c(C[NH2+]C2CC[NH2+]CC2)cc2ccccc21 ZINC001246165763 987529046 /nfs/dbraw/zinc/52/90/46/987529046.db2.gz LJSSUEXOQFTOBG-UHFFFAOYSA-N 2 0 243.354 2.020 20 0 BEADRP C[C@@H]1CC[C@@H](n2ccc3ccc(C[NH3+])cc32)C[NH2+]1 ZINC001246170268 987534701 /nfs/dbraw/zinc/53/47/01/987534701.db2.gz QOPBQKRCTRGDKD-BXUZGUMPSA-N 2 0 243.354 2.413 20 0 BEADRP [NH3+]Cc1cc2ccccc2n1C1CC[NH2+]CC1 ZINC001246168623 987534898 /nfs/dbraw/zinc/53/48/98/987534898.db2.gz YQQDMPCJKSATBZ-UHFFFAOYSA-N 2 0 229.327 2.025 20 0 BEADRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1cccc(N)c1 ZINC001246176295 987543437 /nfs/dbraw/zinc/54/34/37/987543437.db2.gz OKQYFQMWPONCNL-ZEIJEMSESA-N 2 0 245.370 2.202 20 0 BEADRP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1cccc(N)c1 ZINC001246176294 987544821 /nfs/dbraw/zinc/54/48/21/987544821.db2.gz OKQYFQMWPONCNL-FMVWZJFZSA-N 2 0 245.370 2.202 20 0 BEADRP Cc1ccc2c(c1)C[C@H]([NH2+]C[C@@H]1CCC[NH2+]1)CC2 ZINC001246187581 987566058 /nfs/dbraw/zinc/56/60/58/987566058.db2.gz CLIXUDFKXBMVTF-CVEARBPZSA-N 2 0 244.382 2.194 20 0 BEADRP CC(C)OCC[C@@H](C)[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC001246205367 987604155 /nfs/dbraw/zinc/60/41/55/987604155.db2.gz NNCUHMFVFCEZKN-JHJVBQTASA-N 2 0 228.380 2.050 20 0 BEADRP CC[C@@H](C)OCC[C@H](C)[NH2+]C[C@H]1CCC[NH2+]C1 ZINC001246216584 987612981 /nfs/dbraw/zinc/61/29/81/987612981.db2.gz OBJXNTOMAHAYRA-MJBXVCDLSA-N 2 0 242.407 2.169 20 0 BEADRP C[C@H]1C[C@H]([NH2+][C@H]2CC[C@@H]3CCC[C@@H]32)CC[NH2+]1 ZINC001246232774 987628967 /nfs/dbraw/zinc/62/89/67/987628967.db2.gz ZRSXQOGTKRSLIJ-HPCHECBXSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCc3ncccc32)CC[NH2+]1 ZINC001246231919 987630419 /nfs/dbraw/zinc/63/04/19/987630419.db2.gz UZPDONRNTVNOIL-LALPHHSUSA-N 2 0 245.370 2.189 20 0 BEADRP CC[C@@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)c1cccnc1 ZINC001246240655 987641126 /nfs/dbraw/zinc/64/11/26/987641126.db2.gz SSGUVKUBVZBWMC-MRVWCRGKSA-N 2 0 233.359 2.263 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)c1cccnc1 ZINC001246240653 987642534 /nfs/dbraw/zinc/64/25/34/987642534.db2.gz SSGUVKUBVZBWMC-BNOWGMLFSA-N 2 0 233.359 2.263 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]Cc2c[nH]c3ccccc23)CC[NH2+]1 ZINC001246242547 987644942 /nfs/dbraw/zinc/64/49/42/987644942.db2.gz FPVIWBYERNKEEG-AAEUAGOBSA-N 2 0 243.354 2.398 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)c1ccc(N)cc1 ZINC001246282253 987675907 /nfs/dbraw/zinc/67/59/07/987675907.db2.gz BCZHUSBJKRLQRR-UHIISALHSA-N 2 0 233.359 2.060 20 0 BEADRP Cc1cccc(C(=[NH2+])N[C@H]2CC[NH2+][C@@H](C)C2)c1 ZINC001246286350 987678395 /nfs/dbraw/zinc/67/83/95/987678395.db2.gz WVPHVKSNOFORRI-AAEUAGOBSA-N 2 0 231.343 2.050 20 0 BEADRP CCCOC1CCC([NH2+]CC[C@H](C)[NH3+])CC1 ZINC001246298840 987693188 /nfs/dbraw/zinc/69/31/88/987693188.db2.gz CKVPVPLYADXXKA-HIFPTAJRSA-N 2 0 228.380 2.051 20 0 BEADRP CC[NH+](CC)C1CC[NH+](C[C@H]2C[C@H]2C)CC1 ZINC001116758678 987697110 /nfs/dbraw/zinc/69/71/10/987697110.db2.gz YYDJJEUGVLXKNQ-CHWSQXEVSA-N 2 0 224.392 2.449 20 0 BEADRP CSC(C)(C)C[C@H](C)[NH2+]CC[C@H](C)[NH3+] ZINC001246303281 987700516 /nfs/dbraw/zinc/70/05/16/987700516.db2.gz GEIZCNLOXRXRDV-UWVGGRQHSA-N 2 0 218.410 2.234 20 0 BEADRP CC[C@H]([NH3+])CCNC1C[C@H](CC)[NH2+][C@@H](CC)C1 ZINC001246303941 987702070 /nfs/dbraw/zinc/70/20/70/987702070.db2.gz BMKGONXEVGHFFZ-AVGNSLFASA-N 2 0 241.423 2.013 20 0 BEADRP CC(C)OC1CCC([NH2+]CC[C@H](C)[NH3+])CC1 ZINC001246305089 987703083 /nfs/dbraw/zinc/70/30/83/987703083.db2.gz NEYNYQLKONDODQ-HIFPTAJRSA-N 2 0 228.380 2.050 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@H]1CCc2ccc(C)cc2C1 ZINC001246312044 987712476 /nfs/dbraw/zinc/71/24/76/987712476.db2.gz FAJQUJUFSYRORH-GJZGRUSLSA-N 2 0 232.371 2.179 20 0 BEADRP [NH3+]CCc1cc2ccccc2n1C1CC[NH2+]CC1 ZINC001246318479 987725352 /nfs/dbraw/zinc/72/53/52/987725352.db2.gz JWYFVLNPPOBWAQ-UHFFFAOYSA-N 2 0 243.354 2.067 20 0 BEADRP C[C@H]1CC[C@@H](n2ccc3cccc(C[NH3+])c32)C[NH2+]1 ZINC001246327684 987734995 /nfs/dbraw/zinc/73/49/95/987734995.db2.gz UFECQAPVCAIQLH-SMDDNHRTSA-N 2 0 243.354 2.413 20 0 BEADRP [NH3+]Cc1cccc2ccn([C@H]3CCC[NH2+]C3)c21 ZINC001246327831 987735579 /nfs/dbraw/zinc/73/55/79/987735579.db2.gz VWAXIOZOJHBTPY-ZDUSSCGKSA-N 2 0 229.327 2.025 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CC2(c3ccccc3)CC2)CC[NH2+]1 ZINC001246332554 987740116 /nfs/dbraw/zinc/74/01/16/987740116.db2.gz NHYSUHWANAFJHT-DZGCQCFKSA-N 2 0 244.382 2.448 20 0 BEADRP [NH3+][C@@]12CC[C@@]([NH2+][C@@H]3CCCSC3)(C1)CCC2 ZINC001246342212 987752144 /nfs/dbraw/zinc/75/21/44/987752144.db2.gz RXWHHFORLBICLW-FRRDWIJNSA-N 2 0 240.416 2.276 20 0 BEADRP Fc1cccc2c1C[C@H](N[C@@H]1CCC[NH2+]C1)CC2 ZINC001246357052 987765282 /nfs/dbraw/zinc/76/52/82/987765282.db2.gz IQEGGOJGVUSXOW-CHWSQXEVSA-N 2 0 248.345 2.025 20 0 BEADRP C[C@H]1C[C@@H]([NH2+][C@H]2CCc3ccccc3C2)CC[NH2+]1 ZINC001246363597 987770727 /nfs/dbraw/zinc/77/07/27/987770727.db2.gz KVBFWHLEHRSJIX-RCBQFDQVSA-N 2 0 244.382 2.274 20 0 BEADRP CCCC1([NH2+][C@@H]2CC[NH2+][C@H](C)C2)CCC1 ZINC001246390656 987778843 /nfs/dbraw/zinc/77/88/43/987778843.db2.gz YJWHDOPHOYMPIW-VXGBXAGGSA-N 2 0 210.365 2.439 20 0 BEADRP Cc1cnccc1[C@H]([NH2+]C1CC[NH2+]CC1)C1CC1 ZINC001246407444 987787197 /nfs/dbraw/zinc/78/71/97/987787197.db2.gz NZRBBGHODDUYAU-OAHLLOKOSA-N 2 0 245.370 2.183 20 0 BEADRP Cc1cnccc1[C@@H]([NH2+]C1CC[NH2+]CC1)C1CC1 ZINC001246407441 987788200 /nfs/dbraw/zinc/78/82/00/987788200.db2.gz NZRBBGHODDUYAU-HNNXBMFYSA-N 2 0 245.370 2.183 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@H]2C[C@H](SC)C2)CC1 ZINC001474651480 987792837 /nfs/dbraw/zinc/79/28/37/987792837.db2.gz QATHNQBDHZZVIA-JOCQHMNTSA-N 2 0 242.432 2.202 20 0 BEADRP CC(C)CCC[C@H](C)[NH2+][C@H]1CC12C[NH2+]C2 ZINC001246445427 987801598 /nfs/dbraw/zinc/80/15/98/987801598.db2.gz OCMBLVKOBNMREV-RYUDHWBXSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]1C[C@H]([NH2+][C@@H]2C[C@@H]3C[C@H]([C@@H]2C)C3(C)C)C[NH2+]1 ZINC001246443145 987801721 /nfs/dbraw/zinc/80/17/21/987801721.db2.gz LTWSPMIYQPPNNI-SNIKSBKOSA-N 2 0 236.403 2.397 20 0 BEADRP CC(C)CCC[C@@H](C)[NH2+][C@@H]1CC12C[NH2+]C2 ZINC001246445429 987802620 /nfs/dbraw/zinc/80/26/20/987802620.db2.gz OCMBLVKOBNMREV-VXGBXAGGSA-N 2 0 210.365 2.153 20 0 BEADRP CCCC[C@@H](CCC)[NH2+][C@@H]1CC12C[NH2+]C2 ZINC001246444279 987802731 /nfs/dbraw/zinc/80/27/31/987802731.db2.gz JUZZDLDQXSYVRS-VXGBXAGGSA-N 2 0 210.365 2.297 20 0 BEADRP FC(F)(F)[C@@H]1CCC[C@@H]([NH2+][C@@H]2CC23C[NH2+]C3)C1 ZINC001246445123 987803338 /nfs/dbraw/zinc/80/33/38/987803338.db2.gz MMLNMXZDVUMQPS-OPRDCNLKSA-N 2 0 248.292 2.059 20 0 BEADRP CC[C@@H](CC(C)C)[NH2+]CCC[NH2+]CCCC[NH3+] ZINC001246458047 987815464 /nfs/dbraw/zinc/81/54/64/987815464.db2.gz RJTVDFIHTUCKQI-AWEZNQCLSA-N 3 0 243.439 2.119 20 0 BEADRP C[NH2+][C@H]1C[C@H]([NH2+][C@@H]2CCCC(C)(C)C2)C1 ZINC001246462409 987822790 /nfs/dbraw/zinc/82/27/90/987822790.db2.gz RIPNTSIDBGPMJM-IJLUTSLNSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@@H]1CC[C@H](N[C@H]2CCc3sccc32)C[NH2+]1 ZINC001246478161 987834862 /nfs/dbraw/zinc/83/48/62/987834862.db2.gz LRROKOXPBVEPJQ-SCVCMEIPSA-N 2 0 236.384 2.466 20 0 BEADRP CC1(C)[C@@H]2C[C@@H]([NH2+][C@H]3CCCC[C@H]3[NH3+])C[C@@H]21 ZINC001246479249 987836803 /nfs/dbraw/zinc/83/68/03/987836803.db2.gz SONDHQYQMCNSNQ-LBELIVKGSA-N 2 0 222.376 2.281 20 0 BEADRP C[C@H](Cc1ccco1)[NH2+][C@H]1CCCC[C@H]1[NH3+] ZINC001246480373 987837964 /nfs/dbraw/zinc/83/79/64/987837964.db2.gz YQQCRVQSHGLUHW-RTXFEEFZSA-N 2 0 222.332 2.070 20 0 BEADRP CC(C)COCC[C@@H](C)[NH2+][C@H]1CCCC[C@H]1[NH3+] ZINC001246479222 987838578 /nfs/dbraw/zinc/83/85/78/987838578.db2.gz SKHRFOCPYIGUDC-MCIONIFRSA-N 2 0 242.407 2.297 20 0 BEADRP C[C@@H](Cc1ccco1)[NH2+][C@H]1CCCC[C@H]1[NH3+] ZINC001246480375 987839214 /nfs/dbraw/zinc/83/92/14/987839214.db2.gz YQQCRVQSHGLUHW-UHTWSYAYSA-N 2 0 222.332 2.070 20 0 BEADRP C[C@H]1CC[C@H](C)C1[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC001246495553 987849815 /nfs/dbraw/zinc/84/98/15/987849815.db2.gz QCNQNSWDRFOQGF-MSXOGSJSSA-N 2 0 222.376 2.294 20 0 BEADRP CC1(C)CC(C[NH2+][C@@H]2CCCC[NH2+]C2)C1 ZINC001246496173 987849978 /nfs/dbraw/zinc/84/99/78/987849978.db2.gz DCFWNGXHPQANRI-GFCCVEGCSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1CC[C@@H](C)C1[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC001246495556 987851658 /nfs/dbraw/zinc/85/16/58/987851658.db2.gz QCNQNSWDRFOQGF-PNKOWGENSA-N 2 0 222.376 2.294 20 0 BEADRP CCCC(C[NH3+])(CCC)N[C@H]1CC[C@H](C)[NH2+]C1 ZINC001246498770 987853510 /nfs/dbraw/zinc/85/35/10/987853510.db2.gz XOUHKXUOCHXUIF-STQMWFEESA-N 2 0 241.423 2.014 20 0 BEADRP [NH3+]C12CC([NH2+]C3CCCCCCC3)(C1)C2 ZINC001246499801 987854144 /nfs/dbraw/zinc/85/41/44/987854144.db2.gz FZKVULGGOBMVLV-UHFFFAOYSA-N 2 0 208.349 2.323 20 0 BEADRP CCCC(C[NH3+])(CCC)N[C@@H]1CC[C@@H](C)[NH2+]C1 ZINC001246498767 987854644 /nfs/dbraw/zinc/85/46/44/987854644.db2.gz XOUHKXUOCHXUIF-CHWSQXEVSA-N 2 0 241.423 2.014 20 0 BEADRP CCc1ccc(C[C@H](C)[NH2+]C23CC([NH3+])(C2)C3)cc1 ZINC001246500203 987857447 /nfs/dbraw/zinc/85/74/47/987857447.db2.gz GQLZOWYXVDKQNJ-JQRITLKVSA-N 2 0 244.382 2.403 20 0 BEADRP CCC[N@H+]([C@H](C)CC)[C@@H](C)CC[NH2+]C ZINC001246526793 987877942 /nfs/dbraw/zinc/87/79/42/987877942.db2.gz CRIXAFALJCJEMQ-NEPJUHHUSA-N 2 0 200.370 2.495 20 0 BEADRP C[C@@]1([NH3+])CC[N@@H+](C2CC(C)(C)OC(C)(C)C2)C1 ZINC001246532817 987891943 /nfs/dbraw/zinc/89/19/43/987891943.db2.gz YJNKFDHINZWTKE-CQSZACIVSA-N 2 0 240.391 2.146 20 0 BEADRP CCCCCC[C@H](C)[N@@H+]1CCO[C@@H](CC[NH3+])C1 ZINC001246536657 987893939 /nfs/dbraw/zinc/89/39/39/987893939.db2.gz VULAOWJBJXVVDT-KBPBESRZSA-N 2 0 242.407 2.395 20 0 BEADRP CCCCC[C@H](CC)[N@@H+]1CCO[C@H](CC[NH3+])C1 ZINC001246535693 987895494 /nfs/dbraw/zinc/89/54/94/987895494.db2.gz OTSUEILOINSQML-UONOGXRCSA-N 2 0 242.407 2.395 20 0 BEADRP CC[C@H](C)OCC[C@H](C)[N@@H+]1C[C@H](C)[C@H](C[NH3+])C1 ZINC001246538457 987896706 /nfs/dbraw/zinc/89/67/06/987896706.db2.gz CCUVMRDCXGJJMG-XDQVBPFNSA-N 2 0 242.407 2.107 20 0 BEADRP CC[C@@H]1CC[C@@H]([N@@H+]2CCC[C@@H]([NH3+])CC2)C1 ZINC001246539262 987901914 /nfs/dbraw/zinc/90/19/14/987901914.db2.gz GPBUZHPAQFDDKA-JHJVBQTASA-N 2 0 210.365 2.378 20 0 BEADRP Cc1cccc2c1CC[C@@H]([N@H+]1CC[C@@H]([NH3+])[C@H]1C)C2 ZINC001246542905 987910382 /nfs/dbraw/zinc/91/03/82/987910382.db2.gz MEHQNNZPAODHMQ-XNRPHZJLSA-N 2 0 244.382 2.274 20 0 BEADRP [NH3+]C[C@]1(F)CCC[N@@H+]([C@@H]2CCCSC2)CC1 ZINC001246551056 987948535 /nfs/dbraw/zinc/94/85/35/987948535.db2.gz OUDAKWATTAVEMW-NEPJUHHUSA-N 2 0 246.395 2.035 20 0 BEADRP CSCC[C@H](C)[N@@H+]1CCC[C@](C)([NH3+])CC1 ZINC001246552937 987952998 /nfs/dbraw/zinc/95/29/98/987952998.db2.gz QDXBDAMEBHOKGZ-RYUDHWBXSA-N 2 0 230.421 2.331 20 0 BEADRP CC(C)OCC[C@H](C)[N@@H+]1CCC[C@](C)([NH3+])CC1 ZINC001246552902 987953542 /nfs/dbraw/zinc/95/35/42/987953542.db2.gz QBZCPODKBJHSDY-KBPBESRZSA-N 2 0 242.407 2.393 20 0 BEADRP CCSC[C@H](C)[N@@H+]1CC[C@@H](C)[C@@H](C[NH3+])CC1 ZINC001246555736 987969284 /nfs/dbraw/zinc/96/92/84/987969284.db2.gz GAKMJGFCRLIZSJ-FRRDWIJNSA-N 2 0 244.448 2.435 20 0 BEADRP CSCC[C@H](C)[N@H+]1CC[C@@H](C[NH3+])[C@@H](C)CC1 ZINC001246555388 987970351 /nfs/dbraw/zinc/97/03/51/987970351.db2.gz DVSIYTSHRDEUAG-AVGNSLFASA-N 2 0 244.448 2.435 20 0 BEADRP CCSC[C@H](C)[N@@H+]1CCC[C@](C)([NH3+])CC1 ZINC001246556422 987971370 /nfs/dbraw/zinc/97/13/70/987971370.db2.gz ZRJCJXVVEBJJOO-RYUDHWBXSA-N 2 0 230.421 2.331 20 0 BEADRP CC[C@@H]1CC[C@@H]([N@@H+]2CCC(F)(F)[C@@H](C[NH3+])C2)C1 ZINC001246557583 987977600 /nfs/dbraw/zinc/97/76/00/987977600.db2.gz MIZWOROXXRCCCN-GRYCIOLGSA-N 2 0 246.345 2.481 20 0 BEADRP CCCC[C@H](C)[N@@H+]1CCC(F)(F)[C@@H](C[NH3+])C1 ZINC001246561636 987995358 /nfs/dbraw/zinc/99/53/58/987995358.db2.gz RLWGXQJROKCINW-QWRGUYRKSA-N 2 0 234.334 2.481 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2CC[C@H](C)C(F)(F)CC2)CC[NH2+]1 ZINC001246563958 988011522 /nfs/dbraw/zinc/01/15/22/988011522.db2.gz DMGBCWRJVBQELN-QJPTWQEYSA-N 2 0 246.345 2.494 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]CCCCOc1ccccc1 ZINC001118119608 988021474 /nfs/dbraw/zinc/02/14/74/988021474.db2.gz OJQHWXMBYDLWRC-CABCVRRESA-N 2 0 248.370 2.315 20 0 BEADRP C[C@H]1CCN([C@H]2CCC[NH2+]C2)CCC1(F)F ZINC001246569679 988049954 /nfs/dbraw/zinc/04/99/54/988049954.db2.gz RSFOLKJBXAYPHK-QWRGUYRKSA-N 2 0 232.318 2.106 20 0 BEADRP CCOCC[C@@H](C)[N@@H+]1CCC[C@](C)(C[NH3+])CC1 ZINC001246571260 988063213 /nfs/dbraw/zinc/06/32/13/988063213.db2.gz AREYRNVZLFEHKS-KGLIPLIRSA-N 2 0 242.407 2.252 20 0 BEADRP C[NH2+]CC[C@H](C)[N@@H+]1CCC[C@@H](C)[C@@H](C)C1 ZINC001246572963 988066492 /nfs/dbraw/zinc/06/64/92/988066492.db2.gz LNHDZFKQQNZENQ-AGIUHOORSA-N 2 0 212.381 2.352 20 0 BEADRP CCCc1ccc(C[N@@H+]2CC[C@H](C[NH3+])C2)cc1 ZINC001118196297 988087674 /nfs/dbraw/zinc/08/76/74/988087674.db2.gz AWIJTVKAABTWFF-OAHLLOKOSA-N 2 0 232.371 2.420 20 0 BEADRP C[C@H]1C[C@@H]([N@@H+]2CCC[C@](C)(C[NH3+])CC2)CCO1 ZINC001246579846 988102849 /nfs/dbraw/zinc/10/28/49/988102849.db2.gz LTSHHWBNKMLITL-IHRRRGAJSA-N 2 0 240.391 2.005 20 0 BEADRP CSCC[C@@H](C)[N@@H+]1CCCC[C@@H](C[NH3+])C1 ZINC001246580933 988111110 /nfs/dbraw/zinc/11/11/10/988111110.db2.gz JCAFOVJBKGDBBC-NEPJUHHUSA-N 2 0 230.421 2.189 20 0 BEADRP CC1(C)[C@@H]2C[C@H]([N@@H+]3CCCC[C@H](C[NH3+])C3)C[C@@H]21 ZINC001246584952 988136733 /nfs/dbraw/zinc/13/67/33/988136733.db2.gz XBBWFQLWPIYKRX-YIYPIFLZSA-N 2 0 236.403 2.482 20 0 BEADRP CCOCC[C@@H](C)[N@@H+]1CCCC[C@](C)(C[NH3+])C1 ZINC001246595229 988183814 /nfs/dbraw/zinc/18/38/14/988183814.db2.gz SHSOHVYPPUUEDK-ZIAGYGMSSA-N 2 0 242.407 2.252 20 0 BEADRP C[C@H]1C[C@H]([N@@H+]2CCC(F)(F)C(C)(C)C2)CC[NH2+]1 ZINC001246593980 988187716 /nfs/dbraw/zinc/18/77/16/988187716.db2.gz CNLSZIJHYAFXDO-WDEREUQCSA-N 2 0 246.345 2.494 20 0 BEADRP CCC1CCC([NH+]2CC(C[NH2+]C)C2)CC1 ZINC001246597014 988196402 /nfs/dbraw/zinc/19/64/02/988196402.db2.gz LDAAJUISBIXSAA-UHFFFAOYSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H](CC(F)(F)F)[NH+]1CCC(F)(C[NH3+])CC1 ZINC001246625924 988277758 /nfs/dbraw/zinc/27/77/58/988277758.db2.gz IOACIGVGLRJXJX-MRVPVSSYSA-N 2 0 242.260 2.090 20 0 BEADRP CC1(C)CCC([N@@H+]2CC[C@@H]3[NH2+]CC[C@H]32)CC1 ZINC001246632975 988320571 /nfs/dbraw/zinc/32/05/71/988320571.db2.gz IYGNCBYAKHJNOZ-QWHCGFSZSA-N 2 0 222.376 2.391 20 0 BEADRP CSC(C)(C)C[C@H](C)N1CC[C@@H]2[NH2+]CC[C@H]21 ZINC001246633296 988320706 /nfs/dbraw/zinc/32/07/06/988320706.db2.gz LFVDUOUSWVPBLZ-SDDRHHMPSA-N 2 0 242.432 2.343 20 0 BEADRP C[C@@H]1CC([N@@H+]2CC[C@H]3[NH2+]CC[C@H]32)C[C@@H](C)C1 ZINC001246637707 988324388 /nfs/dbraw/zinc/32/43/88/988324388.db2.gz ISDJJFXQPGHPOI-CDGCEXEKSA-N 2 0 222.376 2.247 20 0 BEADRP CC(C)CC[C@H](C)N1CC[C@@H]2CC[NH2+][C@@H]2C1 ZINC001246636053 988326764 /nfs/dbraw/zinc/32/67/64/988326764.db2.gz KSJMIFGNJKZOJT-MELADBBJSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H]1CC([N@@H+]2CC[C@H]3[NH2+]CC[C@H]32)C[C@H](C)C1 ZINC001246637709 988327189 /nfs/dbraw/zinc/32/71/89/988327189.db2.gz ISDJJFXQPGHPOI-HBJVGIJOSA-N 2 0 222.376 2.247 20 0 BEADRP CC1(C)CCC[C@@H]([N@@H+]2CC[C@H]3[NH2+]CC[C@H]32)C1 ZINC001246636373 988331080 /nfs/dbraw/zinc/33/10/80/988331080.db2.gz GLOOVYGWHCNHOJ-JHJVBQTASA-N 2 0 222.376 2.391 20 0 BEADRP C[C@H]1CCC[C@@H]([N@@H+]2CC[C@H]3[NH2+]CC[C@H]32)C1 ZINC001246636226 988332547 /nfs/dbraw/zinc/33/25/47/988332547.db2.gz FQPZPGIEUVFHPP-UMSGYPCISA-N 2 0 208.349 2.001 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2CC[C@H]3[NH2+]CC[C@H]32)C[C@@H]1C ZINC001246642100 988351744 /nfs/dbraw/zinc/35/17/44/988351744.db2.gz ZEYVORMFGNMNBC-MBJXGIAVSA-N 2 0 222.376 2.247 20 0 BEADRP CC1(C)CCC([N@@H+]2CC[C@H]3C[NH2+]C[C@H]32)CC1 ZINC001246644593 988353870 /nfs/dbraw/zinc/35/38/70/988353870.db2.gz IIJGHTBYKFXEIO-WCQYABFASA-N 2 0 222.376 2.249 20 0 BEADRP C1[C@@H]2C[C@H]([N@@H+]3CCCC[C@]34CC[NH2+]C4)C[C@H]12 ZINC001246645854 988360746 /nfs/dbraw/zinc/36/07/46/988360746.db2.gz WSKZRICTSLUXDG-ZOBORPQBSA-N 2 0 220.360 2.003 20 0 BEADRP CC1(C)CCC[C@@H]([N@@H+]2CC[C@H]3C[NH2+]C[C@H]32)C1 ZINC001246647545 988363027 /nfs/dbraw/zinc/36/30/27/988363027.db2.gz SUBPBCFTRDAKIZ-YNEHKIRRSA-N 2 0 222.376 2.249 20 0 BEADRP CC1(C)CCC[C@H]([N@@H+]2CC[C@H]3C[NH2+]C[C@H]32)C1 ZINC001246647544 988366388 /nfs/dbraw/zinc/36/63/88/988366388.db2.gz SUBPBCFTRDAKIZ-RWMBFGLXSA-N 2 0 222.376 2.249 20 0 BEADRP CC[C@H](C[C@@H](C)CC)[N@@H+]1C[C@@H]2CC[NH2+][C@@H]2C1 ZINC001246653440 988378071 /nfs/dbraw/zinc/37/80/71/988378071.db2.gz SZABWMCKKATUHC-IGQOVBAYSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1CC[C@@H]([N@H+]2C[C@H]3[C@H](CCC3(F)F)C2)C[NH2+]1 ZINC001246654514 988381363 /nfs/dbraw/zinc/38/13/63/988381363.db2.gz ICSDDTWLEVWPPT-KKOKHZNYSA-N 2 0 244.329 2.104 20 0 BEADRP C[C@H]1C[C@H]([N@H+]2C[C@H]3[C@H](CCC3(F)F)C2)CC[NH2+]1 ZINC001246656402 988383111 /nfs/dbraw/zinc/38/31/11/988383111.db2.gz NOJKRZHMJRVRJY-QCNOEVLYSA-N 2 0 244.329 2.104 20 0 BEADRP CC(C)C1CCC([N@@H+]2C[C@H]3CC[NH2+]C[C@H]32)CC1 ZINC001246661577 988400817 /nfs/dbraw/zinc/40/08/17/988400817.db2.gz GQISEUHXQOQMNO-HXSCFSKGSA-N 2 0 236.403 2.495 20 0 BEADRP CCCCCC[C@H](C)[N@H+]1C[C@@H]2[C@H]([NH3+])[C@@H]2C1 ZINC001246665873 988403435 /nfs/dbraw/zinc/40/34/35/988403435.db2.gz UWBIDIIGXDPMIA-RVMXOQNASA-N 2 0 210.365 2.234 20 0 BEADRP CCCCCC[C@@H](C)[N@H+]1C[C@@H]2[C@H]([NH3+])[C@@H]2C1 ZINC001246665871 988405306 /nfs/dbraw/zinc/40/53/06/988405306.db2.gz UWBIDIIGXDPMIA-FVCCEPFGSA-N 2 0 210.365 2.234 20 0 BEADRP C[C@H]1C[C@H]([N@@H+]2C[C@H]3CC[NH2+]C[C@H]32)CC(C)(C)C1 ZINC001246666986 988408826 /nfs/dbraw/zinc/40/88/26/988408826.db2.gz WPTVHIXJEFJZDV-RFQIPJPRSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@H]1C[C@@H]([N@@H+]2C[C@H]3CC[NH2+]C[C@H]32)CC(C)(C)C1 ZINC001246666985 988409870 /nfs/dbraw/zinc/40/98/70/988409870.db2.gz WPTVHIXJEFJZDV-REWJHTLYSA-N 2 0 236.403 2.495 20 0 BEADRP CC(C)CCC[C@H](C)[N@@H+]1C[C@@H]2C[NH2+]CC[C@H]21 ZINC001246669875 988412839 /nfs/dbraw/zinc/41/28/39/988412839.db2.gz CFOHPPNMUVQRHY-MELADBBJSA-N 2 0 224.392 2.495 20 0 BEADRP CC(C)CC(CC(C)C)[N@H+]1C[C@@H]2[C@H]([NH3+])[C@@H]2C1 ZINC001246667246 988412912 /nfs/dbraw/zinc/41/29/12/988412912.db2.gz YRHLZTICZOHNDD-BTTYYORXSA-N 2 0 224.392 2.336 20 0 BEADRP CC(C)CC[C@@H](C)[N@@H+]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC001246671378 988415836 /nfs/dbraw/zinc/41/58/36/988415836.db2.gz ZWPXSKYPFDUOFG-MGPQQGTHSA-N 2 0 224.392 2.352 20 0 BEADRP CC(C)C1CCC([N@@H+]2C[C@H]3C[NH2+]CC[C@@H]32)CC1 ZINC001246677669 988419776 /nfs/dbraw/zinc/41/97/76/988419776.db2.gz WWEBOSCGNKFHHB-JYVUQVBGSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@@H]1CC[C@H]([N@H+]2C[C@H]3CC[C@@H](C2)[C@@H]3[NH3+])C[C@@H]1C ZINC001246841221 988549408 /nfs/dbraw/zinc/54/94/08/988549408.db2.gz NAUFFWJWDCPYLB-BYGOPZEFSA-N 2 0 236.403 2.480 20 0 BEADRP C[C@@H]1C[C@@H]([N@H+](C)C[C@H]2CC2(C)C)CC[NH2+]1 ZINC001246846180 988554183 /nfs/dbraw/zinc/55/41/83/988554183.db2.gz NDDBSKYPKCPMMD-UTUOFQBUSA-N 2 0 210.365 2.105 20 0 BEADRP CCCC(CCC)[N@H+]1C[C@H]2C[NH2+]CC[C@@H]2C1 ZINC001246846426 988558391 /nfs/dbraw/zinc/55/83/91/988558391.db2.gz NPDAZVZRNKDCEM-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP CC1(C)CCC[C@H]([N@@H+]2C[C@@H]3CC[C@@]3([NH3+])C2)C1 ZINC001246857032 988579884 /nfs/dbraw/zinc/57/98/84/988579884.db2.gz ZBAXGEYHZXYKBB-SGMGOOAPSA-N 2 0 222.376 2.378 20 0 BEADRP Cc1ccc(C[C@H](C)[N@@H+]2C[C@@H]3CC[C@@]3([NH3+])C2)cc1 ZINC001246858704 988584885 /nfs/dbraw/zinc/58/48/85/988584885.db2.gz HYAVMZRXHBILKG-CWRNSKLLSA-N 2 0 244.382 2.349 20 0 BEADRP C[C@H]1C[C@H](N2CCc3c(F)cccc3C2)CC[NH2+]1 ZINC001246863557 988610304 /nfs/dbraw/zinc/61/03/04/988610304.db2.gz QPRLIPPBQSKXJZ-WCQYABFASA-N 2 0 248.345 2.324 20 0 BEADRP CCC[N@H+](C1CCOCC1)[C@H]1CC[NH2+][C@@H](C)C1 ZINC001246900259 988676748 /nfs/dbraw/zinc/67/67/48/988676748.db2.gz UOTJSRDMYYEVPC-JSGCOSHPSA-N 2 0 240.391 2.018 20 0 BEADRP NC[C@H]1CCC[N@@H+]1[C@H]1CCc2cc(F)ccc2C1 ZINC001246907670 988691021 /nfs/dbraw/zinc/69/10/21/988691021.db2.gz HFPXDZHPJFQWAY-LSDHHAIUSA-N 2 0 248.345 2.106 20 0 BEADRP CCC[N@H+](CC(C)C)[C@H]1CSC2(C[NH2+]C2)C1 ZINC001246911219 988697396 /nfs/dbraw/zinc/69/73/96/988697396.db2.gz OIIAVQFDHUTTLZ-GFCCVEGCSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H]1CCC[C@@H]([N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)C1 ZINC001246928723 988754633 /nfs/dbraw/zinc/75/46/33/988754633.db2.gz BTMCBCPGVNNINB-APIJFGDWSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H](CC1CC1)[N@H+]1C[C@@H]2CC[NH2+]CC[C@@H]2C1 ZINC001246930516 988764096 /nfs/dbraw/zinc/76/40/96/988764096.db2.gz JSQIQHIYWSYDFS-FPMFFAJLSA-N 2 0 222.376 2.106 20 0 BEADRP C[C@H](Cc1ccco1)[N@H+]1C[C@@H]2CC[NH2+]CC[C@@H]2C1 ZINC001246936816 988769917 /nfs/dbraw/zinc/76/99/17/988769917.db2.gz XRPDLRIJLABAHP-MCIONIFRSA-N 2 0 248.370 2.142 20 0 BEADRP CCCCC[C@@H](C)[N@H+](C)[C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001246947138 988780703 /nfs/dbraw/zinc/78/07/03/988780703.db2.gz IXEKUNBXOAJZGW-NDBYEHHHSA-N 2 0 210.365 2.105 20 0 BEADRP CC(C)[N@H+](C1CCOCC1)[C@@H]1CC[NH2+][C@@H](C)C1 ZINC001246985032 988813711 /nfs/dbraw/zinc/81/37/11/988813711.db2.gz ORVSEZFBDKAZBN-GXTWGEPZSA-N 2 0 240.391 2.016 20 0 BEADRP CCCCC[C@@H](CCC)[N@H+]1C[C@@H](OC)[C@@H](N)C1 ZINC001246983502 988815361 /nfs/dbraw/zinc/81/53/61/988815361.db2.gz SMWBDHIOFFWJKB-HZSPNIEDSA-N 2 0 242.407 2.393 20 0 BEADRP CO[C@@H]1C[N@@H+]([C@@H](C)C[C@@H](C)CC(C)C)C[C@@H]1N ZINC001246983889 988815501 /nfs/dbraw/zinc/81/55/01/988815501.db2.gz VTJDXDOLENTBCH-XDQVBPFNSA-N 2 0 242.407 2.105 20 0 BEADRP C[NH+](C)C1(CNc2cc[nH+]cc2)CCCCC1 ZINC001515206281 989000104 /nfs/dbraw/zinc/00/01/04/989000104.db2.gz TXVSVCMSXKPBMB-UHFFFAOYSA-N 2 0 233.359 2.180 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]C[C@H](C)CC(C)C ZINC001325267219 989136302 /nfs/dbraw/zinc/13/63/02/989136302.db2.gz KHAAIIFBUXMTCU-VXGBXAGGSA-N 2 0 200.370 2.256 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]Cc1cccc2cnccc21 ZINC001325624282 989218550 /nfs/dbraw/zinc/21/85/50/989218550.db2.gz CXDRJQJXDHGGAB-GFCCVEGCSA-N 2 0 243.354 2.322 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]CC(C)(C)c1ccccc1 ZINC001325625446 989218759 /nfs/dbraw/zinc/21/87/59/989218759.db2.gz KSHMUCBXRJPKNB-ZDUSSCGKSA-N 2 0 234.387 2.409 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H]1CCC[C@@H](C)[C@H]1C ZINC001325741760 989247096 /nfs/dbraw/zinc/24/70/96/989247096.db2.gz MLHCKWDZUWVDSP-FDYHWXHSSA-N 2 0 212.381 2.399 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H]1C[C@@H](OC(C)C)C1(C)C ZINC001325744818 989247514 /nfs/dbraw/zinc/24/75/14/989247514.db2.gz VLUVJVCFFQDBJZ-FRRDWIJNSA-N 2 0 242.407 2.166 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H](C)c1cccc(OC)c1 ZINC001325742688 989249238 /nfs/dbraw/zinc/24/92/38/989249238.db2.gz GKLUOIIULGTJPC-NEPJUHHUSA-N 2 0 236.359 2.344 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]Cc1ccnc2ccccc12 ZINC001326076548 989365634 /nfs/dbraw/zinc/36/56/34/989365634.db2.gz ONVTWDVRNCRTOE-LBPRGKRZSA-N 2 0 243.354 2.322 20 0 BEADRP CCC(=O)CC[N@@H+](C)[C@@H]1CCN(CC)C[C@H]1C ZINC001326304744 989473603 /nfs/dbraw/zinc/47/36/03/989473603.db2.gz GJXZPDCBOJTADB-TZMCWYRMSA-N 2 0 240.391 2.018 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]C1(C)CC1 ZINC001326459537 989569119 /nfs/dbraw/zinc/56/91/19/989569119.db2.gz RGPXPIUZLMRXRD-JTQLQIEISA-N 2 0 219.332 2.052 20 0 BEADRP CC1(C)CCC[N@H+](CCNc2cc[nH+]cc2)C1 ZINC001120779930 989878050 /nfs/dbraw/zinc/87/80/50/989878050.db2.gz RZRHOQGKWNUHCC-UHFFFAOYSA-N 2 0 233.359 2.037 20 0 BEADRP CCC1([NH+](C)C)CCN(c2cc[nH+]cc2)CC1 ZINC001120866235 989933676 /nfs/dbraw/zinc/93/36/76/989933676.db2.gz FLXIDOLSMOBRKV-UHFFFAOYSA-N 2 0 233.359 2.392 20 0 BEADRP C[N@@H+]1CCCC[C@@H]1CNc1cc[nH+]cc1C1CC1 ZINC001120884892 989946316 /nfs/dbraw/zinc/94/63/16/989946316.db2.gz RZIMCDOIFMUIJW-CYBMUJFWSA-N 2 0 245.370 2.277 20 0 BEADRP CCC(CC)C[NH2+][C@@H]1CC[C@H]2C[N@H+](C)C[C@H]21 ZINC001308554267 991036400 /nfs/dbraw/zinc/03/64/00/991036400.db2.gz NPJMDGMEQZUKHS-BFHYXJOUSA-N 2 0 224.392 2.352 20 0 BEADRP CCC(CC)C[NH2+][C@@H]1CC[C@@H]2C[N@H+](C)C[C@@H]12 ZINC001308554270 991036716 /nfs/dbraw/zinc/03/67/16/991036716.db2.gz NPJMDGMEQZUKHS-MGPQQGTHSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1CC([NH2+]CCSCC[NH3+])C[C@@H](C)C1 ZINC001258157114 991041441 /nfs/dbraw/zinc/04/14/41/991041441.db2.gz ZNDATSREOMRAKY-QWRGUYRKSA-N 2 0 230.421 2.093 20 0 BEADRP C[C@H](Cc1ccco1)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001258176203 991074748 /nfs/dbraw/zinc/07/47/48/991074748.db2.gz MRJOUFIMPYYTRA-YIYPIFLZSA-N 2 0 248.370 2.425 20 0 BEADRP C[C@H](Cc1ccco1)[NH2+]C(C)(C)C(C)(C)[NH3+] ZINC001258181032 991082930 /nfs/dbraw/zinc/08/29/30/991082930.db2.gz HPZLZGUOYZZILU-SNVBAGLBSA-N 2 0 224.348 2.316 20 0 BEADRP CC1(C[NH3+])CN(Cc2ccc(C3CC3)cc2)C1 ZINC001206729735 991103350 /nfs/dbraw/zinc/10/33/50/991103350.db2.gz IWOLFFKDZUECMX-UHFFFAOYSA-N 2 0 230.355 2.345 20 0 BEADRP CSCC[C@@H](C)[NH+]1CCC([NH+](C)C)CC1 ZINC001258212759 991131600 /nfs/dbraw/zinc/13/16/00/991131600.db2.gz IJISTXCIESGAHX-LLVKDONJSA-N 2 0 230.421 2.154 20 0 BEADRP CSCC[C@@H](C)[NH+]1CCC(C[NH+](C)C)CC1 ZINC001258219983 991142427 /nfs/dbraw/zinc/14/24/27/991142427.db2.gz NFMPVOWEPXEXLU-GFCCVEGCSA-N 2 0 244.448 2.402 20 0 BEADRP CC[N@H+]1C[C@@H]2C[NH+]([C@@H](C)CCSC)C[C@@H]2C1 ZINC001258227857 991168609 /nfs/dbraw/zinc/16/86/09/991168609.db2.gz HJKDKHDJTTUUIG-RWMBFGLXSA-N 2 0 242.432 2.012 20 0 BEADRP [NH2+]=C(NC1CCCCCCC1)SCC[NH3+] ZINC001258234349 991170850 /nfs/dbraw/zinc/17/08/50/991170850.db2.gz VMNZPWLEZUPLLL-UHFFFAOYSA-N 2 0 229.393 2.316 20 0 BEADRP CC1(C)CCC[C@@H]([NH2+][C@@H]2CCC[C@@H]2[NH3+])C1 ZINC001258284152 991216820 /nfs/dbraw/zinc/21/68/20/991216820.db2.gz ZWHXIBXPCWVCQJ-GRYCIOLGSA-N 2 0 210.365 2.425 20 0 BEADRP CC(C)C[C@@H](C)[NH2+]C[C@H]1C[NH+]2CCC1CC2 ZINC001308966004 991230589 /nfs/dbraw/zinc/23/05/89/991230589.db2.gz KVGCQIDOJIZXCI-OCCSQVGLSA-N 2 0 224.392 2.352 20 0 BEADRP CSC(C)(C)C[C@H](C)[NH2+]C(C)(C)C[NH3+] ZINC001258314572 991239429 /nfs/dbraw/zinc/23/94/29/991239429.db2.gz FVVXQMJCRAMYNH-VIFPVBQESA-N 2 0 218.410 2.234 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[N@H+](C)C[C@H]12)C1CCCC1 ZINC001308983263 991246299 /nfs/dbraw/zinc/24/62/99/991246299.db2.gz BVPJGNMQJYRLQU-PMOUVXMZSA-N 2 0 236.403 2.495 20 0 BEADRP CSC(C)(C)C[C@H](C)[N@@H+]1CCC[C@H]([NH3+])C1 ZINC001258321845 991247582 /nfs/dbraw/zinc/24/75/82/991247582.db2.gz RYQNWXGVYYURQU-QWRGUYRKSA-N 2 0 230.421 2.330 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[N@H+](C)C[C@@H]21)C1CCCC1 ZINC001308983262 991251363 /nfs/dbraw/zinc/25/13/63/991251363.db2.gz BVPJGNMQJYRLQU-CYUUQNCZSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@H](CC1CC1)[N@H+](C)CC1CC[NH+](C)CC1 ZINC001258461666 991417518 /nfs/dbraw/zinc/41/75/18/991417518.db2.gz DOXJPCONKMEFCS-GFCCVEGCSA-N 2 0 224.392 2.449 20 0 BEADRP C[NH+](C)C[C@@]12C[C@@H]1C[N@@H+]([C@@H]1CCC(C)(C)C1)C2 ZINC001258607580 991523397 /nfs/dbraw/zinc/52/33/97/991523397.db2.gz LYVJVFYTOJGFSM-UMVBOHGHSA-N 2 0 236.403 2.449 20 0 BEADRP CCC[N@H+](CCC[NH3+])[C@H](C)Cc1cccnc1 ZINC001258613670 991542240 /nfs/dbraw/zinc/54/22/40/991542240.db2.gz VWDUMXITXPBLRA-CYBMUJFWSA-N 2 0 235.375 2.073 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)[C@H](C)Cc1cccnc1 ZINC001258632242 991577630 /nfs/dbraw/zinc/57/76/30/991577630.db2.gz WZBRXNCNBNDSCF-CQSZACIVSA-N 2 0 249.402 2.286 20 0 BEADRP CC1(C)CC([NH2+]C[C@H]2C[NH+]3CCC2CC3)C1 ZINC001561034223 991692742 /nfs/dbraw/zinc/69/27/42/991692742.db2.gz KJYAJIUGJPDKTB-LBPRGKRZSA-N 2 0 222.376 2.106 20 0 BEADRP CCC[NH+]1CCC([NH2+]C2(COC)CCC2)CC1 ZINC001258766393 991724458 /nfs/dbraw/zinc/72/44/58/991724458.db2.gz UDAYDMFURJCUMH-UHFFFAOYSA-N 2 0 240.391 2.020 20 0 BEADRP CC(C)C1CCC(NC(=[NH2+])SCC[NH3+])CC1 ZINC001258799505 991796726 /nfs/dbraw/zinc/79/67/26/991796726.db2.gz WQOAWMJFHWTNIO-UHFFFAOYSA-N 2 0 243.420 2.417 20 0 BEADRP CC[C@@H](Cc1ccccc1)[NH2+]C1CC([NH3+])C1 ZINC001258840554 991871148 /nfs/dbraw/zinc/87/11/48/991871148.db2.gz WAYPXCFROKJCCB-MOKVOYLWSA-N 2 0 218.344 2.087 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H]1C[C@@H]1C ZINC001258898444 991886799 /nfs/dbraw/zinc/88/67/99/991886799.db2.gz XLLBLCWRAPAHDJ-RWMBFGLXSA-N 2 0 212.381 2.495 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)n1ccc(C[NH3+])n1 ZINC001258898699 991893765 /nfs/dbraw/zinc/89/37/65/991893765.db2.gz PGLAQYUHGPILRO-LBPRGKRZSA-N 2 0 238.379 2.025 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@]1(C)CCOC1 ZINC001258904893 991893892 /nfs/dbraw/zinc/89/38/92/991893892.db2.gz MNBSTKUKSMZHOX-ZIAGYGMSSA-N 2 0 242.407 2.266 20 0 BEADRP CCC[C@@H](CO)[NH2+][C@@H](C)CCC[NH+](CC)CC ZINC001258900488 991893926 /nfs/dbraw/zinc/89/39/26/991893926.db2.gz NIXJPYREFUOBAA-KBPBESRZSA-N 2 0 244.423 2.248 20 0 BEADRP CCC[C@H](CO)[NH2+][C@H](C)CCC[NH+](CC)CC ZINC001258900496 991894548 /nfs/dbraw/zinc/89/45/48/991894548.db2.gz NIXJPYREFUOBAA-ZIAGYGMSSA-N 2 0 244.423 2.248 20 0 BEADRP CCC[C@H](CO)[NH2+][C@@H](C)CCC[NH+](CC)CC ZINC001258900490 991896200 /nfs/dbraw/zinc/89/62/00/991896200.db2.gz NIXJPYREFUOBAA-UONOGXRCSA-N 2 0 244.423 2.248 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+]CC[C@@H](C)CO ZINC001258903587 991896421 /nfs/dbraw/zinc/89/64/21/991896421.db2.gz UYGKWKLSNNNUIU-KGLIPLIRSA-N 2 0 244.423 2.105 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[N@H+](C)C[C@H](C)C[NH3+] ZINC001258902843 991896727 /nfs/dbraw/zinc/89/67/27/991896727.db2.gz HEMQRVDPJUXSNB-KGLIPLIRSA-N 2 0 243.439 2.024 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCCOCC1 ZINC001258906853 991897122 /nfs/dbraw/zinc/89/71/22/991897122.db2.gz BKDQHJAVXPMSKU-CQSZACIVSA-N 2 0 242.407 2.219 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H](C)CSC(C)(C)C ZINC001261423964 992297508 /nfs/dbraw/zinc/29/75/08/992297508.db2.gz JWQXYUOJQMHRRU-GHMZBOCLSA-N 2 0 232.437 2.494 20 0 BEADRP C[C@H](CC[NH3+])[NH2+]Cc1ccccc1N1CCCC1 ZINC001261370236 992277926 /nfs/dbraw/zinc/27/79/26/992277926.db2.gz CMWVOQGBLUARLZ-CYBMUJFWSA-N 2 0 247.386 2.114 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H]1CCc2cc(C)ccc21 ZINC001261423937 992292744 /nfs/dbraw/zinc/29/27/44/992292744.db2.gz JBEAKDVOAZDMPV-WFASDCNBSA-N 2 0 232.371 2.427 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H]1CCC[C@H]1CCCF ZINC001261423749 992296251 /nfs/dbraw/zinc/29/62/51/992296251.db2.gz CWHNTIHFJDETFL-FRRDWIJNSA-N 2 0 230.371 2.492 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001261490129 992338623 /nfs/dbraw/zinc/33/86/23/992338623.db2.gz MLVOSMUHZXZGNF-ZDUSSCGKSA-N 2 0 224.392 2.498 20 0 BEADRP C[NH+]1CCC(CC[NH2+]C2CC(C(F)F)C2)CC1 ZINC001321230286 992496703 /nfs/dbraw/zinc/49/67/03/992496703.db2.gz ZPFBKFGBCMTKOF-UHFFFAOYSA-N 2 0 246.345 2.352 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@H]([NH2+][C@@H]3CC[C@@H]3C3CC3)[C@H]2C1 ZINC001474756471 992511298 /nfs/dbraw/zinc/51/12/98/992511298.db2.gz GSWPMXFINWBMHY-ZQNQSHIBSA-N 2 0 234.387 2.105 20 0 BEADRP [NH3+]C1CC[NH+](C[C@H]2C[C@H]2c2ccccc2)CC1 ZINC001574271018 992836759 /nfs/dbraw/zinc/83/67/59/992836759.db2.gz WTAYFLBGPOKORW-HIFRSBDPSA-N 2 0 230.355 2.213 20 0 BEADRP C[C@@H]1CC[N@H+](CC2CC[NH+](C)CC2)C[C@@H]1F ZINC001262365148 992861295 /nfs/dbraw/zinc/86/12/95/992861295.db2.gz SWWBETSVDJVKFP-YPMHNXCESA-N 2 0 228.355 2.008 20 0 BEADRP C1=CO[C@@H](C[NH2+]CC[C@H]2CCC[NH2+]CC2)CC1 ZINC001574774409 992899820 /nfs/dbraw/zinc/89/98/20/992899820.db2.gz MRMWSWXFTIDJJW-UONOGXRCSA-N 2 0 238.375 2.049 20 0 BEADRP C(C[N@@H+]1CC[C@H](C2CCC2)C1)[C@H]1CC[NH2+]C1 ZINC001574773962 992900091 /nfs/dbraw/zinc/90/00/91/992900091.db2.gz HNPIXMNJYDCNHK-OCCSQVGLSA-N 2 0 222.376 2.108 20 0 BEADRP C(C[N@H+](CC1CC1)C1CCC1)[C@@H]1CC[NH2+]C1 ZINC001574774811 992904451 /nfs/dbraw/zinc/90/44/51/992904451.db2.gz QLIACTVQCZTVGE-LBPRGKRZSA-N 2 0 222.376 2.251 20 0 BEADRP C([NH2+][C@@H]1CCCC12CC2)[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC001574794244 992906019 /nfs/dbraw/zinc/90/60/19/992906019.db2.gz BUJGCCJDMJJIGP-XJFOESAGSA-N 2 0 234.387 2.439 20 0 BEADRP C([N@@H+]1CCCC2(CCCC2)C1)[C@@]12C[C@@H]1C[NH2+]C2 ZINC001574800995 992913444 /nfs/dbraw/zinc/91/34/44/992913444.db2.gz MNRVDVBYTJRKHZ-HIFRSBDPSA-N 2 0 234.387 2.252 20 0 BEADRP C([NH2+][C@@H]1C[C@@H]2CCC[C@H]12)[C@@H]1CCCCC[NH2+]1 ZINC001574801585 992914475 /nfs/dbraw/zinc/91/44/75/992914475.db2.gz RWULSPXAYGAETO-XDQVBPFNSA-N 2 0 222.376 2.297 20 0 BEADRP C([NH2+][C@]12CCC[C@H]1[NH2+]CC2)C1CCSCC1 ZINC001574816229 992916506 /nfs/dbraw/zinc/91/65/06/992916506.db2.gz BHBNTHIFVQDGAY-OLZOCXBDSA-N 2 0 240.416 2.004 20 0 BEADRP CC(C)(C)O[C@H]1C[C@H]([NH2+][C@@H]2CCC[C@H]([NH3+])C2)C1 ZINC001575254125 993000116 /nfs/dbraw/zinc/00/01/16/993000116.db2.gz YSOWSHOVAXULDE-RNJOBUHISA-N 2 0 240.391 2.192 20 0 BEADRP CC(C)(C[NH3+])[NH2+]CCSCc1ccccc1 ZINC001575318242 993011338 /nfs/dbraw/zinc/01/13/38/993011338.db2.gz POTPLOSRTRURMW-UHFFFAOYSA-N 2 0 238.400 2.247 20 0 BEADRP C[NH+](C)[C@H]1CCCN(c2cc[nH+]cc2)CC1 ZINC001262671688 993012222 /nfs/dbraw/zinc/01/22/22/993012222.db2.gz PFFDJTPBZDAPKA-LBPRGKRZSA-N 2 0 219.332 2.002 20 0 BEADRP CC(C)([NH3+])C[NH2+][C@@H]1CC[C@H]2CCC[C@@H]2C1 ZINC001575357675 993014444 /nfs/dbraw/zinc/01/44/44/993014444.db2.gz DTVBBEXJTBGQPG-IJLUTSLNSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)(C[NH2+][C@@H]1C[C@@H]([NH3+])C1(C)C)C1CC1 ZINC001575334957 993014559 /nfs/dbraw/zinc/01/45/59/993014559.db2.gz WLJALPAQBGFRQQ-GHMZBOCLSA-N 2 0 210.365 2.138 20 0 BEADRP CC(C)(C[NH2+]C[C@@H]1CCC[NH2+]C1)C(F)(F)F ZINC001575334162 993015284 /nfs/dbraw/zinc/01/52/84/993015284.db2.gz DSXOAXNJGSHHGA-SECBINFHSA-N 2 0 238.297 2.164 20 0 BEADRP CC(C)([NH3+])CC[NH2+]Cc1nccc2c1CCCC2 ZINC001575354159 993019483 /nfs/dbraw/zinc/01/94/83/993019483.db2.gz GYTNZFJSQLYASU-UHFFFAOYSA-N 2 0 247.386 2.177 20 0 BEADRP CC(C)C[C@@H]1C[C@H]1[NH2+][C@H]1C[C@H]([NH3+])C1(C)C ZINC001575633499 993087516 /nfs/dbraw/zinc/08/75/16/993087516.db2.gz BMHFOVHSGNRHMO-WYUUTHIRSA-N 2 0 210.365 2.136 20 0 BEADRP CC(C)Cc1ccc(C[NH2+][C@H](C)CC[NH3+])cn1 ZINC001575656092 993092526 /nfs/dbraw/zinc/09/25/26/993092526.db2.gz UTSJBWJDFQJHOH-GFCCVEGCSA-N 2 0 235.375 2.107 20 0 BEADRP CC(C)OC1(C[NH2+][C@@H]2C[C@@H]([NH3+])C2(C)C)CCC1 ZINC001575748632 993103712 /nfs/dbraw/zinc/10/37/12/993103712.db2.gz BZNRJZILKCYSFC-VXGBXAGGSA-N 2 0 240.391 2.050 20 0 BEADRP CC(C)[C@@H]1C[C@H]1[NH2+][C@@H](C)C[C@H]1CCC[NH2+]1 ZINC001575940769 993132822 /nfs/dbraw/zinc/13/28/22/993132822.db2.gz BKZFWEHUVKPEIN-QNWHQSFQSA-N 2 0 210.365 2.151 20 0 BEADRP C[C@H](C[NH2+]CCOCCC[NH3+])C1CCCCC1 ZINC001576033861 993163127 /nfs/dbraw/zinc/16/31/27/993163127.db2.gz XDAJXPSCKIRCEO-CYBMUJFWSA-N 2 0 242.407 2.158 20 0 BEADRP C[C@@H](Cc1ccc(O)cc1)[NH2+]CCC(C)(C)[NH3+] ZINC001576052113 993167505 /nfs/dbraw/zinc/16/75/05/993167505.db2.gz GWBCEKMEIMJLHS-NSHDSACASA-N 2 0 236.359 2.040 20 0 BEADRP C[C@@H]1CCC[C@@H]([N@@H+]2CCC[C@@H]([NH3+])CC2)C1 ZINC000378665199 993198699 /nfs/dbraw/zinc/19/86/99/993198699.db2.gz FQECACHFXDOELQ-JHJVBQTASA-N 2 0 210.365 2.378 20 0 BEADRP C[C@H]([NH2+][C@H]1C[C@@H]([NH3+])C1(C)C)C1CCSCC1 ZINC001576234859 993226072 /nfs/dbraw/zinc/22/60/72/993226072.db2.gz ATOZAKASHFUDKE-WCQGTBRESA-N 2 0 242.432 2.234 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1C[C@@H]1C1CCCC1)C1C[NH2+]C1 ZINC001576245328 993231061 /nfs/dbraw/zinc/23/10/61/993231061.db2.gz OPDKJEARWLAXRG-VHRBIJSZSA-N 2 0 222.376 2.010 20 0 BEADRP C[C@H]([NH2+][C@H]1C[C@H]([NH3+])C1)[C@H]1CC2CCC1CC2 ZINC001576250370 993233081 /nfs/dbraw/zinc/23/30/81/993233081.db2.gz FKSGFBLSOYHODS-SLRWIUGFSA-N 2 0 222.376 2.281 20 0 BEADRP C[C@@H]([NH2+][C@H]1C[C@H]([NH3+])C1)[C@H]1CC2CCC1CC2 ZINC001576250369 993233379 /nfs/dbraw/zinc/23/33/79/993233379.db2.gz FKSGFBLSOYHODS-LBYYJAQLSA-N 2 0 222.376 2.281 20 0 BEADRP C[C@H]([NH2+][C@H]1C[C@@H]([NH3+])C1)[C@@H]1C[C@H]1c1cccs1 ZINC001576251368 993234645 /nfs/dbraw/zinc/23/46/45/993234645.db2.gz LPTMWEDKVLULBH-HHHUOAJASA-N 2 0 236.384 2.319 20 0 BEADRP CC1(C)[C@H]([NH3+])C[C@@H]1[NH2+][C@@H]1CCSC(C)(C)C1 ZINC001576393186 993295472 /nfs/dbraw/zinc/29/54/72/993295472.db2.gz DIVSMHUOXIAOKI-MXWKQRLJSA-N 2 0 242.432 2.376 20 0 BEADRP CC1(C)[C@H]([NH2+][C@@H]2CCSC(C)(C)C2)C[C@@H]1[NH3+] ZINC001576393187 993297465 /nfs/dbraw/zinc/29/74/65/993297465.db2.gz DIVSMHUOXIAOKI-OUAUKWLOSA-N 2 0 242.432 2.376 20 0 BEADRP C[C@H]1[NH2+]CC[C@@H]1[NH2+]C1C[C@@H](C)C[C@H](C)C1 ZINC001576589033 993358142 /nfs/dbraw/zinc/35/81/42/993358142.db2.gz JYBWYRSPHTXCHH-KQXIARHKSA-N 2 0 210.365 2.151 20 0 BEADRP C[C@@H]1C[C@H]1[C@@H]1C[C@H]1[NH2+]C[C@@H]1CC[NH2+][C@H](C)C1 ZINC001576597216 993362186 /nfs/dbraw/zinc/36/21/86/993362186.db2.gz DMSMNVUYZDZXBS-UCKQBZRPSA-N 2 0 222.376 2.009 20 0 BEADRP C[C@@H]1C[C@@H](C[N@@H+]2CC[C@@H](c3ccco3)C2)CC[NH2+]1 ZINC001576598824 993363987 /nfs/dbraw/zinc/36/39/87/993363987.db2.gz OMKDBGBLWYLWNI-HZSPNIEDSA-N 2 0 248.370 2.457 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2C[C@H](C3CC3)[C@H]2C2CC2)CC[NH2+]1 ZINC001576598526 993364881 /nfs/dbraw/zinc/36/48/81/993364881.db2.gz MGCDWEBVEFKCJJ-CZPYZCIJSA-N 2 0 248.414 2.495 20 0 BEADRP C[C@@H]1CCC[C@@H](C[NH2+][C@H]2C[NH2+]CC2(C)C)C1 ZINC001576678717 993391640 /nfs/dbraw/zinc/39/16/40/993391640.db2.gz OJXYCZHRLQUHSU-UPJWGTAASA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+][C@H]2C[C@H]3CC[C@@H]2[NH2+]3)C1 ZINC001576680892 993393790 /nfs/dbraw/zinc/39/37/90/993393790.db2.gz VUOXQZRVHZKHQU-KVSVUVNWSA-N 2 0 208.349 2.048 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@H]2C[C@H]3CC[C@@H]2[NH2+]3)C1 ZINC001576680891 993394198 /nfs/dbraw/zinc/39/41/98/993394198.db2.gz VUOXQZRVHZKHQU-FHUSYTEZSA-N 2 0 208.349 2.048 20 0 BEADRP C[C@H]1C[N@@H+](C[C@H]2CC[C@@H]([NH3+])C2)CC[C@@H]1C ZINC001576732441 993408413 /nfs/dbraw/zinc/40/84/13/993408413.db2.gz UHEVJINALQQPCX-ZDEQEGDKSA-N 2 0 210.365 2.092 20 0 BEADRP CCC(CC)(C[NH3+])C[NH2+]CCCC(F)F ZINC001577052561 993489182 /nfs/dbraw/zinc/48/91/82/993489182.db2.gz XAGFTPFJTZUZFX-UHFFFAOYSA-N 2 0 222.323 2.386 20 0 BEADRP CCC[C@@H](C)CC[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC001577340830 993601604 /nfs/dbraw/zinc/60/16/04/993601604.db2.gz KQTUYOLJEPETSU-CHWSQXEVSA-N 2 0 212.381 2.402 20 0 BEADRP CCC[C@@H]1CCCC[C@@H]1[NH2+]C[C@@H]([NH3+])CCOC ZINC001577377181 993635598 /nfs/dbraw/zinc/63/55/98/993635598.db2.gz IBCZWXSPJRLRQH-RDBSUJKOSA-N 2 0 242.407 2.299 20 0 BEADRP CCCCO[C@@H]1C[C@@H]([NH2+]C/C=C\C[NH3+])C1(C)C ZINC001577463375 993669182 /nfs/dbraw/zinc/66/91/82/993669182.db2.gz UWYNOBOIUVSVNB-ZSBJFDRYSA-N 2 0 240.391 2.075 20 0 BEADRP C1[C@@H]([NH2+]C2CC[NH2+]CC2)C12CCCCC2 ZINC000386871347 993695561 /nfs/dbraw/zinc/69/55/61/993695561.db2.gz HAIPRCDOQVWCRS-GFCCVEGCSA-N 2 0 208.349 2.051 20 0 BEADRP CC(C)(C)CC[N@@H+]1CCCC[C@H](C[NH3+])C1 ZINC000389740153 993764543 /nfs/dbraw/zinc/76/45/43/993764543.db2.gz VPCWOGZOTXRWRF-GFCCVEGCSA-N 2 0 212.381 2.483 20 0 BEADRP CC/C=C/CC[N@@H+]1C[C@H]2CC[NH+](C)C[C@H]2C1 ZINC001307986848 995515798 /nfs/dbraw/zinc/51/57/98/995515798.db2.gz DXYOLJINUXRKMC-WEHDMVHDSA-N 2 0 222.376 2.226 20 0 BEADRP CC(C)C[N@@H+]1C[C@@]23C[NH+](C)C[C@]2(C1)CCCC3 ZINC001308171159 995583883 /nfs/dbraw/zinc/58/38/83/995583883.db2.gz QKIYMMGDKMOJRL-GASCZTMLSA-N 2 0 236.403 2.450 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]C[C@H]1CCOC1 ZINC000019915190 1170141121 /nfs/dbraw/zinc/14/11/21/1170141121.db2.gz YNIBCTQHAMFVRH-ZIAGYGMSSA-N 2 0 242.407 2.123 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@H]([NH2+][C@H]3CCC(C)(C)C3)[C@@H]2C1 ZINC001621569798 1170854072 /nfs/dbraw/zinc/85/40/72/1170854072.db2.gz FBDVZMFMTKOXJO-FQUUOJAGSA-N 2 0 236.403 2.495 20 0 BEADRP CC(C)(C)C[N@@H+]1CCC[C@]2(CCC[NH2+]C2)C1 ZINC000031994539 1170880483 /nfs/dbraw/zinc/88/04/83/1170880483.db2.gz DGSZIPDFMDDZIR-AWEZNQCLSA-N 2 0 224.392 2.498 20 0 BEADRP COc1ccccc1C[C@H](C)N1CCC[C@H]([NH3+])C1 ZINC000041027994 1171162036 /nfs/dbraw/zinc/16/20/36/1171162036.db2.gz FJTXLJDCYYLIRG-JSGCOSHPSA-N 2 0 248.370 2.049 20 0 BEADRP Cc1nccn1CC[NH2+][C@@H](C)Cc1ccco1 ZINC000049330295 1171688576 /nfs/dbraw/zinc/68/85/76/1171688576.db2.gz ARRUYDRKWOUUCN-NSHDSACASA-N 2 0 233.315 2.005 20 0 BEADRP CCCC1CC[NH+](C[C@H]2CC[NH2+]C2)CC1 ZINC000051890183 1171927190 /nfs/dbraw/zinc/92/71/90/1171927190.db2.gz BDJGQYPABHNXMU-ZDUSSCGKSA-N 2 0 210.365 2.108 20 0 BEADRP CCCC1CC[NH+](C[C@@H]2CC[NH2+]C2)CC1 ZINC000051890181 1171927887 /nfs/dbraw/zinc/92/78/87/1171927887.db2.gz BDJGQYPABHNXMU-CYBMUJFWSA-N 2 0 210.365 2.108 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@@H](C)CCCC(F)(F)F ZINC000414994208 398137911 /nfs/dbraw/zinc/13/79/11/398137911.db2.gz UMWSCWIMALXDDO-IUCAKERBSA-N 2 0 226.286 2.434 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@H](C)CCCC(F)(F)F ZINC000414994209 398137951 /nfs/dbraw/zinc/13/79/51/398137951.db2.gz UMWSCWIMALXDDO-RKDXNWHRSA-N 2 0 226.286 2.434 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@@H](C)CCCC(F)(F)F ZINC000414994206 398137977 /nfs/dbraw/zinc/13/79/77/398137977.db2.gz UMWSCWIMALXDDO-DTWKUNHWSA-N 2 0 226.286 2.434 20 0 BEADRP C[C@H]([NH2+]C1CCSCC1)C1CC[NH+](C)CC1 ZINC000161586046 538917052 /nfs/dbraw/zinc/91/70/52/538917052.db2.gz RSSFRBZEUCQWJD-NSHDSACASA-N 2 0 242.432 2.202 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@H](C)[C@@H]2C[C@@H]2C)CC1 ZINC000321645039 398144152 /nfs/dbraw/zinc/14/41/52/398144152.db2.gz VCADHACBDOTYQR-OUCADQQQSA-N 2 0 224.392 2.352 20 0 BEADRP CSC1(C[NH2+]C2CCC([NH+](C)C)CC2)CC1 ZINC000336656174 398144329 /nfs/dbraw/zinc/14/43/29/398144329.db2.gz AKHKTUHWOOWRLW-UHFFFAOYSA-N 2 0 242.432 2.344 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]C1(c2ccccc2)CC1 ZINC000422939352 398158733 /nfs/dbraw/zinc/15/87/33/398158733.db2.gz RDBGWMVSLCCYRC-RYUDHWBXSA-N 2 0 218.344 2.391 20 0 BEADRP CCOCCC1(C[NH2+][C@@H](C)C[C@H](C)[NH3+])CCC1 ZINC000422942830 398159181 /nfs/dbraw/zinc/15/91/81/398159181.db2.gz QGJMBVDQQYPFRB-STQMWFEESA-N 2 0 242.407 2.299 20 0 BEADRP Cc1cc(C[N@@H+]2CC[C@@H](C[NH3+])C2)c(C)s1 ZINC000050245566 178001525 /nfs/dbraw/zinc/00/15/25/178001525.db2.gz ZPKZAEYQPVVGID-NSHDSACASA-N 2 0 224.373 2.146 20 0 BEADRP Cc1cc(C[NH2+]C[C@H](C)C[NH+](C)C)ccc1F ZINC000291704647 178025091 /nfs/dbraw/zinc/02/50/91/178025091.db2.gz KNAHRHKZZDOKPJ-NSHDSACASA-N 2 0 238.350 2.421 20 0 BEADRP Cc1cc(C)c(C[NH2+][C@@H](C)CCCC[NH3+])cn1 ZINC000396993825 398168949 /nfs/dbraw/zinc/16/89/49/398168949.db2.gz VWSQYDFIPCWAIM-LBPRGKRZSA-N 2 0 235.375 2.306 20 0 BEADRP CC[C@@H](C)C[NH2+]C1CCC([NH+](C)C)CC1 ZINC000421376967 192323400 /nfs/dbraw/zinc/32/34/00/192323400.db2.gz SHUBHELYAZCMCY-PNESKVBLSA-N 2 0 212.381 2.495 20 0 BEADRP C[NH2+]CCC[N@H+](C)C[C@H](C)c1ccc(F)cc1 ZINC000415118947 398163013 /nfs/dbraw/zinc/16/30/13/398163013.db2.gz DVFBXHWSDGVOFS-LBPRGKRZSA-N 2 0 238.350 2.471 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@@H]1C(C)(C)C)C1C[NH2+]C1 ZINC000423174443 398164628 /nfs/dbraw/zinc/16/46/28/398164628.db2.gz CDKRGHHHZZIYQW-WCFLWFBJSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CCC[NH2+]1)C1C(C)(C)C1(C)C ZINC000423233163 398165130 /nfs/dbraw/zinc/16/51/30/398165130.db2.gz JIBRNIHBPCBFJL-GHMZBOCLSA-N 2 0 224.392 2.399 20 0 BEADRP c1ccc(C[C@H]([NH2+]C[C@H]2CCC[NH2+]2)C2CC2)cc1 ZINC000423233402 398165231 /nfs/dbraw/zinc/16/52/31/398165231.db2.gz JTFFZQSDLFVLBA-CVEARBPZSA-N 2 0 244.382 2.349 20 0 BEADRP Cc1cc(F)ccc1C[N@@H+]1CCC[C@H](C[NH3+])C1 ZINC000050580331 178085033 /nfs/dbraw/zinc/08/50/33/178085033.db2.gz BBLWGLDWVPPZPC-GFCCVEGCSA-N 2 0 236.334 2.305 20 0 BEADRP C[C@H](C[NH3+])N[C@H]1CCCc2sccc21 ZINC000235463582 398194010 /nfs/dbraw/zinc/19/40/10/398194010.db2.gz IQXVDKIYPZXEMJ-SCZZXKLOSA-N 2 0 210.346 2.062 20 0 BEADRP Cc1cc(N(C)CCC[NH+]2CCCC2)cc[nH+]1 ZINC000281905771 178099036 /nfs/dbraw/zinc/09/90/36/178099036.db2.gz PNSOAKXKZPDCDP-UHFFFAOYSA-N 2 0 233.359 2.312 20 0 BEADRP Cc1cc(N2CC([NH+](C)C)C2)c2ccccc2[nH+]1 ZINC000273380734 178113477 /nfs/dbraw/zinc/11/34/77/178113477.db2.gz YVVACLYRNLCMDN-UHFFFAOYSA-N 2 0 241.338 2.293 20 0 BEADRP CC1(CC[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)CC1 ZINC000647796802 398201531 /nfs/dbraw/zinc/20/15/31/398201531.db2.gz ODABGRMLPOXSJM-JHJVBQTASA-N 2 0 222.376 2.154 20 0 BEADRP Cc1cc(N2C[C@H]([NH+]3CCCC3)C[C@@H]2C)cc[nH+]1 ZINC000286206188 178121797 /nfs/dbraw/zinc/12/17/97/178121797.db2.gz CATFQGMZEDRUML-DZGCQCFKSA-N 2 0 245.370 2.453 20 0 BEADRP Cc1cc(N2C[C@H]([NH+]3CCCC3)C[C@H]2C)cc[nH+]1 ZINC000286206198 178122368 /nfs/dbraw/zinc/12/23/68/178122368.db2.gz CATFQGMZEDRUML-UKRRQHHQSA-N 2 0 245.370 2.453 20 0 BEADRP CC(C)CCC[N@@H+]1C[C@@H]2CC[C@H]([NH3+])[C@@H]2C1 ZINC000336712920 398205065 /nfs/dbraw/zinc/20/50/65/398205065.db2.gz VHQWXCVFGQJFDM-XQQFMLRXSA-N 2 0 210.365 2.092 20 0 BEADRP CC(C)CCC[N@@H+]1C[C@@H]2CC[C@@H]([NH3+])[C@@H]2C1 ZINC000336712922 398205413 /nfs/dbraw/zinc/20/54/13/398205413.db2.gz VHQWXCVFGQJFDM-YNEHKIRRSA-N 2 0 210.365 2.092 20 0 BEADRP CC[C@H](F)C[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000440711801 398208412 /nfs/dbraw/zinc/20/84/12/398208412.db2.gz KIDPSDCYQGOANI-ZDUSSCGKSA-N 2 0 230.371 2.398 20 0 BEADRP Cc1cc(NC2CCC([NH3+])CC2)cc[nH+]1 ZINC000107198599 178154670 /nfs/dbraw/zinc/15/46/70/178154670.db2.gz OYSPPBFNBQFXBL-UHFFFAOYSA-N 2 0 205.305 2.072 20 0 BEADRP C[C@H](c1ccncc1)[N@H+]1CC[C@H]2C[NH2+]C[C@H]2CC1 ZINC000386507589 398211092 /nfs/dbraw/zinc/21/10/92/398211092.db2.gz LYQHTXFWGLELIF-YUELXQCFSA-N 2 0 245.370 2.074 20 0 BEADRP Cc1cc(NCC2CC[NH+](C)CC2)cc[nH+]1 ZINC000229565524 178158022 /nfs/dbraw/zinc/15/80/22/178158022.db2.gz JIGUUIFZWPROSG-UHFFFAOYSA-N 2 0 219.332 2.144 20 0 BEADRP CCC(CC)C[N@@H+]1CCC[C@@H](C[NH2+]C)C1 ZINC000040591997 168350223 /nfs/dbraw/zinc/35/02/23/168350223.db2.gz QQYVXTPZADTXJB-ZDUSSCGKSA-N 2 0 212.381 2.354 20 0 BEADRP C[C@H]([NH2+]CCC[NH3+])c1cnc2ccsc2c1 ZINC000082928259 136222150 /nfs/dbraw/zinc/22/21/50/136222150.db2.gz GVFDDJOFOCRQSJ-VIFPVBQESA-N 2 0 235.356 2.296 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@@H]2CC[NH2+]C2)[C@@H]2CCCC[C@@H]12 ZINC000647880339 398223214 /nfs/dbraw/zinc/22/32/14/398223214.db2.gz JSMBQFLJUPNZAR-APIJFGDWSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]1SCC[N@H+](CC[C@@H]2CCC[NH+]2C)[C@H]1C ZINC000161946632 349519967 /nfs/dbraw/zinc/51/99/67/349519967.db2.gz JYMAPSHBYWEFBV-AVGNSLFASA-N 2 0 242.432 2.297 20 0 BEADRP CCC(CC)C[N@@H+]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC000352535032 168351105 /nfs/dbraw/zinc/35/11/05/168351105.db2.gz LOPZVRZKSLDAJV-AWEZNQCLSA-N 2 0 224.392 2.498 20 0 BEADRP CCC(CC)C[N@@H+]1CC[C@@]2(CC[NH2+]C2)C1 ZINC000031994493 168353589 /nfs/dbraw/zinc/35/35/89/168353589.db2.gz AIZFRWJHBNHFQQ-CYBMUJFWSA-N 2 0 210.365 2.108 20 0 BEADRP CCC(CC)C[N@@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC000368314094 168352082 /nfs/dbraw/zinc/35/20/82/168352082.db2.gz FITYYNMNENDOTQ-CQSZACIVSA-N 2 0 224.392 2.450 20 0 BEADRP CCOc1ccccc1C[N@@H+]1CC[C@@H]([C@H](C)[NH3+])C1 ZINC000252779483 136226900 /nfs/dbraw/zinc/22/69/00/136226900.db2.gz LSZQQGXAFGYWEW-QWHCGFSZSA-N 2 0 248.370 2.254 20 0 BEADRP CCC(CC)C[NH2+]CC1=CC[N@H+](C)CC1 ZINC000336766866 168360282 /nfs/dbraw/zinc/36/02/82/168360282.db2.gz RZEQDBXTOAHZJN-UHFFFAOYSA-N 2 0 210.365 2.274 20 0 BEADRP C1=C[C@@H]([N@@H+]2C[C@H]3C[NH2+]C[C@H]3C2)CCCCC1 ZINC000380800364 398251927 /nfs/dbraw/zinc/25/19/27/398251927.db2.gz HBLDTPIKOLNFJG-HZSPNIEDSA-N 2 0 220.360 2.027 20 0 BEADRP C[C@@H]([NH2+]C[C@@H](C)C1CC1)[C@H]1CCCC[NH2+]1 ZINC000386090439 398263122 /nfs/dbraw/zinc/26/31/22/398263122.db2.gz IBILQXKYVZLGMM-NQBHXWOUSA-N 2 0 210.365 2.153 20 0 BEADRP CCN1CCC[C@H]([NH2+][C@@H](C)C2(C)CC2)C1 ZINC000040502607 343997754 /nfs/dbraw/zinc/99/77/54/343997754.db2.gz YEFSXEAWKAQKDX-RYUDHWBXSA-N 2 0 210.365 2.249 20 0 BEADRP CC(C)CCC[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000162088257 349560557 /nfs/dbraw/zinc/56/05/57/349560557.db2.gz DGNRVRFYFQIZNY-ZDUSSCGKSA-N 2 0 224.392 2.497 20 0 BEADRP CCC[C@@H]1C[C@H]1[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@H]1C ZINC000393529038 259314808 /nfs/dbraw/zinc/31/48/08/259314808.db2.gz VNTJYJUWWWZKQF-XVIXHAIJSA-N 2 0 224.392 2.493 20 0 BEADRP CC(C)CC[N@H+](C)CC[C@H]1CCC[NH+]1C ZINC000179308181 538955019 /nfs/dbraw/zinc/95/50/19/538955019.db2.gz KXLVTLPPFRZHAV-CYBMUJFWSA-N 2 0 212.381 2.449 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+]C[C@@H]1CCCC[N@H+](C)C1 ZINC000624124194 346854918 /nfs/dbraw/zinc/85/49/18/346854918.db2.gz ZSSHLMDDESGQDW-BFHYXJOUSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H]([NH2+]CCC[N@H+](C)C(C)C)C1CC1 ZINC000166568784 361852994 /nfs/dbraw/zinc/85/29/94/361852994.db2.gz RDXWWSFBUCLKJF-CYBMUJFWSA-N 2 0 212.381 2.495 20 0 BEADRP CC[C@@H]1CC[N@H+](CC[C@@H]2CCC[NH+]2C)C1 ZINC000162230766 349613674 /nfs/dbraw/zinc/61/36/74/349613674.db2.gz HBBJFUQGDKIZKQ-OLZOCXBDSA-N 2 0 210.365 2.203 20 0 BEADRP C[C@@H]([NH2+][C@H](C)C1CC[NH+](C)CC1)c1cccnc1 ZINC000037220825 538961885 /nfs/dbraw/zinc/96/18/85/538961885.db2.gz YKSYQNXTHXBJAC-CHWSQXEVSA-N 2 0 247.386 2.463 20 0 BEADRP CC(C)CC[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000037209534 538961980 /nfs/dbraw/zinc/96/19/80/538961980.db2.gz DLSHWGGDQVICBT-LBPRGKRZSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H]([NH2+][C@H](C)C1CC[NH+](C)CC1)c1ccccn1 ZINC000037220382 538962032 /nfs/dbraw/zinc/96/20/32/538962032.db2.gz RNEZHQYWTDRPNR-CHWSQXEVSA-N 2 0 247.386 2.463 20 0 BEADRP [NH3+]C[C@H]1CCC[N@H+](C[C@@H]2C[C@H]2c2ccccc2)C1 ZINC000583934829 342728292 /nfs/dbraw/zinc/72/82/92/342728292.db2.gz XSOPXYLORMYQND-KBMXLJTQSA-N 2 0 244.382 2.461 20 0 BEADRP CCC(CC)[NH2+]C[C@@H](C)C[NH+]1CCCC1 ZINC000062077321 168388088 /nfs/dbraw/zinc/38/80/88/168388088.db2.gz BHGMLSNUJZCATK-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP Cc1ccc(C[N@H+]2C[C@@H](C[NH3+])C[C@@H]2C)s1 ZINC000126718272 398285366 /nfs/dbraw/zinc/28/53/66/398285366.db2.gz PQXMVIBZBVQHSA-GXSJLCMTSA-N 2 0 224.373 2.226 20 0 BEADRP c1ccc(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000106868646 398286190 /nfs/dbraw/zinc/28/61/90/398286190.db2.gz QFWSRKSYZUNQFS-HUUCEWRRSA-N 2 0 230.355 2.403 20 0 BEADRP C[C@@H]1CC[N@H+](CC[C@@H]2CCC[NH+]2C)CCS1 ZINC000192191311 538994135 /nfs/dbraw/zinc/99/41/35/538994135.db2.gz BMYJMQAULLPXID-OLZOCXBDSA-N 2 0 242.432 2.298 20 0 BEADRP CCC[C@H](C)[NH2+][C@@H](C)CN(CC)CC ZINC000045689637 538993054 /nfs/dbraw/zinc/99/30/54/538993054.db2.gz YHERBNPYOVUDLK-RYUDHWBXSA-N 2 0 200.370 2.495 20 0 BEADRP CCCCC[C@@H](C)[N@@H+]1CC[C@H](C[NH2+]C)C1 ZINC000053031686 1172008253 /nfs/dbraw/zinc/00/82/53/1172008253.db2.gz XMLFMZOGZSBSIG-CHWSQXEVSA-N 2 0 212.381 2.497 20 0 BEADRP CCC1CCC([N@@H+]2CC[C@H](C[NH2+]C)C2)CC1 ZINC000053031754 1172008769 /nfs/dbraw/zinc/00/87/69/1172008769.db2.gz CTGYQDWMXWBBBH-ROKHWSDSSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]([NH2+][C@@H]1CSC[C@H]1C)C1CC[NH+](C)CC1 ZINC000381433354 539000872 /nfs/dbraw/zinc/00/08/72/539000872.db2.gz CAEHXCWCQNIAME-NTZNESFSSA-N 2 0 242.432 2.058 20 0 BEADRP CCC1CCC([N@@H+]2CC[C@@H](C[NH2+]C)C2)CC1 ZINC000053031755 1172009745 /nfs/dbraw/zinc/00/97/45/1172009745.db2.gz CTGYQDWMXWBBBH-MOKVOYLWSA-N 2 0 224.392 2.497 20 0 BEADRP CC1(C)CC[C@H]1[NH2+]CCC[NH+]1CCCC1 ZINC000308838080 342859573 /nfs/dbraw/zinc/85/95/73/342859573.db2.gz XCGXDKPHWFXHME-GFCCVEGCSA-N 2 0 210.365 2.251 20 0 BEADRP CCCC1(C[NH2+][C@H]2CCC[C@H]([NH3+])C2)CC1 ZINC000233042522 342894538 /nfs/dbraw/zinc/89/45/38/342894538.db2.gz IUFFVMRGJQZGMO-RYUDHWBXSA-N 2 0 210.365 2.426 20 0 BEADRP CC(C)[N@@H+]1CC[C@H](C[NH2+]C2CC(C)C2)C1 ZINC000232831953 342886552 /nfs/dbraw/zinc/88/65/52/342886552.db2.gz ZEDGBAYOCCVKCL-OTTFEQOBSA-N 2 0 210.365 2.105 20 0 BEADRP CCO[C@@H]1C[C@@H]([NH2+]CCC[NH2+]C(C)C)C1(C)C ZINC000233743527 342912384 /nfs/dbraw/zinc/91/23/84/342912384.db2.gz YYXWWJYPWUQFBQ-CHWSQXEVSA-N 2 0 242.407 2.168 20 0 BEADRP CCc1ccc(C[N@@H+]2CC[C@](C)(C[NH3+])C2)s1 ZINC000234158953 342917297 /nfs/dbraw/zinc/91/72/97/342917297.db2.gz GTPHBBKOHKEOJP-CYBMUJFWSA-N 2 0 238.400 2.481 20 0 BEADRP COC[C@H](C)[NH2+]CCCCC[NH+]1CCCCC1 ZINC000174077018 346877178 /nfs/dbraw/zinc/87/71/78/346877178.db2.gz FHHJTFPXTZJCNL-AWEZNQCLSA-N 2 0 242.407 2.267 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]C[C@@H]2CC=CCC2)C1 ZINC000222994387 259331295 /nfs/dbraw/zinc/33/12/95/259331295.db2.gz LBVQOGFBKHIEDX-UPJWGTAASA-N 2 0 208.349 2.202 20 0 BEADRP C[C@H](C[NH2+][C@H]1C[C@@H](C)O[C@@H](C)C1)N(C)C1CC1 ZINC000562517644 323022501 /nfs/dbraw/zinc/02/25/01/323022501.db2.gz JYJIOHQXZGCHST-NDBYEHHHSA-N 2 0 240.391 2.015 20 0 BEADRP CC(C)c1ccc([C@H](C)NCC[NH3+])cc1 ZINC000037712585 342944277 /nfs/dbraw/zinc/94/42/77/342944277.db2.gz GPOCHHPQUFZLLT-NSHDSACASA-N 2 0 206.333 2.419 20 0 BEADRP CCN1CCC([NH2+][C@@H](C)c2ccncc2)CC1 ZINC000020121033 342969630 /nfs/dbraw/zinc/96/96/30/342969630.db2.gz DEADMMXTYIKYPA-LBPRGKRZSA-N 2 0 233.359 2.217 20 0 BEADRP CCCC(CCC)[NH2+]CCC[NH+](C)C ZINC000019959227 342964580 /nfs/dbraw/zinc/96/45/80/342964580.db2.gz NWXLKTOGYHCULN-UHFFFAOYSA-N 2 0 200.370 2.497 20 0 BEADRP CC1(C[NH2+]CCC[NH+]2CCCCC2)CC1 ZINC000308820223 259340639 /nfs/dbraw/zinc/34/06/39/259340639.db2.gz QJZCVHGTYPTNTH-UHFFFAOYSA-N 2 0 210.365 2.252 20 0 BEADRP C[C@H](F)CC[N@@H+]1CCC[C@H](c2ncc[nH]2)C1 ZINC000351875401 136261083 /nfs/dbraw/zinc/26/10/83/136261083.db2.gz LPONVKOGHCQZDG-QWRGUYRKSA-N 2 0 225.311 2.337 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]CCc2ccc(F)cc2)C1 ZINC000093209412 343150855 /nfs/dbraw/zinc/15/08/55/343150855.db2.gz AUUPBNPVJDPSPD-UONOGXRCSA-N 2 0 236.334 2.228 20 0 BEADRP C[C@@H]([NH2+]CC1CC[NH2+]CC1)c1cccc(F)c1 ZINC000094009616 343151696 /nfs/dbraw/zinc/15/16/96/343151696.db2.gz KXNKHFVSKRLMNV-LLVKDONJSA-N 2 0 236.334 2.476 20 0 BEADRP CCCC[N@@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000150758746 136273522 /nfs/dbraw/zinc/27/35/22/136273522.db2.gz MXUAUROJKDKHFC-CYBMUJFWSA-N 2 0 210.365 2.204 20 0 BEADRP CN(CCC[NH3+])Cc1ccccc1OC(F)F ZINC000123328416 343162000 /nfs/dbraw/zinc/16/20/00/343162000.db2.gz FAHNUZMECJGBKT-UHFFFAOYSA-N 2 0 244.285 2.069 20 0 BEADRP C[NH2+]CCC[N@H+](C)C[C@H]1CCC[C@@H](C)C1 ZINC000087472191 136281576 /nfs/dbraw/zinc/28/15/76/136281576.db2.gz WFJBAPHIRXNMPB-OLZOCXBDSA-N 2 0 212.381 2.354 20 0 BEADRP C[C@H]1C[C@@H]([NH3+])CN1Cc1cccc2ncccc12 ZINC000634688584 343249064 /nfs/dbraw/zinc/24/90/64/343249064.db2.gz WZOVCFVKJCJQAJ-WCQYABFASA-N 2 0 241.338 2.156 20 0 BEADRP Fc1ccc2c(c1)CC[C@@H]2[NH2+]C1CC[NH2+]CC1 ZINC000335601260 136295285 /nfs/dbraw/zinc/29/52/85/136295285.db2.gz JPQZCGNJDRDTSI-AWEZNQCLSA-N 2 0 234.318 2.155 20 0 BEADRP CC[C@H]1CCC[N@H+](CCC2CC[NH2+]CC2)C1 ZINC000036169799 343311793 /nfs/dbraw/zinc/31/17/93/343311793.db2.gz SYOPIZOXFYVSRG-ZDUSSCGKSA-N 2 0 224.392 2.498 20 0 BEADRP Cc1cc(C[NH2+][C@@H]2CC[NH2+][C@H](C)C2)ccc1F ZINC000335635971 136300722 /nfs/dbraw/zinc/30/07/22/136300722.db2.gz BJZZDWDSYWTHTB-DGCLKSJQSA-N 2 0 236.334 2.364 20 0 BEADRP CC[C@H]1CCCC[C@H]1[NH2+]CCC[NH+](C)C ZINC000070558355 343334794 /nfs/dbraw/zinc/33/47/94/343334794.db2.gz FJPCOORIBUSJRQ-QWHCGFSZSA-N 2 0 212.381 2.497 20 0 BEADRP CN1CCC([NH2+]C[C@H]2CC=CCC2)CC1 ZINC000037248592 343340895 /nfs/dbraw/zinc/34/08/95/343340895.db2.gz MFBSMBSQWQYPHH-LBPRGKRZSA-N 2 0 208.349 2.027 20 0 BEADRP C[C@H]1CCC[C@H]1[NH2+]CCC[NH+]1CCCC1 ZINC000070829458 343341253 /nfs/dbraw/zinc/34/12/53/343341253.db2.gz VZDJMBHXFJTVMJ-QWHCGFSZSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@H]1CC([NH2+]CC2([NH3+])CCC2)C[C@H](C)C1 ZINC000335650673 136305228 /nfs/dbraw/zinc/30/52/28/136305228.db2.gz WIVCMTWVDOUSSX-GHMZBOCLSA-N 2 0 210.365 2.282 20 0 BEADRP CCC[N@H+](CCC[NH+](C)C)C[C@H]1CCSC1 ZINC000349365427 136343276 /nfs/dbraw/zinc/34/32/76/136343276.db2.gz HVFDWRFPZRQRCG-CYBMUJFWSA-N 2 0 244.448 2.403 20 0 BEADRP Cc1nccn1CCC[N@@H+](C)C[C@H]1C[C@H]1C ZINC000349408373 136344859 /nfs/dbraw/zinc/34/48/59/136344859.db2.gz PUZSUGRTCSQHDQ-DGCLKSJQSA-N 2 0 221.348 2.169 20 0 BEADRP CC(C)=CC[NH+]1CC[C@]2(C1)CCC[N@@H+](C)C2 ZINC000335725613 136346868 /nfs/dbraw/zinc/34/68/68/136346868.db2.gz JLBMWRILPSOCTP-CQSZACIVSA-N 2 0 222.376 2.370 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]Cc1ccc(F)c(Cl)c1 ZINC000258728845 136373905 /nfs/dbraw/zinc/37/39/05/136373905.db2.gz JVBNWGRUAAFSOQ-MRVPVSSYSA-N 2 0 230.714 2.164 20 0 BEADRP C[C@H]([NH3+])C1CC[NH+](Cc2cccs2)CC1 ZINC000082474670 343444318 /nfs/dbraw/zinc/44/43/18/343444318.db2.gz LIFFSKHSSHGYGC-JTQLQIEISA-N 2 0 224.373 2.307 20 0 BEADRP CC[C@H]([NH2+]CCC[NH+](CC)CC)C1CC1 ZINC000083054248 343475328 /nfs/dbraw/zinc/47/53/28/343475328.db2.gz RNMYOSFTTLGSCJ-ZDUSSCGKSA-N 2 0 212.381 2.497 20 0 BEADRP CC[NH+]1CCC(Nc2cc(C)ccn2)CC1 ZINC000043561569 343477941 /nfs/dbraw/zinc/47/79/41/343477941.db2.gz UOOLIKCEMNZZHM-UHFFFAOYSA-N 2 0 219.332 2.286 20 0 BEADRP C[NH2+]C[C@H]1CCC[N@H+](CCC2CCC2)C1 ZINC000398610776 488220808 /nfs/dbraw/zinc/22/08/08/488220808.db2.gz AVOZYRFECOVHSI-CYBMUJFWSA-N 2 0 210.365 2.108 20 0 BEADRP CCc1nc(C[NH2+]CCCC[NH+](C)C)cs1 ZINC000049949222 343606637 /nfs/dbraw/zinc/60/66/37/343606637.db2.gz VDPBWLRMOVUNLW-UHFFFAOYSA-N 2 0 241.404 2.137 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]Cc1ccc(C)s1 ZINC000086070642 343610606 /nfs/dbraw/zinc/61/06/06/343610606.db2.gz IEYABCGETZGKAZ-SECBINFHSA-N 2 0 212.362 2.002 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@@H]1CCC(C)(C)C1 ZINC000087771426 343660123 /nfs/dbraw/zinc/66/01/23/343660123.db2.gz PWJZYLDLOFPJRK-VXGBXAGGSA-N 2 0 212.381 2.495 20 0 BEADRP CC/C=C/CC[N@@H+]1CCc2nc[nH]c2C1 ZINC000625436236 343733660 /nfs/dbraw/zinc/73/36/60/343733660.db2.gz GTNCSNZHIJMTEX-ONEGZZNKSA-N 2 0 205.305 2.124 20 0 BEADRP C(=C/c1ccccc1)\C[N@@H+]1CCc2nc[nH]c2C1 ZINC000625437827 343740086 /nfs/dbraw/zinc/74/00/86/343740086.db2.gz JBWYNHMSBUJLAE-QPJJXVBHSA-N 2 0 239.322 2.481 20 0 BEADRP C[N@H+](CCC[NH2+]C1CCCCC1)C1CC1 ZINC000053499012 1172035415 /nfs/dbraw/zinc/03/54/15/1172035415.db2.gz JBEGKBKYIRNKMU-UHFFFAOYSA-N 2 0 210.365 2.393 20 0 BEADRP CC/C=C\CC[N@@H+]1CC[C@H](C[NH+](C)C)C1 ZINC000342251174 343726693 /nfs/dbraw/zinc/72/66/93/343726693.db2.gz RBWKHNLHBQMAJB-CFHLNLSMSA-N 2 0 210.365 2.226 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@H](C[NH3+])C2)c(C)c1 ZINC000044527746 343781545 /nfs/dbraw/zinc/78/15/45/343781545.db2.gz BQWKCBZTLUAYJR-CQSZACIVSA-N 2 0 232.371 2.474 20 0 BEADRP [NH3+][C@@]12CCC[C@H]1C[N@H+](CCCc1ccccc1)C2 ZINC000621777908 343903503 /nfs/dbraw/zinc/90/35/03/343903503.db2.gz IOPNTWHDPAVJLJ-JKSUJKDBSA-N 2 0 244.382 2.432 20 0 BEADRP CC[C@H](CC(F)F)C[N@@H+]1C[C@H]2CCC[C@]2([NH3+])C1 ZINC000621784434 343909642 /nfs/dbraw/zinc/90/96/42/343909642.db2.gz OVRSSUCOFLPBTB-WZRBSPASSA-N 2 0 246.345 2.481 20 0 BEADRP C1C([NH2+][C@@H]2CCSC2)CC1[NH+]1CCCCC1 ZINC000335606481 192068248 /nfs/dbraw/zinc/06/82/48/192068248.db2.gz OJRBAEIGIBJNGG-PNESKVBLSA-N 2 0 240.416 2.098 20 0 BEADRP CC[C@H](C)C[NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000221317486 259371989 /nfs/dbraw/zinc/37/19/89/259371989.db2.gz PNCAQOZWCDDGES-RWMBFGLXSA-N 2 0 212.381 2.495 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]([NH2+]Cc2cccc(O)c2)C1 ZINC000634732430 344107124 /nfs/dbraw/zinc/10/71/24/344107124.db2.gz GMZMOQISLMKPLV-ZDUSSCGKSA-N 2 0 248.370 2.260 20 0 BEADRP CCC[C@H](C)C[NH2+][C@]12CCC[C@@H]1C[NH2+]C2 ZINC000634733417 344113310 /nfs/dbraw/zinc/11/33/10/344113310.db2.gz FFVBXQFBOBYKMV-XQQFMLRXSA-N 2 0 210.365 2.154 20 0 BEADRP COCC(C)(C)C[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000634734110 344114634 /nfs/dbraw/zinc/11/46/34/344114634.db2.gz XAOCKQIOGVSATE-GFCCVEGCSA-N 2 0 242.407 2.027 20 0 BEADRP CCC[C@H](C[NH2+]C[C@@H]1CC[N@@H+](C(C)C)C1)OC ZINC000395209467 362348013 /nfs/dbraw/zinc/34/80/13/362348013.db2.gz UYAVHCMSMASGMU-UONOGXRCSA-N 2 0 242.407 2.121 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H]1CCCC12CCC2 ZINC000518359968 344210776 /nfs/dbraw/zinc/21/07/76/344210776.db2.gz IRDSJJJYIIWUEM-LBPRGKRZSA-N 2 0 210.365 2.298 20 0 BEADRP CSCC[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCCC[NH2+]1 ZINC000086500067 344218524 /nfs/dbraw/zinc/21/85/24/344218524.db2.gz CHRDHUPQJFZAFH-FRRDWIJNSA-N 2 0 242.432 2.250 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+]C1CC[NH+](CC)CC1 ZINC000387728069 347042863 /nfs/dbraw/zinc/04/28/63/347042863.db2.gz RHIVGSKSOLPYKF-NEPJUHHUSA-N 2 0 210.365 2.106 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]CCCOc2ccccc2)C1 ZINC000093215832 344312640 /nfs/dbraw/zinc/31/26/40/344312640.db2.gz GDUJXRCULGPZLB-UONOGXRCSA-N 2 0 248.370 2.315 20 0 BEADRP C[C@H]1C[C@@H]([NH3+])CN1Cc1cccc2cccnc21 ZINC000385100198 344326502 /nfs/dbraw/zinc/32/65/02/344326502.db2.gz PCPBCOFNHSRUFR-SMDDNHRTSA-N 2 0 241.338 2.156 20 0 BEADRP C[C@H]1C[C@H]([NH3+])CN1Cc1cccc2cccnc21 ZINC000385100196 344326569 /nfs/dbraw/zinc/32/65/69/344326569.db2.gz PCPBCOFNHSRUFR-FZMZJTMJSA-N 2 0 241.338 2.156 20 0 BEADRP CCN(CC[NH3+])CCSCc1ccccc1 ZINC000600772620 344372398 /nfs/dbraw/zinc/37/23/98/344372398.db2.gz FQRYZGOAXBHIHR-UHFFFAOYSA-N 2 0 238.400 2.200 20 0 BEADRP CC(C)=CC[NH2+][C@@H]1C[C@@H](C)[N@@H+](C)C[C@@H]1C ZINC000228317831 259375847 /nfs/dbraw/zinc/37/58/47/259375847.db2.gz SEWJFTQOHIWECQ-YNEHKIRRSA-N 2 0 210.365 2.271 20 0 BEADRP COCCCCC[N@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000152339552 344521960 /nfs/dbraw/zinc/52/19/60/344521960.db2.gz RRILTIPHOJVMNA-AWEZNQCLSA-N 2 0 242.407 2.077 20 0 BEADRP CC(C)C[C@@H](C)[NH2+]CCCC[NH+](C)C ZINC000045663307 344574533 /nfs/dbraw/zinc/57/45/33/344574533.db2.gz WEBWGIDFGPJZOA-GFCCVEGCSA-N 2 0 200.370 2.352 20 0 BEADRP CC(C)C[C@H](C)[NH2+][C@@H](C)CC[NH+](C)C ZINC000049553078 344652870 /nfs/dbraw/zinc/65/28/70/344652870.db2.gz UGCFMHVVXIVWGS-RYUDHWBXSA-N 2 0 200.370 2.351 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+]C[C@H]1CC=CCC1 ZINC000049553548 344653193 /nfs/dbraw/zinc/65/31/93/344653193.db2.gz ZMLBAOYXPHHSGY-OLZOCXBDSA-N 2 0 210.365 2.273 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH2+]C2CC3(CCC3)C2)C1 ZINC000309970029 259378832 /nfs/dbraw/zinc/37/88/32/259378832.db2.gz PADGODGESXRASY-LBPRGKRZSA-N 2 0 222.376 2.251 20 0 BEADRP CC(C)[C@@H](C)[NH2+]Cc1ccc2c(c1)C[NH2+]C2 ZINC000318969269 259381147 /nfs/dbraw/zinc/38/11/47/259381147.db2.gz GQRHDMWEFGQXHR-LLVKDONJSA-N 2 0 218.344 2.424 20 0 BEADRP CCC[N@H+](C[C@H](C)CC)C1CC[NH2+]CC1 ZINC000050427177 344820266 /nfs/dbraw/zinc/82/02/66/344820266.db2.gz HGIRIKHICIPJQN-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP C[NH+](C)C[C@H]1CC[N@H+](C[C@@]2(C)CCCS2)C1 ZINC000628174019 344894621 /nfs/dbraw/zinc/89/46/21/344894621.db2.gz UJQKNQIQNIRSLT-CHWSQXEVSA-N 2 0 242.432 2.156 20 0 BEADRP COCC[N@H+](C)CCC[NH2+][C@H](C)C1CCCC1 ZINC000153786548 344973878 /nfs/dbraw/zinc/97/38/78/344973878.db2.gz LDUZYYJYPJSFOL-CYBMUJFWSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[C@H]1c1ccco1)[C@H]1CCC[NH2+]C1 ZINC000579342032 344951330 /nfs/dbraw/zinc/95/13/30/344951330.db2.gz MXSYJWHIWASPGS-YVECIDJPSA-N 2 0 234.343 2.113 20 0 BEADRP CCC(CC)C[NH+]1CCC([NH+](C)C)CC1 ZINC000153901437 344997673 /nfs/dbraw/zinc/99/76/73/344997673.db2.gz WWPOHKGZKNQADK-UHFFFAOYSA-N 2 0 212.381 2.449 20 0 BEADRP CC(F)(F)CCC[NH2+][C@H]1CCC[C@@H]1C[NH3+] ZINC000390230674 259382860 /nfs/dbraw/zinc/38/28/60/259382860.db2.gz GQEXCQOICCQCFD-ZJUUUORDSA-N 2 0 220.307 2.139 20 0 BEADRP C(C1CC1)[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000156479959 345167242 /nfs/dbraw/zinc/16/72/42/345167242.db2.gz DTQSDWXJHTXFLV-CQSZACIVSA-N 2 0 222.376 2.347 20 0 BEADRP C[C@@H]1C[C@@H]2CCCC[C@H]2[N@@H+]1CC12CC(C1)C[NH2+]2 ZINC000634993399 345190386 /nfs/dbraw/zinc/19/03/86/345190386.db2.gz SZDBDWLWLYZWFG-NSWUILHUSA-N 2 0 234.387 2.391 20 0 BEADRP CC(F)(F)CCC[NH2+][C@@H]1CCC[C@@H]1C[NH3+] ZINC000390230671 259383089 /nfs/dbraw/zinc/38/30/89/259383089.db2.gz GQEXCQOICCQCFD-NXEZZACHSA-N 2 0 220.307 2.139 20 0 BEADRP CCC(C)(C)CC[NH2+][C@@H](CCC[NH3+])COC ZINC000635024236 345224851 /nfs/dbraw/zinc/22/48/51/345224851.db2.gz USGPAJQEDGIFDP-LBPRGKRZSA-N 2 0 230.396 2.156 20 0 BEADRP CC(C)[C@H](C)[N@H+](C)CC[C@H]1CCC[NH2+]C1 ZINC000251303391 192370341 /nfs/dbraw/zinc/37/03/41/192370341.db2.gz ILCLDUCLYHAHAE-QWHCGFSZSA-N 2 0 212.381 2.352 20 0 BEADRP CC(C)[C@@H]1CCCN(CC23CC(C2)C[NH2+]3)C1 ZINC000634994152 345192411 /nfs/dbraw/zinc/19/24/11/345192411.db2.gz SKWSEPVVSSJRSN-ROKHWSDSSA-N 2 0 222.376 2.106 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@H]2CCCC23CC3)C1 ZINC000634997014 345193945 /nfs/dbraw/zinc/19/39/45/345193945.db2.gz BCVLGXNBMHOFKJ-UTUOFQBUSA-N 2 0 208.349 2.179 20 0 BEADRP COc1ccccc1CN1CCCCC[C@H]([NH3+])C1 ZINC000634997388 345195488 /nfs/dbraw/zinc/19/54/88/345195488.db2.gz JXNXHUSBVVTBSN-AWEZNQCLSA-N 2 0 248.370 2.399 20 0 BEADRP COc1ccccc1CN1CCCCC[C@@H]([NH3+])C1 ZINC000634997389 345195622 /nfs/dbraw/zinc/19/56/22/345195622.db2.gz JXNXHUSBVVTBSN-CQSZACIVSA-N 2 0 248.370 2.399 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCCC12CC2)[C@@H]1CCCC[NH2+]1 ZINC000635003287 345205735 /nfs/dbraw/zinc/20/57/35/345205735.db2.gz HTYBMDQOTWSZSA-RWMBFGLXSA-N 2 0 222.376 2.439 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@@H]1CCO[C@H]1c1ccccc1 ZINC000635004221 345207949 /nfs/dbraw/zinc/20/79/49/345207949.db2.gz NOLDUJYGHHPLDE-MXYBEHONSA-N 2 0 248.370 2.232 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CCCC12CC2 ZINC000635004840 345208440 /nfs/dbraw/zinc/20/84/40/345208440.db2.gz QCEMGZAFMDUXDS-AVGNSLFASA-N 2 0 222.376 2.426 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+][C@H]1CC[C@H](C[NH3+])CC1 ZINC000635004965 345209305 /nfs/dbraw/zinc/20/93/05/345209305.db2.gz KZVULMAGPODGFM-SRVKXCTJSA-N 2 0 210.365 2.282 20 0 BEADRP CCC[C@H](CCO)[NH2+][C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000635005984 345209993 /nfs/dbraw/zinc/20/99/93/345209993.db2.gz XCGZDQIGHBKSRF-UGFHNGPFSA-N 2 0 248.370 2.272 20 0 BEADRP C[C@@H](Cc1ccoc1)[NH2+][C@H]1CC[C@H](C[NH3+])CC1 ZINC000635006457 345210637 /nfs/dbraw/zinc/21/06/37/345210637.db2.gz RJCKGAKQLDSKOL-OBJOEFQTSA-N 2 0 236.359 2.318 20 0 BEADRP CC(C)(F)C[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000635006495 345210760 /nfs/dbraw/zinc/21/07/60/345210760.db2.gz YWAONWNFLDVRLK-IJLUTSLNSA-N 2 0 228.355 2.245 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)CC1CCC1)[C@H]1CCC[NH2+]1 ZINC000635011364 345213329 /nfs/dbraw/zinc/21/33/29/345213329.db2.gz FBUAJSQSXDRHFU-DMDPSCGWSA-N 2 0 210.365 2.295 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+][C@@H]1C[C@H]1C(F)(F)F ZINC000635012448 345214132 /nfs/dbraw/zinc/21/41/32/345214132.db2.gz MLOJOKWEWMBNNH-ZYUZMQFOSA-N 2 0 236.281 2.044 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+][C@@H]1C[C@H]1C(F)(F)F ZINC000635012447 345214628 /nfs/dbraw/zinc/21/46/28/345214628.db2.gz MLOJOKWEWMBNNH-SGIHWFKDSA-N 2 0 236.281 2.044 20 0 BEADRP CC(C)[C@@H](C)[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000635012633 345214686 /nfs/dbraw/zinc/21/46/86/345214686.db2.gz UUFYOVUJMJSHED-VXGBXAGGSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)c1cncs1 ZINC000635008405 345216059 /nfs/dbraw/zinc/21/60/59/345216059.db2.gz UBOSWDCQIWWALW-GMTAPVOTSA-N 2 0 239.388 2.311 20 0 BEADRP CCCC[C@H](COC)[NH2+][C@H]1CC[C@H](C[NH3+])CC1 ZINC000635008215 345216222 /nfs/dbraw/zinc/21/62/22/345216222.db2.gz SCXCREXFUBCEHE-MGPQQGTHSA-N 2 0 242.407 2.299 20 0 BEADRP Cc1nccn1CC[N@@H+]1CCCC2(CC2)CC1 ZINC000626114545 345314452 /nfs/dbraw/zinc/31/44/52/345314452.db2.gz KGHIZKUUGLJTFP-UHFFFAOYSA-N 2 0 233.359 2.458 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000132023205 345313232 /nfs/dbraw/zinc/31/32/32/345313232.db2.gz RPPVQIPEDIFZJA-OLZOCXBDSA-N 2 0 236.359 2.190 20 0 BEADRP Cc1c[nH+]ccc1N[C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000158451538 345336908 /nfs/dbraw/zinc/33/69/08/345336908.db2.gz IVPOFJXYCKRAHG-VXGBXAGGSA-N 2 0 219.332 2.285 20 0 BEADRP CCC[NH+]1CCC([NH2+]CC(C)(C)OCC)CC1 ZINC000159157677 345411587 /nfs/dbraw/zinc/41/15/87/345411587.db2.gz DCQFVTLYDMCQDK-UHFFFAOYSA-N 2 0 242.407 2.266 20 0 BEADRP CCC[N@H+](C)C[C@@H]1CCN(Cc2ccn(C)c2)C1 ZINC000093742125 345663765 /nfs/dbraw/zinc/66/37/65/345663765.db2.gz ZPEHYEOGJMBMIJ-HNNXBMFYSA-N 2 0 249.402 2.189 20 0 BEADRP CC[C@H](C)[C@@H](C)[NH2+]CC1(COC)CC[NH2+]CC1 ZINC000319102837 259384578 /nfs/dbraw/zinc/38/45/78/259384578.db2.gz FJSOOYFTZHBRFO-QWHCGFSZSA-N 2 0 242.407 2.027 20 0 BEADRP [NH3+]CCCC[NH2+]C/C=C\c1ccccc1 ZINC000200655737 345729291 /nfs/dbraw/zinc/72/92/91/345729291.db2.gz QMXUPEOIQOABGZ-TWGQIWQCSA-N 2 0 204.317 2.028 20 0 BEADRP C[C@@H]1CC[NH+](C/C=C\C[N@H+]2CC[C@H](C)C2)C1 ZINC000201246902 345729674 /nfs/dbraw/zinc/72/96/74/345729674.db2.gz QRABICHAEBIDEA-LQOBQMSGSA-N 2 0 222.376 2.226 20 0 BEADRP c1ccc([C@H]2CC[N@H+]2C2CC[NH2+]CC2)cc1 ZINC000141962252 345861793 /nfs/dbraw/zinc/86/17/93/345861793.db2.gz FNHCIWSEFQNPSP-CQSZACIVSA-N 2 0 216.328 2.185 20 0 BEADRP CC1(c2ccccc2)CC[NH+](CCC[NH3+])CC1 ZINC000034483142 345835342 /nfs/dbraw/zinc/83/53/42/345835342.db2.gz WOYYKFDUYXSCQU-UHFFFAOYSA-N 2 0 232.371 2.389 20 0 BEADRP C[C@H](CC1CCC1)[NH2+]C[C@H]1CCCN1C ZINC000166878671 345925159 /nfs/dbraw/zinc/92/51/59/345925159.db2.gz LEHTWAWSCUCLHB-DGCLKSJQSA-N 2 0 210.365 2.249 20 0 BEADRP C(C1CC1)[NH+]1CCC([NH2+][C@H]2CC23CC3)CC1 ZINC000569685507 345975344 /nfs/dbraw/zinc/97/53/44/345975344.db2.gz WCJITYWFVFEKDV-ZDUSSCGKSA-N 2 0 220.360 2.003 20 0 BEADRP CC1=CC[C@H]([NH2+]CCCC[NH+](C)C)CC1 ZINC000380305232 345979819 /nfs/dbraw/zinc/97/98/19/345979819.db2.gz FKXVFBHDTCLSQE-ZDUSSCGKSA-N 2 0 210.365 2.417 20 0 BEADRP Cc1ncc(C[N@H+]2CCCC23CC[NH+](C)CC3)o1 ZINC000628243818 346207655 /nfs/dbraw/zinc/20/76/55/346207655.db2.gz HYWPKBVETPGBNE-UHFFFAOYSA-N 2 0 249.358 2.043 20 0 BEADRP CC(C)(C)C[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000236615975 346262235 /nfs/dbraw/zinc/26/22/35/346262235.db2.gz RWGZWCZFJLSINV-UHFFFAOYSA-N 2 0 224.392 2.497 20 0 BEADRP C1CC1C([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)C1CC1 ZINC000401136128 346276281 /nfs/dbraw/zinc/27/62/81/346276281.db2.gz QQSBTSOALYXOCL-HZSPNIEDSA-N 2 0 234.387 2.153 20 0 BEADRP Cc1cccc(C)c1C[N@@H+](C)C1CC[NH2+]CC1 ZINC000130884870 179033853 /nfs/dbraw/zinc/03/38/53/179033853.db2.gz QFADSRPPBCZKCV-UHFFFAOYSA-N 2 0 232.371 2.487 20 0 BEADRP Cc1ncc(C[N@H+](C)CCCn2ccnc2C)o1 ZINC000628280170 346290383 /nfs/dbraw/zinc/29/03/83/346290383.db2.gz TVYRAVFNSJSUMA-UHFFFAOYSA-N 2 0 248.330 2.010 20 0 BEADRP CC(C)C[NH2+]C[C@H](C)N1CCCC[C@@H]1C ZINC000052378553 346321713 /nfs/dbraw/zinc/32/17/13/346321713.db2.gz IKMDKKJRPXPMIM-STQMWFEESA-N 2 0 212.381 2.495 20 0 BEADRP Cc1cccc(C)c1C[NH2+]CCCC[NH3+] ZINC000126496283 179036484 /nfs/dbraw/zinc/03/64/84/179036484.db2.gz NKCUISAXFLLSLN-UHFFFAOYSA-N 2 0 206.333 2.132 20 0 BEADRP Cc1cccc(CC[NH2+][C@H]2CCC[NH2+]CC2)c1 ZINC000129221934 179060520 /nfs/dbraw/zinc/06/05/20/179060520.db2.gz OWGAGQGAVPKWGS-HNNXBMFYSA-N 2 0 232.371 2.269 20 0 BEADRP Cc1cccc(CC[NH2+][C@@H]2CCC[NH2+]CC2)c1 ZINC000129221685 179060689 /nfs/dbraw/zinc/06/06/89/179060689.db2.gz OWGAGQGAVPKWGS-OAHLLOKOSA-N 2 0 232.371 2.269 20 0 BEADRP Cc1cccc(C[N@H+](C)C[C@@H]2CC[NH2+]C2)c1 ZINC000051890076 179065587 /nfs/dbraw/zinc/06/55/87/179065587.db2.gz GCBMHOKMXYPVIX-CQSZACIVSA-N 2 0 218.344 2.036 20 0 BEADRP C[C@H](CC(F)(F)F)[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000300361732 346432247 /nfs/dbraw/zinc/43/22/47/346432247.db2.gz HHWRWHNIUYVHAH-VGMNWLOBSA-N 2 0 224.270 2.187 20 0 BEADRP Cc1cccc(C[N@H+]2CC[C@@H](C)[C@H](C[NH3+])C2)c1 ZINC000163425110 179080051 /nfs/dbraw/zinc/08/00/51/179080051.db2.gz PZQZIZURPBSUOU-UKRRQHHQSA-N 2 0 232.371 2.412 20 0 BEADRP Cc1cccc(C[N@H+]2CC[C@@H]([C@H](C)[NH3+])C2)c1 ZINC000228204708 179082126 /nfs/dbraw/zinc/08/21/26/179082126.db2.gz BPSLYPCHBVNWEJ-GXTWGEPZSA-N 2 0 218.344 2.164 20 0 BEADRP Cc1cccc(C[N@@H+]2CC[C@H]([NH3+])[C@H](C)C2)c1C ZINC000094338765 179081893 /nfs/dbraw/zinc/08/18/93/179081893.db2.gz NAHHXYBJRFSNQO-DOMZBBRYSA-N 2 0 232.371 2.473 20 0 BEADRP C[C@@H]1CCC(C)(C)[N@@H+]1CC1CC[NH2+]CC1 ZINC000641794126 362734599 /nfs/dbraw/zinc/73/45/99/362734599.db2.gz QOLKEFOVXDPSBW-LLVKDONJSA-N 2 0 210.365 2.249 20 0 BEADRP CC[NH+](CC)CCC[N@H+](C)[C@@H](C)C1CC1 ZINC000170794148 346451615 /nfs/dbraw/zinc/45/16/15/346451615.db2.gz SGKIQEQOQVEZRI-LBPRGKRZSA-N 2 0 212.381 2.449 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H]1CC[C@@H]1C1CCC1 ZINC000574981064 346488143 /nfs/dbraw/zinc/48/81/43/346488143.db2.gz WOFODTDJNBOYJT-CHWSQXEVSA-N 2 0 210.365 2.154 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H]1CCCc2c(O)cccc21 ZINC000574981069 346488295 /nfs/dbraw/zinc/48/82/95/346488295.db2.gz WRSPFTGTRBZDIK-CQSZACIVSA-N 2 0 248.370 2.359 20 0 BEADRP Cc1cnccc1CN1[C@H](C)[C@@H](C)CC[C@H]1C[NH3+] ZINC000641806383 362764678 /nfs/dbraw/zinc/76/46/78/362764678.db2.gz RIPAHFCEZSMLRI-LNSITVRQSA-N 2 0 247.386 2.338 20 0 BEADRP Cc1cccnc1CN1[C@@H](C)[C@@H](C)CC[C@H]1C[NH3+] ZINC000641809491 362765939 /nfs/dbraw/zinc/76/59/39/362765939.db2.gz QQADHQOFYCWAET-UBHSHLNASA-N 2 0 247.386 2.338 20 0 BEADRP Cc1ncccc1CN1[C@@H](C)[C@@H](C)CC[C@H]1C[NH3+] ZINC000641809496 362766648 /nfs/dbraw/zinc/76/66/48/362766648.db2.gz QRXSWCIHEBFFKW-WHOFXGATSA-N 2 0 247.386 2.338 20 0 BEADRP COC[C@@H](C)[NH2+]CCCC[N@@H+]1CCCC[C@@H]1C ZINC000345163074 365821811 /nfs/dbraw/zinc/82/18/11/365821811.db2.gz TXPQUMGADNBVOA-KGLIPLIRSA-N 2 0 242.407 2.266 20 0 BEADRP COc1cc(C)cc(C[NH2+][C@H]2CCC[C@H]([NH3+])C2)c1 ZINC000577124168 365828513 /nfs/dbraw/zinc/82/85/13/365828513.db2.gz IUUAMHIAKPQZGR-KBPBESRZSA-N 2 0 248.370 2.363 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]C1CCOCC1 ZINC000036303972 346658429 /nfs/dbraw/zinc/65/84/29/346658429.db2.gz NOCISYQKUCOJKV-CYBMUJFWSA-N 2 0 242.407 2.266 20 0 BEADRP Cc1cccc(NC[C@@H]2CCC[C@@H]([NH3+])C2)[nH+]1 ZINC000227669510 179146688 /nfs/dbraw/zinc/14/66/88/179146688.db2.gz GCRAFEBVXXFLET-VXGBXAGGSA-N 2 0 219.332 2.319 20 0 BEADRP COC[C@@H](C)C[NH2+]CCC[NH+](C(C)C)C(C)C ZINC000188094954 346752383 /nfs/dbraw/zinc/75/23/83/346752383.db2.gz MXSHSEIONCXLIU-AWEZNQCLSA-N 2 0 244.423 2.367 20 0 BEADRP Cc1cccc(OCC[NH2+][C@@H]2CCC[NH2+]CC2)c1 ZINC000129195937 179167458 /nfs/dbraw/zinc/16/74/58/179167458.db2.gz JHXIEHXZBFKVRI-CQSZACIVSA-N 2 0 248.370 2.106 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@@H]1C ZINC000387970943 347138534 /nfs/dbraw/zinc/13/85/34/347138534.db2.gz GBNXKDXUPSABQK-PDWCTOEPSA-N 2 0 224.392 2.351 20 0 BEADRP C[C@H](C[N@@H+]1C[C@@H]2CCC[C@@]2([NH3+])C1)C(C)(C)C ZINC000622004562 370655244 /nfs/dbraw/zinc/65/52/44/370655244.db2.gz QMBUBOVJDSBGKU-MBNYWOFBSA-N 2 0 224.392 2.482 20 0 BEADRP C[N@@H+]1CCCC[C@H]1CC[NH+]1CC=CCC1 ZINC000679323817 488333461 /nfs/dbraw/zinc/33/34/61/488333461.db2.gz LWLGGUUAECEBGR-ZDUSSCGKSA-N 2 0 208.349 2.123 20 0 BEADRP Cc1cccc([C@@H](C)[NH2+][C@@H]2CCN(C)C2)c1 ZINC000042545808 179183129 /nfs/dbraw/zinc/18/31/29/179183129.db2.gz RCKBNSQSWSVBMR-TZMCWYRMSA-N 2 0 218.344 2.350 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C2CC(F)(F)C2)[C@H]2CCC[C@H]21 ZINC000353589576 187372817 /nfs/dbraw/zinc/37/28/17/187372817.db2.gz QPASCCIQXJCPGO-GRYCIOLGSA-N 2 0 244.329 2.247 20 0 BEADRP [NH3+]CCOCC[N@@H+]1CCCC2(CCCCC2)C1 ZINC000357093422 187376807 /nfs/dbraw/zinc/37/68/07/187376807.db2.gz YHRKQJPXUIAWIK-UHFFFAOYSA-N 2 0 240.391 2.008 20 0 BEADRP Cc1ccccc1C[N@H+](C)C[C@@H]1CC[NH2+]C1 ZINC000051890028 179270303 /nfs/dbraw/zinc/27/03/03/179270303.db2.gz FROQAXUHRNBWRW-CYBMUJFWSA-N 2 0 218.344 2.036 20 0 BEADRP Cc1ccccc1CC[NH2+][C@H]1CCC[NH2+]CC1 ZINC000129309248 179267184 /nfs/dbraw/zinc/26/71/84/179267184.db2.gz QMFSSZPPLOSEOF-HNNXBMFYSA-N 2 0 232.371 2.269 20 0 BEADRP Cc1ccccc1C[N@H+]1CC[C@@H](C[NH+](C)C)C1 ZINC000172196756 179275136 /nfs/dbraw/zinc/27/51/36/179275136.db2.gz CLAZIRNDKZUPEC-AWEZNQCLSA-N 2 0 232.371 2.379 20 0 BEADRP Cc1ccccc1C[N@@H+]1CC[C@@](C)(C[NH3+])C1 ZINC000235794612 179276337 /nfs/dbraw/zinc/27/63/37/179276337.db2.gz RFWDTOXZWHSJPY-AWEZNQCLSA-N 2 0 218.344 2.166 20 0 BEADRP Cc1ccccc1C[N@H+]1CC[C@@H]([NH3+])C[C@@H]1C ZINC000049712986 179276891 /nfs/dbraw/zinc/27/68/91/179276891.db2.gz PRFUTTUEDNVVQT-GXTWGEPZSA-N 2 0 218.344 2.307 20 0 BEADRP Cc1ccccc1C[N@H+]1CC[C@@H]([C@H](C)[NH3+])C1 ZINC000228201693 179277191 /nfs/dbraw/zinc/27/71/91/179277191.db2.gz HXBYFTYRGJLPQR-GXTWGEPZSA-N 2 0 218.344 2.164 20 0 BEADRP C[C@@H](Cc1ccco1)[NH2+]C[C@H]1CCCCN1C ZINC000054241418 1172095563 /nfs/dbraw/zinc/09/55/63/1172095563.db2.gz YSAUIXNSOODLHC-QWHCGFSZSA-N 2 0 236.359 2.285 20 0 BEADRP Cc1ccccc1C[C@H](C)[NH2+][C@H]1CCCNC1 ZINC000043327216 179290459 /nfs/dbraw/zinc/29/04/59/179290459.db2.gz MZWRKSPXORDPLV-ZFWWWQNUSA-N 2 0 232.371 2.268 20 0 BEADRP Cc1ccccc1C[C@H](C)[NH2+][C@H]1CN(C)C[C@H]1C ZINC000358002529 179290631 /nfs/dbraw/zinc/29/06/31/179290631.db2.gz GHYJWQNQQKIGBZ-YCPHGPKFSA-N 2 0 246.398 2.466 20 0 BEADRP Cc1ccccc1C[C@H](C)[NH2+][C@@H]1CCCNC1 ZINC000043327214 179291431 /nfs/dbraw/zinc/29/14/31/179291431.db2.gz MZWRKSPXORDPLV-DZGCQCFKSA-N 2 0 232.371 2.268 20 0 BEADRP C[C@H]([NH2+]CCc1cncn1C)c1cccc(F)c1 ZINC000401792059 347902587 /nfs/dbraw/zinc/90/25/87/347902587.db2.gz XCXHTVAVBVUAGN-NSHDSACASA-N 2 0 247.317 2.453 20 0 BEADRP CS[C@H]1CC[C@H]1[NH2+]CCC[N@H+](C)CC(C)C ZINC000593647109 347926367 /nfs/dbraw/zinc/92/63/67/347926367.db2.gz WJJXMMPBUDBPJV-OLZOCXBDSA-N 2 0 244.448 2.448 20 0 BEADRP Cc1ccccc1[C@@H](C)[NH2+]CCCC[NH3+] ZINC000037714930 179320908 /nfs/dbraw/zinc/32/09/08/179320908.db2.gz HKLQEARVUTZIFD-GFCCVEGCSA-N 2 0 206.333 2.385 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+]CC1CC[NH2+]CC1 ZINC000577383045 365940504 /nfs/dbraw/zinc/94/05/04/365940504.db2.gz MIZUNZYDOUIHQE-STQMWFEESA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]1C[C@H](C)C[N@@H+](CCSCC[NH+](C)C)C1 ZINC000594889276 348123023 /nfs/dbraw/zinc/12/30/23/348123023.db2.gz AJEBHLHOBDLZQB-BETUJISGSA-N 2 0 244.448 2.259 20 0 BEADRP CCSCC[NH2+][C@H]1CCCN2CCCC[C@H]12 ZINC000594611918 348082491 /nfs/dbraw/zinc/08/24/91/348082491.db2.gz PGXTYLZATNFFGA-QWHCGFSZSA-N 2 0 242.432 2.346 20 0 BEADRP C[C@@H](CSCCF)[NH2+]CCC[NH+]1CCCC1 ZINC000595003072 348169255 /nfs/dbraw/zinc/16/92/55/348169255.db2.gz CRSFKTHLIHTJLV-LBPRGKRZSA-N 2 0 248.411 2.153 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+][C@@H](C)CSCCF ZINC000595018010 348170981 /nfs/dbraw/zinc/17/09/81/348170981.db2.gz ZMHSDIRHXFVIJF-QWRGUYRKSA-N 2 0 236.400 2.007 20 0 BEADRP Cc1cccnc1C[N@@H+]1CCCC[C@H]1CC[NH3+] ZINC000161853842 179371994 /nfs/dbraw/zinc/37/19/94/179371994.db2.gz XOPUJGVGOXSFQW-ZDUSSCGKSA-N 2 0 233.359 2.093 20 0 BEADRP CCSCC[N@@H+]1CCC[C@@]2(CC[NH+](C)C2)C1 ZINC000595508855 348265235 /nfs/dbraw/zinc/26/52/35/348265235.db2.gz YVXCRVKBVZAPEO-ZDUSSCGKSA-N 2 0 242.432 2.157 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H]2CCS[C@H]2C)CC1 ZINC000220841648 490149823 /nfs/dbraw/zinc/14/98/23/490149823.db2.gz KMMAYQOGBVTJCW-AAEUAGOBSA-N 2 0 242.432 2.344 20 0 BEADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+]C[C@@H]2C[C@H]2C)C1 ZINC000336691812 187393437 /nfs/dbraw/zinc/39/34/37/187393437.db2.gz WYZJPLUFHVWFMT-MCIONIFRSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CCN3CCCC[C@@H]23)CS1 ZINC000251741294 362905408 /nfs/dbraw/zinc/90/54/08/362905408.db2.gz CUGZNQJZDZAWFE-VOAKCMCISA-N 2 0 240.416 2.097 20 0 BEADRP COC1(C[NH2+][C@@H]2CC[N@H+](C)C(C)(C)C2)CCC1 ZINC000623487582 362911035 /nfs/dbraw/zinc/91/10/35/362911035.db2.gz IXYHMTWJFWMNNS-GFCCVEGCSA-N 2 0 240.391 2.018 20 0 BEADRP CC(C)(C)[NH2+]CC[NH2+][C@]1(C)CC=CCC1 ZINC000398396936 323185589 /nfs/dbraw/zinc/18/55/89/323185589.db2.gz ZMPQLUMXEZDHNK-CYBMUJFWSA-N 2 0 210.365 2.463 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+]C1CCC(F)(F)CC1 ZINC000390082119 538012006 /nfs/dbraw/zinc/01/20/06/538012006.db2.gz BVPIWKBMLKJYPB-JTQLQIEISA-N 2 0 234.334 2.494 20 0 BEADRP Cc1c[nH+]ccc1NC[C@@H](C1CC1)[NH+](C)C ZINC000309654177 179711252 /nfs/dbraw/zinc/71/12/52/179711252.db2.gz PCGHQWRZMROCDX-ZDUSSCGKSA-N 2 0 219.332 2.142 20 0 BEADRP COC1([C@H](C)[NH2+]CCCC[NH+](C)C)CCCC1 ZINC000421824158 192387216 /nfs/dbraw/zinc/38/72/16/192387216.db2.gz HIDMBLHUDSZCQH-ZDUSSCGKSA-N 2 0 242.407 2.266 20 0 BEADRP Cc1csc(C[NH2+][C@H]2CCC[C@@H]2C[NH3+])c1 ZINC000344647030 179779140 /nfs/dbraw/zinc/77/91/40/179779140.db2.gz WRUFZZUWJUCIIE-PWSUYJOCSA-N 2 0 224.373 2.274 20 0 BEADRP COC(C)(C)[C@H](C)[NH2+]C1CCC([NH+](C)C)CC1 ZINC000421881766 192399009 /nfs/dbraw/zinc/39/90/09/192399009.db2.gz RNJSPRVCMUKKDN-HIFPTAJRSA-N 2 0 242.407 2.262 20 0 BEADRP C[N@H+](CC1CC(C)(C)C1)C1CC[NH2+]CC1 ZINC000530211975 323212139 /nfs/dbraw/zinc/21/21/39/323212139.db2.gz PMTRQIFTULTFRI-UHFFFAOYSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1CSC[C@H]1[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623521704 362943049 /nfs/dbraw/zinc/94/30/49/362943049.db2.gz CJTQDWCIBSNVHW-IJLUTSLNSA-N 2 0 242.432 2.200 20 0 BEADRP CCc1ccc(C[N@@H+]2CC[C@@H]([C@H](C)[NH3+])C2)s1 ZINC000252782512 349204527 /nfs/dbraw/zinc/20/45/27/349204527.db2.gz NJYPBLKGXSXSQP-WDEREUQCSA-N 2 0 238.400 2.480 20 0 BEADRP CSC1CC[NH+](CCC2CC[NH2+]CC2)CC1 ZINC000300885886 349414199 /nfs/dbraw/zinc/41/41/99/349414199.db2.gz TWDGPHRWGJAEIP-UHFFFAOYSA-N 2 0 242.432 2.204 20 0 BEADRP Cc1nc([C@H](C)[NH2+]CCCC[NH+](C)C)cs1 ZINC000045663927 180048275 /nfs/dbraw/zinc/04/82/75/180048275.db2.gz CHPRHUNWXQMPDV-JTQLQIEISA-N 2 0 241.404 2.444 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]C[C@@H](O)C1CCCCC1 ZINC000422708194 192437970 /nfs/dbraw/zinc/43/79/70/192437970.db2.gz XKJXNMREQJBAAE-GXTWGEPZSA-N 2 0 242.407 2.035 20 0 BEADRP CC(C)n1cc([C@H](C)[NH2+][C@H](C)CCC[NH3+])cn1 ZINC000422716660 192441153 /nfs/dbraw/zinc/44/11/53/192441153.db2.gz UVUMOLPHXXGASQ-NEPJUHHUSA-N 2 0 238.379 2.242 20 0 BEADRP CCC1CCC(C[NH2+][C@H](C)C2C[NH2+]C2)CC1 ZINC000422722751 192442348 /nfs/dbraw/zinc/44/23/48/192442348.db2.gz YWTDHNGHKSCNSJ-PNESKVBLSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H]([NH3+])[C@H](C)[NH2+]C(C1CCC1)C1CCC1 ZINC000324774579 323283216 /nfs/dbraw/zinc/28/32/16/323283216.db2.gz DTPWIVULHWLFIP-UWVGGRQHSA-N 2 0 210.365 2.281 20 0 BEADRP Cc1ncc(CN[C@@H]2CC[N@H+](C)[C@@H](C)C2)s1 ZINC000227375095 180156938 /nfs/dbraw/zinc/15/69/38/180156938.db2.gz JHGWWOMRUAEPCI-GXSJLCMTSA-N 2 0 239.388 2.024 20 0 BEADRP CC(C)[NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000053656073 490374923 /nfs/dbraw/zinc/37/49/23/490374923.db2.gz TXODJEAQRABGOV-CYBMUJFWSA-N 2 0 210.365 2.106 20 0 BEADRP C1[C@@H]2[C@H]1CCC[C@@H]2[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000306073399 191073883 /nfs/dbraw/zinc/07/38/83/191073883.db2.gz DNFJOCUWIWKGKC-LXFSFDBISA-N 2 0 234.387 2.391 20 0 BEADRP Cc1ncc(C[NH2+]C[C@H]2CCC[C@H]([NH3+])C2)s1 ZINC000070503291 180152451 /nfs/dbraw/zinc/15/24/51/180152451.db2.gz KQSPSYYFWRJPCM-QWRGUYRKSA-N 2 0 239.388 2.059 20 0 BEADRP CC[C@@H]([NH3+])CN[C@@H](C)c1ccc(C)cc1 ZINC000223052434 350264349 /nfs/dbraw/zinc/26/43/49/350264349.db2.gz LKMVYXQPYRKHDN-WCQYABFASA-N 2 0 206.333 2.383 20 0 BEADRP CCCC[C@@H](COC)[NH2+]C1CCC(C[NH3+])CC1 ZINC000422762217 192457363 /nfs/dbraw/zinc/45/73/63/192457363.db2.gz SCXCREXFUBCEHE-RUXDESIVSA-N 2 0 242.407 2.299 20 0 BEADRP CC[C@@H](C)[NH2+]C[C@H](C)C[NH+]1CCCCC1 ZINC000038041623 350302941 /nfs/dbraw/zinc/30/29/41/350302941.db2.gz BJQOVXMHKXNMNK-QWHCGFSZSA-N 2 0 212.381 2.497 20 0 BEADRP Cc1ncsc1C[NH2+]C[C@H]1CCC[C@H]([NH3+])C1 ZINC000070838269 180322641 /nfs/dbraw/zinc/32/26/41/180322641.db2.gz PVOXDAFCPDJUEA-QWRGUYRKSA-N 2 0 239.388 2.059 20 0 BEADRP CC[C@@H]1CCC[N@@H+]1CC[C@@H]1CCC[NH+]1C ZINC000336645800 350415516 /nfs/dbraw/zinc/41/55/16/350415516.db2.gz IYLMZJBEEUMYET-OLZOCXBDSA-N 2 0 210.365 2.345 20 0 BEADRP CO[C@@H]1CCC[C@H]1[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623539613 362958386 /nfs/dbraw/zinc/95/83/86/362958386.db2.gz WODMTWJTWAQTRQ-YNEHKIRRSA-N 2 0 240.391 2.016 20 0 BEADRP CO[C@@H](C)[C@H](C)[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000163250311 350511790 /nfs/dbraw/zinc/51/17/90/350511790.db2.gz IYADKMWGYABFRX-RYUDHWBXSA-N 2 0 242.407 2.262 20 0 BEADRP COc1cccc2c1CCC[C@@H]2[NH2+]C[C@H](C)C[NH3+] ZINC000577482270 365963334 /nfs/dbraw/zinc/96/33/34/365963334.db2.gz YTSBFUCZKATLBP-RISCZKNCSA-N 2 0 248.370 2.257 20 0 BEADRP CC(C)(C)[C@@H]1CC[N@H+](C[C@@]2(C)CC[NH2+]C2)C1 ZINC000228736683 191107324 /nfs/dbraw/zinc/10/73/24/191107324.db2.gz HCTCUBLMJXWPCU-OCCSQVGLSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+][C@H]2CC[N@H+](C)C(C)(C)C2)O1 ZINC000623545186 362965152 /nfs/dbraw/zinc/96/51/52/362965152.db2.gz AAXAGOUQTLARPD-FRRDWIJNSA-N 2 0 240.391 2.016 20 0 BEADRP CC[C@@H](C)C[N@@H+]1CC[C@@]2(C1)CCC[NH2+]C2 ZINC000335619800 538097771 /nfs/dbraw/zinc/09/77/71/538097771.db2.gz NASYOPGEMZCVST-OLZOCXBDSA-N 2 0 210.365 2.108 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]CCCC(F)(F)F)C1 ZINC000123990071 350678624 /nfs/dbraw/zinc/67/86/24/350678624.db2.gz UDCYSSTZDPOBOQ-DTWKUNHWSA-N 2 0 224.270 2.188 20 0 BEADRP C[C@H]1C[C@H](C[NH3+])C[N@@H+]1C[C@H]1CCCC[C@H]1C ZINC000346689620 365992573 /nfs/dbraw/zinc/99/25/73/365992573.db2.gz ZQPUSVQSLFJNHX-XJFOESAGSA-N 2 0 224.392 2.482 20 0 BEADRP C([NH2+]C1CC[NH2+]CC1)C1CCCCCC1 ZINC000098177366 350729504 /nfs/dbraw/zinc/72/95/04/350729504.db2.gz JDTAUVMQUAUPHT-UHFFFAOYSA-N 2 0 210.365 2.298 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)C1CC1 ZINC000252703302 538099324 /nfs/dbraw/zinc/09/93/24/538099324.db2.gz SDFPXNQBIRETAY-BNOWGMLFSA-N 2 0 222.376 2.249 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+][C@H]2COC(C)(C)C2)CC1(C)C ZINC000623561960 362986304 /nfs/dbraw/zinc/98/63/04/362986304.db2.gz DAXNVZBBCLDNEG-VXGBXAGGSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@H]([NH2+]Cc1cccc2c1CC[NH2+]C2)C1CC1 ZINC000398039487 362989978 /nfs/dbraw/zinc/98/99/78/362989978.db2.gz KLNIHXWGZDOVRD-NSHDSACASA-N 2 0 230.355 2.220 20 0 BEADRP CC(C)COCCC[NH2+][C@@H]1CC[NH2+]CC[C@H]1C ZINC000422795073 192472012 /nfs/dbraw/zinc/47/20/12/192472012.db2.gz ZPFIJJYQQFAXNM-ZIAGYGMSSA-N 2 0 242.407 2.027 20 0 BEADRP CCCN1CC[C@H]([NH2+][C@H](C)[C@@H]2C[C@H]2C2CC2)C1 ZINC000623572977 363003394 /nfs/dbraw/zinc/00/33/94/363003394.db2.gz TZYQNNRHEUOHEK-UNQGMJICSA-N 2 0 236.403 2.495 20 0 BEADRP CCc1nc(C)cc(N[C@@H]2CC[N@@H+](C(C)C)C2)n1 ZINC000283786079 351069740 /nfs/dbraw/zinc/06/97/40/351069740.db2.gz RESOXVJTFCSILV-GFCCVEGCSA-N 2 0 248.374 2.242 20 0 BEADRP CC(C)[N@@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000336650895 191133434 /nfs/dbraw/zinc/13/34/34/191133434.db2.gz UFIONESPTZCDTM-ZDUSSCGKSA-N 2 0 210.365 2.059 20 0 BEADRP Cc1ccc(C[NH2+][C@H](C)C[C@H](C)[NH3+])cc1F ZINC000422800194 192472975 /nfs/dbraw/zinc/47/29/75/192472975.db2.gz ZNMKABDWVCFMIT-WDEREUQCSA-N 2 0 224.323 2.350 20 0 BEADRP CC[NH+]1CCC(N(C)Cc2ccns2)CC1 ZINC000637887510 351754904 /nfs/dbraw/zinc/75/49/04/351754904.db2.gz UFEJWBFQFUMWGN-UHFFFAOYSA-N 2 0 239.388 2.059 20 0 BEADRP CCN1CCC([N@H+](C)C[C@](C)(CC)OC)CC1 ZINC000637886897 351756522 /nfs/dbraw/zinc/75/65/22/351756522.db2.gz MGWZPFMPDAIEJJ-AWEZNQCLSA-N 2 0 242.407 2.218 20 0 BEADRP C[NH+](C)C1CC[NH+](CC2CCSCC2)CC1 ZINC000637927998 351802973 /nfs/dbraw/zinc/80/29/73/351802973.db2.gz RYMLATRXBWNXNG-UHFFFAOYSA-N 2 0 242.432 2.156 20 0 BEADRP CCCCOCC[N@@H+]1C[C@H](C[NH3+])[C@H](C)C[C@H]1C ZINC000397338384 351823302 /nfs/dbraw/zinc/82/33/02/351823302.db2.gz ZAYQNTLECAVDDW-MCIONIFRSA-N 2 0 242.407 2.108 20 0 BEADRP CC[C@H](C[NH2+]C[C@@](C)(CC)OC)N1CCCC1 ZINC000638353526 352167763 /nfs/dbraw/zinc/16/77/63/352167763.db2.gz APBFZMRNCQUGEX-ZIAGYGMSSA-N 2 0 242.407 2.266 20 0 BEADRP C([NH2+][C@H]1CCN2CCCC[C@@H]12)[C@@H]1C[C@H]2C[C@H]2C1 ZINC000638368362 352179573 /nfs/dbraw/zinc/17/95/73/352179573.db2.gz JQJCAVJUMOGHIF-AICCOOGYSA-N 2 0 234.387 2.249 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H]2CS[C@@H](C)C2)C1 ZINC000638409122 352218618 /nfs/dbraw/zinc/21/86/18/352218618.db2.gz JIAWTVFEPBANFB-YNEHKIRRSA-N 2 0 242.432 2.202 20 0 BEADRP CC(C)(C)CC[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000414916686 352270509 /nfs/dbraw/zinc/27/05/09/352270509.db2.gz QCOOLQXKRRZBRX-ZDUSSCGKSA-N 2 0 212.381 2.402 20 0 BEADRP C[C@@H]1CCC[C@H]1[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000414918231 352273242 /nfs/dbraw/zinc/27/32/42/352273242.db2.gz TWEWCEVDACGCRO-JHJVBQTASA-N 2 0 210.365 2.154 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+]C[C@@H]1CCC[C@@H](C)C1 ZINC000414955619 352375152 /nfs/dbraw/zinc/37/51/52/352375152.db2.gz MIMRHDPVBFORFV-JHJVBQTASA-N 2 0 212.381 2.400 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@@H](C)[C@H]2CC2(F)F)CC1 ZINC000638562673 352387912 /nfs/dbraw/zinc/38/79/12/352387912.db2.gz AUWSPQIUGKFBEO-CMPLNLGQSA-N 2 0 246.345 2.352 20 0 BEADRP Cc1nccn1CCCNc1cc(C)nc(C)n1 ZINC000266265220 352476024 /nfs/dbraw/zinc/47/60/24/352476024.db2.gz PYYHKUFUYCUAEE-UHFFFAOYSA-N 2 0 245.330 2.101 20 0 BEADRP C[N@H+](CCCC[NH2+]Cc1cccnc1)C1CC1 ZINC000453591606 352586627 /nfs/dbraw/zinc/58/66/27/352586627.db2.gz CVZTUPMWMXJPJH-UHFFFAOYSA-N 2 0 233.359 2.046 20 0 BEADRP C[C@@H](C[NH+]1CCC([NH3+])CC1)c1ccccc1 ZINC000040240922 352594362 /nfs/dbraw/zinc/59/43/62/352594362.db2.gz SKVZZWBTPAMAJC-LBPRGKRZSA-N 2 0 218.344 2.213 20 0 BEADRP CCOc1ccccc1C[NH+]1CCC(C[NH3+])CC1 ZINC000044511890 352653634 /nfs/dbraw/zinc/65/36/34/352653634.db2.gz OLDBYISZCVRLHO-UHFFFAOYSA-N 2 0 248.370 2.256 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H](C)C1(OC)CCC1 ZINC000412025889 191239788 /nfs/dbraw/zinc/23/97/88/191239788.db2.gz QXYQEBLAKZUAFX-CYBMUJFWSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@H]1Cc2ccccc2CN1CC(C)(C)[NH3+] ZINC000334318873 352949645 /nfs/dbraw/zinc/94/96/45/352949645.db2.gz XCTCCTFMUYCBOT-NSHDSACASA-N 2 0 218.344 2.171 20 0 BEADRP CO[C@@H](C[NH2+][C@@H](C)CCCC[NH3+])C(C)(C)C ZINC000422812126 192476308 /nfs/dbraw/zinc/47/63/08/192476308.db2.gz PYALAPYLOZYXGG-RYUDHWBXSA-N 2 0 230.396 2.155 20 0 BEADRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]CC1(c2ccccc2)CC1 ZINC000422816192 192478030 /nfs/dbraw/zinc/47/80/30/192478030.db2.gz ZIENQSPDUCPRSK-HIFRSBDPSA-N 2 0 244.382 2.435 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H](C)[C@H]1CC1(F)F ZINC000638862734 353032423 /nfs/dbraw/zinc/03/24/23/353032423.db2.gz HSCWFGOFJVEEPL-WDEREUQCSA-N 2 0 234.334 2.352 20 0 BEADRP C(CC[NH2+]CC1CC1)CC[NH+]1CCCC1 ZINC000339496423 188084390 /nfs/dbraw/zinc/08/43/90/188084390.db2.gz BZTAMKBIBJSHIK-UHFFFAOYSA-N 2 0 210.365 2.252 20 0 BEADRP C[C@@H]([NH2+]CC1(C)CC[NH+](C)CC1)[C@H]1CC1(F)F ZINC000638956283 353169435 /nfs/dbraw/zinc/16/94/35/353169435.db2.gz HTTMKZTVXHFJKX-GHMZBOCLSA-N 2 0 246.345 2.352 20 0 BEADRP CCc1ccc2[nH+]ccc(NCCCC[NH3+])c2c1 ZINC000420228756 192179419 /nfs/dbraw/zinc/17/94/19/192179419.db2.gz FOUIZAYNFUWYSE-UHFFFAOYSA-N 2 0 243.354 2.370 20 0 BEADRP CC[NH+]1CCC([NH2+]CC2CC(F)(F)C2)CC1 ZINC000336759165 353168727 /nfs/dbraw/zinc/16/87/27/353168727.db2.gz ITPWTXUXEBCALL-UHFFFAOYSA-N 2 0 232.318 2.106 20 0 BEADRP Cc1cc(C)cc(C[NH2+]CCC[NH+](C)C)c1 ZINC000037978586 188116207 /nfs/dbraw/zinc/11/62/07/188116207.db2.gz WJXRNRVKBNMJNP-UHFFFAOYSA-N 2 0 220.360 2.345 20 0 BEADRP CC(C)[NH+](CCCn1ccnc1)C(C)C ZINC000090215723 188144569 /nfs/dbraw/zinc/14/45/69/188144569.db2.gz IVNWSQVDZUTPTL-UHFFFAOYSA-N 2 0 209.337 2.392 20 0 BEADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+]C2CCCC2)C1 ZINC000040620886 188137129 /nfs/dbraw/zinc/13/71/29/188137129.db2.gz LSMYJMRLITYEHD-LBPRGKRZSA-N 2 0 210.365 2.249 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@H]2CC2(C)C)CC1 ZINC000045115414 188153024 /nfs/dbraw/zinc/15/30/24/188153024.db2.gz ZXLCLHCFNDDDGL-LBPRGKRZSA-N 2 0 210.365 2.247 20 0 BEADRP CC(C)C[C@H](C)C[N@@H+]1C[C@@H]2CC[C@H]([NH3+])[C@H]2C1 ZINC000336653170 188163462 /nfs/dbraw/zinc/16/34/62/188163462.db2.gz FZYLVRLPFGTQPB-XUXIUFHCSA-N 2 0 224.392 2.338 20 0 BEADRP CC(C)[C@H]1CCCC[C@@H]1[NH2+]C[C@H](C)C[NH3+] ZINC000336693625 188165581 /nfs/dbraw/zinc/16/55/81/188165581.db2.gz NJKIIFQVBKJLGC-UPJWGTAASA-N 2 0 212.381 2.386 20 0 BEADRP CC(C)=CCC[NH2+][C@@H]1CC[N@@H+](C)C[C@H]1C ZINC000309145768 188167088 /nfs/dbraw/zinc/16/70/88/188167088.db2.gz VCOQMJZTAISERF-CHWSQXEVSA-N 2 0 210.365 2.273 20 0 BEADRP Cc1ccc(CCC[NH2+]C[C@H]2CCCOC2)cn1 ZINC000354125888 188186241 /nfs/dbraw/zinc/18/62/41/188186241.db2.gz UOJMMFNZTYGCJD-OAHLLOKOSA-N 2 0 248.370 2.339 20 0 BEADRP CC(C)[N@H+](C)CCN[C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000132090222 188221988 /nfs/dbraw/zinc/22/19/88/188221988.db2.gz JUSCZQKTPWFNLG-GJZGRUSLSA-N 2 0 247.386 2.061 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC=CCC1)C1CC[NH+](C)CC1 ZINC000084066305 538113176 /nfs/dbraw/zinc/11/31/76/538113176.db2.gz XVJKEFSSQMZRQP-OCCSQVGLSA-N 2 0 222.376 2.415 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CC2CC[NH2+]CC2)C[C@@H](C)C1 ZINC000251781961 353288147 /nfs/dbraw/zinc/28/81/47/353288147.db2.gz FOJDBSREJFFJFK-IMRBUKKESA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1C[C@@H](C[NH3+])C[N@@H+]1C[C@H]1CCC[C@@H](C)C1 ZINC000251970277 353293382 /nfs/dbraw/zinc/29/33/82/353293382.db2.gz YCWOXAIQSXHGFV-MQYQWHSLSA-N 2 0 224.392 2.482 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](C[C@@H]2CCCC[C@H]2C)C1 ZINC000252128734 353297073 /nfs/dbraw/zinc/29/70/73/353297073.db2.gz KLFHTYXLSZCLRG-RDBSUJKOSA-N 2 0 224.392 2.354 20 0 BEADRP CCc1ccccc1C[N@@H+]1CC[C@H]([C@H](C)[NH3+])C1 ZINC000252755951 353304352 /nfs/dbraw/zinc/30/43/52/353304352.db2.gz BPGOMUXXMHZNTA-JSGCOSHPSA-N 2 0 232.371 2.418 20 0 BEADRP CCc1nc(C)cc(NC[C@H](C)[N@H+](C)C2CC2)n1 ZINC000288006485 353596251 /nfs/dbraw/zinc/59/62/51/353596251.db2.gz SEKOCNTVKJBAPD-NSHDSACASA-N 2 0 248.374 2.242 20 0 BEADRP CC1(C)CC[N@H+](C[C@@H]2CCC[NH2+]C2)CCS1 ZINC000231047867 353560773 /nfs/dbraw/zinc/56/07/73/353560773.db2.gz YETSKADZOAQYGM-GFCCVEGCSA-N 2 0 242.432 2.204 20 0 BEADRP Fc1ccc2c(c1)C[N@@H+](CC1CC[NH2+]CC1)CC2 ZINC000297413217 180987171 /nfs/dbraw/zinc/98/71/71/180987171.db2.gz NZLXECRLDJSFLO-UHFFFAOYSA-N 2 0 248.345 2.183 20 0 BEADRP Fc1cccc2c1C[N@H+](CC1CC[NH2+]CC1)CC2 ZINC000261799828 181007370 /nfs/dbraw/zinc/00/73/70/181007370.db2.gz GVZJBVIKAWHHDJ-UHFFFAOYSA-N 2 0 248.345 2.183 20 0 BEADRP C[C@H](c1cccnc1)N(C)C[C@@H]1CCC[NH2+]C1 ZINC000220425963 353836376 /nfs/dbraw/zinc/83/63/76/353836376.db2.gz XUEFFTWWMYPORX-CHWSQXEVSA-N 2 0 233.359 2.074 20 0 BEADRP C[C@H]([NH2+]CC1CC[NH+](C)CC1)C1CC(F)(F)C1 ZINC000529537881 324329546 /nfs/dbraw/zinc/32/95/46/324329546.db2.gz IGRLRWNJLZJAEL-JTQLQIEISA-N 2 0 246.345 2.352 20 0 BEADRP C[C@H]1CC[N@H+](CCc2cncn2C)CC1(C)C ZINC000334562189 354117536 /nfs/dbraw/zinc/11/75/36/354117536.db2.gz JTFDKXUDVKLGES-LBPRGKRZSA-N 2 0 235.375 2.331 20 0 BEADRP C[C@@H]1CCC[C@@H]1C[NH2+][C@@H]1CCC[C@@H]1C[NH3+] ZINC000230664921 363318236 /nfs/dbraw/zinc/31/82/36/363318236.db2.gz XWFMTTYWDJUQSL-FDYHWXHSSA-N 2 0 210.365 2.140 20 0 BEADRP CC[C@@H](C)[NH2+]Cc1cn(-c2cc[nH+]cc2)nc1C ZINC000344126267 354145287 /nfs/dbraw/zinc/14/52/87/354145287.db2.gz GRTLNHBOJSZPKC-LLVKDONJSA-N 2 0 244.342 2.464 20 0 BEADRP CCC[C@@H](C[N@H+](CC)CCC[NH+](C)C)OC ZINC000639175924 354210428 /nfs/dbraw/zinc/21/04/28/354210428.db2.gz RMTHBDRQEODSHV-ZDUSSCGKSA-N 2 0 230.396 2.075 20 0 BEADRP CCC[C@H](C[N@H+](C)[C@@H]1CCN(C)C[C@@H]1C)OC ZINC000639180421 354278429 /nfs/dbraw/zinc/27/84/29/354278429.db2.gz WSDMMQOMWOFQNG-BFHYXJOUSA-N 2 0 242.407 2.074 20 0 BEADRP c1nc2c([nH]1)C[C@H]([NH2+]C1CC3(CCC3)C1)CC2 ZINC000334646628 354436535 /nfs/dbraw/zinc/43/65/35/354436535.db2.gz MAFQIHLLTXXUEK-SNVBAGLBSA-N 2 0 231.343 2.189 20 0 BEADRP CC[N@H+](CCC1CC1)C[C@@H]1CCC[NH2+]C1 ZINC000233466754 363403731 /nfs/dbraw/zinc/40/37/31/363403731.db2.gz PVOONYAXBSNEBW-CYBMUJFWSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@@H](CC[NH3+])[NH2+]Cc1ccc(Cl)c(F)c1 ZINC000235087618 363436854 /nfs/dbraw/zinc/43/68/54/363436854.db2.gz WDPVBOZYHHDRFD-QMMMGPOBSA-N 2 0 230.714 2.306 20 0 BEADRP CC[C@H](C[NH2+][C@H](C)[C@@H]1CCCO1)N1CCCC1 ZINC000346468353 354954634 /nfs/dbraw/zinc/95/46/34/354954634.db2.gz AISDELLJPJYLDX-MCIONIFRSA-N 2 0 240.391 2.018 20 0 BEADRP C[NH+](C)[C@H]1CCC[N@H+](C[C@H]2CCSC2)CC1 ZINC000335196461 355029828 /nfs/dbraw/zinc/02/98/28/355029828.db2.gz WHQAXQVMOZSSMG-OLZOCXBDSA-N 2 0 242.432 2.156 20 0 BEADRP COc1ccc([C@@H](C)C[NH+]2CCC([NH3+])CC2)cc1 ZINC000346657061 355004750 /nfs/dbraw/zinc/00/47/50/355004750.db2.gz SXLVAPNKVKOAGA-LBPRGKRZSA-N 2 0 248.370 2.222 20 0 BEADRP C[NH2+]CCN(C)Cc1cc(C)c2ncccc2c1 ZINC000346667838 355007437 /nfs/dbraw/zinc/00/74/37/355007437.db2.gz FGKHZJNYTNCZIY-UHFFFAOYSA-N 2 0 243.354 2.194 20 0 BEADRP Cc1noc(C)c1CN[C@@H]1CCCCC[C@@H]1[NH3+] ZINC000335193009 355025981 /nfs/dbraw/zinc/02/59/81/355025981.db2.gz HMRCPCJNTNPNTI-QWHCGFSZSA-N 2 0 237.347 2.041 20 0 BEADRP C[C@@H]([NH2+]C1CCC(C)(C)CC1)C1C[NH2+]C1 ZINC000335217479 355056486 /nfs/dbraw/zinc/05/64/86/355056486.db2.gz OIFSHMBTGXLBGI-SNVBAGLBSA-N 2 0 210.365 2.153 20 0 BEADRP CCCO[C@H]1CCC[N@H+](CC(C)(C)[NH3+])CC1 ZINC000346842739 355134886 /nfs/dbraw/zinc/13/48/86/355134886.db2.gz IKYBMDNGJAWNCM-LBPRGKRZSA-N 2 0 228.380 2.005 20 0 BEADRP C[C@@H]1C[C@H](C)CC[N@H+](C[C@@H]2CCC[NH2+]C2)C1 ZINC000346972750 355208171 /nfs/dbraw/zinc/20/81/71/355208171.db2.gz HXPYBTDNWFWDFX-MGPQQGTHSA-N 2 0 224.392 2.354 20 0 BEADRP C1CC1[C@H]1CCCC[C@H]1[NH2+]C1CC[NH2+]CC1 ZINC000335253590 355210913 /nfs/dbraw/zinc/21/09/13/355210913.db2.gz YJCOYMSYPQORNK-ZIAGYGMSSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]1CCC[C@H](C)[N@H+](C[C@H]2CCC[NH2+]C2)C1 ZINC000346965937 355172975 /nfs/dbraw/zinc/17/29/75/355172975.db2.gz CELFRZSTANHTBY-RDBSUJKOSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)([NH3+])C[N@H+](C[C@H]1CCCO1)C1CCCC1 ZINC000346999349 355196712 /nfs/dbraw/zinc/19/67/12/355196712.db2.gz GAUQKWRAUZWZJE-CYBMUJFWSA-N 2 0 240.391 2.147 20 0 BEADRP C[C@@H]1C[N@H+](CC2CC[NH2+]CC2)[C@@H]2CCCC[C@@H]21 ZINC000347000574 355198054 /nfs/dbraw/zinc/19/80/54/355198054.db2.gz GMIODMFGYKLEMG-BPLDGKMQSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CCCC[N@H+](C)C2CC2)CS1 ZINC000639244743 355248123 /nfs/dbraw/zinc/24/81/23/355248123.db2.gz OQLHIIMSVQKORD-NWDGAFQWSA-N 2 0 242.432 2.344 20 0 BEADRP CC1(C)CCCN1CC[NH2+]CCC[C@@H]1CCO1 ZINC000639241836 355227902 /nfs/dbraw/zinc/22/79/02/355227902.db2.gz JLZFLSZMTABOLB-CYBMUJFWSA-N 2 0 240.391 2.020 20 0 BEADRP CC[C@@](C)(C[NH2+]CCCC[N@H+](C)C1CC1)OC ZINC000639243873 355232137 /nfs/dbraw/zinc/23/21/37/355232137.db2.gz DUMNFCKJIMAFFU-AWEZNQCLSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@H]([NH2+]CCCC[N@H+](C)C1CC1)[C@@H]1CC1(F)F ZINC000639245160 355240739 /nfs/dbraw/zinc/24/07/39/355240739.db2.gz STCMHMLOQKCQTF-JQWIXIFHSA-N 2 0 246.345 2.494 20 0 BEADRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)[C@H]1CC1(F)F ZINC000639245728 355275088 /nfs/dbraw/zinc/27/50/88/355275088.db2.gz BDXPBJKEAAFUSQ-IYJVRESMSA-N 2 0 244.329 2.245 20 0 BEADRP Cc1c[nH+]ccc1NCCCC[N@@H+](C)C1CC1 ZINC000413346389 191373741 /nfs/dbraw/zinc/37/37/41/191373741.db2.gz HTMWTBBHTNYJSJ-UHFFFAOYSA-N 2 0 233.359 2.098 20 0 BEADRP CC[C@](C)(C[NH2+]CC[C@H]1CCC[N@H+](C)C1)OC ZINC000639258129 355305014 /nfs/dbraw/zinc/30/50/14/355305014.db2.gz ZWRVMHPHBFYMFM-ZIAGYGMSSA-N 2 0 242.407 2.123 20 0 BEADRP CCC1CC([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000335516251 355311998 /nfs/dbraw/zinc/31/19/98/355311998.db2.gz JOBQBKJKPZQEQA-FMNWTUGISA-N 2 0 208.349 2.048 20 0 BEADRP C[NH+](C)C1CCC([NH2+]CCC[C@H]2CCO2)CC1 ZINC000639277395 355355634 /nfs/dbraw/zinc/35/56/34/355355634.db2.gz VUZSAHPVRICOSC-RUXDESIVSA-N 2 0 240.391 2.018 20 0 BEADRP CC[NH+](CC)CCOCC[NH2+][C@H](C)C1(C)CC1 ZINC000349696691 355413394 /nfs/dbraw/zinc/41/33/94/355413394.db2.gz VIHZSSDHUXUHQV-CYBMUJFWSA-N 2 0 242.407 2.123 20 0 BEADRP c1ccc(OCCCC[NH2+]C2CC[NH2+]CC2)cc1 ZINC000414778345 191566803 /nfs/dbraw/zinc/56/68/03/191566803.db2.gz HZAJYTXKDPTUDC-UHFFFAOYSA-N 2 0 248.370 2.187 20 0 BEADRP CC(C)CCC[NH2+][C@H](C)[C@@H]1CCC[NH2+]C1 ZINC000414825838 191587598 /nfs/dbraw/zinc/58/75/98/191587598.db2.gz UJEWTUBPAPQBDW-CHWSQXEVSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H](C[NH2+]CC[C@@H]1CC[NH2+]C1)Cc1ccccc1 ZINC000414832253 191591893 /nfs/dbraw/zinc/59/18/93/191591893.db2.gz OGFPOXAUPOMCSF-GDBMZVCRSA-N 2 0 246.398 2.454 20 0 BEADRP CC(C)[C@@H]1C[C@@H]([NH2+][C@H](C)CCCC[NH3+])CCO1 ZINC000415017566 191651300 /nfs/dbraw/zinc/65/13/00/191651300.db2.gz SKHZBWLVSVWEIG-RDBSUJKOSA-N 2 0 242.407 2.297 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CC[C@@H](C[NH3+])C1 ZINC000415051889 191653754 /nfs/dbraw/zinc/65/37/54/191653754.db2.gz ZZAXNKSEWHZXJU-LPWJVIDDSA-N 2 0 210.365 2.282 20 0 BEADRP Cc1cc(C[NH2+][C@@H](C)CCC[NH3+])ccc1F ZINC000415021171 191654125 /nfs/dbraw/zinc/65/41/25/191654125.db2.gz KBAJJOSHJURFAQ-NSHDSACASA-N 2 0 224.323 2.351 20 0 BEADRP Cc1cc(F)ccc1C[NH2+][C@@H](C)CCC[NH3+] ZINC000415024094 191655508 /nfs/dbraw/zinc/65/55/08/191655508.db2.gz OFXJQOZDXIHLAB-NSHDSACASA-N 2 0 224.323 2.351 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000583545702 355522430 /nfs/dbraw/zinc/52/24/30/355522430.db2.gz LAYHAKNSZXFPJU-OCCSQVGLSA-N 2 0 236.359 2.142 20 0 BEADRP [NH3+]CCC[C@H]([NH2+]C1CCOCC1)c1ccccc1 ZINC000415047105 191661756 /nfs/dbraw/zinc/66/17/56/191661756.db2.gz DTIYLVPEHFKSMH-HNNXBMFYSA-N 2 0 248.370 2.235 20 0 BEADRP C[C@H](CC1CC1)[NH2+]C[C@H]1CC[NH2+][C@H](C)C1 ZINC000415079572 191671980 /nfs/dbraw/zinc/67/19/80/191671980.db2.gz IJAMIRMEINRIHV-WZRBSPASSA-N 2 0 210.365 2.153 20 0 BEADRP CCOc1ccccc1C[N@@H+]1C[C@H](C[NH3+])C[C@@H]1C ZINC000215969056 355644287 /nfs/dbraw/zinc/64/42/87/355644287.db2.gz GWXAQLAIUSSMOU-STQMWFEESA-N 2 0 248.370 2.254 20 0 BEADRP CCC[C@@H](C[NH2+]C[C@@H]1CCN1C(C)(C)C)OC ZINC000639303222 355652651 /nfs/dbraw/zinc/65/26/51/355652651.db2.gz NYECCODFQCPNOW-STQMWFEESA-N 2 0 242.407 2.264 20 0 BEADRP Cc1scc(C[N@@H+](C)CC2CN(C)C2)c1C ZINC000639308902 355664893 /nfs/dbraw/zinc/66/48/93/355664893.db2.gz FLNADIRTDCIZQR-UHFFFAOYSA-N 2 0 238.400 2.358 20 0 BEADRP CCOc1cccc(C[N@@H+]2C[C@@H](C[NH3+])C[C@@H]2C)c1 ZINC000215955937 355619515 /nfs/dbraw/zinc/61/95/15/355619515.db2.gz FQZNAAUGYWLEPT-GXTWGEPZSA-N 2 0 248.370 2.254 20 0 BEADRP CC(C)C1(C[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)CC1 ZINC000639312119 355674157 /nfs/dbraw/zinc/67/41/57/355674157.db2.gz JWNDEKBSZNCFKZ-BETUJISGSA-N 2 0 224.392 2.352 20 0 BEADRP CCC[C@H](C[NH2+]C[C@H]1CCCC[N@H+](C)C1)OC ZINC000639347806 355794461 /nfs/dbraw/zinc/79/44/61/355794461.db2.gz QYOUJVSKGRARKJ-ZIAGYGMSSA-N 2 0 242.407 2.123 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@H]2CCC[C@@H]2C)CC1 ZINC000084901965 355872443 /nfs/dbraw/zinc/87/24/43/355872443.db2.gz CFCZJTSLILIARJ-JSGCOSHPSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+]CCC[NH+]1CCCC1 ZINC000309671283 491085762 /nfs/dbraw/zinc/08/57/62/491085762.db2.gz JXHSDEQPOKWFRC-UONOGXRCSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+]CCC[NH+]1CCCC1 ZINC000309671281 491085769 /nfs/dbraw/zinc/08/57/69/491085769.db2.gz JXHSDEQPOKWFRC-KBPBESRZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[NH+](CC[C@@H]2CCCC[N@@H+]2C)C[C@H]1C ZINC000351439996 355992599 /nfs/dbraw/zinc/99/25/99/355992599.db2.gz ZXBXCPQIAUTYLW-MCIONIFRSA-N 2 0 224.392 2.449 20 0 BEADRP CCN1CC[C@H]2CC[C@@H](C1)[N@@H+]2C[C@H]1C[C@H]1C ZINC000351232414 355965157 /nfs/dbraw/zinc/96/51/57/355965157.db2.gz XWSUUNCHDFJHKY-SYQHCUMBSA-N 2 0 222.376 2.201 20 0 BEADRP C[C@H](F)CC[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C)C1 ZINC000351882131 356120303 /nfs/dbraw/zinc/12/03/03/356120303.db2.gz PAWWWSODHUGBPX-AVGNSLFASA-N 2 0 228.355 2.151 20 0 BEADRP FCCCC[N@@H+]1CC[C@@H](Oc2ccncc2)C1 ZINC000351889862 356153318 /nfs/dbraw/zinc/15/33/18/356153318.db2.gz LUBMOIFEXFJUHL-CYBMUJFWSA-N 2 0 238.306 2.284 20 0 BEADRP COCCC1(C[NH2+][C@H](C)C[C@H](C)[NH3+])CCCC1 ZINC000422884481 192497860 /nfs/dbraw/zinc/49/78/60/192497860.db2.gz DXKFNOUQVREURF-QWHCGFSZSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@H]([NH3+])C[N@@H+]1CCC[C@H]1CCc1ccccc1 ZINC000420297422 192205246 /nfs/dbraw/zinc/20/52/46/192205246.db2.gz DIIBBELAXOBEGU-ZFWWWQNUSA-N 2 0 232.371 2.431 20 0 BEADRP C[C@]1(C[NH3+])CC[N@H+](CCCCC(F)(F)F)C1 ZINC000420319185 192195708 /nfs/dbraw/zinc/19/57/08/192195708.db2.gz RHGGLRLDZHEGDK-SNVBAGLBSA-N 2 0 238.297 2.390 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CCC[N@H+](CC[C@H]2CCCCO2)C1 ZINC000420281773 192200317 /nfs/dbraw/zinc/20/03/17/192200317.db2.gz AJWSCCZZTMMPFP-BFHYXJOUSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@@H]([NH3+])[C@H]1CCCN(Cc2ncc(C3CC3)o2)C1 ZINC000420290930 192200918 /nfs/dbraw/zinc/20/09/18/192200918.db2.gz MQCWOTXBMMLLEV-PWSUYJOCSA-N 2 0 249.358 2.111 20 0 BEADRP Cc1ccc(CN2CCC[C@H](C)[C@@H]2C[NH3+])c(C)n1 ZINC000420289980 192201375 /nfs/dbraw/zinc/20/13/75/192201375.db2.gz LAHJBDOTOJACKL-NHYWBVRUSA-N 2 0 247.386 2.258 20 0 BEADRP COCc1cccc(CN[C@](C)(C[NH3+])C2CC2)c1 ZINC000420290001 192202033 /nfs/dbraw/zinc/20/20/33/192202033.db2.gz LCTQEPUKWGHLHS-OAHLLOKOSA-N 2 0 248.370 2.050 20 0 BEADRP COCc1cccc(CN[C@@](C)(C[NH3+])C2CC2)c1 ZINC000420289999 192202117 /nfs/dbraw/zinc/20/21/17/192202117.db2.gz LCTQEPUKWGHLHS-HNNXBMFYSA-N 2 0 248.370 2.050 20 0 BEADRP COc1ccc([C@H](C[NH3+])C[N@H+](C)C2CCC2)cc1 ZINC000420295635 192203138 /nfs/dbraw/zinc/20/31/38/192203138.db2.gz CHSTUIUBPYBLBT-CYBMUJFWSA-N 2 0 248.370 2.222 20 0 BEADRP COc1ccc([C@H](C[NH3+])C[N@@H+]2CC[C@H](C)C2)cc1 ZINC000420317664 192213037 /nfs/dbraw/zinc/21/30/37/192213037.db2.gz NPZDNQOBOLFFPA-GXTWGEPZSA-N 2 0 248.370 2.079 20 0 BEADRP [NH3+]CC[C@@H]1CCCC[N@@H+]1CCCc1ccncc1 ZINC000420314006 192213131 /nfs/dbraw/zinc/21/31/31/192213131.db2.gz KPVUCJCOSLERLT-HNNXBMFYSA-N 2 0 247.386 2.218 20 0 BEADRP C[C@@H]1CC[C@H](C)[N@H+]1CC[C@@H]1CCC[NH2+]C1 ZINC000420314666 192213165 /nfs/dbraw/zinc/21/31/65/192213165.db2.gz ZHGJZCFFVSXCDW-XQQFMLRXSA-N 2 0 210.365 2.249 20 0 BEADRP CCc1cccc(C[N@@H+]2CC[C@@H]3[NH2+]CC[C@@H]3C2)c1 ZINC000420313973 192213322 /nfs/dbraw/zinc/21/33/22/192213322.db2.gz KODAWDBFNKVBBB-CVEARBPZSA-N 2 0 244.382 2.433 20 0 BEADRP CCc1cccc(C[N@@H+]2CC[C@@H]3C[NH2+]C[C@H]3C2)c1 ZINC000420314911 192213385 /nfs/dbraw/zinc/21/33/85/192213385.db2.gz LRGRCELNJNUTQJ-CVEARBPZSA-N 2 0 244.382 2.290 20 0 BEADRP CCCC[N@@H+]1CCC[C@@H]([C@H]2CC[NH2+]C2)C1 ZINC000420334285 192214515 /nfs/dbraw/zinc/21/45/15/192214515.db2.gz GBIJBCCDZWIECC-QWHCGFSZSA-N 2 0 210.365 2.108 20 0 BEADRP C[N@H+](CC[C@@H]1CCCCO1)[C@H]1CCC[NH2+]CC1 ZINC000420318411 192214542 /nfs/dbraw/zinc/21/45/42/192214542.db2.gz WBEQBIYRLQOHTG-KBPBESRZSA-N 2 0 240.391 2.020 20 0 BEADRP FCCCCC[NH+]1CCC2(CC[NH2+]C2)CC1 ZINC000420346638 192216974 /nfs/dbraw/zinc/21/69/74/192216974.db2.gz WZMWXLRDXMLINA-UHFFFAOYSA-N 2 0 228.355 2.202 20 0 BEADRP FCCCCC[NH+]1CCC([C@H]2CC[NH2+]C2)CC1 ZINC000420307754 192208569 /nfs/dbraw/zinc/20/85/69/192208569.db2.gz CHUNAGLCUQZKBB-AWEZNQCLSA-N 2 0 242.382 2.448 20 0 BEADRP C[C@@H]1CCC[C@@H](C)[N@H+](CC[C@@H]2CC[NH2+]C2)C1 ZINC000420305662 192209455 /nfs/dbraw/zinc/20/94/55/192209455.db2.gz PTKXXBMWMFZTJU-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1ccccc1C[C@@H]1CCC[N@H+]1C[C@@H](C)[NH3+] ZINC000420308407 192210172 /nfs/dbraw/zinc/21/01/72/192210172.db2.gz SCPNQXSVKDFUQO-HIFRSBDPSA-N 2 0 232.371 2.349 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CC[N@H+](CCCc2ccsc2)C1 ZINC000420317252 192212832 /nfs/dbraw/zinc/21/28/32/192212832.db2.gz ZDCHSSBBTFFCLY-WCQYABFASA-N 2 0 238.400 2.350 20 0 BEADRP C[NH2+]CCC[NH2+][C@H](C)c1ccccc1C ZINC000420368809 192225976 /nfs/dbraw/zinc/22/59/76/192225976.db2.gz IKXNBCQSGCWBRU-GFCCVEGCSA-N 2 0 206.333 2.255 20 0 BEADRP CC(C)(C)CCC[N@@H+]1CCNC[C@](C)(F)C1 ZINC000420329599 192229210 /nfs/dbraw/zinc/22/92/10/192229210.db2.gz JZLZEPDZSMGOSU-ZDUSSCGKSA-N 2 0 230.371 2.446 20 0 BEADRP CCSCC[N@@H+]1CCC[C@@H]([C@H]2CC[NH2+]C2)C1 ZINC000420328341 192230258 /nfs/dbraw/zinc/23/02/58/192230258.db2.gz MHXCHPCZPQNTLG-QWHCGFSZSA-N 2 0 242.432 2.061 20 0 BEADRP CC[C@H](C)N1C[C@@H](c2cccc(F)c2)[C@H]([NH3+])C1 ZINC000420384826 192234539 /nfs/dbraw/zinc/23/45/39/192234539.db2.gz GVUMSQLERQPEHL-LEWSCRJBSA-N 2 0 236.334 2.351 20 0 BEADRP CC(C)[C@@H]([NH2+]C[C@H](C)[NH3+])c1ccccc1 ZINC000420382892 192235711 /nfs/dbraw/zinc/23/57/11/192235711.db2.gz YYYQCQXHWOLZLA-WCQYABFASA-N 2 0 206.333 2.321 20 0 BEADRP CC[C@@H]1CCC[C@H]1[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000420403565 192237831 /nfs/dbraw/zinc/23/78/31/192237831.db2.gz LDXNZPQPCIIMHZ-JHJVBQTASA-N 2 0 210.365 2.154 20 0 BEADRP Cc1ccc(CC[N@H+]2CC[C@H](C)[C@@H](C[NH3+])C2)cc1 ZINC000420408092 192239592 /nfs/dbraw/zinc/23/95/92/192239592.db2.gz OWXZEAQXPHNQEF-HOCLYGCPSA-N 2 0 246.398 2.454 20 0 BEADRP C[C@H]([NH2+]CCC1CC[NH2+]CC1)c1ccccn1 ZINC000420419837 192241461 /nfs/dbraw/zinc/24/14/61/192241461.db2.gz XVSJDRGRCSPFHF-LBPRGKRZSA-N 2 0 233.359 2.122 20 0 BEADRP CC(C)[C@@H]1CCCC[C@@H]1[NH2+]C[C@@H]1CC[NH2+]C1 ZINC000420421210 192242107 /nfs/dbraw/zinc/24/21/07/192242107.db2.gz YNJXKJMFQJOALK-RDBSUJKOSA-N 2 0 224.392 2.400 20 0 BEADRP c1cn(CC[N@@H+]2CC[C@@H](C3CCCC3)C2)cn1 ZINC000420960166 192282254 /nfs/dbraw/zinc/28/22/54/192282254.db2.gz GILJKZMUIUMVJR-CQSZACIVSA-N 2 0 233.359 2.395 20 0 BEADRP CCc1cc(N2CCC[C@H]([NH+](C)C)C2)cc[nH+]1 ZINC000336192236 134123823 /nfs/dbraw/zinc/12/38/23/134123823.db2.gz ICQADENSEVUUKG-AWEZNQCLSA-N 2 0 233.359 2.174 20 0 BEADRP C[C@@H]1CSC[C@H]1[NH2+]CCN1CCCC1(C)C ZINC000449781958 202035131 /nfs/dbraw/zinc/03/51/31/202035131.db2.gz JTEGNZFRWWTBCI-VXGBXAGGSA-N 2 0 242.432 2.202 20 0 BEADRP C([C@H]1CCC[NH2+]C1)[N@@H+]1CCC[C@@H]1C1CCC1 ZINC000336197080 134126697 /nfs/dbraw/zinc/12/66/97/134126697.db2.gz KGEHHXQTCKIYLX-GXTWGEPZSA-N 2 0 222.376 2.251 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+]CC1([NH3+])CCCCC1 ZINC000261531496 535322720 /nfs/dbraw/zinc/32/27/20/535322720.db2.gz GTLOHGINEITRAR-NSHDSACASA-N 2 0 210.365 2.426 20 0 BEADRP CC(C)[C@@H]1OCCC[C@@H]1C[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000422922007 192507242 /nfs/dbraw/zinc/50/72/42/192507242.db2.gz RPDWTFKZEJJSEC-FQUUOJAGSA-N 2 0 242.407 2.153 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H](C)[C@H]1COc2ccccc21 ZINC000422997764 192523209 /nfs/dbraw/zinc/52/32/09/192523209.db2.gz BVSNBXOSJCIWQY-YRGRVCCFSA-N 2 0 248.370 2.268 20 0 BEADRP Cc1ccc2c(c1C)OC[C@H]2[NH2+][C@H](C)CCC[NH3+] ZINC000422958320 192525513 /nfs/dbraw/zinc/52/55/13/192525513.db2.gz PGRSCUQPZKJGAN-BXUZGUMPSA-N 2 0 248.370 2.454 20 0 BEADRP Cc1cc(C)c(C[N@H+]2C[C@H](O)CC[C@H]2C)c(C)n1 ZINC000639685690 356600727 /nfs/dbraw/zinc/60/07/27/356600727.db2.gz LQQMXPNBHUINOT-TZMCWYRMSA-N 2 0 248.370 2.352 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CCCN(c2cc[nH+]cc2)CC1 ZINC000639685933 356601663 /nfs/dbraw/zinc/60/16/63/356601663.db2.gz ZEQBKHTXIBPSGD-ZIAGYGMSSA-N 2 0 245.370 2.250 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+]C1CCC([NH3+])CC1 ZINC000423008472 192536669 /nfs/dbraw/zinc/53/66/69/192536669.db2.gz SUAMNKDUFUBTOB-QFWMXSHPSA-N 2 0 222.332 2.070 20 0 BEADRP CC[C@H]([NH2+][C@H](C)CCC[NH3+])c1c(C)noc1C ZINC000423008801 192537155 /nfs/dbraw/zinc/53/71/55/192537155.db2.gz BBKNEUUMDRWASB-SKDRFNHKSA-N 2 0 239.363 2.460 20 0 BEADRP CO[C@@H]1[C@H](C)[C@H]([NH2+][C@H](C)CCCC[NH3+])C1(C)C ZINC000423019005 192542251 /nfs/dbraw/zinc/54/22/51/192542251.db2.gz STOBOIVRBFLITQ-FVCCEPFGSA-N 2 0 242.407 2.153 20 0 BEADRP CCC[N@@H+]1CC[C@@H](CNc2cc[nH+]c(CC)c2)C1 ZINC000450272334 202116997 /nfs/dbraw/zinc/11/69/97/202116997.db2.gz BGJNYBNNCRKACD-ZDUSSCGKSA-N 2 0 247.386 2.210 20 0 BEADRP CSCCCCC[NH2+][C@H](C)C[C@@H](C)[NH3+] ZINC000423056063 192554445 /nfs/dbraw/zinc/55/44/45/192554445.db2.gz WWYUWMLNWQNJQT-GHMZBOCLSA-N 2 0 218.410 2.235 20 0 BEADRP COCC(C)(C)CCC[NH2+][C@H](C)CCC[NH3+] ZINC000423127235 192577041 /nfs/dbraw/zinc/57/70/41/192577041.db2.gz PBZULEXYWZXMBN-GFCCVEGCSA-N 2 0 230.396 2.156 20 0 BEADRP CCC1(C[NH2+][C@H](C)[C@@H]2CCCC[NH2+]2)CC1 ZINC000386113043 356670119 /nfs/dbraw/zinc/67/01/19/356670119.db2.gz LTAIJKUQQOUCKI-NEPJUHHUSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H](C)C(C)(F)F ZINC000389453474 356676647 /nfs/dbraw/zinc/67/66/47/356676647.db2.gz VSHFGQKAWSXKER-BDAKNGLRSA-N 2 0 208.296 2.137 20 0 BEADRP C[C@H]1CC[N@H+](CCc2ccccc2)C[C@@H]1C[NH3+] ZINC000167770815 134154221 /nfs/dbraw/zinc/15/42/21/134154221.db2.gz OYSUCDPVLWUZII-ZFWWWQNUSA-N 2 0 232.371 2.146 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[N@@H+]1CCC[C@@]2(CCSC2)C1 ZINC000423163725 192574374 /nfs/dbraw/zinc/57/43/74/192574374.db2.gz RNTWLLBWAVDEEM-YNEHKIRRSA-N 2 0 242.432 2.331 20 0 BEADRP CCO[C@@H]1CCCC[C@H]1[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000581022558 356665604 /nfs/dbraw/zinc/66/56/04/356665604.db2.gz ZEMPGNOYTWMARP-XJFOESAGSA-N 2 0 240.391 2.194 20 0 BEADRP CCOCC(C)(C)C[NH2+][C@H](CC)[C@@H]1CCC[NH2+]1 ZINC000423120731 192575153 /nfs/dbraw/zinc/57/51/53/192575153.db2.gz HNASTECZZFXDEV-OLZOCXBDSA-N 2 0 242.407 2.169 20 0 BEADRP CCc1cc(N[C@@H]2C[C@@H](C)[N@@H+](C3CC3)C2)cc[nH+]1 ZINC000450373549 202143914 /nfs/dbraw/zinc/14/39/14/202143914.db2.gz CSHDLHDSVVURMK-BXUZGUMPSA-N 2 0 245.370 2.103 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]Cc1cccc(F)c1F ZINC000583681131 356706768 /nfs/dbraw/zinc/70/67/68/356706768.db2.gz DLTZAVHOXOWCOR-SECBINFHSA-N 2 0 228.286 2.182 20 0 BEADRP CC(C)[C@@H]1C[C@H]1C[NH2+][C@H](C)CCCC[NH3+] ZINC000423154683 192593136 /nfs/dbraw/zinc/59/31/36/192593136.db2.gz PIHCQACBRQJXOI-AGIUHOORSA-N 2 0 212.381 2.386 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+][C@@H]2CC2(C)C)CC1(C)C ZINC000623371748 356880901 /nfs/dbraw/zinc/88/09/01/356880901.db2.gz QASGQYUHENUMBV-GHMZBOCLSA-N 2 0 210.365 2.247 20 0 BEADRP CCO[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)C[C@@H](C)[NH3+] ZINC000423169236 192606029 /nfs/dbraw/zinc/60/60/29/192606029.db2.gz VTXIMCHZDGVGIY-YVECIDJPSA-N 2 0 228.380 2.050 20 0 BEADRP CO[C@H]1c2ccccc2C[C@H]1[NH2+][C@H](C)C[C@H](C)[NH3+] ZINC000423171893 192606912 /nfs/dbraw/zinc/60/69/12/192606912.db2.gz QLCKASQGBRMOCL-DRABBMOASA-N 2 0 248.370 2.014 20 0 BEADRP COCC1CCC([NH2+][C@H](C)CCCC[NH3+])CC1 ZINC000423185522 192615550 /nfs/dbraw/zinc/61/55/50/192615550.db2.gz NUVGHADTPBVQDC-IYXRBSQSSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]CC(C)(C)c1cccnc1 ZINC000423193208 192620896 /nfs/dbraw/zinc/62/08/96/192620896.db2.gz VKALCQXJJGCTET-LBPRGKRZSA-N 2 0 235.375 2.076 20 0 BEADRP CCC(C)(C)CC[N@@H+]1CC[C@@H](C[NH2+]C)C1 ZINC000261548172 535351006 /nfs/dbraw/zinc/35/10/06/535351006.db2.gz NFKHWXDREUKDDK-LBPRGKRZSA-N 2 0 212.381 2.354 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000423220340 192631659 /nfs/dbraw/zinc/63/16/59/192631659.db2.gz YCQYVZZYHGJRFX-AGIUHOORSA-N 2 0 210.365 2.010 20 0 BEADRP CC1(C[NH2+]C2CC[NH+](CC3CC3)CC2)CC1 ZINC000390585638 357102648 /nfs/dbraw/zinc/10/26/48/357102648.db2.gz YEEJKPGRYQVQEB-UHFFFAOYSA-N 2 0 222.376 2.251 20 0 BEADRP CCC[C@H](C)C[NH2+]CCN1CC[C@H](C)C1 ZINC000389904836 357064973 /nfs/dbraw/zinc/06/49/73/357064973.db2.gz GFIMNPBGDKSXFU-STQMWFEESA-N 2 0 212.381 2.354 20 0 BEADRP CC(F)(F)CCC[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000390253084 357087633 /nfs/dbraw/zinc/08/76/33/357087633.db2.gz VDOYEDZLOUYLNI-VHSXEESVSA-N 2 0 220.307 2.281 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CC[NH2+]C1)[C@@H]1CC1(C)C ZINC000423248044 192650142 /nfs/dbraw/zinc/65/01/42/192650142.db2.gz MGHKQHOSXMAFHK-TUAOUCFPSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]1CC(C)(C)C[C@H]1[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000423249248 192651940 /nfs/dbraw/zinc/65/19/40/192651940.db2.gz OHYKXSQAHZOSHR-JHJVBQTASA-N 2 0 224.392 2.400 20 0 BEADRP Fc1cccc2c1CC[C@@H]2[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000423251997 192653121 /nfs/dbraw/zinc/65/31/21/192653121.db2.gz SSTBELKZTFEADS-ABAIWWIYSA-N 2 0 248.345 2.402 20 0 BEADRP Cc1cc(CN[C@H]2CC[N@@H+]3CCCC[C@@H]23)ccn1 ZINC000391169754 357125642 /nfs/dbraw/zinc/12/56/42/357125642.db2.gz FQQXUPXYXKQYBK-GJZGRUSLSA-N 2 0 245.370 2.106 20 0 BEADRP C(C[C@@H]1CCC[NH2+]C1)[NH2+][C@@H]1CC[C@@H]1C1CC1 ZINC000423268347 192661171 /nfs/dbraw/zinc/66/11/71/192661171.db2.gz GCCRSVQQIOKGCK-IACUBPJLSA-N 2 0 222.376 2.154 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@@H]1CCC[C@H]1CCCF ZINC000423266956 192661741 /nfs/dbraw/zinc/66/17/41/192661741.db2.gz FACRDQBSYQZYNE-YNEHKIRRSA-N 2 0 230.371 2.478 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]C1CCC2(CC2)CC1 ZINC000423268779 192663351 /nfs/dbraw/zinc/66/33/51/192663351.db2.gz GKUHXQLXJHQKQB-NSHDSACASA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCCC[C@@H]1C[NH3+])[C@H]1C[C@H]1C ZINC000423285229 192677076 /nfs/dbraw/zinc/67/70/76/192677076.db2.gz YBASZRXTOPYMDA-RXGFPQBGSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H]1CSC[C@@H]1[NH2+]C[C@H]1CCCC[N@H+](C)C1 ZINC000628425918 357254170 /nfs/dbraw/zinc/25/41/70/357254170.db2.gz ZCZQTAQWMOVJPQ-UPJWGTAASA-N 2 0 242.432 2.059 20 0 BEADRP CC[C@H]([NH2+]CC1CC[NH2+]CC1)[C@H]1C[C@@H]1C ZINC000582540531 357338509 /nfs/dbraw/zinc/33/85/09/357338509.db2.gz SRJSSEWORPFYSQ-DRZSPHRISA-N 2 0 210.365 2.010 20 0 BEADRP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]CC(C1CC1)C1CC1 ZINC000394834709 357382540 /nfs/dbraw/zinc/38/25/40/357382540.db2.gz UEDSFJCJNXITAO-XHDPSFHLSA-N 2 0 236.403 2.352 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]CC(C1CC1)C1CC1 ZINC000394834707 357383018 /nfs/dbraw/zinc/38/30/18/357383018.db2.gz UEDSFJCJNXITAO-IAQYHMDHSA-N 2 0 236.403 2.352 20 0 BEADRP Cc1ccc2c(c1)OCCC[C@H]2[NH2+]C[C@@H](C)C[NH3+] ZINC000423298387 192687527 /nfs/dbraw/zinc/68/75/27/192687527.db2.gz OGAFVDWBLDBRED-GXTWGEPZSA-N 2 0 248.370 2.393 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H](C)CCCc1cccnc1 ZINC000582779476 357390738 /nfs/dbraw/zinc/39/07/38/357390738.db2.gz IDSRKLFWKOZXFF-CQSZACIVSA-N 2 0 249.402 2.382 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+]C1CCc2ccccc2CC1 ZINC000423300670 192689379 /nfs/dbraw/zinc/68/93/79/192689379.db2.gz DUMMUXQKUVYTEE-LBPRGKRZSA-N 2 0 232.371 2.118 20 0 BEADRP CCOC[C@H]1CCC[C@@H]1[NH2+]CCC[NH2+]C(C)C ZINC000582899110 357425411 /nfs/dbraw/zinc/42/54/11/357425411.db2.gz YQPPILHVGODZGU-KGLIPLIRSA-N 2 0 242.407 2.169 20 0 BEADRP C[C@@H]([NH2+]CCCC1CC1)[C@@H]1CCCC[NH2+]1 ZINC000395242885 357429127 /nfs/dbraw/zinc/42/91/27/357429127.db2.gz RCZHWKDCNVBHNX-YPMHNXCESA-N 2 0 210.365 2.297 20 0 BEADRP Cc1ccsc1CC[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000582915655 357434947 /nfs/dbraw/zinc/43/49/47/357434947.db2.gz IJSIHIILWSZDFG-NWDGAFQWSA-N 2 0 238.400 2.459 20 0 BEADRP Cc1occc1C[NH2+]CC1CC[NH+](C)CC1 ZINC000321338400 357508792 /nfs/dbraw/zinc/50/87/92/357508792.db2.gz AVMZXALRKKGVKR-UHFFFAOYSA-N 2 0 222.332 2.019 20 0 BEADRP CCc1cccnc1[C@H](C)[NH2+]CC1CC[NH2+]CC1 ZINC000583078383 357473705 /nfs/dbraw/zinc/47/37/05/357473705.db2.gz ZESHNWNFGLDEAC-LBPRGKRZSA-N 2 0 247.386 2.294 20 0 BEADRP C[N@@H+]1CCC[C@H]1CCSCC1CC[NH2+]CC1 ZINC000583082308 357474095 /nfs/dbraw/zinc/47/40/95/357474095.db2.gz PXJVUMSSXIYABA-ZDUSSCGKSA-N 2 0 242.432 2.204 20 0 BEADRP Cc1cc(C)c(C[NH2+][C@H]2CCC[C@H]([NH3+])C2)cn1 ZINC000396976186 357488067 /nfs/dbraw/zinc/48/80/67/357488067.db2.gz KIGTZSXIGROPKK-KBPBESRZSA-N 2 0 233.359 2.058 20 0 BEADRP C[C@H]([NH2+]CCOCC[NH+](C)C)C1CCCCC1 ZINC000231786900 357628932 /nfs/dbraw/zinc/62/89/32/357628932.db2.gz GLZHQKGKOSFRNR-ZDUSSCGKSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)C1CC([NH2+]CCCC[NH+](C)C)C1 ZINC000232559897 357671088 /nfs/dbraw/zinc/67/10/88/357671088.db2.gz KAQMFLBGLQBJRT-UHFFFAOYSA-N 2 0 212.381 2.352 20 0 BEADRP Cc1c[nH+]ccc1N1CC[C@H]([NH+]2CCCC2)C1 ZINC000191980370 357819089 /nfs/dbraw/zinc/81/90/89/357819089.db2.gz MZYDOBOWVDMASP-ZDUSSCGKSA-N 2 0 231.343 2.065 20 0 BEADRP Cc1c[nH+]ccc1N1CC[C@H]2[C@H](CCC[N@H+]2C)C1 ZINC000192693996 357847482 /nfs/dbraw/zinc/84/74/82/357847482.db2.gz XXQOSNDLFQQKDO-HIFRSBDPSA-N 2 0 245.370 2.311 20 0 BEADRP CCNCC[NH2+]C[C@H]1CCCC(C)(C)C1 ZINC000583740374 357931765 /nfs/dbraw/zinc/93/17/65/357931765.db2.gz VQQDBMABFOEOTA-LBPRGKRZSA-N 2 0 212.381 2.402 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]CCC2(F)CCC2)C1 ZINC000583763864 357938584 /nfs/dbraw/zinc/93/85/84/357938584.db2.gz MQLGIPDSUMFQBZ-WDEREUQCSA-N 2 0 214.328 2.128 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]C[C@@H]2C[C@H]2C2CCC2)C1 ZINC000584479864 357996732 /nfs/dbraw/zinc/99/67/32/357996732.db2.gz KAGOQDYEWBIYRC-XUXIUFHCSA-N 2 0 222.376 2.282 20 0 BEADRP COCc1ccc(C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)cc1 ZINC000584517361 358029075 /nfs/dbraw/zinc/02/90/75/358029075.db2.gz VXYYTBQSEBVEFX-LSDHHAIUSA-N 2 0 248.370 2.193 20 0 BEADRP C[C@]1(C[NH2+][C@@H]2CCC[NH2+]CC2)CCCS1 ZINC000168773974 134247640 /nfs/dbraw/zinc/24/76/40/134247640.db2.gz WFKCVLPTDWTVHJ-VXGBXAGGSA-N 2 0 228.405 2.004 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+][C@@H]2CCC[NH2+]CC2)C1 ZINC000168717128 134246632 /nfs/dbraw/zinc/24/66/32/134246632.db2.gz ICPPAPNNHHPOIQ-JHJVBQTASA-N 2 0 210.365 2.297 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H]1C[C@H]2C[C@H]2C1 ZINC000584585632 358099707 /nfs/dbraw/zinc/09/97/07/358099707.db2.gz OQLISOSSOBKKBD-NRWUCQMLSA-N 2 0 245.370 2.298 20 0 BEADRP c1ccc2c(c1)CC[NH+](CC1CC[NH2+]CC1)CC2 ZINC000079572165 358106417 /nfs/dbraw/zinc/10/64/17/358106417.db2.gz UAILFGLWPHJSCI-UHFFFAOYSA-N 2 0 244.382 2.087 20 0 BEADRP COc1cccc2c1CCC[C@@H]2[NH2+]CC[C@H](C)[NH3+] ZINC000584834123 358196854 /nfs/dbraw/zinc/19/68/54/358196854.db2.gz ZNNRVPBQBVCWEP-FZMZJTMJSA-N 2 0 248.370 2.400 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@H](C)C2CC2)CC1 ZINC000044517506 358388940 /nfs/dbraw/zinc/38/89/40/358388940.db2.gz IEMRJLZSBKYJGS-LLVKDONJSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@]1(C[NH3+])CC[N@H+](CCCc2ccccc2)C1 ZINC000235706988 358447329 /nfs/dbraw/zinc/44/73/29/358447329.db2.gz SHWVVQUCWWAYNM-OAHLLOKOSA-N 2 0 232.371 2.290 20 0 BEADRP CCCC[C@@H](COC)[NH2+]CC1CC[NH+](C)CC1 ZINC000126304883 358548914 /nfs/dbraw/zinc/54/89/14/358548914.db2.gz CWLSNGMJCBRXOD-AWEZNQCLSA-N 2 0 242.407 2.123 20 0 BEADRP C[NH+]1CCC(C[NH2+]Cc2ccc(Cl)o2)CC1 ZINC000044516287 358550635 /nfs/dbraw/zinc/55/06/35/358550635.db2.gz LSLZCMJMJCNJNE-UHFFFAOYSA-N 2 0 242.750 2.364 20 0 BEADRP CN1CCC[C@@H]1C[NH2+][C@H]1CCCC1(C)C ZINC000166889173 358577529 /nfs/dbraw/zinc/57/75/29/358577529.db2.gz OFLNRHPTQIRQNU-NEPJUHHUSA-N 2 0 210.365 2.249 20 0 BEADRP CC(C)C[N@H+](CCC[NH3+])Cc1ccccc1 ZINC000043417417 358537508 /nfs/dbraw/zinc/53/75/08/358537508.db2.gz YVQSQPLLPSBOLQ-UHFFFAOYSA-N 2 0 220.360 2.493 20 0 BEADRP Cc1ccccc1C[NH2+][C@@H](C)CC[NH+](C)C ZINC000049551768 358694662 /nfs/dbraw/zinc/69/46/62/358694662.db2.gz YYRLLDOMYLFMHK-ZDUSSCGKSA-N 2 0 220.360 2.425 20 0 BEADRP CC[NH+]1CCC([NH2+]CC2(C3CC3)CC2)CC1 ZINC000132334351 358718967 /nfs/dbraw/zinc/71/89/67/358718967.db2.gz UMRFZEYSWQKJDM-UHFFFAOYSA-N 2 0 222.376 2.251 20 0 BEADRP Cc1ccc(OCCCN2CC[C@@H]([NH3+])C2)cc1C ZINC000050242589 358720943 /nfs/dbraw/zinc/72/09/43/358720943.db2.gz GQMFBPRUNLCFPX-CQSZACIVSA-N 2 0 248.370 2.105 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCN2CCCC[C@H]12)C1CCC1 ZINC000132401307 358722371 /nfs/dbraw/zinc/72/23/71/358722371.db2.gz PCFDYXAUDCLCGS-IACUBPJLSA-N 2 0 222.376 2.391 20 0 BEADRP Cc1cccc(C[N@@H+]2CC[C@H]([NH3+])[C@@H](C)C2)c1 ZINC000219836992 134292081 /nfs/dbraw/zinc/29/20/81/134292081.db2.gz BHYVJULQJQUVOV-JSGCOSHPSA-N 2 0 218.344 2.164 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000069663197 359031388 /nfs/dbraw/zinc/03/13/88/359031388.db2.gz VFAFQMCGAVQHBJ-HLVVYCRESA-N 2 0 222.376 2.390 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCC[NH+]2CCCCC2)CCO1 ZINC000070346226 359050158 /nfs/dbraw/zinc/05/01/58/359050158.db2.gz RKKZOFOCILNMLA-KGLIPLIRSA-N 2 0 240.391 2.020 20 0 BEADRP CCC[C@H]([NH2+]CC1C[NH2+]C1)c1ccsc1 ZINC000423309391 192698115 /nfs/dbraw/zinc/69/81/15/192698115.db2.gz ZKSKDIFSVKKQRS-LBPRGKRZSA-N 2 0 224.373 2.398 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H]2CCO[C@@H](C)C2)CC1 ZINC000070347251 359050611 /nfs/dbraw/zinc/05/06/11/359050611.db2.gz HSPSEYKEAZKTQS-JSGCOSHPSA-N 2 0 240.391 2.018 20 0 BEADRP CC(C)C[C@H]1CCC[C@@H]([NH2+]CC2C[NH2+]C2)C1 ZINC000423313899 192700724 /nfs/dbraw/zinc/70/07/24/192700724.db2.gz GHLACLWUPNUTDW-TZMCWYRMSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1CC(C)(C)C[C@H]1[NH2+]C[C@H]([NH3+])C1CC1 ZINC000423317770 192702968 /nfs/dbraw/zinc/70/29/68/192702968.db2.gz KOEBNWOUROYAKO-ADEWGFFLSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H]1CC(C)(C)C[C@H]1[NH2+]C[C@@H]([NH3+])C1CC1 ZINC000423317777 192703508 /nfs/dbraw/zinc/70/35/08/192703508.db2.gz KOEBNWOUROYAKO-YUSALJHKSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H]([NH2+]CCCC[NH3+])C1C(C)(C)C1(C)C ZINC000423332271 192713447 /nfs/dbraw/zinc/71/34/47/192713447.db2.gz QRABCSXOYHGJMW-SNVBAGLBSA-N 2 0 212.381 2.386 20 0 BEADRP C[C@H]([NH2+]CC1(C)CC[NH2+]CC1)c1ccncc1 ZINC000423328305 192709512 /nfs/dbraw/zinc/70/95/12/192709512.db2.gz LZMMOCRPXQXZIN-LBPRGKRZSA-N 2 0 233.359 2.122 20 0 BEADRP COCCC[C@H](C)[NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000246978396 359180205 /nfs/dbraw/zinc/18/02/05/359180205.db2.gz ISPSKAKNKBEYHR-MELADBBJSA-N 2 0 242.407 2.264 20 0 BEADRP CC(C)=CC[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2C)C1 ZINC000248008058 359251243 /nfs/dbraw/zinc/25/12/43/359251243.db2.gz KZTPLPXCGNGXHF-KBPBESRZSA-N 2 0 222.376 2.369 20 0 BEADRP C1=C(C[NH2+]C(C2CCC2)C2CCC2)CC[NH2+]C1 ZINC000423360713 192732032 /nfs/dbraw/zinc/73/20/32/192732032.db2.gz WKFQRFGGUGUFJD-UHFFFAOYSA-N 2 0 234.387 2.465 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]Cc1cccc2c1CCCN2 ZINC000423411948 192748680 /nfs/dbraw/zinc/74/86/80/192748680.db2.gz GQCSNESKORPBBM-NEPJUHHUSA-N 2 0 247.386 2.260 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)c1cccnc1 ZINC000423425944 192750655 /nfs/dbraw/zinc/75/06/55/192750655.db2.gz DSIBYDJYIWSDAH-BYCMXARLSA-N 2 0 245.370 2.120 20 0 BEADRP C[C@H]([NH2+]CC1CC[NH2+]CC1)c1ccsc1 ZINC000086701095 359355612 /nfs/dbraw/zinc/35/56/12/359355612.db2.gz VOVUMBNFMNBAQM-JTQLQIEISA-N 2 0 224.373 2.398 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000423432763 192767270 /nfs/dbraw/zinc/76/72/70/192767270.db2.gz JHRVCHJRTBCBJZ-AUZPSNTRSA-N 2 0 224.392 2.399 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C2CC=CC2)CC1(C)C ZINC000623447650 359339810 /nfs/dbraw/zinc/33/98/10/359339810.db2.gz ZPXFRPQPPMKHFN-LBPRGKRZSA-N 2 0 208.349 2.167 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+]C2CC=CC2)CC1(C)C ZINC000623447649 359339853 /nfs/dbraw/zinc/33/98/53/359339853.db2.gz ZPXFRPQPPMKHFN-GFCCVEGCSA-N 2 0 208.349 2.167 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C2(C3CC3)CC2)CC1(C)C ZINC000623449461 359342495 /nfs/dbraw/zinc/34/24/95/359342495.db2.gz WNRDDENAGARSIJ-LBPRGKRZSA-N 2 0 222.376 2.391 20 0 BEADRP CCO[C@@H]1C[C@H]([NH2+][C@@H](C)[C@@H](C)[NH3+])C12CCCC2 ZINC000423453817 192776707 /nfs/dbraw/zinc/77/67/07/192776707.db2.gz YHCZLOGMNJERAV-MROQNXINSA-N 2 0 240.391 2.050 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@H]1CCCc2ccc(O)cc21 ZINC000423467358 192781841 /nfs/dbraw/zinc/78/18/41/192781841.db2.gz XKYUOYFBTASLFB-NHYWBVRUSA-N 2 0 248.370 2.487 20 0 BEADRP Cc1cc(N)cc(C[NH2+][C@H](C)CCCC[NH3+])c1 ZINC000423468529 192783216 /nfs/dbraw/zinc/78/32/16/192783216.db2.gz BJTFPLIIQGSVBB-GFCCVEGCSA-N 2 0 235.375 2.184 20 0 BEADRP [NH3+][C@@H]1CCC[C@H](C[NH2+][C@H]2CCC23CCC3)C1 ZINC000423479255 192788216 /nfs/dbraw/zinc/78/82/16/192788216.db2.gz UVJSAHSYHWNFNZ-XQQFMLRXSA-N 2 0 222.376 2.426 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[C@@H]([NH3+])C1)c1ccccn1 ZINC000423484151 192790243 /nfs/dbraw/zinc/79/02/43/192790243.db2.gz ZVKCRPKZIJDPMU-YNEHKIRRSA-N 2 0 233.359 2.250 20 0 BEADRP CCN1CCC([NH2+][C@H]2CCC[C@@H](OC)C2)CC1 ZINC000223816901 491140596 /nfs/dbraw/zinc/14/05/96/491140596.db2.gz LBYXVLIOFXMVBU-UONOGXRCSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[C@@H](C[NH3+])C1)c1cccc(O)c1 ZINC000423484814 192791064 /nfs/dbraw/zinc/79/10/64/192791064.db2.gz AIGWSCKEVDDIRU-LOWVWBTDSA-N 2 0 234.343 2.170 20 0 BEADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@H]2CCC23CCC3)C1 ZINC000423524078 192803758 /nfs/dbraw/zinc/80/37/58/192803758.db2.gz ZGGSPHWASPPLDX-WOPDTQHZSA-N 2 0 208.349 2.036 20 0 BEADRP C1=C(CC[NH2+][C@H]2CC[C@H]2C2CCC2)CC[NH2+]C1 ZINC000423534548 192806913 /nfs/dbraw/zinc/80/69/13/192806913.db2.gz ACOBNMRXAKVZPV-GJZGRUSLSA-N 2 0 234.387 2.465 20 0 BEADRP COc1cccc([C@H](C)[NH2+][C@H]2CC[C@H](C[NH3+])C2)c1 ZINC000423496338 192795356 /nfs/dbraw/zinc/79/53/56/192795356.db2.gz WKVMDOKKNXKOEJ-OBJOEFQTSA-N 2 0 248.370 2.473 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2CCS[C@H](C)CC2)CC[NH2+]1 ZINC000379545546 359541694 /nfs/dbraw/zinc/54/16/94/359541694.db2.gz YZESPCWETWGNNT-JHJVBQTASA-N 2 0 242.432 2.202 20 0 BEADRP C[C@H]1CSCCN(CC[NH2+]C(C)(C)C)C1 ZINC000379573539 359549143 /nfs/dbraw/zinc/54/91/43/359549143.db2.gz XORFGXZLEUWSAM-LLVKDONJSA-N 2 0 230.421 2.059 20 0 BEADRP Cc1ncc(C[NH2+]CC(C2CC2)C2CC2)n1C ZINC000580451976 359559683 /nfs/dbraw/zinc/55/96/83/359559683.db2.gz MZMZGGPHWUHJEQ-UHFFFAOYSA-N 2 0 233.359 2.254 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1)C1CC1 ZINC000132913014 491142123 /nfs/dbraw/zinc/14/21/23/491142123.db2.gz PDOAAVCEEHRMJR-NTZNESFSSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@@H]([NH2+]C[C@@H](C)C1CC1)C1CC[NH+](C)CC1 ZINC000132959126 491143854 /nfs/dbraw/zinc/14/38/54/491143854.db2.gz QAGWRMDAEJLANU-VXGBXAGGSA-N 2 0 224.392 2.352 20 0 BEADRP Cn1cncc1CCC[N@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000578375658 366544075 /nfs/dbraw/zinc/54/40/75/366544075.db2.gz CSBIJBTWXSRQCC-OKILXGFUSA-N 2 0 247.386 2.475 20 0 BEADRP CCO[C@@H]1C[C@@H]([NH2+]CCC[NH3+])C12CCCCC2 ZINC000087298417 359906526 /nfs/dbraw/zinc/90/65/26/359906526.db2.gz NEZTVAFQEUMWLY-CHWSQXEVSA-N 2 0 240.391 2.053 20 0 BEADRP CCO[C@H]1C[C@H]([NH2+]CCC[NH3+])C12CCCCC2 ZINC000087298415 359906601 /nfs/dbraw/zinc/90/66/01/359906601.db2.gz NEZTVAFQEUMWLY-STQMWFEESA-N 2 0 240.391 2.053 20 0 BEADRP CCC[NH+]1CCC([NH2+]CC(O)(CC)CC)CC1 ZINC000087013864 359893737 /nfs/dbraw/zinc/89/37/37/359893737.db2.gz IDCZCTSSYCNWPZ-UHFFFAOYSA-N 2 0 242.407 2.002 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@@]2(C)CCCS2)CC1 ZINC000087792671 359929744 /nfs/dbraw/zinc/92/97/44/359929744.db2.gz OBEIXEREEDVZEI-CYBMUJFWSA-N 2 0 242.432 2.346 20 0 BEADRP c1ccc([C@@H]2CCC[N@H+]2CC2CC[NH2+]CC2)nc1 ZINC000578596880 366604710 /nfs/dbraw/zinc/60/47/10/366604710.db2.gz TVUKTCMNIYMRTM-HNNXBMFYSA-N 2 0 245.370 2.218 20 0 BEADRP C[C@@H](Cn1ccnc1)[NH2+][C@@H]1CCC(C)(C)C1 ZINC000087770970 359926388 /nfs/dbraw/zinc/92/63/88/359926388.db2.gz AKERRPBEECJFPG-NWDGAFQWSA-N 2 0 221.348 2.440 20 0 BEADRP CC[C@H](C)C[N@@H+]1CC[C@H](C[NH+](C)CC)C1 ZINC000088536900 359965823 /nfs/dbraw/zinc/96/58/23/359965823.db2.gz HDNZWWZZVXWBII-QWHCGFSZSA-N 2 0 212.381 2.306 20 0 BEADRP CC(C)COCCC[NH2+][C@H]1CCCC[C@@H]1C[NH3+] ZINC000089140450 359992456 /nfs/dbraw/zinc/99/24/56/359992456.db2.gz OWIPJBZMQJSRIS-KGLIPLIRSA-N 2 0 242.407 2.156 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]Cc1cc(F)ccc1F ZINC000089150687 359994359 /nfs/dbraw/zinc/99/43/59/359994359.db2.gz BXNGBPTVFGXTGZ-TVQRCGJNSA-N 2 0 240.297 2.182 20 0 BEADRP CC1(C[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)CCC1 ZINC000090219853 360065625 /nfs/dbraw/zinc/06/56/25/360065625.db2.gz RJYGCKZYEQMESY-QWHCGFSZSA-N 2 0 222.376 2.393 20 0 BEADRP CC(C)C1(C[NH2+][C@H]2CC[N@H+](C)C[C@@H]2C)CC1 ZINC000090230524 360066789 /nfs/dbraw/zinc/06/67/89/360066789.db2.gz SNUDHVCQFKJEFK-STQMWFEESA-N 2 0 224.392 2.352 20 0 BEADRP C[C@H](CC[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1)c1ccccc1 ZINC000090320650 360070376 /nfs/dbraw/zinc/07/03/76/360070376.db2.gz ZBRDSZZLKCOBMI-BMFZPTHFSA-N 2 0 244.382 2.331 20 0 BEADRP CC[C@H](COC)[NH2+][C@@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000093516603 360255791 /nfs/dbraw/zinc/25/57/91/360255791.db2.gz QSJINEJGWISMFN-MJBXVCDLSA-N 2 0 242.407 2.312 20 0 BEADRP Cc1ncccc1C[N@H+](C)CC1CC[NH+](C)CC1 ZINC000093089255 360216645 /nfs/dbraw/zinc/21/66/45/360216645.db2.gz GDXGJVCKLUKCGV-UHFFFAOYSA-N 2 0 247.386 2.164 20 0 BEADRP COC[C@H](C)C[NH2+][C@@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000093516224 360256182 /nfs/dbraw/zinc/25/61/82/360256182.db2.gz WNXBFUHQRUSFIV-HZSPNIEDSA-N 2 0 242.407 2.169 20 0 BEADRP CCOCCC[NH2+][C@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000093496274 360251152 /nfs/dbraw/zinc/25/11/52/360251152.db2.gz XGNGKMLKAWRKNJ-KGLIPLIRSA-N 2 0 242.407 2.313 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@@H]1CCOC2(CCC2)C1 ZINC000094370483 360305939 /nfs/dbraw/zinc/30/59/39/360305939.db2.gz KMHDUSWRRFRUJW-CHWSQXEVSA-N 2 0 240.391 2.018 20 0 BEADRP CCC[NH+]1CCC([NH2+]C[C@@]2(C)CCCO2)CC1 ZINC000094797745 360318538 /nfs/dbraw/zinc/31/85/38/360318538.db2.gz DVLCDDOPJPWTQN-CQSZACIVSA-N 2 0 240.391 2.020 20 0 BEADRP CC1(C)CCC[C@H]([NH2+][C@@H]2CCCNC2)C1 ZINC000149299041 360615480 /nfs/dbraw/zinc/61/54/80/360615480.db2.gz ADNXMSXBNJLJIT-NWDGAFQWSA-N 2 0 210.365 2.297 20 0 BEADRP CN1CCC[C@@H]([NH2+]C2CCC3(CC3)CC2)C1 ZINC000309634744 491153275 /nfs/dbraw/zinc/15/32/75/491153275.db2.gz JAGXMCFBMJDWJO-CYBMUJFWSA-N 2 0 222.376 2.393 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H]1C[C@H](C)CC(C)(C)C1 ZINC000414882306 200774471 /nfs/dbraw/zinc/77/44/71/200774471.db2.gz UABUVFZZEQUROJ-QJPTWQEYSA-N 2 0 212.381 2.386 20 0 BEADRP CC1(C)CC[C@H]([NH2+][C@@H]2CC[NH2+]C23CCC3)C1 ZINC000629385199 361032615 /nfs/dbraw/zinc/03/26/15/361032615.db2.gz UJXFKIPLABSZAY-NWDGAFQWSA-N 2 0 222.376 2.439 20 0 BEADRP CC(C)CCC[C@H](C)[NH2+]CC1([NH3+])CCOCC1 ZINC000629387646 361040396 /nfs/dbraw/zinc/04/03/96/361040396.db2.gz IJJLUWBHSANGEM-ZDUSSCGKSA-N 2 0 242.407 2.299 20 0 BEADRP C[NH2+]CCOCC[NH2+]C1CCC(C(C)C)CC1 ZINC000629392406 361040932 /nfs/dbraw/zinc/04/09/32/361040932.db2.gz NEIIYXAAXICXSY-UHFFFAOYSA-N 2 0 242.407 2.027 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+][C@H]1CC[C@@H](C)C[C@@H]1C ZINC000629407674 361056916 /nfs/dbraw/zinc/05/69/16/361056916.db2.gz HSSABVYBYMRZBP-QNWJLWSRSA-N 2 0 210.365 2.151 20 0 BEADRP C[C@H]1CC(C)(C)CC[C@H]1[NH2+][C@@H]1CC[NH2+]C1 ZINC000629409908 361057946 /nfs/dbraw/zinc/05/79/46/361057946.db2.gz XTTFRFQIQSMPEX-QJPTWQEYSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1C[NH+](CC2CC[NH2+]CC2)C[C@@H](C)C1(F)F ZINC000629497104 361099573 /nfs/dbraw/zinc/09/95/73/361099573.db2.gz VEIFAOGHTAJTCO-GHMZBOCLSA-N 2 0 246.345 2.209 20 0 BEADRP CCC[C@H](C)CCC[N@@H+]1CCC[NH2+]CC1 ZINC000629505903 361100911 /nfs/dbraw/zinc/10/09/11/361100911.db2.gz PZUFRXQWDKLYQY-ZDUSSCGKSA-N 2 0 212.381 2.498 20 0 BEADRP Cc1cccc2c1C[C@H]([NH2+][C@@H](C)C[C@H](C)[NH3+])CO2 ZINC000629513165 361109968 /nfs/dbraw/zinc/10/99/68/361109968.db2.gz FMJCENGYULFGEW-AVGNSLFASA-N 2 0 248.370 2.014 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1[NH2+][C@@H]1CCC12CCCC2 ZINC000629527294 361129706 /nfs/dbraw/zinc/12/97/06/361129706.db2.gz QWZQXEKCECLDNY-YNEHKIRRSA-N 2 0 222.376 2.439 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[NH2+][C@H]1CC)[C@H]1C[C@@H]1C ZINC000629528120 361131850 /nfs/dbraw/zinc/13/18/50/361131850.db2.gz PNFYEGIHXFBEBI-PJSNJIKXSA-N 2 0 210.365 2.151 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[NH2+][C@H]1CC)[C@H]1C[C@H]1C ZINC000629528121 361132073 /nfs/dbraw/zinc/13/20/73/361132073.db2.gz PNFYEGIHXFBEBI-QNWJLWSRSA-N 2 0 210.365 2.151 20 0 BEADRP C[NH2+]CCOCC[NH2+][C@@H](C)C1CCCCCC1 ZINC000629530217 361143574 /nfs/dbraw/zinc/14/35/74/361143574.db2.gz ZOYSVVKXVSELJI-ZDUSSCGKSA-N 2 0 242.407 2.171 20 0 BEADRP C[NH2+]CCOCC[NH2+][C@H](C)[C@H]1CCCC[C@H]1C ZINC000629530762 361145748 /nfs/dbraw/zinc/14/57/48/361145748.db2.gz QLPUHDOVFDNHLS-MCIONIFRSA-N 2 0 242.407 2.027 20 0 BEADRP C1CC1C1([NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)CC1 ZINC000309697901 491154620 /nfs/dbraw/zinc/15/46/20/491154620.db2.gz RXSVCAUIELJUKA-STQMWFEESA-N 2 0 220.360 2.145 20 0 BEADRP Cc1ccc([C@H](C)[NH2+]CC2([NH3+])CCOCC2)cc1 ZINC000629524176 361121891 /nfs/dbraw/zinc/12/18/91/361121891.db2.gz MYWHLADYVGBZQJ-ZDUSSCGKSA-N 2 0 248.370 2.154 20 0 BEADRP Cc1ccccc1[C@H](C)[NH2+]CC1([NH3+])CCOCC1 ZINC000629525237 361125717 /nfs/dbraw/zinc/12/57/17/361125717.db2.gz YXVSZCAWXDESOH-ZDUSSCGKSA-N 2 0 248.370 2.154 20 0 BEADRP CC[C@@H]1CCCC[C@@H]1[NH2+]CC1([NH3+])CCOCC1 ZINC000629524750 361126135 /nfs/dbraw/zinc/12/61/35/361126135.db2.gz OIABDGKTMQRCBO-OLZOCXBDSA-N 2 0 240.391 2.053 20 0 BEADRP CSCC[C@@H](C)[N@H+](C)CC1CC[NH2+]CC1 ZINC000158593415 361205402 /nfs/dbraw/zinc/20/54/02/361205402.db2.gz TVJQWPZLIFKOQQ-LLVKDONJSA-N 2 0 230.421 2.059 20 0 BEADRP C1CC12C[C@@H]2[NH2+][C@@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1 ZINC000424372898 200924418 /nfs/dbraw/zinc/92/44/18/200924418.db2.gz ITYISLYWBVHBDA-DGAVXFQQSA-N 2 0 234.387 2.439 20 0 BEADRP Cc1cccc(C)c1CN(C)[C@H](C)C[NH3+] ZINC000158512482 361200242 /nfs/dbraw/zinc/20/02/42/361200242.db2.gz GAZJMTWWMQDTLQ-GFCCVEGCSA-N 2 0 206.333 2.082 20 0 BEADRP [NH3+][C@H]1CCCCC[C@@H]1[NH2+][C@@H]1C[C@H]1C1CCC1 ZINC000424376125 200926161 /nfs/dbraw/zinc/92/61/61/200926161.db2.gz OORBRKTULWOGIW-XDQVBPFNSA-N 2 0 222.376 2.425 20 0 BEADRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+]C1CSC1 ZINC000309747742 491155952 /nfs/dbraw/zinc/15/59/52/491155952.db2.gz GBEJWPNFRYQNCW-LBPRGKRZSA-N 2 0 242.432 2.346 20 0 BEADRP C[C@@H]1C[C@@H]1CN1CCCC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000579121903 366716144 /nfs/dbraw/zinc/71/61/44/366716144.db2.gz IAMLKNFWZURJCD-MQYQWHSLSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CC1(F)F)[C@@H]1CCCC[NH2+]1 ZINC000622043666 370674266 /nfs/dbraw/zinc/67/42/66/370674266.db2.gz HFLQJAMDQSNUNR-VWYCJHECSA-N 2 0 232.318 2.152 20 0 BEADRP C[C@@H]([NH2+]CC1CC(C)C1)[C@@H]1CCCC[NH2+]1 ZINC000622044866 370674430 /nfs/dbraw/zinc/67/44/30/370674430.db2.gz WGGDSEXHQAMGHZ-KPFVRQRISA-N 2 0 210.365 2.153 20 0 BEADRP CC1CC(C[NH2+][C@H]2CCCCC[C@@H]2[NH3+])C1 ZINC000622044648 370677058 /nfs/dbraw/zinc/67/70/58/370677058.db2.gz NWYKFPWCEPEVMC-TYUFSLCMSA-N 2 0 210.365 2.282 20 0 BEADRP CCC[NH+]1CCC([NH2+]C[C@@H](C)SC)CC1 ZINC000162341700 361346831 /nfs/dbraw/zinc/34/68/31/361346831.db2.gz SHWZQAPZRXHZRK-LLVKDONJSA-N 2 0 230.421 2.202 20 0 BEADRP CC[NH+](CC)CCC[N@H+](C)C(C)(C)COC ZINC000429263008 201086788 /nfs/dbraw/zinc/08/67/88/201086788.db2.gz HWKXQEFSMHQUMG-UHFFFAOYSA-N 2 0 230.396 2.075 20 0 BEADRP [NH3+]C1(C[NH2+]CCCc2ccccc2)CCC1 ZINC000342135717 181331827 /nfs/dbraw/zinc/33/18/27/181331827.db2.gz LCQAPYKXTDBMTO-UHFFFAOYSA-N 2 0 218.344 2.090 20 0 BEADRP C[C@H](Cc1ccsc1)[NH2+][C@@H]1CC[NH2+][C@H](C)C1 ZINC000579328732 366760014 /nfs/dbraw/zinc/76/00/14/366760014.db2.gz PBPKENYUYYPVQY-NQBHXWOUSA-N 2 0 238.400 2.409 20 0 BEADRP COC1(C[C@@H](C)[NH2+]CCCC[NH+](C)C)CCC1 ZINC000429514257 201112067 /nfs/dbraw/zinc/11/20/67/201112067.db2.gz HAHRVOFYURSNOO-CYBMUJFWSA-N 2 0 242.407 2.266 20 0 BEADRP CC[C@@H]([NH2+]CCOCCC[NH3+])c1cccs1 ZINC000629536785 361400104 /nfs/dbraw/zinc/40/01/04/361400104.db2.gz HNSGRIGHJDGKQH-LLVKDONJSA-N 2 0 242.388 2.154 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCOCCC[NH3+])c2ccccc21 ZINC000629535356 361410371 /nfs/dbraw/zinc/41/03/71/361410371.db2.gz BZTOIDBNKDDIAQ-DOMZBBRYSA-N 2 0 248.370 2.190 20 0 BEADRP CC[C@H](C)[C@H]([NH3+])C(=O)Nc1ccc([C@H](C)[NH3+])cc1 ZINC000429581588 201118029 /nfs/dbraw/zinc/11/80/29/201118029.db2.gz USDHWQPKHDGZCK-KWBADKCTSA-N 2 0 249.358 2.018 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+][C@@H]1CC[C@H]1C(C)(C)C ZINC000629543800 361412773 /nfs/dbraw/zinc/41/27/73/361412773.db2.gz BQULZLDWYBGSAW-IRCOFANPSA-N 2 0 210.365 2.151 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[NH2+][C@H]1C)C1CCCC1 ZINC000629543863 361413122 /nfs/dbraw/zinc/41/31/22/361413122.db2.gz CRHZMDNFLKFJAE-WCFLWFBJSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H]([NH2+]C1CCC([NH+](C)C)CC1)[C@H]1CCCO1 ZINC000429978433 201136534 /nfs/dbraw/zinc/13/65/34/201136534.db2.gz DVDPJPPVGNKOTR-GFJIZPEISA-N 2 0 240.391 2.016 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CCOCCC[NH3+])c2ccccc21 ZINC000629535358 361409921 /nfs/dbraw/zinc/40/99/21/361409921.db2.gz BZTOIDBNKDDIAQ-SWLSCSKDSA-N 2 0 248.370 2.190 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+][C@@H]1CCCC12CCC2 ZINC000629545595 361426310 /nfs/dbraw/zinc/42/63/10/361426310.db2.gz LTJXHSHWOVGCLT-QJPTWQEYSA-N 2 0 208.349 2.049 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1N[C@@H](c1cncc(F)c1)C1CC1 ZINC000629546423 361427657 /nfs/dbraw/zinc/42/76/57/361427657.db2.gz PQPFMZDCNOJFJO-CUOATXAZSA-N 2 0 249.333 2.012 20 0 BEADRP C[C@@H](CCCc1cccnc1)[NH2+][C@@H]1CC[NH2+][C@H]1C ZINC000629546934 361429183 /nfs/dbraw/zinc/42/91/83/361429183.db2.gz QPCJULOIVBYSGC-KCQAQPDRSA-N 2 0 247.386 2.133 20 0 BEADRP C[C@H](N[C@@H]1CC[NH2+][C@H]1C)c1ccc(F)c(F)c1 ZINC000629547064 361430782 /nfs/dbraw/zinc/43/07/82/361430782.db2.gz FTZRJLRYHXAWFA-MWODSPESSA-N 2 0 240.297 2.366 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CCCC12CC2 ZINC000629555299 361446075 /nfs/dbraw/zinc/44/60/75/361446075.db2.gz UMJDUVCXDMOTPZ-UTUOFQBUSA-N 2 0 208.349 2.036 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CCCC12CC2 ZINC000629555297 361446325 /nfs/dbraw/zinc/44/63/25/361446325.db2.gz UMJDUVCXDMOTPZ-TUAOUCFPSA-N 2 0 208.349 2.036 20 0 BEADRP C([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)[C@@H]1CCCC12CC2 ZINC000629555628 361447243 /nfs/dbraw/zinc/44/72/43/361447243.db2.gz ZNADDUUZTOFJMJ-ICIURTGMSA-N 2 0 234.387 2.439 20 0 BEADRP c1cc2c(cc1C[NH+](C1CC1)C1CC1)C[NH2+]CC2 ZINC000629569051 361460762 /nfs/dbraw/zinc/46/07/62/361460762.db2.gz UPDYGKVFWHBUBM-UHFFFAOYSA-N 2 0 242.366 2.459 20 0 BEADRP C[NH2+]C[C@H]1CC[N@H+](CCCc2ccccc2C)C1 ZINC000430941213 201158864 /nfs/dbraw/zinc/15/88/64/201158864.db2.gz VABODEPXKUPEEZ-OAHLLOKOSA-N 2 0 246.398 2.469 20 0 BEADRP C([C@@H]1CCC[NH2+]C1)[N@@H+]1CCCC2(CC2)CC1 ZINC000629586133 361475317 /nfs/dbraw/zinc/47/53/17/361475317.db2.gz LCZXUFMAKBDFDR-CYBMUJFWSA-N 2 0 222.376 2.252 20 0 BEADRP CC1(C)CC(C[N@@H+]2C[C@@]3(C)C[NH2+]C[C@@]3(C)C2)C1 ZINC000629595825 361483837 /nfs/dbraw/zinc/48/38/37/361483837.db2.gz QZHXKRSWMXMROY-GASCZTMLSA-N 2 0 236.403 2.354 20 0 BEADRP CCO[C@@H](CC[NH+](C)C)C[NH2+]C1CC(C)(C)C1 ZINC000433294204 201175467 /nfs/dbraw/zinc/17/54/67/201175467.db2.gz KHNOFDXVSAJLNU-ZDUSSCGKSA-N 2 0 242.407 2.121 20 0 BEADRP Cc1cnccc1C[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000629648905 361541635 /nfs/dbraw/zinc/54/16/35/361541635.db2.gz CCEKUWCQEBCRJP-CQSZACIVSA-N 2 0 233.359 2.012 20 0 BEADRP COCc1ccc(C[NH2+][C@@H](C)CCCC[NH3+])o1 ZINC000629649205 361543013 /nfs/dbraw/zinc/54/30/13/361543013.db2.gz MAFMOISWFRIONP-NSHDSACASA-N 2 0 240.347 2.033 20 0 BEADRP C[C@@H]1C[NH+](C[C@]2(C)CC[NH2+]C2)C[C@@H](C)C1(F)F ZINC000629649982 361546038 /nfs/dbraw/zinc/54/60/38/361546038.db2.gz MWPMTDCBVGJAAY-IJLUTSLNSA-N 2 0 246.345 2.209 20 0 BEADRP COC1(C[NH2+]Cc2ccc(C[NH3+])cc2)CCCC1 ZINC000629650329 361548240 /nfs/dbraw/zinc/54/82/40/361548240.db2.gz RJKQVROKOXEDNF-UHFFFAOYSA-N 2 0 248.370 2.194 20 0 BEADRP [NH3+]C1CCC([NH2+]CCc2ccccc2)CC1 ZINC000051692928 181341829 /nfs/dbraw/zinc/34/18/29/181341829.db2.gz XDHZKPBSJRYSAB-UHFFFAOYSA-N 2 0 218.344 2.089 20 0 BEADRP [NH3+]C1CCC([NH2+]Cc2cccs2)CC1 ZINC000051692929 181341056 /nfs/dbraw/zinc/34/10/56/181341056.db2.gz MHNFMAWXOYYFEZ-UHFFFAOYSA-N 2 0 210.346 2.108 20 0 BEADRP CC[N@H+](Cc1cccnc1)[C@H]1CCC[NH2+]CC1 ZINC000435389682 201267184 /nfs/dbraw/zinc/26/71/84/201267184.db2.gz LUSRKFGGGKQLBD-AWEZNQCLSA-N 2 0 233.359 2.046 20 0 BEADRP [NH3+][C@H]1CCc2c1cccc2C1=CC[NH2+]CC1 ZINC000629723510 361664778 /nfs/dbraw/zinc/66/47/78/361664778.db2.gz NSJWTFYOVXXNOZ-AWEZNQCLSA-N 2 0 214.312 2.009 20 0 BEADRP c1cc([C@H]2CCC[NH2+]2)ccc1C1=CC[NH2+]CC1 ZINC000629723521 361664924 /nfs/dbraw/zinc/66/49/24/361664924.db2.gz NYWWRVKXMKMLQB-OAHLLOKOSA-N 2 0 228.339 2.488 20 0 BEADRP c1cc(C2=CC[NH2+]CC2)cc([C@H]2CCC[NH2+]2)c1 ZINC000629722790 361663450 /nfs/dbraw/zinc/66/34/50/361663450.db2.gz DTEJQJBGTCHUJU-OAHLLOKOSA-N 2 0 228.339 2.488 20 0 BEADRP C[C@@H]([NH3+])CCc1ccc(C2=CC[NH2+]CC2)cc1 ZINC000629722948 361663640 /nfs/dbraw/zinc/66/36/40/361663640.db2.gz IJFCFKKYABSVNO-GFCCVEGCSA-N 2 0 230.355 2.343 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CCc1ccc(F)c(F)c1 ZINC000573711446 364899233 /nfs/dbraw/zinc/89/92/33/364899233.db2.gz TVWKJGYTLMDADS-VHSXEESVSA-N 2 0 242.313 2.223 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CCc1ccc(F)c(F)c1 ZINC000573711445 364899374 /nfs/dbraw/zinc/89/93/74/364899374.db2.gz TVWKJGYTLMDADS-UWVGGRQHSA-N 2 0 242.313 2.223 20 0 BEADRP Cc1ccc(CC[N@H+]2CC[C@H]([NH3+])C[C@H]2C)cc1 ZINC000573931521 364949482 /nfs/dbraw/zinc/94/94/82/364949482.db2.gz XAIWMECWOHUNQY-HIFRSBDPSA-N 2 0 232.371 2.349 20 0 BEADRP [NH3+]CCCC[NH2+][C@H](c1ccccc1)C1CC1 ZINC000041045568 181377900 /nfs/dbraw/zinc/37/79/00/181377900.db2.gz ZWHVRMPRNHSPRK-CQSZACIVSA-N 2 0 218.344 2.466 20 0 BEADRP [NH3+]CCCC[NH2+]Cc1c(F)cccc1Cl ZINC000037715030 181377167 /nfs/dbraw/zinc/37/71/67/181377167.db2.gz PKIFIOYPIQXKTN-UHFFFAOYSA-N 2 0 230.714 2.308 20 0 BEADRP [NH3+]CCCC[NH2+][C@H]1CCCc2ccccc21 ZINC000037715121 181377761 /nfs/dbraw/zinc/37/77/61/181377761.db2.gz GEGKBXSNUUPMJH-AWEZNQCLSA-N 2 0 218.344 2.393 20 0 BEADRP [NH3+]CCCC[NH2+]Cc1cc2ccccc2o1 ZINC000037715150 181377851 /nfs/dbraw/zinc/37/78/51/181377851.db2.gz JGXNEFACZUTFFZ-UHFFFAOYSA-N 2 0 218.300 2.261 20 0 BEADRP [NH3+]CCC[N@@H+](Cc1ccccn1)CC1CCCC1 ZINC000352478598 181379247 /nfs/dbraw/zinc/37/92/47/181379247.db2.gz YMWCHIFICPIPHM-UHFFFAOYSA-N 2 0 247.386 2.423 20 0 BEADRP CC[C@H](C)C[NH+]1CCN(c2cc[nH+]cc2)CC1 ZINC000151329503 541441239 /nfs/dbraw/zinc/44/12/39/541441239.db2.gz WBISQLMYYYFFQT-ZDUSSCGKSA-N 2 0 233.359 2.250 20 0 BEADRP [NH3+]CCC[N@@H+](Cc1ccncc1)CC1CCCC1 ZINC000352534083 181379689 /nfs/dbraw/zinc/37/96/89/181379689.db2.gz CVXXPNFHPCAAJJ-UHFFFAOYSA-N 2 0 247.386 2.423 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+][C@H]1CC[NH2+][C@@H](C)C1 ZINC000574191060 365006883 /nfs/dbraw/zinc/00/68/83/365006883.db2.gz ALMNGMSDWKCLKF-RNJOBUHISA-N 2 0 210.365 2.295 20 0 BEADRP [NH3+]CCC[NH2+][C@H]1CCSc2ccccc21 ZINC000037713285 181383670 /nfs/dbraw/zinc/38/36/70/181383670.db2.gz YAFCHBBETBQDRN-NSHDSACASA-N 2 0 222.357 2.162 20 0 BEADRP CC(C)N(C)CC[NH2+][C@@H]1CCC[C@H]2C[C@H]21 ZINC000379777500 365207193 /nfs/dbraw/zinc/20/71/93/365207193.db2.gz AQSSUTLVWGMEDC-YNEHKIRRSA-N 2 0 210.365 2.105 20 0 BEADRP CC[C@H]([NH2+]CCC[NH+]1CCCC1)[C@H]1CCCO1 ZINC000182330867 366886849 /nfs/dbraw/zinc/88/68/49/366886849.db2.gz CUKRRPJXKRCUNA-UONOGXRCSA-N 2 0 240.391 2.020 20 0 BEADRP C[N@@H+]1CCC[C@H](CC[NH2+]C(C2CC2)C2CC2)C1 ZINC000579567400 366877681 /nfs/dbraw/zinc/87/76/81/366877681.db2.gz VULVWLOPXVMCPL-GFCCVEGCSA-N 2 0 236.403 2.497 20 0 BEADRP CC[C@@H]([NH3+])CN[C@@H](C)c1ccc(C)cc1OC ZINC000579822674 367024258 /nfs/dbraw/zinc/02/42/58/367024258.db2.gz GSVWPNLBGPRPTA-NWDGAFQWSA-N 2 0 236.359 2.392 20 0 BEADRP Cc1cncc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](C)C2)c1 ZINC000184351245 367073639 /nfs/dbraw/zinc/07/36/39/367073639.db2.gz MGLHAOBNPGEYOL-KBPBESRZSA-N 2 0 247.386 2.382 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]CCCc1cccs1 ZINC000579945023 367094828 /nfs/dbraw/zinc/09/48/28/367094828.db2.gz DQAKXEZSEOAUCP-NSHDSACASA-N 2 0 226.389 2.398 20 0 BEADRP CC1(C[N@@H+]2CCC[C@@H]([C@@H]3CC[NH2+]C3)C2)CC1 ZINC000579958580 367103765 /nfs/dbraw/zinc/10/37/65/367103765.db2.gz KMBWOKDXWBCQMK-CHWSQXEVSA-N 2 0 222.376 2.108 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@@H]2CC[NH2+][C@H](C)C2)[C@@H]1C ZINC000380669939 367276297 /nfs/dbraw/zinc/27/62/97/367276297.db2.gz KXHAGPLNWSLCBW-FDYHWXHSSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@@H]1C[N@H+](C[C@H]2CC[NH2+][C@H](C)C2)C(C)(C)C1 ZINC000380504661 367225203 /nfs/dbraw/zinc/22/52/03/367225203.db2.gz IDPWOPIMJBAKRU-XQQFMLRXSA-N 2 0 224.392 2.495 20 0 BEADRP CCO[C@@H]1CCCC[C@H]1[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000581022557 367239830 /nfs/dbraw/zinc/23/98/30/367239830.db2.gz ZEMPGNOYTWMARP-REWJHTLYSA-N 2 0 240.391 2.194 20 0 BEADRP C[C@@H]1CC[N@H+](CC[C@H]2CCC[NH2+]C2)[C@@H]1C ZINC000380806859 367306323 /nfs/dbraw/zinc/30/63/23/367306323.db2.gz QNEYGBMOYSWATM-JHJVBQTASA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@H]1CCC[C@H]1[NH2+]CC1=CC[N@H+](C)CC1 ZINC000381357997 367387577 /nfs/dbraw/zinc/38/75/77/367387577.db2.gz DTBPOCUVBJMZJG-UONOGXRCSA-N 2 0 222.376 2.417 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]C[C@@H]1CC[N@@H+](C(C)C)C1 ZINC000381390374 367392522 /nfs/dbraw/zinc/39/25/22/367392522.db2.gz NYXUNEYPERYAFS-MJBXVCDLSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@H]1CCC[C@H]2C[C@H]21 ZINC000382181463 367495449 /nfs/dbraw/zinc/49/54/49/367495449.db2.gz ZNMRCCKAFUCEGM-XQHKEYJVSA-N 2 0 210.365 2.105 20 0 BEADRP Cc1cc([C@@H](C)[NH2+]CCCC[NH3+])cs1 ZINC000381746617 367454037 /nfs/dbraw/zinc/45/40/37/367454037.db2.gz MWDJKTMUZPOFMF-SNVBAGLBSA-N 2 0 212.362 2.446 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H]1CC12CC2 ZINC000581424109 367464840 /nfs/dbraw/zinc/46/48/40/367464840.db2.gz WEIPMPADMSFXCD-ZWNOBZJWSA-N 2 0 231.343 2.052 20 0 BEADRP CC[C@H]1CCC[C@@H]1[NH2+]CCC[NH2+]C1CC1 ZINC000382526913 367533118 /nfs/dbraw/zinc/53/31/18/367533118.db2.gz BOXMJLABJLPPDS-AAEUAGOBSA-N 2 0 210.365 2.297 20 0 BEADRP c1ccc2c(c1)CC[C@H]2[NH2+]CCC[NH2+]C1CC1 ZINC000382548823 367537083 /nfs/dbraw/zinc/53/70/83/367537083.db2.gz RKTITAWTPWMARC-OAHLLOKOSA-N 2 0 230.355 2.406 20 0 BEADRP C[C@@H]([NH2+]CCC[NH2+]C1CC1)c1ccccc1 ZINC000382586379 367545777 /nfs/dbraw/zinc/54/57/77/367545777.db2.gz UETDZONYVXLWBK-GFCCVEGCSA-N 2 0 218.344 2.479 20 0 BEADRP CC[C@H]([NH2+][C@H](CCC[NH3+])COC)C1CCCC1 ZINC000382796444 367557382 /nfs/dbraw/zinc/55/73/82/367557382.db2.gz UXGGQJNOIUPTEN-KGLIPLIRSA-N 2 0 242.407 2.299 20 0 BEADRP CC[C@H]([NH2+][C@@H](CCC[NH3+])COC)C1CCCC1 ZINC000382796443 367557520 /nfs/dbraw/zinc/55/75/20/367557520.db2.gz UXGGQJNOIUPTEN-KBPBESRZSA-N 2 0 242.407 2.299 20 0 BEADRP CC[C@@H]([NH2+][C@@H]1CCCNC1)C1CCCC1 ZINC000382789848 367557734 /nfs/dbraw/zinc/55/77/34/367557734.db2.gz OJCXLXBSJPKAGI-CHWSQXEVSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H](c1ccncc1)[N@H+](C)C[C@H]1CC[NH2+][C@H](C)C1 ZINC000383923012 367659794 /nfs/dbraw/zinc/65/97/94/367659794.db2.gz HXOXLXGVPCRTBH-RDBSUJKOSA-N 2 0 247.386 2.463 20 0 BEADRP CC/C=C/C[NH2+]C1CC[NH+](CCC)CC1 ZINC000384909718 367755981 /nfs/dbraw/zinc/75/59/81/367755981.db2.gz YGPGVWKABXRUFE-AATRIKPKSA-N 2 0 210.365 2.417 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H]2C[C@H](C)O[C@H]2C)CC1 ZINC000384940043 367761792 /nfs/dbraw/zinc/76/17/92/367761792.db2.gz QSJQFYDBEXNQBJ-SGMGOOAPSA-N 2 0 240.391 2.016 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@@H]2C[C@@H](C)O[C@H]2C)CC1 ZINC000384971936 367767435 /nfs/dbraw/zinc/76/74/35/367767435.db2.gz TWDUZEPHNBJHFC-MBNYWOFBSA-N 2 0 240.391 2.015 20 0 BEADRP CSCC1CCC([NH2+]CCCC[NH3+])CC1 ZINC000385738776 367858758 /nfs/dbraw/zinc/85/87/58/367858758.db2.gz VTRXVWPDLOVAEQ-UHFFFAOYSA-N 2 0 230.421 2.237 20 0 BEADRP C[C@H]1CCC[C@@H](C[N@@H+]2CC[C@@H]3C[NH2+]C[C@@H]32)C1 ZINC000385373268 367823576 /nfs/dbraw/zinc/82/35/76/367823576.db2.gz LNRKSYFCUZJARV-DGAVXFQQSA-N 2 0 222.376 2.106 20 0 BEADRP CC1(C)CCC(CN2CC[C@@H]3C[NH2+]C[C@@H]32)CC1 ZINC000385405495 367826408 /nfs/dbraw/zinc/82/64/08/367826408.db2.gz XPKNMHJGHMCFJN-KGLIPLIRSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCC[C@H]2CCC[NH2+]2)[C@H]1C ZINC000386094024 367911367 /nfs/dbraw/zinc/91/13/67/367911367.db2.gz GJKZRQOBXXYBKE-XQHKEYJVSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@]2(C)CCC[NH2+]C2)[C@H]1C ZINC000386090843 367911444 /nfs/dbraw/zinc/91/14/44/367911444.db2.gz FVSQYSOAOFXZSM-MROQNXINSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC=CCC1)[C@@H]1CCCC[NH2+]1 ZINC000386125384 367915635 /nfs/dbraw/zinc/91/56/35/367915635.db2.gz NQUMITAELWXBJG-XQQFMLRXSA-N 2 0 208.349 2.215 20 0 BEADRP C[C@@H]([NH2+]CC1(C)CCC1)[C@H]1CCCC[NH2+]1 ZINC000386127264 367916167 /nfs/dbraw/zinc/91/61/67/367916167.db2.gz NXXBKFVXXHSRPO-VXGBXAGGSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC[C@@H]2CCC[NH2+]C2)[C@@H]1C ZINC000386171670 367922331 /nfs/dbraw/zinc/92/23/31/367922331.db2.gz YYLAHLUJDJLVRZ-NDBYEHHHSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]([NH2+]CC1CC(F)(F)C1)[C@@H]1CCCC[NH2+]1 ZINC000386010500 367897645 /nfs/dbraw/zinc/89/76/45/367897645.db2.gz MMGITVLBYFNUSV-KOLCDFICSA-N 2 0 232.318 2.152 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CC=CCC1)[C@H]1CCCC[NH2+]1 ZINC000386013678 367897753 /nfs/dbraw/zinc/89/77/53/367897753.db2.gz NDNOJVJOBZDDPZ-MELADBBJSA-N 2 0 222.376 2.463 20 0 BEADRP CC(C)OCCCC[NH2+][C@H](C)[C@H]1CCCC[NH2+]1 ZINC000386476575 367978335 /nfs/dbraw/zinc/97/83/35/367978335.db2.gz RIVRHRYZKDOFQG-ZIAGYGMSSA-N 2 0 242.407 2.312 20 0 BEADRP CC[C@H]([NH2+][C@H](C)C[C@H]1CCCCC[NH2+]1)[C@H](C)O ZINC000386835789 368025442 /nfs/dbraw/zinc/02/54/42/368025442.db2.gz IOKZGIZXRVLWKV-RQJABVFESA-N 2 0 242.407 2.046 20 0 BEADRP CC[C@@H]([NH2+]CCOCC[NH+](C)C)C1CCCC1 ZINC000387475132 368226078 /nfs/dbraw/zinc/22/60/78/368226078.db2.gz UKJQAMKAQYIEFO-CQSZACIVSA-N 2 0 242.407 2.123 20 0 BEADRP [NH3+]C1CC[NH+](Cc2ccnc3ccccc23)CC1 ZINC000082026274 368632599 /nfs/dbraw/zinc/63/25/99/368632599.db2.gz JTJZZHNWEJKCBH-UHFFFAOYSA-N 2 0 241.338 2.158 20 0 BEADRP CCc1ccc(C[N@@H+]2CC[C@H]([NH3+])[C@H](C)C2)s1 ZINC000086884432 368886869 /nfs/dbraw/zinc/88/68/69/368886869.db2.gz BPPVLRLHXLUTFQ-MFKMUULPSA-N 2 0 238.400 2.480 20 0 BEADRP Cc1cscc1C[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000087309622 368891182 /nfs/dbraw/zinc/89/11/82/368891182.db2.gz IAONOMPNFUEJHQ-NWDGAFQWSA-N 2 0 224.373 2.416 20 0 BEADRP Cc1ncsc1C[NH+]1CCC(CC[NH3+])CC1 ZINC000084149541 368849310 /nfs/dbraw/zinc/84/93/10/368849310.db2.gz PEMCICNZTFBDIQ-UHFFFAOYSA-N 2 0 239.388 2.012 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)[C@H]1C[C@H]1C ZINC000623657273 368997883 /nfs/dbraw/zinc/99/78/83/368997883.db2.gz MNZNXGOUYWTIMB-SYQHCUMBSA-N 2 0 224.392 2.352 20 0 BEADRP CCCn1ccc(C[NH2+]C[C@H]2CCC[N@H+](C)C2)c1 ZINC000091013034 369004104 /nfs/dbraw/zinc/00/41/04/369004104.db2.gz JNVPHGVDHNNKOH-CQSZACIVSA-N 2 0 249.402 2.330 20 0 BEADRP Cc1cc(C)c(C[N@H+]2CC[C@@H]([C@H](C)[NH3+])C2)c(C)n1 ZINC000631824191 368987531 /nfs/dbraw/zinc/98/75/31/368987531.db2.gz YJQASIAHMPZSQK-GXTWGEPZSA-N 2 0 247.386 2.176 20 0 BEADRP C[N@@H+]1CCCC[C@H](C[NH2+]C2CCSCC2)C1 ZINC000623655811 368990985 /nfs/dbraw/zinc/99/09/85/368990985.db2.gz GBLOMNPUHTVLAE-GFCCVEGCSA-N 2 0 242.432 2.204 20 0 BEADRP C[N@@H+]1CCCC[C@H](C[NH2+]C2CCCC2)C1 ZINC000623655747 368991785 /nfs/dbraw/zinc/99/17/85/368991785.db2.gz DOEWPAJNALNTRT-GFCCVEGCSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CCCC[N@H+](C)C1 ZINC000623656343 368992907 /nfs/dbraw/zinc/99/29/07/368992907.db2.gz SFHFTFUTXJPCJT-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH2+]CCC[NH+]1CCC2(CCSCC2)CC1 ZINC000631836691 369088558 /nfs/dbraw/zinc/08/85/58/369088558.db2.gz FBXNPAMGLKNMHR-UHFFFAOYSA-N 2 0 242.432 2.205 20 0 BEADRP C[C@@H]1C[N@H+](CCC(C)(C)C2CC2)C[C@H]1C[NH3+] ZINC000631838047 369114304 /nfs/dbraw/zinc/11/43/04/369114304.db2.gz YVLYQWMHUAAIBZ-VXGBXAGGSA-N 2 0 224.392 2.339 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC(C2CC2)C2CC2)CC[N@@H+]1C ZINC000156602246 326236888 /nfs/dbraw/zinc/23/68/88/326236888.db2.gz IUESWCRPDJRQHM-BXUZGUMPSA-N 2 0 236.403 2.495 20 0 BEADRP CC(C)c1ccc(C[NH+]2C[C@@H]3C[NH2+]C[C@H]3C2)cc1 ZINC000107573391 369353994 /nfs/dbraw/zinc/35/39/94/369353994.db2.gz HSGXPOGQUMUOHX-HOTGVXAUSA-N 2 0 244.382 2.461 20 0 BEADRP CCO[C@@]1(C)C[C@H]1[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623676814 369366799 /nfs/dbraw/zinc/36/67/99/369366799.db2.gz FZZJBFKVNLRFLK-SCRDCRAPSA-N 2 0 240.391 2.016 20 0 BEADRP C[N@@H+]1CCC[C@@H](CC[NH2+]C2CCCC2)C1 ZINC000459738682 203350074 /nfs/dbraw/zinc/35/00/74/203350074.db2.gz SCQVSLFKVWWFHP-LBPRGKRZSA-N 2 0 210.365 2.251 20 0 BEADRP CC[C@@H](C)C[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC000459723597 203343190 /nfs/dbraw/zinc/34/31/90/203343190.db2.gz AGPISJSQXYJKFF-CHWSQXEVSA-N 2 0 212.381 2.354 20 0 BEADRP C[N@@H+]1CCC[C@H](CC[NH2+]C2CCSCC2)C1 ZINC000459730501 203343639 /nfs/dbraw/zinc/34/36/39/203343639.db2.gz KJIDKMZBMZUUBH-GFCCVEGCSA-N 2 0 242.432 2.204 20 0 BEADRP C[N@@H+]1CCC[C@@H]1CC[NH2+][C@H]1CCC[C@@H]2C[C@@H]21 ZINC000459795036 203373382 /nfs/dbraw/zinc/37/33/82/203373382.db2.gz XGVGBIPVMITCNQ-MQYQWHSLSA-N 2 0 222.376 2.249 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H](C1CC1)N(C)C)C1CC1 ZINC000166324305 203387844 /nfs/dbraw/zinc/38/78/44/203387844.db2.gz CFKMIRVWOIUUAP-OLZOCXBDSA-N 2 0 210.365 2.105 20 0 BEADRP Cc1ncccc1CN[C@H]1CC[N@@H+](C)C(C)(C)C1 ZINC000623703381 369867635 /nfs/dbraw/zinc/86/76/35/369867635.db2.gz LVLTZZUFPBTAFP-AWEZNQCLSA-N 2 0 247.386 2.352 20 0 BEADRP C[C@@H]1CCCC[C@H]1C[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000252135869 369999499 /nfs/dbraw/zinc/99/94/99/369999499.db2.gz LLZKBJNVLGPPPU-RDBSUJKOSA-N 2 0 224.392 2.402 20 0 BEADRP C[C@H](c1cccnc1)[N@@H+]1C[C@@H]2CCC[C@@H]([NH3+])[C@H]2C1 ZINC000252860998 370136919 /nfs/dbraw/zinc/13/69/19/370136919.db2.gz NGDLLRXNSMOKIJ-UQOMUDLDSA-N 2 0 245.370 2.202 20 0 BEADRP C[C@@H]1CC[C@H]1[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000309803222 370263084 /nfs/dbraw/zinc/26/30/84/370263084.db2.gz RONQYCUXIYPODQ-BXUZGUMPSA-N 2 0 222.376 2.249 20 0 BEADRP CC1CC(C[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)C1 ZINC000621384334 370328432 /nfs/dbraw/zinc/32/84/32/370328432.db2.gz CCIHNBZXGNMDBN-HOAMVYINSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+][C@H]1CC[NH2+]C[C@H]1C ZINC000310484320 370348139 /nfs/dbraw/zinc/34/81/39/370348139.db2.gz DOKFLBYXWIJWGP-BZPMIXESSA-N 2 0 236.359 2.188 20 0 BEADRP Cc1cc(CN2CCCC[C@@H]2[C@@H](C)[NH3+])ccn1 ZINC000621773964 370518438 /nfs/dbraw/zinc/51/84/38/370518438.db2.gz HDOABOUUNYZBDA-TZMCWYRMSA-N 2 0 233.359 2.092 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CC2CC(C)C2)[C@H](C)C1 ZINC000621739714 370496815 /nfs/dbraw/zinc/49/68/15/370496815.db2.gz UHDXQWVWWIRZHZ-FKZOYECMSA-N 2 0 224.392 2.352 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H](C)[C@@H]1CCCCO1 ZINC000623849219 371123946 /nfs/dbraw/zinc/12/39/46/371123946.db2.gz ZNTBMMKWRHFQPK-KBPBESRZSA-N 2 0 242.407 2.266 20 0 BEADRP FCCCC[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000390773859 371234921 /nfs/dbraw/zinc/23/49/21/371234921.db2.gz YSJQFQBFQBMNJI-UHFFFAOYSA-N 2 0 228.355 2.200 20 0 BEADRP COCCC[C@@H](C)[NH2+]C[C@@H]1CCCC[N@H+](C)C1 ZINC000624120522 371321744 /nfs/dbraw/zinc/32/17/44/371321744.db2.gz BBUYNTLIEVKNJV-KGLIPLIRSA-N 2 0 242.407 2.123 20 0 BEADRP COC(C)(C)[C@@H](C)[NH2+]C[C@H]1CCCC[N@H+](C)C1 ZINC000624123195 371324169 /nfs/dbraw/zinc/32/41/69/371324169.db2.gz HSICNQFWVAIFLH-CHWSQXEVSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCCC[N@H+](C)C2)[C@@H]1C ZINC000624124119 371324753 /nfs/dbraw/zinc/32/47/53/371324753.db2.gz XTDSHSXYNFRKQQ-MQYQWHSLSA-N 2 0 224.392 2.352 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H]1CCCN1C)[C@@H]1CC1(C)C ZINC000624271725 371450001 /nfs/dbraw/zinc/45/00/01/371450001.db2.gz AVVMUYKHQGXXDT-RWMBFGLXSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]([NH2+]CC(C)(C)F)C1CC[NH+](C)CC1 ZINC000631658126 372484611 /nfs/dbraw/zinc/48/46/11/372484611.db2.gz IZNUYUPGNSSFRC-SNVBAGLBSA-N 2 0 216.344 2.054 20 0 BEADRP CCC[C@H](CCO)[NH2+]C1CC[NH+](CCC)CC1 ZINC000631667478 372493515 /nfs/dbraw/zinc/49/35/15/372493515.db2.gz PRZOPEWLEKHNTG-CYBMUJFWSA-N 2 0 242.407 2.002 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]1[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC000631826998 372606386 /nfs/dbraw/zinc/60/63/86/372606386.db2.gz CCZNEMWSAILFQR-GHMZBOCLSA-N 2 0 246.345 2.400 20 0 BEADRP Cc1cc(C)c(C[N@H+]2CC[C@@H]([NH3+])C[C@H]2C)c(C)n1 ZINC000631829362 372611450 /nfs/dbraw/zinc/61/14/50/372611450.db2.gz OTKUWJCLZGCBDU-TZMCWYRMSA-N 2 0 247.386 2.318 20 0 BEADRP [NH3+][C@]12CCC[C@H]1C[N@H+](C[C@@H]1CCC(F)(F)C1)C2 ZINC000631829879 372612828 /nfs/dbraw/zinc/61/28/28/372612828.db2.gz CLTHGTRRPQQNHL-WOPDTQHZSA-N 2 0 244.329 2.235 20 0 BEADRP C[C@H]1C[N@H+](Cc2ccc3c(c2)CCC3)C[C@H]1C[NH3+] ZINC000631837293 372627052 /nfs/dbraw/zinc/62/70/52/372627052.db2.gz ADCWMLSDGJHGNN-BLLLJJGKSA-N 2 0 244.382 2.202 20 0 BEADRP C[C@H](c1cccc(F)c1)[N@H+]1C[C@@H](C[NH3+])[C@H](C)C1 ZINC000631839371 372635505 /nfs/dbraw/zinc/63/55/05/372635505.db2.gz FPLXSOGBFIQVLW-NQBHXWOUSA-N 2 0 236.334 2.413 20 0 BEADRP Cc1cc(C[NH2+][C@H]2CCC[C@H]2C[NH3+])ccc1F ZINC000414794275 205772660 /nfs/dbraw/zinc/77/26/60/205772660.db2.gz LQNQHSNKWTVVHE-JSGCOSHPSA-N 2 0 236.334 2.351 20 0 BEADRP C(C1CC1)[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000246433221 374260208 /nfs/dbraw/zinc/26/02/08/374260208.db2.gz CSKBTEYENJBTKP-UKRRQHHQSA-N 2 0 234.387 2.345 20 0 BEADRP C[C@H]1CCCC[N@@H+]1CC[C@H]1CCC[NH+]1C ZINC000246575209 374276790 /nfs/dbraw/zinc/27/67/90/374276790.db2.gz CAJNOULRPRSQJJ-QWHCGFSZSA-N 2 0 210.365 2.345 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+][C@@H]2CC23CC3)c2ccccc21 ZINC000424378111 206040179 /nfs/dbraw/zinc/04/01/79/206040179.db2.gz SCQKFUVMMFOPEF-JHJVBQTASA-N 2 0 214.312 2.273 20 0 BEADRP CCc1cc(N(C)CC[N@H+](C)C2CC2)cc[nH+]1 ZINC000450448708 206102733 /nfs/dbraw/zinc/10/27/33/206102733.db2.gz CVEGCHWGFZTDSW-UHFFFAOYSA-N 2 0 233.359 2.174 20 0 BEADRP CCCC[C@@H](C)[NH2+]CC1CC[NH+](C)CC1 ZINC000044516565 168949237 /nfs/dbraw/zinc/94/92/37/168949237.db2.gz UHJBCJCQZUOVEU-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP CCC[N@H+](C)C[C@@H]1CC[NH+](CCC2CC2)C1 ZINC000336668547 169078876 /nfs/dbraw/zinc/07/88/76/169078876.db2.gz PCQOUJZYDNKCQT-AWEZNQCLSA-N 2 0 224.392 2.450 20 0 BEADRP CCC[N@H+](CCC[NH3+])Cc1ccc(OC)cc1 ZINC000036731880 169156659 /nfs/dbraw/zinc/15/66/59/169156659.db2.gz WSAAODUQTBGADB-UHFFFAOYSA-N 2 0 236.359 2.256 20 0 BEADRP CCC[NH+]1CCC(CNc2cc[nH+]c(C)c2)CC1 ZINC000357219621 169186721 /nfs/dbraw/zinc/18/67/21/169186721.db2.gz NHXGYBWZJRPZSF-UHFFFAOYSA-N 2 0 247.386 2.346 20 0 BEADRP CCC[NH+]1CCC([N@H+](C)CCCOCC)CC1 ZINC000119608430 169186751 /nfs/dbraw/zinc/18/67/51/169186751.db2.gz DFICWUWSZNWVPS-UHFFFAOYSA-N 2 0 242.407 2.219 20 0 BEADRP CCC[NH+]1CCC(C[NH2+]C[C@@H]2C[C@@H]2C)CC1 ZINC000336783188 169187176 /nfs/dbraw/zinc/18/71/76/169187176.db2.gz ZQXYQPPXAPHEFL-JSGCOSHPSA-N 2 0 224.392 2.354 20 0 BEADRP CCC[NH+]1CCC(C[NH2+]CCSCC)CC1 ZINC000309984043 169187207 /nfs/dbraw/zinc/18/72/07/169187207.db2.gz XKMRXAQLRMVXPH-UHFFFAOYSA-N 2 0 244.448 2.451 20 0 BEADRP CCC[NH+]1CCC([NH2+]C[C@@H](C)CC)CC1 ZINC000020190097 169187818 /nfs/dbraw/zinc/18/78/18/169187818.db2.gz CODHJBGKQPQXKH-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP CCC[NH+]1CCC([NH2+]CCCOC(C)C)CC1 ZINC000020197889 169187890 /nfs/dbraw/zinc/18/78/90/169187890.db2.gz IVJGDZGIANQHGD-UHFFFAOYSA-N 2 0 242.407 2.266 20 0 BEADRP CCC[NH+]1CCC([NH2+]C[C@@H]2CC[C@H](C)O2)CC1 ZINC000127736229 169188688 /nfs/dbraw/zinc/18/86/88/169188688.db2.gz QCZCWZQDXBEGTJ-JSGCOSHPSA-N 2 0 240.391 2.018 20 0 BEADRP CCC[NH+]1CCC([NH2+]CC(C)(C)C)CC1 ZINC000040492338 169188887 /nfs/dbraw/zinc/18/88/87/169188887.db2.gz RTVNDLOITVUTMR-UHFFFAOYSA-N 2 0 212.381 2.497 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H]2C[C@H](C)[C@@H]2C)CC1 ZINC000309428916 169189573 /nfs/dbraw/zinc/18/95/73/169189573.db2.gz YWQOZTAOPPLOIS-SGMGOOAPSA-N 2 0 224.392 2.495 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H](C)CCCOC)CC1 ZINC000359616997 169190156 /nfs/dbraw/zinc/19/01/56/169190156.db2.gz CSYUVZVGXPCKGL-ZDUSSCGKSA-N 2 0 242.407 2.266 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H](C)[C@H]2CCCO2)CC1 ZINC000020205808 169190404 /nfs/dbraw/zinc/19/04/04/169190404.db2.gz XHMINQOXFUIFEL-TZMCWYRMSA-N 2 0 240.391 2.018 20 0 BEADRP c1c[nH]c([C@@H]2CCC[N@@H+](CCC3CC3)C2)n1 ZINC000336665913 183326519 /nfs/dbraw/zinc/32/65/19/183326519.db2.gz JPTOFUGWAFXSQG-GFCCVEGCSA-N 2 0 219.332 2.389 20 0 BEADRP CCC[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000157450853 169198452 /nfs/dbraw/zinc/19/84/52/169198452.db2.gz BUYPMIVJFCUHGT-ZDUSSCGKSA-N 2 0 210.365 2.347 20 0 BEADRP c1cc(C[NH2+]C2CCCC2)cc2c1C[NH2+]C2 ZINC000163474770 183368563 /nfs/dbraw/zinc/36/85/63/183368563.db2.gz UOISRMQVGPOQFC-UHFFFAOYSA-N 2 0 216.328 2.322 20 0 BEADRP c1[nH+]cn2cc(C[NH2+][C@@H]3CCCSC3)ccc12 ZINC000297562286 183375630 /nfs/dbraw/zinc/37/56/30/183375630.db2.gz QPEPEYDJROXZSF-GFCCVEGCSA-N 2 0 247.367 2.320 20 0 BEADRP c1ccc(CC[N@H+]2CC[C@H]3C[NH2+]C[C@H]3CC2)cc1 ZINC000311204925 183392576 /nfs/dbraw/zinc/39/25/76/183392576.db2.gz IYWZEXSKZRGBHB-IYBDPMFKSA-N 2 0 244.382 2.161 20 0 BEADRP c1ccc(CC[N@@H+]2CC[C@@]3(C2)CCC[NH2+]C3)cc1 ZINC000067674190 183393205 /nfs/dbraw/zinc/39/32/05/183393205.db2.gz CURGXZNSJBBSAH-INIZCTEOSA-N 2 0 244.382 2.305 20 0 BEADRP CCC[NH2+][C@@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1 ZINC000250904672 169281584 /nfs/dbraw/zinc/28/15/84/169281584.db2.gz YJHUGCGXKOIEGL-YNEHKIRRSA-N 2 0 210.365 2.297 20 0 BEADRP CCCOc1ccc(C[NH2+]CCC[NH2+]C)cc1 ZINC000020967374 169318557 /nfs/dbraw/zinc/31/85/57/169318557.db2.gz JPVWIAAKVPBAIE-UHFFFAOYSA-N 2 0 236.359 2.175 20 0 BEADRP c1ccc2c(c1)CC[C@@H]2[NH2+]CC1CC[NH2+]CC1 ZINC000094009573 183444216 /nfs/dbraw/zinc/44/42/16/183444216.db2.gz XCMHFTYDMPFPKT-HNNXBMFYSA-N 2 0 230.355 2.263 20 0 BEADRP CCC[C@@H](C)[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000037485345 169370941 /nfs/dbraw/zinc/37/09/41/169370941.db2.gz KLFYBJYPRHYDQQ-VXGBXAGGSA-N 2 0 210.365 2.249 20 0 BEADRP CCC[C@@H](C)[NH2+]C[C@@H](C)C[NH+]1CCCC1 ZINC000062078118 169369492 /nfs/dbraw/zinc/36/94/92/169369492.db2.gz RGROBZWMNSNWSK-CHWSQXEVSA-N 2 0 212.381 2.497 20 0 BEADRP CCC[C@@H](C)C[N@@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC000366486237 169359007 /nfs/dbraw/zinc/35/90/07/169359007.db2.gz CYEZBPYVHDEVDI-KGLIPLIRSA-N 2 0 224.392 2.450 20 0 BEADRP CCC[C@@H](C)[N@H+](C)CCC1CC[NH2+]CC1 ZINC000036790844 169364082 /nfs/dbraw/zinc/36/40/82/169364082.db2.gz ZPACDOVNIPIGJK-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP CCC[C@@H](C)[C@@H](CC)[NH2+]CCN(C)C ZINC000336645996 169372292 /nfs/dbraw/zinc/37/22/92/169372292.db2.gz CHGCWWMEXVAWFT-VXGBXAGGSA-N 2 0 200.370 2.352 20 0 BEADRP CCC[C@@H](C[NH2+]C1CC[NH+](C(C)C)CC1)OC ZINC000356340349 169384517 /nfs/dbraw/zinc/38/45/17/169384517.db2.gz SIXLECZAKKXXLW-AWEZNQCLSA-N 2 0 242.407 2.264 20 0 BEADRP CCC[NH+]1CCC([NH2+]C[C@H]2CC2(C)C)CC1 ZINC000223812922 134343135 /nfs/dbraw/zinc/34/31/35/134343135.db2.gz HAMQIRVRKZHLST-GFCCVEGCSA-N 2 0 224.392 2.497 20 0 BEADRP CCC[C@H](CC)[NH2+][C@H](C)CC[NH+](C)C ZINC000224614004 134349334 /nfs/dbraw/zinc/34/93/34/134349334.db2.gz WDWHDYDSAFOFPF-NEPJUHHUSA-N 2 0 200.370 2.495 20 0 BEADRP c1ccc2c(c1)C[NH+](CC1CC[NH2+]CC1)C2 ZINC000000011385 383817997 /nfs/dbraw/zinc/81/79/97/383817997.db2.gz BHTNJHYCTNENRE-UHFFFAOYSA-N 2 0 216.328 2.002 20 0 BEADRP Cc1ccc(C[NH2+]CCC[NH+](C)C)cc1C ZINC000034991080 383822596 /nfs/dbraw/zinc/82/25/96/383822596.db2.gz LAJMQYVMHXJZIT-UHFFFAOYSA-N 2 0 220.360 2.345 20 0 BEADRP [NH3+]CC[C@@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000069723894 383841346 /nfs/dbraw/zinc/84/13/46/383841346.db2.gz MQCQBUTZPGTWDC-NSHDSACASA-N 2 0 224.373 2.309 20 0 BEADRP C[N@H+]1CC=C(C[NH2+]Cc2ccccc2F)CC1 ZINC000345184531 383841871 /nfs/dbraw/zinc/84/18/71/383841871.db2.gz JRTYCBWBPUQVDH-UHFFFAOYSA-N 2 0 234.318 2.177 20 0 BEADRP [NH3+]CC[C@@H]1CCCC[N@@H+]1Cc1ccsc1 ZINC000069720685 383843867 /nfs/dbraw/zinc/84/38/67/383843867.db2.gz PPTAZJQTVZHGOA-LBPRGKRZSA-N 2 0 224.373 2.451 20 0 BEADRP [NH3+]C[C@@H]1CCCCN1C[C@@H]1CCC(F)(F)C1 ZINC000301020434 383847365 /nfs/dbraw/zinc/84/73/65/383847365.db2.gz ZSWOBXWADCFZCG-MNOVXSKESA-N 2 0 232.318 2.235 20 0 BEADRP CC[NH+]1C[C@H]2C[NH+](Cc3ccccc3)C[C@@H]2C1 ZINC000409439188 383848099 /nfs/dbraw/zinc/84/80/99/383848099.db2.gz QEWCPQVDZXGIBS-GJZGRUSLSA-N 2 0 230.355 2.070 20 0 BEADRP CC[N@H+](CCNC(=[NH2+])Nc1ccccc1)C1CC1 ZINC000066246556 383853719 /nfs/dbraw/zinc/85/37/19/383853719.db2.gz RUVGVJPLQRUBNX-UHFFFAOYSA-N 2 0 246.358 2.107 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH2+][C@H]2CCC(C)(C)C2)C1 ZINC000087771475 383865192 /nfs/dbraw/zinc/86/51/92/383865192.db2.gz PPPFFLUGQOLAIT-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1OCC[C@@H]1[NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000119892574 383912339 /nfs/dbraw/zinc/91/23/39/383912339.db2.gz KZUBRNOTIIBNDQ-JQWIXIFHSA-N 2 0 240.391 2.063 20 0 BEADRP C[NH+]1CCC(Nc2[nH+]ccc3[nH]ccc32)CC1 ZINC000643611333 383927888 /nfs/dbraw/zinc/92/78/88/383927888.db2.gz LOMROJZCUOHBLE-UHFFFAOYSA-N 2 0 230.315 2.069 20 0 BEADRP [NH3+][C@H]1CCC[C@@H](C[NH2+]Cc2cccs2)C1 ZINC000070503172 383930702 /nfs/dbraw/zinc/93/07/02/383930702.db2.gz OCLMMCLMGDALIW-MNOVXSKESA-N 2 0 224.373 2.355 20 0 BEADRP C[N@H+](CCc1ccccc1)CC1CC[NH2+]CC1 ZINC000088195262 383884912 /nfs/dbraw/zinc/88/49/12/383884912.db2.gz KDMWNFDQYNAIDS-UHFFFAOYSA-N 2 0 232.371 2.161 20 0 BEADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+]C2CC(C)(C)C2)C1 ZINC000309538850 383886449 /nfs/dbraw/zinc/88/64/49/383886449.db2.gz GAYVMJVQIPZADZ-LBPRGKRZSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1cccnc1 ZINC000037649302 383992196 /nfs/dbraw/zinc/99/21/96/383992196.db2.gz VAFQSEQIYZGGOX-OLZOCXBDSA-N 2 0 245.370 2.217 20 0 BEADRP C[C@H](C[NH2+]C1CCC(F)(F)CC1)C[NH+](C)C ZINC000647212720 383957774 /nfs/dbraw/zinc/95/77/74/383957774.db2.gz SATUMDORJPBKBS-SNVBAGLBSA-N 2 0 234.334 2.352 20 0 BEADRP CC(C)N(C)C[C@@H](C)[NH2+][C@@H]1CCC[C@H]1C ZINC000309130665 384024969 /nfs/dbraw/zinc/02/49/69/384024969.db2.gz XUKGIPBJGZGTAK-JHJVBQTASA-N 2 0 212.381 2.493 20 0 BEADRP CC[C@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)C1CC1 ZINC000643545971 384014878 /nfs/dbraw/zinc/01/48/78/384014878.db2.gz GOMWVZDBCXCGIX-STQMWFEESA-N 2 0 222.376 2.439 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)C1CC1 ZINC000643545969 384015272 /nfs/dbraw/zinc/01/52/72/384015272.db2.gz GOMWVZDBCXCGIX-OLZOCXBDSA-N 2 0 222.376 2.439 20 0 BEADRP C[C@H]([NH3+])[C@H]1CCC[N@H+](Cc2ccsc2)C1 ZINC000069627037 384052162 /nfs/dbraw/zinc/05/21/62/384052162.db2.gz ACIPRISQWRHXBB-JQWIXIFHSA-N 2 0 224.373 2.307 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000643547196 384033640 /nfs/dbraw/zinc/03/36/40/384033640.db2.gz AYWABYHZASYTHH-RYUDHWBXSA-N 2 0 222.376 2.439 20 0 BEADRP CC1(C)CC[C@H]1[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000643547197 384033888 /nfs/dbraw/zinc/03/38/88/384033888.db2.gz AYWABYHZASYTHH-VXGBXAGGSA-N 2 0 222.376 2.439 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CC2(CC)CC2)[C@@H](C)C1 ZINC000090219462 384034446 /nfs/dbraw/zinc/03/44/46/384034446.db2.gz GAIUJVUPQZQEKY-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP CCC[C@H](C)C[N@@H+]1CC[C@@]2(C1)CCC[NH2+]C2 ZINC000564973522 384053166 /nfs/dbraw/zinc/05/31/66/384053166.db2.gz NRQKIIISPOKHPD-KBPBESRZSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H]([NH2+]C1CC[NH2+]CC1)c1cccs1 ZINC000038040744 384061089 /nfs/dbraw/zinc/06/10/89/384061089.db2.gz PEGRLPYBTMCTKY-SECBINFHSA-N 2 0 210.346 2.151 20 0 BEADRP CCC[C@H](C[NH2+][C@@H]1CC[N@H+](CC)C[C@@H]1C)OC ZINC000449379258 384078306 /nfs/dbraw/zinc/07/83/06/384078306.db2.gz SIXIEUORTKRGRO-BFHYXJOUSA-N 2 0 242.407 2.121 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@@H]([NH3+])[C@@H](C)C2)s1 ZINC000224085374 384126335 /nfs/dbraw/zinc/12/63/35/384126335.db2.gz SFSULZYIBGSAOM-JOYOIKCWSA-N 2 0 224.373 2.226 20 0 BEADRP C[C@@H]1CSC[C@@H]1[NH2+][C@H]1CCC[C@H]([NH+](C)C)C1 ZINC000449175469 384165874 /nfs/dbraw/zinc/16/58/74/384165874.db2.gz RBXVBSOXGIOJPA-VOAKCMCISA-N 2 0 242.432 2.200 20 0 BEADRP C[C@@H]1CSC[C@@H]1[NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1 ZINC000449175468 384166733 /nfs/dbraw/zinc/16/67/33/384166733.db2.gz RBXVBSOXGIOJPA-NDBYEHHHSA-N 2 0 242.432 2.200 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@H]([NH3+])[C@H](C)C2)s1 ZINC000050225595 384167582 /nfs/dbraw/zinc/16/75/82/384167582.db2.gz SFSULZYIBGSAOM-SKDRFNHKSA-N 2 0 224.373 2.226 20 0 BEADRP CCC(CC)C[NH+]1CCC([C@@H](C)[NH3+])CC1 ZINC000082474676 384231310 /nfs/dbraw/zinc/23/13/10/384231310.db2.gz PTDXHWITGRUOAG-LLVKDONJSA-N 2 0 212.381 2.482 20 0 BEADRP C(C1CCC1)[NH+]1CCC([NH+]2CCCC2)CC1 ZINC000173538071 384236124 /nfs/dbraw/zinc/23/61/24/384236124.db2.gz BQZOYOFWORWYOU-UHFFFAOYSA-N 2 0 222.376 2.347 20 0 BEADRP C[C@@H]([NH3+])[C@@H](Cc1ccccc1)[NH2+]CCC1CC1 ZINC000422921992 384216134 /nfs/dbraw/zinc/21/61/34/384216134.db2.gz ROOWJUKWKDNAEV-IUODEOHRSA-N 2 0 232.371 2.335 20 0 BEADRP CC[N@H+](C)C[C@H]1CC[NH+](CCCOC(C)C)C1 ZINC000173886911 384276980 /nfs/dbraw/zinc/27/69/80/384276980.db2.gz MQJTXNBPBQAHRN-CQSZACIVSA-N 2 0 242.407 2.075 20 0 BEADRP C[C@@H]([NH2+]C1CC1)c1cccc(OCC[NH+](C)C)c1 ZINC000132684219 384245051 /nfs/dbraw/zinc/24/50/51/384245051.db2.gz NGKDQFIHSWPDNA-GFCCVEGCSA-N 2 0 248.370 2.440 20 0 BEADRP COc1ccc(C[N@H+](C)[C@H]2CCC[NH2+]CC2)cc1 ZINC000113712532 384261579 /nfs/dbraw/zinc/26/15/79/384261579.db2.gz WLHZGLSKYAPCPF-AWEZNQCLSA-N 2 0 248.370 2.269 20 0 BEADRP CSCCC[N@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000173791919 384263441 /nfs/dbraw/zinc/26/34/41/384263441.db2.gz RADJUNDYURUOLT-GFCCVEGCSA-N 2 0 230.421 2.013 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1Cc2ccccc21)[C@@H]1CCC[NH2+]1 ZINC000400444319 384277907 /nfs/dbraw/zinc/27/79/07/384277907.db2.gz PEOKZEDOZXISFR-WHOFXGATSA-N 2 0 230.355 2.056 20 0 BEADRP C[C@@H](C[NH2+]C1CCN(C2CC2)CC1)CC(F)F ZINC000647319771 384266127 /nfs/dbraw/zinc/26/61/27/384266127.db2.gz LHXUMNXMMNECDM-SNVBAGLBSA-N 2 0 246.345 2.494 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](Cc3cccs3)C[C@H]21 ZINC000228537469 384274413 /nfs/dbraw/zinc/27/44/13/384274413.db2.gz FUMKYKSMYPIVMB-RAIGVLPGSA-N 2 0 236.384 2.307 20 0 BEADRP CC[N@H+](C)C[C@@H]1CC[NH+](CCCOC(C)C)C1 ZINC000173886895 384276626 /nfs/dbraw/zinc/27/66/26/384276626.db2.gz MQJTXNBPBQAHRN-AWEZNQCLSA-N 2 0 242.407 2.075 20 0 BEADRP CC[NH+](CC)C[C@@H]1CC[N@H+](CCSC)C1 ZINC000174228843 384315094 /nfs/dbraw/zinc/31/50/94/384315094.db2.gz BNRPRVBOEDBOJA-LBPRGKRZSA-N 2 0 230.421 2.013 20 0 BEADRP CCC(C)(C)C[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000174513593 384336692 /nfs/dbraw/zinc/33/66/92/384336692.db2.gz DLEFOXAYHPBHOM-VXGBXAGGSA-N 2 0 212.381 2.495 20 0 BEADRP Cc1ccc(C[N@@H+]2CCCC[C@H]2CC[NH3+])cn1 ZINC000228858747 384346742 /nfs/dbraw/zinc/34/67/42/384346742.db2.gz LJKGLCAWWSIXQD-AWEZNQCLSA-N 2 0 233.359 2.093 20 0 BEADRP Cc1ccc(C[N@@H+]2CCCC[C@@H]2CC[NH3+])cn1 ZINC000228858736 384347101 /nfs/dbraw/zinc/34/71/01/384347101.db2.gz LJKGLCAWWSIXQD-CQSZACIVSA-N 2 0 233.359 2.093 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]CC1(C)CC1 ZINC000300359087 384357956 /nfs/dbraw/zinc/35/79/56/384357956.db2.gz MNCPLLRIZULHKZ-IJLUTSLNSA-N 2 0 210.365 2.105 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCCSC)[C@H](C)C1 ZINC000174780954 384363239 /nfs/dbraw/zinc/36/32/39/384363239.db2.gz JOGBDUCKUMMYFF-CHWSQXEVSA-N 2 0 244.448 2.402 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CC[NH2+]C1)c1cccs1 ZINC000095068387 384330898 /nfs/dbraw/zinc/33/08/98/384330898.db2.gz SGONINODYFRNLP-ZJUUUORDSA-N 2 0 210.346 2.008 20 0 BEADRP C[NH+](C)CCCC[NH2+]Cc1cccc(F)c1 ZINC000045598374 384399336 /nfs/dbraw/zinc/39/93/36/384399336.db2.gz BGSKERVOEJOJPK-UHFFFAOYSA-N 2 0 224.323 2.257 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@H]1CCc2ccccc2C1 ZINC000045664082 384403798 /nfs/dbraw/zinc/40/37/98/384403798.db2.gz XMFXXBJWKMCELM-INIZCTEOSA-N 2 0 246.398 2.475 20 0 BEADRP C[C@@H]([NH2+]CCCC[NH3+])c1cccc(F)c1 ZINC000037715050 384512649 /nfs/dbraw/zinc/51/26/49/384512649.db2.gz MNJBADJGDLCDLQ-SNVBAGLBSA-N 2 0 210.296 2.215 20 0 BEADRP CC(C)CC[N@@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000150803612 384514399 /nfs/dbraw/zinc/51/43/99/384514399.db2.gz SRAGEKSIUILWMI-CQSZACIVSA-N 2 0 224.392 2.450 20 0 BEADRP C[C@@H]1C[C@H](C[N@H+](C)C2CC(C)(C)C2)CC[NH2+]1 ZINC000334623380 384527608 /nfs/dbraw/zinc/52/76/08/384527608.db2.gz UHPKNIHBNHWLAC-VXGBXAGGSA-N 2 0 224.392 2.495 20 0 BEADRP FC1(F)CC([NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)C1 ZINC000309484231 384544077 /nfs/dbraw/zinc/54/40/77/384544077.db2.gz FRNJNHCAKCDLGK-KOLCDFICSA-N 2 0 230.302 2.001 20 0 BEADRP Cc1cccc(CC[NH2+][C@@H]2CCCCC[C@@H]2[NH3+])n1 ZINC000423081067 384551665 /nfs/dbraw/zinc/55/16/65/384551665.db2.gz AZUGCOSXVPOMGW-LSDHHAIUSA-N 2 0 247.386 2.182 20 0 BEADRP FC1(F)CCC[N@H+](CC2CC[NH2+]CC2)CC1 ZINC000258237491 384551907 /nfs/dbraw/zinc/55/19/07/384551907.db2.gz ALKKTQCKCKBOQR-UHFFFAOYSA-N 2 0 232.318 2.107 20 0 BEADRP CCC[C@H](C)[NH2+]CC(C)(C)C[NH+](C)C ZINC000019905925 384556298 /nfs/dbraw/zinc/55/62/98/384556298.db2.gz DVSNGTXMEDYWGE-NSHDSACASA-N 2 0 200.370 2.352 20 0 BEADRP CSC1(C[NH2+][C@@H]2CCC[C@H]([NH+](C)C)C2)CC1 ZINC000309728985 384559154 /nfs/dbraw/zinc/55/91/54/384559154.db2.gz ZABOWUIHRNPWNX-NEPJUHHUSA-N 2 0 242.432 2.344 20 0 BEADRP CC[N@H+](CC[C@@H]1CC[NH2+]C1)CCC(F)(F)F ZINC000643057514 384562136 /nfs/dbraw/zinc/56/21/36/384562136.db2.gz LREKDWNPPDKDJB-JTQLQIEISA-N 2 0 238.297 2.260 20 0 BEADRP C[NH+](C)CCC[NH2+][C@@H]1CCc2ccccc21 ZINC000019958634 384562291 /nfs/dbraw/zinc/56/22/91/384562291.db2.gz NQIVXZPDSVJSHK-CQSZACIVSA-N 2 0 218.344 2.215 20 0 BEADRP CC(C)CCC[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000162088428 384568214 /nfs/dbraw/zinc/56/82/14/384568214.db2.gz DGNRVRFYFQIZNY-CYBMUJFWSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH+](C)C1(CNC(=[NH2+])Nc2ccccc2)CCC1 ZINC000097925043 384578983 /nfs/dbraw/zinc/57/89/83/384578983.db2.gz QWFPXLJQOCAKRG-UHFFFAOYSA-N 2 0 246.358 2.107 20 0 BEADRP CC(C)C[C@H]([NH3+])C[N@@H+]1CC[C@@H]2CCC[C@H]21 ZINC000355107507 384581686 /nfs/dbraw/zinc/58/16/86/384581686.db2.gz NSPOKMZBCCOVFJ-RWMBFGLXSA-N 2 0 210.365 2.234 20 0 BEADRP Cc1nc2ccc(C[N@H+](C)CCC[NH3+])cc2s1 ZINC000517935720 384583571 /nfs/dbraw/zinc/58/35/71/384583571.db2.gz BRICHHFZRSIEET-UHFFFAOYSA-N 2 0 249.383 2.385 20 0 BEADRP CCC[N@H+](C)C[C@@H]1CC[NH+](CCCF)C1 ZINC000151336840 384565366 /nfs/dbraw/zinc/56/53/66/384565366.db2.gz FNGTVSHNVPXKQD-LBPRGKRZSA-N 2 0 216.344 2.010 20 0 BEADRP C[NH2+]C[C@H]1CCC[N@H+](C[C@@H]2CCC(F)(F)C2)C1 ZINC000306049649 384567917 /nfs/dbraw/zinc/56/79/17/384567917.db2.gz VVGLVEWRQQBXLB-VXGBXAGGSA-N 2 0 246.345 2.353 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@H](CC[NH+](C)C)C(C)(C)C)CO1 ZINC000647184042 384603231 /nfs/dbraw/zinc/60/32/31/384603231.db2.gz ZGDZUUDNCFXBPU-JHJVBQTASA-N 2 0 242.407 2.120 20 0 BEADRP CSCCC[N@H+](C)C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000300855847 384611148 /nfs/dbraw/zinc/61/11/48/384611148.db2.gz OKYQYOAACCPFOJ-VXGBXAGGSA-N 2 0 230.421 2.059 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]CC2CC[NH2+]CC2)C1 ZINC000086700455 384672960 /nfs/dbraw/zinc/67/29/60/384672960.db2.gz ZSIYQCDFIOJWDI-DGCLKSJQSA-N 2 0 210.365 2.154 20 0 BEADRP c1ccc([C@H]2CC[N@@H+](CC3CC[NH2+]CC3)C2)cc1 ZINC000050599368 384634689 /nfs/dbraw/zinc/63/46/89/384634689.db2.gz RJABRYAOJWHDDJ-INIZCTEOSA-N 2 0 244.382 2.476 20 0 BEADRP Cc1ccc(CN2CC[C@H]3CC[NH2+][C@H]3C2)c(C)c1 ZINC000647532815 384638573 /nfs/dbraw/zinc/63/85/73/384638573.db2.gz DWDDWQCHYNKQNB-ZBFHGGJFSA-N 2 0 244.382 2.487 20 0 BEADRP C[N@H+](CCC[NH3+])CCc1ccc(Cl)cc1 ZINC000049820587 384641185 /nfs/dbraw/zinc/64/11/85/384641185.db2.gz CPFCVWATEVLUAF-UHFFFAOYSA-N 2 0 226.751 2.163 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[N@@H+]1CC[C@@H]2CC[NH2+][C@H]2C1 ZINC000647534853 384645802 /nfs/dbraw/zinc/64/58/02/384645802.db2.gz YAAYCYPJVHIZHV-BARDWOONSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@H]([NH3+])C1)C1CCCC1 ZINC000086404360 384645951 /nfs/dbraw/zinc/64/59/51/384645951.db2.gz SMPRYMGHYAGJJI-WCFLWFBJSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@H]([NH2+]CC1=CC[N@H+](C)CC1)c1cncc(F)c1 ZINC000271883889 384652940 /nfs/dbraw/zinc/65/29/40/384652940.db2.gz QDUNSTBJQADAAP-NSHDSACASA-N 2 0 249.333 2.133 20 0 BEADRP CC(C)CCOCC[N@@H+]1CCC[C@@H]([C@@H](C)[NH3+])C1 ZINC000104421451 384684153 /nfs/dbraw/zinc/68/41/53/384684153.db2.gz JTGRIYCOJRXFSV-ZIAGYGMSSA-N 2 0 242.407 2.108 20 0 BEADRP CC(C)[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CC[NH2+]C1 ZINC000126023095 384726297 /nfs/dbraw/zinc/72/62/97/384726297.db2.gz JHDLNWFINJHWCL-AGIUHOORSA-N 2 0 210.365 2.153 20 0 BEADRP Cc1ncc(C[NH+]2CCC([C@@H](C)[NH3+])CC2)s1 ZINC000082475138 384686069 /nfs/dbraw/zinc/68/60/69/384686069.db2.gz XDFYAKPZMRYMLJ-SECBINFHSA-N 2 0 239.388 2.011 20 0 BEADRP FC1(F)CCC[N@H+](C[C@H]2CCC[NH2+]C2)CC1 ZINC000258899529 384688864 /nfs/dbraw/zinc/68/88/64/384688864.db2.gz OEIYWBBQTQFPKW-NSHDSACASA-N 2 0 232.318 2.107 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H]2CC[C@@H]2C2CC2)CCCCC1 ZINC000423174574 384689070 /nfs/dbraw/zinc/68/90/70/384689070.db2.gz BDCDVXBVOAMRIG-CHWSQXEVSA-N 2 0 222.376 2.426 20 0 BEADRP CC(C)C[N@@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC000647543249 384712592 /nfs/dbraw/zinc/71/25/92/384712592.db2.gz KAALCUQFAKAUCO-KBPBESRZSA-N 2 0 224.392 2.354 20 0 BEADRP FC1(C[N@@H+]2CCC[C@H]([C@@H]3CCC[NH2+]C3)C2)CC1 ZINC000647543746 384712608 /nfs/dbraw/zinc/71/26/08/384712608.db2.gz RPJHQPHJYKERLV-OLZOCXBDSA-N 2 0 240.366 2.200 20 0 BEADRP CC1(C)CCC[C@@H]1[NH2+]CC1CC[NH2+]CC1 ZINC000086873617 384714288 /nfs/dbraw/zinc/71/42/88/384714288.db2.gz UEJNKGGFFRPZEM-LBPRGKRZSA-N 2 0 210.365 2.154 20 0 BEADRP CC[C@@H](C)[NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1 ZINC000125895387 384718321 /nfs/dbraw/zinc/71/83/21/384718321.db2.gz ZCIVWZNNYHPMRO-OLZOCXBDSA-N 2 0 212.381 2.495 20 0 BEADRP C[C@H]([NH2+]C1CCCCCC1)[C@H]1CCC[NH2+]1 ZINC000335037245 384780703 /nfs/dbraw/zinc/78/07/03/384780703.db2.gz BSCWARQBJXOYQX-WCQYABFASA-N 2 0 210.365 2.439 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH2+]C2CCCCC2)C1 ZINC000044535573 384776373 /nfs/dbraw/zinc/77/63/73/384776373.db2.gz JTHOFPLIKVTEIP-LBPRGKRZSA-N 2 0 210.365 2.251 20 0 BEADRP C[NH+](C)C1CCC([NH2+]Cc2cncs2)CC1 ZINC000309945790 384732283 /nfs/dbraw/zinc/73/22/83/384732283.db2.gz DITRTGYGGXMXBM-UHFFFAOYSA-N 2 0 239.388 2.106 20 0 BEADRP Cc1ccsc1C[NH2+][C@H](C)CCC[NH3+] ZINC000308481138 384742496 /nfs/dbraw/zinc/74/24/96/384742496.db2.gz GXZLMKKEWAOYFM-SNVBAGLBSA-N 2 0 212.362 2.274 20 0 BEADRP C[NH+](C)CC(C)(C)C[NH2+][C@@H]1CCC12CCC2 ZINC000309959995 384745938 /nfs/dbraw/zinc/74/59/38/384745938.db2.gz KPBUGWYBXSSOJL-GFCCVEGCSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH+](C)CCC[NH2+]C1CCC(C(F)F)CC1 ZINC000309972981 384752582 /nfs/dbraw/zinc/75/25/82/384752582.db2.gz QONVWJVXDDXZFR-UHFFFAOYSA-N 2 0 234.334 2.352 20 0 BEADRP Cc1ccc(CNC2C[C@H]3CC[C@@H](C2)[N@H+]3C)o1 ZINC000053035667 384759756 /nfs/dbraw/zinc/75/97/56/384759756.db2.gz STGOLWCVSSSBLK-YHWZYXNKSA-N 2 0 234.343 2.303 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+][C@H](C)[C@@H]1CCC[NH2+]C1 ZINC000423210431 384761554 /nfs/dbraw/zinc/76/15/54/384761554.db2.gz GHASCPWWXBKDCY-MQYQWHSLSA-N 2 0 224.392 2.399 20 0 BEADRP C[N@H+](C[C@@H]1CCCC(F)(F)C1)C1CC([NH3+])C1 ZINC000336233396 384823438 /nfs/dbraw/zinc/82/34/38/384823438.db2.gz FTNBYQQWCOAXLT-KPPDAEKUSA-N 2 0 232.318 2.233 20 0 BEADRP Cc1ccc(CN[C@@H]2CC[N@H+](C)[C@@H](C)C2)nc1C ZINC000314149330 384829948 /nfs/dbraw/zinc/82/99/48/384829948.db2.gz KSOJBPBDTBWESB-GXTWGEPZSA-N 2 0 247.386 2.271 20 0 BEADRP CC(C)CCC[NH2+]C[C@H](C)C[NH+](C)C ZINC000308592488 384835251 /nfs/dbraw/zinc/83/52/51/384835251.db2.gz WIMCZBGCQYXMGB-LBPRGKRZSA-N 2 0 200.370 2.210 20 0 BEADRP CCCC[C@@H](COC)[NH2+]C[C@@H]1CC[N@H+](CC)C1 ZINC000163276552 384782991 /nfs/dbraw/zinc/78/29/91/384782991.db2.gz TVZCUCTWOKOXMN-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)[C@@H]([NH3+])CN[C@H]1CCc2ccc(F)cc21 ZINC000423277107 384788020 /nfs/dbraw/zinc/78/80/20/384788020.db2.gz PESBIOMICRXYPN-KBPBESRZSA-N 2 0 236.334 2.386 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H]2CC[C@@H]2C2CCC2)C1 ZINC000423360603 384836039 /nfs/dbraw/zinc/83/60/39/384836039.db2.gz FWOKTAAENASYJF-XJFOESAGSA-N 2 0 222.376 2.425 20 0 BEADRP CC(C)C[C@H](C)C[N@@H+]1CC[C@@H]2[NH2+]CC[C@@H]2C1 ZINC000309246943 384789235 /nfs/dbraw/zinc/78/92/35/384789235.db2.gz CMSLCOBUKKRLMP-MJBXVCDLSA-N 2 0 224.392 2.352 20 0 BEADRP [NH3+]CCN(Cc1ccccc1)CC1CCC1 ZINC000083838110 384799711 /nfs/dbraw/zinc/79/97/11/384799711.db2.gz UERRDGBDZJPPAN-UHFFFAOYSA-N 2 0 218.344 2.247 20 0 BEADRP CCSCC[C@H](C)[NH2+][C@@H](C)CCC[NH3+] ZINC000308636328 384882307 /nfs/dbraw/zinc/88/23/07/384882307.db2.gz AZUKVNGWLGRDRW-QWRGUYRKSA-N 2 0 218.410 2.235 20 0 BEADRP C[C@H](C[NH2+][C@H](C)C(C)(C)C)C[NH+](C)C ZINC000308645537 384885042 /nfs/dbraw/zinc/88/50/42/384885042.db2.gz HJJUQGCDDDEWEE-GHMZBOCLSA-N 2 0 200.370 2.208 20 0 BEADRP COC[C@H]([NH2+][C@H]1CCC[C@H]([NH3+])C1)C1CCCC1 ZINC000423364806 384840876 /nfs/dbraw/zinc/84/08/76/384840876.db2.gz JYJPKGPMQNULAY-IHRRRGAJSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@@H]([NH3+])C1)c1ccc(F)cn1 ZINC000423366749 384843539 /nfs/dbraw/zinc/84/35/39/384843539.db2.gz CFLGJIVJRLMHNO-MVWJERBFSA-N 2 0 237.322 2.141 20 0 BEADRP Cc1cncc([C@H](C)[NH2+][C@H]2CCC[C@H]([NH3+])C2)c1 ZINC000423373474 384847702 /nfs/dbraw/zinc/84/77/02/384847702.db2.gz HMDAPCYOVQKEBV-UBHSHLNASA-N 2 0 233.359 2.311 20 0 BEADRP c1ccc(C[N@@H+]2CC[C@H]3C[NH2+]CC[C@@H]3C2)cc1 ZINC000084225114 384850706 /nfs/dbraw/zinc/85/07/06/384850706.db2.gz HMEQPPDSBRYYKW-LSDHHAIUSA-N 2 0 230.355 2.118 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@@H]1CCc2ccc(F)cc21 ZINC000423402019 384851263 /nfs/dbraw/zinc/85/12/63/384851263.db2.gz RDLVVAVNAMTAKY-WKPIXPDZSA-N 2 0 248.345 2.401 20 0 BEADRP CC(C)[C@H]1CC[C@@H]1[NH2+][C@@H]1CC[NH2+][C@H](C)C1 ZINC000423388127 384853549 /nfs/dbraw/zinc/85/35/49/384853549.db2.gz TUSPGBCJOHOJBW-LPWJVIDDSA-N 2 0 210.365 2.151 20 0 BEADRP Cc1ncc([C@H](C)[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)c(C)n1 ZINC000423393651 384853586 /nfs/dbraw/zinc/85/35/86/384853586.db2.gz QUMRPISAEKGWJG-CYZMBNFOSA-N 2 0 248.374 2.014 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+][C@H]1CC[NH2+]C[C@@H]1C ZINC000423409069 384856457 /nfs/dbraw/zinc/85/64/57/384856457.db2.gz YMOGHPJDXQAMEX-CYDGBPFRSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+]C[C@@H]1CC[C@H]2C[C@H]2C1 ZINC000403777749 384858042 /nfs/dbraw/zinc/85/80/42/384858042.db2.gz WSSQVDUXUFWAFY-YIYPIFLZSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@H](CC[NH2+][C@H]1CO[C@H](C)C1)[NH+]1CCCCC1 ZINC000647201083 384888988 /nfs/dbraw/zinc/88/89/88/384888988.db2.gz ZUDQYYNJNXVMLR-MGPQQGTHSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+][C@H]2CC[N@H+](C)C[C@@H]2C)C1 ZINC000336673288 384860122 /nfs/dbraw/zinc/86/01/22/384860122.db2.gz AKEPWHNPDBBDFQ-RFGFWPKPSA-N 2 0 224.392 2.352 20 0 BEADRP CCOc1ccc(C[NH2+]C[C@@H]2CCC[NH2+]C2)cc1 ZINC000259042308 384951273 /nfs/dbraw/zinc/95/12/73/384951273.db2.gz PQPAFWXOLJPUGH-CQSZACIVSA-N 2 0 248.370 2.175 20 0 BEADRP COc1ccc(CC[N@@H+]2CC[C@@H]([NH3+])C[C@@H]2C)cc1 ZINC000049707593 384898109 /nfs/dbraw/zinc/89/81/09/384898109.db2.gz XRWCGEOGVYZXEM-GXTWGEPZSA-N 2 0 248.370 2.049 20 0 BEADRP CCCCC[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000127651105 384912584 /nfs/dbraw/zinc/91/25/84/384912584.db2.gz RQWSTZLWMOGRNF-QWHCGFSZSA-N 2 0 210.365 2.393 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000251962161 384918480 /nfs/dbraw/zinc/91/84/80/384918480.db2.gz VTVODVMDYDBBOP-RWMBFGLXSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]Cc1ccsc1 ZINC000308694678 384919423 /nfs/dbraw/zinc/91/94/23/384919423.db2.gz SMYSAKISNRPLIU-JTQLQIEISA-N 2 0 212.362 2.355 20 0 BEADRP COc1ccc(C)cc1CC[NH2+][C@H]1CCC[C@@H]1[NH3+] ZINC000259239212 384959585 /nfs/dbraw/zinc/95/95/85/384959585.db2.gz YHQADCDHTLTGKP-KBPBESRZSA-N 2 0 248.370 2.016 20 0 BEADRP CC(C)[C@@H]1CCCC[N@@H+]1CC[C@H]1CC[NH2+]C1 ZINC000257770882 384929396 /nfs/dbraw/zinc/92/93/96/384929396.db2.gz IFTVDTFCCSQSJX-KGLIPLIRSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H](NC[C@H]1CCC[N@H+](C)C1)c1ccoc1 ZINC000087290077 384935814 /nfs/dbraw/zinc/93/58/14/384935814.db2.gz GIVRKPQGKQCSNU-VXGBXAGGSA-N 2 0 222.332 2.272 20 0 BEADRP CC[NH+]1CCC(N[C@H](C)c2ccoc2)CC1 ZINC000087289959 384941152 /nfs/dbraw/zinc/94/11/52/384941152.db2.gz GNHLFVZVEGVZIK-LLVKDONJSA-N 2 0 222.332 2.415 20 0 BEADRP CC(C)(C[NH2+][C@H]1CCC[C@@H]1[NH3+])c1ccccc1 ZINC000258762644 384941407 /nfs/dbraw/zinc/94/14/07/384941407.db2.gz APVWJUVHYOFJAC-KBPBESRZSA-N 2 0 232.371 2.434 20 0 BEADRP Cc1ccc(C[NH2+]CC[C@@H]2CCC[NH2+]C2)cc1 ZINC000258819586 384941620 /nfs/dbraw/zinc/94/16/20/384941620.db2.gz UYVLQQMUDAGRLF-AWEZNQCLSA-N 2 0 232.371 2.474 20 0 BEADRP COc1ccc(C[NH2+]C[C@H](C)C[NH3+])c(Cl)c1 ZINC000258838796 384947704 /nfs/dbraw/zinc/94/77/04/384947704.db2.gz VXUWFUVUSYAJJB-SECBINFHSA-N 2 0 242.750 2.033 20 0 BEADRP Cc1cncc(C[N@H+]2CCC[C@H](C)[C@@H]2CC[NH3+])c1 ZINC000404315867 384967976 /nfs/dbraw/zinc/96/79/76/384967976.db2.gz ZZDRSZXLILVDGA-ZFWWWQNUSA-N 2 0 247.386 2.339 20 0 BEADRP C(CC[NH2+][C@H]1CCCOC1)CC[NH+]1CCCC1 ZINC000340480629 384970050 /nfs/dbraw/zinc/97/00/50/384970050.db2.gz SPCKFVVBHSXBST-AWEZNQCLSA-N 2 0 240.391 2.021 20 0 BEADRP C[C@@H](Cc1ccsc1)[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000087646879 384984033 /nfs/dbraw/zinc/98/40/33/384984033.db2.gz NATMZGHGHRGXAB-WCQYABFASA-N 2 0 238.400 2.268 20 0 BEADRP CC[C@H](CSC)[NH2+][C@H]1CN(CC)C[C@@H]1C ZINC000336762002 384996190 /nfs/dbraw/zinc/99/61/90/384996190.db2.gz NIPZYGBEDSQWKQ-TUAOUCFPSA-N 2 0 230.421 2.058 20 0 BEADRP Cc1ccc(C[NH2+]C[C@H]2CCCN2C)cc1 ZINC000107778288 385001040 /nfs/dbraw/zinc/00/10/40/385001040.db2.gz BQIPHVHVXTYSQO-CQSZACIVSA-N 2 0 218.344 2.179 20 0 BEADRP COc1ccc(C[N@@H+]2CCC[C@@H]([C@@H](C)[NH3+])C2)cc1 ZINC000107954020 385013360 /nfs/dbraw/zinc/01/33/60/385013360.db2.gz LMXRJYXRGGDZGW-TZMCWYRMSA-N 2 0 248.370 2.254 20 0 BEADRP C[C@@H]([NH2+]C1CCCCC1)[C@@H]1CCC[NH2+]C1 ZINC000129792057 385013787 /nfs/dbraw/zinc/01/37/87/385013787.db2.gz QZAHXWCKDGAGDS-VXGBXAGGSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H](F)CC[NH2+][C@@H]1CC[N@H+](C)[C@@H]2CCC[C@@H]21 ZINC000340464314 385064478 /nfs/dbraw/zinc/06/44/78/385064478.db2.gz SPVKTRBFSQTGLH-UMSGYPCISA-N 2 0 228.355 2.197 20 0 BEADRP C[C@H](F)CC[NH2+][C@@H]1CC[N@H+](C)[C@@H]2CCC[C@H]21 ZINC000340464316 385065379 /nfs/dbraw/zinc/06/53/79/385065379.db2.gz SPVKTRBFSQTGLH-WUHRBBMRSA-N 2 0 228.355 2.197 20 0 BEADRP Cc1c[nH+]ccc1N[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000226880664 385065541 /nfs/dbraw/zinc/06/55/41/385065541.db2.gz IVPOFJXYCKRAHG-RYUDHWBXSA-N 2 0 219.332 2.285 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000423559717 385028485 /nfs/dbraw/zinc/02/84/85/385028485.db2.gz UGQFNGBGGBZNDK-SEBNEYGDSA-N 2 0 236.403 2.399 20 0 BEADRP Cc1ccc(CC[N@@H+]2CC[C@H]3C[NH2+]C[C@H]3C2)cc1 ZINC000334141479 385028601 /nfs/dbraw/zinc/02/86/01/385028601.db2.gz HMNOKLIRGOARLQ-HOTGVXAUSA-N 2 0 244.382 2.079 20 0 BEADRP COCc1ccccc1C[NH2+][C@@H](C)CCC[NH3+] ZINC000310548405 385110611 /nfs/dbraw/zinc/11/06/11/385110611.db2.gz TVQXUCCDBNKDOL-LBPRGKRZSA-N 2 0 236.359 2.050 20 0 BEADRP C[NH+](C)CC(C)(C)C[NH2+][C@@H]1CCCSC1 ZINC000061570868 385121817 /nfs/dbraw/zinc/12/18/17/385121817.db2.gz OMWVPYKKXRQPQP-LLVKDONJSA-N 2 0 230.421 2.059 20 0 BEADRP CC(C)[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000157359391 385151365 /nfs/dbraw/zinc/15/13/65/385151365.db2.gz YLZGDSMJXRPIBA-CYBMUJFWSA-N 2 0 210.365 2.345 20 0 BEADRP CC1(C[N@@H+]2CCC[C@@H]([C@H]3CCC[NH2+]3)C2)CC1 ZINC000647479732 385157035 /nfs/dbraw/zinc/15/70/35/385157035.db2.gz RLARNLZFIJOVHU-CHWSQXEVSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)CS1 ZINC000157366237 385159430 /nfs/dbraw/zinc/15/94/30/385159430.db2.gz WTPMYMMZSMBWGU-FVCCEPFGSA-N 2 0 240.416 2.097 20 0 BEADRP CC/C=C\CC[N@@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC000644784175 385170819 /nfs/dbraw/zinc/17/08/19/385170819.db2.gz GTXSFJOHKOJEKF-ZRUQZJFASA-N 2 0 222.376 2.370 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCc2cccs2)CC[N@@H+]1C ZINC000129658639 385173781 /nfs/dbraw/zinc/17/37/81/385173781.db2.gz YHDATGJFMAUXTB-VXGBXAGGSA-N 2 0 238.400 2.363 20 0 BEADRP CC(C)C[C@H](C)[NH2+]CC1=CC[N@H+](C)CC1 ZINC000308847267 385206345 /nfs/dbraw/zinc/20/63/45/385206345.db2.gz MSLXNILSRRBTSF-LBPRGKRZSA-N 2 0 210.365 2.273 20 0 BEADRP CSC1(C[NH2+][C@@H](C)CCCC[NH3+])CCC1 ZINC000308846273 385208156 /nfs/dbraw/zinc/20/81/56/385208156.db2.gz LLYBFOVXFIRVHT-NSHDSACASA-N 2 0 230.421 2.379 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H]1CCO[C@@H]1C ZINC000119776783 385212722 /nfs/dbraw/zinc/21/27/22/385212722.db2.gz WPNXLYXNQGIWOR-MJBXVCDLSA-N 2 0 242.407 2.264 20 0 BEADRP CC(C)C[C@H](C)C[N@@H+]1C[C@@H](C[NH3+])C[C@@H]1C ZINC000300988784 385222116 /nfs/dbraw/zinc/22/21/16/385222116.db2.gz VEXJHFDRUGUPBX-RWMBFGLXSA-N 2 0 212.381 2.338 20 0 BEADRP CCSCCC[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@H]1C ZINC000300990037 385222806 /nfs/dbraw/zinc/22/28/06/385222806.db2.gz VSZFFQNMZRHCCS-JHJVBQTASA-N 2 0 244.448 2.448 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@H](C)CC(F)(F)F ZINC000308860570 385222937 /nfs/dbraw/zinc/22/29/37/385222937.db2.gz PDUCLVZEENRAPI-RKDXNWHRSA-N 2 0 226.286 2.434 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CCC[C@H]3C[C@H]32)C1 ZINC000304562950 385239110 /nfs/dbraw/zinc/23/91/10/385239110.db2.gz LOBJZUAVAZXHEG-XJFOESAGSA-N 2 0 222.376 2.106 20 0 BEADRP C[NH+](C)CCCC[NH2+]CC1CCCCC1 ZINC000045663035 385273562 /nfs/dbraw/zinc/27/35/62/385273562.db2.gz ABSFLWDUCVSSOZ-UHFFFAOYSA-N 2 0 212.381 2.498 20 0 BEADRP CC(C)(C[N@@H+]1CC[C@H](C[NH3+])C1)c1ccccc1 ZINC000647490637 385281885 /nfs/dbraw/zinc/28/18/85/385281885.db2.gz FSMZCQTZCMQCDG-CYBMUJFWSA-N 2 0 232.371 2.245 20 0 BEADRP [NH3+]C[C@H]1CC[N@H+](Cc2nccc3ccccc32)C1 ZINC000647490745 385282696 /nfs/dbraw/zinc/28/26/96/385282696.db2.gz NDWBLKZIYZLIMO-GFCCVEGCSA-N 2 0 241.338 2.015 20 0 BEADRP CC(C)(CCO)C[NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000227904904 385283345 /nfs/dbraw/zinc/28/33/45/385283345.db2.gz QBNPWQQSKLCIHN-KGLIPLIRSA-N 2 0 248.370 2.129 20 0 BEADRP CC(C)C[C@H]1CC[N@H+](C[C@H]2CCC[NH2+]C2)C1 ZINC000307808753 385288177 /nfs/dbraw/zinc/28/81/77/385288177.db2.gz MTJVPLFJLWRXMS-KGLIPLIRSA-N 2 0 224.392 2.354 20 0 BEADRP Cc1ccnc(NCC[N@H+]2CC=CCC2)c1 ZINC000280303582 385293563 /nfs/dbraw/zinc/29/35/63/385293563.db2.gz RQTAZGWUZWRHGI-UHFFFAOYSA-N 2 0 217.316 2.064 20 0 BEADRP CCC1CC([NH2+]CCC[NH+](CC)CC)C1 ZINC000308944675 385301223 /nfs/dbraw/zinc/30/12/23/385301223.db2.gz NIXWWYFVFTXFDJ-UHFFFAOYSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@H]([NH2+]CC1=CC[N@H+](C)CC1)C1CCC1 ZINC000308996569 385338336 /nfs/dbraw/zinc/33/83/36/385338336.db2.gz MRPNRLOBOUUNFV-NSHDSACASA-N 2 0 208.349 2.027 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCSC)[C@H](C)C1 ZINC000178978713 385354933 /nfs/dbraw/zinc/35/49/33/385354933.db2.gz MGALPTRIMWGCIE-VXGBXAGGSA-N 2 0 230.421 2.012 20 0 BEADRP CCOCCC[NH2+][C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000131914563 385367379 /nfs/dbraw/zinc/36/73/79/385367379.db2.gz PZQVMLMDWRBCJU-KBPBESRZSA-N 2 0 234.343 2.147 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+]C[C@H](C)C[NH3+])cc1 ZINC000309013155 385368769 /nfs/dbraw/zinc/36/87/69/385368769.db2.gz YDOGSQURYXDPBO-VXGBXAGGSA-N 2 0 206.333 2.240 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CCC[N@@H+]1C)C(C)(C)C ZINC000179470071 385377351 /nfs/dbraw/zinc/37/73/51/385377351.db2.gz NUWWEYNZAVGDQA-NEPJUHHUSA-N 2 0 212.381 2.495 20 0 BEADRP CC[C@H](C)C[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000180203967 385385486 /nfs/dbraw/zinc/38/54/86/385385486.db2.gz KRXYKFVDUCLPGV-LBPRGKRZSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1ccc(C)c(C[N@H+]2C[C@@H](C[NH3+])C[C@H]2C)c1 ZINC000228078923 385326603 /nfs/dbraw/zinc/32/66/03/385326603.db2.gz DJCRXGQGHNOFAK-ZIAGYGMSSA-N 2 0 232.371 2.473 20 0 BEADRP CC(C)[C@H](C)[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000319502734 385424866 /nfs/dbraw/zinc/42/48/66/385424866.db2.gz JEDBJFRVNMTNAK-RYUDHWBXSA-N 2 0 210.365 2.295 20 0 BEADRP CC(C)OCCCC[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000180456070 385391475 /nfs/dbraw/zinc/39/14/75/385391475.db2.gz WPXOVBAQPRWDRA-KBPBESRZSA-N 2 0 242.407 2.264 20 0 BEADRP CCC1(C[NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)CC1 ZINC000181242747 385404603 /nfs/dbraw/zinc/40/46/03/385404603.db2.gz VQNWVSZGRLDZCM-NEPJUHHUSA-N 2 0 210.365 2.249 20 0 BEADRP CC(C)C1(C[NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)CC1 ZINC000181263070 385404945 /nfs/dbraw/zinc/40/49/45/385404945.db2.gz DKPQENVAVJJFCJ-CHWSQXEVSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CC2(C3CC3)CC2)CC[N@@H+]1C ZINC000181654291 385411039 /nfs/dbraw/zinc/41/10/39/385411039.db2.gz XFYIUYVTOMURKT-AAEUAGOBSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CC2(C3CC3)CC2)CC[N@@H+]1C ZINC000181654258 385411824 /nfs/dbraw/zinc/41/18/24/385411824.db2.gz XFYIUYVTOMURKT-WCQYABFASA-N 2 0 222.376 2.249 20 0 BEADRP Cc1ccc(C[NH+]2C[C@H]3C[N@H+](C)C[C@H]3C2)c(C)c1 ZINC000194540311 385439447 /nfs/dbraw/zinc/43/94/47/385439447.db2.gz HSSPXZWLBKZUSC-IYBDPMFKSA-N 2 0 244.382 2.297 20 0 BEADRP CC[C@@](C)(C[NH2+]C[C@H](C)C[NH+]1CCCC1)OC ZINC000319536616 385441106 /nfs/dbraw/zinc/44/11/06/385441106.db2.gz AXNBFQLWKBSQPC-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@@H]1[C@@H]([NH2+][C@@H]2CCC2(C)C)CCCN1C ZINC000309144295 385434323 /nfs/dbraw/zinc/43/43/23/385434323.db2.gz URDQASBANGIECO-GRYCIOLGSA-N 2 0 210.365 2.247 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCN(C)C2CCCC2)[C@@H]1C ZINC000309257494 385501367 /nfs/dbraw/zinc/50/13/67/385501367.db2.gz ARKMMSNHEBZPSY-BZPMIXESSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000309274946 385508063 /nfs/dbraw/zinc/50/80/63/385508063.db2.gz DRGKZJLJNPHTHH-BBBLOLIVSA-N 2 0 238.297 2.292 20 0 BEADRP c1cn(CCC[NH2+]C2CC3(CCC3)C2)cn1 ZINC000309289785 385515242 /nfs/dbraw/zinc/51/52/42/385515242.db2.gz PTZNTYIGPFTBIU-UHFFFAOYSA-N 2 0 219.332 2.196 20 0 BEADRP COC(C)(C)[C@H](C)[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000302510578 385535160 /nfs/dbraw/zinc/53/51/60/385535160.db2.gz VCUVECROUXEYJS-YNEHKIRRSA-N 2 0 240.391 2.016 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@@H]2CC[C@H](F)C2)CC1 ZINC000309333959 385536263 /nfs/dbraw/zinc/53/62/63/385536263.db2.gz AAEKHVRJSRASGH-WCQYABFASA-N 2 0 228.355 2.339 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H]1CCCc2ccccc21 ZINC000309338807 385538645 /nfs/dbraw/zinc/53/86/45/385538645.db2.gz KOJPZVQLOAFOAC-RISCZKNCSA-N 2 0 218.344 2.248 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@H]1CCc2ccccc21 ZINC000309353782 385545519 /nfs/dbraw/zinc/54/55/19/385545519.db2.gz CCWRUTAQUIMLEC-FZMZJTMJSA-N 2 0 218.344 2.391 20 0 BEADRP C[C@H](C[NH2+][C@@H]1C[C@@H](C)[C@@H]1C)C[NH+]1CCCC1 ZINC000309346836 385546334 /nfs/dbraw/zinc/54/63/34/385546334.db2.gz MJJFXJNICYTMFC-YIYPIFLZSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](C)c1cccnc1 ZINC000309313895 385526849 /nfs/dbraw/zinc/52/68/49/385526849.db2.gz FQQZSWFDQPEUCM-RYUDHWBXSA-N 2 0 221.348 2.250 20 0 BEADRP Cc1nc(CC[NH2+][C@@H](C)CCCC[NH3+])cs1 ZINC000309406055 385572752 /nfs/dbraw/zinc/57/27/52/385572752.db2.gz UYIOIRAENBPZJU-JTQLQIEISA-N 2 0 241.404 2.101 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]C1CCC(C)(C)CC1 ZINC000414847942 385603726 /nfs/dbraw/zinc/60/37/26/385603726.db2.gz WLZLWKVTEVVJFC-NSHDSACASA-N 2 0 212.381 2.400 20 0 BEADRP CC(C)C[C@H](C)C[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000414848219 385606799 /nfs/dbraw/zinc/60/67/99/385606799.db2.gz KLZHCXZWKKZWFU-QWHCGFSZSA-N 2 0 212.381 2.258 20 0 BEADRP CCSCC[N@@H+]1C[C@H](C[NH3+])[C@H](C)C[C@@H]1C ZINC000397298433 385587133 /nfs/dbraw/zinc/58/71/33/385587133.db2.gz CLOHBHRCMMEOEC-WOPDTQHZSA-N 2 0 230.421 2.045 20 0 BEADRP [NH3+]CCCC[NH2+][C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000082862880 385591974 /nfs/dbraw/zinc/59/19/74/385591974.db2.gz DKHAPZUUMFTRIE-ZJUUUORDSA-N 2 0 238.297 2.436 20 0 BEADRP CCCC[C@H](COC)[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000414848846 385620802 /nfs/dbraw/zinc/62/08/02/385620802.db2.gz XNLYTSZVYBHGFB-ZIAGYGMSSA-N 2 0 242.407 2.171 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]Cc1ccc(F)c(Cl)c1 ZINC000414849752 385630806 /nfs/dbraw/zinc/63/08/06/385630806.db2.gz YMWSGKQEEQHHMO-SECBINFHSA-N 2 0 244.741 2.424 20 0 BEADRP CSCCCCC[NH2+][C@@H](C)CCC[NH3+] ZINC000336650260 385609419 /nfs/dbraw/zinc/60/94/19/385609419.db2.gz AMDCHBJZMBLINH-NSHDSACASA-N 2 0 218.410 2.237 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@@H]2CCC[C@@H]3C[C@@]32C)CC1 ZINC000337415444 385644376 /nfs/dbraw/zinc/64/43/76/385644376.db2.gz ZEHWTRUQPDAILQ-KFWWJZLASA-N 2 0 236.403 2.497 20 0 BEADRP Cc1ccc(C[NH2+][C@@H](C)CCC[NH3+])s1 ZINC000336682911 385645425 /nfs/dbraw/zinc/64/54/25/385645425.db2.gz ITLFYUCAXNGTNQ-VIFPVBQESA-N 2 0 212.362 2.274 20 0 BEADRP COc1cccc(C[NH2+][C@H](C)[C@@H]2CCC[NH2+]C2)c1 ZINC000414851892 385660349 /nfs/dbraw/zinc/66/03/49/385660349.db2.gz JMQSZCHSJVGXJL-TZMCWYRMSA-N 2 0 248.370 2.173 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CCC(C)C)[C@@H](C)C1 ZINC000221703270 385687701 /nfs/dbraw/zinc/68/77/01/385687701.db2.gz GHFFQHKDQDJCJY-STQMWFEESA-N 2 0 212.381 2.352 20 0 BEADRP C[N@H+]1CC=C(C[NH2+][C@@H]2CCC[C@H]3C[C@]32C)CC1 ZINC000337499540 385692718 /nfs/dbraw/zinc/69/27/18/385692718.db2.gz ZWSMXLUAFGRHPV-RRFJBIMHSA-N 2 0 234.387 2.417 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]([NH2+]CCC[NH3+])C[C@H]1C ZINC000336688774 385706579 /nfs/dbraw/zinc/70/65/79/385706579.db2.gz VUZUNMYFUOZYDT-UPJWGTAASA-N 2 0 212.381 2.386 20 0 BEADRP CC(C)C[C@H](C)C[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000414856188 385709617 /nfs/dbraw/zinc/70/96/17/385709617.db2.gz OASNXIBQYITESJ-STQMWFEESA-N 2 0 212.381 2.258 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@@H](C)CCc1ccco1 ZINC000336683785 385668746 /nfs/dbraw/zinc/66/87/46/385668746.db2.gz ZKRLYFZCKNGGGU-RYUDHWBXSA-N 2 0 224.348 2.318 20 0 BEADRP CC[C@@H](C)[NH+]1CCN(c2cc[nH+]cc2OC)CC1 ZINC000337462743 385671503 /nfs/dbraw/zinc/67/15/03/385671503.db2.gz LBCLJCGOEGSKNR-GFCCVEGCSA-N 2 0 249.358 2.011 20 0 BEADRP CC[C@H]([NH2+]C[C@H](C)C[NH3+])c1ccc(OC)cc1 ZINC000336691946 385730727 /nfs/dbraw/zinc/73/07/27/385730727.db2.gz HPPLNZMQDDLCJW-RISCZKNCSA-N 2 0 236.359 2.331 20 0 BEADRP Cc1cccc(C[NH2+][C@@H](C)[C@@H]2CCC[NH2+]C2)c1 ZINC000414857825 385732827 /nfs/dbraw/zinc/73/28/27/385732827.db2.gz QHCKKUWBHDJRTF-DZGCQCFKSA-N 2 0 232.371 2.473 20 0 BEADRP C[NH2+]CCC[NH2+][C@H](C)CCc1ccc(F)cc1 ZINC000414858610 385736555 /nfs/dbraw/zinc/73/65/55/385736555.db2.gz KGOCQTNNOCADSX-GFCCVEGCSA-N 2 0 238.350 2.346 20 0 BEADRP C[NH2+]Cc1ccccc1NC[C@H]1CC[NH2+][C@H](C)C1 ZINC000414861124 385745065 /nfs/dbraw/zinc/74/50/65/385745065.db2.gz FAZWBQNHDRPXIK-OLZOCXBDSA-N 2 0 247.386 2.206 20 0 BEADRP C[C@@H]([NH2+]Cc1ccccc1)[C@@H]1CCC[NH2+]C1 ZINC000414861308 385749915 /nfs/dbraw/zinc/74/99/15/385749915.db2.gz WKDZYEFUGUHSQU-TZMCWYRMSA-N 2 0 218.344 2.164 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1CCCC[C@@H]1C1CC1 ZINC000414861319 385750178 /nfs/dbraw/zinc/75/01/78/385750178.db2.gz RWOKNLHQRGNTDE-CHWSQXEVSA-N 2 0 210.365 2.154 20 0 BEADRP [NH3+][C@@H]1CCCN(CCCOCc2ccccc2)C1 ZINC000336698006 385754851 /nfs/dbraw/zinc/75/48/51/385754851.db2.gz BUQYZXXJSSWLOW-OAHLLOKOSA-N 2 0 248.370 2.016 20 0 BEADRP C[C@@H]1C[C@H]1C[NH2+]CC1([NH3+])CCCCCC1 ZINC000414862547 385755395 /nfs/dbraw/zinc/75/53/95/385755395.db2.gz VJXFDHWXSVQZLG-NEPJUHHUSA-N 2 0 210.365 2.284 20 0 BEADRP CC[NH2+]Cc1ccccc1NC[C@@H]1CCC[NH2+]C1 ZINC000414863360 385758949 /nfs/dbraw/zinc/75/89/49/385758949.db2.gz IYDYQBKGAJOMTP-CYBMUJFWSA-N 2 0 247.386 2.208 20 0 BEADRP C([NH2+][C@@H]1CCC[C@H]1C1CC1)[C@@H]1CCC[NH2+]C1 ZINC000414863896 385760635 /nfs/dbraw/zinc/76/06/35/385760635.db2.gz YKTLSCUCRXOUMG-KWCYVHTRSA-N 2 0 222.376 2.154 20 0 BEADRP C[NH2+]CCC[NH2+][C@H]1C[C@@H](C)CC(C)(C)C1 ZINC000414864530 385764164 /nfs/dbraw/zinc/76/41/64/385764164.db2.gz ZJQCHLXNUPZNCA-NEPJUHHUSA-N 2 0 212.381 2.400 20 0 BEADRP CCC[NH2+]CC[NH2+]C[C@H](C)CC1CCOCC1 ZINC000414864553 385764870 /nfs/dbraw/zinc/76/48/70/385764870.db2.gz CWRQGFPJZFYKIS-CYBMUJFWSA-N 2 0 242.407 2.028 20 0 BEADRP CC(C)[C@@H]1CC[C@H]([NH2+][C@H]2CC[NH2+]C2)C[C@H]1C ZINC000414865520 385768426 /nfs/dbraw/zinc/76/84/26/385768426.db2.gz DALAORDJZASFSE-RFGFWPKPSA-N 2 0 224.392 2.399 20 0 BEADRP CC(C)[C@@H]1CC[C@H]([NH2+][C@H]2CC[NH2+]C2)C[C@@H]1C ZINC000414865522 385768553 /nfs/dbraw/zinc/76/85/53/385768553.db2.gz DALAORDJZASFSE-XUXIUFHCSA-N 2 0 224.392 2.399 20 0 BEADRP CCN(CCC[NH+]1CCCC1)Cc1ccncc1 ZINC000271026451 385772914 /nfs/dbraw/zinc/77/29/14/385772914.db2.gz PFZVNPPSEDWDGQ-UHFFFAOYSA-N 2 0 247.386 2.389 20 0 BEADRP CC[N@H+](CCC[NH2+]C)CCc1cccs1 ZINC000309662984 385774155 /nfs/dbraw/zinc/77/41/55/385774155.db2.gz YUWQJMYGIGJWCP-UHFFFAOYSA-N 2 0 226.389 2.222 20 0 BEADRP CCOc1ccc([C@@H](C)[NH2+]C[C@H](C)C[NH3+])cc1 ZINC000336705563 385787875 /nfs/dbraw/zinc/78/78/75/385787875.db2.gz LCOPWXNACSVPQR-VXGBXAGGSA-N 2 0 236.359 2.331 20 0 BEADRP CC(C)[C@H](CN[C@H]1CC[NH2+]C1)c1ccccc1 ZINC000414866526 385780737 /nfs/dbraw/zinc/78/07/37/385780737.db2.gz FITSDYZSLWXBIL-GJZGRUSLSA-N 2 0 232.371 2.378 20 0 BEADRP CC(C)C[C@@H]1C[C@H]1[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000647799879 385799009 /nfs/dbraw/zinc/79/90/09/385799009.db2.gz RZFPJHANUXSTKE-KJWHEZOQSA-N 2 0 236.403 2.399 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@@H]1C[C@@H](C)[C@H]1C ZINC000336711668 385799604 /nfs/dbraw/zinc/79/96/04/385799604.db2.gz UNVDTPIAWDIJFD-JHJVBQTASA-N 2 0 212.381 2.351 20 0 BEADRP c1coc([C@@H]2C[C@H]2[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)c1 ZINC000647799624 385800016 /nfs/dbraw/zinc/80/00/16/385800016.db2.gz MPMISCQSQRJMRU-DHGKCCLASA-N 2 0 246.354 2.113 20 0 BEADRP C([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)[C@@H]1C[C@H]1C1CCC1 ZINC000647799407 385800338 /nfs/dbraw/zinc/80/03/38/385800338.db2.gz FLEIQXWUVLUEPF-NPJQDHAYSA-N 2 0 248.414 2.400 20 0 BEADRP C[C@@H](CCC1CC1)[NH2+][C@H]1CC[NH2+][C@H](C)C1 ZINC000414948671 385810253 /nfs/dbraw/zinc/81/02/53/385810253.db2.gz MNMLGEDEPBQZFQ-LOWVWBTDSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)CC(F)F ZINC000647800714 385810328 /nfs/dbraw/zinc/81/03/28/385810328.db2.gz JJESZKLCHVRUBQ-IRCOFANPSA-N 2 0 246.345 2.255 20 0 BEADRP C[C@@H](C[NH2+][C@@H](C)C1CCCC1)C[NH+](C)C ZINC000336714662 385812331 /nfs/dbraw/zinc/81/23/31/385812331.db2.gz WCAJIDMFQVVTJW-RYUDHWBXSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CCc1ccsc1 ZINC000336716130 385813776 /nfs/dbraw/zinc/81/37/76/385813776.db2.gz XGFARJWSNDVFLO-LLVKDONJSA-N 2 0 226.389 2.398 20 0 BEADRP CCC[NH2+]CC[NH2+]C[C@@H]1CCCC[C@@H]1C ZINC000414868194 385814310 /nfs/dbraw/zinc/81/43/10/385814310.db2.gz JPZJPBUPOPFFFN-STQMWFEESA-N 2 0 212.381 2.402 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@H]2CC[NH2+][C@H](C)C2)C1 ZINC000414950314 385816941 /nfs/dbraw/zinc/81/69/41/385816941.db2.gz OJRMLVOIYNRJNN-NDBYEHHHSA-N 2 0 210.365 2.295 20 0 BEADRP COc1ccccc1C1([NH2+][C@@H](C)C[C@H](C)[NH3+])CC1 ZINC000647802047 385833595 /nfs/dbraw/zinc/83/35/95/385833595.db2.gz CMCJAQVUYDANRC-RYUDHWBXSA-N 2 0 248.370 2.400 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+][C@H]1CC[NH2+][C@H](C)C1 ZINC000414955465 385836632 /nfs/dbraw/zinc/83/66/32/385836632.db2.gz UHYKELUTEWLRJY-BBBLOLIVSA-N 2 0 238.297 2.448 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CC1CCC(F)CC1 ZINC000647804256 385840246 /nfs/dbraw/zinc/84/02/46/385840246.db2.gz MWCVXOWILPGAQL-DMOGRIERSA-N 2 0 216.344 2.230 20 0 BEADRP C[C@@H]([NH2+]CC1CCC(F)CC1)[C@H]1CCC[NH2+]1 ZINC000647804260 385840460 /nfs/dbraw/zinc/84/04/60/385840460.db2.gz MXEYPLSZVRMUNS-IKWCTNDRSA-N 2 0 228.355 2.245 20 0 BEADRP C[C@@H]1SCC[C@@H]1[NH2+][C@@H]1CCCCC[C@H]1[NH3+] ZINC000647804207 385841108 /nfs/dbraw/zinc/84/11/08/385841108.db2.gz LJLAVHQDEVUWHI-WHOHXGKFSA-N 2 0 228.405 2.130 20 0 BEADRP [NH3+]CC1CCC([NH2+][C@@H]2CC[C@H]3C[C@H]3C2)CC1 ZINC000647804087 385841523 /nfs/dbraw/zinc/84/15/23/385841523.db2.gz IPVUQHBPAXGBSO-BMYFTYEUSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]Cc1cc2ccccc2o1 ZINC000414871075 385855285 /nfs/dbraw/zinc/85/52/85/385855285.db2.gz CTQBGVHVSODXBT-SNVBAGLBSA-N 2 0 218.300 2.117 20 0 BEADRP CC(C)[C@H](C)[NH2+]CCC1CC[NH+](C)CC1 ZINC000122136678 385889053 /nfs/dbraw/zinc/88/90/53/385889053.db2.gz ARFXKSGUIYKGPJ-LBPRGKRZSA-N 2 0 212.381 2.352 20 0 BEADRP CO[C@H](C)[C@@H](C)[NH2+]CCCCC[NH+]1CCCC1 ZINC000340479112 385889236 /nfs/dbraw/zinc/88/92/36/385889236.db2.gz VSRHVZYSVKEEJY-ZIAGYGMSSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+]C/C=C/c1ccc(F)cc1 ZINC000414964271 385904102 /nfs/dbraw/zinc/90/41/02/385904102.db2.gz UQGMCOZCQFWLTN-RDYIKARRSA-N 2 0 248.345 2.427 20 0 BEADRP FC1(F)CC(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)C1 ZINC000334492160 385909062 /nfs/dbraw/zinc/90/90/62/385909062.db2.gz FCEYWOREDMHCNS-VXGBXAGGSA-N 2 0 244.329 2.248 20 0 BEADRP COC[C@@]1(C[NH2+][C@@H](C)CCC(C)C)CCC[NH2+]1 ZINC000414964845 385909743 /nfs/dbraw/zinc/90/97/43/385909743.db2.gz YPNXXVQDHRJGFO-KBPBESRZSA-N 2 0 242.407 2.169 20 0 BEADRP C[C@@H](CC[NH3+])[NH2+]Cc1cnc(C(C)(C)C)s1 ZINC000414877882 385926677 /nfs/dbraw/zinc/92/66/77/385926677.db2.gz GNVHDJIETXMAJY-VIFPVBQESA-N 2 0 241.404 2.268 20 0 BEADRP C[C@]1(C[N@@H+]2CCC[C@H]3CCC[C@H]32)CC[NH2+]C1 ZINC000250801013 385927131 /nfs/dbraw/zinc/92/71/31/385927131.db2.gz OQVPWCOLWYBJOC-MCIONIFRSA-N 2 0 222.376 2.251 20 0 BEADRP CC1(C[NH2+][C@@H]2CCCCC[C@@H]2[NH3+])CCOCC1 ZINC000335038135 385927428 /nfs/dbraw/zinc/92/74/28/385927428.db2.gz HCAZAQJUWDEHRI-QWHCGFSZSA-N 2 0 240.391 2.053 20 0 BEADRP CCC[NH2+]CC[NH2+][C@H]1C[C@H](C)C[C@H](C)C1 ZINC000414872395 385865674 /nfs/dbraw/zinc/86/56/74/385865674.db2.gz PVSDKGCBGAOZFQ-ITGUQSILSA-N 2 0 212.381 2.400 20 0 BEADRP CCOC[C@@H](C)[NH2+]CCCCC[NH+]1CCCC1 ZINC000340472454 385867260 /nfs/dbraw/zinc/86/72/60/385867260.db2.gz BBWQYRYYXMELNB-CQSZACIVSA-N 2 0 242.407 2.267 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H]1CCC(C)(C)C[C@@H]1C ZINC000414872896 385871357 /nfs/dbraw/zinc/87/13/57/385871357.db2.gz GMSYFQZRABWBKM-GRYCIOLGSA-N 2 0 212.381 2.386 20 0 BEADRP [NH3+][C@H]1CCCCC[C@@H]1[NH2+]CC1CCSCC1 ZINC000335019265 385977740 /nfs/dbraw/zinc/97/77/40/385977740.db2.gz NAPONXLLUPLIIR-STQMWFEESA-N 2 0 242.432 2.379 20 0 BEADRP CC[NH+](CC)CCC[N@@H+]1CC[C@@H](OC)C[C@@H]1C ZINC000338365492 385980550 /nfs/dbraw/zinc/98/05/50/385980550.db2.gz RRRZLWMSCZNAFB-UONOGXRCSA-N 2 0 242.407 2.218 20 0 BEADRP [NH3+]C1(C[NH2+]C2CCC3(CC3)CC2)CCC1 ZINC000335022469 385983008 /nfs/dbraw/zinc/98/30/08/385983008.db2.gz GPJRSTRMFRCLLW-UHFFFAOYSA-N 2 0 208.349 2.180 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H]2CCC23CCCC3)CCC1 ZINC000335023797 385983953 /nfs/dbraw/zinc/98/39/53/385983953.db2.gz MKYLWWNXSBQLQK-LLVKDONJSA-N 2 0 208.349 2.180 20 0 BEADRP C[C@H]([NH2+][C@H]1CCCc2ccc(F)cc21)C1C[NH2+]C1 ZINC000335023576 385985031 /nfs/dbraw/zinc/98/50/31/385985031.db2.gz SBAYCGWWGDDVEJ-BONVTDFDSA-N 2 0 248.345 2.401 20 0 BEADRP CC1(C)CC([NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)C1 ZINC000336748370 385986240 /nfs/dbraw/zinc/98/62/40/385986240.db2.gz SRMZXJSTFOXGOM-LLVKDONJSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CC2([NH3+])CCC2)[C@@H](C)C1 ZINC000414877731 385931315 /nfs/dbraw/zinc/93/13/15/385931315.db2.gz NCVVMVCGGUNXIT-WOPDTQHZSA-N 2 0 210.365 2.282 20 0 BEADRP CC1CCC(C[NH2+][C@H]2CCC[C@@H]2[NH3+])CC1 ZINC000335043592 385936390 /nfs/dbraw/zinc/93/63/90/385936390.db2.gz PIGMUURKJNIFAM-TYUFSLCMSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]([NH2+]C1CC[NH+](CC2CC2)CC1)[C@H]1C[C@H]1C ZINC000414060621 385936841 /nfs/dbraw/zinc/93/68/41/385936841.db2.gz BDFHNDILENGUDI-JMSVASOKSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]C1Cc2ccccc2C1 ZINC000335044244 385938597 /nfs/dbraw/zinc/93/85/97/385938597.db2.gz XWUARBRLFUUIBF-MLGOLLRUSA-N 2 0 244.382 2.132 20 0 BEADRP Cc1ccccc1C[C@H](C)[NH2+]CC1([NH3+])CCC1 ZINC000414878710 385941287 /nfs/dbraw/zinc/94/12/87/385941287.db2.gz ORMIIWJCSBAXOB-ZDUSSCGKSA-N 2 0 232.371 2.397 20 0 BEADRP CC[C@H](C[C@@H](C)CC)[NH2+]C[C@H](C)C[NH3+] ZINC000414879111 385945711 /nfs/dbraw/zinc/94/57/11/385945711.db2.gz PCGDSXCIRFPUNY-QJPTWQEYSA-N 2 0 200.370 2.386 20 0 BEADRP CC[NH+](CC)CCC[N@@H+]1C[C@H](C)[C@H](C)C1 ZINC000338305348 385952005 /nfs/dbraw/zinc/95/20/05/385952005.db2.gz KIDHSIWIIFOLOH-BETUJISGSA-N 2 0 212.381 2.306 20 0 BEADRP Cc1c[nH+]ccc1N1CC[C@@]2(C1)CCC[N@@H+](C)C2 ZINC000335056007 385955599 /nfs/dbraw/zinc/95/55/99/385955599.db2.gz SQPROYDOXRYESD-HNNXBMFYSA-N 2 0 245.370 2.312 20 0 BEADRP CC1(C[NH2+][C@H]2CCC[C@@H]2[NH3+])CCCCC1 ZINC000335056047 385955683 /nfs/dbraw/zinc/95/56/83/385955683.db2.gz ANIWLGJELLEZCI-RYUDHWBXSA-N 2 0 210.365 2.426 20 0 BEADRP CC1(C[NH2+][C@H]2CCC[C@H]2[NH3+])CCCCC1 ZINC000335056044 385956292 /nfs/dbraw/zinc/95/62/92/385956292.db2.gz ANIWLGJELLEZCI-NEPJUHHUSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@H]1Cc2ccccc2[C@@H]1[NH2+]CC1([NH3+])CCC1 ZINC000335056829 385956498 /nfs/dbraw/zinc/95/64/98/385956498.db2.gz ZEUHWLRMBQYUFJ-SMDDNHRTSA-N 2 0 230.355 2.391 20 0 BEADRP CC1([NH3+])CC[NH+](CCCOc2ccccc2)CC1 ZINC000647924893 385958449 /nfs/dbraw/zinc/95/84/49/385958449.db2.gz UBAGQQQRALEGGK-UHFFFAOYSA-N 2 0 248.370 2.269 20 0 BEADRP Cc1cc(C[NH2+]C[C@H](C)C[NH3+])cc2cccnc12 ZINC000414879968 385960616 /nfs/dbraw/zinc/96/06/16/385960616.db2.gz QCJAHYLHJFRDFN-LLVKDONJSA-N 2 0 243.354 2.228 20 0 BEADRP CC[C@@H](C[NH2+]C[C@@H](C)C[NH3+])c1ccccc1 ZINC000414879995 385963102 /nfs/dbraw/zinc/96/31/02/385963102.db2.gz QFOWJKLSJZRESR-STQMWFEESA-N 2 0 220.360 2.365 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CN(C2CC2)C[C@@H]1C)[C@@H]1C[C@H]1C ZINC000414111181 386005543 /nfs/dbraw/zinc/00/55/43/386005543.db2.gz MDOXRRHTFMQLAO-QFCKPIOYSA-N 2 0 236.403 2.493 20 0 BEADRP C[C@H](CCCC(F)(F)F)[NH2+]C[C@@H](C)C[NH3+] ZINC000414882296 386011986 /nfs/dbraw/zinc/01/19/86/386011986.db2.gz TXWAMIURNVDRHG-DTWKUNHWSA-N 2 0 226.286 2.292 20 0 BEADRP COC1(C[NH2+][C@@H](C)CCCC[NH3+])CCCC1 ZINC000309521695 386018289 /nfs/dbraw/zinc/01/82/89/386018289.db2.gz UGVYTPWQMJTUQT-LBPRGKRZSA-N 2 0 228.380 2.053 20 0 BEADRP CC[C@@H](C)[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000414177196 386021254 /nfs/dbraw/zinc/02/12/54/386021254.db2.gz ICFWJHZMXCVHSZ-SNVBAGLBSA-N 2 0 203.289 2.222 20 0 BEADRP CC(C)N(C)CC[NH2+][C@H]1CCC12CCC2 ZINC000336753347 386023099 /nfs/dbraw/zinc/02/30/99/386023099.db2.gz HOROMAINDQUIRO-LBPRGKRZSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@H]1CCC[C@H]([NH2+]CC2=CC[NH2+]CC2)C1 ZINC000335061868 386026695 /nfs/dbraw/zinc/02/66/95/386026695.db2.gz YSUODMGFCMOKGM-AAEUAGOBSA-N 2 0 208.349 2.074 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+]CC1=CC[NH2+]CC1 ZINC000335061435 386026808 /nfs/dbraw/zinc/02/68/08/386026808.db2.gz TZPALTRFODUKGT-YPMHNXCESA-N 2 0 208.349 2.074 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)[C@H]1C[C@H]1C ZINC000414191450 386029874 /nfs/dbraw/zinc/02/98/74/386029874.db2.gz RYPGHNVLTJJKGS-RQJABVFESA-N 2 0 224.392 2.352 20 0 BEADRP CC[C@H]([NH3+])CNCc1cc2cc(F)ccc2o1 ZINC000414977397 386031454 /nfs/dbraw/zinc/03/14/54/386031454.db2.gz JUSBOKNPVQTCBP-NSHDSACASA-N 2 0 236.290 2.399 20 0 BEADRP c1cc(C[NH2+]C2CCSCC2)cc2c1C[NH2+]C2 ZINC000335064510 386034586 /nfs/dbraw/zinc/03/45/86/386034586.db2.gz SUYHBZITYRMLIZ-UHFFFAOYSA-N 2 0 248.395 2.275 20 0 BEADRP COCCC[C@H](C)[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC000414201711 386037680 /nfs/dbraw/zinc/03/76/80/386037680.db2.gz YIGAOKKZAOLQSX-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@@H]([NH2+]CCCC[N@H+](C)C1CC1)[C@H]1C[C@H]1C ZINC000414145977 385995638 /nfs/dbraw/zinc/99/56/38/385995638.db2.gz KYMBWVPWAXNXBQ-BZPMIXESSA-N 2 0 224.392 2.495 20 0 BEADRP [NH3+][C@@H](C[NH2+]CC1CCCCCC1)C1CC1 ZINC000414889400 386111535 /nfs/dbraw/zinc/11/15/35/386111535.db2.gz GKRZDNYJQZARKP-ZDUSSCGKSA-N 2 0 210.365 2.284 20 0 BEADRP CC(C)CCN(CC[NH3+])Cc1ccccc1 ZINC000038033231 386115546 /nfs/dbraw/zinc/11/55/46/386115546.db2.gz HGNPUWZIKMWZFV-UHFFFAOYSA-N 2 0 220.360 2.493 20 0 BEADRP c1ccc(C[NH2+]CC[C@H]2CCC[NH2+]C2)cc1 ZINC000054309171 386117153 /nfs/dbraw/zinc/11/71/53/386117153.db2.gz UNYUHZICYNLQEJ-CQSZACIVSA-N 2 0 218.344 2.166 20 0 BEADRP C1=C(CC[NH2+]C2CC[NH2+]CC2)CCCC1 ZINC000038040616 386118890 /nfs/dbraw/zinc/11/88/90/386118890.db2.gz HBKOJUMIQRJJFB-UHFFFAOYSA-N 2 0 208.349 2.219 20 0 BEADRP c1ccc(C[NH2+]CC[C@@H]2CCC[NH2+]C2)cc1 ZINC000054309170 386119202 /nfs/dbraw/zinc/11/92/02/386119202.db2.gz UNYUHZICYNLQEJ-AWEZNQCLSA-N 2 0 218.344 2.166 20 0 BEADRP C(C[NH2+][C@@H]1CCCSC1)C[C@H]1CCC[NH2+]1 ZINC000414982084 386063412 /nfs/dbraw/zinc/06/34/12/386063412.db2.gz YIIPNNFSKMPHQH-VXGBXAGGSA-N 2 0 228.405 2.004 20 0 BEADRP CC[C@@H]1CCC[C@@H](C[NH2+][C@H]2CC[NH2+]C2)C1 ZINC000414886760 386076698 /nfs/dbraw/zinc/07/66/98/386076698.db2.gz QLCFCVGOBWXTGT-UPJWGTAASA-N 2 0 210.365 2.154 20 0 BEADRP CCc1cccc(F)c1C[NH2+][C@H](C)CC[NH3+] ZINC000414886515 386077396 /nfs/dbraw/zinc/07/73/96/386077396.db2.gz CPCNNFAZTOFNND-SNVBAGLBSA-N 2 0 224.323 2.215 20 0 BEADRP CC[C@@H]([NH3+])CNCc1cccc2c1OC(C)(C)C2 ZINC000414984047 386081901 /nfs/dbraw/zinc/08/19/01/386081901.db2.gz UQTBJTYRJSKDES-CYBMUJFWSA-N 2 0 248.370 2.227 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+][C@@H]1C[C@H]1c1ccco1 ZINC000414328834 386123089 /nfs/dbraw/zinc/12/30/89/386123089.db2.gz CTMJQMQISORYRZ-XHJNMGKDSA-N 2 0 248.370 2.454 20 0 BEADRP CC[N@@H+](Cc1ccccc1C)C[C@H]1CC[NH2+]C1 ZINC000647877335 386147366 /nfs/dbraw/zinc/14/73/66/386147366.db2.gz NZWYNFBCZCQPTQ-AWEZNQCLSA-N 2 0 232.371 2.426 20 0 BEADRP C[C@@H]1CC(C)(C)CC[C@H]1[NH2+][C@H]1CC[NH2+]C1 ZINC000414892269 386150684 /nfs/dbraw/zinc/15/06/84/386150684.db2.gz XTTFRFQIQSMPEX-GRYCIOLGSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)C[C@H](C)C[C@H](C)[NH2+][C@@H]1CC[NH2+]C1 ZINC000414892768 386151930 /nfs/dbraw/zinc/15/19/30/386151930.db2.gz YIYUXJRZJZTJPX-RWMBFGLXSA-N 2 0 212.381 2.399 20 0 BEADRP CCC1(C)CCC([NH2+][C@@H]2CC[NH2+]C2)CC1 ZINC000414892711 386152764 /nfs/dbraw/zinc/15/27/64/386152764.db2.gz YDPFPTUHOOUCNR-OTTFEQOBSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H](CC[NH3+])[NH2+]Cc1cc2cc(F)ccc2o1 ZINC000414892649 386153070 /nfs/dbraw/zinc/15/30/70/386153070.db2.gz XEGQXNDVKSJUNE-SECBINFHSA-N 2 0 236.290 2.399 20 0 BEADRP C[C@H](CC[NH3+])[NH2+]C/C=C\c1ccc(F)cc1 ZINC000414892671 386153563 /nfs/dbraw/zinc/15/35/63/386153563.db2.gz XHURBMVZEPANCK-OTDNITJGSA-N 2 0 222.307 2.166 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@@H](C)CCc1ccccc1 ZINC000414991457 386153824 /nfs/dbraw/zinc/15/38/24/386153824.db2.gz QEOSIJQXMGQFDR-GXTWGEPZSA-N 2 0 220.360 2.335 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+]C[C@@H](C)c1ccccc1 ZINC000414991467 386153921 /nfs/dbraw/zinc/15/39/21/386153921.db2.gz QEZBNIRZFQQXGO-DGCLKSJQSA-N 2 0 206.333 2.117 20 0 BEADRP C[C@@H](CC[NH3+])[NH2+]C/C=C/c1ccc(F)cc1 ZINC000414892673 386154384 /nfs/dbraw/zinc/15/43/84/386154384.db2.gz XHURBMVZEPANCK-VUDBWIFFSA-N 2 0 222.307 2.166 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000414992438 386156695 /nfs/dbraw/zinc/15/66/95/386156695.db2.gz ROXAHGCGLPFZDX-LPEHRKFASA-N 2 0 238.297 2.434 20 0 BEADRP C[NH2+][C@@H]1CCN(CCCc2ccccc2C)C1 ZINC000430616202 386161064 /nfs/dbraw/zinc/16/10/64/386161064.db2.gz FQPMARYBGYNREQ-OAHLLOKOSA-N 2 0 232.371 2.221 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@@H](C)CCC(F)(F)F ZINC000414993659 386161853 /nfs/dbraw/zinc/16/18/53/386161853.db2.gz TUZMCAKIYZMASU-JGVFFNPUSA-N 2 0 212.259 2.044 20 0 BEADRP Cc1cccc([C@H]2CCC[N@@H+]2CCC[NH3+])c1 ZINC000414681602 386164200 /nfs/dbraw/zinc/16/42/00/386164200.db2.gz WCGKQCSRCIJTEW-CQSZACIVSA-N 2 0 218.344 2.481 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]C[C@@H]([NH3+])C2CC2)[C@@H]1C ZINC000414894824 386178105 /nfs/dbraw/zinc/17/81/05/386178105.db2.gz UKRMUOOQBIQXNA-WFFHOREQSA-N 2 0 210.365 2.138 20 0 BEADRP CC[C@H](Cc1ccccc1)[NH2+]C[C@@H]([NH3+])CC ZINC000414995785 386180059 /nfs/dbraw/zinc/18/00/59/386180059.db2.gz WSGKXSGXMCRONP-UONOGXRCSA-N 2 0 220.360 2.335 20 0 BEADRP CC[C@H](Cc1ccccc1)[NH2+]C[C@H]([NH3+])C1CC1 ZINC000414895010 386180655 /nfs/dbraw/zinc/18/06/55/386180655.db2.gz VBJWFGSKNJLEQP-CABCVRRESA-N 2 0 232.371 2.335 20 0 BEADRP [NH3+]CCC[NH+]1CCC(COc2ccccc2)CC1 ZINC000414691488 386187286 /nfs/dbraw/zinc/18/72/86/386187286.db2.gz ORNLWWUNKJKDJZ-UHFFFAOYSA-N 2 0 248.370 2.126 20 0 BEADRP CC(C)Oc1ccccc1C[NH2+][C@H](C)CC[NH3+] ZINC000414890264 386128548 /nfs/dbraw/zinc/12/85/48/386128548.db2.gz UFIXWPNYZLFEAV-GFCCVEGCSA-N 2 0 236.359 2.301 20 0 BEADRP CC(C)CCC1CC[NH+](CCC[NH3+])CC1 ZINC000414701386 386204615 /nfs/dbraw/zinc/20/46/15/386204615.db2.gz HAHQMKIFCAYCOY-UHFFFAOYSA-N 2 0 212.381 2.483 20 0 BEADRP C[C@@H](CC[NH3+])[NH2+]CCSCc1ccccc1 ZINC000414896990 386210226 /nfs/dbraw/zinc/21/02/26/386210226.db2.gz QNAYMTQRZFWPCM-LBPRGKRZSA-N 2 0 238.400 2.247 20 0 BEADRP C[C@H]1[C@H](c2ccccc2)CC[N@@H+]1CCC[NH3+] ZINC000414707046 386216312 /nfs/dbraw/zinc/21/63/12/386216312.db2.gz NJOIFMFQZSCKFU-GXTWGEPZSA-N 2 0 218.344 2.213 20 0 BEADRP C[C@@H]1C[C@@H](c2ccc(F)cc2)C[N@@H+]1CCC[NH3+] ZINC000414707112 386216976 /nfs/dbraw/zinc/21/69/76/386216976.db2.gz PBKJOHPPOVUFOY-DGCLKSJQSA-N 2 0 236.334 2.352 20 0 BEADRP C[C@H](CC1CC1)[NH2+]CC1(C)CC[NH2+]CC1 ZINC000414897701 386220283 /nfs/dbraw/zinc/22/02/83/386220283.db2.gz FHXKIEYIZAOLJO-LLVKDONJSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H](c1cccnc1)[N@H+](C)C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000414709936 386225745 /nfs/dbraw/zinc/22/57/45/386225745.db2.gz KPFWMLQJVYFAOH-MGPQQGTHSA-N 2 0 247.386 2.463 20 0 BEADRP CC[NH+](CC)CCN[C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000131887150 386227283 /nfs/dbraw/zinc/22/72/83/386227283.db2.gz LUKPNPRVMJHJRW-CABCVRRESA-N 2 0 247.386 2.063 20 0 BEADRP CC[N@H+](C)C[C@@H]1CC[NH+](CC2(SC)CC2)C1 ZINC000340562108 386228336 /nfs/dbraw/zinc/22/83/36/386228336.db2.gz VIGRFMFMEPCOIS-LBPRGKRZSA-N 2 0 242.432 2.156 20 0 BEADRP CCCc1cccc(C[NH2+][C@H](C)CC[NH3+])c1 ZINC000414898762 386233150 /nfs/dbraw/zinc/23/31/50/386233150.db2.gz TYNQENSRUYTFCE-GFCCVEGCSA-N 2 0 220.360 2.466 20 0 BEADRP CC(C)C[C@@H]([NH3+])CN(C)[C@@H](C)c1cccnc1 ZINC000414716702 386238075 /nfs/dbraw/zinc/23/80/75/386238075.db2.gz SQOXSTVWZQBTTP-GXTWGEPZSA-N 2 0 235.375 2.448 20 0 BEADRP CCSCC[NH+]1CCC(C[NH+](C)C)CC1 ZINC000336643550 386247001 /nfs/dbraw/zinc/24/70/01/386247001.db2.gz CWKAGRLKSMJXEV-UHFFFAOYSA-N 2 0 230.421 2.013 20 0 BEADRP CCCC[C@H](COC)[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000414899524 386247403 /nfs/dbraw/zinc/24/74/03/386247403.db2.gz CLMDUZITDAASCT-KGLIPLIRSA-N 2 0 242.407 2.171 20 0 BEADRP COc1ccc(C[NH2+]C[C@H]2CCC[C@H]([NH3+])C2)cc1 ZINC000415003464 386253743 /nfs/dbraw/zinc/25/37/43/386253743.db2.gz XFQNXUBNXKMAGO-KBPBESRZSA-N 2 0 248.370 2.302 20 0 BEADRP CC(C)C[C@H](C)[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000415005326 386298356 /nfs/dbraw/zinc/29/83/56/386298356.db2.gz JEHUCUCQINTUCC-FPMFFAJLSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]C[C@H]2CC[NH2+]C2)[C@@H]1C ZINC000414901510 386307779 /nfs/dbraw/zinc/30/77/79/386307779.db2.gz GBTTVJUPKBTFPE-NDBYEHHHSA-N 2 0 210.365 2.010 20 0 BEADRP CC(C)(C[NH2+][C@@H]1CCSC1)C[NH+]1CCCC1 ZINC000309707788 386311571 /nfs/dbraw/zinc/31/15/71/386311571.db2.gz WBGVZXSLHQEGTI-GFCCVEGCSA-N 2 0 242.432 2.204 20 0 BEADRP C[C@H]([NH3+])[C@H](C)[NH2+]CCCCOc1ccccc1 ZINC000415005883 386312023 /nfs/dbraw/zinc/31/20/23/386312023.db2.gz AXEJZDLHBCIQBI-STQMWFEESA-N 2 0 236.359 2.171 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CC2CCCCC2)CC[NH2+]1 ZINC000335261607 386320710 /nfs/dbraw/zinc/32/07/10/386320710.db2.gz OZYHCDQEFBNEDS-AAEUAGOBSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]1c2ccccc2CC[N@H+]1C[C@H]1CC[NH2+]C1 ZINC000647884446 386263916 /nfs/dbraw/zinc/26/39/16/386263916.db2.gz QKNNKCOMESBINQ-STQMWFEESA-N 2 0 230.355 2.215 20 0 BEADRP CC(C)[C@H](C)[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000297624823 386268721 /nfs/dbraw/zinc/26/87/21/386268721.db2.gz WFNSSOZHCIOVPQ-NSHDSACASA-N 2 0 217.316 2.468 20 0 BEADRP CCSCC[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000297642941 386269466 /nfs/dbraw/zinc/26/94/66/386269466.db2.gz XLAZEXDRVKFZBZ-UHFFFAOYSA-N 2 0 235.356 2.177 20 0 BEADRP C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@@H+]1C[C@H]1CC[NH2+]C1 ZINC000647884995 386270133 /nfs/dbraw/zinc/27/01/33/386270133.db2.gz VJZIPQPXLXQQED-RFGFWPKPSA-N 2 0 222.376 2.249 20 0 BEADRP Cc1nc2ccc(C[NH2+]CCCC[NH3+])cc2s1 ZINC000414900566 386278746 /nfs/dbraw/zinc/27/87/46/386278746.db2.gz HPFUUXVBZJHHSI-UHFFFAOYSA-N 2 0 249.383 2.433 20 0 BEADRP C[C@@H](CCc1ccc(F)cc1)[NH2+]CCCC[NH3+] ZINC000414903832 386344376 /nfs/dbraw/zinc/34/43/76/386344376.db2.gz LUKCAKLGCWRMAC-LBPRGKRZSA-N 2 0 238.350 2.475 20 0 BEADRP C[NH2+]CCC[NH+]1CCC(C2CCCC2)CC1 ZINC000647890058 386360323 /nfs/dbraw/zinc/36/03/23/386360323.db2.gz KNCDXBHUXSRDFO-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H]([NH2+]CC1(N(C)C)CCC1)C1CCC1 ZINC000336774740 386365627 /nfs/dbraw/zinc/36/56/27/386365627.db2.gz ZOZUHDKEZYKYOT-LLVKDONJSA-N 2 0 210.365 2.249 20 0 BEADRP CC(C)(CNCc1ccncc1)C[NH+]1CCCC1 ZINC000276690002 386366255 /nfs/dbraw/zinc/36/62/55/386366255.db2.gz KJOQSOJPDHHKOC-UHFFFAOYSA-N 2 0 247.386 2.293 20 0 BEADRP CSCCC[N@H+](C)CC[C@@H]1CCC[NH+]1C ZINC000336697230 386376569 /nfs/dbraw/zinc/37/65/69/386376569.db2.gz NMQSLYJEPULCSB-LBPRGKRZSA-N 2 0 230.421 2.156 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+][C@@H]1CC[N@H+](C)[C@@H]2CCC[C@@H]21 ZINC000453303024 386376679 /nfs/dbraw/zinc/37/66/79/386376679.db2.gz BAXWELFZJNIBHZ-XLWJZTARSA-N 2 0 236.403 2.495 20 0 BEADRP CC(C)(O)C(C)(C)C[NH2+][C@@H]1CCCCC[C@@H]1[NH3+] ZINC000331953057 386327863 /nfs/dbraw/zinc/32/78/63/386327863.db2.gz JLSYXBPFZUQCES-NWDGAFQWSA-N 2 0 242.407 2.033 20 0 BEADRP [NH3+]CCCC[NH2+][C@@H]1CCCC[C@H]1C1CC1 ZINC000414902513 386329731 /nfs/dbraw/zinc/32/97/31/386329731.db2.gz JUWHDVSFDHEENO-QWHCGFSZSA-N 2 0 210.365 2.284 20 0 BEADRP CCCC[N@@H+]1CC2(C[C@H]1C)CC[NH2+]CC2 ZINC000335275948 386335989 /nfs/dbraw/zinc/33/59/89/386335989.db2.gz BXYMURNAXIZUKQ-GFCCVEGCSA-N 2 0 210.365 2.251 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](CCc3ccccc3)C[C@@H]21 ZINC000230045703 386336665 /nfs/dbraw/zinc/33/66/65/386336665.db2.gz JJPZCAXYXGHNLE-OWCLPIDISA-N 2 0 244.382 2.288 20 0 BEADRP CCN(CC[NH2+][C@@H]1CCC12CCC2)C1CC1 ZINC000336754136 386442483 /nfs/dbraw/zinc/44/24/83/386442483.db2.gz FKHACAKWTGLSJR-CYBMUJFWSA-N 2 0 222.376 2.393 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]Cc2ccccc2)CC[N@@H+]1C ZINC000073655694 386451007 /nfs/dbraw/zinc/45/10/07/386451007.db2.gz KZTLAVPYGULHBC-TZMCWYRMSA-N 2 0 218.344 2.259 20 0 BEADRP CCC[C@@]1(CO)CCCN1CC[NH2+]C(C)(C)C ZINC000414758172 386406074 /nfs/dbraw/zinc/40/60/74/386406074.db2.gz MFWPIRATDQYPNV-AWEZNQCLSA-N 2 0 242.407 2.002 20 0 BEADRP [NH3+]CCCC[NH2+]Cc1coc(-c2ccccc2)n1 ZINC000414910006 386411708 /nfs/dbraw/zinc/41/17/08/386411708.db2.gz RMNHHNZARWXQLC-UHFFFAOYSA-N 2 0 245.326 2.170 20 0 BEADRP CCOCC[NH+]1CCC(C[NH+](CC)CC)CC1 ZINC000336707427 386412252 /nfs/dbraw/zinc/41/22/52/386412252.db2.gz HABMMWXEAHNAHV-UHFFFAOYSA-N 2 0 242.407 2.077 20 0 BEADRP CC(C)[N@H+](CC1CCC1)C[C@@H]1CC[NH2+]C1 ZINC000647991647 386418393 /nfs/dbraw/zinc/41/83/93/386418393.db2.gz WFRCRPTWBKWODP-CYBMUJFWSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]Cc1cccc(Cl)c1 ZINC000308494383 386426803 /nfs/dbraw/zinc/42/68/03/386426803.db2.gz BIIROJXZZWRNGR-SECBINFHSA-N 2 0 212.724 2.024 20 0 BEADRP Cc1cc(C[NH2+][C@@H]2C[C@H](C)N(C3CC3)C2)ccn1 ZINC000391182042 386467186 /nfs/dbraw/zinc/46/71/86/386467186.db2.gz KPVGHJOBXZBYAF-GXTWGEPZSA-N 2 0 245.370 2.105 20 0 BEADRP CC(C)C[C@H](C)C[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000414912555 386474940 /nfs/dbraw/zinc/47/49/40/386474940.db2.gz YOPKORGNWQNWAM-QWHCGFSZSA-N 2 0 212.381 2.400 20 0 BEADRP C[NH+]1CCC(C)(C[NH2+]Cc2cccc(O)c2)CC1 ZINC000227330826 386476090 /nfs/dbraw/zinc/47/60/90/386476090.db2.gz NOAKZDUSHFFRLJ-UHFFFAOYSA-N 2 0 248.370 2.214 20 0 BEADRP CCOc1ccccc1C[NH2+][C@@H]1CC[C@H](C[NH3+])C1 ZINC000415044362 386528861 /nfs/dbraw/zinc/52/88/61/386528861.db2.gz SJLUIOIKKRTGSP-GXTWGEPZSA-N 2 0 248.370 2.302 20 0 BEADRP CC[C@@H]1CCC[C@H](C[NH2+][C@@H]2[C@H]3C[NH2+]C[C@H]32)C1 ZINC000415042156 386528886 /nfs/dbraw/zinc/52/88/86/386528886.db2.gz SDVKEIAZTVTFIK-BJJPWKGXSA-N 2 0 222.376 2.010 20 0 BEADRP Cc1ccoc1CNC[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000135146907 386480451 /nfs/dbraw/zinc/48/04/51/386480451.db2.gz ILQYKLUUNYEBHA-LBPRGKRZSA-N 2 0 234.343 2.162 20 0 BEADRP C([NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)[C@@H]1CC12CC2 ZINC000417345928 386487991 /nfs/dbraw/zinc/48/79/91/386487991.db2.gz YMAJJKXIYJALCK-RWMBFGLXSA-N 2 0 220.360 2.003 20 0 BEADRP C[C@H](CCc1cccc(F)c1)[NH2+]CCCC[NH3+] ZINC000414913488 386488855 /nfs/dbraw/zinc/48/88/55/386488855.db2.gz VYXDHMQIRGVINN-GFCCVEGCSA-N 2 0 238.350 2.475 20 0 BEADRP C[C@@H](CCc1cccc(F)c1)[NH2+]CCCC[NH3+] ZINC000414913489 386489604 /nfs/dbraw/zinc/48/96/04/386489604.db2.gz VYXDHMQIRGVINN-LBPRGKRZSA-N 2 0 238.350 2.475 20 0 BEADRP C[C@@H]([NH3+])[C@H](C)[NH2+][C@H](C)CCC(F)(F)F ZINC000415013126 386496321 /nfs/dbraw/zinc/49/63/21/386496321.db2.gz KFKHSMVJSWWSHZ-PRJMDXOYSA-N 2 0 212.259 2.043 20 0 BEADRP C[C@H](CCc1ccsc1)[NH2+][C@@H](C)[C@H](C)[NH3+] ZINC000415013203 386496523 /nfs/dbraw/zinc/49/65/23/386496523.db2.gz KNZHREREWXJIOY-VWYCJHECSA-N 2 0 226.389 2.395 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]Cc1ccc2c[nH]nc2c1 ZINC000415014807 386499691 /nfs/dbraw/zinc/49/96/91/386499691.db2.gz MWZVLNXLIKRLAV-LLVKDONJSA-N 2 0 246.358 2.170 20 0 BEADRP COC[C@H](CC(C)C)[NH2+][C@@H](C)CCCC[NH3+] ZINC000415015643 386500039 /nfs/dbraw/zinc/50/00/39/386500039.db2.gz ONPIEBBTJKMPQN-STQMWFEESA-N 2 0 230.396 2.155 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]Cc1cccc2c1NCC2 ZINC000415015522 386500479 /nfs/dbraw/zinc/50/04/79/386500479.db2.gz OCPGDHBPFJADSB-GFCCVEGCSA-N 2 0 247.386 2.262 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]Cc1cccc2c1NCC2 ZINC000415015525 386500868 /nfs/dbraw/zinc/50/08/68/386500868.db2.gz OCPGDHBPFJADSB-LBPRGKRZSA-N 2 0 247.386 2.262 20 0 BEADRP Cc1cc([C@@H](C)[NH2+]C2CC[NH2+]CC2)cs1 ZINC000335453375 386529598 /nfs/dbraw/zinc/52/95/98/386529598.db2.gz UEMRTEAHDQAQNT-SNVBAGLBSA-N 2 0 224.373 2.459 20 0 BEADRP CC(C)n1nccc1C[NH2+][C@H](C)CCCC[NH3+] ZINC000415017574 386502632 /nfs/dbraw/zinc/50/26/32/386502632.db2.gz SLCAJLTUFUMNRK-GFCCVEGCSA-N 2 0 238.379 2.071 20 0 BEADRP CCCc1cccc(CN[C@H](C)[C@H](C)[NH3+])c1 ZINC000415016651 386502908 /nfs/dbraw/zinc/50/29/08/386502908.db2.gz OISHPWUDBVHMRP-NWDGAFQWSA-N 2 0 220.360 2.464 20 0 BEADRP C[C@H](CC1CCOCC1)[NH2+][C@@H](C)CCCC[NH3+] ZINC000415018557 386504023 /nfs/dbraw/zinc/50/40/23/386504023.db2.gz UKNFIUAHUALNRO-QWHCGFSZSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](C)CC1CCOCC1 ZINC000415018559 386504034 /nfs/dbraw/zinc/50/40/34/386504034.db2.gz UKNFIUAHUALNRO-STQMWFEESA-N 2 0 242.407 2.299 20 0 BEADRP c1ccc([C@H]2CCC[C@H]2[NH2+][C@@H]2[C@H]3C[NH2+]C[C@H]32)cc1 ZINC000415052324 386508156 /nfs/dbraw/zinc/50/81/56/386508156.db2.gz CMFLEJKPDFSBGC-LJIZCISZSA-N 2 0 242.366 2.130 20 0 BEADRP C[C@@H]1CCCC[C@H]1C[N@@H+]1CCC[C@H]2C[NH2+]C[C@H]21 ZINC000414785776 386513095 /nfs/dbraw/zinc/51/30/95/386513095.db2.gz TWXGJKOMDVDABX-CBBWQLFWSA-N 2 0 236.403 2.497 20 0 BEADRP CC(C)C[C@H](C)C[NH2+][C@@H](C)CCC[NH3+] ZINC000415025738 386513098 /nfs/dbraw/zinc/51/30/98/386513098.db2.gz RMQCNHLMXCZTPB-RYUDHWBXSA-N 2 0 200.370 2.386 20 0 BEADRP [NH3+]C[C@H]1CC[C@H](C[NH2+]Cc2cccc(O)c2)CC1 ZINC000415025033 386513406 /nfs/dbraw/zinc/51/34/06/386513406.db2.gz OXMFCJWOUXEVMB-JOCQHMNTSA-N 2 0 248.370 2.247 20 0 BEADRP C[C@H](C[NH2+][C@@H](C)CCC[NH3+])CC1CCOCC1 ZINC000415025459 386513412 /nfs/dbraw/zinc/51/34/12/386513412.db2.gz QZQRTPZRRYFLEM-STQMWFEESA-N 2 0 242.407 2.156 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]Cc1cc(F)c(F)cc1F ZINC000415026263 386513673 /nfs/dbraw/zinc/51/36/73/386513673.db2.gz SZJLABIDNLHDDN-MRVPVSSYSA-N 2 0 246.276 2.321 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+][C@H]1C[C@H](C)C[C@H](C)C1 ZINC000414787805 386530140 /nfs/dbraw/zinc/53/01/40/386530140.db2.gz CRIBUPPLDQJFPU-LOWDOPEQSA-N 2 0 212.381 2.384 20 0 BEADRP Cc1ccc(CCC[NH2+][C@@H]2CC[C@H](C[NH3+])C2)cn1 ZINC000415027600 386516348 /nfs/dbraw/zinc/51/63/48/386516348.db2.gz BFYNOOJUHXUYPE-LSDHHAIUSA-N 2 0 247.386 2.040 20 0 BEADRP Cc1ccc(F)cc1C[NH2+][C@H](C)CCC[NH3+] ZINC000415026390 386517118 /nfs/dbraw/zinc/51/71/18/386517118.db2.gz UDRBSZYLVUEPLM-LLVKDONJSA-N 2 0 224.323 2.351 20 0 BEADRP COCc1cccc(C[NH2+][C@@H]2CC[C@@H](C[NH3+])C2)c1 ZINC000415029188 386517151 /nfs/dbraw/zinc/51/71/51/386517151.db2.gz DNEQTNBYIJWJNI-IUODEOHRSA-N 2 0 248.370 2.050 20 0 BEADRP CCOc1ccccc1C[NH2+][C@H]1CC[C@@H](C[NH3+])C1 ZINC000415044366 386530412 /nfs/dbraw/zinc/53/04/12/386530412.db2.gz SJLUIOIKKRTGSP-OCCSQVGLSA-N 2 0 248.370 2.302 20 0 BEADRP [NH3+]C[C@H]1CC[C@@H]([NH2+]Cc2cccc(F)c2)C1 ZINC000415036916 386524784 /nfs/dbraw/zinc/52/47/84/386524784.db2.gz LUABHZOQQRXEGP-GXFFZTMASA-N 2 0 222.307 2.043 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CC[C@H](C[NH3+])C2)cc1 ZINC000415036890 386524963 /nfs/dbraw/zinc/52/49/63/386524963.db2.gz LTDQMFHXCRGVQG-KBPBESRZSA-N 2 0 218.344 2.212 20 0 BEADRP C[C@H](C[C@H]1CCC[NH2+]1)Nc1ccc(C[NH3+])cc1 ZINC000414916346 386525232 /nfs/dbraw/zinc/52/52/32/386525232.db2.gz SKKFCNYESAQTDL-BXUZGUMPSA-N 2 0 233.359 2.088 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+][C@@H]1CC[C@@H](C[NH3+])C1 ZINC000415039899 386527194 /nfs/dbraw/zinc/52/71/94/386527194.db2.gz OPKXUPCHOMCGED-OPRDCNLKSA-N 2 0 238.297 2.434 20 0 BEADRP COCc1cccc(CN[C@@H]2CC[NH2+]C2(C)C)c1 ZINC000415038902 386527258 /nfs/dbraw/zinc/52/72/58/386527258.db2.gz MIAAQAYKOQWEGA-CQSZACIVSA-N 2 0 248.370 2.063 20 0 BEADRP C[C@@H](C[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21)CC1CCCCC1 ZINC000415040129 386527498 /nfs/dbraw/zinc/52/74/98/386527498.db2.gz PUWMFWGYNDSYSC-RZFFKMDDSA-N 2 0 236.403 2.400 20 0 BEADRP CCC[C@@H](C[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21)c1ccccc1 ZINC000415039264 386527589 /nfs/dbraw/zinc/52/75/89/386527589.db2.gz PBEVNRXVTBMGRZ-CAOSSQGBSA-N 2 0 244.382 2.378 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCc2ccccc2C1)C[NH+](C)C ZINC000291709197 386453281 /nfs/dbraw/zinc/45/32/81/386453281.db2.gz LBHIQBFSBLKSBP-CZUORRHYSA-N 2 0 246.398 2.331 20 0 BEADRP COCc1cccc(C[N@@H+]2CC[C@H]([NH3+])[C@@H](C)C2)c1 ZINC000094338930 386458246 /nfs/dbraw/zinc/45/82/46/386458246.db2.gz ZQNBPLZTTNPUAA-WFASDCNBSA-N 2 0 248.370 2.002 20 0 BEADRP CC(C)[C@H](C[NH2+]C1CC[NH2+]CC1)c1cccnc1 ZINC000415077867 386586297 /nfs/dbraw/zinc/58/62/97/386586297.db2.gz FTAADLHBUSJQLE-HNNXBMFYSA-N 2 0 247.386 2.163 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+]C[C@@H](C)Cc1ccccc1 ZINC000414801017 386590585 /nfs/dbraw/zinc/59/05/85/386590585.db2.gz SUNLWVPYHZRKPB-ZFWWWQNUSA-N 2 0 234.387 2.438 20 0 BEADRP CC(C)([NH3+])CNCc1ccc(F)c2cccnc12 ZINC000414799839 386592400 /nfs/dbraw/zinc/59/24/00/386592400.db2.gz HKAYFJIRXNIHOZ-UHFFFAOYSA-N 2 0 247.317 2.201 20 0 BEADRP Cc1ccccc1C[NH2+][C@@H]1CC[C@@H](C[NH3+])C1 ZINC000415044504 386532791 /nfs/dbraw/zinc/53/27/91/386532791.db2.gz STQDSMSVOOCWFQ-TZMCWYRMSA-N 2 0 218.344 2.212 20 0 BEADRP CC1(C)CC[C@H]([NH2+][C@H]2CC[C@H](C[NH3+])C2)C1 ZINC000415047380 386534846 /nfs/dbraw/zinc/53/48/46/386534846.db2.gz WAKTZXPOYKPXFT-SRVKXCTJSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)C[C@@H](C)C[NH2+]C[C@@H]([NH3+])C(C)C ZINC000414787392 386537067 /nfs/dbraw/zinc/53/70/67/386537067.db2.gz CHDIUZVQRPSAAR-VXGBXAGGSA-N 2 0 200.370 2.242 20 0 BEADRP CC[C@@H]1C[C@H](C[NH2+][C@H](CN)C(C)(C)C)CCO1 ZINC000415056043 386537069 /nfs/dbraw/zinc/53/70/69/386537069.db2.gz PDXNFQBDIMHKJM-JHJVBQTASA-N 2 0 242.407 2.155 20 0 BEADRP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[NH2+]C1)c1cccnc1 ZINC000415081705 386596869 /nfs/dbraw/zinc/59/68/69/386596869.db2.gz KUSBBUSRDCDSOR-OBJOEFQTSA-N 2 0 233.359 2.120 20 0 BEADRP CC[C@]1(C)CC[N@H+](CC[C@H]2CCC[NH2+]C2)C1 ZINC000399386460 386540719 /nfs/dbraw/zinc/54/07/19/386540719.db2.gz RIUVNBMEEYTJOP-ZIAGYGMSSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H]1C[N@@H+]([C@@H]2CCC[C@@H]2C2CC2)C[C@@]1(C)C[NH3+] ZINC000415060103 386542257 /nfs/dbraw/zinc/54/22/57/386542257.db2.gz TYVVEGCICQJTNV-NMFUWQPSSA-N 2 0 236.403 2.482 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+]CC1C[NH2+]C1)[C@@H](C)C2 ZINC000335460898 386543333 /nfs/dbraw/zinc/54/33/33/386543333.db2.gz HASNRCIEFWXDNF-XHDPSFHLSA-N 2 0 230.355 2.037 20 0 BEADRP C([NH2+][C@H]1CCCCC12CCCC2)C1C[NH2+]C1 ZINC000335461705 386544008 /nfs/dbraw/zinc/54/40/08/386544008.db2.gz LNRADJSNVKCLRR-ZDUSSCGKSA-N 2 0 222.376 2.298 20 0 BEADRP C(C[NH2+]C1CC1)C[NH2+][C@@H]1CCC[C@@H]1C1CC1 ZINC000415064265 386545438 /nfs/dbraw/zinc/54/54/38/386545438.db2.gz CDUMNPHXWGDTAG-ZIAGYGMSSA-N 2 0 222.376 2.297 20 0 BEADRP CC1CCC([NH2+][C@H]2CCCC[NH2+]C2)CC1 ZINC000415069263 386551128 /nfs/dbraw/zinc/55/11/28/386551128.db2.gz OPSPVZOOYBNHSQ-BPCQOVAHSA-N 2 0 210.365 2.297 20 0 BEADRP COC[C@H](CC(C)C)[NH2+][C@@H]1CCCC[C@H]1C[NH3+] ZINC000414791944 386551503 /nfs/dbraw/zinc/55/15/03/386551503.db2.gz BPJPLTVQZCNKAW-MELADBBJSA-N 2 0 242.407 2.155 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CCCC[NH2+]C2)C1 ZINC000415071003 386555154 /nfs/dbraw/zinc/55/51/54/386555154.db2.gz RZPNTTPNBWRBBY-FRRDWIJNSA-N 2 0 210.365 2.297 20 0 BEADRP CCC[C@H](C)[NH2+]C[C@H](C)C[NH+]1CCCC1 ZINC000062078127 386561825 /nfs/dbraw/zinc/56/18/25/386561825.db2.gz RGROBZWMNSNWSK-STQMWFEESA-N 2 0 212.381 2.497 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@@H]1CCC[C@@H]1C1CC1 ZINC000414793336 386564990 /nfs/dbraw/zinc/56/49/90/386564990.db2.gz KGTVFSUEVOIZQV-JHJVBQTASA-N 2 0 210.365 2.138 20 0 BEADRP Fc1cccc(C2([NH2+]C[C@@H]3CC[NH2+]C3)CCC2)c1 ZINC000647996272 386571386 /nfs/dbraw/zinc/57/13/86/386571386.db2.gz HCTZJFXGDQBMSJ-GFCCVEGCSA-N 2 0 248.345 2.404 20 0 BEADRP C[C@H](CC1CCCCC1)[NH2+][C@H]1CC[NH2+]C1 ZINC000415113014 386620355 /nfs/dbraw/zinc/62/03/55/386620355.db2.gz WAQKPITYUPOCQI-YPMHNXCESA-N 2 0 210.365 2.297 20 0 BEADRP CCOc1ccccc1C[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000414924387 386624107 /nfs/dbraw/zinc/62/41/07/386624107.db2.gz KBYJASYTZZQJRS-KBPBESRZSA-N 2 0 248.370 2.445 20 0 BEADRP CC1(C)CCC[C@@H]([NH2+]CC2=CC[NH2+]CC2)C1 ZINC000335499430 386625391 /nfs/dbraw/zinc/62/53/91/386625391.db2.gz FBUHJQJQKYCPDK-CYBMUJFWSA-N 2 0 222.376 2.465 20 0 BEADRP C[C@@H]1CC(C)(C)C[N@@H+]1C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000415127048 386627069 /nfs/dbraw/zinc/62/70/69/386627069.db2.gz RKFOPLUKZOQFBL-JHJVBQTASA-N 2 0 224.392 2.495 20 0 BEADRP Cc1ccc(C[NH2+][C@@H](CN)C2CC2)c(C)c1 ZINC000414810347 386630086 /nfs/dbraw/zinc/63/00/86/386630086.db2.gz VGLNKJASFPCJQU-AWEZNQCLSA-N 2 0 218.344 2.130 20 0 BEADRP C[NH2+]CCCN(C)C/C=C\c1ccccc1OC ZINC000415134519 386639052 /nfs/dbraw/zinc/63/90/52/386639052.db2.gz ORFPQSOOSPMJJD-TWGQIWQCSA-N 2 0 248.370 2.250 20 0 BEADRP NC[C@H]([NH2+]CCC1CCCCC1)C1CC1 ZINC000414813251 386642424 /nfs/dbraw/zinc/64/24/24/386642424.db2.gz QKRHRCPDQDVCIG-ZDUSSCGKSA-N 2 0 210.365 2.284 20 0 BEADRP C[C@H](Cc1ccccc1F)[NH2+]CC[C@H](C)[NH3+] ZINC000414817223 386652245 /nfs/dbraw/zinc/65/22/45/386652245.db2.gz AGXJPOWLUMDTML-WDEREUQCSA-N 2 0 224.323 2.084 20 0 BEADRP Cc1ccccc1OCC[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000415082329 386599942 /nfs/dbraw/zinc/59/99/42/386599942.db2.gz LUDRTVXJLQYKTC-CQSZACIVSA-N 2 0 248.370 2.106 20 0 BEADRP C[C@H]([NH3+])c1ccc(C[NH2+]C[C@@H]2CCCOC2)cc1 ZINC000414803450 386600640 /nfs/dbraw/zinc/60/06/40/386600640.db2.gz CSUBUUSIFCOKAA-JSGCOSHPSA-N 2 0 248.370 2.223 20 0 BEADRP C[C@@H](CCCC(F)(F)F)[NH2+]CC(C)(C)[NH3+] ZINC000414804623 386608565 /nfs/dbraw/zinc/60/85/65/386608565.db2.gz NSFMYBJQEAJCPQ-QMMMGPOBSA-N 2 0 226.286 2.434 20 0 BEADRP C[C@@H]([NH2+]C[C@@H](C)C[NH3+])c1ccc(F)cc1F ZINC000336645449 386611836 /nfs/dbraw/zinc/61/18/36/386611836.db2.gz ATNHTQDELNXYOK-DTWKUNHWSA-N 2 0 228.286 2.210 20 0 BEADRP CC[C@H](COC)[NH2+]Cc1ccc([C@H](C)[NH3+])cc1 ZINC000414805277 386612477 /nfs/dbraw/zinc/61/24/77/386612477.db2.gz AJTSWJSDAQYHKH-SMDDNHRTSA-N 2 0 236.359 2.221 20 0 BEADRP [NH3+]C[C@H](NC/C=C\c1ccc(F)cc1)C1CC1 ZINC000414807920 386612673 /nfs/dbraw/zinc/61/26/73/386612673.db2.gz RTSPXHBBRLXOIZ-BOPNBLERSA-N 2 0 234.318 2.166 20 0 BEADRP C1CC2(CCCC2)[C@@H]1[NH2+][C@H]1CCCC[NH2+]C1 ZINC000335493637 386613380 /nfs/dbraw/zinc/61/33/80/386613380.db2.gz BLIKMVGSHNTIKB-QWHCGFSZSA-N 2 0 222.376 2.441 20 0 BEADRP C1CC2(CCCC2)[C@@H]1[NH2+][C@@H]1CCCC[NH2+]C1 ZINC000335493632 386614518 /nfs/dbraw/zinc/61/45/18/386614518.db2.gz BLIKMVGSHNTIKB-CHWSQXEVSA-N 2 0 222.376 2.441 20 0 BEADRP C[C@@H](C[NH2+][C@H](CN)C1CC1)c1ccc(F)cc1 ZINC000414807474 386617268 /nfs/dbraw/zinc/61/72/68/386617268.db2.gz OCGFIJJNBZSFDH-IINYFYTJSA-N 2 0 236.334 2.256 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CC[NH2+][C@H](C)C1)c1ccccn1 ZINC000415107424 386617777 /nfs/dbraw/zinc/61/77/77/386617777.db2.gz NYVMSLGNBBZDAF-UPJWGTAASA-N 2 0 233.359 2.120 20 0 BEADRP c1cc(CNCC[NH2+]C2CCCCCC2)ccn1 ZINC000414807389 386618020 /nfs/dbraw/zinc/61/80/20/386618020.db2.gz OAUNVZUXTSOTOW-UHFFFAOYSA-N 2 0 247.386 2.484 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000414819731 386662285 /nfs/dbraw/zinc/66/22/85/386662285.db2.gz IETCONFINBWLCD-IVZWLZJFSA-N 2 0 238.297 2.434 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)C1CCC1)[C@H]1CCC[NH2+]C1 ZINC000414818687 386667218 /nfs/dbraw/zinc/66/72/18/386667218.db2.gz FSVRVCVXZUMXTC-LOWVWBTDSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1)C1CCC1 ZINC000414818685 386667989 /nfs/dbraw/zinc/66/79/89/386667989.db2.gz FSVRVCVXZUMXTC-GMXVVIOVSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH3+])CC[NH2+]C1CCC(C(F)(F)F)CC1 ZINC000414821185 386677267 /nfs/dbraw/zinc/67/72/67/386677267.db2.gz KYKLJTWDOUIGHP-IDKOKCKLSA-N 2 0 238.297 2.434 20 0 BEADRP CN(C)c1ccccc1C[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000414927720 386710459 /nfs/dbraw/zinc/71/04/59/386710459.db2.gz PGOGHSIOPQRAEY-KBPBESRZSA-N 2 0 247.386 2.112 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]C[C@@H](C)c1ccccc1 ZINC000414830784 386710310 /nfs/dbraw/zinc/71/03/10/386710310.db2.gz CKNKZECGQBOBLQ-CHWSQXEVSA-N 2 0 220.360 2.235 20 0 BEADRP C[C@@H](C[NH2+][C@H]1CCC1(C)C)C[NH+]1CCCC1 ZINC000336648490 386686419 /nfs/dbraw/zinc/68/64/19/386686419.db2.gz GEHLQYZNHRLLBE-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP C(=C\c1ccccc1)\C[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000414825506 386691059 /nfs/dbraw/zinc/69/10/59/386691059.db2.gz CJPMFIXXHPKSQQ-QZDDGCDVSA-N 2 0 230.355 2.289 20 0 BEADRP CC(C)[C@@H]1CCC[C@@H]1[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000414825548 386691128 /nfs/dbraw/zinc/69/11/28/386691128.db2.gz COKPPFNMJYYVLR-IHRRRGAJSA-N 2 0 224.392 2.400 20 0 BEADRP C[NH2+]CCC[N@H+](C)C[C@H]1CCCC[C@H]1C ZINC000394834705 386693066 /nfs/dbraw/zinc/69/30/66/386693066.db2.gz QDKDOBKEPNTEEC-CHWSQXEVSA-N 2 0 212.381 2.354 20 0 BEADRP C[C@@H]1CCC[C@H](C[NH2+]CC[C@H]2CC[NH2+]C2)C1 ZINC000414827589 386693643 /nfs/dbraw/zinc/69/36/43/386693643.db2.gz HJPQBBDRQOITIM-MCIONIFRSA-N 2 0 224.392 2.402 20 0 BEADRP COC[C@H](CC(C)C)[NH2+][C@@H](C)[C@H]1CCC[NH2+]C1 ZINC000414826201 386694005 /nfs/dbraw/zinc/69/40/05/386694005.db2.gz VDYFEDVHYVIHMY-IHRRRGAJSA-N 2 0 242.407 2.025 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]CC[C@H]2CC[NH2+]C2)[C@H]1C ZINC000414827514 386695030 /nfs/dbraw/zinc/69/50/30/386695030.db2.gz HDXQXKYXDSLMEA-RQJABVFESA-N 2 0 224.392 2.400 20 0 BEADRP COC(C)(C)CC[N@H+](C)CCC[NH+]1CCCC1 ZINC000337285476 386700507 /nfs/dbraw/zinc/70/05/07/386700507.db2.gz ZXXRLDLPCQJIOO-UHFFFAOYSA-N 2 0 242.407 2.219 20 0 BEADRP Fc1ccc(/C=C/C[NH2+]CC[C@H]2CC[NH2+]C2)cc1 ZINC000414828949 386701882 /nfs/dbraw/zinc/70/18/82/386701882.db2.gz JYUDVCCPKQKLAK-YUKKFKLSSA-N 2 0 248.345 2.428 20 0 BEADRP [NH3+]CCOCC[N@@H+]1CCC[C@@H]1C1CCCCC1 ZINC000357067284 386708127 /nfs/dbraw/zinc/70/81/27/386708127.db2.gz DMKMMOKKEOCKLW-CQSZACIVSA-N 2 0 240.391 2.006 20 0 BEADRP COC[C@@H](CC(C)C)[NH2+][C@@H](CN)CC(C)C ZINC000414836708 386730337 /nfs/dbraw/zinc/73/03/37/386730337.db2.gz IXIFYKWKYDTXIB-CHWSQXEVSA-N 2 0 230.396 2.011 20 0 BEADRP CC(C)([NH3+])C[N@@H+]1CC[C@H](c2ccccc2)C1 ZINC000050600912 386730973 /nfs/dbraw/zinc/73/09/73/386730973.db2.gz YYYJWMYIBUUOED-ZDUSSCGKSA-N 2 0 218.344 2.213 20 0 BEADRP CC(C)([NH3+])C[N@@H+]1CC[C@@H](c2ccccc2)C1 ZINC000050600914 386731028 /nfs/dbraw/zinc/73/10/28/386731028.db2.gz YYYJWMYIBUUOED-CYBMUJFWSA-N 2 0 218.344 2.213 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000414838740 386737959 /nfs/dbraw/zinc/73/79/59/386737959.db2.gz XGOJVADCHMWIPU-YIPFDTCYSA-N 2 0 222.376 2.438 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000414838721 386739527 /nfs/dbraw/zinc/73/95/27/386739527.db2.gz XGKANYORDRISDH-ZJUUUORDSA-N 2 0 238.297 2.307 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H](C)C1CCCCC1 ZINC000414840544 386739787 /nfs/dbraw/zinc/73/97/87/386739787.db2.gz MLJPTCMGYKXLKN-NEPJUHHUSA-N 2 0 212.381 2.400 20 0 BEADRP C(C[C@@H]1CC[NH2+]C1)[NH2+][C@H]1CCC[C@H]1C1CC1 ZINC000414833752 386712652 /nfs/dbraw/zinc/71/26/52/386712652.db2.gz QAXOQTVIMOEPTI-UBHSHLNASA-N 2 0 222.376 2.154 20 0 BEADRP C[C@@H](CCC(F)(F)F)[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000414838715 386739941 /nfs/dbraw/zinc/73/99/41/386739941.db2.gz XGKANYORDRISDH-UWVGGRQHSA-N 2 0 238.297 2.307 20 0 BEADRP C[C@H]1CCC[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000414832525 386716006 /nfs/dbraw/zinc/71/60/06/386716006.db2.gz QRKPHNDDIQDLBD-CSHRUCKSSA-N 2 0 222.376 2.438 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H]1CCC[C@H]1C1CC1 ZINC000414832177 386716076 /nfs/dbraw/zinc/71/60/76/386716076.db2.gz FAFCOMXZRHJONC-DRZSPHRISA-N 2 0 210.365 2.010 20 0 BEADRP C[C@]1(C[NH2+][C@H]2CCC23CCC3)CCC[NH2+]C1 ZINC000335486508 386716280 /nfs/dbraw/zinc/71/62/80/386716280.db2.gz HEMROZIZAVYCEE-STQMWFEESA-N 2 0 222.376 2.298 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H]1CCC[C@@H](C2CC2)C1 ZINC000414835811 386727262 /nfs/dbraw/zinc/72/72/62/386727262.db2.gz IPFZYKJKWBYZAF-YUTCNCBUSA-N 2 0 224.392 2.400 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]Cc1cc(C)cc(C)c1 ZINC000414835262 386728295 /nfs/dbraw/zinc/72/82/95/386728295.db2.gz IFRPXAWYYAEONI-ZDUSSCGKSA-N 2 0 220.360 2.249 20 0 BEADRP CCC(CC)C[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000414839580 386746977 /nfs/dbraw/zinc/74/69/77/386746977.db2.gz XVSGORUQJNRDTL-FUNVUKJBSA-N 2 0 210.365 2.295 20 0 BEADRP CCCC[C@H](CC)[NH2+]C[C@H](C)C[NH2+]C ZINC000414840837 386751400 /nfs/dbraw/zinc/75/14/00/386751400.db2.gz NPPCPPDOCSEUPT-NEPJUHHUSA-N 2 0 200.370 2.400 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000414841258 386754935 /nfs/dbraw/zinc/75/49/35/386754935.db2.gz ZBUQDSDYOROJFI-UCEQBCCISA-N 2 0 208.349 2.048 20 0 BEADRP C[C@@H]1CCC[C@H]1[NH2+]C[C@@H](N)c1ccccc1 ZINC000414839310 386741206 /nfs/dbraw/zinc/74/12/06/386741206.db2.gz VYQOOWUMTRCRPP-MRVWCRGKSA-N 2 0 218.344 2.465 20 0 BEADRP CC1(C)CCC[C@H]1[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000414839381 386743008 /nfs/dbraw/zinc/74/30/08/386743008.db2.gz WGDGBJUUYAKZJJ-VXGBXAGGSA-N 2 0 210.365 2.154 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CC[C@H](C)C[C@@H]1C ZINC000414844876 386771749 /nfs/dbraw/zinc/77/17/49/386771749.db2.gz RQNBWCGJMHTKAA-ZDEQEGDKSA-N 2 0 212.381 2.256 20 0 BEADRP Cc1ccccc1C[N@@H+](C)CC(C)(C)C[NH3+] ZINC000051256377 386777628 /nfs/dbraw/zinc/77/76/28/386777628.db2.gz NMGSAWWRHWVVOP-UHFFFAOYSA-N 2 0 220.360 2.412 20 0 BEADRP C[C@H](Cc1cccs1)[NH2+][C@@H](C)CCC[NH3+] ZINC000336667710 386785306 /nfs/dbraw/zinc/78/53/06/386785306.db2.gz DVLVZVFIKPUURO-WDEREUQCSA-N 2 0 226.389 2.396 20 0 BEADRP C[C@H]1CCC[C@@H](C[N@H+](C)C2CC([NH3+])C2)C1 ZINC000394999402 386797291 /nfs/dbraw/zinc/79/72/91/386797291.db2.gz FPRYAGIQCFMSNG-ZFDZMSFRSA-N 2 0 210.365 2.234 20 0 BEADRP Cc1ccncc1C[N@H+](C)CC1CC[NH+](C)CC1 ZINC000269487113 386798666 /nfs/dbraw/zinc/79/86/66/386798666.db2.gz NCQWTBHPANAZIZ-UHFFFAOYSA-N 2 0 247.386 2.164 20 0 BEADRP CC[C@H](C[NH2+][C@H](C)C[C@@H]1CCCCC[NH2+]1)OC ZINC000336669538 386801129 /nfs/dbraw/zinc/80/11/29/386801129.db2.gz AMPBCPHWPHYODT-HZSPNIEDSA-N 2 0 242.407 2.312 20 0 BEADRP C[N@H+](CCC1CCCCC1)C1CC([NH3+])C1 ZINC000395007246 386802435 /nfs/dbraw/zinc/80/24/35/386802435.db2.gz ICOFOFVHOPXSTL-UHFFFAOYSA-N 2 0 210.365 2.378 20 0 BEADRP CC[N@H+](C[C@H]1CCC[NH2+]C1)C1CC(C)(C)C1 ZINC000395300360 386808558 /nfs/dbraw/zinc/80/85/58/386808558.db2.gz QNRUKUPNSIHYPF-LBPRGKRZSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)Oc1cccc(C[N@H+](C)C2CC([NH3+])C2)c1 ZINC000395030293 386810299 /nfs/dbraw/zinc/81/02/99/386810299.db2.gz QBNRDFNOMAULMP-UHFFFAOYSA-N 2 0 248.370 2.395 20 0 BEADRP CC[C@@H]([NH2+]C1CC[NH2+]CC1)c1ccccc1 ZINC000051627188 386835593 /nfs/dbraw/zinc/83/55/93/386835593.db2.gz PPBHFODBIZQQTB-CQSZACIVSA-N 2 0 218.344 2.479 20 0 BEADRP CCCC[N@H+](C)C[C@H](C)Nc1cc[nH+]cc1C ZINC000341134859 386845122 /nfs/dbraw/zinc/84/51/22/386845122.db2.gz GMIYANINDSGYQB-ZDUSSCGKSA-N 2 0 235.375 2.344 20 0 BEADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@H]2CCCc3occc32)C1 ZINC000331398495 386849427 /nfs/dbraw/zinc/84/94/27/386849427.db2.gz RXVMKPARQXBXLV-MDZLAQPJSA-N 2 0 234.343 2.374 20 0 BEADRP CC[C@H]1CC[C@H]1[NH2+]CCC1CC[NH+](C)CC1 ZINC000336744451 386857379 /nfs/dbraw/zinc/85/73/79/386857379.db2.gz UYVCLFXUGCCYCG-UONOGXRCSA-N 2 0 224.392 2.497 20 0 BEADRP [NH3+]C1(C[NH2+][C@H]2CCCOCC2)CCCCCC1 ZINC000334837405 386878240 /nfs/dbraw/zinc/87/82/40/386878240.db2.gz LRJFKWWNTPXEOA-ZDUSSCGKSA-N 2 0 240.391 2.197 20 0 BEADRP CC1([NH2+]CC2CCCCC2)CC[NH2+]CC1 ZINC000334840933 386884760 /nfs/dbraw/zinc/88/47/60/386884760.db2.gz DEACOURRQAAHJA-UHFFFAOYSA-N 2 0 210.365 2.298 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]Cc2cc(F)cc(F)c2)C1 ZINC000334843049 386891024 /nfs/dbraw/zinc/89/10/24/386891024.db2.gz AGJKGSJYHOUOHY-CHWSQXEVSA-N 2 0 240.297 2.324 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H]2CC[N@@H+](C)C[C@H]2C)cc1 ZINC000358158248 386903680 /nfs/dbraw/zinc/90/36/80/386903680.db2.gz NKOPDLWPCXJRTE-GDBMZVCRSA-N 2 0 246.398 2.467 20 0 BEADRP Cc1cc(C[NH2+][C@@H]2CC[NH2+]C[C@H]2C)c(C)s1 ZINC000334856176 386908373 /nfs/dbraw/zinc/90/83/73/386908373.db2.gz GVHYMJHAPQSVPL-NOZJJQNGSA-N 2 0 238.400 2.453 20 0 BEADRP Cc1cccc(C)c1C[NH2+][C@H]1CC[NH2+]C[C@@H]1C ZINC000334857825 386910126 /nfs/dbraw/zinc/91/01/26/386910126.db2.gz OTFKQCBYWONIJO-ZFWWWQNUSA-N 2 0 232.371 2.391 20 0 BEADRP Cc1cc(C)cc(C[NH2+][C@H]2CC[NH2+]C[C@H]2C)c1 ZINC000334858374 386911775 /nfs/dbraw/zinc/91/17/75/386911775.db2.gz SDBFCFCLHZKOOS-HIFRSBDPSA-N 2 0 232.371 2.391 20 0 BEADRP Fc1cccc2c1CC[C@@H]2[NH2+]C1CC[NH2+]CC1 ZINC000334865381 386921673 /nfs/dbraw/zinc/92/16/73/386921673.db2.gz UBPPFUGKNNLSNF-AWEZNQCLSA-N 2 0 234.318 2.155 20 0 BEADRP C[C@H](O)CC(C)(C)C[NH2+][C@@H]1CCCCC[C@H]1[NH3+] ZINC000331969926 386933282 /nfs/dbraw/zinc/93/32/82/386933282.db2.gz LEQGSNVSKSGETK-YNEHKIRRSA-N 2 0 242.407 2.033 20 0 BEADRP C[C@@H]([NH2+]C1Cc2ccccc2C1)[C@H]1CCC[NH2+]C1 ZINC000334873243 386934553 /nfs/dbraw/zinc/93/45/53/386934553.db2.gz FNXXCZBJKYFDNK-DOMZBBRYSA-N 2 0 244.382 2.132 20 0 BEADRP C[C@H]([NH2+]C1Cc2ccccc2C1)[C@H]1CCC[NH2+]C1 ZINC000334873250 386934606 /nfs/dbraw/zinc/93/46/06/386934606.db2.gz FNXXCZBJKYFDNK-WFASDCNBSA-N 2 0 244.382 2.132 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+]CC1([NH3+])CCCCC1 ZINC000334816899 386943805 /nfs/dbraw/zinc/94/38/05/386943805.db2.gz CZIATLSZKGAXGS-NEPJUHHUSA-N 2 0 210.365 2.426 20 0 BEADRP CC[C@@H](Cc1ccccc1)[NH2+]CCCC[NH3+] ZINC000116385738 386944526 /nfs/dbraw/zinc/94/45/26/386944526.db2.gz VPRAHMRJCNYUAA-AWEZNQCLSA-N 2 0 220.360 2.336 20 0 BEADRP CSC1(C[NH2+]C[C@H](C)C[NH+]2CCCC2)CC1 ZINC000304255637 386966450 /nfs/dbraw/zinc/96/64/50/386966450.db2.gz IDFDIELMWYERJK-LBPRGKRZSA-N 2 0 242.432 2.204 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC2(C)CC[NH2+]CC2)[C@H]1C ZINC000395157275 386948507 /nfs/dbraw/zinc/94/85/07/386948507.db2.gz LNXPRNGOFLWPRB-WOPDTQHZSA-N 2 0 210.365 2.010 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@H]([C@@H](C)[NH3+])C2)cc1 ZINC000107934675 387038548 /nfs/dbraw/zinc/03/85/48/387038548.db2.gz ZPZHCIHRZUVCFQ-OCCSQVGLSA-N 2 0 218.344 2.164 20 0 BEADRP CCOc1ccccc1C[N@@H+]1CC[C@@H]([C@@H](C)[NH3+])C1 ZINC000126903567 387072720 /nfs/dbraw/zinc/07/27/20/387072720.db2.gz LSZQQGXAFGYWEW-CHWSQXEVSA-N 2 0 248.370 2.254 20 0 BEADRP C[C@]1(c2ccccc2)CC[C@@H]([NH2+]CC2C[NH2+]C2)C1 ZINC000423299470 387130412 /nfs/dbraw/zinc/13/04/12/387130412.db2.gz BUOJRRNMNQMJIW-CVEARBPZSA-N 2 0 244.382 2.306 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H]1CCC[C@@H]1CCCF ZINC000423298521 387130472 /nfs/dbraw/zinc/13/04/72/387130472.db2.gz AJUMHPXKAGJQEG-IJLUTSLNSA-N 2 0 216.344 2.089 20 0 BEADRP CCC[C@H](C)[C@@H](CC)[NH2+]C[C@@H](C)C[NH3+] ZINC000423299156 387130670 /nfs/dbraw/zinc/13/06/70/387130670.db2.gz PLIHWRKUJQIUIS-SDDRHHMPSA-N 2 0 200.370 2.386 20 0 BEADRP Cc1csc([C@@H](C)[NH2+]CC2CC[NH2+]CC2)n1 ZINC000070733614 387089671 /nfs/dbraw/zinc/08/96/71/387089671.db2.gz CKLNWABHQUTOQI-SNVBAGLBSA-N 2 0 239.388 2.102 20 0 BEADRP CCc1cccc(C[N@@H+]2CC[C@H]([NH3+])[C@@H](C)C2)c1 ZINC000334997516 387091165 /nfs/dbraw/zinc/09/11/65/387091165.db2.gz DHWYBVVNHABFIP-WFASDCNBSA-N 2 0 232.371 2.418 20 0 BEADRP Cc1csc([C@H](C)[NH2+]CC2CC[NH2+]CC2)n1 ZINC000070733615 387091448 /nfs/dbraw/zinc/09/14/48/387091448.db2.gz CKLNWABHQUTOQI-JTQLQIEISA-N 2 0 239.388 2.102 20 0 BEADRP C[N@H+](Cc1cccc(F)c1)[C@H]1CCC[NH2+]CC1 ZINC000111824528 387092159 /nfs/dbraw/zinc/09/21/59/387092159.db2.gz KPBPQPUYVNFRFZ-AWEZNQCLSA-N 2 0 236.334 2.400 20 0 BEADRP Cc1ccc(C[N@H+]2CCC[C@H]([C@H](C)[NH3+])C2)c(C)n1 ZINC000334998958 387092221 /nfs/dbraw/zinc/09/22/21/387092221.db2.gz XFYXEXVXOMYSJJ-JSGCOSHPSA-N 2 0 247.386 2.258 20 0 BEADRP Cc1ccc(C[NH2+]CCC[NH2+]C2CC2)cc1F ZINC000228408363 387093661 /nfs/dbraw/zinc/09/36/61/387093661.db2.gz IZMCMZSVXLZXDD-UHFFFAOYSA-N 2 0 236.334 2.366 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]CC1=CCCCC1 ZINC000335004790 387098563 /nfs/dbraw/zinc/09/85/63/387098563.db2.gz GAXYEUKHVRWNLV-OCCSQVGLSA-N 2 0 222.376 2.465 20 0 BEADRP CC(C)C1CC([NH2+][C@H]2CC[NH2+]C[C@H]2C)C1 ZINC000335004462 387098752 /nfs/dbraw/zinc/09/87/52/387098752.db2.gz DCMGDUZAEWCTFX-XVSSEFHLSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@@H]1CCNC[C@@H]1[NH2+]C1CCC2(CC2)CC1 ZINC000335006195 387101353 /nfs/dbraw/zinc/10/13/53/387101353.db2.gz BUSLEZPFNVRCLW-YPMHNXCESA-N 2 0 222.376 2.297 20 0 BEADRP CC[C@H]1CC[C@@H]1[NH2+]CC1CC[NH+](C)CC1 ZINC000336766197 387101567 /nfs/dbraw/zinc/10/15/67/387101567.db2.gz RKOSTJQRYWNFKZ-STQMWFEESA-N 2 0 210.365 2.106 20 0 BEADRP C[NH+](C)C1CCC([NH2+]CC(C)(C)C)CC1 ZINC000336766577 387115083 /nfs/dbraw/zinc/11/50/83/387115083.db2.gz RSRDECMVRVXCBV-UHFFFAOYSA-N 2 0 212.381 2.495 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]Cc1ccccc1 ZINC000335025406 387116708 /nfs/dbraw/zinc/11/67/08/387116708.db2.gz RMDSFCOGNNJQEO-ZIAGYGMSSA-N 2 0 218.344 2.436 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]Cc1ccccc1 ZINC000335025404 387116771 /nfs/dbraw/zinc/11/67/71/387116771.db2.gz RMDSFCOGNNJQEO-KGLIPLIRSA-N 2 0 218.344 2.436 20 0 BEADRP Cc1cccc(C[NH2+][C@H]2CC[NH2+]CC[C@H]2C)c1 ZINC000335025419 387116849 /nfs/dbraw/zinc/11/68/49/387116849.db2.gz RREWFJMJOPTARB-HIFRSBDPSA-N 2 0 232.371 2.473 20 0 BEADRP C[NH+](C)CCCC(C)(C)[NH2+]CC[C@H]1CCOC1 ZINC000400575038 387132063 /nfs/dbraw/zinc/13/20/63/387132063.db2.gz DZZBQSGOCAPTGS-ZDUSSCGKSA-N 2 0 242.407 2.123 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]C1CCC(F)(F)CC1 ZINC000335028647 387122670 /nfs/dbraw/zinc/12/26/70/387122670.db2.gz XTVUNFJAGIUUKQ-GXSJLCMTSA-N 2 0 232.318 2.281 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]C1CCC(F)(F)CC1 ZINC000335028650 387122691 /nfs/dbraw/zinc/12/26/91/387122691.db2.gz XTVUNFJAGIUUKQ-ONGXEEELSA-N 2 0 232.318 2.281 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H](C)[C@@H]2C[C@H]2C)CC1 ZINC000321351243 387126501 /nfs/dbraw/zinc/12/65/01/387126501.db2.gz CRYYMFZBLZMCFG-YRGRVCCFSA-N 2 0 224.392 2.495 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H](C)[C@@H]2C[C@@H]2C)CC1 ZINC000321351241 387126909 /nfs/dbraw/zinc/12/69/09/387126909.db2.gz CRYYMFZBLZMCFG-OUCADQQQSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H]1c2cc(F)ccc2C[C@@H]1C ZINC000423298619 387128800 /nfs/dbraw/zinc/12/88/00/387128800.db2.gz OUZDOYHPIWWCAR-ISTVAULSSA-N 2 0 236.334 2.243 20 0 BEADRP COc1cc([C@@H](C)[NH2+]C[C@@H](C)C[NH3+])ccc1F ZINC000423299532 387129072 /nfs/dbraw/zinc/12/90/72/387129072.db2.gz BSZNIXNVUFCDDS-VHSXEESVSA-N 2 0 240.322 2.080 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H]1C[C@@H](C)c2ccccc21 ZINC000423299616 387129246 /nfs/dbraw/zinc/12/92/46/387129246.db2.gz CCRWVTQJACDXOC-GYSYKLTISA-N 2 0 218.344 2.419 20 0 BEADRP CC[C@H](Cc1ccc(C)cc1)[NH2+]CC1C[NH2+]C1 ZINC000423299031 387129359 /nfs/dbraw/zinc/12/93/59/387129359.db2.gz ASMAIHDLBMZNIB-OAHLLOKOSA-N 2 0 232.371 2.125 20 0 BEADRP Cc1cccc2c1CC[C@H]2[NH2+]C[C@H](C)C[NH3+] ZINC000423298575 387129527 /nfs/dbraw/zinc/12/95/27/387129527.db2.gz OOPXJBIGCBAAFW-QMTHXVAHSA-N 2 0 218.344 2.167 20 0 BEADRP Cc1ccc([C@H]2CCC[C@H]2[NH2+]CC2C[NH2+]C2)cc1 ZINC000423298760 387130021 /nfs/dbraw/zinc/13/00/21/387130021.db2.gz AFYDAFMHLXTROT-HZPDHXFCSA-N 2 0 244.382 2.440 20 0 BEADRP CCCC[C@H](C)[C@H](C)[NH2+]C[C@H](C)C[NH3+] ZINC000423299833 387130108 /nfs/dbraw/zinc/13/01/08/387130108.db2.gz CEAXQGRRBNURJR-WOPDTQHZSA-N 2 0 200.370 2.386 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H](C)[C@@H]1CCCC[C@H]1C ZINC000423305666 387141538 /nfs/dbraw/zinc/14/15/38/387141538.db2.gz KYLQNMFTFUPVMA-FDYHWXHSSA-N 2 0 212.381 2.386 20 0 BEADRP Cc1ccc(C)c([C@H](C)[NH2+]CC2C[NH2+]C2)c1 ZINC000423306701 387141724 /nfs/dbraw/zinc/14/17/24/387141724.db2.gz UFPXCMBQAZSUQP-LBPRGKRZSA-N 2 0 218.344 2.173 20 0 BEADRP Fc1ccc2c(c1)CCC[C@H]2[NH2+]CC1C[NH2+]C1 ZINC000423306157 387141812 /nfs/dbraw/zinc/14/18/12/387141812.db2.gz SFHYDQUPMHUPNH-CQSZACIVSA-N 2 0 234.318 2.012 20 0 BEADRP C[C@H]([NH2+]CC1C[NH2+]C1)c1cc2c(s1)CCC2 ZINC000423305583 387142258 /nfs/dbraw/zinc/14/22/58/387142258.db2.gz RFODCEOQNADQSV-VIFPVBQESA-N 2 0 236.384 2.107 20 0 BEADRP C[C@@H](C[C@H]1CCCCC[NH2+]1)[NH2+]CCCCCO ZINC000229110389 387143029 /nfs/dbraw/zinc/14/30/29/387143029.db2.gz ZUOSHXWHIDEXOJ-UONOGXRCSA-N 2 0 242.407 2.049 20 0 BEADRP Cc1cc(C)cc([C@@H](C)[NH2+]CC2C[NH2+]C2)c1 ZINC000423307333 387144256 /nfs/dbraw/zinc/14/42/56/387144256.db2.gz VRPZVEDNFQJJJK-GFCCVEGCSA-N 2 0 218.344 2.173 20 0 BEADRP CC(C)(C)C1CCC([NH2+]CC2C[NH2+]C2)CC1 ZINC000423309504 387145808 /nfs/dbraw/zinc/14/58/08/387145808.db2.gz ZYARRNPCQQIKGO-UHFFFAOYSA-N 2 0 224.392 2.400 20 0 BEADRP CCC[NH2+]CC[NH2+][C@@H]1CC[C@@H]1C(C)(C)C ZINC000423309029 387146351 /nfs/dbraw/zinc/14/63/51/387146351.db2.gz KUGCHSQSZAXCCI-NWDGAFQWSA-N 2 0 212.381 2.400 20 0 BEADRP Cc1cn2c(n1)[C@@H](C[NH2+]Cc1cc[nH]c1)CCC2 ZINC000371133222 387149719 /nfs/dbraw/zinc/14/97/19/387149719.db2.gz JAROZMNYZORVDF-CYBMUJFWSA-N 2 0 244.342 2.187 20 0 BEADRP CC(C)C[C@H]1CCC[C@H]([NH2+]CC2C[NH2+]C2)C1 ZINC000423313897 387151279 /nfs/dbraw/zinc/15/12/79/387151279.db2.gz GHLACLWUPNUTDW-OCCSQVGLSA-N 2 0 224.392 2.400 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H]([NH3+])C1CC1)C1CCCC1 ZINC000423313106 387151904 /nfs/dbraw/zinc/15/19/04/387151904.db2.gz FAVIYHFAUZMHEK-CHWSQXEVSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)[C@H]1CCC[C@@H]([NH2+]C[C@H](C)C[NH3+])C1 ZINC000423312957 387152015 /nfs/dbraw/zinc/15/20/15/387152015.db2.gz VVKCYCSMMMYRQB-FRRDWIJNSA-N 2 0 212.381 2.386 20 0 BEADRP [NH3+][C@@H](C[NH2+][C@@H]1CCCC12CCC2)C1CC1 ZINC000423313891 387152128 /nfs/dbraw/zinc/15/21/28/387152128.db2.gz GGVGFOWCXAXBKZ-NWDGAFQWSA-N 2 0 208.349 2.036 20 0 BEADRP [NH3+][C@@H](C[NH2+][C@@H](Cc1ccccc1)C1CC1)C1CC1 ZINC000423315186 387153072 /nfs/dbraw/zinc/15/30/72/387153072.db2.gz IQPRHBCZNWNTJI-HOTGVXAUSA-N 2 0 244.382 2.335 20 0 BEADRP [NH3+][C@H](C[NH2+]C1C2CC3CC(C2)CC1C3)C1CC1 ZINC000423315172 387154188 /nfs/dbraw/zinc/15/41/88/387154188.db2.gz IPZUPRDGKFEZCR-DFOWJFBESA-N 2 0 234.387 2.138 20 0 BEADRP C[C@@H]1Cc2ccccc2[C@@H]1[NH2+]C[C@H]([NH3+])C1CC1 ZINC000423314847 387155203 /nfs/dbraw/zinc/15/52/03/387155203.db2.gz HXZDLNSSXCOXSR-WKPIXPDZSA-N 2 0 230.355 2.247 20 0 BEADRP [NH3+][C@@H](C[NH2+][C@H](c1ccccc1)C1CC1)C1CC1 ZINC000423315576 387156616 /nfs/dbraw/zinc/15/66/16/387156616.db2.gz IZROADLRKUHREH-LSDHHAIUSA-N 2 0 230.355 2.465 20 0 BEADRP [NH3+][C@H](C[NH2+][C@H](c1ccccc1)C1CC1)C1CC1 ZINC000423315574 387157710 /nfs/dbraw/zinc/15/77/10/387157710.db2.gz IZROADLRKUHREH-HUUCEWRRSA-N 2 0 230.355 2.465 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+]CC1(C)CC[NH2+]CC1 ZINC000423318607 387158484 /nfs/dbraw/zinc/15/84/84/387158484.db2.gz CPJPZTGTDRUIRA-ZDUSSCGKSA-N 2 0 247.386 2.430 20 0 BEADRP C[C@H]1Cc2ccccc2[C@@H]1[NH2+]CCCC[NH3+] ZINC000423319093 387158904 /nfs/dbraw/zinc/15/89/04/387158904.db2.gz CFJKVCXTQSVTQZ-SMDDNHRTSA-N 2 0 218.344 2.248 20 0 BEADRP CC[C@@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)C1CC1 ZINC000423318158 387159272 /nfs/dbraw/zinc/15/92/72/387159272.db2.gz CFDVBFRFQDUEMN-CHWSQXEVSA-N 2 0 210.365 2.154 20 0 BEADRP Cc1cc([C@H](C)[NH2+]CC2(C)CC[NH2+]CC2)no1 ZINC000423319139 387159666 /nfs/dbraw/zinc/15/96/66/387159666.db2.gz CYKFRICNBGVCNW-NSHDSACASA-N 2 0 237.347 2.023 20 0 BEADRP C[C@H]([NH2+]CC1(C)CC[NH2+]CC1)c1cccc(O)c1 ZINC000423323509 387165597 /nfs/dbraw/zinc/16/55/97/387165597.db2.gz HYFVQQAAVMGTHI-LBPRGKRZSA-N 2 0 248.370 2.433 20 0 BEADRP COc1cccc([C@H](C)[NH2+]CC2=CC[NH2+]CC2)c1 ZINC000423343585 387193362 /nfs/dbraw/zinc/19/33/62/387193362.db2.gz MAMDNXIHISJUBB-LBPRGKRZSA-N 2 0 246.354 2.266 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]CC2=CC[NH2+]CC2)[C@H]1C ZINC000423328768 387172139 /nfs/dbraw/zinc/17/21/39/387172139.db2.gz ATULSJZAWNQGNY-DYEKYZERSA-N 2 0 222.376 2.320 20 0 BEADRP C[C@H](CCCc1cccnc1)[NH2+]CC1([NH3+])CCC1 ZINC000423331034 387176165 /nfs/dbraw/zinc/17/61/65/387176165.db2.gz OCKUQBUVENMZEW-CYBMUJFWSA-N 2 0 247.386 2.264 20 0 BEADRP CCC[C@@H]([NH2+]CC1C[NH2+]C1)C1CCCC1 ZINC000423331665 387176427 /nfs/dbraw/zinc/17/64/27/387176427.db2.gz USYUAMDBUPIKRO-CYBMUJFWSA-N 2 0 210.365 2.154 20 0 BEADRP [NH3+]C1(C[NH2+][C@H]2CC[C@H]2C2CCC2)CCC1 ZINC000423332715 387177884 /nfs/dbraw/zinc/17/78/84/387177884.db2.gz QWQXXOWPJHDRLK-RYUDHWBXSA-N 2 0 208.349 2.036 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H]2CC[C@@H]2C2CCC2)CCC1 ZINC000423332716 387178375 /nfs/dbraw/zinc/17/83/75/387178375.db2.gz QWQXXOWPJHDRLK-VXGBXAGGSA-N 2 0 208.349 2.036 20 0 BEADRP [NH3+]C1(C[NH2+]C(C2CCC2)C2CCC2)CCC1 ZINC000423334373 387181159 /nfs/dbraw/zinc/18/11/59/387181159.db2.gz SWNAHCUIOYGVCI-UHFFFAOYSA-N 2 0 222.376 2.426 20 0 BEADRP Cc1cc([C@@H](C)[NH2+]CCCC[NH3+])oc1C ZINC000423336808 387183172 /nfs/dbraw/zinc/18/31/72/387183172.db2.gz VDXVODKKSULABE-SNVBAGLBSA-N 2 0 210.321 2.286 20 0 BEADRP CC(C)=CCC[C@H](C)[NH2+]C[C@H]([NH3+])C1CC1 ZINC000423339965 387188021 /nfs/dbraw/zinc/18/80/21/387188021.db2.gz ZZZLGQDADCQVHG-AAEUAGOBSA-N 2 0 210.365 2.448 20 0 BEADRP CC[C@@H]1CC[C@@H](C)C[C@@H]1[NH2+]CC1C[NH2+]C1 ZINC000423339204 387188461 /nfs/dbraw/zinc/18/84/61/387188461.db2.gz ZIZDSPBOUYEDGA-RTXFEEFZSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]([NH2+]CC1=CC[NH2+]CC1)C1CCSCC1 ZINC000423341702 387190461 /nfs/dbraw/zinc/19/04/61/387190461.db2.gz KERUJMSSCDHMKA-LLVKDONJSA-N 2 0 240.416 2.027 20 0 BEADRP CC[C@@H]1CCCC[C@@H]1[NH2+]CC1([NH3+])CCC1 ZINC000423340509 387190784 /nfs/dbraw/zinc/19/07/84/387190784.db2.gz XGQYTCGTLSNRGD-NEPJUHHUSA-N 2 0 210.365 2.426 20 0 BEADRP CC[C@@H]1CCC[C@H]([NH2+]CC2=CC[NH2+]CC2)C1 ZINC000423340331 387191110 /nfs/dbraw/zinc/19/11/10/387191110.db2.gz JJXJVMVNJNHWMJ-OCCSQVGLSA-N 2 0 222.376 2.465 20 0 BEADRP Clc1ccc2c(c1)[C@H]([NH2+]CC1C[NH2+]C1)CC2 ZINC000423302758 387134237 /nfs/dbraw/zinc/13/42/37/387134237.db2.gz KHSFHOGDIGMXCD-CYBMUJFWSA-N 2 0 236.746 2.136 20 0 BEADRP COc1cccc(C2CC[NH+](CCC[NH3+])CC2)c1 ZINC000057537240 387136402 /nfs/dbraw/zinc/13/64/02/387136402.db2.gz RLKKZWJYTVWNBP-UHFFFAOYSA-N 2 0 248.370 2.223 20 0 BEADRP Cc1cccc([C@H](C)[NH2+]CC2C[NH2+]C2)c1C ZINC000423304161 387136359 /nfs/dbraw/zinc/13/63/59/387136359.db2.gz NHXKLWGJPFYTEH-LBPRGKRZSA-N 2 0 218.344 2.173 20 0 BEADRP C[C@@H]([NH2+]CC1C[NH2+]C1)c1ccc(Cl)cc1 ZINC000423303696 387136458 /nfs/dbraw/zinc/13/64/58/387136458.db2.gz MNKSTQVUHFQOCB-SECBINFHSA-N 2 0 224.735 2.210 20 0 BEADRP CCC1(C)CCC([NH2+]CC2C[NH2+]C2)CC1 ZINC000423304184 387136974 /nfs/dbraw/zinc/13/69/74/387136974.db2.gz NLCAUQZFNRTMDW-UHFFFAOYSA-N 2 0 210.365 2.154 20 0 BEADRP CCC[C@H]([NH2+]CC1C[NH2+]C1)c1ccccc1 ZINC000423304157 387137393 /nfs/dbraw/zinc/13/73/93/387137393.db2.gz NHPPDTJHIKOTIR-AWEZNQCLSA-N 2 0 218.344 2.337 20 0 BEADRP [NH3+][C@H](C[NH2+][C@H]1CCCc2ccccc21)C1CC1 ZINC000423325033 387139211 /nfs/dbraw/zinc/13/92/11/387139211.db2.gz PTHKNWUFQSOXAO-CABCVRRESA-N 2 0 230.355 2.391 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H](C)C1C(C)(C)C1(C)C ZINC000423304788 387139697 /nfs/dbraw/zinc/13/96/97/387139697.db2.gz ZLWXVNYICVFHOO-NXEZZACHSA-N 2 0 212.381 2.242 20 0 BEADRP C[C@H]([NH2+]CC1C[NH2+]C1)C12CC3CC(CC(C3)C1)C2 ZINC000423304670 387140468 /nfs/dbraw/zinc/14/04/68/387140468.db2.gz OQQHDWVPSATIFT-IKMFHRHGSA-N 2 0 248.414 2.400 20 0 BEADRP CC(C)(C)[C@@H]1CC[C@@H]1[NH2+]CC1=CC[NH2+]CC1 ZINC000423351469 387203250 /nfs/dbraw/zinc/20/32/50/387203250.db2.gz IDFNMEYROICPPP-OLZOCXBDSA-N 2 0 222.376 2.320 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CC2CCC2)CC1(C)C ZINC000623378733 387206349 /nfs/dbraw/zinc/20/63/49/387206349.db2.gz NSYSTULCZPBYRU-LBPRGKRZSA-N 2 0 210.365 2.249 20 0 BEADRP FCC[C@@H]1CCC[C@H]1[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000423359020 387209681 /nfs/dbraw/zinc/20/96/81/387209681.db2.gz OPJTXJUGVCGZGO-YNEHKIRRSA-N 2 0 228.355 2.246 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[NH2+]C[C@H]1C)C1CCSCC1 ZINC000423365081 387216059 /nfs/dbraw/zinc/21/60/59/387216059.db2.gz CVEVEBBQKUUCRF-MDZLAQPJSA-N 2 0 242.432 2.106 20 0 BEADRP Cc1cncc([C@H](C)[NH2+][C@H]2CC[NH2+]C[C@@H]2C)c1 ZINC000423363219 387216740 /nfs/dbraw/zinc/21/67/40/387216740.db2.gz BOJGTQKOUJTPJJ-OBJOEFQTSA-N 2 0 233.359 2.039 20 0 BEADRP [NH3+][C@@H]1CC[C@@H]2C[N@H+](CCCc3ccccc3)C[C@H]12 ZINC000336796095 387225143 /nfs/dbraw/zinc/22/51/43/387225143.db2.gz PKKFEZHLSSWPSW-OWCLPIDISA-N 2 0 244.382 2.288 20 0 BEADRP [NH3+][C@@H]1CC[C@@H]2C[N@H+](CCCc3ccccc3)C[C@@H]12 ZINC000336796093 387225340 /nfs/dbraw/zinc/22/53/40/387225340.db2.gz PKKFEZHLSSWPSW-BZUAXINKSA-N 2 0 244.382 2.288 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[NH2+][C@H](C)C1)C1CCCC1 ZINC000423372285 387226585 /nfs/dbraw/zinc/22/65/85/387226585.db2.gz IFNUUSONVZECMX-MDZLAQPJSA-N 2 0 210.365 2.295 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+]C1[C@H](C)CCC[C@H]1C ZINC000423373514 387226995 /nfs/dbraw/zinc/22/69/95/387226995.db2.gz HBSMDUZADGBYGU-IJLUTSLNSA-N 2 0 212.381 2.399 20 0 BEADRP CC[C@H]([NH2+]CC1CC[NH2+]CC1)c1ccncc1 ZINC000643497131 387228279 /nfs/dbraw/zinc/22/82/79/387228279.db2.gz AISICYKHYIFJPT-AWEZNQCLSA-N 2 0 233.359 2.122 20 0 BEADRP CC[C@@H]([NH2+]CC1CC[NH2+]CC1)c1ccncc1 ZINC000643497132 387228745 /nfs/dbraw/zinc/22/87/45/387228745.db2.gz AISICYKHYIFJPT-CQSZACIVSA-N 2 0 233.359 2.122 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@@H]1CC[C@H]1C(C)(C)C ZINC000423401425 387238435 /nfs/dbraw/zinc/23/84/35/387238435.db2.gz QWJJZTKNHPDGRI-FVCCEPFGSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]Cc1cccc2c1CCCN2 ZINC000423416945 387248581 /nfs/dbraw/zinc/24/85/81/387248581.db2.gz RRCNFFUGEGUFMZ-LBPRGKRZSA-N 2 0 247.386 2.262 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)c1ccccn1 ZINC000423421850 387250684 /nfs/dbraw/zinc/25/06/84/387250684.db2.gz BCUCNOLXTRBTTM-OSAQELSMSA-N 2 0 245.370 2.120 20 0 BEADRP CC(C)[C@H]1CC[C@@H](C)C[C@H]1[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000423424231 387250924 /nfs/dbraw/zinc/25/09/24/387250924.db2.gz FMXPJADMIIBWNY-LACSLYJWSA-N 2 0 236.403 2.255 20 0 BEADRP CC[C@H]([NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21)c1ccc(C)cc1 ZINC000423421539 387251156 /nfs/dbraw/zinc/25/11/56/387251156.db2.gz CKUGNPNFWRHBIH-LJISPDSOSA-N 2 0 230.355 2.254 20 0 BEADRP Cc1cc([C@H](C)[NH2+]CC2=CC[NH2+]CC2)c(C)o1 ZINC000423347560 387196321 /nfs/dbraw/zinc/19/63/21/387196321.db2.gz QPARKOHKQPLTHY-NSHDSACASA-N 2 0 234.343 2.467 20 0 BEADRP Cc1cc([C@H](C)[NH2+]C[C@@H]2CCC[C@@H]([NH3+])C2)no1 ZINC000423463424 387310750 /nfs/dbraw/zinc/31/07/50/387310750.db2.gz FYJSUAZZTHOCMI-QJPTWQEYSA-N 2 0 237.347 2.151 20 0 BEADRP Cc1ccnc([C@H](C)[NH2+][C@@H](C)CCC[NH3+])c1 ZINC000423465540 387312740 /nfs/dbraw/zinc/31/27/40/387312740.db2.gz WOLHCBWZBGMWDJ-RYUDHWBXSA-N 2 0 221.348 2.168 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H]1CCCc2ccc(O)cc21 ZINC000423467354 387315516 /nfs/dbraw/zinc/31/55/16/387315516.db2.gz XKYUOYFBTASLFB-ABAIWWIYSA-N 2 0 248.370 2.487 20 0 BEADRP CCCC[NH+]1CCC([NH2+][C@H]2CCO[C@@H]2C)CC1 ZINC000120658924 387261886 /nfs/dbraw/zinc/26/18/86/387261886.db2.gz KKTSYRFGLFLFPN-OCCSQVGLSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@@H]([NH2+][C@@H](C1CC1)C1CCCC1)[C@H](C)[NH3+] ZINC000423469484 387317511 /nfs/dbraw/zinc/31/75/11/387317511.db2.gz PBAYPRYJMXSLOT-OPQQBVKSSA-N 2 0 210.365 2.281 20 0 BEADRP Cc1ncc([C@H](C)[NH2+]CC2CC[NH2+]CC2)s1 ZINC000643497691 387270898 /nfs/dbraw/zinc/27/08/98/387270898.db2.gz UEHCWLWAIKBFHO-VIFPVBQESA-N 2 0 239.388 2.102 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@@H]1CC[C@@H]1C1CCC1 ZINC000423389494 387274721 /nfs/dbraw/zinc/27/47/21/387274721.db2.gz NNNOYCCHXCYISV-RAIGVLPGSA-N 2 0 210.365 2.153 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@@H]1C[C@H](C)CC[C@@H]1C ZINC000423391064 387276839 /nfs/dbraw/zinc/27/68/39/387276839.db2.gz PDFVNZQBNQGNOD-YVECIDJPSA-N 2 0 212.381 2.399 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)C1CCC1 ZINC000423392096 387279730 /nfs/dbraw/zinc/27/97/30/387279730.db2.gz XLCQTPIPMGMLPB-RTXFEEFZSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2C[C@H]2C2CC[NH2+]CC2)[C@H]1C ZINC000423430794 387280975 /nfs/dbraw/zinc/28/09/75/387280975.db2.gz IKUPJMIRTWTJGT-JPKGWIMLSA-N 2 0 222.376 2.009 20 0 BEADRP C[C@H](C[NH2+][C@H](C)[C@H]1C[C@@H]1C)C[NH+]1CCCC1 ZINC000321594239 387282590 /nfs/dbraw/zinc/28/25/90/387282590.db2.gz PODKFRNQQCYMGN-RQJABVFESA-N 2 0 224.392 2.352 20 0 BEADRP CC[C@H](C)[C@@H](C)[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000423432770 387284891 /nfs/dbraw/zinc/28/48/91/387284891.db2.gz JHRVCHJRTBCBJZ-UZGDPCLZSA-N 2 0 224.392 2.399 20 0 BEADRP CC[NH+]1CCC(C[NH2+]Cc2ccoc2C)CC1 ZINC000320970413 387318101 /nfs/dbraw/zinc/31/81/01/387318101.db2.gz GEKBDMWNNMNVPZ-UHFFFAOYSA-N 2 0 236.359 2.410 20 0 BEADRP C1[C@@H]([NH2+][C@@H]2CCC23CCC3)[C@@H]1C1CC[NH2+]CC1 ZINC000423434319 387286274 /nfs/dbraw/zinc/28/62/74/387286274.db2.gz KMPHSJVWPVEDFA-BFHYXJOUSA-N 2 0 234.387 2.297 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@H](C)c1ccc(F)cn1 ZINC000423438356 387288849 /nfs/dbraw/zinc/28/88/49/387288849.db2.gz RIPJGUXWZMHJBJ-GHMZBOCLSA-N 2 0 239.338 2.389 20 0 BEADRP c1ccc2c(c1)CCCC[C@@H]2[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000423441511 387293339 /nfs/dbraw/zinc/29/33/39/387293339.db2.gz UNFGFBOZHMTVLY-XUWVNRHRSA-N 2 0 242.366 2.262 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H]1CCCC12CCC2 ZINC000423446963 387296686 /nfs/dbraw/zinc/29/66/86/387296686.db2.gz CXSUCDKSUQVUBL-VXGBXAGGSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H]1CC[C@@H]1C1CCC1 ZINC000423452368 387299048 /nfs/dbraw/zinc/29/90/48/387299048.db2.gz JPJUZKVGJQUNRJ-RTXFEEFZSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)C(C)(C)C ZINC000423449873 387300470 /nfs/dbraw/zinc/30/04/70/387300470.db2.gz WTDKWRNAKOGEOF-KGYLQXTDSA-N 2 0 224.392 2.399 20 0 BEADRP CC[C@@H](COC)[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000360501649 387301275 /nfs/dbraw/zinc/30/12/75/387301275.db2.gz VZXSIFGDWNECRS-LBPRGKRZSA-N 2 0 240.391 2.018 20 0 BEADRP CC(C)CC[C@H]1CC[C@H]([NH2+][C@@H]2[C@H]3C[NH2+]C[C@H]32)C1 ZINC000423453867 387301743 /nfs/dbraw/zinc/30/17/43/387301743.db2.gz LALHRSUBNQKBOE-BTFPBAQTSA-N 2 0 236.403 2.399 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@@H](C1CC1)C1CCCC1 ZINC000423456604 387303203 /nfs/dbraw/zinc/30/32/03/387303203.db2.gz DSIQSEMJRRCKNN-QWHCGFSZSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]([NH3+])[C@H](C)[NH2+]C1CCC(C(F)F)CC1 ZINC000423455280 387303510 /nfs/dbraw/zinc/30/35/10/387303510.db2.gz CGDYKQJRWDPODX-DKEVHCRPSA-N 2 0 220.307 2.136 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@@H]1CCC[C@@H]1CCCF ZINC000423457002 387304793 /nfs/dbraw/zinc/30/47/93/387304793.db2.gz FDQKMETXZCNSLY-GRYCIOLGSA-N 2 0 216.344 2.232 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+][C@@H]1CCC[C@H]([NH3+])C1)CO2 ZINC000514872996 387306296 /nfs/dbraw/zinc/30/62/96/387306296.db2.gz MBICGTGEQROHBD-OUCADQQQSA-N 2 0 246.354 2.288 20 0 BEADRP CC[C@H]([NH2+][C@@H](C)CCC[NH3+])c1ccc(F)cn1 ZINC000423457761 387306252 /nfs/dbraw/zinc/30/62/52/387306252.db2.gz PMOCTIPCSNEPFL-JQWIXIFHSA-N 2 0 239.338 2.389 20 0 BEADRP CCC[C@H](C)C[N@@H+]1CCC[C@]2(CC[NH2+]C2)C1 ZINC000352539758 387306498 /nfs/dbraw/zinc/30/64/98/387306498.db2.gz CMAJSUOCDKYPOS-UONOGXRCSA-N 2 0 224.392 2.498 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@H](Cc1ccccc1)C1CC1 ZINC000423457463 387306814 /nfs/dbraw/zinc/30/68/14/387306814.db2.gz FTCSWFBXBMPFAX-LSDHHAIUSA-N 2 0 232.371 2.335 20 0 BEADRP C[C@]12C[C@H]1CCC[C@H]2[NH2+]CCC1=CC[NH2+]CC1 ZINC000423535560 387360884 /nfs/dbraw/zinc/36/08/84/387360884.db2.gz DGRUACFBZMXFEM-KFWWJZLASA-N 2 0 234.387 2.465 20 0 BEADRP C1=C(CC[NH2+][C@@H]2CCC[C@@H]2C2CC2)CC[NH2+]C1 ZINC000423535036 387361508 /nfs/dbraw/zinc/36/15/08/387361508.db2.gz BQTAFYNMHXPQAK-HUUCEWRRSA-N 2 0 234.387 2.465 20 0 BEADRP CCCC[C@H](COC)[NH2+]CCC1=CC[NH2+]CC1 ZINC000423534558 387361924 /nfs/dbraw/zinc/36/19/24/387361924.db2.gz ADBGFLWZOIRSFO-CQSZACIVSA-N 2 0 240.391 2.091 20 0 BEADRP C1=C(CC[NH2+][C@@H]2CCC[C@H]2C2CC2)CC[NH2+]C1 ZINC000423535037 387362210 /nfs/dbraw/zinc/36/22/10/387362210.db2.gz BQTAFYNMHXPQAK-LSDHHAIUSA-N 2 0 234.387 2.465 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@@H]1C[C@@H](OCC(C)C)C1(C)C ZINC000423481619 387362712 /nfs/dbraw/zinc/36/27/12/387362712.db2.gz XAEABDCCFHBTPM-YNEHKIRRSA-N 2 0 242.407 2.153 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)C1(C)CC1 ZINC000423538514 387363293 /nfs/dbraw/zinc/36/32/93/387363293.db2.gz GNMMLCMXVCIXHV-UMSGYPCISA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H](C[NH3+])NCc1cccc2ccccc21 ZINC000162061463 387364450 /nfs/dbraw/zinc/36/44/50/387364450.db2.gz FSHWVTSLBVCGTE-LLVKDONJSA-N 2 0 214.312 2.277 20 0 BEADRP C1CC1[C@@H]1CC[C@@H]1[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000423538686 387364677 /nfs/dbraw/zinc/36/46/77/387364677.db2.gz GVRGPIJYNYZQHM-SEBNEYGDSA-N 2 0 234.387 2.153 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]C[C@H]1Cc2ccccc21 ZINC000643453601 387370075 /nfs/dbraw/zinc/37/00/75/387370075.db2.gz KLFCZWAZRPEQKU-XPKDYRNWSA-N 2 0 244.382 2.304 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1Cc2ccccc21)[C@H]1CCCC[NH2+]1 ZINC000643453504 387370433 /nfs/dbraw/zinc/37/04/33/387370433.db2.gz IQMQTKVHEMHWBL-XNRPHZJLSA-N 2 0 244.382 2.447 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1Cc2ccccc21)[C@@H]1CCC[NH2+]1 ZINC000643453652 387370728 /nfs/dbraw/zinc/37/07/28/387370728.db2.gz PEOKZEDOZXISFR-ZLDLUXBVSA-N 2 0 230.355 2.056 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1Cc2ccccc21)[C@@H]1CCC[NH2+]1 ZINC000643453638 387370965 /nfs/dbraw/zinc/37/09/65/387370965.db2.gz OKZXJFFVFJRGEE-BPUTZDHNSA-N 2 0 244.382 2.447 20 0 BEADRP CC[C@H]([NH2+]C[C@H]1Cc2ccccc21)[C@@H]1CCC[NH2+]1 ZINC000643453640 387371083 /nfs/dbraw/zinc/37/10/83/387371083.db2.gz OKZXJFFVFJRGEE-KBMXLJTQSA-N 2 0 244.382 2.447 20 0 BEADRP CC[C@@H]([NH2+]C[C@H]1Cc2ccccc21)[C@@H]1CCC[NH2+]1 ZINC000643453637 387371226 /nfs/dbraw/zinc/37/12/26/387371226.db2.gz OKZXJFFVFJRGEE-BMFZPTHFSA-N 2 0 244.382 2.447 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]C[C@@H]1Cc2ccccc21 ZINC000643453648 387371416 /nfs/dbraw/zinc/37/14/16/387371416.db2.gz OVLJGZUXLVNJDY-LOWVWBTDSA-N 2 0 218.344 2.042 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1Cc2ccccc21)[C@H]1CCC[NH2+]1 ZINC000643453650 387371692 /nfs/dbraw/zinc/37/16/92/387371692.db2.gz PEOKZEDOZXISFR-OSAQELSMSA-N 2 0 230.355 2.056 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)[C@H]1C[C@H]1C ZINC000423550500 387372771 /nfs/dbraw/zinc/37/27/71/387372771.db2.gz NXXXLQWKHOHDDO-WZBKEBKWSA-N 2 0 222.376 2.009 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)[C@H]1C[C@@H]1C ZINC000423552851 387373908 /nfs/dbraw/zinc/37/39/08/387373908.db2.gz QDPGHELYHDLFPL-DEPYFDJDSA-N 2 0 236.403 2.399 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000423555055 387374719 /nfs/dbraw/zinc/37/47/19/387374719.db2.gz XRJOYBLCGVIYSY-HTOAHKCRSA-N 2 0 222.376 2.153 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCCC[NH2+]C1)[C@H]1C[C@H]1C ZINC000423557696 387375521 /nfs/dbraw/zinc/37/55/21/387375521.db2.gz NNWLFXHMKXNBQH-NDBYEHHHSA-N 2 0 210.365 2.153 20 0 BEADRP CCCC[C@@H](C)[NH2+]CCC1=CC[NH2+]CC1 ZINC000423563854 387377083 /nfs/dbraw/zinc/37/70/83/387377083.db2.gz ROFJROUHTBGXSK-GFCCVEGCSA-N 2 0 210.365 2.465 20 0 BEADRP C[C@H]1CCCC[C@H]1[NH2+]CCC1=CC[NH2+]CC1 ZINC000423567165 387378169 /nfs/dbraw/zinc/37/81/69/387378169.db2.gz UXEDHUSUYNIONL-GXTWGEPZSA-N 2 0 222.376 2.465 20 0 BEADRP CCO[C@@H]1C[C@H]([NH2+]C[C@H]([NH3+])CC)C1(CC)CC ZINC000423477814 387324251 /nfs/dbraw/zinc/32/42/51/387324251.db2.gz UEKGISGVKANQGH-FRRDWIJNSA-N 2 0 242.407 2.297 20 0 BEADRP C[C@@H]([NH3+])CN1CCC[C@H]1c1ccc(F)cc1 ZINC000336501072 387327513 /nfs/dbraw/zinc/32/75/13/387327513.db2.gz OJAOFZHUAVLAHZ-MFKMUULPSA-N 2 0 222.307 2.310 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[C@@H]([NH3+])C1)c1ccccn1 ZINC000423484149 387329159 /nfs/dbraw/zinc/32/91/59/387329159.db2.gz ZVKCRPKZIJDPMU-RWMBFGLXSA-N 2 0 233.359 2.250 20 0 BEADRP C[C@H]([NH3+])[C@H](C)[NH2+][C@H]1CCC[C@@H](c2cccnc2)C1 ZINC000423482982 387330105 /nfs/dbraw/zinc/33/01/05/387330105.db2.gz XQHVKEZHOUXRLD-XPCVCDNBSA-N 2 0 247.386 2.433 20 0 BEADRP CCO[C@@H]1C[C@@H]([NH2+]C[C@H]([NH3+])CC)C12CCCC2 ZINC000423485994 387331909 /nfs/dbraw/zinc/33/19/09/387331909.db2.gz ZIJBLYSXNPDVBZ-JHJVBQTASA-N 2 0 240.391 2.051 20 0 BEADRP COc1ccc([C@H](C)[NH2+][C@@H]2CC[C@@H](C[NH3+])C2)cc1 ZINC000423485680 387331976 /nfs/dbraw/zinc/33/19/76/387331976.db2.gz BCPAZBSMWHBQTO-OUCADQQQSA-N 2 0 248.370 2.473 20 0 BEADRP C[C@@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1cncs1 ZINC000423489038 387333221 /nfs/dbraw/zinc/33/32/21/387333221.db2.gz VTBGBZGUUKUFDM-MNOVXSKESA-N 2 0 239.388 2.326 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+][C@@H](C)CCc1ccco1 ZINC000515053155 387334455 /nfs/dbraw/zinc/33/44/55/387334455.db2.gz DHRHAHUQLPCVDO-AAEUAGOBSA-N 2 0 224.348 2.174 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])C1)c1ccco1 ZINC000423488895 387334529 /nfs/dbraw/zinc/33/45/29/387334529.db2.gz FJLDNGZDHUBVFO-DCAQKATOSA-N 2 0 208.305 2.058 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[C@H](C[NH3+])C1)[C@@H]1C[C@H]1C ZINC000423493495 387338578 /nfs/dbraw/zinc/33/85/78/387338578.db2.gz BPOHDTJLDFAVBF-MLGHIDQZSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]C2(C3CC3)CC2)CN1C1CC1 ZINC000309805229 387343653 /nfs/dbraw/zinc/34/36/53/387343653.db2.gz RZQZBFHRVDTBAH-CMPLNLGQSA-N 2 0 220.360 2.144 20 0 BEADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@H]2CCC23CCCC3)C1 ZINC000423506804 387345855 /nfs/dbraw/zinc/34/58/55/387345855.db2.gz MIKWYZKWAKKRBG-UPJWGTAASA-N 2 0 222.376 2.426 20 0 BEADRP Cc1ccc2c(c1)[C@@H]([NH2+][C@H](C)C1C[NH2+]C1)CC2 ZINC000643468988 387424771 /nfs/dbraw/zinc/42/47/71/387424771.db2.gz WRQRVNYTXPVSDP-ABAIWWIYSA-N 2 0 230.355 2.180 20 0 BEADRP CC(C)Oc1ccc(C[NH2+]C2CC[NH2+]CC2)cc1 ZINC000084574673 387455153 /nfs/dbraw/zinc/45/51/53/387455153.db2.gz VYORYDJEQRCMKU-UHFFFAOYSA-N 2 0 248.370 2.315 20 0 BEADRP c1ccc2c(c1)CCC[C@H]([NH2+]C[C@H]1CCC[NH2+]1)C2 ZINC000643505772 387456068 /nfs/dbraw/zinc/45/60/68/387456068.db2.gz JFOMSRHVJDHADJ-JKSUJKDBSA-N 2 0 244.382 2.276 20 0 BEADRP CC(C)C[C@@H]([NH3+])C[NH2+]C(C)(C)C(C)C ZINC000515516793 387385327 /nfs/dbraw/zinc/38/53/27/387385327.db2.gz MABYSSMIOKUMOK-LLVKDONJSA-N 2 0 200.370 2.384 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@@H](C2CC2)C2CCC2)CC1 ZINC000324685874 387503819 /nfs/dbraw/zinc/50/38/19/387503819.db2.gz SNBWJGHVYKTJRD-OAHLLOKOSA-N 2 0 236.403 2.497 20 0 BEADRP Cc1ncc([C@@H](C)[NH2+]CC[C@@H]2CC[NH2+]C2)s1 ZINC000643509310 387504187 /nfs/dbraw/zinc/50/41/87/387504187.db2.gz XTKAZJPAICFORS-KOLCDFICSA-N 2 0 239.388 2.102 20 0 BEADRP CC(C)OC1CCC([NH2+][C@@H]2CCC[C@@H]2[NH3+])CC1 ZINC000643475920 387513434 /nfs/dbraw/zinc/51/34/34/387513434.db2.gz XMQVEDDQNQALEH-CLRIEMFWSA-N 2 0 240.391 2.192 20 0 BEADRP c1ccc2c(CN3CCC[NH2+]CC3)ccnc2c1 ZINC000104386602 387515081 /nfs/dbraw/zinc/51/50/81/387515081.db2.gz ATUGCURPFFSDFZ-UHFFFAOYSA-N 2 0 241.338 2.030 20 0 BEADRP CCN(CC)[C@H](C)C[NH2+][C@H](C)[C@@H]1CCCOC1 ZINC000355295866 387516823 /nfs/dbraw/zinc/51/68/23/387516823.db2.gz SFJNGIMXPOVDQQ-MGPQQGTHSA-N 2 0 242.407 2.121 20 0 BEADRP CCCC[NH+]1CCC([NH+]2CCCC2)CC1 ZINC000361683517 387520652 /nfs/dbraw/zinc/52/06/52/387520652.db2.gz WPOQFSRTUKNHII-UHFFFAOYSA-N 2 0 210.365 2.347 20 0 BEADRP CC1(C)C[C@H]1[NH2+]Cc1cc(C2CC[NH2+]CC2)no1 ZINC000425898320 387534997 /nfs/dbraw/zinc/53/49/97/387534997.db2.gz YZIKWPFPFJQAIL-CYBMUJFWSA-N 2 0 249.358 2.030 20 0 BEADRP CN(CC[C@H]1CCCC[N@@H+]1C)CC1(F)CC1 ZINC000527220173 387535275 /nfs/dbraw/zinc/53/52/75/387535275.db2.gz FUNFWDXEJJUQEY-GFCCVEGCSA-N 2 0 228.355 2.295 20 0 BEADRP C[C@H](C[NH2+]C[C@@H]1CC=CCC1)N(C)C1CC1 ZINC000122195941 387489900 /nfs/dbraw/zinc/48/99/00/387489900.db2.gz QKCLWWLTCVUZEY-CHWSQXEVSA-N 2 0 222.376 2.415 20 0 BEADRP C[C@H](C[NH2+][C@H]1CSC[C@@H]1C)C[NH+]1CCCC1 ZINC000304500475 387491012 /nfs/dbraw/zinc/49/10/12/387491012.db2.gz NFHKQLWMICYMIO-AGIUHOORSA-N 2 0 242.432 2.059 20 0 BEADRP CC(C)C[C@H]([NH3+])C[N@@H+]1CCSC[C@H](C)C1 ZINC000379553235 387586308 /nfs/dbraw/zinc/58/63/08/387586308.db2.gz VUEYIAAWISJDKH-NEPJUHHUSA-N 2 0 230.421 2.045 20 0 BEADRP CC(C)CCOCC[N@H+](C)CC[C@H]([NH3+])C(C)C ZINC000123714333 387592078 /nfs/dbraw/zinc/59/20/78/387592078.db2.gz PMBRDIZWIGOCPB-AWEZNQCLSA-N 2 0 244.423 2.354 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+][C@@H](C)Cc1cccs1 ZINC000643511614 387593613 /nfs/dbraw/zinc/59/36/13/387593613.db2.gz LEVINDVWEQCGQJ-JQWIXIFHSA-N 2 0 226.389 2.252 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+][C@H]1CCCc2cccnc21 ZINC000643512459 387596398 /nfs/dbraw/zinc/59/63/98/387596398.db2.gz LMXSPVZPTHISJL-MJBXVCDLSA-N 2 0 245.370 2.176 20 0 BEADRP Cc1ccc(C[NH2+][C@H](C)C2C[NH2+]C2)c(C)c1 ZINC000422692688 387612488 /nfs/dbraw/zinc/61/24/88/387612488.db2.gz KSKCKMUWMHTFKO-GFCCVEGCSA-N 2 0 218.344 2.001 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H](C)C2C[NH2+]C2)c(C)c1 ZINC000422698944 387616110 /nfs/dbraw/zinc/61/61/10/387616110.db2.gz BWLPBLKOBWIPEZ-ZDUSSCGKSA-N 2 0 232.371 2.043 20 0 BEADRP CCc1nc([C@@H](C)[NH2+][C@H](C)CCC[NH3+])cs1 ZINC000422703037 387617620 /nfs/dbraw/zinc/61/76/20/387617620.db2.gz GSBKQKXFMKYOJF-NXEZZACHSA-N 2 0 241.404 2.484 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]C[C@H](O)C1CCCCC1 ZINC000422708195 387622592 /nfs/dbraw/zinc/62/25/92/387622592.db2.gz XKJXNMREQJBAAE-JSGCOSHPSA-N 2 0 242.407 2.035 20 0 BEADRP CC[C@@H](Cc1cccs1)[NH2+]C[C@H]([NH3+])C1CC1 ZINC000643516415 387622784 /nfs/dbraw/zinc/62/27/84/387622784.db2.gz RNBGFFNRNHXVOY-AAEUAGOBSA-N 2 0 238.400 2.396 20 0 BEADRP C[C@H]([NH3+])[C@@H](Cc1ccccc1)[NH2+]CC1CCC1 ZINC000422713615 387626697 /nfs/dbraw/zinc/62/66/97/387626697.db2.gz KDJNFCKWHJNZBP-SWLSCSKDSA-N 2 0 232.371 2.335 20 0 BEADRP C[C@@H]([NH3+])[C@H](Cc1ccccc1)[NH2+]CC1CCC1 ZINC000422713607 387626734 /nfs/dbraw/zinc/62/67/34/387626734.db2.gz KDJNFCKWHJNZBP-DOMZBBRYSA-N 2 0 232.371 2.335 20 0 BEADRP C[C@H]([NH2+]C1CCC(C[NH3+])CC1)C1CCC1 ZINC000643476310 387548039 /nfs/dbraw/zinc/54/80/39/387548039.db2.gz DTRRWJOQQISLOG-ZBOXLXRLSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)C[C@H](C)[NH+]1CCC([NH+](C)C)CC1 ZINC000355757829 387577397 /nfs/dbraw/zinc/57/73/97/387577397.db2.gz KOPKEYRHZUYTIB-LBPRGKRZSA-N 2 0 212.381 2.447 20 0 BEADRP C[NH2+]C[C@H]1CCC[N@H+](CCc2ccc(C)cc2)C1 ZINC000430605606 387632467 /nfs/dbraw/zinc/63/24/67/387632467.db2.gz STFGTPOTJXOQON-MRXNPFEDSA-N 2 0 246.398 2.469 20 0 BEADRP CC(C)CCC[C@H](C)[NH2+][C@H](C)C1C[NH2+]C1 ZINC000422728319 387638662 /nfs/dbraw/zinc/63/86/62/387638662.db2.gz JBKUIRDBPRBAFK-NWDGAFQWSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CCc1ccc(F)cc1 ZINC000422735454 387643004 /nfs/dbraw/zinc/64/30/04/387643004.db2.gz UVMPOXMCBDQTGX-GHMZBOCLSA-N 2 0 224.323 2.084 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H](C)C[C@@H](C)[NH3+] ZINC000422736011 387643035 /nfs/dbraw/zinc/64/30/35/387643035.db2.gz VMLJCKQWDAKJLG-HZSPNIEDSA-N 3 0 243.439 2.212 20 0 BEADRP C[C@H](Cc1ccccc1F)[NH2+][C@H](C)C[C@H](C)[NH3+] ZINC000422739693 387645349 /nfs/dbraw/zinc/64/53/49/387645349.db2.gz LZHXNHACBVJSQH-QJPTWQEYSA-N 2 0 238.350 2.472 20 0 BEADRP C[C@@H]([NH2+]C[C@@H](C)c1ccc(F)cc1)C1C[NH2+]C1 ZINC000422745699 387647557 /nfs/dbraw/zinc/64/75/57/387647557.db2.gz VMTWEMUZNAIOBG-GHMZBOCLSA-N 2 0 236.334 2.127 20 0 BEADRP C[C@@H](C[NH2+][C@H](C)C1C[NH2+]C1)c1ccc(F)cc1 ZINC000422745702 387649003 /nfs/dbraw/zinc/64/90/03/387649003.db2.gz VMTWEMUZNAIOBG-WDEREUQCSA-N 2 0 236.334 2.127 20 0 BEADRP [NH3+]C1(C[NH2+][C@H]2CCCc3ccccc3C2)CCC1 ZINC000643518015 387649045 /nfs/dbraw/zinc/64/90/45/387649045.db2.gz RRJPADSMZSBNPU-HNNXBMFYSA-N 2 0 244.382 2.405 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccnc(C)c2)C1 ZINC000527643837 387652188 /nfs/dbraw/zinc/65/21/88/387652188.db2.gz CZPGKYDOSBFMDS-HNNXBMFYSA-N 2 0 247.386 2.212 20 0 BEADRP [NH3+][C@H]1CCCCC[C@@H]1[NH2+]CCc1ccccc1 ZINC000422748877 387653504 /nfs/dbraw/zinc/65/35/04/387653504.db2.gz WOEOOLOKOBTHLC-GJZGRUSLSA-N 2 0 232.371 2.479 20 0 BEADRP C[C@@H]([NH2+]Cc1ccc(Cl)cc1)C1C[NH2+]C1 ZINC000422748972 387653929 /nfs/dbraw/zinc/65/39/29/387653929.db2.gz WXPDTKWKWFKWQF-SECBINFHSA-N 2 0 224.735 2.038 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])N[C@@H](CC[NH+](C)C)C(C)(C)C ZINC000422756223 387658563 /nfs/dbraw/zinc/65/85/63/387658563.db2.gz HLFAORZFNLTDBU-XQQFMLRXSA-N 2 0 243.439 2.068 20 0 BEADRP CS[C@@H]1CCC[C@H]([NH2+][C@@H](C)C[C@H](C)[NH3+])C1 ZINC000422754783 387659370 /nfs/dbraw/zinc/65/93/70/387659370.db2.gz GENZUGMIJVDXRP-FIQHERPVSA-N 2 0 230.421 2.376 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]CCCNc1ccccc1 ZINC000422758301 387660996 /nfs/dbraw/zinc/66/09/96/387660996.db2.gz NTUWHNNAOOTXKS-ZFWWWQNUSA-N 2 0 247.386 2.206 20 0 BEADRP C[C@H]([NH2+][C@H]1C[C@H](C)C[C@H](C)C1)C1C[NH2+]C1 ZINC000422756982 387661766 /nfs/dbraw/zinc/66/17/66/387661766.db2.gz CTASOMUVLPXCHF-SRRSOLGSSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]CCCNc1ccccc1 ZINC000422761184 387663686 /nfs/dbraw/zinc/66/36/86/387663686.db2.gz QVPLZQUOQUPPKU-ZDUSSCGKSA-N 2 0 235.375 2.206 20 0 BEADRP CCc1ccc(CC[N@@H+]2CC[C@@H]([NH3+])[C@H](C)C2)cc1 ZINC000430953865 387663999 /nfs/dbraw/zinc/66/39/99/387663999.db2.gz DBSYYHOIQGLIPA-CZUORRHYSA-N 2 0 246.398 2.461 20 0 BEADRP [NH3+][C@H]1CCCCC[C@@H]1[NH2+]CCOc1ccccc1 ZINC000422764602 387665719 /nfs/dbraw/zinc/66/57/19/387665719.db2.gz VGXTZCZVNYEQLX-GJZGRUSLSA-N 2 0 248.370 2.315 20 0 BEADRP CC[C@@H](COC)[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C ZINC000125997106 387670207 /nfs/dbraw/zinc/67/02/07/387670207.db2.gz KYNWBZZUHHIEKF-STQMWFEESA-N 2 0 244.423 2.367 20 0 BEADRP CC[C@H](COC)[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C ZINC000125997348 387670526 /nfs/dbraw/zinc/67/05/26/387670526.db2.gz KYNWBZZUHHIEKF-OLZOCXBDSA-N 2 0 244.423 2.367 20 0 BEADRP COc1cccc(C[NH2+][C@H]2CC[NH2+]CC[C@@H]2C)c1 ZINC000422774453 387673409 /nfs/dbraw/zinc/67/34/09/387673409.db2.gz XBHIAIISRPOCHZ-WFASDCNBSA-N 2 0 248.370 2.173 20 0 BEADRP CCO[C@@H]1C[C@H]([NH2+][C@@H](C)C[C@@H](C)[NH3+])C12CCC2 ZINC000422777106 387674173 /nfs/dbraw/zinc/67/41/73/387674173.db2.gz FFLGLHAAIDSROU-MROQNXINSA-N 2 0 240.391 2.050 20 0 BEADRP CCC[N@H+](CCCCCOC)C1CC[NH2+]CC1 ZINC000431069030 387674485 /nfs/dbraw/zinc/67/44/85/387674485.db2.gz DWYCEKZQGYIEKB-UHFFFAOYSA-N 2 0 242.407 2.267 20 0 BEADRP CC[C@@H]([NH2+]CCCOCC(C)C)[C@@H]1CCC[NH2+]1 ZINC000422779616 387679386 /nfs/dbraw/zinc/67/93/86/387679386.db2.gz GABFOVDKBFDIFV-KGLIPLIRSA-N 2 0 242.407 2.169 20 0 BEADRP C[N@H+](CCC[NH3+])Cc1ccc(OC(F)F)cc1 ZINC000123344434 387682735 /nfs/dbraw/zinc/68/27/35/387682735.db2.gz LCWMVFKMKZRDOM-UHFFFAOYSA-N 2 0 244.285 2.069 20 0 BEADRP Cc1cc(C)cc(CC[NH2+][C@H]2CCC[C@H]2[NH3+])c1 ZINC000422783813 387684477 /nfs/dbraw/zinc/68/44/77/387684477.db2.gz NGVXXFMBIKPJHT-CABCVRRESA-N 2 0 232.371 2.315 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]CCCOC1CCCCC1 ZINC000422783485 387684646 /nfs/dbraw/zinc/68/46/46/387684646.db2.gz LEBQYWRUUCMMTM-KGLIPLIRSA-N 2 0 240.391 2.195 20 0 BEADRP C[C@@H]([NH2+]CC1CC[NH+](C)CC1)c1ccco1 ZINC000044515657 387685785 /nfs/dbraw/zinc/68/57/85/387685785.db2.gz GBECDCZEHXOACT-LLVKDONJSA-N 2 0 222.332 2.272 20 0 BEADRP CC[C@H]([NH2+]C1CCC([NH3+])CC1)c1ccncc1 ZINC000422785936 387685936 /nfs/dbraw/zinc/68/59/36/387685936.db2.gz PTHDFZHRAHTBKK-RUXDESIVSA-N 2 0 233.359 2.392 20 0 BEADRP C[C@@H]([NH2+]CCc1ccccc1Cl)C1C[NH2+]C1 ZINC000422787244 387686279 /nfs/dbraw/zinc/68/62/79/387686279.db2.gz UGTVPUWOSLQIDB-SNVBAGLBSA-N 2 0 238.762 2.080 20 0 BEADRP C[C@H]([NH2+]CCc1ccccc1Cl)C1C[NH2+]C1 ZINC000422787243 387686468 /nfs/dbraw/zinc/68/64/68/387686468.db2.gz UGTVPUWOSLQIDB-JTQLQIEISA-N 2 0 238.762 2.080 20 0 BEADRP [NH3+]C[C@@H]1CCC[N@H+](CCCOc2ccccc2)C1 ZINC000044530186 387686672 /nfs/dbraw/zinc/68/66/72/387686672.db2.gz GBEXMMYXBDXPIX-AWEZNQCLSA-N 2 0 248.370 2.126 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCC[C@@H]1[NH3+])c1ccc(F)cc1 ZINC000422744193 387689694 /nfs/dbraw/zinc/68/96/94/387689694.db2.gz SOGZBOHENDYSGU-SWHYSGLUSA-N 2 0 236.334 2.399 20 0 BEADRP CO[C@@H](C[NH2+][C@H](C)CCC[NH3+])c1ccccc1 ZINC000422743246 387691018 /nfs/dbraw/zinc/69/10/18/387691018.db2.gz SXYIEMOBILRKJE-OCCSQVGLSA-N 2 0 236.359 2.091 20 0 BEADRP CO[C@H](C[NH2+][C@@H](C)C[C@H](C)[NH3+])c1ccccc1 ZINC000422743327 387691242 /nfs/dbraw/zinc/69/12/42/387691242.db2.gz TYGDYDWCDJZCDO-SGMGOOAPSA-N 2 0 236.359 2.090 20 0 BEADRP C1C[C@@H]([NH2+][C@@H]2CC[C@H]3CCCC[C@@H]3C2)C[NH2+]1 ZINC000422792375 387692966 /nfs/dbraw/zinc/69/29/66/387692966.db2.gz DQEKDOYOTGQRDT-AAVRWANBSA-N 2 0 222.376 2.297 20 0 BEADRP CCc1ccc(C[NH2+][C@@H](C)C2C[NH2+]C2)s1 ZINC000422862940 387744017 /nfs/dbraw/zinc/74/40/17/387744017.db2.gz OFUOKRILKQUEIB-VIFPVBQESA-N 2 0 224.373 2.008 20 0 BEADRP C(C1CCCCC1)[N@@H+]1C[C@@H]2CCC[NH2+][C@@H]2C1 ZINC000128420400 387744555 /nfs/dbraw/zinc/74/45/55/387744555.db2.gz FSANDADYTGBVNK-UONOGXRCSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]C[C@@]1(C)CCCS1 ZINC000422873739 387751567 /nfs/dbraw/zinc/75/15/67/387751567.db2.gz LYNRNHDQBWKHIV-JHJVBQTASA-N 2 0 242.432 2.250 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]C[C@]1(C)CCCS1 ZINC000422873740 387753004 /nfs/dbraw/zinc/75/30/04/387753004.db2.gz LYNRNHDQBWKHIV-UPJWGTAASA-N 2 0 242.432 2.250 20 0 BEADRP COCc1cccc(C[NH2+][C@@H](C)C[C@H](C)[NH3+])c1 ZINC000422879380 387753982 /nfs/dbraw/zinc/75/39/82/387753982.db2.gz KHUITWSUTCHGBV-RYUDHWBXSA-N 2 0 236.359 2.048 20 0 BEADRP C[C@H](C[NH2+][C@H](C)[C@H]1CC12CC2)C[NH+]1CCCC1 ZINC000527852500 387754630 /nfs/dbraw/zinc/75/46/30/387754630.db2.gz RHGMGTVKSALWHE-MGPQQGTHSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H]1CCc2ccccc21 ZINC000422799508 387698715 /nfs/dbraw/zinc/69/87/15/387698715.db2.gz XCEPZKVALARYFS-COPLHBTASA-N 2 0 218.344 2.389 20 0 BEADRP Cc1ccc(C[NH2+][C@@H](C)C[C@H](C)[NH3+])cc1F ZINC000422800193 387699222 /nfs/dbraw/zinc/69/92/22/387699222.db2.gz ZNMKABDWVCFMIT-QWRGUYRKSA-N 2 0 224.323 2.350 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@H]1CCc2ccccc21 ZINC000422799511 387700222 /nfs/dbraw/zinc/70/02/22/387700222.db2.gz XCEPZKVALARYFS-WDMOLILDSA-N 2 0 218.344 2.389 20 0 BEADRP C[C@@H]([NH2+]Cc1cc(F)cc(F)c1)[C@H]1CC[NH2+]C1 ZINC000422803494 387702673 /nfs/dbraw/zinc/70/26/73/387702673.db2.gz IYNQLCLXSSNQEY-KOLCDFICSA-N 2 0 240.297 2.052 20 0 BEADRP CCCC[NH+]1CCC([NH2+][C@H](C)CCOC)CC1 ZINC000045025175 387704435 /nfs/dbraw/zinc/70/44/35/387704435.db2.gz DTOSCGWUTUKHIH-CYBMUJFWSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]Cc1cc(F)cc(F)c1 ZINC000422807473 387704996 /nfs/dbraw/zinc/70/49/96/387704996.db2.gz PAHQJGGDCRNJCF-BDAKNGLRSA-N 2 0 228.286 2.180 20 0 BEADRP C[C@H]([NH2+]C1CCCCC1)[C@@H]1CCCC[NH2+]1 ZINC000238434010 387705456 /nfs/dbraw/zinc/70/54/56/387705456.db2.gz SDFAWIMHEMUDAO-AAEUAGOBSA-N 2 0 210.365 2.439 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+]CC1(c2ccccc2)CC1 ZINC000422808430 387708458 /nfs/dbraw/zinc/70/84/58/387708458.db2.gz LDKNQQHAVSBAAC-UONOGXRCSA-N 2 0 230.355 2.188 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CCc1ccsc1 ZINC000422811267 387709280 /nfs/dbraw/zinc/70/92/80/387709280.db2.gz TZYBHQXODGAJQV-ZJUUUORDSA-N 2 0 212.362 2.006 20 0 BEADRP CCSCC[C@@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000422810375 387709531 /nfs/dbraw/zinc/70/95/31/387709531.db2.gz RRVGLMSSAPTTAF-FKJOKYEKSA-N 2 0 242.432 2.391 20 0 BEADRP COCc1ccccc1C[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000422812661 387710541 /nfs/dbraw/zinc/71/05/41/387710541.db2.gz YDPMDFIMESNQLB-RYUDHWBXSA-N 2 0 236.359 2.048 20 0 BEADRP CCO[C@H](CC[NH2+][C@@H]1CCC[C@H]1C[NH3+])C(C)C ZINC000422811897 387710807 /nfs/dbraw/zinc/71/08/07/387710807.db2.gz PUSGYKYYWDHIEF-BFHYXJOUSA-N 2 0 242.407 2.155 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CC1(c2ccccc2)CC1 ZINC000422813786 387712014 /nfs/dbraw/zinc/71/20/14/387712014.db2.gz SJNODHNSEFVEQE-QWHCGFSZSA-N 2 0 232.371 2.434 20 0 BEADRP C[C@H](c1ccccc1)[C@H](C)[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000422817836 387715317 /nfs/dbraw/zinc/71/53/17/387715317.db2.gz DXRTWTCVZKKCEA-AVGNSLFASA-N 2 0 232.371 2.376 20 0 BEADRP CCS[C@@H]1CCC[C@@H]([NH2+][C@@H](C)C2C[NH2+]C2)C1 ZINC000422820416 387716726 /nfs/dbraw/zinc/71/67/26/387716726.db2.gz QMANJIOBHPQBHS-CYZMBNFOSA-N 2 0 242.432 2.248 20 0 BEADRP CCS[C@@H]1CCCC[C@H]1[NH2+][C@H](C)C1C[NH2+]C1 ZINC000422831271 387723867 /nfs/dbraw/zinc/72/38/67/387723867.db2.gz DHLYJHJWIRAQOC-RAIGVLPGSA-N 2 0 242.432 2.248 20 0 BEADRP Cc1ccc([C@H](C)[NH2+][C@H]2CCC[NH2+]CC2)c(C)n1 ZINC000643522984 387724679 /nfs/dbraw/zinc/72/46/79/387724679.db2.gz VJOXCSDAAAAHBY-KBPBESRZSA-N 2 0 247.386 2.491 20 0 BEADRP C[C@@H]([NH2+]C[C@]1(C)CCCS1)[C@@H]1CCC[NH2+]1 ZINC000422876527 387755694 /nfs/dbraw/zinc/75/56/94/387755694.db2.gz QGUVFBCZRQGKST-WOPDTQHZSA-N 2 0 228.405 2.002 20 0 BEADRP Cc1cccc(O[C@H](C)C[NH2+][C@@H]2CCC[C@H]2[NH3+])c1 ZINC000422790162 387734113 /nfs/dbraw/zinc/73/41/13/387734113.db2.gz PDXRIZOZJGRXPG-BPLDGKMQSA-N 2 0 248.370 2.232 20 0 BEADRP Cc1cc(F)ccc1CC[NH2+][C@H]1CCC[C@@H]1[NH3+] ZINC000422849226 387734979 /nfs/dbraw/zinc/73/49/79/387734979.db2.gz BPUVUJXOHIQSLQ-KBPBESRZSA-N 2 0 236.334 2.146 20 0 BEADRP CC[C@@H]([NH2+][C@H](CCC[NH3+])COC)C(C)(C)C ZINC000422856451 387740130 /nfs/dbraw/zinc/74/01/30/387740130.db2.gz FKBLDRYHJDBIBV-VXGBXAGGSA-N 2 0 230.396 2.155 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]C[C@H](C)N(C)c1ccccc1 ZINC000422856204 387741192 /nfs/dbraw/zinc/74/11/92/387741192.db2.gz FTEYQYVKLZPGSS-MJBXVCDLSA-N 2 0 249.402 2.227 20 0 BEADRP CO[C@@H]1C[C@H]([NH2+][C@H]2CCCCC[C@H]2[NH3+])C1(C)C ZINC000422856061 387742469 /nfs/dbraw/zinc/74/24/69/387742469.db2.gz WMSLSBMXFVJWDQ-MROQNXINSA-N 2 0 240.391 2.050 20 0 BEADRP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)[C@H]1CC12CC2 ZINC000527905330 387761657 /nfs/dbraw/zinc/76/16/57/387761657.db2.gz NJIRALPBUZSAAA-RKFYDKJMSA-N 2 0 234.387 2.390 20 0 BEADRP CC(C)C[C@H](C)C[C@H](C)[NH2+]C[C@@H](C)[NH3+] ZINC000643527124 387762527 /nfs/dbraw/zinc/76/25/27/387762527.db2.gz JYVUJTRHRQSIQS-TUAOUCFPSA-N 2 0 200.370 2.384 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1CCC[C@@H]2OCC[C@@H]21 ZINC000422890117 387763921 /nfs/dbraw/zinc/76/39/21/387763921.db2.gz RFXMTTFTFNJWRM-SYQHCUMBSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H]([NH3+])C[NH2+][C@@H](C)CCc1ccsc1 ZINC000643527937 387764871 /nfs/dbraw/zinc/76/48/71/387764871.db2.gz VULBDYDQUYAISJ-ZJUUUORDSA-N 2 0 212.362 2.006 20 0 BEADRP C[C@H](CCCC(F)(F)F)[NH2+]C[C@H](C)[NH3+] ZINC000643527582 387765270 /nfs/dbraw/zinc/76/52/70/387765270.db2.gz OSWWBWTVZRDGFM-JGVFFNPUSA-N 2 0 212.259 2.044 20 0 BEADRP COc1ccc([C@@H]([NH2+]C[C@@H](C)[NH3+])C(C)C)cc1 ZINC000643528283 387768421 /nfs/dbraw/zinc/76/84/21/387768421.db2.gz GPKZPYPWVMOBEP-RISCZKNCSA-N 2 0 236.359 2.329 20 0 BEADRP C[C@@H]([NH3+])C[NH2+][C@H](C)CCc1cccc(F)c1 ZINC000643528555 387769384 /nfs/dbraw/zinc/76/93/84/387769384.db2.gz LJPLUEOYCJDFLM-GHMZBOCLSA-N 2 0 224.323 2.084 20 0 BEADRP CC[C@@H](Cc1ccc(C)cc1)[NH2+]C[C@H](C)[NH3+] ZINC000643528560 387769507 /nfs/dbraw/zinc/76/95/07/387769507.db2.gz LLLGZSHSIXNOJW-JSGCOSHPSA-N 2 0 220.360 2.253 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]([NH2+]C[C@H](C)[NH3+])C[C@H]1C ZINC000643529175 387772354 /nfs/dbraw/zinc/77/23/54/387772354.db2.gz WMCWQEBZJUULCR-XQHKEYJVSA-N 2 0 212.381 2.384 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]CCc1cc2ccccc2o1 ZINC000422915267 387773057 /nfs/dbraw/zinc/77/30/57/387773057.db2.gz AORKAWMXSKYFAF-ZIAGYGMSSA-N 2 0 244.338 2.445 20 0 BEADRP Cc1cc([C@@H](C)[NH2+][C@@H](C)C2C[NH2+]C2)ccc1F ZINC000422918117 387773955 /nfs/dbraw/zinc/77/39/55/387773955.db2.gz GPWRPNLYWMQRTC-MNOVXSKESA-N 2 0 236.334 2.393 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+][C@H]1C[C@@H]1C1CCCCC1 ZINC000422919661 387775892 /nfs/dbraw/zinc/77/58/92/387775892.db2.gz KTGHUBJLSMKSGY-MQYQWHSLSA-N 2 0 222.376 2.425 20 0 BEADRP [NH3+]CC1CCC([NH2+]CCC(F)(F)F)CC1 ZINC000422923767 387776916 /nfs/dbraw/zinc/77/69/16/387776916.db2.gz XAMSBNJBDSJASO-UHFFFAOYSA-N 2 0 224.270 2.046 20 0 BEADRP CC(C)CC(C)(C)C[NH2+][C@H](C)C1C[NH2+]C1 ZINC000422922590 387778329 /nfs/dbraw/zinc/77/83/29/387778329.db2.gz UCOAVTNUVNUXET-LLVKDONJSA-N 2 0 212.381 2.256 20 0 BEADRP Cc1ccc(CCC[NH2+][C@H](C)C2C[NH2+]C2)c(C)c1 ZINC000643457126 387779084 /nfs/dbraw/zinc/77/90/84/387779084.db2.gz YVCZMUDOIYSEQU-CQSZACIVSA-N 2 0 246.398 2.434 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+][C@H]1C[C@@H]1Cc1ccccc1 ZINC000422926612 387779869 /nfs/dbraw/zinc/77/98/69/387779869.db2.gz XBQPMZCSVZZFBH-VGWMRTNUSA-N 2 0 244.382 2.335 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]C1CC(C)C1 ZINC000422925308 387779990 /nfs/dbraw/zinc/77/99/90/387779990.db2.gz ZYLPZDIALVJPQK-DMLGSKKGSA-N 2 0 233.359 2.298 20 0 BEADRP CC[C@H]([NH2+]CC1(C2CC2)CC1)[C@@H]1CCC[NH2+]1 ZINC000422932429 387781353 /nfs/dbraw/zinc/78/13/53/387781353.db2.gz FSHDLNSLYKVJLR-STQMWFEESA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC2CC=CC2)CC[N@@H+]1C ZINC000527945548 387781526 /nfs/dbraw/zinc/78/15/26/387781526.db2.gz SGIYLIYGBRAERS-DGCLKSJQSA-N 2 0 208.349 2.025 20 0 BEADRP CCOCCC1(C[NH2+][C@H](C)CCC[NH3+])CCC1 ZINC000422938341 387782776 /nfs/dbraw/zinc/78/27/76/387782776.db2.gz KOXCLFCSUPJPJG-CYBMUJFWSA-N 2 0 242.407 2.300 20 0 BEADRP CCC1(CC)[C@H]([NH2+][C@@H]2CCC[C@@H]2[NH3+])C[C@@H]1OC ZINC000422937733 387782836 /nfs/dbraw/zinc/78/28/36/387782836.db2.gz KCKWSUJGTPKFFN-LOWDOPEQSA-N 2 0 240.391 2.050 20 0 BEADRP CC[C@@H]([NH2+][C@H](C)C1C[NH2+]C1)c1cccs1 ZINC000422935792 387782959 /nfs/dbraw/zinc/78/29/59/387782959.db2.gz DRJXLPKKLBUGNK-MWLCHTKSSA-N 2 0 224.373 2.397 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]Cc1nc(C2CC2)cs1 ZINC000422936039 387783070 /nfs/dbraw/zinc/78/30/70/387783070.db2.gz HTHDKLFTHPVPIC-VIFPVBQESA-N 2 0 239.388 2.238 20 0 BEADRP C[C@H]1C[N@H+](CCC[NH2+]CC(C)(C)C)CCCO1 ZINC000432363080 387784265 /nfs/dbraw/zinc/78/42/65/387784265.db2.gz SBCMHUSSKVNNIM-ZDUSSCGKSA-N 2 0 242.407 2.123 20 0 BEADRP Cc1cccc(C)c1CC[NH2+][C@H]1CCC[C@H]1[NH3+] ZINC000422945100 387785601 /nfs/dbraw/zinc/78/56/01/387785601.db2.gz UAKVLSMLBQBKPN-CABCVRRESA-N 2 0 232.371 2.315 20 0 BEADRP CC(C)CC[C@](C)(O)C[NH2+][C@H](C)CCCC[NH3+] ZINC000422979263 387788665 /nfs/dbraw/zinc/78/86/65/387788665.db2.gz MJWWXSSAIGUDGJ-KGLIPLIRSA-N 2 0 244.423 2.281 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCC[C@H]1C[NH3+])Oc1ccccc1 ZINC000422983011 387793697 /nfs/dbraw/zinc/79/36/97/387793697.db2.gz SDELCAPUFCGUMB-IPYPFGDCSA-N 2 0 248.370 2.171 20 0 BEADRP Cc1ccc(CC[NH2+][C@H](C)CCC[NH3+])cc1 ZINC000422982293 387794335 /nfs/dbraw/zinc/79/43/35/387794335.db2.gz QFBBOLWVNMQXJX-CYBMUJFWSA-N 2 0 220.360 2.255 20 0 BEADRP [NH3+]CC1CCC([NH2+]CCc2ccc(O)cc2)CC1 ZINC000422985292 387795469 /nfs/dbraw/zinc/79/54/69/387795469.db2.gz CYWSOCBFODWVBF-UHFFFAOYSA-N 2 0 248.370 2.042 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+][C@H]1CC=CCC1 ZINC000422986707 387796191 /nfs/dbraw/zinc/79/61/91/387796191.db2.gz HENDSFOIGIUVQS-AGIUHOORSA-N 2 0 208.349 2.073 20 0 BEADRP C[C@@H]1C[C@H](C[NH2+][C@@H]2CCCCC[C@H]2[NH3+])CCO1 ZINC000422985565 387796395 /nfs/dbraw/zinc/79/63/95/387796395.db2.gz FIKMFECAKCDVRV-AAVRWANBSA-N 2 0 240.391 2.051 20 0 BEADRP CC[C@@H]([NH2+]CCc1ccc(O)cc1)[C@@H]1CCC[NH2+]1 ZINC000422987969 387797209 /nfs/dbraw/zinc/79/72/09/387797209.db2.gz JOGSIWAEFCFPDA-CABCVRRESA-N 2 0 248.370 2.055 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CCC[C@H]1CCCC[C@H]1O ZINC000422991653 387799936 /nfs/dbraw/zinc/79/99/36/387799936.db2.gz PYPCZMNEYKYUNQ-IGQOVBAYSA-N 2 0 242.407 2.033 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H](C)[C@H]1COc2ccccc21 ZINC000422997763 387803113 /nfs/dbraw/zinc/80/31/13/387803113.db2.gz BVSNBXOSJCIWQY-MBNYWOFBSA-N 2 0 248.370 2.268 20 0 BEADRP c1ccc(CC2(C[NH2+]C3CC[NH2+]CC3)CC2)cc1 ZINC000422998343 387804303 /nfs/dbraw/zinc/80/43/03/387804303.db2.gz PXWKCJXMSHLRGS-UHFFFAOYSA-N 2 0 244.382 2.351 20 0 BEADRP COc1cc(C)cc(C[NH2+][C@H](C)C[C@H](C)[NH3+])c1 ZINC000423001627 387806569 /nfs/dbraw/zinc/80/65/69/387806569.db2.gz IFLVWLNMDFMNES-NWDGAFQWSA-N 2 0 236.359 2.219 20 0 BEADRP CC[C@H]([NH2+]C1CCSCC1)[C@@H]1CCC[NH2+]1 ZINC000422949230 387807201 /nfs/dbraw/zinc/80/72/01/387807201.db2.gz UNLZKMJUAMSVEV-RYUDHWBXSA-N 2 0 228.405 2.002 20 0 BEADRP COc1cccc(C2([NH2+][C@H](C)C[C@@H](C)[NH3+])CC2)c1 ZINC000422951903 387807907 /nfs/dbraw/zinc/80/79/07/387807907.db2.gz ARXFJVKUHOEMOB-VXGBXAGGSA-N 2 0 248.370 2.400 20 0 BEADRP C[C@@H]([NH2+]C1(Cc2ccccc2)CCC1)C1C[NH2+]C1 ZINC000422960211 387810966 /nfs/dbraw/zinc/81/09/66/387810966.db2.gz VRVMVTGPVQISHI-CYBMUJFWSA-N 2 0 244.382 2.349 20 0 BEADRP Cc1ccc2c(c1C)OC[C@H]2[NH2+][C@@H](C)CCC[NH3+] ZINC000422958323 387811070 /nfs/dbraw/zinc/81/10/70/387811070.db2.gz PGRSCUQPZKJGAN-SMDDNHRTSA-N 2 0 248.370 2.454 20 0 BEADRP Cc1ccc2c(c1C)OC[C@@H]2[NH2+][C@@H](C)CCC[NH3+] ZINC000422958321 387811289 /nfs/dbraw/zinc/81/12/89/387811289.db2.gz PGRSCUQPZKJGAN-FZMZJTMJSA-N 2 0 248.370 2.454 20 0 BEADRP CC[C@H](NC[C@@H](C)[NH3+])c1ccccc1F ZINC000643527839 387757788 /nfs/dbraw/zinc/75/77/88/387757788.db2.gz UAHBLUQFLRYAMA-SKDRFNHKSA-N 2 0 210.296 2.214 20 0 BEADRP C[C@H]([NH3+])C[NH2+][C@@H](C)C1CCC(F)(F)CC1 ZINC000643526947 387759167 /nfs/dbraw/zinc/75/91/67/387759167.db2.gz HUMPIUVBZZEBCB-IUCAKERBSA-N 2 0 220.307 2.137 20 0 BEADRP CC(C)[C@H]1CC[C@@H](C)C[C@@H]1[NH2+]C[C@@H](C)[NH3+] ZINC000643526737 387760013 /nfs/dbraw/zinc/76/00/13/387760013.db2.gz FQHJREMIYXVZHA-LPWJVIDDSA-N 2 0 212.381 2.384 20 0 BEADRP Cc1ccc(C[C@@H](C)[NH2+][C@H](C)C2C[NH2+]C2)c(C)c1 ZINC000422886256 387761030 /nfs/dbraw/zinc/76/10/30/387761030.db2.gz INVWIWMMJBINOT-ZIAGYGMSSA-N 2 0 246.398 2.432 20 0 BEADRP CC(C)[C@H]1CC[C@@H](C)C[C@H]1[NH2+]C[C@@H](C)[NH3+] ZINC000643526736 387761413 /nfs/dbraw/zinc/76/14/13/387761413.db2.gz FQHJREMIYXVZHA-FDYHWXHSSA-N 2 0 212.381 2.384 20 0 BEADRP COc1ccccc1[C@H]1CCCN1C[C@@H](C)[NH3+] ZINC000442667195 387819821 /nfs/dbraw/zinc/81/98/21/387819821.db2.gz YOKIRYKCWWZKKJ-DGCLKSJQSA-N 2 0 234.343 2.179 20 0 BEADRP Cc1cnccc1CC[N@@H+](C)C[C@@H]1CCC[C@H]1O ZINC000564081161 387820168 /nfs/dbraw/zinc/82/01/68/387820168.db2.gz ZDVPRGORBQBCTH-LSDHHAIUSA-N 2 0 248.370 2.025 20 0 BEADRP Cc1cncc(C[NH+]2CCC(C[NH+](C)C)CC2)c1 ZINC000442680653 387821121 /nfs/dbraw/zinc/82/11/21/387821121.db2.gz OACQHYKXPFHZHU-UHFFFAOYSA-N 2 0 247.386 2.164 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CC=CCC1)[C@H]1CCCC[NH2+]1 ZINC000422972943 387821403 /nfs/dbraw/zinc/82/14/03/387821403.db2.gz NDNOJVJOBZDDPZ-HZSPNIEDSA-N 2 0 222.376 2.463 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC12CCCC2)[C@H]1CC[NH2+]C1 ZINC000423069745 387872891 /nfs/dbraw/zinc/87/28/91/387872891.db2.gz BSTDSOLTQOUYQX-RWMBFGLXSA-N 2 0 222.376 2.297 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]CCCCc1ccccc1 ZINC000643458311 387822951 /nfs/dbraw/zinc/82/29/51/387822951.db2.gz IUBXJFPFLVZPID-CABCVRRESA-N 2 0 232.371 2.479 20 0 BEADRP CC[C@@H]([NH2+][C@@H](C)CCC[NH3+])c1c(C)noc1C ZINC000423008800 387831716 /nfs/dbraw/zinc/83/17/16/387831716.db2.gz BBKNEUUMDRWASB-JOYOIKCWSA-N 2 0 239.363 2.460 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+][C@H](C)[C@H]1CCC[NH2+]C1 ZINC000423008701 387832268 /nfs/dbraw/zinc/83/22/68/387832268.db2.gz UDEMXTDHNINPCA-BZPMIXESSA-N 2 0 236.359 2.188 20 0 BEADRP C([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)C12CCC(CC1)C2 ZINC000423009829 387833276 /nfs/dbraw/zinc/83/32/76/387833276.db2.gz FBDMWLWZQMWMLU-OTHKPKEBSA-N 2 0 234.387 2.439 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]CC12CCC(CC1)C2 ZINC000423011496 387833827 /nfs/dbraw/zinc/83/38/27/387833827.db2.gz IXEBCGRZMQVUEW-YIFLHPOLSA-N 2 0 222.376 2.284 20 0 BEADRP Cc1ccc(CC[C@H](C)[NH2+][C@H](C)C2C[NH2+]C2)o1 ZINC000423009905 387833894 /nfs/dbraw/zinc/83/38/94/387833894.db2.gz WJZPCNHYAWHOJB-CMPLNLGQSA-N 2 0 236.359 2.107 20 0 BEADRP Cc1ccc(CC[C@H](C)[NH2+][C@@H](C)C2C[NH2+]C2)o1 ZINC000423009906 387834163 /nfs/dbraw/zinc/83/41/63/387834163.db2.gz WJZPCNHYAWHOJB-JQWIXIFHSA-N 2 0 236.359 2.107 20 0 BEADRP COCCCCC[N@H+](C)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000442754965 387835148 /nfs/dbraw/zinc/83/51/48/387835148.db2.gz JEYNPOQYQZFSAJ-PBWFPOADSA-N 2 0 240.391 2.018 20 0 BEADRP CC(C)OCCC[N@H+](C)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000442761482 387835494 /nfs/dbraw/zinc/83/54/94/387835494.db2.gz XMFMDXJKCRRKNW-PBWFPOADSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H](c1cccnc1)C1CC1 ZINC000423011997 387836409 /nfs/dbraw/zinc/83/64/09/387836409.db2.gz JXHZEORHWGZIQK-COPLHBTASA-N 2 0 233.359 2.248 20 0 BEADRP CC(C)CSCCC[NH2+][C@H]1CCC[C@@H]1C[NH3+] ZINC000423012189 387836552 /nfs/dbraw/zinc/83/65/52/387836552.db2.gz KGAXVWBRZURPLX-OLZOCXBDSA-N 2 0 244.448 2.483 20 0 BEADRP Cc1ccsc1CC[NH2+][C@H]1CCC[C@@H]1C[NH3+] ZINC000423015006 387838961 /nfs/dbraw/zinc/83/89/61/387838961.db2.gz JVAZFKSSVDVEKB-NEPJUHHUSA-N 2 0 238.400 2.316 20 0 BEADRP Cc1ccsc1CC[NH2+][C@@H]1CCC[C@@H]1C[NH3+] ZINC000423015009 387839268 /nfs/dbraw/zinc/83/92/68/387839268.db2.gz JVAZFKSSVDVEKB-VXGBXAGGSA-N 2 0 238.400 2.316 20 0 BEADRP CC[C@H]([NH2+][C@H](C)CCCC[NH3+])[C@@H]1CCCO1 ZINC000423017567 387840768 /nfs/dbraw/zinc/84/07/68/387840768.db2.gz WQWNLAIHLVEREJ-AGIUHOORSA-N 2 0 228.380 2.051 20 0 BEADRP CO[C@@H]1CCC[C@@H]1C[NH2+][C@H]1CCCCC[C@H]1[NH3+] ZINC000423019143 387841835 /nfs/dbraw/zinc/84/18/35/387841835.db2.gz UEQAMIZLDUMZSW-YIYPIFLZSA-N 2 0 240.391 2.051 20 0 BEADRP CC[C@H]([NH2+]CCCCOC(C)C)[C@@H]1CCC[NH2+]1 ZINC000423027608 387844116 /nfs/dbraw/zinc/84/41/16/387844116.db2.gz DQTQDIDFWCMZBE-KBPBESRZSA-N 2 0 242.407 2.312 20 0 BEADRP Cc1cc(C[NH+](C)C)cc(N[C@H]2CCC[C@@H]2[NH3+])c1 ZINC000423028482 387847394 /nfs/dbraw/zinc/84/73/94/387847394.db2.gz QYJREODTLLXBNJ-GJZGRUSLSA-N 2 0 247.386 2.348 20 0 BEADRP CC[C@H]([NH2+]C[C@H]1CCCCS1)[C@@H]1CCC[NH2+]1 ZINC000423036424 387850993 /nfs/dbraw/zinc/85/09/93/387850993.db2.gz UAAPQRJVKWAGKM-AGIUHOORSA-N 2 0 242.432 2.392 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CCC[C@@H]1CCCCO1 ZINC000423036504 387851875 /nfs/dbraw/zinc/85/18/75/387851875.db2.gz LEVZWJDLRXQVSG-KBPBESRZSA-N 2 0 242.407 2.443 20 0 BEADRP COCC[C@@H]([NH2+][C@H](C)CCC[NH3+])c1ccco1 ZINC000423041779 387854558 /nfs/dbraw/zinc/85/45/58/387854558.db2.gz JTAKCNVTJKNPEH-VXGBXAGGSA-N 2 0 240.347 2.074 20 0 BEADRP C[C@@H](C[NH2+][C@H]1CC[NH2+]CC[C@H]1C)C(F)(F)F ZINC000423052053 387859544 /nfs/dbraw/zinc/85/95/44/387859544.db2.gz OYUHSVCZIIFHOA-UTLUCORTSA-N 2 0 238.297 2.163 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@@H](C)CC(F)(F)F ZINC000423052976 387859697 /nfs/dbraw/zinc/85/96/97/387859697.db2.gz RQFZUBHUBXPZGM-RNJXMRFFSA-N 2 0 212.259 2.043 20 0 BEADRP CCc1ccc(C[N@H+]2C[C@H]3C[NH+](C)C[C@H]3C2)cc1 ZINC000193646620 387860309 /nfs/dbraw/zinc/86/03/09/387860309.db2.gz ZWNYYSRKSUWKLX-IYBDPMFKSA-N 2 0 244.382 2.242 20 0 BEADRP C1[C@H]([NH2+][C@H]2CCC23CCCC3)C12CC[NH2+]CC2 ZINC000643534688 387860413 /nfs/dbraw/zinc/86/04/13/387860413.db2.gz ABRJHRYVSVZOKZ-STQMWFEESA-N 2 0 234.387 2.441 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCCC[C@@H]1C[NH3+])C(F)(F)F ZINC000423056963 387862923 /nfs/dbraw/zinc/86/29/23/387862923.db2.gz YMNWYHWVEPYEAV-OPRDCNLKSA-N 2 0 238.297 2.292 20 0 BEADRP C/C=C/C[C@H](CO)[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000423057708 387864411 /nfs/dbraw/zinc/86/44/11/387864411.db2.gz ZSFJTIPKNCSAOB-NSOMQSSYSA-N 2 0 246.354 2.048 20 0 BEADRP C1CC1[C@@H]([NH2+][C@H]1CC12CC[NH2+]CC2)C1CCC1 ZINC000643536039 387865553 /nfs/dbraw/zinc/86/55/53/387865553.db2.gz MJMCTLJZJYVENV-KBPBESRZSA-N 2 0 234.387 2.297 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[C@H](C)C1)[C@@H]1CCC[NH2+]1 ZINC000423062022 387867243 /nfs/dbraw/zinc/86/72/43/387867243.db2.gz MCRDBOLXOMYKBQ-RNJOBUHISA-N 2 0 210.365 2.295 20 0 BEADRP CO[C@H](C)[C@H](C)[NH2+][C@@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000423064975 387867401 /nfs/dbraw/zinc/86/74/01/387867401.db2.gz AKZUMSHHSGBLFG-FQUUOJAGSA-N 2 0 242.407 2.310 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC12CC[NH2+]CC2)C(C)(C)C ZINC000643536499 387869160 /nfs/dbraw/zinc/86/91/60/387869160.db2.gz UKQGDVIWQYPBAY-MNOVXSKESA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000643537083 387870964 /nfs/dbraw/zinc/87/09/64/387870964.db2.gz ZBERQYIVKBFTMY-AGIUHOORSA-N 2 0 222.376 2.297 20 0 BEADRP CC[C@H]([NH2+]CCC(O)(CC)CC)[C@@H]1CCC[NH2+]1 ZINC000423069832 387871192 /nfs/dbraw/zinc/87/11/92/387871192.db2.gz MJPBPFRUOZOVEV-STQMWFEESA-N 2 0 242.407 2.048 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000643537084 387872028 /nfs/dbraw/zinc/87/20/28/387872028.db2.gz ZBERQYIVKBFTMY-FRRDWIJNSA-N 2 0 222.376 2.297 20 0 BEADRP CCO[C@@]1(C)C[C@H]1[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000527974740 387814296 /nfs/dbraw/zinc/81/42/96/387814296.db2.gz OVCMEERUYJNGMC-KGLIPLIRSA-N 2 0 240.391 2.016 20 0 BEADRP [NH3+][C@H]1CCCCC[C@@H]1[NH2+]CCc1ccco1 ZINC000422963175 387814591 /nfs/dbraw/zinc/81/45/91/387814591.db2.gz HVTIJOBBONAOAE-STQMWFEESA-N 2 0 222.332 2.072 20 0 BEADRP C[C@H]([NH2+][C@H]1C[C@H](c2ccccc2)C1)C1C[NH2+]C1 ZINC000422967321 387815914 /nfs/dbraw/zinc/81/59/14/387815914.db2.gz OXHLIPJOIHVFCD-WHOFXGATSA-N 2 0 230.355 2.130 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]CCc1ccccc1O ZINC000422966940 387816463 /nfs/dbraw/zinc/81/64/63/387816463.db2.gz AXDVNSXROLPEIZ-UONOGXRCSA-N 2 0 248.370 2.042 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CCc1ccccc1O ZINC000422970667 387818421 /nfs/dbraw/zinc/81/84/21/387818421.db2.gz GTKXTYVCOSOEFJ-LBPRGKRZSA-N 2 0 236.359 2.042 20 0 BEADRP CC(C)=CCC[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000423072203 387872795 /nfs/dbraw/zinc/87/27/95/387872795.db2.gz PIQQGTBSPIMUHB-FUNVUKJBSA-N 2 0 208.349 2.215 20 0 BEADRP Cc1cnccc1CC[N@@H+](C)C[C@H]1CCC[C@H]1O ZINC000564081160 387819528 /nfs/dbraw/zinc/81/95/28/387819528.db2.gz ZDVPRGORBQBCTH-HUUCEWRRSA-N 2 0 248.370 2.025 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CC1(C(F)(F)F)CC1 ZINC000423102276 387890049 /nfs/dbraw/zinc/89/00/49/387890049.db2.gz DVDKHOVYTBPBRO-HTQZYQBOSA-N 2 0 224.270 2.044 20 0 BEADRP COCC[C@@H]([NH2+][C@H](C)[C@H]1CCC[NH2+]1)C(C)(C)C ZINC000423105910 387891494 /nfs/dbraw/zinc/89/14/94/387891494.db2.gz CRCMPFXSYHMATJ-JHJVBQTASA-N 2 0 242.407 2.168 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)CCC[NH3+])c1ccc2n[nH]cc2c1 ZINC000423104921 387891918 /nfs/dbraw/zinc/89/19/18/387891918.db2.gz HNMQYZUFCMZZLG-WDEREUQCSA-N 2 0 246.358 2.341 20 0 BEADRP C[C@H]([NH2+]CCC1(F)CCC1)[C@@H]1CCCC[NH2+]1 ZINC000423105846 387892055 /nfs/dbraw/zinc/89/20/55/387892055.db2.gz IXOZLRFUJLTKPD-RYUDHWBXSA-N 2 0 228.355 2.389 20 0 BEADRP COCC[C@H]([NH2+][C@H](C)[C@H]1CCC[NH2+]1)C(C)(C)C ZINC000423105912 387892147 /nfs/dbraw/zinc/89/21/47/387892147.db2.gz CRCMPFXSYHMATJ-UPJWGTAASA-N 2 0 242.407 2.168 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC1(C)C)[C@H]1CCC[NH2+]C1 ZINC000423110189 387892692 /nfs/dbraw/zinc/89/26/92/387892692.db2.gz OTBOSISQXQQYRC-SDDRHHMPSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CC1(C(F)(F)F)CC1 ZINC000423111599 387894022 /nfs/dbraw/zinc/89/40/22/387894022.db2.gz QQWGPYQWDBUNRC-VIFPVBQESA-N 2 0 238.297 2.436 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@@H]1CCCC12CCOCC2 ZINC000423116695 387897864 /nfs/dbraw/zinc/89/78/64/387897864.db2.gz RCTUAXKNLMWYJE-QWHCGFSZSA-N 2 0 240.391 2.053 20 0 BEADRP COCC[C@@H]([NH2+][C@H](C)CCC[NH3+])C(C)(C)C ZINC000423117682 387898022 /nfs/dbraw/zinc/89/80/22/387898022.db2.gz WPWYCVURVCPYEP-VXGBXAGGSA-N 2 0 230.396 2.155 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCCC[C@@H]1C[NH3+])c1ccncc1 ZINC000643460392 387875174 /nfs/dbraw/zinc/87/51/74/387875174.db2.gz YUNBEFQZZJMEBC-BPLDGKMQSA-N 2 0 247.386 2.292 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCCC[C@H]1C[NH3+])c1ccncc1 ZINC000643460394 387875202 /nfs/dbraw/zinc/87/52/02/387875202.db2.gz YUNBEFQZZJMEBC-VHDGCEQUSA-N 2 0 247.386 2.292 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC[NH2+]CC[C@@H]1C)c1ccncc1 ZINC000643460296 387875418 /nfs/dbraw/zinc/87/54/18/387875418.db2.gz NDMCWUSBDJAMGC-GUTXKFCHSA-N 2 0 247.386 2.163 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H](C)c1ccncc1)[C@@H]1CCC[NH2+]1 ZINC000643460377 387875533 /nfs/dbraw/zinc/87/55/33/387875533.db2.gz WRCJABCCGDEGPR-YUELXQCFSA-N 2 0 247.386 2.305 20 0 BEADRP C[C@@H](C[NH2+]C1CCC(C[NH3+])CC1)c1ccncc1 ZINC000643460360 387875660 /nfs/dbraw/zinc/87/56/60/387875660.db2.gz VUKOWRNXWQMWQR-OPFPJEHXSA-N 2 0 247.386 2.292 20 0 BEADRP C[C@@H](C[NH2+][C@@H](C)CCCC[NH3+])c1ccncc1 ZINC000643460234 387875678 /nfs/dbraw/zinc/87/56/78/387875678.db2.gz DAHTXFAIXIVOGK-STQMWFEESA-N 2 0 235.375 2.292 20 0 BEADRP CCC(C)(C)C[NH2+][C@@H]1CC[NH2+]CC[C@H]1C ZINC000423076297 387876342 /nfs/dbraw/zinc/87/63/42/387876342.db2.gz QTMUIJWYCQLTQO-VXGBXAGGSA-N 2 0 212.381 2.400 20 0 BEADRP C1[C@H]([NH2+][C@H]2CC[C@H]2C2CCC2)C12CC[NH2+]CC2 ZINC000643536865 387876421 /nfs/dbraw/zinc/87/64/21/387876421.db2.gz XBSLULVLLJWNOI-IHRRRGAJSA-N 2 0 234.387 2.297 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]C1CCC2(CC2)CC1 ZINC000423078796 387876843 /nfs/dbraw/zinc/87/68/43/387876843.db2.gz WTYLAYKIQWWARP-GHMZBOCLSA-N 2 0 210.365 2.425 20 0 BEADRP CC[C@](C)(C[NH2+][C@H]1CCN2CCCC[C@@H]12)OC ZINC000322518374 387878730 /nfs/dbraw/zinc/87/87/30/387878730.db2.gz KYEOBZAGSICWPT-MELADBBJSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H]1CCCC12CCOCC2 ZINC000423116694 387898453 /nfs/dbraw/zinc/89/84/53/387898453.db2.gz RCTUAXKNLMWYJE-OLZOCXBDSA-N 2 0 240.391 2.053 20 0 BEADRP CSC1(C[NH2+][C@@H]2CCCCC[C@@H]2[NH3+])CC1 ZINC000423085916 387880006 /nfs/dbraw/zinc/88/00/06/387880006.db2.gz KTDKKXNRJIVSAM-WDEREUQCSA-N 2 0 228.405 2.132 20 0 BEADRP CC[C@H](Cc1cccs1)[NH2+]C[C@@H]([NH3+])CC ZINC000643540332 387880763 /nfs/dbraw/zinc/88/07/63/387880763.db2.gz YNBYXVSRFRSLJN-WDEREUQCSA-N 2 0 226.389 2.396 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@@H](C)Cc1cccs1 ZINC000643540248 387881091 /nfs/dbraw/zinc/88/10/91/387881091.db2.gz LJBQMNUNXBDCIC-VHSXEESVSA-N 2 0 212.362 2.006 20 0 BEADRP COC1CCC(C)(C[NH2+][C@@H]2CCC[C@H]2[NH3+])CC1 ZINC000423086997 387881374 /nfs/dbraw/zinc/88/13/74/387881374.db2.gz ONHPWSZRAWHEQK-CEUNDQEZSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]CCC1(C)CC1 ZINC000423087948 387881542 /nfs/dbraw/zinc/88/15/42/387881542.db2.gz QPSYKTLJDLLBHB-VXGBXAGGSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1C[C@H](C)C[N@H+]1CCC1CC[NH2+]CC1 ZINC000157893957 387882394 /nfs/dbraw/zinc/88/23/94/387882394.db2.gz MCRPDVMSLZZPJJ-NWDGAFQWSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CCCc1ccccc1F ZINC000423095430 387885371 /nfs/dbraw/zinc/88/53/71/387885371.db2.gz MDLLCPIJBMXXPA-NEPJUHHUSA-N 2 0 238.350 2.474 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC(F)(F)C1)[C@@H]1CCC[NH2+]1 ZINC000423095209 387885838 /nfs/dbraw/zinc/88/58/38/387885838.db2.gz LQGHJTMTNXFDSL-AXFHLTTASA-N 2 0 232.318 2.152 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CC1C(C)(C)C1(C)C ZINC000423098910 387886676 /nfs/dbraw/zinc/88/66/76/387886676.db2.gz SXYGHVGSWXHETB-VHSXEESVSA-N 2 0 212.381 2.384 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CC1C(C)(C)C1(C)C ZINC000423098908 387886741 /nfs/dbraw/zinc/88/67/41/387886741.db2.gz SXYGHVGSWXHETB-NXEZZACHSA-N 2 0 212.381 2.384 20 0 BEADRP C[C@@H]1CCC[C@@H]1C[NH2+][C@H]1CC[NH2+]CC[C@H]1C ZINC000423098109 387887422 /nfs/dbraw/zinc/88/74/22/387887422.db2.gz KGFUOJPHXGRNSK-SYQHCUMBSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CCC1(F)CCC1 ZINC000423101054 387887664 /nfs/dbraw/zinc/88/76/64/387887664.db2.gz CGWZDCSMONCZPL-NSHDSACASA-N 2 0 216.344 2.376 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@H](CO)CCC(C)(C)C ZINC000423098818 387887739 /nfs/dbraw/zinc/88/77/39/387887739.db2.gz SMSRWKNDEQBZCF-STQMWFEESA-N 2 0 244.423 2.281 20 0 BEADRP Cc1cccc(CCC[NH2+][C@H](C)C[C@H](C)[NH3+])n1 ZINC000423098471 387888015 /nfs/dbraw/zinc/88/80/15/387888015.db2.gz CTWFEXJYUYMZJC-WCQYABFASA-N 2 0 235.375 2.038 20 0 BEADRP CO[C@H](C)[C@@H](C)[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000423141114 387917927 /nfs/dbraw/zinc/91/79/27/387917927.db2.gz OANSKVKGXCEOGC-DMTCVQMQSA-N 2 0 234.343 2.144 20 0 BEADRP FC(F)[C@H]1C[C@@H]1[NH2+][C@@H]1CCC[C@H]1[C@H]1CCC[NH2+]1 ZINC000423116074 387899469 /nfs/dbraw/zinc/89/94/69/387899469.db2.gz ZKTSEQGCBFSHDM-HGCLJGPKSA-N 2 0 244.329 2.150 20 0 BEADRP C[C@H]([NH2+]C1CC(C(F)(F)F)C1)[C@H]1CCC[NH2+]1 ZINC000423121041 387900607 /nfs/dbraw/zinc/90/06/07/387900607.db2.gz HUNSGYKVOXDFLQ-AUXWQGHOSA-N 2 0 236.281 2.057 20 0 BEADRP COCC(C)(C)CCC[NH2+][C@H]1CCC[C@@H]1C[NH3+] ZINC000423121493 387901586 /nfs/dbraw/zinc/90/15/86/387901586.db2.gz INSHYGMRFVLSBC-OLZOCXBDSA-N 2 0 242.407 2.156 20 0 BEADRP COCC(C)(C)CCC[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000423122565 387902151 /nfs/dbraw/zinc/90/21/51/387902151.db2.gz JZTCLLIKSXBSCB-RYUDHWBXSA-N 2 0 230.396 2.155 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]C[C@@H]1COc2ccccc21 ZINC000423128106 387905586 /nfs/dbraw/zinc/90/55/86/387905586.db2.gz VCCDYLCLPVAKFJ-QWHCGFSZSA-N 2 0 248.370 2.270 20 0 BEADRP CCOCC(C)(C)C[NH2+][C@H]1CCCCC[C@@H]1[NH3+] ZINC000423130498 387906900 /nfs/dbraw/zinc/90/69/00/387906900.db2.gz YQENEDVSCGENCB-STQMWFEESA-N 2 0 242.407 2.299 20 0 BEADRP CCc1noc(C)c1C[NH2+][C@H](C)CCCC[NH3+] ZINC000423130221 387907608 /nfs/dbraw/zinc/90/76/08/387907608.db2.gz GDUYNBZMEUNGHH-SNVBAGLBSA-N 2 0 239.363 2.153 20 0 BEADRP CCOCC(C)(C)C[NH2+][C@@H]1CCCCC[C@@H]1[NH3+] ZINC000423130497 387907679 /nfs/dbraw/zinc/90/76/79/387907679.db2.gz YQENEDVSCGENCB-QWHCGFSZSA-N 2 0 242.407 2.299 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[C@@H](F)C1)[C@@H]1CCCC[NH2+]1 ZINC000423129215 387907940 /nfs/dbraw/zinc/90/79/40/387907940.db2.gz QWFFHISOUWFSEM-NDBYEHHHSA-N 2 0 228.355 2.387 20 0 BEADRP CCOCC(C)(C)C[NH2+][C@@H]1CCCCC[C@H]1[NH3+] ZINC000423130495 387908005 /nfs/dbraw/zinc/90/80/05/387908005.db2.gz YQENEDVSCGENCB-CHWSQXEVSA-N 2 0 242.407 2.299 20 0 BEADRP Cc1cccnc1C(C)(C)C[NH2+][C@H]1CCC[C@H]1[NH3+] ZINC000423133226 387909389 /nfs/dbraw/zinc/90/93/89/387909389.db2.gz CMYPLAFRVROGFQ-OLZOCXBDSA-N 2 0 247.386 2.137 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CCc2ccccc21)C1C[NH2+]C1 ZINC000423142709 387919561 /nfs/dbraw/zinc/91/95/61/387919561.db2.gz BHJMHTCIGBJTLS-OCCSQVGLSA-N 2 0 244.382 2.304 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+][C@@H]1CC[C@H](F)C1 ZINC000423132456 387909687 /nfs/dbraw/zinc/90/96/87/387909687.db2.gz UQESBBGVCMZKCG-QCNOEVLYSA-N 2 0 214.328 2.127 20 0 BEADRP CC(C)[C@H]([NH2+][C@@H]1CC[C@H](C[NH3+])C1)C1CC1 ZINC000514667500 387909740 /nfs/dbraw/zinc/90/97/40/387909740.db2.gz VXRZIZQFWPYCCS-UHTWSYAYSA-N 2 0 210.365 2.138 20 0 BEADRP Cc1cccnc1C(C)(C)C[NH2+][C@H]1CCC[C@@H]1[NH3+] ZINC000423133229 387909956 /nfs/dbraw/zinc/90/99/56/387909956.db2.gz CMYPLAFRVROGFQ-STQMWFEESA-N 2 0 247.386 2.137 20 0 BEADRP COCC1(C[NH2+][C@H](C)C[C@@H](C)[NH3+])CCCCC1 ZINC000423134761 387912444 /nfs/dbraw/zinc/91/24/44/387912444.db2.gz FHDUTIUQXGPHAP-CHWSQXEVSA-N 2 0 242.407 2.299 20 0 BEADRP CC(C)C1([NH2+]C2CCC(C[NH3+])CC2)CC1 ZINC000423137459 387913617 /nfs/dbraw/zinc/91/36/17/387913617.db2.gz RAAZZKCGVLCMGK-UHFFFAOYSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H](F)CC[NH2+][C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000423138787 387916600 /nfs/dbraw/zinc/91/66/00/387916600.db2.gz UBXXCPPYMNLVJJ-XDTLVQLUSA-N 2 0 222.307 2.469 20 0 BEADRP Cc1cccnc1CCC[NH2+][C@@H](C)C[C@@H](C)[NH3+] ZINC000423151928 387929402 /nfs/dbraw/zinc/92/94/02/387929402.db2.gz KWJHBJWTSQHKAK-OLZOCXBDSA-N 2 0 235.375 2.038 20 0 BEADRP CCO[C@@H]1CCCC[C@H]1[NH2+][C@H](C)CCCC[NH3+] ZINC000423157712 387937234 /nfs/dbraw/zinc/93/72/34/387937234.db2.gz BMPWPZGZCFWXLZ-MGPQQGTHSA-N 2 0 242.407 2.441 20 0 BEADRP Cc1ccc(F)c(CC[NH2+][C@H]2CCC[C@@H]2[NH3+])c1 ZINC000423151384 387930378 /nfs/dbraw/zinc/93/03/78/387930378.db2.gz KCFFJHVMPJMJOC-KBPBESRZSA-N 2 0 236.334 2.146 20 0 BEADRP CC(C)[C@@H]1C[C@H]1C[NH2+][C@@H](C)[C@H]1CCCC[NH2+]1 ZINC000423151609 387930599 /nfs/dbraw/zinc/93/05/99/387930599.db2.gz KEVQUXBTRQEDEP-XDQVBPFNSA-N 2 0 224.392 2.399 20 0 BEADRP CCO[C@@H]1CCC[C@H]1[NH2+][C@H](C)CCCC[NH3+] ZINC000423157855 387937259 /nfs/dbraw/zinc/93/72/59/387937259.db2.gz BRKRWAJERQVDLT-JHJVBQTASA-N 2 0 228.380 2.051 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1C[C@H]1C1CC1)[C@@H]1CCC[NH2+]1 ZINC000423157745 387936311 /nfs/dbraw/zinc/93/63/11/387936311.db2.gz BPYKBGMJXQBWJU-XUXIUFHCSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CSc2ccccc21)C1C[NH2+]C1 ZINC000423143331 387920565 /nfs/dbraw/zinc/92/05/65/387920565.db2.gz CQHQIUKZQJUQPY-JQWIXIFHSA-N 2 0 248.395 2.073 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CCc2ccccc21)C1C[NH2+]C1 ZINC000423142708 387921303 /nfs/dbraw/zinc/92/13/03/387921303.db2.gz BHJMHTCIGBJTLS-JSGCOSHPSA-N 2 0 244.382 2.304 20 0 BEADRP CC(C)(C[NH2+][C@@H]1CCC[C@H]1C[NH3+])c1ccccn1 ZINC000423147902 387924227 /nfs/dbraw/zinc/92/42/27/387924227.db2.gz TXOAIOBHDUJTHJ-QWHCGFSZSA-N 2 0 247.386 2.076 20 0 BEADRP Cc1cccnc1CCC[NH2+][C@@H](C)[C@@H]1CCC[NH2+]1 ZINC000423147087 387924752 /nfs/dbraw/zinc/92/47/52/387924752.db2.gz CBRIDKZPZXXSEM-ZFWWWQNUSA-N 2 0 247.386 2.053 20 0 BEADRP CC(C)[C@@H]1C[C@@H](C[NH2+][C@@H](C)C[C@H](C)[NH3+])CCO1 ZINC000423150126 387927732 /nfs/dbraw/zinc/92/77/32/387927732.db2.gz IDHWOQQVYMLGDS-XUXIUFHCSA-N 2 0 242.407 2.153 20 0 BEADRP CC/C=C\C[NH2+][C@@H](C)c1ccc(C[NH3+])nc1C ZINC000423152189 387929137 /nfs/dbraw/zinc/92/91/37/387929137.db2.gz DXTNKMUTDPPGFP-GZTOBOFZSA-N 2 0 233.359 2.466 20 0 BEADRP C[N@@H+](CC1=CCCC1)C[C@H]1CCC[NH+](C)C1 ZINC000645807751 387954503 /nfs/dbraw/zinc/95/45/03/387954503.db2.gz AFSGITWSKYHKDT-AWEZNQCLSA-N 2 0 222.376 2.370 20 0 BEADRP CSCC1CCC([NH2+][C@@H]2CCC[C@H]2[NH3+])CC1 ZINC000423159123 387938314 /nfs/dbraw/zinc/93/83/14/387938314.db2.gz OUZWIPLWZCPOFS-FIYWTHMPSA-N 2 0 242.432 2.378 20 0 BEADRP CC(C)C[C@@H](C)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000044535006 387939133 /nfs/dbraw/zinc/93/91/33/387939133.db2.gz PFZADHSVZZJEMN-OLZOCXBDSA-N 2 0 212.381 2.352 20 0 BEADRP CC[C@H](C)[C@H](C[NH2+][C@H]1CC[NH2+]CC[C@H]1C)OC ZINC000423159423 387940946 /nfs/dbraw/zinc/94/09/46/387940946.db2.gz PFKPXIIYTDIFNH-CRWXNKLISA-N 2 0 242.407 2.025 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]CCC[C@@H]1CCOC1 ZINC000423161058 387942955 /nfs/dbraw/zinc/94/29/55/387942955.db2.gz NDNMFXBYWUUMLM-MCIONIFRSA-N 2 0 240.391 2.053 20 0 BEADRP CC[C@H]([NH2+][C@H](C)C1C[NH2+]C1)C1CCCC1 ZINC000423162464 387943733 /nfs/dbraw/zinc/94/37/33/387943733.db2.gz PILCVAHVKMSHSI-MFKMUULPSA-N 2 0 210.365 2.153 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]CCC1CC(F)(F)C1 ZINC000423164139 387945739 /nfs/dbraw/zinc/94/57/39/387945739.db2.gz OBTYGBBOWUCXMG-WDEREUQCSA-N 2 0 232.318 2.139 20 0 BEADRP C[C@@H](CCCC[NH3+])[N@@H+]1CCC[C@@]2(CCOC2)C1 ZINC000423164812 387948590 /nfs/dbraw/zinc/94/85/90/387948590.db2.gz SWPKWSCJPLBVBM-UONOGXRCSA-N 2 0 240.391 2.006 20 0 BEADRP CC[C@H]([NH2+]C[C@H](C)C[NH+](C)C)[C@H]1C[C@H]1C ZINC000321136878 387951009 /nfs/dbraw/zinc/95/10/09/387951009.db2.gz UOZJOBLZKFHOBI-RNJOBUHISA-N 2 0 212.381 2.208 20 0 BEADRP CC[C@H]([NH2+]C[C@H](C)C[NH+](C)C)[C@@H]1C[C@H]1C ZINC000321136877 387951275 /nfs/dbraw/zinc/95/12/75/387951275.db2.gz UOZJOBLZKFHOBI-LOWDOPEQSA-N 2 0 212.381 2.208 20 0 BEADRP C[C@H]([NH2+]C1(C2CCC2)CCC1)[C@@H]1CCC[NH2+]1 ZINC000423172668 387959013 /nfs/dbraw/zinc/95/90/13/387959013.db2.gz UPZLVGGQCCFCFS-AAEUAGOBSA-N 2 0 222.376 2.439 20 0 BEADRP COc1ccc([C@@H](C)[NH2+]C2CC[NH2+]CC2)c(C)c1 ZINC000423177015 387961307 /nfs/dbraw/zinc/96/13/07/387961307.db2.gz DKQJCCUOSFBYKZ-GFCCVEGCSA-N 2 0 248.370 2.406 20 0 BEADRP C1CC1[C@@H]([NH2+]C1CC[NH2+]CC1)C1CCCC1 ZINC000423176714 387961673 /nfs/dbraw/zinc/96/16/73/387961673.db2.gz CTYIWTCSHFJLJE-AWEZNQCLSA-N 2 0 222.376 2.297 20 0 BEADRP C1CC1[C@H]([NH2+]C1CC[NH2+]CC1)C1CCCC1 ZINC000423176715 387961889 /nfs/dbraw/zinc/96/18/89/387961889.db2.gz CTYIWTCSHFJLJE-CQSZACIVSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]1CC[N@H+](CC[C@@H]2CCC[NH+]2C)[C@H]1C ZINC000245603551 387965064 /nfs/dbraw/zinc/96/50/64/387965064.db2.gz JLVCENIRZQBVIT-AGIUHOORSA-N 2 0 210.365 2.201 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+][C@@H]1CCCC[C@H]1F ZINC000423180884 387965961 /nfs/dbraw/zinc/96/59/61/387965961.db2.gz KQSVPWGASAJAKJ-FVCCEPFGSA-N 2 0 228.355 2.374 20 0 BEADRP CO[C@H](c1ccccc1)[C@@H](C)[NH2+]C1CC[NH2+]CC1 ZINC000423184629 387968955 /nfs/dbraw/zinc/96/89/55/387968955.db2.gz MJMGEOKUXGKGHY-DOMZBBRYSA-N 2 0 248.370 2.104 20 0 BEADRP C[C@H]1CN(C2CC2)C[C@@H]1[NH2+]C[C@@H]1C[C@H]1C1CCC1 ZINC000424295617 387956917 /nfs/dbraw/zinc/95/69/17/387956917.db2.gz PVURWBDBSMYFCV-MZGVZZPPSA-N 2 0 248.414 2.495 20 0 BEADRP [NH3+]CCC[NH2+][C@@H]1CC[C@@H](c2ccccc2)C1 ZINC000423193919 387979137 /nfs/dbraw/zinc/97/91/37/387979137.db2.gz QZVOJWFFACVTDQ-ZIAGYGMSSA-N 2 0 218.344 2.261 20 0 BEADRP Cc1cccc(C[C@@H]([NH2+]CCC[NH3+])C2CC2)c1 ZINC000423196630 387981221 /nfs/dbraw/zinc/98/12/21/387981221.db2.gz VTEPUSLKSHCMOG-OAHLLOKOSA-N 2 0 232.371 2.255 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CC(C)(C)c1cccnc1 ZINC000423189910 387973789 /nfs/dbraw/zinc/97/37/89/387973789.db2.gz RMIIAMPXRKVELC-VXGBXAGGSA-N 2 0 235.375 2.075 20 0 BEADRP [NH3+][C@@H]1CCCC[C@H]1[NH2+]CCCOc1ccccc1 ZINC000424329517 387975662 /nfs/dbraw/zinc/97/56/62/387975662.db2.gz GQOSJNBJNJQLKM-HUUCEWRRSA-N 2 0 248.370 2.315 20 0 BEADRP CC[C@@H]([NH2+]CCC[NH2+]C)c1ccc(F)cc1 ZINC000423190218 387976337 /nfs/dbraw/zinc/97/63/37/387976337.db2.gz QOJARVJMFSSKTE-CYBMUJFWSA-N 2 0 224.323 2.476 20 0 BEADRP CC[C@@H](NCCC[NH+](C)C)c1ccncc1 ZINC000453061237 387977211 /nfs/dbraw/zinc/97/72/11/387977211.db2.gz SJHSURGZXDJAHR-CYBMUJFWSA-N 2 0 221.348 2.074 20 0 BEADRP Cc1cccc(OCC[NH2+][C@@H]2CCCC[C@H]2[NH3+])c1 ZINC000424334692 387978420 /nfs/dbraw/zinc/97/84/20/387978420.db2.gz NXYDZPDFAJHEJX-HUUCEWRRSA-N 2 0 248.370 2.233 20 0 BEADRP CC[C@@H]1CC[C@@H](C)C[C@@H]1[NH2+]CCC[NH2+]C ZINC000423201625 387987401 /nfs/dbraw/zinc/98/74/01/387987401.db2.gz PFNCVMVJSMDBDX-UPJWGTAASA-N 2 0 212.381 2.400 20 0 BEADRP C[NH2+]CCC[NH2+][C@H](C)[C@@H]1CCCC[C@H]1C ZINC000423201884 387987711 /nfs/dbraw/zinc/98/77/11/387987711.db2.gz QDTTVSTUNYNGIA-JHJVBQTASA-N 2 0 212.381 2.400 20 0 BEADRP CC[C@@H]1CC[C@H](C)C[C@H]1[NH2+]CCC[NH2+]C ZINC000423201627 387988176 /nfs/dbraw/zinc/98/81/76/387988176.db2.gz PFNCVMVJSMDBDX-YNEHKIRRSA-N 2 0 212.381 2.400 20 0 BEADRP C[NH2+]CCC[NH2+][C@H]1c2cc(C)ccc2C[C@@H]1C ZINC000423203681 387989391 /nfs/dbraw/zinc/98/93/91/387989391.db2.gz SXQLMVMCEJDHQI-SWLSCSKDSA-N 2 0 232.371 2.427 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1CCCc2nc(C)sc21 ZINC000423204515 387989440 /nfs/dbraw/zinc/98/94/40/387989440.db2.gz UNHPLPZDKJHEAG-SNVBAGLBSA-N 2 0 239.388 2.028 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CC1([NH3+])CCCCCC1 ZINC000423202560 387989546 /nfs/dbraw/zinc/98/95/46/387989546.db2.gz RBJPCKIOVZNDFI-CYBMUJFWSA-N 3 0 241.423 2.145 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1CCC[C@H]1CCCF ZINC000423206405 387991126 /nfs/dbraw/zinc/99/11/26/387991126.db2.gz WSTMJOBANMTMKE-NWDGAFQWSA-N 2 0 216.344 2.104 20 0 BEADRP FCCC[C@@H]1CCC[C@H]1[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000423204736 387991363 /nfs/dbraw/zinc/99/13/63/387991363.db2.gz DQAUTQNQFMKAAC-MELADBBJSA-N 2 0 242.382 2.494 20 0 BEADRP C[C@@H](CCC1CC1)[NH2+][C@@H]1CCCC[C@H]1[NH3+] ZINC000424373314 387996036 /nfs/dbraw/zinc/99/60/36/387996036.db2.gz XOHOKTUMUHOMED-CYZMBNFOSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)c1cccc(O)c1)[C@@H]1CCC[NH2+]C1 ZINC000423205775 387991920 /nfs/dbraw/zinc/99/19/20/387991920.db2.gz BKPODQGDTSTVAM-OUCADQQQSA-N 2 0 248.370 2.431 20 0 BEADRP CC[C@@H]1C[C@H](C[NH2+][C@@H]2CCCC[C@H]2[NH3+])CCO1 ZINC000424365878 387992718 /nfs/dbraw/zinc/99/27/18/387992718.db2.gz HXAXIQZJVVYTFH-AAVRWANBSA-N 2 0 240.391 2.051 20 0 BEADRP C[NH2+]CCC[NH2+][C@H](C)c1ccc2c(c1)CCC2 ZINC000423209055 387994088 /nfs/dbraw/zinc/99/40/88/387994088.db2.gz ZNNMHNHVNAWQIZ-GFCCVEGCSA-N 2 0 232.371 2.435 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[C@H]1C1CCC1)[C@H]1CCCC[NH2+]1 ZINC000424370556 387994073 /nfs/dbraw/zinc/99/40/73/387994073.db2.gz DQDGGZGNTHVTNS-YXCITZCRSA-N 2 0 222.376 2.295 20 0 BEADRP [NH3+]CCC[NH2+][C@@H]1CCCc2cc(F)ccc21 ZINC000423196873 387982080 /nfs/dbraw/zinc/98/20/80/387982080.db2.gz WTOHAXPTHIOTSA-CYBMUJFWSA-N 2 0 222.307 2.142 20 0 BEADRP C[NH2+]CCC[NH2+][C@H](C)C1C(C)(C)C1(C)C ZINC000423197965 387983611 /nfs/dbraw/zinc/98/36/11/387983611.db2.gz CHFNBTQGUQHVLB-SNVBAGLBSA-N 2 0 212.381 2.256 20 0 BEADRP C[C@H]([NH2+]CC1([NH3+])CCCCCC1)C1CC1 ZINC000423198542 387983797 /nfs/dbraw/zinc/98/37/97/387983797.db2.gz GKNRLQRNJQDXOH-NSHDSACASA-N 2 0 210.365 2.426 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1c2cc(F)ccc2C[C@@H]1C ZINC000423198042 387984376 /nfs/dbraw/zinc/98/43/76/387984376.db2.gz CQCSXBIAIGQWPX-HZMBPMFUSA-N 2 0 236.334 2.258 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCCC[C@H]1[NH3+])C1CCCC1 ZINC000424374020 387998455 /nfs/dbraw/zinc/99/84/55/387998455.db2.gz KPBQEQMSULYJBS-CYZMBNFOSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H]1C[C@@]1(F)c1ccccc1 ZINC000424375325 387998746 /nfs/dbraw/zinc/99/87/46/387998746.db2.gz MUJJTVOLNUKRQD-MRVWCRGKSA-N 2 0 236.334 2.341 20 0 BEADRP C[C@@H]([NH2+]CC[C@H](C)[NH3+])c1cc(F)c(F)c(F)c1 ZINC000423222255 388001304 /nfs/dbraw/zinc/00/13/04/388001304.db2.gz AJKQPVVEMRATIH-JGVFFNPUSA-N 2 0 246.276 2.492 20 0 BEADRP C[C@H]([NH3+])CC[NH2+]C(C1CCC1)C1CCC1 ZINC000423222345 388001778 /nfs/dbraw/zinc/00/17/78/388001778.db2.gz AREDPJFLRUXRMC-JTQLQIEISA-N 2 0 210.365 2.282 20 0 BEADRP Cc1cccc([C@@H](C)[NH2+]CC[C@H](C)[NH3+])c1 ZINC000423223821 388006509 /nfs/dbraw/zinc/00/65/09/388006509.db2.gz ATBWMVSSSGTMMJ-NWDGAFQWSA-N 2 0 206.333 2.383 20 0 BEADRP CCCCO[C@@H]1C[C@H]([NH2+]CC[C@H](C)[NH3+])C1(C)C ZINC000423225232 388008099 /nfs/dbraw/zinc/00/80/99/388008099.db2.gz LURWZBYMPMUOIV-RWMBFGLXSA-N 2 0 242.407 2.297 20 0 BEADRP C[C@@H]([NH2+]CC[C@H](C)[NH3+])C1C(C)(C)C1(C)C ZINC000423226318 388009312 /nfs/dbraw/zinc/00/93/12/388009312.db2.gz QGINQTLUWZPOLH-VHSXEESVSA-N 2 0 212.381 2.384 20 0 BEADRP COCC1CCC([NH2+][C@@H]2CCCC[C@H]2[NH3+])CC1 ZINC000424372170 387996171 /nfs/dbraw/zinc/99/61/71/387996171.db2.gz HHQNYBUNYVXSNE-NWINJMCUSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]C[C@@H]1C[C@H]1C1CCC1 ZINC000424372769 387996559 /nfs/dbraw/zinc/99/65/59/387996559.db2.gz HLBQDHXIWJQNFE-UNQGMJICSA-N 2 0 236.403 2.400 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+]C[C@@H]1C[C@H]1C1CCC1 ZINC000424372767 387996743 /nfs/dbraw/zinc/99/67/43/387996743.db2.gz HLBQDHXIWJQNFE-CYUUQNCZSA-N 2 0 236.403 2.400 20 0 BEADRP COc1ccc([C@@H](C)[NH2+]CC[C@H]2CC[NH2+]C2)cc1 ZINC000423240572 388023717 /nfs/dbraw/zinc/02/37/17/388023717.db2.gz CJOVUSZHBXRQHQ-CHWSQXEVSA-N 2 0 248.370 2.345 20 0 BEADRP C(C[C@@H]1CC[NH2+]C1)[NH2+][C@@H](C1CC1)C1CCC1 ZINC000423240582 388023787 /nfs/dbraw/zinc/02/37/87/388023787.db2.gz CJQYZXOECYNFAQ-SMDDNHRTSA-N 2 0 222.376 2.154 20 0 BEADRP Cc1ccsc1[C@@H](C)[NH2+]CC[C@H](C)[NH3+] ZINC000423242645 388026228 /nfs/dbraw/zinc/02/62/28/388026228.db2.gz ZELDGTAMJIAXNH-VHSXEESVSA-N 2 0 212.362 2.444 20 0 BEADRP C[C@@H]1CC(C)(C)C[C@H]1[NH2+]C[C@H]1CCC[NH2+]1 ZINC000423243447 388026248 /nfs/dbraw/zinc/02/62/48/388026248.db2.gz WNMNJRBDSQDEOT-IJLUTSLNSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H](C)CCCc1cccnc1 ZINC000423228337 388012720 /nfs/dbraw/zinc/01/27/20/388012720.db2.gz ZEQNLSKULSSMPR-STQMWFEESA-N 2 0 235.375 2.120 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@H]1CCc2c1cccc2F ZINC000423227836 388013120 /nfs/dbraw/zinc/01/31/20/388013120.db2.gz XFVPATGRADQKJO-ZANVPECISA-N 2 0 222.307 2.140 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@H]1CCCc2ccccc21 ZINC000423231775 388016574 /nfs/dbraw/zinc/01/65/74/388016574.db2.gz LTVILMMBWLFMMR-FZMZJTMJSA-N 2 0 218.344 2.391 20 0 BEADRP CC(=O)Nc1cccc([C@H](C)[NH2+]CC[C@H](C)[NH3+])c1 ZINC000423232082 388016678 /nfs/dbraw/zinc/01/66/78/388016678.db2.gz MHQFUYBBUZNFSP-QWRGUYRKSA-N 2 0 249.358 2.033 20 0 BEADRP CCNCC[NH2+][C@@H]1CCC[C@H](c2cccnc2)C1 ZINC000423234924 388018916 /nfs/dbraw/zinc/01/89/16/388018916.db2.gz MQSKXADAYFHGOX-DZGCQCFKSA-N 2 0 247.386 2.307 20 0 BEADRP Cc1ccccc1[C@@H](C)[NH2+]CC[C@H](C)[NH3+] ZINC000423233780 388019473 /nfs/dbraw/zinc/01/94/73/388019473.db2.gz OTIHKHMWBCJECR-NWDGAFQWSA-N 2 0 206.333 2.383 20 0 BEADRP CC[C@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1ccncc1 ZINC000423238422 388022621 /nfs/dbraw/zinc/02/26/21/388022621.db2.gz AGDSBWHSIUUETI-OCCSQVGLSA-N 2 0 233.359 2.122 20 0 BEADRP COc1ccc([C@H](C)[NH2+]CC[C@H](C)[NH3+])cc1 ZINC000423239697 388022709 /nfs/dbraw/zinc/02/27/09/388022709.db2.gz WJVABARUNNBHSE-QWRGUYRKSA-N 2 0 222.332 2.083 20 0 BEADRP C[C@@H]1CCC[C@@H](C)C1[NH2+]C[C@H]1CCC[NH2+]1 ZINC000423239574 388022786 /nfs/dbraw/zinc/02/27/86/388022786.db2.gz SHILLKFPUJWPMD-IJLUTSLNSA-N 2 0 210.365 2.153 20 0 BEADRP Cc1cc[nH+]c(NCC[C@H]2CCC[NH2+]C2)c1 ZINC000082487027 388035871 /nfs/dbraw/zinc/03/58/71/388035871.db2.gz HMHYFCNKJBAJJX-GFCCVEGCSA-N 2 0 219.332 2.192 20 0 BEADRP CC[C@H]([NH2+]C[C@@H](C)C[NH2+]C)[C@@H]1CC1(C)C ZINC000423255731 388036717 /nfs/dbraw/zinc/03/67/17/388036717.db2.gz APZNKWMKLRQBJB-SRVKXCTJSA-N 2 0 212.381 2.256 20 0 BEADRP C(C[C@@H]1CC[NH2+]C1)[NH2+][C@@H]1CC[C@H]1C1CCC1 ZINC000423254656 388036752 /nfs/dbraw/zinc/03/67/52/388036752.db2.gz ZAUPHIXDTWQPGL-FPMFFAJLSA-N 2 0 222.376 2.154 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)c1cncs1 ZINC000423256674 388036902 /nfs/dbraw/zinc/03/69/02/388036902.db2.gz FPYWLFXFKLUQNP-MNOVXSKESA-N 2 0 239.388 2.183 20 0 BEADRP CC[C@@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)C1CC1 ZINC000423256070 388037642 /nfs/dbraw/zinc/03/76/42/388037642.db2.gz DIODFGCOEBYHGQ-WCQYABFASA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]([NH2+][C@H]1C[C@H](C)[N@H+](C)C[C@H]1C)C1CC1 ZINC000453298033 388037935 /nfs/dbraw/zinc/03/79/35/388037935.db2.gz WUSBWJKUCHKNBM-XZUYRWCXSA-N 2 0 210.365 2.103 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@H]1CC[C@H]1C(C)(C)C ZINC000423264884 388042031 /nfs/dbraw/zinc/04/20/31/388042031.db2.gz CLFHWHRVRQCFED-UTUOFQBUSA-N 2 0 212.381 2.384 20 0 BEADRP CC(C)C[C@H](C[NH3+])N[C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000423264673 388042270 /nfs/dbraw/zinc/04/22/70/388042270.db2.gz QAJGXMMLCKGGRJ-UGFHNGPFSA-N 2 0 247.386 2.094 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@H]1CCCC12CCC2 ZINC000423263869 388042899 /nfs/dbraw/zinc/04/28/99/388042899.db2.gz BHISAVZIAKFLJD-NEPJUHHUSA-N 2 0 210.365 2.282 20 0 BEADRP CCc1ccc([C@@H](C)[NH2+]CC[C@@H]2CC[NH2+]C2)o1 ZINC000423243589 388026611 /nfs/dbraw/zinc/02/66/11/388026611.db2.gz GQUNFXLFCYNUED-NEPJUHHUSA-N 2 0 236.359 2.492 20 0 BEADRP CC(C)[C@@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1cccnc1 ZINC000423243886 388028743 /nfs/dbraw/zinc/02/87/43/388028743.db2.gz GSQYGRZCUIMTFZ-UKRRQHHQSA-N 2 0 247.386 2.368 20 0 BEADRP CC(C)=CCC[C@@H](C)[NH2+]C[C@@H]1CCC[NH2+]1 ZINC000423246599 388030390 /nfs/dbraw/zinc/03/03/90/388030390.db2.gz ZLXZRTDVJCNFPO-OLZOCXBDSA-N 2 0 210.365 2.463 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1cccs1 ZINC000423249052 388031582 /nfs/dbraw/zinc/03/15/82/388031582.db2.gz ODTVOCYOEXPODG-MNOVXSKESA-N 2 0 224.373 2.398 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+]C1[C@H](C)CCC[C@H]1C ZINC000423271721 388051076 /nfs/dbraw/zinc/05/10/76/388051076.db2.gz JEYSCWWEGDMDEI-IJLUTSLNSA-N 2 0 212.381 2.384 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CC(C)(C)C[C@H]1C ZINC000423273272 388053234 /nfs/dbraw/zinc/05/32/34/388053234.db2.gz KNOLHKKIHJPQJX-QJPTWQEYSA-N 2 0 212.381 2.256 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CC[C@@H]1C(C)(C)C ZINC000423276146 388056303 /nfs/dbraw/zinc/05/63/03/388056303.db2.gz OFDNJCZWQMEMAT-SDDRHHMPSA-N 2 0 212.381 2.256 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H]1CCc2cc(F)ccc21 ZINC000423276430 388058041 /nfs/dbraw/zinc/05/80/41/388058041.db2.gz ONEATSGUNRDBQJ-QMTHXVAHSA-N 2 0 236.334 2.258 20 0 BEADRP C(C1CC[NH2+]CC1)[N@@H+]1CCC[C@H]2CCC[C@H]21 ZINC000083701132 388058809 /nfs/dbraw/zinc/05/88/09/388058809.db2.gz IRPUNYSVHOHOHY-ZIAGYGMSSA-N 2 0 222.376 2.251 20 0 BEADRP CCC1CC([NH2+][C@@H]2CCCC[C@H]2C[NH3+])C1 ZINC000423277797 388058808 /nfs/dbraw/zinc/05/88/08/388058808.db2.gz OSSYDZKVWVZAKJ-PYNQCMFNSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@]1(C[N@@H+]2CCCC(C)(C)CC2)CC[NH2+]C1 ZINC000083680838 388058995 /nfs/dbraw/zinc/05/89/95/388058995.db2.gz YYQRMPYZLJSMLI-AWEZNQCLSA-N 2 0 224.392 2.498 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H]1CCc2cc(F)ccc21 ZINC000423276431 388059053 /nfs/dbraw/zinc/05/90/53/388059053.db2.gz ONEATSGUNRDBQJ-YGRLFVJLSA-N 2 0 236.334 2.258 20 0 BEADRP C[C@@]1(C[N@@H+]2CCCC(C)(C)CC2)CC[NH2+]C1 ZINC000083680837 388059603 /nfs/dbraw/zinc/05/96/03/388059603.db2.gz YYQRMPYZLJSMLI-CQSZACIVSA-N 2 0 224.392 2.498 20 0 BEADRP CCC[C@H]([NH2+]C[C@H](C)C[NH2+]C)c1cccnc1 ZINC000423279970 388061972 /nfs/dbraw/zinc/06/19/72/388061972.db2.gz TVRCPUJJHXQXHD-OCCSQVGLSA-N 2 0 235.375 2.368 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H](C1CC1)C1CCCC1 ZINC000423283117 388065050 /nfs/dbraw/zinc/06/50/50/388065050.db2.gz XFRSNHLYAAVQPN-RISCZKNCSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]C[C@@H]1C[C@H]1C1CC1 ZINC000453382595 388065425 /nfs/dbraw/zinc/06/54/25/388065425.db2.gz ZGAWKLKUJCFQBH-GCPZOVCVSA-N 2 0 236.403 2.351 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C[C@@H]2C[C@H]2C2CC2)[C@@H]2CCC[C@H]21 ZINC000453382901 388065900 /nfs/dbraw/zinc/06/59/00/388065900.db2.gz LXBFBWLBWXKZJU-UVPYHEFZSA-N 2 0 248.414 2.495 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCCC[C@H]1C[NH3+])[C@H]1C[C@H]1C ZINC000423285228 388068310 /nfs/dbraw/zinc/06/83/10/388068310.db2.gz YBASZRXTOPYMDA-QNWJLWSRSA-N 2 0 210.365 2.138 20 0 BEADRP Cc1ccsc1[C@H](C)[NH2+]CC(C)(C)[NH3+] ZINC000423286285 388071184 /nfs/dbraw/zinc/07/11/84/388071184.db2.gz GKPYGOTYKLBCLK-VIFPVBQESA-N 2 0 212.362 2.444 20 0 BEADRP CC(C)([NH3+])C[NH2+][C@@H]1CCC[C@H]1CCCF ZINC000423290182 388074450 /nfs/dbraw/zinc/07/44/50/388074450.db2.gz ZIJJRBFPKYTDOD-WDEREUQCSA-N 2 0 216.344 2.232 20 0 BEADRP CCO[C@H]1C[C@@H]([NH2+]CC(C)(C)[NH3+])C12CCCC2 ZINC000423289593 388074571 /nfs/dbraw/zinc/07/45/71/388074571.db2.gz XUQKDOFLRKUHPN-NEPJUHHUSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H]([NH2+]CCCC[N@H+](C)C1CC1)[C@H]1CCCO1 ZINC000453404811 388074716 /nfs/dbraw/zinc/07/47/16/388074716.db2.gz PYVSDSJOSBWNOL-TZMCWYRMSA-N 2 0 240.391 2.018 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc(F)cc1 ZINC000084217748 388075270 /nfs/dbraw/zinc/07/52/70/388075270.db2.gz ADVNANUONCYZQX-AAEUAGOBSA-N 2 0 222.307 2.043 20 0 BEADRP C[C@H]([NH2+]CCCC[N@H+](C)C1CC1)[C@@H]1CCCO1 ZINC000453404809 388075363 /nfs/dbraw/zinc/07/53/63/388075363.db2.gz PYVSDSJOSBWNOL-JSGCOSHPSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H](C)c1ccc2c(c1)CCC2 ZINC000423294442 388076891 /nfs/dbraw/zinc/07/68/91/388076891.db2.gz BYUKXNVXSJSLGB-NEPJUHHUSA-N 2 0 232.371 2.421 20 0 BEADRP C[C@H]1CCC[C@@H](C[NH+]2CCC(C[NH3+])CC2)C1 ZINC000084344481 388076911 /nfs/dbraw/zinc/07/69/11/388076911.db2.gz JXMQOBJKNWUKKV-GXTWGEPZSA-N 2 0 224.392 2.483 20 0 BEADRP c1cc2c(s1)CC[N@@H+](CC[C@H]1CC[NH2+]C1)C2 ZINC000084384479 388077309 /nfs/dbraw/zinc/07/73/09/388077309.db2.gz BDLVZPQVRPNTPG-LLVKDONJSA-N 2 0 236.384 2.106 20 0 BEADRP c1ccc2c(c1)C[NH+](CC[C@@H]1CC[NH2+]C1)C2 ZINC000084385684 388077796 /nfs/dbraw/zinc/07/77/96/388077796.db2.gz IMURBVYVXGBTRE-LBPRGKRZSA-N 2 0 216.328 2.002 20 0 BEADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@H]2CCOC[C@H]2C)cc1 ZINC000423296460 388078283 /nfs/dbraw/zinc/07/82/83/388078283.db2.gz ZHNRDBPMJMFMON-XUJVJEKNSA-N 2 0 248.370 2.221 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H]1CC(C)(C)Cc2occc21 ZINC000423297008 388078539 /nfs/dbraw/zinc/07/85/39/388078539.db2.gz IIZCPLGCAQHSPI-PWSUYJOCSA-N 2 0 236.359 2.478 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@@H](C)c1cc(F)cc(F)c1 ZINC000423296662 388078769 /nfs/dbraw/zinc/07/87/69/388078769.db2.gz HGZUQJIRCQPNRD-IUCAKERBSA-N 2 0 228.286 2.210 20 0 BEADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H]2CCOC[C@@H]2C)cc1 ZINC000423296457 388078961 /nfs/dbraw/zinc/07/89/61/388078961.db2.gz ZHNRDBPMJMFMON-SLEUVZQESA-N 2 0 248.370 2.221 20 0 BEADRP CCc1ccc([C@H](C)[NH2+]C[C@@H](C)C[NH3+])o1 ZINC000423297624 388079598 /nfs/dbraw/zinc/07/95/98/388079598.db2.gz LCFHJAGHBNUADB-UWVGGRQHSA-N 2 0 210.321 2.087 20 0 BEADRP CC[C@H]([NH2+]C[C@@H](C)C[NH3+])c1cccc(OC)c1 ZINC000423297489 388080108 /nfs/dbraw/zinc/08/01/08/388080108.db2.gz KNBIJURYJRTRNM-FZMZJTMJSA-N 2 0 236.359 2.331 20 0 BEADRP CCc1ccc([C@@H](C)[NH2+]C[C@H](C)C[NH3+])o1 ZINC000423297623 388080139 /nfs/dbraw/zinc/08/01/39/388080139.db2.gz LCFHJAGHBNUADB-NXEZZACHSA-N 2 0 210.321 2.087 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H]1CCC1(C)C ZINC000336658814 388080180 /nfs/dbraw/zinc/08/01/80/388080180.db2.gz BGFNFGGZFFWHCA-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP C[N@H+](CCCC[NH2+]Cc1ccccn1)C1CC1 ZINC000453590074 388087221 /nfs/dbraw/zinc/08/72/21/388087221.db2.gz AFXAEPVUWILSCC-UHFFFAOYSA-N 2 0 233.359 2.046 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+]CCCC[N@H+](C)C1CC1 ZINC000453593809 388088752 /nfs/dbraw/zinc/08/87/52/388088752.db2.gz HSZOLIWMWXNPRL-VXGBXAGGSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H](C[NH2+][C@@H](C)CCC[NH3+])CC(F)(F)F ZINC000396922144 388101263 /nfs/dbraw/zinc/10/12/63/388101263.db2.gz GSFTUUXWYWCTFP-BDAKNGLRSA-N 2 0 226.286 2.292 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]Cc2ccc(F)cc2)C1 ZINC000086401984 388101630 /nfs/dbraw/zinc/10/16/30/388101630.db2.gz DUWYZRDMEYIYJF-OLZOCXBDSA-N 2 0 222.307 2.185 20 0 BEADRP CC1(C)C[C@@H]1[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000086494431 388103802 /nfs/dbraw/zinc/10/38/02/388103802.db2.gz AWTLYUULITXOEX-XQHKEYJVSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]CC2CC[NH2+]CC2)[C@@H]1C ZINC000086700258 388106460 /nfs/dbraw/zinc/10/64/60/388106460.db2.gz MZTMHQJBPGWXOD-BZPMIXESSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CC2CC[NH2+]CC2)[C@H](C)C1 ZINC000086701222 388106534 /nfs/dbraw/zinc/10/65/34/388106534.db2.gz VMBMDUPHVVPXNB-BZPMIXESSA-N 2 0 224.392 2.400 20 0 BEADRP C(C[NH2+][C@@H]1CCCOCC1)C[NH+]1CCCCC1 ZINC000086869869 388109307 /nfs/dbraw/zinc/10/93/07/388109307.db2.gz ZMZPAKIURSMHCS-CQSZACIVSA-N 2 0 240.391 2.021 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@H]1CCC[C@H]1CCCF ZINC000423266954 388045510 /nfs/dbraw/zinc/04/55/10/388045510.db2.gz FACRDQBSYQZYNE-XQQFMLRXSA-N 2 0 230.371 2.478 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H]1[C@H](C)CCC[C@@H]1C ZINC000423269136 388047089 /nfs/dbraw/zinc/04/70/89/388047089.db2.gz GSHSMNARHZMQGW-NDBYEHHHSA-N 2 0 212.381 2.256 20 0 BEADRP CCC1(CC)[C@H]([NH2+]C[C@H](C)C[NH2+]C)C[C@@H]1OC ZINC000423268705 388047882 /nfs/dbraw/zinc/04/78/82/388047882.db2.gz GGLDMSWZTQKQCD-UPJWGTAASA-N 2 0 242.407 2.025 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H](C)c1ccc(F)cc1 ZINC000423269494 388048222 /nfs/dbraw/zinc/04/82/22/388048222.db2.gz GYZPQRGSXIXRJB-WDEREUQCSA-N 2 0 224.323 2.332 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H]1CCCOc2ccccc21 ZINC000423269576 388048825 /nfs/dbraw/zinc/04/88/25/388048825.db2.gz HFSCRIKNXMXSKD-OCCSQVGLSA-N 2 0 248.370 2.345 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCC[NH2+]CC1)C1CCC1 ZINC000324875045 388125856 /nfs/dbraw/zinc/12/58/56/388125856.db2.gz CPDSLZNPEKIOKM-OLZOCXBDSA-N 2 0 210.365 2.297 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H]2CSC[C@H]2C)C1 ZINC000449095306 388141380 /nfs/dbraw/zinc/14/13/80/388141380.db2.gz XQSKYQIGFNPCGJ-UPJWGTAASA-N 2 0 242.432 2.059 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H](CCO)C(C)(C)C ZINC000191822529 388254662 /nfs/dbraw/zinc/25/46/62/388254662.db2.gz DUXXPCUFABYOLQ-ZDUSSCGKSA-N 2 0 244.423 2.105 20 0 BEADRP Cc1nocc1C[NH2+]C(C)(C)CCC[NH+](C)C ZINC000449529278 388225538 /nfs/dbraw/zinc/22/55/38/388225538.db2.gz WBCKXRHIBVYJSX-UHFFFAOYSA-N 2 0 239.363 2.193 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](C)c1nccs1 ZINC000336662362 388260162 /nfs/dbraw/zinc/26/01/62/388260162.db2.gz CKAAWGCLKWEHFE-UWVGGRQHSA-N 2 0 227.377 2.311 20 0 BEADRP CCC[NH+]1CCC([NH2+]CCSCC)CC1 ZINC000164832409 388248070 /nfs/dbraw/zinc/24/80/70/388248070.db2.gz XWBKWTHQRZNRBG-UHFFFAOYSA-N 2 0 230.421 2.204 20 0 BEADRP Cc1cnccc1C[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000294947392 388406972 /nfs/dbraw/zinc/40/69/72/388406972.db2.gz DCJZHYCPMOJGSZ-UHFFFAOYSA-N 2 0 247.386 2.212 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]C[C@H]2CC=CCC2)C1 ZINC000086403866 388347908 /nfs/dbraw/zinc/34/79/08/388347908.db2.gz LBVQOGFBKHIEDX-XQQFMLRXSA-N 2 0 208.349 2.202 20 0 BEADRP C[C@H](C[NH3+])N[C@H](C)c1ccccc1Cl ZINC000235462503 388369311 /nfs/dbraw/zinc/36/93/11/388369311.db2.gz OMQLTOPIIIIVIW-RKDXNWHRSA-N 2 0 212.724 2.338 20 0 BEADRP Cc1ccc(CCC[NH2+][C@H](C)C[C@@H](C)[NH3+])cn1 ZINC000572721726 388370937 /nfs/dbraw/zinc/37/09/37/388370937.db2.gz BVONCVDYMLCBQJ-DGCLKSJQSA-N 2 0 235.375 2.038 20 0 BEADRP CC[NH2+]CCC[NH2+]C1CCC2(CC2)CC1 ZINC000572749253 388373809 /nfs/dbraw/zinc/37/38/09/388373809.db2.gz MUBGTIGBJRYWFJ-UHFFFAOYSA-N 2 0 210.365 2.298 20 0 BEADRP C[C@@H]1C[C@H](C[NH3+])C[N@@H+]1C[C@H]1CCC(F)(F)C1 ZINC000300799601 388394611 /nfs/dbraw/zinc/39/46/11/388394611.db2.gz CTRMBHOSIKMXJO-OUAUKWLOSA-N 2 0 232.318 2.091 20 0 BEADRP CCC(C)(C)OCC[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000308550698 388442533 /nfs/dbraw/zinc/44/25/33/388442533.db2.gz WONAKGMROFODTE-STQMWFEESA-N 2 0 242.407 2.264 20 0 BEADRP CCC[C@@H]([NH2+]CCOCC[NH+](C)C)C1CCC1 ZINC000322715989 388444529 /nfs/dbraw/zinc/44/45/29/388444529.db2.gz RYISLPVHCMCTCX-CQSZACIVSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@H]([NH3+])[C@H]1CCCC[N@@H+]1CCCCCF ZINC000336674026 388461304 /nfs/dbraw/zinc/46/13/04/388461304.db2.gz GYPLAGBCPJIJTE-NWDGAFQWSA-N 2 0 216.344 2.328 20 0 BEADRP CCOc1ccc([C@H](C)[NH2+]C[C@@H](C)C[NH3+])cc1 ZINC000336705562 388465091 /nfs/dbraw/zinc/46/50/91/388465091.db2.gz LCOPWXNACSVPQR-RYUDHWBXSA-N 2 0 236.359 2.331 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCC[NH3+])c2ccccc21 ZINC000336719746 388468083 /nfs/dbraw/zinc/46/80/83/388468083.db2.gz ZCMVZNSAVOSVEX-MFKMUULPSA-N 2 0 204.317 2.173 20 0 BEADRP Cc1cnccc1C[NH2+]C[C@H](C)C[NH+]1CCCC1 ZINC000296413382 388422548 /nfs/dbraw/zinc/42/25/48/388422548.db2.gz MDWYCZJWDFHFBK-ZDUSSCGKSA-N 2 0 247.386 2.212 20 0 BEADRP CCC[C@H](C[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@@H]1C)OC ZINC000356333486 388547840 /nfs/dbraw/zinc/54/78/40/388547840.db2.gz LDCBHIKUWFPZAU-IGQOVBAYSA-N 2 0 242.407 2.120 20 0 BEADRP F[C@@H]1CCC[C@@H]1N[C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000340529474 388493103 /nfs/dbraw/zinc/49/31/03/388493103.db2.gz JVIAENNPGYMVAX-RVMXOQNASA-N 2 0 226.339 2.093 20 0 BEADRP C1[C@@H]2C[C@@H]([NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)C[C@H]12 ZINC000397749360 388496389 /nfs/dbraw/zinc/49/63/89/388496389.db2.gz OQNQRWGVYOPSGC-XVIXHAIJSA-N 2 0 220.360 2.001 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@@H](C)[N@H+](C)C[C@H]2C)CS1 ZINC000397796016 388499758 /nfs/dbraw/zinc/49/97/58/388499758.db2.gz ANLLFKJMHIAKMH-NJMOYASZSA-N 2 0 242.432 2.199 20 0 BEADRP C[C@H]1CCCC[C@@H]1C[NH+]1CCC(C[NH3+])CC1 ZINC000346688371 388520139 /nfs/dbraw/zinc/52/01/39/388520139.db2.gz NPVJTAPAAHBSGS-GXTWGEPZSA-N 2 0 224.392 2.483 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]C[C@@H]2CCC(F)(F)C2)C1 ZINC000516877923 388522030 /nfs/dbraw/zinc/52/20/30/388522030.db2.gz RAMYPWFOMRYABP-GMTAPVOTSA-N 2 0 232.318 2.281 20 0 BEADRP CC[C@H]1CCC[C@@H](C[NH2+][C@H]2CC[NH2+]C2)C1 ZINC000516878616 388522075 /nfs/dbraw/zinc/52/20/75/388522075.db2.gz QLCFCVGOBWXTGT-XQQFMLRXSA-N 2 0 210.365 2.154 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+][C@@H](C)Cc1ccsc1 ZINC000516958065 388528982 /nfs/dbraw/zinc/52/89/82/388528982.db2.gz YNKHQQNHILPZAV-JQWIXIFHSA-N 2 0 226.389 2.252 20 0 BEADRP CC[C@]1(C)CC[N@H+](CCC2CC[NH2+]CC2)C1 ZINC000359192481 388555863 /nfs/dbraw/zinc/55/58/63/388555863.db2.gz PKWHINSKKVKAIA-CQSZACIVSA-N 2 0 224.392 2.498 20 0 BEADRP CO[C@H](C[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21)C(C)C ZINC000362975011 388561480 /nfs/dbraw/zinc/56/14/80/388561480.db2.gz CZGUXIHUSHUSFI-RBSFLKMASA-N 2 0 248.370 2.392 20 0 BEADRP CO[C@H](C[NH2+][C@H]1C[C@H]([NH3+])c2ccccc21)C(C)C ZINC000362975013 388562325 /nfs/dbraw/zinc/56/23/25/388562325.db2.gz CZGUXIHUSHUSFI-SOUVJXGZSA-N 2 0 248.370 2.392 20 0 BEADRP CCCC[NH2+][C@@H]1CC[N@H+](C)[C@H]2CCC[C@@H]21 ZINC000367621441 388566192 /nfs/dbraw/zinc/56/61/92/388566192.db2.gz SXDORDIQVCYDBG-UPJWGTAASA-N 2 0 210.365 2.249 20 0 BEADRP CCC[C@@H]1CN(CCC[NH+](CC)CC)CCO1 ZINC000191817020 388670338 /nfs/dbraw/zinc/67/03/38/388670338.db2.gz UUSSBXOCRPQXHK-CQSZACIVSA-N 2 0 242.407 2.219 20 0 BEADRP CC1=CC[C@H]([NH2+]C[C@@H]2CCC[N@@H+](C)C2)CC1 ZINC000552117516 388670398 /nfs/dbraw/zinc/67/03/98/388670398.db2.gz PPZPIWQILHKFIS-KBPBESRZSA-N 2 0 222.376 2.417 20 0 BEADRP CC1(C)CCC[C@@H]1[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000530177319 388621339 /nfs/dbraw/zinc/62/13/39/388621339.db2.gz FYBJECJREZRIJO-RYUDHWBXSA-N 2 0 222.376 2.439 20 0 BEADRP Fc1ccc(CN[C@@H]2CC[NH2+]C23CCC3)cc1 ZINC000530177786 388621602 /nfs/dbraw/zinc/62/16/02/388621602.db2.gz UVCXLCLGUGKQNA-CYBMUJFWSA-N 2 0 234.318 2.200 20 0 BEADRP C[C@@H](CC1CC1)[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000530178832 388621660 /nfs/dbraw/zinc/62/16/60/388621660.db2.gz OKRLVJDNBWOOSB-JQWIXIFHSA-N 2 0 208.349 2.049 20 0 BEADRP CC1CCC([NH2+][C@@H]2CC[NH2+]C23CCC3)CC1 ZINC000530179655 388623205 /nfs/dbraw/zinc/62/32/05/388623205.db2.gz ZRGRVGDJABHNRD-WXRRBKDZSA-N 2 0 222.376 2.439 20 0 BEADRP CC1(C)CC(C[N@@H+]2CCC[C@@H](C[NH3+])C2)C1 ZINC000530213047 388627754 /nfs/dbraw/zinc/62/77/54/388627754.db2.gz UGYLJVIGPUNHIN-NSHDSACASA-N 2 0 210.365 2.093 20 0 BEADRP C([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)[C@H]1CC[C@@H]2C[C@@H]2C1 ZINC000530212994 388627798 /nfs/dbraw/zinc/62/77/98/388627798.db2.gz TVIUHUXODJDBFN-LCLNTYCWSA-N 2 0 234.387 2.295 20 0 BEADRP CCC[C@H](C[NH2+][C@@H]1CC[NH2+]CC[C@@H]1C)OCC ZINC000530212610 388627908 /nfs/dbraw/zinc/62/79/08/388627908.db2.gz RDBPGNMVAGONMS-BFHYXJOUSA-N 2 0 242.407 2.169 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CCCC1(C)C)C1C[NH2+]C1 ZINC000530210027 388627993 /nfs/dbraw/zinc/62/79/93/388627993.db2.gz KIJLVLLOFDPYBS-AAEUAGOBSA-N 2 0 224.392 2.400 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[NH2+]C12CCC2)[C@@H]1C[C@@H]1C ZINC000530216141 388630309 /nfs/dbraw/zinc/63/03/09/388630309.db2.gz MVYIMMVHRFWUKG-QNWHQSFQSA-N 2 0 222.376 2.295 20 0 BEADRP C1CC([C@@H]2CC[C@H]2[NH2+][C@H]2CC[NH2+]C23CCC3)C1 ZINC000530218137 388630730 /nfs/dbraw/zinc/63/07/30/388630730.db2.gz VRYOIYBVXHVECZ-MJBXVCDLSA-N 2 0 234.387 2.439 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[NH2+]C12CCC2)[C@H]1CC1(C)C ZINC000530217644 388630793 /nfs/dbraw/zinc/63/07/93/388630793.db2.gz URYMNCVXKJUVGO-QJPTWQEYSA-N 2 0 222.376 2.295 20 0 BEADRP CC1(C)CC(C[N@@H+]2C[C@@H]3CCC[C@@H]([NH3+])[C@H]3C2)C1 ZINC000530217094 388630886 /nfs/dbraw/zinc/63/08/86/388630886.db2.gz FIGDJMSYWHYERA-MELADBBJSA-N 2 0 236.403 2.482 20 0 BEADRP C[C@@H]1CC(F)(F)CC[N@@H+]1CC[C@H]1CC[NH2+]C1 ZINC000530233636 388637277 /nfs/dbraw/zinc/63/72/77/388637277.db2.gz ZJKAFZUQXFLUQI-GHMZBOCLSA-N 2 0 232.318 2.106 20 0 BEADRP C[C@H](C[C@H]1CCC[NH2+]1)[NH2+]C[C@H](C)c1ccncc1 ZINC000530242717 388638420 /nfs/dbraw/zinc/63/84/20/388638420.db2.gz CTIUGBLDDHKXOK-GZBFAFLISA-N 2 0 247.386 2.305 20 0 BEADRP C[C@H](C[NH2+]C[C@H]1CC[NH2+][C@H](C)C1)c1ccncc1 ZINC000530244368 388638821 /nfs/dbraw/zinc/63/88/21/388638821.db2.gz KPDBKKFQYBDFNN-MCIONIFRSA-N 2 0 247.386 2.163 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[NH2+]C12CCC2)C1CCC1 ZINC000530244974 388639158 /nfs/dbraw/zinc/63/91/58/388639158.db2.gz RLHLYPLSHTUOKB-PWSUYJOCSA-N 2 0 208.349 2.049 20 0 BEADRP COc1ccc(C[N@@H+]2CC[C@](C)(C[NH3+])C2)cc1C ZINC000261554950 388649216 /nfs/dbraw/zinc/64/92/16/388649216.db2.gz BDBBDAJZYOYZMX-OAHLLOKOSA-N 2 0 248.370 2.174 20 0 BEADRP CCOCCCC[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@H]1C ZINC000246871928 388654025 /nfs/dbraw/zinc/65/40/25/388654025.db2.gz DMWNNKBDYCGZJE-MGPQQGTHSA-N 2 0 242.407 2.121 20 0 BEADRP COCC[C@@H](C)[NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1 ZINC000247030583 388657320 /nfs/dbraw/zinc/65/73/20/388657320.db2.gz NOLJLDROLZGZEV-ZIAGYGMSSA-N 2 0 242.407 2.121 20 0 BEADRP CC[C@@H](C)[NH+](C)CCOCC[N@@H+](C)[C@H](C)CC ZINC000247177812 388659864 /nfs/dbraw/zinc/65/98/64/388659864.db2.gz VRNHFRHCOCSYRN-ZIAGYGMSSA-N 2 0 244.423 2.464 20 0 BEADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+]C[C@@H]2CCSC2)C1 ZINC000224396812 388664007 /nfs/dbraw/zinc/66/40/07/388664007.db2.gz IWYPRVVTNGZCAG-STQMWFEESA-N 2 0 242.432 2.059 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]C[C@H]2CCCCS2)C1 ZINC000250865001 388741614 /nfs/dbraw/zinc/74/16/14/388741614.db2.gz RBYJKEDBDWLPGK-GRYCIOLGSA-N 2 0 228.405 2.132 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]C[C@H]2CCCCS2)C1 ZINC000250865002 388741626 /nfs/dbraw/zinc/74/16/26/388741626.db2.gz RBYJKEDBDWLPGK-IJLUTSLNSA-N 2 0 228.405 2.132 20 0 BEADRP C[C@H](CC1CC1)[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000251214396 388745728 /nfs/dbraw/zinc/74/57/28/388745728.db2.gz NCHMNIFHVAOTIW-BNOWGMLFSA-N 2 0 222.376 2.391 20 0 BEADRP COC[C@H]([NH2+]CC[C@H]1CCCC[N@@H+]1C)C(C)C ZINC000086700187 388691031 /nfs/dbraw/zinc/69/10/31/388691031.db2.gz IBXWHIZYGKGFTE-KGLIPLIRSA-N 2 0 242.407 2.121 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)CCC2CC2)C1 ZINC000248975924 388702336 /nfs/dbraw/zinc/70/23/36/388702336.db2.gz HRAVQMJECHFJET-TZMCWYRMSA-N 2 0 224.392 2.497 20 0 BEADRP CCSCCC[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000228809518 388774421 /nfs/dbraw/zinc/77/44/21/388774421.db2.gz UUSDBDCPOYMSRM-RYUDHWBXSA-N 2 0 230.421 2.202 20 0 BEADRP COC(C)(C)C[N@H+](C)Cc1cccc2nccn21 ZINC000553521472 388780843 /nfs/dbraw/zinc/78/08/43/388780843.db2.gz BTPBMTPAQOQHAI-UHFFFAOYSA-N 2 0 247.342 2.191 20 0 BEADRP C[C@@H](NC[C@H](C)C[NH+](C)C)c1ccc(F)cn1 ZINC000293616288 388854631 /nfs/dbraw/zinc/85/46/31/388854631.db2.gz JJUJGCBHDCXUJA-WDEREUQCSA-N 2 0 239.338 2.069 20 0 BEADRP CC1(C)CC[C@H]([NH2+]CC[C@H]2CCC[NH2+]2)C1 ZINC000129535797 388851040 /nfs/dbraw/zinc/85/10/40/388851040.db2.gz HWWTUAUDBQDKLB-NEPJUHHUSA-N 2 0 210.365 2.297 20 0 BEADRP CCC[NH2+]CC[NH2+][C@H](C)C(C)(C)CC ZINC000565710348 388964902 /nfs/dbraw/zinc/96/49/02/388964902.db2.gz HBBSYAIMOYPBHZ-LLVKDONJSA-N 2 0 200.370 2.400 20 0 BEADRP COc1ccc(C[NH2+][C@@H](C)C[C@@H](C)[NH3+])c(C)c1 ZINC000565593360 388955734 /nfs/dbraw/zinc/95/57/34/388955734.db2.gz SRNHCQXACXKSRR-NEPJUHHUSA-N 2 0 236.359 2.219 20 0 BEADRP CCC(C)(C)[C@@H](C)[NH2+]C[C@]1(COC)CCC[NH2+]1 ZINC000566062622 388984089 /nfs/dbraw/zinc/98/40/89/388984089.db2.gz RZWVZGUKXMPBGG-OCCSQVGLSA-N 2 0 242.407 2.169 20 0 BEADRP Cc1ccc(C[NH2+]CC2=CC[N@H+](C)CC2)cc1F ZINC000271819308 389026105 /nfs/dbraw/zinc/02/61/05/389026105.db2.gz MNRRSKJXFRZMMI-UHFFFAOYSA-N 2 0 248.345 2.486 20 0 BEADRP C([NH2+][C@@H]1CCCC12CCC2)[C@H]1CCC[NH2+]1 ZINC000335128254 533368735 /nfs/dbraw/zinc/36/87/35/533368735.db2.gz GHDFMJRELIIYNO-VXGBXAGGSA-N 2 0 208.349 2.051 20 0 BEADRP C[C@@H]([NH2+]CCC1CCCC1)[C@H]1CCC[NH2+]1 ZINC000400668828 533374099 /nfs/dbraw/zinc/37/40/99/533374099.db2.gz UBUZJGIKZCGJPH-DGCLKSJQSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]([NH2+]CCCC(F)(F)F)[C@H]1CCC[NH2+]1 ZINC000400607301 533376596 /nfs/dbraw/zinc/37/65/96/533376596.db2.gz XUVRAHYPFRJQNL-RKDXNWHRSA-N 2 0 224.270 2.059 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCCC[C@H]1C)[C@@H]1CCC[NH2+]1 ZINC000400368644 533540752 /nfs/dbraw/zinc/54/07/52/533540752.db2.gz GAMKZSUXASMUTL-NDBYEHHHSA-N 2 0 210.365 2.295 20 0 BEADRP Cc1cc(N2CCC([C@H]3CCC[NH2+]3)CC2)cc[nH+]1 ZINC000162878659 132233713 /nfs/dbraw/zinc/23/37/13/132233713.db2.gz YMLCLDGNUSJQRG-OAHLLOKOSA-N 2 0 245.370 2.358 20 0 BEADRP C[C@H](Cc1ccccc1F)[NH2+]CCCC[NH3+] ZINC000162531461 133521061 /nfs/dbraw/zinc/52/10/61/133521061.db2.gz XGISKUHHYGPETB-LLVKDONJSA-N 2 0 224.323 2.085 20 0 BEADRP C[C@H]1CC(C)(C)C[C@@H]1[NH2+]CC1=CC[NH2+]CC1 ZINC000335502112 133868742 /nfs/dbraw/zinc/86/87/42/133868742.db2.gz VUSNKGMPXMVXQC-AAEUAGOBSA-N 2 0 222.376 2.320 20 0 BEADRP Fc1ccc2c(c1)CC[C@@H]2[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000335523195 133874902 /nfs/dbraw/zinc/87/49/02/133874902.db2.gz XMUSSNDKLVDOMY-ABAIWWIYSA-N 2 0 248.345 2.402 20 0 BEADRP C[C@]1(C[NH2+][C@@H]2CCC23CCC3)CCC[NH2+]C1 ZINC000335486505 133882141 /nfs/dbraw/zinc/88/21/41/133882141.db2.gz HEMROZIZAVYCEE-OLZOCXBDSA-N 2 0 222.376 2.298 20 0 BEADRP C[C@@H]1CCSCC[N@@H+]1CC[C@@H]1CCC[NH+]1C ZINC000335938086 134013042 /nfs/dbraw/zinc/01/30/42/134013042.db2.gz OAFKSKFMSOHTBF-OLZOCXBDSA-N 2 0 242.432 2.298 20 0 BEADRP C[C@@H](F)CC[N@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000352050002 134046185 /nfs/dbraw/zinc/04/61/85/134046185.db2.gz PHZKIIJNTKAAHR-NEPJUHHUSA-N 2 0 216.344 2.008 20 0 BEADRP c1nc2c([nH]1)C[C@H]([NH2+][C@H]1CCC13CCC3)CC2 ZINC000336003073 134048146 /nfs/dbraw/zinc/04/81/46/134048146.db2.gz OTIDYXKKXMOUKO-MFKMUULPSA-N 2 0 231.343 2.189 20 0 BEADRP C[C@@H](F)CC[N@@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000352051355 134048197 /nfs/dbraw/zinc/04/81/97/134048197.db2.gz ZJQXEEBMTKIPAA-OLZOCXBDSA-N 2 0 228.355 2.152 20 0 BEADRP C[N@@H+]1CC[C@@]2(CC[NH+](CC3CCCC3)C2)C1 ZINC000336125088 134092600 /nfs/dbraw/zinc/09/26/00/134092600.db2.gz ZUDGLIKITDRSEW-CQSZACIVSA-N 2 0 222.376 2.204 20 0 BEADRP [NH3+]CCCC[NH2+][C@H]1Cc2ccc(Cl)cc2C1 ZINC000168082541 134156350 /nfs/dbraw/zinc/15/63/50/134156350.db2.gz VDYCIKIAFHFMEC-ZDUSSCGKSA-N 2 0 238.762 2.136 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[NH2+]CC1)c1ccccc1 ZINC000168693357 134242372 /nfs/dbraw/zinc/24/23/72/134242372.db2.gz KFZULCLPVQNGFO-GXTWGEPZSA-N 2 0 218.344 2.479 20 0 BEADRP CSCCC[NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000169242121 134250016 /nfs/dbraw/zinc/25/00/16/134250016.db2.gz ROIQVIAFHNZAHT-OLZOCXBDSA-N 2 0 236.384 2.474 20 0 BEADRP CCCCC[N@@H+]1CC[C@@H](C[NH+](C)CC)C1 ZINC000173891673 134278541 /nfs/dbraw/zinc/27/85/41/134278541.db2.gz FFTXQXQPLMJDOY-ZDUSSCGKSA-N 2 0 212.381 2.450 20 0 BEADRP CCC[C@@H]1CCC[N@H+](CC2CC[NH2+]CC2)C1 ZINC000178975661 134314054 /nfs/dbraw/zinc/31/40/54/134314054.db2.gz MIBSUYYMMUNVBV-CYBMUJFWSA-N 2 0 224.392 2.498 20 0 BEADRP C[N@H+](CC[C@H]1CCC[NH+]1C)C1CCCC1 ZINC000179239182 134318756 /nfs/dbraw/zinc/31/87/56/134318756.db2.gz IXKUXYOQJOSOBO-CYBMUJFWSA-N 2 0 210.365 2.345 20 0 BEADRP CCC(CC)C[N@@H+]1CC[C@H](C[NH+](C)C)C1 ZINC000179884865 134325151 /nfs/dbraw/zinc/32/51/51/134325151.db2.gz UTBFORRTNZPADB-CYBMUJFWSA-N 2 0 212.381 2.306 20 0 BEADRP CC1(C)C[C@@H]1C[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000222029089 134329395 /nfs/dbraw/zinc/32/93/95/134329395.db2.gz IPVXRFFYDJXAEH-FRRDWIJNSA-N 2 0 222.376 2.249 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CCC(F)(F)F)[C@@H](C)C1 ZINC000224510912 134348679 /nfs/dbraw/zinc/34/86/79/134348679.db2.gz YUTKJCWMDZNYID-VHSXEESVSA-N 2 0 238.297 2.259 20 0 BEADRP C[NH2+]C[C@H]1CC[N@H+](CCCC2CCCC2)C1 ZINC000226420552 134365722 /nfs/dbraw/zinc/36/57/22/134365722.db2.gz GTZAVXMUPXISKN-CQSZACIVSA-N 2 0 224.392 2.498 20 0 BEADRP C[NH+]1CCC(C)(C[NH2+]CC(C)(C)C)CC1 ZINC000227330068 134377921 /nfs/dbraw/zinc/37/79/21/134377921.db2.gz QYHPXMWEUIDEEQ-UHFFFAOYSA-N 2 0 212.381 2.354 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CC2(C)CC[NH+](C)CC2)C1 ZINC000227328944 134378041 /nfs/dbraw/zinc/37/80/41/134378041.db2.gz KLOCHTRTLXIZOI-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CC2(C)CC[NH+](C)CC2)C1 ZINC000227328958 134378250 /nfs/dbraw/zinc/37/82/50/134378250.db2.gz KLOCHTRTLXIZOI-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+]C1CCCCCC1 ZINC000234776841 134583655 /nfs/dbraw/zinc/58/36/55/134583655.db2.gz PFYWXYJXMCJQFH-ZDUSSCGKSA-N 2 0 228.380 2.053 20 0 BEADRP C1CC1C([NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)C1CC1 ZINC000130152631 134616759 /nfs/dbraw/zinc/61/67/59/134616759.db2.gz WPRNTUTZTOAJER-ZIAGYGMSSA-N 2 0 234.387 2.391 20 0 BEADRP C[C@H]([NH3+])C1CC[NH+](CCC(C)(C)C)CC1 ZINC000082474742 134970311 /nfs/dbraw/zinc/97/03/11/134970311.db2.gz ZRDQAEBHKKCWBW-NSHDSACASA-N 2 0 212.381 2.482 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+]CC1CC[NH+](C)CC1 ZINC000070828343 135014066 /nfs/dbraw/zinc/01/40/66/135014066.db2.gz HTPNMBAWTQQIKJ-YPMHNXCESA-N 2 0 210.365 2.106 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2cncc(C)c2)C1 ZINC000248754032 135020685 /nfs/dbraw/zinc/02/06/85/135020685.db2.gz UQXLZRBTYBDKIQ-ZIAGYGMSSA-N 2 0 247.386 2.382 20 0 BEADRP CC[NH+](CC)CCC[NH2+]C[C@H]1CCSC1 ZINC000163620095 135020927 /nfs/dbraw/zinc/02/09/27/135020927.db2.gz WCWJLNWPSCWMTD-GFCCVEGCSA-N 2 0 230.421 2.061 20 0 BEADRP Cc1c[nH+]ccc1N[C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000250877256 135060558 /nfs/dbraw/zinc/06/05/58/135060558.db2.gz QREUCTWCOMPDIR-OLZOCXBDSA-N 2 0 231.343 2.429 20 0 BEADRP CC[C@H](COC)[NH2+][C@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000251098698 135064547 /nfs/dbraw/zinc/06/45/47/135064547.db2.gz QSJINEJGWISMFN-MGPQQGTHSA-N 2 0 242.407 2.312 20 0 BEADRP C[C@H](CCCO)[NH2+][C@@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000251266004 135067140 /nfs/dbraw/zinc/06/71/40/135067140.db2.gz WSMNXFQKBUBUOV-HZSPNIEDSA-N 2 0 242.407 2.048 20 0 BEADRP CC[C@@H](C)C[N@@H+]1CC[C@@H](C[NH+](C)CC)C1 ZINC000246182599 135082507 /nfs/dbraw/zinc/08/25/07/135082507.db2.gz HDNZWWZZVXWBII-OLZOCXBDSA-N 2 0 212.381 2.306 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CCC[C@H]([NH3+])C2)s1 ZINC000086403901 135083545 /nfs/dbraw/zinc/08/35/45/135083545.db2.gz AOUQYENQOIZUFK-QWRGUYRKSA-N 2 0 224.373 2.416 20 0 BEADRP C[C@H]1CCC[N@H+](CC[C@H]2CCC[NH+]2C)C1 ZINC000246575503 135083581 /nfs/dbraw/zinc/08/35/81/135083581.db2.gz CEFHIKARRVAVCP-QWHCGFSZSA-N 2 0 210.365 2.203 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]Cc2ccsc2)C1 ZINC000086404139 135083681 /nfs/dbraw/zinc/08/36/81/135083681.db2.gz MKWDGXXQKGBXIT-MNOVXSKESA-N 2 0 210.346 2.108 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000252178632 135085919 /nfs/dbraw/zinc/08/59/19/135085919.db2.gz PNVTXFIWCYSUKC-VOAKCMCISA-N 2 0 210.365 2.425 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)CC(C)C)C1 ZINC000252439442 135088742 /nfs/dbraw/zinc/08/87/42/135088742.db2.gz ORTXDMHKCCWORW-CHWSQXEVSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H](C[C@H]1CCCCC[NH2+]1)[NH2+]C1CCC1 ZINC000086501047 135088713 /nfs/dbraw/zinc/08/87/13/135088713.db2.gz LCAUEIKESIDJIV-WCQYABFASA-N 2 0 210.365 2.439 20 0 BEADRP CC(C)C[C@H]([NH3+])C[NH+]1C[C@@H]2CCC[C@H]2C1 ZINC000252704342 135098356 /nfs/dbraw/zinc/09/83/56/135098356.db2.gz MUFUSUGQYSZHNN-AVGNSLFASA-N 2 0 210.365 2.092 20 0 BEADRP CC(C)CC[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000252672695 135108214 /nfs/dbraw/zinc/10/82/14/135108214.db2.gz CFDIWLMPNAIRDQ-STQMWFEESA-N 2 0 210.365 2.249 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+][C@H]2CCSC2)c2ccccc21 ZINC000261534319 135108981 /nfs/dbraw/zinc/10/89/81/135108981.db2.gz PVMIUVLZYTZYJK-BIMULSAOSA-N 2 0 234.368 2.226 20 0 BEADRP CC(C)CCC[N@@H+]1C[C@@H]2CCC[C@@H]([NH3+])[C@H]2C1 ZINC000252861906 135113969 /nfs/dbraw/zinc/11/39/69/135113969.db2.gz NSIDJBWTQFTMLK-MELADBBJSA-N 2 0 224.392 2.482 20 0 BEADRP Cc1cc(N[C@H]2CC[N@@H+]3CCC[C@H]3C2)cc[nH+]1 ZINC000252952353 135117929 /nfs/dbraw/zinc/11/79/29/135117929.db2.gz POBXYQPNWNRYIN-KBPBESRZSA-N 2 0 231.343 2.429 20 0 BEADRP Cc1cscc1C[NH2+][C@@H]1CCC[C@@H]1C[NH3+] ZINC000087309287 135121721 /nfs/dbraw/zinc/12/17/21/135121721.db2.gz QCAVPNNNLJUQGG-ZYHUDNBSSA-N 2 0 224.373 2.274 20 0 BEADRP Cc1ccsc1C[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000087308683 135121903 /nfs/dbraw/zinc/12/19/03/135121903.db2.gz DCMLLIWHCXKKSE-QWRGUYRKSA-N 2 0 224.373 2.416 20 0 BEADRP Cc1cscc1C[NH2+][C@@H]1CCC[C@H]1C[NH3+] ZINC000087309289 135122167 /nfs/dbraw/zinc/12/21/67/135122167.db2.gz QCAVPNNNLJUQGG-CMPLNLGQSA-N 2 0 224.373 2.274 20 0 BEADRP C[C@@H]1CC[N@H+](Cc2ccc(F)cc2)C[C@H]1C[NH3+] ZINC000253181246 135123022 /nfs/dbraw/zinc/12/30/22/135123022.db2.gz FEBDUFSVLGLESC-DGCLKSJQSA-N 2 0 236.334 2.242 20 0 BEADRP C[C@H]1CC[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)C1 ZINC000253278761 135125565 /nfs/dbraw/zinc/12/55/65/135125565.db2.gz JSPHJAIIQVNIML-WSOGJNRSSA-N 2 0 222.376 2.390 20 0 BEADRP Cc1csc(C[NH+]2CCC([C@H](C)[NH3+])CC2)n1 ZINC000087393584 135127492 /nfs/dbraw/zinc/12/74/92/135127492.db2.gz VLQSPACUCLLBRA-JTQLQIEISA-N 2 0 239.388 2.011 20 0 BEADRP C[C@H](c1ccccc1)[N@@H+]1CC[C@]2(CC[NH2+]C2)C1 ZINC000257690569 135139166 /nfs/dbraw/zinc/13/91/66/135139166.db2.gz JBACJOGWDMWQSV-HIFRSBDPSA-N 2 0 230.355 2.433 20 0 BEADRP C(C1CCCC1)[N@@H+]1CC[C@@]2(CCC[NH2+]2)C1 ZINC000257686827 135139439 /nfs/dbraw/zinc/13/94/39/135139439.db2.gz MLALDHNTQRQGGS-ZDUSSCGKSA-N 2 0 208.349 2.005 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@@H]1CCCC1(C)C ZINC000261530598 135157830 /nfs/dbraw/zinc/15/78/30/135157830.db2.gz CUFCAXXKWVDTMV-GRYCIOLGSA-N 2 0 210.365 2.153 20 0 BEADRP Cc1[nH+]ccc(NC[C@@H]([NH3+])C2CC2)c1Cl ZINC000261531410 135160261 /nfs/dbraw/zinc/16/02/61/135160261.db2.gz GJQMHAIWCMCUQH-SECBINFHSA-N 2 0 225.723 2.193 20 0 BEADRP C[C@@H]1CCC[N@H+](C[C@H]2CC[NH2+][C@H](C)C2)C1 ZINC000261531337 135160281 /nfs/dbraw/zinc/16/02/81/135160281.db2.gz GDUQVBUYTYSRJG-UPJWGTAASA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CCC[NH2+]C1)C1CCCC1 ZINC000087647315 135161371 /nfs/dbraw/zinc/16/13/71/135161371.db2.gz LYBKILNMIGMTHZ-NEPJUHHUSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1C[N@H+](CC2CCC(C)CC2)C[C@H]1[NH3+] ZINC000261531873 135161495 /nfs/dbraw/zinc/16/14/95/135161495.db2.gz IDYCQYCDURYUMF-POOIEITISA-N 2 0 210.365 2.092 20 0 BEADRP C[C@@H]1C[N@H+](C[C@H]2CCC[C@@H](C)C2)C[C@H]1[NH3+] ZINC000261531839 135161530 /nfs/dbraw/zinc/16/15/30/135161530.db2.gz IALMBPNPHJGOON-FVCCEPFGSA-N 2 0 210.365 2.092 20 0 BEADRP CC[C@@H]1CCC[N@H+](C[C@H]2CC[NH2+][C@@H](C)C2)C1 ZINC000261532729 135163102 /nfs/dbraw/zinc/16/31/02/135163102.db2.gz DIKLLNDKUDNXFW-MJBXVCDLSA-N 2 0 224.392 2.497 20 0 BEADRP CCC[N@H+](CC1CC1)C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000261534484 135166534 /nfs/dbraw/zinc/16/65/34/135166534.db2.gz REMWBNMXUDUQCZ-TZMCWYRMSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CCC[C@@H](C[NH2+]C[C@H]2CCC[NH2+]C2)C1 ZINC000261534323 135167112 /nfs/dbraw/zinc/16/71/12/135167112.db2.gz PVNWYCUYEUDGIX-MCIONIFRSA-N 2 0 224.392 2.402 20 0 BEADRP C[C@@H]1C[C@@H](C[N@@H+]2CCCC[C@H]2C)CC[NH2+]1 ZINC000261535303 135169311 /nfs/dbraw/zinc/16/93/11/135169311.db2.gz OBLVBDRSHHJVOE-UPJWGTAASA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+][C@H]1CCC(C)(C)C1 ZINC000261536360 135171194 /nfs/dbraw/zinc/17/11/94/135171194.db2.gz RJROZGJAIQMICC-GRYCIOLGSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@]1(C[NH2+][C@H]2CCCC[C@@H]2C[NH3+])CCCS1 ZINC000087792750 135171792 /nfs/dbraw/zinc/17/17/92/135171792.db2.gz FEZGHORLLIHIMT-FRRDWIJNSA-N 2 0 242.432 2.379 20 0 BEADRP CCC[C@@H]1C[C@@H]1[NH2+][C@H]1CCCC[C@@H]1C[NH3+] ZINC000261537908 135175089 /nfs/dbraw/zinc/17/50/89/135175089.db2.gz WQFKQQDPDDADMJ-NDBYEHHHSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]1C[C@H]([NH2+]C[C@H]2CCC[NH2+]2)C[C@@H](C)C1 ZINC000261538230 135175561 /nfs/dbraw/zinc/17/55/61/135175561.db2.gz XMZHASAWCUCKSG-XQHKEYJVSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@@H]1CC[N@H+](C[C@H]2CC[NH2+][C@@H](C)C2)C1 ZINC000261538471 135176570 /nfs/dbraw/zinc/17/65/70/135176570.db2.gz YFKGEZUVMPFYGK-XQQFMLRXSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1CCCC[N@H+](C[C@@H]2CCC[NH2+]C2)C1 ZINC000261539319 135178061 /nfs/dbraw/zinc/17/80/61/135178061.db2.gz CCRCMMGMJILHSB-CHWSQXEVSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@@H]1CC[C@H](C)C[N@H+]1CC1CC[NH2+]CC1 ZINC000084048140 135178287 /nfs/dbraw/zinc/17/82/87/135178287.db2.gz RNWBTYAMEAKDKT-NWDGAFQWSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC[NH2+]C[C@@H]1C)c1ccccc1 ZINC000261540468 135179258 /nfs/dbraw/zinc/17/92/58/135179258.db2.gz AGBXKHCZLDHUEK-IPYPFGDCSA-N 2 0 232.371 2.378 20 0 BEADRP C[C@]1(C[N@H+]2C[C@@H]3CCCC[C@@H]3C2)CC[NH2+]C1 ZINC000261540790 135180080 /nfs/dbraw/zinc/18/00/80/135180080.db2.gz FFMPQEXWABXQIV-MJBXVCDLSA-N 2 0 222.376 2.108 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CC[NH2+]CC2(C)C)cc1 ZINC000261543383 135183699 /nfs/dbraw/zinc/18/36/99/135183699.db2.gz DAUZKLWLPSGMHL-AWEZNQCLSA-N 2 0 232.371 2.473 20 0 BEADRP C[N@H+](C[C@H]1CCC[NH2+]C1)C1(C)CCCC1 ZINC000261543092 135184241 /nfs/dbraw/zinc/18/42/41/135184241.db2.gz HKMQICMORIHXTI-LBPRGKRZSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@H]1C[N@H+](C[C@H]2CCC[NH2+]C2)C(C)(C)C1 ZINC000261549142 135187938 /nfs/dbraw/zinc/18/79/38/135187938.db2.gz OGHKUTZUFXUHPX-NEPJUHHUSA-N 2 0 210.365 2.106 20 0 BEADRP Cc1ncsc1C[N@@H+]1CCC[C@H](CC[NH3+])C1 ZINC000084149533 135188366 /nfs/dbraw/zinc/18/83/66/135188366.db2.gz WTHQEFBVPJOPCM-LLVKDONJSA-N 2 0 239.388 2.012 20 0 BEADRP Cc1ncsc1C[N@@H+]1CCC[C@@H](CC[NH3+])C1 ZINC000084149534 135188440 /nfs/dbraw/zinc/18/84/40/135188440.db2.gz WTHQEFBVPJOPCM-NSHDSACASA-N 2 0 239.388 2.012 20 0 BEADRP C[C@H]1CCCC[N@H+](CC2CC[NH2+]CC2)C1 ZINC000261549497 135188613 /nfs/dbraw/zinc/18/86/13/135188613.db2.gz ORMCVSNPTSCJNU-LBPRGKRZSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@@H](C[N@@H+]1CC[C@@](C)(C[NH3+])C1)c1ccccc1 ZINC000261553594 135192737 /nfs/dbraw/zinc/19/27/37/135192737.db2.gz OBNHSEOTJIGQMB-ZFWWWQNUSA-N 2 0 232.371 2.461 20 0 BEADRP C[C@H](CC1CC1)[NH2+][C@H]1CCCC[C@@H]1C[NH3+] ZINC000084216925 135192844 /nfs/dbraw/zinc/19/28/44/135192844.db2.gz GFZOIPZEYWVBPU-RTXFEEFZSA-N 2 0 210.365 2.282 20 0 BEADRP Cc1[nH+]ccc(NC[C@H]2CCC[NH2+]C2)c1Cl ZINC000261560626 135202060 /nfs/dbraw/zinc/20/20/60/135202060.db2.gz ADWPGBGTFIQEDW-JTQLQIEISA-N 2 0 239.750 2.455 20 0 BEADRP CC(C)(C)CC[N@@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000261562065 135203787 /nfs/dbraw/zinc/20/37/87/135203787.db2.gz AYYIDMRVJBDPDB-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP Cc1nc(C)c(C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)s1 ZINC000261562669 135204029 /nfs/dbraw/zinc/20/40/29/135204029.db2.gz BMIOJCCBDGOZQC-WDEREUQCSA-N 2 0 239.388 2.119 20 0 BEADRP Cc1ncccc1CN(C)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000261562530 135204621 /nfs/dbraw/zinc/20/46/21/135204621.db2.gz GMHMIZYTAZLQTD-YIONKMFJSA-N 2 0 245.370 2.105 20 0 BEADRP Cc1cccc(C[N@@H+]2CC[C@@](C)(C[NH3+])C2)c1C ZINC000261565872 135207369 /nfs/dbraw/zinc/20/73/69/135207369.db2.gz YPUFJQBWKGSRHY-HNNXBMFYSA-N 2 0 232.371 2.474 20 0 BEADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]CCC(C)(C)O ZINC000261565387 135207924 /nfs/dbraw/zinc/20/79/24/135207924.db2.gz YHTZCBYCWZMHEN-OLZOCXBDSA-N 2 0 242.407 2.048 20 0 BEADRP Cc1ccsc1C[N@@H+]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000261568131 135210092 /nfs/dbraw/zinc/21/00/92/135210092.db2.gz FJIZEPMXSQVYJB-RYUDHWBXSA-N 2 0 236.384 2.098 20 0 BEADRP CC(C)([NH3+])C[NH2+][C@@H]1CCCc2ccccc21 ZINC000261569400 135210889 /nfs/dbraw/zinc/21/08/89/135210889.db2.gz GHIUYKLNWUAXBK-CYBMUJFWSA-N 2 0 218.344 2.391 20 0 BEADRP C[C@@H]1CCC[C@@H](C[N@@H+]2CC[C@@](C)(C[NH3+])C2)C1 ZINC000261571039 135213272 /nfs/dbraw/zinc/21/32/72/135213272.db2.gz HILKKQXIYFMPLT-MCIONIFRSA-N 2 0 224.392 2.483 20 0 BEADRP C[C@@H]1CCC[C@H](C[N@@H+]2CC[C@](C)(C[NH3+])C2)C1 ZINC000261571038 135213453 /nfs/dbraw/zinc/21/34/53/135213453.db2.gz HILKKQXIYFMPLT-HZSPNIEDSA-N 2 0 224.392 2.483 20 0 BEADRP Cc1cccc(C[NH2+][C@H]2CC[NH2+]C[C@@H]2C)c1 ZINC000261571596 135213928 /nfs/dbraw/zinc/21/39/28/135213928.db2.gz HOQAGQXZIZVGDP-JSGCOSHPSA-N 2 0 218.344 2.083 20 0 BEADRP Cc1cccc(C[NH2+][C@@H]2CC[NH2+]C[C@@H]2C)c1 ZINC000261571595 135213953 /nfs/dbraw/zinc/21/39/53/135213953.db2.gz HOQAGQXZIZVGDP-GXTWGEPZSA-N 2 0 218.344 2.083 20 0 BEADRP CCOc1cccc(C[NH2+][C@@H]2CC[NH2+]C[C@H]2C)c1 ZINC000261572565 135215279 /nfs/dbraw/zinc/21/52/79/135215279.db2.gz LSPMPVJPXHKCLD-IUODEOHRSA-N 2 0 248.370 2.173 20 0 BEADRP C[C@H]([NH3+])[C@H](C)[NH2+][C@H](c1ccccc1)C1CC1 ZINC000261575858 135216990 /nfs/dbraw/zinc/21/69/90/135216990.db2.gz JYGOBQLFRJOGFS-COPLHBTASA-N 2 0 218.344 2.463 20 0 BEADRP [NH3+][C@@H]1CC[C@H]2C[N@H+](CC3CCCCC3)C[C@@H]12 ZINC000261574644 135217038 /nfs/dbraw/zinc/21/70/38/135217038.db2.gz JKCGDQCQVPLBHE-BFHYXJOUSA-N 2 0 222.376 2.236 20 0 BEADRP CC(C)C[N@H+](CC[C@H]1CC[NH2+]C1)C1CC1 ZINC000084385385 135218116 /nfs/dbraw/zinc/21/81/16/135218116.db2.gz PMUOJAGHODZNSK-GFCCVEGCSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[N@H+](C)CC[C@@H]1CC[NH2+]C1 ZINC000084385431 135218343 /nfs/dbraw/zinc/21/83/43/135218343.db2.gz OTVUZVBOQLUANX-RDBSUJKOSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H](C[N@@H+]1CC[C@H]2C[NH2+]C[C@H]2C1)c1ccccc1 ZINC000261581335 135222316 /nfs/dbraw/zinc/22/23/16/135222316.db2.gz QPBQNOXPLLRNRL-KBMXLJTQSA-N 2 0 244.382 2.331 20 0 BEADRP C[C@H](C[N@@H+]1CC[C@@H]2[NH2+]CC[C@@H]2C1)c1ccccc1 ZINC000261581567 135222335 /nfs/dbraw/zinc/22/23/35/135222335.db2.gz QSNZEXOQHWFZSE-BMFZPTHFSA-N 2 0 244.382 2.474 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+][C@H]1CCc2ccccc2C1 ZINC000261584117 135225168 /nfs/dbraw/zinc/22/51/68/135225168.db2.gz SCKFFWXHOUAKSU-UHOFOFEASA-N 2 0 244.382 2.132 20 0 BEADRP C[NH2+]C[C@H]1CCCN1c1cc[nH+]c(C)c1Cl ZINC000261585112 135225817 /nfs/dbraw/zinc/22/58/17/135225817.db2.gz QENBLHFCAZQAQB-SNVBAGLBSA-N 2 0 239.750 2.232 20 0 BEADRP C(C1CCCCC1)[N@@H+]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000261584823 135226120 /nfs/dbraw/zinc/22/61/20/135226120.db2.gz QBAJWFPYERFNAI-KGLIPLIRSA-N 2 0 222.376 2.108 20 0 BEADRP C(C1CCCCC1)[N@@H+]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000261584825 135226379 /nfs/dbraw/zinc/22/63/79/135226379.db2.gz QBAJWFPYERFNAI-ZIAGYGMSSA-N 2 0 222.376 2.108 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]CC[C@H]2CCOC2)c2ccccc21 ZINC000261585575 135227037 /nfs/dbraw/zinc/22/70/37/135227037.db2.gz TWKVMURXPCOGGI-NILFDRSVSA-N 2 0 246.354 2.147 20 0 BEADRP C[C@@H]([NH3+])[C@@H](C)[NH2+]C1C2CC3CC(C2)CC1C3 ZINC000261589029 135229059 /nfs/dbraw/zinc/22/90/59/135229059.db2.gz SUWQYLJTWHUURA-FVGPQNGLSA-N 2 0 222.376 2.136 20 0 BEADRP CCC[C@](C)(O)C[NH2+][C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000261588567 135229203 /nfs/dbraw/zinc/22/92/03/135229203.db2.gz VUARDMXPTCUMJH-KKUMJFAQSA-N 2 0 248.370 2.272 20 0 BEADRP Cc1cc(NCC2([NH3+])CCCCC2)cc[nH+]1 ZINC000261588671 135229476 /nfs/dbraw/zinc/22/94/76/135229476.db2.gz SNUXBTKDMMREBM-UHFFFAOYSA-N 2 0 219.332 2.464 20 0 BEADRP C[C@@H]1CC[C@]2(CC[N@H+](CC(C)(C)[NH3+])C2)C1 ZINC000261589648 135230047 /nfs/dbraw/zinc/23/00/47/135230047.db2.gz UAABZOQFBFNGIW-YPMHNXCESA-N 2 0 210.365 2.236 20 0 BEADRP Cc1cc(C)cc(C[N@@H+]2CC[C@H]3[NH2+]CC[C@H]3C2)c1 ZINC000261589791 135230563 /nfs/dbraw/zinc/23/05/63/135230563.db2.gz WMYTWLLGLFKGKP-JKSUJKDBSA-N 2 0 244.382 2.487 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@@H]3C[NH2+]C[C@@H]3C2)cc1C ZINC000261590724 135230820 /nfs/dbraw/zinc/23/08/20/135230820.db2.gz XEPPAELUYCIUJT-HZPDHXFCSA-N 2 0 244.382 2.345 20 0 BEADRP Cc1ccsc1C[N@@H+]1CC[C@H]2[NH2+]CC[C@H]2C1 ZINC000261592428 135232469 /nfs/dbraw/zinc/23/24/69/135232469.db2.gz VWDSRHQUJQZJNW-NWDGAFQWSA-N 2 0 236.384 2.240 20 0 BEADRP Cc1cc(C[N@@H+]2C[C@@H]3CC[C@H]([NH3+])[C@@H]3C2)ccc1F ZINC000261592128 135232911 /nfs/dbraw/zinc/23/29/11/135232911.db2.gz YIEBXURHNIYXSA-GUTXKFCHSA-N 2 0 248.345 2.303 20 0 BEADRP Cc1ccsc1C[N@@H+]1CC[C@@H]2[NH2+]CC[C@@H]2C1 ZINC000261592427 135232975 /nfs/dbraw/zinc/23/29/75/135232975.db2.gz VWDSRHQUJQZJNW-NEPJUHHUSA-N 2 0 236.384 2.240 20 0 BEADRP Cc1ccccc1C[NH2+][C@H]1CC[NH2+]C[C@@H]1C ZINC000261593595 135233989 /nfs/dbraw/zinc/23/39/89/135233989.db2.gz WZAZIZISVPFZAX-JSGCOSHPSA-N 2 0 218.344 2.083 20 0 BEADRP Cc1ccccc1C[NH2+][C@H]1CC[NH2+]C[C@H]1C ZINC000261593596 135234035 /nfs/dbraw/zinc/23/40/35/135234035.db2.gz WZAZIZISVPFZAX-OCCSQVGLSA-N 2 0 218.344 2.083 20 0 BEADRP Cc1ccccc1C[NH2+][C@@H]1CC[NH2+]C[C@@H]1C ZINC000261593594 135234515 /nfs/dbraw/zinc/23/45/15/135234515.db2.gz WZAZIZISVPFZAX-GXTWGEPZSA-N 2 0 218.344 2.083 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@H]3C[NH2+]C[C@@H]3C2)s1 ZINC000261597503 135236767 /nfs/dbraw/zinc/23/67/67/135236767.db2.gz ZDOLFHVFOUEKDZ-NWDGAFQWSA-N 2 0 236.384 2.098 20 0 BEADRP Cc1cccc(C[N@@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@H]3C2)c1 ZINC000261546221 135238545 /nfs/dbraw/zinc/23/85/45/135238545.db2.gz GRGCUMVSEXEEKM-SOUVJXGZSA-N 2 0 230.355 2.164 20 0 BEADRP Cc1cccc(C[N@@H+]2C[C@@H]3CC[C@H]([NH3+])[C@H]3C2)c1 ZINC000261546219 135238561 /nfs/dbraw/zinc/23/85/61/135238561.db2.gz GRGCUMVSEXEEKM-KKUMJFAQSA-N 2 0 230.355 2.164 20 0 BEADRP CCC(C)(C)CC[N@@H+]1C[C@@H](C[NH3+])C[C@@H]1C ZINC000261546685 135239506 /nfs/dbraw/zinc/23/95/06/135239506.db2.gz LFOTVAFIHORERU-NWDGAFQWSA-N 2 0 212.381 2.482 20 0 BEADRP CCC(C)(C)CC[N@@H+]1C[C@H](C[NH3+])C[C@H]1C ZINC000261546684 135239574 /nfs/dbraw/zinc/23/95/74/135239574.db2.gz LFOTVAFIHORERU-NEPJUHHUSA-N 2 0 212.381 2.482 20 0 BEADRP CCC[C@@H]1CCC[N@H+](C[C@@]2(C)CC[NH2+]C2)C1 ZINC000261756368 135250074 /nfs/dbraw/zinc/25/00/74/135250074.db2.gz KXDZCGZFQXKGMY-KGLIPLIRSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@H]1CC[N@H+](C[C@]2(C)CC[NH2+]C2)CC1(C)C ZINC000261768979 135251977 /nfs/dbraw/zinc/25/19/77/135251977.db2.gz MIOCHGPBBOSMQM-GXTWGEPZSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H](C[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1)c1ccc(F)cc1 ZINC000261815031 135255053 /nfs/dbraw/zinc/25/50/53/135255053.db2.gz HXOHQEZCLLSPRD-FPMFFAJLSA-N 2 0 248.345 2.080 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@@H]2CCC[NH2+]C2)CC1(C)C ZINC000261813348 135255345 /nfs/dbraw/zinc/25/53/45/135255345.db2.gz HVAWEDALHFXRML-CHWSQXEVSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@H]1CC2(CCC2)C[N@@H+]1CC1CC[NH2+]CC1 ZINC000261864442 135258067 /nfs/dbraw/zinc/25/80/67/135258067.db2.gz UPXJDYBQYUOFQH-LBPRGKRZSA-N 2 0 222.376 2.251 20 0 BEADRP [NH3+]C1CCC([NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)CC1 ZINC000261879189 135259011 /nfs/dbraw/zinc/25/90/11/135259011.db2.gz UAVPUJIQVJHXJD-RXDNMWQFSA-N 2 0 208.349 2.035 20 0 BEADRP C[C@@]1(C[N@@H+]2CCCCC(C)(C)C2)CC[NH2+]C1 ZINC000261882914 135260413 /nfs/dbraw/zinc/26/04/13/135260413.db2.gz RIZMLUBEGZARNM-CQSZACIVSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H]1C[N@H+](C[C@]2(C)CC[NH2+]C2)[C@H]2CCCC[C@H]12 ZINC000261914136 135262436 /nfs/dbraw/zinc/26/24/36/135262436.db2.gz YYQKIYCZXFZKPH-APIJFGDWSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H]1C[C@@H]1CN(CC[NH3+])Cc1ccccc1 ZINC000261943959 135265581 /nfs/dbraw/zinc/26/55/81/135265581.db2.gz NDDYWENBQGVLOO-GXTWGEPZSA-N 2 0 218.344 2.103 20 0 BEADRP CCc1cccc(F)c1CN1C[C@H](C)[C@H]([NH3+])C1 ZINC000261964065 135267253 /nfs/dbraw/zinc/26/72/53/135267253.db2.gz HOEVBLRMYFBDPR-IINYFYTJSA-N 2 0 236.334 2.167 20 0 BEADRP CC[N@H+](Cc1cnccc1C)[C@H]1CCC[NH2+]CC1 ZINC000261997003 135270547 /nfs/dbraw/zinc/27/05/47/135270547.db2.gz SXUNKAKEWLPHEY-HNNXBMFYSA-N 2 0 247.386 2.354 20 0 BEADRP COc1cc(C[N@@H+]2CC[C@@H]([NH3+])[C@H](C)C2)ccc1C ZINC000262016364 135273064 /nfs/dbraw/zinc/27/30/64/135273064.db2.gz VSZYROQXOODIGO-TZMCWYRMSA-N 2 0 248.370 2.173 20 0 BEADRP C[C@@H]1C[C@H](C)CC[N@H+](C[C@@]2(C)CC[NH2+]C2)C1 ZINC000262018967 135273175 /nfs/dbraw/zinc/27/31/75/135273175.db2.gz MZAIOAJVQDWRDN-MCIONIFRSA-N 2 0 224.392 2.354 20 0 BEADRP CC(C)C[C@H]1CC[N@H+](C[C@]2(C)CC[NH2+]C2)C1 ZINC000262149966 135282394 /nfs/dbraw/zinc/28/23/94/135282394.db2.gz ZVCRQDHQDAAVBI-ZIAGYGMSSA-N 2 0 224.392 2.354 20 0 BEADRP CCc1nc(C[NH2+]C2CCC([NH3+])CC2)cs1 ZINC000262150005 135282450 /nfs/dbraw/zinc/28/24/50/135282450.db2.gz FXTMKUUXSHPOHU-UHFFFAOYSA-N 2 0 239.388 2.065 20 0 BEADRP Cc1cc([C@H]2CCC[N@@H+]2CC2CC[NH2+]CC2)on1 ZINC000262298390 135291563 /nfs/dbraw/zinc/29/15/63/135291563.db2.gz WZDQMXZKJHYLAC-CYBMUJFWSA-N 2 0 249.358 2.120 20 0 BEADRP CC(C)CC[N@@H+]1CCC[C@@H]2C[NH+](C)CC[C@@H]21 ZINC000334356230 135369621 /nfs/dbraw/zinc/36/96/21/135369621.db2.gz MTUINFFTJLUFAL-KGLIPLIRSA-N 2 0 224.392 2.449 20 0 BEADRP C[C@@H](C[NH2+]Cc1cc[nH]c1)C[NH+]1CCCCC1 ZINC000080773887 135384553 /nfs/dbraw/zinc/38/45/53/135384553.db2.gz LHSQIVLALSFWAZ-ZDUSSCGKSA-N 2 0 235.375 2.226 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]Cc2ccc(F)cc2)C1 ZINC000086401982 135491178 /nfs/dbraw/zinc/49/11/78/135491178.db2.gz DUWYZRDMEYIYJF-CHWSQXEVSA-N 2 0 222.307 2.185 20 0 BEADRP COc1ccc2c(c1)[C@@H]([NH2+]CCCC[NH3+])CCC2 ZINC000092383693 135575770 /nfs/dbraw/zinc/57/57/70/135575770.db2.gz ZFVVQEUOOFNGLO-HNNXBMFYSA-N 2 0 248.370 2.401 20 0 BEADRP CC1CCC([NH2+][C@H]2CC[C@H](C[NH3+])C2)CC1 ZINC000334863374 135826644 /nfs/dbraw/zinc/82/66/44/135826644.db2.gz MWKQCUKLDSPZTG-MVKMKZAISA-N 2 0 210.365 2.282 20 0 BEADRP CC1(C)CCCC[C@H]1[NH2+]C[C@H]1CC[NH2+]C1 ZINC000335175817 135931777 /nfs/dbraw/zinc/93/17/77/135931777.db2.gz PQSKPGPESYYESS-NWDGAFQWSA-N 2 0 210.365 2.154 20 0 BEADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@@H]1CC[C@H]1CC ZINC000348069916 136026602 /nfs/dbraw/zinc/02/66/02/136026602.db2.gz HBEOIXDVRJKAGP-MGPQQGTHSA-N 2 0 242.407 2.121 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@@H]2C[C@@H]2C(F)F)CC1 ZINC000348116394 136037964 /nfs/dbraw/zinc/03/79/64/136037964.db2.gz KOGLPSQPGFYRLF-WDEREUQCSA-N 2 0 232.318 2.102 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H]2C[C@H]2C(F)F)CC1 ZINC000348150420 136039686 /nfs/dbraw/zinc/03/96/86/136039686.db2.gz LCECRWBWFKUZHI-GHMZBOCLSA-N 2 0 232.318 2.104 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H]2C[C@@H]2C(F)F)CC1 ZINC000348150423 136040027 /nfs/dbraw/zinc/04/00/27/136040027.db2.gz LCECRWBWFKUZHI-WDEREUQCSA-N 2 0 232.318 2.104 20 0 BEADRP Cc1cnc([C@@H](C)[NH+]2CCC([C@@H](C)[NH3+])CC2)o1 ZINC000335387063 136089392 /nfs/dbraw/zinc/08/93/92/136089392.db2.gz QEUGEGDAEJYZFU-GHMZBOCLSA-N 2 0 237.347 2.103 20 0 BEADRP C[C@H]1CC(C)(C)CC[C@@H]1[NH2+]CC1C[NH2+]C1 ZINC000335551591 136097973 /nfs/dbraw/zinc/09/79/73/136097973.db2.gz KBXDTSBTDHWMRL-JQWIXIFHSA-N 2 0 210.365 2.010 20 0 BEADRP COC1CCC([NH2+][C@H]2CCCCC[C@H]2[NH3+])CC1 ZINC000335595779 136104853 /nfs/dbraw/zinc/10/48/53/136104853.db2.gz PBMPTNPPDIEIIE-PQAZSJQKSA-N 2 0 240.391 2.194 20 0 BEADRP [NH3+]CC1CCC([NH2+][C@@H]2CCCC[C@H]2F)CC1 ZINC000335562434 136106672 /nfs/dbraw/zinc/10/66/72/136106672.db2.gz MZDWWCQDSQDURK-FIYWTHMPSA-N 2 0 228.355 2.374 20 0 BEADRP C[C@H]1Cc2ccc(F)cc2[C@@H]1[NH2+]C1CC[NH2+]CC1 ZINC000335568797 136108667 /nfs/dbraw/zinc/10/86/67/136108667.db2.gz SOWGQAWPNHMSOS-ZUZCIYMTSA-N 2 0 248.345 2.401 20 0 BEADRP C[C@@H]1Cc2ccc(F)cc2[C@@H]1[NH2+]C1CC[NH2+]CC1 ZINC000335568796 136108871 /nfs/dbraw/zinc/10/88/71/136108871.db2.gz SOWGQAWPNHMSOS-MEBBXXQBSA-N 2 0 248.345 2.401 20 0 BEADRP Cc1cccc(OCC[NH2+][C@@H]2C[C@H]([NH3+])C2(C)C)c1 ZINC000404785184 397732614 /nfs/dbraw/zinc/73/26/14/397732614.db2.gz PHAKUQZHTAPXMQ-UONOGXRCSA-N 2 0 248.370 2.089 20 0 BEADRP Cc1c[nH+]ccc1NC[C@H]1CCCC[N@@H+]1C1CC1 ZINC000358916104 397943428 /nfs/dbraw/zinc/94/34/28/397943428.db2.gz RBQKJCGCOVEYDS-CQSZACIVSA-N 2 0 245.370 2.241 20 0 BEADRP CCc1cc(N2CC[C@H](C[NH+](C)C)C2)cc[nH+]1 ZINC000450438566 397963127 /nfs/dbraw/zinc/96/31/27/397963127.db2.gz VKZALSIYUVLYKY-GFCCVEGCSA-N 2 0 233.359 2.032 20 0 BEADRP CC[C@](C)(C[N@H+](C)C[C@H]1CCC[NH+](C)C1)OC ZINC000637929436 398044254 /nfs/dbraw/zinc/04/42/54/398044254.db2.gz ADWHLXJXDRJUGB-UONOGXRCSA-N 2 0 242.407 2.075 20 0 BEADRP CC[C@@](C)(C[N@H+](C)C[C@@H]1CCC[NH+](C)C1)OC ZINC000637929435 398044494 /nfs/dbraw/zinc/04/44/94/398044494.db2.gz ADWHLXJXDRJUGB-KGLIPLIRSA-N 2 0 242.407 2.075 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+][C@@H]1CCC[C@H](C)CC1 ZINC000300580135 397995300 /nfs/dbraw/zinc/99/53/00/397995300.db2.gz SZHOXNSTORKSAP-MJBXVCDLSA-N 2 0 242.407 2.299 20 0 BEADRP CCCCOCCC[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000221679199 398046351 /nfs/dbraw/zinc/04/63/51/398046351.db2.gz WCAQOSVYICPHND-UONOGXRCSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@H]1C[C@@H](C[N@H+](C)C(C2CC2)C2CC2)CC[NH2+]1 ZINC000414689752 398019484 /nfs/dbraw/zinc/01/94/84/398019484.db2.gz GVFHWZLLHGMGDN-RYUDHWBXSA-N 2 0 236.403 2.495 20 0 BEADRP COc1c(C)cc(C[N@H+](C)C2CC([NH3+])C2)cc1C ZINC000414776608 398034546 /nfs/dbraw/zinc/03/45/46/398034546.db2.gz NKBRBRSULVROPS-UHFFFAOYSA-N 2 0 248.370 2.234 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+]C[C@H]1CCC[C@@H](C)C1 ZINC000414792077 398038923 /nfs/dbraw/zinc/03/89/23/398038923.db2.gz IMQJEGDAABTTSW-FRRDWIJNSA-N 2 0 212.381 2.386 20 0 BEADRP C[N@H+](CCCc1ccccc1)C[C@@H]1CC[NH2+]C1 ZINC000382761522 397972540 /nfs/dbraw/zinc/97/25/40/397972540.db2.gz YZLIJIJRQVRIQO-OAHLLOKOSA-N 2 0 232.371 2.161 20 0 BEADRP CC(C)CCC[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000054243379 397972541 /nfs/dbraw/zinc/97/25/41/397972541.db2.gz PQNMIEHKVPVSFJ-CYBMUJFWSA-N 2 0 212.381 2.354 20 0 BEADRP CCOc1cccc(C[NH2+]CC[C@H]2CCC[NH2+]2)c1 ZINC000414917620 398092381 /nfs/dbraw/zinc/09/23/81/398092381.db2.gz RXPRPHWCHNVKPM-CQSZACIVSA-N 2 0 248.370 2.317 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[C@@H](C)C1)[C@H]1CCC[NH2+]C1 ZINC000414853995 398062142 /nfs/dbraw/zinc/06/21/42/398062142.db2.gz LSHPHKKEOGPEBM-VOAKCMCISA-N 2 0 210.365 2.153 20 0 BEADRP CCC[C@H](C)C[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000414855177 398063315 /nfs/dbraw/zinc/06/33/15/398063315.db2.gz VVXKVRXRQWICPM-QWHCGFSZSA-N 2 0 212.381 2.402 20 0 BEADRP C[NH2+]CCC[NH2+][C@H](C)CCCC(F)(F)F ZINC000414863074 398068606 /nfs/dbraw/zinc/06/86/06/398068606.db2.gz WRVDNELMRYJKSF-SECBINFHSA-N 2 0 226.286 2.307 20 0 BEADRP CCC(CC)(C[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1)OC ZINC000383993538 398055621 /nfs/dbraw/zinc/05/56/21/398055621.db2.gz NMHJWAJLKZOGPY-OLZOCXBDSA-N 2 0 242.407 2.264 20 0 BEADRP CC[C@H](C[C@@H](C)CC)[NH2+][C@H]1CCN(C)C1 ZINC000238857308 171296178 /nfs/dbraw/zinc/29/61/78/171296178.db2.gz YTZGWYJAGBGQIG-XQQFMLRXSA-N 2 0 212.381 2.495 20 0 BEADRP C[C@@H]1C[C@@H](C)[N@H+](CC2CCC2)C[C@H]1C[NH3+] ZINC000397321476 398120517 /nfs/dbraw/zinc/12/05/17/398120517.db2.gz SXUIMHBGRVDDCH-NQBHXWOUSA-N 2 0 210.365 2.092 20 0 BEADRP CCOc1cccc(C[NH2+][C@@H]2CC[NH2+][C@H](C)C2)c1 ZINC000414945756 398121255 /nfs/dbraw/zinc/12/12/55/398121255.db2.gz IVAQVSYJIRENHS-TZMCWYRMSA-N 2 0 248.370 2.315 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@H]2CSC[C@H]2C)CC1 ZINC000304354307 398115061 /nfs/dbraw/zinc/11/50/61/398115061.db2.gz CWBQIOBMXGBZNN-YPMHNXCESA-N 2 0 242.432 2.059 20 0 BEADRP CC(C)C[NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1 ZINC000053657773 167005943 /nfs/dbraw/zinc/00/59/43/167005943.db2.gz LCPNXWXQHNCMBN-ZDUSSCGKSA-N 2 0 212.381 2.352 20 0 BEADRP CCC[NH+]1CCC(NC(=[NH2+])C(C)(C)C)CC1 ZINC000062993650 1172793215 /nfs/dbraw/zinc/79/32/15/1172793215.db2.gz VEFLLTVMVPYNNB-UHFFFAOYSA-N 2 0 225.380 2.474 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H](C[NH2+]Cc2ccsc2)C1 ZINC000063147381 1172802450 /nfs/dbraw/zinc/80/24/50/1172802450.db2.gz NEKWJVZABGSRKT-ZYHUDNBSSA-N 2 0 224.373 2.355 20 0 BEADRP Cc1cc(C)c(C[NH2+]C[C@@H](C)C[NH3+])cc1C ZINC000258779505 322877535 /nfs/dbraw/zinc/87/75/35/322877535.db2.gz OYSADRLRCRHEKN-JTQLQIEISA-N 2 0 220.360 2.296 20 0 BEADRP Cc1ccc(C[NH2+]C[C@@H]2CCC[NH2+]C2)c(C)c1 ZINC000258916899 322879702 /nfs/dbraw/zinc/87/97/02/322879702.db2.gz FVWDGBVWIRDSTP-CQSZACIVSA-N 2 0 232.371 2.393 20 0 BEADRP Cc1cc(C[NH2+]CC[C@@H]2CC[NH2+]C2)ccc1F ZINC000258975523 322880703 /nfs/dbraw/zinc/88/07/03/322880703.db2.gz KPQDWGYTCILFFA-LBPRGKRZSA-N 2 0 236.334 2.223 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@H]1CC[C@H](C)SC1 ZINC000655703345 487557458 /nfs/dbraw/zinc/55/74/58/487557458.db2.gz OLHXVUAVICBKTA-WOPDTQHZSA-N 2 0 230.421 2.200 20 0 BEADRP Cc1ccc(F)c(C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)c1 ZINC000334843191 487570172 /nfs/dbraw/zinc/57/01/72/487570172.db2.gz CSVWNXPCSNRFEN-OLZOCXBDSA-N 2 0 236.334 2.494 20 0 BEADRP CC(C)OC[C@@H](C)[NH2+]CCC1CC[NH+](C)CC1 ZINC000337322893 167254841 /nfs/dbraw/zinc/25/48/41/167254841.db2.gz ADUXNFLFHYBNPW-CYBMUJFWSA-N 2 0 242.407 2.121 20 0 BEADRP CC(C)OC[C@@H](C)[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000337348893 167254913 /nfs/dbraw/zinc/25/49/13/167254913.db2.gz ZOUZMSAHCWZVNO-CYBMUJFWSA-N 2 0 242.407 2.262 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@H]2CS[C@H](C)C2)CC1 ZINC000086935664 487593451 /nfs/dbraw/zinc/59/34/51/487593451.db2.gz ATSRSMYXMXLHEX-DGCLKSJQSA-N 2 0 242.432 2.202 20 0 BEADRP CC1CCC([NH2+][C@@H]2CC[C@@H]3C[N@H+](C)C[C@H]23)CC1 ZINC001651698332 1172977032 /nfs/dbraw/zinc/97/70/32/1172977032.db2.gz VIELEPHZLKWKGJ-FJGURNMVSA-N 2 0 236.403 2.495 20 0 BEADRP CC(C)CC[NH+](C)C[C@H]1CC[NH2+][C@@H](C)C1 ZINC000232546631 487605584 /nfs/dbraw/zinc/60/55/84/487605584.db2.gz OLWLZWUYGMVJAW-STQMWFEESA-N 2 0 212.381 2.352 20 0 BEADRP CC(C)SCC[NH+]1CCC(C[NH+](C)C)CC1 ZINC000336670088 167323613 /nfs/dbraw/zinc/32/36/13/167323613.db2.gz XWYYQPLBDPTALY-UHFFFAOYSA-N 2 0 244.448 2.402 20 0 BEADRP CC(C)SCC[N@@H+]1CC[C@@H](C[NH+](C)C)C1 ZINC000336677686 167326806 /nfs/dbraw/zinc/32/68/06/167326806.db2.gz ICNMROKACVWYAC-LBPRGKRZSA-N 2 0 230.421 2.012 20 0 BEADRP C1=CCC(C[N@@H+]2CCC[C@@H]([C@H]3CCC[NH2+]3)C2)C1 ZINC000662263505 409556409 /nfs/dbraw/zinc/55/64/09/409556409.db2.gz BVMGPPNAGGBQGM-HUUCEWRRSA-N 2 0 234.387 2.417 20 0 BEADRP CC[C@@H](CC(F)F)C[N@@H+]1CC[C@]2(CC[NH2+]C2)C1 ZINC000662264456 409559814 /nfs/dbraw/zinc/55/98/14/409559814.db2.gz DHAXZANEWPIOHJ-AAEUAGOBSA-N 2 0 246.345 2.353 20 0 BEADRP CC[C@H](C[NH2+]CC1([NH3+])CCC1)CC(F)F ZINC000662266479 409567035 /nfs/dbraw/zinc/56/70/35/409567035.db2.gz MKGNIAZNLQFFKA-VIFPVBQESA-N 2 0 220.307 2.139 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCC[C@@H](C2CCC2)C1 ZINC000662317786 409637207 /nfs/dbraw/zinc/63/72/07/409637207.db2.gz SIYYLTAUIFKQCK-CYBMUJFWSA-N 2 0 210.365 2.108 20 0 BEADRP CC[C@@H]1C[N@H+](C[C@@H]2C[C@H]3C[C@H]3C2)CC[C@H]1[NH3+] ZINC000662270504 409572653 /nfs/dbraw/zinc/57/26/53/409572653.db2.gz LPMNQFBEHDFVSE-RKQHYHRCSA-N 2 0 222.376 2.092 20 0 BEADRP CO[C@H](C[N@@H+]1CC[C@H]([NH3+])C[C@@H]1C)C1CCCC1 ZINC000662284267 409614665 /nfs/dbraw/zinc/61/46/65/409614665.db2.gz MJIRHMJSRGEEBY-FPMFFAJLSA-N 2 0 240.391 2.003 20 0 BEADRP CC(C)SCC[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000304325757 167332141 /nfs/dbraw/zinc/33/21/41/167332141.db2.gz SVLFBSJFILVEQY-CHWSQXEVSA-N 2 0 242.432 2.344 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CC[N@H+](C[C@@H](C)C(C)(C)C)C1 ZINC000308778194 409905812 /nfs/dbraw/zinc/90/58/12/409905812.db2.gz BITYDJCGAZNBRK-GRYCIOLGSA-N 2 0 212.381 2.338 20 0 BEADRP C[C@@H](C[NH2+][C@@H](C)CC1CCC1)C[NH+](C)C ZINC000308911328 409936297 /nfs/dbraw/zinc/93/62/97/409936297.db2.gz MQQRUIKDLVGXBK-RYUDHWBXSA-N 2 0 212.381 2.352 20 0 BEADRP CC[C@H]1C[N@H+](CCCCCF)CC[C@@H]1[NH3+] ZINC000308916724 409938198 /nfs/dbraw/zinc/93/81/98/409938198.db2.gz INEBBGKPIJBPOK-RYUDHWBXSA-N 2 0 216.344 2.185 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@H]2CCC[C@@H]3C[C@@H]32)CC1 ZINC000383365224 487612342 /nfs/dbraw/zinc/61/23/42/487612342.db2.gz XAJANBPRAOLWGC-ILXRZTDVSA-N 2 0 236.403 2.497 20 0 BEADRP CC(C)[C@H]1CCC[C@H]1[NH2+]CC12CC(C1)C[NH2+]2 ZINC000663498166 410276146 /nfs/dbraw/zinc/27/61/46/410276146.db2.gz MXYQVADCMJXFLP-CEUNDQEZSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]1CC[N@H+](CCCC2CC[NH2+]CC2)C1 ZINC000050953006 410323695 /nfs/dbraw/zinc/32/36/95/410323695.db2.gz SRBDBSQUTVKHGY-GFCCVEGCSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]Cc2cccc3c2CCC3)CC[NH2+]1 ZINC000650703502 410332687 /nfs/dbraw/zinc/33/26/87/410332687.db2.gz CEIRMDPHZPCIQL-WFASDCNBSA-N 2 0 244.382 2.405 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]Cc1cccc2c1CCC2 ZINC000650704293 410335135 /nfs/dbraw/zinc/33/51/35/410335135.db2.gz RSQRWMLHKAZJRZ-NEPJUHHUSA-N 2 0 232.371 2.391 20 0 BEADRP CCc1ccc(C[NH2+]CCC2(C[NH3+])CC2)cc1 ZINC000650711846 410341786 /nfs/dbraw/zinc/34/17/86/410341786.db2.gz GFYZBMIBFDZFGP-UHFFFAOYSA-N 2 0 232.371 2.468 20 0 BEADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H]1CCCOCC1 ZINC000650719185 410355638 /nfs/dbraw/zinc/35/56/38/410355638.db2.gz GXMYOLZNQDUSLL-OAHLLOKOSA-N 2 0 248.370 2.065 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2CC[C@@]3(CC3(F)F)C2)CC[NH2+]1 ZINC000650725379 410359870 /nfs/dbraw/zinc/35/98/70/410359870.db2.gz ZJNLOTMJFQCMPU-IJLUTSLNSA-N 2 0 244.329 2.106 20 0 BEADRP CC(C)C[N@@H+]1CCCC[C@@H]1[C@H]1C[C@@H]([NH3+])CCO1 ZINC000650724047 410360003 /nfs/dbraw/zinc/36/00/03/410360003.db2.gz XNCZEOTWMJVPCQ-BFHYXJOUSA-N 2 0 240.391 2.003 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[C@H]1CC(C)(C)C)C1C[NH2+]C1 ZINC000650742071 410374518 /nfs/dbraw/zinc/37/45/18/410374518.db2.gz QPVIAVUVDWKGSF-JFGNBEQYSA-N 2 0 210.365 2.009 20 0 BEADRP Cc1ccc([C@H](C)[NH2+]CCC2(C[NH3+])CC2)o1 ZINC000650743657 410376874 /nfs/dbraw/zinc/37/68/74/410376874.db2.gz YKMFKDNZPCJAHH-NSHDSACASA-N 2 0 222.332 2.368 20 0 BEADRP C[C@H]([NH2+]CCC1(C[NH3+])CC1)c1ccccc1 ZINC000650743487 410377198 /nfs/dbraw/zinc/37/71/98/410377198.db2.gz UNWULMLRBDXOPZ-LBPRGKRZSA-N 2 0 218.344 2.466 20 0 BEADRP CC(C)[C@H]([NH2+]CCC1(C[NH3+])CC1)C1CC1 ZINC000650745254 410380769 /nfs/dbraw/zinc/38/07/69/410380769.db2.gz CJOSSSZPWSSLHL-LBPRGKRZSA-N 2 0 210.365 2.140 20 0 BEADRP CCc1cccnc1[C@@H](C)[NH2+]CCC1(C[NH3+])CC1 ZINC000650745676 410383048 /nfs/dbraw/zinc/38/30/48/410383048.db2.gz LLBXGXAAUDUMFN-GFCCVEGCSA-N 2 0 247.386 2.424 20 0 BEADRP C[C@@H]([NH2+]CCC1(C[NH3+])CC1)c1cccc(O)c1 ZINC000650745475 410383130 /nfs/dbraw/zinc/38/31/30/410383130.db2.gz HNLMEMASXCZIPL-LLVKDONJSA-N 2 0 234.343 2.172 20 0 BEADRP C[C@H]([NH2+]CCC1(C[NH3+])CC1)c1ccc(F)cn1 ZINC000650745905 410384771 /nfs/dbraw/zinc/38/47/71/410384771.db2.gz QQAURNKXEHHVLX-JTQLQIEISA-N 2 0 237.322 2.000 20 0 BEADRP [NH3+]CC1(CC[NH2+][C@@H]2CC[C@H]2C2CCC2)CC1 ZINC000650747283 410387845 /nfs/dbraw/zinc/38/78/45/410387845.db2.gz WNSQXSYZBMMNCE-QWHCGFSZSA-N 2 0 222.376 2.284 20 0 BEADRP CC[C@@H]([NH2+]CCC1(C[NH3+])CC1)C1CCC1 ZINC000650747377 410387942 /nfs/dbraw/zinc/38/79/42/410387942.db2.gz YSZXAUNSNWMXDV-GFCCVEGCSA-N 2 0 210.365 2.284 20 0 BEADRP C[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1F)[C@@H]1C[C@H]1C ZINC000650755901 410401408 /nfs/dbraw/zinc/40/14/08/410401408.db2.gz PCOHXOZFIQDDRM-GIPNMCIBSA-N 2 0 236.334 2.419 20 0 BEADRP C[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1F)[C@H]1C[C@H]1C ZINC000650755899 410401825 /nfs/dbraw/zinc/40/18/25/410401825.db2.gz PCOHXOZFIQDDRM-BREBYQMCSA-N 2 0 236.334 2.419 20 0 BEADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H](C)CCCC[NH3+] ZINC000650755371 410401882 /nfs/dbraw/zinc/40/18/82/410401882.db2.gz CWBQEZYRPLSMSV-ZDUSSCGKSA-N 3 0 249.402 2.013 20 0 BEADRP C[C@H]([NH2+]Cc1ccc(C[NH3+])cc1F)[C@@H]1C[C@H]1C ZINC000650755900 410402197 /nfs/dbraw/zinc/40/21/97/410402197.db2.gz PCOHXOZFIQDDRM-GBIKHYSHSA-N 2 0 236.334 2.419 20 0 BEADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H](C)C1CC1 ZINC000650759527 410406755 /nfs/dbraw/zinc/40/67/55/410406755.db2.gz LKDFWOTXIQECBA-NSHDSACASA-N 2 0 218.344 2.294 20 0 BEADRP Cc1cc([C@H](C)[NH2+]CCC2CC[NH2+]CC2)no1 ZINC000650762803 410411440 /nfs/dbraw/zinc/41/14/40/410411440.db2.gz KVMHIARONNRKRJ-NSHDSACASA-N 2 0 237.347 2.023 20 0 BEADRP CC[C@@H]([NH2+]CCC1CC[NH2+]CC1)C(C)C ZINC000650763577 410413994 /nfs/dbraw/zinc/41/39/94/410413994.db2.gz DPYPILFWESJWBX-CYBMUJFWSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H]([NH2+]CCC1CC[NH2+]CC1)C(C)(C)C ZINC000650764041 410414161 /nfs/dbraw/zinc/41/41/61/410414161.db2.gz PBSNOJOIPYVDJZ-NSHDSACASA-N 2 0 212.381 2.400 20 0 BEADRP Nc1cccc(C[NH2+][C@@H]2CCCCC[C@H]2[NH3+])c1 ZINC000665232823 410724415 /nfs/dbraw/zinc/72/44/15/410724415.db2.gz VCDSEOMOOZVRAP-ZIAGYGMSSA-N 2 0 233.359 2.018 20 0 BEADRP Nc1cccc(C[NH2+][C@H]2CCCCC[C@@H]2[NH3+])c1 ZINC000665232820 410724547 /nfs/dbraw/zinc/72/45/47/410724547.db2.gz VCDSEOMOOZVRAP-KBPBESRZSA-N 2 0 233.359 2.018 20 0 BEADRP CC[C@@H](NCCc1cnccc1C)[C@@H]1CCC[NH2+]1 ZINC000665239206 410729795 /nfs/dbraw/zinc/72/97/95/410729795.db2.gz OBGKGBKAPQIANI-CABCVRRESA-N 2 0 247.386 2.053 20 0 BEADRP c1cc(CC[NH2+][C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)co1 ZINC000665262931 410737289 /nfs/dbraw/zinc/73/72/89/410737289.db2.gz CGVJYZHFORFSGQ-RBSFLKMASA-N 2 0 248.370 2.332 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC[C@@H]1c1ccccc1)C1C[NH2+]C1 ZINC000665274042 410742263 /nfs/dbraw/zinc/74/22/63/410742263.db2.gz IOUFJCDYGLALBT-KCPJHIHWSA-N 2 0 230.355 2.130 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]C[C@H]1C(C)(C)C1(F)F ZINC000665274234 410742902 /nfs/dbraw/zinc/74/29/02/410742902.db2.gz MBZCVZXQGXPWOG-UWVGGRQHSA-N 2 0 234.334 2.385 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@@H]1C(C)(C)C1(F)F ZINC000665274233 410744148 /nfs/dbraw/zinc/74/41/48/410744148.db2.gz MBZCVZXQGXPWOG-NXEZZACHSA-N 2 0 234.334 2.385 20 0 BEADRP C[NH2+]C[C@H](C)[NH2+][C@@H](Cc1ccccc1)C1CC1 ZINC000665296785 410814016 /nfs/dbraw/zinc/81/40/16/410814016.db2.gz XRRHQDPXLYQUAI-WFASDCNBSA-N 2 0 232.371 2.205 20 0 BEADRP C[NH2+]C[C@@H](C)[NH2+][C@H](C)C1CCC(F)(F)CC1 ZINC000665297595 410818224 /nfs/dbraw/zinc/81/82/24/410818224.db2.gz IVZIECRZLJHAKU-NXEZZACHSA-N 2 0 234.334 2.398 20 0 BEADRP CC(C)C[NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1 ZINC000053657777 167006092 /nfs/dbraw/zinc/00/60/92/167006092.db2.gz LCPNXWXQHNCMBN-CYBMUJFWSA-N 2 0 212.381 2.352 20 0 BEADRP CC(C)C[NH2+][C@@H]1CC[N@H+](C)[C@@H]2CCC[C@@H]21 ZINC000367617968 167012136 /nfs/dbraw/zinc/01/21/36/167012136.db2.gz NZQPVXUNUSVPPF-JHJVBQTASA-N 2 0 210.365 2.105 20 0 BEADRP CC(C)[NH2+]CCCC[N@@H+]1CCC[C@H](C)C1 ZINC000037482883 167101526 /nfs/dbraw/zinc/10/15/26/167101526.db2.gz OFUFOCDYQQHVQN-ZDUSSCGKSA-N 2 0 212.381 2.497 20 0 BEADRP CC(C)[NH2+]CCC[NH+]1C[C@@H](C)C[C@H](C)C1 ZINC000037480274 167102352 /nfs/dbraw/zinc/10/23/52/167102352.db2.gz AWKYYQYWSFEXRM-STQMWFEESA-N 2 0 212.381 2.352 20 0 BEADRP CC(C)C[C@@H]1CCC[N@@H+]1C[C@H]1CC[NH2+]C1 ZINC000396981341 410907763 /nfs/dbraw/zinc/90/77/63/410907763.db2.gz UKGKWMKVRJBXAG-STQMWFEESA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)C[C@H]1CCC[N@@H+]1C[C@@H]1CC[NH2+]C1 ZINC000396981338 410908389 /nfs/dbraw/zinc/90/83/89/410908389.db2.gz UKGKWMKVRJBXAG-CHWSQXEVSA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)Oc1cccc(C[NH2+]CCCC[NH3+])c1 ZINC000040640591 167306949 /nfs/dbraw/zinc/30/69/49/167306949.db2.gz OHSJLIRNTPBKFD-UHFFFAOYSA-N 2 0 236.359 2.302 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@H]([NH3+])C1)[C@@H]1CC1(C)C ZINC000397837529 410936528 /nfs/dbraw/zinc/93/65/28/410936528.db2.gz SZYOVEOKBZXBAW-YFKTTZPYSA-N 2 0 210.365 2.281 20 0 BEADRP CC(C)SCC[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000336685110 167334131 /nfs/dbraw/zinc/33/41/31/167334131.db2.gz KNZAKNAAAHXDGF-RYUDHWBXSA-N 2 0 230.421 2.200 20 0 BEADRP C[C@@H](C[NH2+]C[C@@H]1CCC[NH2+]C1)C(C)(C)C ZINC000162703953 487620116 /nfs/dbraw/zinc/62/01/16/487620116.db2.gz BRXXXKIFMIVWFQ-NWDGAFQWSA-N 2 0 212.381 2.258 20 0 BEADRP CCC[C@H](C)C[N@@H+]1C[C@@H]2CCC[C@]2(C[NH3+])C1 ZINC000309399140 411162912 /nfs/dbraw/zinc/16/29/12/411162912.db2.gz DCSPJJYJFBGFER-IHRRRGAJSA-N 2 0 224.392 2.483 20 0 BEADRP CC(C)CC[N@H+](C[C@@H]1CC[NH2+]C1)C1CC1 ZINC000111239052 411163866 /nfs/dbraw/zinc/16/38/66/411163866.db2.gz REJACYIQMQUKGZ-GFCCVEGCSA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)C[N@H+](C)CCC[NH2+][C@@H]1CCCOCC1 ZINC000651865662 411147721 /nfs/dbraw/zinc/14/77/21/411147721.db2.gz CPJMPUGYXHSJBW-CQSZACIVSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)C[N@H+](C)CCC[NH2+][C@@H]1C[C@H](C)O[C@H]1C ZINC000651864703 411147788 /nfs/dbraw/zinc/14/77/88/411147788.db2.gz BCUGSUZRCUOKDO-MELADBBJSA-N 2 0 242.407 2.120 20 0 BEADRP C[C@@H]1C[N@H+](CCCC2CC[NH2+]CC2)CCS1 ZINC000123523428 411154212 /nfs/dbraw/zinc/15/42/12/411154212.db2.gz ROSKDUFNNRATEB-GFCCVEGCSA-N 2 0 242.432 2.204 20 0 BEADRP C[C@@H]([NH3+])C[N@@H+]1CCC[C@H]1CC1CCCC1 ZINC000655949012 411161395 /nfs/dbraw/zinc/16/13/95/411161395.db2.gz KFEUEVRXIMYWLY-YPMHNXCESA-N 2 0 210.365 2.378 20 0 BEADRP C[C@@H]([NH3+])C1CC[NH+]([C@@H](C)c2ccncc2)CC1 ZINC000110643839 411112971 /nfs/dbraw/zinc/11/29/71/411112971.db2.gz OOFAFFHNQDKINQ-NEPJUHHUSA-N 2 0 233.359 2.202 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)C1CCC1 ZINC000400989537 411168308 /nfs/dbraw/zinc/16/83/08/411168308.db2.gz XIHPXBQJWWVQTJ-IGHBBLSQSA-N 2 0 222.376 2.153 20 0 BEADRP CC(F)(F)CCC[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000401001305 411168414 /nfs/dbraw/zinc/16/84/14/411168414.db2.gz MVYAOBOTJQVJIB-QJPTWQEYSA-N 2 0 246.345 2.400 20 0 BEADRP C[C@@H]1CCCCC[C@H]1[NH2+]CCOCC[NH+](C)C ZINC000652193087 411168556 /nfs/dbraw/zinc/16/85/56/411168556.db2.gz VLYIQPVSULRGMD-ZIAGYGMSSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@@H]1CCCCC[C@@H]1[NH2+]CCOCC[NH+](C)C ZINC000652193085 411168698 /nfs/dbraw/zinc/16/86/98/411168698.db2.gz VLYIQPVSULRGMD-KGLIPLIRSA-N 2 0 242.407 2.123 20 0 BEADRP Cc1ccccc1C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000401027313 411173647 /nfs/dbraw/zinc/17/36/47/411173647.db2.gz VEBDDQUJXRXUQP-BZUAXINKSA-N 2 0 244.382 2.473 20 0 BEADRP Fc1ccccc1C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000401088271 411176497 /nfs/dbraw/zinc/17/64/97/411176497.db2.gz WGKLURITYKNXQG-MRVWCRGKSA-N 2 0 248.345 2.303 20 0 BEADRP COC[C@@H](CC(C)(C)C)[NH2+]C[C@@H]([NH3+])CC(C)C ZINC000656193905 411199263 /nfs/dbraw/zinc/19/92/63/411199263.db2.gz XQGRBDAGEUXLOL-QWHCGFSZSA-N 2 0 244.423 2.401 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCC[C@@H]([NH3+])C1)C1CCOCC1 ZINC000656197067 411201949 /nfs/dbraw/zinc/20/19/49/411201949.db2.gz BBEPFJGDOUUTOT-MCIONIFRSA-N 2 0 240.391 2.051 20 0 BEADRP COCC1(C[NH2+][C@H]2C[C@@H]([NH3+])c3ccccc32)CC1 ZINC000656200075 411205131 /nfs/dbraw/zinc/20/51/31/411205131.db2.gz JBZKLPZLYZTKLP-KGLIPLIRSA-N 2 0 246.354 2.147 20 0 BEADRP COc1c(C)cccc1CN[C@H](C)[C@@H]1CC[NH2+]C1 ZINC000656201309 411206681 /nfs/dbraw/zinc/20/66/81/411206681.db2.gz VGRQSIDQNNCPRC-CHWSQXEVSA-N 2 0 248.370 2.091 20 0 BEADRP COCCCCC[N@@H+]1CCC[C@@H](C)[C@@H]1CC[NH3+] ZINC000652355023 411214722 /nfs/dbraw/zinc/21/47/22/411214722.db2.gz MYTHCFBWJZHZNO-KGLIPLIRSA-N 2 0 242.407 2.252 20 0 BEADRP CCO[C@@H]1C[N@H+](CCC(C)(C)CC)C[C@H]1C[NH3+] ZINC000652356803 411215255 /nfs/dbraw/zinc/21/52/55/411215255.db2.gz IPIPMJOYLVDLFY-CHWSQXEVSA-N 2 0 242.407 2.108 20 0 BEADRP Cc1c[nH+]ccc1N[C@H]1CCC[N@@H+]2CCCC[C@H]12 ZINC000656226293 411215379 /nfs/dbraw/zinc/21/53/79/411215379.db2.gz LPYMHMQMSGUQNE-LSDHHAIUSA-N 2 0 245.370 2.241 20 0 BEADRP CC1=CC[C@H]([NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)CC1 ZINC000656269814 411220198 /nfs/dbraw/zinc/22/01/98/411220198.db2.gz VTHBMFDGJPVSHX-MELADBBJSA-N 2 0 222.376 2.415 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CC(C)(C)C[NH+](C)C)CS1 ZINC000655679769 411222964 /nfs/dbraw/zinc/22/29/64/411222964.db2.gz GBPJESPLUFOKGL-VXGBXAGGSA-N 2 0 244.448 2.448 20 0 BEADRP CC[C@@H]([NH2+]CC1C[NH2+]C1)c1ccc(F)cc1 ZINC000423307062 411238718 /nfs/dbraw/zinc/23/87/18/411238718.db2.gz VEHVZYTURZXXRK-CYBMUJFWSA-N 2 0 222.307 2.086 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CC[C@@H](C)SC2)C1 ZINC000655693953 411239497 /nfs/dbraw/zinc/23/94/97/411239497.db2.gz BIQKVFOAOLXVQU-JHJVBQTASA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H]1CCC[C@@H]1C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000400880128 411165603 /nfs/dbraw/zinc/16/56/03/411165603.db2.gz ADODZBDEQZKZMT-NIFZNCRKSA-N 2 0 236.403 2.400 20 0 BEADRP CCC(CC)C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000400969779 411166495 /nfs/dbraw/zinc/16/64/95/411166495.db2.gz OTVSBKPRWGPZMY-HZSPNIEDSA-N 2 0 224.392 2.400 20 0 BEADRP C(C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)CC1CC1 ZINC000400950173 411166676 /nfs/dbraw/zinc/16/66/76/411166676.db2.gz FDEJGFDIDBDTJQ-HZSPNIEDSA-N 2 0 222.376 2.154 20 0 BEADRP CC1(C)C[C@@H]1C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000400978377 411167123 /nfs/dbraw/zinc/16/71/23/411167123.db2.gz QHKYPELXQYJHCX-WUHRBBMRSA-N 2 0 222.376 2.010 20 0 BEADRP CCC(C)(C)C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000400983194 411167192 /nfs/dbraw/zinc/16/71/92/411167192.db2.gz WVPFRQBYILXCHU-FRRDWIJNSA-N 2 0 224.392 2.400 20 0 BEADRP CC1(C)C[C@@H]1C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000400978376 411167289 /nfs/dbraw/zinc/16/72/89/411167289.db2.gz QHKYPELXQYJHCX-UMSGYPCISA-N 2 0 222.376 2.010 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@H]2CCC[N@H+](C)C2)CS1 ZINC000655712165 411267233 /nfs/dbraw/zinc/26/72/33/411267233.db2.gz RHUFVXBGZRFKBJ-UPJWGTAASA-N 2 0 242.432 2.202 20 0 BEADRP C[N@H+](CCCC1CC[NH2+]CC1)Cc1cccnc1 ZINC000050952677 411269574 /nfs/dbraw/zinc/26/95/74/411269574.db2.gz UCPMKTGKXPAQRV-UHFFFAOYSA-N 2 0 247.386 2.293 20 0 BEADRP CC(C)CC[N@H+](C)CC[C@H]1CCC[NH2+]C1 ZINC000051919127 411286320 /nfs/dbraw/zinc/28/63/20/411286320.db2.gz WXPBVZYYCOBRAJ-CYBMUJFWSA-N 2 0 212.381 2.354 20 0 BEADRP CC(C)CC[N@H+](C)CC[C@@H]1CCC[NH2+]C1 ZINC000051919125 411286579 /nfs/dbraw/zinc/28/65/79/411286579.db2.gz WXPBVZYYCOBRAJ-ZDUSSCGKSA-N 2 0 212.381 2.354 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CCC(C)(C)F)[C@@H](C)C1 ZINC000658193406 411288303 /nfs/dbraw/zinc/28/83/03/411288303.db2.gz UNMRRPBMMIOHCU-RYUDHWBXSA-N 2 0 230.371 2.445 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CCC(C)(C)F)CC[N@@H+]1C ZINC000658193779 411288506 /nfs/dbraw/zinc/28/85/06/411288506.db2.gz YONYOEUHWPJUGN-QWRGUYRKSA-N 2 0 216.344 2.197 20 0 BEADRP C[C@H]([NH2+]CCc1ccoc1)C1CC[NH+](C)CC1 ZINC000658197435 411290442 /nfs/dbraw/zinc/29/04/42/411290442.db2.gz GQQYUGBASCSNTB-LBPRGKRZSA-N 2 0 236.359 2.142 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@@H]2CCC[C@H]3C[C@H]32)CC1 ZINC000658206060 411292572 /nfs/dbraw/zinc/29/25/72/411292572.db2.gz LJNYNWANAPZMTO-KCQAQPDRSA-N 2 0 236.403 2.497 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@@H]2CCC[C@@H]3C[C@@H]32)CC1 ZINC000658206059 411292926 /nfs/dbraw/zinc/29/29/26/411292926.db2.gz LJNYNWANAPZMTO-IPYPFGDCSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H]([NH2+][C@H]1CCS[C@H]1C)C1CC[NH+](C)CC1 ZINC000309851219 411295520 /nfs/dbraw/zinc/29/55/20/411295520.db2.gz XXBYTEQXEBSJBF-GVXVVHGQSA-N 2 0 242.432 2.200 20 0 BEADRP C[C@@H]([NH2+]C[C@]1(C)CC1(F)F)C1CC[NH+](C)CC1 ZINC000658217295 411296669 /nfs/dbraw/zinc/29/66/69/411296669.db2.gz FXIDYWJEBMWCRN-PWSUYJOCSA-N 2 0 246.345 2.352 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]C[C@@]2(C)CC2(F)F)[C@@H](C)C1 ZINC000658220092 411299671 /nfs/dbraw/zinc/29/96/71/411299671.db2.gz OXOSJYMRQCLCQR-SDDRHHMPSA-N 2 0 246.345 2.352 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CC[C@@]2(C)CC2(F)F)CC[N@@H+]1C ZINC000658223093 411301960 /nfs/dbraw/zinc/30/19/60/411301960.db2.gz SKGZFQSBBJGRJY-WOPDTQHZSA-N 2 0 246.345 2.494 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]1[NH2+][C@@H]1CCC[C@H](C2CC2)C1 ZINC000424388832 411249889 /nfs/dbraw/zinc/24/98/89/411249889.db2.gz ZTBAOSTVEGJWDO-CRWXNKLISA-N 2 0 222.376 2.425 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC2CC(F)(F)C2)CC[NH+]1C ZINC000309810327 411252735 /nfs/dbraw/zinc/25/27/35/411252735.db2.gz UALWFRSSUWQBJF-MWLCHTKSSA-N 2 0 232.318 2.104 20 0 BEADRP C[C@@H]1C[C@H]1C[N@@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000656783360 411359914 /nfs/dbraw/zinc/35/99/14/411359914.db2.gz PWTFOTXWQBWWOT-SNPRPXQTSA-N 2 0 236.403 2.354 20 0 BEADRP CCOc1cccc(CN(C)CC(C)(C)[NH3+])c1 ZINC000656783960 411360941 /nfs/dbraw/zinc/36/09/41/411360941.db2.gz WXGILDONJGRHCF-UHFFFAOYSA-N 2 0 236.359 2.254 20 0 BEADRP C[C@H](C[NH2+]C[C@@H]1CC[NH2+][C@H](C)C1)c1ccccn1 ZINC000656783644 411362009 /nfs/dbraw/zinc/36/20/09/411362009.db2.gz SDQVNSYKGNLUSH-MGPQQGTHSA-N 2 0 247.386 2.163 20 0 BEADRP C([C@@H]1CCC[NH2+]C1)[NH+]1CCC(C2CCC2)CC1 ZINC000656787536 411365376 /nfs/dbraw/zinc/36/53/76/411365376.db2.gz MABBKPAQLJLFRQ-CYBMUJFWSA-N 2 0 236.403 2.498 20 0 BEADRP CC(C)C[NH+]1CCC([C@H]2CCC[NH2+]C2)CC1 ZINC000656787099 411366255 /nfs/dbraw/zinc/36/62/55/411366255.db2.gz SZSWATAKMBUSGM-AWEZNQCLSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@]1(C[NH+]2CCC(C3CCC3)CC2)CC[NH2+]C1 ZINC000656787571 411366495 /nfs/dbraw/zinc/36/64/95/411366495.db2.gz NQPNJYNTFXBFOL-OAHLLOKOSA-N 2 0 236.403 2.498 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]CC2([NH3+])CCCC2)C1 ZINC000656789312 411369228 /nfs/dbraw/zinc/36/92/28/411369228.db2.gz MIPDNXYRKRVJRI-VXGBXAGGSA-N 2 0 210.365 2.426 20 0 BEADRP CC[NH+]1CCC([NH2+]CCCc2ccco2)CC1 ZINC000658327721 411335777 /nfs/dbraw/zinc/33/57/77/411335777.db2.gz QDHQMKMPXWQAJY-UHFFFAOYSA-N 2 0 236.359 2.286 20 0 BEADRP CC1(C[N@@H+]2CCC[C@@]3(CC[NH2+]C3)C2)CCC1 ZINC000336631956 168024017 /nfs/dbraw/zinc/02/40/17/168024017.db2.gz AWFNHJQCAKIOKT-AWEZNQCLSA-N 2 0 222.376 2.252 20 0 BEADRP CC1=C[C@H](C)C[C@@H](C[N@H+]2C[C@H]3C[NH+](C)C[C@H]3C2)C1 ZINC000356392085 168128809 /nfs/dbraw/zinc/12/88/09/168128809.db2.gz JRXNXWFSZXHSLI-DRPJVOAASA-N 2 0 248.414 2.472 20 0 BEADRP CC1CCC([NH2+][C@H]2CCN(C3CC3)C2)CC1 ZINC000044683913 168165087 /nfs/dbraw/zinc/16/50/87/168165087.db2.gz YDWQNCSXFIYZBQ-BPCQOVAHSA-N 2 0 222.376 2.391 20 0 BEADRP C[C@@H]1CN(C)C[C@@H]1[NH2+]C1CCC(C)CC1 ZINC000336751637 168165681 /nfs/dbraw/zinc/16/56/81/168165681.db2.gz GODSGZHAAVXPRL-KPFVRQRISA-N 2 0 210.365 2.105 20 0 BEADRP CC1CC[NH+](C2C[C@H]3CC[C@@H](C2)[NH2+]3)CC1 ZINC000062570050 168178052 /nfs/dbraw/zinc/17/80/52/168178052.db2.gz WTZQPBDMOMBRBT-FUNVUKJBSA-N 2 0 208.349 2.001 20 0 BEADRP CC1CC[NH+](CCCC2CC[NH2+]CC2)CC1 ZINC000050952245 168179239 /nfs/dbraw/zinc/17/92/39/168179239.db2.gz AIPBYDXDZXZAMR-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP CC1CC[NH+](CCC[NH2+]Cc2cc[nH]c2)CC1 ZINC000080773374 168179480 /nfs/dbraw/zinc/17/94/80/168179480.db2.gz UEJRWOUUVMEPPL-UHFFFAOYSA-N 2 0 235.375 2.226 20 0 BEADRP CC1CC[NH+](CC[C@@H]2CCC[N@@H+]2C)CC1 ZINC000124653222 168182106 /nfs/dbraw/zinc/18/21/06/168182106.db2.gz PYZHHAGMZOCYRQ-ZDUSSCGKSA-N 2 0 210.365 2.203 20 0 BEADRP CC1CC[NH+](CC[C@H]2CCC[N@@H+]2C)CC1 ZINC000124653411 168182440 /nfs/dbraw/zinc/18/24/40/168182440.db2.gz PYZHHAGMZOCYRQ-CYBMUJFWSA-N 2 0 210.365 2.203 20 0 BEADRP C[C@H]1CCC[N@H+](Cc2cncs2)[C@H]1CC[NH3+] ZINC000404277094 411387996 /nfs/dbraw/zinc/38/79/96/411387996.db2.gz BEPXJVMDIFBRJT-JQWIXIFHSA-N 2 0 239.388 2.092 20 0 BEADRP CC(C)CC[N@@H+]1CCC[C@@H](C)[C@@H]1CC[NH3+] ZINC000404321811 411391003 /nfs/dbraw/zinc/39/10/03/411391003.db2.gz RFYCWGKIGNNWMX-OLZOCXBDSA-N 2 0 212.381 2.482 20 0 BEADRP C[C@H]1CCC[N@H+](Cc2ccccn2)[C@@H]1CC[NH3+] ZINC000404360295 411391388 /nfs/dbraw/zinc/39/13/88/411391388.db2.gz DWXVNHHJYKQGQV-GXTWGEPZSA-N 2 0 233.359 2.031 20 0 BEADRP CCC(C)(C)CC[N@@H+]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000357075966 168276255 /nfs/dbraw/zinc/27/62/55/168276255.db2.gz JNKMEHOBIWIRMS-QWHCGFSZSA-N 2 0 224.392 2.354 20 0 BEADRP CCC(C)(C)C[NH2+][C@H]1CC[N@H+](C)C[C@H]1C ZINC000336772612 168281965 /nfs/dbraw/zinc/28/19/65/168281965.db2.gz YEGKBODKTPCFPA-NEPJUHHUSA-N 2 0 212.381 2.352 20 0 BEADRP CCC(C)(C)C[NH2+][C@@H]1CC[N@H+](C)C[C@H]1C ZINC000336772617 168282011 /nfs/dbraw/zinc/28/20/11/168282011.db2.gz YEGKBODKTPCFPA-VXGBXAGGSA-N 2 0 212.381 2.352 20 0 BEADRP Cc1ccncc1C[N@H+]1CCC[C@H](C)[C@@H]1CC[NH3+] ZINC000404410481 411395456 /nfs/dbraw/zinc/39/54/56/411395456.db2.gz CESGPANJFKOMOZ-ZFWWWQNUSA-N 2 0 247.386 2.339 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+][C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000647803826 411407272 /nfs/dbraw/zinc/40/72/72/411407272.db2.gz DQQZVFMQEZFQSJ-KSTCHIGDSA-N 2 0 222.376 2.425 20 0 BEADRP C[C@@H](Cc1cccs1)[NH2+]CCC[NH2+]C1CC1 ZINC000382552157 411409092 /nfs/dbraw/zinc/40/90/92/411409092.db2.gz WVLWICMIDJJFPW-NSHDSACASA-N 2 0 238.400 2.411 20 0 BEADRP CCN1CCC[C@H]([NH2+][C@@H]2CCOC(C)(C)C2)C1 ZINC000070359360 411411732 /nfs/dbraw/zinc/41/17/32/411411732.db2.gz GPUBIGUXCZIKMP-OLZOCXBDSA-N 2 0 240.391 2.018 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H]2CO[C@@H](CC)C2)CC1 ZINC000657294022 411449891 /nfs/dbraw/zinc/44/98/91/411449891.db2.gz AHVGVGGPEYOXSV-KGLIPLIRSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@H]([NH2+]Cc1ccnn1-c1cc[nH+]cc1)C1CC1 ZINC000657293015 411453283 /nfs/dbraw/zinc/45/32/83/411453283.db2.gz ISKAHFVQKJFCPM-NSHDSACASA-N 2 0 242.326 2.155 20 0 BEADRP Cc1ccc(C[NH2+][C@@H](C)C2CC[NH+](C)CC2)o1 ZINC000053036253 411475762 /nfs/dbraw/zinc/47/57/62/411475762.db2.gz CDYWPRCXZSWZLK-LBPRGKRZSA-N 2 0 236.359 2.408 20 0 BEADRP CC[NH+]1CCC(CC[NH2+]Cc2ccn(C)c2)CC1 ZINC000126021723 169951402 /nfs/dbraw/zinc/95/14/02/169951402.db2.gz NRMBFMXWUKUWSX-UHFFFAOYSA-N 2 0 249.402 2.237 20 0 BEADRP CC[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)C1CC1 ZINC000655805377 411519019 /nfs/dbraw/zinc/51/90/19/411519019.db2.gz GWTUGBPQYPEDMX-UHTWSYAYSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655805442 411519088 /nfs/dbraw/zinc/51/90/88/411519088.db2.gz HIQANMUBMMPGSW-NDBYEHHHSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1cccc(O)c1 ZINC000655805008 411519630 /nfs/dbraw/zinc/51/96/30/411519630.db2.gz IFDUHHNXPWYCHZ-BZPMIXESSA-N 2 0 248.370 2.383 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1cscn1 ZINC000655805372 411519744 /nfs/dbraw/zinc/51/97/44/411519744.db2.gz MUSIJSWFJZXYGP-GARJFASQSA-N 2 0 239.388 2.134 20 0 BEADRP CCCC[C@H](C)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655807077 411520287 /nfs/dbraw/zinc/52/02/87/411520287.db2.gz HZSLQGDZCWOTIX-RWMBFGLXSA-N 2 0 212.381 2.495 20 0 BEADRP C[C@H](F)CC[NH2+]Cc1ccnn1-c1cc[nH+]cc1 ZINC000657475215 411525316 /nfs/dbraw/zinc/52/53/16/411525316.db2.gz MBTLZJBNPCHIBV-NSHDSACASA-N 2 0 248.305 2.105 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]Cc2ccsc2)C1 ZINC000655826167 411526681 /nfs/dbraw/zinc/52/66/81/411526681.db2.gz RRERIAOMJQQULA-TXEJJXNPSA-N 2 0 224.373 2.178 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCC2CC2)[C@@H](C)C1 ZINC000336671495 170010095 /nfs/dbraw/zinc/01/00/95/170010095.db2.gz YULJXPKRASGVSH-GXTWGEPZSA-N 2 0 224.392 2.449 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CCSC(C)C)[C@H](C)C1 ZINC000336780275 170012022 /nfs/dbraw/zinc/01/20/22/170012022.db2.gz QTCMVVZOZIOSDP-CHWSQXEVSA-N 2 0 244.448 2.448 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+]CCC(C)(C)C)C1 ZINC000037731403 170015693 /nfs/dbraw/zinc/01/56/93/170015693.db2.gz IPLYMIOKLANOGR-GFCCVEGCSA-N 2 0 212.381 2.354 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CCC23CCC3)C1 ZINC000309953720 170016256 /nfs/dbraw/zinc/01/62/56/170016256.db2.gz HIKPEQRBDDCSHZ-CHWSQXEVSA-N 2 0 222.376 2.251 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+]Cc2sccc2C)C1 ZINC000037484198 170016441 /nfs/dbraw/zinc/01/64/41/170016441.db2.gz DJINSBWVKLWPMV-GFCCVEGCSA-N 2 0 238.400 2.488 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2cccnc2)C1 ZINC000037644021 170016735 /nfs/dbraw/zinc/01/67/35/170016735.db2.gz HHPYPQBUVMMREZ-QWHCGFSZSA-N 2 0 233.359 2.074 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CCC[C@@H]3C[C@@]32C)C1 ZINC000337378452 170017386 /nfs/dbraw/zinc/01/73/86/170017386.db2.gz HYGNNKWLFWDWOP-TUVASFSCSA-N 2 0 236.403 2.497 20 0 BEADRP CC[C@@H]1C[C@@H]([NH2+]CCC[N@H+](C)CC(C)C)CO1 ZINC000657501640 411538673 /nfs/dbraw/zinc/53/86/73/411538673.db2.gz YQWCUPIWVUDQML-ZIAGYGMSSA-N 2 0 242.407 2.121 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CC2(C)CC2)[C@H](C)C1 ZINC000309054338 170020882 /nfs/dbraw/zinc/02/08/82/170020882.db2.gz SSWVVRAKGVDXIG-NEPJUHHUSA-N 2 0 210.365 2.106 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]C2CC(F)(F)C2)[C@H](C)C1 ZINC000309676849 170021188 /nfs/dbraw/zinc/02/11/88/170021188.db2.gz YBGGHOUPZHIMMU-KOLCDFICSA-N 2 0 232.318 2.104 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@H]2CCC2(C)C)[C@H](C)C1 ZINC000336778033 170022234 /nfs/dbraw/zinc/02/22/34/170022234.db2.gz KFTMDVOLWASZIW-AGIUHOORSA-N 2 0 224.392 2.495 20 0 BEADRP CC[NH2+]CCN[C@@H](C)c1sc(C)nc1C ZINC000044651748 170116072 /nfs/dbraw/zinc/11/60/72/170116072.db2.gz ZYJOAFFXYTWRAF-QMMMGPOBSA-N 2 0 227.377 2.020 20 0 BEADRP CC[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000032025797 170127785 /nfs/dbraw/zinc/12/77/85/170127785.db2.gz QTRMYTSCFYUECE-UHFFFAOYSA-N 2 0 248.370 2.271 20 0 BEADRP CCOCCC[N@H+](C)[C@@H]1CC[NH+](CC)[C@H](C)C1 ZINC000336708429 170370609 /nfs/dbraw/zinc/37/06/09/170370609.db2.gz HYBIOIAXSRUMFK-ZIAGYGMSSA-N 2 0 242.407 2.218 20 0 BEADRP CC(C)(F)CC[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000657645274 411568849 /nfs/dbraw/zinc/56/88/49/411568849.db2.gz QEINEHCLXSVVHO-NWDGAFQWSA-N 2 0 228.355 2.341 20 0 BEADRP C[C@@H]1CN(C)C[C@@H]1[NH2+][C@@H]1CC[C@@H]1c1ccccc1 ZINC000657713613 411586369 /nfs/dbraw/zinc/58/63/69/411586369.db2.gz IHOQKOMUBNUDJO-MIGQKNRLSA-N 2 0 244.382 2.472 20 0 BEADRP CC1(C)C[C@]1(C)[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000657761394 411591553 /nfs/dbraw/zinc/59/15/53/411591553.db2.gz KAOBNEKQXWUZLL-BZPMIXESSA-N 2 0 222.376 2.391 20 0 BEADRP C[NH+](C)CC(C)(C)C[NH2+][C@H]1CCCSCC1 ZINC000657816862 411605786 /nfs/dbraw/zinc/60/57/86/411605786.db2.gz OTLPHGHBKHHCSS-LBPRGKRZSA-N 2 0 244.448 2.450 20 0 BEADRP C(C[NH2+][C@H]1CCCSCC1)C[NH+]1CCCC1 ZINC000657823931 411607537 /nfs/dbraw/zinc/60/75/37/411607537.db2.gz MCSORWOSMOXSDN-ZDUSSCGKSA-N 2 0 242.432 2.348 20 0 BEADRP C[N@@H+]1CC[C@@]2(CC[NH+](CCC3CCC3)C2)C1 ZINC000660616333 411608173 /nfs/dbraw/zinc/60/81/73/411608173.db2.gz JWEFADYYSQOHJG-CQSZACIVSA-N 2 0 222.376 2.204 20 0 BEADRP C[N@@H+]1CCC[C@@]2(CC[NH+](C[C@@H]3C[C@H]4C[C@H]4C3)C2)C1 ZINC000660641819 411611288 /nfs/dbraw/zinc/61/12/88/411611288.db2.gz KCJUWGWFDFABCX-QKPAOTATSA-N 2 0 248.414 2.450 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+]C1CC(CF)(CF)C1 ZINC000657857646 411612735 /nfs/dbraw/zinc/61/27/35/411612735.db2.gz AZFAJEFVPGOBFT-SNVBAGLBSA-N 2 0 234.334 2.004 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@H]1CCCSCC1 ZINC000657858313 411612746 /nfs/dbraw/zinc/61/27/46/411612746.db2.gz HIRFPCMMZQSPOV-LBPRGKRZSA-N 2 0 230.421 2.204 20 0 BEADRP C[N@@H+]1CC[C@@]2(C1)CCC[NH+](CCC1CC1)C2 ZINC000660657799 411615355 /nfs/dbraw/zinc/61/53/55/411615355.db2.gz AJAUEZKLBFLDMT-CQSZACIVSA-N 2 0 222.376 2.204 20 0 BEADRP c1cc2c(cc[nH+]c2N[C@@H]2CC[N@@H+](C3CC3)C2)[nH]1 ZINC000663424985 411656003 /nfs/dbraw/zinc/65/60/03/411656003.db2.gz MZNMKMKRVYMFJN-SNVBAGLBSA-N 2 0 242.326 2.212 20 0 BEADRP C[C@@H]1C[C@H](Nc2[nH+]ccc3[nH]ccc32)CC[N@@H+]1C ZINC000663661907 411717165 /nfs/dbraw/zinc/71/71/65/411717165.db2.gz SJPBDBIHJHHKHK-GHMZBOCLSA-N 2 0 244.342 2.458 20 0 BEADRP C[C@@H]1C[C@@H](Nc2[nH+]ccc3[nH]ccc32)CC[N@@H+]1C ZINC000663661909 411717661 /nfs/dbraw/zinc/71/76/61/411717661.db2.gz SJPBDBIHJHHKHK-MNOVXSKESA-N 2 0 244.342 2.458 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CC23CC(C2)C[NH2+]3)[C@H](C)C1 ZINC000663497822 411678965 /nfs/dbraw/zinc/67/89/65/411678965.db2.gz KGKHFYFPOJTHQD-WCCYQHBJSA-N 2 0 222.376 2.153 20 0 BEADRP CCc1ncc(C[NH2+]CC[C@@H]([NH3+])C(C)C)s1 ZINC000663497906 411679491 /nfs/dbraw/zinc/67/94/91/411679491.db2.gz ICMHJJYBTGISLE-LLVKDONJSA-N 2 0 241.404 2.169 20 0 BEADRP Cc1ccccc1C[NH2+]CC[C@@H]([NH3+])C(C)C ZINC000663498085 411680844 /nfs/dbraw/zinc/68/08/44/411680844.db2.gz KUBYTCUYZVFCEW-CQSZACIVSA-N 2 0 220.360 2.458 20 0 BEADRP C([NH2+][C@@H]1CCC[C@H](C2CC2)C1)C12CC(C1)C[NH2+]2 ZINC000663498572 411682449 /nfs/dbraw/zinc/68/24/49/411682449.db2.gz QENBSCXGIGXVPI-PIBLMLOJSA-N 2 0 234.387 2.297 20 0 BEADRP CCC[C@H](C)C[NH2+]CC[C@@H]([NH3+])C(C)C ZINC000663499221 411682523 /nfs/dbraw/zinc/68/25/23/411682523.db2.gz GZACLVSXPIFAEC-NWDGAFQWSA-N 2 0 200.370 2.386 20 0 BEADRP CCCC[C@H](COC)[NH2+]CC[C@@H]([NH3+])C(C)C ZINC000663502005 411685121 /nfs/dbraw/zinc/68/51/21/411685121.db2.gz CUBGFRBWBQEPMU-CHWSQXEVSA-N 2 0 230.396 2.155 20 0 BEADRP C[C@@]1(C[N@H+](CCC2CC2)CC2CC2)CC[NH2+]C1 ZINC000663502228 411685174 /nfs/dbraw/zinc/68/51/74/411685174.db2.gz FXFWMEDGDOBNRY-OAHLLOKOSA-N 2 0 236.403 2.498 20 0 BEADRP C[C@H](C[NH2+]CC12CC(C1)C[NH2+]2)C(C)(C)C ZINC000663501492 411685434 /nfs/dbraw/zinc/68/54/34/411685434.db2.gz WMSCHKBDXFZGSX-XSRFYTQQSA-N 2 0 210.365 2.010 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+]CCC(C)(C)C ZINC000663504067 411687538 /nfs/dbraw/zinc/68/75/38/411687538.db2.gz VQZWGLXMCHBDDI-LLVKDONJSA-N 2 0 200.370 2.386 20 0 BEADRP C[NH2+]C[C@H](C)[NH2+][C@@H]1CCC[C@H](C2CC2)C1 ZINC000663509287 411691916 /nfs/dbraw/zinc/69/19/16/411691916.db2.gz IQJWPNRHMBRXDP-WCFLWFBJSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)[N@H+](C)CCNc1[nH+]ccc2[nH]ccc21 ZINC000663523335 411696437 /nfs/dbraw/zinc/69/64/37/411696437.db2.gz WKOLMYMTEWFHJN-UHFFFAOYSA-N 2 0 232.331 2.315 20 0 BEADRP CC[C@H](C[C@@H](C)CC)[NH2+][C@H](C)C[NH2+]C ZINC000663514825 411696923 /nfs/dbraw/zinc/69/69/23/411696923.db2.gz UKOQVGFPTSSVHV-QJPTWQEYSA-N 2 0 200.370 2.399 20 0 BEADRP CC[C@H](C)C[C@H](CC)[NH2+][C@@H](C)C[NH2+]C ZINC000663514827 411697882 /nfs/dbraw/zinc/69/78/82/411697882.db2.gz UKOQVGFPTSSVHV-SRVKXCTJSA-N 2 0 200.370 2.399 20 0 BEADRP Cc1[nH+]ccc(NCC[C@H](C)[NH+](C)C)c1Cl ZINC000664246034 411896565 /nfs/dbraw/zinc/89/65/65/411896565.db2.gz RNWJIIHNZJLJNG-VIFPVBQESA-N 2 0 241.766 2.217 20 0 BEADRP C[N@H+](CCOC(C)(C)C)CCC1CC[NH2+]CC1 ZINC000133722642 411920169 /nfs/dbraw/zinc/92/01/69/411920169.db2.gz HDDJIPJNPDHWOK-UHFFFAOYSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCCC[C@@H]1C[NH3+])C1CC1 ZINC000132466019 411981457 /nfs/dbraw/zinc/98/14/57/411981457.db2.gz CQAWMUIBBGEBEE-RTXFEEFZSA-N 2 0 210.365 2.140 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCCC[C@@H]1C[NH3+])C1CC1 ZINC000132465642 411981874 /nfs/dbraw/zinc/98/18/74/411981874.db2.gz CQAWMUIBBGEBEE-RAIGVLPGSA-N 2 0 210.365 2.140 20 0 BEADRP C(C[N@H+](C1CC1)C1CC[NH2+]CC1)C1CCC1 ZINC000662234205 412033113 /nfs/dbraw/zinc/03/31/13/412033113.db2.gz JQQDRIZFMDSKBH-UHFFFAOYSA-N 2 0 222.376 2.393 20 0 BEADRP C[NH2+]C[C@H]1CCC[N@H+](CCCC2CCC2)C1 ZINC000662237869 412034864 /nfs/dbraw/zinc/03/48/64/412034864.db2.gz KYTDOXPGTDZRDJ-CQSZACIVSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H]([NH3+])C1CC[NH+](C[C@@H]2C[C@H]3C[C@H]3C2)CC1 ZINC000662244762 412040799 /nfs/dbraw/zinc/04/07/99/412040799.db2.gz HGKWRRHHQRLNMQ-MHDGFBEUSA-N 2 0 222.376 2.092 20 0 BEADRP CC[C@H](CC(F)F)CN1CCC[C@H]([NH2+]C)C1 ZINC000662247198 412044286 /nfs/dbraw/zinc/04/42/86/412044286.db2.gz VHUUSLAFMWWLCV-MNOVXSKESA-N 2 0 234.334 2.352 20 0 BEADRP C[N@H+](CCC[NH3+])CC[C@H]1CCc2ccccc21 ZINC000662247468 412045382 /nfs/dbraw/zinc/04/53/82/412045382.db2.gz ZGIPODSWMJCCGY-CQSZACIVSA-N 2 0 232.371 2.387 20 0 BEADRP C[NH2+]CCC1CC[NH+](C[C@@H]2C[C@H]3C[C@H]3C2)CC1 ZINC000662263777 412055313 /nfs/dbraw/zinc/05/53/13/412055313.db2.gz FFVHEUCBZSWDDZ-QDMKHBRRSA-N 2 0 236.403 2.354 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]CC1(N(C)C)CCC1 ZINC000308935120 171041625 /nfs/dbraw/zinc/04/16/25/171041625.db2.gz KRNDKKYMXYFXPT-NEPJUHHUSA-N 2 0 210.365 2.249 20 0 BEADRP C(CC1CCC1)C[NH+]1CCC2(CC[NH2+]2)CC1 ZINC000662282338 412073111 /nfs/dbraw/zinc/07/31/11/412073111.db2.gz GNDSXJJWKDOQAO-UHFFFAOYSA-N 2 0 222.376 2.395 20 0 BEADRP CC(C)=CCC[N@H+]1CC[C@@H](C)[C@@H](C[NH3+])C1 ZINC000662282663 412073546 /nfs/dbraw/zinc/07/35/46/412073546.db2.gz PRRMRGUIPJKGAF-OLZOCXBDSA-N 2 0 210.365 2.259 20 0 BEADRP [NH3+][C@@H]1CCCC[C@H]1[NH2+]CCCC1CCC1 ZINC000662283066 412076098 /nfs/dbraw/zinc/07/60/98/412076098.db2.gz KFDJGFITTGEUGN-CHWSQXEVSA-N 2 0 210.365 2.426 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCC[C@@H]2C[NH+](C)CC[C@H]21 ZINC000336686532 171281408 /nfs/dbraw/zinc/28/14/08/171281408.db2.gz WNVIOSPCKKQOTF-BFHYXJOUSA-N 2 0 224.392 2.449 20 0 BEADRP CC[C@H](C)C[NH2+]CC1(SC)CC[NH+](C)CC1 ZINC000309690863 171283582 /nfs/dbraw/zinc/28/35/82/171283582.db2.gz JEVZYVKUEGYSEW-LBPRGKRZSA-N 2 0 244.448 2.450 20 0 BEADRP CC[C@H](C)C[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000037485296 171285470 /nfs/dbraw/zinc/28/54/70/171285470.db2.gz GBTOSBZJTUUTDM-NWDGAFQWSA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@H](C)C[NH2+][C@@H]1CC[N@H+](CC)C[C@H]1C ZINC000309220314 171286519 /nfs/dbraw/zinc/28/65/19/171286519.db2.gz VDABTMBQWNUWGD-YNEHKIRRSA-N 2 0 212.381 2.352 20 0 BEADRP C[NH2+]CCC[N@H+](C)Cc1cccc2ncccc12 ZINC000662294954 412084260 /nfs/dbraw/zinc/08/42/60/412084260.db2.gz INLSVMTVKWKMIE-UHFFFAOYSA-N 2 0 243.354 2.276 20 0 BEADRP CC[C@H](C)[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000308930157 171339675 /nfs/dbraw/zinc/33/96/75/171339675.db2.gz JHTSEFKXPIVZSL-HIFPTAJRSA-N 2 0 210.365 2.391 20 0 BEADRP CC[C@H](C)[NH2+]C[C@@H]1Cc2ccccc2CN1 ZINC000040408012 171340782 /nfs/dbraw/zinc/34/07/82/171340782.db2.gz HZWPRKXGVPXDLM-FZMZJTMJSA-N 2 0 218.344 2.089 20 0 BEADRP CC[C@H](C)[NH2+]C[C@@H](C)Cn1ccnc1C ZINC000167307343 171341384 /nfs/dbraw/zinc/34/13/84/171341384.db2.gz DMQWULWDXFDCLB-MNOVXSKESA-N 2 0 209.337 2.216 20 0 BEADRP CC(C)[NH+]1CCC([C@H]2CCC[NH2+]C2)CC1 ZINC000662290145 412079450 /nfs/dbraw/zinc/07/94/50/412079450.db2.gz LDGFOMUWNWIYNR-ZDUSSCGKSA-N 2 0 210.365 2.106 20 0 BEADRP FCCC[N@@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000662293047 412080310 /nfs/dbraw/zinc/08/03/10/412080310.db2.gz IYQKPTRUHJANFF-ZDUSSCGKSA-N 2 0 228.355 2.058 20 0 BEADRP C(C[NH+]1CCC(C2CCC2)CC1)[C@@H]1CC[NH2+]C1 ZINC000662299292 412087212 /nfs/dbraw/zinc/08/72/12/412087212.db2.gz NKVAYJUBZADEHJ-ZDUSSCGKSA-N 2 0 236.403 2.498 20 0 BEADRP COc1cccc([C@@H](C)N2CC3CC2(C[NH3+])C3)c1 ZINC000662304393 412088407 /nfs/dbraw/zinc/08/84/07/412088407.db2.gz QPGPEXSQUIKTLY-XIKARTHZSA-N 2 0 246.354 2.179 20 0 BEADRP C[C@H](c1ccc(F)cc1)N1CC2CC1(C[NH3+])C2 ZINC000662304406 412089458 /nfs/dbraw/zinc/08/94/58/412089458.db2.gz RIVGUOHQXNEPPV-CDWSIMAYSA-N 2 0 234.318 2.310 20 0 BEADRP C[C@H]([NH3+])C[N@@H+]1CC[C@@H](C2CCCCC2)C1 ZINC000662305363 412090350 /nfs/dbraw/zinc/09/03/50/412090350.db2.gz GFAUVCRMZADUSQ-WCQYABFASA-N 2 0 210.365 2.236 20 0 BEADRP C[C@@H]1CCC[N@H+](Cc2ccccn2)[C@@H]1CCC[NH3+] ZINC000662311525 412094372 /nfs/dbraw/zinc/09/43/72/412094372.db2.gz BPCZYKDOVDUGLV-UKRRQHHQSA-N 2 0 247.386 2.421 20 0 BEADRP CC[C@@H](C)C[N@@H+]1CCO[C@H](CCC[NH+](C)C)C1 ZINC000662319150 412098497 /nfs/dbraw/zinc/09/84/97/412098497.db2.gz FMIAHFDZJBGLFE-ZIAGYGMSSA-N 2 0 242.407 2.075 20 0 BEADRP CC(C)CC[N@@H+]1CCO[C@H](CCC[NH+](C)C)C1 ZINC000662319934 412098536 /nfs/dbraw/zinc/09/85/36/412098536.db2.gz QWXRRTRVUVYXFJ-CQSZACIVSA-N 2 0 242.407 2.075 20 0 BEADRP C[N@H+](C[C@@H]1CC[NH2+]C1)C[C@@H]1CCc2ccccc21 ZINC000662322544 412100813 /nfs/dbraw/zinc/10/08/13/412100813.db2.gz NAFDBNYXEDMZFS-HIFRSBDPSA-N 2 0 244.382 2.258 20 0 BEADRP [NH3+][C@@H]1CN(Cc2ccc(C3CC3)cc2)CC[C@H]1F ZINC000662325353 412102714 /nfs/dbraw/zinc/10/27/14/412102714.db2.gz FDKJPPCLRNPPNJ-HUUCEWRRSA-N 2 0 248.345 2.435 20 0 BEADRP c1ccc(C23CC(C2)C[N@H+]3C[C@H]2CC[NH2+]C2)cc1 ZINC000662328526 412104261 /nfs/dbraw/zinc/10/42/61/412104261.db2.gz RPPAUNBWWAEVMH-HLIUYOAVSA-N 2 0 242.366 2.217 20 0 BEADRP C[N@H+](CC[C@H]1CCC[NH+]1C)C[C@H]1CC1(C)C ZINC000662345686 412115899 /nfs/dbraw/zinc/11/58/99/412115899.db2.gz LCEFZRZFNCCBPN-CHWSQXEVSA-N 2 0 224.392 2.449 20 0 BEADRP Cc1ccncc1CC[NH2+][C@@H](C)CCCC[NH3+] ZINC000665238914 412179744 /nfs/dbraw/zinc/17/97/44/412179744.db2.gz HJAKZXIZEOBSQK-ZDUSSCGKSA-N 2 0 235.375 2.040 20 0 BEADRP C[C@]12C[C@H]1CCC[C@@H]2[NH2+]CC1([NH3+])CCCC1 ZINC000665246776 412184907 /nfs/dbraw/zinc/18/49/07/412184907.db2.gz NMNGIEIZHKJXRK-AGIUHOORSA-N 2 0 222.376 2.426 20 0 BEADRP CC1(C)[C@H](C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)C1(F)F ZINC000665274802 412214864 /nfs/dbraw/zinc/21/48/64/412214864.db2.gz YOYFCEQJVGPCNP-UTLUCORTSA-N 2 0 232.318 2.137 20 0 BEADRP COCC[C@H]1CCC[C@@H]1[NH2+]CC1([NH3+])CCCC1 ZINC000665246773 412190886 /nfs/dbraw/zinc/19/08/86/412190886.db2.gz NLKORYJHHUHKCS-OLZOCXBDSA-N 2 0 240.391 2.053 20 0 BEADRP COCC[C@H]1CCC[C@H]1[NH2+]CC1([NH3+])CCCC1 ZINC000665246772 412191509 /nfs/dbraw/zinc/19/15/09/412191509.db2.gz NLKORYJHHUHKCS-CHWSQXEVSA-N 2 0 240.391 2.053 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[C@@H]2C[C@@H]21)[C@H]1CCC[NH2+]1 ZINC000665263051 412205740 /nfs/dbraw/zinc/20/57/40/412205740.db2.gz FDRATALTNLTQEE-ZUWCUPBKSA-N 2 0 222.376 2.153 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000665263927 412207160 /nfs/dbraw/zinc/20/71/60/412207160.db2.gz YGYQNYSWMCGXEK-QMVSFRDZSA-N 2 0 222.376 2.140 20 0 BEADRP C[C@]1(C[NH2+][C@H]2CCCCC[C@@H]2[NH3+])CC1(F)F ZINC000665266802 412210083 /nfs/dbraw/zinc/21/00/83/412210083.db2.gz KCAZIQOFVCKVRM-GARJFASQSA-N 2 0 232.318 2.281 20 0 BEADRP C[C@H]([NH2+]CCCC1CCC1)[C@H]1CCC[NH2+]1 ZINC000665267488 412211034 /nfs/dbraw/zinc/21/10/34/412211034.db2.gz XOFSRDPNADRGNI-WCQYABFASA-N 2 0 210.365 2.297 20 0 BEADRP COC1CC(CC[NH2+][C@@H]2CCCCC[C@@H]2[NH3+])C1 ZINC000665229851 412167832 /nfs/dbraw/zinc/16/78/32/412167832.db2.gz DYQAVZQTQQNXGL-CLRIEMFWSA-N 2 0 240.391 2.051 20 0 BEADRP COC1CC(CC[NH2+][C@H]2CCCCC[C@H]2[NH3+])C1 ZINC000665229854 412168581 /nfs/dbraw/zinc/16/85/81/412168581.db2.gz DYQAVZQTQQNXGL-PQAZSJQKSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H]([NH2+]Cc1cccc(N)c1)C1CC[NH+](C)CC1 ZINC000665233630 412172395 /nfs/dbraw/zinc/17/23/95/412172395.db2.gz LYDYFKAKWHOXMD-GFCCVEGCSA-N 2 0 247.386 2.089 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC[NH2+]CC[C@H]1C)c1ccccn1 ZINC000665232904 412172964 /nfs/dbraw/zinc/17/29/64/412172964.db2.gz XJYANQPOBIAIPY-NFAWXSAZSA-N 2 0 247.386 2.163 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+][C@@H]1CC[C@@H]1c1ccccc1 ZINC000665274022 412216221 /nfs/dbraw/zinc/21/62/21/412216221.db2.gz ICUJSGBQJRROHZ-KBUPBQIOSA-N 2 0 230.355 2.402 20 0 BEADRP CC1(C)[C@@H](C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1(F)F ZINC000665274258 412217723 /nfs/dbraw/zinc/21/77/23/412217723.db2.gz MJIRZSRUAFTZIC-KJLIAQIISA-N 2 0 244.329 2.150 20 0 BEADRP CC1(C)[C@H](C[NH2+][C@@H]2CCCC[C@H]2C[NH3+])C1(F)F ZINC000665274097 412218145 /nfs/dbraw/zinc/21/81/45/412218145.db2.gz JMOVZXYTSIZFRJ-AXFHLTTASA-N 2 0 246.345 2.385 20 0 BEADRP CC(C)(C)[C@@H]1CC[C@H]1[NH2+]CC12CC(C1)C[NH2+]2 ZINC000665279532 412220729 /nfs/dbraw/zinc/22/07/29/412220729.db2.gz FSKGIXKNCCSKMZ-CBKZZEEASA-N 2 0 222.376 2.153 20 0 BEADRP CC(C)(C)[C@H]1CC[C@H]1[NH2+]CC12CC(C1)C[NH2+]2 ZINC000665279533 412221294 /nfs/dbraw/zinc/22/12/94/412221294.db2.gz FSKGIXKNCCSKMZ-MRFPXMQZSA-N 2 0 222.376 2.153 20 0 BEADRP CC[C@@H](C)[C@@H](C)[NH2+]CC[C@@H]([NH3+])C(C)C ZINC000665279328 412223363 /nfs/dbraw/zinc/22/33/63/412223363.db2.gz ANAABICCSJWKKR-IJLUTSLNSA-N 2 0 200.370 2.384 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+][C@H](C)c1ccncc1 ZINC000665280807 412223388 /nfs/dbraw/zinc/22/33/88/412223388.db2.gz MEUDKJRPNHQCQV-DGCLKSJQSA-N 2 0 221.348 2.106 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+][C@@H](C)c1ccncc1 ZINC000665280808 412223541 /nfs/dbraw/zinc/22/35/41/412223541.db2.gz MEUDKJRPNHQCQV-WCQYABFASA-N 2 0 221.348 2.106 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+][C@H](C)c1cncc(F)c1 ZINC000665280718 412225281 /nfs/dbraw/zinc/22/52/81/412225281.db2.gz JNLSCOUWMKOQJB-ZWNOBZJWSA-N 2 0 239.338 2.245 20 0 BEADRP CC[C@@H]([NH2+]CC[C@@H]([NH3+])C(C)C)c1ccncc1 ZINC000665282537 412227532 /nfs/dbraw/zinc/22/75/32/412227532.db2.gz ZVYYNCKAYHYJIZ-ZIAGYGMSSA-N 2 0 235.375 2.496 20 0 BEADRP C[NH2+]C[C@H](C)[NH2+][C@H](C)[C@@H]1CCCC[C@@H]1C ZINC000665297312 412238144 /nfs/dbraw/zinc/23/81/44/412238144.db2.gz CYIHLQWSMVYRMH-WUHRBBMRSA-N 2 0 212.381 2.399 20 0 BEADRP COc1cccc(C[NH2+][C@@H]2CCC[C@H]2C[NH3+])c1C ZINC000665294851 412240317 /nfs/dbraw/zinc/24/03/17/412240317.db2.gz XPGCKEHSDMXZON-GXTWGEPZSA-N 2 0 248.370 2.221 20 0 BEADRP COc1cccc(C[NH2+][C@H](C)C[C@H](C)[NH3+])c1C ZINC000665294831 412240491 /nfs/dbraw/zinc/24/04/91/412240491.db2.gz XIGIGBULIMNYGX-WDEREUQCSA-N 2 0 236.359 2.219 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH2+]Cc2ccccc2)CC1 ZINC000076647102 173021371 /nfs/dbraw/zinc/02/13/71/173021371.db2.gz UNVBVZINQUNNCC-CQSZACIVSA-N 2 0 218.344 2.261 20 0 BEADRP C[N@@H+]1CCC[C@@H]1CC[NH+]1CCC[C@H]1C1CC1 ZINC000371205637 173028695 /nfs/dbraw/zinc/02/86/95/173028695.db2.gz UFPOVXQRKAGYNL-KGLIPLIRSA-N 2 0 222.376 2.345 20 0 BEADRP C[N@@H+]1CCC[C@@H]2C[NH+](C3CCCC3)CC[C@@H]21 ZINC000120117657 173036390 /nfs/dbraw/zinc/03/63/90/173036390.db2.gz PYGVYQQLMWTVOK-OCCSQVGLSA-N 2 0 222.376 2.345 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+]Cc2ccccc2)C1 ZINC000044534109 173040334 /nfs/dbraw/zinc/04/03/34/173040334.db2.gz ACWIQGVZQNTNBK-CQSZACIVSA-N 2 0 218.344 2.118 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@H]2CCC[C@@H]3C[C@@H]32)C1 ZINC000568248685 322930601 /nfs/dbraw/zinc/93/06/01/322930601.db2.gz XWIVASLKZZZUOQ-KVSVUVNWSA-N 2 0 208.349 2.035 20 0 BEADRP C[N@@H+]1CCC[C@H]2C[NH+](CC3CCC3)CC[C@H]21 ZINC000336585047 173059928 /nfs/dbraw/zinc/05/99/28/173059928.db2.gz BIGZDHSREYJGTI-UONOGXRCSA-N 2 0 222.376 2.203 20 0 BEADRP C[NH2+]CC1CC[NH+](Cc2sccc2C)CC1 ZINC000063158957 173338301 /nfs/dbraw/zinc/33/83/01/173338301.db2.gz WDUSGOYFQHDYPZ-UHFFFAOYSA-N 2 0 238.400 2.488 20 0 BEADRP C[NH2+]CC1CC[NH+](Cc2ccccc2F)CC1 ZINC000011889157 173338380 /nfs/dbraw/zinc/33/83/80/173338380.db2.gz XWYDOBYPCHYQAR-UHFFFAOYSA-N 2 0 236.334 2.257 20 0 BEADRP C[NH2+]CCC1CC[NH+](CC2CCCC2)CC1 ZINC000070534515 173342973 /nfs/dbraw/zinc/34/29/73/173342973.db2.gz ONYLPSQZDMMKFP-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP C[NH2+]CCC1CC[NH+](CCCCCF)CC1 ZINC000304351079 173343188 /nfs/dbraw/zinc/34/31/88/173343188.db2.gz GNUUWVKXESAGAT-UHFFFAOYSA-N 2 0 230.371 2.448 20 0 BEADRP C[NH2+]CCC[N@@H+]1CC[C@@H]2CCCC[C@@H]2C1 ZINC000042409653 173346986 /nfs/dbraw/zinc/34/69/86/173346986.db2.gz QFWJZBGJOJTABE-QWHCGFSZSA-N 2 0 210.365 2.108 20 0 BEADRP C[NH2+]CCC[NH2+]Cc1ccc(OC(C)C)cc1 ZINC000040719705 173349753 /nfs/dbraw/zinc/34/97/53/173349753.db2.gz LLFGUYOCNXPSLQ-UHFFFAOYSA-N 2 0 236.359 2.173 20 0 BEADRP C[NH2+]C[C@@H]1CCC[N@H+](Cc2ccc(C)cc2)C1 ZINC000011888686 173367820 /nfs/dbraw/zinc/36/78/20/173367820.db2.gz NBDZLTAQQKGRPX-HNNXBMFYSA-N 2 0 232.371 2.426 20 0 BEADRP C[NH2+]C[C@@H]1CCCN1CCCc1ccccc1 ZINC000019933377 173368719 /nfs/dbraw/zinc/36/87/19/173368719.db2.gz ODHLWWDBQSRVOF-HNNXBMFYSA-N 2 0 232.371 2.303 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](Cc2cc(C)sc2C)C1 ZINC000070798766 173370613 /nfs/dbraw/zinc/37/06/13/173370613.db2.gz MJNQEDSYKDMNMV-LBPRGKRZSA-N 2 0 238.400 2.406 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](Cc2ccc(C)cc2)C1 ZINC000011891910 173370980 /nfs/dbraw/zinc/37/09/80/173370980.db2.gz MUPCTGVRWFSYKH-AWEZNQCLSA-N 2 0 218.344 2.036 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@@H+]([C@@H](C)c2cccc(OC)c2)C1 ZINC000221275590 173371305 /nfs/dbraw/zinc/37/13/05/173371305.db2.gz SSYYRUZYGDJCRT-STQMWFEESA-N 2 0 248.370 2.298 20 0 BEADRP C[NH2+]C[C@H](C)CNc1cc[nH+]c(C)c1Cl ZINC000309028460 173375329 /nfs/dbraw/zinc/37/53/29/173375329.db2.gz ZSOILRKKMMMFDN-QMMMGPOBSA-N 2 0 227.739 2.311 20 0 BEADRP COC1(C[NH2+]CCCC[NH+](C)C)CCCCC1 ZINC000319622726 174000519 /nfs/dbraw/zinc/00/05/19/174000519.db2.gz LNZVOXMYNJDDNA-UHFFFAOYSA-N 2 0 242.407 2.267 20 0 BEADRP COCCCCC[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000122780341 174183284 /nfs/dbraw/zinc/18/32/84/174183284.db2.gz HXWYPAAIKSJWOV-UHFFFAOYSA-N 2 0 242.407 2.266 20 0 BEADRP COCCCC[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000118001087 174189827 /nfs/dbraw/zinc/18/98/27/174189827.db2.gz OZPNPNHUHVSVIC-UHFFFAOYSA-N 2 0 242.407 2.077 20 0 BEADRP COCc1ccccc1C[NH2+][C@H](C)CCC[NH3+] ZINC000310548404 174634489 /nfs/dbraw/zinc/63/44/89/174634489.db2.gz TVQXUCCDBNKDOL-GFCCVEGCSA-N 2 0 236.359 2.050 20 0 BEADRP COc1ccc(C)cc1C[N@@H+]1CCC[C@@H](C[NH3+])C1 ZINC000044530037 175075103 /nfs/dbraw/zinc/07/51/03/175075103.db2.gz IYAXYRIEBWOIBS-ZDUSSCGKSA-N 2 0 248.370 2.174 20 0 BEADRP COc1ccc(C)cc1[C@@H](C)[NH2+]CCCC[NH3+] ZINC000037715011 175079459 /nfs/dbraw/zinc/07/94/59/175079459.db2.gz ZHDSUZGUCBYQNF-GFCCVEGCSA-N 2 0 236.359 2.393 20 0 BEADRP COc1ccc(C[NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000090720843 175112043 /nfs/dbraw/zinc/11/20/43/175112043.db2.gz ZEPDVHIRKNEXMG-OCCSQVGLSA-N 2 0 248.370 2.268 20 0 BEADRP COc1ccc(C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)cc1 ZINC000093209644 175112141 /nfs/dbraw/zinc/11/21/41/175112141.db2.gz DIOOHLZCSWWPID-OLZOCXBDSA-N 2 0 234.343 2.055 20 0 BEADRP COc1ccc([C@@H](C)[NH2+][C@@H](C)CCC[NH3+])cc1 ZINC000310171117 175176858 /nfs/dbraw/zinc/17/68/58/175176858.db2.gz TYNLFRBYEWLCIE-NWDGAFQWSA-N 2 0 236.359 2.473 20 0 BEADRP COc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[NH2+]C2)cc1 ZINC000107786862 175176998 /nfs/dbraw/zinc/17/69/98/175176998.db2.gz CNNVLLABCHYLHR-OLZOCXBDSA-N 2 0 248.370 2.345 20 0 BEADRP COc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@H]2C[NH3+])cc1 ZINC000160096870 175189032 /nfs/dbraw/zinc/18/90/32/175189032.db2.gz IVPAUBUHIADKKF-CORIIIEPSA-N 2 0 248.370 2.473 20 0 BEADRP COc1cccc(C[N@@H+]2CCC[C@H]([C@@H](C)[NH3+])C2)c1 ZINC000111695793 175258744 /nfs/dbraw/zinc/25/87/44/175258744.db2.gz GUWXPNDUXZQJOC-OCCSQVGLSA-N 2 0 248.370 2.254 20 0 BEADRP COc1cccc(C[N@@H+]2CCCC[C@H]2CC[NH3+])c1 ZINC000075778003 175258765 /nfs/dbraw/zinc/25/87/65/175258765.db2.gz FDQVTMVPDHIXLQ-AWEZNQCLSA-N 2 0 248.370 2.399 20 0 BEADRP COc1cccc(C[NH2+][C@@H](C)CCCC[NH3+])c1 ZINC000336721158 175265430 /nfs/dbraw/zinc/26/54/30/175265430.db2.gz SJMFBCUWCMFWBT-LBPRGKRZSA-N 2 0 236.359 2.302 20 0 BEADRP COc1cccc(C[NH2+][C@H](C)CCCC[NH3+])c1 ZINC000336721157 175266485 /nfs/dbraw/zinc/26/64/85/175266485.db2.gz SJMFBCUWCMFWBT-GFCCVEGCSA-N 2 0 236.359 2.302 20 0 BEADRP COc1cccc([C@@H](C)[NH2+][C@H]2CCC[NH2+]CC2)c1 ZINC000129132381 175287522 /nfs/dbraw/zinc/28/75/22/175287522.db2.gz JFZOBWXVDUVZDY-OCCSQVGLSA-N 2 0 248.370 2.488 20 0 BEADRP COc1cccc([C@H](C)[N@@H+]2CC[C@@H]([C@@H](C)[NH3+])C2)c1 ZINC000226537924 175292151 /nfs/dbraw/zinc/29/21/51/175292151.db2.gz HLUMIFWZKIFFGL-MBNYWOFBSA-N 2 0 248.370 2.425 20 0 BEADRP COc1cccc([C@H](C)[N@@H+]2CCC[C@H](C[NH3+])C2)c1 ZINC000044527653 175292247 /nfs/dbraw/zinc/29/22/47/175292247.db2.gz RRFGCTKXUIJSCM-QWHCGFSZSA-N 2 0 248.370 2.427 20 0 BEADRP COc1cccc([C@H](C)[NH2+][C@H]2CCC[NH2+]CC2)c1 ZINC000129132163 175293123 /nfs/dbraw/zinc/29/31/23/175293123.db2.gz JFZOBWXVDUVZDY-JSGCOSHPSA-N 2 0 248.370 2.488 20 0 BEADRP COc1cccc([C@H](C)[NH2+]CCCC[NH3+])c1 ZINC000037714843 175293303 /nfs/dbraw/zinc/29/33/03/175293303.db2.gz YYVBZAJEJZNQLV-NSHDSACASA-N 2 0 222.332 2.085 20 0 BEADRP COc1ccccc1C[N@@H+]1CCC[C@H]([C@@H](C)[NH3+])C1 ZINC000113655520 175326970 /nfs/dbraw/zinc/32/69/70/175326970.db2.gz KWZVMWUXGYEKGM-OLZOCXBDSA-N 2 0 248.370 2.254 20 0 BEADRP COc1ccccc1[C@@H](C)[NH2+]CCCC[NH3+] ZINC000037714779 175345425 /nfs/dbraw/zinc/34/54/25/175345425.db2.gz QGCSJMPWNURCTQ-LLVKDONJSA-N 2 0 222.332 2.085 20 0 BEADRP COc1ccccc1[C@H](C)[NH2+][C@H](C)CCC[NH3+] ZINC000310492848 175352337 /nfs/dbraw/zinc/35/23/37/175352337.db2.gz GICWDQSXUGDCNP-NEPJUHHUSA-N 2 0 236.359 2.473 20 0 BEADRP CSC1(C[NH2+][C@@H](C)C2CC2)CC[NH+](C)CC1 ZINC000336709522 175452758 /nfs/dbraw/zinc/45/27/58/175452758.db2.gz RIFVQVRKHMZCIG-NSHDSACASA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H]1COc2ccccc2C1 ZINC000336887902 175663283 /nfs/dbraw/zinc/66/32/83/175663283.db2.gz DOMQDECYEBYOGZ-JSGCOSHPSA-N 2 0 248.370 2.097 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CC[C@@H]1CCCCO1 ZINC000309356532 175663454 /nfs/dbraw/zinc/66/34/54/175663454.db2.gz NLFLWETVPPJVBG-STQMWFEESA-N 2 0 228.380 2.053 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]CCc1ccccc1F ZINC000309457772 175664858 /nfs/dbraw/zinc/66/48/58/175664858.db2.gz REBIOQAJIZUSGX-NSHDSACASA-N 2 0 224.323 2.085 20 0 BEADRP C[C@@H]([NH3+])C1CC[NH+](CCc2ccccc2)CC1 ZINC000111611493 175801396 /nfs/dbraw/zinc/80/13/96/175801396.db2.gz MMHBYTQADPVQIA-CYBMUJFWSA-N 2 0 232.371 2.288 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC1(C)C)C1CC[NH+](C)CC1 ZINC000045116892 175923646 /nfs/dbraw/zinc/92/36/46/175923646.db2.gz QOWUDHRBLVHKNP-PWSUYJOCSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@@H](c1ccccc1)[N@@H+]1CC[C@H](CC[NH3+])C1 ZINC000083008667 176022268 /nfs/dbraw/zinc/02/22/68/176022268.db2.gz VUQMMBROUBKCLF-STQMWFEESA-N 2 0 218.344 2.418 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[N@@H+]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000357045030 176076184 /nfs/dbraw/zinc/07/61/84/176076184.db2.gz HMEVJWXMEMXBFD-KBUPBQIOSA-N 2 0 236.403 2.354 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]CC2=CC[N@H+](C)CC2)C1 ZINC000309769225 176123152 /nfs/dbraw/zinc/12/31/52/176123152.db2.gz KCHPGNKXHCYYBZ-TZMCWYRMSA-N 2 0 222.376 2.417 20 0 BEADRP C[C@@H]1CCC[C@H](CC[N@H+]2C[C@H]3C[NH2+]C[C@H]3C2)C1 ZINC000359294844 176136785 /nfs/dbraw/zinc/13/67/85/176136785.db2.gz AUVFLLAFSVICSF-TUVASFSCSA-N 2 0 236.403 2.354 20 0 BEADRP C[C@@H]1CC[N@H+](Cc2ccc(F)cc2)C[C@@H]1C[NH3+] ZINC000163392335 176173534 /nfs/dbraw/zinc/17/35/34/176173534.db2.gz FEBDUFSVLGLESC-YPMHNXCESA-N 2 0 236.334 2.242 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]C[C@]1(C)CCCS1 ZINC000120434967 176268755 /nfs/dbraw/zinc/26/87/55/176268755.db2.gz ZQMWPIMOALWDCD-AGIUHOORSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]C[C@@H]1CCCSC1 ZINC000304519487 176269168 /nfs/dbraw/zinc/26/91/68/176269168.db2.gz PEYPHDYBPMHZBG-AGIUHOORSA-N 2 0 242.432 2.059 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]C[C@H]1CCCCS1 ZINC000336781262 176269297 /nfs/dbraw/zinc/26/92/97/176269297.db2.gz UEXONEOUPWBHFP-UPJWGTAASA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]C[C@H]1CCC(F)(F)C1 ZINC000302212482 176270428 /nfs/dbraw/zinc/27/04/28/176270428.db2.gz XWTJNLFAVVKOJY-GRYCIOLGSA-N 2 0 246.345 2.352 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]CC(C)(C)C ZINC000040492884 176277966 /nfs/dbraw/zinc/27/79/66/176277966.db2.gz ZERYNCXKMOEEKK-UTUOFQBUSA-N 2 0 212.381 2.351 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+][C@H]1CCC1(C)C ZINC000309218654 176278159 /nfs/dbraw/zinc/27/81/59/176278159.db2.gz PYWUDQVXWOJGAQ-NDBYEHHHSA-N 2 0 224.392 2.493 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]CCCCF ZINC000336713682 176278299 /nfs/dbraw/zinc/27/82/99/176278299.db2.gz VSEKDGSSWCAMSE-UTUOFQBUSA-N 2 0 216.344 2.054 20 0 BEADRP C[C@@H]1C[N@H+](C/C=C/c2ccccc2)CC[C@@H]1[NH3+] ZINC000094342202 176279667 /nfs/dbraw/zinc/27/96/67/176279667.db2.gz YMPMBDKWTYYQOB-JGOVJGDKSA-N 2 0 230.355 2.369 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+][C@@H]1CCC1(C)C ZINC000309218648 176279939 /nfs/dbraw/zinc/27/99/39/176279939.db2.gz PYWUDQVXWOJGAQ-FDYHWXHSSA-N 2 0 224.392 2.493 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]C[C@@H]1CC1(C)C ZINC000300359326 176280350 /nfs/dbraw/zinc/28/03/50/176280350.db2.gz OHJGLPWHFQIFKO-FVCCEPFGSA-N 2 0 224.392 2.351 20 0 BEADRP C[C@@H]1C[N@H+](CCCCC(F)(F)F)CC[C@@H]1[NH3+] ZINC000124394350 176288229 /nfs/dbraw/zinc/28/82/29/176288229.db2.gz VLNOUDCBJMRPLB-ZJUUUORDSA-N 2 0 238.297 2.388 20 0 BEADRP C[C@@H]1C[N@H+](CCC2CC[NH2+]CC2)C(C)(C)C1 ZINC000336538745 176288450 /nfs/dbraw/zinc/28/84/50/176288450.db2.gz MAXCZRNLHWNUIO-LBPRGKRZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[NH+](CC[C@H]2CCC[N@@H+]2C)C[C@H]1C ZINC000336650833 176293418 /nfs/dbraw/zinc/29/34/18/176293418.db2.gz TYIXCIYRMDZWGD-JHJVBQTASA-N 2 0 210.365 2.059 20 0 BEADRP C[C@H](c1ccccc1)[N@@H+]1CC[C@@H]([NH3+])[C@H](C)C1 ZINC000251604130 176316727 /nfs/dbraw/zinc/31/67/27/176316727.db2.gz DEXULUOWZSCBAU-YRGRVCCFSA-N 2 0 218.344 2.417 20 0 BEADRP C[C@@H]1C[C@@H](C[NH3+])C[N@@H+]1CC1CCCCC1 ZINC000122312810 176368285 /nfs/dbraw/zinc/36/82/85/176368285.db2.gz CGUUJETWSSGYCW-YPMHNXCESA-N 2 0 210.365 2.236 20 0 BEADRP C[C@@H]1C[C@@H]([N@H+](C)CCC2CC2)CCN1C ZINC000336699515 176371565 /nfs/dbraw/zinc/37/15/65/176371565.db2.gz XQDQGVRDLOREHC-YPMHNXCESA-N 2 0 210.365 2.201 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCC[NH+]2CCCC2)[C@@H]1C ZINC000308975993 176374794 /nfs/dbraw/zinc/37/47/94/176374794.db2.gz ILICCWGQNOLDCX-JHJVBQTASA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]([NH2+]CCC[NH3+])c1ccc(Cl)cc1 ZINC000037713173 176844859 /nfs/dbraw/zinc/84/48/59/176844859.db2.gz JWZDYPDBWXQYIR-VIFPVBQESA-N 2 0 212.724 2.339 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)C1CC[NH+](C)CC1)c1cccnc1 ZINC000037220821 176914955 /nfs/dbraw/zinc/91/49/55/176914955.db2.gz YKSYQNXTHXBJAC-QWHCGFSZSA-N 2 0 247.386 2.463 20 0 BEADRP C[C@H](c1ccccc1)[N@@H+]1CC[C@H](CC[NH3+])C1 ZINC000083008670 177040225 /nfs/dbraw/zinc/04/02/25/177040225.db2.gz VUQMMBROUBKCLF-OLZOCXBDSA-N 2 0 218.344 2.418 20 0 BEADRP C[C@H](CN(C)C)[NH2+]C1C[C@H](C)C[C@@H](C)C1 ZINC000227605461 177066025 /nfs/dbraw/zinc/06/60/25/177066025.db2.gz FVRUJZQSCLLBSR-IJLUTSLNSA-N 2 0 212.381 2.351 20 0 BEADRP C[C@H]1CCCC[C@H]1C[NH2+]C1CC[NH2+]CC1 ZINC000042859665 177085896 /nfs/dbraw/zinc/08/58/96/177085896.db2.gz ZPZJICWFVVSSJU-RYUDHWBXSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H]1CCC[C@@H]([NH2+]C2CC[NH2+]CC2)CC1 ZINC000235697316 177122799 /nfs/dbraw/zinc/12/27/99/177122799.db2.gz ULBIUFNMPDAOQF-NWDGAFQWSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]1CCC[C@H](C[NH2+]C2CC[NH2+]CC2)C1 ZINC000235629208 177133598 /nfs/dbraw/zinc/13/35/98/177133598.db2.gz AZNKFFCOWTVZBM-RYUDHWBXSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C[NH3+] ZINC000059535381 177166107 /nfs/dbraw/zinc/16/61/07/177166107.db2.gz FKMJKEQHUVZBJG-JSGCOSHPSA-N 2 0 218.344 2.103 20 0 BEADRP C[C@H]1CC[C@H]([NH2+]CC2(C)CC[NH2+]CC2)C1 ZINC000129443338 177204358 /nfs/dbraw/zinc/20/43/58/177204358.db2.gz BTKGIAVEDAEQTH-RYUDHWBXSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@@H]1C ZINC000309050387 177239284 /nfs/dbraw/zinc/23/92/84/177239284.db2.gz PIVVJSVBOPVVLH-QNWJLWSRSA-N 2 0 210.365 2.103 20 0 BEADRP C[C@H]1CSC[C@@H]1[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000304538744 177305863 /nfs/dbraw/zinc/30/58/63/177305863.db2.gz RYEVCDITLVYMNL-RYUDHWBXSA-N 2 0 242.432 2.059 20 0 BEADRP C[C@@H]1C[C@H](C)[N@H+](CC[C@@H]2CCC[NH+]2C)C1 ZINC000336651731 177317397 /nfs/dbraw/zinc/31/73/97/177317397.db2.gz VSKQNTXYMCAYLV-AGIUHOORSA-N 2 0 210.365 2.201 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CC2([NH3+])CCC2)C[C@@H](C)C1 ZINC000335650672 177317911 /nfs/dbraw/zinc/31/79/11/177317911.db2.gz WIVCMTWVDOUSSX-GDNZZTSVSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]1C[C@@H](C[NH3+])C[N@@H+]1C[C@H]1CCC[C@@H](C)C1 ZINC000126723836 177324724 /nfs/dbraw/zinc/32/47/24/177324724.db2.gz YCWOXAIQSXHGFV-RFGFWPKPSA-N 2 0 224.392 2.482 20 0 BEADRP C[C@H]1C[C@@H](C[NH2+]C2CCCCC2)CC[NH2+]1 ZINC000235700265 177324826 /nfs/dbraw/zinc/32/48/26/177324826.db2.gz BHKUCAXBACCRSY-RYUDHWBXSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]1C[C@@H](N(C)Cc2ccco2)CC[N@@H+]1C ZINC000093643688 177326959 /nfs/dbraw/zinc/32/69/59/177326959.db2.gz RAEVLCSDKRRREY-RYUDHWBXSA-N 2 0 222.332 2.194 20 0 BEADRP C[C@H]1C[C@H](C[N@H+](C)CC(C)(C)C)CC[NH2+]1 ZINC000235684612 177361750 /nfs/dbraw/zinc/36/17/50/177361750.db2.gz FCYPYXKPLZXTPS-NWDGAFQWSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H]1C[C@H](C[N@@H+]2CCc3ccccc3C2)CC[NH2+]1 ZINC000235697243 177362592 /nfs/dbraw/zinc/36/25/92/177362592.db2.gz HNOUVSUKFPDUMS-UONOGXRCSA-N 2 0 244.382 2.433 20 0 BEADRP C[C@H]1C[C@H](C[NH2+]Cc2cccs2)CC[NH2+]1 ZINC000235670858 177363648 /nfs/dbraw/zinc/36/36/48/177363648.db2.gz XVMKWCNWBIPQJO-WDEREUQCSA-N 2 0 224.373 2.226 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]CC1(C(F)F)CC1 ZINC000359003344 177369703 /nfs/dbraw/zinc/36/97/03/177369703.db2.gz QTAMMOKJHFZPCH-VWYCJHECSA-N 2 0 246.345 2.350 20 0 BEADRP C[C@H]1C[C@H]1C[N@H+](CCC[NH3+])Cc1ccccc1 ZINC000339406332 177378954 /nfs/dbraw/zinc/37/89/54/177378954.db2.gz GEGUPNWLMMYFKQ-ZFWWWQNUSA-N 2 0 232.371 2.493 20 0 BEADRP C[C@H]1C[C@H]1C[N@H+](CCC[NH3+])CC1CCCC1 ZINC000352539480 177379338 /nfs/dbraw/zinc/37/93/38/177379338.db2.gz BCUPORVVHDLWTI-JSGCOSHPSA-N 2 0 224.392 2.483 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCc2ccccc2C1)[C@H]1CCC[NH2+]1 ZINC000400347000 225038767 /nfs/dbraw/zinc/03/87/67/225038767.db2.gz HUVFUDUMNZSXJK-APHBMKBZSA-N 2 0 244.382 2.274 20 0 BEADRP C[C@H]1C[C@@H]1C[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000488324041 225373583 /nfs/dbraw/zinc/37/35/83/225373583.db2.gz CPGFRFKLHPNIRK-DZGCQCFKSA-N 2 0 236.403 2.450 20 0 BEADRP C[C@H]1C[C@H]1C[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000488326258 225374224 /nfs/dbraw/zinc/37/42/24/225374224.db2.gz LJOKAFPRSDFFGW-JSGCOSHPSA-N 2 0 224.392 2.306 20 0 BEADRP C[C@@H]1C[C@H]1C[NH2+][C@H]1CCN(CC2CCCC2)C1 ZINC000488443245 225399267 /nfs/dbraw/zinc/39/92/67/225399267.db2.gz GIEADNHWCORHJV-SNPRPXQTSA-N 2 0 236.403 2.497 20 0 BEADRP C[NH+](C)CC1CC[NH+](C[C@H]2CCSC2)CC1 ZINC000495087982 226276555 /nfs/dbraw/zinc/27/65/55/226276555.db2.gz USEQCWQQAQMGNR-CYBMUJFWSA-N 2 0 242.432 2.013 20 0 BEADRP C[C@H]([NH2+]CCCC(C)(F)F)[C@H]1CCC[NH2+]1 ZINC000400323998 226340559 /nfs/dbraw/zinc/34/05/59/226340559.db2.gz BYKMRIRSHDUKTF-VHSXEESVSA-N 2 0 220.307 2.152 20 0 BEADRP CSCCCCC[NH2+][C@H](C)[C@H]1CCC[NH2+]1 ZINC000400356950 226341745 /nfs/dbraw/zinc/34/17/45/226341745.db2.gz AVXNCUOTIDDBSV-VXGBXAGGSA-N 2 0 230.421 2.250 20 0 BEADRP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[NH2+]1)C1CCCC1 ZINC000400378476 226342068 /nfs/dbraw/zinc/34/20/68/226342068.db2.gz JMFGYNGFYSLMHM-GMXVVIOVSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H]([NH2+]CC1C(C)(C)C1(C)C)[C@H]1CCC[NH2+]1 ZINC000400498321 226344827 /nfs/dbraw/zinc/34/48/27/226344827.db2.gz BKDBCILJGCFVQW-WDEREUQCSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCC[C@@H](C)C1)[C@H]1CCC[NH2+]1 ZINC000400630249 226347954 /nfs/dbraw/zinc/34/79/54/226347954.db2.gz LPLFJCSAWJOUJS-FVCCEPFGSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)C(C)(C)C ZINC000400941004 226352547 /nfs/dbraw/zinc/35/25/47/226352547.db2.gz CVGDWUYQCLWXQT-WUHRBBMRSA-N 2 0 224.392 2.399 20 0 BEADRP C[NH+](C)C[C@H]1CC[N@H+](CCCOC(C)(C)C)C1 ZINC000674909264 487652228 /nfs/dbraw/zinc/65/22/28/487652228.db2.gz ZNTOTKGVDOKYLP-CYBMUJFWSA-N 2 0 242.407 2.075 20 0 BEADRP C[C@H](C[NH2+]CC[C@H]1CC[NH2+]C1)C(C)(C)C ZINC000162946507 487673134 /nfs/dbraw/zinc/67/31/34/487673134.db2.gz YQXFCZGIRDLCFU-NEPJUHHUSA-N 2 0 212.381 2.258 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC2(C)CC[NH2+]CC2)[C@@H]1C ZINC000395157273 262766096 /nfs/dbraw/zinc/76/60/96/262766096.db2.gz LNXPRNGOFLWPRB-UTUOFQBUSA-N 2 0 210.365 2.010 20 0 BEADRP Cc1ccc(C[N@@H+]2C[C@H](C[NH3+])[C@@H](C)C[C@@H]2C)cn1 ZINC000397304646 262921417 /nfs/dbraw/zinc/92/14/17/262921417.db2.gz LYEUKELYWFBAQR-WHOFXGATSA-N 2 0 247.386 2.195 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@@H]([NH3+])C1)c1ccncc1 ZINC000088169918 487708518 /nfs/dbraw/zinc/70/85/18/487708518.db2.gz VDNWWONLSFYFKI-CYZMBNFOSA-N 2 0 219.332 2.002 20 0 BEADRP C[C@@H](CC[NH3+])[NH2+]Cc1nccc2ccccc21 ZINC000136137367 487712581 /nfs/dbraw/zinc/71/25/81/487712581.db2.gz DVEVZOGXCLJZEN-NSHDSACASA-N 2 0 229.327 2.062 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@@H]2CCC[C@@H]21)C1CC1 ZINC000671743657 487718747 /nfs/dbraw/zinc/71/87/47/487718747.db2.gz GRRBHUQTUIWGHG-NMFUWQPSSA-N 2 0 236.403 2.495 20 0 BEADRP FC(F)C1CC([NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)C1 ZINC000681112206 487730945 /nfs/dbraw/zinc/73/09/45/487730945.db2.gz BTCWWZWMLVIQLK-RUJICJSRSA-N 2 0 244.329 2.247 20 0 BEADRP C(C1CCC1)[N@@H+]1CCC[C@@H]([C@H]2CCC[NH2+]2)C1 ZINC000250681433 487739469 /nfs/dbraw/zinc/73/94/69/487739469.db2.gz YMTNIUSCZAGENU-ZIAGYGMSSA-N 2 0 222.376 2.251 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1Cc2ccccc21 ZINC000250859520 487742379 /nfs/dbraw/zinc/74/23/79/487742379.db2.gz RONDBQFZNZFUGK-GUTXKFCHSA-N 2 0 230.355 2.043 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]C[C@H]1Cc2ccccc21 ZINC000250869252 487743097 /nfs/dbraw/zinc/74/30/97/487743097.db2.gz YAYUQTHOLNSXAG-LZWOXQAQSA-N 2 0 244.382 2.433 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCC[C@H]1C[NH3+])C(C)(C)C ZINC000251138869 487749531 /nfs/dbraw/zinc/74/95/31/487749531.db2.gz VYRIYRFLOCZPJD-WOPDTQHZSA-N 2 0 212.381 2.386 20 0 BEADRP CC[C@@H]1C[N@@H+]([C@@H](C)c2cccnc2)CC[C@H]1[NH3+] ZINC000251524482 487765086 /nfs/dbraw/zinc/76/50/86/487765086.db2.gz ACGWYUHUTQFPIC-OUCADQQQSA-N 2 0 233.359 2.202 20 0 BEADRP CC[C@@H]1C[N@@H+]([C@H](C)c2cccnc2)CC[C@H]1[NH3+] ZINC000251524494 487765740 /nfs/dbraw/zinc/76/57/40/487765740.db2.gz ACGWYUHUTQFPIC-YRGRVCCFSA-N 2 0 233.359 2.202 20 0 BEADRP CC[C@@H]1C[N@H+](CCOCCC(C)C)CC[C@H]1[NH3+] ZINC000251583908 487772097 /nfs/dbraw/zinc/77/20/97/487772097.db2.gz CLAJCXVFQVBKOT-ZIAGYGMSSA-N 2 0 242.407 2.108 20 0 BEADRP CC[C@@H]1C[N@@H+]([C@@H](C)c2ccncc2)CC[C@H]1[NH3+] ZINC000251585593 487771991 /nfs/dbraw/zinc/77/19/91/487771991.db2.gz CMWOQXROWDZXLO-OUCADQQQSA-N 2 0 233.359 2.202 20 0 BEADRP CC[C@@H]1C[N@H+](CCCC(C)C)CC[C@H]1[NH3+] ZINC000251720823 487793130 /nfs/dbraw/zinc/79/31/30/487793130.db2.gz JYGUWFSKABZEFL-CHWSQXEVSA-N 2 0 212.381 2.482 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@H](C)c2ccncc2)CC1 ZINC000675927280 487793487 /nfs/dbraw/zinc/79/34/87/487793487.db2.gz CZIFJMZGSOTJGF-ZDUSSCGKSA-N 2 0 247.386 2.259 20 0 BEADRP CCC[NH2+]CC[NH2+]C[C@H](C)C(C)(C)C ZINC000162996908 487795387 /nfs/dbraw/zinc/79/53/87/487795387.db2.gz NFSJVCAJLMYGLT-NSHDSACASA-N 2 0 200.370 2.258 20 0 BEADRP C[N@H+](CCCC[NH2+]Cc1nccs1)C1CC1 ZINC000651600486 487797572 /nfs/dbraw/zinc/79/75/72/487797572.db2.gz JYWCQPNOWLSOEZ-UHFFFAOYSA-N 2 0 239.388 2.107 20 0 BEADRP CC[C@H]1C[N@H+](Cc2cccs2)CC[C@H]1[NH3+] ZINC000251842831 487801807 /nfs/dbraw/zinc/80/18/07/487801807.db2.gz QZIHNVAVIARPDN-CMPLNLGQSA-N 2 0 224.373 2.307 20 0 BEADRP [NH3+]CCCN1CC[C@@](F)(c2ccccc2F)C1 ZINC000414766550 487823921 /nfs/dbraw/zinc/82/39/21/487823921.db2.gz RFWHQZSANKJXNI-ZDUSSCGKSA-N 2 0 240.297 2.045 20 0 BEADRP [NH3+]CCC[NH2+]Cc1ccccc1OC1CCC1 ZINC000415091498 487837136 /nfs/dbraw/zinc/83/71/36/487837136.db2.gz QJXRTDNHGLFNEA-UHFFFAOYSA-N 2 0 234.343 2.056 20 0 BEADRP C[C@@H](CC[N@H+](C)CCCF)[NH+](C)CCCF ZINC000887141239 592457892 /nfs/dbraw/zinc/45/78/92/592457892.db2.gz KPEFKSZOVLJPDL-LBPRGKRZSA-N 2 0 236.350 2.348 20 0 BEADRP [NH3+]CCC[N@@H+]1CCS[C@@H](c2ccccc2)C1 ZINC000666640943 487849918 /nfs/dbraw/zinc/84/99/18/487849918.db2.gz GQHQQXUDZIHHLO-CYBMUJFWSA-N 2 0 236.384 2.125 20 0 BEADRP CC[C@@H]1CN(C)c2ccccc2C[N@@H+]1CCC[NH3+] ZINC000666650360 487851952 /nfs/dbraw/zinc/85/19/52/487851952.db2.gz LTHKLVSPTNHPAP-CQSZACIVSA-N 2 0 247.386 2.066 20 0 BEADRP C[C@H](c1ccncc1)[N@@H+]1CC[C@@H](C)[C@H](C[NH3+])C1 ZINC000253188692 487858147 /nfs/dbraw/zinc/85/81/47/487858147.db2.gz JYLRZAJAQQIHCS-YRGRVCCFSA-N 2 0 233.359 2.059 20 0 BEADRP C[C@@H](CC1CCC1)[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000666789037 487859469 /nfs/dbraw/zinc/85/94/69/487859469.db2.gz ATHCOXJKSCZFCE-AAEUAGOBSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H](C[N@@H+]1CCC[C@H]2C[NH2+]C[C@H]21)C(C)(C)C ZINC000666732486 487867826 /nfs/dbraw/zinc/86/78/26/487867826.db2.gz XUXXISCHWDYECG-RWMBFGLXSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@H](CC1CCC1)[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000666765797 487873604 /nfs/dbraw/zinc/87/36/04/487873604.db2.gz ZNZVVXIZTZHBPY-DGCLKSJQSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H](CC1CCC1)[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000666765798 487874523 /nfs/dbraw/zinc/87/45/23/487874523.db2.gz ZNZVVXIZTZHBPY-WCQYABFASA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H](CC[NH3+])[NH2+]Cc1cccc2cnccc21 ZINC000666832351 487888381 /nfs/dbraw/zinc/88/83/81/487888381.db2.gz SSNIBZFCNGXSQA-NSHDSACASA-N 2 0 229.327 2.062 20 0 BEADRP COCCC1(C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)CCC1 ZINC000666853118 487891100 /nfs/dbraw/zinc/89/11/00/487891100.db2.gz MXKPQFPIBHHGQE-CHWSQXEVSA-N 2 0 240.391 2.053 20 0 BEADRP C(=C/c1ccccc1)\C[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000666952443 487891416 /nfs/dbraw/zinc/89/14/16/487891416.db2.gz WRDBHKRPTGLZAO-SZTZYQKNSA-N 2 0 242.366 2.432 20 0 BEADRP C[C@H](CC1CCC1)[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000666953742 487891893 /nfs/dbraw/zinc/89/18/93/487891893.db2.gz GORCUQYISKUIKN-YPMHNXCESA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H](CC1CCC1)[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000666857876 487892037 /nfs/dbraw/zinc/89/20/37/487892037.db2.gz NORBYRPPWGOECI-WCQYABFASA-N 2 0 210.365 2.297 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+]CC2CCSCC2)C1 ZINC000229214731 487893477 /nfs/dbraw/zinc/89/34/77/487893477.db2.gz ZTUZUEPMCROEFI-CYBMUJFWSA-N 2 0 242.432 2.061 20 0 BEADRP COc1cccc(C[NH2+][C@H](C)CCC[NH3+])c1F ZINC000666942058 487907271 /nfs/dbraw/zinc/90/72/71/487907271.db2.gz GSLKHALLXHRPLS-SNVBAGLBSA-N 2 0 240.322 2.051 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C1C[C@@H](C)O[C@H](C)C1 ZINC000666936657 487907395 /nfs/dbraw/zinc/90/73/95/487907395.db2.gz VYBXUTOBQPQUJF-IJLUTSLNSA-N 2 0 228.380 2.050 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]CCC[NH+](C)C)CC1 ZINC000083427148 487909878 /nfs/dbraw/zinc/90/98/78/487909878.db2.gz MJEFXIQNXGDSBI-OLZOCXBDSA-N 2 0 212.381 2.497 20 0 BEADRP Cc1ccsc1C[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000666950860 487913258 /nfs/dbraw/zinc/91/32/58/487913258.db2.gz NNCYTCBJXXLWJE-LBPRGKRZSA-N 2 0 236.384 2.288 20 0 BEADRP Cc1ccc(F)c(C[NH2+][C@H]2CC23CC[NH2+]CC3)c1 ZINC000666952280 487914425 /nfs/dbraw/zinc/91/44/25/487914425.db2.gz OBZGLCSDBNHAHL-AWEZNQCLSA-N 2 0 248.345 2.366 20 0 BEADRP CC(C)CCC[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000666953674 487915194 /nfs/dbraw/zinc/91/51/94/487915194.db2.gz DTLPJDRBUHICFG-LBPRGKRZSA-N 2 0 210.365 2.154 20 0 BEADRP CCC[C@@H](CC)[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000666953898 487915997 /nfs/dbraw/zinc/91/59/97/487915997.db2.gz KLLVCWNOSAGTJD-NEPJUHHUSA-N 2 0 210.365 2.297 20 0 BEADRP CCC[C@H](CC)[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000666953899 487916230 /nfs/dbraw/zinc/91/62/30/487916230.db2.gz KLLVCWNOSAGTJD-NWDGAFQWSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H](C[NH2+][C@H]1CC12CC[NH2+]CC2)C(C)(C)C ZINC000666955495 487917267 /nfs/dbraw/zinc/91/72/67/487917267.db2.gz RLNXLVHHFXDDBJ-RYUDHWBXSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC[C@H](C[NH3+])C1)C(C)(C)C ZINC000666964033 487920073 /nfs/dbraw/zinc/92/00/73/487920073.db2.gz CSUHJNXSLXWQBD-WOPDTQHZSA-N 2 0 212.381 2.386 20 0 BEADRP C[C@@H](CC1CC1)[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000666995394 487924709 /nfs/dbraw/zinc/92/47/09/487924709.db2.gz MTKUJDDFJCPDBK-WCQYABFASA-N 2 0 222.376 2.439 20 0 BEADRP C1CC2(C1)C[C@H]([NH2+][C@@H]1CCCSC1)CC[NH2+]2 ZINC000666995665 487924980 /nfs/dbraw/zinc/92/49/80/487924980.db2.gz VPUHEODVETWDBB-VXGBXAGGSA-N 2 0 240.416 2.146 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]Cc1ccnc2ccccc12 ZINC000564970362 322984209 /nfs/dbraw/zinc/98/42/09/322984209.db2.gz JTFBWNZQOYZSRT-NWDGAFQWSA-N 2 0 243.354 2.450 20 0 BEADRP CCCOc1ccc(C[NH2+]C[C@H](C)C[NH3+])cc1 ZINC000560942770 322993678 /nfs/dbraw/zinc/99/36/78/322993678.db2.gz CEDZWDULYCGCLD-GFCCVEGCSA-N 2 0 236.359 2.160 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](C)C2CCC2)C1 ZINC000247137887 323012241 /nfs/dbraw/zinc/01/22/41/323012241.db2.gz SDQJFFZKWWRFBI-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP CC1(C[N@@H+]2CC[C@@H](C[NH+]3CCCC3)C2)CC1 ZINC000562364348 323017844 /nfs/dbraw/zinc/01/78/44/323017844.db2.gz SQKFYFVGYDEUSL-ZDUSSCGKSA-N 2 0 222.376 2.204 20 0 BEADRP Cc1cccc(CC[N@@H+](C)CCC[NH+](C)C)c1 ZINC000562521918 323022822 /nfs/dbraw/zinc/02/28/22/323022822.db2.gz XRVJQWJGPOZXRS-UHFFFAOYSA-N 2 0 234.387 2.421 20 0 BEADRP C[C@H](Cc1ccsc1)[NH2+]CC1=CC[NH2+]CC1 ZINC000567654797 323034618 /nfs/dbraw/zinc/03/46/18/323034618.db2.gz COOSGARFNSKLOS-LLVKDONJSA-N 2 0 236.384 2.188 20 0 BEADRP CC[N@H+](CC[C@H]1CCCC[NH+]1C)C[C@@H](C)OC ZINC000569897534 323043710 /nfs/dbraw/zinc/04/37/10/323043710.db2.gz PASRFZRZWZUBOW-ZIAGYGMSSA-N 2 0 242.407 2.218 20 0 BEADRP C[N@@H+]1CCC[C@@H]2C[NH+](CC3(C)CC3)CC[C@@H]21 ZINC000569904071 323043921 /nfs/dbraw/zinc/04/39/21/323043921.db2.gz CVXSMHBKIYJEFW-OLZOCXBDSA-N 2 0 222.376 2.203 20 0 BEADRP C[C@H](Cc1ccc(O)cc1)[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000570107603 323050264 /nfs/dbraw/zinc/05/02/64/323050264.db2.gz XURHFGCJIMBPDJ-MRVWCRGKSA-N 2 0 248.370 2.183 20 0 BEADRP CCC[N@H+](CCC[NH+]1CCCC1)C1CC1 ZINC000153493794 323051769 /nfs/dbraw/zinc/05/17/69/323051769.db2.gz JOWXWGWRPBAKLP-UHFFFAOYSA-N 2 0 210.365 2.347 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[C@H]([NH3+])C1)c1cscn1 ZINC000570832114 323072133 /nfs/dbraw/zinc/07/21/33/323072133.db2.gz UDPRERXALFDIIF-DCAQKATOSA-N 2 0 239.388 2.311 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]CCCC1CC1 ZINC000161717172 323076427 /nfs/dbraw/zinc/07/64/27/323076427.db2.gz JXOHPAMIXXVZAG-BZPMIXESSA-N 2 0 224.392 2.495 20 0 BEADRP Cc1cccnc1C[N@@H+]1C[C@H](C[NH3+])[C@@H](C)C[C@H]1C ZINC000397254633 323077377 /nfs/dbraw/zinc/07/73/77/323077377.db2.gz FAYJGITWBMYPMX-MJBXVCDLSA-N 2 0 247.386 2.195 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCCC12CCC2)C[NH+](C)C ZINC000394829902 323086088 /nfs/dbraw/zinc/08/60/88/323086088.db2.gz TUVDINLIAAGHMB-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+]C[C@@H]2CC=CCC2)C1 ZINC000222314726 323086505 /nfs/dbraw/zinc/08/65/05/323086505.db2.gz XXCWCGMKENUIFH-ZIAGYGMSSA-N 2 0 222.376 2.274 20 0 BEADRP CC[C@H](C)C[NH2+]Cc1ccc(C[NH3+])cc1 ZINC000054488719 323087250 /nfs/dbraw/zinc/08/72/50/323087250.db2.gz SCJNDQOYIHXVTR-NSHDSACASA-N 2 0 206.333 2.281 20 0 BEADRP COC[C@H]([NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21)C1CC1 ZINC000397299469 323087404 /nfs/dbraw/zinc/08/74/04/323087404.db2.gz CTTVNRIDWFBGHJ-KFWWJZLASA-N 2 0 246.354 2.146 20 0 BEADRP CN(CCC[NH3+])Cc1cnc(C2CCC2)s1 ZINC000563129695 323094325 /nfs/dbraw/zinc/09/43/25/323094325.db2.gz LUJVZPRVXUZFEY-UHFFFAOYSA-N 2 0 239.388 2.191 20 0 BEADRP COc1ccccc1/C=C\C[NH2+][C@H](C)C[C@@H](C)[NH3+] ZINC000563135340 323094696 /nfs/dbraw/zinc/09/46/96/323094696.db2.gz JHDYFYLATFTSRJ-YVNFWLBFSA-N 2 0 248.370 2.424 20 0 BEADRP CC(C)C(C)(C)[NH2+]CC[NH2+]C(C)(C)C ZINC000563430740 323125108 /nfs/dbraw/zinc/12/51/08/323125108.db2.gz PRIUIMFFPVRECJ-UHFFFAOYSA-N 2 0 200.370 2.399 20 0 BEADRP CC(C)[C@H]([NH2+]C[C@@H]1CCC[NH2+]C1)C1CC1 ZINC000324209180 323136247 /nfs/dbraw/zinc/13/62/47/323136247.db2.gz CQGUHTDKGKSPFH-YPMHNXCESA-N 2 0 210.365 2.010 20 0 BEADRP C[C@H](CCc1ccccc1)C[NH2+]C[C@@H]1CC[NH2+]C1 ZINC000414919149 323152012 /nfs/dbraw/zinc/15/20/12/323152012.db2.gz WHGNBPZRXXMOMX-GDBMZVCRSA-N 2 0 246.398 2.454 20 0 BEADRP CCOc1ccc(C[NH2+][C@H]2CCC[NH2+]CC2)cc1 ZINC000414919282 323152069 /nfs/dbraw/zinc/15/20/69/323152069.db2.gz UREKYCNXSYXFSX-AWEZNQCLSA-N 2 0 248.370 2.317 20 0 BEADRP CC[C@@H]1CCC[C@H]1[NH2+]CCC[N@H+](C)CCOC ZINC000531940479 323156047 /nfs/dbraw/zinc/15/60/47/323156047.db2.gz ABPVOGTWFPBYOT-ZIAGYGMSSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)(C)[NH2+]CC[NH2+][C@@]1(C)CC=CCC1 ZINC000398396940 323185571 /nfs/dbraw/zinc/18/55/71/323185571.db2.gz ZMPQLUMXEZDHNK-ZDUSSCGKSA-N 2 0 210.365 2.463 20 0 BEADRP Cc1ccncc1CN[C@@H](C)[C@@H]1CCCC[NH2+]1 ZINC000395091943 323186942 /nfs/dbraw/zinc/18/69/42/323186942.db2.gz VFAIHQFWQRTACP-JSGCOSHPSA-N 2 0 233.359 2.010 20 0 BEADRP CC(C)(CO)CC[NH2+][C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000395120822 323187993 /nfs/dbraw/zinc/18/79/93/323187993.db2.gz GOKMNWXNKYQMNR-KBPBESRZSA-N 2 0 248.370 2.129 20 0 BEADRP C[N@@H+]1CCC[C@H]1CC[NH+]1C2CCC1CC2 ZINC000535765301 323190647 /nfs/dbraw/zinc/19/06/47/323190647.db2.gz IYYPTGLTPDQGPT-HIFPTAJRSA-N 2 0 208.349 2.098 20 0 BEADRP CCC[C@H](C[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)OCC ZINC000530209428 323209829 /nfs/dbraw/zinc/20/98/29/323209829.db2.gz HNGAOOOKVHLJJM-QNMSZWNNSA-N 2 0 240.391 2.064 20 0 BEADRP C1CC1[C@H]([NH2+][C@H]1CC[NH2+]C12CCC2)C1CCC1 ZINC000530214823 323216877 /nfs/dbraw/zinc/21/68/77/323216877.db2.gz CYWFIGSNQIGHJP-UONOGXRCSA-N 2 0 234.387 2.439 20 0 BEADRP CC[C@H]([NH2+][C@H]1CC[NH2+]C[C@@H]1C)C1CCC1 ZINC000324908066 323301861 /nfs/dbraw/zinc/30/18/61/323301861.db2.gz ITUBURVQVSBEJV-DRZSPHRISA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[NH2+]C[C@@H]1C)C1CCC1 ZINC000324908068 323301965 /nfs/dbraw/zinc/30/19/65/323301965.db2.gz ITUBURVQVSBEJV-WCFLWFBJSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]([NH2+]CCC[NH+]1CCCC1)[C@H]1C[C@H]1C ZINC000321898907 323390460 /nfs/dbraw/zinc/39/04/60/323390460.db2.gz NCANEAXTABIYIQ-UPJWGTAASA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1OCC[C@H]1[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C ZINC000121221260 324005596 /nfs/dbraw/zinc/00/55/96/324005596.db2.gz LVABDRWHUDKYFP-XQQFMLRXSA-N 2 0 242.407 2.120 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+]C1CCSCC1 ZINC000163630818 324130469 /nfs/dbraw/zinc/13/04/69/324130469.db2.gz NOWNPOFKEZSUKW-UHFFFAOYSA-N 2 0 230.421 2.202 20 0 BEADRP FCCC[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCCC[NH2+]1 ZINC000304297943 324200026 /nfs/dbraw/zinc/20/00/26/324200026.db2.gz ZXUDQOOKNJUUQR-FRRDWIJNSA-N 2 0 228.355 2.246 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)C1CC(F)(F)C1 ZINC000529548278 324336768 /nfs/dbraw/zinc/33/67/68/324336768.db2.gz KFQZUIFTMAEQBX-WDEREUQCSA-N 2 0 246.345 2.352 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CCCC1(C)C)C1C[NH2+]C1 ZINC000530210028 324526820 /nfs/dbraw/zinc/52/68/20/324526820.db2.gz KIJLVLLOFDPYBS-DGCLKSJQSA-N 2 0 224.392 2.400 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CC1CC=CC1 ZINC000530215572 324531311 /nfs/dbraw/zinc/53/13/11/324531311.db2.gz HOALDJSNEXCGDE-LLVKDONJSA-N 2 0 245.370 2.466 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000070828312 325035919 /nfs/dbraw/zinc/03/59/19/325035919.db2.gz PYOKJFOPPONBTB-AGIUHOORSA-N 2 0 210.365 2.106 20 0 BEADRP C(C[NH2+]C1(C2CC2)CC1)C[NH2+]C1(C2CC2)CC1 ZINC000543455297 325090252 /nfs/dbraw/zinc/09/02/52/325090252.db2.gz WEONHVLABSGJPO-UHFFFAOYSA-N 2 0 234.387 2.441 20 0 BEADRP CC[C@@H]1CCC[C@H]1[NH2+]CC1CC[NH+](C)CC1 ZINC000133336442 325287346 /nfs/dbraw/zinc/28/73/46/325287346.db2.gz AFWWZPJAKLOULK-ZIAGYGMSSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000133408265 325293763 /nfs/dbraw/zinc/29/37/63/325293763.db2.gz PNXCHEIBBIVVKW-BFHYXJOUSA-N 2 0 224.392 2.497 20 0 BEADRP CSC[C@@H](C)[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000134009763 325337449 /nfs/dbraw/zinc/33/74/49/325337449.db2.gz XHZMDQGWCILDJS-LLVKDONJSA-N 2 0 230.421 2.200 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@@H](C)C(C)C)CC1 ZINC000081047635 325489699 /nfs/dbraw/zinc/48/96/99/325489699.db2.gz WDJYQAUNLCDNTP-GFCCVEGCSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1)[C@H]1C[C@H]1C ZINC000566068842 325988178 /nfs/dbraw/zinc/98/81/78/325988178.db2.gz GXWVCEJOQAPQIS-GYSYKLTISA-N 2 0 218.344 2.279 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H]1CCC[C@@H](C)[C@@H]1C ZINC000566087900 325991521 /nfs/dbraw/zinc/99/15/21/325991521.db2.gz BVLZTMQSMZWHCK-FRRDWIJNSA-N 2 0 212.381 2.400 20 0 BEADRP Cc1cnc(C)nc1NC1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000566481921 326055771 /nfs/dbraw/zinc/05/57/71/326055771.db2.gz IWGXYBMIHBWOLI-YHWZYXNKSA-N 2 0 246.358 2.131 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]C2CCC(F)(F)CC2)C1 ZINC000566483161 326056431 /nfs/dbraw/zinc/05/64/31/326056431.db2.gz ZHFNKSSXVBBWHK-ONGXEEELSA-N 2 0 232.318 2.424 20 0 BEADRP C[C@H]1CC(C)(C)C[C@@H]1[NH2+]C1CC([NH+](C)C)C1 ZINC000566805609 326084998 /nfs/dbraw/zinc/08/49/98/326084998.db2.gz JAAYFIDMJCOXHL-WTIISPKJSA-N 2 0 224.392 2.493 20 0 BEADRP C[N@H+](C[C@@H]1CCC[NH+](C)C1)CC1(C)CC1 ZINC000566832783 326086240 /nfs/dbraw/zinc/08/62/40/326086240.db2.gz MQZSLNYWBXTCEB-GFCCVEGCSA-N 2 0 210.365 2.060 20 0 BEADRP Cc1cccnc1CCC[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000566985647 326100139 /nfs/dbraw/zinc/10/01/39/326100139.db2.gz RZQQOUHDJQAYKQ-ZIAGYGMSSA-N 2 0 247.386 2.182 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H](C)C1CCSCC1 ZINC000567159353 326125551 /nfs/dbraw/zinc/12/55/51/326125551.db2.gz MGRGPKGFTAYRCY-NSHDSACASA-N 2 0 230.421 2.107 20 0 BEADRP C[C@@]1(c2ccccc2)CC[C@@H](N[C@H]2CC[NH2+]C2)C1 ZINC000567487371 326202473 /nfs/dbraw/zinc/20/24/73/326202473.db2.gz LEMGKGIQCSBGBA-OWCLPIDISA-N 2 0 244.382 2.448 20 0 BEADRP Cc1ccc(CC[NH2+][C@H]2CCCCC[C@H]2[NH3+])o1 ZINC000567579780 326221191 /nfs/dbraw/zinc/22/11/91/326221191.db2.gz CBTSXSXGCOWFJV-KGLIPLIRSA-N 2 0 236.359 2.380 20 0 BEADRP CC(C)C1CC([NH2+]CC2CC[NH2+]CC2)C1 ZINC000567604042 326226710 /nfs/dbraw/zinc/22/67/10/326226710.db2.gz WFNHSHSAQIEZRU-UHFFFAOYSA-N 2 0 210.365 2.010 20 0 BEADRP C([NH2+]C1CCC2(CC2)CC1)C1CC[NH2+]CC1 ZINC000567638930 326236099 /nfs/dbraw/zinc/23/60/99/326236099.db2.gz WKDARIHLZASEDO-UHFFFAOYSA-N 2 0 222.376 2.298 20 0 BEADRP C[C@@H]([NH3+])c1ccc(OCC[C@@H]2CC[NH2+]C2)cc1 ZINC000567673874 326243019 /nfs/dbraw/zinc/24/30/19/326243019.db2.gz PQBGWDXKPGWTAQ-NEPJUHHUSA-N 2 0 234.343 2.085 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+]CCCC1CC1 ZINC000156834557 326243930 /nfs/dbraw/zinc/24/39/30/326243930.db2.gz FKEYESGGJDKEDA-OLZOCXBDSA-N 2 0 210.365 2.284 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CCC[C@@H](F)C1 ZINC000567735664 326253208 /nfs/dbraw/zinc/25/32/08/326253208.db2.gz OQJSYQNPUFPWCW-RNJOBUHISA-N 2 0 228.355 2.374 20 0 BEADRP COC[C@H](C)[NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1 ZINC000157955400 326301410 /nfs/dbraw/zinc/30/14/10/326301410.db2.gz NFMOQWFDYOLNLN-KGLIPLIRSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)[C@H]([NH2+]CC1(C)CC[NH2+]CC1)C1CC1 ZINC000568252825 326335604 /nfs/dbraw/zinc/33/56/04/326335604.db2.gz DMVBWAPXKFGGBN-ZDUSSCGKSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCCC12CC2)C[NH+](C)C ZINC000568277319 326340115 /nfs/dbraw/zinc/34/01/15/326340115.db2.gz VNFQAFWJGBKORS-VXGBXAGGSA-N 2 0 210.365 2.106 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H]1C[C@H](C)C[C@H](C)C1 ZINC000568617076 326367941 /nfs/dbraw/zinc/36/79/41/326367941.db2.gz BDBWUSZJBPOXGS-ITGUQSILSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H](c1ccccn1)N1[C@@H]2CC[C@H]1CC[N@@H+](C)C2 ZINC000568828152 326378199 /nfs/dbraw/zinc/37/81/99/326378199.db2.gz PMLBDHWQKPPUSD-MELADBBJSA-N 2 0 245.370 2.311 20 0 BEADRP CCn1ccnc1CNc1ccc(C[NH2+]C)cc1 ZINC000569090439 326389408 /nfs/dbraw/zinc/38/94/08/326389408.db2.gz XVVWDDSSQPPIPM-UHFFFAOYSA-N 2 0 244.342 2.235 20 0 BEADRP C[C@H](O)[C@H](C)[NH2+]CCCCC[NH+]1CCCCC1 ZINC000572752014 326408936 /nfs/dbraw/zinc/40/89/36/326408936.db2.gz YQTIIXBXASPRER-KBPBESRZSA-N 2 0 242.407 2.002 20 0 BEADRP C[NH+]1CCC(C)(C[NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)CC1 ZINC000302633695 487975927 /nfs/dbraw/zinc/97/59/27/487975927.db2.gz DJNZQBJFIXTRPO-HZSPNIEDSA-N 2 0 236.403 2.497 20 0 BEADRP C[NH2+]CCC[N@H+](C1CC1)C1CCCCC1 ZINC000309650788 488011341 /nfs/dbraw/zinc/01/13/41/488011341.db2.gz SSZIHCXWPWQFEK-UHFFFAOYSA-N 2 0 210.365 2.393 20 0 BEADRP CCC[N@H+](CC)Cc1ccnn1-c1cc[nH+]cc1 ZINC000667463544 488015127 /nfs/dbraw/zinc/01/51/27/488015127.db2.gz RGLWRPJVOLDKRB-UHFFFAOYSA-N 2 0 244.342 2.499 20 0 BEADRP CCCC[C@H](C)[NH2+][C@@H](C)CC[NH+](C)C ZINC000049554153 488018729 /nfs/dbraw/zinc/01/87/29/488018729.db2.gz DLDYLXCBJIPGBJ-RYUDHWBXSA-N 2 0 200.370 2.495 20 0 BEADRP C[N@H+](CCC[NH3+])Cc1coc2ccccc12 ZINC000084486336 488053667 /nfs/dbraw/zinc/05/36/67/488053667.db2.gz KIPUAFLCYUDXLI-UHFFFAOYSA-N 2 0 218.300 2.213 20 0 BEADRP Cc1ccnc(CN(C)[C@H]2CC[N@H+](C)[C@H](C)C2)c1 ZINC000683010616 488090609 /nfs/dbraw/zinc/09/06/09/488090609.db2.gz CIFDNNGOQCENOW-HIFRSBDPSA-N 2 0 247.386 2.305 20 0 BEADRP CC(C)[N@@H+]1CC[C@H](C[NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)C1 ZINC000378960177 488113988 /nfs/dbraw/zinc/11/39/88/488113988.db2.gz POGJRQPEEFMITM-APIJFGDWSA-N 2 0 236.403 2.495 20 0 BEADRP C[N@H+](C[C@@H]1CC[C@H]2C[C@H]2C1)CC(C)(C)C[NH3+] ZINC000403234987 488119486 /nfs/dbraw/zinc/11/94/86/488119486.db2.gz AVFYXKZWXKDTTI-FRRDWIJNSA-N 2 0 224.392 2.339 20 0 BEADRP [NH3+]C[C@]12CCC[C@H]1C[N@H+](C[C@@H]1CC[C@@H]3C[C@@H]3C1)C2 ZINC000403519771 488125260 /nfs/dbraw/zinc/12/52/60/488125260.db2.gz KQDUDFIGLPHXTF-OWYFMNJBSA-N 2 0 248.414 2.483 20 0 BEADRP CCO[C@@H]1C[C@@H]([NH2+]CC2([NH3+])CCCC2)C1(C)C ZINC000233783001 488127252 /nfs/dbraw/zinc/12/72/52/488127252.db2.gz LOTNNEUPSUEOBI-VXGBXAGGSA-N 2 0 240.391 2.051 20 0 BEADRP Cc1ccccc1C(C)(C)C[NH2+]CCC[NH3+] ZINC000258732515 488130602 /nfs/dbraw/zinc/13/06/02/488130602.db2.gz KBYCHLJWBILHLG-UHFFFAOYSA-N 2 0 220.360 2.211 20 0 BEADRP C1[C@H]([NH2+]C2CCCCC2)C12CC[NH2+]CC2 ZINC000390051134 488131511 /nfs/dbraw/zinc/13/15/11/488131511.db2.gz GFCDXEDVFJDHIN-LBPRGKRZSA-N 2 0 208.349 2.051 20 0 BEADRP [NH3+]C[C@@H]1CC[N@H+](Cc2ccccc2C2CC2)C1 ZINC000094528204 487539235 /nfs/dbraw/zinc/53/92/35/487539235.db2.gz BGSXLELWNBWRQN-LBPRGKRZSA-N 2 0 230.355 2.345 20 0 BEADRP C(C1CCC1)[N@@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000662292372 487541564 /nfs/dbraw/zinc/54/15/64/487541564.db2.gz FBHKPHLBJGEQTB-OAHLLOKOSA-N 2 0 236.403 2.498 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+]C[C@@H]2CCCS2)CC1(C)C ZINC000623445462 487473004 /nfs/dbraw/zinc/47/30/04/487473004.db2.gz RVFLHRSGGUGWMJ-NEPJUHHUSA-N 2 0 242.432 2.344 20 0 BEADRP [NH3+]C[C@]12CCC[C@H]1C[N@H+](CCc1ccccc1)C2 ZINC000381019346 487493152 /nfs/dbraw/zinc/49/31/52/487493152.db2.gz OROIAMZHXZVGBE-HOTGVXAUSA-N 2 0 244.382 2.290 20 0 BEADRP C(CC1CC1)[NH2+][C@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000086494538 487512403 /nfs/dbraw/zinc/51/24/03/487512403.db2.gz NHIDYHLFFLFSTE-RDBSUJKOSA-N 2 0 222.376 2.297 20 0 BEADRP CC[C@@H](C)[NH+]1CCN(c2cc[nH+]cc2)CC1 ZINC000680010333 487516750 /nfs/dbraw/zinc/51/67/50/487516750.db2.gz MOCRTACAALJLML-GFCCVEGCSA-N 2 0 219.332 2.002 20 0 BEADRP C(CC1CCC1)C[N@@H+]1CC[C@H]2[NH2+]CC[C@@H]2C1 ZINC000662274482 487522633 /nfs/dbraw/zinc/52/26/33/487522633.db2.gz UPXDSNJUUCTVHL-ZIAGYGMSSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@@]1(C[NH3+])CC[N@H+](CCCC2CCC2)C1 ZINC000662274040 487522648 /nfs/dbraw/zinc/52/26/48/487522648.db2.gz SMCXRVCAQXRUKN-ZDUSSCGKSA-N 2 0 210.365 2.237 20 0 BEADRP CC(C)C[C@@H](C)[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000390083219 488135659 /nfs/dbraw/zinc/13/56/59/488135659.db2.gz SRYHHVVKUSYDOA-NEPJUHHUSA-N 2 0 210.365 2.153 20 0 BEADRP COc1ccc(CC[NH2+][C@H]2CCC[C@H]([NH3+])C2)cc1 ZINC000093209570 488139227 /nfs/dbraw/zinc/13/92/27/488139227.db2.gz XSJJDFKHZZBQKC-KBPBESRZSA-N 2 0 248.370 2.097 20 0 BEADRP Cc1ccc(CC[NH2+][C@H]2CCC[C@H]2[NH3+])cc1C ZINC000258852614 488139602 /nfs/dbraw/zinc/13/96/02/488139602.db2.gz FEWCIMOYSDFQQW-CABCVRRESA-N 2 0 232.371 2.315 20 0 BEADRP C[C@@H](Cc1ccsc1)[NH2+]CC(C)(C)[NH3+] ZINC000379612017 488144543 /nfs/dbraw/zinc/14/45/43/488144543.db2.gz VAUATPOYROWSCI-VIFPVBQESA-N 2 0 212.362 2.006 20 0 BEADRP [NH3+]CCC1CC[NH+](CCC2CCC2)CC1 ZINC000398655203 488152288 /nfs/dbraw/zinc/15/22/88/488152288.db2.gz MLHQYUTUMAZEFF-UHFFFAOYSA-N 2 0 210.365 2.237 20 0 BEADRP CC(C)=CCC[NH2+][C@H]1CC[NH2+]CC1(C)C ZINC000397871226 488161243 /nfs/dbraw/zinc/16/12/43/488161243.db2.gz IXMDTFOCEYJJBD-LBPRGKRZSA-N 2 0 210.365 2.320 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCC[NH2+]CC1)C(C)(C)C ZINC000168781153 488164426 /nfs/dbraw/zinc/16/44/26/488164426.db2.gz CXXGZGWMBHMBAP-VXGBXAGGSA-N 2 0 212.381 2.400 20 0 BEADRP CC[C@](C)(C[NH2+][C@@H](C)C1CC[NH+](C)CC1)OC ZINC000322568089 488191707 /nfs/dbraw/zinc/19/17/07/488191707.db2.gz YOQHTALEZQKKEY-GXTWGEPZSA-N 2 0 242.407 2.121 20 0 BEADRP CC1(C)CCC[C@H](C[NH+]2C[C@H]3C[NH2+]C[C@@H]3C2)C1 ZINC000678343076 488243194 /nfs/dbraw/zinc/24/31/94/488243194.db2.gz LSFGOOQRUQKHMI-BFHYXJOUSA-N 2 0 236.403 2.354 20 0 BEADRP CO[C@@H](C)[C@H](C)[NH2+]C1CCC(C[NH+](C)C)CC1 ZINC000678604016 488270327 /nfs/dbraw/zinc/27/03/27/488270327.db2.gz VLDYBNZAOYULOZ-FEPKRQSRSA-N 2 0 242.407 2.120 20 0 BEADRP CC(C)C[N@@H+]1CCCN(c2cc[nH+]cc2)CC1 ZINC000684574944 488328444 /nfs/dbraw/zinc/32/84/44/488328444.db2.gz HXEKSMIGCGCQIW-UHFFFAOYSA-N 2 0 233.359 2.250 20 0 BEADRP Cc1ccc(C[NH2+]CC[C@H]2CCC[N@@H+](C)C2)cn1 ZINC000459723582 490132705 /nfs/dbraw/zinc/13/27/05/490132705.db2.gz AERBXNWYGILKDD-CQSZACIVSA-N 2 0 247.386 2.212 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H]2CCS[C@@H]2C)CC1 ZINC000220841525 490150003 /nfs/dbraw/zinc/15/00/03/490150003.db2.gz KMMAYQOGBVTJCW-YPMHNXCESA-N 2 0 242.432 2.344 20 0 BEADRP COc1ccc(C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)c(C)c1 ZINC000577887122 490221009 /nfs/dbraw/zinc/22/10/09/490221009.db2.gz FIDLLDYWYHAFMA-ZIAGYGMSSA-N 2 0 248.370 2.363 20 0 BEADRP C[NH+](C)CCC[NH2+]Cc1ccc2[nH]ccc2c1 ZINC000083251103 490251838 /nfs/dbraw/zinc/25/18/38/490251838.db2.gz UXAPRAFSKXBSRZ-UHFFFAOYSA-N 2 0 231.343 2.209 20 0 BEADRP CCCCOCCN1CCC[C@H]([NH2+]C(C)C)C1 ZINC000071201382 490258759 /nfs/dbraw/zinc/25/87/59/490258759.db2.gz WVWORBCUZFJGGV-AWEZNQCLSA-N 2 0 242.407 2.266 20 0 BEADRP [NH3+]CCCC[NH2+]Cc1ccc(C(F)F)cc1 ZINC000124592820 490379403 /nfs/dbraw/zinc/37/94/03/490379403.db2.gz QTHWZFKSJPTNRK-UHFFFAOYSA-N 2 0 228.286 2.453 20 0 BEADRP C[C@@H]1CCCCC[C@H]1[NH2+]CCC[NH+](C)C ZINC000125021640 490410648 /nfs/dbraw/zinc/41/06/48/490410648.db2.gz JVQJLNKFOZZONR-CHWSQXEVSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H](CC1CCC1)[NH2+]CC1(N(C)C)CC1 ZINC000397825370 490539558 /nfs/dbraw/zinc/53/95/58/490539558.db2.gz AWRPKRKGFVNXTL-NSHDSACASA-N 2 0 210.365 2.249 20 0 BEADRP C([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)C1CCCC1 ZINC000400942760 491069158 /nfs/dbraw/zinc/06/91/58/491069158.db2.gz BUGRDFCOCMYNSD-MELADBBJSA-N 2 0 222.376 2.154 20 0 BEADRP Cc1ccncc1[C@H](C)NC[C@@H](C)C[NH+](C)C ZINC000293659109 491114347 /nfs/dbraw/zinc/11/43/47/491114347.db2.gz LUIHTCRZTMCQIS-YPMHNXCESA-N 2 0 235.375 2.238 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CCC2CC2)[C@H](C)C1 ZINC000090118304 491123011 /nfs/dbraw/zinc/12/30/11/491123011.db2.gz SVFYJPMEJDTZRF-YPMHNXCESA-N 2 0 210.365 2.106 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]C(C2CC2)C2CC2)C1 ZINC000086402329 491123841 /nfs/dbraw/zinc/12/38/41/491123841.db2.gz HBOSQUMJIVJVSP-NEPJUHHUSA-N 2 0 208.349 2.035 20 0 BEADRP CC[C@@H](C)[NH2+]Cc1ccc(C[NH3+])cc1F ZINC000086682308 491124060 /nfs/dbraw/zinc/12/40/60/491124060.db2.gz TUVFFLVNIUDEGE-SECBINFHSA-N 2 0 210.296 2.173 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)CC2CCC2)C1 ZINC000132426880 491135964 /nfs/dbraw/zinc/13/59/64/491135964.db2.gz CAFGXXFNXDRBOX-GXTWGEPZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H](CC1CC1)[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000400940945 533768344 /nfs/dbraw/zinc/76/83/44/533768344.db2.gz BEUXOMBTGKPRMC-YXCITZCRSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCCCS1)[C@@H]1CCC[NH2+]1 ZINC000400399362 533881008 /nfs/dbraw/zinc/88/10/08/533881008.db2.gz PJEGXYYHGNLUOP-SRVKXCTJSA-N 2 0 228.405 2.002 20 0 BEADRP C[C@H]([NH2+]C[C@@]1(C)CCCS1)[C@H]1CCC[NH2+]1 ZINC000400579502 533891414 /nfs/dbraw/zinc/89/14/14/533891414.db2.gz QGUVFBCZRQGKST-QJPTWQEYSA-N 2 0 228.405 2.002 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C2CC[NH+](CC3CC3)CC2)[C@H]1C ZINC000494889568 533943184 /nfs/dbraw/zinc/94/31/84/533943184.db2.gz BUZXYLHWXNHPFE-XUJVJEKNSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@@H]1C[C@H]1C[N@H+](C)CC[C@@H]1CCCC[NH+]1C ZINC000488336111 534016326 /nfs/dbraw/zinc/01/63/26/534016326.db2.gz SYXMAGKAVCJLJL-RDBSUJKOSA-N 2 0 224.392 2.449 20 0 BEADRP C[C@@H]1C[C@H]1C[N@H+](C)CC[C@H]1CCCC[NH+]1C ZINC000488336105 534019727 /nfs/dbraw/zinc/01/97/27/534019727.db2.gz SYXMAGKAVCJLJL-HZSPNIEDSA-N 2 0 224.392 2.449 20 0 BEADRP C[C@H]1OCC[C@]1(C)[NH2+]CCC[NH+]1CCCCC1 ZINC000494218080 534129681 /nfs/dbraw/zinc/12/96/81/534129681.db2.gz ZVHFYAXECCEQCC-KGLIPLIRSA-N 2 0 240.391 2.020 20 0 BEADRP CC[C@@H]1CCCC[C@H]1[NH2+]C[C@H]1CCC[NH2+]1 ZINC000261537122 535819209 /nfs/dbraw/zinc/81/92/09/535819209.db2.gz UXMBZFHWTXMKMS-JHJVBQTASA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1CCC[N@H+](CC2CC[NH+](C)CC2)[C@H]1C ZINC000891860926 582730567 /nfs/dbraw/zinc/73/05/67/582730567.db2.gz DUIDBGMWSPUHQF-OLZOCXBDSA-N 2 0 224.392 2.449 20 0 BEADRP C[C@@H]1CC[N@H+](CC2CC[NH+](C)CC2)C[C@@H]1C ZINC000892066934 582783292 /nfs/dbraw/zinc/78/32/92/582783292.db2.gz ZRLYIJGNCUPQJM-OLZOCXBDSA-N 2 0 224.392 2.306 20 0 BEADRP CC(C)(C)C[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000252668352 534613212 /nfs/dbraw/zinc/61/32/12/534613212.db2.gz VJNQQHQMQXDHRS-NEPJUHHUSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H]1C[C@@H](C)C[NH+](CC[C@H]2CCCC[NH2+]2)C1 ZINC000242463580 525210693 /nfs/dbraw/zinc/21/06/93/525210693.db2.gz DFIGHHKRSRRDCH-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)O[C@@H]1C[C@H]([NH2+]CCC[NH+](C)C)C1(C)C ZINC000185186611 534912056 /nfs/dbraw/zinc/91/20/56/534912056.db2.gz BZXUAGGTAATLCA-QWHCGFSZSA-N 2 0 242.407 2.120 20 0 BEADRP CC(C)C(C)(C)C[NH2+][C@@H](C)[C@H]1CCC[NH2+]1 ZINC000400514676 527571894 /nfs/dbraw/zinc/57/18/94/527571894.db2.gz MNUDXAKILLWVHD-NWDGAFQWSA-N 2 0 212.381 2.399 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+]C/C=C\c2ccncc2)C1 ZINC000486986781 527742565 /nfs/dbraw/zinc/74/25/65/527742565.db2.gz ZKHLNODXCAUKFB-JZIMQPMSSA-N 2 0 245.370 2.026 20 0 BEADRP CC(C)[C@H]1CC[C@H]1[NH2+][C@@H]1CCCC[C@H]1[NH3+] ZINC000424377707 527816873 /nfs/dbraw/zinc/81/68/73/527816873.db2.gz RPGOEUYSUWYVQF-FDYHWXHSSA-N 2 0 210.365 2.281 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH+](C)C[C@@H]2C[C@H]2C)[C@H](C)C1 ZINC000488311710 527831038 /nfs/dbraw/zinc/83/10/38/527831038.db2.gz JUGZDWNKHNVVDO-MQYQWHSLSA-N 2 0 224.392 2.305 20 0 BEADRP CCC[N@H+](C)C[C@@H]1CC[NH+](C[C@@H]2C[C@@H]2C)C1 ZINC000488321746 527839159 /nfs/dbraw/zinc/83/91/59/527839159.db2.gz NRIMXTQTWXXTBZ-IHRRRGAJSA-N 2 0 224.392 2.306 20 0 BEADRP CCCC1(C[NH2+][C@@H](C)[C@H]2CCC[NH2+]2)CC1 ZINC000400674378 528061671 /nfs/dbraw/zinc/06/16/71/528061671.db2.gz VFTBDRAHHSMWIQ-NWDGAFQWSA-N 2 0 210.365 2.297 20 0 BEADRP CCC[C@H](C)[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000401044135 528066536 /nfs/dbraw/zinc/06/65/36/528066536.db2.gz LFKKQXHBFPFTCU-UMSGYPCISA-N 2 0 210.365 2.153 20 0 BEADRP CCC[C@H](C)[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000401044134 528067024 /nfs/dbraw/zinc/06/70/24/528067024.db2.gz LFKKQXHBFPFTCU-QNWHQSFQSA-N 2 0 210.365 2.153 20 0 BEADRP CC[NH+](CC)C[C@@H]1CC[N@H+](C[C@@H]2C[C@@H]2C)C1 ZINC000488351657 528175854 /nfs/dbraw/zinc/17/58/54/528175854.db2.gz FSKVYUXDQYLKJT-IHRRRGAJSA-N 2 0 224.392 2.306 20 0 BEADRP CC(C)[NH+]1CCC([N@H+](C)C[C@@H]2C[C@H]2C)CC1 ZINC000488354935 528991466 /nfs/dbraw/zinc/99/14/66/528991466.db2.gz WYFWKMZAESQJGI-OLZOCXBDSA-N 2 0 224.392 2.447 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000173871840 534949986 /nfs/dbraw/zinc/94/99/86/534949986.db2.gz LHDCCVOSHJHJBY-ZDUSSCGKSA-N 2 0 210.365 2.204 20 0 BEADRP CC(C)(CC[NH2+]C1CC[NH2+]CC1)C1CC1 ZINC000262312989 535038811 /nfs/dbraw/zinc/03/88/11/535038811.db2.gz ZFZJVJCDGSSPRC-UHFFFAOYSA-N 2 0 210.365 2.154 20 0 BEADRP CC(C)[C@H]1CCC[N@@H+]1C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000261533671 535183671 /nfs/dbraw/zinc/18/36/71/535183671.db2.gz JSPHLAMKDGFSQD-MGPQQGTHSA-N 2 0 224.392 2.495 20 0 BEADRP CC(C)C[C@@H]1CCC[N@@H+]1C[C@]1(C)CC[NH2+]C1 ZINC000261687663 535283819 /nfs/dbraw/zinc/28/38/19/535283819.db2.gz ASIQRXNYXNVFDM-UONOGXRCSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)C[C@@H]1CCC[N@@H+]1CC1CC[NH2+]CC1 ZINC000261812438 535284761 /nfs/dbraw/zinc/28/47/61/535284761.db2.gz RQCCKTWESOLVSL-AWEZNQCLSA-N 2 0 224.392 2.497 20 0 BEADRP CCC1(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)CC1 ZINC000252732459 535296433 /nfs/dbraw/zinc/29/64/33/535296433.db2.gz VDXFCZBOUYYXFI-OLZOCXBDSA-N 2 0 222.376 2.393 20 0 BEADRP CC(C)C[C@H]1CCC[N@@H+]1C[C@]1(C)CC[NH2+]C1 ZINC000261687665 535326895 /nfs/dbraw/zinc/32/68/95/535326895.db2.gz ASIQRXNYXNVFDM-ZIAGYGMSSA-N 2 0 224.392 2.497 20 0 BEADRP CC[NH+](CC)C[C@H]1CCCC[C@@H]1[NH2+]CCOC ZINC000348309345 535592691 /nfs/dbraw/zinc/59/26/91/535592691.db2.gz FXHVBTOTABMMEX-KGLIPLIRSA-N 2 0 242.407 2.123 20 0 BEADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@H]1CCC1(C)C ZINC000342735906 535596979 /nfs/dbraw/zinc/59/69/79/535596979.db2.gz PTWMSWLWOSOTJE-OLZOCXBDSA-N 2 0 242.407 2.121 20 0 BEADRP CC[NH+](CC)C[C@H]1CC[N@H+](CCCF)C1 ZINC000151130750 535596839 /nfs/dbraw/zinc/59/68/39/535596839.db2.gz RYAJRMFMBYVXCL-GFCCVEGCSA-N 2 0 216.344 2.010 20 0 BEADRP CC[NH+](CC)C[C@H]1CC[N@H+](CC[C@@H](C)F)C1 ZINC000352003395 535597972 /nfs/dbraw/zinc/59/79/72/535597972.db2.gz LUVWPEWJXQQIMA-CHWSQXEVSA-N 2 0 230.371 2.398 20 0 BEADRP CCC[C@H](C)C[N@@H+]1CC[C@H](C)[C@@H](C[NH3+])C1 ZINC000253226532 535611559 /nfs/dbraw/zinc/61/15/59/535611559.db2.gz JFLMCKHONSKUBU-AVGNSLFASA-N 2 0 212.381 2.339 20 0 BEADRP CCSCC[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000220870390 535684497 /nfs/dbraw/zinc/68/44/97/535684497.db2.gz LHHMFFUIZWJICW-UHFFFAOYSA-N 2 0 230.421 2.061 20 0 BEADRP CC[N@H+](CC1CC1)C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000261536034 535698513 /nfs/dbraw/zinc/69/85/13/535698513.db2.gz QEDHLTREQHCBGO-DGCLKSJQSA-N 2 0 210.365 2.106 20 0 BEADRP CCc1ccc(CC[N@@H+]2CC[C@](C)(C[NH3+])C2)cc1 ZINC000261704998 536170311 /nfs/dbraw/zinc/17/03/11/536170311.db2.gz LXCLGEKIBCTOHP-MRXNPFEDSA-N 2 0 246.398 2.462 20 0 BEADRP C[N@H+](CCC1CCCC1)C1CC[NH2+]CC1 ZINC000258963901 536320665 /nfs/dbraw/zinc/32/06/65/536320665.db2.gz LBCAPTPIFJOOHE-UHFFFAOYSA-N 2 0 210.365 2.251 20 0 BEADRP CN1CCC([NH2+][C@@H]2CCCC2(C)C)CC1 ZINC000086856236 536344825 /nfs/dbraw/zinc/34/48/25/536344825.db2.gz QITFTQKTVSCJJX-GFCCVEGCSA-N 2 0 210.365 2.249 20 0 BEADRP COc1cc(C[N@@H+]2CC[C@H]([C@H](C)[NH3+])C2)ccc1C ZINC000261644285 536773577 /nfs/dbraw/zinc/77/35/77/536773577.db2.gz AMBUYKXAVCXQEB-JSGCOSHPSA-N 2 0 248.370 2.173 20 0 BEADRP C([NH2+][C@@H]1CC[C@H]1C1CC1)[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000348072194 566261549 /nfs/dbraw/zinc/26/15/49/566261549.db2.gz ABIZOJKEJDVDJJ-TUKIKUTGSA-N 2 0 234.387 2.249 20 0 BEADRP C([NH2+][C@@H]1CC[C@@H]1C1CC1)[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000348072193 566261662 /nfs/dbraw/zinc/26/16/62/566261662.db2.gz ABIZOJKEJDVDJJ-NILFDRSVSA-N 2 0 234.387 2.249 20 0 BEADRP CCCC[C@H](CC)C[NH+]1C[C@@H]2C[NH2+]C[C@H]2C1 ZINC000251315567 566431811 /nfs/dbraw/zinc/43/18/11/566431811.db2.gz JKDGBULEUOPIDQ-IHRRRGAJSA-N 2 0 224.392 2.354 20 0 BEADRP CCCSC[C@@H](C)[NH2+]CC1CC[NH+](C)CC1 ZINC000892945242 583014739 /nfs/dbraw/zinc/01/47/39/583014739.db2.gz ZMMBLDIVBUZJPS-GFCCVEGCSA-N 2 0 244.448 2.450 20 0 BEADRP C[NH2+]C[C@H](C)NCc1cc(C)c(OC)c(C)c1 ZINC000853250606 588729502 /nfs/dbraw/zinc/72/95/02/588729502.db2.gz UVDFUVJBFAMZHB-LBPRGKRZSA-N 2 0 236.359 2.010 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+][C@@H]1CC[C@H]1C(C)C ZINC000854229936 588781130 /nfs/dbraw/zinc/78/11/30/588781130.db2.gz ARQQKANOQRCKRZ-YNEHKIRRSA-N 2 0 212.381 2.384 20 0 BEADRP C1C[C@H]([NH2+][C@H]2CC[C@@H]3CCCC[C@@H]3C2)C[NH2+]1 ZINC000854222332 588780172 /nfs/dbraw/zinc/78/01/72/588780172.db2.gz DQEKDOYOTGQRDT-CRWXNKLISA-N 2 0 222.376 2.297 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2CCC[C@@H]2C2CC2)CC1 ZINC000891934141 582739873 /nfs/dbraw/zinc/73/98/73/582739873.db2.gz WYPMUCBKTFYXPB-CQSZACIVSA-N 2 0 222.376 2.203 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1)C1CC1 ZINC000132912804 582741426 /nfs/dbraw/zinc/74/14/26/582741426.db2.gz PDOAAVCEEHRMJR-NQBHXWOUSA-N 2 0 210.365 2.105 20 0 BEADRP Cc1cncc(C[NH2+][C@@H](C)C2CC[NH+](C)CC2)c1 ZINC000396450908 583082521 /nfs/dbraw/zinc/08/25/21/583082521.db2.gz GNLBOTYFPGPHPS-ZDUSSCGKSA-N 2 0 247.386 2.210 20 0 BEADRP C[C@H]([NH2+][C@H]1CCCC1(F)F)C1CC[NH+](C)CC1 ZINC000398040139 583118452 /nfs/dbraw/zinc/11/84/52/583118452.db2.gz RNPONMQWCNOUPF-JQWIXIFHSA-N 2 0 246.345 2.494 20 0 BEADRP CCCCCC[N@@H+]1C[C@H]2CCC[C@@]2([NH3+])C1 ZINC000857086984 588886966 /nfs/dbraw/zinc/88/69/66/588886966.db2.gz OZSAIIDWCOHLON-CHWSQXEVSA-N 2 0 210.365 2.380 20 0 BEADRP Cc1coc(C[NH+]2CCC(C[NH+](C)C)CC2)c1 ZINC000893939289 583255263 /nfs/dbraw/zinc/25/52/63/583255263.db2.gz DOAKAIFTSFZMHJ-UHFFFAOYSA-N 2 0 236.359 2.362 20 0 BEADRP C[N@@H+]1CCC[C@H]1CC[NH+]1CCC[C@H](CF)C1 ZINC000880237079 583505825 /nfs/dbraw/zinc/50/58/25/583505825.db2.gz PQJFWUHTRMIKBL-OLZOCXBDSA-N 2 0 228.355 2.152 20 0 BEADRP C[C@@H]1[C@@H](C)[C@H](C)C[N@@H+]1CC1CC[NH+](C)CC1 ZINC000894959557 583559496 /nfs/dbraw/zinc/55/94/96/583559496.db2.gz YIRCEFYWDLFQIZ-FRRDWIJNSA-N 2 0 224.392 2.305 20 0 BEADRP C[NH+]1CCC(C[NH+]2CC(C)(CC(F)F)C2)CC1 ZINC000895105157 583589533 /nfs/dbraw/zinc/58/95/33/583589533.db2.gz PIDNJNPALOSICF-UHFFFAOYSA-N 2 0 246.345 2.305 20 0 BEADRP CC1=CC[C@@H]([NH2+]CC[C@@H](C)[NH+](C)C)CC1 ZINC000895294349 583638368 /nfs/dbraw/zinc/63/83/68/583638368.db2.gz UJYMSPDZZVTDMJ-CHWSQXEVSA-N 2 0 210.365 2.415 20 0 BEADRP COC[C@H](CC(C)(C)C)[NH2+]CC[C@@H](C)[NH+](C)C ZINC000895292592 583638808 /nfs/dbraw/zinc/63/88/08/583638808.db2.gz RAUGZAPBGNUZEZ-OLZOCXBDSA-N 2 0 244.423 2.367 20 0 BEADRP CC(C)[C@@H]1C[C@@H]([NH2+]CC[C@@H](C)[NH+](C)C)CS1 ZINC000895293729 583639446 /nfs/dbraw/zinc/63/94/46/583639446.db2.gz KPPKZNQVOXOVQW-UPJWGTAASA-N 2 0 244.448 2.446 20 0 BEADRP C[C@H](CC[NH2+]C1C[C@H]2CCC[C@@H]2C1)[NH+](C)C ZINC000895429605 583669297 /nfs/dbraw/zinc/66/92/97/583669297.db2.gz QQIMNQLKWYURFH-JHJVBQTASA-N 2 0 224.392 2.495 20 0 BEADRP CC(C)CC[NH+]1CCC([NH2+]C2CSC2)CC1 ZINC000895435306 583673018 /nfs/dbraw/zinc/67/30/18/583673018.db2.gz YKFCAAQTEVWODZ-UHFFFAOYSA-N 2 0 242.432 2.202 20 0 BEADRP CC(C)(C)[NH+]1CCC([NH2+]CC2CSC2)CC1 ZINC000895421700 583673117 /nfs/dbraw/zinc/67/31/17/583673117.db2.gz UOEVTLOHWVUHKU-UHFFFAOYSA-N 2 0 242.432 2.202 20 0 BEADRP Cc1ncc(CN2CCC(C)([NH+]3CCC3)CC2)o1 ZINC000895670900 583706187 /nfs/dbraw/zinc/70/61/87/583706187.db2.gz ICWNRKGOIGHODP-UHFFFAOYSA-N 2 0 249.358 2.043 20 0 BEADRP C[N@@H+]1CC[C@@H]1CNc1cc[nH+]c2cc(F)ccc12 ZINC000895770732 583725455 /nfs/dbraw/zinc/72/54/55/583725455.db2.gz DHUKIXHJXISTGH-LLVKDONJSA-N 2 0 245.301 2.490 20 0 BEADRP C[N@H+](CCCF)Cc1ccnn1-c1cc[nH+]cc1 ZINC000895895889 583743468 /nfs/dbraw/zinc/74/34/68/583743468.db2.gz HTGREEWGNHYMMH-UHFFFAOYSA-N 2 0 248.305 2.059 20 0 BEADRP C[C@@H]1[C@@H]([NH2+]CC2Cc3ccccc3C2)CCN1C ZINC000896555566 583811905 /nfs/dbraw/zinc/81/19/05/583811905.db2.gz OPRMNVFOZGQDSW-WBMJQRKESA-N 2 0 244.382 2.084 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CCCCCCO)CC1(C)C ZINC000858155479 588936190 /nfs/dbraw/zinc/93/61/90/588936190.db2.gz JSQFDCDMLHIMTI-ZDUSSCGKSA-N 2 0 242.407 2.002 20 0 BEADRP CC(=O)CC[NH+]1CCC(C[N@@H+](C)C(C)C)CC1 ZINC000728926218 583937258 /nfs/dbraw/zinc/93/72/58/583937258.db2.gz GNHJGZKGMUUTTL-UHFFFAOYSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@@H]1CN(C)C[C@@H]1[NH2+][C@@H]1CCSC(C)(C)C1 ZINC000897797225 584049048 /nfs/dbraw/zinc/04/90/48/584049048.db2.gz FGKUMHXWDBSREG-UTUOFQBUSA-N 2 0 242.432 2.200 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@@H]2C[C@@H]3CCC[C@H]23)CC1 ZINC000897959816 584067306 /nfs/dbraw/zinc/06/73/06/584067306.db2.gz LTXAYJKGALINAA-MELADBBJSA-N 2 0 222.376 2.106 20 0 BEADRP Cc1ncccc1CC[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000898251639 584100658 /nfs/dbraw/zinc/10/06/58/584100658.db2.gz GPYPNBCTTCQVPS-SWLSCSKDSA-N 2 0 247.386 2.005 20 0 BEADRP CCc1ccc([C@H](C)[NH2+]C[C@H]2C[C@H]([NH3+])C2)o1 ZINC000873254769 584128267 /nfs/dbraw/zinc/12/82/67/584128267.db2.gz ADLCRZGNMRKGGS-DCAQKATOSA-N 2 0 222.332 2.230 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)C1CCCCC1 ZINC000873255020 584128331 /nfs/dbraw/zinc/12/83/31/584128331.db2.gz DBSWHSLNKVZMEC-WZRBSPASSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H]1C1CC1)C1CC[NH2+]CC1 ZINC000873271862 584128775 /nfs/dbraw/zinc/12/87/75/584128775.db2.gz MSEIFWBPFLXYLD-ZLKJLUDKSA-N 2 0 222.376 2.153 20 0 BEADRP C(SC[C@H]1CCCC[NH2+]C1)C1CC[NH2+]CC1 ZINC000899632611 584221810 /nfs/dbraw/zinc/22/18/10/584221810.db2.gz FTTLAKYIOWQMHU-ZDUSSCGKSA-N 2 0 242.432 2.109 20 0 BEADRP COc1ccc([C@@H](C)[NH2+][C@@H](C)C2C[NH2+]C2)cc1C ZINC000902407456 584574741 /nfs/dbraw/zinc/57/47/41/584574741.db2.gz ZMMYRWZXEZNGBK-NEPJUHHUSA-N 2 0 248.370 2.262 20 0 BEADRP Cc1ccc2c(c1)[C@@H]([NH2+]CC1([NH3+])CC1)[C@@H](C)C2 ZINC000902412519 584576065 /nfs/dbraw/zinc/57/60/65/584576065.db2.gz CGQCYNFTZQEQHF-FZMZJTMJSA-N 2 0 230.355 2.309 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+]CC1([NH3+])CC1)[C@@H](C)C2 ZINC000902412521 584576118 /nfs/dbraw/zinc/57/61/18/584576118.db2.gz CGQCYNFTZQEQHF-SMDDNHRTSA-N 2 0 230.355 2.309 20 0 BEADRP CCC1([NH2+][C@@H]2CC[NH2+]CC(C)(C)C2)CC1 ZINC000902386491 584578951 /nfs/dbraw/zinc/57/89/51/584578951.db2.gz FGEBPNYWQJLASO-LLVKDONJSA-N 2 0 210.365 2.297 20 0 BEADRP CC/C=C\C[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000902387428 584579144 /nfs/dbraw/zinc/57/91/44/584579144.db2.gz KSKOEYCUFALQLT-FOQNGQEVSA-N 2 0 210.365 2.320 20 0 BEADRP CC1(C)C[C@@H]1[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000902391054 584581770 /nfs/dbraw/zinc/58/17/70/584581770.db2.gz SBWKCIFLOWNQAB-QWRGUYRKSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)(F)CC[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000902394681 584582687 /nfs/dbraw/zinc/58/26/87/584582687.db2.gz ADOKWRBCKPJJEA-NSHDSACASA-N 2 0 230.371 2.492 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]([NH2+][C@@H]2C[C@H]3C[C@H]3C2)C1 ZINC000902391880 584582986 /nfs/dbraw/zinc/58/29/86/584582986.db2.gz CAAJFAQOSPNUEG-YVECIDJPSA-N 2 0 222.376 2.153 20 0 BEADRP CC1CC(C[NH2+][C@@H]2CC[NH2+]CC(C)(C)C2)C1 ZINC000902395826 584585285 /nfs/dbraw/zinc/58/52/85/584585285.db2.gz FSXHTSHOLARDOA-WXRRBKDZSA-N 2 0 224.392 2.400 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H]2CCC[C@@H](c3cccnc3)C2)CC1 ZINC000902405496 584589388 /nfs/dbraw/zinc/58/93/88/584589388.db2.gz IFCZLNSRRWGIOX-TZMCWYRMSA-N 2 0 245.370 2.189 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H]2CCC[C@@H](C3CC3)C2)CC1 ZINC000902416917 584591180 /nfs/dbraw/zinc/59/11/80/584591180.db2.gz PFWZOANCDIMTIP-VXGBXAGGSA-N 2 0 208.349 2.036 20 0 BEADRP CC1(C)CC[C@H](CC[NH2+][C@H]2CCC[C@@H]2[NH3+])OC1 ZINC000902428301 584594101 /nfs/dbraw/zinc/59/41/01/584594101.db2.gz BKSLGMOXTKRTIF-AGIUHOORSA-N 2 0 240.391 2.051 20 0 BEADRP CC1(C)CC[C@H](CC[NH2+][C@H]2CCC[C@H]2[NH3+])OC1 ZINC000902428304 584594994 /nfs/dbraw/zinc/59/49/94/584594994.db2.gz BKSLGMOXTKRTIF-UPJWGTAASA-N 2 0 240.391 2.051 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+][C@@H]1C[NH2+]CC1(C)C ZINC000902443973 584598208 /nfs/dbraw/zinc/59/82/08/584598208.db2.gz MRBBCGGXUQAUJK-QJPTWQEYSA-N 2 0 210.365 2.009 20 0 BEADRP CC[C@@H](NCC1([NH3+])CC1)c1ccc(F)cc1 ZINC000902414991 584600424 /nfs/dbraw/zinc/60/04/24/584600424.db2.gz IVUJQOWQDCARTO-GFCCVEGCSA-N 2 0 222.307 2.358 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+][C@@H]2C[C@H]3CC[C@@H]2[NH2+]3)C1 ZINC000902473240 584601510 /nfs/dbraw/zinc/60/15/10/584601510.db2.gz VUOXQZRVHZKHQU-NJMOYASZSA-N 2 0 208.349 2.048 20 0 BEADRP C1CC1[C@H]1CCCC[C@H]1[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902473826 584601897 /nfs/dbraw/zinc/60/18/97/584601897.db2.gz AERUVHRGIZAXCH-ARILJUKYSA-N 2 0 234.387 2.438 20 0 BEADRP C[C@@H](CC1CCC1)[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902476832 584602730 /nfs/dbraw/zinc/60/27/30/584602730.db2.gz PVNIUNKRARNTIQ-ZBAXXZLZSA-N 2 0 208.349 2.048 20 0 BEADRP CC1(C)CCC([NH2+][C@@H]2C[C@H]3CC[C@@H]2[NH2+]3)CC1 ZINC000902479004 584603191 /nfs/dbraw/zinc/60/31/91/584603191.db2.gz ZLSRNOYOZDSONX-FRRDWIJNSA-N 2 0 222.376 2.438 20 0 BEADRP CC1(C)C[NH2+]C[C@@H]1[NH2+][C@@H]1CC[C@@H]1C1CCC1 ZINC000902447226 584604065 /nfs/dbraw/zinc/60/40/65/584604065.db2.gz XIUMIYQMGDXVHV-UPJWGTAASA-N 2 0 222.376 2.153 20 0 BEADRP CC1(C)C[NH2+]C[C@@H]1[NH2+][C@H]1CC[C@@H]1C1CCC1 ZINC000902447224 584604166 /nfs/dbraw/zinc/60/41/66/584604166.db2.gz XIUMIYQMGDXVHV-AGIUHOORSA-N 2 0 222.376 2.153 20 0 BEADRP CC[C@H]([NH2+][C@@H]1C[NH2+]CC1(C)C)[C@@H]1C[C@@H]1C ZINC000902446945 584604383 /nfs/dbraw/zinc/60/43/83/584604383.db2.gz WJVNPJHHXNWRQE-WHOHXGKFSA-N 2 0 210.365 2.009 20 0 BEADRP CC1(C)C[NH2+]C[C@@H]1[NH2+][C@@H]1CC[C@H]1C1CCC1 ZINC000902447227 584604525 /nfs/dbraw/zinc/60/45/25/584604525.db2.gz XIUMIYQMGDXVHV-XQQFMLRXSA-N 2 0 222.376 2.153 20 0 BEADRP CC(C)[C@@H]([NH2+][C@H]1C[NH2+]CC1(C)C)C1CC1 ZINC000902450511 584606763 /nfs/dbraw/zinc/60/67/63/584606763.db2.gz SSWIOJVZMAXVNK-NWDGAFQWSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@@H]1[C@H]2CC[C@@H](C[C@@H]1[NH2+][C@@H]1C[C@@H]3CCC[C@@H]13)[NH2+]2 ZINC000902453028 584607785 /nfs/dbraw/zinc/60/77/85/584607785.db2.gz BPULQWQDPXJHGW-NGOQWVGTSA-N 2 0 234.387 2.294 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+][C@@H]1C[C@H]2CCC[C@@H]21 ZINC000902453431 584607939 /nfs/dbraw/zinc/60/79/39/584607939.db2.gz CSPDCHMYUKJEPR-XHJNMGKDSA-N 2 0 222.376 2.425 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]CC[C@H]1CCC(F)(F)C1 ZINC000902452741 584607957 /nfs/dbraw/zinc/60/79/57/584607957.db2.gz AGFVGYMUXGJSTH-MXWKQRLJSA-N 2 0 232.318 2.281 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]CC[C@@H]1CCC(F)(F)C1 ZINC000902452740 584608061 /nfs/dbraw/zinc/60/80/61/584608061.db2.gz AGFVGYMUXGJSTH-HBNTYKKESA-N 2 0 232.318 2.281 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC=CCCC1)C1C[NH2+]C1 ZINC000902454813 584609393 /nfs/dbraw/zinc/60/93/93/584609393.db2.gz IKKBDDIHQOGTPM-STQMWFEESA-N 2 0 222.376 2.320 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCCC2(CC2)C1)[C@H]1CCC[NH2+]1 ZINC000902455217 584609417 /nfs/dbraw/zinc/60/94/17/584609417.db2.gz WWEKUBFVAFTXGF-FRRDWIJNSA-N 2 0 222.376 2.439 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+][C@@H]1C[C@@H]2CCC[C@@H]12 ZINC000902456464 584609888 /nfs/dbraw/zinc/60/98/88/584609888.db2.gz PBAIGSUIPPEPJS-MAMMZVBQSA-N 2 0 234.387 2.281 20 0 BEADRP CC1(C)CCC[C@H](C[NH2+][C@H]2CCC[C@@H]2C[NH3+])O1 ZINC000902460247 584610949 /nfs/dbraw/zinc/61/09/49/584610949.db2.gz FUSBBYNDOWPVAC-UPJWGTAASA-N 2 0 240.391 2.051 20 0 BEADRP CC(C)CC[C@H](C)[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902464738 584612763 /nfs/dbraw/zinc/61/27/63/584612763.db2.gz CJBRGNSRAWUFLU-WUHRBBMRSA-N 2 0 210.365 2.294 20 0 BEADRP C[C@@H]1CC(C)(C)C[C@H]1[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902465094 584612827 /nfs/dbraw/zinc/61/28/27/584612827.db2.gz DCLJUSHROQSXBY-NZEXEKPDSA-N 2 0 222.376 2.294 20 0 BEADRP C[C@@H]1CC(C)(C)C[C@@H]1[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902464828 584612861 /nfs/dbraw/zinc/61/28/61/584612861.db2.gz DCLJUSHROQSXBY-LBELIVKGSA-N 2 0 222.376 2.294 20 0 BEADRP C[C@@H](CCC1CC1)[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902464383 584612943 /nfs/dbraw/zinc/61/29/43/584612943.db2.gz CBMOZIZNPSVKGF-ZBAXXZLZSA-N 2 0 208.349 2.048 20 0 BEADRP CC(C)[C@@H]1CCC[C@H]1[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902464813 584613012 /nfs/dbraw/zinc/61/30/12/584613012.db2.gz CWNZDDBPJWBSJM-ODXJTPSBSA-N 2 0 222.376 2.294 20 0 BEADRP C[C@]12C[C@H]1CCC[C@H]2[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902464865 584613203 /nfs/dbraw/zinc/61/32/03/584613203.db2.gz DZBVBHPPWSCAGK-WNWFYDSVSA-N 2 0 220.360 2.048 20 0 BEADRP C[C@H]1CC(C)(C)C[C@@H]1[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902464833 584613459 /nfs/dbraw/zinc/61/34/59/584613459.db2.gz DCLJUSHROQSXBY-OFTGVCEQSA-N 2 0 222.376 2.294 20 0 BEADRP CCCCC[C@H](C)[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902467284 584614436 /nfs/dbraw/zinc/61/44/36/584614436.db2.gz OROLMYWPDORAHG-WUHRBBMRSA-N 2 0 210.365 2.438 20 0 BEADRP FC(F)C1CCC([NH2+][C@@H]2C[C@H]3CC[C@@H]2[NH2+]3)CC1 ZINC000902466837 584615047 /nfs/dbraw/zinc/61/50/47/584615047.db2.gz NLNDXWIOCBVIPT-UAQGADGFSA-N 2 0 244.329 2.293 20 0 BEADRP CC1(C)CCC[C@@H]1[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902468515 584615380 /nfs/dbraw/zinc/61/53/80/584615380.db2.gz UXJGZPPURBFECI-QCNOEVLYSA-N 2 0 208.349 2.048 20 0 BEADRP CCC[C@H]([NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2)C1CCC1 ZINC000902469356 584615878 /nfs/dbraw/zinc/61/58/78/584615878.db2.gz PKBYRSZUNPZSRB-IGQOVBAYSA-N 2 0 222.376 2.438 20 0 BEADRP C[C@H]1CCC[C@H](C)C1[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902470732 584616460 /nfs/dbraw/zinc/61/64/60/584616460.db2.gz GFSBCSXKHDJQJH-JZRPKSSGSA-N 2 0 222.376 2.294 20 0 BEADRP CC1(C)CCC([NH2+][C@H]2C[C@H](C[NH3+])C2)CC1 ZINC000902490006 584617475 /nfs/dbraw/zinc/61/74/75/584617475.db2.gz QTQJHMKMWUVELM-UMSPYCQHSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H](CSC(C)(C)C)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902490041 584617654 /nfs/dbraw/zinc/61/76/54/584617654.db2.gz REQVQPQOSZTPEG-GMTAPVOTSA-N 2 0 230.421 2.234 20 0 BEADRP CC[C@@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)C1CCCC1 ZINC000902491740 584618122 /nfs/dbraw/zinc/61/81/22/584618122.db2.gz YJDKCUPMSBEGOJ-RAIGVLPGSA-N 2 0 210.365 2.282 20 0 BEADRP CC[C@H]1CCC[C@H]([NH2+][C@H]2C[C@H](C[NH3+])C2)C1 ZINC000902491801 584618153 /nfs/dbraw/zinc/61/81/53/584618153.db2.gz ZXVIRQSKWSXMJM-CYDGBPFRSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+][C@@H]2CCc3ccccc32)C1 ZINC000902490968 584618313 /nfs/dbraw/zinc/61/83/13/584618313.db2.gz ZIYWXXZMQZELDM-MPKXVKKWSA-N 2 0 216.328 2.001 20 0 BEADRP COc1cccc([C@@H](C)[NH2+][C@H]2C[C@H](C[NH3+])C2)c1 ZINC000902490984 584618368 /nfs/dbraw/zinc/61/83/68/584618368.db2.gz ZZJFBKCHRFAWNA-NQBHXWOUSA-N 2 0 234.343 2.083 20 0 BEADRP CC[C@@H]([NH2+]C[C@H]1CCCCC[NH2+]1)C1CC1 ZINC000902482428 584623893 /nfs/dbraw/zinc/62/38/93/584623893.db2.gz LDWMDRWWCLFHEE-CHWSQXEVSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CCCCC[NH2+]1 ZINC000902485314 584624718 /nfs/dbraw/zinc/62/47/18/584624718.db2.gz ZPMAELGMXOIGLJ-AGIUHOORSA-N 2 0 210.365 2.297 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+][C@@H]2CCCNc3ccccc32)C1 ZINC000902484124 584624997 /nfs/dbraw/zinc/62/49/97/584624997.db2.gz DCCXPUNENGCEMV-LALPHHSUSA-N 2 0 245.370 2.260 20 0 BEADRP C[C@H](CCc1ccsc1)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902485518 584625378 /nfs/dbraw/zinc/62/53/78/584625378.db2.gz LNFUHTNFBCGAFN-RAIGVLPGSA-N 2 0 238.400 2.396 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+][C@@H]2CCCC23CCCC3)C1 ZINC000902486095 584625484 /nfs/dbraw/zinc/62/54/84/584625484.db2.gz PFWKTLSNEBHODK-JHJVBQTASA-N 2 0 222.376 2.426 20 0 BEADRP CC(C)=CCC[C@H](C)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902486588 584625861 /nfs/dbraw/zinc/62/58/61/584625861.db2.gz ANOHQTZRZDDUIP-AVGNSLFASA-N 2 0 210.365 2.448 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+][C@H]2CCCOc3ccccc32)C1 ZINC000902487102 584625938 /nfs/dbraw/zinc/62/59/38/584625938.db2.gz JQIWMMJJMMXSTE-OBJOEFQTSA-N 2 0 246.354 2.227 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+][C@@H]2CCCC23CCC3)C1 ZINC000902486591 584626239 /nfs/dbraw/zinc/62/62/39/584626239.db2.gz GEKMJUDOXGYOPK-IJLUTSLNSA-N 2 0 208.349 2.036 20 0 BEADRP CCc1cccnc1[C@H](C)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902488445 584626629 /nfs/dbraw/zinc/62/66/29/584626629.db2.gz YJMJWOQJCSOVQF-GVXVVHGQSA-N 2 0 233.359 2.032 20 0 BEADRP COc1ccc(C)cc1[C@@H](C)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902489889 584627253 /nfs/dbraw/zinc/62/72/53/584627253.db2.gz SDTGCGWLXYMMFM-JHJVBQTASA-N 2 0 248.370 2.392 20 0 BEADRP C[C@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1ccc(F)c(F)c1 ZINC000902489461 584627302 /nfs/dbraw/zinc/62/73/02/584627302.db2.gz RPXAEXVWADLBFY-QXEWZRGKSA-N 2 0 240.297 2.353 20 0 BEADRP C[C@@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1ccc(F)cc1F ZINC000902488797 584627409 /nfs/dbraw/zinc/62/74/09/584627409.db2.gz NWTWMRBTYMKEMW-FXPVBKGRSA-N 2 0 240.297 2.353 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@@H](c2ccncc2)C2CC2)C1 ZINC000902513928 584629555 /nfs/dbraw/zinc/62/95/55/584629555.db2.gz IZDMQKKIRLXMGB-RBSFLKMASA-N 2 0 245.370 2.392 20 0 BEADRP Cc1ncccc1CC[NH2+][C@H]1CCCC[C@@H]1C[NH3+] ZINC000902514646 584629601 /nfs/dbraw/zinc/62/96/01/584629601.db2.gz TWCHXZDUFPHWJB-CABCVRRESA-N 2 0 247.386 2.040 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]C/C=C/Cl ZINC000902522045 584631433 /nfs/dbraw/zinc/63/14/33/584631433.db2.gz VPAJFKAIXCHDGE-SWTNXBIASA-N 2 0 239.750 2.252 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+][C@@H]1C[C@H]2CCC[C@H]2C1 ZINC000902780762 584669748 /nfs/dbraw/zinc/66/97/48/584669748.db2.gz SAHJFJQFFRTGSL-FQUUOJAGSA-N 2 0 224.392 2.495 20 0 BEADRP C1CC1N1CC[C@H]([NH2+][C@@H]2C[C@H]3CCC[C@H]3C2)C1 ZINC000902793938 584673285 /nfs/dbraw/zinc/67/32/85/584673285.db2.gz OYPUCVLISKNVQI-CRWXNKLISA-N 2 0 234.387 2.391 20 0 BEADRP C[N@@H+]1CCCC[C@H]1CCN1CCC[C@H](F)C1 ZINC000903002142 584716112 /nfs/dbraw/zinc/71/61/12/584716112.db2.gz WUOVXZFABKJGLJ-STQMWFEESA-N 2 0 228.355 2.295 20 0 BEADRP CCO[C@H]1CCC[C@@H]([NH2+]C[C@H]2CCCN2C)C1 ZINC000903063620 584722710 /nfs/dbraw/zinc/72/27/10/584722710.db2.gz GSVCSFJBWGRPLB-MCIONIFRSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@H]1C[C@H]1C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C1CC1 ZINC000903079326 584724589 /nfs/dbraw/zinc/72/45/89/584724589.db2.gz LXSOTDNWKYVAEN-RLIJAYAKSA-N 2 0 234.387 2.390 20 0 BEADRP COC(C)(C)[C@H](C)[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1 ZINC000903330426 584754152 /nfs/dbraw/zinc/75/41/52/584754152.db2.gz JZYHAKHGSSAZBV-RYUDHWBXSA-N 2 0 242.407 2.262 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@H+](C)[C@@H]1CCc2ccccc21 ZINC000903430296 584761617 /nfs/dbraw/zinc/76/16/17/584761617.db2.gz RRGARJJSVGANNF-IVMMDQJWSA-N 2 0 244.382 2.461 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@H+](C)[C@H]1CCc2ccccc21 ZINC000903430295 584761850 /nfs/dbraw/zinc/76/18/50/584761850.db2.gz RRGARJJSVGANNF-INWMFGNUSA-N 2 0 244.382 2.461 20 0 BEADRP [NH3+]C1CC[NH+](Cc2ccc3cc[nH]c3c2)CC1 ZINC000903420514 584763842 /nfs/dbraw/zinc/76/38/42/584763842.db2.gz ACIWBLIRCSIMMR-UHFFFAOYSA-N 2 0 229.327 2.091 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@@H]1CC[C@@H](C)C[C@@H]1C ZINC000903458928 584765937 /nfs/dbraw/zinc/76/59/37/584765937.db2.gz NFFDTUZHDNZNOR-XHJNMGKDSA-N 2 0 224.392 2.256 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@@H]1CCCC1(C)C ZINC000903459001 584766149 /nfs/dbraw/zinc/76/61/49/584766149.db2.gz PFUNPTJZJKNNBN-GRYCIOLGSA-N 2 0 210.365 2.010 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1CC2(C[C@H]1C)CC[NH2+]CC2 ZINC000903459845 584766440 /nfs/dbraw/zinc/76/64/40/584766440.db2.gz OQRYVAVKLKWLRD-MCIONIFRSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H]1C[C@H]([NH3+])CC[N@@H+]1Cc1ccc2cc[nH]c2c1 ZINC000903460841 584766527 /nfs/dbraw/zinc/76/65/27/584766527.db2.gz JRHZYIGKZXBHQC-SMDDNHRTSA-N 2 0 243.354 2.480 20 0 BEADRP CC[C@@H]1CCC[C@H](C)[N@@H+]1C[C@@H]1C[NH2+]C[C@H]1C ZINC000903464483 584766824 /nfs/dbraw/zinc/76/68/24/584766824.db2.gz PDUSAKAUHIFLJN-ZOBORPQBSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@]1(C[NH3+])CC[N@H+](Cc2ccc3cc[nH]c3c2)C1 ZINC000903451572 584771857 /nfs/dbraw/zinc/77/18/57/584771857.db2.gz BJQYPTASIXUFSY-OAHLLOKOSA-N 2 0 243.354 2.339 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[N@@H+]2CCC[C@H]2c2ccncc2)C1 ZINC000903455495 584774293 /nfs/dbraw/zinc/77/42/93/584774293.db2.gz WUOLUNJDKIIWDN-CFVMTHIKSA-N 2 0 245.370 2.346 20 0 BEADRP CC(C)=CCC[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000903470376 584774859 /nfs/dbraw/zinc/77/48/59/584774859.db2.gz AKHWBPDOWXSKON-GFCCVEGCSA-N 2 0 208.349 2.217 20 0 BEADRP C(CC1CCCC1)[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000903471215 584775245 /nfs/dbraw/zinc/77/52/45/584775245.db2.gz RXPCSTDKAUCDCV-CYBMUJFWSA-N 2 0 222.376 2.441 20 0 BEADRP FCCCCC[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000903471263 584775513 /nfs/dbraw/zinc/77/55/13/584775513.db2.gz HKJKAGKAZYFXTL-NSHDSACASA-N 2 0 214.328 2.000 20 0 BEADRP C(CC1CCC1)[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000903472903 584775904 /nfs/dbraw/zinc/77/59/04/584775904.db2.gz WPZBGJIHPIWJIV-GFCCVEGCSA-N 2 0 208.349 2.051 20 0 BEADRP CC1(C)CC(C[NH2+][C@H]2CC[NH2+]C23CCC3)C1 ZINC000903472758 584776150 /nfs/dbraw/zinc/77/61/50/584776150.db2.gz WBLSTHHABZJBRV-LBPRGKRZSA-N 2 0 222.376 2.297 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[NH+]2CCC(CCF)CC2)C1 ZINC000903476927 584777514 /nfs/dbraw/zinc/77/75/14/584777514.db2.gz OCRPIGULBUHFDO-QWHCGFSZSA-N 2 0 228.355 2.185 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+][C@H]1CC[NH2+]C12CCCC2 ZINC000903481589 584778099 /nfs/dbraw/zinc/77/80/99/584778099.db2.gz HDEDZTTWZIUSEA-AGIUHOORSA-N 2 0 222.376 2.297 20 0 BEADRP COCCCCC[NH2+][C@H]1CC[NH2+]C12CCCC2 ZINC000903482973 584778858 /nfs/dbraw/zinc/77/88/58/584778858.db2.gz ALTNDMVZZJZLPH-ZDUSSCGKSA-N 2 0 240.391 2.067 20 0 BEADRP CSCCC[NH2+][C@@H]1CC[NH2+]C12CCCC2 ZINC000903484852 584779279 /nfs/dbraw/zinc/77/92/79/584779279.db2.gz WXMHBCCKTIFITA-LLVKDONJSA-N 2 0 228.405 2.004 20 0 BEADRP CCCCC[NH2+][C@@H]1CC[NH2+]C12CCCC2 ZINC000903487451 584779759 /nfs/dbraw/zinc/77/97/59/584779759.db2.gz ADMPOUMKUMMIBL-GFCCVEGCSA-N 2 0 210.365 2.441 20 0 BEADRP CCc1cccc(CN2C[C@@H]([NH3+])C(C)(C)C2)c1 ZINC000903556771 584783214 /nfs/dbraw/zinc/78/32/14/584783214.db2.gz DMSJBXBBGLQWQE-CQSZACIVSA-N 2 0 232.371 2.418 20 0 BEADRP CC1CC(C[NH+]2CCC([NH2+]CC3CC3)CC2)C1 ZINC000903717724 584792228 /nfs/dbraw/zinc/79/22/28/584792228.db2.gz UISGKUURUKWIBW-UHFFFAOYSA-N 2 0 236.403 2.497 20 0 BEADRP C[NH2+]CCC1CC[NH+](CC2CC(C)C2)CC1 ZINC000903743322 584796667 /nfs/dbraw/zinc/79/66/67/584796667.db2.gz IPPFNWIOQLOGHU-UHFFFAOYSA-N 2 0 224.392 2.354 20 0 BEADRP C([C@H]1CCCC[NH2+]C1)[NH+](C1CC1)C1CC1 ZINC000903769404 584797989 /nfs/dbraw/zinc/79/79/89/584797989.db2.gz FNHYALTUEKWCED-NSHDSACASA-N 2 0 208.349 2.003 20 0 BEADRP C[C@]12C[N@H+](CC[C@H]3CC[NH2+]C3)C[C@H]1[C@H]1C=C[C@@H]2C1 ZINC000903826309 584805063 /nfs/dbraw/zinc/80/50/63/584805063.db2.gz HVFGFBVZIWBZOZ-DGADGQDISA-N 2 0 246.398 2.130 20 0 BEADRP C[C@H]1CSCCC[N@@H+]1CC[C@H]1CCC[NH2+]C1 ZINC000903829231 584805620 /nfs/dbraw/zinc/80/56/20/584805620.db2.gz CLCZCZXQNJLULC-QWHCGFSZSA-N 2 0 242.432 2.204 20 0 BEADRP C[C@@H]1CSCCC[N@@H+]1CCC1CC[NH2+]CC1 ZINC000903829322 584805634 /nfs/dbraw/zinc/80/56/34/584805634.db2.gz CSDZXYNLVCPTKP-GFCCVEGCSA-N 2 0 242.432 2.204 20 0 BEADRP FCCC1C[C@H]2CC[C@@H](C1)[N@H+]2C[C@@H]1CC[NH2+]C1 ZINC000903831895 584806178 /nfs/dbraw/zinc/80/61/78/584806178.db2.gz MZTBQIPTSQFLHD-CPIKKWJDSA-N 2 0 240.366 2.199 20 0 BEADRP C[C@@H]1CC=CC[C@H]1[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000903850369 584807919 /nfs/dbraw/zinc/80/79/19/584807919.db2.gz PESYZNTXVLSSGJ-HZSPNIEDSA-N 2 0 222.376 2.320 20 0 BEADRP CCC(CC)C[N@@H+]1CCC[C@]12CC[NH2+]C2 ZINC000903869226 584814513 /nfs/dbraw/zinc/81/45/13/584814513.db2.gz DVWVUTKSMRGUFU-CYBMUJFWSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@@H]1C[N@H+](C[C@H]([NH3+])CC(F)F)[C@H]2CCCC[C@@H]12 ZINC000903903515 584821032 /nfs/dbraw/zinc/82/10/32/584821032.db2.gz UXFQUUBPMLZLGQ-WYUUTHIRSA-N 2 0 246.345 2.479 20 0 BEADRP C[C@@H](Cc1cccs1)[NH2+]C[C@@H]([NH3+])CC(F)F ZINC000903923258 584823906 /nfs/dbraw/zinc/82/39/06/584823906.db2.gz OZMFWTRPCSLLCO-IUCAKERBSA-N 2 0 248.342 2.251 20 0 BEADRP C[C@@H]1CC(C)(C)CN1C[C@H]([NH3+])CC(F)F ZINC000903929185 584824370 /nfs/dbraw/zinc/82/43/70/584824370.db2.gz BMZXJIGGAGSABT-RKDXNWHRSA-N 2 0 220.307 2.089 20 0 BEADRP C[C@@H](C[C@@H]1CCCCC[NH2+]1)NCCC(C)(C)[NH3+] ZINC000903939440 584825950 /nfs/dbraw/zinc/82/59/50/584825950.db2.gz HKQSTWLKVZNXHO-STQMWFEESA-N 2 0 241.423 2.014 20 0 BEADRP CC(C)([NH3+])CC[NH2+]Cc1nccc2ccccc21 ZINC000903938563 584826671 /nfs/dbraw/zinc/82/66/71/584826671.db2.gz GSMGRUPUICZPSR-UHFFFAOYSA-N 2 0 243.354 2.452 20 0 BEADRP Cc1ccc(F)cc1C[NH2+]CCC(C)(C)[NH3+] ZINC000903938726 584826942 /nfs/dbraw/zinc/82/69/42/584826942.db2.gz IHNQQDXDAXTSJS-UHFFFAOYSA-N 2 0 224.323 2.351 20 0 BEADRP CC1(C)CCC[C@@H]1[NH2+]C[C@H]1C[NH2+]CCC1(F)F ZINC000903957950 584827527 /nfs/dbraw/zinc/82/75/27/584827527.db2.gz UYTVHLHWWBMAKP-MNOVXSKESA-N 2 0 246.345 2.400 20 0 BEADRP C[C@H](Cc1ccccc1F)[NH2+]CCC(C)(C)[NH3+] ZINC000903939831 584828980 /nfs/dbraw/zinc/82/89/80/584828980.db2.gz OAQYEZRYPVEIEZ-LLVKDONJSA-N 2 0 238.350 2.474 20 0 BEADRP CC(C)C[C@H](C)C[NH2+]CCC(C)(C)[NH3+] ZINC000903939598 584828993 /nfs/dbraw/zinc/82/89/93/584828993.db2.gz JVUOQZXIGPIGDE-NSHDSACASA-N 2 0 200.370 2.386 20 0 BEADRP CCC[C@H](C)C[NH2+]C[C@@H]1C[NH2+]CCC1(F)F ZINC000903955772 584832023 /nfs/dbraw/zinc/83/20/23/584832023.db2.gz YPKOCPJPAGZDMO-QWRGUYRKSA-N 2 0 234.334 2.257 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[NH2+]CCC1(F)F)C1CCC1 ZINC000903956120 584832263 /nfs/dbraw/zinc/83/22/63/584832263.db2.gz HEZZNDYGNPSCHH-MWLCHTKSSA-N 2 0 232.318 2.009 20 0 BEADRP CCC[C@H](CC)[NH2+]C[C@@H]1C[NH2+]CCC1(F)F ZINC000903955938 584832322 /nfs/dbraw/zinc/83/23/22/584832322.db2.gz CHUBLZXKNQTOGF-QWRGUYRKSA-N 2 0 234.334 2.400 20 0 BEADRP CCC[C@@H](CC)[NH2+]C[C@H]1C[NH2+]CCC1(F)F ZINC000903955936 584832381 /nfs/dbraw/zinc/83/23/81/584832381.db2.gz CHUBLZXKNQTOGF-GHMZBOCLSA-N 2 0 234.334 2.400 20 0 BEADRP Cc1ccc(C[NH2+]CC[C@@H]2C[NH2+]C[C@H]2C)cc1 ZINC000903974349 584832487 /nfs/dbraw/zinc/83/24/87/584832487.db2.gz OZINLKGNPYAQCZ-UKRRQHHQSA-N 2 0 232.371 2.330 20 0 BEADRP Cc1ccc(C)c(C[NH2+]C[C@@H]2C[NH2+]C[C@H]2C)c1 ZINC000903964669 584833985 /nfs/dbraw/zinc/83/39/85/584833985.db2.gz OBKRESJASVPIND-HIFRSBDPSA-N 2 0 232.371 2.249 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+]C/C=C/c1ccc(F)cc1 ZINC000903964242 584834255 /nfs/dbraw/zinc/83/42/55/584834255.db2.gz GCNFGUZQNSMJCU-SDEBIZQBSA-N 2 0 248.345 2.284 20 0 BEADRP CC(C)C[C@@H](C)C[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000903966737 584834460 /nfs/dbraw/zinc/83/44/60/584834460.db2.gz AOEJKYXURSVMKT-JHJVBQTASA-N 2 0 212.381 2.114 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+]C[C@H]1CCCC[C@H]1C ZINC000903964884 584834518 /nfs/dbraw/zinc/83/45/18/584834518.db2.gz XSQXRMDQZGUIFT-FDYHWXHSSA-N 2 0 210.365 2.010 20 0 BEADRP Cc1cc(C)cc(C[NH2+]C[C@@H]2C[NH2+]C[C@H]2C)c1 ZINC000903964858 584834546 /nfs/dbraw/zinc/83/45/46/584834546.db2.gz SSJWBJZAWZCNLI-HIFRSBDPSA-N 2 0 232.371 2.249 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@@H]1CCC[C@@H](C2CC2)C1 ZINC000903967512 584834873 /nfs/dbraw/zinc/83/48/73/584834873.db2.gz KDXYLPANKDEFSK-REBRKWNGSA-N 2 0 236.403 2.400 20 0 BEADRP CCC1CCC([NH2+]C[C@@H]2C[NH2+]C[C@H]2C)CC1 ZINC000903968687 584835188 /nfs/dbraw/zinc/83/51/88/584835188.db2.gz YOFWNNUSCDHOQX-ZIHBUVQPSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1C[C@@H](C[NH2+]C(C)(C)/C=C/Cl)CC[NH2+]1 ZINC000903988098 584836204 /nfs/dbraw/zinc/83/62/04/584836204.db2.gz NPKSAUBRCIXXEK-PVTPVBHGSA-N 2 0 230.783 2.495 20 0 BEADRP CN(C[C@@H]([NH3+])CCC(C)(C)C)CC(C)(C)C[NH3+] ZINC000904301562 584861571 /nfs/dbraw/zinc/86/15/71/584861571.db2.gz NTSVQXGYBDBRJK-LBPRGKRZSA-N 2 0 243.439 2.057 20 0 BEADRP C[N@H+](C[C@H]1C[C@@H]([NH3+])C1)[C@@H]1CCc2ccccc21 ZINC000904307948 584862745 /nfs/dbraw/zinc/86/27/45/584862745.db2.gz ZJJZAKSXUSANIJ-OSAQELSMSA-N 2 0 230.355 2.343 20 0 BEADRP C[C@@H]1CCC[C@H](C)[N@H+](C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000904321657 584864058 /nfs/dbraw/zinc/86/40/58/584864058.db2.gz BAGFPDPJSWEANE-XQHKEYJVSA-N 2 0 210.365 2.234 20 0 BEADRP CCCC[N@H+](CCOC)C[C@]1(C)CCC[NH2+]C1 ZINC000904321530 584864269 /nfs/dbraw/zinc/86/42/69/584864269.db2.gz ZNWXRYJKAYFZGQ-CQSZACIVSA-N 2 0 242.407 2.125 20 0 BEADRP Cc1cccc2c1CC[N@H+](C[C@H]1C[C@@H]([NH3+])C1)C2 ZINC000904318787 584864288 /nfs/dbraw/zinc/86/42/88/584864288.db2.gz WBPQCOLMFRGXIA-XBXGTLAGSA-N 2 0 230.355 2.090 20 0 BEADRP CC(C)([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccc(F)cc1 ZINC000904327846 584865258 /nfs/dbraw/zinc/86/52/58/584865258.db2.gz JEDLGYRNENHYFD-GSJFWJNXSA-N 2 0 236.334 2.388 20 0 BEADRP CC(C)(C)CC[C@@H]([NH3+])C[NH2+][C@@H](CO)C(C)(C)C ZINC000904341508 584867275 /nfs/dbraw/zinc/86/72/75/584867275.db2.gz SXNBBEUECUTLEF-NEPJUHHUSA-N 2 0 244.423 2.137 20 0 BEADRP CCCC[C@H](C[NH3+])NC[C@H]([NH3+])CCC(C)(C)C ZINC000904350886 584869355 /nfs/dbraw/zinc/86/93/55/584869355.db2.gz RXARTPBFROFUIA-CHWSQXEVSA-N 2 0 243.439 2.247 20 0 BEADRP Cc1cc(N)cc(C[NH2+]C[C@@]2(C)CCC[NH2+]C2)c1 ZINC000904355541 584871093 /nfs/dbraw/zinc/87/10/93/584871093.db2.gz UFYGYSVPBLNKEX-HNNXBMFYSA-N 2 0 247.386 2.057 20 0 BEADRP Cc1ccccc1OCCC[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000904362053 584871886 /nfs/dbraw/zinc/87/18/86/584871886.db2.gz GTWZFMDMRGEESC-OKILXGFUSA-N 2 0 248.370 2.091 20 0 BEADRP [NH3+]CC1CC([NH2+]Cc2ccccc2Cl)C1 ZINC000904361869 584872031 /nfs/dbraw/zinc/87/20/31/584872031.db2.gz AHOMOERGVJOGAC-UHFFFAOYSA-N 2 0 224.735 2.167 20 0 BEADRP CC[C@@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1c(C)noc1C ZINC000904361166 584872158 /nfs/dbraw/zinc/87/21/58/584872158.db2.gz WVNBDZSLTOKTOJ-GRYCIOLGSA-N 2 0 237.347 2.069 20 0 BEADRP CSc1ccc(C[NH2+]C2CC(C[NH3+])C2)cc1 ZINC000904368575 584872585 /nfs/dbraw/zinc/87/25/85/584872585.db2.gz LHFXBVAYDKBVKU-UHFFFAOYSA-N 2 0 236.384 2.235 20 0 BEADRP CC(C)(C)CC[C@@H]([NH3+])C[NH2+][C@H]1CCCOCC1 ZINC000904367526 584872749 /nfs/dbraw/zinc/87/27/49/584872749.db2.gz DQANOELGXLBOFU-OLZOCXBDSA-N 2 0 242.407 2.299 20 0 BEADRP CC(C)(C)CC[C@H]([NH3+])C[NH2+]C[C@H]1CCCCO1 ZINC000904367922 584872801 /nfs/dbraw/zinc/87/28/01/584872801.db2.gz KEVGUPGNBSADJI-QWHCGFSZSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+]C[C@H]([NH3+])CCC(C)(C)C)O1 ZINC000904370539 584873403 /nfs/dbraw/zinc/87/34/03/584873403.db2.gz AIGQTHGZHQCFPI-JHJVBQTASA-N 2 0 242.407 2.297 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[N@@H+]2CCCC[C@@H]2C2CCC2)C1 ZINC000904373651 584873715 /nfs/dbraw/zinc/87/37/15/584873715.db2.gz HTVULQONOSCDHU-KWCYVHTRSA-N 2 0 222.376 2.378 20 0 BEADRP CC(C)[C@@H](C[NH2+]C1CC(C[NH3+])C1)c1cccnc1 ZINC000904363519 584874565 /nfs/dbraw/zinc/87/45/65/584874565.db2.gz HKXREPQCUZXRQP-PESDSKBTSA-N 2 0 247.386 2.148 20 0 BEADRP [NH3+]CC1CC([NH2+]CCc2ccc(Cl)s2)C1 ZINC000904363872 584874572 /nfs/dbraw/zinc/87/45/72/584874572.db2.gz OWPSIVXVRYCCKA-UHFFFAOYSA-N 2 0 244.791 2.271 20 0 BEADRP CC(C)(C)CC[C@@H]([NH3+])C[NH2+]CC1CCOCC1 ZINC000904365917 584874824 /nfs/dbraw/zinc/87/48/24/584874824.db2.gz BLQHFZYZFHOTDY-CYBMUJFWSA-N 2 0 242.407 2.156 20 0 BEADRP Cc1cc(C)c(C[NH2+]C[C@H]2C[C@@H]([NH3+])C2)c(C)c1 ZINC000904365924 584874928 /nfs/dbraw/zinc/87/49/28/584874928.db2.gz BOBCNCRGNNBXCD-OKILXGFUSA-N 2 0 232.371 2.439 20 0 BEADRP C[C@@H]([NH2+]C1CC(C[NH3+])C1)c1c(F)cccc1F ZINC000904389350 584875584 /nfs/dbraw/zinc/87/55/84/584875584.db2.gz KTLLVBYUUDOKBB-XNWIYYODSA-N 2 0 240.297 2.353 20 0 BEADRP C[C@@]1(C[NH+]2CCC(CCF)CC2)CCC[NH2+]C1 ZINC000904383935 584877096 /nfs/dbraw/zinc/87/70/96/584877096.db2.gz DINUGNJMJQRYNK-CQSZACIVSA-N 2 0 242.382 2.448 20 0 BEADRP Cc1ccsc1C[N@@H+]1CC[C@@H](C[NH3+])[C@@H](C)C1 ZINC000904411814 584879827 /nfs/dbraw/zinc/87/98/27/584879827.db2.gz NPSQALISNHPADP-RYUDHWBXSA-N 2 0 238.400 2.473 20 0 BEADRP Cc1ccsc1C[N@@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1 ZINC000904420830 584882398 /nfs/dbraw/zinc/88/23/98/584882398.db2.gz HRSUAEGVFIDGKS-NWDGAFQWSA-N 2 0 236.384 2.098 20 0 BEADRP C[NH+](C)CC1CC[NH+](C[Si](C)(C)C)CC1 ZINC000732569520 584938734 /nfs/dbraw/zinc/93/87/34/584938734.db2.gz PJLOEAQTMVWQJI-UHFFFAOYSA-N 2 0 228.456 2.137 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CCNc2ccccc2)CC[N@@H+]1C ZINC000766514474 584942158 /nfs/dbraw/zinc/94/21/58/584942158.db2.gz GSTYXIIECQKTHW-ZFWWWQNUSA-N 2 0 247.386 2.171 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+][C@H](C)CSC(C)(C)C ZINC000817957273 584991482 /nfs/dbraw/zinc/99/14/82/584991482.db2.gz ADIFIQUWOHHLIM-MNOVXSKESA-N 2 0 232.437 2.480 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+][C@@H](C)CSC(C)(C)C ZINC000817957274 584991664 /nfs/dbraw/zinc/99/16/64/584991664.db2.gz ADIFIQUWOHHLIM-QWRGUYRKSA-N 2 0 232.437 2.480 20 0 BEADRP Cc1ccc2c(c1)CC[C@@H]2[NH2+][C@H](C)[C@@H](C)[NH3+] ZINC000817977264 584992989 /nfs/dbraw/zinc/99/29/89/584992989.db2.gz FUSFKGFBVBUEKQ-GYSYKLTISA-N 2 0 218.344 2.308 20 0 BEADRP Cc1ccc2c(c1)CC[C@@H]2[NH2+][C@H](C)[C@H](C)[NH3+] ZINC000817977267 584993336 /nfs/dbraw/zinc/99/33/36/584993336.db2.gz FUSFKGFBVBUEKQ-WDMOLILDSA-N 2 0 218.344 2.308 20 0 BEADRP C[C@@H]1CC[C@H]1[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000839165346 585095052 /nfs/dbraw/zinc/09/50/52/585095052.db2.gz NKPGXCDSQLSUQO-ZWNOBZJWSA-N 2 0 215.300 2.222 20 0 BEADRP C[C@H]1CC[C@@H]1[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000839165339 585095055 /nfs/dbraw/zinc/09/50/55/585095055.db2.gz NKPGXCDSQLSUQO-GWCFXTLKSA-N 2 0 215.300 2.222 20 0 BEADRP C[NH+](C)CCCCCCC[NH2+]Cc1cn[nH]c1 ZINC000749915301 585208177 /nfs/dbraw/zinc/20/81/77/585208177.db2.gz KKDVHAQYHCZPAW-UHFFFAOYSA-N 2 0 238.379 2.011 20 0 BEADRP CC(C)[N@H+](C)CC1CC[NH+](CCF)CC1 ZINC000759339323 585368809 /nfs/dbraw/zinc/36/88/09/585368809.db2.gz MLXYIXZHOWSBEW-UHFFFAOYSA-N 2 0 216.344 2.008 20 0 BEADRP C[C@@H](C[NH2+]C1CC(C(F)F)C1)C[NH+]1CCCC1 ZINC000768676980 585541603 /nfs/dbraw/zinc/54/16/03/585541603.db2.gz GECUWJCGCQVHOK-UNXYVOJBSA-N 2 0 246.345 2.352 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2CCC[C@H]2c2ccc[nH]2)CC1 ZINC000788487235 585925689 /nfs/dbraw/zinc/92/56/89/585925689.db2.gz FKULEZBWKNMJKI-HNNXBMFYSA-N 2 0 247.386 2.493 20 0 BEADRP C[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2Cc2ccoc2)C1 ZINC000809767221 586518285 /nfs/dbraw/zinc/51/82/85/586518285.db2.gz HTRWFMUTCUUMKN-KBPBESRZSA-N 2 0 234.343 2.196 20 0 BEADRP C[NH+](C)C1CCC([NH2+]C2CC(C(F)F)C2)CC1 ZINC000817416184 586802613 /nfs/dbraw/zinc/80/26/13/586802613.db2.gz OSWQPTQPAXFAEI-UHFFFAOYSA-N 2 0 246.345 2.493 20 0 BEADRP CC(C)Oc1cccc(C[NH2+][C@H](C)C2C[NH2+]C2)c1 ZINC000817888966 586832339 /nfs/dbraw/zinc/83/23/39/586832339.db2.gz QLNFACVEAMKAQW-GFCCVEGCSA-N 2 0 248.370 2.171 20 0 BEADRP Cc1cccc(F)c1C[NH2+][C@H](C)C[C@@H](C)[NH3+] ZINC000817896976 586835186 /nfs/dbraw/zinc/83/51/86/586835186.db2.gz AUQMRYXSMNMWPL-GHMZBOCLSA-N 2 0 224.323 2.350 20 0 BEADRP CS[C@@H]1CC[C@H]([NH2+][C@H]2CC[NH2+]CC[C@H]2C)C1 ZINC000817900504 586835848 /nfs/dbraw/zinc/83/58/48/586835848.db2.gz PHDXFVDZAIFMOO-XQHKEYJVSA-N 2 0 242.432 2.248 20 0 BEADRP C[C@@H]([NH2+]C1CC[NH2+]CC1)c1ccc2c(c1)CCO2 ZINC000817898890 586836288 /nfs/dbraw/zinc/83/62/88/586836288.db2.gz CECVIBNMIOEGFP-LLVKDONJSA-N 2 0 246.354 2.024 20 0 BEADRP CCN(C)c1ccccc1C[NH2+][C@H](C)C[C@@H](C)[NH3+] ZINC000817902621 586836436 /nfs/dbraw/zinc/83/64/36/586836436.db2.gz VMVWALXNJWZMFI-CHWSQXEVSA-N 2 0 249.402 2.358 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CCSC(C)(C)C ZINC000817908949 586836774 /nfs/dbraw/zinc/83/67/74/586836774.db2.gz UKDGHBXVADHSHN-UWVGGRQHSA-N 2 0 218.410 2.234 20 0 BEADRP Cc1cccc(C)c1C[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000817909108 586836779 /nfs/dbraw/zinc/83/67/79/586836779.db2.gz XUZSZOKZHYUURA-LBPRGKRZSA-N 2 0 218.344 2.001 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]CCSC(C)(C)C ZINC000817907646 586837013 /nfs/dbraw/zinc/83/70/13/586837013.db2.gz GZZKDTQVEUNYOX-NEPJUHHUSA-N 2 0 244.448 2.496 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CCSC(C)(C)C ZINC000817908951 586837404 /nfs/dbraw/zinc/83/74/04/586837404.db2.gz UKDGHBXVADHSHN-VHSXEESVSA-N 2 0 218.410 2.234 20 0 BEADRP CSCCCCCC[NH2+][C@H]1CCC[C@H]1[NH3+] ZINC000817922091 586840408 /nfs/dbraw/zinc/84/04/08/586840408.db2.gz PTTIYACAALEELO-NEPJUHHUSA-N 2 0 230.421 2.379 20 0 BEADRP Cc1cc(F)ccc1[C@@H](C)[NH2+]CCC[NH3+] ZINC000817938322 586843888 /nfs/dbraw/zinc/84/38/88/586843888.db2.gz JAEKKSLCROMUNR-SNVBAGLBSA-N 2 0 210.296 2.134 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H](C)CSC(C)(C)C ZINC000817939885 586845009 /nfs/dbraw/zinc/84/50/09/586845009.db2.gz HUQXFDNUMTYAOV-JTQLQIEISA-N 2 0 218.410 2.106 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H](C)c1ccnc(Cl)c1 ZINC000817953098 586848461 /nfs/dbraw/zinc/84/84/61/586848461.db2.gz MYPAPRREZMTJGR-IUCAKERBSA-N 2 0 227.739 2.123 20 0 BEADRP C[C@H](N[C@H](C[NH3+])C1CC1)c1ccc2c(c1)CCO2 ZINC000817959103 586851297 /nfs/dbraw/zinc/85/12/97/586851297.db2.gz CGKIJAZJVNYGFR-IINYFYTJSA-N 2 0 246.354 2.009 20 0 BEADRP C[C@H](CSC(C)(C)C)[NH2+]CC1([NH3+])CCC1 ZINC000817964801 586853952 /nfs/dbraw/zinc/85/39/52/586853952.db2.gz JKUVXPOVOGYPBT-SNVBAGLBSA-N 2 0 230.421 2.378 20 0 BEADRP Cc1cc(F)ccc1[C@H](C)[NH2+]CC1C[NH2+]C1 ZINC000817964504 586854009 /nfs/dbraw/zinc/85/40/09/586854009.db2.gz ATKWVZHMMNYHJG-JTQLQIEISA-N 2 0 222.307 2.004 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000817976674 586860938 /nfs/dbraw/zinc/86/09/38/586860938.db2.gz QYKXNIFRSGVSPD-AVGNSLFASA-N 2 0 222.376 2.153 20 0 BEADRP CCCCCC[N@@H+]1CCn2cncc2C1 ZINC000821269495 587104493 /nfs/dbraw/zinc/10/44/93/587104493.db2.gz FCIUWPAUPQUJBZ-UHFFFAOYSA-N 2 0 207.321 2.279 20 0 BEADRP CCCCCC[N@@H+]1CCc2nc[nH]c2C1 ZINC000821270708 587104720 /nfs/dbraw/zinc/10/47/20/587104720.db2.gz NNNANMWEINOLPU-UHFFFAOYSA-N 2 0 207.321 2.348 20 0 BEADRP CO[C@H]1CC[C@H]([NH+]2CCC([NH2+]C(C)C)CC2)C1 ZINC000821390349 587115336 /nfs/dbraw/zinc/11/53/36/587115336.db2.gz AFXDWTYFTXKLFW-KBPBESRZSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@@H](CCCc1cccnc1)[NH2+][C@@H]1CCN(C)C1 ZINC000834566690 587759586 /nfs/dbraw/zinc/75/95/86/587759586.db2.gz QHAQKAHDUCKMMJ-DZGCQCFKSA-N 2 0 247.386 2.087 20 0 BEADRP C[C@H]1CCC[C@H]1[NH2+]Cc1ccc(CC[NH3+])cc1 ZINC000841032667 587937085 /nfs/dbraw/zinc/93/70/85/587937085.db2.gz VKTHRJBFTMFLOH-SWLSCSKDSA-N 2 0 232.371 2.466 20 0 BEADRP COc1c(C)cc(C[NH2+][C@@H](C)CC[NH3+])cc1C ZINC000841051316 587939683 /nfs/dbraw/zinc/93/96/83/587939683.db2.gz NNHBFEPAYQETSQ-LBPRGKRZSA-N 2 0 236.359 2.139 20 0 BEADRP COc1cccc2cc(C[NH2+]C[C@@H](C)C[NH3+])oc21 ZINC000841049233 587939713 /nfs/dbraw/zinc/93/97/13/587939713.db2.gz OXBXLQFAWFDIMH-JTQLQIEISA-N 2 0 248.326 2.126 20 0 BEADRP CC[C@@H]([NH3+])CNCc1cnc2ccccc2c1 ZINC000841073540 587944359 /nfs/dbraw/zinc/94/43/59/587944359.db2.gz YUZBVYFNKZQZES-CYBMUJFWSA-N 2 0 229.327 2.062 20 0 BEADRP C[C@H]([NH3+])c1ccc(NC(=O)CCCCC[NH3+])cc1 ZINC000841849158 587977947 /nfs/dbraw/zinc/97/79/47/587977947.db2.gz YANZXRVWYSGEFO-NSHDSACASA-N 2 0 249.358 2.164 20 0 BEADRP Cc1cccc2c1CC[N@H+](C[C@]1(C)CC[NH2+]C1)C2 ZINC000843063896 588078793 /nfs/dbraw/zinc/07/87/93/588078793.db2.gz SWSBNAFLWCZITD-MRXNPFEDSA-N 2 0 244.382 2.353 20 0 BEADRP CC[C@@H]1C[C@H](C[NH2+]C2CCC([NH3+])CC2)CCO1 ZINC000843105557 588081635 /nfs/dbraw/zinc/08/16/35/588081635.db2.gz VXVAYWRUKZAPCB-BLYZHGLHSA-N 2 0 240.391 2.051 20 0 BEADRP CC[C@H]1C[C@H](C[NH+]2CCC(C)([NH3+])CC2)CCO1 ZINC000843108459 588081960 /nfs/dbraw/zinc/08/19/60/588081960.db2.gz SVVYMMRASSMVMI-OLZOCXBDSA-N 2 0 240.391 2.005 20 0 BEADRP COc1ccsc1C[NH2+]CCCCCC[NH3+] ZINC000843127376 588085329 /nfs/dbraw/zinc/08/53/29/588085329.db2.gz ORSFSNGAQJZMQL-UHFFFAOYSA-N 2 0 242.388 2.365 20 0 BEADRP [NH3+]CCCCCC[NH2+][C@@H]1CCC12CCOCC2 ZINC000843341568 588101162 /nfs/dbraw/zinc/10/11/62/588101162.db2.gz JMRVHBMILLPYNR-CYBMUJFWSA-N 2 0 240.391 2.054 20 0 BEADRP C[C@H]([NH2+]CCCCCC[NH3+])c1cncc(F)c1 ZINC000843340323 588101179 /nfs/dbraw/zinc/10/11/79/588101179.db2.gz AYRWEFQFFRITPC-NSHDSACASA-N 2 0 239.338 2.390 20 0 BEADRP C[C@@H](Cc1ccoc1)[NH2+]CCCCCC[NH3+] ZINC000843342206 588101224 /nfs/dbraw/zinc/10/12/24/588101224.db2.gz OMOUZIAHLANMES-LBPRGKRZSA-N 2 0 224.348 2.319 20 0 BEADRP COCC[C@H]1CCC[C@@H]1[NH2+]CCCCCC[NH3+] ZINC000843342913 588101501 /nfs/dbraw/zinc/10/15/01/588101501.db2.gz VCYRYHAYGAIKRQ-KGLIPLIRSA-N 2 0 242.407 2.300 20 0 BEADRP C[C@@H](N)[C@H]1CCCC[N@@H+]1CCCCCCC[NH3+] ZINC000843347953 588102404 /nfs/dbraw/zinc/10/24/04/588102404.db2.gz YXEAJFDMSLKFBW-ZIAGYGMSSA-N 2 0 241.423 2.097 20 0 BEADRP Cc1ccccc1OCC[NH2+][C@@](C)(C[NH3+])C1CC1 ZINC000843356597 588103912 /nfs/dbraw/zinc/10/39/12/588103912.db2.gz YEMHUINPPQPQDD-HNNXBMFYSA-N 2 0 248.370 2.091 20 0 BEADRP CC(C)CC1CC[NH+](C[C@H]2CC[NH2+]C2)CC1 ZINC000843359722 588104281 /nfs/dbraw/zinc/10/42/81/588104281.db2.gz WXGMGFMJXDHKDY-AWEZNQCLSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CC[C@]1(C)C[C@]1(F)Cl ZINC000844923583 588218939 /nfs/dbraw/zinc/21/89/39/588218939.db2.gz LMZAYSWTKXHATN-UKKRHICBSA-N 2 0 236.762 2.407 20 0 BEADRP [NH3+]CCCCCC[N@@H+]1CCC[C@@H]2COCC[C@H]21 ZINC000846219039 588260862 /nfs/dbraw/zinc/26/08/62/588260862.db2.gz DFPBIWTYDBQHEH-ZIAGYGMSSA-N 2 0 240.391 2.006 20 0 BEADRP [NH3+]CCCCCC[N@@H+]1CC[C@@H](c2ccccn2)C1 ZINC000846220376 588261031 /nfs/dbraw/zinc/26/10/31/588261031.db2.gz HOFSEUPKUYPSEN-CQSZACIVSA-N 2 0 247.386 2.390 20 0 BEADRP COCC1(C)CC[NH+](CCCCCC[NH3+])CC1 ZINC000846221523 588261453 /nfs/dbraw/zinc/26/14/53/588261453.db2.gz ZSTDXWOXGOMAJX-UHFFFAOYSA-N 2 0 242.407 2.254 20 0 BEADRP C[C@H]1CC2(C[N@@H+]1C/C=C\Cl)CC[NH2+]CC2 ZINC000846224462 588261538 /nfs/dbraw/zinc/26/15/38/588261538.db2.gz XSVZKOZBQZQQDA-SROOVFNMSA-N 2 0 228.767 2.203 20 0 BEADRP C[NH2+]CCC[N@H+](C)[C@H]1C[C@H]1c1ccccc1 ZINC000846222424 588261663 /nfs/dbraw/zinc/26/16/63/588261663.db2.gz OIEXAJXZUMXAEG-KBPBESRZSA-N 2 0 218.344 2.084 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000848557157 588396874 /nfs/dbraw/zinc/39/68/74/588396874.db2.gz FVOQTXBYRARQRS-RFQIPJPRSA-N 2 0 224.392 2.351 20 0 BEADRP CC(C)[C@H]1CC[C@@H]1[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000848557158 588397358 /nfs/dbraw/zinc/39/73/58/588397358.db2.gz FVOQTXBYRARQRS-RQJABVFESA-N 2 0 224.392 2.351 20 0 BEADRP Cc1cccc(F)c1C[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000848717400 588407767 /nfs/dbraw/zinc/40/77/67/588407767.db2.gz AOZNIMPUFCWLSQ-VXGBXAGGSA-N 2 0 236.334 2.494 20 0 BEADRP Cc1cccc(F)c1C[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000848717397 588407931 /nfs/dbraw/zinc/40/79/31/588407931.db2.gz AOZNIMPUFCWLSQ-NEPJUHHUSA-N 2 0 236.334 2.494 20 0 BEADRP CC(C)c1ccccc1C[NH+]1C[C@H]2C[NH2+]C[C@@H]2C1 ZINC000848890626 588417535 /nfs/dbraw/zinc/41/75/35/588417535.db2.gz SUIIIZOLLCUMIT-HUUCEWRRSA-N 2 0 244.382 2.461 20 0 BEADRP C[C@@H](CN1CCC(C)CC1)[NH2+][C@H]1CC[C@@H]1C ZINC000850544234 588559142 /nfs/dbraw/zinc/55/91/42/588559142.db2.gz UVGKAWASYYKWJB-IHRRRGAJSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H](CN1CCC(C)CC1)[NH2+][C@@H]1CC[C@H]1C ZINC000850544233 588559228 /nfs/dbraw/zinc/55/92/28/588559228.db2.gz UVGKAWASYYKWJB-HZSPNIEDSA-N 2 0 224.392 2.495 20 0 BEADRP C([C@@H]1CC[C@H]2C[C@H]2C1)[N@@H+]1CC[C@]2(CCC[NH2+]2)C1 ZINC000852751356 588700358 /nfs/dbraw/zinc/70/03/58/588700358.db2.gz YWQJNDUBAGVXGQ-LXTVHRRPSA-N 2 0 234.387 2.251 20 0 BEADRP CCC(C)(C)C[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000863483086 589292610 /nfs/dbraw/zinc/29/26/10/589292610.db2.gz QSGLGPBWLLKRGQ-LLVKDONJSA-N 2 0 210.365 2.297 20 0 BEADRP [NH3+]C1(C[NH2+]C2CCCCCCC2)CCOCC1 ZINC000863482290 589292772 /nfs/dbraw/zinc/29/27/72/589292772.db2.gz XYLCULDDCZNUOP-UHFFFAOYSA-N 2 0 240.391 2.197 20 0 BEADRP [NH3+]CCCCCC[N@@H+]1CCc2c(O)cccc2C1 ZINC000863557720 589298970 /nfs/dbraw/zinc/29/89/70/589298970.db2.gz PQLDAIZTFMUFLA-UHFFFAOYSA-N 2 0 248.370 2.269 20 0 BEADRP Cc1ccccc1CCCN(C)C[C@@H](C)[NH3+] ZINC000863568321 589300339 /nfs/dbraw/zinc/30/03/39/589300339.db2.gz JXNBJLVREMLWPS-CYBMUJFWSA-N 2 0 220.360 2.207 20 0 BEADRP COc1ccc2oc(CN(C)C[C@@H](C)[NH3+])cc2c1 ZINC000863651322 589307212 /nfs/dbraw/zinc/30/72/12/589307212.db2.gz GLPKQYLTGAXYNH-SNVBAGLBSA-N 2 0 248.326 2.220 20 0 BEADRP C[C@H]([NH3+])CN(C)Cc1nccc2ccccc21 ZINC000863652090 589307406 /nfs/dbraw/zinc/30/74/06/589307406.db2.gz QFWAFYJURWTLAJ-NSHDSACASA-N 2 0 229.327 2.014 20 0 BEADRP CS[C@H]1C[C@H]([NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)C1 ZINC000865733260 589459039 /nfs/dbraw/zinc/45/90/39/589459039.db2.gz GSQRQQHTWZHUQP-FDYHWXHSSA-N 2 0 240.416 2.097 20 0 BEADRP CC(C)(C)[C@]1(C[NH3+])CC[N@H+](C/C=C/Cl)C1 ZINC000866709047 589514369 /nfs/dbraw/zinc/51/43/69/589514369.db2.gz VKOVQWUPUDWHBJ-FUEXJSSKSA-N 2 0 230.783 2.436 20 0 BEADRP CC(C)(C)[C@]1(C[NH3+])CC[N@H+](C/C=C\Cl)C1 ZINC000866709049 589514375 /nfs/dbraw/zinc/51/43/75/589514375.db2.gz VKOVQWUPUDWHBJ-RNZFLTOJSA-N 2 0 230.783 2.436 20 0 BEADRP CC(C)(C)[C@]1(C[NH3+])CC[N@H+](CCCF)C1 ZINC000866709704 589514504 /nfs/dbraw/zinc/51/45/04/589514504.db2.gz ZBNGTQHCPVPSNY-LBPRGKRZSA-N 2 0 216.344 2.043 20 0 BEADRP CC(C)(C)[C@@]1(C[NH3+])CC[N@H+](Cc2ccncc2)C1 ZINC000866706415 589514688 /nfs/dbraw/zinc/51/46/88/589514688.db2.gz HZTMUZXNUSBNLU-OAHLLOKOSA-N 2 0 247.386 2.279 20 0 BEADRP C[C@@H]1C[C@H]1C[N@@H+]1CC[C@@](C[NH3+])(C(C)(C)C)C1 ZINC000866706699 589514738 /nfs/dbraw/zinc/51/47/38/589514738.db2.gz CBRCWGPTCHANEN-DYEKYZERSA-N 2 0 224.392 2.339 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CC[NH2+]CC(C)(C)C2)cn1 ZINC000872251843 589900800 /nfs/dbraw/zinc/90/08/00/589900800.db2.gz OEVYYFVFRXFGFL-CQSZACIVSA-N 2 0 247.386 2.258 20 0 BEADRP C[NH+](C)CC(C)(C)CNc1cc[nH+]cc1C1CC1 ZINC000872389045 589931093 /nfs/dbraw/zinc/93/10/93/589931093.db2.gz WSUWTNXAIQYIDW-UHFFFAOYSA-N 2 0 247.386 2.381 20 0 BEADRP CN(CC[N@H+](C)C1CC1)c1cc[nH+]cc1C1CC1 ZINC000872513707 589945942 /nfs/dbraw/zinc/94/59/42/589945942.db2.gz YWICMIXOHIDNTE-UHFFFAOYSA-N 2 0 245.370 2.489 20 0 BEADRP [NH3+][C@@H]1C[C@H]1c1ccc(NC2CCC([NH3+])CC2)cc1 ZINC000873214228 589996825 /nfs/dbraw/zinc/99/68/25/589996825.db2.gz BTSOOANCKWNRLN-RIXNLZLZSA-N 2 0 245.370 2.183 20 0 BEADRP F[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000873216031 589997895 /nfs/dbraw/zinc/99/78/95/589997895.db2.gz IEBDDWJCAFCDMD-ITGHMWBKSA-N 2 0 240.366 2.245 20 0 BEADRP CC(C)[C@H](C[NH3+])CNc1ccc([C@@H]2C[C@H]2[NH3+])cc1 ZINC000873215947 589998079 /nfs/dbraw/zinc/99/80/79/589998079.db2.gz MSWOGCDGOGYZAZ-VHDGCEQUSA-N 2 0 247.386 2.144 20 0 BEADRP CC(C)C[C@H]([NH3+])CNc1ccc([C@@H]2C[C@H]2[NH3+])cc1 ZINC000873216802 589998320 /nfs/dbraw/zinc/99/83/20/589998320.db2.gz XYTVVPSUJCUBRD-AEGPPILISA-N 2 0 247.386 2.287 20 0 BEADRP C([NH2+][C@@]12CCC[C@@H]1[NH2+]CC2)C1CCCCC1 ZINC000873229646 589998983 /nfs/dbraw/zinc/99/89/83/589998983.db2.gz DGGWYXYZDJWCDC-UONOGXRCSA-N 2 0 222.376 2.441 20 0 BEADRP CC(C)(C)[C@@]1(C[NH3+])CC[N@H+](CC2(F)CC2)C1 ZINC000873223610 590000921 /nfs/dbraw/zinc/00/09/21/590000921.db2.gz PAXHFJNCPOQFFM-GFCCVEGCSA-N 2 0 228.355 2.185 20 0 BEADRP CC(C)(C)CC[NH2+][C@]12CCC[C@@H]1[NH2+]CC2 ZINC000873232334 590003336 /nfs/dbraw/zinc/00/33/36/590003336.db2.gz WSSALVBCKZKCFE-AAEUAGOBSA-N 2 0 210.365 2.297 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CCCC[C@@H]1F ZINC000873238971 590005626 /nfs/dbraw/zinc/00/56/26/590005626.db2.gz KQSVPWGASAJAKJ-ZDEQEGDKSA-N 2 0 228.355 2.374 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+]CC1CCC2(CC2)CC1 ZINC000873242754 590006446 /nfs/dbraw/zinc/00/64/46/590006446.db2.gz SDNKBWAEHSIUAR-QWHCGFSZSA-N 2 0 222.376 2.426 20 0 BEADRP CCC[C@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccccn1 ZINC000873250088 590007275 /nfs/dbraw/zinc/00/72/75/590007275.db2.gz DJXBKIDFSMYRHN-XQQFMLRXSA-N 2 0 233.359 2.250 20 0 BEADRP Cc1cc([C@@H](C)[NH2+]C[C@H]2C[C@@H]([NH3+])C2)cs1 ZINC000873248907 590007377 /nfs/dbraw/zinc/00/73/77/590007377.db2.gz GXTISEWEPPEWHN-FOGDFJRCSA-N 2 0 224.373 2.444 20 0 BEADRP Cc1ccc([C@H](C)[NH2+]C[C@H]2C[C@@H]([NH3+])C2)c(C)n1 ZINC000873250358 590007840 /nfs/dbraw/zinc/00/78/40/590007840.db2.gz GNBORFZZXCRNON-WCFLWFBJSA-N 2 0 233.359 2.086 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1cc(F)cc(F)c1 ZINC000873253759 590009338 /nfs/dbraw/zinc/00/93/38/590009338.db2.gz DOKOURWWYDXKNF-MWODSPESSA-N 2 0 240.297 2.353 20 0 BEADRP C[C@@H](Cc1ccsc1)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873253675 590009552 /nfs/dbraw/zinc/00/95/52/590009552.db2.gz BWQRJWPLAXNLST-ZMLRMANQSA-N 2 0 224.373 2.006 20 0 BEADRP CCc1ccc([C@H](C)[NH2+]C[C@H]2C[C@@H]([NH3+])C2)o1 ZINC000873253534 590009674 /nfs/dbraw/zinc/00/96/74/590009674.db2.gz ADLCRZGNMRKGGS-GARJFASQSA-N 2 0 222.332 2.230 20 0 BEADRP Cc1ccc([C@H](C)[NH2+]C[C@H]2C[C@@H]([NH3+])C2)s1 ZINC000873255049 590010051 /nfs/dbraw/zinc/01/00/51/590010051.db2.gz DQULAIFTEUVYNH-GARJFASQSA-N 2 0 224.373 2.444 20 0 BEADRP C[C@@H]1CC(C)(C)C[C@@H]1[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873255261 590010156 /nfs/dbraw/zinc/01/01/56/590010156.db2.gz FMQBQXHCGRBNAY-KKOKHZNYSA-N 2 0 210.365 2.138 20 0 BEADRP CO[C@H](c1ccccc1)[C@@H](C)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873254961 590010178 /nfs/dbraw/zinc/01/01/78/590010178.db2.gz CISVZULNZXASCX-GBOPCIDUSA-N 2 0 248.370 2.090 20 0 BEADRP C[C@@H](Cc1ccsc1)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873254849 590010358 /nfs/dbraw/zinc/01/03/58/590010358.db2.gz BWQRJWPLAXNLST-DLOVCJGASA-N 2 0 224.373 2.006 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccc(F)cc1 ZINC000873256220 590010592 /nfs/dbraw/zinc/01/05/92/590010592.db2.gz MVFBMRQRDVARPR-BREBYQMCSA-N 2 0 222.307 2.214 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1ccc(Cl)nc1 ZINC000873256270 590010637 /nfs/dbraw/zinc/01/06/37/590010637.db2.gz MHMHAQMWKXDVAG-FXPVBKGRSA-N 2 0 239.750 2.123 20 0 BEADRP Cc1cc([C@@H](C)[NH2+]C[C@H]2C[C@H]([NH3+])C2)oc1C ZINC000873256111 590010767 /nfs/dbraw/zinc/01/07/67/590010767.db2.gz KJIHFODGPKADQG-YUSALJHKSA-N 2 0 222.332 2.284 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+]C(C2CCC2)C2CCC2)C1 ZINC000873255563 590010835 /nfs/dbraw/zinc/01/08/35/590010835.db2.gz HQLDDRJWHIEWJR-MJHDQNEOSA-N 2 0 222.376 2.282 20 0 BEADRP COc1ccc([C@H](C)[NH2+]C[C@H]2C[C@@H]([NH3+])C2)cc1 ZINC000873255633 590011038 /nfs/dbraw/zinc/01/10/38/590011038.db2.gz IMSBOOCXYGCKND-GMXVVIOVSA-N 2 0 234.343 2.083 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@H]2C[C@H]([NH3+])C2)C[C@H]1C ZINC000873256478 590011438 /nfs/dbraw/zinc/01/14/38/590011438.db2.gz MXFCUJQKBXLGHR-VEGXAWMVSA-N 2 0 210.365 2.138 20 0 BEADRP CC[C@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1ccc(OC)cc1 ZINC000873256586 590011509 /nfs/dbraw/zinc/01/15/09/590011509.db2.gz AKJYZDZHQBZMJF-WHOFXGATSA-N 2 0 248.370 2.473 20 0 BEADRP CCC[C@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)C1CCC1 ZINC000873256539 590011822 /nfs/dbraw/zinc/01/18/22/590011822.db2.gz PECIZHDJZAHPBX-DRZSPHRISA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+][C@@H]2CCCc3sccc32)C1 ZINC000873257052 590011937 /nfs/dbraw/zinc/01/19/37/590011937.db2.gz DQFGGAUPSWKVGU-CKYFFXLPSA-N 2 0 236.384 2.452 20 0 BEADRP C[C@@H]1CCC[C@H](C)[C@H]1[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873257850 590012145 /nfs/dbraw/zinc/01/21/45/590012145.db2.gz VJFLHOHBCCGIHJ-YOTBANQPSA-N 2 0 210.365 2.138 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+]C[C@H]2C[C@H]([NH3+])C2)cc1 ZINC000873258082 590012153 /nfs/dbraw/zinc/01/21/53/590012153.db2.gz MEZOTVJROQFAJS-YRGRVCCFSA-N 2 0 218.344 2.383 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1ccccc1N(C)C ZINC000873257698 590012289 /nfs/dbraw/zinc/01/22/89/590012289.db2.gz USRGGKCXSHGGGY-JHJVBQTASA-N 2 0 247.386 2.141 20 0 BEADRP C[C@@H]1Cc2ccccc2[C@H]1[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873257965 590012316 /nfs/dbraw/zinc/01/23/16/590012316.db2.gz WEYSDJGPSPHSIF-CVMIBZJCSA-N 2 0 230.355 2.247 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1ccccc1N(C)C ZINC000873257696 590012492 /nfs/dbraw/zinc/01/24/92/590012492.db2.gz USRGGKCXSHGGGY-AVGNSLFASA-N 2 0 247.386 2.141 20 0 BEADRP CC[C@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1ccccc1 ZINC000873257719 590012598 /nfs/dbraw/zinc/01/25/98/590012598.db2.gz JMSJBBPUUXMTKH-UBHSHLNASA-N 2 0 218.344 2.465 20 0 BEADRP COc1ccc([C@H](C)[NH2+]C[C@H]2C[C@H]([NH3+])C2)cc1 ZINC000873257505 590012603 /nfs/dbraw/zinc/01/26/03/590012603.db2.gz IMSBOOCXYGCKND-GVXVVHGQSA-N 2 0 234.343 2.083 20 0 BEADRP C[C@H](Cc1ccccc1F)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873258687 590013016 /nfs/dbraw/zinc/01/30/16/590013016.db2.gz VDQJBRRBSLOOJU-NQBHXWOUSA-N 2 0 236.334 2.084 20 0 BEADRP CC(C)[C@@H]1CCC[C@H]1[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873258196 590013150 /nfs/dbraw/zinc/01/31/50/590013150.db2.gz XRBMTWWQDZWWDO-ZDEQEGDKSA-N 2 0 210.365 2.138 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+][C@H]2CCC[C@@H]2CCCF)C1 ZINC000873259020 590013197 /nfs/dbraw/zinc/01/31/97/590013197.db2.gz XNIYCGRFIGVLMD-LPWJVIDDSA-N 2 0 228.355 2.232 20 0 BEADRP CC[C@H]1CC[C@H]1[NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000873262354 590014092 /nfs/dbraw/zinc/01/40/92/590014092.db2.gz XOQJQHRMAUQMFB-PDWCTOEPSA-N 2 0 222.376 2.295 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000873262355 590014569 /nfs/dbraw/zinc/01/45/69/590014569.db2.gz XOQJQHRMAUQMFB-RGDJUOJXSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccccn1 ZINC000873265772 590015135 /nfs/dbraw/zinc/01/51/35/590015135.db2.gz XOIFGIWVOJFFFT-YIYPIFLZSA-N 2 0 245.370 2.263 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+][C@H](C)C1CC[NH2+]CC1 ZINC000873268944 590015370 /nfs/dbraw/zinc/01/53/70/590015370.db2.gz IZBGYNPVXJIYDI-KWCYVHTRSA-N 2 0 224.392 2.399 20 0 BEADRP Cc1ccncc1[C@@H](C)[NH2+][C@H](C)C1CC[NH2+]CC1 ZINC000873268587 590015316 /nfs/dbraw/zinc/01/53/16/590015316.db2.gz XLZUEKXRFBHTIC-CHWSQXEVSA-N 2 0 247.386 2.429 20 0 BEADRP CC[C@H]([NH2+][C@H](C)C1CC[NH2+]CC1)[C@@H]1C[C@@H]1C ZINC000873270637 590016174 /nfs/dbraw/zinc/01/61/74/590016174.db2.gz YRHGFCWHUWIQHL-UNJBNNCHSA-N 2 0 224.392 2.399 20 0 BEADRP COc1ccccc1[C@@H](C)[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000873273589 590016912 /nfs/dbraw/zinc/01/69/12/590016912.db2.gz JATDGUDWOBOXPK-SDDRHHMPSA-N 2 0 236.359 2.472 20 0 BEADRP COCC(C)(C)CC[NH2+][C@@H]1CCCCC[C@@H]1[NH3+] ZINC000873281455 590018861 /nfs/dbraw/zinc/01/88/61/590018861.db2.gz JGBJQJBMCATYAT-QWHCGFSZSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CCC[C@H]1C=CCC1 ZINC000873281672 590019075 /nfs/dbraw/zinc/01/90/75/590019075.db2.gz OLCVDSUGQYOGQC-AVGNSLFASA-N 2 0 210.365 2.448 20 0 BEADRP C[C@H]([NH2+]CCC[C@H]1C=CCC1)[C@H]1CCC[NH2+]1 ZINC000873282564 590019669 /nfs/dbraw/zinc/01/96/69/590019669.db2.gz VCSAGZCZLIQOIG-MELADBBJSA-N 2 0 222.376 2.463 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]CCC[C@@H]1C=CCC1 ZINC000873283111 590019934 /nfs/dbraw/zinc/01/99/34/590019934.db2.gz YOZFEQSICHSCQE-UPJWGTAASA-N 2 0 208.349 2.202 20 0 BEADRP Cc1ccc(OCC[N@H+]2CC[C@H]([NH3+])C[C@@H]2C)cc1 ZINC000124595859 590061210 /nfs/dbraw/zinc/06/12/10/590061210.db2.gz MPGOWJJYQHADGT-KBPBESRZSA-N 2 0 248.370 2.185 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@@H](C)[C@@H]2CCCO2)CC1 ZINC000020205737 590086105 /nfs/dbraw/zinc/08/61/05/590086105.db2.gz DUTVBASHOSXSQJ-JSGCOSHPSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@H](CC(F)(F)F)[NH2+]CC1CC[NH+](C)CC1 ZINC000126388318 590296834 /nfs/dbraw/zinc/29/68/34/590296834.db2.gz RYINUUAHMWRNLL-SECBINFHSA-N 2 0 238.297 2.259 20 0 BEADRP CN(CCC[NH+](C)C)C[C@@H]1CC1(Cl)Cl ZINC000877521794 590345617 /nfs/dbraw/zinc/34/56/17/590345617.db2.gz DZTPNHCWAZQOEM-VIFPVBQESA-N 2 0 239.190 2.064 20 0 BEADRP C[NH+]1CCC2(CC1)CC[NH+](CC1CC1)CC2 ZINC000877683888 590391844 /nfs/dbraw/zinc/39/18/44/590391844.db2.gz ACMUXZKZZUPMKS-UHFFFAOYSA-N 2 0 222.376 2.204 20 0 BEADRP C[NH+](C)C[C@@H]1CC[N@H+](CC2CC3(CCC3)C2)C1 ZINC000878105266 590494723 /nfs/dbraw/zinc/49/47/23/590494723.db2.gz ZANDLTNUOSUUIG-ZDUSSCGKSA-N 2 0 236.403 2.450 20 0 BEADRP C=C/C=C/CC[NH+]1CC[C@]2(CC[N@@H+](C)C2)C1 ZINC000878645264 590600507 /nfs/dbraw/zinc/60/05/07/590600507.db2.gz JEYUVGNBJYNHJE-NNTXTVRGSA-N 2 0 220.360 2.146 20 0 BEADRP C[NH+]1CCC2(CC[N@H+](C/C=C\Cl)C2)CC1 ZINC000878864393 590634309 /nfs/dbraw/zinc/63/43/09/590634309.db2.gz AGIAJJQMNSGTDY-KXFIGUGUSA-N 2 0 228.767 2.157 20 0 BEADRP CC[N@H+](CC(C)C)CC1CC[NH+](C)CC1 ZINC000879702086 590852080 /nfs/dbraw/zinc/85/20/80/590852080.db2.gz FOMBCYUAUJICHX-UHFFFAOYSA-N 2 0 212.381 2.306 20 0 BEADRP C[N@@H+]1CCCC[C@H]1CC[NH+]1CC[C@H](CF)C1 ZINC000880295311 590989652 /nfs/dbraw/zinc/98/96/52/590989652.db2.gz JWBVFNTVTPONEU-OLZOCXBDSA-N 2 0 228.355 2.152 20 0 BEADRP FC[C@@H]1CC[N@H+](CCC[NH+]2CCCCC2)C1 ZINC000880298722 590992745 /nfs/dbraw/zinc/99/27/45/590992745.db2.gz IWVDPYXUEMHTKQ-ZDUSSCGKSA-N 2 0 228.355 2.154 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH+]1CCC(C)([NH+]2CCC2)CC1 ZINC000880476116 591054675 /nfs/dbraw/zinc/05/46/75/591054675.db2.gz NTMHJIDGNQOVOG-CHWSQXEVSA-N 2 0 222.376 2.203 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H]2C[C@@H]3CC[C@@H](C3)C2)C1 ZINC000883162537 591557240 /nfs/dbraw/zinc/55/72/40/591557240.db2.gz WESQCVWEKYBHFA-OYQDBORRSA-N 2 0 236.403 2.495 20 0 BEADRP [NH3+]C[C@@H]1CCC[N@H+](CC[C@H]2CCCC2(F)F)C1 ZINC000883416015 591652863 /nfs/dbraw/zinc/65/28/63/591652863.db2.gz JWNBXQTZFQLHBA-NWDGAFQWSA-N 2 0 246.345 2.483 20 0 BEADRP C[C@H]([NH3+])[C@H]1CC[N@H+](CC[C@@H]2CCCC2(F)F)C1 ZINC000883424101 591658283 /nfs/dbraw/zinc/65/82/83/591658283.db2.gz GBEXPGHCUCBGQQ-SRVKXCTJSA-N 2 0 246.345 2.481 20 0 BEADRP C=C/C=C\CC[NH+]1CCC([C@H]2CC[NH2+]C2)CC1 ZINC000883427770 591659800 /nfs/dbraw/zinc/65/98/00/591659800.db2.gz BQRQXQMKTCIETN-JZIMQPMSSA-N 2 0 234.387 2.440 20 0 BEADRP C=C/C=C/CC[NH+]1CCC2(CC[NH2+]C2)CC1 ZINC000883428384 591659836 /nfs/dbraw/zinc/65/98/36/591659836.db2.gz SDSAFLIHTCJASM-ONEGZZNKSA-N 2 0 220.360 2.194 20 0 BEADRP C=C/C=C/CC[NH+]1CCC([C@@H]2CC[NH2+]C2)CC1 ZINC000883427771 591660551 /nfs/dbraw/zinc/66/05/51/591660551.db2.gz BQRQXQMKTCIETN-NHZBNJEXSA-N 2 0 234.387 2.440 20 0 BEADRP C[N@H+](CC[C@@H]1CCCC1(F)F)CC(C)(C)[NH3+] ZINC000883435008 591664933 /nfs/dbraw/zinc/66/49/33/591664933.db2.gz HSWUIZYAPSHHDL-JTQLQIEISA-N 2 0 234.334 2.481 20 0 BEADRP CC[NH2+]CC1CC[NH+](C/C=C\Cl)CC1 ZINC000216135858 592011901 /nfs/dbraw/zinc/01/19/01/592011901.db2.gz KHPHWYIDYNEORC-UTCJRWHESA-N 2 0 216.756 2.060 20 0 BEADRP CCC1([NH+]2CCC2)CC[NH+](CC2CC2)CC1 ZINC000886712827 592309406 /nfs/dbraw/zinc/30/94/06/592309406.db2.gz NIGRODWNYGXMBE-UHFFFAOYSA-N 2 0 222.376 2.347 20 0 BEADRP CC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000076110127 592314385 /nfs/dbraw/zinc/31/43/85/592314385.db2.gz VUPKIEMVCGGHSY-HNNXBMFYSA-N 2 0 232.371 2.460 20 0 BEADRP C[C@H](CC(F)(F)F)[NH2+]C1CCC([NH3+])CC1 ZINC000220816988 592355411 /nfs/dbraw/zinc/35/54/11/592355411.db2.gz FHRSKVWVXOGYBG-AFPNSQJFSA-N 2 0 224.270 2.187 20 0 BEADRP C(CN1CCC[C@H]2[NH2+]CC[C@@H]21)[C@@H]1C[C@H]1C1CC1 ZINC000886841243 592360620 /nfs/dbraw/zinc/36/06/20/592360620.db2.gz GBRUATQVOPNFJZ-BARDWOONSA-N 2 0 234.387 2.249 20 0 BEADRP [NH3+]CCCCCC[N@@H+]1CC[C@@H]([C@H]2CCCO2)C1 ZINC000886860273 592369228 /nfs/dbraw/zinc/36/92/28/592369228.db2.gz YGXJYBMBYVNFSB-ZIAGYGMSSA-N 2 0 240.391 2.006 20 0 BEADRP C[C@@H]1CN(c2cc[nH+]cc2)CC[N@@H+]1CCC1CC1 ZINC000887132782 592449616 /nfs/dbraw/zinc/44/96/16/592449616.db2.gz MUZLOJAIBWQRBG-CYBMUJFWSA-N 2 0 245.370 2.392 20 0 BEADRP COC(C)(C)CC[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000300067105 592502288 /nfs/dbraw/zinc/50/22/88/592502288.db2.gz QTJUNDPTUFDZHM-STQMWFEESA-N 2 0 240.391 2.018 20 0 BEADRP CC(C)C[C@H](O)C[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000300275499 592505735 /nfs/dbraw/zinc/50/57/35/592505735.db2.gz PDQFXLZQKGGREX-TUKIKUTGSA-N 2 0 248.370 2.128 20 0 BEADRP CS[C@@H]1CC[C@H]([NH2+][C@@H]2CCC[C@H]([NH3+])C2)C1 ZINC000300392905 592509949 /nfs/dbraw/zinc/50/99/49/592509949.db2.gz WBUCLRYCJBAAIB-WHOHXGKFSA-N 2 0 228.405 2.130 20 0 BEADRP CSC1CC[NH+](CCCCCC[NH3+])CC1 ZINC000300841730 592522264 /nfs/dbraw/zinc/52/22/64/592522264.db2.gz MIDHYIOTPSTPKS-UHFFFAOYSA-N 2 0 230.421 2.333 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2)C(C)(C)C ZINC000925703448 634380629 /nfs/dbraw/zinc/38/06/29/634380629.db2.gz VDHWAOURLYALMO-GMTAPVOTSA-N 2 0 210.365 2.281 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[C@H]([NH3+])C12CCC2)C(C)(C)C ZINC000925703450 634382271 /nfs/dbraw/zinc/38/22/71/634382271.db2.gz VDHWAOURLYALMO-OUAUKWLOSA-N 2 0 210.365 2.281 20 0 BEADRP CSCCC[N@@H+]1CCC[C@H](C[NH3+])[C@H](C)C1 ZINC001205984588 984217071 /nfs/dbraw/zinc/21/70/71/984217071.db2.gz SJLDELXFGLMRQL-VXGBXAGGSA-N 2 0 230.421 2.046 20 0 BEADRP CSCCC[N@@H+]1CCC[C@H](C[NH3+])[C@@H](C)C1 ZINC001205984582 984217100 /nfs/dbraw/zinc/21/71/00/984217100.db2.gz SJLDELXFGLMRQL-NWDGAFQWSA-N 2 0 230.421 2.046 20 0 BEADRP CC1(C[NH2+]CCC[NH+]2CCCC2)CCC1 ZINC000232862926 634390266 /nfs/dbraw/zinc/39/02/66/634390266.db2.gz BTCHTZBRAFKLLA-UHFFFAOYSA-N 2 0 210.365 2.252 20 0 BEADRP CSCC1(CC[NH2+][C@@H]2CC[NH2+]C2(C)C)CC1 ZINC000925708867 634402872 /nfs/dbraw/zinc/40/28/72/634402872.db2.gz SWNGLWGLNATYFX-LLVKDONJSA-N 2 0 242.432 2.250 20 0 BEADRP CSCC1(CC[NH2+][C@H]2CC[NH2+]C2(C)C)CC1 ZINC000925708870 634403009 /nfs/dbraw/zinc/40/30/09/634403009.db2.gz SWNGLWGLNATYFX-NSHDSACASA-N 2 0 242.432 2.250 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H](CCC[NH3+])c2ccccc2)CO1 ZINC000925712944 634417071 /nfs/dbraw/zinc/41/70/71/634417071.db2.gz QNBLBWDKLUSHSP-SNPRPXQTSA-N 2 0 248.370 2.234 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+]C[C@@H]1CCCC12CC2 ZINC000925716640 634447901 /nfs/dbraw/zinc/44/79/01/634447901.db2.gz BICNLMBUZYBVRP-RYUDHWBXSA-N 2 0 222.376 2.297 20 0 BEADRP CC(C)(C)CCC[NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2 ZINC000313247867 634458300 /nfs/dbraw/zinc/45/83/00/634458300.db2.gz ABFXLUVWZMQWEE-YHQUGGNUSA-N 2 0 236.403 2.399 20 0 BEADRP CC[C@@H]1C[N@H+](CC[C@H]2CCC[NH2+]C2)CCS1 ZINC000253056077 634468802 /nfs/dbraw/zinc/46/88/02/634468802.db2.gz AOSMSEJPAJJCTA-CHWSQXEVSA-N 2 0 242.432 2.204 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@@H]([NH3+])CC(C)(C)C2)[C@@H](C)O1 ZINC000925726490 634522280 /nfs/dbraw/zinc/52/22/80/634522280.db2.gz SZJVYZKTPOZZNF-VEGXAWMVSA-N 2 0 240.391 2.048 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@H]([NH3+])CC(C)(C)C2)[C@H](C)O1 ZINC000925726488 634523333 /nfs/dbraw/zinc/52/33/33/634523333.db2.gz SZJVYZKTPOZZNF-SJHCENCUSA-N 2 0 240.391 2.048 20 0 BEADRP [NH3+]CC[C@@H]1CC[N@H+](Cc2cc(F)ccc2F)C1 ZINC000125577597 634565548 /nfs/dbraw/zinc/56/55/48/634565548.db2.gz AJZCAGQMIPGRKK-SNVBAGLBSA-N 2 0 240.297 2.136 20 0 BEADRP C[C@@H]([NH2+]CC1(CC2CC2)CC1)[C@@H]1CCC[NH2+]1 ZINC000925732779 634576228 /nfs/dbraw/zinc/57/62/28/634576228.db2.gz CXSIDBXUQAXEGK-YPMHNXCESA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H]([NH2+]CCC(C)(C)[NH3+])c1ccc2c(c1)COC2 ZINC000925740355 634601196 /nfs/dbraw/zinc/60/11/96/634601196.db2.gz JOFAXPWZZCSXGQ-NSHDSACASA-N 2 0 248.370 2.495 20 0 BEADRP CC(C)([NH3+])CC[NH2+][C@@H]1CCC[C@H]2C[C@]21C ZINC000925739357 634597751 /nfs/dbraw/zinc/59/77/51/634597751.db2.gz WHVFPVXAYIIOBU-DMDPSCGWSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H](C[NH2+]C[C@@H]1C[NH2+]C[C@H]1C)C(C)(C)C ZINC000162954960 635239528 /nfs/dbraw/zinc/23/95/28/635239528.db2.gz KMLOBVJFXADPJA-UTUOFQBUSA-N 2 0 212.381 2.114 20 0 BEADRP CCC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1C[NH2+]C[C@H]1C ZINC000925783891 635295113 /nfs/dbraw/zinc/29/51/13/635295113.db2.gz LPLJWZMIXUOPPZ-FVCCEPFGSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1C[C@H]1[C@@H]1C[C@H]1[NH2+][C@@H]1C[C@@H]2CC[C@@H]([NH2+]2)[C@@H]1C ZINC000925822890 635405198 /nfs/dbraw/zinc/40/51/98/635405198.db2.gz LUKMXXYBDBDRPY-UFEULUFESA-N 2 0 234.387 2.150 20 0 BEADRP C[C@@H]1C[C@H]1[C@@H]1C[C@H]1[NH2+][C@H]1CCCC[C@H]1C[NH3+] ZINC000925823011 635406230 /nfs/dbraw/zinc/40/62/30/635406230.db2.gz NNEVJDBMQBXZNT-QTJJRWQNSA-N 2 0 222.376 2.138 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+]C[C@@H]2C[C@H]2C(F)(F)F)C12CCC2 ZINC000925831947 635468818 /nfs/dbraw/zinc/46/88/18/635468818.db2.gz MWHUHSROSQMZQM-QCLAVDOMSA-N 2 0 248.292 2.044 20 0 BEADRP CC(C)[C@H](C)[NH2+]C[C@]12CCC[C@H]1[NH2+]CC2 ZINC000925842949 635509061 /nfs/dbraw/zinc/50/90/61/635509061.db2.gz OSUCSPDPOLQLTP-YNEHKIRRSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[NH2+]C23CCC3)CCS1 ZINC000925857692 635549781 /nfs/dbraw/zinc/54/97/81/635549781.db2.gz HWDBZXXVPOCKLH-IJLUTSLNSA-N 2 0 240.416 2.145 20 0 BEADRP C[C@H]1C[C@H]([NH2+]C2CCC([NH3+])CC2)CCS1 ZINC000925861805 635557324 /nfs/dbraw/zinc/55/73/24/635557324.db2.gz STLQXENCRTXOOJ-WNYYMSAVSA-N 2 0 228.405 2.130 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CCCC[C@@H]2C[NH3+])CCS1 ZINC000925860944 635557544 /nfs/dbraw/zinc/55/75/44/635557544.db2.gz MLFDHHIIDPJSML-LPWJVIDDSA-N 2 0 242.432 2.378 20 0 BEADRP COC[C@H](C[NH2+][C@H]1CCCCC[C@H]1[NH3+])C(C)C ZINC000925874236 635593639 /nfs/dbraw/zinc/59/36/39/635593639.db2.gz QASXSWNSYHKFPE-MJBXVCDLSA-N 2 0 242.407 2.155 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@H+](C)CC1CCCCC1 ZINC000082560652 631406951 /nfs/dbraw/zinc/40/69/51/631406951.db2.gz DPWUULMBKWDITJ-OCCSQVGLSA-N 2 0 224.392 2.354 20 0 BEADRP CCC1CC[NH+](CC2CC[NH+](C)CC2)CC1 ZINC000891748851 631471882 /nfs/dbraw/zinc/47/18/82/631471882.db2.gz SDQUEORJRDJESN-UHFFFAOYSA-N 2 0 224.392 2.450 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+]C[C@@H]1CC1(Cl)Cl ZINC000308695399 631521075 /nfs/dbraw/zinc/52/10/75/631521075.db2.gz STNFAOWEDDQDMB-IUCAKERBSA-N 2 0 239.190 2.110 20 0 BEADRP C[C@@H](C[N@@H+]1CCC[C@H](C[NH3+])C1)C(C)(C)C ZINC000308839013 631677233 /nfs/dbraw/zinc/67/72/33/631677233.db2.gz XUZNTULKTWUHMB-NWDGAFQWSA-N 2 0 212.381 2.339 20 0 BEADRP C[C@H](C[N@@H+]1CCC[C@H](C[NH3+])C1)C(C)(C)C ZINC000308839017 631677446 /nfs/dbraw/zinc/67/74/46/631677446.db2.gz XUZNTULKTWUHMB-VXGBXAGGSA-N 2 0 212.381 2.339 20 0 BEADRP Cc1nc(C)c([C@@H](C)[NH2+]C[C@H]2CC[NH2+]C2)s1 ZINC000062117085 631704177 /nfs/dbraw/zinc/70/41/77/631704177.db2.gz DJHBSPROLIXLDI-KCJUWKMLSA-N 2 0 239.388 2.020 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H](C)Cc1cccnc1 ZINC000934231603 631739390 /nfs/dbraw/zinc/73/93/90/631739390.db2.gz WBDFGJBSQMEEMZ-CQSZACIVSA-N 2 0 249.402 2.334 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+]C1CCC([NH+](C)C)CC1 ZINC000309101283 631883209 /nfs/dbraw/zinc/88/32/09/631883209.db2.gz FVMHNJSRUIPPRE-XVSSEFHLSA-N 2 0 210.365 2.247 20 0 BEADRP C[C@@H]1C[C@H]([NH3+])CC[N@@H+]1CCc1cccs1 ZINC000049712297 631908349 /nfs/dbraw/zinc/90/83/49/631908349.db2.gz DDKJDMUDZFHXEL-GHMZBOCLSA-N 2 0 224.373 2.102 20 0 BEADRP C[C@@H](C[C@@H]1CCC[NH2+]1)[NH2+]CC1(C)CCC1 ZINC000235122570 632008215 /nfs/dbraw/zinc/00/82/15/632008215.db2.gz GWXJCEAINNVAMH-RYUDHWBXSA-N 2 0 210.365 2.297 20 0 BEADRP C[N@H+](CC[C@H]1CCC[NH2+]C1)CC(C)(C)C ZINC000051919606 632013712 /nfs/dbraw/zinc/01/37/12/632013712.db2.gz KOUUQCDTXUPYTD-GFCCVEGCSA-N 2 0 212.381 2.354 20 0 BEADRP Cc1cc(C)cc(C[N@@H+]2CC[C@@H]([NH3+])[C@@H](C)C2)c1 ZINC000227056372 632414449 /nfs/dbraw/zinc/41/44/49/632414449.db2.gz ZMRSGTGXXAFISQ-DZGCQCFKSA-N 2 0 232.371 2.473 20 0 BEADRP CC[C@](C)(O)C[NH2+][C@@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000251281326 632545352 /nfs/dbraw/zinc/54/53/52/632545352.db2.gz OGXKOFLCXXDOJV-MJBXVCDLSA-N 2 0 242.407 2.048 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000252971248 632564925 /nfs/dbraw/zinc/56/49/25/632564925.db2.gz XTFLNGUQWDDFDI-MHWZDGSBSA-N 2 0 216.328 2.377 20 0 BEADRP CCC[C@@H](C)[N@H+](C)C[C@@]1(C)CCC[NH2+]C1 ZINC000219755423 632565466 /nfs/dbraw/zinc/56/54/66/632565466.db2.gz LUXODJLMFNOTAY-OLZOCXBDSA-N 2 0 212.381 2.497 20 0 BEADRP CC(C)[C@H](C)[N@H+](C)C[C@@]1(C)CCC[NH2+]C1 ZINC000219755110 632565587 /nfs/dbraw/zinc/56/55/87/632565587.db2.gz POZKBXFBYCFORJ-STQMWFEESA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H]1C[C@@H]1[NH2+][C@@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1 ZINC000252200063 632592753 /nfs/dbraw/zinc/59/27/53/632592753.db2.gz WCXHMKNOIHJRNU-ITGHMWBKSA-N 2 0 222.376 2.295 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]CCCCCCO)c2ccccc21 ZINC000236306355 632917125 /nfs/dbraw/zinc/91/71/25/632917125.db2.gz NGRDHUCKRKXIIA-CABCVRRESA-N 2 0 248.370 2.274 20 0 BEADRP c1ccc(CCC[N@@H+]2C[C@@H]3CC[NH2+]C[C@@H]3C2)cc1 ZINC000311006160 633050330 /nfs/dbraw/zinc/05/03/30/633050330.db2.gz JFCLQNMOEKXLHJ-JKSUJKDBSA-N 2 0 244.382 2.161 20 0 BEADRP CC(C)[C@H]1CC[N@H+](C[C@@H]2CC[C@H]([NH3+])C2)C1 ZINC000166318347 633109717 /nfs/dbraw/zinc/10/97/17/633109717.db2.gz UBDYEKJHLLLXNO-AGIUHOORSA-N 2 0 210.365 2.092 20 0 BEADRP CCC1CC[NH+](C[C@H]2CC[NH2+][C@@H](C)C2)CC1 ZINC000232899069 636068209 /nfs/dbraw/zinc/06/82/09/636068209.db2.gz QZZQNDADZFUXJA-JSGCOSHPSA-N 2 0 224.392 2.497 20 0 BEADRP CCC1(C[NH2+][C@@H]2CCCC[C@@H]2C[NH3+])CC1 ZINC000233087363 636122170 /nfs/dbraw/zinc/12/21/70/636122170.db2.gz KYKNZZRFLVEDDX-VXGBXAGGSA-N 2 0 210.365 2.284 20 0 BEADRP C[C@H]([NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32)C1CCCC1 ZINC000328549087 633772853 /nfs/dbraw/zinc/77/28/53/633772853.db2.gz QSSOWMZTGZBOHQ-VUJLMQJESA-N 2 0 234.387 2.151 20 0 BEADRP C[C@H]([NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23)C1CCCC1 ZINC000328549082 633774610 /nfs/dbraw/zinc/77/46/10/633774610.db2.gz QSSOWMZTGZBOHQ-BMJAIKTRSA-N 2 0 234.387 2.151 20 0 BEADRP CC(C)[NH2+]C1CC[NH+](CCCCCCO)CC1 ZINC000175427139 633783059 /nfs/dbraw/zinc/78/30/59/633783059.db2.gz KKQALGZRECOQJQ-UHFFFAOYSA-N 2 0 242.407 2.002 20 0 BEADRP CSCC[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000925506855 633840673 /nfs/dbraw/zinc/84/06/73/633840673.db2.gz SWFYXPCHKWZGLG-ZDUSSCGKSA-N 2 0 238.400 2.419 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H](C)COC ZINC000053172202 633876235 /nfs/dbraw/zinc/87/62/35/633876235.db2.gz FTKIIWICHRJONH-STQMWFEESA-N 2 0 230.396 2.121 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2C[C@@H]([NH3+])C23CCC3)cc1F ZINC000925524436 633899528 /nfs/dbraw/zinc/89/95/28/633899528.db2.gz TXNPJLKZVJPPGH-ZIAGYGMSSA-N 2 0 248.345 2.494 20 0 BEADRP CO[C@H](C[NH2+][C@H]1C[C@H]([NH3+])CC(C)(C)C1)C(C)C ZINC000925526380 633909660 /nfs/dbraw/zinc/90/96/60/633909660.db2.gz IGQVDJHGWLAEMQ-RWMBFGLXSA-N 2 0 242.407 2.153 20 0 BEADRP CCC1(C[NH2+][C@H]2CC[NH2+]C2(C)C)CCC1 ZINC000925542865 633965378 /nfs/dbraw/zinc/96/53/78/633965378.db2.gz RACCOFPFPJBFIL-NSHDSACASA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@]1(C[NH2+][C@H]2CC[NH2+]C23CCC3)CCCS1 ZINC000925550820 633996255 /nfs/dbraw/zinc/99/62/55/633996255.db2.gz CPIVJEBWGWFTPR-RYUDHWBXSA-N 2 0 240.416 2.146 20 0 BEADRP C[NH+](C)CC(C)(C)C[NH2+]C1CC2(CCC2)C1 ZINC000309970333 634001435 /nfs/dbraw/zinc/00/14/35/634001435.db2.gz PDOQZTKUZBFBNN-UHFFFAOYSA-N 2 0 224.392 2.497 20 0 BEADRP CC1CC([NH2+][C@H]2CC[NH2+]C23CCCC3)C1 ZINC000925577338 634078257 /nfs/dbraw/zinc/07/82/57/634078257.db2.gz QPELWMVWPBHJCL-MCIGGMRASA-N 2 0 208.349 2.049 20 0 BEADRP CCC1(C[NH2+][C@H]2CC[NH2+]C23CCCC3)CC1 ZINC000925579277 634080680 /nfs/dbraw/zinc/08/06/80/634080680.db2.gz KYBODZYRKBMKON-LBPRGKRZSA-N 2 0 222.376 2.441 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC[NH2+]C12CCCC2)C1CC1 ZINC000925585315 634091836 /nfs/dbraw/zinc/09/18/36/634091836.db2.gz TUALFIQQZBGTIL-ZYHUDNBSSA-N 2 0 208.349 2.049 20 0 BEADRP CCC(O)(CC)C[NH2+][C@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925615581 634159020 /nfs/dbraw/zinc/15/90/20/634159020.db2.gz GHVWAGRLVJTNQT-RYUDHWBXSA-N 2 0 242.407 2.033 20 0 BEADRP C[C@@H]1CC[C@@H](C[NH2+][C@@H]2CC[NH2+]C2(C)C)C1 ZINC000925664290 634235813 /nfs/dbraw/zinc/23/58/13/634235813.db2.gz XVINGDRHRKFTCN-IJLUTSLNSA-N 2 0 210.365 2.153 20 0 BEADRP CC1(C)SC[C@H]1[NH2+][C@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925666862 634239553 /nfs/dbraw/zinc/23/95/53/634239553.db2.gz OKOCBEQWMGOCJI-OUAUKWLOSA-N 2 0 242.432 2.376 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+]CC1CC(F)(F)C1 ZINC000925672952 634258833 /nfs/dbraw/zinc/25/88/33/634258833.db2.gz KZYLESFDEMFCMM-ZYANWLCNSA-N 2 0 244.329 2.137 20 0 BEADRP C[C@@H]([NH2+][C@H]1C[C@@H]([NH3+])CC(C)(C)C1)C1CC1 ZINC000925679433 634275818 /nfs/dbraw/zinc/27/58/18/634275818.db2.gz CGQORXPWNNTIAZ-JLLWLGSASA-N 2 0 210.365 2.281 20 0 BEADRP CCC[C@H](C[NH2+][C@@H]1C[C@@H]([NH3+])CC(C)(C)C1)OC ZINC000925680239 634278601 /nfs/dbraw/zinc/27/86/01/634278601.db2.gz NPBBVTYPMLBCJM-JHJVBQTASA-N 2 0 242.407 2.297 20 0 BEADRP Cc1cc(C[NH2+][C@@H]2C[C@H]([NH3+])CC(C)(C)C2)ccn1 ZINC000925680746 634278818 /nfs/dbraw/zinc/27/88/18/634278818.db2.gz TVQFBMOWCWZVIA-UONOGXRCSA-N 2 0 247.386 2.386 20 0 BEADRP C[C@@H]1[C@H]2CC[C@@H](C[C@H]1[NH2+][C@@H]1CCCC[C@H]1F)[NH2+]2 ZINC000925687671 634304187 /nfs/dbraw/zinc/30/41/87/634304187.db2.gz BJQKLKFLGOSPGD-KLVXDSBYSA-N 2 0 240.366 2.386 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+][C@@H]2CCCC[C@H]2F)C12CCC2 ZINC000925692836 634323102 /nfs/dbraw/zinc/32/31/02/634323102.db2.gz RJQSTMYYKJTBPJ-DDHJBXDOSA-N 2 0 226.339 2.127 20 0 BEADRP c1ccc2c(c1)OCC[C@H]2[NH2+]CC1CC[NH2+]CC1 ZINC000094009986 635162585 /nfs/dbraw/zinc/16/25/85/635162585.db2.gz XAIDCJPUJZVLOE-CQSZACIVSA-N 2 0 246.354 2.099 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+][C@H]1CCCC(C)(C)C1 ZINC000925782572 635278925 /nfs/dbraw/zinc/27/89/25/635278925.db2.gz LFUJWJYVAUJIEK-GRYCIOLGSA-N 2 0 210.365 2.153 20 0 BEADRP CCC[C@H]1CCC[C@H]1[NH2+][C@@H]1C[NH2+]C[C@H]1C ZINC000925783894 635297602 /nfs/dbraw/zinc/29/76/02/635297602.db2.gz LPLJWZMIXUOPPZ-YVECIDJPSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1Cc2ccccc2[C@@H]1[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000925790324 635315958 /nfs/dbraw/zinc/31/59/58/635315958.db2.gz GZEZJDSULBHEIV-UNIGVISCSA-N 2 0 244.382 2.365 20 0 BEADRP C[C@@H]([NH2+]C1CCC([NH3+])CC1)C1CCCC1 ZINC000054081559 635346830 /nfs/dbraw/zinc/34/68/30/635346830.db2.gz RWLRZIIUOFIXNE-QFWMXSHPSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+]CC[C@@H]1C[C@H]1C1CC1 ZINC000925802741 635351234 /nfs/dbraw/zinc/35/12/34/635351234.db2.gz QMMDQUGHGQGTQR-PMOUVXMZSA-N 2 0 236.403 2.400 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CC[C@@H]1C[C@H]1C1CC1 ZINC000925803519 635352160 /nfs/dbraw/zinc/35/21/60/635352160.db2.gz ZKBWVPGRPFFGIF-DNIRFERGSA-N 2 0 210.365 2.138 20 0 BEADRP CC[C@H]([NH2+]C[C@H](COC)C(C)C)[C@@H]1CCC[NH2+]1 ZINC000925874940 635594956 /nfs/dbraw/zinc/59/49/56/635594956.db2.gz XPNMCEPOFMBRRC-RDBSUJKOSA-N 2 0 242.407 2.025 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH2+][C@H]2C[C@H]3C=C[C@@H]2CC3)C1 ZINC000925012918 635848223 /nfs/dbraw/zinc/84/82/23/635848223.db2.gz XSIKXARIZMZJKI-XQLPTFJDSA-N 2 0 234.387 2.273 20 0 BEADRP CCC[C@H](CC)[NH2+]CC1CC[NH+](C)CC1 ZINC000054243868 636245168 /nfs/dbraw/zinc/24/51/68/636245168.db2.gz HBELONFWSNSXGH-ZDUSSCGKSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@H]1CCC[C@@H](C[N@@H+]2C[C@@H]3CC[NH2+]C[C@@H]3C2)C1 ZINC000928997893 636699029 /nfs/dbraw/zinc/69/90/29/636699029.db2.gz PBRSWLKYCIBWOR-LJISPDSOSA-N 2 0 236.403 2.354 20 0 BEADRP C[C@H]1C[C@@H]1C[NH+]1CCC([NH2+]C2CCC2)CC1 ZINC000897981649 636853984 /nfs/dbraw/zinc/85/39/84/636853984.db2.gz PPSNEHPVCQFYRW-NWDGAFQWSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@@H](C[NH2+][C@@H](C)CCc1cccnc1)C[NH+](C)C ZINC000866364810 636880978 /nfs/dbraw/zinc/88/09/78/636880978.db2.gz QBZNNUXKIWUGEW-KBPBESRZSA-N 2 0 249.402 2.190 20 0 BEADRP CC1([NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)CC(F)(F)C1 ZINC000873197962 636980274 /nfs/dbraw/zinc/98/02/74/636980274.db2.gz WXFHROSEPOFNTE-QWRGUYRKSA-N 2 0 244.329 2.391 20 0 BEADRP CCC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C1CC1 ZINC000054603341 637034839 /nfs/dbraw/zinc/03/48/39/637034839.db2.gz VWBXNRFXNKDSSY-VGPLMAKISA-N 2 0 208.349 2.144 20 0 BEADRP CCCCC[C@@H](C)[NH2+]C[C@@H](O)C[NH+]1CCCC1 ZINC000042238389 637090477 /nfs/dbraw/zinc/09/04/77/637090477.db2.gz XDDMXMRMFTYOEK-ZIAGYGMSSA-N 2 0 242.407 2.002 20 0 BEADRP CO[C@@H]1CCC[C@@H]1[NH2+]CCCC[N@H+](C)C1CC1 ZINC000903182505 637351438 /nfs/dbraw/zinc/35/14/38/637351438.db2.gz CGVNWPIEHWFXFC-UONOGXRCSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH+]1C[C@@H](C)C(F)(F)[C@H](C)C1 ZINC000903464819 637362278 /nfs/dbraw/zinc/36/22/78/637362278.db2.gz XYGKRIADMQHBKQ-KKOKHZNYSA-N 2 0 246.345 2.065 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH+]1C[C@H](C)C(F)(F)[C@@H](C)C1 ZINC000903464820 637363316 /nfs/dbraw/zinc/36/33/16/637363316.db2.gz XYGKRIADMQHBKQ-RHYQMDGZSA-N 2 0 246.345 2.065 20 0 BEADRP CC(C)[N@H+](C[C@H]1CCCC[NH2+]C1)C1CC1 ZINC000903721636 637379203 /nfs/dbraw/zinc/37/92/03/637379203.db2.gz CCDXPMPYJCPJQJ-LBPRGKRZSA-N 2 0 210.365 2.249 20 0 BEADRP FCc1ccccc1C[N@@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1 ZINC000903788401 637382351 /nfs/dbraw/zinc/38/23/51/637382351.db2.gz KHHPIMPDIGQKNZ-LSDHHAIUSA-N 2 0 248.345 2.197 20 0 BEADRP Cc1cc(C)nc(C[N@@H+]2CC[C@H](C[NH3+])[C@H](C)C2)c1 ZINC000903789401 637384432 /nfs/dbraw/zinc/38/44/32/637384432.db2.gz WLZFPKSMIOVVJU-TZMCWYRMSA-N 2 0 247.386 2.115 20 0 BEADRP C(C[N@@H+]1CCC[C@]12CC[NH2+]C2)C1CCCC1 ZINC000903866641 637386529 /nfs/dbraw/zinc/38/65/29/637386529.db2.gz WEABICYEYWRBDF-CQSZACIVSA-N 2 0 222.376 2.395 20 0 BEADRP C[C@]1(C[N@@H+]2C[C@@H]3[C@@H]4C=C[C@@H](C4)[C@]3(C)C2)CC[NH2+]C1 ZINC000904462126 637407054 /nfs/dbraw/zinc/40/70/54/637407054.db2.gz HRQRHIZTARKJOH-LEOABGAYSA-N 2 0 246.398 2.130 20 0 BEADRP C[C@@]1(C[N@@H+]2C[C@@H]3[C@@H]4C=C[C@@H](C4)[C@]3(C)C2)CC[NH2+]C1 ZINC000904462125 637407415 /nfs/dbraw/zinc/40/74/15/637407415.db2.gz HRQRHIZTARKJOH-JKJDWNRSSA-N 2 0 246.398 2.130 20 0 BEADRP C[C@@H](C[NH2+]CC1([NH3+])CC1)c1ccc(F)cc1 ZINC000904441974 637410913 /nfs/dbraw/zinc/41/09/13/637410913.db2.gz BMNPJBBIJRSLPF-JTQLQIEISA-N 2 0 222.307 2.010 20 0 BEADRP CC1(C)CCC[C@@H](C[NH2+]CC2([NH3+])CC2)C1 ZINC000904448557 637413529 /nfs/dbraw/zinc/41/35/29/637413529.db2.gz BEPZFKLVZDLJEJ-LLVKDONJSA-N 2 0 210.365 2.284 20 0 BEADRP CC(C)([NH3+])c1ccc(N[C@H]2CCC[NH2+]CC2)cc1 ZINC000904476267 637425761 /nfs/dbraw/zinc/42/57/61/637425761.db2.gz PDMWZZXBFXNVBB-ZDUSSCGKSA-N 2 0 247.386 2.434 20 0 BEADRP CSCC(C)(C)[NH2+]C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000904476332 637426347 /nfs/dbraw/zinc/42/63/47/637426347.db2.gz QMNWYZYCCXGCAF-GHMZBOCLSA-N 2 0 230.421 2.106 20 0 BEADRP CC(C)C[C@H]([NH3+])C[N@@H+]1C[C@@H]2CSC[C@]2(C)C1 ZINC000904476768 637427354 /nfs/dbraw/zinc/42/73/54/637427354.db2.gz RCOJWBJLDCQWQF-AGIUHOORSA-N 2 0 242.432 2.045 20 0 BEADRP CCCOc1ccc(C[NH2+]C2CC([NH3+])C2)cc1 ZINC000906508325 638179051 /nfs/dbraw/zinc/17/90/51/638179051.db2.gz NAJQQQYTQFWFGY-UHFFFAOYSA-N 2 0 234.343 2.055 20 0 BEADRP CC[C@@H](C[NH2+]C1CC([NH3+])C1)c1ccccc1 ZINC000906509206 638180817 /nfs/dbraw/zinc/18/08/17/638180817.db2.gz AKNRPROZUPCGMU-XGNXJENSSA-N 2 0 218.344 2.260 20 0 BEADRP C[C@@H](C[NH2+]C1CC([NH3+])C1)c1ccc(F)cc1 ZINC000906510561 638183410 /nfs/dbraw/zinc/18/34/10/638183410.db2.gz LSTSCBWGSXOMJP-ALXWSUNGSA-N 2 0 222.307 2.009 20 0 BEADRP Cc1cc(C)c(C[NH2+]C2CC([NH3+])C2)c(C)c1 ZINC000906511205 638184034 /nfs/dbraw/zinc/18/40/34/638184034.db2.gz YJQVSIYWCCLBDZ-UHFFFAOYSA-N 2 0 218.344 2.191 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]Cc2ccccc2C2CC2)C1 ZINC000906516325 638186054 /nfs/dbraw/zinc/18/60/54/638186054.db2.gz DBHPFHJVCZEWIO-JOCQHMNTSA-N 2 0 216.328 2.143 20 0 BEADRP CC[C@@H]1CCC[C@@H](C[NH2+][C@H]2C[C@H]([NH3+])C2)C1 ZINC000906517739 638188237 /nfs/dbraw/zinc/18/82/37/638188237.db2.gz OKGWCNLKCSITTF-FDYHWXHSSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]Cc2ccc(OCC3CC3)cc2)C1 ZINC000906519358 638190202 /nfs/dbraw/zinc/19/02/02/638190202.db2.gz ZPMLNHQQYDWGJS-HDJSIYSDSA-N 2 0 246.354 2.055 20 0 BEADRP CCCC[NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1 ZINC000906530041 638190316 /nfs/dbraw/zinc/19/03/16/638190316.db2.gz WHCYDAAHMIRTGD-CYBMUJFWSA-N 2 0 212.381 2.497 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]CC[C@@H]2C[C@H]2C2CC2)C1 ZINC000712747518 711450022 /nfs/dbraw/zinc/45/00/22/711450022.db2.gz CUDMOCQYPABHJG-RQJABVFESA-N 2 0 222.376 2.282 20 0 BEADRP CN1C[C@]2(C)C[N@@H+](C3CCCC3)C[C@]2(C)C1 ZINC000931310864 640145243 /nfs/dbraw/zinc/14/52/43/640145243.db2.gz IZNOKIMVGXBBAZ-OKILXGFUSA-N 2 0 222.376 2.203 20 0 BEADRP C[N@@H+]1CC[C@@H]2C[NH+](Cc3ccccc3F)C[C@@H]2C1 ZINC000931429383 640198266 /nfs/dbraw/zinc/19/82/66/640198266.db2.gz GOHUOTLZGFDEDF-OCCSQVGLSA-N 2 0 248.345 2.209 20 0 BEADRP C=C/C=C\CC[NH+]1C[C@H]2CC[N@@H+](C)C[C@H]2C1 ZINC000931442382 640206545 /nfs/dbraw/zinc/20/65/45/640206545.db2.gz FULNQUZHYMNXIA-VSVUCHCSSA-N 2 0 220.360 2.002 20 0 BEADRP C[N@@H+]1CC[C@@H]2C[NH+](CC3CC(C)(C)C3)C[C@@H]2C1 ZINC000931441743 640208074 /nfs/dbraw/zinc/20/80/74/640208074.db2.gz OIEVUWCIMHGXIG-KGLIPLIRSA-N 2 0 236.403 2.306 20 0 BEADRP CC1CC(CN2CC[C@@H]3[C@@H](CC[N@@H+]3C)C2)C1 ZINC000931547307 640266402 /nfs/dbraw/zinc/26/64/02/640266402.db2.gz QJTAXPCAYGHPFY-CLRIEMFWSA-N 2 0 222.376 2.059 20 0 BEADRP C[N@@H+]1CC[C@@H]2CN(CCCC(C)(F)F)CC[C@H]21 ZINC000931545663 640267663 /nfs/dbraw/zinc/26/76/63/640267663.db2.gz GGMKZMFRSWBUER-VXGBXAGGSA-N 2 0 246.345 2.448 20 0 BEADRP CC[C@H](C[C@](C)(O)CC)[NH2+][C@H](C)CC[NH+](C)C ZINC000924855143 640326295 /nfs/dbraw/zinc/32/62/95/640326295.db2.gz VNGIOBLONKAOJO-MGPQQGTHSA-N 2 0 244.423 2.246 20 0 BEADRP C[C@H](C1CC1)[N@@H+]1CCN(c2cc[nH+]cc2)C[C@H]1C ZINC000931764332 640357914 /nfs/dbraw/zinc/35/79/14/640357914.db2.gz PTIKMRHNJDXJOM-CHWSQXEVSA-N 2 0 245.370 2.391 20 0 BEADRP CC(C)C[C@@H](C)[NH2+]CC1CC[NH+](C)CC1 ZINC000044515583 640398061 /nfs/dbraw/zinc/39/80/61/640398061.db2.gz MTKHAYHBEZVXGG-GFCCVEGCSA-N 2 0 212.381 2.352 20 0 BEADRP C([C@H]1CCC[NH2+]1)[N@@H+]1CCC[C@@H]2CCCC[C@@H]21 ZINC000223675051 640585470 /nfs/dbraw/zinc/58/54/70/640585470.db2.gz RYYKXPYZNYPFLF-MJBXVCDLSA-N 2 0 222.376 2.393 20 0 BEADRP CC(C)C1CC[NH+](C[C@@H]2CCC[NH2+]C2)CC1 ZINC000226438962 640765717 /nfs/dbraw/zinc/76/57/17/640765717.db2.gz UAYCEHYBEIMXMZ-CYBMUJFWSA-N 2 0 224.392 2.354 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+][C@@H]1CCc2ccccc21 ZINC000227134946 640817190 /nfs/dbraw/zinc/81/71/90/640817190.db2.gz MAZDANFVIUBXLZ-NWANDNLSSA-N 2 0 230.355 2.391 20 0 BEADRP CSCC[C@@H](C)[NH2+]CC1CC[NH+](C)CC1 ZINC000228879402 640902851 /nfs/dbraw/zinc/90/28/51/640902851.db2.gz KTUGRTYCGZPECR-LLVKDONJSA-N 2 0 230.421 2.059 20 0 BEADRP CC(C)[C@@H]1CC[N@H+](C[C@@]2(C)CCC[NH2+]C2)C1 ZINC000228738435 640892912 /nfs/dbraw/zinc/89/29/12/640892912.db2.gz UHPWXOGUEXGRPN-KGLIPLIRSA-N 2 0 224.392 2.354 20 0 BEADRP CO[C@@H]1CCC[N@H+](CCCCCCC[NH3+])C1 ZINC000230314575 641045543 /nfs/dbraw/zinc/04/55/43/641045543.db2.gz JXEDVBUZGSBUSM-CYBMUJFWSA-N 2 0 228.380 2.006 20 0 BEADRP CC1(C)CC[NH+](C[C@]2(C)CCC[NH2+]C2)CC1 ZINC000062868016 641103867 /nfs/dbraw/zinc/10/38/67/641103867.db2.gz HJSONDIXWQOZLQ-CQSZACIVSA-N 2 0 224.392 2.498 20 0 BEADRP CC1([NH3+])CC[NH+](CCc2cccc(F)c2)CC1 ZINC000071547363 641151186 /nfs/dbraw/zinc/15/11/86/641151186.db2.gz UQHPOMZLUFWINU-UHFFFAOYSA-N 2 0 236.334 2.181 20 0 BEADRP CC[N@H+](C)C[C@H]1CC[NH+](C[Si](C)(C)C)C1 ZINC000173913420 641216473 /nfs/dbraw/zinc/21/64/73/641216473.db2.gz QYJWEFUKYRNNLM-GFCCVEGCSA-N 2 0 228.456 2.137 20 0 BEADRP C[C@@H]1CC[C@H](C[N@H+](C)C2(C[NH3+])CCCCC2)O1 ZINC000231997414 641225533 /nfs/dbraw/zinc/22/55/33/641225533.db2.gz FZLKOUQJCFDYAO-CHWSQXEVSA-N 2 0 240.391 2.147 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@H]1C[NH3+])c1ccccc1 ZINC000088161946 641319312 /nfs/dbraw/zinc/31/93/12/641319312.db2.gz RQALVUIAUHFWBW-FPMFFAJLSA-N 2 0 218.344 2.465 20 0 BEADRP Cc1cccc(OCC[NH2+][C@@H]2CCC[C@@H]2C[NH3+])c1 ZINC000089150415 641477133 /nfs/dbraw/zinc/47/71/33/641477133.db2.gz QWXINCUIBFGYNY-UKRRQHHQSA-N 2 0 248.370 2.091 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@@H]1C[NH3+])c1cccc(O)c1 ZINC000089149718 641477236 /nfs/dbraw/zinc/47/72/36/641477236.db2.gz REHLVQKFVNCCTM-SUHUHFCYSA-N 2 0 234.343 2.170 20 0 BEADRP CC(C)[C@@H](C)[NH2+]Cc1ccc(CC[NH3+])cc1 ZINC000318998299 641601277 /nfs/dbraw/zinc/60/12/77/641601277.db2.gz MGUIJOFHPQMBDG-GFCCVEGCSA-N 2 0 220.360 2.322 20 0 BEADRP CC1CC(C[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C)C2)C1 ZINC000929847635 641763479 /nfs/dbraw/zinc/76/34/79/641763479.db2.gz MPNVKGIDIYDWBA-WUCCLRPBSA-N 2 0 236.403 2.449 20 0 BEADRP CC(C)CC[N@H+](C)CC1CC[NH+](C)CC1 ZINC000154779372 642246247 /nfs/dbraw/zinc/24/62/47/642246247.db2.gz RZUTVTSNWZFGGH-UHFFFAOYSA-N 2 0 212.381 2.306 20 0 BEADRP C[C@@H]1CC[N@H+](CC2CCCCC2)C[C@H]1C[NH3+] ZINC000253237395 642633339 /nfs/dbraw/zinc/63/33/39/642633339.db2.gz OWAHAIVCQBLUKP-TZMCWYRMSA-N 2 0 224.392 2.483 20 0 BEADRP CCC1(C[NH2+]C2CC[NH2+]CC2)CCCC1 ZINC000232993405 642641848 /nfs/dbraw/zinc/64/18/48/642641848.db2.gz OSMFYHYOYDHXCQ-UHFFFAOYSA-N 2 0 210.365 2.298 20 0 BEADRP CCC1(C[NH2+][C@H]2CCCC[C@@H]2C[NH3+])CC1 ZINC000233096319 642648364 /nfs/dbraw/zinc/64/83/64/642648364.db2.gz KYKNZZRFLVEDDX-NEPJUHHUSA-N 2 0 210.365 2.284 20 0 BEADRP CCO[C@H]1C[C@@H]([NH2+]CCCCCC[NH3+])C1(C)C ZINC000233778455 642694038 /nfs/dbraw/zinc/69/40/38/642694038.db2.gz QDEIVPQSCDUSQK-OLZOCXBDSA-N 2 0 242.407 2.299 20 0 BEADRP CC[C@@H]1CC[C@H](C)[N@@H+]1C[C@@H]1C[NH2+]C[C@H]1C ZINC000233920972 642707372 /nfs/dbraw/zinc/70/73/72/642707372.db2.gz ZQPDWNWZPNJULC-MROQNXINSA-N 2 0 210.365 2.105 20 0 BEADRP CC[C@@H]1CCCCC[N@@H+]1C[C@@H]1C[NH2+]C[C@H]1C ZINC000233912436 642710795 /nfs/dbraw/zinc/71/07/95/642710795.db2.gz SDGHLUSWAUZFMA-HZSPNIEDSA-N 2 0 224.392 2.497 20 0 BEADRP CC1(C)CCC[N@H+](CCC[NH2+]C2CC2)C1 ZINC000069793203 642912925 /nfs/dbraw/zinc/91/29/25/642912925.db2.gz KXOYTAMTMHDXSL-UHFFFAOYSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@@H]1C[C@@H](C[N@H+]2C[C@@H]3CC=CC[C@@H]3C2)CC[NH2+]1 ZINC000310339634 643113522 /nfs/dbraw/zinc/11/35/22/643113522.db2.gz NRXAQMBWCAOXTI-BARDWOONSA-N 2 0 234.387 2.273 20 0 BEADRP C[N@@H+]1CCC[C@@H]2CN(C/C=C\Cl)CC[C@@H]21 ZINC000255048102 643282887 /nfs/dbraw/zinc/28/28/87/643282887.db2.gz XRNXTWPJMRBORC-FVLQNALFSA-N 2 0 228.767 2.155 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@H+](C)C1CCCCC1 ZINC000082560294 643343207 /nfs/dbraw/zinc/34/32/07/643343207.db2.gz GJMYGWJLTGAQSS-NEPJUHHUSA-N 2 0 210.365 2.106 20 0 BEADRP CCc1ccc(C[NH2+][C@@H]2CCC[C@@H]2C[NH3+])cc1 ZINC000234144479 643519263 /nfs/dbraw/zinc/51/92/63/643519263.db2.gz YNCBUWBCNGHUSR-HUUCEWRRSA-N 2 0 232.371 2.466 20 0 BEADRP C[C@@H]1[C@@H](C)CCC[N@@H+]1C[C@@H]1CC[C@H]([NH3+])C1 ZINC000085015636 643523919 /nfs/dbraw/zinc/52/39/19/643523919.db2.gz JDPFGPJVSKQTER-LOWDOPEQSA-N 2 0 210.365 2.234 20 0 BEADRP CC1([NH3+])CC[NH+](CCc2cccs2)CC1 ZINC000071531844 643548602 /nfs/dbraw/zinc/54/86/02/643548602.db2.gz NEGNGGJKWXSMBS-UHFFFAOYSA-N 2 0 224.373 2.104 20 0 BEADRP CCc1ccc(C[NH2+]C[C@H]2CCC[NH2+]C2)cc1 ZINC000234190411 643573681 /nfs/dbraw/zinc/57/36/81/643573681.db2.gz VYGWJEBMKICUCT-HNNXBMFYSA-N 2 0 232.371 2.338 20 0 BEADRP Cc1cccc(CNC2C[C@H]3CC[C@@H](C2)[N@H+]3C)n1 ZINC000051573710 643638980 /nfs/dbraw/zinc/63/89/80/643638980.db2.gz JYKPVYPOYCSIJZ-GOOCMWNKSA-N 2 0 245.370 2.105 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CCC[C@@H]2C[NH3+])s1 ZINC000084221296 643651171 /nfs/dbraw/zinc/65/11/71/643651171.db2.gz VUWIWYGLJFUFEV-ZYHUDNBSSA-N 2 0 224.373 2.274 20 0 BEADRP CC(C)C[C@@H]1CC[N@H+](CCC[NH2+]C2CC2)C1 ZINC000307814703 643668829 /nfs/dbraw/zinc/66/88/29/643668829.db2.gz LFTODWSNWCWBTB-ZDUSSCGKSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1ncsc1C[N@H+](C)C[C@@H]1CC[C@H]([NH3+])C1 ZINC000085016018 643678959 /nfs/dbraw/zinc/67/89/59/643678959.db2.gz NBRTXBPIFVXUQY-MNOVXSKESA-N 2 0 239.388 2.011 20 0 BEADRP C[C@@H]1C[C@@H](C)C[NH+](C[C@@H]2CC[C@H]([NH3+])C2)C1 ZINC000085014382 643681175 /nfs/dbraw/zinc/68/11/75/643681175.db2.gz WYDDCNDIOALUIC-LPWJVIDDSA-N 2 0 210.365 2.092 20 0 BEADRP CCC(CC)(CC)[NH2+]C[C@@H](O)C[NH+]1CCCC1 ZINC000086642765 644158241 /nfs/dbraw/zinc/15/82/41/644158241.db2.gz XOCYLFATRCCOPX-CYBMUJFWSA-N 2 0 242.407 2.002 20 0 BEADRP FC(F)(F)[C@H]1CCC[C@@H]([NH2+][C@@H]2CC[NH2+]C2)C1 ZINC000086727881 644167112 /nfs/dbraw/zinc/16/71/12/644167112.db2.gz SJVXEZYSOZHYDR-IVZWLZJFSA-N 2 0 236.281 2.059 20 0 BEADRP CN1CCC([NH2+]CC2CCC=CCC2)CC1 ZINC000922966777 644202400 /nfs/dbraw/zinc/20/24/00/644202400.db2.gz XTLZSTHZIIVDRK-UHFFFAOYSA-N 2 0 222.376 2.417 20 0 BEADRP C([NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)[C@]12C[C@H]1CCC2 ZINC000922962953 644203731 /nfs/dbraw/zinc/20/37/31/644203731.db2.gz OLRPGPXNYVXLTG-KBXIAJHMSA-N 2 0 234.387 2.393 20 0 BEADRP CC(C)=CC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000193351295 644235826 /nfs/dbraw/zinc/23/58/26/644235826.db2.gz AYDWFYNABGXWSB-YHWZYXNKSA-N 2 0 208.349 2.167 20 0 BEADRP C[C@H]1C[N@H+](CC2CCC3(CC3)CC2)C[C@@H]1C[NH3+] ZINC000923412716 644413139 /nfs/dbraw/zinc/41/31/39/644413139.db2.gz TUQLSRRWOHRZEL-JSGCOSHPSA-N 2 0 236.403 2.483 20 0 BEADRP C[C@@H]1C[N@H+](CC2CCC3(CC3)CC2)C[C@H]1C[NH3+] ZINC000923412718 644414216 /nfs/dbraw/zinc/41/42/16/644414216.db2.gz TUQLSRRWOHRZEL-TZMCWYRMSA-N 2 0 236.403 2.483 20 0 BEADRP C[C@@H]1C[N@H+](CC2CCC3(CC3)CC2)C[C@@H]1C[NH3+] ZINC000923412717 644414737 /nfs/dbraw/zinc/41/47/37/644414737.db2.gz TUQLSRRWOHRZEL-OCCSQVGLSA-N 2 0 236.403 2.483 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@@H]2CC=CCC2)CC1 ZINC000084066710 644417642 /nfs/dbraw/zinc/41/76/42/644417642.db2.gz OGKMVZCJECFCIF-CYBMUJFWSA-N 2 0 208.349 2.027 20 0 BEADRP CCc1ncc(C[N@H+](C)CCCCCC[NH3+])o1 ZINC000923426131 644418584 /nfs/dbraw/zinc/41/85/84/644418584.db2.gz NFNCFFHPZDJRRG-UHFFFAOYSA-N 2 0 239.363 2.188 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]CCC1CCCC1 ZINC000084219991 644421459 /nfs/dbraw/zinc/42/14/59/644421459.db2.gz SXANWZHUBKQYQH-STQMWFEESA-N 2 0 210.365 2.284 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]CC1CCCC1 ZINC000084215936 644421554 /nfs/dbraw/zinc/42/15/54/644421554.db2.gz CPAVKGZWKZYTTC-QWHCGFSZSA-N 2 0 210.365 2.284 20 0 BEADRP C(CC1CC1)[NH2+][C@@H]1CC[NH2+]C12CCCC2 ZINC000923428697 644421661 /nfs/dbraw/zinc/42/16/61/644421661.db2.gz QJXMGNPQQFFSIE-GFCCVEGCSA-N 2 0 208.349 2.051 20 0 BEADRP CCCCCC[C@H](O)C[NH2+][C@H]1C[C@H]([NH3+])C1(C)C ZINC000923420262 644425627 /nfs/dbraw/zinc/42/56/27/644425627.db2.gz HFLSFXKHIWXGLI-AVGNSLFASA-N 2 0 242.407 2.033 20 0 BEADRP CC(C)[C@@H]1CCC[N@@H+]1C[C@@H]1CC[C@H]([NH3+])C1 ZINC000085016295 644436472 /nfs/dbraw/zinc/43/64/72/644436472.db2.gz MMDWAOAFCKDENK-AGIUHOORSA-N 2 0 210.365 2.234 20 0 BEADRP C[C@H]1C[N@H+](CC[C@@H]2C[C@H]2C2CC2)CC[C@@H]1C[NH3+] ZINC000923491932 644466937 /nfs/dbraw/zinc/46/69/37/644466937.db2.gz KUSZMMWIBSJDPJ-MYPMTAMASA-N 2 0 236.403 2.339 20 0 BEADRP C[C@H]1C[N@H+](CC[C@@H]2C[C@H]2C2CC2)CC[C@H]1C[NH3+] ZINC000923491931 644467568 /nfs/dbraw/zinc/46/75/68/644467568.db2.gz KUSZMMWIBSJDPJ-ATGSNQNLSA-N 2 0 236.403 2.339 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@H](C[NH3+])[C@H](C)C2)c(C)n1 ZINC000923494913 644469424 /nfs/dbraw/zinc/46/94/24/644469424.db2.gz QMGWSQYMFXMAAQ-BXUZGUMPSA-N 2 0 247.386 2.115 20 0 BEADRP CC[C@@H]([NH2+][C@@H]1CC[NH2+]C1)C1CCCCC1 ZINC000086729800 644471672 /nfs/dbraw/zinc/47/16/72/644471672.db2.gz OYFNLPWBFHJAMN-CHWSQXEVSA-N 2 0 210.365 2.297 20 0 BEADRP CCC[NH+]1CCC([C@@H]2CCC[NH2+]CC2)CC1 ZINC000923505917 644474707 /nfs/dbraw/zinc/47/47/07/644474707.db2.gz DKGRNZWYVZPTLV-CYBMUJFWSA-N 2 0 224.392 2.498 20 0 BEADRP Cc1ccc(C[N@@H+]2C[C@@H]3CC[NH2+]C[C@@H]3C2)cc1C ZINC000923516429 644480036 /nfs/dbraw/zinc/48/00/36/644480036.db2.gz DVXVRLHLQJMKKY-JKSUJKDBSA-N 2 0 244.382 2.345 20 0 BEADRP C[C@H]1CCCC[C@@H]1C[N@@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1 ZINC000923518953 644483068 /nfs/dbraw/zinc/48/30/68/644483068.db2.gz HIWPOJOMFQZTPR-LJISPDSOSA-N 2 0 236.403 2.354 20 0 BEADRP Cc1ccc(C[N@@H+]2C[C@@H]3CC[NH2+]C[C@@H]3C2)cc1 ZINC000923520627 644484069 /nfs/dbraw/zinc/48/40/69/644484069.db2.gz GSMFCPABUABPFU-LSDHHAIUSA-N 2 0 230.355 2.036 20 0 BEADRP C([C@@H]1CC[NH2+]C1)[N@@H+]1C[C@H](C2CC2)C[C@@H]1C1CC1 ZINC000923526417 644485556 /nfs/dbraw/zinc/48/55/56/644485556.db2.gz PYKZSJZYTJHUEQ-KCPJHIHWSA-N 2 0 234.387 2.106 20 0 BEADRP CC[C@H](C)C[N@@H+]1CC[C@@]2(C1)CCCC[NH2+]2 ZINC000923534212 644489293 /nfs/dbraw/zinc/48/92/93/644489293.db2.gz RNVGWFNPDIKXFZ-QWHCGFSZSA-N 2 0 210.365 2.251 20 0 BEADRP Cc1csc(C[N@@H+](C)C2CCC([NH3+])CC2)n1 ZINC000087393828 644495340 /nfs/dbraw/zinc/49/53/40/644495340.db2.gz LQERZJNAGCTKSE-UHFFFAOYSA-N 2 0 239.388 2.153 20 0 BEADRP c1ccc(CC[N@H+](C[C@H]2CC[NH2+]C2)C2CC2)cc1 ZINC000923556316 644497486 /nfs/dbraw/zinc/49/74/86/644497486.db2.gz WALQCMMITVWEHW-HNNXBMFYSA-N 2 0 244.382 2.303 20 0 BEADRP c1ccc(CC[N@H+](C[C@@H]2CC[NH2+]C2)C2CC2)cc1 ZINC000923556318 644497671 /nfs/dbraw/zinc/49/76/71/644497671.db2.gz WALQCMMITVWEHW-OAHLLOKOSA-N 2 0 244.382 2.303 20 0 BEADRP C[C@H]1CCC[N@H+](CC[C@H]2CCC[NH2+]C2)CC1 ZINC000252140931 644836608 /nfs/dbraw/zinc/83/66/08/644836608.db2.gz MGMANOWYINNTSM-UONOGXRCSA-N 2 0 224.392 2.498 20 0 BEADRP CC(C)C[C@H](C)C[N@@H+]1CC[C@]2(CCC[NH2+]2)C1 ZINC000415141989 644885996 /nfs/dbraw/zinc/88/59/96/644885996.db2.gz QFBKYCGTCAATEG-UONOGXRCSA-N 2 0 224.392 2.497 20 0 BEADRP C([C@H]1CC[NH2+]C1)[N@@H+]1CCCC2(CCCC2)C1 ZINC000843389200 645288343 /nfs/dbraw/zinc/28/83/43/645288343.db2.gz RTPDJXKGRYLPIP-ZDUSSCGKSA-N 2 0 222.376 2.252 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)C1(Cl)CC1 ZINC000926665998 645344071 /nfs/dbraw/zinc/34/40/71/645344071.db2.gz ODVSHHIDQHKRPH-GARJFASQSA-N 2 0 230.783 2.076 20 0 BEADRP C[C@@H]1CC[C@@H](C)C1[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000926665536 645344680 /nfs/dbraw/zinc/34/46/80/645344680.db2.gz GTZYLVKGSUUFAH-LPWJVIDDSA-N 2 0 224.392 2.351 20 0 BEADRP C(CC1CC[NH2+]CC1)[NH2+][C@@H]1CC[C@H]1C1CC1 ZINC000844927381 645350372 /nfs/dbraw/zinc/35/03/72/645350372.db2.gz ZOUJSSVFTDKRAN-UONOGXRCSA-N 2 0 222.376 2.154 20 0 BEADRP C[C@]1(CC[NH2+][C@@H]2CCC[C@H]2[NH3+])C[C@]1(F)Cl ZINC000844925443 645350696 /nfs/dbraw/zinc/35/06/96/645350696.db2.gz VCFJBISNPXHNRZ-CHWFTXMASA-N 2 0 234.746 2.161 20 0 BEADRP C[C@]1(CC[NH2+][C@@H]2CCC[C@@H]2[NH3+])C[C@@]1(F)Cl ZINC000844925444 645350749 /nfs/dbraw/zinc/35/07/49/645350749.db2.gz VCFJBISNPXHNRZ-VLEAKVRGSA-N 2 0 234.746 2.161 20 0 BEADRP Cc1cccc(C[NH2+][C@@H]2C[C@H]([NH3+])CC(C)(C)C2)n1 ZINC000925485890 645429538 /nfs/dbraw/zinc/42/95/38/645429538.db2.gz PLCRAURXRLCTDL-GXTWGEPZSA-N 2 0 247.386 2.386 20 0 BEADRP CC1(C)[C@@H]([NH2+]C2CCCC2)[C@@H]2CCC[NH2+][C@@H]21 ZINC000925490167 645535517 /nfs/dbraw/zinc/53/55/17/645535517.db2.gz FGHGCRPQPNCSJG-AGIUHOORSA-N 2 0 222.376 2.295 20 0 BEADRP CCc1cc(N2CC[C@H]3[C@@H]2CCC[N@@H+]3C)cc[nH+]1 ZINC000872779764 645769320 /nfs/dbraw/zinc/76/93/20/645769320.db2.gz TUCARJRVVRZZLD-GJZGRUSLSA-N 2 0 245.370 2.317 20 0 BEADRP CC(C)[N@@H+](C)CCC[NH2+][C@@H](C)Cc1ccccn1 ZINC000924616222 646079201 /nfs/dbraw/zinc/07/92/01/646079201.db2.gz AJXHGCWGWNYEIY-AWEZNQCLSA-N 2 0 249.402 2.333 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H]2C[C@H]3C=C[C@@H]2CC3)C1 ZINC000924706899 646093634 /nfs/dbraw/zinc/09/36/34/646093634.db2.gz RQXOEBCYKGIQLT-GBJTYRQASA-N 2 0 234.387 2.273 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H]2C[C@H]3C=C[C@@H]2CC3)C1 ZINC000924706903 646094232 /nfs/dbraw/zinc/09/42/32/646094232.db2.gz RQXOEBCYKGIQLT-YJNKXOJESA-N 2 0 234.387 2.273 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@H]1C[C@H]2C=C[C@@H]1CC2 ZINC000924854902 646119196 /nfs/dbraw/zinc/11/91/96/646119196.db2.gz NUFIXVSWWDUQGG-MJBXVCDLSA-N 2 0 222.376 2.273 20 0 BEADRP CC[N@@H+]1CCC[C@H](C[NH2+]C2CC(SC)C2)C1 ZINC000924863350 646121994 /nfs/dbraw/zinc/12/19/94/646121994.db2.gz WJXPWNICOHIMKT-PNESKVBLSA-N 2 0 242.432 2.202 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@@H](C)c2ncco2)CC1 ZINC000924955224 646142299 /nfs/dbraw/zinc/14/22/99/646142299.db2.gz NUUFSSPMSMTBRM-NSHDSACASA-N 2 0 237.347 2.057 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+][C@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925478964 646291472 /nfs/dbraw/zinc/29/14/72/646291472.db2.gz FPXVRQAWGSAFQR-KKOKHZNYSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+][C@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925478966 646292840 /nfs/dbraw/zinc/29/28/40/646292840.db2.gz FPXVRQAWGSAFQR-WYUUTHIRSA-N 2 0 210.365 2.138 20 0 BEADRP CC1(C[NH2+][C@@H](CCC[NH3+])c2ccccc2)COC1 ZINC000925482152 646294128 /nfs/dbraw/zinc/29/41/28/646294128.db2.gz LUUWVKMDLXJLJN-AWEZNQCLSA-N 2 0 248.370 2.093 20 0 BEADRP CC1(C)C[C@@H](NCc2nccs2)C[C@@H]([NH3+])C1 ZINC000925487818 646299660 /nfs/dbraw/zinc/29/96/60/646299660.db2.gz XJPOKOFFRHKMLM-ZJUUUORDSA-N 2 0 239.388 2.139 20 0 BEADRP CC[C@H]([NH2+][C@H]1C[C@H]([NH3+])C12CCC2)c1ccncc1 ZINC000925520037 646312331 /nfs/dbraw/zinc/31/23/31/646312331.db2.gz DUBCXRUJZBAUJH-IHRRRGAJSA-N 2 0 245.370 2.392 20 0 BEADRP CCCCOCC[NH2+][C@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925517936 646312778 /nfs/dbraw/zinc/31/27/78/646312778.db2.gz CPRFUSXIAHRVBL-OLZOCXBDSA-N 2 0 242.407 2.299 20 0 BEADRP CC1(C)C[C@@H]([NH2+][C@H]2CCCSC2)C[C@@H]([NH3+])C1 ZINC000925530672 646320658 /nfs/dbraw/zinc/32/06/58/646320658.db2.gz LGVHAODPAXKEMH-WOPDTQHZSA-N 2 0 242.432 2.378 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@@H]([NH3+])CC(C)(C)C1)[C@@H]1CCCO1 ZINC000925538297 646321217 /nfs/dbraw/zinc/32/12/17/646321217.db2.gz TZNGWWFFEYEEQY-LOWDOPEQSA-N 2 0 240.391 2.050 20 0 BEADRP CC1(C)C[C@H]([NH3+])C[C@@H]([NH2+]C[C@@H]2CCCS2)C1 ZINC000925552617 646328923 /nfs/dbraw/zinc/32/89/23/646328923.db2.gz LIQLQWQWRYHKET-UTUOFQBUSA-N 2 0 242.432 2.378 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+]C[C@@]1(C)CCCS1 ZINC000925553741 646330994 /nfs/dbraw/zinc/33/09/94/646330994.db2.gz VHECMVWAZSCCGR-CMPLNLGQSA-N 2 0 228.405 2.002 20 0 BEADRP CC1(C)C[C@@H]([NH2+]C2CCSCC2)C[C@@H]([NH3+])C1 ZINC000925592908 646349537 /nfs/dbraw/zinc/34/95/37/646349537.db2.gz ZNFLNYAIRSJMIV-PWSUYJOCSA-N 2 0 242.432 2.378 20 0 BEADRP CC1(C)C[C@@H]1C[NH2+][C@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C ZINC000925595395 646351683 /nfs/dbraw/zinc/35/16/83/646351683.db2.gz JVOFGJKDQYGHSY-NDBYEHHHSA-N 2 0 236.403 2.399 20 0 BEADRP CC1(C)C[C@@H]([NH2+]CCc2ccco2)C[C@@H]([NH3+])C1 ZINC000925611290 646359289 /nfs/dbraw/zinc/35/92/89/646359289.db2.gz LUICVKWAQFABPO-NEPJUHHUSA-N 2 0 236.359 2.318 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+]C[C@H]1CC=CCC1 ZINC000925614821 646363303 /nfs/dbraw/zinc/36/33/03/646363303.db2.gz CPTKDIAOOOXRJE-RYUDHWBXSA-N 2 0 208.349 2.073 20 0 BEADRP C([NH2+][C@H]1CC[NH2+]C12CCC2)C12CCC(CC1)C2 ZINC000925627445 646374209 /nfs/dbraw/zinc/37/42/09/646374209.db2.gz YUDDWWQGAIHEJQ-MOKVOYLWSA-N 2 0 234.387 2.441 20 0 BEADRP CC1(C)CC(C[NH2+][C@@H]2CC[NH2+]C2(C)C)C1 ZINC000925645369 646386167 /nfs/dbraw/zinc/38/61/67/646386167.db2.gz PYSHPLMSXBHJAU-LLVKDONJSA-N 2 0 210.365 2.153 20 0 BEADRP CC1(CC[NH2+][C@H]2CC[NH2+]C23CCC3)CC1 ZINC000925653196 646392910 /nfs/dbraw/zinc/39/29/10/646392910.db2.gz KCWQTJBOXOWZOQ-NSHDSACASA-N 2 0 208.349 2.051 20 0 BEADRP [NH3+]CCC[C@@H]([NH2+]CCF)c1ccccc1 ZINC000925655171 646393779 /nfs/dbraw/zinc/39/37/79/646393779.db2.gz QOTUTSGUSCEDPE-GFCCVEGCSA-N 2 0 210.296 2.026 20 0 BEADRP C[C@@H]1CCC[C@H]1C[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000925656157 646393787 /nfs/dbraw/zinc/39/37/87/646393787.db2.gz VZBBZGHBNMTJBB-AGIUHOORSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]1CCC[C@H]1C[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000925656158 646394191 /nfs/dbraw/zinc/39/41/91/646394191.db2.gz VZBBZGHBNMTJBB-FRRDWIJNSA-N 2 0 222.376 2.297 20 0 BEADRP CC1(C)CC[C@H]1[NH2+][C@@H]1CC[NH2+]C12CCCC2 ZINC000925674621 646403275 /nfs/dbraw/zinc/40/32/75/646403275.db2.gz SNPMHJOOANCFOF-VXGBXAGGSA-N 2 0 222.376 2.439 20 0 BEADRP COCC(C)(C)C[NH2+][C@@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925674730 646404129 /nfs/dbraw/zinc/40/41/29/646404129.db2.gz SODMAPABABTTFM-NWDGAFQWSA-N 2 0 242.407 2.155 20 0 BEADRP CC(C)C1([NH2+][C@@H]2C[C@H]([NH3+])C23CCC3)CC1 ZINC000925677475 646406972 /nfs/dbraw/zinc/40/69/72/646406972.db2.gz QLVNMPHADHMHLD-WDEREUQCSA-N 2 0 208.349 2.035 20 0 BEADRP CO[C@@H]1CCC[C@H]1[NH2+][C@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925683548 646411293 /nfs/dbraw/zinc/41/12/93/646411293.db2.gz SIDUUBIDLJZJAL-WUHRBBMRSA-N 2 0 240.391 2.050 20 0 BEADRP CC(C)[C@@H]1C[C@H]1C[NH2+][C@H]1CC[NH2+]C1(C)C ZINC000925687510 646414072 /nfs/dbraw/zinc/41/40/72/646414072.db2.gz CHVXPQLJTJXEIO-SRVKXCTJSA-N 2 0 210.365 2.009 20 0 BEADRP CC(C)[C@@H]1C[C@H]1C[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000925689223 646414927 /nfs/dbraw/zinc/41/49/27/646414927.db2.gz HLJBOKSXAJHBEC-AVGNSLFASA-N 2 0 222.376 2.153 20 0 BEADRP C([NH2+][C@@H]1CC[NH2+]C12CCCC2)[C@@H]1C[C@H]1C1CC1 ZINC000925688452 646415086 /nfs/dbraw/zinc/41/50/86/646415086.db2.gz CQQOOQYHMCYVQZ-MELADBBJSA-N 2 0 234.387 2.297 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC[NH2+]C1(C)C)CC(F)(F)F ZINC000925693374 646418081 /nfs/dbraw/zinc/41/80/81/646418081.db2.gz BMSISIRECDTRIC-IUCAKERBSA-N 2 0 238.297 2.305 20 0 BEADRP CCC([NH3+])(CC)CN[C@@H](c1ccccc1)[C@H](C)[NH3+] ZINC000925700806 646425601 /nfs/dbraw/zinc/42/56/01/646425601.db2.gz WRIPGHKENOGBQI-GXTWGEPZSA-N 2 0 249.402 2.182 20 0 BEADRP C[C@@H]1[C@H]2CC[C@@H](C[C@@H]1[NH2+][C@@H]1C[C@H]1C1CCC1)[NH2+]2 ZINC000925702217 646427140 /nfs/dbraw/zinc/42/71/40/646427140.db2.gz AWXPJJXVROKAKA-OJVJDFQCSA-N 2 0 234.387 2.294 20 0 BEADRP C[C@H]1[C@H]2CC[C@@H](C[C@H]1[NH2+][C@@H]1C[C@H]1C1CCC1)[NH2+]2 ZINC000925702218 646427383 /nfs/dbraw/zinc/42/73/83/646427383.db2.gz AWXPJJXVROKAKA-RCGGLWAFSA-N 2 0 234.387 2.294 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+]CC1=CCCC1 ZINC000925704230 646428566 /nfs/dbraw/zinc/42/85/66/646428566.db2.gz CYARWGHSVHCECA-VTXSZYRJSA-N 2 0 220.360 2.202 20 0 BEADRP Cc1cc(C[NH2+][C@@H]2C[C@H]([NH3+])C23CCC3)cc(C)n1 ZINC000925706580 646430839 /nfs/dbraw/zinc/43/08/39/646430839.db2.gz MPQMVWYRPSUXFT-UONOGXRCSA-N 2 0 245.370 2.058 20 0 BEADRP CC1(C)[C@H](C[NH2+][C@H]2C[C@@H]([NH3+])C23CCC3)C1(F)F ZINC000925706539 646431391 /nfs/dbraw/zinc/43/13/91/646431391.db2.gz LLTUUONSHAUPFU-AEJSXWLSSA-N 2 0 244.329 2.137 20 0 BEADRP CC1(C)C[C@@H]([NH2+]CCCCCC[NH3+])C[C@@H]([NH3+])C1 ZINC000925707228 646432978 /nfs/dbraw/zinc/43/29/78/646432978.db2.gz DKXGPCBATDXLBV-OLZOCXBDSA-N 3 0 241.423 2.001 20 0 BEADRP CC1(C)C[C@H]([NH3+])C[C@@H]([NH2+][C@@H]2C=CCC2)C1 ZINC000925710192 646434656 /nfs/dbraw/zinc/43/46/56/646434656.db2.gz HYXSQSIJBIMUSY-IJLUTSLNSA-N 2 0 208.349 2.201 20 0 BEADRP C([NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23)[C@@H]1C[C@H]1C1CCC1 ZINC000925711090 646436671 /nfs/dbraw/zinc/43/66/71/646436671.db2.gz WUEVZGNLMULSAK-XEVPTUHLSA-N 2 0 246.398 2.009 20 0 BEADRP CC(C)(F)CC[NH2+][C@@H]1CC[NH2+]C12CCCC2 ZINC000925712661 646438772 /nfs/dbraw/zinc/43/87/72/646438772.db2.gz YWEXUAHCXUBAQG-LLVKDONJSA-N 2 0 228.355 2.389 20 0 BEADRP C[C@]1(CC[NH2+][C@@H]2C[C@H]([NH3+])C23CCC3)CC1(F)F ZINC000925712721 646439145 /nfs/dbraw/zinc/43/91/45/646439145.db2.gz ZIQOWBOKHPRJSD-AXFHLTTASA-N 2 0 244.329 2.281 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC[NH2+]C1(C)C)CC(F)F ZINC000925713827 646439469 /nfs/dbraw/zinc/43/94/69/646439469.db2.gz UTVAEGQRLCSJKK-IUCAKERBSA-N 2 0 220.307 2.008 20 0 BEADRP CC(C)[C@H]([NH3+])CCN[C@@H](c1ccccc1)[C@H](C)[NH3+] ZINC000925715795 646440680 /nfs/dbraw/zinc/44/06/80/646440680.db2.gz MERUTFAAGIXRAR-NWANDNLSSA-N 2 0 249.402 2.038 20 0 BEADRP Cc1ncccc1C[NH2+][C@@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925718992 646442106 /nfs/dbraw/zinc/44/21/06/646442106.db2.gz PBHUBFGODSDBBO-UONOGXRCSA-N 2 0 247.386 2.386 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+]CC[C@H]1CC=CCC1 ZINC000925718092 646442397 /nfs/dbraw/zinc/44/23/97/646442397.db2.gz GJPWPRBEKPANCZ-QWHCGFSZSA-N 2 0 222.376 2.463 20 0 BEADRP Cc1ncccc1C[NH2+][C@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925718990 646443222 /nfs/dbraw/zinc/44/32/22/646443222.db2.gz PBHUBFGODSDBBO-KBPBESRZSA-N 2 0 247.386 2.386 20 0 BEADRP CC1CC(C[NH2+][C@H]2[C@@H]3CCC[NH2+][C@@H]3C2(C)C)C1 ZINC000925721875 646445999 /nfs/dbraw/zinc/44/59/99/646445999.db2.gz RDMHTHFANJRMSA-LSUUEXMVSA-N 2 0 236.403 2.399 20 0 BEADRP CCC[C@H](CCO)[NH2+][C@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925725196 646449708 /nfs/dbraw/zinc/44/97/08/646449708.db2.gz RRAINFGFWROSFT-XQQFMLRXSA-N 2 0 242.407 2.033 20 0 BEADRP C1=C[C@@H](C[NH2+][C@@H]2CC[NH2+]C23CCCC3)CC1 ZINC000925732608 646455445 /nfs/dbraw/zinc/45/54/45/646455445.db2.gz QHPGUUBZNSZQBG-CHWSQXEVSA-N 2 0 220.360 2.217 20 0 BEADRP C1=C[C@@H](C[NH2+][C@H]2CC[NH2+]C23CCCC3)CC1 ZINC000925732610 646456581 /nfs/dbraw/zinc/45/65/81/646456581.db2.gz QHPGUUBZNSZQBG-OLZOCXBDSA-N 2 0 220.360 2.217 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+][C@@H]1C[C@H]1C(F)(F)F ZINC000925733653 646457792 /nfs/dbraw/zinc/45/77/92/646457792.db2.gz KVNTYSBTABTIEL-RZJTZRKSSA-N 2 0 248.292 2.043 20 0 BEADRP CCC[C@H](C)CC[NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2 ZINC000925734958 646457848 /nfs/dbraw/zinc/45/78/48/646457848.db2.gz WDXPVZNQSPURAZ-UQGHGMQMSA-N 2 0 236.403 2.399 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]C[C@]1(C)CC1(C)C ZINC000925734952 646457856 /nfs/dbraw/zinc/45/78/56/646457856.db2.gz WDXNLKOHBKGEQH-BZPMIXESSA-N 2 0 224.392 2.400 20 0 BEADRP C([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)C1(CC2CC2)CC1 ZINC000925734828 646457861 /nfs/dbraw/zinc/45/78/61/646457861.db2.gz VOMGXAFHHMMLER-PBWFPOADSA-N 2 0 234.387 2.439 20 0 BEADRP CC(C)(C[NH2+][C@@H]1CCC[C@H]1[NH3+])CC(F)F ZINC000925733907 646457979 /nfs/dbraw/zinc/45/79/79/646457979.db2.gz MUXAVZIMWOAAPR-RKDXNWHRSA-N 2 0 220.307 2.137 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]CC2(CC3CC3)CC2)C12CCC2 ZINC000925733897 646458255 /nfs/dbraw/zinc/45/82/55/646458255.db2.gz MMXYDFHEUZTNNE-OLZOCXBDSA-N 2 0 234.387 2.426 20 0 BEADRP CC(C)(C[NH2+][C@H]1CCC[C@H]1[NH3+])CC(F)F ZINC000925733904 646458390 /nfs/dbraw/zinc/45/83/90/646458390.db2.gz MUXAVZIMWOAAPR-BDAKNGLRSA-N 2 0 220.307 2.137 20 0 BEADRP CC(C)O[C@H]1C[C@H]([NH2+]CCC(C)(C)[NH3+])C1(C)C ZINC000925736512 646459728 /nfs/dbraw/zinc/45/97/28/646459728.db2.gz AWLIPVMTQLWBJB-RYUDHWBXSA-N 2 0 242.407 2.296 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CCCC1(F)F)[C@H]1CC[NH2+]C1 ZINC000925736281 646460968 /nfs/dbraw/zinc/46/09/68/646460968.db2.gz LDMKKKPMJLVIPF-SRVKXCTJSA-N 2 0 246.345 2.400 20 0 BEADRP Cc1ccc([C@H](C)[NH2+]CCC(C)(C)[NH3+])c(C)n1 ZINC000925742530 646461894 /nfs/dbraw/zinc/46/18/94/646461894.db2.gz VTCCOEFSZAJNOK-NSHDSACASA-N 2 0 235.375 2.476 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+][C@@H]1C[C@@H]2CCCC[C@H]12 ZINC000925764973 646464463 /nfs/dbraw/zinc/46/44/63/646464463.db2.gz LDDICLGZNGSTJF-NAWOPXAZSA-N 2 0 210.365 2.281 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@@H]1C[C@@H]2CCCC[C@H]12 ZINC000925764972 646466678 /nfs/dbraw/zinc/46/66/78/646466678.db2.gz LDDICLGZNGSTJF-FPYNETTCSA-N 2 0 210.365 2.281 20 0 BEADRP Cc1nc(C)c(C[N@H+](C)CCCCCC[NH3+])o1 ZINC000723647735 711529999 /nfs/dbraw/zinc/52/99/99/711529999.db2.gz ZYPVCQWSAIGFET-UHFFFAOYSA-N 2 0 239.363 2.242 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1C[NH2+]CCC1(F)F)C1CCCC1 ZINC000925781657 646479731 /nfs/dbraw/zinc/47/97/31/646479731.db2.gz JDGKEYHOFWYSQZ-PWSUYJOCSA-N 2 0 246.345 2.400 20 0 BEADRP CC(C)[C@@H]([NH2+]C[C@H]1C[NH2+]CCC1(F)F)C1CC1 ZINC000925782341 646480075 /nfs/dbraw/zinc/48/00/75/646480075.db2.gz LIWKGIHCURIHKE-VXGBXAGGSA-N 2 0 246.345 2.255 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@H]1CC[C@H]1C1CCC1 ZINC000925785384 646481234 /nfs/dbraw/zinc/48/12/34/646481234.db2.gz NCTXTDUAJGSSQO-SAXRGWBVSA-N 2 0 222.376 2.010 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+][C@H]1CCC[C@H]1CCCF ZINC000925787119 646483823 /nfs/dbraw/zinc/48/38/23/646483823.db2.gz XCAVYZBACUEAGG-MROQNXINSA-N 2 0 228.355 2.102 20 0 BEADRP Cc1cccc2c1CC[C@H]2[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000925790835 646484529 /nfs/dbraw/zinc/48/45/29/646484529.db2.gz LCTBADUKPGBELD-DVOMOZLQSA-N 2 0 244.382 2.427 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@H]1CCc2c1cccc2F ZINC000925793254 646485536 /nfs/dbraw/zinc/48/55/36/646485536.db2.gz XSDBOYLFEBTLND-ZETOZRRWSA-N 2 0 248.345 2.258 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1C[NH2+]C[C@H]1C)c1ccccc1 ZINC000925791431 646485563 /nfs/dbraw/zinc/48/55/63/646485563.db2.gz PNPWIWOVORIALA-DYEKYZERSA-N 2 0 218.344 2.193 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+]C[C@@H]1C[NH2+]C[C@H]1C)CC2 ZINC000925790638 646485823 /nfs/dbraw/zinc/48/58/23/646485823.db2.gz JKBBQJIJLFHNJY-IVMMDQJWSA-N 2 0 244.382 2.427 20 0 BEADRP C[C@H]([NH2+]C[C@]12C[C@H]1CCCC2)[C@@H]1CCC[NH2+]1 ZINC000925803275 646488358 /nfs/dbraw/zinc/48/83/58/646488358.db2.gz WPRCYSDAVYEGLZ-CRWXNKLISA-N 2 0 222.376 2.297 20 0 BEADRP Cc1cncc([C@H](C)[NH2+]CC[C@@H]2C[NH2+]C[C@H]2C)c1 ZINC000925803781 646488934 /nfs/dbraw/zinc/48/89/34/646488934.db2.gz VKSNITWGGDQKAD-HZSPNIEDSA-N 2 0 247.386 2.286 20 0 BEADRP C[C@@H]1C[C@H]1[C@@H]1C[C@H]1[NH2+][C@@H]1CC[NH2+]CC[C@@H]1C ZINC000925821272 646495129 /nfs/dbraw/zinc/49/51/29/646495129.db2.gz GNFWFNJHCBTEPF-GMDXDWKASA-N 2 0 222.376 2.009 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H](c1ccccn1)C1CC1 ZINC000925824133 646496352 /nfs/dbraw/zinc/49/63/52/646496352.db2.gz VOLVHXPTWSSEKH-COPLHBTASA-N 2 0 233.359 2.248 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]CCC1CC=CC1 ZINC000925830313 646500578 /nfs/dbraw/zinc/50/05/78/646500578.db2.gz CMCHGISUZHZGAR-TZMCWYRMSA-N 2 0 222.376 2.320 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2C[C@@H]([NH3+])C23CCC3)CCS1 ZINC000925857566 646510698 /nfs/dbraw/zinc/51/06/98/646510698.db2.gz HNMQXSJGEZPXDO-KKOKHZNYSA-N 2 0 240.416 2.130 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@@H]([NH3+])C2)CCS1 ZINC000925860698 646514289 /nfs/dbraw/zinc/51/42/89/646514289.db2.gz JQJDNWFLKYFCDI-WISYIIOYSA-N 2 0 228.405 2.130 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@H]([NH3+])C2)CCS1 ZINC000925860697 646515398 /nfs/dbraw/zinc/51/53/98/646515398.db2.gz JQJDNWFLKYFCDI-NOOOWODRSA-N 2 0 228.405 2.130 20 0 BEADRP C([NH2+][C@@H]1CC[NH2+]C12CCCC2)[C@]12C[C@H]1CCC2 ZINC000925879639 646529282 /nfs/dbraw/zinc/52/92/82/646529282.db2.gz BEGCTBUBAFYXBP-MCIONIFRSA-N 2 0 234.387 2.441 20 0 BEADRP C1=CCCC(C[NH2+][C@H]2[C@@H]3[NH2+]C[C@@H]4C[C@H]2C[C@@H]43)CC1 ZINC000925880999 646530699 /nfs/dbraw/zinc/53/06/99/646530699.db2.gz PJPMUJOBKYOXRL-RFBLXINOSA-N 2 0 246.398 2.319 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[NH2+][C@@H]2CCCc3occc32)C1 ZINC000925882470 646531609 /nfs/dbraw/zinc/53/16/09/646531609.db2.gz MVRXVAYXZOGRGO-DMDPSCGWSA-N 2 0 234.343 2.374 20 0 BEADRP C[N@H+]1C[C@H]2CC[C@@H](C1)C2[NH2+]CCC1(F)CCC1 ZINC000926425955 646636577 /nfs/dbraw/zinc/63/65/77/646636577.db2.gz QDGPIFBDLAWWAT-FUNVUKJBSA-N 2 0 240.366 2.199 20 0 BEADRP c1nc2c([nH]1)C[C@H]([NH2+][C@H]1CC3CCC1CC3)CC2 ZINC000926451087 646642212 /nfs/dbraw/zinc/64/22/12/646642212.db2.gz VUODOMIYDIWTNI-YZVRNYIASA-N 2 0 245.370 2.435 20 0 BEADRP C[C@H](C[NH2+][C@H]1C[C@H]2C=C[C@@H]1CC2)C[NH+](C)C ZINC000926474045 646653760 /nfs/dbraw/zinc/65/37/60/646653760.db2.gz NQAKDHNFRMIUOQ-RQJABVFESA-N 2 0 222.376 2.128 20 0 BEADRP CC[C@H](C[C@@](C)(O)CC)[NH2+]C[C@@H](C)C[NH+](C)C ZINC000926473698 646653916 /nfs/dbraw/zinc/65/39/16/646653916.db2.gz NFBPHRKEVWFKTC-MCIONIFRSA-N 2 0 244.423 2.103 20 0 BEADRP C[NH+](C)CCC[NH2+][C@@H]1CCO[C@@H](C(C)(C)C)C1 ZINC000721552888 711624421 /nfs/dbraw/zinc/62/44/21/711624421.db2.gz VYXHAURLQKKUSK-CHWSQXEVSA-N 2 0 242.407 2.121 20 0 BEADRP CC[C@@H]1C[N@H+](CCCC(C)(F)F)CC[C@@H]1[NH3+] ZINC000718709717 711663268 /nfs/dbraw/zinc/66/32/68/711663268.db2.gz UZEIRUQDIMJTKU-MNOVXSKESA-N 2 0 234.334 2.481 20 0 BEADRP CC[C@@H]1CC[C@@H](C)[N@@H+]1CCC[NH2+]C1CC1 ZINC000136085664 711684257 /nfs/dbraw/zinc/68/42/57/711684257.db2.gz BPMBZLJZZDIQJM-DGCLKSJQSA-N 2 0 210.365 2.391 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+]C1CCC([NH3+])CC1 ZINC000335049126 711719843 /nfs/dbraw/zinc/71/98/43/711719843.db2.gz IYBNHBUWVJAWCN-TYUFSLCMSA-N 2 0 210.365 2.281 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]CCC1CCC1 ZINC000229077844 711837569 /nfs/dbraw/zinc/83/75/69/711837569.db2.gz GEQFMEZOYWFATQ-QWHCGFSZSA-N 2 0 210.365 2.284 20 0 BEADRP CC1(C)C[C@]1(C)C[NH2+][C@@H]1CCC[C@H]1C[NH3+] ZINC000701983929 712034342 /nfs/dbraw/zinc/03/43/42/712034342.db2.gz IZONWNBNWQMXKO-DMDPSCGWSA-N 2 0 210.365 2.140 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCSC1)[C@H]1CCCC[NH2+]1 ZINC000704777796 712116173 /nfs/dbraw/zinc/11/61/73/712116173.db2.gz VKZNJWIWFXPVHS-RWMBFGLXSA-N 2 0 242.432 2.250 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CC[C@H]1CCSC1 ZINC000704840195 712118945 /nfs/dbraw/zinc/11/89/45/712118945.db2.gz GSPOJOUFEQKPIO-RYUDHWBXSA-N 2 0 230.421 2.237 20 0 BEADRP C[C@@H](C[N@@H+]1CC[C@H](CC[NH3+])C1)C(C)(C)C ZINC000710719906 712255616 /nfs/dbraw/zinc/25/56/16/712255616.db2.gz RPJWQVQZNOSAAL-RYUDHWBXSA-N 2 0 212.381 2.339 20 0 BEADRP C[N@@H+](C/C=C\Cl)CCCCCC[NH3+] ZINC000710683722 712254173 /nfs/dbraw/zinc/25/41/73/712254173.db2.gz KNKHCCVDTOFZBA-SREVYHEPSA-N 2 0 204.745 2.190 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@@H]1C[C@@H]2CC[C@@H](C2)C1 ZINC000711068524 712278315 /nfs/dbraw/zinc/27/83/15/712278315.db2.gz LQJWDDRAWKMTBX-BTTYYORXSA-N 2 0 224.392 2.497 20 0 BEADRP FC[C@H]1CCC[N@H+](C[C@@H]2CCCC[NH2+]C2)C1 ZINC000711440733 712300996 /nfs/dbraw/zinc/30/09/96/712300996.db2.gz FCTQBAYWJPTYNG-CHWSQXEVSA-N 2 0 228.355 2.058 20 0 BEADRP C[C@@H]1C[C@H]([NH3+])CC[N@@H+]1CC[C@@H]1C[C@H]1C1CC1 ZINC000712684607 712440463 /nfs/dbraw/zinc/44/04/63/712440463.db2.gz IETXOMSSCWPXKB-ZRJCITRHSA-N 2 0 222.376 2.234 20 0 BEADRP C=C/C=C/CC[NH+]1CCC([C@@H](C)[NH3+])CC1 ZINC000713705421 712469616 /nfs/dbraw/zinc/46/96/16/712469616.db2.gz XCISGBPRDPQBJQ-ZYOFXKKJSA-N 2 0 208.349 2.178 20 0 BEADRP CC1(C)CCC[C@H](CN2CCCC[C@@H]2C[NH3+])O1 ZINC000714321995 712482008 /nfs/dbraw/zinc/48/20/08/712482008.db2.gz XOONDTDWMVOKRK-CHWSQXEVSA-N 2 0 240.391 2.147 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CC[N@H+](C[C@@H]2CCCC(C)(C)O2)C1 ZINC000714375373 712484542 /nfs/dbraw/zinc/48/45/42/712484542.db2.gz UFDZXQYYZGCQHZ-XQQFMLRXSA-N 2 0 240.391 2.003 20 0 BEADRP CCC1([NH3+])CC[NH+](CC2(C)CCC2)CC1 ZINC000714753525 712497333 /nfs/dbraw/zinc/49/73/33/712497333.db2.gz COZXIRSWXLUNRM-UHFFFAOYSA-N 2 0 210.365 2.380 20 0 BEADRP COCC[C@H](C)[NH2+]C1CCC(C)([NH+](C)C)CC1 ZINC000715511973 712524698 /nfs/dbraw/zinc/52/46/98/712524698.db2.gz ZDYAIKXZLSNIBP-HSBZDZAISA-N 2 0 242.407 2.264 20 0 BEADRP C[NH+](C)C1(C)CCC([NH2+]Cc2cc[nH]c2)CC1 ZINC000715513511 712524924 /nfs/dbraw/zinc/52/49/24/712524924.db2.gz QVKCHTIVSSOGNY-UHFFFAOYSA-N 2 0 235.375 2.367 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]CC[C@@H]2CCCS2)C12CCC2 ZINC000715659320 712529764 /nfs/dbraw/zinc/52/97/64/712529764.db2.gz NXFRDKYZUUKENN-QJPTWQEYSA-N 2 0 240.416 2.132 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]CC[C@H]2CCCS2)C1 ZINC000715751538 712531742 /nfs/dbraw/zinc/53/17/42/712531742.db2.gz FNNJPTKZVAAPMY-GRYCIOLGSA-N 2 0 228.405 2.132 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]CCCCC1CC1 ZINC000716412080 712559304 /nfs/dbraw/zinc/55/93/04/712559304.db2.gz GOOWIQICFNLJSZ-STQMWFEESA-N 2 0 210.365 2.284 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CC[C@@H]2C[C@@H]21)[C@@H]1CCC[NH2+]1 ZINC000717031435 712615066 /nfs/dbraw/zinc/61/50/66/712615066.db2.gz UIUJZJPCTHXSDB-QNSTZXKLSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]1CCCC[C@H]1[NH2+]C[C@@H]1C[NH2+]CCC1(F)F ZINC000717047325 712625070 /nfs/dbraw/zinc/62/50/70/712625070.db2.gz LOTMYCPUKDDKMO-GRYCIOLGSA-N 2 0 246.345 2.400 20 0 BEADRP CC1(C[NH2+]C[C@H]2C[NH2+]CCC2(F)F)CCC1 ZINC000717310032 712646267 /nfs/dbraw/zinc/64/62/67/712646267.db2.gz ZBZJHOXQTCKLEK-SNVBAGLBSA-N 2 0 232.318 2.011 20 0 BEADRP C[C@H](CC1CCC1)[NH2+]C[C@H]1C[NH2+]CCC1(F)F ZINC000717335330 712649238 /nfs/dbraw/zinc/64/92/38/712649238.db2.gz NKGQPZFKDBJXOB-ZYHUDNBSSA-N 2 0 246.345 2.400 20 0 BEADRP C[C@@H](CC1CCC1)[NH2+]C[C@H]1C[NH2+]CCC1(F)F ZINC000717335327 712649376 /nfs/dbraw/zinc/64/93/76/712649376.db2.gz NKGQPZFKDBJXOB-CMPLNLGQSA-N 2 0 246.345 2.400 20 0 BEADRP CC(F)(F)CCC[N@@H+]1CC[C@@](C)(C[NH3+])C1 ZINC000718572608 712774997 /nfs/dbraw/zinc/77/49/97/712774997.db2.gz SAEYZXRXVULJLY-JTQLQIEISA-N 2 0 220.307 2.093 20 0 BEADRP CO[C@@H]1CCC[C@H]([NH2+][C@@H](C)CC[NH+](C)C)CC1 ZINC000718838912 712784854 /nfs/dbraw/zinc/78/48/54/712784854.db2.gz BZQLMEKTMDCAIO-MELADBBJSA-N 2 0 242.407 2.264 20 0 BEADRP CC1(C[NH2+][C@@H]2C[C@@H]([NH3+])C23CCC3)CC(F)(F)C1 ZINC000720900585 712874843 /nfs/dbraw/zinc/87/48/43/712874843.db2.gz ODXNAWZYZVVONG-NXEZZACHSA-N 2 0 244.329 2.281 20 0 BEADRP CC1(C[NH2+][C@H]2CCC[C@H]2C[NH3+])CC(F)(F)C1 ZINC000720912885 712877679 /nfs/dbraw/zinc/87/76/79/712877679.db2.gz QYRPJRNIKFHNFM-UWVGGRQHSA-N 2 0 232.318 2.139 20 0 BEADRP CCO[C@H]1CCC[C@@H]([NH2+]CCCC[NH+](C)C)C1 ZINC000721170037 712894694 /nfs/dbraw/zinc/89/46/94/712894694.db2.gz XFWRHAJYMVLNML-KGLIPLIRSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@@H]1CC[C@H]1[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000381318693 710622480 /nfs/dbraw/zinc/62/24/80/710622480.db2.gz NYQQCAIKKDGFMD-BLYZHGLHSA-N 2 0 222.376 2.391 20 0 BEADRP CCC[NH+]1CCC(C[NH2+][C@H]2CC[C@H]2C)CC1 ZINC000381712190 710682779 /nfs/dbraw/zinc/68/27/79/710682779.db2.gz KLTUXOCQCHHBQI-OCCSQVGLSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1ccsc1C[NH2+]CC[C@@H]1C[NH2+]C[C@H]1C ZINC000722514609 710713971 /nfs/dbraw/zinc/71/39/71/710713971.db2.gz LGOYHIOMSQJRJI-VXGBXAGGSA-N 2 0 238.400 2.392 20 0 BEADRP C[C@H]1SCC[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000381825923 710724551 /nfs/dbraw/zinc/72/45/51/710724551.db2.gz MHNOWAFARQPAGV-JVGWCMFKSA-N 2 0 240.416 2.095 20 0 BEADRP CCOc1ccc(C[N@@H+]2CC[C@@H](CC[NH3+])C2)cc1 ZINC000723670970 710731406 /nfs/dbraw/zinc/73/14/06/710731406.db2.gz XCBMZJDWIOANPC-CQSZACIVSA-N 2 0 248.370 2.256 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+]C[C@@]2(C)CCCS2)C1 ZINC000382099358 710776518 /nfs/dbraw/zinc/77/65/18/710776518.db2.gz BEMFWOOQCJTESA-QWHCGFSZSA-N 2 0 242.432 2.204 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCC1(C)C)C1CC[NH+](C)CC1 ZINC000380540993 712901677 /nfs/dbraw/zinc/90/16/77/712901677.db2.gz HECBPOITASSMBH-YPMHNXCESA-N 2 0 224.392 2.495 20 0 BEADRP CCCCC[C@H](C)[NH2+]CC1(O)CC[NH+](C)CC1 ZINC000397537421 710908512 /nfs/dbraw/zinc/90/85/12/710908512.db2.gz IEMXUBQOGAFXAT-ZDUSSCGKSA-N 2 0 242.407 2.002 20 0 BEADRP CC1(C)C[N@H+](C[C@@]2(C)CCC[NH2+]C2)CCS1 ZINC000133325164 710970733 /nfs/dbraw/zinc/97/07/33/710970733.db2.gz MCIXGVRPYQCLGJ-ZDUSSCGKSA-N 2 0 242.432 2.204 20 0 BEADRP C[C@@H]([N@H+](C)CCC[NH2+]C1CC1)C1(C)CC1 ZINC000385301949 711009918 /nfs/dbraw/zinc/00/99/18/711009918.db2.gz NCWRSOBUHYJHEI-LLVKDONJSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@]2(C)CCC[NH2+]C2)[C@@H]1C ZINC000380702833 712902489 /nfs/dbraw/zinc/90/24/89/712902489.db2.gz XSIZJJVEFUAALL-JHJVBQTASA-N 2 0 210.365 2.106 20 0 BEADRP C[NH+](C)CCCC(C)(C)[NH2+]Cc1ccoc1 ZINC000387161251 711041249 /nfs/dbraw/zinc/04/12/49/711041249.db2.gz DNFVJERNBDSUEZ-UHFFFAOYSA-N 2 0 224.348 2.490 20 0 BEADRP Cc1csc(C[N@H+](C)CCCCCC[NH3+])n1 ZINC000387426108 711042305 /nfs/dbraw/zinc/04/23/05/711042305.db2.gz HGEMAJWKWUIVCM-UHFFFAOYSA-N 2 0 241.404 2.402 20 0 BEADRP CCc1ccc(CN2C[C@@H]([NH3+])C(C)(C)C2)cc1 ZINC000388025981 711050798 /nfs/dbraw/zinc/05/07/98/711050798.db2.gz CFPQRXZHGXNRTG-CQSZACIVSA-N 2 0 232.371 2.418 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000389618889 711082576 /nfs/dbraw/zinc/08/25/76/711082576.db2.gz HVAMZKZPMZIBPM-XQHKEYJVSA-N 2 0 210.365 2.247 20 0 BEADRP CS[C@@H]1CC[C@H]([NH2+][C@@H](C)CCCC[NH3+])C1 ZINC000389731742 711088137 /nfs/dbraw/zinc/08/81/37/711088137.db2.gz SPOJQDLBYJMLCU-SDDRHHMPSA-N 2 0 230.421 2.378 20 0 BEADRP CS[C@@H]1CC[C@H]([NH2+][C@H](C)CCCC[NH3+])C1 ZINC000389731734 711088200 /nfs/dbraw/zinc/08/82/00/711088200.db2.gz SPOJQDLBYJMLCU-GRYCIOLGSA-N 2 0 230.421 2.378 20 0 BEADRP C[NH+](C)CCCC[NH2+]C[C@@H]1CC1(Cl)Cl ZINC000390302259 711111783 /nfs/dbraw/zinc/11/17/83/711111783.db2.gz AKQWLZMATXWIAB-VIFPVBQESA-N 2 0 239.190 2.112 20 0 BEADRP C[NH+](C)CCCC[NH2+]Cc1ccc(Cl)cn1 ZINC000390329719 711113202 /nfs/dbraw/zinc/11/32/02/711113202.db2.gz JZIRHLZZIMUVRU-UHFFFAOYSA-N 2 0 241.766 2.166 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC[C@H]1C)C[NH+]1CCCCC1 ZINC000390459369 711118912 /nfs/dbraw/zinc/11/89/12/711118912.db2.gz BLSZFNDEDZPRQJ-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP CSC1(C[NH2+][C@H]2CC[C@H]2C)CC[NH+](C)CC1 ZINC000390509996 711122411 /nfs/dbraw/zinc/12/24/11/711122411.db2.gz ZCEGHWAEFZMNSL-NEPJUHHUSA-N 2 0 242.432 2.202 20 0 BEADRP C([NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32)C1(C2CC2)CCC1 ZINC000391420731 711138991 /nfs/dbraw/zinc/13/89/91/711138991.db2.gz DBSRRJZQBTWQAE-XSXPHNMFSA-N 2 0 246.398 2.153 20 0 BEADRP CCCCCC[NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23 ZINC000392806652 711151787 /nfs/dbraw/zinc/15/17/87/711151787.db2.gz CRTTYHFXABKPRY-MEBFFEOJSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@H]2[C@@H]3[NH2+]C[C@@H]4C[C@H]2C[C@@H]43)C1 ZINC000392816598 711152336 /nfs/dbraw/zinc/15/23/36/711152336.db2.gz ANNOJOUXQBLVBW-SRGUQECISA-N 2 0 234.387 2.151 20 0 BEADRP [NH3+]C[C@]12CCC[C@H]1C[N@H+](CCCC1CC1)C2 ZINC000394493438 711193650 /nfs/dbraw/zinc/19/36/50/711193650.db2.gz AOHPZDUAHAYNQM-KBPBESRZSA-N 2 0 222.376 2.237 20 0 BEADRP C[N@H+](CCCC1CC1)C1CCC([NH3+])CC1 ZINC000394605771 711195556 /nfs/dbraw/zinc/19/55/56/711195556.db2.gz ZBGISJHHMLCJTN-UHFFFAOYSA-N 2 0 210.365 2.378 20 0 BEADRP CCC[NH+]1CCC(C[NH2+][C@@H]2CC[C@@H]2C)CC1 ZINC000381712187 710681847 /nfs/dbraw/zinc/68/18/47/710681847.db2.gz KLTUXOCQCHHBQI-GXTWGEPZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+]Cc1cccs1 ZINC000722522160 710715203 /nfs/dbraw/zinc/71/52/03/710715203.db2.gz SLSHXUWBNZEFSK-GHMZBOCLSA-N 2 0 224.373 2.083 20 0 BEADRP C[C@@H]([NH3+])C1CC[NH+](CCCC2CC2)CC1 ZINC000394504312 710889443 /nfs/dbraw/zinc/88/94/43/710889443.db2.gz TVVGCAVSSMBHGG-LLVKDONJSA-N 2 0 210.365 2.236 20 0 BEADRP CS[C@@H]1CC[C@H]([NH2+][C@H](C)[C@H]2CCCC[NH2+]2)C1 ZINC000386552795 711033311 /nfs/dbraw/zinc/03/33/11/711033311.db2.gz HGUTYKXJBXOMLM-YVECIDJPSA-N 2 0 242.432 2.391 20 0 BEADRP [NH3+]CCC1CC[NH+](CCCC2CC2)CC1 ZINC000394619938 711194849 /nfs/dbraw/zinc/19/48/49/711194849.db2.gz DYNZLFIIXZCIMV-UHFFFAOYSA-N 2 0 210.365 2.237 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH+]1CCC([C@H](C)[NH3+])CC1 ZINC000723079563 711499675 /nfs/dbraw/zinc/49/96/75/711499675.db2.gz NLBIIDZEQUFKHU-LOWVWBTDSA-N 2 0 210.365 2.092 20 0 BEADRP CO[C@H](C[N@@H+]1CCC[C@H](C[NH3+])C1)c1ccccc1 ZINC000382366504 711502996 /nfs/dbraw/zinc/50/29/96/711502996.db2.gz XZADMMOQHNPRKP-UKRRQHHQSA-N 2 0 248.370 2.045 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1C[C@@H]2CCC[C@]2(C[NH3+])C1 ZINC000723104748 711503180 /nfs/dbraw/zinc/50/31/80/711503180.db2.gz ZGCCYHHLSAFXHA-RFGFWPKPSA-N 2 0 222.376 2.093 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]2)C1 ZINC000723132748 711506450 /nfs/dbraw/zinc/50/64/50/711506450.db2.gz CMXYLIOAFQATHT-KBXIAJHMSA-N 2 0 236.403 2.497 20 0 BEADRP CC[C@@H](c1ccccc1)[N@@H+]1C[C@@H](C)[C@H]([NH3+])C1 ZINC000723471124 711512481 /nfs/dbraw/zinc/51/24/81/711512481.db2.gz RHULSGUGHGXAJQ-BNOWGMLFSA-N 2 0 218.344 2.417 20 0 BEADRP C[C@@H](C[NH2+][C@@H]1CCCC2(CC2)C1)C[NH+](C)C ZINC000723560993 711517724 /nfs/dbraw/zinc/51/77/24/711517724.db2.gz VLBUHXOTRUCWKF-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1ccc(OCC[N@@H+]2CC[C@@H](CC[NH3+])C2)cc1 ZINC000723670072 711532984 /nfs/dbraw/zinc/53/29/84/711532984.db2.gz OGHDATGOYFSPDC-CQSZACIVSA-N 2 0 248.370 2.045 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@@H](CC[NH3+])C2)cc1F ZINC000723668759 711533043 /nfs/dbraw/zinc/53/30/43/711533043.db2.gz BUGPODAMVMEUAG-GFCCVEGCSA-N 2 0 236.334 2.305 20 0 BEADRP Cc1ccc(F)c(C[N@@H+]2CC[C@H](CC[NH3+])C2)c1 ZINC000723668968 711533446 /nfs/dbraw/zinc/53/34/46/711533446.db2.gz DVWWLQYHJPLXIA-LBPRGKRZSA-N 2 0 236.334 2.305 20 0 BEADRP C[C@@H]1C[C@H](C)CC[N@H+](CC[C@@H]2CC[NH2+]C2)C1 ZINC000723779263 711536768 /nfs/dbraw/zinc/53/67/68/711536768.db2.gz ICMKNACEUUGZLW-MCIONIFRSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H](c1ccccn1)[N@@H+]1C[C@@H](C)[C@H](CC[NH3+])C1 ZINC000723891847 711543903 /nfs/dbraw/zinc/54/39/03/711543903.db2.gz OMSAPIJMLRVVPH-FRRDWIJNSA-N 2 0 233.359 2.059 20 0 BEADRP C[C@@H]1C[N@H+](CC2CC(C)(C)C2)C[C@H]1CC[NH3+] ZINC000723890313 711544392 /nfs/dbraw/zinc/54/43/92/711544392.db2.gz FTXHOOYIPZHCPV-DGCLKSJQSA-N 2 0 224.392 2.339 20 0 BEADRP CCCC1(C[NH2+][C@H]2[C@@H]3[NH2+]C[C@@H]4C[C@H]2C[C@@H]43)CC1 ZINC000383303505 711551287 /nfs/dbraw/zinc/55/12/87/711551287.db2.gz MIHZRTRDDSDZET-QSLWVIQJSA-N 2 0 234.387 2.153 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CCC2CC=CC2)CC[N@@H+]1C ZINC000724184472 711567039 /nfs/dbraw/zinc/56/70/39/711567039.db2.gz IXZAAVISTJCOKR-GXTWGEPZSA-N 2 0 222.376 2.415 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]CCC2CC=CC2)C1 ZINC000724201124 711568815 /nfs/dbraw/zinc/56/88/15/711568815.db2.gz STROWWKLOHOURW-QWHCGFSZSA-N 2 0 208.349 2.202 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CC[C@H]1CC(C)(C)CO1 ZINC000717291428 711594555 /nfs/dbraw/zinc/59/45/55/711594555.db2.gz JVMNOSJANFULTC-STQMWFEESA-N 2 0 242.407 2.299 20 0 BEADRP C[NH+](C)CCC[NH2+][C@H]1CCO[C@H](C(C)(C)C)C1 ZINC000721552893 711624341 /nfs/dbraw/zinc/62/43/41/711624341.db2.gz VYXHAURLQKKUSK-STQMWFEESA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H]1CCC[C@@H]1C[NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2 ZINC000383104497 711668193 /nfs/dbraw/zinc/66/81/93/711668193.db2.gz CSVRDWRYGUNIQM-ZTQNTSQUSA-N 2 0 234.387 2.009 20 0 BEADRP Cc1cnccc1C[N@@H+](C)C1CCC([NH3+])CC1 ZINC000395360424 711694283 /nfs/dbraw/zinc/69/42/83/711694283.db2.gz JEJOJQKMPXRAGT-UHFFFAOYSA-N 2 0 233.359 2.092 20 0 BEADRP CC(C)(C)CC[N@@H+]1CC[C@@]2(CCC[NH2+]2)C1 ZINC000335265170 711721301 /nfs/dbraw/zinc/72/13/01/711721301.db2.gz GEPPBOMLESHETG-ZDUSSCGKSA-N 2 0 210.365 2.251 20 0 BEADRP CC1(C)C[C@@H]([NH2+]CC2CC=CC2)C[C@@H]([NH3+])C1 ZINC000925722742 711726355 /nfs/dbraw/zinc/72/63/55/711726355.db2.gz KRDGDYDNMBQKHD-OLZOCXBDSA-N 2 0 222.376 2.448 20 0 BEADRP CC1(C)C[C@H]([NH3+])C[C@@H]([NH2+]CC2CC=CC2)C1 ZINC000925722741 711726480 /nfs/dbraw/zinc/72/64/80/711726480.db2.gz KRDGDYDNMBQKHD-CHWSQXEVSA-N 2 0 222.376 2.448 20 0 BEADRP C[C@@H]1[C@H]2CC[C@@H](C[C@@H]1[NH2+][C@@H]1CCCC[C@@H]1F)[NH2+]2 ZINC000925724571 711728468 /nfs/dbraw/zinc/72/84/68/711728468.db2.gz BJQKLKFLGOSPGD-JJEKRJTGSA-N 2 0 240.366 2.386 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@H](c2ccccn2)C2CC2)C1 ZINC000925821459 711756225 /nfs/dbraw/zinc/75/62/25/711756225.db2.gz JGYRCOZNAFYDMZ-NFAWXSAZSA-N 2 0 245.370 2.392 20 0 BEADRP CC(C)([NH2+]CCCCCC[NH3+])c1nccs1 ZINC000232556655 711760941 /nfs/dbraw/zinc/76/09/41/711760941.db2.gz XAWDSWVGOPWZMN-UHFFFAOYSA-N 2 0 241.404 2.487 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]C[C@]12C[C@H]1CCC2 ZINC000925880316 711762091 /nfs/dbraw/zinc/76/20/91/711762091.db2.gz JEIZWHNQPZDPRS-MQYQWHSLSA-N 2 0 222.376 2.426 20 0 BEADRP CSCC[C@H](C)[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000159983500 711805130 /nfs/dbraw/zinc/80/51/30/711805130.db2.gz RONSUOKOILJVQF-YNEHKIRRSA-N 2 0 242.432 2.344 20 0 BEADRP CSCC[C@H](C)[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000159983736 711805581 /nfs/dbraw/zinc/80/55/81/711805581.db2.gz RONSUOKOILJVQF-RWMBFGLXSA-N 2 0 242.432 2.344 20 0 BEADRP CCO[C@H]1CCC[C@@H]([NH2+]C2CC([NH+](C)C)C2)C1 ZINC000721273136 711881944 /nfs/dbraw/zinc/88/19/44/711881944.db2.gz NMEIRHGGVXZHEB-RYSNWHEDSA-N 2 0 240.391 2.016 20 0 BEADRP C1CC1[C@H]1CC[C@@H]1[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000530216508 711937773 /nfs/dbraw/zinc/93/77/73/711937773.db2.gz PYJSRPWPNRDONH-AGIUHOORSA-N 2 0 220.360 2.049 20 0 BEADRP COC[C@H](C[N@@H+]1CCCC[C@H]1CC[NH3+])C(C)C ZINC000721959262 711948037 /nfs/dbraw/zinc/94/80/37/711948037.db2.gz HGMRSTZDTFIJAJ-KBPBESRZSA-N 2 0 242.407 2.108 20 0 BEADRP C(C[NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2)CC1CCC1 ZINC000701746118 712028678 /nfs/dbraw/zinc/02/86/78/712028678.db2.gz AUABLMHNMMYAMY-LXFSFDBISA-N 2 0 234.387 2.153 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[N@@H+]2CCC[C@H](CCF)C2)C1 ZINC000701895179 712031837 /nfs/dbraw/zinc/03/18/37/712031837.db2.gz CHDLQOCNUXNZNK-FRRDWIJNSA-N 2 0 228.355 2.185 20 0 BEADRP CC1(C)C[C@]1(C)C[NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23 ZINC000701986360 712035259 /nfs/dbraw/zinc/03/52/59/712035259.db2.gz OBNIBRQJMDHROC-ZBIBNXQESA-N 2 0 234.387 2.009 20 0 BEADRP C[C@]12C[NH2+]C[C@H]1C[N@H+](CCC1CCCCC1)C2 ZINC000702071056 712037287 /nfs/dbraw/zinc/03/72/87/712037287.db2.gz IPXBWKOLRLQCSQ-LSDHHAIUSA-N 2 0 236.403 2.498 20 0 BEADRP C[C@H]1CCCC[N@H+](C[C@@H]2CCCC[NH2+]C2)C1 ZINC000703211907 712068451 /nfs/dbraw/zinc/06/84/51/712068451.db2.gz HRWDVYVROHUVLB-UONOGXRCSA-N 2 0 224.392 2.498 20 0 BEADRP CC[C@H](C)C[N@H+](C)CC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000703893629 712092456 /nfs/dbraw/zinc/09/24/56/712092456.db2.gz GAHYCIRASKJNGH-FUDCBSFHSA-N 2 0 224.392 2.495 20 0 BEADRP CCC(F)(F)CN1CCC2(C1)CC[NH2+]CC2 ZINC000704760083 712115413 /nfs/dbraw/zinc/11/54/13/712115413.db2.gz UWSBXCOKHQBOFQ-UHFFFAOYSA-N 2 0 232.318 2.107 20 0 BEADRP C[NH+]1CCC(C[NH2+]CC[C@@H]2CCSC2)CC1 ZINC000704790148 712116969 /nfs/dbraw/zinc/11/69/69/712116969.db2.gz KKQOHORJWBCOIW-CYBMUJFWSA-N 2 0 242.432 2.061 20 0 BEADRP CCC[C@H](C[NH2+]CC1CC[NH+](C)CC1)OCC ZINC000705343478 712129156 /nfs/dbraw/zinc/12/91/56/712129156.db2.gz KYPZLTCQFGZPJB-CQSZACIVSA-N 2 0 242.407 2.123 20 0 BEADRP C([NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32)[C@H]1CCCC12CC2 ZINC000706262962 712142558 /nfs/dbraw/zinc/14/25/58/712142558.db2.gz ITIZEWDWAICLRD-XDSHMYFISA-N 2 0 246.398 2.153 20 0 BEADRP CSC1CC([NH2+]CC2(C)CC[NH+](C)CC2)C1 ZINC000706913915 712158236 /nfs/dbraw/zinc/15/82/36/712158236.db2.gz AEDBFBMDKMEGQL-UHFFFAOYSA-N 2 0 242.432 2.202 20 0 BEADRP CC[N@H+](C[C@@]1(C)CCC[NH2+]C1)C1CCC1 ZINC000706892301 712159531 /nfs/dbraw/zinc/15/95/31/712159531.db2.gz APIJSGKVFJJUJP-ZDUSSCGKSA-N 2 0 210.365 2.251 20 0 BEADRP C[NH2+]CCOCC[N@H+](C)C[C@H](C)CC(C)(C)C ZINC000709184510 712197763 /nfs/dbraw/zinc/19/77/63/712197763.db2.gz AURAOYAZGZJFNJ-CYBMUJFWSA-N 2 0 244.423 2.227 20 0 BEADRP CC(C)(C)SCC[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000709387848 712220612 /nfs/dbraw/zinc/22/06/12/712220612.db2.gz CPQDYAKMRQWDFI-FOSCPWQOSA-N 2 0 242.432 2.391 20 0 BEADRP C[C@@H]1[C@H]2CC[C@@H](C[C@H]1[NH2+][C@@H]1CC13CCCC3)[NH2+]2 ZINC000709389789 712220973 /nfs/dbraw/zinc/22/09/73/712220973.db2.gz SPWJAIZIYQRGNT-XVIXHAIJSA-N 2 0 234.387 2.438 20 0 BEADRP C[C@@H]1[C@H]2CC[C@@H](C[C@H]1[NH2+][C@H]1CC=CCC1)[NH2+]2 ZINC000709436640 712221989 /nfs/dbraw/zinc/22/19/89/712221989.db2.gz MEXTWBRWVZWUTQ-MBJXGIAVSA-N 2 0 220.360 2.214 20 0 BEADRP [NH3+][C@H]1C[C@H]2C[C@@H](C1)[N@H+](C[C@H]1CCC(F)(F)C1)C2 ZINC000709843655 712229316 /nfs/dbraw/zinc/22/93/16/712229316.db2.gz NKROAILBWKIFON-BJDJZHNGSA-N 2 0 244.329 2.233 20 0 BEADRP [NH3+][C@@H]1C[C@H]2C[C@@H](C1)[N@H+](C[C@@H]1CC[C@H]3C[C@H]3C1)C2 ZINC000709862457 712230150 /nfs/dbraw/zinc/23/01/50/712230150.db2.gz NIKZKNRVMNGQPH-FSKVPOERSA-N 2 0 234.387 2.234 20 0 BEADRP C([C@@H]1C[C@H]2C[C@H]2C1)[N@@H+]1CC[C@@]2(C1)CCC[NH2+]C2 ZINC000709920527 712232446 /nfs/dbraw/zinc/23/24/46/712232446.db2.gz QDPRSMUKOPENNB-XGUBFFRZSA-N 2 0 234.387 2.108 20 0 BEADRP C[C@@H]1C[C@H]([NH3+])CC[N@@H+]1C[C@H]1C[C@@H]2[C@H](C1)C2(F)F ZINC000710511333 712253796 /nfs/dbraw/zinc/25/37/96/712253796.db2.gz VRSSHSHUVXSJGW-PZWNZHSQSA-N 2 0 244.329 2.089 20 0 BEADRP C[N@H+]1CC=C(C[NH2+][C@H]2C[C@@H]3CC[C@@H](C3)C2)CC1 ZINC000710895120 712262017 /nfs/dbraw/zinc/26/20/17/712262017.db2.gz FEDCHDBHPIMNFD-FICVDOATSA-N 2 0 234.387 2.417 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]C[C@H]2C=CCC2)CC1 ZINC000711733353 712321130 /nfs/dbraw/zinc/32/11/30/712321130.db2.gz VDZSFORXUDZJAB-ZDUSSCGKSA-N 2 0 222.376 2.415 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1C=CCC1)C1CC[NH+](C)CC1 ZINC000711725522 712322074 /nfs/dbraw/zinc/32/20/74/712322074.db2.gz AWOXHUWLBLFUKF-CHWSQXEVSA-N 2 0 222.376 2.273 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C=CCC1)C1CC[NH+](C)CC1 ZINC000711725526 712322603 /nfs/dbraw/zinc/32/26/03/712322603.db2.gz AWOXHUWLBLFUKF-OLZOCXBDSA-N 2 0 222.376 2.273 20 0 BEADRP [NH3+]CC[C@H]1CC[N@H+](Cc2ccc3cc[nH]c3c2)C1 ZINC000923479455 712334293 /nfs/dbraw/zinc/33/42/93/712334293.db2.gz PCJQJFZLCGIDLC-LBPRGKRZSA-N 2 0 243.354 2.339 20 0 BEADRP C(C1CCCCC1)[N@@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1 ZINC000390666519 712423495 /nfs/dbraw/zinc/42/34/95/712423495.db2.gz RSUWVIILDWEWKF-UONOGXRCSA-N 2 0 222.376 2.108 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1C[C@H]1C1CC1)[C@@H]1CCC[NH2+]1 ZINC000712665812 712440076 /nfs/dbraw/zinc/44/00/76/712440076.db2.gz DTXWGOZTURQICB-GHYVTOPFSA-N 2 0 222.376 2.153 20 0 BEADRP COc1ccc(CN2CC[NH2+]CCC2(C)C)cc1 ZINC000712561160 712445815 /nfs/dbraw/zinc/44/58/15/712445815.db2.gz HPPYYFBUZBBLDT-UHFFFAOYSA-N 2 0 248.370 2.269 20 0 BEADRP C[C@@H]1C[C@@H]([NH3+])CC[N@@H+]1CC[C@@H]1C[C@H]1C1CC1 ZINC000712692083 712448300 /nfs/dbraw/zinc/44/83/00/712448300.db2.gz IETXOMSSCWPXKB-ZZVYKPCYSA-N 2 0 222.376 2.234 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]CC[C@@H]2C[C@H]2C2CC2)C1 ZINC000712729796 712448627 /nfs/dbraw/zinc/44/86/27/712448627.db2.gz CUDMOCQYPABHJG-MQYQWHSLSA-N 2 0 222.376 2.282 20 0 BEADRP C=C/C=C\CC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000713640752 712467860 /nfs/dbraw/zinc/46/78/60/712467860.db2.gz GSXRZLNOAUQNOH-OAWCYKKTSA-N 2 0 220.360 2.334 20 0 BEADRP C=C/C=C/CC[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000713691410 712469306 /nfs/dbraw/zinc/46/93/06/712469306.db2.gz BJJDWECBBMIAPC-JQSFKPKSSA-N 2 0 208.349 2.191 20 0 BEADRP C=C/C=C/CC[N@@H+](C)CC[C@H]([NH3+])C(C)C ZINC000713736310 712470525 /nfs/dbraw/zinc/47/05/25/712470525.db2.gz TVYVSJCCSZIGSK-YBJDMEARSA-N 2 0 210.365 2.424 20 0 BEADRP C=C/C=C/CC[N@H+]1CCC[C@H](CC[NH3+])C1 ZINC000713729161 712470810 /nfs/dbraw/zinc/47/08/10/712470810.db2.gz AVBPUGFJUPAANG-ITDFMYJTSA-N 2 0 208.349 2.180 20 0 BEADRP C=C/C=C\CC[N@@H+]1CC[C@]2(C1)CCC[NH2+]C2 ZINC000713755448 712471778 /nfs/dbraw/zinc/47/17/78/712471778.db2.gz MZGCWFIZSJBIPL-VQTKUKTRSA-N 2 0 220.360 2.194 20 0 BEADRP C=C/C=C/CC[N@@H+]1CC[C@@]2(C1)CCC[NH2+]C2 ZINC000713755450 712471877 /nfs/dbraw/zinc/47/18/77/712471877.db2.gz MZGCWFIZSJBIPL-XGACYXMMSA-N 2 0 220.360 2.194 20 0 BEADRP CN(C[C@@H]1CCCC(C)(C)O1)CC(C)(C)[NH3+] ZINC000714330417 712481983 /nfs/dbraw/zinc/48/19/83/712481983.db2.gz KIMYQCFGTIYRAT-NSHDSACASA-N 2 0 228.380 2.003 20 0 BEADRP C[C@@H]1C[C@H]1C[NH+]1CCC(C(C)(C)C[NH3+])CC1 ZINC000714415668 712485582 /nfs/dbraw/zinc/48/55/82/712485582.db2.gz XQQBYPUXMGIFPS-NEPJUHHUSA-N 2 0 224.392 2.339 20 0 BEADRP C[C@H]1C[C@H]1C[NH+]1CCC(C(C)(C)C[NH3+])CC1 ZINC000714415673 712485664 /nfs/dbraw/zinc/48/56/64/712485664.db2.gz XQQBYPUXMGIFPS-RYUDHWBXSA-N 2 0 224.392 2.339 20 0 BEADRP CC[C@@H](C)[NH+]1CCC(C(C)(C)C[NH3+])CC1 ZINC000714408194 712485667 /nfs/dbraw/zinc/48/56/67/712485667.db2.gz CCEYQEHXVGBACQ-LLVKDONJSA-N 2 0 212.381 2.482 20 0 BEADRP CO[C@H]1C[C@H](C[NH2+][C@H]2C[C@@H]([NH3+])c3ccccc32)C1 ZINC000714708606 712496371 /nfs/dbraw/zinc/49/63/71/712496371.db2.gz WHUPMEWIDANCAV-FKGLVLAHSA-N 2 0 246.354 2.146 20 0 BEADRP C[C@H]([NH3+])[C@H]1CC[N@H+](CC[C@@H]2C[C@H]2C2CC2)C1 ZINC000714921313 712499977 /nfs/dbraw/zinc/49/99/77/712499977.db2.gz XMOYPQTVRBELLB-GHYVTOPFSA-N 2 0 222.376 2.092 20 0 BEADRP C(CC1CC1)CN1CCC[C@@H]2C[NH2+]CC[C@H]21 ZINC000714998311 712503322 /nfs/dbraw/zinc/50/33/22/712503322.db2.gz FYCLRGAEUKYYSV-ZIAGYGMSSA-N 2 0 222.376 2.251 20 0 BEADRP C[NH+](C)C1CCC([NH2+]C[C@@H]2CCC=CO2)CC1 ZINC000715489037 712522908 /nfs/dbraw/zinc/52/29/08/712522908.db2.gz BPNGUVAJPORTPP-RUXDESIVSA-N 2 0 238.375 2.142 20 0 BEADRP CO[C@H](C)[C@H](C)[NH2+]C1CCC(C)([NH+](C)C)CC1 ZINC000715511223 712524234 /nfs/dbraw/zinc/52/42/34/712524234.db2.gz UMFHELYOPGRIFD-MRFVTOPCSA-N 2 0 242.407 2.262 20 0 BEADRP COC[C@@H](C)C[NH2+]C1CCC(C)([NH+](C)C)CC1 ZINC000715511561 712524564 /nfs/dbraw/zinc/52/45/64/712524564.db2.gz WEAMJYNJVUDHCZ-HSBZDZAISA-N 2 0 242.407 2.121 20 0 BEADRP CO[C@@H]1CCC[C@@H]1[NH2+]C1CCC([NH+](C)C)CC1 ZINC000715551253 712528136 /nfs/dbraw/zinc/52/81/36/712528136.db2.gz HEFBLDNYNAFDHX-CLRIEMFWSA-N 2 0 240.391 2.016 20 0 BEADRP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+]C[C@@H]2C[C@H]3C[C@H]3C2)C1 ZINC000715563116 712528869 /nfs/dbraw/zinc/52/88/69/712528869.db2.gz URHDOBAVFDGCDE-XLWJZTARSA-N 2 0 236.403 2.495 20 0 BEADRP C[NH+](C)[C@@H]1CCC[C@H]([NH2+]C[C@@H]2C[C@H]3C[C@H]3C2)C1 ZINC000715563114 712528964 /nfs/dbraw/zinc/52/89/64/712528964.db2.gz URHDOBAVFDGCDE-AIEDFZFUSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@@H]([NH+](C)C)C2)CS1 ZINC000715572722 712529367 /nfs/dbraw/zinc/52/93/67/712529367.db2.gz MVADITPXZXVCFP-MROQNXINSA-N 2 0 242.432 2.343 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]CC[C@@H]2CCCS2)C1 ZINC000715751541 712531922 /nfs/dbraw/zinc/53/19/22/712531922.db2.gz FNNJPTKZVAAPMY-WOPDTQHZSA-N 2 0 228.405 2.132 20 0 BEADRP C[C@H]([NH2+]CC1CC[NH+](C)CC1)c1ccns1 ZINC000716046268 712548152 /nfs/dbraw/zinc/54/81/52/712548152.db2.gz GFUDTTFAIBHBFF-JTQLQIEISA-N 2 0 239.388 2.136 20 0 BEADRP C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000716585101 712564483 /nfs/dbraw/zinc/56/44/83/712564483.db2.gz RHPSWZASMPNWOJ-BYGOPZEFSA-N 2 0 236.403 2.351 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@H]1[C@H]1C[C@H]1C)[C@H]1CCC[NH2+]1 ZINC000716528240 712567106 /nfs/dbraw/zinc/56/71/06/712567106.db2.gz DIGXXSRXGWHEFE-YOVYLDAJSA-N 2 0 222.376 2.009 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@H]1[C@H]1C[C@H]1C)[C@H]1CCCC[NH2+]1 ZINC000716630918 712567955 /nfs/dbraw/zinc/56/79/55/712567955.db2.gz ATAGNTRXLCHCLL-PLJUSGQGSA-N 2 0 236.403 2.399 20 0 BEADRP C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000716648570 712568718 /nfs/dbraw/zinc/56/87/18/712568718.db2.gz DZEWDZFVIMTNBB-ZMNRPKMZSA-N 2 0 234.387 2.151 20 0 BEADRP C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C[NH2+][C@H]1C[C@@H]([NH3+])C12CCC2 ZINC000716668942 712568985 /nfs/dbraw/zinc/56/89/85/712568985.db2.gz SZVBGRLPSHOWDF-WNWFYDSVSA-N 2 0 234.387 2.138 20 0 BEADRP C[N@H+](CCCF)Cc1cccc2c1CC[NH2+]C2 ZINC000716770590 712572772 /nfs/dbraw/zinc/57/27/72/712572772.db2.gz YEFNZPUECMZUFG-UHFFFAOYSA-N 2 0 236.334 2.124 20 0 BEADRP C[N@H+](CCCF)Cc1ccc2c(c1)C[NH2+]CC2 ZINC000716770545 712572831 /nfs/dbraw/zinc/57/28/31/712572831.db2.gz XPCVUBNNBHQUBQ-UHFFFAOYSA-N 2 0 236.334 2.124 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]CC[C@@H]2CC[C@@H]3C[C@@H]32)C1 ZINC000717070528 712628206 /nfs/dbraw/zinc/62/82/06/712628206.db2.gz UGPSHJZTXRUHST-MQLXINIDSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@H]2C[NH2+]CCC2(F)F)C1 ZINC000717307101 712646222 /nfs/dbraw/zinc/64/62/22/712646222.db2.gz RYFDXWHGAFICJW-MXWKQRLJSA-N 2 0 232.318 2.009 20 0 BEADRP CC1(C)C[C@@H]([NH3+])C[C@@H]([NH2+]CCc2ccccn2)C1 ZINC000925494803 712696252 /nfs/dbraw/zinc/69/62/52/712696252.db2.gz MFWNLYJONDZXAS-GXTWGEPZSA-N 2 0 247.386 2.120 20 0 BEADRP CC[C@@H]1[C@@H](C)CC[N@@H+]1C[C@@H]1CC[C@H]([NH3+])C1 ZINC000717936757 712734341 /nfs/dbraw/zinc/73/43/41/712734341.db2.gz ZADJYYRMRJDQRX-QNWHQSFQSA-N 2 0 210.365 2.234 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]C2CCC=CCC2)C1 ZINC000718065932 712740984 /nfs/dbraw/zinc/74/09/84/712740984.db2.gz DRGGMGUPPJMTGF-DGCLKSJQSA-N 2 0 208.349 2.345 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CC[N@H+](CCCC(C)(F)F)C1 ZINC000718569761 712774757 /nfs/dbraw/zinc/77/47/57/712774757.db2.gz HMUWOMKMJAXMFJ-VHSXEESVSA-N 2 0 220.307 2.091 20 0 BEADRP CCOCc1ccccc1C[NH2+]C1CC[NH2+]CC1 ZINC000038041480 712801346 /nfs/dbraw/zinc/80/13/46/712801346.db2.gz SGVDREKKKYWDMR-UHFFFAOYSA-N 2 0 248.370 2.065 20 0 BEADRP CSCC1CC[NH+](CC2CC[NH2+]CC2)CC1 ZINC000719308048 712804253 /nfs/dbraw/zinc/80/42/53/712804253.db2.gz SEWMGEZBBMPYQR-UHFFFAOYSA-N 2 0 242.432 2.061 20 0 BEADRP CC[C@@H](CC(F)F)C[N@@H+]1C[C@@H]2C[NH2+]C[C@]2(C)C1 ZINC000720850271 712870942 /nfs/dbraw/zinc/87/09/42/712870942.db2.gz PDCCVHOSZDDIIM-GMXVVIOVSA-N 2 0 246.345 2.209 20 0 BEADRP CC1(C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)CC(F)(F)C1 ZINC000720914193 712877844 /nfs/dbraw/zinc/87/78/44/712877844.db2.gz ZURGAUDYIOXEOR-NXEZZACHSA-N 2 0 232.318 2.281 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH+]2C[C@@H]3CCC[C@H]3C2)C1 ZINC001208603362 957092596 /nfs/dbraw/zinc/09/25/96/957092596.db2.gz BYPRICAZJBJWSX-IHRRRGAJSA-N 2 0 222.376 2.060 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[N@@H+]2CCC[C@@H](C3CCC3)C2)C1 ZINC000692980157 957205570 /nfs/dbraw/zinc/20/55/70/957205570.db2.gz SMUOWSQKTGFRGB-BNOWGMLFSA-N 2 0 222.376 2.236 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@@H](C)CN1c1cc2[nH]ccc2c[nH+]1 ZINC001164633112 719162204 /nfs/dbraw/zinc/16/22/04/719162204.db2.gz GQCPUZRVXALSJZ-WDEREUQCSA-N 2 0 244.342 2.092 20 0 BEADRP C[C@H]([NH2+]C[C@@]12C[C@@H]1CCCC2)[C@@H]1CCC[NH2+]1 ZINC000693569805 958864878 /nfs/dbraw/zinc/86/48/78/958864878.db2.gz WPRCYSDAVYEGLZ-XDQVBPFNSA-N 2 0 222.376 2.297 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[N@H+](C)CC1COC1 ZINC001167836813 961218649 /nfs/dbraw/zinc/21/86/49/961218649.db2.gz HPELDGUJRHEVKC-ZDUSSCGKSA-N 2 0 242.407 2.075 20 0 BEADRP CC[C@H](C)CC[NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23 ZINC000696217390 961873156 /nfs/dbraw/zinc/87/31/56/961873156.db2.gz NVIGNSDHUUJLGU-BSCCGWMCSA-N 2 0 222.376 2.009 20 0 BEADRP C[C@H]1C[C@H]([NH2+][C@H]2CC[C@H]([NH+](C)C)CC2)CCO1 ZINC001168091937 963686080 /nfs/dbraw/zinc/68/60/80/963686080.db2.gz CRQOQLCAKZPSIV-FQUUOJAGSA-N 2 0 240.391 2.016 20 0 BEADRP C[NH+](C)C1CCC([N@@H+]2CCCC23CC3)CC1 ZINC001168315747 964418904 /nfs/dbraw/zinc/41/89/04/964418904.db2.gz MYLSQEFQYZKCAG-UHFFFAOYSA-N 2 0 222.376 2.488 20 0 BEADRP C[C@@H](CC[NH2+][C@@H]1CCC(C)(C)C1)[NH+](C)C ZINC000697879256 964603001 /nfs/dbraw/zinc/60/30/01/964603001.db2.gz NEGORBXNZKGEKB-NWDGAFQWSA-N 2 0 212.381 2.495 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@H]2CC[C@@H]2C)CC1 ZINC000380034507 964940902 /nfs/dbraw/zinc/94/09/02/964940902.db2.gz RKILNQSHPJWLOO-AAEUAGOBSA-N 2 0 210.365 2.106 20 0 BEADRP [NH3+]CCCO[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000211333700 1165794509 /nfs/dbraw/zinc/79/45/09/1165794509.db2.gz LJGCIXLPUZYBJN-OAHLLOKOSA-N 2 0 248.370 2.016 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@](C)([NH3+])CC2)o1 ZINC001205255145 967438625 /nfs/dbraw/zinc/43/86/25/967438625.db2.gz HHOAHIISZDWRLB-ZDUSSCGKSA-N 2 0 222.332 2.291 20 0 BEADRP CC/C=C\CC[N@@H+]1CCC(F)(F)[C@H](C[NH3+])C1 ZINC001205735947 967809879 /nfs/dbraw/zinc/80/98/79/967809879.db2.gz SCXXNWBHHJOBKP-DLRQAJBASA-N 2 0 232.318 2.259 20 0 BEADRP CCOC(C)(C)C[N@@H+]1CCC[C@@H](C[NH3+])[C@@H](C)C1 ZINC001205982593 967936330 /nfs/dbraw/zinc/93/63/30/967936330.db2.gz MMAPRRONMHICOK-STQMWFEESA-N 2 0 242.407 2.108 20 0 BEADRP Clc1ccc(C[NH2+]C[C@H]2CC[NH2+]C2)s1 ZINC000070600358 1165929569 /nfs/dbraw/zinc/92/95/69/1165929569.db2.gz BRDYWJHINPVFOF-QMMMGPOBSA-N 2 0 230.764 2.101 20 0 BEADRP C[C@]1(C[NH3+])CCCC[N@H+](C[C@H]2CCCCO2)C1 ZINC001206542015 968353886 /nfs/dbraw/zinc/35/38/86/968353886.db2.gz PEVATNWFQNBGIR-ZIAGYGMSSA-N 2 0 240.391 2.006 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]CC1(C)COC1 ZINC000079472647 1166018040 /nfs/dbraw/zinc/01/80/40/1166018040.db2.gz FLUUIWIMUWZOPM-CYBMUJFWSA-N 2 0 242.407 2.123 20 0 BEADRP CC[N@H+](CC[C@@H]1CC[NH2+]C1)CC(C)(C)C ZINC000389602821 1166032485 /nfs/dbraw/zinc/03/24/85/1166032485.db2.gz VYXANIFCJRERRA-LBPRGKRZSA-N 2 0 212.381 2.354 20 0 BEADRP CCCC1CC[NH+](C[C@@H]2C[NH2+]C[C@H]2C)CC1 ZINC000082560838 1166058388 /nfs/dbraw/zinc/05/83/88/1166058388.db2.gz NZWDNQSQVQSEQW-OCCSQVGLSA-N 2 0 224.392 2.354 20 0 BEADRP C[NH+]1CCC(CC[NH+]2CC3(CCC3)C2)CC1 ZINC001207481272 968797545 /nfs/dbraw/zinc/79/75/45/968797545.db2.gz AIPDTYJGORHVAR-UHFFFAOYSA-N 2 0 222.376 2.204 20 0 BEADRP C[C@H]1CCC[N@H+](C[C@@H]2CCCC[NH2+]C2)CC1 ZINC000829276002 968829850 /nfs/dbraw/zinc/82/98/50/968829850.db2.gz RLPKSISKKRXXLQ-UONOGXRCSA-N 2 0 224.392 2.498 20 0 BEADRP CC[NH+]1CCC(C[NH+]2CC3(CCC3)C2)CC1 ZINC001208592276 969147832 /nfs/dbraw/zinc/14/78/32/969147832.db2.gz GSBCOOVDPGOOTG-UHFFFAOYSA-N 2 0 222.376 2.204 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+]C2CCC3(CC3)CC2)C1 ZINC000693561432 1166245863 /nfs/dbraw/zinc/24/58/63/1166245863.db2.gz GTGOXNIUUOTHGB-PHIMTYICSA-N 2 0 208.349 2.036 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2CCCC23CC3)CC1 ZINC001208594829 969150700 /nfs/dbraw/zinc/15/07/00/969150700.db2.gz OIAQNACWXPDKNP-UHFFFAOYSA-N 2 0 222.376 2.347 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2CCC[C@@H](F)C2)CC1 ZINC001208599421 969151912 /nfs/dbraw/zinc/15/19/12/969151912.db2.gz HKBLOCYQFLJSHJ-CYBMUJFWSA-N 2 0 228.355 2.152 20 0 BEADRP CC(C)CCC[N@@H+]1C[C@H]2CC[NH+](C)C[C@H]2C1 ZINC001208733581 969223823 /nfs/dbraw/zinc/22/38/23/969223823.db2.gz TYTVZSGHUYDBGT-KGLIPLIRSA-N 2 0 224.392 2.306 20 0 BEADRP CCC[N@H+](CCC[NH3+])[C@@H]1CCC[C@@H](OC)C1 ZINC000226539028 1166288092 /nfs/dbraw/zinc/28/80/92/1166288092.db2.gz QBEYDSJLKQOUCJ-CHWSQXEVSA-N 2 0 228.380 2.005 20 0 BEADRP CC(C)[C@@H](C[NH3+])C[N@@H+]1CCC[C@@H]1C(C)C ZINC000226560300 1166295703 /nfs/dbraw/zinc/29/57/03/1166295703.db2.gz UBQHAICHLBADPT-QWHCGFSZSA-N 2 0 212.381 2.338 20 0 BEADRP C[C@@H]1C[C@H]([N@H+](C)CCC[NH3+])CC(C)(C)C1 ZINC000227741939 1166306978 /nfs/dbraw/zinc/30/69/78/1166306978.db2.gz JKIWMZIRWASWGS-NEPJUHHUSA-N 2 0 212.381 2.482 20 0 BEADRP CCCC[C@@H](CC)C[N@@H+]1C[C@@H](C)[C@H]([NH3+])C1 ZINC000723469976 969318354 /nfs/dbraw/zinc/31/83/54/969318354.db2.gz KMWXUIZMOBEUDE-JHJVBQTASA-N 2 0 212.381 2.482 20 0 BEADRP CN(CCOc1ccccc1)[C@@H]1CCCC[C@@H]1[NH3+] ZINC000158581926 1166412134 /nfs/dbraw/zinc/41/21/34/1166412134.db2.gz ZMXDIYJNVJILBA-LSDHHAIUSA-N 2 0 248.370 2.267 20 0 BEADRP CC(C)(C)CC[N@@H+]1C[C@@H]2CCC[C@@H]([NH3+])[C@@H]2C1 ZINC000228534100 1166414131 /nfs/dbraw/zinc/41/41/31/1166414131.db2.gz AWRUHZQSYDDKOA-YNEHKIRRSA-N 2 0 224.392 2.482 20 0 BEADRP CCC(CC)C[N@@H+]1CC[C@@H]2[NH2+]CCC[C@H]2C1 ZINC000250783394 1166429777 /nfs/dbraw/zinc/42/97/77/1166429777.db2.gz UNRGAQPCHRQAEI-KBPBESRZSA-N 2 0 224.392 2.497 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH+]2CCC23CCCC3)CC1 ZINC001254520687 969695495 /nfs/dbraw/zinc/69/54/95/969695495.db2.gz PGFFFOPLYLCTIX-CYBMUJFWSA-N 2 0 222.376 2.489 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH+]2CCC[C@H](CF)C2)CC1 ZINC001254524663 969716861 /nfs/dbraw/zinc/71/68/61/969716861.db2.gz YIOFIXUNOWACDW-CHWSQXEVSA-N 2 0 228.355 2.152 20 0 BEADRP Cc1cc(NC(C)(C)CC[NH+](C)C)nc(C)n1 ZINC001169710925 969830115 /nfs/dbraw/zinc/83/01/15/969830115.db2.gz AULRDFGQDTZFPL-UHFFFAOYSA-N 2 0 236.363 2.236 20 0 BEADRP CCCC[C@H](CC)[N@@H+]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000309409524 1166540846 /nfs/dbraw/zinc/54/08/46/1166540846.db2.gz KABQJUBGNWPMEC-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP [NH3+]CCC[C@@H]1CCCC[N@@H+]([C@@H]2CCSC2)C1 ZINC001255280326 970032988 /nfs/dbraw/zinc/03/29/88/970032988.db2.gz YYUDMKSOSWSDCI-QWHCGFSZSA-N 2 0 242.432 2.333 20 0 BEADRP C[NH2+]CCNc1ccc2c[nH+]c(C)cc2c1 ZINC001167727064 1166628951 /nfs/dbraw/zinc/62/89/51/1166628951.db2.gz STMIPOMCBXOASU-UHFFFAOYSA-N 2 0 215.300 2.175 20 0 BEADRP COC[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH3+])cc1 ZINC000396138884 1166652113 /nfs/dbraw/zinc/65/21/13/1166652113.db2.gz OXJPVMVRVFYALT-HNNXBMFYSA-N 2 0 248.370 2.146 20 0 BEADRP C[C@H]1C[N@H+](CCC2CCCC2)CC[C@H]1C[NH3+] ZINC000300719218 970298053 /nfs/dbraw/zinc/29/80/53/970298053.db2.gz AUMLOZMBKJYSCR-JSGCOSHPSA-N 2 0 224.392 2.483 20 0 BEADRP CCc1ccc(C[N@H+](C)CC2CC[NH2+]CC2)nc1 ZINC000379279792 1166699162 /nfs/dbraw/zinc/69/91/62/1166699162.db2.gz QBXZMGMCVXFPKM-UHFFFAOYSA-N 2 0 247.386 2.075 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)n1ccnc1[C@@H](C)[NH3+] ZINC001255940629 970568043 /nfs/dbraw/zinc/56/80/43/970568043.db2.gz FDPYJEAWEMCGBA-VXGBXAGGSA-N 2 0 238.379 2.196 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]C1(COC)CCC1 ZINC001255942276 970575938 /nfs/dbraw/zinc/57/59/38/970575938.db2.gz FBJZACWFOSZOHX-ZDUSSCGKSA-N 2 0 242.407 2.266 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+][C@@H]1CC1(C)C ZINC001255948180 970582654 /nfs/dbraw/zinc/58/26/54/970582654.db2.gz GRJUMIRHSWVGTJ-VXGBXAGGSA-N 2 0 212.381 2.495 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+][C@H]1CCOC[C@@H]1C ZINC001255948097 970583855 /nfs/dbraw/zinc/58/38/55/970583855.db2.gz DYJCSMHPZPFWJY-IHRRRGAJSA-N 2 0 242.407 2.121 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+][C@@H]1C[C@H]1C1CC1 ZINC001255954453 970588063 /nfs/dbraw/zinc/58/80/63/970588063.db2.gz DSRGRQFTQFCXJE-FPMFFAJLSA-N 2 0 224.392 2.495 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH+]1CCC(OC)CC1 ZINC001255955165 970591275 /nfs/dbraw/zinc/59/12/75/970591275.db2.gz PHFHOTBKSXKENI-ZDUSSCGKSA-N 2 0 242.407 2.218 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[N@@H+]1C[C@@H]2C[C@@H]2C1 ZINC001255957638 970597373 /nfs/dbraw/zinc/59/73/73/970597373.db2.gz UAHHAURNUZOCAP-RWMBFGLXSA-N 2 0 210.365 2.059 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[N@H+](CCOC)C(C)C ZINC001255959963 970601785 /nfs/dbraw/zinc/60/17/85/970601785.db2.gz BZOLWEOVDNSTOB-CQSZACIVSA-N 2 0 244.423 2.464 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]Cc1ccc2c(c1)C[C@@H](C)O2 ZINC000925829542 1166879516 /nfs/dbraw/zinc/87/95/16/1166879516.db2.gz CKSVZUYSRFPBBL-SDDRHHMPSA-N 2 0 248.370 2.225 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]Cc1ccc2c(c1)C[C@H](C)O2 ZINC000925829545 1166879625 /nfs/dbraw/zinc/87/96/25/1166879625.db2.gz CKSVZUYSRFPBBL-SRVKXCTJSA-N 2 0 248.370 2.225 20 0 BEADRP C[N@@H+]1CCC[C@@H](CC[NH2+][C@@H]2C[C@H]3C[C@H]3C2)C1 ZINC001167898230 1166899200 /nfs/dbraw/zinc/89/92/00/1166899200.db2.gz QDGXRGHPYIDNCU-FQUUOJAGSA-N 2 0 222.376 2.106 20 0 BEADRP CSCC[C@H](C)[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000401025309 970655943 /nfs/dbraw/zinc/65/59/43/970655943.db2.gz NGHNGPMZJSSWRT-QNWHQSFQSA-N 2 0 242.432 2.106 20 0 BEADRP C[C@@H]1CC[C@@H]([N@@H+]2CCC3(CCCC3)C2)C[NH2+]1 ZINC000304428691 1166917313 /nfs/dbraw/zinc/91/73/13/1166917313.db2.gz SDZDPUKCZQAGQD-CHWSQXEVSA-N 2 0 222.376 2.393 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2CCC3(CCCC3)C2)C[NH2+]1 ZINC000304428692 1166917843 /nfs/dbraw/zinc/91/78/43/1166917843.db2.gz SDZDPUKCZQAGQD-OLZOCXBDSA-N 2 0 222.376 2.393 20 0 BEADRP CN1CCC([N@@H+]2CCC[C@H](C(F)F)C2)CC1 ZINC001256207390 970715107 /nfs/dbraw/zinc/71/51/07/970715107.db2.gz HJIUHWZTWWLNIQ-JTQLQIEISA-N 2 0 232.318 2.058 20 0 BEADRP CC[C@@H]1CC[C@@H]([N@H+](C)CCC[NH+](C)C)C1 ZINC001173275528 975087026 /nfs/dbraw/zinc/08/70/26/975087026.db2.gz VUDICFJFSNUHIK-CHWSQXEVSA-N 2 0 212.381 2.449 20 0 BEADRP CCSC[C@H](C)[NH+]1CCC2(C[NH+](C)C2)CC1 ZINC001173315282 975305515 /nfs/dbraw/zinc/30/55/15/975305515.db2.gz OVRNHXOKAFYESI-LBPRGKRZSA-N 2 0 242.432 2.156 20 0 BEADRP C(C[N@@H+]1C[C@@H]2CC[NH2+]C[C@H]2C1)C1CCCCC1 ZINC000310407041 1167105274 /nfs/dbraw/zinc/10/52/74/1167105274.db2.gz OKNLORWCPXABKS-GJZGRUSLSA-N 2 0 236.403 2.498 20 0 BEADRP CC(C)[N@@H+](C)C[C@H](C)Nc1cc[nH+]cc1 ZINC000309124175 1167254160 /nfs/dbraw/zinc/25/41/60/1167254160.db2.gz VOGLNDSZKYWUCL-NSHDSACASA-N 2 0 207.321 2.222 20 0 BEADRP CC[C@H](C)[NH2+][C@@H]1CC[N@@H+](C(C)C)C[C@H]1C ZINC000309236976 1167271484 /nfs/dbraw/zinc/27/14/84/1167271484.db2.gz XSKHLAYIAOYXFS-FRRDWIJNSA-N 2 0 212.381 2.493 20 0 BEADRP C[C@H]1C[C@H](C)C[NH+](C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000309348286 1167293625 /nfs/dbraw/zinc/29/36/25/1167293625.db2.gz MTYKLAZXLVDAAH-CSHRUCKSSA-N 2 0 222.376 2.247 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH2+]CC2CC(C)(C)C2)CC1 ZINC000309614618 1167333072 /nfs/dbraw/zinc/33/30/72/1167333072.db2.gz CIZQKKJZYMRWPX-CYBMUJFWSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1C[C@H]([N@@H+]2CC[C@@]3(CC[NH2+]C3)C2)C[C@@H](C)C1 ZINC000310143888 1167422978 /nfs/dbraw/zinc/42/29/78/1167422978.db2.gz DUSUNTAUQCIRJV-CBBWQLFWSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@H]2CC[N@H+](C)C2)C[C@@H]1C ZINC000251799932 1167458540 /nfs/dbraw/zinc/45/85/40/1167458540.db2.gz LXQXEXNCOGRKQX-RQJABVFESA-N 2 0 224.392 2.352 20 0 BEADRP C[NH2+]C[C@@H]1CCC[N@@H+]([C@@H]2CCC[C@H](C)C2)C1 ZINC000251931655 1167465452 /nfs/dbraw/zinc/46/54/52/1167465452.db2.gz VJDBPCSZJZHVFS-MELADBBJSA-N 2 0 224.392 2.497 20 0 BEADRP CCC[N@H+](CC1CC[NH2+]CC1)[C@@H](C)CC ZINC000086701982 1167640475 /nfs/dbraw/zinc/64/04/75/1167640475.db2.gz JTFNNRSGNRGPTC-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP C[NH2+][C@@]12CC[C@@]([NH2+]CCOC(C)C)(C1)CCC2 ZINC001277658624 978047341 /nfs/dbraw/zinc/04/73/41/978047341.db2.gz VJEYRGXBYMQYJC-UONOGXRCSA-N 2 0 240.391 2.066 20 0 BEADRP C[C@@]1(C[NH3+])CCC[N@H+](C[C@@H]2CCC=CO2)CC1 ZINC001206293279 978291755 /nfs/dbraw/zinc/29/17/55/978291755.db2.gz GYCVALYSUFTMPZ-UONOGXRCSA-N 2 0 238.375 2.130 20 0 BEADRP [NH3+]CCCC[N@@H+]1CCOC[C@@H]1C1CCCCC1 ZINC001236432617 1168225989 /nfs/dbraw/zinc/22/59/89/1168225989.db2.gz ACQXYQFTYUEPBQ-CQSZACIVSA-N 2 0 240.391 2.006 20 0 BEADRP CCCCCC[C@@H](C)[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC000085282014 1168323858 /nfs/dbraw/zinc/32/38/58/1168323858.db2.gz LTWBYZHNBNIHMC-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP C(C[N@@H+]1CCCC[C@]12CC[NH2+]C2)C1CC1 ZINC000257653985 1168335663 /nfs/dbraw/zinc/33/56/63/1168335663.db2.gz DYQIHSAJEAAOMH-CYBMUJFWSA-N 2 0 208.349 2.005 20 0 BEADRP Cc1c(Cl)cccc1CN(C)C[C@H](C)[NH3+] ZINC001236907797 979793153 /nfs/dbraw/zinc/79/31/53/979793153.db2.gz GUEINWRMPUGWJU-VIFPVBQESA-N 2 0 226.751 2.427 20 0 BEADRP C[C@H]1CCC[C@@H]([NH2+]C[C@@H]2CC[N@H+](C)C2)C1 ZINC000037484636 1168418466 /nfs/dbraw/zinc/41/84/66/1168418466.db2.gz BBTVVGXGKRDVLS-RWMBFGLXSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1c2sccc2CC[N@H+]1CCC[NH3+] ZINC000712269299 1168423956 /nfs/dbraw/zinc/42/39/56/1168423956.db2.gz ZTPLQBFOYCCVEQ-SECBINFHSA-N 2 0 210.346 2.016 20 0 BEADRP [NH3+]CC1(Cc2cccc(Cl)c2)CC[NH2+]CC1 ZINC001239325184 980533219 /nfs/dbraw/zinc/53/32/19/980533219.db2.gz YSISLGYSESLBMG-UHFFFAOYSA-N 2 0 238.762 2.211 20 0 BEADRP CC[C@@H](Cc1cccs1)[NH2+]CCCC[NH3+] ZINC001345482984 980617779 /nfs/dbraw/zinc/61/77/79/980617779.db2.gz PTTVKUKCNYEUJS-NSHDSACASA-N 2 0 226.389 2.398 20 0 BEADRP CC(C)CC[N@@H+]1CCCC[C@@]12CC[NH2+]C2 ZINC000257690695 1168599815 /nfs/dbraw/zinc/59/98/15/1168599815.db2.gz NMBYORZWJSDGEV-ZDUSSCGKSA-N 2 0 210.365 2.251 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@H]1Cc2cccc(Cl)c2C1 ZINC001246316264 1168633270 /nfs/dbraw/zinc/63/32/70/1168633270.db2.gz YRMROBHFATUPOR-MNOVXSKESA-N 2 0 238.762 2.134 20 0 BEADRP CO[C@@H]1CC[C@@H]([NH2+][C@H]2CC[N@H+](C)C(C)(C)C2)C1 ZINC001348100597 981281872 /nfs/dbraw/zinc/28/18/72/981281872.db2.gz YFSFFZCTDWMZJU-FRRDWIJNSA-N 2 0 240.391 2.016 20 0 BEADRP CC[C@H](C)C[N@@H+]1CC[C@H](C)[C@@H](C[NH3+])CC1 ZINC001205605135 1168791011 /nfs/dbraw/zinc/79/10/11/1168791011.db2.gz ZFSKTNUGBGMHML-RWMBFGLXSA-N 2 0 212.381 2.339 20 0 BEADRP C[C@H]1C[C@H]1C[NH+]1CCC2(CCC[N@H+](C)C2)CC1 ZINC001276034155 1169064450 /nfs/dbraw/zinc/06/44/50/1169064450.db2.gz RFFDYTGSCGCPMB-KBPBESRZSA-N 2 0 236.403 2.450 20 0 BEADRP CCCC[C@H](O)C[NH2+]CCC[NH+]1CCCCC1 ZINC001252110947 983686098 /nfs/dbraw/zinc/68/60/98/983686098.db2.gz QPXBNOSJADPXOQ-AWEZNQCLSA-N 2 0 242.407 2.003 20 0 BEADRP CO[C@H]1CC[C@@H](C)[N@H+](CCCCCCC[NH3+])C1 ZINC000687197958 1169122260 /nfs/dbraw/zinc/12/22/60/1169122260.db2.gz UXZMLYLYFISVFH-KGLIPLIRSA-N 2 0 242.407 2.395 20 0 BEADRP CCOCC[C@H](C)[NH2+]CCC[NH+]1CCCCC1 ZINC001172412260 974678538 /nfs/dbraw/zinc/67/85/38/974678538.db2.gz SALFPIHUTPONMF-AWEZNQCLSA-N 2 0 242.407 2.267 20 0 BEADRP CCOCC[C@@H](C)[NH2+]CCCCCCC[NH3+] ZINC001172419223 974690595 /nfs/dbraw/zinc/69/05/95/974690595.db2.gz JNIDTJRJHDMERR-CYBMUJFWSA-N 2 0 230.396 2.300 20 0 BEADRP CC(C)OCC[C@@H](C)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC001172439083 974795254 /nfs/dbraw/zinc/79/52/54/974795254.db2.gz XSMKMYPTGNXKDR-ZIAGYGMSSA-N 2 0 242.407 2.121 20 0 BEADRP CC(C)OCC[C@H](C)[NH+]1CCC(C)([NH3+])CC1 ZINC001172443913 974805111 /nfs/dbraw/zinc/80/51/11/974805111.db2.gz SSJLCHHWADFNGV-LBPRGKRZSA-N 2 0 228.380 2.003 20 0 BEADRP CC(C)COCC[C@@H](C)[NH+]1CCC(C)([NH3+])CC1 ZINC001172461406 974826325 /nfs/dbraw/zinc/82/63/25/974826325.db2.gz GLFKKGCAHNDOFY-CYBMUJFWSA-N 2 0 242.407 2.251 20 0 BEADRP CCCCC[C@H](C)[N@@H+]1CCC[C@@](O)(C[NH3+])CC1 ZINC001246545974 972659618 /nfs/dbraw/zinc/65/96/18/972659618.db2.gz XUBJYZWDTIIYLM-KBPBESRZSA-N 2 0 242.407 2.131 20 0 BEADRP C[C@H](CC1CC1)[N@@H+]1CCC(F)(F)[C@H](C[NH3+])C1 ZINC001246560411 972793898 /nfs/dbraw/zinc/79/38/98/972793898.db2.gz ULPMPFLRVLILIC-MWLCHTKSSA-N 2 0 232.318 2.091 20 0 BEADRP CC(C)C[C@H](C)C[C@@H](C)[N@H+]1C[C@@H]2[C@H]([NH3+])[C@@H]2C1 ZINC001246666656 973072479 /nfs/dbraw/zinc/07/24/79/973072479.db2.gz WVMYHYMFPFBHBB-VJTDZRGJSA-N 2 0 224.392 2.336 20 0 BEADRP CSCC[C@@H](C)[N@H+]1C[C@@H]2CC[NH2+]CC[C@@H]2C1 ZINC001246933135 973595590 /nfs/dbraw/zinc/59/55/90/973595590.db2.gz QQMMEJKBCNSAJL-UPJWGTAASA-N 2 0 242.432 2.059 20 0 BEADRP C[C@@H](Cc1ccccn1)[N@H+](C)C1CCC([NH3+])CC1 ZINC001256399649 970806274 /nfs/dbraw/zinc/80/62/74/970806274.db2.gz QPVZLZAONYSICO-OPFPJEHXSA-N 2 0 247.386 2.214 20 0 BEADRP CO[C@H]1C[C@@H]([NH2+]C2CC[NH+](C(C)(C)C)CC2)C1 ZINC001256561365 970861902 /nfs/dbraw/zinc/86/19/02/970861902.db2.gz GBNLTEYASLLFTK-BETUJISGSA-N 2 0 240.391 2.016 20 0 BEADRP CC(C)(C)[NH+]1CCC([NH2+][C@]2(C)CCOC2)CC1 ZINC001256566161 970862995 /nfs/dbraw/zinc/86/29/95/970862995.db2.gz IUQDEXLODTWERZ-CQSZACIVSA-N 2 0 240.391 2.018 20 0 BEADRP C[NH+]1CCC2(C[NH+](Cc3ccc(F)cc3)C2)CC1 ZINC001203915605 1169470123 /nfs/dbraw/zinc/47/01/23/1169470123.db2.gz VXUPRCIUEYSQJF-UHFFFAOYSA-N 2 0 248.345 2.353 20 0 BEADRP C[C@H]1CCC[N@@H+](C2C[C@H]3CC[C@@H](C2)[NH+]3C)C1 ZINC001256621154 970887440 /nfs/dbraw/zinc/88/74/40/970887440.db2.gz LGOKUHAUQIJXDM-ICIURTGMSA-N 2 0 222.376 2.344 20 0 BEADRP CC1CC[NH+](C2C[C@H]3CC[C@@H](C2)[N@H+]3C)CC1 ZINC001256621591 970887843 /nfs/dbraw/zinc/88/78/43/970887843.db2.gz XSJFPIJDTYLEML-PBWFPOADSA-N 2 0 222.376 2.344 20 0 BEADRP CCCCCC[N@@H+]1CCC(F)(F)[C@H](C[NH3+])C1 ZINC000403174067 970894221 /nfs/dbraw/zinc/89/42/21/970894221.db2.gz OGNBLWYPWUIXSL-LLVKDONJSA-N 2 0 234.334 2.483 20 0 BEADRP C[C@@H](Cc1ccncc1)[NH2+][C@H]1CCC[N@H+](C)CC1 ZINC001256721753 970941146 /nfs/dbraw/zinc/94/11/46/970941146.db2.gz UTTNUTXIDOGEHI-ZFWWWQNUSA-N 2 0 247.386 2.087 20 0 BEADRP CCC1CCC([NH2+]CCSCC[NH3+])CC1 ZINC001256868341 971003170 /nfs/dbraw/zinc/00/31/70/971003170.db2.gz QJPVVUYKSXVUOM-UHFFFAOYSA-N 2 0 230.421 2.237 20 0 BEADRP C(=C/C1CC[NH2+]CC1)\c1cccn2c[nH+]cc12 ZINC001243895986 971018024 /nfs/dbraw/zinc/01/80/24/971018024.db2.gz BBLTWJJPYHHTKP-ONEGZZNKSA-N 2 0 227.311 2.347 20 0 BEADRP C[C@H]1C[C@@H](CF)[N@H+](CC2(C)CC[NH+](C)CC2)C1 ZINC001208107788 1169502777 /nfs/dbraw/zinc/50/27/77/1169502777.db2.gz KKWMLLBXTVSFNY-STQMWFEESA-N 2 0 242.382 2.398 20 0 BEADRP C[N@@H+]1CCc2cc(C3=C[NH2+]CCC3)ccc2C1 ZINC001243950582 971043779 /nfs/dbraw/zinc/04/37/79/971043779.db2.gz GWNCQGNMYFRLJP-UHFFFAOYSA-N 2 0 228.339 2.399 20 0 BEADRP C[C@H]1CC([NH2+]C(C)(C)CC[NH+](C)C)C[C@H](C)O1 ZINC001257082231 971078252 /nfs/dbraw/zinc/07/82/52/971078252.db2.gz WSTFDXUUCVARPW-RYUDHWBXSA-N 2 0 242.407 2.262 20 0 BEADRP CC(C)[NH+]1CCC(n2ccc3c2CC[NH2+]C3)CC1 ZINC001257223947 971135810 /nfs/dbraw/zinc/13/58/10/971135810.db2.gz JSZRHHBCSPMIKU-UHFFFAOYSA-N 2 0 247.386 2.179 20 0 BEADRP C[C@@H]1CCC[N@H+](C/C=C/Cl)[C@@H]1CC[NH3+] ZINC000404368522 971157876 /nfs/dbraw/zinc/15/78/76/971157876.db2.gz QEZLGAGLQVDZBW-NNPIPJJVSA-N 2 0 216.756 2.188 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]C2CCCCC2)C12CCC2 ZINC000404751814 971181932 /nfs/dbraw/zinc/18/19/32/971181932.db2.gz JFFMDPVMCWVFQR-RYUDHWBXSA-N 2 0 208.349 2.179 20 0 BEADRP CC1(C)[C@H]([NH3+])C[C@H]1[NH2+]CCc1cccs1 ZINC000404842972 971185198 /nfs/dbraw/zinc/18/51/98/971185198.db2.gz CHPDXWHVAMUQDX-GHMZBOCLSA-N 2 0 224.373 2.006 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]CCc2ccsc2)C12CCC2 ZINC000405227241 971211705 /nfs/dbraw/zinc/21/17/05/971211705.db2.gz DRRDIZXAZFHNGX-NEPJUHHUSA-N 2 0 236.384 2.150 20 0 BEADRP CCC[C@H](C)[NH+]1CCC([NH3+])(CCOC)CC1 ZINC001257314768 971214260 /nfs/dbraw/zinc/21/42/60/971214260.db2.gz ZIVPMVOJALBJRC-LBPRGKRZSA-N 2 0 228.380 2.005 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]CCc2ccccc2)C12CCC2 ZINC000405247932 971219825 /nfs/dbraw/zinc/21/98/25/971219825.db2.gz IFRLGQSHKLTBBN-KBPBESRZSA-N 2 0 230.355 2.089 20 0 BEADRP Cc1cc(C)c(C[NH2+][C@H]2C[C@H]([NH3+])C23CCC3)cn1 ZINC000405245380 971220065 /nfs/dbraw/zinc/22/00/65/971220065.db2.gz ZNYQMULKRXUBJN-KBPBESRZSA-N 2 0 245.370 2.058 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]CCCc2ccccc2)C12CCC2 ZINC000405232927 971216539 /nfs/dbraw/zinc/21/65/39/971216539.db2.gz BVWQHFSMHLEOLC-HUUCEWRRSA-N 2 0 244.382 2.479 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+][C@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405265063 971221585 /nfs/dbraw/zinc/22/15/85/971221585.db2.gz PCSPCOPVOJCMJF-XQHKEYJVSA-N 2 0 222.376 2.425 20 0 BEADRP C[C@H](Cc1ccco1)[NH2+][C@H]1C[C@H]([NH3+])C12CCC2 ZINC000405282329 971224030 /nfs/dbraw/zinc/22/40/30/971224030.db2.gz CHNARPUXLOHGKV-WXHSDQCUSA-N 2 0 234.343 2.070 20 0 BEADRP CCC[C@H](C)[N@H+](CCOC)C1CCN(C)CC1 ZINC001257321747 971224893 /nfs/dbraw/zinc/22/48/93/971224893.db2.gz VWYCIIKXVSJMKM-ZDUSSCGKSA-N 2 0 242.407 2.218 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+]CC(C2CC2)C2CC2)C12CCC2 ZINC000405282574 971224965 /nfs/dbraw/zinc/22/49/65/971224965.db2.gz CKNPDFFIZXTCJB-UONOGXRCSA-N 2 0 234.387 2.282 20 0 BEADRP CCC[C@@H](C)[N@H+]1C[C@H]2C[NH+](CCC)C[C@H]2C1 ZINC001257327069 971226156 /nfs/dbraw/zinc/22/61/56/971226156.db2.gz GEVPISPEIPQVKA-MCIONIFRSA-N 2 0 224.392 2.449 20 0 BEADRP Cc1cscc1C[NH2+][C@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405293348 971227128 /nfs/dbraw/zinc/22/71/28/971227128.db2.gz ZGLDRFBPNLVNME-NEPJUHHUSA-N 2 0 236.384 2.416 20 0 BEADRP CSC1(C[NH2+][C@@H]2C[C@H]([NH3+])C23CCC3)CCC1 ZINC000405281384 971227492 /nfs/dbraw/zinc/22/74/92/971227492.db2.gz ZPYASJRWRYRHFP-WDEREUQCSA-N 2 0 240.416 2.132 20 0 BEADRP CCC[C@H](C)[NH+]1C[C@@H]2C[NH+](CCC)C[C@H]2C1 ZINC001257327068 971227865 /nfs/dbraw/zinc/22/78/65/971227865.db2.gz GEVPISPEIPQVKA-IHRRRGAJSA-N 2 0 224.392 2.449 20 0 BEADRP C[C@]1(C[NH2+][C@@H]2C[C@@H]([NH3+])C23CCC3)CCCS1 ZINC000405275586 971228985 /nfs/dbraw/zinc/22/89/85/971228985.db2.gz WVQBTLJLHDZGDQ-IJLUTSLNSA-N 2 0 240.416 2.132 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]Cc2ccsc2)C12CCC2 ZINC000405309858 971229951 /nfs/dbraw/zinc/22/99/51/971229951.db2.gz OEIQLEFKAFETQO-GHMZBOCLSA-N 2 0 222.357 2.108 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]CC2(C3CC3)CCC2)C12CCC2 ZINC000405329409 971234922 /nfs/dbraw/zinc/23/49/22/971234922.db2.gz VZBGTOAXUBXCLM-OLZOCXBDSA-N 2 0 234.387 2.426 20 0 BEADRP CCCC(CCC)[NH2+]CCSCC[NH3+] ZINC001257332920 971238917 /nfs/dbraw/zinc/23/89/17/971238917.db2.gz JJBJOMIXJKGBRK-UHFFFAOYSA-N 2 0 218.410 2.237 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]Cc2cccc(F)c2)C12CCC2 ZINC000405326108 971238410 /nfs/dbraw/zinc/23/84/10/971238410.db2.gz UKALJMZXFHUZII-OLZOCXBDSA-N 2 0 234.318 2.185 20 0 BEADRP CCCC1(C[NH2+][C@H]2C[C@H]([NH3+])C23CCC3)CC1 ZINC000405345781 971240604 /nfs/dbraw/zinc/24/06/04/971240604.db2.gz KUZRGLMODPQWMR-RYUDHWBXSA-N 2 0 222.376 2.426 20 0 BEADRP CC1(C)CCC[C@@H]1[NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405355717 971242756 /nfs/dbraw/zinc/24/27/56/971242756.db2.gz QVSPKSDTPYLEKO-GRYCIOLGSA-N 2 0 222.376 2.425 20 0 BEADRP CCCCCC[C@@H](CC)[NH2+]CCOCC[NH3+] ZINC001170578460 971245475 /nfs/dbraw/zinc/24/54/75/971245475.db2.gz IRXMVIHFJPRJBG-CYBMUJFWSA-N 2 0 230.396 2.300 20 0 BEADRP Cc1csc(C[NH2+][C@@H]2C[C@H]([NH3+])C23CCC3)c1 ZINC000405378820 971250289 /nfs/dbraw/zinc/25/02/89/971250289.db2.gz CGJVRXBLSQMYDT-NWDGAFQWSA-N 2 0 236.384 2.416 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+][C@@H]2CC[C@@H]3C[C@@H]3C2)C12CCC2 ZINC000405401954 971250660 /nfs/dbraw/zinc/25/06/60/971250660.db2.gz QMCACGGJRLEYOW-VEGXAWMVSA-N 2 0 220.360 2.035 20 0 BEADRP C[C@H]1CC[C@H]([NH2+][C@H]2C[C@H]([NH3+])C23CCC3)CC1 ZINC000405376498 971250986 /nfs/dbraw/zinc/25/09/86/971250986.db2.gz BMRMGLRTOZBWGS-CYDGBPFRSA-N 2 0 222.376 2.425 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]CCC2CCC2)C12CCC2 ZINC000405430959 971256731 /nfs/dbraw/zinc/25/67/31/971256731.db2.gz AWKXXUKSMIHNGU-RYUDHWBXSA-N 2 0 208.349 2.036 20 0 BEADRP c1cn(C2CCCC2)c([C@H]2CCC[NH2+]C2)n1 ZINC001257355638 971271681 /nfs/dbraw/zinc/27/16/81/971271681.db2.gz CWOPUQJNBUHBDJ-NSHDSACASA-N 2 0 219.332 2.465 20 0 BEADRP CC[NH+](CC)CCO[C@@H](C)C[NH+](CC)CC ZINC001224927152 974076014 /nfs/dbraw/zinc/07/60/14/974076014.db2.gz DOIFCNQZYCKPFO-ZDUSSCGKSA-N 2 0 230.396 2.075 20 0 BEADRP CC[NH+]1C[C@H]2C[NH+](C3CCCCC3)C[C@@H]2C1 ZINC001257467098 971389483 /nfs/dbraw/zinc/38/94/83/971389483.db2.gz UWYVOZAPIBRXKR-STQMWFEESA-N 2 0 222.376 2.203 20 0 BEADRP CCCCC[C@H](C)[N@H+](C)C[C@H](C)C[NH3+] ZINC001257504660 971422566 /nfs/dbraw/zinc/42/25/66/971422566.db2.gz YZSIGWYNHNHMCI-NEPJUHHUSA-N 2 0 200.370 2.482 20 0 BEADRP CCCCC[C@@H](C)[N@H+](C)C[C@H](C)C[NH3+] ZINC001257504666 971423753 /nfs/dbraw/zinc/42/37/53/971423753.db2.gz YZSIGWYNHNHMCI-VXGBXAGGSA-N 2 0 200.370 2.482 20 0 BEADRP C[NH+](C)CCCCC[NH2+][C@@H]1CCCSC1 ZINC001257657374 971460406 /nfs/dbraw/zinc/46/04/06/971460406.db2.gz DABIWWQXCGUERQ-GFCCVEGCSA-N 2 0 230.421 2.204 20 0 BEADRP [NH3+]CCCCCCC[NH2+][C@@H]1CCCSC1 ZINC001257665209 971467477 /nfs/dbraw/zinc/46/74/77/971467477.db2.gz ZNNPZWVXLVNQPP-GFCCVEGCSA-N 2 0 230.421 2.381 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]1OCc1ccc(C[NH3+])cc1 ZINC001217878066 971471301 /nfs/dbraw/zinc/47/13/01/971471301.db2.gz RPXFEDPMWUOUMV-CQSZACIVSA-N 2 0 248.370 2.050 20 0 BEADRP C[N@H+](CC1CC[NH+](C)CC1)[C@H]1CCCSC1 ZINC001257678298 971482800 /nfs/dbraw/zinc/48/28/00/971482800.db2.gz URQDTSAUPYUONY-ZDUSSCGKSA-N 2 0 242.432 2.156 20 0 BEADRP CC(C)OC1CCC([N@@H+](C)C[C@H](C)C[NH3+])CC1 ZINC001257874567 971511576 /nfs/dbraw/zinc/51/15/76/971511576.db2.gz FRHRVBGYQBNLSW-IYXRBSQSSA-N 2 0 242.407 2.249 20 0 BEADRP [NH3+][C@@H]1C[C@H]1c1ccc(O[C@H]2CCC[NH2+]CC2)cc1 ZINC001217998808 971564866 /nfs/dbraw/zinc/56/48/66/971564866.db2.gz FEYCZEDSRWWKSE-AEGPPILISA-N 2 0 246.354 2.022 20 0 BEADRP C[C@@H](Oc1ccc2c(c1)C[NH2+]C2)C1CC[NH2+]CC1 ZINC001218007641 971569934 /nfs/dbraw/zinc/56/99/34/971569934.db2.gz XNFQDAAXULXBDD-LLVKDONJSA-N 2 0 246.354 2.057 20 0 BEADRP C[C@H](Oc1ccc2c(c1)C[NH2+]C2)C1CC[NH2+]CC1 ZINC001218007642 971570749 /nfs/dbraw/zinc/57/07/49/971570749.db2.gz XNFQDAAXULXBDD-NSHDSACASA-N 2 0 246.354 2.057 20 0 BEADRP C[C@H](c1cccc(O[C@H]2CC[NH2+]C2)c1)[NH+](C)C ZINC001218182722 971618643 /nfs/dbraw/zinc/61/86/43/971618643.db2.gz ZXNXMQUSTGKPSV-RISCZKNCSA-N 2 0 234.343 2.050 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2C[C@@H]3[C@H](C2)C3(C)C)C1 ZINC001170714787 971626397 /nfs/dbraw/zinc/62/63/97/971626397.db2.gz ALBXIKFEYCXRIR-SYQHCUMBSA-N 2 0 236.403 2.352 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+][C@H]2C[C@@H]3[C@H](C2)C3(C)C)C1 ZINC001170714789 971628171 /nfs/dbraw/zinc/62/81/71/971628171.db2.gz ALBXIKFEYCXRIR-YIYPIFLZSA-N 2 0 236.403 2.352 20 0 BEADRP Cc1ncn([C@@H]2C[C@@H]3[C@H](C2)C3(C)C)c1CC[NH3+] ZINC001170715039 971634431 /nfs/dbraw/zinc/63/44/31/971634431.db2.gz DTTRIISHQQBBLT-CNDDSTCGSA-N 2 0 233.359 2.300 20 0 BEADRP CC1(C)[C@@H]2C[C@H]([NH2+][C@H]3CCN(CC4CC4)C3)C[C@@H]21 ZINC001170732298 971674237 /nfs/dbraw/zinc/67/42/37/971674237.db2.gz XXBSGBRUUZQYFU-XQLPTFJDSA-N 2 0 248.414 2.495 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]1Oc1cccc2c1C[NH2+]C2 ZINC001218316060 971701506 /nfs/dbraw/zinc/70/15/06/971701506.db2.gz OMDXSYTZIQKTLB-CQSZACIVSA-N 2 0 246.354 2.057 20 0 BEADRP [NH3+]Cc1cccc(O[C@@H]2CC[NH2+]C3(CCC3)C2)c1 ZINC001218309227 971702758 /nfs/dbraw/zinc/70/27/58/971702758.db2.gz MISFVPGKRHRVIP-CQSZACIVSA-N 2 0 246.354 2.199 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+][C@@H](C)CCOC ZINC000309654806 971722484 /nfs/dbraw/zinc/72/24/84/971722484.db2.gz PHCHBOQBUATWPV-STQMWFEESA-N 2 0 230.396 2.121 20 0 BEADRP C[N@@H+]1CC[C@@]2(CC[NH+]([C@H]3C[C@@H]4[C@H](C3)C4(C)C)C2)C1 ZINC001170763745 971747945 /nfs/dbraw/zinc/74/79/45/971747945.db2.gz CMBDVZHDGKKAGA-HLPPOEQASA-N 2 0 248.414 2.449 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+][C@@H](C)[C@H](C)OC ZINC000309676109 971754747 /nfs/dbraw/zinc/75/47/47/971754747.db2.gz XSMZELCBZXOQBB-AVGNSLFASA-N 2 0 230.396 2.120 20 0 BEADRP [NH3+]CC1(F)CC[NH+](C[C@H]2CC=CCC2)CC1 ZINC001222528006 972540247 /nfs/dbraw/zinc/54/02/47/972540247.db2.gz SLAOTINNWGJHNS-LBPRGKRZSA-N 2 0 226.339 2.106 20 0 BEADRP CC1(C)C[C@H](Oc2ccccc2C[NH3+])CC[NH2+]1 ZINC001218477851 971827713 /nfs/dbraw/zinc/82/77/13/971827713.db2.gz SXFHIYILAAFKCZ-GFCCVEGCSA-N 2 0 234.343 2.055 20 0 BEADRP CC[C@H](C)OCC[C@@H](C)[N@@H+]1CCC[C@H]1CN ZINC001172323262 974534258 /nfs/dbraw/zinc/53/42/58/974534258.db2.gz BPAHRCAQOGYXJF-AGIUHOORSA-N 2 0 228.380 2.003 20 0 BEADRP [NH3+]CC1(F)CC[NH+](CCc2cccs2)CC1 ZINC001222527353 972543921 /nfs/dbraw/zinc/54/39/21/972543921.db2.gz LOONUYUKZRPWAJ-UHFFFAOYSA-N 2 0 242.363 2.053 20 0 BEADRP CC[C@H](C)OCC[C@H](C)[N@@H+]1CCC[C@H]1CN ZINC001172323264 974533116 /nfs/dbraw/zinc/53/31/16/974533116.db2.gz BPAHRCAQOGYXJF-AVGNSLFASA-N 2 0 228.380 2.003 20 0 BEADRP C[NH+](C)[C@@H]1CCC[C@H](Nc2cc[nH+]cc2)C1 ZINC000309981940 971909018 /nfs/dbraw/zinc/90/90/18/971909018.db2.gz WLVYGQGBBVVANU-QWHCGFSZSA-N 2 0 219.332 2.366 20 0 BEADRP C[NH+](C)C1CCC([NH2+][C@H]2C[C@H]2C2CC2)CC1 ZINC000309984365 971912404 /nfs/dbraw/zinc/91/24/04/971912404.db2.gz XRRMBRLJAHUWEM-HOAMVYINSA-N 2 0 222.376 2.247 20 0 BEADRP CC[C@@H](C)OCC[C@H](C)[N@H+](C)CCC[NH+](C)C ZINC001172334378 974599807 /nfs/dbraw/zinc/59/98/07/974599807.db2.gz BPBPMQHVHDIOQW-UONOGXRCSA-N 2 0 244.423 2.464 20 0 BEADRP C[C@@H]([NH3+])CCNc1cc(OCC2CC2)cc[nH+]1 ZINC001170890302 972039757 /nfs/dbraw/zinc/03/97/57/972039757.db2.gz WQBYFWQDCXGTTJ-SNVBAGLBSA-N 2 0 235.331 2.020 20 0 BEADRP CC(C)CC[NH2+][C@H]1CCC[C@H]([NH+](C)C)C1 ZINC000190775193 972053779 /nfs/dbraw/zinc/05/37/79/972053779.db2.gz BTMBUTNOBRIAGZ-STQMWFEESA-N 2 0 212.381 2.495 20 0 BEADRP COCCC[NH+]1CCC([NH2+]CCC(C)C)CC1 ZINC000190740673 972054752 /nfs/dbraw/zinc/05/47/52/972054752.db2.gz PXKWJJXNNSZGIA-UHFFFAOYSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)CC[NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1 ZINC000190775176 972055239 /nfs/dbraw/zinc/05/52/39/972055239.db2.gz BTMBUTNOBRIAGZ-OLZOCXBDSA-N 2 0 212.381 2.495 20 0 BEADRP [NH3+]CCC[C@@H]([NH3+])Nc1cccc(C(F)F)c1 ZINC001170900475 972065188 /nfs/dbraw/zinc/06/51/88/972065188.db2.gz URNQOOJELFVKJN-JTQLQIEISA-N 2 0 229.274 2.060 20 0 BEADRP CCn1ccc2cc(N[C@H]([NH3+])CCC[NH3+])ccc21 ZINC001170902878 972072411 /nfs/dbraw/zinc/07/24/11/972072411.db2.gz GSIZZMNCEDUDEG-AWEZNQCLSA-N 2 0 246.358 2.097 20 0 BEADRP Fc1ccc2c(c1)CC[C@@H]([NH2+]C1CC[NH2+]CC1)C2 ZINC001246080250 972135852 /nfs/dbraw/zinc/13/58/52/972135852.db2.gz QMDWFDZSOAETEP-OAHLLOKOSA-N 2 0 248.345 2.025 20 0 BEADRP CC(C)OCC[C@@H](C)[NH2+]C[C@@H]1C[NH2+]CC[C@@H]1C ZINC001246118741 972183479 /nfs/dbraw/zinc/18/34/79/972183479.db2.gz ICJZXARGCPZBPW-MJBXVCDLSA-N 2 0 242.407 2.025 20 0 BEADRP CC[NH2+]Cc1cccc(NC2=C[NH2+]CCC2)c1 ZINC001159956422 972194650 /nfs/dbraw/zinc/19/46/50/972194650.db2.gz JBAZOSMVDYOREC-UHFFFAOYSA-N 2 0 231.343 2.433 20 0 BEADRP C[N@@H+]1CCC=C(c2ccccc2C2([NH3+])CC2)C1 ZINC001241571346 1169734611 /nfs/dbraw/zinc/73/46/11/1169734611.db2.gz YTEZVJAVWDPNOC-UHFFFAOYSA-N 2 0 228.339 2.353 20 0 BEADRP Cc1[nH+]c(NCC(C)(C)[NH3+])cc2[nH]ccc21 ZINC001160031936 972207471 /nfs/dbraw/zinc/20/74/71/972207471.db2.gz GZPHJGZJANOYCH-UHFFFAOYSA-N 2 0 218.304 2.021 20 0 BEADRP CC(C)COCC[C@@H](C)[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC001246199574 972217080 /nfs/dbraw/zinc/21/70/80/972217080.db2.gz XFZHUXCMNWYPDO-ZIAGYGMSSA-N 2 0 242.407 2.027 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]C[C@@H]2CC[NH2+]2)CC(C)(C)C1 ZINC001246216889 972219366 /nfs/dbraw/zinc/21/93/66/972219366.db2.gz JHPGLFIUQJOVBS-SDDRHHMPSA-N 2 0 210.365 2.153 20 0 BEADRP CS[C@H](C)CC[N@@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC001208154607 957034992 /nfs/dbraw/zinc/03/49/92/957034992.db2.gz MVEPZLSYFWHMFU-OLZOCXBDSA-N 2 0 242.432 2.156 20 0 BEADRP Cl/C=C\C[N@@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000692954046 957046273 /nfs/dbraw/zinc/04/62/73/957046273.db2.gz GNOLVKQRLPFNFF-XYRDXQRHSA-N 2 0 242.794 2.451 20 0 BEADRP C[C@@H]1C[C@H](C)C[N@@H+](C[C@@H]2CCC[NH+](C)C2)C1 ZINC001208612292 957099861 /nfs/dbraw/zinc/09/98/61/957099861.db2.gz MFVXODISJGBEEM-HZSPNIEDSA-N 2 0 224.392 2.306 20 0 BEADRP Cc1cccc(C(=[NH2+])N[C@H]2CC[C@@H](C)[NH2+]C2)c1 ZINC001246285314 972256677 /nfs/dbraw/zinc/25/66/77/972256677.db2.gz RJACSVCMGLWXEA-YPMHNXCESA-N 2 0 231.343 2.050 20 0 BEADRP C[C@@H]1CC(C[N@@H+]2CCC[C@@H]([NH3+])CC2)C[C@@H](C)O1 ZINC000724507938 957320269 /nfs/dbraw/zinc/32/02/69/957320269.db2.gz JKLWLUYTUFTJCB-YRGRVCCFSA-N 2 0 240.391 2.003 20 0 BEADRP Cc1cc(N2CC[NH+](C[C@H]3C[C@@H]3C)CC2)cc[nH+]1 ZINC001209426247 957449770 /nfs/dbraw/zinc/44/97/70/957449770.db2.gz JSWOKBWMTZICGK-GXTWGEPZSA-N 2 0 245.370 2.168 20 0 BEADRP Cc1c[nH+]ccc1N1CC[NH+](C[C@@H]2C[C@@H]2C)CC1 ZINC001209429312 957451073 /nfs/dbraw/zinc/45/10/73/957451073.db2.gz WJXYCNAGTDYTIF-JSGCOSHPSA-N 2 0 245.370 2.168 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@@H]1CCc2c(F)cccc2C1 ZINC001246311421 972272604 /nfs/dbraw/zinc/27/26/04/972272604.db2.gz CLTFSTUHWMKUOE-NWDGAFQWSA-N 2 0 236.334 2.010 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CC2CC(C)(C)C2)CC[NH2+]1 ZINC000706561389 958008313 /nfs/dbraw/zinc/00/83/13/958008313.db2.gz XKYUWMNLRVZWJV-JQWIXIFHSA-N 2 0 210.365 2.153 20 0 BEADRP C[NH2+]Cc1ccc(Nc2c(C)[nH+]cn2C)cc1 ZINC001211129251 958040268 /nfs/dbraw/zinc/04/02/68/958040268.db2.gz ABAJNRIKUPVEGV-UHFFFAOYSA-N 2 0 230.315 2.192 20 0 BEADRP CCCCCC[C@@H](C)[NH2+]CCCNCCC[NH3+] ZINC001246451659 972319777 /nfs/dbraw/zinc/31/97/77/972319777.db2.gz HYSGKDMBARLKIC-CQSZACIVSA-N 2 0 243.439 2.263 20 0 BEADRP Cn1c[nH+]cc1Nc1cc[nH+]c(C2CC2)c1 ZINC001211248072 958115610 /nfs/dbraw/zinc/11/56/10/958115610.db2.gz IPGYKYYRKPSUDN-UHFFFAOYSA-N 2 0 214.272 2.436 20 0 BEADRP CCCC[C@H](CC)[NH2+]CCC[NH2+]CCCC[NH3+] ZINC001246458797 972326907 /nfs/dbraw/zinc/32/69/07/972326907.db2.gz VZKQGRMOPJMKGH-AWEZNQCLSA-N 3 0 243.439 2.263 20 0 BEADRP C[C@@H](Cc1ccco1)[NH2+]C[C@@H]1C[NH2+]C[C@@H](C)C1 ZINC000398805628 958396681 /nfs/dbraw/zinc/39/66/81/958396681.db2.gz PHFDSOQEVYHZHT-AVGNSLFASA-N 2 0 236.359 2.046 20 0 BEADRP C[C@@H]([NH3+])C1CC[NH+](CC=C(Cl)Cl)CC1 ZINC000403316026 958454196 /nfs/dbraw/zinc/45/41/96/958454196.db2.gz DUVBUIDTUXGKFT-MRVPVSSYSA-N 2 0 237.174 2.365 20 0 BEADRP C[C@@H](C[NH2+]C1C[C@H]2CC[C@@H](C1)S2)C[NH+](C)C ZINC000403636664 958749308 /nfs/dbraw/zinc/74/93/08/958749308.db2.gz NQWNDWCVIVZHEE-WODVXLOZSA-N 2 0 242.432 2.200 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[N@H+](Cc2cccs2)C2CC2)C1 ZINC000693545572 958756981 /nfs/dbraw/zinc/75/69/81/958756981.db2.gz KGWAJDHAAZWDBP-PHIMTYICSA-N 2 0 236.384 2.450 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@@H]2CCCC[C@H]2C2CC2)C1 ZINC000693562195 958806712 /nfs/dbraw/zinc/80/67/12/958806712.db2.gz MVTOLCGDNQXQTK-AHLTXXRQSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@@H]1C[C@H](C)[C@@H](C)[N@H+](C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000693578437 958868104 /nfs/dbraw/zinc/86/81/04/958868104.db2.gz LMQQTJVSBOSEJB-MLGHIDQZSA-N 2 0 210.365 2.090 20 0 BEADRP C[C@H](Cc1ccccn1)[NH2+]CC[C@H]1CCC[N@@H+]1C ZINC000707961858 958879991 /nfs/dbraw/zinc/87/99/91/958879991.db2.gz VMONDLYLFQKGSE-UKRRQHHQSA-N 2 0 247.386 2.087 20 0 BEADRP Cc1ccccc1C[N@H+](C)C[C@H]1C[C@@H]([NH3+])C1 ZINC000693590550 958902414 /nfs/dbraw/zinc/90/24/14/958902414.db2.gz COMSVDVIBKPMIL-XBXGTLAGSA-N 2 0 218.344 2.164 20 0 BEADRP C1=C[C@@H]2C[C@H]1C[C@H]2C[N@@H+]1CC[C@@]2(C1)CCC[NH2+]C2 ZINC001222141448 972387836 /nfs/dbraw/zinc/38/78/36/972387836.db2.gz MJDLCTPHQVJXFB-FZKCQIBNSA-N 2 0 246.398 2.274 20 0 BEADRP C1=C[C@@H]2C[C@H]1C[C@@H]2C[N@@H+]1CC[C@@]2(C1)CCC[NH2+]C2 ZINC001222141449 972389976 /nfs/dbraw/zinc/38/99/76/972389976.db2.gz MJDLCTPHQVJXFB-JJXSEGSLSA-N 2 0 246.398 2.274 20 0 BEADRP CCOCC[C@@H](C)[NH2+]C1CC[NH+](C(C)C)CC1 ZINC001172408688 974669406 /nfs/dbraw/zinc/66/94/06/974669406.db2.gz KYCYOBOMOAXENB-CYBMUJFWSA-N 2 0 242.407 2.264 20 0 BEADRP COC(C)(C)CC[N@@H+]1CCC[C@]12CCC[NH2+]C2 ZINC001222236883 972416707 /nfs/dbraw/zinc/41/67/07/972416707.db2.gz CMZOMXREEGATKU-AWEZNQCLSA-N 2 0 240.391 2.020 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]CCc2ccccc2F)C12CCC2 ZINC000405238372 959422140 /nfs/dbraw/zinc/42/21/40/959422140.db2.gz VBGUICQLQUXOBL-ZIAGYGMSSA-N 2 0 248.345 2.228 20 0 BEADRP [NH3+]CCCCCCCO[C@@H]1CCC[NH2+]C[C@H]1F ZINC001217766056 959579325 /nfs/dbraw/zinc/57/93/25/959579325.db2.gz PVLZQSUECCYDKC-CHWSQXEVSA-N 2 0 246.370 2.002 20 0 BEADRP C[C@@H]1C[C@H]1C[N@@H+]1CCC[C@@]2(CCCC[NH2+]2)C1 ZINC001222384812 972450979 /nfs/dbraw/zinc/45/09/79/972450979.db2.gz AALPXTKBUHDCHN-RDBSUJKOSA-N 2 0 222.376 2.251 20 0 BEADRP C1=C[C@@H]2C[C@H]1C[C@H]2C[N@@H+]1CC[C@@]2(C1)CCCC[NH2+]2 ZINC001222422485 972473785 /nfs/dbraw/zinc/47/37/85/972473785.db2.gz VBLWAPXEEVNXIA-XUWVNRHRSA-N 2 0 246.398 2.417 20 0 BEADRP CC(C)OC1CC[NH+](CCCCCC[NH3+])CC1 ZINC000695075189 960081487 /nfs/dbraw/zinc/08/14/87/960081487.db2.gz GLKFAMIRTAHMIY-UHFFFAOYSA-N 2 0 242.407 2.395 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+][C@H]2CCCC(F)(F)C2)C12CCC2 ZINC000695112751 960106710 /nfs/dbraw/zinc/10/67/10/960106710.db2.gz MFHFMFWVCAXKOR-HBNTYKKESA-N 2 0 244.329 2.424 20 0 BEADRP C[C@@H]1CC[N@H+](CCC2CC[NH+](C)CC2)C[C@H]1F ZINC001207478995 960346026 /nfs/dbraw/zinc/34/60/26/960346026.db2.gz ADABMBJKSBUVKT-TZMCWYRMSA-N 2 0 242.382 2.398 20 0 BEADRP C1=C[C@@H]2C[C@H]1C[C@H]2C[N@@H+]1CCC[C@]2(CCC[NH2+]2)C1 ZINC001222345270 960544957 /nfs/dbraw/zinc/54/49/57/960544957.db2.gz KHSIMOJMQSYODL-XUWVNRHRSA-N 2 0 246.398 2.417 20 0 BEADRP C[C@@H]1C[C@@H]([N@@H+]2CCC[C@H]2c2ccncc2)CC[NH2+]1 ZINC000709467545 960614562 /nfs/dbraw/zinc/61/45/62/960614562.db2.gz UMNAQUPEGQMUFW-SNPRPXQTSA-N 2 0 245.370 2.359 20 0 BEADRP Cc1c[nH]c(C[NH+]2CC3(C2)CC[NH+](C)CC3)c1C ZINC001140861571 960640702 /nfs/dbraw/zinc/64/07/02/960640702.db2.gz IIACSBYRJXHKMN-UHFFFAOYSA-N 2 0 247.386 2.159 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@H]2CC[NH2+][C@H](C)C2)C1 ZINC000300056242 961008616 /nfs/dbraw/zinc/00/86/16/961008616.db2.gz OHYYVIKXDUQDIL-NDBYEHHHSA-N 2 0 210.365 2.153 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH2+][C@@H]2CC3CCC2CC3)C1 ZINC000310169254 961162390 /nfs/dbraw/zinc/16/23/90/961162390.db2.gz OZIRMGBPYVHIBX-OOJKYFRXSA-N 2 0 236.403 2.497 20 0 BEADRP CC[NH+](CC)CCCC[NH2+][C@H]1C[C@H]2C[C@H]2C1 ZINC001167895969 961524349 /nfs/dbraw/zinc/52/43/49/961524349.db2.gz YDKNLTOIGHJTBP-WDNDVIMCSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH+]1CCC(C2CCC2)CC1 ZINC000692926535 961748076 /nfs/dbraw/zinc/74/80/76/961748076.db2.gz GSIJSQHSWWBGJV-DOMZBBRYSA-N 2 0 236.403 2.354 20 0 BEADRP C[NH+]1CCC(CCC[NH2+][C@@H]2C[C@H]3C[C@H]3C2)CC1 ZINC001167915018 961838531 /nfs/dbraw/zinc/83/85/31/961838531.db2.gz ZJSGOYAFPQGIBU-QDMKHBRRSA-N 2 0 236.403 2.497 20 0 BEADRP Cc1cc(C)[nH+]c(N2CC[C@@]3(C2)CCC[NH2+]C3)c1 ZINC000709951772 961940125 /nfs/dbraw/zinc/94/01/25/961940125.db2.gz CELTWVVYQQFKIK-HNNXBMFYSA-N 2 0 245.370 2.278 20 0 BEADRP C[NH2+]C[C@H]1CC[N@H+](C[C@@H]2CC3CCC2CC3)C1 ZINC000400113407 962246989 /nfs/dbraw/zinc/24/69/89/962246989.db2.gz LGGAQUFIKSPZQB-JYVUQVBGSA-N 2 0 236.403 2.354 20 0 BEADRP CC[N@H+](C)C1CC[NH+]([C@H]2C[C@H]3C[C@H]3C2)CC1 ZINC001167947630 962564596 /nfs/dbraw/zinc/56/45/96/962564596.db2.gz CKNGHVYARXIMLR-IMRBUKKESA-N 2 0 222.376 2.201 20 0 BEADRP CC(C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167958164 962823570 /nfs/dbraw/zinc/82/35/70/962823570.db2.gz CUUQGCDSXLGHSO-AGUYFDCRSA-N 2 0 222.376 2.390 20 0 BEADRP [NH3+][C@H]1CCC[C@H](Nc2[nH+]ccc3[nH]ccc32)C1 ZINC001154976998 962928077 /nfs/dbraw/zinc/92/80/77/962928077.db2.gz MHYFJWSJLOYMKR-UWVGGRQHSA-N 2 0 230.315 2.245 20 0 BEADRP Cc1cc2[nH]ccc2c(N[C@@H](C)C[NH+](C)C)[nH+]1 ZINC001155916265 963202647 /nfs/dbraw/zinc/20/26/47/963202647.db2.gz NRRXLTHIEZNMCJ-JTQLQIEISA-N 2 0 232.331 2.233 20 0 BEADRP CC[N@H+](CCNC(=[NH2+])Nc1ccccc1)C(C)C ZINC000066246544 963272677 /nfs/dbraw/zinc/27/26/77/963272677.db2.gz NKDWZONHTJNRTF-UHFFFAOYSA-N 2 0 248.374 2.144 20 0 BEADRP CC(C)[NH+]1CCC(CNc2cccc(N)[nH+]2)CC1 ZINC001156495594 963371119 /nfs/dbraw/zinc/37/11/19/963371119.db2.gz JCSLCGGQYNEHJJ-UHFFFAOYSA-N 2 0 248.374 2.196 20 0 BEADRP CC1(Nc2[nH+]ccc3[nH]ccc32)CC[NH2+]CC1 ZINC001157397560 963598675 /nfs/dbraw/zinc/59/86/75/963598675.db2.gz RYRAPFCMRDHEIJ-UHFFFAOYSA-N 2 0 230.315 2.117 20 0 BEADRP Cc1ccc(NCC[C@H]2CCC[NH2+]2)[nH+]c1C ZINC001158627209 963894823 /nfs/dbraw/zinc/89/48/23/963894823.db2.gz FMQXEIKDFKGCHH-GFCCVEGCSA-N 2 0 219.332 2.252 20 0 BEADRP Nc1cc(Nc2ccc3c(c2)CC[NH2+]C3)cc[nH+]1 ZINC001159114066 964001665 /nfs/dbraw/zinc/00/16/65/964001665.db2.gz OXSZYMPDUKINCN-UHFFFAOYSA-N 2 0 240.310 2.053 20 0 BEADRP Cc1cc(Nc2ccc3c(c2)C[NH2+]C3)cc(C)[nH+]1 ZINC001159470394 964106914 /nfs/dbraw/zinc/10/69/14/964106914.db2.gz DCRXKXKUTOFVCU-UHFFFAOYSA-N 2 0 239.322 2.467 20 0 BEADRP Cc1cc2ns[nH]c-2cc1=[NH+]C1=CC[NH2+]CC1 ZINC001159932682 964228490 /nfs/dbraw/zinc/22/84/90/964228490.db2.gz BVKZAMRRMHCPDT-UHFFFAOYSA-N 2 0 246.339 2.289 20 0 BEADRP C[NH+](C)C1CCC(Nc2cccc(C[NH3+])c2)CC1 ZINC001168295226 964388065 /nfs/dbraw/zinc/38/80/65/964388065.db2.gz XEZYHCPBSGQPEQ-UHFFFAOYSA-N 2 0 247.386 2.430 20 0 BEADRP C[C@@H]1C[N@@H+](C2CCC([NH+](C)C)CC2)C[C@@H]1F ZINC001168313626 964414944 /nfs/dbraw/zinc/41/49/44/964414944.db2.gz FMLBOSIFSIQSKK-XVSSEFHLSA-N 2 0 228.355 2.149 20 0 BEADRP CC(C)[NH+]1CC(Nc2ccc(C3([NH3+])CC3)cc2)C1 ZINC001168314067 964419096 /nfs/dbraw/zinc/41/90/96/964419096.db2.gz JPNOWVGFLVGCON-UHFFFAOYSA-N 2 0 245.370 2.139 20 0 BEADRP CN(C)c1cccc(NCC[C@H]2CCC[N@@H+]2C)[nH+]1 ZINC001160966689 964461537 /nfs/dbraw/zinc/46/15/37/964461537.db2.gz XFJVMVVTZPLXCH-GFCCVEGCSA-N 2 0 248.374 2.044 20 0 BEADRP C[N@H+](CCOC(C)(C)C)C[C@H]1CCCC[NH2+]C1 ZINC000690053575 964499619 /nfs/dbraw/zinc/49/96/19/964499619.db2.gz JAVFTDMHHUYBGB-ZDUSSCGKSA-N 2 0 242.407 2.123 20 0 BEADRP COC1(C[NH2+]CC[C@@H](C)[NH+](C)C)CCCCC1 ZINC000697825874 964550075 /nfs/dbraw/zinc/55/00/75/964550075.db2.gz HJWYZVGLOACTSM-CYBMUJFWSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@H](CC[NH2+][C@@H]1CCc2ccccc2C1)[NH+](C)C ZINC000697858922 964573211 /nfs/dbraw/zinc/57/32/11/964573211.db2.gz PENDIEZLDOQNAH-CZUORRHYSA-N 2 0 246.398 2.474 20 0 BEADRP CSC1(C[NH2+]CC[C@H](C)[NH+](C)C)CCC1 ZINC000697888634 964636289 /nfs/dbraw/zinc/63/62/89/964636289.db2.gz PKCBMJMDIWLJQU-NSHDSACASA-N 2 0 230.421 2.202 20 0 BEADRP Cc1ccc(C[NH2+]CC[C@H](C)[NH+](C)C)s1 ZINC000697888175 964636776 /nfs/dbraw/zinc/63/67/76/964636776.db2.gz IJCLOTLHQGGONU-JTQLQIEISA-N 2 0 226.389 2.486 20 0 BEADRP CC1CC([N@H+](C)CC2CC[NH+](C)CC2)C1 ZINC000150049413 964728021 /nfs/dbraw/zinc/72/80/21/964728021.db2.gz PWMGAWKRXROHGD-UHFFFAOYSA-N 2 0 210.365 2.059 20 0 BEADRP Cc1cc(N(C)C)[nH+]cc1N[C@H]1CCC[C@@H]([NH3+])C1 ZINC001162395719 964955344 /nfs/dbraw/zinc/95/53/44/964955344.db2.gz FPZLABDDCJFFIS-NEPJUHHUSA-N 2 0 248.374 2.138 20 0 BEADRP C[C@@H]([NH2+][C@H]1C=CCC1)C1CC[NH+](C)CC1 ZINC000698207360 965105836 /nfs/dbraw/zinc/10/58/36/965105836.db2.gz WLVFBEALUMOTGD-YPMHNXCESA-N 2 0 208.349 2.025 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H]2C=CCC2)CC1 ZINC000698207868 965108945 /nfs/dbraw/zinc/10/89/45/965108945.db2.gz YDUXKRGJOPFMNX-LBPRGKRZSA-N 2 0 208.349 2.169 20 0 BEADRP CC1CC(C[N@H+](C)C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000691945392 965120553 /nfs/dbraw/zinc/12/05/53/965120553.db2.gz WQOLOXLXSQQWAU-LJZITESISA-N 2 0 222.376 2.247 20 0 BEADRP C1=C[C@H]([NH2+][C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)CC1 ZINC000698277942 965166840 /nfs/dbraw/zinc/16/68/40/965166840.db2.gz MSEXMNOJWLCOEG-IGQOVBAYSA-N 2 0 220.360 2.215 20 0 BEADRP Cc1cccnc1CN[C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000250992770 965194434 /nfs/dbraw/zinc/19/44/34/965194434.db2.gz PLGSIMVYMBZANR-KBPBESRZSA-N 2 0 245.370 2.106 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@@H]1CCCC[C@@H]1C1CC1 ZINC000696000826 965209275 /nfs/dbraw/zinc/20/92/75/965209275.db2.gz GHDGUOSKLJLVPF-FAAHXZRKSA-N 2 0 236.403 2.400 20 0 BEADRP c1cc(N[C@H]2C[NH+]3CCC2CC3)cc(C2CC2)[nH+]1 ZINC001163395647 965391599 /nfs/dbraw/zinc/39/15/99/965391599.db2.gz UWNDEYOSKXTTIM-HNNXBMFYSA-N 2 0 243.354 2.465 20 0 BEADRP Cc1[nH]c2ccc(N[C@H](C)C[NH+](C)C)cc2[nH+]1 ZINC001163776747 965580867 /nfs/dbraw/zinc/58/08/67/965580867.db2.gz JRADZDFQIMFAOG-SECBINFHSA-N 2 0 232.331 2.233 20 0 BEADRP C[C@H]1CC[C@H](C[NH3+])N(c2cc3[nH]ccc3c[nH+]2)C1 ZINC001164060840 965724330 /nfs/dbraw/zinc/72/43/30/965724330.db2.gz CGNXTXPWJIRNDS-CMPLNLGQSA-N 2 0 244.342 2.127 20 0 BEADRP C[C@@H]1CC[C@@H](C[NH3+])N(c2cc3[nH]ccc3c[nH+]2)C1 ZINC001164060842 965724572 /nfs/dbraw/zinc/72/45/72/965724572.db2.gz CGNXTXPWJIRNDS-PWSUYJOCSA-N 2 0 244.342 2.127 20 0 BEADRP CC(C)N(CCC[NH3+])c1c[nH+]cc2cc[nH]c21 ZINC001164123015 965744983 /nfs/dbraw/zinc/74/49/83/965744983.db2.gz VSPXOGLBDUNRBZ-UHFFFAOYSA-N 2 0 232.331 2.127 20 0 BEADRP C[NH+](C)C1CCC([NH2+]CCc2ccco2)CC1 ZINC000715179092 965774099 /nfs/dbraw/zinc/77/40/99/965774099.db2.gz KNENUPYXDHSGTF-UHFFFAOYSA-N 2 0 236.359 2.285 20 0 BEADRP C[N@@H+](Cc1ccccn1)CC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000699260845 965826035 /nfs/dbraw/zinc/82/60/35/965826035.db2.gz POKIFUPUDUOJIS-AGUYFDCRSA-N 2 0 245.370 2.044 20 0 BEADRP COc1cc(C)cc(C[N@@H+]2CCC[C@H]([NH3+])CC2)c1 ZINC001205109551 965830543 /nfs/dbraw/zinc/83/05/43/965830543.db2.gz IKBHWEWYLHZSHK-AWEZNQCLSA-N 2 0 248.370 2.317 20 0 BEADRP C[C@H]1CC[C@@H](C[NH3+])CN1c1[nH+]ccc2[nH]ccc21 ZINC001164456854 965891734 /nfs/dbraw/zinc/89/17/34/965891734.db2.gz TUYOITFPQGEGCK-QWRGUYRKSA-N 2 0 244.342 2.127 20 0 BEADRP C[NH+](C)C[C@@H]1CCCN1c1[nH+]ccc2[nH]ccc21 ZINC001165070902 965956030 /nfs/dbraw/zinc/95/60/30/965956030.db2.gz CHFYWSUSMDRJRR-NSHDSACASA-N 2 0 244.342 2.093 20 0 BEADRP Cc1c[nH+]c(N2C[C@@H]3C[C@]3(C[NH+](C)C)C2)cc1C ZINC001165182689 965977364 /nfs/dbraw/zinc/97/73/64/965977364.db2.gz MONXODNMYAXGDB-ZFWWWQNUSA-N 2 0 245.370 2.086 20 0 BEADRP Cc1cc(C)[nH+]c(N2C[C@@H]3C[C@]3(C[NH+](C)C)C2)c1 ZINC001165180347 965978146 /nfs/dbraw/zinc/97/81/46/965978146.db2.gz AXMMXIDEVOZZSP-ZFWWWQNUSA-N 2 0 245.370 2.086 20 0 BEADRP CCc1ccc(C[NH+]2CC3(C2)CC[NH+](C)CC3)o1 ZINC001204395470 965984194 /nfs/dbraw/zinc/98/41/94/965984194.db2.gz RNRCNRNIGKLCGM-UHFFFAOYSA-N 2 0 248.370 2.370 20 0 BEADRP Cc1ccc(N2CC[C@@]3(C2)CCC[NH2+]C3)[nH+]c1C ZINC001165235934 966003842 /nfs/dbraw/zinc/00/38/42/966003842.db2.gz AKCLYHSNICUHBG-HNNXBMFYSA-N 2 0 245.370 2.278 20 0 BEADRP [NH3+][C@@]12CCC[C@@H]1C[N@H+](C[C@@H]1C[C@H]3C=C[C@@H]1C3)C2 ZINC001235240940 966032893 /nfs/dbraw/zinc/03/28/93/966032893.db2.gz OEWRVDOYZRPXMF-XPABHHOTSA-N 2 0 232.371 2.012 20 0 BEADRP Cc1ccccc1C[N@H+]1C[C@@H]2CC[NH2+]CC[C@@H]2C1 ZINC001236313976 966360580 /nfs/dbraw/zinc/36/05/80/966360580.db2.gz COYDFHUDJFZSSY-IYBDPMFKSA-N 2 0 244.382 2.426 20 0 BEADRP C[C@@H]1CCC[C@H](C)[N@H+]1C[C@H]1CCC[NH2+]C1 ZINC000162334527 966618044 /nfs/dbraw/zinc/61/80/44/966618044.db2.gz YTQFOZSUKFBQCQ-XQQFMLRXSA-N 2 0 210.365 2.249 20 0 BEADRP Cc1[nH+]cn(C)c1Nc1cc(C)cnc1C ZINC001203657324 966719597 /nfs/dbraw/zinc/71/95/97/966719597.db2.gz LDTWJVCLZOCRRN-UHFFFAOYSA-N 2 0 216.288 2.484 20 0 BEADRP CC[NH+]1C[C@H]2C[NH+](Cc3cccc(C)c3)C[C@@H]2C1 ZINC001203893541 966811835 /nfs/dbraw/zinc/81/18/35/966811835.db2.gz KKIBSMRFIBVLPR-HOTGVXAUSA-N 2 0 244.382 2.379 20 0 BEADRP Cn1c[nH+]cc1N1C[C@@H](CC[NH3+])c2ccccc21 ZINC001168543614 966850252 /nfs/dbraw/zinc/85/02/52/966850252.db2.gz IYLCDZNHJDBQBV-LLVKDONJSA-N 2 0 242.326 2.004 20 0 BEADRP C[NH+]1CCC2(CC1)CC[NH+](Cc1ccc[nH]1)CC2 ZINC001204011349 966851220 /nfs/dbraw/zinc/85/12/20/966851220.db2.gz NRCDAPDBDXRSQG-UHFFFAOYSA-N 2 0 247.386 2.323 20 0 BEADRP C[NH+]1CC2(C1)CC[NH+](Cc1ccsc1)CC2 ZINC001204042998 966869983 /nfs/dbraw/zinc/86/99/83/966869983.db2.gz RQRFHOUFKAKLKO-UHFFFAOYSA-N 2 0 236.384 2.276 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@H]([NH2+]CC3(C)CCC3)[C@H]2C1 ZINC001204089349 966888423 /nfs/dbraw/zinc/88/84/23/966888423.db2.gz MGVNUHXCBGEYHC-AVGNSLFASA-N 2 0 222.376 2.106 20 0 BEADRP CC(C)[C@@H]1C[C@H]1[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC001204128146 966897482 /nfs/dbraw/zinc/89/74/82/966897482.db2.gz IXJUVWXWBVTONI-ZOBORPQBSA-N 2 0 222.376 2.247 20 0 BEADRP CC(C)OCCC[NH2+]C1CCC([NH+](C)C)CC1 ZINC000715533667 967077981 /nfs/dbraw/zinc/07/79/81/967077981.db2.gz RZIDBXCVVCJEIY-UHFFFAOYSA-N 2 0 242.407 2.264 20 0 BEADRP CCCC[C@@H](CC)C[N@@H+]1CCO[C@H](CC[NH3+])C1 ZINC001204748759 967144714 /nfs/dbraw/zinc/14/47/14/967144714.db2.gz SYTXQQLRBHCOHR-ZIAGYGMSSA-N 2 0 242.407 2.252 20 0 BEADRP C[C@@]1([NH3+])CCCN(Cc2ccc3c(c2)CCC3)C1 ZINC001204937598 967238586 /nfs/dbraw/zinc/23/85/86/967238586.db2.gz FVZKKZQTIJNIJX-MRXNPFEDSA-N 2 0 244.382 2.489 20 0 BEADRP COc1cc(C)ccc1C[NH+]1CCC(C[NH3+])CC1 ZINC001205033405 967296546 /nfs/dbraw/zinc/29/65/46/967296546.db2.gz GFOPLBJHQGTZGC-UHFFFAOYSA-N 2 0 248.370 2.174 20 0 BEADRP Cc1cc(C[N@@H+]2CCC[C@@H]([NH3+])CC2)oc1C ZINC001205094446 967340484 /nfs/dbraw/zinc/34/04/84/967340484.db2.gz MJNQXKQQXTWRHP-GFCCVEGCSA-N 2 0 222.332 2.210 20 0 BEADRP CCOc1cccc(C[N@@H+]2CCC[C@@H]([NH3+])CC2)c1 ZINC001205102608 967348599 /nfs/dbraw/zinc/34/85/99/967348599.db2.gz UKJNEMIPWOVCOR-CQSZACIVSA-N 2 0 248.370 2.399 20 0 BEADRP [NH3+][C@H]1CCC[N@H+](Cc2ccc3c(c2)COC3)CC1 ZINC001205102932 967349418 /nfs/dbraw/zinc/34/94/18/967349418.db2.gz WRKWLVGPWNHADN-HNNXBMFYSA-N 2 0 246.354 2.030 20 0 BEADRP COCc1ccc(C[N@@H+]2CCC[C@H]([NH3+])CC2)cc1 ZINC001205116623 967362707 /nfs/dbraw/zinc/36/27/07/967362707.db2.gz FBHACXZNJLKTLY-HNNXBMFYSA-N 2 0 248.370 2.146 20 0 BEADRP Cc1cc(O)cc(C[N@@H+]2CCC[C@@H]([NH3+])CC2)c1 ZINC001205117947 967371744 /nfs/dbraw/zinc/37/17/44/967371744.db2.gz ZKZIMLVLYJDBFY-CYBMUJFWSA-N 2 0 234.343 2.014 20 0 BEADRP C[C@H]1C[N@H+](CC2CCC(F)(F)CC2)C[C@H]1C[NH3+] ZINC001205130301 967375015 /nfs/dbraw/zinc/37/50/15/967375015.db2.gz BEDQJVVRHBWQNE-CMPLNLGQSA-N 2 0 246.345 2.339 20 0 BEADRP Cc1c(F)cccc1C[N@H+]1C[C@H](C)[C@H](C[NH3+])C1 ZINC001205135903 967380142 /nfs/dbraw/zinc/38/01/42/967380142.db2.gz DSPZRXVGUKUHHC-GXFFZTMASA-N 2 0 236.334 2.161 20 0 BEADRP C[C@@]1([NH3+])CCC[N@H+](CCOc2ccccc2)CC1 ZINC001205255838 967445740 /nfs/dbraw/zinc/44/57/40/967445740.db2.gz LRVQPSSDGDHPBI-OAHLLOKOSA-N 2 0 248.370 2.269 20 0 BEADRP C[C@@]1([NH3+])CCC[N@H+](Cc2ccsc2)CC1 ZINC001205263898 967458935 /nfs/dbraw/zinc/45/89/35/967458935.db2.gz FMADWPWOLJWWNT-GFCCVEGCSA-N 2 0 224.373 2.451 20 0 BEADRP C[C@@]1([NH3+])CCC[N@H+](Cc2ccc3n2CCC3)CC1 ZINC001205296123 967498465 /nfs/dbraw/zinc/49/84/65/967498465.db2.gz HLQNTFUQODTFLT-OAHLLOKOSA-N 2 0 247.386 2.138 20 0 BEADRP CS[C@H]1CCC[C@@H]([NH2+]C2CC([NH+](C)C)C2)C1 ZINC000922213691 967603154 /nfs/dbraw/zinc/60/31/54/967603154.db2.gz DVXRMNBCLAYQSW-XVSSEFHLSA-N 2 0 242.432 2.343 20 0 BEADRP C[C@@H](CC[NH2+][C@@H]1CCCOC1)[NH+]1CCCCC1 ZINC001205391966 967617027 /nfs/dbraw/zinc/61/70/27/967617027.db2.gz XXESBNMUZGWNEF-UONOGXRCSA-N 2 0 240.391 2.020 20 0 BEADRP Cc1cc(Nc2ccc3c[nH+]cn3c2)cc[nH+]1 ZINC001250323129 967703927 /nfs/dbraw/zinc/70/39/27/967703927.db2.gz SUNRGQVAXLDIJD-UHFFFAOYSA-N 2 0 224.267 2.203 20 0 BEADRP Cc1[nH+]cc(Nc2ccc3c[nH+]cn3c2)n1C ZINC001250328720 967713433 /nfs/dbraw/zinc/71/34/33/967713433.db2.gz ZEOPMSKWCKTODV-UHFFFAOYSA-N 2 0 227.271 2.120 20 0 BEADRP C[C@@H]1CC[N@H+](Cc2ccco2)CC[C@@H]1C[NH3+] ZINC001205601953 967721733 /nfs/dbraw/zinc/72/17/33/967721733.db2.gz HCMMXMUGGXKSRQ-VXGBXAGGSA-N 2 0 222.332 2.086 20 0 BEADRP Cc1cc(C)c(C[N@H+]2CC[C@@H](C)[C@H](C[NH3+])CC2)[nH]1 ZINC001205617712 967727534 /nfs/dbraw/zinc/72/75/34/967727534.db2.gz MPXODMMQUGBPDJ-RISCZKNCSA-N 2 0 249.402 2.438 20 0 BEADRP Cc1ncccc1C[N@H+]1CC[C@H](C)[C@@H](C[NH3+])CC1 ZINC001205618426 967731504 /nfs/dbraw/zinc/73/15/04/967731504.db2.gz VWFXTYUPXJKEDL-GXTWGEPZSA-N 2 0 247.386 2.197 20 0 BEADRP Cc1ccncc1C[N@H+]1CC[C@H](C)[C@@H](C[NH3+])CC1 ZINC001205625598 967732707 /nfs/dbraw/zinc/73/27/07/967732707.db2.gz BSCDQDYIYSIQFM-UONOGXRCSA-N 2 0 247.386 2.197 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@H](C)[C@@H](C[NH3+])CC2)cn1 ZINC001205626318 967736784 /nfs/dbraw/zinc/73/67/84/967736784.db2.gz FQTMEXMALQDEKU-SWLSCSKDSA-N 2 0 247.386 2.197 20 0 BEADRP Cc1ccncc1C[N@H+]1CC[C@@H](C)[C@H](C[NH3+])CC1 ZINC001205625597 967737123 /nfs/dbraw/zinc/73/71/23/967737123.db2.gz BSCDQDYIYSIQFM-KGLIPLIRSA-N 2 0 247.386 2.197 20 0 BEADRP C[C@@H]1CC[N@H+](Cc2ccccc2N)CC[C@@H]1C[NH3+] ZINC001205653353 967744110 /nfs/dbraw/zinc/74/41/10/967744110.db2.gz SVVZKTXARLWYFJ-CHWSQXEVSA-N 2 0 247.386 2.076 20 0 BEADRP CCc1ccc(C[N@@H+]2CC[C@H](CC[NH3+])C2)s1 ZINC000700631481 967802732 /nfs/dbraw/zinc/80/27/32/967802732.db2.gz PFLUSYQIKIZTGN-NSHDSACASA-N 2 0 238.400 2.481 20 0 BEADRP Cc1cc[nH+]c(N[C@H]2CCC[C@@H]([NH3+])C2)c1C ZINC001162390940 967822346 /nfs/dbraw/zinc/82/23/46/967822346.db2.gz KCNYTORFAPBCGN-NEPJUHHUSA-N 2 0 219.332 2.380 20 0 BEADRP C[C@H]1[C@@H](C[NH3+])CCC[N@@H+]1CCC(C)(C)C ZINC001205902202 967873424 /nfs/dbraw/zinc/87/34/24/967873424.db2.gz IPVCJWQKXORWNY-NWDGAFQWSA-N 2 0 212.381 2.482 20 0 BEADRP C[C@@H]1[C@H](C[NH3+])CCC[N@@H+]1C[C@H]1C[C@H]2C=C[C@@H]1C2 ZINC001205901803 967877556 /nfs/dbraw/zinc/87/75/56/967877556.db2.gz GJODZEHNHGRGSI-QKGCVVFFSA-N 2 0 234.387 2.258 20 0 BEADRP Cc1c(N)cc[nH+]c1NC(=[NH2+])C(C)(C)C ZINC001162657498 967884041 /nfs/dbraw/zinc/88/40/41/967884041.db2.gz LTOQQPNTKLNQGI-UHFFFAOYSA-N 2 0 206.293 2.407 20 0 BEADRP C[C@H]1C[N@H+](CCC2CC2)CCC[C@@H]1C[NH3+] ZINC001205984711 967929643 /nfs/dbraw/zinc/92/96/43/967929643.db2.gz UKSSZRWVMOJZEA-WCQYABFASA-N 2 0 210.365 2.093 20 0 BEADRP Cc1cccc(C[N@@H+]2CCC[C@@H](C[NH3+])[C@H](C)C2)n1 ZINC001205992543 967944067 /nfs/dbraw/zinc/94/40/67/967944067.db2.gz FFFFWJSCFQMICT-OCCSQVGLSA-N 2 0 247.386 2.197 20 0 BEADRP C[C@@H]1C[N@H+](Cc2ccc(O)cc2)CCC[C@H]1C[NH3+] ZINC001205996137 967946807 /nfs/dbraw/zinc/94/68/07/967946807.db2.gz VAGORDGSOJGFMQ-OCCSQVGLSA-N 2 0 248.370 2.199 20 0 BEADRP Cc1ccncc1C[N@@H+]1CCC[C@@H](C[NH3+])[C@@H](C)C1 ZINC001206003454 967955680 /nfs/dbraw/zinc/95/56/80/967955680.db2.gz IFEYKAYUHQTXJB-KBPBESRZSA-N 2 0 247.386 2.197 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@H](C[NH3+])[C@H](C)C2)nc1 ZINC001206003769 967960171 /nfs/dbraw/zinc/96/01/71/967960171.db2.gz MKJKRTVFOPQJDG-ZIAGYGMSSA-N 2 0 247.386 2.197 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CCC[C@](C)(C[NH3+])CC1 ZINC001206295634 968201944 /nfs/dbraw/zinc/20/19/44/968201944.db2.gz MKAHFTZPPDOLCF-UPJWGTAASA-N 2 0 210.365 2.093 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCC[C@](C)(C[NH3+])CC1 ZINC001206294009 968203537 /nfs/dbraw/zinc/20/35/37/968203537.db2.gz ILAFNCJFWUWUAQ-STQMWFEESA-N 2 0 212.381 2.483 20 0 BEADRP Cc1ccnc(C[N@@H+]2CCC[C@@](C)(C[NH3+])CC2)c1 ZINC001206304614 968210173 /nfs/dbraw/zinc/21/01/73/968210173.db2.gz NFFUGLWLJPDSBC-OAHLLOKOSA-N 2 0 247.386 2.341 20 0 BEADRP [NH3+][C@@H]1CCN(c2cc[nH+]cc2-c2ccccc2)C1 ZINC001164281618 968209962 /nfs/dbraw/zinc/20/99/62/968209962.db2.gz INTQEILGRWUSKM-CYBMUJFWSA-N 2 0 239.322 2.286 20 0 BEADRP Cc1cnccc1C[N@@H+]1CCC[C@@](C)(C[NH3+])CC1 ZINC001206305118 968213837 /nfs/dbraw/zinc/21/38/37/968213837.db2.gz UARUPPGOOJNRER-OAHLLOKOSA-N 2 0 247.386 2.341 20 0 BEADRP Cc1cnccc1C[N@@H+]1CCC[C@](C)(C[NH3+])CC1 ZINC001206305117 968214436 /nfs/dbraw/zinc/21/44/36/968214436.db2.gz UARUPPGOOJNRER-HNNXBMFYSA-N 2 0 247.386 2.341 20 0 BEADRP C[C@@]1(C[NH3+])CCC[N@H+](Cc2ccccc2N)CC1 ZINC001206326871 968233172 /nfs/dbraw/zinc/23/31/72/968233172.db2.gz PYZJPETYXHITLP-OAHLLOKOSA-N 2 0 247.386 2.220 20 0 BEADRP [NH3+]CCONc1ccc2c(c1)[nH]c1cc[nH+]cc12 ZINC001164435596 968235137 /nfs/dbraw/zinc/23/51/37/968235137.db2.gz KEYIASGTGWGGGA-UHFFFAOYSA-N 2 0 242.282 2.018 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@@H](C)Cc1ccccc1F ZINC001331820919 968245318 /nfs/dbraw/zinc/24/53/18/968245318.db2.gz KMUBDWGWYYVBDS-RYUDHWBXSA-N 2 0 238.350 2.344 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+][C@@H]2CCC23CCCC3)C1 ZINC000693771048 968296158 /nfs/dbraw/zinc/29/61/58/968296158.db2.gz SNXOQXRZMWYUEF-IJLUTSLNSA-N 2 0 208.349 2.036 20 0 BEADRP C[C@]1(C[NH3+])CCCC[N@H+](Cc2cccc(O)c2)C1 ZINC001206541844 968365761 /nfs/dbraw/zinc/36/57/61/968365761.db2.gz LOTMGQRYGWNKFA-OAHLLOKOSA-N 2 0 248.370 2.343 20 0 BEADRP CC(C)(C)C[N@@H+]1CCCC[C@@](C)(C[NH3+])C1 ZINC001206541432 968366570 /nfs/dbraw/zinc/36/65/70/968366570.db2.gz HKXUHYUNBFACCT-ZDUSSCGKSA-N 2 0 212.381 2.483 20 0 BEADRP CC[C@@H](C)C[N@@H+]1CCCC[C@@](C)(C[NH3+])C1 ZINC001206541872 968367276 /nfs/dbraw/zinc/36/72/76/968367276.db2.gz MHFHLFXPOHUYID-OLZOCXBDSA-N 2 0 212.381 2.483 20 0 BEADRP C[C@@]1(C[NH3+])CCCC[N@H+](Cc2cccnc2)C1 ZINC001206541766 968368140 /nfs/dbraw/zinc/36/81/40/968368140.db2.gz JSGSHHSZLKYQKT-AWEZNQCLSA-N 2 0 233.359 2.033 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCCC[C@](C)(C[NH3+])C1 ZINC001206541873 968369373 /nfs/dbraw/zinc/36/93/73/968369373.db2.gz MHFHLFXPOHUYID-QWHCGFSZSA-N 2 0 212.381 2.483 20 0 BEADRP Cc1cccnc1C[N@@H+]1CCCC[C@](C)(C[NH3+])C1 ZINC001206549804 968376116 /nfs/dbraw/zinc/37/61/16/968376116.db2.gz PYVKUEUINPXHFC-OAHLLOKOSA-N 2 0 247.386 2.341 20 0 BEADRP Cc1ccc(C[N@@H+]2CCCC[C@@](C)(C[NH3+])C2)nc1 ZINC001206556811 968380736 /nfs/dbraw/zinc/38/07/36/968380736.db2.gz XNAGTOUHGODZLV-HNNXBMFYSA-N 2 0 247.386 2.341 20 0 BEADRP [NH3+]CCC[C@@H]([NH2+]C[C@H]1CCOC1)c1ccccc1 ZINC001119699276 968456544 /nfs/dbraw/zinc/45/65/44/968456544.db2.gz MGVZMLUZGDQOOJ-UKRRQHHQSA-N 2 0 248.370 2.093 20 0 BEADRP [NH3+]CCC[C@H]([NH2+]C[C@@H]1CCOC1)c1ccccc1 ZINC001119699277 968458266 /nfs/dbraw/zinc/45/82/66/968458266.db2.gz MGVZMLUZGDQOOJ-ZFWWWQNUSA-N 2 0 248.370 2.093 20 0 BEADRP [NH3+]CCC[C@@H]([NH2+]C[C@@H]1CCOC1)c1ccccc1 ZINC001119699274 968459007 /nfs/dbraw/zinc/45/90/07/968459007.db2.gz MGVZMLUZGDQOOJ-DZGCQCFKSA-N 2 0 248.370 2.093 20 0 BEADRP CCCC[C@H](O)C[NH2+]CCC[N@H+](C)CCCC ZINC001252108953 968591986 /nfs/dbraw/zinc/59/19/86/968591986.db2.gz UDUQUVIKASKVDV-AWEZNQCLSA-N 2 0 244.423 2.249 20 0 BEADRP Cc1cncc(C[N@H+](C)CC2CC[NH+](C)CC2)c1 ZINC001207157108 968664987 /nfs/dbraw/zinc/66/49/87/968664987.db2.gz VSIOXOKEIBRPLI-UHFFFAOYSA-N 2 0 247.386 2.164 20 0 BEADRP C[NH+](C)CC(C)(C)C[N@@H+]1CCCOC(C)(C)C1 ZINC001207287139 968716532 /nfs/dbraw/zinc/71/65/32/968716532.db2.gz YEUNGRYBRGBPIS-UHFFFAOYSA-N 2 0 242.407 2.075 20 0 BEADRP C[NH+]1CCC(C[NH+]2C[C@@H]3CCCC[C@H]3C2)CC1 ZINC001207391353 968745113 /nfs/dbraw/zinc/74/51/13/968745113.db2.gz HPHIPUKTJULXPK-GJZGRUSLSA-N 2 0 236.403 2.450 20 0 BEADRP CC1(C)C[N@H+](CC2CC[NH2+]CC2)CCC1(F)F ZINC001207435501 968770470 /nfs/dbraw/zinc/77/04/70/968770470.db2.gz IKUSBAHMRZZCKM-UHFFFAOYSA-N 2 0 246.345 2.353 20 0 BEADRP C[C@H]1CCC[N@H+](CCC2CC[NH+](C)CC2)C1 ZINC001207480264 968798546 /nfs/dbraw/zinc/79/85/46/968798546.db2.gz YZJATPZNKHXYRM-ZDUSSCGKSA-N 2 0 224.392 2.450 20 0 BEADRP C[NH+]1CCC(CC[N@@H+]2CCC[C@@H]3C[C@@H]32)CC1 ZINC001207487493 968802207 /nfs/dbraw/zinc/80/22/07/968802207.db2.gz LDTNLCDWAIPOJY-KGLIPLIRSA-N 2 0 222.376 2.203 20 0 BEADRP C[C@@H]1CCC[N@H+](C[C@@H]2CCCC[NH2+]C2)CC1 ZINC000829276004 968828575 /nfs/dbraw/zinc/82/85/75/968828575.db2.gz RLPKSISKKRXXLQ-ZIAGYGMSSA-N 2 0 224.392 2.498 20 0 BEADRP Cc1c[nH+]c(NC[C@H]2CCC[NH2+]C[C@@H]2C)cc1N ZINC001155034948 968858317 /nfs/dbraw/zinc/85/83/17/968858317.db2.gz ZHXBCUATWJAZLR-CMPLNLGQSA-N 2 0 248.374 2.020 20 0 BEADRP CCCC[C@H](C)[NH2+][C@@H]1CC[C@H]2C[N@H+](C)C[C@@H]21 ZINC001207836123 968895160 /nfs/dbraw/zinc/89/51/60/968895160.db2.gz GUTOINZQDWKYHI-XDQVBPFNSA-N 2 0 224.392 2.495 20 0 BEADRP CCCC[C@H](C)[NH2+][C@@H]1CC[C@H]2C[N@H+](C)C[C@H]21 ZINC001207836117 968896614 /nfs/dbraw/zinc/89/66/14/968896614.db2.gz GUTOINZQDWKYHI-IGQOVBAYSA-N 2 0 224.392 2.495 20 0 BEADRP C[N@H+]1CC=C(c2nccc3[nH]ccc32)CC1 ZINC001241307343 968970138 /nfs/dbraw/zinc/97/01/38/968970138.db2.gz FDPXPEBVOXQHBJ-UHFFFAOYSA-N 2 0 213.284 2.282 20 0 BEADRP C[NH+]1CCC(C)(C[N@@H+]2CCC(C)(C)C2)CC1 ZINC001208106946 968999901 /nfs/dbraw/zinc/99/99/01/968999901.db2.gz MAZYGIZEJSWYJB-UHFFFAOYSA-N 2 0 224.392 2.450 20 0 BEADRP C[N@@H+]1CCC=C(c2ccc3c(c2)C[NH2+]CC3)C1 ZINC001241569476 969063593 /nfs/dbraw/zinc/06/35/93/969063593.db2.gz BAGTVSIJLABLHD-UHFFFAOYSA-N 2 0 228.339 2.051 20 0 BEADRP CC[NH+]1CCC(C[N@H+](C)Cc2ccncc2)CC1 ZINC001208592427 969149016 /nfs/dbraw/zinc/14/90/16/969149016.db2.gz HNGDVTLVMPWBNI-UHFFFAOYSA-N 2 0 247.386 2.245 20 0 BEADRP CC[NH+]1CCC(C[N@H+](C)Cc2cccnc2)CC1 ZINC001208594333 969150373 /nfs/dbraw/zinc/15/03/73/969150373.db2.gz NGWCWBSCFXOJQD-UHFFFAOYSA-N 2 0 247.386 2.245 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2CCC[C@H](CF)C2)CC1 ZINC001208597985 969151154 /nfs/dbraw/zinc/15/11/54/969151154.db2.gz ORVWBQWFEVEDCU-CQSZACIVSA-N 2 0 242.382 2.400 20 0 BEADRP CC[NH+]1CCC(C[NH+]2CC(C)(C)C2)CC1 ZINC001208593925 969151977 /nfs/dbraw/zinc/15/19/77/969151977.db2.gz KNEMJRNHSBEGDL-UHFFFAOYSA-N 2 0 210.365 2.060 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2C[C@@H](F)C[C@H]2C)CC1 ZINC001208593647 969152626 /nfs/dbraw/zinc/15/26/26/969152626.db2.gz YJWYQNISPVNDSU-YPMHNXCESA-N 2 0 228.355 2.151 20 0 BEADRP CCCCC[C@@H](C)[NH2+]C[C@H](O)C[NH2+]C(C)(C)C ZINC001253406188 969164500 /nfs/dbraw/zinc/16/45/00/969164500.db2.gz BXRGOZUMWHQRKQ-OLZOCXBDSA-N 2 0 244.423 2.294 20 0 BEADRP CSC(C)(C)CC[NH2+]CCC[NH+](C)C ZINC000385197875 969190126 /nfs/dbraw/zinc/19/01/26/969190126.db2.gz GNJBMPMKRZLVLS-UHFFFAOYSA-N 2 0 218.410 2.059 20 0 BEADRP CC[NH+]1C[C@@H]2C[NH+](CCC3CCCC3)C[C@H]2C1 ZINC001208699314 969199536 /nfs/dbraw/zinc/19/95/36/969199536.db2.gz TWYORUIJNNCIKI-HUUCEWRRSA-N 2 0 236.403 2.450 20 0 BEADRP c1ccc(C[N@H+]2CC[C@H](C[NH+]3CCC3)C2)cc1 ZINC001208947516 969313435 /nfs/dbraw/zinc/31/34/35/969313435.db2.gz LMYGICLKKTUERM-OAHLLOKOSA-N 2 0 230.355 2.214 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]CCC1CCC1)C2 ZINC001169097924 969391951 /nfs/dbraw/zinc/39/19/51/969391951.db2.gz FIRHYKYNRFTWBU-BTTYYORXSA-N 2 0 222.376 2.391 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]CC1CCC1)C2 ZINC001169081563 969401909 /nfs/dbraw/zinc/40/19/09/969401909.db2.gz SZBPMKDWNNTZAS-XYYAHUGASA-N 2 0 208.349 2.001 20 0 BEADRP C[C@H]1CCC[C@H]1[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169082288 969403178 /nfs/dbraw/zinc/40/31/78/969403178.db2.gz YOQHIUQNLZTACV-PDWCTOEPSA-N 2 0 222.376 2.390 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]CC1(C)CC1)C2 ZINC001169082492 969404055 /nfs/dbraw/zinc/40/40/55/969404055.db2.gz ZWCNCHRPBRGSIY-ZSBIGDGJSA-N 2 0 208.349 2.001 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+][C@@H]1CCCC[C@H]1F)C2 ZINC001169081317 969405058 /nfs/dbraw/zinc/40/50/58/969405058.db2.gz QVRLKSPZVIHRDH-XVIXHAIJSA-N 2 0 240.366 2.482 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H](Nc1cccc(C[NH3+])c1)C2 ZINC001169090905 969408507 /nfs/dbraw/zinc/40/85/07/969408507.db2.gz NQMTTWHUSWMRIE-QKDCVEJESA-N 2 0 245.370 2.182 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](Nc1cccc(C[NH3+])c1)C2 ZINC001169090904 969409846 /nfs/dbraw/zinc/40/98/46/969409846.db2.gz NQMTTWHUSWMRIE-QDMKHBRRSA-N 2 0 245.370 2.182 20 0 BEADRP C[C@H]1CCC[N@@H+]([C@@H]2C[C@H]3CC[C@@H](C2)[NH+]3C)C1 ZINC001169123419 969422009 /nfs/dbraw/zinc/42/20/09/969422009.db2.gz LGOKUHAUQIJXDM-FQUUOJAGSA-N 2 0 222.376 2.344 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CCC[C@H](F)CC1)C2 ZINC001169124919 969426714 /nfs/dbraw/zinc/42/67/14/969426714.db2.gz HDTROSXKIQMMOY-FQUUOJAGSA-N 2 0 240.366 2.436 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+][C@H]1C=CCCC1)C2 ZINC001169115282 969453010 /nfs/dbraw/zinc/45/30/10/969453010.db2.gz ICHMIQQWVOQYMS-XDQVBPFNSA-N 2 0 220.360 2.310 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CCC3(CCC3)C1)C2 ZINC001169146441 969465804 /nfs/dbraw/zinc/46/58/04/969465804.db2.gz PPFQJBLAOFVQOQ-BTTYYORXSA-N 2 0 234.387 2.488 20 0 BEADRP [NH3+]CCC[C@@H]1CCCC[N@@H+]([C@H]2CCCOC2)C1 ZINC001254376266 969590674 /nfs/dbraw/zinc/59/06/74/969590674.db2.gz WSHQLFDGDASRQL-KBPBESRZSA-N 2 0 240.391 2.006 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH2+]C[C@@H]2CCC[C@H]2F)CC1 ZINC001254497033 969658552 /nfs/dbraw/zinc/65/85/52/969658552.db2.gz FGIFIPQXYSVTRR-YNEHKIRRSA-N 2 0 228.355 2.199 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH2+]C(C)(C)C2CC2)CC1 ZINC001254497000 969663472 /nfs/dbraw/zinc/66/34/72/969663472.db2.gz CVHXUKMSVAOFCL-GFCCVEGCSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCC[N@H+](C)CC1)c1ccc(N)cc1 ZINC001254506811 969671161 /nfs/dbraw/zinc/67/11/61/969671161.db2.gz ATXGNMISESYXHR-IUODEOHRSA-N 2 0 247.386 2.404 20 0 BEADRP CCC1([NH2+][C@@H]2CCC[N@H+](C)CC2)CCC1 ZINC001254510898 969677595 /nfs/dbraw/zinc/67/75/95/969677595.db2.gz RCOZCGMIGQORBI-GFCCVEGCSA-N 2 0 210.365 2.393 20 0 BEADRP CC[C@H]1CCC[N@@H+]1[C@H]1CCC[NH+](C)CC1 ZINC001254522078 969698629 /nfs/dbraw/zinc/69/86/29/969698629.db2.gz BMSUZWITJLCNIM-STQMWFEESA-N 2 0 210.365 2.345 20 0 BEADRP CSC1CC[NH+]([C@@H]2CCC[N@H+](C)CC2)CC1 ZINC001254522485 969709180 /nfs/dbraw/zinc/70/91/80/969709180.db2.gz GTFDACRWZJKWTJ-GFCCVEGCSA-N 2 0 242.432 2.298 20 0 BEADRP C[N@H+](CC1CCC1)[C@@H]1CCC[NH+](C)CC1 ZINC001254522188 969709833 /nfs/dbraw/zinc/70/98/33/969709833.db2.gz DOBKPESONSXYBD-CYBMUJFWSA-N 2 0 210.365 2.203 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH+]2C[C@@H]3[C@H](C2)C3(C)C)CC1 ZINC001254524473 969710350 /nfs/dbraw/zinc/71/03/50/969710350.db2.gz CDHOCYGJUHNHRA-RWMBFGLXSA-N 2 0 222.376 2.059 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH+]2CCC3(CCC3)C2)CC1 ZINC001254525191 969717134 /nfs/dbraw/zinc/71/71/34/969717134.db2.gz HFLALUBRHCSESU-ZDUSSCGKSA-N 2 0 222.376 2.347 20 0 BEADRP C[N@H+](CCC1CC1)[C@@H]1CCC[NH+](C)CC1 ZINC001254530568 969726592 /nfs/dbraw/zinc/72/65/92/969726592.db2.gz YSAYPVWCOHNUFA-CYBMUJFWSA-N 2 0 210.365 2.203 20 0 BEADRP Cc1cc[nH+]c(NCC[C@H]2CCC[NH2+]2)c1C ZINC001169558629 969753858 /nfs/dbraw/zinc/75/38/58/969753858.db2.gz KMUTZZQWEHEKHS-GFCCVEGCSA-N 2 0 219.332 2.252 20 0 BEADRP Cc1c(N)cc[nH+]c1NC(C)(C)CC[NH+](C)C ZINC001169711296 969829178 /nfs/dbraw/zinc/82/91/78/969829178.db2.gz IIETWKDIHFEDCY-UHFFFAOYSA-N 2 0 236.363 2.114 20 0 BEADRP C[NH+](C)CCCCC[NH2+]C1Cc2ccccc2C1 ZINC001255012080 969845074 /nfs/dbraw/zinc/84/50/74/969845074.db2.gz MBVITKAVPCMVJB-UHFFFAOYSA-N 2 0 246.398 2.475 20 0 BEADRP C[C@@H](C[NH2+]C1CCOCC1)CC(C)(C)CC[NH3+] ZINC001255036363 969851826 /nfs/dbraw/zinc/85/18/26/969851826.db2.gz YKDUFCUHRMZIGY-GFCCVEGCSA-N 2 0 242.407 2.156 20 0 BEADRP Cc1cccc(C)c1C[N@@H+]1CC[NH2+][C@H](C)CC1 ZINC001210476639 969899564 /nfs/dbraw/zinc/89/95/64/969899564.db2.gz WLVHUKFEHXARLY-CQSZACIVSA-N 2 0 232.371 2.487 20 0 BEADRP CCCC[C@H](C)[NH+]1C[C@H]2C[NH+](CC)C[C@@H]2C1 ZINC001255334041 970115220 /nfs/dbraw/zinc/11/52/20/970115220.db2.gz KXGLLGPODUIAFA-BFHYXJOUSA-N 2 0 224.392 2.449 20 0 BEADRP CCCC[C@@H](C)[N@H+]1C[C@H]2C[NH+](CC)C[C@H]2C1 ZINC001255334043 970116378 /nfs/dbraw/zinc/11/63/78/970116378.db2.gz KXGLLGPODUIAFA-MCIONIFRSA-N 2 0 224.392 2.449 20 0 BEADRP C[N@@H+]1CCC[C@H](n2cc(C[NH3+])c3ccccc32)C1 ZINC001255468900 970195238 /nfs/dbraw/zinc/19/52/38/970195238.db2.gz ZDSGLBCGHHPTLV-ZDUSSCGKSA-N 2 0 243.354 2.367 20 0 BEADRP C[N@@H+]1CCC[C@@H](n2ccc3ccc(C[NH3+])cc32)C1 ZINC001255470713 970197162 /nfs/dbraw/zinc/19/71/62/970197162.db2.gz OXFNCMLGWJMFGJ-CQSZACIVSA-N 2 0 243.354 2.367 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3C)C1 ZINC001170098022 970266390 /nfs/dbraw/zinc/26/63/90/970266390.db2.gz JSPHJAIIQVNIML-VJTDZRGJSA-N 2 0 222.376 2.390 20 0 BEADRP C[C@H]1CC[C@H]([NH2+]CC23CC[NH+](CC2)CC3)C1 ZINC001170099475 970282262 /nfs/dbraw/zinc/28/22/62/970282262.db2.gz ASGRCVKYJNUSII-STQMWFEESA-N 2 0 222.376 2.251 20 0 BEADRP C[C@@H]1C[N@H+](CCC2CCCC2)CC[C@@H]1C[NH3+] ZINC000300719220 970297851 /nfs/dbraw/zinc/29/78/51/970297851.db2.gz AUMLOZMBKJYSCR-TZMCWYRMSA-N 2 0 224.392 2.483 20 0 BEADRP CC[N@@H+]1CCc2cc(C3=CC[NH2+]C3)ccc2C1 ZINC001243107984 970340515 /nfs/dbraw/zinc/34/05/15/970340515.db2.gz ASFDPOSBKUXGHE-UHFFFAOYSA-N 2 0 228.339 2.051 20 0 BEADRP C[C@@H]([NH3+])c1ccn(C2C[C@H]3CCC[C@@H](C2)[N@H+]3C)n1 ZINC001255668892 970448465 /nfs/dbraw/zinc/44/84/65/970448465.db2.gz OUWSTKBOCHXQDI-FKJOKYEKSA-N 2 0 248.374 2.091 20 0 BEADRP COc1ccc([C@@H](C)[NH2+]CCC(C)(C)[NH3+])cc1 ZINC000302589368 970448911 /nfs/dbraw/zinc/44/89/11/970448911.db2.gz HXZIMAFGSISKOW-LLVKDONJSA-N 2 0 236.359 2.473 20 0 BEADRP C[C@@H]1C[N@@H+](C2C[C@H]3CCC[C@@H](C2)[NH+]3C)C[C@@H]1F ZINC001255673855 970452658 /nfs/dbraw/zinc/45/26/58/970452658.db2.gz GMUVBRSUCUXINJ-YIPFDTCYSA-N 2 0 240.366 2.292 20 0 BEADRP Cc1ccc(C[C@@H](C)[NH2+]C[C@H]2CC[N@H+](C)C2)cc1 ZINC001255773955 970478350 /nfs/dbraw/zinc/47/83/50/970478350.db2.gz SHSVAGDAKJAAGA-GDBMZVCRSA-N 2 0 246.398 2.467 20 0 BEADRP Cc1ccc(C[C@H](C)[NH2+]CCCC[NH3+])cc1 ZINC001255774570 970480875 /nfs/dbraw/zinc/48/08/75/970480875.db2.gz IDTNQJSDXWFFJZ-ZDUSSCGKSA-N 2 0 220.360 2.255 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](C[C@@H]2CC3CCC2CC3)C1 ZINC000400113418 970552977 /nfs/dbraw/zinc/55/29/77/970552977.db2.gz LGGAQUFIKSPZQB-SHWKFHJASA-N 2 0 236.403 2.354 20 0 BEADRP CC[C@@H]1C[C@@H]([NH2+][C@H]2CCC[N@H+](C)CC2)CCO1 ZINC001170171745 970563434 /nfs/dbraw/zinc/56/34/34/970563434.db2.gz UDTRZWWFLCSWJE-MELADBBJSA-N 2 0 240.391 2.018 20 0 BEADRP CCC[N@H+](CCC[NH3+])[C@H]1CCO[C@H](CC)C1 ZINC001170172492 970567350 /nfs/dbraw/zinc/56/73/50/970567350.db2.gz ZQBJNKWRRPRBPD-QWHCGFSZSA-N 2 0 228.380 2.005 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]C(C)(C)C ZINC001255940030 970571459 /nfs/dbraw/zinc/57/14/59/970571459.db2.gz LTZRMYMESYWREM-NSHDSACASA-N 2 0 200.370 2.495 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]CC1CCOCC1 ZINC001255940577 970572109 /nfs/dbraw/zinc/57/21/09/970572109.db2.gz DQOQJCBYLMGWFL-ZDUSSCGKSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@@H]([NH2+]Cc1ccccc1F)C1CC[NH2+]CC1 ZINC000400318568 970572165 /nfs/dbraw/zinc/57/21/65/970572165.db2.gz AZAZYYBERPIRDE-LLVKDONJSA-N 2 0 236.334 2.303 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+][C@@H](CO)CC(C)C ZINC001255941340 970573629 /nfs/dbraw/zinc/57/36/29/970573629.db2.gz ORTFRKBXGWYEJJ-UONOGXRCSA-N 2 0 244.423 2.103 20 0 BEADRP CC[C@H](C)[C@@H](CO)[NH2+][C@H](C)CC[NH+](CC)CC ZINC001255943566 970578357 /nfs/dbraw/zinc/57/83/57/970578357.db2.gz OBELEOGVZFPWAS-BFHYXJOUSA-N 2 0 244.423 2.103 20 0 BEADRP CCC(CC)C[NH2+][C@@H](C)C1CC[NH2+]CC1 ZINC000400492587 970596589 /nfs/dbraw/zinc/59/65/89/970596589.db2.gz ZUUJOSOBTJLTKP-NSHDSACASA-N 2 0 212.381 2.400 20 0 BEADRP CS[C@@H]1CC[C@H]([NH2+][C@@H](C)[C@H]2CCC[NH2+]2)C1 ZINC000400366397 970583063 /nfs/dbraw/zinc/58/30/63/970583063.db2.gz FHHCBLNXUUOLAC-NNYUYHANSA-N 2 0 228.405 2.001 20 0 BEADRP CS[C@@H]1CC[C@H]([NH2+][C@H](C)[C@@H]2CCC[NH2+]2)C1 ZINC000400366395 970583176 /nfs/dbraw/zinc/58/31/76/970583176.db2.gz FHHCBLNXUUOLAC-KXNHARMFSA-N 2 0 228.405 2.001 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)c1cccc(O)c1 ZINC000400437892 970589827 /nfs/dbraw/zinc/58/98/27/970589827.db2.gz NFAQIKMBFCXYSP-NWDGAFQWSA-N 2 0 248.370 2.431 20 0 BEADRP Cc1cc(NCCCC[NH+](C)C)cc(C)[nH+]1 ZINC000304426664 970591971 /nfs/dbraw/zinc/59/19/71/970591971.db2.gz QFPUNGFASDRABV-UHFFFAOYSA-N 2 0 221.348 2.452 20 0 BEADRP Cc1cc(NC2(C)CC[NH2+]CC2)cc(C)[nH+]1 ZINC000304416206 970593653 /nfs/dbraw/zinc/59/36/53/970593653.db2.gz OTBOLISSQXABLL-UHFFFAOYSA-N 2 0 219.332 2.252 20 0 BEADRP C[C@@H](CC1CC1)[NH2+][C@@H](C)C1CC[NH2+]CC1 ZINC000400501916 970596285 /nfs/dbraw/zinc/59/62/85/970596285.db2.gz CGHUXMILBJCRBL-QWRGUYRKSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H](C)C1)C1CC[NH2+]CC1 ZINC000400519676 970598364 /nfs/dbraw/zinc/59/83/64/970598364.db2.gz GXRKCHJPEYRNFU-NTZNESFSSA-N 2 0 210.365 2.153 20 0 BEADRP Cc1cc(NCC[C@H]2CCC[NH2+]2)cc(C)[nH+]1 ZINC000304472828 970598635 /nfs/dbraw/zinc/59/86/35/970598635.db2.gz ZQCCFFMGVHJFFP-GFCCVEGCSA-N 2 0 219.332 2.252 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[C@@H](C)C1)C1CC[NH2+]CC1 ZINC000400519677 970598749 /nfs/dbraw/zinc/59/87/49/970598749.db2.gz GXRKCHJPEYRNFU-WZRBSPASSA-N 2 0 210.365 2.153 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H]1CCCc2c(O)cccc21 ZINC001327841777 972755067 /nfs/dbraw/zinc/75/50/67/972755067.db2.gz ZMRFYFTZMOPSKS-BXUZGUMPSA-N 2 0 248.370 2.357 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H](C)CCCc1cccnc1 ZINC001327840120 972755646 /nfs/dbraw/zinc/75/56/46/972755646.db2.gz MSBNIDSBLMMHAO-KGLIPLIRSA-N 2 0 249.402 2.380 20 0 BEADRP C[C@@H]1C[N@@H+](C2CCCC2)CCC[C@@H]1C[NH3+] ZINC001246559493 972785598 /nfs/dbraw/zinc/78/55/98/972785598.db2.gz ANIRXWNIHJRNEN-VXGBXAGGSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@H](CC(F)(F)F)[N@@H+]1CC[C@@H]([NH3+])[C@H](F)CC1 ZINC001246589586 972987323 /nfs/dbraw/zinc/98/73/23/972987323.db2.gz SSIDMUYCUBALBU-IWSPIJDZSA-N 2 0 242.260 2.089 20 0 BEADRP C[NH2+]CC1C[NH+]([C@@H]2C[C@@H](C)CC(C)(C)C2)C1 ZINC001246594795 973004685 /nfs/dbraw/zinc/00/46/85/973004685.db2.gz FGMMXBHXCDJCLU-DGCLKSJQSA-N 2 0 224.392 2.352 20 0 BEADRP C1[C@@H]2C[C@@H]([N@@H+]3CCC[C@]34CCC[NH2+]C4)C[C@H]12 ZINC001246605920 973023249 /nfs/dbraw/zinc/02/32/49/973023249.db2.gz CZAMZKQOJJLUEE-CRWXNKLISA-N 2 0 220.360 2.003 20 0 BEADRP C[C@@H]1CC[C@H]([N@H+]2C[C@H]3[C@H](CCC3(F)F)C2)C[NH2+]1 ZINC001246654537 973067103 /nfs/dbraw/zinc/06/71/03/973067103.db2.gz ICSDDTWLEVWPPT-WYUUTHIRSA-N 2 0 244.329 2.104 20 0 BEADRP C[C@H]1C[C@H]([N@@H+]2CCCC3(C[NH2+]C3)C2)C[C@@H](C)C1 ZINC001246794275 973098122 /nfs/dbraw/zinc/09/81/22/973098122.db2.gz ZMEGEUCAROVEQS-WDNDVIMCSA-N 2 0 236.403 2.497 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H]2CC[C@H]3[C@@H](C2)C3(F)F)C1 ZINC001328616284 973194229 /nfs/dbraw/zinc/19/42/29/973194229.db2.gz USJAZXGRVROKJT-CSYMLDBXSA-N 2 0 244.329 2.280 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H]1CCc2c1cccc2OC ZINC001329024423 973431910 /nfs/dbraw/zinc/43/19/10/973431910.db2.gz RQNUPYZTVVYGAL-RISCZKNCSA-N 2 0 248.370 2.270 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@@H](C)Cc1ccsc1 ZINC001329023478 973433899 /nfs/dbraw/zinc/43/38/99/973433899.db2.gz IMFQIFJRIYCTRR-QWRGUYRKSA-N 2 0 226.389 2.267 20 0 BEADRP C[C@@H]1CC[C@@H]([N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)C1 ZINC001246935406 973614032 /nfs/dbraw/zinc/61/40/32/973614032.db2.gz VDBMWDDJAWCDJQ-YIYPIFLZSA-N 2 0 222.376 2.106 20 0 BEADRP COC[C@H]1CCC[N@H+](CCCCCCC[NH3+])C1 ZINC000234730042 973729274 /nfs/dbraw/zinc/72/92/74/973729274.db2.gz DUJJNUBRVWQFDE-AWEZNQCLSA-N 2 0 242.407 2.254 20 0 BEADRP C[C@H]1C[C@H]1C[N@@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001329433401 973772308 /nfs/dbraw/zinc/77/23/08/973772308.db2.gz NAZQHWCFYMACHC-STQMWFEESA-N 2 0 222.376 2.108 20 0 BEADRP C1=C[C@@H]2CC[C@H]1C[C@H]2[NH2+]CCC[NH+]1CCCC1 ZINC001332834037 1169968778 /nfs/dbraw/zinc/96/87/78/1169968778.db2.gz QREPHXIJYQSJKS-RRFJBIMHSA-N 2 0 234.387 2.417 20 0 BEADRP C[NH+]1C(C)(C)CC([NH2+][C@@H]2CCOC2)CC1(C)C ZINC001171614349 974115572 /nfs/dbraw/zinc/11/55/72/974115572.db2.gz YDHPZNJTNMJQOA-LLVKDONJSA-N 2 0 240.391 2.016 20 0 BEADRP CC(C)OCC[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172100101 974344028 /nfs/dbraw/zinc/34/40/28/974344028.db2.gz MVWMFCYCGMICQF-ZSOGYDGISA-N 2 0 240.391 2.016 20 0 BEADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC[C@@H]1CF)C2 ZINC001172130196 974356723 /nfs/dbraw/zinc/35/67/23/974356723.db2.gz HQPRPJSYWLKMLY-XJFOESAGSA-N 2 0 240.366 2.436 20 0 BEADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]C[C@H]1C[C@H](F)C1)C2 ZINC001172101720 974361540 /nfs/dbraw/zinc/36/15/40/974361540.db2.gz AAZKMYMKOSTMOT-HLHWALHNSA-N 2 0 240.366 2.339 20 0 BEADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC3(CC3)C1)C2 ZINC001172121471 974388863 /nfs/dbraw/zinc/38/88/63/974388863.db2.gz QUHFVADYVUYSHP-BTTYYORXSA-N 2 0 234.387 2.488 20 0 BEADRP [NH3+]CCCCCCC[NH2+]C1C[C@H]2CC[C@@H](C1)O2 ZINC001172224855 974460476 /nfs/dbraw/zinc/46/04/76/974460476.db2.gz WXQXCDCLRBWUMW-AGUYFDCRSA-N 2 0 240.391 2.195 20 0 BEADRP Cc1csc(C[N@@H+]2CC[C@@H]([NH3+])[C@H](F)CC2)c1 ZINC001206163807 974513965 /nfs/dbraw/zinc/51/39/65/974513965.db2.gz GCTDDVXZXGKPLO-VXGBXAGGSA-N 2 0 242.363 2.318 20 0 BEADRP C[NH+](C)[C@H]1CC[C@H]([NH2+][C@H]2COC(C)(C)C2)CC1 ZINC001172280019 974515367 /nfs/dbraw/zinc/51/53/67/974515367.db2.gz RAIBSARBFMLWIM-JHJVBQTASA-N 2 0 240.391 2.016 20 0 BEADRP C[C@@H]1CC[C@@H]([N@H+]2C[C@H]3C[NH+](C)C[C@H]3C2)C[C@H]1C ZINC001172380125 974583920 /nfs/dbraw/zinc/58/39/20/974583920.db2.gz RHQBLNLGDJNJDQ-ARILJUKYSA-N 2 0 236.403 2.305 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CCSCC[NH3+])C[C@@H]1C ZINC001172365149 974641466 /nfs/dbraw/zinc/64/14/66/974641466.db2.gz CRQPNALZAICAAC-WOPDTQHZSA-N 2 0 230.421 2.093 20 0 BEADRP CCOCC[C@@H](C)[NH2+]CC1CC[NH+](CC)CC1 ZINC001172409760 974671817 /nfs/dbraw/zinc/67/18/17/974671817.db2.gz BNLTYIBWNHUYSR-CYBMUJFWSA-N 2 0 242.407 2.123 20 0 BEADRP CCOc1ccc(C[NH2+]CC[C@H](C)[NH2+]C)cc1 ZINC001331420753 974712392 /nfs/dbraw/zinc/71/23/92/974712392.db2.gz ZIJBGBHZYBOUQH-LBPRGKRZSA-N 2 0 236.359 2.173 20 0 BEADRP CC(C)OCC[C@@H](C)[N@H+](CCC[NH3+])C(C)C ZINC001172434952 974745265 /nfs/dbraw/zinc/74/52/65/974745265.db2.gz WCZNMJNNONNWJH-CYBMUJFWSA-N 2 0 230.396 2.249 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@H](C)C1CCSCC1 ZINC001331833961 974829882 /nfs/dbraw/zinc/82/98/82/974829882.db2.gz KAEJBYIAPOZHFS-WDEREUQCSA-N 2 0 230.421 2.106 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@@H]([NH3+])[C@H](F)CC2)s1 ZINC001206165325 974830101 /nfs/dbraw/zinc/83/01/01/974830101.db2.gz NISARWPKDXUQBF-VXGBXAGGSA-N 2 0 242.363 2.318 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@H]([NH2+]C[C@H]3CC=CCC3)[C@H]2C1 ZINC001204089635 974877831 /nfs/dbraw/zinc/87/78/31/974877831.db2.gz PUGZMSHURQBHBW-AJNGGQMLSA-N 2 0 234.387 2.273 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@H]([NH2+]C[C@@H]3CC=CCC3)[C@@H]2C1 ZINC001204089636 974878591 /nfs/dbraw/zinc/87/85/91/974878591.db2.gz PUGZMSHURQBHBW-BARDWOONSA-N 2 0 234.387 2.273 20 0 BEADRP Cc1ccc2c(c1)C[C@H]([NH2+]CC1CN(C)C1)CC2 ZINC001172840887 974956059 /nfs/dbraw/zinc/95/60/59/974956059.db2.gz FBXHCRQTQNVHAM-MRXNPFEDSA-N 2 0 244.382 2.004 20 0 BEADRP CO[C@H]1CCC[C@H]([NH2+]Cc2ccccc2C[NH3+])C1 ZINC001172924668 974971175 /nfs/dbraw/zinc/97/11/75/974971175.db2.gz XLEFVHHAGZAGMY-GJZGRUSLSA-N 2 0 248.370 2.193 20 0 BEADRP CCCOC1CCC([N@@H+]2CCC[C@@H]([NH3+])C2)CC1 ZINC001173092579 975015382 /nfs/dbraw/zinc/01/53/82/975015382.db2.gz VMGOKYRZNCKEPO-IYXRBSQSSA-N 2 0 240.391 2.147 20 0 BEADRP CC[NH+](CC)C1CCC([NH2+][C@H](C)COC)CC1 ZINC001173103402 975022412 /nfs/dbraw/zinc/02/24/12/975022412.db2.gz AUOYMOQFZZLGHY-IYXRBSQSSA-N 2 0 242.407 2.264 20 0 BEADRP C([C@@H]1C[C@H]2C[C@H]2C1)[N@@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001330584321 975049504 /nfs/dbraw/zinc/04/95/04/975049504.db2.gz HVBOOMSJWUXTSW-QDMKHBRRSA-N 2 0 248.414 2.498 20 0 BEADRP C[C@H]1C[C@H](n2ccnc2[C@H]2CCC[NH2+]C2)CCO1 ZINC001173173276 975053847 /nfs/dbraw/zinc/05/38/47/975053847.db2.gz FGAIMTMPGVTPBC-RWMBFGLXSA-N 2 0 249.358 2.090 20 0 BEADRP CCCC[C@@H](CC(C)C)[NH2+]CCOCC[NH3+] ZINC001173250196 975088236 /nfs/dbraw/zinc/08/82/36/975088236.db2.gz PGWGLIGRYXQSQE-ZDUSSCGKSA-N 2 0 230.396 2.156 20 0 BEADRP C[C@@H]1CC[C@H]1[NH2+][C@H]1CC[NH2+]C12CCCC2 ZINC001332421408 975095254 /nfs/dbraw/zinc/09/52/54/975095254.db2.gz PREMKJCDHOMIFY-UTUOFQBUSA-N 2 0 208.349 2.049 20 0 BEADRP CC[C@@H]1CC[C@@H]([NH2+][C@@H]2CCC[C@H]([NH3+])C2)C1 ZINC001173260891 975110183 /nfs/dbraw/zinc/11/01/83/975110183.db2.gz PISDPAXZQOFEBA-YVECIDJPSA-N 2 0 210.365 2.425 20 0 BEADRP CCC[N@H+](CCC[NH3+])[C@H](C)CSCC ZINC001173292873 975171072 /nfs/dbraw/zinc/17/10/72/975171072.db2.gz SHRNVCNJNKFZHT-LLVKDONJSA-N 2 0 218.410 2.189 20 0 BEADRP CC[C@@H]1CC[C@@H]([N@@H+]2C[C@H]3C[C@@]3(C[NH+](C)C)C2)C1 ZINC001173295498 975179882 /nfs/dbraw/zinc/17/98/82/975179882.db2.gz QFTBXVOOFBOOJQ-KBUPBQIOSA-N 2 0 236.403 2.449 20 0 BEADRP CCSC[C@@H](C)[NH2+][C@H]1CCN(CC(C)C)C1 ZINC001173296311 975183562 /nfs/dbraw/zinc/18/35/62/975183562.db2.gz RMDGTQSJSIRBMG-OLZOCXBDSA-N 2 0 244.448 2.448 20 0 BEADRP CCSC[C@H](C)[NH+]1C[C@@H]2C[NH+](CC)C[C@H]2C1 ZINC001173307680 975218083 /nfs/dbraw/zinc/21/80/83/975218083.db2.gz IRLUJQRTHQEAAV-AVGNSLFASA-N 2 0 242.432 2.012 20 0 BEADRP Cc1sccc1C[N@@H+]1CC[C@@H]([NH3+])[C@@H](F)CC1 ZINC001206200439 975377472 /nfs/dbraw/zinc/37/74/72/975377472.db2.gz RPYGJNMGQYKAIO-NWDGAFQWSA-N 2 0 242.363 2.318 20 0 BEADRP CC[N@@H+]1CCC[C@H](C[NH2+][C@H](C)[C@@H]2CC2(F)F)C1 ZINC001333338330 975675186 /nfs/dbraw/zinc/67/51/86/975675186.db2.gz OHEPKJYQWQFTHC-UTUOFQBUSA-N 2 0 246.345 2.352 20 0 BEADRP C[C@H](c1cccc(O[C@H]2CC[N@H+](C)C2)c1)[NH+](C)C ZINC001229625582 976917201 /nfs/dbraw/zinc/91/72/01/976917201.db2.gz IDQDXBKJMSGZLZ-DOMZBBRYSA-N 2 0 248.370 2.392 20 0 BEADRP Cc1cc(Nc2cc[nH+]c3c2CCC3)cc[nH+]1 ZINC001174654190 976943943 /nfs/dbraw/zinc/94/39/43/976943943.db2.gz VGYLWKHWLRRFEZ-UHFFFAOYSA-N 2 0 225.295 2.439 20 0 BEADRP C[NH+](C)Cc1ccccc1O[C@H]1CCC[N@H+](C)C1 ZINC001229699276 976948586 /nfs/dbraw/zinc/94/85/86/976948586.db2.gz MIJKMXOPJICLCI-AWEZNQCLSA-N 2 0 248.370 2.221 20 0 BEADRP CC[N@@H+]1CC[C@H](Oc2ccccc2C[NH+](C)C)C1 ZINC001229699990 976950763 /nfs/dbraw/zinc/95/07/63/976950763.db2.gz UJRNYRJWGOBWDG-AWEZNQCLSA-N 2 0 248.370 2.221 20 0 BEADRP C[NH+](C)Cc1ccccc1NC1=CCC[N@H+](C)C1 ZINC001175580648 977604891 /nfs/dbraw/zinc/60/48/91/977604891.db2.gz OQHABKNPFPNOKF-UHFFFAOYSA-N 2 0 245.370 2.380 20 0 BEADRP c1cc(N2CC[C@@H](C[NH+]3CCCC3)C2)cc[nH+]1 ZINC001336396312 977658523 /nfs/dbraw/zinc/65/85/23/977658523.db2.gz KCDGRRBMEIOSRE-ZDUSSCGKSA-N 2 0 231.343 2.004 20 0 BEADRP CO[C@H]1CCC[N@H+](Cc2cc3c[nH+]ccc3[nH]2)C1 ZINC001232011743 977837968 /nfs/dbraw/zinc/83/79/68/977837968.db2.gz OKNCCSNIECMAKS-ZDUSSCGKSA-N 2 0 245.326 2.174 20 0 BEADRP C[C@@H]1CC[N@H+](Cc2cc3c[nH+]ccc3[nH]2)C1 ZINC001232011415 977838896 /nfs/dbraw/zinc/83/88/96/977838896.db2.gz JYWFNZXNLLYQLB-SNVBAGLBSA-N 2 0 215.300 2.405 20 0 BEADRP CO[C@@H](C)C1C[NH+](Cc2cc3c[nH+]ccc3[nH]2)C1 ZINC001232017192 977844491 /nfs/dbraw/zinc/84/44/91/977844491.db2.gz MQDGGFTYFKZJJY-JTQLQIEISA-N 2 0 245.326 2.030 20 0 BEADRP C[NH+](C)[C@@H]1CC[C@@H]2C[N@H+](Cc3ccoc3)C[C@@H]2C1 ZINC001336889257 978029783 /nfs/dbraw/zinc/02/97/83/978029783.db2.gz QITRCIQNIMPIFD-QLFBSQMISA-N 2 0 248.370 2.442 20 0 BEADRP C[C@@H]1C[C@@H]([NH+]2CCCC2)CN1c1cc[nH+]cc1 ZINC001336908701 978050072 /nfs/dbraw/zinc/05/00/72/978050072.db2.gz GVRINRUBFFVBER-TZMCWYRMSA-N 2 0 231.343 2.145 20 0 BEADRP C[C@@]1(C[NH3+])CCC[N@H+](Cc2ccncc2)CC1 ZINC001206292888 978289892 /nfs/dbraw/zinc/28/98/92/978289892.db2.gz FKJFAMSPMJIIBW-CQSZACIVSA-N 2 0 233.359 2.033 20 0 BEADRP C[C@]1(C[NH3+])CCC[N@H+](C[C@@H]2CCC=CO2)CC1 ZINC001206293268 978296476 /nfs/dbraw/zinc/29/64/76/978296476.db2.gz GYCVALYSUFTMPZ-KBPBESRZSA-N 2 0 238.375 2.130 20 0 BEADRP C[NH+](C)CCCOC1CC[NH+](C(C)(C)C)CC1 ZINC001206296525 978313219 /nfs/dbraw/zinc/31/32/19/978313219.db2.gz NMLFAYNQTXRVOL-UHFFFAOYSA-N 2 0 242.407 2.218 20 0 BEADRP Cc1cccnc1C[N@@H+]1CCC[C@@](C)(C[NH3+])CC1 ZINC001206303126 978346572 /nfs/dbraw/zinc/34/65/72/978346572.db2.gz BMBGLRZVBJFKJE-OAHLLOKOSA-N 2 0 247.386 2.341 20 0 BEADRP C[C@@]1(C[NH3+])CCC[N@H+](Cc2cncs2)CC1 ZINC001206303149 978359443 /nfs/dbraw/zinc/35/94/43/978359443.db2.gz BUVCCHKGUMFKET-GFCCVEGCSA-N 2 0 239.388 2.094 20 0 BEADRP C[C@]1(C[NH3+])CCC[N@H+](Cc2cncs2)CC1 ZINC001206303150 978359730 /nfs/dbraw/zinc/35/97/30/978359730.db2.gz BUVCCHKGUMFKET-LBPRGKRZSA-N 2 0 239.388 2.094 20 0 BEADRP Cc1cc(C[N@@H+]2CCC[C@@](C)(C[NH3+])CC2)ccn1 ZINC001206305096 978383549 /nfs/dbraw/zinc/38/35/49/978383549.db2.gz SVCYLTSQBAEGFT-OAHLLOKOSA-N 2 0 247.386 2.341 20 0 BEADRP C[NH+]1CCC([C@@H]2CCN(c3cc[nH+]cc3)C2)CC1 ZINC001337654651 978442005 /nfs/dbraw/zinc/44/20/05/978442005.db2.gz HDJRJHMKVBLCMA-CQSZACIVSA-N 2 0 245.370 2.250 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@H](NCc3ccccc3F)[C@@H]2C1 ZINC001179815688 978758267 /nfs/dbraw/zinc/75/82/67/978758267.db2.gz IVBQBFJPCIZAGB-GUTXKFCHSA-N 2 0 248.345 2.256 20 0 BEADRP CC[C@@H]1CC[C@H]([NH2+]C[C@@H]2CCC[N@H+](C)C2)C1 ZINC000070643703 978862071 /nfs/dbraw/zinc/86/20/71/978862071.db2.gz GOVANNKDETXSBV-RDBSUJKOSA-N 2 0 224.392 2.497 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2CCC=C(F)C2)CC1 ZINC001180732732 978942390 /nfs/dbraw/zinc/94/23/90/978942390.db2.gz SFUSGYHZLPOHTH-UHFFFAOYSA-N 2 0 226.339 2.277 20 0 BEADRP CC1=C[C@H](C)[C@@H](CN2CC[C@@H]3[NH2+]CC[C@@H]32)CC1 ZINC001235005373 978947614 /nfs/dbraw/zinc/94/76/14/978947614.db2.gz VWBYIUXOKAPWBI-XGUBFFRZSA-N 2 0 234.387 2.415 20 0 BEADRP CCc1cccc(C)c1C[N@@H+]1CC[C@H]2[NH2+]C[C@H]2C1 ZINC001235029915 978954608 /nfs/dbraw/zinc/95/46/08/978954608.db2.gz BPNKJJBCPYVHTG-GOEBONIOSA-N 2 0 244.382 2.351 20 0 BEADRP CC1=C[C@H](C)[C@@H](C[N@@H+]2CC[C@H]3[NH2+]C[C@H]3C2)CC1 ZINC001235025475 978955310 /nfs/dbraw/zinc/95/53/10/978955310.db2.gz BZMLWXFEZDYROA-LJISPDSOSA-N 2 0 234.387 2.273 20 0 BEADRP CC1=C[C@H](C)[C@H](C[N@@H+]2CC[C@]3(CC[NH2+]3)C2)CC1 ZINC001235062687 978967655 /nfs/dbraw/zinc/96/76/55/978967655.db2.gz BTCKIVOANMOZEJ-SOUVJXGZSA-N 2 0 234.387 2.417 20 0 BEADRP C(C1CCC1)[N@@H+]1CCCC[C@@]12CC[NH2+]C2 ZINC001235122647 978979419 /nfs/dbraw/zinc/97/94/19/978979419.db2.gz HPWIHAUGJIGRAF-ZDUSSCGKSA-N 2 0 208.349 2.005 20 0 BEADRP C([C@H]1CCCC[NH2+]1)[N@@H+]1CC[C@H]2CCC[C@@H]2C1 ZINC001235222655 978995995 /nfs/dbraw/zinc/99/59/95/978995995.db2.gz MRCNRQCQPCGDJG-MGPQQGTHSA-N 2 0 222.376 2.251 20 0 BEADRP C([C@H]1CCCC[NH2+]1)[N@@H+]1CC[C@@H]2CCC[C@@H]2C1 ZINC001235222646 978998900 /nfs/dbraw/zinc/99/89/00/978998900.db2.gz MRCNRQCQPCGDJG-BFHYXJOUSA-N 2 0 222.376 2.251 20 0 BEADRP c1c[nH]c(C[NH+]2CCC([C@H]3CCCC[NH2+]3)CC2)c1 ZINC001235230600 978999409 /nfs/dbraw/zinc/99/94/09/978999409.db2.gz PZNZHWOLEXCSQS-OAHLLOKOSA-N 2 0 247.386 2.369 20 0 BEADRP Cc1c(F)cccc1CN1C[C@H]2CCC[C@@]2([NH3+])C1 ZINC001235241409 979001881 /nfs/dbraw/zinc/00/18/81/979001881.db2.gz UDNIVGAIRSKNSA-UKRRQHHQSA-N 2 0 248.345 2.447 20 0 BEADRP [NH3+][C@@]12CCC[C@@H]1C[N@H+](C[C@@H]1CC=CCC1)C2 ZINC001235240042 979003499 /nfs/dbraw/zinc/00/34/99/979003499.db2.gz KAVAMMOMVMXVKL-MGPQQGTHSA-N 2 0 220.360 2.156 20 0 BEADRP CC(C)(C)c1ccc(C[N@H+]2C[C@@H]3[C@H]([NH3+])[C@@H]3C2)cc1 ZINC001235283230 979018055 /nfs/dbraw/zinc/01/80/55/979018055.db2.gz FFGMLOLVLNMDKO-QDMKHBRRSA-N 2 0 244.382 2.373 20 0 BEADRP CCC(CC)C[N@@H+]1CC[C@@]2(C1)C[NH2+]CC[C@H]2F ZINC001235404153 979038837 /nfs/dbraw/zinc/03/88/37/979038837.db2.gz MTHQUWHGGKRQOU-KGLIPLIRSA-N 2 0 242.382 2.446 20 0 BEADRP CC(C)CCC[N@@H+]1CC[C@]2(C1)C[NH2+]CC[C@@H]2F ZINC001235410501 979039943 /nfs/dbraw/zinc/03/99/43/979039943.db2.gz YGCVCCVTOMHDNB-UONOGXRCSA-N 2 0 242.382 2.446 20 0 BEADRP CC[NH2+]CCN1CCC[C@@H](c2ccccc2)C1 ZINC001235666509 979113007 /nfs/dbraw/zinc/11/30/07/979113007.db2.gz SEHOWOMBHOSBMU-OAHLLOKOSA-N 2 0 232.371 2.476 20 0 BEADRP CCCC[NH+]1CCC(C2CC[NH2+]CC2)CC1 ZINC001235701329 979129263 /nfs/dbraw/zinc/12/92/63/979129263.db2.gz IGRRBSBCTSTRAY-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP CCc1ccccc1C[N@@H+]1CCCC2(C[NH2+]C2)C1 ZINC001235710639 979129977 /nfs/dbraw/zinc/12/99/77/979129977.db2.gz CYWRLHVWGZWXBH-UHFFFAOYSA-N 2 0 244.382 2.434 20 0 BEADRP [NH3+]CCCC[N@@H+]1CC[C@@H](c2ccccc2F)C1 ZINC001235727638 979134461 /nfs/dbraw/zinc/13/44/61/979134461.db2.gz VLOJBZNUWONRON-GFCCVEGCSA-N 2 0 236.334 2.354 20 0 BEADRP CC1=C[C@H](C)[C@H](C[N@@H+]2C[C@H]3CC[C@@]3([NH3+])C2)CC1 ZINC001235977785 979240233 /nfs/dbraw/zinc/24/02/33/979240233.db2.gz HYKUKIJAQUAQFP-BYNSBNAKSA-N 2 0 234.387 2.402 20 0 BEADRP [NH3+][C@]12CC[C@@H]1C[N@H+](CCC1CCCCC1)C2 ZINC001235981867 979262841 /nfs/dbraw/zinc/26/28/41/979262841.db2.gz YHJYLFCVUTWSDR-KGLIPLIRSA-N 2 0 222.376 2.380 20 0 BEADRP C[C@@H](CN1C[C@H]2CC[C@@H](C1)[NH2+]C2)c1ccccc1 ZINC001236059489 979346347 /nfs/dbraw/zinc/34/63/47/979346347.db2.gz IWDUIJUBWJZREL-DZKIICNBSA-N 2 0 244.382 2.474 20 0 BEADRP CC(C)(C)CC[N@@H+]1C[C@H]2CC[C@@H](C1)[NH2+]C2 ZINC001236061530 979351206 /nfs/dbraw/zinc/35/12/06/979351206.db2.gz ZJAAJUIQGVXUNR-RYUDHWBXSA-N 2 0 210.365 2.106 20 0 BEADRP [NH3+]C[C@H]1CCCN1Cc1cccc2occc21 ZINC001236251566 979470536 /nfs/dbraw/zinc/47/05/36/979470536.db2.gz VVDRVQNEBLVTMO-GFCCVEGCSA-N 2 0 230.311 2.356 20 0 BEADRP C(C[N@H+]1C[C@@H]2CC[NH2+]CC[C@@H]2C1)C1CCCC1 ZINC001236314527 979526148 /nfs/dbraw/zinc/52/61/48/979526148.db2.gz QGFFMHOFQUIZIP-GASCZTMLSA-N 2 0 236.403 2.498 20 0 BEADRP CC1=C[C@H](C)[C@H](C[N@H+](C)[C@@H]2[C@H]3C[NH2+]C[C@H]32)CC1 ZINC001236411151 979588317 /nfs/dbraw/zinc/58/83/17/979588317.db2.gz NAWMFYRYEWIQCV-BTFPBAQTSA-N 2 0 234.387 2.128 20 0 BEADRP C[C@]1([NH3+])CCC[N@H+](CCC2CCOCC2)CC1 ZINC001205255773 979738040 /nfs/dbraw/zinc/73/80/40/979738040.db2.gz KSLJUGISNUCJAO-AWEZNQCLSA-N 2 0 240.391 2.006 20 0 BEADRP C[C@@]1([NH3+])CCC[N@H+](Cc2ccc(O)cc2)CC1 ZINC001205263701 979806465 /nfs/dbraw/zinc/80/64/65/979806465.db2.gz BPVMXRPYUVPUFF-CQSZACIVSA-N 2 0 234.343 2.096 20 0 BEADRP Cc1ncc(C[N@@H+]2CCC[C@@](C)([NH3+])CC2)s1 ZINC001205265319 979815962 /nfs/dbraw/zinc/81/59/62/979815962.db2.gz PTPABFSRCDAFSA-GFCCVEGCSA-N 2 0 239.388 2.155 20 0 BEADRP Cc1ncsc1C[N@@H+]1CCC[C@](C)([NH3+])CC1 ZINC001205266737 979820628 /nfs/dbraw/zinc/82/06/28/979820628.db2.gz XAYCMXDNZHTMEC-LBPRGKRZSA-N 2 0 239.388 2.155 20 0 BEADRP CS[C@H](C)CC[N@@H+]1CC[C@@H]2[NH2+]CCC[C@@H]2C1 ZINC001237383618 979881953 /nfs/dbraw/zinc/88/19/53/979881953.db2.gz QQAIOHKBXDQBBJ-UPJWGTAASA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]C[C@H]1C[NH+]2CCC1CC2 ZINC001184134136 979945852 /nfs/dbraw/zinc/94/58/52/979945852.db2.gz AHRHRYGKCMJBFI-FZMZJTMJSA-N 2 0 222.376 2.106 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+][C@@H]1CC[C@H]2C[N@H+](C)C[C@H]21 ZINC001184386311 980057557 /nfs/dbraw/zinc/05/75/57/980057557.db2.gz BRKGZNJAWKPDFQ-QSLWVIQJSA-N 2 0 224.392 2.351 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+][C@@H]1COC(C)(C)C1 ZINC001184417510 980080305 /nfs/dbraw/zinc/08/03/05/980080305.db2.gz DZIZSBVRDFQWNK-STQMWFEESA-N 2 0 242.407 2.264 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+][C@H]1CCCOCC1 ZINC001184419313 980080838 /nfs/dbraw/zinc/08/08/38/980080838.db2.gz ZLTPHWPRJQRJFK-KGLIPLIRSA-N 2 0 242.407 2.266 20 0 BEADRP c1cc(C2=CCC[NH2+]CC2)cc2c1C[NH2+]C2 ZINC001238941731 980382180 /nfs/dbraw/zinc/38/21/80/980382180.db2.gz SHQGTZRHFVHRGO-UHFFFAOYSA-N 2 0 214.312 2.057 20 0 BEADRP COc1cccc2c1CC[C@@H]2[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC001345097413 980548437 /nfs/dbraw/zinc/54/84/37/980548437.db2.gz KVOVJIRUTAAXIR-MJVIPROJSA-N 2 0 246.354 2.009 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H](C)c1ccc(C)nc1C ZINC001345483545 980618762 /nfs/dbraw/zinc/61/87/62/980618762.db2.gz SPSPIODCMLASNZ-PWSUYJOCSA-N 2 0 235.375 2.205 20 0 BEADRP C[NH+](C)Cc1cccc(CCn2ccnc2)c1 ZINC001250316639 980756851 /nfs/dbraw/zinc/75/68/51/980756851.db2.gz QKGDSYACSZBNLO-UHFFFAOYSA-N 2 0 229.327 2.187 20 0 BEADRP [NH3+]C[C@@]1(F)CCC[N@H+](C[C@H]2CC=CCC2)CC1 ZINC001205539441 980914392 /nfs/dbraw/zinc/91/43/92/980914392.db2.gz ZDTLOSJQXFDSNE-UONOGXRCSA-N 2 0 240.366 2.496 20 0 BEADRP C[C@H]([NH3+])c1ccc(-c2cncc(C[NH3+])c2)cc1 ZINC001239798384 980938508 /nfs/dbraw/zinc/93/85/08/980938508.db2.gz OWTZQJULSJTBGZ-JTQLQIEISA-N 2 0 227.311 2.227 20 0 BEADRP C([C@@H]1CC2CCC1CC2)[N@@H+]1CC[C@@H]2C[NH2+]C[C@@H]21 ZINC000691685548 981079281 /nfs/dbraw/zinc/07/92/81/981079281.db2.gz QEWXUMQCLYRKMV-IFOPZJACSA-N 2 0 234.387 2.106 20 0 BEADRP C[C@@H]1CC[N@H+](CCC2CC2)CC[C@@H]1C[NH3+] ZINC001205600446 981155686 /nfs/dbraw/zinc/15/56/86/981155686.db2.gz BSVWGBBXAWSABE-DGCLKSJQSA-N 2 0 210.365 2.093 20 0 BEADRP CCCCC[N@@H+]1CC[C@@H](C)[C@@H](C[NH3+])CC1 ZINC001205602644 981164592 /nfs/dbraw/zinc/16/45/92/981164592.db2.gz KXRDNHFAAANRKN-CHWSQXEVSA-N 2 0 212.381 2.483 20 0 BEADRP Cc1cccnc1C[N@H+]1CC[C@H](C)[C@@H](C[NH3+])CC1 ZINC001205603989 981175564 /nfs/dbraw/zinc/17/55/64/981175564.db2.gz SXSIKGFAADBTGI-GXTWGEPZSA-N 2 0 247.386 2.197 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]Cc1cc(C)ccc1C ZINC001348515762 981379637 /nfs/dbraw/zinc/37/96/37/981379637.db2.gz PIMAAHNSZFSQGD-CYBMUJFWSA-N 2 0 220.360 2.391 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]C[C@@H]1CCOc2ccccc21 ZINC001348516707 981381058 /nfs/dbraw/zinc/38/10/58/981381058.db2.gz WKQRMLYPSZCYHR-STQMWFEESA-N 2 0 248.370 2.140 20 0 BEADRP [NH3+]Cc1ccccc1-c1ccc2c(c1)CC[NH2+]C2 ZINC001240457576 981391468 /nfs/dbraw/zinc/39/14/68/981391468.db2.gz XSZUYEGAWNCHRZ-UHFFFAOYSA-N 2 0 238.334 2.458 20 0 BEADRP c1cnc(C2=CC[NH2+]CC2)c(C[NH+]2CCCC2)c1 ZINC001240466753 981398137 /nfs/dbraw/zinc/39/81/37/981398137.db2.gz UIAXWYPWBGUCJT-UHFFFAOYSA-N 2 0 243.354 2.054 20 0 BEADRP C[C@@H]1CC[N@H+](Cc2cccc(N)c2)CC[C@@H]1C[NH3+] ZINC001205638819 981413110 /nfs/dbraw/zinc/41/31/10/981413110.db2.gz SERXEMVDSLTTJC-TZMCWYRMSA-N 2 0 247.386 2.076 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CCc1ccc(N(C)C)cc1 ZINC001348841362 981454357 /nfs/dbraw/zinc/45/43/57/981454357.db2.gz SLHLULPHRZTDFP-CHWSQXEVSA-N 2 0 249.402 2.011 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CCc1ccc(N(C)C)cc1 ZINC001348841365 981454671 /nfs/dbraw/zinc/45/46/71/981454671.db2.gz SLHLULPHRZTDFP-QWHCGFSZSA-N 2 0 249.402 2.011 20 0 BEADRP c1cc2c(cc1C[NH2+][C@@H]1[C@@H]3CCC[C@@H]31)C[NH2+]CC2 ZINC001580890684 981717321 /nfs/dbraw/zinc/71/73/21/981717321.db2.gz NFMIHILTFIJKRK-MUJYYYPQSA-N 2 0 242.366 2.220 20 0 BEADRP c1cc(CC[NH2+][C@@H]2CC[C@@H]3[NH2+]CCC[C@H]3C2)co1 ZINC001580887745 981720024 /nfs/dbraw/zinc/72/00/24/981720024.db2.gz GVTONVVPQBEDLT-ZNMIVQPWSA-N 2 0 248.370 2.332 20 0 BEADRP c1cc(CC[NH2+][C@@H]2CC[C@@H]3[NH2+]CCC[C@@H]3C2)co1 ZINC001580887742 981720355 /nfs/dbraw/zinc/72/03/55/981720355.db2.gz GVTONVVPQBEDLT-KFWWJZLASA-N 2 0 248.370 2.332 20 0 BEADRP c1ccc(C[NH2+]C[C@H]2CCC[NH2+]CC2)cc1 ZINC001580893179 981723275 /nfs/dbraw/zinc/72/32/75/981723275.db2.gz WKRKUOOGYPWNOT-AWEZNQCLSA-N 2 0 218.344 2.166 20 0 BEADRP C(c1cc(-n2ccnc2)cc[nH+]1)=C1CC[NH2+]CC1 ZINC001240875461 981923258 /nfs/dbraw/zinc/92/32/58/981923258.db2.gz OUPUDPSYJKXGMY-UHFFFAOYSA-N 2 0 240.310 2.034 20 0 BEADRP C[NH2+]Cc1ccc(C=C2CC[NH2+]CC2)cc1 ZINC001240878679 981931805 /nfs/dbraw/zinc/93/18/05/981931805.db2.gz NENFMNVSKUXCGR-UHFFFAOYSA-N 2 0 216.328 2.173 20 0 BEADRP [NH3+]Cc1cccc(C=C2CC[NH2+]CC2)c1F ZINC001240878841 981932807 /nfs/dbraw/zinc/93/28/07/981932807.db2.gz PZPREJGNDIBQRT-UHFFFAOYSA-N 2 0 220.291 2.051 20 0 BEADRP C[C@H]([NH3+])c1ccc(C2=CC[N@H+](C)CC2)cc1 ZINC001241327145 982487558 /nfs/dbraw/zinc/48/75/58/982487558.db2.gz IAFRVPLXWVKFTQ-NSHDSACASA-N 2 0 216.328 2.425 20 0 BEADRP COC[C@H](C)[NH2+]CCC1CC[NH+](C(C)C)CC1 ZINC001352862687 982607518 /nfs/dbraw/zinc/60/75/18/982607518.db2.gz LRBNQYKMDJYXTF-ZDUSSCGKSA-N 2 0 242.407 2.121 20 0 BEADRP C[NH+]1CCC2(C[NH+](Cc3ccccc3)C2)CC1 ZINC001203314933 982670674 /nfs/dbraw/zinc/67/06/74/982670674.db2.gz RKULPNCTOBCYJE-UHFFFAOYSA-N 2 0 230.355 2.214 20 0 BEADRP C[N@@H+]1CCC=C(c2cccc3c2CC[NH2+]C3)C1 ZINC001241569973 982818389 /nfs/dbraw/zinc/81/83/89/982818389.db2.gz BUEKBKQTARPOLU-UHFFFAOYSA-N 2 0 228.339 2.051 20 0 BEADRP C[N@@H+]1CCC=C(c2cccc3c2C[NH2+]C3)C1 ZINC001241570144 982818412 /nfs/dbraw/zinc/81/84/12/982818412.db2.gz GLJHWIHJFZUTQX-UHFFFAOYSA-N 2 0 214.312 2.009 20 0 BEADRP C[N@@H+]1CCC=C(c2cccc3c2C[NH2+]CC3)C1 ZINC001241570458 982818775 /nfs/dbraw/zinc/81/87/75/982818775.db2.gz HZNUXFACISQDJT-UHFFFAOYSA-N 2 0 228.339 2.051 20 0 BEADRP c1cc(NC[C@@H]2CC[N@@H+]2C2CCCCC2)cc[nH+]1 ZINC001354032515 983120750 /nfs/dbraw/zinc/12/07/50/983120750.db2.gz XBTBIXVPTOXBRJ-HNNXBMFYSA-N 2 0 245.370 2.322 20 0 BEADRP Cc1c[nH+]c(-c2ccc(C[NH3+])cc2)cc1N ZINC001241911643 983125216 /nfs/dbraw/zinc/12/52/16/983125216.db2.gz XQHFDDYHXUBFPP-UHFFFAOYSA-N 2 0 213.284 2.098 20 0 BEADRP CN(C)c1cc[nH+]c(-c2ccc(C[NH3+])cc2)c1 ZINC001241911235 983125532 /nfs/dbraw/zinc/12/55/32/983125532.db2.gz JAPDWEHAPIJLLU-UHFFFAOYSA-N 2 0 227.311 2.273 20 0 BEADRP C[NH+](C)Cc1ccc(-c2ccc(C[NH3+])cc2)nc1 ZINC001241911205 983126118 /nfs/dbraw/zinc/12/61/18/983126118.db2.gz QCWAGNCOVRTQDL-UHFFFAOYSA-N 2 0 241.338 2.269 20 0 BEADRP [NH3+]Cc1ccc(-c2cccc3c[nH+]cn32)cc1 ZINC001241915491 983132850 /nfs/dbraw/zinc/13/28/50/983132850.db2.gz ZFFYECIMLHBUNO-UHFFFAOYSA-N 2 0 223.279 2.460 20 0 BEADRP C[N@@H+]1CC[C@@H]2C[NH+](C[C@@H]3CC=CCC3)C[C@@H]2C1 ZINC001201412122 983215601 /nfs/dbraw/zinc/21/56/01/983215601.db2.gz UKBOQADTSIDRNP-KFWWJZLASA-N 2 0 234.387 2.226 20 0 BEADRP [NH3+]Cc1cccc(C2=C[C@H]3CC[C@@H](C2)[NH2+]3)c1 ZINC001242021170 983230583 /nfs/dbraw/zinc/23/05/83/983230583.db2.gz JSDQTLNQBIHJBF-KGLIPLIRSA-N 2 0 214.312 2.053 20 0 BEADRP [NH3+]Cc1ccccc1C1=C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC001242026303 983239866 /nfs/dbraw/zinc/23/98/66/983239866.db2.gz FYAKNLYUMGDZJE-OLZOCXBDSA-N 2 0 214.312 2.053 20 0 BEADRP Cc1cc2ccccc2c(N2CCC([NH3+])CC2)[nH+]1 ZINC000082766414 983276617 /nfs/dbraw/zinc/27/66/17/983276617.db2.gz UCZMUMUOHWOKPO-UHFFFAOYSA-N 2 0 241.338 2.471 20 0 BEADRP CCC[N@H+]1C[C@@H]2C[NH+](CCC(C)C)C[C@@H]2C1 ZINC001201630298 983357063 /nfs/dbraw/zinc/35/70/63/983357063.db2.gz OUUSKBSFLUOSCE-OKILXGFUSA-N 2 0 224.392 2.306 20 0 BEADRP C[NH+]1CC2(C1)CC[NH+](CCC(C)(C)C)CC2 ZINC001202096763 983557627 /nfs/dbraw/zinc/55/76/27/983557627.db2.gz RJRJSEIGWYOXHB-UHFFFAOYSA-N 2 0 224.392 2.450 20 0 BEADRP CN1CCC[C@H]2C[N@H+](CCC(C)(C)C)C[C@H]21 ZINC001202114629 983563957 /nfs/dbraw/zinc/56/39/57/983563957.db2.gz BWIUILIIOMWULD-QWHCGFSZSA-N 2 0 224.392 2.449 20 0 BEADRP CC[N@H+]1C[C@@H]2C[NH+](CCC(C)(C)C)C[C@@H]2C1 ZINC001202114948 983564252 /nfs/dbraw/zinc/56/42/52/983564252.db2.gz JRQXXACXUQWJLC-BETUJISGSA-N 2 0 224.392 2.306 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[N@H+](C)C[C@@H]12)C1CCC1 ZINC001561053069 984013828 /nfs/dbraw/zinc/01/38/28/984013828.db2.gz RYVQAQGYUXEUHI-IGHBBLSQSA-N 2 0 222.376 2.105 20 0 BEADRP C[C@@H]1CCC[C@H](CC[N@H+](C)[C@@H]2[C@H]3C[NH2+]C[C@H]32)C1 ZINC001576670110 984178452 /nfs/dbraw/zinc/17/84/52/984178452.db2.gz YIINMYLEUHGFPI-ZSAUSMIDSA-N 2 0 236.403 2.352 20 0 BEADRP C[C@@H]1C[N@H+](Cc2ccccc2)CCC[C@@H]1C[NH3+] ZINC001205985223 984302056 /nfs/dbraw/zinc/30/20/56/984302056.db2.gz WODXCDNADFUUSF-UKRRQHHQSA-N 2 0 232.371 2.493 20 0 BEADRP CC[C@@H](C)C[NH+]1CCC2(CC[N@H+](C)C2)CC1 ZINC001275061847 984455302 /nfs/dbraw/zinc/45/53/02/984455302.db2.gz LOWOAOVWBLWACI-CYBMUJFWSA-N 2 0 224.392 2.450 20 0 BEADRP [NH3+]CC1(C[NH2+]CC[C@H]2CCC(F)(F)C2)CC1 ZINC001580244109 984468478 /nfs/dbraw/zinc/46/84/78/984468478.db2.gz POTGPGOAWNYREW-SNVBAGLBSA-N 2 0 232.318 2.140 20 0 BEADRP CC(C)CC[N@H+]1C[C@@H]2CC[NH+](C)CC[C@@H]2C1 ZINC001275096403 984486106 /nfs/dbraw/zinc/48/61/06/984486106.db2.gz HIJQNZHBAVYBPN-OKILXGFUSA-N 2 0 224.392 2.306 20 0 BEADRP CCC[N@@H+]1CCC[C@@]2(CCC[NH+](C)C2)C1 ZINC001275103960 984490284 /nfs/dbraw/zinc/49/02/84/984490284.db2.gz VXZMYYDVBYMVJY-CYBMUJFWSA-N 2 0 210.365 2.204 20 0 BEADRP C[N@@H+]1CCC2(C1)CC[NH+](Cc1ccco1)CC2 ZINC001275235692 984525037 /nfs/dbraw/zinc/52/50/37/984525037.db2.gz YGBPDGSMELAFBG-UHFFFAOYSA-N 2 0 234.343 2.197 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+][C@@H]2CC[C@@H]3CCCC[C@H]3C2)C1 ZINC001580423470 984535300 /nfs/dbraw/zinc/53/53/00/984535300.db2.gz ZYFXFHFRLAGJTJ-QSLWVIQJSA-N 2 0 222.376 2.425 20 0 BEADRP C[NH+]1CCC(c2cccc(C3=CC[NH2+]C3)c2)CC1 ZINC001243114486 984584622 /nfs/dbraw/zinc/58/46/22/984584622.db2.gz DFRPAZKZOWSFEG-UHFFFAOYSA-N 2 0 242.366 2.482 20 0 BEADRP CC(C)[NH2+]CC[NH2+]C1C[C@H](C)C[C@@H](C)C1 ZINC000719345228 984630790 /nfs/dbraw/zinc/63/07/90/984630790.db2.gz HKHXUZSARKWJPA-VXGBXAGGSA-N 2 0 212.381 2.399 20 0 BEADRP C[N@@H+]1CCCC2(CC[NH+](Cc3ccc[nH]3)CC2)C1 ZINC001275854032 984701006 /nfs/dbraw/zinc/70/10/06/984701006.db2.gz YHDWUYJVFSOYTO-UHFFFAOYSA-N 2 0 247.386 2.323 20 0 BEADRP CCC[C@@H](C)[N@H+](CC)CCC[NH+](C)C ZINC001257324432 984895588 /nfs/dbraw/zinc/89/55/88/984895588.db2.gz OLVOHXSWVXKTOL-GFCCVEGCSA-N 2 0 200.370 2.449 20 0 BEADRP CCc1cccc(C[NH2+][C@H]2C[C@@H]([NH3+])C2(C)C)c1 ZINC001578266171 984901976 /nfs/dbraw/zinc/90/19/76/984901976.db2.gz BSKHEGWEMMMUKP-KGLIPLIRSA-N 2 0 232.371 2.464 20 0 BEADRP C[N@H+](CCCCCC[NH3+])C[C@]1(C)CCCCO1 ZINC001578465850 985101132 /nfs/dbraw/zinc/10/11/32/985101132.db2.gz RDOSNWLTUFBOLB-AWEZNQCLSA-N 2 0 242.407 2.397 20 0 BEADRP C[NH+](C)[C@H]1CC[C@H]([NH2+][C@@H]2CCCSC2)CC1 ZINC001257664781 985245189 /nfs/dbraw/zinc/24/51/89/985245189.db2.gz XCGXEGGVMVMTAD-JHJVBQTASA-N 2 0 242.432 2.344 20 0 BEADRP CO[C@@](C)(C[N@@H+]1CCCCC[C@@H]([NH3+])C1)C1CC1 ZINC001578897013 985467186 /nfs/dbraw/zinc/46/71/86/985467186.db2.gz HVOXVDSLPDWEOV-KGLIPLIRSA-N 2 0 240.391 2.005 20 0 BEADRP C(=C/C1CC[NH2+]CC1)\c1ccc2c(c1)CC[NH2+]C2 ZINC001243892413 985567143 /nfs/dbraw/zinc/56/71/43/985567143.db2.gz IFUCRPQGECZRMT-OWOJBTEDSA-N 2 0 242.366 2.345 20 0 BEADRP C[NH+](C)Cc1ccnc(/C=C/C2CC[NH2+]CC2)c1 ZINC001243894806 985572987 /nfs/dbraw/zinc/57/29/87/985572987.db2.gz QCQAJGIIXSWZNO-ONEGZZNKSA-N 2 0 245.370 2.156 20 0 BEADRP C(=C/C1CC[NH2+]CC1)\c1cccc2c1C[NH2+]C2 ZINC001243896419 985580572 /nfs/dbraw/zinc/58/05/72/985580572.db2.gz NRPKUGXRXOEDNF-SNAWJCMRSA-N 2 0 228.339 2.303 20 0 BEADRP C[NH2+]Cc1ccccc1/C=C/C1CC[NH2+]CC1 ZINC001243897140 985582775 /nfs/dbraw/zinc/58/27/75/985582775.db2.gz QIOXPJZXPCZWER-VOTSOKGWSA-N 2 0 230.355 2.419 20 0 BEADRP C[C@H](Cc1ccco1)[NH+]1CC2(C1)CC[NH+](C)CC2 ZINC001258196795 985590994 /nfs/dbraw/zinc/59/09/94/985590994.db2.gz ZZDCCUNFVQNGBA-CYBMUJFWSA-N 2 0 248.370 2.238 20 0 BEADRP C[NH+](C)CCCC[NH2+]C1CCC(F)(F)CC1 ZINC000688348311 985619818 /nfs/dbraw/zinc/61/98/18/985619818.db2.gz RLITXHYLLONXCT-UHFFFAOYSA-N 2 0 234.334 2.496 20 0 BEADRP CSCC[C@H](C)[NH2+]Cc1ccccc1C[NH3+] ZINC001258209492 985639879 /nfs/dbraw/zinc/63/98/79/985639879.db2.gz WJISCHMUEFOFID-NSHDSACASA-N 2 0 238.400 2.377 20 0 BEADRP COc1ccc(C2=C[NH2+]CCC2)cc1C[NH+](C)C ZINC001243952426 985663082 /nfs/dbraw/zinc/66/30/82/985663082.db2.gz PKTYVRSMMHCQSH-UHFFFAOYSA-N 2 0 246.354 2.481 20 0 BEADRP C[C@@H]([NH3+])c1ccccc1C1=C[NH2+]CCC1 ZINC001243954802 985666934 /nfs/dbraw/zinc/66/69/34/985666934.db2.gz YXXSVSYIIYFDPO-SNVBAGLBSA-N 2 0 202.301 2.431 20 0 BEADRP [NH3+]Cc1c[nH]c2ccc(C3=C[NH2+]CCC3)cc12 ZINC001243953469 985667670 /nfs/dbraw/zinc/66/76/70/985667670.db2.gz IZNFZSFICDMAAA-UHFFFAOYSA-N 2 0 227.311 2.351 20 0 BEADRP CO[C@H]1C[C@@H](C[NH2+]C[C@@H]([NH3+])CCC(C)(C)C)C1 ZINC001579130079 985808001 /nfs/dbraw/zinc/80/80/01/985808001.db2.gz YIRGMEPBMDZVGC-RWMBFGLXSA-N 2 0 242.407 2.155 20 0 BEADRP COc1cccc(C[NH2+][C@@H]2C[C@H]([NH3+])C2(C)C)c1C ZINC001579277710 985828137 /nfs/dbraw/zinc/82/81/37/985828137.db2.gz KNSHHGOORUROGB-UONOGXRCSA-N 2 0 248.370 2.219 20 0 BEADRP CSC1(C[N@@H+]2CC[C@@H](C[NH3+])[C@@H](C)C2)CCC1 ZINC001579364907 985860468 /nfs/dbraw/zinc/86/04/68/985860468.db2.gz FOYLHZOBKRYPLE-RYUDHWBXSA-N 2 0 242.432 2.189 20 0 BEADRP CSC1(C[N@@H+]2CC[C@H](C[NH3+])[C@@H](C)C2)CCC1 ZINC001579364906 985861682 /nfs/dbraw/zinc/86/16/82/985861682.db2.gz FOYLHZOBKRYPLE-NWDGAFQWSA-N 2 0 242.432 2.189 20 0 BEADRP C[C@H](CC1CC1)[NH2+]C(C)(C)CC[NH+](C)C ZINC001258451887 985894762 /nfs/dbraw/zinc/89/47/62/985894762.db2.gz UDDQSIFQEKNWOI-LLVKDONJSA-N 2 0 212.381 2.495 20 0 BEADRP C[C@H](CC1CC1)[NH+]1CCN(c2cc[nH+]cc2)CC1 ZINC001258458296 985906071 /nfs/dbraw/zinc/90/60/71/985906071.db2.gz RZFHUULUVAGQOB-CYBMUJFWSA-N 2 0 245.370 2.392 20 0 BEADRP C[C@H](CC1CC1)[N@@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC001258473544 985934132 /nfs/dbraw/zinc/93/41/32/985934132.db2.gz NKSKXIOMMNKXRW-OCCSQVGLSA-N 2 0 222.376 2.203 20 0 BEADRP CCC[N@H+]1C[C@@H]2C[NH+]([C@H](C)CC3CC3)C[C@@H]2C1 ZINC001258471340 985939833 /nfs/dbraw/zinc/93/98/33/985939833.db2.gz ZERXJVPKXWGKGA-YUELXQCFSA-N 2 0 236.403 2.449 20 0 BEADRP CC[NH+]1C[C@@H]2C[NH+]([C@H](C)CC3CC3)C[C@H]2C1 ZINC001258472888 985940825 /nfs/dbraw/zinc/94/08/25/985940825.db2.gz QCZHTPTYTNMZGW-MRVWCRGKSA-N 2 0 222.376 2.059 20 0 BEADRP C[C@H](CC1CC1)[NH+]1CCC2(C[NH+](C)C2)CC1 ZINC001258474402 985944592 /nfs/dbraw/zinc/94/45/92/985944592.db2.gz TYZCILWVTHJAEN-GFCCVEGCSA-N 2 0 222.376 2.203 20 0 BEADRP [NH3+]CCOc1cccc(-c2cccc(C[NH3+])c2)c1 ZINC001244322895 985955216 /nfs/dbraw/zinc/95/52/16/985955216.db2.gz ZXANZPUAUUHBMQ-UHFFFAOYSA-N 2 0 242.322 2.150 20 0 BEADRP CCCCC[C@H](CCC)[NH2+]CCOCC[NH3+] ZINC001258661320 985996861 /nfs/dbraw/zinc/99/68/61/985996861.db2.gz DSGCZCWHAVIPSB-ZDUSSCGKSA-N 2 0 230.396 2.300 20 0 BEADRP Cc1cc(F)ccc1[C@H](C)[NH2+]C[C@@]12C[C@@H]1C[NH2+]C2 ZINC001579617692 986134973 /nfs/dbraw/zinc/13/49/73/986134973.db2.gz VBSVZVQRCFSMBZ-ZOWXZIJZSA-N 2 0 248.345 2.394 20 0 BEADRP CC[C@H](C[C@@H](C)CC)NC(=[NH2+])NCCCC[NH3+] ZINC001258779967 986171048 /nfs/dbraw/zinc/17/10/48/986171048.db2.gz JHNGZKSPLFJAKZ-NWDGAFQWSA-N 2 0 242.411 2.054 20 0 BEADRP Cc1ccc(C[C@H](C)[NH2+]C[C@@H]2C[NH2+]C[C@H]2C)cc1 ZINC001579684539 986172016 /nfs/dbraw/zinc/17/20/16/986172016.db2.gz IUXXODGMDJIFTR-YCPHGPKFSA-N 2 0 246.398 2.371 20 0 BEADRP Cc1ccc(CC2C[NH+](CC(C)(C)C[NH3+])C2)cc1 ZINC001579684545 986178648 /nfs/dbraw/zinc/17/86/48/986178648.db2.gz IXXXWBNAUHAFOD-UHFFFAOYSA-N 2 0 246.398 2.454 20 0 BEADRP CC[C@H](C[C@@H](C)CC)[NH2+]CCC[N@H+](C)CCO ZINC001258786955 986206151 /nfs/dbraw/zinc/20/61/51/986206151.db2.gz DAZCZUFGDAPCPU-UONOGXRCSA-N 2 0 244.423 2.105 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CC(C)C1 ZINC001258907056 986308248 /nfs/dbraw/zinc/30/82/48/986308248.db2.gz DOKOWUYUXJUYKN-CYBMUJFWSA-N 2 0 212.381 2.449 20 0 BEADRP FC(F)C1CC([NH2+]C[C@]23CCC[C@H]2[NH2+]CC3)C1 ZINC001580024477 986425951 /nfs/dbraw/zinc/42/59/51/986425951.db2.gz XJPIGHGEJJCDQH-FFJHZOIPSA-N 2 0 244.329 2.152 20 0 BEADRP Fc1ccc(/C=C\C[NH2+]CC2CC[NH2+]CC2)cc1 ZINC001580029794 986435736 /nfs/dbraw/zinc/43/57/36/986435736.db2.gz BIHQEGYIRPJIMF-UPHRSURJSA-N 2 0 248.345 2.428 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1C[NH+]2CCC1CC2)C1CCCC1 ZINC001462632599 986466097 /nfs/dbraw/zinc/46/60/97/986466097.db2.gz DTYNQGKLUYDCTA-SWLSCSKDSA-N 2 0 236.403 2.497 20 0 BEADRP CO[C@H](C)C[NH2+]C1CCC(C)([NH+]2CCC2)CC1 ZINC001462629521 986470320 /nfs/dbraw/zinc/47/03/20/986470320.db2.gz BSNLLHCGMAOZEU-IYXRBSQSSA-N 2 0 240.391 2.018 20 0 BEADRP CCCC[C@@H](C)[NH2+]C[C@H]1C[NH+]2CCC1CC2 ZINC001462632293 986471312 /nfs/dbraw/zinc/47/13/12/986471312.db2.gz CUWJATFNYASIJY-OCCSQVGLSA-N 2 0 224.392 2.497 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@H]([NH2+][C@@H]3CC[C@@H]3C3CCC3)[C@H]2C1 ZINC001462674645 986506894 /nfs/dbraw/zinc/50/68/94/986506894.db2.gz YXXHIYMLCXKQJR-NPJQDHAYSA-N 2 0 248.414 2.495 20 0 BEADRP FC1CC[NH+](CCCC2CC[NH2+]CC2)CC1 ZINC000689427016 986602710 /nfs/dbraw/zinc/60/27/10/986602710.db2.gz ZRJRUEBLNYARPD-UHFFFAOYSA-N 2 0 228.355 2.200 20 0 BEADRP CC[NH+]1CCC([NH2+]C/C=C\C2CC2)CC1 ZINC000378847499 986616832 /nfs/dbraw/zinc/61/68/32/986616832.db2.gz AWXWYHXBWYGLET-ARJAWSKDSA-N 2 0 208.349 2.027 20 0 BEADRP [NH3+][C@H]1CCC[N@H+](CCCC(F)(F)F)CC1 ZINC000378662200 986620148 /nfs/dbraw/zinc/62/01/48/986620148.db2.gz CICVRJIECDUSOB-VIFPVBQESA-N 2 0 224.270 2.142 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H]2C[C@@H]3CCC[C@H]23)CCCC1 ZINC001580152750 986622254 /nfs/dbraw/zinc/62/22/54/986622254.db2.gz UERCRXLDMMGTQO-SDDRHHMPSA-N 2 0 208.349 2.036 20 0 BEADRP [NH3+][C@@]12CCC[C@H]1C[N@H+](CC1CC3(CCC3)C1)C2 ZINC001580158559 986629689 /nfs/dbraw/zinc/62/96/89/986629689.db2.gz SUKBRYOTICYQAQ-DZGCQCFKSA-N 2 0 234.387 2.380 20 0 BEADRP [NH3+][C@]12CCC[C@H]1CN(CCc1ccccc1F)C2 ZINC001580158834 986630283 /nfs/dbraw/zinc/63/02/83/986630283.db2.gz XWLXKWMNEHQWFP-ZFWWWQNUSA-N 2 0 248.345 2.181 20 0 BEADRP [NH3+][C@@]12CCC[C@H]1CN(Cc1ccc(CF)cc1)C2 ZINC001580157749 986632463 /nfs/dbraw/zinc/63/24/63/986632463.db2.gz LRGJACPGFUAPFV-LSDHHAIUSA-N 2 0 248.345 2.469 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH+]2CC[C@]3(CC3(F)F)C2)CC1 ZINC001254525086 986664414 /nfs/dbraw/zinc/66/44/14/986664414.db2.gz FZKAHYKBJWAHIH-NEPJUHHUSA-N 2 0 244.329 2.202 20 0 BEADRP C[NH2+]Cc1ccc(N[C@@H]2CCC[N@H+](C)CC2)cc1 ZINC001254522082 986665626 /nfs/dbraw/zinc/66/56/26/986665626.db2.gz BNWPXGWRAULGPE-CQSZACIVSA-N 2 0 247.386 2.302 20 0 BEADRP [NH3+]CC1(C[NH2+]CCC[C@@H]2C=CCC2)CC1 ZINC001580244447 986694721 /nfs/dbraw/zinc/69/47/21/986694721.db2.gz XKZMUBKMPXYQBU-GFCCVEGCSA-N 2 0 208.349 2.061 20 0 BEADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@H]2CC[C@@H]3CCC[C@@H]32)C1 ZINC001580258358 986715886 /nfs/dbraw/zinc/71/58/86/986715886.db2.gz NSRSOUVLFICBRD-QMVSFRDZSA-N 2 0 222.376 2.282 20 0 BEADRP [NH3+]CCCCCC[NH2+]Cc1ccc2[nH]cnc2c1 ZINC001580293249 986736882 /nfs/dbraw/zinc/73/68/82/986736882.db2.gz HYLOHKZUXJGSDK-UHFFFAOYSA-N 2 0 246.358 2.172 20 0 BEADRP [NH3+]C[C@H]1CC[C@H](C[N@@H+]2CCn3cccc3C2)CC1 ZINC001580331172 986770975 /nfs/dbraw/zinc/77/09/75/986770975.db2.gz GBMCPEUAVVMYSE-HDJSIYSDSA-N 2 0 247.386 2.069 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@@H]2CC=CC[C@H]2C(F)(F)F)C1 ZINC001580421960 986839265 /nfs/dbraw/zinc/83/92/65/986839265.db2.gz YVVKIZWDMUPYKC-LMLFDSFASA-N 2 0 248.292 2.210 20 0 BEADRP CC[NH+](CC)[C@H]1CC[C@@H]([NH2+][C@H](C)COC)CC1 ZINC001255566097 987021411 /nfs/dbraw/zinc/02/14/11/987021411.db2.gz AUOYMOQFZZLGHY-MCIONIFRSA-N 2 0 242.407 2.264 20 0 BEADRP CCC[N@H+](CCC[NH3+])[C@@H](C)CC(F)(F)F ZINC001255632527 987035108 /nfs/dbraw/zinc/03/51/08/987035108.db2.gz AYUWWMHABFTHFQ-VIFPVBQESA-N 2 0 226.286 2.388 20 0 BEADRP CN(C)c1cc[nH+]c(-c2ccc3c[nH+]cn3c2)c1 ZINC001245896967 987116753 /nfs/dbraw/zinc/11/67/53/987116753.db2.gz WMVPZTDMAGFCMJ-UHFFFAOYSA-N 2 0 238.294 2.462 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@@H]2CCC23CCCC3)C1 ZINC000693771044 987315020 /nfs/dbraw/zinc/31/50/20/987315020.db2.gz SNXOQXRZMWYUEF-GRYCIOLGSA-N 2 0 208.349 2.036 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H]2CCCC[C@@H]2C2CC2)CC1 ZINC000695988524 987336981 /nfs/dbraw/zinc/33/69/81/987336981.db2.gz SUTJKBLPCBWVST-VXGBXAGGSA-N 2 0 208.349 2.036 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@@H]2CCCC[NH2+]C2)[C@H]1C ZINC000697017861 987343584 /nfs/dbraw/zinc/34/35/84/987343584.db2.gz VAMPCPLXFRXPOG-FRRDWIJNSA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@@H]1CCC[N@@H+]1C[C@H]1CCCC[NH2+]C1 ZINC000697041063 987346884 /nfs/dbraw/zinc/34/68/84/987346884.db2.gz KJOOQLGPFYHEDJ-QWHCGFSZSA-N 2 0 210.365 2.251 20 0 BEADRP CCC[N@H+](C[C@H]1CCCC[NH2+]C1)C1CC1 ZINC000697039774 987347091 /nfs/dbraw/zinc/34/70/91/987347091.db2.gz GVTCZXJJHKPKAC-LBPRGKRZSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@@H]1CC[C@H](C)[N@H+](C[C@H]2CCCC[NH2+]C2)C1 ZINC000697052756 987347857 /nfs/dbraw/zinc/34/78/57/987347857.db2.gz QJPMGXYWYNNUTE-RDBSUJKOSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1[C@H](C)SCC[N@@H+]1C[C@@H]1CCCC[NH2+]C1 ZINC000697058712 987348194 /nfs/dbraw/zinc/34/81/94/987348194.db2.gz TYRWPJPVOHUGDB-FRRDWIJNSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H]1CC(F)(F)CC[N@@H+]1C[C@@H]1CC[C@H]([NH3+])C1 ZINC000697588437 987358413 /nfs/dbraw/zinc/35/84/13/987358413.db2.gz ZQGOJOJUKFQWLT-MXWKQRLJSA-N 2 0 232.318 2.233 20 0 BEADRP C[C@@H]1CC(F)(F)CC[N@@H+]1C[C@H]1CCCC[NH2+]C1 ZINC000697640480 987362667 /nfs/dbraw/zinc/36/26/67/987362667.db2.gz GPYSLCKTCIYFSV-NEPJUHHUSA-N 2 0 246.345 2.496 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H]2Cc3cccc(F)c3C2)CCCC1 ZINC001246075073 987363991 /nfs/dbraw/zinc/36/39/91/987363991.db2.gz HBMNTXFEXPLXML-GFCCVEGCSA-N 2 0 248.345 2.154 20 0 BEADRP CC(C)OCC[C@@H](C)[NH2+]CC1([NH3+])CCCC1 ZINC001246077393 987369966 /nfs/dbraw/zinc/36/99/66/987369966.db2.gz WCKKWKUMBZKNCK-GFCCVEGCSA-N 2 0 228.380 2.051 20 0 BEADRP [NH3+]CCCCCCCC[NH2+][C@@H]1CCC[NH2+]CC1 ZINC001246080366 987371034 /nfs/dbraw/zinc/37/10/34/987371034.db2.gz NNHSASCUPFWOOK-CQSZACIVSA-N 3 0 241.423 2.017 20 0 BEADRP C[C@H]1CC[C@H]([NH2+]CCCCCCCC[NH3+])CN1 ZINC001246079526 987373298 /nfs/dbraw/zinc/37/32/98/987373298.db2.gz KPVSASALKWWMFN-KBPBESRZSA-N 2 0 241.423 2.016 20 0 BEADRP [NH3+]CCc1cn(C2CC[NH2+]CC2)c2ccccc12 ZINC001246084369 987379776 /nfs/dbraw/zinc/37/97/76/987379776.db2.gz YTZXLJCJCSTBSR-UHFFFAOYSA-N 2 0 243.354 2.067 20 0 BEADRP Cc1cc2cc(C[NH3+])ccc2n1[C@@H]1CCC[NH2+]C1 ZINC001246084130 987381964 /nfs/dbraw/zinc/38/19/64/987381964.db2.gz WCYOPXSWMXRIAS-CQSZACIVSA-N 2 0 243.354 2.333 20 0 BEADRP CC(C)OCC[C@H](C)[NH2+]C[C@@H]1C[NH2+]C[C@@H](C)C1 ZINC001246096179 987408168 /nfs/dbraw/zinc/40/81/68/987408168.db2.gz DIICDDLEDMGRKQ-IHRRRGAJSA-N 2 0 242.407 2.025 20 0 BEADRP C[C@H]1CCC[C@@H]([NH2+]C[C@H]2C[NH2+]C[C@@H](C)C2)C1 ZINC001246102097 987421961 /nfs/dbraw/zinc/42/19/61/987421961.db2.gz QZTDYYDAFKHJKH-IGQOVBAYSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1CC[C@@H](C[NH2+][C@@H]2C[C@@H]3[C@H](C2)C3(C)C)[NH2+]C1 ZINC001246102749 987428064 /nfs/dbraw/zinc/42/80/64/987428064.db2.gz FIBOXGMJDLBSFE-ITGHMWBKSA-N 2 0 236.403 2.399 20 0 BEADRP CCC[C@H](CC)[NH2+]C[C@H]1C[NH2+]C[C@H](C)C1 ZINC001246105737 987432895 /nfs/dbraw/zinc/43/28/95/987432895.db2.gz WPSXYEUDHYDKAZ-UPJWGTAASA-N 2 0 212.381 2.400 20 0 BEADRP CC[C@@H](C)C[C@H](CC)[NH2+][C@H]1C[NH2+]C[C@@H]1C ZINC001246105677 987433403 /nfs/dbraw/zinc/43/34/03/987433403.db2.gz BZPHTLXVGIGPLH-VOAKCMCISA-N 2 0 212.381 2.399 20 0 BEADRP CCc1ccc(C[C@@H](C)[NH2+]CCC[NH2+]C)cc1 ZINC001246105253 987433567 /nfs/dbraw/zinc/43/35/67/987433567.db2.gz AWSGPOFDPBPMBM-CYBMUJFWSA-N 2 0 234.387 2.379 20 0 BEADRP C[C@H]1CC[C@H]([NH2+]C[C@H]2CC[C@@H](C)C[NH2+]2)C1 ZINC001246104962 987434386 /nfs/dbraw/zinc/43/43/86/987434386.db2.gz KZAGOGYIDFBJGB-QNWHQSFQSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H](CC1CC1)[NH2+]C[C@H]1C[NH2+]CC[C@H]1C ZINC001246113430 987449554 /nfs/dbraw/zinc/44/95/54/987449554.db2.gz QUPXKJGNOSJSHK-NQBHXWOUSA-N 2 0 210.365 2.010 20 0 BEADRP CC(C)OCC[C@@H](C)[NH2+]C[C@H]1CCC[NH2+][C@H]1C ZINC001246114750 987454379 /nfs/dbraw/zinc/45/43/79/987454379.db2.gz XERJGVRGTRIWLK-HZSPNIEDSA-N 2 0 242.407 2.168 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+][C@@H]2CC[NH2+][C@H](C)C2)C1 ZINC001246117185 987458910 /nfs/dbraw/zinc/45/89/10/987458910.db2.gz OJRMLVOIYNRJNN-FDYHWXHSSA-N 2 0 210.365 2.295 20 0 BEADRP Cc1ccc(C[C@H](C)[NH2+][C@H]2CCCNC2)cc1 ZINC001246121395 987469010 /nfs/dbraw/zinc/46/90/10/987469010.db2.gz YWSHWSBBCBUQGZ-ZFWWWQNUSA-N 2 0 232.371 2.268 20 0 BEADRP CC[C@H](C)[NH2+][C@@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246123370 987472770 /nfs/dbraw/zinc/47/27/70/987472770.db2.gz AKSHBXPLXDYBMB-NWDGAFQWSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]1C[C@H]([NH2+][C@@H]2C[NH2+]CC23CC3)C[C@@H](C)C1 ZINC001246127978 987475257 /nfs/dbraw/zinc/47/52/57/987475257.db2.gz CZPLZYZJSZICFV-MROQNXINSA-N 2 0 222.376 2.153 20 0 BEADRP CC[C@H](CC(C)C)[NH2+][C@@H]1C[NH2+]CC12CC2 ZINC001246132905 987482334 /nfs/dbraw/zinc/48/23/34/987482334.db2.gz NGDGHAAUPZMWDP-VXGBXAGGSA-N 2 0 210.365 2.153 20 0 BEADRP CCC1CCC([NH2+][C@@H]2C[NH2+]CC23CC3)CC1 ZINC001246136424 987493096 /nfs/dbraw/zinc/49/30/96/987493096.db2.gz XBARPTOHZKKYQJ-WXRRBKDZSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]1CC([NH2+][C@H]2CC[C@@H]3C[NH2+]C[C@@H]32)C[C@@H](C)C1 ZINC001246145196 987502876 /nfs/dbraw/zinc/50/28/76/987502876.db2.gz PADVIRTYXYECEK-QIRZIZBZSA-N 2 0 236.403 2.399 20 0 BEADRP CCCCCC[C@H](C)[NH2+][C@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001246150592 987509285 /nfs/dbraw/zinc/50/92/85/987509285.db2.gz WBSALCSDINHQST-RVMXOQNASA-N 2 0 210.365 2.153 20 0 BEADRP CCc1ccc(CC[NH2+][C@H](C)CC[NH2+]C)cc1 ZINC001246156665 987515235 /nfs/dbraw/zinc/51/52/35/987515235.db2.gz BCZYXBPCZZTFCK-CYBMUJFWSA-N 2 0 234.387 2.379 20 0 BEADRP Cc1ccc(CC[NH2+][C@H]2CC[NH2+][C@@H](C)C2)s1 ZINC001246167109 987526045 /nfs/dbraw/zinc/52/60/45/987526045.db2.gz CQPHSZFBPKWITB-JQWIXIFHSA-N 2 0 238.400 2.329 20 0 BEADRP CCC1CCC([NH2+][C@@H]2C[NH2+][C@@H](C)C2)CC1 ZINC001246174035 987540179 /nfs/dbraw/zinc/54/01/79/987540179.db2.gz WDGWBOFLIVYSAX-WTIISPKJSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)c1cccc(N)c1 ZINC001246175247 987541807 /nfs/dbraw/zinc/54/18/07/987541807.db2.gz JECYUTRPXLBECJ-UHIISALHSA-N 2 0 233.359 2.060 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]23)C[C@@H]1C ZINC001246178489 987549253 /nfs/dbraw/zinc/54/92/53/987549253.db2.gz OUBHXAJDEAXXHB-BYGOPZEFSA-N 2 0 236.403 2.399 20 0 BEADRP CC(C)C[C@H](C)C[C@@H](C)[NH2+]C[C@H]1CC[NH2+]1 ZINC001246192979 987561655 /nfs/dbraw/zinc/56/16/55/987561655.db2.gz KWDZQHXNPYTIAG-YNEHKIRRSA-N 2 0 212.381 2.399 20 0 BEADRP Fc1ccc2c(c1)CC[C@@H]([NH2+]C[C@H]1CCC[NH2+]1)C2 ZINC001246185481 987562747 /nfs/dbraw/zinc/56/27/47/987562747.db2.gz BDGRFQJBMOZFEA-HUUCEWRRSA-N 2 0 248.345 2.025 20 0 BEADRP CSC(C)(C)C[C@@H](C)[NH2+]C[C@H]1CCC[NH2+]1 ZINC001246186702 987566405 /nfs/dbraw/zinc/56/64/05/987566405.db2.gz GVBUICGXVBOQSD-GHMZBOCLSA-N 2 0 230.421 2.248 20 0 BEADRP C[C@@H]1CC([NH2+]C[C@H]2CCC[NH2+]2)C[C@@H](C)C1 ZINC001246188479 987572712 /nfs/dbraw/zinc/57/27/12/987572712.db2.gz XMZHASAWCUCKSG-SDDRHHMPSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)C1CCC([NH2+][C@H]2C[C@H]([NH3+])C2)CC1 ZINC001246191621 987577570 /nfs/dbraw/zinc/57/75/70/987577570.db2.gz WTCWKBFHLHNFJS-FLWUZPLOSA-N 2 0 210.365 2.281 20 0 BEADRP CC[C@H](C)OCC[C@@H](C)[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC001246198239 987591527 /nfs/dbraw/zinc/59/15/27/987591527.db2.gz OBJXNTOMAHAYRA-HZSPNIEDSA-N 2 0 242.407 2.169 20 0 BEADRP CSC(C)(C)C[C@@H](C)[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC001246195585 987592251 /nfs/dbraw/zinc/59/22/51/987592251.db2.gz ADOKDUGKLLGOJA-VXGBXAGGSA-N 2 0 244.448 2.496 20 0 BEADRP C=Cc1ccc(C[NH2+]C2CC[NH2+]CC2)cc1 ZINC001246226236 987622433 /nfs/dbraw/zinc/62/24/33/987622433.db2.gz BXNJFXRIPZVTEJ-UHFFFAOYSA-N 2 0 216.328 2.171 20 0 BEADRP CC(C)C([NH2+][C@H]1CC[NH2+][C@H](C)C1)C(C)C ZINC001246237569 987635088 /nfs/dbraw/zinc/63/50/88/987635088.db2.gz PDQAQZMPOJCSAW-NEPJUHHUSA-N 2 0 212.381 2.397 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CC(C)(C)C[NH3+])C[C@H]1C ZINC001246243444 987645083 /nfs/dbraw/zinc/64/50/83/987645083.db2.gz GKEFDWYGYPYNCF-UTUOFQBUSA-N 2 0 212.381 2.386 20 0 BEADRP Cc1ccc2c(c1)C[C@@H]([NH2+]CC(C)(C)C[NH3+])CC2 ZINC001246242282 987645766 /nfs/dbraw/zinc/64/57/66/987645766.db2.gz CQOOJSZQFADRIL-HNNXBMFYSA-N 2 0 246.398 2.427 20 0 BEADRP CCC1([NH2+][C@@H]2C[NH2+][C@H](C)C2)CCCCC1 ZINC001246253239 987652359 /nfs/dbraw/zinc/65/23/59/987652359.db2.gz DDLJPYKBZYOWQK-NEPJUHHUSA-N 2 0 210.365 2.439 20 0 BEADRP C[C@H]1C[C@@H]([NH2+][C@@H]2C[C@H]2c2ccccc2)CC[NH2+]1 ZINC001246263629 987659541 /nfs/dbraw/zinc/65/95/41/987659541.db2.gz KHETVUGRBYWJAI-CYUUQNCZSA-N 2 0 230.355 2.273 20 0 BEADRP CCCC[C@@H]1C[C@@H](NCCC(C)(C)[NH3+])CC[NH2+]1 ZINC001246271907 987660717 /nfs/dbraw/zinc/66/07/17/987660717.db2.gz JGHCJVOMSDHPLH-OLZOCXBDSA-N 2 0 241.423 2.014 20 0 BEADRP CCCCC[C@H](CCC)[NH2+]CCN(C)CC[NH3+] ZINC001246286779 987678579 /nfs/dbraw/zinc/67/85/79/987678579.db2.gz ZVNVWWVVZGNPAF-AWEZNQCLSA-N 2 0 243.439 2.216 20 0 BEADRP CC(C)[C@@H]1C[C@H]1[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1 ZINC001474307659 987685917 /nfs/dbraw/zinc/68/59/17/987685917.db2.gz VIWHEQYGXKTHAN-RWMBFGLXSA-N 2 0 224.392 2.493 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H]1CCO[C@H](c2ccccc2)C1 ZINC001246302722 987700001 /nfs/dbraw/zinc/70/00/01/987700001.db2.gz AGJKZKKTNKLCQS-CFVMTHIKSA-N 2 0 248.370 2.234 20 0 BEADRP CC[NH+]1CCC(C[NH+]2C[C@H](C)[C@@H](C)C2)CC1 ZINC001474370323 987704174 /nfs/dbraw/zinc/70/41/74/987704174.db2.gz XHFKPXATGCTOKO-STQMWFEESA-N 2 0 224.392 2.306 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@@H]1CCc2ccc(C)cc2C1 ZINC001246312046 987711965 /nfs/dbraw/zinc/71/19/65/987711965.db2.gz FAJQUJUFSYRORH-LSDHHAIUSA-N 2 0 232.371 2.179 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@@H](c2cccnc2)C2CC2)CC[NH2+]1 ZINC001246325509 987731927 /nfs/dbraw/zinc/73/19/27/987731927.db2.gz ASEVCPXHEVMUSF-BYCMXARLSA-N 2 0 245.370 2.263 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CC2(c3ccccc3)CC2)CC[NH2+]1 ZINC001246332555 987737991 /nfs/dbraw/zinc/73/79/91/987737991.db2.gz NHYSUHWANAFJHT-HIFRSBDPSA-N 2 0 244.382 2.448 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]Cc2cccc3ncoc32)CC[NH2+]1 ZINC001246335578 987744143 /nfs/dbraw/zinc/74/41/43/987744143.db2.gz ZINPZPLZILJXRJ-JQWIXIFHSA-N 2 0 245.326 2.058 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CCCCCCCCO)CC[NH2+]1 ZINC001246340595 987748629 /nfs/dbraw/zinc/74/86/29/987748629.db2.gz IWBZJKRDZQPOMG-UONOGXRCSA-N 2 0 242.407 2.049 20 0 BEADRP [NH3+][C@@]12CC[C@@]([NH2+]C3CCCC3)(C1)CCC2 ZINC001246342413 987751574 /nfs/dbraw/zinc/75/15/74/987751574.db2.gz SUCZNWQUKUGCLW-QWHCGFSZSA-N 2 0 208.349 2.323 20 0 BEADRP C[C@@H](Cc1cccc(O)c1)[NH2+][C@@H]1CC[NH2+][C@H](C)C1 ZINC001246344726 987751972 /nfs/dbraw/zinc/75/19/72/987751972.db2.gz COOIRAMZKGZUFT-MBNYWOFBSA-N 2 0 248.370 2.053 20 0 BEADRP C[C@@H](Cc1cccc(O)c1)[NH2+][C@H]1CC[NH2+][C@H](C)C1 ZINC001246344723 987753906 /nfs/dbraw/zinc/75/39/06/987753906.db2.gz COOIRAMZKGZUFT-DYEKYZERSA-N 2 0 248.370 2.053 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+][C@H]2CC[NH2+][C@H](C)C2)CC1 ZINC001246358625 987766982 /nfs/dbraw/zinc/76/69/82/987766982.db2.gz GAZAVGXSJNBHAV-NDBYEHHHSA-N 2 0 210.365 2.295 20 0 BEADRP CCCC1([NH2+][C@@H]2CCCC[NH2+]C2)CCC1 ZINC001246384896 987779072 /nfs/dbraw/zinc/77/90/72/987779072.db2.gz LYRQRZMOIHAPKI-GFCCVEGCSA-N 2 0 210.365 2.441 20 0 BEADRP CCCC1([NH2+][C@H]2CCCC[NH2+]C2)CCC1 ZINC001246384897 987781088 /nfs/dbraw/zinc/78/10/88/987781088.db2.gz LYRQRZMOIHAPKI-LBPRGKRZSA-N 2 0 210.365 2.441 20 0 BEADRP c1ccc2c(c1)CC[C@@H]2C[NH2+][C@H]1CCCC[NH2+]C1 ZINC001246418594 987792404 /nfs/dbraw/zinc/79/24/04/987792404.db2.gz DUAZVJBUJIJFOB-CABCVRRESA-N 2 0 244.382 2.448 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCc3ccccc32)CC[NH2+]1 ZINC001246421634 987793584 /nfs/dbraw/zinc/79/35/84/987793584.db2.gz SGSGQUMGIHZLLZ-VHDGCEQUSA-N 2 0 244.382 2.447 20 0 BEADRP CC(C)CC(CC(C)C)[NH2+][C@H]1CC12C[NH2+]C2 ZINC001246441863 987797813 /nfs/dbraw/zinc/79/78/13/987797813.db2.gz AITOVKBEOBNRHF-ZDUSSCGKSA-N 2 0 224.392 2.399 20 0 BEADRP C[NH2+]CC[C@H](C)[NH2+]C[C@H]1CCC(C)(C)C1 ZINC001246432889 987798600 /nfs/dbraw/zinc/79/86/00/987798600.db2.gz IQJWVICSWHZZCS-RYUDHWBXSA-N 2 0 212.381 2.400 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2CC[C@@H](CF)C2)CC1 ZINC001474683583 987800272 /nfs/dbraw/zinc/80/02/72/987800272.db2.gz NEPUKLPSWYLYNE-ZDUSSCGKSA-N 2 0 228.355 2.010 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C(C)(C)Cc2ccccn2)CC[NH2+]1 ZINC001246432847 987800668 /nfs/dbraw/zinc/80/06/68/987800668.db2.gz IDRFBNURGBYYEM-CHWSQXEVSA-N 2 0 247.386 2.133 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2CC[C@H](CF)C2)CC1 ZINC001474683582 987801362 /nfs/dbraw/zinc/80/13/62/987801362.db2.gz NEPUKLPSWYLYNE-CYBMUJFWSA-N 2 0 228.355 2.010 20 0 BEADRP FC(F)(F)C1CCC([NH2+][C@@H]2CC23C[NH2+]C3)CC1 ZINC001246444263 987801821 /nfs/dbraw/zinc/80/18/21/987801821.db2.gz JNIMCBIABUUDAG-UDNWOFFPSA-N 2 0 248.292 2.059 20 0 BEADRP CCC[C@@H](Cc1ccccc1)[NH2+][C@@H]1CC12C[NH2+]C2 ZINC001246445422 987803539 /nfs/dbraw/zinc/80/35/39/987803539.db2.gz OBKNGTSORBKMQX-LSDHHAIUSA-N 2 0 244.382 2.349 20 0 BEADRP CC[C@H](C[C@@H](C)CC)[NH2+][C@H]1CC12C[NH2+]C2 ZINC001246445291 987803932 /nfs/dbraw/zinc/80/39/32/987803932.db2.gz NSVMTLAYDUHRQA-TUAOUCFPSA-N 2 0 210.365 2.153 20 0 BEADRP C1[C@H]([NH2+]C2CCCCCCC2)C12C[NH2+]C2 ZINC001246448389 987805311 /nfs/dbraw/zinc/80/53/11/987805311.db2.gz YHHBZAIDYCRUCQ-LBPRGKRZSA-N 2 0 208.349 2.051 20 0 BEADRP [NH3+]CCCNCCC[NH2+]C1CCCCCCC1 ZINC001246450892 987805567 /nfs/dbraw/zinc/80/55/67/987805567.db2.gz DHOWXBDSFHMWGT-UHFFFAOYSA-N 2 0 241.423 2.017 20 0 BEADRP c1ccc([C@@H]2CC[C@@H]([NH2+][C@H]3CC34C[NH2+]C4)C2)cc1 ZINC001246446351 987807340 /nfs/dbraw/zinc/80/73/40/987807340.db2.gz RLGCVHFCUILFBC-KFWWJZLASA-N 2 0 242.366 2.274 20 0 BEADRP CC(C)=CCC[C@@H](C)[NH2+]CCCNCCC[NH3+] ZINC001246452736 987810479 /nfs/dbraw/zinc/81/04/79/987810479.db2.gz LZEPOUBXMOBZJG-CQSZACIVSA-N 2 0 241.423 2.039 20 0 BEADRP CC(C)CC[C@@H](C)[NH2+]CCC[NH2+]CCCC[NH3+] ZINC001246455477 987812299 /nfs/dbraw/zinc/81/22/99/987812299.db2.gz FOHPNZUKRUNEMD-CQSZACIVSA-N 3 0 243.439 2.119 20 0 BEADRP CC(C)CCC[C@H](C)[NH2+]CCCNCCC[NH3+] ZINC001246456141 987814138 /nfs/dbraw/zinc/81/41/38/987814138.db2.gz ZLKUWUKXLCTQDB-AWEZNQCLSA-N 2 0 243.439 2.119 20 0 BEADRP C[NH2+][C@H]1C[C@H]([NH2+][C@@H]2CCc3ccc(C)cc3C2)C1 ZINC001246458779 987815395 /nfs/dbraw/zinc/81/53/95/987815395.db2.gz BYRFDXKJAYGSAP-BZUAXINKSA-N 2 0 244.382 2.192 20 0 BEADRP C[NH2+][C@H]1C[C@H]([NH2+][C@H]2CCCC(C)(C)C2)C1 ZINC001246462410 987823080 /nfs/dbraw/zinc/82/30/80/987823080.db2.gz RIPNTSIDBGPMJM-SRVKXCTJSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CCc3sccc32)CC[NH2+]1 ZINC001246475195 987831140 /nfs/dbraw/zinc/83/11/40/987831140.db2.gz SLSPOPSQMMRRHO-FOGDFJRCSA-N 2 0 236.384 2.466 20 0 BEADRP CCCC(C[NH3+])(CCC)N[C@@H]1CCC[NH2+]CC1 ZINC001246494151 987849662 /nfs/dbraw/zinc/84/96/62/987849662.db2.gz FKZZYRRELZCXSO-CYBMUJFWSA-N 2 0 241.423 2.016 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC001246495559 987849850 /nfs/dbraw/zinc/84/98/50/987849850.db2.gz QCNQNSWDRFOQGF-RLMRIHLYSA-N 2 0 222.376 2.294 20 0 BEADRP CC[C@H](Cc1ccccc1)[NH2+][C@H]1C[C@@H]([NH2+]C)C1 ZINC001246496363 987850172 /nfs/dbraw/zinc/85/01/72/987850172.db2.gz MYALZVZRYRYQRQ-KFWWJZLASA-N 2 0 232.371 2.348 20 0 BEADRP C[NH2+][C@H]1C[C@@H]([NH2+][C@@H]2CCCC(C)(C)C2)C1 ZINC001246497777 987852228 /nfs/dbraw/zinc/85/22/28/987852228.db2.gz RIPNTSIDBGPMJM-UTUOFQBUSA-N 2 0 210.365 2.295 20 0 BEADRP CC(C)C1CCC([NH2+]C23CC([NH3+])(C2)C3)CC1 ZINC001246499136 987852845 /nfs/dbraw/zinc/85/28/45/987852845.db2.gz BSYXSCGSMKQGQW-UHFFFAOYSA-N 2 0 222.376 2.425 20 0 BEADRP CCc1ccc(C[C@@H](C)[NH2+]C23CC([NH3+])(C2)C3)cc1 ZINC001246500217 987857095 /nfs/dbraw/zinc/85/70/95/987857095.db2.gz GQLZOWYXVDKQNJ-UWTIGNOOSA-N 2 0 244.382 2.403 20 0 BEADRP CC(C)COCC[C@H](C)[NH+]1CCC(C[NH3+])CC1 ZINC001246537664 987898231 /nfs/dbraw/zinc/89/82/31/987898231.db2.gz JHGOCIJZWGYCMB-ZDUSSCGKSA-N 2 0 242.407 2.108 20 0 BEADRP [NH3+][C@@H]1CCC[N@@H+]([C@@H]2Cc3cccc(F)c3C2)CC1 ZINC001246542995 987908468 /nfs/dbraw/zinc/90/84/68/987908468.db2.gz QWZBYFANCUUZIX-CHWSQXEVSA-N 2 0 248.345 2.106 20 0 BEADRP C[C@@H](Cc1ccncc1)[N@@H+]1CCC[C@](C)([NH3+])CC1 ZINC001246548391 987926371 /nfs/dbraw/zinc/92/63/71/987926371.db2.gz GKXQUCGGILPRRI-ZFWWWQNUSA-N 2 0 247.386 2.216 20 0 BEADRP CC[C@@H]1CC[C@@H]([N@@H+]2C[C@H](C)[C@H](C[NH3+])C2)C1 ZINC001246547746 987929819 /nfs/dbraw/zinc/92/98/19/987929819.db2.gz NBRVWLZDDNQPIM-UMSGYPCISA-N 2 0 210.365 2.092 20 0 BEADRP C[C@@H](Cc1ccco1)[N@@H+]1CCC[C@](C)([NH3+])CC1 ZINC001246547896 987931212 /nfs/dbraw/zinc/93/12/12/987931212.db2.gz CZWUYTFNVDVXFN-JSGCOSHPSA-N 2 0 236.359 2.414 20 0 BEADRP C[C@@H](Cc1ccccn1)[N@@H+]1CCC[C@@](C)([NH3+])CC1 ZINC001246553086 987952837 /nfs/dbraw/zinc/95/28/37/987952837.db2.gz QWIAFTSRSYVGNQ-DZGCQCFKSA-N 2 0 247.386 2.216 20 0 BEADRP CC[C@@H]1C[C@H]([N@@H+]2CCC[C@@](C)([NH3+])CC2)CCO1 ZINC001246551689 987955696 /nfs/dbraw/zinc/95/56/96/987955696.db2.gz MKFQZNDFZPNPCM-MGPQQGTHSA-N 2 0 240.391 2.147 20 0 BEADRP CC1(C)CC[C@@H]([N@@H+]2CCC(F)(F)[C@H](C[NH3+])C2)C1 ZINC001246553305 987958320 /nfs/dbraw/zinc/95/83/20/987958320.db2.gz AUEMDAXSVSUTQF-GHMZBOCLSA-N 2 0 246.345 2.481 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]Cc1ccc(F)cc1C ZINC001117953391 987965629 /nfs/dbraw/zinc/96/56/29/987965629.db2.gz GBKIGGPTXJPQTQ-NSHDSACASA-N 2 0 224.323 2.222 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@@H](C)c1ccc2c(c1)COC2 ZINC001118057300 987993151 /nfs/dbraw/zinc/99/31/51/987993151.db2.gz CKLQRQADWYAYGC-RYUDHWBXSA-N 2 0 248.370 2.365 20 0 BEADRP C[C@@H]1CC[N@@H+]([C@@H]2C[C@H]3C[C@H]3C2)CC[C@H]1C[NH3+] ZINC001246561419 987994973 /nfs/dbraw/zinc/99/49/73/987994973.db2.gz SLTVLHYHBFMFMJ-XHJNMGKDSA-N 2 0 222.376 2.092 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@H](C)c1ccc(OC)cc1 ZINC001118060132 987997628 /nfs/dbraw/zinc/99/76/28/987997628.db2.gz WRVLZGQEBAHPKJ-NWDGAFQWSA-N 2 0 236.359 2.344 20 0 BEADRP CCCC(CCC)[N@@H+]1CCCC[C@](O)(C[NH3+])C1 ZINC001246561600 987998844 /nfs/dbraw/zinc/99/88/44/987998844.db2.gz QXDCCRQHVFCSQV-AWEZNQCLSA-N 2 0 242.407 2.131 20 0 BEADRP CCSC[C@H](C)[N@@H+]1CCC[C@@H](C[NH3+])[C@H](C)C1 ZINC001246563591 988009700 /nfs/dbraw/zinc/00/97/00/988009700.db2.gz RZQZVGUMTJUMJC-AGIUHOORSA-N 2 0 244.448 2.435 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]CCCCOc1ccccc1 ZINC001118119614 988020329 /nfs/dbraw/zinc/02/03/29/988020329.db2.gz OJQHWXMBYDLWRC-HUUCEWRRSA-N 2 0 248.370 2.315 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]1[NH2+]CCCCOc1ccccc1 ZINC001118119611 988022015 /nfs/dbraw/zinc/02/20/15/988022015.db2.gz OJQHWXMBYDLWRC-GJZGRUSLSA-N 2 0 248.370 2.315 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@@H](C)c1ccc(F)cc1 ZINC001118121980 988028730 /nfs/dbraw/zinc/02/87/30/988028730.db2.gz MBHOKJJILFOKEZ-QWRGUYRKSA-N 2 0 224.323 2.474 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H](C)c1sc(C)nc1C ZINC001118121822 988029105 /nfs/dbraw/zinc/02/91/05/988029105.db2.gz JDZXKYFAQAXLTM-BDAKNGLRSA-N 2 0 241.404 2.409 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2CCC[C@@H](C[NH3+])[C@H](C)C2)C1 ZINC001246567926 988033046 /nfs/dbraw/zinc/03/30/46/988033046.db2.gz NELLSDZIAPVAML-MQYQWHSLSA-N 2 0 224.392 2.482 20 0 BEADRP C[C@@]1(F)CCCN(C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC001246570960 988048263 /nfs/dbraw/zinc/04/82/63/988048263.db2.gz BYQFCCHESVNQIN-ZGVCCVRISA-N 2 0 226.339 2.093 20 0 BEADRP C[C@@H]1CCN([C@H]2CCC[NH2+]C2)CCC1(F)F ZINC001246569678 988055856 /nfs/dbraw/zinc/05/58/56/988055856.db2.gz RSFOLKJBXAYPHK-MNOVXSKESA-N 2 0 232.318 2.106 20 0 BEADRP C[C@@H]1C[C@@H]([N@@H+]2CCC[C@@](C)(C[NH3+])CC2)CCO1 ZINC001246576612 988080874 /nfs/dbraw/zinc/08/08/74/988080874.db2.gz LTSHHWBNKMLITL-HZSPNIEDSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@@]1(C[NH3+])CCCC[N@@H+](C2CCSCC2)C1 ZINC001246579709 988101920 /nfs/dbraw/zinc/10/19/20/988101920.db2.gz GPLRYBNYTMVHLH-ZDUSSCGKSA-N 2 0 242.432 2.333 20 0 BEADRP C[C@@H](CC(F)(F)F)[NH+]1CCC(F)(C[NH3+])CC1 ZINC001246625927 988111269 /nfs/dbraw/zinc/11/12/69/988111269.db2.gz IOACIGVGLRJXJX-QMMMGPOBSA-N 2 0 242.260 2.090 20 0 BEADRP Cc1ccc2c(c1)C[C@H]([NH+]1CC(C)(C[NH3+])C1)CC2 ZINC001246591013 988166539 /nfs/dbraw/zinc/16/65/39/988166539.db2.gz UWRDPKVHGTVIND-OAHLLOKOSA-N 2 0 244.382 2.133 20 0 BEADRP C[C@H](Cc1ccncc1)[N@@H+]1CCCC[C@@H](C[NH3+])C1 ZINC001246590583 988170809 /nfs/dbraw/zinc/17/08/09/988170809.db2.gz HHTRHMIAFNEUCN-HIFRSBDPSA-N 2 0 247.386 2.073 20 0 BEADRP CC[C@@H](C)C[C@H](CC)[NH+]1CC(C[NH2+]C)C1 ZINC001246593130 988174904 /nfs/dbraw/zinc/17/49/04/988174904.db2.gz AGEVLKBEWZHKMB-YPMHNXCESA-N 2 0 212.381 2.352 20 0 BEADRP CCOCC[C@H](C)[N@@H+]1CCCC[C@@](C)(C[NH3+])C1 ZINC001246595224 988183922 /nfs/dbraw/zinc/18/39/22/988183922.db2.gz SHSOHVYPPUUEDK-KBPBESRZSA-N 2 0 242.407 2.252 20 0 BEADRP CCC[C@H](C)CC[C@@H](C)[NH+]1CC(C[NH3+])C1 ZINC001246594104 988190627 /nfs/dbraw/zinc/19/06/27/988190627.db2.gz JSJLJIJMPVOTKF-NWDGAFQWSA-N 2 0 212.381 2.482 20 0 BEADRP CCOCC[C@@H](C)[N@@H+]1CCCC[C@@](C)(C[NH3+])C1 ZINC001246595226 988190777 /nfs/dbraw/zinc/19/07/77/988190777.db2.gz SHSOHVYPPUUEDK-KGLIPLIRSA-N 2 0 242.407 2.252 20 0 BEADRP C[C@H]1C[C@H]([NH+]2CC(C)(C[NH3+])C2)C[C@@H](C)C1 ZINC001246599693 988206815 /nfs/dbraw/zinc/20/68/15/988206815.db2.gz PWBHJUYAGIKRRD-GDNZZTSVSA-N 2 0 210.365 2.092 20 0 BEADRP CCOCC[C@@H](C)[N@@H+]1CCC[C@]12CCC[NH2+]C2 ZINC001246613406 988247150 /nfs/dbraw/zinc/24/71/50/988247150.db2.gz ZDXWKRBGOBWYOT-KGLIPLIRSA-N 2 0 240.391 2.020 20 0 BEADRP CC[C@H]1CC[C@@H]([NH+]2CCC(F)(C[NH3+])CC2)C1 ZINC001246618228 988259017 /nfs/dbraw/zinc/25/90/17/988259017.db2.gz HUZARURPTMILCM-NWDGAFQWSA-N 2 0 228.355 2.328 20 0 BEADRP CC[C@@H](CC(C)C)[N@@H+]1CC[C@H]2C[NH2+]C[C@H]21 ZINC001246634123 988277093 /nfs/dbraw/zinc/27/70/93/988277093.db2.gz AIQIMIYWYPRPJE-RWMBFGLXSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@H]1CCC[C@H]([NH+]2CCC(F)(C[NH3+])CC2)C1 ZINC001246627583 988291984 /nfs/dbraw/zinc/29/19/84/988291984.db2.gz NPGSAJPNQVOKIP-RYUDHWBXSA-N 2 0 228.355 2.328 20 0 BEADRP C[C@@H]1CCC[C@H]([NH+]2CCC(F)(C[NH3+])CC2)C1 ZINC001246627581 988298042 /nfs/dbraw/zinc/29/80/42/988298042.db2.gz NPGSAJPNQVOKIP-NEPJUHHUSA-N 2 0 228.355 2.328 20 0 BEADRP CC(C)CC[C@@H](C)[N@@H+]1CC[C@H]2C[NH2+]CC[C@H]21 ZINC001246629669 988301838 /nfs/dbraw/zinc/30/18/38/988301838.db2.gz ZFUOFMZDLTUJEP-HZSPNIEDSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1CC[C@@H]([N@H+]2C[C@@H]3CC(F)(F)C[C@@H]3C2)C[NH2+]1 ZINC001246640477 988340652 /nfs/dbraw/zinc/34/06/52/988340652.db2.gz UONSFSKAHKTOKM-WISYIIOYSA-N 2 0 244.329 2.104 20 0 BEADRP CC[C@@H](C)OCC[C@@H](C)N1CC[C@@H]2[NH2+]CC[C@H]21 ZINC001246641473 988347664 /nfs/dbraw/zinc/34/76/64/988347664.db2.gz IIZLUQXGDFMESW-YIYPIFLZSA-N 2 0 240.391 2.016 20 0 BEADRP CC[C@H](CC(C)C)[N@@H+]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC001246647324 988361178 /nfs/dbraw/zinc/36/11/78/988361178.db2.gz KLKSKHSCSZQZIG-HZSPNIEDSA-N 2 0 224.392 2.352 20 0 BEADRP C1[C@@H]2C[C@@H]([N@@H+]3CCCC[C@@]34CC[NH2+]C4)C[C@H]12 ZINC001246645851 988366203 /nfs/dbraw/zinc/36/62/03/988366203.db2.gz WSKZRICTSLUXDG-CRWXNKLISA-N 2 0 220.360 2.003 20 0 BEADRP C[C@@H]1CC[C@@H]([N@@H+]2CC[C@@H]3C[NH2+]C[C@H]3C2)C[C@H]1C ZINC001246647332 988366862 /nfs/dbraw/zinc/36/68/62/988366862.db2.gz KROHLJIPCZFNHG-ARILJUKYSA-N 2 0 236.403 2.352 20 0 BEADRP CC[C@H](Cc1ccccc1)[N@@H+]1CC[C@H]2C[C@@]2([NH3+])C1 ZINC001246654335 988377323 /nfs/dbraw/zinc/37/73/23/988377323.db2.gz KARGKMPFJVUQKI-ARFHVFGLSA-N 2 0 244.382 2.431 20 0 BEADRP CCC[C@H](Cc1ccccc1)[N@H+]1C[C@@H]2[C@@H]([NH3+])[C@@H]2C1 ZINC001246653855 988377909 /nfs/dbraw/zinc/37/79/09/988377909.db2.gz AOGLKUOMMWXMKW-WCVJEAGWSA-N 2 0 244.382 2.287 20 0 BEADRP CCCC(CCC)[N@@H+]1C[C@@H]2CC[NH2+][C@@H]2C1 ZINC001246651966 988380152 /nfs/dbraw/zinc/38/01/52/988380152.db2.gz NBPIGOWQGDYMQG-WCQYABFASA-N 2 0 210.365 2.249 20 0 BEADRP CC(C)CC[C@@H](C)[N@@H+]1C[C@H]2CCC[NH2+][C@H]2C1 ZINC001246657310 988383190 /nfs/dbraw/zinc/38/31/90/988383190.db2.gz LKPHPUNAQOIBGT-MCIONIFRSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1C[C@H]([N@H+]2C[C@H]3[C@H](CCC3(F)F)C2)CC[NH2+]1 ZINC001246656401 988385572 /nfs/dbraw/zinc/38/55/72/988385572.db2.gz NOJKRZHMJRVRJY-KKOKHZNYSA-N 2 0 244.329 2.104 20 0 BEADRP CCC[C@@H](CC)[N@@H+]1C[C@H]2CCC[NH2+][C@H]2C1 ZINC001246659317 988391266 /nfs/dbraw/zinc/39/12/66/988391266.db2.gz RMUMLZSMRSZOPA-UPJWGTAASA-N 2 0 210.365 2.249 20 0 BEADRP CC(C)C[C@H](C)C[C@H](C)[N@H+]1C[C@@H]2[C@@H]([NH3+])[C@@H]2C1 ZINC001246661411 988396949 /nfs/dbraw/zinc/39/69/49/988396949.db2.gz WVMYHYMFPFBHBB-QSLWVIQJSA-N 2 0 224.392 2.336 20 0 BEADRP CC(C)CCC[C@H](C)[N@@H+]1C[C@@H]2C[NH2+]CC[C@@H]21 ZINC001246669874 988409506 /nfs/dbraw/zinc/40/95/06/988409506.db2.gz CFOHPPNMUVQRHY-IHRRRGAJSA-N 2 0 224.392 2.495 20 0 BEADRP CC(C)CCC[C@H](C)[N@@H+]1C[C@H]2C[NH2+]CC[C@@H]21 ZINC001246669876 988414875 /nfs/dbraw/zinc/41/48/75/988414875.db2.gz CFOHPPNMUVQRHY-MJBXVCDLSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2C[C@H]3C[NH2+]CC[C@H]32)CC(C)(C)C1 ZINC001246672751 988415772 /nfs/dbraw/zinc/41/57/72/988415772.db2.gz LGJIRXWEVMKIAM-YIYPIFLZSA-N 2 0 236.403 2.495 20 0 BEADRP CC[C@H](CC(C)C)[N@@H+]1CCCC2(C[NH2+]C2)C1 ZINC001246789222 988467116 /nfs/dbraw/zinc/46/71/16/988467116.db2.gz CFXRUDAGLXEZCE-CYBMUJFWSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1c[nH+]c2ccccc2c1N1CC[NH+](C)CC1 ZINC001323426410 988525977 /nfs/dbraw/zinc/52/59/77/988525977.db2.gz JJIBBOSXJNODOY-UHFFFAOYSA-N 2 0 241.338 2.295 20 0 BEADRP C1CC[C@H]2C[N@@H+]([C@@H]3CCC[NH2+]C3)CC[C@H]2C1 ZINC001246833765 988529251 /nfs/dbraw/zinc/52/92/51/988529251.db2.gz ICLNTGGGMVODTQ-HZSPNIEDSA-N 2 0 222.376 2.251 20 0 BEADRP CC(C)CC[C@H](C)[N@@H+]1C[C@H]2CC[NH2+]C[C@H]2C1 ZINC001246842692 988548877 /nfs/dbraw/zinc/54/88/77/988548877.db2.gz DAGDJKVRDDUYOU-MJBXVCDLSA-N 2 0 224.392 2.352 20 0 BEADRP CCCC(CCC)[N@@H+]1C[C@H]2CC[NH2+]C[C@H]2C1 ZINC001246846428 988558170 /nfs/dbraw/zinc/55/81/70/988558170.db2.gz NPDAZVZRNKDCEM-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@H]1CCC[N@@H+]([C@@H]2CC[NH2+][C@H](C)C2)C1 ZINC001246851174 988568609 /nfs/dbraw/zinc/56/86/09/988568609.db2.gz YSHLPAJQSFDQCS-FRRDWIJNSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2C[C@@H]3CC[C@]3([NH3+])C2)C[C@@H]1C ZINC001246856435 988578000 /nfs/dbraw/zinc/57/80/00/988578000.db2.gz XCGMYMWJYUBWPS-QMVSFRDZSA-N 2 0 222.376 2.234 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2C[C@@H]3CC[C@@]3([NH3+])C2)C[C@H]1C ZINC001246856430 988580316 /nfs/dbraw/zinc/58/03/16/988580316.db2.gz XCGMYMWJYUBWPS-PEBLQZBPSA-N 2 0 222.376 2.234 20 0 BEADRP CC1(C)CCC([N@@H+]2C[C@H]3CC[C@]3([NH3+])C2)CC1 ZINC001246859857 988584353 /nfs/dbraw/zinc/58/43/53/988584353.db2.gz KWMLIRXMHSHVCQ-RISCZKNCSA-N 2 0 222.376 2.378 20 0 BEADRP CCC1CCC([N@@H+]2C[C@@H]3CC[C@@]3([NH3+])C2)CC1 ZINC001246860161 988599571 /nfs/dbraw/zinc/59/95/71/988599571.db2.gz MBBOTDGVSZQUBK-GNRIBBGQSA-N 2 0 222.376 2.378 20 0 BEADRP C[C@@H]1CCC[C@H]([N@@H+]2C[C@H]3CC[C@@H](C2)[NH2+]C3)C1 ZINC001246867589 988617072 /nfs/dbraw/zinc/61/70/72/988617072.db2.gz PMPOMMLRPUTAOX-RFGFWPKPSA-N 2 0 222.376 2.249 20 0 BEADRP CC[C@@H](CC(C)C)[N@@H+]1CC[C@H](C[NH2+]C)C1 ZINC001246866134 988618959 /nfs/dbraw/zinc/61/89/59/988618959.db2.gz ZXTQXFAZDOEERL-OLZOCXBDSA-N 2 0 212.381 2.352 20 0 BEADRP CCCC[C@@H](C)[N@@H+]1C[C@H]2CC[C@@H](C1)[NH2+]C2 ZINC001246867040 988619796 /nfs/dbraw/zinc/61/97/96/988619796.db2.gz MZVDKJSAULNGEA-AGIUHOORSA-N 2 0 210.365 2.249 20 0 BEADRP C[NH2+]CC[C@H](C)[N@@H+]1Cc2ccccc2C[C@H]1C ZINC001246874050 988635427 /nfs/dbraw/zinc/63/54/27/988635427.db2.gz UVBNDJVPWHJJTD-QWHCGFSZSA-N 2 0 232.371 2.431 20 0 BEADRP C[C@H]1CC[C@H]([NH+]2CC3CCC(CC3)C2)C[NH2+]1 ZINC001246881784 988648452 /nfs/dbraw/zinc/64/84/52/988648452.db2.gz JCNKGSVZDFHVCG-ABXWRUBCSA-N 2 0 222.376 2.249 20 0 BEADRP CCc1ccc(C[NH2+]CC[C@H](C)[NH2+]C)s1 ZINC001325321330 989155314 /nfs/dbraw/zinc/15/53/14/989155314.db2.gz VCPVAQNDHVJDRX-JTQLQIEISA-N 2 0 226.389 2.398 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H](C)CSC(C)(C)C ZINC001325743316 989247472 /nfs/dbraw/zinc/24/74/72/989247472.db2.gz LBMNBQSDHQHNJB-MNOVXSKESA-N 2 0 232.437 2.352 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@H](C)Cc1cccs1 ZINC001325744244 989247627 /nfs/dbraw/zinc/24/76/27/989247627.db2.gz RYMXUIPUDQDAFY-WDEREUQCSA-N 2 0 226.389 2.267 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H]1C[C@@H](OC(C)C)C1(C)C ZINC001325744819 989250600 /nfs/dbraw/zinc/25/06/00/989250600.db2.gz VLUVJVCFFQDBJZ-JHJVBQTASA-N 2 0 242.407 2.166 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+]CCCC[NH3+])c(C)n1 ZINC001325756489 989252177 /nfs/dbraw/zinc/25/21/77/989252177.db2.gz VMGXLLURLRPBJS-LLVKDONJSA-N 2 0 221.348 2.088 20 0 BEADRP CC[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)C2(Cl)CC2)C1 ZINC001119623188 989254487 /nfs/dbraw/zinc/25/44/87/989254487.db2.gz FWZKVHVFIQLMFM-RYUDHWBXSA-N 2 0 244.810 2.468 20 0 BEADRP Cc1ccc2c(c1)CC[C@@H]2[NH2+]CCCC[NH3+] ZINC001325755659 989255585 /nfs/dbraw/zinc/25/55/85/989255585.db2.gz FATSJCWTVMCIHH-AWEZNQCLSA-N 2 0 218.344 2.311 20 0 BEADRP C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C[NH2+]C1CCC(C[NH3+])CC1 ZINC001119630483 989266855 /nfs/dbraw/zinc/26/68/55/989266855.db2.gz FSAXXVWDDWFHGA-VVVIAYQMSA-N 2 0 236.403 2.386 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H](C)c1ccsc1 ZINC001326036646 989325149 /nfs/dbraw/zinc/32/51/49/989325149.db2.gz SCEGVVGEDFYBBS-ZJUUUORDSA-N 2 0 212.362 2.397 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H]1CCCc2ccccc2C1 ZINC001326034826 989330880 /nfs/dbraw/zinc/33/08/80/989330880.db2.gz AIMNAAMOEXXBSL-CZUORRHYSA-N 2 0 246.398 2.379 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H](C)Cc1cccs1 ZINC001326035942 989331236 /nfs/dbraw/zinc/33/12/36/989331236.db2.gz MTCBZRCFOWLFTF-QWRGUYRKSA-N 2 0 226.389 2.124 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H]1CC[C@@H](C)C[C@H]1C ZINC001326040432 989343902 /nfs/dbraw/zinc/34/39/02/989343902.db2.gz XXINOSBHBUILEK-FDYHWXHSSA-N 2 0 212.381 2.399 20 0 BEADRP Cc1ncccc1CC[NH2+]C1CCC(C[NH3+])CC1 ZINC001120255257 989610216 /nfs/dbraw/zinc/61/02/16/989610216.db2.gz CHBAMLMOLIBMMU-UHFFFAOYSA-N 2 0 247.386 2.040 20 0 BEADRP F[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)C1 ZINC001326581442 989615837 /nfs/dbraw/zinc/61/58/37/989615837.db2.gz AJVTWERYPGUPPN-XHJNMGKDSA-N 2 0 240.366 2.245 20 0 BEADRP C[C@H]1CC([NH2+]CCSCC[NH3+])C[C@H](C)C1 ZINC001258157113 991041145 /nfs/dbraw/zinc/04/11/45/991041145.db2.gz ZNDATSREOMRAKY-GHMZBOCLSA-N 2 0 230.421 2.093 20 0 BEADRP C[C@@H]1CC([N@H+]2C[C@H]3C[NH+](C)C[C@H]3C2)C[C@@H](C)C1 ZINC001258169137 991064214 /nfs/dbraw/zinc/06/42/14/991064214.db2.gz USXDQRYXSJLCJA-XDQVBPFNSA-N 2 0 236.403 2.305 20 0 BEADRP CC(C)[N@H+](CCC[NH3+])[C@@H](C)Cc1ccco1 ZINC001258176455 991073029 /nfs/dbraw/zinc/07/30/29/991073029.db2.gz VYEADXLWBIEPHD-LBPRGKRZSA-N 2 0 224.348 2.270 20 0 BEADRP CCC[N@H+](CCC[NH3+])[C@H](C)Cc1ccco1 ZINC001258176412 991076297 /nfs/dbraw/zinc/07/62/97/991076297.db2.gz UPAAOARQUZGKEL-GFCCVEGCSA-N 2 0 224.348 2.271 20 0 BEADRP C[C@@H](Cc1ccco1)N1C[C@H]2C[C@@]2(C[NH+](C)C)C1 ZINC001258199506 991115934 /nfs/dbraw/zinc/11/59/34/991115934.db2.gz ONIUNCYUYAYNBR-GZBFAFLISA-N 2 0 248.370 2.094 20 0 BEADRP CCC[N@H+](CCC[NH3+])[C@@H](C)CCSC ZINC001258200853 991119525 /nfs/dbraw/zinc/11/95/25/991119525.db2.gz XSRXJXOSJVKQJS-NSHDSACASA-N 2 0 218.410 2.189 20 0 BEADRP CSCC[C@@H](C)[NH2+]C(C)(C)CC[NH+](C)C ZINC001258205206 991123251 /nfs/dbraw/zinc/12/32/51/991123251.db2.gz HAFCOLTVXWVZQD-LLVKDONJSA-N 2 0 232.437 2.448 20 0 BEADRP CCC1C[NH+](CC2CC[NH+](CC)CC2)C1 ZINC001308801233 991140868 /nfs/dbraw/zinc/14/08/68/991140868.db2.gz AZVIDWNVEPTVIK-UHFFFAOYSA-N 2 0 210.365 2.060 20 0 BEADRP CSC(C)(C)C[C@H](C)[NH2+]C[C@@H]1CC[N@H+](C)C1 ZINC001258317016 991244000 /nfs/dbraw/zinc/24/40/00/991244000.db2.gz VFABOCYNBMXCEC-RYUDHWBXSA-N 2 0 244.448 2.448 20 0 BEADRP CSC(C)(C)C[C@H](C)[NH2+]C[C@H]1CC[N@H+](C)C1 ZINC001258317015 991244940 /nfs/dbraw/zinc/24/49/40/991244940.db2.gz VFABOCYNBMXCEC-NWDGAFQWSA-N 2 0 244.448 2.448 20 0 BEADRP CSC(C)(C)C[C@@H](C)[N@@H+]1CCC[C@@H]([NH3+])C1 ZINC001258321843 991249182 /nfs/dbraw/zinc/24/91/82/991249182.db2.gz RYQNWXGVYYURQU-GHMZBOCLSA-N 2 0 230.421 2.330 20 0 BEADRP CSC(C)(C)C[C@H](C)[NH2+]C[C@H](C)C[NH3+] ZINC001258333936 991258826 /nfs/dbraw/zinc/25/88/26/991258826.db2.gz QISIDTPLZGASIB-ZJUUUORDSA-N 2 0 218.410 2.091 20 0 BEADRP CSC(C)(C)C[C@H](C)[N@H+](C)C[C@@H](C)C[NH3+] ZINC001258335131 991259075 /nfs/dbraw/zinc/25/90/75/991259075.db2.gz XFIUVFMPDHFRIB-QWRGUYRKSA-N 2 0 232.437 2.433 20 0 BEADRP C[C@H](CC1CC1)[NH+]1CCC([NH+](C)C)CC1 ZINC001258457978 991413289 /nfs/dbraw/zinc/41/32/89/991413289.db2.gz NGKGQFMJBFFPCR-LLVKDONJSA-N 2 0 210.365 2.201 20 0 BEADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@H]1CC[C@@H](C)C1 ZINC001560393548 991465292 /nfs/dbraw/zinc/46/52/92/991465292.db2.gz AYTMFZNCTFJRLB-HZSPNIEDSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H](Cc1cccnc1)[NH2+][C@@H]1CCC[N@H+](C)CC1 ZINC001258613197 991535448 /nfs/dbraw/zinc/53/54/48/991535448.db2.gz LFBKMGKZFBDRFR-DZGCQCFKSA-N 2 0 247.386 2.087 20 0 BEADRP C[C@@H](Cc1cccnc1)[N@H+](C)C1CCC([NH3+])CC1 ZINC001258612446 991537216 /nfs/dbraw/zinc/53/72/16/991537216.db2.gz WYOZJSHDQZBAIX-GRTSSRMGSA-N 2 0 247.386 2.214 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@H]2C[NH+]3CCC2CC3)C1 ZINC001561033937 991694064 /nfs/dbraw/zinc/69/40/64/991694064.db2.gz AGYHJPYQWTZZLA-XBFCOCLRSA-N 2 0 222.376 2.106 20 0 BEADRP C[C@H](CC1CCC1)[NH2+][C@@H]1CC[C@H]2C[N@H+](C)C[C@@H]21 ZINC001561052482 991704046 /nfs/dbraw/zinc/70/40/46/991704046.db2.gz BZENTAHWHLDEKX-UQOMUDLDSA-N 2 0 236.403 2.495 20 0 BEADRP CCC[NH+]1CCC(N2CC3(CCC3)C2)CC1 ZINC001258771971 991740074 /nfs/dbraw/zinc/74/00/74/991740074.db2.gz DRQFUFJVFIJJQF-UHFFFAOYSA-N 2 0 222.376 2.347 20 0 BEADRP CCC[NH+]1CCC([N@@H+]2C[C@H]3[C@H](CF)[C@H]3C2)CC1 ZINC001258776067 991744667 /nfs/dbraw/zinc/74/46/67/991744667.db2.gz RLLLPWXVPHLHOJ-ZSOGYDGISA-N 2 0 240.366 2.008 20 0 BEADRP CC[C@@H](C)C[C@@H](CC)NC(=[NH2+])SCC[NH3+] ZINC001258780576 991750613 /nfs/dbraw/zinc/75/06/13/991750613.db2.gz PIIKMBUUPZHGSC-NXEZZACHSA-N 2 0 231.409 2.417 20 0 BEADRP CC[C@@H](C)C[C@H](CC)[NH2+]CCSCC[NH3+] ZINC001258783085 991754389 /nfs/dbraw/zinc/75/43/89/991754389.db2.gz AYIRLYOKZWHXIA-NEPJUHHUSA-N 2 0 232.437 2.483 20 0 BEADRP C[C@@H]1CCC[C@H]([N@@H+]2C[C@H]3C[C@@]3(C[NH+](C)C)C2)C1 ZINC001258827011 991850493 /nfs/dbraw/zinc/85/04/93/991850493.db2.gz GJJRVLBQMOLHMB-APIJFGDWSA-N 2 0 236.403 2.449 20 0 BEADRP CS[C@@H]1CC[C@@H]([N@H+](C)CCn2ccnc2)C1 ZINC001319441772 991870097 /nfs/dbraw/zinc/87/00/97/991870097.db2.gz CSCLBPBDZVKHHN-VXGBXAGGSA-N 2 0 239.388 2.099 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H]1C[C@H]1C ZINC001258898443 991886518 /nfs/dbraw/zinc/88/65/18/991886518.db2.gz XLLBLCWRAPAHDJ-JHJVBQTASA-N 2 0 212.381 2.495 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)n1ccnc1C[NH3+] ZINC001258897265 991891094 /nfs/dbraw/zinc/89/10/94/991891094.db2.gz HCQXEJZYIKCXFB-GFCCVEGCSA-N 2 0 238.379 2.025 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H]1C[C@H]1F ZINC001258900338 991894722 /nfs/dbraw/zinc/89/47/22/991894722.db2.gz JPGOBZKZSIDAOJ-QJPTWQEYSA-N 2 0 216.344 2.197 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H]1C[C@@H](OC)C1 ZINC001258900071 991895566 /nfs/dbraw/zinc/89/55/66/991895566.db2.gz ZOGUNUCGFJMPMO-MELADBBJSA-N 2 0 242.407 2.264 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)n1cc(C[NH3+])cn1 ZINC001258899221 991897058 /nfs/dbraw/zinc/89/70/58/991897058.db2.gz IDMGTLAGWYXVGU-LBPRGKRZSA-N 2 0 238.379 2.025 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CC(COC)C1 ZINC001258907296 991898348 /nfs/dbraw/zinc/89/83/48/991898348.db2.gz HUNMJSQYPGLYGX-CYBMUJFWSA-N 2 0 242.407 2.075 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CC[C@H](OC)C1 ZINC001258907702 991901719 /nfs/dbraw/zinc/90/17/19/991901719.db2.gz MVALTROYWCVYNB-KBPBESRZSA-N 2 0 242.407 2.218 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]C/C=C\c1ccccc1 ZINC001261370261 992276015 /nfs/dbraw/zinc/27/60/15/992276015.db2.gz CWONDIGYJZRLHL-XURPKSDJSA-N 2 0 218.344 2.287 20 0 BEADRP c1cc(C[NH2+][C@@H]2CCC[NH2+]CC2)cc2c1CCC2 ZINC001261370382 992276048 /nfs/dbraw/zinc/27/60/48/992276048.db2.gz HWLVTFZRGRNPBR-MRXNPFEDSA-N 2 0 244.382 2.407 20 0 BEADRP Cc1csc(CCC[NH2+][C@@H](C)C[C@H](C)[NH3+])n1 ZINC001261423316 992292327 /nfs/dbraw/zinc/29/23/27/992292327.db2.gz SXLDABMBUHXRGU-UWVGGRQHSA-N 2 0 241.404 2.100 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H]1CCC[C@H]1CCCF ZINC001261423748 992292818 /nfs/dbraw/zinc/29/28/18/992292818.db2.gz CWHNTIHFJDETFL-AGIUHOORSA-N 2 0 230.371 2.492 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H](C)c1cccs1 ZINC001261423759 992298527 /nfs/dbraw/zinc/29/85/27/992298527.db2.gz DAHIXXYBOXLDNM-NXEZZACHSA-N 2 0 212.362 2.397 20 0 BEADRP Cc1ccc(NC(=[NH2+])NCC[NH+]2CCCC2)cc1 ZINC001261566505 992388663 /nfs/dbraw/zinc/38/86/63/992388663.db2.gz MDTVOYRPQZMLFF-UHFFFAOYSA-N 2 0 246.358 2.027 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@@H]([NH2+]CCC(C)(C)C)[C@H]2C1 ZINC001474757049 992522562 /nfs/dbraw/zinc/52/25/62/992522562.db2.gz OTAHFWVGBKLQIC-RWMBFGLXSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@H](C[NH2+]Cc1cccn1C1CC1)C[NH+](C)C ZINC001262031437 992619717 /nfs/dbraw/zinc/61/97/17/992619717.db2.gz RORHLAIJEIPMLD-GFCCVEGCSA-N 2 0 235.375 2.110 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CCCC(F)F)[C@@H](C)C1 ZINC001262160376 992722991 /nfs/dbraw/zinc/72/29/91/992722991.db2.gz CMQJDTGLAYGOSD-WDEREUQCSA-N 2 0 234.334 2.352 20 0 BEADRP Cc1c[nH+]c2ccccc2c1NC[C@H]1CC[N@H+]1C ZINC001262373596 992867680 /nfs/dbraw/zinc/86/76/80/992867680.db2.gz FLFQOBCFJOARPP-GFCCVEGCSA-N 2 0 241.338 2.081 20 0 BEADRP C1=CC2(CCCCC2)[N@H+](CCC2C[NH2+]C2)C1 ZINC001574774619 992900014 /nfs/dbraw/zinc/90/00/14/992900014.db2.gz NLTXSCCKSXOXEH-UHFFFAOYSA-N 2 0 220.360 2.171 20 0 BEADRP C([NH2+][C@H]1CCCC12CC2)[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC001574794242 992908026 /nfs/dbraw/zinc/90/80/26/992908026.db2.gz BUJGCCJDMJJIGP-CRWXNKLISA-N 2 0 234.387 2.439 20 0 BEADRP CC(C)(C)[C@@H]1CCC[C@@H]1[NH2+]C[C@]12C[C@H]1C[NH2+]C2 ZINC001575120400 992989357 /nfs/dbraw/zinc/98/93/57/992989357.db2.gz SYZGKNPWFBDPIQ-SFDCQRBFSA-N 2 0 236.403 2.400 20 0 BEADRP C[NH+](C)[C@H](CNc1cc[nH+]cc1)c1ccsc1 ZINC001262671770 993014174 /nfs/dbraw/zinc/01/41/74/993014174.db2.gz SPEJRKGOTMPBBM-CYBMUJFWSA-N 2 0 247.367 2.280 20 0 BEADRP CC(C)[C@@H]1CCC[C@@H]1[NH2+][C@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC001575497229 993056986 /nfs/dbraw/zinc/05/69/86/993056986.db2.gz CWNZDDBPJWBSJM-QMVSFRDZSA-N 2 0 222.376 2.294 20 0 BEADRP CC(C)CCC1CC[NH+](CC2C[NH2+]C2)CC1 ZINC001575566328 993073137 /nfs/dbraw/zinc/07/31/37/993073137.db2.gz UYDHFWLVDBCZPF-UHFFFAOYSA-N 2 0 224.392 2.354 20 0 BEADRP CC(C)C[NH+]1CCC([C@@H]2[NH2+]CC23CCC3)CC1 ZINC001575596055 993078691 /nfs/dbraw/zinc/07/86/91/993078691.db2.gz WELWAMQTTQIKQI-AWEZNQCLSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H](C1CC1)[N@H+](C[C@H]1CC[C@@H]([NH3+])C1)C1CC1 ZINC001575911889 993124160 /nfs/dbraw/zinc/12/41/60/993124160.db2.gz KYQNNFWPUZEMLD-NTZNESFSSA-N 2 0 222.376 2.377 20 0 BEADRP C[C@H](C[C@H]1CCC[NH2+]1)[NH2+]C[C@]12C[C@H]1CCC2 ZINC001575941720 993133932 /nfs/dbraw/zinc/13/39/32/993133932.db2.gz UFKISVWAWROACA-SYQHCUMBSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]Cc1cccn1C1CC1 ZINC001575943229 993135378 /nfs/dbraw/zinc/13/53/78/993135378.db2.gz RTLBVLKLMYJVBF-GFCCVEGCSA-N 2 0 235.375 2.430 20 0 BEADRP C[C@@H](COCC1CC1)[NH2+]Cc1ccc(C[NH3+])cc1 ZINC001576041053 993165103 /nfs/dbraw/zinc/16/51/03/993165103.db2.gz MFPMLCUOMKZVAF-LBPRGKRZSA-N 2 0 248.370 2.050 20 0 BEADRP C[C@@H]1CCC[C@H]([N@@H+]2CCC[C@H]([NH3+])CC2)C1 ZINC000378665195 993199968 /nfs/dbraw/zinc/19/99/68/993199968.db2.gz FQECACHFXDOELQ-AGIUHOORSA-N 2 0 210.365 2.378 20 0 BEADRP C[C@@H]([NH2+]C[C@]12CCC[C@H]1[NH2+]CC2)C1CCC1 ZINC001576246901 993234848 /nfs/dbraw/zinc/23/48/48/993234848.db2.gz ZXABQZCVVPYPHA-MRVWCRGKSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[NH2+]C[C@H]1C)[C@@H]1CC2CCC1CC2 ZINC001576252801 993235109 /nfs/dbraw/zinc/23/51/09/993235109.db2.gz TZXOBTRFCQTNRF-HFLBYBBMSA-N 2 0 236.403 2.399 20 0 BEADRP CC1(C)[C@H]([NH3+])C[C@@H]1[NH2+]Cc1cccc2[nH]ccc21 ZINC001576380645 993284669 /nfs/dbraw/zinc/28/46/69/993284669.db2.gz WBQSNJTZUDTSBI-KGLIPLIRSA-N 2 0 243.354 2.383 20 0 BEADRP CC1(C)CCC(C)(C)[N@H+](CCC2C[NH2+]C2)C1 ZINC001576409483 993298436 /nfs/dbraw/zinc/29/84/36/993298436.db2.gz HGCRUMQQFNRZAE-UHFFFAOYSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@]1(C[NH3+])CC[N@H+](CC23CCC(CC2)C3)C1 ZINC001576503637 993314166 /nfs/dbraw/zinc/31/41/66/993314166.db2.gz UHILJBMKTUPKDE-ROKHWSDSSA-N 2 0 222.376 2.237 20 0 BEADRP C[C@H]1C[C@H]([NH3+])CC[N@@H+]1CC12CCC(CC1)C2 ZINC001576608558 993367352 /nfs/dbraw/zinc/36/73/52/993367352.db2.gz UNJIQEHAFMBHIZ-RJZJGCCBSA-N 2 0 222.376 2.378 20 0 BEADRP C[C@@H]1CC[C@@H](C)C1[NH2+][C@H]1CCC[N@H+](C)CC1 ZINC000381201681 993378611 /nfs/dbraw/zinc/37/86/11/993378611.db2.gz FJMFIVHKHFQICP-UPJWGTAASA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H]1CC[C@H]([NH2+]C2CC3(CC([NH3+])C3)C2)CS1 ZINC001576665120 993386395 /nfs/dbraw/zinc/38/63/95/993386395.db2.gz CIEVJFFQWGLAHP-NIMGSEGYSA-N 2 0 240.416 2.130 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C2CC3(CC([NH3+])C3)C2)CS1 ZINC001576665118 993386281 /nfs/dbraw/zinc/38/62/81/993386281.db2.gz CIEVJFFQWGLAHP-JFWOKELFSA-N 2 0 240.416 2.130 20 0 BEADRP C[C@@H]1CCC[C@@H](C)[N@H+](CC2(C[NH3+])CC2)C1 ZINC001576669531 993388074 /nfs/dbraw/zinc/38/80/74/993388074.db2.gz SKZMZDIYHYAIFU-VXGBXAGGSA-N 2 0 210.365 2.236 20 0 BEADRP C[NH+](C)C1CCC([NH2+]CCC(F)(F)F)CC1 ZINC000381613267 993408131 /nfs/dbraw/zinc/40/81/31/993408131.db2.gz TXISTOVGCOFZAJ-UHFFFAOYSA-N 2 0 238.297 2.401 20 0 BEADRP Cc1ccc(N[C@@H]2CCC[C@@H]([NH3+])C2)nc1 ZINC000382434504 993460443 /nfs/dbraw/zinc/46/04/43/993460443.db2.gz UHBBORSQYMYUOP-GHMZBOCLSA-N 2 0 205.305 2.072 20 0 BEADRP CCC(C)(C)OCC[NH2+][C@H]1CC[NH2+]CC[C@@H]1C ZINC001576948419 993462980 /nfs/dbraw/zinc/46/29/80/993462980.db2.gz PWANKMBNMWVHSD-STQMWFEESA-N 2 0 242.407 2.169 20 0 BEADRP CC[C@H](C)[C@H](C[N@@H+]1CC[C@H]([NH3+])[C@H](CC)C1)OC ZINC001576961224 993470054 /nfs/dbraw/zinc/47/00/54/993470054.db2.gz LZTCBGMRFQORMR-CRWXNKLISA-N 2 0 242.407 2.107 20 0 BEADRP CC[C@@H](C)[C@@H](C[NH2+][C@@H](C)C1CC[NH2+]CC1)OC ZINC001576969255 993473789 /nfs/dbraw/zinc/47/37/89/993473789.db2.gz BDCLJGJPRLPMLN-MBNYWOFBSA-N 2 0 242.407 2.025 20 0 BEADRP [NH3+]C[C@@H]1CCCC[N@H+](Cc2ccc(F)cc2)C1 ZINC000383512966 993497909 /nfs/dbraw/zinc/49/79/09/993497909.db2.gz LQVLLGXBYDHQLO-ZDUSSCGKSA-N 2 0 236.334 2.387 20 0 BEADRP CC[C@H]1CCC[N@H+](C[C@H]2CC[C@@H]([NH3+])C2)C1 ZINC001577259852 993566277 /nfs/dbraw/zinc/56/62/77/993566277.db2.gz KINPNUYVSSBICA-RWMBFGLXSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@H](CC(F)(F)F)[NH2+]C[C@H]1CCC[NH2+][C@@H]1C ZINC000384344980 993574868 /nfs/dbraw/zinc/57/48/68/993574868.db2.gz CZOINTIMUAOCMU-OPRDCNLKSA-N 2 0 238.297 2.305 20 0 BEADRP CCC[C@H]1CCC[N@@H+]1C[C@H]1CC[C@@H]([NH3+])C1 ZINC001577377115 993635195 /nfs/dbraw/zinc/63/51/95/993635195.db2.gz FIEDPUYWZOLAIS-XQQFMLRXSA-N 2 0 210.365 2.378 20 0 BEADRP CCCC[C@H](CC)[NH2+]C[C@@H]1CCC2(C[NH2+]C2)O1 ZINC001577387956 993636898 /nfs/dbraw/zinc/63/68/98/993636898.db2.gz COUJQFSMOSUOMR-STQMWFEESA-N 2 0 240.391 2.066 20 0 BEADRP CCC[NH+]1CCC([C@H]2[NH2+]CC23CCC3)CC1 ZINC001577531277 993682461 /nfs/dbraw/zinc/68/24/61/993682461.db2.gz ZHEOSWLMLYKFDF-CYBMUJFWSA-N 2 0 222.376 2.251 20 0 BEADRP CCCSC[C@H](C)[NH2+][C@H]1CC[NH2+][C@@H](C)C1 ZINC001577596951 993691777 /nfs/dbraw/zinc/69/17/77/993691777.db2.gz NSKBMHKCZGUWHU-SRVKXCTJSA-N 2 0 230.421 2.248 20 0 BEADRP [NH3+][C@@H]1CCC[N@H+](CCOCc2ccccc2)CC1 ZINC000393230944 993913978 /nfs/dbraw/zinc/91/39/78/993913978.db2.gz FLAAVNUUZWUACW-OAHLLOKOSA-N 2 0 248.370 2.016 20 0 BEADRP CC1(C)CC[C@H]([NH+]2CCC(C)([NH3+])CC2)C1 ZINC000393768429 994001711 /nfs/dbraw/zinc/00/17/11/994001711.db2.gz IFJQTQZGHDBUCD-NSHDSACASA-N 2 0 210.365 2.378 20 0 BEADRP CCCCC[C@H](C)[N@@H+]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000393792372 994007078 /nfs/dbraw/zinc/00/70/78/994007078.db2.gz MQOOBFZIGQGXCY-BFHYXJOUSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CC2(C)CCCC2)CC[NH2+]1 ZINC000821987771 994415186 /nfs/dbraw/zinc/41/51/86/994415186.db2.gz GOPKLBLPXNWZQL-NEPJUHHUSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CC2(C)CCCC2)CC[NH2+]1 ZINC000821987772 994416337 /nfs/dbraw/zinc/41/63/37/994416337.db2.gz GOPKLBLPXNWZQL-NWDGAFQWSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCC2CCCC2)CC[NH2+]1 ZINC000821987590 994417352 /nfs/dbraw/zinc/41/73/52/994417352.db2.gz FKPLGBWADRRZNP-DGCLKSJQSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]1CC[NH2+]C[C@H]1C[NH2+]C1CCC(F)(F)CC1 ZINC000822168048 994420783 /nfs/dbraw/zinc/42/07/83/994420783.db2.gz JILYMGXKQOJEBG-QWRGUYRKSA-N 2 0 246.345 2.400 20 0 BEADRP C[C@@H](CCNc1cc[nH+]cc1)[NH+]1CCCCC1 ZINC001336909294 995121329 /nfs/dbraw/zinc/12/13/29/995121329.db2.gz LQYWDPNBPWHIKW-ZDUSSCGKSA-N 2 0 233.359 2.180 20 0 BEADRP Cc1ccc(C[N@H+](C)CCCC[NH3+])cc1 ZINC000020264292 1170150908 /nfs/dbraw/zinc/15/09/08/1170150908.db2.gz RDRJTMMJPKAXSR-UHFFFAOYSA-N 2 0 206.333 2.166 20 0 BEADRP CC1(C[NH2+]C[C@@H]2C[NH+]3CCC2CC3)CCC1 ZINC001621551228 1170845792 /nfs/dbraw/zinc/84/57/92/1170845792.db2.gz AQNBIBDJOJRSRT-CYBMUJFWSA-N 2 0 222.376 2.108 20 0 BEADRP CC[NH+](CC)C[C@H](O)C[NH2+]C1CCCCCC1 ZINC000037856022 1170984559 /nfs/dbraw/zinc/98/45/59/1170984559.db2.gz NOIOQIMUBSZRAN-CQSZACIVSA-N 2 0 242.407 2.002 20 0 BEADRP C[NH+](C)CCCC[NH2+]C1Cc2ccccc2C1 ZINC000045663890 1171452990 /nfs/dbraw/zinc/45/29/90/1171452990.db2.gz QTNCNNSICCNMLF-UHFFFAOYSA-N 2 0 232.371 2.085 20 0 BEADRP C[C@@H](Cc1ccco1)[NH2+]CCC[NH+]1CCCC1 ZINC000049332596 1171688628 /nfs/dbraw/zinc/68/86/28/1171688628.db2.gz WAKUHRZADGYJDP-ZDUSSCGKSA-N 2 0 236.359 2.286 20 0 BEADRP C[NH2+]CC[C@H](C)[N@H+](C)Cc1cccc(C)c1 ZINC000052345988 1171958305 /nfs/dbraw/zinc/95/83/05/1171958305.db2.gz WWXUNQNACWDOLK-ZDUSSCGKSA-N 2 0 220.360 2.425 20 0 BEADRP C[NH2+]CC[C@H](C)[N@H+](C)Cc1ccccc1C ZINC000052547073 1171974410 /nfs/dbraw/zinc/97/44/10/1171974410.db2.gz CNUCZSHOSBDCPZ-ZDUSSCGKSA-N 2 0 220.360 2.425 20 0 BEADRP C(C1CC[NH2+]CC1)[N@@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC000227167954 398137164 /nfs/dbraw/zinc/13/71/64/398137164.db2.gz IRPUNYSVHOHOHY-KBPBESRZSA-N 2 0 222.376 2.251 20 0 BEADRP CCC(CC)(CC)C[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC000310005451 168313904 /nfs/dbraw/zinc/31/39/04/168313904.db2.gz GMAXEARLWARWMJ-BETUJISGSA-N 2 0 224.392 2.354 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCC[C@@H]([NH3+])C1)C1CCC1 ZINC000324956794 262798727 /nfs/dbraw/zinc/79/87/27/262798727.db2.gz VWAMDECPCFTVCQ-UPJWGTAASA-N 2 0 210.365 2.425 20 0 BEADRP C[C@]1(C[NH2+]C(C2CC2)C2CC2)CCC[NH2+]C1 ZINC000062862635 349493591 /nfs/dbraw/zinc/49/35/91/349493591.db2.gz KAFKHUJZGKPLKD-AWEZNQCLSA-N 2 0 222.376 2.154 20 0 BEADRP CC(C)=CC[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000188459875 346814131 /nfs/dbraw/zinc/81/41/31/346814131.db2.gz BMNPVFRRXYHEKX-UHFFFAOYSA-N 2 0 222.376 2.417 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@H](C)[C@@H]2C[C@H]2C)CC1 ZINC000321645043 398144446 /nfs/dbraw/zinc/14/44/46/398144446.db2.gz VCADHACBDOTYQR-YRGRVCCFSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@H]([NH2+]C1CC(C)C1)C1CC[NH+](C)CC1 ZINC000161805134 538919051 /nfs/dbraw/zinc/91/90/51/538919051.db2.gz WSXDALSNQWFQIO-AKJDGMEZSA-N 2 0 210.365 2.105 20 0 BEADRP CC[NH+](CC)CCCN1CC[C@@]2(CC2(F)F)C1 ZINC000649908586 398184029 /nfs/dbraw/zinc/18/40/29/398184029.db2.gz RWAYXHZWYKAOQF-GFCCVEGCSA-N 2 0 246.345 2.449 20 0 BEADRP C[N@@H+]1CCC[C@@H]1CC[NH+]1CC[C@@]2(CC2(F)F)C1 ZINC000649907378 398180488 /nfs/dbraw/zinc/18/04/88/398180488.db2.gz PZEXGHWIESUXNB-VXGBXAGGSA-N 2 0 244.329 2.202 20 0 BEADRP C[N@@H+]1CCC[C@H]1CC[NH+]1CC[C@]2(CC2(F)F)C1 ZINC000649907377 398180611 /nfs/dbraw/zinc/18/06/11/398180611.db2.gz PZEXGHWIESUXNB-RYUDHWBXSA-N 2 0 244.329 2.202 20 0 BEADRP CCN(CC[NH3+])Cc1ccc(C2CC2)cc1 ZINC000300761012 398160558 /nfs/dbraw/zinc/16/05/58/398160558.db2.gz AQNQZXYTVFLFRI-UHFFFAOYSA-N 2 0 218.344 2.345 20 0 BEADRP COCCC[NH2+][C@@H]1CCN[C@H](c2ccccc2)C1 ZINC000415097780 398161746 /nfs/dbraw/zinc/16/17/46/398161746.db2.gz DLOKLWPKJAGIJT-CABCVRRESA-N 2 0 248.370 2.106 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@H]1CCO[C@H](C(C)(C)C)C1 ZINC000423020523 398162270 /nfs/dbraw/zinc/16/22/70/398162270.db2.gz BUGJMQATQBEHBK-CYDGBPFRSA-N 2 0 242.407 2.296 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H]1CC1(C)C ZINC000423021290 398162698 /nfs/dbraw/zinc/16/26/98/398162698.db2.gz BPAJCQQKFLNXGJ-MFKMUULPSA-N 2 0 233.359 2.298 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H]1CCO[C@H](C(C)(C)C)C1 ZINC000423023745 398163067 /nfs/dbraw/zinc/16/30/67/398163067.db2.gz KLUXWNUFJJHPBP-UPJWGTAASA-N 2 0 242.407 2.297 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@H]1C(C)(C)C)C1C[NH2+]C1 ZINC000423174441 398164475 /nfs/dbraw/zinc/16/44/75/398164475.db2.gz CDKRGHHHZZIYQW-UHTWSYAYSA-N 2 0 224.392 2.399 20 0 BEADRP Cc1cc(F)ccc1CC[NH2+][C@H](C)CCC[NH3+] ZINC000310518548 178083775 /nfs/dbraw/zinc/08/37/75/178083775.db2.gz LLVJGIYAKABSLH-GFCCVEGCSA-N 2 0 238.350 2.394 20 0 BEADRP Cc1cc(F)ccc1CC[NH2+]C1CC[NH2+]CC1 ZINC000094950569 178084078 /nfs/dbraw/zinc/08/40/78/178084078.db2.gz DESDUOUBVHPDOP-UHFFFAOYSA-N 2 0 236.334 2.018 20 0 BEADRP Cc1cc(F)ccc1C[N@H+]1CC[C@@H]([C@H](C)[NH3+])C1 ZINC000228152893 178086211 /nfs/dbraw/zinc/08/62/11/178086211.db2.gz PIQNNGBSKFCRMP-WCQYABFASA-N 2 0 236.334 2.303 20 0 BEADRP CCC[C@H](C[NH2+]C[C@H](C)C[NH+]1CCCC1)OC ZINC000386162612 398198542 /nfs/dbraw/zinc/19/85/42/398198542.db2.gz VDNCLZARAJGCFH-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP Cc1cc(N2CCC[C@H]([NH+](C)C)CC2)cc[nH+]1 ZINC000277205696 178116839 /nfs/dbraw/zinc/11/68/39/178116839.db2.gz QBUBYCHOQHFSGR-ZDUSSCGKSA-N 2 0 233.359 2.311 20 0 BEADRP C[C@H](Cc1cccs1)[NH2+][C@@H]1CC[NH2+]C[C@@H]1C ZINC000380746468 398207062 /nfs/dbraw/zinc/20/70/62/398207062.db2.gz SUURLBFAFWATPP-DMDPSCGWSA-N 2 0 238.400 2.267 20 0 BEADRP C[N@@H+]1CCC[C@@H](CC[NH2+][C@H]2CCC[C@H]3C[C@H]32)C1 ZINC000576362791 365578639 /nfs/dbraw/zinc/57/86/39/365578639.db2.gz UOSBEYXVALMPSV-XQLPTFJDSA-N 2 0 236.403 2.497 20 0 BEADRP Cc1cc(NC2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc[nH+]1 ZINC000296003239 178155363 /nfs/dbraw/zinc/15/53/63/178155363.db2.gz MXDIBIKPRFDHFH-AGUYFDCRSA-N 2 0 231.343 2.427 20 0 BEADRP [NH3+]CC[C@@H]1CCCC[N@@H+]1Cc1cccc(O)c1 ZINC000070148781 398220877 /nfs/dbraw/zinc/22/08/77/398220877.db2.gz BSLJZKCXTKPBDJ-ZDUSSCGKSA-N 2 0 234.343 2.096 20 0 BEADRP Cc1cc(N[C@H]2CC[NH2+]C2)c2ccccc2[nH+]1 ZINC000052093673 178190776 /nfs/dbraw/zinc/19/07/76/178190776.db2.gz OVAAEUDUWKFROZ-NSHDSACASA-N 2 0 227.311 2.317 20 0 BEADRP Cc1cc(N[C@H]2C[C@H](C)[N@@H+](C3CC3)C2)nc(C)n1 ZINC000275772858 178192555 /nfs/dbraw/zinc/19/25/55/178192555.db2.gz HEZKWKBBHHEDKD-JQWIXIFHSA-N 2 0 246.358 2.131 20 0 BEADRP CCC(CC)C[N@@H+]1CC[C@H]2[NH2+]CC[C@@H]2C1 ZINC000336713137 168351684 /nfs/dbraw/zinc/35/16/84/168351684.db2.gz VJPYILLMAYXVGC-CHWSQXEVSA-N 2 0 210.365 2.106 20 0 BEADRP CCC(CC)C[N@@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC000368314093 168352170 /nfs/dbraw/zinc/35/21/70/168352170.db2.gz FITYYNMNENDOTQ-AWEZNQCLSA-N 2 0 224.392 2.450 20 0 BEADRP CCC(CC)C[N@@H+]1CC[C@]2(CC[NH2+]C2)C1 ZINC000031994495 168352345 /nfs/dbraw/zinc/35/23/45/168352345.db2.gz AIZFRWJHBNHFQQ-ZDUSSCGKSA-N 2 0 210.365 2.108 20 0 BEADRP CCC(CC)C[N@@H+]1C[C@@H]2CC[C@H]([NH3+])[C@H]2C1 ZINC000336673799 168352561 /nfs/dbraw/zinc/35/25/61/168352561.db2.gz GUGATNDWGMWRTQ-AVGNSLFASA-N 2 0 210.365 2.092 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C2CCC([NH+](C)C)CC2)[C@H](C)O1 ZINC000421365031 192333316 /nfs/dbraw/zinc/33/33/16/192333316.db2.gz AQQDNBHTNPMVNF-XPXVYLNCSA-N 2 0 240.391 2.015 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C2CCC([NH+](C)C)CC2)[C@H]1C ZINC000421364957 192333928 /nfs/dbraw/zinc/33/39/28/192333928.db2.gz ABWQOWBCFJNZIK-XPXVYLNCSA-N 2 0 224.392 2.493 20 0 BEADRP Cc1ccc(C[NH2+]C2CCC([NH+](C)C)CC2)nc1 ZINC000421369546 192334423 /nfs/dbraw/zinc/33/44/23/192334423.db2.gz HZPCTROBGGKYOP-UHFFFAOYSA-N 2 0 247.386 2.352 20 0 BEADRP C[C@H]([NH2+]C1CCC([NH+](C)C)CC1)[C@H]1C[C@H]1C ZINC000421371312 192335392 /nfs/dbraw/zinc/33/53/92/192335392.db2.gz JNJKBVYFKYMULF-CJQNXBEJSA-N 2 0 224.392 2.493 20 0 BEADRP Cc1cccc(CC[NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)n1 ZINC000280191506 538936585 /nfs/dbraw/zinc/93/65/85/538936585.db2.gz SGBNTLVGKBTOLG-DZGCQCFKSA-N 2 0 247.386 2.005 20 0 BEADRP CCOc1cccc(C[N@@H+]2CC[C@@H]([C@H](C)[NH3+])C2)c1 ZINC000252793812 136226709 /nfs/dbraw/zinc/22/67/09/136226709.db2.gz XULNXZAYXDGLLO-GXTWGEPZSA-N 2 0 248.370 2.254 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]C[C@H]2CCCOC2)c2ccccc21 ZINC000252794508 136226753 /nfs/dbraw/zinc/22/67/53/136226753.db2.gz YXMMVVYDQGMHBT-DFBGVHRSSA-N 2 0 246.354 2.147 20 0 BEADRP Cc1cc([C@H](C)N[C@H]2CC[N@H+](C)[C@@H](C)C2)no1 ZINC000337552939 178258750 /nfs/dbraw/zinc/25/87/50/178258750.db2.gz PNPHGQJGMMXWJP-DLOVCJGASA-N 2 0 237.347 2.116 20 0 BEADRP C[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1)c1ccccn1 ZINC000576637605 365646559 /nfs/dbraw/zinc/64/65/59/365646559.db2.gz SLJKYTPYGYKXCB-GFCCVEGCSA-N 2 0 241.338 2.391 20 0 BEADRP C([C@@H]1CC[NH2+]C1)[N@@H+]1CCCC[C@H]1C1CCC1 ZINC000647997471 398255363 /nfs/dbraw/zinc/25/53/63/398255363.db2.gz GSDREJCESFMAGR-OCCSQVGLSA-N 2 0 222.376 2.251 20 0 BEADRP CCC[C@@H](C[NH2+]CC1CC[NH+](CC)CC1)OC ZINC000386162293 398263556 /nfs/dbraw/zinc/26/35/56/398263556.db2.gz UZTOTWVRWCKVDX-AWEZNQCLSA-N 2 0 242.407 2.123 20 0 BEADRP CC[NH+](CC)CCC[N@@H+]1CCSC[C@H](C)C1 ZINC000191896804 361827149 /nfs/dbraw/zinc/82/71/49/361827149.db2.gz USNAKJMQYPXUJM-CYBMUJFWSA-N 2 0 244.448 2.403 20 0 BEADRP c1cc(C[NH2+][C@H]2CCCSC2)cc2c1C[NH2+]C2 ZINC000335065006 136232573 /nfs/dbraw/zinc/23/25/73/136232573.db2.gz ZQQXNAZFLISIHE-AWEZNQCLSA-N 2 0 248.395 2.275 20 0 BEADRP C[C@@H]([NH2+]CCc1ccco1)C1CC[NH+](C)CC1 ZINC000035661424 538957232 /nfs/dbraw/zinc/95/72/32/538957232.db2.gz FRYDDAYMADZIGH-GFCCVEGCSA-N 2 0 236.359 2.142 20 0 BEADRP C1CC1[C@@H]1CC[C@H]1[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000348109800 136234362 /nfs/dbraw/zinc/23/43/62/136234362.db2.gz ZITBKZLCCIZSGY-APIJFGDWSA-N 2 0 234.387 2.391 20 0 BEADRP CCCCC[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000037208919 538961897 /nfs/dbraw/zinc/96/18/97/538961897.db2.gz QHDGHTJPFUSDBZ-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP CCC(CC)[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000037208734 538962017 /nfs/dbraw/zinc/96/20/17/538962017.db2.gz FZJXJEXQVQLMMR-NSHDSACASA-N 2 0 212.381 2.495 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@@H]1CCC[C@H]1C ZINC000165715356 361844945 /nfs/dbraw/zinc/84/49/45/361844945.db2.gz CERARHALVOMXKN-CHWSQXEVSA-N 2 0 212.381 2.495 20 0 BEADRP C[NH+](C)CCOc1ccc(C[NH+]2CCCC2)cc1 ZINC000613259540 361868807 /nfs/dbraw/zinc/86/88/07/361868807.db2.gz DJEGHARIWGPHDS-UHFFFAOYSA-N 2 0 248.370 2.223 20 0 BEADRP CC[NH+](CC)CCC[N@H+](C)C(C)(C)C ZINC000145606067 342761160 /nfs/dbraw/zinc/76/11/60/342761160.db2.gz MGZLEEGOHHLDJC-UHFFFAOYSA-N 2 0 200.370 2.449 20 0 BEADRP Cc1cc(N)cc(C[NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)c1 ZINC000335365121 398287137 /nfs/dbraw/zinc/28/71/37/398287137.db2.gz YIPJPUXLBHJZCZ-SWLSCSKDSA-N 2 0 247.386 2.150 20 0 BEADRP CC[C@@H](C)C[NH2+]C[C@@H]1CC[N@@H+](C(C)C)C1 ZINC000040622280 538971884 /nfs/dbraw/zinc/97/18/84/538971884.db2.gz DVLASFIIZGGXPS-OLZOCXBDSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CCC[N@H+](C[C@@H]2CCC(F)(F)C2)C1 ZINC000382309829 361895431 /nfs/dbraw/zinc/89/54/31/361895431.db2.gz ICPILYPPTRBBKM-QJPTWQEYSA-N 2 0 246.345 2.481 20 0 BEADRP CCCCOCC[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000040506737 538971155 /nfs/dbraw/zinc/97/11/55/538971155.db2.gz YQIVRHUBPFYWGZ-ZDUSSCGKSA-N 2 0 242.407 2.123 20 0 BEADRP CCCCOCC[NH2+][C@H](C)C1CC[NH+](C)CC1 ZINC000040506738 538971671 /nfs/dbraw/zinc/97/16/71/538971671.db2.gz YQIVRHUBPFYWGZ-CYBMUJFWSA-N 2 0 242.407 2.123 20 0 BEADRP CCC1CC([NH2+]C[C@@H]2CC[N@@H+](C(C)C)C2)C1 ZINC000309715665 342799272 /nfs/dbraw/zinc/79/92/72/342799272.db2.gz SRRNNHGWVIGJRX-MOKVOYLWSA-N 2 0 224.392 2.495 20 0 BEADRP Cc1cc(C[NH2+]C[C@H]2CCC[NH2+]C2)c(C)s1 ZINC000583981907 342817456 /nfs/dbraw/zinc/81/74/56/342817456.db2.gz HJBZCQOMTLFDLF-LBPRGKRZSA-N 2 0 238.400 2.454 20 0 BEADRP Cn1ccnc1-c1ccc(C(F)(F)CN)cc1 ZINC000630052916 361922398 /nfs/dbraw/zinc/92/23/98/361922398.db2.gz NNTSRJKRRWYOEC-UHFFFAOYSA-N 2 0 237.253 2.138 20 0 BEADRP C[C@H]1CC[N@H+](CC[C@@H]2CCC[NH+]2C)CCS1 ZINC000192191317 538993983 /nfs/dbraw/zinc/99/39/83/538993983.db2.gz BMYJMQAULLPXID-STQMWFEESA-N 2 0 242.432 2.298 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+]CCCC1CCCC1 ZINC000225056916 536594841 /nfs/dbraw/zinc/59/48/41/536594841.db2.gz ONYUODYINKCPNC-CQSZACIVSA-N 2 0 242.407 2.300 20 0 BEADRP C[C@H]([NH2+][C@H]1CSC[C@H]1C)C1CC[NH+](C)CC1 ZINC000381433347 539000865 /nfs/dbraw/zinc/00/08/65/539000865.db2.gz CAEHXCWCQNIAME-MDZLAQPJSA-N 2 0 242.432 2.058 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@@H]2CCC(C)(C)O2)CC1 ZINC000387457728 342837618 /nfs/dbraw/zinc/83/76/18/342837618.db2.gz WFQQLTAESVTZIN-ZDUSSCGKSA-N 2 0 240.391 2.018 20 0 BEADRP Cc1csc([C@@H](C)[NH2+]CCCC[NH+](C)C)n1 ZINC000381750589 539006382 /nfs/dbraw/zinc/00/63/82/539006382.db2.gz RBFGSHDBHFWQDH-LLVKDONJSA-N 2 0 241.404 2.444 20 0 BEADRP FC1(F)CC[C@H]([NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)C1 ZINC000383928845 539012095 /nfs/dbraw/zinc/01/20/95/539012095.db2.gz BHCOFLJHKWKGTD-WOPDTQHZSA-N 2 0 244.329 2.391 20 0 BEADRP C[C@@H]1C[C@@H]([NH+]2CCC(C)(C)CC2)CC[NH2+]1 ZINC000197532348 539012151 /nfs/dbraw/zinc/01/21/51/539012151.db2.gz YJADHPWJQNQDBK-NEPJUHHUSA-N 2 0 210.365 2.249 20 0 BEADRP C1SCC1[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000381278932 538997420 /nfs/dbraw/zinc/99/74/20/538997420.db2.gz XQPUGOBZXIZKPO-UHFFFAOYSA-N 2 0 240.416 2.098 20 0 BEADRP C[C@@H](F)CC[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000382154207 398307583 /nfs/dbraw/zinc/30/75/83/398307583.db2.gz QUGAGRAKGPIZEL-MNOVXSKESA-N 2 0 216.344 2.054 20 0 BEADRP C[C@H](F)CC[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000382154209 398307643 /nfs/dbraw/zinc/30/76/43/398307643.db2.gz QUGAGRAKGPIZEL-QWRGUYRKSA-N 2 0 216.344 2.054 20 0 BEADRP CCC[C@@H](C)[NH2+]Cc1ccc(C[NH3+])cc1 ZINC000233277593 342900861 /nfs/dbraw/zinc/90/08/61/342900861.db2.gz VMBCLHMFOLTCQY-LLVKDONJSA-N 2 0 206.333 2.424 20 0 BEADRP CSC[C@H]1CCC[N@@H+]1CC[C@H]1CCC[NH+]1C ZINC000162308343 349635858 /nfs/dbraw/zinc/63/58/58/349635858.db2.gz ARGGKVNYOWZTOQ-CHWSQXEVSA-N 2 0 242.432 2.298 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@H]1C)C1CC1 ZINC000036908633 342913871 /nfs/dbraw/zinc/91/38/71/342913871.db2.gz WUSBWJKUCHKNBM-HNCHTBHHSA-N 2 0 210.365 2.103 20 0 BEADRP CC[NH+]1CCC(CC[NH2+]Cc2cccn2C)CC1 ZINC000174551460 346883793 /nfs/dbraw/zinc/88/37/93/346883793.db2.gz FFPMUVAKICQRCB-UHFFFAOYSA-N 2 0 249.402 2.237 20 0 BEADRP Cc1cc(C)cc(C[N@H+]2C[C@@H](C[NH3+])C[C@H]2C)c1 ZINC000228072591 398340732 /nfs/dbraw/zinc/34/07/32/398340732.db2.gz UFOCGSBCMHGCOX-UKRRQHHQSA-N 2 0 232.371 2.473 20 0 BEADRP Cc1cc(C[N@@H+](C)C2CC([NH3+])C2)ccc1F ZINC000335479132 398341504 /nfs/dbraw/zinc/34/15/04/398341504.db2.gz RQOITPUAUMCYHA-UHFFFAOYSA-N 2 0 222.307 2.056 20 0 BEADRP CC(C)O[C@H]1C[C@@H]([NH2+]CCC[NH+](C)C)C1(C)C ZINC000185186664 534927481 /nfs/dbraw/zinc/92/74/81/534927481.db2.gz BZXUAGGTAATLCA-OLZOCXBDSA-N 2 0 242.407 2.120 20 0 BEADRP CC[C@H](c1ccccc1)[N@@H+]1CCCO[C@H](C[NH3+])C1 ZINC000313350934 259333947 /nfs/dbraw/zinc/33/39/47/259333947.db2.gz LDLYUAKFCZJNSB-HUUCEWRRSA-N 2 0 248.370 2.187 20 0 BEADRP CCc1cc(NCC2=CC[N@H+](C)CC2)cc[nH+]1 ZINC000307781261 529555305 /nfs/dbraw/zinc/55/53/05/529555305.db2.gz ZJEOWCCWVMVMPA-UHFFFAOYSA-N 2 0 231.343 2.318 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000336683718 346910864 /nfs/dbraw/zinc/91/08/64/346910864.db2.gz ZIJBGEABSBEWRO-UPJWGTAASA-N 2 0 222.376 2.391 20 0 BEADRP Cc1ccc(C[N@H+](C)C[C@@H]2CCC[NH2+]C2)cc1 ZINC000020264745 342978906 /nfs/dbraw/zinc/97/89/06/342978906.db2.gz UXZHBPJNWSEFSC-OAHLLOKOSA-N 2 0 232.371 2.426 20 0 BEADRP CC(C)[C@@H](C)[NH2+]C1CCC([NH+](C)C)CC1 ZINC000336763802 167379627 /nfs/dbraw/zinc/37/96/27/167379627.db2.gz PPOKQRIMQQQFBG-PNESKVBLSA-N 2 0 212.381 2.493 20 0 BEADRP Cc1ccc(C[NH2+]C[C@@H]2CCC[N@@H+](C)C2)cc1 ZINC000044535120 343008826 /nfs/dbraw/zinc/00/88/26/343008826.db2.gz PGJMMWNAQDBFPD-HNNXBMFYSA-N 2 0 232.371 2.426 20 0 BEADRP C[N@H+](CCC1CC1)CC[C@@H]1CCC[NH+]1C ZINC000162615879 349769420 /nfs/dbraw/zinc/76/94/20/349769420.db2.gz BOEXXRDDZKDPBR-ZDUSSCGKSA-N 2 0 210.365 2.203 20 0 BEADRP C[C@H](CC(F)(F)F)[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000235468637 343038938 /nfs/dbraw/zinc/03/89/38/343038938.db2.gz HHWRWHNIUYVHAH-HLTSFMKQSA-N 2 0 224.270 2.187 20 0 BEADRP CC(C)[C@H](C)C[NH2+][C@@H](C)[C@@H]1CCCC[NH2+]1 ZINC000386597517 343079447 /nfs/dbraw/zinc/07/94/47/343079447.db2.gz TWAVFVOTNYPPMK-AGIUHOORSA-N 2 0 212.381 2.399 20 0 BEADRP C(CC1CCCC1)[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000168730138 136269858 /nfs/dbraw/zinc/26/98/58/136269858.db2.gz SZYQSOXBDMDXHU-CYBMUJFWSA-N 2 0 210.365 2.298 20 0 BEADRP Cc1cccc(OCC[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)c1 ZINC000093215588 343151328 /nfs/dbraw/zinc/15/13/28/343151328.db2.gz FPEWPCMBEIEHRL-ZIAGYGMSSA-N 2 0 248.370 2.233 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]CCCc2ccccc2)C1 ZINC000093210093 343151334 /nfs/dbraw/zinc/15/13/34/343151334.db2.gz MJSZYFRIPVKXIC-GJZGRUSLSA-N 2 0 232.371 2.479 20 0 BEADRP c1ccc2c(c1)CC[C@@H]([NH2+]CC1CC[NH2+]CC1)C2 ZINC000094010421 343151538 /nfs/dbraw/zinc/15/15/38/343151538.db2.gz DPYYTDCQUQCCLO-MRXNPFEDSA-N 2 0 244.382 2.133 20 0 BEADRP CN(CCC[NH3+])Cc1coc(-c2ccccc2)n1 ZINC000123350814 343162163 /nfs/dbraw/zinc/16/21/63/343162163.db2.gz XVQVCQZAVAGTES-UHFFFAOYSA-N 2 0 245.326 2.122 20 0 BEADRP Fc1ccc2c(c1)[C@H]([NH2+]CC1CC[NH2+]CC1)CC2 ZINC000576976076 365738372 /nfs/dbraw/zinc/73/83/72/365738372.db2.gz GVCMXAYFFODQOG-OAHLLOKOSA-N 2 0 248.345 2.402 20 0 BEADRP C[C@H]1CCC[N@H+](CC2CC[NH2+]CC2)CC1 ZINC000082489425 136276568 /nfs/dbraw/zinc/27/65/68/136276568.db2.gz ZQSDYNJLFGOBEO-LBPRGKRZSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@H]1CCC[N@H+](CC[C@@H]2CCC[NH2+]C2)CC1 ZINC000082489434 136276731 /nfs/dbraw/zinc/27/67/31/136276731.db2.gz MGMANOWYINNTSM-KBPBESRZSA-N 2 0 224.392 2.498 20 0 BEADRP CCC[NH+]1CCC([NH2+]C[C@H]2CCCS2)CC1 ZINC000087668019 136282131 /nfs/dbraw/zinc/28/21/31/136282131.db2.gz QRGHPCIXOONFSA-CYBMUJFWSA-N 2 0 242.432 2.346 20 0 BEADRP [NH3+]C1CC[NH+](Cc2cccc3ncccc23)CC1 ZINC000634687408 343239687 /nfs/dbraw/zinc/23/96/87/343239687.db2.gz KFEGZNBQISLMDM-UHFFFAOYSA-N 2 0 241.338 2.158 20 0 BEADRP CCC(CC)C[N@@H+]1CCC[C@H]([C@@H](C)[NH3+])C1 ZINC000069724633 343290041 /nfs/dbraw/zinc/29/00/41/343290041.db2.gz VUYFQPMJLFLXLU-YPMHNXCESA-N 2 0 212.381 2.482 20 0 BEADRP C[N@H+](CCc1ccccc1)C[C@@]1(C)CC[NH2+]C1 ZINC000088242802 136285714 /nfs/dbraw/zinc/28/57/14/136285714.db2.gz QKADHFKWNIFCPS-HNNXBMFYSA-N 2 0 232.371 2.161 20 0 BEADRP C[NH+](C)Cc1cccc(NC2CC[NH+](C)CC2)c1 ZINC000036979588 343329344 /nfs/dbraw/zinc/32/93/44/343329344.db2.gz KHOFIYPDLNKUHS-UHFFFAOYSA-N 2 0 247.386 2.254 20 0 BEADRP Cc1c[nH+]ccc1NCC(C)(C)[NH+](C)C ZINC000070047280 343297355 /nfs/dbraw/zinc/29/73/55/343297355.db2.gz TUMBJXDISOEDEU-UHFFFAOYSA-N 2 0 207.321 2.142 20 0 BEADRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]CCCc1cccs1 ZINC000569801919 323041121 /nfs/dbraw/zinc/04/11/21/323041121.db2.gz RXQZBSBBKMFFBB-YPMHNXCESA-N 2 0 238.400 2.398 20 0 BEADRP C[C@H]1C[C@H]([NH3+])CC[N@@H+]1CCCOc1ccccc1 ZINC000052092376 343300539 /nfs/dbraw/zinc/30/05/39/343300539.db2.gz PNKMOBPFELNHOS-UONOGXRCSA-N 2 0 248.370 2.267 20 0 BEADRP CC[C@H]1CCCC[C@@H]1[NH2+]CCC[NH+](C)C ZINC000070558353 343334516 /nfs/dbraw/zinc/33/45/16/343334516.db2.gz FJPCOORIBUSJRQ-STQMWFEESA-N 2 0 212.381 2.497 20 0 BEADRP C[C@H]1CC[C@H]([NH2+]CCC[NH+]2CCCC2)C1 ZINC000070642866 343337258 /nfs/dbraw/zinc/33/72/58/343337258.db2.gz CWRAWKUEJBAWOA-STQMWFEESA-N 2 0 210.365 2.251 20 0 BEADRP C1[C@H](C2CCCCC2)[C@H]1[NH2+]C1CC[NH2+]CC1 ZINC000335650719 136305110 /nfs/dbraw/zinc/30/51/10/136305110.db2.gz XUQFUYGXJHWPBD-KGLIPLIRSA-N 2 0 222.376 2.297 20 0 BEADRP c1ccc2c(c1)CC[C@H]2C[NH2+][C@H]1CCC[NH2+]CC1 ZINC000335650855 136305173 /nfs/dbraw/zinc/30/51/73/136305173.db2.gz QSELBDNLLMWYPW-GJZGRUSLSA-N 2 0 244.382 2.448 20 0 BEADRP C[N@@H+]1CCC[C@@H]2C[NH+](CC3(C)CC3)CC[C@H]21 ZINC000569904070 323043983 /nfs/dbraw/zinc/04/39/83/323043983.db2.gz CVXSMHBKIYJEFW-CHWSQXEVSA-N 2 0 222.376 2.203 20 0 BEADRP CC(C)C1CCC([NH2+][C@H]2CC[NH2+]C2)CC1 ZINC000335640870 136308671 /nfs/dbraw/zinc/30/86/71/136308671.db2.gz CBXWCULTTQPWIM-BPCQOVAHSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]([NH3+])[C@H]1CC[N@H+](CC2CCCCC2)C1 ZINC000166225095 136313592 /nfs/dbraw/zinc/31/35/92/136313592.db2.gz CYYCZCKLPMETPY-YPMHNXCESA-N 2 0 210.365 2.236 20 0 BEADRP CC(C)(C)[C@H]1CC[N@H+](C[C@@H]2CCC[NH2+]C2)C1 ZINC000166228577 136314736 /nfs/dbraw/zinc/31/47/36/136314736.db2.gz WCENZTRHPDZKQW-OLZOCXBDSA-N 2 0 224.392 2.354 20 0 BEADRP CC(C)[C@H]1CC[N@H+](CCC2CC[NH2+]CC2)C1 ZINC000166266908 136325350 /nfs/dbraw/zinc/32/53/50/136325350.db2.gz PCHOBAPSDPBUGF-AWEZNQCLSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H]1CCC[N@@H+]1CC[C@H]1CCCC[NH+]1C ZINC000335698427 136327641 /nfs/dbraw/zinc/32/76/41/136327641.db2.gz NYVUYONZBKVEBD-CHWSQXEVSA-N 2 0 210.365 2.345 20 0 BEADRP C[C@@H]1C[C@H]1C[N@@H+]1CC[C@@H](C2CC[NH+](C)CC2)C1 ZINC000349157523 136327810 /nfs/dbraw/zinc/32/78/10/136327810.db2.gz YTPCJFVNDMXXMU-YUELXQCFSA-N 2 0 236.403 2.306 20 0 BEADRP CCC[N@H+](CCC[NH+](C)C)CCSCC ZINC000349387086 136344358 /nfs/dbraw/zinc/34/43/58/136344358.db2.gz URCQHTYKVHWTDP-UHFFFAOYSA-N 2 0 232.437 2.403 20 0 BEADRP CCC[N@H+](CCC[NH+](C)C)C[C@@H]1C[C@H]1C ZINC000349344217 136342698 /nfs/dbraw/zinc/34/26/98/136342698.db2.gz HMEYGUMVPNKDNJ-OLZOCXBDSA-N 2 0 212.381 2.306 20 0 BEADRP C[N@@H+](Cc1cccc(N)c1)C[C@H]1CCC[NH+](C)C1 ZINC000258969674 136374010 /nfs/dbraw/zinc/37/40/10/136374010.db2.gz KDEMPMNPVIWMBS-AWEZNQCLSA-N 2 0 247.386 2.042 20 0 BEADRP C[N@@H+](Cc1cccc(N)c1)C[C@@H]1CCC[NH+](C)C1 ZINC000258969678 136374163 /nfs/dbraw/zinc/37/41/63/136374163.db2.gz KDEMPMNPVIWMBS-CQSZACIVSA-N 2 0 247.386 2.042 20 0 BEADRP C[C@H]([NH3+])C1CC[NH+](CC2CCCC2)CC1 ZINC000082474716 343444439 /nfs/dbraw/zinc/44/44/39/343444439.db2.gz WKIZCNUVXBMWTQ-NSHDSACASA-N 2 0 210.365 2.236 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](CCC3CCC3)C[C@@H]21 ZINC000398648923 488221636 /nfs/dbraw/zinc/22/16/36/488221636.db2.gz KOQRZXPAAWOLSL-HZSPNIEDSA-N 2 0 222.376 2.236 20 0 BEADRP CC(C)CC[C@H](C)[NH2+]CC[NH2+]C(C)C ZINC000053388246 1172029031 /nfs/dbraw/zinc/02/90/31/1172029031.db2.gz AJGZMVNAQFXPDE-LBPRGKRZSA-N 2 0 200.370 2.399 20 0 BEADRP CC1CCC([N@H+](CCC[NH3+])C2CC2)CC1 ZINC000082848506 343468512 /nfs/dbraw/zinc/46/85/12/343468512.db2.gz HJFVIHWQSGCOIV-UHFFFAOYSA-N 2 0 210.365 2.378 20 0 BEADRP C[C@H]1CC[N@H+](CCC2CCC2)C[C@H]1C[NH3+] ZINC000398701230 488222656 /nfs/dbraw/zinc/22/26/56/488222656.db2.gz KBUWTBZEIMGUGB-WCQYABFASA-N 2 0 210.365 2.093 20 0 BEADRP C[C@H](Cc1ccsc1)[NH2+][C@@H](C)CCC[NH3+] ZINC000379976750 365771744 /nfs/dbraw/zinc/77/17/44/365771744.db2.gz QVUALFNMFKZJMP-WDEREUQCSA-N 2 0 226.389 2.396 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+][C@H]1CCC(C)(C)C1 ZINC000087771429 343660140 /nfs/dbraw/zinc/66/01/40/343660140.db2.gz PWJZYLDLOFPJRK-RYUDHWBXSA-N 2 0 212.381 2.495 20 0 BEADRP C(C[NH2+][C@H]1CC[C@H]1C1CC1)C[NH+]1CCCC1 ZINC000336650615 537820917 /nfs/dbraw/zinc/82/09/17/537820917.db2.gz DTUXKSVRIRVOSE-KBPBESRZSA-N 2 0 222.376 2.251 20 0 BEADRP CC1(C[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)CCC1 ZINC000336667025 537817759 /nfs/dbraw/zinc/81/77/59/537817759.db2.gz LYYHWELNXZLKNA-GFCCVEGCSA-N 2 0 222.376 2.251 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@]3(CC[NH2+]C3)C2)cc1 ZINC000031994553 343886907 /nfs/dbraw/zinc/88/69/07/343886907.db2.gz ZDTXWPZXPPEOOO-HNNXBMFYSA-N 2 0 230.355 2.180 20 0 BEADRP Cc1ncccc1C[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000396461951 347017931 /nfs/dbraw/zinc/01/79/31/347017931.db2.gz NDWXYURUOZFJIC-LBPRGKRZSA-N 2 0 247.386 2.210 20 0 BEADRP C/C=C\C[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000384716500 343960464 /nfs/dbraw/zinc/96/04/64/343960464.db2.gz FZCKUJYJOPUAFF-IHWYPQMZSA-N 2 0 231.343 2.216 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]([NH2+][C@H]2CCCSC2)C1 ZINC000634732597 344106261 /nfs/dbraw/zinc/10/62/61/344106261.db2.gz KANCFADFESWRDK-RYUDHWBXSA-N 2 0 242.432 2.250 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]([NH2+]Cc2cccc(O)c2)C1 ZINC000634732429 344106967 /nfs/dbraw/zinc/10/69/67/344106967.db2.gz GMZMOQISLMKPLV-CYBMUJFWSA-N 2 0 248.370 2.260 20 0 BEADRP C[C@@H]1C[C@H]1C[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000634733439 344113227 /nfs/dbraw/zinc/11/32/27/344113227.db2.gz FYIFOVKNAVEJGV-GRYCIOLGSA-N 2 0 210.365 2.010 20 0 BEADRP C(C1CCCCC1)N1CCC[C@H]2C[NH2+]C[C@H]21 ZINC000299892744 344117448 /nfs/dbraw/zinc/11/74/48/344117448.db2.gz CSVQZMLZHYAMNA-UONOGXRCSA-N 2 0 222.376 2.251 20 0 BEADRP CC1(C)CC[C@@H]([NH2+]CCC[NH2+]C2CC2)C1 ZINC000129588030 344213463 /nfs/dbraw/zinc/21/34/63/344213463.db2.gz YYJNXHKXAQIQGS-GFCCVEGCSA-N 2 0 210.365 2.297 20 0 BEADRP CCN(CC)C[C@@H](C)[NH2+]C1CC(C)(C)C1 ZINC000336749322 537841954 /nfs/dbraw/zinc/84/19/54/537841954.db2.gz DEUHAWJSSUOJAN-LLVKDONJSA-N 2 0 212.381 2.495 20 0 BEADRP CC(C)N(C)CC[NH2+][C@H]1CC[C@H]1C1CC1 ZINC000336748715 537842189 /nfs/dbraw/zinc/84/21/89/537842189.db2.gz DOJZZCHRIYYPAE-STQMWFEESA-N 2 0 210.365 2.105 20 0 BEADRP CC1CCC([NH2+]CCc2cncn2C)CC1 ZINC000381206335 344192977 /nfs/dbraw/zinc/19/29/77/344192977.db2.gz GHNNOAVCLFSLMN-UHFFFAOYSA-N 2 0 221.348 2.131 20 0 BEADRP C[C@H]([NH2+]CCC[NH+]1CCCC1)C1CCC1 ZINC000132249215 344289580 /nfs/dbraw/zinc/28/95/80/344289580.db2.gz UTWNVPIGQMOWBB-LBPRGKRZSA-N 2 0 210.365 2.251 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]CCc2ccccc2F)C1 ZINC000093209725 344312071 /nfs/dbraw/zinc/31/20/71/344312071.db2.gz GKTZXNQQPJAUQJ-STQMWFEESA-N 2 0 236.334 2.228 20 0 BEADRP C[C@H]1C[C@H]([NH3+])CN1Cc1cnc2ccccc2c1 ZINC000385066254 344314152 /nfs/dbraw/zinc/31/41/52/344314152.db2.gz GQYYELGVECCJTM-FZMZJTMJSA-N 2 0 241.338 2.156 20 0 BEADRP CC[C@@H]([NH2+]CC1CC[NH+](CC)CC1)C1CC1 ZINC000083056084 362386727 /nfs/dbraw/zinc/38/67/27/362386727.db2.gz LUNAOFJIXKTKLH-CQSZACIVSA-N 2 0 224.392 2.497 20 0 BEADRP c1cc2nccc(N[C@@H]3CCC[NH2+]CC3)c2s1 ZINC000634813620 344399229 /nfs/dbraw/zinc/39/92/29/344399229.db2.gz ROUZZQZBKGMHFK-SNVBAGLBSA-N 2 0 247.367 2.272 20 0 BEADRP CCCCC[N@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000152385217 344532947 /nfs/dbraw/zinc/53/29/47/344532947.db2.gz AVIJWZXFOHUYMN-ZDUSSCGKSA-N 2 0 212.381 2.450 20 0 BEADRP CC(C)(C)[NH+]1CCC([NH2+]C2CCC2)CC1 ZINC000044481819 344541801 /nfs/dbraw/zinc/54/18/01/344541801.db2.gz JIFNUZNJRIBPLW-UHFFFAOYSA-N 2 0 210.365 2.391 20 0 BEADRP CC[N@@H+]1CCC[C@@H](C[NH2+]CC2(C)CCC2)C1 ZINC000336771596 537849123 /nfs/dbraw/zinc/84/91/23/537849123.db2.gz USIYZGYEJVTXJZ-ZDUSSCGKSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+][C@@H]1CCC[C@@H](C)C1 ZINC000049551643 344652948 /nfs/dbraw/zinc/65/29/48/344652948.db2.gz AMEBKHAIFFGZSP-FRRDWIJNSA-N 2 0 212.381 2.495 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000569616294 344683794 /nfs/dbraw/zinc/68/37/94/344683794.db2.gz QRIDRUZBTQCGNC-SNPRPXQTSA-N 2 0 236.403 2.495 20 0 BEADRP CC(C)CC[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C)C1 ZINC000158612294 344695960 /nfs/dbraw/zinc/69/59/60/344695960.db2.gz AYPGVLVFQCYHSV-KGLIPLIRSA-N 2 0 224.392 2.449 20 0 BEADRP CCC[NH+]1CCC(OCC[NH+](CC)CC)CC1 ZINC000075007792 344767141 /nfs/dbraw/zinc/76/71/41/344767141.db2.gz DOQUCTSFFOAPNA-UHFFFAOYSA-N 2 0 242.407 2.219 20 0 BEADRP CCOCCC[N@H+](C)CC[C@H]1CCCC[NH+]1C ZINC000075860661 344785873 /nfs/dbraw/zinc/78/58/73/344785873.db2.gz CKYGOAWUPHQVEA-CQSZACIVSA-N 2 0 242.407 2.219 20 0 BEADRP CC[C@@H]([NH2+]CCCC1CC1)[C@@H]1CCC[NH2+]1 ZINC000578757438 344912055 /nfs/dbraw/zinc/91/20/55/344912055.db2.gz AEYDFOUGECSZFF-OLZOCXBDSA-N 2 0 210.365 2.297 20 0 BEADRP CO[C@@H]1CCC[C@H]([NH2+]CCC[N@H+](C)C(C)C)C1 ZINC000234767361 537871810 /nfs/dbraw/zinc/87/18/10/537871810.db2.gz YZCYVKTWFCDCSX-UONOGXRCSA-N 2 0 242.407 2.264 20 0 BEADRP CC[N@H+](C)C[C@@H]1CCN(Cc2ccc(C)nc2)C1 ZINC000153978902 345004093 /nfs/dbraw/zinc/00/40/93/345004093.db2.gz OMBAKVXEJOHXBD-HNNXBMFYSA-N 2 0 247.386 2.164 20 0 BEADRP C1CC([NH2+][C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)C1 ZINC000250652507 192369835 /nfs/dbraw/zinc/36/98/35/192369835.db2.gz MRUGVJXLUDOKBZ-JHJVBQTASA-N 2 0 208.349 2.049 20 0 BEADRP C(C1CC1)[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000156480076 345167312 /nfs/dbraw/zinc/16/73/12/345167312.db2.gz DTQSDWXJHTXFLV-AWEZNQCLSA-N 2 0 222.376 2.347 20 0 BEADRP CC(C)[C@H](C[NH3+])C[NH2+]Cc1ccc([C@@H](C)[NH3+])cc1 ZINC000634994404 345181593 /nfs/dbraw/zinc/18/15/93/345181593.db2.gz BOPUEJDOSFZMHT-IUODEOHRSA-N 3 0 249.402 2.027 20 0 BEADRP C[NH2+]Cc1ccc(NC[C@@H](C[NH3+])C(C)C)cc1 ZINC000634996103 345186925 /nfs/dbraw/zinc/18/69/25/345186925.db2.gz ZJKHYWKQDGQKLN-CYBMUJFWSA-N 2 0 235.375 2.049 20 0 BEADRP C[C@H]1CCCC[C@]1(C)[NH2+]CC12CC(C1)C[NH2+]2 ZINC000634996572 345189012 /nfs/dbraw/zinc/18/90/12/345189012.db2.gz OERJCNYONGASKY-AHPWVWPOSA-N 2 0 222.376 2.297 20 0 BEADRP CC(C)[C@H]1CCCN(CC23CC(C2)C[NH2+]3)C1 ZINC000634994151 345192663 /nfs/dbraw/zinc/19/26/63/345192663.db2.gz SKWSEPVVSSJRSN-MOKVOYLWSA-N 2 0 222.376 2.106 20 0 BEADRP C[C@@H]1C[C@@H](C[NH+]2CCC(CCF)CC2)CC[NH2+]1 ZINC000634998467 345198010 /nfs/dbraw/zinc/19/80/10/345198010.db2.gz GBBCKDFSQFJXIA-OCCSQVGLSA-N 2 0 242.382 2.446 20 0 BEADRP C[C@H]1C[C@@H](C[NH+]2CCC(CCF)CC2)CC[NH2+]1 ZINC000634998466 345198433 /nfs/dbraw/zinc/19/84/33/345198433.db2.gz GBBCKDFSQFJXIA-JSGCOSHPSA-N 2 0 242.382 2.446 20 0 BEADRP C[C@@H]1C[C@@H](C[NH2+][C@H]2CCCC23CC3)CC[NH2+]1 ZINC000634999314 345199149 /nfs/dbraw/zinc/19/91/49/345199149.db2.gz SGKZSBSZJVTOND-AGIUHOORSA-N 2 0 222.376 2.297 20 0 BEADRP COc1cc(C[N@@H+]2C[C@H](C)[C@H](C[NH3+])C2)ccc1C ZINC000634999689 345200023 /nfs/dbraw/zinc/20/00/23/345200023.db2.gz XXQRNWAPZOPSER-GXTWGEPZSA-N 2 0 248.370 2.030 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)c1ccncc1 ZINC000635007331 345202751 /nfs/dbraw/zinc/20/27/51/345202751.db2.gz PHNPPKFIHJOLQR-YRGRVCCFSA-N 2 0 233.359 2.250 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCCC12CC2)[C@H]1CCCC[NH2+]1 ZINC000635003290 345205880 /nfs/dbraw/zinc/20/58/80/345205880.db2.gz HTYBMDQOTWSZSA-YNEHKIRRSA-N 2 0 222.376 2.439 20 0 BEADRP C1CC12CCC[C@@H]2[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000635004434 345207718 /nfs/dbraw/zinc/20/77/18/345207718.db2.gz OKPUQSCNJGZVHD-HNGCFSAESA-N 2 0 220.360 2.192 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC[NH2+]CC(C)(C)C1)[C@H]1C[C@H]1C ZINC000635004757 345208319 /nfs/dbraw/zinc/20/83/19/345208319.db2.gz DXGHRNMIGISELR-LPWJVIDDSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)c1ccco1 ZINC000635004818 345208326 /nfs/dbraw/zinc/20/83/26/345208326.db2.gz GMGQHVXCCLUUIS-SRVKXCTJSA-N 2 0 222.332 2.448 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@H]1CCCC12CC2 ZINC000635006056 345210831 /nfs/dbraw/zinc/21/08/31/345210831.db2.gz XGEYYWCHAYYBIT-RYUDHWBXSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)c1cccnc1 ZINC000635006773 345211251 /nfs/dbraw/zinc/21/12/51/345211251.db2.gz NRHNSGGXUBFYGQ-OBJOEFQTSA-N 2 0 233.359 2.250 20 0 BEADRP CO[C@H]1CCC[C@@H]([NH2+][C@H]2CC[C@H](C[NH3+])CC2)C1 ZINC000635006901 345211448 /nfs/dbraw/zinc/21/14/48/345211448.db2.gz ULOHTKZCUWSZDC-SYQHCUMBSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[NH2+]CC(C)(C)C1)C1CC1 ZINC000635011120 345213089 /nfs/dbraw/zinc/21/30/89/345213089.db2.gz MHBATPVWVMNCNK-JQWIXIFHSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]Cc1cccc2[nH]ccc21 ZINC000635011313 345213514 /nfs/dbraw/zinc/21/35/14/345213514.db2.gz DTQGNLQGLGWGRB-GHMZBOCLSA-N 2 0 231.343 2.383 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]Cc1cccc2[nH]ccc21 ZINC000635012240 345214704 /nfs/dbraw/zinc/21/47/04/345214704.db2.gz JVSXCYZGYPDQCE-TZMCWYRMSA-N 2 0 229.327 2.137 20 0 BEADRP CCC[C@H](C)Nc1cc(N2CC[NH2+]CC2)cc[nH+]1 ZINC000635009294 345216430 /nfs/dbraw/zinc/21/64/30/345216430.db2.gz MXOOCJPHTPGKOJ-LBPRGKRZSA-N 2 0 248.374 2.092 20 0 BEADRP CSCCC[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C)C1 ZINC000158476083 345337941 /nfs/dbraw/zinc/33/79/41/345337941.db2.gz HQCHMDAGYCLRQX-OLZOCXBDSA-N 2 0 242.432 2.156 20 0 BEADRP CC(C)=CC[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000235515116 537896282 /nfs/dbraw/zinc/89/62/82/537896282.db2.gz JAYKHBNXWOWAQS-LBPRGKRZSA-N 2 0 210.365 2.273 20 0 BEADRP COCCC[NH+]1CCC([NH2+][C@H](C)C(C)C)CC1 ZINC000159084168 345408670 /nfs/dbraw/zinc/40/86/70/345408670.db2.gz PKHNZXLSKQVGBV-CYBMUJFWSA-N 2 0 242.407 2.121 20 0 BEADRP CCc1cc(NC(C)(C)c2ncc[nH]2)nc(C)n1 ZINC000641662974 362586794 /nfs/dbraw/zinc/58/67/94/362586794.db2.gz LACPFKSFCVCQCV-UHFFFAOYSA-N 2 0 245.330 2.418 20 0 BEADRP Cc1ccc([C@@H]2CCC[N@@H+]2CCOCC[NH3+])cc1 ZINC000357022789 178872181 /nfs/dbraw/zinc/87/21/81/178872181.db2.gz CCUZZZLOYAEDEC-HNNXBMFYSA-N 2 0 248.370 2.107 20 0 BEADRP C[NH2+]CCC[NH+]1CCC(c2ccccc2)CC1 ZINC000137846466 345693202 /nfs/dbraw/zinc/69/32/02/345693202.db2.gz NJWWCRIWUKMFEW-UHFFFAOYSA-N 2 0 232.371 2.476 20 0 BEADRP CC[C@@H]([NH2+]CCc1ccccc1)[C@@H]1CCC[NH2+]1 ZINC000145760823 345711901 /nfs/dbraw/zinc/71/19/01/345711901.db2.gz FLTAMTAKWJLKNG-CABCVRRESA-N 2 0 232.371 2.349 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+][C@@H](C)C1CC(F)(F)C1 ZINC000628210186 345812433 /nfs/dbraw/zinc/81/24/33/345812433.db2.gz KQGOPKDNZLHNJW-UWVGGRQHSA-N 2 0 234.334 2.350 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@@H](C)C1CC(F)(F)C1 ZINC000628210188 345812501 /nfs/dbraw/zinc/81/25/01/345812501.db2.gz KQGOPKDNZLHNJW-ZJUUUORDSA-N 2 0 234.334 2.350 20 0 BEADRP CC(C)[NH2+][C@H]1CCCN(CC2CCC2)C1 ZINC000070585041 345788468 /nfs/dbraw/zinc/78/84/68/345788468.db2.gz PKTIPDWJQNRTMV-ZDUSSCGKSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H](Cc1cccs1)[NH2+]C[C@H]1CCCN1C ZINC000166877873 345925174 /nfs/dbraw/zinc/92/51/74/345925174.db2.gz XRUDINQYLIRQCG-NWDGAFQWSA-N 2 0 238.400 2.363 20 0 BEADRP C[C@@H](C[NH2+][C@@H](C)Cc1ccsc1)C[NH+](C)C ZINC000381455937 345937178 /nfs/dbraw/zinc/93/71/78/345937178.db2.gz IJRPRCURNRACCP-RYUDHWBXSA-N 2 0 240.416 2.466 20 0 BEADRP CC1=CC[C@@H]([NH2+]CCCC[NH+](C)C)CC1 ZINC000380305231 345979572 /nfs/dbraw/zinc/97/95/72/345979572.db2.gz FKXVFBHDTCLSQE-CYBMUJFWSA-N 2 0 210.365 2.417 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)[C@H]1CC1(C)C ZINC000381492591 346077570 /nfs/dbraw/zinc/07/75/70/346077570.db2.gz YTEWIFGUFMQDDG-YNEHKIRRSA-N 2 0 224.392 2.352 20 0 BEADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+]CC2(C)CC2)C1 ZINC000381521491 346242500 /nfs/dbraw/zinc/24/25/00/346242500.db2.gz UVIMQJWVXAAEMI-ZDUSSCGKSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH+](C)CCC[N@H+](C)C[C@@]1(C)CCCS1 ZINC000628277192 346286417 /nfs/dbraw/zinc/28/64/17/346286417.db2.gz GYRURWQGEWQLDM-GFCCVEGCSA-N 2 0 230.421 2.156 20 0 BEADRP Cc1cccc(C)c1C[N@H+]1CC[C@H]([C@@H](C)[NH3+])C1 ZINC000163214678 179035432 /nfs/dbraw/zinc/03/54/32/179035432.db2.gz IPURWBODKIZTEQ-KGLIPLIRSA-N 2 0 232.371 2.473 20 0 BEADRP CC(C)[C@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)C1CC1 ZINC000563348531 323119879 /nfs/dbraw/zinc/11/98/79/323119879.db2.gz BTFIMBDCIPTINL-RTXFEEFZSA-N 2 0 210.365 2.151 20 0 BEADRP Cc1cccc(CC[NH2+]C[C@@H]2CCC[N@@H+](C)C2)c1 ZINC000054243903 179058476 /nfs/dbraw/zinc/05/84/76/179058476.db2.gz MQHAPRGQPYXYRB-INIZCTEOSA-N 2 0 246.398 2.469 20 0 BEADRP C[C@H](CC(F)(F)F)[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000300361729 346432005 /nfs/dbraw/zinc/43/20/05/346432005.db2.gz HHWRWHNIUYVHAH-HRDYMLBCSA-N 2 0 224.270 2.187 20 0 BEADRP Cc1ccc(CN(C)[C@@H]2CC[N@H+](C)[C@@H](C)C2)nc1 ZINC000334175553 346438429 /nfs/dbraw/zinc/43/84/29/346438429.db2.gz CJKZYYYVKLFKEJ-DZGCQCFKSA-N 2 0 247.386 2.305 20 0 BEADRP Cc1c[nH+]ccc1NC[C@H]1CCC[N@@H+](C)C1 ZINC000070047285 349965162 /nfs/dbraw/zinc/96/51/62/349965162.db2.gz COZQPSTVNICZHU-GFCCVEGCSA-N 2 0 219.332 2.144 20 0 BEADRP CC[NH+](CC)CCC[N@H+](C)[C@H](C)C1CC1 ZINC000170794150 346451484 /nfs/dbraw/zinc/45/14/84/346451484.db2.gz SGKIQEQOQVEZRI-GFCCVEGCSA-N 2 0 212.381 2.449 20 0 BEADRP C[C@@H](C1CC1)[N@H+](C)CCC[NH+]1CCCC1 ZINC000170794144 346451914 /nfs/dbraw/zinc/45/19/14/346451914.db2.gz TVHVQENCRVACLD-LBPRGKRZSA-N 2 0 210.365 2.203 20 0 BEADRP CCC(F)(F)C[NH+]1CCC2(CC[NH2+]C2)CC1 ZINC000641797684 362745193 /nfs/dbraw/zinc/74/51/93/362745193.db2.gz FUKTYNFVDKSTBN-UHFFFAOYSA-N 2 0 232.318 2.107 20 0 BEADRP CC(C)C[C@H](C)C[NH2+][C@@H]1C[C@@H]([NH3+])C1(C)C ZINC000641804248 362761908 /nfs/dbraw/zinc/76/19/08/362761908.db2.gz XDAKJJPMQDUGET-QJPTWQEYSA-N 2 0 212.381 2.384 20 0 BEADRP CCc1nc(C)c(CN[C@@H](C[NH3+])C(C)(C)C)o1 ZINC000641800535 362752048 /nfs/dbraw/zinc/75/20/48/362752048.db2.gz ZACKHVUNLQNMIH-NSHDSACASA-N 2 0 239.363 2.008 20 0 BEADRP Cc1cccc(C[NH2+][C@H](C)CCC[NH3+])c1 ZINC000336682609 179100430 /nfs/dbraw/zinc/10/04/30/179100430.db2.gz JLNWQZQEVJLVSL-GFCCVEGCSA-N 2 0 206.333 2.212 20 0 BEADRP CC1(C)[C@H]([NH3+])C[C@@H]1[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC000641800906 362753795 /nfs/dbraw/zinc/75/37/95/362753795.db2.gz ILLSEOSFNBARGU-BBBLOLIVSA-N 2 0 232.318 2.137 20 0 BEADRP CC1(C)CC(C[NH2+][C@@H]2C[C@H]([NH3+])C2(C)C)C1 ZINC000641801233 362755576 /nfs/dbraw/zinc/75/55/76/362755576.db2.gz OCCJLIVAIPHKQZ-WDEREUQCSA-N 2 0 210.365 2.138 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2C[C@@H]([NH3+])C2(C)C)cc1F ZINC000641801788 362756641 /nfs/dbraw/zinc/75/66/41/362756641.db2.gz VQPOUHTZYJORFB-OLZOCXBDSA-N 2 0 236.334 2.350 20 0 BEADRP C[C@H](c1ccccn1)[NH+]1CCC(CC[NH3+])CC1 ZINC000070183554 349967256 /nfs/dbraw/zinc/96/72/56/349967256.db2.gz UYUYGGOIQDZTFV-GFCCVEGCSA-N 2 0 233.359 2.203 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2C[C@@H]([NH3+])C2(C)C)cc1F ZINC000641801787 362756883 /nfs/dbraw/zinc/75/68/83/362756883.db2.gz VQPOUHTZYJORFB-CHWSQXEVSA-N 2 0 236.334 2.350 20 0 BEADRP C[C@@H](c1ccccn1)[NH+]1CCC(CC[NH3+])CC1 ZINC000070183553 349967364 /nfs/dbraw/zinc/96/73/64/349967364.db2.gz UYUYGGOIQDZTFV-LBPRGKRZSA-N 2 0 233.359 2.203 20 0 BEADRP Cc1cnccc1CN1[C@H](C)[C@H](C)CC[C@H]1C[NH3+] ZINC000641806382 362764730 /nfs/dbraw/zinc/76/47/30/362764730.db2.gz RIPAHFCEZSMLRI-KYOSRNDESA-N 2 0 247.386 2.338 20 0 BEADRP Cc1ncccc1CN1[C@H](C)[C@H](C)CC[C@H]1C[NH3+] ZINC000641809494 362765971 /nfs/dbraw/zinc/76/59/71/362765971.db2.gz QRXSWCIHEBFFKW-KYOSRNDESA-N 2 0 247.386 2.338 20 0 BEADRP Cc1ncccc1CN1[C@H](C)[C@@H](C)CC[C@H]1C[NH3+] ZINC000641809495 362766551 /nfs/dbraw/zinc/76/65/51/362766551.db2.gz QRXSWCIHEBFFKW-LNSITVRQSA-N 2 0 247.386 2.338 20 0 BEADRP Cc1cccc(NC[C@H]2CCC[C@@H]([NH3+])C2)[nH+]1 ZINC000227669517 179148785 /nfs/dbraw/zinc/14/87/85/179148785.db2.gz GCRAFEBVXXFLET-NWDGAFQWSA-N 2 0 219.332 2.319 20 0 BEADRP CC[C@@H](C)[N@@H+]1CC[C@@H](c2nccn2C)C1 ZINC000580211793 346684821 /nfs/dbraw/zinc/68/48/21/346684821.db2.gz JRYRTROLTPEAIO-GHMZBOCLSA-N 2 0 207.321 2.008 20 0 BEADRP C[C@H](c1ccccc1)[N@@H+]1C[C@H](C[NH3+])C[C@H]1C ZINC000252699707 346780349 /nfs/dbraw/zinc/78/03/49/346780349.db2.gz VTIFYBOKHPLFSV-UPJWGTAASA-N 2 0 218.344 2.417 20 0 BEADRP Cc1cccc(OCC[N@@H+](C)C2CC[NH2+]CC2)c1 ZINC000036300530 179166585 /nfs/dbraw/zinc/16/65/85/179166585.db2.gz KCFCJCLANCUZNI-UHFFFAOYSA-N 2 0 248.370 2.058 20 0 BEADRP Cc1cccc(OCC[N@H+]2C[C@H](C[NH3+])C[C@H]2C)c1 ZINC000228081180 179168138 /nfs/dbraw/zinc/16/81/38/179168138.db2.gz WWLCIKSNBIPCTD-KGLIPLIRSA-N 2 0 248.370 2.043 20 0 BEADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]C(C)C)[C@H](C)C1 ZINC000151985382 347209061 /nfs/dbraw/zinc/20/90/61/347209061.db2.gz LNZCAAJHTOVZHE-KGLIPLIRSA-N 2 0 242.407 2.121 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000388085794 347181904 /nfs/dbraw/zinc/18/19/04/347181904.db2.gz VNDSLHFFUSARQR-OLZOCXBDSA-N 2 0 224.392 2.495 20 0 BEADRP CC(C)[C@H](C)[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000318843069 347224622 /nfs/dbraw/zinc/22/46/22/347224622.db2.gz GXMFZNZDBKDRQO-WUHRBBMRSA-N 2 0 210.365 2.009 20 0 BEADRP CC[NH+]1CCC([NH2+]CC2(OC)CCCC2)CC1 ZINC000310209920 347248257 /nfs/dbraw/zinc/24/82/57/347248257.db2.gz CGOXZZPEDCUBFQ-UHFFFAOYSA-N 2 0 240.391 2.020 20 0 BEADRP Cc1cccc(CC[NH2+]CCCC[NH+](C)C)c1 ZINC000390131112 347255221 /nfs/dbraw/zinc/25/52/21/347255221.db2.gz DCCGNSJQCFEYSM-UHFFFAOYSA-N 2 0 234.387 2.469 20 0 BEADRP Fc1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1CCC[NH2+]C1)CC2 ZINC000335516217 136741701 /nfs/dbraw/zinc/74/17/01/136741701.db2.gz JEWCTRRVQBTQLG-ABAIWWIYSA-N 2 0 248.345 2.402 20 0 BEADRP C[C@@H](C[NH3+])N(C)Cc1cccc(Cl)c1 ZINC000020226756 347430611 /nfs/dbraw/zinc/43/06/11/347430611.db2.gz KENOZOXJYUQORR-VIFPVBQESA-N 2 0 212.724 2.119 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@@H](C)C1CCCC1 ZINC000054081235 347445105 /nfs/dbraw/zinc/44/51/05/347445105.db2.gz PNRVXCNJSRGDBR-NEPJUHHUSA-N 2 0 212.381 2.495 20 0 BEADRP CC1(C)CC[C@H]1[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000336769191 347447249 /nfs/dbraw/zinc/44/72/49/347447249.db2.gz VIQWLZCMOKQWQJ-VXGBXAGGSA-N 2 0 210.365 2.297 20 0 BEADRP C(CC1CCCC1)C[N@@H+]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000357068181 187377215 /nfs/dbraw/zinc/37/72/15/187377215.db2.gz DKWFPLQEUWACPA-GJZGRUSLSA-N 2 0 236.403 2.498 20 0 BEADRP C[N@H+]1CC=C(C[NH2+]C[C@]2(C)CCCS2)CC1 ZINC000392185351 347504081 /nfs/dbraw/zinc/50/40/81/347504081.db2.gz DAXPZWYIXUYCHY-ZDUSSCGKSA-N 2 0 240.416 2.124 20 0 BEADRP CC[C@H](C)[C@@H](C)[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000319487598 259396359 /nfs/dbraw/zinc/39/63/59/259396359.db2.gz GWCWRXMCIJWVGW-XQQFMLRXSA-N 2 0 212.381 2.400 20 0 BEADRP Cc1ccccc1CCC[NH+]1C[C@@H]2C[NH2+]C[C@H]2C1 ZINC000359283907 179261103 /nfs/dbraw/zinc/26/11/03/179261103.db2.gz KIXOKSVNFQJGJF-HOTGVXAUSA-N 2 0 244.382 2.079 20 0 BEADRP Cc1ccccc1C[N@H+]1C[C@H](C[NH3+])C[C@@H]1C ZINC000122313705 179275467 /nfs/dbraw/zinc/27/54/67/179275467.db2.gz UHUWXBOGCHTLEN-STQMWFEESA-N 2 0 218.344 2.164 20 0 BEADRP Cc1ccccc1C[N@@H+]1CC[C@@H]([NH3+])[C@H](C)C1 ZINC000049712976 179275960 /nfs/dbraw/zinc/27/59/60/179275960.db2.gz RYRFEPQYAFWMQG-TZMCWYRMSA-N 2 0 218.344 2.164 20 0 BEADRP C[C@@H](Cc1ccco1)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000054241420 1172095917 /nfs/dbraw/zinc/09/59/17/1172095917.db2.gz FVKWUGHAEUDXPK-STQMWFEESA-N 2 0 236.359 2.142 20 0 BEADRP Cc1ccccc1C[C@H](C)[NH2+]C1CC[NH2+]CC1 ZINC000038041523 179291454 /nfs/dbraw/zinc/29/14/54/179291454.db2.gz QGKQFYVYVUXXJO-ZDUSSCGKSA-N 2 0 232.371 2.268 20 0 BEADRP C[C@H](Cc1ccco1)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000054241423 1172096793 /nfs/dbraw/zinc/09/67/93/1172096793.db2.gz FVKWUGHAEUDXPK-CHWSQXEVSA-N 2 0 236.359 2.142 20 0 BEADRP CS[C@H]1CC[C@@H]1[NH2+]CCC[N@H+](C)CC(C)C ZINC000593647111 347926473 /nfs/dbraw/zinc/92/64/73/347926473.db2.gz WJJXMMPBUDBPJV-STQMWFEESA-N 2 0 244.448 2.448 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21)[C@H]1CCOC1 ZINC000253070968 347932531 /nfs/dbraw/zinc/93/25/31/347932531.db2.gz MUOOIXVAXABZBU-UOVKNHIHSA-N 2 0 246.354 2.146 20 0 BEADRP C[C@@H](Cc1ccco1)[NH2+]C[C@@H]1CCCCN1C ZINC000054241416 1172097182 /nfs/dbraw/zinc/09/71/82/1172097182.db2.gz YSAUIXNSOODLHC-STQMWFEESA-N 2 0 236.359 2.285 20 0 BEADRP C[C@@H]1C[C@@H](C)C[NH+](CCSCC[NH+](C)C)C1 ZINC000594889277 348122780 /nfs/dbraw/zinc/12/27/80/348122780.db2.gz AJEBHLHOBDLZQB-CHWSQXEVSA-N 2 0 244.448 2.259 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)CSCCF)C1 ZINC000595010211 348159911 /nfs/dbraw/zinc/15/99/11/348159911.db2.gz IZPGPNKGEUGIND-RYUDHWBXSA-N 2 0 248.411 2.009 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@@H](C)CSCCF ZINC000595018009 348170858 /nfs/dbraw/zinc/17/08/58/348170858.db2.gz ZMHSDIRHXFVIJF-MNOVXSKESA-N 2 0 236.400 2.007 20 0 BEADRP C[C@H](CSCCF)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000595015442 348186061 /nfs/dbraw/zinc/18/60/61/348186061.db2.gz FEDNYMWKBFDATF-NEPJUHHUSA-N 2 0 248.411 2.009 20 0 BEADRP CSCCC[N@@H+]1CCC[C@@]2(CC[NH+](C)C2)C1 ZINC000595507813 348264823 /nfs/dbraw/zinc/26/48/23/348264823.db2.gz RGWAJMUGHTWVDK-ZDUSSCGKSA-N 2 0 242.432 2.157 20 0 BEADRP CSCCCC[NH2+][C@@H]1CCCC[C@@H]1C[NH3+] ZINC000229207804 490158600 /nfs/dbraw/zinc/15/86/00/490158600.db2.gz MSXDMBAIMLCMNU-VXGBXAGGSA-N 2 0 230.421 2.237 20 0 BEADRP COC1(C[NH2+][C@H]2CC[N@H+](C)C(C)(C)C2)CCC1 ZINC000623487583 362911237 /nfs/dbraw/zinc/91/12/37/362911237.db2.gz IXYHMTWJFWMNNS-LBPRGKRZSA-N 2 0 240.391 2.018 20 0 BEADRP CSCC1(CC[NH2+][C@@H](C)[C@@H]2CCC[NH2+]2)CC1 ZINC000596650245 348605449 /nfs/dbraw/zinc/60/54/49/348605449.db2.gz KGOQJXXXTALXOA-RYUDHWBXSA-N 2 0 242.432 2.250 20 0 BEADRP CC(C)=CC[NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1 ZINC000623505662 362929976 /nfs/dbraw/zinc/92/99/76/362929976.db2.gz LGFMWZUWWSDHOV-GFCCVEGCSA-N 2 0 210.365 2.415 20 0 BEADRP CCC[C@H](CC)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000054243866 348960945 /nfs/dbraw/zinc/96/09/45/348960945.db2.gz OQXXNDPFBGVMLY-OLZOCXBDSA-N 2 0 212.381 2.497 20 0 BEADRP CSC1(C[NH2+][C@@H]2CC[N@H+](C)C(C)(C)C2)CC1 ZINC000598976676 349070267 /nfs/dbraw/zinc/07/02/67/349070267.db2.gz ZLJISTRMITWPIQ-LLVKDONJSA-N 2 0 242.432 2.344 20 0 BEADRP CCC[N@H+](C)C[C@@H]1CC[NH+]([C@H](C)CC)C1 ZINC000248375590 349127358 /nfs/dbraw/zinc/12/73/58/349127358.db2.gz XFYATVOPTXIIJU-OLZOCXBDSA-N 2 0 212.381 2.449 20 0 BEADRP C[C@H]([NH2+]C1CC=CC1)C1CC[NH+](C)CC1 ZINC000122128883 490238211 /nfs/dbraw/zinc/23/82/11/490238211.db2.gz MMQZMVZARPORTB-NSHDSACASA-N 2 0 208.349 2.025 20 0 BEADRP C(C[NH2+]C1CCCCCC1)[NH2+]CC1CC1 ZINC000040397512 191001154 /nfs/dbraw/zinc/00/11/54/191001154.db2.gz DODLJMGUCHAKBE-UHFFFAOYSA-N 2 0 210.365 2.298 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]CC(C)(C)C)CC1 ZINC000040492329 191005259 /nfs/dbraw/zinc/00/52/59/191005259.db2.gz VCLPIVXCPUIDQH-UHFFFAOYSA-N 2 0 212.381 2.495 20 0 BEADRP CCCC1CC[NH+](CC2CC[NH2+]CC2)CC1 ZINC000050893837 168607820 /nfs/dbraw/zinc/60/78/20/168607820.db2.gz QXCOERYGYONQEO-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP Cc1cncc(C[N@@H+]2C[C@H](C[NH3+])[C@@H](C)C[C@H]2C)c1 ZINC000397310593 350085158 /nfs/dbraw/zinc/08/51/58/350085158.db2.gz ORUHSGYKWBSUGU-GUTXKFCHSA-N 2 0 247.386 2.195 20 0 BEADRP CC[NH+]1CCC(C[NH2+]CC2(SC)CC2)CC1 ZINC000304241542 350150808 /nfs/dbraw/zinc/15/08/08/350150808.db2.gz DHLAKJVWXDLZND-UHFFFAOYSA-N 2 0 242.432 2.204 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H](C1CC1)C1CCC1 ZINC000324701766 323263676 /nfs/dbraw/zinc/26/36/76/323263676.db2.gz YLQIRYMELFLMQJ-MFKMUULPSA-N 2 0 210.365 2.282 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@H]2CCC[C@H]3C[C@H]32)CC1 ZINC000304615091 350158294 /nfs/dbraw/zinc/15/82/94/350158294.db2.gz SGCSWCBTGIFUOZ-MJBXVCDLSA-N 2 0 222.376 2.106 20 0 BEADRP CSCCCC[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@H]1C ZINC000133637408 191042428 /nfs/dbraw/zinc/04/24/28/191042428.db2.gz QIMVZSBPEYEUFG-JHJVBQTASA-N 2 0 244.448 2.448 20 0 BEADRP Cc1ncc(C[N@@H+]2CCC[C@@H](CC[NH3+])C2)s1 ZINC000069724474 180143338 /nfs/dbraw/zinc/14/33/38/180143338.db2.gz HACGSOIEGNJFIG-NSHDSACASA-N 2 0 239.388 2.012 20 0 BEADRP C[C@@H](F)CC[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623533114 362952012 /nfs/dbraw/zinc/95/20/12/362952012.db2.gz TXTZGDBRMSKNIH-MNOVXSKESA-N 2 0 216.344 2.197 20 0 BEADRP Cc1ccc(C[NH2+][C@H](C)C[C@H](C)[NH3+])cc1 ZINC000422756414 192456929 /nfs/dbraw/zinc/45/69/29/192456929.db2.gz IQYPDOLVNHZAAU-NWDGAFQWSA-N 2 0 206.333 2.210 20 0 BEADRP Fc1cccc(CC[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)c1 ZINC000422782951 192465993 /nfs/dbraw/zinc/46/59/93/192465993.db2.gz KHYIXTCFAQVQBE-YIONKMFJSA-N 2 0 248.345 2.241 20 0 BEADRP Cc1ncsc1C[NH2+]C[C@H]1CCC[C@@H]([NH3+])C1 ZINC000070838279 180322873 /nfs/dbraw/zinc/32/28/73/180322873.db2.gz PVOXDAFCPDJUEA-WDEREUQCSA-N 2 0 239.388 2.059 20 0 BEADRP CC[C@@H]1CCC[N@@H+]1CCn1ccnc1C ZINC000336646611 350415815 /nfs/dbraw/zinc/41/58/15/350415815.db2.gz KVAZFMZDCVHYOT-GFCCVEGCSA-N 2 0 207.321 2.066 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+][C@@H]1CCCC[NH2+]C1 ZINC000577483163 365965071 /nfs/dbraw/zinc/96/50/71/365965071.db2.gz UWVOEBOFIANZEP-CHWSQXEVSA-N 2 0 236.359 2.332 20 0 BEADRP COCCN1CCC[C@@H]1C[NH2+][C@H](C)C(C)(C)C ZINC000163419188 350520985 /nfs/dbraw/zinc/52/09/85/350520985.db2.gz JZINZQZRHDMTCI-CHWSQXEVSA-N 2 0 242.407 2.121 20 0 BEADRP CC1(C)CC[C@H]([NH2+][C@@H]2CCC[C@@H]([NH3+])C2)C1 ZINC000228914323 191108556 /nfs/dbraw/zinc/10/85/56/191108556.db2.gz WREZXLNJRZAORT-UTUOFQBUSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@H](C)c1ccccc1 ZINC000422742901 192469173 /nfs/dbraw/zinc/46/91/73/192469173.db2.gz HFMFHXXJCVJXHV-QJPTWQEYSA-N 2 0 206.333 2.463 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]Cc1ccc(Cl)s1 ZINC000070600382 350547017 /nfs/dbraw/zinc/54/70/17/350547017.db2.gz RGBUMTAHRSIESY-SSDOTTSWSA-N 2 0 218.753 2.086 20 0 BEADRP CC[C@@H]1OCC[C@H]1[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623548232 362968027 /nfs/dbraw/zinc/96/80/27/362968027.db2.gz QSWKJPBUBXGNGY-UPJWGTAASA-N 2 0 240.391 2.016 20 0 BEADRP Cc1cnccc1CNCCC[N@@H+](C)C(C)C ZINC000384942954 350650962 /nfs/dbraw/zinc/65/09/62/350650962.db2.gz KHJNEFKUROLAQY-UHFFFAOYSA-N 2 0 235.375 2.210 20 0 BEADRP C[C@H](C[N@H+](C)C1CC([NH3+])C1)c1ccccc1 ZINC000384957138 350673225 /nfs/dbraw/zinc/67/32/25/350673225.db2.gz GWSMVXOMRLFKGH-LMWSTFAQSA-N 2 0 218.344 2.212 20 0 BEADRP C[C@@H]1SCC[C@@H]1[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623558517 362981189 /nfs/dbraw/zinc/98/11/89/362981189.db2.gz AGILQMCDTQNJIW-SRVKXCTJSA-N 2 0 242.432 2.343 20 0 BEADRP CC[NH+](CC)CCC[NH+]1CCC(C)CC1 ZINC000041226426 350784829 /nfs/dbraw/zinc/78/48/29/350784829.db2.gz KKXQYMCBYQVKRA-UHFFFAOYSA-N 2 0 212.381 2.450 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)[C@@H]1C[C@H]1C1CC1 ZINC000623560564 362985476 /nfs/dbraw/zinc/98/54/76/362985476.db2.gz KLYAUIRPROPTGV-MFHWUAJNSA-N 2 0 236.403 2.351 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]C[C@H](C)C2CC2)[C@H](C)C1 ZINC000252708829 538099837 /nfs/dbraw/zinc/09/98/37/538099837.db2.gz BFKMJMZKCAWKPO-SCRDCRAPSA-N 2 0 224.392 2.352 20 0 BEADRP CC(C)[NH+]1CCC([N@H+](C)CC2CC2)CC1 ZINC000336652633 191133677 /nfs/dbraw/zinc/13/36/77/191133677.db2.gz XBDMWDITUHISMP-UHFFFAOYSA-N 2 0 210.365 2.201 20 0 BEADRP CC(C)C[C@H](C)C[N@@H+]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000309436649 187482111 /nfs/dbraw/zinc/48/21/11/187482111.db2.gz NEGDYMYOAIEQQS-IHRRRGAJSA-N 2 0 224.392 2.210 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CC2CC=CC2)CC1(C)C ZINC000623612616 363051333 /nfs/dbraw/zinc/05/13/33/363051333.db2.gz BERBWRLFVGNGJG-ZDUSSCGKSA-N 2 0 222.376 2.415 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CCC[C@@H]2C[NH3+])cc1F ZINC000414792920 351773304 /nfs/dbraw/zinc/77/33/04/351773304.db2.gz JIWLQKJZWVLZOB-OCCSQVGLSA-N 2 0 236.334 2.351 20 0 BEADRP CC(C)[NH2+]C1CC[NH+](CCC[C@H]2CCO2)CC1 ZINC000638002320 351878195 /nfs/dbraw/zinc/87/81/95/351878195.db2.gz XSHQRLUALJPQLR-AWEZNQCLSA-N 2 0 240.391 2.018 20 0 BEADRP CCC[C@@H](C[N@@H+]1CC[C@H](C[NH+](C)CC)C1)OC ZINC000638131881 352001815 /nfs/dbraw/zinc/00/18/15/352001815.db2.gz FDSXJYKNRHGNFJ-KGLIPLIRSA-N 2 0 242.407 2.075 20 0 BEADRP CO[C@H](C[NH2+]CCC[NH+](C)C)C1CCCCC1 ZINC000638289482 352125197 /nfs/dbraw/zinc/12/51/97/352125197.db2.gz JZXWFRDZTFEWFT-CQSZACIVSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@H]([NH2+]CCC[NH+]1CCCCC1)[C@@H]1CC1(F)F ZINC000638307192 352135626 /nfs/dbraw/zinc/13/56/26/352135626.db2.gz HQKXXMVNJPKCNH-RYUDHWBXSA-N 2 0 246.345 2.496 20 0 BEADRP CCOC1CC(C[NH2+]CCC[N@H+](C)C(C)C)C1 ZINC000638337382 352156312 /nfs/dbraw/zinc/15/63/12/352156312.db2.gz FMFLGQMKYIJZHA-UHFFFAOYSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CC[NH2+]C1)[C@@H](C)c1ccccc1 ZINC000414899932 352174871 /nfs/dbraw/zinc/17/48/71/352174871.db2.gz CVPXMPBBNBEDCY-HZSPNIEDSA-N 2 0 232.371 2.378 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]CCC[C@@H]2CCO2)CC1 ZINC000638321340 352143076 /nfs/dbraw/zinc/14/30/76/352143076.db2.gz WXQGUQYGLYILCM-CQSZACIVSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000414918229 352272832 /nfs/dbraw/zinc/27/28/32/352272832.db2.gz TWEWCEVDACGCRO-AGIUHOORSA-N 2 0 210.365 2.154 20 0 BEADRP COC[C@H](CC(C)C)[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000414919520 352281466 /nfs/dbraw/zinc/28/14/66/352281466.db2.gz XFOOTZBQZNHTGY-UONOGXRCSA-N 2 0 242.407 2.027 20 0 BEADRP COC[C@H](CC(C)C)[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000414919518 352281561 /nfs/dbraw/zinc/28/15/61/352281561.db2.gz XFOOTZBQZNHTGY-KBPBESRZSA-N 2 0 242.407 2.027 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+]C[C@H]1CCC[C@H](C)C1 ZINC000414955623 352374978 /nfs/dbraw/zinc/37/49/78/352374978.db2.gz MIMRHDPVBFORFV-XQQFMLRXSA-N 2 0 212.381 2.400 20 0 BEADRP CCC[C@H](C)C[NH2+]CC1(COC)CC[NH2+]CC1 ZINC000414971286 352398405 /nfs/dbraw/zinc/39/84/05/352398405.db2.gz IOTQFQPPZUXGHI-ZDUSSCGKSA-N 2 0 242.407 2.028 20 0 BEADRP CC1CCC([NH2+][C@@H]2CCC[C@@H]([NH3+])C2)CC1 ZINC000086401863 538104155 /nfs/dbraw/zinc/10/41/55/538104155.db2.gz GUBGSODFOXBQMU-POOIEITISA-N 2 0 210.365 2.425 20 0 BEADRP Cc1c[nH+]ccc1N(C)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000334191039 352781784 /nfs/dbraw/zinc/78/17/84/352781784.db2.gz HLDXSBZJTVLNKP-PBWFPOADSA-N 2 0 245.370 2.451 20 0 BEADRP CCO[C@@H](CC[NH2+][C@@H](C)CCC[NH3+])C(C)C ZINC000422814598 192478057 /nfs/dbraw/zinc/47/80/57/192478057.db2.gz VOPKUWMZZUNAFB-STQMWFEESA-N 2 0 230.396 2.155 20 0 BEADRP CCN1CCC([NH2+][C@H]2CC[C@H]2C2CC2)CC1 ZINC000336753578 353107514 /nfs/dbraw/zinc/10/75/14/353107514.db2.gz FBGLCNLMODQANJ-KBPBESRZSA-N 2 0 222.376 2.249 20 0 BEADRP [NH3+]C1CC[NH+](CCCOCc2ccccc2)CC1 ZINC000140139302 353114473 /nfs/dbraw/zinc/11/44/73/353114473.db2.gz BCHKDPNAVBVBHY-UHFFFAOYSA-N 2 0 248.370 2.016 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]CC1CCC(C)CC1 ZINC000414846777 259434209 /nfs/dbraw/zinc/43/42/09/259434209.db2.gz VEORWQPAWOGFJI-OTTFEQOBSA-N 2 0 212.381 2.258 20 0 BEADRP CC(C)C[C@H](C)[N@@H+]1CC[C@@H](C[NH+](C)C)C1 ZINC000355693240 188063680 /nfs/dbraw/zinc/06/36/80/188063680.db2.gz VBYXETRAMKOWCI-STQMWFEESA-N 2 0 212.381 2.305 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]CC2(C(F)F)CC2)CC1 ZINC000355172937 188063936 /nfs/dbraw/zinc/06/39/36/188063936.db2.gz XVYILFQNYYOIFH-UHFFFAOYSA-N 2 0 246.345 2.494 20 0 BEADRP C[NH+](C)CCCC[NH2+]Cc1ccc(F)cc1F ZINC000045598361 353146438 /nfs/dbraw/zinc/14/64/38/353146438.db2.gz SXJMNRLAPNSHFL-UHFFFAOYSA-N 2 0 242.313 2.396 20 0 BEADRP CC(C)C[C@H](C)C[N@@H+]1CC[C@]2(CC[NH2+]C2)C1 ZINC000304514159 188076721 /nfs/dbraw/zinc/07/67/21/188076721.db2.gz DSHXKISDGOSVPJ-KBPBESRZSA-N 2 0 224.392 2.354 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C2CCCC2)[C@@H]2CCC[C@H]21 ZINC000367625809 188082263 /nfs/dbraw/zinc/08/22/63/188082263.db2.gz ZAJPPFXMGKLSJP-MELADBBJSA-N 2 0 222.376 2.391 20 0 BEADRP Cc1ncc(C[NH2+]CCC[C@H]2CCC[NH2+]2)s1 ZINC000336698881 188083506 /nfs/dbraw/zinc/08/35/06/188083506.db2.gz ZOHSUSFSOSCEAK-NSHDSACASA-N 2 0 239.388 2.073 20 0 BEADRP C1CCC([NH2+][C@H]2CCN3CCCC[C@H]23)C1 ZINC000036996498 188104700 /nfs/dbraw/zinc/10/47/00/188104700.db2.gz UUCHMYHNJBPUCU-QWHCGFSZSA-N 2 0 208.349 2.145 20 0 BEADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+]Cc2cc[nH]c2)C1 ZINC000086252921 188143396 /nfs/dbraw/zinc/14/33/96/188143396.db2.gz CYDBNXSONJUZMV-CQSZACIVSA-N 2 0 235.375 2.225 20 0 BEADRP CCC[NH+]1CCC([NH2+]CCC2CC2)CC1 ZINC000083893265 538112047 /nfs/dbraw/zinc/11/20/47/538112047.db2.gz RXUJRTPJUZUZNA-UHFFFAOYSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@@H](CCc1ccccc1)[NH2+]CCCC[NH3+] ZINC000037714753 358476663 /nfs/dbraw/zinc/47/66/63/358476663.db2.gz SAQWZHXYSRLJHY-ZDUSSCGKSA-N 2 0 220.360 2.336 20 0 BEADRP CC(C)[N@H+](C[C@H]1CCC[NH2+]C1)C1CCC1 ZINC000226438880 188155326 /nfs/dbraw/zinc/15/53/26/188155326.db2.gz JIPCKVPNJISPOK-LBPRGKRZSA-N 2 0 210.365 2.249 20 0 BEADRP CCOc1ccccc1[C@H](C)[NH2+]CCCC[NH3+] ZINC000037714973 358476271 /nfs/dbraw/zinc/47/62/71/358476271.db2.gz SZJAYYSBVOJETJ-LBPRGKRZSA-N 2 0 236.359 2.475 20 0 BEADRP C1C[C@H]2C[C@@H]([NH2+]C3CCSCC3)CC[N@@H+]2C1 ZINC000106868998 188166870 /nfs/dbraw/zinc/16/68/70/188166870.db2.gz IRSLVGSOGWWFBB-STQMWFEESA-N 2 0 240.416 2.098 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@H]2CC[C@@H](F)C2)CC1 ZINC000309333962 188167491 /nfs/dbraw/zinc/16/74/91/188167491.db2.gz AAEKHVRJSRASGH-YPMHNXCESA-N 2 0 228.355 2.339 20 0 BEADRP CCC[C@H](CC)[NH2+]CC1=CC[N@H+](C)CC1 ZINC000309189371 188167688 /nfs/dbraw/zinc/16/76/88/188167688.db2.gz PLTSJPCQCDBZMA-ZDUSSCGKSA-N 2 0 210.365 2.417 20 0 BEADRP CC(C)C[C@H](C)C[N@@H+]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000309436648 188168526 /nfs/dbraw/zinc/16/85/26/188168526.db2.gz NEGDYMYOAIEQQS-BFHYXJOUSA-N 2 0 224.392 2.210 20 0 BEADRP CC(C)[NH+]1CCC(N(C)Cc2cccn2C)CC1 ZINC000271038464 188198333 /nfs/dbraw/zinc/19/83/33/188198333.db2.gz KWDSRQFUVQJXCD-UHFFFAOYSA-N 2 0 249.402 2.330 20 0 BEADRP C(C1CC[NH2+]CC1)[NH+]1CCCCCCC1 ZINC000020266249 188175880 /nfs/dbraw/zinc/17/58/80/188175880.db2.gz AVLNFHVYBCJEHD-UHFFFAOYSA-N 2 0 210.365 2.252 20 0 BEADRP CC(C)[C@H](C)[NH2+]C[C@@H](C)C[NH+]1CCCC1 ZINC000062077835 188184260 /nfs/dbraw/zinc/18/42/60/188184260.db2.gz LXJWVAASEMDHFG-OLZOCXBDSA-N 2 0 212.381 2.352 20 0 BEADRP c1[nH+]cn2cc(C[NH2+]C[C@@H]3CCC=CO3)ccc12 ZINC000297587542 188215233 /nfs/dbraw/zinc/21/52/33/188215233.db2.gz SNRHVLHXBSBEBW-AWEZNQCLSA-N 2 0 243.310 2.117 20 0 BEADRP COc1ccc(C[NH2+]CC2CC[NH+](C)CC2)cc1 ZINC000044515283 188216927 /nfs/dbraw/zinc/21/69/27/188216927.db2.gz BDTUCLQWFIMUKZ-UHFFFAOYSA-N 2 0 248.370 2.127 20 0 BEADRP CC[C@H]1CCC[N@H+](C[C@H]2CCC[NH2+]C2)CC1 ZINC000251834493 353292864 /nfs/dbraw/zinc/29/28/64/353292864.db2.gz QFISPLDUTYATLE-KBPBESRZSA-N 2 0 224.392 2.498 20 0 BEADRP Cc1ccsc1C[N@@H+]1CC[C@H]([NH3+])[C@@H](C)C1 ZINC000227057964 363227189 /nfs/dbraw/zinc/22/71/89/363227189.db2.gz SNXWKUQNDKWVLI-QWRGUYRKSA-N 2 0 224.373 2.226 20 0 BEADRP CC[N@H+](CC1CCC1)C[C@H]1CC[NH2+][C@@H](C)C1 ZINC000230321055 353487578 /nfs/dbraw/zinc/48/75/78/353487578.db2.gz QSRIDKGPERMGCK-JSGCOSHPSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@](C)(C[N@@H+]1CCC[C@@H]([NH+](C)C)CC1)OC ZINC000639106208 353621380 /nfs/dbraw/zinc/62/13/80/353621380.db2.gz XBUPFOKVWHUAPX-ZIAGYGMSSA-N 2 0 242.407 2.218 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]1[NH2+]CCCc1cccs1 ZINC000517731002 324176032 /nfs/dbraw/zinc/17/60/32/324176032.db2.gz YLTGVHBNWHRBSJ-RYUDHWBXSA-N 2 0 224.373 2.150 20 0 BEADRP C[NH+](C)C[C@H]1CC[N@H+](CCC2CCCC2)C1 ZINC000119998635 353693434 /nfs/dbraw/zinc/69/34/34/353693434.db2.gz ZILAIUPRSQHDGA-CQSZACIVSA-N 2 0 224.392 2.450 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@H+](C)CCC[NH+]1CCCC1 ZINC000343614023 353933724 /nfs/dbraw/zinc/93/37/24/353933724.db2.gz IPDSJZKCPKORNS-CHWSQXEVSA-N 2 0 210.365 2.060 20 0 BEADRP C[C@@H](CCc1ccccc1)[NH2+]C1CC[NH2+]CC1 ZINC000038040707 358481878 /nfs/dbraw/zinc/48/18/78/358481878.db2.gz OXLJIAUWRDGAGR-ZDUSSCGKSA-N 2 0 232.371 2.349 20 0 BEADRP CO[C@H](C[N@H+](C)CCC[NH+](C)C)C1CCCC1 ZINC000639167268 354050257 /nfs/dbraw/zinc/05/02/57/354050257.db2.gz CGAAXMGVNXCXBS-CQSZACIVSA-N 2 0 242.407 2.075 20 0 BEADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]C1CCC1 ZINC000344076601 354134240 /nfs/dbraw/zinc/13/42/40/354134240.db2.gz UYTARKQZTRRXEI-UHFFFAOYSA-N 2 0 242.326 2.218 20 0 BEADRP C[C@H](C[NH2+]C1CC(C)C1)C[NH+]1CCCC1 ZINC000231787573 363354009 /nfs/dbraw/zinc/35/40/09/363354009.db2.gz PZZWEOMDOOYIPO-OTTFEQOBSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]1CN(C)C[C@@H]1[NH2+]CC1=CCCCC1 ZINC000334654494 354448017 /nfs/dbraw/zinc/44/80/17/354448017.db2.gz VVJRHSQAPKLWBG-AAEUAGOBSA-N 2 0 208.349 2.027 20 0 BEADRP C(CC1CCCCC1)[NH2+]C[C@H]1CCC[NH2+]1 ZINC000232563587 363375798 /nfs/dbraw/zinc/37/57/98/363375798.db2.gz CRELUTOWZINROL-CYBMUJFWSA-N 2 0 210.365 2.298 20 0 BEADRP [NH3+]C1CCC([NH2+][C@@H]2CC[C@@H]2C2CCC2)CC1 ZINC000335135466 354784650 /nfs/dbraw/zinc/78/46/50/354784650.db2.gz HFRJLNZWFPDHEQ-NWINJMCUSA-N 2 0 222.376 2.425 20 0 BEADRP [NH3+]C1CCC([NH2+][C@H]2CC[C@H]2C2CCC2)CC1 ZINC000335135465 354784768 /nfs/dbraw/zinc/78/47/68/354784768.db2.gz HFRJLNZWFPDHEQ-HOAMVYINSA-N 2 0 222.376 2.425 20 0 BEADRP CCC[N@H+](C[C@H]1CC[NH2+][C@@H](C)C1)C1CC1 ZINC000233065268 363392615 /nfs/dbraw/zinc/39/26/15/363392615.db2.gz GPNZLNQFZJBTSS-RYUDHWBXSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H]([NH2+]CCC[NH3+])c1csc(Cl)c1 ZINC000235214987 363439778 /nfs/dbraw/zinc/43/97/78/363439778.db2.gz SGAZUWBFHCYDEA-SSDOTTSWSA-N 2 0 218.753 2.401 20 0 BEADRP CC(C)([NH3+])C[NH2+][C@@H]1Cc2ccc(Cl)cc2C1 ZINC000335174722 354941899 /nfs/dbraw/zinc/94/18/99/354941899.db2.gz CDCQMTSQIKFKDA-GFCCVEGCSA-N 2 0 238.762 2.134 20 0 BEADRP CCN1CCCC[C@@H]1C[NH2+][C@H](C)[C@@H]1CCCO1 ZINC000346566065 354970117 /nfs/dbraw/zinc/97/01/17/354970117.db2.gz RNAOYIOAIHMMGE-MCIONIFRSA-N 2 0 240.391 2.018 20 0 BEADRP Cc1noc(C)c1CN[C@H]1CCCCC[C@H]1[NH3+] ZINC000335192992 355025785 /nfs/dbraw/zinc/02/57/85/355025785.db2.gz HMRCPCJNTNPNTI-OLZOCXBDSA-N 2 0 237.347 2.041 20 0 BEADRP COc1ccccc1/C=C\CN1CCC[NH2+]CC1 ZINC000346691653 355074758 /nfs/dbraw/zinc/07/47/58/355074758.db2.gz WOTBLNZIEZTFGY-DAXSKMNVSA-N 2 0 246.354 2.004 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+]Cc1cccs1 ZINC000335219643 355059394 /nfs/dbraw/zinc/05/93/94/355059394.db2.gz UNCJWUNSANICJT-JQWIXIFHSA-N 2 0 224.373 2.226 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@H]2CCC[NH2+]C2)C[C@@H](C)C1 ZINC000346972751 355208510 /nfs/dbraw/zinc/20/85/10/355208510.db2.gz HXPYBTDNWFWDFX-RDBSUJKOSA-N 2 0 224.392 2.354 20 0 BEADRP C1CC1[C@@H]1CCCC[C@H]1[NH2+]C1CC[NH2+]CC1 ZINC000335253589 355210956 /nfs/dbraw/zinc/21/09/56/355210956.db2.gz YJCOYMSYPQORNK-UONOGXRCSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]1CC[C@@]2(CC[N@H+](C[C@H]3CCC[NH2+]C3)C2)C1 ZINC000347000067 355196750 /nfs/dbraw/zinc/19/67/50/355196750.db2.gz YKRJHKIOIJPCIJ-QLFBSQMISA-N 2 0 236.403 2.498 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCC[C@@H]1c1ccccc1OC ZINC000435876429 191329078 /nfs/dbraw/zinc/32/90/78/191329078.db2.gz IMROIHWTRCOFQV-CQSZACIVSA-N 2 0 248.370 2.442 20 0 BEADRP C[C@@H]([NH2+]CCCC[N@H+](C)C1CC1)[C@@H]1CC1(F)F ZINC000639245162 355240838 /nfs/dbraw/zinc/24/08/38/355240838.db2.gz STCMHMLOQKCQTF-PWSUYJOCSA-N 2 0 246.345 2.494 20 0 BEADRP CC[C@@H](C[N@@H+]1CC[C@H](C[NH+](CC)CC)C1)OC ZINC000412975994 191346829 /nfs/dbraw/zinc/34/68/29/191346829.db2.gz HGJZYKGIVSIXKD-KGLIPLIRSA-N 2 0 242.407 2.075 20 0 BEADRP CC[C@H](C[N@H+](C)[C@@H]1CC[NH+](CC)C[C@H]1C)OC ZINC000412978751 191348813 /nfs/dbraw/zinc/34/88/13/191348813.db2.gz RAENIUXGXWCRLM-MGPQQGTHSA-N 2 0 242.407 2.074 20 0 BEADRP C[N@@H+]1CCC[C@@H](CC[NH2+]C[C@@H]2C[C@H]3C[C@H]3C2)C1 ZINC000639256715 355300125 /nfs/dbraw/zinc/30/01/25/355300125.db2.gz DUJPVZQWXUBQDH-XQLPTFJDSA-N 2 0 236.403 2.354 20 0 BEADRP C[C@@H]([NH2+][C@H](c1cccs1)C1CC1)C1C[NH2+]C1 ZINC000422789717 192486906 /nfs/dbraw/zinc/48/69/06/192486906.db2.gz BMKXHOXDJRSPNV-RNCFNFMXSA-N 2 0 236.384 2.397 20 0 BEADRP CC[NH+](CC)CCOCC[NH2+][C@H]1CC[C@@H](C)C1 ZINC000349698008 355413488 /nfs/dbraw/zinc/41/34/88/355413488.db2.gz XGSLGOXABVLFBI-KGLIPLIRSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@H]1CC[C@H](C)[NH+]1C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000414716426 191556477 /nfs/dbraw/zinc/55/64/77/191556477.db2.gz XWIZKGBXHVGLFA-MROQNXINSA-N 2 0 210.365 2.247 20 0 BEADRP CC(C)(C)C[N@@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1 ZINC000414783759 191567759 /nfs/dbraw/zinc/56/77/59/191567759.db2.gz QMJOFFZZXNFTGM-STQMWFEESA-N 2 0 224.392 2.354 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@H]1CC[C@@H](C)C[C@H]1C ZINC000414790920 191568275 /nfs/dbraw/zinc/56/82/75/191568275.db2.gz HFGNSSUKQJAIGI-LPWJVIDDSA-N 2 0 212.381 2.384 20 0 BEADRP CC(C)C[C@@H](C)C[NH2+]C[C@H]([NH3+])C(C)C ZINC000414787387 191568981 /nfs/dbraw/zinc/56/89/81/191568981.db2.gz CHDIUZVQRPSAAR-NEPJUHHUSA-N 2 0 200.370 2.242 20 0 BEADRP Cc1ccc(C[NH2+]CC[C@H]2CC[NH2+]C2)cc1F ZINC000414830678 191591555 /nfs/dbraw/zinc/59/15/55/191591555.db2.gz MELHRHLHCNHPMN-GFCCVEGCSA-N 2 0 236.334 2.223 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@@H]1Cc2ccc(Cl)cc2C1 ZINC000414992848 191643620 /nfs/dbraw/zinc/64/36/20/191643620.db2.gz SCJRTMGRNRGKBO-QWHCGFSZSA-N 2 0 238.762 2.134 20 0 BEADRP COc1cccc(C[NH2+]C[C@@H]2CCC[C@@H]([NH3+])C2)c1 ZINC000415003494 191646311 /nfs/dbraw/zinc/64/63/11/191646311.db2.gz XICNRPCTZUFEDC-TZMCWYRMSA-N 2 0 248.370 2.302 20 0 BEADRP CC(C)(C)C[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000415010831 191649557 /nfs/dbraw/zinc/64/95/57/191649557.db2.gz PZIICKIRNXEBSE-NWDGAFQWSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]Cc1ncc(Cl)s1 ZINC000415017516 191651187 /nfs/dbraw/zinc/65/11/87/191651187.db2.gz SDOMFRSRXOZBPP-QMMMGPOBSA-N 2 0 247.795 2.404 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]C[C@H]1CCOc2ccccc21 ZINC000415024635 191655045 /nfs/dbraw/zinc/65/50/45/191655045.db2.gz PGZZWTHMFDZEIC-QWHCGFSZSA-N 2 0 248.370 2.270 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]Cc1ccc2ncccc2c1 ZINC000415023444 191655125 /nfs/dbraw/zinc/65/51/25/191655125.db2.gz MWBUDMBEZCYFOX-GFCCVEGCSA-N 2 0 243.354 2.452 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]Cc1ccc2ncccc2c1 ZINC000415023446 191655809 /nfs/dbraw/zinc/65/58/09/191655809.db2.gz MWBUDMBEZCYFOX-LBPRGKRZSA-N 2 0 243.354 2.452 20 0 BEADRP [NH3+]C1(C[NH2+][C@H]2CCC[C@@H]2C2CC2)CCC1 ZINC000414887752 191615604 /nfs/dbraw/zinc/61/56/04/191615604.db2.gz ZKEQJSVRANXWFS-NEPJUHHUSA-N 2 0 208.349 2.036 20 0 BEADRP CCc1cc(OC)ccc1C[NH2+]CCCC[NH3+] ZINC000414911866 191622551 /nfs/dbraw/zinc/62/25/51/191622551.db2.gz UBDPTBBNIFFQCC-UHFFFAOYSA-N 2 0 236.359 2.086 20 0 BEADRP CCC(CC)(CC)C[N@H+](C)CCC[NH3+] ZINC000395117050 355519480 /nfs/dbraw/zinc/51/94/80/355519480.db2.gz HJPZGCVMPHQBGC-UHFFFAOYSA-N 2 0 200.370 2.483 20 0 BEADRP C[C@@H](Cc1ccoc1)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000583545701 355521971 /nfs/dbraw/zinc/52/19/71/355521971.db2.gz LAYHAKNSZXFPJU-JSGCOSHPSA-N 2 0 236.359 2.142 20 0 BEADRP [NH3+]C[C@H]1CC[C@H]([NH2+]Cc2cccc(F)c2)C1 ZINC000415036914 191658522 /nfs/dbraw/zinc/65/85/22/191658522.db2.gz LUABHZOQQRXEGP-GWCFXTLKSA-N 2 0 222.307 2.043 20 0 BEADRP COc1cc(C[NH2+][C@H]2CC[C@@H](C[NH3+])C2)ccc1C ZINC000415048808 191661839 /nfs/dbraw/zinc/66/18/39/191661839.db2.gz XKCIKCZKMAMSCW-OCCSQVGLSA-N 2 0 248.370 2.221 20 0 BEADRP CC(C)[C@@H]1C[N@H+](C[C@@H]2CCC[NH2+]C2)CCS1 ZINC000335837722 355566399 /nfs/dbraw/zinc/56/63/99/355566399.db2.gz NYCBVLMCRPBMAQ-OLZOCXBDSA-N 2 0 242.432 2.059 20 0 BEADRP CC(C)[C@@H]1C[N@H+](C[C@H]2CCC[NH2+]C2)CCS1 ZINC000335837729 355566502 /nfs/dbraw/zinc/56/65/02/355566502.db2.gz NYCBVLMCRPBMAQ-STQMWFEESA-N 2 0 242.432 2.059 20 0 BEADRP C[C@@H]1C[C@@H](C[NH2+]CCc2cccs2)CC[NH2+]1 ZINC000415079994 191671755 /nfs/dbraw/zinc/67/17/55/191671755.db2.gz IZBBLDOJDQHLSG-NEPJUHHUSA-N 2 0 238.400 2.268 20 0 BEADRP CC[C@@](C)(C[NH2+]C[C@@H]1CCN1C(C)(C)C)OC ZINC000639302504 355647470 /nfs/dbraw/zinc/64/74/70/355647470.db2.gz GZPGYAIRESLXGW-JSGCOSHPSA-N 2 0 242.407 2.264 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]C[C@@H]2CC[C@H]3C[C@H]3C2)C1 ZINC000639312996 355684165 /nfs/dbraw/zinc/68/41/65/355684165.db2.gz PRMLDNALMIKHIN-QMIVOQANSA-N 2 0 236.403 2.352 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]C[C@@H]2CC[C@@H]3C[C@@H]3C2)C1 ZINC000639312998 355684411 /nfs/dbraw/zinc/68/44/11/355684411.db2.gz PRMLDNALMIKHIN-ZSAUSMIDSA-N 2 0 236.403 2.352 20 0 BEADRP CS[C@H]1CC[C@H]1[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000425350444 191818639 /nfs/dbraw/zinc/81/86/39/191818639.db2.gz LOHMZWWGUVLZGU-NEPJUHHUSA-N 2 0 242.432 2.202 20 0 BEADRP CS[C@@H]1CC[C@H]1[NH2+]CCC[NH+]1CCCCC1 ZINC000425363009 191822646 /nfs/dbraw/zinc/82/26/46/191822646.db2.gz WFKKQDPTYQOXTJ-CHWSQXEVSA-N 2 0 242.432 2.346 20 0 BEADRP Cc1cccc(C[N@H+]2C[C@H](C[NH3+])C[C@@H]2C)c1C ZINC000216010436 355795688 /nfs/dbraw/zinc/79/56/88/355795688.db2.gz USOJHFQEAMHYFS-JSGCOSHPSA-N 2 0 232.371 2.473 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@@H]2CCC[C@@H]2C)CC1 ZINC000084901964 355872024 /nfs/dbraw/zinc/87/20/24/355872024.db2.gz CFCZJTSLILIARJ-GXTWGEPZSA-N 2 0 224.392 2.497 20 0 BEADRP CCC1([NH+](C)C)CC[NH+](C[C@H]2C[C@H]2C)CC1 ZINC000639378187 355911525 /nfs/dbraw/zinc/91/15/25/355911525.db2.gz FAHVPWONPKWEMS-CHWSQXEVSA-N 2 0 224.392 2.449 20 0 BEADRP CCC1([NH+](C)C)CC[NH+](C[C@H](C)COC)CC1 ZINC000639378559 355912548 /nfs/dbraw/zinc/91/25/48/355912548.db2.gz IHUXBOLYKKLTIB-ZDUSSCGKSA-N 2 0 242.407 2.075 20 0 BEADRP C[C@H]1C[N@H+](CC[C@@H]2CCCC[NH+]2C)C[C@H]1C ZINC000351439998 355992578 /nfs/dbraw/zinc/99/25/78/355992578.db2.gz ZXBXCPQIAUTYLW-MJBXVCDLSA-N 2 0 224.392 2.449 20 0 BEADRP Cc1ccc(CC[N@@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@H]3C2)cc1 ZINC000351495958 356002652 /nfs/dbraw/zinc/00/26/52/356002652.db2.gz QISUVHKFVRAMGI-HRCADAONSA-N 2 0 244.382 2.207 20 0 BEADRP C[C@H](F)CC[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C)C1 ZINC000351882133 356120325 /nfs/dbraw/zinc/12/03/25/356120325.db2.gz PAWWWSODHUGBPX-RWMBFGLXSA-N 2 0 228.355 2.151 20 0 BEADRP Cc1ccc(CC[N@H+]2CC[C@@H]([C@H](C)[NH3+])C2)cc1 ZINC000351861977 356099087 /nfs/dbraw/zinc/09/90/87/356099087.db2.gz MRYFCJPGDDJQNY-DZGCQCFKSA-N 2 0 232.371 2.207 20 0 BEADRP CCc1ccc(CC[N@@H+]2CC[C@@H]([C@@H](C)[NH3+])C2)cc1 ZINC000351861575 356099451 /nfs/dbraw/zinc/09/94/51/356099451.db2.gz KRIDWAGZXOIVOM-CZUORRHYSA-N 2 0 246.398 2.461 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH+](C)CCCCF)[C@@H](C)C1 ZINC000351866491 356102746 /nfs/dbraw/zinc/10/27/46/356102746.db2.gz XDHSWVOCAXCIEJ-STQMWFEESA-N 2 0 230.371 2.398 20 0 BEADRP COc1cccc2c1CC[C@H]2[NH2+][C@@H](C)CCC[NH3+] ZINC000422887168 192498205 /nfs/dbraw/zinc/49/82/05/192498205.db2.gz KENNDBHBIFBXAD-SMDDNHRTSA-N 2 0 248.370 2.400 20 0 BEADRP CCC[C@@H]1CCC[N@H+](CC[C@@H]2CC[NH2+]C2)C1 ZINC000420297082 192204893 /nfs/dbraw/zinc/20/48/93/192204893.db2.gz FINZSZGNUHZINE-UONOGXRCSA-N 2 0 224.392 2.498 20 0 BEADRP CSc1ccccc1C[N@@H+]1CC[C@H](C[NH3+])C1 ZINC000420298773 192205764 /nfs/dbraw/zinc/20/57/64/192205764.db2.gz SQIGIBOHHQRACH-LLVKDONJSA-N 2 0 236.384 2.189 20 0 BEADRP CC[C@H](C)[N@@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1 ZINC000420330939 192214255 /nfs/dbraw/zinc/21/42/55/192214255.db2.gz QIJUWGRVSDWWHN-AVGNSLFASA-N 2 0 210.365 2.106 20 0 BEADRP FCCCCC[N@@H+]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC000420353211 192216933 /nfs/dbraw/zinc/21/69/33/192216933.db2.gz AWIPWJCWBVNYKN-ZDUSSCGKSA-N 2 0 228.355 2.202 20 0 BEADRP CCc1cccc(C[N@@H+]2CC[C@](C)(C[NH3+])C2)c1 ZINC000420307793 192209297 /nfs/dbraw/zinc/20/92/97/192209297.db2.gz CLLGXNGOGBVXLF-OAHLLOKOSA-N 2 0 232.371 2.420 20 0 BEADRP C(C[N@@H+]1CCC[C@H]1C1CCC1)[C@H]1CC[NH2+]C1 ZINC000420306640 192209590 /nfs/dbraw/zinc/20/95/90/192209590.db2.gz QREMSUZPLMMJRH-OCCSQVGLSA-N 2 0 222.376 2.251 20 0 BEADRP C[N@H+](CCCc1ccncc1)[C@H]1CCC[NH2+]CC1 ZINC000420305029 192209744 /nfs/dbraw/zinc/20/97/44/192209744.db2.gz FTQKTLGMZMGRSD-HNNXBMFYSA-N 2 0 247.386 2.088 20 0 BEADRP CCc1cccc(C[N@@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@@H]3C2)c1 ZINC000420311388 192211368 /nfs/dbraw/zinc/21/13/68/192211368.db2.gz RBDVXMNDVUEMCZ-ARFHVFGLSA-N 2 0 244.382 2.418 20 0 BEADRP CCc1cccc(C[N@@H+]2C[C@H](C[NH3+])C[C@@H]2C)c1 ZINC000420317232 192212255 /nfs/dbraw/zinc/21/22/55/192212255.db2.gz MRSUGQPYIOETSF-WFASDCNBSA-N 2 0 232.371 2.418 20 0 BEADRP CCc1cccc(C[N@@H+]2C[C@@H](C[NH3+])C[C@H]2C)c1 ZINC000420317224 192212259 /nfs/dbraw/zinc/21/22/59/192212259.db2.gz MRSUGQPYIOETSF-IUODEOHRSA-N 2 0 232.371 2.418 20 0 BEADRP c1ccc(C[N@@H+](CC[C@@H]2CC[NH2+]C2)C2CC2)nc1 ZINC000420370798 192227439 /nfs/dbraw/zinc/22/74/39/192227439.db2.gz ZEOHVOXRPRNUCI-ZDUSSCGKSA-N 2 0 245.370 2.046 20 0 BEADRP C[C@@H]1OCC[C@@H]1C[N@@H+]1CCC[C@@H](c2ncc[nH]2)C1 ZINC000639532162 356381755 /nfs/dbraw/zinc/38/17/55/356381755.db2.gz BIMFKAYCJCBTOX-YNEHKIRRSA-N 2 0 249.358 2.014 20 0 BEADRP c1cncc([C@@H]2CCC[N@H+]2CC[C@H]2CC[NH2+]C2)c1 ZINC000420354794 192220884 /nfs/dbraw/zinc/22/08/84/192220884.db2.gz DKELWUYPNHISHL-HIFRSBDPSA-N 2 0 245.370 2.218 20 0 BEADRP C[C@@H]([NH2+]CCC1CC[NH2+]CC1)c1cccnc1 ZINC000420363139 192223418 /nfs/dbraw/zinc/22/34/18/192223418.db2.gz BFNGSRDAZYNQDN-GFCCVEGCSA-N 2 0 233.359 2.122 20 0 BEADRP CC(C)[C@H]([NH2+]C[C@H](C)[NH3+])c1ccccc1 ZINC000420382890 192235411 /nfs/dbraw/zinc/23/54/11/192235411.db2.gz YYYQCQXHWOLZLA-AAEUAGOBSA-N 2 0 206.333 2.321 20 0 BEADRP CC[C@@H]1CCC[C@H]1[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000420403570 192238356 /nfs/dbraw/zinc/23/83/56/192238356.db2.gz LDXNZPQPCIIMHZ-YNEHKIRRSA-N 2 0 210.365 2.154 20 0 BEADRP Cc1cccc([C@H](C)[NH2+]CCC[NH3+])c1C ZINC000420419144 192240360 /nfs/dbraw/zinc/24/03/60/192240360.db2.gz XGDFJHVXJTXPKE-LBPRGKRZSA-N 2 0 206.333 2.303 20 0 BEADRP CCc1cc(NC2CCC([NH+](C)C)CC2)cc[nH+]1 ZINC000420627951 192251883 /nfs/dbraw/zinc/25/18/83/192251883.db2.gz OFZLUEUFAMDZMP-UHFFFAOYSA-N 2 0 247.386 2.351 20 0 BEADRP [NH3+]C1CCC([NH2+][C@@H]2CCC[C@H]2C2CC2)CC1 ZINC000336165707 134113036 /nfs/dbraw/zinc/11/30/36/134113036.db2.gz VGASIBRIFFOXQS-CLRIEMFWSA-N 2 0 222.376 2.425 20 0 BEADRP CO[C@H](C)C[N@H+](C)Cc1c(C)cc(C)nc1C ZINC000639644338 356557988 /nfs/dbraw/zinc/55/79/88/356557988.db2.gz PYFSAWYOSSYTOG-GFCCVEGCSA-N 2 0 236.359 2.474 20 0 BEADRP CC[C@H]([NH2+][C@H](C)C[C@@H]1CCCO1)[C@@H]1CCC[NH2+]1 ZINC000422906994 192503376 /nfs/dbraw/zinc/50/33/76/192503376.db2.gz WCLMIDOJRUFDLB-RFGFWPKPSA-N 2 0 240.391 2.064 20 0 BEADRP CCCC(O)(CCC)C[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000422976186 192514790 /nfs/dbraw/zinc/51/47/90/192514790.db2.gz HZQNJSFXLHQVEV-RYUDHWBXSA-N 2 0 230.396 2.033 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H]1CCc2c1cccc2O ZINC000422979133 192515973 /nfs/dbraw/zinc/51/59/73/192515973.db2.gz LJHJUUUCGLCREL-MFKMUULPSA-N 2 0 234.343 2.097 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]C[C@@H](C)Oc1ccccc1 ZINC000422981073 192516289 /nfs/dbraw/zinc/51/62/89/192516289.db2.gz NCNHMRNSTMPCDJ-CHWSQXEVSA-N 2 0 236.359 2.171 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+][C@H]1C[C@H]1Cc1ccccc1 ZINC000422921151 192507910 /nfs/dbraw/zinc/50/79/10/192507910.db2.gz NMHOFHDEWHDCIZ-KBXIAJHMSA-N 2 0 230.355 2.087 20 0 BEADRP CC(C)(CCCO)C[NH2+][C@H]1CCCCC[C@H]1[NH3+] ZINC000422992009 192520484 /nfs/dbraw/zinc/52/04/84/192520484.db2.gz PLGBLVXQBKMBBG-OLZOCXBDSA-N 2 0 242.407 2.035 20 0 BEADRP CS[C@H](C[NH2+][C@H]1CCC[C@@H]1C[NH3+])C(C)(C)C ZINC000423038978 192547740 /nfs/dbraw/zinc/54/77/40/192547740.db2.gz ZKLSFPRWHKQNJU-GRYCIOLGSA-N 2 0 244.448 2.481 20 0 BEADRP CC(C)OCCCC[NH2+][C@@H]1CCCCC[C@H]1[NH3+] ZINC000423036397 192548672 /nfs/dbraw/zinc/54/86/72/192548672.db2.gz TYSYJHMCNSBAGF-ZIAGYGMSSA-N 2 0 242.407 2.441 20 0 BEADRP CCc1cc(NC[C@@H](C)[NH+](CC)CC)cc[nH+]1 ZINC000450252110 202109334 /nfs/dbraw/zinc/10/93/34/202109334.db2.gz XLUQWMQJZCEIPG-GFCCVEGCSA-N 2 0 235.375 2.208 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@H]1CCC12CCCC2 ZINC000423077822 192561176 /nfs/dbraw/zinc/56/11/76/192561176.db2.gz URYXGSABJVWXEI-SRVKXCTJSA-N 2 0 210.365 2.425 20 0 BEADRP COC1CCC(C)(C[NH2+][C@H]2CCC[C@@H]2[NH3+])CC1 ZINC000423086999 192564033 /nfs/dbraw/zinc/56/40/33/192564033.db2.gz ONHPWSZRAWHEQK-QPPOZKHWSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]CCc1ccc2[nH]ccc2c1 ZINC000423098373 192566962 /nfs/dbraw/zinc/56/69/62/192566962.db2.gz KSKIISFMUQYODF-LBPRGKRZSA-N 2 0 245.370 2.427 20 0 BEADRP C[NH+]1CCC2(CC[N@@H+](C3CCCC3)C2)CC1 ZINC000639757202 356663788 /nfs/dbraw/zinc/66/37/88/356663788.db2.gz IQEHNCQVAAKCOW-UHFFFAOYSA-N 2 0 222.376 2.347 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CCc1ccc2[nH]ccc2c1 ZINC000423109805 192572159 /nfs/dbraw/zinc/57/21/59/192572159.db2.gz UZBWRDWZCJNXPJ-RYUDHWBXSA-N 2 0 245.370 2.426 20 0 BEADRP C[NH+]1CCC2(CC[N@H+](CCC3CC3)C2)CC1 ZINC000639754534 356656446 /nfs/dbraw/zinc/65/64/46/356656446.db2.gz BYLDDMPJRNHYHQ-UHFFFAOYSA-N 2 0 222.376 2.204 20 0 BEADRP Clc1ccc(CN2C[C@@H]3C[NH2+]C[C@H]3C2)s1 ZINC000088287668 356657027 /nfs/dbraw/zinc/65/70/27/356657027.db2.gz LYKCSJCXZRYQDU-IUCAKERBSA-N 2 0 242.775 2.053 20 0 BEADRP Clc1ccc(CN2C[C@H]3C[NH2+]C[C@@H]3C2)s1 ZINC000088287664 356657156 /nfs/dbraw/zinc/65/71/56/356657156.db2.gz LYKCSJCXZRYQDU-RKDXNWHRSA-N 2 0 242.775 2.053 20 0 BEADRP COCC[C@H]([NH2+][C@@H](C)CCC[NH3+])C(C)(C)C ZINC000423117681 192574000 /nfs/dbraw/zinc/57/40/00/192574000.db2.gz WPWYCVURVCPYEP-RYUDHWBXSA-N 2 0 230.396 2.155 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]CCCc1ccccc1F ZINC000423093177 192565825 /nfs/dbraw/zinc/56/58/25/192565825.db2.gz GFZPHJZHLQVCKG-LBPRGKRZSA-N 2 0 238.350 2.475 20 0 BEADRP C[C@@H]1CC[N@H+](CCc2ccccc2)C[C@@H]1C[NH3+] ZINC000167770713 134153654 /nfs/dbraw/zinc/15/36/54/134153654.db2.gz OYSUCDPVLWUZII-HIFRSBDPSA-N 2 0 232.371 2.146 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CCCCF ZINC000423139474 192582903 /nfs/dbraw/zinc/58/29/03/192582903.db2.gz KVOUWFBOBZYXAB-JTQLQIEISA-N 2 0 239.338 2.249 20 0 BEADRP C([NH2+]CC1CCCCCC1)[C@@H]1CCC[NH2+]1 ZINC000389491879 356693529 /nfs/dbraw/zinc/69/35/29/356693529.db2.gz SOVNKPINPKOWBH-ZDUSSCGKSA-N 2 0 210.365 2.298 20 0 BEADRP CCOCCCC[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000166221850 538616795 /nfs/dbraw/zinc/61/67/95/538616795.db2.gz SFEZTFSMGHFBTK-UONOGXRCSA-N 2 0 240.391 2.020 20 0 BEADRP CCC(=O)CCC[N@H+](C)[C@@H]1CCN(C)[C@H](C)C1 ZINC000450467071 202174589 /nfs/dbraw/zinc/17/45/89/202174589.db2.gz KHULMFFBGCUZJR-CHWSQXEVSA-N 2 0 240.391 2.160 20 0 BEADRP CCO[C@@H]1CCC[C@H]1[NH2+][C@@H](C)CCCC[NH3+] ZINC000423157856 192595054 /nfs/dbraw/zinc/59/50/54/192595054.db2.gz BRKRWAJERQVDLT-YNEHKIRRSA-N 2 0 228.380 2.051 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CCC[C@H]1C1CC1 ZINC000423172220 192607460 /nfs/dbraw/zinc/60/74/60/192607460.db2.gz RVRBRHBJDBDUAR-FQUUOJAGSA-N 2 0 222.376 2.282 20 0 BEADRP CC1(C)C[C@H]([NH2+]CCC[NH3+])c2ccccc21 ZINC000423175069 192608311 /nfs/dbraw/zinc/60/83/11/192608311.db2.gz CTSJGONPHKGKMM-ZDUSSCGKSA-N 2 0 218.344 2.347 20 0 BEADRP C[C@@H]([NH2+]CCCC[NH+](C)C)[C@@H]1C[C@H]1C1CC1 ZINC000623383481 356907368 /nfs/dbraw/zinc/90/73/68/356907368.db2.gz WLWJUZTTWLOTMA-XBFCOCLRSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@H](C)[C@@H]1C[C@H]1C1CC1 ZINC000623384175 356909136 /nfs/dbraw/zinc/90/91/36/356909136.db2.gz REESCWCYGZPNFA-RFHZTLPTSA-N 2 0 224.392 2.351 20 0 BEADRP COCCCCC[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623385282 356910988 /nfs/dbraw/zinc/91/09/88/356910988.db2.gz AJQFGDQIWKFENM-CYBMUJFWSA-N 2 0 242.407 2.266 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+][C@H](C)[C@H]1CCC[NH2+]C1 ZINC000423210432 192628670 /nfs/dbraw/zinc/62/86/70/192628670.db2.gz GHASCPWWXBKDCY-RFGFWPKPSA-N 2 0 224.392 2.399 20 0 BEADRP Fc1ccc2c(c1)[C@H]([NH2+]CC[C@@H]1CC[NH2+]C1)CC2 ZINC000423241150 192646860 /nfs/dbraw/zinc/64/68/60/192646860.db2.gz DEUKGHDMGRYJJC-XHDPSFHLSA-N 2 0 248.345 2.402 20 0 BEADRP C[C@@H]1CCN(CC[NH2+][C@H]2CCCC2(C)C)C1 ZINC000390653471 357109177 /nfs/dbraw/zinc/10/91/77/357109177.db2.gz PYQHRUVJOAUKKR-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CCN(CC[NH2+][C@@H]2CCCC2(C)C)C1 ZINC000390653468 357109189 /nfs/dbraw/zinc/10/91/89/357109189.db2.gz PYQHRUVJOAUKKR-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP CCC[C@H](C)C[NH2+]CCN1CC[C@@H](C)C1 ZINC000389904834 357065047 /nfs/dbraw/zinc/06/50/47/357065047.db2.gz GFIMNPBGDKSXFU-QWHCGFSZSA-N 2 0 212.381 2.354 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000389985077 357079245 /nfs/dbraw/zinc/07/92/45/357079245.db2.gz LQOQQENCGBIGTI-XQQFMLRXSA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000389985074 357079432 /nfs/dbraw/zinc/07/94/32/357079432.db2.gz LQOQQENCGBIGTI-JHJVBQTASA-N 2 0 210.365 2.106 20 0 BEADRP COCC[C@@H]1CCC[C@H]1[NH2+]C1CCC([NH3+])CC1 ZINC000423233791 192643400 /nfs/dbraw/zinc/64/34/00/192643400.db2.gz OTZJWHLFTAECHE-GFJIZPEISA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1ccc(F)cc1 ZINC000423254483 192655275 /nfs/dbraw/zinc/65/52/75/192655275.db2.gz YEDLXQUPHUOGNP-VXGBXAGGSA-N 2 0 236.334 2.476 20 0 BEADRP Fc1ccc2c(c1)CC[C@@H]2[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000423249260 192652244 /nfs/dbraw/zinc/65/22/44/192652244.db2.gz OITSFVJRALOYFC-NHYWBVRUSA-N 2 0 248.345 2.402 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@H]([NH2+]CC[C@H]2CC[NH2+]C2)C1 ZINC000423252073 192653295 /nfs/dbraw/zinc/65/32/95/192653295.db2.gz TULHNNKOBXLWIT-XJFOESAGSA-N 2 0 224.392 2.400 20 0 BEADRP CC(C)C[C@H](C[NH3+])N[C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000423264672 192660414 /nfs/dbraw/zinc/66/04/14/192660414.db2.gz QAJGXMMLCKGGRJ-KCPJHIHWSA-N 2 0 247.386 2.094 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]C1[C@@H](C)CCC[C@@H]1C ZINC000423269138 192662604 /nfs/dbraw/zinc/66/26/04/192662604.db2.gz GSHSMNARHZMQGW-SRVKXCTJSA-N 2 0 212.381 2.256 20 0 BEADRP C[N@@H+]1CCCC[C@H](C[NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)C1 ZINC000628425707 357253391 /nfs/dbraw/zinc/25/33/91/357253391.db2.gz SNBGIOCXBXMITM-APIJFGDWSA-N 2 0 236.403 2.497 20 0 BEADRP CC(C)[N@@H+]1CC[C@H](C[NH2+][C@H](C)C2CCC2)C1 ZINC000381465731 357264273 /nfs/dbraw/zinc/26/42/73/357264273.db2.gz LDDZZYCVWBMIAG-CHWSQXEVSA-N 2 0 224.392 2.495 20 0 BEADRP C(C[C@@H]1CCC[NH2+]C1)[NH2+][C@H]1CCC12CCC2 ZINC000423285075 192677519 /nfs/dbraw/zinc/67/75/19/192677519.db2.gz ZGDLNYKPMUHUCZ-STQMWFEESA-N 2 0 222.376 2.298 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H]1C[C@H](C)c2ccccc21 ZINC000423299618 192688532 /nfs/dbraw/zinc/68/85/32/192688532.db2.gz CCRWVTQJACDXOC-SUNKGSAMSA-N 2 0 218.344 2.419 20 0 BEADRP CCOC[C@H]1CCC[C@H]1[NH2+]CCC[NH2+]C(C)C ZINC000582899113 357425287 /nfs/dbraw/zinc/42/52/87/357425287.db2.gz YQPPILHVGODZGU-ZIAGYGMSSA-N 2 0 242.407 2.169 20 0 BEADRP C[C@@H]([NH2+]CCCC1CC1)[C@H]1CCCC[NH2+]1 ZINC000395242879 357429322 /nfs/dbraw/zinc/42/93/22/357429322.db2.gz RCZHWKDCNVBHNX-DGCLKSJQSA-N 2 0 210.365 2.297 20 0 BEADRP Cc1ccsc1CC[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000582915656 357436563 /nfs/dbraw/zinc/43/65/63/357436563.db2.gz IJSIHIILWSZDFG-RYUDHWBXSA-N 2 0 238.400 2.459 20 0 BEADRP C([NH2+][C@@H]1CCCC12CCC2)C1CC[NH2+]CC1 ZINC000582958445 357437919 /nfs/dbraw/zinc/43/79/19/357437919.db2.gz CNGMNQFTMIABRC-CYBMUJFWSA-N 2 0 222.376 2.298 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCC[C@H]([NH3+])C1)CC(F)(F)F ZINC000396919797 357486725 /nfs/dbraw/zinc/48/67/25/357486725.db2.gz XUPDRWOPZDZLRH-GUBZILKMSA-N 2 0 238.297 2.434 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCC[C@@H]([NH3+])C1)CC(F)(F)F ZINC000396919795 357486935 /nfs/dbraw/zinc/48/69/35/357486935.db2.gz XUPDRWOPZDZLRH-AEJSXWLSSA-N 2 0 238.297 2.434 20 0 BEADRP Cc1cc(C)c(C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)cn1 ZINC000396976194 357487961 /nfs/dbraw/zinc/48/79/61/357487961.db2.gz KIGTZSXIGROPKK-ZIAGYGMSSA-N 2 0 233.359 2.058 20 0 BEADRP CCC[C@@]1([NH2+]CCc2ccncc2C)CCOC1 ZINC000397542527 357573967 /nfs/dbraw/zinc/57/39/67/357573967.db2.gz YFGDQBWHBIJHPU-OAHLLOKOSA-N 2 0 248.370 2.481 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]CCC(F)(F)F ZINC000063099445 357525516 /nfs/dbraw/zinc/52/55/16/357525516.db2.gz SFDKIKCLOXLEAA-KXUCPTDWSA-N 2 0 238.297 2.257 20 0 BEADRP C[C@@H]1CCC[C@@H]1C[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000230656969 357545090 /nfs/dbraw/zinc/54/50/90/357545090.db2.gz YBPNIFVWULNFES-XJFOESAGSA-N 2 0 224.392 2.495 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@@H]2CCC[C@@H]2C)CC1 ZINC000230657347 357545753 /nfs/dbraw/zinc/54/57/53/357545753.db2.gz LNAYWQQDHULVMG-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP CCOC(C)(C)C[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000159178032 538875213 /nfs/dbraw/zinc/87/52/13/538875213.db2.gz YCFFJIIYKLIPTE-LBPRGKRZSA-N 2 0 242.407 2.121 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+]C1CCC(C)(C)CC1 ZINC000234776560 357828224 /nfs/dbraw/zinc/82/82/24/357828224.db2.gz BHEBUWROPZGKHH-ZDUSSCGKSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@H]([NH2+]CCCC[NH3+])c1cccc(F)c1F ZINC000235513363 357874432 /nfs/dbraw/zinc/87/44/32/357874432.db2.gz ALPGLMSRKMEZPN-VIFPVBQESA-N 2 0 228.286 2.354 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]C[C@@H]2C[C@H]2C2CCC2)C1 ZINC000584479863 357996666 /nfs/dbraw/zinc/99/66/66/357996666.db2.gz KAGOQDYEWBIYRC-FQUUOJAGSA-N 2 0 222.376 2.282 20 0 BEADRP COCc1ccc(C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)cc1 ZINC000584517358 358028903 /nfs/dbraw/zinc/02/89/03/358028903.db2.gz VXYYTBQSEBVEFX-CABCVRRESA-N 2 0 248.370 2.193 20 0 BEADRP C(C[N@H+](C1CC1)C1CCCC1)[C@H]1CC[NH2+]C1 ZINC000584520220 358029643 /nfs/dbraw/zinc/02/96/43/358029643.db2.gz KDMRYOKDEVQDLF-GFCCVEGCSA-N 2 0 222.376 2.393 20 0 BEADRP C[C@H]([NH2+]CC1=CC[N@H+](C)CC1)C1(C)CC1 ZINC000336762971 491119534 /nfs/dbraw/zinc/11/95/34/491119534.db2.gz ONSGARBCBUNADC-NSHDSACASA-N 2 0 208.349 2.027 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+]C2CCC2)c2ccccc21 ZINC000169240553 134250011 /nfs/dbraw/zinc/25/00/11/134250011.db2.gz SBLAUDULRUUGNC-QWHCGFSZSA-N 2 0 202.301 2.273 20 0 BEADRP [NH3+]Cc1ccccc1OCCC[NH+]1CCCCC1 ZINC000037049934 358065271 /nfs/dbraw/zinc/06/52/71/358065271.db2.gz BKTPKSBHCYPRNC-UHFFFAOYSA-N 2 0 248.370 2.400 20 0 BEADRP c1cc(CC[NH2+][C@@H]2CCC[NH2+]CC2)cs1 ZINC000168737065 134248069 /nfs/dbraw/zinc/24/80/69/134248069.db2.gz PRHXSLGVSFULGJ-GFCCVEGCSA-N 2 0 224.373 2.022 20 0 BEADRP CCC1([NH+](C)C)CC[NH+]([C@H](C)CCOC)CC1 ZINC000640017302 358080565 /nfs/dbraw/zinc/08/05/65/358080565.db2.gz LVHGTJMICKNWTA-CYBMUJFWSA-N 2 0 242.407 2.218 20 0 BEADRP CC(C)C[C@@H]1C[C@H]1[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000583882364 358117100 /nfs/dbraw/zinc/11/71/00/358117100.db2.gz DLJQDDXYFLUMFU-FVCCEPFGSA-N 2 0 210.365 2.281 20 0 BEADRP CC(C)C[NH+]1CCC([NH2+]CC2(C)CC2)CC1 ZINC000223814631 358227210 /nfs/dbraw/zinc/22/72/10/358227210.db2.gz QRYPYUGCDFGZJL-UHFFFAOYSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)OCCCC[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000224969717 358242091 /nfs/dbraw/zinc/24/20/91/358242091.db2.gz KUSBPPIWHCNXCD-OLZOCXBDSA-N 2 0 228.380 2.051 20 0 BEADRP C[C@@H](Cc1ccc(F)cc1)[NH2+]CCC[NH+](C)C ZINC000151935186 491128351 /nfs/dbraw/zinc/12/83/51/491128351.db2.gz QLIKXJQPIIOPEO-LBPRGKRZSA-N 2 0 238.350 2.298 20 0 BEADRP C[C@H](c1ccc(F)cc1)[N@@H+]1CC[C@@H](C[NH3+])C1 ZINC000219098196 134273655 /nfs/dbraw/zinc/27/36/55/134273655.db2.gz FGFOVDQKNMJXSB-MNOVXSKESA-N 2 0 222.307 2.167 20 0 BEADRP CC(C)[N@@H+]1CC[C@H](C[NH2+][C@@H]2CC[C@@H](C)C2)C1 ZINC000227200139 358350562 /nfs/dbraw/zinc/35/05/62/358350562.db2.gz ALEZIGMLRIHGLW-MGPQQGTHSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]([N@H+](C)CC1CC[NH2+]CC1)C(C)(C)C ZINC000042781588 358358854 /nfs/dbraw/zinc/35/88/54/358358854.db2.gz QCLXCKZQVKZXSR-LLVKDONJSA-N 2 0 212.381 2.352 20 0 BEADRP C[N@H+](CCC[NH3+])Cc1ccc(C(F)(F)F)cc1 ZINC000044426572 358408471 /nfs/dbraw/zinc/40/84/71/358408471.db2.gz KTDSUXHFCXJUET-UHFFFAOYSA-N 2 0 246.276 2.486 20 0 BEADRP CC[C@@H](C)C[NH2+]CC1CC[NH+](CC)CC1 ZINC000044517646 358388769 /nfs/dbraw/zinc/38/87/69/358388769.db2.gz NKCJDILQKBYHRP-GFCCVEGCSA-N 2 0 212.381 2.354 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@H](C)c2ccccn2)CC1 ZINC000044517425 358388802 /nfs/dbraw/zinc/38/88/02/358388802.db2.gz TVYZFDAMCFSEPY-CYBMUJFWSA-N 2 0 247.386 2.464 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH2+]C[C@H]2CC=CCC2)C1 ZINC000044534330 358389463 /nfs/dbraw/zinc/38/94/63/358389463.db2.gz XXCWCGMKENUIFH-KBPBESRZSA-N 2 0 222.376 2.274 20 0 BEADRP COc1ccccc1CC[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000230285255 358396788 /nfs/dbraw/zinc/39/67/88/358396788.db2.gz BCBHWHHXBKJTFL-ZIAGYGMSSA-N 2 0 248.370 2.097 20 0 BEADRP CCCCOCCC[NH2+]C1CC[NH+](CC)CC1 ZINC000130645069 358638456 /nfs/dbraw/zinc/63/84/56/358638456.db2.gz KFELXINYSGOODI-UHFFFAOYSA-N 2 0 242.407 2.267 20 0 BEADRP CC[NH+](CC)CCC[NH2+]C1CCC(OC)CC1 ZINC000129820355 358599220 /nfs/dbraw/zinc/59/92/20/358599220.db2.gz ARKDGMITUPTASJ-UHFFFAOYSA-N 2 0 242.407 2.266 20 0 BEADRP COC[C@H](C)[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000131978150 358702793 /nfs/dbraw/zinc/70/27/93/358702793.db2.gz AIPPANKBBDAJKT-LBPRGKRZSA-N 2 0 240.391 2.018 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000132078889 358705853 /nfs/dbraw/zinc/70/58/53/358705853.db2.gz XHIBOUBAEPTLBU-CABCVRRESA-N 2 0 247.386 2.063 20 0 BEADRP C(C1CC[NH2+]CC1)[N@@H+]1CC[C@@H]2CCCC[C@@H]21 ZINC000133880519 358771354 /nfs/dbraw/zinc/77/13/54/358771354.db2.gz FNFGSTXIJQXMSY-KBPBESRZSA-N 2 0 222.376 2.251 20 0 BEADRP FCCC[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000133773917 358767276 /nfs/dbraw/zinc/76/72/76/358767276.db2.gz LRHXNOIBNDIKER-ZDUSSCGKSA-N 2 0 228.355 2.154 20 0 BEADRP C[C@H](CC1CC1)[NH2+][C@H]1CCN2CCCC[C@H]12 ZINC000132402714 358721781 /nfs/dbraw/zinc/72/17/81/358721781.db2.gz SIYXPCRGCOCYCW-KWCYVHTRSA-N 2 0 222.376 2.391 20 0 BEADRP COC[C@H]([NH2+][C@H]1CC[N@H+](C)C(C)(C)C1)C(C)C ZINC000623430569 358820083 /nfs/dbraw/zinc/82/00/83/358820083.db2.gz YAQGOOJZSDECMI-STQMWFEESA-N 2 0 242.407 2.120 20 0 BEADRP COC[C@@H]([NH2+][C@H]1CC[N@H+](C)C(C)(C)C1)C(C)C ZINC000623430568 358820387 /nfs/dbraw/zinc/82/03/87/358820387.db2.gz YAQGOOJZSDECMI-QWHCGFSZSA-N 2 0 242.407 2.120 20 0 BEADRP CCCC[N@H+](C)CC1CC[NH+](CCOC)CC1 ZINC000052208981 358776590 /nfs/dbraw/zinc/77/65/90/358776590.db2.gz XPNHKPVPXJWUBL-UHFFFAOYSA-N 2 0 242.407 2.077 20 0 BEADRP CCC[C@H](O)C[NH2+][C@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000134363910 358787838 /nfs/dbraw/zinc/78/78/38/358787838.db2.gz BAPHXZMXAWXCAQ-RDBSUJKOSA-N 2 0 242.407 2.048 20 0 BEADRP CCCOc1cccc(C[NH2+][C@@H](C)CC[NH3+])c1 ZINC000136133130 358865322 /nfs/dbraw/zinc/86/53/22/358865322.db2.gz HSCCLXSNVSMCDB-LBPRGKRZSA-N 2 0 236.359 2.302 20 0 BEADRP CC(C)C[C@H](C)C[C@@H](C)[NH2+]CC1C[NH2+]C1 ZINC000423308748 192695303 /nfs/dbraw/zinc/69/53/03/192695303.db2.gz YGFAEYZJSZHEQQ-NWDGAFQWSA-N 2 0 212.381 2.256 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCC[C@H]([NH3+])C1)C1CCCC1 ZINC000086404361 358968256 /nfs/dbraw/zinc/96/82/56/358968256.db2.gz SMPRYMGHYAGJJI-KGYLQXTDSA-N 2 0 210.365 2.425 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H]2CCO[C@@H](C)C2)CC1 ZINC000070347250 359050212 /nfs/dbraw/zinc/05/02/12/359050212.db2.gz HSPSEYKEAZKTQS-GXTWGEPZSA-N 2 0 240.391 2.018 20 0 BEADRP CCC[C@H]([NH2+]C[C@@H]1CC[NH2+]C1)C(C)(C)C ZINC000423330724 192712032 /nfs/dbraw/zinc/71/20/32/192712032.db2.gz GBVQJSJGBLFEDY-NEPJUHHUSA-N 2 0 212.381 2.400 20 0 BEADRP FC(F)C1CCC([NH2+]CC2=CC[NH2+]CC2)CC1 ZINC000423343643 192720165 /nfs/dbraw/zinc/72/01/65/192720165.db2.gz DTKPMYZEFHHEQR-UHFFFAOYSA-N 2 0 244.329 2.320 20 0 BEADRP FCCC[C@H]1CCC[C@H]1[NH2+]CC1=CC[NH2+]CC1 ZINC000423352888 192726157 /nfs/dbraw/zinc/72/61/57/192726157.db2.gz KYQMHFZWJCWOSC-ZIAGYGMSSA-N 2 0 240.366 2.414 20 0 BEADRP CCCCOCC[NH2+][C@@H]1CC[N@H+](CC)C[C@H]1C ZINC000247102393 359193997 /nfs/dbraw/zinc/19/39/97/359193997.db2.gz SLKJOVXCXFVEHJ-ZIAGYGMSSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+]CC1CCSCC1 ZINC000308885917 491139720 /nfs/dbraw/zinc/13/97/20/491139720.db2.gz VWMJLKXBLKKHSW-NSHDSACASA-N 2 0 230.421 2.059 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H]2CC[C@@H]2C2CC2)C1 ZINC000423374931 192751668 /nfs/dbraw/zinc/75/16/68/192751668.db2.gz UCTBTNVHIILGEC-YVECIDJPSA-N 2 0 208.349 2.035 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1CCC12CCC2 ZINC000423428125 192752220 /nfs/dbraw/zinc/75/22/20/192752220.db2.gz JCIWNQLZXCTJJF-VXGBXAGGSA-N 2 0 210.365 2.426 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+]CCC(F)(F)F)CC1(C)C ZINC000623436183 359328455 /nfs/dbraw/zinc/32/84/55/359328455.db2.gz IFILNRFFYFEMSB-SECBINFHSA-N 2 0 238.297 2.401 20 0 BEADRP C[C@@H](C[NH2+]CC1(C)CCC1)N(C)C1CC1 ZINC000308917821 491140179 /nfs/dbraw/zinc/14/01/79/491140179.db2.gz OCVSSPSJIFHDEI-NSHDSACASA-N 2 0 210.365 2.249 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@H](C1CC1)C1CCCC1 ZINC000423456603 192777345 /nfs/dbraw/zinc/77/73/45/192777345.db2.gz DSIQSEMJRRCKNN-OLZOCXBDSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[C@H]([NH3+])C1)C1(C)CC1 ZINC000423473772 192784699 /nfs/dbraw/zinc/78/46/99/192784699.db2.gz OBTSELLHXGNVRK-SRVKXCTJSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]([NH2+]CCC[C@H]1CCC[NH2+]1)[C@H]1C[C@H]1C ZINC000423482674 192789584 /nfs/dbraw/zinc/78/95/84/192789584.db2.gz PNDLYVUITVUYNJ-NDBYEHHHSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H](C)c1cncs1 ZINC000423430594 192789980 /nfs/dbraw/zinc/78/99/80/192789980.db2.gz LDKLPOHMAPQQRK-ZJUUUORDSA-N 2 0 227.377 2.311 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@H](C[NH3+])C1)[C@H]1CC1(C)C ZINC000423520884 192801845 /nfs/dbraw/zinc/80/18/45/192801845.db2.gz WPQWVAMBQOPTKH-NNYUYHANSA-N 2 0 210.365 2.138 20 0 BEADRP CCc1nc(C)cc(NCC[N@H+]2CC=CCC2)n1 ZINC000287732919 359517503 /nfs/dbraw/zinc/51/75/03/359517503.db2.gz LVDYTAKVJGQFJL-UHFFFAOYSA-N 2 0 246.358 2.021 20 0 BEADRP C[C@@H]1C[C@@H](C[N@@H+]2CCSC[C@@H](C)C2)CC[NH2+]1 ZINC000379554244 359541552 /nfs/dbraw/zinc/54/15/52/359541552.db2.gz ZXCVMBKYZWSOOR-XQQFMLRXSA-N 2 0 242.432 2.059 20 0 BEADRP C[C@@H]1C[C@@H](C[N@@H+]2CCS[C@@H](C)CC2)CC[NH2+]1 ZINC000379545544 359541590 /nfs/dbraw/zinc/54/15/90/359541590.db2.gz YZESPCWETWGNNT-AGIUHOORSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2CCSC[C@@H](C)C2)CC[NH2+]1 ZINC000379554245 359541656 /nfs/dbraw/zinc/54/16/56/359541656.db2.gz ZXCVMBKYZWSOOR-YNEHKIRRSA-N 2 0 242.432 2.059 20 0 BEADRP C[C@H]([NH2+]CCC1=CC[NH2+]CC1)C(C)(C)C ZINC000423542853 192808954 /nfs/dbraw/zinc/80/89/54/192808954.db2.gz UJZYUYFCWPDNJI-NSHDSACASA-N 2 0 210.365 2.320 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CCC2=CC[NH2+]CC2)C1 ZINC000423561852 192813485 /nfs/dbraw/zinc/81/34/85/192813485.db2.gz QHGGBVBPRJHVMR-DGCLKSJQSA-N 2 0 208.349 2.074 20 0 BEADRP C[NH+](C)CC[C@H]([NH2+]C1CSC1)C(C)(C)C ZINC000309035913 491143058 /nfs/dbraw/zinc/14/30/58/491143058.db2.gz IAZVAQLNOOESHW-NSHDSACASA-N 2 0 230.421 2.058 20 0 BEADRP CC(C)c1cc(N2CC[C@H]([NH3+])C2)nc(C(C)C)n1 ZINC000045954590 359745573 /nfs/dbraw/zinc/74/55/73/359745573.db2.gz FAOQRBTVTXTIDN-NSHDSACASA-N 2 0 248.374 2.261 20 0 BEADRP CCC1(CC)CC[N@H+](C[C@H]2CCC[NH2+]C2)C1 ZINC000087254628 359904102 /nfs/dbraw/zinc/90/41/02/359904102.db2.gz XJBCAXZXKGEGOI-ZDUSSCGKSA-N 2 0 224.392 2.498 20 0 BEADRP Cn1cncc1CCC[N@H+](C)CC1CCCC1 ZINC000578638682 366615301 /nfs/dbraw/zinc/61/53/01/366615301.db2.gz BLQOYWPWINILEG-UHFFFAOYSA-N 2 0 235.375 2.475 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+]CCc1ccccc1 ZINC000089139563 359991869 /nfs/dbraw/zinc/99/18/69/359991869.db2.gz JVHGYNWOXVOSFF-CABCVRRESA-N 2 0 232.371 2.336 20 0 BEADRP CC(C)COCCC[NH2+][C@@H]1CCCC[C@@H]1C[NH3+] ZINC000089140448 359992613 /nfs/dbraw/zinc/99/26/13/359992613.db2.gz OWIPJBZMQJSRIS-ZIAGYGMSSA-N 2 0 242.407 2.156 20 0 BEADRP COCc1cccc(C[NH2+][C@@H]2CCC[C@@H]2C[NH3+])c1 ZINC000089150220 359993877 /nfs/dbraw/zinc/99/38/77/359993877.db2.gz BWKLLHWGOGOJMA-HUUCEWRRSA-N 2 0 248.370 2.050 20 0 BEADRP COCc1cccc(C[NH2+][C@H]2CCC[C@@H]2C[NH3+])c1 ZINC000089150221 359994199 /nfs/dbraw/zinc/99/41/99/359994199.db2.gz BWKLLHWGOGOJMA-CABCVRRESA-N 2 0 248.370 2.050 20 0 BEADRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]CCCc1ccccc1 ZINC000089147660 359994283 /nfs/dbraw/zinc/99/42/83/359994283.db2.gz QCDFXZQLANPMIM-HUUCEWRRSA-N 2 0 232.371 2.336 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C2(C)CCC2)CC1(C)C ZINC000623472376 360057020 /nfs/dbraw/zinc/05/70/20/360057020.db2.gz NNMJJXHXTMNBON-NSHDSACASA-N 2 0 210.365 2.391 20 0 BEADRP CCC[C@@H]1C[C@@H]1[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@@H]1C ZINC000090176097 360062759 /nfs/dbraw/zinc/06/27/59/360062759.db2.gz VNTJYJUWWWZKQF-QNSTZXKLSA-N 2 0 224.392 2.493 20 0 BEADRP CCCC1(C[NH2+][C@@H]2CC[N@H+](C)C[C@@H]2C)CC1 ZINC000090402161 360071792 /nfs/dbraw/zinc/07/17/92/360071792.db2.gz HHUHOUJKNOHLQW-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CC2(C3CC3)CC2)[C@H](C)C1 ZINC000090772721 360086911 /nfs/dbraw/zinc/08/69/11/360086911.db2.gz IIZYEYHLZSPTOD-TZMCWYRMSA-N 2 0 236.403 2.497 20 0 BEADRP COc1ccc2c(c1)[C@H]([NH2+]CCCC[NH3+])CC2 ZINC000092836325 360202531 /nfs/dbraw/zinc/20/25/31/360202531.db2.gz SFVOHKFMFMXKRU-CQSZACIVSA-N 2 0 234.343 2.011 20 0 BEADRP COCC[C@H](C)[NH2+][C@@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000093516652 360256103 /nfs/dbraw/zinc/25/61/03/360256103.db2.gz BFGHGHSGWPHYNT-IHRRRGAJSA-N 2 0 242.407 2.312 20 0 BEADRP COCCCC[NH2+][C@@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000093521207 360256138 /nfs/dbraw/zinc/25/61/38/360256138.db2.gz SIJOKKXHBTZBHP-UONOGXRCSA-N 2 0 242.407 2.313 20 0 BEADRP CC1(C)C[C@H]([NH2+]CCN2CCCC2)C(C)(C)O1 ZINC000094422701 360306765 /nfs/dbraw/zinc/30/67/65/360306765.db2.gz XDWBIKAFFMNWAU-LBPRGKRZSA-N 2 0 240.391 2.018 20 0 BEADRP CC(C)CC[N@H+](CCOCC[NH3+])C1CCCC1 ZINC000094849244 360322804 /nfs/dbraw/zinc/32/28/04/360322804.db2.gz WWGUHUVMUYGHRM-UHFFFAOYSA-N 2 0 242.407 2.252 20 0 BEADRP CC(C)(F)C[NH2+]Cc1cccc2nccn21 ZINC000631189777 360527926 /nfs/dbraw/zinc/52/79/26/360527926.db2.gz SVYASVZHQKPXOV-UHFFFAOYSA-N 2 0 221.279 2.172 20 0 BEADRP CC1CC([NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)C1 ZINC000161779187 360552845 /nfs/dbraw/zinc/55/28/45/360552845.db2.gz YACIYMGCMGWNQR-PYNQCMFNSA-N 2 0 208.349 2.001 20 0 BEADRP [NH3+][C@@H](C[NH2+]C[C@@H]1C[C@H]1c1ccccc1)C1CC1 ZINC000414895611 200777051 /nfs/dbraw/zinc/77/70/51/200777051.db2.gz YEINCCNDHZINHT-KKUMJFAQSA-N 2 0 230.355 2.117 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]CCC2CCCC2)C1 ZINC000086403284 325614534 /nfs/dbraw/zinc/61/45/34/325614534.db2.gz WDQFDVNLLKGOGP-CHWSQXEVSA-N 2 0 210.365 2.426 20 0 BEADRP CC1(C)CC[C@@H]([NH2+][C@H]2CC[NH2+]C23CCC3)C1 ZINC000629385198 361032339 /nfs/dbraw/zinc/03/23/39/361032339.db2.gz UJXFKIPLABSZAY-NEPJUHHUSA-N 2 0 222.376 2.439 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+]C1C[C@@H](C)C[C@H](C)C1 ZINC000629406192 361053385 /nfs/dbraw/zinc/05/33/85/361053385.db2.gz JYBWYRSPHTXCHH-MRBYEJRBSA-N 2 0 210.365 2.151 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+][C@H]1CCCC[C@@H]1C1CC1 ZINC000629408446 361059420 /nfs/dbraw/zinc/05/94/20/361059420.db2.gz VIYKHVQXOSAOTN-ASEORRQLSA-N 2 0 222.376 2.295 20 0 BEADRP C(C1CC[NH2+]CC1)[N@@H+]1CCCC2(CC2)CC1 ZINC000629505706 361101173 /nfs/dbraw/zinc/10/11/73/361101173.db2.gz OCFVGFLHINFXJS-UHFFFAOYSA-N 2 0 222.376 2.252 20 0 BEADRP Cc1nc(C(C)C)ccc1C[N@@H+]1CC[C@H](C[NH3+])C1 ZINC000629510640 361108462 /nfs/dbraw/zinc/10/84/62/361108462.db2.gz DMRYERMHSZHDOU-CYBMUJFWSA-N 2 0 247.386 2.294 20 0 BEADRP CC(C)[C@@H]([NH2+]CC[C@@H]1CC[NH2+]C1)C1CC1 ZINC000578994885 366687537 /nfs/dbraw/zinc/68/75/37/366687537.db2.gz WHVSAMWTPKPILW-WCQYABFASA-N 2 0 210.365 2.010 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1[NH2+][C@@H]1CC[C@@H]1C1CCC1 ZINC000629528289 361135658 /nfs/dbraw/zinc/13/56/58/361135658.db2.gz VVQAIZPXSAQQIA-XJFOESAGSA-N 2 0 222.376 2.295 20 0 BEADRP CC[C@@H]1CC[C@@H](C)C[C@@H]1[NH2+]CCOCC[NH2+]C ZINC000629530236 361143094 /nfs/dbraw/zinc/14/30/94/361143094.db2.gz AIKUMUWRNYCWOW-MCIONIFRSA-N 2 0 242.407 2.027 20 0 BEADRP C[NH2+]CCOCC[NH2+][C@@H]1CCCC[C@@H]1C(C)C ZINC000629529950 361146539 /nfs/dbraw/zinc/14/65/39/361146539.db2.gz REWXQNWXIHROGQ-ZIAGYGMSSA-N 2 0 242.407 2.027 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+]CC[C@H]1CC=CCC1 ZINC000629531792 361150478 /nfs/dbraw/zinc/15/04/78/361150478.db2.gz YDUSNUIFDJRWIL-KBPBESRZSA-N 2 0 240.391 2.076 20 0 BEADRP CC[C@H]1CCCC[C@H]1[NH2+]CC1([NH3+])CCOCC1 ZINC000629524751 361125631 /nfs/dbraw/zinc/12/56/31/361125631.db2.gz OIABDGKTMQRCBO-QWHCGFSZSA-N 2 0 240.391 2.053 20 0 BEADRP Cc1ccccc1[C@@H](C)[NH2+]CC1([NH3+])CCOCC1 ZINC000629525236 361125876 /nfs/dbraw/zinc/12/58/76/361125876.db2.gz YXVSZCAWXDESOH-CYBMUJFWSA-N 2 0 248.370 2.154 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+][C@@H]1CCC[C@H](C2CC2)C1 ZINC000424388835 200926753 /nfs/dbraw/zinc/92/67/53/200926753.db2.gz ZTBAOSTVEGJWDO-REWJHTLYSA-N 2 0 222.376 2.425 20 0 BEADRP C[C@@H]1C[C@@H]1CN1CCCC[C@H]1[C@H]1CCC[NH2+]1 ZINC000579121905 366716291 /nfs/dbraw/zinc/71/62/91/366716291.db2.gz IAMLKNFWZURJCD-SYQHCUMBSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@@H]1C[C@@H]1CN1CCCC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000579121900 366716320 /nfs/dbraw/zinc/71/63/20/366716320.db2.gz IAMLKNFWZURJCD-AAVRWANBSA-N 2 0 222.376 2.249 20 0 BEADRP CC1CC(C[NH2+][C@H]2CCCC[C@@H]2C[NH3+])C1 ZINC000622044343 370673083 /nfs/dbraw/zinc/67/30/83/370673083.db2.gz BHYIOSHLSYMADQ-TUUUFIMRSA-N 2 0 210.365 2.140 20 0 BEADRP FC1(F)C[C@@H]1CC[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000622043720 370675476 /nfs/dbraw/zinc/67/54/76/370675476.db2.gz IQQINODSPYCCTB-WHOHXGKFSA-N 2 0 244.329 2.009 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CC[C@H]1CC1(F)F ZINC000622043888 370675756 /nfs/dbraw/zinc/67/57/56/370675756.db2.gz OVEDPSYIISRFBJ-UWVGGRQHSA-N 2 0 220.307 2.139 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]CC[C@@H]1CC1(F)F ZINC000622043739 370675830 /nfs/dbraw/zinc/67/58/30/370675830.db2.gz JSPIXLODUCLWOU-GMTAPVOTSA-N 2 0 232.318 2.281 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+]CC[C@H](C)[NH3+])c(C)n1 ZINC000622045422 370679951 /nfs/dbraw/zinc/67/99/51/370679951.db2.gz SWYKMMROFHDMEH-GXSJLCMTSA-N 2 0 221.348 2.086 20 0 BEADRP CC(C)[C@H]1CCC[C@@H]([NH2+]CCOCCC[NH3+])C1 ZINC000629536521 361399513 /nfs/dbraw/zinc/39/95/13/361399513.db2.gz GNQMOUOGPWFFCT-UONOGXRCSA-N 2 0 242.407 2.156 20 0 BEADRP C[C@@H]([NH2+]CCOCCC[NH3+])C1C(C)(C)C1(C)C ZINC000629537762 361401242 /nfs/dbraw/zinc/40/12/42/361401242.db2.gz KRBHMPBBBGUCNV-LLVKDONJSA-N 2 0 242.407 2.012 20 0 BEADRP CC[C@@H]1C[C@H](C)CC[C@H]1[NH2+]CCOCCC[NH3+] ZINC000629537235 361401466 /nfs/dbraw/zinc/40/14/66/361401466.db2.gz JFIKCLDMTDVASS-MGPQQGTHSA-N 2 0 242.407 2.156 20 0 BEADRP C[C@@H]([NH2+]C[C@]1(C)C[C@H]2C[C@H]2C1)[C@@H]1CCC[NH2+]1 ZINC000629538100 361402392 /nfs/dbraw/zinc/40/23/92/361402392.db2.gz NIAGFBHKFYABOT-PEBLQZBPSA-N 2 0 222.376 2.153 20 0 BEADRP Cc1cc([C@H](C)[NH2+]CCOCCC[NH3+])cs1 ZINC000629535878 361411623 /nfs/dbraw/zinc/41/16/23/361411623.db2.gz DIJFGDACHCFXGS-NSHDSACASA-N 2 0 242.388 2.073 20 0 BEADRP CCC[C@@](C)([NH3+])C(=O)Nc1ccc([C@@H](C)[NH3+])cc1 ZINC000429573222 201117280 /nfs/dbraw/zinc/11/72/80/201117280.db2.gz YFXOGACSBNCGFM-QMTHXVAHSA-N 2 0 249.358 2.162 20 0 BEADRP C[C@]1(C[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)C[C@H]2C[C@H]2C1 ZINC000629541084 361415622 /nfs/dbraw/zinc/41/56/22/361415622.db2.gz WEQASHGIPLBUAK-AQGHMYMLSA-N 2 0 248.414 2.400 20 0 BEADRP [NH3+]CCCOCC[NH2+][C@H](c1ccccc1)C1CC1 ZINC000629540495 361413970 /nfs/dbraw/zinc/41/39/70/361413970.db2.gz VCNNZJMAGSSQID-OAHLLOKOSA-N 2 0 248.370 2.093 20 0 BEADRP CC[C@@H]([NH2+]CCOCCC[NH3+])c1ccsc1 ZINC000629540777 361415208 /nfs/dbraw/zinc/41/52/08/361415208.db2.gz XNKBJTAAMUKLKF-GFCCVEGCSA-N 2 0 242.388 2.154 20 0 BEADRP CC1(C)CCC(C)(C)[N@H+](C[C@@H]2CC[NH2+]C2)C1 ZINC000629544858 361424367 /nfs/dbraw/zinc/42/43/67/361424367.db2.gz JVIPJVRLEJIMIL-GFCCVEGCSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)=CCC[C@H](C)[NH2+][C@@H]1CC[NH2+][C@H]1C ZINC000629549017 361435594 /nfs/dbraw/zinc/43/55/94/361435594.db2.gz UJQNYZFWILOUOC-RWMBFGLXSA-N 2 0 210.365 2.461 20 0 BEADRP Cc1ccccc1[C@H](C)[NH2+]CCOCCC[NH3+] ZINC000629541960 361417559 /nfs/dbraw/zinc/41/75/59/361417559.db2.gz VBFAPJCBIQISKT-ZDUSSCGKSA-N 2 0 236.359 2.011 20 0 BEADRP C[C@]12C[NH2+]C[C@@]1(C)C[N@H+](CCc1ccccc1)C2 ZINC000629583769 361467480 /nfs/dbraw/zinc/46/74/80/361467480.db2.gz FRHOSLXZNKHNPS-IYBDPMFKSA-N 2 0 244.382 2.161 20 0 BEADRP FC1(F)CCC[N@H+](CC[C@H]2CCC[NH2+]C2)CC1 ZINC000629559952 361454899 /nfs/dbraw/zinc/45/48/99/361454899.db2.gz VWFBECYDOUSXOL-GFCCVEGCSA-N 2 0 246.345 2.497 20 0 BEADRP CCCN(CC)CC[NH2+][C@@H]1CCC[C@@H]1C ZINC000152422666 201199551 /nfs/dbraw/zinc/19/95/51/201199551.db2.gz NHGWEDVGQUDFHS-QWHCGFSZSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@H]([NH3+])c1ccc(C[NH2+]Cc2ccn(C)c2)cc1 ZINC000629648670 361541830 /nfs/dbraw/zinc/54/18/30/361541830.db2.gz YTMIPDIPDULOQS-LBPRGKRZSA-N 2 0 243.354 2.335 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2CCCC(F)(F)CC2)CC[NH2+]1 ZINC000629652794 361551518 /nfs/dbraw/zinc/55/15/18/361551518.db2.gz BIOVLGAXYBWQNA-VXGBXAGGSA-N 2 0 246.345 2.496 20 0 BEADRP C[N@H+](CCOCC[NH3+])C[C@@H]1CCCC(C)(C)C1 ZINC000629661238 361594640 /nfs/dbraw/zinc/59/46/40/361594640.db2.gz BSBLSILMHIGATO-CYBMUJFWSA-N 2 0 242.407 2.110 20 0 BEADRP C[C@]1(C[N@@H+]2CCCC3(CC3)CC2)CC[NH2+]C1 ZINC000629669574 361590056 /nfs/dbraw/zinc/59/00/56/361590056.db2.gz YEZVUCMDZIVDBG-ZDUSSCGKSA-N 2 0 222.376 2.252 20 0 BEADRP [NH3+]C1CCC([NH2+]CCc2ccccc2F)CC1 ZINC000094074274 181341802 /nfs/dbraw/zinc/34/18/02/181341802.db2.gz XTTVLZRLGFZWOC-UHFFFAOYSA-N 2 0 236.334 2.228 20 0 BEADRP C[NH2+]Cc1ccc(C2=CC[NH2+]CC2)cc1C ZINC000629722901 361663905 /nfs/dbraw/zinc/66/39/05/361663905.db2.gz GYAXZMFGAPYBSB-UHFFFAOYSA-N 2 0 216.328 2.091 20 0 BEADRP CO[C@@H](c1ccc(C2=CC[NH2+]CC2)cc1)[C@@H](C)[NH3+] ZINC000629723269 361664478 /nfs/dbraw/zinc/66/44/78/361664478.db2.gz LUOURNACHWBYNT-IAQYHMDHSA-N 2 0 246.354 2.098 20 0 BEADRP [NH3+]CC1(Cc2ccc(C3=CC[NH2+]CC3)cc2)CC1 ZINC000629722474 361662565 /nfs/dbraw/zinc/66/25/65/361662565.db2.gz AYEFRLXAABSCFI-UHFFFAOYSA-N 2 0 242.366 2.345 20 0 BEADRP C[NH2+]CCC[N@@H+]1C[C@H](c2ccccc2)C[C@H]1C ZINC000435871732 201292893 /nfs/dbraw/zinc/29/28/93/201292893.db2.gz LJDMVYQHYQLNOR-UKRRQHHQSA-N 2 0 232.371 2.474 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCc2ccccc2[C@H]1C ZINC000435879470 201293822 /nfs/dbraw/zinc/29/38/22/201293822.db2.gz CRJVBGIJAJKUQM-GFCCVEGCSA-N 2 0 218.344 2.215 20 0 BEADRP [NH3+]C1CC[NH+](Cc2cccc3cccnc32)CC1 ZINC000020244492 181345264 /nfs/dbraw/zinc/34/52/64/181345264.db2.gz IZSIPTDUXRZXMM-UHFFFAOYSA-N 2 0 241.338 2.158 20 0 BEADRP [NH3+]C1CC[NH+](Cc2ccc(C3CC3)cc2)CC1 ZINC000094522026 181345333 /nfs/dbraw/zinc/34/53/33/181345333.db2.gz FAOJRPNMEOQWBL-UHFFFAOYSA-N 2 0 230.355 2.487 20 0 BEADRP [NH3+]CCC[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1 ZINC000437771099 201371652 /nfs/dbraw/zinc/37/16/52/201371652.db2.gz GSVFCTLJGAUSLQ-LSDHHAIUSA-N 2 0 232.371 2.336 20 0 BEADRP C[C@@H](CCc1ccc(F)cc1)[NH2+]CCC[NH3+] ZINC000437767721 201371736 /nfs/dbraw/zinc/37/17/36/201371736.db2.gz AXUWZYVOHDCIOC-NSHDSACASA-N 2 0 224.323 2.085 20 0 BEADRP CC(C)[C@H](C)C[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000156110629 201399317 /nfs/dbraw/zinc/39/93/17/201399317.db2.gz DPVZYFJCQRJZFN-MGPQQGTHSA-N 2 0 224.392 2.495 20 0 BEADRP CC[NH+](CC)CCC[N@@H+]1CCC[C@H](C)C1 ZINC000170793358 364245095 /nfs/dbraw/zinc/24/50/95/364245095.db2.gz ROUJKXLTOJKVGX-ZDUSSCGKSA-N 2 0 212.381 2.450 20 0 BEADRP C[C@H]([NH2+]CC1(C)CC[NH2+]CC1)c1cscn1 ZINC000573316010 364794974 /nfs/dbraw/zinc/79/49/74/364794974.db2.gz VUFOYESDJGAUMM-JTQLQIEISA-N 2 0 239.388 2.183 20 0 BEADRP C[NH2+]CCC[NH2+][C@H]1CCCc2c(OC)cccc21 ZINC000573315676 364795790 /nfs/dbraw/zinc/79/57/90/364795790.db2.gz PNQQJEKBFDUIAT-AWEZNQCLSA-N 2 0 248.370 2.272 20 0 BEADRP [NH3+]CCCC[N@@H+]1CCC[C@@H]2CCCC[C@H]21 ZINC000036826505 181375978 /nfs/dbraw/zinc/37/59/78/181375978.db2.gz WRNWAXPGEMRLNZ-QWHCGFSZSA-N 2 0 210.365 2.380 20 0 BEADRP [NH3+]CCCC[NH2+]Cc1ccc(Cl)c(F)c1 ZINC000043389774 181377303 /nfs/dbraw/zinc/37/73/03/181377303.db2.gz ZAGYPQYYLPKJDQ-UHFFFAOYSA-N 2 0 230.714 2.308 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]CC2(C(F)(F)F)CC2)C1 ZINC000574415531 365059460 /nfs/dbraw/zinc/05/94/60/365059460.db2.gz YVGBSNZZCVZJCZ-IUCAKERBSA-N 2 0 236.281 2.188 20 0 BEADRP C[C@@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1ccoc1 ZINC000574269161 365023774 /nfs/dbraw/zinc/02/37/74/365023774.db2.gz LBQXRGUQMFZJHX-YPMHNXCESA-N 2 0 222.332 2.462 20 0 BEADRP NCC[NH2+][C@@H]1CCCC[C@H]1c1ccccc1 ZINC000037712965 181396562 /nfs/dbraw/zinc/39/65/62/181396562.db2.gz WSIHFHHYIQOIDR-UONOGXRCSA-N 2 0 218.344 2.261 20 0 BEADRP [NH3+]CCOCC[NH2+][C@H](c1ccccc1)C1CCC1 ZINC000357078593 181399649 /nfs/dbraw/zinc/39/96/49/181399649.db2.gz LLRFLBPQIKIMAQ-OAHLLOKOSA-N 2 0 248.370 2.093 20 0 BEADRP CC[C@H](CSC)[NH2+][C@H]1CCN(C)[C@H](C)C1 ZINC000162374594 541456888 /nfs/dbraw/zinc/45/68/88/541456888.db2.gz VEVTZUAXZHWZBR-UTUOFQBUSA-N 2 0 230.421 2.200 20 0 BEADRP CC[NH+](CC)C[C@H]1CC[N@H+](CC2(C)CC2)C1 ZINC000575427331 365317321 /nfs/dbraw/zinc/31/73/21/365317321.db2.gz IQDPYNZYZNYRBT-CYBMUJFWSA-N 2 0 224.392 2.450 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H]1CCC[C@H]2C[C@]21C ZINC000575742109 365348294 /nfs/dbraw/zinc/34/82/94/365348294.db2.gz FGHQHFKGIVFTDE-YNEHKIRRSA-N 2 0 210.365 2.154 20 0 BEADRP Cc1cccc([C@H](C)[NH2+]C[C@@H](C)C[NH3+])c1 ZINC000379880369 365336174 /nfs/dbraw/zinc/33/61/74/365336174.db2.gz VKAHROZEMLYNSW-RYUDHWBXSA-N 2 0 206.333 2.240 20 0 BEADRP CC[N@H+](C)C[C@H]1CC[NH+](CC=C(C)C)C1 ZINC000173916489 365453659 /nfs/dbraw/zinc/45/36/59/365453659.db2.gz XDUFLPGFWCCERB-CYBMUJFWSA-N 2 0 210.365 2.226 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H]2CCCC(F)(F)C2)C1 ZINC000579614119 366910486 /nfs/dbraw/zinc/91/04/86/366910486.db2.gz RFPCPZNXOGYQBL-OUAUKWLOSA-N 2 0 232.318 2.424 20 0 BEADRP [NH3+]Cc1ccccc1OC[C@H]1CC[C@H](C[NH3+])CC1 ZINC000579700913 366982464 /nfs/dbraw/zinc/98/24/64/366982464.db2.gz QFTRWHZMOLZTRG-JOCQHMNTSA-N 2 0 248.370 2.289 20 0 BEADRP COc1ccc(C)cc1C[NH2+][C@@H](C)C[C@@H](C)[NH3+] ZINC000579700062 366982767 /nfs/dbraw/zinc/98/27/67/366982767.db2.gz LSCUZJCISLZZIP-NEPJUHHUSA-N 2 0 236.359 2.219 20 0 BEADRP C(C[NH2+][C@H]1CCCC12CC2)C[NH+]1CCCC1 ZINC000579853813 367053308 /nfs/dbraw/zinc/05/33/08/367053308.db2.gz CBRRFIGGGNXSBH-ZDUSSCGKSA-N 2 0 222.376 2.395 20 0 BEADRP C[C@H]1C[C@H](C[N@H+](C)Cc2cccc(O)c2)CC[NH2+]1 ZINC000580939945 367210586 /nfs/dbraw/zinc/21/05/86/367210586.db2.gz NKZDVDVQNBLKHF-GXTWGEPZSA-N 2 0 248.370 2.212 20 0 BEADRP C(C[N@@H+]1[C@H]2CC[C@@H]1CCC2)[C@@H]1CC[NH2+]C1 ZINC000380647467 367265870 /nfs/dbraw/zinc/26/58/70/367265870.db2.gz WKKHKRWNLMWDLH-RWMBFGLXSA-N 2 0 208.349 2.003 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000381128749 367353324 /nfs/dbraw/zinc/35/33/24/367353324.db2.gz KCKMBZCRXPGSDU-IHRRRGAJSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[C@H]([NH3+])C1)c1ccoc1 ZINC000581185200 367287429 /nfs/dbraw/zinc/28/74/29/367287429.db2.gz GIVUDSVPLZCSTI-LOWVWBTDSA-N 2 0 222.332 2.448 20 0 BEADRP C[NH+](C)CC1CCC([NH2+]CC2(F)CC2)CC1 ZINC000381315788 367379496 /nfs/dbraw/zinc/37/94/96/367379496.db2.gz NAEMOWTUKZTHQQ-UHFFFAOYSA-N 2 0 228.355 2.199 20 0 BEADRP CC(C)[C@H]([NH2+]CC1=CC[N@H+](C)CC1)C1CC1 ZINC000381366672 367389132 /nfs/dbraw/zinc/38/91/32/367389132.db2.gz DZPATAKZUAEDTD-AWEZNQCLSA-N 2 0 222.376 2.273 20 0 BEADRP CC1CC[NH+](CCC[NH2+]CC2(C)CC2)CC1 ZINC000381469341 367413644 /nfs/dbraw/zinc/41/36/44/367413644.db2.gz NRAZXNJNXDDGMB-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)NCc1noc2ccccc12 ZINC000581440236 367472545 /nfs/dbraw/zinc/47/25/45/367472545.db2.gz ZJAHTOHVSZWSQW-UWVGGRQHSA-N 2 0 233.315 2.043 20 0 BEADRP CC1(C)CCC[C@@H]1[NH2+]CCC[NH2+]C1CC1 ZINC000382608011 367548767 /nfs/dbraw/zinc/54/87/67/367548767.db2.gz ZQUKONZWASHPNB-LBPRGKRZSA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@H]([NH2+][C@H]1CCCNC1)C1CCCC1 ZINC000382789851 367557454 /nfs/dbraw/zinc/55/74/54/367557454.db2.gz OJCXLXBSJPKAGI-STQMWFEESA-N 2 0 210.365 2.297 20 0 BEADRP CCc1ccccc1CN(C)[C@H](C)C[NH3+] ZINC000382983224 367579778 /nfs/dbraw/zinc/57/97/78/367579778.db2.gz YNMNQIHTWROQHG-LLVKDONJSA-N 2 0 206.333 2.028 20 0 BEADRP CCC[NH2+]CC[NH2+]C[C@H]1CCC[C@H](C)C1 ZINC000383112720 367597761 /nfs/dbraw/zinc/59/77/61/367597761.db2.gz IDESIYQXLOEIHT-STQMWFEESA-N 2 0 212.381 2.402 20 0 BEADRP CC[C@@H]1[C@@H](C)CC[N@@H+]1CC[C@H]1CCC[NH2+]C1 ZINC000384027838 367669424 /nfs/dbraw/zinc/66/94/24/367669424.db2.gz ZECUUGQBEKPSEW-BFHYXJOUSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H]1[C@H](C)CC[N@@H+]1CCC1CC[NH2+]CC1 ZINC000384026597 367669833 /nfs/dbraw/zinc/66/98/33/367669833.db2.gz YEZMKPBYPQIIJL-TZMCWYRMSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCCSC1)[C@H]1CCCC[NH2+]1 ZINC000384095214 367672148 /nfs/dbraw/zinc/67/21/48/367672148.db2.gz CXYXMIGLJNMLMB-RWMBFGLXSA-N 2 0 242.432 2.250 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCCSC1)[C@@H]1CCCC[NH2+]1 ZINC000384095217 367672265 /nfs/dbraw/zinc/67/22/65/367672265.db2.gz CXYXMIGLJNMLMB-XQQFMLRXSA-N 2 0 242.432 2.250 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCC[NH+]2CCCCC2)[C@@H](C)O1 ZINC000385004770 367770709 /nfs/dbraw/zinc/77/07/09/367770709.db2.gz WEJBSAMKUBYYPR-MCIONIFRSA-N 2 0 240.391 2.018 20 0 BEADRP CC1CCC(C[N@H+](C)C2CC([NH3+])C2)CC1 ZINC000384842794 367741765 /nfs/dbraw/zinc/74/17/65/367741765.db2.gz JLAHAGCDBXNOPH-UHFFFAOYSA-N 2 0 210.365 2.234 20 0 BEADRP CC/C=C/C[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@H]1C ZINC000384866946 367745615 /nfs/dbraw/zinc/74/56/15/367745615.db2.gz NZEHXOUCVMZTQD-SFTURWCGSA-N 2 0 210.365 2.271 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H]2C[C@@H](C)O[C@H]2C)CC1 ZINC000384940032 367761521 /nfs/dbraw/zinc/76/15/21/367761521.db2.gz QSJQFYDBEXNQBJ-MBNYWOFBSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@@H](C[N@H+](C)C1CC([NH3+])C1)c1ccccc1 ZINC000384957149 367764395 /nfs/dbraw/zinc/76/43/95/367764395.db2.gz GWSMVXOMRLFKGH-XGNXJENSSA-N 2 0 218.344 2.212 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@@H]2C[C@@H](C)O[C@@H]2C)CC1 ZINC000384971940 367767802 /nfs/dbraw/zinc/76/78/02/367767802.db2.gz TWDUZEPHNBJHFC-YRGRVCCFSA-N 2 0 240.391 2.015 20 0 BEADRP C[N@H+](CCCCC1CCOCC1)C1CC([NH3+])C1 ZINC000385270580 367814820 /nfs/dbraw/zinc/81/48/20/367814820.db2.gz ZYBDTVDHQQBJSA-UHFFFAOYSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)[C@H]1C ZINC000385668383 367853561 /nfs/dbraw/zinc/85/35/61/367853561.db2.gz PHYKOMFUNCNUIC-CCJXIVEXSA-N 2 0 222.376 2.246 20 0 BEADRP CSCC1CCC([NH2+]CC(C)(C)[NH3+])CC1 ZINC000385828479 367868776 /nfs/dbraw/zinc/86/87/76/367868776.db2.gz LEFKGSRBFJMJJK-UHFFFAOYSA-N 2 0 230.421 2.235 20 0 BEADRP CSCC1CCC([NH2+]C2CC[NH2+]CC2)CC1 ZINC000385356667 367821901 /nfs/dbraw/zinc/82/19/01/367821901.db2.gz HATOMTWCRWKEOS-UHFFFAOYSA-N 2 0 242.432 2.250 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCC[C@H]2C[NH3+])[C@@H]1C ZINC000385617897 367847094 /nfs/dbraw/zinc/84/70/94/367847094.db2.gz ICDWINKKKHJHTB-LBELIVKGSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCC[C@@H]([NH3+])C2)[C@@H]1C ZINC000386080300 367909670 /nfs/dbraw/zinc/90/96/70/367909670.db2.gz DACAMVMKCCNNGB-VEGXAWMVSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[C@@H](C)C1)[C@@H]1CCCC[NH2+]1 ZINC000386103618 367912980 /nfs/dbraw/zinc/91/29/80/367912980.db2.gz KFOXVTHZSOXRRX-NDBYEHHHSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@@H]([NH2+]CC1CC(F)(F)C1)[C@H]1CCCC[NH2+]1 ZINC000386010505 367897239 /nfs/dbraw/zinc/89/72/39/367897239.db2.gz MMGITVLBYFNUSV-MWLCHTKSSA-N 2 0 232.318 2.152 20 0 BEADRP CSC1(C[NH2+][C@H](C)[C@H]2CCCC[NH2+]2)CCC1 ZINC000386598235 368000125 /nfs/dbraw/zinc/00/01/25/368000125.db2.gz UBAONMAWVJGHDF-VXGBXAGGSA-N 2 0 242.432 2.392 20 0 BEADRP CCCCOCCC[NH2+][C@@H](C)[C@H]1CCCC[NH2+]1 ZINC000386367311 367957125 /nfs/dbraw/zinc/95/71/25/367957125.db2.gz AUKLDDMUSMSKOF-UONOGXRCSA-N 2 0 242.407 2.313 20 0 BEADRP CC(C)OCCCC[NH2+][C@H](C)[C@@H]1CCCC[NH2+]1 ZINC000386476571 367978665 /nfs/dbraw/zinc/97/86/65/367978665.db2.gz RIVRHRYZKDOFQG-KGLIPLIRSA-N 2 0 242.407 2.312 20 0 BEADRP CC(C)COCCC[NH2+][C@@H](C)[C@H]1CCCC[NH2+]1 ZINC000386489165 367979942 /nfs/dbraw/zinc/97/99/42/367979942.db2.gz UDBCZNNMQBMIBI-UONOGXRCSA-N 2 0 242.407 2.169 20 0 BEADRP C[NH+](C)CCCC(C)(C)[NH2+]Cc1ccccn1 ZINC000387281108 368141207 /nfs/dbraw/zinc/14/12/07/368141207.db2.gz GCOCLTNKDSUBJB-UHFFFAOYSA-N 2 0 235.375 2.292 20 0 BEADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+]C2CCCCCC2)C1 ZINC000335581021 181435733 /nfs/dbraw/zinc/43/57/33/181435733.db2.gz LASPKMBKWRQNTO-DGCLKSJQSA-N 2 0 210.365 2.426 20 0 BEADRP COc1ccccc1C[NH2+]CCCCCC[NH3+] ZINC000107787798 368517588 /nfs/dbraw/zinc/51/75/88/368517588.db2.gz FLSYRUDBNQYGJQ-UHFFFAOYSA-N 2 0 236.359 2.304 20 0 BEADRP Cc1cscc1C[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000087309624 368891170 /nfs/dbraw/zinc/89/11/70/368891170.db2.gz IAONOMPNFUEJHQ-VXGBXAGGSA-N 2 0 224.373 2.416 20 0 BEADRP C[N@@H+]1CCCC[C@H](C[NH2+]C[C@@H]2CCSC2)C1 ZINC000623657108 368997196 /nfs/dbraw/zinc/99/71/96/368997196.db2.gz JWUZLTPSELDXBW-OLZOCXBDSA-N 2 0 242.432 2.061 20 0 BEADRP C[N@@H+]1CCCC[C@@H](C[NH2+]C[C@@H]2CCSC2)C1 ZINC000623657110 368997442 /nfs/dbraw/zinc/99/74/42/368997442.db2.gz JWUZLTPSELDXBW-STQMWFEESA-N 2 0 242.432 2.061 20 0 BEADRP C[N@@H+]1CCCC[C@H](C[NH2+][C@@H]2CCCSC2)C1 ZINC000623656990 368997834 /nfs/dbraw/zinc/99/78/34/368997834.db2.gz HHZAHOAAHCZMRE-CHWSQXEVSA-N 2 0 242.432 2.204 20 0 BEADRP CC(C)OC[C@H](C)[NH2+]C[C@H]1CCCC[N@H+](C)C1 ZINC000623657095 368997991 /nfs/dbraw/zinc/99/79/91/368997991.db2.gz JRBYVINUVSXNDU-UONOGXRCSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@H]2CCCC[N@H+](C)C2)C1 ZINC000623656020 368992745 /nfs/dbraw/zinc/99/27/45/368992745.db2.gz LBWDAIHWDVZINL-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1CCCC[N@H+](C)C1 ZINC000623656342 368993444 /nfs/dbraw/zinc/99/34/44/368993444.db2.gz SFHFTFUTXJPCJT-HZSPNIEDSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[N@H+](CC2CCCCC2)C[C@H]1C[NH3+] ZINC000631839738 369170020 /nfs/dbraw/zinc/17/00/20/369170020.db2.gz KFMZMSKVSFPESR-DGCLKSJQSA-N 2 0 210.365 2.093 20 0 BEADRP C[C@H]1C[N@H+](CC2CCCCC2)C[C@H]1C[NH3+] ZINC000631839739 369170371 /nfs/dbraw/zinc/17/03/71/369170371.db2.gz KFMZMSKVSFPESR-WCQYABFASA-N 2 0 210.365 2.093 20 0 BEADRP CC(C)[NH2+]CCC[NH2+][C@@H](C)Cc1ccoc1 ZINC000567579930 326221955 /nfs/dbraw/zinc/22/19/55/326221955.db2.gz YHKSFRHSBFQATD-LBPRGKRZSA-N 2 0 224.348 2.188 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H](C)CCC(C)C ZINC000567638963 326236197 /nfs/dbraw/zinc/23/61/97/326236197.db2.gz AYKLWNZEOXWBPB-LBPRGKRZSA-N 2 0 200.370 2.400 20 0 BEADRP C[C@H](C1CC1)[N@H+](CCc1cncn1C)C1CC1 ZINC000459292334 203247366 /nfs/dbraw/zinc/24/73/66/203247366.db2.gz DINUZTGZGAHKBD-LLVKDONJSA-N 2 0 233.359 2.226 20 0 BEADRP [NH3+]Cc1ccc(-c2ccccc2C[NH3+])cc1 ZINC000005764196 181480183 /nfs/dbraw/zinc/48/01/83/181480183.db2.gz PDVYXLNWBNQULV-UHFFFAOYSA-N 2 0 212.296 2.271 20 0 BEADRP C[C@H](c1cccc(F)c1)N1C[C@H]2C[NH2+]C[C@@H]2C1 ZINC000108278772 369384956 /nfs/dbraw/zinc/38/49/56/369384956.db2.gz JZLMABQRXXQCLW-RAIGVLPGSA-N 2 0 234.318 2.038 20 0 BEADRP CCc1ccc(CC[N@@H+]2C[C@@H](C)[C@@H](C[NH3+])C2)cc1 ZINC000631840941 369340241 /nfs/dbraw/zinc/34/02/41/369340241.db2.gz WQTONGNTXKWMFM-CJNGLKHVSA-N 2 0 246.398 2.318 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CCC[C@@H](F)C1 ZINC000567735663 326253090 /nfs/dbraw/zinc/25/30/90/326253090.db2.gz OQJSYQNPUFPWCW-LOWDOPEQSA-N 2 0 228.355 2.374 20 0 BEADRP C[C@@H]([NH2+]CC(C1CC1)C1CC1)[C@@H]1CCC[NH2+]1 ZINC000400631321 369351356 /nfs/dbraw/zinc/35/13/56/369351356.db2.gz LTBKAWNRIMEAJT-YGRLFVJLSA-N 2 0 222.376 2.153 20 0 BEADRP CCO[C@H]1C[C@@H]([NH2+]C2CC[NH+](C(C)C)CC2)C1 ZINC000459630767 203324144 /nfs/dbraw/zinc/32/41/44/203324144.db2.gz IXBYNWRVFXZZAA-OKILXGFUSA-N 2 0 240.391 2.016 20 0 BEADRP Cc1ccc(C)c(OCCN2C[C@H]([NH3+])C[C@@H]2C)c1 ZINC000631857634 369436143 /nfs/dbraw/zinc/43/61/43/369436143.db2.gz LENOYIWQOXMQMO-UONOGXRCSA-N 2 0 248.370 2.104 20 0 BEADRP C[N@@H+]1CCC[C@H](CC[NH2+][C@@H]2CCCSC2)C1 ZINC000459724463 203343198 /nfs/dbraw/zinc/34/31/98/203343198.db2.gz DSTOYNDQZPDNJP-CHWSQXEVSA-N 2 0 242.432 2.204 20 0 BEADRP C[N@@H+]1CCC[C@H](CC[NH2+]Cc2cccc(O)c2)C1 ZINC000459728004 203343534 /nfs/dbraw/zinc/34/35/34/203343534.db2.gz HXBCARLSZTUGMF-CYBMUJFWSA-N 2 0 248.370 2.214 20 0 BEADRP C[N@@H+]1CCC[C@H](CC[NH2+]CC(C)(C)C)C1 ZINC000459732719 203343941 /nfs/dbraw/zinc/34/39/41/203343941.db2.gz MPXHIENATIXJQZ-GFCCVEGCSA-N 2 0 212.381 2.354 20 0 BEADRP Cc1ccoc1C[NH2+]CC[C@@H]1CCC[N@@H+](C)C1 ZINC000459734149 203346937 /nfs/dbraw/zinc/34/69/37/203346937.db2.gz OFINLGIZZDWWAH-ZDUSSCGKSA-N 2 0 236.359 2.410 20 0 BEADRP CC1(C)CC(CN2CCC[C@H]3C[NH2+]CC[C@H]32)C1 ZINC000631889448 370976249 /nfs/dbraw/zinc/97/62/49/370976249.db2.gz GHLORJRQVBYHBA-UONOGXRCSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)C1CC1 ZINC000459779680 203365931 /nfs/dbraw/zinc/36/59/31/203365931.db2.gz LNDYZWCONYDWEF-NEPJUHHUSA-N 2 0 210.365 2.106 20 0 BEADRP C[N@@H+]1CCC[C@H]1CC[NH2+][C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000459795039 203373863 /nfs/dbraw/zinc/37/38/63/203373863.db2.gz XGVGBIPVMITCNQ-ZOBORPQBSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@@H]1CSC[C@@H]1[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC000459798038 203373962 /nfs/dbraw/zinc/37/39/62/203373962.db2.gz XKELHXXGWGDTRY-UPJWGTAASA-N 2 0 242.432 2.059 20 0 BEADRP C[C@H](CC1CC1)[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC000459795986 203374404 /nfs/dbraw/zinc/37/44/04/203374404.db2.gz VRKWLJLPCUYNJB-OCCSQVGLSA-N 2 0 224.392 2.497 20 0 BEADRP C[N@@H+]1CCC[C@@H](CC[NH2+]C2CC(C)(C)C2)C1 ZINC000459780977 203367284 /nfs/dbraw/zinc/36/72/84/203367284.db2.gz MEKJZBZXWOZNPF-LBPRGKRZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]([NH2+]C[C@@H](C1CC1)N(C)C)C1CCCC1 ZINC000166319356 203387268 /nfs/dbraw/zinc/38/72/68/203387268.db2.gz WZTGERVXOBRHLU-RISCZKNCSA-N 2 0 224.392 2.495 20 0 BEADRP CC[C@H]([NH2+]C[C@@H](C1CC1)N(C)C)C1CC1 ZINC000166324195 203387351 /nfs/dbraw/zinc/38/73/51/203387351.db2.gz CFKMIRVWOIUUAP-STQMWFEESA-N 2 0 210.365 2.105 20 0 BEADRP CSCC[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCCC[NH2+]1 ZINC000250930081 369622470 /nfs/dbraw/zinc/62/24/70/369622470.db2.gz CHRDHUPQJFZAFH-JHJVBQTASA-N 2 0 242.432 2.250 20 0 BEADRP CC[C@H](C[NH2+][C@]12CCC[C@@H]1C[NH2+]C2)CC(F)F ZINC000631867188 370211708 /nfs/dbraw/zinc/21/17/08/370211708.db2.gz MCUODCFFXVLBAL-LOWVWBTDSA-N 2 0 246.345 2.400 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+][C@H]1CC[NH2+]C[C@@H]1C ZINC000310484322 370348328 /nfs/dbraw/zinc/34/83/28/370348328.db2.gz DOKFLBYXWIJWGP-SCRDCRAPSA-N 2 0 236.359 2.188 20 0 BEADRP CC1CC(C[NH2+][C@@H]2CC[N@H+](C)[C@H]3CCC[C@H]32)C1 ZINC000621770703 370513926 /nfs/dbraw/zinc/51/39/26/370513926.db2.gz WFDRFPFFVSSKDE-PCGVCOGMSA-N 2 0 236.403 2.495 20 0 BEADRP Cc1cc(C[N@@H+]2CCCC[C@H]2CC[NH3+])ccn1 ZINC000621775663 370523087 /nfs/dbraw/zinc/52/30/87/370523087.db2.gz WCDDWMFKCVEZEV-AWEZNQCLSA-N 2 0 233.359 2.093 20 0 BEADRP [NH3+][C@]12CCC[C@@H]1C[N@H+](CCc1ccccc1)C2 ZINC000621779041 370529227 /nfs/dbraw/zinc/52/92/27/370529227.db2.gz YXGQNIDZNHJHRW-CABCVRRESA-N 2 0 230.355 2.042 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@@H](C)[C@@H]1CCCCO1 ZINC000623858807 371129794 /nfs/dbraw/zinc/12/97/94/371129794.db2.gz WOMFMHBBQFCXKY-KBPBESRZSA-N 2 0 242.407 2.264 20 0 BEADRP C(C[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)CC1CC1 ZINC000569093167 326389306 /nfs/dbraw/zinc/38/93/06/326389306.db2.gz AJCUKNVEPFBGNC-FUNVUKJBSA-N 2 0 208.349 2.049 20 0 BEADRP CCC[C@@H](C)[NH2+]C[C@@H]1CCCC[N@H+](C)C1 ZINC000624120034 371319404 /nfs/dbraw/zinc/31/94/04/371319404.db2.gz QEFGPVZCTRNONB-OLZOCXBDSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)C1CCC1 ZINC000624121369 371322894 /nfs/dbraw/zinc/32/28/94/371322894.db2.gz UTCUETFJAMOVIR-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)c1ccncc1 ZINC000624122645 371323144 /nfs/dbraw/zinc/32/31/44/371323144.db2.gz XNAKRCPUCLYEIP-KGLIPLIRSA-N 2 0 247.386 2.464 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H]1CCCN1C)[C@H]1CC1(C)C ZINC000624271726 371449822 /nfs/dbraw/zinc/44/98/22/371449822.db2.gz AVVMUYKHQGXXDT-YNEHKIRRSA-N 2 0 224.392 2.495 20 0 BEADRP CN1CCC[C@H]1C[NH2+][C@@H]1[C@@H]2CCC[C@@H]2C1(C)C ZINC000624271754 371450199 /nfs/dbraw/zinc/45/01/99/371450199.db2.gz CNGHRRQPCDGSJF-RFQIPJPRSA-N 2 0 236.403 2.495 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]Cc2ccccc2)C12CCC2 ZINC000405376880 372156638 /nfs/dbraw/zinc/15/66/38/372156638.db2.gz BQCBAMXXVGRKBG-CHWSQXEVSA-N 2 0 216.328 2.046 20 0 BEADRP Cc1ccc(C[N@H+]2C[C@H](C)[C@H](C[NH3+])C2)cc1 ZINC000631843888 372639886 /nfs/dbraw/zinc/63/98/86/372639886.db2.gz SYWXCOLVSSPUKJ-GXTWGEPZSA-N 2 0 218.344 2.022 20 0 BEADRP Cc1ccc(C)c(C[N@@H+]2C[C@@H](C[NH3+])[C@H](C)C2)c1 ZINC000631842736 372640350 /nfs/dbraw/zinc/64/03/50/372640350.db2.gz FBSGSNLGATZWEH-UKRRQHHQSA-N 2 0 232.371 2.330 20 0 BEADRP Cc1ccccc1C[N@@H+]1C[C@@H](C[NH3+])[C@H](C)C1 ZINC000631842691 372640559 /nfs/dbraw/zinc/64/05/59/372640559.db2.gz DNOHWCIEPPAUDF-TZMCWYRMSA-N 2 0 218.344 2.022 20 0 BEADRP COc1ccc(C)cc1C[N@H+]1C[C@@H](C[NH3+])[C@H](C)C1 ZINC000631844387 372643164 /nfs/dbraw/zinc/64/31/64/372643164.db2.gz WZUUEYUNOOBRKB-TZMCWYRMSA-N 2 0 248.370 2.030 20 0 BEADRP CC(C)CC[N@@H+]1CCC[C@@H]2C[NH2+]CC[C@H]21 ZINC000631884988 372680280 /nfs/dbraw/zinc/68/02/80/372680280.db2.gz RKRRVSKXYSJTBB-CHWSQXEVSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H](CCc1ccccc1F)[NH2+]CCC[NH3+] ZINC000437772185 206072165 /nfs/dbraw/zinc/07/21/65/206072165.db2.gz JKOXEGQNJQXMDL-NSHDSACASA-N 2 0 224.323 2.085 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CC2CCC2)[C@H](C)C1 ZINC000166956175 206140797 /nfs/dbraw/zinc/14/07/97/206140797.db2.gz DLVDLELQCTZUIC-DGCLKSJQSA-N 2 0 210.365 2.106 20 0 BEADRP CCC[N@H+](CC1CC1)CC1CC[NH2+]CC1 ZINC000042491161 169138111 /nfs/dbraw/zinc/13/81/11/169138111.db2.gz MNAFJTGWRTYPOG-UHFFFAOYSA-N 2 0 210.365 2.108 20 0 BEADRP CCC[N@H+](CCC[NH+](C)C)Cc1ccn(C)c1 ZINC000290519725 169156317 /nfs/dbraw/zinc/15/63/17/169156317.db2.gz PZSHDAOZDKGYCB-UHFFFAOYSA-N 2 0 237.391 2.189 20 0 BEADRP CCC[NH+]1CCC(C[NH2+][C@H](C)[C@@H](C)OC)CC1 ZINC000361156064 169187328 /nfs/dbraw/zinc/18/73/28/169187328.db2.gz QPROAIYPBCARSO-CHWSQXEVSA-N 2 0 242.407 2.121 20 0 BEADRP CCC[NH+]1CCC([NH2+]C[C@@H](OC)C(C)C)CC1 ZINC000310201530 169187781 /nfs/dbraw/zinc/18/77/81/169187781.db2.gz AYJATNIRSJJMBH-CQSZACIVSA-N 2 0 242.407 2.121 20 0 BEADRP CCC[NH+]1CCC([NH2+]CCCCF)CC1 ZINC000336665291 169188599 /nfs/dbraw/zinc/18/85/99/169188599.db2.gz DETCBCFZCIIIKX-UHFFFAOYSA-N 2 0 216.344 2.200 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H]2CSC[C@@H]2C)CC1 ZINC000304575760 169189201 /nfs/dbraw/zinc/18/92/01/169189201.db2.gz XQVOAAAVJHQVHV-WCQYABFASA-N 2 0 242.432 2.202 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H](C)[C@H]2CCCO2)CC1 ZINC000020205804 169189417 /nfs/dbraw/zinc/18/94/17/169189417.db2.gz XHMINQOXFUIFEL-GXTWGEPZSA-N 2 0 240.391 2.018 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H]2CC[C@@H]2C)CC1 ZINC000336656194 169189564 /nfs/dbraw/zinc/18/95/64/169189564.db2.gz AHRFHMUPABEXLD-WCQYABFASA-N 2 0 210.365 2.249 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H]2CC[C@H]2C)CC1 ZINC000336656195 169189751 /nfs/dbraw/zinc/18/97/51/169189751.db2.gz AHRFHMUPABEXLD-YPMHNXCESA-N 2 0 210.365 2.249 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H]2CC[C@H](F)C2)CC1 ZINC000336742729 169189943 /nfs/dbraw/zinc/18/99/43/169189943.db2.gz SHCXHPXTZVDVGW-WCQYABFASA-N 2 0 228.355 2.341 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H]2CSC[C@H]2C)CC1 ZINC000304575758 169190268 /nfs/dbraw/zinc/19/02/68/169190268.db2.gz XQVOAAAVJHQVHV-DGCLKSJQSA-N 2 0 242.432 2.202 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H]2CSC2(C)C)CC1 ZINC000336671473 169190316 /nfs/dbraw/zinc/19/03/16/169190316.db2.gz AMEWVSJOQOOVJV-GFCCVEGCSA-N 2 0 242.432 2.344 20 0 BEADRP c1c[nH]c([C@@H]2CCC[N@H+]2CCn2ccnc2)c1 ZINC000162799854 183327752 /nfs/dbraw/zinc/32/77/52/183327752.db2.gz SFBAEIQPRLBJOI-ZDUSSCGKSA-N 2 0 230.315 2.048 20 0 BEADRP CCC[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000157450992 169195717 /nfs/dbraw/zinc/19/57/17/169195717.db2.gz BUYPMIVJFCUHGT-CYBMUJFWSA-N 2 0 210.365 2.347 20 0 BEADRP c1cc(C[N@@H+]2CCCC[C@H]2[C@@H]2CC[NH2+]C2)ccn1 ZINC000334868521 183342210 /nfs/dbraw/zinc/34/22/10/183342210.db2.gz LKQYYGFUGQJFSM-CABCVRRESA-N 2 0 245.370 2.046 20 0 BEADRP c1cc(C[N@H+]2CC[C@H]3C[NH2+]C[C@H]3CC2)cs1 ZINC000309508314 183346361 /nfs/dbraw/zinc/34/63/61/183346361.db2.gz OCGLYWGFQWLFAU-BETUJISGSA-N 2 0 236.384 2.180 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+]CC2(SC)CC2)C1 ZINC000336775834 169206370 /nfs/dbraw/zinc/20/63/70/169206370.db2.gz CURNRDASJNVYAR-GFCCVEGCSA-N 2 0 242.432 2.204 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+]CCSCC)C1 ZINC000336765289 169207267 /nfs/dbraw/zinc/20/72/67/169207267.db2.gz QSFMMYVUDCVAFL-GFCCVEGCSA-N 2 0 230.421 2.061 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H]2CCC2(C)C)C1 ZINC000309946595 169208216 /nfs/dbraw/zinc/20/82/16/169208216.db2.gz DOXOSQANLWWOOE-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP c1cc2c(o1)CCC[C@H]2[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000132035407 183373344 /nfs/dbraw/zinc/37/33/44/183373344.db2.gz YZQVWJPQYVNPHK-DGCLKSJQSA-N 2 0 234.343 2.246 20 0 BEADRP c1ccc(C2CC[NH+](C[C@@H]3CC[NH2+]C3)CC2)cc1 ZINC000169798597 183390499 /nfs/dbraw/zinc/39/04/99/183390499.db2.gz OHMAMUXDYVWLOM-CQSZACIVSA-N 2 0 244.382 2.476 20 0 BEADRP c1ccc(CC[N@@H+]2CC[C@]3(C2)CCC[NH2+]C3)cc1 ZINC000067674191 183393942 /nfs/dbraw/zinc/39/39/42/183393942.db2.gz CURGXZNSJBBSAH-MRXNPFEDSA-N 2 0 244.382 2.305 20 0 BEADRP CC[C@H](C)[C@H](C)[N@@H+]1C[C@H]2CC[NH+](C)C[C@H]2C1 ZINC001644099395 1172526474 /nfs/dbraw/zinc/52/64/74/1172526474.db2.gz PICIYNDEBMLFQJ-FQUUOJAGSA-N 2 0 224.392 2.305 20 0 BEADRP CCN(C)CC[NH2+][C@@H]1CC[C@@H](C)C[C@@H]1C ZINC000222060293 134329379 /nfs/dbraw/zinc/32/93/79/134329379.db2.gz FBKPFOKVPGGGRU-FRRDWIJNSA-N 2 0 212.381 2.352 20 0 BEADRP C[N@H+](C[C@@H]1CCC(F)(F)C1)CC(C)(C)C[NH3+] ZINC000301012924 383842284 /nfs/dbraw/zinc/84/22/84/383842284.db2.gz YAXAEYLMMJUENO-SNVBAGLBSA-N 2 0 234.334 2.339 20 0 BEADRP C[N@H+](C[C@H]1CCC(F)(F)C1)CC(C)(C)C[NH3+] ZINC000301012922 383842702 /nfs/dbraw/zinc/84/27/02/383842702.db2.gz YAXAEYLMMJUENO-JTQLQIEISA-N 2 0 234.334 2.339 20 0 BEADRP [NH3+]C[C@@H]1CCCCN1C[C@H]1CCC(F)(F)C1 ZINC000301020436 383848649 /nfs/dbraw/zinc/84/86/49/383848649.db2.gz ZSWOBXWADCFZCG-QWRGUYRKSA-N 2 0 232.318 2.235 20 0 BEADRP CC(C)[N@@H+]1CC[C@H](C[NH2+]C2CC(C)(C)C2)C1 ZINC000309538849 383885897 /nfs/dbraw/zinc/88/58/97/383885897.db2.gz GAYVMJVQIPZADZ-GFCCVEGCSA-N 2 0 224.392 2.495 20 0 BEADRP C[N@H+](CCc1ccccc1)[C@@H]1CCC[NH2+]CC1 ZINC000088243168 383889201 /nfs/dbraw/zinc/88/92/01/383889201.db2.gz HTZZTINVKYPBKB-OAHLLOKOSA-N 2 0 232.371 2.303 20 0 BEADRP Cc1ccc([C@H](C)[NH2+][C@@H]2CC[C@H](C[NH3+])C2)c(C)n1 ZINC000643542788 383983864 /nfs/dbraw/zinc/98/38/64/383983864.db2.gz ZQSCPSHUKJGPOC-MELADBBJSA-N 2 0 247.386 2.476 20 0 BEADRP CSCC[C@H](C)[N@H+](C)C[C@H]1CC[NH2+][C@H](C)C1 ZINC000300056444 383974758 /nfs/dbraw/zinc/97/47/58/383974758.db2.gz QAVJSYGRDGBXOB-AGIUHOORSA-N 2 0 244.448 2.448 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CCC[N@H+](Cc2ccsc2)C1 ZINC000069627030 384051139 /nfs/dbraw/zinc/05/11/39/384051139.db2.gz ACIPRISQWRHXBB-CMPLNLGQSA-N 2 0 224.373 2.307 20 0 BEADRP C[C@@H]([NH2+]CCCC[NH+](C)C)c1cncc(F)c1 ZINC000222903990 384103101 /nfs/dbraw/zinc/10/31/01/384103101.db2.gz OGYRNWCVQNFEMI-LLVKDONJSA-N 2 0 239.338 2.213 20 0 BEADRP C[C@H](C[N@H+](C)CCC[NH3+])c1ccccc1 ZINC000227742050 134392532 /nfs/dbraw/zinc/39/25/32/134392532.db2.gz LBMIKNACGRZQEA-GFCCVEGCSA-N 2 0 206.333 2.071 20 0 BEADRP CC(C)[N@@H+]1CC[C@H](CNc2ccccn2)C1 ZINC000040624133 384157306 /nfs/dbraw/zinc/15/73/06/384157306.db2.gz YACYDBUGRRMHHN-GFCCVEGCSA-N 2 0 219.332 2.224 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]CC1CCCC1 ZINC000132677830 384201054 /nfs/dbraw/zinc/20/10/54/384201054.db2.gz KRLJCZIYNXKGSH-YPMHNXCESA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)CC[N@@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000082533455 384233775 /nfs/dbraw/zinc/23/37/75/384233775.db2.gz VVZLSZOTCGEOKF-UHFFFAOYSA-N 2 0 210.365 2.108 20 0 BEADRP CCCCC[N@@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000082533456 384233973 /nfs/dbraw/zinc/23/39/73/384233973.db2.gz WKLHFAIEEKAGTB-UHFFFAOYSA-N 2 0 210.365 2.252 20 0 BEADRP C[C@H]([NH3+])[C@@H](Cc1ccccc1)[NH2+]CCC1CC1 ZINC000422921993 384215957 /nfs/dbraw/zinc/21/59/57/384215957.db2.gz ROOWJUKWKDNAEV-SWLSCSKDSA-N 2 0 232.371 2.335 20 0 BEADRP C[C@@H]([NH2+]CCCC[NH+](C)C)c1cncs1 ZINC000132994874 384220652 /nfs/dbraw/zinc/22/06/52/384220652.db2.gz MVALCZYLKAYMJN-SNVBAGLBSA-N 2 0 227.377 2.136 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]Cc1ccnc2ccccc12 ZINC000518726589 384229392 /nfs/dbraw/zinc/22/93/92/384229392.db2.gz CMXGPZMWHQMEQD-LBPRGKRZSA-N 2 0 243.354 2.180 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1)CC(F)F ZINC000647318596 384246803 /nfs/dbraw/zinc/24/68/03/384246803.db2.gz UKDHTQSXOGFTNU-HBNTYKKESA-N 2 0 234.334 2.350 20 0 BEADRP CC[C@@H]1C[N@H+](CC2(OC)CCCC2)CC[C@@H]1[NH3+] ZINC000319456330 384250304 /nfs/dbraw/zinc/25/03/04/384250304.db2.gz OCXSXEAPRMUKQX-OLZOCXBDSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CCc2cn(C)cn2)C[C@@H]1C ZINC000313300212 384241890 /nfs/dbraw/zinc/24/18/90/384241890.db2.gz OGUGQJXXFQJMRP-AGIUHOORSA-N 2 0 235.375 2.377 20 0 BEADRP CC[C@@H]([NH2+]CC1CC[NH+](C)CC1)C1CC1 ZINC000083056081 384278510 /nfs/dbraw/zinc/27/85/10/384278510.db2.gz FULHQODTNVURHP-CYBMUJFWSA-N 2 0 210.365 2.106 20 0 BEADRP CC[N@H+](C)C[C@H]1CC[NH+](CCCSC)C1 ZINC000173909043 384284000 /nfs/dbraw/zinc/28/40/00/384284000.db2.gz HKURKJNKVIKJBU-GFCCVEGCSA-N 2 0 230.421 2.013 20 0 BEADRP CCSCC[N@@H+]1CC[C@H](C[NH+](C)CC)C1 ZINC000173919724 384288721 /nfs/dbraw/zinc/28/87/21/384288721.db2.gz PUTASHABFMLWHN-GFCCVEGCSA-N 2 0 230.421 2.013 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@H]2CC2(C)C)CC[N@@H+]1C ZINC000300360419 384360762 /nfs/dbraw/zinc/36/07/62/384360762.db2.gz YHHRVYUEZBNPDP-IJLUTSLNSA-N 2 0 210.365 2.105 20 0 BEADRP C/C=C\C[NH2+][C@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000384731853 384362738 /nfs/dbraw/zinc/36/27/38/384362738.db2.gz JVAYRUGJWSTPJC-FGTRRKKMSA-N 2 0 210.365 2.463 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH+](C)CCCSC)[C@H](C)C1 ZINC000174780943 384363604 /nfs/dbraw/zinc/36/36/04/384363604.db2.gz JOGBDUCKUMMYFF-OLZOCXBDSA-N 2 0 244.448 2.402 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH+](C)CC(C)C)[C@H](C)C1 ZINC000174778236 384363634 /nfs/dbraw/zinc/36/36/34/384363634.db2.gz LMYVGJUYUHMYBT-CHWSQXEVSA-N 2 0 212.381 2.305 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CC[NH2+]C1)c1cccs1 ZINC000095068386 384330639 /nfs/dbraw/zinc/33/06/39/384330639.db2.gz SGONINODYFRNLP-UWVGGRQHSA-N 2 0 210.346 2.008 20 0 BEADRP C[C@H]1CCC[C@@H](C[NH+]2CCC([NH3+])CC2)C1 ZINC000084344415 384391713 /nfs/dbraw/zinc/39/17/13/384391713.db2.gz XZOHCXNNXJSUOL-NWDGAFQWSA-N 2 0 210.365 2.236 20 0 BEADRP C[NH+](C)CCCC[NH2+]Cc1cccc(F)c1F ZINC000045697883 384402300 /nfs/dbraw/zinc/40/23/00/384402300.db2.gz FIANEINMGHIHIE-UHFFFAOYSA-N 2 0 242.313 2.396 20 0 BEADRP CCC[N@H+](C)C[C@H]1CC[NH+](CCCSC)C1 ZINC000174966597 384380032 /nfs/dbraw/zinc/38/00/32/384380032.db2.gz GIMLPFOPPJYJJU-CYBMUJFWSA-N 2 0 244.448 2.403 20 0 BEADRP FC(F)(F)C1CC[NH+](CCn2ccnc2)CC1 ZINC000120826661 384382971 /nfs/dbraw/zinc/38/29/71/384382971.db2.gz KCILKVRLZHUZRO-UHFFFAOYSA-N 2 0 247.264 2.157 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)CC(F)F ZINC000647227019 384437534 /nfs/dbraw/zinc/43/75/34/384437534.db2.gz MHPXLQQJUSHISC-TUAOUCFPSA-N 2 0 246.345 2.494 20 0 BEADRP C[NH2+]CCCNCc1ccsc1Cl ZINC000312750457 384459613 /nfs/dbraw/zinc/45/96/13/384459613.db2.gz UQKYEAOVCJECPJ-UHFFFAOYSA-N 2 0 218.753 2.101 20 0 BEADRP Cc1cc(Cl)ccc1C[NH2+]CCCC[NH3+] ZINC000235790577 134415147 /nfs/dbraw/zinc/41/51/47/134415147.db2.gz HZDJGXRIKFOQAF-UHFFFAOYSA-N 2 0 226.751 2.477 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+]CCCC[NH3+])s1 ZINC000037715093 384512759 /nfs/dbraw/zinc/51/27/59/384512759.db2.gz ODMAVXTVYXXCCY-SNVBAGLBSA-N 2 0 212.362 2.446 20 0 BEADRP CC[C@@](C)(C[NH2+]CC1(C)CC[NH+](C)CC1)OC ZINC000319848404 384514831 /nfs/dbraw/zinc/51/48/31/384514831.db2.gz KSBVOEJTYIWUFC-AWEZNQCLSA-N 2 0 242.407 2.123 20 0 BEADRP CC1=CC[C@H]([NH2+]CCN2CC[C@@H](C)C2)CC1 ZINC000556833866 384514939 /nfs/dbraw/zinc/51/49/39/384514939.db2.gz NWBACSFLSNBBEM-KGLIPLIRSA-N 2 0 222.376 2.417 20 0 BEADRP CC1(C)CCC[N@H+](CCn2ccnc2)C1 ZINC000161833730 384532609 /nfs/dbraw/zinc/53/26/09/384532609.db2.gz PVLNMLPZJPULMZ-UHFFFAOYSA-N 2 0 207.321 2.005 20 0 BEADRP CC[C@@H]1CCCC[C@@H]1C[NH+]1C[C@H]2C[NH2+]C[C@@H]2C1 ZINC000401436754 384551352 /nfs/dbraw/zinc/55/13/52/384551352.db2.gz JZYDKHNXRJFDNF-KBUPBQIOSA-N 2 0 236.403 2.354 20 0 BEADRP CC[C@H]([NH2+]C[C@@H](C)C[NH3+])c1ccccc1 ZINC000308981056 384556347 /nfs/dbraw/zinc/55/63/47/384556347.db2.gz KIPJQNJOOSEZJX-AAEUAGOBSA-N 2 0 206.333 2.322 20 0 BEADRP CCC[C@@H]1[C@@H](C)CCC[N@@H+]1CCC[NH2+]C ZINC000309852659 384669544 /nfs/dbraw/zinc/66/95/44/384669544.db2.gz YQEKRGJPOBHMKI-QWHCGFSZSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H]1CCC[C@H](C[N@@H+]2CC[C@H]3CC[NH2+][C@H]3C2)C1 ZINC000647534537 384645264 /nfs/dbraw/zinc/64/52/64/384645264.db2.gz QDUWHPUUIDELQL-BARDWOONSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[N@@H+]1CC[C@H]2CC[NH2+][C@H]2C1 ZINC000647534856 384645503 /nfs/dbraw/zinc/64/55/03/384645503.db2.gz YAAYCYPJVHIZHV-TUVASFSCSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[N@@H+]1CC[C@@H]2CC[NH2+][C@@H]2C1 ZINC000647534855 384645544 /nfs/dbraw/zinc/64/55/44/384645544.db2.gz YAAYCYPJVHIZHV-LXTVHRRPSA-N 2 0 236.403 2.497 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]C2CCSCC2)[C@@H](C)C1 ZINC000246981627 384655320 /nfs/dbraw/zinc/65/53/20/384655320.db2.gz IWSORUZLIYYQOS-WCQYABFASA-N 2 0 242.432 2.202 20 0 BEADRP CSCCC[NH2+][C@@H]1CC[N@H+](C)[C@@H]2CCC[C@@H]21 ZINC000309935862 384725701 /nfs/dbraw/zinc/72/57/01/384725701.db2.gz ZTBPYAGZZOTQGY-JHJVBQTASA-N 2 0 242.432 2.202 20 0 BEADRP CSCCC[NH2+][C@@H]1CC[N@H+](C)[C@H]2CCC[C@H]21 ZINC000309935867 384725877 /nfs/dbraw/zinc/72/58/77/384725877.db2.gz ZTBPYAGZZOTQGY-XQQFMLRXSA-N 2 0 242.432 2.202 20 0 BEADRP CC[N@H+](CC1CCC1)CC1CC[NH2+]CC1 ZINC000086703075 384678931 /nfs/dbraw/zinc/67/89/31/384678931.db2.gz CBLKHRJCIXYOAZ-UHFFFAOYSA-N 2 0 210.365 2.108 20 0 BEADRP CC(F)(F)CC[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000357718318 384683437 /nfs/dbraw/zinc/68/34/37/384683437.db2.gz VUOHEWMHNYBVDU-QWRGUYRKSA-N 2 0 232.318 2.248 20 0 BEADRP C[NH+](C)CCC[NH2+][C@H]1CCCCC1(C)C ZINC000086842574 384703747 /nfs/dbraw/zinc/70/37/47/384703747.db2.gz FMTJMSQQLDBYGE-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@@H]1CC[C@H]1C1CCC1 ZINC000309909409 384706118 /nfs/dbraw/zinc/70/61/18/384706118.db2.gz LTJTVPRCEDSZIW-UONOGXRCSA-N 2 0 224.392 2.497 20 0 BEADRP C([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000403498501 384707237 /nfs/dbraw/zinc/70/72/37/384707237.db2.gz XKZVTOGRPNIVET-YTQIUSBHSA-N 2 0 248.414 2.400 20 0 BEADRP C([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000403498499 384707719 /nfs/dbraw/zinc/70/77/19/384707719.db2.gz XKZVTOGRPNIVET-VTMBPIDISA-N 2 0 248.414 2.400 20 0 BEADRP C[NH+](C)CCC[NH2+]CC1=Cc2ccccc2OC1 ZINC000102419359 384711580 /nfs/dbraw/zinc/71/15/80/384711580.db2.gz QSQHOJMFXFFZNU-UHFFFAOYSA-N 2 0 246.354 2.004 20 0 BEADRP CC(C)C[N@@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000647543252 384713529 /nfs/dbraw/zinc/71/35/29/384713529.db2.gz KAALCUQFAKAUCO-ZIAGYGMSSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H]([NH3+])c1ccc(N[C@H]2C[NH2+]C[C@@H](C)C2)cc1 ZINC000647546604 384734758 /nfs/dbraw/zinc/73/47/58/384734758.db2.gz RIPHRRMZVFBEOE-MISXGVKJSA-N 2 0 233.359 2.116 20 0 BEADRP CC[C@H]1[C@@H](C)CC[N@@H+]1CCn1ccnc1 ZINC000185632835 384749404 /nfs/dbraw/zinc/74/94/04/384749404.db2.gz OYUPROJFPIFWDV-RYUDHWBXSA-N 2 0 207.321 2.004 20 0 BEADRP CC[NH+]1CCC(C[NH2+]C[C@@](C)(CC)OC)CC1 ZINC000319961391 384753956 /nfs/dbraw/zinc/75/39/56/384753956.db2.gz VYWVUBPGJQXKFJ-CQSZACIVSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)[C@@H]1CC1(C)C ZINC000397596465 384756620 /nfs/dbraw/zinc/75/66/20/384756620.db2.gz KIGJCEIXIAHZAF-SCRDCRAPSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]Cc1cccc2cnccc21 ZINC000647552022 384757976 /nfs/dbraw/zinc/75/79/76/384757976.db2.gz AOADMBAAVFLLTI-NWDGAFQWSA-N 2 0 243.354 2.450 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+][C@@H](C)[C@H]1CCC[NH2+]C1 ZINC000423210433 384760407 /nfs/dbraw/zinc/76/04/07/384760407.db2.gz GHASCPWWXBKDCY-XUXIUFHCSA-N 2 0 224.392 2.399 20 0 BEADRP CC1(C)CCC[C@H]1[C@H]1CC[N@H+](CCC[NH3+])C1 ZINC000647552762 384762465 /nfs/dbraw/zinc/76/24/65/384762465.db2.gz VNDBGEMJNTYZRJ-STQMWFEESA-N 2 0 224.392 2.483 20 0 BEADRP CC(C)C[C@H](C)C[N@@H+]1CC[C@H]([C@@H](C)[NH3+])C1 ZINC000301013746 384829951 /nfs/dbraw/zinc/82/99/51/384829951.db2.gz ZEZNXFMIMGGYOE-XQQFMLRXSA-N 2 0 212.381 2.338 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000423243974 384785407 /nfs/dbraw/zinc/78/54/07/384785407.db2.gz HAHPVDAOXQVEHR-AVGNSLFASA-N 2 0 210.365 2.010 20 0 BEADRP Cc1ccc(C[N@H+]2C[C@H](C[NH3+])C[C@@H]2C)s1 ZINC000126718025 384795509 /nfs/dbraw/zinc/79/55/09/384795509.db2.gz PQXMVIBZBVQHSA-ONGXEEELSA-N 2 0 224.373 2.226 20 0 BEADRP C[C@H](CCC1CC1)[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000398087833 384801459 /nfs/dbraw/zinc/80/14/59/384801459.db2.gz OIXUWNZVIAKZEC-KGYLQXTDSA-N 2 0 210.365 2.425 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000423339584 384813909 /nfs/dbraw/zinc/81/39/09/384813909.db2.gz LJKZRWBWMQLAAZ-IHRRRGAJSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H](C[NH2+]Cc1cc2ccccc2[nH]1)C[NH+](C)C ZINC000644414864 384870006 /nfs/dbraw/zinc/87/00/06/384870006.db2.gz IMHNIWBLCRJHLM-LBPRGKRZSA-N 2 0 245.370 2.455 20 0 BEADRP C[NH+]1CCC(C[NH2+]C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC000403862277 384877942 /nfs/dbraw/zinc/87/79/42/384877942.db2.gz WQPOBBJVIBTIRA-KFWWJZLASA-N 2 0 236.403 2.354 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@H]([NH3+])C1)c1cncs1 ZINC000423368133 384842106 /nfs/dbraw/zinc/84/21/06/384842106.db2.gz DBPMWNDUYDNTBB-GUBZILKMSA-N 2 0 225.361 2.064 20 0 BEADRP CCC[N@H+](C)C[C@@H]1CC[NH+](CCSC)C1 ZINC000177035839 384848693 /nfs/dbraw/zinc/84/86/93/384848693.db2.gz YRGZUAKOJLENHZ-LBPRGKRZSA-N 2 0 230.421 2.013 20 0 BEADRP C[C@H]([NH3+])[C@H]1CCC[N@H+](CCc2ccccc2)C1 ZINC000104424507 384851435 /nfs/dbraw/zinc/85/14/35/384851435.db2.gz RFFOXKXUQRKNFZ-ZFWWWQNUSA-N 2 0 232.371 2.288 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+][C@H]1CCc2ccc(F)cc21 ZINC000423402012 384851939 /nfs/dbraw/zinc/85/19/39/384851939.db2.gz RDLVVAVNAMTAKY-KMUNFCNLSA-N 2 0 248.345 2.401 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@@H]([NH3+])C1)C1CCSCC1 ZINC000423392456 384854156 /nfs/dbraw/zinc/85/41/56/384854156.db2.gz QFIITLSECDGRNR-UHTWSYAYSA-N 2 0 242.432 2.378 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+][C@@H]1CC[NH2+]C[C@H]1C ZINC000423409176 384855970 /nfs/dbraw/zinc/85/59/70/384855970.db2.gz YMOGHPJDXQAMEX-XQHKEYJVSA-N 2 0 210.365 2.009 20 0 BEADRP CC(C)Oc1ccc(CN[C@H]2CCC[C@H]2[NH3+])cc1 ZINC000258920498 384952037 /nfs/dbraw/zinc/95/20/37/384952037.db2.gz ISYGNPHMTYYDOK-CABCVRRESA-N 2 0 248.370 2.443 20 0 BEADRP Cc1ccc(C[NH2+]CC[C@H]2CC[NH2+]C2)cc1C ZINC000258984315 384955057 /nfs/dbraw/zinc/95/50/57/384955057.db2.gz LEYXXFPNKRRKLU-CQSZACIVSA-N 2 0 232.371 2.393 20 0 BEADRP Cc1ccc(CC[NH2+][C@H]2CCC[C@@H]2[NH3+])cc1 ZINC000258953100 384955796 /nfs/dbraw/zinc/95/57/96/384955796.db2.gz KNUBDJATYIKWKN-KBPBESRZSA-N 2 0 218.344 2.007 20 0 BEADRP Cc1ccc(CC[NH2+][C@H]2CCC[C@H]2[NH3+])cc1 ZINC000258953103 384955861 /nfs/dbraw/zinc/95/58/61/384955861.db2.gz KNUBDJATYIKWKN-KGLIPLIRSA-N 2 0 218.344 2.007 20 0 BEADRP C[NH+](C)CCNc1cc[nH+]c2ccccc12 ZINC000027320641 384893580 /nfs/dbraw/zinc/89/35/80/384893580.db2.gz DKKMYYBDTJFTDO-UHFFFAOYSA-N 2 0 215.300 2.208 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCCC2(C)C)C1 ZINC000086857124 384893990 /nfs/dbraw/zinc/89/39/90/384893990.db2.gz DTPQYFLXSWBZLC-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCCC2(C)C)C1 ZINC000086857123 384896114 /nfs/dbraw/zinc/89/61/14/384896114.db2.gz DTPQYFLXSWBZLC-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H](Cc1ccc(F)cc1)[NH2+][C@@H](C)CCC[NH3+] ZINC000310201246 384901105 /nfs/dbraw/zinc/90/11/05/384901105.db2.gz BWRNYTLONURTFA-NWDGAFQWSA-N 2 0 238.350 2.474 20 0 BEADRP C[C@H]([NH3+])[C@H]1CCC[N@H+](Cc2cccc(F)c2)C1 ZINC000111763717 384902568 /nfs/dbraw/zinc/90/25/68/384902568.db2.gz HUMWVAHQAOEDDW-AAEUAGOBSA-N 2 0 236.334 2.385 20 0 BEADRP C[C@H](C[NH2+]CCC[NH+](C)C)c1ccc(F)cc1 ZINC000127530921 384910569 /nfs/dbraw/zinc/91/05/69/384910569.db2.gz QAUCPKWQBIAPDD-GFCCVEGCSA-N 2 0 238.350 2.471 20 0 BEADRP C[C@H]([NH2+]CC1(C)CC[NH+](C)CC1)C1CCC1 ZINC000336759030 384919903 /nfs/dbraw/zinc/91/99/03/384919903.db2.gz ZTZKJBUDBJWZTP-LBPRGKRZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]Cc1ccsc1 ZINC000308694679 384920182 /nfs/dbraw/zinc/92/01/82/384920182.db2.gz SMYSAKISNRPLIU-SNVBAGLBSA-N 2 0 212.362 2.355 20 0 BEADRP CC(C)[C@H]1CCCC[N@@H+]1CC[C@@H]1CC[NH2+]C1 ZINC000257770883 384929553 /nfs/dbraw/zinc/92/95/53/384929553.db2.gz IFTVDTFCCSQSJX-UONOGXRCSA-N 2 0 224.392 2.497 20 0 BEADRP COc1ccc(C[NH2+]C[C@@H](C)C[NH3+])cc1Cl ZINC000258671973 384936164 /nfs/dbraw/zinc/93/61/64/384936164.db2.gz CXEINFLVIXSJOH-VIFPVBQESA-N 2 0 242.750 2.033 20 0 BEADRP Cc1ccc(C[NH2+]CC[C@H]2CCC[NH2+]C2)cc1 ZINC000258819589 384939328 /nfs/dbraw/zinc/93/93/28/384939328.db2.gz UYVLQQMUDAGRLF-CQSZACIVSA-N 2 0 232.371 2.474 20 0 BEADRP C[NH2+]CCC[NH2+]Cc1cc(C)c(C)cc1C ZINC000258747306 384940716 /nfs/dbraw/zinc/94/07/16/384940716.db2.gz LVDUKYFZAUWREU-UHFFFAOYSA-N 2 0 220.360 2.311 20 0 BEADRP CCC[N@H+](C)C[C@@H]1CC[NH+](CC2(C)CC2)C1 ZINC000555595033 384941990 /nfs/dbraw/zinc/94/19/90/384941990.db2.gz AVXSIJCSDNLQQI-ZDUSSCGKSA-N 2 0 224.392 2.450 20 0 BEADRP F[C@@H]1CC[C@H]([NH2+]C2CC[NH+](CC3CC3)CC2)C1 ZINC000557446929 384945495 /nfs/dbraw/zinc/94/54/95/384945495.db2.gz VRPQMWLRVWHMOS-OCCSQVGLSA-N 2 0 240.366 2.341 20 0 BEADRP C[C@@H]1CC[C@H](C[N@@H+]2CCC[C@H](C)[C@H]2CC[NH3+])O1 ZINC000404274810 384965066 /nfs/dbraw/zinc/96/50/66/384965066.db2.gz AHFGYRZBYAPEPR-REWJHTLYSA-N 2 0 240.391 2.003 20 0 BEADRP Cc1cncc(C[N@H+]2CCC[C@@H](C)[C@@H]2CC[NH3+])c1 ZINC000404315865 384971044 /nfs/dbraw/zinc/97/10/44/384971044.db2.gz ZZDRSZXLILVDGA-HIFRSBDPSA-N 2 0 247.386 2.339 20 0 BEADRP C[C@H](Cc1ccsc1)[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000087646885 384983182 /nfs/dbraw/zinc/98/31/82/384983182.db2.gz NATMZGHGHRGXAB-YPMHNXCESA-N 2 0 238.400 2.268 20 0 BEADRP C[C@@H](C1CC1)[N@H+](C[C@@H]1CCC[NH2+]C1)C1CC1 ZINC000226436279 385022065 /nfs/dbraw/zinc/02/20/65/385022065.db2.gz UXZYBFWGLBDNEC-NWDGAFQWSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CCC(F)(F)F ZINC000308703853 385012720 /nfs/dbraw/zinc/01/27/20/385012720.db2.gz VXZYDHBCPKMJLI-QMMMGPOBSA-N 2 0 212.259 2.046 20 0 BEADRP C1=C(CC[NH2+][C@H]2CC[C@@H]2C2CC2)CC[NH2+]C1 ZINC000423543713 385023411 /nfs/dbraw/zinc/02/34/11/385023411.db2.gz VPKLVEQVUQVGMN-KGLIPLIRSA-N 2 0 220.360 2.074 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]CCc1ccc(Cl)s1 ZINC000259152430 384964394 /nfs/dbraw/zinc/96/43/94/384964394.db2.gz VDAZURWAQQZTTB-NXEZZACHSA-N 2 0 244.791 2.413 20 0 BEADRP CC1(C)CC(C[NH2+][C@H]2CCC[C@H]([NH3+])C2)C1 ZINC000518396289 385048170 /nfs/dbraw/zinc/04/81/70/385048170.db2.gz BTNVCBJTQYUILV-RYUDHWBXSA-N 2 0 210.365 2.282 20 0 BEADRP C(C[N@@H+]1CCC[C@H]2CCC[C@@H]21)[C@H]1CC[NH2+]C1 ZINC000251294652 385055538 /nfs/dbraw/zinc/05/55/38/385055538.db2.gz OAUDKEJYPNAFMB-MCIONIFRSA-N 2 0 222.376 2.251 20 0 BEADRP CN(C)C1(C[NH2+]C2CCCC2)CCCC1 ZINC000105838333 385057721 /nfs/dbraw/zinc/05/77/21/385057721.db2.gz CZCOJIKDVVEVRP-UHFFFAOYSA-N 2 0 210.365 2.393 20 0 BEADRP Cc1cccc(OCC[NH2+][C@@H]2C[C@@H]([NH3+])C2(C)C)c1 ZINC000404785185 385058110 /nfs/dbraw/zinc/05/81/10/385058110.db2.gz PHAKUQZHTAPXMQ-ZIAGYGMSSA-N 2 0 248.370 2.089 20 0 BEADRP C[C@H](F)CC[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@@H]1C ZINC000340471972 385067872 /nfs/dbraw/zinc/06/78/72/385067872.db2.gz XXZDUYROMVARHS-NNYUYHANSA-N 2 0 216.344 2.053 20 0 BEADRP C(CC[NH2+][C@H]1CCSC1)CC[NH+]1CCCC1 ZINC000340474002 385069310 /nfs/dbraw/zinc/06/93/10/385069310.db2.gz GBAUOYIHWLZERD-ZDUSSCGKSA-N 2 0 242.432 2.348 20 0 BEADRP CC1(C)[C@@H]([NH3+])C[C@@H]1NCc1ccccc1F ZINC000404806681 385078062 /nfs/dbraw/zinc/07/80/62/385078062.db2.gz ZCMRCCVHDHZRGY-RYUDHWBXSA-N 2 0 222.307 2.041 20 0 BEADRP CC[C@H](C)C[N@@H+]1C[C@H](C[NH3+])[C@H](C)C[C@@H]1C ZINC000397324449 385080839 /nfs/dbraw/zinc/08/08/39/385080839.db2.gz OFGFDTAYXTZXAB-RNJOBUHISA-N 2 0 212.381 2.338 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000423559715 385028264 /nfs/dbraw/zinc/02/82/64/385028264.db2.gz UGQFNGBGGBZNDK-QRTUWBSPSA-N 2 0 236.403 2.399 20 0 BEADRP Cc1ccc(CN(C)C[C@H]2CCC[N@H+](C)C2)nc1 ZINC000152279349 385042237 /nfs/dbraw/zinc/04/22/37/385042237.db2.gz GSSBFVRPWKOUMU-AWEZNQCLSA-N 2 0 247.386 2.164 20 0 BEADRP Cc1ccc(CN(C)C[C@@H]2CCC[N@H+](C)C2)nc1 ZINC000152279257 385043440 /nfs/dbraw/zinc/04/34/40/385043440.db2.gz GSSBFVRPWKOUMU-CQSZACIVSA-N 2 0 247.386 2.164 20 0 BEADRP CO[C@H](C)[C@H](C)[NH2+]Cc1cnc2ccc(C)cn12 ZINC000189124505 385126382 /nfs/dbraw/zinc/12/63/82/385126382.db2.gz HWKGMLWPMIIICG-NWDGAFQWSA-N 2 0 247.342 2.156 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]CC1(C2CC2)CC1 ZINC000090773015 385093666 /nfs/dbraw/zinc/09/36/66/385093666.db2.gz FOXCHWRXMNTXEQ-DYEKYZERSA-N 2 0 236.403 2.495 20 0 BEADRP [NH3+]CC1CCC([NH2+]Cc2cnc(C3CC3)o2)CC1 ZINC000518753932 385107267 /nfs/dbraw/zinc/10/72/67/385107267.db2.gz YXFVRXQQJBFZFW-UHFFFAOYSA-N 2 0 249.358 2.159 20 0 BEADRP CC(C)CCC[N@@H+]1CC[C@@H]2[NH2+]CC[C@@H]2C1 ZINC000308823638 385195483 /nfs/dbraw/zinc/19/54/83/385195483.db2.gz HFEDIZAONRTMOW-OLZOCXBDSA-N 2 0 210.365 2.106 20 0 BEADRP C(C[N@@H+]1CCC[C@H]2CCC[C@@H]21)[C@@H]1CC[NH2+]C1 ZINC000227643807 385176676 /nfs/dbraw/zinc/17/66/76/385176676.db2.gz OAUDKEJYPNAFMB-MJBXVCDLSA-N 2 0 222.376 2.251 20 0 BEADRP CC(C)C[C@@H](C)C[N@H+](C)C1CC[NH2+]CC1 ZINC000300969360 385215331 /nfs/dbraw/zinc/21/53/31/385215331.db2.gz RYNXHEKIAZEQEF-GFCCVEGCSA-N 2 0 212.381 2.352 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000252713574 385217877 /nfs/dbraw/zinc/21/78/77/385217877.db2.gz PNXCHEIBBIVVKW-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](C)CC(F)(F)F ZINC000308860569 385223236 /nfs/dbraw/zinc/22/32/36/385223236.db2.gz PDUCLVZEENRAPI-IUCAKERBSA-N 2 0 226.286 2.434 20 0 BEADRP CC(C)[C@H](C)C[NH2+][C@@H]1CC[N@H+](C)C[C@H]1C ZINC000252716856 385227302 /nfs/dbraw/zinc/22/73/02/385227302.db2.gz ZJMYMCNKXRGTBL-JHJVBQTASA-N 2 0 212.381 2.208 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]C[C@@H](c1ccccc1)N(C)C ZINC000310965987 385256860 /nfs/dbraw/zinc/25/68/60/385256860.db2.gz BGOSMTJQEVZLKV-HIFRSBDPSA-N 2 0 249.402 2.006 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CC[N@H+](C[C@@H]2CCCC[C@@H]2C)C1 ZINC000346663854 385257119 /nfs/dbraw/zinc/25/71/19/385257119.db2.gz XDRUCEFOGTUPED-XDQVBPFNSA-N 2 0 224.392 2.482 20 0 BEADRP CSCCC[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@H]1C ZINC000068997599 385240821 /nfs/dbraw/zinc/24/08/21/385240821.db2.gz IFWHOFPJBVBQDS-GRYCIOLGSA-N 2 0 230.421 2.058 20 0 BEADRP C[C@@H]([NH2+]CCCC[NH3+])c1ccc(F)c(F)c1 ZINC000037714958 385308550 /nfs/dbraw/zinc/30/85/50/385308550.db2.gz GZUIWGWVGVKZMI-SECBINFHSA-N 2 0 228.286 2.354 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]C[C@H]1CCCCS1 ZINC000308998276 385337528 /nfs/dbraw/zinc/33/75/28/385337528.db2.gz KOOYOGDLGGRCPD-NWDGAFQWSA-N 2 0 230.421 2.379 20 0 BEADRP C[C@@H](Cc1ccccc1)C[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC000359460143 385367004 /nfs/dbraw/zinc/36/70/04/385367004.db2.gz VXUNRDFYNRUECY-CWRNSKLLSA-N 2 0 244.382 2.016 20 0 BEADRP Cc1cc(C)cc(C[NH+]2C[C@H]3C[N@H+](C)C[C@H]3C2)c1 ZINC000193611380 385403900 /nfs/dbraw/zinc/40/39/00/385403900.db2.gz LZUWYUMRVPFZMN-IYBDPMFKSA-N 2 0 244.382 2.297 20 0 BEADRP C[N@H+](CCC[NH3+])Cc1ccc2cnccc2c1 ZINC000647496976 385404659 /nfs/dbraw/zinc/40/46/59/385404659.db2.gz ARGXIIFBKHSCDL-UHFFFAOYSA-N 2 0 229.327 2.015 20 0 BEADRP Cc1ccc(C[NH+]2C[C@H]3C[N@H+](C)C[C@H]3C2)s1 ZINC000194543208 385438988 /nfs/dbraw/zinc/43/89/88/385438988.db2.gz CLMFNNJMVJHIAI-TXEJJXNPSA-N 2 0 236.384 2.050 20 0 BEADRP CCN1CCC[C@@H]1C[NH2+]CC1(OC)CCCC1 ZINC000319554222 385447458 /nfs/dbraw/zinc/44/74/58/385447458.db2.gz CRTOUGYVGDCWDQ-CYBMUJFWSA-N 2 0 240.391 2.020 20 0 BEADRP C([NH2+]CC1CC[NH2+]CC1)C1CCCCC1 ZINC000010435494 385473540 /nfs/dbraw/zinc/47/35/40/385473540.db2.gz HVUXYOIGBFHZBB-UHFFFAOYSA-N 2 0 210.365 2.156 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]Cc1cccc(F)c1 ZINC000309202691 385477705 /nfs/dbraw/zinc/47/77/05/385477705.db2.gz FQDPMPUOKILAAN-LLVKDONJSA-N 2 0 224.323 2.433 20 0 BEADRP CC[C@@H](C)[NH2+]CC1(SC)CC[NH+](C)CC1 ZINC000309197728 385460443 /nfs/dbraw/zinc/46/04/43/385460443.db2.gz QTOZBGWLJRJYEZ-LLVKDONJSA-N 2 0 230.421 2.202 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]CC[C@@H](C)c1ccccc1 ZINC000309267708 385503685 /nfs/dbraw/zinc/50/36/85/385503685.db2.gz CKZSLDGNQVLIAJ-CHWSQXEVSA-N 2 0 220.360 2.365 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000309274952 385508360 /nfs/dbraw/zinc/50/83/60/385508360.db2.gz DRGKZJLJNPHTHH-UTLUCORTSA-N 2 0 238.297 2.292 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H]1CCCc2ccccc21 ZINC000309338317 385539023 /nfs/dbraw/zinc/53/90/23/385539023.db2.gz KOJPZVQLOAFOAC-BXUZGUMPSA-N 2 0 218.344 2.248 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H]1CCc2ccccc21 ZINC000309353779 385545442 /nfs/dbraw/zinc/54/54/42/385545442.db2.gz CCWRUTAQUIMLEC-BXUZGUMPSA-N 2 0 218.344 2.391 20 0 BEADRP Cc1ccsc1CC[NH2+][C@@H]1CN(C)C[C@H]1C ZINC000309356248 385548269 /nfs/dbraw/zinc/54/82/69/385548269.db2.gz AFOJIIFAJLVQBM-VXGBXAGGSA-N 2 0 238.400 2.139 20 0 BEADRP CC[C@](C)(C[NH2+]CCC[N@H+](C)C(C)C)OC ZINC000318936911 385526635 /nfs/dbraw/zinc/52/66/35/385526635.db2.gz BHTZBUZSUUFJRC-CYBMUJFWSA-N 2 0 230.396 2.121 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@H](C)c1cccnc1 ZINC000309313897 385526740 /nfs/dbraw/zinc/52/67/40/385526740.db2.gz FQQZSWFDQPEUCM-VXGBXAGGSA-N 2 0 221.348 2.250 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)CCCC[NH3+])c1cccnc1 ZINC000309313894 385527617 /nfs/dbraw/zinc/52/76/17/385527617.db2.gz FQQZSWFDQPEUCM-NWDGAFQWSA-N 2 0 221.348 2.250 20 0 BEADRP CCc1ccccc1C[NH2+][C@@H](C)CCC[NH3+] ZINC000309384783 385559387 /nfs/dbraw/zinc/55/93/87/385559387.db2.gz GXYNCMUZEBPEOP-LBPRGKRZSA-N 2 0 220.360 2.466 20 0 BEADRP CC(C)[C@@H]1C[C@H]([NH2+]CCN(C)C(C)C)CS1 ZINC000309401543 385571568 /nfs/dbraw/zinc/57/15/68/385571568.db2.gz WIFIMEIVRBAHDV-STQMWFEESA-N 2 0 244.448 2.446 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@@H]1CCCc2occc21 ZINC000336676049 385602395 /nfs/dbraw/zinc/60/23/95/385602395.db2.gz VNAMMSZKFIPIRN-CMPLNLGQSA-N 2 0 222.332 2.374 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)[C@@H]1C ZINC000336650083 385603125 /nfs/dbraw/zinc/60/31/25/385603125.db2.gz DLMNUWGYZLETME-BYNQJWBRSA-N 2 0 222.376 2.105 20 0 BEADRP C[C@@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1nccs1 ZINC000309422734 385578207 /nfs/dbraw/zinc/57/82/07/385578207.db2.gz BFKKOIFVBZPAIX-GHMZBOCLSA-N 2 0 239.388 2.326 20 0 BEADRP CCC1CC([NH2+]C[C@@H](C)C[NH+]2CCCC2)C1 ZINC000336678000 385614376 /nfs/dbraw/zinc/61/43/76/385614376.db2.gz CDSHMFFNKFGQGW-IYXRBSQSSA-N 2 0 224.392 2.497 20 0 BEADRP CCOc1cccc(C[NH2+]C[C@H](C)C[NH2+]C)c1 ZINC000414848374 385615199 /nfs/dbraw/zinc/61/51/99/385615199.db2.gz WVZYQYAUYRENPF-GFCCVEGCSA-N 2 0 236.359 2.030 20 0 BEADRP C[C@H](C[NH2+]CCC[NH+](C)C)Cc1ccccc1 ZINC000182049379 385630352 /nfs/dbraw/zinc/63/03/52/385630352.db2.gz ZKZYICQESINYAP-AWEZNQCLSA-N 2 0 234.387 2.407 20 0 BEADRP CC(C)C[C@H](C)C[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000414848220 385607387 /nfs/dbraw/zinc/60/73/87/385607387.db2.gz KLZHCXZWKKZWFU-STQMWFEESA-N 2 0 212.381 2.258 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]Cc1cc(F)ccc1F ZINC000309488591 385611691 /nfs/dbraw/zinc/61/16/91/385611691.db2.gz XRMWZWWFTDEPAY-SECBINFHSA-N 2 0 228.286 2.182 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]CCC1CCCCC1 ZINC000414852347 385674990 /nfs/dbraw/zinc/67/49/90/385674990.db2.gz RAJOUOTYZMMAPE-LBPRGKRZSA-N 2 0 212.381 2.402 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]C[C@H](C)CC(C)C ZINC000414853096 385680935 /nfs/dbraw/zinc/68/09/35/385680935.db2.gz RTDPPQPTILGKGH-NEPJUHHUSA-N 2 0 200.370 2.114 20 0 BEADRP C[C@@H]([NH2+]C1CC[NH+](C2CCC2)CC1)C1CC1 ZINC000309546961 385681904 /nfs/dbraw/zinc/68/19/04/385681904.db2.gz HBTIUVLOJPOAEB-LLVKDONJSA-N 2 0 222.376 2.391 20 0 BEADRP C[C@@H](CCCC(F)(F)F)[NH2+]C[C@@H]1CCC[NH2+]1 ZINC000414853367 385688428 /nfs/dbraw/zinc/68/84/28/385688428.db2.gz XUAVWZRBWPBWSQ-UWVGGRQHSA-N 2 0 238.297 2.449 20 0 BEADRP C[C@@H](C[NH2+]C1CC(C)(C)C1)C[NH+]1CCCC1 ZINC000309565440 385695288 /nfs/dbraw/zinc/69/52/88/385695288.db2.gz MCOZKPGGERGSPI-LBPRGKRZSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1occc1C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000647793099 385699816 /nfs/dbraw/zinc/69/98/16/385699816.db2.gz KMMAGVUBJUFSMV-MGPQQGTHSA-N 2 0 234.343 2.066 20 0 BEADRP Cc1occc1C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000647793098 385700204 /nfs/dbraw/zinc/70/02/04/385700204.db2.gz KMMAGVUBJUFSMV-MELADBBJSA-N 2 0 234.343 2.066 20 0 BEADRP CC(C)C[C@@H](C)C[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000414856182 385709791 /nfs/dbraw/zinc/70/97/91/385709791.db2.gz OASNXIBQYITESJ-CHWSQXEVSA-N 2 0 212.381 2.258 20 0 BEADRP Clc1csc(C[NH2+]C[C@H]2CCC[NH2+]C2)c1 ZINC000414856553 385715018 /nfs/dbraw/zinc/71/50/18/385715018.db2.gz OILALIRRHQKPGV-VIFPVBQESA-N 2 0 244.791 2.491 20 0 BEADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+]C[C@H]2C[C@H]2C)C1 ZINC000336691810 385729092 /nfs/dbraw/zinc/72/90/92/385729092.db2.gz WYZJPLUFHVWFMT-HZSPNIEDSA-N 2 0 224.392 2.352 20 0 BEADRP C[NH2+]CCC[NH2+]C[C@H](C)c1ccc(F)cc1 ZINC000414857975 385729464 /nfs/dbraw/zinc/72/94/64/385729464.db2.gz GYQKLMLREONKLB-NSHDSACASA-N 2 0 224.323 2.128 20 0 BEADRP [NH3+]C1(C[NH2+]C[C@H]2CCSC2)CCCCCC1 ZINC000414858260 385734821 /nfs/dbraw/zinc/73/48/21/385734821.db2.gz INTBOORUDWWJNE-GFCCVEGCSA-N 2 0 242.432 2.381 20 0 BEADRP Cc1ccccc1C[NH2+][C@H](C)[C@H]1CCC[NH2+]C1 ZINC000414859945 385738546 /nfs/dbraw/zinc/73/85/46/385738546.db2.gz UZYSJNSGBHXAHJ-HIFRSBDPSA-N 2 0 232.371 2.473 20 0 BEADRP Cc1ccccc1C[NH2+][C@H](C)[C@@H]1CCC[NH2+]C1 ZINC000414859946 385739151 /nfs/dbraw/zinc/73/91/51/385739151.db2.gz UZYSJNSGBHXAHJ-UKRRQHHQSA-N 2 0 232.371 2.473 20 0 BEADRP C[C@H]([NH2+]Cc1ccccc1)[C@H]1CCC[NH2+]C1 ZINC000414861304 385750075 /nfs/dbraw/zinc/75/00/75/385750075.db2.gz WKDZYEFUGUHSQU-JSGCOSHPSA-N 2 0 218.344 2.164 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@H]1C)[C@@H]1CCC[NH2+]C1 ZINC000414863100 385756367 /nfs/dbraw/zinc/75/63/67/385756367.db2.gz XXWUISQREWNBOT-XQHKEYJVSA-N 2 0 210.365 2.153 20 0 BEADRP C[NH2+]CCC[NH2+]C1CCC(C(C)C)CC1 ZINC000414863960 385761533 /nfs/dbraw/zinc/76/15/33/385761533.db2.gz YHSYSCKRAWBAAB-UHFFFAOYSA-N 2 0 212.381 2.400 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1C[C@@H](c2ccccc2)[C@H]1C ZINC000414864693 385763564 /nfs/dbraw/zinc/76/35/64/385763564.db2.gz ZTXLLUGLWLVKKR-BPLDGKMQSA-N 2 0 232.371 2.378 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1C[C@@H](C)CC(C)(C)C1 ZINC000414864536 385763748 /nfs/dbraw/zinc/76/37/48/385763748.db2.gz ZJQCHLXNUPZNCA-VXGBXAGGSA-N 2 0 212.381 2.400 20 0 BEADRP CC(C)[C@@H]1CC[C@H]([NH2+][C@@H]2CC[NH2+]C2)C[C@@H]1C ZINC000414865519 385768562 /nfs/dbraw/zinc/76/85/62/385768562.db2.gz DALAORDJZASFSE-FQUUOJAGSA-N 2 0 224.392 2.399 20 0 BEADRP CC[C@H]([NH2+]CCC[NH3+])c1cccc(C)c1 ZINC000336703081 385772218 /nfs/dbraw/zinc/77/22/18/385772218.db2.gz QHQGURWYUFQAOJ-ZDUSSCGKSA-N 2 0 206.333 2.385 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H](C)CC(F)(F)F ZINC000336703279 385772905 /nfs/dbraw/zinc/77/29/05/385772905.db2.gz ZNQGWMRHZJLTKC-HTQZYQBOSA-N 2 0 212.259 2.044 20 0 BEADRP C[C@H](CC(F)(F)F)[NH2+][C@@H](C)CCC[NH3+] ZINC000336703280 385774311 /nfs/dbraw/zinc/77/43/11/385774311.db2.gz ZNQGWMRHZJLTKC-JGVFFNPUSA-N 2 0 212.259 2.044 20 0 BEADRP CCC[C@H](C)C[N@@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000336656406 385780740 /nfs/dbraw/zinc/78/07/40/385780740.db2.gz LFMMKJKHLZKALP-ZDUSSCGKSA-N 2 0 224.392 2.498 20 0 BEADRP C[N@H+]1CC=C(C[NH2+][C@@H]2CCCC2(C)C)CC1 ZINC000309667603 385783916 /nfs/dbraw/zinc/78/39/16/385783916.db2.gz UUUFMVHXPAFKMH-CYBMUJFWSA-N 2 0 222.376 2.417 20 0 BEADRP C([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)[C@@H]1C[C@H]1C1CCC1 ZINC000647799406 385799594 /nfs/dbraw/zinc/79/95/94/385799594.db2.gz FLEIQXWUVLUEPF-LJIZCISZSA-N 2 0 248.414 2.400 20 0 BEADRP Cc1ccc(CCC[NH2+]C2(C)CC[NH2+]CC2)cn1 ZINC000414947219 385803058 /nfs/dbraw/zinc/80/30/58/385803058.db2.gz VSHPXDKCLCRAFC-UHFFFAOYSA-N 2 0 247.386 2.054 20 0 BEADRP C([NH2+][C@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)[C@@H]1C[C@H]1C1CC1 ZINC000647800013 385803438 /nfs/dbraw/zinc/80/34/38/385803438.db2.gz XEYUXKQAFZGIMV-MRLBHPIUSA-N 2 0 234.387 2.010 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC000414947803 385806727 /nfs/dbraw/zinc/80/67/27/385806727.db2.gz WZGZPYVLNJSOIZ-OEAJRASXSA-N 2 0 244.382 2.378 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]Cc1ccc(F)c2cccnc12 ZINC000414871620 385858117 /nfs/dbraw/zinc/85/81/17/385858117.db2.gz DPRPWKYPGXGXDG-SNVBAGLBSA-N 2 0 247.317 2.058 20 0 BEADRP CCCCC[N@@H+]1C[C@@H]2CCC[C@@H]([NH3+])[C@@H]2C1 ZINC000228474463 385838085 /nfs/dbraw/zinc/83/80/85/385838085.db2.gz AGNNIWCLQKYANJ-YNEHKIRRSA-N 2 0 210.365 2.236 20 0 BEADRP CC[C@H](C)C[N@@H+]1C[C@@H]2CCC[C@@H]([NH3+])[C@@H]2C1 ZINC000228471666 385838265 /nfs/dbraw/zinc/83/82/65/385838265.db2.gz VOJJTLOLMKSIDR-WUHRBBMRSA-N 2 0 210.365 2.092 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+]Cc1cnc(C(C)(C)C)s1 ZINC000414869636 385839399 /nfs/dbraw/zinc/83/93/99/385839399.db2.gz BADVFAYBBBAYJQ-VIFPVBQESA-N 2 0 241.404 2.125 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H](C)CCc1ccc(F)cc1 ZINC000414869831 385840335 /nfs/dbraw/zinc/84/03/35/385840335.db2.gz BHNHYHFEAUOYHZ-NEPJUHHUSA-N 2 0 238.350 2.331 20 0 BEADRP CC[C@@H](Cc1ccccc1)[NH2+][C@H]1CCCNC1 ZINC000414870299 385848945 /nfs/dbraw/zinc/84/89/45/385848945.db2.gz SFJVIAZQXIDHDA-GJZGRUSLSA-N 2 0 232.371 2.349 20 0 BEADRP C[C@@H](CCc1ccsc1)N[C@@H]1CC[NH2+]C1 ZINC000414867134 385791467 /nfs/dbraw/zinc/79/14/67/385791467.db2.gz GFBNJYDXTFQBJO-CMPLNLGQSA-N 2 0 224.373 2.021 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)C(F)F ZINC000647798623 385795352 /nfs/dbraw/zinc/79/53/52/385795352.db2.gz UHTUGQZYVWORBJ-ZDCRXTMVSA-N 2 0 232.318 2.008 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]Cc1cc(F)cc2cccnc21 ZINC000414874733 385886338 /nfs/dbraw/zinc/88/63/38/385886338.db2.gz IYTCIYRPAAUXCU-SNVBAGLBSA-N 2 0 247.317 2.058 20 0 BEADRP C[C@H](CCc1ccsc1)[NH2+]C[C@@H](C)C[NH3+] ZINC000414874694 385886786 /nfs/dbraw/zinc/88/67/86/385886786.db2.gz IURDDIMABPPJIH-WDEREUQCSA-N 2 0 226.389 2.254 20 0 BEADRP C[C@H](C[NH2+]Cc1cccs1)C[NH+](C)C ZINC000291713853 385893212 /nfs/dbraw/zinc/89/32/12/385893212.db2.gz LTRLNWJJKKXYBD-SNVBAGLBSA-N 2 0 212.362 2.035 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]CCc1cc(F)cc(F)c1 ZINC000336721179 385893602 /nfs/dbraw/zinc/89/36/02/385893602.db2.gz SKRWSVYKMYFFKJ-JTQLQIEISA-N 2 0 242.313 2.224 20 0 BEADRP CC[NH+](CC)CCNc1[nH+]ccc2[nH]ccc21 ZINC000647844447 385894654 /nfs/dbraw/zinc/89/46/54/385894654.db2.gz CXCOELPAMQTJAY-UHFFFAOYSA-N 2 0 232.331 2.317 20 0 BEADRP CC(C)=CCC[NH2+][C@@H](C)[C@@H]1CCCC[NH2+]1 ZINC000397769939 385913303 /nfs/dbraw/zinc/91/33/03/385913303.db2.gz UPRNRMIJVLQEFL-STQMWFEESA-N 2 0 210.365 2.463 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@@H]1CC[C@@H](C)[C@H](C)C1 ZINC000414966319 385919253 /nfs/dbraw/zinc/91/92/53/385919253.db2.gz WIEMTSDYAROIND-FDYHWXHSSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]Cc1ccc(F)cc1 ZINC000335039076 385930050 /nfs/dbraw/zinc/93/00/50/385930050.db2.gz LWVKLXAGZJMOPS-BXUZGUMPSA-N 2 0 236.334 2.303 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@@H](C)[C@@]1(C)CCCO1 ZINC000340469492 385859693 /nfs/dbraw/zinc/85/96/93/385859693.db2.gz KEFWBJLGRACTON-UONOGXRCSA-N 2 0 242.407 2.264 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H]1CCC(C)(C)C[C@H]1C ZINC000414872899 385871084 /nfs/dbraw/zinc/87/10/84/385871084.db2.gz GMSYFQZRABWBKM-UTUOFQBUSA-N 2 0 212.381 2.386 20 0 BEADRP CC[N@H+](C)C[C@H]1CC[NH+](C[C@](C)(CC)OC)C1 ZINC000638136048 385879070 /nfs/dbraw/zinc/87/90/70/385879070.db2.gz WRBKHOVNMJTZTO-KGLIPLIRSA-N 2 0 242.407 2.075 20 0 BEADRP C[C@H](C[NH2+]CC1([NH3+])CCC1)Cc1ccccc1 ZINC000414874055 385880493 /nfs/dbraw/zinc/88/04/93/385880493.db2.gz HXIZVWGGZRZZFF-ZDUSSCGKSA-N 2 0 232.371 2.336 20 0 BEADRP COc1cccc(C[NH2+]CCC[C@@H]2CCC[NH2+]2)c1 ZINC000414971561 385976385 /nfs/dbraw/zinc/97/63/85/385976385.db2.gz LPEBAIIZMLUNCC-CQSZACIVSA-N 2 0 248.370 2.317 20 0 BEADRP C([NH2+][C@@H]1CCCC12CCC2)[C@H]1CCC[NH2+]C1 ZINC000335018794 385978117 /nfs/dbraw/zinc/97/81/17/385978117.db2.gz LAAFMFHCNPDONI-QWHCGFSZSA-N 2 0 222.376 2.298 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]CC1CCSCC1 ZINC000335019231 385978157 /nfs/dbraw/zinc/97/81/57/385978157.db2.gz LVQPYSWGVYQJFJ-YPMHNXCESA-N 2 0 242.432 2.107 20 0 BEADRP CC[NH+](CC)CCC[N@@H+]1CC[C@@H](OC)C[C@H]1C ZINC000338365493 385980418 /nfs/dbraw/zinc/98/04/18/385980418.db2.gz RRRZLWMSCZNAFB-ZIAGYGMSSA-N 2 0 242.407 2.218 20 0 BEADRP FC1(F)CCC(C[NH2+]C2CC[NH2+]CC2)CC1 ZINC000335021868 385982706 /nfs/dbraw/zinc/98/27/06/385982706.db2.gz IZYWYDCELLUQCT-UHFFFAOYSA-N 2 0 232.318 2.154 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCCc2ccc(F)cc21)C1C[NH2+]C1 ZINC000335023578 385983803 /nfs/dbraw/zinc/98/38/03/385983803.db2.gz SBAYCGWWGDDVEJ-ZUZCIYMTSA-N 2 0 248.345 2.401 20 0 BEADRP CC[C@H]1CC[C@H]1[NH2+]CC1=CC[N@H+](C)CC1 ZINC000336748836 385988909 /nfs/dbraw/zinc/98/89/09/385988909.db2.gz CZUGPKNMFGWKBC-QWHCGFSZSA-N 2 0 208.349 2.027 20 0 BEADRP C[C@@H]([NH2+]CC1CC[NH+](C)CC1)[C@@H]1CC1(C)C ZINC000336749004 385990036 /nfs/dbraw/zinc/99/00/36/385990036.db2.gz TUVQBZBOIJSGCN-YPMHNXCESA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CC2([NH3+])CCC2)[C@H](C)C1 ZINC000414877729 385930804 /nfs/dbraw/zinc/93/08/04/385930804.db2.gz NCVVMVCGGUNXIT-IJLUTSLNSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+][C@H]1CCCCC[C@@H]1[NH2+]C1Cc2ccccc2C1 ZINC000335040046 385931268 /nfs/dbraw/zinc/93/12/68/385931268.db2.gz OCCJYDYSFUIFSA-HOTGVXAUSA-N 2 0 244.382 2.403 20 0 BEADRP COC1CCC([NH2+]CCC[C@H]2CCC[NH2+]2)CC1 ZINC000414968057 385933552 /nfs/dbraw/zinc/93/35/52/385933552.db2.gz RDPBGOVTFRAYST-IYXRBSQSSA-N 2 0 240.391 2.066 20 0 BEADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]C[C@H]1CCCO1 ZINC000251156696 385935266 /nfs/dbraw/zinc/93/52/66/385935266.db2.gz BOFCXGWBJPMSTJ-HZSPNIEDSA-N 2 0 240.391 2.066 20 0 BEADRP Fc1ccc2c(c1)[C@@H]([NH2+]C1CC[NH2+]CC1)CC2 ZINC000335042401 385935292 /nfs/dbraw/zinc/93/52/92/385935292.db2.gz LJKLXMDEOFYFHX-AWEZNQCLSA-N 2 0 234.318 2.155 20 0 BEADRP CC1CCC(C[NH2+][C@@H]2CCC[C@H]2[NH3+])CC1 ZINC000335043584 385936197 /nfs/dbraw/zinc/93/61/97/385936197.db2.gz PIGMUURKJNIFAM-FIYWTHMPSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1CCC[C@H]1[NH2+]C1CCC(C[NH3+])CC1 ZINC000335046130 385941131 /nfs/dbraw/zinc/94/11/31/385941131.db2.gz ZSCWNVGPPUHOEK-IKWCTNDRSA-N 2 0 210.365 2.282 20 0 BEADRP Cc1ccnc([C@@H](C)[NH2+]C2CCC([NH3+])CC2)c1 ZINC000335050597 385945511 /nfs/dbraw/zinc/94/55/11/385945511.db2.gz ORQWWZAQENPBMR-PNESKVBLSA-N 2 0 233.359 2.311 20 0 BEADRP [NH3+]C1(CN[C@@H]2CCCOc3ccccc32)CCC1 ZINC000335052469 385951981 /nfs/dbraw/zinc/95/19/81/385951981.db2.gz LKRGYMXXNBGVRQ-CYBMUJFWSA-N 2 0 246.354 2.371 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+]CC1([NH3+])CCC1)CC2 ZINC000335054622 385953852 /nfs/dbraw/zinc/95/38/52/385953852.db2.gz RZQUGLCSNQFGBR-CQSZACIVSA-N 2 0 230.355 2.453 20 0 BEADRP Cc1cccc2c1CC[C@H]2[NH2+]CC1([NH3+])CCC1 ZINC000335054660 385954671 /nfs/dbraw/zinc/95/46/71/385954671.db2.gz SXYCVYMIDDIMCE-CQSZACIVSA-N 2 0 230.355 2.453 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H]2CCc3ccccc32)CCC1 ZINC000335054679 385954765 /nfs/dbraw/zinc/95/47/65/385954765.db2.gz UIHVUYLMZUGXFE-CYBMUJFWSA-N 2 0 216.328 2.145 20 0 BEADRP CC[NH+](CC)CCC[N@H+](C)[C@H](CO)CC(C)C ZINC000338297785 385958844 /nfs/dbraw/zinc/95/88/44/385958844.db2.gz XCKDIFSAEXLNMQ-AWEZNQCLSA-N 2 0 244.423 2.057 20 0 BEADRP CC[C@H](C[NH2+]C[C@@H](C)C[NH3+])c1ccccc1 ZINC000414879992 385963867 /nfs/dbraw/zinc/96/38/67/385963867.db2.gz QFOWJKLSJZRESR-QWHCGFSZSA-N 2 0 220.360 2.365 20 0 BEADRP CC(C)C1CC([NH2+][C@H]2CCC[C@H]([NH3+])C2)C1 ZINC000335015542 385971220 /nfs/dbraw/zinc/97/12/20/385971220.db2.gz ZDMBAUQENDMVDX-ZFQMDJOTSA-N 2 0 210.365 2.281 20 0 BEADRP C[C@H](CCC1CC1)[NH2+]CCCC[NH+](C)C ZINC000336747331 385972676 /nfs/dbraw/zinc/97/26/76/385972676.db2.gz CJBPKYAAUDQDRP-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP CC[NH+](CC)CCCN1C[C@H](C)O[C@@H](C)[C@H]1C ZINC000338345529 385973780 /nfs/dbraw/zinc/97/37/80/385973780.db2.gz ANNRYJILEXETLB-MJBXVCDLSA-N 2 0 242.407 2.216 20 0 BEADRP CCC[C@H](C)C[NH2+][C@@H]1CC[NH2+]CC1(C)C ZINC000414973971 385999728 /nfs/dbraw/zinc/99/97/28/385999728.db2.gz NGSLSTYQESIHKN-NWDGAFQWSA-N 2 0 212.381 2.400 20 0 BEADRP CC[C@H]1CCC[C@H]([NH2+]CC2([NH3+])CCC2)C1 ZINC000414881489 386000462 /nfs/dbraw/zinc/00/04/62/386000462.db2.gz SJKWVQOLRGBWPJ-RYUDHWBXSA-N 2 0 210.365 2.426 20 0 BEADRP COCCC[C@@H](C)[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000414183782 386025627 /nfs/dbraw/zinc/02/56/27/386025627.db2.gz NNPKEOJJLUBCGB-GFCCVEGCSA-N 2 0 247.342 2.239 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[NH2+]C[C@@H]([NH3+])C1CC1 ZINC000414883183 386032493 /nfs/dbraw/zinc/03/24/93/386032493.db2.gz CVHRPUATTXDXPH-RAIGVLPGSA-N 2 0 210.365 2.140 20 0 BEADRP C[NH2+]Cc1ccc(N[C@@H](C)C[C@H]2CCC[NH2+]2)cc1 ZINC000414978611 386035271 /nfs/dbraw/zinc/03/52/71/386035271.db2.gz SAJKEXRBTKLKLX-SWLSCSKDSA-N 2 0 247.386 2.349 20 0 BEADRP F[C@@H]1CCCC[C@H]1[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000414291495 386101814 /nfs/dbraw/zinc/10/18/14/386101814.db2.gz UKOXHEIBSBABER-IGQOVBAYSA-N 2 0 240.366 2.484 20 0 BEADRP Cc1c[nH+]ccc1N1C[C@H]([NH+]2CCCC2)C[C@H]1C ZINC000334455347 386105075 /nfs/dbraw/zinc/10/50/75/386105075.db2.gz OCOSGPUQOJNGBN-ZIAGYGMSSA-N 2 0 245.370 2.453 20 0 BEADRP c1ccc2c(c1)CC[C@@H]2[NH2+]C1CC[NH2+]CC1 ZINC000038040685 386118388 /nfs/dbraw/zinc/11/83/88/386118388.db2.gz JGOIQLVNQBIZQU-AWEZNQCLSA-N 2 0 216.328 2.016 20 0 BEADRP C[NH+](C)[C@@H]1CCC[C@H]([NH2+][C@@H]2CCOC2(C)C)C1 ZINC000340254716 386118540 /nfs/dbraw/zinc/11/85/40/386118540.db2.gz FKYLTDAEYWDBMA-YNEHKIRRSA-N 2 0 240.391 2.016 20 0 BEADRP COC(C)(C)[C@H](C)[NH2+][C@H]1C[C@@H](C)N(C2CC2)C1 ZINC000340523249 386119099 /nfs/dbraw/zinc/11/90/99/386119099.db2.gz GTJYHSHXVSERCF-WOPDTQHZSA-N 2 0 240.391 2.015 20 0 BEADRP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+][C@H]2CCOC2(C)C)C1 ZINC000340254710 386119914 /nfs/dbraw/zinc/11/99/14/386119914.db2.gz FKYLTDAEYWDBMA-UPJWGTAASA-N 2 0 240.391 2.016 20 0 BEADRP Cc1ccccc1C[C@@H](C)[NH2+]C[C@H]([NH3+])C1CC1 ZINC000414885821 386070197 /nfs/dbraw/zinc/07/01/97/386070197.db2.gz GTHYTZFCPBHHJO-DOMZBBRYSA-N 2 0 232.371 2.253 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@H]2CC2(C)C)[C@H]2CCC[C@@H]21 ZINC000414217392 386073991 /nfs/dbraw/zinc/07/39/91/386073991.db2.gz CCSCJFYWAXFXHA-VOAKCMCISA-N 2 0 222.376 2.247 20 0 BEADRP C[C@@H](CC[NH3+])[NH2+]Cc1cccc(OC(F)F)c1 ZINC000414887484 386082837 /nfs/dbraw/zinc/08/28/37/386082837.db2.gz QKQYUQYSCZLKJN-VIFPVBQESA-N 2 0 244.285 2.115 20 0 BEADRP C[N@H+](CCn1ccnc1)C1CCC(F)(F)CC1 ZINC000286989601 386088930 /nfs/dbraw/zinc/08/89/30/386088930.db2.gz PITRXSIQELQLJQ-UHFFFAOYSA-N 2 0 243.301 2.393 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@@H]1CCc2ccccc2C1 ZINC000336729903 386149348 /nfs/dbraw/zinc/14/93/48/386149348.db2.gz XQVKHHQGWNCUQC-SWLSCSKDSA-N 2 0 232.371 2.261 20 0 BEADRP c1coc([C@@H]2C[C@H]2[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)c1 ZINC000414352179 386155668 /nfs/dbraw/zinc/15/56/68/386155668.db2.gz SZXNZIBDTAVEJF-IGQOVBAYSA-N 2 0 246.354 2.352 20 0 BEADRP C[N@H+](CCC[NH3+])[C@@H]1CCCc2ccccc21 ZINC000106164353 386156884 /nfs/dbraw/zinc/15/68/84/386156884.db2.gz CHZJADGLZLIALG-CQSZACIVSA-N 2 0 218.344 2.345 20 0 BEADRP CC[C@@H](F)CN1CC[C@H](C[NH+](CC)CC)C1 ZINC000440801722 386161754 /nfs/dbraw/zinc/16/17/54/386161754.db2.gz RIVSTJOXFILKJI-CHWSQXEVSA-N 2 0 230.371 2.398 20 0 BEADRP Cc1cc(N(C)C[C@H]2CCC[N@H+](C)C2)cc[nH+]1 ZINC000274931773 386163830 /nfs/dbraw/zinc/16/38/30/386163830.db2.gz QZYFVXKONXIJGO-ZDUSSCGKSA-N 2 0 233.359 2.168 20 0 BEADRP CCc1ccc(CC[NH+]2CCC(C[NH3+])CC2)cc1 ZINC000430617151 386165906 /nfs/dbraw/zinc/16/59/06/386165906.db2.gz KLAZJGCKVRRQIB-UHFFFAOYSA-N 2 0 246.398 2.462 20 0 BEADRP C[C@@H](CCC(F)(F)F)[NH2+]C[C@@H]([NH3+])C1CC1 ZINC000414894864 386177561 /nfs/dbraw/zinc/17/75/61/386177561.db2.gz UTXBGGINWLPQDO-IONNQARKSA-N 2 0 224.270 2.044 20 0 BEADRP CC[C@H]([NH3+])C[NH2+]C1CCC(C(F)(F)F)CC1 ZINC000414995834 386179202 /nfs/dbraw/zinc/17/92/02/386179202.db2.gz WTKKXRSLHHPBRC-KYHHOPLUSA-N 2 0 238.297 2.434 20 0 BEADRP COC1CCC([N@H+](C)C[C@H](N)CC(C)C)CC1 ZINC000414691034 386185240 /nfs/dbraw/zinc/18/52/40/386185240.db2.gz IKFUGRJNFDAAJZ-IYXRBSQSSA-N 2 0 242.407 2.249 20 0 BEADRP C[C@H](CC[NH3+])[NH2+]C/C=C\c1ccc(F)cc1F ZINC000414895402 386185643 /nfs/dbraw/zinc/18/56/43/386185643.db2.gz NNACRKREWIRDNY-MXQLGCADSA-N 2 0 240.297 2.305 20 0 BEADRP C[C@@H]1CCC[C@@H](C[NH2+]C[C@H]([NH3+])C2CC2)C1 ZINC000414895811 386188227 /nfs/dbraw/zinc/18/82/27/386188227.db2.gz ZVBUYRBNUGGTOK-WZRBSPASSA-N 2 0 210.365 2.140 20 0 BEADRP CC[C@@H]([NH3+])CNCc1cccc(OC(C)C)c1 ZINC000414987920 386124703 /nfs/dbraw/zinc/12/47/03/386124703.db2.gz ZLLWUSDJCKDHNE-CYBMUJFWSA-N 2 0 236.359 2.301 20 0 BEADRP C[N@@H+]1CCC[C@@]2(CC[NH+](CCC3CC3)C2)C1 ZINC000334466649 386130052 /nfs/dbraw/zinc/13/00/52/386130052.db2.gz DKKRPNMXFLUQCP-CQSZACIVSA-N 2 0 222.376 2.204 20 0 BEADRP CCSCC[NH+]1CCC([C@@H]2CCC[NH2+]2)CC1 ZINC000129998828 386133289 /nfs/dbraw/zinc/13/32/89/386133289.db2.gz RLPYOFLALMJOFP-ZDUSSCGKSA-N 2 0 242.432 2.204 20 0 BEADRP [NH3+]CCC[N@@H+]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000414691844 386189349 /nfs/dbraw/zinc/18/93/49/386189349.db2.gz JVTCFIGXPKGYNV-GFCCVEGCSA-N 2 0 238.762 2.478 20 0 BEADRP c1csc([C@@H]2CCC[N@H+]2C[C@H]2CC[NH2+]C2)c1 ZINC000647872813 386141004 /nfs/dbraw/zinc/14/10/04/386141004.db2.gz WXSJDKSHDPPKIF-RYUDHWBXSA-N 2 0 236.384 2.495 20 0 BEADRP CCCC[N@H+](CCOC)C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000414701169 386202839 /nfs/dbraw/zinc/20/28/39/386202839.db2.gz UBNVRQYRPRSPKU-ZIAGYGMSSA-N 2 0 242.407 2.123 20 0 BEADRP [NH3+]CCC[N@@H+]1CCC[C@@H]1Cc1cccc(F)c1 ZINC000414699543 386204489 /nfs/dbraw/zinc/20/44/89/386204489.db2.gz IRIJVWMTSLEJOB-CQSZACIVSA-N 2 0 236.334 2.181 20 0 BEADRP CC[N@H+](C)C[C@H]1CC[NH+](CC2(C)CCC2)C1 ZINC000340282431 386204520 /nfs/dbraw/zinc/20/45/20/386204520.db2.gz KDSTZLZOIILNQP-CYBMUJFWSA-N 2 0 224.392 2.450 20 0 BEADRP COc1ccccc1/C=C\C[NH2+]CCCC[NH3+] ZINC000414897762 386211891 /nfs/dbraw/zinc/21/18/91/386211891.db2.gz CMCBZLMWJNLZQF-VURMDHGXSA-N 2 0 234.343 2.037 20 0 BEADRP Cc1ccc(C)c(C[N@H+]2C[C@@H](C[NH3+])C[C@@H]2C)c1 ZINC000131678147 386213972 /nfs/dbraw/zinc/21/39/72/386213972.db2.gz DJCRXGQGHNOFAK-UONOGXRCSA-N 2 0 232.371 2.473 20 0 BEADRP CCO[C@H]1C[C@H]([N@H+](C)CCC[NH3+])C1(CC)CC ZINC000414704077 386216145 /nfs/dbraw/zinc/21/61/45/386216145.db2.gz JEXHXUNDIIFAGS-STQMWFEESA-N 2 0 242.407 2.251 20 0 BEADRP c1ccc2c(c1)CC[C@H]2[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000132015986 386219066 /nfs/dbraw/zinc/21/90/66/386219066.db2.gz PENMQFUCTYRLGJ-IUODEOHRSA-N 2 0 230.355 2.263 20 0 BEADRP COc1ccccc1/C=C\CN1CCC[C@@H]1C[NH3+] ZINC000347040200 386226254 /nfs/dbraw/zinc/22/62/54/386226254.db2.gz HSPLWJNTIPZGIJ-HJHHMULASA-N 2 0 246.354 2.132 20 0 BEADRP Fc1ccc(C[NH2+][C@@H]2C[C@H]2C2CC[NH2+]CC2)cc1 ZINC000415000997 386227885 /nfs/dbraw/zinc/22/78/85/386227885.db2.gz BWCTXLQAROCRAA-LSDHHAIUSA-N 2 0 248.345 2.303 20 0 BEADRP CC[N@H+](C)C[C@H]1CC[NH+](CC2(SC)CC2)C1 ZINC000340562107 386228873 /nfs/dbraw/zinc/22/88/73/386228873.db2.gz VIGRFMFMEPCOIS-GFCCVEGCSA-N 2 0 242.432 2.156 20 0 BEADRP CC[C@H](C)[C@H](C)[N@H+](C[C@H]1CC[NH2+]C1)C1CC1 ZINC000647884519 386260359 /nfs/dbraw/zinc/26/03/59/386260359.db2.gz ZECYVXSBODGPAU-AVGNSLFASA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000339066400 386232650 /nfs/dbraw/zinc/23/26/50/386232650.db2.gz BZKLPLKIBXGSBJ-SNPRPXQTSA-N 2 0 248.370 2.427 20 0 BEADRP CC(C)(C)C[C@@H]1CCC[N@@H+]1C[C@@H]1CC[NH2+]C1 ZINC000647882633 386234652 /nfs/dbraw/zinc/23/46/52/386234652.db2.gz HSGABDGIDCGDKI-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP [NH3+]C[C@@H]1CC[N@H+](C/C=C/c2ccc(F)cc2)C1 ZINC000347084545 386242734 /nfs/dbraw/zinc/24/27/34/386242734.db2.gz AQRHTURSQQOLON-AORQRIRUSA-N 2 0 234.318 2.120 20 0 BEADRP COc1ccc2oc(C[NH2+]CCCC[NH3+])cc2c1 ZINC000414899423 386250531 /nfs/dbraw/zinc/25/05/31/386250531.db2.gz FZFAFYOMJHECSF-UHFFFAOYSA-N 2 0 248.326 2.270 20 0 BEADRP [NH3+][C@@H]1CCC[C@H](C[NH2+]Cc2ccccc2F)C1 ZINC000415003291 386254485 /nfs/dbraw/zinc/25/44/85/386254485.db2.gz WXFKFAPSJSHFBJ-WCQYABFASA-N 2 0 236.334 2.433 20 0 BEADRP CC[N@H+](CC[C@@H]1CCC[NH+]1C)C1CCC1 ZINC000336646634 386255655 /nfs/dbraw/zinc/25/56/55/386255655.db2.gz KWQAYOICEVKXTH-LBPRGKRZSA-N 2 0 210.365 2.345 20 0 BEADRP CC(C)[C@@H]1CCC[C@@H]1[NH2+]C[C@H]([NH3+])C1CC1 ZINC000414895681 386194145 /nfs/dbraw/zinc/19/41/45/386194145.db2.gz YORFMDNICIFGOB-AVGNSLFASA-N 2 0 210.365 2.138 20 0 BEADRP [NH3+][C@H](C[NH2+]C[C@@H]1C[C@H]1c1ccccc1)C1CC1 ZINC000414895612 386194200 /nfs/dbraw/zinc/19/42/00/386194200.db2.gz YEINCCNDHZINHT-SOUVJXGZSA-N 2 0 230.355 2.117 20 0 BEADRP C[C@@H]1C[C@H](C[N@H+](C)[C@H]2CC2(C)C)CC[NH2+]1 ZINC000414741521 386324228 /nfs/dbraw/zinc/32/42/28/386324228.db2.gz MNYYBZLLZOINKV-UTUOFQBUSA-N 2 0 210.365 2.105 20 0 BEADRP C(C[N@@H+]1CC[C@H](C[NH+]2CCCC2)C1)C1CC1 ZINC000336663055 386281137 /nfs/dbraw/zinc/28/11/37/386281137.db2.gz DTRACCJHCKOGMU-CQSZACIVSA-N 2 0 222.376 2.204 20 0 BEADRP C[C@@H]1C[C@@H](c2ccccc2)C[N@@H+]1C[C@H]1CC[NH2+]C1 ZINC000647885884 386297093 /nfs/dbraw/zinc/29/70/93/386297093.db2.gz DRFTWKROMNKOCK-IJEWVQPXSA-N 2 0 244.382 2.474 20 0 BEADRP [NH3+]CCCC[NH2+]Cc1ccc(OCC2CC2)cc1 ZINC000414901153 386298218 /nfs/dbraw/zinc/29/82/18/386298218.db2.gz IJYCEFMSKBGNAS-UHFFFAOYSA-N 2 0 248.370 2.304 20 0 BEADRP CC[N@H+](CCC[NH3+])[C@@H](C)c1cccc(O)c1 ZINC000414734218 386300161 /nfs/dbraw/zinc/30/01/61/386300161.db2.gz BQAWQIYWTLXDPD-NSHDSACASA-N 2 0 222.332 2.124 20 0 BEADRP C[C@@H]1CC[C@H]([N@H+](C)C[C@H]2CC[NH2+][C@H](C)C2)C1 ZINC000414737031 386304629 /nfs/dbraw/zinc/30/46/29/386304629.db2.gz IFTNPZXSIFWRBR-MQYQWHSLSA-N 2 0 224.392 2.495 20 0 BEADRP Cc1ccncc1C[N@@H+](C)C[C@@H]1CC[NH2+][C@@H](C)C1 ZINC000414738293 386317495 /nfs/dbraw/zinc/31/74/95/386317495.db2.gz JAWYYYCAMWOYLV-UONOGXRCSA-N 2 0 247.386 2.210 20 0 BEADRP CSCC[N@H+](C)C1CC[NH+](C(C)C)CC1 ZINC000336650724 386263646 /nfs/dbraw/zinc/26/36/46/386263646.db2.gz SYBHYDJMXPLORJ-UHFFFAOYSA-N 2 0 230.421 2.154 20 0 BEADRP CC(C)(C)C[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000297630656 386270968 /nfs/dbraw/zinc/27/09/68/386270968.db2.gz WNSOTMJWUASAMH-UHFFFAOYSA-N 2 0 217.316 2.470 20 0 BEADRP CC(C)[C@H]([NH3+])CC[N@H+](C)Cc1cccc(N)c1 ZINC000340581680 386278329 /nfs/dbraw/zinc/27/83/29/386278329.db2.gz DHCYAONWHHGFOE-CQSZACIVSA-N 2 0 235.375 2.074 20 0 BEADRP C[C@H]1[C@@H](N2CCCC2)CC[N@@H+]1CCC1CC1 ZINC000347349105 386344484 /nfs/dbraw/zinc/34/44/84/386344484.db2.gz VEXXCMNBFDWXFZ-JSGCOSHPSA-N 2 0 222.376 2.345 20 0 BEADRP C[C@@H]1[C@H](c2ccccc2)CC[N@@H+]1C[C@@H]1CC[NH2+]C1 ZINC000647889348 386356642 /nfs/dbraw/zinc/35/66/42/386356642.db2.gz JBTNKLCXSKJPCF-IIAWOOMASA-N 2 0 244.382 2.474 20 0 BEADRP CC(C)(CNCc1ccco1)C[NH+]1CCCC1 ZINC000276687262 386365021 /nfs/dbraw/zinc/36/50/21/386365021.db2.gz JMODZDQWMQXWLG-UHFFFAOYSA-N 2 0 236.359 2.491 20 0 BEADRP [NH3+]CCCC[NH2+][C@H]1CCCC[C@H]1C1CC1 ZINC000414902516 386329401 /nfs/dbraw/zinc/32/94/01/386329401.db2.gz JUWHDVSFDHEENO-STQMWFEESA-N 2 0 210.365 2.284 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@@H]2CC[NH2+]C2)[C@H](C)C1 ZINC000414902730 386331640 /nfs/dbraw/zinc/33/16/40/386331640.db2.gz HLRDWZFHKPCFOQ-LPWJVIDDSA-N 2 0 210.365 2.010 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3F)C[C@@H]21 ZINC000230047020 386336766 /nfs/dbraw/zinc/33/67/66/386336766.db2.gz BKFMLEFIOYCBQP-CORIIIEPSA-N 2 0 248.345 2.385 20 0 BEADRP COc1ccc([C@H](C)C[N@H+](C)C2CC([NH3+])C2)cc1 ZINC000414769383 386446347 /nfs/dbraw/zinc/44/63/47/386446347.db2.gz KBBLNRCSVFDBBN-LMWSTFAQSA-N 2 0 248.370 2.220 20 0 BEADRP C[C@@H](C[NH2+][C@@H]1CCc2ccccc2C1)C[NH+](C)C ZINC000291709200 386448141 /nfs/dbraw/zinc/44/81/41/386448141.db2.gz LBHIQBFSBLKSBP-XJKSGUPXSA-N 2 0 246.398 2.331 20 0 BEADRP C[NH+]1CCC(N[C@H]2C[C@@]2(F)c2ccccc2)CC1 ZINC000335279460 386392372 /nfs/dbraw/zinc/39/23/72/386392372.db2.gz HUXQOPPQLKRTTL-LSDHHAIUSA-N 2 0 248.345 2.308 20 0 BEADRP C[C@H]1CC[C@H]([NH2+][C@@H]2C[C@H]2C2CC[NH2+]CC2)C1 ZINC000415008831 386392594 /nfs/dbraw/zinc/39/25/94/386392594.db2.gz NEJRQJGVXMNHMR-DOERSZECSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H]1CCCC[C@@H]1[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000414907693 386393390 /nfs/dbraw/zinc/39/33/90/386393390.db2.gz QWGAFWOKLPBYHC-XQQFMLRXSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H]([NH+](C)C)C2)[C@@H]1C ZINC000336776738 386399240 /nfs/dbraw/zinc/39/92/40/386399240.db2.gz GMLPXUPROGSJBO-POQQGIQPSA-N 2 0 224.392 2.493 20 0 BEADRP Cc1ccncc1CCC[N@H+]1CCO[C@H](C)[C@H]1C ZINC000290188121 386403481 /nfs/dbraw/zinc/40/34/81/386403481.db2.gz ZUAUTFSJRMXLRS-ZIAGYGMSSA-N 2 0 248.370 2.432 20 0 BEADRP c1cncc(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)c1 ZINC000093451341 386414199 /nfs/dbraw/zinc/41/41/99/386414199.db2.gz UXJSDQVKUJMCPM-QLFBSQMISA-N 2 0 245.370 2.092 20 0 BEADRP c1coc(CC[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)c1 ZINC000093451633 386414223 /nfs/dbraw/zinc/41/42/23/386414223.db2.gz ACTOBCLKHMPQNO-ZNMIVQPWSA-N 2 0 248.370 2.332 20 0 BEADRP C[C@H](CC1CCOCC1)[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000414909749 386416271 /nfs/dbraw/zinc/41/62/71/386416271.db2.gz CJRMHTJPEXAJOL-MRVWCRGKSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@H](C[C@@H]1CCC[NH2+]1)[NH2+]CCc1ccccc1 ZINC000093462326 386416903 /nfs/dbraw/zinc/41/69/03/386416903.db2.gz QURXJOUDYSAHGI-HIFRSBDPSA-N 2 0 232.371 2.349 20 0 BEADRP Cc1ccc(C[NH2+]CC[C@H]2CCC[NH2+]2)cc1F ZINC000414910241 386423754 /nfs/dbraw/zinc/42/37/54/386423754.db2.gz UOYKGDYSPWPOKS-CYBMUJFWSA-N 2 0 236.334 2.366 20 0 BEADRP C[C@H]([NH2+][C@H]1CCCC[C@H]1C[NH3+])c1cccnc1 ZINC000160881318 386424651 /nfs/dbraw/zinc/42/46/51/386424651.db2.gz LKRGSACBTKPNEZ-OBJOEFQTSA-N 2 0 233.359 2.250 20 0 BEADRP CCCC[C@H](COC)[NH2+]CC1(C)CC[NH2+]CC1 ZINC000414912622 386476634 /nfs/dbraw/zinc/47/66/34/386476634.db2.gz VLOALFINQDLGCP-CYBMUJFWSA-N 2 0 242.407 2.171 20 0 BEADRP C[C@H](CN(C)C)[NH2+][C@H]1CC[C@@H]1C1CCC1 ZINC000336742078 386476760 /nfs/dbraw/zinc/47/67/60/386476760.db2.gz WGWHEOLDKVOOJT-RTXFEEFZSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@H](Cc1ccccc1F)[NH2+]C1CC[NH2+]CC1 ZINC000414776537 386480611 /nfs/dbraw/zinc/48/06/11/386480611.db2.gz FOQMEGDOROMOTA-LLVKDONJSA-N 2 0 236.334 2.098 20 0 BEADRP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+]C[C@@H]2CCSC2)C1 ZINC000336778959 386480610 /nfs/dbraw/zinc/48/06/10/386480610.db2.gz MVFBLAUCWFHLCD-YNEHKIRRSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1ccncc1 ZINC000227498279 386485429 /nfs/dbraw/zinc/48/54/29/386485429.db2.gz XLQRXVIKGCRDIO-CYBMUJFWSA-N 2 0 247.386 2.464 20 0 BEADRP C[C@@H](Cc1ccc(F)cc1)[NH2+]C1CC[NH2+]CC1 ZINC000062050498 386491405 /nfs/dbraw/zinc/49/14/05/386491405.db2.gz ZVRDTUXVCWNHLQ-NSHDSACASA-N 2 0 236.334 2.098 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+][C@H](C)[C@H](C)[NH3+] ZINC000415013125 386496352 /nfs/dbraw/zinc/49/63/52/386496352.db2.gz KFKHSMVJSWWSHZ-GJMOJQLCSA-N 2 0 212.259 2.043 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H]1CCC[C@H]1C1CC1 ZINC000415015125 386500219 /nfs/dbraw/zinc/50/02/19/386500219.db2.gz AERWFIJDEIFFRX-KGYLQXTDSA-N 2 0 210.365 2.282 20 0 BEADRP Cc1ccc(F)c(C[NH2+][C@H](C)CCC[NH3+])c1 ZINC000415015444 386500517 /nfs/dbraw/zinc/50/05/17/386500517.db2.gz ARWBGMCWPWXVFK-LLVKDONJSA-N 2 0 224.323 2.351 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H](C)CC1CCOCC1 ZINC000415018555 386502741 /nfs/dbraw/zinc/50/27/41/386502741.db2.gz UKNFIUAHUALNRO-OLZOCXBDSA-N 2 0 242.407 2.299 20 0 BEADRP COc1ccccc1/C=C\C[NH2+][C@@H](C)CCC[NH3+] ZINC000415016850 386503708 /nfs/dbraw/zinc/50/37/08/386503708.db2.gz DHHMPVWNVJOTOB-XURPKSDJSA-N 2 0 248.370 2.425 20 0 BEADRP C[C@H]([NH3+])[C@H](C)[NH2+][C@H]1Cc2ccc(Cl)cc2C1 ZINC000415019166 386505508 /nfs/dbraw/zinc/50/55/08/386505508.db2.gz RPIWFSXSZPDEMU-RVBZMBCESA-N 2 0 238.762 2.133 20 0 BEADRP CC(C)C[C@@H](C)C[NH2+][C@H]1CC[NH2+]C1(C)C ZINC000415050428 386505797 /nfs/dbraw/zinc/50/57/97/386505797.db2.gz YRZGXQANNBBQKH-NEPJUHHUSA-N 2 0 212.381 2.399 20 0 BEADRP CC(C)C[C@H](C)C[NH2+][C@H]1CC[NH2+]C1(C)C ZINC000415050432 386506251 /nfs/dbraw/zinc/50/62/51/386506251.db2.gz YRZGXQANNBBQKH-RYUDHWBXSA-N 2 0 212.381 2.399 20 0 BEADRP c1cc(C2CC2)ccc1C[NH2+]C1CC[NH2+]CC1 ZINC000414784123 386506331 /nfs/dbraw/zinc/50/63/31/386506331.db2.gz RNUNLEPJWHSJSX-UHFFFAOYSA-N 2 0 230.355 2.406 20 0 BEADRP C[C@H]1[C@@H]([NH3+])CC[N@@H+]1C[C@H]1CCC[C@H](C)C1 ZINC000415050481 386506661 /nfs/dbraw/zinc/50/66/61/386506661.db2.gz CWZZBTQGWYSFDC-CYDGBPFRSA-N 2 0 210.365 2.234 20 0 BEADRP CC(C)(C)C[N@@H+]1CCC[C@@H]([C@H]2CC[NH2+]C2)C1 ZINC000414783755 386508074 /nfs/dbraw/zinc/50/80/74/386508074.db2.gz QMJOFFZZXNFTGM-QWHCGFSZSA-N 2 0 224.392 2.354 20 0 BEADRP CCC[C@@H](Cc1ccccc1)[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000415019925 386509274 /nfs/dbraw/zinc/50/92/74/386509274.db2.gz AJFDIMPRXVOPCL-CAOSSQGBSA-N 2 0 244.382 2.205 20 0 BEADRP c1ccc([C@H]2CCC[C@@H]2[NH2+][C@@H]2[C@H]3C[NH2+]C[C@H]32)cc1 ZINC000415052325 386509644 /nfs/dbraw/zinc/50/96/44/386509644.db2.gz CMFLEJKPDFSBGC-OWYFMNJBSA-N 2 0 242.366 2.130 20 0 BEADRP C[C@@H](Cc1ccccc1)C[N@@H+]1CC[C@H]([NH3+])[C@@H]1C ZINC000415052474 386511774 /nfs/dbraw/zinc/51/17/74/386511774.db2.gz HQSKBVINJQZWQC-YDHLFZDLSA-N 2 0 232.371 2.287 20 0 BEADRP Cc1ccc(C[NH2+][C@H](C)CCC[NH3+])cc1F ZINC000415023456 386513341 /nfs/dbraw/zinc/51/33/41/386513341.db2.gz MWUWOIYUFXJCFS-LLVKDONJSA-N 2 0 224.323 2.351 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]Cc1cnc2ccccc2c1 ZINC000415023666 386515003 /nfs/dbraw/zinc/51/50/03/386515003.db2.gz NGTBDOBIQJSIGK-GFCCVEGCSA-N 2 0 243.354 2.452 20 0 BEADRP Cc1cc(F)ccc1C[NH2+][C@H](C)CCC[NH3+] ZINC000415024092 386515116 /nfs/dbraw/zinc/51/51/16/386515116.db2.gz OFXJQOZDXIHLAB-LLVKDONJSA-N 2 0 224.323 2.351 20 0 BEADRP COCc1ccc(C[NH2+][C@H](C)CCC[NH3+])cc1 ZINC000415026417 386516418 /nfs/dbraw/zinc/51/64/18/386516418.db2.gz UHOLATXOXQSDKG-GFCCVEGCSA-N 2 0 236.359 2.050 20 0 BEADRP [NH3+]CCCN1CCc2sc(Cl)cc2C1 ZINC000335448092 386517896 /nfs/dbraw/zinc/51/78/96/386517896.db2.gz MEZCRNRYUGTKIS-UHFFFAOYSA-N 2 0 230.764 2.108 20 0 BEADRP CCc1cc(OC)ccc1CN1CC[C@H]([NH3+])[C@H]1C ZINC000414784784 386518196 /nfs/dbraw/zinc/51/81/96/386518196.db2.gz LIFCMEKNIVLGBE-ABAIWWIYSA-N 2 0 248.370 2.179 20 0 BEADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+]Cc2cc(F)ccc2F)C1 ZINC000415030707 386519846 /nfs/dbraw/zinc/51/98/46/386519846.db2.gz FWWBSKCKDJMUOO-BXKDBHETSA-N 2 0 240.297 2.182 20 0 BEADRP CC(C)[C@@H]1CC[C@H]([NH2+][C@@H]2[C@H]3C[NH2+]C[C@H]32)C[C@H]1C ZINC000415034960 386521964 /nfs/dbraw/zinc/52/19/64/386521964.db2.gz KGRLQOOJPXJMKB-GHRCFYLDSA-N 2 0 236.403 2.255 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CCCC[C@@H]1[C@@H]1CC[NH2+]C1 ZINC000415033812 386522188 /nfs/dbraw/zinc/52/21/88/386522188.db2.gz CCAALLDVQFTLCJ-AAVRWANBSA-N 2 0 222.376 2.106 20 0 BEADRP CC(C)C[C@H](C)C[NH2+][C@H]1CC[C@@H](C[NH3+])C1 ZINC000415036006 386523498 /nfs/dbraw/zinc/52/34/98/386523498.db2.gz KZKVUWOTLONRNY-XQQFMLRXSA-N 2 0 212.381 2.386 20 0 BEADRP CCC[C@H](C)C[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000414915587 386523702 /nfs/dbraw/zinc/52/37/02/386523702.db2.gz ZRXWQASBQSIQJY-STQMWFEESA-N 2 0 212.381 2.402 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CC[C@@H](C[NH3+])C2)s1 ZINC000415036878 386524140 /nfs/dbraw/zinc/52/41/40/386524140.db2.gz LSWIXHMMCRQWET-MNOVXSKESA-N 2 0 224.373 2.274 20 0 BEADRP C(C[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21)CC1CCCCC1 ZINC000415037779 386524602 /nfs/dbraw/zinc/52/46/02/386524602.db2.gz NGOKEZCNHVHNAJ-WDNDVIMCSA-N 2 0 222.376 2.154 20 0 BEADRP CC(C)C[C@H](C)C[NH2+][C@H]1CC[C@H](C[NH3+])C1 ZINC000415036004 386524666 /nfs/dbraw/zinc/52/46/66/386524666.db2.gz KZKVUWOTLONRNY-AVGNSLFASA-N 2 0 212.381 2.386 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+][C@H]1CC[C@@H](C[NH3+])C1 ZINC000415039897 386526894 /nfs/dbraw/zinc/52/68/94/386526894.db2.gz OPKXUPCHOMCGED-BBBLOLIVSA-N 2 0 238.297 2.434 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@H]1CCC[C@@H]1C(C)C ZINC000414799084 386576083 /nfs/dbraw/zinc/57/60/83/386576083.db2.gz RBHIHPVOVWAWOY-UPJWGTAASA-N 2 0 212.381 2.384 20 0 BEADRP CC[C@H](C)[N@@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000647977777 386577917 /nfs/dbraw/zinc/57/79/17/386577917.db2.gz HNSXPYOXGFAIQT-BFHYXJOUSA-N 2 0 224.392 2.497 20 0 BEADRP CCCC[C@H](COC)[NH2+][C@@H]1CCCC[C@@H]1C[NH3+] ZINC000414800787 386585912 /nfs/dbraw/zinc/58/59/12/386585912.db2.gz LJOFKNZRPMESHP-MGPQQGTHSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+][C@@H](C)Cc1ccoc1 ZINC000336757411 386586604 /nfs/dbraw/zinc/58/66/04/386586604.db2.gz YYWCOSMDHKRVFQ-RYUDHWBXSA-N 2 0 224.348 2.140 20 0 BEADRP C[C@]1(C[NH2+]C[C@@H]2CCc3ccccc32)CC[NH2+]C1 ZINC000415077696 386587463 /nfs/dbraw/zinc/58/74/63/386587463.db2.gz HVLQIYNQWWNGNV-HOCLYGCPSA-N 2 0 244.382 2.306 20 0 BEADRP CC(C)C[C@@H]([NH3+])C[NH2+]CCc1cccs1 ZINC000415078945 386588896 /nfs/dbraw/zinc/58/88/96/386588896.db2.gz HJFINIYBXDWDDV-LLVKDONJSA-N 2 0 226.389 2.254 20 0 BEADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@@H]2CCC[C@@H]2C2CC2)C1 ZINC000415046373 386531874 /nfs/dbraw/zinc/53/18/74/386531874.db2.gz VCNCHVZLOGMRCL-YXCITZCRSA-N 2 0 222.376 2.282 20 0 BEADRP [NH3+]C[C@H]1CC[C@H]([NH2+]Cc2ncc(Cl)s2)C1 ZINC000415045505 386532514 /nfs/dbraw/zinc/53/25/14/386532514.db2.gz UDKVTEREIJTVBJ-YUMQZZPRSA-N 2 0 245.779 2.014 20 0 BEADRP CC(C)c1ccc(CC[NH2+][C@@H]2[C@H]3C[NH2+]C[C@H]32)cc1 ZINC000415046059 386532601 /nfs/dbraw/zinc/53/26/01/386532601.db2.gz WQWGNBIUSMAFDN-ZSHCYNCHSA-N 2 0 244.382 2.160 20 0 BEADRP Nc1cc(C[N@@H+]2CCC[C@@H]3CCC[C@H]32)ccn1 ZINC000228053149 386534786 /nfs/dbraw/zinc/53/47/86/386534786.db2.gz BCVLDQAFDUAHQT-QWHCGFSZSA-N 2 0 231.343 2.428 20 0 BEADRP COc1cc(C[NH2+][C@@H]2CC[C@H](C[NH3+])C2)ccc1C ZINC000415048804 386534850 /nfs/dbraw/zinc/53/48/50/386534850.db2.gz XKCIKCZKMAMSCW-GXTWGEPZSA-N 2 0 248.370 2.221 20 0 BEADRP [NH3+]CCC[C@@H]([NH2+]C1CCOCC1)c1ccccc1 ZINC000415047107 386534887 /nfs/dbraw/zinc/53/48/87/386534887.db2.gz DTIYLVPEHFKSMH-OAHLLOKOSA-N 2 0 248.370 2.235 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@@H]1CC[C@@H](C)[C@@H](C)C1 ZINC000414802375 386596751 /nfs/dbraw/zinc/59/67/51/386596751.db2.gz VOPJLLUAVNJKEV-YVECIDJPSA-N 2 0 212.381 2.384 20 0 BEADRP CC(C)C[C@H](C)C[NH2+]C[C@@H]([NH3+])C(C)C ZINC000414787388 386536046 /nfs/dbraw/zinc/53/60/46/386536046.db2.gz CHDIUZVQRPSAAR-NWDGAFQWSA-N 2 0 200.370 2.242 20 0 BEADRP C[C@H](C[NH2+]C1CC(C)(C)C1)N(C)C1CC1 ZINC000336755403 386537495 /nfs/dbraw/zinc/53/74/95/386537495.db2.gz IVHBPEXEMKCZFT-SNVBAGLBSA-N 2 0 210.365 2.247 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+][C@H]1CC[C@@H](C)C[C@H]1C ZINC000414790922 386539935 /nfs/dbraw/zinc/53/99/35/386539935.db2.gz HFGNSSUKQJAIGI-NDBYEHHHSA-N 2 0 212.381 2.384 20 0 BEADRP COc1ccccc1CN[C@H](C[NH3+])C(C)(C)C ZINC000415060028 386541087 /nfs/dbraw/zinc/54/10/87/386541087.db2.gz VWNLMLFCIMOLBI-CYBMUJFWSA-N 2 0 236.359 2.158 20 0 BEADRP C[C@@H](CN1CC[C@H]([NH3+])[C@@H]1C)c1ccccc1 ZINC000415058591 386541141 /nfs/dbraw/zinc/54/11/41/386541141.db2.gz VYNGUEIGFQZPAH-OBJOEFQTSA-N 2 0 218.344 2.212 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH2+][C@@H]2CCCC23CC3)C1 ZINC000519710480 386542880 /nfs/dbraw/zinc/54/28/80/386542880.db2.gz NSOLOWADUSNXDY-QWHCGFSZSA-N 2 0 222.376 2.251 20 0 BEADRP CCCC[C@H]1CCC[C@H]1[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000415063853 386543758 /nfs/dbraw/zinc/54/37/58/386543758.db2.gz PLWYHOSRWJJDDB-ODXJTPSBSA-N 2 0 222.376 2.153 20 0 BEADRP C(C[NH2+]C1CC1)C[NH2+][C@H]1CCC[C@@H]1C1CC1 ZINC000415064262 386544731 /nfs/dbraw/zinc/54/47/31/386544731.db2.gz CDUMNPHXWGDTAG-KGLIPLIRSA-N 2 0 222.376 2.297 20 0 BEADRP CC(C)([NH3+])C[NH2+]C[C@H]1CCc2ccccc21 ZINC000415084088 386597075 /nfs/dbraw/zinc/59/70/75/386597075.db2.gz QXQDPPXMWCWXDR-GFCCVEGCSA-N 2 0 218.344 2.043 20 0 BEADRP C[C@@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)C1CCC1 ZINC000414918543 386546617 /nfs/dbraw/zinc/54/66/17/386546617.db2.gz UTTMZOABGIYFFC-YPMHNXCESA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CC2C[NH2+]C2)c2ccccc21 ZINC000335463621 386547087 /nfs/dbraw/zinc/54/70/87/386547087.db2.gz YYPIXXDAUAPPGT-HZMBPMFUSA-N 2 0 216.328 2.044 20 0 BEADRP CC1(C)CC[C@@H]([NH2+][C@H]2CCCC[NH2+]C2)C1 ZINC000415066485 386547620 /nfs/dbraw/zinc/54/76/20/386547620.db2.gz IWRHKTRGNOUUGB-NEPJUHHUSA-N 2 0 210.365 2.297 20 0 BEADRP Fc1ccc(/C=C\C[NH2+]C2CC[NH2+]CC2)cc1 ZINC000414791886 386550359 /nfs/dbraw/zinc/55/03/59/386550359.db2.gz RGGAGXAMZSBUBM-UPHRSURJSA-N 2 0 234.318 2.181 20 0 BEADRP C[C@@H](CCC(F)(F)F)[NH2+][C@@H]1CCCC[NH2+]C1 ZINC000415070987 386553508 /nfs/dbraw/zinc/55/35/08/386553508.db2.gz JJHGOIBKIDWTPA-VHSXEESVSA-N 2 0 238.297 2.449 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CC=C(C)C)[C@H](C)C1 ZINC000188447208 386554720 /nfs/dbraw/zinc/55/47/20/386554720.db2.gz XHCPIYDFYBWYDN-OLZOCXBDSA-N 2 0 210.365 2.273 20 0 BEADRP CCC[N@@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC000647974964 386556545 /nfs/dbraw/zinc/55/65/45/386556545.db2.gz DQEKWVANEYFEFO-QWHCGFSZSA-N 2 0 210.365 2.108 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CC=C(C)C)[C@H](C)C1 ZINC000188447232 386556723 /nfs/dbraw/zinc/55/67/23/386556723.db2.gz XHCPIYDFYBWYDN-CHWSQXEVSA-N 2 0 210.365 2.273 20 0 BEADRP Cc1oc2ccccc2c1CN1CC[C@@H]([NH3+])C1 ZINC000123574369 386559617 /nfs/dbraw/zinc/55/96/17/386559617.db2.gz NEDUMIJPAAIDEU-LLVKDONJSA-N 2 0 230.311 2.274 20 0 BEADRP C[C@H](CC1CC1)[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000414919809 386562797 /nfs/dbraw/zinc/56/27/97/386562797.db2.gz XUAAOESODCJXIV-YPMHNXCESA-N 2 0 210.365 2.154 20 0 BEADRP c1ccc2c(c1)CC[C@@H]([NH2+][C@@H]1CCCC[NH2+]C1)C2 ZINC000415075692 386569893 /nfs/dbraw/zinc/56/98/93/386569893.db2.gz RDOCLETWJVADEG-HZPDHXFCSA-N 2 0 244.382 2.276 20 0 BEADRP C(C1CCC1)[N@@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000647976489 386570448 /nfs/dbraw/zinc/57/04/48/386570448.db2.gz PMUQGZKWINISHH-CABCVRRESA-N 2 0 236.403 2.498 20 0 BEADRP COCc1ccc(C[NH2+][C@H]2CCC[C@@H]2C[NH3+])cc1 ZINC000414795560 386572424 /nfs/dbraw/zinc/57/24/24/386572424.db2.gz MYOITAUEVJOTMQ-CABCVRRESA-N 2 0 248.370 2.050 20 0 BEADRP C[C@H](C[C@@H]1CCC[NH2+]1)[NH2+][C@H]1CCC[C@@H]2C[C@@H]21 ZINC000415111120 386621576 /nfs/dbraw/zinc/62/15/76/386621576.db2.gz OHQWBDTXVXHCGJ-DGTMBMJNSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@H]1CC([NH2+]CC2=CC[NH2+]CC2)C[C@H](C)C1 ZINC000335501363 386630741 /nfs/dbraw/zinc/63/07/41/386630741.db2.gz RYULCHLDJJEOGJ-VXGBXAGGSA-N 2 0 222.376 2.320 20 0 BEADRP CC(C)([NH3+])C[NH2+][C@H]1CCC[C@@H](C2CC2)C1 ZINC000414810920 386632800 /nfs/dbraw/zinc/63/28/00/386632800.db2.gz YJLDMJNQOCBCOI-NEPJUHHUSA-N 2 0 210.365 2.282 20 0 BEADRP CC[C@H](Cc1ccccc1)[NH2+]CC(C)(C)[NH3+] ZINC000414811287 386634023 /nfs/dbraw/zinc/63/40/23/386634023.db2.gz YXGYERPIDJYDOI-CYBMUJFWSA-N 2 0 220.360 2.335 20 0 BEADRP CC[C@@H](Cc1ccccc1)[NH2+]CC(C)(C)[NH3+] ZINC000414811288 386634590 /nfs/dbraw/zinc/63/45/90/386634590.db2.gz YXGYERPIDJYDOI-ZDUSSCGKSA-N 2 0 220.360 2.335 20 0 BEADRP c1cncc(CNCC[NH2+]C2CCCCCC2)c1 ZINC000414814038 386637374 /nfs/dbraw/zinc/63/73/74/386637374.db2.gz RHWZRVCCOVXHLP-UHFFFAOYSA-N 2 0 247.386 2.484 20 0 BEADRP NC[C@@H]([NH2+]CCC1CCCCC1)C1CC1 ZINC000414813250 386642733 /nfs/dbraw/zinc/64/27/33/386642733.db2.gz QKRHRCPDQDVCIG-CYBMUJFWSA-N 2 0 210.365 2.284 20 0 BEADRP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1)c1cccnc1 ZINC000415081711 386599824 /nfs/dbraw/zinc/59/98/24/386599824.db2.gz KUSBBUSRDCDSOR-SGMGOOAPSA-N 2 0 233.359 2.120 20 0 BEADRP Cc1occc1C[NH2+]CC[C@@H]1CCC[N@@H+](C)C1 ZINC000414461920 386602111 /nfs/dbraw/zinc/60/21/11/386602111.db2.gz LMVKSTQHPRQJOA-ZDUSSCGKSA-N 2 0 236.359 2.410 20 0 BEADRP COc1cc(C[NH2+][C@@H]2CCC[C@H]2C[NH3+])ccc1C ZINC000414803870 386606355 /nfs/dbraw/zinc/60/63/55/386606355.db2.gz OIXCADCGJDIFTO-UONOGXRCSA-N 2 0 248.370 2.221 20 0 BEADRP FCCC[N@@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC000647978566 386606593 /nfs/dbraw/zinc/60/65/93/386606593.db2.gz UWORQOSCYUECBA-QWHCGFSZSA-N 2 0 228.355 2.058 20 0 BEADRP [NH3+]C[C@H](NC/C=C/c1ccc(F)cc1)C1CC1 ZINC000414807926 386611101 /nfs/dbraw/zinc/61/11/01/386611101.db2.gz RTSPXHBBRLXOIZ-YUKKFKLSSA-N 2 0 234.318 2.166 20 0 BEADRP COC1CCC([NH2+][C@@H]2CCCC[C@H]2C[NH3+])CC1 ZINC000414805367 386611350 /nfs/dbraw/zinc/61/13/50/386611350.db2.gz POZSNNNWDOPWOB-GFJIZPEISA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H]([NH2+]C1CCC(C[NH3+])CC1)c1ccccn1 ZINC000415096249 386614232 /nfs/dbraw/zinc/61/42/32/386614232.db2.gz ARALWFUIFVXNDB-PNESKVBLSA-N 2 0 233.359 2.250 20 0 BEADRP C1CC2(C1)CC[C@@H]2[NH2+][C@H]1CCCC[NH2+]C1 ZINC000335495439 386615648 /nfs/dbraw/zinc/61/56/48/386615648.db2.gz IYSYJGYMVOFAGN-RYUDHWBXSA-N 2 0 208.349 2.051 20 0 BEADRP CC(C)C[C@H]([NH3+])CNCc1ccc([C@@H](C)[NH3+])cc1 ZINC000414819858 386661211 /nfs/dbraw/zinc/66/12/11/386661211.db2.gz ZVNZSQLAJLKVFP-DOMZBBRYSA-N 2 0 249.402 2.169 20 0 BEADRP Fc1ccc2c(c1)CC[C@H]2[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000335523198 386663687 /nfs/dbraw/zinc/66/36/87/386663687.db2.gz XMUSSNDKLVDOMY-XHDPSFHLSA-N 2 0 248.345 2.402 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)C1CCC1)[C@@H]1CCC[NH2+]C1 ZINC000414818684 386666788 /nfs/dbraw/zinc/66/67/88/386666788.db2.gz FSVRVCVXZUMXTC-DMDPSCGWSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)CCC[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000414821333 386678101 /nfs/dbraw/zinc/67/81/01/386678101.db2.gz BEBQIMZSSNZZJD-FUNVUKJBSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H](CCc1ccccc1)[NH2+]CC[C@H](C)[NH3+] ZINC000414823864 386681101 /nfs/dbraw/zinc/68/11/01/386681101.db2.gz POEXPFVPDZYDKO-QWHCGFSZSA-N 2 0 220.360 2.335 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]Cc1coc2ccccc12 ZINC000414831303 386710649 /nfs/dbraw/zinc/71/06/49/386710649.db2.gz CVYRQRLHJSTMPR-LLVKDONJSA-N 2 0 232.327 2.378 20 0 BEADRP CC[C@@H](C)[N@@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000337256635 386691898 /nfs/dbraw/zinc/69/18/98/386691898.db2.gz SMVXTMXOIQISSJ-OCCSQVGLSA-N 2 0 224.392 2.449 20 0 BEADRP C([NH2+]C(C1CCC1)C1CCC1)[C@H]1CCC[NH2+]1 ZINC000324982886 386703980 /nfs/dbraw/zinc/70/39/80/386703980.db2.gz TWWRIUQSPRLIAX-CYBMUJFWSA-N 2 0 222.376 2.297 20 0 BEADRP Cc1ccc(F)c(C[NH2+]CC[C@@H]2CC[NH2+]C2)c1 ZINC000414835960 386731271 /nfs/dbraw/zinc/73/12/71/386731271.db2.gz SGWILVLIPCUZJZ-LBPRGKRZSA-N 2 0 236.334 2.223 20 0 BEADRP Fc1cccc(F)c1CNC[C@@H]1CCC[NH2+]C1 ZINC000414837046 386732268 /nfs/dbraw/zinc/73/22/68/386732268.db2.gz VJFURRIEIPTEPI-SNVBAGLBSA-N 2 0 240.297 2.054 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]Cc1cc(Cl)cs1 ZINC000414835935 386732848 /nfs/dbraw/zinc/73/28/48/386732848.db2.gz ITRIBJOWAKIMAT-MRVPVSSYSA-N 2 0 232.780 2.347 20 0 BEADRP C[C@@H](CCC(F)(F)F)[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000414838718 386739125 /nfs/dbraw/zinc/73/91/25/386739125.db2.gz XGKANYORDRISDH-VHSXEESVSA-N 2 0 238.297 2.307 20 0 BEADRP CC[C@H](C[N@@H+]1C[C@@H](C)[C@H]([NH3+])C1)c1ccccc1 ZINC000340692953 386713190 /nfs/dbraw/zinc/71/31/90/386713190.db2.gz WNSMXQITFCZKTH-UMVBOHGHSA-N 2 0 232.371 2.459 20 0 BEADRP [NH3+]CCOCC[N@H+](CC1CCCCC1)C1CC1 ZINC000357083917 386713601 /nfs/dbraw/zinc/71/36/01/386713601.db2.gz IXMUDBRKPVECNH-UHFFFAOYSA-N 2 0 240.391 2.006 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CC[C@H]2CC[NH2+]C2)C[C@@H](C)C1 ZINC000414832263 386716464 /nfs/dbraw/zinc/71/64/64/386716464.db2.gz OGUIDLYWPUWSJZ-RQJABVFESA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@]1(C[NH2+][C@@H]2CCC23CCC3)CCC[NH2+]C1 ZINC000335486503 386717321 /nfs/dbraw/zinc/71/73/21/386717321.db2.gz HEMROZIZAVYCEE-CHWSQXEVSA-N 2 0 222.376 2.298 20 0 BEADRP Cc1ccc(CC[NH+]2CCC3(CC[NH2+]3)CC2)cc1 ZINC000335486064 386717953 /nfs/dbraw/zinc/71/79/53/386717953.db2.gz GHHFJVZLALHCQH-UHFFFAOYSA-N 2 0 244.382 2.365 20 0 BEADRP CCCC(CCC)[NH2+]C[C@H](C)C[NH2+]C ZINC000414832719 386721900 /nfs/dbraw/zinc/72/19/00/386721900.db2.gz FQJDYWVMDBYYCP-LLVKDONJSA-N 2 0 200.370 2.400 20 0 BEADRP CC[C@H](Cc1ccccc1)[NH2+]C[C@H]1CCC[NH2+]1 ZINC000414841889 386747816 /nfs/dbraw/zinc/74/78/16/386747816.db2.gz IFSIESOFPUGREP-HUUCEWRRSA-N 2 0 232.371 2.349 20 0 BEADRP c1ccc([C@@H]2C[C@H]2C[NH2+]CC[C@H]2CC[NH2+]C2)cc1 ZINC000414841643 386749142 /nfs/dbraw/zinc/74/91/42/386749142.db2.gz YKVYHUITHPCKKM-KBMXLJTQSA-N 2 0 244.382 2.379 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1cocn1 ZINC000192279440 386750220 /nfs/dbraw/zinc/75/02/20/386750220.db2.gz PHNMGISVNPLUGT-LBPRGKRZSA-N 2 0 239.363 2.275 20 0 BEADRP CCC(CC)C[NH2+][C@H](C)[C@@H]1CCC[NH2+]C1 ZINC000414842549 386763838 /nfs/dbraw/zinc/76/38/38/386763838.db2.gz BKHOABKXGVYNQH-DGCLKSJQSA-N 2 0 212.381 2.400 20 0 BEADRP CSC1(C[NH2+][C@@H](C)C(C)C)CC[NH+](C)CC1 ZINC000336664457 386765745 /nfs/dbraw/zinc/76/57/45/386765745.db2.gz DWAVJQLAAPYDPB-LBPRGKRZSA-N 2 0 244.448 2.448 20 0 BEADRP CC1(C)CCC[C@@H]1[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000414839374 386743675 /nfs/dbraw/zinc/74/36/75/386743675.db2.gz WGDGBJUUYAKZJJ-NEPJUHHUSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]([NH2+]CC1(C2CC2)CC1)[C@@H]1CCCC[NH2+]1 ZINC000395242257 386789755 /nfs/dbraw/zinc/78/97/55/386789755.db2.gz YZHOSIWCXBQMMU-YPMHNXCESA-N 2 0 222.376 2.297 20 0 BEADRP [NH3+]CCC[N@@H+](Cc1ccno1)CC1CCCC1 ZINC000647965994 386794921 /nfs/dbraw/zinc/79/49/21/386794921.db2.gz BRAXIPXXFVKPHR-UHFFFAOYSA-N 2 0 237.347 2.016 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CC[C@@H](C)C[C@@H]1C ZINC000414844870 386772079 /nfs/dbraw/zinc/77/20/79/386772079.db2.gz RQNBWCGJMHTKAA-MROQNXINSA-N 2 0 212.381 2.256 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H](C)Cc1cccs1 ZINC000336667692 386786789 /nfs/dbraw/zinc/78/67/89/386786789.db2.gz DVLVZVFIKPUURO-GHMZBOCLSA-N 2 0 226.389 2.396 20 0 BEADRP C[C@H]1CCC[C@H](C[N@H+](C)C2CC([NH3+])C2)C1 ZINC000394999403 386797515 /nfs/dbraw/zinc/79/75/15/386797515.db2.gz FPRYAGIQCFMSNG-ZSVAQUKISA-N 2 0 210.365 2.234 20 0 BEADRP CC[C@H](C[NH2+][C@@H](C)C[C@H]1CCCCC[NH2+]1)OC ZINC000336669537 386801385 /nfs/dbraw/zinc/80/13/85/386801385.db2.gz AMPBCPHWPHYODT-BFHYXJOUSA-N 2 0 242.407 2.312 20 0 BEADRP Cc1ccc(C[N@@H+](C)C2CC([NH3+])C2)cc1C ZINC000395006865 386803414 /nfs/dbraw/zinc/80/34/14/386803414.db2.gz JWFXOYVQUIVGNR-UHFFFAOYSA-N 2 0 218.344 2.225 20 0 BEADRP CCOc1cccc(C[NH2+][C@H](C)CCC[NH3+])c1 ZINC000336672646 386827422 /nfs/dbraw/zinc/82/74/22/386827422.db2.gz BIFJIAYSZZZSJC-GFCCVEGCSA-N 2 0 236.359 2.302 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+]C[C@H](C)C[NH+](C)C ZINC000293364107 386834419 /nfs/dbraw/zinc/83/44/19/386834419.db2.gz HOELPCQAKDREFK-QWHCGFSZSA-N 2 0 238.375 2.388 20 0 BEADRP C[C@H](CCCCO)[NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000398538510 386837747 /nfs/dbraw/zinc/83/77/47/386837747.db2.gz UBZKTNSUIGXBNT-DFBGVHRSSA-N 2 0 248.370 2.272 20 0 BEADRP CO[C@H](C[NH2+]CCCc1cnccc1C)C1CC1 ZINC000293567523 386838510 /nfs/dbraw/zinc/83/85/10/386838510.db2.gz GRUVNMYYIKRIRZ-OAHLLOKOSA-N 2 0 248.370 2.337 20 0 BEADRP CCCC[N@H+](C)C[C@H](C)Nc1cc[nH+]c(C)c1 ZINC000341117305 386839176 /nfs/dbraw/zinc/83/91/76/386839176.db2.gz JTRJVKKXJBGBIW-ZDUSSCGKSA-N 2 0 235.375 2.344 20 0 BEADRP C[C@@H]([NH3+])[C@H]1CCCC[N@@H+]1CCCCCF ZINC000336674028 386839487 /nfs/dbraw/zinc/83/94/87/386839487.db2.gz GYPLAGBCPJIJTE-VXGBXAGGSA-N 2 0 216.344 2.328 20 0 BEADRP CS[C@@H]1CC[C@@H]1[NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000425341735 386844404 /nfs/dbraw/zinc/84/44/04/386844404.db2.gz GBNSOEVIKUBAQH-FVCCEPFGSA-N 2 0 242.432 2.343 20 0 BEADRP CS[C@@H]1CC[C@@H]1[NH2+][C@H]1CCC[C@H]([NH+](C)C)C1 ZINC000425341738 386845723 /nfs/dbraw/zinc/84/57/23/386845723.db2.gz GBNSOEVIKUBAQH-ZDEQEGDKSA-N 2 0 242.432 2.343 20 0 BEADRP CCc1cc(N2CC[C@@H]3CC[N@H+](C)C[C@H]32)cc[nH+]1 ZINC000334790254 386854467 /nfs/dbraw/zinc/85/44/67/386854467.db2.gz MJNXZWLNSIKTCV-SWLSCSKDSA-N 2 0 245.370 2.174 20 0 BEADRP C[C@@H]1C[C@@H](C[N@@H+]2CCCC3(CC3)C2)CC[NH2+]1 ZINC000334833060 386870768 /nfs/dbraw/zinc/87/07/68/386870768.db2.gz MLXQMHFWYILIHR-OLZOCXBDSA-N 2 0 222.376 2.251 20 0 BEADRP Cc1cc(C)c2c(c1)C[N@@H+](CCC[NH3+])CC2 ZINC000334833892 386872659 /nfs/dbraw/zinc/87/26/59/386872659.db2.gz VFRDEMVUOYILQN-UHFFFAOYSA-N 2 0 218.344 2.010 20 0 BEADRP Cc1cc(NCC(C)(C)C[NH+]2CCCC2)cc[nH+]1 ZINC000357963106 386873489 /nfs/dbraw/zinc/87/34/89/386873489.db2.gz PLOLFCAOZAPVES-UHFFFAOYSA-N 2 0 247.386 2.346 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CC[NH2+][C@@H](C)C2)s1 ZINC000334863340 386917046 /nfs/dbraw/zinc/91/70/46/386917046.db2.gz NUQWBBMKPNWXQA-GXSJLCMTSA-N 2 0 224.373 2.287 20 0 BEADRP C[C@@H]1CCC[C@H]1[NH2+]CC1(C)CC[NH2+]CC1 ZINC000334863183 386918204 /nfs/dbraw/zinc/91/82/04/386918204.db2.gz MNADEMAWNYTTLA-VXGBXAGGSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCC(C)(C)C2)CC[NH2+]1 ZINC000414941964 386898572 /nfs/dbraw/zinc/89/85/72/386898572.db2.gz DCTDMQHBUYGENN-GRYCIOLGSA-N 2 0 210.365 2.295 20 0 BEADRP Cc1cc(C[NH2+][C@@H]2CC[NH2+]C[C@@H]2C)ccc1F ZINC000334852832 386902218 /nfs/dbraw/zinc/90/22/18/386902218.db2.gz ATJRQRFDJNQIMX-SMDDNHRTSA-N 2 0 236.334 2.222 20 0 BEADRP Cc1cc(C[NH2+][C@@H]2CC[NH2+]C[C@H]2C)ccc1F ZINC000334852826 386902803 /nfs/dbraw/zinc/90/28/03/386902803.db2.gz ATJRQRFDJNQIMX-BXUZGUMPSA-N 2 0 236.334 2.222 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CC[NH2+]C[C@H]2C)cc1C ZINC000334857331 386908435 /nfs/dbraw/zinc/90/84/35/386908435.db2.gz NEPOYLPQYAEHLU-HIFRSBDPSA-N 2 0 232.371 2.391 20 0 BEADRP Cc1cccc(C[NH2+][C@H]2CC[NH2+]C[C@H]2C)c1C ZINC000334857187 386909251 /nfs/dbraw/zinc/90/92/51/386909251.db2.gz LSGQOHCCGOXRKC-DOMZBBRYSA-N 2 0 232.371 2.391 20 0 BEADRP Cc1cc(C[NH2+][C@@H]2CC[NH2+]C[C@@H]2C)c(C)s1 ZINC000334856179 386909378 /nfs/dbraw/zinc/90/93/78/386909378.db2.gz GVHYMJHAPQSVPL-TVQRCGJNSA-N 2 0 238.400 2.453 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CC[NH2+]C[C@H]2C)cc1F ZINC000334858392 386910404 /nfs/dbraw/zinc/91/04/04/386910404.db2.gz SHNZKRHZWWMLEX-RISCZKNCSA-N 2 0 236.334 2.222 20 0 BEADRP C[C@H]1Cc2ccccc2[C@@H]1[NH2+]C1CC[NH2+]CC1 ZINC000334866412 386923756 /nfs/dbraw/zinc/92/37/56/386923756.db2.gz QDNRLGBWNBHYDY-XHDPSFHLSA-N 2 0 230.355 2.262 20 0 BEADRP Cc1ccccc1C[NH2+][C@H]1CC[NH2+][C@H](C)C1 ZINC000334866456 386923902 /nfs/dbraw/zinc/92/39/02/386923902.db2.gz WNJMFFPKSNPTAV-OCCSQVGLSA-N 2 0 218.344 2.225 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+][C@@H]2CCCC[C@H]2O)c2ccccc21 ZINC000331932938 386928937 /nfs/dbraw/zinc/92/89/37/386928937.db2.gz IOQNHHSXIVDSAY-KBUPBQIOSA-N 2 0 246.354 2.024 20 0 BEADRP CC[C@H](Cc1ccccc1)[NH2+]CCn1ccnc1 ZINC000116386702 386943776 /nfs/dbraw/zinc/94/37/76/386943776.db2.gz AIDCLTXQCWRLGK-OAHLLOKOSA-N 2 0 243.354 2.494 20 0 BEADRP C[C@H]1CC[C@@]2(CC[N@H+](CCn3ccnc3)C2)C1 ZINC000334890105 386962381 /nfs/dbraw/zinc/96/23/81/386962381.db2.gz MSJUVDAKKWLQKF-UONOGXRCSA-N 2 0 233.359 2.395 20 0 BEADRP CS[C@H]1CC[C@H]1[NH2+]CCC[N@H+](C)C(C)C ZINC000425359395 386977082 /nfs/dbraw/zinc/97/70/82/386977082.db2.gz PXXPEUNPIYTMNL-NEPJUHHUSA-N 2 0 230.421 2.200 20 0 BEADRP C[C@H](NCCc1cccs1)[C@H]1CCCC[NH2+]1 ZINC000395193843 386978908 /nfs/dbraw/zinc/97/89/08/386978908.db2.gz JMOHMQIHMCLNAR-WCQYABFASA-N 2 0 238.400 2.411 20 0 BEADRP CSc1ccc(CN2C[C@H]3C[NH2+]C[C@H]3C2)cc1 ZINC000107573397 387033256 /nfs/dbraw/zinc/03/32/56/387033256.db2.gz JTPLVJAWCJTQNP-BETUJISGSA-N 2 0 248.395 2.060 20 0 BEADRP Cc1c[nH+]ccc1N[C@H](C)[C@@H]1CCC[NH2+]C1 ZINC000070047574 387043052 /nfs/dbraw/zinc/04/30/52/387043052.db2.gz GCJQXGUWTITQJW-VXGBXAGGSA-N 2 0 219.332 2.190 20 0 BEADRP Cc1c[nH+]ccc1N[C@@H](C)[C@@H]1CCC[NH2+]C1 ZINC000070047572 387043426 /nfs/dbraw/zinc/04/34/26/387043426.db2.gz GCJQXGUWTITQJW-NWDGAFQWSA-N 2 0 219.332 2.190 20 0 BEADRP Cc1c[nH+]ccc1NCC[C@@H]1CCC[NH2+]C1 ZINC000070047648 387043876 /nfs/dbraw/zinc/04/38/76/387043876.db2.gz UVJBITDMWNLPIM-LBPRGKRZSA-N 2 0 219.332 2.192 20 0 BEADRP [NH3+]CC[C@@H]1CCC[N@H+](Cc2cccc(F)c2)C1 ZINC000070074206 387044343 /nfs/dbraw/zinc/04/43/43/387044343.db2.gz ANRRTNRCUIFBLO-LBPRGKRZSA-N 2 0 236.334 2.387 20 0 BEADRP CCOc1cccc(C[N@@H+]2CC[C@@H]([C@@H](C)[NH3+])C2)c1 ZINC000126796063 387048874 /nfs/dbraw/zinc/04/88/74/387048874.db2.gz XULNXZAYXDGLLO-TZMCWYRMSA-N 2 0 248.370 2.254 20 0 BEADRP CCOc1ccc(CN2CC[C@@H](C[NH2+]C)C2)cc1 ZINC000109347989 387054425 /nfs/dbraw/zinc/05/44/25/387054425.db2.gz HCMDVEMZFNJBRA-AWEZNQCLSA-N 2 0 248.370 2.127 20 0 BEADRP CCc1ccccc1C[N@@H+]1CC[C@H]([C@@H](C)[NH3+])C1 ZINC000126875852 387055871 /nfs/dbraw/zinc/05/58/71/387055871.db2.gz BPGOMUXXMHZNTA-OCCSQVGLSA-N 2 0 232.371 2.418 20 0 BEADRP CC[NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185709270 387058857 /nfs/dbraw/zinc/05/88/57/387058857.db2.gz AGFMLAUXFKWXCB-RYUDHWBXSA-N 2 0 210.365 2.249 20 0 BEADRP Cc1ccc(C[N@H+]2C[C@@H](C[NH3+])C[C@H]2C)cc1F ZINC000228067055 387063755 /nfs/dbraw/zinc/06/37/55/387063755.db2.gz AANOTBDSQYHWSN-DGCLKSJQSA-N 2 0 236.334 2.303 20 0 BEADRP c1ccc2c(NC[C@@H]3CCC[NH2+]3)cc[nH+]c2c1 ZINC000053255485 387022840 /nfs/dbraw/zinc/02/28/40/387022840.db2.gz GLRRFNVWIBOGNG-NSHDSACASA-N 2 0 227.311 2.399 20 0 BEADRP Cc1ccccc1C[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000334882568 387025963 /nfs/dbraw/zinc/02/59/63/387025963.db2.gz PJQRBUJGBYLFJS-YIONKMFJSA-N 2 0 230.355 2.368 20 0 BEADRP CCCC[C@H](C)[C@@H](C)[NH2+]C[C@@H](C)C[NH3+] ZINC000423299831 387130213 /nfs/dbraw/zinc/13/02/13/387130213.db2.gz CEAXQGRRBNURJR-SDDRHHMPSA-N 2 0 200.370 2.386 20 0 BEADRP CC[C@H]1CCC[N@H+](C[C@]2(C)CC[NH2+]C2)CC1 ZINC000070613873 387070572 /nfs/dbraw/zinc/07/05/72/387070572.db2.gz VCLMMGRARILWOS-UONOGXRCSA-N 2 0 224.392 2.498 20 0 BEADRP CC(C)[C@H]([NH2+]C[C@@H](C)C[NH3+])c1ccc(F)cn1 ZINC000423298505 387130309 /nfs/dbraw/zinc/13/03/09/387130309.db2.gz AIDAJWIXMHIIOQ-GWCFXTLKSA-N 2 0 239.338 2.102 20 0 BEADRP C[C@H]([NH3+])C1CC[NH+](Cc2ccccc2F)CC1 ZINC000111611453 387084762 /nfs/dbraw/zinc/08/47/62/387084762.db2.gz UHIYNIMWYVVVTB-NSHDSACASA-N 2 0 236.334 2.385 20 0 BEADRP Cc1ccc(C[NH+]2CCC([C@@H](C)[NH3+])CC2)c(C)n1 ZINC000334998249 387089584 /nfs/dbraw/zinc/08/95/84/387089584.db2.gz MXJULEFADXZNGG-GFCCVEGCSA-N 2 0 247.386 2.258 20 0 BEADRP C[C@@H]([NH3+])[C@H]1CCN(c2cc[nH+]c3ccccc32)C1 ZINC000162207385 387090804 /nfs/dbraw/zinc/09/08/04/387090804.db2.gz HHVHTRMAZJWUAE-NEPJUHHUSA-N 2 0 241.338 2.408 20 0 BEADRP CCc1ccc(C[N@@H+]2CC[C@H](C[NH2+]C)C2)cc1 ZINC000071142125 387095101 /nfs/dbraw/zinc/09/51/01/387095101.db2.gz FHWKHJVKNKIZQE-OAHLLOKOSA-N 2 0 232.371 2.290 20 0 BEADRP C[C@@H]([NH2+]C1CCC2(CC2)CC1)[C@H]1CCC[NH2+]1 ZINC000335010069 387105105 /nfs/dbraw/zinc/10/51/05/387105105.db2.gz MSPACGURZKSVRC-DGCLKSJQSA-N 2 0 222.376 2.439 20 0 BEADRP Fc1ccc([C@@H]2CCC[C@@H]2[NH2+]CC2C[NH2+]C2)cc1 ZINC000423300742 387131617 /nfs/dbraw/zinc/13/16/17/387131617.db2.gz FGMLCSBYASDAIJ-GJZGRUSLSA-N 2 0 248.345 2.271 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]1[NH2+]C1CCC2(CC2)CC1 ZINC000335011982 387107600 /nfs/dbraw/zinc/10/76/00/387107600.db2.gz WPKUSXZDRQDFQS-RYUDHWBXSA-N 2 0 208.349 2.179 20 0 BEADRP FC1(F)CCC([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)CC1 ZINC000335025383 387116185 /nfs/dbraw/zinc/11/61/85/387116185.db2.gz JVMADMLSKSESQB-FOSCPWQOSA-N 2 0 244.329 2.437 20 0 BEADRP c1ccc2c(c1)CCC[C@@H]2C[NH2+]C1CC[NH2+]CC1 ZINC000335026351 387118105 /nfs/dbraw/zinc/11/81/05/387118105.db2.gz ZGYUEFIOKSJOFP-CQSZACIVSA-N 2 0 244.382 2.448 20 0 BEADRP C[N@H+](Cc1ccc(F)cc1)[C@H]1CCC[NH2+]CC1 ZINC000113712689 387119785 /nfs/dbraw/zinc/11/97/85/387119785.db2.gz XPHPALXWUBCYHP-AWEZNQCLSA-N 2 0 236.334 2.400 20 0 BEADRP CCOc1ccc(C[N@@H+]2C[C@@H](C[NH3+])C[C@H]2C)cc1 ZINC000250639621 387120787 /nfs/dbraw/zinc/12/07/87/387120787.db2.gz WGAVVGBFHSRTLX-TZMCWYRMSA-N 2 0 248.370 2.254 20 0 BEADRP CC1(C[NH2+][C@@H]2CCCCC[C@@H]2[NH3+])CCC1 ZINC000335031794 387127735 /nfs/dbraw/zinc/12/77/35/387127735.db2.gz IVCWHDVICFPXCC-NWDGAFQWSA-N 2 0 210.365 2.426 20 0 BEADRP c1ccc(C[C@@H]2CCC[C@@H]2[NH2+]CC2C[NH2+]C2)cc1 ZINC000423301536 387132469 /nfs/dbraw/zinc/13/24/69/387132469.db2.gz HKHRHVOOWUBGJH-HOTGVXAUSA-N 2 0 244.382 2.207 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H]1c2cc(F)ccc2C[C@H]1C ZINC000423298620 387129162 /nfs/dbraw/zinc/12/91/62/387129162.db2.gz OUZDOYHPIWWCAR-RULNRJAQSA-N 2 0 236.334 2.243 20 0 BEADRP COc1ccc2c(c1)[C@H]([NH2+]C[C@@H](C)C[NH3+])CCC2 ZINC000423299664 387129192 /nfs/dbraw/zinc/12/91/92/387129192.db2.gz QJJIIBHNFMCLKT-XHDPSFHLSA-N 2 0 248.370 2.257 20 0 BEADRP COc1cc([C@@H](C)[NH2+]C[C@H](C)C[NH3+])ccc1F ZINC000423299530 387129500 /nfs/dbraw/zinc/12/95/00/387129500.db2.gz BSZNIXNVUFCDDS-NXEZZACHSA-N 2 0 240.322 2.080 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H]1CCc2c1c(F)ccc2F ZINC000423298555 387129869 /nfs/dbraw/zinc/12/98/69/387129869.db2.gz ONTJCPJZKKFEJJ-PELKAZGASA-N 2 0 240.297 2.137 20 0 BEADRP COc1ccc([C@H](C)[NH2+]C[C@H](C)C[NH3+])c(C)c1 ZINC000423298710 387129910 /nfs/dbraw/zinc/12/99/10/387129910.db2.gz ATSHHWMOLMLSOZ-PWSUYJOCSA-N 2 0 236.359 2.249 20 0 BEADRP CC(C)[C@@H](CCc1ccccc1)[NH2+]CC1C[NH2+]C1 ZINC000423299751 387130114 /nfs/dbraw/zinc/13/01/14/387130114.db2.gz CFNATHZYHUJCQO-MRXNPFEDSA-N 2 0 246.398 2.453 20 0 BEADRP CC(C)CC(CC(C)C)[NH2+]CC1C[NH2+]C1 ZINC000423306184 387142360 /nfs/dbraw/zinc/14/23/60/387142360.db2.gz SIVVHLHDXDJJGN-UHFFFAOYSA-N 2 0 212.381 2.256 20 0 BEADRP C[C@H](C[C@H]1CCCCC[NH2+]1)[NH2+]CCCCCO ZINC000229110397 387143824 /nfs/dbraw/zinc/14/38/24/387143824.db2.gz ZUOSHXWHIDEXOJ-ZIAGYGMSSA-N 2 0 242.407 2.049 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@@H]1CCCc2cc(F)ccc21 ZINC000423308123 387143816 /nfs/dbraw/zinc/14/38/16/387143816.db2.gz NXLPTCXTWSSUDX-IINYFYTJSA-N 2 0 236.334 2.388 20 0 BEADRP C[C@H](F)CC[N@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000353152869 387144709 /nfs/dbraw/zinc/14/47/09/387144709.db2.gz JIGMYRSTGGQOEQ-ACJTYDJDSA-N 2 0 228.355 2.292 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]C[C@H]1Cc2ccccc2O1 ZINC000336792697 387146895 /nfs/dbraw/zinc/14/68/95/387146895.db2.gz TTYBROPMVHMJAS-GXTWGEPZSA-N 2 0 248.370 2.097 20 0 BEADRP [NH3+][C@@H](C[NH2+][C@H]1CCCC12CCC2)C1CC1 ZINC000423313892 387152289 /nfs/dbraw/zinc/15/22/89/387152289.db2.gz GGVGFOWCXAXBKZ-RYUDHWBXSA-N 2 0 208.349 2.036 20 0 BEADRP C[C@@H]([NH2+]C[C@@H](C)C[NH3+])[C@@H]1C[C@H]1c1ccccc1 ZINC000423313957 387153253 /nfs/dbraw/zinc/15/32/53/387153253.db2.gz XMGKBPHKAXJDBS-NEBZKDRISA-N 2 0 232.371 2.363 20 0 BEADRP [NH3+]CCCC[NH2+][C@H]1CCCNc2ccccc21 ZINC000423317203 387156517 /nfs/dbraw/zinc/15/65/17/387156517.db2.gz CNHHCCGNYOSTEU-AWEZNQCLSA-N 2 0 233.359 2.262 20 0 BEADRP [NH3+][C@@H](C[NH2+][C@@H](c1ccccc1)C1CC1)C1CC1 ZINC000423315573 387156592 /nfs/dbraw/zinc/15/65/92/387156592.db2.gz IZROADLRKUHREH-GJZGRUSLSA-N 2 0 230.355 2.465 20 0 BEADRP C[C@H](CCCc1cccnc1)[NH2+]C[C@@H]([NH3+])C1CC1 ZINC000423320240 387162440 /nfs/dbraw/zinc/16/24/40/387162440.db2.gz MFTXSOQQAXFJNA-IUODEOHRSA-N 2 0 247.386 2.120 20 0 BEADRP [NH3+][C@@H](C[NH2+][C@H](C1CC1)C1CCCC1)C1CC1 ZINC000423320659 387162878 /nfs/dbraw/zinc/16/28/78/387162878.db2.gz MJOROROILCQEGO-KBPBESRZSA-N 2 0 222.376 2.282 20 0 BEADRP CCC[C@@H]([NH2+]C[C@@H]([NH3+])C1CC1)C1CCC1 ZINC000423324394 387166914 /nfs/dbraw/zinc/16/69/14/387166914.db2.gz PGXIMZCHTMFQBY-CHWSQXEVSA-N 2 0 210.365 2.282 20 0 BEADRP CCC[C@H]([NH2+]C[C@H]([NH3+])C1CC1)C1CCC1 ZINC000423324399 387168305 /nfs/dbraw/zinc/16/83/05/387168305.db2.gz PGXIMZCHTMFQBY-STQMWFEESA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+]CCCC[NH2+][C@H]1CCCc2c(O)cccc21 ZINC000423328091 387170314 /nfs/dbraw/zinc/17/03/14/387170314.db2.gz NTGLASDEALMKCZ-ZDUSSCGKSA-N 2 0 234.343 2.098 20 0 BEADRP CCC(CC)[N@H+](CCOC)C[C@@]1(C)CC[NH2+]C1 ZINC000062911980 387172820 /nfs/dbraw/zinc/17/28/20/387172820.db2.gz BHVVYSQNJNDHRA-AWEZNQCLSA-N 2 0 242.407 2.123 20 0 BEADRP Cc1c[nH+]ccc1NC[C@H]1[N@H+](C)CCCC1(C)C ZINC000359835368 387173031 /nfs/dbraw/zinc/17/30/31/387173031.db2.gz JKRYCIIZJIHIFA-CQSZACIVSA-N 2 0 247.386 2.344 20 0 BEADRP CC[C@H]([NH2+]C[C@H]([NH3+])C1CC1)c1ccccc1 ZINC000423329454 387173643 /nfs/dbraw/zinc/17/36/43/387173643.db2.gz SVBLGIZMMOAARL-KBPBESRZSA-N 2 0 218.344 2.465 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000423330711 387175582 /nfs/dbraw/zinc/17/55/82/387175582.db2.gz GAWBWIARFOCWBV-TZMCWYRMSA-N 2 0 236.359 2.190 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@H]([NH2+]C[C@H]([NH3+])C2CC2)C1 ZINC000423330373 387176267 /nfs/dbraw/zinc/17/62/67/387176267.db2.gz UFPMBKWANHZIFA-RSLMWUCJSA-N 2 0 210.365 2.138 20 0 BEADRP CSCC1CCC([NH2+]C[C@@H]([NH3+])C2CC2)CC1 ZINC000423332445 387178453 /nfs/dbraw/zinc/17/84/53/387178453.db2.gz VEKANFGAYYQVJN-KGPNIALWSA-N 2 0 242.432 2.235 20 0 BEADRP [NH3+]CCCC[NH2+][C@@H]1CCC[C@@H]1CCCF ZINC000423332286 387178653 /nfs/dbraw/zinc/17/86/53/387178653.db2.gz QRXQXGAQRIHIDS-VXGBXAGGSA-N 2 0 216.344 2.233 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+]CC1(C)CC[NH2+]CC1 ZINC000423332989 387179006 /nfs/dbraw/zinc/17/90/06/387179006.db2.gz PPDCIGLCKQHHPU-VXGBXAGGSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]([NH2+]CC1(C)CC[NH2+]CC1)c1cncs1 ZINC000423344829 387194206 /nfs/dbraw/zinc/19/42/06/387194206.db2.gz YGYMDVFQESTRAK-SNVBAGLBSA-N 2 0 239.388 2.183 20 0 BEADRP C1=C(C[NH2+][C@@H]2CCC[C@H](C3CC3)C2)CC[NH2+]C1 ZINC000423337198 387185229 /nfs/dbraw/zinc/18/52/29/387185229.db2.gz HLMYUWHYJDRWMB-LSDHHAIUSA-N 2 0 234.387 2.465 20 0 BEADRP CC(C)[C@@H]1CCC[C@@H]1[NH2+]CC1=CC[NH2+]CC1 ZINC000423337974 387185407 /nfs/dbraw/zinc/18/54/07/387185407.db2.gz HWMLHEZSSDAHQD-KBPBESRZSA-N 2 0 222.376 2.320 20 0 BEADRP CC[C@@H]([NH2+]C1CCC([NH3+])CC1)C1CCC1 ZINC000322396647 259706117 /nfs/dbraw/zinc/70/61/17/259706117.db2.gz QKEHUPGWDDZCLL-WXRRBKDZSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@H]([NH2+]CC1(C)CC[NH2+]CC1)C(C)(C)C ZINC000423338740 387188667 /nfs/dbraw/zinc/18/86/67/387188667.db2.gz UWCPXIJZZXSTFO-NSHDSACASA-N 2 0 212.381 2.400 20 0 BEADRP CC[C@H]([NH2+]CC1=CC[NH2+]CC1)c1ccc(F)cn1 ZINC000423341825 387189277 /nfs/dbraw/zinc/18/92/77/387189277.db2.gz KKDSTCYGUKZKNJ-ZDUSSCGKSA-N 2 0 249.333 2.181 20 0 BEADRP CC[C@H]1CCCC[C@H]1[NH2+]CC1([NH3+])CCC1 ZINC000423340510 387191117 /nfs/dbraw/zinc/19/11/17/387191117.db2.gz XGQYTCGTLSNRGD-NWDGAFQWSA-N 2 0 210.365 2.426 20 0 BEADRP c1ccc(C[C@H]2CCC[C@@H]2[NH2+]CC2C[NH2+]C2)cc1 ZINC000423301535 387133456 /nfs/dbraw/zinc/13/34/56/387133456.db2.gz HKHRHVOOWUBGJH-CVEARBPZSA-N 2 0 244.382 2.207 20 0 BEADRP Cc1cc([C@H](C)[NH2+]C[C@H](C)C[NH3+])oc1C ZINC000423302389 387134047 /nfs/dbraw/zinc/13/40/47/387134047.db2.gz HIAIRMNXBXMWHE-SCZZXKLOSA-N 2 0 210.321 2.142 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@H](c1cccnc1)C1CCC1 ZINC000423301790 387135285 /nfs/dbraw/zinc/13/52/85/387135285.db2.gz GNAVGJYSWGBAIO-FZMZJTMJSA-N 2 0 233.359 2.107 20 0 BEADRP Cc1ccc(CN(C)CC[C@H]([NH3+])C(C)C)cn1 ZINC000228859933 387135341 /nfs/dbraw/zinc/13/53/41/387135341.db2.gz NQKDPGXJEONEIG-AWEZNQCLSA-N 2 0 235.375 2.195 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]([NH2+]CC2C[NH2+]C2)C[C@@H]1C ZINC000423302465 387135808 /nfs/dbraw/zinc/13/58/08/387135808.db2.gz JPFFPZAIMOHQJT-YUTCNCBUSA-N 2 0 224.392 2.256 20 0 BEADRP CCC[C@@H]([NH2+]CC1C[NH2+]C1)c1ccccc1 ZINC000423304158 387136676 /nfs/dbraw/zinc/13/66/76/387136676.db2.gz NHPPDTJHIKOTIR-CQSZACIVSA-N 2 0 218.344 2.337 20 0 BEADRP Cc1cccc(C[C@H]([NH2+]CC2C[NH2+]C2)C2CC2)c1 ZINC000423303063 387138153 /nfs/dbraw/zinc/13/81/53/387138153.db2.gz KXIQNGHVFXZKRP-INIZCTEOSA-N 2 0 244.382 2.125 20 0 BEADRP [NH3+][C@@H](C[NH2+][C@@H]1CCCc2ccccc21)C1CC1 ZINC000423325036 387139179 /nfs/dbraw/zinc/13/91/79/387139179.db2.gz PTHKNWUFQSOXAO-LSDHHAIUSA-N 2 0 230.355 2.391 20 0 BEADRP Cc1cc([C@@H](C)[NH2+]CC2C[NH2+]C2)c(C)s1 ZINC000423304495 387139598 /nfs/dbraw/zinc/13/95/98/387139598.db2.gz ODZUKYGXBJOOQP-SECBINFHSA-N 2 0 224.373 2.235 20 0 BEADRP CCC[NH2+]CC[NH2+][C@@H]1CCC[C@H]1CCCF ZINC000423305382 387140283 /nfs/dbraw/zinc/14/02/83/387140283.db2.gz BNFHOWFUXRKNDE-QWHCGFSZSA-N 2 0 230.371 2.494 20 0 BEADRP c1ccc([C@@H]2CC[C@@H]([NH2+]CC3C[NH2+]C3)C2)cc1 ZINC000423304412 387140572 /nfs/dbraw/zinc/14/05/72/387140572.db2.gz NUJYCFYHQDHZIC-HUUCEWRRSA-N 2 0 230.355 2.132 20 0 BEADRP Cc1ccc([C@H](C)[NH2+]CC2=CC[NH2+]CC2)o1 ZINC000423350558 387202195 /nfs/dbraw/zinc/20/21/95/387202195.db2.gz ZRIGZYGGGBKSNN-NSHDSACASA-N 2 0 220.316 2.158 20 0 BEADRP C(C[C@H]1CCC[NH2+]1)[NH2+][C@H](C1CC1)C1CCC1 ZINC000423352523 387202902 /nfs/dbraw/zinc/20/29/02/387202902.db2.gz BJQLDYGWVWSVQP-KGLIPLIRSA-N 2 0 222.376 2.297 20 0 BEADRP CC(C)[C@H](Cc1ccccc1)[NH2+]C[C@H]1CC[NH2+]C1 ZINC000423351689 387202933 /nfs/dbraw/zinc/20/29/33/387202933.db2.gz ZKHWXMDLZVOXQV-HOTGVXAUSA-N 2 0 246.398 2.453 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CCC[NH2+]1)C1CCSCC1 ZINC000423357913 387210237 /nfs/dbraw/zinc/21/02/37/387210237.db2.gz IYNUIBUIYUCLAC-DGCLKSJQSA-N 2 0 242.432 2.250 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCC[NH2+]1)[C@@H]1CC1(C)C ZINC000423362674 387215751 /nfs/dbraw/zinc/21/57/51/387215751.db2.gz NIEUJAMJEGXAAG-TUAOUCFPSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC[NH2+]C[C@H]1C)C1CCSCC1 ZINC000423365094 387216748 /nfs/dbraw/zinc/21/67/48/387216748.db2.gz CVEVEBBQKUUCRF-NQBHXWOUSA-N 2 0 242.432 2.106 20 0 BEADRP COCC1CCC([NH2+][C@@H]2CCC[C@@H]([NH3+])C2)CC1 ZINC000423368810 387220594 /nfs/dbraw/zinc/22/05/94/387220594.db2.gz NPNOGEPQLPFAHN-FKZOYECMSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@H]1CCCc2cc(N)ccc21 ZINC000423371221 387223439 /nfs/dbraw/zinc/22/34/39/387223439.db2.gz UWVVAXFFATWDNJ-NHYWBVRUSA-N 2 0 247.386 2.363 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@@H]1CCCc2cc(N)ccc21 ZINC000423371223 387223801 /nfs/dbraw/zinc/22/38/01/387223801.db2.gz UWVVAXFFATWDNJ-XHDPSFHLSA-N 2 0 247.386 2.363 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H]1CCCc2cc(N)ccc21 ZINC000423371219 387224294 /nfs/dbraw/zinc/22/42/94/387224294.db2.gz UWVVAXFFATWDNJ-ABAIWWIYSA-N 2 0 247.386 2.363 20 0 BEADRP CCC(C)(C)[C@@H](C)[NH2+]CC1CC[NH2+]CC1 ZINC000643497183 387228817 /nfs/dbraw/zinc/22/88/17/387228817.db2.gz LSZTXHAGYQAKGS-LLVKDONJSA-N 2 0 212.381 2.400 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](Cc3cccc(F)c3)C[C@@H]21 ZINC000230048671 387229113 /nfs/dbraw/zinc/22/91/13/387229113.db2.gz WBTDBTBXAMNBMC-VHDGCEQUSA-N 2 0 248.345 2.385 20 0 BEADRP [NH3+]CCCC[NH2+][C@@H]1CCC[C@H](c2cccnc2)C1 ZINC000423326803 387233041 /nfs/dbraw/zinc/23/30/41/387233041.db2.gz MIIFOYCXELMGIH-DZGCQCFKSA-N 2 0 247.386 2.436 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@@H]1CC[C@@H]1C(C)(C)C ZINC000423401435 387236814 /nfs/dbraw/zinc/23/68/14/387236814.db2.gz QWJJZTKNHPDGRI-MROQNXINSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@H](C[C@H]1CCCCC[NH2+]1)[NH2+]CCC[C@H](C)O ZINC000300698544 387238910 /nfs/dbraw/zinc/23/89/10/387238910.db2.gz KIBVOUWEJBCZPR-HZSPNIEDSA-N 2 0 242.407 2.048 20 0 BEADRP C[C@H](O)CCC[NH2+][C@@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000300698545 387239009 /nfs/dbraw/zinc/23/90/09/387239009.db2.gz KIBVOUWEJBCZPR-MELADBBJSA-N 2 0 242.407 2.048 20 0 BEADRP COC[C@H]([NH2+][C@H]1CCC[C@@H]([NH3+])C1)c1ccccc1 ZINC000423406142 387243790 /nfs/dbraw/zinc/24/37/90/387243790.db2.gz YQFCSKDJCYNZFY-ILXRZTDVSA-N 2 0 248.370 2.234 20 0 BEADRP CC[C@@H]([NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21)c1ccc(C)cc1 ZINC000423421535 387249798 /nfs/dbraw/zinc/24/97/98/387249798.db2.gz CKUGNPNFWRHBIH-BARDWOONSA-N 2 0 230.355 2.254 20 0 BEADRP CC(C)[C@H]1CC[C@@H](C)C[C@@H]1[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000423424229 387251197 /nfs/dbraw/zinc/25/11/97/387251197.db2.gz FMXPJADMIIBWNY-JNWWKETESA-N 2 0 236.403 2.255 20 0 BEADRP CC[C@@H]1CC[C@H](C)C[C@@H]1[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000423424935 387251859 /nfs/dbraw/zinc/25/18/59/387251859.db2.gz GCRUOLWBVSFMQV-AJSWTNHPSA-N 2 0 222.376 2.009 20 0 BEADRP CC(C)(C)[C@H]1CC[C@@H]1[NH2+]CC1([NH3+])CCC1 ZINC000423345712 387194656 /nfs/dbraw/zinc/19/46/56/387194656.db2.gz YWLBWLLRRFDAIZ-QWRGUYRKSA-N 2 0 210.365 2.282 20 0 BEADRP CC[C@H]([NH2+]CCCC[NH3+])c1cccc(OC)c1 ZINC000423345641 387194884 /nfs/dbraw/zinc/19/48/84/387194884.db2.gz XZFFYOQCWHNHKM-AWEZNQCLSA-N 2 0 236.359 2.475 20 0 BEADRP C[C@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)[C@@H]1CC1(C)C ZINC000423346759 387196772 /nfs/dbraw/zinc/19/67/72/387196772.db2.gz QCTGHGVOVXIATH-OBJOEFQTSA-N 2 0 224.392 2.400 20 0 BEADRP COc1ccccc1[C@H](C)[NH2+]CC1=CC[NH2+]CC1 ZINC000423349449 387200898 /nfs/dbraw/zinc/20/08/98/387200898.db2.gz WUPREJDPAVJKCP-LBPRGKRZSA-N 2 0 246.354 2.266 20 0 BEADRP C[C@@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)[C@H]1C[C@H]1C ZINC000423348663 387201131 /nfs/dbraw/zinc/20/11/31/387201131.db2.gz UGXARFUCYAZQJI-NDBYEHHHSA-N 2 0 210.365 2.010 20 0 BEADRP Cc1cncc([C@@H](C)[NH2+][C@H](C)CCC[NH3+])c1 ZINC000423466313 387315173 /nfs/dbraw/zinc/31/51/73/387315173.db2.gz XCSBOXWAYOEECJ-VXGBXAGGSA-N 2 0 221.348 2.168 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[NH2+]C[C@@H]1C)[C@H]1C[C@H]1C ZINC000423385678 387269310 /nfs/dbraw/zinc/26/93/10/387269310.db2.gz GWVAJBVJNOEYNW-QNWJLWSRSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CC[C@@H]2C2CCC2)CC[NH2+]1 ZINC000423388097 387272865 /nfs/dbraw/zinc/27/28/65/387272865.db2.gz SYHSYSLOHDTQTQ-ZRJCITRHSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@@H](CCCCO)[NH2+]CC1([NH3+])CCCCCC1 ZINC000643498736 387277459 /nfs/dbraw/zinc/27/74/59/387277459.db2.gz MQLGWYGOMODIQF-ZDUSSCGKSA-N 2 0 242.407 2.179 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@H]1CC[C@H]1C1CCC1 ZINC000423392729 387278935 /nfs/dbraw/zinc/27/89/35/387278935.db2.gz LXEXYUVDIAMNCO-SAXRGWBVSA-N 2 0 222.376 2.153 20 0 BEADRP Cc1ccc([C@@H]([NH2+][C@@H]2[C@H]3C[NH2+]C[C@H]32)C2CC2)cc1 ZINC000423434018 387285717 /nfs/dbraw/zinc/28/57/17/387285717.db2.gz NQIVAAIMORNMNL-QXSJWSMHSA-N 2 0 242.366 2.254 20 0 BEADRP C1[C@@H]([NH2+][C@H]2CCC23CCC3)[C@@H]1C1CC[NH2+]CC1 ZINC000423434321 387285829 /nfs/dbraw/zinc/28/58/29/387285829.db2.gz KMPHSJVWPVEDFA-MJBXVCDLSA-N 2 0 234.387 2.297 20 0 BEADRP CC[C@@H]([NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21)C1CCCCC1 ZINC000423435077 387286331 /nfs/dbraw/zinc/28/63/31/387286331.db2.gz OPNVMVARBNFQEG-RQJABVFESA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)[C@@H]1C[C@H]1C ZINC000423435519 387286461 /nfs/dbraw/zinc/28/64/61/387286461.db2.gz OTSDAEFSAFPAFZ-NBUWXKEQSA-N 2 0 222.376 2.009 20 0 BEADRP C[C@@H]([NH2+]CC1(C)CC[NH+](C)CC1)[C@H]1C[C@H]1C ZINC000321621607 387286761 /nfs/dbraw/zinc/28/67/61/387286761.db2.gz SEEWARAHKMMGKF-UPJWGTAASA-N 2 0 224.392 2.352 20 0 BEADRP COC[C@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)C(C)C ZINC000423434808 387286859 /nfs/dbraw/zinc/28/68/59/387286859.db2.gz YDFNOLOVIUXXTO-IHRRRGAJSA-N 2 0 242.407 2.012 20 0 BEADRP CCO[C@@H]1C[C@H]([NH2+][C@@H](C)[C@H](C)[NH3+])C1(CC)CC ZINC000423439760 387289919 /nfs/dbraw/zinc/28/99/19/387289919.db2.gz IBNYYBBHXIOYHV-ZDEQEGDKSA-N 2 0 242.407 2.296 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)C1(C)CC1 ZINC000423442999 387292164 /nfs/dbraw/zinc/29/21/64/387292164.db2.gz PYXHBYQMJPGIGM-WCFLWFBJSA-N 2 0 222.376 2.153 20 0 BEADRP CC[C@@H]1CC[C@@H](C)C[C@H]1[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000423449293 387297554 /nfs/dbraw/zinc/29/75/54/387297554.db2.gz GCRUOLWBVSFMQV-HUXGKSLCSA-N 2 0 222.376 2.009 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H]1CCC[C@@H]2C[C@@]21C ZINC000423452501 387299211 /nfs/dbraw/zinc/29/92/11/387299211.db2.gz JRQICZWZDCYYGO-LPWJVIDDSA-N 2 0 210.365 2.282 20 0 BEADRP CCCC[C@@H](C)[C@H](C)[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000423454385 387301696 /nfs/dbraw/zinc/30/16/96/387301696.db2.gz LOAZXTDEYORYOM-FHUSYTEZSA-N 2 0 210.365 2.009 20 0 BEADRP Cc1nc(C[NH2+]C2CCC(C[NH3+])CC2)cs1 ZINC000643452664 387302924 /nfs/dbraw/zinc/30/29/24/387302924.db2.gz ZXGAKPMGAFUMED-UHFFFAOYSA-N 2 0 239.388 2.059 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+]C(C1CCC1)C1CCC1 ZINC000423456606 387304227 /nfs/dbraw/zinc/30/42/27/387304227.db2.gz DSLOBFFORXPELM-GFCCVEGCSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]([NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21)[C@@H](C)C1CCCCC1 ZINC000423458311 387305676 /nfs/dbraw/zinc/30/56/76/387305676.db2.gz PZFMGDBCVDOQDK-YXRJLALLSA-N 2 0 236.403 2.399 20 0 BEADRP Cc1ccncc1[C@@H](C)[NH2+][C@@H](C)CCC[NH3+] ZINC000423459193 387306282 /nfs/dbraw/zinc/30/62/82/387306282.db2.gz QXKNVJJLZOHJKX-NWDGAFQWSA-N 2 0 221.348 2.168 20 0 BEADRP CC(C)[C@H]1CCCC[C@@H]1[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000423460590 387309280 /nfs/dbraw/zinc/30/92/80/387309280.db2.gz SVYNLYWINRDJGE-DGTMBMJNSA-N 2 0 222.376 2.009 20 0 BEADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@H]2CCC23CCC3)C1 ZINC000423524077 387356321 /nfs/dbraw/zinc/35/63/21/387356321.db2.gz ZGGSPHWASPPLDX-UTUOFQBUSA-N 2 0 208.349 2.036 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@H]2CC[C@H]2SC)CC1 ZINC000515298897 387358783 /nfs/dbraw/zinc/35/87/83/387358783.db2.gz WKDREZSKGMNBRP-QWHCGFSZSA-N 2 0 242.432 2.202 20 0 BEADRP CCC[C@@H](CC)[NH2+]CCC1=CC[NH2+]CC1 ZINC000423537639 387364602 /nfs/dbraw/zinc/36/46/02/387364602.db2.gz KJTATGSCLCFNEF-CYBMUJFWSA-N 2 0 210.365 2.465 20 0 BEADRP C[C@H](CCC1CC1)[NH2+]CCC1=CC[NH2+]CC1 ZINC000423546969 387369899 /nfs/dbraw/zinc/36/98/99/387369899.db2.gz ZUBZHRZCZVIQKJ-GFCCVEGCSA-N 2 0 222.376 2.465 20 0 BEADRP CC[C@@H]1C[C@@H]([NH2+][C@@H](C)[C@H]2CCCC[NH2+]2)CCO1 ZINC000423545640 387371135 /nfs/dbraw/zinc/37/11/35/387371135.db2.gz JTDVKFWQQZYODZ-IGQOVBAYSA-N 2 0 240.391 2.064 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]C[C@@H]1Cc2ccccc21 ZINC000643453599 387371443 /nfs/dbraw/zinc/37/14/43/387371443.db2.gz KLFCZWAZRPEQKU-IVMMDQJWSA-N 2 0 244.382 2.304 20 0 BEADRP Cc1cc(C[NH2+][C@@H](C)CCCC[NH3+])cc(C)n1 ZINC000423548726 387371396 /nfs/dbraw/zinc/37/13/96/387371396.db2.gz MSTGJAKKLZULNP-NSHDSACASA-N 2 0 235.375 2.306 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)[C@H]1C[C@H]1C ZINC000423550499 387373384 /nfs/dbraw/zinc/37/33/84/387373384.db2.gz NXXXLQWKHOHDDO-WFQJECDVSA-N 2 0 222.376 2.009 20 0 BEADRP CC(C)C1CC([NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)C1 ZINC000423555582 387375129 /nfs/dbraw/zinc/37/51/29/387375129.db2.gz XZQWRJAURBBOHG-NSWUILHUSA-N 2 0 236.403 2.399 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CCC2=CC[NH2+]CC2)C1 ZINC000423561855 387377125 /nfs/dbraw/zinc/37/71/25/387377125.db2.gz QHGGBVBPRJHVMR-YPMHNXCESA-N 2 0 208.349 2.074 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[C@@H]([NH3+])C1)c1cccnc1 ZINC000423474926 387321734 /nfs/dbraw/zinc/32/17/34/387321734.db2.gz PHPMCQNYVSFTOW-SGMGOOAPSA-N 2 0 233.359 2.250 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H](C[NH2+][C@@H]2CCC23CCC3)C1 ZINC000423479253 387326648 /nfs/dbraw/zinc/32/66/48/387326648.db2.gz UVJSAHSYHWNFNZ-JHJVBQTASA-N 2 0 222.376 2.426 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH2+][C@H]2CCC23CCC3)C1 ZINC000390434504 387327246 /nfs/dbraw/zinc/32/72/46/387327246.db2.gz RIBXNODXNWHORH-STQMWFEESA-N 2 0 222.376 2.251 20 0 BEADRP CC[NH+](CC)CCC[N@@H+]1CC[C@H](C2CC2)C1 ZINC000372804137 387328877 /nfs/dbraw/zinc/32/88/77/387328877.db2.gz FCLMTGTURVWWRY-AWEZNQCLSA-N 2 0 224.392 2.450 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000423483053 387329468 /nfs/dbraw/zinc/32/94/68/387329468.db2.gz PSFQPXUMGHZIHS-AGIUHOORSA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@H]([NH2+]CC1=CC[N@H+](C)CC1)[C@H]1C[C@H]1C ZINC000321951513 387329704 /nfs/dbraw/zinc/32/97/04/387329704.db2.gz WXPPKSGZQDMQBF-XBFCOCLRSA-N 2 0 222.376 2.273 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@@H]1CCCC12CCCC2 ZINC000423486012 387331863 /nfs/dbraw/zinc/33/18/63/387331863.db2.gz ZJMZUIVMBBGNRF-VXGBXAGGSA-N 2 0 210.365 2.426 20 0 BEADRP COc1ccc([C@H](C)[NH2+][C@@H]2CC[C@H](C[NH3+])C2)cc1 ZINC000423485684 387332406 /nfs/dbraw/zinc/33/24/06/387332406.db2.gz BCPAZBSMWHBQTO-SGMGOOAPSA-N 2 0 248.370 2.473 20 0 BEADRP C[C@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1cncs1 ZINC000423489039 387333471 /nfs/dbraw/zinc/33/34/71/387333471.db2.gz VTBGBZGUUKUFDM-QWRGUYRKSA-N 2 0 239.388 2.326 20 0 BEADRP C[C@@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1cccnc1 ZINC000423487979 387333879 /nfs/dbraw/zinc/33/38/79/387333879.db2.gz VCRLDKNVMIMQKV-TZMCWYRMSA-N 2 0 233.359 2.264 20 0 BEADRP C[C@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1cccnc1 ZINC000423487976 387334500 /nfs/dbraw/zinc/33/45/00/387334500.db2.gz VCRLDKNVMIMQKV-GXTWGEPZSA-N 2 0 233.359 2.264 20 0 BEADRP C[C@@H](CCC(C)(C)C)[NH2+]C[C@H]1C[NH2+]CCCO1 ZINC000423491932 387335774 /nfs/dbraw/zinc/33/57/74/387335774.db2.gz KUHSENJKEFPVQY-QWHCGFSZSA-N 2 0 242.407 2.169 20 0 BEADRP C[C@@H](CCC(C)(C)C)[NH2+]C[C@@H]1C[NH2+]CCCO1 ZINC000423491933 387335908 /nfs/dbraw/zinc/33/59/08/387335908.db2.gz KUHSENJKEFPVQY-STQMWFEESA-N 2 0 242.407 2.169 20 0 BEADRP Cc1nc([C@H](C)[NH2+][C@H]2CC[C@H](C[NH3+])C2)cs1 ZINC000423493559 387338374 /nfs/dbraw/zinc/33/83/74/387338374.db2.gz BVWYNUIDJNSPIN-LSJOCFKGSA-N 2 0 239.388 2.230 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H](C[NH3+])C1)C1CCCC1 ZINC000423494937 387338915 /nfs/dbraw/zinc/33/89/15/387338915.db2.gz SVGYKFWFZXKZDX-DMDPSCGWSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[C@H]2C2CCC2)C1 ZINC000423495441 387339099 /nfs/dbraw/zinc/33/90/99/387339099.db2.gz FGTCVWDXKNIWMO-VZZFWQQMSA-N 2 0 222.376 2.282 20 0 BEADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[C@@H]2C2CCC2)C1 ZINC000423495442 387339321 /nfs/dbraw/zinc/33/93/21/387339321.db2.gz FGTCVWDXKNIWMO-YXCITZCRSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@@H]1C[C@H]1C[N@@H+]1CC[C@]2(C1)CCC[NH+](C)C2 ZINC000354178725 387341595 /nfs/dbraw/zinc/34/15/95/387341595.db2.gz XQLVYIOZKBFTPA-HZSPNIEDSA-N 2 0 222.376 2.060 20 0 BEADRP Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[NH2+]C2)c(C)n1 ZINC000643500775 387345275 /nfs/dbraw/zinc/34/52/75/387345275.db2.gz FAFGCXKFWQXGFG-GXTWGEPZSA-N 2 0 247.386 2.349 20 0 BEADRP C[C@@H](Cc1ccsc1)NCC[NH2+]C1CC1 ZINC000643506797 387462046 /nfs/dbraw/zinc/46/20/46/387462046.db2.gz IXQKHILPUDEKPH-JTQLQIEISA-N 2 0 224.373 2.021 20 0 BEADRP CC[C@]1(O)CC[N@H+](CCCc2ccc(C)nc2)C1 ZINC000354632592 387406511 /nfs/dbraw/zinc/40/65/11/387406511.db2.gz HHADAWHATYEJCP-HNNXBMFYSA-N 2 0 248.370 2.169 20 0 BEADRP C[C@@H](C[NH2+][C@@H](C)[C@@H]1CCCC[NH2+]1)C1CC1 ZINC000643468284 387418309 /nfs/dbraw/zinc/41/83/09/387418309.db2.gz IBILQXKYVZLGMM-GVXVVHGQSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H](C[NH2+]C1CCC(C[NH3+])CC1)C1CC1 ZINC000643468364 387419063 /nfs/dbraw/zinc/41/90/63/387419063.db2.gz VEKMWWLLLPQPJM-ZBOXLXRLSA-N 2 0 210.365 2.140 20 0 BEADRP CC1(C)C[C@H]([NH2+]CCC[NH+]2CCCCC2)CO1 ZINC000396815087 387498398 /nfs/dbraw/zinc/49/83/98/387498398.db2.gz SFXYRJJWXDOMIL-ZDUSSCGKSA-N 2 0 240.391 2.020 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H]1CCC[C@H]2C[C@H]21 ZINC000304644167 387499113 /nfs/dbraw/zinc/49/91/13/387499113.db2.gz XHFIRKZAOWCESN-BFHYXJOUSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H](Cc1cccs1)[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000643509248 387506818 /nfs/dbraw/zinc/50/68/18/387506818.db2.gz NSOPNFDGPFUCEV-VXGBXAGGSA-N 2 0 238.400 2.268 20 0 BEADRP C[C@@H]1CC[N@H+](CC2(F)CC2)C[C@H]1n1ccnc1 ZINC000527220057 387536877 /nfs/dbraw/zinc/53/68/77/387536877.db2.gz RQXBENSFSZHNFW-VXGBXAGGSA-N 2 0 237.322 2.268 20 0 BEADRP C[N@H+](CCCCCF)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000304406530 387475288 /nfs/dbraw/zinc/47/52/88/387475288.db2.gz OZWASJHMFZZUPT-FUNVUKJBSA-N 2 0 228.355 2.341 20 0 BEADRP CO[C@H](C)[C@@H](C)[NH2+][C@H](CC[NH+](C)C)C(C)(C)C ZINC000361523831 387479028 /nfs/dbraw/zinc/47/90/28/387479028.db2.gz GWDQUHHTTJKQAR-JHJVBQTASA-N 2 0 244.423 2.366 20 0 BEADRP Cc1occc1C[NH2+][C@@H]1CCCC[C@H]1C[NH3+] ZINC000643472176 387484819 /nfs/dbraw/zinc/48/48/19/387484819.db2.gz DQAIPMFLCVLQQC-WCQYABFASA-N 2 0 222.332 2.195 20 0 BEADRP CC[C@H]([NH2+]CCC1CC[NH+](C)CC1)C1CC1 ZINC000122142871 387487414 /nfs/dbraw/zinc/48/74/14/387487414.db2.gz JQMLDBXWZLPTFJ-AWEZNQCLSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)[NH2+]CCC[NH2+][C@H](C)CC1CCOCC1 ZINC000643508382 387487836 /nfs/dbraw/zinc/48/78/36/387487836.db2.gz XSCPYVWNIALDMN-CYBMUJFWSA-N 2 0 242.407 2.169 20 0 BEADRP C[C@@H](C[NH2+]C[C@@H]1CC=CCC1)N(C)C1CC1 ZINC000122195719 387489843 /nfs/dbraw/zinc/48/98/43/387489843.db2.gz QKCLWWLTCVUZEY-QWHCGFSZSA-N 2 0 222.376 2.415 20 0 BEADRP CC(C)C[C@H]1CCC[N@@H+]1CC[C@@H]1CC[NH2+]C1 ZINC000396780030 387493033 /nfs/dbraw/zinc/49/30/33/387493033.db2.gz URZICZSHJUQPIL-UONOGXRCSA-N 2 0 224.392 2.497 20 0 BEADRP CCCC[N@@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000337043372 387586565 /nfs/dbraw/zinc/58/65/65/387586565.db2.gz CVEFKETZJLARFP-CABCVRRESA-N 2 0 232.371 2.461 20 0 BEADRP CC(C)CCOCC[N@H+](C)CC[C@@H]([NH3+])C(C)C ZINC000123714552 387592208 /nfs/dbraw/zinc/59/22/08/387592208.db2.gz PMBRDIZWIGOCPB-CQSZACIVSA-N 2 0 244.423 2.354 20 0 BEADRP CC(C)([NH3+])C[NH2+][C@H]1CCCc2ccccc2C1 ZINC000643513394 387597406 /nfs/dbraw/zinc/59/74/06/387597406.db2.gz NRFHVYPYXNMSOK-AWEZNQCLSA-N 2 0 232.371 2.261 20 0 BEADRP C[C@H](CC[NH3+])[NH2+]Cc1cccc(C2CC2)c1 ZINC000422552351 387598330 /nfs/dbraw/zinc/59/83/30/387598330.db2.gz GXBBAXOKJPFHAJ-LLVKDONJSA-N 2 0 218.344 2.391 20 0 BEADRP CC(C)C[C@H](C)C[NH+]1CCC2(CC[NH2+]2)CC1 ZINC000422560675 387602363 /nfs/dbraw/zinc/60/23/63/387602363.db2.gz HMSVSLLDQCXJGV-ZDUSSCGKSA-N 2 0 224.392 2.497 20 0 BEADRP CCC(CC)C[NH+]1CCC2(CC[NH2+]2)CC1 ZINC000422562194 387602472 /nfs/dbraw/zinc/60/24/72/387602472.db2.gz PIBKAFYMHGLTOW-UHFFFAOYSA-N 2 0 210.365 2.251 20 0 BEADRP CCC(CC)[C@H](O)C[NH2+][C@H]1CCCCC[C@H]1[NH3+] ZINC000422700752 387614975 /nfs/dbraw/zinc/61/49/75/387614975.db2.gz ANCRXIVQAYBNEK-HZSPNIEDSA-N 2 0 242.407 2.033 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]C[C@@H]1C[C@H]1C ZINC000422701918 387618298 /nfs/dbraw/zinc/61/82/98/387618298.db2.gz JKRUDGOAADDBFC-SCVCMEIPSA-N 2 0 233.359 2.155 20 0 BEADRP Cc1ccc(C(C)(C)C[NH2+][C@@H](C)C2C[NH2+]C2)cc1 ZINC000422702880 387619211 /nfs/dbraw/zinc/61/92/11/387619211.db2.gz GGBWOCIQPDGQKZ-ZDUSSCGKSA-N 2 0 246.398 2.470 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]Cc1ccc2ccccc2n1 ZINC000422706663 387621214 /nfs/dbraw/zinc/62/12/14/387621214.db2.gz UULXXNBMRRXLOU-GFCCVEGCSA-N 2 0 243.354 2.452 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@@H](O)C1CCCCC1 ZINC000422708197 387623789 /nfs/dbraw/zinc/62/37/89/387623789.db2.gz XKJXNMREQJBAAE-TZMCWYRMSA-N 2 0 242.407 2.035 20 0 BEADRP Cc1cc(C[NH+]2CCC(C[NH+](C)C)CC2)ccn1 ZINC000527533539 387624411 /nfs/dbraw/zinc/62/44/11/387624411.db2.gz KDETVZIJZRRKNH-UHFFFAOYSA-N 2 0 247.386 2.164 20 0 BEADRP C[C@H](Cc1cccs1)[NH2+]C[C@H]([NH3+])C1CC1 ZINC000643516561 387627982 /nfs/dbraw/zinc/62/79/82/387627982.db2.gz SBOJZXAVVLYRSO-SKDRFNHKSA-N 2 0 224.373 2.006 20 0 BEADRP [NH3+][C@H](C[NH2+][C@@H]1CCCc2ccccc2C1)C1CC1 ZINC000643516688 387631701 /nfs/dbraw/zinc/63/17/01/387631701.db2.gz JWHRNYZQAIAEFY-HZPDHXFCSA-N 2 0 244.382 2.261 20 0 BEADRP CC(C)[C@@H]1CCC[C@@H]([NH2+][C@H](C)C2C[NH2+]C2)C1 ZINC000422722240 387634219 /nfs/dbraw/zinc/63/42/19/387634219.db2.gz XHLVEIOHEXDYKY-YRGRVCCFSA-N 2 0 224.392 2.399 20 0 BEADRP COc1ccc(C[NH2+][C@@H]2CC[NH2+]CC[C@H]2C)cc1 ZINC000422729054 387637648 /nfs/dbraw/zinc/63/76/48/387637648.db2.gz HINJPWAQFDCZGK-IUODEOHRSA-N 2 0 248.370 2.173 20 0 BEADRP C[C@H](CCc1ccccc1)[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000422730875 387637733 /nfs/dbraw/zinc/63/77/33/387637733.db2.gz MPHPTBIKIKUNBP-OLZOCXBDSA-N 2 0 232.371 2.205 20 0 BEADRP c1ccc(CCC[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000422730025 387638791 /nfs/dbraw/zinc/63/87/91/387638791.db2.gz JCASTJYGMBDIFY-XYPWUTKMSA-N 2 0 244.382 2.492 20 0 BEADRP CCCCOCCC[NH2+][C@@H]1CC[NH2+]CC[C@@H]1C ZINC000422729954 387639000 /nfs/dbraw/zinc/63/90/00/387639000.db2.gz LQJZSTSWDZOCRX-UONOGXRCSA-N 2 0 242.407 2.171 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]CCC1CCOCC1 ZINC000422734384 387643960 /nfs/dbraw/zinc/64/39/60/387643960.db2.gz SELVTTAGCNOMDZ-KGLIPLIRSA-N 2 0 240.391 2.053 20 0 BEADRP CCCCOCCC[NH2+][C@@H](CC)[C@@H]1CCC[NH2+]1 ZINC000422738917 387646282 /nfs/dbraw/zinc/64/62/82/387646282.db2.gz ZQFMIRGIGOZGOM-KBPBESRZSA-N 2 0 242.407 2.313 20 0 BEADRP CO[C@H](C[NH2+][C@H]1CCC[C@@H]1C[NH3+])c1ccccc1 ZINC000422738668 387646460 /nfs/dbraw/zinc/64/64/60/387646460.db2.gz JSLIVWWHKWPRQL-QLFBSQMISA-N 2 0 248.370 2.091 20 0 BEADRP CS[C@@H]1CCC[C@H]([NH2+][C@@H](C)C[C@@H](C)[NH3+])C1 ZINC000422754789 387659223 /nfs/dbraw/zinc/65/92/23/387659223.db2.gz GENZUGMIJVDXRP-NOOOWODRSA-N 2 0 230.421 2.376 20 0 BEADRP CCOC[C@@H](C)[NH2+]C[C@@H](C)C[NH+]1CCCCC1 ZINC000125627248 387660181 /nfs/dbraw/zinc/66/01/81/387660181.db2.gz ACSRTCXIIKNBKM-ZIAGYGMSSA-N 2 0 242.407 2.123 20 0 BEADRP CSCCCC[NH2+][C@@H]1CC[NH2+]CC[C@@H]1C ZINC000422758138 387660508 /nfs/dbraw/zinc/66/05/08/387660508.db2.gz NNQYTFCWTWQVHJ-NWDGAFQWSA-N 2 0 230.421 2.107 20 0 BEADRP C[C@@H]([NH2+]C1C[C@H](C)C[C@@H](C)C1)C1C[NH2+]C1 ZINC000422756971 387660563 /nfs/dbraw/zinc/66/05/63/387660563.db2.gz CTASOMUVLPXCHF-GMTAPVOTSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+]CCOc1ccccc1 ZINC000422761187 387663282 /nfs/dbraw/zinc/66/32/82/387663282.db2.gz QWEODVWJDSIJAE-DZGCQCFKSA-N 2 0 248.370 2.043 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@H](CC[NH+](C)C)C(C)(C)C ZINC000422760058 387663391 /nfs/dbraw/zinc/66/33/91/387663391.db2.gz LMISRIDRBMPSST-QWHCGFSZSA-N 3 0 243.439 2.070 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C ZINC000422760059 387663699 /nfs/dbraw/zinc/66/36/99/387663699.db2.gz LMISRIDRBMPSST-STQMWFEESA-N 3 0 243.439 2.070 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CCCNc1ccccc1 ZINC000422761183 387663904 /nfs/dbraw/zinc/66/39/04/387663904.db2.gz QVPLZQUOQUPPKU-CYBMUJFWSA-N 2 0 235.375 2.206 20 0 BEADRP CCCCOCC[NH2+][C@@H]1CCCCC[C@@H]1[NH3+] ZINC000422792811 387695808 /nfs/dbraw/zinc/69/58/08/387695808.db2.gz ZMDNBDBZDNPHAM-QWHCGFSZSA-N 2 0 228.380 2.053 20 0 BEADRP CSCCCC[NH2+]C1CCC(C[NH3+])CC1 ZINC000422765444 387665873 /nfs/dbraw/zinc/66/58/73/387665873.db2.gz VXXNZUQXCDGHJT-UHFFFAOYSA-N 2 0 230.421 2.237 20 0 BEADRP Cc1ccc([C@@H](C)C[NH2+][C@@H](C)C2C[NH2+]C2)cc1 ZINC000422773347 387669576 /nfs/dbraw/zinc/66/95/76/387669576.db2.gz YKPQAGRMKXDCFB-STQMWFEESA-N 2 0 232.371 2.296 20 0 BEADRP C[C@H]([NH2+][C@H]1CCc2nc[nH]c2C1)[C@@H]1C[C@H]1C1CC1 ZINC000527714007 387669935 /nfs/dbraw/zinc/66/99/35/387669935.db2.gz YDJWVYMNYCHPOS-BQUFFADESA-N 2 0 245.370 2.291 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CCC[C@@H](C)C1)C1C[NH2+]C1 ZINC000422772796 387670626 /nfs/dbraw/zinc/67/06/26/387670626.db2.gz ZOGVWVMIDFPBAH-IJLUTSLNSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CCC[C@@H](C)C1)C1C[NH2+]C1 ZINC000422772797 387671530 /nfs/dbraw/zinc/67/15/30/387671530.db2.gz ZOGVWVMIDFPBAH-UTUOFQBUSA-N 2 0 210.365 2.010 20 0 BEADRP COc1cccc(C[NH2+][C@H]2CC[NH2+]CC[C@H]2C)c1 ZINC000422774450 387672756 /nfs/dbraw/zinc/67/27/56/387672756.db2.gz XBHIAIISRPOCHZ-DOMZBBRYSA-N 2 0 248.370 2.173 20 0 BEADRP Cc1cccc([C@@H](C)C[NH2+][C@@H](C)C2C[NH2+]C2)c1 ZINC000422781034 387681512 /nfs/dbraw/zinc/68/15/12/387681512.db2.gz JZXBAHFTAQORDS-STQMWFEESA-N 2 0 232.371 2.296 20 0 BEADRP CO[C@@H]1CCCC[C@@H]1[NH2+][C@H](C)CCCC[NH3+] ZINC000422783443 387684550 /nfs/dbraw/zinc/68/45/50/387684550.db2.gz HLARJZUWOGBQBA-FRRDWIJNSA-N 2 0 228.380 2.051 20 0 BEADRP C[C@H](C[NH2+][C@@H](C)C1C[NH2+]C1)Cc1cccs1 ZINC000422787680 387687858 /nfs/dbraw/zinc/68/78/58/387687858.db2.gz UWXVEIIILVOPBN-QWRGUYRKSA-N 2 0 238.400 2.124 20 0 BEADRP COc1ccc(CCC[NH2+][C@H]2CCC[C@@H]2[NH3+])cc1 ZINC000422744178 387690084 /nfs/dbraw/zinc/69/00/84/387690084.db2.gz VQBMRVHXQNUSKX-GJZGRUSLSA-N 2 0 248.370 2.097 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+]CC2=CC[NH2+]CC2)c(C)n1 ZINC000643520311 387691319 /nfs/dbraw/zinc/69/13/19/387691319.db2.gz KFRAYVRCDBQENX-GFCCVEGCSA-N 2 0 245.370 2.269 20 0 BEADRP CC[C@H]([NH2+][C@H](C)[C@@H]1CC[NH2+]C1)C(C)(C)C ZINC000422865614 387747186 /nfs/dbraw/zinc/74/71/86/387747186.db2.gz YTYKUMRDLFDCSW-UTUOFQBUSA-N 2 0 212.381 2.399 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]C[C@H]1CCCS1 ZINC000422873777 387752799 /nfs/dbraw/zinc/75/27/99/387752799.db2.gz MFCKZYINCKUHQT-UTUOFQBUSA-N 2 0 228.405 2.132 20 0 BEADRP C[C@H]([NH2+]CCC[NH+]1CCCC1)[C@H]1CC12CC2 ZINC000527845023 387753319 /nfs/dbraw/zinc/75/33/19/387753319.db2.gz HPXHMLYYKOYRAV-QWHCGFSZSA-N 2 0 222.376 2.251 20 0 BEADRP CC[C@H]([NH2+][C@@H](C)CCCC[NH3+])C1CCOCC1 ZINC000422804576 387701365 /nfs/dbraw/zinc/70/13/65/387701365.db2.gz FPJDEGFKHLZTEW-JSGCOSHPSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]CCc1ccsc1 ZINC000422802480 387703665 /nfs/dbraw/zinc/70/36/65/387703665.db2.gz DGMNSKFLPDEROK-YPMHNXCESA-N 2 0 238.400 2.268 20 0 BEADRP CCO[C@@H](CC[NH2+][C@@H](C)[C@H]1CCC[NH2+]1)C(C)C ZINC000422806278 387704809 /nfs/dbraw/zinc/70/48/09/387704809.db2.gz HTJWMEJMNJUYRE-MJBXVCDLSA-N 2 0 242.407 2.168 20 0 BEADRP CCO[C@H](CC[NH2+][C@@H](C)[C@H]1CCC[NH2+]1)C(C)C ZINC000422806072 387705134 /nfs/dbraw/zinc/70/51/34/387705134.db2.gz HTJWMEJMNJUYRE-BFHYXJOUSA-N 2 0 242.407 2.168 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]Cc1cc(F)cc(F)c1 ZINC000422807474 387705154 /nfs/dbraw/zinc/70/51/54/387705154.db2.gz PAHQJGGDCRNJCF-DTWKUNHWSA-N 2 0 228.286 2.180 20 0 BEADRP CO[C@H](C[NH2+][C@@H]1CC[NH2+]CC[C@H]1C)C(C)(C)C ZINC000422808614 387707814 /nfs/dbraw/zinc/70/78/14/387707814.db2.gz LGJMLRIAUNQJPB-JHJVBQTASA-N 2 0 242.407 2.025 20 0 BEADRP C[C@H]([NH2+]C1CCCCC1)[C@H]1CCCC[NH2+]1 ZINC000238434026 387708883 /nfs/dbraw/zinc/70/88/83/387708883.db2.gz SDFAWIMHEMUDAO-WCQYABFASA-N 2 0 210.365 2.439 20 0 BEADRP CC(C)CCC[NH2+][C@@H]1CC[NH2+]CC[C@@H]1C ZINC000422812913 387710608 /nfs/dbraw/zinc/71/06/08/387710608.db2.gz YIOYZIYDPVJBBU-QWHCGFSZSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CC1(CCO)CCCC1 ZINC000422815615 387713633 /nfs/dbraw/zinc/71/36/33/387713633.db2.gz YACNYYJFVCSDEX-ZDUSSCGKSA-N 2 0 242.407 2.036 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCC(C)(C)C[C@H]1C)C1C[NH2+]C1 ZINC000422819918 387718174 /nfs/dbraw/zinc/71/81/74/387718174.db2.gz OJULRAXHLHMGNQ-NQBHXWOUSA-N 2 0 224.392 2.399 20 0 BEADRP CC[C@@H]([NH2+][C@H]1CCCSC1)[C@@H]1CCC[NH2+]1 ZINC000422821147 387718600 /nfs/dbraw/zinc/71/86/00/387718600.db2.gz UOBPABRLCFKRIL-TUAOUCFPSA-N 2 0 228.405 2.002 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]C[C@H]2CC[C@@H](C)O2)CC1 ZINC000127735190 387726013 /nfs/dbraw/zinc/72/60/13/387726013.db2.gz XEYDMXWZGFMNJA-TZMCWYRMSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](C)Cc1ccncc1 ZINC000422835138 387729915 /nfs/dbraw/zinc/72/99/15/387729915.db2.gz IJROUFDVHPIASO-STQMWFEESA-N 2 0 235.375 2.120 20 0 BEADRP Cc1cccc(O[C@H](C)C[NH2+][C@H]2CCC[C@H]2[NH3+])c1 ZINC000422790165 387733805 /nfs/dbraw/zinc/73/38/05/387733805.db2.gz PDXRIZOZJGRXPG-YUELXQCFSA-N 2 0 248.370 2.232 20 0 BEADRP Cc1nccn1CC[N@H+]1CCC(F)(F)C[C@H]1C ZINC000528774098 387734186 /nfs/dbraw/zinc/73/41/86/387734186.db2.gz SZDPWWDOKUJXSW-SNVBAGLBSA-N 2 0 243.301 2.311 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)[C@@H]1CC12CC2 ZINC000527862166 387737673 /nfs/dbraw/zinc/73/76/73/387737673.db2.gz NKFANLPBBKSVMO-XQQFMLRXSA-N 2 0 222.376 2.106 20 0 BEADRP C[C@H](C[NH2+][C@@H](C)CCC[NH3+])N(C)c1ccccc1 ZINC000422854838 387737893 /nfs/dbraw/zinc/73/78/93/387737893.db2.gz DEJGPWOTURRERG-UONOGXRCSA-N 2 0 249.402 2.228 20 0 BEADRP CC[C@@H]1CCC[C@H]1[NH2+][C@H](C)[C@H]1CCC[NH2+]1 ZINC000422877794 387756106 /nfs/dbraw/zinc/75/61/06/387756106.db2.gz RSAIEVRAIFJBHI-FDYHWXHSSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H](C[NH2+][C@@H](C)C[C@H](C)[NH3+])N(C)c1ccccc1 ZINC000422856203 387742054 /nfs/dbraw/zinc/74/20/54/387742054.db2.gz FTEYQYVKLZPGSS-MELADBBJSA-N 2 0 249.402 2.227 20 0 BEADRP COCCC1(C[NH2+][C@H](C)CCC[NH3+])CCCC1 ZINC000422891916 387762147 /nfs/dbraw/zinc/76/21/47/387762147.db2.gz WVKSYJCNSBTNER-CYBMUJFWSA-N 2 0 242.407 2.300 20 0 BEADRP CCC1(C[NH2+][C@@H]2CCC[C@H]2[NH3+])CCCC1 ZINC000422891228 387762431 /nfs/dbraw/zinc/76/24/31/387762431.db2.gz UVSJWHLXZBIDDE-VXGBXAGGSA-N 2 0 210.365 2.426 20 0 BEADRP COCCC1(C[NH2+][C@@H]2CCC[C@@H]2[NH3+])CCCC1 ZINC000422892382 387762491 /nfs/dbraw/zinc/76/24/91/387762491.db2.gz YELMHAUQZRADIT-QWHCGFSZSA-N 2 0 240.391 2.053 20 0 BEADRP Cc1cccnc1[C@@H]1CCC[C@@H]([NH2+]C[C@H](C)[NH3+])C1 ZINC000643527099 387763133 /nfs/dbraw/zinc/76/31/33/387763133.db2.gz JWWLTLMQPKXCKG-BFHYXJOUSA-N 2 0 247.386 2.353 20 0 BEADRP COCCC1(C[NH2+][C@@H]2CCC[C@H]2[NH3+])CCCC1 ZINC000422892380 387763936 /nfs/dbraw/zinc/76/39/36/387763936.db2.gz YELMHAUQZRADIT-CHWSQXEVSA-N 2 0 240.391 2.053 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CCOc2ccccc21 ZINC000422889570 387764102 /nfs/dbraw/zinc/76/41/02/387764102.db2.gz PWJVVRKHZBJQGA-BNOWGMLFSA-N 2 0 246.354 2.022 20 0 BEADRP Cc1ccc(C[NH2+][C@@H](C)C[C@@H](C)[NH3+])s1 ZINC000422896091 387766260 /nfs/dbraw/zinc/76/62/60/387766260.db2.gz XJNLBLWWXBGMJV-BDAKNGLRSA-N 2 0 212.362 2.272 20 0 BEADRP Cc1ccc(C[C@@H]([NH2+]C[C@H](C)[NH3+])C(C)C)cc1 ZINC000643528625 387769085 /nfs/dbraw/zinc/76/90/85/387769085.db2.gz MENAHISGNFWWND-DZGCQCFKSA-N 2 0 234.387 2.499 20 0 BEADRP C[C@@H]([NH3+])C[NH2+][C@@H]1CCCCc2ccccc21 ZINC000643528681 387770177 /nfs/dbraw/zinc/77/01/77/387770177.db2.gz MUXAACBHMPTKCU-BXUZGUMPSA-N 2 0 218.344 2.391 20 0 BEADRP Cc1ccc(C[C@H]([NH2+]C[C@@H](C)[NH3+])C(C)C)cc1 ZINC000643528626 387770311 /nfs/dbraw/zinc/77/03/11/387770311.db2.gz MENAHISGNFWWND-HIFRSBDPSA-N 2 0 234.387 2.499 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]CCCc1cccc(F)c1 ZINC000422912258 387770644 /nfs/dbraw/zinc/77/06/44/387770644.db2.gz VRIFESDIXJTHIQ-KGLIPLIRSA-N 2 0 236.334 2.228 20 0 BEADRP C[C@@H]([NH2+][C@@H](Cc1ccccc1)C1CC1)C1C[NH2+]C1 ZINC000422914465 387771874 /nfs/dbraw/zinc/77/18/74/387771874.db2.gz UHVSOIBVGFFPLC-WBMJQRKESA-N 2 0 244.382 2.205 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]1[NH2+]CCCc1cccc(F)c1 ZINC000422912257 387771904 /nfs/dbraw/zinc/77/19/04/387771904.db2.gz VRIFESDIXJTHIQ-KBPBESRZSA-N 2 0 236.334 2.228 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CCc1cccc(F)c1F ZINC000422961017 387812162 /nfs/dbraw/zinc/81/21/62/387812162.db2.gz YDRJDAAVLFPSGC-ZJUUUORDSA-N 2 0 242.313 2.223 20 0 BEADRP CC(C)C1(C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)CC1 ZINC000422917688 387774185 /nfs/dbraw/zinc/77/41/85/387774185.db2.gz FNLIQXFKDUQFNC-FUNVUKJBSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]Cc1cnc2ccccc2c1 ZINC000422915792 387774202 /nfs/dbraw/zinc/77/42/02/387774202.db2.gz ZAAPOTFLOMUFAM-NWDGAFQWSA-N 2 0 243.354 2.450 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]CCC(F)(F)F ZINC000422919583 387775618 /nfs/dbraw/zinc/77/56/18/387775618.db2.gz KCFFSQCVIZGKFF-BDAKNGLRSA-N 2 0 224.270 2.188 20 0 BEADRP COc1ccc([C@H](C)[C@H](C)[NH2+]C[C@@H](C)[NH3+])cc1 ZINC000643529434 387777090 /nfs/dbraw/zinc/77/70/90/387777090.db2.gz ZRUFPEVGTFDJDB-UTUOFQBUSA-N 2 0 236.359 2.124 20 0 BEADRP Cc1cccc(OCC[NH2+][C@H](C)C[C@H](C)[NH3+])c1 ZINC000422927843 387779828 /nfs/dbraw/zinc/77/98/28/387779828.db2.gz HIFDBGHWULVIKX-QWHCGFSZSA-N 2 0 236.359 2.089 20 0 BEADRP COc1ccc(C[NH2+][C@@H](C)CCC[NH3+])c(F)c1 ZINC000422927949 387779882 /nfs/dbraw/zinc/77/98/82/387779882.db2.gz HXULMDIBQWZVHF-JTQLQIEISA-N 2 0 240.322 2.051 20 0 BEADRP C[C@@H]([NH2+]CC1(C)CCCCC1)C1C[NH2+]C1 ZINC000422930618 387780980 /nfs/dbraw/zinc/78/09/80/387780980.db2.gz VGCNEWSUAPVVBG-LLVKDONJSA-N 2 0 210.365 2.154 20 0 BEADRP CC(C)CC1(C[NH2+][C@H]2CCC[C@@H]2[NH3+])CC1 ZINC000422932572 387781451 /nfs/dbraw/zinc/78/14/51/387781451.db2.gz ZNMWBAZHJPLKNE-RYUDHWBXSA-N 2 0 210.365 2.282 20 0 BEADRP CCC(CC)(CC)C[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000422931886 387781675 /nfs/dbraw/zinc/78/16/75/387781675.db2.gz YICZGDMTSZJAGW-NSHDSACASA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H]1CN(C2CC2)C[C@@H]1[NH2+]CC1CC=CC1 ZINC000527942036 387782029 /nfs/dbraw/zinc/78/20/29/387782029.db2.gz APHRRBBWKPBFLN-RISCZKNCSA-N 2 0 220.360 2.025 20 0 BEADRP COc1ccc(C2([NH2+][C@@H](C)C[C@@H](C)[NH3+])CC2)cc1 ZINC000422934475 387782470 /nfs/dbraw/zinc/78/24/70/387782470.db2.gz JMJOYJBSKHUBDC-NEPJUHHUSA-N 2 0 248.370 2.400 20 0 BEADRP Cc1cccc(C)c1CC[NH2+][C@H](C)C1C[NH2+]C1 ZINC000422934953 387782566 /nfs/dbraw/zinc/78/25/66/387782566.db2.gz GVNURYSEVMCWRE-CYBMUJFWSA-N 2 0 232.371 2.043 20 0 BEADRP CCOCCC1(C[NH2+][C@H]2CCC[C@@H]2[NH3+])CCC1 ZINC000422937996 387782947 /nfs/dbraw/zinc/78/29/47/387782947.db2.gz KKVCJMVWKZMXJL-STQMWFEESA-N 2 0 240.391 2.053 20 0 BEADRP CCC1(CC)[C@H]([NH2+][C@@H]2CCC[C@H]2[NH3+])C[C@@H]1OC ZINC000422937734 387783055 /nfs/dbraw/zinc/78/30/55/387783055.db2.gz KCKWSUJGTPKFFN-LPWJVIDDSA-N 2 0 240.391 2.050 20 0 BEADRP COc1ccc(C[NH2+][C@H](C)C[C@H](C)[NH3+])cc1F ZINC000422937249 387783173 /nfs/dbraw/zinc/78/31/73/387783173.db2.gz JCLZLVWXNBNFRK-VHSXEESVSA-N 2 0 240.322 2.050 20 0 BEADRP CC[C@H](C)C[NH2+]CCC[N@@H+]1CCCO[C@@H](C)C1 ZINC000432355719 387784444 /nfs/dbraw/zinc/78/44/44/387784444.db2.gz FRBJMOZQWFEERC-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP CCC1(CC)[C@H]([NH2+][C@@H](C)CCC[NH3+])C[C@@H]1OC ZINC000422944787 387785776 /nfs/dbraw/zinc/78/57/76/387785776.db2.gz STPMQFCPGMSFCQ-XQQFMLRXSA-N 2 0 242.407 2.297 20 0 BEADRP CCC1(CC)[C@H]([NH2+][C@H](C)CCC[NH3+])C[C@@H]1OC ZINC000422944786 387785897 /nfs/dbraw/zinc/78/58/97/387785897.db2.gz STPMQFCPGMSFCQ-UPJWGTAASA-N 2 0 242.407 2.297 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+]C1(c2ccccc2)CC1 ZINC000422944152 387786255 /nfs/dbraw/zinc/78/62/55/387786255.db2.gz ZGXHPISOWZFHHY-AWEZNQCLSA-N 2 0 248.370 2.019 20 0 BEADRP CCOc1ccc(C[NH2+][C@@H](C)C[C@H](C)[NH3+])cc1 ZINC000422901485 387787697 /nfs/dbraw/zinc/78/76/97/387787697.db2.gz LAPXVQVHBZCESG-RYUDHWBXSA-N 2 0 236.359 2.301 20 0 BEADRP CC(C)CC[C@@](C)(O)C[NH2+][C@@H](C)CCCC[NH3+] ZINC000422979264 387788822 /nfs/dbraw/zinc/78/88/22/387788822.db2.gz MJWWXSSAIGUDGJ-UONOGXRCSA-N 2 0 244.423 2.281 20 0 BEADRP C[C@H]([NH2+]CCN1CC[C@@H](C)C1)C1CCCC1 ZINC000309506221 387812841 /nfs/dbraw/zinc/81/28/41/387812841.db2.gz VZBOYDTZHKNVSZ-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H]1CCc2c1cccc2O ZINC000422980841 387791164 /nfs/dbraw/zinc/79/11/64/387791164.db2.gz RHPNZVOBKJHJFU-SMDDNHRTSA-N 2 0 248.370 2.487 20 0 BEADRP C[C@H](C[NH2+][C@@H](C)CCC[NH3+])Oc1ccccc1 ZINC000422981075 387791190 /nfs/dbraw/zinc/79/11/90/387791190.db2.gz NCNHMRNSTMPCDJ-QWHCGFSZSA-N 2 0 236.359 2.171 20 0 BEADRP C[C@H](Cc1ccc(O)cc1)[NH2+][C@H]1CCC[C@H]1C[NH3+] ZINC000422979583 387791482 /nfs/dbraw/zinc/79/14/82/387791482.db2.gz NCZCGHVRXHWHTB-ZLDLUXBVSA-N 2 0 248.370 2.040 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]C[C@@H](C)Oc1ccccc1 ZINC000422980910 387791710 /nfs/dbraw/zinc/79/17/10/387791710.db2.gz MRKACFCMAKKCQA-YNEHKIRRSA-N 2 0 236.359 2.169 20 0 BEADRP C[C@H](Cc1ccc(O)cc1)[NH2+][C@@H]1CCC[C@H]1C[NH3+] ZINC000422979581 387791845 /nfs/dbraw/zinc/79/18/45/387791845.db2.gz NCZCGHVRXHWHTB-OSAQELSMSA-N 2 0 248.370 2.040 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H]1CCc2c1cccc2O ZINC000422981461 387793215 /nfs/dbraw/zinc/79/32/15/387793215.db2.gz SWVCEXZTWDJUBS-OUJBWJOFSA-N 2 0 234.343 2.095 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]CC1Cc2ccccc2C1 ZINC000422983629 387793434 /nfs/dbraw/zinc/79/34/34/387793434.db2.gz UJJXSTRZRLZHOU-JKSUJKDBSA-N 2 0 244.382 2.118 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCCC(F)(F)C1 ZINC000422986615 387795136 /nfs/dbraw/zinc/79/51/36/387795136.db2.gz CWTQPLXCCOXENH-BBBLOLIVSA-N 2 0 218.291 2.034 20 0 BEADRP CSc1cc(C[NH2+][C@H](C)C[C@H](C)[NH3+])ccn1 ZINC000422984671 387795484 /nfs/dbraw/zinc/79/54/84/387795484.db2.gz BFPMNRZYCDEPCN-VHSXEESVSA-N 2 0 239.388 2.019 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+][C@@H](C)c1ccccc1 ZINC000422986726 387795612 /nfs/dbraw/zinc/79/56/12/387795612.db2.gz HFMFHXXJCVJXHV-UTUOFQBUSA-N 2 0 206.333 2.463 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@H]1CCCC(F)(F)C1 ZINC000422987870 387797888 /nfs/dbraw/zinc/79/78/88/387797888.db2.gz HOONMUSMLBXTIN-UWVGGRQHSA-N 2 0 220.307 2.281 20 0 BEADRP CC(C)(CCCO)C[NH2+][C@@H]1CCCCC[C@@H]1[NH3+] ZINC000422992010 387800122 /nfs/dbraw/zinc/80/01/22/387800122.db2.gz PLGBLVXQBKMBBG-QWHCGFSZSA-N 2 0 242.407 2.035 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+][C@H]1CC=CCC1 ZINC000422991137 387800644 /nfs/dbraw/zinc/80/06/44/387800644.db2.gz OHYOMKDOEAKCIF-YNEHKIRRSA-N 2 0 208.349 2.345 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC=CCC1)[C@H]1CCCC[NH2+]1 ZINC000422990516 387801109 /nfs/dbraw/zinc/80/11/09/387801109.db2.gz NQUMITAELWXBJG-JHJVBQTASA-N 2 0 208.349 2.215 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@@H](C)CCc1ccco1 ZINC000422965067 387813328 /nfs/dbraw/zinc/81/33/28/387813328.db2.gz NMGZTJKERPNXLN-SDDRHHMPSA-N 2 0 224.348 2.316 20 0 BEADRP CCC[C@H](CCO)C[NH2+][C@@H]1CCCCC[C@H]1[NH3+] ZINC000423002333 387807106 /nfs/dbraw/zinc/80/71/06/387807106.db2.gz FUZZHUVITLFZLZ-MGPQQGTHSA-N 2 0 242.407 2.035 20 0 BEADRP Cc1cccc(C)c1OCC[NH2+][C@H]1CCC[C@H]1[NH3+] ZINC000422948669 387807498 /nfs/dbraw/zinc/80/74/98/387807498.db2.gz RVFCMYDZOWRZOH-KGLIPLIRSA-N 2 0 248.370 2.152 20 0 BEADRP COc1cccc(C2([NH2+][C@H](C)C[C@H](C)[NH3+])CC2)c1 ZINC000422951901 387807915 /nfs/dbraw/zinc/80/79/15/387807915.db2.gz ARXFJVKUHOEMOB-NWDGAFQWSA-N 2 0 248.370 2.400 20 0 BEADRP CC1(C)C[C@@H]1C[NH2+][C@H]1CCCCC[C@@H]1[NH3+] ZINC000422956273 387808851 /nfs/dbraw/zinc/80/88/51/387808851.db2.gz OZFNUNBRVGNVCS-WOPDTQHZSA-N 2 0 210.365 2.282 20 0 BEADRP COC[C@H]([NH2+][C@H](C)C[C@H](C)[NH3+])c1ccccc1 ZINC000422954311 387809742 /nfs/dbraw/zinc/80/97/42/387809742.db2.gz HYFXDZAUCMFGCT-SCRDCRAPSA-N 2 0 236.359 2.090 20 0 BEADRP Cc1ccccc1C[C@H]([NH2+]C[C@H](C)[NH3+])C1CC1 ZINC000643526679 387758798 /nfs/dbraw/zinc/75/87/98/387758798.db2.gz DRVAAQSQCCPPOU-WFASDCNBSA-N 2 0 232.371 2.253 20 0 BEADRP CC[C@@H](Cc1cccs1)[NH2+]C[C@H](C)[NH3+] ZINC000643526860 387759406 /nfs/dbraw/zinc/75/94/06/387759406.db2.gz AUTONPBYJQLUJJ-UWVGGRQHSA-N 2 0 212.362 2.006 20 0 BEADRP CC[C@H](Cc1cccs1)[NH2+]C[C@H](C)[NH3+] ZINC000643526861 387760476 /nfs/dbraw/zinc/76/04/76/387760476.db2.gz AUTONPBYJQLUJJ-VHSXEESVSA-N 2 0 212.362 2.006 20 0 BEADRP COc1cccc([C@@H]2CCCN2C[C@@H](C)[NH3+])c1 ZINC000442667146 387820117 /nfs/dbraw/zinc/82/01/17/387820117.db2.gz YGJAXQUTODAHIU-RISCZKNCSA-N 2 0 234.343 2.179 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CC=CCC1)[C@@H]1CCCC[NH2+]1 ZINC000422972946 387821107 /nfs/dbraw/zinc/82/11/07/387821107.db2.gz NDNOJVJOBZDDPZ-RDBSUJKOSA-N 2 0 222.376 2.463 20 0 BEADRP C1=CC[C@H](C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)CC1 ZINC000422971667 387821752 /nfs/dbraw/zinc/82/17/52/387821752.db2.gz JIRXIJSFBDQZPG-ICIURTGMSA-N 2 0 220.360 2.215 20 0 BEADRP C[C@H](Cc1ccc(O)cc1)[NH2+][C@@H](C)[C@H]1CCC[NH2+]1 ZINC000422976103 387825904 /nfs/dbraw/zinc/82/59/04/387825904.db2.gz UQISMFQKNZFOSB-TYNCELHUSA-N 2 0 248.370 2.053 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CC1(CCO)CCCCC1 ZINC000423004107 387826276 /nfs/dbraw/zinc/82/62/76/387826276.db2.gz JEHYATRNTVCSMV-OLZOCXBDSA-N 2 0 242.407 2.035 20 0 BEADRP C[C@H](Cc1ccc(O)cc1)[NH2+][C@H](C)[C@H]1CCC[NH2+]1 ZINC000422976101 387826862 /nfs/dbraw/zinc/82/68/62/387826862.db2.gz UQISMFQKNZFOSB-LALPHHSUSA-N 2 0 248.370 2.053 20 0 BEADRP COCC(C)(C)C[N@@H+]1CCC[C@@H]([NH+](C)C)CC1 ZINC000432815290 387827875 /nfs/dbraw/zinc/82/78/75/387827875.db2.gz FGQPPZDKXWEQDH-CYBMUJFWSA-N 2 0 242.407 2.075 20 0 BEADRP COc1cc(C)cc(C[NH2+][C@H](C)CCC[NH3+])c1 ZINC000423007674 387829155 /nfs/dbraw/zinc/82/91/55/387829155.db2.gz YGEKOGAGWKMELC-GFCCVEGCSA-N 2 0 236.359 2.221 20 0 BEADRP CC(C)(CO)CCC[NH2+][C@@H]1CCCCC[C@@H]1[NH3+] ZINC000423006413 387829730 /nfs/dbraw/zinc/82/97/30/387829730.db2.gz OPINTHXFXASKAY-QWHCGFSZSA-N 2 0 242.407 2.035 20 0 BEADRP CC(C)(CO)CCC[NH2+][C@@H]1CCCCC[C@H]1[NH3+] ZINC000423006411 387829921 /nfs/dbraw/zinc/82/99/21/387829921.db2.gz OPINTHXFXASKAY-CHWSQXEVSA-N 2 0 242.407 2.035 20 0 BEADRP C[C@@H]([NH2+]CC12CCC(CC1)C2)[C@@H]1CCC[NH2+]1 ZINC000423008626 387832314 /nfs/dbraw/zinc/83/23/14/387832314.db2.gz ARZZCRUHCGBIBW-ZIHBUVQPSA-N 2 0 222.376 2.297 20 0 BEADRP CC[C@@H]([NH2+]CCSCC(C)C)[C@@H]1CCC[NH2+]1 ZINC000423010564 387833666 /nfs/dbraw/zinc/83/36/66/387833666.db2.gz GYLUFGBSYQHZKT-OLZOCXBDSA-N 2 0 244.448 2.496 20 0 BEADRP Cc1ccc(CC[N@H+]2C[C@@H](C[NH3+])C[C@H]2C)cc1 ZINC000442763711 387834101 /nfs/dbraw/zinc/83/41/01/387834101.db2.gz JBIZKZFUJNSJKW-UKRRQHHQSA-N 2 0 232.371 2.207 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]C1CCC(F)(F)CC1 ZINC000423010690 387834804 /nfs/dbraw/zinc/83/48/04/387834804.db2.gz HCUPHEQUVQTYKZ-SECBINFHSA-N 2 0 220.307 2.281 20 0 BEADRP CC(C)CSCCC[NH2+][C@H]1CCC[C@H]1[NH3+] ZINC000423013900 387835293 /nfs/dbraw/zinc/83/52/93/387835293.db2.gz NTKMIJJOXLLKKG-NEPJUHHUSA-N 2 0 230.421 2.235 20 0 BEADRP CO[C@@H]1[C@H](C)[C@@H]([NH2+][C@@H](C)CCCC[NH3+])C1(C)C ZINC000423019007 387841167 /nfs/dbraw/zinc/84/11/67/387841167.db2.gz STOBOIVRBFLITQ-UMSGYPCISA-N 2 0 242.407 2.153 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC1(C)C)[C@H]1CCCC[NH2+]1 ZINC000423027121 387844621 /nfs/dbraw/zinc/84/46/21/387844621.db2.gz OHZLVFQWMIGWAH-QJPTWQEYSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H](CO)CC1CCCC1 ZINC000423031109 387846621 /nfs/dbraw/zinc/84/66/21/387846621.db2.gz WPILXFTZUAGVAY-TZMCWYRMSA-N 2 0 242.407 2.035 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CCCCS1)[C@@H]1CCC[NH2+]1 ZINC000423033995 387848307 /nfs/dbraw/zinc/84/83/07/387848307.db2.gz PJEGXYYHGNLUOP-WOPDTQHZSA-N 2 0 228.405 2.002 20 0 BEADRP CS[C@H](C[NH2+][C@@H]1CCC[C@@H]1[NH3+])C(C)(C)C ZINC000423031922 387848860 /nfs/dbraw/zinc/84/88/60/387848860.db2.gz LQTSCSQGIJZZAO-HBNTYKKESA-N 2 0 230.421 2.234 20 0 BEADRP Cc1csc([C@H](C)C[NH2+][C@H]2CCC[C@H]2[NH3+])n1 ZINC000423034322 387848978 /nfs/dbraw/zinc/84/89/78/387848978.db2.gz HSNPNTIUTDYMRN-IEBDPFPHSA-N 2 0 239.388 2.024 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+][C@H]2CC23CC[NH2+]CC3)o1 ZINC000643533745 387849214 /nfs/dbraw/zinc/84/92/14/387849214.db2.gz CPKZAQMNLLKCKO-YPMHNXCESA-N 2 0 234.343 2.381 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@@H]2CCC[C@H]2[NH3+])C[C@H]1C ZINC000423033770 387849375 /nfs/dbraw/zinc/84/93/75/387849375.db2.gz GVVMRKSATKDHTQ-UJPOAAIJSA-N 2 0 210.365 2.281 20 0 BEADRP C[C@@H](C[NH2+][C@@H](C)C1(C)CC1)C[NH+]1CCCC1 ZINC000062078304 387849517 /nfs/dbraw/zinc/84/95/17/387849517.db2.gz QKXHHRZJTHTSHS-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP COC1CCC(CC[NH2+][C@@H](C)C[C@H](C)[NH3+])CC1 ZINC000423036689 387850436 /nfs/dbraw/zinc/85/04/36/387850436.db2.gz LHKVAFMZXAKUFM-FEPKRQSRSA-N 2 0 242.407 2.297 20 0 BEADRP COCCC(C)(C)C[NH2+]C1CCC(C[NH3+])CC1 ZINC000423035364 387850453 /nfs/dbraw/zinc/85/04/53/387850453.db2.gz JGIFBBVHNDGBJH-UHFFFAOYSA-N 2 0 242.407 2.156 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1CCCCS1)[C@@H]1CCC[NH2+]1 ZINC000423036426 387850520 /nfs/dbraw/zinc/85/05/20/387850520.db2.gz UAAPQRJVKWAGKM-AVGNSLFASA-N 2 0 242.432 2.392 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+][C@H]1CCC12CCCC2 ZINC000423074535 387874019 /nfs/dbraw/zinc/87/40/19/387874019.db2.gz LYDNUDURPHPXOY-STQMWFEESA-N 2 0 240.391 2.053 20 0 BEADRP Cc1cc(C[NH+](C)C)cc(N[C@@H](C)C2C[NH2+]C2)c1 ZINC000423035031 387850637 /nfs/dbraw/zinc/85/06/37/387850637.db2.gz YHHPGQNAIZBNJQ-LBPRGKRZSA-N 2 0 247.386 2.076 20 0 BEADRP COC1CCC(CC[NH2+][C@H](C)C[C@@H](C)[NH3+])CC1 ZINC000423036691 387851119 /nfs/dbraw/zinc/85/11/19/387851119.db2.gz LHKVAFMZXAKUFM-IWMBGFJWSA-N 2 0 242.407 2.297 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CCC[C@H]1CCCCO1 ZINC000423036509 387851546 /nfs/dbraw/zinc/85/15/46/387851546.db2.gz LEVZWJDLRXQVSG-ZIAGYGMSSA-N 2 0 242.407 2.443 20 0 BEADRP CS[C@H](C[NH2+][C@H]1CCC[C@H]1C[NH3+])C(C)(C)C ZINC000423038981 387852721 /nfs/dbraw/zinc/85/27/21/387852721.db2.gz ZKLSFPRWHKQNJU-SDDRHHMPSA-N 2 0 244.448 2.481 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CC[C@@H]1CCO[C@@H](C)C1 ZINC000423038974 387852910 /nfs/dbraw/zinc/85/29/10/387852910.db2.gz ZKDIGCRTWLNLFW-HZSPNIEDSA-N 2 0 242.407 2.299 20 0 BEADRP CC[C@H](CC(F)(F)F)[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000423041249 387854863 /nfs/dbraw/zinc/85/48/63/387854863.db2.gz WQYKMTHLFRJYJD-XHNCKOQMSA-N 2 0 226.286 2.433 20 0 BEADRP C[N@H+]1C[C@@H]2C[NH+](CCC3CCCC3)C[C@@H]2C1 ZINC000193654231 387857850 /nfs/dbraw/zinc/85/78/50/387857850.db2.gz MXRWHKQPORTLQR-OKILXGFUSA-N 2 0 222.376 2.060 20 0 BEADRP C[C@@H](NC1(Cc2ccccc2)CC1)[C@H]1CCC[NH2+]1 ZINC000423049681 387858051 /nfs/dbraw/zinc/85/80/51/387858051.db2.gz KFIMTNOUTZJWND-UKRRQHHQSA-N 2 0 244.382 2.492 20 0 BEADRP CC(C)C[C@@H]1OCCC[C@@H]1[NH2+][C@@H](C)CCC[NH3+] ZINC000423052533 387859248 /nfs/dbraw/zinc/85/92/48/387859248.db2.gz QDUGJFOCHJOHBI-IHRRRGAJSA-N 2 0 242.407 2.297 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H](C)CC(F)(F)F ZINC000423052975 387859718 /nfs/dbraw/zinc/85/97/18/387859718.db2.gz RQFZUBHUBXPZGM-FXQIFTODSA-N 2 0 212.259 2.043 20 0 BEADRP C[C@@H]([NH2+]Cc1ccc(C(F)F)cc1)C1C[NH2+]C1 ZINC000423052609 387859862 /nfs/dbraw/zinc/85/98/62/387859862.db2.gz QYRASFJETVWEDN-SECBINFHSA-N 2 0 240.297 2.322 20 0 BEADRP C1[C@@H]([NH2+][C@@H]2CCC23CCC3)C12CC[NH2+]CC2 ZINC000643535380 387862460 /nfs/dbraw/zinc/86/24/60/387862460.db2.gz CXBTWFPBZDIGRJ-VXGBXAGGSA-N 2 0 220.360 2.051 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCCC[C@H]1C[NH3+])C(F)(F)F ZINC000423056964 387863472 /nfs/dbraw/zinc/86/34/72/387863472.db2.gz YMNWYHWVEPYEAV-UTLUCORTSA-N 2 0 238.297 2.292 20 0 BEADRP C[C@H]([NH2+][C@H]1CC12CC[NH2+]CC2)[C@@H]1CC1(C)C ZINC000643536037 387865779 /nfs/dbraw/zinc/86/57/79/387865779.db2.gz MHZJJEFYTYBIGX-SRVKXCTJSA-N 2 0 222.376 2.153 20 0 BEADRP CC[C@@H]([NH2+]CCC=C(C)C)[C@@H]1CCC[NH2+]1 ZINC000423066676 387869673 /nfs/dbraw/zinc/86/96/73/387869673.db2.gz FEROGVYXOJPTBB-OLZOCXBDSA-N 2 0 210.365 2.463 20 0 BEADRP CC[C@H]([NH2+]CCC=C(C)C)[C@@H]1CCC[NH2+]1 ZINC000423066677 387870316 /nfs/dbraw/zinc/87/03/16/387870316.db2.gz FEROGVYXOJPTBB-STQMWFEESA-N 2 0 210.365 2.463 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[C@H](OC)C1)[C@@H]1CCCC[NH2+]1 ZINC000423068315 387870470 /nfs/dbraw/zinc/87/04/70/387870470.db2.gz JRDXGOZVASKHRR-RFGFWPKPSA-N 2 0 240.391 2.064 20 0 BEADRP C1[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)C12CCCC2 ZINC000423071550 387871484 /nfs/dbraw/zinc/87/14/84/387871484.db2.gz FLEFDCVUTWZMNE-HNGCFSAESA-N 2 0 220.360 2.192 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC12CCCC2)[C@H]1CC[NH2+]C1 ZINC000423069744 387871724 /nfs/dbraw/zinc/87/17/24/387871724.db2.gz BSTDSOLTQOUYQX-AVGNSLFASA-N 2 0 222.376 2.297 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]CCc1ccco1 ZINC000422963172 387813918 /nfs/dbraw/zinc/81/39/18/387813918.db2.gz HVTIJOBBONAOAE-CHWSQXEVSA-N 2 0 222.332 2.072 20 0 BEADRP COc1ccccc1C[C@H]1CCCN1C[C@@H](C)[NH3+] ZINC000442656104 387814287 /nfs/dbraw/zinc/81/42/87/387814287.db2.gz DOCQMWPUBFETBO-TZMCWYRMSA-N 2 0 248.370 2.049 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]CCc1ccco1 ZINC000422963173 387814500 /nfs/dbraw/zinc/81/45/00/387814500.db2.gz HVTIJOBBONAOAE-OLZOCXBDSA-N 2 0 222.332 2.072 20 0 BEADRP CCOC[C@H]([NH2+]C1CCC(C[NH3+])CC1)C(C)C ZINC000423070146 387872668 /nfs/dbraw/zinc/87/26/68/387872668.db2.gz MWZMXHGRFSRXGC-RUXDESIVSA-N 2 0 242.407 2.155 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]CCCC(F)(F)F ZINC000422968432 387818975 /nfs/dbraw/zinc/81/89/75/387818975.db2.gz QSUULEAQMAIMSV-ZJUUUORDSA-N 2 0 238.297 2.307 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]CCC1(F)CCC1 ZINC000423103008 387889743 /nfs/dbraw/zinc/88/97/43/387889743.db2.gz FWRRGSRNMJPVPV-VXGBXAGGSA-N 2 0 228.355 2.246 20 0 BEADRP COCC[C@H]([NH2+][C@@H](C)[C@@H]1CC[NH2+]C1)C(C)(C)C ZINC000423116576 387898818 /nfs/dbraw/zinc/89/88/18/387898818.db2.gz QLEYDPLXJDHKNJ-XQQFMLRXSA-N 2 0 242.407 2.025 20 0 BEADRP CC(C)OCCC[N@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000158075173 387890775 /nfs/dbraw/zinc/89/07/75/387890775.db2.gz UNKZEOSFEYFGEH-CQSZACIVSA-N 2 0 242.407 2.075 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]1[NH2+]CC1(C(F)(F)F)CCC1 ZINC000423107001 387890852 /nfs/dbraw/zinc/89/08/52/387890852.db2.gz KFLIFQYPUJUOLO-IUCAKERBSA-N 2 0 236.281 2.188 20 0 BEADRP CO[C@H]1CCCC[C@@H]1[NH2+][C@@H](C)CCCC[NH3+] ZINC000423109521 387893724 /nfs/dbraw/zinc/89/37/24/387893724.db2.gz HLARJZUWOGBQBA-AVGNSLFASA-N 2 0 228.380 2.051 20 0 BEADRP CCSCCC[NH2+][C@H]1CCCCC[C@H]1[NH3+] ZINC000423110688 387893934 /nfs/dbraw/zinc/89/39/34/387893934.db2.gz IICLVNRFMIFNSF-NEPJUHHUSA-N 2 0 230.421 2.379 20 0 BEADRP C[C@H]([NH2+]CC1CCC(F)(F)CC1)C1C[NH2+]C1 ZINC000423111834 387894988 /nfs/dbraw/zinc/89/49/88/387894988.db2.gz JJJKPOQXBGMIET-VIFPVBQESA-N 2 0 232.318 2.009 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCCC(F)(F)C1)C1C[NH2+]C1 ZINC000423117800 387898970 /nfs/dbraw/zinc/89/89/70/387898970.db2.gz XHAXUVSYCJXESC-UWVGGRQHSA-N 2 0 232.318 2.009 20 0 BEADRP CC1(C)CC[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000423113485 387896567 /nfs/dbraw/zinc/89/65/67/387896567.db2.gz UISSOWCPIUNGAP-AYLPWXGPSA-N 2 0 208.349 2.048 20 0 BEADRP C1[C@@H]([NH2+][C@H]2CC[C@H]2C2CCC2)C12CC[NH2+]CC2 ZINC000643536866 387876582 /nfs/dbraw/zinc/87/65/82/387876582.db2.gz XBSLULVLLJWNOI-MELADBBJSA-N 2 0 234.387 2.297 20 0 BEADRP CC1(CC[NH2+][C@@H]2CCCC[C@@H]2C[NH3+])CC1 ZINC000423083674 387879110 /nfs/dbraw/zinc/87/91/10/387879110.db2.gz GFYREANMORHCIA-VXGBXAGGSA-N 2 0 210.365 2.284 20 0 BEADRP CC[C@](C)(C[NH2+][C@H]1CCN2CCCC[C@H]12)OC ZINC000322518372 387879684 /nfs/dbraw/zinc/87/96/84/387879684.db2.gz KYEOBZAGSICWPT-BFHYXJOUSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@@H]([NH2+]CCC1(C)CC1)[C@H]1CCCC[NH2+]1 ZINC000423088364 387880609 /nfs/dbraw/zinc/88/06/09/387880609.db2.gz RRWPZKRVDUDGCK-VXGBXAGGSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]([NH2+]CCC1(C)CC1)[C@@H]1CCCC[NH2+]1 ZINC000423088361 387881055 /nfs/dbraw/zinc/88/10/55/387881055.db2.gz RRWPZKRVDUDGCK-NEPJUHHUSA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@H]([NH2+]CC1(SC)CCC1)[C@@H]1CCC[NH2+]1 ZINC000423086386 387881255 /nfs/dbraw/zinc/88/12/55/387881255.db2.gz LXFOSCRBQVZZQH-RYUDHWBXSA-N 2 0 242.432 2.392 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CC[C@@H](C)C1)[C@@H]1CCC[NH2+]1 ZINC000423092551 387882502 /nfs/dbraw/zinc/88/25/02/387882502.db2.gz CIDSBBVCWATRED-XQHKEYJVSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH3+])[C@H](C)[NH2+][C@@H]1CCCc2ccccc2C1 ZINC000643540101 387882441 /nfs/dbraw/zinc/88/24/41/387882441.db2.gz JJHHWYYPBYVTBC-SLEUVZQESA-N 2 0 232.371 2.259 20 0 BEADRP CC[C@H]([NH2+][C@H](C)CC[NH+](C)C)[C@@H]1C[C@H]1C ZINC000322072366 387883871 /nfs/dbraw/zinc/88/38/71/387883871.db2.gz SRBDLCRMKUCZNC-LPWJVIDDSA-N 2 0 212.381 2.351 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC000423095822 387884897 /nfs/dbraw/zinc/88/48/97/387884897.db2.gz NBZPZLWTEIQICK-VWYCJHECSA-N 2 0 232.318 2.139 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]C[C@H]1CCC(F)(F)C1 ZINC000423093659 387885084 /nfs/dbraw/zinc/88/50/84/387885084.db2.gz IIYFSFTZUGKOFW-WOPDTQHZSA-N 2 0 246.345 2.400 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]C[C@H]1CCC(F)(F)C1 ZINC000423096040 387885330 /nfs/dbraw/zinc/88/53/30/387885330.db2.gz NVADBMZYXOFBKB-GUBZILKMSA-N 2 0 220.307 2.137 20 0 BEADRP Cc1cccc(CCC[NH2+][C@@H]2CCC[C@@H]2C[NH3+])n1 ZINC000423100156 387887963 /nfs/dbraw/zinc/88/79/63/387887963.db2.gz GJVIGPILYRZDQH-UKRRQHHQSA-N 2 0 247.386 2.040 20 0 BEADRP CCSCCC[NH2+][C@@H]1CC[NH2+]CC[C@@H]1C ZINC000423117732 387899280 /nfs/dbraw/zinc/89/92/80/387899280.db2.gz WXIVKOAAPKANLH-NWDGAFQWSA-N 2 0 230.421 2.107 20 0 BEADRP CO[C@H](C)[C@@H](C)[NH2+][C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000423141115 387919193 /nfs/dbraw/zinc/91/91/93/387919193.db2.gz OANSKVKGXCEOGC-JYILRKAJSA-N 2 0 234.343 2.144 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]C1CC(C(F)(F)F)C1 ZINC000423119829 387900714 /nfs/dbraw/zinc/90/07/14/387900714.db2.gz FNWLSJUQBVKFSN-DKATWDMPSA-N 2 0 224.270 2.043 20 0 BEADRP CCOCC(C)(C)C[NH2+][C@@H](CC)[C@@H]1CCC[NH2+]1 ZINC000423120732 387900778 /nfs/dbraw/zinc/90/07/78/387900778.db2.gz HNASTECZZFXDEV-STQMWFEESA-N 2 0 242.407 2.169 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]C1CC(C(F)(F)F)C1 ZINC000423119832 387901741 /nfs/dbraw/zinc/90/17/41/387901741.db2.gz FNWLSJUQBVKFSN-MZUZGICHSA-N 2 0 224.270 2.043 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]Cc1c(F)cc(F)cc1F ZINC000423126118 387904436 /nfs/dbraw/zinc/90/44/36/387904436.db2.gz ARTBWTDHUULSQW-QMMMGPOBSA-N 2 0 246.276 2.321 20 0 BEADRP C[C@H]([NH2+]CC(C)(C)C(C)(C)C)C1C[NH2+]C1 ZINC000423126764 387904584 /nfs/dbraw/zinc/90/45/84/387904584.db2.gz IYLHNRUWXVOKLH-JTQLQIEISA-N 2 0 212.381 2.256 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@@H]1COc2ccccc21 ZINC000423128104 387905179 /nfs/dbraw/zinc/90/51/79/387905179.db2.gz VCCDYLCLPVAKFJ-CHWSQXEVSA-N 2 0 248.370 2.270 20 0 BEADRP C/C(Cl)=C\C[NH+]1CCC(C[NH+](C)C)CC1 ZINC000528352249 387906361 /nfs/dbraw/zinc/90/63/61/387906361.db2.gz FOEXMKFVVIVJLT-NYYWCZLTSA-N 2 0 230.783 2.403 20 0 BEADRP C[C@H]([NH2+][C@H]1C[C@H](c2ccc(F)cc2)C1)C1C[NH2+]C1 ZINC000423128911 387906579 /nfs/dbraw/zinc/90/65/79/387906579.db2.gz LFZXXEUISOZXER-WBIUFABUSA-N 2 0 248.345 2.269 20 0 BEADRP COCC(C)(C)CCC[NH2+][C@@H](C)[C@@H]1CCC[NH2+]1 ZINC000423129221 387906981 /nfs/dbraw/zinc/90/69/81/387906981.db2.gz QWITUOWATYYIQS-STQMWFEESA-N 2 0 242.407 2.169 20 0 BEADRP C[C@@H]([NH2+]CC1CC(C)(C)C1)[C@H]1CCC[NH2+]1 ZINC000514667672 387908601 /nfs/dbraw/zinc/90/86/01/387908601.db2.gz KFTBCMQUZHCAGH-ZYHUDNBSSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]C[C@@H]1CCCSC1 ZINC000423133698 387911216 /nfs/dbraw/zinc/91/12/16/387911216.db2.gz VXCVGQCAMYBYND-FRRDWIJNSA-N 2 0 242.432 2.107 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]C1CC(C(F)(F)F)C1 ZINC000423136858 387914239 /nfs/dbraw/zinc/91/42/39/387914239.db2.gz ZQEYQKSYSLWRNF-NFTFJBJSSA-N 2 0 236.281 2.044 20 0 BEADRP CCC[C@H](C[NH2+][C@H]1CCCCC[C@H]1[NH3+])OC ZINC000423144615 387919654 /nfs/dbraw/zinc/91/96/54/387919654.db2.gz HNAXCDXNLUJMLK-UPJWGTAASA-N 2 0 228.380 2.051 20 0 BEADRP CC[C@H]1CC[C@H]([NH2+][C@@H](C)C2C[NH2+]C2)CC1 ZINC000423137033 387914910 /nfs/dbraw/zinc/91/49/10/387914910.db2.gz VWNDXEFKXAORQQ-GVXVVHGQSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]([NH2+]CCC(C)(C)C1CC1)C1C[NH2+]C1 ZINC000423138806 387916008 /nfs/dbraw/zinc/91/60/08/387916008.db2.gz UFBOLCRSBRTHMB-SNVBAGLBSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@H](F)CC[NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000423138785 387916112 /nfs/dbraw/zinc/91/61/12/387916112.db2.gz UBXXCPPYMNLVJJ-BIMULSAOSA-N 2 0 222.307 2.469 20 0 BEADRP Cc1cccnc1CCC[NH2+][C@H](C)C[C@@H](C)[NH3+] ZINC000423151927 387929894 /nfs/dbraw/zinc/92/98/94/387929894.db2.gz KWJHBJWTSQHKAK-CHWSQXEVSA-N 2 0 235.375 2.038 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]C[C@@H]1CCCCC1(F)F ZINC000423150833 387929999 /nfs/dbraw/zinc/92/99/99/387929999.db2.gz ZHTWFQRVULGLNG-HBNTYKKESA-N 2 0 232.318 2.281 20 0 BEADRP CC(C)[C@@H]1C[C@H]1C[NH2+][C@H](C)[C@H]1CCCC[NH2+]1 ZINC000423151611 387930764 /nfs/dbraw/zinc/93/07/64/387930764.db2.gz KEVQUXBTRQEDEP-ZOBORPQBSA-N 2 0 224.392 2.399 20 0 BEADRP Cc1ccc(F)c(CC[NH2+][C@H](C)CCC[NH3+])c1 ZINC000423152740 387931753 /nfs/dbraw/zinc/93/17/53/387931753.db2.gz MCIDOCLCJAGHCC-GFCCVEGCSA-N 2 0 238.350 2.394 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+][C@@H]1CC[NH2+]CC[C@H]1C ZINC000423152700 387931964 /nfs/dbraw/zinc/93/19/64/387931964.db2.gz MAOPHLLJZFBCHV-FVCCEPFGSA-N 2 0 210.365 2.010 20 0 BEADRP CC(C)[C@@H]1C[C@H]1C[NH2+][C@@H]1CCCC[C@H]1C[NH3+] ZINC000423153994 387931973 /nfs/dbraw/zinc/93/19/73/387931973.db2.gz OLSALKBFZOWPDR-XDQVBPFNSA-N 2 0 224.392 2.386 20 0 BEADRP CC(C)[C@@H]1C[C@H]1C[NH2+][C@H]1CCCC[C@@H]1C[NH3+] ZINC000423153993 387932930 /nfs/dbraw/zinc/93/29/30/387932930.db2.gz OLSALKBFZOWPDR-RFGFWPKPSA-N 2 0 224.392 2.386 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]C[C@H]1CCCC1(F)F ZINC000423156384 387937470 /nfs/dbraw/zinc/93/74/70/387937470.db2.gz SILLMZKOBQILJP-IJLUTSLNSA-N 2 0 246.345 2.400 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCCC(C)(C)C1)C1C[NH2+]C1 ZINC000423157871 387936126 /nfs/dbraw/zinc/93/61/26/387936126.db2.gz BTKCKWBMIWQKOV-NWDGAFQWSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H](c1ccccn1)[N@H+](C)CCc1cncn1C ZINC000459394966 387936157 /nfs/dbraw/zinc/93/61/57/387936157.db2.gz SUGOUQIVCJGOGC-LBPRGKRZSA-N 2 0 244.342 2.051 20 0 BEADRP CC1(F)CC([NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)C1 ZINC000423146252 387923004 /nfs/dbraw/zinc/92/30/04/387923004.db2.gz OWEBHPSCFNDBDV-ANNIKCPVSA-N 2 0 240.366 2.387 20 0 BEADRP Cc1cccnc1CC[NH2+]C1CCC(C[NH3+])CC1 ZINC000423146301 387923071 /nfs/dbraw/zinc/92/30/71/387923071.db2.gz AABKPWRGPRNDNJ-UHFFFAOYSA-N 2 0 247.386 2.040 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]CCCC(C)(F)F ZINC000423147498 387924040 /nfs/dbraw/zinc/92/40/40/387924040.db2.gz SGXCKAVDFKJWLV-MNOVXSKESA-N 2 0 234.334 2.400 20 0 BEADRP CCn1ccnc1[C@H](C)[NH2+][C@H](C)CCCC[NH3+] ZINC000423146888 387925151 /nfs/dbraw/zinc/92/51/51/387925151.db2.gz BNJMASAVFPJBFA-NEPJUHHUSA-N 2 0 238.379 2.071 20 0 BEADRP F[C@H]1CCC[C@H]1[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000423148184 387925229 /nfs/dbraw/zinc/92/52/29/387925229.db2.gz UTIXIQNJSHIZQA-QSLWVIQJSA-N 2 0 240.366 2.387 20 0 BEADRP Cc1ccc(F)c(CC[NH2+][C@@H](C)C[C@H](C)[NH3+])c1 ZINC000423147028 387925912 /nfs/dbraw/zinc/92/59/12/387925912.db2.gz BTJNDKRHKWZXJQ-RYUDHWBXSA-N 2 0 238.350 2.392 20 0 BEADRP CC(C)(C[NH2+][C@H]1CCC[C@@H]1C[NH3+])c1ccccn1 ZINC000423147901 387926256 /nfs/dbraw/zinc/92/62/56/387926256.db2.gz TXOAIOBHDUJTHJ-OLZOCXBDSA-N 2 0 247.386 2.076 20 0 BEADRP CC[C@@H]1CCC[C@H]1C[NH2+][C@H](C)C1C[NH2+]C1 ZINC000423151857 387929011 /nfs/dbraw/zinc/92/90/11/387929011.db2.gz CZZSZLWGRCNWHX-UTUOFQBUSA-N 2 0 210.365 2.010 20 0 BEADRP CC[C@H]([NH2+]CC1(N(C)C)CCC1)[C@@H]1C[C@H]1C ZINC000321153033 387952419 /nfs/dbraw/zinc/95/24/19/387952419.db2.gz WLISNLOWYLUVIV-UPJWGTAASA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@H]1CCC[C@@H]2C[C@@H]21 ZINC000423167204 387953130 /nfs/dbraw/zinc/95/31/30/387953130.db2.gz DTSUSJIZEKCWKY-RNJOBUHISA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]C1(C2CCC2)CCC1 ZINC000423168392 387953277 /nfs/dbraw/zinc/95/32/77/387953277.db2.gz HDYJZLFLIORYBZ-LLVKDONJSA-N 2 0 210.365 2.426 20 0 BEADRP CC[C@]1(C(C)C)C[C@@H]1[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000423169467 387953895 /nfs/dbraw/zinc/95/38/95/387953895.db2.gz VXEJGOWTWGCOCB-WCFLWFBJSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]CCC1CC(F)(F)C1 ZINC000423169159 387955546 /nfs/dbraw/zinc/95/55/46/387955546.db2.gz VOKSMTRCNBCBTC-PWSUYJOCSA-N 2 0 246.345 2.400 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+]C1(C2CCC2)CCC1 ZINC000423169944 387955646 /nfs/dbraw/zinc/95/56/46/387955646.db2.gz KQNAOTYCEQYEDQ-CYBMUJFWSA-N 2 0 240.391 2.053 20 0 BEADRP CC[C@H](C)[C@@H](C)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000044534262 387937558 /nfs/dbraw/zinc/93/75/58/387937558.db2.gz VTVODVMDYDBBOP-XQQFMLRXSA-N 2 0 212.381 2.352 20 0 BEADRP CC[C@]1(C(C)C)C[C@@H]1[NH2+][C@H](C)[C@@H]1CC[NH2+]C1 ZINC000423158209 387938801 /nfs/dbraw/zinc/93/88/01/387938801.db2.gz CJZRDORNNJDBLI-YIYPIFLZSA-N 2 0 224.392 2.399 20 0 BEADRP CCCC[C@@H](C)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000044533296 387938735 /nfs/dbraw/zinc/93/87/35/387938735.db2.gz HGYXWFGDEOULSL-CHWSQXEVSA-N 2 0 212.381 2.497 20 0 BEADRP CC(C)[C@@H]1C[C@H]1C[NH2+]C1CCC(C[NH3+])CC1 ZINC000423158628 387939291 /nfs/dbraw/zinc/93/92/91/387939291.db2.gz WWQXAVGJOOXINT-YIOUJQMASA-N 2 0 224.392 2.386 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1C[C@H]1CC)[C@@H]1CCC[NH2+]1 ZINC000423158625 387939783 /nfs/dbraw/zinc/93/97/83/387939783.db2.gz WWGMUSRKVMJTTH-VOAKCMCISA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@]1(C(C)C)C[C@@H]1[NH2+][C@H](C)[C@H]1CC[NH2+]C1 ZINC000423158210 387939869 /nfs/dbraw/zinc/93/98/69/387939869.db2.gz CJZRDORNNJDBLI-ZOBORPQBSA-N 2 0 224.392 2.399 20 0 BEADRP CC[C@@H]([NH2+][C@@H](C)C1C[NH2+]C1)C1CCCC1 ZINC000423162463 387942560 /nfs/dbraw/zinc/94/25/60/387942560.db2.gz PILCVAHVKMSHSI-GXFFZTMASA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@@H]([NH2+][C@H](C)C1C[NH2+]C1)C1CCCC1 ZINC000423162465 387944049 /nfs/dbraw/zinc/94/40/49/387944049.db2.gz PILCVAHVKMSHSI-ZWNOBZJWSA-N 2 0 210.365 2.153 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]CC1(C2CCC2)CCC1 ZINC000423164440 387947609 /nfs/dbraw/zinc/94/76/09/387947609.db2.gz OQWCZHBKBUPTIA-CHWSQXEVSA-N 2 0 222.376 2.426 20 0 BEADRP CCC[C@H]([NH2+][C@@H]1CC[NH2+]C1)C1CCCC1 ZINC000423171395 387956367 /nfs/dbraw/zinc/95/63/67/387956367.db2.gz OHGQQAZWJNVGDS-OLZOCXBDSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@@H]1C[C@H]1c1ccccc1F ZINC000423170639 387956412 /nfs/dbraw/zinc/95/64/12/387956412.db2.gz MMRKZWAVXDQKCS-HEQLZXTPSA-N 2 0 236.334 2.397 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CCC1CC(F)(F)C1 ZINC000423166180 387950111 /nfs/dbraw/zinc/95/01/11/387950111.db2.gz QUMGSJWFUBCCJZ-IUCAKERBSA-N 2 0 220.307 2.137 20 0 BEADRP CC(C)C[C@@H]1C[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000423172250 387959478 /nfs/dbraw/zinc/95/94/78/387959478.db2.gz RYSJWVVWKHXWFE-SYCZCVCYSA-N 2 0 222.376 2.294 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CCC[C@H]1C1CC1 ZINC000423172221 387959591 /nfs/dbraw/zinc/95/95/91/387959591.db2.gz RVRBRHBJDBDUAR-RQJABVFESA-N 2 0 222.376 2.282 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]C1(C2CCC2)CCC1 ZINC000423171898 387959744 /nfs/dbraw/zinc/95/97/44/387959744.db2.gz QLJWRPNINDHQGD-QWRGUYRKSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@H]([NH2+]CC1([NH3+])CCCCC1)[C@H]1CCCOC1 ZINC000423175623 387961917 /nfs/dbraw/zinc/96/19/17/387961917.db2.gz FAQACBOEHKBMDD-STQMWFEESA-N 2 0 240.391 2.053 20 0 BEADRP C[C@@H]([NH2+]CC1([NH3+])CCCCC1)[C@H]1CCCOC1 ZINC000423175621 387961935 /nfs/dbraw/zinc/96/19/35/387961935.db2.gz FAQACBOEHKBMDD-OLZOCXBDSA-N 2 0 240.391 2.053 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1CCCc2ccccc21 ZINC000423187823 387972311 /nfs/dbraw/zinc/97/23/11/387972311.db2.gz MXZAUQIBTDZPMD-CQSZACIVSA-N 2 0 218.344 2.263 20 0 BEADRP C[C@@H]1C[C@H](C[NH2+][C@@H]2CCCCC[C@H]2[NH3+])[C@@H](C)O1 ZINC000423183595 387970501 /nfs/dbraw/zinc/97/05/01/387970501.db2.gz MSDBSSKNCFJJES-DHGKCCLASA-N 2 0 240.391 2.050 20 0 BEADRP C[NH2+]CCC[NH2+][C@H](C)c1cccc(F)c1 ZINC000423187836 387971597 /nfs/dbraw/zinc/97/15/97/387971597.db2.gz NATGQOJDHLQRHM-SNVBAGLBSA-N 2 0 210.296 2.086 20 0 BEADRP CCC[C@@H]([NH2+][C@H]1CC[NH2+]C1)C1CCCC1 ZINC000423171396 387956918 /nfs/dbraw/zinc/95/69/18/387956918.db2.gz OHGQQAZWJNVGDS-QWHCGFSZSA-N 2 0 210.365 2.297 20 0 BEADRP CC(C)O[C@H]1C[C@@H]([NH2+][C@@H]2CCCC[C@@H]2C[NH3+])C1 ZINC000423170244 387957003 /nfs/dbraw/zinc/95/70/03/387957003.db2.gz XODAPFOZHRVMIF-YIYPIFLZSA-N 2 0 240.391 2.050 20 0 BEADRP C[C@H]1CCc2c(F)cccc2[C@@H]1[NH2+]CCC[NH3+] ZINC000423195175 387979624 /nfs/dbraw/zinc/97/96/24/387979624.db2.gz SKUWTLKKTSHRIH-IINYFYTJSA-N 2 0 236.334 2.388 20 0 BEADRP COc1ccc2c(c1)C(C)(C)C[C@H]2[NH2+]CCC[NH3+] ZINC000423197243 387981644 /nfs/dbraw/zinc/98/16/44/387981644.db2.gz YOPHZYZWASBSCJ-CQSZACIVSA-N 2 0 248.370 2.356 20 0 BEADRP CC[C@H](C)[NH2+][C@@H]1CC[N@H+](C)[C@@H]2CCC[C@@H]21 ZINC000453051382 387973219 /nfs/dbraw/zinc/97/32/19/387973219.db2.gz BEVUKRLPUUTTCY-UMSGYPCISA-N 2 0 210.365 2.247 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CC(C)(C)c1cccnc1 ZINC000423189908 387973456 /nfs/dbraw/zinc/97/34/56/387973456.db2.gz RMIIAMPXRKVELC-NWDGAFQWSA-N 2 0 235.375 2.075 20 0 BEADRP C[N@@H+]1CCC[C@@H]1CC[NH+]1C[C@@H]2CCC[C@H]2C1 ZINC000245701716 387974953 /nfs/dbraw/zinc/97/49/53/387974953.db2.gz XUPHFIQYOBGQSB-MELADBBJSA-N 2 0 222.376 2.203 20 0 BEADRP c1ccc(CC[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000106868242 387975854 /nfs/dbraw/zinc/97/58/54/387975854.db2.gz IONPZCPSSSCTFZ-JKSUJKDBSA-N 2 0 244.382 2.446 20 0 BEADRP C[C@@H]1CC(C)(C)C[C@@H]1[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000423202644 387989346 /nfs/dbraw/zinc/98/93/46/387989346.db2.gz BIDKTDBFGDOCNU-AGIUHOORSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[NH2+]C1)c1cccc(O)c1 ZINC000423205774 387990698 /nfs/dbraw/zinc/99/06/98/387990698.db2.gz BKPODQGDTSTVAM-OBJOEFQTSA-N 2 0 248.370 2.431 20 0 BEADRP CC[C@@H]1C[C@@H](C)CC[C@@H]1[NH2+]CCC[NH2+]C ZINC000423205041 387990712 /nfs/dbraw/zinc/99/07/12/387990712.db2.gz VBYYVRYGRDSEFL-XQQFMLRXSA-N 2 0 212.381 2.400 20 0 BEADRP C[NH2+]CCC[NH2+][C@H]1CCC[C@@H]1CCCF ZINC000423206404 387991189 /nfs/dbraw/zinc/99/11/89/387991189.db2.gz WSTMJOBANMTMKE-NEPJUHHUSA-N 2 0 216.344 2.104 20 0 BEADRP CCCC[C@@H](COC)[NH2+][C@@H]1CCCC[C@H]1[NH3+] ZINC000424366200 387991424 /nfs/dbraw/zinc/99/14/24/387991424.db2.gz IRPHPDLRBOJQAN-YNEHKIRRSA-N 2 0 228.380 2.051 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1CCC[C@@H]1CCCF ZINC000423206407 387991411 /nfs/dbraw/zinc/99/14/11/387991411.db2.gz WSTMJOBANMTMKE-VXGBXAGGSA-N 2 0 216.344 2.104 20 0 BEADRP CC1(C)CC[C@H]([NH2+][C@@H]2CCCC[C@H]2[NH3+])C1 ZINC000424368022 387992835 /nfs/dbraw/zinc/99/28/35/387992835.db2.gz OKZIRUKPWMJONU-QJPTWQEYSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[C@H]1C1CCC1)[C@@H]1CCCC[NH2+]1 ZINC000424370555 387994104 /nfs/dbraw/zinc/99/41/04/387994104.db2.gz DQDGGZGNTHVTNS-VZZFWQQMSA-N 2 0 222.376 2.295 20 0 BEADRP Cc1ccc(C[C@@H](N[C@H]2CC[NH2+]C2)C2CC2)cc1 ZINC000423211982 387994759 /nfs/dbraw/zinc/99/47/59/387994759.db2.gz ZICMUJODDAVIRI-JKSUJKDBSA-N 2 0 244.382 2.268 20 0 BEADRP C[C@@H]([NH2+]CCC[NH3+])[C@@H]1C[C@H]1c1ccccc1 ZINC000423196238 387982043 /nfs/dbraw/zinc/98/20/43/387982043.db2.gz UXTKUBYUAFPHCU-XBFCOCLRSA-N 2 0 218.344 2.117 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@@H]2C[C@H]3C[C@H]3C2)[C@H]2CCC[C@H]21 ZINC000424342181 387982139 /nfs/dbraw/zinc/98/21/39/387982139.db2.gz FJMJYNNHUHLMOT-ZAQNNHEOSA-N 2 0 234.387 2.247 20 0 BEADRP C[NH2+]CCC[NH2+][C@H]1CCCC12CCCC2 ZINC000423198600 387984055 /nfs/dbraw/zinc/98/40/55/387984055.db2.gz GSCXDPBRLFHWFH-LBPRGKRZSA-N 2 0 210.365 2.298 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1C[C@@H](C)c2ccccc21 ZINC000423198920 387985149 /nfs/dbraw/zinc/98/51/49/387985149.db2.gz IRGFUFCSSOKADX-BXUZGUMPSA-N 2 0 218.344 2.434 20 0 BEADRP C[NH2+]CCC[NH2+][C@H](C)c1cc2c(s1)CCC2 ZINC000423200302 387985495 /nfs/dbraw/zinc/98/54/95/387985495.db2.gz LRFYFIPDQKRZQY-SNVBAGLBSA-N 2 0 238.400 2.497 20 0 BEADRP CC[C@H]([NH2+]CCC[NH2+]C)c1ccsc1 ZINC000423199670 387986418 /nfs/dbraw/zinc/98/64/18/387986418.db2.gz KLAJDKMDUKGCJE-NSHDSACASA-N 2 0 212.362 2.398 20 0 BEADRP CCC1CC([NH2+][C@@H](C)[C@@H]2CCC[NH2+]C2)C1 ZINC000423218002 387999053 /nfs/dbraw/zinc/99/90/53/387999053.db2.gz QYJLLYUGHZNOOR-GMKTYKIGSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@@H]([NH2+]C[C@@H]2CCC[NH2+]C2)C1 ZINC000423216378 387999761 /nfs/dbraw/zinc/99/97/61/387999761.db2.gz RUXOWTVGXJXQJI-RQJABVFESA-N 2 0 224.392 2.400 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+][C@H](C)[C@H]1CCC[NH2+]C1 ZINC000423216868 387999797 /nfs/dbraw/zinc/99/97/97/387999797.db2.gz PFUIWXFGHZXKSF-NDBYEHHHSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]C[C@@H]1C[C@H]1C1CCC1 ZINC000424375617 388000081 /nfs/dbraw/zinc/00/00/81/388000081.db2.gz KNWORQUUJAFXGG-UKJIMTQDSA-N 2 0 210.365 2.138 20 0 BEADRP CC(C)C1CC([NH2+]C[C@@H]2CCC[NH2+]C2)C1 ZINC000423221229 388001837 /nfs/dbraw/zinc/00/18/37/388001837.db2.gz ZKLNMWFNKNYWAD-PNESKVBLSA-N 2 0 210.365 2.010 20 0 BEADRP C[N@H+]1CC=C(C[NH2+][C@@H](C2CC2)C2CCC2)CC1 ZINC000453185701 388005148 /nfs/dbraw/zinc/00/51/48/388005148.db2.gz XVLUKHFLFNHIFB-OAHLLOKOSA-N 2 0 234.387 2.417 20 0 BEADRP Cc1cccc2c1CC[C@H]2[NH2+]CC[C@H](C)[NH3+] ZINC000423223415 388005498 /nfs/dbraw/zinc/00/54/98/388005498.db2.gz GJZZWAJRBRAWQS-SMDDNHRTSA-N 2 0 218.344 2.309 20 0 BEADRP Cc1cc([C@H](C)[NH2+]CC[C@H](C)[NH3+])cs1 ZINC000423224709 388006279 /nfs/dbraw/zinc/00/62/79/388006279.db2.gz JZRKQASIZZVULL-WPRPVWTQSA-N 2 0 212.362 2.444 20 0 BEADRP CC[NH+](CC)C[C@@H]1CC[N@H+](CC2CC2)C1 ZINC000156584834 388006343 /nfs/dbraw/zinc/00/63/43/388006343.db2.gz GKLVAASCEAXVPI-ZDUSSCGKSA-N 2 0 210.365 2.060 20 0 BEADRP COc1ccc(C)cc1[C@@H](C)[NH2+]CC[C@H](C)[NH3+] ZINC000423227154 388011154 /nfs/dbraw/zinc/01/11/54/388011154.db2.gz UQHSMTGOPIQNAI-NWDGAFQWSA-N 2 0 236.359 2.392 20 0 BEADRP CCC[C@H]([NH2+]CC[C@H](C)[NH3+])c1ccccn1 ZINC000423225512 388007032 /nfs/dbraw/zinc/00/70/32/388007032.db2.gz NBDAQEPPZJPJBW-RYUDHWBXSA-N 2 0 221.348 2.250 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@H]1CCc2cc(F)ccc21 ZINC000423224911 388007857 /nfs/dbraw/zinc/00/78/57/388007857.db2.gz KLKJCKFEVSHXDP-ZANVPECISA-N 2 0 222.307 2.140 20 0 BEADRP COc1ccc([C@@H](C)[NH2+]CC[C@H](C)[NH3+])cc1F ZINC000423226270 388009854 /nfs/dbraw/zinc/00/98/54/388009854.db2.gz QCAJBCWBMNEAPH-VHSXEESVSA-N 2 0 240.322 2.222 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@H]1CCC[C@@H]1CCCF ZINC000423227601 388010634 /nfs/dbraw/zinc/01/06/34/388010634.db2.gz WIEGCMDNNHYPJE-TUAOUCFPSA-N 2 0 216.344 2.232 20 0 BEADRP COc1ccc([C@H](C)[NH2+]CC[C@@H]2CC[NH2+]C2)cc1 ZINC000423240575 388024482 /nfs/dbraw/zinc/02/44/82/388024482.db2.gz CJOVUSZHBXRQHQ-STQMWFEESA-N 2 0 248.370 2.345 20 0 BEADRP Cc1ccncc1[C@@H](C)[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000423243538 388026244 /nfs/dbraw/zinc/02/62/44/388026244.db2.gz GLWJSLUVFVYBBL-CHWSQXEVSA-N 2 0 233.359 2.040 20 0 BEADRP c1cc2c(o1)CCC[C@@H]2[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000423241110 388025034 /nfs/dbraw/zinc/02/50/34/388025034.db2.gz DBBSIJVMQSGEJB-AAEUAGOBSA-N 2 0 234.343 2.246 20 0 BEADRP Cc1ccsc1[C@H](C)[NH2+]CC[C@H](C)[NH3+] ZINC000423242644 388025634 /nfs/dbraw/zinc/02/56/34/388025634.db2.gz ZELDGTAMJIAXNH-UWVGGRQHSA-N 2 0 212.362 2.444 20 0 BEADRP CC(=O)Nc1ccc([C@@H](C)[NH2+]CC[C@H](C)[NH3+])cc1 ZINC000423226901 388011308 /nfs/dbraw/zinc/01/13/08/388011308.db2.gz SRWMMBRYXZCAAG-WDEREUQCSA-N 2 0 249.358 2.033 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCC(F)(F)F)CC[N@@H+]1C ZINC000156617044 388011742 /nfs/dbraw/zinc/01/17/42/388011742.db2.gz WIHKDPFESIUBLM-RKDXNWHRSA-N 2 0 224.270 2.011 20 0 BEADRP COc1ccc([C@H](C)[NH2+]CC[C@H](C)[NH3+])c(C)c1 ZINC000423227448 388011834 /nfs/dbraw/zinc/01/18/34/388011834.db2.gz VVXFNZDJCQMGNV-RYUDHWBXSA-N 2 0 236.359 2.392 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+][C@H](C1CC1)C1CCC1 ZINC000423269836 388014128 /nfs/dbraw/zinc/01/41/28/388014128.db2.gz HQSLACDSTLUIBT-STQMWFEESA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H](CCCc1cccnc1)[NH2+]C[C@H]1CCC[NH2+]1 ZINC000423229770 388015285 /nfs/dbraw/zinc/01/52/85/388015285.db2.gz BZXUZKMIIFDCQQ-DZGCQCFKSA-N 2 0 247.386 2.134 20 0 BEADRP C[C@H](CCCc1cccnc1)[NH2+]C[C@@H]1CCC[NH2+]1 ZINC000423229771 388015633 /nfs/dbraw/zinc/01/56/33/388015633.db2.gz BZXUZKMIIFDCQQ-HIFRSBDPSA-N 2 0 247.386 2.134 20 0 BEADRP CC(C)(C)[C@@H]1CC[C@@H]1[NH2+]C[C@H]1CCC[NH2+]1 ZINC000423231149 388017007 /nfs/dbraw/zinc/01/70/07/388017007.db2.gz FUJKJUGEEOHOPV-UTUOFQBUSA-N 2 0 210.365 2.153 20 0 BEADRP COCC[C@H]1CCC[C@@H]1[NH2+]C1CCC([NH3+])CC1 ZINC000423233792 388018248 /nfs/dbraw/zinc/01/82/48/388018248.db2.gz OTZJWHLFTAECHE-RYSNWHEDSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@]12C[C@H]1CCC[C@H]2[NH2+]C1CCC([NH3+])CC1 ZINC000423234060 388018586 /nfs/dbraw/zinc/01/85/86/388018586.db2.gz PAAZOUICCANROV-DQRRXLOISA-N 2 0 222.376 2.425 20 0 BEADRP CCNCC[NH2+][C@@H]1CCC[C@@H](c2cccnc2)C1 ZINC000423234926 388018973 /nfs/dbraw/zinc/01/89/73/388018973.db2.gz MQSKXADAYFHGOX-UKRRQHHQSA-N 2 0 247.386 2.307 20 0 BEADRP Cc1cncc([C@H](C)[NH2+]CC[C@@H]2CC[NH2+]C2)c1 ZINC000423238443 388023051 /nfs/dbraw/zinc/02/30/51/388023051.db2.gz AJKYWOONZNVBRN-STQMWFEESA-N 2 0 233.359 2.040 20 0 BEADRP C(C[C@H]1CC[NH2+]C1)[NH2+]C1CCC2(CC2)CC1 ZINC000423249336 388032117 /nfs/dbraw/zinc/03/21/17/388032117.db2.gz ORTOSVMTADXVIS-GFCCVEGCSA-N 2 0 222.376 2.298 20 0 BEADRP COc1cccc([C@@H](C)[NH2+]CC[C@H]2CC[NH2+]C2)c1 ZINC000423250179 388032301 /nfs/dbraw/zinc/03/23/01/388032301.db2.gz PYCGCZCLLANNOM-CHWSQXEVSA-N 2 0 248.370 2.345 20 0 BEADRP CC[C@H]([NH2+]C[C@@H](C)C[NH+]1CCCC1)C1CC1 ZINC000083056512 388044389 /nfs/dbraw/zinc/04/43/89/388044389.db2.gz GOIMDCYUHFDILZ-OCCSQVGLSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1ccnc([C@H](C)[NH2+]CC[C@@H]2CCC[NH2+]C2)c1 ZINC000423256605 388037274 /nfs/dbraw/zinc/03/72/74/388037274.db2.gz CEFOUGZWQGGADI-KBPBESRZSA-N 2 0 247.386 2.430 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CCC[NH2+]C1)c1cncs1 ZINC000423256673 388037638 /nfs/dbraw/zinc/03/76/38/388037638.db2.gz FPYWLFXFKLUQNP-GHMZBOCLSA-N 2 0 239.388 2.183 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)c1cccc(O)c1 ZINC000423262076 388040897 /nfs/dbraw/zinc/04/08/97/388040897.db2.gz UFIFDLUSJGINLH-STQMWFEESA-N 2 0 248.370 2.433 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H](C)C[NH2+]C)C1CCCC1 ZINC000423266189 388043599 /nfs/dbraw/zinc/04/35/99/388043599.db2.gz CYYDSEWFJDRZNZ-WCQYABFASA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1cccc(O)c1 ZINC000423244175 388028406 /nfs/dbraw/zinc/02/84/06/388028406.db2.gz HJULLOHJBBONJR-NWDGAFQWSA-N 2 0 234.343 2.042 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CC[NH2+]C1)C1CCSCC1 ZINC000423245472 388028483 /nfs/dbraw/zinc/02/84/83/388028483.db2.gz IZYUDMRPJLMEBA-NWDGAFQWSA-N 2 0 242.432 2.107 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]C1CC(C)(F)C1 ZINC000453256542 388028597 /nfs/dbraw/zinc/02/85/97/388028597.db2.gz UFZLSYQEUJIYML-BFCCFQBASA-N 2 0 228.355 2.195 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+]Cc1ccc(Cl)cc1 ZINC000258869049 135135424 /nfs/dbraw/zinc/13/54/24/135135424.db2.gz ZMTOUDGYOWRXJB-VIFPVBQESA-N 2 0 212.724 2.024 20 0 BEADRP CCc1cccnc1[C@@H](C)[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000423248747 388031170 /nfs/dbraw/zinc/03/11/70/388031170.db2.gz NSFWFAOMQGTTNS-OLZOCXBDSA-N 2 0 247.386 2.294 20 0 BEADRP CC(C)(C)[C@@H]1CC[C@H]1[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000423249691 388031306 /nfs/dbraw/zinc/03/13/06/388031306.db2.gz PKWHXURPXJHPMG-JHJVBQTASA-N 2 0 224.392 2.400 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]C(C1CCC1)C1CCC1 ZINC000423273555 388053809 /nfs/dbraw/zinc/05/38/09/388053809.db2.gz LBTKAIPXGXMBJQ-NSHDSACASA-N 2 0 224.392 2.400 20 0 BEADRP CC(C)[C@@H]1C[C@H]1C[NH2+][C@H]1CC[N@H+](C)C[C@@H]1C ZINC000453350587 388054954 /nfs/dbraw/zinc/05/49/54/388054954.db2.gz LOJOATCZCYOPRJ-XUXIUFHCSA-N 2 0 224.392 2.208 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CCCNc2ccccc21 ZINC000423275166 388056900 /nfs/dbraw/zinc/05/69/00/388056900.db2.gz MRAPVGPWLNJPBI-SWLSCSKDSA-N 2 0 247.386 2.379 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H]1CCc2cc(F)ccc21 ZINC000423276428 388057385 /nfs/dbraw/zinc/05/73/85/388057385.db2.gz ONEATSGUNRDBQJ-HZMBPMFUSA-N 2 0 236.334 2.258 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+][C@H]1CCC12CCC2 ZINC000423275935 388057502 /nfs/dbraw/zinc/05/75/02/388057502.db2.gz MJFSUVQLOXKFAH-XQQFMLRXSA-N 2 0 222.376 2.426 20 0 BEADRP C([C@@H]1CCC[NH2+]C1)[N@@H+]1CCC[C@@H]2CCC[C@H]21 ZINC000083701088 388058879 /nfs/dbraw/zinc/05/88/79/388058879.db2.gz OKPGHPGGXNNHFU-HZSPNIEDSA-N 2 0 222.376 2.251 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H](C)c1ccc(OC)cc1 ZINC000423278155 388058898 /nfs/dbraw/zinc/05/88/98/388058898.db2.gz QPHNOPFKDYOYQV-NWDGAFQWSA-N 2 0 236.359 2.201 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H]1CCCC12CCC2 ZINC000423278846 388059485 /nfs/dbraw/zinc/05/94/85/388059485.db2.gz RRVRPTFNQCKTRO-NEPJUHHUSA-N 2 0 210.365 2.154 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H]1CCCC12CCC2 ZINC000423278849 388059907 /nfs/dbraw/zinc/05/99/07/388059907.db2.gz RRVRPTFNQCKTRO-VXGBXAGGSA-N 2 0 210.365 2.154 20 0 BEADRP CC[C@@H]([NH2+]C[C@H](C)C[NH2+]C)C(C)(C)C ZINC000423278204 388060124 /nfs/dbraw/zinc/06/01/24/388060124.db2.gz QUIOKXFBJHGOFH-GHMZBOCLSA-N 2 0 200.370 2.256 20 0 BEADRP CCC[C@@H]1CCC[C@H]1[NH2+]C[C@@H](C)C[NH2+]C ZINC000423279096 388060497 /nfs/dbraw/zinc/06/04/97/388060497.db2.gz RXNRSHAJPXJUJX-YNEHKIRRSA-N 2 0 212.381 2.400 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000423279402 388060687 /nfs/dbraw/zinc/06/06/87/388060687.db2.gz SJTPNYRPNRQNKX-JHJVBQTASA-N 2 0 210.365 2.154 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H](C)c1ccc2c(c1)COC2 ZINC000423279709 388061818 /nfs/dbraw/zinc/06/18/18/388061818.db2.gz SVGREXHXFJORHO-NEPJUHHUSA-N 2 0 248.370 2.223 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+][C@H]1CCCC[C@H]1C[NH3+] ZINC000423279566 388062150 /nfs/dbraw/zinc/06/21/50/388062150.db2.gz RNEYPUVCNWQOJC-XBFCOCLRSA-N 2 0 236.359 2.318 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]C[C@@H]1C[C@H]1C1CC1 ZINC000453382600 388065801 /nfs/dbraw/zinc/06/58/01/388065801.db2.gz ZGAWKLKUJCFQBH-NKQKNBIVSA-N 2 0 236.403 2.351 20 0 BEADRP CCOC[C@@H]1CCC[C@H]1[NH2+]CC([NH3+])(CC)CC ZINC000423283875 388067086 /nfs/dbraw/zinc/06/70/86/388067086.db2.gz FSSSKUXRIHJAOT-QWHCGFSZSA-N 2 0 242.407 2.299 20 0 BEADRP C[N@H+](CCCC[NH2+][C@H]1CCOC1(C)C)C1CC1 ZINC000453389462 388067329 /nfs/dbraw/zinc/06/73/29/388067329.db2.gz CMJNTMAWYWITKT-ZDUSSCGKSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@H]([NH2+][C@H]1CCCC[C@@H]1C[NH3+])[C@H]1C[C@H]1C ZINC000423285226 388068680 /nfs/dbraw/zinc/06/86/80/388068680.db2.gz YBASZRXTOPYMDA-FHUSYTEZSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCCC[N@H+](C)C2CC2)[C@@H]1C ZINC000453396858 388070845 /nfs/dbraw/zinc/07/08/45/388070845.db2.gz IWWWADXJWPERAL-BZPMIXESSA-N 2 0 224.392 2.495 20 0 BEADRP CCCCO[C@@H]1C[C@H]([NH2+]CC(C)(C)[NH3+])C1(C)C ZINC000423286397 388072028 /nfs/dbraw/zinc/07/20/28/388072028.db2.gz GZHYSRACNQBIMQ-NWDGAFQWSA-N 2 0 242.407 2.297 20 0 BEADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H](C)[C@H]2CCCO2)cc1 ZINC000423289863 388074354 /nfs/dbraw/zinc/07/43/54/388074354.db2.gz BUJLNSRDIPLSRM-SLEUVZQESA-N 2 0 248.370 2.363 20 0 BEADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@H]2C[C@@H](C)O[C@H]2C)cc1 ZINC000423289895 388074752 /nfs/dbraw/zinc/07/47/52/388074752.db2.gz BXUABONHVNKOKS-YXMPFFBPSA-N 2 0 248.370 2.362 20 0 BEADRP C[C@@H]([NH2+]CCCC[N@H+](C)C1CC1)[C@@H]1CCCO1 ZINC000453404810 388074846 /nfs/dbraw/zinc/07/48/46/388074846.db2.gz PYVSDSJOSBWNOL-OCCSQVGLSA-N 2 0 240.391 2.018 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]Cc1ccccc1F ZINC000084217781 388075030 /nfs/dbraw/zinc/07/50/30/388075030.db2.gz DNDLVQMIDTWDET-GXFFZTMASA-N 2 0 222.307 2.043 20 0 BEADRP CC[C@H]([NH2+]C[C@@H](C)C[NH3+])c1ccc(F)cc1 ZINC000423295543 388076936 /nfs/dbraw/zinc/07/69/36/388076936.db2.gz FCLNSQUVJFBLBR-GWCFXTLKSA-N 2 0 224.323 2.461 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H](C)c1ccc2ccccc2n1 ZINC000423294646 388077610 /nfs/dbraw/zinc/07/76/10/388077610.db2.gz CMXLWPJKSFMCJI-NEPJUHHUSA-N 2 0 243.354 2.480 20 0 BEADRP CC[C@@H]([NH2+]C[C@H](C)C[NH3+])c1ccc(F)cc1 ZINC000423295546 388077751 /nfs/dbraw/zinc/07/77/51/388077751.db2.gz FCLNSQUVJFBLBR-ZWNOBZJWSA-N 2 0 224.323 2.461 20 0 BEADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@H]2CCO[C@H](C)C2)cc1 ZINC000423295911 388078869 /nfs/dbraw/zinc/07/88/69/388078869.db2.gz XTTYTTZTOLTYAE-JMSVASOKSA-N 2 0 248.370 2.363 20 0 BEADRP Cc1ccc2c(c1)OCCC[C@H]2[NH2+]C[C@H](C)C[NH3+] ZINC000423298390 388079295 /nfs/dbraw/zinc/07/92/95/388079295.db2.gz OGAFVDWBLDBRED-TZMCWYRMSA-N 2 0 248.370 2.393 20 0 BEADRP Cc1nc2c(s1)[C@@H]([NH2+]C[C@@H](C)C[NH3+])CCC2 ZINC000423297515 388079561 /nfs/dbraw/zinc/07/95/61/388079561.db2.gz KPICBQODINCPCP-WPRPVWTQSA-N 2 0 239.388 2.013 20 0 BEADRP COc1ccc2c(c1)CCC[C@H]2[NH2+]C[C@@H](C)C[NH3+] ZINC000423297644 388080046 /nfs/dbraw/zinc/08/00/46/388080046.db2.gz LDDUONMPNRSWGX-XHDPSFHLSA-N 2 0 248.370 2.257 20 0 BEADRP CCC[C@@H]([NH2+]C[C@H](C)C[NH3+])c1cccnc1 ZINC000423298431 388080257 /nfs/dbraw/zinc/08/02/57/388080257.db2.gz AACGURXOQKDCDV-DGCLKSJQSA-N 2 0 221.348 2.107 20 0 BEADRP CCO[C@H]1C[C@H]([NH2+]CCCC[NH+](C)C)C1(C)C ZINC000085398156 388087167 /nfs/dbraw/zinc/08/71/67/388087167.db2.gz SMFXBJPMXQLNAL-STQMWFEESA-N 2 0 242.407 2.121 20 0 BEADRP CCO[C@H]1C[C@@H]([NH2+]CCCC[NH3+])C12CCCC2 ZINC000085679974 388094839 /nfs/dbraw/zinc/09/48/39/388094839.db2.gz VVOPJGPEZDUQSJ-OLZOCXBDSA-N 2 0 240.391 2.053 20 0 BEADRP Cc1ccccc1CN(C)C1(C[NH3+])CCC1 ZINC000086475014 388102472 /nfs/dbraw/zinc/10/24/72/388102472.db2.gz QPSSOWLTBHOKLH-UHFFFAOYSA-N 2 0 218.344 2.308 20 0 BEADRP C[C@@H]1CN(c2cc[nH+]c3ccccc32)[C@H](C)C[NH2+]1 ZINC000086471344 388103757 /nfs/dbraw/zinc/10/37/57/388103757.db2.gz MRUCMEQMCGIMFM-VXGBXAGGSA-N 2 0 241.338 2.421 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]CC2CC[NH2+]CC2)[C@@H]1C ZINC000086700264 388106645 /nfs/dbraw/zinc/10/66/45/388106645.db2.gz MZTMHQJBPGWXOD-YRGRVCCFSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H](Cc1cccs1)[NH2+]CC1CC[NH2+]CC1 ZINC000086700593 388107134 /nfs/dbraw/zinc/10/71/34/388107134.db2.gz XWLOZEAVKKLASW-NSHDSACASA-N 2 0 238.400 2.268 20 0 BEADRP C[C@@H](CCN[C@@H]1CC[NH2+]C1)c1ccccc1 ZINC000086729950 388108226 /nfs/dbraw/zinc/10/82/26/388108226.db2.gz BCXJVEYGINOXNH-GXTWGEPZSA-N 2 0 218.344 2.132 20 0 BEADRP Cc1[nH+]ccc(NCC(C)(C)[NH3+])c1Cl ZINC000261528243 135153533 /nfs/dbraw/zinc/15/35/33/135153533.db2.gz KOWBAOCYVOIGRP-UHFFFAOYSA-N 2 0 213.712 2.193 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CCC(C)(F)F)[C@H](C)C1 ZINC000449354690 388180085 /nfs/dbraw/zinc/18/00/85/388180085.db2.gz QMSZPVNBDOJOGQ-GHMZBOCLSA-N 2 0 234.334 2.352 20 0 BEADRP C[C@@H]1CN(C2CC2)C[C@H]1[NH2+]CCC(C)(F)F ZINC000449355258 388180958 /nfs/dbraw/zinc/18/09/58/388180958.db2.gz XIFFKZJFDSJSDQ-MWLCHTKSSA-N 2 0 232.318 2.104 20 0 BEADRP C[C@@H](Cc1ccoc1)[NH2+]CCCC[NH+](C)C ZINC000449108147 388143759 /nfs/dbraw/zinc/14/37/59/388143759.db2.gz SFYVASAWNAFHAA-LBPRGKRZSA-N 2 0 224.348 2.142 20 0 BEADRP CC/C=C\C[NH2+][C@@H]1CC[N@H+](CC)C[C@H]1C ZINC000449455706 388210479 /nfs/dbraw/zinc/21/04/79/388210479.db2.gz LOSYAEYVCHLIBI-ZSBJFDRYSA-N 2 0 210.365 2.273 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]Cc1ccnc2ccccc12 ZINC000518726585 256585705 /nfs/dbraw/zinc/58/57/05/256585705.db2.gz CMXGPZMWHQMEQD-GFCCVEGCSA-N 2 0 243.354 2.180 20 0 BEADRP CS[C@@H]1CC[N@H+](CCC[NH+]2CCCCC2)C1 ZINC000451328759 388263178 /nfs/dbraw/zinc/26/31/78/388263178.db2.gz VSIFKVBLQJSJIP-CYBMUJFWSA-N 2 0 242.432 2.300 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H]1C[C@H](OC)C1(C)C ZINC000451491155 388277446 /nfs/dbraw/zinc/27/74/46/388277446.db2.gz ILQPVIXFVSZTAH-STQMWFEESA-N 2 0 242.407 2.121 20 0 BEADRP CC1(C[NH2+][C@H]2CCC[C@H]([NH3+])C2)CCCC1 ZINC000086404241 388348573 /nfs/dbraw/zinc/34/85/73/388348573.db2.gz JWTCIMSZIBUOQC-RYUDHWBXSA-N 2 0 210.365 2.426 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+]CC(C(C)C)C(C)C ZINC000234711559 388359109 /nfs/dbraw/zinc/35/91/09/388359109.db2.gz LNCGOGOUYODECR-CYBMUJFWSA-N 2 0 244.423 2.258 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@H]1CS[C@H](C)C1 ZINC000300369670 388362499 /nfs/dbraw/zinc/36/24/99/388362499.db2.gz ZQSKJOLMSWIVDA-VXGBXAGGSA-N 2 0 230.421 2.200 20 0 BEADRP C[C@H](C[NH3+])N[C@@H](C)c1ccccc1Cl ZINC000235459436 388369151 /nfs/dbraw/zinc/36/91/51/388369151.db2.gz OMQLTOPIIIIVIW-BDAKNGLRSA-N 2 0 212.724 2.338 20 0 BEADRP Cc1ncccc1C[NH2+]Cc1ccc(C[NH3+])cc1 ZINC000572879745 388382927 /nfs/dbraw/zinc/38/29/27/388382927.db2.gz UXEVQPROGSAVIX-UHFFFAOYSA-N 2 0 241.338 2.139 20 0 BEADRP CCOCCCC[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@@H]1C ZINC000165111202 388391590 /nfs/dbraw/zinc/39/15/90/388391590.db2.gz DMWNNKBDYCGZJE-BFHYXJOUSA-N 2 0 242.407 2.121 20 0 BEADRP CCN(CC[NH3+])Cc1cc(F)cc(Cl)c1 ZINC000300769079 388392491 /nfs/dbraw/zinc/39/24/91/388392491.db2.gz CJCOCRDVASLGGL-UHFFFAOYSA-N 2 0 230.714 2.260 20 0 BEADRP C[C@@H]1C[C@@H]([NH3+])CC[N@@H+]1C[C@@H]1CCC(F)(F)C1 ZINC000300997950 388397660 /nfs/dbraw/zinc/39/76/60/388397660.db2.gz VHKLEWWKLKSFKN-MXWKQRLJSA-N 2 0 232.318 2.233 20 0 BEADRP C[NH+](C)CCC1CC[NH+](CC2(F)CC2)CC1 ZINC000525977555 388440118 /nfs/dbraw/zinc/44/01/18/388440118.db2.gz VKWOTJWSLKJVHC-UHFFFAOYSA-N 2 0 228.355 2.152 20 0 BEADRP Cc1c[nH+]ccc1NC1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000322754534 388445738 /nfs/dbraw/zinc/44/57/38/388445738.db2.gz XZDPXZVHHGHBKQ-YHWZYXNKSA-N 2 0 231.343 2.427 20 0 BEADRP Fc1ccc(C[N@H+]2CC[C@H]3C[NH2+]C[C@H]3CC2)cc1 ZINC000335266603 388449205 /nfs/dbraw/zinc/44/92/05/388449205.db2.gz BGQHORZDXZYPSZ-OKILXGFUSA-N 2 0 248.345 2.257 20 0 BEADRP Cc1ccc(C[N@@H+]2C[C@H](C[NH3+])[C@H](C)C[C@H]2C)nc1 ZINC000397264795 388455760 /nfs/dbraw/zinc/45/57/60/388455760.db2.gz IQWDKXVMOISJGX-MCIONIFRSA-N 2 0 247.386 2.195 20 0 BEADRP Cc1ccc(C[N@@H+]2C[C@H](C[NH3+])[C@@H](C)C[C@@H]2C)nc1 ZINC000397264793 388455912 /nfs/dbraw/zinc/45/59/12/388455912.db2.gz IQWDKXVMOISJGX-IHRRRGAJSA-N 2 0 247.386 2.195 20 0 BEADRP Cc1ccc(C[N@@H+]2C[C@H](C[NH3+])[C@H](C)C[C@H]2C)cn1 ZINC000397304641 388458055 /nfs/dbraw/zinc/45/80/55/388458055.db2.gz LYEUKELYWFBAQR-KYOSRNDESA-N 2 0 247.386 2.195 20 0 BEADRP CCN1CCC[C@H]1C[NH2+][C@@H]1CCC1(C)C ZINC000336703119 388465198 /nfs/dbraw/zinc/46/51/98/388465198.db2.gz QIJWIZOSUYZRHM-NWDGAFQWSA-N 2 0 210.365 2.249 20 0 BEADRP CCS[C@H]1CC[C@H]([N@H+](C)CCC[NH2+]C)C1 ZINC000336719421 388467568 /nfs/dbraw/zinc/46/75/68/388467568.db2.gz YEMQVQMZHDTJJW-RYUDHWBXSA-N 2 0 230.421 2.202 20 0 BEADRP CCc1cc(NCC[N@H+](C)C(C)C)cc[nH+]1 ZINC000307827449 388427333 /nfs/dbraw/zinc/42/73/33/388427333.db2.gz YAUQCKDZPAMNOQ-UHFFFAOYSA-N 2 0 221.348 2.396 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2C[C@H]([NH3+])C2(C)C)cc1 ZINC000404766170 388432531 /nfs/dbraw/zinc/43/25/31/388432531.db2.gz GJXZFKFUVPTGKD-STQMWFEESA-N 2 0 218.344 2.210 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1CC[N@H+](CC)C1)C1CCC1 ZINC000322367550 388432663 /nfs/dbraw/zinc/43/26/63/388432663.db2.gz ILUDRGCICOCQMY-JSGCOSHPSA-N 2 0 224.392 2.497 20 0 BEADRP COc1cccc2c1CCC[C@@H]2[NH2+]CCCC[NH3+] ZINC000517356211 388547886 /nfs/dbraw/zinc/54/78/86/388547886.db2.gz LKVLDQNQOXJXGS-AWEZNQCLSA-N 2 0 248.370 2.401 20 0 BEADRP CCC[C@H](C)CN1C[C@@H](F)C[C@H]1C[NH2+]C ZINC000378739824 388493357 /nfs/dbraw/zinc/49/33/57/388493357.db2.gz OOSQZBZMGFRFAJ-SRVKXCTJSA-N 2 0 216.344 2.054 20 0 BEADRP CCC[C@H]([NH2+]CCN(C)C)[C@@H]1CC1(C)C ZINC000397853327 388506456 /nfs/dbraw/zinc/50/64/56/388506456.db2.gz SMYDREKUJYQFCF-RYUDHWBXSA-N 2 0 212.381 2.352 20 0 BEADRP CCc1cc(N[C@@H](CC)C[NH+]2CCCC2)cc[nH+]1 ZINC000649279236 388507106 /nfs/dbraw/zinc/50/71/06/388507106.db2.gz ZXYMXBPYTSWHSU-AWEZNQCLSA-N 2 0 247.386 2.352 20 0 BEADRP C[C@@H]([NH2+]CCC[NH2+]C1CC1)[C@H]1CC1(C)C ZINC000397867828 388507566 /nfs/dbraw/zinc/50/75/66/388507566.db2.gz ZHGCHGBBQHNUBG-ZYHUDNBSSA-N 2 0 210.365 2.153 20 0 BEADRP CN(C)C1(C[NH2+]CC2CCCCC2)CC1 ZINC000397990887 388514798 /nfs/dbraw/zinc/51/47/98/388514798.db2.gz WZKOIAKAADHNNO-UHFFFAOYSA-N 2 0 210.365 2.251 20 0 BEADRP CC[C@@H]1CCC[C@@H](C[N@@H+]2CC[C@@H](C[NH3+])C2)C1 ZINC000347093878 388522202 /nfs/dbraw/zinc/52/22/02/388522202.db2.gz GUQGYRUDRCRMGF-MCIONIFRSA-N 2 0 224.392 2.483 20 0 BEADRP C[N@H+](CCC[NH3+])Cc1ccc2c(c1)CC(C)(C)O2 ZINC000516970370 388529342 /nfs/dbraw/zinc/52/93/42/388529342.db2.gz KRIZIDCIWVYNCI-UHFFFAOYSA-N 2 0 248.370 2.181 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@H]2CCC[C@H]2F)[C@@H]2CCC[C@@H]21 ZINC000550934148 388617101 /nfs/dbraw/zinc/61/71/01/388617101.db2.gz WVMNOXKPDVJCNZ-NDKCEZKHSA-N 2 0 240.366 2.339 20 0 BEADRP CO[C@H](C[N@@H+]1CC[C@@H]([NH3+])C[C@@H]1C)c1ccccc1 ZINC000379171135 388594683 /nfs/dbraw/zinc/59/46/83/388594683.db2.gz DIKNAXKSMCFXGE-NWANDNLSSA-N 2 0 248.370 2.186 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+]C[C@H]1CCCN1C ZINC000261536282 388551792 /nfs/dbraw/zinc/55/17/92/388551792.db2.gz RBFRUAUQEKSJRO-UPJWGTAASA-N 2 0 210.365 2.249 20 0 BEADRP Cc1ccccc1OCC[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000517588805 388555442 /nfs/dbraw/zinc/55/54/42/388555442.db2.gz SVARTAXHWJCBSQ-UONOGXRCSA-N 2 0 248.370 2.233 20 0 BEADRP CO[C@H](C[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21)C(C)C ZINC000362975012 388562261 /nfs/dbraw/zinc/56/22/61/388562261.db2.gz CZGUXIHUSHUSFI-RRFJBIMHSA-N 2 0 248.370 2.392 20 0 BEADRP CS[C@@H]1CC[N@H+](CC[C@H]2CCCC[NH+]2C)C1 ZINC000521192232 388564302 /nfs/dbraw/zinc/56/43/02/388564302.db2.gz OCILFBUQBHIHSM-CHWSQXEVSA-N 2 0 242.432 2.298 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH+](C)CCOC(C)C)[C@@H](C)C1 ZINC000245412691 388577526 /nfs/dbraw/zinc/57/75/26/388577526.db2.gz AVPLBWSBHOEOPB-KBPBESRZSA-N 2 0 242.407 2.074 20 0 BEADRP C[NH+](C)C1CC([NH2+]CC2CCCCC2)C1 ZINC000522014296 388674797 /nfs/dbraw/zinc/67/47/97/388674797.db2.gz NVIGGYRYEHFNOI-UHFFFAOYSA-N 2 0 210.365 2.249 20 0 BEADRP CC1(C)C[C@H]1C[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000538159273 388678915 /nfs/dbraw/zinc/67/89/15/388678915.db2.gz NOGVUAJXLDJPKQ-ZDUSSCGKSA-N 2 0 236.403 2.497 20 0 BEADRP CC[C@H](C)[NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1 ZINC000125895579 388681747 /nfs/dbraw/zinc/68/17/47/388681747.db2.gz ZCIVWZNNYHPMRO-STQMWFEESA-N 2 0 212.381 2.495 20 0 BEADRP CC[NH+]1CCC(CC[NH2+]Cc2cc[nH]c2)CC1 ZINC000086255191 388684073 /nfs/dbraw/zinc/68/40/73/388684073.db2.gz RXORAGZTELWIOV-UHFFFAOYSA-N 2 0 235.375 2.226 20 0 BEADRP C([NH2+][C@@H]1CC[NH2+]C12CCC2)C1CCCCC1 ZINC000530179352 388622475 /nfs/dbraw/zinc/62/24/75/388622475.db2.gz XDTBEIAFXLFSCR-CYBMUJFWSA-N 2 0 222.376 2.441 20 0 BEADRP C[C@@H]([NH3+])[C@H]1CCC[N@H+](CC2CC(C)(C)C2)C1 ZINC000530213071 388627830 /nfs/dbraw/zinc/62/78/30/388627830.db2.gz TTYLTTHMKOAKFU-YPMHNXCESA-N 2 0 224.392 2.482 20 0 BEADRP CC(C)C1CC([NH2+][C@@H]2CC[NH2+]C23CCC3)C1 ZINC000530215754 388629551 /nfs/dbraw/zinc/62/95/51/388629551.db2.gz IQLRPAJDBHAKLL-WXRRBKDZSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@@H]([NH2+]CC1CC=CC1)[C@@H]1CCCC[NH2+]1 ZINC000530217417 388630025 /nfs/dbraw/zinc/63/00/25/388630025.db2.gz STIMROBEFVYYAC-YPMHNXCESA-N 2 0 208.349 2.073 20 0 BEADRP CCC1(C[NH2+][C@@H]2C[C@@H](C)[N@H+](C)C[C@H]2C)CC1 ZINC000246324603 388630241 /nfs/dbraw/zinc/63/02/41/388630241.db2.gz FPZGULZXHNXWJL-JHJVBQTASA-N 2 0 224.392 2.495 20 0 BEADRP CC1(C)CC(C[N@@H+]2CC[C@@]3(CC[NH2+]C3)C2)C1 ZINC000530216448 388630681 /nfs/dbraw/zinc/63/06/81/388630681.db2.gz BMZWMFMJADVUKC-CQSZACIVSA-N 2 0 222.376 2.108 20 0 BEADRP CC[C@@H]1CCC[C@H]1[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000530221203 388632804 /nfs/dbraw/zinc/63/28/04/388632804.db2.gz OTNSCSGUROBYFI-JHJVBQTASA-N 2 0 222.376 2.439 20 0 BEADRP C[C@H]1C[C@@H](C[NH3+])C[N@@H+]1CC1CC(C)(C)C1 ZINC000530225157 388635081 /nfs/dbraw/zinc/63/50/81/388635081.db2.gz WUSFEQSWPMLIBB-QWRGUYRKSA-N 2 0 210.365 2.092 20 0 BEADRP C[C@@H]1CC(F)(F)CC[N@@H+]1CC[C@@H]1CC[NH2+]C1 ZINC000530233637 388636920 /nfs/dbraw/zinc/63/69/20/388636920.db2.gz ZJKAFZUQXFLUQI-MNOVXSKESA-N 2 0 232.318 2.106 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[NH2+]C12CCC2)C1CCC1 ZINC000530244972 388639080 /nfs/dbraw/zinc/63/90/80/388639080.db2.gz RLHLYPLSHTUOKB-JQWIXIFHSA-N 2 0 208.349 2.049 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH+](C)CC2CCC2)[C@@H](C)C1 ZINC000246487022 388639188 /nfs/dbraw/zinc/63/91/88/388639188.db2.gz IDHMLTMCCNZIHW-GXTWGEPZSA-N 2 0 224.392 2.449 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1)C1CC1 ZINC000251533355 388644689 /nfs/dbraw/zinc/64/46/89/388644689.db2.gz KKGABOSSRUNFIV-DOERSZECSA-N 2 0 222.376 2.295 20 0 BEADRP COc1cccnc1NCCCCn1ccnc1 ZINC000127979478 388734985 /nfs/dbraw/zinc/73/49/85/388734985.db2.gz PDSFAULUGLQPLR-UHFFFAOYSA-N 2 0 246.314 2.179 20 0 BEADRP CCCCOCCC[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000128011958 388736346 /nfs/dbraw/zinc/73/63/46/388736346.db2.gz WCAQOSVYICPHND-KGLIPLIRSA-N 2 0 242.407 2.266 20 0 BEADRP CC(C)[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CC[NH2+]C1 ZINC000251307754 388746555 /nfs/dbraw/zinc/74/65/55/388746555.db2.gz JHDLNWFINJHWCL-AVGNSLFASA-N 2 0 210.365 2.153 20 0 BEADRP CSC1(C[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)CC1 ZINC000248662958 388689577 /nfs/dbraw/zinc/68/95/77/388689577.db2.gz YWXLCAOYVKDYKP-RYUDHWBXSA-N 2 0 240.416 2.098 20 0 BEADRP C[C@@H](C[NH2+]Cc1ccccc1)Cn1ccnc1 ZINC000195251146 388702724 /nfs/dbraw/zinc/70/27/24/388702724.db2.gz UVZQXDIHWDRSHS-ZDUSSCGKSA-N 2 0 229.327 2.309 20 0 BEADRP COC[C@@H](C)C[NH2+]CCC[N@@H+]1CCCC[C@@H]1C ZINC000225690652 388726075 /nfs/dbraw/zinc/72/60/75/388726075.db2.gz NGGHXHZUPPIFAV-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP [NH3+]CCC[N@@H+](Cc1ccccc1)C[C@H]1CCCO1 ZINC000230001203 388809268 /nfs/dbraw/zinc/80/92/68/388809268.db2.gz PGKOEAXZHDIZHJ-OAHLLOKOSA-N 2 0 248.370 2.016 20 0 BEADRP C[C@@H]1C[C@H]([NH3+])CC[N@@H+]1CCCc1ccsc1 ZINC000565665150 388961289 /nfs/dbraw/zinc/96/12/89/388961289.db2.gz FWEXLQPMARMTTE-DGCLKSJQSA-N 2 0 238.400 2.492 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@@H]2CCCC[C@H]2F)C1 ZINC000565313660 388937237 /nfs/dbraw/zinc/93/72/37/388937237.db2.gz MNCABZDSHFMZSD-DDHJBXDOSA-N 2 0 214.328 2.127 20 0 BEADRP CCCCN(C)C[C@@H](C)[NH2+][C@@H]1CCOC[C@@H]1C ZINC000565510470 388949506 /nfs/dbraw/zinc/94/95/06/388949506.db2.gz FJISVXVKFYOBQT-BFHYXJOUSA-N 2 0 242.407 2.121 20 0 BEADRP CCCCN(C)C[C@@H](C)[NH2+][C@H]1CCOC[C@H]1C ZINC000565510476 388950467 /nfs/dbraw/zinc/95/04/67/388950467.db2.gz FJISVXVKFYOBQT-MCIONIFRSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)N[C@@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000566009784 388983361 /nfs/dbraw/zinc/98/33/61/388983361.db2.gz LPCWZMVINIWHGU-XDQVBPFNSA-N 2 0 241.423 2.013 20 0 BEADRP C[C@H]([NH2+]Cc1ccc(C[NH3+])cc1)[C@H]1C[C@H]1C ZINC000566068844 388984367 /nfs/dbraw/zinc/98/43/67/388984367.db2.gz GXWVCEJOQAPQIS-SUNKGSAMSA-N 2 0 218.344 2.279 20 0 BEADRP CC(C)[NH2+]CCC[NH2+][C@H]1CC[C@@H]1C1CC1 ZINC000566088402 388986574 /nfs/dbraw/zinc/98/65/74/388986574.db2.gz LNHOBSJHJZSYOP-OLZOCXBDSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]([NH2+]CC1(C2CC2)CCC1)[C@@H]1CCC[NH2+]1 ZINC000400359878 533357034 /nfs/dbraw/zinc/35/70/34/533357034.db2.gz PVOWQWDQDRHIGG-YPMHNXCESA-N 2 0 222.376 2.297 20 0 BEADRP C(C[N@@H+]1CC[C@@H]2[NH2+]CC[C@H]2C1)C1CCCC1 ZINC000261571344 533364227 /nfs/dbraw/zinc/36/42/27/533364227.db2.gz HMQJUTVSHNCZPV-KBPBESRZSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@@H]([NH2+]CC1CCCCC1)[C@H]1CCC[NH2+]1 ZINC000400635437 533367184 /nfs/dbraw/zinc/36/71/84/533367184.db2.gz MREBKPCYLHAFFX-DGCLKSJQSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C/C=C/c2ccncc2)CC[N@@H+]1C ZINC000487321406 533639438 /nfs/dbraw/zinc/63/94/38/533639438.db2.gz RMAGFDVJMFTMLE-LNMOPNHASA-N 2 0 245.370 2.167 20 0 BEADRP CC[NH+]1CCN(c2cc[nH+]c3ccccc32)CC1 ZINC000264664394 132178849 /nfs/dbraw/zinc/17/88/49/132178849.db2.gz RTKZGTWNIGECPB-UHFFFAOYSA-N 2 0 241.338 2.377 20 0 BEADRP C[NH2+]CCC1CCN(c2cc[nH+]cc2C)CC1 ZINC000070489757 132231178 /nfs/dbraw/zinc/23/11/78/132231178.db2.gz AULUXPDPMYUJOQ-UHFFFAOYSA-N 2 0 233.359 2.216 20 0 BEADRP CS[C@H](C)C[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000252951169 133652303 /nfs/dbraw/zinc/65/23/03/133652303.db2.gz DPCXQIVTHOEXAU-MROQNXINSA-N 2 0 242.432 2.248 20 0 BEADRP c1cnc2ccc(C[NH2+]C3CC[NH2+]CC3)cc2c1 ZINC000335278783 133823780 /nfs/dbraw/zinc/82/37/80/133823780.db2.gz PDKYXTRZLQMZMB-UHFFFAOYSA-N 2 0 241.338 2.076 20 0 BEADRP [NH3+]C1CCC([NH2+][C@@H]2CC[C@H]2C2CC2)CC1 ZINC000335498784 133867981 /nfs/dbraw/zinc/86/79/81/133867981.db2.gz VSXXVXZKONRONQ-IFWUJCSASA-N 2 0 208.349 2.035 20 0 BEADRP CC[NH+](CC)CCOCC[NH2+][C@@H](C)C(C)(C)C ZINC000349694238 133902717 /nfs/dbraw/zinc/90/27/17/133902717.db2.gz PAVURAXNBRYVMQ-ZDUSSCGKSA-N 2 0 244.423 2.369 20 0 BEADRP Cc1c[nH+]ccc1N1CCC[C@@H]([NH+]2CCCC2)C1 ZINC000336103250 134083971 /nfs/dbraw/zinc/08/39/71/134083971.db2.gz UBWSFIXTWYYXEH-CQSZACIVSA-N 2 0 245.370 2.455 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]CC1CCSCC1 ZINC000167691418 134154036 /nfs/dbraw/zinc/15/40/36/134154036.db2.gz NZWHJVMLTLSMDL-YPMHNXCESA-N 2 0 242.432 2.059 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CCC[NH2+]CC2)cc1 ZINC000168705877 134246456 /nfs/dbraw/zinc/24/64/56/134246456.db2.gz YGWSMDJAUFOYJS-CQSZACIVSA-N 2 0 218.344 2.227 20 0 BEADRP CC[C@@H](N[C@H]1CCC[NH2+]CC1)c1nccs1 ZINC000168758294 134248035 /nfs/dbraw/zinc/24/80/35/134248035.db2.gz VOEDVDKSIQNVFU-WDEREUQCSA-N 2 0 239.388 2.326 20 0 BEADRP CC[C@@H](C)[NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000178038464 134302500 /nfs/dbraw/zinc/30/25/00/134302500.db2.gz YQGKXZDJLNVYKF-MCIONIFRSA-N 2 0 242.407 2.264 20 0 BEADRP CC[C@@H](C)[NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000178038488 134302752 /nfs/dbraw/zinc/30/27/52/134302752.db2.gz YQGKXZDJLNVYKF-MGPQQGTHSA-N 2 0 242.407 2.264 20 0 BEADRP CC[C@H](C)[NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000178038476 134302805 /nfs/dbraw/zinc/30/28/05/134302805.db2.gz YQGKXZDJLNVYKF-MELADBBJSA-N 2 0 242.407 2.264 20 0 BEADRP C[C@@H](CC[NH3+])[NH2+]Cc1cccc(Cl)c1 ZINC000220482960 134305286 /nfs/dbraw/zinc/30/52/86/134305286.db2.gz HRENNMFHQNCNNC-VIFPVBQESA-N 2 0 212.724 2.167 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCN2CCCC[C@@H]12 ZINC000226363809 134364377 /nfs/dbraw/zinc/36/43/77/134364377.db2.gz OACOQGIYOAHRGI-RQJABVFESA-N 2 0 222.376 2.391 20 0 BEADRP C[C@H]1CCC[C@H]1[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000227327062 134378176 /nfs/dbraw/zinc/37/81/76/134378176.db2.gz AGHNBXYNPYNMAK-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]([NH2+]CC1(C)CC[NH+](C)CC1)C1CC1 ZINC000227498181 134381327 /nfs/dbraw/zinc/38/13/27/134381327.db2.gz RDEJPTBZDCLUBA-NSHDSACASA-N 2 0 210.365 2.106 20 0 BEADRP Cc1ccc([C@H](C)[N@H+](C)CCC[NH3+])cc1 ZINC000227745183 134391955 /nfs/dbraw/zinc/39/19/55/134391955.db2.gz CITFBEVLVPERFW-LBPRGKRZSA-N 2 0 206.333 2.337 20 0 BEADRP CC[C@@H]1CCC[C@@H]([NH2+][C@@H](CCC[NH3+])COC)C1 ZINC000233915384 134570993 /nfs/dbraw/zinc/57/09/93/134570993.db2.gz ZOFMYXVRKYZOLE-MCIONIFRSA-N 2 0 242.407 2.299 20 0 BEADRP CC[C@H](C)C[C@@H](C)[NH2+][C@@H](CCC[NH3+])COC ZINC000233984389 134571349 /nfs/dbraw/zinc/57/13/49/134571349.db2.gz JVNOBQFSYGXVFK-XQQFMLRXSA-N 2 0 230.396 2.155 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]Cc1ccc(Cl)s1 ZINC000086070740 134581427 /nfs/dbraw/zinc/58/14/27/134581427.db2.gz KMXLHWUIGZSBCN-MRVPVSSYSA-N 2 0 232.780 2.347 20 0 BEADRP CCC(CC)C[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000130451626 134619909 /nfs/dbraw/zinc/61/99/09/134619909.db2.gz RSNDADMTAPYEJP-ZDUSSCGKSA-N 2 0 212.381 2.402 20 0 BEADRP CC[C@@H]1CC[C@H]([NH2+]CC2CC[NH+](C)CC2)C1 ZINC000070643691 135001433 /nfs/dbraw/zinc/00/14/33/135001433.db2.gz KBWOQPWHNNAUAO-OCCSQVGLSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@H]1C)C1CC1 ZINC000249331243 135037158 /nfs/dbraw/zinc/03/71/58/135037158.db2.gz WUSBWJKUCHKNBM-PRULPYPASA-N 2 0 210.365 2.103 20 0 BEADRP Cc1c[nH+]ccc1N[C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000250877259 135060677 /nfs/dbraw/zinc/06/06/77/135060677.db2.gz QREUCTWCOMPDIR-STQMWFEESA-N 2 0 231.343 2.429 20 0 BEADRP CSCCC[NH2+][C@@H]1CCC[C@H]1[C@H]1CCC[NH2+]1 ZINC000250961996 135061201 /nfs/dbraw/zinc/06/12/01/135061201.db2.gz WXTWDRARRHDWTH-JHJVBQTASA-N 2 0 242.432 2.250 20 0 BEADRP COCC[C@H](C)[NH2+][C@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000251154559 135065159 /nfs/dbraw/zinc/06/51/59/135065159.db2.gz BFGHGHSGWPHYNT-BFHYXJOUSA-N 2 0 242.407 2.312 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)C1 ZINC000251685498 135074211 /nfs/dbraw/zinc/07/42/11/135074211.db2.gz AQBRMURSNBXWDD-JHJVBQTASA-N 2 0 222.376 2.249 20 0 BEADRP C[C@H]1C[N@H+](CCCOc2ccccc2)CC[C@H]1[NH3+] ZINC000251834925 135079113 /nfs/dbraw/zinc/07/91/13/135079113.db2.gz PXJBGWUEEMSGFT-DZGCQCFKSA-N 2 0 248.370 2.125 20 0 BEADRP CC(C)C[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000086494171 135086231 /nfs/dbraw/zinc/08/62/31/135086231.db2.gz FCUDGHZDYQXJOD-RWMBFGLXSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]1CCC[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000252219227 135088071 /nfs/dbraw/zinc/08/80/71/135088071.db2.gz YOQHIUQNLZTACV-APYLGABCSA-N 2 0 222.376 2.390 20 0 BEADRP C[C@H](C[C@H]1CCCCC[NH2+]1)[NH2+]C1CCC1 ZINC000086501049 135088271 /nfs/dbraw/zinc/08/82/71/135088271.db2.gz LCAUEIKESIDJIV-DGCLKSJQSA-N 2 0 210.365 2.439 20 0 BEADRP CCC[C@@H](C)C[N@H+](C)CC(C)(C)C[NH3+] ZINC000086637535 135091891 /nfs/dbraw/zinc/09/18/91/135091891.db2.gz DZZPIIIZJXTYJB-LLVKDONJSA-N 2 0 200.370 2.339 20 0 BEADRP C[C@H]1CC[C@@H]([N@H+](C)CC2CC[NH2+]CC2)C1 ZINC000086701595 135094291 /nfs/dbraw/zinc/09/42/91/135094291.db2.gz DRZJUWLMSHKWQF-WCQYABFASA-N 2 0 210.365 2.106 20 0 BEADRP C1CCC([NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)C1 ZINC000252675434 135095694 /nfs/dbraw/zinc/09/56/94/135095694.db2.gz ZTUBPWUGZCJWMQ-OLZOCXBDSA-N 2 0 208.349 2.145 20 0 BEADRP Cc1csc([C@@H](C)[NH2+]C2CCC([NH3+])CC2)n1 ZINC000086730389 135096061 /nfs/dbraw/zinc/09/60/61/135096061.db2.gz LBFAQWONSWFNNI-KPPDAEKUSA-N 2 0 239.388 2.372 20 0 BEADRP CO[C@H](C)[C@@H](C)[NH2+]CCC[N@@H+]1CCCC[C@H]1C ZINC000252711049 135099241 /nfs/dbraw/zinc/09/92/41/135099241.db2.gz IJROWCHYEGUBNK-MGPQQGTHSA-N 2 0 242.407 2.264 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]C[C@]1(C)CCCS1 ZINC000252717053 135102774 /nfs/dbraw/zinc/10/27/74/135102774.db2.gz ZQMWPIMOALWDCD-UPJWGTAASA-N 2 0 242.432 2.202 20 0 BEADRP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]CC1(C)CCC1 ZINC000252728925 135103496 /nfs/dbraw/zinc/10/34/96/135103496.db2.gz DKCLPCRMJLBEIG-NWDGAFQWSA-N 2 0 210.365 2.106 20 0 BEADRP Cc1ccsc1C[N@@H+](C)C1CC[NH2+]CC1 ZINC000259210577 135104093 /nfs/dbraw/zinc/10/40/93/135104093.db2.gz XDHBZMLDSBAHKD-UHFFFAOYSA-N 2 0 224.373 2.240 20 0 BEADRP CC(C)(C)CC[N@@H+]1CC[C@H]2[NH2+]CC[C@@H]2C1 ZINC000261537105 135108457 /nfs/dbraw/zinc/10/84/57/135108457.db2.gz UWSOULUHYKMPJQ-VXGBXAGGSA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)CC[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000252672694 135108726 /nfs/dbraw/zinc/10/87/26/135108726.db2.gz CFDIWLMPNAIRDQ-OLZOCXBDSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCCC[C@H]1C[NH3+])C1CCC1 ZINC000252981504 135118797 /nfs/dbraw/zinc/11/87/97/135118797.db2.gz RKPYDSVNVOOOGP-WCFLWFBJSA-N 2 0 210.365 2.282 20 0 BEADRP Cc1ccsc1C[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000087308682 135122136 /nfs/dbraw/zinc/12/21/36/135122136.db2.gz DCMLLIWHCXKKSE-WDEREUQCSA-N 2 0 224.373 2.416 20 0 BEADRP [NH3+]C[C@H]1CC[C@H](C[NH2+]C2CCCC2)CC1 ZINC000253128980 135122535 /nfs/dbraw/zinc/12/25/35/135122535.db2.gz NHMJSXNFPYENJY-HAQNSBGRSA-N 2 0 210.365 2.284 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)C1 ZINC000253278759 135125387 /nfs/dbraw/zinc/12/53/87/135125387.db2.gz JSPHJAIIQVNIML-PJIALRRASA-N 2 0 222.376 2.390 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)C1 ZINC000253278762 135125641 /nfs/dbraw/zinc/12/56/41/135125641.db2.gz JSPHJAIIQVNIML-YJBUHQLJSA-N 2 0 222.376 2.390 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@@H]2CCCC[C@H]2C[NH3+])C1 ZINC000253285779 135126011 /nfs/dbraw/zinc/12/60/11/135126011.db2.gz OAUJZIDOXZYVBN-MROQNXINSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)CC[N@@H+]1CCC[C@]2(CC[NH2+]C2)C1 ZINC000257641456 135137261 /nfs/dbraw/zinc/13/72/61/135137261.db2.gz BAOVWNMCWOKAGQ-CYBMUJFWSA-N 2 0 210.365 2.108 20 0 BEADRP C(C1CCCC1)[N@@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000257677583 135139188 /nfs/dbraw/zinc/13/91/88/135139188.db2.gz KCOTUYCIFPAZIO-UHFFFAOYSA-N 2 0 222.376 2.252 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@@]3(CC[NH2+]C3)C2)c(C)c1 ZINC000257686248 135139199 /nfs/dbraw/zinc/13/91/99/135139199.db2.gz MHJQGNBHBHBNPT-MRXNPFEDSA-N 2 0 244.382 2.489 20 0 BEADRP C[C@@H](c1ccccc1)[N@@H+]1CC[C@@]2(CC[NH2+]C2)C1 ZINC000257690568 135139531 /nfs/dbraw/zinc/13/95/31/135139531.db2.gz JBACJOGWDMWQSV-DZGCQCFKSA-N 2 0 230.355 2.433 20 0 BEADRP CCCC[NH+]1CCC([C@H]2CC[NH2+]C2)CC1 ZINC000259267182 135142686 /nfs/dbraw/zinc/14/26/86/135142686.db2.gz NKACCPKYROODCP-ZDUSSCGKSA-N 2 0 210.365 2.108 20 0 BEADRP C[NH2+]CCCN(C)Cc1ccc(SC)cc1 ZINC000087472220 135142868 /nfs/dbraw/zinc/14/28/68/135142868.db2.gz HISDMPOCLBBEJX-UHFFFAOYSA-N 2 0 238.400 2.450 20 0 BEADRP C[C@@H]1CCCC[C@H]1C[NH2+]C[C@@H]1CCC[NH2+]1 ZINC000261529822 135156700 /nfs/dbraw/zinc/15/67/00/135156700.db2.gz BMAPOBYHKKYUOD-AGIUHOORSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+]C1CCCCCC1 ZINC000261531027 135159193 /nfs/dbraw/zinc/15/91/93/135159193.db2.gz DXNOHFVBMYCCIG-DGCLKSJQSA-N 2 0 210.365 2.297 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000261531565 135160613 /nfs/dbraw/zinc/16/06/13/135160613.db2.gz HAZUMUGSLKMAEA-NEPJUHHUSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1C[C@H](C[NH3+])C[N@@H+]1CCC1CCCC1 ZINC000261531588 135160790 /nfs/dbraw/zinc/16/07/90/135160790.db2.gz HEGSHJVHWVDGEM-DGCLKSJQSA-N 2 0 210.365 2.236 20 0 BEADRP Cc1cccc(C[NH2+]C[C@@H]2CCC[NH2+]C2)c1 ZINC000087646158 135160849 /nfs/dbraw/zinc/16/08/49/135160849.db2.gz CHNILIVPNKWBLW-CQSZACIVSA-N 2 0 218.344 2.084 20 0 BEADRP CC(C)(C)CC[N@@H+]1C[C@@H]2CC[C@@H]([NH3+])[C@@H]2C1 ZINC000261532246 135162214 /nfs/dbraw/zinc/16/22/14/135162214.db2.gz JTHYWZKNPJBADQ-QJPTWQEYSA-N 2 0 210.365 2.092 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[NH2+]C[C@@H]1C)c1ccsc1 ZINC000261532226 135162328 /nfs/dbraw/zinc/16/23/28/135162328.db2.gz JRYRWXZGJWXDDE-NHCYSSNCSA-N 2 0 224.373 2.397 20 0 BEADRP C[C@@H]1C[C@@H](C[N@H+](C)CCC2CC2)CC[NH2+]1 ZINC000261533289 135164876 /nfs/dbraw/zinc/16/48/76/135164876.db2.gz KQAGFIPUOKFHDR-YPMHNXCESA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@@H]1C[N@H+](C[C@@H]2CC[NH2+][C@H](C)C2)CCS1 ZINC000261533414 135165244 /nfs/dbraw/zinc/16/52/44/135165244.db2.gz IHCGJTOYNRXHTN-JHJVBQTASA-N 2 0 242.432 2.202 20 0 BEADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+][C@H]1CCSC1 ZINC000261533917 135165910 /nfs/dbraw/zinc/16/59/10/135165910.db2.gz LFRXWXHHKJRCCX-AGIUHOORSA-N 2 0 242.432 2.392 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@H]2CCC(C)(C)C2)CC1 ZINC000087771472 135167396 /nfs/dbraw/zinc/16/73/96/135167396.db2.gz SLHNSDQZMROXKJ-ZDUSSCGKSA-N 2 0 224.392 2.497 20 0 BEADRP CC1(C)CC[C@@H]([NH2+]C2CCC([NH3+])CC2)C1 ZINC000087771636 135167408 /nfs/dbraw/zinc/16/74/08/135167408.db2.gz MBYYORGZCFCHMA-HTAVTVPLSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[NH2+]C[C@H]1C)c1cccs1 ZINC000261535070 135168665 /nfs/dbraw/zinc/16/86/65/135168665.db2.gz NRIIARWNIVDMOJ-VWYCJHECSA-N 2 0 224.373 2.397 20 0 BEADRP C[C@H](c1ccc(F)cc1)N1C[C@@H](C)[C@H]([NH3+])C1 ZINC000261535006 135169108 /nfs/dbraw/zinc/16/91/08/135169108.db2.gz VLYTXDAUVIBVIK-GIPNMCIBSA-N 2 0 222.307 2.166 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]1[NH2+]Cc1cccs1 ZINC000261537128 135173359 /nfs/dbraw/zinc/17/33/59/135173359.db2.gz UYKOSCKBDIZBRL-LLVKDONJSA-N 2 0 224.373 2.226 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]1[NH2+]CC1CCCC1 ZINC000261536871 135173563 /nfs/dbraw/zinc/17/35/63/135173563.db2.gz UBMYBWSHVTZFKD-LBPRGKRZSA-N 2 0 210.365 2.154 20 0 BEADRP CCC[C@@H]1C[C@@H]1[NH2+][C@@H]1CCCC[C@H]1C[NH3+] ZINC000261537910 135174825 /nfs/dbraw/zinc/17/48/25/135174825.db2.gz WQFKQQDPDDADMJ-XQHKEYJVSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1CCC[C@@H]1C[NH2+][C@@H]1CCC[C@H]1C[NH3+] ZINC000261538371 135175704 /nfs/dbraw/zinc/17/57/04/135175704.db2.gz XWFMTTYWDJUQSL-YVECIDJPSA-N 2 0 210.365 2.140 20 0 BEADRP CC(C)SCC[NH2+][C@@H]1CCCC[C@@H]1C[NH3+] ZINC000261538721 135176445 /nfs/dbraw/zinc/17/64/45/135176445.db2.gz ZBJRIAHAIQSIKJ-VXGBXAGGSA-N 2 0 230.421 2.235 20 0 BEADRP C[C@@H]1CC[C@@H](C)[N@H+](CC[C@@H]2CCC[NH2+]C2)C1 ZINC000084048149 135178900 /nfs/dbraw/zinc/17/89/00/135178900.db2.gz OURFWNYDKLTFAK-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP C([C@H]1CCC[NH2+]C1)[N@@H+]1CCCC12CCC2 ZINC000261548857 135187892 /nfs/dbraw/zinc/18/78/92/135187892.db2.gz NYSMREDTCMIVQB-LBPRGKRZSA-N 2 0 208.349 2.005 20 0 BEADRP CCS[C@@H]1CCCC[N@H+](CC(C)(C)[NH3+])C1 ZINC000261548640 135187949 /nfs/dbraw/zinc/18/79/49/135187949.db2.gz NSKKUGNIQROTIS-LLVKDONJSA-N 2 0 230.421 2.331 20 0 BEADRP Cc1ncsc1C[N@H+]1CCC[C@@H]([C@@H](C)[NH3+])C1 ZINC000084149536 135188452 /nfs/dbraw/zinc/18/84/52/135188452.db2.gz MYGYFDWLGYLNFM-MWLCHTKSSA-N 2 0 239.388 2.011 20 0 BEADRP C[C@H]1C[C@@H](C[N@H+]2C[C@@H]3CCCC[C@@H]3C2)CC[NH2+]1 ZINC000261550988 135190088 /nfs/dbraw/zinc/19/00/88/135190088.db2.gz LRQUZASCMFDBTJ-ZQDZILKHSA-N 2 0 236.403 2.497 20 0 BEADRP CC1CCC(C[N@@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@H]3C2)CC1 ZINC000261550951 135190431 /nfs/dbraw/zinc/19/04/31/135190431.db2.gz LQDLKCGVTBUCIF-QXRZNBQRSA-N 2 0 236.403 2.482 20 0 BEADRP CCC(C)(C)CC[NH+]1CCC(C[NH3+])CC1 ZINC000261552473 135191273 /nfs/dbraw/zinc/19/12/73/135191273.db2.gz RNEOBMLULJUKEF-UHFFFAOYSA-N 2 0 212.381 2.483 20 0 BEADRP Cc1ccc(C[N@@H+]2C[C@@H]3CC[C@H]([NH3+])[C@@H]3C2)c(C)c1 ZINC000261556317 135196063 /nfs/dbraw/zinc/19/60/63/135196063.db2.gz BWSNHHYCPGYUKB-XHSDSOJGSA-N 2 0 244.382 2.473 20 0 BEADRP C1CC2CCC1C[C@@H]2[NH2+][C@H]1CCC[NH2+]CC1 ZINC000261558905 135199418 /nfs/dbraw/zinc/19/94/18/135199418.db2.gz YQCDSFYXNNVSEG-HOAMVYINSA-N 2 0 222.376 2.297 20 0 BEADRP C1CC2CCC1C[C@@H]2[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000261558908 135199863 /nfs/dbraw/zinc/19/98/63/135199863.db2.gz YQCDSFYXNNVSEG-PQAZSJQKSA-N 2 0 222.376 2.297 20 0 BEADRP Cc1ccccc1C[N@@H+]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000261561709 135202904 /nfs/dbraw/zinc/20/29/04/135202904.db2.gz VRTWUIFDHCVLAI-UKRRQHHQSA-N 2 0 230.355 2.036 20 0 BEADRP C[C@@H]1C[C@@H](c2ccccc2F)N(CC[NH3+])C1 ZINC000261563801 135205318 /nfs/dbraw/zinc/20/53/18/135205318.db2.gz BZXIJBHHBIFYKN-MFKMUULPSA-N 2 0 222.307 2.167 20 0 BEADRP C[C@H]1[C@@H]([NH3+])CCN1Cc1coc2ccccc12 ZINC000261563683 135205474 /nfs/dbraw/zinc/20/54/74/135205474.db2.gz XDIKNKOHFXWATR-GWCFXTLKSA-N 2 0 230.311 2.354 20 0 BEADRP C[C@H]1C[C@H](c2ccccc2F)N(CC[NH3+])C1 ZINC000261563799 135205638 /nfs/dbraw/zinc/20/56/38/135205638.db2.gz BZXIJBHHBIFYKN-GXFFZTMASA-N 2 0 222.307 2.167 20 0 BEADRP COc1cccc([C@@H](C)[N@@H+]2CC[C@@](C)(C[NH3+])C2)c1 ZINC000261563962 135206323 /nfs/dbraw/zinc/20/63/23/135206323.db2.gz HDIKRDYLWVKQSC-DOMZBBRYSA-N 2 0 248.370 2.427 20 0 BEADRP Cc1ccc(F)cc1C[N@@H+]1C[C@@H]2CC[C@H]([NH3+])[C@@H]2C1 ZINC000261564735 135206754 /nfs/dbraw/zinc/20/67/54/135206754.db2.gz HLFFRXGXANSTNY-GLQYFDAESA-N 2 0 248.345 2.303 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+]C1C2CC3CC(C2)CC1C3 ZINC000261565145 135207132 /nfs/dbraw/zinc/20/71/32/135207132.db2.gz HQTBZGOZCRAUJH-NZYIEUEFSA-N 2 0 248.414 2.399 20 0 BEADRP Cc1ccccc1C[N@@H+]1C[C@@H]2CC[C@@H]([NH3+])[C@H]2C1 ZINC000261566584 135208958 /nfs/dbraw/zinc/20/89/58/135208958.db2.gz ZDDYZVFSBJPZBM-SOUVJXGZSA-N 2 0 230.355 2.164 20 0 BEADRP CC(C)([NH3+])C[NH2+][C@H]1CCCc2ccccc21 ZINC000261569401 135210941 /nfs/dbraw/zinc/21/09/41/135210941.db2.gz GHIUYKLNWUAXBK-ZDUSSCGKSA-N 2 0 218.344 2.391 20 0 BEADRP C[NH2+]C[C@H]1CC[N@H+](CC2CCCCCC2)C1 ZINC000084329946 135211267 /nfs/dbraw/zinc/21/12/67/135211267.db2.gz WMZGVHCKQCBDFF-CQSZACIVSA-N 2 0 224.392 2.498 20 0 BEADRP [NH3+]C1CC[NH+](CC2CCCCCC2)CC1 ZINC000084329915 135211383 /nfs/dbraw/zinc/21/13/83/135211383.db2.gz INQFAVVNLUMSGT-UHFFFAOYSA-N 2 0 210.365 2.380 20 0 BEADRP Cc1cccc(OCC[N@@H+]2CC[C@@](C)(C[NH3+])C2)c1 ZINC000261569772 135212456 /nfs/dbraw/zinc/21/24/56/135212456.db2.gz KAKIRISKHGLNAC-HNNXBMFYSA-N 2 0 248.370 2.045 20 0 BEADRP C(C[N@@H+]1CC[C@H]2[NH2+]CC[C@@H]2C1)C1CCCC1 ZINC000261571347 135212769 /nfs/dbraw/zinc/21/27/69/135212769.db2.gz HMQJUTVSHNCZPV-ZIAGYGMSSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@@H]([NH2+][C@H](c1ccccc1)C1CC1)[C@H](C)[NH3+] ZINC000261575860 135216830 /nfs/dbraw/zinc/21/68/30/135216830.db2.gz JYGOBQLFRJOGFS-MISXGVKJSA-N 2 0 218.344 2.463 20 0 BEADRP C[C@@H]1CCCC[C@H]1[N@H+](C)CC[C@@H]1CC[NH2+]C1 ZINC000084385442 135217958 /nfs/dbraw/zinc/21/79/58/135217958.db2.gz OTVUZVBOQLUANX-HZSPNIEDSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)C[N@H+](CC[C@@H]1CC[NH2+]C1)C(C)C ZINC000084385405 135218196 /nfs/dbraw/zinc/21/81/96/135218196.db2.gz KZRZTLCPRCZAAL-ZDUSSCGKSA-N 2 0 212.381 2.352 20 0 BEADRP CC(C)([NH3+])C[NH2+][C@H](c1ccccc1)C1CC1 ZINC000261576891 135218693 /nfs/dbraw/zinc/21/86/93/135218693.db2.gz KQTSOIRLNCHWLK-CYBMUJFWSA-N 2 0 218.344 2.465 20 0 BEADRP CC1CCC(C[NH2+][C@H]2CC[NH2+]C[C@@H]2C)CC1 ZINC000261582812 135224136 /nfs/dbraw/zinc/22/41/36/135224136.db2.gz OSIRHHWQUXRDMM-YIOUJQMASA-N 2 0 224.392 2.400 20 0 BEADRP CC(C)([NH3+])C[NH2+][C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000261584329 135225205 /nfs/dbraw/zinc/22/52/05/135225205.db2.gz PQBKTUVSYJDLDW-BDAKNGLRSA-N 2 0 238.297 2.434 20 0 BEADRP C[C@H]1C[NH2+]CC[C@@H]1[NH2+]Cc1ccc(Cl)cc1 ZINC000261585827 135226801 /nfs/dbraw/zinc/22/68/01/135226801.db2.gz QRASTWATVZZQRZ-GWCFXTLKSA-N 2 0 238.762 2.428 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+]Cc1ccc(Cl)cc1 ZINC000261585829 135226903 /nfs/dbraw/zinc/22/69/03/135226903.db2.gz QRASTWATVZZQRZ-MFKMUULPSA-N 2 0 238.762 2.428 20 0 BEADRP C[C@H]1CC[C@]2(CC[N@H+](CC(C)(C)[NH3+])C2)C1 ZINC000261589645 135230042 /nfs/dbraw/zinc/23/00/42/135230042.db2.gz UAABZOQFBFNGIW-AAEUAGOBSA-N 2 0 210.365 2.236 20 0 BEADRP Cc1cc(C)cc(C[N@@H+]2CC[C@@H]3[NH2+]CC[C@@H]3C2)c1 ZINC000261589785 135230355 /nfs/dbraw/zinc/23/03/55/135230355.db2.gz WMYTWLLGLFKGKP-CVEARBPZSA-N 2 0 244.382 2.487 20 0 BEADRP C[C@@H]1C[N@H+](CC(C)(C)[NH3+])[C@@H]2CCCC[C@@H]21 ZINC000261590904 135231278 /nfs/dbraw/zinc/23/12/78/135231278.db2.gz UVGLJFXHTIZQTK-IJLUTSLNSA-N 2 0 210.365 2.234 20 0 BEADRP Cc1ccc(F)c(C[N@@H+]2C[C@@H]3CC[C@H]([NH3+])[C@@H]3C2)c1 ZINC000261591018 135231874 /nfs/dbraw/zinc/23/18/74/135231874.db2.gz XJACCEMKZAKCRO-LNSITVRQSA-N 2 0 248.345 2.303 20 0 BEADRP C[C@@H]1CCC[C@H](C[N@H+](C)C2CC[NH2+]CC2)C1 ZINC000261592012 135232404 /nfs/dbraw/zinc/23/24/04/135232404.db2.gz VQTSRFLOSWNUPG-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1cc(C[N@@H+]2C[C@@H]3CC[C@H]([NH3+])[C@H]3C2)ccc1F ZINC000261592131 135232417 /nfs/dbraw/zinc/23/24/17/135232417.db2.gz YIEBXURHNIYXSA-YDHLFZDLSA-N 2 0 248.345 2.303 20 0 BEADRP Cc1cc(F)ccc1CC[NH2+]CC(C)(C)[NH3+] ZINC000261592003 135232735 /nfs/dbraw/zinc/23/27/35/135232735.db2.gz VQGYPHBESRHCKR-UHFFFAOYSA-N 2 0 224.323 2.004 20 0 BEADRP C(C1CCCCC1)[N@@H+]1CC[C@H]2[NH2+]CC[C@H]2C1 ZINC000261597533 135237039 /nfs/dbraw/zinc/23/70/39/135237039.db2.gz ZEUMRFFJIRUTRN-UONOGXRCSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[NH2+]C[C@H]1C)c1ccccc1 ZINC000261599707 135237479 /nfs/dbraw/zinc/23/74/79/135237479.db2.gz ZYJNXGDTPNCJHR-DYEKYZERSA-N 2 0 218.344 2.335 20 0 BEADRP C[C@@H]1CC[N@H+](CC2CC[NH2+]CC2)CC12CCC2 ZINC000261642216 135242890 /nfs/dbraw/zinc/24/28/90/135242890.db2.gz AHGYSNVKLMGUGY-CYBMUJFWSA-N 2 0 236.403 2.498 20 0 BEADRP COc1cc(C[N@@H+]2CC[C@@H]([C@@H](C)[NH3+])C2)ccc1C ZINC000261644287 135242945 /nfs/dbraw/zinc/24/29/45/135242945.db2.gz AMBUYKXAVCXQEB-TZMCWYRMSA-N 2 0 248.370 2.173 20 0 BEADRP C[C@H]1CCC[C@@H](CC[N@@H+]2CCC[NH2+]CC2)C1 ZINC000078806689 135243231 /nfs/dbraw/zinc/24/32/31/135243231.db2.gz WYCZOPFJAUQWGY-KBPBESRZSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@H]1CC2(CCC2)C[N@@H+]1C[C@@H]1CCC[NH2+]C1 ZINC000261749101 135250129 /nfs/dbraw/zinc/25/01/29/135250129.db2.gz LRJOZIXNYFPQDR-QWHCGFSZSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@@H]1CC2(CCC2)C[N@@H+]1C[C@H]1CCC[NH2+]C1 ZINC000261749100 135250184 /nfs/dbraw/zinc/25/01/84/135250184.db2.gz LRJOZIXNYFPQDR-OLZOCXBDSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@]1(C[NH3+])CC[N@@H+]([C@H]2CCc3ccc(F)cc32)C1 ZINC000261815871 135255444 /nfs/dbraw/zinc/25/54/44/135255444.db2.gz PCMFQBMUHYHXNT-LSDHHAIUSA-N 2 0 248.345 2.484 20 0 BEADRP Cn1cccc1[C@@H]1CCC[N@@H+]1C[C@]1(C)CC[NH2+]C1 ZINC000261867954 135258536 /nfs/dbraw/zinc/25/85/36/135258536.db2.gz OGEBFWIOUGWAFJ-LSDHHAIUSA-N 2 0 247.386 2.162 20 0 BEADRP CC(C)[C@@H]1CCC[N@H+](C[C@@H]2CCC[NH2+]C2)C1 ZINC000261982469 135269389 /nfs/dbraw/zinc/26/93/89/135269389.db2.gz RNYHWSMDDPKJTN-ZIAGYGMSSA-N 2 0 224.392 2.354 20 0 BEADRP CC(C)[C@H]1CCC[N@H+](C[C@@H]2CCC[NH2+]C2)C1 ZINC000261982464 135269966 /nfs/dbraw/zinc/26/99/66/135269966.db2.gz RNYHWSMDDPKJTN-KGLIPLIRSA-N 2 0 224.392 2.354 20 0 BEADRP C(C1CC[NH2+]CC1)[N@@H+]1CCCC2(CCC2)C1 ZINC000262003631 135271403 /nfs/dbraw/zinc/27/14/03/135271403.db2.gz UHFPTHRHTQHPBD-UHFFFAOYSA-N 2 0 222.376 2.252 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2CC[C@H]3CCC[C@H]32)CC[NH2+]1 ZINC000262013527 135272713 /nfs/dbraw/zinc/27/27/13/135272713.db2.gz UZPGLQJZOLKUSJ-AAVRWANBSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@]2(C)CC[NH2+]C2)C[C@@H](C)C1 ZINC000262018963 135272892 /nfs/dbraw/zinc/27/28/92/135272892.db2.gz MZAIOAJVQDWRDN-HZSPNIEDSA-N 2 0 224.392 2.354 20 0 BEADRP CC(C)C[C@@H]1CC[N@H+](C[C@@]2(C)CC[NH2+]C2)C1 ZINC000262149958 135282343 /nfs/dbraw/zinc/28/23/43/135282343.db2.gz ZVCRQDHQDAAVBI-KBPBESRZSA-N 2 0 224.392 2.354 20 0 BEADRP Cc1nccn1CC[N@H+]1CCC[C@@H](C)CC1 ZINC000334168193 135324289 /nfs/dbraw/zinc/32/42/89/135324289.db2.gz ALCFZQNYJBNXBH-GFCCVEGCSA-N 2 0 221.348 2.314 20 0 BEADRP CCC(CC)C[N@@H+]1C[C@H]2CCC[NH2+][C@H]2C1 ZINC000299893311 135381450 /nfs/dbraw/zinc/38/14/50/135381450.db2.gz KBMZFPYRLFLGLF-OLZOCXBDSA-N 2 0 210.365 2.106 20 0 BEADRP CCC[N@H+](C)C[C@H]1CC[NH+](CC2CCC2)C1 ZINC000081517052 135387091 /nfs/dbraw/zinc/38/70/91/135387091.db2.gz URSXZUDFLCDMCE-CQSZACIVSA-N 2 0 224.392 2.450 20 0 BEADRP CC[N@H+](CC1CC[NH2+]CC1)[C@@H](C)C(C)C ZINC000086701838 135495036 /nfs/dbraw/zinc/49/50/36/135495036.db2.gz UBJFXSYGIPQGHO-LBPRGKRZSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H]1CC([NH2+]CC2CC[NH2+]CC2)C[C@@H](C)C1 ZINC000086701327 135495104 /nfs/dbraw/zinc/49/51/04/135495104.db2.gz FOJDBSREJFFJFK-RYUDHWBXSA-N 2 0 224.392 2.400 20 0 BEADRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]CCc1cccc(F)c1 ZINC000089148167 135531455 /nfs/dbraw/zinc/53/14/55/135531455.db2.gz NHXDNWLPYGAZEF-OCCSQVGLSA-N 2 0 236.334 2.085 20 0 BEADRP Cc1cc(F)ccc1C[NH2+][C@@H]1CC[NH2+][C@H](C)C1 ZINC000334865320 135827624 /nfs/dbraw/zinc/82/76/24/135827624.db2.gz SIVQNLGDMOOZNW-BXUZGUMPSA-N 2 0 236.334 2.364 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]Cc1cccc(F)c1 ZINC000335010109 135865058 /nfs/dbraw/zinc/86/50/58/135865058.db2.gz NNVVDZIXKWMKLC-RISCZKNCSA-N 2 0 236.334 2.303 20 0 BEADRP Fc1ccc2c(c1)[C@H]([NH2+]C1CC[NH2+]CC1)CC2 ZINC000335042402 135872180 /nfs/dbraw/zinc/87/21/80/135872180.db2.gz LJKLXMDEOFYFHX-CQSZACIVSA-N 2 0 234.318 2.155 20 0 BEADRP CC1(C[NH2+][C@@H]2CCC23CCC3)CC[NH2+]CC1 ZINC000335021107 135879128 /nfs/dbraw/zinc/87/91/28/135879128.db2.gz BJVWVOYGZKVTKS-GFCCVEGCSA-N 2 0 222.376 2.298 20 0 BEADRP C[C@H]([NH3+])[C@H](C)[NH2+]C1CCC2(CCOCC2)CC1 ZINC000335160461 135923273 /nfs/dbraw/zinc/92/32/73/135923273.db2.gz XYDMRPAMZLZWKG-RYUDHWBXSA-N 2 0 240.391 2.051 20 0 BEADRP C[N@@H+]1CCC[C@H]1CC[NH+]1CCCC12CCC2 ZINC000335311880 136030042 /nfs/dbraw/zinc/03/00/42/136030042.db2.gz NYEDWNKQLHDRBK-ZDUSSCGKSA-N 2 0 222.376 2.489 20 0 BEADRP C[C@@H]1CN(C2CC2)C[C@@H]1[NH2+][C@@H]1CC[C@@H]1C1CC1 ZINC000348086566 136034715 /nfs/dbraw/zinc/03/47/15/136034715.db2.gz PWJOFWVDNJNBMT-QZKOUSHUSA-N 2 0 234.387 2.247 20 0 BEADRP CC(C)CC[N@@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC000335321077 136049842 /nfs/dbraw/zinc/04/98/42/136049842.db2.gz KMOFQYPFKBCJBA-CYBMUJFWSA-N 2 0 210.365 2.060 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@@H]2C[C@@H]2C(F)F)[C@H]2CCC[C@@H]21 ZINC000348253791 136057168 /nfs/dbraw/zinc/05/71/68/136057168.db2.gz FNDHLNSTAPQOMF-IIRVCBMXSA-N 2 0 244.329 2.102 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@@H]2C[C@@H]2C(F)F)[C@@H]2CCC[C@@H]21 ZINC000348253793 136057456 /nfs/dbraw/zinc/05/74/56/136057456.db2.gz FNDHLNSTAPQOMF-NGDQXYMTSA-N 2 0 244.329 2.102 20 0 BEADRP [NH3+]C1CCC([NH2+][C@@H]2CCC[C@@H](F)C2)CC1 ZINC000335385529 136088879 /nfs/dbraw/zinc/08/88/79/136088879.db2.gz LFINREFOZPWSIH-HBIQZDMRSA-N 2 0 214.328 2.127 20 0 BEADRP Cc1cnc([C@@H](C)[N@@H+]2CCC3(C2)CC[NH2+]CC3)o1 ZINC000335390832 136090705 /nfs/dbraw/zinc/09/07/05/136090705.db2.gz BDGUXKYCRQOTSI-GFCCVEGCSA-N 2 0 249.358 2.120 20 0 BEADRP c1ccc2c(c1)CCCC[C@@H]2[NH2+]CC1C[NH2+]C1 ZINC000335553021 136098624 /nfs/dbraw/zinc/09/86/24/136098624.db2.gz RWXNUWBFPJLTJG-HNNXBMFYSA-N 2 0 230.355 2.263 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C2CCC(C[NH3+])CC2)C1 ZINC000335567627 136108421 /nfs/dbraw/zinc/10/84/21/136108421.db2.gz MEMYPDZSIWWHDY-IKWCTNDRSA-N 2 0 210.365 2.282 20 0 BEADRP CC[C@@H](C)C[N@@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC000335571541 136109885 /nfs/dbraw/zinc/10/98/85/136109885.db2.gz FLVRDMSGMPPFBC-OLZOCXBDSA-N 2 0 210.365 2.060 20 0 BEADRP C[NH2+]C[C@@H]1C[C@H](F)CN1C[C@@H](C)CC(C)C ZINC000647540480 397782307 /nfs/dbraw/zinc/78/23/07/397782307.db2.gz UVBODJKEKBSTQW-AVGNSLFASA-N 2 0 230.371 2.300 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]C[C@@H]1CCCC[N@H+](C)C1 ZINC000624121270 397800792 /nfs/dbraw/zinc/80/07/92/397800792.db2.gz SBWSGUJIOLOLOM-JSGCOSHPSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+]Cc2cc[nH]c2)C1 ZINC000178828530 397849280 /nfs/dbraw/zinc/84/92/80/397849280.db2.gz HVHHOXYVTGGQBP-OAHLLOKOSA-N 2 0 249.402 2.472 20 0 BEADRP CC(C)=CCC[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000309101981 397851184 /nfs/dbraw/zinc/85/11/84/397851184.db2.gz GGCCJUQHYBKFPF-QWHCGFSZSA-N 2 0 210.365 2.415 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000388106822 397871678 /nfs/dbraw/zinc/87/16/78/397871678.db2.gz XVXHKKGSJKJTOS-RFGFWPKPSA-N 2 0 222.376 2.249 20 0 BEADRP CSCC[C@H](C)[N@H+](C)C[C@]1(C)CC[NH2+]C1 ZINC000156881998 397927209 /nfs/dbraw/zinc/92/72/09/397927209.db2.gz SHEVVPZFANWOON-NWDGAFQWSA-N 2 0 230.421 2.059 20 0 BEADRP Cc1occc1C[N@H+](C)CC1CC[NH+](C)CC1 ZINC000414381770 397919568 /nfs/dbraw/zinc/91/95/68/397919568.db2.gz MVDGZSOSNBFSPZ-UHFFFAOYSA-N 2 0 236.359 2.362 20 0 BEADRP CC[C@@](C)(C[N@H+](C)C[C@H]1CCC[NH+](C)C1)OC ZINC000637929434 398044231 /nfs/dbraw/zinc/04/42/31/398044231.db2.gz ADWHLXJXDRJUGB-KBPBESRZSA-N 2 0 242.407 2.075 20 0 BEADRP C[C@@H]([NH2+]CCC[NH+]1CCCC1)[C@@H]1CCCCO1 ZINC000383087825 397998393 /nfs/dbraw/zinc/99/83/93/397998393.db2.gz KPPLKLDYCSGGMG-KGLIPLIRSA-N 2 0 240.391 2.020 20 0 BEADRP CC(C)CCC[NH+]1CCC([C@H](C)[NH3+])CC1 ZINC000165033175 398002247 /nfs/dbraw/zinc/00/22/47/398002247.db2.gz ISIBBJSKJFVWPG-LBPRGKRZSA-N 2 0 212.381 2.482 20 0 BEADRP C(C1CCCC1)[N@@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1 ZINC000414777369 398035681 /nfs/dbraw/zinc/03/56/81/398035681.db2.gz IENQWQOEBYKJOS-CABCVRRESA-N 2 0 236.403 2.498 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+]C[C@@H]1CCC[C@@H](C)C1 ZINC000414792081 398038972 /nfs/dbraw/zinc/03/89/72/398038972.db2.gz IMQJEGDAABTTSW-UPJWGTAASA-N 2 0 212.381 2.386 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]Cc1c(C)cccc1C ZINC000414829414 398050618 /nfs/dbraw/zinc/05/06/18/398050618.db2.gz AQHSAKKFLFJNMU-LLVKDONJSA-N 2 0 220.360 2.249 20 0 BEADRP C[C@H](CC1CC1)[NH2+][C@H](C)[C@@H]1CCC[NH2+]C1 ZINC000414817723 398042609 /nfs/dbraw/zinc/04/26/09/398042609.db2.gz BOJPSUKBSUYLNT-NQBHXWOUSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)[C@@H]1CCC[C@H]1[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000414858848 398065704 /nfs/dbraw/zinc/06/57/04/398065704.db2.gz SPZPIOXXLOHYNH-MELADBBJSA-N 2 0 224.392 2.400 20 0 BEADRP Cc1cccc(C[NH2+][C@H](C)[C@H]2CCC[NH2+]C2)c1 ZINC000414857826 398065726 /nfs/dbraw/zinc/06/57/26/398065726.db2.gz QHCKKUWBHDJRTF-HIFRSBDPSA-N 2 0 232.371 2.473 20 0 BEADRP C[C@H]([NH2+]CCN(C)C)C1CCCCCC1 ZINC000088169177 398074707 /nfs/dbraw/zinc/07/47/07/398074707.db2.gz WKNHBARUWKCTLD-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H]([NH2+]CCN(C)C)C1CCCCCC1 ZINC000088169272 398074980 /nfs/dbraw/zinc/07/49/80/398074980.db2.gz WKNHBARUWKCTLD-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP CCC1CCC([NH2+]CC2([NH3+])CCC2)CC1 ZINC000414879537 398078773 /nfs/dbraw/zinc/07/87/73/398078773.db2.gz PTJRKJIDJYFINL-UHFFFAOYSA-N 2 0 210.365 2.426 20 0 BEADRP Cc1ccc(C[N@@H+](C)CC(C)(C)C[NH3+])s1 ZINC000086637125 398056383 /nfs/dbraw/zinc/05/63/83/398056383.db2.gz YSRJMGFMRAZIHD-UHFFFAOYSA-N 2 0 226.389 2.473 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@@H]([NH3+])c3ccccc32)[C@H](C)O1 ZINC000384635430 398100513 /nfs/dbraw/zinc/10/05/13/398100513.db2.gz RWCBCLWIBJTKBP-AVFNUOGKSA-N 2 0 246.354 2.287 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@@H]([NH3+])c3ccccc32)[C@@H](C)O1 ZINC000384635432 398100553 /nfs/dbraw/zinc/10/05/53/398100553.db2.gz RWCBCLWIBJTKBP-HGUIZCDCSA-N 2 0 246.354 2.287 20 0 BEADRP CC[C@@H]([NH2+]CCC[NH+](C)C)[C@@H]1CC1(C)C ZINC000397674528 398121253 /nfs/dbraw/zinc/12/12/53/398121253.db2.gz GSHPHXDCJJDEFW-NWDGAFQWSA-N 2 0 212.381 2.352 20 0 BEADRP CC[C@@H]1C[N@H+](CC2(C)CCC2)CC[C@H]1[NH3+] ZINC000389693482 398125483 /nfs/dbraw/zinc/12/54/83/398125483.db2.gz IFOAPNIPAXYCBQ-VXGBXAGGSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@@H](Cc1ccco1)[NH2+]CC(C)(C)C[NH+](C)C ZINC000062769475 1172779337 /nfs/dbraw/zinc/77/93/37/1172779337.db2.gz NFCLTUWUNOXDSX-LBPRGKRZSA-N 2 0 238.375 2.388 20 0 BEADRP C[C@H](Cc1ccco1)[NH2+]CC(C)(C)C[NH+](C)C ZINC000062769476 1172779647 /nfs/dbraw/zinc/77/96/47/1172779647.db2.gz NFCLTUWUNOXDSX-GFCCVEGCSA-N 2 0 238.375 2.388 20 0 BEADRP C[C@H](CCC1CC1)[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000398235355 322866817 /nfs/dbraw/zinc/86/68/17/322866817.db2.gz VVZGGBPBSMJANX-YPMHNXCESA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H]1C[C@H]1C[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000668782165 487528912 /nfs/dbraw/zinc/52/89/12/487528912.db2.gz AIDZUKLDTRDFCO-WFASDCNBSA-N 2 0 236.403 2.354 20 0 BEADRP CC(C)[NH2+]Cc1ccccc1OCC[NH+](C)C ZINC000033465875 167120103 /nfs/dbraw/zinc/12/01/03/167120103.db2.gz DCJWWWYRUYAWPB-UHFFFAOYSA-N 2 0 236.359 2.125 20 0 BEADRP COc1ccc(C[NH2+]CCCC[NH3+])c(Cl)c1 ZINC000258843110 322878782 /nfs/dbraw/zinc/87/87/82/322878782.db2.gz HBHXLANUTXSQMM-UHFFFAOYSA-N 2 0 242.750 2.177 20 0 BEADRP C[NH2+]CCC[N@H+](C)CCC(C)(C)C1CC1 ZINC000405944832 487585243 /nfs/dbraw/zinc/58/52/43/487585243.db2.gz BJIFPNBOTYWDQV-UHFFFAOYSA-N 2 0 212.381 2.354 20 0 BEADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+][C@@H]2CS[C@H](C)C2)C1 ZINC000086935458 487593552 /nfs/dbraw/zinc/59/35/52/487593552.db2.gz XNXSLOZZELLKER-AGIUHOORSA-N 2 0 242.432 2.200 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCC[C@@H]1C[NH3+])C(C)(C)C ZINC000162623017 487595747 /nfs/dbraw/zinc/59/57/47/487595747.db2.gz VYRIYRFLOCZPJD-UTUOFQBUSA-N 2 0 212.381 2.386 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCC[C@@H]1C[NH3+])C(C)(C)C ZINC000162622786 487595783 /nfs/dbraw/zinc/59/57/83/487595783.db2.gz VYRIYRFLOCZPJD-IJLUTSLNSA-N 2 0 212.381 2.386 20 0 BEADRP [NH3+]C[C@@H]1CC[N@H+](CC[C@@H]2CCc3ccccc32)C1 ZINC000662246138 409542017 /nfs/dbraw/zinc/54/20/17/409542017.db2.gz PUWOFEAAWOKKDJ-ZFWWWQNUSA-N 2 0 244.382 2.387 20 0 BEADRP CO[C@H](C[N@H+](C)CC(C)(C)C[NH3+])C1CCCC1 ZINC000662247903 409544093 /nfs/dbraw/zinc/54/40/93/409544093.db2.gz ODKGBZMWEAJDTE-CYBMUJFWSA-N 2 0 242.407 2.108 20 0 BEADRP C([C@H]1CCC[NH2+]C1)[N@@H+]1CCC[C@H](C2CCC2)C1 ZINC000662318401 409636628 /nfs/dbraw/zinc/63/66/28/409636628.db2.gz ZQUHWOWGAVSRIQ-ZFWWWQNUSA-N 2 0 236.403 2.498 20 0 BEADRP CC1([NH3+])CC[NH+](CCCC2CCC2)CC1 ZINC000662270021 409572164 /nfs/dbraw/zinc/57/21/64/409572164.db2.gz GQKIRGTXVQKZNP-UHFFFAOYSA-N 2 0 210.365 2.380 20 0 BEADRP CC[C@H](CC(F)F)C[N@@H+]1CC[C@](C)(C[NH3+])C1 ZINC000662272876 409578307 /nfs/dbraw/zinc/57/83/07/409578307.db2.gz JNKHIPRRSUWAOL-ZYHUDNBSSA-N 2 0 234.334 2.339 20 0 BEADRP C([C@@H]1CC[C@@H]2C[C@@H]2C1)[NH+]1CCC2(CC[NH2+]C2)CC1 ZINC000662273773 409582810 /nfs/dbraw/zinc/58/28/10/409582810.db2.gz OTCIOTPUUDHTCX-KFWWJZLASA-N 2 0 248.414 2.498 20 0 BEADRP CO[C@H](C[N@@H+]1CC[C@@H]([NH3+])C[C@H]1C)C1CCCC1 ZINC000662284285 409614368 /nfs/dbraw/zinc/61/43/68/409614368.db2.gz MJIRHMJSRGEEBY-MRVWCRGKSA-N 2 0 240.391 2.003 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H]2CCC[C@H]2[NH3+])c(C)c1 ZINC000259119731 409732259 /nfs/dbraw/zinc/73/22/59/409732259.db2.gz TVLDIYPECVUTCX-HUUCEWRRSA-N 2 0 232.371 2.315 20 0 BEADRP C[N@H+](Cc1ccsc1)[C@H]1CCC[NH2+]CC1 ZINC000082666688 409849322 /nfs/dbraw/zinc/84/93/22/409849322.db2.gz XBTOOQXNGAWESU-LBPRGKRZSA-N 2 0 224.373 2.322 20 0 BEADRP c1cc2c(c(C[NH2+]CC[C@H]3CC[NH2+]C3)c1)CCC2 ZINC000650703950 410334706 /nfs/dbraw/zinc/33/47/06/410334706.db2.gz ZIKZAEADSOXDOB-CYBMUJFWSA-N 2 0 244.382 2.265 20 0 BEADRP C[C@@H]1C[C@@H](C[NH3+])C[N@@H+]1Cc1cccc2c1CCC2 ZINC000650703185 410334854 /nfs/dbraw/zinc/33/48/54/410334854.db2.gz ORTMJTLUAYOFAR-OLZOCXBDSA-N 2 0 244.382 2.344 20 0 BEADRP [NH3+]C[C@@H]1CC[C@H]([NH2+]Cc2cccc3c2CCC3)C1 ZINC000650704032 410336311 /nfs/dbraw/zinc/33/63/11/410336311.db2.gz DBMOAMQBONXWCU-DOMZBBRYSA-N 2 0 244.382 2.392 20 0 BEADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+]Cc2cccc3c2CCC3)C1 ZINC000650704033 410336465 /nfs/dbraw/zinc/33/64/65/410336465.db2.gz DBMOAMQBONXWCU-IUODEOHRSA-N 2 0 244.382 2.392 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]Cc1cccc2c1CCC2 ZINC000650704296 410336628 /nfs/dbraw/zinc/33/66/28/410336628.db2.gz RSQRWMLHKAZJRZ-VXGBXAGGSA-N 2 0 232.371 2.391 20 0 BEADRP C[C@H]1CCCC[C@H]1[NH2+]CCC1(C[NH3+])CC1 ZINC000650713058 410345130 /nfs/dbraw/zinc/34/51/30/410345130.db2.gz CNSZOJCUEQZDJR-NWDGAFQWSA-N 2 0 210.365 2.284 20 0 BEADRP Cc1ccc(F)cc1C[NH2+]CCC1(C[NH3+])CC1 ZINC000650713505 410345167 /nfs/dbraw/zinc/34/51/67/410345167.db2.gz VBQBGDOIAUKULZ-UHFFFAOYSA-N 2 0 236.334 2.353 20 0 BEADRP CC(C)C[C@H](C)C[NH2+]CCC1(C[NH3+])CC1 ZINC000650713890 410345667 /nfs/dbraw/zinc/34/56/67/410345667.db2.gz IGGUTRQHEQIFOK-LBPRGKRZSA-N 2 0 212.381 2.387 20 0 BEADRP CC1(C)CC[C@H]([NH2+]CCC2(C[NH3+])CC2)C1 ZINC000650714164 410346595 /nfs/dbraw/zinc/34/65/95/410346595.db2.gz UKWKKGVHNFCNRP-NSHDSACASA-N 2 0 210.365 2.284 20 0 BEADRP C[C@@H](CCC(F)(F)F)[NH2+]CCC1(C[NH3+])CC1 ZINC000650714268 410348353 /nfs/dbraw/zinc/34/83/53/410348353.db2.gz XUGWNCYZPWNCQV-VIFPVBQESA-N 2 0 238.297 2.436 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]CCC2(C[NH3+])CC2)C1 ZINC000650713315 410351039 /nfs/dbraw/zinc/35/10/39/410351039.db2.gz OGSWNRHXQHKCHH-NEPJUHHUSA-N 2 0 210.365 2.284 20 0 BEADRP C[NH2+]Cc1ccccc1C[NH2+]C1CC(C)C1 ZINC000650720178 410358335 /nfs/dbraw/zinc/35/83/35/410358335.db2.gz HGKKSKHMNHONLG-UHFFFAOYSA-N 2 0 218.344 2.294 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2CC[C@]3(CC3(F)F)C2)CC[NH2+]1 ZINC000650725380 410360188 /nfs/dbraw/zinc/36/01/88/410360188.db2.gz ZJNLOTMJFQCMPU-UTUOFQBUSA-N 2 0 244.329 2.106 20 0 BEADRP Cc1ccccc1[C@@H]1C[C@H]1[NH2+][C@@H]1CCC[C@@H]1[NH3+] ZINC000650742323 410375447 /nfs/dbraw/zinc/37/54/47/410375447.db2.gz VWJOKSAXFZOFPW-BYNSBNAKSA-N 2 0 230.355 2.320 20 0 BEADRP CC(C)(C)C[C@@H]1C[C@H]1[NH2+][C@H]1CCC[C@H]1[NH3+] ZINC000650741961 410375581 /nfs/dbraw/zinc/37/55/81/410375581.db2.gz OOWQYITZTFDBKW-WHOHXGKFSA-N 2 0 210.365 2.281 20 0 BEADRP COc1ccccc1[C@H](C)[NH2+]CCC1(C[NH3+])CC1 ZINC000650742774 410378497 /nfs/dbraw/zinc/37/84/97/410378497.db2.gz DCUCKRXCEKKHHX-LBPRGKRZSA-N 2 0 248.370 2.475 20 0 BEADRP [NH3+]CC1(CC[NH2+][C@@H]2CCCc3occc32)CC1 ZINC000650746347 410383230 /nfs/dbraw/zinc/38/32/30/410383230.db2.gz ADNQZEMNCSYNAW-GFCCVEGCSA-N 2 0 234.343 2.376 20 0 BEADRP Cc1nc([C@H](C)[NH2+]CCC2(C[NH3+])CC2)cs1 ZINC000650748120 410386780 /nfs/dbraw/zinc/38/67/80/410386780.db2.gz NJFLWEQPWZUULW-VIFPVBQESA-N 2 0 239.388 2.231 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1CNc2ccccc2C1 ZINC000650748575 410390940 /nfs/dbraw/zinc/39/09/40/410390940.db2.gz XHEMYRCLIJZJEV-OCCSQVGLSA-N 2 0 247.386 2.130 20 0 BEADRP C[NH2+]Cc1ccccc1C[NH2+][C@H]1CCO[C@H](C)C1 ZINC000650757301 410404144 /nfs/dbraw/zinc/40/41/44/410404144.db2.gz UFWSULNAISQWTR-DOMZBBRYSA-N 2 0 248.370 2.063 20 0 BEADRP C[C@H]([NH2+]CCC1CC[NH2+]CC1)c1cscn1 ZINC000650763200 410411838 /nfs/dbraw/zinc/41/18/38/410411838.db2.gz UPIOTDRIYYIWSM-JTQLQIEISA-N 2 0 239.388 2.183 20 0 BEADRP CO[C@H](C[N@@H+]1CC[C@](C)(C[NH3+])C1)c1ccccc1 ZINC000393283938 410673686 /nfs/dbraw/zinc/67/36/86/410673686.db2.gz BRSKJNDFRBRNLL-HUUCEWRRSA-N 2 0 248.370 2.045 20 0 BEADRP CC(C)(C)C[N@@H+]1C[C@@H]2CCC[C@@H]([NH3+])[C@@H]2C1 ZINC000228533529 166580701 /nfs/dbraw/zinc/58/07/01/166580701.db2.gz WWFMSKPLNWUSJC-QJPTWQEYSA-N 2 0 210.365 2.092 20 0 BEADRP C[C@@H]1C[C@@H]([NH3+])CC[N@@H+]1Cc1cccc2c1CCC2 ZINC000653280255 410633904 /nfs/dbraw/zinc/63/39/04/410633904.db2.gz JFYJTMZPIDYIJT-DOMZBBRYSA-N 2 0 244.382 2.487 20 0 BEADRP c1cc(CC[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)co1 ZINC000665262933 410737888 /nfs/dbraw/zinc/73/78/88/410737888.db2.gz CGVJYZHFORFSGQ-ZNMIVQPWSA-N 2 0 248.370 2.332 20 0 BEADRP c1cc(CC[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)co1 ZINC000665262932 410737919 /nfs/dbraw/zinc/73/79/19/410737919.db2.gz CGVJYZHFORFSGQ-RRFJBIMHSA-N 2 0 248.370 2.332 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]CCCC2CCC2)C1 ZINC000665266707 410739776 /nfs/dbraw/zinc/73/97/76/410739776.db2.gz HYZIAWDGAPAJDF-STQMWFEESA-N 2 0 210.365 2.426 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H]1c1ccccc1)C1C[NH2+]C1 ZINC000665274043 410743096 /nfs/dbraw/zinc/74/30/96/410743096.db2.gz IOUFJCDYGLALBT-NILFDRSVSA-N 2 0 230.355 2.130 20 0 BEADRP Cc1ccncc1[C@@H](C)[NH2+]CC[C@@H]([NH3+])C(C)C ZINC000665281332 410758681 /nfs/dbraw/zinc/75/86/81/410758681.db2.gz ZSRCXCRUPXNQFQ-TZMCWYRMSA-N 2 0 235.375 2.414 20 0 BEADRP C[NH2+]C[C@H](C)[NH2+][C@H]1CCCc2ccccc2C1 ZINC000665297452 410819494 /nfs/dbraw/zinc/81/94/94/410819494.db2.gz GBDVKVGJBFUKKI-WFASDCNBSA-N 2 0 232.371 2.132 20 0 BEADRP CC(C)C[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000336763293 167002880 /nfs/dbraw/zinc/00/28/80/167002880.db2.gz OYKFUJGHZKGLLC-UHFFFAOYSA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)[NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1 ZINC000037482882 167101978 /nfs/dbraw/zinc/10/19/78/167101978.db2.gz OFUFOCDYQQHVQN-CYBMUJFWSA-N 2 0 212.381 2.497 20 0 BEADRP CC(C)[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC000022862431 167118905 /nfs/dbraw/zinc/11/89/05/167118905.db2.gz XPPFUZCMBSWWMT-UHFFFAOYSA-N 2 0 206.333 2.246 20 0 BEADRP CC(C)OCCC[N@H+](C)CCC[NH+]1CCCC1 ZINC000337274614 167208189 /nfs/dbraw/zinc/20/81/89/167208189.db2.gz PWGAJSKPCLWZKS-UHFFFAOYSA-N 2 0 242.407 2.219 20 0 BEADRP CC(C)Oc1cccc(C[N@@H+]2CC[C@@H](C[NH3+])C2)c1 ZINC000050245507 167304206 /nfs/dbraw/zinc/30/42/06/167304206.db2.gz IQNVEIYWDYYUNX-AWEZNQCLSA-N 2 0 248.370 2.254 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@H]([NH3+])C1)[C@H]1CC1(C)C ZINC000397837524 410936578 /nfs/dbraw/zinc/93/65/78/410936578.db2.gz SZYOVEOKBZXBAW-NNYUYHANSA-N 2 0 210.365 2.281 20 0 BEADRP CC(C)[C@@H](C)[NH2+]C[C@H](C)C[NH+]1CCCC1 ZINC000062077838 167382279 /nfs/dbraw/zinc/38/22/79/167382279.db2.gz LXJWVAASEMDHFG-QWHCGFSZSA-N 2 0 212.381 2.352 20 0 BEADRP CC[C@H]([NH2+][C@@H](C)C1CC[NH+](C)CC1)C(F)F ZINC000651364333 410953126 /nfs/dbraw/zinc/95/31/26/410953126.db2.gz HFOZFYUMZXOCTQ-ONGXEEELSA-N 2 0 234.334 2.350 20 0 BEADRP C[C@H](C[NH2+]C[C@H]1CCC[NH2+]C1)C(C)(C)C ZINC000162704304 487620076 /nfs/dbraw/zinc/62/00/76/487620076.db2.gz BRXXXKIFMIVWFQ-NEPJUHHUSA-N 2 0 212.381 2.258 20 0 BEADRP C[C@@H](c1ccncc1)[N@@H+]1CCC[C@H](CC[NH3+])C1 ZINC000070169532 411137196 /nfs/dbraw/zinc/13/71/96/411137196.db2.gz LNVKLPADSXMBRT-QWHCGFSZSA-N 2 0 233.359 2.203 20 0 BEADRP CCSCC[N@@H+]1C[C@H](C[NH3+])[C@@H](C)C[C@@H]1C ZINC000397298426 411143394 /nfs/dbraw/zinc/14/33/94/411143394.db2.gz CLOHBHRCMMEOEC-SRVKXCTJSA-N 2 0 230.421 2.045 20 0 BEADRP CC(C)C[N@H+](C)CCC[NH2+][C@H]1CSC[C@H]1C ZINC000651865230 411147624 /nfs/dbraw/zinc/14/76/24/411147624.db2.gz RDKCXAAOHKVTSR-OLZOCXBDSA-N 2 0 244.448 2.305 20 0 BEADRP CC(C)C[N@H+](C)CCC[NH2+]C[C@H]1CCSC1 ZINC000651865995 411147748 /nfs/dbraw/zinc/14/77/48/411147748.db2.gz PSALBMVCDLESEM-CYBMUJFWSA-N 2 0 244.448 2.307 20 0 BEADRP Cc1ccc(CNCCC[N@@H+](C)CC(C)C)nc1 ZINC000651865797 411148147 /nfs/dbraw/zinc/14/81/47/411148147.db2.gz IDWNAYPRIXWKGW-UHFFFAOYSA-N 2 0 249.402 2.458 20 0 BEADRP CC(C)CC[N@H+](C[C@H]1CC[NH2+]C1)C1CC1 ZINC000111239054 411163953 /nfs/dbraw/zinc/16/39/53/411163953.db2.gz REJACYIQMQUKGZ-LBPRGKRZSA-N 2 0 210.365 2.106 20 0 BEADRP CC1([NH3+])CC[NH+](CCC2CCCC2)CC1 ZINC000309507049 411156289 /nfs/dbraw/zinc/15/62/89/411156289.db2.gz WFMFYPBHTWVMMK-UHFFFAOYSA-N 2 0 210.365 2.380 20 0 BEADRP C[C@@H]([NH3+])C[N@@H+]1CCC[C@@H]1CC1CCCC1 ZINC000655949010 411161687 /nfs/dbraw/zinc/16/16/87/411161687.db2.gz KFEUEVRXIMYWLY-DGCLKSJQSA-N 2 0 210.365 2.378 20 0 BEADRP C[C@@H]([NH3+])C1CC[NH+]([C@H](C)c2ccncc2)CC1 ZINC000110643841 411113256 /nfs/dbraw/zinc/11/32/56/411113256.db2.gz OOFAFFHNQDKINQ-VXGBXAGGSA-N 2 0 233.359 2.202 20 0 BEADRP CC[C@]1(C)CCC[C@H]1[NH2+]CCOCC[NH+](C)C ZINC000652192599 411168444 /nfs/dbraw/zinc/16/84/44/411168444.db2.gz GDEMGRBUIHOPFH-ZIAGYGMSSA-N 2 0 242.407 2.123 20 0 BEADRP C1=C(C[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)CCCC1 ZINC000401003408 411168713 /nfs/dbraw/zinc/16/87/13/411168713.db2.gz AINFASIROIJZHX-RBSFLKMASA-N 2 0 234.387 2.465 20 0 BEADRP c1ccc(CC[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)cc1 ZINC000401036493 411173136 /nfs/dbraw/zinc/17/31/36/411173136.db2.gz ZCYSZCNTZSEVKD-BZUAXINKSA-N 2 0 244.382 2.207 20 0 BEADRP Fc1cccc(C[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)c1 ZINC000401079162 411176809 /nfs/dbraw/zinc/17/68/09/411176809.db2.gz QGNJIKCVTASXTH-VNHYZAJKSA-N 2 0 248.345 2.303 20 0 BEADRP c1csc(C[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)c1 ZINC000401071190 411177099 /nfs/dbraw/zinc/17/70/99/411177099.db2.gz NCFASXAHJZENGW-SDDRHHMPSA-N 2 0 236.384 2.226 20 0 BEADRP Cc1ccoc1C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000401120730 411177637 /nfs/dbraw/zinc/17/76/37/411177637.db2.gz JINJAUSTJQXHJH-JHJVBQTASA-N 2 0 234.343 2.066 20 0 BEADRP c1cc(C[NH2+]C2CCCC2)c2c(c1)C[NH2+]CC2 ZINC000123913043 411180400 /nfs/dbraw/zinc/18/04/00/411180400.db2.gz UHTBDTXBGAIGBY-UHFFFAOYSA-N 2 0 230.355 2.365 20 0 BEADRP CCC(CC)[N@H+](C[C@H]1CC[NH2+]C1)C1CC1 ZINC000310035436 411195258 /nfs/dbraw/zinc/19/52/58/411195258.db2.gz TYJGDFKUSZDNHQ-NSHDSACASA-N 2 0 210.365 2.249 20 0 BEADRP COC[C@H](CC(C)(C)C)[NH2+][C@H]1CCC[NH2+]CC1 ZINC000656193733 411199295 /nfs/dbraw/zinc/19/92/95/411199295.db2.gz QSLCSFGWEBBFLN-STQMWFEESA-N 2 0 242.407 2.169 20 0 BEADRP COC[C@H](CC(C)(C)C)[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000656193276 411200100 /nfs/dbraw/zinc/20/01/00/411200100.db2.gz DCFBXLKMKGVBHJ-AGIUHOORSA-N 2 0 242.407 2.297 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCC[C@H]([NH3+])C1)c1ccncc1 ZINC000656197196 411203143 /nfs/dbraw/zinc/20/31/43/411203143.db2.gz MSSTVDNJGTXELP-XBFCOCLRSA-N 2 0 233.359 2.045 20 0 BEADRP CC[C@H]([NH2+][C@H](C)C[C@H](C)[NH3+])[C@@H]1CCCCO1 ZINC000656201602 411205836 /nfs/dbraw/zinc/20/58/36/411205836.db2.gz SGONCTAFQAEJFN-RNJOBUHISA-N 2 0 228.380 2.050 20 0 BEADRP CC[C@H]([NH2+][C@H](C)C[C@@H](C)[NH3+])[C@@H]1CCCCO1 ZINC000656201600 411206810 /nfs/dbraw/zinc/20/68/10/411206810.db2.gz SGONCTAFQAEJFN-NDBYEHHHSA-N 2 0 228.380 2.050 20 0 BEADRP CCCC[N@@H+]1CCC[C@H]([C@H]2C[C@H]([NH3+])CCO2)C1 ZINC000652346351 411209298 /nfs/dbraw/zinc/20/92/98/411209298.db2.gz ZOZVRFAJZHSLEW-BFHYXJOUSA-N 2 0 240.391 2.005 20 0 BEADRP Cc1cc(N[C@@H]2CCC[N@@H+]3CCCC[C@@H]23)cc[nH+]1 ZINC000656226754 411212986 /nfs/dbraw/zinc/21/29/86/411212986.db2.gz OAWJTKRTNXJYQG-CABCVRRESA-N 2 0 245.370 2.241 20 0 BEADRP COCCCCC[N@@H+]1CCC[C@H](C)[C@@H]1CC[NH3+] ZINC000652355022 411214439 /nfs/dbraw/zinc/21/44/39/411214439.db2.gz MYTHCFBWJZHZNO-KBPBESRZSA-N 2 0 242.407 2.252 20 0 BEADRP Cc1nccc(N[C@@H]2CCC[N@@H+]3CCCC[C@@H]23)n1 ZINC000656226190 411215194 /nfs/dbraw/zinc/21/51/94/411215194.db2.gz LLZXDBHCPNDIMN-OLZOCXBDSA-N 2 0 246.358 2.214 20 0 BEADRP COCCCCC[N@@H+]1CCC[C@@H](C)[C@H]1CC[NH3+] ZINC000652355025 411215270 /nfs/dbraw/zinc/21/52/70/411215270.db2.gz MYTHCFBWJZHZNO-ZIAGYGMSSA-N 2 0 242.407 2.252 20 0 BEADRP C[C@H]1CCC[N@H+](Cc2cccc(N)c2)[C@@H]1CC[NH3+] ZINC000652356109 411215286 /nfs/dbraw/zinc/21/52/86/411215286.db2.gz SCDOEEXXZNIFLV-SWLSCSKDSA-N 2 0 247.386 2.218 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]C2CC(CF)(CF)C2)C1 ZINC000658048351 411217897 /nfs/dbraw/zinc/21/78/97/411217897.db2.gz VNTWAHDHOXFCOH-KLPPZKSPSA-N 2 0 246.345 2.004 20 0 BEADRP COCCCCC[NH2+][C@H]1CCCCC[C@H]1[NH3+] ZINC000422826944 411232846 /nfs/dbraw/zinc/23/28/46/411232846.db2.gz RPQNDQFHNJTEBA-OLZOCXBDSA-N 2 0 228.380 2.053 20 0 BEADRP Cc1nc([C@@H](C)[NH2+][C@@H](C)CCC[NH3+])cs1 ZINC000422883429 411233086 /nfs/dbraw/zinc/23/30/86/411233086.db2.gz BZNHQZSFVBYZER-DTWKUNHWSA-N 2 0 227.377 2.230 20 0 BEADRP COCCC1(C[NH2+][C@@H](C)C[C@H](C)[NH3+])CCCC1 ZINC000422884482 411233799 /nfs/dbraw/zinc/23/37/99/411233799.db2.gz DXKFNOUQVREURF-STQMWFEESA-N 2 0 242.407 2.299 20 0 BEADRP COCC[C@H](C)C[NH2+][C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000423173429 411236690 /nfs/dbraw/zinc/23/66/90/411236690.db2.gz YOQBHOOUKRDEHW-CQDKDKBSSA-N 2 0 248.370 2.393 20 0 BEADRP Cc1ccc(C[C@@H]([NH2+]CC2C[NH2+]C2)C2CC2)cc1 ZINC000423306723 411237940 /nfs/dbraw/zinc/23/79/40/411237940.db2.gz UJYLOPMWJQFMBL-MRXNPFEDSA-N 2 0 244.382 2.125 20 0 BEADRP CC1(C)[C@@H]([NH2+]CC2C[NH2+]C2)C[C@H]1c1ccccc1 ZINC000423306711 411238063 /nfs/dbraw/zinc/23/80/63/411238063.db2.gz UGPXSHLPFQSSGY-GJZGRUSLSA-N 2 0 244.382 2.378 20 0 BEADRP CC(C)CCC[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000400967885 411166376 /nfs/dbraw/zinc/16/63/76/411166376.db2.gz NYAFPSZNXWHXLQ-HZSPNIEDSA-N 2 0 224.392 2.400 20 0 BEADRP CC(C)[C@H](C)C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000400966513 411166695 /nfs/dbraw/zinc/16/66/95/411166695.db2.gz NJEBQCMTZAOHCV-XJFOESAGSA-N 2 0 224.392 2.256 20 0 BEADRP CC(C)(C)C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000400950687 411166747 /nfs/dbraw/zinc/16/67/47/411166747.db2.gz WSIAIMFTLBWUHO-IJLUTSLNSA-N 2 0 210.365 2.010 20 0 BEADRP CC(C)[C@@H](C)[NH2+][C@@H]1CCN(C(C)(C)C)C1 ZINC000658091079 411242194 /nfs/dbraw/zinc/24/21/94/411242194.db2.gz KTLYZRCSZTUTCP-VXGBXAGGSA-N 2 0 212.381 2.493 20 0 BEADRP CC1(C)C[C@@H]1C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000400978374 411167196 /nfs/dbraw/zinc/16/71/96/411167196.db2.gz QHKYPELXQYJHCX-FDYHWXHSSA-N 2 0 222.376 2.010 20 0 BEADRP CC[N@H+](CCCC1CC[NH2+]CC1)C1CC1 ZINC000050952529 411269566 /nfs/dbraw/zinc/26/95/66/411269566.db2.gz IIUBAYVSIIEAHG-UHFFFAOYSA-N 2 0 210.365 2.251 20 0 BEADRP C[N@H+](CCCC1CC[NH2+]CC1)CC1CC1 ZINC000050952824 411269775 /nfs/dbraw/zinc/26/97/75/411269775.db2.gz VUOKGNZHMSJSBD-UHFFFAOYSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+]CCC2CC[NH2+]CC2)C1 ZINC000129417674 411284067 /nfs/dbraw/zinc/28/40/67/411284067.db2.gz QWSNTJRAVYOGRX-WCQYABFASA-N 2 0 210.365 2.154 20 0 BEADRP CCC[NH2+]CCN[C@H](C)Cc1cccs1 ZINC000643515265 411285380 /nfs/dbraw/zinc/28/53/80/411285380.db2.gz ZJPWDAXMBZNEJP-LLVKDONJSA-N 2 0 226.389 2.268 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CCc2ccoc2)[C@H]2CCC[C@H]21 ZINC000658196219 411289120 /nfs/dbraw/zinc/28/91/20/411289120.db2.gz CQPRCVRMHQQWNK-QLFBSQMISA-N 2 0 248.370 2.285 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CCc2ccoc2)[C@@H]2CCC[C@@H]21 ZINC000658196217 411289214 /nfs/dbraw/zinc/28/92/14/411289214.db2.gz CQPRCVRMHQQWNK-KKUMJFAQSA-N 2 0 248.370 2.285 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CCc2ccoc2)[C@H](C)C1 ZINC000658202202 411291447 /nfs/dbraw/zinc/29/14/47/411291447.db2.gz VGODWZBLQMKEJB-TZMCWYRMSA-N 2 0 236.359 2.142 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@H]2CCC[C@@H](C)O2)CC1 ZINC000658222934 411302046 /nfs/dbraw/zinc/30/20/46/411302046.db2.gz YSVTXOAIFXPLRQ-TZMCWYRMSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@@H]([NH2+][C@]1(C)CC1(C)C)C1CC[NH+](C)CC1 ZINC000658309055 411330759 /nfs/dbraw/zinc/33/07/59/411330759.db2.gz SJWYWWTYNIGMTH-BXUZGUMPSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H]([NH2+][C@]1(C)CC1(C)C)C1CC[NH+](C)CC1 ZINC000658309060 411330935 /nfs/dbraw/zinc/33/09/35/411330935.db2.gz SJWYWWTYNIGMTH-SMDDNHRTSA-N 2 0 224.392 2.495 20 0 BEADRP CC1(C)CC[NH+](CC[C@H]2CCC[NH2+]C2)CC1 ZINC000061820125 167920632 /nfs/dbraw/zinc/92/06/32/167920632.db2.gz IIESEQXVOZFCRS-CYBMUJFWSA-N 2 0 224.392 2.498 20 0 BEADRP C[NH+](C)C1CC[NH+](CCC2CCC2)CC1 ZINC000659839327 411321642 /nfs/dbraw/zinc/32/16/42/411321642.db2.gz UVCJRDFWUOFRDL-UHFFFAOYSA-N 2 0 210.365 2.203 20 0 BEADRP C(=C\C[N@@H+]1CC[C@@H]2C[C@@H]2C1)\C[NH+]1CC[C@@H]2C[C@@H]2C1 ZINC000661965873 411332703 /nfs/dbraw/zinc/33/27/03/411332703.db2.gz BIVCCUWRKBJAHY-RANSTAHOSA-N 2 0 246.398 2.226 20 0 BEADRP CC[N@H+](C[C@H](O)C[NH+](C)C(C)C)[C@H](C)C(C)C ZINC000659858239 411349335 /nfs/dbraw/zinc/34/93/35/411349335.db2.gz WAPHEKKIELVHOZ-ZIAGYGMSSA-N 2 0 244.423 2.054 20 0 BEADRP C[C@H](C[NH2+]C1CCC([NH3+])CC1)c1ccccn1 ZINC000656783049 411359982 /nfs/dbraw/zinc/35/99/82/411359982.db2.gz MTUPHMTXHOWGJB-PNESKVBLSA-N 2 0 233.359 2.045 20 0 BEADRP CC(C)C[C@H]([NH3+])C[NH2+]C[C@H](C)c1ccccn1 ZINC000656782377 411360175 /nfs/dbraw/zinc/36/01/75/411360175.db2.gz FNWIXUNADCMYQH-STQMWFEESA-N 2 0 235.375 2.148 20 0 BEADRP C(C1CC1)[NH+]1CCC([C@@H]2CCC[NH2+]C2)CC1 ZINC000656785901 411364199 /nfs/dbraw/zinc/36/41/99/411364199.db2.gz MZCAOADUHREXTF-CQSZACIVSA-N 2 0 222.376 2.108 20 0 BEADRP Cc1ccc2c(c1)C[N@@H+](C[C@]1(C)CC[NH2+]C1)CC2 ZINC000656787375 411365441 /nfs/dbraw/zinc/36/54/41/411365441.db2.gz JRMNPHCDQRAALW-MRXNPFEDSA-N 2 0 244.382 2.353 20 0 BEADRP C(C1CC[NH2+]CC1)[NH+]1CCC(C2CCC2)CC1 ZINC000656787614 411366165 /nfs/dbraw/zinc/36/61/65/411366165.db2.gz PCYWMANNSNKGSC-UHFFFAOYSA-N 2 0 236.403 2.498 20 0 BEADRP CCCC[C@H]1CCC[C@@H]1[NH2+][C@H]1CC[NH2+]C1 ZINC000656788008 411367533 /nfs/dbraw/zinc/36/75/33/411367533.db2.gz HYVASTXUDFQHRO-AVGNSLFASA-N 2 0 210.365 2.297 20 0 BEADRP CCCC[C@H]1CCC[C@H]1[NH2+][C@H]1CC[NH2+]C1 ZINC000656788009 411368020 /nfs/dbraw/zinc/36/80/20/411368020.db2.gz HYVASTXUDFQHRO-RWMBFGLXSA-N 2 0 210.365 2.297 20 0 BEADRP FCC[C@@H]1CCC[N@H+](CC2CC[NH2+]CC2)C1 ZINC000656791806 411372398 /nfs/dbraw/zinc/37/23/98/411372398.db2.gz KHGRUQIYHTUUFF-LBPRGKRZSA-N 2 0 228.355 2.058 20 0 BEADRP CC1(C[N@H+]2CC[C@H]3C[NH2+]C[C@H]3CC2)CCC1 ZINC000335255492 168026615 /nfs/dbraw/zinc/02/66/15/168026615.db2.gz MWSXORCYBVWQML-BETUJISGSA-N 2 0 222.376 2.108 20 0 BEADRP CC1(C[NH2+]Cc2cccs2)CC[NH2+]CC1 ZINC000062841746 168044513 /nfs/dbraw/zinc/04/45/13/168044513.db2.gz NSGAXOVYZAUUIS-UHFFFAOYSA-N 2 0 224.373 2.227 20 0 BEADRP CC1=C[C@@H](C)C[C@@H](C[NH2+]CCn2ccnc2)C1 ZINC000235702594 168123649 /nfs/dbraw/zinc/12/36/49/168123649.db2.gz VHALYSGAMYYOEY-TZMCWYRMSA-N 2 0 233.359 2.465 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CC[N@H+](CC2CCC(C)CC2)C1 ZINC000227204920 168153546 /nfs/dbraw/zinc/15/35/46/168153546.db2.gz CMCMKDNEIOXJQH-GNRIBBGQSA-N 2 0 224.392 2.482 20 0 BEADRP CC1CCC([NH2+]C[C@@H]2CC[N@H+](C)C2)CC1 ZINC000037484609 168162473 /nfs/dbraw/zinc/16/24/73/168162473.db2.gz SSUBDPAHIUDIND-CPCZMJQVSA-N 2 0 210.365 2.106 20 0 BEADRP CC1CCC([NH2+]C[C@@H]2CCC[N@H+](C)C2)CC1 ZINC000044535152 168162974 /nfs/dbraw/zinc/16/29/74/168162974.db2.gz VTGWZOJOEVFGBP-MOKVOYLWSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)[NH2+]CCCC[NH+]1CCC(C)CC1 ZINC000037482860 168179339 /nfs/dbraw/zinc/17/93/39/168179339.db2.gz RCFKEIQEXFSUPS-UHFFFAOYSA-N 2 0 212.381 2.497 20 0 BEADRP Cc1cccnc1C[N@H+]1CCC[C@@H](C)[C@H]1CC[NH3+] ZINC000404286480 411388974 /nfs/dbraw/zinc/38/89/74/411388974.db2.gz IFRGYDIYQKEJGH-UKRRQHHQSA-N 2 0 247.386 2.339 20 0 BEADRP CC[C@H]1C[C@@H]([NH2+]CC(C)(C)C[NH+](C)C)CCO1 ZINC000070343397 411389321 /nfs/dbraw/zinc/38/93/21/411389321.db2.gz KLCHLWWGZSBVCS-STQMWFEESA-N 2 0 242.407 2.121 20 0 BEADRP C[NH+](C)CC(C)(C)C[NH2+][C@@H]1CCOC(C)(C)C1 ZINC000070343392 411389532 /nfs/dbraw/zinc/38/95/32/411389532.db2.gz UCNONAAIXFYNGV-GFCCVEGCSA-N 2 0 242.407 2.121 20 0 BEADRP CC(C)CC[N@@H+]1CCC[C@@H](C)[C@H]1CC[NH3+] ZINC000404321810 411390931 /nfs/dbraw/zinc/39/09/31/411390931.db2.gz RFYCWGKIGNNWMX-CHWSQXEVSA-N 2 0 212.381 2.482 20 0 BEADRP CC[C@H]1C[C@@H]([NH2+]CCC[NH+](CC)CC)CCO1 ZINC000070344709 411391647 /nfs/dbraw/zinc/39/16/47/411391647.db2.gz DJJDPTRXGMARQR-KBPBESRZSA-N 2 0 242.407 2.266 20 0 BEADRP CCC(C)(C)CC[N@@H+]1CC[C@@]2(CC[NH2+]C2)C1 ZINC000360566199 168275965 /nfs/dbraw/zinc/27/59/65/168275965.db2.gz XWDARNGXPADGLW-CQSZACIVSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@H]1C[C@@H]1C[NH2+]Cc1ccnn1-c1cc[nH+]cc1 ZINC000657309805 411459353 /nfs/dbraw/zinc/45/93/53/411459353.db2.gz IDRKWEROVVIYHI-NWDGAFQWSA-N 2 0 242.326 2.013 20 0 BEADRP C[C@H]1CCC[N@H+](CC2CCC2)[C@@H]1CC[NH3+] ZINC000404392556 411393185 /nfs/dbraw/zinc/39/31/85/411393185.db2.gz YWNJMKYYKWIFNA-WCQYABFASA-N 2 0 210.365 2.236 20 0 BEADRP C[C@H](Cc1cccs1)[NH2+]CCC[NH2+]C1CC1 ZINC000382552156 411408831 /nfs/dbraw/zinc/40/88/31/411408831.db2.gz WVLWICMIDJJFPW-LLVKDONJSA-N 2 0 238.400 2.411 20 0 BEADRP CN(C)c1cccc([C@H]2CCC[N@@H+]2CCC[NH3+])c1 ZINC000414705058 411441069 /nfs/dbraw/zinc/44/10/69/411441069.db2.gz NGIIABVTPOTMQP-OAHLLOKOSA-N 2 0 247.386 2.238 20 0 BEADRP C[C@H](CCc1cccc(F)c1)[NH2+]CC[C@H](C)[NH3+] ZINC000414824671 411448842 /nfs/dbraw/zinc/44/88/42/411448842.db2.gz RFOWLTZWPSEECY-NWDGAFQWSA-N 2 0 238.350 2.474 20 0 BEADRP CC[N@H+](C[C@@H](O)C[NH+](C)C(C)C)[C@@H](C)C(C)C ZINC000659858236 411479835 /nfs/dbraw/zinc/47/98/35/411479835.db2.gz WAPHEKKIELVHOZ-KBPBESRZSA-N 2 0 244.423 2.054 20 0 BEADRP C[C@H](C[NH2+]C1CC[NH2+]CC1)Cc1cccs1 ZINC000415089037 411490824 /nfs/dbraw/zinc/49/08/24/411490824.db2.gz XDFRKALVVPICBF-NSHDSACASA-N 2 0 238.400 2.268 20 0 BEADRP CC1(C)CC[C@H]([NH2+]CC2CC[NH2+]CC2)C1 ZINC000128597035 411493456 /nfs/dbraw/zinc/49/34/56/411493456.db2.gz ADKPNAFFJRKMBI-LBPRGKRZSA-N 2 0 210.365 2.154 20 0 BEADRP C[N@H+](C[C@@H]1C[C@H]2C[C@H]2C1)CC1CC[NH+](C)CC1 ZINC000659918743 411498007 /nfs/dbraw/zinc/49/80/07/411498007.db2.gz FDKGYGSCRCHIAU-QDMKHBRRSA-N 2 0 236.403 2.306 20 0 BEADRP C[C@H]1CC[C@H]([NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)CS1 ZINC000655802679 411518515 /nfs/dbraw/zinc/51/85/15/411518515.db2.gz HIJHTYAWBLWDGZ-ZDEQEGDKSA-N 2 0 242.432 2.200 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H]2CCC2(C)C)C1 ZINC000655804423 411519381 /nfs/dbraw/zinc/51/93/81/411519381.db2.gz YLFZYJMLZOTEKG-GRYCIOLGSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)[C@@H]1CC1(C)C ZINC000655803940 411519663 /nfs/dbraw/zinc/51/96/63/411519663.db2.gz IWWIINXNMQPXGK-RVMXOQNASA-N 2 0 224.392 2.351 20 0 BEADRP CC[C@H]1CC[C@@H]1[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655804110 411519775 /nfs/dbraw/zinc/51/97/75/411519775.db2.gz PTIKRTWWBGKMFP-RVMXOQNASA-N 2 0 210.365 2.105 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655805821 411520730 /nfs/dbraw/zinc/52/07/30/411520730.db2.gz SSVLYVXIGXHENQ-MELADBBJSA-N 2 0 247.386 2.381 20 0 BEADRP CC[N@H+](C)C[C@@H]1CC[NH+](C[C@@H]2C[C@H]3C[C@H]3C2)C1 ZINC000659990232 411521562 /nfs/dbraw/zinc/52/15/62/411521562.db2.gz YYDFMZQWTGOARH-XQLPTFJDSA-N 2 0 236.403 2.306 20 0 BEADRP CC(C)C[C@@H](C)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655807418 411521692 /nfs/dbraw/zinc/52/16/92/411521692.db2.gz LLOVEXXIBDKMEM-UPJWGTAASA-N 2 0 212.381 2.351 20 0 BEADRP CCc1ccc(C[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)o1 ZINC000655826524 411529685 /nfs/dbraw/zinc/52/96/85/411529685.db2.gz HBMQWOKASNWKMC-TXEJJXNPSA-N 2 0 236.359 2.272 20 0 BEADRP CC[C@@H]1C[C@H]([NH2+]CCCC[N@H+](C)C2CC2)CO1 ZINC000657486953 411530785 /nfs/dbraw/zinc/53/07/85/411530785.db2.gz CZBANEWYWZJAPV-GXTWGEPZSA-N 2 0 240.391 2.018 20 0 BEADRP CC(C)[NH2+]C1CC[NH+](CC2CC=CC2)CC1 ZINC000660064566 411532293 /nfs/dbraw/zinc/53/22/93/411532293.db2.gz RORAVYARMZDPJG-UHFFFAOYSA-N 2 0 222.376 2.415 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(C)cc2)C1 ZINC000037643772 170007256 /nfs/dbraw/zinc/00/72/56/170007256.db2.gz XSLPMLYMGOCXFU-HNNXBMFYSA-N 2 0 232.371 2.426 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)C2(C)CC2)C1 ZINC000037484293 170007958 /nfs/dbraw/zinc/00/79/58/170007958.db2.gz PVVZWCUMLHUSID-RYUDHWBXSA-N 2 0 210.365 2.106 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2cccc(C)c2)C1 ZINC000037643774 170008735 /nfs/dbraw/zinc/00/87/35/170008735.db2.gz BYAAHDAHARGDLY-HNNXBMFYSA-N 2 0 232.371 2.426 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+]CC2(SC)CCC2)C1 ZINC000304244739 170015474 /nfs/dbraw/zinc/01/54/74/170015474.db2.gz FIXLCYHQUOAEPO-GFCCVEGCSA-N 2 0 242.432 2.204 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2cncc(C)c2)C1 ZINC000184285016 170017486 /nfs/dbraw/zinc/01/74/86/170017486.db2.gz UQXLZRBTYBDKIQ-UONOGXRCSA-N 2 0 247.386 2.382 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CC2(C(F)F)CC2)[C@H](C)C1 ZINC000355146722 170021009 /nfs/dbraw/zinc/02/10/09/170021009.db2.gz GTBURPPNQUIYEM-MNOVXSKESA-N 2 0 246.345 2.352 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H]2CSC2(C)C)[C@H](C)C1 ZINC000336779645 170021781 /nfs/dbraw/zinc/02/17/81/170021781.db2.gz PABRWJZNXNEKRN-GRYCIOLGSA-N 2 0 242.432 2.200 20 0 BEADRP CC[NH2+]CC1CC[NH+](Cc2ncccc2C)CC1 ZINC000161839286 170111775 /nfs/dbraw/zinc/11/17/75/170111775.db2.gz HYPWPMCWIIZBRI-UHFFFAOYSA-N 2 0 247.386 2.212 20 0 BEADRP CCOCC(C)(C)C[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000310183464 170352747 /nfs/dbraw/zinc/35/27/47/170352747.db2.gz ODYOOODAMDWANH-CHWSQXEVSA-N 2 0 242.407 2.121 20 0 BEADRP CC(C)(F)CC[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000657645276 411568604 /nfs/dbraw/zinc/56/86/04/411568604.db2.gz QEINEHCLXSVVHO-VXGBXAGGSA-N 2 0 228.355 2.341 20 0 BEADRP CC[N@@H+]1CCC[C@H]1CNc1[nH+]ccc2[nH]ccc21 ZINC000663319911 411623837 /nfs/dbraw/zinc/62/38/37/411623837.db2.gz WFFYGQFOVYGEFS-NSHDSACASA-N 2 0 244.342 2.459 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)C1CC1 ZINC000663346263 411633426 /nfs/dbraw/zinc/63/34/26/411633426.db2.gz RUJBOCFBQVTNAD-GXTWGEPZSA-N 2 0 236.403 2.497 20 0 BEADRP FC1(C[NH2+]CC2CC[NH+](CC3CC3)CC2)CC1 ZINC000657813645 411604458 /nfs/dbraw/zinc/60/44/58/411604458.db2.gz WBPOSLNUXDWLDG-UHFFFAOYSA-N 2 0 240.366 2.200 20 0 BEADRP CC(C)=CCC[NH+]1CC[C@]2(CC[N@@H+](C)C2)C1 ZINC000660615304 411607948 /nfs/dbraw/zinc/60/79/48/411607948.db2.gz FQQIRWQGMWNGRP-AWEZNQCLSA-N 2 0 222.376 2.370 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@@H]1CCCSCC1 ZINC000657858310 411612706 /nfs/dbraw/zinc/61/27/06/411612706.db2.gz HIRFPCMMZQSPOV-GFCCVEGCSA-N 2 0 230.421 2.204 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCC[C@@]2(CC[NH+](C)C2)C1 ZINC000660654950 411613246 /nfs/dbraw/zinc/61/32/46/411613246.db2.gz DGUNANXNJUXBCR-KBPBESRZSA-N 2 0 224.392 2.450 20 0 BEADRP CC[C@H](C)[N@H+](CC)CCCc1cncn1C ZINC000661103921 411709066 /nfs/dbraw/zinc/70/90/66/411709066.db2.gz INWBPVUJIUWBFW-LBPRGKRZSA-N 2 0 223.364 2.473 20 0 BEADRP C[C@H]1C[C@@H](Nc2[nH+]ccc3[nH]ccc32)CC[N@@H+]1C ZINC000663661911 411716900 /nfs/dbraw/zinc/71/69/00/411716900.db2.gz SJPBDBIHJHHKHK-QWRGUYRKSA-N 2 0 244.342 2.458 20 0 BEADRP Cc1cccc([C@H](C)[N@H+](C)CCC[NH3+])c1 ZINC000133229380 411661187 /nfs/dbraw/zinc/66/11/87/411661187.db2.gz HVCXCHZUDZNISP-LBPRGKRZSA-N 2 0 206.333 2.337 20 0 BEADRP CC[C@H](C)[NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000663470544 411666301 /nfs/dbraw/zinc/66/63/01/411666301.db2.gz VBRVOMHKTWJRJU-GXTWGEPZSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H](C)[NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000663470556 411668004 /nfs/dbraw/zinc/66/80/04/411668004.db2.gz VBRVOMHKTWJRJU-OCCSQVGLSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H](Cc1ccccc1)[NH2+]CC12CC(C1)C[NH2+]2 ZINC000663497534 411679471 /nfs/dbraw/zinc/67/94/71/411679471.db2.gz GYOFFOUOLLGJNO-PCKAHOCUSA-N 2 0 244.382 2.349 20 0 BEADRP C[C@]1(C[N@@H+]2CCC[C@H](C3CCC3)C2)CC[NH2+]C1 ZINC000663499123 411681044 /nfs/dbraw/zinc/68/10/44/411681044.db2.gz ATONQDZBJMPTJG-GJZGRUSLSA-N 2 0 236.403 2.498 20 0 BEADRP C[C@@]1(C[N@@H+]2CCC[C@@H](C3CCC3)C2)CC[NH2+]C1 ZINC000663499124 411682024 /nfs/dbraw/zinc/68/20/24/411682024.db2.gz ATONQDZBJMPTJG-HUUCEWRRSA-N 2 0 236.403 2.498 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CC23CC(C2)C[NH2+]3)C[C@H]1C ZINC000663498142 411682106 /nfs/dbraw/zinc/68/21/06/411682106.db2.gz MHYQOJRPTLDHSS-LRUBOHGLSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]([NH2+]CC12CC(C1)C[NH2+]2)C1CCCCC1 ZINC000663499670 411684320 /nfs/dbraw/zinc/68/43/20/411684320.db2.gz FVPLKIJJXREBHR-LKSINWNRSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H]1CCC[C@H](C[NH2+]CC23CC(C2)C[NH2+]3)C1 ZINC000663501522 411686411 /nfs/dbraw/zinc/68/64/11/411686411.db2.gz XJXPHQPFQHGPPL-FEPKRQSRSA-N 2 0 222.376 2.154 20 0 BEADRP C(C[N@H+](CC1CC1)CC1CC[NH2+]CC1)C1CC1 ZINC000663504244 411687729 /nfs/dbraw/zinc/68/77/29/411687729.db2.gz WURYWSSXMLWIGE-UHFFFAOYSA-N 2 0 236.403 2.498 20 0 BEADRP C[NH2+]C[C@H](C)[NH2+][C@@H]1CCCC[C@@H]1C1CC1 ZINC000663510728 411693090 /nfs/dbraw/zinc/69/30/90/411693090.db2.gz RTFRFRVOQGBFHO-CYZMBNFOSA-N 2 0 210.365 2.153 20 0 BEADRP c1cc2c(cc[nH+]c2NCC[N@H+]2CC=CCC2)[nH]1 ZINC000663860777 411763523 /nfs/dbraw/zinc/76/35/23/411763523.db2.gz BVDSVIWZGNGMBZ-UHFFFAOYSA-N 2 0 242.326 2.237 20 0 BEADRP C[C@@H]([NH2+]CCn1ccnc1)C1CCC(F)CC1 ZINC000662001427 411939622 /nfs/dbraw/zinc/93/96/22/411939622.db2.gz MIOISTOFGYKLNV-PNESKVBLSA-N 2 0 239.338 2.390 20 0 BEADRP Cc1cc(NC[C@H]2CC[N@@H+]2C(C)(C)C)cc[nH+]1 ZINC000664142849 411870117 /nfs/dbraw/zinc/87/01/17/411870117.db2.gz NUAFEYOLKDXRMB-CYBMUJFWSA-N 2 0 233.359 2.097 20 0 BEADRP Cc1c[nH+]ccc1N[C@@H](C)C[NH+]1CCC(C)CC1 ZINC000664455283 411963151 /nfs/dbraw/zinc/96/31/51/411963151.db2.gz WXKIRILFASHUQQ-AWEZNQCLSA-N 2 0 247.386 2.344 20 0 BEADRP C(C1CC[NH2+]CC1)[N@@H+]1CCC[C@@H](C2CCC2)C1 ZINC000662229389 412031803 /nfs/dbraw/zinc/03/18/03/412031803.db2.gz IWDCZFKENGYSOK-OAHLLOKOSA-N 2 0 236.403 2.498 20 0 BEADRP CO[C@H](C[N@@H+]1CCCC[C@H]1[C@H](C)[NH3+])C1CCC1 ZINC000662236381 412035118 /nfs/dbraw/zinc/03/51/18/412035118.db2.gz XCHSBDKAPOXROO-FPMFFAJLSA-N 2 0 240.391 2.003 20 0 BEADRP CC[C@@H](CC(F)F)C[N@@H+]1CC[C@@H](C[NH2+]C)C1 ZINC000662244107 412038457 /nfs/dbraw/zinc/03/84/57/412038457.db2.gz BUEQYIWFVWSILS-QWRGUYRKSA-N 2 0 234.334 2.209 20 0 BEADRP CC[NH2+]CC1CC[NH+](C[C@@H]2C[C@H]3C[C@H]3C2)CC1 ZINC000662243838 412038865 /nfs/dbraw/zinc/03/88/65/412038865.db2.gz FKOFCCOSXHTWHC-QDMKHBRRSA-N 2 0 236.403 2.354 20 0 BEADRP C[NH2+]CC1CC[NH+](CCC=C(C)C)CC1 ZINC000662244125 412040214 /nfs/dbraw/zinc/04/02/14/412040214.db2.gz CIIQWUYYPVRDLO-UHFFFAOYSA-N 2 0 210.365 2.274 20 0 BEADRP CC1(C)CCCC[C@@H]1C[N@@H+]1CC[C@H](C[NH3+])C1 ZINC000662247739 412045024 /nfs/dbraw/zinc/04/50/24/412045024.db2.gz ZOBYZJRQMOZNMJ-CHWSQXEVSA-N 2 0 224.392 2.483 20 0 BEADRP C[C@@H]1C[N@H+](CCCC2CCC2)CC[C@@H]1[NH3+] ZINC000662246981 412045084 /nfs/dbraw/zinc/04/50/84/412045084.db2.gz XOMQADSQKJIGDI-YPMHNXCESA-N 2 0 210.365 2.236 20 0 BEADRP CO[C@H](C[NH2+][C@@](C)(C[NH3+])C(C)C)C1CCCC1 ZINC000662248709 412046566 /nfs/dbraw/zinc/04/65/66/412046566.db2.gz BLKOLIGCVNBZDZ-KGLIPLIRSA-N 2 0 242.407 2.155 20 0 BEADRP C1=CCC(C[N@@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]3)C2)C1 ZINC000662263502 412056252 /nfs/dbraw/zinc/05/62/52/412056252.db2.gz BVMGPPNAGGBQGM-CABCVRRESA-N 2 0 234.387 2.417 20 0 BEADRP CC[C@@H]1CC[C@@H](C)[N@@H+]1CC1CC[NH2+]CC1 ZINC000136185241 171036330 /nfs/dbraw/zinc/03/63/30/171036330.db2.gz CZYLIZODMZHZAZ-DGCLKSJQSA-N 2 0 210.365 2.249 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]CCC1CC[NH+](C)CC1 ZINC000336744450 171042321 /nfs/dbraw/zinc/04/23/21/171042321.db2.gz UYVCLFXUGCCYCG-KGLIPLIRSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]CCN1CCC(C)CC1 ZINC000336676867 171042610 /nfs/dbraw/zinc/04/26/10/171042610.db2.gz BYNQFMDTDOJSJC-KGLIPLIRSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H]1C[N@H+](CC2CC=CC2)CC[C@H]1[NH3+] ZINC000662270850 412062302 /nfs/dbraw/zinc/06/23/02/412062302.db2.gz PZZXQZTUMOPXIU-CHWSQXEVSA-N 2 0 208.349 2.012 20 0 BEADRP C(C[NH+]1CCC([C@H]2CC[NH2+]C2)CC1)C1CCC1 ZINC000662272683 412062777 /nfs/dbraw/zinc/06/27/77/412062777.db2.gz HYALUNWJUBWINJ-HNNXBMFYSA-N 2 0 236.403 2.498 20 0 BEADRP C1=CCC(C[N@@H+]2CCCC[C@@H]2[C@H]2CC[NH2+]C2)C1 ZINC000662276497 412068611 /nfs/dbraw/zinc/06/86/11/412068611.db2.gz NMMNFJQUMUFXIO-LSDHHAIUSA-N 2 0 234.387 2.417 20 0 BEADRP C[C@H]1CCC[N@H+](CC2CC=CC2)[C@@H]1CC[NH3+] ZINC000662285848 412077532 /nfs/dbraw/zinc/07/75/32/412077532.db2.gz NSCGGZTULOXDKW-GXTWGEPZSA-N 2 0 222.376 2.402 20 0 BEADRP [NH3+]C[C@]12CCC[C@H]1C[N@H+](CC1CC=CC1)C2 ZINC000662286882 412078053 /nfs/dbraw/zinc/07/80/53/412078053.db2.gz SWLSGZXHYJWFJE-KBPBESRZSA-N 2 0 220.360 2.013 20 0 BEADRP CC[C@H](C)C[N@H+](CC)CCC[NH+](C)C ZINC000336669495 171278234 /nfs/dbraw/zinc/27/82/34/171278234.db2.gz DWYGPIPNQUMSBW-LBPRGKRZSA-N 2 0 200.370 2.306 20 0 BEADRP CC[C@H](C)C[NH+]1CCC([C@H]2CC[NH2+]C2)CC1 ZINC000357047066 171279613 /nfs/dbraw/zinc/27/96/13/171279613.db2.gz IYVLSRPQBPLEQL-JSGCOSHPSA-N 2 0 224.392 2.354 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCC[C@]2(CC[NH2+]C2)C1 ZINC000335620315 171280537 /nfs/dbraw/zinc/28/05/37/171280537.db2.gz XHUTXWDLBGKIBQ-QWHCGFSZSA-N 2 0 210.365 2.108 20 0 BEADRP CC[C@H](C)C[N@@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000121684902 171282743 /nfs/dbraw/zinc/28/27/43/171282743.db2.gz CDPFHFWLGWJEDL-UONOGXRCSA-N 2 0 224.392 2.450 20 0 BEADRP CC[C@H](C)C[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000336734247 171283659 /nfs/dbraw/zinc/28/36/59/171283659.db2.gz KRZICLDNYSAEQH-LBPRGKRZSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@H](C)[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000309168151 171339831 /nfs/dbraw/zinc/33/98/31/171339831.db2.gz JYPNMLCFQAXORH-NSHDSACASA-N 2 0 210.365 2.391 20 0 BEADRP CC[C@H](C)[NH2+]C[C@@H]1NCCc2ccccc21 ZINC000043596132 171341327 /nfs/dbraw/zinc/34/13/27/171341327.db2.gz GVTIUMJOVLXYBR-FZMZJTMJSA-N 2 0 218.344 2.262 20 0 BEADRP CC[C@H](C)[C@H](C[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1)OC ZINC000362974926 171392829 /nfs/dbraw/zinc/39/28/29/171392829.db2.gz CCHNPYVECONCFP-XUXIUFHCSA-N 2 0 242.407 2.120 20 0 BEADRP [NH3+]CCOCC[N@@H+]1CCCC2(CCCC2)CC1 ZINC000662299469 412086298 /nfs/dbraw/zinc/08/62/98/412086298.db2.gz QNWHXDQYUNWWDQ-UHFFFAOYSA-N 2 0 240.391 2.008 20 0 BEADRP C([C@H]1CC[NH2+]C1)[N@@H+]1CC[C@H](C2CCCCC2)C1 ZINC000662305441 412090485 /nfs/dbraw/zinc/09/04/85/412090485.db2.gz HPXQXOMYECBDKN-ZFWWWQNUSA-N 2 0 236.403 2.498 20 0 BEADRP CCC1(CC)CCC[N@H+](C[C@@H]2CC[NH2+]C2)C1 ZINC000662308679 412093272 /nfs/dbraw/zinc/09/32/72/412093272.db2.gz COGHRFQCJOYCAU-CYBMUJFWSA-N 2 0 224.392 2.498 20 0 BEADRP CCC1(CC)CCC[N@H+](CCC[NH2+]C)C1 ZINC000662309847 412094938 /nfs/dbraw/zinc/09/49/38/412094938.db2.gz OFOSKPDTXVXMJG-UHFFFAOYSA-N 2 0 212.381 2.498 20 0 BEADRP c1cc(C[N@@H+]2CC[C@H]3C[C@H]3C2)c2c(c1)C[NH2+]CC2 ZINC000662315954 412095832 /nfs/dbraw/zinc/09/58/32/412095832.db2.gz RGLKEJQLFXUBKS-WFASDCNBSA-N 2 0 242.366 2.174 20 0 BEADRP CCC(CC)CCC[N@H+](C)C[C@H](C)[NH3+] ZINC000662316147 412095902 /nfs/dbraw/zinc/09/59/02/412095902.db2.gz IYEFCLNDVAXDBA-NSHDSACASA-N 2 0 200.370 2.482 20 0 BEADRP C([C@@H]1CC[NH2+]C1)[N@@H+]1CCC[C@@H](C2CCC2)C1 ZINC000662317799 412097610 /nfs/dbraw/zinc/09/76/10/412097610.db2.gz SRCKECZRBKKNOH-TZMCWYRMSA-N 2 0 222.376 2.108 20 0 BEADRP [NH3+]CCOCC[N@@H+]1CCCC[C@@H]1CC1CCC1 ZINC000662319635 412099794 /nfs/dbraw/zinc/09/97/94/412099794.db2.gz PCUIKAMYMORBCW-CQSZACIVSA-N 2 0 240.391 2.006 20 0 BEADRP CCC[C@H](C)[N@@H+]1CCO[C@H](CCC[NH+](C)C)C1 ZINC000662322524 412100193 /nfs/dbraw/zinc/10/01/93/412100193.db2.gz ILIBASPUKWGJOT-UONOGXRCSA-N 2 0 242.407 2.218 20 0 BEADRP C[N@H+](CC[C@H]1CCC[NH2+]C1)C[C@@H]1CC1(C)C ZINC000662331577 412104994 /nfs/dbraw/zinc/10/49/94/412104994.db2.gz NRLNLXGRGYMEPO-OLZOCXBDSA-N 2 0 224.392 2.354 20 0 BEADRP CC[C@H](COC)[NH2+]CCC1CC[NH+](CC)CC1 ZINC000121813789 171459518 /nfs/dbraw/zinc/45/95/18/171459518.db2.gz PMUKGIFBOKSNAX-CQSZACIVSA-N 2 0 242.407 2.123 20 0 BEADRP C[NH+](C)Cc1cc(-c2c[nH]cn2)ccc1F ZINC000665199772 412132177 /nfs/dbraw/zinc/13/21/77/412132177.db2.gz WXWXGBKRLKFRKQ-UHFFFAOYSA-N 2 0 219.263 2.277 20 0 BEADRP COCC[C@@H]1CCC[C@@H]1[NH2+]CC1([NH3+])CCCC1 ZINC000665246775 412185221 /nfs/dbraw/zinc/18/52/21/412185221.db2.gz NLKORYJHHUHKCS-STQMWFEESA-N 2 0 240.391 2.053 20 0 BEADRP CC(C)[C@H]1CCCC[C@H]1[NH2+][C@H]1CC[NH2+]C1 ZINC000665242749 412186743 /nfs/dbraw/zinc/18/67/43/412186743.db2.gz JHDLNWFINJHWCL-YNEHKIRRSA-N 2 0 210.365 2.153 20 0 BEADRP [NH3+]C1(C[NH2+][C@H]2CC[C@H]2C2CCC2)CCCC1 ZINC000665246387 412190312 /nfs/dbraw/zinc/19/03/12/412190312.db2.gz CYZYWHRHZQJPDV-STQMWFEESA-N 2 0 222.376 2.426 20 0 BEADRP COCC[C@@H]1CCC[C@H]1[NH2+]CC1([NH3+])CCCC1 ZINC000665246774 412190539 /nfs/dbraw/zinc/19/05/39/412190539.db2.gz NLKORYJHHUHKCS-QWHCGFSZSA-N 2 0 240.391 2.053 20 0 BEADRP CC[C@H]([NH2+]CC1([NH3+])CCCC1)[C@@H]1C[C@H]1C ZINC000665246425 412191733 /nfs/dbraw/zinc/19/17/33/412191733.db2.gz FLLBUJPWUDLUET-UTUOFQBUSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)(F)CC[NH2+][C@H]1CCCC[C@H]1C[NH3+] ZINC000665261682 412203292 /nfs/dbraw/zinc/20/32/92/412203292.db2.gz JJTQZOQETHYUIR-QWRGUYRKSA-N 2 0 216.344 2.232 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+]CCC(C)(C)F ZINC000665261540 412204428 /nfs/dbraw/zinc/20/44/28/412204428.db2.gz FNNYICOOCBCHCO-WDEREUQCSA-N 2 0 216.344 2.102 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+]CCC(C)(C)F ZINC000665261539 412204856 /nfs/dbraw/zinc/20/48/56/412204856.db2.gz FNNYICOOCBCHCO-QWRGUYRKSA-N 2 0 216.344 2.102 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[C@H]2C[C@H]21)[C@@H]1CCC[NH2+]1 ZINC000665263050 412205279 /nfs/dbraw/zinc/20/52/79/412205279.db2.gz FDRATALTNLTQEE-YHQUGGNUSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]C[C@@H]1CCC[C@H]2C[C@H]21 ZINC000665263138 412205692 /nfs/dbraw/zinc/20/56/92/412205692.db2.gz GRTOIHAKMMHOSB-PJSNJIKXSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CC[C@]1(C)CC1(F)F ZINC000665266914 412210094 /nfs/dbraw/zinc/21/00/94/412210094.db2.gz LTQLQQNPADMTMK-IVZWLZJFSA-N 2 0 220.307 2.137 20 0 BEADRP C[C@H]([NH2+]CC[C@@]1(C)CC1(F)F)[C@H]1CCC[NH2+]1 ZINC000665267279 412210169 /nfs/dbraw/zinc/21/01/69/412210169.db2.gz TXKFEXDWFCFLPH-AXFHLTTASA-N 2 0 232.318 2.152 20 0 BEADRP C[C@]1(CC[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)CC1(F)F ZINC000665266857 412210317 /nfs/dbraw/zinc/21/03/17/412210317.db2.gz KXFMJNLRLAOIBK-MXWKQRLJSA-N 2 0 232.318 2.281 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]CC1=CCCC1 ZINC000665273871 412215573 /nfs/dbraw/zinc/21/55/73/412215573.db2.gz FZLFKNMVHLDKMU-DGCLKSJQSA-N 2 0 208.349 2.074 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCCC[C@H]1C[NH3+])c1ccccn1 ZINC000665232383 412170555 /nfs/dbraw/zinc/17/05/55/412170555.db2.gz MBXAMWFBBYHHHM-IPYPFGDCSA-N 2 0 247.386 2.292 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC[NH2+]CC[C@@H]1C)c1ccccn1 ZINC000665232902 412171591 /nfs/dbraw/zinc/17/15/91/412171591.db2.gz XJYANQPOBIAIPY-GUTXKFCHSA-N 2 0 247.386 2.163 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+]CC1=CCCC1 ZINC000665273870 412216203 /nfs/dbraw/zinc/21/62/03/412216203.db2.gz FZLFKNMVHLDKMU-AAEUAGOBSA-N 2 0 208.349 2.074 20 0 BEADRP CCC(C)(C)[C@@H](C)[NH2+]CC12CC(C1)C[NH2+]2 ZINC000665279668 412222641 /nfs/dbraw/zinc/22/26/41/412222641.db2.gz JDAIAXJKIAXMBI-XSRFYTQQSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@@H]([NH2+]CC[C@@H]([NH3+])C(C)C)C(C)C ZINC000665279870 412223626 /nfs/dbraw/zinc/22/36/26/412223626.db2.gz NWPFVDHAINALBO-VXGBXAGGSA-N 2 0 200.370 2.384 20 0 BEADRP C([NH2+][C@H](C1CC1)C1CCCC1)C12CC(C1)C[NH2+]2 ZINC000665279871 412223749 /nfs/dbraw/zinc/22/37/49/412223749.db2.gz NZDGKCBVNHNCMD-WPBUFGDCSA-N 2 0 234.387 2.297 20 0 BEADRP COC[C@H]([NH2+]CC[C@@H]([NH3+])C(C)C)C1CCCC1 ZINC000665281836 412224184 /nfs/dbraw/zinc/22/41/84/412224184.db2.gz LLPJUFOXDIKTBA-KGLIPLIRSA-N 2 0 242.407 2.155 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+][C@H](C)[C@H]1CC1(C)C ZINC000665282083 412225956 /nfs/dbraw/zinc/22/59/56/412225956.db2.gz QJFHUQAWZXLAMJ-IJLUTSLNSA-N 2 0 212.381 2.384 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+][C@H](C)c1cccnc1 ZINC000665281339 412226009 /nfs/dbraw/zinc/22/60/09/412226009.db2.gz ZUCISAGOXFKBNW-DGCLKSJQSA-N 2 0 221.348 2.106 20 0 BEADRP CCc1ccc(C[NH2+]CCCC[NH+](C)C)cn1 ZINC000352774888 171804538 /nfs/dbraw/zinc/80/45/38/171804538.db2.gz YHZGJSGBTGRXOK-UHFFFAOYSA-N 2 0 235.375 2.075 20 0 BEADRP C[NH+](C)C1CCC([NH2+]C[C@@H]2CCSC2)CC1 ZINC000336779704 172405995 /nfs/dbraw/zinc/40/59/95/172405995.db2.gz PHPOTGWPJMMPDW-HIFPTAJRSA-N 2 0 242.432 2.202 20 0 BEADRP C[N@H+]1CC=C(C[NH2+]Cc2ccsc2)CC1 ZINC000271928756 172979079 /nfs/dbraw/zinc/97/90/79/172979079.db2.gz VZBLDZGIBRZIKG-UHFFFAOYSA-N 2 0 222.357 2.100 20 0 BEADRP C[NH+]1CCC(C[NH2+]C2CC3(CCC3)C2)CC1 ZINC000309634005 172984879 /nfs/dbraw/zinc/98/48/79/172984879.db2.gz IVCCBGQUJISXQJ-UHFFFAOYSA-N 2 0 222.376 2.251 20 0 BEADRP C[NH+]1CCC(C[NH2+]C[C@H]2CC=CCC2)CC1 ZINC000044516022 172985998 /nfs/dbraw/zinc/98/59/98/172985998.db2.gz SWSLBSOYBPSTMX-ZDUSSCGKSA-N 2 0 222.376 2.274 20 0 BEADRP C[N@@H+]1CCC[C@@H]1CC[NH+]1C[C@H]2CCCC[C@H]21 ZINC000368083831 173029386 /nfs/dbraw/zinc/02/93/86/173029386.db2.gz OQPIICOSEABOCN-MGPQQGTHSA-N 2 0 222.376 2.345 20 0 BEADRP C[N@@H+]1CCC[C@@H]2C[NH+](CCCCF)CC[C@@H]21 ZINC000367158589 173036257 /nfs/dbraw/zinc/03/62/57/173036257.db2.gz TVEVJMHEDBUNRN-OLZOCXBDSA-N 2 0 228.355 2.152 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH3+])[C@H]1c1cccs1 ZINC000082374015 173042440 /nfs/dbraw/zinc/04/24/40/173042440.db2.gz DPKWXOKHANQUNA-KOLCDFICSA-N 2 0 210.346 2.090 20 0 BEADRP C[N@@H+]1CCC[C@H]1CC[NH+]1CCCC1(C)C ZINC000336556117 173050339 /nfs/dbraw/zinc/05/03/39/173050339.db2.gz HVYUGPAYLYWYTL-LBPRGKRZSA-N 2 0 210.365 2.345 20 0 BEADRP C[N@@H+]1CCC[C@H]1CC[NH+]1C[C@H]2CCCC[C@H]21 ZINC000368083830 173052167 /nfs/dbraw/zinc/05/21/67/173052167.db2.gz OQPIICOSEABOCN-HZSPNIEDSA-N 2 0 222.376 2.345 20 0 BEADRP C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cc2ccco2)C1 ZINC000290372131 173134844 /nfs/dbraw/zinc/13/48/44/173134844.db2.gz HMYDIICSMWIZDL-GXTWGEPZSA-N 2 0 234.343 2.196 20 0 BEADRP C[N@@H+]1CC[C@@]2(CC[NH+](CCCCCF)C2)C1 ZINC000366495525 173137875 /nfs/dbraw/zinc/13/78/75/173137875.db2.gz GUOBPGGUJDLJRQ-CYBMUJFWSA-N 2 0 228.355 2.154 20 0 BEADRP C[N@@H+]1CC[C@H](C[NH2+]C2CCCCCC2)C1 ZINC000037484613 173147447 /nfs/dbraw/zinc/14/74/47/173147447.db2.gz KEOTVXSNMQREOS-GFCCVEGCSA-N 2 0 210.365 2.251 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CC2CCC2)[C@@H]2CCC[C@@H]21 ZINC000309501063 173151408 /nfs/dbraw/zinc/15/14/08/173151408.db2.gz ZTNQMCHRWHERJX-IHRRRGAJSA-N 2 0 222.376 2.249 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]Cc2cccnc2)[C@@H]2CCC[C@H]21 ZINC000367620692 173152937 /nfs/dbraw/zinc/15/29/37/173152937.db2.gz QUGOVTIOUXRJRX-SOUVJXGZSA-N 2 0 245.370 2.044 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CC2CCC2)[C@@H]2CCC[C@H]21 ZINC000309501065 173153324 /nfs/dbraw/zinc/15/33/24/173153324.db2.gz ZTNQMCHRWHERJX-MELADBBJSA-N 2 0 222.376 2.249 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C[C@@H]2CC2(C)C)[C@H]2CCC[C@H]21 ZINC000353399065 173153503 /nfs/dbraw/zinc/15/35/03/173153503.db2.gz ANQSOZWLXUWSGI-RFQIPJPRSA-N 2 0 236.403 2.495 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CCCCC1)C2 ZINC000100046893 173206456 /nfs/dbraw/zinc/20/64/56/173206456.db2.gz MVSSXDKAQLWYQO-CLLJXQQHSA-N 2 0 208.349 2.098 20 0 BEADRP C[NH2+]CC1CC[NH+]([C@H](C)c2cccnc2)CC1 ZINC000063158785 173338873 /nfs/dbraw/zinc/33/88/73/173338873.db2.gz UZYXYCNZSDXXSM-GFCCVEGCSA-N 2 0 233.359 2.074 20 0 BEADRP C[NH2+]CC1CC[NH+](Cc2ccccc2OC)CC1 ZINC000011889183 173338887 /nfs/dbraw/zinc/33/88/87/173338887.db2.gz FGBCEMKKYWIOGG-UHFFFAOYSA-N 2 0 248.370 2.127 20 0 BEADRP C[NH2+]C[C@@H](C)CNc1cc[nH+]c(C)c1Cl ZINC000309028458 173364271 /nfs/dbraw/zinc/36/42/71/173364271.db2.gz ZSOILRKKMMMFDN-MRVPVSSYSA-N 2 0 227.739 2.311 20 0 BEADRP C[NH2+]C[C@@H]1CCC[N@H+](CCc2ccccc2)C1 ZINC000011888791 173368164 /nfs/dbraw/zinc/36/81/64/173368164.db2.gz DLAVNDLZWDBEPM-HNNXBMFYSA-N 2 0 232.371 2.161 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](CC2CCCCC2)C1 ZINC000053031002 173369536 /nfs/dbraw/zinc/36/95/36/173369536.db2.gz ROSJLRYLMQUSBK-ZDUSSCGKSA-N 2 0 210.365 2.108 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](CCC2CCCCC2)C1 ZINC000053031468 173369556 /nfs/dbraw/zinc/36/95/56/173369556.db2.gz BJHMGBUIMXUZRL-AWEZNQCLSA-N 2 0 224.392 2.498 20 0 BEADRP C[NH2+]C[C@H]1CCC[N@H+](Cc2cccc(C)c2)C1 ZINC000011888683 173378437 /nfs/dbraw/zinc/37/84/37/173378437.db2.gz LBLODXXLWBXUAJ-OAHLLOKOSA-N 2 0 232.371 2.426 20 0 BEADRP C[NH2+]C[C@H]1CCCN1CCOc1ccc(C)cc1 ZINC000019933448 173380170 /nfs/dbraw/zinc/38/01/70/173380170.db2.gz NIKJKFKLDMKTCM-CQSZACIVSA-N 2 0 248.370 2.058 20 0 BEADRP C[NH2+]C[C@H]1CC[N@@H+]([C@H](C)c2ccccc2)C1 ZINC000053012240 173381440 /nfs/dbraw/zinc/38/14/40/173381440.db2.gz LZWHOWKJRAMZKN-CHWSQXEVSA-N 2 0 218.344 2.289 20 0 BEADRP C[NH2+]C[C@H]1CC[N@@H+]([C@@H](C)c2cccc(OC)c2)C1 ZINC000071141895 173381709 /nfs/dbraw/zinc/38/17/09/173381709.db2.gz SSYYRUZYGDJCRT-QWHCGFSZSA-N 2 0 248.370 2.298 20 0 BEADRP C[NH2+]C[C@H]1CC[N@H+](Cc2ccc(C)c(C)c2)C1 ZINC000071142429 173381875 /nfs/dbraw/zinc/38/18/75/173381875.db2.gz YGZAODWEBWHMLD-OAHLLOKOSA-N 2 0 232.371 2.345 20 0 BEADRP C[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2C)C1 ZINC000011891901 173382221 /nfs/dbraw/zinc/38/22/21/173382221.db2.gz INFDTSFOQHMDRF-CYBMUJFWSA-N 2 0 218.344 2.036 20 0 BEADRP COC1(C[NH2+]CCC[N@H+](C)C(C)C)CCCC1 ZINC000319380756 174000675 /nfs/dbraw/zinc/00/06/75/174000675.db2.gz CJGZTPMYANLBNB-UHFFFAOYSA-N 2 0 242.407 2.266 20 0 BEADRP COCCC[C@H](C)[NH2+]CCC[N@H+](C)C(C)C ZINC000309450772 174263070 /nfs/dbraw/zinc/26/30/70/174263070.db2.gz LBPZJGPMESWYDS-ZDUSSCGKSA-N 2 0 230.396 2.121 20 0 BEADRP COCc1cccc(C[NH2+][C@H](C)CCC[NH3+])c1 ZINC000310570287 174631623 /nfs/dbraw/zinc/63/16/23/174631623.db2.gz YZFCHMUJSKVTTK-GFCCVEGCSA-N 2 0 236.359 2.050 20 0 BEADRP COc1ccc(C)cc1C[N@@H+]1CC[C@@](C)(C[NH3+])C1 ZINC000234857781 175075161 /nfs/dbraw/zinc/07/51/61/175075161.db2.gz IONCKPMFXIOTOO-HNNXBMFYSA-N 2 0 248.370 2.174 20 0 BEADRP COc1ccc(C)cc1[C@@H](C)[NH2+]C[C@@H](C)C[NH3+] ZINC000336713991 175079291 /nfs/dbraw/zinc/07/92/91/175079291.db2.gz OVWOPEDKFKABMJ-NWDGAFQWSA-N 2 0 236.359 2.249 20 0 BEADRP COc1ccc(C)cc1[C@@H](C)[NH2+]C[C@H](C)C[NH3+] ZINC000336713993 175079362 /nfs/dbraw/zinc/07/93/62/175079362.db2.gz OVWOPEDKFKABMJ-VXGBXAGGSA-N 2 0 236.359 2.249 20 0 BEADRP COc1ccc(C)cc1[C@H](C)[NH2+]C[C@H](C)C[NH3+] ZINC000336713990 175081227 /nfs/dbraw/zinc/08/12/27/175081227.db2.gz OVWOPEDKFKABMJ-NEPJUHHUSA-N 2 0 236.359 2.249 20 0 BEADRP COc1ccc(C[N@H+](CCC[NH3+])C2CC2)cc1 ZINC000036732062 175097763 /nfs/dbraw/zinc/09/77/63/175097763.db2.gz CQNWMIDJAUXKPH-UHFFFAOYSA-N 2 0 234.343 2.008 20 0 BEADRP COc1ccc(C[NH2+]CCC[NH+]2CCCC2)cc1 ZINC000020128913 175106559 /nfs/dbraw/zinc/10/65/59/175106559.db2.gz KXXYMLOMSNPXRH-UHFFFAOYSA-N 2 0 248.370 2.271 20 0 BEADRP COc1ccc([C@@H](C)[NH2+]C[C@H](C)C[NH3+])cc1F ZINC000310540336 175177188 /nfs/dbraw/zinc/17/71/88/175177188.db2.gz SJWOBOJQRKOYRD-NXEZZACHSA-N 2 0 240.322 2.080 20 0 BEADRP COc1ccc([C@@H](C)[NH2+][C@H]2CCC[NH2+]CC2)cc1 ZINC000129302197 175177698 /nfs/dbraw/zinc/17/76/98/175177698.db2.gz FOUYRSURKVHYOR-OCCSQVGLSA-N 2 0 248.370 2.488 20 0 BEADRP COc1ccc([C@H](C)[NH2+]C2CC[NH2+]CC2)cc1 ZINC000090339616 175188318 /nfs/dbraw/zinc/18/83/18/175188318.db2.gz XDUZUVNRQVBGMJ-NSHDSACASA-N 2 0 234.343 2.098 20 0 BEADRP COc1ccc([C@H](C)[NH2+][C@H](C)CCC[NH3+])cc1 ZINC000310171115 175189239 /nfs/dbraw/zinc/18/92/39/175189239.db2.gz TYNLFRBYEWLCIE-NEPJUHHUSA-N 2 0 236.359 2.473 20 0 BEADRP COc1ccc([C@H](C)[NH2+][C@@H]2CCC[NH2+]CC2)cc1 ZINC000129301510 175189454 /nfs/dbraw/zinc/18/94/54/175189454.db2.gz FOUYRSURKVHYOR-GXTWGEPZSA-N 2 0 248.370 2.488 20 0 BEADRP COc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@@H]2C[NH3+])cc1 ZINC000090339648 175189762 /nfs/dbraw/zinc/18/97/62/175189762.db2.gz IVPAUBUHIADKKF-NJZAAPMLSA-N 2 0 248.370 2.473 20 0 BEADRP COc1ccc2c(c1)CCC[C@H]2[NH2+]CCCC[NH3+] ZINC000037715078 175208100 /nfs/dbraw/zinc/20/81/00/175208100.db2.gz NQWPVURHKUFSSH-OAHLLOKOSA-N 2 0 248.370 2.401 20 0 BEADRP COc1ccc2[nH+]ccc(NCC[NH+](C)C)c2c1 ZINC000005688935 175230119 /nfs/dbraw/zinc/23/01/19/175230119.db2.gz BZSIDXIVBGHQHP-UHFFFAOYSA-N 2 0 245.326 2.217 20 0 in-man BEADRP COc1cccc(C[NH+]2CCC(CC[NH3+])CC2)c1 ZINC000042427616 175257814 /nfs/dbraw/zinc/25/78/14/175257814.db2.gz CHHLPQWZQQSCBF-UHFFFAOYSA-N 2 0 248.370 2.256 20 0 BEADRP COc1cccc(C[N@@H+]2CCC[C@H](CC[NH3+])C2)c1 ZINC000070074237 175258822 /nfs/dbraw/zinc/25/88/22/175258822.db2.gz KKCALSCCZZHGOH-CYBMUJFWSA-N 2 0 248.370 2.256 20 0 BEADRP COc1cccc(C[NH2+][C@@H]2CCN(C3CC3)C2)c1 ZINC000044683862 175266623 /nfs/dbraw/zinc/26/66/23/175266623.db2.gz HIKGYGYHAFAJAD-CYBMUJFWSA-N 2 0 246.354 2.022 20 0 BEADRP COc1cccc([C@@H](C)[NH2+]CC2CC[NH2+]CC2)c1 ZINC000094010235 175286475 /nfs/dbraw/zinc/28/64/75/175286475.db2.gz XPHVBASPMWNZCU-GFCCVEGCSA-N 2 0 248.370 2.345 20 0 BEADRP COc1cccc([C@H](C)[NH2+][C@@H]2CCC[C@H]2C[NH3+])c1 ZINC000148222724 175293580 /nfs/dbraw/zinc/29/35/80/175293580.db2.gz ADQABIYVQWQTQO-CORIIIEPSA-N 2 0 248.370 2.473 20 0 BEADRP COc1ccccc1C[NH+]1CCC([C@@H](C)[NH3+])CC1 ZINC000104436292 175325651 /nfs/dbraw/zinc/32/56/51/175325651.db2.gz KEHKQXOKYCRUHA-GFCCVEGCSA-N 2 0 248.370 2.254 20 0 BEADRP COc1ccccc1C[NH2+][C@H](C)CCCC[NH3+] ZINC000336682582 175329648 /nfs/dbraw/zinc/32/96/48/175329648.db2.gz FAMMJNQBQRQSMA-GFCCVEGCSA-N 2 0 236.359 2.302 20 0 BEADRP COc1ccccc1C[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000093209367 175329820 /nfs/dbraw/zinc/32/98/20/175329820.db2.gz FBMQDGFQGCOZEV-QWHCGFSZSA-N 2 0 234.343 2.055 20 0 BEADRP C[C@H](CC[NH3+])[NH2+]Cc1ccc(C(F)F)cc1 ZINC000556932328 322931429 /nfs/dbraw/zinc/93/14/29/322931429.db2.gz XRQARNSNBMHOIG-SECBINFHSA-N 2 0 228.286 2.451 20 0 BEADRP C[C@@H]([NH2+][C@H](C)C1CC[NH+](C)CC1)C1CC1 ZINC000035732770 175919460 /nfs/dbraw/zinc/91/94/60/175919460.db2.gz KTZLREMXLATPFC-GHMZBOCLSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@@H]1CC2(C[N@@H+]1CC1CCC1)CC[NH2+]CC2 ZINC000335276468 176057948 /nfs/dbraw/zinc/05/79/48/176057948.db2.gz DNVWVGODXPFFGT-GFCCVEGCSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@@H]1CCCC[N@@H+]1CCC[NH2+]CC1CC1 ZINC000037118284 176071407 /nfs/dbraw/zinc/07/14/07/176071407.db2.gz HPYDKFSJZGFPJY-GFCCVEGCSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[N@@H+]1CCC[C@H](N)C1 ZINC000070585814 176075764 /nfs/dbraw/zinc/07/57/64/176075764.db2.gz SREOGLUZORHDBK-UPJWGTAASA-N 2 0 210.365 2.236 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+]CCCC[NH+](C)C ZINC000045662965 176080670 /nfs/dbraw/zinc/08/06/70/176080670.db2.gz FMHWEPVUIKJCFC-OLZOCXBDSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H]1CCCC[C@H]1[NH2+]CC1=CC[N@H+](C)CC1 ZINC000335607812 176088628 /nfs/dbraw/zinc/08/86/28/176088628.db2.gz HVBMYMZDXBTGKI-TZMCWYRMSA-N 2 0 222.376 2.417 20 0 BEADRP C[C@@H]1CCC[N@H+](CCCC2CC[NH2+]CC2)C1 ZINC000050952290 176098705 /nfs/dbraw/zinc/09/87/05/176098705.db2.gz KAAOQSAMUUHDIY-CYBMUJFWSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H]1CC[N@H+](CCCCCF)C[C@H]1C[NH3+] ZINC000336695477 176168704 /nfs/dbraw/zinc/16/87/04/176168704.db2.gz NWIANVCSFZTACX-VXGBXAGGSA-N 2 0 216.344 2.043 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+][C@@H]1CC[N@H+](C)[C@H]2CCC[C@H]21 ZINC000309829086 176217490 /nfs/dbraw/zinc/21/74/90/176217490.db2.gz YBQKDAGYLWXZHS-HTOAHKCRSA-N 2 0 222.376 2.247 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@H]1C ZINC000309050386 176218279 /nfs/dbraw/zinc/21/82/79/176218279.db2.gz PIVVJSVBOPVVLH-NJMOYASZSA-N 2 0 210.365 2.103 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CCC[C@H]2CCC[NH2+]2)C1 ZINC000308979407 176232788 /nfs/dbraw/zinc/23/27/88/176232788.db2.gz HQOQAWNRKJXHMO-UPJWGTAASA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@@H]2CCC[C@@H]([NH3+])C2)C1 ZINC000228977121 176233388 /nfs/dbraw/zinc/23/33/88/176233388.db2.gz AOVLIHADRRDYJF-LPWJVIDDSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@@]2(C)CCC[NH2+]C2)C1 ZINC000228981531 176233391 /nfs/dbraw/zinc/23/33/91/176233391.db2.gz GKFHYUGQQKIDFD-AGIUHOORSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]Cc1cccc(F)c1 ZINC000105480748 176269850 /nfs/dbraw/zinc/26/98/50/176269850.db2.gz NYOWOXNMTHBALP-RISCZKNCSA-N 2 0 236.334 2.256 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+][C@H]1CC[C@@H](F)C1 ZINC000309798612 176279127 /nfs/dbraw/zinc/27/91/27/176279127.db2.gz QSIZYOUBZNPJIM-KVSVUVNWSA-N 2 0 228.355 2.195 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]CCc1ccco1 ZINC000036908629 176279311 /nfs/dbraw/zinc/27/93/11/176279311.db2.gz WUWZQZXYEXMLPH-YRGRVCCFSA-N 2 0 236.359 2.140 20 0 BEADRP C[C@@H]1C[N@H+](CCC2CCCC2)CC[C@@H]1[NH3+] ZINC000049713033 176288535 /nfs/dbraw/zinc/28/85/35/176288535.db2.gz VQPPCRBHGUAXFG-YPMHNXCESA-N 2 0 210.365 2.236 20 0 BEADRP C[C@@H]1CSC[C@H]1[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000304538748 176355301 /nfs/dbraw/zinc/35/53/01/176355301.db2.gz RYEVCDITLVYMNL-VXGBXAGGSA-N 2 0 242.432 2.059 20 0 BEADRP C[C@@H]1CSC[C@H]1[NH2+]CCC[NH+]1CCCCC1 ZINC000304525021 176355318 /nfs/dbraw/zinc/35/53/18/176355318.db2.gz PSLXSUDGHRZINZ-CHWSQXEVSA-N 2 0 242.432 2.204 20 0 BEADRP C[C@@H]1C[C@@H](C[N@H+](C)CC(C)(C)C)CC[NH2+]1 ZINC000235381238 176368098 /nfs/dbraw/zinc/36/80/98/176368098.db2.gz FCYPYXKPLZXTPS-NEPJUHHUSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H]1C[C@@H](C[NH3+])CN1c1cc[nH+]c2ccccc21 ZINC000216234788 176368935 /nfs/dbraw/zinc/36/89/35/176368935.db2.gz UCJQQOSKTCHTGQ-NEPJUHHUSA-N 2 0 241.338 2.408 20 0 BEADRP C[C@@H]1C[C@@H]([N@H+](C)CC2CCC2)CCN1C ZINC000336084588 176370868 /nfs/dbraw/zinc/37/08/68/176370868.db2.gz CZSXWWFELHDLRB-YPMHNXCESA-N 2 0 210.365 2.201 20 0 BEADRP C[C@@H]1C[C@@H]([NH3+])CC[N@@H+]1CCc1ccccc1 ZINC000049708925 176372080 /nfs/dbraw/zinc/37/20/80/176372080.db2.gz NSBXMYHTQVVHAT-OCCSQVGLSA-N 2 0 218.344 2.041 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CC2CC(F)(F)C2)CC[N@@H+]1C ZINC000309810326 176375683 /nfs/dbraw/zinc/37/56/83/176375683.db2.gz UALWFRSSUWQBJF-KOLCDFICSA-N 2 0 232.318 2.104 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCc2ccc(O)cc2)CC[N@@H+]1C ZINC000156113633 176376754 /nfs/dbraw/zinc/37/67/54/176376754.db2.gz STRYNYQFCVQJRC-OCCSQVGLSA-N 2 0 248.370 2.007 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+][C@@H]1CC[N@H+](C)[C@H]2CCC[C@@H]21 ZINC000309775594 176398179 /nfs/dbraw/zinc/39/81/79/176398179.db2.gz LPSZJWSLJCBQIJ-KSTCHIGDSA-N 2 0 222.376 2.105 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCC2CC[NH+](C)CC2)[C@H]1C ZINC000336686217 176495587 /nfs/dbraw/zinc/49/55/87/176495587.db2.gz UQHMKAMHOCYEAI-DYEKYZERSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H]1CC2CCC1CC2 ZINC000336744046 176620973 /nfs/dbraw/zinc/62/09/73/176620973.db2.gz YUZQGSGXEZPPLU-IKWCTNDRSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]([NH3+])C1CC[NH+](CCOc2ccccc2)CC1 ZINC000111611971 176754767 /nfs/dbraw/zinc/75/47/67/176754767.db2.gz ZJORRFZHERDOSG-ZDUSSCGKSA-N 2 0 248.370 2.125 20 0 BEADRP C[C@H]([NH2+]CC1CC[NH+](C)CC1)c1cccnc1 ZINC000044515595 176838133 /nfs/dbraw/zinc/83/81/33/176838133.db2.gz SJBVGSUCRBSTBC-LBPRGKRZSA-N 2 0 233.359 2.074 20 0 BEADRP C[C@H]([NH2+]CCCC[NH+](C)C)C1CCSCC1 ZINC000309517374 176843368 /nfs/dbraw/zinc/84/33/68/176843368.db2.gz YZSXWORWMODDDS-LBPRGKRZSA-N 2 0 244.448 2.450 20 0 BEADRP C[C@H](c1cccnc1)[N@@H+]1C[C@@H]2CCC[C@H]([NH3+])[C@@H]2C1 ZINC000125341321 177046710 /nfs/dbraw/zinc/04/67/10/177046710.db2.gz NGDLLRXNSMOKIJ-BEAPCOKYSA-N 2 0 245.370 2.202 20 0 BEADRP C[C@H](c1cccs1)N(C)CC(C)(C)[NH3+] ZINC000049717083 177048494 /nfs/dbraw/zinc/04/84/94/177048494.db2.gz JZGNRNLMUPEWQE-SECBINFHSA-N 2 0 212.362 2.478 20 0 BEADRP C[C@H]1CCCC[C@@H]1[NH2+]CC1=CC[N@H+](C)CC1 ZINC000335607810 177083062 /nfs/dbraw/zinc/08/30/62/177083062.db2.gz HVBMYMZDXBTGKI-JSGCOSHPSA-N 2 0 222.376 2.417 20 0 BEADRP C[C@H]1CCCC[C@H]1C[NH+]1CCC([NH3+])CC1 ZINC000042864227 177085241 /nfs/dbraw/zinc/08/52/41/177085241.db2.gz MSOIOGBQIGFUAE-RYUDHWBXSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@@H]1[C@@H](C)CCC[N@@H+]1CC1CC[NH2+]CC1 ZINC000050564933 177097863 /nfs/dbraw/zinc/09/78/63/177097863.db2.gz KCSAISMNIWUKGG-NWDGAFQWSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]1CCC[C@H]([NH2+]C2CC[NH2+]CC2)CC1 ZINC000235602739 177136285 /nfs/dbraw/zinc/13/62/85/177136285.db2.gz ULBIUFNMPDAOQF-RYUDHWBXSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]CC1(C2CC2)CCC1 ZINC000358351119 177233997 /nfs/dbraw/zinc/23/39/97/177233997.db2.gz JWINGNHVDHBKRN-GXTWGEPZSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H]1C[N@H+](CC[C@H]2CCC[NH2+]C2)C(C)(C)C1 ZINC000335664601 177254707 /nfs/dbraw/zinc/25/47/07/177254707.db2.gz UIYFUXVTSOJEHF-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP CCCCCC[C@H](CCCC)[NH2+]C[C@H](O)C[NH3+] ZINC001172510516 974864783 /nfs/dbraw/zinc/86/47/83/974864783.db2.gz DPTTUBHYIYECGO-UONOGXRCSA-N 2 0 244.423 2.425 20 0 BEADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCCCC[NH3+])C1 ZINC000020073479 177313034 /nfs/dbraw/zinc/31/30/34/177313034.db2.gz GDQBXGRTHSJATN-BETUJISGSA-N 2 0 212.381 2.483 20 0 BEADRP C[C@@H]1CN(C)C[C@H]1[NH2+][C@H]1C[C@H](C)C[C@H](C)C1 ZINC000309783310 177318443 /nfs/dbraw/zinc/31/84/43/177318443.db2.gz NLHWNDFAPVPTEC-XHJNMGKDSA-N 2 0 224.392 2.351 20 0 BEADRP C[C@H]1C[C@@H](C[NH3+])C[N@@H+]1Cc1ccc2c(c1)CCC2 ZINC000131760597 177324485 /nfs/dbraw/zinc/32/44/85/177324485.db2.gz OXGZFWVRIBTNJD-JSGCOSHPSA-N 2 0 244.382 2.344 20 0 BEADRP C[C@H]1C[C@@H](C[N@@H+]2CCCC2(C)C)CC[NH2+]1 ZINC000235698800 177324706 /nfs/dbraw/zinc/32/47/06/177324706.db2.gz SKCSDAHEWGIHIJ-RYUDHWBXSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@H]1C[C@@H](C[NH2+]C2(C)CCCC2)CC[NH2+]1 ZINC000235699915 177324936 /nfs/dbraw/zinc/32/49/36/177324936.db2.gz WWYNKOJFJWMGOR-RYUDHWBXSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]1C[C@@H]([NH3+])CC[N@@H+]1CC1CCCCC1 ZINC000049710735 177326815 /nfs/dbraw/zinc/32/68/15/177326815.db2.gz NFMMOBFVRUZEOH-AAEUAGOBSA-N 2 0 210.365 2.378 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CCc2ccccc2)CC[N@@H+]1C ZINC000129596795 177332093 /nfs/dbraw/zinc/33/20/93/177332093.db2.gz PFOBTMUVZQNKRG-ZFWWWQNUSA-N 2 0 232.371 2.301 20 0 BEADRP C[C@H](CN(C)C)[NH2+][C@H]1CC[C@@H](C)C[C@@H]1C ZINC000227605734 177356779 /nfs/dbraw/zinc/35/67/79/177356779.db2.gz GNCMUZWSUWGTTG-XQHKEYJVSA-N 2 0 212.381 2.351 20 0 BEADRP C[C@H]1C[C@H](C[N@@H+]2CCSC(C)(C)C2)CC[NH2+]1 ZINC000235662458 177362265 /nfs/dbraw/zinc/36/22/65/177362265.db2.gz SIMNHEALXOFQPG-NWDGAFQWSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H]1CC[C@H](C)[N@H+](C[C@@H]2CC[NH2+][C@@H](C)C2)C1 ZINC000235323484 177362851 /nfs/dbraw/zinc/36/28/51/177362851.db2.gz DWKNIUVZVJBHKL-ZOBORPQBSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H]1C[C@H]([NH3+])CC[N@@H+]1CCCc1ccccc1 ZINC000049713022 177365373 /nfs/dbraw/zinc/36/53/73/177365373.db2.gz MTTCZJGUWUHMSE-DZGCQCFKSA-N 2 0 232.371 2.431 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CCC2(F)CCC2)CC[N@@H+]1C ZINC000309808495 177369631 /nfs/dbraw/zinc/36/96/31/177369631.db2.gz SUFSYYKKHQJNID-NWDGAFQWSA-N 2 0 228.355 2.341 20 0 BEADRP C[C@H]1C[C@H]1C[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000309793532 177380740 /nfs/dbraw/zinc/38/07/40/177380740.db2.gz PRIYQOQKXAXYEY-RYUDHWBXSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@H](CN1CCCCCC1)[NH2+]C[C@@H]1C[C@@H]1C ZINC000336755672 177382054 /nfs/dbraw/zinc/38/20/54/177382054.db2.gz XUXMDDFHXMPAKK-MJBXVCDLSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1C[C@H]1C[NH2+]CCCCC[NH+]1CCCC1 ZINC000354235435 177382162 /nfs/dbraw/zinc/38/21/62/177382162.db2.gz GDKPETCAGNPGFQ-KBPBESRZSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H]1Cc2c(ncn2CCn2ccnc2)C[C@@H]1C ZINC000295070668 177391171 /nfs/dbraw/zinc/39/11/71/177391171.db2.gz CLNDHTDOYMPJSP-NWDGAFQWSA-N 2 0 244.342 2.151 20 0 BEADRP C[C@H]1CCC[C@H](CC[N@H+]2C[C@H]3C[NH2+]C[C@H]3C2)C1 ZINC000479767288 225192774 /nfs/dbraw/zinc/19/27/74/225192774.db2.gz AUVFLLAFSVICSF-LJISPDSOSA-N 2 0 236.403 2.354 20 0 BEADRP C[C@@H]1C[C@H]1C[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000488358712 225387383 /nfs/dbraw/zinc/38/73/83/225387383.db2.gz XZNGOGZDKFIUBI-ILXRZTDVSA-N 2 0 236.403 2.450 20 0 BEADRP C[C@@H]1C[C@@H](C[N@@H+]2CC[C@H](C3CC3)C2)CC[NH2+]1 ZINC000400041232 225345456 /nfs/dbraw/zinc/34/54/56/225345456.db2.gz PANXYSCYJMOLHQ-DYEKYZERSA-N 2 0 222.376 2.106 20 0 BEADRP C[C@H]1C[C@@H]1C[NH+]1CCC([NH+]2CCCC2)CC1 ZINC000488310163 225367278 /nfs/dbraw/zinc/36/72/78/225367278.db2.gz PQCORMYVNHRIFI-QWHCGFSZSA-N 2 0 222.376 2.203 20 0 BEADRP CC[N@H+](C[C@H](O)C[NH+](C)C(C)C)CC(C)(C)C ZINC000383610856 487647663 /nfs/dbraw/zinc/64/76/63/487647663.db2.gz SPCKFJQWGSOIEF-CYBMUJFWSA-N 2 0 244.423 2.056 20 0 BEADRP COCC(C)(C)C[NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000494080720 226260522 /nfs/dbraw/zinc/26/05/22/226260522.db2.gz VJLNAFWSTOVKIU-QWHCGFSZSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H]1OCC[C@@]1(C)[NH2+]CCC[NH+]1CCCCC1 ZINC000494218082 226262476 /nfs/dbraw/zinc/26/24/76/226262476.db2.gz ZVHFYAXECCEQCC-ZIAGYGMSSA-N 2 0 240.391 2.020 20 0 BEADRP C[C@H]([NH2+]CC1(C2CC2)CCC1)[C@H]1CCC[NH2+]1 ZINC000400359877 226341586 /nfs/dbraw/zinc/34/15/86/226341586.db2.gz PVOWQWDQDRHIGG-WCQYABFASA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)c1ccccn1 ZINC000400996302 226352552 /nfs/dbraw/zinc/35/25/52/226352552.db2.gz DYKGCZLYJLWKFG-RFQIPJPRSA-N 2 0 245.370 2.120 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)c1ccccn1 ZINC000400996304 226352553 /nfs/dbraw/zinc/35/25/53/226352553.db2.gz DYKGCZLYJLWKFG-XDQVBPFNSA-N 2 0 245.370 2.120 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)c1cccnc1 ZINC000401010786 226352611 /nfs/dbraw/zinc/35/26/11/226352611.db2.gz MGGWVYSVUITLCE-CYUUQNCZSA-N 2 0 245.370 2.120 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)c1ccncc1 ZINC000401035674 226352624 /nfs/dbraw/zinc/35/26/24/226352624.db2.gz YTZUPICPADDAGY-SPWCGHHHSA-N 2 0 245.370 2.120 20 0 BEADRP C(C[NH2+]C[C@H]1CCSC1)C[NH+]1CCCCC1 ZINC000163629914 262747333 /nfs/dbraw/zinc/74/73/33/262747333.db2.gz UGGZMXXAOLMDPI-CYBMUJFWSA-N 2 0 242.432 2.205 20 0 BEADRP [NH3+]C[C@@H]1C[N@H+](CCCF)C[C@H]1c1ccccc1 ZINC000305997012 229387415 /nfs/dbraw/zinc/38/74/15/229387415.db2.gz IBLYGQWNXDIKRZ-KGLIPLIRSA-N 2 0 236.334 2.020 20 0 BEADRP CC[C@H](C)C[N@H+](CC)C[C@@H](O)C[NH+](C)C(C)C ZINC000383842525 487677509 /nfs/dbraw/zinc/67/75/09/487677509.db2.gz ZQXQYXCBICDIEI-KBPBESRZSA-N 2 0 244.423 2.056 20 0 BEADRP CC[C@H](C)CC[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000394413134 487678985 /nfs/dbraw/zinc/67/89/85/487678985.db2.gz RNQDJJQAYLLJBD-RWMBFGLXSA-N 2 0 212.381 2.495 20 0 BEADRP Cc1cncc(C[N@@H+]2CCCC[C@@H]2CC[NH3+])c1 ZINC000228620252 487693385 /nfs/dbraw/zinc/69/33/85/487693385.db2.gz AQIABUZNKNIVIZ-CQSZACIVSA-N 2 0 233.359 2.093 20 0 BEADRP Cc1cncc(C[N@@H+]2CCCC[C@H]2CC[NH3+])c1 ZINC000228620259 487694266 /nfs/dbraw/zinc/69/42/66/487694266.db2.gz AQIABUZNKNIVIZ-AWEZNQCLSA-N 2 0 233.359 2.093 20 0 BEADRP CC(C)=CCC[NH2+][C@H]1CCCC[C@H]1C[NH3+] ZINC000397883438 262939086 /nfs/dbraw/zinc/93/90/86/262939086.db2.gz PAENZUPQOJKEAF-STQMWFEESA-N 2 0 210.365 2.450 20 0 BEADRP CCC[C@@H](C)[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000233279657 487704125 /nfs/dbraw/zinc/70/41/25/487704125.db2.gz IDVMMLVBKMBHLU-NEPJUHHUSA-N 2 0 210.365 2.439 20 0 BEADRP C[C@@H](C[NH+]1CCC(C)([NH3+])CC1)C(C)(C)C ZINC000309739893 487723088 /nfs/dbraw/zinc/72/30/88/487723088.db2.gz DCCJXSGKEKZVHR-NSHDSACASA-N 2 0 212.381 2.482 20 0 BEADRP CC[C@@]1(C)CCC[N@H+](C[C@@H]2CC[NH2+]C2)C1 ZINC000379462401 487734537 /nfs/dbraw/zinc/73/45/37/487734537.db2.gz UKWLVJVPNUJENT-OLZOCXBDSA-N 2 0 210.365 2.108 20 0 BEADRP CCO[C@@H]1C[C@@H]([NH2+]CC[C@@H]([NH3+])C(C)C)C1(C)C ZINC000233745028 487738965 /nfs/dbraw/zinc/73/89/65/487738965.db2.gz MGGQGSVJZRPOFW-JHJVBQTASA-N 2 0 242.407 2.153 20 0 BEADRP C[C@H]([N@H+](C)CC[C@H]1CC[NH2+]C1)C(C)(C)C ZINC000251027308 487746575 /nfs/dbraw/zinc/74/65/75/487746575.db2.gz GTOFTBSJCQXCOL-NWDGAFQWSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H]([NH2+]C1CCC([NH+](C)C)CC1)[C@@H]1CC1(F)F ZINC000666229497 487764363 /nfs/dbraw/zinc/76/43/63/487764363.db2.gz OTDYRUWBKJZLNR-XKGSQUFQSA-N 2 0 246.345 2.493 20 0 BEADRP CC[C@H]1C[N@H+](Cc2ccsc2)CC[C@H]1[NH3+] ZINC000251691383 487790395 /nfs/dbraw/zinc/79/03/95/487790395.db2.gz IKDYGKRRAHYDRX-NWDGAFQWSA-N 2 0 224.373 2.307 20 0 BEADRP CC[C@@H]1C[N@@H+]([C@H](C)c2ccccn2)CC[C@H]1[NH3+] ZINC000251884536 487805839 /nfs/dbraw/zinc/80/58/39/487805839.db2.gz VMGMNDIWKUHLMT-JHJVBQTASA-N 2 0 233.359 2.202 20 0 BEADRP [NH3+]CCC[N@@H+]1CCCCC[C@@H]1c1ccncc1 ZINC000414671210 487817296 /nfs/dbraw/zinc/81/72/96/487817296.db2.gz NJYRXTJMEMADEO-CQSZACIVSA-N 2 0 233.359 2.348 20 0 BEADRP C[C@@H](C[N@@H+]1CC[C@H]([NH3+])C[C@H]1C)C(C)(C)C ZINC000252152307 487819115 /nfs/dbraw/zinc/81/91/15/487819115.db2.gz OSQMGWAKOYHMCE-TUAOUCFPSA-N 2 0 212.381 2.480 20 0 BEADRP C[C@@H](C[N@@H+]1CC[C@@H]([NH3+])C[C@H]1C)C(C)(C)C ZINC000252152306 487819297 /nfs/dbraw/zinc/81/92/97/487819297.db2.gz OSQMGWAKOYHMCE-QJPTWQEYSA-N 2 0 212.381 2.480 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)CS1 ZINC000322749043 487821909 /nfs/dbraw/zinc/82/19/09/487821909.db2.gz WWRJRMKDDPJEJO-NZISVWNOSA-N 2 0 240.416 2.095 20 0 BEADRP COc1ccc2c(c1)C[C@@H](C)[N@@H+](CCC[NH3+])[C@H]2C ZINC000414753531 487821893 /nfs/dbraw/zinc/82/18/93/487821893.db2.gz DUHPAQMWWMJJBB-NEPJUHHUSA-N 2 0 248.370 2.352 20 0 BEADRP CC[N@H+](CCC[NH3+])[C@H](C)Cc1ccsc1 ZINC000414759525 487823124 /nfs/dbraw/zinc/82/31/24/487823124.db2.gz OQECBDWIVNABMI-LLVKDONJSA-N 2 0 226.389 2.350 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCC2CC[NH2+]CC2)[C@H]1C ZINC000386135597 487830162 /nfs/dbraw/zinc/83/01/62/487830162.db2.gz PLAITAHGQHYWDP-NTZNESFSSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]Cc1scnc1C1CC1 ZINC000415029017 487833920 /nfs/dbraw/zinc/83/39/20/487833920.db2.gz ZTUJLWNPCRLRTE-VIFPVBQESA-N 2 0 239.388 2.238 20 0 BEADRP CC[C@@H](C[NH2+]CCC[NH3+])Oc1ccccc1C ZINC000415074998 487835880 /nfs/dbraw/zinc/83/58/80/487835880.db2.gz DNOBIRUJYGBBPY-ZDUSSCGKSA-N 2 0 236.359 2.091 20 0 BEADRP CSc1cc(C)ccc1C[NH2+]CCC[NH3+] ZINC000415083338 487835747 /nfs/dbraw/zinc/83/57/47/487835747.db2.gz NBUINVVYPKHHMU-UHFFFAOYSA-N 2 0 224.373 2.155 20 0 BEADRP CC(C)CC[N@H+](C1CC1)C1CC[NH2+]CC1 ZINC000109454541 487866660 /nfs/dbraw/zinc/86/66/60/487866660.db2.gz ILEUZGUOURLIAU-UHFFFAOYSA-N 2 0 210.365 2.249 20 0 BEADRP CC1(C)CC[C@@H]([NH2+]C[C@@H]2CCC[NH2+]C2)C1 ZINC000128571049 487874164 /nfs/dbraw/zinc/87/41/64/487874164.db2.gz HZQXYCXIUNJGBC-VXGBXAGGSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H]1C[N@H+](CCC(C)(C)C)CC[C@H]1C[NH3+] ZINC000251773602 644821200 /nfs/dbraw/zinc/82/12/00/644821200.db2.gz MNOXUMAHZZXGNV-RYUDHWBXSA-N 2 0 212.381 2.339 20 0 BEADRP C[NH+](C)CCC[NH2+]Cc1ccc2cc[nH]c2c1 ZINC000083252266 487887009 /nfs/dbraw/zinc/88/70/09/487887009.db2.gz FIYWRVDXOWPJRN-UHFFFAOYSA-N 2 0 231.343 2.209 20 0 BEADRP Cc1cc(F)ccc1C[NH2+][C@H]1CCC[NH2+]CC1 ZINC000666855296 487890486 /nfs/dbraw/zinc/89/04/86/487890486.db2.gz LDNJWFNLDYXMBM-AWEZNQCLSA-N 2 0 236.334 2.366 20 0 BEADRP COCCC1(C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)CCC1 ZINC000666853121 487890807 /nfs/dbraw/zinc/89/08/07/487890807.db2.gz MXKPQFPIBHHGQE-QWHCGFSZSA-N 2 0 240.391 2.053 20 0 BEADRP COCCC1(C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)CCC1 ZINC000666853120 487891064 /nfs/dbraw/zinc/89/10/64/487891064.db2.gz MXKPQFPIBHHGQE-OLZOCXBDSA-N 2 0 240.391 2.053 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000666858014 487891729 /nfs/dbraw/zinc/89/17/29/487891729.db2.gz SVUPTBDQLGHCMX-NXEZZACHSA-N 2 0 238.297 2.449 20 0 BEADRP C(=C/c1ccccc1)\C[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000666952441 487891747 /nfs/dbraw/zinc/89/17/47/487891747.db2.gz WRDBHKRPTGLZAO-NFBGWVBBSA-N 2 0 242.366 2.432 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC[NH2+][C@H](C)C1)C(C)(C)C ZINC000666874265 487895316 /nfs/dbraw/zinc/89/53/16/487895316.db2.gz VZACDGQTFBRLQF-UTUOFQBUSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)C1CCC1 ZINC000666993712 487901928 /nfs/dbraw/zinc/90/19/28/487901928.db2.gz GCICGJIIJAOKGT-AAEUAGOBSA-N 2 0 222.376 2.439 20 0 BEADRP CCc1ccc(C[N@H+](C)CC2CN(C)C2)cc1 ZINC000668538265 487903208 /nfs/dbraw/zinc/90/32/08/487903208.db2.gz YHWCNNOUWNGISA-UHFFFAOYSA-N 2 0 232.371 2.242 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]Cc1ccc2cnccc2c1 ZINC000666942089 487908355 /nfs/dbraw/zinc/90/83/55/487908355.db2.gz NDBNIYWNOSOQSW-LBPRGKRZSA-N 2 0 243.354 2.452 20 0 BEADRP C[N@H+](CCC[NH3+])CCSc1ccccc1 ZINC000133196336 487912739 /nfs/dbraw/zinc/91/27/39/487912739.db2.gz AMAUDPYRHXMNLF-UHFFFAOYSA-N 2 0 224.373 2.059 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CC23CC[NH2+]CC3)s1 ZINC000666950832 487913413 /nfs/dbraw/zinc/91/34/13/487913413.db2.gz KXOOKWODYCQRSV-LBPRGKRZSA-N 2 0 236.384 2.288 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CC23CC[NH2+]CC3)cc1 ZINC000666950686 487913207 /nfs/dbraw/zinc/91/32/07/487913207.db2.gz BAPMGEBOPPZRPA-CQSZACIVSA-N 2 0 230.355 2.227 20 0 BEADRP Cc1ccc(F)cc1C[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000666953583 487914967 /nfs/dbraw/zinc/91/49/67/487914967.db2.gz BMJGZVPJVKAKKF-AWEZNQCLSA-N 2 0 248.345 2.366 20 0 BEADRP C[C@@H](C[NH2+][C@@H]1CC12CC[NH2+]CC2)C(C)(C)C ZINC000666955494 487917404 /nfs/dbraw/zinc/91/74/04/487917404.db2.gz RLNXLVHHFXDDBJ-NWDGAFQWSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H](CC1CCC1)[NH2+][C@H]1CC[C@H](C[NH3+])C1 ZINC000666963980 487919577 /nfs/dbraw/zinc/91/95/77/487919577.db2.gz UNEIISCTHULNNJ-WXHSDQCUSA-N 2 0 210.365 2.282 20 0 BEADRP CC1(C[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)CC1 ZINC000666993839 487923499 /nfs/dbraw/zinc/92/34/99/487923499.db2.gz NTTGLDXBIZLQSV-NSHDSACASA-N 2 0 208.349 2.051 20 0 BEADRP CC[C@H](C)C[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000666995622 487925356 /nfs/dbraw/zinc/92/53/56/487925356.db2.gz UJYWVKGVSCKPLI-RYUDHWBXSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]([NH3+])CN1CCc2ccc(F)cc2[C@H](C)C1 ZINC000652363291 487932727 /nfs/dbraw/zinc/93/27/27/487932727.db2.gz ACBPZOJQYCIBOG-GHMZBOCLSA-N 2 0 236.334 2.135 20 0 BEADRP C[NH2+]CCC[N@H+](C)Cc1ccc2cnccc2c1 ZINC000667054927 487934780 /nfs/dbraw/zinc/93/47/80/487934780.db2.gz IQYJOZKKSWNQGA-UHFFFAOYSA-N 2 0 243.354 2.276 20 0 BEADRP C[C@H]([NH2+][C@@H]1CS[C@H](C)C1)C1CC[NH+](C)CC1 ZINC000396470947 487935233 /nfs/dbraw/zinc/93/52/33/487935233.db2.gz XEBIOURAYRUCOU-MDZLAQPJSA-N 2 0 242.432 2.200 20 0 BEADRP C(C[NH2+][C@@H]1CCC[C@H]2C[C@H]21)C[NH+]1CCCC1 ZINC000304582207 322993111 /nfs/dbraw/zinc/99/31/11/322993111.db2.gz OHZMBUHPQPZXNM-BFHYXJOUSA-N 2 0 222.376 2.251 20 0 BEADRP CCC([NH3+])(CC)C[NH2+][C@@H]1CCC12CCOCC2 ZINC000562955746 323034890 /nfs/dbraw/zinc/03/48/90/323034890.db2.gz KMSQQBUOVBVNOA-GFCCVEGCSA-N 2 0 240.391 2.053 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CCC[NH2+]C1)c1ccoc1 ZINC000569833806 323042407 /nfs/dbraw/zinc/04/24/07/323042407.db2.gz AENDGVUMUWHBCK-VXGBXAGGSA-N 2 0 222.332 2.320 20 0 BEADRP COc1cc(C)ccc1[C@@H](C)[NH2+]C[C@H](C)C[NH3+] ZINC000570561979 323063145 /nfs/dbraw/zinc/06/31/45/323063145.db2.gz CDDBNDMLUBFNOD-VXGBXAGGSA-N 2 0 236.359 2.249 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]Cc2cnc3n2CCCC3)[C@@H]1C ZINC000570775942 323069901 /nfs/dbraw/zinc/06/99/01/323069901.db2.gz NZASTMZPOYDQIK-NQBHXWOUSA-N 2 0 233.359 2.354 20 0 BEADRP Cc1cccnc1C[N@@H+]1C[C@H](C[NH3+])[C@H](C)C[C@@H]1C ZINC000397254635 323077406 /nfs/dbraw/zinc/07/74/06/323077406.db2.gz FAYJGITWBMYPMX-RDBSUJKOSA-N 2 0 247.386 2.195 20 0 BEADRP CCC1(C[NH2+][C@H]2C[C@@H]([NH3+])c3ccccc32)COC1 ZINC000393961076 323098976 /nfs/dbraw/zinc/09/89/76/323098976.db2.gz DYKJLIPAHIAQCP-KGLIPLIRSA-N 2 0 246.354 2.147 20 0 BEADRP CC(C)[C@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)C1CC1 ZINC000571037686 323104443 /nfs/dbraw/zinc/10/44/43/323104443.db2.gz GQDCTTPLKDSUPP-JSGCOSHPSA-N 2 0 224.392 2.400 20 0 BEADRP Cc1cnc([C@@H](C)[NH+]2CCC(CC[NH3+])CC2)o1 ZINC000563275221 323107494 /nfs/dbraw/zinc/10/74/94/323107494.db2.gz JMDGWZJOQMXSFM-LLVKDONJSA-N 2 0 237.347 2.105 20 0 BEADRP C[C@H]1CC(C)(C)C[C@@H]1[NH2+]CC1CC[NH2+]CC1 ZINC000571394826 323143241 /nfs/dbraw/zinc/14/32/41/323143241.db2.gz PCKKCHLVYWXWGI-AAEUAGOBSA-N 2 0 224.392 2.400 20 0 BEADRP CC[C@@H]([NH2+]CCC[NH2+]C(C)C)C(C)C ZINC000571394854 323143330 /nfs/dbraw/zinc/14/33/30/323143330.db2.gz QNVNAKSUHUZXRC-GFCCVEGCSA-N 2 0 200.370 2.399 20 0 BEADRP Cc1cc(C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)cc(C)n1 ZINC000571462089 323145427 /nfs/dbraw/zinc/14/54/27/323145427.db2.gz PIBSKGOGBVGHSO-UONOGXRCSA-N 2 0 233.359 2.058 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@@H](C)COC(C)C)CC1 ZINC000571532047 323147159 /nfs/dbraw/zinc/14/71/59/323147159.db2.gz OLCOASBGPQPCML-ZDUSSCGKSA-N 2 0 242.407 2.121 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@@H]1CCC[C@@H](C)[C@H]1C ZINC000414956060 323152257 /nfs/dbraw/zinc/15/22/57/323152257.db2.gz MYDYOJBIRPJJCD-FDYHWXHSSA-N 2 0 212.381 2.399 20 0 BEADRP Cc1ccc(CCC[NH2+][C@H]2CCCN[C@H]2C)cn1 ZINC000414960164 323152300 /nfs/dbraw/zinc/15/23/00/323152300.db2.gz ULZQDYWNRPUHPO-ZFWWWQNUSA-N 2 0 247.386 2.053 20 0 BEADRP CC[C@H]1CCC[C@@H]1[NH2+]CCC[N@H+](C)CCOC ZINC000531940476 323155992 /nfs/dbraw/zinc/15/59/92/323155992.db2.gz ABPVOGTWFPBYOT-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP C[NH+]1CCC(C)(C[NH2+]CC2(C)CC2)CC1 ZINC000308966645 323182696 /nfs/dbraw/zinc/18/26/96/323182696.db2.gz WFQINCIIRQAAGN-UHFFFAOYSA-N 2 0 210.365 2.108 20 0 BEADRP Cc1ccncc1CN[C@@H](C)[C@H]1CCCC[NH2+]1 ZINC000395091941 323186962 /nfs/dbraw/zinc/18/69/62/323186962.db2.gz VFAIHQFWQRTACP-GXTWGEPZSA-N 2 0 233.359 2.010 20 0 BEADRP C(CC1CCCCC1)C[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC000395115360 323187569 /nfs/dbraw/zinc/18/75/69/323187569.db2.gz IREDKDHZTHIYSU-GASCZTMLSA-N 2 0 236.403 2.498 20 0 BEADRP CCc1ccc(CNC[C@H]2CCC[N@H+](C)C2)o1 ZINC000051724957 323190810 /nfs/dbraw/zinc/19/08/10/323190810.db2.gz NLYRHVPBKINLCC-GFCCVEGCSA-N 2 0 236.359 2.273 20 0 BEADRP CCC[C@H](C[NH2+][C@H]1CCCCC[C@@H]1[NH3+])OCC ZINC000530212961 323216520 /nfs/dbraw/zinc/21/65/20/323216520.db2.gz SHMQOPDYGWYGKS-RDBSUJKOSA-N 2 0 242.407 2.441 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]CC[C@H]1CCCOC1 ZINC000530212685 323216564 /nfs/dbraw/zinc/21/65/64/323216564.db2.gz RXEGVFGUMRKCIN-MGPQQGTHSA-N 2 0 240.391 2.053 20 0 BEADRP C1=CCC(C[NH2+][C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)C1 ZINC000530216530 323217163 /nfs/dbraw/zinc/21/71/63/323217163.db2.gz QBUPHBIZEAAUEM-RRFJBIMHSA-N 2 0 234.387 2.463 20 0 BEADRP CC[C@@H]1CCC[C@H]1[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000530221205 323218448 /nfs/dbraw/zinc/21/84/48/323218448.db2.gz OTNSCSGUROBYFI-UPJWGTAASA-N 2 0 222.376 2.439 20 0 BEADRP C[C@@H]1C[C@H]([NH3+])CC[N@@H+]1CC1CC(C)(C)C1 ZINC000530225310 323219041 /nfs/dbraw/zinc/21/90/41/323219041.db2.gz VNGCNHGMVONRSI-ZYHUDNBSSA-N 2 0 210.365 2.234 20 0 BEADRP CC(C)[C@H]([NH2+][C@H]1CC[NH2+]C12CCC2)C1CC1 ZINC000530225905 323219065 /nfs/dbraw/zinc/21/90/65/323219065.db2.gz XZJLQYZVELGMEI-STQMWFEESA-N 2 0 222.376 2.295 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H]2CC[N@@H+](C)C[C@@H]2C)o1 ZINC000532450370 323265133 /nfs/dbraw/zinc/26/51/33/323265133.db2.gz CVFGAVALJIIATO-SMDDNHRTSA-N 2 0 236.359 2.060 20 0 BEADRP CCC1(C[NH2+][C@@H]2CC[N@H+](C)C[C@@H]2C)CCC1 ZINC000122720565 324054503 /nfs/dbraw/zinc/05/45/03/324054503.db2.gz UAHJAVIUJKEGDE-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc(C[NH3+])cc1 ZINC000572522378 324189250 /nfs/dbraw/zinc/18/92/50/324189250.db2.gz AKUAIKWYEWXDIF-RISCZKNCSA-N 2 0 218.344 2.424 20 0 BEADRP C[C@@H]1C[C@@H](C)[N@H+](CC2CCCC2)C[C@@H]1C[NH3+] ZINC000397331359 324212168 /nfs/dbraw/zinc/21/21/68/324212168.db2.gz RBIVBSCRVIAOEI-BZPMIXESSA-N 2 0 224.392 2.482 20 0 BEADRP C[C@H](CCC1CC1)[NH2+][C@H]1CCC[NH2+]CC1 ZINC000398105718 324217817 /nfs/dbraw/zinc/21/78/17/324217817.db2.gz VNABIGHLEMQGTR-YPMHNXCESA-N 2 0 210.365 2.297 20 0 BEADRP COCCC1CC[NH+](C2CCC([NH3+])CC2)CC1 ZINC000530212636 324528805 /nfs/dbraw/zinc/52/88/05/324528805.db2.gz RIOIKOHQRPIKRD-UHFFFAOYSA-N 2 0 240.391 2.005 20 0 BEADRP CCC[C@H](C[NH2+][C@H]1CCC[C@H]([NH3+])C1)OCC ZINC000530214338 324530452 /nfs/dbraw/zinc/53/04/52/324530452.db2.gz XXNLDLBVCMBSHV-RWMBFGLXSA-N 2 0 228.380 2.051 20 0 BEADRP CC(C)Oc1ccc(C[NH2+][C@@H](C)CC[NH3+])cc1 ZINC000066147957 324737946 /nfs/dbraw/zinc/73/79/46/324737946.db2.gz UFZKVGPTUVZZOY-LBPRGKRZSA-N 2 0 236.359 2.301 20 0 BEADRP CCCC[NH+]1CCC([NH2+][C@H](C)COCC)CC1 ZINC000130018660 325004676 /nfs/dbraw/zinc/00/46/76/325004676.db2.gz JPIIFRVUSTWKMG-CYBMUJFWSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@@H](CN(C)C)[NH2+][C@@H]1CC[C@@H](C)[C@@H](C)C1 ZINC000130079885 325010591 /nfs/dbraw/zinc/01/05/91/325010591.db2.gz QWLHOFMKXYBXAW-MROQNXINSA-N 2 0 212.381 2.351 20 0 BEADRP CCC(CC)(CCO)[NH2+]CCC[NH+]1CCCC1 ZINC000548940975 325493608 /nfs/dbraw/zinc/49/36/08/325493608.db2.gz YEYDDULYYXCKAX-UHFFFAOYSA-N 2 0 242.407 2.003 20 0 BEADRP CC[C@@H](C)C[NH2+]C[C@H]1CC[C@H](C[NH3+])CC1 ZINC000253134662 325711162 /nfs/dbraw/zinc/71/11/62/325711162.db2.gz QULVLTCGCGLZED-JHJVBQTASA-N 2 0 212.381 2.387 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]C2CCC(F)(F)CC2)C1 ZINC000566483156 326056444 /nfs/dbraw/zinc/05/64/44/326056444.db2.gz ZHFNKSSXVBBWHK-GXSJLCMTSA-N 2 0 232.318 2.424 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H]2C[C@H]2C2CCC2)C1 ZINC000566630582 326070671 /nfs/dbraw/zinc/07/06/71/326070671.db2.gz XLBWRYQSSDPHKZ-MROQNXINSA-N 2 0 208.349 2.035 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCC[C@@H]([NH3+])C1)Oc1ccccc1 ZINC000567249496 326150736 /nfs/dbraw/zinc/15/07/36/326150736.db2.gz ICYIUSVSDIRJMI-MCIONIFRSA-N 2 0 248.370 2.313 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CC(C2CC2)C2CC2)CC[N@@H+]1C ZINC000156602532 326236825 /nfs/dbraw/zinc/23/68/25/326236825.db2.gz IUESWCRPDJRQHM-RISCZKNCSA-N 2 0 236.403 2.495 20 0 BEADRP [NH3+]Cc1ccc(C[NH2+][C@H]2CCCSC2)cc1 ZINC000567871129 326274076 /nfs/dbraw/zinc/27/40/76/326274076.db2.gz RKYRNHAQGWBIHT-ZDUSSCGKSA-N 2 0 236.384 2.131 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H]2CCCC[C@@H]2C[NH3+])cn1 ZINC000567889955 326277001 /nfs/dbraw/zinc/27/70/01/326277001.db2.gz OPVDTGUHLRFPOT-HUUCEWRRSA-N 2 0 247.386 2.040 20 0 BEADRP Cc1ccc(CC[NH2+][C@H]2CCCC[C@@H]2C[NH3+])cn1 ZINC000567889953 326277025 /nfs/dbraw/zinc/27/70/25/326277025.db2.gz OPVDTGUHLRFPOT-CABCVRRESA-N 2 0 247.386 2.040 20 0 BEADRP COC[C@H](C)[NH2+]CCCC[N@@H+]1CCCC[C@@H]1C ZINC000157897586 326299216 /nfs/dbraw/zinc/29/92/16/326299216.db2.gz TXPQUMGADNBVOA-KBPBESRZSA-N 2 0 242.407 2.266 20 0 BEADRP CC(C)[C@@H]([NH2+]CC1(C)CC[NH2+]CC1)C1CC1 ZINC000568252824 326335496 /nfs/dbraw/zinc/33/54/96/326335496.db2.gz DMVBWAPXKFGGBN-CYBMUJFWSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]CCc1ccc(F)c(F)c1 ZINC000568618325 326367661 /nfs/dbraw/zinc/36/76/61/326367661.db2.gz HBILANYQQHDPDJ-JTQLQIEISA-N 2 0 242.313 2.224 20 0 BEADRP C[NH+](C)CCCC[NH2+]Cc1ccc2c(n1)CCC2 ZINC000568966271 326383955 /nfs/dbraw/zinc/38/39/55/326383955.db2.gz VPWZVTBCXPVHCG-UHFFFAOYSA-N 2 0 247.386 2.002 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@@H]2CCc3c2cccc3O)C1 ZINC000573107549 326430083 /nfs/dbraw/zinc/43/00/83/326430083.db2.gz XRUMUZVHYPKKKG-JTNHKYCSSA-N 2 0 246.354 2.239 20 0 BEADRP c1ccc2c(N[C@@H]3CC[NH2+]C3)cc[nH+]c2c1 ZINC000052094010 487973686 /nfs/dbraw/zinc/97/36/86/487973686.db2.gz HBFJSDBVMBKXLQ-SNVBAGLBSA-N 2 0 213.284 2.009 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)o1 ZINC000677236878 488003986 /nfs/dbraw/zinc/00/39/86/488003986.db2.gz VLBTZYFYIMMGPE-KGLIPLIRSA-N 2 0 248.370 2.347 20 0 BEADRP CCCC[C@@H](C)[NH2+][C@@H](C)CC[NH+](C)C ZINC000049554152 488018418 /nfs/dbraw/zinc/01/84/18/488018418.db2.gz DLDYLXCBJIPGBJ-NEPJUHHUSA-N 2 0 200.370 2.495 20 0 BEADRP C[NH2+]CCC[N@H+](C)C[C@H](C)C(C)(C)C ZINC000388685207 488052470 /nfs/dbraw/zinc/05/24/70/488052470.db2.gz KHXOSIPEJALIRE-NSHDSACASA-N 2 0 200.370 2.210 20 0 BEADRP C[N@@H+]1CC[C@@H](NCc2ccccn2)CC1(C)C ZINC000084519279 488056943 /nfs/dbraw/zinc/05/69/43/488056943.db2.gz FXNAWHPZCGDJFC-GFCCVEGCSA-N 2 0 233.359 2.044 20 0 BEADRP [NH3+]C1CCC([NH2+][C@@H]2CCCc3cccnc32)CC1 ZINC000091661522 488058213 /nfs/dbraw/zinc/05/82/13/488058213.db2.gz UBQYWNVNPQSELO-JXQTWKCFSA-N 2 0 245.370 2.319 20 0 BEADRP Cc1cnc(CC[NH2+][C@@H](C)CCCC[NH3+])c(C)c1 ZINC000656200766 488067000 /nfs/dbraw/zinc/06/70/00/488067000.db2.gz QDMOZYCHMNZUBI-AWEZNQCLSA-N 2 0 249.402 2.348 20 0 BEADRP COc1c(C)cccc1C[NH2+][C@@H](C)C[C@@H](C)[NH3+] ZINC000656200805 488067047 /nfs/dbraw/zinc/06/70/47/488067047.db2.gz QZEJWNANYCYLTA-NEPJUHHUSA-N 2 0 236.359 2.219 20 0 BEADRP CC[C@H]1C[N@H+](CCc2ccccc2)CC[C@H]1[NH3+] ZINC000006780184 488089104 /nfs/dbraw/zinc/08/91/04/488089104.db2.gz JBWFBMMQKGBHTC-LSDHHAIUSA-N 2 0 232.371 2.288 20 0 BEADRP Cc1ccc([C@H]2CC[N@H+](CCC[NH3+])C2)cc1 ZINC000516423695 488099112 /nfs/dbraw/zinc/09/91/12/488099112.db2.gz QSLODHHDXYJZNA-AWEZNQCLSA-N 2 0 218.344 2.133 20 0 BEADRP C[C@@H]1C[C@H]([NH3+])CC[N@@H+]1C[C@@H]1CC[C@H]2C[C@H]2C1 ZINC000403375562 488122147 /nfs/dbraw/zinc/12/21/47/488122147.db2.gz KEHPKZWJWUMXPE-RKQHYHRCSA-N 2 0 222.376 2.234 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)C1 ZINC000667796576 488123234 /nfs/dbraw/zinc/12/32/34/488123234.db2.gz PJECVSPMODDHMB-APIJFGDWSA-N 2 0 236.403 2.497 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H]2CCC[C@@H]3C[C@@H]32)C1 ZINC000667796577 488123425 /nfs/dbraw/zinc/12/34/25/488123425.db2.gz PJECVSPMODDHMB-KBXIAJHMSA-N 2 0 236.403 2.497 20 0 BEADRP CCc1ccc(C(C)(C)C[NH2+]CCC[NH3+])cc1 ZINC000258698407 488128476 /nfs/dbraw/zinc/12/84/76/488128476.db2.gz GQRBJVITNCCKEI-UHFFFAOYSA-N 2 0 234.387 2.465 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)C[C@@H]1C[NH3+] ZINC000403676150 488130020 /nfs/dbraw/zinc/13/00/20/488130020.db2.gz VQKPSJBUTWGCDH-ZSAUSMIDSA-N 2 0 236.403 2.339 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCC[NH2+]CC1)C(C)(C)C ZINC000168781349 487540529 /nfs/dbraw/zinc/54/05/29/487540529.db2.gz CXXGZGWMBHMBAP-NEPJUHHUSA-N 2 0 212.381 2.400 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@H]1CCC[C@@H]2C[C@@H]21 ZINC000382425492 487543217 /nfs/dbraw/zinc/54/32/17/487543217.db2.gz YAYJLFNFVBABBH-RDBSUJKOSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1C[NH+](CCCC2CC[NH2+]CC2)C[C@H]1C ZINC000086015091 487471817 /nfs/dbraw/zinc/47/18/17/487471817.db2.gz OPUDMVATMFGQCF-CHWSQXEVSA-N 2 0 224.392 2.354 20 0 BEADRP CCN(CC[NH3+])Cc1cccc(C)c1C ZINC000231818905 487477000 /nfs/dbraw/zinc/47/70/00/487477000.db2.gz RROXPRWZRFFDRA-UHFFFAOYSA-N 2 0 206.333 2.084 20 0 BEADRP C[C@H](C[N@@H+]1CCC[C@H]2C[NH2+]C[C@H]21)C(C)(C)C ZINC000304355626 487488345 /nfs/dbraw/zinc/48/83/45/487488345.db2.gz XUXXISCHWDYECG-FRRDWIJNSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H](CC[NH3+])[NH2+]CC(C)(C)c1ccccc1 ZINC000220520991 487513414 /nfs/dbraw/zinc/51/34/14/487513414.db2.gz TUQSWORRRBRNEI-LBPRGKRZSA-N 2 0 220.360 2.291 20 0 BEADRP C[N@@H+]1CCC[C@@H](CC[NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)C1 ZINC000668236712 487518415 /nfs/dbraw/zinc/51/84/15/487518415.db2.gz UOSBEYXVALMPSV-LJISPDSOSA-N 2 0 236.403 2.497 20 0 BEADRP CC(C)CC[N@@H+]1CCC[C@H]([C@H]2CCC[NH2+]2)C1 ZINC000250543444 487734230 /nfs/dbraw/zinc/73/42/30/487734230.db2.gz CHFWAZGVJCVBOG-UONOGXRCSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]Cc1cccc2cnccc21 ZINC000666941519 487908790 /nfs/dbraw/zinc/90/87/90/487908790.db2.gz ZQRXDTGIMMICNR-GFCCVEGCSA-N 2 0 243.354 2.452 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]C[C@H](C)C(C)(C)C ZINC000379505422 488140726 /nfs/dbraw/zinc/14/07/26/488140726.db2.gz OHSDEIMVTWBVGW-WDEREUQCSA-N 2 0 200.370 2.386 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]C2CCC([NH+](C)C)CC2)CS1 ZINC000666207374 487935694 /nfs/dbraw/zinc/93/56/94/487935694.db2.gz AKGCBVCQAIVNMI-GMKTYKIGSA-N 2 0 242.432 2.343 20 0 BEADRP COc1ccc(C[N@H+](C)C[C@H]2CC[NH2+]C2)cc1C ZINC000259008570 488146703 /nfs/dbraw/zinc/14/67/03/488146703.db2.gz XKDASSUQFHPEOV-AWEZNQCLSA-N 2 0 248.370 2.045 20 0 BEADRP [NH3+]C[C@]12CCC[C@H]1C[N@H+](Cc1cccs1)C2 ZINC000390585847 488167757 /nfs/dbraw/zinc/16/77/57/488167757.db2.gz QRUYVOYMABJXJB-AAEUAGOBSA-N 2 0 236.384 2.309 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)C1 ZINC000400964846 488178379 /nfs/dbraw/zinc/17/83/79/488178379.db2.gz HEUYUPBNDSPMNW-CAEXGNQWSA-N 2 0 236.403 2.400 20 0 BEADRP CC(C)=CCC[C@H](C)[NH2+]CCOCC[NH+](C)C ZINC000683692303 488207688 /nfs/dbraw/zinc/20/76/88/488207688.db2.gz RVILNVMUNCPZDJ-AWEZNQCLSA-N 2 0 242.407 2.289 20 0 BEADRP Cc1ncc(C[NH+]2CC3(C2)CCCC3)n1C ZINC000668173811 488214042 /nfs/dbraw/zinc/21/40/42/488214042.db2.gz UCNPVGUVIFHHDC-UHFFFAOYSA-N 2 0 219.332 2.105 20 0 BEADRP C(C[N@H+]1CC[C@H]2C[NH2+]C[C@H]2CC1)C1CCC1 ZINC000398657920 488221388 /nfs/dbraw/zinc/22/13/88/488221388.db2.gz NKEUGSFADNMZNP-OKILXGFUSA-N 2 0 222.376 2.108 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](CCC3CCC3)C[C@H]21 ZINC000398648927 488221522 /nfs/dbraw/zinc/22/15/22/488221522.db2.gz KOQRZXPAAWOLSL-MGPQQGTHSA-N 2 0 222.376 2.236 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]2C[N@H+](CCC3CCC3)C[C@@H]21 ZINC000398648924 488221799 /nfs/dbraw/zinc/22/17/99/488221799.db2.gz KOQRZXPAAWOLSL-MELADBBJSA-N 2 0 222.376 2.236 20 0 BEADRP C/C(=C/c1ccccc1)C[NH+]1C[C@@H]2C[NH2+]C[C@H]2C1 ZINC000678343291 488243430 /nfs/dbraw/zinc/24/34/30/488243430.db2.gz PBPJUZAWZYWQDZ-PDDOBUOSSA-N 2 0 242.366 2.241 20 0 BEADRP CC(C)(C[NH+]1C[C@@H]2C[NH2+]C[C@H]2C1)c1ccccc1 ZINC000678844137 488289994 /nfs/dbraw/zinc/28/99/94/488289994.db2.gz VMMYBKDQLXDCAU-KBPBESRZSA-N 2 0 244.382 2.115 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H]2CCC(F)(F)C2)[C@@H](C)C1 ZINC000679073689 488305836 /nfs/dbraw/zinc/30/58/36/488305836.db2.gz NFROUMNEVSRKOK-TUAOUCFPSA-N 2 0 246.345 2.494 20 0 BEADRP CCC1([NH2+][C@H]2CCN(C)[C@H](C)C2)CCOCC1 ZINC000679152024 488313743 /nfs/dbraw/zinc/31/37/43/488313743.db2.gz XPBSZAUGHZZREQ-OLZOCXBDSA-N 2 0 240.391 2.018 20 0 BEADRP CCc1cc(N[C@@H](C)C2=CC[N@H+](C)CC2)ncn1 ZINC000679708767 488364984 /nfs/dbraw/zinc/36/49/84/488364984.db2.gz YADOFLQYMYPMLC-NSHDSACASA-N 2 0 246.358 2.101 20 0 BEADRP C[C@@H]1SCC[C@@H]1[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000220594063 490052071 /nfs/dbraw/zinc/05/20/71/490052071.db2.gz MJFNSLXGICIUJR-LOWDOPEQSA-N 2 0 240.416 2.097 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]CCCc1ccco1 ZINC000665283123 490096084 /nfs/dbraw/zinc/09/60/84/490096084.db2.gz HUBXCCCFQVXQMK-GXTWGEPZSA-N 2 0 236.359 2.319 20 0 BEADRP C(=C/C[N@H+]1CC=CCC1)\C[NH+]1CC=CCC1 ZINC000679322269 490113658 /nfs/dbraw/zinc/11/36/58/490113658.db2.gz YIXYOJUFEHVRFK-BQYQJAHWSA-N 2 0 218.344 2.066 20 0 BEADRP CO[C@H]1CCC[C@H]([NH2+]CCC[NH+]2CCCC2)C1 ZINC000070327815 490209710 /nfs/dbraw/zinc/20/97/10/490209710.db2.gz DDENLOHGDHQXED-KBPBESRZSA-N 2 0 240.391 2.020 20 0 BEADRP Cc1cccc(CC[NH2+][C@@H](C)C[C@H]2CCC[NH2+]2)n1 ZINC000415111187 490214803 /nfs/dbraw/zinc/21/48/03/490214803.db2.gz UCYNSSHDNIBOCN-DZGCQCFKSA-N 2 0 247.386 2.053 20 0 BEADRP C[C@H]([NH2+]C1CCC([NH3+])CC1)c1cncc(F)c1 ZINC000235495436 490293543 /nfs/dbraw/zinc/29/35/43/490293543.db2.gz VLZREOLNSXXZKJ-ALXWSUNGSA-N 2 0 237.322 2.141 20 0 BEADRP CC[C@@H](C)[N@H+](CC)CCC1CC[NH2+]CC1 ZINC000037113337 491078568 /nfs/dbraw/zinc/07/85/68/491078568.db2.gz TVDVLKIQNXTURS-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP CO[C@H](C[NH2+][C@H]1CCC[C@H]1[NH3+])C1CCCCC1 ZINC000665282855 491107873 /nfs/dbraw/zinc/10/78/73/491107873.db2.gz CVXHHSYHAKOWLD-HZSPNIEDSA-N 2 0 240.391 2.051 20 0 BEADRP CCCN1CC[C@H]([NH2+][C@@H]2C[C@H](C)[C@@H]2C)C1 ZINC000395093430 491125242 /nfs/dbraw/zinc/12/52/42/491125242.db2.gz CZTJNRPKEWMIEE-ZDEQEGDKSA-N 2 0 210.365 2.105 20 0 BEADRP CC(C)[C@H](C)C[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000156369553 491132077 /nfs/dbraw/zinc/13/20/77/491132077.db2.gz YKSVDSMVMMQRMJ-UPJWGTAASA-N 2 0 212.381 2.351 20 0 BEADRP COc1ccc(C[NH2+][C@H]2CCC[C@H]2C[NH3+])c(C)c1 ZINC000562960247 491133338 /nfs/dbraw/zinc/13/33/38/491133338.db2.gz LYJGHGILMKNJHJ-WFASDCNBSA-N 2 0 248.370 2.221 20 0 BEADRP CCN(CC)CC[NH2+][C@@H](C)CC1CCC1 ZINC000132052570 491133958 /nfs/dbraw/zinc/13/39/58/491133958.db2.gz AAGCFTZVPJMPAF-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@H](CC1CCC1)[NH2+]CC(C)(C)N(C)C ZINC000132048151 491133998 /nfs/dbraw/zinc/13/39/98/491133998.db2.gz SDMQPZIZUQDGSH-LLVKDONJSA-N 2 0 212.381 2.495 20 0 BEADRP CC1(C)CCC(C[NH+]2C[C@H]3C[NH2+]C[C@@H]3C2)CC1 ZINC000310147504 491160546 /nfs/dbraw/zinc/16/05/46/491160546.db2.gz OGTZZHDLIRRYIY-ZIAGYGMSSA-N 2 0 236.403 2.354 20 0 BEADRP C[C@H](CC1CC1)[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000400940944 533767495 /nfs/dbraw/zinc/76/74/95/533767495.db2.gz BEUXOMBTGKPRMC-VZZFWQQMSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CC=CCC1)[C@H]1CCC[NH2+]1 ZINC000400386910 533881060 /nfs/dbraw/zinc/88/10/60/533881060.db2.gz MCRKSBSPNHELHB-YNEHKIRRSA-N 2 0 208.349 2.073 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CC[C@@H](C)C1)[C@H]1CCC[NH2+]1 ZINC000400482274 533906981 /nfs/dbraw/zinc/90/69/81/533906981.db2.gz CIDSBBVCWATRED-MROQNXINSA-N 2 0 210.365 2.153 20 0 BEADRP CS[C@@H]1CCC[C@H]([NH2+][C@H](C)[C@H]2CCC[NH2+]2)C1 ZINC000400345500 533960884 /nfs/dbraw/zinc/96/08/84/533960884.db2.gz KDMVPOLFLCCCOR-YVECIDJPSA-N 2 0 242.432 2.391 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+][C@H](C)[C@@H]1CCC[NH2+]1 ZINC000400364943 534000591 /nfs/dbraw/zinc/00/05/91/534000591.db2.gz DRRIMISLMSPQNS-BZPMIXESSA-N 2 0 236.359 2.331 20 0 BEADRP C[C@H]([NH2+][C@H]1CCc2ccccc2C1)[C@H]1CCC[NH2+]1 ZINC000400347003 534012954 /nfs/dbraw/zinc/01/29/54/534012954.db2.gz HUVFUDUMNZSXJK-VBNZEHGJSA-N 2 0 244.382 2.274 20 0 BEADRP C[C@H]([NH2+][C@H]1CCc2ccccc21)[C@@H]1CC[NH2+]C1 ZINC000400342031 534013945 /nfs/dbraw/zinc/01/39/45/534013945.db2.gz GALZRROUMOETGW-LNSITVRQSA-N 2 0 230.355 2.262 20 0 BEADRP C[C@@H]1C[C@H]1C[NH+]1CCC([NH+]2CCCC2)CC1 ZINC000488310162 534021237 /nfs/dbraw/zinc/02/12/37/534021237.db2.gz PQCORMYVNHRIFI-OLZOCXBDSA-N 2 0 222.376 2.203 20 0 BEADRP CC[C@@H](COC)[NH2+]CCC[NH+]1CCC(C)CC1 ZINC000079707384 535761048 /nfs/dbraw/zinc/76/10/48/535761048.db2.gz QPTZJFQFFMUUIA-AWEZNQCLSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@H](c1ccccn1)[NH+]1CCC(C[NH+](C)C)CC1 ZINC000488401020 534143580 /nfs/dbraw/zinc/14/35/80/534143580.db2.gz VFOUKSUPEAVSOJ-CYBMUJFWSA-N 2 0 247.386 2.416 20 0 BEADRP CC[C@@H]1CCC[C@H]([NH2+]C2CC[NH2+]CC2)C1 ZINC000082847462 535822073 /nfs/dbraw/zinc/82/20/73/535822073.db2.gz QPHIHXAIXWEZPP-YPMHNXCESA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)C1CC1 ZINC000251378292 535946758 /nfs/dbraw/zinc/94/67/58/535946758.db2.gz SKLBFACROWMELS-IHRRRGAJSA-N 2 0 222.376 2.391 20 0 BEADRP C[C@@H]1OCC[C@]1(C)[NH2+]CCC[NH+]1CCCCC1 ZINC000494218079 534204955 /nfs/dbraw/zinc/20/49/55/534204955.db2.gz ZVHFYAXECCEQCC-KBPBESRZSA-N 2 0 240.391 2.020 20 0 BEADRP CCc1ccc(C[N@@H+]2CC[C@@H]3[NH2+]CC[C@@H]3C2)cc1 ZINC000261585233 536178715 /nfs/dbraw/zinc/17/87/15/536178715.db2.gz SWJQHFZZMYXRIT-CVEARBPZSA-N 2 0 244.382 2.433 20 0 BEADRP CC(C)(C)C[N@@H+]1C[C@@H]2CCC[C@@H]([NH3+])[C@H]2C1 ZINC000252877789 534605042 /nfs/dbraw/zinc/60/50/42/534605042.db2.gz WWFMSKPLNWUSJC-SDDRHHMPSA-N 2 0 210.365 2.092 20 0 BEADRP CC(C)C1(C[NH2+][C@@H](C)[C@@H]2CCC[NH2+]2)CC1 ZINC000400681887 527616031 /nfs/dbraw/zinc/61/60/31/527616031.db2.gz XBOPUHJXIZSUAN-RYUDHWBXSA-N 2 0 210.365 2.153 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+]C/C=C\c2ccncc2)C1 ZINC000486986779 527815343 /nfs/dbraw/zinc/81/53/43/527815343.db2.gz ZKHLNODXCAUKFB-ABCZVMIZSA-N 2 0 245.370 2.026 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH+](C)C[C@@H]2C[C@@H]2C)C[C@H]1C ZINC000488302147 527833013 /nfs/dbraw/zinc/83/30/13/527833013.db2.gz SEQJWIANPMUGFG-CRWXNKLISA-N 2 0 224.392 2.447 20 0 BEADRP CCC[N@H+](C)C[C@@H]1CC[NH+](C[C@H]2C[C@H]2C)C1 ZINC000488321745 527838063 /nfs/dbraw/zinc/83/80/63/527838063.db2.gz NRIMXTQTWXXTBZ-HZSPNIEDSA-N 2 0 224.392 2.306 20 0 BEADRP CCC[C@H](C)C[NH2+][C@H](C)[C@@H]1CCC[NH2+]C1 ZINC000414847549 528034398 /nfs/dbraw/zinc/03/43/98/528034398.db2.gz FSWLXOVYRCLVTL-YNEHKIRRSA-N 2 0 212.381 2.400 20 0 BEADRP CC(C)C[C@@H]([NH3+])C[N@@H+]1CC[C@H](C2CC2)C1 ZINC000400006186 528347776 /nfs/dbraw/zinc/34/77/76/528347776.db2.gz RLKLPELXYBQTEU-QWHCGFSZSA-N 2 0 210.365 2.092 20 0 BEADRP CCCC[N@H+](C)[C@@H]1CC[NH+](CC)C[C@@H]1C ZINC000174773427 528368783 /nfs/dbraw/zinc/36/87/83/528368783.db2.gz ALXVSQKROVXQKK-QWHCGFSZSA-N 2 0 212.381 2.449 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000400982820 529032741 /nfs/dbraw/zinc/03/27/41/529032741.db2.gz SXCBFSXDMKWVLG-RVMXOQNASA-N 2 0 222.376 2.153 20 0 BEADRP CCC(CC)[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000250372696 535081702 /nfs/dbraw/zinc/08/17/02/535081702.db2.gz AMBGMZFHRRFJPT-OLZOCXBDSA-N 2 0 210.365 2.391 20 0 BEADRP CC1(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)CC1 ZINC000222174275 535157866 /nfs/dbraw/zinc/15/78/66/535157866.db2.gz OVMULWGSSVCFKN-VXGBXAGGSA-N 2 0 208.349 2.003 20 0 BEADRP CC(C)[C@H]1CCCC[N@@H+]1C[C@H]1CCC[NH2+]C1 ZINC000257789558 535175988 /nfs/dbraw/zinc/17/59/88/535175988.db2.gz XGYZEFMDIWROOC-UONOGXRCSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H](C)C[N@H+](CC)C[C@@]1(C)CC[NH2+]C1 ZINC000223399873 535509558 /nfs/dbraw/zinc/50/95/58/535509558.db2.gz YSMFLGKSOAHNRM-OLZOCXBDSA-N 2 0 212.381 2.354 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H]1CCCOC1 ZINC000070463763 535522070 /nfs/dbraw/zinc/52/20/70/535522070.db2.gz NEONYGKSAVMAML-KGLIPLIRSA-N 2 0 242.407 2.266 20 0 BEADRP CC[NH+](CC)C[C@@H]1CCCC[C@@H]1[NH2+]CCOC ZINC000348309343 535577070 /nfs/dbraw/zinc/57/70/70/535577070.db2.gz FXHVBTOTABMMEX-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP CCS[C@H]1CC[C@H]([N@H+](C)CC(C)(C)[NH3+])C1 ZINC000261560082 535729436 /nfs/dbraw/zinc/72/94/36/535729436.db2.gz ZNJAYPDIJYZKSN-QWRGUYRKSA-N 2 0 230.421 2.330 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]C2CC(C)C2)[C@@H](C)C1 ZINC000222168807 535768849 /nfs/dbraw/zinc/76/88/49/535768849.db2.gz ZITIMHXPCDOWNA-MVKMKZAISA-N 2 0 210.365 2.105 20 0 BEADRP CC[C@]1(C)CC[N@H+](CC2CC[NH2+]CC2)C1 ZINC000261542675 535908941 /nfs/dbraw/zinc/90/89/41/535908941.db2.gz HDPHWVWEOUHSPO-CYBMUJFWSA-N 2 0 210.365 2.108 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)C1CC1 ZINC000130237047 535937623 /nfs/dbraw/zinc/93/76/23/535937623.db2.gz SKLBFACROWMELS-MCIONIFRSA-N 2 0 222.376 2.391 20 0 BEADRP CCc1ccc(C[N@@H+]2C[C@@H]3CC[C@H]([NH3+])[C@H]3C2)cc1 ZINC000261587433 536179570 /nfs/dbraw/zinc/17/95/70/536179570.db2.gz VBPDECJCQVLOEJ-JYJNAYRXSA-N 2 0 244.382 2.418 20 0 BEADRP CCc1ccc(C[N@@H+]2C[C@H](C[NH3+])C[C@H]2C)cc1 ZINC000252697448 536180053 /nfs/dbraw/zinc/18/00/53/536180053.db2.gz HMBKIVGFRFODGX-DOMZBBRYSA-N 2 0 232.371 2.418 20 0 BEADRP CC[C@H]1[C@@H](C)CC[N@@H+]1CC1CC[NH2+]CC1 ZINC000261546631 536181114 /nfs/dbraw/zinc/18/11/14/536181114.db2.gz LCGFSXSDRPPVDA-AAEUAGOBSA-N 2 0 210.365 2.106 20 0 BEADRP C[N@@H+]1CCCC[C@H]1CC[NH+]1CCCSCC1 ZINC000335934799 536357535 /nfs/dbraw/zinc/35/75/35/536357535.db2.gz NEQWBPHGMLWJBK-ZDUSSCGKSA-N 2 0 242.432 2.300 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+]CC1C(C)(C)C1(C)C ZINC000234713709 536593464 /nfs/dbraw/zinc/59/34/64/536593464.db2.gz YJGIKQFRCZNCNT-LLVKDONJSA-N 2 0 242.407 2.012 20 0 BEADRP CO[C@@H]1CC[C@H]([NH2+][C@H]2C[C@H]([NH3+])c3ccccc32)C1 ZINC000261576244 536706299 /nfs/dbraw/zinc/70/62/99/536706299.db2.gz NOAVOPBXPCMETB-JLUCKKNBSA-N 2 0 246.354 2.288 20 0 BEADRP COc1ccc([C@H](C)[NH2+][C@@H]2CC[NH2+]C[C@@H]2C)cc1 ZINC000261571451 536904872 /nfs/dbraw/zinc/90/48/72/536904872.db2.gz LBJOXEMJARCBEZ-SLEUVZQESA-N 2 0 248.370 2.344 20 0 BEADRP COc1ccc([C@H](C)[NH2+][C@@H]2CC[NH2+]C[C@H]2C)cc1 ZINC000261571453 536905425 /nfs/dbraw/zinc/90/54/25/536905425.db2.gz LBJOXEMJARCBEZ-TYNCELHUSA-N 2 0 248.370 2.344 20 0 BEADRP C[NH+]1CCC(C[NH+]2CCC(F)(F)CC2)CC1 ZINC000894177116 583327367 /nfs/dbraw/zinc/32/73/67/583327367.db2.gz RXCYSTCBMLLQGJ-UHFFFAOYSA-N 2 0 232.318 2.059 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+][C@@H]1CC[C@@H]1C1CC1 ZINC000854230548 588781044 /nfs/dbraw/zinc/78/10/44/588781044.db2.gz UGLFKWGYGXNSMS-JHJVBQTASA-N 2 0 210.365 2.138 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H]2CC[C@H]2C2CC2)C1 ZINC000348089609 582495756 /nfs/dbraw/zinc/49/57/56/582495756.db2.gz UBUDWFOKDOFFKN-SNPRPXQTSA-N 2 0 236.403 2.497 20 0 BEADRP [NH3+]Cc1cccc(-c2ccc3c(c2)CC[NH2+]C3)c1 ZINC000757218581 582562899 /nfs/dbraw/zinc/56/28/99/582562899.db2.gz UZSQPEKUMWLAJQ-UHFFFAOYSA-N 2 0 238.334 2.458 20 0 BEADRP C[NH+]1CCC(C[NH+](CC2CC2)CC2CC2)CC1 ZINC000892061064 582780021 /nfs/dbraw/zinc/78/00/21/582780021.db2.gz OEYAQUNNUCCWKX-UHFFFAOYSA-N 2 0 236.403 2.450 20 0 BEADRP CC[C@H]1C[C@@H](C[NH2+]CC2([NH3+])CCCC2)CCO1 ZINC000849349567 582849654 /nfs/dbraw/zinc/84/96/54/582849654.db2.gz AGYUFFFULSZEHO-STQMWFEESA-N 2 0 240.391 2.053 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2CCCC3(CC3)C2)CC1 ZINC000893663636 583190666 /nfs/dbraw/zinc/19/06/66/583190666.db2.gz JYDNCPGVAJYXAD-UHFFFAOYSA-N 2 0 222.376 2.204 20 0 BEADRP CCOc1ccc(CN(C)CCC[NH+](C)C)o1 ZINC000894451506 583463064 /nfs/dbraw/zinc/46/30/64/583463064.db2.gz MWNIRVPSWNSQAX-UHFFFAOYSA-N 2 0 240.347 2.062 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2C[C@@H](C3CC3)[C@H]2C2CC2)CC1 ZINC000894735104 583514314 /nfs/dbraw/zinc/51/43/14/583514314.db2.gz GJHKNPOCVHWLLA-JKSUJKDBSA-N 2 0 248.414 2.449 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2CC[C@@H](C3CCC3)C2)CC1 ZINC000894948834 583559287 /nfs/dbraw/zinc/55/92/87/583559287.db2.gz NVBKVHCUQIQPRP-OAHLLOKOSA-N 2 0 236.403 2.450 20 0 BEADRP CC1=CC[C@@H]([NH2+]CC[C@H](C)[NH+](C)C)CC1 ZINC000895294351 583638303 /nfs/dbraw/zinc/63/83/03/583638303.db2.gz UJYMSPDZZVTDMJ-QWHCGFSZSA-N 2 0 210.365 2.415 20 0 BEADRP C[C@@H](CC[NH2+]C1CC2(CCC2)C1)[NH+](C)C ZINC000895292575 583639181 /nfs/dbraw/zinc/63/91/81/583639181.db2.gz QECWLIXTGPKPHA-NSHDSACASA-N 2 0 210.365 2.249 20 0 BEADRP CC(C)[C@@H]1C[C@@H]([NH2+]CC[C@H](C)[NH+](C)C)CS1 ZINC000895293730 583639852 /nfs/dbraw/zinc/63/98/52/583639852.db2.gz KPPKZNQVOXOVQW-XQQFMLRXSA-N 2 0 244.448 2.446 20 0 BEADRP C[NH+]1CCC(C[NH2+]CC[C@@]2(C)CC2(F)F)CC1 ZINC000895379455 583662059 /nfs/dbraw/zinc/66/20/59/583662059.db2.gz BNPSLTAVAWRRID-LBPRGKRZSA-N 2 0 246.345 2.353 20 0 BEADRP C[N@H+](C[C@@H]1CC1(C)C)CC1CC[NH+](C)CC1 ZINC000895480450 583680203 /nfs/dbraw/zinc/68/02/03/583680203.db2.gz GZAQXPLISOORFD-ZDUSSCGKSA-N 2 0 224.392 2.306 20 0 BEADRP C[NH+]1CCC(C[N@H+]2C[C@@H]3CC=CC[C@@H]3C2)CC1 ZINC000895830471 583735500 /nfs/dbraw/zinc/73/55/00/583735500.db2.gz ZZQQOROKYAHCCN-GASCZTMLSA-N 2 0 234.387 2.226 20 0 BEADRP CC1=CC[C@H]([NH2+][C@@H]2CCN(C)[C@H]2C)CC1 ZINC000896555930 583811643 /nfs/dbraw/zinc/81/16/43/583811643.db2.gz SFECNPUGHGDLBH-RWMBFGLXSA-N 2 0 208.349 2.167 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+]CCc2cccnc2)CC1(C)C ZINC000858093436 588932396 /nfs/dbraw/zinc/93/23/96/588932396.db2.gz BFOIQCOEVJOOMU-CQSZACIVSA-N 2 0 247.386 2.087 20 0 BEADRP CC[C@H]([NH2+]CCN1CCC[C@@H]1C)[C@H]1C[C@H]1C ZINC000840725404 583934262 /nfs/dbraw/zinc/93/42/62/583934262.db2.gz AFLXCSBUCLNGSD-RFGFWPKPSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CC(C)(C)C2CC2)CC[N@@H+]1C ZINC000897437953 583983666 /nfs/dbraw/zinc/98/36/66/583983666.db2.gz QEFXKVLKTQNATL-YPMHNXCESA-N 2 0 224.392 2.495 20 0 BEADRP CCC[NH+]1CCC(C[NH2+]Cc2ccoc2)CC1 ZINC000729682006 584022606 /nfs/dbraw/zinc/02/26/06/584022606.db2.gz FSEKEOXSFSKLNV-UHFFFAOYSA-N 2 0 236.359 2.491 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H]2C[C@@H]3CCC[C@@H]23)[C@H](C)C1 ZINC000897955915 584065901 /nfs/dbraw/zinc/06/59/01/584065901.db2.gz YZUXVYCFHVOUNC-QKGCVVFFSA-N 2 0 236.403 2.495 20 0 BEADRP C[NH+](C)CC(C)(C)C[N@H+](C)C[C@@H]1CCSC1 ZINC000898307631 584109841 /nfs/dbraw/zinc/10/98/41/584109841.db2.gz DWMDOYPYMDYSKQ-LBPRGKRZSA-N 2 0 244.448 2.259 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@H]1C1CC1)C1CC[NH2+]CC1 ZINC000873271861 584128584 /nfs/dbraw/zinc/12/85/84/584128584.db2.gz MSEIFWBPFLXYLD-LEWSCRJBSA-N 2 0 222.376 2.153 20 0 BEADRP C(SC[C@@H]1CCCC[NH2+]C1)C1CC[NH2+]CC1 ZINC000899632610 584221948 /nfs/dbraw/zinc/22/19/48/584221948.db2.gz FTTLAKYIOWQMHU-CYBMUJFWSA-N 2 0 242.432 2.109 20 0 BEADRP CCCCOCC[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000902333801 584563318 /nfs/dbraw/zinc/56/33/18/584563318.db2.gz ODJPHAFPGAPXAC-ZDUSSCGKSA-N 2 0 242.407 2.171 20 0 BEADRP CS[C@@H](C)C[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000902360246 584571198 /nfs/dbraw/zinc/57/11/98/584571198.db2.gz HHHRRCKDFVMDAD-QWRGUYRKSA-N 2 0 230.421 2.106 20 0 BEADRP CS[C@@H](C)C[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000902360247 584571701 /nfs/dbraw/zinc/57/17/01/584571701.db2.gz HHHRRCKDFVMDAD-WDEREUQCSA-N 2 0 230.421 2.106 20 0 BEADRP C[C@@H]([NH2+]CC1([NH3+])CC1)[C@@H]1CCCC[C@H]1C ZINC000902406103 584574424 /nfs/dbraw/zinc/57/44/24/584574424.db2.gz LMMOPQLJEHVUGK-IJLUTSLNSA-N 2 0 210.365 2.282 20 0 BEADRP Cc1ccccc1C[C@H]([NH2+]CC1([NH3+])CC1)C1CC1 ZINC000902408232 584575689 /nfs/dbraw/zinc/57/56/89/584575689.db2.gz YLTLXMOKYSHYBJ-HNNXBMFYSA-N 2 0 244.382 2.397 20 0 BEADRP C[C@H]1Cc2ccccc2[C@H]1[NH2+]CC1([NH3+])CC1 ZINC000902412530 584576378 /nfs/dbraw/zinc/57/63/78/584576378.db2.gz COAZKEIRUIITQL-GWCFXTLKSA-N 2 0 216.328 2.001 20 0 BEADRP C[C@H](F)CC[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000902389131 584580544 /nfs/dbraw/zinc/58/05/44/584580544.db2.gz SDFJNGFAGQXRNM-WDEREUQCSA-N 2 0 216.344 2.102 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]([NH2+][C@H]2C=CCC2)C1 ZINC000902391567 584581737 /nfs/dbraw/zinc/58/17/37/584581737.db2.gz GYCQKXXUBCLVQA-NWDGAFQWSA-N 2 0 208.349 2.073 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]([NH2+]CC2=CCCC2)C1 ZINC000902395710 584585113 /nfs/dbraw/zinc/58/51/13/584585113.db2.gz FDRBFHYGGLTJSB-ZDUSSCGKSA-N 2 0 222.376 2.465 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H]2CCC[C@H](c3cccnc3)C2)CC1 ZINC000902405493 584588719 /nfs/dbraw/zinc/58/87/19/584588719.db2.gz IFCZLNSRRWGIOX-GXTWGEPZSA-N 2 0 245.370 2.189 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H]2CC[C@H]3CCCC[C@@H]3C2)CC1 ZINC000902415549 584589407 /nfs/dbraw/zinc/58/94/07/584589407.db2.gz IKKJRYSHNZHFME-JHJVBQTASA-N 2 0 222.376 2.426 20 0 BEADRP CC1(C)CC[C@H](CC[NH2+][C@@H]2CCC[C@H]2[NH3+])OC1 ZINC000902428303 584594350 /nfs/dbraw/zinc/59/43/50/584594350.db2.gz BKSLGMOXTKRTIF-JHJVBQTASA-N 2 0 240.391 2.051 20 0 BEADRP C[C@H]([NH2+]CC(C)(C)C1CC1)[C@H]1CCC[NH2+]1 ZINC000902430905 584595387 /nfs/dbraw/zinc/59/53/87/584595387.db2.gz JSJQPCLKMZIXFC-CMPLNLGQSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CC(C)(C)C1CCOCC1 ZINC000902432230 584595489 /nfs/dbraw/zinc/59/54/89/584595489.db2.gz ORGBKWRYIMIRCR-NWDGAFQWSA-N 2 0 242.407 2.155 20 0 BEADRP CC1(C)C[NH2+]C[C@@H]1[NH2+][C@@H]1CCC[C@H]1CCCF ZINC000902440837 584597114 /nfs/dbraw/zinc/59/71/14/584597114.db2.gz ARSOZOOVUFRAOL-XQQFMLRXSA-N 2 0 242.382 2.492 20 0 BEADRP CC(C)CC[C@H](C)[NH2+][C@H]1C[NH2+]CC1(C)C ZINC000902447320 584604764 /nfs/dbraw/zinc/60/47/64/584604764.db2.gz SHEATWHJHNQJGA-RYUDHWBXSA-N 2 0 212.381 2.399 20 0 BEADRP CCCC[C@@H]1CCC[C@@H]1[NH2+]CC1(N)CC1 ZINC000902414729 584600713 /nfs/dbraw/zinc/60/07/13/584600713.db2.gz ZWOITHJQOWGZHB-NEPJUHHUSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@@H](CCc1ccccc1)[NH2+]CC1(N)CC1 ZINC000902414984 584600762 /nfs/dbraw/zinc/60/07/62/584600762.db2.gz IRBNOCMSKNMLDL-LBPRGKRZSA-N 2 0 218.344 2.089 20 0 BEADRP C[C@@H](CC1CCCC1)[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902472211 584601326 /nfs/dbraw/zinc/60/13/26/584601326.db2.gz ZAIFDBNFCMJPHW-SCUASFONSA-N 2 0 222.376 2.438 20 0 BEADRP C[C@@H]1CCCC[C@H]1[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902472722 584601468 /nfs/dbraw/zinc/60/14/68/584601468.db2.gz GFJVSAVZOJHVKI-NJMOYASZSA-N 2 0 208.349 2.048 20 0 BEADRP C[C@@H]1CCC[C@H](C)[C@H]1[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902474615 584601820 /nfs/dbraw/zinc/60/18/20/584601820.db2.gz GFSBCSXKHDJQJH-WZBKEBKWSA-N 2 0 222.376 2.294 20 0 BEADRP C[C@H]1CCC[C@H](C)C1[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902474613 584601957 /nfs/dbraw/zinc/60/19/57/584601957.db2.gz GFSBCSXKHDJQJH-IEECTRCBSA-N 2 0 222.376 2.294 20 0 BEADRP C[C@@H](CCC(F)(F)F)[NH2+][C@@H]1C[NH2+]CC1(C)C ZINC000902448171 584605111 /nfs/dbraw/zinc/60/51/11/584605111.db2.gz DGUBIMPOVBTSPN-DTWKUNHWSA-N 2 0 238.297 2.305 20 0 BEADRP CC(C)[C@@H]1CCC[C@H]1[NH2+][C@H]1C[NH2+]CC1(C)C ZINC000902448691 584605390 /nfs/dbraw/zinc/60/53/90/584605390.db2.gz HAOQPMKTGGHQID-XQQFMLRXSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCSC(C)(C)C1)[C@H]1CCC[NH2+]1 ZINC000902450046 584606289 /nfs/dbraw/zinc/60/62/89/584606289.db2.gz CBWZHSFVSQGIST-IJLUTSLNSA-N 2 0 242.432 2.391 20 0 BEADRP CC1(C)C[C@H]([NH2+][C@H]2CCC[C@@H]2C[NH3+])CCS1 ZINC000902451178 584606598 /nfs/dbraw/zinc/60/65/98/584606598.db2.gz GHFLTWQNMPIBIO-UTUOFQBUSA-N 2 0 242.432 2.378 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H]1CCCC2(CC2)C1 ZINC000902450398 584606909 /nfs/dbraw/zinc/60/69/09/584606909.db2.gz DBYLETOSIKYIDH-SDDRHHMPSA-N 2 0 210.365 2.425 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+][C@@H]2C[C@H]3CCC[C@H]32)C12CCC2 ZINC000902452732 584608275 /nfs/dbraw/zinc/60/82/75/584608275.db2.gz AEIVYXGISBFGHQ-VEGXAWMVSA-N 2 0 220.360 2.035 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CCC(F)(F)C1)C1C[NH2+]C1 ZINC000902457583 584610557 /nfs/dbraw/zinc/61/05/57/584610557.db2.gz UWXWUVWIWKWNPF-ZJUUUORDSA-N 2 0 232.318 2.009 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+][C@@H]1C[C@@H]2CCC[C@@H]12 ZINC000902458638 584611041 /nfs/dbraw/zinc/61/10/41/584611041.db2.gz WWWFSEWJTOXJDG-XHJNMGKDSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H]1CC(C)(C)C[C@H]1[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902464831 584613188 /nfs/dbraw/zinc/61/31/88/584613188.db2.gz DCLJUSHROQSXBY-OBPIAQAESA-N 2 0 222.376 2.294 20 0 BEADRP C[C@]12C[C@H]1CCC[C@H]2[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902465120 584613257 /nfs/dbraw/zinc/61/32/57/584613257.db2.gz DZBVBHPPWSCAGK-LEZGYBIHSA-N 2 0 220.360 2.048 20 0 BEADRP CC[C@H]1CCC[C@@H]([NH2+][C@@H]2C[C@@H]3CC[C@H]2[NH2+]3)C1 ZINC000902465009 584613333 /nfs/dbraw/zinc/61/33/33/584613333.db2.gz FOPVYEHJMIKGJA-MEBFFEOJSA-N 2 0 222.376 2.438 20 0 BEADRP C[C@@H]1CC[C@@H](C)[C@H]([NH2+][C@@H]2C[C@H]3CC[C@@H]2[NH2+]3)C1 ZINC000902469165 584615775 /nfs/dbraw/zinc/61/57/75/584615775.db2.gz YLNXSWLIRCAFNO-YOVYLDAJSA-N 2 0 222.376 2.294 20 0 BEADRP CC[C@H]([NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2)C1CCC1 ZINC000902470443 584616376 /nfs/dbraw/zinc/61/63/76/584616376.db2.gz XNLQRWCRSAIUBM-WUHRBBMRSA-N 2 0 208.349 2.048 20 0 BEADRP CC1(C)CCC[C@@H]([NH2+][C@@H]2C[C@@H]3CC[C@H]2[NH2+]3)C1 ZINC000902472138 584617140 /nfs/dbraw/zinc/61/71/40/584617140.db2.gz XSDFSQOXSRAFFX-UMSGYPCISA-N 2 0 222.376 2.438 20 0 BEADRP CC[C@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1ccccc1 ZINC000902490060 584617363 /nfs/dbraw/zinc/61/73/63/584617363.db2.gz UZHDGSJFBZPDGD-UBHSHLNASA-N 2 0 218.344 2.465 20 0 BEADRP COc1ccc([C@H](C)[NH2+][C@H]2C[C@H](C[NH3+])C2)cc1 ZINC000902490556 584618235 /nfs/dbraw/zinc/61/82/35/584618235.db2.gz WRUMPRGUOIIXEN-GVXVVHGQSA-N 2 0 234.343 2.083 20 0 BEADRP C[C@@H]1CC=CC[C@H]1[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000902505794 584621498 /nfs/dbraw/zinc/62/14/98/584621498.db2.gz UCWOQSYDESEANA-FVCCEPFGSA-N 2 0 208.349 2.201 20 0 BEADRP C[C@H](CC1CC1)[NH2+]C[C@@H]1CCCCC[NH2+]1 ZINC000902481412 584624315 /nfs/dbraw/zinc/62/43/15/584624315.db2.gz CONKQZDVBPMGEV-YPMHNXCESA-N 2 0 210.365 2.297 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+]C(C2CCC2)C2CCC2)C1 ZINC000902483783 584624567 /nfs/dbraw/zinc/62/45/67/584624567.db2.gz BQLNBCLTCULNJM-MJHDQNEOSA-N 2 0 222.376 2.282 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+][C@H]2CCCc3c(O)cccc32)C1 ZINC000902485355 584624947 /nfs/dbraw/zinc/62/49/47/584624947.db2.gz JXRMYYWGZRSOIO-MJVIPROJSA-N 2 0 246.354 2.097 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+][C@H]2CCC[C@@H]2CCCF)C1 ZINC000902485676 584625468 /nfs/dbraw/zinc/62/54/68/584625468.db2.gz MKYLGOBVUYJVRM-LPWJVIDDSA-N 2 0 228.355 2.232 20 0 BEADRP CCOc1cccc([C@@H](C)[NH2+][C@H]2C[C@H](C[NH3+])C2)c1 ZINC000902486407 584625469 /nfs/dbraw/zinc/62/54/69/584625469.db2.gz GUGIUKHDMZJIMK-YRGRVCCFSA-N 2 0 248.370 2.473 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@H]([NH2+][C@H]2C[C@H](C[NH3+])C2)C1 ZINC000902486127 584625540 /nfs/dbraw/zinc/62/55/40/584625540.db2.gz PWEUGWCPUMLQNC-NZEXEKPDSA-N 2 0 210.365 2.138 20 0 BEADRP CC1(C)CCC[C@@H]([NH2+][C@H]2C[C@H](C[NH3+])C2)C1 ZINC000902486744 584626167 /nfs/dbraw/zinc/62/61/67/584626167.db2.gz RRTOKVMTCQKFEW-IJLUTSLNSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+]C2C3CC4CC(C3)CC2C4)C1 ZINC000902488125 584626828 /nfs/dbraw/zinc/62/68/28/584626828.db2.gz KVBRIQUPLBZHFG-JJAJUMEASA-N 2 0 234.387 2.138 20 0 BEADRP CCOc1ccccc1[C@@H](C)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902488046 584626944 /nfs/dbraw/zinc/62/69/44/584626944.db2.gz IVSFMXQLHAHSSA-JHJVBQTASA-N 2 0 248.370 2.473 20 0 BEADRP COc1ccccc1[C@H](C)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902488806 584627257 /nfs/dbraw/zinc/62/72/57/584627257.db2.gz NZGULVJEMBYVHG-SRVKXCTJSA-N 2 0 234.343 2.083 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+][C@@H](c2cccnc2)C2CCC2)C1 ZINC000902488685 584627389 /nfs/dbraw/zinc/62/73/89/584627389.db2.gz ZXPOEUDHBOSTFI-KCPJHIHWSA-N 2 0 245.370 2.250 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+]C2CCCCCCC2)C1 ZINC000902489377 584627476 /nfs/dbraw/zinc/62/74/76/584627476.db2.gz PVLOREDTTQRWJK-AULYBMBSSA-N 2 0 210.365 2.426 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@H](c2ccncc2)C2CC2)C1 ZINC000902513926 584629541 /nfs/dbraw/zinc/62/95/41/584629541.db2.gz IZDMQKKIRLXMGB-KFWWJZLASA-N 2 0 245.370 2.392 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H](c2ccncc2)C2CC2)C1 ZINC000902513927 584629668 /nfs/dbraw/zinc/62/96/68/584629668.db2.gz IZDMQKKIRLXMGB-QLFBSQMISA-N 2 0 245.370 2.392 20 0 BEADRP Cl/C=C\C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000902516015 584630228 /nfs/dbraw/zinc/63/02/28/584630228.db2.gz BROZXZFZGONTGT-KFKREVGDSA-N 2 0 228.767 2.249 20 0 BEADRP Cn1cncc1CC[NH2+]C1C[C@H]2CCC[C@@H]2C1 ZINC000902957539 584705850 /nfs/dbraw/zinc/70/58/50/584705850.db2.gz KEYOSOWOZRBNFU-VXGBXAGGSA-N 2 0 233.359 2.131 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H]2C[C@H]3CCC[C@H]3C2)C1 ZINC000903043421 584720976 /nfs/dbraw/zinc/72/09/76/584720976.db2.gz YQIQGFGGAYHBDW-ABWMFPBJSA-N 2 0 236.403 2.495 20 0 BEADRP CCCSC[C@@H](C)[NH2+]C[C@H](C)C[NH+](C)C ZINC000903174898 584732743 /nfs/dbraw/zinc/73/27/43/584732743.db2.gz OQKNOANJNSIIQI-NWDGAFQWSA-N 2 0 232.437 2.305 20 0 BEADRP C[C@@H]1C[C@H]1[C@@H]1C[C@H]1[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000903252498 584739109 /nfs/dbraw/zinc/73/91/09/584739109.db2.gz DITRWFOBDWPRHK-ULXLPNHUSA-N 2 0 234.387 2.247 20 0 BEADRP C[N@H+]1C[C@H]2CC[C@@H](C1)C2[NH2+][C@@H]1C[C@@H]2CCC[C@@H]12 ZINC000903319497 584746117 /nfs/dbraw/zinc/74/61/17/584746117.db2.gz VAKYJBIYYMWXEY-CYJZHVFYSA-N 2 0 234.387 2.105 20 0 BEADRP C[C@H](C1CC1)[N@H+](C[C@@H]1C[NH2+]C[C@H]1C)C1CC1 ZINC000903430785 584761431 /nfs/dbraw/zinc/76/14/31/584761431.db2.gz AXOMPJOMGIZJDB-WZRBSPASSA-N 2 0 222.376 2.105 20 0 BEADRP CC1(C)C[N@H+](C[C@@H]2CC[C@H]([NH3+])C2)C(C)(C)CO1 ZINC000903439956 584763273 /nfs/dbraw/zinc/76/32/73/584763273.db2.gz RKJVMGFCPSQBPD-NEPJUHHUSA-N 2 0 240.391 2.003 20 0 BEADRP [NH3+]C[C@@H]1CCC[N@H+](Cc2ccc3cc[nH]c3c2)C1 ZINC000903421307 584763642 /nfs/dbraw/zinc/76/36/42/584763642.db2.gz LCKBGZWSUJXKSI-ZDUSSCGKSA-N 2 0 243.354 2.339 20 0 BEADRP COc1ccccc1[C@H](C)[NH2+]C[C@@H]1CC[C@H]([NH3+])C1 ZINC000903458473 584765092 /nfs/dbraw/zinc/76/50/92/584765092.db2.gz AOVSCMAKTUQSSF-XQQFMLRXSA-N 2 0 248.370 2.473 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@H]1CCC[C@@H](C)[C@@H]1C ZINC000903458748 584765387 /nfs/dbraw/zinc/76/53/87/584765387.db2.gz IQQQTQUKVDARLN-DGTMBMJNSA-N 2 0 224.392 2.256 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1C[NH2+]C[C@H]1C)C1CCCC1 ZINC000903458814 584766174 /nfs/dbraw/zinc/76/61/74/584766174.db2.gz KJRKYEIRDVHKMM-WZRBSPASSA-N 2 0 210.365 2.010 20 0 BEADRP Cc1ccc2c(c1)C[N@H+](C[C@@H]1C[NH2+]C[C@H]1C)CC2 ZINC000903464053 584767490 /nfs/dbraw/zinc/76/74/90/584767490.db2.gz XVYRWZVYRYLUTE-CJNGLKHVSA-N 2 0 244.382 2.209 20 0 BEADRP C[C@@]1(C[NH3+])CC[N@H+](Cc2ccc3cc[nH]c3c2)C1 ZINC000903451569 584772155 /nfs/dbraw/zinc/77/21/55/584772155.db2.gz BJQYPTASIXUFSY-HNNXBMFYSA-N 2 0 243.354 2.339 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[N@@H+]2CCc3cc(F)ccc3C2)C1 ZINC000903454665 584773458 /nfs/dbraw/zinc/77/34/58/584773458.db2.gz HROZCRPRQVQGLI-XHDPSFHLSA-N 2 0 248.345 2.311 20 0 BEADRP C(CC1CCCC1)[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000903471216 584775209 /nfs/dbraw/zinc/77/52/09/584775209.db2.gz RXPCSTDKAUCDCV-ZDUSSCGKSA-N 2 0 222.376 2.441 20 0 BEADRP FCCCCC[NH2+][C@H]1CC[NH2+]C12CCCC2 ZINC000903483079 584778582 /nfs/dbraw/zinc/77/85/82/584778582.db2.gz CVMYDVWTKQEHQF-LBPRGKRZSA-N 2 0 228.355 2.391 20 0 BEADRP FCCCCC[NH2+][C@@H]1CC[NH2+]C12CCCC2 ZINC000903483078 584778837 /nfs/dbraw/zinc/77/88/37/584778837.db2.gz CVMYDVWTKQEHQF-GFCCVEGCSA-N 2 0 228.355 2.391 20 0 BEADRP CC(C)C[N@@H+](Cc1ccccn1)C[C@@H]1CC[NH2+]C1 ZINC000903575201 584783714 /nfs/dbraw/zinc/78/37/14/584783714.db2.gz HOMJRHJJJJOSDB-CQSZACIVSA-N 2 0 247.386 2.149 20 0 BEADRP C[C@H]([NH3+])C1CC[NH+](CC2CC(C)C2)CC1 ZINC000903716436 584791611 /nfs/dbraw/zinc/79/16/11/584791611.db2.gz MZRXKSLAPHYOAB-CXQJBGSLSA-N 2 0 210.365 2.092 20 0 BEADRP CC1CC(C[N@@H+]2CCC[C@H](CC[NH3+])C2)C1 ZINC000903748032 584795063 /nfs/dbraw/zinc/79/50/63/584795063.db2.gz YCEFAPYQNSUMIJ-OTTFEQOBSA-N 2 0 210.365 2.093 20 0 BEADRP CC1CC(C[N@@H+]2C[C@@H]3CCC[C@]3(C[NH3+])C2)C1 ZINC000903765414 584797294 /nfs/dbraw/zinc/79/72/94/584797294.db2.gz ZPHJQDNXPGSGKI-HOAMVYINSA-N 2 0 222.376 2.093 20 0 BEADRP CCC[N@@H+]1CCCC[C@H]1C1(C[NH3+])CCC1 ZINC000903811889 584803208 /nfs/dbraw/zinc/80/32/08/584803208.db2.gz POVGHXXFYYYSSV-LBPRGKRZSA-N 2 0 210.365 2.380 20 0 BEADRP [NH3+]CC1([C@H]2CCCC[N@@H+]2CC2CC2)CCC1 ZINC000903812153 584803615 /nfs/dbraw/zinc/80/36/15/584803615.db2.gz QZFNWYWXSYPEPP-CYBMUJFWSA-N 2 0 222.376 2.380 20 0 BEADRP C[C@H](C[NH2+][C@H]1C[NH2+]CC1(C)C)C(C)(C)C ZINC000903821641 584804125 /nfs/dbraw/zinc/80/41/25/584804125.db2.gz OLUXVRVWVAWKLL-MNOVXSKESA-N 2 0 212.381 2.256 20 0 BEADRP CCC(CC)C[N@@H+]1CCC[C@@]12CC[NH2+]C2 ZINC000903869227 584814868 /nfs/dbraw/zinc/81/48/68/584814868.db2.gz DVWVUTKSMRGUFU-ZDUSSCGKSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@@H]([NH2+]CC1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccccn1 ZINC000903928202 584824475 /nfs/dbraw/zinc/82/44/75/584824475.db2.gz XOIFGIWVOJFFFT-RLAWYHOSSA-N 2 0 245.370 2.263 20 0 BEADRP Cc1cc(C[NH2+]CCC(C)(C)[NH3+])cnc1Cl ZINC000903938927 584824842 /nfs/dbraw/zinc/82/48/42/584824842.db2.gz QPCHGQZIGSUDFE-UHFFFAOYSA-N 2 0 241.766 2.260 20 0 BEADRP CC(C)([NH3+])CC[NH2+]Cc1cnc(C2CC2)s1 ZINC000903938939 584825067 /nfs/dbraw/zinc/82/50/67/584825067.db2.gz QQCWRPCIKUXFBT-UHFFFAOYSA-N 2 0 239.388 2.238 20 0 BEADRP [NH3+][C@H](C[NH2+]CC1CCC(F)CC1)CC(F)F ZINC000903932104 584825231 /nfs/dbraw/zinc/82/52/31/584825231.db2.gz MJIVKVNZAQGNOK-RTBKNWGFSA-N 2 0 238.297 2.087 20 0 BEADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)NCCC(C)(C)[NH3+] ZINC000903939438 584825959 /nfs/dbraw/zinc/82/59/59/584825959.db2.gz HKQSTWLKVZNXHO-OLZOCXBDSA-N 2 0 241.423 2.014 20 0 BEADRP Cc1ncccc1C[NH2+]CC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000903934735 584825975 /nfs/dbraw/zinc/82/59/75/584825975.db2.gz JMFHKUPHPMHCDZ-LQDVMPOASA-N 2 0 245.370 2.010 20 0 BEADRP CC(C)([NH3+])CC[NH2+]Cc1cc(F)cc(F)c1 ZINC000903938676 584826364 /nfs/dbraw/zinc/82/63/64/584826364.db2.gz GWBPIGPUQOXCSA-UHFFFAOYSA-N 2 0 228.286 2.182 20 0 BEADRP CC1(F)CC[NH+](CC2C[C@H]3CC[C@@H](C2)[NH2+]3)CC1 ZINC000903937166 584826536 /nfs/dbraw/zinc/82/65/36/584826536.db2.gz CVTWABJHPIFUPK-YHWZYXNKSA-N 2 0 240.366 2.341 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1C[NH2+]CCC1(F)F ZINC000903957392 584827907 /nfs/dbraw/zinc/82/79/07/584827907.db2.gz QKOXLZPLIAKFOI-MXWKQRLJSA-N 2 0 232.318 2.009 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+]CCC(C)(C)[NH3+] ZINC000903939748 584829239 /nfs/dbraw/zinc/82/92/39/584829239.db2.gz LOLYALGLHDTNKE-MRVPVSSYSA-N 2 0 226.286 2.434 20 0 BEADRP C[C@H]1C[C@@H](C[NH2+]Cc2cc(C3CC3)no2)CC[NH2+]1 ZINC000903954096 584831394 /nfs/dbraw/zinc/83/13/94/584831394.db2.gz QAARVUBPEMDOAN-QWRGUYRKSA-N 2 0 249.358 2.030 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1C[NH2+]C[C@H]1C)C1CCC1 ZINC000903978298 584832957 /nfs/dbraw/zinc/83/29/57/584832957.db2.gz DOKYTGJXHYZNLV-NTZNESFSSA-N 2 0 210.365 2.010 20 0 BEADRP CC(C)CCC[C@H](C)[NH2+][C@@H]1C[NH2+]C[C@H]1C ZINC000903963860 584833325 /nfs/dbraw/zinc/83/33/25/584833325.db2.gz IABXRPMSTQARBD-FRRDWIJNSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+][C@H]1CCCC[C@@H]1C1CC1 ZINC000903963589 584833622 /nfs/dbraw/zinc/83/36/22/584833622.db2.gz BQFXGNDWFPURBZ-RUZUBIRVSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+][C@H]1CCCCC1(C)C ZINC000903964371 584834126 /nfs/dbraw/zinc/83/41/26/584834126.db2.gz OEILRYWFPLEBES-UTUOFQBUSA-N 2 0 210.365 2.153 20 0 BEADRP CCc1ccc(C[NH2+]C[C@@H]2C[NH2+]C[C@H]2C)cc1 ZINC000903963976 584834153 /nfs/dbraw/zinc/83/41/53/584834153.db2.gz BVNLGSKZWOFEBC-DOMZBBRYSA-N 2 0 232.371 2.194 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+][C@H]1CCC[C@@H](C2CC2)C1 ZINC000903965093 584834331 /nfs/dbraw/zinc/83/43/31/584834331.db2.gz ZWNMIGZRUZIJRT-RUZUBIRVSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+]C[C@@H]1CCCC[C@@H]1C ZINC000903967065 584834420 /nfs/dbraw/zinc/83/44/20/584834420.db2.gz GDMGLJRADQUVBC-CRWXNKLISA-N 2 0 224.392 2.258 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+]C[C@H]1CCCC[C@@H]1C ZINC000903964887 584834587 /nfs/dbraw/zinc/83/45/87/584834587.db2.gz XSQXRMDQZGUIFT-UMSGYPCISA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@H]1CCC[C@@H](C)C1 ZINC000903968397 584834881 /nfs/dbraw/zinc/83/48/81/584834881.db2.gz UYRZRRNUIYTUOR-NDBYEHHHSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H](C[NH2+]C[C@@H]1C[NH2+]C[C@H]1C)c1ccccc1 ZINC000903967735 584835159 /nfs/dbraw/zinc/83/51/59/584835159.db2.gz MNSMUVSTCGFMAN-GZBFAFLISA-N 2 0 232.371 2.235 20 0 BEADRP CC(C)[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000903968508 584835211 /nfs/dbraw/zinc/83/52/11/584835211.db2.gz XAAGGGOBUVJCKU-RFGFWPKPSA-N 2 0 224.392 2.256 20 0 BEADRP C[C@@H]1C[C@H](C[NH2+]C(C)(C)/C=C/Cl)CC[NH2+]1 ZINC000903988099 584836009 /nfs/dbraw/zinc/83/60/09/584836009.db2.gz NPKSAUBRCIXXEK-XIJCSBCJSA-N 2 0 230.783 2.495 20 0 BEADRP CC(C)[C@H](C)[N@H+](C[C@H]1C[C@@H]([NH3+])C1)C1CC1 ZINC000904301264 584861366 /nfs/dbraw/zinc/86/13/66/584861366.db2.gz CLIAEIGYUNQZMN-SDDRHHMPSA-N 2 0 210.365 2.233 20 0 BEADRP C[N@H+](C[C@@H]([NH3+])CCC(C)(C)C)CC1CC1 ZINC000904312155 584863049 /nfs/dbraw/zinc/86/30/49/584863049.db2.gz NACCSPIVKPZPJG-LBPRGKRZSA-N 2 0 212.381 2.482 20 0 BEADRP CC(C)[N@@H+](Cc1ccccn1)C[C@H]1C[C@@H]([NH3+])C1 ZINC000904313748 584863548 /nfs/dbraw/zinc/86/35/48/584863548.db2.gz ZIOSEUFMVNYTCO-BETUJISGSA-N 2 0 233.359 2.029 20 0 BEADRP CC(C)(C)[C@@H]1CCC[N@@H+]1C[C@H]1C[C@@H]([NH3+])C1 ZINC000904317482 584863888 /nfs/dbraw/zinc/86/38/88/584863888.db2.gz ZEKOXOARYRTTMR-TUAOUCFPSA-N 2 0 210.365 2.234 20 0 BEADRP C[C@@H]1CCC[C@@H](C)[N@H+](C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000904321655 584864011 /nfs/dbraw/zinc/86/40/11/584864011.db2.gz BAGFPDPJSWEANE-LPWJVIDDSA-N 2 0 210.365 2.234 20 0 BEADRP C[C@@H]1Cc2ccccc2C[N@@H+]1C[C@H]1C[C@@H]([NH3+])C1 ZINC000904323755 584864467 /nfs/dbraw/zinc/86/44/67/584864467.db2.gz RXPLEBMVAOTOHE-JMSVASOKSA-N 2 0 230.355 2.171 20 0 BEADRP C[N@H+](C[C@@H]([NH3+])CCC(C)(C)C)C[C@H]1CCOC1 ZINC000904326953 584865614 /nfs/dbraw/zinc/86/56/14/584865614.db2.gz UOTZOKFAWBKNDD-OLZOCXBDSA-N 2 0 242.407 2.108 20 0 BEADRP CC(C)(C)CC[C@@H]([NH3+])C[NH2+]C1(C)CCOCC1 ZINC000904329184 584865909 /nfs/dbraw/zinc/86/59/09/584865909.db2.gz MDWUAAXLLLFCGX-GFCCVEGCSA-N 2 0 242.407 2.299 20 0 BEADRP CC(C)([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1cccc(F)c1 ZINC000904328910 584866106 /nfs/dbraw/zinc/86/61/06/584866106.db2.gz IYEYYGVIQHDVOR-GSJFWJNXSA-N 2 0 236.334 2.388 20 0 BEADRP C[C@H]1COCCN(C[C@@H]([NH3+])CCC(C)(C)C)C1 ZINC000904340131 584866747 /nfs/dbraw/zinc/86/67/47/584866747.db2.gz DLXRAWBSOIZFEV-OLZOCXBDSA-N 2 0 242.407 2.108 20 0 BEADRP C[NH2+]Cc1ccc(NC[C@@]2(C)CCC[NH2+]C2)cc1 ZINC000904354276 584870144 /nfs/dbraw/zinc/87/01/44/584870144.db2.gz DCNQZSDCBNRYRN-HNNXBMFYSA-N 2 0 247.386 2.208 20 0 BEADRP Cc1cccc(OC[C@H](C)[NH2+]C[C@H]2C[C@@H]([NH3+])C2)c1 ZINC000904361937 584871837 /nfs/dbraw/zinc/87/18/37/584871837.db2.gz CMAJOLOCHBYEHJ-MELADBBJSA-N 2 0 248.370 2.089 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+]CCc2cc3ccccc3o2)C1 ZINC000904361155 584871906 /nfs/dbraw/zinc/87/19/06/584871906.db2.gz WPYRQRIBKONKPT-BJHJDKERSA-N 2 0 244.338 2.302 20 0 BEADRP CC(C)C[NH2+]C[C@@H]([NH3+])CCC(C)(C)C ZINC000904367523 584872894 /nfs/dbraw/zinc/87/28/94/584872894.db2.gz DMMLLJQPYURWON-NSHDSACASA-N 2 0 200.370 2.386 20 0 BEADRP CC(C)(C)CC[C@H]([NH3+])C[NH2+][C@H]1CCCOCC1 ZINC000904367528 584872905 /nfs/dbraw/zinc/87/29/05/584872905.db2.gz DQANOELGXLBOFU-STQMWFEESA-N 2 0 242.407 2.299 20 0 BEADRP Cc1cc(F)ccc1CC[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000904363456 584874292 /nfs/dbraw/zinc/87/42/92/584874292.db2.gz GAKFSHQIRXHRET-VDISTLRHSA-N 2 0 236.334 2.004 20 0 BEADRP Cc1cc(C)c(C[NH2+]C2CC(C[NH3+])C2)c(C)c1 ZINC000904366654 584874900 /nfs/dbraw/zinc/87/49/00/584874900.db2.gz OFPNOVOMSNAJIK-UHFFFAOYSA-N 2 0 232.371 2.439 20 0 BEADRP C[C@H](C[NH2+]C[C@]1(C)CCC[NH2+]C1)c1ccccn1 ZINC000904377396 584876290 /nfs/dbraw/zinc/87/62/90/584876290.db2.gz PTUHMDOGRZFEJC-UKRRQHHQSA-N 2 0 247.386 2.164 20 0 BEADRP CC1(F)CC[NH+](C[C@@]2(C)CCC[NH2+]C2)CC1 ZINC000904384427 584877152 /nfs/dbraw/zinc/87/71/52/584877152.db2.gz KKVNUUILBXUVMN-LBPRGKRZSA-N 2 0 228.355 2.200 20 0 BEADRP C[C@@H](C[NH2+]C[C@]1(C)CCC[NH2+]C1)c1ccncc1 ZINC000904381595 584877229 /nfs/dbraw/zinc/87/72/29/584877229.db2.gz ZLQWTGGBMSSBCL-DZGCQCFKSA-N 2 0 247.386 2.164 20 0 BEADRP [NH3+]CC1CC([NH2+][C@@H]2c3ccccc3CC[C@@H]2F)C1 ZINC000904386021 584877912 /nfs/dbraw/zinc/87/79/12/584877912.db2.gz MZEISRLQRYBSNO-TVSZOZCSSA-N 2 0 248.345 2.339 20 0 BEADRP COc1cc(C[N@@H+]2CC[C@@H](CC[NH3+])C2)ccc1C ZINC000904405796 584878445 /nfs/dbraw/zinc/87/84/45/584878445.db2.gz PTGLIRBYROJIRX-CYBMUJFWSA-N 2 0 248.370 2.174 20 0 BEADRP [NH3+]CC[C@H]1CC[N@H+](Cc2cccc3c2CCC3)C1 ZINC000904406270 584878695 /nfs/dbraw/zinc/87/86/95/584878695.db2.gz DKLIQDPFLWVDGP-ZDUSSCGKSA-N 2 0 244.382 2.346 20 0 BEADRP Cc1ccsc1C[N@@H+]1CC[C@@H](C[NH3+])[C@H](C)C1 ZINC000904411812 584879489 /nfs/dbraw/zinc/87/94/89/584879489.db2.gz NPSQALISNHPADP-NEPJUHHUSA-N 2 0 238.400 2.473 20 0 BEADRP C[C@@H]1C[N@H+](Cc2cccs2)CC[C@H]1C[NH3+] ZINC000904412842 584879735 /nfs/dbraw/zinc/87/97/35/584879735.db2.gz XTGVCKCWFCJMGY-MNOVXSKESA-N 2 0 224.373 2.165 20 0 BEADRP Cc1ccc2c(c1)CC[C@@H]2[NH2+]C[C@H](C)C[NH3+] ZINC000817962452 584992413 /nfs/dbraw/zinc/99/24/13/584992413.db2.gz MJLITHKGROVINV-RISCZKNCSA-N 2 0 218.344 2.167 20 0 BEADRP CSCCC[N@H+](C)CC1CC[NH+](C)CC1 ZINC000743848737 585140809 /nfs/dbraw/zinc/14/08/09/585140809.db2.gz CDAAXBLAWYVEFD-UHFFFAOYSA-N 2 0 230.421 2.013 20 0 BEADRP C[N@H+](CC1CC1)C[C@H]1CCN(C/C=C\Cl)C1 ZINC000747530973 585180326 /nfs/dbraw/zinc/18/03/26/585180326.db2.gz ASXONKRLFQMDAK-IUAZIXFQSA-N 2 0 242.794 2.403 20 0 BEADRP C[NH+](C)[C@@H]1CCCN(Cc2ccoc2)CC1 ZINC000763616965 585451420 /nfs/dbraw/zinc/45/14/20/585451420.db2.gz UGMDUHZQQSPGEC-CYBMUJFWSA-N 2 0 222.332 2.196 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCNc2ccccc2)CC[N@@H+]1C ZINC000766514473 585503755 /nfs/dbraw/zinc/50/37/55/585503755.db2.gz GSTYXIIECQKTHW-UKRRQHHQSA-N 2 0 247.386 2.171 20 0 BEADRP CCC[NH+]1CCC([NH2+]C2CC(C(F)F)C2)CC1 ZINC000768668061 585541766 /nfs/dbraw/zinc/54/17/66/585541766.db2.gz GCFFSEMOQWGJIM-UHFFFAOYSA-N 2 0 246.345 2.494 20 0 BEADRP C[C@@H](CCO)[NH2+]CCCCC[NH+]1CCCCC1 ZINC000779404455 585753524 /nfs/dbraw/zinc/75/35/24/585753524.db2.gz KTVWHTGFOBVVIP-AWEZNQCLSA-N 2 0 242.407 2.003 20 0 BEADRP C[C@H](C1CC1)[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C)C1 ZINC000782192941 585811411 /nfs/dbraw/zinc/81/14/11/585811411.db2.gz XDIGJUWYUZZWBJ-KWCYVHTRSA-N 2 0 222.376 2.201 20 0 BEADRP C[C@H](C1CC1)[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C)C1 ZINC000782192942 585811682 /nfs/dbraw/zinc/81/16/82/585811682.db2.gz XDIGJUWYUZZWBJ-MRVWCRGKSA-N 2 0 222.376 2.201 20 0 BEADRP C[C@@H](C[NH2+][C@H](C)[C@@H]1CCC[NH2+]1)C(C)(C)C ZINC000817893534 586834385 /nfs/dbraw/zinc/83/43/85/586834385.db2.gz FMSLVYFCBGGEGV-TUAOUCFPSA-N 2 0 212.381 2.399 20 0 BEADRP CS[C@@H]1CC[C@@H]([NH2+][C@@H](C)[C@@H]2CCCC[NH2+]2)C1 ZINC000817897222 586835006 /nfs/dbraw/zinc/83/50/06/586835006.db2.gz HGUTYKXJBXOMLM-LOWDOPEQSA-N 2 0 242.432 2.391 20 0 BEADRP CCC(CC)(C[NH2+][C@H]1CCC[C@H]1[NH3+])SC ZINC000817898428 586835298 /nfs/dbraw/zinc/83/52/98/586835298.db2.gz FOSMBZCTZRYCNB-MNOVXSKESA-N 2 0 230.421 2.378 20 0 BEADRP C[C@H]([NH2+]C1CC[NH2+]CC1)c1ccc2c(c1)CCO2 ZINC000817898891 586835655 /nfs/dbraw/zinc/83/56/55/586835655.db2.gz CECVIBNMIOEGFP-NSHDSACASA-N 2 0 246.354 2.024 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H](C)c1ccc2c(c1)CCO2 ZINC000817901502 586835672 /nfs/dbraw/zinc/83/56/72/586835672.db2.gz WNLOHSVNSYICEM-NEPJUHHUSA-N 2 0 248.370 2.400 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CCNc1ccccc1 ZINC000817899094 586836018 /nfs/dbraw/zinc/83/60/18/586836018.db2.gz CQAKVMFWXHIMGL-ZDUSSCGKSA-N 2 0 235.375 2.206 20 0 BEADRP Cc1ncc(CC[NH2+][C@@H](C)CCCC[NH3+])s1 ZINC000817916439 586839842 /nfs/dbraw/zinc/83/98/42/586839842.db2.gz ZNJKHGPIFUYNGK-JTQLQIEISA-N 2 0 241.404 2.101 20 0 BEADRP C[C@]1(C[NH2+][C@@H]2CCC[C@H]2[NH3+])CC1(Cl)Cl ZINC000817937826 586844331 /nfs/dbraw/zinc/84/43/31/586844331.db2.gz YGYXUYFBBUUCDJ-IWSPIJDZSA-N 2 0 237.174 2.040 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]C[C@]1(C)CC1(Cl)Cl ZINC000817937605 586844627 /nfs/dbraw/zinc/84/46/27/586844627.db2.gz SRHIGGCGZODMHT-YIZRAAEISA-N 2 0 239.190 2.286 20 0 BEADRP C[C@]1(C[NH2+][C@H]2CCC[C@H]2[NH3+])CC1(Cl)Cl ZINC000817937825 586844745 /nfs/dbraw/zinc/84/47/45/586844745.db2.gz YGYXUYFBBUUCDJ-HRDYMLBCSA-N 2 0 237.174 2.040 20 0 BEADRP C[C@@H]([NH2+]CC[C@H](C)[NH3+])c1ccnc(Cl)c1 ZINC000817953097 586848534 /nfs/dbraw/zinc/84/85/34/586848534.db2.gz MYPAPRREZMTJGR-DTWKUNHWSA-N 2 0 227.739 2.123 20 0 BEADRP CC[C@H]([NH2+]C[C@@H](C)C[NH3+])c1ccc2c(c1)CCO2 ZINC000817961986 586853471 /nfs/dbraw/zinc/85/34/71/586853471.db2.gz FTXYJVXFIRQFNX-FZMZJTMJSA-N 2 0 248.370 2.257 20 0 BEADRP C[C@@H](CSC(C)(C)C)[NH2+]CC1([NH3+])CCC1 ZINC000817964800 586853723 /nfs/dbraw/zinc/85/37/23/586853723.db2.gz JKUVXPOVOGYPBT-JTQLQIEISA-N 2 0 230.421 2.378 20 0 BEADRP COc1cc(C)c([C@H](C)[NH2+]CC2C[NH2+]C2)cc1C ZINC000817965339 586854333 /nfs/dbraw/zinc/85/43/33/586854333.db2.gz OSMKYRUXRXKOSN-LBPRGKRZSA-N 2 0 248.370 2.182 20 0 BEADRP C[C@H]([NH3+])C[NH2+][C@@H]1CC[C@@H]2CCCC[C@H]2C1 ZINC000817971267 586855913 /nfs/dbraw/zinc/85/59/13/586855913.db2.gz LNBBKTHCMGCMOI-ZDEQEGDKSA-N 2 0 210.365 2.282 20 0 BEADRP Cc1ccc2c(c1)CC[C@@H]2[NH2+]CC1=CC[NH2+]CC1 ZINC000817967199 586856263 /nfs/dbraw/zinc/85/62/63/586856263.db2.gz FMXYBQVJUIKKHG-INIZCTEOSA-N 2 0 242.366 2.492 20 0 BEADRP C[C@H](CSC(C)(C)C)[NH2+][C@H]1CC[NH2+]C[C@@H]1C ZINC000817972123 586859529 /nfs/dbraw/zinc/85/95/29/586859529.db2.gz TWQVAQQSGIGASU-TUAOUCFPSA-N 2 0 244.448 2.494 20 0 BEADRP C1CC1[C@H]1CC[C@@H]1[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000817984811 586862873 /nfs/dbraw/zinc/86/28/73/586862873.db2.gz AIYODOFAJSOFAU-MCIONIFRSA-N 2 0 234.387 2.439 20 0 BEADRP Cc1ccccc1OCC[NH2+][C@@H]1CCCC[C@H]1[NH3+] ZINC000818341188 586887287 /nfs/dbraw/zinc/88/72/87/586887287.db2.gz WNHFKIDJUVMVOV-ZIAGYGMSSA-N 2 0 248.370 2.233 20 0 BEADRP CO[C@@H]1CC[C@H]([NH+]2CCC([NH2+]C(C)C)CC2)C1 ZINC000821390352 587115607 /nfs/dbraw/zinc/11/56/07/587115607.db2.gz AFXDWTYFTXKLFW-UONOGXRCSA-N 2 0 240.391 2.016 20 0 BEADRP Cc1cc([C@H]2CCC[N@@H+]2CC2CC[NH2+]CC2)no1 ZINC000823578918 587232075 /nfs/dbraw/zinc/23/20/75/587232075.db2.gz KHWQFGVFCKDOHO-CQSZACIVSA-N 2 0 249.358 2.120 20 0 BEADRP C[NH2+]CCC[NH2+]Cc1ccc2c(c1)CC(C)(C)O2 ZINC000841042646 587938262 /nfs/dbraw/zinc/93/82/62/587938262.db2.gz OKSLHXZHPJHKIT-UHFFFAOYSA-N 2 0 248.370 2.099 20 0 BEADRP COc1cccc2cc(C[NH2+]C[C@H](C)C[NH3+])oc21 ZINC000841049234 587940169 /nfs/dbraw/zinc/94/01/69/587940169.db2.gz OXBXLQFAWFDIMH-SNVBAGLBSA-N 2 0 248.326 2.126 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]Cc1ccc(Cl)nc1 ZINC000841079907 587944971 /nfs/dbraw/zinc/94/49/71/587944971.db2.gz OGYPGXVFGXQJTA-SNVBAGLBSA-N 2 0 241.766 2.342 20 0 BEADRP CC(C)(C)[C@@H](C[NH3+])NCc1ccnc(Cl)c1 ZINC000842475115 588028871 /nfs/dbraw/zinc/02/88/71/588028871.db2.gz JVLPWGYQOHMRNB-SNVBAGLBSA-N 2 0 241.766 2.198 20 0 BEADRP COc1cccc2cc(C[N@H+](C)CCC[NH3+])oc21 ZINC000843050435 588076566 /nfs/dbraw/zinc/07/65/66/588076566.db2.gz HRMDKNDTYRRAPL-UHFFFAOYSA-N 2 0 248.326 2.222 20 0 BEADRP Cc1cccc2c1CC[N@H+](C[C@@]1(C)CC[NH2+]C1)C2 ZINC000843063895 588078684 /nfs/dbraw/zinc/07/86/84/588078684.db2.gz SWSBNAFLWCZITD-INIZCTEOSA-N 2 0 244.382 2.353 20 0 BEADRP CC[C@@H]1C[C@@H](C[NH2+]C2CCC([NH3+])CC2)CCO1 ZINC000843105558 588081571 /nfs/dbraw/zinc/08/15/71/588081571.db2.gz VXVAYWRUKZAPCB-GFJIZPEISA-N 2 0 240.391 2.051 20 0 BEADRP CC[C@H]1C[C@@H](C[NH+]2CCC(C)([NH3+])CC2)CCO1 ZINC000843108464 588081956 /nfs/dbraw/zinc/08/19/56/588081956.db2.gz SVVYMMRASSMVMI-STQMWFEESA-N 2 0 240.391 2.005 20 0 BEADRP CC[C@H]1C[C@@H](C[NH2+]CCCCCC[NH3+])CCO1 ZINC000843127990 588084938 /nfs/dbraw/zinc/08/49/38/588084938.db2.gz SNNPNCPPAAJNRN-KBPBESRZSA-N 2 0 242.407 2.300 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]Cc1cncc2ccccc21 ZINC000843127998 588085337 /nfs/dbraw/zinc/08/53/37/588085337.db2.gz GRGFQYNYFKDEHF-VXGBXAGGSA-N 2 0 243.354 2.450 20 0 BEADRP C[C@H]([NH2+]CCCCCC[NH3+])c1ccoc1 ZINC000843343704 588101556 /nfs/dbraw/zinc/10/15/56/588101556.db2.gz WUBXMABWFLVQHR-NSHDSACASA-N 2 0 210.321 2.449 20 0 BEADRP [NH3+]CCCCCC[NH2+][C@H]1CCC12CCC2 ZINC000843342961 588101619 /nfs/dbraw/zinc/10/16/19/588101619.db2.gz VVCUSFCIYKJLKK-LBPRGKRZSA-N 2 0 210.365 2.428 20 0 BEADRP C[NH2+]CCC[N@H+]1Cc2ccccc2[C@H](C)C1 ZINC000843355993 588103239 /nfs/dbraw/zinc/10/32/39/588103239.db2.gz ADQJVLGGCKJIRK-GFCCVEGCSA-N 2 0 218.344 2.215 20 0 BEADRP CC(C)C[C@@H]1COCC[N@@H+]1CCCCCC[NH3+] ZINC000846217914 588260659 /nfs/dbraw/zinc/26/06/59/588260659.db2.gz INGZJAPYLGKNPK-CQSZACIVSA-N 2 0 242.407 2.252 20 0 BEADRP CC(C)CO[C@@H]1CC[N@H+](CCCCCC[NH3+])C1 ZINC000846219694 588260740 /nfs/dbraw/zinc/26/07/40/588260740.db2.gz VYNFCHYXHWSPCQ-CQSZACIVSA-N 2 0 242.407 2.252 20 0 BEADRP [NH3+]C1C[C@H]2CCC[C@@H](C1)N2C/C=C\Cl ZINC000846219471 588260844 /nfs/dbraw/zinc/26/08/44/588260844.db2.gz BJVBAZDIWULMIU-CHCHCGSXSA-N 2 0 214.740 2.083 20 0 BEADRP Cl/C=C\C[N@@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1 ZINC000846221250 588261330 /nfs/dbraw/zinc/26/13/30/588261330.db2.gz VICACEDIOOXPKE-COGOEBJDSA-N 2 0 228.767 2.060 20 0 BEADRP Cc1cccc(F)c1C[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000848717399 588407970 /nfs/dbraw/zinc/40/79/70/588407970.db2.gz AOZNIMPUFCWLSQ-RYUDHWBXSA-N 2 0 236.334 2.494 20 0 BEADRP C[C@H](O)c1ccc(C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)cc1 ZINC000848717893 588408005 /nfs/dbraw/zinc/40/80/05/588408005.db2.gz XACUTDYKDVGZBW-NILFDRSVSA-N 2 0 248.370 2.099 20 0 BEADRP C[C@H](O)c1ccc(C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)cc1 ZINC000848717890 588408179 /nfs/dbraw/zinc/40/81/79/588408179.db2.gz XACUTDYKDVGZBW-GLQYFDAESA-N 2 0 248.370 2.099 20 0 BEADRP CC(C)c1ccccc1C[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC000848890624 588417835 /nfs/dbraw/zinc/41/78/35/588417835.db2.gz SUIIIZOLLCUMIT-GASCZTMLSA-N 2 0 244.382 2.461 20 0 BEADRP [NH3+]CCCCCCC[N@@H+]1CCC[C@@H]2OCC[C@@H]21 ZINC000852754903 588700724 /nfs/dbraw/zinc/70/07/24/588700724.db2.gz PRKOXUUFRPCFOA-KBPBESRZSA-N 2 0 240.391 2.149 20 0 BEADRP CCO[C@@H](C[N@H+](C)C1CCC([NH3+])CC1)C1CC1 ZINC000863541623 589297135 /nfs/dbraw/zinc/29/71/35/589297135.db2.gz KMXNHOBLSGPYJW-RUXDESIVSA-N 2 0 240.391 2.003 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1[NH2+][C@@H]1CC[C@H]1C(C)C ZINC000863543441 589297365 /nfs/dbraw/zinc/29/73/65/589297365.db2.gz OXWDWXLWTWXLPE-WUHRBBMRSA-N 2 0 210.365 2.151 20 0 BEADRP CC[C@H]([NH2+]CCOCCC[NH3+])C1CCCCC1 ZINC000863544774 589297788 /nfs/dbraw/zinc/29/77/88/589297788.db2.gz AQQVPPRBXUULJQ-AWEZNQCLSA-N 2 0 242.407 2.300 20 0 BEADRP CCc1cccc(CN(C)C[C@H](C)[NH3+])c1 ZINC000863568512 589300298 /nfs/dbraw/zinc/30/02/98/589300298.db2.gz NDBYFEZNQYRKAU-NSHDSACASA-N 2 0 206.333 2.028 20 0 BEADRP Cc1cc(C[NH2+][C@H]2CC[NH2+]CC(C)(C)C2)ccn1 ZINC000864054757 589335601 /nfs/dbraw/zinc/33/56/01/589335601.db2.gz AJEJNMHAHTWXKF-AWEZNQCLSA-N 2 0 247.386 2.258 20 0 BEADRP CCC(CC)NC(=[NH2+])NC[C@@H](C)[NH+](CC)CC ZINC000864454314 589365949 /nfs/dbraw/zinc/36/59/49/589365949.db2.gz WNXXZDHPIXLAKY-LLVKDONJSA-N 2 0 242.411 2.019 20 0 BEADRP CCC[N@H+](CC)CCNC(=[NH2+])NC(CC)CC ZINC000864456688 589367556 /nfs/dbraw/zinc/36/75/56/589367556.db2.gz JSQHSGIPJCLDOX-UHFFFAOYSA-N 2 0 242.411 2.021 20 0 BEADRP CC(C)[C@@](C)(C[NH3+])[NH2+]C[C@H]1CCC(C)(C)CO1 ZINC000866661828 589508593 /nfs/dbraw/zinc/50/85/93/589508593.db2.gz VOQUJQURKJSYJN-TZMCWYRMSA-N 2 0 242.407 2.155 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCC[C@H](OC2CCC2)CC1 ZINC000866696920 589512574 /nfs/dbraw/zinc/51/25/74/589512574.db2.gz CFPKQARUHMTRQU-AWEZNQCLSA-N 2 0 240.391 2.020 20 0 BEADRP CC(C)(C)[C@@]1(C[NH3+])CC[N@H+](CC2CC2)C1 ZINC000866709335 589514153 /nfs/dbraw/zinc/51/41/53/589514153.db2.gz WLLPYBLUEKSGOM-CYBMUJFWSA-N 2 0 210.365 2.093 20 0 BEADRP CC[C@H](C)[N@@H+]1CC[C@@](C[NH3+])(C(C)(C)C)C1 ZINC000866708238 589514817 /nfs/dbraw/zinc/51/48/17/589514817.db2.gz QGQNRHSHGFKIAT-AAEUAGOBSA-N 2 0 212.381 2.482 20 0 BEADRP CC[C@H](C)[N@@H+]1CC[C@](C[NH3+])(C(C)(C)C)C1 ZINC000866708243 589514863 /nfs/dbraw/zinc/51/48/63/589514863.db2.gz QGQNRHSHGFKIAT-WCQYABFASA-N 2 0 212.381 2.482 20 0 BEADRP C[C@@H]1C[N@H+](CCCCCCC[NH3+])CCS1 ZINC000123509124 589740441 /nfs/dbraw/zinc/74/04/41/589740441.db2.gz CQSQAISTYJCPID-GFCCVEGCSA-N 2 0 230.421 2.333 20 0 BEADRP CC(C)CC[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000872254318 589901036 /nfs/dbraw/zinc/90/10/36/589901036.db2.gz ZLNCBQMLFNHJBH-GFCCVEGCSA-N 2 0 212.381 2.400 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@]12CCC[C@H]1OCC2 ZINC000872315250 589909932 /nfs/dbraw/zinc/90/99/32/589909932.db2.gz QINBEMVLBJOIMF-KGLIPLIRSA-N 2 0 240.391 2.020 20 0 BEADRP C[NH+](C)[C@H]1CCCN(c2cc[nH+]cc2C2CC2)C1 ZINC000872441058 589939917 /nfs/dbraw/zinc/93/99/17/589939917.db2.gz GYTCLELSPHVYJM-ZDUSSCGKSA-N 2 0 245.370 2.489 20 0 BEADRP C[C@H]1C[C@@H](Nc2cc[nH+]cc2C2CC2)CC[N@@H+]1C ZINC000872463049 589942110 /nfs/dbraw/zinc/94/21/10/589942110.db2.gz HKKVXKVODPJSHG-AAEUAGOBSA-N 2 0 245.370 2.276 20 0 BEADRP C[NH+](C)C[C@H]1CCN(c2cc[nH+]cc2C2CC2)C1 ZINC000872506333 589945606 /nfs/dbraw/zinc/94/56/06/589945606.db2.gz SUKXLGSQCLVVGX-GFCCVEGCSA-N 2 0 245.370 2.347 20 0 BEADRP CN(C[C@@H]1CCC[N@@H+]1C)c1cc[nH+]cc1C1CC1 ZINC000872574063 589953654 /nfs/dbraw/zinc/95/36/54/589953654.db2.gz XUOXJMCTXYKPJO-ZDUSSCGKSA-N 2 0 245.370 2.489 20 0 BEADRP CC(C)(C)[NH2+]CCNc1ccc([C@@H]2C[C@H]2[NH3+])cc1 ZINC000873214278 589997157 /nfs/dbraw/zinc/99/71/57/589997157.db2.gz DCLUHFMNOJCSAV-UONOGXRCSA-N 2 0 247.386 2.301 20 0 BEADRP [NH3+][C@@H]1C[C@H]1c1ccc(N[C@@H]2CCC[C@H]([NH3+])C2)cc1 ZINC000873215651 589997861 /nfs/dbraw/zinc/99/78/61/589997861.db2.gz KKPWIHNPRZUTGO-PMOUVXMZSA-N 2 0 245.370 2.183 20 0 BEADRP CC(C)(C)[C@]1(C[NH3+])CC[N@H+](CC2(C)CC2)C1 ZINC000873223959 590001252 /nfs/dbraw/zinc/00/12/52/590001252.db2.gz VTVJESDEZYHQLR-AWEZNQCLSA-N 2 0 224.392 2.483 20 0 BEADRP c1nc(C[NH2+][C@H]2CCCCC23CC[NH2+]CC3)co1 ZINC000873232896 590002517 /nfs/dbraw/zinc/00/25/17/590002517.db2.gz QHNLPYCTVMXAFM-ZDUSSCGKSA-N 2 0 249.358 2.077 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CCSC1)[C@H]1CCCC[NH2+]1 ZINC000873236292 590003826 /nfs/dbraw/zinc/00/38/26/590003826.db2.gz VKZNJWIWFXPVHS-JHJVBQTASA-N 2 0 242.432 2.250 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]CC[C@@H]1CCSC1 ZINC000873234391 590003943 /nfs/dbraw/zinc/00/39/43/590003943.db2.gz CGPIEOKCHNKTJZ-JHJVBQTASA-N 2 0 242.432 2.379 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1CCCC[C@@H]1F ZINC000873239044 590005894 /nfs/dbraw/zinc/00/58/94/590005894.db2.gz MTQACTABOITQEF-GRYCIOLGSA-N 2 0 216.344 2.374 20 0 BEADRP CC[C@@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)C1CCCC1 ZINC000873250019 590007486 /nfs/dbraw/zinc/00/74/86/590007486.db2.gz OSKOBLVGVBUVOI-KGYLQXTDSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]1CC(C)(C)C[C@@H]1[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873248849 590007496 /nfs/dbraw/zinc/00/74/96/590007496.db2.gz FMQBQXHCGRBNAY-YFKTTZPYSA-N 2 0 210.365 2.138 20 0 BEADRP Cc1cc([C@H](C)[NH2+]C[C@H]2C[C@@H]([NH3+])C2)oc1C ZINC000873249296 590007644 /nfs/dbraw/zinc/00/76/44/590007644.db2.gz KJIHFODGPKADQG-ZMLRMANQSA-N 2 0 222.332 2.284 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1cccc(F)c1F ZINC000873249508 590007764 /nfs/dbraw/zinc/00/77/64/590007764.db2.gz AQPZWAMSRXHWQJ-LPEHRKFASA-N 2 0 240.297 2.353 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CC(C)(C)C(C)(F)F ZINC000873251030 590008427 /nfs/dbraw/zinc/00/84/27/590008427.db2.gz IAYTZBGAEIGCFJ-BDAKNGLRSA-N 2 0 222.323 2.383 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CC(C)(C)C(C)(F)F ZINC000873251032 590008542 /nfs/dbraw/zinc/00/85/42/590008542.db2.gz IAYTZBGAEIGCFJ-IUCAKERBSA-N 2 0 222.323 2.383 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@@H]2CCCNc3ccccc32)C1 ZINC000873251783 590008806 /nfs/dbraw/zinc/00/88/06/590008806.db2.gz OFFIOEDLNONAHT-TYNCELHUSA-N 2 0 245.370 2.260 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)C1C(C)(C)C1(C)C ZINC000873252432 590008825 /nfs/dbraw/zinc/00/88/25/590008825.db2.gz RQVOTLGSLGEAKX-MXWKQRLJSA-N 2 0 224.392 2.384 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@H]2CCCNc3ccccc32)C1 ZINC000873251785 590008972 /nfs/dbraw/zinc/00/89/72/590008972.db2.gz OFFIOEDLNONAHT-ZOWXZIJZSA-N 2 0 245.370 2.260 20 0 BEADRP CC(C)[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873253021 590009057 /nfs/dbraw/zinc/00/90/57/590009057.db2.gz XRBMTWWQDZWWDO-RNJOBUHISA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H](Cc1cccs1)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873253954 590009312 /nfs/dbraw/zinc/00/93/12/590009312.db2.gz HWAHWRIFKNEVRY-GARJFASQSA-N 2 0 224.373 2.006 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@H]2CCc3ccc(F)cc32)C1 ZINC000873253772 590009340 /nfs/dbraw/zinc/00/93/40/590009340.db2.gz DYYWODDBVWKQFW-BHYNMZESSA-N 2 0 234.318 2.140 20 0 BEADRP C[C@@H](Cc1ccc(F)cc1)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873254138 590009500 /nfs/dbraw/zinc/00/95/00/590009500.db2.gz LQLPUOVMMJWWCI-VHRBIJSZSA-N 2 0 236.334 2.084 20 0 BEADRP CCOc1cccc([C@H](C)[NH2+]C[C@H]2C[C@@H]([NH3+])C2)c1 ZINC000873253845 590009562 /nfs/dbraw/zinc/00/95/62/590009562.db2.gz FZPQMXAXFBVJQM-SGMGOOAPSA-N 2 0 248.370 2.473 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@@H]2CCc3ccc(F)cc32)C1 ZINC000873253773 590009594 /nfs/dbraw/zinc/00/95/94/590009594.db2.gz DYYWODDBVWKQFW-LJWDBELGSA-N 2 0 234.318 2.140 20 0 BEADRP CC[C@@H]1CCC[C@H]([NH2+]C[C@H]2C[C@H]([NH3+])C2)C1 ZINC000873256707 590011481 /nfs/dbraw/zinc/01/14/81/590011481.db2.gz PDOFKFPQWFHYQJ-LPWJVIDDSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1ccnc(Cl)c1 ZINC000873257098 590011740 /nfs/dbraw/zinc/01/17/40/590011740.db2.gz QXJMVJGMHMQSNP-QXEWZRGKSA-N 2 0 239.750 2.123 20 0 BEADRP COc1ccsc1[C@@H](C)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873256773 590011767 /nfs/dbraw/zinc/01/17/67/590011767.db2.gz NTJFYBUVDLZSCI-OPRDCNLKSA-N 2 0 240.372 2.145 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccc(F)c(F)c1 ZINC000873257699 590012359 /nfs/dbraw/zinc/01/23/59/590012359.db2.gz WRIKPUUEEVVQLJ-ATZCPNFKSA-N 2 0 240.297 2.353 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1ccc(F)cc1 ZINC000873258110 590012498 /nfs/dbraw/zinc/01/24/98/590012498.db2.gz MVFBMRQRDVARPR-GIPNMCIBSA-N 2 0 222.307 2.214 20 0 BEADRP C[C@H](Cc1cccs1)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873257468 590012539 /nfs/dbraw/zinc/01/25/39/590012539.db2.gz HWAHWRIFKNEVRY-GMTAPVOTSA-N 2 0 224.373 2.006 20 0 BEADRP CC(C)=CCC[C@@H](C)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873258345 590012794 /nfs/dbraw/zinc/01/27/94/590012794.db2.gz ONHBJOZZTUNFHE-JHJVBQTASA-N 2 0 210.365 2.448 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+][C@@H]2CCc3c2cccc3F)C1 ZINC000873259149 590013065 /nfs/dbraw/zinc/01/30/65/590013065.db2.gz YBOJGXRNZVBGPZ-GPCCPHFNSA-N 2 0 234.318 2.140 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+][C@@H]2CCC[C@@H]2CCCF)C1 ZINC000873259019 590013083 /nfs/dbraw/zinc/01/30/83/590013083.db2.gz XNIYCGRFIGVLMD-FDYHWXHSSA-N 2 0 228.355 2.232 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+]C2CCCCCCC2)C1 ZINC000873259221 590013416 /nfs/dbraw/zinc/01/34/16/590013416.db2.gz ZZNMAXHSICWZOU-HAQNSBGRSA-N 2 0 210.365 2.426 20 0 BEADRP C([NH2+][C@H]1CCC12CCC2)[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000873262129 590014366 /nfs/dbraw/zinc/01/43/66/590014366.db2.gz VRYLLEIZDTWSKL-CRWXNKLISA-N 2 0 234.387 2.439 20 0 BEADRP C([NH2+][C@H]1CC[C@H]1C1CC1)[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000873261805 590014459 /nfs/dbraw/zinc/01/44/59/590014459.db2.gz SBHAOQDVLQLMDJ-KLLKFSIISA-N 2 0 234.387 2.295 20 0 BEADRP CC[C@@H](C)[C@H](C)[NH2+][C@H](C)C1CC[NH2+]CC1 ZINC000873264513 590014928 /nfs/dbraw/zinc/01/49/28/590014928.db2.gz FYIWMLOGRPXATH-GRYCIOLGSA-N 2 0 212.381 2.399 20 0 BEADRP CC[C@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)[C@H]1C[C@@H]1C ZINC000873273151 590016593 /nfs/dbraw/zinc/01/65/93/590016593.db2.gz YRHGFCWHUWIQHL-IMIFBBOLSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]C1([C@H]2CCCCO2)CCC1 ZINC000873277521 590017864 /nfs/dbraw/zinc/01/78/64/590017864.db2.gz TUTAKSXOFHCNMZ-RWMBFGLXSA-N 2 0 240.391 2.194 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]C1([C@@H]2CCCCO2)CCC1 ZINC000873277522 590018090 /nfs/dbraw/zinc/01/80/90/590018090.db2.gz TUTAKSXOFHCNMZ-XQQFMLRXSA-N 2 0 240.391 2.194 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CCC[C@@H]1C=CCC1 ZINC000873281675 590018923 /nfs/dbraw/zinc/01/89/23/590018923.db2.gz OLCVDSUGQYOGQC-YNEHKIRRSA-N 2 0 210.365 2.448 20 0 BEADRP C[C@@H]1C[C@H]1C[NH+]1CCC2(CC[NH+](C)CC2)CC1 ZINC000877683905 590392090 /nfs/dbraw/zinc/39/20/90/590392090.db2.gz ARZMWMOWJNCXHK-KGLIPLIRSA-N 2 0 236.403 2.450 20 0 BEADRP C[C@H]1C[C@H]1C[NH+]1CCC2(CC[NH+](C)CC2)CC1 ZINC000877683904 590392124 /nfs/dbraw/zinc/39/21/24/590392124.db2.gz ARZMWMOWJNCXHK-KBPBESRZSA-N 2 0 236.403 2.450 20 0 BEADRP C[N@@H+]1CC[C@@H]2C[NH+](CCc3ccccc3)CC[C@@H]21 ZINC000877743492 590410658 /nfs/dbraw/zinc/41/06/58/590410658.db2.gz WJSQAVRBSNHSPY-CVEARBPZSA-N 2 0 244.382 2.255 20 0 BEADRP C=C/C=C\CC[NH+]1CCC([NH+](C)C)CC1 ZINC000877958706 590458193 /nfs/dbraw/zinc/45/81/93/590458193.db2.gz DLHJIGGVVWWXGY-WAYWQWQTSA-N 2 0 208.349 2.145 20 0 BEADRP C=C/C=C/CC[NH+]1CCN(c2cc[nH+]cc2)CC1 ZINC000878190097 590520851 /nfs/dbraw/zinc/52/08/51/590520851.db2.gz DFPLFVWUQKSYLS-ONEGZZNKSA-N 2 0 243.354 2.336 20 0 BEADRP C[NH+]1CCC2(CC[N@H+](C/C=C/Cl)C2)CC1 ZINC000878864394 590634409 /nfs/dbraw/zinc/63/44/09/590634409.db2.gz AGIAJJQMNSGTDY-QHHAFSJGSA-N 2 0 228.767 2.157 20 0 BEADRP C[N@@H+]1CCC[C@H]1CC[NH+]1C[C@@H]2CC=CC[C@@H]2C1 ZINC000879529965 590791624 /nfs/dbraw/zinc/79/16/24/590791624.db2.gz HQKOEXGVTYGOCV-ZNMIVQPWSA-N 2 0 234.387 2.369 20 0 BEADRP CC[NH+](CC)CCC[N@@H+]1CCC[C@@H](CF)C1 ZINC000880236829 590968715 /nfs/dbraw/zinc/96/87/15/590968715.db2.gz JYZHMANYQBOEPT-ZDUSSCGKSA-N 2 0 230.371 2.400 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CCN(c2cc[nH+]cc2)[C@H](C)C1 ZINC000880259551 590979675 /nfs/dbraw/zinc/97/96/75/590979675.db2.gz WAPLJJHDWAPPTG-MGPQQGTHSA-N 2 0 245.370 2.248 20 0 BEADRP C[C@H]1C[N@H+](CCC2CC2)CCN1c1cc[nH+]cc1 ZINC000880260685 590980517 /nfs/dbraw/zinc/98/05/17/590980517.db2.gz RESHBHAEZDDIAW-ZDUSSCGKSA-N 2 0 245.370 2.392 20 0 BEADRP CC(C)C[NH+]1CCC(C)([NH+]2CCC2)CC1 ZINC000880472156 591048699 /nfs/dbraw/zinc/04/86/99/591048699.db2.gz FQJAWERXLGMUPH-UHFFFAOYSA-N 2 0 210.365 2.203 20 0 BEADRP CC1([NH+]2CCC2)CC[NH+](CCCCF)CC1 ZINC000880473853 591054628 /nfs/dbraw/zinc/05/46/28/591054628.db2.gz BPCXSHZKJASSDY-UHFFFAOYSA-N 2 0 228.355 2.296 20 0 BEADRP Cc1ncnc(NCCCC[N@@H+](C)C2CC2)c1C ZINC000882436441 591348279 /nfs/dbraw/zinc/34/82/79/591348279.db2.gz ZAHMEAIAJYYDQZ-UHFFFAOYSA-N 2 0 248.374 2.380 20 0 BEADRP CCN1CC[C@@H]1C[NH2+][C@@H](C)CC1(OC)CCC1 ZINC000883355836 591626197 /nfs/dbraw/zinc/62/61/97/591626197.db2.gz YTBDGJJNFMCOID-QWHCGFSZSA-N 2 0 240.391 2.018 20 0 BEADRP C[NH2+]C[C@H]1CC[N@H+](CC[C@@H]2CCCC2(F)F)C1 ZINC000883416948 591652071 /nfs/dbraw/zinc/65/20/71/591652071.db2.gz JLQUAGUJSRAHJX-NEPJUHHUSA-N 2 0 246.345 2.353 20 0 BEADRP [NH3+]C[C@@H]1CC[N@H+](CC[C@@H]2CCCC2(F)F)C1 ZINC000883417170 591652881 /nfs/dbraw/zinc/65/28/81/591652881.db2.gz PUBFCCGRABVPQD-QWRGUYRKSA-N 2 0 232.318 2.093 20 0 BEADRP C[C@@H]1C[N@H+](CC[C@@H]2CCCC2(F)F)CC[C@H]1[NH3+] ZINC000883417807 591654449 /nfs/dbraw/zinc/65/44/49/591654449.db2.gz NSFKDSANWZQVLX-GRYCIOLGSA-N 2 0 246.345 2.481 20 0 BEADRP C=C/C=C/CC[NH2+][C@@H]1[C@H](C)CCN[C@H]1C ZINC000883429638 591660444 /nfs/dbraw/zinc/66/04/44/591660444.db2.gz AORYCBUOGPINEW-XDQHSUTASA-N 2 0 208.349 2.095 20 0 BEADRP C[C@]1(c2ccccc2)CCC[N@@H+]1CCC[NH3+] ZINC000883459541 591674135 /nfs/dbraw/zinc/67/41/35/591674135.db2.gz ALRGZYJKWRLORV-CQSZACIVSA-N 2 0 218.344 2.346 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1c2ccccc2NC1(C)C ZINC000883464339 591674621 /nfs/dbraw/zinc/67/46/21/591674621.db2.gz KWBDFCRJIKFICS-CYBMUJFWSA-N 2 0 233.359 2.131 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21)[C@H]1CCCO1 ZINC000131949054 591679350 /nfs/dbraw/zinc/67/93/50/591679350.db2.gz CBNLGONBJZJDIS-BSLXNSKLSA-N 2 0 246.354 2.288 20 0 BEADRP CN1CCC[C@@H]([NH2+]CC2(C)CCCC2)C1 ZINC000134284613 591911956 /nfs/dbraw/zinc/91/19/56/591911956.db2.gz VSCYBENBPLZAGY-GFCCVEGCSA-N 2 0 210.365 2.251 20 0 BEADRP Cc1cc(C[NH2+][C@H]2CCN(C)C2)ccc1Cl ZINC000134653067 591945363 /nfs/dbraw/zinc/94/53/63/591945363.db2.gz YOLVAWURWHHCDO-LBPRGKRZSA-N 2 0 238.762 2.442 20 0 BEADRP C[NH+]1CCC(C)(C[NH2+]C[C@@H]2CCC=CO2)CC1 ZINC000219485639 592225994 /nfs/dbraw/zinc/22/59/94/592225994.db2.gz CGABCTAEZBKDRQ-ZDUSSCGKSA-N 2 0 238.375 2.001 20 0 BEADRP CC[N@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000076110128 592315136 /nfs/dbraw/zinc/31/51/36/592315136.db2.gz VUPKIEMVCGGHSY-OAHLLOKOSA-N 2 0 232.371 2.460 20 0 BEADRP C(CN1CCC[C@@H]2[NH2+]CC[C@@H]21)[C@@H]1C[C@H]1C1CC1 ZINC000886841246 592360794 /nfs/dbraw/zinc/36/07/94/592360794.db2.gz GBRUATQVOPNFJZ-QPSCCSFWSA-N 2 0 234.387 2.249 20 0 BEADRP C[C@H]1CC[N@H+](CCOCC[NH3+])[C@@H]1c1ccccc1 ZINC000886858263 592370702 /nfs/dbraw/zinc/37/07/02/592370702.db2.gz UAJGODNDOHIWCP-ZFWWWQNUSA-N 2 0 248.370 2.045 20 0 BEADRP C(C1CCC1)[N@@H+]1CCCC[C@]2(CC[NH2+]C2)C1 ZINC000886870315 592375609 /nfs/dbraw/zinc/37/56/09/592375609.db2.gz VMWPTDTVJNRMKX-CQSZACIVSA-N 2 0 222.376 2.252 20 0 BEADRP C1=CCC(C[N@@H+]2CCCC[C@@]3(CC[NH2+]C3)C2)C1 ZINC000886873985 592376702 /nfs/dbraw/zinc/37/67/02/592376702.db2.gz CXXJNVLOQORBEH-HNNXBMFYSA-N 2 0 234.387 2.418 20 0 BEADRP CC[C@H](C)[N@@H+]1CCCC[C@]2(CC[NH2+]C2)C1 ZINC000886874559 592376899 /nfs/dbraw/zinc/37/68/99/592376899.db2.gz QGGITXSBTYCGGS-QWHCGFSZSA-N 2 0 210.365 2.251 20 0 BEADRP C1=CCC(C[N@@H+]2CCCC[C@]3(CC[NH2+]C3)C2)C1 ZINC000886873986 592377424 /nfs/dbraw/zinc/37/74/24/592377424.db2.gz CXXJNVLOQORBEH-OAHLLOKOSA-N 2 0 234.387 2.418 20 0 BEADRP C[C@@H]1C[C@H]1C[N@@H+]1CCCC[C@@]2(CC[NH2+]C2)C1 ZINC000886873928 592377521 /nfs/dbraw/zinc/37/75/21/592377521.db2.gz BOFYTCMINVOAHK-RDBSUJKOSA-N 2 0 222.376 2.108 20 0 BEADRP C[C@H](Cc1cccc(F)c1)[NH2+]CCC[NH+](C)C ZINC000221705772 592438764 /nfs/dbraw/zinc/43/87/64/592438764.db2.gz NCBCTMVMIMSXCE-GFCCVEGCSA-N 2 0 238.350 2.298 20 0 BEADRP Cc1nccn1CCN(CC(F)F)C1CCC1 ZINC000887100845 592441852 /nfs/dbraw/zinc/44/18/52/592441852.db2.gz TZLPXLMZXYLZCL-UHFFFAOYSA-N 2 0 243.301 2.311 20 0 BEADRP CC[C@H](C)[N@@H+]1CCN(c2cc[nH+]cc2)C[C@@H]1C ZINC000887134914 592448408 /nfs/dbraw/zinc/44/84/08/592448408.db2.gz SGHDYNFTKFLCNZ-STQMWFEESA-N 2 0 233.359 2.391 20 0 BEADRP C[NH+](C/C=C/C[N@H+](C)CCCF)CCCF ZINC000887141271 592457197 /nfs/dbraw/zinc/45/71/97/592457197.db2.gz MDQFDCZVZFFTBH-ONEGZZNKSA-N 2 0 234.334 2.125 20 0 BEADRP CCSC[C@@H](C)[N@@H+]1CCCC[C@@H](C[NH3+])C1 ZINC001246582506 988117703 /nfs/dbraw/zinc/11/77/03/988117703.db2.gz NCWSZHBRWQODCA-NEPJUHHUSA-N 2 0 230.421 2.189 20 0 BEADRP COc1ccc(C)cc1C[N@@H+]1CC[C@H](CC[NH3+])C1 ZINC000125561672 634550235 /nfs/dbraw/zinc/55/02/35/634550235.db2.gz LTPQHUUPCQUJNT-ZDUSSCGKSA-N 2 0 248.370 2.174 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]C[C@H]1C=CCC1 ZINC000925731723 634569445 /nfs/dbraw/zinc/56/94/45/634569445.db2.gz MQAWBONWGRTIQX-YPMHNXCESA-N 2 0 245.370 2.466 20 0 BEADRP CC(C)(C[NH2+][C@H]1CC[NH2+]C1(C)C)CC(F)F ZINC000925734256 634584553 /nfs/dbraw/zinc/58/45/53/634584553.db2.gz PKEZTTDYDCTLIR-VIFPVBQESA-N 2 0 234.334 2.398 20 0 BEADRP C[C@@H]1C[N@H+](CCCCCCC[NH3+])[C@@H](C)CO1 ZINC000223221858 635363134 /nfs/dbraw/zinc/36/31/34/635363134.db2.gz DVTBGNYSBNZVBI-QWHCGFSZSA-N 2 0 228.380 2.005 20 0 BEADRP c1ccc([C@H]([NH2+][C@H]2CCC[NH2+]CC2)C2CC2)nc1 ZINC000925821881 635398397 /nfs/dbraw/zinc/39/83/97/635398397.db2.gz KNTWSWLIEQYTNM-DZGCQCFKSA-N 2 0 245.370 2.264 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]C[C@@H]2C[C@H]2C(F)(F)F)C12CCC2 ZINC000925831967 635469781 /nfs/dbraw/zinc/46/97/81/635469781.db2.gz MWHUHSROSQMZQM-SGIHWFKDSA-N 2 0 248.292 2.044 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCS[C@H](C)C1)[C@@H]1CCC[NH2+]C1 ZINC000925862254 635559824 /nfs/dbraw/zinc/55/98/24/635559824.db2.gz ZDLQRAXBIWOTMY-YVECIDJPSA-N 2 0 242.432 2.248 20 0 BEADRP CCCN(C[C@H]1CCC[NH2+]1)C[C@@H]1CCCCO1 ZINC000233112091 635529505 /nfs/dbraw/zinc/52/95/05/635529505.db2.gz UTONIUULAUYHEM-KGLIPLIRSA-N 2 0 240.391 2.020 20 0 BEADRP C[NH+]1CCC(C[NH2+]CC2(C3CC3)CC2)CC1 ZINC000234330894 635554243 /nfs/dbraw/zinc/55/42/43/635554243.db2.gz YLFCSDBICBWQLW-UHFFFAOYSA-N 2 0 222.376 2.108 20 0 BEADRP [NH3+]C[C@H]1CCC[C@H]1[NH2+][C@H]1CCCc2cccnc21 ZINC000925871910 635586538 /nfs/dbraw/zinc/58/65/38/635586538.db2.gz LMXSPVZPTHISJL-MCIONIFRSA-N 2 0 245.370 2.176 20 0 BEADRP C1=CCCC(C[NH2+][C@H]2CCC[NH2+]CC2)CC1 ZINC000925881042 635609100 /nfs/dbraw/zinc/60/91/00/635609100.db2.gz QGDJVXPJWXBRGM-AWEZNQCLSA-N 2 0 222.376 2.465 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]C[C@]12C[C@H]1CCC2 ZINC000925881823 635610440 /nfs/dbraw/zinc/61/04/40/635610440.db2.gz VFOILPVEAJCCCD-MQYQWHSLSA-N 2 0 222.376 2.154 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]CC1CCC=CCC1 ZINC000925882142 635610914 /nfs/dbraw/zinc/61/09/14/635610914.db2.gz XOPSCLFYSLDVBU-UONOGXRCSA-N 2 0 222.376 2.450 20 0 BEADRP C[C@H]([NH2+][C@H]1C[C@@](C[NH3+])(c2ccccc2)C1)C1CC1 ZINC000925887434 635615395 /nfs/dbraw/zinc/61/53/95/635615395.db2.gz CXJRPOLTTFYEHB-VBNZEHGJSA-N 2 0 244.382 2.434 20 0 BEADRP Cc1ccc(C[NH+]2C[C@H]3C[N@@H+](C)C[C@@]3(C)C2)cc1 ZINC000933746588 631501975 /nfs/dbraw/zinc/50/19/75/631501975.db2.gz XIGLNUAUOVKWKF-CVEARBPZSA-N 2 0 244.382 2.379 20 0 BEADRP CC(C)SCC[NH2+]CC1CC[NH+](C)CC1 ZINC000308792576 631648737 /nfs/dbraw/zinc/64/87/37/631648737.db2.gz IXQYLXFTRKPDII-UHFFFAOYSA-N 2 0 230.421 2.059 20 0 BEADRP C[N@H+](CCCCCC[NH3+])CC(C)(C)C ZINC000045089683 631829014 /nfs/dbraw/zinc/82/90/14/631829014.db2.gz BIIWWOQJOQXBAN-UHFFFAOYSA-N 2 0 200.370 2.483 20 0 BEADRP C[C@H]1CC[C@@H]1[NH2+]C1CCC([NH+](C)C)CC1 ZINC000309101282 631884195 /nfs/dbraw/zinc/88/41/95/631884195.db2.gz FVMHNJSRUIPPRE-WTIISPKJSA-N 2 0 210.365 2.247 20 0 BEADRP CC(C)C[N@H+](CC[C@H]1CCC[NH2+]C1)C1CC1 ZINC000051919295 632013042 /nfs/dbraw/zinc/01/30/42/632013042.db2.gz QBQBCYJTPABAKJ-CYBMUJFWSA-N 2 0 224.392 2.497 20 0 BEADRP [NH3+]C[C@@H]1CC[N@@H+]([C@@H]2CCCc3ccccc32)C1 ZINC000224203443 632014406 /nfs/dbraw/zinc/01/44/06/632014406.db2.gz NWZIHPNDOZRZIH-SWLSCSKDSA-N 2 0 230.355 2.345 20 0 BEADRP C[C@@H](C[NH2+][C@H]1[C@H](C)CC[C@@H]1C)N(C)C1CC1 ZINC000924968500 635815808 /nfs/dbraw/zinc/81/58/08/635815808.db2.gz ZJNIZLLXBTVSJW-KZVDOYCCSA-N 2 0 224.392 2.493 20 0 BEADRP CC(C)C[NH2+]Cc1ccc(C[NH3+])cc1F ZINC000650717583 632407001 /nfs/dbraw/zinc/40/70/01/632407001.db2.gz GCYMTZYERRGNPY-UHFFFAOYSA-N 2 0 210.296 2.030 20 0 BEADRP C[C@@H]1CCC[N@H+](C[C@@]2(C)CCC[NH2+]C2)C1 ZINC000219749412 632561348 /nfs/dbraw/zinc/56/13/48/632561348.db2.gz OZCISRRGALPMJP-OLZOCXBDSA-N 2 0 210.365 2.108 20 0 BEADRP CC[C@H](C)C[N@H+](C)C[C@@]1(C)CCC[NH2+]C1 ZINC000219753363 632562357 /nfs/dbraw/zinc/56/23/57/632562357.db2.gz QHCBIGODYLZGAA-STQMWFEESA-N 2 0 212.381 2.354 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+]Cc1ccccc1F ZINC000089139618 632657965 /nfs/dbraw/zinc/65/79/65/632657965.db2.gz OUVFNDFJZTTXNJ-RISCZKNCSA-N 2 0 236.334 2.433 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@@H]2CC[NH2+][C@@H](C)C2)C1 ZINC000235331849 632672821 /nfs/dbraw/zinc/67/28/21/632672821.db2.gz OHYYVIKXDUQDIL-XQHKEYJVSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H](CC(F)(F)F)[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000235465700 632748613 /nfs/dbraw/zinc/74/86/13/632748613.db2.gz RUNFIZUEJZDYRL-RKDXNWHRSA-N 2 0 224.270 2.059 20 0 BEADRP C[C@]1(C[NH3+])CC[N@H+](Cc2ccc3c(c2)CCC3)C1 ZINC000235735146 632822846 /nfs/dbraw/zinc/82/28/46/632822846.db2.gz FIPXVRBDYOSUNV-MRXNPFEDSA-N 2 0 244.382 2.346 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@H]2CCC(F)(F)C2)CC1 ZINC000309334761 632944243 /nfs/dbraw/zinc/94/42/43/632944243.db2.gz AJKIRLVBFHDSTJ-NSHDSACASA-N 2 0 232.318 2.106 20 0 BEADRP C[C@H](Cc1ccco1)[NH2+][C@@H](C)CCCC[NH3+] ZINC000309352112 632962464 /nfs/dbraw/zinc/96/24/64/632962464.db2.gz MQHJDMCBJNITIU-NWDGAFQWSA-N 2 0 224.348 2.318 20 0 BEADRP CC(C)[C@H]1CC[N@H+](C[C@]2(C)CCC[NH2+]C2)C1 ZINC000166320976 633109965 /nfs/dbraw/zinc/10/99/65/633109965.db2.gz UHPWXOGUEXGRPN-UONOGXRCSA-N 2 0 224.392 2.354 20 0 BEADRP Cc1ccc(C[C@H](C)[NH2+]C2CC[NH2+]CC2)s1 ZINC000070716127 636028000 /nfs/dbraw/zinc/02/80/00/636028000.db2.gz XZEGZEZOLFNFEG-JTQLQIEISA-N 2 0 238.400 2.329 20 0 BEADRP CC[C@H](C)C[C@H](C)[NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23 ZINC000328239236 633747682 /nfs/dbraw/zinc/74/76/82/633747682.db2.gz AQORXONMTIEWKH-KQBRZWLDSA-N 2 0 236.403 2.397 20 0 BEADRP Cc1nc(CNC[C@@H](C)C[NH+](C)C)sc1C ZINC000309795969 633751113 /nfs/dbraw/zinc/75/11/13/633751113.db2.gz VJSLRZQHHPPMHQ-SECBINFHSA-N 2 0 241.404 2.047 20 0 BEADRP CC(C)CC[C@H](C)[NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32 ZINC000328466387 633768263 /nfs/dbraw/zinc/76/82/63/633768263.db2.gz XIIMRIUWHVZLDD-GXYBRJDSSA-N 2 0 236.403 2.397 20 0 BEADRP CCC[C@H](CC)[NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2 ZINC000328522011 633771880 /nfs/dbraw/zinc/77/18/80/633771880.db2.gz HLFORLNECHWHLP-VZKILSJISA-N 2 0 222.376 2.151 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@H]2[C@@H]3[NH2+]C[C@H]4C[C@H]2C[C@H]34)C[C@@H]1C ZINC000328558580 633775406 /nfs/dbraw/zinc/77/54/06/633775406.db2.gz CSLWPJKATYPEHG-XMMDLHNASA-N 2 0 248.414 2.397 20 0 BEADRP CC(C)CCC[NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2 ZINC000328566140 633775691 /nfs/dbraw/zinc/77/56/91/633775691.db2.gz MKRDYSDXSVNZJJ-YHQUGGNUSA-N 2 0 222.376 2.009 20 0 BEADRP CSCCCC[NH2+][C@H]1CC[NH2+]C12CCCC2 ZINC000925503619 633830119 /nfs/dbraw/zinc/83/01/19/633830119.db2.gz KQVVUJOFDNHGPW-LBPRGKRZSA-N 2 0 242.432 2.394 20 0 BEADRP CCCC[C@H](COC)[NH2+][C@H]1C[C@H]([NH3+])C12CCC2 ZINC000925503600 633830272 /nfs/dbraw/zinc/83/02/72/633830272.db2.gz KQIRACGWZXBUFZ-AGIUHOORSA-N 2 0 240.391 2.051 20 0 BEADRP COC[C@H](C)[NH2+]CCC[N@H+](C)C1CCCCC1 ZINC000053196113 634069642 /nfs/dbraw/zinc/06/96/42/634069642.db2.gz UFFNYIHTNVQZIR-ZDUSSCGKSA-N 2 0 242.407 2.266 20 0 BEADRP CC(C)C1(C[NH2+][C@@H]2CC[NH2+]C2(C)C)CC1 ZINC000925579628 634079746 /nfs/dbraw/zinc/07/97/46/634079746.db2.gz NBGLERJNHTUXBK-LLVKDONJSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+][C@@H]1CCO[C@H]1C ZINC000252751886 634231184 /nfs/dbraw/zinc/23/11/84/634231184.db2.gz XCCWNUHXDJDGHV-ZOBORPQBSA-N 2 0 240.391 2.064 20 0 BEADRP FCCCC[NH2+][C@@H]1CC[NH2+]C[C@@H]1C1CCCC1 ZINC000925677636 634270297 /nfs/dbraw/zinc/27/02/97/634270297.db2.gz XFPHPFIXFLSYBI-ZIAGYGMSSA-N 2 0 242.382 2.494 20 0 BEADRP C[C@H](CC(C)(C)O)[NH2+][C@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925682762 634287908 /nfs/dbraw/zinc/28/79/08/634287908.db2.gz ZRMXQAWCJZRGQZ-UTUOFQBUSA-N 2 0 242.407 2.032 20 0 BEADRP CC[C@H](C)[C@@H](C)[NH2+]C[C@H]1CCCC[NH2+]C1 ZINC000319465491 634289227 /nfs/dbraw/zinc/28/92/27/634289227.db2.gz VQGUEGPCLTXSBO-XQQFMLRXSA-N 2 0 212.381 2.400 20 0 BEADRP CC1(C)C[C@@H]1[NH2+][C@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925686368 634300382 /nfs/dbraw/zinc/30/03/82/634300382.db2.gz SGFKGORMAOLFTK-VWYCJHECSA-N 2 0 210.365 2.281 20 0 BEADRP CC(C)[NH2+]CCCN[C@H](c1ccccc1)[C@@H](C)[NH3+] ZINC000925695257 634346726 /nfs/dbraw/zinc/34/67/26/634346726.db2.gz VBASZSGIUZCEJP-HIFRSBDPSA-N 2 0 249.402 2.053 20 0 BEADRP CCCC[C@H](C[NH3+])N[C@@H](c1ccccc1)[C@H](C)[NH3+] ZINC000925696792 634356544 /nfs/dbraw/zinc/35/65/44/634356544.db2.gz AWGLYODVLMHJPO-NWANDNLSSA-N 2 0 249.402 2.182 20 0 BEADRP CCCC[C@H](C[NH3+])N[C@@H](c1ccccc1)[C@@H](C)[NH3+] ZINC000925696786 634356921 /nfs/dbraw/zinc/35/69/21/634356921.db2.gz AWGLYODVLMHJPO-BPLDGKMQSA-N 2 0 249.402 2.182 20 0 BEADRP CC[NH2+][C@H](C)CN[C@@H](CCC[NH3+])c1ccccc1 ZINC000925701365 634374710 /nfs/dbraw/zinc/37/47/10/634374710.db2.gz YGRDFKUWLGTDKT-HIFRSBDPSA-N 2 0 249.402 2.054 20 0 BEADRP C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000925772523 635213726 /nfs/dbraw/zinc/21/37/26/635213726.db2.gz IKFQXXZRABMWBB-HTOAHKCRSA-N 2 0 234.387 2.153 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]C[C@H]1CCC2(CCC2)CO1 ZINC000925774214 635231540 /nfs/dbraw/zinc/23/15/40/635231540.db2.gz LJFQVAFXSXAIQH-YNEHKIRRSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C[NH2+][C@@H]1CC[NH2+]C1(C)C ZINC000925774495 635236878 /nfs/dbraw/zinc/23/68/78/635236878.db2.gz VZMHTZWOYLLOSE-UJPOAAIJSA-N 2 0 222.376 2.009 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]C[C@H]1C[NH2+]CCC1(F)F ZINC000925777541 635258682 /nfs/dbraw/zinc/25/86/82/635258682.db2.gz POCKWJKBWBBGSV-MXWKQRLJSA-N 2 0 232.318 2.009 20 0 BEADRP CN1CC[C@@H]2CC[C@H](C1)[N@@H+]2CCC1CCC1 ZINC000931717837 635272650 /nfs/dbraw/zinc/27/26/50/635272650.db2.gz DLMOLEQOBQXRSM-UONOGXRCSA-N 2 0 222.376 2.345 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[NH2+]C[C@H]1C)[C@H]1CCCC[C@H]1C ZINC000925783656 635291215 /nfs/dbraw/zinc/29/12/15/635291215.db2.gz KOCIZMIMSLXSNA-XGFWRYKXSA-N 2 0 224.392 2.399 20 0 BEADRP Cc1ccc(C)c(C[N@@H+]2CC[C@H]([NH3+])[C@H](C)C2)c1 ZINC000094338883 635299299 /nfs/dbraw/zinc/29/92/99/635299299.db2.gz CNATUTXXMAPJHG-HIFRSBDPSA-N 2 0 232.371 2.473 20 0 BEADRP Cc1cc(C)cc(C[N@@H+]2CC[C@@H]([NH3+])[C@H](C)C2)c1 ZINC000094338968 635299421 /nfs/dbraw/zinc/29/94/21/635299421.db2.gz ZMRSGTGXXAFISQ-UKRRQHHQSA-N 2 0 232.371 2.473 20 0 BEADRP COc1ccc(Cl)cc1C[NH2+][C@H](C)CC[NH3+] ZINC000220511061 635307693 /nfs/dbraw/zinc/30/76/93/635307693.db2.gz QXFWVXZBFSRKBR-SECBINFHSA-N 2 0 242.750 2.176 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@H]1CCc2ccccc21 ZINC000925790908 635318932 /nfs/dbraw/zinc/31/89/32/635318932.db2.gz MZOQLMTZPAQCJR-ZLDLUXBVSA-N 2 0 230.355 2.119 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1C[NH2+]C[C@H]1C)c1cccc(O)c1 ZINC000925793936 635329041 /nfs/dbraw/zinc/32/90/41/635329041.db2.gz CCWRZIRKECLAOB-MBNYWOFBSA-N 2 0 248.370 2.288 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1C[NH2+]C[C@H]1C)c1cccc(O)c1 ZINC000925793942 635329768 /nfs/dbraw/zinc/32/97/68/635329768.db2.gz CCWRZIRKECLAOB-YRGRVCCFSA-N 2 0 248.370 2.288 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CC[C@H]([NH3+])C1)c1ccoc1 ZINC000925874985 635594725 /nfs/dbraw/zinc/59/47/25/635594725.db2.gz AVTRYHXGHCUKPT-FOGDFJRCSA-N 2 0 208.305 2.058 20 0 BEADRP C[NH+]1CCC(C[NH2+]C[C@H]2C(C)(C)C2(F)F)CC1 ZINC000895438941 636144004 /nfs/dbraw/zinc/14/40/04/636144004.db2.gz UOFGAOOTXIQRQL-NSHDSACASA-N 2 0 246.345 2.209 20 0 BEADRP Cc1ccc(OCC[N@H+]2CC[C@@H]([C@@H](C)[NH3+])C2)cc1 ZINC000163197842 636212799 /nfs/dbraw/zinc/21/27/99/636212799.db2.gz LLBUTRIDTFBXIY-ZIAGYGMSSA-N 2 0 248.370 2.043 20 0 BEADRP CC[N@H+](C)C[C@H]1CC[NH+](CC2CC(F)(F)C2)C1 ZINC000450470905 636443235 /nfs/dbraw/zinc/44/32/35/636443235.db2.gz JJHLYVGQHMITLB-LLVKDONJSA-N 2 0 246.345 2.305 20 0 BEADRP CC[C@@H](c1ccc(F)cc1)N(C)CC[NH3+] ZINC000054416797 636636897 /nfs/dbraw/zinc/63/68/97/636636897.db2.gz JRGBLBIGAUDDGL-LBPRGKRZSA-N 2 0 210.296 2.167 20 0 BEADRP C[C@@H](C[N@@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1)c1ccccc1 ZINC000928997328 636699163 /nfs/dbraw/zinc/69/91/63/636699163.db2.gz HXRAAUPWNWIZOR-CWRNSKLLSA-N 2 0 244.382 2.331 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)cc1 ZINC000086402133 636886790 /nfs/dbraw/zinc/88/67/90/636886790.db2.gz YESDVVAXAQIFGE-UONOGXRCSA-N 2 0 218.344 2.355 20 0 BEADRP FC(F)(F)[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[NH2+]C2)C1 ZINC000086727888 636887801 /nfs/dbraw/zinc/88/78/01/636887801.db2.gz SJVXEZYSOZHYDR-KXUCPTDWSA-N 2 0 236.281 2.059 20 0 BEADRP FC(F)(F)C1CCC([NH2+][C@@H]2CC[NH2+]C2)CC1 ZINC000086727457 636889779 /nfs/dbraw/zinc/88/97/79/636889779.db2.gz LLCPRBAJNQAQAY-UDNWOFFPSA-N 2 0 236.281 2.059 20 0 BEADRP Cc1ccc(C[N@H+](C)CC[C@@H]2CC[NH2+]C2)cc1 ZINC000089749127 636909078 /nfs/dbraw/zinc/90/90/78/636909078.db2.gz IMLOQNLRNGTSAT-AWEZNQCLSA-N 2 0 232.371 2.426 20 0 BEADRP COCC[C@H](C)[N@@H+]1CC[C@](C[NH3+])(C(C)(C)C)C1 ZINC000866707712 636931880 /nfs/dbraw/zinc/93/18/80/636931880.db2.gz VSFVKUPGYMOCQR-GXTWGEPZSA-N 2 0 242.407 2.108 20 0 BEADRP CC(C)(C)C[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000041051410 636958099 /nfs/dbraw/zinc/95/80/99/636958099.db2.gz JHXLCIWCZUAJGC-LLVKDONJSA-N 2 0 210.365 2.106 20 0 BEADRP C[N@H+]1C[C@H]2CC[C@@H](C1)C2[NH2+]CC1CCCC1 ZINC000924778469 637192409 /nfs/dbraw/zinc/19/24/09/637192409.db2.gz ORJCLCSFVXUFTP-PBWFPOADSA-N 2 0 222.376 2.106 20 0 BEADRP CCO[C@@H]1CCC[N@H+](CCCCCC[NH3+])C1 ZINC000042425546 637244392 /nfs/dbraw/zinc/24/43/92/637244392.db2.gz XZJGFXAHRFVFPD-CYBMUJFWSA-N 2 0 228.380 2.006 20 0 BEADRP CC[N@H+](CCCCCCC[NH3+])C[C@@H]1CCCO1 ZINC000042471407 637269400 /nfs/dbraw/zinc/26/94/00/637269400.db2.gz NHXKLAPBXSOMKM-AWEZNQCLSA-N 2 0 242.407 2.397 20 0 BEADRP FCCC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C1CC1 ZINC000903123910 637344820 /nfs/dbraw/zinc/34/48/20/637344820.db2.gz CWZVJRDZTICCJN-VGPLMAKISA-N 2 0 226.339 2.093 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@@H+]1CCCC[C@H]1C1CCC1 ZINC000903461440 637362589 /nfs/dbraw/zinc/36/25/89/637362589.db2.gz UGOCGLIQFHJZGE-SNPRPXQTSA-N 2 0 236.403 2.497 20 0 BEADRP CC[C@]1(C)CCC[N@H+](C[C@@H]2C[NH2+]C[C@H]2C)C1 ZINC000903438078 637363051 /nfs/dbraw/zinc/36/30/51/637363051.db2.gz QOOQGYKBXWHNJM-HZSPNIEDSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@@H+]1CCCC[C@@H]1C1CCC1 ZINC000903461441 637363133 /nfs/dbraw/zinc/36/31/33/637363133.db2.gz UGOCGLIQFHJZGE-VHDGCEQUSA-N 2 0 236.403 2.497 20 0 BEADRP [NH3+]C1(C[NH2+]CC2C3CC4CC(C3)CC2C4)CC1 ZINC000904443704 637412701 /nfs/dbraw/zinc/41/27/01/637412701.db2.gz MYZYGBGKMDRIAS-UHFFFAOYSA-N 2 0 234.387 2.140 20 0 BEADRP CC[C@@H](C[NH2+]CC1([NH3+])CC1)c1ccccc1 ZINC000904450348 637415729 /nfs/dbraw/zinc/41/57/29/637415729.db2.gz PKUCKHBCNRUJSB-LBPRGKRZSA-N 2 0 218.344 2.261 20 0 BEADRP CC(C)([NH3+])c1ccc(NCC2CC[NH2+]CC2)cc1 ZINC000904470056 637423404 /nfs/dbraw/zinc/42/34/04/637423404.db2.gz GBSWQSYTNVAZIL-UHFFFAOYSA-N 2 0 247.386 2.292 20 0 BEADRP CC(C)([NH3+])CNc1ccc(C(C)(C)[NH3+])cc1 ZINC000904470423 637423547 /nfs/dbraw/zinc/42/35/47/637423547.db2.gz KTHBWJAKFFLNGV-UHFFFAOYSA-N 2 0 221.348 2.030 20 0 BEADRP Cc1cccc(C)c1C[N@H+](C)C[C@H]1C[C@@H]([NH3+])C1 ZINC000904469968 637424140 /nfs/dbraw/zinc/42/41/40/637424140.db2.gz SPAWXGPOZRAENT-OKILXGFUSA-N 2 0 232.371 2.473 20 0 BEADRP C[C@@H]1C[NH2+]C[C@@H](Nc2ccc(C(C)(C)[NH3+])cc2)C1 ZINC000904475574 637424956 /nfs/dbraw/zinc/42/49/56/637424956.db2.gz LWBLEWDPHKYMQN-FZMZJTMJSA-N 2 0 247.386 2.290 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H](Nc2ccc(C(C)(C)[NH3+])cc2)C1 ZINC000904475578 637425775 /nfs/dbraw/zinc/42/57/75/637425775.db2.gz LWBLEWDPHKYMQN-SMDDNHRTSA-N 2 0 247.386 2.290 20 0 BEADRP CC(C)([NH3+])c1ccc(NCC2(C[NH3+])CC2)cc1 ZINC000904477342 637427820 /nfs/dbraw/zinc/42/78/20/637427820.db2.gz UJPMRPJLERPWFB-UHFFFAOYSA-N 2 0 233.359 2.031 20 0 BEADRP CCCC[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000906528344 638192978 /nfs/dbraw/zinc/19/29/78/638192978.db2.gz YWGMWLBOQPOBDJ-UHFFFAOYSA-N 2 0 210.365 2.251 20 0 BEADRP [NH3+]C1CC([NH2+]Cc2ccc3ccccc3c2)C1 ZINC000906507578 638180298 /nfs/dbraw/zinc/18/02/98/638180298.db2.gz AMCZJIUOJPXHQG-UHFFFAOYSA-N 2 0 226.323 2.419 20 0 BEADRP [NH3+]C1CC([NH2+]Cc2ccccc2C2CC2)C1 ZINC000906509259 638181578 /nfs/dbraw/zinc/18/15/78/638181578.db2.gz DBHPFHJVCZEWIO-UHFFFAOYSA-N 2 0 216.328 2.143 20 0 BEADRP [NH3+]C1CC([NH2+]Cc2cccc(C3CC3)c2)C1 ZINC000906509935 638184569 /nfs/dbraw/zinc/18/45/69/638184569.db2.gz DKKPXFSKWIJEEZ-UHFFFAOYSA-N 2 0 216.328 2.143 20 0 BEADRP Cc1ccc(C[NH2+]C2CC([NH3+])C2)cc1Cl ZINC000906510564 638184741 /nfs/dbraw/zinc/18/47/41/638184741.db2.gz LVNXIDORZOPJDW-UHFFFAOYSA-N 2 0 224.735 2.228 20 0 BEADRP Cc1oc2ccccc2c1C[NH2+][C@H]1C[C@H]([NH3+])C1 ZINC000906516254 638185090 /nfs/dbraw/zinc/18/50/90/638185090.db2.gz ACPVNWUIVWAQTA-XYPYZODXSA-N 2 0 230.311 2.321 20 0 BEADRP CC[C@H](C[NH2+][C@H]1C[C@H]([NH3+])C1)c1ccccc1 ZINC000906516269 638186149 /nfs/dbraw/zinc/18/61/49/638186149.db2.gz AKNRPROZUPCGMU-MRVWCRGKSA-N 2 0 218.344 2.260 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]Cc2ccc(C3CC3)cc2)C1 ZINC000906519241 638187483 /nfs/dbraw/zinc/18/74/83/638187483.db2.gz WAPAIPAADONVST-HDJSIYSDSA-N 2 0 216.328 2.143 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]CCC2CCCCCC2)C1 ZINC000906518500 638188177 /nfs/dbraw/zinc/18/81/77/638188177.db2.gz QMQCQKILQXJDPM-JOCQHMNTSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@@H](CC[NH2+][C@H]1C[C@H]([NH3+])C1)c1ccccc1 ZINC000906516960 638188389 /nfs/dbraw/zinc/18/83/89/638188389.db2.gz ALQBRKYXOMTMNY-UBHSHLNASA-N 2 0 218.344 2.260 20 0 BEADRP C[C@@H](C1CC1)[N@@H+]1CCC[C@]2(CC[NH+](C)C2)C1 ZINC000930602255 639817065 /nfs/dbraw/zinc/81/70/65/639817065.db2.gz OLYWYGRYUYLNBP-GXTWGEPZSA-N 2 0 222.376 2.203 20 0 BEADRP CC1CC(C[N@@H+]2CCC[C@@]3(CC[NH+](C)C3)C2)C1 ZINC000930601382 639817418 /nfs/dbraw/zinc/81/74/18/639817418.db2.gz HFPMLQFOZNOOPT-NRXISQOPSA-N 2 0 236.403 2.450 20 0 BEADRP C[C@@H](C1CC1)[N@@H+]1CCN(c2cc[nH+]cc2)[C@@H](C)C1 ZINC000931683203 640311524 /nfs/dbraw/zinc/31/15/24/640311524.db2.gz HKVUHGNJNLWFCL-STQMWFEESA-N 2 0 245.370 2.391 20 0 BEADRP CC[C@H](C[C@](C)(O)CC)[NH2+][C@@H](C)CC[NH+](C)C ZINC000924855141 640326256 /nfs/dbraw/zinc/32/62/56/640326256.db2.gz VNGIOBLONKAOJO-BFHYXJOUSA-N 2 0 244.423 2.246 20 0 BEADRP Cc1ccsc1C[NH2+]CC1CC[NH+](C)CC1 ZINC000044515391 640398422 /nfs/dbraw/zinc/39/84/22/640398422.db2.gz FHMYFTRBRGLZMR-UHFFFAOYSA-N 2 0 238.400 2.488 20 0 BEADRP CCCC[C@H](C)[NH2+]CC1CC[NH+](C)CC1 ZINC000044516567 640398467 /nfs/dbraw/zinc/39/84/67/640398467.db2.gz UHJBCJCQZUOVEU-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@H]([NH2+]CC1CC[NH+](C)CC1)c1ccccn1 ZINC000044515447 640399422 /nfs/dbraw/zinc/39/94/22/640399422.db2.gz IATDVCREKXWQIW-LBPRGKRZSA-N 2 0 233.359 2.074 20 0 BEADRP C[NH+]1CCC(C[NH2+]Cc2ccc(F)cc2)CC1 ZINC000044515277 640399924 /nfs/dbraw/zinc/39/99/24/640399924.db2.gz ZIMSMJOURARNNX-UHFFFAOYSA-N 2 0 236.334 2.257 20 0 BEADRP CC[C@H]1C[N@H+](C[C@@]2(C)CCC[NH2+]C2)CCS1 ZINC000222152999 640457373 /nfs/dbraw/zinc/45/73/73/640457373.db2.gz AJRWQTOQBFZSTE-STQMWFEESA-N 2 0 242.432 2.204 20 0 BEADRP CC(C)[C@@H]1CC[N@H+](C[C@@H]2CC[C@H]([NH3+])C2)C1 ZINC000166318223 640629241 /nfs/dbraw/zinc/62/92/41/640629241.db2.gz UBDYEKJHLLLXNO-UPJWGTAASA-N 2 0 210.365 2.092 20 0 BEADRP CC[C@@H]1CC[N@H+](C[C@]2(C)CCC[NH2+]C2)C1 ZINC000166351830 640631948 /nfs/dbraw/zinc/63/19/48/640631948.db2.gz OCQSRSRIODELDZ-CHWSQXEVSA-N 2 0 210.365 2.108 20 0 BEADRP C=C/C=C/CC[NH+]1C[C@H]2C[N@@H+](C)C[C@@]2(C)C1 ZINC000933734459 640761343 /nfs/dbraw/zinc/76/13/43/640761343.db2.gz QGZHAVSAPAARFQ-IHDARNGBSA-N 2 0 220.360 2.002 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[N@@H+]2CC[C@@H]3CCCC[C@@H]32)C1 ZINC000226590598 640778768 /nfs/dbraw/zinc/77/87/68/640778768.db2.gz VPSJLUIEJHHXTC-FQUUOJAGSA-N 2 0 222.376 2.378 20 0 BEADRP Cc1ccc(OCC[N@@H+]2CC[C@H]([NH3+])[C@@H](C)C2)cc1 ZINC000227072525 640813983 /nfs/dbraw/zinc/81/39/83/640813983.db2.gz XKAZSVCGPVKIFB-ZFWWWQNUSA-N 2 0 248.370 2.043 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+][C@@H]1CCCc2occc21 ZINC000227129180 640816286 /nfs/dbraw/zinc/81/62/86/640816286.db2.gz CCYUQOXJJFPZIR-CYZMBNFOSA-N 2 0 234.343 2.374 20 0 BEADRP [NH3+]CCCCCC[NH2+]C1Cc2ccccc2C1 ZINC000059911758 640837546 /nfs/dbraw/zinc/83/75/46/640837546.db2.gz XJAHOORYZUIPBA-UHFFFAOYSA-N 2 0 232.371 2.263 20 0 BEADRP Cc1cncc(C[N@@H+](C)C2CCC([NH3+])CC2)c1 ZINC000228621583 640886797 /nfs/dbraw/zinc/88/67/97/640886797.db2.gz PFVCETTUIWMNQI-UHFFFAOYSA-N 2 0 233.359 2.092 20 0 BEADRP CSCC[C@@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000228874295 640901702 /nfs/dbraw/zinc/90/17/02/640901702.db2.gz SLYIQRRSMKKALE-ODWCKFRGSA-N 2 0 242.432 2.343 20 0 BEADRP C[C@H]([NH2+]C1CCC([NH3+])CC1)c1cncs1 ZINC000229127611 640925776 /nfs/dbraw/zinc/92/57/76/640925776.db2.gz QRUSPMZQKWYVCB-IDKOKCKLSA-N 2 0 225.361 2.064 20 0 BEADRP CSCCCC[NH2+]CC1CC[NH+](C)CC1 ZINC000229213437 640934435 /nfs/dbraw/zinc/93/44/35/640934435.db2.gz LVAZVYLHWDPIFE-UHFFFAOYSA-N 2 0 230.421 2.061 20 0 BEADRP C[C@@H]1C[N@H+](CCCCCCC[NH3+])CCCO1 ZINC000061934493 641007947 /nfs/dbraw/zinc/00/79/47/641007947.db2.gz JGSWNNUCLIBVQT-CYBMUJFWSA-N 2 0 228.380 2.006 20 0 BEADRP C[C@@H](C[NH2+]CC(C)(C)C)C[NH+]1CCCC1 ZINC000062079211 641019643 /nfs/dbraw/zinc/01/96/43/641019643.db2.gz QTPMKOZJTPKPLX-LBPRGKRZSA-N 2 0 212.381 2.354 20 0 BEADRP C[N@H+](CC(C)(C)C)C[C@]1(C)CCC[NH2+]C1 ZINC000062867737 641103939 /nfs/dbraw/zinc/10/39/39/641103939.db2.gz FVJRTXAQENZGRP-CYBMUJFWSA-N 2 0 212.381 2.354 20 0 BEADRP CC(C)[NH+]1CCC(C[NH3+])(c2ccccc2)CC1 ZINC000071536447 641147985 /nfs/dbraw/zinc/14/79/85/641147985.db2.gz AYVQQXROAFLWSR-UHFFFAOYSA-N 2 0 232.371 2.387 20 0 BEADRP CC[N@H+](C)C[C@@H]1CC[NH+](C[Si](C)(C)C)C1 ZINC000173913403 641217975 /nfs/dbraw/zinc/21/79/75/641217975.db2.gz QYJWEFUKYRNNLM-LBPRGKRZSA-N 2 0 228.456 2.137 20 0 BEADRP C[C@@H]1CC=CC[C@H]1[NH2+]CC[C@@H]1CCC[N@@H+]1C ZINC000934620999 641218638 /nfs/dbraw/zinc/21/86/38/641218638.db2.gz OHEBBIPKJBGJQK-HZSPNIEDSA-N 2 0 222.376 2.415 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000929697057 641403501 /nfs/dbraw/zinc/40/35/01/641403501.db2.gz QEPSXSFYVCRKKX-ZNMIVQPWSA-N 2 0 236.403 2.450 20 0 BEADRP CC[C@H]1CO[C@H](C)C[N@@H+]1CCCCCCC[NH3+] ZINC000042452099 641552576 /nfs/dbraw/zinc/55/25/76/641552576.db2.gz GQAXKTIRMLKWPH-KGLIPLIRSA-N 2 0 242.407 2.395 20 0 BEADRP CC[N@H+](CCCCCC[NH3+])C[C@H]1CCCO1 ZINC000042471366 641552667 /nfs/dbraw/zinc/55/26/67/641552667.db2.gz UZBKENYOERYMOC-CYBMUJFWSA-N 2 0 228.380 2.006 20 0 BEADRP C[NH+]1CCC(CC[NH2+]C[C@H]2CCC=CO2)CC1 ZINC000187572853 641716143 /nfs/dbraw/zinc/71/61/43/641716143.db2.gz XEWFBLUFPJENDC-CQSZACIVSA-N 2 0 238.375 2.001 20 0 BEADRP CSC(C)(C)C[NH2+][C@H](C)C1CC[NH+](C)CC1 ZINC000154318307 642028091 /nfs/dbraw/zinc/02/80/91/642028091.db2.gz IGAVABVHKXGNTE-LLVKDONJSA-N 2 0 244.448 2.448 20 0 BEADRP C[N@H+]1C[C@H]2CC[C@@H](C1)C2[NH2+]CCCC1CC1 ZINC000925438624 642059454 /nfs/dbraw/zinc/05/94/54/642059454.db2.gz ZDKUSDSYUWVVLW-PBWFPOADSA-N 2 0 222.376 2.106 20 0 BEADRP CCC1(C[NH2+][C@H]2CCC[C@@H]2C[NH3+])CCC1 ZINC000232884538 642073044 /nfs/dbraw/zinc/07/30/44/642073044.db2.gz RNHBYXAFBASJEN-NEPJUHHUSA-N 2 0 210.365 2.284 20 0 BEADRP CCC(C)(C)C[NH2+]C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000232887404 642146291 /nfs/dbraw/zinc/14/62/91/642146291.db2.gz ITPPKPSDCANYHT-VXGBXAGGSA-N 2 0 212.381 2.400 20 0 BEADRP CCC(C)(C)C[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000232891436 642160943 /nfs/dbraw/zinc/16/09/43/642160943.db2.gz FLHPKQCMIPVEEQ-ZDUSSCGKSA-N 2 0 212.381 2.402 20 0 BEADRP CCC(C)(C)C[NH2+]C[C@H]1CC[NH2+][C@@H](C)C1 ZINC000232897384 642202933 /nfs/dbraw/zinc/20/29/33/642202933.db2.gz ITPPKPSDCANYHT-RYUDHWBXSA-N 2 0 212.381 2.400 20 0 BEADRP CC1(C[NH2+]C[C@@]2(C)CCC[NH2+]C2)CCC1 ZINC000232897706 642202987 /nfs/dbraw/zinc/20/29/87/642202987.db2.gz BPJKYWHHAFEPOH-ZDUSSCGKSA-N 2 0 210.365 2.156 20 0 BEADRP CC1(C[NH2+]Cc2ccc(CC[NH3+])cc2)CCC1 ZINC000232932413 642449247 /nfs/dbraw/zinc/44/92/47/642449247.db2.gz HSGRYTAMVCHJMQ-UHFFFAOYSA-N 2 0 232.371 2.468 20 0 BEADRP CC[C@@H](C)C[NH2+]C[C@H]1CCC[N@H+](CC)C1 ZINC000093066493 642455793 /nfs/dbraw/zinc/45/57/93/642455793.db2.gz KBXRDTDIEWVEPK-CHWSQXEVSA-N 2 0 212.381 2.354 20 0 BEADRP CCCC1(C[NH2+]CC2CC[NH+](C)CC2)CC1 ZINC000232957503 642637474 /nfs/dbraw/zinc/63/74/74/642637474.db2.gz JDLVAGSVEJSWCO-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP CCCC[N@H+](C[C@@H]1C[NH2+]C[C@H]1C)C1CC1 ZINC000232954388 642637535 /nfs/dbraw/zinc/63/75/35/642637535.db2.gz HBEBFCYBMDANBF-NEPJUHHUSA-N 2 0 210.365 2.106 20 0 BEADRP CC1(C)C[C@@H]1C[NH2+][C@H]1CCCC[C@@H]1C[NH3+] ZINC000232962047 642640043 /nfs/dbraw/zinc/64/00/43/642640043.db2.gz RKRZMJPEQLIEJF-UTUOFQBUSA-N 2 0 210.365 2.140 20 0 BEADRP CCC1([NH2+]C[C@H]2CC[NH2+][C@H](C)C2)CCC1 ZINC000233054375 642648105 /nfs/dbraw/zinc/64/81/05/642648105.db2.gz FZGICLPRCLWPMV-NEPJUHHUSA-N 2 0 210.365 2.297 20 0 BEADRP CCO[C@@H]1C[C@H]([NH2+]CC([NH3+])(CC)CC)C1(C)C ZINC000233764024 642692700 /nfs/dbraw/zinc/69/27/00/642692700.db2.gz KRWKKMIULPQXPY-NWDGAFQWSA-N 2 0 242.407 2.297 20 0 BEADRP CC[N@H+](CC1CC1)C[C@@]1(C)CCC[NH2+]C1 ZINC000068947611 642814859 /nfs/dbraw/zinc/81/48/59/642814859.db2.gz YSOSVXWOLZAKGC-ZDUSSCGKSA-N 2 0 210.365 2.108 20 0 BEADRP CC[C@H](C)[NH2+]Cc1ccc(CC[NH3+])cc1 ZINC000070533134 643034698 /nfs/dbraw/zinc/03/46/98/643034698.db2.gz LKERCSYZZDJKLI-NSHDSACASA-N 2 0 206.333 2.076 20 0 BEADRP CC[C@@H]1C[C@H](C[NH2+][C@H]2CCC[C@H]([NH3+])C2)CCO1 ZINC000414910528 643085007 /nfs/dbraw/zinc/08/50/07/643085007.db2.gz DBWJVNFIWZCMPH-ZOBORPQBSA-N 2 0 240.391 2.051 20 0 BEADRP CN(c1cc[nH+]c2ccccc21)[C@@H]1CC[NH2+]C1 ZINC000071311613 643121999 /nfs/dbraw/zinc/12/19/99/643121999.db2.gz DWBVLUQNNREUJV-LLVKDONJSA-N 2 0 227.311 2.033 20 0 BEADRP CCC[NH+]1CCC(C[NH3+])(c2ccccc2)CC1 ZINC000071536448 643152219 /nfs/dbraw/zinc/15/22/19/643152219.db2.gz SQZZSFLDDBZPKJ-UHFFFAOYSA-N 2 0 232.371 2.389 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+]CC2(C)CCCC2)C1 ZINC000082619092 643355130 /nfs/dbraw/zinc/35/51/30/643355130.db2.gz CATQODMDFABCAT-CYBMUJFWSA-N 2 0 224.392 2.498 20 0 BEADRP CCC1CC[NH+](C[C@@H]2CC[C@H]([NH3+])C2)CC1 ZINC000085015058 643522983 /nfs/dbraw/zinc/52/29/83/643522983.db2.gz GJLGUCHXWQYFOM-OLZOCXBDSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@H]1C[NH+](CCCCCCC[NH3+])C[C@@H]1C ZINC000086015352 643629061 /nfs/dbraw/zinc/62/90/61/643629061.db2.gz GFBFXYKTJXXZPH-STQMWFEESA-N 2 0 212.381 2.483 20 0 BEADRP C[C@@H]1CC[C@H](C)C[N@H+]1CCC[NH2+]C1CC1 ZINC000084046574 643643109 /nfs/dbraw/zinc/64/31/09/643643109.db2.gz MXNKIBCQPHNFAG-NWDGAFQWSA-N 2 0 210.365 2.249 20 0 BEADRP CC1(C[NH2+][C@H]2CCC[C@@H]2C[NH3+])CCCC1 ZINC000084222016 643651880 /nfs/dbraw/zinc/65/18/80/643651880.db2.gz WTFHSDCPEGQPSB-NEPJUHHUSA-N 2 0 210.365 2.284 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]CCc1cccs1 ZINC000084215623 643651913 /nfs/dbraw/zinc/65/19/13/643651913.db2.gz AFTYHSVOQRRKDL-AAEUAGOBSA-N 2 0 238.400 2.398 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@H](C[NH3+])C2)c(C)c1 ZINC000050245201 643656810 /nfs/dbraw/zinc/65/68/10/643656810.db2.gz KCRPIEWMJVFHQU-CYBMUJFWSA-N 2 0 218.344 2.084 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]C[C@@H]2CCC[NH2+]C2)C1 ZINC000087646338 643667324 /nfs/dbraw/zinc/66/73/24/643667324.db2.gz JACKSXYTNGWUCF-UPJWGTAASA-N 2 0 210.365 2.154 20 0 BEADRP CC[C@H]1CCC[N@H+](C[C@@H]2CC[C@H]([NH3+])C2)C1 ZINC000085014699 643678832 /nfs/dbraw/zinc/67/88/32/643678832.db2.gz KINPNUYVSSBICA-XQQFMLRXSA-N 2 0 210.365 2.236 20 0 BEADRP CC(C)[C@H]1CCC[N@@H+]1CC[C@H]1CCC[NH2+]C1 ZINC000251451266 643802663 /nfs/dbraw/zinc/80/26/63/643802663.db2.gz XDVGEVPANYXWQM-ZIAGYGMSSA-N 2 0 224.392 2.497 20 0 BEADRP CS[C@@H]1CCC[C@@H]([NH2+]C[C@H](C)C[NH+](C)C)C1 ZINC000922140087 643869719 /nfs/dbraw/zinc/86/97/19/643869719.db2.gz NKCNZJDKEHEOEX-YNEHKIRRSA-N 2 0 244.448 2.448 20 0 BEADRP CC(C)C[N@H+](C)CCC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000086573170 644151722 /nfs/dbraw/zinc/15/17/22/644151722.db2.gz AJZPGKBVQHDTOP-AGUYFDCRSA-N 2 0 224.392 2.495 20 0 BEADRP CCCCCC[C@H](O)C[NH2+][C@](C)(C[NH3+])C1CC1 ZINC000923295666 644332758 /nfs/dbraw/zinc/33/27/58/644332758.db2.gz DGWIHGLJZPMTGM-UONOGXRCSA-N 2 0 242.407 2.035 20 0 BEADRP CCCCCC[C@@H](O)C[N@H+](C)CC(C)(C)C[NH3+] ZINC000923294800 644332916 /nfs/dbraw/zinc/33/29/16/644332916.db2.gz QARUHDPJBQURNT-CYBMUJFWSA-N 2 0 244.423 2.234 20 0 BEADRP CCCCCC[C@H](O)C[NH2+][C@@](C)(C[NH3+])C(C)C ZINC000923296241 644335668 /nfs/dbraw/zinc/33/56/68/644335668.db2.gz PZESOZVGVUYMRA-KBPBESRZSA-N 2 0 244.423 2.281 20 0 BEADRP C[C@H]1C[N@H+](CC2CCC3(CC3)CC2)C[C@H]1C[NH3+] ZINC000923412715 644413753 /nfs/dbraw/zinc/41/37/53/644413753.db2.gz TUQLSRRWOHRZEL-GXTWGEPZSA-N 2 0 236.403 2.483 20 0 BEADRP C[C@@H]1CC[C@@H](C)N(CC[NH2+]C(C)(C)C)C1 ZINC000084047063 644414548 /nfs/dbraw/zinc/41/45/48/644414548.db2.gz IKXIBSPLKGSXMV-VXGBXAGGSA-N 2 0 212.381 2.495 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]CC1CCCCC1 ZINC000084218728 644421100 /nfs/dbraw/zinc/42/11/00/644421100.db2.gz HAWQQMUODBFYJD-QWHCGFSZSA-N 2 0 210.365 2.284 20 0 BEADRP C(CC1CC1)[NH2+][C@H]1CC[NH2+]C12CCCC2 ZINC000923428698 644422121 /nfs/dbraw/zinc/42/21/21/644422121.db2.gz QJXMGNPQQFFSIE-LBPRGKRZSA-N 2 0 208.349 2.051 20 0 BEADRP CC(C)C[C@@H](C)CN1CC[C@@H]2CC[NH2+][C@@H]2C1 ZINC000923456168 644434525 /nfs/dbraw/zinc/43/45/25/644434525.db2.gz LYSLUNJTMLCBDK-HZSPNIEDSA-N 2 0 224.392 2.352 20 0 BEADRP CC1(C)C(C[NH2+][C@H]2CCC[C@H]2C[NH3+])C1(C)C ZINC000086239371 644459448 /nfs/dbraw/zinc/45/94/48/644459448.db2.gz OPBQTRQDAUQQDK-QWRGUYRKSA-N 2 0 224.392 2.386 20 0 BEADRP C[C@H]1C[N@H+](CCCCCF)CC[C@H]1C[NH3+] ZINC000923495301 644461895 /nfs/dbraw/zinc/46/18/95/644461895.db2.gz BGEOUJUQBIWVCF-RYUDHWBXSA-N 2 0 216.344 2.043 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)cc1 ZINC000086402139 644465857 /nfs/dbraw/zinc/46/58/57/644465857.db2.gz YESDVVAXAQIFGE-KGLIPLIRSA-N 2 0 218.344 2.355 20 0 BEADRP C[C@H]1C[N@@H+]([C@@H]2C[C@H]2C(C)(C)C)CC[C@@H]1C[NH3+] ZINC000923492890 644467343 /nfs/dbraw/zinc/46/73/43/644467343.db2.gz QZUBRFLZITWPMW-UMSGYPCISA-N 2 0 224.392 2.338 20 0 BEADRP C[C@H]1C[N@H+](Cc2cccc(F)c2)CC[C@H]1C[NH3+] ZINC000923498333 644473747 /nfs/dbraw/zinc/47/37/47/644473747.db2.gz HICJHAOKZXJCIE-AAEUAGOBSA-N 2 0 236.334 2.242 20 0 BEADRP C[C@H](c1ccncc1)[N@@H+]1CC[C@@H](C[NH3+])[C@H](C)C1 ZINC000923500270 644474244 /nfs/dbraw/zinc/47/42/44/644474244.db2.gz NDAXBXDKJAZILY-BZPMIXESSA-N 2 0 233.359 2.059 20 0 BEADRP C[C@@H]1C[N@H+](Cc2ccccc2F)CC[C@@H]1C[NH3+] ZINC000923504203 644474596 /nfs/dbraw/zinc/47/45/96/644474596.db2.gz PWNHQOLPDZCBNO-VXGBXAGGSA-N 2 0 236.334 2.242 20 0 BEADRP CC[NH+]1CCC([C@H]2CCC[NH2+]CC2)CC1 ZINC000923507232 644475359 /nfs/dbraw/zinc/47/53/59/644475359.db2.gz JAYCTPSPZBIMTL-LBPRGKRZSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@H](c1cccnc1)[N@@H+]1CC[C@@H](C[NH3+])[C@H](C)C1 ZINC000923501296 644476304 /nfs/dbraw/zinc/47/63/04/644476304.db2.gz PYLHVKMNDQBUGI-UPJWGTAASA-N 2 0 233.359 2.059 20 0 BEADRP C[C@@H](c1cccc(F)c1)[N@@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1 ZINC000923517890 644479762 /nfs/dbraw/zinc/47/97/62/644479762.db2.gz HCDHAVVBIKGNDL-FPMFFAJLSA-N 2 0 248.345 2.428 20 0 BEADRP CCc1ccccc1C[N@@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1 ZINC000923521306 644482449 /nfs/dbraw/zinc/48/24/49/644482449.db2.gz MPEKYVAIBAEJQA-JKSUJKDBSA-N 2 0 244.382 2.290 20 0 BEADRP Cc1ccc(CC[N@@H+]2C[C@@H]3CC[NH2+]C[C@@H]3C2)cc1 ZINC000923519139 644483046 /nfs/dbraw/zinc/48/30/46/644483046.db2.gz PROUEYPBVPJKEX-JKSUJKDBSA-N 2 0 244.382 2.079 20 0 BEADRP C[C@@H](c1ccccc1F)[N@@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1 ZINC000923518547 644483871 /nfs/dbraw/zinc/48/38/71/644483871.db2.gz NDOXJFRXVWSBRX-RWMBFGLXSA-N 2 0 248.345 2.428 20 0 BEADRP Cc1csc(C[N@@H+]2CCC[C@@H](CC[NH3+])C2)n1 ZINC000087393680 644493761 /nfs/dbraw/zinc/49/37/61/644493761.db2.gz MOQNBOLSUMYNBP-NSHDSACASA-N 2 0 239.388 2.012 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+]CCOc1ccccc1 ZINC000089145801 644535303 /nfs/dbraw/zinc/53/53/03/644535303.db2.gz YDEIBPPIIWZNFA-UKRRQHHQSA-N 2 0 248.370 2.173 20 0 BEADRP CCc1ccccc1C[NH2+][C@@H]1CCC[C@@H]1C[NH3+] ZINC000089150766 644536525 /nfs/dbraw/zinc/53/65/25/644536525.db2.gz BBSVNJKWVRTJMH-UKRRQHHQSA-N 2 0 232.371 2.466 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+]CCOC1CCCC1 ZINC000089146424 644536819 /nfs/dbraw/zinc/53/68/19/644536819.db2.gz YYNFGMLVKSRGTA-TZMCWYRMSA-N 2 0 240.391 2.053 20 0 BEADRP Cc1ccc(C[N@H+](C)CC[C@H]2CC[NH2+]C2)cc1 ZINC000089749129 644565640 /nfs/dbraw/zinc/56/56/40/644565640.db2.gz IMLOQNLRNGTSAT-CQSZACIVSA-N 2 0 232.371 2.426 20 0 BEADRP C[C@@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]C1CCOCC1 ZINC000093514912 644693843 /nfs/dbraw/zinc/69/38/43/644693843.db2.gz MWNOLZXOWAEZED-JSGCOSHPSA-N 2 0 240.391 2.066 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+][C@H]1CCOc2ccccc21 ZINC000250836137 644782440 /nfs/dbraw/zinc/78/24/40/644782440.db2.gz AWKWSYYSTOMYNW-YUTCNCBUSA-N 2 0 246.354 2.227 20 0 BEADRP Cc1ccc([C@H](C)[NH2+][C@H]2CCC[C@H]2C[NH3+])o1 ZINC000251213994 644797501 /nfs/dbraw/zinc/79/75/01/644797501.db2.gz DXXSUNNSNXKZDW-SRVKXCTJSA-N 2 0 222.332 2.366 20 0 BEADRP CCC[C@H](C)C[N@@H+]1CC[C@@H](C[NH3+])[C@H](C)C1 ZINC000251258886 644798488 /nfs/dbraw/zinc/79/84/88/644798488.db2.gz CNTOGWRHJYPMPP-XQQFMLRXSA-N 2 0 212.381 2.339 20 0 BEADRP C[C@H]1C[N@H+](CC2CCCC2)CC[C@H]1C[NH3+] ZINC000251836165 644825694 /nfs/dbraw/zinc/82/56/94/644825694.db2.gz PZPJIZOQRIANKW-AAEUAGOBSA-N 2 0 210.365 2.093 20 0 BEADRP CC[C@@H]1CCC[N@H+](CC[C@H]2CCC[NH2+]C2)C1 ZINC000251907040 644831063 /nfs/dbraw/zinc/83/10/63/644831063.db2.gz XKEBKRCVTQBFQV-ZIAGYGMSSA-N 2 0 224.392 2.498 20 0 BEADRP CC(C)CCCN1CC[C@@]2(CCC[NH2+]2)C1 ZINC000415141708 644885584 /nfs/dbraw/zinc/88/55/84/644885584.db2.gz PVFQUILZVABVJT-ZDUSSCGKSA-N 2 0 210.365 2.251 20 0 BEADRP CC(C)C[C@@H](C)C[N@@H+]1CC[C@]2(CCC[NH2+]2)C1 ZINC000415141990 644885817 /nfs/dbraw/zinc/88/58/17/644885817.db2.gz QFBKYCGTCAATEG-ZIAGYGMSSA-N 2 0 224.392 2.497 20 0 BEADRP CCC(CC)C[N@@H+]1CC[C@@]2(CCC[NH2+]2)C1 ZINC000415136426 644886853 /nfs/dbraw/zinc/88/68/53/644886853.db2.gz HJILAGUXCBHDEY-ZDUSSCGKSA-N 2 0 210.365 2.251 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H]2CC3CCC2CC3)C1 ZINC000926665645 645344820 /nfs/dbraw/zinc/34/48/20/645344820.db2.gz JNQUYANDBSSABB-OGONIBCJSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@H]([NH2+]CC[C@]1(C)C[C@@]1(F)Cl)[C@H]1CCC[NH2+]1 ZINC000844923180 645348060 /nfs/dbraw/zinc/34/80/60/645348060.db2.gz HZGMRXOLAPWDPY-QCNOEVLYSA-N 2 0 248.773 2.421 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+]CCC1(C[NH3+])CC1 ZINC000844920183 645348261 /nfs/dbraw/zinc/34/82/61/645348261.db2.gz KQHPAUVGEUXNGO-RYUDHWBXSA-N 2 0 210.365 2.140 20 0 BEADRP CC(C)[C@H]1CC[C@@H]1[NH2+]CCC1CC[NH2+]CC1 ZINC000844922864 645348476 /nfs/dbraw/zinc/34/84/76/645348476.db2.gz BYXOPFFQUMZPTQ-KGLIPLIRSA-N 2 0 224.392 2.400 20 0 BEADRP Cc1cccc(C[NH2+][C@@H]2C[C@@H]([NH3+])CC(C)(C)C2)n1 ZINC000925485897 645429453 /nfs/dbraw/zinc/42/94/53/645429453.db2.gz PLCRAURXRLCTDL-TZMCWYRMSA-N 2 0 247.386 2.386 20 0 BEADRP C[N@H+]1C[C@H]2CC[C@@H](C1)C2[NH2+]CCC1CC=CC1 ZINC000926947884 645495774 /nfs/dbraw/zinc/49/57/74/645495774.db2.gz BSIQGBYKFIXQJL-YIONKMFJSA-N 2 0 234.387 2.273 20 0 BEADRP C[C@H]1CN(C2CC2)C[C@@H]1[NH2+]CCC1CC=CC1 ZINC000926951953 645499386 /nfs/dbraw/zinc/49/93/86/645499386.db2.gz HLRCAXZNJPRGEA-WFASDCNBSA-N 2 0 234.387 2.415 20 0 BEADRP CCC[C@H](O)CC[NH2+]C1CC[NH+](CCC)CC1 ZINC000927024377 645523651 /nfs/dbraw/zinc/52/36/51/645523651.db2.gz HBSIGWAUEUIVRO-AWEZNQCLSA-N 2 0 242.407 2.002 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]C[C@]23C[C@H]2CCC3)[C@H](C)C1 ZINC000927119010 645556000 /nfs/dbraw/zinc/55/60/00/645556000.db2.gz IOLOFGPWTKYOJT-KBXIAJHMSA-N 2 0 236.403 2.497 20 0 BEADRP CCCC[NH2+][C@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C ZINC000925496095 645935020 /nfs/dbraw/zinc/93/50/20/645935020.db2.gz XGYNIGQTQLGYKL-SRVKXCTJSA-N 2 0 210.365 2.153 20 0 BEADRP CCOCCC[NH2+][C@H]1CCCN2CCCC[C@H]12 ZINC000924523936 646045264 /nfs/dbraw/zinc/04/52/64/646045264.db2.gz CZKZOSPZGDBHHA-UONOGXRCSA-N 2 0 240.391 2.020 20 0 BEADRP COCCC[NH2+]C1CC[NH+](CCC(C)C)CC1 ZINC000924536496 646054219 /nfs/dbraw/zinc/05/42/19/646054219.db2.gz PHUDGRFJSDDSHT-UHFFFAOYSA-N 2 0 242.407 2.123 20 0 BEADRP COCC[NH2+][C@@H](C)c1cccc(C[NH+](C)C)c1 ZINC000924537467 646057807 /nfs/dbraw/zinc/05/78/07/646057807.db2.gz IYCAQRUWYZCYJK-LBPRGKRZSA-N 2 0 236.359 2.045 20 0 BEADRP C[NH+](C)CCC[NH2+][C@H]1CCOC12CCCCC2 ZINC000924541474 646061086 /nfs/dbraw/zinc/06/10/86/646061086.db2.gz VECFEGNAICHRGA-ZDUSSCGKSA-N 2 0 240.391 2.020 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+]C2[C@@H](C)CC[C@@H]2C)C1 ZINC000924706234 646092586 /nfs/dbraw/zinc/09/25/86/646092586.db2.gz PCLATHIVVHKISM-RWMBFGLXSA-N 2 0 224.392 2.352 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H]2[C@H](C)CC[C@@H]2C)C1 ZINC000924706233 646092669 /nfs/dbraw/zinc/09/26/69/646092669.db2.gz PCLATHIVVHKISM-RQJABVFESA-N 2 0 224.392 2.352 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+]C2[C@H](C)CC[C@H]2C)C1 ZINC000924706231 646094078 /nfs/dbraw/zinc/09/40/78/646094078.db2.gz PCLATHIVVHKISM-JHJVBQTASA-N 2 0 224.392 2.352 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@@H]1C[C@H]2C=C[C@@H]1CC2 ZINC000924854901 646118872 /nfs/dbraw/zinc/11/88/72/646118872.db2.gz NUFIXVSWWDUQGG-BFHYXJOUSA-N 2 0 222.376 2.273 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+][C@H]1C[C@H]2C=C[C@@H]1CC2 ZINC000924851511 646119463 /nfs/dbraw/zinc/11/94/63/646119463.db2.gz FLJNJTQRGOZFJT-FQUUOJAGSA-N 2 0 222.376 2.271 20 0 BEADRP CC[N@@H+]1CCC[C@@H](C[NH2+]C2CC(SC)C2)C1 ZINC000924863349 646122187 /nfs/dbraw/zinc/12/21/87/646122187.db2.gz WJXPWNICOHIMKT-HIFPTAJRSA-N 2 0 242.432 2.202 20 0 BEADRP CC1(C)C[C@H]([NH3+])C[C@@H](NCc2nccs2)C1 ZINC000925487813 646298638 /nfs/dbraw/zinc/29/86/38/646298638.db2.gz XJPOKOFFRHKMLM-NXEZZACHSA-N 2 0 239.388 2.139 20 0 BEADRP CC1(C)C[C@@H]([NH3+])C[C@H](NCc2nccs2)C1 ZINC000925487815 646299586 /nfs/dbraw/zinc/29/95/86/646299586.db2.gz XJPOKOFFRHKMLM-UWVGGRQHSA-N 2 0 239.388 2.139 20 0 BEADRP Fc1ccc(CCN[C@@H]2CC[NH2+]C23CCC3)cc1 ZINC000925488776 646300273 /nfs/dbraw/zinc/30/02/73/646300273.db2.gz LGJINMXGGBZKQG-CQSZACIVSA-N 2 0 248.345 2.242 20 0 BEADRP CC1(C)C[C@@H]([NH2+]Cc2ccco2)C[C@@H]([NH3+])C1 ZINC000925506026 646306020 /nfs/dbraw/zinc/30/60/20/646306020.db2.gz WSPVOBXMFJMFPU-MNOVXSKESA-N 2 0 222.332 2.275 20 0 BEADRP CC[NH+](CC)CCN[C@@H](c1ccccc1)[C@@H](C)[NH3+] ZINC000925505487 646306377 /nfs/dbraw/zinc/30/63/77/646306377.db2.gz UJINXFYTBFFBDC-UKRRQHHQSA-N 2 0 249.402 2.006 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+]CCCOC1CCCC1 ZINC000925531723 646320678 /nfs/dbraw/zinc/32/06/78/646320678.db2.gz MMPUPVQXIOXVHO-CYBMUJFWSA-N 2 0 240.391 2.066 20 0 BEADRP CC(C)[N@H+](C)CCN[C@@H](c1ccccc1)[C@@H](C)[NH3+] ZINC000925560614 646335875 /nfs/dbraw/zinc/33/58/75/646335875.db2.gz WTBKTMLJXGEJFE-UKRRQHHQSA-N 2 0 249.402 2.005 20 0 BEADRP COCCCC[NH2+][C@@H](c1ccccc1)[C@H](C)N ZINC000925560564 646336537 /nfs/dbraw/zinc/33/65/37/646336537.db2.gz ZMNGFUMBILEYAQ-GXTWGEPZSA-N 2 0 236.359 2.091 20 0 BEADRP C[C@@H](C[NH2+][C@H]1CC[NH2+]C12CCCC2)C1CC1 ZINC000925583414 646346412 /nfs/dbraw/zinc/34/64/12/646346412.db2.gz FFZQTFNHJGHMFB-AAEUAGOBSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[NH2+]C12CCCC2)C1CC1 ZINC000925583415 646347732 /nfs/dbraw/zinc/34/77/32/646347732.db2.gz FFZQTFNHJGHMFB-DGCLKSJQSA-N 2 0 222.376 2.297 20 0 BEADRP C([NH2+][C@H]1CC[NH2+]C12CCCC2)C1(C2CC2)CC1 ZINC000925589785 646349223 /nfs/dbraw/zinc/34/92/23/646349223.db2.gz KFHAHLOENIZEGO-ZDUSSCGKSA-N 2 0 234.387 2.441 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C)C1 ZINC000929847671 646359557 /nfs/dbraw/zinc/35/95/57/646359557.db2.gz NAJZWNJBDDSNHV-QPSCCSFWSA-N 2 0 236.403 2.449 20 0 BEADRP CC1(C)C[C@@H]([NH3+])C[C@@H]([NH2+]CCc2ccco2)C1 ZINC000925611291 646360534 /nfs/dbraw/zinc/36/05/34/646360534.db2.gz LUICVKWAQFABPO-NWDGAFQWSA-N 2 0 236.359 2.318 20 0 BEADRP CC1(C)C[C@@H]([NH3+])C[C@H]([NH2+]CCc2ccncc2)C1 ZINC000925614358 646362828 /nfs/dbraw/zinc/36/28/28/646362828.db2.gz IIVJUGHQEBYOGN-KBPBESRZSA-N 2 0 247.386 2.120 20 0 BEADRP CCC[C@](C)(O)C[NH2+][C@@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925613630 646362855 /nfs/dbraw/zinc/36/28/55/646362855.db2.gz UKUFGCZKXOZKKR-BZPMIXESSA-N 2 0 242.407 2.033 20 0 BEADRP CC1(C)C[C@@H]([NH2+]Cc2ccoc2)C[C@@H]([NH3+])C1 ZINC000925613582 646363256 /nfs/dbraw/zinc/36/32/56/646363256.db2.gz SVSQENVVJDKNKW-NEPJUHHUSA-N 2 0 222.332 2.275 20 0 BEADRP CC1(C)[C@@H]([NH2+][C@@H]2CC=CCC2)[C@@H]2CCC[NH2+][C@@H]21 ZINC000925619335 646367396 /nfs/dbraw/zinc/36/73/96/646367396.db2.gz MRXTYNIINVICLO-MQYQWHSLSA-N 2 0 234.387 2.461 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+]CC12CCC(CC1)C2 ZINC000925624788 646369966 /nfs/dbraw/zinc/36/99/66/646369966.db2.gz CFDSIPHXWVVGEQ-LXVYMNJGSA-N 2 0 222.376 2.297 20 0 BEADRP C([NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23)C12CCC(CC1)C2 ZINC000925624986 646371421 /nfs/dbraw/zinc/37/14/21/646371421.db2.gz FJRBIPFOJONXDT-JDNGBHBRSA-N 2 0 246.398 2.153 20 0 BEADRP Cc1cncc(C[NH2+][C@H]2C[C@H]([NH3+])CC(C)(C)C2)c1 ZINC000925629718 646373602 /nfs/dbraw/zinc/37/36/02/646373602.db2.gz NLSKUEAOQWTIMX-KBPBESRZSA-N 2 0 247.386 2.386 20 0 BEADRP C[C@@H]1CSC[C@@H]1[NH2+][C@@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925671084 646399962 /nfs/dbraw/zinc/39/99/62/646399962.db2.gz QEXAJBPIFOYDTK-KXNHARMFSA-N 2 0 242.432 2.234 20 0 BEADRP C[C@@H]1CSC[C@@H]1[NH2+][C@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925671086 646400969 /nfs/dbraw/zinc/40/09/69/646400969.db2.gz QEXAJBPIFOYDTK-WYUUTHIRSA-N 2 0 242.432 2.234 20 0 BEADRP CC[C@H]([NH2+][C@H]1C[C@H]([NH3+])CC(C)(C)C1)C(C)(C)O ZINC000925674444 646402099 /nfs/dbraw/zinc/40/20/99/646402099.db2.gz JPZGAKPTHGUNHU-SRVKXCTJSA-N 2 0 242.407 2.032 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+][C@H]1CC[NH2+]C12CCCC2 ZINC000925674620 646402854 /nfs/dbraw/zinc/40/28/54/646402854.db2.gz SNPMHJOOANCFOF-RYUDHWBXSA-N 2 0 222.376 2.439 20 0 BEADRP CC(C)SCCN[C@H]1CC[NH2+]C12CCCC2 ZINC000925672189 646402920 /nfs/dbraw/zinc/40/29/20/646402920.db2.gz TZAVHEKCSMJXMM-LBPRGKRZSA-N 2 0 242.432 2.392 20 0 BEADRP CC(C)C1([NH2+][C@H]2C[C@@H]([NH3+])C23CCC3)CC1 ZINC000925677473 646407760 /nfs/dbraw/zinc/40/77/60/646407760.db2.gz QLVNMPHADHMHLD-MNOVXSKESA-N 2 0 208.349 2.035 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000925688243 646415226 /nfs/dbraw/zinc/41/52/26/646415226.db2.gz CFFFUQMCONLLQQ-OAHLLOKOSA-N 3 0 249.402 2.056 20 0 BEADRP CC1(C)[C@@H]([NH2+]C[C@@H]2C[C@H]2C2CC2)[C@@H]2CCC[NH2+][C@@H]21 ZINC000925689431 646416940 /nfs/dbraw/zinc/41/69/40/646416940.db2.gz GTSBBGMPPPCKFB-AICCOOGYSA-N 2 0 248.414 2.399 20 0 BEADRP C[C@@H](C[NH2+][C@H]1CC[NH2+]C1(C)C)CC(F)(F)F ZINC000925693371 646418639 /nfs/dbraw/zinc/41/86/39/646418639.db2.gz BMSISIRECDTRIC-BDAKNGLRSA-N 2 0 238.297 2.305 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000925694250 646419805 /nfs/dbraw/zinc/41/98/05/646419805.db2.gz RMJOVGIIRFCWRO-CABCVRRESA-N 3 0 249.402 2.040 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000925694252 646420070 /nfs/dbraw/zinc/42/00/70/646420070.db2.gz RMJOVGIIRFCWRO-GJZGRUSLSA-N 3 0 249.402 2.040 20 0 BEADRP CC1(C)C[C@@H]([NH2+][C@H]2CC23CC3)C[C@@H]([NH3+])C1 ZINC000925702447 646426943 /nfs/dbraw/zinc/42/69/43/646426943.db2.gz CZFMMEGWMAWLQF-VWYCJHECSA-N 2 0 208.349 2.035 20 0 BEADRP C1[C@@H]2C[C@@H]([NH2+][C@@H]3CC[NH2+]C34CCCC4)C[C@H]12 ZINC000925704963 646429574 /nfs/dbraw/zinc/42/95/74/646429574.db2.gz JBOSWKCWNFBOIX-YVECIDJPSA-N 2 0 220.360 2.049 20 0 BEADRP CC1(C)C[C@@H]([NH3+])C[C@@H]([NH2+]CCCCCC[NH3+])C1 ZINC000925707229 646432702 /nfs/dbraw/zinc/43/27/02/646432702.db2.gz DKXGPCBATDXLBV-QWHCGFSZSA-N 3 0 241.423 2.001 20 0 BEADRP C1=C[C@H]([NH2+][C@H]2CC[NH2+]C[C@@H]2C2CCCC2)CC1 ZINC000925708684 646432906 /nfs/dbraw/zinc/43/29/06/646432906.db2.gz CZMUKHXBKTXYQL-ZNMIVQPWSA-N 2 0 234.387 2.463 20 0 BEADRP CC1(C)[C@@H]([NH2+][C@@H]2C[C@H]3C[C@H]3C2)[C@@H]2CCC[NH2+][C@@H]21 ZINC000925708054 646432928 /nfs/dbraw/zinc/43/29/28/646432928.db2.gz RCJKCVXVUJPJDT-FDFVQJQPSA-N 2 0 234.387 2.151 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+]CC1CC=CC1 ZINC000925722414 646448568 /nfs/dbraw/zinc/44/85/68/646448568.db2.gz IFGNEDWAFQYWGI-VTXSZYRJSA-N 2 0 220.360 2.058 20 0 BEADRP CC(C)(F)C[NH2+][C@H]1CC[NH2+]C[C@H]1C1CCCC1 ZINC000925725454 646450192 /nfs/dbraw/zinc/45/01/92/646450192.db2.gz UGOFIBOBWFQHJV-STQMWFEESA-N 2 0 242.382 2.492 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+][C@@H]2CCCC[C@@H]2F)C12CCC2 ZINC000925726342 646452366 /nfs/dbraw/zinc/45/23/66/646452366.db2.gz RJQSTMYYKJTBPJ-WHOHXGKFSA-N 2 0 226.339 2.127 20 0 BEADRP CC1(C)[C@H]([NH2+]C[C@H]2C=CCC2)[C@@H]2CCC[NH2+][C@@H]21 ZINC000925731014 646454627 /nfs/dbraw/zinc/45/46/27/646454627.db2.gz IURIOVSCAXCGHD-RFQIPJPRSA-N 2 0 234.387 2.319 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CC1(CC2CC2)CC1 ZINC000925733126 646455934 /nfs/dbraw/zinc/45/59/34/646455934.db2.gz GAAUAQOVXQWUCJ-MNOVXSKESA-N 2 0 210.365 2.282 20 0 BEADRP C([NH2+][C@H]1CCC[NH2+]CC1)C1(CC2CC2)CC1 ZINC000925735342 646458543 /nfs/dbraw/zinc/45/85/43/646458543.db2.gz ZHEBLMCWGPCDFS-ZDUSSCGKSA-N 2 0 222.376 2.298 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCCC1(F)F)[C@H]1CC[NH2+]C1 ZINC000925736280 646459683 /nfs/dbraw/zinc/45/96/83/646459683.db2.gz LDMKKKPMJLVIPF-SDDRHHMPSA-N 2 0 246.345 2.400 20 0 BEADRP CC(C)([NH3+])CC[NH2+][C@H]1CCC[C@@H]1CCF ZINC000925736836 646460519 /nfs/dbraw/zinc/46/05/19/646460519.db2.gz CVYIJPNLVIMBHS-MNOVXSKESA-N 2 0 216.344 2.232 20 0 BEADRP CO[C@H]1C[C@H](C[NH2+][C@@H](c2ccccc2)[C@@H](C)N)C1 ZINC000925735467 646461152 /nfs/dbraw/zinc/46/11/52/646461152.db2.gz GGSGAWWFUCDFCO-QHSBEEBCSA-N 2 0 248.370 2.090 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+][C@@H]1C[C@@H]2CCCC[C@H]12 ZINC000925764975 646465301 /nfs/dbraw/zinc/46/53/01/646465301.db2.gz LDDICLGZNGSTJF-QNWJLWSRSA-N 2 0 210.365 2.281 20 0 BEADRP CCC1([NH3+])CC[NH+]([C@@H]2CC[C@H]2C2CC2)CC1 ZINC000925760084 646465968 /nfs/dbraw/zinc/46/59/68/646465968.db2.gz OFUKLHPVVYENOR-QWHCGFSZSA-N 2 0 222.376 2.378 20 0 BEADRP CC[C@@H]([NH2+]CC[C@H]1CCCO1)[C@@H]1CCCC[NH2+]1 ZINC000925773690 646472158 /nfs/dbraw/zinc/47/21/58/646472158.db2.gz FNUOYXRBACWPRI-MCIONIFRSA-N 2 0 240.391 2.066 20 0 BEADRP CC[C@H]([NH2+][C@@H]1C[NH2+]C[C@H]1C)[C@H]1CC1(C)C ZINC000925782483 646479164 /nfs/dbraw/zinc/47/91/64/646479164.db2.gz GPTYSDYTAUYRCA-WISYIIOYSA-N 2 0 210.365 2.009 20 0 BEADRP CC(C)[C@@H]([NH2+]C[C@@H]1C[NH2+]CCC1(F)F)C1CC1 ZINC000925782338 646479380 /nfs/dbraw/zinc/47/93/80/646479380.db2.gz LIWKGIHCURIHKE-NWDGAFQWSA-N 2 0 246.345 2.255 20 0 BEADRP CCC[C@H]1CCC[C@H]1[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000925785254 646481781 /nfs/dbraw/zinc/48/17/81/646481781.db2.gz MHZLUEIQBOVWNK-ZOBORPQBSA-N 2 0 224.392 2.400 20 0 BEADRP CC[C@H]([NH2+][C@@H]1C[NH2+]C[C@H]1C)C1CCCC1 ZINC000925787609 646482506 /nfs/dbraw/zinc/48/25/06/646482506.db2.gz YVWHUIUXDIOORA-KGYLQXTDSA-N 2 0 210.365 2.153 20 0 BEADRP CSCC1CCC([NH2+][C@@H]2C[NH2+]C[C@H]2C)CC1 ZINC000925787658 646482680 /nfs/dbraw/zinc/48/26/80/646482680.db2.gz ZXWWKZHVKRSWQO-IKWCTNDRSA-N 2 0 242.432 2.106 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1C[NH2+]C[C@H]1C)c1ccco1 ZINC000925797343 646486714 /nfs/dbraw/zinc/48/67/14/646486714.db2.gz GGLXZDHITZORPP-GRYCIOLGSA-N 2 0 222.332 2.176 20 0 BEADRP CC[C@H]([NH2+]CC[C@@H]1C[NH2+]C[C@H]1C)[C@@H]1C[C@H]1C ZINC000925797033 646486893 /nfs/dbraw/zinc/48/68/93/646486893.db2.gz SWJVBQVBLLFONZ-KSTCHIGDSA-N 2 0 224.392 2.256 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1C[NH2+]C[C@H]1C)C1CCCC1 ZINC000925797340 646486991 /nfs/dbraw/zinc/48/69/91/646486991.db2.gz GCHPZEMFHZVRQJ-YRGRVCCFSA-N 2 0 224.392 2.400 20 0 BEADRP CC[C@@H]1CCC[C@H]1[NH2+]CC[C@@H]1C[NH2+]C[C@H]1C ZINC000925795666 646487216 /nfs/dbraw/zinc/48/72/16/646487216.db2.gz HSYWLTLTDTYXDH-AAVRWANBSA-N 2 0 224.392 2.400 20 0 BEADRP CSC1CCC(C[NH2+][C@@H]2CCC[C@@H]2[NH3+])CC1 ZINC000925803371 646488006 /nfs/dbraw/zinc/48/80/06/646488006.db2.gz YOLFYLBLFDLGLP-IFWUJCSASA-N 2 0 242.432 2.378 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+][C@@H]1CCC[C@H]2C[C@]21C ZINC000925804019 646488722 /nfs/dbraw/zinc/48/87/22/646488722.db2.gz XUSASVXNBXXNRL-UXXRCYHCSA-N 2 0 236.403 2.400 20 0 BEADRP CC[C@@H]([NH2+][C@@H]1C[C@H]1[C@@H]1C[C@H]1C)[C@@H]1CCC[NH2+]1 ZINC000925820037 646493904 /nfs/dbraw/zinc/49/39/04/646493904.db2.gz BTMFBJCXMKBTOQ-IKKURHKOSA-N 2 0 222.376 2.151 20 0 BEADRP C[C@H]([NH2+][C@@H](c1ccccn1)C1CC1)[C@@H]1CC[NH2+]C1 ZINC000925822689 646496016 /nfs/dbraw/zinc/49/60/16/646496016.db2.gz NZBXBQRFZQMCTH-NJZAAPMLSA-N 2 0 245.370 2.120 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@@H]1C[C@H]1C(F)(F)F ZINC000925830990 646501008 /nfs/dbraw/zinc/50/10/08/646501008.db2.gz HSUYVPSSXWNSOS-KXUCPTDWSA-N 2 0 238.297 2.292 20 0 BEADRP CC[C@@H]([NH2+]CCC1CC=CC1)[C@@H]1CCC[NH2+]1 ZINC000925831267 646501226 /nfs/dbraw/zinc/50/12/26/646501226.db2.gz IMDMVQPRNYNBSO-KGLIPLIRSA-N 2 0 222.376 2.463 20 0 BEADRP C([NH2+][C@H]1CCCSC1)[C@]12CCC[C@H]1[NH2+]CC2 ZINC000925839329 646505874 /nfs/dbraw/zinc/50/58/74/646505874.db2.gz ABAXWAKQMARZTE-YNEHKIRRSA-N 2 0 240.416 2.004 20 0 BEADRP C[C@H]1CCC[C@@H]1[NH2+]C[C@]12CCC[C@H]1[NH2+]CC2 ZINC000925840058 646505934 /nfs/dbraw/zinc/50/59/34/646505934.db2.gz GRCSSNXCSOQXNY-IGQOVBAYSA-N 2 0 222.376 2.297 20 0 BEADRP Cc1cnc(C[NH2+][C@@H]2CC[NH2+]CC[C@@H]2C)c(C)c1 ZINC000925838561 646506784 /nfs/dbraw/zinc/50/67/84/646506784.db2.gz YUCAYRHKQNGVSM-GXTWGEPZSA-N 2 0 247.386 2.176 20 0 BEADRP C([NH2+]C1CCSCC1)[C@]12CCC[C@H]1[NH2+]CC2 ZINC000925839730 646507000 /nfs/dbraw/zinc/50/70/00/646507000.db2.gz CWPHSDHGUZWUTM-CHWSQXEVSA-N 2 0 240.416 2.004 20 0 BEADRP CC[C@H]([NH2+]C[C@]12CCC[C@H]1[NH2+]CC2)C1CC1 ZINC000925844571 646507708 /nfs/dbraw/zinc/50/77/08/646507708.db2.gz VCABAQKDDIDKCO-BFHYXJOUSA-N 2 0 222.376 2.297 20 0 BEADRP C1CC2(C1)C[C@@H]([NH2+]C1CC[NH2+]CC1)CCS2 ZINC000925861820 646515127 /nfs/dbraw/zinc/51/51/27/646515127.db2.gz TYQOITCQOQSPPX-LBPRGKRZSA-N 2 0 240.416 2.146 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)CCS1 ZINC000925861159 646515321 /nfs/dbraw/zinc/51/53/21/646515321.db2.gz NRMLSHJZLLYJLP-BWOQGFTMSA-N 2 0 240.416 2.143 20 0 BEADRP COC[C@H](C[NH2+][C@@H]1CCCCC[C@H]1[NH3+])C(C)C ZINC000925874233 646523747 /nfs/dbraw/zinc/52/37/47/646523747.db2.gz QASXSWNSYHKFPE-BFHYXJOUSA-N 2 0 242.407 2.155 20 0 BEADRP C[C@@H](Cc1cccs1)[NH2+]C[C@@H]1CC[C@H]([NH3+])C1 ZINC000925876793 646527330 /nfs/dbraw/zinc/52/73/30/646527330.db2.gz ILPNKONKAMBHRR-TUAOUCFPSA-N 2 0 238.400 2.396 20 0 BEADRP C[C@H]1CCCC[C@H]1[NH2+]C[C@@H]1CC[C@H]([NH3+])C1 ZINC000925876510 646527429 /nfs/dbraw/zinc/52/74/29/646527429.db2.gz ADIJDTGBZBVZIX-QNWHQSFQSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CC[C@H]([NH3+])C1)[C@H]1CC1(C)C ZINC000925880174 646529525 /nfs/dbraw/zinc/52/95/25/646529525.db2.gz PGZAGMVZINNIHQ-WISYIIOYSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@H]([NH2+]CC1CCC=CCC1)[C@@H]1CC[NH2+]C1 ZINC000925882187 646530576 /nfs/dbraw/zinc/53/05/76/646530576.db2.gz ZAOBKIBRRGIIHT-GXTWGEPZSA-N 2 0 222.376 2.320 20 0 BEADRP C[C@H]([NH2+]CC1CCC=CCC1)[C@@H]1CCC[NH2+]1 ZINC000925881769 646531154 /nfs/dbraw/zinc/53/11/54/646531154.db2.gz UUPNLRKDQFILBX-JSGCOSHPSA-N 2 0 222.376 2.463 20 0 BEADRP CC[C@@H](C)[NH2+][C@H]1C[C@@](C[NH3+])(c2ccccc2)C1 ZINC000925887884 646533962 /nfs/dbraw/zinc/53/39/62/646533962.db2.gz OHZANILDWUIHNE-YUELXQCFSA-N 2 0 232.371 2.434 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCC[C@@H]([NH3+])C1)[C@@H]1CCCOC1 ZINC000723986902 711551200 /nfs/dbraw/zinc/55/12/00/711551200.db2.gz LXDNEZGPUBYMJK-SYQHCUMBSA-N 2 0 240.391 2.051 20 0 BEADRP CC1(C)C[C@]1(C)C[NH2+][C@H]1C[C@H]([NH3+])C12CCC2 ZINC000702000062 712036129 /nfs/dbraw/zinc/03/61/29/712036129.db2.gz BHQIZRHNGHRIJT-GMXVVIOVSA-N 2 0 222.376 2.282 20 0 BEADRP C([NH2+]C1CCCCC1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000703796829 712087257 /nfs/dbraw/zinc/08/72/57/712087257.db2.gz LNEYRBZITRXFPA-QXMXGUDHSA-N 2 0 222.376 2.439 20 0 BEADRP C[N@H+](CCC1CC1)CC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000703797789 712087599 /nfs/dbraw/zinc/08/75/99/712087599.db2.gz VKXOAKMVATWTAN-AGUYFDCRSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@@H]1CC[C@H](C)[N@H+]1CC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000706457204 712145105 /nfs/dbraw/zinc/14/51/05/712145105.db2.gz UKENNZSHKZRQLD-LSPKCERGSA-N 2 0 222.376 2.390 20 0 BEADRP C[C@@H](CC[NH2+][C@@H]1CCCC12CC2)[NH+](C)C ZINC000706614981 712151339 /nfs/dbraw/zinc/15/13/39/712151339.db2.gz MSQHNQAZLMHSKW-NWDGAFQWSA-N 2 0 210.365 2.249 20 0 BEADRP [NH3+]CCCCCCC[N@@H+]1CC[C@]2(CCOC2)C1 ZINC000707211403 712167281 /nfs/dbraw/zinc/16/72/81/712167281.db2.gz BBQPYMWXJUBVEV-AWEZNQCLSA-N 2 0 240.391 2.008 20 0 BEADRP CSCC[C@@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000709467165 712222239 /nfs/dbraw/zinc/22/22/39/712222239.db2.gz ZXMKCQVSUVGBAH-YIBTVLSRSA-N 2 0 228.405 2.001 20 0 BEADRP C[C@H](CC1CCC1)[NH2+][C@@H]1C[C@H]([NH3+])C12CCC2 ZINC000710271214 712250273 /nfs/dbraw/zinc/25/02/73/712250273.db2.gz JONRCCHLISUANM-KGYLQXTDSA-N 2 0 222.376 2.425 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C=CCC1)[C@H]1CCCC[NH2+]1 ZINC000711719200 712319227 /nfs/dbraw/zinc/31/92/27/712319227.db2.gz LTDYEMPQCXLTDJ-RWMBFGLXSA-N 2 0 208.349 2.073 20 0 BEADRP CC1(C)CC[C@H](CN2CCCC[C@@H]2C[NH3+])OC1 ZINC000713588079 712466207 /nfs/dbraw/zinc/46/62/07/712466207.db2.gz SQSFRCMAPSODOH-CHWSQXEVSA-N 2 0 240.391 2.005 20 0 BEADRP C=C/C=C\CC[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000713695075 712469430 /nfs/dbraw/zinc/46/94/30/712469430.db2.gz MKBCMSACPBRSGO-SZZPACECSA-N 2 0 222.376 2.439 20 0 BEADRP C=C/C=C/CC[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000713742571 712471092 /nfs/dbraw/zinc/47/10/92/712471092.db2.gz ZIKRLWPUKSLLTE-LSMGEYOZSA-N 2 0 220.360 2.335 20 0 BEADRP C[C@]1(C[NH3+])CC[N@H+](C[C@H]2CCCC(C)(C)O2)C1 ZINC000714375223 712484359 /nfs/dbraw/zinc/48/43/59/712484359.db2.gz SEHQGDIAUYSEIS-TZMCWYRMSA-N 2 0 240.391 2.005 20 0 BEADRP CC1(C)CCC[C@@H](C[N@@H+]2CC[C@H](CC[NH3+])C2)O1 ZINC000714339381 712483030 /nfs/dbraw/zinc/48/30/30/712483030.db2.gz SHVLJHFDPXOIEG-STQMWFEESA-N 2 0 240.391 2.005 20 0 BEADRP CCCC[NH+]1CCC(C(C)(C)C[NH3+])CC1 ZINC000714402400 712485027 /nfs/dbraw/zinc/48/50/27/712485027.db2.gz BMTMGDNFRHPCDX-UHFFFAOYSA-N 2 0 212.381 2.483 20 0 BEADRP C[N@H+](C[C@@H]1CCCC(C)(C)O1)C1CC[NH2+]CC1 ZINC000714374257 712484380 /nfs/dbraw/zinc/48/43/80/712484380.db2.gz HMRRHXYLSGQGMW-ZDUSSCGKSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@@H]([NH3+])[C@@H]1CC[N@H+](CC[C@@H]2C[C@H]2C2CC2)C1 ZINC000714921315 712499621 /nfs/dbraw/zinc/49/96/21/712499621.db2.gz XMOYPQTVRBELLB-ZRJCITRHSA-N 2 0 222.376 2.092 20 0 BEADRP CC[C@H](C)[C@@H](C)[NH2+]C[C@@H]1C[NH2+]CCC1(F)F ZINC000717045284 712624951 /nfs/dbraw/zinc/62/49/51/712624951.db2.gz HYWJFQHLZIVSFX-AXFHLTTASA-N 2 0 234.334 2.255 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)C(C)C ZINC000037485282 712650709 /nfs/dbraw/zinc/65/07/09/712650709.db2.gz PMMGYGRRPBRKBX-GXTWGEPZSA-N 2 0 224.392 2.495 20 0 BEADRP CC[C@H]([NH2+]C[C@H]1CC[N@H+](CC)C1)C(C)C ZINC000037484318 712650859 /nfs/dbraw/zinc/65/08/59/712650859.db2.gz VKYVUPSRQKSDCK-OLZOCXBDSA-N 2 0 212.381 2.352 20 0 BEADRP CCCCCC[N@@H+]1CC[C@H]2[NH2+]CC[C@H]2C1 ZINC000389566978 712689519 /nfs/dbraw/zinc/68/95/19/712689519.db2.gz AINDVNALZLHTGO-QWHCGFSZSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@@H]1CC[N@H+](CCCC(C)(F)F)C[C@H]1C[NH3+] ZINC000718570261 712775186 /nfs/dbraw/zinc/77/51/86/712775186.db2.gz JJFKHMLOJIXFSL-GHMZBOCLSA-N 2 0 234.334 2.339 20 0 BEADRP COCC(C)(C)CC[NH2+][C@H](C)CCCC[NH3+] ZINC000718649949 712776807 /nfs/dbraw/zinc/77/68/07/712776807.db2.gz XMVRBXNAFOKNSE-GFCCVEGCSA-N 2 0 230.396 2.156 20 0 BEADRP COCC(C)(C)CC[NH2+][C@H]1CCCC[C@H]1C[NH3+] ZINC000718669127 712776716 /nfs/dbraw/zinc/77/67/16/712776716.db2.gz YWBVHJRVHODQQG-STQMWFEESA-N 2 0 242.407 2.156 20 0 BEADRP CO[C@@H]1CCC[C@@H]([NH2+]CCCC[NH+](C)C)CC1 ZINC000718843277 712785994 /nfs/dbraw/zinc/78/59/94/712785994.db2.gz PXZZQQWTOFXKCS-ZIAGYGMSSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@H]1C[C@H](C)C[C@H](C)C1 ZINC000719374722 712805991 /nfs/dbraw/zinc/80/59/91/712805991.db2.gz CBLCGJXLNHPHSF-BJJPWKGXSA-N 2 0 224.392 2.256 20 0 BEADRP CCCCCCN1CCC[C@@H]2[NH2+]CC[C@H]21 ZINC000720902206 712875937 /nfs/dbraw/zinc/87/59/37/712875937.db2.gz DVRFOCVNVHJZCV-QWHCGFSZSA-N 2 0 210.365 2.393 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@@H]1CC2CCC1CC2 ZINC000381123559 710602979 /nfs/dbraw/zinc/60/29/79/710602979.db2.gz JBCPNIBHPJYCHJ-BLYZHGLHSA-N 2 0 224.392 2.495 20 0 BEADRP CC[NH+](CC)CCC[NH2+]C1CC(C(F)F)C1 ZINC000381750540 710701540 /nfs/dbraw/zinc/70/15/40/710701540.db2.gz RAGBTMGROMKLNL-UHFFFAOYSA-N 2 0 234.334 2.352 20 0 BEADRP CC[C@H]([NH2+]CCCC[NH+](C)C)[C@@H]1CCCOC1 ZINC000724006090 710735175 /nfs/dbraw/zinc/73/51/75/710735175.db2.gz JRUMKVVNSBAQOG-KGLIPLIRSA-N 2 0 242.407 2.123 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+]C[C@@]2(C)CCCS2)C1 ZINC000382099356 710776630 /nfs/dbraw/zinc/77/66/30/710776630.db2.gz BEMFWOOQCJTESA-CHWSQXEVSA-N 2 0 242.432 2.204 20 0 BEADRP CC[C@@H]1[C@H](C)CC[N@@H+]1C[C@@]1(C)CCC[NH2+]C1 ZINC000383994983 710987448 /nfs/dbraw/zinc/98/74/48/710987448.db2.gz AATPGSLGIGAVAH-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2 ZINC000385486677 711013332 /nfs/dbraw/zinc/01/33/32/711013332.db2.gz HETWZSJHWLNYBP-KDELZDPKSA-N 2 0 248.414 2.399 20 0 BEADRP C[C@@H]1CCC[C@H](C[NH2+][C@H]2[C@@H]3[NH2+]C[C@@H]4C[C@H]2C[C@@H]43)C1 ZINC000385545750 711015204 /nfs/dbraw/zinc/01/52/04/711015204.db2.gz VPEIMWPIDQVPMU-UQYNZRTDSA-N 2 0 248.414 2.399 20 0 BEADRP C[C@H]([NH2+]CCC1CCC1)[C@@H]1CCCC[NH2+]1 ZINC000386139954 711023993 /nfs/dbraw/zinc/02/39/93/711023993.db2.gz QGBISVJWMRZENV-AAEUAGOBSA-N 2 0 210.365 2.297 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+]CCN1CCC[C@H]1C ZINC000390344560 711112542 /nfs/dbraw/zinc/11/25/42/711112542.db2.gz NTOZEWAZMYGTEY-HZSPNIEDSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC[C@@H]1C)C[NH+]1CCCCC1 ZINC000390459379 711119339 /nfs/dbraw/zinc/11/93/39/711119339.db2.gz BLSZFNDEDZPRQJ-RDBSUJKOSA-N 2 0 224.392 2.497 20 0 BEADRP CSC1(C[NH2+][C@@H]2CC[C@@H]2C)CC[NH+](C)CC1 ZINC000390509997 711122948 /nfs/dbraw/zinc/12/29/48/711122948.db2.gz ZCEGHWAEFZMNSL-NWDGAFQWSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@H](C[NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2)C(C)(C)C ZINC000392940425 711155164 /nfs/dbraw/zinc/15/51/64/711155164.db2.gz ZVXFSTBTWMBYRK-WFQJECDVSA-N 2 0 236.403 2.255 20 0 BEADRP [NH3+]CC[C@@H]1CCC[N@H+](CCCC2CC2)C1 ZINC000394493378 711193387 /nfs/dbraw/zinc/19/33/87/711193387.db2.gz LRVFNSOINNWDTL-ZDUSSCGKSA-N 2 0 210.365 2.237 20 0 BEADRP CCCN1CCC[C@H]1C[NH2+][C@H]1CC[C@@H]1C ZINC000393604696 711165353 /nfs/dbraw/zinc/16/53/53/711165353.db2.gz CHSCZDAYULEIEB-AVGNSLFASA-N 2 0 210.365 2.249 20 0 BEADRP COC(C)(C)[C@H](C)[NH2+][C@H](C)C1CC[NH+](C)CC1 ZINC000396445644 711221229 /nfs/dbraw/zinc/22/12/29/711221229.db2.gz PGFDGRJHNLQOMX-NEPJUHHUSA-N 2 0 242.407 2.120 20 0 BEADRP C[C@H]1NCCC[C@@H]1[NH2+]CCCOc1ccccc1 ZINC000396633918 711361579 /nfs/dbraw/zinc/36/15/79/711361579.db2.gz JSWCECGBLQZVLB-HIFRSBDPSA-N 2 0 248.370 2.186 20 0 BEADRP CC[C@@H]1C[C@@H](C)C[N@@H+]1C[C@@H]([NH3+])CC(F)F ZINC000399143539 711421964 /nfs/dbraw/zinc/42/19/64/711421964.db2.gz CNVXJPQJMMCOLJ-KXUCPTDWSA-N 2 0 220.307 2.089 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1C[C@H]1C1CC1)[C@H]1CCC[NH2+]1 ZINC000712748172 711450049 /nfs/dbraw/zinc/45/00/49/711450049.db2.gz DTXWGOZTURQICB-RUZUBIRVSA-N 2 0 222.376 2.153 20 0 BEADRP C([NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23)C1CCCCC1 ZINC000383232510 711481821 /nfs/dbraw/zinc/48/18/21/711481821.db2.gz BNUYGRPQEJXIQG-XPABHHOTSA-N 2 0 234.387 2.153 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1CCCC[C@H]1CC[NH3+] ZINC000723081283 711501226 /nfs/dbraw/zinc/50/12/26/711501226.db2.gz UIEBQOGSYPRRCZ-AGIUHOORSA-N 2 0 210.365 2.236 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@H](CC[NH3+])C2)c(C)c1 ZINC000723669939 711532932 /nfs/dbraw/zinc/53/29/32/711532932.db2.gz MGMJJYWAOWCYTL-AWEZNQCLSA-N 2 0 232.371 2.474 20 0 BEADRP Cc1ccc(OCC[N@@H+]2CC[C@H](CC[NH3+])C2)cc1 ZINC000723670071 711533040 /nfs/dbraw/zinc/53/30/40/711533040.db2.gz OGHDATGOYFSPDC-AWEZNQCLSA-N 2 0 248.370 2.045 20 0 BEADRP C[C@@H]1C[N@H+](C[C@H]2CCCC[C@H]2C)C[C@H]1C[NH3+] ZINC000723862701 711539722 /nfs/dbraw/zinc/53/97/22/711539722.db2.gz QSJAIXGKHHEXPK-AAVRWANBSA-N 2 0 224.392 2.339 20 0 BEADRP Cc1cc(C)nc(CN2CC[C@H]3CC[C@@H](C2)[NH2+]3)c1 ZINC000723877053 711542282 /nfs/dbraw/zinc/54/22/82/711542282.db2.gz QPSLBGNZROGBEP-KGLIPLIRSA-N 2 0 245.370 2.025 20 0 BEADRP CCC[C@@H](C)C[N@@H+]1C[C@@H](C)[C@H](CC[NH3+])C1 ZINC000723900626 711544291 /nfs/dbraw/zinc/54/42/91/711544291.db2.gz KWZRJIUGWUSWIZ-JHJVBQTASA-N 2 0 212.381 2.339 20 0 BEADRP C[C@@H]1C[N@H+](CCc2ccccc2)C[C@H]1CC[NH3+] ZINC000723908825 711544799 /nfs/dbraw/zinc/54/47/99/711544799.db2.gz KRYYXULXQQUDGN-UKRRQHHQSA-N 2 0 232.371 2.146 20 0 BEADRP [NH3+]C1CC([NH2+][C@@H]2CCC[C@H](C(F)(F)F)C2)C1 ZINC000087651570 711546026 /nfs/dbraw/zinc/54/60/26/711546026.db2.gz UXARPYILYBLTDX-QGVKSAJWSA-N 2 0 236.281 2.187 20 0 BEADRP C[C@H]([NH2+]CCC1CC=CC1)[C@@H]1CCC[NH2+]1 ZINC000724127732 711562801 /nfs/dbraw/zinc/56/28/01/711562801.db2.gz ARGAEWGESUKRQY-AAEUAGOBSA-N 2 0 208.349 2.073 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]CCC1CC=CC1 ZINC000724200690 711568892 /nfs/dbraw/zinc/56/88/92/711568892.db2.gz PVVAMQJWJUCGMC-QWHCGFSZSA-N 2 0 208.349 2.060 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]CCC2CC=CC2)C1 ZINC000724201120 711569050 /nfs/dbraw/zinc/56/90/50/711569050.db2.gz STROWWKLOHOURW-CHWSQXEVSA-N 2 0 208.349 2.202 20 0 BEADRP C[C@H]([NH2+]CCC1CC=CC1)[C@H]1CCCC[NH2+]1 ZINC000724202160 711569912 /nfs/dbraw/zinc/56/99/12/711569912.db2.gz KHSIIVFFKPGGOB-GXTWGEPZSA-N 2 0 222.376 2.463 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]CCC2CC=CC2)C12CCC2 ZINC000724221191 711570249 /nfs/dbraw/zinc/57/02/49/711570249.db2.gz ZELNLUKWMXSHKQ-STQMWFEESA-N 2 0 220.360 2.202 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2 ZINC000383374306 711646039 /nfs/dbraw/zinc/64/60/39/711646039.db2.gz ZNXOWAFXCQOQNO-QLMDPUNJSA-N 2 0 234.387 2.151 20 0 BEADRP C[C@@H]1CCC[C@@H]1C[NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23 ZINC000383104492 711668073 /nfs/dbraw/zinc/66/80/73/711668073.db2.gz CSVRDWRYGUNIQM-NIDFBQPUSA-N 2 0 234.387 2.009 20 0 BEADRP C[N@H+](CCCC1CC1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000394603599 711707277 /nfs/dbraw/zinc/70/72/77/711707277.db2.gz JNUUWZUTOPTNQP-PBWFPOADSA-N 2 0 222.376 2.391 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+][C@H]1CCCC12CC2 ZINC000925723861 711727314 /nfs/dbraw/zinc/72/73/14/711727314.db2.gz CMMYHXLGZJDZQN-VZANTVGXSA-N 2 0 234.387 2.425 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]C[C@@H]2C[C@H]2C(F)(F)F)C1 ZINC000925833520 711759892 /nfs/dbraw/zinc/75/98/92/711759892.db2.gz SSMDIYSITHEIIO-AATLWQCWSA-N 2 0 236.281 2.044 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+]CC1(C)CCC1 ZINC000722507709 711760181 /nfs/dbraw/zinc/76/01/81/711760181.db2.gz HXWMTMLNOAYUMD-VXGBXAGGSA-N 2 0 210.365 2.012 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CC1CCC=CCC1 ZINC000925880065 711762039 /nfs/dbraw/zinc/76/20/39/711762039.db2.gz HBVTYMIDAOIMRM-VXGBXAGGSA-N 2 0 210.365 2.448 20 0 BEADRP CSC(C)(C)C[NH2+][C@@H]1CCCC[C@H]1C[NH3+] ZINC000229083520 711837459 /nfs/dbraw/zinc/83/74/59/711837459.db2.gz DKWQBQAFSMAKRA-WDEREUQCSA-N 2 0 230.421 2.235 20 0 BEADRP [NH3+]CC[C@@H]1CCC[N@H+](CCc2cccs2)C1 ZINC000069724374 711893578 /nfs/dbraw/zinc/89/35/78/711893578.db2.gz UXCIXTVAACPFQC-LBPRGKRZSA-N 2 0 238.400 2.351 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]CCC2(F)CCC2)C12CCC2 ZINC000705282019 711900614 /nfs/dbraw/zinc/90/06/14/711900614.db2.gz XINIDPRJMIMLHU-MNOVXSKESA-N 2 0 226.339 2.128 20 0 BEADRP COC[C@@H](C[N@@H+]1CCCC[C@H]1CC[NH3+])C(C)C ZINC000721959265 711947879 /nfs/dbraw/zinc/94/78/79/711947879.db2.gz HGMRSTZDTFIJAJ-KGLIPLIRSA-N 2 0 242.407 2.108 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000423373359 711958174 /nfs/dbraw/zinc/95/81/74/711958174.db2.gz RXTIOIBODATGPW-VOAKCMCISA-N 2 0 210.365 2.281 20 0 BEADRP CC[C@@H]1CCC[N@H+](C[C@@H]2CCCC[NH2+]C2)C1 ZINC000700240000 711988191 /nfs/dbraw/zinc/98/81/91/711988191.db2.gz ZLVFKYMPDKSVLD-ZIAGYGMSSA-N 2 0 224.392 2.498 20 0 BEADRP CCC[C@@H](C)[N@H+](C)C[C@@H]1CCCC[NH2+]C1 ZINC000700256312 711988717 /nfs/dbraw/zinc/98/87/17/711988717.db2.gz GADDYEBBHZIUJL-CHWSQXEVSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+]C[C@@H]1CCCC[N@H+](C)C1 ZINC000700799733 712006038 /nfs/dbraw/zinc/00/60/38/712006038.db2.gz LLUCWCFAKHKZPA-AGIUHOORSA-N 2 0 210.365 2.106 20 0 BEADRP C(C[NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32)CC1CCC1 ZINC000701746117 712028705 /nfs/dbraw/zinc/02/87/05/712028705.db2.gz AUABLMHNMMYAMY-BTFPBAQTSA-N 2 0 234.387 2.153 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]CCCC2CCC2)C12CCC2 ZINC000701771981 712028896 /nfs/dbraw/zinc/02/88/96/712028896.db2.gz LSUNUKKPDAVTEG-OLZOCXBDSA-N 2 0 222.376 2.426 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@@]2(C)CC2(C)C)CC1 ZINC000702019936 712036502 /nfs/dbraw/zinc/03/65/02/712036502.db2.gz XGFNFPSRIBAZAZ-ZDUSSCGKSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@]12C[NH2+]C[C@H]1C[N@H+](CCC1CCCC1)C2 ZINC000702049215 712037594 /nfs/dbraw/zinc/03/75/94/712037594.db2.gz NCEXTLYERWUANT-UONOGXRCSA-N 2 0 222.376 2.108 20 0 BEADRP C[C@@H]1CCC[C@H](C[N@@H+]2C[C@@H]3C[NH2+]C[C@]3(C)C2)C1 ZINC000702076778 712038129 /nfs/dbraw/zinc/03/81/29/712038129.db2.gz MVRIKWFWDWIGGG-CBBWQLFWSA-N 2 0 236.403 2.354 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]CC[C@H]1CCSC1 ZINC000704797962 712117640 /nfs/dbraw/zinc/11/76/40/712117640.db2.gz OHMRMFJRKQRKCX-AVGNSLFASA-N 2 0 242.432 2.237 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CC[C@@H]1CCSC1 ZINC000704840196 712118982 /nfs/dbraw/zinc/11/89/82/712118982.db2.gz GSPOJOUFEQKPIO-VXGBXAGGSA-N 2 0 230.421 2.237 20 0 BEADRP C[C@@H]1CC[C@@H](C)[NH+]1CC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000706457202 712145233 /nfs/dbraw/zinc/14/52/33/712145233.db2.gz UKENNZSHKZRQLD-DUJLVANISA-N 2 0 222.376 2.390 20 0 BEADRP CC[N@H+](C[C@H]1CCCC[NH2+]C1)C1CCC1 ZINC000706816826 712156488 /nfs/dbraw/zinc/15/64/88/712156488.db2.gz HKCPHYICHHWDAU-LBPRGKRZSA-N 2 0 210.365 2.251 20 0 BEADRP CSC1CC([NH2+]C[C@@H]2CC[N@@H+](C(C)C)C2)C1 ZINC000706920671 712160978 /nfs/dbraw/zinc/16/09/78/712160978.db2.gz XJZQLFJWWPIFQW-HIFPTAJRSA-N 2 0 242.432 2.200 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+][C@@H]2CCCC23CC3)C12CCC2 ZINC000706949931 712162804 /nfs/dbraw/zinc/16/28/04/712162804.db2.gz WHYIBVYKKDREPV-UTUOFQBUSA-N 2 0 220.360 2.179 20 0 BEADRP CC(C)[C@@H]([NH3+])CC[N@H+](C)C[C@H]1CC(C)(C)CO1 ZINC000708334751 712187967 /nfs/dbraw/zinc/18/79/67/712187967.db2.gz AHFNBHAANXHZAI-OLZOCXBDSA-N 2 0 242.407 2.107 20 0 BEADRP C[NH2+]CCC[N@H+](C)C[C@H]1CC(C)(C)OC1(C)C ZINC000709698152 712216044 /nfs/dbraw/zinc/21/60/44/712216044.db2.gz YTUXCMXFSCHOCV-GFCCVEGCSA-N 2 0 242.407 2.121 20 0 BEADRP CC1(C)C[C@H](C[NH2+]CC2([NH3+])CCC2)C(C)(C)O1 ZINC000709756500 712217747 /nfs/dbraw/zinc/21/77/47/712217747.db2.gz USXYNIRTADBWGN-LLVKDONJSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@H]1[C@H]2CC[C@@H](C[C@@H]1[NH2+]C1CCSCC1)[NH2+]2 ZINC000709283367 712219009 /nfs/dbraw/zinc/21/90/09/712219009.db2.gz MFMCFPQNTDPJOT-SYEHKZFSSA-N 2 0 240.416 2.001 20 0 BEADRP C[C@H]1[C@H]2CC[C@@H](C[C@H]1[NH2+]C1CCCC1)[NH2+]2 ZINC000709374460 712220468 /nfs/dbraw/zinc/22/04/68/712220468.db2.gz QNEMBIZBDMAUOD-FTYKPCCVSA-N 2 0 208.349 2.048 20 0 BEADRP C[C@@H]1[C@H]2CC[C@@H](C[C@@H]1[NH2+][C@@H]1CC[C@H]3C[C@H]3C1)[NH2+]2 ZINC000709421387 712221430 /nfs/dbraw/zinc/22/14/30/712221430.db2.gz DDZAJBWTTKSBPA-FXWFOLBNSA-N 2 0 234.387 2.294 20 0 BEADRP C[N@H+](CCCCCC[NH3+])CCc1cccnc1 ZINC000710706050 712255095 /nfs/dbraw/zinc/25/50/95/712255095.db2.gz QPYXQZHPQDIGTC-UHFFFAOYSA-N 2 0 235.375 2.075 20 0 BEADRP C[N@H+](CCCCCC[NH3+])CC[C@@H]1CCCO1 ZINC000710749258 712255889 /nfs/dbraw/zinc/25/58/89/712255889.db2.gz HXLSOYCHKAKRJS-ZDUSSCGKSA-N 2 0 228.380 2.006 20 0 BEADRP Cc1cnccc1C[N@H+](C)CCCCCC[NH3+] ZINC000710818287 712257327 /nfs/dbraw/zinc/25/73/27/712257327.db2.gz FYXHXUTUEIFCRO-UHFFFAOYSA-N 2 0 235.375 2.341 20 0 BEADRP C[N@H+](CCCCCC[NH3+])C[C@H]1CC1(C)C ZINC000710800731 712257496 /nfs/dbraw/zinc/25/74/96/712257496.db2.gz XNNRWDHOSPTUAT-GFCCVEGCSA-N 2 0 212.381 2.483 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H]2C[C@@H]3CC[C@@H](C3)C2)C1 ZINC000711205504 712289271 /nfs/dbraw/zinc/28/92/71/712289271.db2.gz YJMPRSZAUJJEDN-LJISPDSOSA-N 2 0 236.403 2.497 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2C[C@@H]3CC[C@@H](C3)C2)C1 ZINC000711204766 712289313 /nfs/dbraw/zinc/28/93/13/712289313.db2.gz TXJKOQQCAQSMJR-LXTVHRRPSA-N 2 0 236.403 2.497 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H]2C[C@@H]3CC[C@@H](C3)C2)C1 ZINC000711205503 712289331 /nfs/dbraw/zinc/28/93/31/712289331.db2.gz YJMPRSZAUJJEDN-BARDWOONSA-N 2 0 236.403 2.497 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@H]2C[C@@H]3CC[C@@H](C3)C2)CC1 ZINC000711203060 712289339 /nfs/dbraw/zinc/28/93/39/712289339.db2.gz MIFLEZCRZBRFTF-FICVDOATSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2CCC[C@@H](CF)C2)CC[NH2+]1 ZINC000711463304 712304602 /nfs/dbraw/zinc/30/46/02/712304602.db2.gz VTLNKBUPHFJMJA-UPJWGTAASA-N 2 0 228.355 2.056 20 0 BEADRP C1=C[C@H](C[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)CC1 ZINC000711719513 712319440 /nfs/dbraw/zinc/31/94/40/712319440.db2.gz NLZVNXMHPCJCER-IHRRRGAJSA-N 2 0 220.360 2.169 20 0 BEADRP Cc1cc(C)c(C[N@@H+]2CC[C@@H](CC[NH3+])C2)c(C)n1 ZINC000923478716 712334488 /nfs/dbraw/zinc/33/44/88/712334488.db2.gz HNYHODHMFVRNHE-CQSZACIVSA-N 2 0 247.386 2.178 20 0 BEADRP CSCC[C@@H](C)[NH2+][C@H](C)CCCC[NH3+] ZINC000379517223 712387193 /nfs/dbraw/zinc/38/71/93/712387193.db2.gz AWOVBJBKLUNYPO-GHMZBOCLSA-N 2 0 218.410 2.235 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]1[NH2+]CC[C@@H]1C[C@H]1C1CC1 ZINC000712642610 712439247 /nfs/dbraw/zinc/43/92/47/712439247.db2.gz NDMSPCXXLAIFDJ-HZSPNIEDSA-N 2 0 236.403 2.400 20 0 BEADRP C([C@@H]1C[C@H]2C[C@H]2C1)[N@@H+]1CC[NH2+]CCC12CCC2 ZINC000713136126 712453241 /nfs/dbraw/zinc/45/32/41/712453241.db2.gz YKPSOLLDTFPIPT-BTTYYORXSA-N 2 0 234.387 2.251 20 0 BEADRP C=C/C=C/CC[N@@H+]1CC[C@H]([NH3+])[C@H](CC)C1 ZINC000713700392 712469414 /nfs/dbraw/zinc/46/94/14/712469414.db2.gz AEDXMTZOFVOGJZ-PBJSTTKNSA-N 2 0 208.349 2.178 20 0 BEADRP C=C/C=C/CC[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000713691408 712469607 /nfs/dbraw/zinc/46/96/07/712469607.db2.gz BJJDWECBBMIAPC-FBVTZJDUSA-N 2 0 208.349 2.191 20 0 BEADRP C=C/C=C\CC[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000713742568 712470915 /nfs/dbraw/zinc/47/09/15/712470915.db2.gz ZIKRLWPUKSLLTE-JHZNUDOXSA-N 2 0 220.360 2.335 20 0 BEADRP CC1(C)CCC[C@@H](CN2CCCC[C@H]2C[NH3+])O1 ZINC000714332677 712482142 /nfs/dbraw/zinc/48/21/42/712482142.db2.gz XOONDTDWMVOKRK-STQMWFEESA-N 2 0 240.391 2.147 20 0 BEADRP C[C@@H]1C[N@H+](C[C@@H]2CCCC(C)(C)O2)CC[C@@H]1[NH3+] ZINC000714368280 712483761 /nfs/dbraw/zinc/48/37/61/712483761.db2.gz LXBMOZOZVGYZEX-AGIUHOORSA-N 2 0 240.391 2.003 20 0 BEADRP C[N@H+](CC[C@@H]1C[C@H]1C1CC1)CC(C)(C)[NH3+] ZINC000714833272 712501449 /nfs/dbraw/zinc/50/14/49/712501449.db2.gz TWXIRYQAAOZTCN-NEPJUHHUSA-N 2 0 210.365 2.092 20 0 BEADRP C[N@H+](CC[C@@H]1C[C@H]1C1CC1)CC(C)(C)C[NH3+] ZINC000714848789 712502020 /nfs/dbraw/zinc/50/20/20/712502020.db2.gz HVIMUVNXFHDQSR-OLZOCXBDSA-N 2 0 224.392 2.339 20 0 BEADRP COCC[C@@H](C)[NH2+]C1CCC(C)([NH+](C)C)CC1 ZINC000715511977 712524573 /nfs/dbraw/zinc/52/45/73/712524573.db2.gz ZDYAIKXZLSNIBP-IYXRBSQSSA-N 2 0 242.407 2.264 20 0 BEADRP Cc1cc(NC2CCC(C)([NH+](C)C)CC2)cc[nH+]1 ZINC000715584971 712527125 /nfs/dbraw/zinc/52/71/25/712527125.db2.gz JSBZQAQCUKBGJF-UHFFFAOYSA-N 2 0 247.386 2.487 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCCS1)[C@@H]1CCCC[NH2+]1 ZINC000715623812 712528199 /nfs/dbraw/zinc/52/81/99/712528199.db2.gz RGZDHSIRQFEBQA-XQQFMLRXSA-N 2 0 242.432 2.392 20 0 BEADRP C[NH+]1CCC(C[NH2+]CC[C@H]2CCCS2)CC1 ZINC000715784360 712532147 /nfs/dbraw/zinc/53/21/47/712532147.db2.gz VAMZVHLCKKPPJD-CYBMUJFWSA-N 2 0 242.432 2.204 20 0 BEADRP Cc1ccc([C@H](C)NC2CC[NH+](C)CC2)o1 ZINC000037249139 712558632 /nfs/dbraw/zinc/55/86/32/712558632.db2.gz NGWYFWQLQVRJOR-NSHDSACASA-N 2 0 222.332 2.333 20 0 BEADRP C[C@@H]1C[C@@H]1[C@H]1C[C@@H]1C[NH2+]CC1CC[NH+](C)CC1 ZINC000716580242 712564059 /nfs/dbraw/zinc/56/40/59/712564059.db2.gz GHQBPYHCQFGLOE-RZFFKMDDSA-N 2 0 236.403 2.210 20 0 BEADRP C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000716585103 712564401 /nfs/dbraw/zinc/56/44/01/712564401.db2.gz RHPSWZASMPNWOJ-PMXAPFLYSA-N 2 0 236.403 2.351 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@H]1[C@H]1C[C@H]1C)[C@@H]1CCC[NH2+]1 ZINC000716528237 712567161 /nfs/dbraw/zinc/56/71/61/712567161.db2.gz DIGXXSRXGWHEFE-HUXGKSLCSA-N 2 0 222.376 2.009 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@@H]1C[C@@H]1[C@H]1C[C@@H]1C ZINC000716544854 712567585 /nfs/dbraw/zinc/56/75/85/712567585.db2.gz IQPUOTDOBRJITF-NDKCEZKHSA-N 2 0 224.392 2.386 20 0 BEADRP C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C[NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2 ZINC000716668931 712568908 /nfs/dbraw/zinc/56/89/08/712568908.db2.gz SZVBGRLPSHOWDF-BUCHIQEDSA-N 2 0 234.387 2.138 20 0 BEADRP C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C[NH2+][C@H]1C[C@H]([NH3+])C12CCC2 ZINC000716668939 712568947 /nfs/dbraw/zinc/56/89/47/712568947.db2.gz SZVBGRLPSHOWDF-PRFQISJJSA-N 2 0 234.387 2.138 20 0 BEADRP FC1(F)CC[NH2+]C[C@@H]1C[NH2+]C1CCCCC1 ZINC000717020213 712605234 /nfs/dbraw/zinc/60/52/34/712605234.db2.gz MVTYCUWGAYRUHD-SNVBAGLBSA-N 2 0 232.318 2.154 20 0 BEADRP C(C[C@@H]1CC[C@@H]2C[C@@H]21)[NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2 ZINC000717136870 712634586 /nfs/dbraw/zinc/63/45/86/712634586.db2.gz NCPBAKOKPBLSOZ-ZGNUMKAHSA-N 2 0 246.398 2.009 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CC[C@H]1CC(C)(C)CO1 ZINC000717291426 712645421 /nfs/dbraw/zinc/64/54/21/712645421.db2.gz JVMNOSJANFULTC-OLZOCXBDSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@@H](CCC1CC1)[NH2+]C[C@H]1C[NH2+]CCC1(F)F ZINC000717348723 712650115 /nfs/dbraw/zinc/65/01/15/712650115.db2.gz JPOSAUOUTYKQNB-CMPLNLGQSA-N 2 0 246.345 2.400 20 0 BEADRP C1=CCCC([NH2+][C@H]2[C@@H]3[NH2+]C[C@@H]4C[C@H]2C[C@@H]43)CC1 ZINC000718098094 712742699 /nfs/dbraw/zinc/74/26/99/712742699.db2.gz LSIOTDZKJQJJMA-XSXPHNMFSA-N 2 0 232.371 2.071 20 0 BEADRP CC(F)(F)CCC[N@@H+]1CC[C@]2(CC[NH2+]C2)C1 ZINC000718569700 712774800 /nfs/dbraw/zinc/77/48/00/712774800.db2.gz GNWDQVKQDFBDLW-LBPRGKRZSA-N 2 0 232.318 2.107 20 0 BEADRP C[C@@H]1CC[N@H+](CCCCCCC[NH3+])CCO1 ZINC000719780204 712824432 /nfs/dbraw/zinc/82/44/32/712824432.db2.gz VNUGHENREBEJGQ-CYBMUJFWSA-N 2 0 228.380 2.006 20 0 BEADRP CCO[C@@H]1CCC[C@@H]([NH2+][C@H](C)CC[NH+](C)C)C1 ZINC000721169976 712894958 /nfs/dbraw/zinc/89/49/58/712894958.db2.gz WJTADHOUQCEKJG-MGPQQGTHSA-N 2 0 242.407 2.264 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH+]2CCC3(CC3)CC2)C1 ZINC001208605995 957095670 /nfs/dbraw/zinc/09/56/70/957095670.db2.gz CVIXUUSBXIUBTH-CYBMUJFWSA-N 2 0 222.376 2.204 20 0 BEADRP C[C@H]1CCC[N@H+](CCNc2cc[nH+]cc2)C1 ZINC000309803136 960128415 /nfs/dbraw/zinc/12/84/15/960128415.db2.gz ROBHYPTUJPTMTE-LBPRGKRZSA-N 2 0 219.332 2.225 20 0 BEADRP C[C@H]1C[C@@H]([N@H+](CC2CC2)C2CC2)CC[NH2+]1 ZINC000709465052 960608838 /nfs/dbraw/zinc/60/88/38/960608838.db2.gz NTKHILQHDOVNNL-GWCFXTLKSA-N 2 0 208.349 2.001 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CC[C@@H]2CCC[N@@H+]2C)C1 ZINC000710448753 962382754 /nfs/dbraw/zinc/38/27/54/962382754.db2.gz ZTNXAKBDJYQRAY-UPJWGTAASA-N 2 0 210.365 2.249 20 0 BEADRP C[C@H](CC[NH2+][C@@H]1CCC[C@@H](C)C1)[NH+](C)C ZINC000697878753 964603366 /nfs/dbraw/zinc/60/33/66/964603366.db2.gz LMQCEVGFNWGBSM-JHJVBQTASA-N 2 0 212.381 2.495 20 0 BEADRP Cc1ccc(C[NH2+]CC[C@H](C)[NH+](C)C)cc1 ZINC000697886875 964633553 /nfs/dbraw/zinc/63/35/53/964633553.db2.gz IWUGWKZIDJDNJG-ZDUSSCGKSA-N 2 0 220.360 2.425 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1cnoc1 ZINC000037676245 1165801809 /nfs/dbraw/zinc/80/18/09/1165801809.db2.gz NOZQPYXIMWYLSU-LBPRGKRZSA-N 2 0 239.363 2.275 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@@H]([NH2+]CC3(C)CCC3)[C@@H]2C1 ZINC001204089353 966889308 /nfs/dbraw/zinc/88/93/08/966889308.db2.gz MGVNUHXCBGEYHC-YNEHKIRRSA-N 2 0 222.376 2.106 20 0 BEADRP CC1=C[C@H](C)[C@@H](C[N@@H+]2CC[C@@](C)([NH3+])C2)CC1 ZINC001204762771 967152200 /nfs/dbraw/zinc/15/22/00/967152200.db2.gz DFNNKZOISLXKRU-BFHYXJOUSA-N 2 0 222.376 2.402 20 0 BEADRP C[N@@H+]1CC[C@H](C[NH2+]C2CCC(C)(C)CC2)C1 ZINC000070623086 1165938899 /nfs/dbraw/zinc/93/88/99/1165938899.db2.gz BCYVNKREUTVDAG-GFCCVEGCSA-N 2 0 224.392 2.497 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@H]2CCC23CCCC3)C1 ZINC000693771058 968296756 /nfs/dbraw/zinc/29/67/56/968296756.db2.gz SNXOQXRZMWYUEF-TUAOUCFPSA-N 2 0 208.349 2.036 20 0 BEADRP CCCO[C@@H]1CC[N@H+](CC(C)(C)C[NH+](C)C)C1 ZINC001207284152 968719084 /nfs/dbraw/zinc/71/90/84/968719084.db2.gz KJPLWPKZLNPCOL-CYBMUJFWSA-N 2 0 242.407 2.075 20 0 BEADRP C[NH+]1CCC(C[NH+]2CC3(C2)CC(F)(F)C3)CC1 ZINC001207391277 968748023 /nfs/dbraw/zinc/74/80/23/968748023.db2.gz AUFCEUZAKXFCBB-UHFFFAOYSA-N 2 0 244.329 2.059 20 0 BEADRP CCC[C@@H](C)[N@H+](C)C[C@@H](C[NH3+])C(C)C ZINC000083607068 1166113513 /nfs/dbraw/zinc/11/35/13/1166113513.db2.gz RLLBTDJMDAJQOX-VXGBXAGGSA-N 2 0 200.370 2.338 20 0 BEADRP COCC[N@H+](CCC1CC[NH+](C)CC1)C(C)C ZINC001207485599 968797522 /nfs/dbraw/zinc/79/75/22/968797522.db2.gz XXKRMLPDAQOZSF-UHFFFAOYSA-N 2 0 242.407 2.075 20 0 BEADRP Cc1cc(C)nc(C[N@H+]2CC[C@@H](C)[C@@H](C[NH3+])C2)c1 ZINC000723877361 1166147122 /nfs/dbraw/zinc/14/71/22/1166147122.db2.gz TXKJBHIIYJTLGV-OCCSQVGLSA-N 2 0 247.386 2.115 20 0 BEADRP CC[N@H+](CC1(C)CC[NH+](C)CC1)C(C)C ZINC001208105000 968999763 /nfs/dbraw/zinc/99/97/63/968999763.db2.gz QJOZPJIJUDLINS-UHFFFAOYSA-N 2 0 212.381 2.449 20 0 BEADRP CSCC[C@H](C)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000228873558 1166223708 /nfs/dbraw/zinc/22/37/08/1166223708.db2.gz MUPGEYUWBCQWLZ-NWDGAFQWSA-N 2 0 230.421 2.059 20 0 BEADRP CCCC(CCC)[NH2+]C[C@@H](O)C[NH+](CC)CC ZINC001253206501 969110331 /nfs/dbraw/zinc/11/03/31/969110331.db2.gz OBXIKOUDZYLEDA-CQSZACIVSA-N 2 0 244.423 2.248 20 0 BEADRP C([C@@H]1CCC[NH2+]1)[N@@H+]1CC[C@H]2CCCC[C@@H]2C1 ZINC000227648611 1166239187 /nfs/dbraw/zinc/23/91/87/1166239187.db2.gz DBZSIGILGQEISC-MCIONIFRSA-N 2 0 222.376 2.251 20 0 BEADRP CCC[N@H+](CC)CC1CC[NH+](CC)CC1 ZINC001208593656 969149958 /nfs/dbraw/zinc/14/99/58/969149958.db2.gz IFQSVZRBLGYCNU-UHFFFAOYSA-N 2 0 212.381 2.450 20 0 BEADRP CC[N@H+](CC(C)(C)C[NH+](C)C)C1CCOCC1 ZINC001207285290 1166273578 /nfs/dbraw/zinc/27/35/78/1166273578.db2.gz DXSWVUJYZLXNRH-UHFFFAOYSA-N 2 0 242.407 2.075 20 0 BEADRP CC[C@@H](C)C[C@H](CC)[N@H+](C)CCC[NH3+] ZINC000227744766 1166308228 /nfs/dbraw/zinc/30/82/28/1166308228.db2.gz NYICZAMSKZTNLI-NEPJUHHUSA-N 2 0 200.370 2.482 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+]Cc2cccs2)C12CCC2 ZINC000405207794 1166403689 /nfs/dbraw/zinc/40/36/89/1166403689.db2.gz BDGTZVJIFLSLJQ-WDEREUQCSA-N 2 0 222.357 2.108 20 0 BEADRP CC[N@@H+]1CCC[C@H](C[NH2+][C@H]2CC[C@@H](C)C2)C1 ZINC000253182777 1166406278 /nfs/dbraw/zinc/40/62/78/1166406278.db2.gz GDDKHENKRRFJEC-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H]1CCCC[N@@H+]1[C@@H]1CC[NH2+][C@H](C)C1 ZINC000252935577 1166427726 /nfs/dbraw/zinc/42/77/26/1166427726.db2.gz FMAHAOQRSOBZIB-JHJVBQTASA-N 2 0 210.365 2.391 20 0 BEADRP C[C@]1(C[N@@H+]2CC[C@@H]3CCCC[C@H]3C2)CC[NH2+]C1 ZINC000250793552 1166431159 /nfs/dbraw/zinc/43/11/59/1166431159.db2.gz KRKXMBZXTGFWRU-KKUMJFAQSA-N 2 0 236.403 2.498 20 0 BEADRP c1ccc(CC[N@@H+]2CC[C@@H]3[NH2+]CCC[C@H]3C2)cc1 ZINC000250799595 1166431210 /nfs/dbraw/zinc/43/12/10/1166431210.db2.gz DDDAPRBYVQIKCF-HOTGVXAUSA-N 2 0 244.382 2.303 20 0 BEADRP C[C@@H]1CC[N@@H+]([C@@H]2CC[NH2+][C@H](C)C2)[C@H](C)C1 ZINC000252961212 1166461262 /nfs/dbraw/zinc/46/12/62/1166461262.db2.gz VELJTGIBRWVDFS-FDYHWXHSSA-N 2 0 210.365 2.247 20 0 BEADRP Cc1cc(C[N@@H+]2CC[C@@H]([NH3+])[C@H](C)C2)cs1 ZINC000309054189 1166471787 /nfs/dbraw/zinc/47/17/87/1166471787.db2.gz RSWHDBQUYQVLCT-BXKDBHETSA-N 2 0 224.373 2.226 20 0 BEADRP CCC1([NH2+][C@@H]2CCC[N@H+](C)CC2)CCOCC1 ZINC001254513062 969680689 /nfs/dbraw/zinc/68/06/89/969680689.db2.gz WKHOWMVETVZNPI-CYBMUJFWSA-N 2 0 240.391 2.020 20 0 BEADRP C(C1CCCC1)[N@@H+]1CC[C@@H]2[NH2+]CCC[C@H]2C1 ZINC000251020627 1166485582 /nfs/dbraw/zinc/48/55/82/1166485582.db2.gz FCEUXDMDVFQAQD-KBPBESRZSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@H]1C[N@@H+](C2CCC(F)(F)CC2)C[C@H]1C[NH3+] ZINC000708832000 1166517123 /nfs/dbraw/zinc/51/71/23/1166517123.db2.gz WHSBSLKBOLRTGO-VHSXEESVSA-N 2 0 232.318 2.091 20 0 BEADRP CC(C)CCC[C@H](C)[N@@H+]1C[C@@H](C)[C@H]([NH3+])C1 ZINC000309374814 1166526554 /nfs/dbraw/zinc/52/65/54/1166526554.db2.gz CLHOWJJINWMKNQ-FRRDWIJNSA-N 2 0 212.381 2.480 20 0 BEADRP [NH3+]CC1(C[N@H+](Cc2ccccc2)C2CC2)CC1 ZINC000307030618 1166536981 /nfs/dbraw/zinc/53/69/81/1166536981.db2.gz NYKITKYUYGDFTM-UHFFFAOYSA-N 2 0 230.355 2.390 20 0 BEADRP CC(C)[N@H+]([C@@H]1CCSC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001255274233 970025540 /nfs/dbraw/zinc/02/55/40/970025540.db2.gz ALKXFLSRCZGYTG-JHJVBQTASA-N 2 0 242.432 2.472 20 0 BEADRP CC[C@H](C)CC[NH2+][C@H]1CCCN(CC)C1 ZINC000394448054 1166589197 /nfs/dbraw/zinc/58/91/97/1166589197.db2.gz JYDSHHZQANKWSV-STQMWFEESA-N 2 0 212.381 2.497 20 0 BEADRP CC[C@H](C)CC[NH2+][C@@H]1CCCN(CC)C1 ZINC000394448051 1166589343 /nfs/dbraw/zinc/58/93/43/1166589343.db2.gz JYDSHHZQANKWSV-QWHCGFSZSA-N 2 0 212.381 2.497 20 0 BEADRP CC(C)CCC[C@H](C)[NH2+]CCC[N@H+](C)CCO ZINC001170073431 970166794 /nfs/dbraw/zinc/16/67/94/970166794.db2.gz KKVNHILQSBTTGP-AWEZNQCLSA-N 2 0 244.423 2.105 20 0 BEADRP CC(C)([NH3+])C(C)(C)[NH2+][C@H]1CCOC(C)(C)C1 ZINC001255533251 970296567 /nfs/dbraw/zinc/29/65/67/970296567.db2.gz YHTNUTJDIZQCGE-JTQLQIEISA-N 2 0 228.380 2.050 20 0 BEADRP COC[C@H](C)[NH2+]C[C@@H](C)CC(C)(C)CC[NH3+] ZINC001255564054 970354960 /nfs/dbraw/zinc/35/49/60/970354960.db2.gz UFQWTLOEXKIQLK-RYUDHWBXSA-N 2 0 230.396 2.012 20 0 BEADRP CCC[C@H](C)[NH2+]Cc1ccccc1C[NH3+] ZINC000233337751 1166777074 /nfs/dbraw/zinc/77/70/74/1166777074.db2.gz BIANFVZQFNIUSL-NSHDSACASA-N 2 0 206.333 2.424 20 0 BEADRP C[C@H]1CC[C@@H]1[NH2+]CCC1CC[NH+](C)CC1 ZINC000379894869 1166809888 /nfs/dbraw/zinc/80/98/88/1166809888.db2.gz BQFUNVSECOBISQ-AAEUAGOBSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+]CCC1CC[NH+](C)CC1 ZINC000379894872 1166809151 /nfs/dbraw/zinc/80/91/51/1166809151.db2.gz BQFUNVSECOBISQ-YPMHNXCESA-N 2 0 210.365 2.106 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]C1CC(F)(F)C1 ZINC001255941894 970579353 /nfs/dbraw/zinc/57/93/53/970579353.db2.gz ZBZUDOIUKXSIQI-JTQLQIEISA-N 2 0 234.334 2.494 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]CCCC(C)(C)O ZINC001255948163 970583360 /nfs/dbraw/zinc/58/33/60/970583360.db2.gz GKHDVDIIFZPEBB-CYBMUJFWSA-N 2 0 244.423 2.248 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+][C@@H]1CCO[C@H](C)C1 ZINC001255954368 970590050 /nfs/dbraw/zinc/59/00/50/970590050.db2.gz VOZQLFCSAXSRIX-BFHYXJOUSA-N 2 0 242.407 2.264 20 0 BEADRP CC(C)[C@@H]1CCC[C@H]([NH2+][C@@H]2C[NH2+]C[C@H]2C)C1 ZINC000925784863 1166833579 /nfs/dbraw/zinc/83/35/79/1166833579.db2.gz OIDHSXDPFVAVLJ-YIYPIFLZSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@@H](C[NH2+]CCC(C)(C)[NH3+])C(C)(C)C ZINC000162999703 1166835202 /nfs/dbraw/zinc/83/52/02/1166835202.db2.gz JAVCLZJMCIVVNY-JTQLQIEISA-N 2 0 200.370 2.386 20 0 BEADRP [NH2+]=CNc1ccc(F)c(C[NH+]2CCCC2)c1 ZINC001167871657 1166878437 /nfs/dbraw/zinc/87/84/37/1166878437.db2.gz UOWVHOBJSFKOHF-UHFFFAOYSA-N 2 0 221.279 2.440 20 0 BEADRP C[C@@]1([NH3+])CC[N@@H+](C2CCC(C)(C)CC2)C1 ZINC000405857182 1166888517 /nfs/dbraw/zinc/88/85/17/1166888517.db2.gz OOIOJLWFIOERNB-CYBMUJFWSA-N 2 0 210.365 2.378 20 0 BEADRP [NH3+]CC1CC[NH+](C[C@H]2CC=CCC2)CC1 ZINC000238548405 1166907591 /nfs/dbraw/zinc/90/75/91/1166907591.db2.gz URPJCIPMCPCHSU-ZDUSSCGKSA-N 2 0 208.349 2.013 20 0 BEADRP CC(C)SCC[NH2+]C[C@@H]1CC[N@@H+](C(C)C)C1 ZINC000304268740 1166909437 /nfs/dbraw/zinc/90/94/37/1166909437.db2.gz KGNNAMYTPFORRP-ZDUSSCGKSA-N 2 0 244.448 2.448 20 0 BEADRP CC(C)SCC[NH2+]C[C@H]1CC[N@@H+](C(C)C)C1 ZINC000304268739 1166909536 /nfs/dbraw/zinc/90/95/36/1166909536.db2.gz KGNNAMYTPFORRP-CYBMUJFWSA-N 2 0 244.448 2.448 20 0 BEADRP C[C@H]1C[C@H]([N@@H+]2CCC3(CCCC3)C2)CC[NH2+]1 ZINC000304318483 1166911076 /nfs/dbraw/zinc/91/10/76/1166911076.db2.gz BWBHUZCCDWLWFP-QWHCGFSZSA-N 2 0 222.376 2.393 20 0 BEADRP C[C@@H]1CCCCC[N@@H+]1C1CCN(C)CC1 ZINC001256207926 970712598 /nfs/dbraw/zinc/71/25/98/970712598.db2.gz RVNGLNWCQFSYFQ-GFCCVEGCSA-N 2 0 210.365 2.345 20 0 BEADRP CN1CCC([NH+]2C3CCCC2CCC3)CC1 ZINC001256211234 970720188 /nfs/dbraw/zinc/72/01/88/970720188.db2.gz SJNIKMGRUFXSSM-UHFFFAOYSA-N 2 0 222.376 2.488 20 0 BEADRP CC[NH+](CC)C1CCC([NH2+]C2CSC2)CC1 ZINC001173103659 975021507 /nfs/dbraw/zinc/02/15/07/975021507.db2.gz NQLNQCZFCWPNHQ-UHFFFAOYSA-N 2 0 242.432 2.344 20 0 BEADRP CC[NH+](CC)C1CCC([NH2+]C[C@H](C)OC)CC1 ZINC001173104233 975023452 /nfs/dbraw/zinc/02/34/52/975023452.db2.gz LOAXQJVVAQXDMZ-HSBZDZAISA-N 2 0 242.407 2.264 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@@H+]1CC(C)(C)[C@H]2CCC[C@H]21 ZINC000383276544 1167120503 /nfs/dbraw/zinc/12/05/03/1167120503.db2.gz WRUKNKOKWOYVFQ-ZOBORPQBSA-N 2 0 236.403 2.352 20 0 BEADRP CCC[N@H+](CC(C)C)[C@H]1CC[NH2+][C@@H](C)C1 ZINC000308804538 1167201862 /nfs/dbraw/zinc/20/18/62/1167201862.db2.gz AGLFTHMQEWJUPQ-STQMWFEESA-N 2 0 212.381 2.495 20 0 BEADRP CCCC(CCC)[N@@H+]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000309405894 1167301086 /nfs/dbraw/zinc/30/10/86/1167301086.db2.gz JPXJJGGHVUABTL-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H]2C[C@H]2C2CC2)CC1 ZINC000309589124 1167328946 /nfs/dbraw/zinc/32/89/46/1167328946.db2.gz UCWMHELTYIUDBT-KBPBESRZSA-N 2 0 222.376 2.249 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH2+]CC2CC(F)(F)C2)CC1 ZINC000309660735 1167335038 /nfs/dbraw/zinc/33/50/38/1167335038.db2.gz RETIKMYNHOHSEB-LLVKDONJSA-N 2 0 232.318 2.106 20 0 BEADRP C[NH2+]CCC[N@H+](C)CCC1=CCCCC1 ZINC000385107384 1167384741 /nfs/dbraw/zinc/38/47/41/1167384741.db2.gz CFCYDGNGMXJQAE-UHFFFAOYSA-N 2 0 210.365 2.418 20 0 BEADRP CC[C@@H]1CCCC[N@@H+]1C[C@H]1CC[C@@H]([NH3+])C1 ZINC000251636215 1167451728 /nfs/dbraw/zinc/45/17/28/1167451728.db2.gz FRXXXTIBVSWYTK-YNEHKIRRSA-N 2 0 210.365 2.378 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@@H]2CC[N@H+](C)C2)C[C@H]1C ZINC000251799929 1167458799 /nfs/dbraw/zinc/45/87/99/1167458799.db2.gz LXQXEXNCOGRKQX-MQYQWHSLSA-N 2 0 224.392 2.352 20 0 BEADRP C[N@H+](Cc1ccsc1)CC1(C[NH3+])CCC1 ZINC000168523257 1167465098 /nfs/dbraw/zinc/46/50/98/1167465098.db2.gz NIOBMZIAVWYADU-UHFFFAOYSA-N 2 0 224.373 2.309 20 0 BEADRP CC[C@H](C)[C@H](C[NH2+]C[C@]1(C)CCC[NH2+]C1)OC ZINC000381381337 1167547585 /nfs/dbraw/zinc/54/75/85/1167547585.db2.gz LNRPYBLMNRXGIA-MELADBBJSA-N 2 0 242.407 2.027 20 0 BEADRP C[NH+]1CCC(C[NH2+]CCC2(C)CC2)CC1 ZINC000698084197 1167610134 /nfs/dbraw/zinc/61/01/34/1167610134.db2.gz ACABTOPAWMBPOK-UHFFFAOYSA-N 2 0 210.365 2.108 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@@H+](C2C[C@@H](C)C[C@H](C)C2)C1 ZINC000252125808 1167704864 /nfs/dbraw/zinc/70/48/64/1167704864.db2.gz LJFCAASBHKVCLA-AVGNSLFASA-N 2 0 224.392 2.352 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@@H+](C2C[C@H](C)C[C@@H](C)C2)C1 ZINC000252125814 1167705790 /nfs/dbraw/zinc/70/57/90/1167705790.db2.gz LJFCAASBHKVCLA-UPJWGTAASA-N 2 0 224.392 2.352 20 0 BEADRP CC(C)CCC[N@@H+]1CC[C@@]2(C1)C[NH2+]CC[C@@H]2F ZINC001235410497 979040545 /nfs/dbraw/zinc/04/05/45/979040545.db2.gz YGCVCCVTOMHDNB-KBPBESRZSA-N 2 0 242.382 2.446 20 0 BEADRP CCC1CCC([N@H+]2C[C@H]3C[NH2+]CC[C@@H]3C2)CC1 ZINC000310528332 1168238987 /nfs/dbraw/zinc/23/89/87/1168238987.db2.gz NMNBTCYWFBRTIS-PIOWNMBXSA-N 2 0 236.403 2.497 20 0 BEADRP CCC1CCC([N@@H+]2C[C@H]3CC[NH2+]C[C@H]3C2)CC1 ZINC000310528323 1168240484 /nfs/dbraw/zinc/24/04/84/1168240484.db2.gz NMNBTCYWFBRTIS-FUUBYGMNSA-N 2 0 236.403 2.497 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH2+]CCc2ccc(O)cc2)CC1 ZINC000086818880 1168313001 /nfs/dbraw/zinc/31/30/01/1168313001.db2.gz IONBRFFCXOOGRV-CQSZACIVSA-N 2 0 248.370 2.009 20 0 BEADRP CC[C@H](C[C@@H](C)CC)[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC000085282119 1168324809 /nfs/dbraw/zinc/32/48/09/1168324809.db2.gz JTUSFFHWBKBKNJ-IGQOVBAYSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@H]1C[C@H]([NH+]2Cc3ccccc3C2)CC[NH2+]1 ZINC000229546185 1168354211 /nfs/dbraw/zinc/35/42/11/1168354211.db2.gz PDQYUKZCRLKZPH-SMDDNHRTSA-N 2 0 216.328 2.143 20 0 BEADRP CCCCC[C@@H](C)[NH2+]C[C@@H]1CC[N@H+](C)C1 ZINC000037484754 1168418643 /nfs/dbraw/zinc/41/86/43/1168418643.db2.gz LJHQVZKYEOBUPH-OLZOCXBDSA-N 2 0 212.381 2.497 20 0 BEADRP CCC(CC)[N@H+](CC)C[C@@H]1CCC[NH2+]C1 ZINC000232893572 1168462935 /nfs/dbraw/zinc/46/29/35/1168462935.db2.gz ZLSKMBZYXOXMDB-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP CC(C)CC[N@@H+]1CCC[C@]12CCC[NH2+]C2 ZINC000257685171 1168588280 /nfs/dbraw/zinc/58/82/80/1168588280.db2.gz LZYRPRQFRTXESR-ZDUSSCGKSA-N 2 0 210.365 2.251 20 0 BEADRP C[N@@H+]1CC[C@@H]2C[NH+]([C@@H]3C[C@@H]4[C@H](C3)C4(C)C)C[C@@H]2C1 ZINC001170752858 1168591453 /nfs/dbraw/zinc/59/14/53/1168591453.db2.gz KXRQJFKTFORZBU-KHMAMNHCSA-N 2 0 248.414 2.305 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@@H]1Cc2cccc(Cl)c2C1 ZINC001246316259 1168633520 /nfs/dbraw/zinc/63/35/20/1168633520.db2.gz YRMROBHFATUPOR-GHMZBOCLSA-N 2 0 238.762 2.134 20 0 BEADRP Cc1cccc2c1CC[C@H]([NH2+][C@H]1C[C@@](C)([NH3+])C1)C2 ZINC001246457098 1168638449 /nfs/dbraw/zinc/63/84/49/1168638449.db2.gz CGKYHNBTNKILDK-OFQRWUPVSA-N 2 0 244.382 2.322 20 0 BEADRP Cc1cc(N(C)C)[nH+]cc1NC[C@H]1CCCC[NH2+]1 ZINC001171335579 1168664525 /nfs/dbraw/zinc/66/45/25/1168664525.db2.gz YRLJEHMTQVUCGT-GFCCVEGCSA-N 2 0 248.374 2.010 20 0 BEADRP CO[C@@H]1CC[C@H]([NH2+][C@@H]2C[C@@H]([NH3+])CC(C)(C)C2)C1 ZINC001350955160 982134499 /nfs/dbraw/zinc/13/44/99/982134499.db2.gz GSNVDRTZKXVUMO-YVECIDJPSA-N 2 0 240.391 2.050 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH2+]C2CC(C)(C)C2)CC1 ZINC000258121872 1168934631 /nfs/dbraw/zinc/93/46/31/1168934631.db2.gz POTMXZPSZWADBU-NSHDSACASA-N 2 0 210.365 2.249 20 0 BEADRP CC[NH2+][C@H](C)c1cccc(C[NH+](C)C)c1 ZINC001354204984 983194320 /nfs/dbraw/zinc/19/43/20/983194320.db2.gz MPTLIOJYMUHGMO-LLVKDONJSA-N 2 0 206.333 2.419 20 0 BEADRP CCC[C@H](C)C[NH+]1CC2(C1)CC[NH+](C)CC2 ZINC001201552216 983304624 /nfs/dbraw/zinc/30/46/24/983304624.db2.gz BRBWBRNFDSIJLJ-ZDUSSCGKSA-N 2 0 224.392 2.450 20 0 BEADRP CCCCC[N@@H+]1C[C@H]2CCCN(C)[C@H]2C1 ZINC001201737329 983442010 /nfs/dbraw/zinc/44/20/10/983442010.db2.gz IQEHDCHAHXTDRX-OLZOCXBDSA-N 2 0 210.365 2.203 20 0 BEADRP C[C@@H](Cc1ccco1)[NH2+]CC1([NH3+])CCCC1 ZINC000042594171 1169086643 /nfs/dbraw/zinc/08/66/43/1169086643.db2.gz LTYOXJFFDQYUEH-NSHDSACASA-N 2 0 222.332 2.072 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@@H]1CC[C@@H]2CCC[C@H]12 ZINC001575953437 984136998 /nfs/dbraw/zinc/13/69/98/984136998.db2.gz ZUIOYFFXOKGGSV-ZDEQEGDKSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H](C[C@@H]1CCC[NH2+]1)[NH2+][C@@H]1C[C@H]1[C@@H]1C[C@H]1C ZINC001575941030 984139231 /nfs/dbraw/zinc/13/92/31/984139231.db2.gz HKNNBYSPOVQFKS-IKKURHKOSA-N 2 0 222.376 2.151 20 0 BEADRP C[C@H]1C[C@H](C[N@H+]2C[C@@H]3CC=CC[C@@H]3C2)CC[NH2+]1 ZINC000394902636 1169258191 /nfs/dbraw/zinc/25/81/91/1169258191.db2.gz NRXAQMBWCAOXTI-LJISPDSOSA-N 2 0 234.387 2.273 20 0 BEADRP CCOCC[C@@H](C)[NH2+]C1CCC([NH+](C)C)CC1 ZINC001172412691 974678827 /nfs/dbraw/zinc/67/88/27/974678827.db2.gz BMDHQKSAFQCBGY-IYXRBSQSSA-N 2 0 242.407 2.264 20 0 BEADRP C[C@H]([NH3+])C[N@@H+]1CC[C@H](C)[C@H]1c1ccccc1 ZINC001331707935 974798761 /nfs/dbraw/zinc/79/87/61/974798761.db2.gz XVOMXVDFVVOXKI-OBJOEFQTSA-N 2 0 218.344 2.417 20 0 BEADRP CC(C)COCC[C@@H](C)[NH2+]CCCC[NH+](C)C ZINC001172460558 974825922 /nfs/dbraw/zinc/82/59/22/974825922.db2.gz PGYNZNDBZXWEHQ-CQSZACIVSA-N 2 0 244.423 2.369 20 0 BEADRP C[C@H]([NH2+]CCCC[NH3+])c1cccnc1Cl ZINC001331833849 974829339 /nfs/dbraw/zinc/82/93/39/974829339.db2.gz IWCJDZVXDHXZQG-VIFPVBQESA-N 2 0 227.739 2.125 20 0 BEADRP CC1(C)C[C@@H]([N@@H+]2CCC[C@](C)(C[NH3+])CC2)CO1 ZINC001246572988 972864947 /nfs/dbraw/zinc/86/49/47/972864947.db2.gz DSOHJILIZWFVCE-OCCSQVGLSA-N 2 0 240.391 2.005 20 0 BEADRP CC1(C[NH3+])C[NH+]([C@H]2CCCC(C)(C)C2)C1 ZINC001246602171 973022901 /nfs/dbraw/zinc/02/29/01/973022901.db2.gz VZOFULYFSICERK-NSHDSACASA-N 2 0 210.365 2.236 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]Cc1ccc(C)s1 ZINC001328677709 973258931 /nfs/dbraw/zinc/25/89/31/973258931.db2.gz STXMSOZUOHITEE-SECBINFHSA-N 2 0 212.362 2.144 20 0 BEADRP Cc1cc(Nc2ccc3c(c2)CC[NH2+]C3)cc[nH+]1 ZINC001159106932 1169435557 /nfs/dbraw/zinc/43/55/57/1169435557.db2.gz KHOFYHNZBCBBMD-UHFFFAOYSA-N 2 0 239.322 2.201 20 0 BEADRP Cc1c[nH+]ccc1Nc1ccc2c(c1)CC[NH2+]C2 ZINC001159107922 1169435863 /nfs/dbraw/zinc/43/58/63/1169435863.db2.gz YSKVGTGQXIOILE-UHFFFAOYSA-N 2 0 239.322 2.201 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H](C)Cc1ccsc1 ZINC001329023477 973434835 /nfs/dbraw/zinc/43/48/35/973434835.db2.gz IMFQIFJRIYCTRR-MNOVXSKESA-N 2 0 226.389 2.267 20 0 BEADRP C[C@@H]([NH2+]CCCC[NH3+])c1ccc(Cl)nc1 ZINC001329025144 973438101 /nfs/dbraw/zinc/43/81/01/973438101.db2.gz ZFQRGCCRUKLKME-SECBINFHSA-N 2 0 227.739 2.125 20 0 BEADRP CC(C)(C)[NH+]1CCC([NH2+][C@H]2C[C@@H](F)C2)CC1 ZINC001256562105 970861546 /nfs/dbraw/zinc/86/15/46/970861546.db2.gz WNVQEMGMICNCHP-KLPPZKSPSA-N 2 0 228.355 2.339 20 0 BEADRP CC[C@@H]1CC[N@@H+](C2C[C@H]3CC[C@@H](C2)[NH+]3C)C1 ZINC001256631146 970895002 /nfs/dbraw/zinc/89/50/02/970895002.db2.gz PTBWHWPANJIJFU-HABKJSAYSA-N 2 0 222.376 2.344 20 0 BEADRP [NH3+]C[C@@H]1C[N@H+](CC2CCCCC2)CCC1(F)F ZINC000403216030 970896054 /nfs/dbraw/zinc/89/60/54/970896054.db2.gz GOKPBAVOFQTDOU-GFCCVEGCSA-N 2 0 246.345 2.483 20 0 BEADRP CCCC[NH2+]C1CCC([NH+]2CCOCC2)CC1 ZINC001256677938 970916300 /nfs/dbraw/zinc/91/63/00/970916300.db2.gz QXTJQXAGOMXCCF-UHFFFAOYSA-N 2 0 240.391 2.020 20 0 BEADRP C([NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32)[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000403392299 970928703 /nfs/dbraw/zinc/92/87/03/970928703.db2.gz QPXARSHGXNAMCL-QMCPMGKZSA-N 2 0 246.398 2.009 20 0 BEADRP C[C@@H](Cc1ccncc1)[NH2+]C(C)(C)C(C)(C)[NH3+] ZINC001256728647 970953146 /nfs/dbraw/zinc/95/31/46/970953146.db2.gz JAYWQEZVCQJTQY-NSHDSACASA-N 2 0 235.375 2.118 20 0 BEADRP [NH3+]CCCC[NH2+][C@H]1CCO[C@H](c2ccccc2)C1 ZINC001256787313 970987161 /nfs/dbraw/zinc/98/71/61/970987161.db2.gz QLQJVBHZSBFZOQ-GJZGRUSLSA-N 2 0 248.370 2.235 20 0 BEADRP [NH3+]CCCC[NH2+][C@H]1CCO[C@@H](c2ccccc2)C1 ZINC001256787316 970988215 /nfs/dbraw/zinc/98/82/15/970988215.db2.gz QLQJVBHZSBFZOQ-LSDHHAIUSA-N 2 0 248.370 2.235 20 0 BEADRP c1cc(N2CCC([NH2+]C34CC(C3)C4)CC2)cc[nH+]1 ZINC001256849197 970995728 /nfs/dbraw/zinc/99/57/28/970995728.db2.gz RJCJTIDDQZOQNP-UHFFFAOYSA-N 2 0 243.354 2.193 20 0 BEADRP C[N@H+](CC1CC1)C1CCN(c2cc[nH+]cc2)CC1 ZINC001256855579 970996065 /nfs/dbraw/zinc/99/60/65/970996065.db2.gz PPZIXFCILRXXNY-UHFFFAOYSA-N 2 0 245.370 2.392 20 0 BEADRP c1cc([C@@H]2CC[NH2+]C2)ccc1C1=C[NH2+]CCC1 ZINC001243951228 971037382 /nfs/dbraw/zinc/03/73/82/971037382.db2.gz DHXMGZBFKZWRAQ-OAHLLOKOSA-N 2 0 228.339 2.488 20 0 BEADRP CNc1cc(Nc2cc[nH+]c(N(C)C)c2)cc[nH+]1 ZINC001216334007 971047543 /nfs/dbraw/zinc/04/75/43/971047543.db2.gz LONJEZOGXSPMTE-UHFFFAOYSA-N 2 0 243.314 2.328 20 0 BEADRP C[C@H]1CC([NH2+]CCCCC[NH+](C)C)C[C@H](C)O1 ZINC001257073732 971090490 /nfs/dbraw/zinc/09/04/90/971090490.db2.gz UEJVIEPPWRVNDS-STQMWFEESA-N 2 0 242.407 2.264 20 0 BEADRP CCN(c1[nH+]ccc2[nH]ccc21)[C@@H]1CCC[NH2+]C1 ZINC001158199566 971097848 /nfs/dbraw/zinc/09/78/48/971097848.db2.gz BGJOUDFKISVJDF-LLVKDONJSA-N 2 0 244.342 2.141 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)[C@@H]1C[C@@H](C)O[C@@H](C)C1 ZINC001257101292 971116305 /nfs/dbraw/zinc/11/63/05/971116305.db2.gz GISKVYMLXJQGGZ-BTTYYORXSA-N 2 0 242.407 2.216 20 0 BEADRP C[C@@H]1CCC[N@H+](C/C=C/Cl)[C@H]1CC[NH3+] ZINC000404368520 971158699 /nfs/dbraw/zinc/15/86/99/971158699.db2.gz QEZLGAGLQVDZBW-MFFLNWJUSA-N 2 0 216.756 2.188 20 0 BEADRP C[N@H+](CCCCCC[NH3+])Cc1ccns1 ZINC000404460608 971165265 /nfs/dbraw/zinc/16/52/65/971165265.db2.gz IDWXCVHLQRXIPP-UHFFFAOYSA-N 2 0 227.377 2.094 20 0 BEADRP CCC[C@@H](CC)[N@@H+]1C[C@H]2C[C@@]2(C[NH+](C)C)C1 ZINC001257267727 971172173 /nfs/dbraw/zinc/17/21/73/971172173.db2.gz YWGPRHSGUCWHGO-MGPQQGTHSA-N 2 0 224.392 2.449 20 0 BEADRP CCc1cc(NCC[C@H]2CCC[NH2+]2)cc[nH+]1 ZINC000307796999 971177377 /nfs/dbraw/zinc/17/73/77/971177377.db2.gz YCRJHBVPVSYGET-GFCCVEGCSA-N 2 0 219.332 2.198 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+]C2CCCCC2)C12CCC2 ZINC000404751813 971181537 /nfs/dbraw/zinc/18/15/37/971181537.db2.gz JFFMDPVMCWVFQR-NWDGAFQWSA-N 2 0 208.349 2.179 20 0 BEADRP CCC[C@@H](C)[NH2+]CCCCC[NH+](C)C ZINC001257306237 971196666 /nfs/dbraw/zinc/19/66/66/971196666.db2.gz OGUMUSVTKVBAIL-GFCCVEGCSA-N 2 0 200.370 2.497 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]CCc2ccsc2)C12CCC2 ZINC000405227246 971212348 /nfs/dbraw/zinc/21/23/48/971212348.db2.gz DRRDIZXAZFHNGX-VXGBXAGGSA-N 2 0 236.384 2.150 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]CCc2ccccc2F)C12CCC2 ZINC000405238366 971213433 /nfs/dbraw/zinc/21/34/33/971213433.db2.gz VBGUICQLQUXOBL-KBPBESRZSA-N 2 0 248.345 2.228 20 0 BEADRP CCC[C@@H](C)[N@@H+]1C[C@H]2CC[NH+](C)C[C@H]2C1 ZINC001257321127 971220966 /nfs/dbraw/zinc/22/09/66/971220966.db2.gz YRIZVRAFIVSCAM-UPJWGTAASA-N 2 0 210.365 2.059 20 0 BEADRP CCSCC[C@H](C)[NH2+][C@H]1C[C@H]([NH3+])C12CCC2 ZINC000405278869 971226422 /nfs/dbraw/zinc/22/64/22/971226422.db2.gz YJFKYHGNVXJJJH-SRVKXCTJSA-N 2 0 242.432 2.378 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]CC2=CCCCC2)C12CCC2 ZINC000405257366 971223140 /nfs/dbraw/zinc/22/31/40/971223140.db2.gz LKAUNZBIGAYWRC-STQMWFEESA-N 2 0 220.360 2.346 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]C[C@H]2Cc3ccccc32)C12CCC2 ZINC000405275579 971224516 /nfs/dbraw/zinc/22/45/16/971224516.db2.gz WVLGBYYVFPQGNZ-BPLDGKMQSA-N 2 0 242.366 2.186 20 0 BEADRP CCSCC[C@H](C)[NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405278867 971224532 /nfs/dbraw/zinc/22/45/32/971224532.db2.gz YJFKYHGNVXJJJH-QJPTWQEYSA-N 2 0 242.432 2.378 20 0 BEADRP C[C@H](CC(F)(F)F)[NH2+][C@H]1C[C@H]([NH3+])C12CCC2 ZINC000405272495 971226959 /nfs/dbraw/zinc/22/69/59/971226959.db2.gz SPYFWCCDKKZEQG-VGMNWLOBSA-N 2 0 236.281 2.187 20 0 BEADRP CCC[C@H](C)[NH+]1C[C@H]2C[NH+](CCC)C[C@@H]2C1 ZINC001257327067 971227023 /nfs/dbraw/zinc/22/70/23/971227023.db2.gz GEVPISPEIPQVKA-BFHYXJOUSA-N 2 0 224.392 2.449 20 0 BEADRP C[C@H](Cc1ccco1)[NH2+][C@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405282326 971228248 /nfs/dbraw/zinc/22/82/48/971228248.db2.gz CHNARPUXLOHGKV-RTXFEEFZSA-N 2 0 234.343 2.070 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+][C@@H]2CC3CCC2CC3)C12CCC2 ZINC000405332912 971238538 /nfs/dbraw/zinc/23/85/38/971238538.db2.gz XKFMONOQKZGRBU-YAWVXEGQSA-N 2 0 234.387 2.425 20 0 BEADRP CC(C)OCCCC[NH2+][C@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405358284 971244268 /nfs/dbraw/zinc/24/42/68/971244268.db2.gz SHCGVWLFNFDVCZ-OLZOCXBDSA-N 2 0 240.391 2.051 20 0 BEADRP Cc1csc(C[NH2+][C@@H]2C[C@@H]([NH3+])C23CCC3)c1 ZINC000405378826 971247837 /nfs/dbraw/zinc/24/78/37/971247837.db2.gz CGJVRXBLSQMYDT-VXGBXAGGSA-N 2 0 236.384 2.416 20 0 BEADRP C[C@@H]1CCC[C@@H]1C[NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405366796 971244705 /nfs/dbraw/zinc/24/47/05/971244705.db2.gz WZUUVKMGCVXQTM-FDYHWXHSSA-N 2 0 222.376 2.282 20 0 BEADRP CC(C)C1(C[NH2+][C@@H]2C[C@@H]([NH3+])C23CCC3)CC1 ZINC000405372918 971246979 /nfs/dbraw/zinc/24/69/79/971246979.db2.gz ZODRFVUZCXMXAF-VXGBXAGGSA-N 2 0 222.376 2.282 20 0 BEADRP C[NH+](C)[C@H]1CC[C@@H]([NH2+]C2CCCC2)CC1 ZINC001257348614 971258505 /nfs/dbraw/zinc/25/85/05/971258505.db2.gz FPYQHFFKRMUMEJ-BETUJISGSA-N 2 0 210.365 2.391 20 0 BEADRP CC(C)CCC[NH2+][C@@H]1C[C@H]([NH3+])C12CCC2 ZINC000405459917 971259763 /nfs/dbraw/zinc/25/97/63/971259763.db2.gz ILUZQHLOMZGPIL-NWDGAFQWSA-N 2 0 210.365 2.282 20 0 BEADRP CCC[N@H+]1C[C@@H]2C[NH+](C3CCCC3)C[C@@H]2C1 ZINC001257355253 971271094 /nfs/dbraw/zinc/27/10/94/971271094.db2.gz SHRANNRJCPDDJE-BETUJISGSA-N 2 0 222.376 2.203 20 0 BEADRP CCCC[C@@H](CC)NC(=[NH2+])SCC[NH3+] ZINC001257411247 971306917 /nfs/dbraw/zinc/30/69/17/971306917.db2.gz SQJNJAIDRJUXIQ-SECBINFHSA-N 2 0 217.382 2.171 20 0 BEADRP CC[NH+](CC)CCO[C@@H]1CCC[N@@H+](C(C)C)C1 ZINC001224927158 974075946 /nfs/dbraw/zinc/07/59/46/974075946.db2.gz DSWHIGQMDRCKHP-CQSZACIVSA-N 2 0 242.407 2.218 20 0 BEADRP CC[C@H](C)[NH+]1CCC([N@H+](C)C2CC2)CC1 ZINC001257446903 971362680 /nfs/dbraw/zinc/36/26/80/971362680.db2.gz SFNSDYVVLWBOLX-NSHDSACASA-N 2 0 210.365 2.344 20 0 BEADRP [NH3+][C@H]1CCc2c1cccc2N[C@@H]1CCC[C@H]([NH3+])C1 ZINC001170623200 971378741 /nfs/dbraw/zinc/37/87/41/971378741.db2.gz QNAJFPMAUQWCNZ-WDMOLILDSA-N 2 0 245.370 2.314 20 0 BEADRP C[N@@H+]1CC[C@@H]2C[NH+](C3CCCCC3)C[C@@H]2C1 ZINC001257458116 971379682 /nfs/dbraw/zinc/37/96/82/971379682.db2.gz QTPXLFGMUZHFKI-OLZOCXBDSA-N 2 0 222.376 2.203 20 0 BEADRP C[C@@H]1C[NH2+]CCC[C@H]1OCc1ccc(C[NH3+])cc1 ZINC001217772184 971397461 /nfs/dbraw/zinc/39/74/61/971397461.db2.gz ANSXENFKHGDMJM-IUODEOHRSA-N 2 0 248.370 2.050 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1OCc1cccc(C[NH3+])c1 ZINC001217779308 971400008 /nfs/dbraw/zinc/40/00/08/971400008.db2.gz CYWJGWFLMKBJPP-WFASDCNBSA-N 2 0 248.370 2.050 20 0 BEADRP C[C@@H]1C[NH2+]CCC[C@@H]1OCc1ccccc1C[NH3+] ZINC001217781393 971404366 /nfs/dbraw/zinc/40/43/66/971404366.db2.gz RQEVJOOJZOTSQE-DOMZBBRYSA-N 2 0 248.370 2.050 20 0 BEADRP C[NH2+][C@H]1CC[C@H](OCCCCCCC[NH3+])CC1 ZINC001217824325 971421033 /nfs/dbraw/zinc/42/10/33/971421033.db2.gz SIRNYOVYVBKHLB-HDJSIYSDSA-N 2 0 242.407 2.443 20 0 BEADRP CC[N@H+](C)C1CC[NH+]([C@@H]2CCCSC2)CC1 ZINC001257684453 971490806 /nfs/dbraw/zinc/49/08/06/971490806.db2.gz SZGBPQQDBIBUPY-CYBMUJFWSA-N 2 0 242.432 2.298 20 0 BEADRP CC(C)C[NH+]1CCC([NH2+]C[C@H]2C[C@H](F)C2)CC1 ZINC001258002781 971555788 /nfs/dbraw/zinc/55/57/88/971555788.db2.gz DKWOZOXGACYZQD-JOCQHMNTSA-N 2 0 242.382 2.445 20 0 BEADRP C[C@@H]1C[NH2+]CCC[C@H]1Oc1cccc2c1C[NH2+]C2 ZINC001217992405 971561537 /nfs/dbraw/zinc/56/15/37/971561537.db2.gz RHTLLSZMGAJANR-BXUZGUMPSA-N 2 0 246.354 2.057 20 0 BEADRP C[C@H]([NH3+])c1ccc(O[C@@H](C)C2CC[NH2+]CC2)cc1 ZINC001218005974 971568453 /nfs/dbraw/zinc/56/84/53/971568453.db2.gz PDUGETKFRFVXMV-RYUDHWBXSA-N 2 0 248.370 2.473 20 0 BEADRP C[C@@H]([NH3+])c1ccc(O[C@H](C)C2CC[NH2+]CC2)cc1 ZINC001218005976 971570249 /nfs/dbraw/zinc/57/02/49/971570249.db2.gz PDUGETKFRFVXMV-VXGBXAGGSA-N 2 0 248.370 2.473 20 0 BEADRP C[C@H]([NH3+])c1ccc(O[C@H]2CC[NH2+]CC[C@@H]2C)cc1 ZINC001218034115 971576169 /nfs/dbraw/zinc/57/61/69/971576169.db2.gz LYWHCHQUBUNMGG-HUBLWGQQSA-N 2 0 248.370 2.473 20 0 BEADRP [NH3+]Cc1ccccc1OC1CC2(C1)CC[NH2+]CC2 ZINC001218104334 971600828 /nfs/dbraw/zinc/60/08/28/971600828.db2.gz LWVUDMKBXMWULS-UHFFFAOYSA-N 2 0 246.354 2.056 20 0 BEADRP CC1(C)[C@@H]2C[C@@H]([NH2+][C@@H]3CCC[C@H]([NH3+])C3)C[C@@H]21 ZINC001170709670 971612679 /nfs/dbraw/zinc/61/26/79/971612679.db2.gz CDWUZRJZGFAUHU-FPYNETTCSA-N 2 0 222.376 2.281 20 0 BEADRP C[NH2+][C@H]1CC[C@H](Oc2ccc3c(c2)C[NH2+]C3)CC1 ZINC001218189557 971624074 /nfs/dbraw/zinc/62/40/74/971624074.db2.gz YYDXIAJMZDVXKO-HDJSIYSDSA-N 2 0 246.354 2.199 20 0 BEADRP CC[NH+](CC)C[C@@H](C)Oc1cccc(C[NH3+])c1 ZINC001218194469 971625286 /nfs/dbraw/zinc/62/52/86/971625286.db2.gz UWEXMFZTRIBPAV-GFCCVEGCSA-N 2 0 236.359 2.254 20 0 BEADRP C[C@@H]([NH3+])c1ccn([C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)n1 ZINC001172106282 974366673 /nfs/dbraw/zinc/36/66/73/974366673.db2.gz OUWSTKBOCHXQDI-NDBYEHHHSA-N 2 0 248.374 2.091 20 0 BEADRP CC(C)[N@@H+]1CCC[C@H](Oc2cccc(C[NH3+])c2)C1 ZINC001218349140 971721426 /nfs/dbraw/zinc/72/14/26/971721426.db2.gz XXIPRRVKFLQBDN-HNNXBMFYSA-N 2 0 248.370 2.397 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+][C@@H](C)CCOC ZINC000309654799 971723577 /nfs/dbraw/zinc/72/35/77/971723577.db2.gz PHCHBOQBUATWPV-OLZOCXBDSA-N 2 0 230.396 2.121 20 0 BEADRP C[N@@H+]1CC[C@]2(CC[NH+]([C@H]3C[C@@H]4[C@H](C3)C4(C)C)C2)C1 ZINC001170763743 971749771 /nfs/dbraw/zinc/74/97/71/971749771.db2.gz CMBDVZHDGKKAGA-FQLMCAECSA-N 2 0 248.414 2.449 20 0 BEADRP C[NH+]1CCC2(C[NH+]([C@@H]3C[C@@H]4[C@H](C3)C4(C)C)C2)CC1 ZINC001170764743 971752541 /nfs/dbraw/zinc/75/25/41/971752541.db2.gz MBMNZKAEJRRLGE-ZSOGYDGISA-N 2 0 248.414 2.449 20 0 BEADRP CC[NH+]1C[C@@H]2C[NH+]([C@@H]3C[C@@H]4[C@H](C3)C4(C)C)C[C@H]2C1 ZINC001170768003 971760270 /nfs/dbraw/zinc/76/02/70/971760270.db2.gz VSLFEPQIGTYMHH-RYPNDVFKSA-N 2 0 248.414 2.305 20 0 BEADRP C[C@H]([NH3+])c1ccc(O[C@@H]2C[NH2+]CCC23CC3)cc1 ZINC001218408697 971782890 /nfs/dbraw/zinc/78/28/90/971782890.db2.gz LXXLNKGXELNETI-SMDDNHRTSA-N 2 0 246.354 2.227 20 0 BEADRP CC[NH+](CC)CCCC[NH2+][C@H]1COC(C)(C)C1 ZINC001172270487 974486832 /nfs/dbraw/zinc/48/68/32/974486832.db2.gz MRZZVSTYGWBJCQ-CYBMUJFWSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@H]([NH3+])c1ccc(O[C@H]2C[NH2+]CC[C@H]2C)cc1 ZINC001218482639 971830189 /nfs/dbraw/zinc/83/01/89/971830189.db2.gz BVXZVIVYQILJEX-SUNKGSAMSA-N 2 0 234.343 2.083 20 0 BEADRP [NH3+]CCC1CCC([NH2+][C@@H]2CCCOCC2)CC1 ZINC001170792218 971832833 /nfs/dbraw/zinc/83/28/33/971832833.db2.gz IUABRUIEJLWDMV-ROKHWSDSSA-N 2 0 240.391 2.053 20 0 BEADRP Cc1ccc(NCC[C@@H](C)[NH3+])c(C[NH+](C)C)c1 ZINC001170895817 972048446 /nfs/dbraw/zinc/04/84/46/972048446.db2.gz YCPLETXQKTZGMU-GFCCVEGCSA-N 2 0 235.375 2.206 20 0 BEADRP [NH3+]CCCCCCCC[NH2+][C@H]1CCCC[NH2+]C1 ZINC001246080114 972133338 /nfs/dbraw/zinc/13/33/38/972133338.db2.gz MVDWKFCPLCADCH-AWEZNQCLSA-N 3 0 241.423 2.017 20 0 BEADRP [NH3+]CCCCCCCC[NH2+][C@@H]1CCCC[NH2+]C1 ZINC001246080132 972133772 /nfs/dbraw/zinc/13/37/72/972133772.db2.gz MVDWKFCPLCADCH-CQSZACIVSA-N 3 0 241.423 2.017 20 0 BEADRP CC1(C)[C@@H]2C[C@@H]([NH2+][C@H]3CCCC[NH2+]C3)C[C@@H]21 ZINC001246089287 972142985 /nfs/dbraw/zinc/14/29/85/972142985.db2.gz BXGYQIFFZOUUMM-ZDEQEGDKSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]1C[NH2+]C[C@@H](C[NH2+][C@@H]2C[C@@H]3[C@H](C2)C3(C)C)C1 ZINC001246101299 972158035 /nfs/dbraw/zinc/15/80/35/972158035.db2.gz PKAMFRCNDRSEBJ-HTVCTNPSSA-N 2 0 236.403 2.256 20 0 BEADRP C[C@H]1C[NH2+]C[C@H]1[NH2+][C@H]1C[C@H](C)CC(C)(C)C1 ZINC001246116499 972178913 /nfs/dbraw/zinc/17/89/13/972178913.db2.gz MRTLBRBZQWCLME-ZDEQEGDKSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]C[C@H]2C[NH2+]CC[C@H]2C)C1 ZINC001246112286 972176404 /nfs/dbraw/zinc/17/64/04/972176404.db2.gz NLBAXZRBFZVIGX-SYQHCUMBSA-N 2 0 224.392 2.400 20 0 BEADRP CC[C@H](C)C[C@H](CC)[NH2+][C@@H]1C[NH2+]C[C@@H]1C ZINC001246113526 972176465 /nfs/dbraw/zinc/17/64/65/972176465.db2.gz BZPHTLXVGIGPLH-ZDEQEGDKSA-N 2 0 212.381 2.399 20 0 BEADRP C[N@@H+]1CCC=C(c2ccc([C@H]3CC[NH2+]C3)cc2)C1 ZINC001241571278 1169731074 /nfs/dbraw/zinc/73/10/74/1169731074.db2.gz XNWYCRLTJUUIPF-HNNXBMFYSA-N 2 0 242.366 2.482 20 0 BEADRP C[C@@H]1[NH2+]CCC[C@@H]1C[NH2+]C1Cc2ccccc2C1 ZINC001246113149 972177006 /nfs/dbraw/zinc/17/70/06/972177006.db2.gz SJDUWSQLUOEJSM-SWLSCSKDSA-N 2 0 244.382 2.132 20 0 BEADRP C[NH+](C)/C=C/c1ccncc1C1=CCC[N@H+](C)C1 ZINC001241571780 1169732485 /nfs/dbraw/zinc/73/24/85/1169732485.db2.gz IVSHKORDSOFPSA-JXMROGBWSA-N 2 0 243.354 2.333 20 0 BEADRP CC(C)COCC[C@H](C)[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC001246199573 972217218 /nfs/dbraw/zinc/21/72/18/972217218.db2.gz XFZHUXCMNWYPDO-UONOGXRCSA-N 2 0 242.407 2.027 20 0 BEADRP CSC1CC[NH+](C[C@@]2(C)CCC[NH2+]C2)CC1 ZINC000300797072 957048443 /nfs/dbraw/zinc/04/84/43/957048443.db2.gz DVECYADFJNMLDU-ZDUSSCGKSA-N 2 0 242.432 2.204 20 0 BEADRP CC[C@@H]1CC[C@H]([NH2+][C@@H]2CCC[C@H]([NH3+])C2)C1 ZINC000414927733 972249244 /nfs/dbraw/zinc/24/92/44/972249244.db2.gz PISDPAXZQOFEBA-XQHKEYJVSA-N 2 0 210.365 2.425 20 0 BEADRP Cc1ccc(C[C@@H](C)[NH2+]CC[C@H](C)[NH3+])cc1 ZINC001246304285 972266130 /nfs/dbraw/zinc/26/61/30/972266130.db2.gz LHTHJGBHGGXRLO-QWHCGFSZSA-N 2 0 220.360 2.253 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@@H]1CCc2cccc(F)c2C1 ZINC001246313139 972272330 /nfs/dbraw/zinc/27/23/30/972272330.db2.gz JELPRQPPPPJQMM-NWDGAFQWSA-N 2 0 236.334 2.010 20 0 BEADRP C[C@@H](CC(F)(F)F)[NH2+]C[C@@H]1CC[C@@H](C)[NH2+]C1 ZINC000397530375 957680239 /nfs/dbraw/zinc/68/02/39/957680239.db2.gz YGMIKZRYSUENLA-KXUCPTDWSA-N 2 0 238.297 2.305 20 0 BEADRP CC(C)[NH+](CC1CC[NH+](C)CC1)C(C)C ZINC000197741343 958030492 /nfs/dbraw/zinc/03/04/92/958030492.db2.gz XMDNEDBERXSYFB-UHFFFAOYSA-N 2 0 212.381 2.447 20 0 BEADRP CCc1ccc(C[C@H](C)[NH2+][C@H]2CC23C[NH2+]C3)cc1 ZINC001246443977 972315408 /nfs/dbraw/zinc/31/54/08/972315408.db2.gz IWHVKVCLKTWVFH-WFASDCNBSA-N 2 0 244.382 2.132 20 0 BEADRP C1[C@H]([NH2+]C2CCC3(CCCC3)CC2)C12C[NH2+]C2 ZINC001246444295 972317307 /nfs/dbraw/zinc/31/73/07/972317307.db2.gz JYWOWXPTXCBDCT-ZDUSSCGKSA-N 2 0 234.387 2.441 20 0 BEADRP C[C@H](CC(F)(F)F)[NH2+]C[C@H]1C[NH2+]C[C@@H](C)C1 ZINC000398645025 958342464 /nfs/dbraw/zinc/34/24/64/958342464.db2.gz BVOLTLWMYWIHCP-IVZWLZJFSA-N 2 0 238.297 2.163 20 0 BEADRP CC[C@H](C)OCC[C@H](C)[NH2+][C@H]1CCCC[C@H]1[NH3+] ZINC001246474688 972347874 /nfs/dbraw/zinc/34/78/74/972347874.db2.gz AWXKVOIMSAAQEX-FQUUOJAGSA-N 2 0 242.407 2.440 20 0 BEADRP CC[C@@H](C)OCC[C@@H](C)[NH2+][C@H]1CCCC[C@H]1[NH3+] ZINC001246474714 972348058 /nfs/dbraw/zinc/34/80/58/972348058.db2.gz AWXKVOIMSAAQEX-SYQHCUMBSA-N 2 0 242.407 2.440 20 0 BEADRP C[C@H]1CC[C@H](N(C)CCc2cccs2)C[NH2+]1 ZINC000398983360 958475270 /nfs/dbraw/zinc/47/52/70/958475270.db2.gz GZQPIKSYMXATID-RYUDHWBXSA-N 2 0 238.400 2.363 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2CCC23CCCC3)CC[NH2+]1 ZINC000707627663 958636930 /nfs/dbraw/zinc/63/69/30/958636930.db2.gz RRRVYQWPEYYIDB-VXGBXAGGSA-N 2 0 208.349 2.145 20 0 BEADRP C([NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)[C@]12C[C@H]1CCC2 ZINC000693534723 958726804 /nfs/dbraw/zinc/72/68/04/958726804.db2.gz OLRPGPXNYVXLTG-TUVASFSCSA-N 2 0 234.387 2.393 20 0 BEADRP CC(C)(C)C1CC[NH+](C[C@H]2C[C@@H]([NH3+])C2)CC1 ZINC000693545502 958757815 /nfs/dbraw/zinc/75/78/15/958757815.db2.gz OGMBCEMOHUNXIJ-BJHJDKERSA-N 2 0 224.392 2.482 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@@H]2CCCC[C@@H]2C2CC2)C1 ZINC000693562222 958807001 /nfs/dbraw/zinc/80/70/01/958807001.db2.gz MVTOLCGDNQXQTK-YXCITZCRSA-N 2 0 222.376 2.282 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]C[C@]23C[C@H]2CCCC3)C12CCC2 ZINC000693563977 958815861 /nfs/dbraw/zinc/81/58/61/958815861.db2.gz FEVZPEZSDYYZAX-MQYQWHSLSA-N 2 0 234.387 2.426 20 0 BEADRP CC[C@@H]1C[N@H+](CCCCCC[NH3+])[C@@H](CC)CO1 ZINC000403731891 958835819 /nfs/dbraw/zinc/83/58/19/958835819.db2.gz BABZVGRCCDWKKW-UONOGXRCSA-N 2 0 242.407 2.395 20 0 BEADRP [NH3+]CC[C@@H]1CC[N@H+](Cc2cccc(F)c2F)C1 ZINC000690738452 958856367 /nfs/dbraw/zinc/85/63/67/958856367.db2.gz HPIUWMWPCARBOS-SNVBAGLBSA-N 2 0 240.297 2.136 20 0 BEADRP C[C@@H](Cc1ccccn1)[NH2+]CC[C@@H]1CCC[N@@H+]1C ZINC000707961860 958880075 /nfs/dbraw/zinc/88/00/75/958880075.db2.gz VMONDLYLFQKGSE-ZFWWWQNUSA-N 2 0 247.386 2.087 20 0 BEADRP CC[N@@H+](Cc1cccs1)C[C@H]1C[C@@H]([NH3+])C1 ZINC000693591731 958899919 /nfs/dbraw/zinc/89/99/19/958899919.db2.gz LHMFIVKMEOOHDK-PHIMTYICSA-N 2 0 224.373 2.307 20 0 BEADRP CC[N@@H+](Cc1ccccc1)C[C@H]1C[C@@H]([NH3+])C1 ZINC000693597784 958924293 /nfs/dbraw/zinc/92/42/93/958924293.db2.gz XKJJTSBZFNTLRS-OKILXGFUSA-N 2 0 218.344 2.246 20 0 BEADRP [NH3+]Cc1cccn1-c1ccc(C2([NH3+])CCC2)cc1 ZINC001167593111 958989677 /nfs/dbraw/zinc/98/96/77/958989677.db2.gz LGDBOVIUEJKYNR-UHFFFAOYSA-N 2 0 241.338 2.274 20 0 BEADRP C[C@]1([NH3+])CCN([C@@H]2CSc3ccccc3C2)C1 ZINC001246526826 972396868 /nfs/dbraw/zinc/39/68/68/972396868.db2.gz BUTATDPEAJJRNS-JSGCOSHPSA-N 2 0 248.395 2.127 20 0 BEADRP C[C@@]1([NH3+])CCN([C@H]2CSc3ccccc3C2)C1 ZINC001246526837 972399353 /nfs/dbraw/zinc/39/93/53/972399353.db2.gz BUTATDPEAJJRNS-TZMCWYRMSA-N 2 0 248.395 2.127 20 0 BEADRP Cc1noc(C)c1[C@@H](C)[NH2+]CCCC[NH+](C)C ZINC000690747687 959209092 /nfs/dbraw/zinc/20/90/92/959209092.db2.gz LWCMHJTZMHWGQY-SNVBAGLBSA-N 2 0 239.363 2.284 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[NH+]2CCC(F)(C3CC3)CC2)C1 ZINC000724801585 959313239 /nfs/dbraw/zinc/31/32/39/959313239.db2.gz CRCLCEVCZCCWLG-WCQYABFASA-N 2 0 240.366 2.328 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@H+](C)[C@@H]1CCCC[C@H]1C ZINC000300356697 959378081 /nfs/dbraw/zinc/37/80/81/959378081.db2.gz OCIMHMAJFFCUSX-YIYPIFLZSA-N 2 0 224.392 2.352 20 0 BEADRP Cc1ccsc1C[NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405263909 959423941 /nfs/dbraw/zinc/42/39/41/959423941.db2.gz OMCHBKFYSURLAG-VXGBXAGGSA-N 2 0 236.384 2.416 20 0 BEADRP Cc1ccsc1C[NH2+][C@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405263900 959424808 /nfs/dbraw/zinc/42/48/08/959424808.db2.gz OMCHBKFYSURLAG-NEPJUHHUSA-N 2 0 236.384 2.416 20 0 BEADRP Cc1cccc(CC[NH2+][C@@H]2C[C@H]([NH3+])C23CCC3)c1 ZINC000405277430 959428132 /nfs/dbraw/zinc/42/81/32/959428132.db2.gz XSQZRAUPZPFBKA-LSDHHAIUSA-N 2 0 244.382 2.397 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+][C@@H]2CC3CCC2CC3)C12CCC2 ZINC000405332913 959439133 /nfs/dbraw/zinc/43/91/33/959439133.db2.gz XKFMONOQKZGRBU-YTPFDHIKSA-N 2 0 234.387 2.425 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@@H]1CCC12CCCC2 ZINC000693890747 959481082 /nfs/dbraw/zinc/48/10/82/959481082.db2.gz WUVPMVKVQDEFPO-FRRDWIJNSA-N 2 0 222.376 2.154 20 0 BEADRP C[C@H](NCC[C@H]1CCC[N@@H+]1C)c1cncs1 ZINC000693892817 959482734 /nfs/dbraw/zinc/48/27/34/959482734.db2.gz DQKHKBXEQZVGIR-WDEREUQCSA-N 2 0 239.388 2.278 20 0 BEADRP C1=C[C@@H]2C[C@H]1C[C@H]2C[N@@H+]1CCC[C@@]2(CCC[NH2+]2)C1 ZINC001222345266 972441043 /nfs/dbraw/zinc/44/10/43/972441043.db2.gz KHSIMOJMQSYODL-FZKCQIBNSA-N 2 0 246.398 2.417 20 0 BEADRP C[C@H]1C[NH2+]CCC[C@H]1OCCCCCCC[NH3+] ZINC001217776061 959587389 /nfs/dbraw/zinc/58/73/89/959587389.db2.gz FDHXIOSMNPRMCX-UONOGXRCSA-N 2 0 242.407 2.300 20 0 BEADRP CCCCN1CCC[C@@]2(CCCC[NH2+]2)C1 ZINC001222385316 972450681 /nfs/dbraw/zinc/45/06/81/972450681.db2.gz JKFOXORPXPRSKG-ZDUSSCGKSA-N 2 0 210.365 2.395 20 0 BEADRP Cc1cccc(C[N@H+]2C[C@H](C)[C@H](C[NH3+])C2)c1F ZINC000708823413 959853933 /nfs/dbraw/zinc/85/39/33/959853933.db2.gz UEGNBCPOTDIHEY-WCQYABFASA-N 2 0 236.334 2.161 20 0 BEADRP [NH3+]CC1(F)CC[NH+](Cc2cccc(F)c2)CC1 ZINC001222531407 972547051 /nfs/dbraw/zinc/54/70/51/972547051.db2.gz BQILMCDGNCNLDA-UHFFFAOYSA-N 2 0 240.297 2.089 20 0 BEADRP CCCCC[C@H](C)[NH2+]CC12CC(C1)C[NH2+]2 ZINC000694515168 959897159 /nfs/dbraw/zinc/89/71/59/959897159.db2.gz MLUWYPPXNULYBF-HIFPTAJRSA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@@H]1CC[C@H]([N@@H+]2C[C@H](C)[C@H](C[NH3+])C2)C1 ZINC000708863265 959986294 /nfs/dbraw/zinc/98/62/94/959986294.db2.gz NBRVWLZDDNQPIM-LOWDOPEQSA-N 2 0 210.365 2.092 20 0 BEADRP C[C@H]([NH3+])c1ccc(O[C@H]2CC[NH2+]C[C@H]2C)cc1 ZINC001218418806 960078436 /nfs/dbraw/zinc/07/84/36/960078436.db2.gz WSFOWHCEAHSYDY-SUNKGSAMSA-N 2 0 234.343 2.083 20 0 BEADRP CC1(C)[C@@H]2C[C@H]([NH+]3CCC(C[NH3+])CC3)C[C@@H]21 ZINC001246537180 972479599 /nfs/dbraw/zinc/47/95/99/972479599.db2.gz FVPGRLZGGYNGBR-CLLJXQQHSA-N 2 0 222.376 2.092 20 0 BEADRP C[C@@H]1C[C@@H]([N@@H+]2CCCC(F)(F)CC2)CC[NH2+]1 ZINC000702795776 960305038 /nfs/dbraw/zinc/30/50/38/960305038.db2.gz CHWSYCCGNRHLSC-MNOVXSKESA-N 2 0 232.318 2.248 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)C1(Cl)CC1 ZINC000695654756 960328447 /nfs/dbraw/zinc/32/84/47/960328447.db2.gz JGADJIDWGKDPFY-WDEREUQCSA-N 2 0 242.794 2.220 20 0 BEADRP [NH3+]C[C@@H]1CC[N@H+](CC2CCC3(CC3)CC2)C1 ZINC000695720261 960402088 /nfs/dbraw/zinc/40/20/88/960402088.db2.gz ZDSOGFAMSIWHLQ-ZDUSSCGKSA-N 2 0 222.376 2.237 20 0 BEADRP C1=C[C@@H]2C[C@H]1C[C@@H]2C[N@@H+]1CCC[C@]2(CCC[NH2+]2)C1 ZINC001222345281 960543728 /nfs/dbraw/zinc/54/37/28/960543728.db2.gz KHSIMOJMQSYODL-ZJIFWQFVSA-N 2 0 246.398 2.417 20 0 BEADRP C[C@H](C[NH2+][C@H]1C[C@@H]([NH3+])C12CCC2)c1ccccn1 ZINC000692744331 960565064 /nfs/dbraw/zinc/56/50/64/960565064.db2.gz GBJVNHFLEWBTOZ-BNOWGMLFSA-N 2 0 245.370 2.045 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2CCC[C@H]2c2ccncc2)CC[NH2+]1 ZINC000709467549 960610910 /nfs/dbraw/zinc/61/09/10/960610910.db2.gz UMNAQUPEGQMUFW-YUELXQCFSA-N 2 0 245.370 2.359 20 0 BEADRP C[C@@H]1C[N@H+](CCCCc2ccccc2)C[C@H]1[NH3+] ZINC000300047968 960875036 /nfs/dbraw/zinc/87/50/36/960875036.db2.gz GIOPWWIOCHHFQE-UKRRQHHQSA-N 2 0 232.371 2.288 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CC[C@@H]1COC ZINC001167834914 961211154 /nfs/dbraw/zinc/21/11/54/961211154.db2.gz NTYNWZGZUFOKQM-UONOGXRCSA-N 2 0 242.407 2.218 20 0 BEADRP Cc1ccc([C@H](C)[NH2+]C[C@@H]2CC[C@H]([NH3+])C2)c(C)n1 ZINC000925883500 961715465 /nfs/dbraw/zinc/71/54/65/961715465.db2.gz WVMRUKWCXCWRDW-YUTCNCBUSA-N 2 0 247.386 2.476 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@@H+]1CCC[C@@H](C2CCC2)C1 ZINC000692926526 961747691 /nfs/dbraw/zinc/74/76/91/961747691.db2.gz KDUNELPTMCLDPN-YUELXQCFSA-N 2 0 236.403 2.354 20 0 BEADRP C[N@H+](CC1CC[NH+](C)CC1)[C@H]1C[C@H]2C[C@H]2C1 ZINC001167939981 962164500 /nfs/dbraw/zinc/16/45/00/962164500.db2.gz OGRFYPNKNQJCSN-WDNDVIMCSA-N 2 0 222.376 2.059 20 0 BEADRP CCc1cccc(C[N@@H+]2CCCC[C@H](C[NH3+])C2)n1 ZINC001206641222 962286309 /nfs/dbraw/zinc/28/63/09/962286309.db2.gz UQNKMKQOANVWML-CYBMUJFWSA-N 2 0 247.386 2.205 20 0 BEADRP C[NH+]1CCC2(CC[N@@H+]([C@@H]3C[C@H]4C[C@H]4C3)C2)CC1 ZINC001167950595 962630548 /nfs/dbraw/zinc/63/05/48/962630548.db2.gz CZQZXEIMSSRBOS-BTTYYORXSA-N 2 0 234.387 2.203 20 0 BEADRP Cc1[nH+]c(N[C@@H]2CC[NH2+][C@@H]2C)cc2[nH]ccc21 ZINC001155188183 963015660 /nfs/dbraw/zinc/01/56/60/963015660.db2.gz UYNWIYYSASRYQY-MWLCHTKSSA-N 2 0 230.315 2.034 20 0 BEADRP Cc1[nH+]c(N[C@@H](C)C[NH+](C)C)cc2[nH]ccc21 ZINC001155921540 963205985 /nfs/dbraw/zinc/20/59/85/963205985.db2.gz NPHQAXYKHVXDOL-VIFPVBQESA-N 2 0 232.331 2.233 20 0 BEADRP Cc1ccc(N(CCC[NH3+])C(C)C)[nH+]c1C ZINC001156117773 963259588 /nfs/dbraw/zinc/25/95/88/963259588.db2.gz AJURRKPMFFFMIN-UHFFFAOYSA-N 2 0 221.348 2.262 20 0 BEADRP COC[C@@H]1CCCC[N@H+](CCCCCC[NH3+])C1 ZINC000696642588 963331435 /nfs/dbraw/zinc/33/14/35/963331435.db2.gz BFXHRVNMBKBNPU-CQSZACIVSA-N 2 0 242.407 2.254 20 0 BEADRP CN(c1[nH+]ccc2[nH]ccc21)[C@@]1(C)CCC[NH2+]C1 ZINC001156956943 963502647 /nfs/dbraw/zinc/50/26/47/963502647.db2.gz SQZLTYYSIZMZKW-AWEZNQCLSA-N 2 0 244.342 2.141 20 0 BEADRP CCCc1nccn1C[C@H]1CCCC[NH2+]C1 ZINC000697002607 963624255 /nfs/dbraw/zinc/62/42/55/963624255.db2.gz YULFFQJEKLJDJP-LBPRGKRZSA-N 2 0 221.348 2.225 20 0 BEADRP CC[C@@H](C)[N@H+](CC)C[C@@H]1CCCC[NH2+]C1 ZINC000697040095 963669628 /nfs/dbraw/zinc/66/96/28/963669628.db2.gz HKEARXNAGHAXBQ-CHWSQXEVSA-N 2 0 212.381 2.497 20 0 BEADRP Cc1c[nH+]c(N[C@H]2CCCC[C@@H]2[NH+](C)C)cc1N ZINC001157803058 963730813 /nfs/dbraw/zinc/73/08/13/963730813.db2.gz KKIREEYVUINFGX-STQMWFEESA-N 2 0 248.374 2.257 20 0 BEADRP CC[NH+]1C[C@H]2C[NH+](C3CCC(C)CC3)C[C@@H]2C1 ZINC001168225409 964005831 /nfs/dbraw/zinc/00/58/31/964005831.db2.gz ZPOKIWKYAHDBCE-GQKFXUNGSA-N 2 0 236.403 2.449 20 0 BEADRP F[C@@H]1CC[NH2+]C[C@@H]1Nc1cc[nH+]c(C2CC2)c1 ZINC001168230916 964013810 /nfs/dbraw/zinc/01/38/10/964013810.db2.gz GQEYVJFXBPFCHL-YPMHNXCESA-N 2 0 235.306 2.071 20 0 BEADRP Clc1cc(NC2=CCC[NH2+]C2)cn2ccnc12 ZINC001159265594 964041847 /nfs/dbraw/zinc/04/18/47/964041847.db2.gz AKZIKEUYZAMUBT-UHFFFAOYSA-N 2 0 248.717 2.277 20 0 BEADRP CCN1CCC[C@H]1C[NH2+][C@H](C)Cc1ccncc1 ZINC001256715837 1169834634 /nfs/dbraw/zinc/83/46/34/1169834634.db2.gz IJZYYPMBLNJORG-HIFRSBDPSA-N 2 0 247.386 2.087 20 0 BEADRP C(=CC1CC[NH2+]CC1)Nc1ccc2c(c1)C[NH2+]C2 ZINC001159472911 964104766 /nfs/dbraw/zinc/10/47/66/964104766.db2.gz WKZWJZWJJUEGNK-VMPITWQZSA-N 2 0 243.354 2.215 20 0 BEADRP CCN1CCC[C@H]1C[NH2+][C@@H](C)Cc1ccncc1 ZINC001256715840 1169835379 /nfs/dbraw/zinc/83/53/79/1169835379.db2.gz IJZYYPMBLNJORG-ZFWWWQNUSA-N 2 0 247.386 2.087 20 0 BEADRP C[C@@H]1C[C@@H](F)C[N@@H+]1C1CCC([NH+](C)C)CC1 ZINC001168313435 964422519 /nfs/dbraw/zinc/42/25/19/964422519.db2.gz CTAIUTUCLVFTOY-OKZRHMCRSA-N 2 0 228.355 2.292 20 0 BEADRP CC(C)C[N@H+](C)C1CCC([NH+](C)C)CC1 ZINC001168316440 964432004 /nfs/dbraw/zinc/43/20/04/964432004.db2.gz YTTWRMNRWQKBRD-UHFFFAOYSA-N 2 0 212.381 2.447 20 0 BEADRP C[NH+](C)C1CCC([NH2+][C@]2(C)CCCOC2)CC1 ZINC001168316097 964437256 /nfs/dbraw/zinc/43/72/56/964437256.db2.gz VSDFNSADTSXAKO-JXQTWKCFSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@H]1CCC[N@@H+]1C1CCC([NH+](C)C)CC1 ZINC001168315958 964437586 /nfs/dbraw/zinc/43/75/86/964437586.db2.gz SJNXCQNRJHUYOU-HIFPTAJRSA-N 2 0 210.365 2.344 20 0 BEADRP C[NH+](C)C1CCC([NH+]2CC3CC(C3)C2)CC1 ZINC001168329526 964461139 /nfs/dbraw/zinc/46/11/39/964461139.db2.gz WQMARZINCQRQPW-UHFFFAOYSA-N 2 0 222.376 2.201 20 0 BEADRP C[NH+](C)C1CCC([N@@H+]2C[C@H]3[C@H](CF)[C@H]3C2)CC1 ZINC001168327640 964461170 /nfs/dbraw/zinc/46/11/70/964461170.db2.gz QHXBWBCUYMJPCZ-UMHABRDISA-N 2 0 240.366 2.007 20 0 BEADRP CCC1CCC([N@H+]2C[C@H]3C[NH+](C)C[C@H]3C2)CC1 ZINC001256874492 1169842736 /nfs/dbraw/zinc/84/27/36/1169842736.db2.gz BPTBPFABACMYES-HFDVOGEKSA-N 2 0 236.403 2.449 20 0 BEADRP CCC[C@H](C)C[NH2+]CC[C@H](C)[NH+](C)C ZINC000697871975 964598893 /nfs/dbraw/zinc/59/88/93/964598893.db2.gz QGNXHFGYLYAAOF-RYUDHWBXSA-N 2 0 200.370 2.352 20 0 BEADRP Cc1sccc1CNCC[C@H](C)[NH+](C)C ZINC000697887107 964632457 /nfs/dbraw/zinc/63/24/57/964632457.db2.gz DGIKYJPBRCDTPM-JTQLQIEISA-N 2 0 226.389 2.486 20 0 BEADRP Cc1ccccc1C[NH2+]CC[C@@H](C)[NH+](C)C ZINC000697890475 964642697 /nfs/dbraw/zinc/64/26/97/964642697.db2.gz VXKQPKMZBALZOK-CYBMUJFWSA-N 2 0 220.360 2.425 20 0 BEADRP C[N@@H+]1CCC[C@](C)(Nc2cc3[nH]ccc3c[nH+]2)C1 ZINC001162340159 964936666 /nfs/dbraw/zinc/93/66/66/964936666.db2.gz ADTWZCZGISLWTI-AWEZNQCLSA-N 2 0 244.342 2.459 20 0 BEADRP CN(C)c1cc[nH+]c(N[C@]2(C)CCC[N@H+](C)C2)c1 ZINC001162343035 964939668 /nfs/dbraw/zinc/93/96/68/964939668.db2.gz ZYPZTPDQENGQBZ-CQSZACIVSA-N 2 0 248.374 2.044 20 0 BEADRP Cc1cc2[nH+]ccn2cc1N[C@H]1CCC[C@H]([NH3+])C1 ZINC001162400125 964960455 /nfs/dbraw/zinc/96/04/55/964960455.db2.gz GJZOCKBJBPKWDF-RYUDHWBXSA-N 2 0 244.342 2.325 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H](Nc2cccn3c[nH+]cc23)C1 ZINC001162404467 964963876 /nfs/dbraw/zinc/96/38/76/964963876.db2.gz MVTXCIDELWVRIS-GHMZBOCLSA-N 2 0 230.315 2.016 20 0 BEADRP Cc1cc(NC[C@@H]2CCC[NH2+]C[C@H]2C)cc(C)[nH+]1 ZINC001162457463 964983593 /nfs/dbraw/zinc/98/35/93/964983593.db2.gz PHOYEQQGDFQTMT-RISCZKNCSA-N 2 0 247.386 2.168 20 0 BEADRP Cc1c(N)cc[nH+]c1NC[C@H]1CCC[NH2+]C[C@@H]1C ZINC001162454442 964983770 /nfs/dbraw/zinc/98/37/70/964983770.db2.gz OJGIUIPLXKGIGP-CMPLNLGQSA-N 2 0 248.374 2.020 20 0 BEADRP Cc1ccc(C)c(N[C@H]2CC[C@@H]3C[NH2+]C[C@@H]32)[nH+]1 ZINC001163261426 965319240 /nfs/dbraw/zinc/31/92/40/965319240.db2.gz WDHNGMDVBQWJKD-AGIUHOORSA-N 2 0 231.343 2.108 20 0 BEADRP Cc1[nH+]c(NCC2([NH3+])CCC2)cc2[nH]ccc21 ZINC001163327340 965334842 /nfs/dbraw/zinc/33/48/42/965334842.db2.gz XIGZQARVIFIEBM-UHFFFAOYSA-N 2 0 230.315 2.165 20 0 BEADRP C[C@H]1CC[C@@H](CN)[N@@H+]1Cc1cccc2c1CCC2 ZINC001205088607 965690605 /nfs/dbraw/zinc/69/06/05/965690605.db2.gz QPIUMPQFETZGAH-WFASDCNBSA-N 2 0 244.382 2.487 20 0 BEADRP [NH3+][C@@H]1CCC[N@H+](Cc2cccc3[nH]ccc32)CC1 ZINC001205093866 965720192 /nfs/dbraw/zinc/72/01/92/965720192.db2.gz GWKPWIMMGAYMQY-CYBMUJFWSA-N 2 0 243.354 2.481 20 0 BEADRP CN(C)c1ccccc1C[N@@H+]1CCC[C@H]([NH3+])CC1 ZINC001205094898 965735341 /nfs/dbraw/zinc/73/53/41/965735341.db2.gz RIVYKWBAJZCEBF-AWEZNQCLSA-N 2 0 247.386 2.066 20 0 BEADRP Cc1c2[nH+]c[nH]c2ccc1N(CCC[NH3+])C(C)C ZINC001164122454 965743737 /nfs/dbraw/zinc/74/37/37/965743737.db2.gz DJNJCLLPBTZMQT-UHFFFAOYSA-N 2 0 246.358 2.435 20 0 BEADRP CC(C)N(CCC[NH3+])c1cc[nH+]c2c1ccn2C ZINC001164129086 965747847 /nfs/dbraw/zinc/74/78/47/965747847.db2.gz XCGBIDXSORNJDD-UHFFFAOYSA-N 2 0 246.358 2.137 20 0 BEADRP Cc1cc(O)cc(C)c1C[N@@H+]1CCC[C@@H]([NH3+])CC1 ZINC001205102894 965803326 /nfs/dbraw/zinc/80/33/26/965803326.db2.gz VUSDNDJPJBRPOZ-CYBMUJFWSA-N 2 0 248.370 2.322 20 0 BEADRP C[C@H]1C[C@H](C)C[NH+](CC2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000699206721 965817315 /nfs/dbraw/zinc/81/73/15/965817315.db2.gz YXJAWKQNMIICLW-UUQIVFDPSA-N 2 0 236.403 2.495 20 0 BEADRP CC[NH+]1CCC(N(C)c2cc(OC)cc[nH+]2)CC1 ZINC001165068979 965956174 /nfs/dbraw/zinc/95/61/74/965956174.db2.gz PYBXIWZLZIQWPZ-UHFFFAOYSA-N 2 0 249.358 2.011 20 0 BEADRP Cc1c[nH+]c(N2CCC3(CC([NH3+])C3)CC2)cc1C ZINC001165245401 966009173 /nfs/dbraw/zinc/00/91/73/966009173.db2.gz KDYGHXVGYMPQOM-UHFFFAOYSA-N 2 0 245.370 2.406 20 0 BEADRP Cc1cc(NCC[C@H]2CCC[N@@H+](C)C2)cc(C)[nH+]1 ZINC001165278783 966025082 /nfs/dbraw/zinc/02/50/82/966025082.db2.gz LTDAYYUBMVXZGY-CQSZACIVSA-N 2 0 247.386 2.264 20 0 BEADRP Cc1cc(NCC[C@@H]2CCC[N@@H+](C)C2)cc(C)[nH+]1 ZINC001165278777 966025983 /nfs/dbraw/zinc/02/59/83/966025983.db2.gz LTDAYYUBMVXZGY-AWEZNQCLSA-N 2 0 247.386 2.264 20 0 BEADRP [NH3+][C@@]12CCC[C@@H]1C[N@H+](C[C@H]1C[C@H]3C=C[C@@H]1C3)C2 ZINC001235240923 966032106 /nfs/dbraw/zinc/03/21/06/966032106.db2.gz OEWRVDOYZRPXMF-NJVJYBDUSA-N 2 0 232.371 2.012 20 0 BEADRP CC1CC(C[NH2+]C2CCC([NH+](C)C)CC2)C1 ZINC000715273057 966112316 /nfs/dbraw/zinc/11/23/16/966112316.db2.gz VGHIJIYUGZENGZ-UHFFFAOYSA-N 2 0 224.392 2.495 20 0 BEADRP CCC[C@H](C)C[N@H+]1C[C@H]2CC[C@@H](C1)[C@@H]2[NH3+] ZINC001235959465 966179179 /nfs/dbraw/zinc/17/91/79/966179179.db2.gz QAESLDZBYLAQFO-RVMXOQNASA-N 2 0 210.365 2.092 20 0 BEADRP CC1=C[C@H](C)[C@H](C[NH+]2CC(C)(C[NH3+])C2)CC1 ZINC001206711330 966200358 /nfs/dbraw/zinc/20/03/58/966200358.db2.gz IOANHGYCDOROCD-STQMWFEESA-N 2 0 222.376 2.259 20 0 BEADRP CC1=C[C@H](C)[C@@H](C[N@H+]2CC[C@@H]([NH3+])[C@H]2C)CC1 ZINC001205171105 966200407 /nfs/dbraw/zinc/20/04/07/966200407.db2.gz KRNPMNNURRBRGZ-REWJHTLYSA-N 2 0 222.376 2.400 20 0 BEADRP CC(C)[C@H]1CCC[N@@H+]1CC[NH2+]C(C)(C)C ZINC000084125904 966928077 /nfs/dbraw/zinc/92/80/77/966928077.db2.gz AZBWSRWDWJGJMH-GFCCVEGCSA-N 2 0 212.381 2.495 20 0 BEADRP Cc1cc(C[NH+]2C[C@H]3CC[N@@H+](C)C[C@H]3C2)oc1C ZINC001204533269 967027821 /nfs/dbraw/zinc/02/78/21/967027821.db2.gz KBGGOAIOQJJTNP-KGLIPLIRSA-N 2 0 248.370 2.280 20 0 BEADRP C[C@@]1([NH3+])CCN(Cc2cccc3ccoc32)C1 ZINC001204800385 967175998 /nfs/dbraw/zinc/17/59/98/967175998.db2.gz DBSDQPBWCZFQBS-CQSZACIVSA-N 2 0 230.311 2.356 20 0 BEADRP C[C@]1([NH3+])CCN(Cc2cccc3ccoc32)C1 ZINC001204800383 967178501 /nfs/dbraw/zinc/17/85/01/967178501.db2.gz DBSDQPBWCZFQBS-AWEZNQCLSA-N 2 0 230.311 2.356 20 0 BEADRP C[NH+](C)C1CCC([NH2+]C[C@H]2CCCCO2)CC1 ZINC000715571332 967184931 /nfs/dbraw/zinc/18/49/31/967184931.db2.gz HNRCDQLAZSHHJC-JXQTWKCFSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@@H]([NH+](C)C)C2)CCO1 ZINC000715583357 967192316 /nfs/dbraw/zinc/19/23/16/967192316.db2.gz JWTVQZNMMYOURA-XJFOESAGSA-N 2 0 240.391 2.016 20 0 BEADRP COc1cccc(C)c1C[NH+]1CCC(C[NH3+])CC1 ZINC001205047279 967308249 /nfs/dbraw/zinc/30/82/49/967308249.db2.gz TVHRBHPAXUFYFA-UHFFFAOYSA-N 2 0 248.370 2.174 20 0 BEADRP Cc1cc(C[N@@H+]2CCC[C@H]([NH3+])CC2)oc1C ZINC001205094459 967336253 /nfs/dbraw/zinc/33/62/53/967336253.db2.gz MJNQXKQQXTWRHP-LBPRGKRZSA-N 2 0 222.332 2.210 20 0 BEADRP Cc1ccc(CCC[N@@H+]2CCC[C@@H]([NH3+])CC2)o1 ZINC001205093850 967339670 /nfs/dbraw/zinc/33/96/70/967339670.db2.gz GPDBLQUPGYBFRM-CYBMUJFWSA-N 2 0 236.359 2.334 20 0 BEADRP CCOc1ccccc1C[N@@H+]1CCC[C@@H]([NH3+])CC1 ZINC001205095579 967339955 /nfs/dbraw/zinc/33/99/55/967339955.db2.gz ZMHBBPNMLHBJCG-CQSZACIVSA-N 2 0 248.370 2.399 20 0 BEADRP Cc1cccc(C[N@@H+]2CCC[C@H]([NH3+])CC2)c1F ZINC001205103067 967349741 /nfs/dbraw/zinc/34/97/41/967349741.db2.gz XURVOYHCCBIPIA-ZDUSSCGKSA-N 2 0 236.334 2.447 20 0 BEADRP Cc1sccc1C[N@@H+]1CCC[C@@H]([NH3+])CC1 ZINC001205123975 967351022 /nfs/dbraw/zinc/35/10/22/967351022.db2.gz IAYJVZQVNWIHQP-GFCCVEGCSA-N 2 0 224.373 2.370 20 0 BEADRP COc1cc(C[N@@H+]2CCC[C@H]([NH3+])CC2)ccc1C ZINC001205109070 967355041 /nfs/dbraw/zinc/35/50/41/967355041.db2.gz AHAUBAUCSQUAFY-AWEZNQCLSA-N 2 0 248.370 2.317 20 0 BEADRP Cc1cc(C[N@@H+]2CCC[C@@H]([NH3+])CC2)cc(C)n1 ZINC001205116894 967363842 /nfs/dbraw/zinc/36/38/42/967363842.db2.gz IRGUOCRMCZETLG-CQSZACIVSA-N 2 0 233.359 2.012 20 0 BEADRP C[C@H]1C[N@H+](Cc2ccc3occc3c2)C[C@H]1C[NH3+] ZINC001205136280 967381381 /nfs/dbraw/zinc/38/13/81/967381381.db2.gz VIPLXRDAMHAWLK-SMDDNHRTSA-N 2 0 244.338 2.459 20 0 BEADRP C[C@H]1C[N@H+](Cc2ccc(C(C)(C)C)[nH]2)C[C@H]1C[NH3+] ZINC001205136308 967382542 /nfs/dbraw/zinc/38/25/42/967382542.db2.gz XFNBRVMJYHXHKH-NWDGAFQWSA-N 2 0 249.402 2.339 20 0 BEADRP Cc1cc(C[N@H+]2C[C@H](C)[C@H](C[NH3+])C2)c(C)cc1O ZINC001205140468 967385961 /nfs/dbraw/zinc/38/59/61/967385961.db2.gz IGASGRWJWYSSAD-GXTWGEPZSA-N 2 0 248.370 2.036 20 0 BEADRP C[C@@]1([NH3+])CCC[N@H+](CCCc2ccncc2)CC1 ZINC001205257524 967444258 /nfs/dbraw/zinc/44/42/58/967444258.db2.gz WFUIILQEJSQIHB-OAHLLOKOSA-N 2 0 247.386 2.218 20 0 BEADRP C[NH+](C)CCCc1ccccc1C[NH+](C)C ZINC001250161875 967455072 /nfs/dbraw/zinc/45/50/72/967455072.db2.gz HPBDJKGKJGPLTR-UHFFFAOYSA-N 2 0 220.360 2.242 20 0 BEADRP C[C@@]1([NH3+])CCC[N@H+](Cc2cccc(O)c2)CC1 ZINC001205266746 967457524 /nfs/dbraw/zinc/45/75/24/967457524.db2.gz XDPRLQDDQVOWBJ-CQSZACIVSA-N 2 0 234.343 2.096 20 0 BEADRP Cc1ccncc1C[N@@H+]1CCC[C@](C)([NH3+])CC1 ZINC001205273146 967465836 /nfs/dbraw/zinc/46/58/36/967465836.db2.gz GBLATKZTHHJFAH-AWEZNQCLSA-N 2 0 233.359 2.093 20 0 BEADRP C[C@]1([NH3+])CCC[N@H+](CC2OC=CC2=S)CC1 ZINC001205288347 967480829 /nfs/dbraw/zinc/48/08/29/967480829.db2.gz JELXOUNTJHRTGI-LBPRGKRZSA-N 2 0 240.372 2.272 20 0 BEADRP Cc1cc(C)c(C[N@@H+]2CCC[C@](C)([NH3+])CC2)cn1 ZINC001205289214 967482811 /nfs/dbraw/zinc/48/28/11/967482811.db2.gz UZOILGKDWRIMOF-HNNXBMFYSA-N 2 0 247.386 2.402 20 0 BEADRP CS[C@@H]1CCC[C@@H]([NH2+]C2CC([NH+](C)C)C2)C1 ZINC000922213687 967604724 /nfs/dbraw/zinc/60/47/24/967604724.db2.gz DVXRMNBCLAYQSW-IKWCTNDRSA-N 2 0 242.432 2.343 20 0 BEADRP C[C@@H](CC[NH2+][C@H]1CCCOC1)[NH+]1CCCCC1 ZINC001205391964 967617450 /nfs/dbraw/zinc/61/74/50/967617450.db2.gz XXESBNMUZGWNEF-KBPBESRZSA-N 2 0 240.391 2.020 20 0 BEADRP C[C@@H]1CC[N@H+](CC(C)(C)C)CC[C@@H]1C[NH3+] ZINC001205599966 967719451 /nfs/dbraw/zinc/71/94/51/967719451.db2.gz ATMOFOCWWZEMDQ-VXGBXAGGSA-N 2 0 212.381 2.339 20 0 BEADRP Cc1cnccc1C[N@@H+]1CC[C@@H](C[NH3+])[C@@H](C)CC1 ZINC001205602629 967717652 /nfs/dbraw/zinc/71/76/52/967717652.db2.gz KSPGCQQEZVNOMB-JSGCOSHPSA-N 2 0 247.386 2.197 20 0 BEADRP C[C@@H]1CC[N@H+](Cc2ccccc2)CC[C@@H]1C[NH3+] ZINC001205603627 967718389 /nfs/dbraw/zinc/71/83/89/967718389.db2.gz RHXGYYZFKVABAN-UKRRQHHQSA-N 2 0 232.371 2.493 20 0 BEADRP C[C@@H]1CC[N@H+](CCC(F)(F)F)CC[C@@H]1C[NH3+] ZINC001205601786 967718462 /nfs/dbraw/zinc/71/84/62/967718462.db2.gz GKLZGIBPLFDCLZ-NXEZZACHSA-N 2 0 238.297 2.246 20 0 BEADRP CSCCC[N@H+]1CC[C@@H](C[NH3+])[C@@H](C)CC1 ZINC001205603585 967718520 /nfs/dbraw/zinc/71/85/20/967718520.db2.gz QOUFCKSHKPOONP-RYUDHWBXSA-N 2 0 230.421 2.046 20 0 BEADRP CS[C@H](C)CC[N@H+]1CC[C@@H](C[NH3+])[C@@H](C)CC1 ZINC001205602588 967719054 /nfs/dbraw/zinc/71/90/54/967719054.db2.gz KBRQRGRPMILCNH-XQQFMLRXSA-N 2 0 244.448 2.435 20 0 BEADRP C[C@H]1CC[N@H+](CC2CCCC2)CC[C@@H]1C[NH3+] ZINC001205603034 967720714 /nfs/dbraw/zinc/72/07/14/967720714.db2.gz NDLGWDRBHQXXMY-GXTWGEPZSA-N 2 0 224.392 2.483 20 0 BEADRP Cc1cncc(C[N@H+]2CC[C@@H](C)[C@@H](C[NH3+])CC2)c1 ZINC001205617584 967725459 /nfs/dbraw/zinc/72/54/59/967725459.db2.gz LCGYTXNEGSYDRW-UKRRQHHQSA-N 2 0 247.386 2.197 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@@H](C)[C@@H](C[NH3+])CC2)cn1 ZINC001205626317 967735703 /nfs/dbraw/zinc/73/57/03/967735703.db2.gz FQTMEXMALQDEKU-IUODEOHRSA-N 2 0 247.386 2.197 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@@H](C)[C@H](C[NH3+])CC2)cn1 ZINC001205626316 967736936 /nfs/dbraw/zinc/73/69/36/967736936.db2.gz FQTMEXMALQDEKU-DOMZBBRYSA-N 2 0 247.386 2.197 20 0 BEADRP COc1ccc(CN2CC[C@@H](C)[C@@H]([NH3+])C2)c(C)c1 ZINC001205873211 967867937 /nfs/dbraw/zinc/86/79/37/967867937.db2.gz YWWOMEZCUOQSHF-ABAIWWIYSA-N 2 0 248.370 2.173 20 0 BEADRP C[C@@H]1[C@H](C[NH3+])CCC[N@@H+]1CCC(C)(C)C ZINC001205902201 967876861 /nfs/dbraw/zinc/87/68/61/967876861.db2.gz IPVCJWQKXORWNY-NEPJUHHUSA-N 2 0 212.381 2.482 20 0 BEADRP COC(C)(C)CC[N@@H+]1CCC[C@@H](C[NH3+])[C@H](C)C1 ZINC001205981914 967926973 /nfs/dbraw/zinc/92/69/73/967926973.db2.gz JBPQENOEYBIOTN-OLZOCXBDSA-N 2 0 242.407 2.108 20 0 BEADRP C[C@H]1CC[N@H+](CCCC[NH3+])CCC1(F)F ZINC001205982177 967928808 /nfs/dbraw/zinc/92/88/08/967928808.db2.gz LIBFOKIILFYUHU-JTQLQIEISA-N 2 0 220.307 2.093 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@H](C[NH3+])[C@H](C)C2)o1 ZINC001205983919 967932586 /nfs/dbraw/zinc/93/25/86/967932586.db2.gz QGKOCEMIQVKVJL-DGCLKSJQSA-N 2 0 236.359 2.395 20 0 BEADRP C[C@@H]1C[N@H+](CCC(F)(F)F)CCC[C@H]1C[NH3+] ZINC001205984636 967933310 /nfs/dbraw/zinc/93/33/10/967933310.db2.gz SQWMARVTWJOKTJ-ZJUUUORDSA-N 2 0 238.297 2.246 20 0 BEADRP Cc1cc(C)c(C[N@@H+]2CCC[C@H](C[NH3+])[C@H](C)C2)[nH]1 ZINC001205991330 967938311 /nfs/dbraw/zinc/93/83/11/967938311.db2.gz ACJOBCMETNYTFQ-TZMCWYRMSA-N 2 0 249.402 2.438 20 0 BEADRP Cc1ncccc1C[N@@H+]1CCC[C@@H](C[NH3+])[C@H](C)C1 ZINC001205991436 967939965 /nfs/dbraw/zinc/93/99/65/967939965.db2.gz ASKJQXBHIASASS-OCCSQVGLSA-N 2 0 247.386 2.197 20 0 BEADRP Cc1cccc(C[N@@H+]2CCC[C@@H](C[NH3+])[C@@H](C)C2)n1 ZINC001205992542 967941405 /nfs/dbraw/zinc/94/14/05/967941405.db2.gz FFFFWJSCFQMICT-JSGCOSHPSA-N 2 0 247.386 2.197 20 0 BEADRP Cc1cc(C)c(C[N@@H+]2CCC[C@H](C[NH3+])[C@@H](C)C2)[nH]1 ZINC001205991321 967944344 /nfs/dbraw/zinc/94/43/44/967944344.db2.gz ACJOBCMETNYTFQ-GXTWGEPZSA-N 2 0 249.402 2.438 20 0 BEADRP Cc1ncccc1C[N@@H+]1CCC[C@@H](C[NH3+])[C@@H](C)C1 ZINC001205991433 967944923 /nfs/dbraw/zinc/94/49/23/967944923.db2.gz ASKJQXBHIASASS-JSGCOSHPSA-N 2 0 247.386 2.197 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H]1CCc2cc(F)ccc21 ZINC001118122107 968011169 /nfs/dbraw/zinc/01/11/69/968011169.db2.gz PEVZFXNYJIFNEI-YGRLFVJLSA-N 2 0 236.334 2.401 20 0 BEADRP Cc1ccc2[nH]cc(CN3C[C@@H](C)[C@H]([NH3+])C3)c2c1 ZINC001206053210 968018477 /nfs/dbraw/zinc/01/84/77/968018477.db2.gz NPVYZRLVVORMHJ-BXUZGUMPSA-N 2 0 243.354 2.255 20 0 BEADRP C[C@@H]1CCC[N@H+](CC2(F)CC[NH2+]CC2)C[C@H]1C ZINC001206110292 968071498 /nfs/dbraw/zinc/07/14/98/968071498.db2.gz SPFRZHIIOFUONI-CHWSQXEVSA-N 2 0 242.382 2.446 20 0 BEADRP C[C@@]1(C[NH3+])CCC[N@H+](C[C@@H]2CCCCO2)CC1 ZINC001206297261 968204777 /nfs/dbraw/zinc/20/47/77/968204777.db2.gz XAJUKPBXVFTJBG-UONOGXRCSA-N 2 0 240.391 2.006 20 0 BEADRP C[C@]1(C[NH3+])CCC[N@H+](C[C@@H]2CCCCO2)CC1 ZINC001206297258 968207245 /nfs/dbraw/zinc/20/72/45/968207245.db2.gz XAJUKPBXVFTJBG-KBPBESRZSA-N 2 0 240.391 2.006 20 0 BEADRP Cc1ncccc1C[N@@H+]1CCC[C@@](C)(C[NH3+])CC1 ZINC001206304623 968211247 /nfs/dbraw/zinc/21/12/47/968211247.db2.gz NLYMULMZDJNRMT-OAHLLOKOSA-N 2 0 247.386 2.341 20 0 BEADRP Cc1cc2cc(N3CC[C@H]([NH3+])C3)ccc2c[nH+]1 ZINC001164289234 968216368 /nfs/dbraw/zinc/21/63/68/968216368.db2.gz WICRMLJGAYIJDY-ZDUSSCGKSA-N 2 0 227.311 2.081 20 0 BEADRP Cc1ccncc1C[N@@H+]1CCC[C@](C)(C[NH3+])CC1 ZINC001206310830 968218348 /nfs/dbraw/zinc/21/83/48/968218348.db2.gz DAHLHSCCWFBVJI-HNNXBMFYSA-N 2 0 247.386 2.341 20 0 BEADRP CS[C@H](C)CC[N@@H+]1CCCC[C@@](F)(CN)C1 ZINC001206334966 968240774 /nfs/dbraw/zinc/24/07/74/968240774.db2.gz BIVFUTXTSFMPHV-VXGBXAGGSA-N 2 0 248.411 2.281 20 0 BEADRP C[C@]1(C[NH3+])CCCC[N@H+](Cc2cccnc2)C1 ZINC001206541767 968365943 /nfs/dbraw/zinc/36/59/43/968365943.db2.gz JSGSHHSZLKYQKT-CQSZACIVSA-N 2 0 233.359 2.033 20 0 BEADRP C[C@@]1(C[NH3+])CCCC[N@H+](Cc2ccccn2)C1 ZINC001206540179 968368174 /nfs/dbraw/zinc/36/81/74/968368174.db2.gz BAKPKQLVMVHUHE-AWEZNQCLSA-N 2 0 233.359 2.033 20 0 BEADRP Cc1cc(C[N@@H+]2CCCC[C@H](C[NH3+])C2)ccc1O ZINC001206622385 968424649 /nfs/dbraw/zinc/42/46/49/968424649.db2.gz BBENJEMMSLBWDW-CQSZACIVSA-N 2 0 248.370 2.261 20 0 BEADRP C[C@H]1CCCC[N@@H+]1CC(C)(C)C[NH+](C)C ZINC001207276478 968713794 /nfs/dbraw/zinc/71/37/94/968713794.db2.gz XSERGBYWXTZCHD-LBPRGKRZSA-N 2 0 212.381 2.449 20 0 BEADRP CC[C@@H](C)[N@H+](C)CC(C)(C)C[NH+](C)C ZINC001207279385 968714076 /nfs/dbraw/zinc/71/40/76/968714076.db2.gz LGKQPDXVJGACIH-LLVKDONJSA-N 2 0 200.370 2.305 20 0 BEADRP C[NH+](C)CC(C)(C)C[N@H+](C)CCc1cccnc1 ZINC001207285454 968720136 /nfs/dbraw/zinc/72/01/36/968720136.db2.gz KQKGZKPXRHPOBY-UHFFFAOYSA-N 2 0 249.402 2.144 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2CCC[C@H](F)CC2)CC1 ZINC001207392366 968752636 /nfs/dbraw/zinc/75/26/36/968752636.db2.gz ZZXLLFLMQHBXAP-ZDUSSCGKSA-N 2 0 228.355 2.152 20 0 BEADRP c1ccc([C@H]2CC[N@H+]2CC2CC[NH2+]CC2)cc1 ZINC001207439074 968775918 /nfs/dbraw/zinc/77/59/18/968775918.db2.gz KSTBVWUMHDDKEX-OAHLLOKOSA-N 2 0 230.355 2.433 20 0 BEADRP CC[C@@H]1CC[N@H+](CCC2CC[NH+](C)CC2)C1 ZINC001207488049 968802948 /nfs/dbraw/zinc/80/29/48/968802948.db2.gz DDQZNSJANXOYNV-CYBMUJFWSA-N 2 0 224.392 2.450 20 0 BEADRP [NH3+][C@H]1CCC[C@@H](Nc2[nH+]ccc3[nH]ccc32)C1 ZINC001154976999 968828473 /nfs/dbraw/zinc/82/84/73/968828473.db2.gz MHYFJWSJLOYMKR-VHSXEESVSA-N 2 0 230.315 2.245 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]CCC[C@@H]1CCO1 ZINC001207858099 968891538 /nfs/dbraw/zinc/89/15/38/968891538.db2.gz DIQZRZORESEGGJ-UONOGXRCSA-N 2 0 242.407 2.266 20 0 BEADRP CCCC[C@H](C)[NH2+][C@@H]1CC[C@@H]2C[N@H+](C)C[C@H]12 ZINC001207836122 968897058 /nfs/dbraw/zinc/89/70/58/968897058.db2.gz GUTOINZQDWKYHI-RFQIPJPRSA-N 2 0 224.392 2.495 20 0 BEADRP C[NH+]1CCC(C)(C[N@@H+]2CC[C@@](C)(CF)C2)CC1 ZINC001208107907 969000785 /nfs/dbraw/zinc/00/07/85/969000785.db2.gz MEVLHURLISYTHN-AWEZNQCLSA-N 2 0 242.382 2.400 20 0 BEADRP C[NH+]1CCC(C)(C[N@@H+]2CCC[C@@H]3C[C@@H]32)CC1 ZINC001208110477 969005204 /nfs/dbraw/zinc/00/52/04/969005204.db2.gz DJWGWUVPHLZBFF-OLZOCXBDSA-N 2 0 222.376 2.203 20 0 BEADRP C[NH+]1CCC(C)(C[NH+]2CC3CC(C3)C2)CC1 ZINC001208110467 969007089 /nfs/dbraw/zinc/00/70/89/969007089.db2.gz DFLJEGYEGMULHS-UHFFFAOYSA-N 2 0 222.376 2.060 20 0 BEADRP CS[C@@H](C)CC[NH+]1CCC(C[NH+](C)C)CC1 ZINC001208144369 969066885 /nfs/dbraw/zinc/06/68/85/969066885.db2.gz XJESXIKFLXGRIF-LBPRGKRZSA-N 2 0 244.448 2.402 20 0 BEADRP C[C@@H]([NH3+])c1cccc(C2=CCC[N@H+](C)C2)c1 ZINC001241570825 969068242 /nfs/dbraw/zinc/06/82/42/969068242.db2.gz OCEPQELISFDSRF-LLVKDONJSA-N 2 0 216.328 2.425 20 0 BEADRP C[NH+](C)CC1(C[NH+]2CC(C)(C)C2)CCCC1 ZINC001208182381 969113276 /nfs/dbraw/zinc/11/32/76/969113276.db2.gz OBFGMLIGASWVSD-UHFFFAOYSA-N 2 0 224.392 2.450 20 0 BEADRP CSCC[N@H+](C)CC1(C[NH+](C)C)CCCC1 ZINC001208187832 969118868 /nfs/dbraw/zinc/11/88/68/969118868.db2.gz PFBYIZGPTFAZIH-UHFFFAOYSA-N 2 0 244.448 2.403 20 0 BEADRP C[NH+](C)CC1(C[NH+]2CC3CC(C3)C2)CCCC1 ZINC001208186969 969118935 /nfs/dbraw/zinc/11/89/35/969118935.db2.gz CYOKEOPDYRLQGT-UHFFFAOYSA-N 2 0 236.403 2.450 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2C[C@@H](C)[C@@H](F)C2)CC1 ZINC001208592479 969146671 /nfs/dbraw/zinc/14/66/71/969146671.db2.gz JDRVXAXZTWLBQM-YPMHNXCESA-N 2 0 228.355 2.008 20 0 BEADRP C[C@H]1C[N@H+](C[C@@H]2CCC[NH+](C)C2)CCC1(F)F ZINC001208609273 969149147 /nfs/dbraw/zinc/14/91/47/969149147.db2.gz ZYJZLEJZRJHNIO-NWDGAFQWSA-N 2 0 246.345 2.305 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2CC[C@@H](C)[C@H](F)C2)CC1 ZINC001208592025 969149133 /nfs/dbraw/zinc/14/91/33/969149133.db2.gz BATLXMGYRLGXNN-TZMCWYRMSA-N 2 0 242.382 2.398 20 0 BEADRP CC[NH+]1CCC(C[N@H+](C)C2CC(F)(F)C2)CC1 ZINC001208595207 969151789 /nfs/dbraw/zinc/15/17/89/969151789.db2.gz SEBHQHLLVDQBEQ-UHFFFAOYSA-N 2 0 246.345 2.448 20 0 BEADRP CC[NH+]1CCC(C[NH+]2CC3CC(C3)C2)CC1 ZINC001208602592 969154504 /nfs/dbraw/zinc/15/45/04/969154504.db2.gz JEXKASDPYUDVAR-UHFFFAOYSA-N 2 0 222.376 2.060 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH+]2CCC[C@@H](F)CC2)C1 ZINC001208608845 969166721 /nfs/dbraw/zinc/16/67/21/969166721.db2.gz XCVFBYCEANEECL-CHWSQXEVSA-N 2 0 228.355 2.152 20 0 BEADRP CC[N@H+]1C[C@@H]2C[NH+](CCCC(C)C)C[C@@H]2C1 ZINC001208737759 969225669 /nfs/dbraw/zinc/22/56/69/969225669.db2.gz ZZNVXJRNMSEDCP-OKILXGFUSA-N 2 0 224.392 2.306 20 0 BEADRP C[C@H]1C[N@H+](Cc2cccc(O)c2)CCC[C@@H]1C[NH3+] ZINC001205994857 969250599 /nfs/dbraw/zinc/25/05/99/969250599.db2.gz MRXXEWXQTKUXRF-GXTWGEPZSA-N 2 0 248.370 2.199 20 0 BEADRP CC1C[NH+](C[C@@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC001208946522 969311356 /nfs/dbraw/zinc/31/13/56/969311356.db2.gz HSGMGKVWQJZALZ-MRXNPFEDSA-N 2 0 244.382 2.460 20 0 BEADRP CCOC(C)(C)C[N@H+](CC)CCC[NH+](C)C ZINC001209076542 969348855 /nfs/dbraw/zinc/34/88/55/969348855.db2.gz NLMNRMAAJQDZQL-UHFFFAOYSA-N 2 0 230.396 2.075 20 0 BEADRP Cc1cccnc1C[N@@H+]1CCC[C@H](C[NH3+])[C@H](C)C1 ZINC001205996550 969352416 /nfs/dbraw/zinc/35/24/16/969352416.db2.gz XEXVYGVTGIQLPQ-ZIAGYGMSSA-N 2 0 247.386 2.197 20 0 BEADRP CN1CCC([N@H+](C)CCCc2cccnc2)CC1 ZINC001209171919 969369521 /nfs/dbraw/zinc/36/95/21/969369521.db2.gz FJFXTZDRNLQCBB-UHFFFAOYSA-N 2 0 247.386 2.040 20 0 BEADRP CCC[C@H](C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169099620 969391819 /nfs/dbraw/zinc/39/18/19/969391819.db2.gz CPXDLEUJNIEIRU-RVMXOQNASA-N 2 0 210.365 2.390 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]C(C1CC1)C1CC1)C2 ZINC001169098163 969392373 /nfs/dbraw/zinc/39/23/73/969392373.db2.gz GHMNZECHUHLJQE-ZSOGYDGISA-N 2 0 234.387 2.390 20 0 BEADRP CC[C@H](C)C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169078821 969397942 /nfs/dbraw/zinc/39/79/42/969397942.db2.gz HNSQLEUDVURXFO-RVMXOQNASA-N 2 0 210.365 2.247 20 0 BEADRP C[C@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccncc1 ZINC001169080442 969401825 /nfs/dbraw/zinc/40/18/25/969401825.db2.gz NMYGGOLFSINENC-MHEUCROKSA-N 2 0 245.370 2.357 20 0 BEADRP CC1CC(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3C)C1 ZINC001169079749 969402822 /nfs/dbraw/zinc/40/28/22/969402822.db2.gz LAKULXNWGDZRAG-MOIJGLSHSA-N 2 0 222.376 2.247 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H](NC(=[NH2+])C(C)(C)C)C2 ZINC001169081520 969404039 /nfs/dbraw/zinc/40/40/39/969404039.db2.gz SHASHOSWQOJNJO-RTCCRHLQSA-N 2 0 223.364 2.225 20 0 BEADRP CC(C)[C@H](C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169080946 969404733 /nfs/dbraw/zinc/40/47/33/969404733.db2.gz NYAKOTKWVZUILG-RVMXOQNASA-N 2 0 210.365 2.246 20 0 BEADRP CC1CC[NH+]([C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3C)CC1 ZINC001169125268 969424109 /nfs/dbraw/zinc/42/41/09/969424109.db2.gz XSJFPIJDTYLEML-BTTYYORXSA-N 2 0 222.376 2.344 20 0 BEADRP CC1CC[NH+]([C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3C)CC1 ZINC001169125269 969426811 /nfs/dbraw/zinc/42/68/11/969426811.db2.gz XSJFPIJDTYLEML-WDNDVIMCSA-N 2 0 222.376 2.344 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CCC[C@@H](F)CC1)C2 ZINC001169124922 969428270 /nfs/dbraw/zinc/42/82/70/969428270.db2.gz HDTROSXKIQMMOY-YIYPIFLZSA-N 2 0 240.366 2.436 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CC3(CCC3)C1)C2 ZINC001169131182 969442434 /nfs/dbraw/zinc/44/24/34/969442434.db2.gz REISESMQUMFHCL-ITGUQSILSA-N 2 0 220.360 2.098 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H](N1Cc3ccncc3C1)C2 ZINC001169142319 969451780 /nfs/dbraw/zinc/45/17/80/969451780.db2.gz TUBQULHGCYYCIX-QDMKHBRRSA-N 2 0 243.354 2.022 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CCC3(CCC3)C1)C2 ZINC001169146442 969468004 /nfs/dbraw/zinc/46/80/04/969468004.db2.gz PPFQJBLAOFVQOQ-WDNDVIMCSA-N 2 0 234.387 2.488 20 0 BEADRP C[C@H]([NH3+])c1ccn(-c2ccccc2C(C)(C)[NH3+])n1 ZINC001169234018 969516194 /nfs/dbraw/zinc/51/61/94/969516194.db2.gz DHBMAJVFYRCOQE-JTQLQIEISA-N 2 0 244.342 2.086 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH2+]C(C)(C)c2cccnc2)CC1 ZINC001254498160 969657659 /nfs/dbraw/zinc/65/76/59/969657659.db2.gz TXYZGSVAIPFSED-CQSZACIVSA-N 2 0 247.386 2.391 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH+]2CCCC23CC3)CC1 ZINC001254515719 969688700 /nfs/dbraw/zinc/68/87/00/969688700.db2.gz BHWDFPVYUPVLDB-LBPRGKRZSA-N 2 0 208.349 2.099 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH+]2CCCC23CC3)CC1 ZINC001254515718 969692013 /nfs/dbraw/zinc/69/20/13/969692013.db2.gz BHWDFPVYUPVLDB-GFCCVEGCSA-N 2 0 208.349 2.099 20 0 BEADRP C[N@H+](C[C@@H]1CC1(C)C)[C@@H]1CCC[NH+](C)CC1 ZINC001254524849 969694252 /nfs/dbraw/zinc/69/42/52/969694252.db2.gz CVKZBRJJLWACKF-QWHCGFSZSA-N 2 0 224.392 2.449 20 0 BEADRP CCC/C=C/c1cc(N2CC[NH2+]CC2)cc[nH+]1 ZINC001242254559 969695492 /nfs/dbraw/zinc/69/54/92/969695492.db2.gz RLTQNAUINXJRNB-SNAWJCMRSA-N 2 0 231.343 2.305 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH+]2Cc3ccccc3C2)CC1 ZINC001254517286 969703027 /nfs/dbraw/zinc/70/30/27/969703027.db2.gz UAKUVHOZBPAMSB-HNNXBMFYSA-N 2 0 230.355 2.487 20 0 BEADRP C[N@H+](C1CCCC1)[C@@H]1CCC[NH+](C)CC1 ZINC001254524594 969713319 /nfs/dbraw/zinc/71/33/19/969713319.db2.gz XJXSHMLPJFIALP-CYBMUJFWSA-N 2 0 210.365 2.345 20 0 BEADRP C[C@@H]1C[C@H](C)C[N@H+]([C@@H]2CCC[NH+](C)CC2)C1 ZINC001254524910 969719897 /nfs/dbraw/zinc/71/98/97/969719897.db2.gz DQWJPHYCYNZQFJ-HZSPNIEDSA-N 2 0 224.392 2.449 20 0 BEADRP [NH3+]Cc1ccn(-c2ccc(C3([NH3+])CCC3)cc2)c1 ZINC001169725652 969818545 /nfs/dbraw/zinc/81/85/45/969818545.db2.gz ISGFCSQQDHNAIP-UHFFFAOYSA-N 2 0 241.338 2.274 20 0 BEADRP [NH3+]CCC1CCC([NH2+]C2CCSCC2)CC1 ZINC001255084213 969917527 /nfs/dbraw/zinc/91/75/27/969917527.db2.gz CCOXGZIHOQQYIJ-UHFFFAOYSA-N 2 0 242.432 2.379 20 0 BEADRP C[C@@H](CC[NH+]1CC(C[NH3+])C1)CC(C)(C)C ZINC001210545127 969933100 /nfs/dbraw/zinc/93/31/00/969933100.db2.gz NYZJFRKNWBUDQB-NSHDSACASA-N 2 0 212.381 2.339 20 0 BEADRP CCCC[N@H+](C)CCC[NH2+][C@@H]1CCSC1 ZINC001255269084 970019930 /nfs/dbraw/zinc/01/99/30/970019930.db2.gz YCGWLDOLAGCAEJ-GFCCVEGCSA-N 2 0 230.421 2.204 20 0 BEADRP CN(c1ccccc1C(C)(C)[NH3+])C(C)(C)C[NH3+] ZINC001170059162 970109129 /nfs/dbraw/zinc/10/91/29/970109129.db2.gz AZYKNCXJRJGZIT-UHFFFAOYSA-N 2 0 235.375 2.054 20 0 BEADRP CN(c1cc[nH+]c(C2CC2)c1)C(C)(C)C[NH3+] ZINC001170059232 970111702 /nfs/dbraw/zinc/11/17/02/970111702.db2.gz CRBCUTMUPKSQAK-UHFFFAOYSA-N 2 0 219.332 2.133 20 0 BEADRP CCCC[C@H](C)[NH+]1C[C@@H]2C[NH+](CC)C[C@H]2C1 ZINC001255334042 970114185 /nfs/dbraw/zinc/11/41/85/970114185.db2.gz KXGLLGPODUIAFA-IHRRRGAJSA-N 2 0 224.392 2.449 20 0 BEADRP C[N@@H+]1CC[C@H](n2cc(CC[NH3+])c3ccccc32)C1 ZINC001255412195 970132811 /nfs/dbraw/zinc/13/28/11/970132811.db2.gz GKNULJKXHHANQI-ZDUSSCGKSA-N 2 0 243.354 2.019 20 0 BEADRP COc1c[nH+]ccc1Nc1cc(C)cc(C)n1 ZINC001211257250 970202945 /nfs/dbraw/zinc/20/29/45/970202945.db2.gz GNERQTKHNKBPED-UHFFFAOYSA-N 2 0 229.283 2.268 20 0 BEADRP CC(C)Oc1cc[nH+]c(NC2(C)CC[NH2+]CC2)c1 ZINC001157401312 970249733 /nfs/dbraw/zinc/24/97/33/970249733.db2.gz CIJHDQIGWXUOJY-UHFFFAOYSA-N 2 0 249.358 2.423 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C(C)(C)CC[NH+](C)C)C1 ZINC001170100912 970290044 /nfs/dbraw/zinc/29/00/44/970290044.db2.gz MUOQWQFZWFXMHG-NEPJUHHUSA-N 2 0 212.381 2.495 20 0 BEADRP C[C@H]1C[N@H+](CCC2CCCC2)CC[C@@H]1C[NH3+] ZINC000300719217 970299093 /nfs/dbraw/zinc/29/90/93/970299093.db2.gz AUMLOZMBKJYSCR-GXTWGEPZSA-N 2 0 224.392 2.483 20 0 BEADRP COC[C@H](C)[NH2+][C@@H]1CC(C)(C)C[C@](C)(C[NH3+])C1 ZINC001255559969 970338363 /nfs/dbraw/zinc/33/83/63/970338363.db2.gz LAONCNLQOUOAPX-OUCADQQQSA-N 2 0 242.407 2.155 20 0 BEADRP COC[C@H](C)[NH2+][C@H]1CC(C)(C)C[C@](C)(C[NH3+])C1 ZINC001255559971 970341214 /nfs/dbraw/zinc/34/12/14/970341214.db2.gz LAONCNLQOUOAPX-SGMGOOAPSA-N 2 0 242.407 2.155 20 0 BEADRP CCC(CC)[NH+]1CCC([NH2+][C@@H](C)COC)CC1 ZINC001255563268 970348824 /nfs/dbraw/zinc/34/88/24/970348824.db2.gz LAKHXHALVJBFJI-LBPRGKRZSA-N 2 0 242.407 2.264 20 0 BEADRP CC(C)[NH+]1CC(Nc2[nH+]ccc3[nH]ccc32)C1 ZINC001157525499 970409311 /nfs/dbraw/zinc/40/93/11/970409311.db2.gz DGSDIFWAUMCMSR-UHFFFAOYSA-N 2 0 230.315 2.067 20 0 BEADRP C[C@@H]([NH3+])c1nccn1C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001255661887 970444241 /nfs/dbraw/zinc/44/42/41/970444241.db2.gz DWPHZWXIDWHONC-FKJOKYEKSA-N 2 0 248.374 2.091 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)[C@H]1CC[C@@H](C)C1 ZINC001170156374 970483874 /nfs/dbraw/zinc/48/38/74/970483874.db2.gz DUDNIHKFWMOWPX-OLZOCXBDSA-N 2 0 212.381 2.449 20 0 BEADRP CC[C@H]1C[C@@H]([NH2+]C(C)(C)CC[NH+](C)C)CCO1 ZINC001170176044 970549010 /nfs/dbraw/zinc/54/90/10/970549010.db2.gz OUIBNYHZJGVCHM-STQMWFEESA-N 2 0 242.407 2.264 20 0 BEADRP CC[C@@H]1C[C@H]([NH2+]Cc2ccccc2C[NH3+])CCO1 ZINC001170181158 970553521 /nfs/dbraw/zinc/55/35/21/970553521.db2.gz DZOZLSDNRXZWRH-HUUCEWRRSA-N 2 0 248.370 2.193 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]CCCC[NH+](C)C ZINC001255939152 970562659 /nfs/dbraw/zinc/56/26/59/970562659.db2.gz CMYJQOAACKGPLS-AWEZNQCLSA-N 2 0 243.439 2.038 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+][C@H](C)C1CC[NH2+]CC1 ZINC000400335793 970579852 /nfs/dbraw/zinc/57/98/52/970579852.db2.gz FYIWMLOGRPXATH-SDDRHHMPSA-N 2 0 212.381 2.399 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+][C@@H]1CC1(C)C ZINC001255948178 970581344 /nfs/dbraw/zinc/58/13/44/970581344.db2.gz GRJUMIRHSWVGTJ-NWDGAFQWSA-N 2 0 212.381 2.495 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[N@H+](CC)CC(C)(C)O ZINC001255968496 970604047 /nfs/dbraw/zinc/60/40/47/970604047.db2.gz ZUPBQIAOFHAHTO-CYBMUJFWSA-N 2 0 244.423 2.200 20 0 BEADRP C[NH+]1CC(CNc2cc(OC(C)(C)C)cc[nH+]2)C1 ZINC001170257910 970638467 /nfs/dbraw/zinc/63/84/67/970638467.db2.gz COEMKCSZEJYMEU-UHFFFAOYSA-N 2 0 249.358 2.232 20 0 BEADRP C(CC1CCC1)[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000400961312 970647243 /nfs/dbraw/zinc/64/72/43/970647243.db2.gz ISLRZWQQFPOTBT-BFHYXJOUSA-N 2 0 222.376 2.154 20 0 BEADRP C[C@H]1CCC[N@@H+](C2CCN(C)CC2)C[C@H]1C ZINC001256202666 970701513 /nfs/dbraw/zinc/70/15/13/970701513.db2.gz KIUSKNXULFYMNS-QWHCGFSZSA-N 2 0 224.392 2.449 20 0 BEADRP C[C@H]1CC[N@@H+](C2CCN(C)CC2)[C@@H](C)C1 ZINC001256207344 970708168 /nfs/dbraw/zinc/70/81/68/970708168.db2.gz FNLVBRDAKALFDE-RYUDHWBXSA-N 2 0 210.365 2.201 20 0 BEADRP C[C@H]1CCC[N@@H+](C2CCN(C)CC2)[C@H]1C ZINC001256207230 970710783 /nfs/dbraw/zinc/71/07/83/970710783.db2.gz DAHXUSYAADEEHS-RYUDHWBXSA-N 2 0 210.365 2.201 20 0 BEADRP CC(C)[C@@H]1CCC[N@@H+]1C1CCN(C)CC1 ZINC001256211037 970719618 /nfs/dbraw/zinc/71/96/18/970719618.db2.gz QFUCFJVSAVNRHH-ZDUSSCGKSA-N 2 0 210.365 2.201 20 0 BEADRP Cc1cccc(C[NH+]2CCC(F)(C[NH3+])CC2)c1 ZINC001222532332 972549389 /nfs/dbraw/zinc/54/93/89/972549389.db2.gz KRQGSWADRGAMNL-UHFFFAOYSA-N 2 0 236.334 2.258 20 0 BEADRP Cc1ccc(C[NH+]2CCC(F)(C[NH3+])CC2)s1 ZINC001222533058 972552376 /nfs/dbraw/zinc/55/23/76/972552376.db2.gz RREGBLVJONNTJC-UHFFFAOYSA-N 2 0 242.363 2.319 20 0 BEADRP CSCC[C@H](C)[N@@H+]1CCC[C@](F)(C[NH3+])CC1 ZINC001246549575 972695441 /nfs/dbraw/zinc/69/54/41/972695441.db2.gz MMYXUUXDALAISA-NWDGAFQWSA-N 2 0 248.411 2.281 20 0 BEADRP C[C@@]1([NH3+])CCC[N@@H+]([C@@H]2CCCSC2)CC1 ZINC001246554029 972745816 /nfs/dbraw/zinc/74/58/16/972745816.db2.gz USEODRNRKORXQE-VXGBXAGGSA-N 2 0 228.405 2.085 20 0 BEADRP C[C@@H](C[C@H]1CCCCC[NH2+]1)[NH2+]C1(C)CC1 ZINC001327837745 972747044 /nfs/dbraw/zinc/74/70/44/972747044.db2.gz BKAPGOSCLNPDDR-NWDGAFQWSA-N 2 0 210.365 2.439 20 0 BEADRP CCCCC[C@@H](C)[N@@H+]1CCCC[C@@](O)(C[NH3+])C1 ZINC001246557971 972777930 /nfs/dbraw/zinc/77/79/30/972777930.db2.gz JSJXMZXCRKBYJE-ZIAGYGMSSA-N 2 0 242.407 2.131 20 0 BEADRP CCC(CC)[N@@H+]1CCC[C@H](C[NH3+])[C@@H](C)C1 ZINC001246570827 972845169 /nfs/dbraw/zinc/84/51/69/972845169.db2.gz WAOYUPUOOVKNMF-NWDGAFQWSA-N 2 0 212.381 2.482 20 0 BEADRP C[C@@H]1CC[C@@H](C[NH3+])C[N@@H+]1[C@H]1C[C@@H]2[C@H](C1)C2(C)C ZINC001246594975 973007660 /nfs/dbraw/zinc/00/76/60/973007660.db2.gz WWVVEEDDQJDVLW-XHJNMGKDSA-N 2 0 236.403 2.480 20 0 BEADRP C[NH2+]CC1C[NH+]([C@@H](C)CCC=C(C)C)C1 ZINC001246598347 973015686 /nfs/dbraw/zinc/01/56/86/973015686.db2.gz NZSBAMVGJVMBHC-LBPRGKRZSA-N 2 0 210.365 2.273 20 0 BEADRP CC1(C)CC[C@@H]([N@@H+]2C[C@H]3CCC[NH2+][C@H]3C2)C1 ZINC001246658267 973071303 /nfs/dbraw/zinc/07/13/03/973071303.db2.gz QAAUZYSTLBVUID-UPJWGTAASA-N 2 0 222.376 2.249 20 0 BEADRP CC(C)C[C@H](C)C[C@H](C)[N@H+]1C[C@@H]2[C@H]([NH3+])[C@@H]2C1 ZINC001246666662 973076170 /nfs/dbraw/zinc/07/61/70/973076170.db2.gz WVMYHYMFPFBHBB-YHQUGGNUSA-N 2 0 224.392 2.336 20 0 BEADRP CC(C)C1CCC([N@@H+]2C[C@@H]3C[NH2+]CC[C@@H]32)CC1 ZINC001246677674 973080312 /nfs/dbraw/zinc/08/03/12/973080312.db2.gz WWEBOSCGNKFHHB-SHWKFHJASA-N 2 0 236.403 2.495 20 0 BEADRP CCC1CCC([N@@H+]2C[C@@H]3CC[C@]3([NH3+])C2)CC1 ZINC001246860290 973165452 /nfs/dbraw/zinc/16/54/52/973165452.db2.gz MBBOTDGVSZQUBK-YIOUJQMASA-N 2 0 222.376 2.378 20 0 BEADRP CCC1CCC([N@@H+]2C[C@H]3CC[C@]3([NH3+])C2)CC1 ZINC001246860165 973172827 /nfs/dbraw/zinc/17/28/27/973172827.db2.gz MBBOTDGVSZQUBK-HHTDUIENSA-N 2 0 222.376 2.378 20 0 BEADRP CC(C)CC[C@@H](C)N1C[C@H]2CC[C@@H](C1)[NH2+]C2 ZINC001246866315 973221046 /nfs/dbraw/zinc/22/10/46/973221046.db2.gz JFMTWUSJTMIABR-RDBSUJKOSA-N 2 0 224.392 2.495 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]Cc1cncc2ccccc21 ZINC001328677466 973259567 /nfs/dbraw/zinc/25/95/67/973259567.db2.gz OXYLNXWPOWQZQD-LBPRGKRZSA-N 2 0 243.354 2.180 20 0 BEADRP C1[NH2+][C@H]2C[N@@H+](C3CCC4(CCCC4)CC3)C[C@@H]12 ZINC001246913955 973442436 /nfs/dbraw/zinc/44/24/36/973442436.db2.gz BQANWVOZPFQZJG-OCCSQVGLSA-N 2 0 234.387 2.393 20 0 BEADRP Cc1c2[nH+]c[nH]c2ccc1NC[C@@H]1CCCC[NH2+]1 ZINC001171333486 973857213 /nfs/dbraw/zinc/85/72/13/973857213.db2.gz DZJDQLKUILNARL-NSHDSACASA-N 2 0 244.342 2.425 20 0 BEADRP [NH3+][C@H]1CCc2c1cccc2NC[C@@H]1CCCC[NH2+]1 ZINC001171334854 973869274 /nfs/dbraw/zinc/86/92/74/973869274.db2.gz KLXXGOSZMWXKGK-FZMZJTMJSA-N 2 0 245.370 2.187 20 0 BEADRP CC(C)([NH3+])c1ccccc1NC[C@@H]1CCCC[NH2+]1 ZINC001171335676 973878959 /nfs/dbraw/zinc/87/89/59/973878959.db2.gz QJDGNMZUXLTNHS-LBPRGKRZSA-N 2 0 247.386 2.434 20 0 BEADRP CC(C)C[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172100268 974344445 /nfs/dbraw/zinc/34/44/45/974344445.db2.gz NZDICZAMGZSOLY-CLLJXQQHSA-N 2 0 210.365 2.247 20 0 BEADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1ccncc1)C2 ZINC001172100334 974345208 /nfs/dbraw/zinc/34/52/08/974345208.db2.gz OXMBSJBPIAMXID-QKDCVEJESA-N 2 0 245.370 2.187 20 0 BEADRP CCCOCC[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172104285 974366930 /nfs/dbraw/zinc/36/69/30/974366930.db2.gz DTUZQCDTTRGJRD-ZSOGYDGISA-N 2 0 240.391 2.018 20 0 BEADRP C[C@H]([NH3+])c1ccn([C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)n1 ZINC001172106284 974370491 /nfs/dbraw/zinc/37/04/91/974370491.db2.gz OUWSTKBOCHXQDI-WUHRBBMRSA-N 2 0 248.374 2.091 20 0 BEADRP CN1[C@@H]2CCC[C@H]1C[C@H]([N@H+](C)CC1CC1)C2 ZINC001172115708 974378212 /nfs/dbraw/zinc/37/82/12/974378212.db2.gz ZAJZZLPKKACMRZ-BTTYYORXSA-N 2 0 222.376 2.344 20 0 BEADRP CC1(C)C[C@@H]([NH2+]C2CCC(CC[NH3+])CC2)CO1 ZINC001172278616 974490316 /nfs/dbraw/zinc/49/03/16/974490316.db2.gz JBHBVYPYRSQEPI-WXRRBKDZSA-N 2 0 240.391 2.051 20 0 BEADRP CCCCCC[C@H](CCC)[NH2+]C[C@H](O)C[NH3+] ZINC001172379219 974586259 /nfs/dbraw/zinc/58/62/59/974586259.db2.gz SEHFZEBJFJVBAT-QWHCGFSZSA-N 2 0 230.396 2.035 20 0 BEADRP CC[C@@H](C)OCC[C@@H](C)[NH2+]C[C@@H]1CC[N@H+](C)C1 ZINC001172346509 974593817 /nfs/dbraw/zinc/59/38/17/974593817.db2.gz CLAYFPBLKAVOLF-MCIONIFRSA-N 2 0 242.407 2.121 20 0 BEADRP CC[C@@H](C)OCC[C@H](C)[NH2+]C[C@@H]1CC[N@H+](C)C1 ZINC001172346512 974595489 /nfs/dbraw/zinc/59/54/89/974595489.db2.gz CLAYFPBLKAVOLF-MJBXVCDLSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+][C@@H]2CCC[C@@H]2[NH3+])C[C@@H]1C ZINC001172366649 974646986 /nfs/dbraw/zinc/64/69/86/974646986.db2.gz GVVMRKSATKDHTQ-RXGFPQBGSA-N 2 0 210.365 2.281 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]Cc1cccc(C)c1 ZINC001331417480 974712170 /nfs/dbraw/zinc/71/21/70/974712170.db2.gz BJDUPXGPDCDXAW-LBPRGKRZSA-N 2 0 206.333 2.083 20 0 BEADRP CC[C@H](CC(C)C)[N@H+]1C[C@H]2C[NH+](C)C[C@H]2C1 ZINC001172399311 974758136 /nfs/dbraw/zinc/75/81/36/974758136.db2.gz BMLGWVFMQQMYTB-HZSPNIEDSA-N 2 0 224.392 2.305 20 0 BEADRP CC(C)OCC[C@H](C)[NH2+][C@H]1CCC[N@H+](C)CC1 ZINC001172437788 974793545 /nfs/dbraw/zinc/79/35/45/974793545.db2.gz JGKDOPFLVYICLU-KBPBESRZSA-N 2 0 242.407 2.264 20 0 BEADRP CC(C)OCC[C@@H](C)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC001172439081 974796350 /nfs/dbraw/zinc/79/63/50/974796350.db2.gz XSMKMYPTGNXKDR-KGLIPLIRSA-N 2 0 242.407 2.121 20 0 BEADRP CC(C)COCC[C@H](C)[NH+]1CCC(C)([NH3+])CC1 ZINC001172461408 974826538 /nfs/dbraw/zinc/82/65/38/974826538.db2.gz GLFKKGCAHNDOFY-ZDUSSCGKSA-N 2 0 242.407 2.251 20 0 BEADRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]Cc1ccc2c(c1)CCC2 ZINC001331822591 974828650 /nfs/dbraw/zinc/82/86/50/974828650.db2.gz SGRHECQTYYNBQQ-HZPDHXFCSA-N 2 0 244.382 2.392 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H]1CC(C)(C)C[C@@H]1C ZINC001331836975 974832691 /nfs/dbraw/zinc/83/26/91/974832691.db2.gz YHEPXTGLEPLSEF-TUAOUCFPSA-N 2 0 212.381 2.399 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H]1CC(C)(C)C[C@H]1C ZINC001331836976 974833125 /nfs/dbraw/zinc/83/31/25/974833125.db2.gz YHEPXTGLEPLSEF-UTUOFQBUSA-N 2 0 212.381 2.399 20 0 BEADRP CO[C@@H]1CCC[C@@H]([NH2+]CCCCC[NH+](C)C)C1 ZINC001172917522 974966169 /nfs/dbraw/zinc/96/61/69/974966169.db2.gz NINMRWKJFJDKAZ-ZIAGYGMSSA-N 2 0 242.407 2.266 20 0 BEADRP CO[C@@H]1CCC[C@@H]([NH2+][C@@H]2CCC[N@H+](C)CC2)C1 ZINC001172923981 974972849 /nfs/dbraw/zinc/97/28/49/974972849.db2.gz OWKCIVFUIUJUFF-MGPQQGTHSA-N 2 0 240.391 2.018 20 0 BEADRP CO[C@H]1CCC[C@H]([NH2+]CC[C@H]2CCC[N@@H+]2C)C1 ZINC001172927773 974974207 /nfs/dbraw/zinc/97/42/07/974974207.db2.gz ZVVKNMNPDNLSKX-MJBXVCDLSA-N 2 0 240.391 2.018 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)[C@H]1CCC[C@H](OC)C1 ZINC001172951533 975005853 /nfs/dbraw/zinc/00/58/53/975005853.db2.gz RGOGUERIASWQJG-KBPBESRZSA-N 2 0 242.407 2.218 20 0 BEADRP CC(C)CC[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000297643132 975053436 /nfs/dbraw/zinc/05/34/36/975053436.db2.gz XNRDWTALCAAKKT-UHFFFAOYSA-N 2 0 217.316 2.470 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+][C@H]1CC[NH2+]C12CCCC2 ZINC001332421409 975094375 /nfs/dbraw/zinc/09/43/75/975094375.db2.gz PREMKJCDHOMIFY-WOPDTQHZSA-N 2 0 208.349 2.049 20 0 BEADRP CCc1ccc(C[C@@H](C)[NH2+]C2CC([NH3+])C2)cc1 ZINC001173237818 975158861 /nfs/dbraw/zinc/15/88/61/975158861.db2.gz FGICKVIRYVILAR-VCANKDNSSA-N 2 0 232.371 2.259 20 0 BEADRP CCSC[C@@H](C)[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC001173293201 975168273 /nfs/dbraw/zinc/16/82/73/975168273.db2.gz YQNWEHVLURYLST-CHWSQXEVSA-N 2 0 244.448 2.450 20 0 BEADRP CC[C@@H]1CC[C@H]([N@@H+]2C[C@H]3CC[NH+](C)C[C@H]3C2)C1 ZINC001173278792 975236403 /nfs/dbraw/zinc/23/64/03/975236403.db2.gz FPGXTCFGWRPXFZ-KBXIAJHMSA-N 2 0 236.403 2.449 20 0 BEADRP CC[C@@H]1CC[C@H]([NH+]2C[C@H]3C[NH+](CC)C[C@@H]3C2)C1 ZINC001173282509 975238858 /nfs/dbraw/zinc/23/88/58/975238858.db2.gz GWSGTUNOXMNYNU-TUVASFSCSA-N 2 0 236.403 2.449 20 0 BEADRP CCSC[C@@H](C)[NH2+]CCC1CC[NH+](C)CC1 ZINC001173288796 975253943 /nfs/dbraw/zinc/25/39/43/975253943.db2.gz ZURFFIBFAWRSDJ-GFCCVEGCSA-N 2 0 244.448 2.450 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@H]2CC23CCC3)CC1 ZINC000721224537 975363048 /nfs/dbraw/zinc/36/30/48/975363048.db2.gz MVIAPHFVWXZIQI-ZDUSSCGKSA-N 2 0 222.376 2.391 20 0 BEADRP Cc1sccc1C[N@H+]1CC[C@@H](F)[C@@H]([NH3+])CC1 ZINC001206200438 975375386 /nfs/dbraw/zinc/37/53/86/975375386.db2.gz RPYGJNMGQYKAIO-NEPJUHHUSA-N 2 0 242.363 2.318 20 0 BEADRP C[C@@H](c1cccc(O[C@H]2CC[N@H+](C)C2)c1)[NH+](C)C ZINC001229625596 976917580 /nfs/dbraw/zinc/91/75/80/976917580.db2.gz IDQDXBKJMSGZLZ-WFASDCNBSA-N 2 0 248.370 2.392 20 0 BEADRP CCC[C@H](C)[N@@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC000429015168 976979969 /nfs/dbraw/zinc/97/99/69/976979969.db2.gz XGDYMJUCCIUBIY-QWHCGFSZSA-N 2 0 210.365 2.203 20 0 BEADRP C[N@@H+]1CCC[C@H]2CN(c3cc[nH+]cc3)CC[C@H]21 ZINC001336391777 977655820 /nfs/dbraw/zinc/65/58/20/977655820.db2.gz NFGAWVRZIADVHU-GXTWGEPZSA-N 2 0 231.343 2.002 20 0 BEADRP CN(C)c1cc(Nc2ccc(C[NH3+])cc2)cc[nH+]1 ZINC001175966266 977836504 /nfs/dbraw/zinc/83/65/04/977836504.db2.gz MFASROCITRXJSB-UHFFFAOYSA-N 2 0 242.326 2.350 20 0 BEADRP CC(C)[N@H+](CCCO)Cc1cc2c[nH+]ccc2[nH]1 ZINC001232013931 977837504 /nfs/dbraw/zinc/83/75/04/977837504.db2.gz IDESGJSDJSZVSM-UHFFFAOYSA-N 2 0 247.342 2.156 20 0 BEADRP Cc1cc(C)[nH+]c(N2C[C@H](C[NH3+])CC[C@H]2C)c1 ZINC000721831033 978042913 /nfs/dbraw/zinc/04/29/13/978042913.db2.gz SYHDOVJHJRSFHJ-OLZOCXBDSA-N 2 0 233.359 2.262 20 0 BEADRP Cc1cc(C)[nH+]c(N2C[C@@H](C[NH3+])CC[C@H]2C)c1 ZINC000721831025 978047014 /nfs/dbraw/zinc/04/70/14/978047014.db2.gz SYHDOVJHJRSFHJ-CHWSQXEVSA-N 2 0 233.359 2.262 20 0 BEADRP c1cc(NC2CC[NH+](C3CCCC3)CC2)cc[nH+]1 ZINC001336909760 978047802 /nfs/dbraw/zinc/04/78/02/978047802.db2.gz PJCVMJVAJSZLDR-UHFFFAOYSA-N 2 0 245.370 2.322 20 0 BEADRP C[C@]1(C[NH3+])CCC[N@H+](CC2CCC2)CC1 ZINC001206292493 978283204 /nfs/dbraw/zinc/28/32/04/978283204.db2.gz CBAKLTCCZIDPKF-ZDUSSCGKSA-N 2 0 210.365 2.237 20 0 BEADRP Cc1ccnc(N[C@@H]2CC[C@@H]3C[N@@H+](C)C[C@@H]23)c1 ZINC001337432177 978333366 /nfs/dbraw/zinc/33/33/66/978333366.db2.gz QNETWCAWPSZYDO-JHJVBQTASA-N 2 0 231.343 2.142 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC001337805556 978505462 /nfs/dbraw/zinc/50/54/62/978505462.db2.gz NFYZBQQHUOKNKX-WOPDTQHZSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@@H](C)[NH2+][C@@]12CC[C@@]([NH2+]C)(C1)CCC2 ZINC001277807806 978695851 /nfs/dbraw/zinc/69/58/51/978695851.db2.gz QQOGGQMAELTCEB-UPJWGTAASA-N 2 0 210.365 2.439 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2C[C@H](C)C[C@@H]2C)CC1 ZINC001179898651 978781351 /nfs/dbraw/zinc/78/13/51/978781351.db2.gz RKRJEWMOMYGVLV-OLZOCXBDSA-N 2 0 224.392 2.449 20 0 BEADRP Cc1cc(C)c(C[N@@H+]2CCC3(C[NH2+]C3)C2)cc1C ZINC001235023974 978954511 /nfs/dbraw/zinc/95/45/11/978954511.db2.gz IFOBSIVKXUSOPU-UHFFFAOYSA-N 2 0 244.382 2.407 20 0 BEADRP CC(C)c1ccc(CC[N@H+]2C[C@@H]3[C@@H]([NH3+])[C@@H]3C2)cc1 ZINC001235210960 978999422 /nfs/dbraw/zinc/99/94/22/978999422.db2.gz RTGBHRBRVUASHG-ZSHCYNCHSA-N 2 0 244.382 2.241 20 0 BEADRP CC1=CC[C@@H](CC[N@H+]2C[C@@H]3[C@@H]([NH3+])[C@@H]3C2)C1(C)C ZINC001235209967 979001386 /nfs/dbraw/zinc/00/13/86/979001386.db2.gz GTSSRNQIZOKSQN-IGQOVBAYSA-N 2 0 234.387 2.258 20 0 BEADRP Cc1cccc(CCN2C[C@H]3CCC[C@@]3([NH3+])C2)c1 ZINC001235239077 979002600 /nfs/dbraw/zinc/00/26/00/979002600.db2.gz FAROOMZARVPLCF-HZPDHXFCSA-N 2 0 244.382 2.351 20 0 BEADRP CC1=C[C@H](C)[C@H](C[N@@H+]2C[C@H]3C[NH2+]CC[C@H]32)CC1 ZINC001235256771 979009375 /nfs/dbraw/zinc/00/93/75/979009375.db2.gz GQMUBVNKTKODFG-BYNSBNAKSA-N 2 0 234.387 2.273 20 0 BEADRP CC(C)c1ccc(CC[N@H+]2C[C@@H]3[C@H]([NH3+])[C@@H]3C2)cc1 ZINC001235283923 979018300 /nfs/dbraw/zinc/01/83/00/979018300.db2.gz RTGBHRBRVUASHG-MUJYYYPQSA-N 2 0 244.382 2.241 20 0 BEADRP CCC(CC)C[N@@H+]1CC[C@]2(C1)C[NH2+]CC[C@H]2F ZINC001235404156 979037173 /nfs/dbraw/zinc/03/71/73/979037173.db2.gz MTHQUWHGGKRQOU-ZIAGYGMSSA-N 2 0 242.382 2.446 20 0 BEADRP C[C@@H]1CCC[N@H+](CC[C@H]2COC(C)(C)N2)[C@H]1C ZINC001235694712 979123276 /nfs/dbraw/zinc/12/32/76/979123276.db2.gz ITAFKYVRPPQQCB-AGIUHOORSA-N 2 0 240.391 2.221 20 0 BEADRP C(C1CCCCC1)[N@@H+]1CCCC2(C[NH2+]C2)C1 ZINC001235711885 979127898 /nfs/dbraw/zinc/12/78/98/979127898.db2.gz UKBVMSUDKCRHLI-UHFFFAOYSA-N 2 0 222.376 2.252 20 0 BEADRP [NH3+]CC[C@@H]1CCC[N@@H+]1Cc1cccc2c1CCC2 ZINC001235925654 979207918 /nfs/dbraw/zinc/20/79/18/979207918.db2.gz NPORQIXNGOLJFE-HNNXBMFYSA-N 2 0 244.382 2.489 20 0 BEADRP CCc1cccc(C[N@H+]2C[C@H]3CC[C@@H](C2)[C@@H]3[NH3+])c1 ZINC001235958672 979225617 /nfs/dbraw/zinc/22/56/17/979225617.db2.gz AXPREJXAPVBPBH-MUJYYYPQSA-N 2 0 244.382 2.418 20 0 BEADRP [NH3+][C@]12CC[C@@H]1C[N@H+](CCCC1CCCC1)C2 ZINC001235979956 979235875 /nfs/dbraw/zinc/23/58/75/979235875.db2.gz OWEGJMGHCIYZIY-KGLIPLIRSA-N 2 0 222.376 2.380 20 0 BEADRP [NH3+][C@@]12CC[C@@H]1C[N@H+](CCC1CCCCC1)C2 ZINC001235981869 979241037 /nfs/dbraw/zinc/24/10/37/979241037.db2.gz YHJYLFCVUTWSDR-ZIAGYGMSSA-N 2 0 222.376 2.380 20 0 BEADRP C[C@H](C[N@@H+]1C[C@H]2CC[C@]2([NH3+])C1)c1ccccc1 ZINC001235976610 979246384 /nfs/dbraw/zinc/24/63/84/979246384.db2.gz AJMBNGWFBNUNCJ-YUELXQCFSA-N 2 0 230.355 2.213 20 0 BEADRP Cc1ccc(CN2C[C@H]3CC[C@@H](C2)[NH2+]C3)cc1C ZINC001236059830 979346846 /nfs/dbraw/zinc/34/68/46/979346846.db2.gz MXPWUECPNPLQHH-HOTGVXAUSA-N 2 0 244.382 2.487 20 0 BEADRP C[C@H](CN1C[C@H]2CC[C@@H](C1)[NH2+]C2)c1ccccc1 ZINC001236059492 979350327 /nfs/dbraw/zinc/35/03/27/979350327.db2.gz IWDUIJUBWJZREL-YCPHGPKFSA-N 2 0 244.382 2.474 20 0 BEADRP Cc1cccc(CN2C[C@H]3CC[C@@H](C2)[NH2+]C3)c1C ZINC001236060420 979350563 /nfs/dbraw/zinc/35/05/63/979350563.db2.gz QDJKGBRHGDTJHN-HOCLYGCPSA-N 2 0 244.382 2.487 20 0 BEADRP CCc1cccc(CN2CCC[NH2+][C@@H](C)C2)c1 ZINC001236094827 979384744 /nfs/dbraw/zinc/38/47/44/979384744.db2.gz JWNOPHTWAQBLSV-ZDUSSCGKSA-N 2 0 232.371 2.433 20 0 BEADRP CC/C=C\CC[N@H+]1C[C@@H]2CC[NH2+]CC[C@@H]2C1 ZINC001236315010 979526378 /nfs/dbraw/zinc/52/63/78/979526378.db2.gz UPYMQNGUSGCMAK-LQOBQMSGSA-N 2 0 222.376 2.274 20 0 BEADRP Cc1cc(C[N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)oc1C ZINC001236317316 979529722 /nfs/dbraw/zinc/52/97/22/979529722.db2.gz VTPXGFCOQZQHMK-OKILXGFUSA-N 2 0 248.370 2.328 20 0 BEADRP C[NH+](C)Cc1cccc(-c2ccc(C[NH3+])nc2)c1 ZINC001236420094 979589658 /nfs/dbraw/zinc/58/96/58/979589658.db2.gz XVXSIPMWLJZXFA-UHFFFAOYSA-N 2 0 241.338 2.269 20 0 BEADRP CC[NH+]1CCC(C[NH2+]CC2CC(C)C2)CC1 ZINC001183035703 979708122 /nfs/dbraw/zinc/70/81/22/979708122.db2.gz JLJSXZHVTVOLKZ-UHFFFAOYSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@]1([NH3+])CCC[N@H+](CCc2ccccc2)CC1 ZINC001205257161 979755884 /nfs/dbraw/zinc/75/58/84/979755884.db2.gz SWFAARYPYKHJKR-HNNXBMFYSA-N 2 0 232.371 2.432 20 0 BEADRP C[C@]1([NH3+])CCC[N@H+](C[C@H]2C[C@H]3C=C[C@@H]2C3)CC1 ZINC001205257238 979757775 /nfs/dbraw/zinc/75/77/75/979757775.db2.gz UQGWMVJBVZGARO-YJNKXOJESA-N 2 0 234.387 2.402 20 0 BEADRP CCOC(C)(C)C[N@@H+]1CCC[C@](C)([NH3+])CC1 ZINC001205257946 979781172 /nfs/dbraw/zinc/78/11/72/979781172.db2.gz ZGBCFUPYURGRBO-ZDUSSCGKSA-N 2 0 228.380 2.005 20 0 BEADRP Cc1cc(C[N@@H+]2CCC[C@@](C)([NH3+])CC2)ccc1O ZINC001205273061 979833358 /nfs/dbraw/zinc/83/33/58/979833358.db2.gz DDYGHGOLPAJYIB-OAHLLOKOSA-N 2 0 248.370 2.404 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+][C@H]1COC(C)(C)C1 ZINC001184417509 980080670 /nfs/dbraw/zinc/08/06/70/980080670.db2.gz DZIZSBVRDFQWNK-QWHCGFSZSA-N 2 0 242.407 2.264 20 0 BEADRP C[C@H]1CCC[N@@H+]1Cc1cccc2cncn21 ZINC001238104719 980158044 /nfs/dbraw/zinc/15/80/44/980158044.db2.gz YVETUDQNQPEYGO-NSHDSACASA-N 2 0 215.300 2.319 20 0 BEADRP c1cc(C2=CCC[NH2+]CC2)ncc1[C@H]1CCC[NH2+]1 ZINC001238936149 980374285 /nfs/dbraw/zinc/37/42/85/980374285.db2.gz MHGSGMPCNCBRNL-CQSZACIVSA-N 2 0 243.354 2.273 20 0 BEADRP C[NH2+]Cc1cccc(CC[NH+]2CCCCC2)c1 ZINC001250242352 980382791 /nfs/dbraw/zinc/38/27/91/980382791.db2.gz XCNGTNAQOVFYML-UHFFFAOYSA-N 2 0 232.371 2.434 20 0 BEADRP COc1cc(C[NH2+][C@@H](C)CCC[NH3+])ccc1F ZINC001345105726 980550570 /nfs/dbraw/zinc/55/05/70/980550570.db2.gz SSCMFEQNEXMXDK-JTQLQIEISA-N 2 0 240.322 2.051 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@H](C)CCC(C)C ZINC001345469982 980615384 /nfs/dbraw/zinc/61/53/84/980615384.db2.gz MNVMCAAXIUNEJW-NWDGAFQWSA-N 2 0 200.370 2.399 20 0 BEADRP C[NH+](C)Cc1ccccc1-c1cc(C[NH3+])ccn1 ZINC001239679929 980838849 /nfs/dbraw/zinc/83/88/49/980838849.db2.gz GBQOQJUOPFGSSC-UHFFFAOYSA-N 2 0 241.338 2.269 20 0 BEADRP CC(C)([NH3+])c1ccccc1-c1cncc(C[NH3+])c1 ZINC001239806722 980945339 /nfs/dbraw/zinc/94/53/39/980945339.db2.gz JCVJIPXTVJCAML-UHFFFAOYSA-N 2 0 241.338 2.401 20 0 BEADRP [NH3+]Cc1cncc(-c2ccc3c(c2)[C@H]([NH3+])CC3)c1 ZINC001239809890 980952236 /nfs/dbraw/zinc/95/22/36/980952236.db2.gz ZVEMFUIDKFCUMB-OAHLLOKOSA-N 2 0 239.322 2.153 20 0 BEADRP CCCCC[N@H+]1CC[C@@H](C[NH3+])[C@@H](C)CC1 ZINC001205602647 981163835 /nfs/dbraw/zinc/16/38/35/981163835.db2.gz KXRDNHFAAANRKN-STQMWFEESA-N 2 0 212.381 2.483 20 0 BEADRP CN(CC1([NH+](C)C)CCC1)c1cc[nH+]cc1 ZINC001347783338 981171346 /nfs/dbraw/zinc/17/13/46/981171346.db2.gz AHSVYEZBHMFATO-UHFFFAOYSA-N 2 0 219.332 2.002 20 0 BEADRP CCOC(C)(C)C[N@H+]1CC[C@@H](C[NH3+])[C@@H](C)CC1 ZINC001205604857 981180394 /nfs/dbraw/zinc/18/03/94/981180394.db2.gz YFIVJSRBGHOIRV-STQMWFEESA-N 2 0 242.407 2.108 20 0 BEADRP CCOC(C)(C)C[N@@H+]1CC[C@@H](C)[C@H](C[NH3+])CC1 ZINC001205604855 981182521 /nfs/dbraw/zinc/18/25/21/981182521.db2.gz YFIVJSRBGHOIRV-OLZOCXBDSA-N 2 0 242.407 2.108 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]Cc1cnc2ccccc2c1 ZINC001348516881 981381731 /nfs/dbraw/zinc/38/17/31/981381731.db2.gz WNIAZRVSMLGPGY-LBPRGKRZSA-N 2 0 243.354 2.180 20 0 BEADRP c1cnc(C2=CCC[NH2+]C2)c(C[NH+]2CCCC2)c1 ZINC001240656538 981566355 /nfs/dbraw/zinc/56/63/55/981566355.db2.gz DVXHAZVTLMLRGE-UHFFFAOYSA-N 2 0 243.354 2.054 20 0 BEADRP C[NH+](C)CCOc1ccccc1C1=CCC[NH2+]C1 ZINC001240665783 981575210 /nfs/dbraw/zinc/57/52/10/981575210.db2.gz YAKUTXSLMGGOTN-UHFFFAOYSA-N 2 0 246.354 2.004 20 0 BEADRP CC[NH+](CC)Cc1cncc(C2=CCC[NH2+]C2)c1 ZINC001240668772 981577595 /nfs/dbraw/zinc/57/75/95/981577595.db2.gz AYJBXIFSFIFAGE-UHFFFAOYSA-N 2 0 245.370 2.300 20 0 BEADRP CCCN1CCC[C@H]1C[NH2+]CC1(OC)CCC1 ZINC001349623229 981599413 /nfs/dbraw/zinc/59/94/13/981599413.db2.gz BJYDPASPFYJBIV-ZDUSSCGKSA-N 2 0 240.391 2.020 20 0 BEADRP c1cc(CCC[NH2+]C2CC[NH2+]CC2)cs1 ZINC001580887719 981708070 /nfs/dbraw/zinc/70/80/70/981708070.db2.gz FPLWUDPUZZVEOW-UHFFFAOYSA-N 2 0 224.373 2.022 20 0 BEADRP Cc1ccccc1NC(=[NH2+])NCC(C)(C)[NH+](C)C ZINC001349910802 981812415 /nfs/dbraw/zinc/81/24/15/981812415.db2.gz MOTZZQPCBGKLSZ-UHFFFAOYSA-N 2 0 248.374 2.271 20 0 BEADRP Cc1ccccc1NC(=[NH2+])NCC[NH2+]C(C)(C)C ZINC001349911618 981813601 /nfs/dbraw/zinc/81/36/01/981813601.db2.gz PTYJKDZXSIUFPQ-UHFFFAOYSA-N 2 0 248.374 2.319 20 0 BEADRP CCC[C@H](C)[NH2+]C1CC[NH+](CCCOC)CC1 ZINC000159117152 981828124 /nfs/dbraw/zinc/82/81/24/981828124.db2.gz JMCPZKZSGFZQSN-ZDUSSCGKSA-N 2 0 242.407 2.266 20 0 BEADRP CC[NH2+]C1CCC(C)([NH+]2CCCC2)CC1 ZINC001350086898 981865885 /nfs/dbraw/zinc/86/58/85/981865885.db2.gz WJAMJGZMKQBDSC-UHFFFAOYSA-N 2 0 210.365 2.393 20 0 BEADRP CO[C@@H]1CC[C@H]([NH2+][C@H]2C[C@H]([NH3+])CC(C)(C)C2)C1 ZINC001350955161 982132965 /nfs/dbraw/zinc/13/29/65/982132965.db2.gz GSNVDRTZKXVUMO-ZDEQEGDKSA-N 2 0 240.391 2.050 20 0 BEADRP C[C@@H]1CC[C@@H](C[NH3+])N(CCCC(F)(F)F)C1 ZINC001205807290 982574333 /nfs/dbraw/zinc/57/43/33/982574333.db2.gz ZNIQEHYDLXCXPS-ZJUUUORDSA-N 2 0 238.297 2.388 20 0 BEADRP C[N@@H+]1CCC=C(c2ccc([C@H]3CCC[NH2+]3)cn2)C1 ZINC001241565023 982806224 /nfs/dbraw/zinc/80/62/24/982806224.db2.gz FOIWIDFWDMFROD-CQSZACIVSA-N 2 0 243.354 2.225 20 0 BEADRP C[NH2+]Cc1ccccc1C1=CCC[N@H+](C)C1 ZINC001241572459 982825544 /nfs/dbraw/zinc/82/55/44/982825544.db2.gz XDHPWTDAKSPQFV-UHFFFAOYSA-N 2 0 216.328 2.125 20 0 BEADRP CC[N@@H+]1C[C@@H](C)N(c2cc[nH+]cc2)C[C@H]1C ZINC001354019632 983117464 /nfs/dbraw/zinc/11/74/64/983117464.db2.gz UBOVYSZGSRIGEY-VXGBXAGGSA-N 2 0 219.332 2.001 20 0 BEADRP CNc1ccc(C[N@@H+]2CCC[C@H](C[NH3+])[C@H]2C)cc1 ZINC001205915862 983184443 /nfs/dbraw/zinc/18/44/43/983184443.db2.gz RBYAWNMQBBDWMW-TZMCWYRMSA-N 2 0 247.386 2.288 20 0 BEADRP CC[NH2+][C@@H](C)c1cccc(C[NH+](C)C)c1 ZINC001354204985 983192904 /nfs/dbraw/zinc/19/29/04/983192904.db2.gz MPTLIOJYMUHGMO-NSHDSACASA-N 2 0 206.333 2.419 20 0 BEADRP C[NH+](C)C[C@@]12C[C@@H]1C[N@H+](CC1CCCCC1)C2 ZINC001201401270 983200669 /nfs/dbraw/zinc/20/06/69/983200669.db2.gz FXYOLLPMLMRTDK-HUUCEWRRSA-N 2 0 236.403 2.450 20 0 BEADRP [NH3+]Cc1ccc(C2=C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC001242021693 983229882 /nfs/dbraw/zinc/22/98/82/983229882.db2.gz VJKHXODBNHXRBX-KGLIPLIRSA-N 2 0 214.312 2.053 20 0 BEADRP CCC[C@H](C)C[N@H+](C)C1CCN(C)CC1 ZINC001201534745 983288461 /nfs/dbraw/zinc/28/84/61/983288461.db2.gz QKMRVUOXDPCRHC-LBPRGKRZSA-N 2 0 212.381 2.449 20 0 BEADRP CCC[N@H+]1C[C@@H]2C[NH+](C[C@H](C)CC)C[C@@H]2C1 ZINC001201516846 983313492 /nfs/dbraw/zinc/31/34/92/983313492.db2.gz DMKPZFXLMQXTJJ-MCIONIFRSA-N 2 0 224.392 2.306 20 0 BEADRP CCC[N@H+]1C[C@@H]2C[C@@H](CN(Cc3ccco3)C2)C1 ZINC001201642347 983399782 /nfs/dbraw/zinc/39/97/82/983399782.db2.gz VIHIYHVKTJWHAQ-OKILXGFUSA-N 2 0 248.370 2.443 20 0 BEADRP CCC[NH+]1C[C@H]2C[NH+](CCCSC)C[C@@H]2C1 ZINC001201697882 983410828 /nfs/dbraw/zinc/41/08/28/983410828.db2.gz RYEJOWLTQPRQJM-STQMWFEESA-N 2 0 242.432 2.013 20 0 BEADRP CCCC[NH+]1C[C@@H]2C[NH+](CCC)C[C@H]2C1 ZINC001201717228 983424507 /nfs/dbraw/zinc/42/45/07/983424507.db2.gz GUDVYAPPAJVZHF-STQMWFEESA-N 2 0 210.365 2.060 20 0 BEADRP CCCCC[N@H+]1C[C@H]2C[NH+](CC)C[C@H]2C1 ZINC001201744293 983447442 /nfs/dbraw/zinc/44/74/42/983447442.db2.gz GFAUXWGPMLPOKI-BETUJISGSA-N 2 0 210.365 2.060 20 0 BEADRP C[NH+]1CCC(C2CC[NH+](CC3CC3)CC2)CC1 ZINC001201932860 983504064 /nfs/dbraw/zinc/50/40/64/983504064.db2.gz XRXYGCQNIOQNMV-UHFFFAOYSA-N 2 0 236.403 2.450 20 0 BEADRP Cc1cnccc1O[C@@H]1CC[N@H+](CC2CC2)C1 ZINC001201952031 983519020 /nfs/dbraw/zinc/51/90/20/983519020.db2.gz GBPDSGOBESXJGX-CYBMUJFWSA-N 2 0 232.327 2.253 20 0 BEADRP CC[N@H+](CC1CCC1)C1CCN(C)CC1 ZINC001202739345 984209355 /nfs/dbraw/zinc/20/93/55/984209355.db2.gz HGRLDIFNBBOYDU-UHFFFAOYSA-N 2 0 210.365 2.203 20 0 BEADRP CCCCC[C@H](O)C[NH2+]CC(C)(C)C[NH+](C)C ZINC001253555307 984210514 /nfs/dbraw/zinc/21/05/14/984210514.db2.gz YKNHUSUMAYNVJJ-ZDUSSCGKSA-N 2 0 244.423 2.105 20 0 BEADRP CSCCC[N@@H+]1CCC[C@@H](C[NH3+])[C@@H](C)C1 ZINC001205984586 984217429 /nfs/dbraw/zinc/21/74/29/984217429.db2.gz SJLDELXFGLMRQL-RYUDHWBXSA-N 2 0 230.421 2.046 20 0 BEADRP C[C@@H]1C[N@H+](CC2CCCC2)CCC[C@@H]1C[NH3+] ZINC001205985019 984220154 /nfs/dbraw/zinc/22/01/54/984220154.db2.gz VBHBJELQMSVOCA-TZMCWYRMSA-N 2 0 224.392 2.483 20 0 BEADRP C[NH2+]Cc1cccc(-c2cc(N)c(C)c[nH+]2)c1 ZINC001242994673 984359529 /nfs/dbraw/zinc/35/95/29/984359529.db2.gz ONJCDSYUVMFCJT-UHFFFAOYSA-N 2 0 227.311 2.359 20 0 BEADRP C[NH2+]Cc1cccc(-c2ncc(C)cc2C[NH3+])c1 ZINC001242994978 984359829 /nfs/dbraw/zinc/35/98/29/984359829.db2.gz XLOMAVUSIHQEIY-UHFFFAOYSA-N 2 0 241.338 2.235 20 0 BEADRP [NH3+]C1(c2ccc(C3=CC[NH2+]C3)cc2)CCC1 ZINC001243110195 984564405 /nfs/dbraw/zinc/56/44/05/984564405.db2.gz CCDYOIDANPDFON-UHFFFAOYSA-N 2 0 214.312 2.011 20 0 BEADRP C[C@H]1C[C@@H]1C[NH+]1CCC2(CC[N@H+](C)C2)CC1 ZINC001276031484 984790929 /nfs/dbraw/zinc/79/09/29/984790929.db2.gz HRLNDIDBRFKFLV-QWHCGFSZSA-N 2 0 222.376 2.060 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H]1CCO[C@@H](c2ccccc2)C1 ZINC001256799569 984840978 /nfs/dbraw/zinc/84/09/78/984840978.db2.gz VFPQOPOZDXYIDU-VHDGCEQUSA-N 2 0 248.370 2.091 20 0 BEADRP CCO[C@@H]1CCC[C@@H]([NH2+][C@@H]2CCCC[C@H]2[NH3+])C1 ZINC001578098124 984847609 /nfs/dbraw/zinc/84/76/09/984847609.db2.gz SAAVJWNNDJMPJW-AAVRWANBSA-N 2 0 240.391 2.194 20 0 BEADRP CCO[C@@H]1CCC[C@H]1[NH2+]Cc1cccc(C[NH3+])c1 ZINC001578151476 984857068 /nfs/dbraw/zinc/85/70/68/984857068.db2.gz MLHRCXSLJSDXCJ-HUUCEWRRSA-N 2 0 248.370 2.193 20 0 BEADRP CCCC[C@H](CC)[N@H+]1C[C@H]2C[NH+](C)C[C@H]2C1 ZINC001257424429 984981167 /nfs/dbraw/zinc/98/11/67/984981167.db2.gz DYLYVBPKKZMYFK-MJBXVCDLSA-N 2 0 224.392 2.449 20 0 BEADRP C[NH+](C)C1CC[NH+](C2CCCCC2)CC1 ZINC001257455109 985052086 /nfs/dbraw/zinc/05/20/86/985052086.db2.gz YLACZDBDWQECLE-UHFFFAOYSA-N 2 0 210.365 2.345 20 0 BEADRP CCC(C)(C)CC[NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23 ZINC000686307628 985106680 /nfs/dbraw/zinc/10/66/80/985106680.db2.gz ZAHOVVDQGWYJQX-MEBFFEOJSA-N 2 0 236.403 2.399 20 0 BEADRP Cn1cccc1C[N@H+](C)Cc1cccc(C[NH3+])c1 ZINC001578493096 985122470 /nfs/dbraw/zinc/12/24/70/985122470.db2.gz DCHKOUSNDVJFFB-UHFFFAOYSA-N 2 0 243.354 2.116 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H]1C[C@@H]2CC[C@@H](C2)C1 ZINC001578572032 985204859 /nfs/dbraw/zinc/20/48/59/985204859.db2.gz ZUYDHGFEXUQMEJ-FVCCEPFGSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H](Cc1ccco1)[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000155906220 985241627 /nfs/dbraw/zinc/24/16/27/985241627.db2.gz IXQPFNUDQZJJIQ-MGPQQGTHSA-N 2 0 248.370 2.427 20 0 BEADRP C[C@H](Cc1ccco1)[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000155906407 985241979 /nfs/dbraw/zinc/24/19/79/985241979.db2.gz IXQPFNUDQZJJIQ-HZSPNIEDSA-N 2 0 248.370 2.427 20 0 BEADRP C[NH2+]CCC[N@H+](C)CC12CCC(CC1)C2 ZINC001578687453 985299228 /nfs/dbraw/zinc/29/92/28/985299228.db2.gz PJICJHVYLBVWCW-UHFFFAOYSA-N 2 0 210.365 2.108 20 0 BEADRP CNc1ccc(C)cc1C[NH2+][C@@H](C)C[C@@H](C)[NH3+] ZINC001578757609 985328876 /nfs/dbraw/zinc/32/88/76/985328876.db2.gz UUDQPNOPIMLVDT-NEPJUHHUSA-N 2 0 235.375 2.252 20 0 BEADRP CC(C)=CCC[C@H](C)NC(=[NH2+])SCC[NH3+] ZINC001258075542 985381308 /nfs/dbraw/zinc/38/13/08/985381308.db2.gz COSBJGQHWKHDNI-JTQLQIEISA-N 2 0 229.393 2.338 20 0 BEADRP CO[C@@H](C)C[N@H+](CCCCCC[NH3+])C(C)C ZINC000688042007 985511902 /nfs/dbraw/zinc/51/19/02/985511902.db2.gz TXLIEXUJDCHBDM-ZDUSSCGKSA-N 2 0 230.396 2.251 20 0 BEADRP COC[C@H](CC(C)(C)C)[NH2+][C@@H]1CC[NH2+][C@@H](C)C1 ZINC001578960533 985581881 /nfs/dbraw/zinc/58/18/81/985581881.db2.gz JJXRHMYIUFZZHL-XQQFMLRXSA-N 2 0 242.407 2.168 20 0 BEADRP COC[C@H](CC(C)(C)C)[NH2+][C@H](C)CCC[NH3+] ZINC001578960919 985582097 /nfs/dbraw/zinc/58/20/97/985582097.db2.gz QHDFCLXZWSXXTL-NEPJUHHUSA-N 2 0 230.396 2.155 20 0 BEADRP C(=C/C1CC[NH2+]CC1)\c1cccc2c1CC[NH2+]C2 ZINC001243897350 985582062 /nfs/dbraw/zinc/58/20/62/985582062.db2.gz WNQACLDJXYOOST-SNAWJCMRSA-N 2 0 242.366 2.345 20 0 BEADRP C[C@@H](Cc1ccco1)[NH+]1CC2(C1)CC[NH+](C)CC2 ZINC001258196796 985590509 /nfs/dbraw/zinc/59/05/09/985590509.db2.gz ZZDCCUNFVQNGBA-ZDUSSCGKSA-N 2 0 248.370 2.238 20 0 BEADRP c1cc2c(c(C3=C[NH2+]CCC3)c1)CC[NH2+]C2 ZINC001243949835 985641051 /nfs/dbraw/zinc/64/10/51/985641051.db2.gz JWERSNJIAIYMHU-UHFFFAOYSA-N 2 0 214.312 2.057 20 0 BEADRP COCCCC[N@@H+]1CCCC[C@]12CCC[NH2+]C2 ZINC001579013288 985668617 /nfs/dbraw/zinc/66/86/17/985668617.db2.gz ZFOPVUMPNMNZHX-CQSZACIVSA-N 2 0 240.391 2.021 20 0 BEADRP CSCC[NH+]1CCC2(CCC[C@@H]2C[NH3+])CC1 ZINC001579374884 985864578 /nfs/dbraw/zinc/86/45/78/985864578.db2.gz YBGVPHYCKMHPIN-GFCCVEGCSA-N 2 0 242.432 2.190 20 0 BEADRP C[C@@H]([NH2+]C1CC2(C[NH2+]C2)C1)c1ccc(F)cc1 ZINC001579414762 985885892 /nfs/dbraw/zinc/88/58/92/985885892.db2.gz NEUMIDUHANEOOP-SNVBAGLBSA-N 2 0 234.318 2.228 20 0 BEADRP CCC[C@H]1CCC[N@@H+]1CCn1ccnc1C ZINC001460900130 985930771 /nfs/dbraw/zinc/93/07/71/985930771.db2.gz LSYFIQGOAJLMPI-ZDUSSCGKSA-N 2 0 221.348 2.456 20 0 BEADRP CCC[N@H+]1C[C@@H]2C[NH+]([C@@H](C)CC3CC3)C[C@@H]2C1 ZINC001258471337 985939745 /nfs/dbraw/zinc/93/97/45/985939745.db2.gz ZERXJVPKXWGKGA-AEGPPILISA-N 2 0 236.403 2.449 20 0 BEADRP C[C@H]([NH3+])CC[NH2+]CCc1ccc(F)cc1Cl ZINC001579480003 986001916 /nfs/dbraw/zinc/00/19/16/986001916.db2.gz DYIDHRVKSMQFAB-VIFPVBQESA-N 2 0 244.741 2.349 20 0 BEADRP C[C@@H]1CC[N@H+](CCC2CCCC2)C[C@H]1[NH3+] ZINC000300747533 986011566 /nfs/dbraw/zinc/01/15/66/986011566.db2.gz JXHFPXQKVKXXPT-DGCLKSJQSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@H]1COC(C)(C)C[N@@H+]1CCCCCC[NH3+] ZINC001579492795 986020975 /nfs/dbraw/zinc/02/09/75/986020975.db2.gz YWERMNHCTHUBEH-LBPRGKRZSA-N 2 0 228.380 2.005 20 0 BEADRP CC(C)[NH+](CCC[NH2+]C1CCOCC1)C(C)C ZINC001461267715 986030015 /nfs/dbraw/zinc/03/00/15/986030015.db2.gz MCVTUVRMQNPJBB-UHFFFAOYSA-N 2 0 242.407 2.264 20 0 BEADRP F[C@H]1CCCC[C@H]1[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC001461679048 986109548 /nfs/dbraw/zinc/10/95/48/986109548.db2.gz UKOXHEIBSBABER-ZOBORPQBSA-N 2 0 240.366 2.484 20 0 BEADRP Cc1cc(C[N@H+]2CCC[C@H]([C@H](C)[NH3+])C2)cc(C)n1 ZINC001579598178 986112385 /nfs/dbraw/zinc/11/23/85/986112385.db2.gz GYXKIMXDXZRSCI-ZFWWWQNUSA-N 2 0 247.386 2.258 20 0 BEADRP CCCC[C@H](CCC)[N@@H+]1CCO[C@H](C[NH3+])C1 ZINC001258752888 986116216 /nfs/dbraw/zinc/11/62/16/986116216.db2.gz NAQIJATZUGLOLU-QWHCGFSZSA-N 2 0 228.380 2.005 20 0 BEADRP Cc1cc(F)ccc1[C@H](C)[NH2+]C[C@]12C[C@H]1C[NH2+]C2 ZINC001579617690 986132761 /nfs/dbraw/zinc/13/27/61/986132761.db2.gz VBSVZVQRCFSMBZ-SLEUVZQESA-N 2 0 248.345 2.394 20 0 BEADRP Cc1ccc(CC[NH2+]CC23CC(C2)C[NH2+]3)cc1C ZINC001579687011 986178383 /nfs/dbraw/zinc/17/83/83/986178383.db2.gz CFUQEKJUXHKSPF-UHFFFAOYSA-N 2 0 244.382 2.188 20 0 BEADRP Cc1ccc(F)c(C[N@H+](C)CCC2C[NH2+]C2)c1 ZINC001579705496 986187499 /nfs/dbraw/zinc/18/74/99/986187499.db2.gz ACBPAWGJYXIWTL-UHFFFAOYSA-N 2 0 236.334 2.175 20 0 BEADRP Cc1cccc(C[NH+]2CCC3(C[NH2+]C3)CC2)c1F ZINC001579760393 986215844 /nfs/dbraw/zinc/21/58/44/986215844.db2.gz GFHMVWUZIRVWAA-UHFFFAOYSA-N 2 0 248.345 2.320 20 0 BEADRP CC[NH+]1CCC(C[NH2+]C(C)(C)CF)CC1 ZINC001462119348 986287941 /nfs/dbraw/zinc/28/79/41/986287941.db2.gz VIQNYLISAFMNNO-UHFFFAOYSA-N 2 0 216.344 2.056 20 0 BEADRP C[C@@H]1CCC[C@H]([N@H+]2C[C@H]3C[NH+](C)C[C@H]3C2)C1 ZINC001258825531 986288569 /nfs/dbraw/zinc/28/85/69/986288569.db2.gz DBHSJPLDWQMPCL-MQYQWHSLSA-N 2 0 222.376 2.059 20 0 BEADRP Cc1cc(N2CC[NH+](CC3CCC3)CC2)cc[nH+]1 ZINC001202791785 986310913 /nfs/dbraw/zinc/31/09/13/986310913.db2.gz GBLCQUPLDAIINS-UHFFFAOYSA-N 2 0 245.370 2.312 20 0 BEADRP CC[C@@H]1C[N@H+](CCCCCC[NH3+])C[C@H](C)O1 ZINC000689190734 986384122 /nfs/dbraw/zinc/38/41/22/986384122.db2.gz MUTHBKLIEHYMGQ-QWHCGFSZSA-N 2 0 228.380 2.005 20 0 BEADRP C[NH2+]Cc1cccc(-c2ccc(C[NH3+])nc2)c1F ZINC001244860115 986404412 /nfs/dbraw/zinc/40/44/12/986404412.db2.gz HIHGUIDLILHRLL-UHFFFAOYSA-N 2 0 245.301 2.066 20 0 BEADRP CC=C(NC=[NH2+])c1cccc(C[NH2+]C)c1F ZINC001244858990 986405366 /nfs/dbraw/zinc/40/53/66/986405366.db2.gz ZVSAHUDBLGNMMA-JYOAFUTRSA-N 2 0 221.279 2.103 20 0 BEADRP C[C@@H]1CCCC[C@H]1[NH2+]C[C@@H]1C[NH+]2CCC1CC2 ZINC001462635596 986470140 /nfs/dbraw/zinc/47/01/40/986470140.db2.gz MHQWSMOQYMMCIG-BPLDGKMQSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@]1(C[N@@H+]2CCC[C@H](CCF)C2)CCC[NH2+]C1 ZINC000689421675 986583446 /nfs/dbraw/zinc/58/34/46/986583446.db2.gz MGZCUYDGDYBFFS-KGLIPLIRSA-N 2 0 242.382 2.448 20 0 BEADRP [NH3+][C@@H](C[NH2+]CC1CCC=CCC1)CC(F)F ZINC001580132948 986602033 /nfs/dbraw/zinc/60/20/33/986602033.db2.gz SEEVLANYIDNSQG-LLVKDONJSA-N 2 0 232.318 2.305 20 0 BEADRP [NH3+]C1CC([NH2+]CC2(c3ccccc3F)CCC2)C1 ZINC001580162731 986636644 /nfs/dbraw/zinc/63/66/44/986636644.db2.gz DXGMXMFSLKVAJY-UHFFFAOYSA-N 2 0 248.345 2.327 20 0 BEADRP [NH3+][C@H]1CC12CC([NH2+]Cc1cccc3cc[nH]c31)C2 ZINC001580165903 986641931 /nfs/dbraw/zinc/64/19/31/986641931.db2.gz NSJPICVPECMVRI-OWYJLGKBSA-N 2 0 241.338 2.137 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH+]2C[C@H]3[C@H](CC3(F)F)C2)CC1 ZINC001254519844 986658973 /nfs/dbraw/zinc/65/89/73/986658973.db2.gz KMOORLADPNCQHC-WOPDTQHZSA-N 2 0 244.329 2.058 20 0 BEADRP C[C@H]1CCCC[N@@H+]1[C@H]1CCC[NH+](C)CC1 ZINC001254515819 986664200 /nfs/dbraw/zinc/66/42/00/986664200.db2.gz DKZZQTDVHDGXDD-STQMWFEESA-N 2 0 210.365 2.345 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH+]2C[C@@H]3CCC[C@@H]3C2)CC1 ZINC001254515815 986670670 /nfs/dbraw/zinc/67/06/70/986670670.db2.gz DJLYCFKHCUMNKO-MJBXVCDLSA-N 2 0 222.376 2.203 20 0 BEADRP [NH3+]CC1(C[NH2+][C@H]2CCCc3cccnc32)CCC1 ZINC001580244160 986693213 /nfs/dbraw/zinc/69/32/13/986693213.db2.gz RHUJOWOKPOCNLS-ZDUSSCGKSA-N 2 0 245.370 2.178 20 0 BEADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@H]2CC[C@@H]3CCC[C@@H]32)C1 ZINC001580258357 986715258 /nfs/dbraw/zinc/71/52/58/986715258.db2.gz NSRSOUVLFICBRD-BJJPWKGXSA-N 2 0 222.376 2.282 20 0 BEADRP [NH3+]CC1CC[NH+]([C@H]2C[C@H]2c2cccc(F)c2)CC1 ZINC001580265435 986720180 /nfs/dbraw/zinc/72/01/80/986720180.db2.gz IUEAAJJSLCGMAK-GJZGRUSLSA-N 2 0 248.345 2.352 20 0 BEADRP [NH3+]CC[C@@H]1CC[N@H+](C[C@H]2C[C@@H]2c2ccccc2)C1 ZINC001580288772 986731247 /nfs/dbraw/zinc/73/12/47/986731247.db2.gz XMZPOFUAJMLHHK-FVQBIDKESA-N 2 0 244.382 2.461 20 0 BEADRP Cc1cc(C)c(C[NH+]2CCC(C[NH+](C)C)CC2)[nH]1 ZINC001137328286 986782522 /nfs/dbraw/zinc/78/25/22/986782522.db2.gz ZMZLILFXLCKRAF-UHFFFAOYSA-N 2 0 249.402 2.405 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[N@@H+]2CCCC[C@H]2c2cc[nH]n2)C1 ZINC001580387089 986810751 /nfs/dbraw/zinc/81/07/51/986810751.db2.gz KFFOHIZGWYOYLL-SCRDCRAPSA-N 2 0 248.374 2.064 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[NH2+][C@@H](c2ccccn2)C2CC2)C1 ZINC001580389544 986816246 /nfs/dbraw/zinc/81/62/46/986816246.db2.gz NZDPBPUMVHVSQP-NJZAAPMLSA-N 2 0 245.370 2.250 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+]Cc2ccc(F)c(Cl)c2)C1 ZINC001580421398 986838758 /nfs/dbraw/zinc/83/87/58/986838758.db2.gz HWXBHUFPHLLXNL-AOOOYVTPSA-N 2 0 242.725 2.306 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2)C1 ZINC001580423202 986841758 /nfs/dbraw/zinc/84/17/58/986841758.db2.gz UCBQKFMGSPTIOF-LVQVYYBASA-N 2 0 244.382 2.477 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+][C@H]2CCC[C@@H]2Cc2ccccc2)C1 ZINC001580423203 986842905 /nfs/dbraw/zinc/84/29/05/986842905.db2.gz UCBQKFMGSPTIOF-WCVJEAGWSA-N 2 0 244.382 2.477 20 0 BEADRP C[C@@H]([NH3+])c1ccccc1-c1ccncc1C[NH3+] ZINC001245559612 986951655 /nfs/dbraw/zinc/95/16/55/986951655.db2.gz CRVRVSCVPHBDFH-SNVBAGLBSA-N 2 0 227.311 2.227 20 0 BEADRP C[C@@H]([NH3+])c1cccc(-c2ccncc2C[NH3+])c1 ZINC001245563051 986957312 /nfs/dbraw/zinc/95/73/12/986957312.db2.gz XHBLTIFTYPTLQM-SNVBAGLBSA-N 2 0 227.311 2.227 20 0 BEADRP C[C@]1(C[NH3+])CC[N@H+](C[C@@H]2CC3CCC2CC3)C1 ZINC000691657808 987288394 /nfs/dbraw/zinc/28/83/94/987288394.db2.gz AIGBDFCZIYVSAN-PFSRBDOWSA-N 2 0 236.403 2.483 20 0 BEADRP CCCCC[C@@H](O)C[N@@H+]1CCC[C@@](C)([NH3+])CC1 ZINC001246020326 987307468 /nfs/dbraw/zinc/30/74/68/987307468.db2.gz KQOVEPXQNLBHEW-ZIAGYGMSSA-N 2 0 242.407 2.131 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@H]2CCCC[NH2+]C2)[C@H](C)C1 ZINC000697053688 987347418 /nfs/dbraw/zinc/34/74/18/987347418.db2.gz WGLGVGUZTWEZDF-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)[C@H]1CC[N@H+](C[C@@H]2CCCC[NH2+]C2)C1 ZINC000697052266 987347729 /nfs/dbraw/zinc/34/77/29/987347729.db2.gz MKKSDCIUTCTBJR-KGLIPLIRSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@H]2CCCC[C@H]2C)CC[NH2+]1 ZINC001246066972 987353680 /nfs/dbraw/zinc/35/36/80/987353680.db2.gz SQSCZDJTWXXKFS-NDBYEHHHSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCCCCCCC[NH3+])CC[NH2+]1 ZINC001246074654 987363919 /nfs/dbraw/zinc/36/39/19/987363919.db2.gz BDLSUIIZKKVMNN-KGLIPLIRSA-N 3 0 241.423 2.016 20 0 BEADRP CC[C@@H](C)OCC[C@@H](C)[NH2+]CC1([NH3+])CCCC1 ZINC001246074545 987365121 /nfs/dbraw/zinc/36/51/21/987365121.db2.gz DPZWAXPEQGGGCO-CHWSQXEVSA-N 2 0 242.407 2.441 20 0 BEADRP C[C@H](C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)CC(F)F ZINC000697713467 987365409 /nfs/dbraw/zinc/36/54/09/987365409.db2.gz GWHNVSWJNUNKHA-YEJSDXFRSA-N 2 0 246.345 2.493 20 0 BEADRP C[C@@H]1C[C@H](n2ccc3cc(C[NH3+])ccc32)CC[NH2+]1 ZINC001246086815 987386777 /nfs/dbraw/zinc/38/67/77/987386777.db2.gz WCQOLTDHYKIZJX-BXUZGUMPSA-N 2 0 243.354 2.413 20 0 BEADRP C[C@H]1C[C@@H](n2ccc3cc(C[NH3+])ccc32)CC[NH2+]1 ZINC001246086820 987387621 /nfs/dbraw/zinc/38/76/21/987387621.db2.gz WCQOLTDHYKIZJX-FZMZJTMJSA-N 2 0 243.354 2.413 20 0 BEADRP CC[C@H](C)OCC[C@@H](C)[NH2+][C@H]1CCCC[NH2+]C1 ZINC001246089920 987392589 /nfs/dbraw/zinc/39/25/89/987392589.db2.gz HSSDPYFAKQWJQJ-RDBSUJKOSA-N 2 0 242.407 2.312 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H]2CC[NH2+][C@H](C)C2)cc1 ZINC001246094067 987400992 /nfs/dbraw/zinc/40/09/92/987400992.db2.gz FORSHUAZPVABPG-UKRRQHHQSA-N 2 0 232.371 2.268 20 0 BEADRP CC(C)OCC[C@@H](C)[NH2+]C[C@H]1C[NH2+]C[C@@H](C)C1 ZINC001246096176 987408586 /nfs/dbraw/zinc/40/85/86/987408586.db2.gz DIICDDLEDMGRKQ-BFHYXJOUSA-N 2 0 242.407 2.025 20 0 BEADRP C[C@H](CC1CC1)[NH2+]C[C@H]1CC[C@@H](C)[NH2+]C1 ZINC001246103933 987428826 /nfs/dbraw/zinc/42/88/26/987428826.db2.gz ZAJLHCLLSODBII-WZRBSPASSA-N 2 0 210.365 2.153 20 0 BEADRP CC1CCC([NH2+]C[C@H]2C[NH2+]C[C@H](C)C2)CC1 ZINC001246104847 987433362 /nfs/dbraw/zinc/43/33/62/987433362.db2.gz VLGGBABADRPQAF-CEUNDQEZSA-N 2 0 224.392 2.400 20 0 BEADRP CC1CCC([NH2+]C[C@H]2C[NH2+]C[C@@H](C)C2)CC1 ZINC001246104850 987434992 /nfs/dbraw/zinc/43/49/92/987434992.db2.gz VLGGBABADRPQAF-YIFLHPOLSA-N 2 0 224.392 2.400 20 0 BEADRP [NH3+]Cc1cn(C2CC[NH2+]CC2)c2ccccc12 ZINC001246107062 987436748 /nfs/dbraw/zinc/43/67/48/987436748.db2.gz GMJJPGVDUDTLHM-UHFFFAOYSA-N 2 0 229.327 2.025 20 0 BEADRP CC(C)CCC[C@H](C)[NH2+][C@H]1C[NH2+]C[C@@H]1C ZINC001246107420 987439496 /nfs/dbraw/zinc/43/94/96/987439496.db2.gz IABXRPMSTQARBD-AVGNSLFASA-N 2 0 212.381 2.399 20 0 BEADRP C[C@@H]1CC[C@H](n2cc(C[NH3+])c3ccccc32)C[NH2+]1 ZINC001246109281 987442815 /nfs/dbraw/zinc/44/28/15/987442815.db2.gz NDQNMEDHIDIKDG-YPMHNXCESA-N 2 0 243.354 2.413 20 0 BEADRP CC(C)OCC[C@@H](C)[NH2+]C[C@H]1CCC[NH2+][C@@H]1C ZINC001246114753 987453301 /nfs/dbraw/zinc/45/33/01/987453301.db2.gz XERJGVRGTRIWLK-MGPQQGTHSA-N 2 0 242.407 2.168 20 0 BEADRP CC(C)OCC[C@@H](C)[NH2+]C[C@@H]1CCC[NH2+][C@@H]1C ZINC001246114751 987456159 /nfs/dbraw/zinc/45/61/59/987456159.db2.gz XERJGVRGTRIWLK-MCIONIFRSA-N 2 0 242.407 2.168 20 0 BEADRP C[C@H]1C[C@@H](N[C@@H]2CCOc3ccccc32)CC[NH2+]1 ZINC001246115020 987456778 /nfs/dbraw/zinc/45/67/78/987456778.db2.gz QAMLMHVGCZMTFY-SGMGOOAPSA-N 2 0 246.354 2.240 20 0 BEADRP CC(C)C1CCC([NH2+][C@@H]2C[NH2+]C[C@@H]2C)CC1 ZINC001246116397 987459848 /nfs/dbraw/zinc/45/98/48/987459848.db2.gz MJKSRDPFUJOWIW-GFJIZPEISA-N 2 0 224.392 2.399 20 0 BEADRP C[C@H]1C[C@H]([NH2+][C@H]2C[NH2+]CC23CC3)C[C@@H](C)C1 ZINC001246127977 987478592 /nfs/dbraw/zinc/47/85/92/987478592.db2.gz CZPLZYZJSZICFV-LOWDOPEQSA-N 2 0 222.376 2.153 20 0 BEADRP C1C[C@H]([NH2+][C@@H]2CCC3(C2)CC[NH2+]CC3)CS1 ZINC001246133791 987490709 /nfs/dbraw/zinc/49/07/09/987490709.db2.gz QSPDMMLEPBLNNF-NEPJUHHUSA-N 2 0 240.416 2.004 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@@]2(F)CC[NH2+]C2)CC(C)(C)C1 ZINC001246142530 987498447 /nfs/dbraw/zinc/49/84/47/987498447.db2.gz IVEADAAXDLXMNB-MBNYWOFBSA-N 2 0 242.382 2.492 20 0 BEADRP CCCCCC[C@@H](C)[NH2+][C@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001246150591 987508618 /nfs/dbraw/zinc/50/86/18/987508618.db2.gz WBSALCSDINHQST-FVCCEPFGSA-N 2 0 210.365 2.153 20 0 BEADRP C[NH2+]CC[C@@H](C)[NH2+]CCc1ccc(C)cc1C ZINC001246160477 987521814 /nfs/dbraw/zinc/52/18/14/987521814.db2.gz ULNBDHDXSQTTOX-CQSZACIVSA-N 2 0 234.387 2.434 20 0 BEADRP C[C@@H]1CC[C@@H](n2c(C[NH3+])cc3ccccc32)C[NH2+]1 ZINC001246164760 987527975 /nfs/dbraw/zinc/52/79/75/987527975.db2.gz BCZQQWCTOJVMMM-DGCLKSJQSA-N 2 0 243.354 2.413 20 0 BEADRP CCCC1CCC([NH2+][C@H]2C[C@@H]([NH3+])C2)CC1 ZINC001246182943 987554938 /nfs/dbraw/zinc/55/49/38/987554938.db2.gz BWNFZEJZKZWBGT-JSTMSRMQSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@H]2CC[NH2+]2)CC(C)(C)C1 ZINC001246192672 987580482 /nfs/dbraw/zinc/58/04/82/987580482.db2.gz JHPGLFIUQJOVBS-UTUOFQBUSA-N 2 0 210.365 2.153 20 0 BEADRP CCCC1CCC([NH2+]C[C@@H]2CC[NH2+]2)CC1 ZINC001246194657 987585632 /nfs/dbraw/zinc/58/56/32/987585632.db2.gz SJEKIZBNYOUUJQ-BPCQOVAHSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@H]2C[C@H]2c2ccccc2)CC[NH2+]1 ZINC001246210780 987608078 /nfs/dbraw/zinc/60/80/78/987608078.db2.gz KHETVUGRBYWJAI-UNQGMJICSA-N 2 0 230.355 2.273 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+][C@H]2CC[C@@H]3CCC[C@@H]32)CN1 ZINC001246228864 987626218 /nfs/dbraw/zinc/62/62/18/987626218.db2.gz GYCLRYSFJHDAOT-BJJPWKGXSA-N 2 0 222.376 2.295 20 0 BEADRP Cc1ccccc1OC[C@@H](C)[NH2+]C1CC[NH2+]CC1 ZINC001246236557 987636383 /nfs/dbraw/zinc/63/63/83/987636383.db2.gz MICADAQJTDIWRF-CYBMUJFWSA-N 2 0 248.370 2.104 20 0 BEADRP Cc1ccnc(CCC[NH2+][C@@H]2CC[NH2+][C@H](C)C2)c1 ZINC001246241428 987641481 /nfs/dbraw/zinc/64/14/81/987641481.db2.gz RCACJZGTGMXVLC-UKRRQHHQSA-N 2 0 247.386 2.053 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CC(C)(C)C[NH3+])C[C@@H]1C ZINC001246243439 987645073 /nfs/dbraw/zinc/64/50/73/987645073.db2.gz GKEFDWYGYPYNCF-GRYCIOLGSA-N 2 0 212.381 2.386 20 0 BEADRP CCCC[C@H]1C[C@H](NCCC(C)(C)[NH3+])CC[NH2+]1 ZINC001246271910 987659757 /nfs/dbraw/zinc/65/97/57/987659757.db2.gz JGHCJVOMSDHPLH-QWHCGFSZSA-N 2 0 241.423 2.014 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC[NH2+][C@H](C)C1)c1ccc(O)cc1 ZINC001246272960 987667002 /nfs/dbraw/zinc/66/70/02/987667002.db2.gz NCCXSMJIDDZPCC-BZPMIXESSA-N 2 0 248.370 2.226 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[NH2+][C@H](C)C1)c1ccc(N)cc1 ZINC001246282241 987674628 /nfs/dbraw/zinc/67/46/28/987674628.db2.gz BCZHUSBJKRLQRR-GYSYKLTISA-N 2 0 233.359 2.060 20 0 BEADRP CC1(C)CCC[C@H]1[NH2+][C@@H]1CCCC[NH2+]C1 ZINC001246283460 987678072 /nfs/dbraw/zinc/67/80/72/987678072.db2.gz CEIQGIYYLZREBG-VXGBXAGGSA-N 2 0 210.365 2.297 20 0 BEADRP CCCCC[C@@H](CCC)[NH2+]CCN(C)CC[NH3+] ZINC001246286781 987679088 /nfs/dbraw/zinc/67/90/88/987679088.db2.gz ZVNVWWVVZGNPAF-CQSZACIVSA-N 2 0 243.439 2.216 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[NH2+][C@@H](C)C1)c1ccc(N)cc1 ZINC001246293253 987686151 /nfs/dbraw/zinc/68/61/51/987686151.db2.gz BCZHUSBJKRLQRR-WDMOLILDSA-N 2 0 233.359 2.060 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@H](C)CC(C)(C)SC ZINC001246312066 987713194 /nfs/dbraw/zinc/71/31/94/987713194.db2.gz FJUUUAUTIJYTOZ-ZJUUUORDSA-N 2 0 218.410 2.234 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@@H](C)Cc1ccc(C)cc1 ZINC001246315104 987722164 /nfs/dbraw/zinc/72/21/64/987722164.db2.gz HFYGSEBLQLLDDY-JSGCOSHPSA-N 2 0 220.360 2.253 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CC2(c3ccccc3)CC2)CC[NH2+]1 ZINC001246332558 987738605 /nfs/dbraw/zinc/73/86/05/987738605.db2.gz NHYSUHWANAFJHT-ZFWWWQNUSA-N 2 0 244.382 2.448 20 0 BEADRP C[C@H]1CCCC[C@H]1[NH2+][C@@H]1CCCC[NH2+]C1 ZINC001246334642 987742049 /nfs/dbraw/zinc/74/20/49/987742049.db2.gz VZEMLTIMEVHOFB-YNEHKIRRSA-N 2 0 210.365 2.297 20 0 BEADRP CCCCCC[C@H](C)[NH2+][C@H]1CC[NH2+]C[C@H]1OC ZINC001246346209 987749416 /nfs/dbraw/zinc/74/94/16/987749416.db2.gz FLAHNLOJDASICT-MELADBBJSA-N 2 0 242.407 2.312 20 0 BEADRP CCCC[C@@H]1C[C@H](NC(C)(C)CC[NH3+])CC[NH2+]1 ZINC001246357819 987765569 /nfs/dbraw/zinc/76/55/69/987765569.db2.gz ASTHAITYFFKGAQ-CHWSQXEVSA-N 2 0 241.423 2.014 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC2(CC3CC3)CC2)CC[NH2+]1 ZINC001246430956 987793507 /nfs/dbraw/zinc/79/35/07/987793507.db2.gz HQZOBZJCZUKCEB-DGCLKSJQSA-N 2 0 222.376 2.297 20 0 BEADRP CC[C@H](C[C@@H](C)CC)[NH2+]CCCNCCC[NH3+] ZINC001246451888 987795181 /nfs/dbraw/zinc/79/51/81/987795181.db2.gz ICOGFOBAZNFFGY-UONOGXRCSA-N 2 0 243.439 2.119 20 0 BEADRP CC(C)C[C@H](C)C[C@@H](C)[NH2+][C@@H]1CC12C[NH2+]C2 ZINC001246446767 987796908 /nfs/dbraw/zinc/79/69/08/987796908.db2.gz TYQVJQLOHIKWML-YNEHKIRRSA-N 2 0 224.392 2.399 20 0 BEADRP CC1(C)CC[C@@H](C[NH2+]C2CC[NH2+]CC2)C1 ZINC001246438438 987798665 /nfs/dbraw/zinc/79/86/65/987798665.db2.gz XYPYXKQMOJFIGQ-LLVKDONJSA-N 2 0 210.365 2.154 20 0 BEADRP Fc1ccccc1CC1([NH2+]C2CC[NH2+]CC2)CC1 ZINC001246440075 987800102 /nfs/dbraw/zinc/80/01/02/987800102.db2.gz QYISTHXAZHNYSO-UHFFFAOYSA-N 2 0 248.345 2.242 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@H]2CCC(C)(C)C2)C[NH2+]1 ZINC001246437250 987800803 /nfs/dbraw/zinc/80/08/03/987800803.db2.gz UMQDKCHMZIZFBS-WOPDTQHZSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]1C[C@@H]([NH2+][C@@H]2C[C@@H]3C[C@H]([C@@H]2C)C3(C)C)C[NH2+]1 ZINC001246443142 987801803 /nfs/dbraw/zinc/80/18/03/987801803.db2.gz LTWSPMIYQPPNNI-QEHJDLSMSA-N 2 0 236.403 2.397 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C2(CC3CC3)CC2)CC[NH2+]1 ZINC001246445158 987801954 /nfs/dbraw/zinc/80/19/54/987801954.db2.gz MYLCSHXSGNBDJQ-ZYHUDNBSSA-N 2 0 208.349 2.049 20 0 BEADRP FC(F)(F)[C@@H]1CCC[C@H]([NH2+][C@@H]2CC23C[NH2+]C3)C1 ZINC001246445121 987802054 /nfs/dbraw/zinc/80/20/54/987802054.db2.gz MMLNMXZDVUMQPS-KXUCPTDWSA-N 2 0 248.292 2.059 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]C(C)(C)Cc2cccnc2)CC[NH2+]1 ZINC001246444652 987803153 /nfs/dbraw/zinc/80/31/53/987803153.db2.gz AQQFKANOXJMZHH-JSGCOSHPSA-N 2 0 247.386 2.133 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C(C)(C)Cc2cccnc2)CC[NH2+]1 ZINC001246444655 987803247 /nfs/dbraw/zinc/80/32/47/987803247.db2.gz AQQFKANOXJMZHH-TZMCWYRMSA-N 2 0 247.386 2.133 20 0 BEADRP CC(C)=CCC[C@@H](C)[NH2+][C@H]1CC12C[NH2+]C2 ZINC001246446823 987804730 /nfs/dbraw/zinc/80/47/30/987804730.db2.gz UGCNJZDOFRQJDB-NEPJUHHUSA-N 2 0 208.349 2.073 20 0 BEADRP CC(C)=CCC[C@H](C)[NH2+][C@H]1CC12C[NH2+]C2 ZINC001246446828 987806945 /nfs/dbraw/zinc/80/69/45/987806945.db2.gz UGCNJZDOFRQJDB-RYUDHWBXSA-N 2 0 208.349 2.073 20 0 BEADRP CCCC[C@@H](CCC)[NH2+]CCCNCCC[NH3+] ZINC001246453880 987809286 /nfs/dbraw/zinc/80/92/86/987809286.db2.gz QREFFBWGTFTMHK-CQSZACIVSA-N 2 0 243.439 2.263 20 0 BEADRP CC[C@H](C)C[C@H](CC)[NH2+]CCCNCCC[NH3+] ZINC001246451886 987810547 /nfs/dbraw/zinc/81/05/47/987810547.db2.gz ICOGFOBAZNFFGY-KBPBESRZSA-N 2 0 243.439 2.119 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+]C[C@H]1C[NH+]2CCC1CC2 ZINC001474735253 987813053 /nfs/dbraw/zinc/81/30/53/987813053.db2.gz MBOYDIIOCOOQEC-KWCYVHTRSA-N 2 0 222.376 2.106 20 0 BEADRP CC(C)CCC[C@@H](C)[NH2+]CCCNCCC[NH3+] ZINC001246456142 987813397 /nfs/dbraw/zinc/81/33/97/987813397.db2.gz ZLKUWUKXLCTQDB-CQSZACIVSA-N 2 0 243.439 2.119 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]C[C@@H]1C[NH+]2CCC1CC2 ZINC001474735252 987814685 /nfs/dbraw/zinc/81/46/85/987814685.db2.gz MBOYDIIOCOOQEC-BNOWGMLFSA-N 2 0 222.376 2.106 20 0 BEADRP C[NH2+][C@H]1C[C@H]([NH2+][C@H]2CCc3ccc(C)cc3C2)C1 ZINC001246458785 987817278 /nfs/dbraw/zinc/81/72/78/987817278.db2.gz BYRFDXKJAYGSAP-JYJNAYRXSA-N 2 0 244.382 2.192 20 0 BEADRP CC1(C)CCC([NH2+][C@H]2C[C@@](C)([NH3+])C2)CC1 ZINC001246457891 987817717 /nfs/dbraw/zinc/81/77/17/987817717.db2.gz FKPSZLFPDIJLKN-BJHJDKERSA-N 2 0 210.365 2.425 20 0 BEADRP C[NH2+][C@H]1C[C@H]([NH2+][C@@H]2CC[C@@H](C)[C@@H](C)C2)C1 ZINC001246461676 987818504 /nfs/dbraw/zinc/81/85/04/987818504.db2.gz PEMDERSRFFMBNC-NZEXEKPDSA-N 2 0 210.365 2.151 20 0 BEADRP C[NH2+][C@H]1C[C@H]([NH2+][C@@H]2CC[C@H](C)[C@H](C)C2)C1 ZINC001246461677 987820519 /nfs/dbraw/zinc/82/05/19/987820519.db2.gz PEMDERSRFFMBNC-QWQWKMKNSA-N 2 0 210.365 2.151 20 0 BEADRP C[NH2+][C@H]1C[C@H]([NH2+][C@@H]2CC[C@H](C)[C@@H](C)C2)C1 ZINC001246461679 987820541 /nfs/dbraw/zinc/82/05/41/987820541.db2.gz PEMDERSRFFMBNC-WJTVCTBASA-N 2 0 210.365 2.151 20 0 BEADRP C[NH2+][C@H]1C[C@H]([NH2+]C2CCc3ccccc3CC2)C1 ZINC001246462389 987823899 /nfs/dbraw/zinc/82/38/99/987823899.db2.gz QUQXUHVITPNICP-WKILWMFISA-N 2 0 244.382 2.274 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C[C@@H]2CC[NH2+]C[C@@H]2F)C[C@@H]1C ZINC001246475442 987830857 /nfs/dbraw/zinc/83/08/57/987830857.db2.gz FTTNYWKZDGMJSN-HTOAHKCRSA-N 2 0 242.382 2.348 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]C[C@@H]2CC[NH2+]C[C@@H]2F)C1 ZINC001246477316 987834250 /nfs/dbraw/zinc/83/42/50/987834250.db2.gz NWICJZDNJAXNNZ-XQHKEYJVSA-N 2 0 228.355 2.102 20 0 BEADRP F[C@H]1C[NH2+]CC[C@H]1C[NH2+]C1CCC2(CC2)CC1 ZINC001246478444 987838463 /nfs/dbraw/zinc/83/84/63/987838463.db2.gz WJNTVYOMQSAUHY-AAEUAGOBSA-N 2 0 240.366 2.246 20 0 BEADRP CC1(C)CC[C@@H]([NH2+][C@H]2CCCC[C@H]2[NH3+])C1 ZINC001246478402 987839182 /nfs/dbraw/zinc/83/91/82/987839182.db2.gz OKZIRUKPWMJONU-UTUOFQBUSA-N 2 0 210.365 2.425 20 0 BEADRP CCCC(C[NH3+])(CCC)N[C@H]1CC[NH2+][C@@H](C)C1 ZINC001246494051 987846590 /nfs/dbraw/zinc/84/65/90/987846590.db2.gz CTWBEPNOSCACRN-STQMWFEESA-N 2 0 241.423 2.014 20 0 BEADRP C[NH2+][C@H]1C[C@@H]([NH2+][C@H]2CCCC(C)(C)C2)C1 ZINC001246497776 987853632 /nfs/dbraw/zinc/85/36/32/987853632.db2.gz RIPNTSIDBGPMJM-SDDRHHMPSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]C23CC([NH3+])(C2)C3)CC(C)(C)C1 ZINC001246506510 987858980 /nfs/dbraw/zinc/85/89/80/987858980.db2.gz WMUPNWIZAFHLDU-YWBBTBBSSA-N 2 0 222.376 2.425 20 0 BEADRP CCC[N@H+]([C@@H](C)CC)[C@@H](C)CC[NH2+]C ZINC001246526804 987879176 /nfs/dbraw/zinc/87/91/76/987879176.db2.gz CRIXAFALJCJEMQ-RYUDHWBXSA-N 2 0 200.370 2.495 20 0 BEADRP CC[C@@H]1CC[C@@H]([N@@H+]2CCC[C@H]([NH3+])CC2)C1 ZINC001246539261 987900410 /nfs/dbraw/zinc/90/04/10/987900410.db2.gz GPBUZHPAQFDDKA-FRRDWIJNSA-N 2 0 210.365 2.378 20 0 BEADRP C[C@H]1C[N@@H+]([C@@H]2CCC[C@H](C)C2)C[C@H]1C[NH3+] ZINC001246539296 987900836 /nfs/dbraw/zinc/90/08/36/987900836.db2.gz HECQLJLNRQBCLU-WUHRBBMRSA-N 2 0 210.365 2.092 20 0 BEADRP CSC(C)(C)C[C@@H](C)[N@@H+]1C[C@H](C)[C@H](C[NH3+])C1 ZINC001246540740 987901530 /nfs/dbraw/zinc/90/15/30/987901530.db2.gz KATOVLKNHYSGIP-QJPTWQEYSA-N 2 0 244.448 2.433 20 0 BEADRP C[C@H]1C[N@@H+]([C@@H]2CCC(C)(C)C2)C[C@H]1C[NH3+] ZINC001246542455 987909274 /nfs/dbraw/zinc/90/92/74/987909274.db2.gz PKVBNCCTCMPCOM-QJPTWQEYSA-N 2 0 210.365 2.092 20 0 BEADRP CC[C@H]1CC[C@H]([N@@H+]2C[C@H](C)[C@H](C[NH3+])C2)C1 ZINC001246547745 987931707 /nfs/dbraw/zinc/93/17/07/987931707.db2.gz NBRVWLZDDNQPIM-RVMXOQNASA-N 2 0 210.365 2.092 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2CCC[C@](C)([NH3+])CC2)C1 ZINC001246549963 987942131 /nfs/dbraw/zinc/94/21/31/987942131.db2.gz IXCDXLRHZATUQO-AGIUHOORSA-N 2 0 210.365 2.378 20 0 BEADRP C[C@]1([NH3+])CCC[N@@H+](C2Cc3ccccc3C2)CC1 ZINC001246551058 987944770 /nfs/dbraw/zinc/94/47/70/987944770.db2.gz KISMRTZLDQLAPN-INIZCTEOSA-N 2 0 244.382 2.357 20 0 BEADRP [NH3+]C[C@@]1(F)CCC[N@@H+]([C@H]2CCCSC2)CC1 ZINC001246551064 987948115 /nfs/dbraw/zinc/94/81/15/987948115.db2.gz OUDAKWATTAVEMW-NWDGAFQWSA-N 2 0 246.395 2.035 20 0 BEADRP CC1(C)CC[C@H]([N@@H+]2CCC(F)(F)[C@@H](C[NH3+])C2)C1 ZINC001246553309 987961547 /nfs/dbraw/zinc/96/15/47/987961547.db2.gz AUEMDAXSVSUTQF-QWRGUYRKSA-N 2 0 246.345 2.481 20 0 BEADRP CCSC[C@H](C)[N@@H+]1CC[C@@H](C)[C@H](C[NH3+])CC1 ZINC001246555734 987966294 /nfs/dbraw/zinc/96/62/94/987966294.db2.gz GAKMJGFCRLIZSJ-AGIUHOORSA-N 2 0 244.448 2.435 20 0 BEADRP CCOCC[C@H](C)[N@@H+]1CC[C@H](C)[C@@H](C[NH3+])CC1 ZINC001246557352 987975513 /nfs/dbraw/zinc/97/55/13/987975513.db2.gz KQYSUULNKBPTPX-MELADBBJSA-N 2 0 242.407 2.108 20 0 BEADRP CCSC[C@@H](C)[N@@H+]1CCC[C@](F)(C[NH3+])CC1 ZINC001246557298 987976677 /nfs/dbraw/zinc/97/66/77/987976677.db2.gz KKUIOOFCGJDLNN-VXGBXAGGSA-N 2 0 248.411 2.281 20 0 BEADRP CSCC[C@H](C)[N@@H+]1CCC[C@H](C[NH3+])[C@@H](C)C1 ZINC001246559541 987987294 /nfs/dbraw/zinc/98/72/94/987987294.db2.gz BFLYFGWCWZSRHI-RWMBFGLXSA-N 2 0 244.448 2.435 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H](C)c1ccc(OC)cc1 ZINC001118060136 987998407 /nfs/dbraw/zinc/99/84/07/987998407.db2.gz WRVLZGQEBAHPKJ-VXGBXAGGSA-N 2 0 236.359 2.344 20 0 BEADRP C[C@H](CC1CC1)[N@@H+]1CC[C@@H](C)[C@@H](C[NH3+])CC1 ZINC001246563702 988006107 /nfs/dbraw/zinc/00/61/07/988006107.db2.gz XNYZMGKPMNROIE-YRGRVCCFSA-N 2 0 224.392 2.482 20 0 BEADRP CCC(C)(C)[C@H](C)[NH2+]CC[C@H](C)[NH2+]C ZINC001118121690 988018362 /nfs/dbraw/zinc/01/83/62/988018362.db2.gz HKQZFMJXHKXYBX-QWRGUYRKSA-N 2 0 200.370 2.399 20 0 BEADRP Cc1cccc2c1C[N@H+]([C@H]1CC[NH2+][C@H](C)C1)C2 ZINC001246566664 988024199 /nfs/dbraw/zinc/02/41/99/988024199.db2.gz IPSNYJRUCORMBQ-OCCSQVGLSA-N 2 0 230.355 2.451 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H]1CCc2ccc(F)cc21 ZINC001118122128 988028640 /nfs/dbraw/zinc/02/86/40/988028640.db2.gz PQAQXZFPLGTPAR-YGRLFVJLSA-N 2 0 236.334 2.401 20 0 BEADRP CCc1ccc(C[C@H](C)[NH+]2CC(C)(C[NH3+])C2)cc1 ZINC001246589987 988168165 /nfs/dbraw/zinc/16/81/65/988168165.db2.gz QTVJCMGUCRVZEL-ZDUSSCGKSA-N 2 0 246.398 2.461 20 0 BEADRP CC[C@H](C)C[C@H](CC)[NH+]1CC(C[NH2+]C)C1 ZINC001246593122 988178133 /nfs/dbraw/zinc/17/81/33/988178133.db2.gz AGEVLKBEWZHKMB-AAEUAGOBSA-N 2 0 212.381 2.352 20 0 BEADRP CC[C@@H](C)C[C@@H](CC)[NH+]1CC(C[NH2+]C)C1 ZINC001246593126 988180491 /nfs/dbraw/zinc/18/04/91/988180491.db2.gz AGEVLKBEWZHKMB-DGCLKSJQSA-N 2 0 212.381 2.352 20 0 BEADRP CC(C)C1CCC([NH+]2CC(C)(C[NH3+])C2)CC1 ZINC001246597815 988199302 /nfs/dbraw/zinc/19/93/02/988199302.db2.gz NIOXFYJSEUUQMZ-UHFFFAOYSA-N 2 0 224.392 2.482 20 0 BEADRP CC[C@H](Cc1ccccc1)[NH+]1CC(C[NH2+]C)C1 ZINC001246598692 988199679 /nfs/dbraw/zinc/19/96/79/988199679.db2.gz OJLHXNKTYOITGK-OAHLLOKOSA-N 2 0 232.371 2.159 20 0 BEADRP C[C@@H]1C[C@H]([NH+]2CC(C)(C[NH3+])C2)CC(C)(C)C1 ZINC001246601271 988206053 /nfs/dbraw/zinc/20/60/53/988206053.db2.gz UNTSXLUKAHVPAW-NEPJUHHUSA-N 2 0 224.392 2.482 20 0 BEADRP CC(C)CC(CC(C)C)[NH+]1CC2(C[NH2+]C2)C1 ZINC001246616607 988261420 /nfs/dbraw/zinc/26/14/20/988261420.db2.gz YNMCFGXQHOAKKJ-UHFFFAOYSA-N 2 0 224.392 2.352 20 0 BEADRP CSC(C)(C)C[C@@H](C)N1CC[C@@H]2[NH2+]CC[C@H]21 ZINC001246633287 988313879 /nfs/dbraw/zinc/31/38/79/988313879.db2.gz LFVDUOUSWVPBLZ-GRYCIOLGSA-N 2 0 242.432 2.343 20 0 BEADRP CC1(C)CC[C@H]([N@@H+]2CC[C@@H]3[NH2+]CC[C@H]32)C1 ZINC001246633728 988318899 /nfs/dbraw/zinc/31/88/99/988318899.db2.gz LXMAQSREJVZZSX-SDDRHHMPSA-N 2 0 208.349 2.001 20 0 BEADRP CCCCC[C@H](C)N1CC[C@@H]2[NH2+]CC[C@H]21 ZINC001246635875 988325961 /nfs/dbraw/zinc/32/59/61/988325961.db2.gz SOXZOOXOMPSSCJ-RWMBFGLXSA-N 2 0 210.365 2.391 20 0 BEADRP CC(C)CC[C@@H](C)N1CC[C@@H]2CC[NH2+][C@@H]2C1 ZINC001246636052 988333038 /nfs/dbraw/zinc/33/30/38/988333038.db2.gz KSJMIFGNJKZOJT-HZSPNIEDSA-N 2 0 224.392 2.495 20 0 BEADRP CC[C@@H]1CC[C@H]([N@@H+]2CC[C@H]3[NH2+]CC[C@H]32)C1 ZINC001246640310 988337026 /nfs/dbraw/zinc/33/70/26/988337026.db2.gz SBRGLLAOYXLWIT-YVECIDJPSA-N 2 0 208.349 2.001 20 0 BEADRP CC[C@@H](C)C[C@H](CC)[N@@H+]1C[C@@H]2CC[NH2+][C@@H]2C1 ZINC001246653446 988381227 /nfs/dbraw/zinc/38/12/27/988381227.db2.gz SZABWMCKKATUHC-ZOBORPQBSA-N 2 0 224.392 2.495 20 0 BEADRP CCCCC[C@H](CC)[N@H+]1C[C@@H]2[C@H]([NH3+])[C@@H]2C1 ZINC001246657994 988383553 /nfs/dbraw/zinc/38/35/53/988383553.db2.gz BMGXNDCTDAUABS-RVMXOQNASA-N 2 0 210.365 2.234 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2CC[C@@H]3CCC[C@@H]3C2)C[NH2+]1 ZINC001246655754 988383649 /nfs/dbraw/zinc/38/36/49/988383649.db2.gz KPWDWZPXUFMISZ-RQJABVFESA-N 2 0 222.376 2.249 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2CC[C@H]3CCC[C@@H]3C2)C[NH2+]1 ZINC001246655756 988386858 /nfs/dbraw/zinc/38/68/58/988386858.db2.gz KPWDWZPXUFMISZ-SYQHCUMBSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@@H]1C[C@@H]([N@H+]2C[C@H]3[C@H](CCC3(F)F)C2)CC[NH2+]1 ZINC001246656404 988387014 /nfs/dbraw/zinc/38/70/14/988387014.db2.gz NOJKRZHMJRVRJY-WYUUTHIRSA-N 2 0 244.329 2.104 20 0 BEADRP CC(C)CC(CC(C)C)[N@H+]1C[C@@H]2[C@@H]([NH3+])[C@@H]2C1 ZINC001246662260 988396105 /nfs/dbraw/zinc/39/61/05/988396105.db2.gz YRHLZTICZOHNDD-WDNDVIMCSA-N 2 0 224.392 2.336 20 0 BEADRP CC1(C)[C@@H]2C[C@H]([N@@H+]3C[C@H]4CCC[C@@]4([NH3+])C3)C[C@@H]21 ZINC001246661435 988400900 /nfs/dbraw/zinc/40/09/00/988400900.db2.gz FPECUQPQFVHLJZ-ZHZXCYKASA-N 2 0 234.387 2.234 20 0 BEADRP CCC[C@H](CC)[N@@H+]1C[C@H]2CCC[C@@]2([NH3+])C1 ZINC001246665812 988404726 /nfs/dbraw/zinc/40/47/26/988404726.db2.gz QQOWPRYRYAKAIZ-FRRDWIJNSA-N 2 0 210.365 2.378 20 0 BEADRP CCCC[C@@H](CC)[N@@H+]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC001246667395 988408243 /nfs/dbraw/zinc/40/82/43/988408243.db2.gz KABQJUBGNWPMEC-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2C[C@H]3CC[NH2+]C[C@H]32)CC(C)(C)C1 ZINC001246666987 988411578 /nfs/dbraw/zinc/41/15/78/988411578.db2.gz WPTVHIXJEFJZDV-YIYPIFLZSA-N 2 0 236.403 2.495 20 0 BEADRP CC(C)C1CCC([N@@H+]2C[C@H]3C[NH2+]CC[C@H]32)CC1 ZINC001246677667 988426036 /nfs/dbraw/zinc/42/60/36/988426036.db2.gz WWEBOSCGNKFHHB-HXSCFSKGSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2CC[C@H](c3cccnc3)C2)CC[NH2+]1 ZINC001246790551 988466393 /nfs/dbraw/zinc/46/63/93/988466393.db2.gz HMDUONJATYGBMD-VHDGCEQUSA-N 2 0 245.370 2.011 20 0 BEADRP C[C@@H]1CC[C@@H]([N@@H+]2CCCC3(C[NH2+]C3)C2)C[C@@H]1C ZINC001246792229 988467819 /nfs/dbraw/zinc/46/78/19/988467819.db2.gz ORBVMOXMLUWNIW-HZSPNIEDSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]1C[C@@H]([N@@H+]2CC[C@H](c3cccnc3)C2)CC[NH2+]1 ZINC001246790550 988468897 /nfs/dbraw/zinc/46/88/97/988468897.db2.gz HMDUONJATYGBMD-SNPRPXQTSA-N 2 0 245.370 2.011 20 0 BEADRP CCCOC1CC[NH+]([C@@H]2CC[NH2+][C@@H](C)C2)CC1 ZINC001246788745 988469582 /nfs/dbraw/zinc/46/95/82/988469582.db2.gz ILBKGFYXUYPZJH-QWHCGFSZSA-N 2 0 240.391 2.018 20 0 BEADRP CCCCCC[C@@H](CCC)N(CC[NH3+])CC[NH3+] ZINC001246828718 988523085 /nfs/dbraw/zinc/52/30/85/988523085.db2.gz CGZXXTRPWLIHHJ-CQSZACIVSA-N 2 0 243.439 2.345 20 0 BEADRP C[NH2+]CC[C@@H](C)[N@@H+]1CC[C@H]2CCCC[C@H]2C1 ZINC001246830484 988523390 /nfs/dbraw/zinc/52/33/90/988523390.db2.gz BUBMBTSLYOJWRO-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP C1CC[C@H]2C[N@@H+]([C@H]3CCC[NH2+]C3)CC[C@H]2C1 ZINC001246833780 988527731 /nfs/dbraw/zinc/52/77/31/988527731.db2.gz ICLNTGGGMVODTQ-RDBSUJKOSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@@H]1CC[C@@H]([N@H+]2C[C@H]3CC[C@@H](C2)[C@@H]3[NH3+])C[C@@H]1C ZINC001246841220 988547515 /nfs/dbraw/zinc/54/75/15/988547515.db2.gz NAUFFWJWDCPYLB-ARSDKDGVSA-N 2 0 236.403 2.480 20 0 BEADRP CCCCC[C@H](C)[N@@H+]1C[C@@H]2CC[C@]2([NH3+])C1 ZINC001246857566 988587373 /nfs/dbraw/zinc/58/73/73/988587373.db2.gz AZWHTYFKLVCCOG-AVGNSLFASA-N 2 0 210.365 2.378 20 0 BEADRP [NH3+][C@@]12CC[C@@H]1C[N@@H+](C1CCCCCC1)C2 ZINC001246862766 988603732 /nfs/dbraw/zinc/60/37/32/988603732.db2.gz RHYPIDMGCSDFNF-DGCLKSJQSA-N 2 0 208.349 2.132 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@@H+]([C@@H](C)Cc2ccc(C)cc2)C1 ZINC001246863884 988606738 /nfs/dbraw/zinc/60/67/38/988606738.db2.gz LZQIQHZPHLTMDG-HOCLYGCPSA-N 2 0 246.398 2.467 20 0 BEADRP CCCC[C@H](CC)[N@@H+]1C[C@H]2CC[C@]2([NH3+])C1 ZINC001246863951 988611080 /nfs/dbraw/zinc/61/10/80/988611080.db2.gz STXCJZAOWKDXBZ-AGIUHOORSA-N 2 0 210.365 2.378 20 0 BEADRP C[C@@H]1C[C@H](N2CCc3c(F)cccc3C2)CC[NH2+]1 ZINC001246863555 988611841 /nfs/dbraw/zinc/61/18/41/988611841.db2.gz QPRLIPPBQSKXJZ-DGCLKSJQSA-N 2 0 248.345 2.324 20 0 BEADRP CC1CCC([N@@H+]2C[C@H]3CC[C@@H](C2)[NH2+]C3)CC1 ZINC001246869266 988626600 /nfs/dbraw/zinc/62/66/00/988626600.db2.gz VCMRUVKHFHMUGK-QPPOZKHWSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@@H]1CC[C@@H]([N@@H+]2C[C@H]3CC[C@@H](C2)[NH2+]C3)C[C@@H]1C ZINC001246870039 988630572 /nfs/dbraw/zinc/63/05/72/988630572.db2.gz YDIUWPDLKVJLOP-CAEXGNQWSA-N 2 0 236.403 2.495 20 0 BEADRP CCC[N@H+](C1CCOCC1)[C@H]1CC[NH2+][C@H](C)C1 ZINC001246900264 988673831 /nfs/dbraw/zinc/67/38/31/988673831.db2.gz UOTJSRDMYYEVPC-OCCSQVGLSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@@H](Cc1ccco1)[N@H+]1C[C@@H]2CC[NH2+]CC[C@@H]2C1 ZINC001246936824 988769749 /nfs/dbraw/zinc/76/97/49/988769749.db2.gz XRPDLRIJLABAHP-MELADBBJSA-N 2 0 248.370 2.142 20 0 BEADRP CCCC1CCC([N@H+](C)[C@@H]2[C@H]3C[NH2+]C[C@H]32)CC1 ZINC001246947160 988778145 /nfs/dbraw/zinc/77/81/45/988778145.db2.gz JDHVQUIJPPBWIW-QSCRHYGLSA-N 2 0 236.403 2.495 20 0 BEADRP Cc1ccc2c(c1)CC[N@@H+]([C@H]1CC[NH2+][C@H](C)C1)C2 ZINC001246964132 988795893 /nfs/dbraw/zinc/79/58/93/988795893.db2.gz BQPNCDANRVMFON-CJNGLKHVSA-N 2 0 244.382 2.494 20 0 BEADRP CC1(C)[C@@H]2C[C@@H](N3CC[C@H]4[NH2+]CCC[C@@H]4C3)C[C@@H]21 ZINC001247016730 988844915 /nfs/dbraw/zinc/84/49/15/988844915.db2.gz XNSNGCQBUWHFIX-ARILJUKYSA-N 2 0 248.414 2.495 20 0 BEADRP C[C@@H]([NH3+])C[N@@H+]1CCC[C@@]1(C)c1ccccc1 ZINC001119347951 988989715 /nfs/dbraw/zinc/98/97/15/988989715.db2.gz UAUSQICEFMZEQO-OCCSQVGLSA-N 2 0 218.344 2.345 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]Cc1ccc(F)c(C)c1 ZINC001325266788 989137109 /nfs/dbraw/zinc/13/71/09/989137109.db2.gz FNLADFVZSLYSLQ-LLVKDONJSA-N 2 0 224.323 2.222 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC001325268713 989137621 /nfs/dbraw/zinc/13/76/21/989137621.db2.gz UBUNCCUYEQBXST-QEJZJMRPSA-N 2 0 232.371 2.378 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]Cc1cccc(C)c1C ZINC001325627622 989219996 /nfs/dbraw/zinc/21/99/96/989219996.db2.gz UUEQZHCTGQNRJB-LBPRGKRZSA-N 2 0 220.360 2.391 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H]1CC[C@@H]1C1CCC1 ZINC001325722351 989244231 /nfs/dbraw/zinc/24/42/31/989244231.db2.gz MCGGUWCEISTOCR-RAIGVLPGSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@@H]([NH2+]CC[C@H](C)[NH2+]C)c1ccncc1 ZINC001325723355 989244911 /nfs/dbraw/zinc/24/49/11/989244911.db2.gz RGPBKMFTAKDAJT-WCQYABFASA-N 2 0 221.348 2.120 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@@H](C)Cc1cccs1 ZINC001325744243 989248403 /nfs/dbraw/zinc/24/84/03/989248403.db2.gz RYMXUIPUDQDAFY-QWRGUYRKSA-N 2 0 226.389 2.267 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@H]1CCc2ccc(OC)cc21 ZINC001325745317 989249799 /nfs/dbraw/zinc/24/97/99/989249799.db2.gz XBGAVPZIJIGMTC-NHYWBVRUSA-N 2 0 248.370 2.270 20 0 BEADRP Cc1cc(N[C@@H]2CCCC[C@@H]2[NH+](C)C)cc[nH+]1 ZINC001325777744 989257191 /nfs/dbraw/zinc/25/71/91/989257191.db2.gz YFNLOZXHQSTKOU-KGLIPLIRSA-N 2 0 233.359 2.097 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CCCc2ccccc2C1 ZINC001326034827 989333618 /nfs/dbraw/zinc/33/36/18/989333618.db2.gz AIMNAAMOEXXBSL-XJKSGUPXSA-N 2 0 246.398 2.379 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H](C)Cc1cccs1 ZINC001326035940 989334443 /nfs/dbraw/zinc/33/44/43/989334443.db2.gz MTCBZRCFOWLFTF-GHMZBOCLSA-N 2 0 226.389 2.124 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H]1CCCc2ccc(O)cc21 ZINC001326037493 989336520 /nfs/dbraw/zinc/33/65/20/989336520.db2.gz XETCPMPZNUKOCA-IAQYHMDHSA-N 2 0 248.370 2.357 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H]1CCCc2ccc(O)cc21 ZINC001326037492 989339256 /nfs/dbraw/zinc/33/92/56/989339256.db2.gz XETCPMPZNUKOCA-ABAIWWIYSA-N 2 0 248.370 2.357 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H]1CC[C@H](C)C[C@@H]1C ZINC001326040434 989341855 /nfs/dbraw/zinc/34/18/55/989341855.db2.gz XXINOSBHBUILEK-WUHRBBMRSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@@H]1CC[C@H]1[NH2+][C@@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C ZINC001119699009 989344075 /nfs/dbraw/zinc/34/40/75/989344075.db2.gz GZKJDUKXRPRXJD-NJMOYASZSA-N 2 0 222.376 2.151 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]Cc1ccc(C)cc1C ZINC001326076568 989362715 /nfs/dbraw/zinc/36/27/15/989362715.db2.gz OXKLIGWPZIDYJP-ZDUSSCGKSA-N 2 0 220.360 2.391 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]Cc1ccnc2ccccc12 ZINC001326076546 989366505 /nfs/dbraw/zinc/36/65/05/989366505.db2.gz ONVTWDVRNCRTOE-GFCCVEGCSA-N 2 0 243.354 2.322 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H]1CC[C@@H]1C(C)(C)C ZINC001326474136 989570568 /nfs/dbraw/zinc/57/05/68/989570568.db2.gz SNLBDURIBAEZCH-WOPDTQHZSA-N 2 0 212.381 2.399 20 0 BEADRP C[N@H+]1Cc2ccccc2[C@H](Nc2cc[nH+]cc2)C1 ZINC001120860226 989927978 /nfs/dbraw/zinc/92/79/78/989927978.db2.gz FVSOARAJLRBEDB-OAHLLOKOSA-N 2 0 239.322 2.102 20 0 BEADRP C[N@H+]1Cc2ccccc2[C@@H](Nc2cc[nH+]cc2)C1 ZINC001120860225 989928393 /nfs/dbraw/zinc/92/83/93/989928393.db2.gz FVSOARAJLRBEDB-HNNXBMFYSA-N 2 0 239.322 2.102 20 0 BEADRP c1cc(N2CC[C@@H]([NH+]3CCCCC3)C2)cc[nH+]1 ZINC001120860692 989931670 /nfs/dbraw/zinc/93/16/70/989931670.db2.gz RDCPVTOUBRPDLI-CQSZACIVSA-N 2 0 231.343 2.146 20 0 BEADRP CCC(CC)C[NH2+][C@@H]1CC[C@@H]2C[N@H+](C)C[C@H]12 ZINC001308554268 991035215 /nfs/dbraw/zinc/03/52/15/991035215.db2.gz NPJMDGMEQZUKHS-HZSPNIEDSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H](Cc1ccco1)[NH2+]Cc1ccccc1C[NH3+] ZINC001258178950 991079295 /nfs/dbraw/zinc/07/92/95/991079295.db2.gz NDIVNBDFXSRBAA-LBPRGKRZSA-N 2 0 244.338 2.459 20 0 BEADRP CSCC[C@@H](C)[NH2+]CC12CC[NH+](CC1)CC2 ZINC001258206055 991124955 /nfs/dbraw/zinc/12/49/55/991124955.db2.gz NLJHSCAZDVUVGV-GFCCVEGCSA-N 2 0 242.432 2.204 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)[C@@H](C)CCSC ZINC001258224065 991162170 /nfs/dbraw/zinc/16/21/70/991162170.db2.gz KFSBKJHPUADTQA-LBPRGKRZSA-N 2 0 232.437 2.402 20 0 BEADRP CC1(C)CCC[C@H]([NH2+]CCSCC[NH3+])C1 ZINC001258280495 991208703 /nfs/dbraw/zinc/20/87/03/991208703.db2.gz WILJOWWOOCHCKX-NSHDSACASA-N 2 0 230.421 2.237 20 0 BEADRP CC(C)SCC[NH2+][C@@H]1CC[C@H]2C[N@H+](C)C[C@@H]21 ZINC001308984342 991235236 /nfs/dbraw/zinc/23/52/36/991235236.db2.gz HGSBODJXOVUNOB-RWMBFGLXSA-N 2 0 242.432 2.058 20 0 BEADRP CC(C)C[C@H](C)[NH2+]C[C@@H]1C[NH+]2CCC1CC2 ZINC001308966000 991238230 /nfs/dbraw/zinc/23/82/30/991238230.db2.gz KVGCQIDOJIZXCI-GXTWGEPZSA-N 2 0 224.392 2.352 20 0 BEADRP CSC(C)(C)C[C@@H](C)[N@H+](C)C[C@H](C)C[NH3+] ZINC001258335129 991262028 /nfs/dbraw/zinc/26/20/28/991262028.db2.gz XFIUVFMPDHFRIB-GHMZBOCLSA-N 2 0 232.437 2.433 20 0 BEADRP CCCCC(CCCC)[NH2+]CCOCC[NH3+] ZINC001258378782 991332610 /nfs/dbraw/zinc/33/26/10/991332610.db2.gz QLNDOZGSECVIGQ-UHFFFAOYSA-N 2 0 230.396 2.300 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)[C@H](C)CC1CC1 ZINC001258470109 991433478 /nfs/dbraw/zinc/43/34/78/991433478.db2.gz LKFRLBITMXTKDB-GFCCVEGCSA-N 2 0 212.381 2.449 20 0 BEADRP CC[NH+]1C[C@@H]2C[NH+]([C@@H](C)CC3CC3)C[C@H]2C1 ZINC001258472887 991442960 /nfs/dbraw/zinc/44/29/60/991442960.db2.gz QCZHTPTYTNMZGW-IACUBPJLSA-N 2 0 222.376 2.059 20 0 BEADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@@H]1CCC[C@H]1C ZINC001560393885 991464391 /nfs/dbraw/zinc/46/43/91/991464391.db2.gz QXDJLXFCICRIKR-MGPQQGTHSA-N 2 0 242.407 2.121 20 0 BEADRP c1[nH+]cn2cc(C[NH2+]Cc3cccnc3)ccc12 ZINC001560499526 991488361 /nfs/dbraw/zinc/48/83/61/991488361.db2.gz GGMJEXFNJLLTJL-UHFFFAOYSA-N 2 0 238.294 2.019 20 0 BEADRP C[C@H]1C[C@@H](NC(=[NH2+])SCC[NH3+])CC(C)(C)C1 ZINC001258687124 991621478 /nfs/dbraw/zinc/62/14/78/991621478.db2.gz MRFAMBNUZQSWJL-VHSXEESVSA-N 2 0 243.420 2.417 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@H]2CC2(C)C)CC1 ZINC001560882139 991639102 /nfs/dbraw/zinc/63/91/02/991639102.db2.gz BYCWXFLOKOMOIO-LBPRGKRZSA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[C@@H]2C[N@H+](C)C[C@H]12)C1CCC1 ZINC001561053641 991710897 /nfs/dbraw/zinc/71/08/97/991710897.db2.gz XZYWYUREPOJRHZ-CBBWQLFWSA-N 2 0 236.403 2.495 20 0 BEADRP CCC[NH+]1CCC([NH2+]CCCC(C)(C)O)CC1 ZINC001258768799 991732966 /nfs/dbraw/zinc/73/29/66/991732966.db2.gz XTHHGHBKHUCKJK-UHFFFAOYSA-N 2 0 242.407 2.002 20 0 BEADRP C[C@H]1CCC[C@@H]([NH2+][C@H]2CCC[C@H]([NH3+])C2)C1 ZINC001258813178 991822601 /nfs/dbraw/zinc/82/26/01/991822601.db2.gz BWEDVWQSUBGHHW-RVMXOQNASA-N 2 0 210.365 2.425 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[N@H+](CCN)C(C)C ZINC001258898288 991891470 /nfs/dbraw/zinc/89/14/70/991891470.db2.gz HQUKKCHAPGYPCQ-AWEZNQCLSA-N 2 0 243.439 2.166 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[N@H+](C)C[C@@H](C)C[NH3+] ZINC001258902842 991895228 /nfs/dbraw/zinc/89/52/28/991895228.db2.gz HEMQRVDPJUXSNB-KBPBESRZSA-N 2 0 243.439 2.024 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H]1C[C@H]1F ZINC001258900337 991895745 /nfs/dbraw/zinc/89/57/45/991895745.db2.gz JPGOBZKZSIDAOJ-IJLUTSLNSA-N 2 0 216.344 2.197 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CC=CC1 ZINC001258906834 991896137 /nfs/dbraw/zinc/89/61/37/991896137.db2.gz BBIWBVPOHCYCMG-CYBMUJFWSA-N 2 0 210.365 2.369 20 0 BEADRP CCOC1C[NH+]([C@H](C)CCC[NH+](CC)CC)C1 ZINC001258907316 991898808 /nfs/dbraw/zinc/89/88/08/991898808.db2.gz IPZDFNVXRPRLBA-CYBMUJFWSA-N 2 0 242.407 2.218 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[N@H+](C)CC(C)=O ZINC001258908607 991900587 /nfs/dbraw/zinc/90/05/87/991900587.db2.gz YRVXIXMXKWSFBR-LBPRGKRZSA-N 2 0 228.380 2.018 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCO[C@H](C)C1 ZINC001258907561 991900858 /nfs/dbraw/zinc/90/08/58/991900858.db2.gz KMVMPSHGQDNYJK-UONOGXRCSA-N 2 0 242.407 2.218 20 0 BEADRP C[C@@H](CC[NH3+])[NH2+]Cc1ccccc1N1CCCC1 ZINC001261370237 992276304 /nfs/dbraw/zinc/27/63/04/992276304.db2.gz CMWVOQGBLUARLZ-ZDUSSCGKSA-N 2 0 247.386 2.114 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H]1CCC[C@@H]1CCCF ZINC001261423750 992296673 /nfs/dbraw/zinc/29/66/73/992296673.db2.gz CWHNTIHFJDETFL-JHJVBQTASA-N 2 0 230.371 2.492 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@H]([NH2+][C@@H]3CC[C@H]3C3CC3)[C@@H]2C1 ZINC001474756468 992511488 /nfs/dbraw/zinc/51/14/88/992511488.db2.gz GSWPMXFINWBMHY-AHDPXTMNSA-N 2 0 234.387 2.105 20 0 BEADRP Cc1occc1C[NH+]1CCC([C@@H]2C[C@@H]2[NH3+])CC1 ZINC001574207997 992820159 /nfs/dbraw/zinc/82/01/59/992820159.db2.gz KKOUUCXTHDSPDE-KBPBESRZSA-N 2 0 234.343 2.147 20 0 BEADRP Cc1c[nH+]c2ccccc2c1NC[C@@H]1CC[N@H+]1C ZINC001262373597 992867095 /nfs/dbraw/zinc/86/70/95/992867095.db2.gz FLFQOBCFJOARPP-LBPRGKRZSA-N 2 0 241.338 2.081 20 0 BEADRP C([N@H+](C1CC1)C1CCCCC1)[C@]12C[C@H]1C[NH2+]C2 ZINC001574794556 992906314 /nfs/dbraw/zinc/90/63/14/992906314.db2.gz DVFRDXKQKDIXOK-SWLSCSKDSA-N 2 0 234.387 2.393 20 0 BEADRP C([NH2+][C@H]1CC[C@@H]1C1CC1)[C@@H]1CCC[NH2+]CC1 ZINC001574799765 992910591 /nfs/dbraw/zinc/91/05/91/992910591.db2.gz FPJZBFKFSYJFCL-BNOWGMLFSA-N 2 0 222.376 2.154 20 0 BEADRP C([NH2+][C@H]1C[C@@H]2CC[C@@H](C2)C1)[C@@H]1CCC[NH2+]C1 ZINC001574799940 992913815 /nfs/dbraw/zinc/91/38/15/992913815.db2.gz FZSGPRZIPBOJIV-RQJABVFESA-N 2 0 222.376 2.154 20 0 BEADRP C([NH2+]C1CCCCCCC1)[C@H]1[C@@H]2C[NH2+]C[C@H]12 ZINC001574801612 992914670 /nfs/dbraw/zinc/91/46/70/992914670.db2.gz SRWMIEUVNOQICW-WDNDVIMCSA-N 2 0 222.376 2.154 20 0 BEADRP C/C(=C\c1ccccc1)C[NH2+][C@H]1C[C@H]([NH3+])C1 ZINC001574979947 992957818 /nfs/dbraw/zinc/95/78/18/992957818.db2.gz NWARLLRFQNZURW-BIQPOQOMSA-N 2 0 216.328 2.169 20 0 BEADRP CC(C)(C)[C@@H]1CCC[N@@H+]1C[C@]12C[C@H]1C[NH2+]C2 ZINC001575120257 992990004 /nfs/dbraw/zinc/99/00/04/992990004.db2.gz SJKHKGLQXYGZOJ-SGMGOOAPSA-N 2 0 222.376 2.106 20 0 BEADRP CC1CC[NH+](CCCCNc2cc[nH+]cc2)CC1 ZINC001262671804 993013237 /nfs/dbraw/zinc/01/32/37/993013237.db2.gz UUWIUWBCAOZVMU-UHFFFAOYSA-N 2 0 247.386 2.428 20 0 BEADRP CC(C)(C[NH2+]C1CC2(C[C@@H]2[NH3+])C1)C1CCC1 ZINC001575334180 993014169 /nfs/dbraw/zinc/01/41/69/993014169.db2.gz DYZGTQKDJATGMB-LXVYMNJGSA-N 2 0 222.376 2.282 20 0 BEADRP CC(C)(C[NH2+]C1CC2(C[C@H]2[NH3+])C1)C1CCC1 ZINC001575334188 993014909 /nfs/dbraw/zinc/01/49/09/993014909.db2.gz DYZGTQKDJATGMB-MBHSVXNSSA-N 2 0 222.376 2.282 20 0 BEADRP CC(C)[C@@H](C[NH3+])C[NH2+]C[C@@H]1C(C)(C)C1(F)F ZINC001575422909 993033970 /nfs/dbraw/zinc/03/39/70/993033970.db2.gz OFXSFZYJSWVVCJ-VHSXEESVSA-N 2 0 234.334 2.098 20 0 BEADRP CC(C)[C@H](C[NH3+])C[NH2+]C[C@H]1C(C)(C)C1(F)F ZINC001575422910 993034087 /nfs/dbraw/zinc/03/40/87/993034087.db2.gz OFXSFZYJSWVVCJ-ZJUUUORDSA-N 2 0 234.334 2.098 20 0 BEADRP CC(C)[C@H](C[NH3+])C[NH2+]Cc1cccc2cc[nH]c21 ZINC001575421949 993041401 /nfs/dbraw/zinc/04/14/01/993041401.db2.gz DEGSNBGDGALAEI-CQSZACIVSA-N 2 0 245.370 2.488 20 0 BEADRP CC(C)C(C[NH2+][C@@H]1C[NH2+]C[C@H]1C)C(C)C ZINC001575432799 993044606 /nfs/dbraw/zinc/04/46/06/993044606.db2.gz KEYIWCZEUCSLPQ-DGCLKSJQSA-N 2 0 212.381 2.112 20 0 BEADRP CC(C)[C@@H]1CC[N@@H+]1C[C@@]1(C)CCC[NH2+]C1 ZINC001575508349 993062386 /nfs/dbraw/zinc/06/23/86/993062386.db2.gz SIFOZKDQKXBLQP-STQMWFEESA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H](CC1CCC1)[NH2+]C1CC(CC[NH3+])C1 ZINC001575934947 993133494 /nfs/dbraw/zinc/13/34/94/993133494.db2.gz UTTNJLYTPFZXKQ-PKSQDBQZSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H](C[C@@H]1CCC[NH2+]1)[NH2+]C[C@]12C[C@H]1CCC2 ZINC001575941718 993133846 /nfs/dbraw/zinc/13/38/46/993133846.db2.gz UFKISVWAWROACA-CRWXNKLISA-N 2 0 222.376 2.297 20 0 BEADRP [NH3+][C@@H]1CCC[N@H+](Cc2ccc3c(c2)CCC3)CC1 ZINC000378809309 993204475 /nfs/dbraw/zinc/20/44/75/993204475.db2.gz ZASUODYREVCHER-MRXNPFEDSA-N 2 0 244.382 2.489 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]C/C=C\C2CC2)CC1 ZINC000378788256 993206338 /nfs/dbraw/zinc/20/63/38/993206338.db2.gz LAYQEHIFJHBILA-ARJAWSKDSA-N 2 0 222.376 2.415 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@@H]1C1CCCC1)C1C[NH2+]C1 ZINC001576245329 993229208 /nfs/dbraw/zinc/22/92/08/993229208.db2.gz OPDKJEARWLAXRG-ZKYQVNSYSA-N 2 0 222.376 2.010 20 0 BEADRP CC1(C)[C@@H]([NH3+])C[C@@H]1[NH2+]Cc1cccc2[nH]ccc21 ZINC001576380644 993286605 /nfs/dbraw/zinc/28/66/05/993286605.db2.gz WBQSNJTZUDTSBI-KBPBESRZSA-N 2 0 243.354 2.383 20 0 BEADRP C[C@@H]1C[C@@H]([N@@H+]2CCCC[C@@H](C[NH3+])C2)C[C@H](C)O1 ZINC000379928232 993297321 /nfs/dbraw/zinc/29/73/21/993297321.db2.gz TVMHHFDHKHFVSX-CRWXNKLISA-N 2 0 240.391 2.003 20 0 BEADRP CC1(C)C[NH2+][C@@H]1C1CC[NH+](CC2CCC2)CC1 ZINC001576469692 993316128 /nfs/dbraw/zinc/31/61/28/993316128.db2.gz SJFSSLLNLSBICZ-CQSZACIVSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@]1(C[NH3+])CC[N@H+](CC23CCC(CC2)C3)C1 ZINC001576503636 993325833 /nfs/dbraw/zinc/32/58/33/993325833.db2.gz UHILJBMKTUPKDE-MOKVOYLWSA-N 2 0 222.376 2.237 20 0 BEADRP C[C@@]1(C[NH2+]CC2CCC=CCC2)CC[NH2+]C1 ZINC001576518556 993328241 /nfs/dbraw/zinc/32/82/41/993328241.db2.gz AHJJDXWYMFNCMR-CQSZACIVSA-N 2 0 222.376 2.322 20 0 BEADRP CC1(C)CCC[C@@H]1C[NH2+]C[C@]1(C)CC[NH2+]C1 ZINC001576519866 993329581 /nfs/dbraw/zinc/32/95/81/993329581.db2.gz VAYNCVVHGCEKOS-TZMCWYRMSA-N 2 0 224.392 2.402 20 0 BEADRP CC1(C)[C@H]([NH2+]C[C@@]2(C)C[C@H]3C[C@H]3C2)C[C@@H]1[NH3+] ZINC001576519046 993331610 /nfs/dbraw/zinc/33/16/10/993331610.db2.gz ITGQASGDCGPHLA-SVPLCASGSA-N 2 0 222.376 2.138 20 0 BEADRP CC1=CCC[C@@H](C)[C@@H]1C[NH2+][C@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC001576554816 993343123 /nfs/dbraw/zinc/34/31/23/993343123.db2.gz BLYVWGSECFLRPT-ZSAUSMIDSA-N 2 0 234.387 2.461 20 0 BEADRP C[C@@H]1C[C@H]1[C@@H]1C[C@H]1[NH2+]C[C@H]1CC[NH2+][C@H](C)C1 ZINC001576597214 993360528 /nfs/dbraw/zinc/36/05/28/993360528.db2.gz DMSMNVUYZDZXBS-IKKURHKOSA-N 2 0 222.376 2.009 20 0 BEADRP C[C@H]1C[C@H](CNc2ccc3c([nH+]2)CCC3)CC[NH2+]1 ZINC001576596873 993360897 /nfs/dbraw/zinc/36/08/97/993360897.db2.gz BGWDTVGELCENPS-NWDGAFQWSA-N 2 0 245.370 2.370 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2CC[C@H](c3ccco3)C2)CC[NH2+]1 ZINC001576598826 993363264 /nfs/dbraw/zinc/36/32/64/993363264.db2.gz OMKDBGBLWYLWNI-MCIONIFRSA-N 2 0 248.370 2.457 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@H]1[NH2+][C@H]1CCC[N@H+](C)CC1 ZINC000381201660 993380488 /nfs/dbraw/zinc/38/04/88/993380488.db2.gz FJMFIVHKHFQICP-RFQIPJPRSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@@H]([NH2+][C@H]2C[C@H]3CC[C@@H]2[NH2+]3)C1 ZINC001576648384 993384012 /nfs/dbraw/zinc/38/40/12/993384012.db2.gz YLNXSWLIRCAFNO-QUGYJXMDSA-N 2 0 222.376 2.294 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+][C@H]1CC[C@H](C)SC1 ZINC001576670842 993388699 /nfs/dbraw/zinc/38/86/99/993388699.db2.gz MXYCVVPVLINIPR-SDDRHHMPSA-N 2 0 230.421 2.234 20 0 BEADRP C[C@H]1CCC[C@@H]([NH2+]CC2=CC[NH2+]CC2)CC1 ZINC001576679562 993390760 /nfs/dbraw/zinc/39/07/60/993390760.db2.gz CTTTZQVBSKKTHE-GXTWGEPZSA-N 2 0 222.376 2.465 20 0 BEADRP C[C@@H]1CCC[C@H](C[NH2+][C@@H]2C[NH2+]CC2(C)C)C1 ZINC001576678715 993391012 /nfs/dbraw/zinc/39/10/12/993391012.db2.gz OJXYCZHRLQUHSU-FRRDWIJNSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H]1CCC[C@H]([NH2+]CC2=CC[NH2+]CC2)CC1 ZINC001576679563 993391497 /nfs/dbraw/zinc/39/14/97/993391497.db2.gz CTTTZQVBSKKTHE-JSGCOSHPSA-N 2 0 222.376 2.465 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@H]2C[C@H]2C2CC2)CC1 ZINC000381521472 993402270 /nfs/dbraw/zinc/40/22/70/993402270.db2.gz UUYAJXYOOYODGT-KBPBESRZSA-N 2 0 222.376 2.247 20 0 BEADRP CC[C@H](C)[C@H](C[N@@H+]1CC[C@@H]([NH3+])[C@H](CC)C1)OC ZINC001576961226 993471250 /nfs/dbraw/zinc/47/12/50/993471250.db2.gz LZTCBGMRFQORMR-DGAVXFQQSA-N 2 0 242.407 2.107 20 0 BEADRP CC[C@@H](C)[N@H+](CCO)C[C@H]([NH3+])CCC(C)(C)C ZINC001576996828 993482352 /nfs/dbraw/zinc/48/23/52/993482352.db2.gz XQSDYQWDRIYWGW-CHWSQXEVSA-N 2 0 244.423 2.233 20 0 BEADRP C[C@@H](Cc1ccco1)[N@@H+]1CCCC[C@H](C[NH3+])C1 ZINC000383652634 993508518 /nfs/dbraw/zinc/50/85/18/993508518.db2.gz DVOCYRQVWNACQJ-QWHCGFSZSA-N 2 0 236.359 2.271 20 0 BEADRP CCC1(c2ccccc2)C[NH+](C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC001577233431 993549242 /nfs/dbraw/zinc/54/92/42/993549242.db2.gz JIRXACLHLXOJQT-OTVXOJSOSA-N 2 0 244.382 2.387 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@@H]2CCC[NH2+][C@H]2C)C1 ZINC000384206572 993558620 /nfs/dbraw/zinc/55/86/20/993558620.db2.gz BUJKILLMWRIDJM-VOAKCMCISA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@H]1CCCC[C@@H]1C[NH2+][C@H]1C[C@H]([NH3+])C1 ZINC001577254370 993564186 /nfs/dbraw/zinc/56/41/86/993564186.db2.gz JVGQQARKDPIACJ-RNJOBUHISA-N 2 0 210.365 2.282 20 0 BEADRP CC[C@@H]1CCCC[C@@H]1C[NH2+]C[C@]12C[C@H]1C[NH2+]C2 ZINC001577255090 993564654 /nfs/dbraw/zinc/56/46/54/993564654.db2.gz RFOJHOALKPTIBB-KBXIAJHMSA-N 2 0 236.403 2.402 20 0 BEADRP CC[C@H]1CCCC[C@H]1C[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001577255366 993565359 /nfs/dbraw/zinc/56/53/59/993565359.db2.gz UXCOCAYRDVZLML-QSLWVIQJSA-N 2 0 222.376 2.010 20 0 BEADRP CC[C@H]1CC[N@H+](CCC2CC[NH2+]CC2)[C@H]1C ZINC001577263384 993573697 /nfs/dbraw/zinc/57/36/97/993573697.db2.gz RMWFVMXRIMBMTH-JSGCOSHPSA-N 2 0 224.392 2.497 20 0 BEADRP CCCC[C@@H](CC)[NH2+]C[C@H]1CCC2(C[NH2+]C2)O1 ZINC001577387953 993638661 /nfs/dbraw/zinc/63/86/61/993638661.db2.gz COUJQFSMOSUOMR-CHWSQXEVSA-N 2 0 240.391 2.066 20 0 BEADRP CCCSC[C@H](C)[NH2+][C@@H]1CC[NH2+][C@@H](C)C1 ZINC001577596950 993690270 /nfs/dbraw/zinc/69/02/70/993690270.db2.gz NSKBMHKCZGUWHU-SDDRHHMPSA-N 2 0 230.421 2.248 20 0 BEADRP CCCCC[C@@H](C)[NH2+]CCSCC[NH3+] ZINC000389693307 993758006 /nfs/dbraw/zinc/75/80/06/993758006.db2.gz AQHKYPBWBNWBHP-LLVKDONJSA-N 2 0 218.410 2.237 20 0 BEADRP Cc1cc(C[NH+]2CCC(C[NH3+])CC2)cs1 ZINC000389632752 993759342 /nfs/dbraw/zinc/75/93/42/993759342.db2.gz MWRZZBOMNXERDM-UHFFFAOYSA-N 2 0 224.373 2.227 20 0 BEADRP C[NH+](C)C1CCC([NH2+][C@H]2CC[C@@H](F)C2)CC1 ZINC000390655804 993800191 /nfs/dbraw/zinc/80/01/91/993800191.db2.gz QPDMOPSHGJAWPA-IGJPJIBNSA-N 2 0 228.355 2.339 20 0 BEADRP CC1CCC([N@@H+]2CCC[C@@H]([NH3+])CC2)CC1 ZINC000393196294 993909817 /nfs/dbraw/zinc/90/98/17/993909817.db2.gz AHVWCICJQCWFPY-OTTFEQOBSA-N 2 0 210.365 2.378 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[C@H]3C[N@H+](C)C[C@H]32)C1 ZINC001621108268 1170717198 /nfs/dbraw/zinc/71/71/98/1170717198.db2.gz KWWHDXMPDBDEPF-GZBLMMOJSA-N 2 0 236.403 2.495 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@H]([NH2+][C@@H]3CCC(C)(C)C3)[C@@H]2C1 ZINC001621569797 1170854140 /nfs/dbraw/zinc/85/41/40/1170854140.db2.gz FBDVZMFMTKOXJO-DGAVXFQQSA-N 2 0 236.403 2.495 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1cnoc1 ZINC000037676244 1170962885 /nfs/dbraw/zinc/96/28/85/1170962885.db2.gz NOZQPYXIMWYLSU-GFCCVEGCSA-N 2 0 239.363 2.275 20 0 BEADRP C[C@H](Cc1ccco1)[NH2+]CCCn1ccnc1 ZINC000049328056 1171688541 /nfs/dbraw/zinc/68/85/41/1171688541.db2.gz NSKYLJVGTSZWPA-GFCCVEGCSA-N 2 0 233.315 2.087 20 0 BEADRP Cc1nccn1CC[NH2+][C@H](C)Cc1ccco1 ZINC000049330297 1171690114 /nfs/dbraw/zinc/69/01/14/1171690114.db2.gz ARRUYDRKWOUUCN-LLVKDONJSA-N 2 0 233.315 2.005 20 0 BEADRP CC(C)(C)C1CC[NH+](CCCC[NH3+])CC1 ZINC000050346042 1171796631 /nfs/dbraw/zinc/79/66/31/1171796631.db2.gz SJIUPDOZKVDIFU-UHFFFAOYSA-N 2 0 212.381 2.483 20 0 BEADRP [NH3+]CCCC[N@@H+]1CC[C@@H](c2ccccc2)C1 ZINC000050598417 1171818112 /nfs/dbraw/zinc/81/81/12/1171818112.db2.gz XACKUUHJOIDKBH-CQSZACIVSA-N 2 0 218.344 2.215 20 0 BEADRP C([C@@H]1CC[NH2+]C1)[N@@H+]1CC[C@@H]2CCCC[C@@H]2C1 ZINC000051889545 1171926480 /nfs/dbraw/zinc/92/64/80/1171926480.db2.gz VZZSTNBUJKBISN-HZSPNIEDSA-N 2 0 222.376 2.108 20 0 BEADRP CC(C)C[C@H](C)C[N@@H+]1CCC[C@@H](C[NH3+])C1 ZINC000300932636 349452686 /nfs/dbraw/zinc/45/26/86/349452686.db2.gz NYEIBRCAASJISC-STQMWFEESA-N 2 0 212.381 2.339 20 0 BEADRP C(C[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)CC1CC1 ZINC000161703094 538917585 /nfs/dbraw/zinc/91/75/85/538917585.db2.gz PFODZOTXPQGLFC-ZIAGYGMSSA-N 2 0 222.376 2.393 20 0 BEADRP CCc1ccc(CN[C@@H]2CC[N@H+](C)[C@H](C)C2)o1 ZINC000161614974 349476571 /nfs/dbraw/zinc/47/65/71/349476571.db2.gz KLZGUIAFNOXADE-VXGBXAGGSA-N 2 0 236.359 2.414 20 0 BEADRP C[C@@H]([NH2+]C1CC(C)C1)C1CC[NH+](C)CC1 ZINC000161805206 538919089 /nfs/dbraw/zinc/91/90/89/538919089.db2.gz WSXDALSNQWFQIO-QWKFWESOSA-N 2 0 210.365 2.105 20 0 BEADRP CCC1(CC)[C@H]([NH2+][C@H](C)C[C@H](C)[NH3+])C[C@H]1OC ZINC000422943706 398159242 /nfs/dbraw/zinc/15/92/42/398159242.db2.gz RDGURCYWILVPJI-UMSGYPCISA-N 2 0 242.407 2.296 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]Cc1ccc(F)c(F)c1 ZINC000422907629 398157165 /nfs/dbraw/zinc/15/71/65/398157165.db2.gz XGTXIYADKKQZJB-IUCAKERBSA-N 2 0 228.286 2.180 20 0 BEADRP Cc1ccccc1C1(C[NH2+][C@@H](C)C2C[NH2+]C2)CC1 ZINC000422907327 398157363 /nfs/dbraw/zinc/15/73/63/398157363.db2.gz WYHYJCDMWXITOB-ZDUSSCGKSA-N 2 0 244.382 2.224 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CCOC1CCCCC1 ZINC000422941830 398159793 /nfs/dbraw/zinc/15/97/93/398159793.db2.gz IPSZMPDKWDSSGN-NEPJUHHUSA-N 2 0 228.380 2.051 20 0 BEADRP Cc1cc(C[NH2+]CC2=CC[N@H+](C)CC2)cs1 ZINC000294669419 178021146 /nfs/dbraw/zinc/02/11/46/178021146.db2.gz AIXBYTKPRJEHMV-UHFFFAOYSA-N 2 0 236.384 2.408 20 0 BEADRP Cc1cc(C)c(C[NH2+][C@H](C)CCCC[NH3+])cn1 ZINC000396993822 398168965 /nfs/dbraw/zinc/16/89/65/398168965.db2.gz VWSQYDFIPCWAIM-GFCCVEGCSA-N 2 0 235.375 2.306 20 0 BEADRP C[C@H](C[N@@H+]1C[C@H](C[NH3+])C[C@H]1C)C(C)(C)C ZINC000379814613 398170394 /nfs/dbraw/zinc/17/03/94/398170394.db2.gz PTZUNLMPGVRZRO-UTUOFQBUSA-N 2 0 212.381 2.338 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]C[C@H]1CC=CCC1 ZINC000422976843 398161434 /nfs/dbraw/zinc/16/14/34/398161434.db2.gz VQBKKHYNAZVXCW-RDBSUJKOSA-N 2 0 222.376 2.320 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]C[C@@H](C)CC(F)(F)F ZINC000423174525 398164021 /nfs/dbraw/zinc/16/40/21/398164021.db2.gz CIAXKJHKAAOLBX-CIUDSAMLSA-N 2 0 226.286 2.290 20 0 BEADRP Cc1cc(Cl)ccc1CN1C[C@H]([NH3+])[C@@H](C)C1 ZINC000235652434 178066890 /nfs/dbraw/zinc/06/68/90/178066890.db2.gz XBGPOQWFJDSJPL-GWCFXTLKSA-N 2 0 238.762 2.427 20 0 BEADRP CC[C@@H]([NH2+]CC1([NH3+])CCCCC1)C1CC1 ZINC000423174343 398164312 /nfs/dbraw/zinc/16/43/12/398164312.db2.gz ALEWMSFEXIVGDE-GFCCVEGCSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@@H](C[NH2+][C@@H](C)C[C@H](C)[NH3+])CC(F)(F)F ZINC000423174527 398164338 /nfs/dbraw/zinc/16/43/38/398164338.db2.gz CIAXKJHKAAOLBX-VGMNWLOBSA-N 2 0 226.286 2.290 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@H]1C(C)(C)C)C1C[NH2+]C1 ZINC000423174437 398164649 /nfs/dbraw/zinc/16/46/49/398164649.db2.gz CDKRGHHHZZIYQW-CYZMBNFOSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[NH2+]1)C1C(C)(C)C1(C)C ZINC000423233165 398165306 /nfs/dbraw/zinc/16/53/06/398165306.db2.gz JIBRNIHBPCBFJL-QWRGUYRKSA-N 2 0 224.392 2.399 20 0 BEADRP Cc1ncccc1C[NH2+]C1CCC([NH+](C)C)CC1 ZINC000421380688 192323785 /nfs/dbraw/zinc/32/37/85/192323785.db2.gz ZCODNTLTHNSETE-UHFFFAOYSA-N 2 0 247.386 2.352 20 0 BEADRP Cc1cc(N(C)CC2CC[NH+](C)CC2)cc[nH+]1 ZINC000274820903 178096901 /nfs/dbraw/zinc/09/69/01/178096901.db2.gz PLQWURVPIQOBKH-UHFFFAOYSA-N 2 0 233.359 2.168 20 0 BEADRP Cc1cc(N(C)C2C[C@H]3CC[C@@H](C2)[NH2+]3)cc[nH+]1 ZINC000162865482 178097141 /nfs/dbraw/zinc/09/71/41/178097141.db2.gz BNIPRGZKGPRJJN-ONXXMXGDSA-N 2 0 231.343 2.109 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCCC[C@@H]1C[NH3+])CC(F)F ZINC000647801218 398207633 /nfs/dbraw/zinc/20/76/33/398207633.db2.gz RPGXYIBZMATDBU-AXFHLTTASA-N 2 0 234.334 2.385 20 0 BEADRP C1=C[C@H]([NH+]2C[C@H]3C[NH2+]C[C@@H]3C2)CCCCC1 ZINC000380800369 398208269 /nfs/dbraw/zinc/20/82/69/398208269.db2.gz HBLDTPIKOLNFJG-MCIONIFRSA-N 2 0 220.360 2.027 20 0 BEADRP C1=C[C@H]([N@@H+]2C[C@H]3C[NH2+]C[C@H]3C2)CCCCC1 ZINC000380800370 398208761 /nfs/dbraw/zinc/20/87/61/398208761.db2.gz HBLDTPIKOLNFJG-MJBXVCDLSA-N 2 0 220.360 2.027 20 0 BEADRP C[N@@H+]1CCC[C@@H](CC[NH2+][C@@H]2CCC[C@H]3C[C@H]32)C1 ZINC000576362789 365578070 /nfs/dbraw/zinc/57/80/70/365578070.db2.gz UOSBEYXVALMPSV-BYNSBNAKSA-N 2 0 236.403 2.497 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H](CC)c1ccncc1 ZINC000576386354 365581551 /nfs/dbraw/zinc/58/15/51/365581551.db2.gz GUFMKHARIXJKAK-CYBMUJFWSA-N 2 0 221.348 2.122 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+][C@@H]1CCCc2cccnc21 ZINC000643512456 398224502 /nfs/dbraw/zinc/22/45/02/398224502.db2.gz LMXSPVZPTHISJL-BFHYXJOUSA-N 2 0 245.370 2.176 20 0 BEADRP CCC[C@@H](C)[N@@H+]1CC[C@H](C[NH+](C)CC)C1 ZINC000187707520 259304049 /nfs/dbraw/zinc/30/40/49/259304049.db2.gz SUOIYUUXAWCDRU-CHWSQXEVSA-N 2 0 212.381 2.449 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C2CCC([NH+](C)C)CC2)[C@H]1C ZINC000421364955 192333256 /nfs/dbraw/zinc/33/32/56/192333256.db2.gz ABWQOWBCFJNZIK-CJQNXBEJSA-N 2 0 224.392 2.493 20 0 BEADRP C[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)[C@@H]1C[C@H]1C ZINC000421371313 192335317 /nfs/dbraw/zinc/33/53/17/192335317.db2.gz JNJKBVYFKYMULF-KPHYFBGPSA-N 2 0 224.392 2.493 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]C[C@H]2CCCCO2)c2ccccc21 ZINC000252790959 136227014 /nfs/dbraw/zinc/22/70/14/136227014.db2.gz SWEPYNYPJLXDLL-KCPJHIHWSA-N 2 0 246.354 2.290 20 0 BEADRP c1ccc2c(c1)CC[C@@H]2[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000643534305 398239733 /nfs/dbraw/zinc/23/97/33/398239733.db2.gz QBRSYXQEXFOXSF-GJZGRUSLSA-N 2 0 242.366 2.406 20 0 BEADRP Fc1ccc(C[NH2+]CC2CC[NH2+]CC2)c(F)c1 ZINC000094010417 398244583 /nfs/dbraw/zinc/24/45/83/398244583.db2.gz GTMNPKZCBFSDSR-UHFFFAOYSA-N 2 0 240.297 2.054 20 0 BEADRP C([C@H]1CC[NH2+]C1)[N@@H+]1CCCC[C@H]1C1CCC1 ZINC000647997470 398255370 /nfs/dbraw/zinc/25/53/70/398255370.db2.gz GSDREJCESFMAGR-JSGCOSHPSA-N 2 0 222.376 2.251 20 0 BEADRP C([C@H]1CC[NH2+]C1)[N@@H+]1CCCC[C@@H]1C1CCC1 ZINC000647997469 398255373 /nfs/dbraw/zinc/25/53/73/398255373.db2.gz GSDREJCESFMAGR-GXTWGEPZSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@H](C[NH2+][C@@H](C)[C@@H]1CCCC[NH2+]1)C1CC1 ZINC000386090437 398263008 /nfs/dbraw/zinc/26/30/08/398263008.db2.gz IBILQXKYVZLGMM-MDZLAQPJSA-N 2 0 210.365 2.153 20 0 BEADRP Fc1ccc(C[NH2+]CC[C@H]2CC[NH2+]C2)c(F)c1 ZINC000259047502 349542741 /nfs/dbraw/zinc/54/27/41/349542741.db2.gz QAQWMZIAZNNKIS-SNVBAGLBSA-N 2 0 240.297 2.054 20 0 BEADRP CCC(CC)[N@H+](CCOC)C[C@@H]1CCC[NH2+]C1 ZINC000042681749 168374865 /nfs/dbraw/zinc/37/48/65/168374865.db2.gz RSLLRDNOXXOJJV-CYBMUJFWSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)[C@@H]1CCCC[C@H]1[NH2+][C@H]1CC[NH2+]C1 ZINC000251307756 398268634 /nfs/dbraw/zinc/26/86/34/398268634.db2.gz JHDLNWFINJHWCL-RWMBFGLXSA-N 2 0 210.365 2.153 20 0 BEADRP C1CC1[C@H]1CC[C@H]1[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000348109801 136234275 /nfs/dbraw/zinc/23/42/75/136234275.db2.gz ZITBKZLCCIZSGY-KBUPBQIOSA-N 2 0 234.387 2.391 20 0 BEADRP Cc1ccc2c(c1)CC[C@H]2[NH2+][C@H](C)C1C[NH2+]C1 ZINC000335602159 136235765 /nfs/dbraw/zinc/23/57/65/136235765.db2.gz XGJBEXOZYHLALW-IAQYHMDHSA-N 2 0 230.355 2.180 20 0 BEADRP C[C@H]([NH2+]CC1CCCC1)C1CC[NH+](C)CC1 ZINC000037257433 538962138 /nfs/dbraw/zinc/96/21/38/538962138.db2.gz RPMRWJKEGFNGSW-LBPRGKRZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]([NH2+]CC1CCCC1)C1CC[NH+](C)CC1 ZINC000037257435 538962486 /nfs/dbraw/zinc/96/24/86/538962486.db2.gz RPMRWJKEGFNGSW-GFCCVEGCSA-N 2 0 224.392 2.497 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H]1CCC[C@H]1C ZINC000083389772 398280503 /nfs/dbraw/zinc/28/05/03/398280503.db2.gz NUVFNGJUGRABEX-CHWSQXEVSA-N 2 0 212.381 2.497 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@@H](C)[C@@H](C[NH3+])C2)c(C)n1 ZINC000335614016 136237729 /nfs/dbraw/zinc/23/77/29/136237729.db2.gz NHXKWCRLSNABJM-ABAIWWIYSA-N 2 0 247.386 2.115 20 0 BEADRP CC[C@H](C)C[NH2+]C[C@@H]1CC[N@@H+](C(C)C)C1 ZINC000040622283 538971699 /nfs/dbraw/zinc/97/16/99/538971699.db2.gz DVLASFIIZGGXPS-STQMWFEESA-N 2 0 212.381 2.352 20 0 BEADRP CCOc1ccc(C[N@H+](C)C2CC[NH2+]CC2)cc1 ZINC000036300320 342809058 /nfs/dbraw/zinc/80/90/58/342809058.db2.gz HNNNCGWSDXEWNT-UHFFFAOYSA-N 2 0 248.370 2.269 20 0 BEADRP CC1(C[NH2+]CCN2CCCC(C)(C)C2)CC1 ZINC000309732262 342814146 /nfs/dbraw/zinc/81/41/46/342814146.db2.gz BLLISBQAODWEPN-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP CCSCCC[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000401001765 398288401 /nfs/dbraw/zinc/28/84/01/398288401.db2.gz BUDIUFFGIGYKAL-JHJVBQTASA-N 2 0 242.432 2.107 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC[C@H]1C)C1CC[NH+](C)CC1 ZINC000379774163 538980513 /nfs/dbraw/zinc/98/05/13/538980513.db2.gz CCGPYMYBGXIEGR-NQBHXWOUSA-N 2 0 210.365 2.105 20 0 BEADRP CCC1(C[NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)CC1 ZINC000222206579 259323468 /nfs/dbraw/zinc/32/34/68/259323468.db2.gz VQNWVSZGRLDZCM-NWDGAFQWSA-N 2 0 210.365 2.249 20 0 BEADRP CCC[C@H](C)CCC[NH+]1C[C@H]2C[NH2+]C[C@@H]2C1 ZINC000625096963 342852074 /nfs/dbraw/zinc/85/20/74/342852074.db2.gz HSDDUOVEMFXCHE-BFHYXJOUSA-N 2 0 224.392 2.354 20 0 BEADRP CC(C)[N@@H+]1CC[C@H](C[NH2+]C[C@H]2CCSC2)C1 ZINC000300231804 259326895 /nfs/dbraw/zinc/32/68/95/259326895.db2.gz IWYPRVVTNGZCAG-CHWSQXEVSA-N 2 0 242.432 2.059 20 0 BEADRP CC[C@H]1CCC[N@H+](C[C@@H]2CCC[NH2+]C2)C1 ZINC000036169893 342894442 /nfs/dbraw/zinc/89/44/42/342894442.db2.gz DQMJOFRFMSIZNX-QWHCGFSZSA-N 2 0 210.365 2.108 20 0 BEADRP CC(C)C1(C[NH2+][C@H]2CCC[C@H]([NH3+])C2)CC1 ZINC000232728135 342879348 /nfs/dbraw/zinc/87/93/48/342879348.db2.gz FELIBMYCWFOYPT-RYUDHWBXSA-N 2 0 210.365 2.282 20 0 BEADRP CC1(C[NH2+]Cc2ccc(C[NH3+])cc2)CC1 ZINC000232932607 342892106 /nfs/dbraw/zinc/89/21/06/342892106.db2.gz IRNRXSUBEYZQCV-UHFFFAOYSA-N 2 0 204.317 2.035 20 0 BEADRP CCC[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000134871909 342908930 /nfs/dbraw/zinc/90/89/30/342908930.db2.gz KUKRNAUGFUSGAA-OCCSQVGLSA-N 2 0 222.376 2.345 20 0 BEADRP CCO[C@H]1C[C@H]([NH2+]CCC[NH2+]C(C)C)C1(C)C ZINC000233760484 342912485 /nfs/dbraw/zinc/91/24/85/342912485.db2.gz YYXWWJYPWUQFBQ-STQMWFEESA-N 2 0 242.407 2.168 20 0 BEADRP CC[NH+]1CCC([NH2+]CCC2(OC)CCC2)CC1 ZINC000336662683 346872883 /nfs/dbraw/zinc/87/28/83/346872883.db2.gz UVNLGWHCTKIQGT-UHFFFAOYSA-N 2 0 240.391 2.020 20 0 BEADRP Cc1ccc(C[N@H+](C)CCC[NH3+])cc1Cl ZINC000234289576 342918597 /nfs/dbraw/zinc/91/85/97/342918597.db2.gz DYGGNQBXWIJBRC-UHFFFAOYSA-N 2 0 226.751 2.429 20 0 BEADRP CC1(C)COC[C@@H]1N[C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000313054180 259330178 /nfs/dbraw/zinc/33/01/78/259330178.db2.gz HQVDZAPEYVMUPO-MCIONIFRSA-N 2 0 246.354 2.146 20 0 BEADRP CSC[C@H](C)[NH2+][C@H](C)C1CC[NH+](C)CC1 ZINC000134014164 398328583 /nfs/dbraw/zinc/32/85/83/398328583.db2.gz KCBFBOLVVVDJPH-WDEREUQCSA-N 2 0 230.421 2.058 20 0 BEADRP Cc1cc(C)c(C[N@H+]2C[C@H]3C[NH2+]C[C@H]3C2)c(C)c1 ZINC000109683406 398327713 /nfs/dbraw/zinc/32/77/13/398327713.db2.gz IEPFVXMATSDZIW-GASCZTMLSA-N 2 0 244.382 2.263 20 0 BEADRP CC1(C)COC[C@@H]1N[C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000313054183 259330289 /nfs/dbraw/zinc/33/02/89/259330289.db2.gz HQVDZAPEYVMUPO-MJBXVCDLSA-N 2 0 246.354 2.146 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@]2(C)CCCOC2)CC1 ZINC000336321402 398330592 /nfs/dbraw/zinc/33/05/92/398330592.db2.gz PPTNDQHATVYEFY-CQSZACIVSA-N 2 0 240.391 2.018 20 0 BEADRP CCN(CC[NH2+]CCCC(C)C)C1CC1 ZINC000053377276 346888079 /nfs/dbraw/zinc/88/80/79/346888079.db2.gz HXZXEIHRUIXLAH-UHFFFAOYSA-N 2 0 212.381 2.497 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H]1CC[C@H]1C(C)(C)C ZINC000576814627 365691103 /nfs/dbraw/zinc/69/11/03/365691103.db2.gz FXMNNLJGFDILLL-NEPJUHHUSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H](F)CC[NH+]1CCC(C[NH+](C)C)CC1 ZINC000351849232 136257489 /nfs/dbraw/zinc/25/74/89/136257489.db2.gz DFCSJCXWSDTDGE-NSHDSACASA-N 2 0 216.344 2.008 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@H]2CC[C@H](C[NH3+])CC2)[C@H]1C ZINC000386277433 342994074 /nfs/dbraw/zinc/99/40/74/342994074.db2.gz QECFUBVFQRVDEK-ITGHMWBKSA-N 2 0 224.392 2.386 20 0 BEADRP C[C@@H]1C[NH+](Cc2ccc3c(c2)C[NH2+]CC3)C[C@H]1C ZINC000211967422 343017103 /nfs/dbraw/zinc/01/71/03/343017103.db2.gz RSSAORPTRDZZSI-CHWSQXEVSA-N 2 0 244.382 2.420 20 0 BEADRP CC1(C)C[C@H]1[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000045116848 534932060 /nfs/dbraw/zinc/93/20/60/534932060.db2.gz RTQDSGZKWSCWOI-CQSZACIVSA-N 2 0 245.370 2.439 20 0 BEADRP CC[NH+]1CCC([NH2+]CCSC(C)C)CC1 ZINC000308840358 346925277 /nfs/dbraw/zinc/92/52/77/346925277.db2.gz XZLMBYAVGMZQEQ-UHFFFAOYSA-N 2 0 230.421 2.202 20 0 BEADRP Cc1ccc(C[N@H+](C)CCC[NH3+])cc1C ZINC000049668648 343114302 /nfs/dbraw/zinc/11/43/02/343114302.db2.gz REYRHPYXVCSKNJ-UHFFFAOYSA-N 2 0 206.333 2.084 20 0 BEADRP C[N@@H+]1CCCC[C@H]1CC[NH+]1CC[C@H](C(F)F)C1 ZINC000677729299 488204496 /nfs/dbraw/zinc/20/44/96/488204496.db2.gz BUNUNYHOHPUMGE-RYUDHWBXSA-N 2 0 246.345 2.448 20 0 BEADRP C[C@H]([NH2+]CC1CC[NH2+]CC1)c1ccccc1F ZINC000094010225 343151833 /nfs/dbraw/zinc/15/18/33/343151833.db2.gz CVBULDFYSQALHM-NSHDSACASA-N 2 0 236.334 2.476 20 0 BEADRP C[N@H+](CCC[NH3+])Cc1ccc(F)c2cccnc12 ZINC000123342394 343162062 /nfs/dbraw/zinc/16/20/62/343162062.db2.gz UWSDFAFZABODEU-UHFFFAOYSA-N 2 0 247.317 2.155 20 0 BEADRP Cc1ccc(C[N@H+](C)C[C@H]2CCC[NH2+]C2)cc1 ZINC000020264747 343284101 /nfs/dbraw/zinc/28/41/01/343284101.db2.gz UXZHBPJNWSEFSC-HNNXBMFYSA-N 2 0 232.371 2.426 20 0 BEADRP CC(C)[N@H+](CC[C@@H]1CCC[NH2+]C1)CC1CC1 ZINC000051919308 343278757 /nfs/dbraw/zinc/27/87/57/343278757.db2.gz OVAHMZUHPHKYLW-ZDUSSCGKSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)c1ccoc1 ZINC000569833805 323042352 /nfs/dbraw/zinc/04/23/52/323042352.db2.gz AENDGVUMUWHBCK-RYUDHWBXSA-N 2 0 222.332 2.320 20 0 BEADRP C[NH2+]CCC1CC[NH+](CCC(C)C)CC1 ZINC000070534510 343332822 /nfs/dbraw/zinc/33/28/22/343332822.db2.gz PCGIIJGADIOWGH-UHFFFAOYSA-N 2 0 212.381 2.354 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+]CC1CC(F)(F)C1 ZINC000335613058 136295676 /nfs/dbraw/zinc/29/56/76/136295676.db2.gz RWLYBTLHCIWDAM-ONGXEEELSA-N 2 0 232.318 2.009 20 0 BEADRP CC[C@H]1CCC[C@H]([NH2+]CCC[NH+](C)C)C1 ZINC000070562242 343335173 /nfs/dbraw/zinc/33/51/73/343335173.db2.gz IVLYXTLGKJCNOF-STQMWFEESA-N 2 0 212.381 2.497 20 0 BEADRP CC1(C)CCCC[C@@H]1[NH2+]CC1([NH3+])CCC1 ZINC000335650236 136304806 /nfs/dbraw/zinc/30/48/06/136304806.db2.gz RPQQZCOAZMPOIH-NSHDSACASA-N 2 0 210.365 2.426 20 0 BEADRP CC1CCC([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)CC1 ZINC000335653355 136305588 /nfs/dbraw/zinc/30/55/88/136305588.db2.gz AFTUZZYUXFPOJO-LJZITESISA-N 2 0 222.376 2.438 20 0 BEADRP CCC[N@H+](CCC[NH+](C)C)C[C@H]1C[C@@H]1C ZINC000349344219 136342946 /nfs/dbraw/zinc/34/29/46/136342946.db2.gz HMEYGUMVPNKDNJ-QWHCGFSZSA-N 2 0 212.381 2.306 20 0 BEADRP CC(C)[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)C1CC1 ZINC000152473044 323046985 /nfs/dbraw/zinc/04/69/85/323046985.db2.gz CBAQYHSGINJPBW-SWLSCSKDSA-N 2 0 236.403 2.495 20 0 BEADRP C[N@H+](CC1CCCC1)C[C@]1(C)CC[NH2+]C1 ZINC000082493362 343442509 /nfs/dbraw/zinc/44/25/09/343442509.db2.gz NZHUSEDBVPAZKP-CYBMUJFWSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]CCC[NH+](C)C)[C@@H]1C ZINC000082857406 343468744 /nfs/dbraw/zinc/46/87/44/343468744.db2.gz DBWCMAHLRMJGQW-JHJVBQTASA-N 2 0 212.381 2.352 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+]Cc1ccc(C[NH3+])cc1 ZINC000580552039 365759035 /nfs/dbraw/zinc/75/90/35/365759035.db2.gz LGTPDWKHXBTWPZ-ZIAGYGMSSA-N 2 0 218.344 2.424 20 0 BEADRP CCN1C[C@H](C)[C@H]([NH2+]C[C@@H](C)C(C)C)C1 ZINC000379948011 365759980 /nfs/dbraw/zinc/75/99/80/365759980.db2.gz RRSAXNBVTYVVSY-FRRDWIJNSA-N 2 0 212.381 2.208 20 0 BEADRP C[C@H]1CC[N@H+](CCC2CCC2)C[C@@H]1C[NH3+] ZINC000398701227 488222197 /nfs/dbraw/zinc/22/21/97/488222197.db2.gz KBUWTBZEIMGUGB-AAEUAGOBSA-N 2 0 210.365 2.093 20 0 BEADRP CCC[C@@H](C)[NH2+][C@H](C)C1CC[NH+](C)CC1 ZINC000037209013 537791147 /nfs/dbraw/zinc/79/11/47/537791147.db2.gz LQEHKJWGWAWLSZ-VXGBXAGGSA-N 2 0 212.381 2.495 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@@H]1CCc2ccccc2C1 ZINC000049554209 343602756 /nfs/dbraw/zinc/60/27/56/343602756.db2.gz HZRUXQBFVIHDJL-CZUORRHYSA-N 2 0 246.398 2.474 20 0 BEADRP CC1(C)CC(C[NH2+][C@H]2CCC[C@@H]2C[NH3+])C1 ZINC000577054379 365795208 /nfs/dbraw/zinc/79/52/08/365795208.db2.gz GASLCIZQOCQJLO-NEPJUHHUSA-N 2 0 210.365 2.140 20 0 BEADRP CC1(C)CC(C[NH2+][C@H]2CCC[C@H]2C[NH3+])C1 ZINC000577054381 365795370 /nfs/dbraw/zinc/79/53/70/365795370.db2.gz GASLCIZQOCQJLO-RYUDHWBXSA-N 2 0 210.365 2.140 20 0 BEADRP C[C@@H]1CN(C)CC[C@@H]1[NH2+][C@H]1CC=CCC1 ZINC000090035804 343749839 /nfs/dbraw/zinc/74/98/39/343749839.db2.gz JBPTWSKNXNWMFB-AGIUHOORSA-N 2 0 208.349 2.025 20 0 BEADRP CCc1ccc(C[N@@H+]2CCC[C@@H](C[NH3+])C2)cc1 ZINC000044527783 343781234 /nfs/dbraw/zinc/78/12/34/343781234.db2.gz PBCQXKULBZXKSP-HNNXBMFYSA-N 2 0 232.371 2.420 20 0 BEADRP C[C@H](C[NH+]1CCC(C[NH3+])CC1)c1ccccc1 ZINC000044512308 343781538 /nfs/dbraw/zinc/78/15/38/343781538.db2.gz ROBPTFKDADHZJE-CYBMUJFWSA-N 2 0 232.371 2.461 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+]CC1=CC[N@H+](C)CC1 ZINC000336665059 537816540 /nfs/dbraw/zinc/81/65/40/537816540.db2.gz LKBNVBQAPVKWGX-KBPBESRZSA-N 2 0 222.376 2.273 20 0 BEADRP C[NH+]1CCC(CC[NH2+]CC2(C)CCC2)CC1 ZINC000336691155 537827571 /nfs/dbraw/zinc/82/75/71/537827571.db2.gz WUNNKSUVPVUCQE-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP COc1cc(C)ccc1[C@H](C)[NH2+]C[C@H](C)C[NH3+] ZINC000570561976 323063101 /nfs/dbraw/zinc/06/31/01/323063101.db2.gz CDDBNDMLUBFNOD-NEPJUHHUSA-N 2 0 236.359 2.249 20 0 BEADRP CC(C)=CCC[N@@H+]1C[C@@H]2CCC[C@@]2([NH3+])C1 ZINC000621784631 343907849 /nfs/dbraw/zinc/90/78/49/343907849.db2.gz RSKAIWMUROVPGF-QWHCGFSZSA-N 2 0 208.349 2.156 20 0 BEADRP C/C=C/C[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000384716508 343960122 /nfs/dbraw/zinc/96/01/22/343960122.db2.gz FZCKUJYJOPUAFF-NSCUHMNNSA-N 2 0 231.343 2.216 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@H]1CC[C@H]1C1CC1 ZINC000336753969 537840287 /nfs/dbraw/zinc/84/02/87/537840287.db2.gz HEBZEXDYNMZONP-STQMWFEESA-N 2 0 210.365 2.106 20 0 BEADRP Cc1cnccc1C[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000634734087 344114559 /nfs/dbraw/zinc/11/45/59/344114559.db2.gz WLWMXMIHIUYTQY-CQSZACIVSA-N 2 0 247.386 2.258 20 0 BEADRP CC1(C[NH2+][C@@H]2CC[NH2+]CC(C)(C)C2)CC1 ZINC000634733977 344114601 /nfs/dbraw/zinc/11/46/01/344114601.db2.gz TYTSQFNKTLLMNE-LLVKDONJSA-N 2 0 210.365 2.154 20 0 BEADRP CCC(CC)C[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000130406411 344220327 /nfs/dbraw/zinc/22/03/27/344220327.db2.gz HXSGAXCHNFNCAT-CYBMUJFWSA-N 2 0 212.381 2.402 20 0 BEADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+]C[C@@H]2C[C@H]2C)C1 ZINC000336691816 192069386 /nfs/dbraw/zinc/06/93/86/192069386.db2.gz WYZJPLUFHVWFMT-RDBSUJKOSA-N 2 0 224.392 2.352 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]CCc2ccccc2F)C1 ZINC000093209728 344312243 /nfs/dbraw/zinc/31/22/43/344312243.db2.gz GKTZXNQQPJAUQJ-CHWSQXEVSA-N 2 0 236.334 2.228 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]CCc2ccccc2F)C1 ZINC000093209722 344312272 /nfs/dbraw/zinc/31/22/72/344312272.db2.gz GKTZXNQQPJAUQJ-QWHCGFSZSA-N 2 0 236.334 2.228 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000387729680 347046771 /nfs/dbraw/zinc/04/67/71/347046771.db2.gz RSAZZNODOKKJFZ-FVCCEPFGSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CC2CCC2)CN1C1CC1 ZINC000132863927 344309919 /nfs/dbraw/zinc/30/99/19/344309919.db2.gz ONENFHJQTVEEIY-ZYHUDNBSSA-N 2 0 208.349 2.001 20 0 BEADRP C[C@@H]1C[C@H](C[NH+]2C[C@@H](C)S[C@H](C)C2)CC[NH2+]1 ZINC000300056913 344384033 /nfs/dbraw/zinc/38/40/33/344384033.db2.gz WFBPDXIQSQSZEK-FDYHWXHSSA-N 2 0 242.432 2.200 20 0 BEADRP Cc1nc(C)c(C)c(N[C@H]2CC[C@H]([NH3+])CC2)n1 ZINC000634813614 344399342 /nfs/dbraw/zinc/39/93/42/344399342.db2.gz RKRZIPSBVHFQQO-HAQNSBGRSA-N 2 0 234.347 2.084 20 0 BEADRP C[N@H+](CC(C)(C)C)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000041051911 344416495 /nfs/dbraw/zinc/41/64/95/344416495.db2.gz KUZLFUYNHGAYQJ-FOSCPWQOSA-N 2 0 210.365 2.247 20 0 BEADRP CC(C)C[N@H+](C[C@@H]1CCC[NH2+]C1)C1CC1 ZINC000042559896 344458360 /nfs/dbraw/zinc/45/83/60/344458360.db2.gz RHKHNROQKDUASW-GFCCVEGCSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]CCCF ZINC000389331099 344459891 /nfs/dbraw/zinc/45/98/91/344459891.db2.gz LSBQSZKBCBJWRI-RYUDHWBXSA-N 2 0 216.344 2.246 20 0 BEADRP CCC[NH+]1CCC(C[NH2+]CC2(C)CC2)CC1 ZINC000309965010 259378821 /nfs/dbraw/zinc/37/88/21/259378821.db2.gz NAVSMWDBIBVOOR-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP [NH3+]C1(C[NH2+]CCCOCc2ccccc2)CCC1 ZINC000390018817 259379256 /nfs/dbraw/zinc/37/92/56/259379256.db2.gz AACNTFRFFGQNOK-UHFFFAOYSA-N 2 0 248.370 2.064 20 0 BEADRP Cc1ccc(C[NH2+]CCC[NH2+]C2CC2)s1 ZINC000050226775 344743068 /nfs/dbraw/zinc/74/30/68/344743068.db2.gz UCEPIKYAWBKAEU-UHFFFAOYSA-N 2 0 224.373 2.288 20 0 BEADRP CC[NH+](CC)CCOC1CC[NH+](C(C)C)CC1 ZINC000075007471 344767236 /nfs/dbraw/zinc/76/72/36/344767236.db2.gz IJWBENTYGHQROG-UHFFFAOYSA-N 2 0 242.407 2.218 20 0 BEADRP C[NH+]1CCC(C[NH2+]C/C=C\c2ccncc2)CC1 ZINC000487268768 530049471 /nfs/dbraw/zinc/04/94/71/530049471.db2.gz DFOYADGXLWCACD-IHWYPQMZSA-N 2 0 245.370 2.026 20 0 BEADRP CC[NH+]1CCC([NH2+]CCCC(C)(F)F)CC1 ZINC000390099556 259380347 /nfs/dbraw/zinc/38/03/47/259380347.db2.gz OTMYJOJEHSHZBC-UHFFFAOYSA-N 2 0 234.334 2.496 20 0 BEADRP CSCC[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000166365971 344875668 /nfs/dbraw/zinc/87/56/68/344875668.db2.gz HTRNBUQUWMVIBD-UHFFFAOYSA-N 2 0 230.421 2.202 20 0 BEADRP c1cc(C[NH2+]CCCCC[NH+]2CCCC2)no1 ZINC000634982467 345162858 /nfs/dbraw/zinc/16/28/58/345162858.db2.gz MJAXHZABBCDRDH-UHFFFAOYSA-N 2 0 237.347 2.030 20 0 BEADRP CC1CCC(C)([NH2+]CC23CC(C2)C[NH2+]3)CC1 ZINC000634993273 345189636 /nfs/dbraw/zinc/18/96/36/345189636.db2.gz PKGQOZBQSPHINI-UHFFFAOYSA-N 2 0 222.376 2.297 20 0 BEADRP C([N@@H+]1CCC[C@@H]2CCC[C@@H]21)C12CC(C1)C[NH2+]2 ZINC000634992153 345179853 /nfs/dbraw/zinc/17/98/53/345179853.db2.gz FYKMKVQSUXFPOZ-QPPOZKHWSA-N 2 0 220.360 2.003 20 0 BEADRP C([N@@H+]1CCC[C@H]2CCC[C@@H]21)C12CC(C1)C[NH2+]2 ZINC000634992152 345179915 /nfs/dbraw/zinc/17/99/15/345179915.db2.gz FYKMKVQSUXFPOZ-DKNRTOFZSA-N 2 0 220.360 2.003 20 0 BEADRP C([N@@H+]1CCC[C@@H]2CCC[C@H]21)C12CC(C1)C[NH2+]2 ZINC000634992154 345179992 /nfs/dbraw/zinc/17/99/92/345179992.db2.gz FYKMKVQSUXFPOZ-YIFLHPOLSA-N 2 0 220.360 2.003 20 0 BEADRP C1CC12CCC[C@@H]2[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000634997073 345193997 /nfs/dbraw/zinc/19/39/97/345193997.db2.gz CEDUWSXKJHUWAF-DGAVXFQQSA-N 2 0 234.387 2.297 20 0 BEADRP COc1ccc(C[N@H+]2C[C@@H](C[NH3+])[C@H](C)C2)cc1C ZINC000634998154 345197067 /nfs/dbraw/zinc/19/70/67/345197067.db2.gz BMDVDFQNAVSIOM-TZMCWYRMSA-N 2 0 248.370 2.030 20 0 BEADRP C1CC12CCC[C@H]2[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000634998049 345197307 /nfs/dbraw/zinc/19/73/07/345197307.db2.gz ZTRVOEFXMQDBJV-VXGBXAGGSA-N 2 0 208.349 2.051 20 0 BEADRP CC(C)C[C@H]([NH3+])C[NH2+][C@@]12C[C@@H]1CCCC2 ZINC000635001286 345197527 /nfs/dbraw/zinc/19/75/27/345197527.db2.gz MYURTFBZYIGUGK-AVGNSLFASA-N 2 0 210.365 2.282 20 0 BEADRP CCc1ccc(C[N@H+]2C[C@@H](C[NH3+])[C@H](C)C2)s1 ZINC000634998167 345197546 /nfs/dbraw/zinc/19/75/46/345197546.db2.gz BTJGHYYNNDMFQW-GHMZBOCLSA-N 2 0 238.400 2.337 20 0 BEADRP C[C@@H]1C[N@H+](C/C=C\c2ccccc2)C[C@H]1C[NH3+] ZINC000634998233 345197959 /nfs/dbraw/zinc/19/79/59/345197959.db2.gz CITPPGOSINXVLR-VZFGUZNESA-N 2 0 230.355 2.226 20 0 BEADRP [NH3+]CC1CCC([NH2+][C@H]2CCCC23CC3)CC1 ZINC000634998735 345199146 /nfs/dbraw/zinc/19/91/46/345199146.db2.gz KGPFBUMPBCSBQL-BPCQOVAHSA-N 2 0 222.376 2.426 20 0 BEADRP CC[C@](C)([NH2+]CCC[NH3+])c1ccc(F)cc1 ZINC000634999155 345199613 /nfs/dbraw/zinc/19/96/13/345199613.db2.gz QSKLURAHMFGSAJ-ZDUSSCGKSA-N 2 0 224.323 2.389 20 0 BEADRP Cc1cccc(C[N@H+]2C[C@H](C)[C@H](C[NH3+])C2)c1C ZINC000634999871 345201126 /nfs/dbraw/zinc/20/11/26/345201126.db2.gz BKPQJXSXFCFNIB-SWLSCSKDSA-N 2 0 232.371 2.330 20 0 BEADRP C[C@H]1C[C@H](C[NH+]2CCC(C)(F)CC2)CC[NH2+]1 ZINC000635001527 345201316 /nfs/dbraw/zinc/20/13/16/345201316.db2.gz CHZWJQQEWKSVFP-NWDGAFQWSA-N 2 0 228.355 2.199 20 0 BEADRP C[C@@H]1C[C@H](C[NH2+][C@@]23C[C@@H]2CCCC3)CC[NH2+]1 ZINC000635001147 345202950 /nfs/dbraw/zinc/20/29/50/345202950.db2.gz IFJHLBGPOZYKMN-MQYQWHSLSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H]([NH2+][C@H]1CCCC12CC2)[C@@H]1CCC[NH2+]1 ZINC000635004144 345206824 /nfs/dbraw/zinc/20/68/24/345206824.db2.gz NIZKQMVSGFFRPZ-SRVKXCTJSA-N 2 0 208.349 2.049 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCCC12CC2)[C@@H]1CCC[NH2+]1 ZINC000635004148 345206927 /nfs/dbraw/zinc/20/69/27/345206927.db2.gz NIZKQMVSGFFRPZ-WOPDTQHZSA-N 2 0 208.349 2.049 20 0 BEADRP CC[C@H]([NH2+][C@H]1CCCC12CC2)[C@@H]1CCC[NH2+]1 ZINC000635004481 345207497 /nfs/dbraw/zinc/20/74/97/345207497.db2.gz PFSUHTUTAFZJAG-AVGNSLFASA-N 2 0 222.376 2.439 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+][C@@H]1CCO[C@H]1c1ccccc1 ZINC000635004223 345207610 /nfs/dbraw/zinc/20/76/10/345207610.db2.gz NOLDUJYGHHPLDE-OSRDXIQISA-N 2 0 248.370 2.232 20 0 BEADRP CC[C@H]1CC[C@H]1[NH2+][C@H]1CC[C@H](C[NH3+])CC1 ZINC000635005040 345209501 /nfs/dbraw/zinc/20/95/01/345209501.db2.gz LJSFZXKQMHEXNP-ZDEQEGDKSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)[C@H]1C[C@H]1C ZINC000635005532 345209592 /nfs/dbraw/zinc/20/95/92/345209592.db2.gz OQQVZVYSSGZGKX-VEGXAWMVSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)[C@H]1C[C@H]1C ZINC000635005529 345209640 /nfs/dbraw/zinc/20/96/40/345209640.db2.gz OQQVZVYSSGZGKX-MLGHIDQZSA-N 2 0 210.365 2.138 20 0 BEADRP CCC[C@H](CCO)[NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000635005980 345209664 /nfs/dbraw/zinc/20/96/64/345209664.db2.gz XCGZDQIGHBKSRF-DFBGVHRSSA-N 2 0 248.370 2.272 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)[C@@H]1C[C@H]1C ZINC000635005530 345209942 /nfs/dbraw/zinc/20/99/42/345209942.db2.gz OQQVZVYSSGZGKX-NZEXEKPDSA-N 2 0 210.365 2.138 20 0 BEADRP Cc1cc([C@H](C)[NH2+][C@H]2CC[C@H](C[NH3+])CC2)no1 ZINC000635005865 345210027 /nfs/dbraw/zinc/21/00/27/345210027.db2.gz PSPMCGKTTYFXFK-SRVKXCTJSA-N 2 0 237.347 2.151 20 0 BEADRP C[C@H]1CCC[C@H]1[NH2+][C@H]1CC[C@H](C[NH3+])CC1 ZINC000635009789 345211923 /nfs/dbraw/zinc/21/19/23/345211923.db2.gz ZSCWNVGPPUHOEK-ZDEQEGDKSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CC[C@H]1CNc2ccccc21 ZINC000635010078 345212093 /nfs/dbraw/zinc/21/20/93/345212093.db2.gz XYXZJZPIJCJWOG-XQQFMLRXSA-N 2 0 247.386 2.301 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC[NH2+]CC(C)(C)C1)C1CC1 ZINC000635011123 345212974 /nfs/dbraw/zinc/21/29/74/345212974.db2.gz MHBATPVWVMNCNK-ZYHUDNBSSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)[C@@H](C)[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000635012630 345214618 /nfs/dbraw/zinc/21/46/18/345214618.db2.gz UUFYOVUJMJSHED-NEPJUHHUSA-N 2 0 212.381 2.399 20 0 BEADRP CC(C)C[NH2+]CC(C)(C)C[NH+]1CCCC1 ZINC000051208072 345314080 /nfs/dbraw/zinc/31/40/80/345314080.db2.gz XYKJWSHRILXYAS-UHFFFAOYSA-N 2 0 212.381 2.354 20 0 BEADRP c1cn(CC[N@@H+]2CCCC3(CC3)CC2)cn1 ZINC000626114513 345314542 /nfs/dbraw/zinc/31/45/42/345314542.db2.gz JKYQGVZVACHYDB-UHFFFAOYSA-N 2 0 219.332 2.149 20 0 BEADRP CC(C)CC[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C)C1 ZINC000158612150 345357284 /nfs/dbraw/zinc/35/72/84/345357284.db2.gz AYPGVLVFQCYHSV-ZIAGYGMSSA-N 2 0 224.392 2.449 20 0 BEADRP CCOC(C)(C)C[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000159165037 345413989 /nfs/dbraw/zinc/41/39/89/345413989.db2.gz BZXDQYAOEMBKTD-UHFFFAOYSA-N 2 0 242.407 2.264 20 0 BEADRP CCOC(C)(C)C[NH2+][C@H]1C[C@@H](C)N(C2CC2)C1 ZINC000159251249 345419668 /nfs/dbraw/zinc/41/96/68/345419668.db2.gz RFMNJKHZLCRSRZ-NEPJUHHUSA-N 2 0 240.391 2.016 20 0 BEADRP CCOC(C)(C)C[NH2+][C@@H]1C[C@H](C)N(C2CC2)C1 ZINC000159250813 345419998 /nfs/dbraw/zinc/41/99/98/345419998.db2.gz RFMNJKHZLCRSRZ-NWDGAFQWSA-N 2 0 240.391 2.016 20 0 BEADRP CCOC(C)(C)C[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000159307471 345421765 /nfs/dbraw/zinc/42/17/65/345421765.db2.gz RMQKLACBZCGNJY-QWHCGFSZSA-N 2 0 240.391 2.018 20 0 BEADRP c1cnc2c(c1)cccc2C[NH2+]C1CC[NH2+]CC1 ZINC000159308784 345422743 /nfs/dbraw/zinc/42/27/43/345422743.db2.gz WJJKCIWYVHPROJ-UHFFFAOYSA-N 2 0 241.338 2.076 20 0 BEADRP CC(C)C[N@@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000081634498 345488543 /nfs/dbraw/zinc/48/85/43/345488543.db2.gz FWQPWETUNNWRKW-CQSZACIVSA-N 2 0 224.392 2.306 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000081636369 345488807 /nfs/dbraw/zinc/48/88/07/345488807.db2.gz AKYXCMLBQAYLRP-CYBMUJFWSA-N 2 0 210.365 2.060 20 0 BEADRP COCC[C@@H](C)[NH2+]C1CCC(C[NH+](C)C)CC1 ZINC000090668724 345574715 /nfs/dbraw/zinc/57/47/15/345574715.db2.gz SXDWQXWIFCOLED-IYXRBSQSSA-N 2 0 242.407 2.121 20 0 BEADRP Cc1ccc([C@H](C)[NH2+]C[C@@H](C)C[NH3+])cc1 ZINC000309013154 178889555 /nfs/dbraw/zinc/88/95/55/178889555.db2.gz YDOGSQURYXDPBO-RYUDHWBXSA-N 2 0 206.333 2.240 20 0 BEADRP CCCC(O)(CCC)C[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000577076471 365805937 /nfs/dbraw/zinc/80/59/37/365805937.db2.gz HKEVQXWCGNHTAU-OLZOCXBDSA-N 2 0 242.407 2.177 20 0 BEADRP CCC[N@H+](CC)CCC[NH+](CC)CC ZINC000219260908 345745592 /nfs/dbraw/zinc/74/55/92/345745592.db2.gz TYFXYJLYKMSPGV-UHFFFAOYSA-N 2 0 200.370 2.450 20 0 BEADRP CCC[C@@H]([NH2+]CCCC[NH3+])c1ccccn1 ZINC000223568046 345749144 /nfs/dbraw/zinc/74/91/44/345749144.db2.gz ZIOJEYQFFAKETM-GFCCVEGCSA-N 2 0 221.348 2.251 20 0 BEADRP CC(C)C1CCC([NH2+]CC2C[NH2+]C2)CC1 ZINC000204892393 345732173 /nfs/dbraw/zinc/73/21/73/345732173.db2.gz SYDBYOGTXSTNFX-UHFFFAOYSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)CC[NH+](C)C)C1CC(F)(F)C1 ZINC000628210187 345812514 /nfs/dbraw/zinc/81/25/14/345812514.db2.gz KQGOPKDNZLHNJW-VHSXEESVSA-N 2 0 234.334 2.350 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@@H]2CC[C@@H](C)C2)CC1 ZINC000070643701 345793316 /nfs/dbraw/zinc/79/33/16/345793316.db2.gz FDRPFUJCLLNMHL-TZMCWYRMSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H](C)[C@@H](C)[NH2+]CCC1=CC[NH2+]CC1 ZINC000319178521 259386500 /nfs/dbraw/zinc/38/65/00/259386500.db2.gz NWQIZBGHABRZEF-VXGBXAGGSA-N 2 0 210.365 2.320 20 0 BEADRP C[C@@H](CC1CCC1)[NH2+]C[C@@H]1CCCN1C ZINC000166878406 345925288 /nfs/dbraw/zinc/92/52/88/345925288.db2.gz LEHTWAWSCUCLHB-AAEUAGOBSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H]1CCC[N@H+](C[C@@H]2CCCC[NH2+]C2)[C@H]1C ZINC000669378551 537969326 /nfs/dbraw/zinc/96/93/26/537969326.db2.gz GODLHYWPBQHANE-HZSPNIEDSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1cccc(CC[NH2+][C@@H]2CN(C)C[C@H]2C)c1 ZINC000358078627 179059970 /nfs/dbraw/zinc/05/99/70/179059970.db2.gz DILMVVGMZRCPTL-UKRRQHHQSA-N 2 0 232.371 2.077 20 0 BEADRP CC(C)[N@H+](C)CC1CCN(CC(F)F)CC1 ZINC000603410457 349959861 /nfs/dbraw/zinc/95/98/61/349959861.db2.gz CRQQDQXYDDQNJT-UHFFFAOYSA-N 2 0 234.334 2.304 20 0 BEADRP Cc1cccc(C[N@@H+]2CC[C@@]3(CC[NH2+]C3)C2)c1 ZINC000031994556 179082421 /nfs/dbraw/zinc/08/24/21/179082421.db2.gz FYRIYXLPXCYYNJ-OAHLLOKOSA-N 2 0 230.355 2.180 20 0 BEADRP Cc1cccc(C[NH2+]CC2=CC[N@H+](C)CC2)c1 ZINC000271822905 179089234 /nfs/dbraw/zinc/08/92/34/179089234.db2.gz NCHPDJNWQHXZHE-UHFFFAOYSA-N 2 0 230.355 2.347 20 0 BEADRP Cc1cccc(C[NH2+]CC2CC[NH+](C)CC2)c1 ZINC000044515307 179090256 /nfs/dbraw/zinc/09/02/56/179090256.db2.gz AOJYTRZYMHOSDV-UHFFFAOYSA-N 2 0 232.371 2.426 20 0 BEADRP CC[NH+](CC)CCC[N@H+](CC)C[C@@H]1CCCO1 ZINC000191779217 259389769 /nfs/dbraw/zinc/38/97/69/259389769.db2.gz DADMUMKRPIEKND-AWEZNQCLSA-N 2 0 242.407 2.219 20 0 BEADRP CO[C@H](C[NH2+][C@@H]1C[C@H]([NH3+])C1(C)C)c1ccccc1 ZINC000641801100 362755553 /nfs/dbraw/zinc/75/55/53/362755553.db2.gz NBYMOGMNNLOWQI-HZSPNIEDSA-N 2 0 248.370 2.090 20 0 BEADRP Cc1cc(C)c(C[NH2+][C@H]2C[C@@H]([NH3+])C2(C)C)c(C)n1 ZINC000641801992 362758035 /nfs/dbraw/zinc/75/80/35/362758035.db2.gz XIYXCMDIPPMNQX-KGLIPLIRSA-N 2 0 247.386 2.222 20 0 BEADRP CC1(C)c2ccccc2CC[N@H+]1C[C@@H]1CC[NH2+]C1 ZINC000641802131 362758579 /nfs/dbraw/zinc/75/85/79/362758579.db2.gz XWTHCGPRIHCHHY-CYBMUJFWSA-N 2 0 244.382 2.389 20 0 BEADRP Cc1cc(CN2[C@@H](C)[C@H](C)CC[C@H]2C[NH3+])ccn1 ZINC000641806405 362764847 /nfs/dbraw/zinc/76/48/47/362764847.db2.gz RQZBKVHLRBCZFM-ZLDLUXBVSA-N 2 0 247.386 2.338 20 0 BEADRP C[C@H](C[N@@H+]1C[C@@H](C[NH3+])C[C@H]1C)c1ccccc1 ZINC000216056198 349971784 /nfs/dbraw/zinc/97/17/84/349971784.db2.gz VKIQLAPYQKBGDH-MGPQQGTHSA-N 2 0 232.371 2.459 20 0 BEADRP Cc1cccc(N2CC[C@@]3(C2)CCC[N@@H+](C)C3)n1 ZINC000292786994 179124286 /nfs/dbraw/zinc/12/42/86/179124286.db2.gz MGXCVEUIGXMACI-HNNXBMFYSA-N 2 0 245.370 2.312 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCC[C@H]2C[C@H]21)C[NH+]1CCCC1 ZINC000380055721 365829785 /nfs/dbraw/zinc/82/97/85/365829785.db2.gz NFIWDWRFZSIXOJ-LXTVHRRPSA-N 2 0 236.403 2.497 20 0 BEADRP C(C1CC[NH2+]CC1)[N@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000178973701 346729340 /nfs/dbraw/zinc/72/93/40/346729340.db2.gz FHMKDQXBRHBIIJ-OKILXGFUSA-N 2 0 222.376 2.108 20 0 BEADRP Cc1cccc(NC[C@@H]2CCC[C@H]([NH3+])C2)[nH+]1 ZINC000227669522 179147336 /nfs/dbraw/zinc/14/73/36/179147336.db2.gz GCRAFEBVXXFLET-NEPJUHHUSA-N 2 0 219.332 2.319 20 0 BEADRP C[C@@H]1OCC[C@]1(C)[NH2+]CC[C@H]1CCCC[N@@H+]1C ZINC000300422528 346746280 /nfs/dbraw/zinc/74/62/80/346746280.db2.gz HOUFCWFYDAAVRW-MJBXVCDLSA-N 2 0 240.391 2.018 20 0 BEADRP Cc1cccc(OCC[N@H+]2CC[C@@H]([NH3+])C[C@@H]2C)c1 ZINC000042896906 179166511 /nfs/dbraw/zinc/16/65/11/179166511.db2.gz NECPUYJBHXJNAD-UONOGXRCSA-N 2 0 248.370 2.185 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@@H]1C ZINC000387970941 347138168 /nfs/dbraw/zinc/13/81/68/347138168.db2.gz GBNXKDXUPSABQK-MQLXINIDSA-N 2 0 224.392 2.351 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]Cc2ccc3c(c2)COC3)C1 ZINC000577204757 365875704 /nfs/dbraw/zinc/87/57/04/365875704.db2.gz IFJPBQVIMMEKTK-GJZGRUSLSA-N 2 0 246.354 2.076 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]Cc2ccc3c(c2)COC3)C1 ZINC000577204758 365875770 /nfs/dbraw/zinc/87/57/70/365875770.db2.gz IFJPBQVIMMEKTK-HUUCEWRRSA-N 2 0 246.354 2.076 20 0 BEADRP Cc1cccc([C@@H](C)[N@@H+]2CCCO[C@@H](C[NH3+])C2)c1 ZINC000313352779 179178999 /nfs/dbraw/zinc/17/89/99/179178999.db2.gz LTDOBSNNVSFANF-HIFRSBDPSA-N 2 0 248.370 2.106 20 0 BEADRP CC(C)[C@@H]([NH2+]C[C@@H]1CCC[NH2+]C1)C1CC1 ZINC000324209178 323136095 /nfs/dbraw/zinc/13/60/95/323136095.db2.gz CQGUHTDKGKSPFH-DGCLKSJQSA-N 2 0 210.365 2.010 20 0 BEADRP CC(F)(F)CCC[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000390253088 347294521 /nfs/dbraw/zinc/29/45/21/347294521.db2.gz VDOYEDZLOUYLNI-ZJUUUORDSA-N 2 0 220.307 2.281 20 0 BEADRP c1csc(C[NH2+]CCC[NH+]2CCCC2)c1 ZINC000020128956 347409078 /nfs/dbraw/zinc/40/90/78/347409078.db2.gz IVOUSKQTXAMGRM-UHFFFAOYSA-N 2 0 224.373 2.324 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000166809312 136745279 /nfs/dbraw/zinc/74/52/79/136745279.db2.gz KYSFZPHFDBSNKX-XGFWRYKXSA-N 2 0 222.376 2.153 20 0 BEADRP C[N@H+]1CC=C(C[NH2+]C(C2CC2)C2CC2)CC1 ZINC000390508129 347372949 /nfs/dbraw/zinc/37/29/49/347372949.db2.gz YBCOBUAUYDJWKK-UHFFFAOYSA-N 2 0 220.360 2.027 20 0 BEADRP C[C@@H](CCC(F)(F)F)[NH2+]C[C@@H]1CCCN1C ZINC000390681394 347425993 /nfs/dbraw/zinc/42/59/93/347425993.db2.gz ZXVPMFCNHIRAKH-UWVGGRQHSA-N 2 0 238.297 2.401 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CC(C1CC1)C1CC1 ZINC000577214322 365884275 /nfs/dbraw/zinc/88/42/75/365884275.db2.gz AYZXYHNWBWRCOL-UWVGGRQHSA-N 2 0 210.365 2.138 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]CCOCC1CCC1 ZINC000577214612 365884413 /nfs/dbraw/zinc/88/44/13/365884413.db2.gz PTUSFNQEOBHVDD-KGLIPLIRSA-N 2 0 240.391 2.053 20 0 BEADRP Cc1ccccc1C[NH2+]CCCC[NH+](C)C ZINC000045598378 179280844 /nfs/dbraw/zinc/28/08/44/179280844.db2.gz XFBJHPZBZZSRMX-UHFFFAOYSA-N 2 0 220.360 2.426 20 0 BEADRP Cc1ccccc1C[N@@H+]1CC[C@]2(CC[NH2+]C2)C1 ZINC000031994570 179275492 /nfs/dbraw/zinc/27/54/92/179275492.db2.gz WZCRCJHCLXTUJJ-HNNXBMFYSA-N 2 0 230.355 2.180 20 0 BEADRP CCS[C@@H]1CC[C@@H]([N@H+](C)C[C@H]2CC[NH2+]C2)C1 ZINC000592476775 347791238 /nfs/dbraw/zinc/79/12/38/347791238.db2.gz YQOSOLKYZUKUQU-YNEHKIRRSA-N 2 0 242.432 2.202 20 0 BEADRP Cc1ccccc1[C@@H](C)N[C@@H]1CCC[NH2+]C1 ZINC000043324643 179320645 /nfs/dbraw/zinc/32/06/45/179320645.db2.gz NXILAOZYLQFMOZ-CHWSQXEVSA-N 2 0 218.344 2.398 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H]1CCc2c1cccc2F ZINC000577363054 365934207 /nfs/dbraw/zinc/93/42/07/365934207.db2.gz JMOLIXRZPXOKQF-AWEZNQCLSA-N 2 0 236.334 2.402 20 0 BEADRP Cc1ccccc1[C@H]1CCC[N@@H+]1CCOCC[NH3+] ZINC000357076467 179346431 /nfs/dbraw/zinc/34/64/31/179346431.db2.gz OXFOCOZUOQYWKB-OAHLLOKOSA-N 2 0 248.370 2.107 20 0 BEADRP Cc1cccnc1CC[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000296382289 179371103 /nfs/dbraw/zinc/37/11/03/179371103.db2.gz JQWKJMLGFQLPJP-ZIAGYGMSSA-N 2 0 247.386 2.005 20 0 BEADRP C[C@@H]([NH2+]CC1(C)CC1)C1CC[NH+](C)CC1 ZINC000222192364 490149555 /nfs/dbraw/zinc/14/95/55/490149555.db2.gz JJSXGTMTZSPHIU-LLVKDONJSA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)[N@H+](CC[C@H]1CCC[NH+]1C)C1CC1 ZINC000179241931 535073047 /nfs/dbraw/zinc/07/30/47/535073047.db2.gz ZWUWURIIEPUFQB-GFCCVEGCSA-N 2 0 210.365 2.344 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@H]2C[C@@H]2C(F)F)CC1 ZINC000348116393 187394151 /nfs/dbraw/zinc/39/41/51/187394151.db2.gz KOGLPSQPGFYRLF-QWRGUYRKSA-N 2 0 232.318 2.102 20 0 BEADRP CCOC(C)(C)C[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623502464 362927024 /nfs/dbraw/zinc/92/70/24/362927024.db2.gz KNPOAAFEOFSAJM-GFCCVEGCSA-N 2 0 242.407 2.264 20 0 BEADRP CSCC1(CC[NH2+][C@@H](C)C[C@@H](C)[NH3+])CC1 ZINC000596649692 348605122 /nfs/dbraw/zinc/60/51/22/348605122.db2.gz FEQMKWNHSRQPPL-MNOVXSKESA-N 2 0 230.421 2.235 20 0 BEADRP CSCC1(CC[NH2+][C@H](C)[C@H]2CCC[NH2+]2)CC1 ZINC000596650246 348605215 /nfs/dbraw/zinc/60/52/15/348605215.db2.gz KGOQJXXXTALXOA-VXGBXAGGSA-N 2 0 242.432 2.250 20 0 BEADRP CCSC1(C[NH2+][C@H]2CC[NH2+]CC[C@@H]2C)CC1 ZINC000596650119 348605535 /nfs/dbraw/zinc/60/55/35/348605535.db2.gz GURNUVWSIHAHOM-RYUDHWBXSA-N 2 0 242.432 2.250 20 0 BEADRP CCSC1(C[NH2+][C@H](C)[C@H]2CCC[NH2+]2)CC1 ZINC000596652319 348606217 /nfs/dbraw/zinc/60/62/17/348606217.db2.gz PPFAJZRXFSXWQC-GHMZBOCLSA-N 2 0 228.405 2.002 20 0 BEADRP CCSC1(C[NH2+][C@H](C)[C@@H]2CCC[NH2+]2)CC1 ZINC000596652320 348606942 /nfs/dbraw/zinc/60/69/42/348606942.db2.gz PPFAJZRXFSXWQC-MNOVXSKESA-N 2 0 228.405 2.002 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]C(C1CC1)C1CC1 ZINC000308811363 348698570 /nfs/dbraw/zinc/69/85/70/348698570.db2.gz HGXKNXHBGPQEMA-JTQLQIEISA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C(C1CC1)C1CC1 ZINC000308811369 348698760 /nfs/dbraw/zinc/69/87/60/348698760.db2.gz HGXKNXHBGPQEMA-SNVBAGLBSA-N 2 0 210.365 2.282 20 0 BEADRP Cc1c[nH+]ccc1NC[C@H](C1CC1)[NH+](C)C ZINC000309654176 179712391 /nfs/dbraw/zinc/71/23/91/179712391.db2.gz PCGHQWRZMROCDX-CYBMUJFWSA-N 2 0 219.332 2.142 20 0 BEADRP Cc1c[nH+]ccc1NC[C@]1(C)CCC[NH2+]C1 ZINC000160004306 179712005 /nfs/dbraw/zinc/71/20/05/179712005.db2.gz QVGVAZPNMORFPP-CYBMUJFWSA-N 2 0 219.332 2.192 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+]CC2(C(F)F)CC2)CC1(C)C ZINC000623510612 362936913 /nfs/dbraw/zinc/93/69/13/362936913.db2.gz CQSLIHSIKQWPLT-SNVBAGLBSA-N 2 0 246.345 2.494 20 0 BEADRP C[C@H]([N@H+](C)C[C@H]1CCC[NH2+]C1)C(C)(C)C ZINC000251028812 349181874 /nfs/dbraw/zinc/18/18/74/349181874.db2.gz HJRDZGYJMGOCRP-RYUDHWBXSA-N 2 0 212.381 2.352 20 0 BEADRP COC1([C@H](C)[NH2+]C[C@H](C)C[NH+](C)C)CCCC1 ZINC000421853147 192389790 /nfs/dbraw/zinc/38/97/90/192389790.db2.gz IPHBFUOETMMYHM-STQMWFEESA-N 2 0 242.407 2.121 20 0 BEADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+][C@H](C)C2CC2)C1 ZINC000250475315 349171157 /nfs/dbraw/zinc/17/11/57/349171157.db2.gz AHDNCOBMGLDNLK-NEPJUHHUSA-N 2 0 210.365 2.105 20 0 BEADRP Cc1csc([C@H](C)[NH2+][C@@H](C)CCC[NH3+])n1 ZINC000336659886 179796057 /nfs/dbraw/zinc/79/60/57/179796057.db2.gz BPQNDKGDHDQTGQ-WPRPVWTQSA-N 2 0 227.377 2.230 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@H]1C)C1CC[NH+](C)CC1 ZINC000070827347 490239997 /nfs/dbraw/zinc/23/99/97/490239997.db2.gz JZVMBTRHABMEMH-DYEKYZERSA-N 2 0 224.392 2.495 20 0 BEADRP CC(C)[N@@H+]1CC[C@H](C[NH2+][C@H]2CCC[C@H]2C)C1 ZINC000252107118 349195851 /nfs/dbraw/zinc/19/58/51/349195851.db2.gz HEWSJGGECOMNGV-MCIONIFRSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H]([NH2+]CC(C1CCC1)C1CCC1)C1C[NH2+]C1 ZINC000530213027 323216983 /nfs/dbraw/zinc/21/69/83/323216983.db2.gz SVJNWYXFWPQLLM-NSHDSACASA-N 2 0 236.403 2.400 20 0 BEADRP CSC1CC[NH+](C[C@H]2CC[NH2+][C@@H](C)C2)CC1 ZINC000300919448 349429370 /nfs/dbraw/zinc/42/93/70/349429370.db2.gz YOKWRRGPALXOHK-RYUDHWBXSA-N 2 0 242.432 2.202 20 0 BEADRP [NH3+][C@H]1CCC[C@H](C[NH2+]C(C2CC2)C2CC2)C1 ZINC000070503288 350015611 /nfs/dbraw/zinc/01/56/11/350015611.db2.gz AVKOCTOAVCRCAO-GWCFXTLKSA-N 2 0 222.376 2.282 20 0 BEADRP Cc1nc(C[N@@H+]2CCC[C@@H](CC[NH3+])C2)cs1 ZINC000069723922 179953601 /nfs/dbraw/zinc/95/36/01/179953601.db2.gz DRCJDQDVSNCCAZ-NSHDSACASA-N 2 0 239.388 2.012 20 0 BEADRP Cc1ccc(C[NH2+][C@@H](C)C2C[NH2+]C2)c(C)c1 ZINC000422692693 192433501 /nfs/dbraw/zinc/43/35/01/192433501.db2.gz KSKCKMUWMHTFKO-LBPRGKRZSA-N 2 0 218.344 2.001 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H](C)CC1CC1 ZINC000131442384 191015594 /nfs/dbraw/zinc/01/55/94/191015594.db2.gz DVDNHUCXJYKLFI-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP Cc1nc([C@@H](C)[NH2+]CCCC[NH+](C)C)cs1 ZINC000045663926 180035127 /nfs/dbraw/zinc/03/51/27/180035127.db2.gz CHPRHUNWXQMPDV-SNVBAGLBSA-N 2 0 241.404 2.444 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]C[C@@H]1CCCSC1 ZINC000384029352 350124007 /nfs/dbraw/zinc/12/40/07/350124007.db2.gz BRQAFALETJUUNW-AVGNSLFASA-N 2 0 242.432 2.237 20 0 BEADRP C[C@H]([NH2+]CC1CC[NH+](C)CC1)C1CCC1 ZINC000133334382 191039339 /nfs/dbraw/zinc/03/93/39/191039339.db2.gz HOLCJMILHLWXGI-NSHDSACASA-N 2 0 210.365 2.106 20 0 BEADRP Cc1ncc(C[NH2+]C[C@@H]2CCC[C@H]([NH3+])C2)s1 ZINC000070503290 180152769 /nfs/dbraw/zinc/15/27/69/180152769.db2.gz KQSPSYYFWRJPCM-MNOVXSKESA-N 2 0 239.388 2.059 20 0 BEADRP CC[C@@H]1[C@H](C)CC[N@@H+]1C[C@@H](N)CC(C)C ZINC000384126928 350216755 /nfs/dbraw/zinc/21/67/55/350216755.db2.gz PGMZIKAYGAYIIT-FRRDWIJNSA-N 2 0 212.381 2.480 20 0 BEADRP Cc1nccc(NC[C@H]2CCC[N@@H+](C(C)C)C2)n1 ZINC000266413938 180201448 /nfs/dbraw/zinc/20/14/48/180201448.db2.gz QXBSJBRLBMJSNN-CYBMUJFWSA-N 2 0 248.374 2.317 20 0 BEADRP Cc1ncccc1CN[C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000368367690 180222085 /nfs/dbraw/zinc/22/20/85/180222085.db2.gz UGDAYLXRJZRJAJ-GJZGRUSLSA-N 2 0 245.370 2.106 20 0 BEADRP c1ccc(CC[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000422749162 192452104 /nfs/dbraw/zinc/45/21/04/192452104.db2.gz XVFWYFAGZIBFMW-YIONKMFJSA-N 2 0 230.355 2.102 20 0 BEADRP CC(C)CCC[NH+]1CCC([NH+](C)C)CC1 ZINC000429051926 191091787 /nfs/dbraw/zinc/09/17/87/191091787.db2.gz ZWPPAXGHCWGITG-UHFFFAOYSA-N 2 0 212.381 2.449 20 0 BEADRP C[C@H](Cc1cccs1)[NH2+]C1CC[NH2+]CC1 ZINC000038041067 350302409 /nfs/dbraw/zinc/30/24/09/350302409.db2.gz RVOMLLLDISPJQE-SNVBAGLBSA-N 2 0 224.373 2.021 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CCC(C)(F)F)CC1(C)C ZINC000623534186 362953739 /nfs/dbraw/zinc/95/37/39/362953739.db2.gz BQODFJGJJWPBKE-JTQLQIEISA-N 2 0 234.334 2.494 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH2+][C@H](C2CC2)C2CCC2)C1 ZINC000324871789 350314229 /nfs/dbraw/zinc/31/42/29/350314229.db2.gz CBWGYTNFYJMDGI-WFASDCNBSA-N 2 0 236.403 2.497 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@@H]2CC2(C)C)CC1 ZINC000223812861 350289662 /nfs/dbraw/zinc/28/96/62/350289662.db2.gz XLGOSJSNSHGTFL-NSHDSACASA-N 2 0 210.365 2.106 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+]CCC(C)(F)F)CC1(C)C ZINC000623534187 362954130 /nfs/dbraw/zinc/95/41/30/362954130.db2.gz BQODFJGJJWPBKE-SNVBAGLBSA-N 2 0 234.334 2.494 20 0 BEADRP CCC[C@@H](C[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1)OC ZINC000623535261 362954599 /nfs/dbraw/zinc/95/45/99/362954599.db2.gz SARGAMSPGZTZGI-STQMWFEESA-N 2 0 242.407 2.264 20 0 BEADRP Cc1ncsc1CN1CCCC[C@@H]1[C@H](C)[NH3+] ZINC000228290391 180315680 /nfs/dbraw/zinc/31/56/80/180315680.db2.gz YFBTXLNCFBMDLU-GXSJLCMTSA-N 2 0 239.388 2.153 20 0 BEADRP Cc1ncsc1C[NH2+][C@@H](C)CCCC[NH3+] ZINC000308862408 180322626 /nfs/dbraw/zinc/32/26/26/180322626.db2.gz PQJFEFFEQSBOQU-VIFPVBQESA-N 2 0 227.377 2.059 20 0 BEADRP Cc1cc(N[C@H]2CC[N@@H+]3CCC[C@@H]3C2)cc[nH+]1 ZINC000162812278 350438433 /nfs/dbraw/zinc/43/84/33/350438433.db2.gz POBXYQPNWNRYIN-UONOGXRCSA-N 2 0 231.343 2.429 20 0 BEADRP COc1cccc2c1CCC[C@H]2[NH2+]C[C@@H](C)C[NH3+] ZINC000577482271 365963559 /nfs/dbraw/zinc/96/35/59/365963559.db2.gz YTSBFUCZKATLBP-SMDDNHRTSA-N 2 0 248.370 2.257 20 0 BEADRP C[C@@H]1CC[C@@H](C[NH2+][C@@H]2CC[N@H+](C)C(C)(C)C2)O1 ZINC000623545188 362965243 /nfs/dbraw/zinc/96/52/43/362965243.db2.gz AAXAGOUQTLARPD-UPJWGTAASA-N 2 0 240.391 2.016 20 0 BEADRP CC1(C)CC[C@H]([NH2+][C@H]2CCC[C@@H]([NH3+])C2)C1 ZINC000228914343 191108357 /nfs/dbraw/zinc/10/83/57/191108357.db2.gz WREZXLNJRZAORT-WOPDTQHZSA-N 2 0 210.365 2.425 20 0 BEADRP CC[NH+]1CCC([NH2+]CC2(SC)CCC2)CC1 ZINC000228014341 350524059 /nfs/dbraw/zinc/52/40/59/350524059.db2.gz RWTNZSHKAOEUEQ-UHFFFAOYSA-N 2 0 242.432 2.346 20 0 BEADRP CC1(C)CCC[N@@H+]1CC[C@@H]1CCC[NH2+]C1 ZINC000063067289 350570583 /nfs/dbraw/zinc/57/05/83/350570583.db2.gz IHPJXHGWUUTBDR-LBPRGKRZSA-N 2 0 210.365 2.251 20 0 BEADRP CC[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)COC(C)C)C1 ZINC000337308023 350571817 /nfs/dbraw/zinc/57/18/17/350571817.db2.gz SSIFMHYNRPMPMM-KBPBESRZSA-N 2 0 242.407 2.121 20 0 BEADRP CCO[C@H]1C[C@@H]([NH2+][C@H]2CC[N@H+](C)C(C)(C)C2)C1 ZINC000623546795 362968150 /nfs/dbraw/zinc/96/81/50/362968150.db2.gz SKCAYAIUBGUULX-RWMBFGLXSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@H+](C)C(C)(C)C2)CS1 ZINC000623549723 362969948 /nfs/dbraw/zinc/96/99/48/362969948.db2.gz MOSQMNFOWKTOSV-UTUOFQBUSA-N 2 0 242.432 2.343 20 0 BEADRP CC[C@H](C)C[N@@H+]1CC2(C[C@@H]1C)CC[NH2+]CC2 ZINC000335277590 133823162 /nfs/dbraw/zinc/82/31/62/133823162.db2.gz JSLPTMVEBFTWFR-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP CC1(C)CC[C@H]1[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000336656655 350614675 /nfs/dbraw/zinc/61/46/75/350614675.db2.gz LQAQQZDOWKKFFV-WCQYABFASA-N 2 0 222.376 2.249 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+][C@@H]2CC23CC3)CC1(C)C ZINC000623554617 362975528 /nfs/dbraw/zinc/97/55/28/362975528.db2.gz GZZUOMHELDPEFI-GHMZBOCLSA-N 2 0 208.349 2.001 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)[C@@H]1C[C@H]1C1CC1 ZINC000623560565 362985793 /nfs/dbraw/zinc/98/57/93/362985793.db2.gz KLYAUIRPROPTGV-OPYWOCCESA-N 2 0 236.403 2.351 20 0 BEADRP CCCC[C@@H](C)[NH2+]C[C@H](C)C[NH+](C)C ZINC000336691299 350984088 /nfs/dbraw/zinc/98/40/88/350984088.db2.gz PSFRJFLOSHKMGP-NWDGAFQWSA-N 2 0 200.370 2.352 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@H](F)C1)[C@@H]1CCCC[NH2+]1 ZINC000577611603 366017205 /nfs/dbraw/zinc/01/72/05/366017205.db2.gz TWALEVYVDCCQEL-CYDGBPFRSA-N 2 0 228.355 2.387 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+]C[C@@]2(C)CC2(F)F)CC1(C)C ZINC000623570155 362999915 /nfs/dbraw/zinc/99/99/15/362999915.db2.gz JEADXLFZSUGSDX-ZYHUDNBSSA-N 2 0 246.345 2.494 20 0 BEADRP CC1(C[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)CC1 ZINC000261533041 535158466 /nfs/dbraw/zinc/15/84/66/535158466.db2.gz GFYJRLHVLPZXMT-JHJVBQTASA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)C1CC(F)(F)C1 ZINC000628327047 351263942 /nfs/dbraw/zinc/26/39/42/351263942.db2.gz GLRWNNKBWLGLQT-JBLDHEPKSA-N 2 0 246.345 2.350 20 0 BEADRP CC[NH+](CC)CCC[N@H+](C)C[C@@H]1CCCOC1 ZINC000177959327 366072692 /nfs/dbraw/zinc/07/26/92/366072692.db2.gz ZYVWLQSVCAYNJR-AWEZNQCLSA-N 2 0 242.407 2.077 20 0 BEADRP Cc1ccc(CC[NH2+][C@H](C)CCCC[NH3+])o1 ZINC000577840085 366079060 /nfs/dbraw/zinc/07/90/60/366079060.db2.gz IZJWIAUAZVLPKU-LLVKDONJSA-N 2 0 224.348 2.238 20 0 BEADRP c1ccc(C[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)cc1 ZINC000307298461 351912317 /nfs/dbraw/zinc/91/23/17/351912317.db2.gz AJKXLOLBWRVZPN-RRFJBIMHSA-N 2 0 230.355 2.164 20 0 BEADRP c1ccc(C[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)cc1 ZINC000307298460 351912360 /nfs/dbraw/zinc/91/23/60/351912360.db2.gz AJKXLOLBWRVZPN-RBSFLKMASA-N 2 0 230.355 2.164 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H]1CCCC[C@H]1OC ZINC000037211032 358471018 /nfs/dbraw/zinc/47/10/18/358471018.db2.gz MFJYQWWYRRLRNP-ZIAGYGMSSA-N 2 0 242.407 2.266 20 0 BEADRP COCc1cccc(C[NH2+]C2(C)CC[NH2+]CC2)c1 ZINC000414946935 352370551 /nfs/dbraw/zinc/37/05/51/352370551.db2.gz VBAZWSHPHFKHQU-UHFFFAOYSA-N 2 0 248.370 2.065 20 0 BEADRP CN(CC[NH2+]C[C@@H]1C[C@H]2C[C@H]2C1)C1CCCC1 ZINC000638545937 352376355 /nfs/dbraw/zinc/37/63/55/352376355.db2.gz YFKPHBKUAZOWBR-BTTYYORXSA-N 2 0 236.403 2.497 20 0 BEADRP [NH3+]CCC[NH2+][C@H]1CCc2c1cccc2Cl ZINC000415087835 352567114 /nfs/dbraw/zinc/56/71/14/352567114.db2.gz VENZPMCCVQXOIH-LBPRGKRZSA-N 2 0 224.735 2.266 20 0 BEADRP C[N@H+](CC1CCCC1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000042011635 352617024 /nfs/dbraw/zinc/61/70/24/352617024.db2.gz ZASRIPYKYIYQQE-PBWFPOADSA-N 2 0 222.376 2.391 20 0 BEADRP CCCN(CC)CC[NH2+]C[C@@H]1C[C@H]2C[C@H]2C1 ZINC000638720971 352571522 /nfs/dbraw/zinc/57/15/22/352571522.db2.gz MFUYACLONCJLAY-BTTYYORXSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]CC12CCC(CC1)C2 ZINC000334259859 352871710 /nfs/dbraw/zinc/87/17/10/352871710.db2.gz RBLGVXXGRQXHMC-LQULJDIASA-N 2 0 236.403 2.497 20 0 BEADRP Cc1[nH+]ccc(N2CCN(C)C[C@H]2C)c1Cl ZINC000334336181 352971729 /nfs/dbraw/zinc/97/17/29/352971729.db2.gz RWEHMOKWKWBSEF-SECBINFHSA-N 2 0 239.750 2.184 20 0 BEADRP CCC[NH2+][C@H]1CC[N@H+](CCCOCC)C[C@H]1C ZINC000250639917 535192143 /nfs/dbraw/zinc/19/21/43/535192143.db2.gz SSLVMFMCBUQXMV-KGLIPLIRSA-N 2 0 242.407 2.123 20 0 BEADRP CCN1CCC([NH2+][C@@H]2CC[C@@H]2C2CC2)CC1 ZINC000336753581 353107483 /nfs/dbraw/zinc/10/74/83/353107483.db2.gz FBGLCNLMODQANJ-ZIAGYGMSSA-N 2 0 222.376 2.249 20 0 BEADRP CCN1CCCC[C@@H]1C[NH2+]C[C@H]1C[C@H]1C ZINC000336757267 353158317 /nfs/dbraw/zinc/15/83/17/353158317.db2.gz JCSMMRPWLARABW-JHJVBQTASA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)[C@@H]1CC[C@H]([NH2+]CCC[NH3+])C[C@@H]1C ZINC000336688772 188083115 /nfs/dbraw/zinc/08/31/15/188083115.db2.gz VUZUNMYFUOZYDT-AVGNSLFASA-N 2 0 212.381 2.386 20 0 BEADRP C([NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)[C@@H]1CCCS1 ZINC000128074109 188084931 /nfs/dbraw/zinc/08/49/31/188084931.db2.gz RUXARMORPGJVPC-AGIUHOORSA-N 2 0 240.416 2.098 20 0 BEADRP CC(C)[C@@H]1C[C@H]([NH2+]CCC[NH+](C)C)CS1 ZINC000336759375 353169390 /nfs/dbraw/zinc/16/93/90/353169390.db2.gz LGZNPMCOTGOGQE-RYUDHWBXSA-N 2 0 230.421 2.058 20 0 BEADRP CC(C)[C@@H]1C[C@@H]([NH2+]CCC[NH+](C)C)CS1 ZINC000336759373 353169673 /nfs/dbraw/zinc/16/96/73/353169673.db2.gz LGZNPMCOTGOGQE-NEPJUHHUSA-N 2 0 230.421 2.058 20 0 BEADRP COc1ccccc1C[NH2+]CC1=CC[N@H+](C)CC1 ZINC000271867202 188090631 /nfs/dbraw/zinc/09/06/31/188090631.db2.gz WPGBCLGLYUEYPU-UHFFFAOYSA-N 2 0 246.354 2.047 20 0 BEADRP C(C[NH+]1CCCCC1)C[NH+]1CCCCC1 ZINC000005841434 188103089 /nfs/dbraw/zinc/10/30/89/188103089.db2.gz AMBFNDRKYCJLNH-UHFFFAOYSA-N 2 0 210.365 2.348 20 0 BEADRP C1CC1[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCCC[NH2+]1 ZINC000250940918 188086854 /nfs/dbraw/zinc/08/68/54/188086854.db2.gz ZKIHBVNAKCCARB-JHJVBQTASA-N 2 0 208.349 2.049 20 0 BEADRP Cc1csc(CNCC2([NH3+])CCCCC2)n1 ZINC000049539152 353168420 /nfs/dbraw/zinc/16/84/20/353168420.db2.gz UEFCTSMNMSUDFJ-UHFFFAOYSA-N 2 0 239.388 2.203 20 0 BEADRP C([NH2+]C1CCCC1)[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000037408432 188107213 /nfs/dbraw/zinc/10/72/13/188107213.db2.gz ZZRXJFZFEGXNTH-NSHDSACASA-N 2 0 208.349 2.003 20 0 BEADRP Cc1ccc(C)c(C[NH2+]CCC[NH+](C)C)c1 ZINC000042209212 188119505 /nfs/dbraw/zinc/11/95/05/188119505.db2.gz XFGQQDVAZNXZHE-UHFFFAOYSA-N 2 0 220.360 2.345 20 0 BEADRP Cc1nccn1CC[NH2+][C@H](C)[C@@H]1CC1(C)C ZINC000309448429 188144263 /nfs/dbraw/zinc/14/42/63/188144263.db2.gz LXEZGRCOXXTEOL-PWSUYJOCSA-N 2 0 221.348 2.216 20 0 BEADRP CC(C)C[C@H](C)[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000037485330 188151853 /nfs/dbraw/zinc/15/18/53/188151853.db2.gz LVIOGPRFNAMSPW-QWHCGFSZSA-N 2 0 224.392 2.495 20 0 BEADRP CCC[C@H](CC)[NH2+]CCn1ccnc1C ZINC000050403285 188154022 /nfs/dbraw/zinc/15/40/22/188154022.db2.gz NJZWQYQTLPIZOB-LBPRGKRZSA-N 2 0 209.337 2.360 20 0 BEADRP C1[C@H]2CCC[C@@H]([NH2+][C@H]3CC[N@@H+]4CCC[C@H]4C3)[C@@H]12 ZINC000306073395 188154601 /nfs/dbraw/zinc/15/46/01/188154601.db2.gz DNFJOCUWIWKGKC-CAEXGNQWSA-N 2 0 234.387 2.391 20 0 BEADRP CC(C)C[C@@H](C[NH2+][C@H](C)CCCC[NH3+])N(C)C ZINC000310552185 188172149 /nfs/dbraw/zinc/17/21/49/188172149.db2.gz UWEGRDTXLQQMRJ-KGLIPLIRSA-N 2 0 243.439 2.070 20 0 BEADRP C[C@H](Cc1ccc(O)cc1)[NH2+]C[C@H]1CCCN1C ZINC000226010839 188181904 /nfs/dbraw/zinc/18/19/04/188181904.db2.gz SKVYXMPJYKIYHG-TZMCWYRMSA-N 2 0 248.370 2.007 20 0 BEADRP C[C@@H]([NH2+]CCC1CC1)C1CC[NH+](C)CC1 ZINC000083893693 538112343 /nfs/dbraw/zinc/11/23/43/538112343.db2.gz QYCOHXHMNVVMGT-LLVKDONJSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]([NH2+][C@H]1CC=CCC1)C1CC[NH+](C)CC1 ZINC000084066304 538113221 /nfs/dbraw/zinc/11/32/21/538113221.db2.gz XVJKEFSSQMZRQP-JSGCOSHPSA-N 2 0 222.376 2.415 20 0 BEADRP C[C@@H]1C[C@H](C[NH3+])C[N@@H+]1C[C@H]1CCC[C@@H](C)C1 ZINC000251970278 353293643 /nfs/dbraw/zinc/29/36/43/353293643.db2.gz YCWOXAIQSXHGFV-YIYPIFLZSA-N 2 0 224.392 2.482 20 0 BEADRP CC[N@H+](CC1CCC1)C[C@@H]1CC[NH2+][C@@H](C)C1 ZINC000230321050 353487570 /nfs/dbraw/zinc/48/75/70/353487570.db2.gz QSRIDKGPERMGCK-GXTWGEPZSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH3+] ZINC000252368455 363229931 /nfs/dbraw/zinc/22/99/31/363229931.db2.gz OXJYWERKFNGMGY-ZIAGYGMSSA-N 2 0 218.344 2.246 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]2C[N@H+](Cc3cccs3)C[C@@H]21 ZINC000230126739 353473255 /nfs/dbraw/zinc/47/32/55/353473255.db2.gz FUMKYKSMYPIVMB-WCFLWFBJSA-N 2 0 236.384 2.307 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+]CC1(CC(C)C)CC1 ZINC000391804764 259445120 /nfs/dbraw/zinc/44/51/20/259445120.db2.gz FNBGZGBFZFRUBX-ZDUSSCGKSA-N 2 0 242.407 2.156 20 0 BEADRP C[C@H](C[C@H]1CCCCC[NH2+]1)[NH2+][C@@H]1CCSC1 ZINC000231348347 353595082 /nfs/dbraw/zinc/59/50/82/353595082.db2.gz LFRXWXHHKJRCCX-JHJVBQTASA-N 2 0 242.432 2.392 20 0 BEADRP CC1(C)CC[N@H+](C[C@H]2CCC[NH2+]C2)CCS1 ZINC000231047870 353560725 /nfs/dbraw/zinc/56/07/25/353560725.db2.gz YETSKADZOAQYGM-LBPRGKRZSA-N 2 0 242.432 2.204 20 0 BEADRP CCC[C@H](C[N@@H+]1CCC[C@@H]([NH+](C)C)CC1)OC ZINC000639106240 353612873 /nfs/dbraw/zinc/61/28/73/353612873.db2.gz XLRLXKYMIRCJJE-ZIAGYGMSSA-N 2 0 242.407 2.218 20 0 BEADRP CC(C)[N@H+](CC1CCC1)C[C@H]1CCC[NH2+]C1 ZINC000232662036 353752931 /nfs/dbraw/zinc/75/29/31/353752931.db2.gz OMQLHSAKNZTGKO-AWEZNQCLSA-N 2 0 224.392 2.497 20 0 BEADRP CC[N@H+](C)C[C@H]1CCN(C/C=C(\C)Cl)C1 ZINC000528396507 324220247 /nfs/dbraw/zinc/22/02/47/324220247.db2.gz IEPCQZHTWCRWDB-JXDHDYMSSA-N 2 0 230.783 2.403 20 0 BEADRP Cc1cc(C)c(C[N@H+]2C[C@H]3C[NH2+]C[C@H]3C2)cc1C ZINC000220219906 353826820 /nfs/dbraw/zinc/82/68/20/353826820.db2.gz ITDJZKBRJUMDDF-IYBDPMFKSA-N 2 0 244.382 2.263 20 0 BEADRP C[C@@H]1C[C@H]1C[N@H+](C)CCC[NH+]1CCCC1 ZINC000343614024 353933744 /nfs/dbraw/zinc/93/37/44/353933744.db2.gz IPDSJZKCPKORNS-OLZOCXBDSA-N 2 0 210.365 2.060 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H]2CCS[C@H]2C)[C@@H](C)C1 ZINC000309630427 491058253 /nfs/dbraw/zinc/05/82/53/491058253.db2.gz HPUFBJRJMFHBPT-ZDEQEGDKSA-N 2 0 242.432 2.200 20 0 BEADRP C[NH+](C)CCC[N@H+](C)C[C@H]1CC=CCC1 ZINC000344023531 354084609 /nfs/dbraw/zinc/08/46/09/354084609.db2.gz ATDQTZWWDFPTKN-ZDUSSCGKSA-N 2 0 210.365 2.226 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)CC1CCSCC1 ZINC000639174579 354185719 /nfs/dbraw/zinc/18/57/19/354185719.db2.gz COJXBSVBFQKNEW-UHFFFAOYSA-N 2 0 244.448 2.403 20 0 BEADRP CC[C@@H](C)[C@@H](C[N@H+](CC)CCC[NH+](C)C)OC ZINC000639175026 354190817 /nfs/dbraw/zinc/19/08/17/354190817.db2.gz GNOBGTUDKUDURI-ZIAGYGMSSA-N 2 0 244.423 2.321 20 0 BEADRP C[C@@H](CC[NH2+]Cc1ccn(C)c1)[NH+]1CCCCC1 ZINC000344353845 354241375 /nfs/dbraw/zinc/24/13/75/354241375.db2.gz RJFWZQNLJHTWGT-AWEZNQCLSA-N 2 0 249.402 2.379 20 0 BEADRP COCC1CCC([NH2+]CCC[NH2+]C(C)C)CC1 ZINC000578062656 366208913 /nfs/dbraw/zinc/20/89/13/366208913.db2.gz JBFFSLMTSJHIFV-UHFFFAOYSA-N 2 0 242.407 2.169 20 0 BEADRP CC(C)C1(C[N@@H+]2CC[C@]3(CC[NH+](C)C3)C2)CC1 ZINC000639202662 354607670 /nfs/dbraw/zinc/60/76/70/354607670.db2.gz AAPDONKNTCRTSY-AWEZNQCLSA-N 2 0 236.403 2.450 20 0 BEADRP C[NH2+]CCC[NH2+]Cc1ccc(Cl)cc1C ZINC000234354419 363420116 /nfs/dbraw/zinc/42/01/16/363420116.db2.gz IEOWQFKVNKWUGB-UHFFFAOYSA-N 2 0 226.751 2.348 20 0 BEADRP COC1CCC([NH2+][C@H]2CCCN(C)[C@H]2C)CC1 ZINC000346329417 354898295 /nfs/dbraw/zinc/89/82/95/354898295.db2.gz MQQIDADIKLUGFL-ABXWRUBCSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@H]([NH2+]CCC[NH3+])c1csc(Cl)c1 ZINC000235517276 363447050 /nfs/dbraw/zinc/44/70/50/363447050.db2.gz SGAZUWBFHCYDEA-ZETCQYMHSA-N 2 0 218.753 2.401 20 0 BEADRP CC[C@H](C[NH2+][C@@H](C)[C@H]1CCCO1)N1CCCC1 ZINC000346468351 354954642 /nfs/dbraw/zinc/95/46/42/354954642.db2.gz AISDELLJPJYLDX-BFHYXJOUSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@H]([NH3+])c1ccc(N[C@@H]2CCC[NH2+]CC2)cc1 ZINC000335178684 354964625 /nfs/dbraw/zinc/96/46/25/354964625.db2.gz ODZVUEDNZQTWOK-WCQYABFASA-N 2 0 233.359 2.260 20 0 BEADRP C[NH+](C)[C@@H]1CCC[N@H+](C[C@H]2CCSC2)CC1 ZINC000335196455 355029698 /nfs/dbraw/zinc/02/96/98/355029698.db2.gz WHQAXQVMOZSSMG-CHWSQXEVSA-N 2 0 242.432 2.156 20 0 BEADRP COc1ccc([C@@H]2CCN(CC(C)(C)[NH3+])C2)cc1 ZINC000346828871 355128884 /nfs/dbraw/zinc/12/88/84/355128884.db2.gz JEKLYWHNQVKPEC-CYBMUJFWSA-N 2 0 248.370 2.222 20 0 BEADRP CCCCOCC[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@@H]1C ZINC000040506806 358494124 /nfs/dbraw/zinc/49/41/24/358494124.db2.gz IFZFBRCSFFJZCR-BFHYXJOUSA-N 2 0 242.407 2.121 20 0 BEADRP CO[C@H](C)[C@@H](C)[NH2+]CC[C@@H](C)[NH+]1CCCCC1 ZINC000346869031 355158459 /nfs/dbraw/zinc/15/84/59/355158459.db2.gz KDXPHBUAKQZPEO-MGPQQGTHSA-N 2 0 242.407 2.264 20 0 BEADRP C1CC1[C@H]1CCC[C@@H]([NH2+]C2CC[NH2+]CC2)C1 ZINC000335252438 355207472 /nfs/dbraw/zinc/20/74/72/355207472.db2.gz PHGDWRJMMREHRO-GXTWGEPZSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]1CCC[C@H](C)[N@H+](C[C@@H]2CCC[NH2+]C2)C1 ZINC000346965928 355173458 /nfs/dbraw/zinc/17/34/58/355173458.db2.gz CELFRZSTANHTBY-HZSPNIEDSA-N 2 0 224.392 2.497 20 0 BEADRP Fc1ccc2c(c1)C[N@@H+](CC[C@H]1CC[NH2+]C1)CC2 ZINC000335241754 355176759 /nfs/dbraw/zinc/17/67/59/355176759.db2.gz PPEJIUGAWFHUOI-GFCCVEGCSA-N 2 0 248.345 2.183 20 0 BEADRP Cc1ccccc1C[NH2+][C@@H]1CC[NH2+]CC[C@@H]1C ZINC000335256226 355189767 /nfs/dbraw/zinc/18/97/67/355189767.db2.gz FDJAELUVTCOHTB-DZGCQCFKSA-N 2 0 232.371 2.473 20 0 BEADRP CCC[C@H]1CCC[N@H+](C[C@H]2CCC[NH2+]C2)C1 ZINC000346997592 355195874 /nfs/dbraw/zinc/19/58/74/355195874.db2.gz XMERJWBPIGIDBO-KBPBESRZSA-N 2 0 224.392 2.498 20 0 BEADRP CCSCC[C@H](C)[N@H+](C)C[C@H]1CCC[NH2+]C1 ZINC000347012161 355204816 /nfs/dbraw/zinc/20/48/16/355204816.db2.gz UUSFBSJTNKRNJK-STQMWFEESA-N 2 0 244.448 2.450 20 0 BEADRP CC[C@H](C[N@H+](C)[C@@H]1CC[NH+](CC)C[C@@H]1C)OC ZINC000412978748 191349351 /nfs/dbraw/zinc/34/93/51/191349351.db2.gz RAENIUXGXWCRLM-BFHYXJOUSA-N 2 0 242.407 2.074 20 0 BEADRP CSC1(C[N@H+](C)C[C@@H]2CCC[NH+](C)C2)CC1 ZINC000347597953 355251095 /nfs/dbraw/zinc/25/10/95/355251095.db2.gz XAZSBIQDHDBWAG-GFCCVEGCSA-N 2 0 242.432 2.156 20 0 BEADRP C[C@H]([NH2+]C1CC[NH+](CC2CC2)CC1)[C@@H]1C[C@H]1C ZINC000414060996 191422901 /nfs/dbraw/zinc/42/29/01/191422901.db2.gz BDFHNDILENGUDI-TYNCELHUSA-N 2 0 236.403 2.495 20 0 BEADRP CC[NH+](CC)CCOCC[NH2+][C@@H]1CC[C@H](C)C1 ZINC000349698009 355413413 /nfs/dbraw/zinc/41/34/13/355413413.db2.gz XGSLGOXABVLFBI-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@H]1CCC[C@H]1C1CC1 ZINC000414793340 191571123 /nfs/dbraw/zinc/57/11/23/191571123.db2.gz KGTVFSUEVOIZQV-XQQFMLRXSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H]([NH3+])c1ccc(C[NH2+]C2CCC([NH3+])CC2)cc1 ZINC000414807238 191576274 /nfs/dbraw/zinc/57/62/74/191576274.db2.gz CJLOOGFWQCJLEY-VCANKDNSSA-N 3 0 247.386 2.066 20 0 BEADRP CC(C)C[N@H+](C)CCC[NH2+]CCC[C@@H]1CCO1 ZINC000639290882 355466247 /nfs/dbraw/zinc/46/62/47/355466247.db2.gz WNZFHFDCNZLEIC-CQSZACIVSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]CC[C@H]2CC[NH2+]C2)C1 ZINC000414827901 191589091 /nfs/dbraw/zinc/58/90/91/191589091.db2.gz IBMAHNPPLUQSHK-JHJVBQTASA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1CCCC[C@H]1[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000414831589 191590810 /nfs/dbraw/zinc/59/08/10/191590810.db2.gz NGIATSBXRZSRMJ-JHJVBQTASA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H](CCC1CCCC1)[NH2+][C@@H]1CC[NH2+]C1 ZINC000414867058 191607659 /nfs/dbraw/zinc/60/76/59/191607659.db2.gz FYTUOYQBUBMXIX-WCQYABFASA-N 2 0 210.365 2.297 20 0 BEADRP Cc1ccc2ncc(C[NH2+]C(C)(C)CF)n2c1 ZINC000349823513 355470080 /nfs/dbraw/zinc/47/00/80/355470080.db2.gz USEZRPFIZGEEOI-UHFFFAOYSA-N 2 0 235.306 2.480 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000414858957 191603490 /nfs/dbraw/zinc/60/34/90/191603490.db2.gz LQUDVNLADCUDAO-VHSXEESVSA-N 2 0 238.297 2.307 20 0 BEADRP CC(C)[C@](C)(O)C[NH2+][C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000261569443 535284878 /nfs/dbraw/zinc/28/48/78/535284878.db2.gz JUHMPSMLHJAUNA-SOUVJXGZSA-N 2 0 248.370 2.128 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]Cc1ccccc1N(C)C ZINC000415016013 191651653 /nfs/dbraw/zinc/65/16/53/191651653.db2.gz OTUWYSAKQQICOX-ZDUSSCGKSA-N 2 0 249.402 2.360 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@@H](C)CCC(F)(F)F ZINC000415024575 191655407 /nfs/dbraw/zinc/65/54/07/191655407.db2.gz PDDZFFNBHJKHPV-IUCAKERBSA-N 2 0 226.286 2.434 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CC[C@H](C[NH3+])C2)cc1F ZINC000415028141 191656495 /nfs/dbraw/zinc/65/64/95/191656495.db2.gz CGZCFQFTWIHHGM-WCQYABFASA-N 2 0 236.334 2.351 20 0 BEADRP COc1cc(C[NH2+]CC[C@H]2CCC[NH2+]2)ccc1C ZINC000414905141 191621761 /nfs/dbraw/zinc/62/17/61/191621761.db2.gz MZCKFMWTWWHOIT-CQSZACIVSA-N 2 0 248.370 2.235 20 0 BEADRP CC(C)c1ncc(C[NH2+][C@@H](C)CCC[NH3+])s1 ZINC000415027397 191657023 /nfs/dbraw/zinc/65/70/23/191657023.db2.gz WPBNHNKARXFXKA-JTQLQIEISA-N 2 0 241.404 2.484 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@@H]1CCC[C@H]1C1CC1 ZINC000414967619 191635801 /nfs/dbraw/zinc/63/58/01/191635801.db2.gz XWHKVTAUWJPBHA-KGYLQXTDSA-N 2 0 210.365 2.153 20 0 BEADRP COc1ccc(C[NH2+]CCC[C@H]2CCC[NH2+]2)cc1 ZINC000414979957 191639799 /nfs/dbraw/zinc/63/97/99/191639799.db2.gz VUPBOHWLRYENEF-AWEZNQCLSA-N 2 0 248.370 2.317 20 0 BEADRP Cc1cccc(C[NH2+][C@H]2CC[C@H](C[NH3+])C2)c1 ZINC000415038418 191659795 /nfs/dbraw/zinc/65/97/95/191659795.db2.gz NJNGCQZSJSVJMG-JSGCOSHPSA-N 2 0 218.344 2.212 20 0 BEADRP CCCC[N@@H+]1CC[C@H](OCC[NH+](CC)CC)C1 ZINC000350179931 355621181 /nfs/dbraw/zinc/62/11/81/355621181.db2.gz AXCLGKOCVDKULZ-AWEZNQCLSA-N 2 0 242.407 2.219 20 0 BEADRP C[N@@H+]1CCCC[C@@H](C[NH2+]C[C@@H]2C[C@H]3C[C@H]3C2)C1 ZINC000639346660 355793245 /nfs/dbraw/zinc/79/32/45/355793245.db2.gz HUHHWKWZSLIQFD-XQLPTFJDSA-N 2 0 236.403 2.354 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)[C@@H]1CC1(F)F ZINC000639347487 355793573 /nfs/dbraw/zinc/79/35/73/355793573.db2.gz ODVUMYZZZGKQRS-TUAOUCFPSA-N 2 0 246.345 2.352 20 0 BEADRP CCC[C@@H](C[NH2+]C[C@H]1CCCC[N@H+](C)C1)OC ZINC000639347804 355794724 /nfs/dbraw/zinc/79/47/24/355794724.db2.gz QYOUJVSKGRARKJ-KGLIPLIRSA-N 2 0 242.407 2.123 20 0 BEADRP Cc1ccc(C[N@H+]2C[C@H](C[NH3+])C[C@@H]2C)cc1C ZINC000216009415 355795705 /nfs/dbraw/zinc/79/57/05/355795705.db2.gz XERLLWGCXCOUPZ-ZFWWWQNUSA-N 2 0 232.371 2.473 20 0 BEADRP CC[C@@]1(C)CC[N@H+](CC[C@@H]2CC[NH2+]C2)C1 ZINC000399376576 355867734 /nfs/dbraw/zinc/86/77/34/355867734.db2.gz OBCPRJFPTMFAMU-STQMWFEESA-N 2 0 210.365 2.108 20 0 BEADRP CCC1([NH+](C)C)CC[NH+](CC2CC2)CC1 ZINC000639379574 355914906 /nfs/dbraw/zinc/91/49/06/355914906.db2.gz QPMNOCYEMLCDPS-UHFFFAOYSA-N 2 0 210.365 2.203 20 0 BEADRP CC[NH+]1CCC(C[NH2+]CC2(C)CC2)CC1 ZINC000309061807 355984849 /nfs/dbraw/zinc/98/48/49/355984849.db2.gz XFFSCQXZHGERDX-UHFFFAOYSA-N 2 0 210.365 2.108 20 0 BEADRP Cc1ccc(CC[N@@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@@H]3C2)cc1 ZINC000351495957 356003011 /nfs/dbraw/zinc/00/30/11/356003011.db2.gz QISUVHKFVRAMGI-ARFHVFGLSA-N 2 0 244.382 2.207 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCCCF)[C@H](C)C1 ZINC000351866488 356101220 /nfs/dbraw/zinc/10/12/20/356101220.db2.gz XDHSWVOCAXCIEJ-CHWSQXEVSA-N 2 0 230.371 2.398 20 0 BEADRP COC[C@H](C)C[N@H+](C)C1CC[NH+](C(C)C)CC1 ZINC000526114537 356226822 /nfs/dbraw/zinc/22/68/22/356226822.db2.gz CSJFZNWFFWOTSH-CYBMUJFWSA-N 2 0 242.407 2.074 20 0 BEADRP Cc1[nH+]c2ccccc2c(NCCCC[NH3+])c1C ZINC000420243466 192184319 /nfs/dbraw/zinc/18/43/19/192184319.db2.gz XRJVSHPLKJZKOF-UHFFFAOYSA-N 2 0 243.354 2.424 20 0 BEADRP CC[N@H+](CC[C@H]1CC[NH2+]C1)[C@H](C)C(C)C ZINC000420295762 192205140 /nfs/dbraw/zinc/20/51/40/192205140.db2.gz CQJMFDHACRFTMD-CHWSQXEVSA-N 2 0 212.381 2.352 20 0 BEADRP CCSCC[C@@H](C)[N@H+](C)CC[C@H]1CC[NH2+]C1 ZINC000420298864 192205783 /nfs/dbraw/zinc/20/57/83/192205783.db2.gz IDIZKAKTRIBOOS-CHWSQXEVSA-N 2 0 244.448 2.450 20 0 BEADRP CCc1cccc(C[NH+]2CCC(C[NH3+])CC2)c1 ZINC000420274892 192198290 /nfs/dbraw/zinc/19/82/90/192198290.db2.gz PBRDUNDMJMYVAS-UHFFFAOYSA-N 2 0 232.371 2.420 20 0 BEADRP CC(C)[C@@H]([NH3+])CC[N@H+](C)CCCc1ccncc1 ZINC000420287067 192201678 /nfs/dbraw/zinc/20/16/78/192201678.db2.gz HJJJJQGBJVFVJR-HNNXBMFYSA-N 2 0 249.402 2.319 20 0 BEADRP C[C@@H]([NH3+])[C@@H]1CCC[N@H+](CCCc2ccncc2)C1 ZINC000420292678 192202826 /nfs/dbraw/zinc/20/28/26/192202826.db2.gz PVJXNQJUOOGUTD-UKRRQHHQSA-N 2 0 247.386 2.073 20 0 BEADRP CCCC[N@@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1 ZINC000420334287 192214727 /nfs/dbraw/zinc/21/47/27/192214727.db2.gz GBIJBCCDZWIECC-STQMWFEESA-N 2 0 210.365 2.108 20 0 BEADRP C(C[N@@H+]1CCC[C@@H]1C1CCC1)[C@H]1CC[NH2+]C1 ZINC000420306641 192208219 /nfs/dbraw/zinc/20/82/19/192208219.db2.gz QREMSUZPLMMJRH-TZMCWYRMSA-N 2 0 222.376 2.251 20 0 BEADRP [NH3+]CC[C@@H]1CCC[N@H+](Cc2ncc(C3CC3)o2)C1 ZINC000420312080 192210523 /nfs/dbraw/zinc/21/05/23/192210523.db2.gz OFMABVDNSYPIBH-NSHDSACASA-N 2 0 249.358 2.113 20 0 BEADRP Cc1ccc(C[N@H+](C)CC[C@H]2CC[NH2+]C2)s1 ZINC000420312847 192210531 /nfs/dbraw/zinc/21/05/31/192210531.db2.gz XKDGAOUKZCQLLB-GFCCVEGCSA-N 2 0 238.400 2.488 20 0 BEADRP CCc1cccc(C[N@@H+]2C[C@H](C[NH3+])C[C@H]2C)c1 ZINC000420317221 192212265 /nfs/dbraw/zinc/21/22/65/192212265.db2.gz MRSUGQPYIOETSF-DOMZBBRYSA-N 2 0 232.371 2.418 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H]1CC[NH2+]C1)c1ccc(OC)cc1 ZINC000420366608 192225953 /nfs/dbraw/zinc/22/59/53/192225953.db2.gz GFZSNGSPCJDSDR-IUODEOHRSA-N 2 0 248.370 2.345 20 0 BEADRP c1ccc(C[N@@H+](CC[C@H]2CC[NH2+]C2)C2CC2)nc1 ZINC000420370796 192228623 /nfs/dbraw/zinc/22/86/23/192228623.db2.gz ZEOHVOXRPRNUCI-CYBMUJFWSA-N 2 0 245.370 2.046 20 0 BEADRP CCc1ccc(CC[N@H+](C)C2CC([NH3+])C2)cc1 ZINC000420328614 192229087 /nfs/dbraw/zinc/22/90/87/192229087.db2.gz HTXQUKBKOQAGFE-UHFFFAOYSA-N 2 0 232.371 2.213 20 0 BEADRP c1cc([C@H]2CCC[N@H+]2CC[C@@H]2CC[NH2+]C2)ccn1 ZINC000420363486 192223227 /nfs/dbraw/zinc/22/32/27/192223227.db2.gz PHBXAVVNPDHRNG-DZGCQCFKSA-N 2 0 245.370 2.218 20 0 BEADRP C[C@H]1[C@@H]([NH3+])CC[N@@H+]1[C@H]1CCCc2ccccc21 ZINC000420362925 192223868 /nfs/dbraw/zinc/22/38/68/192223868.db2.gz ZVFRRNKQNCACIM-CQDKDKBSSA-N 2 0 230.355 2.486 20 0 BEADRP [NH3+]C[C@H]1C[N@H+](CCCC2CCCC2)CCCO1 ZINC000420389672 192234940 /nfs/dbraw/zinc/23/49/40/192234940.db2.gz MHYGGKPXEDYSOQ-AWEZNQCLSA-N 2 0 240.391 2.006 20 0 BEADRP C[NH2+]CCC[NH2+][C@H]1CCCC[C@H]1C(C)C ZINC000420395544 192237202 /nfs/dbraw/zinc/23/72/02/192237202.db2.gz DMSQANOYWNOLPB-STQMWFEESA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CCC[NH2+]C1)c1ccccn1 ZINC000420399468 192237915 /nfs/dbraw/zinc/23/79/15/192237915.db2.gz HYRUSEONKDVQMR-CHWSQXEVSA-N 2 0 233.359 2.122 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CC[NH2+]C1)C1CCCC1 ZINC000420403222 192237970 /nfs/dbraw/zinc/23/79/70/192237970.db2.gz KWFUYMZWVAFYMO-RYUDHWBXSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CC[NH2+]C1)C1CCCC1 ZINC000420403220 192238744 /nfs/dbraw/zinc/23/87/44/192238744.db2.gz KWFUYMZWVAFYMO-NEPJUHHUSA-N 2 0 210.365 2.154 20 0 BEADRP CC[C@@H](C)[C@H](C)[NH2+]CCC1CC[NH2+]CC1 ZINC000420410184 192239748 /nfs/dbraw/zinc/23/97/48/192239748.db2.gz REQWTDFMHSUSHO-NEPJUHHUSA-N 2 0 212.381 2.400 20 0 BEADRP c1cn(CC[N@@H+]2CC[C@H](C3CCCC3)C2)cn1 ZINC000420960165 192280962 /nfs/dbraw/zinc/28/09/62/192280962.db2.gz GILJKZMUIUMVJR-AWEZNQCLSA-N 2 0 233.359 2.395 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCN2CCCC2(C)C)[C@@H](C)O1 ZINC000449782247 202035518 /nfs/dbraw/zinc/03/55/18/202035518.db2.gz KIXLVJUHTZRUQP-JHJVBQTASA-N 2 0 240.391 2.016 20 0 BEADRP C[C@H]1CSC[C@H]1[NH2+]CCN1CCCC1(C)C ZINC000449781956 202036427 /nfs/dbraw/zinc/03/64/27/202036427.db2.gz JTEGNZFRWWTBCI-NWDGAFQWSA-N 2 0 242.432 2.202 20 0 BEADRP [NH3+]CC1CCC([NH2+]CC2(C3CC3)CC2)CC1 ZINC000422937553 192511402 /nfs/dbraw/zinc/51/14/02/192511402.db2.gz OFXDXPLPYLJCEE-UHFFFAOYSA-N 2 0 222.376 2.284 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]CCC(C)(C)C ZINC000422945023 192513805 /nfs/dbraw/zinc/51/38/05/192513805.db2.gz SYMRZDWZPXWVTN-NEPJUHHUSA-N 2 0 212.381 2.400 20 0 BEADRP CC(C)CC[C@@](C)(O)C[NH2+][C@H](C)CCCC[NH3+] ZINC000422979365 192516658 /nfs/dbraw/zinc/51/66/58/192516658.db2.gz MJWWXSSAIGUDGJ-ZIAGYGMSSA-N 2 0 244.423 2.281 20 0 BEADRP CC(C)[C@@H]1OCCC[C@H]1C[NH2+][C@H](C)CCC[NH3+] ZINC000422924949 192508591 /nfs/dbraw/zinc/50/85/91/192508591.db2.gz ZKXOTTRFYYOXFF-RDBSUJKOSA-N 2 0 242.407 2.155 20 0 BEADRP C[C@H]([NH2+]C1CC(c2ccccc2)C1)C1C[NH2+]C1 ZINC000422967322 192528769 /nfs/dbraw/zinc/52/87/69/192528769.db2.gz OXHLIPJOIHVFCD-ZOODHJKOSA-N 2 0 230.355 2.130 20 0 BEADRP Cc1csc([C@H](C)C[NH2+][C@@H](C)CCC[NH3+])n1 ZINC000423036365 192547282 /nfs/dbraw/zinc/54/72/82/192547282.db2.gz KWJMPGWXNPTXGL-ZJUUUORDSA-N 2 0 241.404 2.272 20 0 BEADRP CCC(O)(CC)CC[NH2+][C@@H](C)CCCC[NH3+] ZINC000423075211 192559089 /nfs/dbraw/zinc/55/90/89/192559089.db2.gz WHCJCHXJWYWCAR-LBPRGKRZSA-N 2 0 230.396 2.035 20 0 BEADRP CC(C)C1CC([NH2+][C@H](C)[C@H]2CCC[NH2+]C2)C1 ZINC000423077637 192561229 /nfs/dbraw/zinc/56/12/29/192561229.db2.gz MLQRICWFRCOTRN-KBHBFKLGSA-N 2 0 224.392 2.399 20 0 BEADRP CC(C)C[C@@H]1OCCC[C@@H]1[NH2+][C@H](C)C[C@@H](C)[NH3+] ZINC000423047223 192551787 /nfs/dbraw/zinc/55/17/87/192551787.db2.gz FWGQGJZBAYYADF-MQYQWHSLSA-N 2 0 242.407 2.296 20 0 BEADRP C[NH+](C)CC1CC[NH+](CC2CC(F)(F)C2)CC1 ZINC000450265445 202114982 /nfs/dbraw/zinc/11/49/82/202114982.db2.gz JRZATJNVLRCHSP-UHFFFAOYSA-N 2 0 246.345 2.305 20 0 BEADRP CCc1cc(N(C)CC2CC[NH+](C)CC2)cc[nH+]1 ZINC000450318641 202128549 /nfs/dbraw/zinc/12/85/49/202128549.db2.gz WPFSISAINXNETH-UHFFFAOYSA-N 2 0 247.386 2.422 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CC1(C(F)(F)F)CC1 ZINC000423108379 192570407 /nfs/dbraw/zinc/57/04/07/192570407.db2.gz LZZFRZGXYIUYHE-MRVPVSSYSA-N 2 0 224.270 2.046 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)CCCC[NH3+])C(C)(F)F ZINC000389453475 356676835 /nfs/dbraw/zinc/67/68/35/356676835.db2.gz VSHFGQKAWSXKER-DTWKUNHWSA-N 2 0 208.296 2.137 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@H](C)C(C)(F)F ZINC000389453477 356676903 /nfs/dbraw/zinc/67/69/03/356676903.db2.gz VSHFGQKAWSXKER-RKDXNWHRSA-N 2 0 208.296 2.137 20 0 BEADRP CCc1cc(N[C@H]2CCC[C@@H]([NH+](C)C)C2)cc[nH+]1 ZINC000450368990 202145108 /nfs/dbraw/zinc/14/51/08/202145108.db2.gz LPEXCJGFHAZWDH-DZGCQCFKSA-N 2 0 247.386 2.351 20 0 BEADRP CC[C@H]([NH2+]CCC[NH3+])c1ccccc1F ZINC000168116418 134156289 /nfs/dbraw/zinc/15/62/89/134156289.db2.gz UWUHBSAGCOXETC-LBPRGKRZSA-N 2 0 210.296 2.215 20 0 BEADRP CCC(=O)CCC[N@H+](C)[C@@H]1CCN(C)[C@@H](C)C1 ZINC000450467073 202175577 /nfs/dbraw/zinc/17/55/77/202175577.db2.gz KHULMFFBGCUZJR-QWHCGFSZSA-N 2 0 240.391 2.160 20 0 BEADRP CC(C)[C@@H]1C[C@H]1C[NH2+][C@@H](C)CCCC[NH3+] ZINC000423154684 192594155 /nfs/dbraw/zinc/59/41/55/192594155.db2.gz PIHCQACBRQJXOI-AVGNSLFASA-N 2 0 212.381 2.386 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CC2(C)C)CC1(C)C ZINC000623371751 356881204 /nfs/dbraw/zinc/88/12/04/356881204.db2.gz QASGQYUHENUMBV-WDEREUQCSA-N 2 0 210.365 2.247 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+]C[C@@H]1C[C@H]1C1CC1 ZINC000423170765 192605401 /nfs/dbraw/zinc/60/54/01/192605401.db2.gz YULOCWKZSKEVHA-DOERSZECSA-N 2 0 222.376 2.010 20 0 BEADRP COCC[C@H](C)[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000088523260 491104613 /nfs/dbraw/zinc/10/46/13/491104613.db2.gz MIRNCFAPZPXONA-ZDUSSCGKSA-N 2 0 242.407 2.075 20 0 BEADRP CCCCOCC[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623383434 356907302 /nfs/dbraw/zinc/90/73/02/356907302.db2.gz UHLYAEYHBUCAFG-CYBMUJFWSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+][C@@H](C)[C@@H]1C[C@H]1C1CC1 ZINC000623384174 356909167 /nfs/dbraw/zinc/90/91/67/356909167.db2.gz REESCWCYGZPNFA-IMIFBBOLSA-N 2 0 224.392 2.351 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CCOC(C)(C)C)CC1(C)C ZINC000623385380 356910155 /nfs/dbraw/zinc/91/01/55/356910155.db2.gz HVORWHQQQQXMKB-LBPRGKRZSA-N 2 0 242.407 2.264 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+]C[C@H]2CCCCO2)CC1(C)C ZINC000623377437 356896754 /nfs/dbraw/zinc/89/67/54/356896754.db2.gz ZAARRMJNQDBTMJ-CHWSQXEVSA-N 2 0 240.391 2.018 20 0 BEADRP CC1(C)Cc2occc2[C@H]([NH2+]CCC[NH3+])C1 ZINC000423197150 192621927 /nfs/dbraw/zinc/62/19/27/192621927.db2.gz YDCSWAMXSRHNTB-LLVKDONJSA-N 2 0 222.332 2.232 20 0 BEADRP CCCCOCC[NH2+][C@@H]1CC[N@H+](CC)C[C@@H]1C ZINC000119592278 357029258 /nfs/dbraw/zinc/02/92/58/357029258.db2.gz SLKJOVXCXFVEHJ-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC12CCC2)[C@@H]1CCC[NH2+]C1 ZINC000423221096 192631993 /nfs/dbraw/zinc/63/19/93/192631993.db2.gz WFNAUWOCNFVBDM-YNEHKIRRSA-N 2 0 222.376 2.297 20 0 BEADRP FCCC[C@@H]1CCC[C@@H]1[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000423241595 192647791 /nfs/dbraw/zinc/64/77/91/192647791.db2.gz DIKAIMKNCXBSCC-RDBSUJKOSA-N 2 0 242.382 2.494 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]CCN1CC[C@H](C)C1 ZINC000389932605 357069224 /nfs/dbraw/zinc/06/92/24/357069224.db2.gz LMWYJLMLIPRAMX-XQQFMLRXSA-N 2 0 210.365 2.106 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CCCc2c(O)cccc21 ZINC000423255609 192654735 /nfs/dbraw/zinc/65/47/35/192654735.db2.gz AJAOEHOODHOFFK-SMDDNHRTSA-N 2 0 248.370 2.215 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H]1CCCc2ccc(O)cc21 ZINC000423255505 192655145 /nfs/dbraw/zinc/65/51/45/192655145.db2.gz AGODOKZPSFVGLI-IAQYHMDHSA-N 2 0 248.370 2.215 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]C[C@@H]2CCCC2(F)F)C1 ZINC000390872667 357119131 /nfs/dbraw/zinc/11/91/31/357119131.db2.gz POUWKOKRRMDEJJ-HBNTYKKESA-N 2 0 232.318 2.281 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@H](C)CCCc1cccnc1 ZINC000423274167 192666337 /nfs/dbraw/zinc/66/63/37/192666337.db2.gz LMVNKUUYRSXIIJ-UKRRQHHQSA-N 2 0 249.402 2.366 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+]C1CCC2(CC2)CC1 ZINC000423267722 192661576 /nfs/dbraw/zinc/66/15/76/192661576.db2.gz FQLYYJUMORFAHK-LBPRGKRZSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@@H]1CC[C@H]1C1CCC1 ZINC000423285128 192677244 /nfs/dbraw/zinc/67/72/44/192677244.db2.gz YXOJENCXFXNFOE-YNEHKIRRSA-N 2 0 210.365 2.138 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H]1CCc2c1cccc2F ZINC000423282052 192675695 /nfs/dbraw/zinc/67/56/95/192675695.db2.gz WHQCHIPEHUSWLJ-HZMBPMFUSA-N 2 0 236.334 2.258 20 0 BEADRP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]CC1CC(C)(C)C1 ZINC000393802922 357300042 /nfs/dbraw/zinc/30/00/42/357300042.db2.gz UPCRDYUVFNVJHH-AAEUAGOBSA-N 2 0 224.392 2.352 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000423279405 192672426 /nfs/dbraw/zinc/67/24/26/192672426.db2.gz SJTPNYRPNRQNKX-YNEHKIRRSA-N 2 0 210.365 2.154 20 0 BEADRP CCN(CC)C[C@H](C)[NH2+][C@H](C)[C@@H]1CCCOC1 ZINC000356849532 538819694 /nfs/dbraw/zinc/81/96/94/538819694.db2.gz PSLANNGPNUUWMM-BFHYXJOUSA-N 2 0 242.407 2.121 20 0 BEADRP CC[C@@H]1CCC[C@@H](C[N@H+](C)CCC[NH3+])C1 ZINC000394504799 357363266 /nfs/dbraw/zinc/36/32/66/357363266.db2.gz FCASSFUWLJELPC-CHWSQXEVSA-N 2 0 212.381 2.483 20 0 BEADRP Cc1cnccc1C[N@@H+]1CCCC[C@H]1CC[NH3+] ZINC000395370585 357434277 /nfs/dbraw/zinc/43/42/77/357434277.db2.gz NEMXQKUTPCFWBQ-AWEZNQCLSA-N 2 0 233.359 2.093 20 0 BEADRP Cc1ccnc([C@@H](C)[NH2+]CC2CC[NH2+]CC2)c1 ZINC000583138272 357499433 /nfs/dbraw/zinc/49/94/33/357499433.db2.gz OENWKBANKMIBEE-GFCCVEGCSA-N 2 0 233.359 2.040 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@H]2CCC[C@H]2C)CC1 ZINC000230657357 357545457 /nfs/dbraw/zinc/54/54/57/357545457.db2.gz LNAYWQQDHULVMG-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP CC[NH+](CC)CCC[NH+]1C[C@H]2CCC[C@@H]2C1 ZINC000191545775 357784371 /nfs/dbraw/zinc/78/43/71/357784371.db2.gz GGCUZXIREOCWQQ-ZIAGYGMSSA-N 2 0 224.392 2.450 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+][C@H]1CCCC(C)(C)C1 ZINC000234753690 357826949 /nfs/dbraw/zinc/82/69/49/357826949.db2.gz FZOLRVPOVZCANT-QWHCGFSZSA-N 2 0 242.407 2.299 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+]CC1C(C)(C)C1(C)C ZINC000234780417 357828000 /nfs/dbraw/zinc/82/80/00/357828000.db2.gz YJGIKQFRCZNCNT-NSHDSACASA-N 2 0 242.407 2.012 20 0 BEADRP CC[NH+](CC)[C@@H]1CCN(c2cc[nH+]cc2C)C1 ZINC000192636003 357842164 /nfs/dbraw/zinc/84/21/64/357842164.db2.gz RTORFRRYXNUFNO-CYBMUJFWSA-N 2 0 233.359 2.311 20 0 BEADRP CC(C)C[C@@H](C[NH3+])NCc1cccc(F)c1F ZINC000583740342 357931515 /nfs/dbraw/zinc/93/15/15/357931515.db2.gz RRBYTTNDEKZUDE-NSHDSACASA-N 2 0 242.313 2.428 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]CCC2(F)CCC2)C1 ZINC000583763863 357938508 /nfs/dbraw/zinc/93/85/08/357938508.db2.gz MQLGIPDSUMFQBZ-QWRGUYRKSA-N 2 0 214.328 2.128 20 0 BEADRP COCc1ccc(C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)cc1 ZINC000584517360 358028810 /nfs/dbraw/zinc/02/88/10/358028810.db2.gz VXYYTBQSEBVEFX-HUUCEWRRSA-N 2 0 248.370 2.193 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]C2CCC2)c2ccccc21 ZINC000169240336 134249888 /nfs/dbraw/zinc/24/98/88/134249888.db2.gz SBLAUDULRUUGNC-OLZOCXBDSA-N 2 0 202.301 2.273 20 0 BEADRP C([NH2+]C(C1CC1)C1CC1)[C@H]1CC[N@@H+](C2CC2)C1 ZINC000037649100 358084979 /nfs/dbraw/zinc/08/49/79/358084979.db2.gz CYYXPSSBTUHCMK-LLVKDONJSA-N 2 0 234.387 2.249 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]CC2CC2)c2ccccc21 ZINC000169232403 134250284 /nfs/dbraw/zinc/25/02/84/134250284.db2.gz MUEQIPSIOVLDGY-OLZOCXBDSA-N 2 0 202.301 2.131 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H]1C[C@H]2C[C@H]2C1 ZINC000584585631 358099816 /nfs/dbraw/zinc/09/98/16/358099816.db2.gz OQLISOSSOBKKBD-FMSGJZPZSA-N 2 0 245.370 2.298 20 0 BEADRP C[C@H](C[NH2+][C@@H](C)Cc1cccs1)C[NH+](C)C ZINC000390372780 491122103 /nfs/dbraw/zinc/12/21/03/491122103.db2.gz WIAAKQJBKNOCTN-NEPJUHHUSA-N 2 0 240.416 2.466 20 0 BEADRP C[C@H](Cc1cccs1)[NH2+]C[C@H](C)C[NH+](C)C ZINC000390372781 491122117 /nfs/dbraw/zinc/12/21/17/491122117.db2.gz WIAAKQJBKNOCTN-NWDGAFQWSA-N 2 0 240.416 2.466 20 0 BEADRP CCC[C@H](C)C[N@@H+]1CC[C@H](C[NH+](C)C)C1 ZINC000180230524 366397125 /nfs/dbraw/zinc/39/71/25/366397125.db2.gz BSTWGJPXWSPUKG-QWHCGFSZSA-N 2 0 212.381 2.306 20 0 BEADRP CSCC[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000173882867 134278315 /nfs/dbraw/zinc/27/83/15/134278315.db2.gz NZZOJRJDINFNLV-ZDUSSCGKSA-N 2 0 242.432 2.157 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@H](C)c2cccnc2)CC1 ZINC000044517484 358388710 /nfs/dbraw/zinc/38/87/10/358388710.db2.gz DRRMHQXUGQWEDY-CYBMUJFWSA-N 2 0 247.386 2.464 20 0 BEADRP C1CC1C([NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)C1CC1 ZINC000130153104 358610334 /nfs/dbraw/zinc/61/03/34/358610334.db2.gz WPRNTUTZTOAJER-UONOGXRCSA-N 2 0 234.387 2.391 20 0 BEADRP C[C@H](Cn1ccnc1)Nc1nc2ccccc2[nH]1 ZINC000049235884 358677102 /nfs/dbraw/zinc/67/71/02/358677102.db2.gz DLCBRPVYSAHKAP-SNVBAGLBSA-N 2 0 241.298 2.260 20 0 BEADRP CCCCOCC[N@H+](CCC)C1CC[NH2+]CC1 ZINC000049264102 358678494 /nfs/dbraw/zinc/67/84/94/358678494.db2.gz QGYURZPXXSYOGN-UHFFFAOYSA-N 2 0 242.407 2.267 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+]C1Cc2ccccc2C1 ZINC000049553886 358694564 /nfs/dbraw/zinc/69/45/64/358694564.db2.gz GVFQCMNOCOEOSF-LBPRGKRZSA-N 2 0 232.371 2.084 20 0 BEADRP C[C@H](CC[NH+](C)C)N[C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000132060020 358705619 /nfs/dbraw/zinc/70/56/19/358705619.db2.gz KZVOSBBGCYLGHT-UGFHNGPFSA-N 2 0 247.386 2.061 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)C1CCC1 ZINC000132416313 491135841 /nfs/dbraw/zinc/13/58/41/491135841.db2.gz XAYYSTZSAJEYPP-IACUBPJLSA-N 2 0 222.376 2.391 20 0 BEADRP CC(C)[C@H]([NH3+])CC[N@H+](C)Cc1cccc(O)c1 ZINC000133338805 358751336 /nfs/dbraw/zinc/75/13/36/358751336.db2.gz LMWZSDMKWQEDNW-CQSZACIVSA-N 2 0 236.359 2.197 20 0 BEADRP COC[C@H]([NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1)C(C)C ZINC000623430567 358819989 /nfs/dbraw/zinc/81/99/89/358819989.db2.gz YAQGOOJZSDECMI-OLZOCXBDSA-N 2 0 242.407 2.120 20 0 BEADRP C[C@@H](CC[NH3+])[NH2+]Cc1cccc2cccnc21 ZINC000136134559 358864996 /nfs/dbraw/zinc/86/49/96/358864996.db2.gz DWJRVABTYGIIDU-NSHDSACASA-N 2 0 229.327 2.062 20 0 BEADRP C[C@H]([NH2+]CC1C[NH2+]C1)c1cccc(Cl)c1 ZINC000423308369 192695660 /nfs/dbraw/zinc/69/56/60/192695660.db2.gz XQHBKMVFOQGTKV-VIFPVBQESA-N 2 0 224.735 2.210 20 0 BEADRP C[NH+](C)CCC[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC000135610512 358846811 /nfs/dbraw/zinc/84/68/11/358846811.db2.gz YWGGPAKHNDNXQC-GJZGRUSLSA-N 2 0 232.371 2.331 20 0 BEADRP C[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1)[C@H]1CCCOC1 ZINC000578324011 366512846 /nfs/dbraw/zinc/51/28/46/366512846.db2.gz CJHVTTGBNIRXMJ-DOMZBBRYSA-N 2 0 248.370 2.050 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]CC(C2CC2)C2CC2)C1 ZINC000086404705 358968356 /nfs/dbraw/zinc/96/83/56/358968356.db2.gz SXPHMFZZMFGWJD-STQMWFEESA-N 2 0 222.376 2.282 20 0 BEADRP C(C[NH2+][C@H]1CCCSC1)C[NH+]1CCCCC1 ZINC000061571798 358934981 /nfs/dbraw/zinc/93/49/81/358934981.db2.gz TYDLOLJNFDIPRD-ZDUSSCGKSA-N 2 0 242.432 2.348 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CCC2CC2)CC1(C)C ZINC000623432693 358946002 /nfs/dbraw/zinc/94/60/02/358946002.db2.gz FTEWZKWWZIRVHS-LBPRGKRZSA-N 2 0 210.365 2.249 20 0 BEADRP CC(C)O[C@@H]1C[C@@H]([NH2+]CC2([NH3+])CCC2)C1(C)C ZINC000423315962 192702446 /nfs/dbraw/zinc/70/24/46/192702446.db2.gz BHVDIRCNJSDQDW-VXGBXAGGSA-N 2 0 240.391 2.050 20 0 BEADRP CC(C)[C@H]1C[C@@H]([NH2+]CCCC[NH+](C)C)CCO1 ZINC000070360767 359051596 /nfs/dbraw/zinc/05/15/96/359051596.db2.gz SBPGHNHEHWLTPF-UONOGXRCSA-N 2 0 242.407 2.121 20 0 BEADRP CO[C@H](C[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1)C(C)(C)C ZINC000247136594 359196690 /nfs/dbraw/zinc/19/66/90/359196690.db2.gz QPQOCXBSLAJZDJ-RWMBFGLXSA-N 2 0 242.407 2.120 20 0 BEADRP C[C@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)[C@H]1C[C@H]1C ZINC000423348664 192724133 /nfs/dbraw/zinc/72/41/33/192724133.db2.gz UGXARFUCYAZQJI-VOAKCMCISA-N 2 0 210.365 2.010 20 0 BEADRP c1ccc2c(c1)CC[C@H]2[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000423353664 192725832 /nfs/dbraw/zinc/72/58/32/192725832.db2.gz BWQIAXZHGNIKJG-UKRRQHHQSA-N 2 0 230.355 2.406 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+][C@@H]1CC=CCC1 ZINC000247233835 359203678 /nfs/dbraw/zinc/20/36/78/359203678.db2.gz XEADMHTWLUHBPI-AAVRWANBSA-N 2 0 222.376 2.413 20 0 BEADRP C[C@@H]([NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21)[C@H](C)C1CCCCC1 ZINC000423458310 192778230 /nfs/dbraw/zinc/77/82/30/192778230.db2.gz PZFMGDBCVDOQDK-WPTOEGHWSA-N 2 0 236.403 2.399 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)c1ccncc1 ZINC000423444854 192772648 /nfs/dbraw/zinc/77/26/48/192772648.db2.gz RJHLVUAZDPFWMJ-BYCMXARLSA-N 2 0 245.370 2.120 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]Cc1ccc2c(c1)CCCN2 ZINC000423450097 192774807 /nfs/dbraw/zinc/77/48/07/192774807.db2.gz SICRYUSBUFDWOL-RYUDHWBXSA-N 2 0 247.386 2.260 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])C1)c1ccccc1 ZINC000423492118 192793633 /nfs/dbraw/zinc/79/36/33/192793633.db2.gz LVGSUIXIWBTEQZ-OBJOEFQTSA-N 2 0 218.344 2.465 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[C@@H]([NH3+])C1)c1ccncc1 ZINC000423465849 192782575 /nfs/dbraw/zinc/78/25/75/192782575.db2.gz HYDHLFMIVWVNMD-SGMGOOAPSA-N 2 0 233.359 2.250 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[C@@H]([NH3+])C1)C1(C)CC1 ZINC000423473771 192785416 /nfs/dbraw/zinc/78/54/16/192785416.db2.gz OBTSELLHXGNVRK-SDDRHHMPSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@H](C2CC2)C2CCC2)C1 ZINC000423511314 192800563 /nfs/dbraw/zinc/80/05/63/192800563.db2.gz PXZWVJVKMGFLBC-SWHYSGLUSA-N 2 0 222.376 2.282 20 0 BEADRP CCCC1(C[NH2+][C@H](C)[C@H]2CCC[NH2+]2)CC1 ZINC000400674382 359487559 /nfs/dbraw/zinc/48/75/59/359487559.db2.gz VFTBDRAHHSMWIQ-VXGBXAGGSA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@H]([NH2+]CCC1=CC[NH2+]CC1)[C@@H]1C[C@@H]1C ZINC000423540450 192807772 /nfs/dbraw/zinc/80/77/72/192807772.db2.gz QIOPYQWOZVOWHL-YUTCNCBUSA-N 2 0 222.376 2.320 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H](C[NH3+])C1)C1CCSCC1 ZINC000423501290 192797267 /nfs/dbraw/zinc/79/72/67/192797267.db2.gz JHVWNAKZXBHWEK-DMDPSCGWSA-N 2 0 242.432 2.235 20 0 BEADRP C[C@H](Cc1ccsc1)[NH2+][C@@H](C)[C@H](C)[NH3+] ZINC000379542096 359540149 /nfs/dbraw/zinc/54/01/49/359540149.db2.gz QUTUZVRXRHLLJV-UTLUCORTSA-N 2 0 212.362 2.004 20 0 BEADRP C1CC2(C1)CC[C@@H]2[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000423543609 192809110 /nfs/dbraw/zinc/80/91/10/192809110.db2.gz NLNXOXSLYCPALN-FQUUOJAGSA-N 2 0 234.387 2.297 20 0 BEADRP C1CC2(C1)CC[C@@H]2[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000423543610 192809166 /nfs/dbraw/zinc/80/91/66/192809166.db2.gz NLNXOXSLYCPALN-RQJABVFESA-N 2 0 234.387 2.297 20 0 BEADRP CC[C@H]([NH2+]CCC1=CC[NH2+]CC1)C(C)C ZINC000423553024 192812024 /nfs/dbraw/zinc/81/20/24/192812024.db2.gz JYYZGSRSXTZYBA-ZDUSSCGKSA-N 2 0 210.365 2.320 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+][C@H](C)CC[NH+](C)C ZINC000309000647 491141511 /nfs/dbraw/zinc/14/15/11/491141511.db2.gz NZBOUFCPFJAXPQ-FRRDWIJNSA-N 2 0 212.381 2.351 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H]2CCCC23CC3)C1 ZINC000578454354 366575059 /nfs/dbraw/zinc/57/50/59/366575059.db2.gz XLDZAYNGWDHVOO-QWHCGFSZSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@@H](C)CC1CCC1 ZINC000133007878 491145184 /nfs/dbraw/zinc/14/51/84/491145184.db2.gz LGQHKXCDSFYVLL-NEPJUHHUSA-N 2 0 212.381 2.495 20 0 BEADRP CC[NH+](CC)CCC[N@@H+]1CC[C@@](C)(COC)C1 ZINC000451202091 202378555 /nfs/dbraw/zinc/37/85/55/202378555.db2.gz LWZHZFUGPHRKBL-CQSZACIVSA-N 2 0 242.407 2.077 20 0 BEADRP COc1cccc(C[N@H+](C)CC[C@@H]2CC[NH2+]C2)c1 ZINC000089749231 360036945 /nfs/dbraw/zinc/03/69/45/360036945.db2.gz ZEYNRECJGJOTHO-ZDUSSCGKSA-N 2 0 248.370 2.127 20 0 BEADRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]CCOC1CCCCC1 ZINC000089150694 359993893 /nfs/dbraw/zinc/99/38/93/359993893.db2.gz WLEMJNDWGGERBG-OCCSQVGLSA-N 2 0 240.391 2.053 20 0 BEADRP CCOc1cccc(C[NH2+][C@H]2CCC[C@@H]2C[NH3+])c1 ZINC000089149829 359994001 /nfs/dbraw/zinc/99/40/01/359994001.db2.gz KMKUVOFNLRWKEV-HIFRSBDPSA-N 2 0 248.370 2.302 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+]C2(C)CCC2)CC1(C)C ZINC000623472375 360056920 /nfs/dbraw/zinc/05/69/20/360056920.db2.gz NNMJJXHXTMNBON-LLVKDONJSA-N 2 0 210.365 2.391 20 0 BEADRP Cc1ncccc1CN(C)C[C@@H]1CCC[N@H+](C)C1 ZINC000092253877 360159534 /nfs/dbraw/zinc/15/95/34/360159534.db2.gz NOBYXWKNHJFGIT-CQSZACIVSA-N 2 0 247.386 2.164 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]Cc2ccc(F)cc2F)C1 ZINC000093215770 360222930 /nfs/dbraw/zinc/22/29/30/360222930.db2.gz PFPUWPSGCZAFKO-NWDGAFQWSA-N 2 0 240.297 2.324 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]C[C@@]2(C)CCCO2)CC1 ZINC000094797937 360318350 /nfs/dbraw/zinc/31/83/50/360318350.db2.gz CEWKCSDJBLDGIL-CQSZACIVSA-N 2 0 240.391 2.018 20 0 BEADRP CC1(C)CCC[C@@H]([NH2+][C@H]2CCCNC2)C1 ZINC000149299697 360615370 /nfs/dbraw/zinc/61/53/70/360615370.db2.gz ADNXMSXBNJLJIT-NEPJUHHUSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]([NH3+])c1ccc(CNCC[NH2+]C(C)(C)C)cc1 ZINC000414815264 200766592 /nfs/dbraw/zinc/76/65/92/200766592.db2.gz OYZCUIHVIQVWCP-LBPRGKRZSA-N 2 0 249.402 2.184 20 0 BEADRP CCSc1cccc(C[NH2+]C[C@H](C)C[NH3+])c1 ZINC000414885781 200775505 /nfs/dbraw/zinc/77/55/05/200775505.db2.gz XKOHVIXHMFAWPG-LLVKDONJSA-N 2 0 238.400 2.483 20 0 BEADRP [NH3+]C1(C[NH2+]CC2CCCCCC2)CCOCC1 ZINC000629389450 361036233 /nfs/dbraw/zinc/03/62/33/361036233.db2.gz XVKMRIAFGUCFDA-UHFFFAOYSA-N 2 0 240.391 2.054 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1[NH2+][C@H]1CCC[C@@H](C)C1 ZINC000629390214 361037959 /nfs/dbraw/zinc/03/79/59/361037959.db2.gz ANRDGSIDMLDRBB-MROQNXINSA-N 2 0 210.365 2.295 20 0 BEADRP CC(C)CCC[C@@H](C)[NH2+]CC1([NH3+])CCOCC1 ZINC000629387642 361040107 /nfs/dbraw/zinc/04/01/07/361040107.db2.gz IJJLUWBHSANGEM-CYBMUJFWSA-N 2 0 242.407 2.299 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1[NH2+]CC1CCCCC1 ZINC000629390603 361044349 /nfs/dbraw/zinc/04/43/49/361044349.db2.gz IYQYUYZCNOCZSJ-QWHCGFSZSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1CC(C)(C)CC[C@H]1[NH2+]CCOCCC[NH3+] ZINC000629399702 361051027 /nfs/dbraw/zinc/05/10/27/361051027.db2.gz KIKNPGKMOREXBF-CHWSQXEVSA-N 2 0 242.407 2.156 20 0 BEADRP CC[C@H]1CCC[C@H](C[NH2+]CCOCCC[NH3+])C1 ZINC000629399775 361051083 /nfs/dbraw/zinc/05/10/83/361051083.db2.gz BOIQOQIRBOOVLC-KBPBESRZSA-N 2 0 242.407 2.158 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+]C1C[C@H](C)C[C@@H](C)C1 ZINC000629406191 361053802 /nfs/dbraw/zinc/05/38/02/361053802.db2.gz JYBWYRSPHTXCHH-HNCHTBHHSA-N 2 0 210.365 2.151 20 0 BEADRP C[C@H]1CC(C)(C)CC[C@@H]1[NH2+][C@@H]1CC[NH2+]C1 ZINC000629409909 361058136 /nfs/dbraw/zinc/05/81/36/361058136.db2.gz XTTFRFQIQSMPEX-TUAOUCFPSA-N 2 0 210.365 2.153 20 0 BEADRP Cc1cccc2c1C[C@H]([NH2+][C@H](C)C[C@@H](C)[NH3+])CO2 ZINC000629513166 361109780 /nfs/dbraw/zinc/10/97/80/361109780.db2.gz FMJCENGYULFGEW-UPJWGTAASA-N 2 0 248.370 2.014 20 0 BEADRP CCC[C@@H](C)[C@H](CC)[NH2+]CC1([NH3+])CCOCC1 ZINC000629520314 361116336 /nfs/dbraw/zinc/11/63/36/361116336.db2.gz GEHBDLRLMPHYLG-OLZOCXBDSA-N 2 0 242.407 2.299 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1[NH2+][C@H](C)[C@@H]1CC1(C)C ZINC000629527486 361130501 /nfs/dbraw/zinc/13/05/01/361130501.db2.gz WYNDXVURJKPHEE-NOOOWODRSA-N 2 0 210.365 2.151 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1[NH2+][C@@H](C)C1CCSCC1 ZINC000629527491 361130659 /nfs/dbraw/zinc/13/06/59/361130659.db2.gz WYYVEOFBDTYNHN-WCFLWFBJSA-N 2 0 242.432 2.248 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1[NH2+][C@H](C)[C@H]1CC1(C)C ZINC000629527488 361131002 /nfs/dbraw/zinc/13/10/02/361131002.db2.gz WYNDXVURJKPHEE-WISYIIOYSA-N 2 0 210.365 2.151 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1[NH2+][C@H]1CC[C@@H]1C1CCC1 ZINC000629528290 361134881 /nfs/dbraw/zinc/13/48/81/361134881.db2.gz VVQAIZPXSAQQIA-ZOBORPQBSA-N 2 0 222.376 2.295 20 0 BEADRP C[NH2+]CCOCC[NH2+][C@H]1C[C@H](C)c2ccccc21 ZINC000629530531 361144426 /nfs/dbraw/zinc/14/44/26/361144426.db2.gz JEHMYWIIVYZJLI-WFASDCNBSA-N 2 0 248.370 2.061 20 0 BEADRP C[NH2+]CCOCC[NH2+][C@@H](C)CCC(C)(C)C ZINC000629530800 361145760 /nfs/dbraw/zinc/14/57/60/361145760.db2.gz RPBZNGWBHOMPAM-LBPRGKRZSA-N 2 0 230.396 2.027 20 0 BEADRP Cc1ccc(C(C)(C)C[NH2+]C2CC[NH2+]CC2)nc1 ZINC000629524034 361121537 /nfs/dbraw/zinc/12/15/37/361121537.db2.gz PVISYDQCTNXBLT-UHFFFAOYSA-N 2 0 247.386 2.009 20 0 BEADRP CCCC[C@@H](C)[C@@H](C)[NH2+]CC1([NH3+])CCOCC1 ZINC000629521793 361121971 /nfs/dbraw/zinc/12/19/71/361121971.db2.gz UNDWNAINDPRXOM-CHWSQXEVSA-N 2 0 242.407 2.299 20 0 BEADRP CCSCC[N@H+](C)CC[C@@H]([NH3+])C(C)C ZINC000158584815 361205135 /nfs/dbraw/zinc/20/51/35/361205135.db2.gz LQPVYOPCANNBLS-LLVKDONJSA-N 2 0 218.410 2.045 20 0 BEADRP Cc1cc(C)cc(CN(C)[C@H](C)C[NH3+])c1 ZINC000158513107 361200657 /nfs/dbraw/zinc/20/06/57/361200657.db2.gz GCZMZLCWKREGCD-GFCCVEGCSA-N 2 0 206.333 2.082 20 0 BEADRP CC1(C)CC(CN2CC[C@@H]3CC[NH2+][C@H]3C2)C1 ZINC000629534005 361163276 /nfs/dbraw/zinc/16/32/76/361163276.db2.gz HVESJYFKBNBHOH-STQMWFEESA-N 2 0 222.376 2.106 20 0 BEADRP C[C@@H]1C[C@@H]1CN1CCCC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000579121906 366716196 /nfs/dbraw/zinc/71/61/96/366716196.db2.gz IAMLKNFWZURJCD-YIYPIFLZSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]CC[C@H]1CC1(F)F ZINC000622043656 370674185 /nfs/dbraw/zinc/67/41/85/370674185.db2.gz HBERAUSNUKQYJT-OUAUKWLOSA-N 2 0 232.318 2.009 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H](C)Cc1cccs1 ZINC000622045752 370679543 /nfs/dbraw/zinc/67/95/43/370679543.db2.gz UXIHWOYSOHEGHP-UWVGGRQHSA-N 2 0 212.362 2.006 20 0 BEADRP CCO[C@H]1C[C@H]([NH2+]CC[C@H](C)[NH3+])C12CCCC2 ZINC000622045416 370679708 /nfs/dbraw/zinc/67/97/08/370679708.db2.gz SNQCDUCBHZPYMA-AVGNSLFASA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CCCN(C)C2)[C@@H]1C ZINC000082858900 491156680 /nfs/dbraw/zinc/15/66/80/491156680.db2.gz WQDRSFNXMOSOPW-SYQHCUMBSA-N 2 0 224.392 2.495 20 0 BEADRP COC1(C[C@H](C)[NH2+]CCCC[NH+](C)C)CCC1 ZINC000429514258 201111982 /nfs/dbraw/zinc/11/19/82/201111982.db2.gz HAHRVOFYURSNOO-ZDUSSCGKSA-N 2 0 242.407 2.266 20 0 BEADRP COC(C)(C)CC[N@@H+]1CCC[C@@H]([NH+](C)C)CC1 ZINC000429541356 201112015 /nfs/dbraw/zinc/11/20/15/201112015.db2.gz OPLJBKUXDNJOOT-CYBMUJFWSA-N 2 0 242.407 2.218 20 0 BEADRP CC[C@@H]1CC[C@@H](C)C[C@H]1[NH2+]CCOCCC[NH3+] ZINC000629536296 361398525 /nfs/dbraw/zinc/39/85/25/361398525.db2.gz GBHLIFCZEXBAAZ-MGPQQGTHSA-N 2 0 242.407 2.156 20 0 BEADRP Cc1ccc([C@H](C)[NH2+]CCOCCC[NH3+])s1 ZINC000629536968 361399883 /nfs/dbraw/zinc/39/98/83/361399883.db2.gz HYWHEENOWMXXMN-NSHDSACASA-N 2 0 242.388 2.073 20 0 BEADRP CC[C@@H]1C[C@@H](C)CC[C@H]1[NH2+]CCOCCC[NH3+] ZINC000629537231 361401236 /nfs/dbraw/zinc/40/12/36/361401236.db2.gz JFIKCLDMTDVASS-BFHYXJOUSA-N 2 0 242.407 2.156 20 0 BEADRP [NH3+]C1(C[NH2+]CCCC2CCCC2)CCC1 ZINC000336680904 181331978 /nfs/dbraw/zinc/33/19/78/181331978.db2.gz RJNPWFYLONJKHS-UHFFFAOYSA-N 2 0 210.365 2.428 20 0 BEADRP CCSCC[N@@H+]1CCC[C@@H]([NH+](C)C)CC1 ZINC000429555280 201114578 /nfs/dbraw/zinc/11/45/78/201114578.db2.gz VYFHVYAVIWGZPQ-GFCCVEGCSA-N 2 0 230.421 2.156 20 0 BEADRP CCC[C@](C)([NH3+])C(=O)Nc1ccc([C@H](C)[NH3+])cc1 ZINC000429573220 201117836 /nfs/dbraw/zinc/11/78/36/201117836.db2.gz YFXOGACSBNCGFM-HZMBPMFUSA-N 2 0 249.358 2.162 20 0 BEADRP CCC[C@](C)([NH3+])C(=O)Nc1ccc([C@@H](C)[NH3+])cc1 ZINC000429573223 201118699 /nfs/dbraw/zinc/11/86/99/201118699.db2.gz YFXOGACSBNCGFM-YGRLFVJLSA-N 2 0 249.358 2.162 20 0 BEADRP CC[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CC[NH2+][C@H]1C ZINC000629544287 361420527 /nfs/dbraw/zinc/42/05/27/361420527.db2.gz JBBDGIAWZIJJOG-LOWDOPEQSA-N 2 0 210.365 2.295 20 0 BEADRP CC1(C)CCC(C)(C)[N@H+](C[C@H]2CC[NH2+]C2)C1 ZINC000629544860 361424251 /nfs/dbraw/zinc/42/42/51/361424251.db2.gz JVIPJVRLEJIMIL-LBPRGKRZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+][C@H]1CCCC12CCCC2 ZINC000629546894 361429308 /nfs/dbraw/zinc/42/93/08/361429308.db2.gz QINCDNTTYOTUDW-XQQFMLRXSA-N 2 0 222.376 2.439 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC[NH2+]C1)[C@@H]1CCCC[C@H]1C ZINC000629553332 361438564 /nfs/dbraw/zinc/43/85/64/361438564.db2.gz WCBMGJYZCRCOOK-FDYHWXHSSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CCCC12CC2)[C@H]1CCC[NH2+]1 ZINC000629554279 361439634 /nfs/dbraw/zinc/43/96/34/361439634.db2.gz HGYIPMFUXMZEAZ-JHJVBQTASA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]1C[NH+](CC[C@@H]2CC[NH2+]C2)C[C@@H](C)C1(F)F ZINC000629554304 361439979 /nfs/dbraw/zinc/43/99/79/361439979.db2.gz ZINSNLOLPXMIFK-UTUOFQBUSA-N 2 0 246.345 2.209 20 0 BEADRP CO[C@H]1C[C@@H](C[NH2+][C@@H]2C[C@@H]([NH3+])c3ccccc32)C1 ZINC000629555521 361447156 /nfs/dbraw/zinc/44/71/56/361447156.db2.gz WHUPMEWIDANCAV-BAESOJJISA-N 2 0 246.354 2.146 20 0 BEADRP CC(C)C[N@@H+]1CC[C@@H](C(F)(F)F)[C@@H](C[NH3+])C1 ZINC000629563982 361458636 /nfs/dbraw/zinc/45/86/36/361458636.db2.gz IUOSXGIKQBVYGU-VHSXEESVSA-N 2 0 238.297 2.102 20 0 BEADRP CC[C@@H](c1ccccc1)[N@H+](C)CCOCC[NH3+] ZINC000629579296 361464485 /nfs/dbraw/zinc/46/44/85/361464485.db2.gz QUFZGMNSCYVKFH-AWEZNQCLSA-N 2 0 236.359 2.045 20 0 BEADRP C[C@]12C[NH2+]C[C@@]1(C)CN(Cc1cccc(F)c1)C2 ZINC000629584269 361469786 /nfs/dbraw/zinc/46/97/86/361469786.db2.gz NRBUCDNDIXNWRO-GASCZTMLSA-N 2 0 248.345 2.257 20 0 BEADRP CC[C@H](C)[N@@H+]1CC[C@H](C(F)(F)F)[C@H](C[NH3+])C1 ZINC000629562474 361455771 /nfs/dbraw/zinc/45/57/71/361455771.db2.gz NJTGPKHQWSSJMX-AEJSXWLSSA-N 2 0 238.297 2.244 20 0 BEADRP CCCC[N@@H+]1CC[C@@H](C(F)(F)F)[C@@H](C[NH3+])C1 ZINC000629567154 361457356 /nfs/dbraw/zinc/45/73/56/361457356.db2.gz WYTMXXXWRGYDPO-VHSXEESVSA-N 2 0 238.297 2.246 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1[NH2+]C[C@@H](C)CC(C)C ZINC000629566545 361457644 /nfs/dbraw/zinc/45/76/44/361457644.db2.gz ULBJZXXCCBKPAB-RWMBFGLXSA-N 2 0 212.381 2.399 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CC[C@H]2C(C)C)C1 ZINC000309966763 491158626 /nfs/dbraw/zinc/15/86/26/491158626.db2.gz NVEILGGYULBHNL-HZSPNIEDSA-N 2 0 224.392 2.352 20 0 BEADRP COC1(C[NH2+]C[C@H](N)c2ccccc2)CCCC1 ZINC000629647651 361537663 /nfs/dbraw/zinc/53/76/63/361537663.db2.gz DBCVRMANCCFORA-AWEZNQCLSA-N 2 0 248.370 2.235 20 0 BEADRP Cc1cnccc1C[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000629648578 361541882 /nfs/dbraw/zinc/54/18/82/361541882.db2.gz RKZPMASPTANSOX-AWEZNQCLSA-N 2 0 245.370 2.154 20 0 BEADRP Cc1cnccc1C[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000629648579 361541983 /nfs/dbraw/zinc/54/19/83/361541983.db2.gz RKZPMASPTANSOX-CQSZACIVSA-N 2 0 245.370 2.154 20 0 BEADRP Cc1cnccc1C[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000629648904 361542541 /nfs/dbraw/zinc/54/25/41/361542541.db2.gz CCEKUWCQEBCRJP-AWEZNQCLSA-N 2 0 233.359 2.012 20 0 BEADRP Cc1cnccc1C[NH2+]C[C@H]1CC[C@H](C[NH3+])CC1 ZINC000629649154 361543495 /nfs/dbraw/zinc/54/34/95/361543495.db2.gz JTLPGYNNXDIVAZ-HDJSIYSDSA-N 2 0 247.386 2.245 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1[NH2+]C[C@H](C)C(C)(C)C ZINC000629653617 361552622 /nfs/dbraw/zinc/55/26/22/361552622.db2.gz KQWACEXRIKQCDH-SDDRHHMPSA-N 2 0 212.381 2.399 20 0 BEADRP CCC[C@@H](C)C[N@@H+]1C[C@@]2(C)C[NH2+]C[C@@]2(C)C1 ZINC000629665242 361595851 /nfs/dbraw/zinc/59/58/51/361595851.db2.gz LGQIKVPDNBPQCH-MCIONIFRSA-N 2 0 224.392 2.354 20 0 BEADRP [NH3+][C@@H]1CSCc2ccc(C3=CC[NH2+]CC3)cc21 ZINC000629722884 361663900 /nfs/dbraw/zinc/66/39/00/361663900.db2.gz GKAZXVYLYCJGQM-CQSZACIVSA-N 2 0 246.379 2.310 20 0 BEADRP CO[C@@H](c1ccc(C2=CC[NH2+]CC2)cc1)[C@H](C)[NH3+] ZINC000629723271 361664620 /nfs/dbraw/zinc/66/46/20/361664620.db2.gz LUOURNACHWBYNT-XHDPSFHLSA-N 2 0 246.354 2.098 20 0 BEADRP C[C@@H]([NH2+]CCC[NH+]1CCCCC1)[C@@H]1CCCO1 ZINC000154413737 201277906 /nfs/dbraw/zinc/27/79/06/201277906.db2.gz HTCLUIDSMNLLHL-KGLIPLIRSA-N 2 0 240.391 2.020 20 0 BEADRP CC[N@H+](CCC(F)(F)F)[C@@H]1CCC[NH2+]CC1 ZINC000435626917 201279210 /nfs/dbraw/zinc/27/92/10/201279210.db2.gz LZSOHVMLLSXHLX-SNVBAGLBSA-N 2 0 238.297 2.403 20 0 BEADRP C[C@@H]1Cc2ccc(C3=CC[NH2+]CC3)cc2C[NH2+]1 ZINC000629722590 361662578 /nfs/dbraw/zinc/66/25/78/361662578.db2.gz CSUPUQOPCZSKCU-LLVKDONJSA-N 2 0 228.339 2.098 20 0 BEADRP C[NH2+]CCC[N@@H+]1Cc2ccccc2C[C@@H]1C ZINC000435878766 201293643 /nfs/dbraw/zinc/29/36/43/201293643.db2.gz FUUWPMKIGYSZES-LBPRGKRZSA-N 2 0 218.344 2.043 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+]Cc1cccs1 ZINC000335277796 181344527 /nfs/dbraw/zinc/34/45/27/181344527.db2.gz KAIBYQIVMSQAHY-UYVFGJEYSA-N 2 0 236.384 2.354 20 0 BEADRP CC(C)N(C)CC[NH2+][C@@H](C)C(C)(C)C ZINC000155781080 201353445 /nfs/dbraw/zinc/35/34/45/201353445.db2.gz QRCJMONMMIQWGX-NSHDSACASA-N 2 0 200.370 2.351 20 0 BEADRP [NH3+]CCC[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1 ZINC000437771098 201371949 /nfs/dbraw/zinc/37/19/49/201371949.db2.gz GSVFCTLJGAUSLQ-HUUCEWRRSA-N 2 0 232.371 2.336 20 0 BEADRP CC(C)[C@H](C)C[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000156110854 201399142 /nfs/dbraw/zinc/39/91/42/201399142.db2.gz DPVZYFJCQRJZFN-HZSPNIEDSA-N 2 0 224.392 2.495 20 0 BEADRP [NH3+]CC1CC[NH+](CCCOc2ccccc2)CC1 ZINC000020267180 181365097 /nfs/dbraw/zinc/36/50/97/181365097.db2.gz AHYUXZNOOSHEMO-UHFFFAOYSA-N 2 0 248.370 2.126 20 0 BEADRP [NH3+]CC1CC[NH+](C/C=C/c2ccccc2)CC1 ZINC000044513348 181364929 /nfs/dbraw/zinc/36/49/29/181364929.db2.gz YTPVVJXNAPIVTL-QPJJXVBHSA-N 2 0 230.355 2.371 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2csc(C)c2)C1 ZINC000296589139 364784591 /nfs/dbraw/zinc/78/45/91/364784591.db2.gz XJHHCAXQJUQCMU-LBPRGKRZSA-N 2 0 238.400 2.488 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+]Cc2csc(C)c2)C1 ZINC000296589132 364784933 /nfs/dbraw/zinc/78/49/33/364784933.db2.gz XJHHCAXQJUQCMU-GFCCVEGCSA-N 2 0 238.400 2.488 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCc2nc[nH]c2C1)c1cncs1 ZINC000573530072 364855276 /nfs/dbraw/zinc/85/52/76/364855276.db2.gz QPTRFJOIXBEKNR-DTWKUNHWSA-N 2 0 248.355 2.074 20 0 BEADRP [NH3+]CCCC[NH2+]Cc1ccc(Cl)cc1 ZINC000037714614 181377558 /nfs/dbraw/zinc/37/75/58/181377558.db2.gz DKERCMQYGWLTEW-UHFFFAOYSA-N 2 0 212.724 2.169 20 0 BEADRP CCc1ccc(C[N@@H+]2CC[C@H]([C@@H](C)[NH3+])C2)s1 ZINC000168493516 364941083 /nfs/dbraw/zinc/94/10/83/364941083.db2.gz NJYPBLKGXSXSQP-MNOVXSKESA-N 2 0 238.400 2.480 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+]Cc1ccc(C(F)F)cc1 ZINC000574139059 364993885 /nfs/dbraw/zinc/99/38/85/364993885.db2.gz XHKDKQXYWMGDSJ-VIFPVBQESA-N 2 0 228.286 2.309 20 0 BEADRP CC[C@H]([NH2+]Cc1ccc(C[NH3+])cc1)C1CC1 ZINC000574206591 365010781 /nfs/dbraw/zinc/01/07/81/365010781.db2.gz YXRLJOPEIJCNBA-AWEZNQCLSA-N 2 0 218.344 2.424 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCC[C@H]1C)C1CC[NH+](C)CC1 ZINC000252125556 541445786 /nfs/dbraw/zinc/44/57/86/541445786.db2.gz JZVMBTRHABMEMH-BZPMIXESSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@H]1CCC12CCOCC2 ZINC000574392334 365047260 /nfs/dbraw/zinc/04/72/60/365047260.db2.gz OZBKNFLIMQXBFR-OLZOCXBDSA-N 2 0 240.391 2.053 20 0 BEADRP Cc1ccc(C[NH2+]Cc2ccc(C[NH3+])cc2)nc1 ZINC000574878495 365161849 /nfs/dbraw/zinc/16/18/49/365161849.db2.gz TUALLVNVRRHZNT-UHFFFAOYSA-N 2 0 241.338 2.139 20 0 BEADRP C[C@@H]1C[NH+](CCC[NH+]2CCCCC2)C[C@H]1C ZINC000444602664 193050408 /nfs/dbraw/zinc/05/04/08/193050408.db2.gz LGZLDLLNXRRXLF-ZIAGYGMSSA-N 2 0 224.392 2.450 20 0 BEADRP COc1cc(C)ccc1[C@H](C)[NH2+]CC[C@H](C)[NH3+] ZINC000575795081 365363050 /nfs/dbraw/zinc/36/30/50/365363050.db2.gz KXAVWKVGWJCQMX-RYUDHWBXSA-N 2 0 236.359 2.392 20 0 BEADRP C[C@H]([NH2+][C@@H](C)[C@H]1CC2CCC1CC2)C1C[NH2+]C1 ZINC000575873235 365399449 /nfs/dbraw/zinc/39/94/49/365399449.db2.gz LNWMWSUZRCVKMN-KBJMEZGRSA-N 2 0 236.403 2.399 20 0 BEADRP CC(C)[NH2+]CCC[NH2+][C@H](C(C)C)C1CC1 ZINC000575914102 365410921 /nfs/dbraw/zinc/41/09/21/365410921.db2.gz BYNMGUZNYOLGEU-CYBMUJFWSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCn2ccnc2)C1 ZINC000182622055 366923150 /nfs/dbraw/zinc/92/31/50/366923150.db2.gz FNRWOTTUJNRBOV-BETUJISGSA-N 2 0 221.348 2.251 20 0 BEADRP Cc1ccoc1C[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655827325 541482309 /nfs/dbraw/zinc/48/23/09/541482309.db2.gz RWKJLDCZPARPTC-TXEJJXNPSA-N 2 0 222.332 2.018 20 0 BEADRP CC[C@@H]([NH3+])CN[C@H](C)c1ccc(C)cc1OC ZINC000579822676 367024497 /nfs/dbraw/zinc/02/44/97/367024497.db2.gz GSVWPNLBGPRPTA-VXGBXAGGSA-N 2 0 236.359 2.392 20 0 BEADRP CC[C@H]([NH3+])CN[C@H](C)c1ccc(C)cc1OC ZINC000579822673 367024558 /nfs/dbraw/zinc/02/45/58/367024558.db2.gz GSVWPNLBGPRPTA-NEPJUHHUSA-N 2 0 236.359 2.392 20 0 BEADRP CC1(C[N@@H+]2CCC[C@H]([C@@H]3CC[NH2+]C3)C2)CC1 ZINC000579958581 367103837 /nfs/dbraw/zinc/10/38/37/367103837.db2.gz KMBWOKDXWBCQMK-OLZOCXBDSA-N 2 0 222.376 2.108 20 0 BEADRP CC[NH+](CC)CCC[NH2+]C1(C2CC2)CC1 ZINC000380362753 367191610 /nfs/dbraw/zinc/19/16/10/367191610.db2.gz ZHMMNCHMIFQPQF-UHFFFAOYSA-N 2 0 210.365 2.251 20 0 BEADRP [NH3+]CC1CCC([NH2+]CCCC2CC2)CC1 ZINC000580887331 367196684 /nfs/dbraw/zinc/19/66/84/367196684.db2.gz PHDYDWWHEKQASK-UHFFFAOYSA-N 2 0 210.365 2.284 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H](c2cccnc2)C2CC2)C1 ZINC000581143656 367277638 /nfs/dbraw/zinc/27/76/38/367277638.db2.gz XLGILDHLVTYSNR-QLFBSQMISA-N 2 0 245.370 2.392 20 0 BEADRP C[C@@H]1CC[N@H+](CC[C@@H]2CCC[NH2+]C2)[C@@H]1C ZINC000380806861 367306184 /nfs/dbraw/zinc/30/61/84/367306184.db2.gz QNEYGBMOYSWATM-UPJWGTAASA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+]C[C@H]1CC[N@@H+](C(C)C)C1 ZINC000381390373 367392613 /nfs/dbraw/zinc/39/26/13/367392613.db2.gz NYXUNEYPERYAFS-MGPQQGTHSA-N 2 0 224.392 2.495 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]C[C@H]1CC[N@@H+](C(C)C)C1 ZINC000381390371 367393118 /nfs/dbraw/zinc/39/31/18/367393118.db2.gz NYXUNEYPERYAFS-MCIONIFRSA-N 2 0 224.392 2.495 20 0 BEADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+][C@H](C)C2CCC2)C1 ZINC000381465734 367410708 /nfs/dbraw/zinc/41/07/08/367410708.db2.gz LDDZZYCVWBMIAG-OLZOCXBDSA-N 2 0 224.392 2.495 20 0 BEADRP CC(C)[N@@H+]1CC[C@H](C[NH2+][C@@H](C)C2CCC2)C1 ZINC000381465736 367410835 /nfs/dbraw/zinc/41/08/35/367410835.db2.gz LDDZZYCVWBMIAG-QWHCGFSZSA-N 2 0 224.392 2.495 20 0 BEADRP c1ccc2c(c1)CC[C@@H]([NH2+]CCC[NH2+]C1CC1)C2 ZINC000382550150 367537151 /nfs/dbraw/zinc/53/71/51/367537151.db2.gz SWTMRHSPQKBKPB-MRXNPFEDSA-N 2 0 244.382 2.276 20 0 BEADRP COc1cccc([C@H](C)[NH2+]CCC[NH2+]C2CC2)c1 ZINC000382562062 367539938 /nfs/dbraw/zinc/53/99/38/367539938.db2.gz WMBHXEVWOQWHBI-LBPRGKRZSA-N 2 0 248.370 2.488 20 0 BEADRP CC1CCC([NH2+]CCC[NH2+]C2CC2)CC1 ZINC000382596925 367547273 /nfs/dbraw/zinc/54/72/73/367547273.db2.gz NJABVDJEGUGQBJ-UHFFFAOYSA-N 2 0 210.365 2.297 20 0 BEADRP CC(C)OCCC[N@H+](C)CC[C@@H]([NH3+])C(C)C ZINC000382801172 367559123 /nfs/dbraw/zinc/55/91/23/367559123.db2.gz KMKNUFGOAPBHKU-CYBMUJFWSA-N 2 0 230.396 2.107 20 0 BEADRP C[C@H](C[C@H]1CCCCC[NH2+]1)N[C@@H](C)C[C@H](C)[NH3+] ZINC000566009783 325983659 /nfs/dbraw/zinc/98/36/59/325983659.db2.gz LPCWZMVINIWHGU-IGQOVBAYSA-N 2 0 241.423 2.013 20 0 BEADRP CC[C@@H]1[C@H](C)CC[N@@H+]1CC[C@@H]1CC[NH2+]C1 ZINC000384106595 367672345 /nfs/dbraw/zinc/67/23/45/367672345.db2.gz DRPMDANYDMCDFE-FRRDWIJNSA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@@H]1[C@@H](C)CC[N@@H+]1CC[C@@H]1CC[NH2+]C1 ZINC000384106603 367672456 /nfs/dbraw/zinc/67/24/56/367672456.db2.gz DRPMDANYDMCDFE-RWMBFGLXSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]C[C@H]1CCCSC1 ZINC000384175986 367674692 /nfs/dbraw/zinc/67/46/92/367674692.db2.gz VNMJSDOKGNSFRH-NWDGAFQWSA-N 2 0 230.421 2.237 20 0 BEADRP C[C@H](CC(C)(C)C)[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000384512703 367695540 /nfs/dbraw/zinc/69/55/40/367695540.db2.gz HOXLCTAGFRESIV-NEPJUHHUSA-N 2 0 212.381 2.400 20 0 BEADRP CC[NH+](CC)CCCC[NH+](CC)CC ZINC000002563417 367739358 /nfs/dbraw/zinc/73/93/58/367739358.db2.gz YXVIGUHBJDFXKZ-UHFFFAOYSA-N 2 0 200.370 2.450 20 0 BEADRP C[N@H+](C/C=C/c1ccccc1)C1CC([NH3+])C1 ZINC000384875827 367746845 /nfs/dbraw/zinc/74/68/45/367746845.db2.gz PQFNGTMUXYLIIP-VMPITWQZSA-N 2 0 216.328 2.121 20 0 BEADRP C[N@H+](Cc1cccc(C2CC2)c1)C1CC([NH3+])C1 ZINC000384886333 367750633 /nfs/dbraw/zinc/75/06/33/367750633.db2.gz SEEAWCSGAXVWNY-UHFFFAOYSA-N 2 0 230.355 2.486 20 0 BEADRP CC/C=C\C[NH2+]C1CC[NH+](CCC)CC1 ZINC000384909720 367756543 /nfs/dbraw/zinc/75/65/43/367756543.db2.gz YGPGVWKABXRUFE-WAYWQWQTSA-N 2 0 210.365 2.417 20 0 BEADRP CC(C)Oc1ccc(C[N@H+](C)C2CC([NH3+])C2)cc1 ZINC000385250784 367813525 /nfs/dbraw/zinc/81/35/25/367813525.db2.gz XAACNMWWROJDLU-UHFFFAOYSA-N 2 0 248.370 2.395 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H]1CCC[C@H]1C(C)C ZINC000581878552 367865559 /nfs/dbraw/zinc/86/55/59/367865559.db2.gz NYDVNYWJTDLHKD-STQMWFEESA-N 2 0 212.381 2.400 20 0 BEADRP CSCC1CCC([NH2+]CCC[NH+](C)C)CC1 ZINC000385355629 367821794 /nfs/dbraw/zinc/82/17/94/367821794.db2.gz GRDIWMHKGMSNDZ-UHFFFAOYSA-N 2 0 244.448 2.450 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]Cc1scnc1C1CC1 ZINC000581824186 367832400 /nfs/dbraw/zinc/83/24/00/367832400.db2.gz AXNFSIAXDPSIOT-BDAKNGLRSA-N 2 0 239.388 2.236 20 0 BEADRP CC[N@H+](CCC1CC1)C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000385489140 367835836 /nfs/dbraw/zinc/83/58/36/367835836.db2.gz DXBFFHYIWKLTDL-TZMCWYRMSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]([N@H+](C)CC[C@H]1CC[NH2+]C1)C1(C)CC1 ZINC000385524030 367840284 /nfs/dbraw/zinc/84/02/84/367840284.db2.gz WANLMNUJDXXFEQ-NWDGAFQWSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]([N@H+](C)CC[C@@H]1CC[NH2+]C1)C1(C)CC1 ZINC000385524021 367840996 /nfs/dbraw/zinc/84/09/96/367840996.db2.gz WANLMNUJDXXFEQ-NEPJUHHUSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CC2([NH3+])CCCCC2)[C@@H]1C ZINC000386085141 367909940 /nfs/dbraw/zinc/90/99/40/367909940.db2.gz DTWBGWABCBXYDW-IJLUTSLNSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC2([NH3+])CCCCC2)[C@H]1C ZINC000386085145 367910013 /nfs/dbraw/zinc/91/00/13/367910013.db2.gz DTWBGWABCBXYDW-WOPDTQHZSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[C@@H](C)C1)[C@@H]1CCCC[NH2+]1 ZINC000386103620 367912924 /nfs/dbraw/zinc/91/29/24/367912924.db2.gz KFOXVTHZSOXRRX-VOAKCMCISA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CC1(C)C)[C@H]1CCCC[NH2+]1 ZINC000386100084 367913003 /nfs/dbraw/zinc/91/30/03/367913003.db2.gz JQHZTZLVKPOQFY-QJPTWQEYSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC1(C)C)[C@@H]1CCCC[NH2+]1 ZINC000386129366 367915695 /nfs/dbraw/zinc/91/56/95/367915695.db2.gz OHHNMWGJKIJTPJ-SRVKXCTJSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H]([NH2+]CC1CCCC1)[C@H]1CCCC[NH2+]1 ZINC000385984601 367892757 /nfs/dbraw/zinc/89/27/57/367892757.db2.gz DBWNCRRILBDTRG-WCQYABFASA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CC=CCC1)[C@H]1CCCC[NH2+]1 ZINC000386013675 367897273 /nfs/dbraw/zinc/89/72/73/367897273.db2.gz NDNOJVJOBZDDPZ-BFHYXJOUSA-N 2 0 222.376 2.463 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]Cc2ccc(C[NH3+])cc2)[C@H]1C ZINC000386310585 367948360 /nfs/dbraw/zinc/94/83/60/367948360.db2.gz WUBYWVCJZGWWMD-SUNKGSAMSA-N 2 0 218.344 2.279 20 0 BEADRP CSC1(C[NH2+][C@@H](C)[C@@H]2CCCC[NH2+]2)CCC1 ZINC000386598234 368000453 /nfs/dbraw/zinc/00/04/53/368000453.db2.gz UBAONMAWVJGHDF-RYUDHWBXSA-N 2 0 242.432 2.392 20 0 BEADRP C[C@H](NCCc1ccccc1)[C@H]1CCCC[NH2+]1 ZINC000386612493 368001882 /nfs/dbraw/zinc/00/18/82/368001882.db2.gz WVZWSYKKDJXZSA-DZGCQCFKSA-N 2 0 232.371 2.349 20 0 BEADRP CCOCC(C)(C)C[NH2+][C@H](C)[C@@H]1CCCC[NH2+]1 ZINC000386506000 367981978 /nfs/dbraw/zinc/98/19/78/367981978.db2.gz WMPTVIVGCDVPDG-OLZOCXBDSA-N 2 0 242.407 2.169 20 0 BEADRP C[C@@H]1CC[C@H](N[C@@H]2CCCc3occc32)C[NH2+]1 ZINC000399283572 368066829 /nfs/dbraw/zinc/06/68/29/368066829.db2.gz YHSWKJUWRGSOCD-NTZNESFSSA-N 2 0 234.343 2.387 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+][C@H]1CC12CCCC2 ZINC000387155267 368072025 /nfs/dbraw/zinc/07/20/25/368072025.db2.gz QAVXEBPTMQLYIX-SRVKXCTJSA-N 2 0 208.349 2.036 20 0 BEADRP Cc1cc(C)c(C[N@@H+]2CC[C@@H]([NH3+])[C@H](C)C2)c(C)n1 ZINC000631821612 368973092 /nfs/dbraw/zinc/97/30/92/368973092.db2.gz DGOPOYZBPSHHRH-IAQYHMDHSA-N 2 0 247.386 2.176 20 0 BEADRP C[N@@H+]1CCCC[C@H](C[NH2+]C[C@H]2CCSC2)C1 ZINC000623657107 368997175 /nfs/dbraw/zinc/99/71/75/368997175.db2.gz JWUZLTPSELDXBW-CHWSQXEVSA-N 2 0 242.432 2.061 20 0 BEADRP CCn1cccc1C[NH2+]C[C@H]1CC[N@@H+](C(C)C)C1 ZINC000091025828 369004082 /nfs/dbraw/zinc/00/40/82/369004082.db2.gz NGTGRSDDOGIJQL-CQSZACIVSA-N 2 0 249.402 2.328 20 0 BEADRP Cc1cc(C)c(C[N@H+]2CC[C@H]([C@@H](C)[NH3+])C2)c(C)n1 ZINC000631824193 368987199 /nfs/dbraw/zinc/98/71/99/368987199.db2.gz YJQASIAHMPZSQK-OCCSQVGLSA-N 2 0 247.386 2.176 20 0 BEADRP [NH3+]C[C@H]1CC[C@H]([NH2+]C2CCCCCC2)C1 ZINC000335581020 181465714 /nfs/dbraw/zinc/46/57/14/181465714.db2.gz LASPKMBKWRQNTO-AAEUAGOBSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@@H](C1CC1)[N@H+](CCc1cncn1C)C1CC1 ZINC000459292335 203248303 /nfs/dbraw/zinc/24/83/03/203248303.db2.gz DINUZTGZGAHKBD-NSHDSACASA-N 2 0 233.359 2.226 20 0 BEADRP CC(C)(C)C[NH2+][C@H]1CCN(CC2CC2)C1 ZINC000108424018 369392868 /nfs/dbraw/zinc/39/28/68/369392868.db2.gz KZWQZLDLMSYDCU-LBPRGKRZSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H](Cc1ccsc1)N[C@@H](C)[C@@H]1CCC[NH2+]1 ZINC000400483030 369350777 /nfs/dbraw/zinc/35/07/77/369350777.db2.gz WPTAGDQTUUEHOP-MDZLAQPJSA-N 2 0 238.400 2.409 20 0 BEADRP CCO[C@@]1(C)C[C@H]1[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623676813 369367586 /nfs/dbraw/zinc/36/75/86/369367586.db2.gz FZZJBFKVNLRFLK-BZPMIXESSA-N 2 0 240.391 2.016 20 0 BEADRP Cc1ccc(C)c(OCCN2C[C@H]([NH3+])C[C@H]2C)c1 ZINC000631857635 369435762 /nfs/dbraw/zinc/43/57/62/369435762.db2.gz LENOYIWQOXMQMO-ZIAGYGMSSA-N 2 0 248.370 2.104 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC000459730294 203344051 /nfs/dbraw/zinc/34/40/51/203344051.db2.gz KDTKJUNAPPZDIW-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CCC[C@H]1[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC000459730296 203345376 /nfs/dbraw/zinc/34/53/76/203345376.db2.gz KDTKJUNAPPZDIW-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)[C@H](C)[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC000459736647 203346458 /nfs/dbraw/zinc/34/64/58/203346458.db2.gz QEFSUWFEHVGBHT-STQMWFEESA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)C1CC1 ZINC000459779691 203365374 /nfs/dbraw/zinc/36/53/74/203365374.db2.gz LNDYZWCONYDWEF-NWDGAFQWSA-N 2 0 210.365 2.106 20 0 BEADRP C[N@@H+]1CCC[C@@H]1CC[NH2+][C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000459795038 203373929 /nfs/dbraw/zinc/37/39/29/203373929.db2.gz XGVGBIPVMITCNQ-YIYPIFLZSA-N 2 0 222.376 2.249 20 0 BEADRP C[N@@H+]1CCC[C@H](CC[NH2+]C[C@@H]2CCSC2)C1 ZINC000459794362 203370154 /nfs/dbraw/zinc/37/01/54/203370154.db2.gz UMBJWLKKCMPLEN-OLZOCXBDSA-N 2 0 242.432 2.061 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@H]([NH+](C)C)C1)C1CC1 ZINC000165543197 203384820 /nfs/dbraw/zinc/38/48/20/203384820.db2.gz MKZKTHNKXUDWNL-DRZSPHRISA-N 2 0 210.365 2.247 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+]C[C@@H](C1CC1)N(C)C ZINC000166204599 203387323 /nfs/dbraw/zinc/38/73/23/203387323.db2.gz VVHQPKDXKBUNBW-GVXVVHGQSA-N 2 0 212.381 2.351 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]CCC[C@H]2CCCCO2)C1 ZINC000568249013 326334833 /nfs/dbraw/zinc/33/48/33/326334833.db2.gz DTCFWNNMAMNELH-MGPQQGTHSA-N 2 0 240.391 2.195 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+][C@@H]1CC[NH2+]C[C@@H]1C ZINC000310484321 370348312 /nfs/dbraw/zinc/34/83/12/370348312.db2.gz DOKFLBYXWIJWGP-OUCADQQQSA-N 2 0 236.359 2.188 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CC1(F)F)C1CC[NH+](C)CC1 ZINC000621769669 370513123 /nfs/dbraw/zinc/51/31/23/370513123.db2.gz FJIHLYIEWUIEJJ-PWSUYJOCSA-N 2 0 246.345 2.352 20 0 BEADRP CC1CC(C[NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)C1 ZINC000621771810 370514990 /nfs/dbraw/zinc/51/49/90/370514990.db2.gz NGKGNURXKTWFEF-KPFVRQRISA-N 2 0 210.365 2.105 20 0 BEADRP CC[NH+]1CCC([NH2+]CC[C@H]2CC2(F)F)CC1 ZINC000621734640 370491698 /nfs/dbraw/zinc/49/16/98/370491698.db2.gz RHSBYGMRQQSXOZ-JTQLQIEISA-N 2 0 232.318 2.106 20 0 BEADRP [NH3+][C@]12CCC[C@H]1C[N@H+](CCC1CCCC1)C2 ZINC000621781268 370530957 /nfs/dbraw/zinc/53/09/57/370530957.db2.gz BOANVBXGJBODHR-KBPBESRZSA-N 2 0 222.376 2.380 20 0 BEADRP [NH3+][C@]12CCC[C@@H]1C[N@H+](C[C@@H]1CC[C@H]3C[C@H]3C1)C2 ZINC000621784341 370535539 /nfs/dbraw/zinc/53/55/39/370535539.db2.gz NMHIZCRZBGGINZ-KHMAMNHCSA-N 2 0 234.387 2.236 20 0 BEADRP C[C@@H]([NH2+]CC(C)(C)C[NH+](C)C)[C@H]1CCCCO1 ZINC000623849201 371125127 /nfs/dbraw/zinc/12/51/27/371125127.db2.gz YWZXEZLSBUQCQM-CHWSQXEVSA-N 2 0 242.407 2.121 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H](C[NH2+]Cc2cccs2)C1 ZINC000070503174 181580590 /nfs/dbraw/zinc/58/05/90/181580590.db2.gz OCLMMCLMGDALIW-GHMZBOCLSA-N 2 0 224.373 2.355 20 0 BEADRP C[C@H]([NH2+]CC1CC=CC1)C1CC[NH+](C)CC1 ZINC000624076282 371294001 /nfs/dbraw/zinc/29/40/01/371294001.db2.gz QHJUVKSUNJAFQZ-LBPRGKRZSA-N 2 0 222.376 2.273 20 0 BEADRP COCCC[C@H](C)[NH2+]C[C@H]1CCCC[N@H+](C)C1 ZINC000624120523 371321782 /nfs/dbraw/zinc/32/17/82/371321782.db2.gz BBUYNTLIEVKNJV-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP C[N@@H+]1CCC[C@@H]1CC[NH+]1CCC(C)(C)C1 ZINC000162075670 371607971 /nfs/dbraw/zinc/60/79/71/371607971.db2.gz UPUJFSQYKDLGOM-GFCCVEGCSA-N 2 0 210.365 2.203 20 0 BEADRP CC[C@H](CSC)[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000162359144 371664895 /nfs/dbraw/zinc/66/48/95/371664895.db2.gz GRSIQDAYYFSEFR-WCQYABFASA-N 2 0 244.448 2.448 20 0 BEADRP CSC1(C[NH2+][C@H](C)C2CC[NH+](C)CC2)CC1 ZINC000228023769 371979407 /nfs/dbraw/zinc/97/94/07/371979407.db2.gz KTZWOJQHDYQDFF-LLVKDONJSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CC[N@H+](C)C(C)(C)C2)[C@H](C)O1 ZINC000631218278 372242435 /nfs/dbraw/zinc/24/24/35/372242435.db2.gz MHSCYJOFIRUHJD-VOAKCMCISA-N 2 0 240.391 2.015 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CC(C)(C)F)[C@H]2CCC[C@@H]21 ZINC000631665966 372489613 /nfs/dbraw/zinc/48/96/13/372489613.db2.gz ZWTNVFBMOAAQNR-WOPDTQHZSA-N 2 0 228.355 2.197 20 0 BEADRP CCC[C@@H](CCO)[NH2+]C1CC[NH+](CCC)CC1 ZINC000631667479 372493413 /nfs/dbraw/zinc/49/34/13/372493413.db2.gz PRZOPEWLEKHNTG-ZDUSSCGKSA-N 2 0 242.407 2.002 20 0 BEADRP [NH3+][C@]12CCC[C@H]1C[N@H+](C[C@H]1CCC(F)(F)C1)C2 ZINC000631829876 372613483 /nfs/dbraw/zinc/61/34/83/372613483.db2.gz CLTHGTRRPQQNHL-SRVKXCTJSA-N 2 0 244.329 2.235 20 0 BEADRP Cc1cc(C[N@@H+]2C[C@@H](C[NH3+])[C@H](C)C2)c(C)s1 ZINC000631838398 372632507 /nfs/dbraw/zinc/63/25/07/372632507.db2.gz NPRBZFSBAVAZSQ-NOZJJQNGSA-N 2 0 238.400 2.392 20 0 BEADRP C[C@@H](c1cccc(F)c1)[N@H+]1C[C@@H](C[NH3+])[C@H](C)C1 ZINC000631839372 372637041 /nfs/dbraw/zinc/63/70/41/372637041.db2.gz FPLXSOGBFIQVLW-NTZNESFSSA-N 2 0 236.334 2.413 20 0 BEADRP C[C@H](c1ccccc1F)[N@H+]1C[C@@H](C[NH3+])[C@H](C)C1 ZINC000631841634 372638348 /nfs/dbraw/zinc/63/83/48/372638348.db2.gz NKARUANFGWFBQI-IJLUTSLNSA-N 2 0 236.334 2.413 20 0 BEADRP C[C@H](c1ccccc1)[N@H+]1C[C@@H](C[NH3+])[C@H](C)C1 ZINC000631843060 372641058 /nfs/dbraw/zinc/64/10/58/372641058.db2.gz IYTBBTLFGLFRGA-YRGRVCCFSA-N 2 0 218.344 2.274 20 0 BEADRP C[C@H]1C[N@H+](Cc2cccc(Cl)c2)C[C@H]1C[NH3+] ZINC000631844061 372643120 /nfs/dbraw/zinc/64/31/20/372643120.db2.gz UYGQQEXXWVPTRX-CMPLNLGQSA-N 2 0 238.762 2.367 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]1[NH2+]C[C@H]1CCC(F)(F)C1 ZINC000631827000 372605562 /nfs/dbraw/zinc/60/55/62/372605562.db2.gz CCZNEMWSAILFQR-QWRGUYRKSA-N 2 0 246.345 2.400 20 0 BEADRP CC1(F)CC[NH+](CCC2CC[NH2+]CC2)CC1 ZINC000631867005 372668506 /nfs/dbraw/zinc/66/85/06/372668506.db2.gz GGOLMJMDFJYZRC-UHFFFAOYSA-N 2 0 228.355 2.200 20 0 BEADRP CC1(C)CC(C[NH2+][C@]23CCC[C@@H]2C[NH2+]C3)C1 ZINC000631867265 372669588 /nfs/dbraw/zinc/66/95/88/372669588.db2.gz OGERGBSRHOFBRJ-OCCSQVGLSA-N 2 0 222.376 2.154 20 0 BEADRP CC(C)CC[N@@H+]1CCC[C@H]2C[NH2+]CC[C@H]21 ZINC000631884990 372682059 /nfs/dbraw/zinc/68/20/59/372682059.db2.gz RKRRVSKXYSJTBB-QWHCGFSZSA-N 2 0 210.365 2.106 20 0 BEADRP CC1(C[NH2+]Cc2ccc(F)cc2)CC[NH2+]CC1 ZINC000414908685 205782953 /nfs/dbraw/zinc/78/29/53/205782953.db2.gz QQOKHHANVBFCSH-UHFFFAOYSA-N 2 0 236.334 2.305 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@H](C2CC2)C1)C1C[NH2+]C1 ZINC000424379862 206038108 /nfs/dbraw/zinc/03/81/08/206038108.db2.gz PJVYANFGTFWXTN-VHRBIJSZSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H]1CCCC[C@H]1[NH2+][C@@H]1CCCC[C@H]1[NH3+] ZINC000424369449 206038288 /nfs/dbraw/zinc/03/82/88/206038288.db2.gz BVCLEFGVFWBPDF-UMSGYPCISA-N 2 0 210.365 2.425 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+][C@@H]1CCCC[C@H]1[NH3+] ZINC000424377728 206038695 /nfs/dbraw/zinc/03/86/95/206038695.db2.gz RRMXLNXSCLWZLD-RAIGVLPGSA-N 2 0 222.332 2.070 20 0 BEADRP C[C@H]1CCCC[C@@H]1[NH2+][C@@H]1CCCC[C@H]1[NH3+] ZINC000424369448 206040404 /nfs/dbraw/zinc/04/04/04/206040404.db2.gz BVCLEFGVFWBPDF-QNWHQSFQSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@@H]1[C@@H]([NH2+]CCC[NH3+])C[C@@H]1c1ccccc1 ZINC000437759645 206070177 /nfs/dbraw/zinc/07/01/77/206070177.db2.gz DOAWTWQHKXQQMK-UBHSHLNASA-N 2 0 218.344 2.117 20 0 BEADRP CCC[C@H](C)C[NH+]1CCC2(CC[NH2+]C2)CC1 ZINC000430915580 206061648 /nfs/dbraw/zinc/06/16/48/206061648.db2.gz QPTHCZJLYGJZPD-ZDUSSCGKSA-N 2 0 224.392 2.498 20 0 BEADRP CCOCCC[N@H+](CCC[NH3+])CC1CCCC1 ZINC000352512042 170372526 /nfs/dbraw/zinc/37/25/26/170372526.db2.gz VIIWBWCGAYCDMI-UHFFFAOYSA-N 2 0 242.407 2.254 20 0 BEADRP CCCC[C@H](CC)[NH2+]CC1(O)CC[NH+](C)CC1 ZINC000360253291 169000204 /nfs/dbraw/zinc/00/02/04/169000204.db2.gz RRBGWTUFDWMMPD-ZDUSSCGKSA-N 2 0 242.407 2.002 20 0 BEADRP CCC[N@H+](CC)Cc1ccc(-n2ccnc2)nc1 ZINC000267380168 169130316 /nfs/dbraw/zinc/13/03/16/169130316.db2.gz MLEBNMNQFKPARM-UHFFFAOYSA-N 2 0 244.342 2.499 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H]2CC[C@@H]2SC)CC1 ZINC000336682845 169189428 /nfs/dbraw/zinc/18/94/28/169189428.db2.gz DFNVARZACSFRKP-STQMWFEESA-N 2 0 242.432 2.344 20 0 BEADRP c1cc(C[N@@H+]2CCCC3(CC[NH2+]CC3)C2)ccn1 ZINC000004238044 183340151 /nfs/dbraw/zinc/34/01/51/183340151.db2.gz XNBDFSLVADLPGJ-UHFFFAOYSA-N 2 0 245.370 2.047 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)C(C)(C)OC)C1 ZINC000340197242 169206190 /nfs/dbraw/zinc/20/61/90/169206190.db2.gz DRSAVNJZBYNLOT-OLZOCXBDSA-N 2 0 242.407 2.121 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)COC(C)C)C1 ZINC000337339613 169206823 /nfs/dbraw/zinc/20/68/23/169206823.db2.gz OSUIRJSHLPWNBR-KGLIPLIRSA-N 2 0 242.407 2.121 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H]2C[C@H](C)[C@H]2C)C1 ZINC000309976879 169208336 /nfs/dbraw/zinc/20/83/36/169208336.db2.gz UBJWWFHJAFZJFP-REWJHTLYSA-N 2 0 224.392 2.352 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CC[C@@H]2CC)C1 ZINC000336782971 169208691 /nfs/dbraw/zinc/20/86/91/169208691.db2.gz ZDIVGGNMCSDJIH-HZSPNIEDSA-N 2 0 224.392 2.497 20 0 BEADRP c1cc(C[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)cs1 ZINC000037408353 183352633 /nfs/dbraw/zinc/35/26/33/183352633.db2.gz ZSTOYRSCDSVWHW-LLVKDONJSA-N 2 0 236.384 2.322 20 0 BEADRP c1cc2c(s1)CC[N@@H+](CC1CC[NH2+]CC1)C2 ZINC000020072115 183373536 /nfs/dbraw/zinc/37/35/36/183373536.db2.gz XHIPNEFFHFYSPS-UHFFFAOYSA-N 2 0 236.384 2.106 20 0 BEADRP c1cc2c(s1)CCC[C@H]2[NH2+]C1CC[NH2+]CC1 ZINC000061360290 183373912 /nfs/dbraw/zinc/37/39/12/183373912.db2.gz ZDCQSBLAJJREQI-GFCCVEGCSA-N 2 0 236.384 2.467 20 0 BEADRP c1ccc(C2([NH2+]C3CC[NH2+]CC3)CCC2)cc1 ZINC000335227545 183389256 /nfs/dbraw/zinc/38/92/56/183389256.db2.gz MJAPYEYPZDVRRS-UHFFFAOYSA-N 2 0 230.355 2.407 20 0 BEADRP CCC[C@@H](CC)[NH2+]C[C@@H](C)C[NH+](C)C ZINC000336681172 169379105 /nfs/dbraw/zinc/37/91/05/169379105.db2.gz HIMKVSUGUHINFC-VXGBXAGGSA-N 2 0 200.370 2.352 20 0 BEADRP [NH3+]C1CC[NH+](CCCC2CCCC2)CC1 ZINC000226417037 134365425 /nfs/dbraw/zinc/36/54/25/134365425.db2.gz NDOPTKCZSSVVNT-UHFFFAOYSA-N 2 0 210.365 2.380 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH2+][C@@H]2CCC(C)(C)C2)C1 ZINC000087771478 383865053 /nfs/dbraw/zinc/86/50/53/383865053.db2.gz PPPFFLUGQOLAIT-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP [NH3+]CC[C@@H]1CCCC[N@@H+]1Cc1cccs1 ZINC000070534355 383934529 /nfs/dbraw/zinc/93/45/29/383934529.db2.gz IIZDIHPJDBSMKF-NSHDSACASA-N 2 0 224.373 2.451 20 0 BEADRP C1CC([NH+]2CCC([NH2+][C@H]3CCSC3)CC2)C1 ZINC000309354584 383909903 /nfs/dbraw/zinc/90/99/03/383909903.db2.gz NNYMKEKTGVTALH-LBPRGKRZSA-N 2 0 240.416 2.098 20 0 BEADRP Cc1ccc([C@H](C)[NH2+][C@H]2CC[C@H](C[NH3+])C2)c(C)n1 ZINC000643542787 383984216 /nfs/dbraw/zinc/98/42/16/383984216.db2.gz ZQSCPSHUKJGPOC-IHRRRGAJSA-N 2 0 247.386 2.476 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1ccncc1 ZINC000037649299 383990263 /nfs/dbraw/zinc/99/02/63/383990263.db2.gz AQNAYYQJCDGLJG-QWHCGFSZSA-N 2 0 245.370 2.217 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1cccnc1 ZINC000037649303 383990935 /nfs/dbraw/zinc/99/09/35/383990935.db2.gz VAFQSEQIYZGGOX-QWHCGFSZSA-N 2 0 245.370 2.217 20 0 BEADRP CC[N@H+](CCC[NH+]1CCCC1)C[C@H](C)COC ZINC000569410643 384000319 /nfs/dbraw/zinc/00/03/19/384000319.db2.gz DSPGDWMGKZMNGC-AWEZNQCLSA-N 2 0 242.407 2.077 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CCCCC[NH+]2CCCC2)CO1 ZINC000647213171 383959899 /nfs/dbraw/zinc/95/98/99/383959899.db2.gz RFJAUASIXZTAPH-UONOGXRCSA-N 2 0 240.391 2.020 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCCCC[NH+]2CCCC2)CO1 ZINC000647213172 383961265 /nfs/dbraw/zinc/96/12/65/383961265.db2.gz RFJAUASIXZTAPH-ZIAGYGMSSA-N 2 0 240.391 2.020 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@H]2CC=CCC2)[C@H](C)C1 ZINC000090035796 384022216 /nfs/dbraw/zinc/02/22/16/384022216.db2.gz PQEQXRXDTAPIBQ-RDBSUJKOSA-N 2 0 222.376 2.415 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000643547399 384033762 /nfs/dbraw/zinc/03/37/62/384033762.db2.gz DTWINHLYJVGBFH-TZMCWYRMSA-N 2 0 248.370 2.475 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]CC1(C)CCC1 ZINC000090220109 384036032 /nfs/dbraw/zinc/03/60/32/384036032.db2.gz PBUWGGJZFXEGCN-UPJWGTAASA-N 2 0 224.392 2.495 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CC2(CC)CC2)[C@@H](C)C1 ZINC000090219463 384037038 /nfs/dbraw/zinc/03/70/38/384037038.db2.gz GAIUJVUPQZQEKY-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP CCCC[NH+]1CCC([NH2+]Cc2ccn(C)c2)CC1 ZINC000091008403 384092133 /nfs/dbraw/zinc/09/21/33/384092133.db2.gz CBLIHBYQAFVDHD-UHFFFAOYSA-N 2 0 249.402 2.379 20 0 BEADRP C[C@H]([NH2+]C1CC[NH2+]CC1)c1cccs1 ZINC000038040743 384062436 /nfs/dbraw/zinc/06/24/36/384062436.db2.gz PEGRLPYBTMCTKY-VIFPVBQESA-N 2 0 210.346 2.151 20 0 BEADRP CCC[C@H](C[NH2+][C@@H]1CC[N@H+](CC)C[C@H]1C)OC ZINC000449379260 384080258 /nfs/dbraw/zinc/08/02/58/384080258.db2.gz SIXIEUORTKRGRO-MGPQQGTHSA-N 2 0 242.407 2.121 20 0 BEADRP C[NH+](C)CC(C)(C)C[NH2+]CC(C)(C)C ZINC000041051083 384175404 /nfs/dbraw/zinc/17/54/04/384175404.db2.gz JKJKDYPKVWSBGU-UHFFFAOYSA-N 2 0 200.370 2.210 20 0 BEADRP C[C@@H]1CSC[C@@H]1[NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000449175470 384165860 /nfs/dbraw/zinc/16/58/60/384165860.db2.gz RBXVBSOXGIOJPA-XQHKEYJVSA-N 2 0 242.432 2.200 20 0 BEADRP C[C@H]([NH3+])[C@H]1CC[N@H+](Cc2ccc3c(c2)CCC3)C1 ZINC000163243017 384188578 /nfs/dbraw/zinc/18/85/78/384188578.db2.gz IIJKKCIRIWDQBE-LRDDRELGSA-N 2 0 244.382 2.344 20 0 BEADRP C[C@@H]([NH3+])[C@@H]1CC[N@H+](Cc2ccc3c(c2)CCC3)C1 ZINC000163242915 384188740 /nfs/dbraw/zinc/18/87/40/384188740.db2.gz IIJKKCIRIWDQBE-MLGOLLRUSA-N 2 0 244.382 2.344 20 0 BEADRP C[C@H]([NH3+])[C@H](Cc1ccccc1)[NH2+]CCC1CC1 ZINC000422921994 384213559 /nfs/dbraw/zinc/21/35/59/384213559.db2.gz ROOWJUKWKDNAEV-WFASDCNBSA-N 2 0 232.371 2.335 20 0 BEADRP CSCCC[N@H+](C)[C@@H]1CCN(C)[C@H](C)C1 ZINC000173527554 384225072 /nfs/dbraw/zinc/22/50/72/384225072.db2.gz FXDIFAZOSYUKDS-VXGBXAGGSA-N 2 0 230.421 2.154 20 0 BEADRP C(C[N@@H+]1CCC2(CCC2)C1)C1CC[NH2+]CC1 ZINC000336607804 384226222 /nfs/dbraw/zinc/22/62/22/384226222.db2.gz XQBNEWPBRBAQTM-UHFFFAOYSA-N 2 0 222.376 2.252 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CCc1ccc(F)cc1F ZINC000569555859 384228506 /nfs/dbraw/zinc/22/85/06/384228506.db2.gz CLNMMNJABSQLMK-SNVBAGLBSA-N 2 0 242.313 2.224 20 0 BEADRP C[C@H](C[NH2+]C[C@H]1CCC[NH2+]1)c1ccccc1 ZINC000235475574 384250342 /nfs/dbraw/zinc/25/03/42/384250342.db2.gz UVTLDDMWTYUECZ-TZMCWYRMSA-N 2 0 218.344 2.132 20 0 BEADRP CC[C@H]1C[N@H+](CC2(OC)CCCC2)CC[C@H]1[NH3+] ZINC000319456331 384250431 /nfs/dbraw/zinc/25/04/31/384250431.db2.gz OCXSXEAPRMUKQX-QWHCGFSZSA-N 2 0 240.391 2.005 20 0 BEADRP CCC[C@H](C)C[N@@H+]1CCC[C@H]([C@@H](C)[NH3+])C1 ZINC000082645617 384253566 /nfs/dbraw/zinc/25/35/66/384253566.db2.gz GXYFGUWHCPGMAY-XQQFMLRXSA-N 2 0 212.381 2.482 20 0 BEADRP C[C@@H]([NH3+])[C@@H]1CCC[N@H+](CC2CCCC2)C1 ZINC000082645631 384253866 /nfs/dbraw/zinc/25/38/66/384253866.db2.gz YACRAAHCUORGQV-DGCLKSJQSA-N 2 0 210.365 2.236 20 0 BEADRP Cc1ncccc1CN(C)[C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000093644887 384254684 /nfs/dbraw/zinc/25/46/84/384254684.db2.gz MLQYUQGDLANSLB-IUODEOHRSA-N 2 0 247.386 2.305 20 0 BEADRP [NH3+]CCC1CC[NH+](C[C@@H]2CCC(F)(F)C2)CC1 ZINC000302523595 384258136 /nfs/dbraw/zinc/25/81/36/384258136.db2.gz WPYDODNTOJSNLG-GFCCVEGCSA-N 2 0 246.345 2.483 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]C[C@@H]2CCSC2)c2ccccc21 ZINC000228555335 384277748 /nfs/dbraw/zinc/27/77/48/384277748.db2.gz HVTRAKQEGALVOG-GDLCADMTSA-N 2 0 248.395 2.474 20 0 BEADRP CC[C@@H]1CCC[C@@H]([NH2+]C2CC[NH2+]CC2)C1 ZINC000082847464 384271188 /nfs/dbraw/zinc/27/11/88/384271188.db2.gz QPHIHXAIXWEZPP-DGCLKSJQSA-N 2 0 210.365 2.297 20 0 BEADRP CC[N@H+](C)C[C@H]1CC[NH+](CCOC(C)(C)C)C1 ZINC000173885895 384275998 /nfs/dbraw/zinc/27/59/98/384275998.db2.gz QKIHWAIPDHKUJP-CYBMUJFWSA-N 2 0 242.407 2.075 20 0 BEADRP CC[C@@H]([NH2+]CCC[NH+]1CCCC1)C1CC1 ZINC000083054550 384278745 /nfs/dbraw/zinc/27/87/45/384278745.db2.gz WZYKIKHOPUODKO-CYBMUJFWSA-N 2 0 210.365 2.251 20 0 BEADRP c1ccc2c(c1)CCC[C@H]2[N@@H+]1CCC[NH2+]CC1 ZINC000034444889 384279906 /nfs/dbraw/zinc/27/99/06/384279906.db2.gz VIZVUUXHGLJMQQ-OAHLLOKOSA-N 2 0 230.355 2.359 20 0 BEADRP [NH3+]C[C@H]1CC[C@@H]([NH2+]C2CCCCCC2)C1 ZINC000335581022 384344086 /nfs/dbraw/zinc/34/40/86/384344086.db2.gz LASPKMBKWRQNTO-WCQYABFASA-N 2 0 210.365 2.426 20 0 BEADRP CC1(C)CCC[N@H+](CCC2CC[NH2+]CC2)C1 ZINC000069793456 384354849 /nfs/dbraw/zinc/35/48/49/384354849.db2.gz HZHHNNAOITWVAF-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]CC1(C)CC1 ZINC000300359088 384357384 /nfs/dbraw/zinc/35/73/84/384357384.db2.gz MNCPLLRIZULHKZ-UTUOFQBUSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@@H]1CC[C@H](C)[N@H+](C[C@@H]2CCC[NH2+]C2)C1 ZINC000084047954 384357352 /nfs/dbraw/zinc/35/73/52/384357352.db2.gz ZORAWHLQAWTHSP-FRRDWIJNSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1CC[C@@H](C)[N@H+](C[C@@H]2CCC[NH2+]C2)C1 ZINC000084047960 384358942 /nfs/dbraw/zinc/35/89/42/384358942.db2.gz ZORAWHLQAWTHSP-JHJVBQTASA-N 2 0 210.365 2.106 20 0 BEADRP C[NH+](C)CCCC[NH2+]Cc1ccccc1 ZINC000045598342 384399358 /nfs/dbraw/zinc/39/93/58/384399358.db2.gz LJCQZCQIQMKUSP-UHFFFAOYSA-N 2 0 206.333 2.118 20 0 BEADRP C[C@@H]([NH2+]CCCC[NH+](C)C)c1ccncc1 ZINC000045663319 384402898 /nfs/dbraw/zinc/40/28/98/384402898.db2.gz HMFLYHWZXBTQJQ-GFCCVEGCSA-N 2 0 221.348 2.074 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1Nc1ccccn1 ZINC000084213451 384376634 /nfs/dbraw/zinc/37/66/34/384376634.db2.gz SWILFNYZLYLOQU-WDEREUQCSA-N 2 0 205.305 2.011 20 0 BEADRP CCC[N@H+](CC[C@H]1CC[NH2+]C1)CC1CC1 ZINC000084385213 384391117 /nfs/dbraw/zinc/39/11/17/384391117.db2.gz QSAFMYYGSGZHMB-GFCCVEGCSA-N 2 0 210.365 2.108 20 0 BEADRP CC(C)[C@H]([NH3+])CNCc1ccsc1Cl ZINC000312749710 384458640 /nfs/dbraw/zinc/45/86/40/384458640.db2.gz UKVXNXQNDJCPJT-SECBINFHSA-N 2 0 232.780 2.474 20 0 BEADRP C[C@@H]([NH2+]CCC[NH3+])c1ccc(Cl)cc1 ZINC000037713174 384509312 /nfs/dbraw/zinc/50/93/12/384509312.db2.gz JWZDYPDBWXQYIR-SECBINFHSA-N 2 0 212.724 2.339 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCc2ccccc2)CN1C1CC1 ZINC000122797284 384511296 /nfs/dbraw/zinc/51/12/96/384511296.db2.gz RJIPJPBNEYQZSW-HIFRSBDPSA-N 2 0 244.382 2.444 20 0 BEADRP Cc1cccc(CC[NH2+][C@H]2CCCCC[C@@H]2[NH3+])n1 ZINC000423081065 384553161 /nfs/dbraw/zinc/55/31/61/384553161.db2.gz AZUGCOSXVPOMGW-GJZGRUSLSA-N 2 0 247.386 2.182 20 0 BEADRP CC(C)(C)CCC[NH+]1CCC(C[NH3+])CC1 ZINC000300787380 384555689 /nfs/dbraw/zinc/55/56/89/384555689.db2.gz BDAZWZJEZSPMIM-UHFFFAOYSA-N 2 0 212.381 2.483 20 0 BEADRP CC(C)CC[NH+]1CCC([NH2+]C(C)C)CC1 ZINC000170987306 384540102 /nfs/dbraw/zinc/54/01/02/384540102.db2.gz RBNPJVCAGRLDIL-UHFFFAOYSA-N 2 0 212.381 2.495 20 0 BEADRP C[NH2+]C[C@H]1CCC[N@H+](C[C@H]2CCC(F)(F)C2)C1 ZINC000306049647 384568826 /nfs/dbraw/zinc/56/88/26/384568826.db2.gz VVGLVEWRQQBXLB-NWDGAFQWSA-N 2 0 246.345 2.353 20 0 BEADRP CCC[NH+]1CCC([N@H+](C)CCCF)CC1 ZINC000151364812 384569672 /nfs/dbraw/zinc/56/96/72/384569672.db2.gz JAIQGPQFXSTVFX-UHFFFAOYSA-N 2 0 216.344 2.152 20 0 BEADRP CC[C@](C)(C[NH2+]C[C@H]1CC[N@@H+](C(C)C)C1)OC ZINC000319894249 384573342 /nfs/dbraw/zinc/57/33/42/384573342.db2.gz PJQSRSISNFXFPI-ZIAGYGMSSA-N 2 0 242.407 2.121 20 0 BEADRP C[N@H+]1CC=C(C[NH2+]C2Cc3ccccc3C2)CC1 ZINC000335896482 384589341 /nfs/dbraw/zinc/58/93/41/384589341.db2.gz MCVXUOAQLCSZDM-UHFFFAOYSA-N 2 0 242.366 2.005 20 0 BEADRP CC(C)[C@@H](C)[NH2+]C[C@H]1CC[N@@H+](C(C)C)C1 ZINC000040621550 384590029 /nfs/dbraw/zinc/59/00/29/384590029.db2.gz AFXVSPFALRJPHW-CHWSQXEVSA-N 2 0 212.381 2.351 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCC[C@@H]2C[C@@]21C)C[NH+](C)C ZINC000336747382 384625794 /nfs/dbraw/zinc/62/57/94/384625794.db2.gz RYDYURLONHGEHM-SYQHCUMBSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]CCC1(C)CC1 ZINC000309767172 384594874 /nfs/dbraw/zinc/59/48/74/384594874.db2.gz JRPIXFPFXLUVHB-AGIUHOORSA-N 2 0 224.392 2.495 20 0 BEADRP Cc1ccccc1C[NH2+]C[C@@H](C)C[NH+](C)C ZINC000309766838 384596193 /nfs/dbraw/zinc/59/61/93/384596193.db2.gz NVLVMCDFXXGOST-GFCCVEGCSA-N 2 0 220.360 2.282 20 0 BEADRP CS[C@H]1CC[C@H]1[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000309848185 384666446 /nfs/dbraw/zinc/66/64/46/384666446.db2.gz HSFXPLZOMWPDPG-OLZOCXBDSA-N 2 0 242.432 2.343 20 0 BEADRP CSC[C@H](C)[NH2+][C@@H]1CC[N@H+](C)[C@@H]2CCC[C@@H]21 ZINC000336658277 384672399 /nfs/dbraw/zinc/67/23/99/384672399.db2.gz BHMPUCLPWKORBM-UMSGYPCISA-N 2 0 242.432 2.200 20 0 BEADRP c1ccc([C@H]2CC[N@@H+](C3CC[NH2+]CC3)C2)cc1 ZINC000050599382 384636632 /nfs/dbraw/zinc/63/66/32/384636632.db2.gz DMIAJSIFTOLYMV-AWEZNQCLSA-N 2 0 230.355 2.228 20 0 BEADRP Cc1ccc(CN2CC[C@@H]3CC[NH2+][C@@H]3C2)c(C)c1 ZINC000647532813 384639800 /nfs/dbraw/zinc/63/98/00/384639800.db2.gz DWDDWQCHYNKQNB-GOEBONIOSA-N 2 0 244.382 2.487 20 0 BEADRP C([NH2+]C[C@@H]1CC[C@@H]2C[C@@H]2C1)[C@H]1CC[N@@H+](C2CC2)C1 ZINC000403385775 384644893 /nfs/dbraw/zinc/64/48/93/384644893.db2.gz QZCKMRSNDYFGMZ-TUVASFSCSA-N 2 0 248.414 2.497 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]CC2CCCCC2)C1 ZINC000086402715 384646301 /nfs/dbraw/zinc/64/63/01/384646301.db2.gz SYLLCXMZRSQKQT-OLZOCXBDSA-N 2 0 210.365 2.426 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]CC2CCCCC2)C1 ZINC000086402712 384647296 /nfs/dbraw/zinc/64/72/96/384647296.db2.gz SYLLCXMZRSQKQT-CHWSQXEVSA-N 2 0 210.365 2.426 20 0 BEADRP CCCCOCCC[NH2+][C@H]1CCCC[C@H]1C[NH3+] ZINC000160195662 384656108 /nfs/dbraw/zinc/65/61/08/384656108.db2.gz CKBMTGPZEUQJNU-KBPBESRZSA-N 2 0 242.407 2.300 20 0 BEADRP CCC[C@H](NCCC[NH+](C)C)c1cccnc1 ZINC000184842704 384656280 /nfs/dbraw/zinc/65/62/80/384656280.db2.gz ANXLKGSLXBJZOO-AWEZNQCLSA-N 2 0 235.375 2.464 20 0 BEADRP CSC1(C[NH2+]CC(C)(C)C)CC[NH+](C)CC1 ZINC000309836794 384661170 /nfs/dbraw/zinc/66/11/70/384661170.db2.gz BLNYZWPLGHLUOW-UHFFFAOYSA-N 2 0 244.448 2.450 20 0 BEADRP Cc1ccc(C[N@@H+](C)CC(C)(C)C[NH3+])cc1 ZINC000051214073 384661988 /nfs/dbraw/zinc/66/19/88/384661988.db2.gz WPKPBIQSQQGZCI-UHFFFAOYSA-N 2 0 220.360 2.412 20 0 BEADRP CN1CCCC(C)(C)[C@@H]1C[NH2+][C@H]1CCSC1 ZINC000309978712 384682775 /nfs/dbraw/zinc/68/27/75/384682775.db2.gz VCJJUOPJEOBHRY-RYUDHWBXSA-N 2 0 242.432 2.202 20 0 BEADRP FC1(F)CCC[N@H+](C[C@@H]2CCC[NH2+]C2)CC1 ZINC000258899518 384690038 /nfs/dbraw/zinc/69/00/38/384690038.db2.gz OEIYWBBQTQFPKW-LLVKDONJSA-N 2 0 232.318 2.107 20 0 BEADRP Cc1ccccc1CN[C@H]1CCC[NH2+][C@H]1C ZINC000335358496 384693493 /nfs/dbraw/zinc/69/34/93/384693493.db2.gz SQIYEUGDRZQFFE-JSGCOSHPSA-N 2 0 218.344 2.225 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000647543427 384712197 /nfs/dbraw/zinc/71/21/97/384712197.db2.gz NFWZQPWIANTLLS-KBUPBQIOSA-N 2 0 236.403 2.354 20 0 BEADRP CC[NH2+]Cc1cccc(N[C@H]2C[NH2+]C[C@@H](C)C2)c1 ZINC000647546387 384729718 /nfs/dbraw/zinc/72/97/18/384729718.db2.gz HXZFYWWPLDIPEL-SWLSCSKDSA-N 2 0 247.386 2.206 20 0 BEADRP CC(C)C[C@@H](C)[NH2+][C@H](CN)CC(C)C ZINC000308457473 384732133 /nfs/dbraw/zinc/73/21/33/384732133.db2.gz FFHDFSNZBZLHPK-NEPJUHHUSA-N 2 0 200.370 2.384 20 0 BEADRP CCN1CCC[C@@H]1C[NH2+][C@@H]1CCCC12CC2 ZINC000568274877 384741485 /nfs/dbraw/zinc/74/14/85/384741485.db2.gz INXDISANLULUEP-CHWSQXEVSA-N 2 0 222.376 2.393 20 0 BEADRP CCN1CCC[C@H]1C[NH2+][C@@H]1CCCC12CC2 ZINC000568274884 384741658 /nfs/dbraw/zinc/74/16/58/384741658.db2.gz INXDISANLULUEP-QWHCGFSZSA-N 2 0 222.376 2.393 20 0 BEADRP C1[C@@H]2[C@H]1CCC[C@@H]2[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000647551800 384754417 /nfs/dbraw/zinc/75/44/17/384754417.db2.gz MIWOMBZPZKFAFU-VMCMIOBHSA-N 2 0 234.387 2.153 20 0 BEADRP CO[C@H](C)CC[NH2+][C@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000336665799 384756733 /nfs/dbraw/zinc/75/67/33/384756733.db2.gz ZDDODYITPHTZJY-MCIONIFRSA-N 2 0 242.407 2.312 20 0 BEADRP C[C@@]1(C[N@@H+]2CC[C@H](C3CCC3)C2)CC[NH2+]C1 ZINC000647552015 384758963 /nfs/dbraw/zinc/75/89/63/384758963.db2.gz AHNDZPNZLLLZIB-UONOGXRCSA-N 2 0 222.376 2.108 20 0 BEADRP Cc1ccc(CN[C@H]2CC[N@H+](C)[C@@H](C)C2)nc1C ZINC000314149334 384830635 /nfs/dbraw/zinc/83/06/35/384830635.db2.gz KSOJBPBDTBWESB-JSGCOSHPSA-N 2 0 247.386 2.271 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]Cc1ccccc1Cl ZINC000308591864 384831957 /nfs/dbraw/zinc/83/19/57/384831957.db2.gz VVZFTJZTNZGREN-SECBINFHSA-N 2 0 212.724 2.024 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000423357623 384833612 /nfs/dbraw/zinc/83/36/12/384833612.db2.gz MKSAMRZQZIUTGL-FRRDWIJNSA-N 2 0 210.365 2.153 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@H]2CC[C@H]2C2CCC2)C1 ZINC000423360601 384834998 /nfs/dbraw/zinc/83/49/98/384834998.db2.gz FWOKTAAENASYJF-RFGFWPKPSA-N 2 0 222.376 2.425 20 0 BEADRP COCC[C@@H]1CCC[C@@H]1[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000423359620 384835890 /nfs/dbraw/zinc/83/58/90/384835890.db2.gz DNBMDZLTHMHZQA-XUXIUFHCSA-N 2 0 240.391 2.051 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H]1CCc2ccc(F)cc21 ZINC000423280275 384788301 /nfs/dbraw/zinc/78/83/01/384788301.db2.gz UHSVKDNOLNAGSV-YGRLFVJLSA-N 2 0 236.334 2.258 20 0 BEADRP CC(C)[C@H]([NH3+])CN[C@H]1CCc2ccc(F)cc21 ZINC000423277108 384788504 /nfs/dbraw/zinc/78/85/04/384788504.db2.gz PESBIOMICRXYPN-KGLIPLIRSA-N 2 0 236.334 2.386 20 0 BEADRP COCC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000423359619 384836264 /nfs/dbraw/zinc/83/62/64/384836264.db2.gz DNBMDZLTHMHZQA-FQUUOJAGSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@H](CCC1CC1)[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000398087839 384799329 /nfs/dbraw/zinc/79/93/29/384799329.db2.gz OIXUWNZVIAKZEC-WXHSDQCUSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@]1(C[NH2+][C@H]2CC[C@H]2C2CC2)CCC[NH2+]C1 ZINC000423332185 384802722 /nfs/dbraw/zinc/80/27/22/384802722.db2.gz HBTRLQJPUUISQR-IHRRRGAJSA-N 2 0 222.376 2.154 20 0 BEADRP CCCC[N@H+](CC1CC[NH2+]CC1)C1CC1 ZINC000042491301 384807790 /nfs/dbraw/zinc/80/77/90/384807790.db2.gz DLWAJRVZZJPZTQ-UHFFFAOYSA-N 2 0 210.365 2.251 20 0 BEADRP CC1(C[NH2+][C@@H]2CC[C@@H]2C2CC2)CC[NH2+]CC1 ZINC000423338728 384812274 /nfs/dbraw/zinc/81/22/74/384812274.db2.gz UVFJEUWXONIARI-CHWSQXEVSA-N 2 0 222.376 2.154 20 0 BEADRP CS[C@@H]1CC[C@@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000309843858 384872578 /nfs/dbraw/zinc/87/25/78/384872578.db2.gz FRZJGCDKIVRGRC-NTWDBFDFSA-N 2 0 240.416 2.095 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@H]([NH3+])C1)c1ccc(F)cn1 ZINC000423366747 384843012 /nfs/dbraw/zinc/84/30/12/384843012.db2.gz CFLGJIVJRLMHNO-DLOVCJGASA-N 2 0 237.322 2.141 20 0 BEADRP Cc1ccoc1CN[C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000127006154 384853296 /nfs/dbraw/zinc/85/32/96/384853296.db2.gz BRUKTBUCYFGOLY-NEPJUHHUSA-N 2 0 222.332 2.160 20 0 BEADRP CO[C@@H]1CC[C@H]([NH2+][C@@H]2C[C@@H]([NH3+])c3ccccc32)C1 ZINC000234804809 384857638 /nfs/dbraw/zinc/85/76/38/384857638.db2.gz NOAVOPBXPCMETB-RBDSIQFVSA-N 2 0 246.354 2.288 20 0 BEADRP [NH3+]Cc1ccc(C[NH2+]C(C2CC2)C2CC2)cc1 ZINC000049237865 384862076 /nfs/dbraw/zinc/86/20/76/384862076.db2.gz GHAISWKPNLSXDB-UHFFFAOYSA-N 2 0 230.355 2.424 20 0 BEADRP Cc1cc(C[NH2+]CC2CC[NH2+]CC2)ccc1F ZINC000258950982 384954174 /nfs/dbraw/zinc/95/41/74/384954174.db2.gz IPGXZGJWGJIZDY-UHFFFAOYSA-N 2 0 236.334 2.223 20 0 BEADRP Cc1cc(C[NH2+]CC[C@H]2CCC[NH2+]2)ccc1F ZINC000258988023 384955668 /nfs/dbraw/zinc/95/56/68/384955668.db2.gz LORNXFPPLSFMFD-CYBMUJFWSA-N 2 0 236.334 2.366 20 0 BEADRP COc1ccc(C[N@@H+]2CC[C@H]([NH3+])C[C@H]2C)cc1 ZINC000049707622 384900351 /nfs/dbraw/zinc/90/03/51/384900351.db2.gz DJYGJKUQAAIGTJ-YPMHNXCESA-N 2 0 234.343 2.007 20 0 BEADRP COC1(C[N@@H+]2CCC[C@H]([C@H](C)[NH3+])C2)CCCC1 ZINC000318932280 384915113 /nfs/dbraw/zinc/91/51/13/384915113.db2.gz ANVVYQUHFWOLFB-STQMWFEESA-N 2 0 240.391 2.005 20 0 BEADRP CC(C)(C[NH2+][C@@H]1CCC[C@H]1[NH3+])c1ccccc1 ZINC000258762656 384942538 /nfs/dbraw/zinc/94/25/38/384942538.db2.gz APVWJUVHYOFJAC-ZIAGYGMSSA-N 2 0 232.371 2.434 20 0 BEADRP C[C@@H](C[NH2+]Cc1ccc(O)cc1)C[NH+]1CCCC1 ZINC000057993859 384976167 /nfs/dbraw/zinc/97/61/67/384976167.db2.gz SZBGZQICUZJSBL-ZDUSSCGKSA-N 2 0 248.370 2.214 20 0 BEADRP C[C@H](Cc1ccsc1)[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000087646881 384984186 /nfs/dbraw/zinc/98/41/86/384984186.db2.gz NATMZGHGHRGXAB-DGCLKSJQSA-N 2 0 238.400 2.268 20 0 BEADRP C[N@H+](C[C@H]1CCC[NH2+]C1)C1Cc2ccccc2C1 ZINC000226436971 385022213 /nfs/dbraw/zinc/02/22/13/385022213.db2.gz VMKRNJATFJZCIC-ZDUSSCGKSA-N 2 0 244.382 2.085 20 0 BEADRP c1ccc(C[NH2+]CCC[C@H]2CCC[NH2+]2)cc1 ZINC000306496630 384999386 /nfs/dbraw/zinc/99/93/86/384999386.db2.gz XZGVRKBUMXHMCC-AWEZNQCLSA-N 2 0 218.344 2.308 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+][C@@H]1CC[C@H]1C1CC1 ZINC000423462826 384962018 /nfs/dbraw/zinc/96/20/18/384962018.db2.gz POEGSZWDKGBRHQ-DMFQKCBSSA-N 2 0 234.387 2.281 20 0 BEADRP COc1cccc(C[NH2+]CC[C@H]2CCC[NH2+]C2)c1 ZINC000259139666 384964225 /nfs/dbraw/zinc/96/42/25/384964225.db2.gz XACUUKUFXQDFPP-CYBMUJFWSA-N 2 0 248.370 2.175 20 0 BEADRP CC1(C)[C@H]([NH3+])C[C@H]1[NH2+]Cc1cccc(F)c1 ZINC000404779651 385058231 /nfs/dbraw/zinc/05/82/31/385058231.db2.gz MTCGITAXMBCQGA-VXGBXAGGSA-N 2 0 222.307 2.041 20 0 BEADRP CC1(C)[C@@H]([NH3+])C[C@@H]1[NH2+]CCCOc1ccccc1 ZINC000404784580 385064341 /nfs/dbraw/zinc/06/43/41/385064341.db2.gz PAFIFGKAVUOHQS-KBPBESRZSA-N 2 0 248.370 2.171 20 0 BEADRP CC1(C)[C@H]([NH2+]CCCOc2ccccc2)C[C@@H]1[NH3+] ZINC000404784586 385064832 /nfs/dbraw/zinc/06/48/32/385064832.db2.gz PAFIFGKAVUOHQS-UONOGXRCSA-N 2 0 248.370 2.171 20 0 BEADRP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]CCCC(F)(F)F ZINC000157091003 385066208 /nfs/dbraw/zinc/06/62/08/385066208.db2.gz GYMNCFCUHOAHMO-UWVGGRQHSA-N 2 0 238.297 2.259 20 0 BEADRP CC[C@@H]([NH2+]CCc1cn(C)cn1)[C@@H]1CC1(C)C ZINC000397617012 385067115 /nfs/dbraw/zinc/06/71/15/385067115.db2.gz CTOIFJDLKFIHDY-QWHCGFSZSA-N 2 0 235.375 2.377 20 0 BEADRP C[C@H](F)CC[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@H]1C ZINC000340471974 385069942 /nfs/dbraw/zinc/06/99/42/385069942.db2.gz XXZDUYROMVARHS-WRWGMCAJSA-N 2 0 216.344 2.053 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@@H]1CCOc2ccccc21 ZINC000310384162 385025329 /nfs/dbraw/zinc/02/53/29/385025329.db2.gz JRZLKCJIEJSQGN-WCQYABFASA-N 2 0 234.343 2.227 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCc2nc[nH]c2C1)C(C)C ZINC000310020277 385041330 /nfs/dbraw/zinc/04/13/30/385041330.db2.gz MYDJIIALCHDKRS-MNOVXSKESA-N 2 0 221.348 2.291 20 0 BEADRP CC1(C)[C@H]([NH3+])C[C@H]1[NH2+]CCC1CCCC1 ZINC000404878103 385120999 /nfs/dbraw/zinc/12/09/99/385120999.db2.gz YBSAQZIJUXMZSO-VXGBXAGGSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCC2CC[NH+](C)CC2)[C@@H]1C ZINC000336686216 385142610 /nfs/dbraw/zinc/14/26/10/385142610.db2.gz UQHMKAMHOCYEAI-BZPMIXESSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@H](C[N@@H+]1CC[C@@H]([NH3+])[C@@H](C)C1)c1ccccc1 ZINC000227057253 385086378 /nfs/dbraw/zinc/08/63/78/385086378.db2.gz NLMVPNGWBMQFEC-VNHYZAJKSA-N 2 0 232.371 2.459 20 0 BEADRP Cc1c[nH+]ccc1NC[C@H]1CCC[C@@H]([NH3+])C1 ZINC000227674085 385199364 /nfs/dbraw/zinc/19/93/64/385199364.db2.gz SWSHSLHFTFVLLL-NWDGAFQWSA-N 2 0 219.332 2.319 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CCC[C@@H]([C@H]2CCC[NH2+]2)C1 ZINC000647479294 385152738 /nfs/dbraw/zinc/15/27/38/385152738.db2.gz AVRCXUDKDQWCCJ-AAVRWANBSA-N 2 0 222.376 2.106 20 0 BEADRP C1CC12C[C@H]2[NH2+][C@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1 ZINC000424372903 385155430 /nfs/dbraw/zinc/15/54/30/385155430.db2.gz ITYISLYWBVHBDA-RFQIPJPRSA-N 2 0 234.387 2.439 20 0 BEADRP CC1(C[N@@H+]2CCC[C@H]([C@@H]3CCC[NH2+]3)C2)CC1 ZINC000647479735 385157649 /nfs/dbraw/zinc/15/76/49/385157649.db2.gz RLARNLZFIJOVHU-STQMWFEESA-N 2 0 222.376 2.251 20 0 BEADRP CC1(C[N@@H+]2CCC[C@H]([C@H]3CCC[NH2+]3)C2)CC1 ZINC000647479734 385159343 /nfs/dbraw/zinc/15/93/43/385159343.db2.gz RLARNLZFIJOVHU-QWHCGFSZSA-N 2 0 222.376 2.251 20 0 BEADRP CCC[C@H](C)C[N@@H+]1CC[C@H]2[NH2+]CC[C@H]2C1 ZINC000308805507 385169733 /nfs/dbraw/zinc/16/97/33/385169733.db2.gz AVLRAZSJEVCDLX-RWMBFGLXSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H](C)c1ccco1 ZINC000308808935 385177762 /nfs/dbraw/zinc/17/77/62/385177762.db2.gz GQDMJWFQDXDXSE-MNOVXSKESA-N 2 0 210.321 2.448 20 0 BEADRP CCCC[C@@H](C)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000044533292 385208264 /nfs/dbraw/zinc/20/82/64/385208264.db2.gz HGYXWFGDEOULSL-OLZOCXBDSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@H]1CC[N@H+](CC2CCCC2)C[C@@H]1C[NH3+] ZINC000164652320 385223059 /nfs/dbraw/zinc/22/30/59/385223059.db2.gz HTQOJEGDNHYITG-AAEUAGOBSA-N 2 0 210.365 2.093 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]CCc1cccs1 ZINC000252714846 385224432 /nfs/dbraw/zinc/22/44/32/385224432.db2.gz TWTGHOCNHXNVQK-DGCLKSJQSA-N 2 0 238.400 2.220 20 0 BEADRP C[C@H](C[NH2+][C@@H](C)CCC1CC1)C[NH+](C)C ZINC000308882094 385235532 /nfs/dbraw/zinc/23/55/32/385235532.db2.gz URAMVUVWISKIBV-NEPJUHHUSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]Cc1ccccc1F ZINC000308892989 385248082 /nfs/dbraw/zinc/24/80/82/385248082.db2.gz YNEOZPWJASLEJI-SNVBAGLBSA-N 2 0 210.296 2.043 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CC[N@H+](C[C@@H]2CCCC[C@H]2C)C1 ZINC000346663859 385254932 /nfs/dbraw/zinc/25/49/32/385254932.db2.gz XDRUCEFOGTUPED-ZOBORPQBSA-N 2 0 224.392 2.482 20 0 BEADRP C[C@@H](C[NH2+]C1CCCCCC1)C[NH+](C)C ZINC000308932594 385303353 /nfs/dbraw/zinc/30/33/53/385303353.db2.gz RRYARIARLAIGAJ-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP C[NH+](C)CCCC[NH2+]Cc1ccsc1 ZINC000045598339 385271284 /nfs/dbraw/zinc/27/12/84/385271284.db2.gz SIYHINXCTIPNRB-UHFFFAOYSA-N 2 0 212.362 2.180 20 0 BEADRP C[C@@H]([NH2+]CCCC[NH+](C)C)c1ccco1 ZINC000045663406 385272687 /nfs/dbraw/zinc/27/26/87/385272687.db2.gz VGJWAJJHTIAOON-LLVKDONJSA-N 2 0 210.321 2.272 20 0 BEADRP C[C@@H]([NH2+]CCN)c1cccc2ccccc21 ZINC000037712350 385274387 /nfs/dbraw/zinc/27/43/87/385274387.db2.gz RVKCNXZTXIAGGC-LLVKDONJSA-N 2 0 214.312 2.449 20 0 BEADRP [NH3+]C[C@@H]1CC[N@H+](Cc2ccc3cnccc3c2)C1 ZINC000647490380 385282850 /nfs/dbraw/zinc/28/28/50/385282850.db2.gz STQAPCZSKNGZLR-ZDUSSCGKSA-N 2 0 241.338 2.015 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCC[NH+]2CCCC2)[C@@H]1C ZINC000308975994 385330269 /nfs/dbraw/zinc/33/02/69/385330269.db2.gz ILICCWGQNOLDCX-UPJWGTAASA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCC[NH+]2CCCC2)[C@H]1C ZINC000308975991 385330551 /nfs/dbraw/zinc/33/05/51/385330551.db2.gz ILICCWGQNOLDCX-AGIUHOORSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]Cc1cccc(F)c1 ZINC000309020444 385375108 /nfs/dbraw/zinc/37/51/08/385375108.db2.gz UGMFVKXLGQRZDJ-SNVBAGLBSA-N 2 0 210.296 2.043 20 0 BEADRP CSCC[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000193433951 385396229 /nfs/dbraw/zinc/39/62/29/385396229.db2.gz WIAKHJXLUGBDDF-UHFFFAOYSA-N 2 0 230.421 2.013 20 0 BEADRP CCSCC[NH2+][C@H]1CCC[C@H]([NH+](C)C)C1 ZINC000309061028 385397178 /nfs/dbraw/zinc/39/71/78/385397178.db2.gz WPPWAWBUMMQVFN-RYUDHWBXSA-N 2 0 230.421 2.202 20 0 BEADRP CC(C)CC[NH2+]C1CCC([NH+](C)C)CC1 ZINC000309083517 385402592 /nfs/dbraw/zinc/40/25/92/385402592.db2.gz TYJJRTZEPZWWPR-UHFFFAOYSA-N 2 0 212.381 2.495 20 0 BEADRP C[C@@H]([NH2+]CCC[NH+]1CCCCC1)C1CC1 ZINC000020128783 385419553 /nfs/dbraw/zinc/41/95/53/385419553.db2.gz LFGQMZDRSCYCBO-GFCCVEGCSA-N 2 0 210.365 2.251 20 0 BEADRP Cc1ccc(CCC[NH2+]C2CCC2)cn1 ZINC000309164723 385444980 /nfs/dbraw/zinc/44/49/80/385444980.db2.gz ILRGNIBGHVZULW-UHFFFAOYSA-N 2 0 204.317 2.465 20 0 BEADRP CCC1CC([NH2+][C@@H]2CCN(C)[C@H](C)C2)C1 ZINC000309176626 385451121 /nfs/dbraw/zinc/45/11/21/385451121.db2.gz MXTLLXBUADMFJA-CQLXCSJHSA-N 2 0 210.365 2.247 20 0 BEADRP CCC1CC([NH2+]C[C@H]2CC[N@H+](CC)C2)C1 ZINC000309202550 385475545 /nfs/dbraw/zinc/47/55/45/385475545.db2.gz RPGXJBIYJUMHMC-OTTFEQOBSA-N 2 0 210.365 2.106 20 0 BEADRP CS[C@H]1CC[C@@H]1[NH2+]C1CCC([NH+](C)C)CC1 ZINC000336721724 385476603 /nfs/dbraw/zinc/47/66/03/385476603.db2.gz ZZNZWYQSQVQUMX-TYUFSLCMSA-N 2 0 242.432 2.343 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]Cc1cccc(F)c1 ZINC000309202693 385478298 /nfs/dbraw/zinc/47/82/98/385478298.db2.gz FQDPMPUOKILAAN-NSHDSACASA-N 2 0 224.323 2.433 20 0 BEADRP CC(C)(C)CCC[N@@H+]1CC[C@@H]2[NH2+]CC[C@H]2C1 ZINC000309290354 385515385 /nfs/dbraw/zinc/51/53/85/385515385.db2.gz PZVUZXYRHMXSLG-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@@H]2CC[C@@H](F)C2)CC1 ZINC000309333956 385537055 /nfs/dbraw/zinc/53/70/55/385537055.db2.gz AAEKHVRJSRASGH-DGCLKSJQSA-N 2 0 228.355 2.339 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@H]1CCCc2ccccc21 ZINC000309338318 385538373 /nfs/dbraw/zinc/53/83/73/385538373.db2.gz KOJPZVQLOAFOAC-FZMZJTMJSA-N 2 0 218.344 2.248 20 0 BEADRP Cc1c[nH+]ccc1N[C@H]1CCC[N@H+](C)[C@H]1C ZINC000309375697 385555813 /nfs/dbraw/zinc/55/58/13/385555813.db2.gz COWGXTJESPAESA-AAEUAGOBSA-N 2 0 219.332 2.285 20 0 BEADRP C[C@@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1nccs1 ZINC000309422739 385577659 /nfs/dbraw/zinc/57/76/59/385577659.db2.gz BFKKOIFVBZPAIX-MNOVXSKESA-N 2 0 239.388 2.326 20 0 BEADRP C[C@@]1(C[NH2+]Cc2ccsc2)CCC[NH2+]C1 ZINC000063147389 385600712 /nfs/dbraw/zinc/60/07/12/385600712.db2.gz DBVIMRLNYGLIGU-GFCCVEGCSA-N 2 0 224.373 2.227 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CCOC1CCCCC1 ZINC000309442138 385583260 /nfs/dbraw/zinc/58/32/60/385583260.db2.gz OGZLPDHRJODAFP-GFCCVEGCSA-N 2 0 228.380 2.053 20 0 BEADRP CC(C)=CC[NH2+][C@@H]1CC[N@@H+](C)[C@@H]2CCC[C@H]21 ZINC000309453281 385585085 /nfs/dbraw/zinc/58/50/85/385585085.db2.gz LRSCGKMXJPJZFR-BFHYXJOUSA-N 2 0 222.376 2.415 20 0 BEADRP [NH3+]CCCC[NH2+][C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000082862878 385591573 /nfs/dbraw/zinc/59/15/73/385591573.db2.gz DKHAPZUUMFTRIE-NXEZZACHSA-N 2 0 238.297 2.436 20 0 BEADRP CCCC[NH+]1CCC([NH2+]C[C@@H]2C[C@H]2C)CC1 ZINC000336724476 385615423 /nfs/dbraw/zinc/61/54/23/385615423.db2.gz FJDPJSYXCFGAST-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H](C)Cc1ccccc1C ZINC000414848361 385615622 /nfs/dbraw/zinc/61/56/22/385615622.db2.gz WUSYOGZZOSGAHC-TZMCWYRMSA-N 2 0 234.387 2.371 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]C[C@H](C)c1ccc(F)cc1 ZINC000414848795 385620018 /nfs/dbraw/zinc/62/00/18/385620018.db2.gz XJSPDPKOJCANAQ-NEPJUHHUSA-N 2 0 238.350 2.374 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H](C)CCC(C)C ZINC000414849305 385625513 /nfs/dbraw/zinc/62/55/13/385625513.db2.gz XYWVNZCDJZGWSU-RYUDHWBXSA-N 2 0 200.370 2.256 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]Cc1ccc(F)c(Cl)c1 ZINC000414849753 385629743 /nfs/dbraw/zinc/62/97/43/385629743.db2.gz YMWSGKQEEQHHMO-VIFPVBQESA-N 2 0 244.741 2.424 20 0 BEADRP Cc1ccncc1CN1CCC([NH2+]C(C)C)CC1 ZINC000269723774 385629831 /nfs/dbraw/zinc/62/98/31/385629831.db2.gz UAGFNGWZLNZMCD-UHFFFAOYSA-N 2 0 247.386 2.352 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CCC[C@@H](C)[C@@H]1C ZINC000414849766 385630658 /nfs/dbraw/zinc/63/06/58/385630658.db2.gz YNPNLMCOVZJLQZ-QNWHQSFQSA-N 2 0 212.381 2.256 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H]1C[C@H](C)[C@@H]1C ZINC000336677602 385608732 /nfs/dbraw/zinc/60/87/32/385608732.db2.gz HYUQVQFHFTULJT-RWMBFGLXSA-N 2 0 212.381 2.352 20 0 BEADRP COC1CCC([NH2+]CC2([NH3+])CCCCC2)CC1 ZINC000414850480 385638635 /nfs/dbraw/zinc/63/86/35/385638635.db2.gz ZFIJDZZMGPXXEC-UHFFFAOYSA-N 2 0 240.391 2.195 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]C1C[C@H](C)C[C@@H](C)C1 ZINC000414850973 385646773 /nfs/dbraw/zinc/64/67/73/385646773.db2.gz ZWPSPBILWPUERV-UTUOFQBUSA-N 2 0 212.381 2.256 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]C1C[C@@H](C)C[C@H](C)C1 ZINC000414850971 385647315 /nfs/dbraw/zinc/64/73/15/385647315.db2.gz ZWPSPBILWPUERV-SRVKXCTJSA-N 2 0 212.381 2.256 20 0 BEADRP CCSCC[C@H](C)[N@H+](C)CCC[NH2+]C ZINC000336735825 385717111 /nfs/dbraw/zinc/71/71/11/385717111.db2.gz OOEVRDCZOCDZAT-NSHDSACASA-N 2 0 218.410 2.059 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC000414853145 385683992 /nfs/dbraw/zinc/68/39/92/385683992.db2.gz RXVJPFZELPHMKS-QEJZJMRPSA-N 2 0 232.371 2.235 20 0 BEADRP Cc1occc1C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000647793097 385699290 /nfs/dbraw/zinc/69/92/90/385699290.db2.gz KMMAGVUBJUFSMV-HZSPNIEDSA-N 2 0 234.343 2.066 20 0 BEADRP C[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)[C@@H]1CC1(C)C ZINC000309568677 385704880 /nfs/dbraw/zinc/70/48/80/385704880.db2.gz MZZWRWWWEZDYFM-YPMHNXCESA-N 2 0 222.376 2.273 20 0 BEADRP C[C@H]([NH2+]CC1=CC[N@H+](C)CC1)[C@@H]1CC1(C)C ZINC000309568674 385704920 /nfs/dbraw/zinc/70/49/20/385704920.db2.gz MZZWRWWWEZDYFM-AAEUAGOBSA-N 2 0 222.376 2.273 20 0 BEADRP C[NH2+]CCC[NH2+]CC[C@@H](C)c1ccccc1 ZINC000414857559 385730701 /nfs/dbraw/zinc/73/07/01/385730701.db2.gz DZAWXANVBWDUPX-CYBMUJFWSA-N 2 0 220.360 2.379 20 0 BEADRP CC1(C)CC[C@H]1[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000336656651 385785794 /nfs/dbraw/zinc/78/57/94/385785794.db2.gz LQAQQZDOWKKFFV-DGCLKSJQSA-N 2 0 222.376 2.249 20 0 BEADRP CC(C)CCC[C@@H](C)[NH2+]C[C@@H](C)C[NH3+] ZINC000336692386 385733211 /nfs/dbraw/zinc/73/32/11/385733211.db2.gz QGLJMBBBVGDNBD-NWDGAFQWSA-N 2 0 200.370 2.386 20 0 BEADRP [NH3+]C1(C[NH2+]C[C@@H]2CCSC2)CCCCCC1 ZINC000414858261 385733815 /nfs/dbraw/zinc/73/38/15/385733815.db2.gz INTBOORUDWWJNE-LBPRGKRZSA-N 2 0 242.432 2.381 20 0 BEADRP CC[NH2+][C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185709254 385736249 /nfs/dbraw/zinc/73/62/49/385736249.db2.gz AGFMLAUXFKWXCB-VXGBXAGGSA-N 2 0 210.365 2.249 20 0 BEADRP CC[C@@H]1CCC[C@H](C[NH2+]CCC[NH2+]C)C1 ZINC000414859803 385739074 /nfs/dbraw/zinc/73/90/74/385739074.db2.gz NXECSKXEWXHLQI-OLZOCXBDSA-N 2 0 212.381 2.402 20 0 BEADRP C[C@H]([NH2+]Cc1cccs1)[C@@H]1CCC[NH2+]C1 ZINC000414860814 385742561 /nfs/dbraw/zinc/74/25/61/385742561.db2.gz VVIXUENGQCTBEX-WDEREUQCSA-N 2 0 224.373 2.226 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCC[C@H]1C)[C@@H]1CCC[NH2+]C1 ZINC000414863094 385755531 /nfs/dbraw/zinc/75/55/31/385755531.db2.gz XXWUISQREWNBOT-LPWJVIDDSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]1C[C@H]1C[NH2+]CC1([NH3+])CCCCCC1 ZINC000414862562 385756049 /nfs/dbraw/zinc/75/60/49/385756049.db2.gz VJXFDHWXSVQZLG-RYUDHWBXSA-N 2 0 210.365 2.284 20 0 BEADRP CC(C)C(C)(C)C[NH2+][C@H](C)CCC[NH3+] ZINC000336701017 385764411 /nfs/dbraw/zinc/76/44/11/385764411.db2.gz XPVBBQOWNHSKPC-LLVKDONJSA-N 2 0 200.370 2.386 20 0 BEADRP CC[NH2+]Cc1cccc(NC[C@H]2CCC[NH2+]C2)c1 ZINC000414864173 385766776 /nfs/dbraw/zinc/76/67/76/385766776.db2.gz JMXKUZQEFHFSGU-AWEZNQCLSA-N 2 0 247.386 2.208 20 0 BEADRP C[NH2+]CCC[NH2+]CCCCOc1ccccc1 ZINC000414864083 385767360 /nfs/dbraw/zinc/76/73/60/385767360.db2.gz YUUWDLOFCQOVAG-UHFFFAOYSA-N 2 0 236.359 2.045 20 0 BEADRP F[C@@H]1CCC[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000647799635 385800322 /nfs/dbraw/zinc/80/03/22/385800322.db2.gz NHLLTWVJQJOADL-PNKOWGENSA-N 2 0 226.339 2.140 20 0 BEADRP F[C@@H]1CCCC[C@H]1[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000647799476 385800493 /nfs/dbraw/zinc/80/04/93/385800493.db2.gz IEBDDWJCAFCDMD-RYMFRWLXSA-N 2 0 240.366 2.245 20 0 BEADRP CC(C)C[C@@H]1C[C@H]1[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000647799880 385800764 /nfs/dbraw/zinc/80/07/64/385800764.db2.gz RZFPJHANUXSTKE-NJVJYBDUSA-N 2 0 236.403 2.399 20 0 BEADRP C([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)[C@@H]1C[C@H]1C1CC1 ZINC000647800014 385803723 /nfs/dbraw/zinc/80/37/23/385803723.db2.gz XEYUXKQAFZGIMV-QMIVOQANSA-N 2 0 234.387 2.010 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]C[C@@H]1CC2CCC1CC2 ZINC000647801082 385809230 /nfs/dbraw/zinc/80/92/30/385809230.db2.gz NWIYROLOKZFFRV-PNKMZZHYSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)CC(F)F ZINC000647800710 385809650 /nfs/dbraw/zinc/80/96/50/385809650.db2.gz JJESZKLCHVRUBQ-FIQHERPVSA-N 2 0 246.345 2.255 20 0 BEADRP CC1(C)CCC[C@H](C[NH2+][C@@H]2CC[NH2+]C2)C1 ZINC000414867661 385810142 /nfs/dbraw/zinc/81/01/42/385810142.db2.gz GVNXBNQYBSBIRC-NWDGAFQWSA-N 2 0 210.365 2.154 20 0 BEADRP CC(C)[C@H]1CCC[N@@H+]1CCC1CC[NH2+]CC1 ZINC000084126316 385856954 /nfs/dbraw/zinc/85/69/54/385856954.db2.gz SWBQQTGRENNTLU-CQSZACIVSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@H]([NH2+]C[C@H](C)C[NH3+])c1ccccc1OC ZINC000336716542 385812016 /nfs/dbraw/zinc/81/20/16/385812016.db2.gz QDHSRUGIFNRBQG-YPMHNXCESA-N 2 0 236.359 2.331 20 0 BEADRP C[C@@H](C[NH2+][C@H](C)[C@@H]1CCC[NH2+]1)CC(F)F ZINC000647801554 385812708 /nfs/dbraw/zinc/81/27/08/385812708.db2.gz YHJIKSWIJOICPY-BBBLOLIVSA-N 2 0 220.307 2.008 20 0 BEADRP C[C@@H](C[NH2+][C@H](C)[C@H]1CCC[NH2+]1)CC(F)F ZINC000647801559 385812734 /nfs/dbraw/zinc/81/27/34/385812734.db2.gz YHJIKSWIJOICPY-OPRDCNLKSA-N 2 0 220.307 2.008 20 0 BEADRP CCC[NH2+]CC[NH2+]C[C@H]1CCCC[C@@H]1C ZINC000414868193 385814439 /nfs/dbraw/zinc/81/44/39/385814439.db2.gz JPZJPBUPOPFFFN-QWHCGFSZSA-N 2 0 212.381 2.402 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]CCCCOc1ccccc1 ZINC000414871640 385857332 /nfs/dbraw/zinc/85/73/32/385857332.db2.gz DRVZLYQJOVNNCP-CYBMUJFWSA-N 2 0 236.359 2.030 20 0 BEADRP CC(C)[N@@H+]1CC[C@H](C)[C@H](n2ccnc2)C1 ZINC000271346848 385819177 /nfs/dbraw/zinc/81/91/77/385819177.db2.gz XVOVMQNCEHJZQP-NWDGAFQWSA-N 2 0 207.321 2.174 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+]CCCC[NH+](C)C ZINC000271327700 385819819 /nfs/dbraw/zinc/81/98/19/385819819.db2.gz ANCZKDHIKBDAJA-ZDUSSCGKSA-N 2 0 235.375 2.382 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+]C[C@@H]1CCCN1C ZINC000271377296 385822559 /nfs/dbraw/zinc/82/25/59/385822559.db2.gz HVIOHNWNLKUTKR-STQMWFEESA-N 2 0 233.359 2.135 20 0 BEADRP CC[C@H](C[N@H+](C)CC[C@@H]1CCCC[NH+]1C)OC ZINC000412977222 385823275 /nfs/dbraw/zinc/82/32/75/385823275.db2.gz LBLIFVUXXYPOTP-UONOGXRCSA-N 2 0 242.407 2.218 20 0 BEADRP COCc1cccc(C[NH2+][C@@H]2CC[NH2+][C@@H](C)C2)c1 ZINC000414952442 385826196 /nfs/dbraw/zinc/82/61/96/385826196.db2.gz QSTCZMYEAMXXEM-SWLSCSKDSA-N 2 0 248.370 2.063 20 0 BEADRP Cc1cc(Cl)ccc1C[NH2+]C[C@H](C)C[NH3+] ZINC000414871630 385857852 /nfs/dbraw/zinc/85/78/52/385857852.db2.gz DQUBJKREFAFGFN-SECBINFHSA-N 2 0 226.751 2.333 20 0 BEADRP C[C@@H](Cc1ccoc1)[NH2+]Cc1ccc(C[NH3+])cc1 ZINC000647802037 385833245 /nfs/dbraw/zinc/83/32/45/385833245.db2.gz CFWZSCQKXVEFRY-LBPRGKRZSA-N 2 0 244.338 2.459 20 0 BEADRP COc1cc(C[NH2+][C@@H]2CC[NH2+][C@@H](C)C2)ccc1C ZINC000414954128 385834883 /nfs/dbraw/zinc/83/48/83/385834883.db2.gz SIATZFMATPXACP-GXTWGEPZSA-N 2 0 248.370 2.234 20 0 BEADRP C[NH2+]Cc1ccccc1NCC[NH2+]C(C)(C)C ZINC000414869472 385837379 /nfs/dbraw/zinc/83/73/79/385837379.db2.gz QHEWJEBNNWRHJN-UHFFFAOYSA-N 2 0 235.375 2.206 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+]CC1CCC(F)CC1 ZINC000647804636 385838637 /nfs/dbraw/zinc/83/86/37/385838637.db2.gz WHYGTOXMOPHGRS-ABXWRUBCSA-N 2 0 242.382 2.492 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+][C@@H]1CC[C@H]2C[C@H]2C1 ZINC000647804798 385838937 /nfs/dbraw/zinc/83/89/37/385838937.db2.gz ZNWYDMPJDZWSRL-HTOAHKCRSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CC1CCC(F)CC1 ZINC000647804259 385840323 /nfs/dbraw/zinc/84/03/23/385840323.db2.gz MWCVXOWILPGAQL-QYNFOATHSA-N 2 0 216.344 2.230 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCS[C@@H]1C)[C@@H]1CCC[NH2+]1 ZINC000647804567 385840772 /nfs/dbraw/zinc/84/07/72/385840772.db2.gz UZQRBUMVNPNLTJ-KXNHARMFSA-N 2 0 228.405 2.001 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H]2CCC[C@@H](C3CC3)C2)CCC1 ZINC000414871913 385858977 /nfs/dbraw/zinc/85/89/77/385858977.db2.gz DSIBWLATJSEGCN-CHWSQXEVSA-N 2 0 222.376 2.426 20 0 BEADRP CCC[NH2+]CC[NH2+][C@@H]1CCC[C@H](C)[C@H]1C ZINC000414871023 385855703 /nfs/dbraw/zinc/85/57/03/385855703.db2.gz NIWACVXKPLQDDL-YNEHKIRRSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H](CCc1ccsc1)N[C@H]1CC[NH2+]C1 ZINC000414867136 385791308 /nfs/dbraw/zinc/79/13/08/385791308.db2.gz GFBNJYDXTFQBJO-PWSUYJOCSA-N 2 0 224.373 2.021 20 0 BEADRP CCOc1ccc(C[NH2+][C@@H]2CC[NH2+][C@H](C)C2)cc1 ZINC000414945794 385793425 /nfs/dbraw/zinc/79/34/25/385793425.db2.gz IWKVQKWDNFKORQ-TZMCWYRMSA-N 2 0 248.370 2.315 20 0 BEADRP CC(C)CC1(C[NH2+][C@@H]2CN(C)C[C@H]2C)CC1 ZINC000309697492 385797685 /nfs/dbraw/zinc/79/76/85/385797685.db2.gz RTZBPFWQOCTRGQ-CHWSQXEVSA-N 2 0 224.392 2.352 20 0 BEADRP CC(C)CC1(C[NH2+][C@@H]2CN(C)C[C@@H]2C)CC1 ZINC000309697494 385797731 /nfs/dbraw/zinc/79/77/31/385797731.db2.gz RTZBPFWQOCTRGQ-QWHCGFSZSA-N 2 0 224.392 2.352 20 0 BEADRP C[N@@H+](Cc1cccs1)CC1CC[NH2+]CC1 ZINC000021949152 385885506 /nfs/dbraw/zinc/88/55/06/385885506.db2.gz HRDSURNHOGRUNX-UHFFFAOYSA-N 2 0 224.373 2.180 20 0 BEADRP CC(C)CCC[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000122132269 385886014 /nfs/dbraw/zinc/88/60/14/385886014.db2.gz GSDHUHDQDJRVIO-CHWSQXEVSA-N 2 0 212.381 2.495 20 0 BEADRP CO[C@@H](C)[C@H](C)[NH2+]CCCCC[NH+]1CCCC1 ZINC000340479109 385890011 /nfs/dbraw/zinc/89/00/11/385890011.db2.gz VSRHVZYSVKEEJY-KBPBESRZSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@H](N[C@H]1CC[N@@H+]2CCCC[C@@H]12)c1ccncc1 ZINC000217677076 385891115 /nfs/dbraw/zinc/89/11/15/385891115.db2.gz BDWFGICOJHVPJC-QEJZJMRPSA-N 2 0 245.370 2.359 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCSc2ccccc21)C1C[NH2+]C1 ZINC000335037961 385929195 /nfs/dbraw/zinc/92/91/95/385929195.db2.gz JURKQJKZKBFICW-GXFFZTMASA-N 2 0 248.395 2.421 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]Cc1ccsc1 ZINC000335037579 385929518 /nfs/dbraw/zinc/92/95/18/385929518.db2.gz FDLJJAVYSOIFOF-ZYHUDNBSSA-N 2 0 224.373 2.226 20 0 BEADRP COC[C@@]1(C[NH2+][C@H](C)CCC(C)C)CCC[NH2+]1 ZINC000414964846 385909941 /nfs/dbraw/zinc/90/99/41/385909941.db2.gz YPNXXVQDHRJGFO-KGLIPLIRSA-N 2 0 242.407 2.169 20 0 BEADRP Cc1cc(N)cc(CNCC[NH2+]C(C)(C)C)c1 ZINC000414965225 385913199 /nfs/dbraw/zinc/91/31/99/385913199.db2.gz NJGJJSCHBZWYNW-UHFFFAOYSA-N 2 0 235.375 2.055 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+]C[C@@H]1CCCC[C@@H]1C ZINC000414965882 385914203 /nfs/dbraw/zinc/91/42/03/385914203.db2.gz WCGHEKWELNWDMR-XQQFMLRXSA-N 2 0 212.381 2.400 20 0 BEADRP CCOc1ccccc1CN[C@@H]1CC[NH2+]C[C@@H]1C ZINC000414966958 385923556 /nfs/dbraw/zinc/92/35/56/385923556.db2.gz XCCPGDKXWOUVCW-GXTWGEPZSA-N 2 0 248.370 2.173 20 0 BEADRP [NH3+]CC1CCC([NH2+][C@H]2CC=CCC2)CC1 ZINC000335034214 385923650 /nfs/dbraw/zinc/92/36/50/385923650.db2.gz KSSMBALFYYMKGZ-CPCZMJQVSA-N 2 0 208.349 2.202 20 0 BEADRP Cc1ccsc1C[NH2+]C[C@@H](C)C[NH+](C)C ZINC000291731880 385924608 /nfs/dbraw/zinc/92/46/08/385924608.db2.gz NYGOXTZKGUXXHC-SNVBAGLBSA-N 2 0 226.389 2.344 20 0 BEADRP [NH3+]C1(C[NH2+][C@H]2CCCC[C@@H]2C2CC2)CCC1 ZINC000414872139 385862034 /nfs/dbraw/zinc/86/20/34/385862034.db2.gz FJKZIBMUKPURCZ-OLZOCXBDSA-N 2 0 222.376 2.426 20 0 BEADRP CC[C@@H](C)[NH2+]CCC1CC[NH+](CC)CC1 ZINC000121762526 385862242 /nfs/dbraw/zinc/86/22/42/385862242.db2.gz CUKSDWSDFZJHKD-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@H]2CC[C@@H]2C2CCC2)CC1 ZINC000337990800 385870303 /nfs/dbraw/zinc/87/03/03/385870303.db2.gz CSKVOGGJGWTKCS-CABCVRRESA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]([NH2+]CC(C)(C)C[NH+](C)C)[C@@]1(C)CCCO1 ZINC000340473676 385877223 /nfs/dbraw/zinc/87/72/23/385877223.db2.gz KGRRBPBTBATRJF-TZMCWYRMSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H]([NH2+]CC(C)(C)C[NH+](C)C)[C@]1(C)CCCO1 ZINC000340473674 385877544 /nfs/dbraw/zinc/87/75/44/385877544.db2.gz KGRRBPBTBATRJF-JSGCOSHPSA-N 2 0 242.407 2.121 20 0 BEADRP CC[C@@H]1CCC[C@H](C[NH2+]C[C@H](C)C[NH3+])C1 ZINC000414873725 385880446 /nfs/dbraw/zinc/88/04/46/385880446.db2.gz HTKFKYYDKJPQOU-UPJWGTAASA-N 2 0 212.381 2.387 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000414971588 385975272 /nfs/dbraw/zinc/97/52/72/385975272.db2.gz WOULUPOHZOGCEQ-WCQYABFASA-N 2 0 210.365 2.297 20 0 BEADRP FC(F)(F)C1CC([NH2+][C@@H]2CCC[NH2+]CC2)C1 ZINC000335017807 385975967 /nfs/dbraw/zinc/97/59/67/385975967.db2.gz NOPFHNYPLLWHIR-HWOCKDDLSA-N 2 0 236.281 2.059 20 0 BEADRP C[C@H](CC1CC1)[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000414971589 385976505 /nfs/dbraw/zinc/97/65/05/385976505.db2.gz WOULUPOHZOGCEQ-YPMHNXCESA-N 2 0 210.365 2.297 20 0 BEADRP C([NH2+][C@H]1CCCC12CCC2)[C@@H]1CCC[NH2+]C1 ZINC000335018793 385977562 /nfs/dbraw/zinc/97/75/62/385977562.db2.gz LAAFMFHCNPDONI-OLZOCXBDSA-N 2 0 222.376 2.298 20 0 BEADRP CCSCC[C@H](C)[N@H+](C)CC(C)(C)[NH3+] ZINC000336748256 385984107 /nfs/dbraw/zinc/98/41/07/385984107.db2.gz DBSNJROSYCTFSE-JTQLQIEISA-N 2 0 218.410 2.187 20 0 BEADRP CC[NH+](CC)CCC[N@@H+]1CCC[C@](C)(OC)C1 ZINC000338389955 385986688 /nfs/dbraw/zinc/98/66/88/385986688.db2.gz TWCNBZHUBOAWLC-AWEZNQCLSA-N 2 0 242.407 2.219 20 0 BEADRP [NH3+]CC[C@H]1CCC[N@H+](C[C@H]2CCC(F)(F)C2)C1 ZINC000305994989 385988788 /nfs/dbraw/zinc/98/87/88/385988788.db2.gz MQKYNOGSDZFYER-NEPJUHHUSA-N 2 0 246.345 2.483 20 0 BEADRP C[C@@H](C[NH2+]C[C@@H]([NH3+])C1CC1)Cc1ccccc1 ZINC000414881362 385992019 /nfs/dbraw/zinc/99/20/19/385992019.db2.gz AHNVKGFZHBMUBF-IUODEOHRSA-N 2 0 232.371 2.192 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]C1Cc2ccccc2C1 ZINC000335040045 385930602 /nfs/dbraw/zinc/93/06/02/385930602.db2.gz OCCJYDYSFUIFSA-CVEARBPZSA-N 2 0 244.382 2.403 20 0 BEADRP CC1(C)C[C@@H]1[NH2+][C@@H]1CCC[C@H]1[C@H]1CCC[NH2+]1 ZINC000251104099 385935514 /nfs/dbraw/zinc/93/55/14/385935514.db2.gz AWTLYUULITXOEX-LOWDOPEQSA-N 2 0 222.376 2.295 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+]CC(C)(C)[NH3+])CC2 ZINC000335043101 385935832 /nfs/dbraw/zinc/93/58/32/385935832.db2.gz NDAWMVLTGAODMP-CYBMUJFWSA-N 2 0 218.344 2.309 20 0 BEADRP [NH3+]C1(C[NH2+]C[C@@H]2C[C@H]2c2ccccc2)CCC1 ZINC000414878704 385941178 /nfs/dbraw/zinc/94/11/78/385941178.db2.gz ORFLIEXCKHZENY-KBPBESRZSA-N 2 0 230.355 2.261 20 0 BEADRP C[C@H](C[NH2+]Cc1cccc2[nH]ccc21)C[NH+](C)C ZINC000291744019 385945078 /nfs/dbraw/zinc/94/50/78/385945078.db2.gz PHTKQOVQEUPLDV-GFCCVEGCSA-N 2 0 245.370 2.455 20 0 BEADRP CC[NH+](CC)CCC[NH+]1CCC(C)(OC)CC1 ZINC000338295353 385955474 /nfs/dbraw/zinc/95/54/74/385955474.db2.gz DYBXJBOYJALIQT-UHFFFAOYSA-N 2 0 242.407 2.219 20 0 BEADRP CC1(C[NH2+][C@@H]2CCC[C@@H]2[NH3+])CCCCC1 ZINC000335056046 385955536 /nfs/dbraw/zinc/95/55/36/385955536.db2.gz ANIWLGJELLEZCI-NWDGAFQWSA-N 2 0 210.365 2.426 20 0 BEADRP CC[N@H+](C)CCCN(C)Cc1ccco1 ZINC000285744773 385959751 /nfs/dbraw/zinc/95/97/51/385959751.db2.gz RIDDLKVACOFYJR-UHFFFAOYSA-N 2 0 210.321 2.053 20 0 BEADRP C[C@H]1COCC[C@@H]1[NH2+]CC1([NH3+])CCCCCC1 ZINC000335058884 385961304 /nfs/dbraw/zinc/96/13/04/385961304.db2.gz MDLVWXOVQDSBDL-STQMWFEESA-N 2 0 240.391 2.053 20 0 BEADRP CC(C)C1CCC([NH2+]C[C@@H](C)C[NH3+])CC1 ZINC000414879958 385961501 /nfs/dbraw/zinc/96/15/01/385961501.db2.gz QAYRXQGCLHVHQT-HIFPTAJRSA-N 2 0 212.381 2.386 20 0 BEADRP C[C@H]([NH2+]CCC[C@H]1CCC[NH2+]1)C1CCC1 ZINC000414970566 385964278 /nfs/dbraw/zinc/96/42/78/385964278.db2.gz VDDZDBYUIYSHSO-AAEUAGOBSA-N 2 0 210.365 2.297 20 0 BEADRP CC[NH+](CC)CCC[N@H+](C)[C@@H]1CC1(C)C ZINC000338361587 385970057 /nfs/dbraw/zinc/97/00/57/385970057.db2.gz COQWTPLMAKPDOV-GFCCVEGCSA-N 2 0 212.381 2.449 20 0 BEADRP CC(C)C1CC([NH2+][C@@H]2CCC[C@@H]([NH3+])C2)C1 ZINC000335015541 385970866 /nfs/dbraw/zinc/97/08/66/385970866.db2.gz ZDMBAUQENDMVDX-QZQSVVMZSA-N 2 0 210.365 2.281 20 0 BEADRP C[C@H]1CCC[C@@H](C[NH2+]CC2([NH3+])CCC2)C1 ZINC000414880818 385972245 /nfs/dbraw/zinc/97/22/45/385972245.db2.gz RCJKZVWPJOOGJF-NWDGAFQWSA-N 2 0 210.365 2.284 20 0 BEADRP CC[NH+](CC)CCCN1C[C@H](C)O[C@@H](C)[C@@H]1C ZINC000338345493 385973581 /nfs/dbraw/zinc/97/35/81/385973581.db2.gz ANNRYJILEXETLB-IHRRRGAJSA-N 2 0 242.407 2.216 20 0 BEADRP CC[C@@H]1CCC[C@@H]([NH2+]CC2([NH3+])CCC2)C1 ZINC000414881492 386000437 /nfs/dbraw/zinc/00/04/37/386000437.db2.gz SJKWVQOLRGBWPJ-VXGBXAGGSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1)[C@H]1C[C@H]1C ZINC000414117313 386012213 /nfs/dbraw/zinc/01/22/13/386012213.db2.gz RVJGGNGKOPQGSN-ITGHMWBKSA-N 2 0 224.392 2.493 20 0 BEADRP C[C@H](CCc1ccsc1)[NH2+]CCC[NH3+] ZINC000336751968 386012653 /nfs/dbraw/zinc/01/26/53/386012653.db2.gz GTTKYJOCICZSBW-SNVBAGLBSA-N 2 0 212.362 2.008 20 0 BEADRP COC(C)(C)[C@@H](C)[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC000414169823 386016338 /nfs/dbraw/zinc/01/63/38/386016338.db2.gz BODLPBZMNOWFFD-CHWSQXEVSA-N 2 0 242.407 2.121 20 0 BEADRP C[N@@H+]1CCC[C@@H](CC[NH2+][C@@H]2CCC2(C)C)C1 ZINC000414168600 386016639 /nfs/dbraw/zinc/01/66/39/386016639.db2.gz ANUPTYXQDIYIGU-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H](Cc1ccc(F)cc1)[NH2+]C[C@@H]([NH3+])C1CC1 ZINC000414882587 386018267 /nfs/dbraw/zinc/01/82/67/386018267.db2.gz BYFXOBCWTBOLKS-IINYFYTJSA-N 2 0 236.334 2.084 20 0 BEADRP C[C@H]([NH2+]Cc1ccc2c[nH+]cn2c1)[C@@H]1C[C@H]1C ZINC000414180587 386022264 /nfs/dbraw/zinc/02/22/64/386022264.db2.gz LFGVWTFHLQPVNK-UHIISALHSA-N 2 0 229.327 2.468 20 0 BEADRP C[C@H](CCc1ccccc1)C[NH2+]C[C@@H](C)C[NH3+] ZINC000414882850 386022427 /nfs/dbraw/zinc/02/24/27/386022427.db2.gz USHJEUBZBAZQNW-KGLIPLIRSA-N 2 0 234.387 2.440 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+]C[C@@H](C)CCc1ccccc1 ZINC000414882849 386023301 /nfs/dbraw/zinc/02/33/01/386023301.db2.gz USHJEUBZBAZQNW-KBPBESRZSA-N 2 0 234.387 2.440 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]C[C@H](C)CCc1ccccc1 ZINC000414882854 386023352 /nfs/dbraw/zinc/02/33/52/386023352.db2.gz USHJEUBZBAZQNW-ZIAGYGMSSA-N 2 0 234.387 2.440 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]CC2([NH3+])CCC2)[C@@H]1C ZINC000414883537 386032114 /nfs/dbraw/zinc/03/21/14/386032114.db2.gz VIWVJKSEZQJIGU-UTUOFQBUSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]CC2([NH3+])CCC2)[C@H]1C ZINC000414883538 386032976 /nfs/dbraw/zinc/03/29/76/386032976.db2.gz VIWVJKSEZQJIGU-WOPDTQHZSA-N 2 0 210.365 2.282 20 0 BEADRP C[NH2+]Cc1ccc(N[C@@H](C)C[C@@H]2CCC[NH2+]2)cc1 ZINC000414978613 386034159 /nfs/dbraw/zinc/03/41/59/386034159.db2.gz SAJKEXRBTKLKLX-WFASDCNBSA-N 2 0 247.386 2.349 20 0 BEADRP C[C@H](CCc1ccccc1)[NH2+]C[C@@H]([NH3+])C1CC1 ZINC000414883825 386034998 /nfs/dbraw/zinc/03/49/98/386034998.db2.gz DQDWMGNMBRUZMM-IUODEOHRSA-N 2 0 232.371 2.335 20 0 BEADRP C[C@@H](C[NH2+]CC1([NH3+])CCC1)c1ccc(F)cc1 ZINC000414884616 386041631 /nfs/dbraw/zinc/04/16/31/386041631.db2.gz VYPXWAGTOGTJEU-NSHDSACASA-N 2 0 236.334 2.400 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H]2CC3CCC2CC3)C1 ZINC000309520706 386050313 /nfs/dbraw/zinc/05/03/13/386050313.db2.gz UBCXZFNSVIPCGJ-MYXTYHMWSA-N 2 0 222.376 2.425 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+][C@@H]1C[C@H]1c1ccco1 ZINC000414328835 386123496 /nfs/dbraw/zinc/12/34/96/386123496.db2.gz CTMJQMQISORYRZ-XVIXHAIJSA-N 2 0 248.370 2.454 20 0 BEADRP Cc1ccc(CCC[NH2+][C@H]2CCSC2)cn1 ZINC000336729247 386107651 /nfs/dbraw/zinc/10/76/51/386107651.db2.gz HQUWHYKYZVGZKL-ZDUSSCGKSA-N 2 0 236.384 2.418 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@@H]1CCC[C@H](C2CC2)C1 ZINC000414986717 386115098 /nfs/dbraw/zinc/11/50/98/386115098.db2.gz YCQPCAQVNAKKKY-RWMBFGLXSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]C1CCC(F)(F)CC1 ZINC000335028051 386067589 /nfs/dbraw/zinc/06/75/89/386067589.db2.gz VUGFMIXHXYJRNF-ZJUUUORDSA-N 2 0 218.291 2.034 20 0 BEADRP C[C@@H]1C[N@H+](C[C@@H]2C[C@H]2c2ccccc2)CC[C@@H]1[NH3+] ZINC000414653877 386072396 /nfs/dbraw/zinc/07/23/96/386072396.db2.gz FIAUZWUGQSRHIK-OEAJRASXSA-N 2 0 244.382 2.459 20 0 BEADRP CCc1cccc(F)c1C[NH2+][C@@H](C)CC[NH3+] ZINC000414886510 386077910 /nfs/dbraw/zinc/07/79/10/386077910.db2.gz CPCNNFAZTOFNND-JTQLQIEISA-N 2 0 224.323 2.215 20 0 BEADRP CSCCC[N@@H+]1CCC[C@@H]([NH+](C)C)CC1 ZINC000365402737 386078134 /nfs/dbraw/zinc/07/81/34/386078134.db2.gz KDKJBTJWBCCQHQ-GFCCVEGCSA-N 2 0 230.421 2.156 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H]2CS[C@@H](C)C2)[C@@H](C)C1 ZINC000414228070 386078095 /nfs/dbraw/zinc/07/80/95/386078095.db2.gz LKFNRXSAYISUGH-CYDGBPFRSA-N 2 0 242.432 2.200 20 0 BEADRP C[NH2+][C@@H]1CCN(C[C@@H]2C[C@H]2c2ccccc2)C1 ZINC000414655762 386082162 /nfs/dbraw/zinc/08/21/62/386082162.db2.gz LXXZZYWRVORVAT-ZNMIVQPWSA-N 2 0 230.355 2.084 20 0 BEADRP [NH3+]C[C@@H]1CC[N@H+](C[C@@H]2C[C@H]2c2ccccc2)C1 ZINC000414659438 386088049 /nfs/dbraw/zinc/08/80/49/386088049.db2.gz SLNZADHNUGWEPX-QEJZJMRPSA-N 2 0 230.355 2.071 20 0 BEADRP Cc1nc2ccc(C[NH2+][C@H](C)CC[NH3+])cc2s1 ZINC000414887265 386088961 /nfs/dbraw/zinc/08/89/61/386088961.db2.gz DFOPLEOQAPZIEB-SECBINFHSA-N 2 0 249.383 2.432 20 0 BEADRP C[C@H](Cc1ccc(Cl)cc1)[NH2+]C[C@@H](C)C[NH3+] ZINC000414887747 386094686 /nfs/dbraw/zinc/09/46/86/386094686.db2.gz ZJPKECVKKXZPOP-WDEREUQCSA-N 2 0 240.778 2.455 20 0 BEADRP [NH3+][C@H](C[NH2+]CCCCOc1ccccc1)C1CC1 ZINC000414892052 386144712 /nfs/dbraw/zinc/14/47/12/386144712.db2.gz PFVXNOFUDLQJCT-OAHLLOKOSA-N 2 0 248.370 2.173 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@H]([NH3+])C2CC2)C[C@@H]1C ZINC000414891942 386144819 /nfs/dbraw/zinc/14/48/19/386144819.db2.gz OZNWEFSHCWRTCF-URBCHYCLSA-N 2 0 210.365 2.138 20 0 BEADRP [NH3+][C@H]1CCC[C@@H](C[NH2+]Cc2ccc(F)cc2)C1 ZINC000414990287 386144833 /nfs/dbraw/zinc/14/48/33/386144833.db2.gz IEOPSCMJUAXCMC-OCCSQVGLSA-N 2 0 236.334 2.433 20 0 BEADRP CCC1CCC([NH2+]C[C@@H]([NH3+])C2CC2)CC1 ZINC000414892080 386144886 /nfs/dbraw/zinc/14/48/86/386144886.db2.gz PGOPHCJITNMXNL-KGPNIALWSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H](C[NH2+]Cc2ccc(F)cc2)C1 ZINC000414990288 386144996 /nfs/dbraw/zinc/14/49/96/386144996.db2.gz IEOPSCMJUAXCMC-TZMCWYRMSA-N 2 0 236.334 2.433 20 0 BEADRP [NH3+][C@@H]1CCC[C@H](C[NH2+]Cc2cccc(F)c2)C1 ZINC000414990750 386147258 /nfs/dbraw/zinc/14/72/58/386147258.db2.gz JBAUHSSHERZZGJ-GXTWGEPZSA-N 2 0 236.334 2.433 20 0 BEADRP COc1ccc([C@@H]2CCC[N@@H+]2CCC[NH3+])cc1 ZINC000414676023 386149146 /nfs/dbraw/zinc/14/91/46/386149146.db2.gz UQKJKCWNJZNAKW-AWEZNQCLSA-N 2 0 234.343 2.181 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[C@@H]([NH3+])C1)C1CCC1 ZINC000414991372 386154071 /nfs/dbraw/zinc/15/40/71/386154071.db2.gz BBPJVLLZIWIYNY-GMXVVIOVSA-N 2 0 210.365 2.282 20 0 BEADRP c1coc([C@@H]2C[C@H]2[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)c1 ZINC000414352180 386155136 /nfs/dbraw/zinc/15/51/36/386155136.db2.gz SZXNZIBDTAVEJF-REWJHTLYSA-N 2 0 246.354 2.352 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@@H]1CCCC[C@H]1C1CC1 ZINC000414992984 386161434 /nfs/dbraw/zinc/16/14/34/386161434.db2.gz SKIYDFOUOTVBBX-RWMBFGLXSA-N 2 0 210.365 2.282 20 0 BEADRP CC[C@H](F)CN1CC[C@H](C[NH+](CC)CC)C1 ZINC000440801724 386161824 /nfs/dbraw/zinc/16/18/24/386161824.db2.gz RIVSTJOXFILKJI-OLZOCXBDSA-N 2 0 230.371 2.398 20 0 BEADRP COC1(C[N@H+](C)CC[C@H]([NH3+])C(C)C)CCCC1 ZINC000319817727 386168641 /nfs/dbraw/zinc/16/86/41/386168641.db2.gz HYDWTRNFXUBTCX-ZDUSSCGKSA-N 2 0 242.407 2.251 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+]C[C@H]([NH3+])C1CC1 ZINC000414894862 386177130 /nfs/dbraw/zinc/17/71/30/386177130.db2.gz UTXBGGINWLPQDO-APPZFPTMSA-N 2 0 224.270 2.044 20 0 BEADRP CC[C@@H](Cc1ccccc1)[NH2+]C[C@@H]([NH3+])C1CC1 ZINC000414895013 386179334 /nfs/dbraw/zinc/17/93/34/386179334.db2.gz VBJWFGSKNJLEQP-LSDHHAIUSA-N 2 0 232.371 2.335 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@H](C)CCc1cccc(F)c1 ZINC000414995884 386179530 /nfs/dbraw/zinc/17/95/30/386179530.db2.gz WTTSEMXIDZKLSC-RISCZKNCSA-N 2 0 238.350 2.474 20 0 BEADRP CC[C@H](Cc1ccccc1)[NH2+]C[C@@H]([NH3+])C1CC1 ZINC000414895012 386180199 /nfs/dbraw/zinc/18/01/99/386180199.db2.gz VBJWFGSKNJLEQP-HUUCEWRRSA-N 2 0 232.371 2.335 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@@H](C)Cc1ccccc1C ZINC000414996329 386181950 /nfs/dbraw/zinc/18/19/50/386181950.db2.gz XNDGJVZJCJDJHN-JSGCOSHPSA-N 2 0 220.360 2.253 20 0 BEADRP CC[C@@H]1CCC[C@H]([NH2+]C[C@@H]([NH3+])C2CC2)C1 ZINC000414895064 386188520 /nfs/dbraw/zinc/18/85/20/386188520.db2.gz VPDZFLTUQXDDOK-KGYLQXTDSA-N 2 0 210.365 2.282 20 0 BEADRP CO[C@H](C)C[N@H+](C[C@H]1CC[NH2+][C@H](C)C1)C(C)C ZINC000414691358 386188841 /nfs/dbraw/zinc/18/88/41/386188841.db2.gz BJWMLFVSFYSUIV-MCIONIFRSA-N 2 0 242.407 2.120 20 0 BEADRP CC[C@H]([NH3+])CNCc1ccccc1Cl ZINC000414987917 386125075 /nfs/dbraw/zinc/12/50/75/386125075.db2.gz ZLGJRQRWHRFKSD-JTQLQIEISA-N 2 0 212.724 2.167 20 0 BEADRP c1ccc([C@H]2CCC[N@H+]2C[C@@H]2CC[NH2+]C2)cc1 ZINC000647874483 386140002 /nfs/dbraw/zinc/14/00/02/386140002.db2.gz ZSRCRDFIXHAXEU-UKRRQHHQSA-N 2 0 230.355 2.433 20 0 BEADRP c1csc([C@H]2CCC[N@H+]2C[C@@H]2CC[NH2+]C2)c1 ZINC000647872814 386141453 /nfs/dbraw/zinc/14/14/53/386141453.db2.gz WXSJDKSHDPPKIF-VXGBXAGGSA-N 2 0 236.384 2.495 20 0 BEADRP c1ccc(C[C@H]2CCC[N@H+]2C[C@@H]2CC[NH2+]C2)cc1 ZINC000647874685 386142304 /nfs/dbraw/zinc/14/23/04/386142304.db2.gz MQURZDAIBZDRQO-HZPDHXFCSA-N 2 0 244.382 2.303 20 0 BEADRP COc1ccc([C@@H](C)[N@H+](C)C[C@H]2CC[NH2+]C2)cc1 ZINC000647874678 386143068 /nfs/dbraw/zinc/14/30/68/386143068.db2.gz MMPZRICYWGCPKN-OLZOCXBDSA-N 2 0 248.370 2.298 20 0 BEADRP Cc1cc(C)cc(C[N@H+]2C[C@@H](C[NH3+])C[C@@H]2C)c1 ZINC000131485062 386210404 /nfs/dbraw/zinc/21/04/04/386210404.db2.gz UFOCGSBCMHGCOX-DZGCQCFKSA-N 2 0 232.371 2.473 20 0 BEADRP CCO[C@H]1C[C@@H]([N@H+](C)CCC[NH3+])C1(CC)CC ZINC000414704073 386216219 /nfs/dbraw/zinc/21/62/19/386216219.db2.gz JEXHXUNDIIFAGS-OLZOCXBDSA-N 2 0 242.407 2.251 20 0 BEADRP CCO[C@@H]1C[C@H]([N@H+](C)CCC[NH3+])C1(CC)CC ZINC000414704075 386217383 /nfs/dbraw/zinc/21/73/83/386217383.db2.gz JEXHXUNDIIFAGS-QWHCGFSZSA-N 2 0 242.407 2.251 20 0 BEADRP Oc1ccc([C@H]2CCC[N@@H+]2C[C@@H]2CC[NH2+]C2)cc1 ZINC000647882070 386218174 /nfs/dbraw/zinc/21/81/74/386218174.db2.gz HZYHKDVUJAMRDZ-IUODEOHRSA-N 2 0 246.354 2.139 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]C[C@@H]2CCCCO2)c2ccccc21 ZINC000132061531 386219169 /nfs/dbraw/zinc/21/91/69/386219169.db2.gz SWEPYNYPJLXDLL-NILFDRSVSA-N 2 0 246.354 2.290 20 0 BEADRP CCC(O)(CC)C[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000132147252 386222060 /nfs/dbraw/zinc/22/20/60/386222060.db2.gz WVNRRMKMQACGDR-ZIAGYGMSSA-N 2 0 248.370 2.272 20 0 BEADRP C[C@@H](c1cccnc1)[N@H+](C)C[C@H]1CC[NH2+][C@H](C)C1 ZINC000414709938 386224933 /nfs/dbraw/zinc/22/49/33/386224933.db2.gz KPFWMLQJVYFAOH-RDBSUJKOSA-N 2 0 247.386 2.463 20 0 BEADRP [NH3+]C[C@H]1CC[N@H+](C/C=C\c2ccc(F)cc2)C1 ZINC000347084551 386241306 /nfs/dbraw/zinc/24/13/06/386241306.db2.gz AQRHTURSQQOLON-UIIMQBOASA-N 2 0 234.318 2.120 20 0 BEADRP C[C@@H]1C[N@H+](CCC[NH3+])CC[C@@H]1c1ccccc1 ZINC000414718843 386249698 /nfs/dbraw/zinc/24/96/98/386249698.db2.gz ZTOKFJGVMVMGRD-HIFRSBDPSA-N 2 0 232.371 2.461 20 0 BEADRP CCC[N@H+](CCC[NH3+])[C@@H]1C[C@@H](OCC)C1(C)C ZINC000414693089 386194021 /nfs/dbraw/zinc/19/40/21/386194021.db2.gz DLNHAMLHEMFOJN-CHWSQXEVSA-N 2 0 242.407 2.251 20 0 BEADRP COCC1(C[NH2+][C@@H](C)CN(C)C(C)C)CCC1 ZINC000310530310 386197389 /nfs/dbraw/zinc/19/73/89/386197389.db2.gz PSMQAQFBUPLMJD-ZDUSSCGKSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H](CC[NH3+])[NH2+]Cc1cc(Cl)cs1 ZINC000414900690 386280620 /nfs/dbraw/zinc/28/06/20/386280620.db2.gz WKKGLIPPRPPSTR-SSDOTTSWSA-N 2 0 218.753 2.228 20 0 BEADRP C[C@@]1(C[NH3+])CC[N@H+](C[C@@H]2C[C@H]2c2ccccc2)C1 ZINC000414730039 386281527 /nfs/dbraw/zinc/28/15/27/386281527.db2.gz GIFQTBMEDFWVBL-JYJNAYRXSA-N 2 0 244.382 2.461 20 0 BEADRP CCCC[C@H](COC)[NH2+]C[C@@H]1CCC[C@@H]([NH3+])C1 ZINC000415005119 386298577 /nfs/dbraw/zinc/29/85/77/386298577.db2.gz OYBOGVUARCLIBU-MGPQQGTHSA-N 2 0 242.407 2.299 20 0 BEADRP CC[C@H](C)[C@@H]1CCCC[N@@H+]1C[C@H]1CC[NH2+]C1 ZINC000647886677 386299554 /nfs/dbraw/zinc/29/95/54/386299554.db2.gz IMVIJOYOMSBCBK-IHRRRGAJSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC2CCCCC2)CC[NH2+]1 ZINC000335261608 386319841 /nfs/dbraw/zinc/31/98/41/386319841.db2.gz OZYHCDQEFBNEDS-DGCLKSJQSA-N 2 0 210.365 2.297 20 0 BEADRP Cc1ccc(CN[C@H](C)[C@@H](C)[NH3+])cc1C ZINC000415004309 386276848 /nfs/dbraw/zinc/27/68/48/386276848.db2.gz HNNFJJRUUPGXBE-VXGBXAGGSA-N 2 0 206.333 2.129 20 0 BEADRP CSCC[N@@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000336682360 386339796 /nfs/dbraw/zinc/33/97/96/386339796.db2.gz RPNOCJGNKIBCKM-ZDUSSCGKSA-N 2 0 242.432 2.013 20 0 BEADRP C[C@H]1Cc2ccccc2C[N@@H+]1C[C@@H]1CC[NH2+]C1 ZINC000647888080 386343718 /nfs/dbraw/zinc/34/37/18/386343718.db2.gz JXJPGAKMBMLJAO-QWHCGFSZSA-N 2 0 230.355 2.043 20 0 BEADRP C[C@H]1Cc2ccccc2C[N@@H+]1C[C@H]1CC[NH2+]C1 ZINC000647888081 386345568 /nfs/dbraw/zinc/34/55/68/386345568.db2.gz JXJPGAKMBMLJAO-STQMWFEESA-N 2 0 230.355 2.043 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+]Cc1ccccc1 ZINC000335278257 386346375 /nfs/dbraw/zinc/34/63/75/386346375.db2.gz MFQUWLNOYFJPGT-DGKWVBSXSA-N 2 0 230.355 2.292 20 0 BEADRP CCO[C@H](CC[NH+](C)C)C[NH2+]CCC(C)(C)C ZINC000188278347 386348000 /nfs/dbraw/zinc/34/80/00/386348000.db2.gz PALPJEQUQVJOMP-CYBMUJFWSA-N 2 0 244.423 2.369 20 0 BEADRP C[N@H+](CCC1CC1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000353157243 386350257 /nfs/dbraw/zinc/35/02/57/386350257.db2.gz ULRCHSPHQABJBW-PBWFPOADSA-N 2 0 222.376 2.344 20 0 BEADRP C[C@@H]1[C@@H](c2ccccc2)CC[N@@H+]1C[C@@H]1CC[NH2+]C1 ZINC000647889347 386356997 /nfs/dbraw/zinc/35/69/97/386356997.db2.gz JBTNKLCXSKJPCF-FMKPAKJESA-N 2 0 244.382 2.474 20 0 BEADRP CCC[C@@H]1[C@@H](C)CCC[N@@H+]1C[C@@H]1CC[NH2+]C1 ZINC000647889969 386362374 /nfs/dbraw/zinc/36/23/74/386362374.db2.gz CDCZOTCMALWEMK-BFHYXJOUSA-N 2 0 224.392 2.497 20 0 BEADRP CSCCC[N@H+](C)CC[C@H]1CCC[NH+]1C ZINC000336697228 386378003 /nfs/dbraw/zinc/37/80/03/386378003.db2.gz NMQSLYJEPULCSB-GFCCVEGCSA-N 2 0 230.421 2.156 20 0 BEADRP C[C@@H]([NH3+])[C@H](C)[NH2+][C@H](C)CCc1cccc(F)c1 ZINC000415006385 386325722 /nfs/dbraw/zinc/32/57/22/386325722.db2.gz BIRQPBREOHWHCB-UTUOFQBUSA-N 2 0 238.350 2.472 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@@H]2CC[NH2+]C2)[C@@H](C)C1 ZINC000414902733 386332601 /nfs/dbraw/zinc/33/26/01/386332601.db2.gz HLRDWZFHKPCFOQ-XQHKEYJVSA-N 2 0 210.365 2.010 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]2C[N@H+](CC3CCCC3)C[C@@H]21 ZINC000230045032 386336282 /nfs/dbraw/zinc/33/62/82/386336282.db2.gz WLFFXPIBHJRZDU-MELADBBJSA-N 2 0 222.376 2.236 20 0 BEADRP c1cn(CC[N@@H+]2CC[C@@H]2c2ccccc2)cn1 ZINC000336715933 386444919 /nfs/dbraw/zinc/44/49/19/386444919.db2.gz VFYXNGCAQQAXBV-CQSZACIVSA-N 2 0 227.311 2.330 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH+](C)C[C@@H](C)COC)C[C@H]1C ZINC000527366090 386447958 /nfs/dbraw/zinc/44/79/58/386447958.db2.gz FQKANPPILBFWEV-MCIONIFRSA-N 2 0 242.407 2.074 20 0 BEADRP C[NH+]1CCC(N[C@@H]2C[C@@]2(F)c2ccccc2)CC1 ZINC000335279459 386392409 /nfs/dbraw/zinc/39/24/09/386392409.db2.gz HUXQOPPQLKRTTL-HUUCEWRRSA-N 2 0 248.345 2.308 20 0 BEADRP CC(C)(C)[C@H]1CCC[N@H+](CCOCC[NH3+])CC1 ZINC000093232488 386406911 /nfs/dbraw/zinc/40/69/11/386406911.db2.gz CQNRAQCXWHNVRV-ZDUSSCGKSA-N 2 0 242.407 2.110 20 0 BEADRP Cc1ccc(C[NH2+]C[C@]2(C)CCC[NH2+]C2)cc1 ZINC000414909980 386408715 /nfs/dbraw/zinc/40/87/15/386408715.db2.gz RXGCCTWIJUGYBX-OAHLLOKOSA-N 2 0 232.371 2.474 20 0 BEADRP C[C@@H](CCc1ccsc1)[NH2+]CCCC[NH3+] ZINC000414910045 386428297 /nfs/dbraw/zinc/42/82/97/386428297.db2.gz ROMFJKUZVURZQI-NSHDSACASA-N 2 0 226.389 2.398 20 0 BEADRP C[C@@H]1C[C@H]1C[NH2+]CC1(C[NH+](C)C)CCCC1 ZINC000336778620 386468494 /nfs/dbraw/zinc/46/84/94/386468494.db2.gz LUUPQNBYTFZQTO-OLZOCXBDSA-N 2 0 224.392 2.354 20 0 BEADRP COc1cccc(C[NH2+]C[C@]2(C)CCC[NH2+]C2)c1 ZINC000414913368 386487271 /nfs/dbraw/zinc/48/72/71/386487271.db2.gz WOVXYOHYNHEXKN-OAHLLOKOSA-N 2 0 248.370 2.175 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]Cc1ccc2c(c1)COC2 ZINC000415012910 386492122 /nfs/dbraw/zinc/49/21/22/386492122.db2.gz JRDCAYILCIPQKB-LBPRGKRZSA-N 2 0 248.370 2.324 20 0 BEADRP CC(C)CCC[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000415013461 386495973 /nfs/dbraw/zinc/49/59/73/386495973.db2.gz VBWNWRBHXBSGMY-UONOGXRCSA-N 2 0 224.392 2.400 20 0 BEADRP c1ccc([C@@H]2C[C@H]2C[NH2+]C2CC[NH2+]CC2)cc1 ZINC000414781039 386497643 /nfs/dbraw/zinc/49/76/43/386497643.db2.gz MMFCYYKTQHXNQG-ZFWWWQNUSA-N 2 0 230.355 2.132 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@H](CC(C)C)OC)CC1 ZINC000417325608 386499066 /nfs/dbraw/zinc/49/90/66/386499066.db2.gz ABMZJLWNEWUXPH-AWEZNQCLSA-N 2 0 242.407 2.121 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@@H](CC(C)C)OC)CC1 ZINC000417325609 386499301 /nfs/dbraw/zinc/49/93/01/386499301.db2.gz ABMZJLWNEWUXPH-CQSZACIVSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000415015228 386500235 /nfs/dbraw/zinc/50/02/35/386500235.db2.gz AOJGKIXOGGPOMZ-MGPQQGTHSA-N 3 0 241.423 2.014 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H]1CCC[C@H]1C1CC1 ZINC000415015128 386500631 /nfs/dbraw/zinc/50/06/31/386500631.db2.gz AERWFIJDEIFFRX-WXHSDQCUSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]Cc1ccccc1N(C)C ZINC000415016012 386500879 /nfs/dbraw/zinc/50/08/79/386500879.db2.gz OTUWYSAKQQICOX-CYBMUJFWSA-N 2 0 249.402 2.360 20 0 BEADRP COC[C@H](CC(C)C)[NH2+]C[C@H]1CCC[C@H]([NH3+])C1 ZINC000415014547 386501135 /nfs/dbraw/zinc/50/11/35/386501135.db2.gz ZYUMULKSTTTXNW-IHRRRGAJSA-N 2 0 242.407 2.155 20 0 BEADRP CC[C@H](C)C[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000415015771 386501169 /nfs/dbraw/zinc/50/11/69/386501169.db2.gz ZIJHSGGQEIWLQU-WCFLWFBJSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]Cc1cccc2c[nH]nc21 ZINC000415017976 386504080 /nfs/dbraw/zinc/50/40/80/386504080.db2.gz TUCCXAZXFUULII-LLVKDONJSA-N 2 0 246.358 2.170 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+]CCCC[NH3+] ZINC000414914942 386504718 /nfs/dbraw/zinc/50/47/18/386504718.db2.gz YNQMGFCMSFYEIX-MRVPVSSYSA-N 2 0 212.259 2.046 20 0 BEADRP [NH3+]C[C@H]1CC[C@H](C[NH2+]C2CCSCC2)CC1 ZINC000415021119 386511080 /nfs/dbraw/zinc/51/10/80/386511080.db2.gz HJBDMAITMOWGGZ-HAQNSBGRSA-N 2 0 242.432 2.237 20 0 BEADRP CC[C@@H]1C[C@H](C[NH2+][C@H](C)CCCC[NH3+])CCO1 ZINC000415022002 386511996 /nfs/dbraw/zinc/51/19/96/386511996.db2.gz ZFXJYASSCKJOES-MGPQQGTHSA-N 2 0 242.407 2.299 20 0 BEADRP CC[C@@H]1C[C@H](C[NH2+][C@@H](C)CCCC[NH3+])CCO1 ZINC000415021997 386512078 /nfs/dbraw/zinc/51/20/78/386512078.db2.gz ZFXJYASSCKJOES-BFHYXJOUSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+]C1CC[NH2+]CC1 ZINC000414782945 386512352 /nfs/dbraw/zinc/51/23/52/386512352.db2.gz PWDMEXHODAMGQA-MRVPVSSYSA-N 2 0 224.270 2.059 20 0 BEADRP Cc1ncccc1C[NH2+]C[C@H]1CC[C@H](C[NH3+])CC1 ZINC000415023440 386513666 /nfs/dbraw/zinc/51/36/66/386513666.db2.gz LFJPWGICIHGFAH-HDJSIYSDSA-N 2 0 247.386 2.245 20 0 BEADRP C[C@@H]([NH3+])[C@H](C)[NH2+][C@H](C)CCc1ccc(F)cc1 ZINC000415024977 386514972 /nfs/dbraw/zinc/51/49/72/386514972.db2.gz ZIPKAHIUPWQLQX-UTUOFQBUSA-N 2 0 238.350 2.472 20 0 BEADRP CC(C)C[C@@H](C)C[NH2+][C@H](C)CCC[NH3+] ZINC000415025739 386514984 /nfs/dbraw/zinc/51/49/84/386514984.db2.gz RMQCNHLMXCZTPB-VXGBXAGGSA-N 2 0 200.370 2.386 20 0 BEADRP CCOc1ccccc1C[NH2+][C@H]1CC[C@H](C[NH3+])C1 ZINC000415044364 386530143 /nfs/dbraw/zinc/53/01/43/386530143.db2.gz SJLUIOIKKRTGSP-JSGCOSHPSA-N 2 0 248.370 2.302 20 0 BEADRP C[C@@H]1CC(C)(C)CC[C@H]1[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000415031615 386520084 /nfs/dbraw/zinc/52/00/84/386520084.db2.gz GKEWVCYJBHNBCC-LBELIVKGSA-N 2 0 222.376 2.009 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CCCC[C@H]1[C@@H]1CC[NH2+]C1 ZINC000415033816 386521011 /nfs/dbraw/zinc/52/10/11/386521011.db2.gz CCAALLDVQFTLCJ-SYQHCUMBSA-N 2 0 222.376 2.106 20 0 BEADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@@H]2CCc3ccccc3C2)C1 ZINC000415034544 386521089 /nfs/dbraw/zinc/52/10/89/386521089.db2.gz JYKVUICRUUBQJO-UHOFOFEASA-N 2 0 244.382 2.261 20 0 BEADRP CCC[C@@H](C)C[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000414915584 386523553 /nfs/dbraw/zinc/52/35/53/386523553.db2.gz ZRXWQASBQSIQJY-CHWSQXEVSA-N 2 0 212.381 2.402 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2[C@H]3C[NH2+]C[C@H]32)CC(C)(C)C1 ZINC000415037744 386524063 /nfs/dbraw/zinc/52/40/63/386524063.db2.gz NDLNOZSMXNUZMV-FHUSYTEZSA-N 2 0 222.376 2.009 20 0 BEADRP Cc1cc(F)ccc1C[NH2+][C@@H]1CC[C@H](C[NH3+])C1 ZINC000415043422 386530416 /nfs/dbraw/zinc/53/04/16/386530416.db2.gz RWSJNCUWCPSYSA-SMDDNHRTSA-N 2 0 236.334 2.351 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+]C[C@@H](C)CC1CCOCC1 ZINC000414786435 386525976 /nfs/dbraw/zinc/52/59/76/386525976.db2.gz BEDBGPNPNGLEKC-JSGCOSHPSA-N 2 0 242.407 2.012 20 0 BEADRP CCCC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000415039693 386527152 /nfs/dbraw/zinc/52/71/52/386527152.db2.gz PLWYHOSRWJJDDB-DGTMBMJNSA-N 2 0 222.376 2.153 20 0 BEADRP CC(C)CC[N@@H+]1CCCC[C@H]1[C@H]1CC[NH2+]C1 ZINC000415041292 386527638 /nfs/dbraw/zinc/52/76/38/386527638.db2.gz LJESLLVSXGLUME-KBPBESRZSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)CC[N@@H+]1CCCC[C@H]1[C@@H]1CC[NH2+]C1 ZINC000415041294 386527838 /nfs/dbraw/zinc/52/78/38/386527838.db2.gz LJESLLVSXGLUME-KGLIPLIRSA-N 2 0 224.392 2.497 20 0 BEADRP CC[N@H+](CCC1CC[NH2+]CC1)Cc1ccccn1 ZINC000094918308 386463605 /nfs/dbraw/zinc/46/36/05/386463605.db2.gz CJBKOQSUZAEQTI-UHFFFAOYSA-N 2 0 247.386 2.293 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+]C[C@@H](C)C[NH3+])s1 ZINC000308604108 386576660 /nfs/dbraw/zinc/57/66/60/386576660.db2.gz GKCUCTZWOLDXQK-WCBMZHEXSA-N 2 0 212.362 2.302 20 0 BEADRP C[C@H](CCC1CC1)[NH2+][C@@H]1CN(C)C[C@H]1C ZINC000336757237 386580113 /nfs/dbraw/zinc/58/01/13/386580113.db2.gz JXWBVYOOCDMXKP-NQBHXWOUSA-N 2 0 210.365 2.105 20 0 BEADRP CC(C)[C@@H]([NH3+])CNCc1cccc(Cl)c1 ZINC000414797948 386582055 /nfs/dbraw/zinc/58/20/55/386582055.db2.gz PVRMXYQQZIMZGZ-LBPRGKRZSA-N 2 0 226.751 2.413 20 0 BEADRP CC(C)[C@@H](C[NH2+]C1CC[NH2+]CC1)c1cccnc1 ZINC000415077868 386586313 /nfs/dbraw/zinc/58/63/13/386586313.db2.gz FTAADLHBUSJQLE-OAHLLOKOSA-N 2 0 247.386 2.163 20 0 BEADRP Cc1ccccc1C[C@@H](C)[NH2+]C[C@@H]([NH3+])C(C)C ZINC000414800598 386587718 /nfs/dbraw/zinc/58/77/18/386587718.db2.gz SEXYALYYPMQVNC-UKRRQHHQSA-N 2 0 234.387 2.499 20 0 BEADRP Cc1ccccc1C[C@@H](C)[NH2+]C[C@H]([NH3+])C(C)C ZINC000414800597 386588368 /nfs/dbraw/zinc/58/83/68/386588368.db2.gz SEXYALYYPMQVNC-HIFRSBDPSA-N 2 0 234.387 2.499 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+]C[C@@H](C)Cc1ccccc1 ZINC000414801014 386589277 /nfs/dbraw/zinc/58/92/77/386589277.db2.gz SUNLWVPYHZRKPB-DZGCQCFKSA-N 2 0 234.387 2.438 20 0 BEADRP CC(C)[C@H](C[NH2+]CC(C)(C)[NH3+])c1cccnc1 ZINC000415081305 386592249 /nfs/dbraw/zinc/59/22/49/386592249.db2.gz KHARJMGYVPXQBP-ZDUSSCGKSA-N 2 0 235.375 2.148 20 0 BEADRP CC(C)[C@@H](C[NH2+]CC(C)(C)[NH3+])c1cccnc1 ZINC000415081302 386592472 /nfs/dbraw/zinc/59/24/72/386592472.db2.gz KHARJMGYVPXQBP-CYBMUJFWSA-N 2 0 235.375 2.148 20 0 BEADRP C[C@@H](CCC(F)(F)F)[NH2+][C@@H](CN)C1CC1 ZINC000414800001 386593358 /nfs/dbraw/zinc/59/33/58/386593358.db2.gz FKMOHXKESBMQOC-CBAPKCEASA-N 2 0 224.270 2.044 20 0 BEADRP C[C@H]1[C@@H]([NH3+])CCN1C[C@@H]1C[C@H]1c1ccccc1 ZINC000414799684 386594480 /nfs/dbraw/zinc/59/44/80/386594480.db2.gz YMYPLVJBMANRGJ-MXAVVETBSA-N 2 0 230.355 2.212 20 0 BEADRP C[C@H]([NH2+]C1CCC(C[NH3+])CC1)c1cccnc1 ZINC000415083750 386596510 /nfs/dbraw/zinc/59/65/10/386596510.db2.gz NRHNSGGXUBFYGQ-DCBWTQNWSA-N 2 0 233.359 2.250 20 0 BEADRP CCC([NH3+])(CC)C[NH2+][C@H]1CCO[C@@H](C(C)C)C1 ZINC000414802536 386596518 /nfs/dbraw/zinc/59/65/18/386596518.db2.gz BVUFOQMXCDCQJP-QWHCGFSZSA-N 2 0 242.407 2.297 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@@H]1CC[C@H](C)[C@@H](C)C1 ZINC000414802374 386596570 /nfs/dbraw/zinc/59/65/70/386596570.db2.gz VOPJLLUAVNJKEV-WUHRBBMRSA-N 2 0 212.381 2.384 20 0 BEADRP CC[C@H](Cc1ccc(C)cc1)[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000415046469 386532026 /nfs/dbraw/zinc/53/20/26/386532026.db2.gz XIDVXNZYCLDWSW-WCVJEAGWSA-N 2 0 244.382 2.124 20 0 BEADRP COc1cc(C[NH2+][C@H]2CC[C@H](C[NH3+])C2)ccc1C ZINC000415048806 386534372 /nfs/dbraw/zinc/53/43/72/386534372.db2.gz XKCIKCZKMAMSCW-JSGCOSHPSA-N 2 0 248.370 2.221 20 0 BEADRP C[C@@]1(C[N@@H+]2CCCc3ccccc3C2)CC[NH2+]C1 ZINC000062946198 386534563 /nfs/dbraw/zinc/53/45/63/386534563.db2.gz PFPWCMMGWKIOPL-MRXNPFEDSA-N 2 0 244.382 2.434 20 0 BEADRP C[C@@H](CCC(F)(F)F)[NH2+]CCC[NH2+]C1CC1 ZINC000415063567 386544395 /nfs/dbraw/zinc/54/43/95/386544395.db2.gz AGUDHQFLUXMMJB-VIFPVBQESA-N 2 0 238.297 2.449 20 0 BEADRP C([NH2+][C@H]1CCCC12CCCCC2)C1C[NH2+]C1 ZINC000335462704 386545930 /nfs/dbraw/zinc/54/59/30/386545930.db2.gz UAGMGMZKFOJCBD-ZDUSSCGKSA-N 2 0 222.376 2.298 20 0 BEADRP C[C@H]([NH3+])C[N@@H+]1CC[C@@H]([C@@H]2CCCC2(C)C)C1 ZINC000647995267 386546931 /nfs/dbraw/zinc/54/69/31/386546931.db2.gz KBDZTNJYZDNYPV-XQQFMLRXSA-N 2 0 224.392 2.482 20 0 BEADRP CC1(C)CC[C@H]([NH2+][C@@H]2CCCC[NH2+]C2)C1 ZINC000415066487 386547177 /nfs/dbraw/zinc/54/71/77/386547177.db2.gz IWRHKTRGNOUUGB-NWDGAFQWSA-N 2 0 210.365 2.297 20 0 BEADRP CCCC[N@@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC000647975301 386550955 /nfs/dbraw/zinc/55/09/55/386550955.db2.gz VNNXJHPPAJRXTC-KBPBESRZSA-N 2 0 224.392 2.498 20 0 BEADRP CCC[N@@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC000647974965 386556179 /nfs/dbraw/zinc/55/61/79/386556179.db2.gz DQEKWVANEYFEFO-STQMWFEESA-N 2 0 210.365 2.108 20 0 BEADRP CC[C@H]([NH2+]C1CCC(C[NH3+])CC1)[C@H]1CCCO1 ZINC000415074626 386565451 /nfs/dbraw/zinc/56/54/51/386565451.db2.gz DAOQGSVKBNVUHZ-CLRIEMFWSA-N 2 0 240.391 2.051 20 0 BEADRP CC(C)([NH3+])C[NH2+][C@H]1CCCC[C@H]1C1CC1 ZINC000414796792 386571022 /nfs/dbraw/zinc/57/10/22/386571022.db2.gz CIPSBXBYLFYYJD-RYUDHWBXSA-N 2 0 210.365 2.282 20 0 BEADRP CO[C@H]1CCCC[C@@H]1[NH2+]C1CCC(C[NH3+])CC1 ZINC000415074376 386573842 /nfs/dbraw/zinc/57/38/42/386573842.db2.gz CKUGCHMTHJCION-HOAMVYINSA-N 2 0 240.391 2.051 20 0 BEADRP C1CC12CCC([NH2+][C@H]1CCCC[NH2+]C1)CC2 ZINC000335495829 386619316 /nfs/dbraw/zinc/61/93/16/386619316.db2.gz NQKYYESPMCRVBP-ZDUSSCGKSA-N 2 0 222.376 2.441 20 0 BEADRP C[C@H]([NH2+][C@H]1CCCC[NH2+]C1)C1CCCC1 ZINC000335497948 386623650 /nfs/dbraw/zinc/62/36/50/386623650.db2.gz BTPZLZUFFOAPGY-AAEUAGOBSA-N 2 0 210.365 2.297 20 0 BEADRP CCOc1ccccc1C[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000414924388 386623934 /nfs/dbraw/zinc/62/39/34/386623934.db2.gz KBYJASYTZZQJRS-KGLIPLIRSA-N 2 0 248.370 2.445 20 0 BEADRP CCCC[C@H](COC)[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000414924377 386624126 /nfs/dbraw/zinc/62/41/26/386624126.db2.gz KBASYSREZRFGCM-RWMBFGLXSA-N 2 0 228.380 2.051 20 0 BEADRP CC1(C)CC[C@@H]([NH2+]CC2=CC[NH2+]CC2)C1 ZINC000335499588 386625517 /nfs/dbraw/zinc/62/55/17/386625517.db2.gz HCKYUWGITXPAEY-GFCCVEGCSA-N 2 0 208.349 2.074 20 0 BEADRP CC[C@H]1C[C@@H](C[NH2+]CC([NH3+])(CC)CC)CCO1 ZINC000414810160 386627139 /nfs/dbraw/zinc/62/71/39/386627139.db2.gz NRHSOHIGSHUFNC-STQMWFEESA-N 2 0 242.407 2.299 20 0 BEADRP CC[C@@H]1C[C@@H](C[NH2+]CC([NH3+])(CC)CC)CCO1 ZINC000414810159 386627398 /nfs/dbraw/zinc/62/73/98/386627398.db2.gz NRHSOHIGSHUFNC-QWHCGFSZSA-N 2 0 242.407 2.299 20 0 BEADRP CC[C@@H]1C[C@H](C[NH2+]CC([NH3+])(CC)CC)CCO1 ZINC000414810155 386627609 /nfs/dbraw/zinc/62/76/09/386627609.db2.gz NRHSOHIGSHUFNC-CHWSQXEVSA-N 2 0 242.407 2.299 20 0 BEADRP Cc1cncc([C@@H](C)[NH2+]C2CCC([NH3+])CC2)c1 ZINC000335500234 386627562 /nfs/dbraw/zinc/62/75/62/386627562.db2.gz OLPPBHAWBKQFHG-LMWSTFAQSA-N 2 0 233.359 2.311 20 0 BEADRP C[C@@H]1CC(C)(C)C[C@H]1[NH2+]CC1=CC[NH2+]CC1 ZINC000335502113 386630034 /nfs/dbraw/zinc/63/00/34/386630034.db2.gz VUSNKGMPXMVXQC-DGCLKSJQSA-N 2 0 222.376 2.320 20 0 BEADRP CCc1ccc(CC[N@@H+]2C[C@@H](C[NH3+])C[C@H]2C)cc1 ZINC000442759903 386631142 /nfs/dbraw/zinc/63/11/42/386631142.db2.gz SPXRBCGITHWYBN-CZUORRHYSA-N 2 0 246.398 2.461 20 0 BEADRP CC(C)OCC(C)(C)[NH2+]C[C@@H]1CC[NH2+][C@@H](C)C1 ZINC000415121837 386631615 /nfs/dbraw/zinc/63/16/15/386631615.db2.gz KTHAKAIWYUQCNF-QWHCGFSZSA-N 2 0 242.407 2.168 20 0 BEADRP CC(C)([NH3+])C[NH2+][C@@H]1CCC[C@H](C2CC2)C1 ZINC000414810921 386632782 /nfs/dbraw/zinc/63/27/82/386632782.db2.gz YJLDMJNQOCBCOI-NWDGAFQWSA-N 2 0 210.365 2.282 20 0 BEADRP C1=C(C[NH2+][C@@H]2CCCC23CCC3)CC[NH2+]C1 ZINC000335506354 386636949 /nfs/dbraw/zinc/63/69/49/386636949.db2.gz YRRDWRWBNXEDDK-CYBMUJFWSA-N 2 0 220.360 2.219 20 0 BEADRP CCOC[C@H](C)[NH2+]Cc1ccc([C@@H](C)[NH3+])cc1 ZINC000414813142 386642147 /nfs/dbraw/zinc/64/21/47/386642147.db2.gz SLCCZAAYZUHQKH-NWDGAFQWSA-N 2 0 236.359 2.221 20 0 BEADRP C[C@@H]([NH3+])c1ccc(NC[C@@H]2CCC[NH2+]C2)cc1 ZINC000414813273 386642164 /nfs/dbraw/zinc/64/21/64/386642164.db2.gz QOYMVGFDBNHJPH-VXGBXAGGSA-N 2 0 233.359 2.118 20 0 BEADRP CCC([NH3+])(CC)CNCc1ccnn1C(C)C ZINC000414813225 386642721 /nfs/dbraw/zinc/64/27/21/386642721.db2.gz STXOYCDSJXWQRZ-UHFFFAOYSA-N 2 0 238.379 2.071 20 0 BEADRP C[C@H]([NH3+])c1ccc(C[NH2+]C[C@@H]2C[C@H]2C)cc1 ZINC000414814847 386649606 /nfs/dbraw/zinc/64/96/06/386649606.db2.gz OFCKIABUGURSOF-SUNKGSAMSA-N 2 0 218.344 2.452 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H](C)Cc1ccccc1F ZINC000414817221 386651872 /nfs/dbraw/zinc/65/18/72/386651872.db2.gz AGXJPOWLUMDTML-QWRGUYRKSA-N 2 0 224.323 2.084 20 0 BEADRP Cc1ccc(CC[NH2+][C@H](C)[C@@H]2CC[NH2+]C2)c(C)c1 ZINC000415085428 386601946 /nfs/dbraw/zinc/60/19/46/386601946.db2.gz IEQUUNLPLJOHHA-GDBMZVCRSA-N 2 0 246.398 2.434 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1CCC[C@H](F)C1 ZINC000520231100 386610136 /nfs/dbraw/zinc/61/01/36/386610136.db2.gz ADVSZCFDVAKCTP-GRYCIOLGSA-N 2 0 216.344 2.374 20 0 BEADRP Cc1ccc(C[NH2+]C[C@]2(C)CC[NH2+]C2)cc1F ZINC000415108027 386616467 /nfs/dbraw/zinc/61/64/67/386616467.db2.gz OMGIJRMRMNWZQZ-CQSZACIVSA-N 2 0 236.334 2.223 20 0 BEADRP C[C@@H](C[NH2+][C@@H](CN)C1CC1)c1ccc(F)cc1 ZINC000414807470 386617857 /nfs/dbraw/zinc/61/78/57/386617857.db2.gz OCGFIJJNBZSFDH-HZMBPMFUSA-N 2 0 236.334 2.256 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CC[NH2+][C@H](C)C1)c1ccccn1 ZINC000415107422 386618194 /nfs/dbraw/zinc/61/81/94/386618194.db2.gz NYVMSLGNBBZDAF-JHJVBQTASA-N 2 0 233.359 2.120 20 0 BEADRP CCSCCN(C)CCC[NH+]1CCCC1 ZINC000337222574 386663208 /nfs/dbraw/zinc/66/32/08/386663208.db2.gz FSDLMQCOUPVREM-UHFFFAOYSA-N 2 0 230.421 2.157 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+]CC[C@H](C)[NH3+] ZINC000414820213 386665373 /nfs/dbraw/zinc/66/53/73/386665373.db2.gz JEZHJHJEGZGSKG-JGVFFNPUSA-N 2 0 212.259 2.044 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H]1CCCC[C@@H]1C1CC1 ZINC000414818804 386668011 /nfs/dbraw/zinc/66/80/11/386668011.db2.gz FYSMGUUPHMKGBN-CYZMBNFOSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@H]1CCC[C@H](C2CC2)C1 ZINC000414825138 386688499 /nfs/dbraw/zinc/68/84/99/386688499.db2.gz SANZXOQVZJTACX-DRZSPHRISA-N 2 0 210.365 2.282 20 0 BEADRP Cc1cccc(C[NH2+]CC[C@@H]2CC[NH2+]C2)c1C ZINC000414826688 386688904 /nfs/dbraw/zinc/68/89/04/386688904.db2.gz GARVLDVOOGZQDY-AWEZNQCLSA-N 2 0 232.371 2.393 20 0 BEADRP C[C@H](C[NH3+])NCc1ccc(-c2ccccc2)o1 ZINC000414927588 386692038 /nfs/dbraw/zinc/69/20/38/386692038.db2.gz LPVKOOBRAPTBQK-LLVKDONJSA-N 2 0 230.311 2.383 20 0 BEADRP C[NH+](C)CC1CC[NH+](Cc2cccc(N)c2)CC1 ZINC000042388537 386693713 /nfs/dbraw/zinc/69/37/13/386693713.db2.gz JJXLYPIZVSZQDE-UHFFFAOYSA-N 2 0 247.386 2.042 20 0 BEADRP C[C@@H]1CCC[C@@H](C[NH2+]CC[C@@H]2CC[NH2+]C2)C1 ZINC000414827587 386694639 /nfs/dbraw/zinc/69/46/39/386694639.db2.gz HJPQBBDRQOITIM-HZSPNIEDSA-N 2 0 224.392 2.402 20 0 BEADRP COC[C@H](CC(C)C)[NH2+][C@H](C)[C@@H]1CCC[NH2+]C1 ZINC000414826203 386695371 /nfs/dbraw/zinc/69/53/71/386695371.db2.gz VDYFEDVHYVIHMY-MCIONIFRSA-N 2 0 242.407 2.025 20 0 BEADRP Fc1ccc(/C=C\C[NH2+]CC[C@H]2CC[NH2+]C2)cc1 ZINC000414828943 386701545 /nfs/dbraw/zinc/70/15/45/386701545.db2.gz JYUDVCCPKQKLAK-BOPNBLERSA-N 2 0 248.345 2.428 20 0 BEADRP Fc1cc(F)cc(C[NH2+]CC[C@H]2CC[NH2+]C2)c1 ZINC000414829175 386701995 /nfs/dbraw/zinc/70/19/95/386701995.db2.gz KIJBIHWVKWJZRZ-SNVBAGLBSA-N 2 0 240.297 2.054 20 0 BEADRP Fc1ccc(/C=C\C[NH2+]CC[C@@H]2CC[NH2+]C2)cc1 ZINC000414828945 386702373 /nfs/dbraw/zinc/70/23/73/386702373.db2.gz JYUDVCCPKQKLAK-DDGIKZQJSA-N 2 0 248.345 2.428 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]Cc1cccc(Cl)c1 ZINC000414829073 386702653 /nfs/dbraw/zinc/70/26/53/386702653.db2.gz AJJKXLXZBDGNJV-SNVBAGLBSA-N 2 0 226.751 2.285 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000414831585 386706305 /nfs/dbraw/zinc/70/63/05/386706305.db2.gz NGIATSBXRZSRMJ-AGIUHOORSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H](C[NH2+]CC[C@@H]1CC[NH2+]C1)c1ccccc1 ZINC000414830397 386706561 /nfs/dbraw/zinc/70/65/61/386706561.db2.gz LYZMTDYEPLMDKF-ZIAGYGMSSA-N 2 0 232.371 2.379 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]Cc1coc2ccccc12 ZINC000414831305 386708557 /nfs/dbraw/zinc/70/85/57/386708557.db2.gz CVYRQRLHJSTMPR-NSHDSACASA-N 2 0 232.327 2.378 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]C/C=C/c1ccccc1 ZINC000414830762 386708586 /nfs/dbraw/zinc/70/85/86/386708586.db2.gz CKGODURFDLENPY-YSKGHYERSA-N 2 0 218.344 2.145 20 0 BEADRP Cc1ccc(C[N@H+]2C[C@H](C[NH3+])C[C@@H]2C)cc1 ZINC000122316946 386740514 /nfs/dbraw/zinc/74/05/14/386740514.db2.gz VYKQNWNZIKLTBF-JSGCOSHPSA-N 2 0 218.344 2.164 20 0 BEADRP COC[C@H](CC(C)C)[NH2+][C@H](CN)CC(C)C ZINC000414836714 386731102 /nfs/dbraw/zinc/73/11/02/386731102.db2.gz IXIFYKWKYDTXIB-STQMWFEESA-N 2 0 230.396 2.011 20 0 BEADRP C(C[C@@H]1CC[NH2+]C1)[NH2+][C@H]1CCC[C@@H]1C1CC1 ZINC000414833756 386713773 /nfs/dbraw/zinc/71/37/73/386713773.db2.gz QAXOQTVIMOEPTI-YUTCNCBUSA-N 2 0 222.376 2.154 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H]1CCC[C@@H]1C1CC1 ZINC000414832178 386718251 /nfs/dbraw/zinc/71/82/51/386718251.db2.gz FAFCOMXZRHJONC-UHTWSYAYSA-N 2 0 210.365 2.010 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CC[C@H](C)[C@H](C)C1 ZINC000414834129 386719288 /nfs/dbraw/zinc/71/92/88/386719288.db2.gz GYEDKRQJUXPWEQ-WUHRBBMRSA-N 2 0 212.381 2.256 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C2CCC3(CC3)CC2)CC[NH2+]1 ZINC000335540282 386719802 /nfs/dbraw/zinc/71/98/02/386719802.db2.gz ZZWWUXWHZMFRNT-YPMHNXCESA-N 2 0 222.376 2.439 20 0 BEADRP Cc1cc(C)cc(C[NH2+]CC[C@@H]2CC[NH2+]C2)c1 ZINC000414834890 386722645 /nfs/dbraw/zinc/72/26/45/386722645.db2.gz RCWFFMCKFUDZTN-AWEZNQCLSA-N 2 0 232.371 2.393 20 0 BEADRP c1ccc2c(c1)CC[C@@H]([NH2+]CC[C@H]1CC[NH2+]C1)C2 ZINC000414834286 386722914 /nfs/dbraw/zinc/72/29/14/386722914.db2.gz QNQNCJCIINGDAM-CZUORRHYSA-N 2 0 244.382 2.133 20 0 BEADRP Cc1cc(F)ccc1C[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000414835251 386728541 /nfs/dbraw/zinc/72/85/41/386728541.db2.gz RIACZLHYZXRFAU-LBPRGKRZSA-N 2 0 236.334 2.223 20 0 BEADRP C(=C/c1ccccc1)\C[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000414836248 386728671 /nfs/dbraw/zinc/72/86/71/386728671.db2.gz URFSZMHTHFXMGO-LWUPOJRFSA-N 2 0 230.355 2.289 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H](C)CCC(F)(F)F ZINC000414839738 386745425 /nfs/dbraw/zinc/74/54/25/386745425.db2.gz MOWRJAMVIJLKOF-BDAKNGLRSA-N 2 0 226.286 2.163 20 0 BEADRP CC1(C)CCC[C@@H]1[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000414839378 386743268 /nfs/dbraw/zinc/74/32/68/386743268.db2.gz WGDGBJUUYAKZJJ-RYUDHWBXSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@@H]1CC2CCC1CC2 ZINC000336744051 386794974 /nfs/dbraw/zinc/79/49/74/386794974.db2.gz YUZQGSGXEZPPLU-YWPUVAFDSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)C[C@H](C)[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000336666810 386775609 /nfs/dbraw/zinc/77/56/09/386775609.db2.gz DRSRBFQTJTYXEU-STQMWFEESA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+][C@@H]1CC[NH2+]C[C@@H]1C ZINC000414933273 386788075 /nfs/dbraw/zinc/78/80/75/386788075.db2.gz DLNKPLWWVPATLC-IVZWLZJFSA-N 2 0 238.297 2.305 20 0 BEADRP C[NH+](C)[C@@H]1CCC[C@H]([NH2+][C@@H]2COC(C)(C)C2)C1 ZINC000417959257 386823969 /nfs/dbraw/zinc/82/39/69/386823969.db2.gz LPGYIAOLQDSPCB-RWMBFGLXSA-N 2 0 240.391 2.016 20 0 BEADRP CC[C@H](CSC)[NH2+][C@H]1CN(CC)C[C@H]1C ZINC000336762003 386800601 /nfs/dbraw/zinc/80/06/01/386800601.db2.gz NIPZYGBEDSQWKQ-UTUOFQBUSA-N 2 0 230.421 2.058 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCc2ccccc21)C[NH+](C)C ZINC000293303830 386813090 /nfs/dbraw/zinc/81/30/90/386813090.db2.gz DURDTMUZBCXRBN-IUODEOHRSA-N 2 0 232.371 2.461 20 0 BEADRP CC(C)c1ccc([C@@H]([NH3+])CNCC(C)(C)[NH3+])cc1 ZINC000414846652 386816184 /nfs/dbraw/zinc/81/61/84/386816184.db2.gz NTANBTWFGJHEAT-AWEZNQCLSA-N 2 0 249.402 2.137 20 0 BEADRP C[C@H](CCCCO)[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000398538511 386836267 /nfs/dbraw/zinc/83/62/67/386836267.db2.gz UBZKTNSUIGXBNT-KCPJHIHWSA-N 2 0 248.370 2.272 20 0 BEADRP C[C@H](CCCCO)[NH2+][C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000398538513 386836566 /nfs/dbraw/zinc/83/65/66/386836566.db2.gz UBZKTNSUIGXBNT-UGFHNGPFSA-N 2 0 248.370 2.272 20 0 BEADRP CS[C@@H]1CC[C@H]1[NH2+]C[C@@H](C)C[NH+]1CCCC1 ZINC000425340151 386839920 /nfs/dbraw/zinc/83/99/20/386839920.db2.gz DLYDFDFLBIASPX-JHJVBQTASA-N 2 0 242.432 2.202 20 0 BEADRP C[C@H]1Cc2ccccc2C[N@@H+]1CC[C@@H]1CC[NH2+]C1 ZINC000334784449 386841844 /nfs/dbraw/zinc/84/18/44/386841844.db2.gz MDDJVTCGPAZOEP-KBPBESRZSA-N 2 0 244.382 2.433 20 0 BEADRP CC[C@@H](C)[C@H](C)[N@H+](CCC[NH2+]C)C1CC1 ZINC000336674210 386841806 /nfs/dbraw/zinc/84/18/06/386841806.db2.gz KBVBWKQULVASRN-NEPJUHHUSA-N 2 0 212.381 2.495 20 0 BEADRP CS[C@H]1CC[C@H]1[NH2+]CCCC[N@H+](C)C1CC1 ZINC000425340273 386841833 /nfs/dbraw/zinc/84/18/33/386841833.db2.gz ADDNZANJGNKEFR-OLZOCXBDSA-N 2 0 242.432 2.344 20 0 BEADRP [NH3+]C[C@@H]1CC[N@H+](Cc2cc3cc(F)ccc3o2)C1 ZINC000334784859 386845283 /nfs/dbraw/zinc/84/52/83/386845283.db2.gz DHEQWBFMELFNHI-JTQLQIEISA-N 2 0 248.301 2.353 20 0 BEADRP CCSCCC[NH2+][C@H](C)[C@@H]1CCCC[NH2+]1 ZINC000395078386 386847205 /nfs/dbraw/zinc/84/72/05/386847205.db2.gz NMPHQRODYMNBGT-NEPJUHHUSA-N 2 0 230.421 2.250 20 0 BEADRP C[C@@H](C[NH3+])N(C)c1cc[nH+]c2ccccc21 ZINC000125495731 386847510 /nfs/dbraw/zinc/84/75/10/386847510.db2.gz PAUYXVJVNZIUPU-JTQLQIEISA-N 2 0 215.300 2.018 20 0 BEADRP C[C@H](C[NH3+])N(C)c1cc[nH+]c2ccccc21 ZINC000125495973 386848110 /nfs/dbraw/zinc/84/81/10/386848110.db2.gz PAUYXVJVNZIUPU-SNVBAGLBSA-N 2 0 215.300 2.018 20 0 BEADRP CCCCOc1ccccc1CN[C@H](C)C[NH3+] ZINC000414938730 386855096 /nfs/dbraw/zinc/85/50/96/386855096.db2.gz XWRPGHMEXAWTTE-GFCCVEGCSA-N 2 0 236.359 2.302 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@@H]1CC[C@@H](C)C[C@@H]1C ZINC000414937897 386857198 /nfs/dbraw/zinc/85/71/98/386857198.db2.gz CTFAYSLCCXFWMZ-YVECIDJPSA-N 2 0 212.381 2.399 20 0 BEADRP CC[C@H]([NH2+][C@H]1CCCC[C@H]1C[NH3+])C1CC1 ZINC000324313613 386871764 /nfs/dbraw/zinc/87/17/64/386871764.db2.gz NASPJRMKEDEWDP-AVGNSLFASA-N 2 0 210.365 2.282 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCCC[C@H]1C[NH3+])C1CC1 ZINC000324313615 386872182 /nfs/dbraw/zinc/87/21/82/386872182.db2.gz NASPJRMKEDEWDP-RWMBFGLXSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CCCC2(C)C)CC[NH2+]1 ZINC000414939936 386874040 /nfs/dbraw/zinc/87/40/40/386874040.db2.gz BKUGRDWJBHIVLM-UTUOFQBUSA-N 2 0 210.365 2.295 20 0 BEADRP Cc1cc(C[NH2+]C2(C)CC[NH2+]CC2)ccc1F ZINC000334845638 386895039 /nfs/dbraw/zinc/89/50/39/386895039.db2.gz ZHEQCDFBKLWDMX-UHFFFAOYSA-N 2 0 236.334 2.366 20 0 BEADRP Cc1ccc(F)cc1C[NH2+][C@H]1CC[NH2+]C[C@H]1C ZINC000334859679 386913825 /nfs/dbraw/zinc/91/38/25/386913825.db2.gz ZXHQTXOXTWHVNW-RISCZKNCSA-N 2 0 236.334 2.222 20 0 BEADRP CC1(C)CCC[NH2+][C@H]1C[NH2+]C1CCSCC1 ZINC000334862350 386915459 /nfs/dbraw/zinc/91/54/59/386915459.db2.gz KJKBXRRTKRIDNV-LBPRGKRZSA-N 2 0 242.432 2.250 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]Cc2ccc(F)cc2)CC[NH2+]1 ZINC000334862403 386917274 /nfs/dbraw/zinc/91/72/74/386917274.db2.gz LCXGDWZCOBJYDQ-ZWNOBZJWSA-N 2 0 222.307 2.056 20 0 BEADRP Fc1cccc2c1CC[C@H]2[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000334862418 386917486 /nfs/dbraw/zinc/91/74/86/386917486.db2.gz LIIKPFAYKZAHGM-XHDPSFHLSA-N 2 0 248.345 2.402 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CC[NH2+][C@H](C)C2)s1 ZINC000334863363 386917583 /nfs/dbraw/zinc/91/75/83/386917583.db2.gz NUQWBBMKPNWXQA-MWLCHTKSSA-N 2 0 224.373 2.287 20 0 BEADRP CC(C)C1CCC([NH2+][C@@H]2[C@H]3C[NH2+]C[C@H]32)CC1 ZINC000334849077 386898585 /nfs/dbraw/zinc/89/85/85/386898585.db2.gz VCKIQESDIFGEKS-TWASESMYSA-N 2 0 222.376 2.009 20 0 BEADRP Cc1ccc(CC[NH2+][C@H]2CC[N@@H+](C)C[C@H]2C)cc1 ZINC000358158250 386902727 /nfs/dbraw/zinc/90/27/27/386902727.db2.gz NKOPDLWPCXJRTE-ZBFHGGJFSA-N 2 0 246.398 2.467 20 0 BEADRP CCc1ccccc1CN1CCC[NH2+]CC1 ZINC000052204648 386903427 /nfs/dbraw/zinc/90/34/27/386903427.db2.gz WUBWYEMHHWCKMI-UHFFFAOYSA-N 2 0 218.344 2.044 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CC[NH2+]C[C@@H]2C)cc1F ZINC000334858393 386911465 /nfs/dbraw/zinc/91/14/65/386911465.db2.gz SHNZKRHZWWMLEX-SMDDNHRTSA-N 2 0 236.334 2.222 20 0 BEADRP Cc1ccc(C)c(C[NH2+][C@H]2CC[NH2+]C[C@H]2C)c1 ZINC000334859359 386913373 /nfs/dbraw/zinc/91/33/73/386913373.db2.gz YSEFFPUZBZLVNS-HIFRSBDPSA-N 2 0 232.371 2.391 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+][C@H]1CN(C)C[C@H]1C ZINC000358390332 386946933 /nfs/dbraw/zinc/94/69/33/386946933.db2.gz BXJZLSAGVJSFHN-BZPMIXESSA-N 2 0 236.359 2.140 20 0 BEADRP Cc1cc(F)ccc1C[NH2+][C@H]1CC[NH2+][C@@H](C)C1 ZINC000334865322 386922069 /nfs/dbraw/zinc/92/20/69/386922069.db2.gz SIVQNLGDMOOZNW-FZMZJTMJSA-N 2 0 236.334 2.364 20 0 BEADRP Cc1cccc(C[NH2+][C@@H]2CC[NH2+][C@@H](C)C2)c1 ZINC000334865143 386922382 /nfs/dbraw/zinc/92/23/82/386922382.db2.gz QZDOZDWIFPADBG-GXTWGEPZSA-N 2 0 218.344 2.225 20 0 BEADRP CC(C)C[N@@H+]1CCCC[C@H]1[C@@H]1CC[NH2+]C1 ZINC000334867368 386926223 /nfs/dbraw/zinc/92/62/23/386926223.db2.gz CVXUKJKHQOJTEK-OLZOCXBDSA-N 2 0 210.365 2.106 20 0 BEADRP CC1CCC([NH2+][C@H]2CC[NH2+][C@H](C)C2)CC1 ZINC000334867463 386926990 /nfs/dbraw/zinc/92/69/90/386926990.db2.gz GAZAVGXSJNBHAV-KPFVRQRISA-N 2 0 210.365 2.295 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+][C@@H]2CCCC[C@H]2O)c2ccccc21 ZINC000331932937 386928097 /nfs/dbraw/zinc/92/80/97/386928097.db2.gz IOQNHHSXIVDSAY-GBJTYRQASA-N 2 0 246.354 2.024 20 0 BEADRP C[C@@]1(C[NH2+]C2Cc3ccccc3C2)CCC[NH2+]C1 ZINC000334875841 386936447 /nfs/dbraw/zinc/93/64/47/386936447.db2.gz UQXIMQDZTANDCN-MRXNPFEDSA-N 2 0 244.382 2.133 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H]1CC[C@H]1SC ZINC000425356538 386967966 /nfs/dbraw/zinc/96/79/66/386967966.db2.gz PLZLLVFKSYPWGO-VXGBXAGGSA-N 2 0 230.421 2.202 20 0 BEADRP CS[C@H]1CC[C@H]1[NH2+]CCC[NH+]1CCCCC1 ZINC000425363010 386971519 /nfs/dbraw/zinc/97/15/19/386971519.db2.gz WFKKQDPTYQOXTJ-OLZOCXBDSA-N 2 0 242.432 2.346 20 0 BEADRP COc1cccc(CCC[NH+]2CCC([NH3+])CC2)c1 ZINC000011729490 386990674 /nfs/dbraw/zinc/99/06/74/386990674.db2.gz DQHUHOKGNYUTJU-UHFFFAOYSA-N 2 0 248.370 2.051 20 0 BEADRP CSC1(C[N@@H+]2CCC[C@@H]([NH+](C)C)CC2)CC1 ZINC000367317257 386991905 /nfs/dbraw/zinc/99/19/05/386991905.db2.gz JGDWBFHHAGTCBX-GFCCVEGCSA-N 2 0 242.432 2.298 20 0 BEADRP CN(Cc1ccc2c(c1)CCC2)[C@@H](C[NH3+])C1CC1 ZINC000160042488 387040768 /nfs/dbraw/zinc/04/07/68/387040768.db2.gz VUBGBFSPYDFGPP-INIZCTEOSA-N 2 0 244.382 2.344 20 0 BEADRP C[C@@]1(C[NH+](CC2CC2)CC2CC2)CC[NH2+]C1 ZINC000070064385 387042798 /nfs/dbraw/zinc/04/27/98/387042798.db2.gz CRAKSIIXRQZIJP-CQSZACIVSA-N 2 0 222.376 2.108 20 0 BEADRP C[C@@H](C[NH+]1CCC2(CC[NH2+]2)CC1)C(C)(C)C ZINC000643427613 387028498 /nfs/dbraw/zinc/02/84/98/387028498.db2.gz OIEZLPRUHZWLHM-LBPRGKRZSA-N 2 0 224.392 2.497 20 0 BEADRP C(C1CCC1)[N@@H+]1CCCC[C@H]1[C@H]1CC[NH2+]C1 ZINC000334983475 387070101 /nfs/dbraw/zinc/07/01/01/387070101.db2.gz MRKFJDNIHQLZGQ-KBPBESRZSA-N 2 0 222.376 2.251 20 0 BEADRP COCc1cccc(C[N@@H+]2CC[C@H]([C@@H](C)[NH3+])C2)c1 ZINC000126930337 387074234 /nfs/dbraw/zinc/07/42/34/387074234.db2.gz SABPAEWTOLOIJM-DOMZBBRYSA-N 2 0 248.370 2.002 20 0 BEADRP CCC[C@H](C)[C@H](CC)[NH2+]C[C@H](C)C[NH3+] ZINC000423299158 387130717 /nfs/dbraw/zinc/13/07/17/387130717.db2.gz PLIHWRKUJQIUIS-WOPDTQHZSA-N 2 0 200.370 2.386 20 0 BEADRP CC[C@@H]([NH2+]CC1CC[NH2+]CC1)c1nccs1 ZINC000070733281 387091069 /nfs/dbraw/zinc/09/10/69/387091069.db2.gz GHOOLVLXEBFWMH-LLVKDONJSA-N 2 0 239.388 2.183 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+]C1CCC(C(F)F)CC1 ZINC000335004047 387096776 /nfs/dbraw/zinc/09/67/76/387096776.db2.gz AIELBXVYDMTZMQ-HBIQZDMRSA-N 2 0 246.345 2.398 20 0 BEADRP CC(C)C1CC([NH2+][C@H]2CC[NH2+]C[C@@H]2C)C1 ZINC000335004461 387098714 /nfs/dbraw/zinc/09/87/14/387098714.db2.gz DCMGDUZAEWCTFX-WTIISPKJSA-N 2 0 210.365 2.009 20 0 BEADRP CC1(F)CC([NH2+][C@H]2CCCCC[C@H]2[NH3+])C1 ZINC000335004822 387099407 /nfs/dbraw/zinc/09/94/07/387099407.db2.gz GNOOHVCJVUYLLJ-UPOSSJBDSA-N 2 0 214.328 2.127 20 0 BEADRP C[C@H]([NH2+]C1CCC2(CC2)CC1)[C@@H]1CCC[NH2+]1 ZINC000335010068 387105395 /nfs/dbraw/zinc/10/53/95/387105395.db2.gz MSPACGURZKSVRC-AAEUAGOBSA-N 2 0 222.376 2.439 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H]2CC[C@@H](OC)C2)CC1 ZINC000188817793 387105436 /nfs/dbraw/zinc/10/54/36/387105436.db2.gz MGCBSLNPGAJOTL-ZIAGYGMSSA-N 2 0 240.391 2.018 20 0 BEADRP FC(F)(F)[C@@H]1CCC[C@H]([NH2+][C@H]2CC[NH2+]C2)C1 ZINC000250667703 387120970 /nfs/dbraw/zinc/12/09/70/387120970.db2.gz SJVXEZYSOZHYDR-UTLUCORTSA-N 2 0 236.281 2.059 20 0 BEADRP Cc1cc(C[NH2+][C@H]2CC[NH2+]CC[C@H]2C)cc(C)n1 ZINC000335029121 387122994 /nfs/dbraw/zinc/12/29/94/387122994.db2.gz NHVQBHUAMXAIHK-ABAIWWIYSA-N 2 0 247.386 2.176 20 0 BEADRP Cc1ccc(CC[C@@H](C)[NH2+]CC2C[NH2+]C2)cc1 ZINC000423300521 387132255 /nfs/dbraw/zinc/13/22/55/387132255.db2.gz FCRWLODICAMIKR-CYBMUJFWSA-N 2 0 232.371 2.125 20 0 BEADRP CC1(C[NH2+][C@H]2CCCCC[C@@H]2[NH3+])CCC1 ZINC000335031796 387127113 /nfs/dbraw/zinc/12/71/13/387127113.db2.gz IVCWHDVICFPXCC-RYUDHWBXSA-N 2 0 210.365 2.426 20 0 BEADRP CC[C@@H](Cc1ccc(C)cc1)[NH2+]CC1C[NH2+]C1 ZINC000423299030 387129172 /nfs/dbraw/zinc/12/91/72/387129172.db2.gz ASMAIHDLBMZNIB-HNNXBMFYSA-N 2 0 232.371 2.125 20 0 BEADRP Cc1ccc([C@H]2CCC[C@@H]2[NH2+]CC2C[NH2+]C2)cc1 ZINC000423298757 387129222 /nfs/dbraw/zinc/12/92/22/387129222.db2.gz AFYDAFMHLXTROT-CVEARBPZSA-N 2 0 244.382 2.440 20 0 BEADRP COc1ccc2c(c1)[C@H]([NH2+]C[C@H](C)C[NH3+])CCC2 ZINC000423299662 387130052 /nfs/dbraw/zinc/13/00/52/387130052.db2.gz QJJIIBHNFMCLKT-IAQYHMDHSA-N 2 0 248.370 2.257 20 0 BEADRP CC(C)C[C@@H](C)C[C@H](C)[NH2+]CC1C[NH2+]C1 ZINC000423308747 387143797 /nfs/dbraw/zinc/14/37/97/387143797.db2.gz YGFAEYZJSZHEQQ-NEPJUHHUSA-N 2 0 212.381 2.256 20 0 BEADRP Fc1ccc([C@@H]([NH2+]CC2C[NH2+]C2)C2CC2)cc1 ZINC000423307396 387144267 /nfs/dbraw/zinc/14/42/67/387144267.db2.gz VXLVPUBXJVRHDR-AWEZNQCLSA-N 2 0 234.318 2.086 20 0 BEADRP CCC[NH2+]CC[NH2+][C@H](C)C1CCSCC1 ZINC000423307948 387144423 /nfs/dbraw/zinc/14/44/23/387144423.db2.gz IIXHJUOMCMBXFN-LLVKDONJSA-N 2 0 230.421 2.107 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H]1CCCc2cc(F)ccc21 ZINC000423308124 387144480 /nfs/dbraw/zinc/14/44/80/387144480.db2.gz NXLPTCXTWSSUDX-QMTHXVAHSA-N 2 0 236.334 2.388 20 0 BEADRP C[C@@H](F)CC[N@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000353152870 387145882 /nfs/dbraw/zinc/14/58/82/387145882.db2.gz JIGMYRSTGGQOEQ-FKJOKYEKSA-N 2 0 228.355 2.292 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H](C)c1cccc(F)c1F ZINC000423310019 387146524 /nfs/dbraw/zinc/14/65/24/387146524.db2.gz RCTMCBVMZVSSGD-RKDXNWHRSA-N 2 0 228.286 2.210 20 0 BEADRP CCC[NH2+]CC[NH2+][C@H]1CC[C@H]1C(C)(C)C ZINC000423309028 387147309 /nfs/dbraw/zinc/14/73/09/387147309.db2.gz KUGCHSQSZAXCCI-NEPJUHHUSA-N 2 0 212.381 2.400 20 0 BEADRP [NH3+][C@@H](C[NH2+][C@@H]1CCCC12CCCC2)C1CC1 ZINC000423310687 387148821 /nfs/dbraw/zinc/14/88/21/387148821.db2.gz ARPKBSQVPLZASF-QWHCGFSZSA-N 2 0 222.376 2.426 20 0 BEADRP [NH3+][C@@H](C[NH2+]C1CCC(C(F)F)CC1)C1CC1 ZINC000423312856 387151096 /nfs/dbraw/zinc/15/10/96/387151096.db2.gz DWBBHEIPWXIOQB-ILDUYXDCSA-N 2 0 232.318 2.137 20 0 BEADRP Cc1c([C@@H](C)[NH2+]C[C@@H](C)C[NH3+])cnn1C(C)C ZINC000423313243 387151854 /nfs/dbraw/zinc/15/18/54/387151854.db2.gz WQRCTPDLTBOXAH-WDEREUQCSA-N 2 0 238.379 2.018 20 0 BEADRP CCC[C@H]([NH2+]C[C@@H](C)C[NH3+])c1ccccn1 ZINC000423313269 387152164 /nfs/dbraw/zinc/15/21/64/387152164.db2.gz WTAIOVWJJJQNST-RYUDHWBXSA-N 2 0 221.348 2.107 20 0 BEADRP CC(C)[C@H]1CCC[C@H]([NH2+]C[C@H](C)C[NH3+])C1 ZINC000423312956 387152336 /nfs/dbraw/zinc/15/23/36/387152336.db2.gz VVKCYCSMMMYRQB-AGIUHOORSA-N 2 0 212.381 2.386 20 0 BEADRP [NH3+][C@@H](C[NH2+][C@H](Cc1ccccc1)C1CC1)C1CC1 ZINC000423315188 387154600 /nfs/dbraw/zinc/15/46/00/387154600.db2.gz IQPRHBCZNWNTJI-JKSUJKDBSA-N 2 0 244.382 2.335 20 0 BEADRP CC(C)CC[C@H]([NH2+]CC1C[NH2+]C1)C1CC1 ZINC000423314835 387155041 /nfs/dbraw/zinc/15/50/41/387155041.db2.gz HWEUQVGLOSRSAE-ZDUSSCGKSA-N 2 0 210.365 2.010 20 0 BEADRP CC[C@@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)C(C)C ZINC000423318661 387158704 /nfs/dbraw/zinc/15/87/04/387158704.db2.gz CUIGTRSULLEHIS-CHWSQXEVSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]Cc1cc(F)c(F)c(F)c1 ZINC000571762295 387163338 /nfs/dbraw/zinc/16/33/38/387163338.db2.gz GGMPURCQBQJZEU-JGVFFNPUSA-N 2 0 246.276 2.319 20 0 BEADRP CC(C)[C@H]([NH2+]CCCC[NH3+])c1ccc(F)cn1 ZINC000423323480 387168270 /nfs/dbraw/zinc/16/82/70/387168270.db2.gz JMNNBSTZIJMQRU-ZDUSSCGKSA-N 2 0 239.338 2.246 20 0 BEADRP Cc1ccncc1[C@@H](C)[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000423324198 387168348 /nfs/dbraw/zinc/16/83/48/387168348.db2.gz AUCHGCAISRRIRV-UKRRQHHQSA-N 2 0 247.386 2.430 20 0 BEADRP C[C@H](Cc1ccc(F)cc1)[NH2+]CC1=CC[NH2+]CC1 ZINC000423329517 387172764 /nfs/dbraw/zinc/17/27/64/387172764.db2.gz BGHBVIWXBLAHQO-GFCCVEGCSA-N 2 0 248.345 2.266 20 0 BEADRP C[C@@H](Cc1ccoc1)[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000423330485 387176483 /nfs/dbraw/zinc/17/64/83/387176483.db2.gz GAWBWIARFOCWBV-GXTWGEPZSA-N 2 0 236.359 2.190 20 0 BEADRP Cc1ccccc1C[C@H]([NH2+]CC1C[NH2+]C1)C1CC1 ZINC000423333160 387177320 /nfs/dbraw/zinc/17/73/20/387177320.db2.gz VMJXLXUWKXLABJ-INIZCTEOSA-N 2 0 244.382 2.125 20 0 BEADRP CC(C)C(C[NH2+]CCC[NH+](C)C)C(C)C ZINC000229551671 387177683 /nfs/dbraw/zinc/17/76/83/387177683.db2.gz VBSGFDPAGNNJTL-UHFFFAOYSA-N 2 0 214.397 2.456 20 0 BEADRP CC[C@H]([NH2+]CC1(C)CC[NH2+]CC1)[C@@H]1C[C@@H]1C ZINC000423332740 387178731 /nfs/dbraw/zinc/17/87/31/387178731.db2.gz PHJGNZNPXVMKDN-XQQFMLRXSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CCC[C@@H]2C[NH+](C)CC[C@H]21 ZINC000571842979 387180583 /nfs/dbraw/zinc/18/05/83/387180583.db2.gz YUXDJVKZWFCMJM-AAVRWANBSA-N 2 0 222.376 2.059 20 0 BEADRP C[C@@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)C1(C)CC1 ZINC000423334788 387180972 /nfs/dbraw/zinc/18/09/72/387180972.db2.gz RFEFLVCQOOUMRW-VXGBXAGGSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CCC[C@@H]2C[NH+](C)CC[C@@H]21 ZINC000571842984 387180992 /nfs/dbraw/zinc/18/09/92/387180992.db2.gz YUXDJVKZWFCMJM-SYQHCUMBSA-N 2 0 222.376 2.059 20 0 BEADRP CC(C)[C@H]1CCC[C@H]1[NH2+]CC1=CC[NH2+]CC1 ZINC000423337981 387185037 /nfs/dbraw/zinc/18/50/37/387185037.db2.gz HWMLHEZSSDAHQD-ZIAGYGMSSA-N 2 0 222.376 2.320 20 0 BEADRP C[C@@H]1CCC[C@@H](C)C1[NH2+]C[C@H]([NH3+])C1CC1 ZINC000423339283 387187582 /nfs/dbraw/zinc/18/75/82/387187582.db2.gz ZMEMOJQURZFHJW-FOGDFJRCSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H]1CCC[C@H](C)[C@H]1[NH2+]C[C@H]([NH3+])C1CC1 ZINC000423339284 387188857 /nfs/dbraw/zinc/18/88/57/387188857.db2.gz ZMEMOJQURZFHJW-JULQROHOSA-N 2 0 210.365 2.138 20 0 BEADRP CCC1(CC)[C@H]([NH2+]CCCC[NH3+])[C@H](C)[C@@H]1OC ZINC000423341854 387189694 /nfs/dbraw/zinc/18/96/94/387189694.db2.gz YDMHTEILQNLIAE-XQQFMLRXSA-N 2 0 242.407 2.155 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]C1CCc2ccccc2CC1 ZINC000423300669 387132755 /nfs/dbraw/zinc/13/27/55/387132755.db2.gz DUMMUXQKUVYTEE-GFCCVEGCSA-N 2 0 232.371 2.118 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@H]1CCCOc2ccccc21 ZINC000423301168 387132833 /nfs/dbraw/zinc/13/28/33/387132833.db2.gz SQPBPNMUQCYBED-AAEUAGOBSA-N 2 0 234.343 2.085 20 0 BEADRP CCC[C@H]([NH2+]C[C@@H](C)C[NH3+])C(C)(C)C ZINC000423302341 387134089 /nfs/dbraw/zinc/13/40/89/387134089.db2.gz HDYSKEBIIOAASR-QWRGUYRKSA-N 2 0 200.370 2.386 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H](Cc1ccccc1)C1CC1 ZINC000423302867 387135114 /nfs/dbraw/zinc/13/51/14/387135114.db2.gz WDRWGJOWWFVCHZ-DOMZBBRYSA-N 2 0 232.371 2.192 20 0 BEADRP CC[C@@H]1C[C@H](C)CC[C@H]1[NH2+]C[C@@H](C)C[NH3+] ZINC000423301802 387135239 /nfs/dbraw/zinc/13/52/39/387135239.db2.gz GNJPRYDJPZNAGJ-YVECIDJPSA-N 2 0 212.381 2.386 20 0 BEADRP COc1ccc([C@@H](C)[NH2+]C[C@@H](C)C[NH3+])c(F)c1 ZINC000423303907 387137372 /nfs/dbraw/zinc/13/73/72/387137372.db2.gz XQLXONZVJHFBEH-VHSXEESVSA-N 2 0 240.322 2.080 20 0 BEADRP CCc1ccc([C@H](C)[NH2+]CC2C[NH2+]C2)cc1 ZINC000423303628 387137496 /nfs/dbraw/zinc/13/74/96/387137496.db2.gz MCVVBFVBBKWEIE-NSHDSACASA-N 2 0 218.344 2.119 20 0 BEADRP Cc1cc([C@H](C)[NH2+]CC2C[NH2+]C2)c(C)s1 ZINC000423304496 387139251 /nfs/dbraw/zinc/13/92/51/387139251.db2.gz ODZUKYGXBJOOQP-VIFPVBQESA-N 2 0 224.373 2.235 20 0 BEADRP c1ccc([C@@H]2CC[C@H]([NH2+]CC3C[NH2+]C3)C2)cc1 ZINC000423304410 387139630 /nfs/dbraw/zinc/13/96/30/387139630.db2.gz NUJYCFYHQDHZIC-CABCVRRESA-N 2 0 230.355 2.132 20 0 BEADRP CCC[NH2+]CC[NH2+][C@@H]1C[C@@H](C)CC[C@H]1C ZINC000423305460 387139809 /nfs/dbraw/zinc/13/98/09/387139809.db2.gz BZYUVRFELLVELG-YNEHKIRRSA-N 2 0 212.381 2.400 20 0 BEADRP CCC[NH2+]CC[NH2+][C@@H]1CCC[C@@H]1CCCF ZINC000423305380 387140226 /nfs/dbraw/zinc/14/02/26/387140226.db2.gz BNFHOWFUXRKNDE-CHWSQXEVSA-N 2 0 230.371 2.494 20 0 BEADRP c1ccc2c(c1)CCC[C@H]([NH2+]C1CC[NH2+]CC1)C2 ZINC000643496301 387206666 /nfs/dbraw/zinc/20/66/66/387206666.db2.gz QMQRZQLESQJUHN-INIZCTEOSA-N 2 0 244.382 2.276 20 0 BEADRP Cc1cc(C)c(CN[C@H](C)C[NH3+])c(C)c1 ZINC000162025936 387207683 /nfs/dbraw/zinc/20/76/83/387207683.db2.gz PXWHEVDHEXYJCT-GFCCVEGCSA-N 2 0 206.333 2.049 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[NH2+]C[C@H]1C)C1CCSCC1 ZINC000423365095 387215846 /nfs/dbraw/zinc/21/58/46/387215846.db2.gz CVEVEBBQKUUCRF-NTZNESFSSA-N 2 0 242.432 2.106 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@@H](C)C1CCSCC1 ZINC000423367339 387219543 /nfs/dbraw/zinc/21/95/43/387219543.db2.gz AELMIUMZIQRCPZ-MNOVXSKESA-N 2 0 230.421 2.106 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)c1ccccc1 ZINC000423368280 387220505 /nfs/dbraw/zinc/22/05/05/387220505.db2.gz FCPUWTXTUUUBFP-MBNYWOFBSA-N 2 0 218.344 2.478 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)[C@@H]1CC1(C)C ZINC000423368975 387221580 /nfs/dbraw/zinc/22/15/80/387221580.db2.gz BMMPSGBDYIQTDR-KXNHARMFSA-N 2 0 210.365 2.151 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H]1CCCc2cc(N)ccc21 ZINC000423371220 387224473 /nfs/dbraw/zinc/22/44/73/387224473.db2.gz UWVVAXFFATWDNJ-IAQYHMDHSA-N 2 0 247.386 2.363 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[NH2+][C@H](C)C1)C1CCSCC1 ZINC000423371775 387224668 /nfs/dbraw/zinc/22/46/68/387224668.db2.gz FQWAEWGIWLHJSL-WZRBSPASSA-N 2 0 242.432 2.248 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCc3ccccc32)CC[NH2+]1 ZINC000423373674 387229335 /nfs/dbraw/zinc/22/93/35/387229335.db2.gz JHXCZYYSHXFYTG-UXIGCNINSA-N 2 0 230.355 2.404 20 0 BEADRP C[C@@H](Cc1coc2ccccc12)[NH2+]CC1C[NH2+]C1 ZINC000423326111 387230000 /nfs/dbraw/zinc/23/00/00/387230000.db2.gz QMUBSGWRBFIZHP-NSHDSACASA-N 2 0 244.338 2.173 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@H]1CCC[C@H]1CCCF ZINC000423396994 387233115 /nfs/dbraw/zinc/23/31/15/387233115.db2.gz NYWWEQUZRSUURU-RFGFWPKPSA-N 2 0 242.382 2.492 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+]C[C@@H]1CCC[C@H](C)C1 ZINC000300663612 387236241 /nfs/dbraw/zinc/23/62/41/387236241.db2.gz NHVMIWDSWPHATR-MJBXVCDLSA-N 2 0 242.407 2.156 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@@H]1CCc2cc(F)ccc21 ZINC000423402065 387237323 /nfs/dbraw/zinc/23/73/23/387237323.db2.gz RFUUYYZHRJTFOZ-WKPIXPDZSA-N 2 0 248.345 2.401 20 0 BEADRP FCCC[C@H]1CCC[C@@H]1[NH2+]CC1CC[NH2+]CC1 ZINC000643497416 387239489 /nfs/dbraw/zinc/23/94/89/387239489.db2.gz QJLMCAWBILNBEA-KGLIPLIRSA-N 2 0 242.382 2.494 20 0 BEADRP C[C@@H]1CCC[C@H](C)[C@H]1[NH2+][C@@H]1CC[NH2+]C[C@H]1C ZINC000423407836 387242897 /nfs/dbraw/zinc/24/28/97/387242897.db2.gz WKQCSZSYFLWSON-ITGHMWBKSA-N 2 0 224.392 2.399 20 0 BEADRP COCCC[C@@H](C)[NH2+]Cc1ccc2c(c1)C[NH2+]C2 ZINC000423407287 387243574 /nfs/dbraw/zinc/24/35/74/387243574.db2.gz ZQWVOQQUYBGRGU-GFCCVEGCSA-N 2 0 248.370 2.195 20 0 BEADRP COC[C@@]1(C[NH2+][C@H](C)CC(C)(C)C)CCC[NH2+]1 ZINC000423413430 387247072 /nfs/dbraw/zinc/24/70/72/387247072.db2.gz KLIVBZCUPXNOFZ-OCCSQVGLSA-N 2 0 242.407 2.169 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)c1ccco1 ZINC000423420204 387247959 /nfs/dbraw/zinc/24/79/59/387247959.db2.gz AEQRIJOVXKUQEL-KGYLQXTDSA-N 2 0 234.343 2.318 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H](C2CC2)C2CCC2)CCC1 ZINC000423346105 387194892 /nfs/dbraw/zinc/19/48/92/387194892.db2.gz ZIHVAXHUAGCWBD-GFCCVEGCSA-N 2 0 208.349 2.036 20 0 BEADRP C[C@@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)C(C)(C)C ZINC000423346360 387195730 /nfs/dbraw/zinc/19/57/30/387195730.db2.gz ZZQFNROFPMBOIM-YPMHNXCESA-N 2 0 212.381 2.400 20 0 BEADRP CC[C@@H]([NH2+]CC1(C)CC[NH2+]CC1)C1CC1 ZINC000423345333 387196004 /nfs/dbraw/zinc/19/60/04/387196004.db2.gz YTUZCNNRPJGFTB-GFCCVEGCSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CC2=CC[NH2+]CC2)C[C@@H]1C ZINC000423348181 387196375 /nfs/dbraw/zinc/19/63/75/387196375.db2.gz SCDQYSDEWFJVJE-MBNYWOFBSA-N 2 0 222.376 2.320 20 0 BEADRP C[C@H]([NH2+]CCCC[NH3+])c1ccc2c(c1)COC2 ZINC000423347246 387197690 /nfs/dbraw/zinc/19/76/90/387197690.db2.gz ZYTIJUYOEXUUCJ-NSHDSACASA-N 2 0 234.343 2.106 20 0 BEADRP C1=C(C[NH2+][C@H]2CCC[C@H]2C2CC2)CC[NH2+]C1 ZINC000423347154 387198077 /nfs/dbraw/zinc/19/80/77/387198077.db2.gz QEYLHSIVKHTCGH-KBPBESRZSA-N 2 0 220.360 2.074 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[C@H]([NH3+])C1)c1ccncc1 ZINC000423465848 387312730 /nfs/dbraw/zinc/31/27/30/387312730.db2.gz HYDHLFMIVWVNMD-SCRDCRAPSA-N 2 0 233.359 2.250 20 0 BEADRP Cc1ccnc([C@H](C)[NH2+][C@H](C)CCC[NH3+])c1 ZINC000423465537 387312885 /nfs/dbraw/zinc/31/28/85/387312885.db2.gz WOLHCBWZBGMWDJ-NEPJUHHUSA-N 2 0 221.348 2.168 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@H]1CCCc2c(O)cccc21 ZINC000423464366 387312977 /nfs/dbraw/zinc/31/29/77/387312977.db2.gz VUAQKWPFYCYPPS-FZMZJTMJSA-N 2 0 248.370 2.487 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@@H](c1ccccc1)C1CC1 ZINC000423470349 387316904 /nfs/dbraw/zinc/31/69/04/387316904.db2.gz PFTPWVSRNGPWAU-KGLIPLIRSA-N 2 0 218.344 2.465 20 0 BEADRP CC(C)CC[C@@H]1CC[C@@H]([NH2+][C@@H]2[C@H]3C[NH2+]C[C@H]32)C1 ZINC000423429130 387255158 /nfs/dbraw/zinc/25/51/58/387255158.db2.gz LALHRSUBNQKBOE-ZSAUSMIDSA-N 2 0 236.403 2.399 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@@H](C)CCCc1cccnc1 ZINC000423378381 387259925 /nfs/dbraw/zinc/25/99/25/387259925.db2.gz FUUWYCKSNWVUGA-UONOGXRCSA-N 2 0 249.402 2.380 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CCC[NH2+]1)C1CCCC1 ZINC000423378769 387260260 /nfs/dbraw/zinc/26/02/60/387260260.db2.gz ZVBAEFPCRDTJAO-DGCLKSJQSA-N 2 0 210.365 2.297 20 0 BEADRP Cc1ccc2c(c1)[C@@H](N[C@@H](C)C[NH3+])CCC2 ZINC000423379931 387261504 /nfs/dbraw/zinc/26/15/04/387261504.db2.gz YGGYOKCKILVYFZ-FZMZJTMJSA-N 2 0 218.344 2.309 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H]3C[C@]32C)CC[NH2+]1 ZINC000423382728 387265031 /nfs/dbraw/zinc/26/50/31/387265031.db2.gz ONZDUIGBWGFSAR-XVIXHAIJSA-N 2 0 222.376 2.295 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[NH2+]C[C@@H]1C)[C@@H]1C[C@@H]1C ZINC000423385675 387267424 /nfs/dbraw/zinc/26/74/24/387267424.db2.gz GWVAJBVJNOEYNW-IEECTRCBSA-N 2 0 210.365 2.009 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+]CC2CC[NH2+]CC2)c(C)n1 ZINC000643497621 387268663 /nfs/dbraw/zinc/26/86/63/387268663.db2.gz ITXUWLALDZTKRI-GFCCVEGCSA-N 2 0 247.386 2.349 20 0 BEADRP CC(C)[C@@H]([NH2+]CC1CC[NH2+]CC1)c1cccnc1 ZINC000643497666 387270516 /nfs/dbraw/zinc/27/05/16/387270516.db2.gz PKTLEDCYGZDLHZ-OAHLLOKOSA-N 2 0 247.386 2.368 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@H](c1ccccc1)C1CC1 ZINC000423470359 387317969 /nfs/dbraw/zinc/31/79/69/387317969.db2.gz PFTPWVSRNGPWAU-ZIAGYGMSSA-N 2 0 218.344 2.465 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)c1cccnc1 ZINC000423431477 387283453 /nfs/dbraw/zinc/28/34/53/387283453.db2.gz VKYOOCYWHHJQGO-IHRRRGAJSA-N 2 0 247.386 2.497 20 0 BEADRP CCC[C@H](C)[C@@H](CC)[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000423437412 387288437 /nfs/dbraw/zinc/28/84/37/387288437.db2.gz QLTRSKVIOFGWJW-KIJLLGNVSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@H]([NH3+])[C@H](C)[NH2+][C@H]1CCC[C@H]1CCCF ZINC000423441262 387290936 /nfs/dbraw/zinc/29/09/36/387290936.db2.gz BESAOVKQPCWNNY-BJDJZHNGSA-N 2 0 216.344 2.230 20 0 BEADRP C[C@H]([NH3+])[C@H](C)[NH2+][C@@H]1c2ccccc2C[C@@H]1C ZINC000423448584 387298090 /nfs/dbraw/zinc/29/80/90/387298090.db2.gz QOQQWFDBTSTWAL-RMIALFOJSA-N 2 0 218.344 2.245 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H]1CCC[C@H]2C[C@]21C ZINC000423452503 387299107 /nfs/dbraw/zinc/29/91/07/387299107.db2.gz JRQICZWZDCYYGO-YVECIDJPSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]Cc1ccc2c(c1)CCCN2 ZINC000423450096 387299137 /nfs/dbraw/zinc/29/91/37/387299137.db2.gz SICRYUSBUFDWOL-NWDGAFQWSA-N 2 0 247.386 2.260 20 0 BEADRP CC(C)[C@H]1CCC[C@H]([NH2+][C@@H]2[C@H]3C[NH2+]C[C@H]32)C1 ZINC000423453521 387302423 /nfs/dbraw/zinc/30/24/23/387302423.db2.gz KSUATGJIRZMREP-QSLWVIQJSA-N 2 0 222.376 2.009 20 0 BEADRP CCC[C@@H](C)[C@@H](CC)[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000423458686 387306904 /nfs/dbraw/zinc/30/69/04/387306904.db2.gz QLTRSKVIOFGWJW-LBELIVKGSA-N 2 0 210.365 2.009 20 0 BEADRP Cc1ccc2c(c1)[C@@H]([NH2+][C@@H]1[C@H]3C[NH2+]C[C@H]31)[C@@H](C)C2 ZINC000423461387 387308333 /nfs/dbraw/zinc/30/83/33/387308333.db2.gz UMSYOGGXITWSIU-YDVLKRNPSA-N 2 0 242.366 2.036 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+]C1CCC(C(F)F)CC1 ZINC000423461015 387309505 /nfs/dbraw/zinc/30/95/05/387309505.db2.gz JFSSAWJCRAMTJT-HWOCKDDLSA-N 2 0 220.307 2.137 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@@H]2CC[C@H]2SC)CC1 ZINC000515298895 387358891 /nfs/dbraw/zinc/35/88/91/387358891.db2.gz WKDREZSKGMNBRP-CHWSQXEVSA-N 2 0 242.432 2.202 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@H]2CC[C@@H]2SC)CC1 ZINC000515298898 387358966 /nfs/dbraw/zinc/35/89/66/387358966.db2.gz WKDREZSKGMNBRP-STQMWFEESA-N 2 0 242.432 2.202 20 0 BEADRP C[C@H]([NH2+]CCC1=CC[NH2+]CC1)[C@@H]1CC1(C)C ZINC000423535180 387361079 /nfs/dbraw/zinc/36/10/79/387361079.db2.gz CGJIYIMQIZBLCH-AAEUAGOBSA-N 2 0 222.376 2.320 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@@H]1C[C@H](OCC(C)C)C1(C)C ZINC000423481618 387363601 /nfs/dbraw/zinc/36/36/01/387363601.db2.gz XAEABDCCFHBTPM-XQQFMLRXSA-N 2 0 242.407 2.153 20 0 BEADRP Cc1cncc([C@H](C)[NH2+]CCC2=CC[NH2+]CC2)c1 ZINC000423537988 387363876 /nfs/dbraw/zinc/36/38/76/387363876.db2.gz LPOBVGVZNVSGCJ-ZDUSSCGKSA-N 2 0 245.370 2.350 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)C1(C)CC1 ZINC000423538515 387364171 /nfs/dbraw/zinc/36/41/71/387364171.db2.gz GNMMLCMXVCIXHV-WUHRBBMRSA-N 2 0 222.376 2.153 20 0 BEADRP CC[C@H]([NH2+]CCC1=CC[NH2+]CC1)[C@@H]1C[C@H]1C ZINC000423540445 387365399 /nfs/dbraw/zinc/36/53/99/387365399.db2.gz QIOPYQWOZVOWHL-BNOWGMLFSA-N 2 0 222.376 2.320 20 0 BEADRP CC[C@H]([NH2+]CCC[NH2+]C1CC1)c1ccncc1 ZINC000423542032 387365936 /nfs/dbraw/zinc/36/59/36/387365936.db2.gz ANASKOKVUDUIEY-AWEZNQCLSA-N 2 0 233.359 2.264 20 0 BEADRP CC[C@@H]([NH2+]CCC[NH2+]C1CC1)c1ccncc1 ZINC000423542036 387365985 /nfs/dbraw/zinc/36/59/85/387365985.db2.gz ANASKOKVUDUIEY-CQSZACIVSA-N 2 0 233.359 2.264 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCCC[NH2+]C1)[C@H]1CC1(C)C ZINC000423541760 387366466 /nfs/dbraw/zinc/36/64/66/387366466.db2.gz AAFOMUUPLFDZHI-QJPTWQEYSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]C[C@H]1CC12CCSCC2 ZINC000423547211 387370847 /nfs/dbraw/zinc/37/08/47/387370847.db2.gz LEWAGNPDBZOVDQ-NWDGAFQWSA-N 2 0 242.432 2.237 20 0 BEADRP c1ccc2c(c1)C[C@H]2C[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000643453499 387371280 /nfs/dbraw/zinc/37/12/80/387371280.db2.gz HNAZBFGLFPJQKB-RDGKXADDSA-N 2 0 242.366 2.199 20 0 BEADRP Cc1cc(C[NH2+][C@@H]2CCCC[C@H]2C[NH3+])cc(C)n1 ZINC000423548892 387371338 /nfs/dbraw/zinc/37/13/38/387371338.db2.gz NAZZABMVZSNTTQ-LSDHHAIUSA-N 2 0 247.386 2.306 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+]CCC1=CC[NH2+]CC1 ZINC000423559193 387374538 /nfs/dbraw/zinc/37/45/38/387374538.db2.gz OQJSCHNZUIBMNX-YPMHNXCESA-N 2 0 208.349 2.074 20 0 BEADRP C[C@]12C[C@H]1CCC[C@@H]2[NH2+]CCC[NH2+]C1CC1 ZINC000423561697 387377058 /nfs/dbraw/zinc/37/70/58/387377058.db2.gz PZJXXZJSVXMFOH-XBFCOCLRSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCC[C@H]2CCC[NH2+]2)c2nccn21 ZINC000423472793 387319355 /nfs/dbraw/zinc/31/93/55/387319355.db2.gz GEFLBDPKKUIPIO-JHJVBQTASA-N 2 0 248.374 2.011 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCC[C@@H]2CCC[NH2+]2)c2nccn21 ZINC000423472791 387320216 /nfs/dbraw/zinc/32/02/16/387320216.db2.gz GEFLBDPKKUIPIO-FRRDWIJNSA-N 2 0 248.374 2.011 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[C@H]([NH3+])C1)c1cncs1 ZINC000423475546 387321685 /nfs/dbraw/zinc/32/16/85/387321685.db2.gz PYXUKNIXWPFKFX-AXFHLTTASA-N 2 0 239.388 2.311 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]C[C@@H]1CCC[C@@H]([NH3+])C1 ZINC000423476759 387323986 /nfs/dbraw/zinc/32/39/86/387323986.db2.gz RIBCVUDDQPTJMV-LPWJVIDDSA-N 2 0 210.365 2.282 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]C[C@H]1CCC[C@@H]([NH3+])C1 ZINC000423476758 387324311 /nfs/dbraw/zinc/32/43/11/387324311.db2.gz RIBCVUDDQPTJMV-LOWDOPEQSA-N 2 0 210.365 2.282 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@@H]1c2ccccc2C[C@@H]1C ZINC000423478377 387325400 /nfs/dbraw/zinc/32/54/00/387325400.db2.gz UNLUCFRVKDJROG-JKOKRWQUSA-N 2 0 218.344 2.247 20 0 BEADRP C[C@H]([NH3+])CN1CCC[C@H]1c1ccc(F)cc1 ZINC000336501070 387327540 /nfs/dbraw/zinc/32/75/40/387327540.db2.gz OJAOFZHUAVLAHZ-GWCFXTLKSA-N 2 0 222.307 2.310 20 0 BEADRP CC[NH+](CC)CCC[N@@H+]1CCC[C@H](OC)CC1 ZINC000372796283 387328396 /nfs/dbraw/zinc/32/83/96/387328396.db2.gz BSYAWGPEPPWVFK-AWEZNQCLSA-N 2 0 242.407 2.219 20 0 BEADRP CC[C@H]([NH2+]CC1=CC[N@H+](C)CC1)[C@@H]1C[C@@H]1C ZINC000321951514 387329200 /nfs/dbraw/zinc/32/92/00/387329200.db2.gz WXPPKSGZQDMQBF-YUTCNCBUSA-N 2 0 222.376 2.273 20 0 BEADRP CC[NH+](CC)CCC[N@@H+]1CC[C@@H](C2CC2)C1 ZINC000372804157 387329593 /nfs/dbraw/zinc/32/95/93/387329593.db2.gz FCLMTGTURVWWRY-CQSZACIVSA-N 2 0 224.392 2.450 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@H](C)CCc1ccco1 ZINC000515053156 387333308 /nfs/dbraw/zinc/33/33/08/387333308.db2.gz DHRHAHUQLPCVDO-DGCLKSJQSA-N 2 0 224.348 2.174 20 0 BEADRP Cc1cc(N)cc(C[NH2+][C@H]2CCCC[C@@H]2C[NH3+])c1 ZINC000423486342 387333669 /nfs/dbraw/zinc/33/36/69/387333669.db2.gz WJCILUSUNVTIKH-HIFRSBDPSA-N 2 0 247.386 2.184 20 0 BEADRP C[C@@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1cncs1 ZINC000423489032 387333962 /nfs/dbraw/zinc/33/39/62/387333962.db2.gz VTBGBZGUUKUFDM-GHMZBOCLSA-N 2 0 239.388 2.326 20 0 BEADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@H]2CC[C@H]2C2CCC2)C1 ZINC000423495440 387339190 /nfs/dbraw/zinc/33/91/90/387339190.db2.gz FGTCVWDXKNIWMO-SAXRGWBVSA-N 2 0 222.376 2.282 20 0 BEADRP CCc1cccnc1[C@H](C)[NH2+][C@H]1CC[C@H](C[NH3+])C1 ZINC000423498710 387340609 /nfs/dbraw/zinc/34/06/09/387340609.db2.gz HGWGGFCQWYEMRW-OBJOEFQTSA-N 2 0 247.386 2.422 20 0 BEADRP CC[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])C1)c1ccncc1 ZINC000423499670 387341375 /nfs/dbraw/zinc/34/13/75/387341375.db2.gz HZFMXWNYAFPQHM-UBHSHLNASA-N 2 0 233.359 2.250 20 0 BEADRP Cc1cncc([C@H](C)[NH2+][C@@H]2CC[C@@H](C[NH3+])C2)c1 ZINC000423502197 387343471 /nfs/dbraw/zinc/34/34/71/387343471.db2.gz JSBKXKIXSQIDKL-OUCADQQQSA-N 2 0 233.359 2.168 20 0 BEADRP C[C@H]1C[C@H]([NH2+]C2(C3CC3)CC2)CN1C1CC1 ZINC000309805230 387344215 /nfs/dbraw/zinc/34/42/15/387344215.db2.gz RZQZBFHRVDTBAH-JQWIXIFHSA-N 2 0 220.360 2.144 20 0 BEADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@H]2CCC23CCCC3)C1 ZINC000423506798 387345016 /nfs/dbraw/zinc/34/50/16/387345016.db2.gz MIKWYZKWAKKRBG-AGIUHOORSA-N 2 0 222.376 2.426 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@H](C[NH3+])C1)[C@@H]1CC1(C)C ZINC000423520886 387353328 /nfs/dbraw/zinc/35/33/28/387353328.db2.gz WPQWVAMBQOPTKH-YFKTTZPYSA-N 2 0 210.365 2.138 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+][C@@H]1CC[C@@H](C[NH3+])C1 ZINC000423518606 387353507 /nfs/dbraw/zinc/35/35/07/387353507.db2.gz UZQMCWBFPZSTIK-YNEHKIRRSA-N 2 0 233.359 2.168 20 0 BEADRP Cc1ccncc1CCC[N@@H+]1CCC[C@@H](O)CC1 ZINC000354750980 387427534 /nfs/dbraw/zinc/42/75/34/387427534.db2.gz XAFLVTKPUJQMRD-OAHLLOKOSA-N 2 0 248.370 2.169 20 0 BEADRP CC[C@@H](COC)[NH2+]CCC1CC[NH+](CC)CC1 ZINC000121813696 387418643 /nfs/dbraw/zinc/41/86/43/387418643.db2.gz PMUKGIFBOKSNAX-AWEZNQCLSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@H](C[NH2+]C1CCC(C[NH3+])CC1)C1CC1 ZINC000643468363 387418773 /nfs/dbraw/zinc/41/87/73/387418773.db2.gz VEKMWWLLLPQPJM-XSRFYTQQSA-N 2 0 210.365 2.140 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[NH2+]CC[C@@H]1C)C1CC1 ZINC000643468333 387419289 /nfs/dbraw/zinc/41/92/89/387419289.db2.gz QLXGMZYGROJWIK-DMDPSCGWSA-N 2 0 210.365 2.010 20 0 BEADRP Cc1ncc([C@H](C)[NH2+]CC[C@H]2CC[NH2+]C2)s1 ZINC000643509309 387503275 /nfs/dbraw/zinc/50/32/75/387503275.db2.gz XTKAZJPAICFORS-GXSJLCMTSA-N 2 0 239.388 2.102 20 0 BEADRP Cc1ccc([C@H](C)[NH2+]CC[C@H]2CC[NH2+]C2)c(C)n1 ZINC000643509169 387506170 /nfs/dbraw/zinc/50/61/70/387506170.db2.gz CDFXYYURGZQYSC-GXTWGEPZSA-N 2 0 247.386 2.349 20 0 BEADRP CC(C)OC1CCC([NH2+][C@H](C)C[C@H](C)[NH3+])CC1 ZINC000643475976 387514129 /nfs/dbraw/zinc/51/41/29/387514129.db2.gz ZFPITISCIWAIKN-MRFVTOPCSA-N 2 0 242.407 2.438 20 0 BEADRP Cc1cc(NC[C@@H]2CC[N@@H+](C3CC3)C2)cc[nH+]1 ZINC000162716993 387518123 /nfs/dbraw/zinc/51/81/23/387518123.db2.gz NVPHLFLLKLXRPP-LBPRGKRZSA-N 2 0 231.343 2.286 20 0 BEADRP CC(C)C(C[N@H+]1C[C@H]2C[NH+](C)C[C@H]2C1)C(C)C ZINC000375312190 387526919 /nfs/dbraw/zinc/52/69/19/387526919.db2.gz ZMTGNLRSFVRNRG-OKILXGFUSA-N 2 0 238.419 2.408 20 0 BEADRP NC[C@H]1CCC[N@@H+]1CCCCC1CCOCC1 ZINC000310065496 387533463 /nfs/dbraw/zinc/53/34/63/387533463.db2.gz PUFIUIVXNANTFD-CQSZACIVSA-N 2 0 240.391 2.006 20 0 BEADRP COC(C)(C)[C@H](C)[NH2+]CCC1CC[NH+](C)CC1 ZINC000310059881 387533871 /nfs/dbraw/zinc/53/38/71/387533871.db2.gz BLXVLYAMWHTZJU-LBPRGKRZSA-N 2 0 242.407 2.121 20 0 BEADRP CN(CC[C@@H]1CCCC[N@@H+]1C)CC1(F)CC1 ZINC000527220174 387536530 /nfs/dbraw/zinc/53/65/30/387536530.db2.gz FUNFWDXEJJUQEY-LBPRGKRZSA-N 2 0 228.355 2.295 20 0 BEADRP FC1(C[NH+]2CCC(C[NH+]3CCCC3)CC2)CC1 ZINC000527218732 387538572 /nfs/dbraw/zinc/53/85/72/387538572.db2.gz IQAALUZPKRMQHA-UHFFFAOYSA-N 2 0 240.366 2.296 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCCSC2)CC[N@@H+]1C ZINC000304332838 387467527 /nfs/dbraw/zinc/46/75/27/387467527.db2.gz AOMXGNCCYIVOQJ-FRRDWIJNSA-N 2 0 242.432 2.202 20 0 BEADRP CO[C@H](C)[C@@H](C)[NH2+]CC1(C[NH+](C)C)CCCC1 ZINC000355069919 387473766 /nfs/dbraw/zinc/47/37/66/387473766.db2.gz SIWBFYJHEQPLFR-CHWSQXEVSA-N 2 0 242.407 2.121 20 0 BEADRP Cc1occc1C[NH2+][C@@H]1CC[NH2+]CC[C@H]1C ZINC000643472165 387484258 /nfs/dbraw/zinc/48/42/58/387484258.db2.gz CADONYGCKAKZKT-ZWNOBZJWSA-N 2 0 222.332 2.066 20 0 BEADRP Cc1occc1C[NH2+][C@H]1CC[NH2+]CC[C@H]1C ZINC000643472164 387484501 /nfs/dbraw/zinc/48/45/01/387484501.db2.gz CADONYGCKAKZKT-MFKMUULPSA-N 2 0 222.332 2.066 20 0 BEADRP Cc1occc1C[NH2+][C@@H]1CCCC[C@@H]1C[NH3+] ZINC000643472175 387484684 /nfs/dbraw/zinc/48/46/84/387484684.db2.gz DQAIPMFLCVLQQC-DGCLKSJQSA-N 2 0 222.332 2.195 20 0 BEADRP CCC1(O)CCC([NH2+][C@@H](C)CCCC[NH3+])CC1 ZINC000643474147 387488679 /nfs/dbraw/zinc/48/86/79/387488679.db2.gz HSFJCIIBFOECQV-HSBZDZAISA-N 2 0 242.407 2.177 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@H]1CCCc2ccccc2C1 ZINC000643514878 387599502 /nfs/dbraw/zinc/59/95/02/387599502.db2.gz AAMLCFNWNFZBEO-WFASDCNBSA-N 2 0 232.371 2.118 20 0 BEADRP c1cc(C[NH2+]C2CC[NH2+]CC2)cc(C2CC2)c1 ZINC000422551559 387599602 /nfs/dbraw/zinc/59/96/02/387599602.db2.gz FCYLXJVLNVXSGQ-UHFFFAOYSA-N 2 0 230.355 2.406 20 0 BEADRP Cc1cc(C)cc([C@H](C)[NH2+]CCC[NH3+])c1 ZINC000148358479 387599830 /nfs/dbraw/zinc/59/98/30/387599830.db2.gz QDLJBDHEFPDHKP-LBPRGKRZSA-N 2 0 206.333 2.303 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H]1CCCc2ccccc2C1 ZINC000643514876 387600058 /nfs/dbraw/zinc/60/00/58/387600058.db2.gz AAMLCFNWNFZBEO-IUODEOHRSA-N 2 0 232.371 2.118 20 0 BEADRP Cc1nccn1CCC[N@@H+]1CC(C)=C[C@@H](C)C1 ZINC000430266680 387603462 /nfs/dbraw/zinc/60/34/62/387603462.db2.gz YLRVFINZTFIUEM-GFCCVEGCSA-N 2 0 233.359 2.480 20 0 BEADRP COCCCCC[N@@H+]1C[C@H](C[NH3+])[C@H](C)C[C@H]1C ZINC000422640733 387610771 /nfs/dbraw/zinc/61/07/71/387610771.db2.gz WAARMPRBJJSJSQ-MCIONIFRSA-N 2 0 242.407 2.108 20 0 BEADRP [NH3+][C@@H](C[NH2+][C@@H]1CCCc2ccccc2C1)C1CC1 ZINC000643516686 387629335 /nfs/dbraw/zinc/62/93/35/387629335.db2.gz JWHRNYZQAIAEFY-CVEARBPZSA-N 2 0 244.382 2.261 20 0 BEADRP COc1cccc([C@H](C)[NH2+][C@@H](C)C[C@H](C)[NH3+])c1 ZINC000422714673 387629272 /nfs/dbraw/zinc/62/92/72/387629272.db2.gz RIQDJJREDJPIRV-SRVKXCTJSA-N 2 0 236.359 2.472 20 0 BEADRP Cc1ccc(C(C)(C)C[NH2+][C@H](C)C2C[NH2+]C2)cc1 ZINC000422702879 387617854 /nfs/dbraw/zinc/61/78/54/387617854.db2.gz GGBWOCIQPDGQKZ-CYBMUJFWSA-N 2 0 246.398 2.470 20 0 BEADRP C[C@H]([NH2+][C@H]1[C@H](C)CCC[C@@H]1C)C1C[NH2+]C1 ZINC000422703570 387619225 /nfs/dbraw/zinc/61/92/25/387619225.db2.gz NJGFLXOERIIELJ-SRRSOLGSSA-N 2 0 210.365 2.009 20 0 BEADRP Cc1ccsc1C[NH2+][C@H](C)C[C@@H](C)[NH3+] ZINC000422709537 387622293 /nfs/dbraw/zinc/62/22/93/387622293.db2.gz ZJARYFMHUIMOPB-NXEZZACHSA-N 2 0 212.362 2.272 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+][C@H]1[C@H](C)CCC[C@@H]1C ZINC000422708772 387622840 /nfs/dbraw/zinc/62/28/40/387622840.db2.gz YEJHWSODOFMDLG-RQJABVFESA-N 2 0 242.407 2.155 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[NH2+][C@H]1CCC[C@@H]1[NH3+] ZINC000422708166 387624046 /nfs/dbraw/zinc/62/40/46/387624046.db2.gz XECHHJYFFCUHPW-NDBYEHHHSA-N 2 0 210.365 2.282 20 0 BEADRP C[NH+](C)CCC[NH2+]C1C2CC3CC(C2)CC1C3 ZINC000035161782 387551570 /nfs/dbraw/zinc/55/15/70/387551570.db2.gz OSGJIZWURFJXNO-UHFFFAOYSA-N 2 0 236.403 2.352 20 0 BEADRP Cc1ccc(CC[NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)nc1 ZINC000399681349 387565055 /nfs/dbraw/zinc/56/50/55/387565055.db2.gz QMRKWKXDZGXPJN-HIFRSBDPSA-N 2 0 247.386 2.005 20 0 BEADRP C[C@@H]([NH2+]CCCC[NH3+])c1cc(F)ccc1F ZINC000037714998 387565982 /nfs/dbraw/zinc/56/59/82/387565982.db2.gz CWXKSVIQVNELPF-SECBINFHSA-N 2 0 228.286 2.354 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CCO[C@H]1CCCC[C@@H]1C ZINC000422716308 387627798 /nfs/dbraw/zinc/62/77/98/387627798.db2.gz UGFHHGCJQSPTBO-XUXIUFHCSA-N 2 0 242.407 2.297 20 0 BEADRP FCCCC[N@@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000377153638 387694688 /nfs/dbraw/zinc/69/46/88/387694688.db2.gz JZISHNCEROWBPW-ZDUSSCGKSA-N 2 0 228.355 2.154 20 0 BEADRP CSC1(C[N@@H+]2CC[C@H](C[NH+](C)C)C2)CCC1 ZINC000356227410 387630728 /nfs/dbraw/zinc/63/07/28/387630728.db2.gz VEGMQBUCIHFOJQ-GFCCVEGCSA-N 2 0 242.432 2.156 20 0 BEADRP CC(C)[C@@](C)(CN)[NH2+]CCN(C)c1ccccc1 ZINC000430588463 387630877 /nfs/dbraw/zinc/63/08/77/387630877.db2.gz ZHRDUXWHCJQFBB-OAHLLOKOSA-N 2 0 249.402 2.086 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CCCC[C@H]1C)C1C[NH2+]C1 ZINC000422726156 387634926 /nfs/dbraw/zinc/63/49/26/387634926.db2.gz DGOJYWOXTRTAMO-AGIUHOORSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CCCC[C@H]1C)C1C[NH2+]C1 ZINC000422726158 387636250 /nfs/dbraw/zinc/63/62/50/387636250.db2.gz DGOJYWOXTRTAMO-JHJVBQTASA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]Cc1ccc(F)cc1 ZINC000422726838 387636461 /nfs/dbraw/zinc/63/64/61/387636461.db2.gz GBRLFURZZWMGFV-VHSXEESVSA-N 2 0 210.296 2.041 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]1[NH2+]CCCc1ccccc1 ZINC000422732238 387641599 /nfs/dbraw/zinc/64/15/99/387641599.db2.gz NOYPWQICDQRDED-KBPBESRZSA-N 2 0 218.344 2.089 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]CCC1CCOCC1 ZINC000422734386 387643423 /nfs/dbraw/zinc/64/34/23/387643423.db2.gz SELVTTAGCNOMDZ-ZIAGYGMSSA-N 2 0 240.391 2.053 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[C@@H](C)C[C@@H]1C)C1C[NH2+]C1 ZINC000422737339 387645490 /nfs/dbraw/zinc/64/54/90/387645490.db2.gz XJVBIDQZJJVKAO-BLFANLJRSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@H]([NH2+]CC(C)(C)c1cccs1)C1C[NH2+]C1 ZINC000422738543 387645687 /nfs/dbraw/zinc/64/56/87/387645687.db2.gz JSCOANHSRUPZTM-JTQLQIEISA-N 2 0 238.400 2.223 20 0 BEADRP C[C@H](C[NH2+][C@@H](C)C1C[NH2+]C1)c1ccc(F)cc1 ZINC000422745700 387648042 /nfs/dbraw/zinc/64/80/42/387648042.db2.gz VMTWEMUZNAIOBG-MNOVXSKESA-N 2 0 236.334 2.127 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]CCc1ccccc1 ZINC000422741593 387648333 /nfs/dbraw/zinc/64/83/33/387648333.db2.gz DWPGQKBOWWKJJZ-UKRRQHHQSA-N 2 0 232.371 2.207 20 0 BEADRP CCCC[C@H](CC)C[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000422741443 387648768 /nfs/dbraw/zinc/64/87/68/387648768.db2.gz DRHQUVFSAKHYDU-RYUDHWBXSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+]CCc1ccccc1 ZINC000422741591 387648969 /nfs/dbraw/zinc/64/89/69/387648969.db2.gz DWPGQKBOWWKJJZ-DZGCQCFKSA-N 2 0 232.371 2.207 20 0 BEADRP CCOc1ccccc1C[NH2+][C@H](C)C[C@H](C)[NH3+] ZINC000422745427 387649108 /nfs/dbraw/zinc/64/91/08/387649108.db2.gz XQWDWGCYKZTSEJ-NWDGAFQWSA-N 2 0 236.359 2.301 20 0 BEADRP c1csc(CC[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)c1 ZINC000422756112 387658149 /nfs/dbraw/zinc/65/81/49/387658149.db2.gz LGYZDPPXQLQBOO-FOSCPWQOSA-N 2 0 236.384 2.163 20 0 BEADRP CSCCCC[NH2+][C@@H]1CCCCC[C@H]1[NH3+] ZINC000422754430 387658821 /nfs/dbraw/zinc/65/88/21/387658821.db2.gz JOTUEVUACKETMW-VXGBXAGGSA-N 2 0 230.421 2.379 20 0 BEADRP COc1ccccc1[C@H](C)[NH2+][C@H](C)C[C@H](C)[NH3+] ZINC000422753925 387658960 /nfs/dbraw/zinc/65/89/60/387658960.db2.gz JATDGUDWOBOXPK-TUAOUCFPSA-N 2 0 236.359 2.472 20 0 BEADRP C[C@H]([NH2+]C1C[C@H](C)C[C@@H](C)C1)C1C[NH2+]C1 ZINC000422756980 387661649 /nfs/dbraw/zinc/66/16/49/387661649.db2.gz CTASOMUVLPXCHF-MXWKQRLJSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]CCOc1ccccc1 ZINC000422761198 387663472 /nfs/dbraw/zinc/66/34/72/387663472.db2.gz QWEODVWJDSIJAE-HIFRSBDPSA-N 2 0 248.370 2.043 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+][C@@H]1CCc2ccccc2C1 ZINC000422761420 387663918 /nfs/dbraw/zinc/66/39/18/387663918.db2.gz RHLBSTJGDFSORN-RBSFLKMASA-N 2 0 230.355 2.013 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]CC1(c2cccc(F)c2)CC1 ZINC000422765732 387664987 /nfs/dbraw/zinc/66/49/87/387664987.db2.gz LAQWPUKYGSZISK-ZIAGYGMSSA-N 2 0 248.345 2.327 20 0 BEADRP C[C@@H]1CCC[C@H](C[NH2+][C@H]2CCC[C@@H]2[NH3+])C1 ZINC000422765637 387665108 /nfs/dbraw/zinc/66/51/08/387665108.db2.gz QZNDPTWWBPRSIL-VOAKCMCISA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+][C@H]1CCCCC[C@@H]1[NH2+]CCOC1CCCC1 ZINC000422763869 387665274 /nfs/dbraw/zinc/66/52/74/387665274.db2.gz NYAMARPHPSIRAJ-KBPBESRZSA-N 2 0 240.391 2.195 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]CCOC1CCCC1 ZINC000422763872 387665423 /nfs/dbraw/zinc/66/54/23/387665423.db2.gz NYAMARPHPSIRAJ-ZIAGYGMSSA-N 2 0 240.391 2.195 20 0 BEADRP CCO[C@@H]1C[C@@H]([NH2+][C@@H](C)CCC[NH3+])C12CCC2 ZINC000422788631 387667884 /nfs/dbraw/zinc/66/78/84/387667884.db2.gz VUTNHQOJXBPXQQ-YNEHKIRRSA-N 2 0 240.391 2.051 20 0 BEADRP Cc1ccc([C@@H](C)C[NH2+][C@H](C)C2C[NH2+]C2)cc1 ZINC000422773346 387669972 /nfs/dbraw/zinc/66/99/72/387669972.db2.gz YKPQAGRMKXDCFB-QWHCGFSZSA-N 2 0 232.371 2.296 20 0 BEADRP CC(C)[C@@H](C)C[NH2+][C@H](C)[C@@H]1CCCC[NH2+]1 ZINC000422773172 387670245 /nfs/dbraw/zinc/67/02/45/387670245.db2.gz TWAVFVOTNYPPMK-XQQFMLRXSA-N 2 0 212.381 2.399 20 0 BEADRP CC[C@@H](COC)[NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1 ZINC000125971575 387670299 /nfs/dbraw/zinc/67/02/99/387670299.db2.gz MIOZSOGTWIPLKV-KGLIPLIRSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CCCN(C)c1ccccc1 ZINC000422771206 387670456 /nfs/dbraw/zinc/67/04/56/387670456.db2.gz XEHNNMNWXLPJCO-KGLIPLIRSA-N 2 0 249.402 2.228 20 0 BEADRP CCCCOCC[NH2+][C@@H]1CCCCC[C@H]1[NH3+] ZINC000422792809 387696016 /nfs/dbraw/zinc/69/60/16/387696016.db2.gz ZMDNBDBZDNPHAM-CHWSQXEVSA-N 2 0 228.380 2.053 20 0 BEADRP CC[C@H]([NH2+][C@H](C)C1C[NH2+]C1)c1ccccc1 ZINC000422777900 387676244 /nfs/dbraw/zinc/67/62/44/387676244.db2.gz GQABXBBBVFYHPT-RISCZKNCSA-N 2 0 218.344 2.335 20 0 BEADRP C[C@H](CC1CCC1)[NH2+]CC1=CC[NH2+]CC1 ZINC000643520158 387679911 /nfs/dbraw/zinc/67/99/11/387679911.db2.gz QQTWZDFSUVUSRR-LLVKDONJSA-N 2 0 208.349 2.074 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]Cc1cccc2cccnc21 ZINC000422781216 387681553 /nfs/dbraw/zinc/68/15/53/387681553.db2.gz LDUSBSMSUQJFKN-RYUDHWBXSA-N 2 0 243.354 2.450 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]CCCOC1CCCCC1 ZINC000422783487 387684672 /nfs/dbraw/zinc/68/46/72/387684672.db2.gz LEBQYWRUUCMMTM-ZIAGYGMSSA-N 2 0 240.391 2.195 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CCCOC1CCCCC1 ZINC000422786931 387687006 /nfs/dbraw/zinc/68/70/06/387687006.db2.gz PHUIBKAGDFKOKW-STQMWFEESA-N 2 0 242.407 2.441 20 0 BEADRP CO[C@H](C[NH2+][C@H](C)C[C@@H](C)[NH3+])c1ccccc1 ZINC000422743328 387688906 /nfs/dbraw/zinc/68/89/06/387688906.db2.gz TYGDYDWCDJZCDO-YRGRVCCFSA-N 2 0 236.359 2.090 20 0 BEADRP CO[C@H](C[NH2+][C@H](C)CCC[NH3+])c1ccccc1 ZINC000422743247 387688977 /nfs/dbraw/zinc/68/89/77/387688977.db2.gz SXYIEMOBILRKJE-TZMCWYRMSA-N 2 0 236.359 2.091 20 0 BEADRP CC(C)CCOCC[NH2+][C@@H]1CC[NH2+]CC[C@H]1C ZINC000422790317 387692844 /nfs/dbraw/zinc/69/28/44/387692844.db2.gz XOWPPFYMDQJVOE-ZIAGYGMSSA-N 2 0 242.407 2.027 20 0 BEADRP CCc1ccccc1C[NH2+][C@H](C)C[C@H](C)[NH3+] ZINC000422790579 387693016 /nfs/dbraw/zinc/69/30/16/387693016.db2.gz VBGKFUMGDQOELI-NWDGAFQWSA-N 2 0 220.360 2.464 20 0 BEADRP Cc1cc(F)ccc1CC[NH2+][C@H](C)C[C@@H](C)[NH3+] ZINC000422867939 387748413 /nfs/dbraw/zinc/74/84/13/387748413.db2.gz TWSMJRNFZJBVBF-VXGBXAGGSA-N 2 0 238.350 2.392 20 0 BEADRP CC[C@@H]([NH2+]C[C@H]1CCCS1)[C@@H]1CCC[NH2+]1 ZINC000422871571 387748517 /nfs/dbraw/zinc/74/85/17/387748517.db2.gz DCYXRKPXEYVVBR-UTUOFQBUSA-N 2 0 228.405 2.002 20 0 BEADRP C[C@@H]([NH2+]C[C@@]1(C)CCCS1)[C@H]1CCCC[NH2+]1 ZINC000422870740 387749956 /nfs/dbraw/zinc/74/99/56/387749956.db2.gz CBVUJVZQMCDJAY-JHJVBQTASA-N 2 0 242.432 2.392 20 0 BEADRP CO[C@H](C)[C@H](C)[NH2+]CCC[NH+]1CCC(C)CC1 ZINC000128592395 387750824 /nfs/dbraw/zinc/75/08/24/387750824.db2.gz SBKDAWBAJXUAMZ-UONOGXRCSA-N 2 0 242.407 2.121 20 0 BEADRP CC[C@@H]([NH2+][C@H](C)CCCC[NH3+])C1CCOCC1 ZINC000422804778 387703487 /nfs/dbraw/zinc/70/34/87/387703487.db2.gz FPJDEGFKHLZTEW-TZMCWYRMSA-N 2 0 242.407 2.299 20 0 BEADRP CO[C@H](C[NH2+][C@H]1CCCCC[C@H]1[NH3+])C(C)(C)C ZINC000422805389 387704480 /nfs/dbraw/zinc/70/44/80/387704480.db2.gz GPGPHUBJWJUNFY-FRRDWIJNSA-N 2 0 242.407 2.297 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]1[NH2+]CCCC1CCCC1 ZINC000422806267 387705445 /nfs/dbraw/zinc/70/54/45/387705445.db2.gz NFCFSNJSDILYEK-STQMWFEESA-N 2 0 210.365 2.426 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]CCCC1CCCC1 ZINC000422806265 387706174 /nfs/dbraw/zinc/70/61/74/387706174.db2.gz NFCFSNJSDILYEK-OLZOCXBDSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CC1(c2ccccc2)CC1 ZINC000422813784 387711156 /nfs/dbraw/zinc/71/11/56/387711156.db2.gz SJNODHNSEFVEQE-CHWSQXEVSA-N 2 0 232.371 2.434 20 0 BEADRP CCSCC[C@H](C)[NH2+][C@@H](C)C[C@@H](C)[NH3+] ZINC000422812442 387712119 /nfs/dbraw/zinc/71/21/19/387712119.db2.gz WGEUAHVWEAPNGA-VWYCJHECSA-N 2 0 218.410 2.234 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]CC1(c2ccccc2)CC1 ZINC000422816191 387715227 /nfs/dbraw/zinc/71/52/27/387715227.db2.gz ZIENQSPDUCPRSK-DZGCQCFKSA-N 2 0 244.382 2.435 20 0 BEADRP C[C@@H]([NH2+]CCCOC1CCCC1)[C@@H]1CCC[NH2+]1 ZINC000422822892 387717642 /nfs/dbraw/zinc/71/76/42/387717642.db2.gz BSTMORMGLDEYGK-OCCSQVGLSA-N 2 0 240.391 2.066 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@@]1(C)CCCC[C@@H]1O ZINC000422819460 387717933 /nfs/dbraw/zinc/71/79/33/387717933.db2.gz IIMPEKZBOGNPFZ-HZSPNIEDSA-N 2 0 242.407 2.035 20 0 BEADRP C1CC([C@@H]2CC[C@H]2[NH2+][C@@H]2CCC[NH2+]CC2)C1 ZINC000643522877 387723991 /nfs/dbraw/zinc/72/39/91/387723991.db2.gz UFIVGUJALDAIKB-HZSPNIEDSA-N 2 0 222.376 2.297 20 0 BEADRP C1CC([C@@H]2CC[C@@H]2[NH2+][C@@H]2CCC[NH2+]CC2)C1 ZINC000643522880 387725827 /nfs/dbraw/zinc/72/58/27/387725827.db2.gz UFIVGUJALDAIKB-RDBSUJKOSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H]([NH2+]CC(C)(C)c1ccccc1)C1C[NH2+]C1 ZINC000422831955 387726922 /nfs/dbraw/zinc/72/69/22/387726922.db2.gz KKKQHMGGZMBLFA-LBPRGKRZSA-N 2 0 232.371 2.162 20 0 BEADRP Cc1cccc(CC[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)c1 ZINC000422844215 387731444 /nfs/dbraw/zinc/73/14/44/387731444.db2.gz LFGVXMMWKOZAJB-XYPWUTKMSA-N 2 0 244.382 2.410 20 0 BEADRP Cc1ccc([C@H](C)[NH2+][C@@H]2CC[NH2+]C[C@@H]2C)c(C)n1 ZINC000643524915 387740913 /nfs/dbraw/zinc/74/09/13/387740913.db2.gz WXBPPUUHUSJOEW-VZJVUDMVSA-N 2 0 247.386 2.347 20 0 BEADRP C(C1CCC1)[N@@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000441453698 387761918 /nfs/dbraw/zinc/76/19/18/387761918.db2.gz YGTSRUVTCKGYCU-AWEZNQCLSA-N 2 0 222.376 2.204 20 0 BEADRP CC(C)C[C@H](C)C[C@H](C)[NH2+]C[C@H](C)[NH3+] ZINC000643527123 387762926 /nfs/dbraw/zinc/76/29/26/387762926.db2.gz JYVUJTRHRQSIQS-SRVKXCTJSA-N 2 0 200.370 2.384 20 0 BEADRP C[C@H]([NH3+])C[NH2+][C@@H]1CC[C@@](C)(c2ccccc2)C1 ZINC000643527912 387763124 /nfs/dbraw/zinc/76/31/24/387763124.db2.gz VFOQJTGRWZRDLW-NWANDNLSSA-N 2 0 232.371 2.434 20 0 BEADRP Cc1cccnc1[C@@H]1CCC[C@@H]([NH2+]C[C@@H](C)[NH3+])C1 ZINC000643527107 387763491 /nfs/dbraw/zinc/76/34/91/387763491.db2.gz JWWLTLMQPKXCKG-MGPQQGTHSA-N 2 0 247.386 2.353 20 0 BEADRP Cc1cccnc1[C@@H]1CCC[C@H]([NH2+]C[C@H](C)[NH3+])C1 ZINC000643527109 387764127 /nfs/dbraw/zinc/76/41/27/387764127.db2.gz JWWLTLMQPKXCKG-MJBXVCDLSA-N 2 0 247.386 2.353 20 0 BEADRP C[C@@H]([NH3+])C[NH2+][C@H](C)CCCC(F)(F)F ZINC000643527581 387765050 /nfs/dbraw/zinc/76/50/50/387765050.db2.gz OSWWBWTVZRDGFM-HTQZYQBOSA-N 2 0 212.259 2.044 20 0 BEADRP C[C@@H]([NH2+]CCC1=CCCCC1)C1C[NH2+]C1 ZINC000422961626 387811910 /nfs/dbraw/zinc/81/19/10/387811910.db2.gz COJSLXUPBHGAKP-LLVKDONJSA-N 2 0 208.349 2.074 20 0 BEADRP C[C@H]([NH3+])C[NH2+][C@@H](C)CCc1ccccc1F ZINC000643528325 387767052 /nfs/dbraw/zinc/76/70/52/387767052.db2.gz HAUVSKVRIFENCT-QWRGUYRKSA-N 2 0 224.323 2.084 20 0 BEADRP COc1ccc([C@H]2C[C@@H]2[C@H](C)[NH2+]C[C@H](C)[NH3+])cc1 ZINC000643527744 387767257 /nfs/dbraw/zinc/76/72/57/387767257.db2.gz RSAXOVKMPXNXKS-UOVKNHIHSA-N 2 0 248.370 2.124 20 0 BEADRP Cc1ccc([C@H]([NH2+]C[C@@H](C)[NH3+])C2CC2)cc1 ZINC000643528247 387767304 /nfs/dbraw/zinc/76/73/04/387767304.db2.gz FZFFWKRAPAWVCP-RISCZKNCSA-N 2 0 218.344 2.383 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CCc2ccccc21 ZINC000422910693 387768675 /nfs/dbraw/zinc/76/86/75/387768675.db2.gz RJOOOBGUSGJSIO-LZWOXQAQSA-N 2 0 244.382 2.433 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CCCc1cccc(F)c1 ZINC000422912918 387770756 /nfs/dbraw/zinc/77/07/56/387770756.db2.gz XJEXNRZPAFNZBK-RYUDHWBXSA-N 2 0 238.350 2.474 20 0 BEADRP c1ccc(C[C@H]([NH2+]C2CC[NH2+]CC2)C2CC2)cc1 ZINC000422912029 387770983 /nfs/dbraw/zinc/77/09/83/387770983.db2.gz MERZZCDGCOQOHV-INIZCTEOSA-N 2 0 244.382 2.349 20 0 BEADRP CCC1(C[NH2+][C@H]2CCCCC[C@H]2[NH3+])CC1 ZINC000422918612 387773434 /nfs/dbraw/zinc/77/34/34/387773434.db2.gz HUICXQIOTIJKFQ-NEPJUHHUSA-N 2 0 210.365 2.426 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+][C@H]1C[C@H]1C1CCCCC1 ZINC000422919660 387775312 /nfs/dbraw/zinc/77/53/12/387775312.db2.gz KTGHUBJLSMKSGY-CRWXNKLISA-N 2 0 222.376 2.425 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+][C@@H]1C[C@H]1C1CCCCC1 ZINC000422919662 387775362 /nfs/dbraw/zinc/77/53/62/387775362.db2.gz KTGHUBJLSMKSGY-RFQIPJPRSA-N 2 0 222.376 2.425 20 0 BEADRP CCC1(C[NH2+][C@@H]2CC[NH2+]CC[C@@H]2C)CC1 ZINC000422920240 387775706 /nfs/dbraw/zinc/77/57/06/387775706.db2.gz MAIUUYBMRLOAAM-NWDGAFQWSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H]([NH3+])C[NH2+][C@H]1CCCC12CCCCC2 ZINC000643529608 387776871 /nfs/dbraw/zinc/77/68/71/387776871.db2.gz GEDDXKIVKAPUMB-RYUDHWBXSA-N 2 0 210.365 2.426 20 0 BEADRP CC(C)[C@H]1OCCC[C@H]1C[NH2+][C@H](C)CCC[NH3+] ZINC000422924946 387777623 /nfs/dbraw/zinc/77/76/23/387777623.db2.gz ZKXOTTRFYYOXFF-HZSPNIEDSA-N 2 0 242.407 2.155 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+][C@H]1C[C@H]1Cc1ccccc1 ZINC000422926611 387779343 /nfs/dbraw/zinc/77/93/43/387779343.db2.gz XBQPMZCSVZZFBH-FZKCQIBNSA-N 2 0 244.382 2.335 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H]1C[C@H]1Cc1ccccc1 ZINC000422926660 387779601 /nfs/dbraw/zinc/77/96/01/387779601.db2.gz XGPPJCQSYMDSDG-DDHJSBNISA-N 2 0 232.371 2.333 20 0 BEADRP C[C@@H]([NH2+]C1C[C@@H](C)O[C@H](C)C1)[C@@H]1CCCC[NH2+]1 ZINC000643477781 387780955 /nfs/dbraw/zinc/78/09/55/387780955.db2.gz SPPVTESGEFCQHW-BYNQJWBRSA-N 2 0 240.391 2.063 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CC2CC=CC2)CC[N@@H+]1C ZINC000527945550 387781547 /nfs/dbraw/zinc/78/15/47/387781547.db2.gz SGIYLIYGBRAERS-WCQYABFASA-N 2 0 208.349 2.025 20 0 BEADRP COc1ccc(C[NH2+][C@@H](C)C[C@@H](C)[NH3+])c(F)c1 ZINC000422932356 387781882 /nfs/dbraw/zinc/78/18/82/387781882.db2.gz ZBHZTNILNHGJDU-ZJUUUORDSA-N 2 0 240.322 2.050 20 0 BEADRP CCCC1(C[NH2+][C@@H](C)C2C[NH2+]C2)CCC1 ZINC000422932055 387781904 /nfs/dbraw/zinc/78/19/04/387781904.db2.gz YOXYXJQUAKJVQZ-NSHDSACASA-N 2 0 210.365 2.154 20 0 BEADRP CC(C)CC1(C[NH2+][C@H]2CCC[C@H]2[NH3+])CC1 ZINC000422932570 387782116 /nfs/dbraw/zinc/78/21/16/387782116.db2.gz ZNMWBAZHJPLKNE-NEPJUHHUSA-N 2 0 210.365 2.282 20 0 BEADRP COc1ccc(C2([NH2+][C@H](C)C[C@@H](C)[NH3+])CC2)cc1 ZINC000422934478 387782499 /nfs/dbraw/zinc/78/24/99/387782499.db2.gz JMJOYJBSKHUBDC-VXGBXAGGSA-N 2 0 248.370 2.400 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]Cc1nc(C2CC2)cs1 ZINC000422935738 387783200 /nfs/dbraw/zinc/78/32/00/387783200.db2.gz HTHDKLFTHPVPIC-SECBINFHSA-N 2 0 239.388 2.238 20 0 BEADRP Cc1cc(C)cc(OCC[NH2+][C@H]2CCC[C@H]2[NH3+])c1 ZINC000422944351 387785135 /nfs/dbraw/zinc/78/51/35/387785135.db2.gz MBRHIDDFTPBZSP-CABCVRRESA-N 2 0 248.370 2.152 20 0 BEADRP C[C@@H](CC[N@@H+]1CC[C@H](C[NH3+])C1)c1ccccc1 ZINC000050245563 387794604 /nfs/dbraw/zinc/79/46/04/387794604.db2.gz KRYJPHUVKDNLFB-UONOGXRCSA-N 2 0 232.371 2.461 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+][C@@H](C)c1ccccc1 ZINC000422986727 387796126 /nfs/dbraw/zinc/79/61/26/387796126.db2.gz HFMFHXXJCVJXHV-WOPDTQHZSA-N 2 0 206.333 2.463 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1[C@@H]2Cc3ccccc3[C@H]12 ZINC000422988957 387798548 /nfs/dbraw/zinc/79/85/48/387798548.db2.gz JZXMIVSCSSUJLC-OTJKEOIZSA-N 2 0 242.366 2.042 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CCc2ccccc2C1 ZINC000643478047 387803131 /nfs/dbraw/zinc/80/31/31/387803131.db2.gz PURWDMFUIIFXDD-MAZHCROVSA-N 2 0 244.382 2.261 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]CCC1=CCCCC1 ZINC000422965120 387813344 /nfs/dbraw/zinc/81/33/44/387813344.db2.gz NTZKOFZSJAQXPX-OLZOCXBDSA-N 2 0 208.349 2.346 20 0 BEADRP COc1cccc(C2([NH2+][C@@H](C)C[C@H](C)[NH3+])CC2)c1 ZINC000422951902 387807053 /nfs/dbraw/zinc/80/70/53/387807053.db2.gz ARXFJVKUHOEMOB-RYUDHWBXSA-N 2 0 248.370 2.400 20 0 BEADRP Cc1cccc(C)c1OCC[NH2+][C@H]1CCC[C@@H]1[NH3+] ZINC000422948668 387807272 /nfs/dbraw/zinc/80/72/72/387807272.db2.gz RVFCMYDZOWRZOH-KBPBESRZSA-N 2 0 248.370 2.152 20 0 BEADRP CC[C@@H]([NH2+]C1CCSCC1)[C@@H]1CCC[NH2+]1 ZINC000422949229 387807316 /nfs/dbraw/zinc/80/73/16/387807316.db2.gz UNLZKMJUAMSVEV-NEPJUHHUSA-N 2 0 228.405 2.002 20 0 BEADRP COc1cc(C)cc(C[NH2+][C@H](C)C[C@@H](C)[NH3+])c1 ZINC000423001629 387807327 /nfs/dbraw/zinc/80/73/27/387807327.db2.gz IFLVWLNMDFMNES-VXGBXAGGSA-N 2 0 236.359 2.219 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H]1CC1(C)C)[C@@H]1CCC[NH2+]1 ZINC000422954596 387808895 /nfs/dbraw/zinc/80/88/95/387808895.db2.gz JGGUCRXLEQXDSP-TUAOUCFPSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH2+][C@@H]1c2ccccc2C[C@H]1C)C1C[NH2+]C1 ZINC000422958053 387810389 /nfs/dbraw/zinc/81/03/89/387810389.db2.gz OHICMUZESSMQHN-ZETOZRRWSA-N 2 0 230.355 2.117 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CCc1cccc(F)c1F ZINC000422959476 387810914 /nfs/dbraw/zinc/81/09/14/387810914.db2.gz SEFYXXVFUQTCOW-SNVBAGLBSA-N 2 0 242.313 2.224 20 0 BEADRP C[C@H]([NH2+]CCC1CC[NH+](C)CC1)[C@@H]1CC12CC2 ZINC000527857896 387757898 /nfs/dbraw/zinc/75/78/98/387757898.db2.gz FIFWLDHAAQFNOF-JSGCOSHPSA-N 2 0 236.403 2.497 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+]C[C@@H](C)[NH3+])[C@H](C)C2 ZINC000643526606 387758386 /nfs/dbraw/zinc/75/83/86/387758386.db2.gz CCGUSYWKKQWRJA-JTNHKYCSSA-N 2 0 218.344 2.165 20 0 BEADRP Cc1nc(C)c(CC[NH2+][C@@H](C)C[C@H](C)[NH3+])s1 ZINC000422885576 387760877 /nfs/dbraw/zinc/76/08/77/387760877.db2.gz HAWHDSGJYLVQTN-IUCAKERBSA-N 2 0 241.404 2.018 20 0 BEADRP C[C@H]([NH3+])C[NH2+][C@H]1CC[C@H](c2ccccc2)C1 ZINC000643526734 387761425 /nfs/dbraw/zinc/76/14/25/387761425.db2.gz FQEZWUVPXFOSJF-UBHSHLNASA-N 2 0 218.344 2.260 20 0 BEADRP C(C1CCC1)[N@@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000441453700 387761543 /nfs/dbraw/zinc/76/15/43/387761543.db2.gz YGTSRUVTCKGYCU-CQSZACIVSA-N 2 0 222.376 2.204 20 0 BEADRP C[C@H](Cc1ccc(O)cc1)[NH2+][C@@H](C)CCC[NH3+] ZINC000422972609 387821041 /nfs/dbraw/zinc/82/10/41/387821041.db2.gz MITLZOUAVIKNQT-NWDGAFQWSA-N 2 0 236.359 2.040 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]1[NH2+]CCCCc1ccccc1 ZINC000643458312 387823464 /nfs/dbraw/zinc/82/34/64/387823464.db2.gz IUBXJFPFLVZPID-GJZGRUSLSA-N 2 0 232.371 2.479 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]CCCCc1ccccc1 ZINC000643458313 387823670 /nfs/dbraw/zinc/82/36/70/387823670.db2.gz IUBXJFPFLVZPID-HUUCEWRRSA-N 2 0 232.371 2.479 20 0 BEADRP C[C@@H](Cc1ccc(O)cc1)[NH2+][C@@H](C)[C@H]1CCC[NH2+]1 ZINC000422976102 387825701 /nfs/dbraw/zinc/82/57/01/387825701.db2.gz UQISMFQKNZFOSB-SLEUVZQESA-N 2 0 248.370 2.053 20 0 BEADRP CC(C)[NH+](CCCN[C@@H](C)C[C@@H](C)[NH3+])C(C)C ZINC000423003550 387825962 /nfs/dbraw/zinc/82/59/62/387825962.db2.gz HWCOTVPWYGAWOM-KGLIPLIRSA-N 2 0 243.439 2.211 20 0 BEADRP C[C@@H](Cc1ccc(O)cc1)[NH2+][C@@H](C)[C@@H]1CCC[NH2+]1 ZINC000422976099 387826590 /nfs/dbraw/zinc/82/65/90/387826590.db2.gz UQISMFQKNZFOSB-HUBLWGQQSA-N 2 0 248.370 2.053 20 0 BEADRP C([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)C1(C2CC2)CCC1 ZINC000423003718 387827340 /nfs/dbraw/zinc/82/73/40/387827340.db2.gz NDWROQKPMRSJLP-PBWFPOADSA-N 2 0 234.387 2.439 20 0 BEADRP Cc1cc(C)c(CC[NH2+][C@H](C)C2C[NH2+]C2)c(C)c1 ZINC000423006764 387829214 /nfs/dbraw/zinc/82/92/14/387829214.db2.gz WHKSAVAFSLFWET-CQSZACIVSA-N 2 0 246.398 2.352 20 0 BEADRP C[C@@H](Cc1ccoc1)[NH2+]C1CCC([NH3+])CC1 ZINC000423008471 387831726 /nfs/dbraw/zinc/83/17/26/387831726.db2.gz SUAMNKDUFUBTOB-PKSQDBQZSA-N 2 0 222.332 2.070 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@H](C)Cc1ccoc1 ZINC000423007921 387832021 /nfs/dbraw/zinc/83/20/21/387832021.db2.gz RVFNHAGFHTWVBN-VXGBXAGGSA-N 2 0 224.348 2.318 20 0 BEADRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]CC12CCC(CC1)C2 ZINC000423011494 387833608 /nfs/dbraw/zinc/83/36/08/387833608.db2.gz IXEBCGRZMQVUEW-DKNRTOFZSA-N 2 0 222.376 2.284 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]Cc1ccc(Cl)cn1 ZINC000423011618 387834253 /nfs/dbraw/zinc/83/42/53/387834253.db2.gz BDONVRVZPUOBKF-JTQLQIEISA-N 2 0 241.766 2.342 20 0 BEADRP CC(C)CSCCC[NH2+][C@@H](C)CCC[NH3+] ZINC000423012409 387835225 /nfs/dbraw/zinc/83/52/25/387835225.db2.gz KRJAYDCWKBSKAH-LBPRGKRZSA-N 2 0 232.437 2.483 20 0 BEADRP CC(C)CSCC[NH2+][C@@H](C)C[C@@H](C)[NH3+] ZINC000423012169 387836475 /nfs/dbraw/zinc/83/64/75/387836475.db2.gz KEPWUQMNBSBKCT-MNOVXSKESA-N 2 0 218.410 2.091 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@H](c1cccnc1)C1CC1 ZINC000423012000 387836878 /nfs/dbraw/zinc/83/68/78/387836878.db2.gz JXHZEORHWGZIQK-WDMOLILDSA-N 2 0 233.359 2.248 20 0 BEADRP Cc1ccsc1CC[NH2+][C@H]1CCC[C@H]1C[NH3+] ZINC000423015008 387838453 /nfs/dbraw/zinc/83/84/53/387838453.db2.gz JVAZFKSSVDVEKB-RYUDHWBXSA-N 2 0 238.400 2.316 20 0 BEADRP Cc1ccsc1CC[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000423014951 387838604 /nfs/dbraw/zinc/83/86/04/387838604.db2.gz JPAIKTYFRSYIRM-QWRGUYRKSA-N 2 0 226.389 2.314 20 0 BEADRP Cc1cnccc1CC[NH2+][C@H]1CCCCC[C@@H]1[NH3+] ZINC000423016236 387839151 /nfs/dbraw/zinc/83/91/51/387839151.db2.gz SKRYVDXFQVOXOG-GJZGRUSLSA-N 3 0 247.386 2.182 20 0 BEADRP C[C@@H]1C[C@H](C[NH3+])C[N@@H+]1[C@@H]1CCc2ccc(F)cc21 ZINC000442779848 387839359 /nfs/dbraw/zinc/83/93/59/387839359.db2.gz JQVCJFMBVCIOKL-UEKVPHQBSA-N 2 0 248.345 2.482 20 0 BEADRP Cc1cnccc1CC[NH2+][C@@H]1CCCCC[C@H]1[NH3+] ZINC000423016237 387839688 /nfs/dbraw/zinc/83/96/88/387839688.db2.gz SKRYVDXFQVOXOG-HUUCEWRRSA-N 3 0 247.386 2.182 20 0 BEADRP Cc1ccsc1CC[NH2+][C@H](C)C[C@@H](C)[NH3+] ZINC000423014949 387839706 /nfs/dbraw/zinc/83/97/06/387839706.db2.gz JPAIKTYFRSYIRM-GHMZBOCLSA-N 2 0 226.389 2.314 20 0 BEADRP Cc1cc(C[NH+](C)C)cc(N[C@H]2CCC[C@H]2[NH3+])c1 ZINC000423028481 387846399 /nfs/dbraw/zinc/84/63/99/387846399.db2.gz QYJREODTLLXBNJ-CABCVRRESA-N 2 0 247.386 2.348 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]C[C@@H]1CCCCS1 ZINC000423029073 387847289 /nfs/dbraw/zinc/84/72/89/387847289.db2.gz HPCLHZDZBVWAPZ-FRRDWIJNSA-N 2 0 242.432 2.250 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CCCCS1)[C@H]1CCC[NH2+]1 ZINC000423033992 387848911 /nfs/dbraw/zinc/84/89/11/387848911.db2.gz PJEGXYYHGNLUOP-GRYCIOLGSA-N 2 0 228.405 2.002 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1ccccc1 ZINC000643533689 387849141 /nfs/dbraw/zinc/84/91/41/387849141.db2.gz BTSKUESEHQJEHF-GXTWGEPZSA-N 2 0 230.355 2.479 20 0 BEADRP C[C@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1ccccc1 ZINC000643533690 387849272 /nfs/dbraw/zinc/84/92/72/387849272.db2.gz BTSKUESEHQJEHF-JSGCOSHPSA-N 2 0 230.355 2.479 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CCC[C@@H]1CCCCO1 ZINC000423031795 387849593 /nfs/dbraw/zinc/84/95/93/387849593.db2.gz DQTBSLSLLRGQQD-OLZOCXBDSA-N 2 0 228.380 2.053 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)CCCC[NH3+])c1cncc(F)c1 ZINC000423037472 387850589 /nfs/dbraw/zinc/85/05/89/387850589.db2.gz WAEAJYCNTCUZBG-WDEREUQCSA-N 2 0 239.338 2.389 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[C@@H](C)[C@@H](C)C1)C1C[NH2+]C1 ZINC000423040755 387853335 /nfs/dbraw/zinc/85/33/35/387853335.db2.gz VCBOQZMLLBIDSY-BLFANLJRSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[C@@H](C)[C@@H](C)C1)C1C[NH2+]C1 ZINC000423040758 387853419 /nfs/dbraw/zinc/85/34/19/387853419.db2.gz VCBOQZMLLBIDSY-XZUYRWCXSA-N 2 0 210.365 2.009 20 0 BEADRP CC(C)O[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H]2[NH3+])C1(C)C ZINC000423044093 387854828 /nfs/dbraw/zinc/85/48/28/387854828.db2.gz ATBZJUWYILMDHJ-QNWHQSFQSA-N 2 0 240.391 2.048 20 0 BEADRP CC(C)O[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@@H]2[NH3+])C1(C)C ZINC000423044094 387854877 /nfs/dbraw/zinc/85/48/77/387854877.db2.gz ATBZJUWYILMDHJ-ZDEQEGDKSA-N 2 0 240.391 2.048 20 0 BEADRP COCC[C@@H]([NH2+][C@@H](C)CCC[NH3+])c1ccco1 ZINC000423041777 387855630 /nfs/dbraw/zinc/85/56/30/387855630.db2.gz JTAKCNVTJKNPEH-NWDGAFQWSA-N 2 0 240.347 2.074 20 0 BEADRP CC[C@@H]([NH2+]CC[C@H]1CCCCO1)[C@@H]1CCC[NH2+]1 ZINC000423043313 387855840 /nfs/dbraw/zinc/85/58/40/387855840.db2.gz OHKKOTZKFCLRHP-MCIONIFRSA-N 2 0 240.391 2.066 20 0 BEADRP C[C@@H]([NH2+]CCC[C@@H]1CCCCO1)[C@H]1CCC[NH2+]1 ZINC000423041668 387856143 /nfs/dbraw/zinc/85/61/43/387856143.db2.gz XQHTYDSSVUKAPC-HZSPNIEDSA-N 2 0 240.391 2.066 20 0 BEADRP CC(C)C[C@@H]1C[C@@H]([NH2+][C@@H](C)CCC[NH3+])CCO1 ZINC000423043290 387856218 /nfs/dbraw/zinc/85/62/18/387856218.db2.gz OEGFKRQBSKSHKG-MELADBBJSA-N 2 0 242.407 2.297 20 0 BEADRP C[C@H](NC1(Cc2ccccc2)CC1)[C@H]1CCC[NH2+]1 ZINC000423049679 387857115 /nfs/dbraw/zinc/85/71/15/387857115.db2.gz KFIMTNOUTZJWND-DZGCQCFKSA-N 2 0 244.382 2.492 20 0 BEADRP CC(C)C[C@@H]1C[C@H]([NH2+][C@@H](C)C[C@@H](C)[NH3+])CCO1 ZINC000423046270 387858307 /nfs/dbraw/zinc/85/83/07/387858307.db2.gz TUQKOTXIRCUDFT-XJFOESAGSA-N 2 0 242.407 2.296 20 0 BEADRP CCCCCC[N@H+]1C[C@H]2C[NH+](C)C[C@H]2C1 ZINC000193637702 387858544 /nfs/dbraw/zinc/85/85/44/387858544.db2.gz LCWIIJHJRKECNK-BETUJISGSA-N 2 0 210.365 2.060 20 0 BEADRP CSCCCCC[NH2+][C@H]1CC[NH2+]CC[C@H]1C ZINC000423049924 387859283 /nfs/dbraw/zinc/85/92/83/387859283.db2.gz KIIRTQPLWKBNDS-OLZOCXBDSA-N 2 0 244.448 2.497 20 0 BEADRP Cc1ccc(CC[NH+]2C[C@H]3C[N@H+](C)C[C@H]3C2)cc1 ZINC000193616137 387859974 /nfs/dbraw/zinc/85/99/74/387859974.db2.gz XIJNHZXHAJFTHR-IYBDPMFKSA-N 2 0 244.382 2.031 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@H](C)C(F)(F)F ZINC000423057556 387862509 /nfs/dbraw/zinc/86/25/09/387862509.db2.gz ZNXVIQFQORTHLA-DTWKUNHWSA-N 2 0 226.286 2.292 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]C[C@H](C)C(F)(F)F ZINC000423057557 387862563 /nfs/dbraw/zinc/86/25/63/387862563.db2.gz ZNXVIQFQORTHLA-IUCAKERBSA-N 2 0 226.286 2.292 20 0 BEADRP CC(C)C(C)(C)C[NH2+][C@@H]1CCOC[C@H]1[C@H](C)[NH3+] ZINC000423059054 387865211 /nfs/dbraw/zinc/86/52/11/387865211.db2.gz KVPNHXQPODWRSN-RWMBFGLXSA-N 2 0 242.407 2.011 20 0 BEADRP CC(C)C(C)(C)C[NH2+][C@@H]1CCOC[C@@H]1[C@H](C)[NH3+] ZINC000423059056 387865291 /nfs/dbraw/zinc/86/52/91/387865291.db2.gz KVPNHXQPODWRSN-YNEHKIRRSA-N 2 0 242.407 2.011 20 0 BEADRP Cc1cncc([C@@H](C)[NH2+][C@@H]2CC23CC[NH2+]CC3)c1 ZINC000643535842 387866624 /nfs/dbraw/zinc/86/66/24/387866624.db2.gz PJMPRACDDYCWRD-TZMCWYRMSA-N 2 0 245.370 2.183 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[C@@H](OC)C1)[C@@H]1CCCC[NH2+]1 ZINC000423068314 387869324 /nfs/dbraw/zinc/86/93/24/387869324.db2.gz JRDXGOZVASKHRR-MQYQWHSLSA-N 2 0 240.391 2.064 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCN(C)[C@H](C)C1)[C@H]1C[C@H]1C ZINC000322068557 387874693 /nfs/dbraw/zinc/87/46/93/387874693.db2.gz SECLLWXUOXFXOR-POQQGIQPSA-N 2 0 224.392 2.493 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@H]2CC[NH2+]CC[C@@H]2C)C1 ZINC000423066765 387869452 /nfs/dbraw/zinc/86/94/52/387869452.db2.gz XTVSSYVIXWTZNR-VOAKCMCISA-N 2 0 210.365 2.153 20 0 BEADRP CCC(O)(CC)CC[NH2+][C@@H]1CCCC[C@H]1C[NH3+] ZINC000423067096 387870739 /nfs/dbraw/zinc/87/07/39/387870739.db2.gz GHZAGFNQDFNGIQ-QWHCGFSZSA-N 2 0 242.407 2.035 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC12CCCC2)[C@@H]1CCC[NH2+]1 ZINC000423069229 387871360 /nfs/dbraw/zinc/87/13/60/387871360.db2.gz ASSBLKXGERHHJU-RWMBFGLXSA-N 2 0 222.376 2.439 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]C[C@@](C)(O)C1CCCCC1 ZINC000423072303 387872315 /nfs/dbraw/zinc/87/23/15/387872315.db2.gz JCPPQCIPZGFPGW-GXTWGEPZSA-N 2 0 242.407 2.035 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CCCC(F)(F)F ZINC000422962463 387813825 /nfs/dbraw/zinc/81/38/25/387813825.db2.gz CORPZFHWZQCSLH-SFYZADRCSA-N 2 0 212.259 2.044 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@H]1CCCc2occc21 ZINC000422964191 387814373 /nfs/dbraw/zinc/81/43/73/387814373.db2.gz KPKOLBBDULEISN-UMNHJUIQSA-N 2 0 222.332 2.372 20 0 BEADRP [NH3+]CC1CCC([NH2+]C[C@@H]2CC=CCC2)CC1 ZINC000422966492 387816411 /nfs/dbraw/zinc/81/64/11/387816411.db2.gz AHILQLCIVBCFOD-ROKHWSDSSA-N 2 0 222.376 2.450 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+]CCCC(F)(F)F ZINC000422968230 387817028 /nfs/dbraw/zinc/81/70/28/387817028.db2.gz QSUULEAQMAIMSV-UWVGGRQHSA-N 2 0 238.297 2.307 20 0 BEADRP COc1cccc([C@@H]2CCCN2C[C@H](C)[NH3+])c1 ZINC000442667145 387819453 /nfs/dbraw/zinc/81/94/53/387819453.db2.gz YGJAXQUTODAHIU-FZMZJTMJSA-N 2 0 234.343 2.179 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1CCO[C@H](C2CC2)C1 ZINC000423054579 387890353 /nfs/dbraw/zinc/89/03/53/387890353.db2.gz VAGIAWWYEUYZRR-BNOWGMLFSA-N 2 0 240.391 2.051 20 0 BEADRP CC1=CCC[C@H](C)[C@H]1C[N@H+]1C[C@H]2C[NH+](C)C[C@H]2C1 ZINC000194543034 387891957 /nfs/dbraw/zinc/89/19/57/387891957.db2.gz ADKJSMTXAOIOAS-JONQDZQNSA-N 2 0 248.414 2.472 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@@H](C)c1ccc2n[nH]cc2c1 ZINC000423104920 387892002 /nfs/dbraw/zinc/89/20/02/387892002.db2.gz HNMQYZUFCMZZLG-QWRGUYRKSA-N 2 0 246.358 2.341 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CCc1ccc2[nH]ccc2c1 ZINC000423109803 387893740 /nfs/dbraw/zinc/89/37/40/387893740.db2.gz UZBWRDWZCJNXPJ-NEPJUHHUSA-N 2 0 245.370 2.426 20 0 BEADRP CCSCCC[NH2+][C@@H]1CCCCC[C@@H]1[NH3+] ZINC000423110689 387894241 /nfs/dbraw/zinc/89/42/41/387894241.db2.gz IICLVNRFMIFNSF-NWDGAFQWSA-N 2 0 230.421 2.379 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+][C@@H]1CCC1(C)C ZINC000423113345 387894970 /nfs/dbraw/zinc/89/49/70/387894970.db2.gz UDWKQGYHGQOPCP-IJLUTSLNSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+][C@H]1CCC1(C)C ZINC000423113347 387895072 /nfs/dbraw/zinc/89/50/72/387895072.db2.gz UDWKQGYHGQOPCP-WOPDTQHZSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+][C@@H]1CCC1(C)C ZINC000423113344 387895134 /nfs/dbraw/zinc/89/51/34/387895134.db2.gz UDWKQGYHGQOPCP-GRYCIOLGSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@@H]([NH2+][C@H]1CCC1(C)C)[C@@H]1CCC[NH2+]1 ZINC000423111951 387896923 /nfs/dbraw/zinc/89/69/23/387896923.db2.gz RIXKGOXWWOSRCI-WOPDTQHZSA-N 2 0 210.365 2.295 20 0 BEADRP COCC[C@H]([NH2+]C1CCC([NH3+])CC1)C(C)(C)C ZINC000423115389 387897046 /nfs/dbraw/zinc/89/70/46/387897046.db2.gz NEUJTRJBMFNFOR-BPCQOVAHSA-N 2 0 242.407 2.297 20 0 BEADRP CC(C)=CCC[NH2+]C1CCC(C[NH3+])CC1 ZINC000423076840 387876122 /nfs/dbraw/zinc/87/61/22/387876122.db2.gz ZXTDFWSYCGKMNP-UHFFFAOYSA-N 2 0 210.365 2.450 20 0 BEADRP CCC(C)(C)C[NH2+][C@H]1CC[NH2+]CC[C@H]1C ZINC000423076294 387876874 /nfs/dbraw/zinc/87/68/74/387876874.db2.gz QTMUIJWYCQLTQO-NEPJUHHUSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H]([NH2+]CC1(C)CCC(C)CC1)C1C[NH2+]C1 ZINC000423082572 387878524 /nfs/dbraw/zinc/87/85/24/387878524.db2.gz DLTVAHQCUCZIBV-MBHSVXNSSA-N 2 0 224.392 2.400 20 0 BEADRP Cc1ccc([C@H](C)[NH2+][C@H](C)CCC[NH3+])c(C)n1 ZINC000643539201 387879635 /nfs/dbraw/zinc/87/96/35/387879635.db2.gz FYBABBZMHRJSGN-PWSUYJOCSA-N 2 0 235.375 2.476 20 0 BEADRP FC(F)[C@H]1C[C@@H]1[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000423116080 387898482 /nfs/dbraw/zinc/89/84/82/387898482.db2.gz ZKTSEQGCBFSHDM-ROHXPCBUSA-N 2 0 244.329 2.150 20 0 BEADRP CSC1(C[NH2+][C@@H]2CCCCC[C@H]2[NH3+])CC1 ZINC000423085813 387881058 /nfs/dbraw/zinc/88/10/58/387881058.db2.gz KTDKKXNRJIVSAM-GHMZBOCLSA-N 2 0 228.405 2.132 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@H]1CCCc2ccccc2C1 ZINC000643540807 387883248 /nfs/dbraw/zinc/88/32/48/387883248.db2.gz VIZJOEIYSXOWKU-GJZGRUSLSA-N 2 0 232.371 2.261 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@@H]1CCCc2ccccc2C1 ZINC000643540809 387883737 /nfs/dbraw/zinc/88/37/37/387883737.db2.gz VIZJOEIYSXOWKU-LSDHHAIUSA-N 2 0 232.371 2.261 20 0 BEADRP COC1CCC(C)(C[NH2+][C@H](C)C[C@H](C)[NH3+])CC1 ZINC000423089854 387883903 /nfs/dbraw/zinc/88/39/03/387883903.db2.gz WDTFONJYSSFSDF-MRFVTOPCSA-N 2 0 242.407 2.297 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC000423093658 387885277 /nfs/dbraw/zinc/88/52/77/387885277.db2.gz IIYFSFTZUGKOFW-UTUOFQBUSA-N 2 0 246.345 2.400 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+]CCCc1ccccc1F ZINC000423097889 387886585 /nfs/dbraw/zinc/88/65/85/387886585.db2.gz RIUUFAXDKIRNCA-UONOGXRCSA-N 2 0 236.334 2.228 20 0 BEADRP Cc1cccc(CCC[NH2+][C@@H](C)C[C@H](C)[NH3+])n1 ZINC000423098469 387887690 /nfs/dbraw/zinc/88/76/90/387887690.db2.gz CTWFEXJYUYMZJC-AAEUAGOBSA-N 2 0 235.375 2.038 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+][C@H]2CC[NH2+]CC[C@H]2C)C1 ZINC000423101933 387888826 /nfs/dbraw/zinc/88/88/26/387888826.db2.gz WOJZJTZIKKLENX-MQYQWHSLSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1CC[C@@H](C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000423101258 387889152 /nfs/dbraw/zinc/88/91/52/387889152.db2.gz VSAYZIWPVNFSRC-LSGALXMHSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CCCSC1)[C@H]1CCCC[NH2+]1 ZINC000423119053 387900255 /nfs/dbraw/zinc/90/02/55/387900255.db2.gz CXYXMIGLJNMLMB-JHJVBQTASA-N 2 0 242.432 2.250 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H]1CCCC12CCOCC2 ZINC000423118019 387901293 /nfs/dbraw/zinc/90/12/93/387901293.db2.gz YHOFMQQFMPKYHH-RWMBFGLXSA-N 2 0 240.391 2.051 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]CCC1(F)CCC1 ZINC000423125152 387902263 /nfs/dbraw/zinc/90/22/63/387902263.db2.gz NBIMOAVRAJJYFT-RYUDHWBXSA-N 2 0 228.355 2.376 20 0 BEADRP COCC(C)(C)CCC[NH2+][C@H](C)C[C@@H](C)[NH3+] ZINC000423122566 387903345 /nfs/dbraw/zinc/90/33/45/387903345.db2.gz JZTCLLIKSXBSCB-VXGBXAGGSA-N 2 0 230.396 2.155 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC000423126547 387904566 /nfs/dbraw/zinc/90/45/66/387904566.db2.gz AVTYFZJRPLYGSL-BYNSBNAKSA-N 2 0 230.355 2.260 20 0 BEADRP CO[C@H](C)[C@@H](C)[NH2+][C@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000423125612 387904930 /nfs/dbraw/zinc/90/49/30/387904930.db2.gz AKZUMSHHSGBLFG-SYQHCUMBSA-N 2 0 242.407 2.310 20 0 BEADRP CC(C)(CC[NH2+][C@@H]1CCC[C@H]1[NH3+])C1CC1 ZINC000423128770 387906622 /nfs/dbraw/zinc/90/66/22/387906622.db2.gz DLBJQNAHVLMXGN-VXGBXAGGSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]([NH2+]C1CC(C(C)(C)C)C1)C1C[NH2+]C1 ZINC000423128793 387907044 /nfs/dbraw/zinc/90/70/44/387907044.db2.gz DNEJQXCKIIGDRU-OIKLOGQESA-N 2 0 210.365 2.009 20 0 BEADRP C[C@H]([NH2+]C1CC(C(C)(C)C)C1)C1C[NH2+]C1 ZINC000423128792 387907184 /nfs/dbraw/zinc/90/71/84/387907184.db2.gz DNEJQXCKIIGDRU-GCVQQVDUSA-N 2 0 210.365 2.009 20 0 BEADRP Cc1cccnc1C(C)(C)C[NH2+][C@@H](C)C[C@@H](C)[NH3+] ZINC000423132742 387908821 /nfs/dbraw/zinc/90/88/21/387908821.db2.gz CCTUIOLCBUFHHX-OLZOCXBDSA-N 2 0 249.402 2.383 20 0 BEADRP Cc1ccoc1C[NH2+]C1CCC(C[NH3+])CC1 ZINC000423131860 387909057 /nfs/dbraw/zinc/90/90/57/387909057.db2.gz OQBDNNXLCCHLMC-UHFFFAOYSA-N 2 0 222.332 2.195 20 0 BEADRP C[C@H](F)CC[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000423138786 387916989 /nfs/dbraw/zinc/91/69/89/387916989.db2.gz UBXXCPPYMNLVJJ-TVYUQYBPSA-N 2 0 222.307 2.469 20 0 BEADRP C[C@H](F)CC[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000423138788 387917117 /nfs/dbraw/zinc/91/71/17/387917117.db2.gz UBXXCPPYMNLVJJ-ZWKOPEQDSA-N 2 0 222.307 2.469 20 0 BEADRP Cc1csc(C[NH2+][C@H](C)C[C@@H](C)[NH3+])c1 ZINC000423156939 387937362 /nfs/dbraw/zinc/93/73/62/387937362.db2.gz UPFUWTXGICGBLE-NXEZZACHSA-N 2 0 212.362 2.272 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+][C@H]1CC[NH2+]CC[C@H]1C ZINC000423152702 387932474 /nfs/dbraw/zinc/93/24/74/387932474.db2.gz MAOPHLLJZFBCHV-NDBYEHHHSA-N 2 0 210.365 2.010 20 0 BEADRP Cc1cccnc1CCC[NH2+][C@@H](C)CCC[NH3+] ZINC000423155873 387934448 /nfs/dbraw/zinc/93/44/48/387934448.db2.gz RINQDPLOESWXNJ-ZDUSSCGKSA-N 2 0 235.375 2.040 20 0 BEADRP CC[C@@H]1CCC[C@@H]1C[NH2+][C@H]1CCC[C@H]1[NH3+] ZINC000423156268 387934802 /nfs/dbraw/zinc/93/48/02/387934802.db2.gz KWORSGMFAIKTAB-LPWJVIDDSA-N 2 0 210.365 2.282 20 0 BEADRP CC(F)(F)CC[NH2+][C@H]1CCCCC[C@@H]1[NH3+] ZINC000423142944 387921231 /nfs/dbraw/zinc/92/12/31/387921231.db2.gz BVSJGFSMWRUCRX-UWVGGRQHSA-N 2 0 220.307 2.281 20 0 BEADRP CC(C)[C@@H]1C[C@H]1C[NH2+][C@@H](C)[C@H]1CCC[NH2+]1 ZINC000423146506 387922094 /nfs/dbraw/zinc/92/20/94/387922094.db2.gz AOTQQQRRTOREDZ-ZDEQEGDKSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]C[C@@H]1CCCC1(F)F ZINC000423146643 387922470 /nfs/dbraw/zinc/92/24/70/387922470.db2.gz BAGKFZYVMDYAIM-GUBZILKMSA-N 2 0 220.307 2.137 20 0 BEADRP CC[C@H]([NH2+][C@H](C)CCCC[NH3+])C(F)F ZINC000423145997 387922559 /nfs/dbraw/zinc/92/25/59/387922559.db2.gz NKKYCAAHYFAZFO-BDAKNGLRSA-N 2 0 208.296 2.137 20 0 BEADRP CC(C)[C@@H]1C[C@H]1C[NH2+][C@H](C)[C@H]1CCC[NH2+]1 ZINC000423146504 387922821 /nfs/dbraw/zinc/92/28/21/387922821.db2.gz AOTQQQRRTOREDZ-MROQNXINSA-N 2 0 210.365 2.009 20 0 BEADRP CC1(F)CC([NH2+][C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)C1 ZINC000423146254 387923454 /nfs/dbraw/zinc/92/34/54/387923454.db2.gz OWEBHPSCFNDBDV-VWGAPNJBSA-N 2 0 240.366 2.387 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@H]1CCC[C@@H]2C[C@@H]21 ZINC000423167202 387951789 /nfs/dbraw/zinc/95/17/89/387951789.db2.gz DTSUSJIZEKCWKY-NDBYEHHHSA-N 2 0 210.365 2.282 20 0 BEADRP CCSCC[N@@H+]1CC2(C[C@H]1C)CC[NH2+]CC2 ZINC000424287483 387952159 /nfs/dbraw/zinc/95/21/59/387952159.db2.gz IWKOADFTNLDQRV-GFCCVEGCSA-N 2 0 242.432 2.204 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]C[C@@H]2C[C@H]2C2CCC2)CC[N@@H+]1C ZINC000424287754 387953363 /nfs/dbraw/zinc/95/33/63/387953363.db2.gz HWUZDLKXFKCEFO-MXAVVETBSA-N 2 0 236.403 2.495 20 0 BEADRP CC(C)O[C@H]1C[C@@H]([NH2+][C@H]2CCCC[C@H]2C[NH3+])C1 ZINC000423170119 387953994 /nfs/dbraw/zinc/95/39/94/387953994.db2.gz XODAPFOZHRVMIF-FQUUOJAGSA-N 2 0 240.391 2.050 20 0 BEADRP CCO[C@@H]1CCCC[C@H]1[NH2+][C@H](C)C[C@H](C)[NH3+] ZINC000423169234 387954147 /nfs/dbraw/zinc/95/41/47/387954147.db2.gz VTXIMCHZDGVGIY-UMSGYPCISA-N 2 0 228.380 2.050 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+]CCC1CC(F)(F)C1 ZINC000423169156 387954206 /nfs/dbraw/zinc/95/42/06/387954206.db2.gz VOKSMTRCNBCBTC-CMPLNLGQSA-N 2 0 246.345 2.400 20 0 BEADRP CC[C@]1(C(C)C)C[C@H]1[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000423169464 387954954 /nfs/dbraw/zinc/95/49/54/387954954.db2.gz VXEJGOWTWGCOCB-CYZMBNFOSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@H](c1ccccn1)[N@H+](C)CCc1cncn1C ZINC000459394963 387937503 /nfs/dbraw/zinc/93/75/03/387937503.db2.gz SUGOUQIVCJGOGC-GFCCVEGCSA-N 2 0 244.342 2.051 20 0 BEADRP CC[C@@H]1CCCC[C@H]1C[NH2+][C@H](C)C1C[NH2+]C1 ZINC000423160374 387940559 /nfs/dbraw/zinc/94/05/59/387940559.db2.gz QRYRLCZNIMGSNO-UPJWGTAASA-N 2 0 224.392 2.400 20 0 BEADRP CC[C@]1(C(C)C)C[C@@H]1[NH2+][C@H]1CCC[C@H]1[NH3+] ZINC000423160762 387941054 /nfs/dbraw/zinc/94/10/54/387941054.db2.gz HULSAPNJPIRPMA-MROQNXINSA-N 2 0 210.365 2.281 20 0 BEADRP CC[C@H](C)[C@H](C[NH2+][C@@H]1CC[NH2+]CC[C@@H]1C)OC ZINC000423159425 387941319 /nfs/dbraw/zinc/94/13/19/387941319.db2.gz PFKPXIIYTDIFNH-FQUUOJAGSA-N 2 0 242.407 2.025 20 0 BEADRP CC[C@]1(C(C)C)C[C@@H]1[NH2+][C@H]1CCC[C@@H]1[NH3+] ZINC000423160764 387942086 /nfs/dbraw/zinc/94/20/86/387942086.db2.gz HULSAPNJPIRPMA-ZDEQEGDKSA-N 2 0 210.365 2.281 20 0 BEADRP Cc1ccc(CC[NH2+][C@H]2CCCC[C@H]2C[NH3+])nc1 ZINC000423162663 387943463 /nfs/dbraw/zinc/94/34/63/387943463.db2.gz LLBNHWNAADXRAW-ZFWWWQNUSA-N 2 0 247.386 2.040 20 0 BEADRP C[C@H](CCC[NH3+])[N@@H+]1CCC[C@]2(CCSC2)C1 ZINC000423161417 387943701 /nfs/dbraw/zinc/94/37/01/387943701.db2.gz NUOBNXWEWZNJFC-OLZOCXBDSA-N 2 0 242.432 2.333 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H]2CCCC[C@H]2C[NH3+])nc1 ZINC000423162660 387944084 /nfs/dbraw/zinc/94/40/84/387944084.db2.gz LLBNHWNAADXRAW-DZGCQCFKSA-N 2 0 247.386 2.040 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]CCC1CC(F)(F)C1 ZINC000423164138 387945990 /nfs/dbraw/zinc/94/59/90/387945990.db2.gz OBTYGBBOWUCXMG-QWRGUYRKSA-N 2 0 232.318 2.139 20 0 BEADRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]CCC1CC(F)(F)C1 ZINC000423164137 387946706 /nfs/dbraw/zinc/94/67/06/387946706.db2.gz OBTYGBBOWUCXMG-MNOVXSKESA-N 2 0 232.318 2.139 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)[C@@H]1C[C@@H]1C ZINC000321097757 387947907 /nfs/dbraw/zinc/94/79/07/387947907.db2.gz OKQWFHGOOLBSSH-VIRABCJISA-N 2 0 236.403 2.495 20 0 BEADRP CC[C@@H]1CCC[C@@H]1C[NH2+][C@H](CCC[NH3+])COC ZINC000423164611 387948674 /nfs/dbraw/zinc/94/86/74/387948674.db2.gz XEXMABMJGWPACN-MGPQQGTHSA-N 2 0 242.407 2.156 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CCC[C@@H]1C1CC1 ZINC000423172219 387959080 /nfs/dbraw/zinc/95/90/80/387959080.db2.gz RVRBRHBJDBDUAR-DGAVXFQQSA-N 2 0 222.376 2.282 20 0 BEADRP CO[C@@H]1C[C@H]([NH2+][C@@H](C)CCCC[NH3+])C12CCC2 ZINC000423172998 387959582 /nfs/dbraw/zinc/95/95/82/387959582.db2.gz WKQIVEKSMWEDMI-RWMBFGLXSA-N 2 0 240.391 2.051 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+][C@@H]1C[C@H]1c1ccccc1F ZINC000423171535 387960069 /nfs/dbraw/zinc/96/00/69/387960069.db2.gz OVLASXNPMJYUQO-SCUASFONSA-N 2 0 234.318 2.151 20 0 BEADRP CC[C@H]([NH2+][C@H]1CS[C@@H](C)C1)[C@@H]1CCC[NH2+]1 ZINC000423173005 387960716 /nfs/dbraw/zinc/96/07/16/387960716.db2.gz WLKXDRCEUVKSMA-USZNOCQGSA-N 2 0 228.405 2.001 20 0 BEADRP CC[C@@H]([NH2+]C1CCC(OC)CC1)[C@@H]1CCC[NH2+]1 ZINC000423173120 387960831 /nfs/dbraw/zinc/96/08/31/387960831.db2.gz WZXUMBYSZFGMBA-PQAZSJQKSA-N 2 0 240.391 2.064 20 0 BEADRP C[C@@H]([NH2+]CCC[NH3+])c1cc(F)c(F)c(F)c1 ZINC000423177486 387963661 /nfs/dbraw/zinc/96/36/61/387963661.db2.gz IWSUIIXKBRTYBW-SSDOTTSWSA-N 2 0 232.249 2.103 20 0 BEADRP COc1ccc([C@@H](C)[C@H](C)[NH2+]CCC[NH3+])cc1 ZINC000423179437 387966744 /nfs/dbraw/zinc/96/67/44/387966744.db2.gz DFHQYHJNPQYZRM-RYUDHWBXSA-N 2 0 236.359 2.126 20 0 BEADRP CC[C@H](C[NH2+][C@H]1CCC[C@H]1[NH3+])CC(F)(F)F ZINC000423180932 387967145 /nfs/dbraw/zinc/96/71/45/387967145.db2.gz KXHQZNAUSOPSJG-AEJSXWLSSA-N 2 0 238.297 2.434 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]CC1([NH3+])CCCCC1 ZINC000423183386 387968367 /nfs/dbraw/zinc/96/83/67/387968367.db2.gz ROBDGDZOBQKNII-NEPJUHHUSA-N 2 0 210.365 2.426 20 0 BEADRP CC[C@H]1CC[C@@H]1[NH2+]CC1([NH3+])CCCCC1 ZINC000423183388 387968510 /nfs/dbraw/zinc/96/85/10/387968510.db2.gz ROBDGDZOBQKNII-RYUDHWBXSA-N 2 0 210.365 2.426 20 0 BEADRP C[NH2+]CCC[NH2+][C@H]1CCCc2cc(OC)ccc21 ZINC000423184697 387969796 /nfs/dbraw/zinc/96/97/96/387969796.db2.gz ILUBAEDHJGQBRL-HNNXBMFYSA-N 2 0 248.370 2.272 20 0 BEADRP C[C@@H]([NH2+]CC1([NH3+])CCCCC1)[C@@H]1C[C@H]1C ZINC000423187484 387971617 /nfs/dbraw/zinc/97/16/17/387971617.db2.gz XVEVORLFCOQPCG-IJLUTSLNSA-N 2 0 210.365 2.282 20 0 BEADRP Cc1ccc(CC[NH2+][C@H](C)CCCC[NH3+])nc1 ZINC000423171168 387957610 /nfs/dbraw/zinc/95/76/10/387957610.db2.gz ZOHKOJPFNAPNFE-CYBMUJFWSA-N 2 0 235.375 2.040 20 0 BEADRP CC[C@@H]([NH2+]C[C@H]1CC[N@H+](CC)C1)c1ccncc1 ZINC000453067925 387978783 /nfs/dbraw/zinc/97/87/83/387978783.db2.gz SFIQSVDKJLMBDD-UKRRQHHQSA-N 2 0 247.386 2.464 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+][C@@H]1C[C@H]1c1ccco1 ZINC000423194541 387979163 /nfs/dbraw/zinc/97/91/63/387979163.db2.gz WTDLUGGTFVYHKE-QNWHQSFQSA-N 2 0 234.343 2.113 20 0 BEADRP C[NH+](C)C[C@@H]1CC[N@H+](C[C@@H]2CC=CCC2)C1 ZINC000245739376 387979908 /nfs/dbraw/zinc/97/99/08/387979908.db2.gz LLAYEOXJBXUEQP-KGLIPLIRSA-N 2 0 222.376 2.226 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+][C@@H]1C[C@H]1c1ccco1 ZINC000423194539 387980222 /nfs/dbraw/zinc/98/02/22/387980222.db2.gz WTDLUGGTFVYHKE-FDYHWXHSSA-N 2 0 234.343 2.113 20 0 BEADRP Cc1cc([C@H](C)[NH2+]CCC[NH3+])cc(C)c1F ZINC000423188671 387972858 /nfs/dbraw/zinc/97/28/58/387972858.db2.gz MDLDDIXDBOWNMR-NSHDSACASA-N 2 0 224.323 2.442 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CCCCC[C@H]2[NH3+])CS1 ZINC000423189903 387974332 /nfs/dbraw/zinc/97/43/32/387974332.db2.gz RMHKHGUVWPVCQE-KXNHARMFSA-N 2 0 228.405 2.130 20 0 BEADRP C[C@@H](C[NH2+][C@H](C)[C@H]1CCC[NH2+]1)CC(F)(F)F ZINC000423196125 387981654 /nfs/dbraw/zinc/98/16/54/387981654.db2.gz YZTJHIQBGDLQDH-OPRDCNLKSA-N 2 0 238.297 2.305 20 0 BEADRP Cc1ccc2c(c1)OCCC[C@@H]2[NH2+]CCC[NH3+] ZINC000423190307 387975294 /nfs/dbraw/zinc/97/52/94/387975294.db2.gz NNDRITJPHQTUGT-ZDUSSCGKSA-N 2 0 234.343 2.147 20 0 BEADRP CSc1ccccc1[C@H](C)[NH2+]CCC[NH3+] ZINC000423190762 387975381 /nfs/dbraw/zinc/97/53/81/387975381.db2.gz ODTWJWHAYABGCL-JTQLQIEISA-N 2 0 224.373 2.408 20 0 BEADRP CSc1ccccc1[C@@H](C)[NH2+]CCC[NH3+] ZINC000423190763 387975594 /nfs/dbraw/zinc/97/55/94/387975594.db2.gz ODTWJWHAYABGCL-SNVBAGLBSA-N 2 0 224.373 2.408 20 0 BEADRP CC[N@H+](C)C[C@H]1CC[NH+](CC2=CCCC2)C1 ZINC000645812120 387977364 /nfs/dbraw/zinc/97/73/64/387977364.db2.gz NLCBMWPUQYZOGV-CQSZACIVSA-N 2 0 222.376 2.370 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CC(C)(C)c1cccnc1 ZINC000423193207 387978426 /nfs/dbraw/zinc/97/84/26/387978426.db2.gz VKALCQXJJGCTET-GFCCVEGCSA-N 2 0 235.375 2.076 20 0 BEADRP CC[C@@H]1C[C@H](C)CC[C@H]1[NH2+][C@H]1CC[NH2+]C1 ZINC000423201704 387987285 /nfs/dbraw/zinc/98/72/85/387987285.db2.gz JCLYVLMQJXVSEH-FVCCEPFGSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH2+]CC1([NH3+])CCCCCC1)[C@H]1CCOC1 ZINC000423201436 387987409 /nfs/dbraw/zinc/98/74/09/387987409.db2.gz ORFQPDLOSHWBOY-STQMWFEESA-N 2 0 240.391 2.053 20 0 BEADRP C[NH2+]CCC[NH2+][C@H](C)[C@H]1CCCC[C@H]1C ZINC000423201885 387988327 /nfs/dbraw/zinc/98/83/27/387988327.db2.gz QDTTVSTUNYNGIA-UPJWGTAASA-N 2 0 212.381 2.400 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1c2cc(C)ccc2C[C@@H]1C ZINC000423203682 387989892 /nfs/dbraw/zinc/98/98/92/387989892.db2.gz SXQLMVMCEJDHQI-WFASDCNBSA-N 2 0 232.371 2.427 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1CCC[NH2+]C1)[C@H]1C[C@H]1C ZINC000423205624 387991645 /nfs/dbraw/zinc/99/16/45/387991645.db2.gz FGIYLXSMNBIONZ-NDBYEHHHSA-N 2 0 210.365 2.010 20 0 BEADRP CC(C)(C)[C@@H]1CC[C@H]1[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000423208368 387993286 /nfs/dbraw/zinc/99/32/86/387993286.db2.gz HTRPWSVCKICAHC-YNEHKIRRSA-N 2 0 224.392 2.400 20 0 BEADRP CC[C@@H](N[C@H]1CC[NH2+]C1)c1cccc(F)c1 ZINC000423212515 387995119 /nfs/dbraw/zinc/99/51/19/387995119.db2.gz JRZZTOXQPXNDGK-QWHCGFSZSA-N 2 0 222.307 2.228 20 0 BEADRP C[C@@H]([NH2+]CCC[NH3+])c1nccc2ccccc21 ZINC000423196409 387982761 /nfs/dbraw/zinc/98/27/61/387982761.db2.gz VFMFKXARYYROJK-LLVKDONJSA-N 2 0 229.327 2.234 20 0 BEADRP C[C@@H](C[NH2+][C@H](C)[C@@H]1CCC[NH2+]1)CC(F)(F)F ZINC000423196123 387982769 /nfs/dbraw/zinc/98/27/69/387982769.db2.gz YZTJHIQBGDLQDH-BBBLOLIVSA-N 2 0 238.297 2.305 20 0 BEADRP CCC1(C[NH2+][C@@H](C)[C@H]2CCC[NH2+]2)CCC1 ZINC000400501359 387983131 /nfs/dbraw/zinc/98/31/31/387983131.db2.gz FZXGDQUOHJLBPU-NWDGAFQWSA-N 2 0 210.365 2.297 20 0 BEADRP COC[C@@H]([NH2+]CC1([NH3+])CCCCCC1)C(C)C ZINC000423198728 387983452 /nfs/dbraw/zinc/98/34/52/387983452.db2.gz HNHVKMQMKQTZRE-CYBMUJFWSA-N 2 0 242.407 2.299 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1c2ccccc2C[C@H]1C ZINC000423198250 387983747 /nfs/dbraw/zinc/98/37/47/387983747.db2.gz DVKKJDWKGULPSU-RISCZKNCSA-N 2 0 218.344 2.119 20 0 BEADRP CCC1(CC)[C@H]([NH2+]CCC[NH2+]C)[C@@H](C)[C@H]1OC ZINC000423197856 387984316 /nfs/dbraw/zinc/98/43/16/387984316.db2.gz BNROEMAKZHRYBN-JHJVBQTASA-N 2 0 242.407 2.025 20 0 BEADRP CCC[C@H](C)[C@H](CC)[NH2+]CCC[NH2+]C ZINC000423199118 387986014 /nfs/dbraw/zinc/98/60/14/387986014.db2.gz JCLPXYJJCYKJJV-RYUDHWBXSA-N 2 0 200.370 2.400 20 0 BEADRP [NH3+][C@@H]1CCCC[C@H]1[NH2+][C@@H]1CC[C@@H]1C1CCC1 ZINC000424372243 387997012 /nfs/dbraw/zinc/99/70/12/387997012.db2.gz HQVYXYPUTFJWRS-AAVRWANBSA-N 2 0 222.376 2.425 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[NH2+]C1)[C@H]1CCCC[C@H]1C ZINC000423163901 387997244 /nfs/dbraw/zinc/99/72/44/387997244.db2.gz WCBMGJYZCRCOOK-XQHKEYJVSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH2+]C1CCC([NH3+])CC1)c1cccc(CO)c1 ZINC000423217853 388000357 /nfs/dbraw/zinc/00/03/57/388000357.db2.gz QSFNMAVKNDPEFV-QGLTVNCISA-N 2 0 248.370 2.099 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@H]([NH2+]C[C@@H]2CCC[NH2+]C2)C1 ZINC000423216379 388000622 /nfs/dbraw/zinc/00/06/22/388000622.db2.gz RUXOWTVGXJXQJI-XJFOESAGSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC12CCC2)[C@@H]1CCC[NH2+]C1 ZINC000423221095 388002330 /nfs/dbraw/zinc/00/23/30/388002330.db2.gz WFNAUWOCNFVBDM-XQQFMLRXSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H]([NH3+])CC[NH2+]C1CCc2ccccc2CC1 ZINC000423222360 388002380 /nfs/dbraw/zinc/00/23/80/388002380.db2.gz ASAWZYFKTNLYNG-LBPRGKRZSA-N 2 0 232.371 2.261 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)c1ccncc1)[C@H]1CCC[NH2+]C1 ZINC000423220190 388002405 /nfs/dbraw/zinc/00/24/05/388002405.db2.gz UYFYASNZVJJZNU-SCRDCRAPSA-N 2 0 233.359 2.120 20 0 BEADRP C[N@H+]1CC=C(C[NH2+][C@H](C2CC2)C2CCC2)CC1 ZINC000453185699 388004486 /nfs/dbraw/zinc/00/44/86/388004486.db2.gz XVLUKHFLFNHIFB-HNNXBMFYSA-N 2 0 234.387 2.417 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@H](c1cccnc1)C1CCC1 ZINC000423222765 388004545 /nfs/dbraw/zinc/00/45/45/388004545.db2.gz CMDYSHYOCTTXBN-FZMZJTMJSA-N 2 0 233.359 2.250 20 0 BEADRP Cc1c([C@H](C)[NH2+]CC[C@H](C)[NH3+])cnn1C(C)C ZINC000423223442 388005300 /nfs/dbraw/zinc/00/53/00/388005300.db2.gz GNFOLFDBYBNVDD-QWRGUYRKSA-N 2 0 238.379 2.160 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@H]1c2ccccc2C[C@@H]1C ZINC000423224180 388006044 /nfs/dbraw/zinc/00/60/44/388006044.db2.gz ILHVNIHLEJCRTA-COPLHBTASA-N 2 0 218.344 2.247 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@H]1CCCNc2ccccc21 ZINC000423227605 388010659 /nfs/dbraw/zinc/01/06/59/388010659.db2.gz WITIOSGMARHOCT-FZMZJTMJSA-N 2 0 233.359 2.260 20 0 BEADRP CCO[C@@H]1C[C@H]([NH2+][C@@H]2CCCC[C@H]2[NH3+])C1(C)C ZINC000424372123 387996111 /nfs/dbraw/zinc/99/61/11/387996111.db2.gz HCEWVMIPPHOBAK-FVCCEPFGSA-N 2 0 240.391 2.050 20 0 BEADRP CC[C@@H]([NH2+]CC[C@H](C)[NH3+])c1ccccc1 ZINC000423240893 388024892 /nfs/dbraw/zinc/02/48/92/388024892.db2.gz XPOYYACVPKCLKQ-WCQYABFASA-N 2 0 206.333 2.465 20 0 BEADRP c1cc2c(o1)CCC[C@@H]2[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000423241113 388025065 /nfs/dbraw/zinc/02/50/65/388025065.db2.gz DBBSIJVMQSGEJB-YPMHNXCESA-N 2 0 234.343 2.246 20 0 BEADRP COc1ccc([C@H](C)[NH2+]CC[C@H]2CC[NH2+]C2)cc1 ZINC000423240574 388025095 /nfs/dbraw/zinc/02/50/95/388025095.db2.gz CJOVUSZHBXRQHQ-QWHCGFSZSA-N 2 0 248.370 2.345 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CCC(F)(F)F)CC[N@@H+]1C ZINC000156617421 388011422 /nfs/dbraw/zinc/01/14/22/388011422.db2.gz WIHKDPFESIUBLM-IUCAKERBSA-N 2 0 224.270 2.011 20 0 BEADRP CC[C@@H]([NH2+]CC[C@H](C)[NH3+])c1cccc(OC)c1 ZINC000423227111 388011434 /nfs/dbraw/zinc/01/14/34/388011434.db2.gz UMTRIWFBWXTZSH-SMDDNHRTSA-N 2 0 236.359 2.473 20 0 BEADRP CCC[C@H]([NH2+]CCOCC[NH+](C)C)C(C)(C)C ZINC000453211970 388011578 /nfs/dbraw/zinc/01/15/78/388011578.db2.gz FXYATLSMSFXOCL-ZDUSSCGKSA-N 2 0 244.423 2.369 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@@H](C1CC1)C1CCC1 ZINC000423269833 388012224 /nfs/dbraw/zinc/01/22/24/388012224.db2.gz HQSLACDSTLUIBT-CHWSQXEVSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H]1CCCC12CCCC2 ZINC000423228025 388012822 /nfs/dbraw/zinc/01/28/22/388012822.db2.gz XXXVTZZCIUVHID-NWDGAFQWSA-N 2 0 210.365 2.426 20 0 BEADRP CCO[C@@H]1C[C@@H]([NH2+]CC[C@H](C)[NH3+])C1(CC)CC ZINC000423227840 388013490 /nfs/dbraw/zinc/01/34/90/388013490.db2.gz XGJAQCHGVGFXRJ-YNEHKIRRSA-N 2 0 242.407 2.297 20 0 BEADRP C([NH2+][C@H](C1CC1)C1CCCC1)[C@@H]1CCC[NH2+]1 ZINC000423229408 388015428 /nfs/dbraw/zinc/01/54/28/388015428.db2.gz BFASKISWGDPVFK-KBPBESRZSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H](C)c1ccccc1F ZINC000423229500 388015736 /nfs/dbraw/zinc/01/57/36/388015736.db2.gz HGYJAKNAQBPEKU-UWVGGRQHSA-N 2 0 210.296 2.214 20 0 BEADRP CCOC[C@@H]1CCC[C@H]1[NH2+]C1CCC([NH3+])CC1 ZINC000423233763 388018334 /nfs/dbraw/zinc/01/83/34/388018334.db2.gz OQXMWGDDRWPGAW-GFJIZPEISA-N 2 0 240.391 2.051 20 0 BEADRP CC[C@@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1ccncc1 ZINC000423238423 388022888 /nfs/dbraw/zinc/02/28/88/388022888.db2.gz AGDSBWHSIUUETI-TZMCWYRMSA-N 2 0 233.359 2.122 20 0 BEADRP C[C@@H]1CC(C)(C)C[C@@H]1[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000423249249 388032258 /nfs/dbraw/zinc/03/22/58/388032258.db2.gz OHYKXSQAHZOSHR-UPJWGTAASA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1ccc(F)cc1 ZINC000423254482 388035433 /nfs/dbraw/zinc/03/54/33/388035433.db2.gz YEDLXQUPHUOGNP-RYUDHWBXSA-N 2 0 236.334 2.476 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H](C)c1ccccc1 ZINC000423255730 388036758 /nfs/dbraw/zinc/03/67/58/388036758.db2.gz APXJSANXXIKPMG-VXGBXAGGSA-N 2 0 206.333 2.193 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H]1CCCc2c(O)cccc21 ZINC000423255603 388036995 /nfs/dbraw/zinc/03/69/95/388036995.db2.gz AJAOEHOODHOFFK-BXUZGUMPSA-N 2 0 248.370 2.215 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCC[NH2+]C1)c1cncs1 ZINC000423256676 388037505 /nfs/dbraw/zinc/03/75/05/388037505.db2.gz FPYWLFXFKLUQNP-WDEREUQCSA-N 2 0 239.388 2.183 20 0 BEADRP Cc1cncc([C@H](C)[NH2+]CC[C@@H]2CCC[NH2+]C2)c1 ZINC000423258437 388038982 /nfs/dbraw/zinc/03/89/82/388038982.db2.gz MCQHRUBUCOERDO-KBPBESRZSA-N 2 0 247.386 2.430 20 0 BEADRP CC[C@@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)C(C)C ZINC000423262349 388040309 /nfs/dbraw/zinc/04/03/09/388040309.db2.gz VFKHJWBSQBVRKL-QWHCGFSZSA-N 2 0 212.381 2.400 20 0 BEADRP CC[C@H]([NH2+]C[C@@H](C)C[NH2+]C)C1CCCC1 ZINC000423266187 388043238 /nfs/dbraw/zinc/04/32/38/388043238.db2.gz CYYDSEWFJDRZNZ-AAEUAGOBSA-N 2 0 212.381 2.400 20 0 BEADRP CC[C@H]([NH2+]C[C@H](C)C[NH2+]C)C1CCCC1 ZINC000423266190 388044141 /nfs/dbraw/zinc/04/41/41/388044141.db2.gz CYYDSEWFJDRZNZ-YPMHNXCESA-N 2 0 212.381 2.400 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H]1CCC12CCCC2 ZINC000423266131 388044711 /nfs/dbraw/zinc/04/47/11/388044711.db2.gz CWQPXDZAIASFHS-VXGBXAGGSA-N 2 0 210.365 2.154 20 0 BEADRP FCCC[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CCC[NH2+]1 ZINC000423245962 388028638 /nfs/dbraw/zinc/02/86/38/388028638.db2.gz YZJSTHJMJJBSPV-XQQFMLRXSA-N 2 0 228.355 2.246 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]C1CC(C)(F)C1 ZINC000453256543 388028738 /nfs/dbraw/zinc/02/87/38/388028738.db2.gz UFZLSYQEUJIYML-IJLVLRJLSA-N 2 0 228.355 2.195 20 0 BEADRP FC(F)C1CCC([NH2+]CC[C@H]2CC[NH2+]C2)CC1 ZINC000423247835 388029717 /nfs/dbraw/zinc/02/97/17/388029717.db2.gz LRTYGYVSUQUJLU-VOMCLLRMSA-N 2 0 246.345 2.400 20 0 BEADRP C(C[C@H]1CC[NH2+]C1)[NH2+]C1C2CC3CC(C2)CC1C3 ZINC000423246423 388030305 /nfs/dbraw/zinc/03/03/05/388030305.db2.gz JZKQAQLZOVKWKD-WFWUXJIDSA-N 2 0 248.414 2.400 20 0 BEADRP c1ccc2c(c1)CC[C@@H]2[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000423246070 388030666 /nfs/dbraw/zinc/03/06/66/388030666.db2.gz JUPKWHWOKXGBKQ-DOMZBBRYSA-N 2 0 230.355 2.263 20 0 BEADRP C(C[C@@H]1CC[NH2+]C1)[NH2+][C@H]1CCC12CCCC2 ZINC000423249320 388031788 /nfs/dbraw/zinc/03/17/88/388031788.db2.gz OQDYFABIYFDMJD-STQMWFEESA-N 2 0 222.376 2.298 20 0 BEADRP CC(C)[C@@H]1C[C@H]1C[NH2+][C@@H]1CC[N@H+](C)C[C@H]1C ZINC000453350589 388052195 /nfs/dbraw/zinc/05/21/95/388052195.db2.gz LOJOATCZCYOPRJ-ZOBORPQBSA-N 2 0 224.392 2.208 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]C(C1CCC1)C1CCC1 ZINC000423273554 388053834 /nfs/dbraw/zinc/05/38/34/388053834.db2.gz LBTKAIPXGXMBJQ-LLVKDONJSA-N 2 0 224.392 2.400 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H](c1cccnc1)C1CCC1 ZINC000423274348 388054515 /nfs/dbraw/zinc/05/45/15/388054515.db2.gz MAEQWABKMGQBLA-IUODEOHRSA-N 2 0 247.386 2.368 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H](C)c1cccc(F)c1 ZINC000423274647 388054572 /nfs/dbraw/zinc/05/45/72/388054572.db2.gz MHAQTOYKKYWKQQ-WDEREUQCSA-N 2 0 224.323 2.332 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H]1CCCNc2ccccc21 ZINC000423275165 388056992 /nfs/dbraw/zinc/05/69/92/388056992.db2.gz MRAPVGPWLNJPBI-IUODEOHRSA-N 2 0 247.386 2.379 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H](C)c1cccs1 ZINC000423275159 388057148 /nfs/dbraw/zinc/05/71/48/388057148.db2.gz MPYRJNVOOCGUMJ-UWVGGRQHSA-N 2 0 212.362 2.254 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H]1CCCNc2ccccc21 ZINC000423275164 388057247 /nfs/dbraw/zinc/05/72/47/388057247.db2.gz MRAPVGPWLNJPBI-DOMZBBRYSA-N 2 0 247.386 2.379 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CC[C@@H]1C1CCC1 ZINC000423280610 388061638 /nfs/dbraw/zinc/06/16/38/388061638.db2.gz UXMUPOCNCWJEAM-CYZMBNFOSA-N 2 0 210.365 2.010 20 0 BEADRP CCC([NH3+])(CC)C[NH2+][C@@H]1CCC12CCC2 ZINC000423281238 388064083 /nfs/dbraw/zinc/06/40/83/388064083.db2.gz BAFAAXVUGPLKPT-LLVKDONJSA-N 2 0 210.365 2.426 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+][C@H]1CCCC[C@@H]1C[NH3+] ZINC000423283448 388064985 /nfs/dbraw/zinc/06/49/85/388064985.db2.gz WEIRWKOZZNLVCV-NDBYEHHHSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)C1CC([NH2+]CC[C@H]2CCC[NH2+]C2)C1 ZINC000423283122 388065209 /nfs/dbraw/zinc/06/52/09/388065209.db2.gz XGBUYEYZQNSTNH-IYXRBSQSSA-N 2 0 224.392 2.400 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C[C@@H]2C[C@H]2C2CC2)[C@H]2CCC[C@@H]21 ZINC000453382899 388065860 /nfs/dbraw/zinc/06/58/60/388065860.db2.gz LXBFBWLBWXKZJU-QRJUGERDSA-N 2 0 248.414 2.495 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]C1CCC(C(F)F)CC1 ZINC000423285600 388068763 /nfs/dbraw/zinc/06/87/63/388068763.db2.gz ZRELZKUPUIPNRT-WHXUTIOJSA-N 2 0 234.334 2.255 20 0 BEADRP CCCCO[C@@H]1C[C@@H]([NH2+]CC(C)(C)[NH3+])C1(C)C ZINC000423286399 388071975 /nfs/dbraw/zinc/07/19/75/388071975.db2.gz GZHYSRACNQBIMQ-VXGBXAGGSA-N 2 0 242.407 2.297 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]Cc1ccccc1F ZINC000084217784 388074649 /nfs/dbraw/zinc/07/46/49/388074649.db2.gz DNDLVQMIDTWDET-GWCFXTLKSA-N 2 0 222.307 2.043 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CCC[C@@H]2C[NH3+])cc1 ZINC000084217903 388075326 /nfs/dbraw/zinc/07/53/26/388075326.db2.gz SZHJUTMGBIUKFH-ZIAGYGMSSA-N 2 0 218.344 2.212 20 0 BEADRP C[C@@H]1CCC[C@@H](C[N@@H+]2CCC[C@H](C[NH3+])C2)C1 ZINC000084344494 388076483 /nfs/dbraw/zinc/07/64/83/388076483.db2.gz KPKMVIXWUOYEPM-MGPQQGTHSA-N 2 0 224.392 2.483 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H](C)c1cc(F)c(F)c(F)c1 ZINC000423295204 388077512 /nfs/dbraw/zinc/07/75/12/388077512.db2.gz DPCYLEPVHNKSKG-SFYZADRCSA-N 2 0 246.276 2.349 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H](C)c1cc(F)c(F)c(F)c1 ZINC000423295102 388077683 /nfs/dbraw/zinc/07/76/83/388077683.db2.gz DPCYLEPVHNKSKG-HTQZYQBOSA-N 2 0 246.276 2.349 20 0 BEADRP C[C@@H]([NH2+]C[C@@H](C)C[NH3+])c1ccc2ccccc2n1 ZINC000423294647 388077703 /nfs/dbraw/zinc/07/77/03/388077703.db2.gz CMXLWPJKSFMCJI-NWDGAFQWSA-N 2 0 243.354 2.480 20 0 BEADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H]2CCO[C@H](C)C2)cc1 ZINC000423295913 388078092 /nfs/dbraw/zinc/07/80/92/388078092.db2.gz XTTYTTZTOLTYAE-TYNCELHUSA-N 2 0 248.370 2.363 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@@H]1CC(C)(C)Cc2occc21 ZINC000423297006 388078689 /nfs/dbraw/zinc/07/86/89/388078689.db2.gz IIZCPLGCAQHSPI-CMPLNLGQSA-N 2 0 236.359 2.478 20 0 BEADRP CC(C)C[C@H]([NH2+]C[C@@H](C)C[NH3+])c1ccccn1 ZINC000423297676 388079288 /nfs/dbraw/zinc/07/92/88/388079288.db2.gz LHVDADHWIYOOLN-JSGCOSHPSA-N 2 0 235.375 2.353 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCC2CC(F)(F)C2)CC[N@@H+]1C ZINC000453426113 388081268 /nfs/dbraw/zinc/08/12/68/388081268.db2.gz ONXPCSTXDPIJTF-PWSUYJOCSA-N 2 0 246.345 2.494 20 0 BEADRP C[C@H]([NH2+]CCCC[N@H+](C)C1CC1)C1CC1 ZINC000453435840 388082159 /nfs/dbraw/zinc/08/21/59/388082159.db2.gz URUQRRXOMONPKU-NSHDSACASA-N 2 0 210.365 2.249 20 0 BEADRP Cc1csc([C@@H](C)[NH2+][C@H](C)CCC[NH3+])n1 ZINC000336659883 388086706 /nfs/dbraw/zinc/08/67/06/388086706.db2.gz BPQNDKGDHDQTGQ-PSASIEDQSA-N 2 0 227.377 2.230 20 0 BEADRP CC(C)CO[C@H]1C[C@H]([NH2+]CCCC[NH3+])C1(C)C ZINC000085400661 388087183 /nfs/dbraw/zinc/08/71/83/388087183.db2.gz GRXGKIFNPPFZCL-STQMWFEESA-N 2 0 242.407 2.155 20 0 BEADRP Cc1ccc(C[NH2+]CCCC[N@@H+](C)C2CC2)nc1 ZINC000453596480 388088604 /nfs/dbraw/zinc/08/86/04/388088604.db2.gz LLNPCEHWZDVSLV-UHFFFAOYSA-N 2 0 247.386 2.354 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]Cc2ccccc2F)C1 ZINC000086402018 388101626 /nfs/dbraw/zinc/10/16/26/388101626.db2.gz JNPMFFSRAHBNFZ-RYUDHWBXSA-N 2 0 222.307 2.185 20 0 BEADRP C[N@H+](CCc1cccs1)C[C@]1(C)CC[NH2+]C1 ZINC000086442318 388102163 /nfs/dbraw/zinc/10/21/63/388102163.db2.gz ZDABLLYAPRUQKZ-CYBMUJFWSA-N 2 0 238.400 2.222 20 0 BEADRP CC(C)[C@H](C)[N@H+](CC1CC[NH2+]CC1)C1CC1 ZINC000086702084 388106506 /nfs/dbraw/zinc/10/65/06/388106506.db2.gz CCBOMXSBPVNABF-LBPRGKRZSA-N 2 0 224.392 2.495 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)C1CC1 ZINC000083055510 388044722 /nfs/dbraw/zinc/04/47/22/388044722.db2.gz GNWFSRFGQZOYQH-FZMZJTMJSA-N 2 0 222.376 2.249 20 0 BEADRP CCC1CC([NH2+]CC[C@H]2CCC[NH2+]C2)C1 ZINC000423268691 388047123 /nfs/dbraw/zinc/04/71/23/388047123.db2.gz GFRZXYRVMZYSTQ-OTTFEQOBSA-N 2 0 210.365 2.154 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+][C@@H](C)C1CCSCC1 ZINC000423269465 388047774 /nfs/dbraw/zinc/04/77/74/388047774.db2.gz HGPIHIDAHYBWSD-JQWIXIFHSA-N 2 0 230.421 2.091 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1C[C@H](C)CC[C@@H]1C ZINC000423269171 388048143 /nfs/dbraw/zinc/04/81/43/388048143.db2.gz GWEOJGNOYLZEJE-MROQNXINSA-N 2 0 212.381 2.256 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1C[C@@H](C)CC[C@H]1C ZINC000423269172 388048233 /nfs/dbraw/zinc/04/82/33/388048233.db2.gz GWEOJGNOYLZEJE-WUHRBBMRSA-N 2 0 212.381 2.256 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+][C@@H](C)CC(C)(C)C ZINC000423271313 388050253 /nfs/dbraw/zinc/05/02/53/388050253.db2.gz IXBZUGKOYBWXSF-QWRGUYRKSA-N 2 0 200.370 2.384 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+]CC1=CC[N@H+](C)CC1 ZINC000449253924 388163250 /nfs/dbraw/zinc/16/32/50/388163250.db2.gz VAUIZTXYTTZLMJ-GFCCVEGCSA-N 2 0 234.343 2.062 20 0 BEADRP C[C@H]1CN(C2CC2)C[C@H]1[NH2+]CCC(C)(F)F ZINC000449355256 388180849 /nfs/dbraw/zinc/18/08/49/388180849.db2.gz XIFFKZJFDSJSDQ-GXSJLCMTSA-N 2 0 232.318 2.104 20 0 BEADRP C1CC1[C@@H]([NH2+][C@H]1CCC[NH2+]CC1)C1CCC1 ZINC000324843453 388124972 /nfs/dbraw/zinc/12/49/72/388124972.db2.gz XESHORAVMSBKMS-KBPBESRZSA-N 2 0 222.376 2.297 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CSC[C@H]2C)C1 ZINC000449095305 388141170 /nfs/dbraw/zinc/14/11/70/388141170.db2.gz XQSKYQIGFNPCGJ-JHJVBQTASA-N 2 0 242.432 2.059 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+]CCCC[NH+](C)C ZINC000449108146 388143642 /nfs/dbraw/zinc/14/36/42/388143642.db2.gz SFYVASAWNAFHAA-GFCCVEGCSA-N 2 0 224.348 2.142 20 0 BEADRP CCSCC[NH2+]C[C@@H](C)C[NH+]1CCCC1 ZINC000164794217 388248491 /nfs/dbraw/zinc/24/84/91/388248491.db2.gz XPWBDQSHWGETSQ-GFCCVEGCSA-N 2 0 230.421 2.061 20 0 BEADRP CC/C=C/C[NH2+][C@@H]1CC[N@H+](CC)C[C@@H]1C ZINC000449455705 388210530 /nfs/dbraw/zinc/21/05/30/388210530.db2.gz LOSYAEYVCHLIBI-VFZNBBLXSA-N 2 0 210.365 2.273 20 0 BEADRP CC1=CC[C@H]([NH2+][C@@H](C)CC[NH+](C)C)CC1 ZINC000518411652 256571926 /nfs/dbraw/zinc/57/19/26/256571926.db2.gz RCZYMRYKQMDKIS-STQMWFEESA-N 2 0 210.365 2.415 20 0 BEADRP C[N@@H+]1CCC[C@@H]1CC[NH+]1CCC(CF)CC1 ZINC000451394823 388269471 /nfs/dbraw/zinc/26/94/71/388269471.db2.gz PLTZHSRPUDAZBI-CYBMUJFWSA-N 2 0 228.355 2.152 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CCOCC1CCCC1 ZINC000313253478 256643071 /nfs/dbraw/zinc/64/30/71/256643071.db2.gz MWSMYPXLTGPOND-ZDUSSCGKSA-N 2 0 242.407 2.300 20 0 BEADRP Cc1ccc(CCC[NH2+][C@@H](C)C[C@@H](C)[NH3+])cn1 ZINC000572721728 388370812 /nfs/dbraw/zinc/37/08/12/388370812.db2.gz BVONCVDYMLCBQJ-YPMHNXCESA-N 2 0 235.375 2.038 20 0 BEADRP Cc1ccc(CCC[NH2+][C@H](C)C[C@H](C)[NH3+])cn1 ZINC000572721727 388370856 /nfs/dbraw/zinc/37/08/56/388370856.db2.gz BVONCVDYMLCBQJ-WCQYABFASA-N 2 0 235.375 2.038 20 0 BEADRP C[NH+](C)CCCC[NH2+]C[C@@]1(C)CCCS1 ZINC000327643445 388381200 /nfs/dbraw/zinc/38/12/00/388381200.db2.gz RUDQKLZULNMLBR-GFCCVEGCSA-N 2 0 230.421 2.204 20 0 BEADRP CCC[C@H]([NH2+]CCOCC[NH+](C)C)C1CCC1 ZINC000322715988 388445174 /nfs/dbraw/zinc/44/51/74/388445174.db2.gz RYISLPVHCMCTCX-AWEZNQCLSA-N 2 0 242.407 2.123 20 0 BEADRP FCCCCC[N@H+]1CC[C@H]2C[NH2+]C[C@H]2CC1 ZINC000309603120 388458949 /nfs/dbraw/zinc/45/89/49/388458949.db2.gz XEJSARWWHDVAIY-BETUJISGSA-N 2 0 228.355 2.058 20 0 BEADRP CC(C)CSCC[NH2+][C@@H](C)CCC[NH3+] ZINC000397419547 388469666 /nfs/dbraw/zinc/46/96/66/388469666.db2.gz UBFSKYQIFATJFZ-NSHDSACASA-N 2 0 218.410 2.093 20 0 BEADRP C[C@]12C[C@H]1CCC[C@H]2[NH2+]CC1CC[NH2+]CC1 ZINC000516044553 256762548 /nfs/dbraw/zinc/76/25/48/256762548.db2.gz GNYVDSCEYZFQIX-MCIONIFRSA-N 2 0 222.376 2.154 20 0 BEADRP CC(C)n1cc([C@H](C)[NH2+][C@@H](C)C[C@H](C)[NH3+])cn1 ZINC000514854737 256722701 /nfs/dbraw/zinc/72/27/01/256722701.db2.gz HMZXWPVKGHZMHX-SRVKXCTJSA-N 2 0 238.379 2.240 20 0 BEADRP COC[C@@H](C)C[N@H+](CCC[NH3+])CC1CCCC1 ZINC000573249159 388433099 /nfs/dbraw/zinc/43/30/99/388433099.db2.gz WZLRIPLJHAHZKZ-ZDUSSCGKSA-N 2 0 242.407 2.110 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@H]([NH2+]CC2CC[NH2+]CC2)C1 ZINC000517122867 388537917 /nfs/dbraw/zinc/53/79/17/388537917.db2.gz LRJSFFWXMPJOEA-MBNYWOFBSA-N 2 0 224.392 2.400 20 0 BEADRP CCC(CC)[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000378926794 388544322 /nfs/dbraw/zinc/54/43/22/388544322.db2.gz IJUDTTMKSHPQNH-DMDPSCGWSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H](CCO)CC[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000397616108 388484140 /nfs/dbraw/zinc/48/41/40/388484140.db2.gz FFVFISZJZVLREW-TUKIKUTGSA-N 2 0 248.370 2.129 20 0 BEADRP C[C@H](CCO)CC[NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000397616105 388484339 /nfs/dbraw/zinc/48/43/39/388484339.db2.gz FFVFISZJZVLREW-GLQYFDAESA-N 2 0 248.370 2.129 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]CC[C@@H](C)F)CC1 ZINC000340465677 388490784 /nfs/dbraw/zinc/49/07/84/388490784.db2.gz XAAWGOSZFRVORJ-LLVKDONJSA-N 2 0 216.344 2.197 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)C1CC1 ZINC000398000689 388514660 /nfs/dbraw/zinc/51/46/60/388514660.db2.gz VVOUKNDXXXCKGV-SRVKXCTJSA-N 2 0 210.365 2.140 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)C1CC1 ZINC000398000688 388515045 /nfs/dbraw/zinc/51/50/45/388515045.db2.gz VVOUKNDXXXCKGV-IJLUTSLNSA-N 2 0 210.365 2.140 20 0 BEADRP CC[C@H]1CC[C@@H](C)[N@@H+]1CC1CC[NH2+]CC1 ZINC000136185274 388525799 /nfs/dbraw/zinc/52/57/99/388525799.db2.gz CZYLIZODMZHZAZ-YPMHNXCESA-N 2 0 210.365 2.249 20 0 BEADRP CC[C@H](C)C[NH2+]CCN1CCCC[C@H]1C ZINC000245532387 388587685 /nfs/dbraw/zinc/58/76/85/388587685.db2.gz ICRHUBBZTAKLBR-QWHCGFSZSA-N 2 0 212.381 2.497 20 0 BEADRP CCC[C@@H](C)C[N@@H+]1CC[C@@H](C[NH+](C)C)C1 ZINC000245634788 388594893 /nfs/dbraw/zinc/59/48/93/388594893.db2.gz BSTWGJPXWSPUKG-OLZOCXBDSA-N 2 0 212.381 2.306 20 0 BEADRP CO[C@H](C[N@@H+]1CC[C@@H]([C@H](C)[NH3+])C1)c1ccccc1 ZINC000379232143 388599612 /nfs/dbraw/zinc/59/96/12/388599612.db2.gz STVCTTYVGSLHTR-NWANDNLSSA-N 2 0 248.370 2.043 20 0 BEADRP CC(C)[NH2+][C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000245891524 388609765 /nfs/dbraw/zinc/60/97/65/388609765.db2.gz MFJDGGVFISXFHS-KBPBESRZSA-N 2 0 218.344 2.430 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@H](C)[C@@H]1CCCCO1 ZINC000356693300 388551300 /nfs/dbraw/zinc/55/13/00/388551300.db2.gz IZDVAKCMCNAZGN-UPJWGTAASA-N 2 0 228.380 2.051 20 0 BEADRP Cc1ccccc1OCC[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000517588806 388555949 /nfs/dbraw/zinc/55/59/49/388555949.db2.gz SVARTAXHWJCBSQ-ZIAGYGMSSA-N 2 0 248.370 2.233 20 0 BEADRP C[C@H]([N@H+](C)CCC1CC[NH2+]CC1)C1(C)CC1 ZINC000359199758 388556077 /nfs/dbraw/zinc/55/60/77/388556077.db2.gz FGYBOTHBWVTQTR-LBPRGKRZSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1ccc(C[N@@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@H]3C2)s1 ZINC000261572771 135215008 /nfs/dbraw/zinc/21/50/08/135215008.db2.gz IGUYPHSKDIGVEJ-WCFLWFBJSA-N 2 0 236.384 2.226 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCC[C@@H]2C[NH3+])C[C@H](C)O1 ZINC000521983282 388672592 /nfs/dbraw/zinc/67/25/92/388672592.db2.gz NTEBJVOAECPJMX-XVIXHAIJSA-N 2 0 240.391 2.050 20 0 BEADRP C1CC2(C1)[NH2+]CC[C@@H]2[NH2+]C1CCCCC1 ZINC000530179235 388620271 /nfs/dbraw/zinc/62/02/71/388620271.db2.gz WIUCCMZOMURHBU-LBPRGKRZSA-N 2 0 208.349 2.193 20 0 BEADRP CCC[C@@H](C)C[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000530178572 388620858 /nfs/dbraw/zinc/62/08/58/388620858.db2.gz OMJRDBVYGQXPDO-VXGBXAGGSA-N 2 0 210.365 2.297 20 0 BEADRP C1CC1[C@@H]1CCC[C@@H]1[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000530177349 388622188 /nfs/dbraw/zinc/62/21/88/388622188.db2.gz GKAQNJUFTXKSKE-IHRRRGAJSA-N 2 0 234.387 2.439 20 0 BEADRP CCC[C@H](C[NH2+][C@H]1CC[NH2+]CC[C@H]1C)OCC ZINC000530212611 388627407 /nfs/dbraw/zinc/62/74/07/388627407.db2.gz RDBPGNMVAGONMS-MCIONIFRSA-N 2 0 242.407 2.169 20 0 BEADRP C1CC([C@@H]2CC[C@@H]2[NH2+][C@@H]2CC[NH2+]C23CCC3)C1 ZINC000530218136 388630032 /nfs/dbraw/zinc/63/00/32/388630032.db2.gz VRYOIYBVXHVECZ-MELADBBJSA-N 2 0 234.387 2.439 20 0 BEADRP C[C@@H]([NH2+]CC1CC=CC1)[C@H]1CCCC[NH2+]1 ZINC000530217413 388630232 /nfs/dbraw/zinc/63/02/32/388630232.db2.gz STIMROBEFVYYAC-DGCLKSJQSA-N 2 0 208.349 2.073 20 0 BEADRP CC[C@H]([NH2+][C@H]1CC[NH2+]C12CCC2)C(C)C ZINC000530217458 388630349 /nfs/dbraw/zinc/63/03/49/388630349.db2.gz GQBWZNLADXFZKB-RYUDHWBXSA-N 2 0 210.365 2.295 20 0 BEADRP CC[C@@H]([NH2+]CC1CC=CC1)[C@@H]1CCC[NH2+]1 ZINC000530217665 388630903 /nfs/dbraw/zinc/63/09/03/388630903.db2.gz UZTIMXDAEHYCCJ-OLZOCXBDSA-N 2 0 208.349 2.073 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CC=CCC1)[C@H]1CCC[NH2+]1 ZINC000530217553 388630986 /nfs/dbraw/zinc/63/09/86/388630986.db2.gz HXBMABMNCBNPFG-MELADBBJSA-N 2 0 222.376 2.463 20 0 BEADRP CC1(C)CC(C[N@H+]2CC[C@H]3C[NH2+]C[C@H]3CC2)C1 ZINC000530219235 388631724 /nfs/dbraw/zinc/63/17/24/388631724.db2.gz IZSPSIIHYGMQFG-OKILXGFUSA-N 2 0 236.403 2.354 20 0 BEADRP C[C@H]1C[C@@H]([NH3+])CC[N@@H+]1CC1CC(C)(C)C1 ZINC000530225302 388634674 /nfs/dbraw/zinc/63/46/74/388634674.db2.gz VNGCNHGMVONRSI-JQWIXIFHSA-N 2 0 210.365 2.234 20 0 BEADRP C[C@H](C[C@@H]1CCC[NH2+]1)[NH2+]C[C@H](C)c1ccncc1 ZINC000530242714 388637641 /nfs/dbraw/zinc/63/76/41/388637641.db2.gz CTIUGBLDDHKXOK-GUTXKFCHSA-N 2 0 247.386 2.305 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[NH2+]C12CCC2)C1CCC1 ZINC000530244971 388639022 /nfs/dbraw/zinc/63/90/22/388639022.db2.gz RLHLYPLSHTUOKB-CMPLNLGQSA-N 2 0 208.349 2.049 20 0 BEADRP C[C@H](CC1CC1)[NH2+][C@H]1CCCC[C@H]1C[NH3+] ZINC000251176505 388642285 /nfs/dbraw/zinc/64/22/85/388642285.db2.gz GFZOIPZEYWVBPU-WXHSDQCUSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]C[C@@H]2CC=CCC2)C1 ZINC000222994259 388647296 /nfs/dbraw/zinc/64/72/96/388647296.db2.gz LBVQOGFBKHIEDX-JHJVBQTASA-N 2 0 208.349 2.202 20 0 BEADRP CCOCCCC[NH2+][C@@H]1CC[N@H+](CC)C[C@@H]1C ZINC000246899454 388655163 /nfs/dbraw/zinc/65/51/63/388655163.db2.gz FTTJJHLURWJWDW-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H](C)C2CC2)[C@@H](C)C1 ZINC000247311415 388662230 /nfs/dbraw/zinc/66/22/30/388662230.db2.gz KAAVRKKGRUQBIK-GVXVVHGQSA-N 2 0 210.365 2.105 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]C[C@@H]2CCCCS2)C1 ZINC000227006710 388737052 /nfs/dbraw/zinc/73/70/52/388737052.db2.gz RBYJKEDBDWLPGK-WOPDTQHZSA-N 2 0 228.405 2.132 20 0 BEADRP CC(C)[C@H](C)[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000251379476 388747436 /nfs/dbraw/zinc/74/74/36/388747436.db2.gz YZWZUEDYMBGUHJ-AVGNSLFASA-N 2 0 210.365 2.247 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000423285366 388689213 /nfs/dbraw/zinc/68/92/13/388689213.db2.gz ZLMSDOPXOHPATC-IHRRRGAJSA-N 2 0 224.392 2.400 20 0 BEADRP CSC1(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)CC1 ZINC000248662957 388689150 /nfs/dbraw/zinc/68/91/50/388689150.db2.gz YWXLCAOYVKDYKP-NEPJUHHUSA-N 2 0 240.416 2.098 20 0 BEADRP C[C@H]([NH2+]CC1CC[NH+](C)CC1)C(C)(C)C ZINC000126357040 388695437 /nfs/dbraw/zinc/69/54/37/388695437.db2.gz CNJJBPSFYFDZRN-NSHDSACASA-N 2 0 212.381 2.352 20 0 BEADRP COC[C@H](C)C[NH2+]CCCCC[NH+]1CCCC1 ZINC000552363131 388697845 /nfs/dbraw/zinc/69/78/45/388697845.db2.gz CQPJVJCWIFUOKW-CQSZACIVSA-N 2 0 242.407 2.125 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)CCC2CC2)C1 ZINC000248975922 388702541 /nfs/dbraw/zinc/70/25/41/388702541.db2.gz HRAVQMJECHFJET-OCCSQVGLSA-N 2 0 224.392 2.497 20 0 BEADRP CCC[C@@H](C)[N@@H+]1CC[C@@H](C[NH+](C)CC)C1 ZINC000249396018 388719833 /nfs/dbraw/zinc/71/98/33/388719833.db2.gz SUOIYUUXAWCDRU-OLZOCXBDSA-N 2 0 212.381 2.449 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CC=C(C)C)[C@@H](C)C1 ZINC000249692547 388731713 /nfs/dbraw/zinc/73/17/13/388731713.db2.gz XHCPIYDFYBWYDN-QWHCGFSZSA-N 2 0 210.365 2.273 20 0 BEADRP C[C@H](CC[NH3+])[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC000252982265 388796254 /nfs/dbraw/zinc/79/62/54/388796254.db2.gz VPBXQIKNADSVNL-XBFCOCLRSA-N 2 0 218.344 2.117 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@H]2C[C@@H]2C(F)F)[C@@H]2CCC[C@H]21 ZINC000554095449 388799047 /nfs/dbraw/zinc/79/90/47/388799047.db2.gz FNDHLNSTAPQOMF-UHFZAUJKSA-N 2 0 244.329 2.102 20 0 BEADRP CSC1(C[NH2+][C@@H]2C[C@H](C)[N@H+](C)C[C@@H]2C)CC1 ZINC000228023115 388765666 /nfs/dbraw/zinc/76/56/66/388765666.db2.gz PIQKAGGOXVZLQP-SDDRHHMPSA-N 2 0 242.432 2.200 20 0 BEADRP CCOC[C@H](C)[NH2+]CCC[NH+]1CCC(C)CC1 ZINC000128592136 388774242 /nfs/dbraw/zinc/77/42/42/388774242.db2.gz PECPFTDKAVEQKJ-AWEZNQCLSA-N 2 0 242.407 2.123 20 0 BEADRP c1ccc([C@@H]2CCC[N@H+]2C[C@H]2CCC[NH2+]C2)nc1 ZINC000564975603 388903777 /nfs/dbraw/zinc/90/37/77/388903777.db2.gz LEXJVSDCZHSTDN-ZFWWWQNUSA-N 2 0 245.370 2.218 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@@H]2CCCC23CC3)CC1 ZINC000565245554 388932045 /nfs/dbraw/zinc/93/20/45/388932045.db2.gz WXMHKXSLNZGIMX-CYBMUJFWSA-N 2 0 222.376 2.251 20 0 BEADRP COC[C@H](C)C[NH2+]Cc1ccc([C@@H](C)[NH3+])cc1 ZINC000565762696 388968004 /nfs/dbraw/zinc/96/80/04/388968004.db2.gz CXBKYTPNCPKYKJ-VXGBXAGGSA-N 2 0 236.359 2.078 20 0 BEADRP CC(C)[NH2+]CCC[NH2+][C@@H]1CCO[C@H](C(C)C)C1 ZINC000565592459 388955411 /nfs/dbraw/zinc/95/54/11/388955411.db2.gz DPELNINJJVQXCJ-KGLIPLIRSA-N 2 0 242.407 2.168 20 0 BEADRP CC(C)[NH2+]CCC[NH2+][C@H]1CCO[C@H](C(C)C)C1 ZINC000565592454 388955802 /nfs/dbraw/zinc/95/58/02/388955802.db2.gz DPELNINJJVQXCJ-KBPBESRZSA-N 2 0 242.407 2.168 20 0 BEADRP C[NH+](C)CCC[N@H+](C)CCC(C)(C)C ZINC000565943293 388980954 /nfs/dbraw/zinc/98/09/54/388980954.db2.gz BEWJHRGORLMIRQ-UHFFFAOYSA-N 2 0 200.370 2.306 20 0 BEADRP CCC(C)(C)[C@H](C)[NH2+]C[C@@]1(COC)CCC[NH2+]1 ZINC000566062620 388985956 /nfs/dbraw/zinc/98/59/56/388985956.db2.gz RZWVZGUKXMPBGG-GXTWGEPZSA-N 2 0 242.407 2.169 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H](C)c1cccc(OC)c1 ZINC000566088321 388986076 /nfs/dbraw/zinc/98/60/76/388986076.db2.gz QZYDBKSRQQOKHS-GFCCVEGCSA-N 2 0 236.359 2.345 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H]1CCC[C@@H](C)[C@H]1C ZINC000566087901 388986558 /nfs/dbraw/zinc/98/65/58/388986558.db2.gz BVLZTMQSMZWHCK-JHJVBQTASA-N 2 0 212.381 2.400 20 0 BEADRP Cc1c[nH+]ccc1NC1CC[NH+](C2CCC2)CC1 ZINC000336269720 177650742 /nfs/dbraw/zinc/65/07/42/177650742.db2.gz FNFPPEYOSVSCNM-UHFFFAOYSA-N 2 0 245.370 2.241 20 0 BEADRP C([NH2+][C@@H]1CCC[NH2+]CC1)[C@@H]1CCCCS1 ZINC000168772824 533368790 /nfs/dbraw/zinc/36/87/90/533368790.db2.gz VPRWSIWPKDAOSU-NEPJUHHUSA-N 2 0 228.405 2.004 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C/C=C\c2ccncc2)CC[N@@H+]1C ZINC000487321845 533639615 /nfs/dbraw/zinc/63/96/15/533639615.db2.gz RMAGFDVJMFTMLE-SUVXUSRCSA-N 2 0 245.370 2.167 20 0 BEADRP Cc1cc(N2CC[C@H]3[C@H](CCC[N@H+]3C)C2)cc[nH+]1 ZINC000274918799 132204359 /nfs/dbraw/zinc/20/43/59/132204359.db2.gz OTPKBPGOFJQGFP-HIFRSBDPSA-N 2 0 245.370 2.311 20 0 BEADRP C[C@H]1CN(c2cc[nH+]c3ccccc32)CC[NH2+]1 ZINC000052783561 132229475 /nfs/dbraw/zinc/22/94/75/132229475.db2.gz FEXVNISSKILHAR-NSHDSACASA-N 2 0 227.311 2.033 20 0 BEADRP Cc1c[nH+]ccc1N1CCC([C@@H]2CCC[NH2+]2)CC1 ZINC000070489747 132231250 /nfs/dbraw/zinc/23/12/50/132231250.db2.gz NBVHNRCTVMPIAN-AWEZNQCLSA-N 2 0 245.370 2.358 20 0 BEADRP Cc1c[nH+]ccc1N1CCC([C@H]2CCC[NH2+]2)CC1 ZINC000070489748 132231371 /nfs/dbraw/zinc/23/13/71/132231371.db2.gz NBVHNRCTVMPIAN-CQSZACIVSA-N 2 0 245.370 2.358 20 0 BEADRP C[NH2+]CCC1CCN(c2cc[nH+]c(C)c2)CC1 ZINC000162887714 132233789 /nfs/dbraw/zinc/23/37/89/132233789.db2.gz IQJVLPXRUHWAGG-UHFFFAOYSA-N 2 0 233.359 2.216 20 0 BEADRP Cc1c[nH+]ccc1N1CC[N@H+](C)[C@@H](C(C)C)C1 ZINC000358915268 132275971 /nfs/dbraw/zinc/27/59/71/132275971.db2.gz NKDMNEQYAZGXIU-CQSZACIVSA-N 2 0 233.359 2.166 20 0 BEADRP CC[C@@H](C)[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000036960319 132343051 /nfs/dbraw/zinc/34/30/51/132343051.db2.gz YEUSSVLHSCFFIM-GFCCVEGCSA-N 2 0 233.359 2.439 20 0 BEADRP c1cc(N2CCC([NH2+]CC3CCC3)CC2)cc[nH+]1 ZINC000037179312 132343736 /nfs/dbraw/zinc/34/37/36/132343736.db2.gz ZVTYYWSIRBHSTE-UHFFFAOYSA-N 2 0 245.370 2.440 20 0 BEADRP Cc1cc(N2CCC([NH2+]C(C)C)CC2)cc[nH+]1 ZINC000185992370 132447719 /nfs/dbraw/zinc/44/77/19/132447719.db2.gz DCOPULRBXXHSSS-UHFFFAOYSA-N 2 0 233.359 2.357 20 0 BEADRP CC[C@H](C)C[N@@H+]1CC2(C[C@H]1C)CC[NH2+]CC2 ZINC000335277589 133823029 /nfs/dbraw/zinc/82/30/29/133823029.db2.gz JSLPTMVEBFTWFR-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP [NH3+]C1CCC([NH2+][C@H]2CC[C@H]2C2CC2)CC1 ZINC000335498786 133867920 /nfs/dbraw/zinc/86/79/20/133867920.db2.gz VSXXVXZKONRONQ-TYUFSLCMSA-N 2 0 208.349 2.035 20 0 BEADRP C[C@@H]1CC(C)(C)C[C@@H]1[NH2+]CCC[NH+](C)C ZINC000192389997 133997937 /nfs/dbraw/zinc/99/79/37/133997937.db2.gz YPEYTFWNVHSKKB-NEPJUHHUSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H]1CCSCC[N@@H+]1CC[C@H]1CCC[NH+]1C ZINC000335938087 134013158 /nfs/dbraw/zinc/01/31/58/134013158.db2.gz OAFKSKFMSOHTBF-QWHCGFSZSA-N 2 0 242.432 2.298 20 0 BEADRP C[C@H](F)CC[N@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000352050004 134046107 /nfs/dbraw/zinc/04/61/07/134046107.db2.gz PHZKIIJNTKAAHR-RYUDHWBXSA-N 2 0 216.344 2.008 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[N@@H+]1CCC[C@H](C[NH3+])C1 ZINC000347032448 134196351 /nfs/dbraw/zinc/19/63/51/134196351.db2.gz ABIDRIJWUOFBGV-MGPQQGTHSA-N 2 0 224.392 2.483 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]C2CCC2)c2ccccc21 ZINC000169240478 134250206 /nfs/dbraw/zinc/25/02/06/134250206.db2.gz SBLAUDULRUUGNC-CHWSQXEVSA-N 2 0 202.301 2.273 20 0 BEADRP C[C@@H](CC[NH3+])[NH2+]Cc1ccc(Cl)cc1 ZINC000220486683 134305157 /nfs/dbraw/zinc/30/51/57/134305157.db2.gz JJKZHABYPJDTET-VIFPVBQESA-N 2 0 212.724 2.167 20 0 BEADRP COCCC[C@@H](C)[NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1 ZINC000178305184 134305977 /nfs/dbraw/zinc/30/59/77/134305977.db2.gz ISPSKAKNKBEYHR-MCIONIFRSA-N 2 0 242.407 2.264 20 0 BEADRP Cc1cc(C)cc(C[NH2+][C@@H](C)CC[NH3+])c1 ZINC000220538894 134309842 /nfs/dbraw/zinc/30/98/42/134309842.db2.gz TYZQARIIERWZTL-LBPRGKRZSA-N 2 0 206.333 2.130 20 0 BEADRP COc1ccc(C)cc1C[NH2+]C[C@H]1CCCN1C ZINC000221148587 134317220 /nfs/dbraw/zinc/31/72/20/134317220.db2.gz DDRSFKVNRRHGKQ-CQSZACIVSA-N 2 0 248.370 2.187 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CCC[NH+](C)C)[C@@H](C)C1 ZINC000221648909 134325950 /nfs/dbraw/zinc/32/59/50/134325950.db2.gz RNQHERPPMCAAGN-FRRDWIJNSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CCn2ccnc2)[C@@H](C)C1 ZINC000222024270 134329491 /nfs/dbraw/zinc/32/94/91/134329491.db2.gz QQEOIGYCDUNGIR-FRRDWIJNSA-N 2 0 221.348 2.297 20 0 BEADRP Cc1ccccc1C[NH2+][C@@H]1CCCC[C@H]1[NH3+] ZINC000222455691 134332136 /nfs/dbraw/zinc/33/21/36/134332136.db2.gz VVTMHQJUFOYSHP-ZIAGYGMSSA-N 2 0 218.344 2.355 20 0 BEADRP CC[NH+]1CCC([NH2+]CCC(C)(C)C)CC1 ZINC000059313072 134391913 /nfs/dbraw/zinc/39/19/13/134391913.db2.gz BMXHRDZPSYTQKU-UHFFFAOYSA-N 2 0 212.381 2.497 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+][C@@H](C)C1CCCCC1 ZINC000234737557 134584674 /nfs/dbraw/zinc/58/46/74/134584674.db2.gz QFRPXVHUDXXJSW-GXTWGEPZSA-N 2 0 242.407 2.299 20 0 BEADRP Cc1c[nH+]ccc1N(C)C[C@@H]1CCC[N@H+](C)C1 ZINC000192598335 134587163 /nfs/dbraw/zinc/58/71/63/134587163.db2.gz PTHNOMJLYYENSZ-CYBMUJFWSA-N 2 0 233.359 2.168 20 0 BEADRP Cc1c[nH+]ccc1N(C)CC1([NH+](C)C)CCC1 ZINC000192846940 134589969 /nfs/dbraw/zinc/58/99/69/134589969.db2.gz DCSWPJNWOBLPSW-UHFFFAOYSA-N 2 0 233.359 2.311 20 0 BEADRP Cc1nc(C)c([C@H](C)[NH2+]CCCC[NH3+])s1 ZINC000049538728 134633874 /nfs/dbraw/zinc/63/38/74/134633874.db2.gz PUBFGACEJPFBIG-QMMMGPOBSA-N 2 0 227.377 2.149 20 0 BEADRP C[C@H]1OCC[C@@H]1[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000134203615 134705123 /nfs/dbraw/zinc/70/51/23/134705123.db2.gz YFFZSPSKQKTXJO-YPMHNXCESA-N 2 0 240.391 2.016 20 0 BEADRP [NH3+]CCC[NH2+][C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000069381541 134901044 /nfs/dbraw/zinc/90/10/44/134901044.db2.gz IJAWRVGOGPHHBA-DTWKUNHWSA-N 2 0 224.270 2.046 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+]CC2CC[NH+](C)CC2)C1 ZINC000070643698 135001273 /nfs/dbraw/zinc/00/12/73/135001273.db2.gz YVWMRLHIXNECMJ-WCQYABFASA-N 2 0 210.365 2.106 20 0 BEADRP Cc1c[nH+]ccc1N1CC[C@H]2[C@@H](CCC[N@H+]2C)C1 ZINC000248675215 135019557 /nfs/dbraw/zinc/01/95/57/135019557.db2.gz XXQOSNDLFQQKDO-ZFWWWQNUSA-N 2 0 245.370 2.311 20 0 BEADRP CCCCOCCN1CCCC[C@@H]1[C@H](C)[NH3+] ZINC000249881571 135047724 /nfs/dbraw/zinc/04/77/24/135047724.db2.gz NZMIFGFGABLXBG-QWHCGFSZSA-N 2 0 228.380 2.005 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H]2CCC[C@H]2C)C1 ZINC000250257089 135051971 /nfs/dbraw/zinc/05/19/71/135051971.db2.gz JFCSKVSNNWQWRT-UPJWGTAASA-N 2 0 210.365 2.106 20 0 BEADRP CCC(CC)C[N@@H+]1CCC[C@@H]([C@H](C)[NH3+])C1 ZINC000250785083 135058930 /nfs/dbraw/zinc/05/89/30/135058930.db2.gz VUYFQPMJLFLXLU-WCQYABFASA-N 2 0 212.381 2.482 20 0 BEADRP C[C@H](CCCO)[NH2+][C@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000251266010 135066974 /nfs/dbraw/zinc/06/69/74/135066974.db2.gz WSMNXFQKBUBUOV-MGPQQGTHSA-N 2 0 242.407 2.048 20 0 BEADRP C[C@H]1C[N@H+](CCCc2ccccc2)CC[C@H]1[NH3+] ZINC000251615883 135072232 /nfs/dbraw/zinc/07/22/32/135072232.db2.gz DRNWZLBWEXEPDR-DZGCQCFKSA-N 2 0 232.371 2.288 20 0 BEADRP C[C@@H]1CC[C@H](C)[N@H+](CC[C@H]2CC[NH2+]C2)C1 ZINC000251876414 135080735 /nfs/dbraw/zinc/08/07/35/135080735.db2.gz QWZKGKFWHLKVCX-FRRDWIJNSA-N 2 0 210.365 2.106 20 0 BEADRP [NH3+]CCCC[NH2+]Cc1cc(Cl)cs1 ZINC000086332486 135081246 /nfs/dbraw/zinc/08/12/46/135081246.db2.gz SVHIXENKTAGVNR-UHFFFAOYSA-N 2 0 218.753 2.230 20 0 BEADRP CC[C@H](C)C[N@H+](CC)CC1CC[NH2+]CC1 ZINC000086437747 135083978 /nfs/dbraw/zinc/08/39/78/135083978.db2.gz OPIZXJZQNPVOLV-LBPRGKRZSA-N 2 0 212.381 2.354 20 0 BEADRP CC[C@H](C)C[N@H+](CC)[C@@H]1CCC[NH2+]CC1 ZINC000086439149 135084882 /nfs/dbraw/zinc/08/48/82/135084882.db2.gz KHIXURKDGLDEJI-QWHCGFSZSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000252175279 135085456 /nfs/dbraw/zinc/08/54/56/135085456.db2.gz OUXRQVDXXIDWEB-RQJABVFESA-N 2 0 222.376 2.391 20 0 BEADRP C[C@H]1CCCN(Cc2ccc(F)cc2)[C@H]1C[NH3+] ZINC000252171282 135085876 /nfs/dbraw/zinc/08/58/76/135085876.db2.gz NZAHPVGIUWLFBT-FZMZJTMJSA-N 2 0 236.334 2.385 20 0 BEADRP C1CCC([NH2+][C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)C1 ZINC000086494179 135086219 /nfs/dbraw/zinc/08/62/19/135086219.db2.gz UOQKBALSUKDNER-MELADBBJSA-N 2 0 222.376 2.439 20 0 BEADRP C[C@@H]1CCC[N@H+](CC[C@H]2CC[NH2+]C2)CC1 ZINC000252208133 135086628 /nfs/dbraw/zinc/08/66/28/135086628.db2.gz VOSPQWKXVQJGNG-CHWSQXEVSA-N 2 0 210.365 2.108 20 0 BEADRP CCCC[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000086494235 135086645 /nfs/dbraw/zinc/08/66/45/135086645.db2.gz INRLUCPVNUWPIV-UPJWGTAASA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H](C[C@H]1CCCCC[NH2+]1)[NH2+]CC1CC1 ZINC000086500509 135088526 /nfs/dbraw/zinc/08/85/26/135088526.db2.gz CHHJNZBQEZVYRN-WCQYABFASA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)C1 ZINC000252513592 135091912 /nfs/dbraw/zinc/09/19/12/135091912.db2.gz ZMTKJJBHRHCCOM-RQJABVFESA-N 2 0 222.376 2.391 20 0 BEADRP [NH3+]C1CCC([NH2+]CCc2ccsc2)CC1 ZINC000086729293 135095989 /nfs/dbraw/zinc/09/59/89/135095989.db2.gz TZDAPBWHTQDHFM-UHFFFAOYSA-N 2 0 224.373 2.150 20 0 BEADRP CC(C)CC[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C)C1 ZINC000252695929 135097321 /nfs/dbraw/zinc/09/73/21/135097321.db2.gz AYPGVLVFQCYHSV-UONOGXRCSA-N 2 0 224.392 2.449 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]CCc1ccccc1 ZINC000252710985 135099141 /nfs/dbraw/zinc/09/91/41/135099141.db2.gz IFKNTQHOSCZARD-UKRRQHHQSA-N 2 0 232.371 2.159 20 0 BEADRP CC1(C)CC[N@H+](CCC2CC[NH2+]CC2)C1 ZINC000087254840 135116022 /nfs/dbraw/zinc/11/60/22/135116022.db2.gz XFBGMKDOTXNBQB-UHFFFAOYSA-N 2 0 210.365 2.108 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CC[N@@H+](C)C[C@H]2C)cc1 ZINC000252894319 135116380 /nfs/dbraw/zinc/11/63/80/135116380.db2.gz USHVXMRBOYUMRR-UKRRQHHQSA-N 2 0 232.371 2.425 20 0 BEADRP Cc1cc(N[C@@H]2CC[N@@H+]3CCC[C@H]3C2)cc[nH+]1 ZINC000252952354 135117405 /nfs/dbraw/zinc/11/74/05/135117405.db2.gz POBXYQPNWNRYIN-KGLIPLIRSA-N 2 0 231.343 2.429 20 0 BEADRP Cc1ccsc1C[NH2+]C[C@]1(C)CC[NH2+]C1 ZINC000087309981 135121860 /nfs/dbraw/zinc/12/18/60/135121860.db2.gz XJRPUGXIHFBHOF-GFCCVEGCSA-N 2 0 224.373 2.146 20 0 BEADRP C[C@H]1CC[C@H]([NH2+][C@H]2CCC[C@@H]2C[NH3+])CC1 ZINC000253118333 135122113 /nfs/dbraw/zinc/12/21/13/135122113.db2.gz HAOOSEZGYOBHKQ-LPWJVIDDSA-N 2 0 210.365 2.282 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]Cc1sccc1C ZINC000087310027 135122460 /nfs/dbraw/zinc/12/24/60/135122460.db2.gz KLDFSRAYRHBMOL-VIFPVBQESA-N 2 0 212.362 2.002 20 0 BEADRP C[C@H]1CC[N@H+](CCc2ccccc2)C[C@H]1C[NH3+] ZINC000253237440 135124779 /nfs/dbraw/zinc/12/47/79/135124779.db2.gz OYSUCDPVLWUZII-DZGCQCFKSA-N 2 0 232.371 2.146 20 0 BEADRP CC(C)(C)C(C)(C)C[NH2+]C1CC[NH2+]CC1 ZINC000259115995 135136859 /nfs/dbraw/zinc/13/68/59/135136859.db2.gz SVBNTTHYCXCCAS-UHFFFAOYSA-N 2 0 212.381 2.400 20 0 BEADRP CC(C)CC[N@@H+]1CC[C@@]2(C1)CCC[NH2+]C2 ZINC000257712891 135140406 /nfs/dbraw/zinc/14/04/06/135140406.db2.gz UAKPTSYMRTTXSX-ZDUSSCGKSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@H](c1cccnc1)[NH+]1CCC2(CC[NH2+]C2)CC1 ZINC000257751462 135141587 /nfs/dbraw/zinc/14/15/87/135141587.db2.gz UWXNQHFHTOXNMX-CYBMUJFWSA-N 2 0 245.370 2.218 20 0 BEADRP C(C1CCCC1)[N@@H+]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC000257747712 135141594 /nfs/dbraw/zinc/14/15/94/135141594.db2.gz ZXZVCFHIHGTLHG-AWEZNQCLSA-N 2 0 222.376 2.252 20 0 BEADRP CC[C@@H](C)[NH+]1CCC([C@H]2CC[NH2+]C2)CC1 ZINC000259321282 135142799 /nfs/dbraw/zinc/14/27/99/135142799.db2.gz QUNYTQYOVSDZED-YPMHNXCESA-N 2 0 210.365 2.106 20 0 BEADRP C[NH2+]CCCN(C)Cc1ccc(C)c(F)c1 ZINC000087472231 135142898 /nfs/dbraw/zinc/14/28/98/135142898.db2.gz XPSBAJCYSDRLOD-UHFFFAOYSA-N 2 0 224.323 2.175 20 0 BEADRP Cc1[nH+]ccc(NC[C@H]2CC[NH2+]C2)c1Cl ZINC000261529497 135155896 /nfs/dbraw/zinc/15/58/96/135155896.db2.gz AVPFFAGCBAGWJI-VIFPVBQESA-N 2 0 225.723 2.065 20 0 BEADRP C[C@@H]1C[C@H](C)[N@H+](C[C@H]2CC[NH2+][C@H](C)C2)C1 ZINC000261530778 135159314 /nfs/dbraw/zinc/15/93/14/135159314.db2.gz DAOGTQJETADWAV-NDBYEHHHSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@@H]1CCC[N@H+](C[C@H]2CC[NH2+][C@@H](C)C2)C1 ZINC000261531335 135160112 /nfs/dbraw/zinc/16/01/12/135160112.db2.gz GDUQVBUYTYSRJG-AGIUHOORSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1CCCC[C@H]1[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000087646038 135160845 /nfs/dbraw/zinc/16/08/45/135160845.db2.gz JUXZVNCDYBRTCN-JHJVBQTASA-N 2 0 210.365 2.154 20 0 BEADRP C[N@H+](CCCc1ccccc1)C1CC([NH3+])C1 ZINC000087653263 135161191 /nfs/dbraw/zinc/16/11/91/135161191.db2.gz QDMMHCUVMVRIDQ-UHFFFAOYSA-N 2 0 218.344 2.041 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[NH2+]C1)c1ccsc1 ZINC000087647145 135161308 /nfs/dbraw/zinc/16/13/08/135161308.db2.gz NXOQPCAYDCRWMB-QWRGUYRKSA-N 2 0 224.373 2.398 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CC[NH2+]C[C@@H]2C)s1 ZINC000261531944 135161660 /nfs/dbraw/zinc/16/16/60/135161660.db2.gz ILRXSYUARHTXEA-JOYOIKCWSA-N 2 0 224.373 2.144 20 0 BEADRP CC[C@@H]1C[N@H+](C[C@H]2CC[NH2+][C@@H](C)C2)CCS1 ZINC000261533415 135164918 /nfs/dbraw/zinc/16/49/18/135164918.db2.gz IHCGJTOYNRXHTN-RWMBFGLXSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2CCC[C@H](C)[C@@H]2C)CC[NH2+]1 ZINC000261533911 135165677 /nfs/dbraw/zinc/16/56/77/135165677.db2.gz LDGOYXDXDFYFRM-RFQIPJPRSA-N 2 0 224.392 2.495 20 0 BEADRP CCC[N@H+](CC1CC1)C[C@H]1CC[NH2+][C@H](C)C1 ZINC000261534483 135166630 /nfs/dbraw/zinc/16/66/30/135166630.db2.gz REMWBNMXUDUQCZ-OCCSQVGLSA-N 2 0 224.392 2.497 20 0 BEADRP CSc1ccc(CN2C[C@H](C)[C@H]([NH3+])C2)cc1 ZINC000261534339 135166954 /nfs/dbraw/zinc/16/69/54/135166954.db2.gz PZAHVCYKCZFBQZ-GXFFZTMASA-N 2 0 236.384 2.188 20 0 BEADRP CC(C)[C@H]1CC[N@H+](C[C@H]2CC[NH2+][C@H](C)C2)C1 ZINC000261535243 135169616 /nfs/dbraw/zinc/16/96/16/135169616.db2.gz XECAGSGUGWSYDN-RDBSUJKOSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]([NH3+])[C@H]1CC[N@H+](CCC2CCCC2)C1 ZINC000261535562 135170006 /nfs/dbraw/zinc/17/00/06/135170006.db2.gz ONXWXSRLUDJVDF-YPMHNXCESA-N 2 0 210.365 2.236 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[NH2+]C[C@H]2C)C1 ZINC000261535652 135170176 /nfs/dbraw/zinc/17/01/76/135170176.db2.gz OXJXYFMMSDRMFP-FVCCEPFGSA-N 2 0 210.365 2.153 20 0 BEADRP CC1(C)C[C@@H]1C[NH2+][C@@H]1CCCC[C@H]1C[NH3+] ZINC000261536368 135171491 /nfs/dbraw/zinc/17/14/91/135171491.db2.gz RKRZMJPEQLIEJF-QJPTWQEYSA-N 2 0 210.365 2.140 20 0 BEADRP CC[N@H+](C[C@H]1CCC[NH2+]C1)[C@H](C)C(C)C ZINC000261537023 135172682 /nfs/dbraw/zinc/17/26/82/135172682.db2.gz UPBZWXISNFUCNT-OLZOCXBDSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H]1C[C@H]([NH2+]C[C@@H]2CCC[NH2+]2)C[C@@H](C)C1 ZINC000261538229 135175888 /nfs/dbraw/zinc/17/58/88/135175888.db2.gz XMZHASAWCUCKSG-QNWHQSFQSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1C[N@@H+]([C@H]2CCCc3ccccc32)C[C@@H]1[NH3+] ZINC000261540056 135178555 /nfs/dbraw/zinc/17/85/55/135178555.db2.gz DEILVRRDRKFJOK-UGFHNGPFSA-N 2 0 230.355 2.343 20 0 BEADRP C[C@@]1(C[N@H+]2C[C@@H]3CCCC[C@@H]3C2)CC[NH2+]C1 ZINC000261540789 135180367 /nfs/dbraw/zinc/18/03/67/135180367.db2.gz FFMPQEXWABXQIV-HZSPNIEDSA-N 2 0 222.376 2.108 20 0 BEADRP Cc1ccc(F)c(C[N@H+]2CC[C@@H]([C@H](C)[NH3+])C2)c1 ZINC000261541953 135181821 /nfs/dbraw/zinc/18/18/21/135181821.db2.gz MYNLWWMGHNEGSJ-NWDGAFQWSA-N 2 0 236.334 2.303 20 0 BEADRP Cc1cc(C[N@@H+]2CC[C@](C)(C[NH3+])C2)ccc1F ZINC000261542090 135182669 /nfs/dbraw/zinc/18/26/69/135182669.db2.gz BSFKLTPYJBGGRB-CQSZACIVSA-N 2 0 236.334 2.305 20 0 BEADRP C[C@@H]1[C@H]([NH3+])CCN1Cc1ccc(C2CC2)cc1 ZINC000261544050 135185299 /nfs/dbraw/zinc/18/52/99/135185299.db2.gz DNVRPUTVNLAKCK-IAQYHMDHSA-N 2 0 230.355 2.486 20 0 BEADRP CCO[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@@H]([NH3+])C2)C1(C)C ZINC000261544459 135185355 /nfs/dbraw/zinc/18/53/55/135185355.db2.gz YFNCRNSLQOBOBF-MROQNXINSA-N 2 0 240.391 2.050 20 0 BEADRP CCO[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@H]([NH3+])C2)C1(C)C ZINC000261544461 135185465 /nfs/dbraw/zinc/18/54/65/135185465.db2.gz YFNCRNSLQOBOBF-ZDEQEGDKSA-N 2 0 240.391 2.050 20 0 BEADRP C[C@@H]1C[N@H+](C[C@@H]2CCC[NH2+]C2)C(C)(C)C1 ZINC000261549143 135187532 /nfs/dbraw/zinc/18/75/32/135187532.db2.gz OGHKUTZUFXUHPX-NWDGAFQWSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[NH2+]C[C@@H]1C)c1cccc(F)c1 ZINC000261550636 135188991 /nfs/dbraw/zinc/18/89/91/135188991.db2.gz LIKUGSIBXPTPGL-COPLHBTASA-N 2 0 236.334 2.474 20 0 BEADRP C[C@@H]1C[C@H](C[N@H+]2C[C@@H]3CCCC[C@@H]3C2)CC[NH2+]1 ZINC000261550987 135190521 /nfs/dbraw/zinc/19/05/21/135190521.db2.gz LRQUZASCMFDBTJ-TUVASFSCSA-N 2 0 236.403 2.497 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]CC1CCCC1 ZINC000084215938 135191709 /nfs/dbraw/zinc/19/17/09/135191709.db2.gz CPAVKGZWKZYTTC-STQMWFEESA-N 2 0 210.365 2.284 20 0 BEADRP Cc1ccc(C[N@@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@@H]3C2)c(C)c1 ZINC000261556314 135196286 /nfs/dbraw/zinc/19/62/86/135196286.db2.gz BWSNHHYCPGYUKB-ARFHVFGLSA-N 2 0 244.382 2.473 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[NH2+]C[C@@H]1C)c1ccc(F)cc1 ZINC000261558430 135199853 /nfs/dbraw/zinc/19/98/53/135199853.db2.gz SJMSFSURCXEBPR-MJVIPROJSA-N 2 0 236.334 2.474 20 0 BEADRP CC1CCC(C[N@@H+]2CC[C@]3(CC[NH2+]C3)C2)CC1 ZINC000261562892 135204673 /nfs/dbraw/zinc/20/46/73/135204673.db2.gz WRFBCNGOUAIHDE-NRXISQOPSA-N 2 0 236.403 2.498 20 0 BEADRP C[C@H]1[C@H]([NH3+])CCN1Cc1coc2ccccc12 ZINC000261563685 135205161 /nfs/dbraw/zinc/20/51/61/135205161.db2.gz XDIKNKOHFXWATR-GXFFZTMASA-N 2 0 230.311 2.354 20 0 BEADRP Cc1cccc(C[NH2+][C@H]2CC[NH2+]CC2(C)C)c1 ZINC000261564143 135206195 /nfs/dbraw/zinc/20/61/95/135206195.db2.gz XNCHYNQJSSRABR-AWEZNQCLSA-N 2 0 232.371 2.473 20 0 BEADRP Cc1ccc(C[N@@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@@H]3C2)s1 ZINC000261572768 135214747 /nfs/dbraw/zinc/21/47/47/135214747.db2.gz IGUYPHSKDIGVEJ-CYZMBNFOSA-N 2 0 236.384 2.226 20 0 BEADRP Cc1ccc(C[N@@H+]2C[C@@H]3CC[C@H]([NH3+])[C@@H]3C2)s1 ZINC000261572770 135214846 /nfs/dbraw/zinc/21/48/46/135214846.db2.gz IGUYPHSKDIGVEJ-UHTWSYAYSA-N 2 0 236.384 2.226 20 0 BEADRP Cc1ccc(C[N@@H+]2C[C@@H]3CC[C@H]([NH3+])[C@H]3C2)s1 ZINC000261572769 135215074 /nfs/dbraw/zinc/21/50/74/135215074.db2.gz IGUYPHSKDIGVEJ-DRZSPHRISA-N 2 0 236.384 2.226 20 0 BEADRP C[C@@H]1C[C@@H](C)[N@H+](CC[C@@H]2CCC[NH2+]C2)C1 ZINC000164188630 135215369 /nfs/dbraw/zinc/21/53/69/135215369.db2.gz GIYRGRDOZNJLRL-UPJWGTAASA-N 2 0 210.365 2.106 20 0 BEADRP Cc1ccc(C[N@@H+]2C[C@@H]3CC[C@H]([NH3+])[C@@H]3C2)cc1F ZINC000261575512 135217014 /nfs/dbraw/zinc/21/70/14/135217014.db2.gz NDJLJECDSMWMIU-GUTXKFCHSA-N 2 0 248.345 2.303 20 0 BEADRP C[C@H]1C[C@H]([NH2+][C@H]2CC[NH2+]C[C@H]2C)C[C@@H](C)C1 ZINC000261576030 135217599 /nfs/dbraw/zinc/21/75/99/135217599.db2.gz KBEUSITWVORGFM-BJJPWKGXSA-N 2 0 224.392 2.399 20 0 BEADRP Cc1cc(F)ccc1CN1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000261576472 135217654 /nfs/dbraw/zinc/21/76/54/135217654.db2.gz NQXHUKXOXULNQA-OCCSQVGLSA-N 2 0 248.345 2.175 20 0 BEADRP CC(C)C[N@H+](CC[C@@H]1CC[NH2+]C1)C1CC1 ZINC000084385382 135218022 /nfs/dbraw/zinc/21/80/22/135218022.db2.gz PMUOJAGHODZNSK-LBPRGKRZSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]([NH3+])[C@H](C)[NH2+][C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000261578272 135219138 /nfs/dbraw/zinc/21/91/38/135219138.db2.gz LQQKZMLEMUQVKO-QEYWKRMJSA-N 2 0 238.297 2.433 20 0 BEADRP Cc1cccc(C)c1C[N@@H+]1C[C@@H]2CC[C@H]([NH3+])[C@H]2C1 ZINC000261578011 135219342 /nfs/dbraw/zinc/21/93/42/135219342.db2.gz ORUGOYHYMZZVAS-BPUTZDHNSA-N 2 0 244.382 2.473 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2C[C@H]([NH3+])c3ccccc32)CCO1 ZINC000261580986 135221503 /nfs/dbraw/zinc/22/15/03/135221503.db2.gz QGVDSYPBTDDYBZ-FIXIBIHLSA-N 2 0 246.354 2.288 20 0 BEADRP Cc1ccc(C)c(C[N@@H+]2CC[C@@H]3C[NH2+]C[C@H]3C2)c1 ZINC000261585622 135226794 /nfs/dbraw/zinc/22/67/94/135226794.db2.gz TYCRLJLTKXELAM-ZBFHGGJFSA-N 2 0 244.382 2.345 20 0 BEADRP C[NH2+]C[C@@H]1CCC[N@H+](CCC2CCCC2)C1 ZINC000261587660 135228765 /nfs/dbraw/zinc/22/87/65/135228765.db2.gz RXSJOIAOGBJNGT-AWEZNQCLSA-N 2 0 224.392 2.498 20 0 BEADRP CCC[C@](C)(O)C[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000261588569 135229005 /nfs/dbraw/zinc/22/90/05/135229005.db2.gz VUARDMXPTCUMJH-ZNMIVQPWSA-N 2 0 248.370 2.272 20 0 BEADRP Cc1[nH+]ccc(N2CC[C@@H]([C@@H](C)[NH3+])C2)c1Cl ZINC000261588369 135229173 /nfs/dbraw/zinc/22/91/73/135229173.db2.gz SIFOWTUYLVMLJE-PSASIEDQSA-N 2 0 239.750 2.217 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@@H]3C[NH2+]C[C@@H]3C2)c(C)c1 ZINC000261589544 135229833 /nfs/dbraw/zinc/22/98/33/135229833.db2.gz WIULJQVIKAIZNY-GDBMZVCRSA-N 2 0 244.382 2.345 20 0 BEADRP C[C@H]1CC[C@@]2(CC[N@H+](CC(C)(C)[NH3+])C2)C1 ZINC000261589647 135229846 /nfs/dbraw/zinc/22/98/46/135229846.db2.gz UAABZOQFBFNGIW-WCQYABFASA-N 2 0 210.365 2.236 20 0 BEADRP C(C1CCCCC1)[N@@H+]1CC[C@H]2[NH2+]CC[C@@H]2C1 ZINC000261597534 135237117 /nfs/dbraw/zinc/23/71/17/135237117.db2.gz ZEUMRFFJIRUTRN-ZIAGYGMSSA-N 2 0 222.376 2.251 20 0 BEADRP Cc1cccc(C[N@@H+]2C[C@@H]3CC[C@H]([NH3+])[C@@H]3C2)c1 ZINC000261546222 135238415 /nfs/dbraw/zinc/23/84/15/135238415.db2.gz GRGCUMVSEXEEKM-ZNMIVQPWSA-N 2 0 230.355 2.164 20 0 BEADRP CC[C@H]1[C@H](C)CC[N@@H+]1CC1CC[NH2+]CC1 ZINC000261546634 135239066 /nfs/dbraw/zinc/23/90/66/135239066.db2.gz LCGFSXSDRPPVDA-YPMHNXCESA-N 2 0 210.365 2.106 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]C[C@H]2CCSC2)c2ccccc21 ZINC000261547268 135239976 /nfs/dbraw/zinc/23/99/76/135239976.db2.gz HVTRAKQEGALVOG-HONMWMINSA-N 2 0 248.395 2.474 20 0 BEADRP C([C@H]1CCC[NH2+]C1)[N@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000261547391 135240179 /nfs/dbraw/zinc/24/01/79/135240179.db2.gz MHSPCQAWSLPLQQ-MELADBBJSA-N 2 0 222.376 2.108 20 0 BEADRP CCOCC(C)(C)C[NH2+][C@H]1CCCC[C@H]1C[NH3+] ZINC000261548071 135241886 /nfs/dbraw/zinc/24/18/86/135241886.db2.gz JBCCGAUFHWRMHZ-STQMWFEESA-N 2 0 242.407 2.156 20 0 BEADRP C[C@H]1CC[N@H+](CC2CC[NH2+]CC2)CC12CCC2 ZINC000261642218 135242296 /nfs/dbraw/zinc/24/22/96/135242296.db2.gz AHGYSNVKLMGUGY-ZDUSSCGKSA-N 2 0 236.403 2.498 20 0 BEADRP C[C@H](C[N@@H+]1CC[C@@H](C[NH3+])C1)c1ccc(F)cc1 ZINC000261652300 135242602 /nfs/dbraw/zinc/24/26/02/135242602.db2.gz BCXWNZFTRRUMCB-NEPJUHHUSA-N 2 0 236.334 2.210 20 0 BEADRP C[C@@H](C[N@@H+]1CC[C@@H](C[NH3+])C1)c1ccc(F)cc1 ZINC000261652304 135242635 /nfs/dbraw/zinc/24/26/35/135242635.db2.gz BCXWNZFTRRUMCB-RYUDHWBXSA-N 2 0 236.334 2.210 20 0 BEADRP C[C@@H]1CCC[C@@H](CC[N@@H+]2CCC[NH2+]CC2)C1 ZINC000078806687 135243622 /nfs/dbraw/zinc/24/36/22/135243622.db2.gz WYCZOPFJAUQWGY-KGLIPLIRSA-N 2 0 224.392 2.498 20 0 BEADRP CC(C)[C@@H]1C[N@H+](C[C@@]2(C)CC[NH2+]C2)CCS1 ZINC000261729284 135248071 /nfs/dbraw/zinc/24/80/71/135248071.db2.gz GZBJBWCMIQPTKL-STQMWFEESA-N 2 0 242.432 2.059 20 0 BEADRP C[C@@H]1CC2(CCC2)C[N@@H+]1C[C@@]1(C)CC[NH2+]C1 ZINC000261740108 135248865 /nfs/dbraw/zinc/24/88/65/135248865.db2.gz IHBACOPDXKTAJN-OLZOCXBDSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@@H]1C[C@H]1C[NH+]1CCC([C@H]2CCC[NH2+]2)CC1 ZINC000261760767 135250462 /nfs/dbraw/zinc/25/04/62/135250462.db2.gz CYDVLUXSSZRSKX-KWCYVHTRSA-N 2 0 222.376 2.106 20 0 BEADRP C[C@H]1CC[N@H+](C[C@@]2(C)CC[NH2+]C2)CC1(C)C ZINC000261768983 135251433 /nfs/dbraw/zinc/25/14/33/135251433.db2.gz MIOCHGPBBOSMQM-JSGCOSHPSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H]1CC[N@H+](CC2CC[NH2+]CC2)CC1(C)C ZINC000261819317 135255436 /nfs/dbraw/zinc/25/54/36/135255436.db2.gz IFZIYVJNCXVJJX-GFCCVEGCSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@H]1C[N@H+](CC2CC[NH2+]CC2)CC(C)(C)C1 ZINC000261829514 135256048 /nfs/dbraw/zinc/25/60/48/135256048.db2.gz IXXVULRTIVWKPG-GFCCVEGCSA-N 2 0 224.392 2.354 20 0 BEADRP Cn1cccc1[C@H]1CCC[N@@H+]1C[C@@]1(C)CC[NH2+]C1 ZINC000261867950 135258402 /nfs/dbraw/zinc/25/84/02/135258402.db2.gz OGEBFWIOUGWAFJ-CABCVRRESA-N 2 0 247.386 2.162 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@@]2(C)CC[NH2+]C2)CC12CCC2 ZINC000261917404 135262913 /nfs/dbraw/zinc/26/29/13/135262913.db2.gz ZUHBSANXONROJQ-KGLIPLIRSA-N 2 0 236.403 2.498 20 0 BEADRP CC[C@@H]1CCC[C@H](C[N@@H+]2C[C@@H](C)[C@H]([NH3+])C2)C1 ZINC000261961718 135267145 /nfs/dbraw/zinc/26/71/45/135267145.db2.gz HJGBMLNDKDXVHO-YIYPIFLZSA-N 2 0 224.392 2.482 20 0 BEADRP CCOc1ccc2c(c1)CCN(CC(C)(C)[NH3+])C2 ZINC000262028179 135273630 /nfs/dbraw/zinc/27/36/30/135273630.db2.gz WWXYXOKDDIRJMJ-UHFFFAOYSA-N 2 0 248.370 2.181 20 0 BEADRP COc1cc(C[N@@H+]2CC[C@](C)(C[NH3+])C2)ccc1C ZINC000262022165 135274239 /nfs/dbraw/zinc/27/42/39/135274239.db2.gz WHMDAVQPTWFBAL-OAHLLOKOSA-N 2 0 248.370 2.174 20 0 BEADRP C[C@@H]1CCC[C@H](C)[N@H+](C[C@]2(C)CC[NH2+]C2)C1 ZINC000262043234 135276092 /nfs/dbraw/zinc/27/60/92/135276092.db2.gz PJMDZKLQCWQFGX-HZSPNIEDSA-N 2 0 224.392 2.497 20 0 BEADRP C[N@H+](C[C@]1(C)CC[NH2+]C1)[C@H]1CCC(C)(C)C1 ZINC000262075160 135277750 /nfs/dbraw/zinc/27/77/50/135277750.db2.gz SKYXHOWRNMGDKB-GXTWGEPZSA-N 2 0 224.392 2.497 20 0 BEADRP C[N@H+](C[C@@]1(C)CC[NH2+]C1)[C@H]1CCC(C)(C)C1 ZINC000262075161 135278023 /nfs/dbraw/zinc/27/80/23/135278023.db2.gz SKYXHOWRNMGDKB-JSGCOSHPSA-N 2 0 224.392 2.497 20 0 BEADRP C[N@H+](C[C@]1(C)CC[NH2+]C1)C(C1CC1)C1CC1 ZINC000262089382 135279086 /nfs/dbraw/zinc/27/90/86/135279086.db2.gz URSZFVNIMPLKOP-CQSZACIVSA-N 2 0 222.376 2.106 20 0 BEADRP CC(C)(C)[C@H]1CCC[N@@H+]1C[C@]1(C)CC[NH2+]C1 ZINC000262110977 135279604 /nfs/dbraw/zinc/27/96/04/135279604.db2.gz WKHVMTRERXNDMK-TZMCWYRMSA-N 2 0 224.392 2.497 20 0 BEADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@@H]1CCC1(C)C ZINC000342735902 135316629 /nfs/dbraw/zinc/31/66/29/135316629.db2.gz PTWMSWLWOSOTJE-CHWSQXEVSA-N 2 0 242.407 2.121 20 0 BEADRP Cc1ncc(C[NH2+][C@H]2CCCC[C@@H]2C[NH3+])s1 ZINC000084216398 135467539 /nfs/dbraw/zinc/46/75/39/135467539.db2.gz VLPRGEIICPAPMZ-PWSUYJOCSA-N 2 0 239.388 2.059 20 0 BEADRP COCc1ccccc1C[NH2+]C1CCC([NH3+])CC1 ZINC000088557292 135523204 /nfs/dbraw/zinc/52/32/04/135523204.db2.gz NPMJGNCRWGBBBQ-UHFFFAOYSA-N 2 0 248.370 2.193 20 0 BEADRP Fc1cccc2c1CC[C@H]2[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000334862416 135826808 /nfs/dbraw/zinc/82/68/08/135826808.db2.gz LIIKPFAYKZAHGM-IAQYHMDHSA-N 2 0 248.345 2.402 20 0 BEADRP CC1(C)CCCC[C@@H]1[NH2+]C[C@@H]1CC[NH2+]C1 ZINC000335175814 135931819 /nfs/dbraw/zinc/93/18/19/135931819.db2.gz PQSKPGPESYYESS-NEPJUHHUSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H]1CC[C@H]([NH+]2CCC(C[NH+](C)C)CC2)C1 ZINC000335318194 136025809 /nfs/dbraw/zinc/02/58/09/136025809.db2.gz KAKDUWIHZISZLE-JSGCOSHPSA-N 2 0 224.392 2.449 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[N@H+](C)C1CC[NH2+]CC1 ZINC000335336879 136044310 /nfs/dbraw/zinc/04/43/10/136044310.db2.gz VNOOMWHPTMTKEF-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@@H]2C[C@@H]2C(F)F)[C@H]2CCC[C@H]21 ZINC000348253794 136057057 /nfs/dbraw/zinc/05/70/57/136057057.db2.gz FNDHLNSTAPQOMF-YBXAARCKSA-N 2 0 244.329 2.102 20 0 BEADRP FC1(CC[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)CCC1 ZINC000348336943 136075656 /nfs/dbraw/zinc/07/56/56/136075656.db2.gz SPPNAIRNRHNKEM-STQMWFEESA-N 2 0 240.366 2.485 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CC[C@H](F)C2)[C@@H]2CCC[C@H]21 ZINC000348391223 136076193 /nfs/dbraw/zinc/07/61/93/136076193.db2.gz HUPQOSUVPLTAOD-ZUWCUPBKSA-N 2 0 240.366 2.339 20 0 BEADRP Cc1cnc([C@H](C)[NH+]2CCC([C@H](C)[NH3+])CC2)o1 ZINC000335387065 136089345 /nfs/dbraw/zinc/08/93/45/136089345.db2.gz QEUGEGDAEJYZFU-QWRGUYRKSA-N 2 0 237.347 2.103 20 0 BEADRP Cc1cnc([C@H](C)[NH+]2CCC3(CC[NH2+]C3)CC2)o1 ZINC000335393400 136091911 /nfs/dbraw/zinc/09/19/11/136091911.db2.gz COXZQCCTHSQQLN-LBPRGKRZSA-N 2 0 249.358 2.120 20 0 BEADRP Cc1cc(N)cc(C[NH2+][C@H]2CCCCC[C@H]2[NH3+])c1 ZINC000335364713 136095299 /nfs/dbraw/zinc/09/52/99/136095299.db2.gz WDNQNOWSTWYLEE-CABCVRRESA-N 2 0 247.386 2.327 20 0 BEADRP Fc1ccc2c(c1)[C@H]([NH2+]CC1C[NH2+]C1)CCC2 ZINC000335551532 136097885 /nfs/dbraw/zinc/09/78/85/136097885.db2.gz GSPFSWGTXSWICK-CQSZACIVSA-N 2 0 234.318 2.012 20 0 BEADRP C[N@H+](CCC[NH3+])C[C@@H]1CCCC(C)(C)C1 ZINC000390433281 397889323 /nfs/dbraw/zinc/88/93/23/397889323.db2.gz AYQUHSZTVYOTTN-GFCCVEGCSA-N 2 0 212.381 2.483 20 0 BEADRP CN1CCC[C@@H]1C[NH2+]C1(c2ccccc2)CC1 ZINC000649575117 397966108 /nfs/dbraw/zinc/96/61/08/397966108.db2.gz DFUTWTAIHNIGBV-CQSZACIVSA-N 2 0 230.355 2.360 20 0 BEADRP C[C@@H](Cc1ccoc1)[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000449079187 397951404 /nfs/dbraw/zinc/95/14/04/397951404.db2.gz XPQGHSZADYYIGK-GXTWGEPZSA-N 2 0 248.370 2.285 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000449079189 397951525 /nfs/dbraw/zinc/95/15/25/397951525.db2.gz XPQGHSZADYYIGK-OCCSQVGLSA-N 2 0 248.370 2.285 20 0 BEADRP Cc1ccc(C[C@@H]2CCC[N@@H+]2CCC[NH3+])cc1 ZINC000414689038 398018594 /nfs/dbraw/zinc/01/85/94/398018594.db2.gz FGWUNUOTIKVYEF-HNNXBMFYSA-N 2 0 232.371 2.351 20 0 BEADRP CC[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)C(C)C ZINC000336732675 398025245 /nfs/dbraw/zinc/02/52/45/398025245.db2.gz LWAHTIHKOJXWQW-CYBMUJFWSA-N 2 0 210.365 2.273 20 0 BEADRP C[N@H+](C[C@@H]1C[C@H]1c1ccccc1)C1CC([NH3+])C1 ZINC000414764852 398028139 /nfs/dbraw/zinc/02/81/39/398028139.db2.gz BGBYCBXZYKMZRE-PPWQZUPISA-N 2 0 230.355 2.212 20 0 BEADRP C[C@H](c1ccccc1)[N@H+](C)C[C@@H]1CC[NH2+]C1 ZINC000197302122 397971621 /nfs/dbraw/zinc/97/16/21/397971621.db2.gz YAQVUKXLGVEJBT-CHWSQXEVSA-N 2 0 218.344 2.289 20 0 BEADRP CCC[C@@H](C)C[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000414855175 398063389 /nfs/dbraw/zinc/06/33/89/398063389.db2.gz VVXKVRXRQWICPM-CHWSQXEVSA-N 2 0 212.381 2.402 20 0 BEADRP Cc1cccc(C[NH2+][C@@H](C)[C@H]2CCC[NH2+]C2)c1 ZINC000414857828 398065868 /nfs/dbraw/zinc/06/58/68/398065868.db2.gz QHCKKUWBHDJRTF-ZFWWWQNUSA-N 2 0 232.371 2.473 20 0 BEADRP C[C@@H](Cc1ccoc1)[NH2+][C@H]1CCN(CC2CC2)C1 ZINC000648450099 398051806 /nfs/dbraw/zinc/05/18/06/398051806.db2.gz SWHOBRNZFHQSHL-WFASDCNBSA-N 2 0 248.370 2.285 20 0 BEADRP CC[C@@H]1CCC[C@H]([NH2+]C[C@H](C)C[NH2+]C)C1 ZINC000414850674 398057440 /nfs/dbraw/zinc/05/74/40/398057440.db2.gz ZRHRAXXISDCTKD-UPJWGTAASA-N 2 0 212.381 2.400 20 0 BEADRP CCC(CC)(C[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1)OC ZINC000383993540 398102429 /nfs/dbraw/zinc/10/24/29/398102429.db2.gz NMHJWAJLKZOGPY-QWHCGFSZSA-N 2 0 242.407 2.264 20 0 BEADRP FC1(F)CC12CC[NH+](CCn1ccnc1)CC2 ZINC000649774520 398098106 /nfs/dbraw/zinc/09/81/06/398098106.db2.gz HSZGOGCNVJZYJB-UHFFFAOYSA-N 2 0 241.285 2.004 20 0 BEADRP C[C@@H]([NH2+]CCCCF)C1CC[NH+](C)CC1 ZINC000389608096 398116080 /nfs/dbraw/zinc/11/60/80/398116080.db2.gz ZNNPCJJLPKVKST-LLVKDONJSA-N 2 0 216.344 2.056 20 0 BEADRP C[N@@H+]1CCC[C@@H]1CC[NH2+]C1(C2CCC2)CC1 ZINC000649810591 398116981 /nfs/dbraw/zinc/11/69/81/398116981.db2.gz RMLINMHRFILMCW-CYBMUJFWSA-N 2 0 222.376 2.393 20 0 BEADRP CCOc1cccc(C[NH2+][C@H]2CC[NH2+][C@H](C)C2)c1 ZINC000414945755 398121195 /nfs/dbraw/zinc/12/11/95/398121195.db2.gz IVAQVSYJIRENHS-OCCSQVGLSA-N 2 0 248.370 2.315 20 0 BEADRP COc1ccc(C)cc1C[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000414932455 398111996 /nfs/dbraw/zinc/11/19/96/398111996.db2.gz VTQYHCCQCTUQAW-KGLIPLIRSA-N 2 0 248.370 2.363 20 0 BEADRP [NH3+]CCCC[N@@H+]1CCCc2ccccc2C1 ZINC000062944366 1172791586 /nfs/dbraw/zinc/79/15/86/1172791586.db2.gz LCESTNVJILXCIZ-UHFFFAOYSA-N 2 0 218.344 2.174 20 0 BEADRP C[C@@H](CCC1CC1)[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000398235354 322866852 /nfs/dbraw/zinc/86/68/52/322866852.db2.gz VVZGGBPBSMJANX-WCQYABFASA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H](CCC1CC1)[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000398235353 322866930 /nfs/dbraw/zinc/86/69/30/322866930.db2.gz VVZGGBPBSMJANX-DGCLKSJQSA-N 2 0 210.365 2.154 20 0 BEADRP C[N@@H+](Cc1cccc(N)c1)CC1CC[NH+](C)CC1 ZINC000063119707 1172799736 /nfs/dbraw/zinc/79/97/36/1172799736.db2.gz BLOBTJBAUKPIEK-UHFFFAOYSA-N 2 0 247.386 2.042 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1ccccc1 ZINC000258632715 322875648 /nfs/dbraw/zinc/87/56/48/322875648.db2.gz DBRYBGPBRLSUSX-CHWSQXEVSA-N 2 0 218.344 2.337 20 0 BEADRP Cc1cc(C)c(C[NH2+]C[C@H](C)C[NH3+])c(C)c1 ZINC000258810336 322876594 /nfs/dbraw/zinc/87/65/94/322876594.db2.gz SKJAWUVYMIFNOH-LLVKDONJSA-N 2 0 220.360 2.296 20 0 BEADRP CC(C)[NH2+]C[C@]1(N(C)C)CCC[C@H](C)C1 ZINC000040668401 167117602 /nfs/dbraw/zinc/11/76/02/167117602.db2.gz SDCFIEBGHKXLIW-STQMWFEESA-N 2 0 212.381 2.495 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+]CCC1CCCCC1 ZINC000259042076 322879529 /nfs/dbraw/zinc/87/95/29/322879529.db2.gz PGXZVSALOJJIMJ-QWHCGFSZSA-N 2 0 210.365 2.426 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]Cc2cccc3c2NCC3)C1 ZINC000334849093 487573717 /nfs/dbraw/zinc/57/37/17/487573717.db2.gz VDIVYAJWHMIKGE-KGLIPLIRSA-N 2 0 245.370 2.014 20 0 BEADRP CC(C)OCCC[N@@H+]1CCCC[C@H]1CC[NH3+] ZINC000352504847 167212716 /nfs/dbraw/zinc/21/27/16/167212716.db2.gz VIJFQJJYCMVWCQ-ZDUSSCGKSA-N 2 0 228.380 2.005 20 0 BEADRP CC1=C[C@H](C)C[C@H](C[N@H+]2C[C@H]3C[NH2+]C[C@H]3C2)C1 ZINC000685839070 487585213 /nfs/dbraw/zinc/58/52/13/487585213.db2.gz YWFMQHHTNUNLGK-CYUUQNCZSA-N 2 0 234.387 2.130 20 0 BEADRP CC(C)OC[C@H](C)[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000337253983 167263470 /nfs/dbraw/zinc/26/34/70/167263470.db2.gz MDAFEWIAQMRBFV-ZDUSSCGKSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H]1C[C@H]1C[NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000668820998 487596496 /nfs/dbraw/zinc/59/64/96/487596496.db2.gz ZZCGQSMIIVMAOT-YUELXQCFSA-N 2 0 236.403 2.354 20 0 BEADRP Cc1cccc(C)c1OCCC[NH2+]CCC[NH3+] ZINC000349144482 487596604 /nfs/dbraw/zinc/59/66/04/487596604.db2.gz OXUDTPVICPOXPJ-UHFFFAOYSA-N 2 0 236.359 2.011 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@@H]([NH2+]Cc3cccs3)[C@H]2C1 ZINC001651698262 1172976748 /nfs/dbraw/zinc/97/67/48/1172976748.db2.gz UDYXAXLYVBCINI-WCFLWFBJSA-N 2 0 236.384 2.178 20 0 BEADRP COCC[C@@H](C)[N@H+](C)CC[C@@H]1CCCC[NH+]1C ZINC000531780034 487602010 /nfs/dbraw/zinc/60/20/10/487602010.db2.gz ZEBCUCWWHIPQQA-KGLIPLIRSA-N 2 0 242.407 2.218 20 0 BEADRP CC[C@@H]1CC[C@@H](C)[N@H+](C[C@H]2CC[NH2+]C2)C1 ZINC000308965246 487602302 /nfs/dbraw/zinc/60/23/02/487602302.db2.gz LYJNKKINJOAFMZ-UPJWGTAASA-N 2 0 210.365 2.106 20 0 BEADRP Clc1sccc1C[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000312764158 322923245 /nfs/dbraw/zinc/92/32/45/322923245.db2.gz LPSHVMJRTARZGF-SECBINFHSA-N 2 0 244.791 2.491 20 0 BEADRP CC(C)SCC[N@@H+]1CC[C@H](C[NH+](C)C)C1 ZINC000336677684 167326520 /nfs/dbraw/zinc/32/65/20/167326520.db2.gz ICNMROKACVWYAC-GFCCVEGCSA-N 2 0 230.421 2.012 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](CC3CC=CC3)C[C@@H]21 ZINC000662265064 409561567 /nfs/dbraw/zinc/56/15/67/409561567.db2.gz FUCICWBUZLRUSN-HZSPNIEDSA-N 2 0 220.360 2.012 20 0 BEADRP CC(C)=CCC[NH+]1CCC(OCCC[NH3+])CC1 ZINC000662247242 409542881 /nfs/dbraw/zinc/54/28/81/409542881.db2.gz DJSLUNNULFUZGN-UHFFFAOYSA-N 2 0 240.391 2.173 20 0 BEADRP C(C[N@@H+]1CCC[C@@H]([C@H]2CC[NH2+]C2)C1)C1CCC1 ZINC000662275058 409585202 /nfs/dbraw/zinc/58/52/02/409585202.db2.gz QOTMYEVXRKBPDE-LSDHHAIUSA-N 2 0 236.403 2.498 20 0 BEADRP CC[C@H](CC(F)F)C[N@@H+]1CC[C@@H]([NH3+])C[C@@H]1C ZINC000662282906 409607566 /nfs/dbraw/zinc/60/75/66/409607566.db2.gz DGAUQYCKLCWKPF-HBNTYKKESA-N 2 0 234.334 2.479 20 0 BEADRP C[C@@H]1C[C@@H]([NH3+])CC[N@@H+]1CCCC1CCC1 ZINC000662284758 409615306 /nfs/dbraw/zinc/61/53/06/409615306.db2.gz PGFADEHBDLHCQR-YPMHNXCESA-N 2 0 210.365 2.378 20 0 BEADRP C[N@H+](Cc1cccs1)[C@H]1CCC[NH2+]CC1 ZINC000082666685 409849584 /nfs/dbraw/zinc/84/95/84/409849584.db2.gz JZZJJDDLCCAHSZ-NSHDSACASA-N 2 0 224.373 2.322 20 0 BEADRP C[C@H](C[NH2+][C@H](C)CC1CCC1)C[NH+](C)C ZINC000308911329 409937473 /nfs/dbraw/zinc/93/74/73/409937473.db2.gz MQQRUIKDLVGXBK-VXGBXAGGSA-N 2 0 212.381 2.352 20 0 BEADRP CCC[N@H+](C[C@@H]1CCCCO1)C1CC[NH2+]CC1 ZINC000037539186 410201860 /nfs/dbraw/zinc/20/18/60/410201860.db2.gz BUURVQQERXDXKB-AWEZNQCLSA-N 2 0 240.391 2.020 20 0 BEADRP C[C@@H](C[NH2+]CC12CC(C1)C[NH2+]2)Cc1ccccc1 ZINC000663498671 410275740 /nfs/dbraw/zinc/27/57/40/410275740.db2.gz SOIVVRZAOGNNGU-IUDNXUCKSA-N 2 0 244.382 2.207 20 0 BEADRP CC(C)CC[C@H](C)[NH2+]CC12CC(C1)C[NH2+]2 ZINC000663498982 410275777 /nfs/dbraw/zinc/27/57/77/410275777.db2.gz SSIZDAQYTYEGOY-HIFPTAJRSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+][C@@H]1CCO[C@H](C(C)C)C1 ZINC000663498381 410276383 /nfs/dbraw/zinc/27/63/83/410276383.db2.gz BJLOIJJDMLCQQE-MCIONIFRSA-N 2 0 242.407 2.153 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+][C@@H]1CCO[C@@H](C(C)C)C1 ZINC000663498383 410276561 /nfs/dbraw/zinc/27/65/61/410276561.db2.gz BJLOIJJDMLCQQE-MGPQQGTHSA-N 2 0 242.407 2.153 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+][C@@H](C)CC1CCOCC1 ZINC000663503027 410278857 /nfs/dbraw/zinc/27/88/57/410278857.db2.gz MBSNHJKZVXGATB-GXTWGEPZSA-N 2 0 242.407 2.155 20 0 BEADRP C[C@H]1C[N@H+](Cc2cccc3c2CCC3)CC[C@@H]1[NH3+] ZINC000650703246 410335151 /nfs/dbraw/zinc/33/51/51/410335151.db2.gz QYZUBTWLWWUKFV-LRDDRELGSA-N 2 0 244.382 2.344 20 0 BEADRP C[C@@H]([NH3+])[C@@H]1CC[N@H+](Cc2cccc3c2CCC3)C1 ZINC000650703283 410336367 /nfs/dbraw/zinc/33/63/67/410336367.db2.gz SNYHTYYKMFNUCV-TZMCWYRMSA-N 2 0 244.382 2.344 20 0 BEADRP Cc1ccsc1C[NH2+]CCC1(C[NH3+])CC1 ZINC000650712314 410342819 /nfs/dbraw/zinc/34/28/19/410342819.db2.gz ZZIWRXGCWVNFAM-UHFFFAOYSA-N 2 0 224.373 2.275 20 0 BEADRP CC(C)(C)C[NH2+]Cc1ccc(C[NH3+])cc1F ZINC000650718228 410355695 /nfs/dbraw/zinc/35/56/95/410355695.db2.gz DBWVNBFXPADZHK-UHFFFAOYSA-N 2 0 224.323 2.420 20 0 BEADRP CC1CCC([NH2+]CCC2(C[NH3+])CC2)CC1 ZINC000650713448 410345853 /nfs/dbraw/zinc/34/58/53/410345853.db2.gz SWCLOTGWWQIMHP-UHFFFAOYSA-N 2 0 210.365 2.284 20 0 BEADRP CC1(C)CC[C@@H]([NH2+]CCC2(C[NH3+])CC2)C1 ZINC000650714163 410348392 /nfs/dbraw/zinc/34/83/92/410348392.db2.gz UKWKKGVHNFCNRP-LLVKDONJSA-N 2 0 210.365 2.284 20 0 BEADRP CC1(C[NH2+]Cc2ccc(C[NH3+])cc2F)CC1 ZINC000650716787 410350018 /nfs/dbraw/zinc/35/00/18/410350018.db2.gz JVDUOBSXPGEESV-UHFFFAOYSA-N 2 0 222.307 2.174 20 0 BEADRP CC1CC([NH2+]Cc2ccc(C[NH3+])cc2F)C1 ZINC000650717081 410354815 /nfs/dbraw/zinc/35/48/15/410354815.db2.gz RFASCFHWZSBMOW-UHFFFAOYSA-N 2 0 222.307 2.173 20 0 BEADRP C[C@@H]1C[N@H+](CCC[NH3+])CCc2ccc(F)cc21 ZINC000650725135 410361679 /nfs/dbraw/zinc/36/16/79/410361679.db2.gz UFJVQLMOOKFDRX-LLVKDONJSA-N 2 0 236.334 2.136 20 0 BEADRP Cc1ccccc1[C@@H]1C[C@H]1[NH2+][C@H](C)C1C[NH2+]C1 ZINC000650741404 410373109 /nfs/dbraw/zinc/37/31/09/410373109.db2.gz CUKBGVUOELRRAB-BYCMXARLSA-N 2 0 230.355 2.048 20 0 BEADRP CC(C)(C)C[C@@H]1C[C@H]1[NH2+][C@H]1CCC[C@@H]1[NH3+] ZINC000650741958 410374403 /nfs/dbraw/zinc/37/44/03/410374403.db2.gz OOWQYITZTFDBKW-FIQHERPVSA-N 2 0 210.365 2.281 20 0 BEADRP COc1ccc([C@@H](C)[NH2+]CCC2(C[NH3+])CC2)cc1 ZINC000650742624 410378203 /nfs/dbraw/zinc/37/82/03/410378203.db2.gz AIWGEHZXJBLKNQ-GFCCVEGCSA-N 2 0 248.370 2.475 20 0 BEADRP COc1cccc([C@@H](C)[NH2+]CCC2(C[NH3+])CC2)c1 ZINC000650742654 410378598 /nfs/dbraw/zinc/37/85/98/410378598.db2.gz AZOXSSVEVLLQJZ-GFCCVEGCSA-N 2 0 248.370 2.475 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+]CCC1(C[NH3+])CC1 ZINC000650745647 410382381 /nfs/dbraw/zinc/38/23/81/410382381.db2.gz LCTMRAMXGYTLBX-NEPJUHHUSA-N 2 0 210.365 2.284 20 0 BEADRP [NH3+]CC1(CC[NH2+][C@@H]2CCC23CCC3)CC1 ZINC000650746375 410383392 /nfs/dbraw/zinc/38/33/92/410383392.db2.gz ARTWXXIAYVUOPR-LLVKDONJSA-N 2 0 208.349 2.038 20 0 BEADRP [NH3+]CC1(CC[NH2+][C@H](C2CC2)C2CCC2)CC1 ZINC000650748090 410387849 /nfs/dbraw/zinc/38/78/49/410387849.db2.gz MWZZCLUDLZHWHV-ZDUSSCGKSA-N 2 0 222.376 2.284 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(C[NH3+])cc2F)[C@@H]1C ZINC000650755590 410401444 /nfs/dbraw/zinc/40/14/44/410401444.db2.gz IJUDNPHNKKEECP-GPCCPHFNSA-N 2 0 236.334 2.419 20 0 BEADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H]1C[C@@H](C)O[C@H]1C ZINC000650755229 410403029 /nfs/dbraw/zinc/40/30/29/410403029.db2.gz AEWGBRONGJPPCY-TYNCELHUSA-N 2 0 248.370 2.062 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]CCC1CC[NH2+]CC1 ZINC000650761624 410410063 /nfs/dbraw/zinc/41/00/63/410410063.db2.gz FLWCMOUJPQTWBA-OLZOCXBDSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]([NH2+]CCC1CC[NH2+]CC1)c1cscn1 ZINC000650763201 410411823 /nfs/dbraw/zinc/41/18/23/410411823.db2.gz UPIOTDRIYYIWSM-SNVBAGLBSA-N 2 0 239.388 2.183 20 0 BEADRP C[C@@H]([NH2+]CCC1CC[NH2+]CC1)[C@@H]1CC1(C)C ZINC000650762876 410412005 /nfs/dbraw/zinc/41/20/05/410412005.db2.gz MRFIMEGAQMAPPK-YPMHNXCESA-N 2 0 224.392 2.400 20 0 BEADRP CC(C)C1CC([NH2+]CCC2CC[NH2+]CC2)C1 ZINC000650762550 410412042 /nfs/dbraw/zinc/41/20/42/410412042.db2.gz DOKKHMOMLKQIET-UHFFFAOYSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H](Cc1ccoc1)[NH2+]CCC1CC[NH2+]CC1 ZINC000650762278 410412048 /nfs/dbraw/zinc/41/20/48/410412048.db2.gz YWSWUJRFPJKUKN-LBPRGKRZSA-N 2 0 236.359 2.190 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+]CCC1CC[NH2+]CC1 ZINC000650763554 410413884 /nfs/dbraw/zinc/41/38/84/410413884.db2.gz DFYWMQMVOHJZRL-YPMHNXCESA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]([NH2+]CCC1CC[NH2+]CC1)c1ccco1 ZINC000650763853 410414171 /nfs/dbraw/zinc/41/41/71/410414171.db2.gz KSACJQGXJQBLLC-LLVKDONJSA-N 2 0 222.332 2.320 20 0 BEADRP CCC(CC)C[N@H+](CC)C[C@H]1CC[NH2+]C1 ZINC000051889642 410570633 /nfs/dbraw/zinc/57/06/33/410570633.db2.gz CSCAROODDCDRNL-ZDUSSCGKSA-N 2 0 212.381 2.354 20 0 BEADRP CO[C@H](C[N@@H+]1CC[C@@](C)(C[NH3+])C1)c1ccccc1 ZINC000393283933 410674590 /nfs/dbraw/zinc/67/45/90/410674590.db2.gz BRSKJNDFRBRNLL-CABCVRRESA-N 2 0 248.370 2.045 20 0 BEADRP CC[NH+](CC)CC1CC[NH+](C[C@@H](C)OC)CC1 ZINC000336715095 169769471 /nfs/dbraw/zinc/76/94/71/169769471.db2.gz SVJNQRQRIZOZKZ-CYBMUJFWSA-N 2 0 242.407 2.075 20 0 BEADRP CC[C@@H](C)CC[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000665237983 410729804 /nfs/dbraw/zinc/72/98/04/410729804.db2.gz OAROAMBFAHULAA-FKJOKYEKSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@]1(C[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)CC1(F)F ZINC000665266501 410739811 /nfs/dbraw/zinc/73/98/11/410739811.db2.gz CLMNOPYDIPPOHY-WRWGMCAJSA-N 2 0 244.329 2.009 20 0 BEADRP [NH3+]CC1CCC([NH2+]CCCc2ccco2)CC1 ZINC000665283555 410765711 /nfs/dbraw/zinc/76/57/11/410765711.db2.gz PWHXXPFNTNRSTG-UHFFFAOYSA-N 2 0 236.359 2.319 20 0 BEADRP C[NH2+]C[C@@H](C)[NH2+][C@@H](Cc1ccccc1)C1CC1 ZINC000665296782 410813691 /nfs/dbraw/zinc/81/36/91/410813691.db2.gz XRRHQDPXLYQUAI-DOMZBBRYSA-N 2 0 232.371 2.205 20 0 BEADRP CC[C@@H]1C[C@H](C)CC[C@H]1[NH2+][C@@H](C)C[NH2+]C ZINC000665296796 410814688 /nfs/dbraw/zinc/81/46/88/410814688.db2.gz XXEGZCPAEXCSSG-YVECIDJPSA-N 2 0 212.381 2.399 20 0 BEADRP C[NH2+]C[C@H](C)[NH2+][C@@H](C1CC1)C1CCCC1 ZINC000665298573 410830948 /nfs/dbraw/zinc/83/09/48/410830948.db2.gz YKPCYKYMMOPCOY-GXFFZTMASA-N 2 0 210.365 2.153 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H](C)[C@H]1CCCOC1 ZINC000338299321 169775030 /nfs/dbraw/zinc/77/50/30/169775030.db2.gz ZGSLUHUTRDRJIO-KGLIPLIRSA-N 2 0 242.407 2.123 20 0 BEADRP c1ccc(CCCC[NH2+]C2CC[NH2+]CC2)cc1 ZINC000040845525 410893031 /nfs/dbraw/zinc/89/30/31/410893031.db2.gz RWFXLTZFBUNZEK-UHFFFAOYSA-N 2 0 232.371 2.351 20 0 BEADRP CC(C)OCCC[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000127788258 167222979 /nfs/dbraw/zinc/22/29/79/167222979.db2.gz FOPUAUSBUNVECE-ZIAGYGMSSA-N 2 0 240.391 2.018 20 0 BEADRP CC(C)OC[C@@H](C)[NH2+]CCC[NH+]1CCCCC1 ZINC000337344831 167255601 /nfs/dbraw/zinc/25/56/01/167255601.db2.gz ULTLOAQFPMQMCY-CQSZACIVSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[NH2+]CC1)[C@@H]1CC1(C)C ZINC000397752828 410934654 /nfs/dbraw/zinc/93/46/54/410934654.db2.gz CGYKLESZRGZHJH-SRVKXCTJSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H](C[NH2+]C[C@@H]1CCC[NH2+]C1)C(C)(C)C ZINC000162704064 487619828 /nfs/dbraw/zinc/61/98/28/487619828.db2.gz BRXXXKIFMIVWFQ-VXGBXAGGSA-N 2 0 212.381 2.258 20 0 BEADRP CC(C)[C@H]1C[C@H]([NH2+]C2CCC([NH3+])CC2)CCO1 ZINC000070361135 167503734 /nfs/dbraw/zinc/50/37/34/167503734.db2.gz GQNYVJBRMKNFHP-NWINJMCUSA-N 2 0 240.391 2.050 20 0 BEADRP C[C@@H](C[N@H+](C)C1CC[NH2+]CC1)C(C)(C)C ZINC000399423753 411040090 /nfs/dbraw/zinc/04/00/90/411040090.db2.gz CFPJCWZBDXFLRJ-NSHDSACASA-N 2 0 212.381 2.352 20 0 BEADRP CC(C)CC[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000400936402 411163877 /nfs/dbraw/zinc/16/38/77/411163877.db2.gz QWKCWAATIBEFOH-FRRDWIJNSA-N 2 0 210.365 2.010 20 0 BEADRP CC(C)C[N@H+](C)CCC[NH2+]C[C@H]1C[C@@H]1C ZINC000651865870 411148088 /nfs/dbraw/zinc/14/80/88/411148088.db2.gz KQLCMTSALPHJOK-QWHCGFSZSA-N 2 0 212.381 2.210 20 0 BEADRP [NH3+]CCC[N@@H+]1CCC[C@@H]1CC1CCCC1 ZINC000655948835 411161067 /nfs/dbraw/zinc/16/10/67/411161067.db2.gz FRDLYCVHWGLLMY-CYBMUJFWSA-N 2 0 210.365 2.380 20 0 BEADRP C[C@H](c1ccncc1)[NH+]1CCC([C@H](C)[NH3+])CC1 ZINC000110643848 411113068 /nfs/dbraw/zinc/11/30/68/411113068.db2.gz OOFAFFHNQDKINQ-NWDGAFQWSA-N 2 0 233.359 2.202 20 0 BEADRP CC[C@]1(C)CCC[C@@H]1[NH2+]CCOCC[NH+](C)C ZINC000652192598 411168845 /nfs/dbraw/zinc/16/88/45/411168845.db2.gz GDEMGRBUIHOPFH-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP Cc1ccsc1C[NH+]1CCC(C)([NH3+])CC1 ZINC000309553927 411171178 /nfs/dbraw/zinc/17/11/78/411171178.db2.gz LNGHQZVBUFTHBM-UHFFFAOYSA-N 2 0 224.373 2.370 20 0 BEADRP C[N@@H+]1CCC[C@H]2C[NH+](CC3CC=CC3)CC[C@@H]21 ZINC000660009878 411172883 /nfs/dbraw/zinc/17/28/83/411172883.db2.gz CIIKLEYYTBMOOL-GJZGRUSLSA-N 2 0 234.387 2.369 20 0 BEADRP Cc1ccccc1C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000401027310 411173637 /nfs/dbraw/zinc/17/36/37/411173637.db2.gz VEBDDQUJXRXUQP-ARFHVFGLSA-N 2 0 244.382 2.473 20 0 BEADRP CC(F)(F)CC[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000401027208 411173681 /nfs/dbraw/zinc/17/36/81/411173681.db2.gz NZVAWLCIOGCTGE-OUAUKWLOSA-N 2 0 232.318 2.009 20 0 BEADRP Cc1cccc(C[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)c1 ZINC000401032038 411173695 /nfs/dbraw/zinc/17/36/95/411173695.db2.gz XEZUYHWMWVSQFI-HRCADAONSA-N 2 0 244.382 2.473 20 0 BEADRP C([NH2+][C@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)C(C1CC1)C1CC1 ZINC000401020670 411173719 /nfs/dbraw/zinc/17/37/19/411173719.db2.gz KQOXETPTBOKVQR-ILXRZTDVSA-N 2 0 248.414 2.400 20 0 BEADRP C([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)C1(C2CC2)CC1 ZINC000401056596 411174929 /nfs/dbraw/zinc/17/49/29/411174929.db2.gz CNLCVXNWSSEDDS-YRGRVCCFSA-N 2 0 234.387 2.154 20 0 BEADRP c1cc(C[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)cs1 ZINC000401082194 411176250 /nfs/dbraw/zinc/17/62/50/411176250.db2.gz SEPBEUKJVCOPMO-YNEHKIRRSA-N 2 0 236.384 2.226 20 0 BEADRP C1=CC[C@H](C[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)CC1 ZINC000401124610 411178231 /nfs/dbraw/zinc/17/82/31/411178231.db2.gz KYPRISRERXNETL-BYNSBNAKSA-N 2 0 234.387 2.320 20 0 BEADRP C[C@@H](C[NH2+][C@@H]1CCCSCC1)C[NH+](C)C ZINC000658018449 411198926 /nfs/dbraw/zinc/19/89/26/411198926.db2.gz QSYPHZIEBYZAJB-NWDGAFQWSA-N 2 0 230.421 2.059 20 0 BEADRP COC[C@H](CC(C)(C)C)[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000656193731 411199316 /nfs/dbraw/zinc/19/93/16/411199316.db2.gz QSLCSFGWEBBFLN-OLZOCXBDSA-N 2 0 242.407 2.169 20 0 BEADRP Cc1cccc(CCC[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)n1 ZINC000656199180 411201763 /nfs/dbraw/zinc/20/17/63/411201763.db2.gz VIVVZQHGILHZEK-UKRRQHHQSA-N 2 0 247.386 2.182 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]CCCOC2CCCC2)C1 ZINC000656197213 411203130 /nfs/dbraw/zinc/20/31/30/411203130.db2.gz PMICIMVXDRFVPL-CHWSQXEVSA-N 2 0 240.391 2.195 20 0 BEADRP COCC1(C[NH2+][C@H]2C[C@H]([NH3+])c3ccccc32)CC1 ZINC000656200074 411203824 /nfs/dbraw/zinc/20/38/24/411203824.db2.gz JBZKLPZLYZTKLP-KBPBESRZSA-N 2 0 246.354 2.147 20 0 BEADRP Cc1cnc(CC[NH2+][C@@H]2CCC[C@H]([NH3+])C2)c(C)c1 ZINC000656200338 411203909 /nfs/dbraw/zinc/20/39/09/411203909.db2.gz LWEFXWQHSMUTQS-UONOGXRCSA-N 2 0 247.386 2.100 20 0 BEADRP COc1c(C)cccc1CN[C@@H](C)[C@@H]1CC[NH2+]C1 ZINC000656201311 411206456 /nfs/dbraw/zinc/20/64/56/411206456.db2.gz VGRQSIDQNNCPRC-QWHCGFSZSA-N 2 0 248.370 2.091 20 0 BEADRP COc1c(C)cccc1CN[C@H](C)[C@H]1CC[NH2+]C1 ZINC000656201310 411206498 /nfs/dbraw/zinc/20/64/98/411206498.db2.gz VGRQSIDQNNCPRC-OLZOCXBDSA-N 2 0 248.370 2.091 20 0 BEADRP CCC[C@H](C)[C@H]1CCC[N@@H+]1C[C@@H]1CC[NH2+]C1 ZINC000652343557 411208012 /nfs/dbraw/zinc/20/80/12/411208012.db2.gz WIOQRHMZQYYXJM-BFHYXJOUSA-N 2 0 224.392 2.497 20 0 BEADRP CCC[C@H](C)[C@@H]1CCC[N@@H+]1C[C@@H]1CC[NH2+]C1 ZINC000652343560 411208144 /nfs/dbraw/zinc/20/81/44/411208144.db2.gz WIOQRHMZQYYXJM-MJBXVCDLSA-N 2 0 224.392 2.497 20 0 BEADRP CCCCC[C@@H]1CCC[N@@H+]1CCOCC[NH3+] ZINC000652343687 411208295 /nfs/dbraw/zinc/20/82/95/411208295.db2.gz FTOWCFXDOQZRGQ-CYBMUJFWSA-N 2 0 228.380 2.006 20 0 BEADRP Cc1cccc(C[NH+]2CCC(C)([NH3+])CC2)c1 ZINC000049816971 411245912 /nfs/dbraw/zinc/24/59/12/411245912.db2.gz LJTPNVZFAYIHOO-UHFFFAOYSA-N 2 0 218.344 2.308 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H]2CCCC23CC3)C1 ZINC000658047261 411218176 /nfs/dbraw/zinc/21/81/76/411218176.db2.gz PUJULAUQLNODEH-FRRDWIJNSA-N 2 0 222.376 2.249 20 0 BEADRP CCCC[N@@H+]1CCCC[C@@H]1[C@H]1C[C@H]([NH3+])CCO1 ZINC000652360348 411218753 /nfs/dbraw/zinc/21/87/53/411218753.db2.gz FXFKFCJNKNJLMK-MGPQQGTHSA-N 2 0 240.391 2.147 20 0 BEADRP CC1(C)[C@H]([NH2+]CC2C[NH2+]C2)C[C@@H]1c1ccccc1 ZINC000423306712 411238148 /nfs/dbraw/zinc/23/81/48/411238148.db2.gz UGPXSHLPFQSSGY-HUUCEWRRSA-N 2 0 244.382 2.378 20 0 BEADRP CCCCC[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000400907621 411165501 /nfs/dbraw/zinc/16/55/01/411165501.db2.gz CFGKZSGEZMFKOU-RWMBFGLXSA-N 2 0 210.365 2.154 20 0 BEADRP CCCCC[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000400907620 411165619 /nfs/dbraw/zinc/16/56/19/411165619.db2.gz CFGKZSGEZMFKOU-JHJVBQTASA-N 2 0 210.365 2.154 20 0 BEADRP CC(C)CCC[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000400967890 411166660 /nfs/dbraw/zinc/16/66/60/411166660.db2.gz NYAFPSZNXWHXLQ-MGPQQGTHSA-N 2 0 224.392 2.400 20 0 BEADRP CC(C)[C@H](C)C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000400966510 411166793 /nfs/dbraw/zinc/16/67/93/411166793.db2.gz NJEBQCMTZAOHCV-AAVRWANBSA-N 2 0 224.392 2.256 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)cc1 ZINC000400960631 411167223 /nfs/dbraw/zinc/16/72/23/411167223.db2.gz BMVQQTDJGRJFPO-BZUAXINKSA-N 2 0 244.382 2.473 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CC2CC[NH+](C)CC2)CS1 ZINC000655716963 411273318 /nfs/dbraw/zinc/27/33/18/411273318.db2.gz QWUYCMVICAQYMI-DGCLKSJQSA-N 2 0 242.432 2.202 20 0 BEADRP Cc1ccc(C[N@H+](C)C[C@@H]2CC[NH2+]C2)cc1 ZINC000051889912 411284791 /nfs/dbraw/zinc/28/47/91/411284791.db2.gz ABGGVDFTHNHVJK-CQSZACIVSA-N 2 0 218.344 2.036 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[N@H+](C)C[C@@H]1CC[NH2+]C1 ZINC000051889821 411285977 /nfs/dbraw/zinc/28/59/77/411285977.db2.gz KBOIENMSRJEDCI-UPJWGTAASA-N 2 0 210.365 2.106 20 0 BEADRP CCC[NH+]1CCC([NH2+]C[C@@]2(C)CC2(F)F)CC1 ZINC000658217898 411297681 /nfs/dbraw/zinc/29/76/81/411297681.db2.gz GEIAVCIFNCQDKL-GFCCVEGCSA-N 2 0 246.345 2.496 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C[C@]2(C)CC2(F)F)CC[N@@H+]1C ZINC000658218639 411298941 /nfs/dbraw/zinc/29/89/41/411298941.db2.gz KJLQNQYKDFGRCZ-VWYCJHECSA-N 2 0 232.318 2.104 20 0 BEADRP C[C@@H]1CCC[C@H](C[NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)O1 ZINC000658220348 411299517 /nfs/dbraw/zinc/29/95/17/411299517.db2.gz PTSPCOZABSFFQI-AAVRWANBSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@@H](c1cccnc1)[N@@H+]1C[C@@H]2CCC[C@]2(C[NH3+])C1 ZINC000402901438 411320972 /nfs/dbraw/zinc/32/09/72/411320972.db2.gz VGYZTJOXFSAWTN-QEJZJMRPSA-N 2 0 245.370 2.203 20 0 BEADRP CC[C@@H](C)C[N@@H+]1C[C@@H]2CCC[C@]2(C[NH3+])C1 ZINC000402980124 411324545 /nfs/dbraw/zinc/32/45/45/411324545.db2.gz HPHLQISGXQDDMM-AGIUHOORSA-N 2 0 210.365 2.093 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CC2=CCCC2)[C@H](C)C1 ZINC000658292657 411325797 /nfs/dbraw/zinc/32/57/97/411325797.db2.gz FSUIYMCXJKBWPT-OCCSQVGLSA-N 2 0 222.376 2.417 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CCCC[NH+](C)C)CS1 ZINC000655703019 411253222 /nfs/dbraw/zinc/25/32/22/411253222.db2.gz IWNWOEKZWLNYHK-NEPJUHHUSA-N 2 0 230.421 2.202 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCC2CC[NH+](C)CC2)CS1 ZINC000125128947 411349680 /nfs/dbraw/zinc/34/96/80/411349680.db2.gz SWPDCWRXWNGRKM-YPMHNXCESA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H]1C[C@H]1C[N@@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000656783362 411359389 /nfs/dbraw/zinc/35/93/89/411359389.db2.gz PWTFOTXWQBWWOT-YUELXQCFSA-N 2 0 236.403 2.354 20 0 BEADRP FC1(C[N@@H+]2CCC[C@@H](C3CC[NH2+]CC3)C2)CC1 ZINC000656782548 411359402 /nfs/dbraw/zinc/35/94/02/411359402.db2.gz HKGKKZPZPDNPCO-CYBMUJFWSA-N 2 0 240.366 2.200 20 0 BEADRP CC1(C[N@@H+]2CCC[C@H](C3CC[NH2+]CC3)C2)CC1 ZINC000656782403 411360077 /nfs/dbraw/zinc/36/00/77/411360077.db2.gz FZHUTDSIIJMWAW-AWEZNQCLSA-N 2 0 236.403 2.498 20 0 BEADRP CC(C)C[C@@H](C)C[N@H+](C)CC(C)(C)N ZINC000656785359 411360419 /nfs/dbraw/zinc/36/04/19/411360419.db2.gz NSVDOBWRBLHPFA-LLVKDONJSA-N 2 0 200.370 2.338 20 0 BEADRP C[C@H]1CCC[C@@H]([NH2+]CC2([NH3+])CCCC2)C1 ZINC000656789310 411368520 /nfs/dbraw/zinc/36/85/20/411368520.db2.gz MIPDNXYRKRVJRI-NWDGAFQWSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@@H]1CCCC[C@H]1[NH2+]CC1([NH3+])CCCC1 ZINC000656789588 411369186 /nfs/dbraw/zinc/36/91/86/411369186.db2.gz RQDULMDZWLSFPT-VXGBXAGGSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@@H]1C[C@@H](C[N@@H+]2CCC[C@@H](CCF)C2)CC[NH2+]1 ZINC000656790834 411370379 /nfs/dbraw/zinc/37/03/79/411370379.db2.gz BITBVESPENEHOB-RDBSUJKOSA-N 2 0 242.382 2.446 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CCCc2ccco2)CC[N@@H+]1C ZINC000658327781 411335751 /nfs/dbraw/zinc/33/57/51/411335751.db2.gz RKCPLCCSXOPDOO-QWHCGFSZSA-N 2 0 236.359 2.285 20 0 BEADRP C1[C@H]2CC[C@@H]([NH2+][C@@H]3CC[C@@H]4C[NH2+]C[C@@H]4C3)C[C@@H]12 ZINC000403376976 411343481 /nfs/dbraw/zinc/34/34/81/411343481.db2.gz DRPGBSKQMAYFSO-PLJUSGQGSA-N 2 0 234.387 2.153 20 0 BEADRP CC1([NH2+]CC2CC[NH2+]CC2)CCCCC1 ZINC000045047221 168063121 /nfs/dbraw/zinc/06/31/21/168063121.db2.gz VZQVILJUSRHYSK-UHFFFAOYSA-N 2 0 210.365 2.298 20 0 BEADRP CC1CCC(C[N@@H+]2CC[C@H]([NH3+])[C@H](C)C2)CC1 ZINC000063145739 168153472 /nfs/dbraw/zinc/15/34/72/168153472.db2.gz MKTSOJLVKAKZHW-HHTDUIENSA-N 2 0 224.392 2.482 20 0 BEADRP CC1CCC(C[NH+]2CCC([NH3+])CC2)CC1 ZINC000063145710 168153979 /nfs/dbraw/zinc/15/39/79/168153979.db2.gz FIOGPFKVASGFMG-UHFFFAOYSA-N 2 0 210.365 2.236 20 0 BEADRP CC1CCC([NH2+]CC2CC[NH+](C)CC2)CC1 ZINC000044515320 168162319 /nfs/dbraw/zinc/16/23/19/168162319.db2.gz SKGGQJGTSMSWMM-UHFFFAOYSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[C@H]1C[NH2+]CCC[NH+]1CCC(C)CC1 ZINC000336777965 168178865 /nfs/dbraw/zinc/17/88/65/168178865.db2.gz JZVDVVXEVOOXNL-KGLIPLIRSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@H]1C[C@@H]1C[NH2+]CCC[NH+]1CCC(C)CC1 ZINC000336777966 168179848 /nfs/dbraw/zinc/17/98/48/168179848.db2.gz JZVDVVXEVOOXNL-UONOGXRCSA-N 2 0 224.392 2.354 20 0 BEADRP CC1CC[NH+](CCC[NH2+][C@@H]2CCSC2)CC1 ZINC000020146236 168179929 /nfs/dbraw/zinc/17/99/29/168179929.db2.gz MWLVSNJYNNDQRZ-CYBMUJFWSA-N 2 0 242.432 2.204 20 0 BEADRP C[C@H]1CCC[N@H+](Cc2cncs2)[C@@H]1CC[NH3+] ZINC000404277093 411387870 /nfs/dbraw/zinc/38/78/70/411387870.db2.gz BEPXJVMDIFBRJT-CMPLNLGQSA-N 2 0 239.388 2.092 20 0 BEADRP CC[C@H]1C[C@H]([NH2+]CC(C)(C)C[NH+](C)C)CCO1 ZINC000070343395 411389598 /nfs/dbraw/zinc/38/95/98/411389598.db2.gz KLCHLWWGZSBVCS-OLZOCXBDSA-N 2 0 242.407 2.121 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCC[C@H](C)[C@H]1CC[NH3+] ZINC000404324970 411391014 /nfs/dbraw/zinc/39/10/14/411391014.db2.gz UFVNWHBLXICAMD-RWMBFGLXSA-N 2 0 212.381 2.482 20 0 BEADRP C[C@@H]1CCC[N@H+](Cc2cccnc2)[C@H]1CC[NH3+] ZINC000404379087 411392402 /nfs/dbraw/zinc/39/24/02/411392402.db2.gz LOKHHMAWBSLIDR-OCCSQVGLSA-N 2 0 233.359 2.031 20 0 BEADRP [NH3+]CC1(CC[NH2+]C2CCCCCC2)CC1 ZINC000404532152 411400392 /nfs/dbraw/zinc/40/03/92/411400392.db2.gz AAIIFIFOMLZSBN-UHFFFAOYSA-N 2 0 210.365 2.428 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+][C@@H]1CC[C@H]2C[C@H]2C1 ZINC000647803927 411407579 /nfs/dbraw/zinc/40/75/79/411407579.db2.gz DQQZVFMQEZFQSJ-QNSTZXKLSA-N 2 0 222.376 2.425 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCc2ccccc2[C@H](C)C1 ZINC000405004776 411413473 /nfs/dbraw/zinc/41/34/73/411413473.db2.gz JADAFVCSOCOAHA-CYBMUJFWSA-N 2 0 232.371 2.258 20 0 BEADRP CC[C@@H]1C[N@@H+]([C@@H](C)c2ccccn2)CC[C@@H]1[NH3+] ZINC000122269373 411427196 /nfs/dbraw/zinc/42/71/96/411427196.db2.gz VMGMNDIWKUHLMT-XQQFMLRXSA-N 2 0 233.359 2.202 20 0 BEADRP CC[C@@H](C)[NH2+]Cc1ccnn1-c1cc[nH+]cc1 ZINC000657286923 411446185 /nfs/dbraw/zinc/44/61/85/411446185.db2.gz FKEILRWLQYLVQP-LLVKDONJSA-N 2 0 230.315 2.155 20 0 BEADRP C[NH+](C)CC1CC[NH+](CC2CC=CC2)CC1 ZINC000659845974 411474339 /nfs/dbraw/zinc/47/43/39/411474339.db2.gz YERGUIHXZVLFJG-UHFFFAOYSA-N 2 0 222.376 2.226 20 0 BEADRP C[NH+](C)[C@H]1CCC[N@H+](C[C@@H]2C[C@H]3C[C@H]3C2)CC1 ZINC000660415641 411488757 /nfs/dbraw/zinc/48/87/57/411488757.db2.gz GTZHHYLCXBLCCI-XGUBFFRZSA-N 2 0 236.403 2.449 20 0 BEADRP Cc1ccc(NC2CC[NH2+]CC2)c(C[NH+](C)C)c1 ZINC000415117469 411492423 /nfs/dbraw/zinc/49/24/23/411492423.db2.gz IRAGXPVSVGCZQG-UHFFFAOYSA-N 2 0 247.386 2.221 20 0 BEADRP CC[NH+]1CCC(CC[NH2+]C[C@H]2C[C@@H]2C)CC1 ZINC000309957763 169950854 /nfs/dbraw/zinc/95/08/54/169950854.db2.gz JIWYGLFVBBGCCR-GXTWGEPZSA-N 2 0 224.392 2.354 20 0 BEADRP c1nc2n(c1C[NH2+]CC13CCC(CC1)C3)CCC2 ZINC000657418825 411501821 /nfs/dbraw/zinc/50/18/21/411501821.db2.gz LYUJYWPLANFANM-UHFFFAOYSA-N 2 0 245.370 2.499 20 0 BEADRP CC1(C)C[C@@H]([N@@H+]2CCC[C@H](c3ncc[nH]3)C2)CO1 ZINC000660077858 411534670 /nfs/dbraw/zinc/53/46/70/411534670.db2.gz QOWOZFALETTWOD-NWDGAFQWSA-N 2 0 249.358 2.157 20 0 BEADRP C[NH+](C)C1CC([NH2+]C2CCC(F)(F)CC2)C1 ZINC000655793094 411516272 /nfs/dbraw/zinc/51/62/72/411516272.db2.gz UTGRYQADCWPPCW-UHFFFAOYSA-N 2 0 232.318 2.247 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)[C@@H]1CC1(C)C ZINC000655803939 411519338 /nfs/dbraw/zinc/51/93/38/411519338.db2.gz IWWIINXNMQPXGK-NDBYEHHHSA-N 2 0 224.392 2.351 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H]2CC[C@@H]2C2CCC2)C1 ZINC000655804429 411519395 /nfs/dbraw/zinc/51/93/95/411519395.db2.gz YNUXHNCBTRZEDL-BEAPCOKYSA-N 2 0 236.403 2.495 20 0 BEADRP CC(C)[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)C1CC1 ZINC000655804908 411519597 /nfs/dbraw/zinc/51/95/97/411519597.db2.gz FWIOYQNXBGMHCL-KWCYVHTRSA-N 2 0 224.392 2.351 20 0 BEADRP C[C@@H]1CC[C@H]1[NH2+]Cc1ccnn1-c1cc[nH+]cc1 ZINC000657466222 411519583 /nfs/dbraw/zinc/51/95/83/411519583.db2.gz QWOJIRFPIZWXSX-BXUZGUMPSA-N 2 0 242.326 2.155 20 0 BEADRP C[C@H]1CC[C@H]1[NH2+]Cc1ccnn1-c1cc[nH+]cc1 ZINC000657466225 411519700 /nfs/dbraw/zinc/51/97/00/411519700.db2.gz QWOJIRFPIZWXSX-SMDDNHRTSA-N 2 0 242.326 2.155 20 0 BEADRP CCCC[C@@H](COC)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655805713 411520185 /nfs/dbraw/zinc/52/01/85/411520185.db2.gz KKTSKQTWOOOFPB-MELADBBJSA-N 2 0 242.407 2.121 20 0 BEADRP CCCC[C@H](COC)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655805711 411520410 /nfs/dbraw/zinc/52/04/10/411520410.db2.gz KKTSKQTWOOOFPB-MCIONIFRSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1ccco1 ZINC000655806904 411520497 /nfs/dbraw/zinc/52/04/97/411520497.db2.gz DIUILBUVPCFWHZ-SDDRHHMPSA-N 2 0 222.332 2.270 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655807911 411521273 /nfs/dbraw/zinc/52/12/73/411521273.db2.gz WAXSJMCHRLSVQL-ZDEQEGDKSA-N 2 0 212.381 2.351 20 0 BEADRP Cc1cc(C[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)cs1 ZINC000655824536 411526625 /nfs/dbraw/zinc/52/66/25/411526625.db2.gz LIIFYBRDGQVFCU-BJHJDKERSA-N 2 0 238.400 2.486 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]CC2(C)CCC2)C1 ZINC000655824103 411526643 /nfs/dbraw/zinc/52/66/43/411526643.db2.gz DYGOAPOCJJJJPR-TXEJJXNPSA-N 2 0 210.365 2.106 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]Cc2ccc(Cl)o2)C1 ZINC000655825649 411527305 /nfs/dbraw/zinc/52/73/05/411527305.db2.gz LLSSHZPRHNTSHM-AOOOYVTPSA-N 2 0 242.750 2.363 20 0 BEADRP C[N@@H+]1CCC[C@@H]2C[NH+](CC3CC=CC3)CC[C@@H]21 ZINC000660009877 411527493 /nfs/dbraw/zinc/52/74/93/411527493.db2.gz CIIKLEYYTBMOOL-CABCVRRESA-N 2 0 234.387 2.369 20 0 BEADRP CC/C=C\C[NH2+]Cc1ccnn1-c1cc[nH+]cc1 ZINC000657480187 411528209 /nfs/dbraw/zinc/52/82/09/411528209.db2.gz SQABNAFQCRGZDL-ARJAWSKDSA-N 2 0 242.326 2.323 20 0 BEADRP Cc1ccc(C[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)s1 ZINC000655826669 411529933 /nfs/dbraw/zinc/52/99/33/411529933.db2.gz XGVKRJQTUWETCV-TXEJJXNPSA-N 2 0 238.400 2.486 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H]2CCC23CCC3)C1 ZINC000309953722 170009357 /nfs/dbraw/zinc/00/93/57/170009357.db2.gz HIKPEQRBDDCSHZ-QWHCGFSZSA-N 2 0 222.376 2.251 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CCSC(C)C)[C@@H](C)C1 ZINC000336780277 170010964 /nfs/dbraw/zinc/01/09/64/170010964.db2.gz QTCMVVZOZIOSDP-QWHCGFSZSA-N 2 0 244.448 2.448 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CCCCCOC)[C@H](C)C1 ZINC000122666001 170011178 /nfs/dbraw/zinc/01/11/78/170011178.db2.gz HQKOAIOWVOXRMZ-ZIAGYGMSSA-N 2 0 242.407 2.123 20 0 BEADRP CC[N@@H+]1CC[C@@H](NCc2cccc(O)c2)[C@H](C)C1 ZINC000173363017 170011488 /nfs/dbraw/zinc/01/14/88/170011488.db2.gz ZRMUKUDKAOYBNI-IUODEOHRSA-N 2 0 248.370 2.212 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+]Cc2ccccc2C)C1 ZINC000037643769 170016306 /nfs/dbraw/zinc/01/63/06/170016306.db2.gz LLTJYSAZRBTBAZ-CQSZACIVSA-N 2 0 232.371 2.426 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2cnccc2C)C1 ZINC000271375133 170016508 /nfs/dbraw/zinc/01/65/08/170016508.db2.gz HKLJGFMTGFBFFR-UONOGXRCSA-N 2 0 247.386 2.382 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH+](C)CCC2CC2)[C@H](C)C1 ZINC000336671498 170018483 /nfs/dbraw/zinc/01/84/83/170018483.db2.gz YULJXPKRASGVSH-OCCSQVGLSA-N 2 0 224.392 2.449 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH+](C)CC(C)C)C[C@H]1C ZINC000336643810 170018570 /nfs/dbraw/zinc/01/85/70/170018570.db2.gz DSODZKHMPBFUQF-OLZOCXBDSA-N 2 0 212.381 2.447 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CCSC(C)C)[C@H](C)C1 ZINC000336780276 170021328 /nfs/dbraw/zinc/02/13/28/170021328.db2.gz QTCMVVZOZIOSDP-OLZOCXBDSA-N 2 0 244.448 2.448 20 0 BEADRP CC[N@H+]1C[C@@H]2C[NH+](Cc3ccccc3)C[C@@H]2C1 ZINC000280490910 170040948 /nfs/dbraw/zinc/04/09/48/170040948.db2.gz QEWCPQVDZXGIBS-GASCZTMLSA-N 2 0 230.355 2.070 20 0 BEADRP CC[N@@H+]1C[C@H]2CC[NH+](Cc3ccccc3)C[C@@H]2C1 ZINC000307624118 170041086 /nfs/dbraw/zinc/04/10/86/170041086.db2.gz FJTSJNSPVZSZPB-CVEARBPZSA-N 2 0 244.382 2.460 20 0 BEADRP CCOCC(C)(C)C[NH2+]C1CC[NH+](CC)CC1 ZINC000336672819 170351068 /nfs/dbraw/zinc/35/10/68/170351068.db2.gz BOPUWPOJJYYUCG-UHFFFAOYSA-N 2 0 242.407 2.123 20 0 BEADRP Cc1c[nH+]ccc1NC[C@@H](C(C)C)[NH+]1CCCC1 ZINC000663378914 411642515 /nfs/dbraw/zinc/64/25/15/411642515.db2.gz JSCYXTNCYOKTGI-HNNXBMFYSA-N 2 0 247.386 2.344 20 0 BEADRP C[C@]1(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)CC1(F)F ZINC000657663454 411576566 /nfs/dbraw/zinc/57/65/66/411576566.db2.gz BOOHCBWMERGZBC-IJLUTSLNSA-N 2 0 244.329 2.248 20 0 BEADRP C[C@H]1CN(C)C[C@@H]1[NH2+][C@@H]1CC[C@@H]1c1ccccc1 ZINC000657713615 411586461 /nfs/dbraw/zinc/58/64/61/411586461.db2.gz IHOQKOMUBNUDJO-XZDPQHSOSA-N 2 0 244.382 2.472 20 0 BEADRP CC1(C)C[C@]1(C)[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000657761395 411591487 /nfs/dbraw/zinc/59/14/87/411591487.db2.gz KAOBNEKQXWUZLL-DYEKYZERSA-N 2 0 222.376 2.391 20 0 BEADRP c1coc(CCC[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)c1 ZINC000657781640 411597643 /nfs/dbraw/zinc/59/76/43/411597643.db2.gz FOAJYVQJXKACJN-KGLIPLIRSA-N 2 0 248.370 2.429 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H]2CCCSCC2)C1 ZINC000657843495 411610386 /nfs/dbraw/zinc/61/03/86/411610386.db2.gz ZDNNABBLQLFZOC-QWHCGFSZSA-N 2 0 242.432 2.204 20 0 BEADRP C[N@@H+]1CCC[C@]2(CC[NH+](CC3CC=CC3)C2)C1 ZINC000660639332 411610966 /nfs/dbraw/zinc/61/09/66/411610966.db2.gz FGDYSOVFGGKTCC-HNNXBMFYSA-N 2 0 234.387 2.370 20 0 BEADRP C[N@@H+]1CCC[C@]2(CC[NH+](C[C@@H]3C[C@H]4C[C@H]4C3)C2)C1 ZINC000660641816 411611153 /nfs/dbraw/zinc/61/11/53/411611153.db2.gz KCJUWGWFDFABCX-FZKCQIBNSA-N 2 0 248.414 2.450 20 0 BEADRP Cc1nccn1CC[NH2+][C@@H]1CCCSCC1 ZINC000657863435 411613571 /nfs/dbraw/zinc/61/35/71/411613571.db2.gz ITRMKPJYGXPFND-GFCCVEGCSA-N 2 0 239.388 2.067 20 0 BEADRP C[N@@H+]1CC[C@@]2(C1)CCC[NH+](C[C@@H]1C[C@H]3C[C@H]3C1)C2 ZINC000660662776 411615756 /nfs/dbraw/zinc/61/57/56/411615756.db2.gz WHQNFDJNNGVJGK-QKPAOTATSA-N 2 0 248.414 2.450 20 0 BEADRP Cc1cccc([C@@H](C)[N@H+](C)CCC[NH3+])c1 ZINC000133229180 411659665 /nfs/dbraw/zinc/65/96/65/411659665.db2.gz HVCXCHZUDZNISP-GFCCVEGCSA-N 2 0 206.333 2.337 20 0 BEADRP CC[C@H](Cc1ccccc1)[NH2+]CC12CC(C1)C[NH2+]2 ZINC000663497533 411679145 /nfs/dbraw/zinc/67/91/45/411679145.db2.gz GYOFFOUOLLGJNO-HWOWSKLDSA-N 2 0 244.382 2.349 20 0 BEADRP C[NH2+]C[C@H](C)[NH2+][C@H]1CCC[C@H](C2CC2)C1 ZINC000663509285 411691367 /nfs/dbraw/zinc/69/13/67/411691367.db2.gz IQJWPNRHMBRXDP-DRZSPHRISA-N 2 0 210.365 2.153 20 0 BEADRP C[NH2+]C[C@H](C)[NH2+]CC1CCC(C)(C)CC1 ZINC000663509446 411691747 /nfs/dbraw/zinc/69/17/47/411691747.db2.gz KTQXVWTXKMFVNE-NSHDSACASA-N 2 0 212.381 2.400 20 0 BEADRP C[NH2+]C[C@H](C)[NH2+][C@H]1CCCC[C@@H]1C1CC1 ZINC000663510730 411693603 /nfs/dbraw/zinc/69/36/03/411693603.db2.gz RTFRFRVOQGBFHO-UHTWSYAYSA-N 2 0 210.365 2.153 20 0 BEADRP CC1(C)C[C@]1([NH2+]CCC[NH3+])c1ccccc1 ZINC000663514980 411697632 /nfs/dbraw/zinc/69/76/32/411697632.db2.gz XMCMHJJPDBEXRS-AWEZNQCLSA-N 2 0 218.344 2.250 20 0 BEADRP CC[N@@H+]1CCN(c2[nH+]ccc3[nH]ccc32)C[C@H]1C ZINC000663743532 411736308 /nfs/dbraw/zinc/73/63/08/411736308.db2.gz BVHGHDBJOSZZDY-LLVKDONJSA-N 2 0 244.342 2.093 20 0 BEADRP CCSCC[C@H](C)[NH2+][C@H](C)CCC[NH3+] ZINC000308636326 170643630 /nfs/dbraw/zinc/64/36/30/170643630.db2.gz AZUKVNGWLGRDRW-MNOVXSKESA-N 2 0 218.410 2.235 20 0 BEADRP C[C@H](CNc1[nH+]ccc2[nH]ccc21)C[NH+](C)C ZINC000663931099 411779712 /nfs/dbraw/zinc/77/97/12/411779712.db2.gz HWMAKBFGQPEQTL-SNVBAGLBSA-N 2 0 232.331 2.173 20 0 BEADRP C[C@@H]1CN(c2[nH+]ccc3[nH]ccc32)C[C@H](C)[N@H+]1C ZINC000663943185 411784642 /nfs/dbraw/zinc/78/46/42/411784642.db2.gz WZLKRRYQQMVJBN-PHIMTYICSA-N 2 0 244.342 2.092 20 0 BEADRP CC[C@@H](C)[C@@H](C)[NH2+]CCCC[NH+](C)C ZINC000045663729 170772546 /nfs/dbraw/zinc/77/25/46/170772546.db2.gz AAYZRUKGPNNXKR-VXGBXAGGSA-N 2 0 200.370 2.352 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](C[C@@H](C)C(C)(C)C)C1 ZINC000221516521 487621123 /nfs/dbraw/zinc/62/11/23/487621123.db2.gz RXFKURYNWJQPFN-NEPJUHHUSA-N 2 0 212.381 2.210 20 0 BEADRP CC[C@@H]([NH2+]CCC1CC[NH+](C)CC1)C1CC1 ZINC000122143094 170893427 /nfs/dbraw/zinc/89/34/27/170893427.db2.gz JQMLDBXWZLPTFJ-CQSZACIVSA-N 2 0 224.392 2.497 20 0 BEADRP C1=CCC(C[N@H+](C2CC2)C2CC[NH2+]CC2)C1 ZINC000662233294 412031579 /nfs/dbraw/zinc/03/15/79/412031579.db2.gz DATOOEIBEKLTLK-UHFFFAOYSA-N 2 0 220.360 2.169 20 0 BEADRP CC[C@@H](CC(F)F)C[NH+]1CCC(C[NH3+])CC1 ZINC000662236214 412034308 /nfs/dbraw/zinc/03/43/08/412034308.db2.gz VTDXBQGVIPHIQG-JTQLQIEISA-N 2 0 234.334 2.339 20 0 BEADRP C[NH2+]C[C@@H]1CCC[N@H+](CCCC2CCC2)C1 ZINC000662237862 412035005 /nfs/dbraw/zinc/03/50/05/412035005.db2.gz KYTDOXPGTDZRDJ-AWEZNQCLSA-N 2 0 224.392 2.498 20 0 BEADRP CC[C@H](CC(F)F)C[N@@H+]1CC[C@@H]([NH3+])[C@@H](C)C1 ZINC000662245507 412041943 /nfs/dbraw/zinc/04/19/43/412041943.db2.gz RTNWMUKWTVGKCO-HBNTYKKESA-N 2 0 234.334 2.337 20 0 BEADRP CC(C)=CCC[NH+]1CCC([C@H](C)[NH3+])CC1 ZINC000662246809 412043040 /nfs/dbraw/zinc/04/30/40/412043040.db2.gz SAFXRZJMQJWFGM-LBPRGKRZSA-N 2 0 210.365 2.402 20 0 BEADRP CC[C@@H](C[NH2+][C@@](C)(CN)C1CC1)CC(F)F ZINC000662247385 412044369 /nfs/dbraw/zinc/04/43/69/412044369.db2.gz GCZDTGSTWVJVHR-SKDRFNHKSA-N 2 0 234.334 2.385 20 0 BEADRP CO[C@@H](C[N@H+](C)CC[C@H]([NH3+])C(C)C)C1CCC1 ZINC000662248032 412046428 /nfs/dbraw/zinc/04/64/28/412046428.db2.gz RFBVAEXMZFUHHX-KBPBESRZSA-N 2 0 242.407 2.107 20 0 BEADRP CC[C@@H]1CCC[C@@H]([NH2+][C@H](CCC[NH3+])COC)C1 ZINC000300026718 170987583 /nfs/dbraw/zinc/98/75/83/170987583.db2.gz ZOFMYXVRKYZOLE-MGPQQGTHSA-N 2 0 242.407 2.299 20 0 BEADRP CC(C)=CCC[N@@H+]1C[C@@H]2CCC[C@H]([NH3+])[C@H]2C1 ZINC000662264109 412056771 /nfs/dbraw/zinc/05/67/71/412056771.db2.gz AYQCGFLQHLDNGK-IHRRRGAJSA-N 2 0 222.376 2.402 20 0 BEADRP CC[C@@H]1CC[N@H+](CCC2CC[NH2+]CC2)C1 ZINC000108324287 171012595 /nfs/dbraw/zinc/01/25/95/171012595.db2.gz STPGQGKHNXUXEP-GFCCVEGCSA-N 2 0 210.365 2.108 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+]CCC[NH+](CC)CC ZINC000336747097 171059632 /nfs/dbraw/zinc/05/96/32/171059632.db2.gz BTAQXWULSKWFFV-CHWSQXEVSA-N 2 0 212.381 2.497 20 0 BEADRP CC[C@@H](CC(F)F)C[NH+]1CCC(C)([NH3+])CC1 ZINC000662271231 412062345 /nfs/dbraw/zinc/06/23/45/412062345.db2.gz UFBAGWUEOLWAIR-JTQLQIEISA-N 2 0 234.334 2.481 20 0 BEADRP CO[C@@H](C[N@@H+]1CCCC[C@@H]1CC[NH3+])C1CCC1 ZINC000662272586 412062720 /nfs/dbraw/zinc/06/27/20/412062720.db2.gz GVECBOWEVMPQIZ-KGLIPLIRSA-N 2 0 240.391 2.005 20 0 BEADRP CC[C@H](CC(F)F)C[NH+]1CCC(C)([NH3+])CC1 ZINC000662271232 412063459 /nfs/dbraw/zinc/06/34/59/412063459.db2.gz UFBAGWUEOLWAIR-SNVBAGLBSA-N 2 0 234.334 2.481 20 0 BEADRP C1=CCC(C[N@@H+]2CCC[C@@H]([C@@H]3CC[NH2+]C3)C2)C1 ZINC000662275283 412067403 /nfs/dbraw/zinc/06/74/03/412067403.db2.gz YVTBUCACEUDQEM-HUUCEWRRSA-N 2 0 234.387 2.274 20 0 BEADRP C[C@@H]1C[C@@H](C)[N@H+](CC2CC=CC2)C[C@H]1C[NH3+] ZINC000662281972 412072690 /nfs/dbraw/zinc/07/26/90/412072690.db2.gz AHOSPJDAPAEIIT-YRGRVCCFSA-N 2 0 222.376 2.258 20 0 BEADRP [NH3+]C[C@]12CCC[C@H]1C[N@H+](C[C@@H]1C[C@H]3C[C@H]3C1)C2 ZINC000662283639 412076169 /nfs/dbraw/zinc/07/61/69/412076169.db2.gz CENWYDDRBXYXAI-AICCOOGYSA-N 2 0 234.387 2.093 20 0 BEADRP CC[C@H](C)C[NH+]1CCC(C[NH+](C)C)CC1 ZINC000336643944 171279203 /nfs/dbraw/zinc/27/92/03/171279203.db2.gz FCNKTUAUUIOCHL-LBPRGKRZSA-N 2 0 212.381 2.306 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCC[C@H]2C[NH+](C)CC[C@@H]21 ZINC000336686533 171281118 /nfs/dbraw/zinc/28/11/18/171281118.db2.gz WNVIOSPCKKQOTF-IHRRRGAJSA-N 2 0 224.392 2.449 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC000335620316 171281353 /nfs/dbraw/zinc/28/13/53/171281353.db2.gz XHUTXWDLBGKIBQ-STQMWFEESA-N 2 0 210.365 2.108 20 0 BEADRP C[N@H+](CCCCC1CCOCC1)CC(C)(C)[NH3+] ZINC000662293675 412082592 /nfs/dbraw/zinc/08/25/92/412082592.db2.gz HYGYXAPYAYAHHD-UHFFFAOYSA-N 2 0 242.407 2.252 20 0 BEADRP CC[C@H](C)C[NH2+]C[C@H](C)C[NH+]1CCCC1 ZINC000062071322 171284997 /nfs/dbraw/zinc/28/49/97/171284997.db2.gz WFBMQJABEYOHOQ-STQMWFEESA-N 2 0 212.381 2.354 20 0 BEADRP CC[C@H](C)C[C@H](C)[NH2+][C@H]1CN(C)C[C@H]1C ZINC000308954356 171298183 /nfs/dbraw/zinc/29/81/83/171298183.db2.gz QCLRYEVGGRVYSN-RNJOBUHISA-N 2 0 212.381 2.351 20 0 BEADRP CC[C@H](C)C[C@H](C)[NH2+][C@@H]1CN(C)C[C@@H]1C ZINC000308954357 171298708 /nfs/dbraw/zinc/29/87/08/171298708.db2.gz QCLRYEVGGRVYSN-ZDEQEGDKSA-N 2 0 212.381 2.351 20 0 BEADRP C[N@H+](CCCCC(F)(F)F)CC(C)(C)[NH3+] ZINC000662296106 412084284 /nfs/dbraw/zinc/08/42/84/412084284.db2.gz VYHWJXUFGKGLIY-UHFFFAOYSA-N 2 0 226.286 2.388 20 0 BEADRP CC[C@H](C)[NH2+]CCCNc1ccccn1 ZINC000163837117 171340134 /nfs/dbraw/zinc/34/01/34/171340134.db2.gz PXDLWPCZLBEHCN-NSHDSACASA-N 2 0 207.321 2.272 20 0 BEADRP CC[C@@H](C)[NH+]1CCC([C@H]2CCC[NH2+]C2)CC1 ZINC000662291319 412080084 /nfs/dbraw/zinc/08/00/84/412080084.db2.gz DNDCZGFYYKTLGY-OCCSQVGLSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H](C)[NH+]1CCC([C@@H]2CCC[NH2+]C2)CC1 ZINC000662291320 412080273 /nfs/dbraw/zinc/08/02/73/412080273.db2.gz DNDCZGFYYKTLGY-TZMCWYRMSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@H](C)[C@@H](C)[NH2+]C[C@@H](C)C[NH+](C)C ZINC000336681990 171364611 /nfs/dbraw/zinc/36/46/11/171364611.db2.gz HZZLKXLCXJBUOL-GRYCIOLGSA-N 2 0 200.370 2.208 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+]CC1CC[NH+](C)CC1 ZINC000044515974 171389142 /nfs/dbraw/zinc/38/91/42/171389142.db2.gz CUDWZPIFDGYTFJ-RYUDHWBXSA-N 2 0 212.381 2.352 20 0 BEADRP CC[C@H](C)[C@H](C[NH2+][C@H](C)CCCC[NH3+])OC ZINC000362976038 171392845 /nfs/dbraw/zinc/39/28/45/171392845.db2.gz IWSNXMWWMCQSCG-XQQFMLRXSA-N 2 0 230.396 2.155 20 0 BEADRP CC[C@H](C)[C@H](C[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1)OC ZINC000362974923 171392982 /nfs/dbraw/zinc/39/29/82/171392982.db2.gz CCHNPYVECONCFP-CRWXNKLISA-N 2 0 242.407 2.120 20 0 BEADRP Cc1cccc([C@@H](C)N2CC3CC2(C[NH3+])C3)c1 ZINC000662304630 412089861 /nfs/dbraw/zinc/08/98/61/412089861.db2.gz SDYBTVHQYNLWDI-DNOWBOINSA-N 2 0 230.355 2.479 20 0 BEADRP C[C@H]([NH3+])C[N@@H+]1CC[C@H](C2CCCCC2)C1 ZINC000662305361 412091536 /nfs/dbraw/zinc/09/15/36/412091536.db2.gz GFAUVCRMZADUSQ-AAEUAGOBSA-N 2 0 210.365 2.236 20 0 BEADRP CC1(C)CC[N@H+](CCOCC[NH3+])CC(C)(C)C1 ZINC000662306663 412091627 /nfs/dbraw/zinc/09/16/27/412091627.db2.gz RSJKNPQKCZUBDA-UHFFFAOYSA-N 2 0 242.407 2.110 20 0 BEADRP CCC(C)(C)CC[N@@H+]1CC2CC1(C[NH3+])C2 ZINC000662305247 412091820 /nfs/dbraw/zinc/09/18/20/412091820.db2.gz FVQRFSDAWIDFIB-UHFFFAOYSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@@H]1CCC[N@H+](Cc2ccncc2)[C@@H]1CCC[NH3+] ZINC000662316794 412097384 /nfs/dbraw/zinc/09/73/84/412097384.db2.gz OBAUXXLZTFVNEX-UKRRQHHQSA-N 2 0 247.386 2.421 20 0 BEADRP CC(C)CC[N@@H+]1CCO[C@@H](CCC[NH+](C)C)C1 ZINC000662319933 412098590 /nfs/dbraw/zinc/09/85/90/412098590.db2.gz QWXRRTRVUVYXFJ-AWEZNQCLSA-N 2 0 242.407 2.075 20 0 BEADRP [NH3+]CCC[N@@H+]1CCCC[C@@H]1CC1CCC1 ZINC000662319953 412100746 /nfs/dbraw/zinc/10/07/46/412100746.db2.gz RFLPLXHPWOOUDO-CYBMUJFWSA-N 2 0 210.365 2.380 20 0 BEADRP C[N@@H+]1CCCC[C@@H]1CC[NH+]1CC2CC1(C)C2 ZINC000662382579 412134645 /nfs/dbraw/zinc/13/46/45/412134645.db2.gz ZPNNREKYJRSUFW-ROKHWSDSSA-N 2 0 222.376 2.345 20 0 BEADRP Cc1ccncc1CC[NH2+][C@H]1CCCC[C@@H]1C[NH3+] ZINC000665239752 412181001 /nfs/dbraw/zinc/18/10/01/412181001.db2.gz YNVZVJKNOIVKDU-HIFRSBDPSA-N 2 0 247.386 2.040 20 0 BEADRP C[C@H]([NH2+]C1CCC(C[NH3+])CC1)c1cscn1 ZINC000665240723 412182591 /nfs/dbraw/zinc/18/25/91/412182591.db2.gz REVHKUBRQYPDQG-WHXUTIOJSA-N 2 0 239.388 2.311 20 0 BEADRP C[C@@H]([NH2+][C@@H]1Cc2ccccc2[C@@H]1C)[C@@H]1CCC[NH2+]1 ZINC000665244150 412186830 /nfs/dbraw/zinc/18/68/30/412186830.db2.gz HHLMCWWZTPDTQX-SHUKQUCYSA-N 2 0 244.382 2.445 20 0 BEADRP C[C@H]([NH2+]CC1([NH3+])CCCC1)C1CCSCC1 ZINC000665248353 412192822 /nfs/dbraw/zinc/19/28/22/412192822.db2.gz VLKMUIBDZLISHE-NSHDSACASA-N 2 0 242.432 2.379 20 0 BEADRP C[C@H]([NH2+]CCC(C)(C)F)[C@@H]1CCCC[NH2+]1 ZINC000665262236 412205491 /nfs/dbraw/zinc/20/54/91/412205491.db2.gz WTRYQWWNUNMERP-QWRGUYRKSA-N 2 0 216.344 2.245 20 0 BEADRP [NH3+][C@H]1CCCCC[C@H]1[NH2+]CCc1ccoc1 ZINC000665262277 412206079 /nfs/dbraw/zinc/20/60/79/412206079.db2.gz XWDQSOBEVWTHIV-QWHCGFSZSA-N 2 0 222.332 2.072 20 0 BEADRP C[C@]1(C[NH2+][C@@H]2CCCC[C@@H]2C[NH3+])CC1(F)F ZINC000665265731 412208518 /nfs/dbraw/zinc/20/85/18/412208518.db2.gz ZWTYMEJWXRNBAJ-GMTAPVOTSA-N 2 0 232.318 2.139 20 0 BEADRP C[C@]1(C[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)CC1(F)F ZINC000665266499 412208852 /nfs/dbraw/zinc/20/88/52/412208852.db2.gz CLMNOPYDIPPOHY-IRCOFANPSA-N 2 0 244.329 2.009 20 0 BEADRP C[C@]1(C[NH2+][C@@H]2CCCC[C@H]2C[NH3+])CC1(F)F ZINC000665265733 412209555 /nfs/dbraw/zinc/20/95/55/412209555.db2.gz ZWTYMEJWXRNBAJ-HBNTYKKESA-N 2 0 232.318 2.139 20 0 BEADRP C[C@@H]([NH2+]CC[C@]1(C)CC1(F)F)[C@H]1CCC[NH2+]1 ZINC000665267282 412211017 /nfs/dbraw/zinc/21/10/17/412211017.db2.gz TXKFEXDWFCFLPH-GMTAPVOTSA-N 2 0 232.318 2.152 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCCC[C@@H]1C[NH3+])c1ccccn1 ZINC000665232385 412169833 /nfs/dbraw/zinc/16/98/33/412169833.db2.gz MBXAMWFBBYHHHM-UMVBOHGHSA-N 2 0 247.386 2.292 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCCCC[C@@H]1[NH3+])c1ccccn1 ZINC000665231992 412170633 /nfs/dbraw/zinc/17/06/33/412170633.db2.gz CUYRDYAHPXDTEG-IPYPFGDCSA-N 2 0 247.386 2.435 20 0 BEADRP C[C@@H]([NH2+]C1CCC2(CC2(F)F)CC1)C1C[NH2+]C1 ZINC000665274640 412216842 /nfs/dbraw/zinc/21/68/42/412216842.db2.gz UZVJAURCWXXQPA-OIKLOGQESA-N 2 0 244.329 2.152 20 0 BEADRP CC[C@H]([NH2+]CC[C@@H]([NH3+])C(C)C)C(C)C ZINC000665279869 412223685 /nfs/dbraw/zinc/22/36/85/412223685.db2.gz NWPFVDHAINALBO-NEPJUHHUSA-N 2 0 200.370 2.384 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+][C@@H](C)[C@@H]1CC1(C)C ZINC000665282085 412226523 /nfs/dbraw/zinc/22/65/23/412226523.db2.gz QJFHUQAWZXLAMJ-SDDRHHMPSA-N 2 0 212.381 2.384 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+][C@H](C)[C@@H]1CC1(C)C ZINC000665282082 412226794 /nfs/dbraw/zinc/22/67/94/412226794.db2.gz QJFHUQAWZXLAMJ-GRYCIOLGSA-N 2 0 212.381 2.384 20 0 BEADRP c1coc(CCC[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)c1 ZINC000665283685 412228661 /nfs/dbraw/zinc/22/86/61/412228661.db2.gz SCZGUYIBIWWPHH-FUNVUKJBSA-N 2 0 234.343 2.085 20 0 BEADRP C[NH2+]C[C@H](C)[NH2+][C@H]1CCCC12CCCC2 ZINC000665297305 412245128 /nfs/dbraw/zinc/24/51/28/412245128.db2.gz CXDBMLQYHYSNBZ-RYUDHWBXSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]([NH2+]CC(C)(C)CC(F)(F)F)C1C[NH2+]C1 ZINC000665300637 412249289 /nfs/dbraw/zinc/24/92/89/412249289.db2.gz GSXKNLBKSPBEGF-QMMMGPOBSA-N 2 0 238.297 2.163 20 0 BEADRP CC(C)(C[NH2+][C@H]1CCC[C@@H]1[NH3+])CC(F)(F)F ZINC000665301232 412249444 /nfs/dbraw/zinc/24/94/44/412249444.db2.gz RWZAMJFDKQUWEC-IUCAKERBSA-N 2 0 238.297 2.434 20 0 BEADRP CCc1ccc(C[N@H+](C)C2CC[NH2+]CC2)s1 ZINC000036300947 171793403 /nfs/dbraw/zinc/79/34/03/171793403.db2.gz JGYHJUDPFKFYPK-UHFFFAOYSA-N 2 0 238.400 2.494 20 0 BEADRP C[NH+](C)CCCC[NH2+]CCC(C)(C)C ZINC000045697111 172429510 /nfs/dbraw/zinc/42/95/10/172429510.db2.gz DRWPCFKEEUNSOM-UHFFFAOYSA-N 2 0 200.370 2.354 20 0 BEADRP C[NH+]1CCC2(CCC[N@@H+]2Cc2cccnc2)CC1 ZINC000336528528 173002986 /nfs/dbraw/zinc/00/29/86/173002986.db2.gz HLDCTWHRXKGQFP-UHFFFAOYSA-N 2 0 245.370 2.142 20 0 BEADRP C[N@@H+]1CCCC[C@H]1CC[NH2+][C@H]1CCOC1(C)C ZINC000328278710 173007961 /nfs/dbraw/zinc/00/79/61/173007961.db2.gz YSBNICBXVQCCNC-STQMWFEESA-N 2 0 240.391 2.018 20 0 BEADRP CN1CCC[C@@H]([NH2+]C2CCCCCC2)C1 ZINC000040671727 173020521 /nfs/dbraw/zinc/02/05/21/173020521.db2.gz PJSOSTJBONCFLN-CYBMUJFWSA-N 2 0 210.365 2.393 20 0 BEADRP C[N@@H+]1CCC[C@@]2(CC[NH+](C3CCCC3)C2)C1 ZINC000334267530 173038708 /nfs/dbraw/zinc/03/87/08/173038708.db2.gz ZULMVAAIYGOVKX-CQSZACIVSA-N 2 0 222.376 2.347 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+]Cc2cccc(F)c2)C1 ZINC000044535439 173041188 /nfs/dbraw/zinc/04/11/88/173041188.db2.gz LTGKJPKMHFOWFL-CYBMUJFWSA-N 2 0 236.334 2.257 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH2+]Cc2cccs2)CC1 ZINC000076673899 173045848 /nfs/dbraw/zinc/04/58/48/173045848.db2.gz AQGMTOYRBVOPJC-NSHDSACASA-N 2 0 224.373 2.322 20 0 BEADRP CN1CCC[C@H]([NH2+]CCc2ccc(F)cc2)C1 ZINC000076683302 173046027 /nfs/dbraw/zinc/04/60/27/173046027.db2.gz APYMBQQUNOVFFZ-AWEZNQCLSA-N 2 0 236.334 2.052 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH2+]Cc2ccc(F)cc2)CC1 ZINC000076683307 173046591 /nfs/dbraw/zinc/04/65/91/173046591.db2.gz XLMVCIAZDBQJSX-AWEZNQCLSA-N 2 0 236.334 2.400 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CCC2CC2)[C@H]2CCC[C@@H]21 ZINC000309436396 173151604 /nfs/dbraw/zinc/15/16/04/173151604.db2.gz HHYVFKQGGPIPQI-RDBSUJKOSA-N 2 0 222.376 2.249 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CCc2ccco2)[C@@H]2CCC[C@H]21 ZINC000353432133 173153151 /nfs/dbraw/zinc/15/31/51/173153151.db2.gz AQNCMAZFNAOPQE-SOUVJXGZSA-N 2 0 248.370 2.285 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CCC[C@@H]2F)[C@@H]2CCC[C@@H]21 ZINC000340525613 173153964 /nfs/dbraw/zinc/15/39/64/173153964.db2.gz WVMNOXKPDVJCNZ-YHQUGGNUSA-N 2 0 240.366 2.339 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CC2(C)C)[C@@H]2CCC[C@H]21 ZINC000336726548 173154058 /nfs/dbraw/zinc/15/40/58/173154058.db2.gz CCSCJFYWAXFXHA-WUHRBBMRSA-N 2 0 222.376 2.247 20 0 BEADRP C[NH2+]CCC1CC[NH+](CC(C)(C)C)CC1 ZINC000069730218 173342964 /nfs/dbraw/zinc/34/29/64/173342964.db2.gz AJRGHVTZRCRLSQ-UHFFFAOYSA-N 2 0 212.381 2.354 20 0 BEADRP C[NH2+]CCC1CC[NH+]([C@@H](C)c2cccnc2)CC1 ZINC000070188721 173343168 /nfs/dbraw/zinc/34/31/68/173343168.db2.gz OEGKDJBJIOKHNH-ZDUSSCGKSA-N 2 0 247.386 2.464 20 0 BEADRP C[NH2+]CCC1CC[NH+]([C@H](C)c2ccccn2)CC1 ZINC000070188878 173343226 /nfs/dbraw/zinc/34/32/26/173343226.db2.gz QKPOKHIBVZRRHM-CYBMUJFWSA-N 2 0 247.386 2.464 20 0 BEADRP C[NH2+]CCC[N@H+](C)Cc1c(C)cccc1C ZINC000126242508 173346005 /nfs/dbraw/zinc/34/60/05/173346005.db2.gz IMSXGKRJJZYPRG-UHFFFAOYSA-N 2 0 220.360 2.345 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCC[C@@H]1c1ccsc1 ZINC000309629237 173346830 /nfs/dbraw/zinc/34/68/30/173346830.db2.gz JZISHDHFCXARGZ-GFCCVEGCSA-N 2 0 224.373 2.495 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCC[C@@H]2CCCC[C@@H]21 ZINC000042409660 173347550 /nfs/dbraw/zinc/34/75/50/173347550.db2.gz GJJAFUVRHQJJBH-STQMWFEESA-N 2 0 210.365 2.251 20 0 BEADRP C[NH2+]C[C@H]1CCC[N@H+](CCC(C)(C)C)C1 ZINC000040601051 173378761 /nfs/dbraw/zinc/37/87/61/173378761.db2.gz SJLPYUCFNUVRSH-GFCCVEGCSA-N 2 0 212.381 2.354 20 0 BEADRP C[NH2+]C[C@H]1CC[N@H+](Cc2cc(C)ccc2C)C1 ZINC000071142629 173382248 /nfs/dbraw/zinc/38/22/48/173382248.db2.gz XEUIYDIGGZWCKR-CQSZACIVSA-N 2 0 232.371 2.345 20 0 BEADRP COC1(C[NH2+]CC(C)(C)C[NH+](C)C)CCCC1 ZINC000319972924 174001569 /nfs/dbraw/zinc/00/15/69/174001569.db2.gz WVLHVNWTAFVQSR-UHFFFAOYSA-N 2 0 242.407 2.123 20 0 BEADRP COC1CC([NH2+]CCCCC[NH+]2CCCC2)C1 ZINC000354234795 174017676 /nfs/dbraw/zinc/01/76/76/174017676.db2.gz CVLQGSAGMCQBMV-UHFFFAOYSA-N 2 0 240.391 2.020 20 0 BEADRP COCC[C@@H]1CCC[C@H]1[NH2+][C@H](C)CC[NH+](C)C ZINC000337410441 174397472 /nfs/dbraw/zinc/39/74/72/174397472.db2.gz VSTIAZZMUOGERX-HZSPNIEDSA-N 2 0 242.407 2.121 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+][C@H]1CCC[C@H](C)CC1 ZINC000300579553 174562033 /nfs/dbraw/zinc/56/20/33/174562033.db2.gz SZHOXNSTORKSAP-IHRRRGAJSA-N 2 0 242.407 2.299 20 0 BEADRP COc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[NH2+]C2)cc1 ZINC000107786857 175176610 /nfs/dbraw/zinc/17/66/10/175176610.db2.gz CNNVLLABCHYLHR-CHWSQXEVSA-N 2 0 248.370 2.345 20 0 BEADRP COc1ccc([C@H](C)[NH2+]CCCC[NH3+])c(F)c1 ZINC000037715474 175188081 /nfs/dbraw/zinc/18/80/81/175188081.db2.gz FOLDODUAWYQDJC-JTQLQIEISA-N 2 0 240.322 2.224 20 0 BEADRP COc1ccc([C@H](C)[NH2+]C[C@H]2CCC[NH2+]C2)cc1 ZINC000107786859 175189685 /nfs/dbraw/zinc/18/96/85/175189685.db2.gz CNNVLLABCHYLHR-STQMWFEESA-N 2 0 248.370 2.345 20 0 BEADRP COc1ccc([C@H](C)[NH2+][C@H]2CCC[C@H]2C[NH3+])cc1 ZINC000160097011 175190313 /nfs/dbraw/zinc/19/03/13/175190313.db2.gz IVPAUBUHIADKKF-WHOFXGATSA-N 2 0 248.370 2.473 20 0 BEADRP COc1cccc(C[N@H+](C)C[C@@H]2CCC[NH2+]C2)c1 ZINC000042442300 175255519 /nfs/dbraw/zinc/25/55/19/175255519.db2.gz MCPOTEUIACVSOT-CQSZACIVSA-N 2 0 248.370 2.127 20 0 BEADRP COc1cccc(C[N@@H+]2CC[C@H]([NH3+])C[C@@H]2C)c1 ZINC000049713134 175259529 /nfs/dbraw/zinc/25/95/29/175259529.db2.gz PPNDBIXHMNCWLQ-AAEUAGOBSA-N 2 0 234.343 2.007 20 0 BEADRP CC(C)[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000053659970 487630254 /nfs/dbraw/zinc/63/02/54/487630254.db2.gz QQGLDGUGQDZSQG-UHFFFAOYSA-N 2 0 210.365 2.106 20 0 BEADRP COc1ccccc1[C@@H](C)[NH2+][C@H]1CCC[NH2+]CC1 ZINC000128878984 175346572 /nfs/dbraw/zinc/34/65/72/175346572.db2.gz CQOLCLDPLXWAOA-OLZOCXBDSA-N 2 0 248.370 2.488 20 0 BEADRP CC(C)C1(C[NH2+]C[C@@H]2CCC[N@H+](C)C2)CC1 ZINC000232672246 487630513 /nfs/dbraw/zinc/63/05/13/487630513.db2.gz AOMFPNGVCOEYIL-ZDUSSCGKSA-N 2 0 224.392 2.354 20 0 BEADRP CSC1(C[NH2+]C2CC(C)C2)CC[NH+](C)CC1 ZINC000309700389 175450876 /nfs/dbraw/zinc/45/08/76/175450876.db2.gz MJMNYKBTIHDFNA-UHFFFAOYSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CCc1cccs1 ZINC000336659934 175663805 /nfs/dbraw/zinc/66/38/05/175663805.db2.gz BRBSCLIFWXHNTK-NSHDSACASA-N 2 0 226.389 2.398 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+]CC1CCC(C)(C)CC1 ZINC000308930768 175708159 /nfs/dbraw/zinc/70/81/59/175708159.db2.gz RFDALGBCLHKUAW-NSHDSACASA-N 2 0 212.381 2.387 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@@H]1CCCc2sccc21 ZINC000308976458 175708410 /nfs/dbraw/zinc/70/84/10/175708410.db2.gz IPUOYGCWHAPBCK-GXSJLCMTSA-N 2 0 224.373 2.310 20 0 BEADRP C[C@@H](C[C@@H]1CCC[NH2+]1)[NH2+]Cc1cccc(F)c1 ZINC000093462927 175766262 /nfs/dbraw/zinc/76/62/62/175766262.db2.gz OEHBDKCXHHKGNG-FZMZJTMJSA-N 2 0 236.334 2.446 20 0 BEADRP C[C@@H]([NH2+]CCCC[NH+](C)C)C1CCSCC1 ZINC000309517373 175874138 /nfs/dbraw/zinc/87/41/38/175874138.db2.gz YZSXWORWMODDDS-GFCCVEGCSA-N 2 0 244.448 2.450 20 0 BEADRP C[C@@H]([NH2+]CCCC[NH3+])c1ccc(F)cc1 ZINC000037714819 175874676 /nfs/dbraw/zinc/87/46/76/175874676.db2.gz NAOQLXZZLZPHBV-SNVBAGLBSA-N 2 0 210.296 2.215 20 0 BEADRP C[C@@H](c1cccnc1)[N@@H+]1CC[C@@H](C)[C@@H](C[NH3+])C1 ZINC000163375672 176029890 /nfs/dbraw/zinc/02/98/90/176029890.db2.gz ALZILMHMUQIRFN-DYEKYZERSA-N 2 0 233.359 2.059 20 0 BEADRP C[C@@H]1CCCC[N@@H+]1CC[C@@H]1CCC[NH+]1C ZINC000124656498 176071547 /nfs/dbraw/zinc/07/15/47/176071547.db2.gz CAJNOULRPRSQJJ-OLZOCXBDSA-N 2 0 210.365 2.345 20 0 BEADRP C[C@@H]1CCCC[C@H]1[NH2+]CCCC[NH+](C)C ZINC000045662969 176088298 /nfs/dbraw/zinc/08/82/98/176088298.db2.gz FMHWEPVUIKJCFC-CHWSQXEVSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H]1CCCC[C@H]1OCCN1CCC[C@H]([NH3+])C1 ZINC000346101486 176089610 /nfs/dbraw/zinc/08/96/10/176089610.db2.gz UEJVAOVQEDJOHQ-HZSPNIEDSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@@H]1CCC[C@@H](C[NH2+]C[C@@H]2CCC[NH2+]2)C1 ZINC000235298540 176118856 /nfs/dbraw/zinc/11/88/56/176118856.db2.gz AJHJJCDWPYBIEO-UPJWGTAASA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]CCCC[NH+](C)C)C1 ZINC000045662985 176123496 /nfs/dbraw/zinc/12/34/96/176123496.db2.gz BDTUZCHOXWBJHO-CHWSQXEVSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+]CC[C@@H]1CCC[N@@H+]1C ZINC000309153729 176131194 /nfs/dbraw/zinc/13/11/94/176131194.db2.gz WZBDZGKDNVMHTC-AGIUHOORSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+][C@H]1CCc2nc[nH]c2C1 ZINC000309733700 176132602 /nfs/dbraw/zinc/13/26/02/176132602.db2.gz BTEXGZKJEADTMA-VWYCJHECSA-N 2 0 219.332 2.045 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]CC2=CC[N@H+](C)CC2)C1 ZINC000309769223 176143150 /nfs/dbraw/zinc/14/31/50/176143150.db2.gz KCHPGNKXHCYYBZ-OCCSQVGLSA-N 2 0 222.376 2.417 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CCC[C@@H]([NH3+])C2)C1 ZINC000222918571 176145054 /nfs/dbraw/zinc/14/50/54/176145054.db2.gz BWEDVWQSUBGHHW-FVCCEPFGSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@@H]1CC[NH+](C/C=C/C[N@H+]2CC[C@@H](C)C2)C1 ZINC000337693637 176166835 /nfs/dbraw/zinc/16/68/35/176166835.db2.gz QRABICHAEBIDEA-LSMGEYOZSA-N 2 0 222.376 2.226 20 0 BEADRP C[C@H](c1cccnc1)[N@@H+]1CC[C@@H](C)[C@@H](C[NH3+])C1 ZINC000229056096 176180966 /nfs/dbraw/zinc/18/09/66/176180966.db2.gz ALZILMHMUQIRFN-BZPMIXESSA-N 2 0 233.359 2.059 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C[C@]2(C)CCC[NH2+]C2)C1 ZINC000129452207 176212827 /nfs/dbraw/zinc/21/28/27/176212827.db2.gz GKFHYUGQQKIDFD-JHJVBQTASA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]Cc1ccc(F)cc1 ZINC000105480679 176269974 /nfs/dbraw/zinc/26/99/74/176269974.db2.gz WQPXUVKWDCBGPF-RISCZKNCSA-N 2 0 236.334 2.256 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+][C@@H]1CSC1(C)C ZINC000309823377 176278054 /nfs/dbraw/zinc/27/80/54/176278054.db2.gz WVTQGNGZADXBRE-WISYIIOYSA-N 2 0 242.432 2.199 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+][C@H]1CC[C@H](F)C1 ZINC000309798611 176278137 /nfs/dbraw/zinc/27/81/37/176278137.db2.gz QSIZYOUBZNPJIM-BNDIWNMDSA-N 2 0 228.355 2.195 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]CC(C)(C)C ZINC000040492886 176278358 /nfs/dbraw/zinc/27/83/58/176278358.db2.gz ZERYNCXKMOEEKK-IJLUTSLNSA-N 2 0 212.381 2.351 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]CC1(C(F)F)CC1 ZINC000359003338 176279177 /nfs/dbraw/zinc/27/91/77/176279177.db2.gz QTAMMOKJHFZPCH-GMTAPVOTSA-N 2 0 246.345 2.350 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]CCC(C)(F)F ZINC000357719312 176279245 /nfs/dbraw/zinc/27/92/45/176279245.db2.gz ZAPRIVTYXVMETN-MXWKQRLJSA-N 2 0 234.334 2.350 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]C[C@H]1CCSC1 ZINC000300230002 176280626 /nfs/dbraw/zinc/28/06/26/176280626.db2.gz NPCBEIXOGQZEPK-FDYHWXHSSA-N 2 0 242.432 2.058 20 0 BEADRP C[C@@H]1C[N@@H+](C2Cc3ccccc3C2)C[C@@]1(C)C[NH3+] ZINC000311073532 176283267 /nfs/dbraw/zinc/28/32/67/176283267.db2.gz ZPGJLRXHCBTOAT-MLGOLLRUSA-N 2 0 244.382 2.071 20 0 BEADRP C[C@@H]1C[N@H+](CC[C@@H]2CC[NH2+]C2)C(C)(C)C1 ZINC000335631443 176294268 /nfs/dbraw/zinc/29/42/68/176294268.db2.gz PBPAGEFQEGDBPY-RYUDHWBXSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1CSC[C@@H]1[NH2+]CCC[NH+]1CCCCC1 ZINC000304525023 176352522 /nfs/dbraw/zinc/35/25/22/176352522.db2.gz PSLXSUDGHRZINZ-OLZOCXBDSA-N 2 0 242.432 2.204 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CSC[C@H]1C)C[NH+]1CCCC1 ZINC000304500479 176355492 /nfs/dbraw/zinc/35/54/92/176355492.db2.gz NFHKQLWMICYMIO-JHJVBQTASA-N 2 0 242.432 2.059 20 0 BEADRP C[C@@H]1C[C@@H](C[N@H+](C)C2CCCC2)CC[NH2+]1 ZINC000235378712 176367405 /nfs/dbraw/zinc/36/74/05/176367405.db2.gz YVVAQYMKIRUPRE-NEPJUHHUSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCC2(F)CCC2)CC[N@@H+]1C ZINC000309808494 176375365 /nfs/dbraw/zinc/37/53/65/176375365.db2.gz SUFSYYKKHQJNID-NEPJUHHUSA-N 2 0 228.355 2.341 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CC2(C(F)F)CC2)CC[N@@H+]1C ZINC000309810345 176375406 /nfs/dbraw/zinc/37/54/06/176375406.db2.gz UAQJNIJKWHYLAO-ZJUUUORDSA-N 2 0 232.318 2.104 20 0 BEADRP C[C@@H]1C[C@H](C[NH+]2CCC(C)(C)CC2)CC[NH2+]1 ZINC000235367200 176413936 /nfs/dbraw/zinc/41/39/36/176413936.db2.gz TUFVVJRPBBRDJW-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H]1CCc2ccccc21 ZINC000309353784 176620974 /nfs/dbraw/zinc/62/09/74/176620974.db2.gz CCWRUTAQUIMLEC-RISCZKNCSA-N 2 0 218.344 2.391 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H](C)c1ccccc1F ZINC000308993926 176658888 /nfs/dbraw/zinc/65/88/88/176658888.db2.gz OSWUDVYFKQBCGF-NXEZZACHSA-N 2 0 210.296 2.071 20 0 BEADRP C[C@H]([NH2+]CCCC[NH+](C)C)c1cccc(O)c1 ZINC000045663497 176843560 /nfs/dbraw/zinc/84/35/60/176843560.db2.gz SSIJCIRBVKFWJC-LBPRGKRZSA-N 2 0 236.359 2.385 20 0 BEADRP C[C@H]([NH2+]CCCC[NH+](C)C)c1cncc(F)c1 ZINC000222904052 176843881 /nfs/dbraw/zinc/84/38/81/176843881.db2.gz OGYRNWCVQNFEMI-NSHDSACASA-N 2 0 239.338 2.213 20 0 BEADRP C[C@H]([NH2+][C@H]1CC1(C)C)C1CC[NH+](C)CC1 ZINC000045116890 176918088 /nfs/dbraw/zinc/91/80/88/176918088.db2.gz QOWUDHRBLVHKNP-JQWIXIFHSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@H](c1cccc(F)c1)[N@@H+]1CC[C@H](C[NH3+])C1 ZINC000049530943 177036073 /nfs/dbraw/zinc/03/60/73/177036073.db2.gz XMRDWBJBEDGNIL-GHMZBOCLSA-N 2 0 222.307 2.167 20 0 BEADRP C[C@H](c1cccc(O)c1)[N@H+](C)CC1CC[NH2+]CC1 ZINC000094011026 177036869 /nfs/dbraw/zinc/03/68/69/177036869.db2.gz RNXBLPIFVPIFCW-GFCCVEGCSA-N 2 0 248.370 2.385 20 0 BEADRP C[C@H]1CCCC[C@@H]1C[NH2+]CCC[NH+](C)C ZINC000122588564 177079603 /nfs/dbraw/zinc/07/96/03/177079603.db2.gz VBUDBSQSGAORFM-QWHCGFSZSA-N 2 0 212.381 2.354 20 0 BEADRP C[C@@H]1C[N@H+](C[C@@H]2CCCC[C@@H]2C)CC[C@@H]1[NH3+] ZINC000042864366 177085093 /nfs/dbraw/zinc/08/50/93/177085093.db2.gz FSQXNGIFBWULKA-CRWXNKLISA-N 2 0 224.392 2.482 20 0 BEADRP C[C@H]1CCC[C@@H](C[NH2+]C2CC[NH2+]CC2)C1 ZINC000235606236 177119494 /nfs/dbraw/zinc/11/94/94/177119494.db2.gz AZNKFFCOWTVZBM-NWDGAFQWSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H]1CCC[C@@H]1[NH2+]CC1=CC[N@H+](C)CC1 ZINC000335604326 177126073 /nfs/dbraw/zinc/12/60/73/177126073.db2.gz WYQKMICPHZGGRJ-AAEUAGOBSA-N 2 0 208.349 2.027 20 0 BEADRP C[C@H]1CCC[C@H]([NH+]2CCC(C[NH3+])CC2)C1 ZINC000044511955 177135307 /nfs/dbraw/zinc/13/53/07/177135307.db2.gz CONRXVQGEDTUMS-AAEUAGOBSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@H]1CCC[C@H]([NH2+]CCCC[NH+](C)C)C1 ZINC000045662984 177137283 /nfs/dbraw/zinc/13/72/83/177137283.db2.gz BDTUZCHOXWBJHO-STQMWFEESA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@H]([NH2+]C[C@H]2CCCN2C)C1 ZINC000300369312 177183960 /nfs/dbraw/zinc/18/39/60/177183960.db2.gz WYEIWLSRMYLTKX-XJFOESAGSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+]CC2(C)CC[NH2+]CC2)C1 ZINC000129443780 177193298 /nfs/dbraw/zinc/19/32/98/177193298.db2.gz BTKGIAVEDAEQTH-NWDGAFQWSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+][C@@H]2CC[N@H+](C)C[C@@H]2C)C1 ZINC000336673292 177233633 /nfs/dbraw/zinc/23/36/33/177233633.db2.gz AKEPWHNPDBBDFQ-ZOBORPQBSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1CCC[C@H](C[N@@H+]2CC[C@@H]([NH3+])[C@@H](C)C2)C1 ZINC000227055034 177259470 /nfs/dbraw/zinc/25/94/70/177259470.db2.gz ILBOPLDSZVRMND-ZOBORPQBSA-N 2 0 224.392 2.482 20 0 BEADRP C[C@H]1CSC[C@@H]1[NH2+]CCC[NH+]1CCCCC1 ZINC000304525025 177306505 /nfs/dbraw/zinc/30/65/05/177306505.db2.gz PSLXSUDGHRZINZ-STQMWFEESA-N 2 0 242.432 2.204 20 0 BEADRP C[C@H]1C[C@@H](C[N@H+](C)C2CCCC2)CC[NH2+]1 ZINC000235697136 177323347 /nfs/dbraw/zinc/32/33/47/177323347.db2.gz YVVAQYMKIRUPRE-RYUDHWBXSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@H]1C[C@@H](C[N@@H+]2CCC[C@@H](C)CC2)CC[NH2+]1 ZINC000235312878 177324968 /nfs/dbraw/zinc/32/49/68/177324968.db2.gz IASXGRNIGYYJPC-RDBSUJKOSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1C[C@@H](C[NH2+]CC2(C)CCC2)CC[NH2+]1 ZINC000235700584 177325007 /nfs/dbraw/zinc/32/50/07/177325007.db2.gz DKVRTHJPIPJZMU-RYUDHWBXSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]CC(C)(C)C ZINC000040492887 177331200 /nfs/dbraw/zinc/33/12/00/177331200.db2.gz ZERYNCXKMOEEKK-GRYCIOLGSA-N 2 0 212.381 2.351 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]CCc1ccco1 ZINC000036908630 177332487 /nfs/dbraw/zinc/33/24/87/177332487.db2.gz WUWZQZXYEXMLPH-MBNYWOFBSA-N 2 0 236.359 2.140 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CCc2cccs2)CC[N@@H+]1C ZINC000129659267 177332547 /nfs/dbraw/zinc/33/25/47/177332547.db2.gz YHDATGJFMAUXTB-RYUDHWBXSA-N 2 0 238.400 2.363 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+][C@H]1CCN(C)[C@@H](C)C1 ZINC000361922416 177333753 /nfs/dbraw/zinc/33/37/53/177333753.db2.gz AAVUGKFBMYSNTL-DYEKYZERSA-N 2 0 236.359 2.283 20 0 BEADRP C[C@H]1C[C@@H]1C[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000336740524 177344573 /nfs/dbraw/zinc/34/45/73/177344573.db2.gz MIDNCOFZYYCSCA-MRFVTOPCSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@@H]1CCC[N@H+](C[C@@H]2CC[NH2+][C@@H](C)C2)C1 ZINC000235311328 177362408 /nfs/dbraw/zinc/36/24/08/177362408.db2.gz GDUQVBUYTYSRJG-FRRDWIJNSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]1C[C@H](C[N@@H+]2CCCC(C)(C)C2)CC[NH2+]1 ZINC000235661535 177362508 /nfs/dbraw/zinc/36/25/08/177362508.db2.gz VJSXXZBHWXUWCE-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1C[C@H](C[NH2+]CC2(C)CCC2)CC[NH2+]1 ZINC000235664505 177362861 /nfs/dbraw/zinc/36/28/61/177362861.db2.gz DKVRTHJPIPJZMU-NWDGAFQWSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H]1C[C@H]([NH3+])CC[N@@H+]1Cc1cccs1 ZINC000049712690 177364602 /nfs/dbraw/zinc/36/46/02/177364602.db2.gz RPMZHVZUTQBWJA-VHSXEESVSA-N 2 0 210.346 2.060 20 0 BEADRP C[C@H]1C[C@H](N(C)Cc2ccco2)CC[N@@H+]1C ZINC000093643686 177364748 /nfs/dbraw/zinc/36/47/48/177364748.db2.gz RAEVLCSDKRRREY-NWDGAFQWSA-N 2 0 222.332 2.194 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]C1CC(F)(F)C1 ZINC000336781420 177369740 /nfs/dbraw/zinc/36/97/40/177369740.db2.gz UPZKXKVCIPUXBL-YWVKMMECSA-N 2 0 232.318 2.102 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CCc2ccccc2O)CC[N@@H+]1C ZINC000154920069 177370136 /nfs/dbraw/zinc/37/01/36/177370136.db2.gz IHAAYCHBXCUWIN-GXTWGEPZSA-N 2 0 248.370 2.007 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]CCc1ccco1 ZINC000036908628 177370498 /nfs/dbraw/zinc/37/04/98/177370498.db2.gz WUWZQZXYEXMLPH-DYEKYZERSA-N 2 0 236.359 2.140 20 0 BEADRP C[C@H]1C[C@H]1C[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC000309506953 177381167 /nfs/dbraw/zinc/38/11/67/177381167.db2.gz WCUPNCZEXPWPDP-WSOGJNRSSA-N 2 0 222.376 2.247 20 0 BEADRP C[C@H]1Cc2ncn(Cc3c[nH]cn3)c2C[C@@H]1C ZINC000295142886 177391080 /nfs/dbraw/zinc/39/10/80/177391080.db2.gz LEZUIYQXUJIAGS-UWVGGRQHSA-N 2 0 230.315 2.025 20 0 BEADRP CC(C)C[C@H](C)[NH2+]CCC[NH2+]C(C)C ZINC000238177385 487638402 /nfs/dbraw/zinc/63/84/02/487638402.db2.gz XSKRJKIGPIICNC-LBPRGKRZSA-N 2 0 200.370 2.399 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCCCS1)[C@@H]1CCC[NH2+]1 ZINC000400399364 225162972 /nfs/dbraw/zinc/16/29/72/225162972.db2.gz PJEGXYYHGNLUOP-TUAOUCFPSA-N 2 0 228.405 2.002 20 0 BEADRP CC(C)OC[C@H](C)[NH2+]C[C@@H]1CC[N@@H+](C(C)C)C1 ZINC000669680746 487644088 /nfs/dbraw/zinc/64/40/88/487644088.db2.gz HYWARZBBPNYRDY-KBPBESRZSA-N 2 0 242.407 2.120 20 0 BEADRP C[C@@H]1C[C@@H](C[N@@H+]2CC[C@@H](C3CC3)C2)CC[NH2+]1 ZINC000400041235 225346282 /nfs/dbraw/zinc/34/62/82/225346282.db2.gz PANXYSCYJMOLHQ-MBNYWOFBSA-N 2 0 222.376 2.106 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@H](C)[C@@H]2CC2(F)F)CC1 ZINC000666226652 487644935 /nfs/dbraw/zinc/64/49/35/487644935.db2.gz BQADOJZPLAFUCQ-PWSUYJOCSA-N 2 0 246.345 2.493 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H](C)[C@H]2CC2(F)F)CC1 ZINC000666227570 487648352 /nfs/dbraw/zinc/64/83/52/487648352.db2.gz OOLXVPJXBGIWDE-CMPLNLGQSA-N 2 0 246.345 2.494 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H](C)[C@@H]2CC2(F)F)CC1 ZINC000666227571 487648031 /nfs/dbraw/zinc/64/80/31/487648031.db2.gz OOLXVPJXBGIWDE-JQWIXIFHSA-N 2 0 246.345 2.494 20 0 BEADRP CSC1(C[NH2+][C@H](C)[C@@H]2CCC[NH2+]2)CCC1 ZINC000400507640 226345303 /nfs/dbraw/zinc/34/53/03/226345303.db2.gz IJPKATJFZVABQR-MNOVXSKESA-N 2 0 228.405 2.002 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)c1cccnc1 ZINC000401010797 226352631 /nfs/dbraw/zinc/35/26/31/226352631.db2.gz MGGWVYSVUITLCE-ZGKBOVNRSA-N 2 0 245.370 2.120 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)c1ccncc1 ZINC000401035664 226352786 /nfs/dbraw/zinc/35/27/86/226352786.db2.gz YTZUPICPADDAGY-CYUUQNCZSA-N 2 0 245.370 2.120 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)[C@H]1CC1(C)C ZINC000401171453 226353111 /nfs/dbraw/zinc/35/31/11/226353111.db2.gz WXRWJAAEBLVMLT-RYMFRWLXSA-N 2 0 236.403 2.399 20 0 BEADRP Cc1cc(C)cc(C[NH2+][C@H]2CN(C)C[C@H]2C)c1 ZINC000674913004 487653823 /nfs/dbraw/zinc/65/38/23/487653823.db2.gz UFPHQMPSBYREFB-HIFRSBDPSA-N 2 0 232.371 2.343 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)c1ccco1 ZINC000401018254 229168757 /nfs/dbraw/zinc/16/87/57/229168757.db2.gz BHJKCKUCMRJZFR-WUHRBBMRSA-N 2 0 234.343 2.318 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)c1ccco1 ZINC000401018253 229168786 /nfs/dbraw/zinc/16/87/86/229168786.db2.gz BHJKCKUCMRJZFR-UMSGYPCISA-N 2 0 234.343 2.318 20 0 BEADRP C[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C[C@@H]1C[NH3+] ZINC000307576058 229216384 /nfs/dbraw/zinc/21/63/84/229216384.db2.gz LWVSSRANZONVSB-NFAWXSAZSA-N 2 0 232.371 2.492 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+]C[C@@H](C)C(C)(C)C ZINC000163005023 487677951 /nfs/dbraw/zinc/67/79/51/487677951.db2.gz NGDZCINGBKVDGB-GHMZBOCLSA-N 2 0 200.370 2.242 20 0 BEADRP CC[C@H](C)CC[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000394413132 487679229 /nfs/dbraw/zinc/67/92/29/487679229.db2.gz RNQDJJQAYLLJBD-AVGNSLFASA-N 2 0 212.381 2.495 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]CC1CCCCCC1 ZINC000414838091 487693247 /nfs/dbraw/zinc/69/32/47/487693247.db2.gz KUBAAHHJLKPTTM-GFCCVEGCSA-N 2 0 212.381 2.402 20 0 BEADRP C[C@@H]([NH2+]CC1(C2CC2)CC1)[C@H]1CCCC[NH2+]1 ZINC000395242250 262784940 /nfs/dbraw/zinc/78/49/40/262784940.db2.gz YZHOSIWCXBQMMU-DGCLKSJQSA-N 2 0 222.376 2.297 20 0 BEADRP C([NH2+]C(C1CCC1)C1CCC1)[C@@H]1CCC[NH2+]1 ZINC000324982887 262798826 /nfs/dbraw/zinc/79/88/26/262798826.db2.gz TWWRIUQSPRLIAX-ZDUSSCGKSA-N 2 0 222.376 2.297 20 0 BEADRP CC[C@H]([NH2+]CCC[NH+]1CCCC1)[C@H]1C[C@H]1C ZINC000321169717 262812311 /nfs/dbraw/zinc/81/23/11/262812311.db2.gz YIDSGSWUGBDKKV-RDBSUJKOSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[C@@H](C)[N@H+](Cc2cccc(O)c2)C[C@@H]1C[NH3+] ZINC000397251754 262920361 /nfs/dbraw/zinc/92/03/61/262920361.db2.gz CWFMYBCJYQGPAS-BZPMIXESSA-N 2 0 248.370 2.197 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[NH2+]C1)[C@H]1CC1(C)C ZINC000397789622 262933972 /nfs/dbraw/zinc/93/39/72/262933972.db2.gz KSYJMSKCIOUJTN-SDDRHHMPSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@H]([NH3+])[C@H]1CCC[N@@H+]([C@@H](C)c2ccncc2)C1 ZINC000226332193 487713146 /nfs/dbraw/zinc/71/31/46/487713146.db2.gz MUUPRRMLDMJSTE-OBJOEFQTSA-N 2 0 233.359 2.202 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@H]2CCC[C@H]21)C1CC1 ZINC000671743654 487718592 /nfs/dbraw/zinc/71/85/92/487718592.db2.gz GRRBHUQTUIWGHG-BEAPCOKYSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@]1([NH2+]C[C@@H](N)CC(F)F)CC=CCC1 ZINC000903929696 584824054 /nfs/dbraw/zinc/82/40/54/584824054.db2.gz JQHWVJAEHNDXAU-ONGXEEELSA-N 2 0 218.291 2.057 20 0 BEADRP FC(F)C1CC([NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)C1 ZINC000681112204 487730786 /nfs/dbraw/zinc/73/07/86/487730786.db2.gz BTCWWZWMLVIQLK-RSJDFQLWSA-N 2 0 244.329 2.247 20 0 BEADRP CC(C)(C)[C@@H]1CCC[N@@H+]1C[C@H]1CC[NH2+]C1 ZINC000250691609 487739500 /nfs/dbraw/zinc/73/95/00/487739500.db2.gz JWBAPILCSYUBKG-RYUDHWBXSA-N 2 0 210.365 2.106 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@@H](C)c2ccncc2)CC1 ZINC000675927279 487793369 /nfs/dbraw/zinc/79/33/69/487793369.db2.gz CZIFJMZGSOTJGF-CYBMUJFWSA-N 2 0 247.386 2.259 20 0 BEADRP CC[C@H](C)[N@H+](CC)CC[C@H]1CCC[NH2+]C1 ZINC000251863237 487803775 /nfs/dbraw/zinc/80/37/75/487803775.db2.gz OSROTPFDVIGAMR-QWHCGFSZSA-N 2 0 212.381 2.497 20 0 BEADRP CCc1ccc(C)[nH+]c1NC1CC[NH+](C)CC1 ZINC000668479363 487807623 /nfs/dbraw/zinc/80/76/23/487807623.db2.gz WXUQOCNJZLQNSL-UHFFFAOYSA-N 2 0 233.359 2.459 20 0 BEADRP [NH3+]CCC[NH2+]C1(Cc2ccccc2)CCCC1 ZINC000414713967 487819271 /nfs/dbraw/zinc/81/92/71/487819271.db2.gz PQXKGWPEVICPHL-UHFFFAOYSA-N 2 0 232.371 2.480 20 0 BEADRP COc1ccc2c(c1)C[C@@H](C)[N@@H+](CCC[NH3+])[C@@H]2C ZINC000414753539 487821538 /nfs/dbraw/zinc/82/15/38/487821538.db2.gz DUHPAQMWWMJJBB-VXGBXAGGSA-N 2 0 248.370 2.352 20 0 BEADRP C[C@@]1(Cc2ccccc2)CCC[N@@H+]1CCC[NH3+] ZINC000414751414 487821629 /nfs/dbraw/zinc/82/16/29/487821629.db2.gz AKUZWHAUYDJRTF-HNNXBMFYSA-N 2 0 232.371 2.432 20 0 BEADRP CC[C@H]1CCCCC[N@@H+]1C[C@H]1CC[NH2+]C1 ZINC000252681291 487828692 /nfs/dbraw/zinc/82/86/92/487828692.db2.gz AAGIJTMNFJZHQX-STQMWFEESA-N 2 0 210.365 2.251 20 0 BEADRP CCc1ncc(C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)s1 ZINC000414936242 487831005 /nfs/dbraw/zinc/83/10/05/487831005.db2.gz ZDKYAPVVJNQFER-ZJUUUORDSA-N 2 0 239.388 2.065 20 0 BEADRP CCCC[C@H](CC)CC[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000415036768 487834353 /nfs/dbraw/zinc/83/43/53/487834353.db2.gz MEQYHDNBIDADEE-IGQOVBAYSA-N 2 0 224.392 2.400 20 0 BEADRP CSCCC[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000020189439 590082977 /nfs/dbraw/zinc/08/29/77/590082977.db2.gz IPDXCVMRYPNRLD-UHFFFAOYSA-N 2 0 230.421 2.202 20 0 BEADRP C[C@@H]1[C@H](C)SCC[N@@H+]1CCCCCC[NH3+] ZINC000132462891 591709334 /nfs/dbraw/zinc/70/93/34/591709334.db2.gz VTWGLIPVOOXWIY-NEPJUHHUSA-N 2 0 230.421 2.331 20 0 BEADRP [NH3+]CCC[N@@H+]1CCS[C@H](c2ccccc2)C1 ZINC000666640944 487849731 /nfs/dbraw/zinc/84/97/31/487849731.db2.gz GQHQQXUDZIHHLO-ZDUSSCGKSA-N 2 0 236.384 2.125 20 0 BEADRP CC(C)CC[N@@H+]1C[C@@H]2CCC[C@]2(C[NH3+])C1 ZINC000379843827 487850089 /nfs/dbraw/zinc/85/00/89/487850089.db2.gz HFXMNSHQBYBXMC-STQMWFEESA-N 2 0 210.365 2.093 20 0 BEADRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]Cc1cccc(F)c1F ZINC000666743841 487869285 /nfs/dbraw/zinc/86/92/85/487869285.db2.gz HAKRREHEDIKUJN-BXKDBHETSA-N 2 0 240.297 2.182 20 0 BEADRP C[C@H](CC1CCC1)[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000666853958 487872653 /nfs/dbraw/zinc/87/26/53/487872653.db2.gz UKPMHOYIKAJRCI-KGYLQXTDSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@H](Cc1ccsc1)[NH2+]C[C@H]([NH3+])C1CC1 ZINC000666835094 487884765 /nfs/dbraw/zinc/88/47/65/487884765.db2.gz ZNUMTQKNACCAGG-SKDRFNHKSA-N 2 0 224.373 2.006 20 0 BEADRP C[C@@H](C[N@H+]1C[C@H]2C[NH+](C)C[C@H]2C1)C(C)(C)C ZINC000670270311 487887798 /nfs/dbraw/zinc/88/77/98/487887798.db2.gz RYTABQYMGDAEMI-RWMBFGLXSA-N 2 0 224.392 2.162 20 0 BEADRP C[C@H](CC[NH3+])[NH2+]Cc1cccc2cnccc21 ZINC000666832350 487887887 /nfs/dbraw/zinc/88/78/87/487887887.db2.gz SSNIBZFCNGXSQA-LLVKDONJSA-N 2 0 229.327 2.062 20 0 BEADRP [NH3+][C@H](C[NH2+]Cc1cccc2cnccc21)C1CC1 ZINC000666834236 487888368 /nfs/dbraw/zinc/88/83/68/487888368.db2.gz HZJZFGPBBLFNRI-OAHLLOKOSA-N 2 0 241.338 2.062 20 0 BEADRP CC(C)C[C@@H](C)C[NH2+][C@H]1CCC[NH2+]CC1 ZINC000666858969 487891817 /nfs/dbraw/zinc/89/18/17/487891817.db2.gz PVIMAQWVTCHRCK-OLZOCXBDSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[NH2+][C@H](C)C1)C(C)(C)C ZINC000666874262 487895520 /nfs/dbraw/zinc/89/55/20/487895520.db2.gz VZACDGQTFBRLQF-IJLUTSLNSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@H](CC1CCC1)[NH2+][C@@H]1CC[NH2+]C[C@@H]1C ZINC000666880448 487896097 /nfs/dbraw/zinc/89/60/97/487896097.db2.gz NCSSKPYCEMXRIP-DMDPSCGWSA-N 2 0 210.365 2.153 20 0 BEADRP Cc1ccccc1C[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000666950985 487909839 /nfs/dbraw/zinc/90/98/39/487909839.db2.gz VLTIDKGDDUOHDA-CQSZACIVSA-N 2 0 230.355 2.227 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CC23CC[NH2+]CC3)s1 ZINC000666950831 487913155 /nfs/dbraw/zinc/91/31/55/487913155.db2.gz KXOOKWODYCQRSV-GFCCVEGCSA-N 2 0 236.384 2.288 20 0 BEADRP CCC[C@H](C)C[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000666952367 487914340 /nfs/dbraw/zinc/91/43/40/487914340.db2.gz SYSWMWKGCIKWRM-RYUDHWBXSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1CCCC[C@H]1[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000666954054 487915882 /nfs/dbraw/zinc/91/58/82/487915882.db2.gz ONZUDKWXBNDKJD-JHJVBQTASA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCCC[NH2+]C1)C(C)(C)C ZINC000666993002 487923589 /nfs/dbraw/zinc/92/35/89/487923589.db2.gz UHBUHGDJSUZWQO-NEPJUHHUSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H](CC1CC1)[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000666995393 487924523 /nfs/dbraw/zinc/92/45/23/487924523.db2.gz MTKUJDDFJCPDBK-DGCLKSJQSA-N 2 0 222.376 2.439 20 0 BEADRP C[C@@H]1CCC[C@H]1[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000666995573 487924579 /nfs/dbraw/zinc/92/45/79/487924579.db2.gz SHPPVWJEGYJTOH-JHJVBQTASA-N 2 0 222.376 2.439 20 0 BEADRP CC[C@H](C)C[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000666995621 487924670 /nfs/dbraw/zinc/92/46/70/487924670.db2.gz UJYWVKGVSCKPLI-NWDGAFQWSA-N 2 0 210.365 2.297 20 0 BEADRP C1CC2(C1)C[C@@H]([NH2+][C@@H]1CCCSC1)CC[NH2+]2 ZINC000666995663 487925176 /nfs/dbraw/zinc/92/51/76/487925176.db2.gz VPUHEODVETWDBB-NWDGAFQWSA-N 2 0 240.416 2.146 20 0 BEADRP C[C@@H]1C[C@@H](C[N@@H+]2CC[C@@H](C3CCC3)C2)CC[NH2+]1 ZINC000667060773 487935413 /nfs/dbraw/zinc/93/54/13/487935413.db2.gz YGSUZTHQOJNHTM-VNHYZAJKSA-N 2 0 236.403 2.497 20 0 BEADRP CC(C)C[C@H]([NH3+])C[N@@H+]1CC[C@H](C2CCC2)C1 ZINC000667060727 487935822 /nfs/dbraw/zinc/93/58/22/487935822.db2.gz HZIYSMVTKOUQFW-KBPBESRZSA-N 2 0 224.392 2.482 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H]1CC(C)(C)C[C@@H]1C ZINC000569566731 322970371 /nfs/dbraw/zinc/97/03/71/322970371.db2.gz YCRKMSKFPDCVOF-RYUDHWBXSA-N 2 0 212.381 2.400 20 0 BEADRP CCC[C@H](C)[N@@H+]1CC[C@H](c2nccn2C)C1 ZINC000564736285 323014360 /nfs/dbraw/zinc/01/43/60/323014360.db2.gz NQRFKYRAPDDCRK-RYUDHWBXSA-N 2 0 221.348 2.398 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CC[C@@H]2C[C@@H]2C1)[C@@H]1CCC[NH2+]1 ZINC000403479373 323030815 /nfs/dbraw/zinc/03/08/15/323030815.db2.gz RGDGSGAFINLVGS-ZSLBOAEBSA-N 2 0 222.376 2.153 20 0 BEADRP CCC([NH3+])(CC)C[NH2+][C@H]1CCC12CCOCC2 ZINC000562955748 323034832 /nfs/dbraw/zinc/03/48/32/323034832.db2.gz KMSQQBUOVBVNOA-LBPRGKRZSA-N 2 0 240.391 2.053 20 0 BEADRP CCC(C)(C)[C@@H](C)[NH2+]C[C@H](C)C[NH2+]C ZINC000562956121 323034983 /nfs/dbraw/zinc/03/49/83/323034983.db2.gz GUHFQKHMQXIKHB-GHMZBOCLSA-N 2 0 200.370 2.256 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H](C)Cc1ccsc1 ZINC000570183452 323052075 /nfs/dbraw/zinc/05/20/75/323052075.db2.gz KJLVMLCYTRRWHO-GHMZBOCLSA-N 2 0 226.389 2.124 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H](C)Cc1ccsc1 ZINC000570183454 323052140 /nfs/dbraw/zinc/05/21/40/323052140.db2.gz KJLVMLCYTRRWHO-QWRGUYRKSA-N 2 0 226.389 2.124 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCCC2(F)F)CC[N@@H+]1C ZINC000394491619 323055439 /nfs/dbraw/zinc/05/54/39/323055439.db2.gz CPDFKCAMEVZNRW-WOPDTQHZSA-N 2 0 246.345 2.494 20 0 BEADRP C[N@@H+](C/C=C\c1ccc(F)cc1)CCC[NH3+] ZINC000570450523 323059933 /nfs/dbraw/zinc/05/99/33/323059933.db2.gz IFWNLIMTPBSCST-RQOWECAXSA-N 2 0 222.307 2.120 20 0 BEADRP COc1cc(C)ccc1[C@H](C)[NH2+]C[C@@H](C)C[NH3+] ZINC000570561978 323063099 /nfs/dbraw/zinc/06/30/99/323063099.db2.gz CDDBNDMLUBFNOD-RYUDHWBXSA-N 2 0 236.359 2.249 20 0 BEADRP CC(C)[C@@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)C1CC1 ZINC000570562621 323063192 /nfs/dbraw/zinc/06/31/92/323063192.db2.gz HYLGVVWJPCIRHO-KGLIPLIRSA-N 2 0 224.392 2.400 20 0 BEADRP Cc1ncc(C[NH2+]C[C@H]2CCCCS2)n1C ZINC000570582598 323063943 /nfs/dbraw/zinc/06/39/43/323063943.db2.gz BBWBEUAUYDFXLE-GFCCVEGCSA-N 2 0 239.388 2.104 20 0 BEADRP CO[C@H](C[NH2+][C@H]1CCC[C@H]([NH3+])C1)c1ccccc1 ZINC000570815678 323071465 /nfs/dbraw/zinc/07/14/65/323071465.db2.gz CZRAQCQUOVNNMP-SOUVJXGZSA-N 2 0 248.370 2.234 20 0 BEADRP Cc1ccc(C[NH2+][C@H](C)CCCC[NH3+])nc1C ZINC000314200225 323080662 /nfs/dbraw/zinc/08/06/62/323080662.db2.gz RBOLJJIDCORJLV-GFCCVEGCSA-N 2 0 235.375 2.306 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[N@@H+]1CC[C@@H]2C[NH2+]C[C@@H]21 ZINC000394824371 323085694 /nfs/dbraw/zinc/08/56/94/323085694.db2.gz JEDMBDYJGQQACR-SYQHCUMBSA-N 2 0 222.376 2.106 20 0 BEADRP C[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1)C1(C)CC1 ZINC000563154328 323095681 /nfs/dbraw/zinc/09/56/81/323095681.db2.gz XAJLLXZSTKIZDA-LLVKDONJSA-N 2 0 218.344 2.424 20 0 BEADRP C[C@@H](C[NH2+][C@H]1CCC[C@H]2C[C@H]21)C[NH+]1CCCC1 ZINC000408510381 323120506 /nfs/dbraw/zinc/12/05/06/323120506.db2.gz NFIWDWRFZSIXOJ-XQLPTFJDSA-N 2 0 236.403 2.497 20 0 BEADRP C([NH2+][C@H]1CCC[C@H]2C[C@H]21)[C@H]1CC[N@@H+](C2CC2)C1 ZINC000408510477 323120582 /nfs/dbraw/zinc/12/05/82/323120582.db2.gz PVMWLGVKMFPXLZ-OSRDXIQISA-N 2 0 234.387 2.249 20 0 BEADRP Nc1ccc2c(c1)CC[C@@H]2[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000563430468 323125091 /nfs/dbraw/zinc/12/50/91/323125091.db2.gz CKHSPLSZLODUBH-LNSITVRQSA-N 2 0 245.370 2.116 20 0 BEADRP Nc1ccc2c(c1)CC[C@@H]2[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000563430469 323125094 /nfs/dbraw/zinc/12/50/94/323125094.db2.gz CKHSPLSZLODUBH-WHOFXGATSA-N 2 0 245.370 2.116 20 0 BEADRP Cc1cc(C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)cc(C)n1 ZINC000571462087 323145471 /nfs/dbraw/zinc/14/54/71/323145471.db2.gz PIBSKGOGBVGHSO-KGLIPLIRSA-N 2 0 233.359 2.058 20 0 BEADRP Cc1ccc(C[NH2+]CC[C@H]2CC[NH2+]C2)cc1 ZINC000258650556 323146565 /nfs/dbraw/zinc/14/65/65/323146565.db2.gz FWZZRRZTYXGGSG-AWEZNQCLSA-N 2 0 218.344 2.084 20 0 BEADRP COc1ccc(C[NH2+]C[C@@]2(C)CCC[NH2+]C2)cc1 ZINC000414900708 323151894 /nfs/dbraw/zinc/15/18/94/323151894.db2.gz IMMXPBQMENLJDS-HNNXBMFYSA-N 2 0 248.370 2.175 20 0 BEADRP C(CN1CCCCC1)[NH2+]C(C1CC1)C1CC1 ZINC000049574544 323162288 /nfs/dbraw/zinc/16/22/88/323162288.db2.gz QNNKYOKQKLXCTA-UHFFFAOYSA-N 2 0 222.376 2.251 20 0 BEADRP CSCC[NH+]1CCC(C[N@H+](C)C(C)C)CC1 ZINC000535566780 323185823 /nfs/dbraw/zinc/18/58/23/323185823.db2.gz KCIKXAISTUKOAP-UHFFFAOYSA-N 2 0 244.448 2.402 20 0 BEADRP C[C@H](O)C[C@H](C)C[NH2+][C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000398578335 323186771 /nfs/dbraw/zinc/18/67/71/323186771.db2.gz LAPFPTIBGQDUBM-GVARAGBVSA-N 2 0 248.370 2.128 20 0 BEADRP CCC[C@H](C[NH2+][C@@H]1CCC[C@H]([NH3+])C1)OCC ZINC000530214339 323216470 /nfs/dbraw/zinc/21/64/70/323216470.db2.gz XXNLDLBVCMBSHV-YNEHKIRRSA-N 2 0 228.380 2.051 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[NH2+]C12CCC2)C1CCC1 ZINC000530213642 323216803 /nfs/dbraw/zinc/21/68/03/323216803.db2.gz BDLUIHJXGPSYNB-QWHCGFSZSA-N 2 0 222.376 2.439 20 0 BEADRP C1CC1[C@@H]([NH2+][C@@H]1CC[NH2+]C12CCC2)C1CCC1 ZINC000530214821 323216837 /nfs/dbraw/zinc/21/68/37/323216837.db2.gz CYWFIGSNQIGHJP-KGLIPLIRSA-N 2 0 234.387 2.439 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]CC[C@H]1CC=CCC1 ZINC000530217072 323217158 /nfs/dbraw/zinc/21/71/58/323217158.db2.gz FCFVPJNMQIDJIK-IHRRRGAJSA-N 2 0 222.376 2.450 20 0 BEADRP CC1(C)CC(C[N@@H+]2CCC[C@@H](CC[NH3+])C2)C1 ZINC000530220380 323217903 /nfs/dbraw/zinc/21/79/03/323217903.db2.gz UFQKVZDSVKZGRB-LBPRGKRZSA-N 2 0 224.392 2.483 20 0 BEADRP C[C@@H]1CCNC[C@@H]1[NH2+]CC[C@H]1CC=CCC1 ZINC000530221848 323218618 /nfs/dbraw/zinc/21/86/18/323218618.db2.gz YPLWBVOGJIRORB-RDBSUJKOSA-N 2 0 222.376 2.320 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@H](C1CC1)C1CCC1 ZINC000324701764 323263253 /nfs/dbraw/zinc/26/32/53/323263253.db2.gz YLQIRYMELFLMQJ-GWCFXTLKSA-N 2 0 210.365 2.282 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H]2CC[N@@H+](C)C[C@H]2C)o1 ZINC000532450361 323265381 /nfs/dbraw/zinc/26/53/81/323265381.db2.gz CVFGAVALJIIATO-BXUZGUMPSA-N 2 0 236.359 2.060 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1CCC[NH2+]C1)C1CCC1 ZINC000324921615 323304114 /nfs/dbraw/zinc/30/41/14/323304114.db2.gz LLTHUWYZQWHDTO-YPMHNXCESA-N 2 0 210.365 2.154 20 0 BEADRP CC[C@H]([NH2+]C[C@H]1CCC[NH2+]C1)C1CCC1 ZINC000324921612 323304125 /nfs/dbraw/zinc/30/41/25/323304125.db2.gz LLTHUWYZQWHDTO-AAEUAGOBSA-N 2 0 210.365 2.154 20 0 BEADRP CC[C@@H]([NH2+]C[C@H]1CCC[NH2+]C1)C1CCC1 ZINC000324921614 323304244 /nfs/dbraw/zinc/30/42/44/323304244.db2.gz LLTHUWYZQWHDTO-WCQYABFASA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]([NH2+]CCC1CC[NH+](C)CC1)[C@@H]1C[C@H]1C ZINC000321569514 323385334 /nfs/dbraw/zinc/38/53/34/323385334.db2.gz UPNJEFOVKYHMNZ-YRGRVCCFSA-N 2 0 224.392 2.352 20 0 BEADRP COc1ccc(C2CC[NH+](CCC[NH3+])CC2)cc1 ZINC000057537241 323927385 /nfs/dbraw/zinc/92/73/85/323927385.db2.gz CGYYKBDNCDONIE-UHFFFAOYSA-N 2 0 248.370 2.223 20 0 BEADRP C[NH+]1CCC(CC[NH2+][C@@H]2CCCSC2)CC1 ZINC000122415863 324044410 /nfs/dbraw/zinc/04/44/10/324044410.db2.gz BLRQBXVSEBZRGC-CYBMUJFWSA-N 2 0 242.432 2.204 20 0 BEADRP FCCC[NH2+][C@@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1 ZINC000304297948 324199528 /nfs/dbraw/zinc/19/95/28/324199528.db2.gz ZXUDQOOKNJUUQR-YNEHKIRRSA-N 2 0 228.355 2.246 20 0 BEADRP CC1(C)CC[C@@H]([NH2+]CC[C@H]2CCC[NH2+]2)C1 ZINC000129536076 324957964 /nfs/dbraw/zinc/95/79/64/324957964.db2.gz HWWTUAUDBQDKLB-VXGBXAGGSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H](CN(C)C)[NH2+][C@@H]1C[C@H](C)CC[C@H]1C ZINC000130080743 325010970 /nfs/dbraw/zinc/01/09/70/325010970.db2.gz VDAZLOCDTKUSLT-FVCCEPFGSA-N 2 0 212.381 2.351 20 0 BEADRP CC[C@@H](COC)[NH2+]C1CC[NH+](CC(C)C)CC1 ZINC000131229589 325127493 /nfs/dbraw/zinc/12/74/93/325127493.db2.gz ALFCFZCVQAYHNG-ZDUSSCGKSA-N 2 0 242.407 2.121 20 0 BEADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+][C@@H]2CSC[C@H]2C)C1 ZINC000304365264 325145730 /nfs/dbraw/zinc/14/57/30/325145730.db2.gz FFYHAEMWNOEDRZ-FRRDWIJNSA-N 2 0 242.432 2.058 20 0 BEADRP CCSCC[C@H](C)[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000133751354 325315946 /nfs/dbraw/zinc/31/59/46/325315946.db2.gz MNLBAAQZLANUKR-SDDRHHMPSA-N 2 0 230.421 2.378 20 0 BEADRP CC[NH+]1CCC([NH2+]CC(C2CC2)C2CC2)CC1 ZINC000088455230 325658641 /nfs/dbraw/zinc/65/86/41/325658641.db2.gz JRKRIKWAQKBGOZ-UHFFFAOYSA-N 2 0 236.403 2.497 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H]1CCC[C@H](C)[C@@H]1C ZINC000566087902 325991514 /nfs/dbraw/zinc/99/15/14/325991514.db2.gz BVLZTMQSMZWHCK-RWMBFGLXSA-N 2 0 212.381 2.400 20 0 BEADRP Cc1cccnc1CCC[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000566985645 326100236 /nfs/dbraw/zinc/10/02/36/326100236.db2.gz RZQQOUHDJQAYKQ-KGLIPLIRSA-N 2 0 247.386 2.182 20 0 BEADRP Cc1cccnc1CCC[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000566985644 326100352 /nfs/dbraw/zinc/10/03/52/326100352.db2.gz RZQQOUHDJQAYKQ-KBPBESRZSA-N 2 0 247.386 2.182 20 0 BEADRP CCc1ccc(C[NH2+][C@@H](C)C[C@H](C)[NH3+])cc1 ZINC000567041237 326105232 /nfs/dbraw/zinc/10/52/32/326105232.db2.gz FZVOZVSGGIIDSC-RYUDHWBXSA-N 2 0 220.360 2.464 20 0 BEADRP CC1(C)CC(C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000567462601 326197536 /nfs/dbraw/zinc/19/75/36/326197536.db2.gz STWWWGOVHPNEFR-FUNVUKJBSA-N 2 0 222.376 2.295 20 0 BEADRP COC[C@@H](CC(C)C)[NH2+]CCC[NH2+]C(C)C ZINC000567490169 326203907 /nfs/dbraw/zinc/20/39/07/326203907.db2.gz XCCYQIAQUTZIRV-CYBMUJFWSA-N 2 0 230.396 2.025 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+][C@H](C)C[C@@H](C)[NH3+])CO2 ZINC000567648431 326238777 /nfs/dbraw/zinc/23/87/77/326238777.db2.gz QJVJSFRGARDJIB-NQBHXWOUSA-N 2 0 234.343 2.144 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H]2CCCC[C@H]2C[NH3+])cn1 ZINC000567889956 326276981 /nfs/dbraw/zinc/27/69/81/326276981.db2.gz OPVDTGUHLRFPOT-LSDHHAIUSA-N 2 0 247.386 2.040 20 0 BEADRP C[C@@H](C[NH2+][C@H]1CCCC12CC2)C[NH+](C)C ZINC000568277318 326340108 /nfs/dbraw/zinc/34/01/08/326340108.db2.gz VNFQAFWJGBKORS-RYUDHWBXSA-N 2 0 210.365 2.106 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@@H]2CC[C@H]2C2CC2)CC1 ZINC000568310741 326343988 /nfs/dbraw/zinc/34/39/88/326343988.db2.gz QEJZIFAOQFGQQD-LSDHHAIUSA-N 2 0 236.403 2.497 20 0 BEADRP CC/C=C/C[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000569069768 326388551 /nfs/dbraw/zinc/38/85/51/326388551.db2.gz QDIKEORQSDEFQD-ONEGZZNKSA-N 2 0 222.376 2.417 20 0 BEADRP CC[C@H]1C[C@H](C[N@H+](C)CCC[NH+](C)C)CCO1 ZINC000569290963 326398964 /nfs/dbraw/zinc/39/89/64/326398964.db2.gz OEGNOKNKBPXYDT-KGLIPLIRSA-N 2 0 242.407 2.075 20 0 BEADRP C([NH2+][C@@H](C1CC1)C1CCC1)C1CC[NH2+]CC1 ZINC000324787173 326418857 /nfs/dbraw/zinc/41/88/57/326418857.db2.gz IOCPDSKGXAGESK-CQSZACIVSA-N 2 0 222.376 2.154 20 0 BEADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@H](CC)C(C)C ZINC000166017129 326427617 /nfs/dbraw/zinc/42/76/17/326427617.db2.gz YQDGLPSQOUULMJ-ZIAGYGMSSA-N 2 0 244.423 2.367 20 0 BEADRP C[C@H]1CCC[C@H]([NH2+]CCOCC[NH+](C)C)CC1 ZINC000235582243 487987384 /nfs/dbraw/zinc/98/73/84/487987384.db2.gz ZEQBXCGKKDZRQM-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP CC[C@H](c1ccccc1)N1CCO[C@H]([C@@H](C)[NH3+])C1 ZINC000123783796 488011249 /nfs/dbraw/zinc/01/12/49/488011249.db2.gz XQGBSLOOFXNPKR-YUELXQCFSA-N 2 0 248.370 2.186 20 0 BEADRP CC(C)=CCC[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000400962597 488012218 /nfs/dbraw/zinc/01/22/18/488012218.db2.gz AZVQTONEWKUFIA-BFHYXJOUSA-N 2 0 222.376 2.320 20 0 BEADRP C[C@H]([NH2+]CC1=CCCC1)C1CC[NH+](C)CC1 ZINC000401179612 488017880 /nfs/dbraw/zinc/01/78/80/488017880.db2.gz TWNSOQLBSFLXJC-LBPRGKRZSA-N 2 0 222.376 2.417 20 0 BEADRP C[C@@H]1C[C@@H]([NH3+])CC[N@@H+]1CCOCc1ccccc1 ZINC000309705105 488034433 /nfs/dbraw/zinc/03/44/33/488034433.db2.gz HLCFKZKLZJRKSF-HIFRSBDPSA-N 2 0 248.370 2.015 20 0 BEADRP C[C@@H]1C[C@H]([NH3+])CC[N@@H+]1CCOCc1ccccc1 ZINC000309705107 488034615 /nfs/dbraw/zinc/03/46/15/488034615.db2.gz HLCFKZKLZJRKSF-UKRRQHHQSA-N 2 0 248.370 2.015 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CCCC[C@H]2C[NH3+])o1 ZINC000084216720 488037806 /nfs/dbraw/zinc/03/78/06/488037806.db2.gz HGWHQHJMYNQJCY-AAEUAGOBSA-N 2 0 222.332 2.195 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]CC23CC(C2)C[NH2+]3)[C@@H]1C ZINC000663497081 488045769 /nfs/dbraw/zinc/04/57/69/488045769.db2.gz BDMVKBJVQPCNAQ-WCCYQHBJSA-N 2 0 222.376 2.153 20 0 BEADRP C[N@@H+]1CC[C@H](NCc2cccnc2)CC1(C)C ZINC000084519282 488056797 /nfs/dbraw/zinc/05/67/97/488056797.db2.gz XWNFUGRHEFRBMB-ZDUSSCGKSA-N 2 0 233.359 2.044 20 0 BEADRP Cc1ncc(C[N@@H+]2CC[C@H](c3ccco3)C2)n1C ZINC000667618668 488060829 /nfs/dbraw/zinc/06/08/29/488060829.db2.gz DZSCSEKVZJPCCV-LBPRGKRZSA-N 2 0 245.326 2.311 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@H]2CCC[C@H]2C[NH3+])C1 ZINC000251975511 488066329 /nfs/dbraw/zinc/06/63/29/488066329.db2.gz YJQHBJYHXIZKCU-VOAKCMCISA-N 2 0 210.365 2.282 20 0 BEADRP Cc1cnc(CC[NH2+][C@H](C)CCCC[NH3+])c(C)c1 ZINC000656200768 488066502 /nfs/dbraw/zinc/06/65/02/488066502.db2.gz QDMOZYCHMNZUBI-CQSZACIVSA-N 2 0 249.402 2.348 20 0 BEADRP C[C@H]1C[C@H](C)[N@H+](Cc2cnc3n2CCC3)C1 ZINC000667664538 488079585 /nfs/dbraw/zinc/07/95/85/488079585.db2.gz NLPVPLZAWZTGIK-QWRGUYRKSA-N 2 0 219.332 2.060 20 0 BEADRP Cc1ccc([C@@H]2CC[N@H+](CCC[NH3+])C2)cc1 ZINC000516423696 488098883 /nfs/dbraw/zinc/09/88/83/488098883.db2.gz QSLODHHDXYJZNA-CQSZACIVSA-N 2 0 218.344 2.133 20 0 BEADRP C([NH2+][C@@H]1CCC[C@@H]2C[C@@H]21)[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000378890528 488110146 /nfs/dbraw/zinc/11/01/46/488110146.db2.gz PVMWLGVKMFPXLZ-MYZSUADSSA-N 2 0 234.387 2.249 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCC[C@@H]2C[C@@H]21)C[NH+]1CCCC1 ZINC000378957351 488113974 /nfs/dbraw/zinc/11/39/74/488113974.db2.gz NFIWDWRFZSIXOJ-KBXIAJHMSA-N 2 0 236.403 2.497 20 0 BEADRP C1[C@@H]([NH2+]C2CCCCCC2)C12CC[NH2+]CC2 ZINC000389823002 488114702 /nfs/dbraw/zinc/11/47/02/488114702.db2.gz QZFYYYSXJRFDNT-CYBMUJFWSA-N 2 0 222.376 2.441 20 0 BEADRP CCC[C@H](CC)[NH2+]Cc1cnc2n1CCC2 ZINC000657348918 488116035 /nfs/dbraw/zinc/11/60/35/488116035.db2.gz LXTXETBYNNXFTJ-NSHDSACASA-N 2 0 221.348 2.498 20 0 BEADRP CC[NH+](CC)CCC[N@H+](CCO)CC(C)(C)C ZINC000683141221 488117977 /nfs/dbraw/zinc/11/79/77/488117977.db2.gz QLIZSEBEYNLZGO-UHFFFAOYSA-N 2 0 244.423 2.059 20 0 BEADRP CC(C)C[C@@H]([NH3+])C(=O)Nc1ccc([C@@H](C)[NH3+])cc1 ZINC000669512428 488118912 /nfs/dbraw/zinc/11/89/12/488118912.db2.gz SGGWSVGFBJVDFK-ZWNOBZJWSA-N 2 0 249.358 2.018 20 0 BEADRP C[N@H+](C[C@@H]1CC[C@@H]2C[C@@H]2C1)CC(C)(C)C[NH3+] ZINC000403234989 488119105 /nfs/dbraw/zinc/11/91/05/488119105.db2.gz AVFYXKZWXKDTTI-UPJWGTAASA-N 2 0 224.392 2.339 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H]2CC[C@H]3C[C@H]3C2)C1 ZINC000403592339 488128209 /nfs/dbraw/zinc/12/82/09/488128209.db2.gz DLLRZCZSIVOGNU-IEECTRCBSA-N 2 0 208.349 2.035 20 0 BEADRP CC[N@@H+]1CCC[C@@H](C[NH2+][C@H]2CCC[C@@H]3C[C@@H]32)C1 ZINC000667820182 488128556 /nfs/dbraw/zinc/12/85/56/488128556.db2.gz RJOHMYOFTQJNCL-XGUBFFRZSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H]([NH3+])C1CC[NH+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC000403690935 488132435 /nfs/dbraw/zinc/13/24/35/488132435.db2.gz YRYWONFGFQZXFK-MXYBEHONSA-N 2 0 236.403 2.482 20 0 BEADRP C[NH2+]C[C@@H]1CCC[N@H+](C[C@@H]2CC[C@H]3C[C@H]3C2)C1 ZINC000403721645 488133896 /nfs/dbraw/zinc/13/38/96/488133896.db2.gz IDEXMOFOEYCDLJ-CBBWQLFWSA-N 2 0 236.403 2.354 20 0 BEADRP C(C1CCC1)[N@@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000662292370 487541587 /nfs/dbraw/zinc/54/15/87/487541587.db2.gz FBHKPHLBJGEQTB-HNNXBMFYSA-N 2 0 236.403 2.498 20 0 BEADRP C[N@H+](CCC[NH3+])C[C@@H]1CCCCC1(C)C ZINC000382065922 487530634 /nfs/dbraw/zinc/53/06/34/487530634.db2.gz QCMMLPJBFODWQS-LBPRGKRZSA-N 2 0 212.381 2.483 20 0 BEADRP CC(C)(CC[NH+]1CCC([NH3+])CC1)C1CC1 ZINC000392794687 487555356 /nfs/dbraw/zinc/55/53/56/487555356.db2.gz KDXBFHAJYKLUBX-UHFFFAOYSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]C[C@@H](C)C(C)(C)C ZINC000379505406 488140511 /nfs/dbraw/zinc/14/05/11/488140511.db2.gz OHSDEIMVTWBVGW-GHMZBOCLSA-N 2 0 200.370 2.386 20 0 BEADRP C[N@H+](CCCC1CCC1)C1CC[NH2+]CC1 ZINC000662236614 487470776 /nfs/dbraw/zinc/47/07/76/487470776.db2.gz FZELMEXKVMUOJL-UHFFFAOYSA-N 2 0 210.365 2.251 20 0 BEADRP [NH3+]C[C@]12CCC[C@H]1C[N@H+](CCCCCF)C2 ZINC000381102541 487497250 /nfs/dbraw/zinc/49/72/50/487497250.db2.gz YBBOHAPFAPFGIK-STQMWFEESA-N 2 0 228.355 2.187 20 0 BEADRP C(CC1CC1)[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000086494534 487512379 /nfs/dbraw/zinc/51/23/79/487512379.db2.gz NHIDYHLFFLFSTE-MCIONIFRSA-N 2 0 222.376 2.297 20 0 BEADRP CO[C@@H](C[NH2+][C@H](C)CC[NH+](C)C)C1CCCC1 ZINC000668710285 488151918 /nfs/dbraw/zinc/15/19/18/488151918.db2.gz JEWNGOWVOYNYNQ-OCCSQVGLSA-N 2 0 242.407 2.121 20 0 BEADRP CC[C@@H](C[NH+]1CCCC1)Nc1cc[nH+]c(C)c1 ZINC000681386520 487789912 /nfs/dbraw/zinc/78/99/12/487789912.db2.gz YLWKGOCGZMJSNC-ZDUSSCGKSA-N 2 0 233.359 2.098 20 0 BEADRP C[C@]1(C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)CCCS1 ZINC000227390396 487836450 /nfs/dbraw/zinc/83/64/50/487836450.db2.gz HHTPGKQKZZHSGK-GRYCIOLGSA-N 2 0 228.405 2.132 20 0 BEADRP CC1(C)CCCC[C@H]1[NH2+]CC12CC(C1)C[NH2+]2 ZINC000663499001 488047822 /nfs/dbraw/zinc/04/78/22/488047822.db2.gz UAWCEIQBMPTCED-MBHSVXNSSA-N 2 0 222.376 2.297 20 0 BEADRP Cc1ccc(C[NH2+]CCC[C@H]2CCC[NH2+]2)cn1 ZINC000414960974 488083977 /nfs/dbraw/zinc/08/39/77/488083977.db2.gz BACCTCASJVUZBH-AWEZNQCLSA-N 2 0 233.359 2.012 20 0 BEADRP C([C@@H]1CC[C@@H]2C[C@@H]2C1)[N@H+]1CC[C@H]2C[NH2+]C[C@H]2CC1 ZINC000403752746 488136471 /nfs/dbraw/zinc/13/64/71/488136471.db2.gz PHIPXINHUVOMDZ-SUJAAXHWSA-N 2 0 248.414 2.354 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@H]([NH3+])C1)c1cccc(O)c1 ZINC000093214302 488139209 /nfs/dbraw/zinc/13/92/09/488139209.db2.gz BMXILSSBTGFDMS-DRZSPHRISA-N 2 0 234.343 2.313 20 0 BEADRP CO[C@@H](C[NH2+][C@@H](C)CC[NH+](C)C)C1CCCC1 ZINC000668710284 488152005 /nfs/dbraw/zinc/15/20/05/488152005.db2.gz JEWNGOWVOYNYNQ-JSGCOSHPSA-N 2 0 242.407 2.121 20 0 BEADRP C[N@H+](Cc1cccc2c1CC[NH2+]C2)C1CCC1 ZINC000143855647 488176681 /nfs/dbraw/zinc/17/66/81/488176681.db2.gz QZXXOIOZGOLROP-UHFFFAOYSA-N 2 0 230.355 2.317 20 0 BEADRP Cc1ncc(C[N@@H+]2CCCC3(CC3)C2)n1C ZINC000667998839 488179565 /nfs/dbraw/zinc/17/95/65/488179565.db2.gz KVNTVGSNXDLYNX-UHFFFAOYSA-N 2 0 219.332 2.105 20 0 BEADRP CC[C@H](C[NH+]1C[C@@H]2C[NH2+]C[C@H]2C1)c1ccccc1 ZINC000678342755 488243491 /nfs/dbraw/zinc/24/34/91/488243491.db2.gz GQUGJXMIQJGODG-KBMXLJTQSA-N 2 0 244.382 2.331 20 0 BEADRP CC(C)(C[NH+]1C[C@H]2C[NH2+]C[C@@H]2C1)c1ccccc1 ZINC000678844138 488290353 /nfs/dbraw/zinc/29/03/53/488290353.db2.gz VMMYBKDQLXDCAU-ZIAGYGMSSA-N 2 0 244.382 2.115 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH+](CC)CC ZINC000077951822 490122066 /nfs/dbraw/zinc/12/20/66/490122066.db2.gz XMBQTWCKXSGBGX-LBPRGKRZSA-N 2 0 200.370 2.449 20 0 BEADRP CC1(C)CC[C@@H]([NH2+]CC2([NH3+])CCCC2)C1 ZINC000129559274 490151329 /nfs/dbraw/zinc/15/13/29/490151329.db2.gz BNAILAAWBGMZGM-LLVKDONJSA-N 2 0 210.365 2.426 20 0 BEADRP CC(C)[NH2+][C@@H]1CCCN(CC[C@@H]2CCCO2)C1 ZINC000071201118 490258916 /nfs/dbraw/zinc/25/89/16/490258916.db2.gz TZJBPERYLMSXRB-KGLIPLIRSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@@H]1CCCCC[C@@H]1[NH2+]CCC[NH+](C)C ZINC000125021203 490410889 /nfs/dbraw/zinc/41/08/89/490410889.db2.gz JVQJLNKFOZZONR-OLZOCXBDSA-N 2 0 212.381 2.497 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H]1CCC[N@H+](CC)C1)C1CC1 ZINC000121862394 490481094 /nfs/dbraw/zinc/48/10/94/490481094.db2.gz AYNYFHNCHHIAKD-GXTWGEPZSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)(C)CC[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000400945304 491069115 /nfs/dbraw/zinc/06/91/15/491069115.db2.gz FIKGGUGATGOVSI-FRRDWIJNSA-N 2 0 224.392 2.400 20 0 BEADRP C([C@@H]1C[C@H]2C[C@H]2C1)[N@@H+]1CCCC[C@H]1[C@H]1CC[NH2+]C1 ZINC000662275368 491085703 /nfs/dbraw/zinc/08/57/03/491085703.db2.gz BIORHJFHZDXEDQ-QMHWVQJVSA-N 2 0 248.414 2.497 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CCSC1)C1CC[NH+](C)CC1 ZINC000228552534 491095567 /nfs/dbraw/zinc/09/55/67/491095567.db2.gz VBXBIPPJPXSPMY-VXGBXAGGSA-N 2 0 242.432 2.059 20 0 BEADRP CCC[N@H+](C)C[C@H]1CC[NH+]([C@@H](C)CCOC)C1 ZINC000088536780 491104705 /nfs/dbraw/zinc/10/47/05/491104705.db2.gz KYWFGCUGDAUKAW-UONOGXRCSA-N 2 0 242.407 2.075 20 0 BEADRP CCC[N@H+](C)C[C@@H]1CC[NH+]([C@@H](C)CCOC)C1 ZINC000088536779 491104865 /nfs/dbraw/zinc/10/48/65/491104865.db2.gz KYWFGCUGDAUKAW-KBPBESRZSA-N 2 0 242.407 2.075 20 0 BEADRP C[C@H]1CCC[N@@H+]1Cc1ccnn1-c1cc[nH+]cc1 ZINC000667619143 491110134 /nfs/dbraw/zinc/11/01/34/491110134.db2.gz UEXPODYLJXMFAO-LBPRGKRZSA-N 2 0 242.326 2.252 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+]C/C=C/c1ccncc1 ZINC000486964948 533892616 /nfs/dbraw/zinc/89/26/16/533892616.db2.gz IZEYAURUUHORTE-MUBLQREKSA-N 2 0 233.359 2.025 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CC=CCC1)[C@@H]1CCC[NH2+]1 ZINC000400386906 533905626 /nfs/dbraw/zinc/90/56/26/533905626.db2.gz MCRKSBSPNHELHB-AVGNSLFASA-N 2 0 208.349 2.073 20 0 BEADRP CCC[C@H](C)C[N@@H+]1CC[C@@H](C)[C@H](C[NH3+])C1 ZINC000253226533 535612598 /nfs/dbraw/zinc/61/25/98/535612598.db2.gz JFLMCKHONSKUBU-YNEHKIRRSA-N 2 0 212.381 2.339 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+][C@H](C)[C@H]1CCC[NH2+]1 ZINC000400364952 534001601 /nfs/dbraw/zinc/00/16/01/534001601.db2.gz DRRIMISLMSPQNS-YRGRVCCFSA-N 2 0 236.359 2.331 20 0 BEADRP CCc1ccc(C[N@@H+]2CC[C@@H]3C[NH2+]C[C@@H]3C2)cc1 ZINC000261561597 536178922 /nfs/dbraw/zinc/17/89/22/536178922.db2.gz FZSFWDYBRZCXMJ-HZPDHXFCSA-N 2 0 244.382 2.290 20 0 BEADRP C[NH2+][C@@H](C)CNc1cc[nH+]c2ccccc12 ZINC000261573803 536345013 /nfs/dbraw/zinc/34/50/13/536345013.db2.gz IZINWYXEFYETCC-JTQLQIEISA-N 2 0 215.300 2.255 20 0 BEADRP CC(C)(C)C[N@@H+]1C[C@@H]2CCC[C@H]([NH3+])[C@H]2C1 ZINC000252877790 534604880 /nfs/dbraw/zinc/60/48/80/534604880.db2.gz WWFMSKPLNWUSJC-SRVKXCTJSA-N 2 0 210.365 2.092 20 0 BEADRP CC(C)(C)C[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000252668353 534612225 /nfs/dbraw/zinc/61/22/25/534612225.db2.gz VJNQQHQMQXDHRS-RYUDHWBXSA-N 2 0 210.365 2.249 20 0 BEADRP C1[NH2+]C[C@H]2C[C@H]([NH2+]C3CCCCC3)CC[C@H]12 ZINC000401051227 526424292 /nfs/dbraw/zinc/42/42/92/526424292.db2.gz PKZYBDWFAYUMJF-YRGRVCCFSA-N 2 0 222.376 2.297 20 0 BEADRP C1[NH2+]C[C@H]2CC[C@@H]([NH2+]C3CCCCC3)C[C@@H]12 ZINC000401051225 526424499 /nfs/dbraw/zinc/42/44/99/526424499.db2.gz PKZYBDWFAYUMJF-MBNYWOFBSA-N 2 0 222.376 2.297 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@H]2CC[C@@H]2C2CC2)CC1 ZINC000309647850 582903609 /nfs/dbraw/zinc/90/36/09/582903609.db2.gz MWIVXDWDOWSNKM-KGLIPLIRSA-N 2 0 222.376 2.106 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@@H]2CC[C@H]2C2CC2)CC1 ZINC000309647851 582903611 /nfs/dbraw/zinc/90/36/11/582903611.db2.gz MWIVXDWDOWSNKM-UONOGXRCSA-N 2 0 222.376 2.106 20 0 BEADRP CC(C)[C@H]1CC[C@@H]1[NH2+][C@@H]1CCCC[C@H]1[NH3+] ZINC000424377708 527811520 /nfs/dbraw/zinc/81/15/20/527811520.db2.gz RPGOEUYSUWYVQF-FVCCEPFGSA-N 2 0 210.365 2.281 20 0 BEADRP CCCCC[N@H+]1CC[C@H]2C[NH2+]C[C@H]2CC1 ZINC000308893031 528186674 /nfs/dbraw/zinc/18/66/74/528186674.db2.gz XXYKWDYGTLNJTN-BETUJISGSA-N 2 0 210.365 2.108 20 0 BEADRP CCC[NH+]1CCC([N@H+](C)C[C@@H]2C[C@@H]2C)CC1 ZINC000488314553 528195740 /nfs/dbraw/zinc/19/57/40/528195740.db2.gz OJEKVDUNRGUADH-STQMWFEESA-N 2 0 224.392 2.449 20 0 BEADRP CC(C)C[C@H]([NH3+])C[N@@H+]1CC[C@@H](C2CC2)C1 ZINC000400006185 528553996 /nfs/dbraw/zinc/55/39/96/528553996.db2.gz RLKLPELXYBQTEU-OLZOCXBDSA-N 2 0 210.365 2.092 20 0 BEADRP CCC(CC)C[N@@H+]1C[C@@H](C)[C@](C)(C[NH3+])C1 ZINC000309036023 528753562 /nfs/dbraw/zinc/75/35/62/528753562.db2.gz GACAEMHCQMIQIR-DGCLKSJQSA-N 2 0 212.381 2.339 20 0 BEADRP CC(C)[C@H](C)[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000401141583 528972137 /nfs/dbraw/zinc/97/21/37/528972137.db2.gz GXMFZNZDBKDRQO-ZDEQEGDKSA-N 2 0 210.365 2.009 20 0 BEADRP CC(C)[NH+]1CCC([N@H+](C)C[C@H]2C[C@H]2C)CC1 ZINC000488354934 528990785 /nfs/dbraw/zinc/99/07/85/528990785.db2.gz WYFWKMZAESQJGI-CHWSQXEVSA-N 2 0 224.392 2.447 20 0 BEADRP CC[C@@H](C)[N@@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000302365365 529356477 /nfs/dbraw/zinc/35/64/77/529356477.db2.gz KKDAZURKEUHPEL-YUELXQCFSA-N 2 0 232.371 2.459 20 0 BEADRP CC(C)C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C)C1 ZINC000178627717 535134448 /nfs/dbraw/zinc/13/44/48/535134448.db2.gz TYFVEOHVWGMFQO-CHWSQXEVSA-N 2 0 210.365 2.059 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]C2CC(C)(F)C2)CC1 ZINC000335375304 535162335 /nfs/dbraw/zinc/16/23/35/535162335.db2.gz ZHRKWJIDJHFDNF-UHFFFAOYSA-N 2 0 228.355 2.339 20 0 BEADRP CCC[NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000335042672 535188196 /nfs/dbraw/zinc/18/81/96/535188196.db2.gz UHCRMSIDNWSARO-HIFRSBDPSA-N 2 0 246.354 2.242 20 0 BEADRP CCC1(C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)CCOCC1 ZINC000261560186 535297353 /nfs/dbraw/zinc/29/73/53/535297353.db2.gz UJEIPOZHPSIFEM-CHWSQXEVSA-N 2 0 240.391 2.053 20 0 BEADRP CC1(C)CC[C@H]([NH2+][C@H]2CCC[C@H]2C[NH3+])C1 ZINC000253234650 535328346 /nfs/dbraw/zinc/32/83/46/535328346.db2.gz DIFWHHWQDABYPI-SRVKXCTJSA-N 2 0 210.365 2.282 20 0 BEADRP CC[NH2+]CC1CC[NH+](CC2(C)CCC2)CC1 ZINC000261589039 535458230 /nfs/dbraw/zinc/45/82/30/535458230.db2.gz SVHFTPFMHJNYQN-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@]2(C)CCCS2)CC1 ZINC000087792670 535474012 /nfs/dbraw/zinc/47/40/12/535474012.db2.gz OBEIXEREEDVZEI-ZDUSSCGKSA-N 2 0 242.432 2.346 20 0 BEADRP CCC[C@H](O)C[NH2+][C@@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000253009825 535717383 /nfs/dbraw/zinc/71/73/83/535717383.db2.gz BAPHXZMXAWXCAQ-MJBXVCDLSA-N 2 0 242.407 2.048 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@@H]1CCC(C)(C)C1 ZINC000087771582 535831822 /nfs/dbraw/zinc/83/18/22/535831822.db2.gz MOSFSWGOHBVOEW-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP CC[C@]1(C)CC[N@H+](C[C@H]2CCC[NH2+]C2)C1 ZINC000261554801 535910668 /nfs/dbraw/zinc/91/06/68/535910668.db2.gz UPQHMGHJFJKKTG-QWHCGFSZSA-N 2 0 210.365 2.108 20 0 BEADRP CC[C@@]1(C)CC[N@H+](CC2CC[NH2+]CC2)C1 ZINC000261542676 536049092 /nfs/dbraw/zinc/04/90/92/536049092.db2.gz HDPHWVWEOUHSPO-ZDUSSCGKSA-N 2 0 210.365 2.108 20 0 BEADRP CC[C@H]1CCCC[C@@H]1[NH2+]CCOCC[NH+](C)C ZINC000219319149 536066764 /nfs/dbraw/zinc/06/67/64/536066764.db2.gz ADUSIJYVSWWVMT-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP CC[C@H](CSC)[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000252730747 536126554 /nfs/dbraw/zinc/12/65/54/536126554.db2.gz MRYSGFNAQBSGMJ-UPJWGTAASA-N 2 0 242.432 2.344 20 0 BEADRP COC1CCC([NH2+][C@@H]2CCCCC[C@H]2[NH3+])CC1 ZINC000335595778 536739903 /nfs/dbraw/zinc/73/99/03/536739903.db2.gz PBMPTNPPDIEIIE-NWINJMCUSA-N 2 0 240.391 2.194 20 0 BEADRP COc1cc(C[N@@H+]2CC[C@H]([NH3+])[C@H](C)C2)ccc1C ZINC000262016361 536770154 /nfs/dbraw/zinc/77/01/54/536770154.db2.gz VSZYROQXOODIGO-OCCSQVGLSA-N 2 0 248.370 2.173 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+]C[C@@H]1CCCC[C@@H]1C ZINC000234789026 536850947 /nfs/dbraw/zinc/85/09/47/536850947.db2.gz OCNSODWSZBUFNA-IHRRRGAJSA-N 2 0 242.407 2.156 20 0 BEADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1C[NH3+] ZINC000145838288 537825666 /nfs/dbraw/zinc/82/56/66/537825666.db2.gz WMERLLDQCPOUQM-TZMCWYRMSA-N 2 0 218.344 2.103 20 0 BEADRP CCOc1ccc(C[NH2+]CCCC[NH+](C)C)o1 ZINC000892739663 582974276 /nfs/dbraw/zinc/97/42/76/582974276.db2.gz GJCQZJFPAIFAJV-UHFFFAOYSA-N 2 0 240.347 2.110 20 0 BEADRP C[C@@H]1CC[C@H]1[NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000853240261 588728297 /nfs/dbraw/zinc/72/82/97/588728297.db2.gz OFXGKLOJWMOKPI-BPLDGKMQSA-N 2 0 236.403 2.497 20 0 BEADRP C[NH2+]C[C@@H](C)NCc1cc(C)c(OC)c(C)c1 ZINC000853250605 588729403 /nfs/dbraw/zinc/72/94/03/588729403.db2.gz UVDFUVJBFAMZHB-GFCCVEGCSA-N 2 0 236.359 2.010 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+][C@H]1CC[C@@H]1C1CC1 ZINC000854230549 588781120 /nfs/dbraw/zinc/78/11/20/588781120.db2.gz UGLFKWGYGXNSMS-UPJWGTAASA-N 2 0 210.365 2.138 20 0 BEADRP [NH3+]C1(C[NH2+][C@H]2CC[C@H]2C2CC2)CCCC1 ZINC000854224390 588780605 /nfs/dbraw/zinc/78/06/05/588780605.db2.gz VYRQZVXDYQGTIN-RYUDHWBXSA-N 2 0 208.349 2.036 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1C[C@H](O)c2ccccc21 ZINC000854229224 588780840 /nfs/dbraw/zinc/78/08/40/588780840.db2.gz IIFYLJAKMIEOJG-DFBGVHRSSA-N 2 0 248.370 2.272 20 0 BEADRP CC[C@@H]1CCC[N@@H+]1CC1CC[NH+](C)CC1 ZINC000891780819 582720138 /nfs/dbraw/zinc/72/01/38/582720138.db2.gz CNIMYJDXZMDSEQ-CYBMUJFWSA-N 2 0 210.365 2.203 20 0 BEADRP C[C@@H]1C[NH+](CC2CC[NH+](C)CC2)C[C@@H](C)S1 ZINC000891822264 582726829 /nfs/dbraw/zinc/72/68/29/582726829.db2.gz KZLMZSQMPRRMSC-VXGBXAGGSA-N 2 0 242.432 2.154 20 0 BEADRP CCC(C)(C)[N@H+](C)CC1CC[NH+](C)CC1 ZINC000892005743 582759512 /nfs/dbraw/zinc/75/95/12/582759512.db2.gz XEZWYFNKDKRFJY-UHFFFAOYSA-N 2 0 212.381 2.449 20 0 BEADRP C[C@@H]1CC[C@@H](C)[N@H+](CC2CC[NH+](C)CC2)C1 ZINC000892069314 582784636 /nfs/dbraw/zinc/78/46/36/582784636.db2.gz HWQYRMNCUJPWDC-CHWSQXEVSA-N 2 0 224.392 2.449 20 0 BEADRP CC[C@]1(C)CC[N@H+](CC2CC[NH+](C)CC2)C1 ZINC000892144230 582800426 /nfs/dbraw/zinc/80/04/26/582800426.db2.gz MNSJGBQPFKDHBP-CQSZACIVSA-N 2 0 224.392 2.450 20 0 BEADRP C(CC1CCCCC1)C[NH+]1C[C@H]2C[NH2+]C[C@@H]2C1 ZINC000395115362 583042816 /nfs/dbraw/zinc/04/28/16/583042816.db2.gz IREDKDHZTHIYSU-HUUCEWRRSA-N 2 0 236.403 2.498 20 0 BEADRP [NH3+][C@@]12CCC[C@@H]1CN(CCc1cccs1)C2 ZINC000857086551 588887060 /nfs/dbraw/zinc/88/70/60/588887060.db2.gz LRRMGOWWVLEMJF-DGCLKSJQSA-N 2 0 236.384 2.104 20 0 BEADRP C[N@@H+]1CCC[C@@H]1CC[NH+]1CCC[C@@H](CF)C1 ZINC000880237080 583506475 /nfs/dbraw/zinc/50/64/75/583506475.db2.gz PQJFWUHTRMIKBL-QWHCGFSZSA-N 2 0 228.355 2.152 20 0 BEADRP C[C@@H]1C[N@H+](CC2CC[NH+](C)CC2)[C@@H](C)[C@H]1C ZINC000894959556 583559415 /nfs/dbraw/zinc/55/94/15/583559415.db2.gz YIRCEFYWDLFQIZ-AGIUHOORSA-N 2 0 224.392 2.305 20 0 BEADRP CN(C)C1(C[NH2+]C[C@H]2CCc3ccccc32)CC1 ZINC000894954463 583559878 /nfs/dbraw/zinc/55/98/78/583559878.db2.gz LDGAPSMSSJMJLH-CQSZACIVSA-N 2 0 244.382 2.400 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2CC[C@]3(CC3(F)F)C2)CC1 ZINC000895188232 583619587 /nfs/dbraw/zinc/61/95/87/583619587.db2.gz IHUAPEAEZALKCP-LBPRGKRZSA-N 2 0 244.329 2.059 20 0 BEADRP CCC1(C[NH2+]CC[C@@H](C)[NH+](C)C)CCOCC1 ZINC000895296188 583640638 /nfs/dbraw/zinc/64/06/38/583640638.db2.gz ABASPLXUSLKIIL-CYBMUJFWSA-N 2 0 242.407 2.123 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2CCC[C@@H](CF)C2)CC1 ZINC000896000967 583760376 /nfs/dbraw/zinc/76/03/76/583760376.db2.gz ZYQFVERHYUKFAH-ZDUSSCGKSA-N 2 0 228.355 2.010 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CC2CC[NH+](C)CC2)CCS1 ZINC000896951834 583863949 /nfs/dbraw/zinc/86/39/49/583863949.db2.gz LZHJRWQOMNGUTA-AAEUAGOBSA-N 2 0 242.432 2.202 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CCc2cccnc2)CC1(C)C ZINC000858093435 588932258 /nfs/dbraw/zinc/93/22/58/588932258.db2.gz BFOIQCOEVJOOMU-AWEZNQCLSA-N 2 0 247.386 2.087 20 0 BEADRP C[N@H+](CCOC(C)(C)C)CC1CC[NH+](C)CC1 ZINC000729265336 583988191 /nfs/dbraw/zinc/98/81/91/583988191.db2.gz BSIWYNHMSXSNEK-UHFFFAOYSA-N 2 0 242.407 2.075 20 0 BEADRP F[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000865697167 584026898 /nfs/dbraw/zinc/02/68/98/584026898.db2.gz UKOXHEIBSBABER-FQUUOJAGSA-N 2 0 240.366 2.484 20 0 BEADRP C[C@@H]1CN(C)C[C@H]1[NH2+][C@H]1CCSC(C)(C)C1 ZINC000897797221 584049371 /nfs/dbraw/zinc/04/93/71/584049371.db2.gz FGKUMHXWDBSREG-GRYCIOLGSA-N 2 0 242.432 2.200 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H]2C[C@@H]3CCC[C@@H]23)[C@@H](C)C1 ZINC000897955917 584065645 /nfs/dbraw/zinc/06/56/45/584065645.db2.gz YZUXVYCFHVOUNC-SBJFKYEJSA-N 2 0 236.403 2.495 20 0 BEADRP C(CC1CC1)C[N@@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1 ZINC000866666084 584121615 /nfs/dbraw/zinc/12/16/15/584121615.db2.gz NFJZEHRPFQNKHD-GJZGRUSLSA-N 2 0 236.403 2.498 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@@H]([NH2+]C[C@H]2C[C@H]([NH3+])C2)C1 ZINC000873255602 584128123 /nfs/dbraw/zinc/12/81/23/584128123.db2.gz ICHYFNYGVSPDFH-MLGHIDQZSA-N 2 0 210.365 2.138 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@H]2CCC[C@@H]2CCCF)C1 ZINC000873251855 584128176 /nfs/dbraw/zinc/12/81/76/584128176.db2.gz XNIYCGRFIGVLMD-NDBYEHHHSA-N 2 0 228.355 2.232 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]CCC[C@@H]1C=CCC1 ZINC000873282308 584129109 /nfs/dbraw/zinc/12/91/09/584129109.db2.gz SYOMZMQSLIKMDE-RDBSUJKOSA-N 2 0 222.376 2.450 20 0 BEADRP [NH3+]Cc1ccc(-c2ccc3c(c2)C[C@H]([NH3+])C3)s1 ZINC000899323621 584196582 /nfs/dbraw/zinc/19/65/82/584196582.db2.gz SQMSAFAQMLJCCZ-GFCCVEGCSA-N 2 0 244.363 2.300 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccccc2NC)C1 ZINC000902078459 584520389 /nfs/dbraw/zinc/52/03/89/584520389.db2.gz LZXUXAUMRIKEJY-ZDUSSCGKSA-N 2 0 247.386 2.160 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]([NH2+]C[C@@H]2CCCS2)C1 ZINC000902346748 584559025 /nfs/dbraw/zinc/55/90/25/584559025.db2.gz POHNMBZDMAGIIX-NEPJUHHUSA-N 2 0 242.432 2.250 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]([NH2+]CCC2CC2)C1 ZINC000902348048 584559030 /nfs/dbraw/zinc/55/90/30/584559030.db2.gz QLDQQLXZVHFVIV-LBPRGKRZSA-N 2 0 210.365 2.154 20 0 BEADRP CO[C@@H](C[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1)C(C)C ZINC000902333890 584563696 /nfs/dbraw/zinc/56/36/96/584563696.db2.gz MVGRWUMGNVHXAK-OLZOCXBDSA-N 2 0 242.407 2.025 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]([NH2+][C@@H]2CC=CCC2)C1 ZINC000902362644 584571999 /nfs/dbraw/zinc/57/19/99/584571999.db2.gz RCPVJXWOVBBXHF-OLZOCXBDSA-N 2 0 222.376 2.463 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]([NH2+][C@H]2CC=CCC2)C1 ZINC000902362647 584572396 /nfs/dbraw/zinc/57/23/96/584572396.db2.gz RCPVJXWOVBBXHF-QWHCGFSZSA-N 2 0 222.376 2.463 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H]2CCCC23CCCC3)CC1 ZINC000902408229 584575856 /nfs/dbraw/zinc/57/58/56/584575856.db2.gz YLRCNOHJNNVNES-LLVKDONJSA-N 2 0 208.349 2.180 20 0 BEADRP C[C@H]1Cc2ccccc2[C@@H]1[NH2+]CC1([NH3+])CC1 ZINC000902412531 584576147 /nfs/dbraw/zinc/57/61/47/584576147.db2.gz COAZKEIRUIITQL-GXFFZTMASA-N 2 0 216.328 2.001 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000902386296 584578205 /nfs/dbraw/zinc/57/82/05/584578205.db2.gz FGIQOXAPADJFKQ-AGIUHOORSA-N 2 0 224.392 2.400 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]([NH2+]CC2CC(F)(F)C2)C1 ZINC000902387720 584579679 /nfs/dbraw/zinc/57/96/79/584579679.db2.gz LIJTWTQCNXAFEO-NSHDSACASA-N 2 0 246.345 2.400 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]([NH2+]C[C@@H]2C[C@H]2C2CC2)C1 ZINC000902388709 584579957 /nfs/dbraw/zinc/57/99/57/584579957.db2.gz QOFBXUSZRSJUQG-IHRRRGAJSA-N 2 0 236.403 2.400 20 0 BEADRP CCC[C@@H](C[NH2+][C@H]1CC[NH2+]CC(C)(C)C1)OC ZINC000902389230 584580701 /nfs/dbraw/zinc/58/07/01/584580701.db2.gz TTYFTWRBQCYEEQ-STQMWFEESA-N 2 0 242.407 2.169 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]([NH2+][C@@H]2C=CCC2)C1 ZINC000902391569 584581744 /nfs/dbraw/zinc/58/17/44/584581744.db2.gz GYCQKXXUBCLVQA-VXGBXAGGSA-N 2 0 208.349 2.073 20 0 BEADRP CC(C)(F)CC[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000902394680 584582890 /nfs/dbraw/zinc/58/28/90/584582890.db2.gz ADOKWRBCKPJJEA-LLVKDONJSA-N 2 0 230.371 2.492 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]([NH2+]CC[C@H]2CC2(F)F)C1 ZINC000902397825 584585281 /nfs/dbraw/zinc/58/52/81/584585281.db2.gz IEUKXEGQQHMHGJ-QWRGUYRKSA-N 2 0 246.345 2.400 20 0 BEADRP C[C@]1(C[NH2+][C@H]2CC[NH2+]CC(C)(C)C2)CC1(F)F ZINC000902400956 584587016 /nfs/dbraw/zinc/58/70/16/584587016.db2.gz YNVUEIOHUWZOMK-CMPLNLGQSA-N 2 0 246.345 2.400 20 0 BEADRP [NH3+]C1(C[NH2+][C@H](C2CC2)C2CCCC2)CC1 ZINC000902404972 584588712 /nfs/dbraw/zinc/58/87/12/584588712.db2.gz HSBKTGGKFGDNHP-LBPRGKRZSA-N 2 0 208.349 2.036 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)C[C@H](C)[NH3+])c1ccc2c(c1)CCO2 ZINC000902405370 584588865 /nfs/dbraw/zinc/58/88/65/584588865.db2.gz MSXXOWBRPMAEAB-SDDRHHMPSA-N 2 0 248.370 2.398 20 0 BEADRP CC(C)(C[NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23)C1CC1 ZINC000902430885 584595340 /nfs/dbraw/zinc/59/53/40/584595340.db2.gz JKBTUYYQNRZWRY-SZZQBSIJSA-N 2 0 234.387 2.009 20 0 BEADRP CC(C)(C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)C1CC1 ZINC000902432241 584595367 /nfs/dbraw/zinc/59/53/67/584595367.db2.gz OWJOCPDTBMGSJV-YRGRVCCFSA-N 2 0 236.403 2.400 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]CC(C)(C)C1CC1 ZINC000902434682 584595861 /nfs/dbraw/zinc/59/58/61/584595861.db2.gz ZCFDTQAONJZBHU-YPMHNXCESA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]CC(C)(C)C1CC1 ZINC000902434680 584595871 /nfs/dbraw/zinc/59/58/71/584595871.db2.gz ZCFDTQAONJZBHU-DGCLKSJQSA-N 2 0 224.392 2.400 20 0 BEADRP CC(C)(C[NH2+][C@H]1CCC[C@H]([NH3+])C1)C1CC1 ZINC000902434564 584595964 /nfs/dbraw/zinc/59/59/64/584595964.db2.gz XMYMKLHKIJANFU-RYUDHWBXSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H](CC(C)(C)C)[NH2+][C@@H]1C[NH2+]CC1(C)C ZINC000902444242 584598613 /nfs/dbraw/zinc/59/86/13/584598613.db2.gz MWOZPMFXSNJPBF-WDEREUQCSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@H](CCC1CC1)[NH2+][C@H]1C[NH2+]CC1(C)C ZINC000902444863 584598844 /nfs/dbraw/zinc/59/88/44/584598844.db2.gz OVHNVZLBAXJWAG-PWSUYJOCSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H](CCC1CC1)[NH2+][C@@H]1C[NH2+]CC1(C)C ZINC000902444852 584599021 /nfs/dbraw/zinc/59/90/21/584599021.db2.gz OVHNVZLBAXJWAG-CMPLNLGQSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH2+]CC1([NH3+])CC1)C1C(C)(C)C1(C)C ZINC000902413549 584599527 /nfs/dbraw/zinc/59/95/27/584599527.db2.gz NZVPKJSYXSXUTG-VIFPVBQESA-N 2 0 210.365 2.138 20 0 BEADRP CC[C@H](NCC1([NH3+])CC1)c1ccc(F)cc1 ZINC000902414992 584600285 /nfs/dbraw/zinc/60/02/85/584600285.db2.gz IVUJQOWQDCARTO-LBPRGKRZSA-N 2 0 222.307 2.358 20 0 BEADRP [NH3+]C1(CN[C@@H]2CCCc3sccc32)CC1 ZINC000902414930 584600625 /nfs/dbraw/zinc/60/06/25/584600625.db2.gz GVNNZRUFOJTSKT-SNVBAGLBSA-N 2 0 222.357 2.206 20 0 BEADRP CC1CCC([NH2+][C@@H]2C[C@H]3CC[C@@H]2[NH2+]3)CC1 ZINC000902473030 584601125 /nfs/dbraw/zinc/60/11/25/584601125.db2.gz OQRGGPUPSCZBSX-UDSBESMDSA-N 2 0 208.349 2.048 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@@H]2C[C@H]3CC[C@@H]2[NH2+]3)[C@H]1C ZINC000902474664 584601850 /nfs/dbraw/zinc/60/18/50/584601850.db2.gz HIBYDIQCAAKJHP-QTJJRWQNSA-N 2 0 222.376 2.294 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+][C@@H]2C[C@H]3CC[C@@H]2[NH2+]3)[C@@H]1C ZINC000902474665 584601927 /nfs/dbraw/zinc/60/19/27/584601927.db2.gz HIBYDIQCAAKJHP-UCKQBZRPSA-N 2 0 222.376 2.294 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902474174 584602313 /nfs/dbraw/zinc/60/23/13/584602313.db2.gz DCOLUERKJUKOKH-DOLQZWNJSA-N 2 0 236.281 2.200 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2)C1CCCC1 ZINC000902476028 584602861 /nfs/dbraw/zinc/60/28/61/584602861.db2.gz MCDQKRZFIAYQOP-FOUMNBMASA-N 2 0 208.349 2.048 20 0 BEADRP CC[C@H]1CCC[C@H]1[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902476169 584602975 /nfs/dbraw/zinc/60/29/75/584602975.db2.gz MVPABWCNFDHBDF-CKIKVBCHSA-N 2 0 208.349 2.048 20 0 BEADRP CC[C@H]([NH2+][C@@H]1C[NH2+]CC1(C)C)[C@H]1C[C@H]1C ZINC000902446944 584604020 /nfs/dbraw/zinc/60/40/20/584604020.db2.gz WJVNPJHHXNWRQE-NOOOWODRSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@@]12C[C@@H]1CCC[C@H]2[NH2+][C@H]1C[NH2+]CC1(C)C ZINC000902447571 584604548 /nfs/dbraw/zinc/60/45/48/584604548.db2.gz ZRVCLWDEKIHHDW-KZVDOYCCSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H](CCC(F)(F)F)[NH2+][C@H]1C[NH2+]CC1(C)C ZINC000902448172 584604617 /nfs/dbraw/zinc/60/46/17/584604617.db2.gz DGUBIMPOVBTSPN-IUCAKERBSA-N 2 0 238.297 2.305 20 0 BEADRP CC(C)CC[C@@H](C)[NH2+][C@H]1C[NH2+]CC1(C)C ZINC000902447318 584605054 /nfs/dbraw/zinc/60/50/54/584605054.db2.gz SHEATWHJHNQJGA-NEPJUHHUSA-N 2 0 212.381 2.399 20 0 BEADRP CC[C@@H]1CCC[C@H]1[NH2+][C@H]1C[NH2+]CC1(C)C ZINC000902448118 584605072 /nfs/dbraw/zinc/60/50/72/584605072.db2.gz CJTNEHCTMGCTTM-UTUOFQBUSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[NH2+]CC1(C)C)C1CCCC1 ZINC000902448731 584605542 /nfs/dbraw/zinc/60/55/42/584605542.db2.gz HZDBHCVCLKYFGL-CMPLNLGQSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)[C@@H]1CCC[C@@H]1[NH2+][C@H]1C[NH2+]CC1(C)C ZINC000902448689 584605640 /nfs/dbraw/zinc/60/56/40/584605640.db2.gz HAOQPMKTGGHQID-AVGNSLFASA-N 2 0 224.392 2.399 20 0 BEADRP CC1(C)C[C@H]([NH2+][C@H]2CCC[C@@H]2[NH3+])CCS1 ZINC000902449986 584606490 /nfs/dbraw/zinc/60/64/90/584606490.db2.gz AZTVZIPUNFACQS-VWYCJHECSA-N 2 0 228.405 2.130 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@H]1CCCC2(CC2)C1 ZINC000902450401 584606822 /nfs/dbraw/zinc/60/68/22/584606822.db2.gz DBYLETOSIKYIDH-SRVKXCTJSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1C[C@H]2CCC[C@@H]21 ZINC000902453494 584607893 /nfs/dbraw/zinc/60/78/93/584607893.db2.gz DGCOOBHLDACQBB-FVCCEPFGSA-N 2 0 210.365 2.282 20 0 BEADRP C1[C@H]2CCC[C@H]2[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000902453952 584608532 /nfs/dbraw/zinc/60/85/32/584608532.db2.gz GHVFPSULEBPTOU-ICQAVMKVSA-N 2 0 220.360 2.048 20 0 BEADRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)S2)[C@@H]1CCC[NH2+]1 ZINC000902455700 584609593 /nfs/dbraw/zinc/60/95/93/584609593.db2.gz YIVBMHNFYYSJEE-ZZIFITQXSA-N 2 0 240.416 2.143 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H]2C[C@H]3CCC[C@H]32)C1 ZINC000902455436 584609739 /nfs/dbraw/zinc/60/97/39/584609739.db2.gz LZZUHZBATFXQKN-UJPOAAIJSA-N 2 0 208.349 2.035 20 0 BEADRP CC1(C)CCC[C@H](C[NH2+][C@H]2CCC[C@H]([NH3+])C2)O1 ZINC000902461204 584611797 /nfs/dbraw/zinc/61/17/97/584611797.db2.gz LXEHLFWVZSHEQL-RWMBFGLXSA-N 2 0 240.391 2.194 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]C[C@H]1CCCC(C)(C)O1 ZINC000902462637 584612019 /nfs/dbraw/zinc/61/20/19/584612019.db2.gz WOBJWPJOLAQZQS-QWHCGFSZSA-N 2 0 242.407 2.441 20 0 BEADRP C[C@]12C[C@H]1CCC[C@@H]2[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902465113 584613464 /nfs/dbraw/zinc/61/34/64/584613464.db2.gz DZBVBHPPWSCAGK-FDFVQJQPSA-N 2 0 220.360 2.048 20 0 BEADRP CNc1ccccc1C[NH2+]CC1=CC[N@H+](C)CC1 ZINC000902466058 584613788 /nfs/dbraw/zinc/61/37/88/584613788.db2.gz IMAFXFGUKQSGMP-UHFFFAOYSA-N 2 0 245.370 2.080 20 0 BEADRP C[C@H]1CCCC[C@H]1[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902465469 584613823 /nfs/dbraw/zinc/61/38/23/584613823.db2.gz GFJVSAVZOJHVKI-KIJLLGNVSA-N 2 0 208.349 2.048 20 0 BEADRP CC1(C)CC[C@@H]([NH2+][C@@H]2C[C@H]3CC[C@@H]2[NH2+]3)C1 ZINC000902466273 584614118 /nfs/dbraw/zinc/61/41/18/584614118.db2.gz MARUIGRLMZNOEO-WISYIIOYSA-N 2 0 208.349 2.048 20 0 BEADRP CCCCC[C@@H](C)[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902467285 584614897 /nfs/dbraw/zinc/61/48/97/584614897.db2.gz OROLMYWPDORAHG-YVECIDJPSA-N 2 0 210.365 2.438 20 0 BEADRP FCCC[C@H]1CCC[C@@H]1[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902469367 584615663 /nfs/dbraw/zinc/61/56/63/584615663.db2.gz PNQVAKVWKCXYGA-MBJXGIAVSA-N 2 0 240.366 2.387 20 0 BEADRP C1C[C@@H]2[NH2+][C@H]1C[C@@H]2[NH2+]C1CCCCCC1 ZINC000902469306 584615754 /nfs/dbraw/zinc/61/57/54/584615754.db2.gz WNTKOEDFAKAMCP-AGIUHOORSA-N 2 0 208.349 2.192 20 0 BEADRP CCC[C@H](N[C@@H]1C[C@H]2CC[C@@H]1[NH2+]2)c1cccnc1 ZINC000902468780 584615760 /nfs/dbraw/zinc/61/57/60/584615760.db2.gz VIOCDYZTYWZASW-CBBWQLFWSA-N 2 0 245.370 2.405 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+][C@@H]2C[C@@H]3CC[C@H]2[NH2+]3)[C@H](C)C1 ZINC000902470486 584616735 /nfs/dbraw/zinc/61/67/35/584616735.db2.gz YOXYJNCGPKQTEZ-BUCHIQEDSA-N 2 0 222.376 2.294 20 0 BEADRP C1CC1[C@H]1CCC[C@@H]([NH2+][C@@H]2C[C@@H]3CC[C@H]2[NH2+]3)C1 ZINC000902471775 584617429 /nfs/dbraw/zinc/61/74/29/584617429.db2.gz SKGNNNLFNCFHHC-XPABHHOTSA-N 2 0 234.387 2.438 20 0 BEADRP C[C@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1ccccc1F ZINC000902489956 584617498 /nfs/dbraw/zinc/61/74/98/584617498.db2.gz SYRLRCHSQDDXHD-DCAQKATOSA-N 2 0 222.307 2.214 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H](C3CC3)C2)C1 ZINC000902491669 584618120 /nfs/dbraw/zinc/61/81/20/584618120.db2.gz YGWFXPYTZSNQKL-FMKGYKFTSA-N 2 0 222.376 2.282 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+][C@H]2CCc3ccccc32)C1 ZINC000902490966 584618304 /nfs/dbraw/zinc/61/83/04/584618304.db2.gz ZIYWXXZMQZELDM-JKOKRWQUSA-N 2 0 216.328 2.001 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+][C@@H]2CCCc3ccccc3C2)C1 ZINC000902490734 584618347 /nfs/dbraw/zinc/61/83/47/584618347.db2.gz VDGCZAYGSSJROH-DAXOMENPSA-N 2 0 244.382 2.261 20 0 BEADRP C[C@@H]1CC=CC[C@H]1[NH2+][C@@H]1C[C@H]([NH3+])C12CCC2 ZINC000902502453 584620913 /nfs/dbraw/zinc/62/09/13/584620913.db2.gz FUKCYTITTWXCMD-FVCCEPFGSA-N 2 0 220.360 2.201 20 0 BEADRP C[C@@H]1CC=CC[C@H]1[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000902503861 584621472 /nfs/dbraw/zinc/62/14/72/584621472.db2.gz LIYUIYKSNGUNCF-XLWJZTARSA-N 2 0 234.387 2.319 20 0 BEADRP CC(C)[NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000902503919 584621661 /nfs/dbraw/zinc/62/16/61/584621661.db2.gz TXIWVTMQNYHZKH-UKRRQHHQSA-N 2 0 246.354 2.240 20 0 BEADRP Cc1ncccc1CC[NH2+][C@@H]1CCCCC[C@H]1[NH3+] ZINC000902511757 584622955 /nfs/dbraw/zinc/62/29/55/584622955.db2.gz FJUIARWQAJYKLH-HUUCEWRRSA-N 2 0 247.386 2.182 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]C[C@H]1CCCCC[NH2+]1 ZINC000902481411 584624279 /nfs/dbraw/zinc/62/42/79/584624279.db2.gz CONKQZDVBPMGEV-WCQYABFASA-N 2 0 210.365 2.297 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+][C@@H]2CCCc3c(O)cccc32)C1 ZINC000902485353 584624541 /nfs/dbraw/zinc/62/45/41/584624541.db2.gz JXRMYYWGZRSOIO-JTNHKYCSSA-N 2 0 246.354 2.097 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+][C@H]2C[C@H](C[NH3+])C2)C[C@H]1C ZINC000902484185 584624571 /nfs/dbraw/zinc/62/45/71/584624571.db2.gz FFXANTVCNRIMKD-SYLRKERUSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H]1CCC[C@H]1[NH2+]C[C@H]1CCCCC[NH2+]1 ZINC000902485316 584624961 /nfs/dbraw/zinc/62/49/61/584624961.db2.gz ZPMAELGMXOIGLJ-JHJVBQTASA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]1CCC[C@H](C)C1[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902486376 584625205 /nfs/dbraw/zinc/62/52/05/584625205.db2.gz GFROLQFEONZFGL-BJDJZHNGSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1cccnc1Cl ZINC000902485551 584625229 /nfs/dbraw/zinc/62/52/29/584625229.db2.gz AFPOOYBCVYIODP-GUBZILKMSA-N 2 0 239.750 2.123 20 0 BEADRP C[C@@H](CCCC(F)(F)F)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902485726 584625375 /nfs/dbraw/zinc/62/53/75/584625375.db2.gz NDCXXLJFGPFFIG-GUBZILKMSA-N 2 0 238.297 2.434 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+][C@H]2CCCC23CCC3)C1 ZINC000902486596 584626025 /nfs/dbraw/zinc/62/60/25/584626025.db2.gz GEKMJUDOXGYOPK-SRVKXCTJSA-N 2 0 208.349 2.036 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+][C@H](Cc2ccccc2)C2CC2)C1 ZINC000902487638 584626694 /nfs/dbraw/zinc/62/66/94/584626694.db2.gz LHYJZBMLQSYDLO-FVQBIDKESA-N 2 0 244.382 2.335 20 0 BEADRP CCC[C@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)C1CCC1 ZINC000902489020 584627231 /nfs/dbraw/zinc/62/72/31/584627231.db2.gz PSVZRDYSLDSRLL-DRZSPHRISA-N 2 0 210.365 2.282 20 0 BEADRP CC[C@@H](Cc1cccs1)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902488786 584627648 /nfs/dbraw/zinc/62/76/48/584627648.db2.gz NXOOZEBWKFFQGL-SRVKXCTJSA-N 2 0 238.400 2.396 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@H](c1ccncc1)C1CC1 ZINC000902515185 584629463 /nfs/dbraw/zinc/62/94/63/584629463.db2.gz UAJWNLUYCQKQJC-MJVIPROJSA-N 2 0 233.359 2.248 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]([NH2+]C/C=C\Cl)C1 ZINC000902521775 584631652 /nfs/dbraw/zinc/63/16/52/584631652.db2.gz UOMAPLIFVKIEKL-TZGMSPROSA-N 2 0 216.756 2.107 20 0 BEADRP Cl/C=C\C[NH2+][C@@H]1CC[NH2+]C[C@@H]1C1CCCC1 ZINC000902522002 584631502 /nfs/dbraw/zinc/63/15/02/584631502.db2.gz VECBEQKBQQKNLE-KRAPLUKQSA-N 2 0 242.794 2.497 20 0 BEADRP C1CC1N1CC[C@H]([NH2+]C2C[C@H]3CCC[C@@H]3C2)C1 ZINC000902793940 584673386 /nfs/dbraw/zinc/67/33/86/584673386.db2.gz OYPUCVLISKNVQI-UPJWGTAASA-N 2 0 234.387 2.391 20 0 BEADRP C[N@@H+]1CCCC[C@@H]1CCN1CCC[C@@H](F)C1 ZINC000903002139 584716244 /nfs/dbraw/zinc/71/62/44/584716244.db2.gz WUOVXZFABKJGLJ-CHWSQXEVSA-N 2 0 228.355 2.295 20 0 BEADRP CO[C@H]1CCC[C@H]1[NH2+]CCC[N@H+](C)CC(C)C ZINC000903195062 584734314 /nfs/dbraw/zinc/73/43/14/584734314.db2.gz URXUWRZKWLZSLO-KGLIPLIRSA-N 2 0 242.407 2.121 20 0 BEADRP CO[C@@H]1CCC[C@@H]1[NH2+]CCC[N@H+](C)CC(C)C ZINC000903195063 584734465 /nfs/dbraw/zinc/73/44/65/584734465.db2.gz URXUWRZKWLZSLO-UONOGXRCSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H]1C[C@H]1[C@@H]1C[C@H]1[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000903253956 584739529 /nfs/dbraw/zinc/73/95/29/584739529.db2.gz NAXMVMQXBSNVFM-BQDHKBFISA-N 2 0 248.414 2.495 20 0 BEADRP C[C@@H]1C[C@H]1[C@@H]1C[C@H]1[NH2+][C@@H]1CC[N@H+](C)[C@@H]2CCC[C@H]21 ZINC000903255683 584740071 /nfs/dbraw/zinc/74/00/71/584740071.db2.gz ZEXTZWBFZORWJL-OAFXHQAOSA-N 2 0 248.414 2.493 20 0 BEADRP C[N@H+]1C[C@H]2CC[C@@H](C1)C2[NH2+][C@@H]1C[C@H]2CCC[C@@H]21 ZINC000903319498 584746018 /nfs/dbraw/zinc/74/60/18/584746018.db2.gz VAKYJBIYYMWXEY-LOGRNBMNSA-N 2 0 234.387 2.105 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@H]21)C1CC[NH+](C)CC1 ZINC000903319213 584746312 /nfs/dbraw/zinc/74/63/12/584746312.db2.gz TZJSPUBRFBGCBO-ZGKBOVNRSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@H]1C[N@H+](Cc2ccc3cc[nH]c3c2)CC[C@@H]1[NH3+] ZINC000903425253 584761020 /nfs/dbraw/zinc/76/10/20/584761020.db2.gz YNMIEXWSIYVZSE-FZMZJTMJSA-N 2 0 243.354 2.337 20 0 BEADRP C[C@H]1C[N@H+](Cc2ccc3cc[nH]c3c2)CC[C@H]1[NH3+] ZINC000903425255 584761264 /nfs/dbraw/zinc/76/12/64/584761264.db2.gz YNMIEXWSIYVZSE-SMDDNHRTSA-N 2 0 243.354 2.337 20 0 BEADRP C[C@@H](C1CC1)[N@H+](C[C@@H]1C[NH2+]C[C@H]1C)C1CC1 ZINC000903430784 584761860 /nfs/dbraw/zinc/76/18/60/584761860.db2.gz AXOMPJOMGIZJDB-MDZLAQPJSA-N 2 0 222.376 2.105 20 0 BEADRP C[C@H](c1cccc(O)c1)[N@H+](C)C[C@@H]1C[NH2+]C[C@H]1C ZINC000903435896 584761975 /nfs/dbraw/zinc/76/19/75/584761975.db2.gz ZPUWYBUIZQODTR-BZPMIXESSA-N 2 0 248.370 2.241 20 0 BEADRP C[C@@H](c1cccc(O)c1)[N@H+](C)C[C@@H]1C[NH2+]C[C@H]1C ZINC000903435897 584762127 /nfs/dbraw/zinc/76/21/27/584762127.db2.gz ZPUWYBUIZQODTR-DYEKYZERSA-N 2 0 248.370 2.241 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](Cc2ccc3cc[nH]c3c2)C1 ZINC000903422642 584764576 /nfs/dbraw/zinc/76/45/76/584764576.db2.gz HGZOJUUOGFXUON-ZDUSSCGKSA-N 2 0 243.354 2.209 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@@H]1CCC[C@@H](C)[C@H]1C ZINC000903458751 584764917 /nfs/dbraw/zinc/76/49/17/584764917.db2.gz IQQQTQUKVDARLN-XGFWRYKXSA-N 2 0 224.392 2.256 20 0 BEADRP CC(C)[N@H+](CC1CCC1)C[C@@H]1C[NH2+]C[C@H]1C ZINC000903459487 584766129 /nfs/dbraw/zinc/76/61/29/584766129.db2.gz UINKEJDKYRRHTR-OCCSQVGLSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@H]1CCCC1(C)C ZINC000903459002 584766171 /nfs/dbraw/zinc/76/61/71/584766171.db2.gz PFUNPTJZJKNNBN-WOPDTQHZSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]1C[C@@H]([NH3+])CC[N@@H+]1Cc1ccc2cc[nH]c2c1 ZINC000903460840 584766845 /nfs/dbraw/zinc/76/68/45/584766845.db2.gz JRHZYIGKZXBHQC-RISCZKNCSA-N 2 0 243.354 2.480 20 0 BEADRP CC[N@H+](CCc1ccccn1)C[C@@H]1CC[C@H]([NH3+])C1 ZINC000903442465 584767051 /nfs/dbraw/zinc/76/70/51/584767051.db2.gz RLYOOZZMOPEMDZ-KGLIPLIRSA-N 2 0 247.386 2.073 20 0 BEADRP C[N@H+](C[C@H]1CC1(C)C)C[C@@H]1CC[C@H]([NH3+])C1 ZINC000903464552 584770495 /nfs/dbraw/zinc/77/04/95/584770495.db2.gz RFXRHYUEHPJVQR-UTUOFQBUSA-N 2 0 210.365 2.092 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1 ZINC000903453835 584772626 /nfs/dbraw/zinc/77/26/26/584772626.db2.gz NJEYFYSEIRDEMP-QPSCCSFWSA-N 2 0 236.403 2.354 20 0 BEADRP C[N@H+](Cc1ccc2cc[nH]c2c1)C1CC([NH3+])C1 ZINC000903454023 584772992 /nfs/dbraw/zinc/77/29/92/584772992.db2.gz RNKGHTWRGMRSHA-UHFFFAOYSA-N 2 0 229.327 2.089 20 0 BEADRP C(C[NH2+][C@@H]1CC[NH2+]C12CCC2)CC1CC1 ZINC000903472911 584776096 /nfs/dbraw/zinc/77/60/96/584776096.db2.gz WTAODAJGDPPMDD-GFCCVEGCSA-N 2 0 208.349 2.051 20 0 BEADRP CC1(C)[C@H]([NH3+])c2ccccc2N1C[C@H]1CCC[NH2+]1 ZINC000903476091 584777502 /nfs/dbraw/zinc/77/75/02/584777502.db2.gz NBLSILJSKQCEIR-BXUZGUMPSA-N 2 0 245.370 2.037 20 0 BEADRP CC1(C)[C@H]([NH3+])C[C@@H]1[NH2+]Cc1ccc2cc[nH]c2c1 ZINC000903482633 584778557 /nfs/dbraw/zinc/77/85/57/584778557.db2.gz NLTINWCFGNZOCY-KGLIPLIRSA-N 2 0 243.354 2.383 20 0 BEADRP C[C@]12C[N@H+](CC3CC[NH2+]CC3)C[C@H]1[C@H]1CC[C@@H]2C1 ZINC000903707108 584791563 /nfs/dbraw/zinc/79/15/63/584791563.db2.gz LOANTTMRFKAEDZ-XUWVNRHRSA-N 2 0 248.414 2.354 20 0 BEADRP C[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2CF)C1 ZINC000903716756 584791838 /nfs/dbraw/zinc/79/18/38/584791838.db2.gz RPWVINHITUHUTA-GFCCVEGCSA-N 2 0 236.334 2.197 20 0 BEADRP C[C@H]([NH3+])[C@H]1CCC[N@H+](CC2CC(C)C2)C1 ZINC000903716265 584794297 /nfs/dbraw/zinc/79/42/97/584794297.db2.gz LESVNSHWTXHJCB-MVKMKZAISA-N 2 0 210.365 2.092 20 0 BEADRP CC1CC(C[NH+]2CCC([C@H]3CCC[NH2+]3)CC2)C1 ZINC000903751414 584795442 /nfs/dbraw/zinc/79/54/42/584795442.db2.gz IULGCOOCVPNAEW-SSDMNJCBSA-N 2 0 236.403 2.497 20 0 BEADRP CC1CC(C[N@@H+]2CCC[C@H]([C@@H]3CCC[NH2+]3)C2)C1 ZINC000903740889 584796065 /nfs/dbraw/zinc/79/60/65/584796065.db2.gz LTJDSCSDCWYTFY-WUCCLRPBSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]1C[C@@H]([NH3+])CC[N@@H+]1Cc1ccccc1CF ZINC000903767215 584797811 /nfs/dbraw/zinc/79/78/11/584797811.db2.gz FSIFYUYSBGDQMF-RISCZKNCSA-N 2 0 236.334 2.468 20 0 BEADRP C([C@@H]1CCCC[NH2+]C1)[NH+](C1CC1)C1CC1 ZINC000903769403 584797876 /nfs/dbraw/zinc/79/78/76/584797876.db2.gz FNHYALTUEKWCED-LLVKDONJSA-N 2 0 208.349 2.003 20 0 BEADRP CC(C)C[C@H](C)C[NH2+][C@@H]1C[NH2+]CC1(C)C ZINC000903821464 584804051 /nfs/dbraw/zinc/80/40/51/584804051.db2.gz LEWSVDFVCSCARB-NWDGAFQWSA-N 2 0 212.381 2.256 20 0 BEADRP CC(C)C[C@@H](C)C[NH2+][C@@H]1C[NH2+]CC1(C)C ZINC000903821466 584804108 /nfs/dbraw/zinc/80/41/08/584804108.db2.gz LEWSVDFVCSCARB-VXGBXAGGSA-N 2 0 212.381 2.256 20 0 BEADRP CC1(C)C[NH2+]C[C@H]1[NH2+]CC1CCCCC1 ZINC000903821693 584804140 /nfs/dbraw/zinc/80/41/40/584804140.db2.gz PYQJCXWDWCOKHD-GFCCVEGCSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H]1CSCCC[N@@H+]1CCCCCC[NH3+] ZINC000903829789 584805822 /nfs/dbraw/zinc/80/58/22/584805822.db2.gz KMWJYMVEMRPQSZ-LBPRGKRZSA-N 2 0 230.421 2.333 20 0 BEADRP C[C@@H]1CC=CC[C@H]1[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000903850370 584808049 /nfs/dbraw/zinc/80/80/49/584808049.db2.gz PESYZNTXVLSSGJ-MGPQQGTHSA-N 2 0 222.376 2.320 20 0 BEADRP C[C@@H]1CC=CC[C@H]1[NH2+]C[C@@H]1CC[C@H]([NH3+])C1 ZINC000903850346 584808351 /nfs/dbraw/zinc/80/83/51/584808351.db2.gz OSHKEYPEMAPMHV-FVCCEPFGSA-N 2 0 208.349 2.058 20 0 BEADRP CC(C)=CCC[N@@H+]1CC[C@@H]2CC[C@]21CN ZINC000903856535 584808814 /nfs/dbraw/zinc/80/88/14/584808814.db2.gz ABFUZHQDEOEACN-STQMWFEESA-N 2 0 208.349 2.156 20 0 BEADRP CC(C)=CCCN1CCC[C@]12CC[NH2+]C2 ZINC000903869084 584813619 /nfs/dbraw/zinc/81/36/19/584813619.db2.gz BAKGQWUZPIHJAC-CYBMUJFWSA-N 2 0 208.349 2.171 20 0 BEADRP C[C@H](CC(C)(C)C)[NH2+]C[C@H]([NH3+])CC(F)F ZINC000903925449 584823450 /nfs/dbraw/zinc/82/34/50/584823450.db2.gz FMZIXTAOBLDGEG-RKDXNWHRSA-N 2 0 222.323 2.383 20 0 BEADRP C[C@@H]1CC2(CCC2)CN1C[C@@H]([NH3+])CC(F)F ZINC000903917818 584827013 /nfs/dbraw/zinc/82/70/13/584827013.db2.gz NSSSCYXVEWBTGX-ZJUUUORDSA-N 2 0 232.318 2.233 20 0 BEADRP CCOc1ccccc1C[NH2+]CCC(C)(C)[NH3+] ZINC000903941228 584829152 /nfs/dbraw/zinc/82/91/52/584829152.db2.gz RVYGLEJRZLQLBU-UHFFFAOYSA-N 2 0 236.359 2.302 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1C[NH2+]CCC1(F)F)C1CCC1 ZINC000903956119 584831910 /nfs/dbraw/zinc/83/19/10/584831910.db2.gz HEZZNDYGNPSCHH-KOLCDFICSA-N 2 0 232.318 2.009 20 0 BEADRP CCC[C@@H](CC)[NH2+]C[C@@H]1C[NH2+]CCC1(F)F ZINC000903955939 584832138 /nfs/dbraw/zinc/83/21/38/584832138.db2.gz CHUBLZXKNQTOGF-WDEREUQCSA-N 2 0 234.334 2.400 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[NH2+]CCC1(F)F)C1CCC1 ZINC000903956118 584832392 /nfs/dbraw/zinc/83/23/92/584832392.db2.gz HEZZNDYGNPSCHH-GXSJLCMTSA-N 2 0 232.318 2.009 20 0 BEADRP CCC[C@@H](CC)[NH2+]CC[C@@H]1C[NH2+]C[C@H]1C ZINC000903974161 584832665 /nfs/dbraw/zinc/83/26/65/584832665.db2.gz KMZJWSDOWRJXGA-JHJVBQTASA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+]C/C=C\c1ccccc1 ZINC000903964270 584833787 /nfs/dbraw/zinc/83/37/87/584833787.db2.gz HBAJDWXWJMIDGE-VZFGUZNESA-N 2 0 230.355 2.145 20 0 BEADRP CC[C@@H]1CCC[C@H]([NH2+][C@@H]2C[NH2+]C[C@H]2C)C1 ZINC000903964091 584834003 /nfs/dbraw/zinc/83/40/03/584834003.db2.gz LHTFSQQFQJEZLJ-FVCCEPFGSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+]C1CCC(C)(C)CC1 ZINC000903964398 584834017 /nfs/dbraw/zinc/83/40/17/584834017.db2.gz PGDPNDYVNUCSHN-ZYHUDNBSSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@@H]1CCC[C@@H]([NH2+]C[C@@H]2C[NH2+]C[C@H]2C)C1 ZINC000903967051 584834359 /nfs/dbraw/zinc/83/43/59/584834359.db2.gz FONGHLKMWMPSAU-YIYPIFLZSA-N 2 0 224.392 2.400 20 0 BEADRP CCOc1cccc(C[NH2+]C[C@@H]2C[NH2+]C[C@H]2C)c1 ZINC000903965109 584834557 /nfs/dbraw/zinc/83/45/57/584834557.db2.gz VPALBUKTYCMFOK-OCCSQVGLSA-N 2 0 248.370 2.030 20 0 BEADRP C[C@H](CCc1ccccc1)C[NH2+][C@@H]1C[NH2+]C[C@H]1C ZINC000903965096 584834640 /nfs/dbraw/zinc/83/46/40/584834640.db2.gz ZZXWVKFHKNDOIS-IIAWOOMASA-N 2 0 246.398 2.453 20 0 BEADRP CC[C@H](Cc1ccccc1)[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000903967747 584834934 /nfs/dbraw/zinc/83/49/34/584834934.db2.gz MXURHVLIJABDNK-VNQPRFMTSA-N 2 0 246.398 2.453 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+]C[C@@H]1CCC[C@H](C)C1 ZINC000903968316 584834962 /nfs/dbraw/zinc/83/49/62/584834962.db2.gz SEHKKPCVNBLELM-DGAVXFQQSA-N 2 0 224.392 2.258 20 0 BEADRP CC(C)[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000903968514 584835008 /nfs/dbraw/zinc/83/50/08/584835008.db2.gz XAAGGGOBUVJCKU-ZOBORPQBSA-N 2 0 224.392 2.256 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+]C[C@H]1CCC[C@@H](C)C1 ZINC000903968317 584835100 /nfs/dbraw/zinc/83/51/00/584835100.db2.gz SEHKKPCVNBLELM-MQYQWHSLSA-N 2 0 224.392 2.258 20 0 BEADRP CC(C)(/C=C\Cl)[NH2+]CC1CC[NH2+]CC1 ZINC000903988229 584835890 /nfs/dbraw/zinc/83/58/90/584835890.db2.gz PJIODEXAEWTKQE-WAYWQWQTSA-N 2 0 216.756 2.107 20 0 BEADRP Cc1ccccc1OCC[N@@H+](C)C[C@H]1C[C@@H]([NH3+])C1 ZINC000904305356 584862083 /nfs/dbraw/zinc/86/20/83/584862083.db2.gz LROOXOGYMKFCCX-OKILXGFUSA-N 2 0 248.370 2.043 20 0 BEADRP Cc1ccc(OCC[N@@H+](C)C[C@H]2C[C@@H]([NH3+])C2)cc1 ZINC000904305031 584862188 /nfs/dbraw/zinc/86/21/88/584862188.db2.gz BIFGKXYXSFHHFM-OKILXGFUSA-N 2 0 248.370 2.043 20 0 BEADRP CCC[N@H+](C[C@H]1C[C@@H]([NH3+])C1)C[C@H]1CCCCO1 ZINC000904318550 584863849 /nfs/dbraw/zinc/86/38/49/584863849.db2.gz SAGBJALZAYLLCJ-HZSPNIEDSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@@H]1C[C@@H]2CCCC[C@H]2[N@@H+]1C[C@H]1C[C@@H]([NH3+])C1 ZINC000904321321 584863958 /nfs/dbraw/zinc/86/39/58/584863958.db2.gz WKZXERGMKPHTTR-PEBLQZBPSA-N 2 0 222.376 2.377 20 0 BEADRP C[C@@H]1C[C@H]2CCCC[C@H]2[N@@H+]1C[C@H]1C[C@@H]([NH3+])C1 ZINC000904321323 584864138 /nfs/dbraw/zinc/86/41/38/584864138.db2.gz WKZXERGMKPHTTR-XGFWRYKXSA-N 2 0 222.376 2.377 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[N@@H+]2CC[C@H](c3cccc(F)c3)C2)C1 ZINC000904316980 584864327 /nfs/dbraw/zinc/86/43/27/584864327.db2.gz BPACRROYEJHODE-CORIIIEPSA-N 2 0 248.345 2.352 20 0 BEADRP Cc1cccc([C@H]2CCC[N@@H+]2C[C@H]2C[C@@H]([NH3+])C2)n1 ZINC000904322140 584864960 /nfs/dbraw/zinc/86/49/60/584864960.db2.gz PUTNLXFZMAXZTN-VNHYZAJKSA-N 2 0 245.370 2.264 20 0 BEADRP CC(C)CC1CC[NH+](C[C@H]2C[C@@H]([NH3+])C2)CC1 ZINC000904327990 584865306 /nfs/dbraw/zinc/86/53/06/584865306.db2.gz KVGHBGGPLVUQCP-OKILXGFUSA-N 2 0 224.392 2.482 20 0 BEADRP C[C@@H]1CC[C@@]2(CC[N@H+](C[C@H]3C[C@@H]([NH3+])C3)C2)C1 ZINC000904331726 584865891 /nfs/dbraw/zinc/86/58/91/584865891.db2.gz KQXHNBBUUYGZRD-YIYPIFLZSA-N 2 0 222.376 2.236 20 0 BEADRP C[C@H]1CC[C@]2(CC[N@H+](C[C@H]3C[C@@H]([NH3+])C3)C2)C1 ZINC000904331722 584865950 /nfs/dbraw/zinc/86/59/50/584865950.db2.gz KQXHNBBUUYGZRD-FQUUOJAGSA-N 2 0 222.376 2.236 20 0 BEADRP Cc1cc(F)ccc1C[N@H+](C)C[C@H]1C[C@@H]([NH3+])C1 ZINC000904342684 584867498 /nfs/dbraw/zinc/86/74/98/584867498.db2.gz NHLCQMNGRTYNID-VDISTLRHSA-N 2 0 236.334 2.303 20 0 BEADRP CCCC[C@H](C[NH3+])NC[C@@H]([NH3+])CCC(C)(C)C ZINC000904350888 584869526 /nfs/dbraw/zinc/86/95/26/584869526.db2.gz RXARTPBFROFUIA-QWHCGFSZSA-N 2 0 243.439 2.247 20 0 BEADRP C[NH2+]Cc1cccc(NC[C@@]2(C)CCC[NH2+]C2)c1 ZINC000904353647 584870456 /nfs/dbraw/zinc/87/04/56/584870456.db2.gz PWMDIXQYONICEV-HNNXBMFYSA-N 2 0 247.386 2.208 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@H]([NH3+])CCC(C)(C)C ZINC000904354840 584870660 /nfs/dbraw/zinc/87/06/60/584870660.db2.gz JOXBXAPQGHUIRP-CHWSQXEVSA-N 3 0 243.439 2.247 20 0 BEADRP CCc1ccccc1C[NH2+]C1CC(C[NH3+])C1 ZINC000904361890 584872142 /nfs/dbraw/zinc/87/21/42/584872142.db2.gz AVWFMAVGGGBJND-UHFFFAOYSA-N 2 0 218.344 2.076 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@H]2C[C@H]2C2CCCCC2)C1 ZINC000904368391 584872639 /nfs/dbraw/zinc/87/26/39/584872639.db2.gz QYBBCOIQWURXLG-GHYVTOPFSA-N 2 0 222.376 2.282 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[N@@H+]2Cc3ccc(Cl)cc3C2)C1 ZINC000904372151 584873384 /nfs/dbraw/zinc/87/33/84/584873384.db2.gz YNZXCAJDRDHZPP-SWZMTVOYSA-N 2 0 236.746 2.393 20 0 BEADRP COc1ccccc1C1([NH2+]C[C@H]2C[C@@H]([NH3+])C2)CC1 ZINC000904374589 584873623 /nfs/dbraw/zinc/87/36/23/584873623.db2.gz UXSNXIUQOWFJGL-TXEJJXNPSA-N 2 0 246.354 2.011 20 0 BEADRP CC(C)(C)c1ccncc1C[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000904373213 584873756 /nfs/dbraw/zinc/87/37/56/584873756.db2.gz MNFSVIFLJAUXNS-BJHJDKERSA-N 2 0 247.386 2.206 20 0 BEADRP Cc1cccc(C)c1CC[NH2+]C1CC(C[NH3+])C1 ZINC000904364211 584874486 /nfs/dbraw/zinc/87/44/86/584874486.db2.gz IMYOQPHGKBPZIM-UHFFFAOYSA-N 2 0 232.371 2.173 20 0 BEADRP CC(C)(C)CC[C@H]([NH3+])C[NH2+]C[C@@]1(C)CCCO1 ZINC000904366851 584874864 /nfs/dbraw/zinc/87/48/64/584874864.db2.gz RHHCPNLTXWVXSW-GXTWGEPZSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1c(F)cccc1F ZINC000904389702 584875602 /nfs/dbraw/zinc/87/56/02/584875602.db2.gz RGWNICUOBIPKAN-BBBLOLIVSA-N 2 0 240.297 2.353 20 0 BEADRP C[C@H](C[NH2+]C[C@@]1(C)CCC[NH2+]C1)c1ccccn1 ZINC000904377395 584876086 /nfs/dbraw/zinc/87/60/86/584876086.db2.gz PTUHMDOGRZFEJC-HIFRSBDPSA-N 2 0 247.386 2.164 20 0 BEADRP [NH3+]CC1CC([NH2+][C@@H]2CCc3ccccc32)C1 ZINC000904377836 584876194 /nfs/dbraw/zinc/87/61/94/584876194.db2.gz ZIYWXXZMQZELDM-MMWSSPAHSA-N 2 0 216.328 2.001 20 0 BEADRP [NH3+]CC1CC([NH2+][C@@H](CF)c2ccc(F)cc2)C1 ZINC000904383751 584877389 /nfs/dbraw/zinc/87/73/89/584877389.db2.gz DJRWMWNNAQPTQD-LDUAJXOISA-N 2 0 240.297 2.163 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@@H]([NH3+])CCC(C)(C)C)[C@@H](C)O1 ZINC000904384296 584877489 /nfs/dbraw/zinc/87/74/89/584877489.db2.gz JORBMVNANGSDMZ-NDBYEHHHSA-N 2 0 242.407 2.296 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@H](C[NH3+])[C@@H](C)C2)s1 ZINC000904412777 584879846 /nfs/dbraw/zinc/87/98/46/584879846.db2.gz XPOVGVRLOZEMHS-CMPLNLGQSA-N 2 0 238.400 2.473 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@H](C)CSC(C)(C)C ZINC000817957269 584991700 /nfs/dbraw/zinc/99/17/00/584991700.db2.gz ADIFIQUWOHHLIM-GHMZBOCLSA-N 2 0 232.437 2.480 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000839165343 585095038 /nfs/dbraw/zinc/09/50/38/585095038.db2.gz NKPGXCDSQLSUQO-MFKMUULPSA-N 2 0 215.300 2.222 20 0 BEADRP C[N@@H+]1CCC[C@@H](CC[NH2+]C[C@H]2CCC=CO2)C1 ZINC000839181975 585096571 /nfs/dbraw/zinc/09/65/71/585096571.db2.gz KVZGWZUMVYZUQT-UONOGXRCSA-N 2 0 238.375 2.001 20 0 BEADRP C[N@H+](CC1CC1)C[C@@H]1CCN(C/C=C\Cl)C1 ZINC000747530975 585180546 /nfs/dbraw/zinc/18/05/46/585180546.db2.gz ASXONKRLFQMDAK-XYRDXQRHSA-N 2 0 242.794 2.403 20 0 BEADRP CCCC[C@H](COC)[NH2+]CCN1CCC[C@H]1C ZINC000766271344 585500325 /nfs/dbraw/zinc/50/03/25/585500325.db2.gz UEHSITNMLCLHAD-ZIAGYGMSSA-N 2 0 242.407 2.266 20 0 BEADRP CC[N@@H+]1CC[C@H](N(C)Cc2ccoc2)[C@@H](C)C1 ZINC000769483321 585558216 /nfs/dbraw/zinc/55/82/16/585558216.db2.gz HUDGFPBTWASJNK-JSGCOSHPSA-N 2 0 236.359 2.442 20 0 BEADRP CC[N@@H+]1CC[C@@H](N(C)Cc2ccoc2)[C@@H](C)C1 ZINC000769483319 585558253 /nfs/dbraw/zinc/55/82/53/585558253.db2.gz HUDGFPBTWASJNK-GXTWGEPZSA-N 2 0 236.359 2.442 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]1[NH2+]CCc1cccs1 ZINC000300806302 585682111 /nfs/dbraw/zinc/68/21/11/585682111.db2.gz GJRCTDOCMYRRFZ-GFCCVEGCSA-N 2 0 238.400 2.268 20 0 BEADRP Cc1cc(C[NH2+]CC2=CC[N@H+](C)CC2)c(C)o1 ZINC000776256636 585694043 /nfs/dbraw/zinc/69/40/43/585694043.db2.gz FIVGFKDODZIRSI-UHFFFAOYSA-N 2 0 234.343 2.248 20 0 BEADRP C[C@@H](CCO)[NH2+]CCCC[N@@H+]1CCCC[C@H]1C ZINC000779341418 585751904 /nfs/dbraw/zinc/75/19/04/585751904.db2.gz MLIORNHSTDKUFO-UONOGXRCSA-N 2 0 242.407 2.002 20 0 BEADRP C[C@@H]1[C@H](C)SCC[N@@H+]1CC1CC[NH+](C)CC1 ZINC000788480475 585925142 /nfs/dbraw/zinc/92/51/42/585925142.db2.gz KCPRQYVYALVYRU-NEPJUHHUSA-N 2 0 242.432 2.154 20 0 BEADRP CC[C@H]1CCC[N@H+](CC2CC[NH+](C)CC2)C1 ZINC000788471702 585925267 /nfs/dbraw/zinc/92/52/67/585925267.db2.gz YBLXCRTWAFKZEW-ZDUSSCGKSA-N 2 0 224.392 2.450 20 0 BEADRP C[C@@H]1C[C@H](C)C[N@@H+](CC2CC[NH+](C)CC2)C1 ZINC000788471714 585925368 /nfs/dbraw/zinc/92/53/68/585925368.db2.gz YVABGPKDJVUHNZ-BETUJISGSA-N 2 0 224.392 2.306 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)CC1 ZINC000788487236 585925535 /nfs/dbraw/zinc/92/55/35/585925535.db2.gz FKULEZBWKNMJKI-OAHLLOKOSA-N 2 0 247.386 2.493 20 0 BEADRP C[C@H]1C[C@@H]1C[N@@H+]1CCCC2(CC[NH+](C)CC2)C1 ZINC000798956979 586154601 /nfs/dbraw/zinc/15/46/01/586154601.db2.gz SECRWKPFDCMKQF-UONOGXRCSA-N 2 0 236.403 2.450 20 0 BEADRP CN1CC[C@@H]([NH2+]Cc2ccc3c(c2)CCCC3)C1 ZINC000813771801 586606318 /nfs/dbraw/zinc/60/63/18/586606318.db2.gz HLWTUTYMVKTJLU-MRXNPFEDSA-N 2 0 244.382 2.359 20 0 BEADRP CS[C@@H]1CC[C@@H]([NH2+][C@@H](C)[C@H]2CCC[NH2+]2)C1 ZINC000817897105 586835469 /nfs/dbraw/zinc/83/54/69/586835469.db2.gz FHHCBLNXUUOLAC-IRCOFANPSA-N 2 0 228.405 2.001 20 0 BEADRP CS[C@@H]1CC[C@H]([NH2+][C@@H]2CC[NH2+]CC[C@H]2C)C1 ZINC000817900505 586835805 /nfs/dbraw/zinc/83/58/05/586835805.db2.gz PHDXFVDZAIFMOO-YVECIDJPSA-N 2 0 242.432 2.248 20 0 BEADRP CSC(C)(C)C[NH2+][C@@H]1CC[NH2+]CC[C@@H]1C ZINC000817899296 586836160 /nfs/dbraw/zinc/83/61/60/586836160.db2.gz KVYLSWBWOOJYLP-WDEREUQCSA-N 2 0 230.421 2.106 20 0 BEADRP CCN(C)c1ccccc1C[NH2+][C@@H](C)C[C@@H](C)[NH3+] ZINC000817902622 586836331 /nfs/dbraw/zinc/83/63/31/586836331.db2.gz VMVWALXNJWZMFI-OLZOCXBDSA-N 2 0 249.402 2.358 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H](C)c1ccc2c(c1)CCO2 ZINC000817901507 586836511 /nfs/dbraw/zinc/83/65/11/586836511.db2.gz WNLOHSVNSYICEM-VXGBXAGGSA-N 2 0 248.370 2.400 20 0 BEADRP Cc1cccc(C)c1C[NH2+][C@H]1CCC[C@@H]1[NH3+] ZINC000817909091 586837068 /nfs/dbraw/zinc/83/70/68/586837068.db2.gz XQTMCYBEZJNHLA-KBPBESRZSA-N 2 0 218.344 2.273 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+]CCC1CCC1 ZINC000817906745 586837258 /nfs/dbraw/zinc/83/72/58/586837258.db2.gz FEBYWKPSRBGQTL-AAEUAGOBSA-N 2 0 210.365 2.154 20 0 BEADRP CCOc1cccc([C@H](C)[NH2+]CCC[NH3+])c1 ZINC000817938739 586844480 /nfs/dbraw/zinc/84/44/80/586844480.db2.gz RCYLWPZHGDVHSD-NSHDSACASA-N 2 0 222.332 2.085 20 0 BEADRP C[NH2+]CCC[NH2+][C@H](C)c1ccc(F)cc1C ZINC000817940916 586844912 /nfs/dbraw/zinc/84/49/12/586844912.db2.gz PDNUYIFPSSTUPU-LLVKDONJSA-N 2 0 224.323 2.394 20 0 BEADRP CCOc1cccc([C@@H](C)[NH2+]CCC[NH2+]C)c1 ZINC000817941268 586845328 /nfs/dbraw/zinc/84/53/28/586845328.db2.gz QTSKMECOLKFKNE-GFCCVEGCSA-N 2 0 236.359 2.345 20 0 BEADRP CC[C@H]([NH2+]CC[C@H](C)[NH3+])c1ccc2c(c1)CCO2 ZINC000817953948 586848626 /nfs/dbraw/zinc/84/86/26/586848626.db2.gz WSAQRPXGIYPJIO-FZMZJTMJSA-N 2 0 248.370 2.400 20 0 BEADRP C[C@H](CSC(C)(C)C)[NH2+][C@H](C)[C@H](C)[NH3+] ZINC000817978012 586862011 /nfs/dbraw/zinc/86/20/11/586862011.db2.gz TVNAYRGQLURIHY-KXUCPTDWSA-N 2 0 218.410 2.232 20 0 BEADRP CCOc1cccc([C@@H](C)[NH2+]C[C@@H](C)C[NH3+])c1 ZINC000817961829 586852844 /nfs/dbraw/zinc/85/28/44/586852844.db2.gz DHKHZPCIIUSOAO-NWDGAFQWSA-N 2 0 236.359 2.331 20 0 BEADRP CC[C@@H]([NH2+]CC(C)(C)[NH3+])c1ccc2c(c1)CCO2 ZINC000817961250 586853304 /nfs/dbraw/zinc/85/33/04/586853304.db2.gz ZQVPBYCDJVAJAA-CYBMUJFWSA-N 2 0 248.370 2.400 20 0 BEADRP Cc1ccc2c(c1)CC[C@@H]2[NH2+]CC1([NH3+])CCC1 ZINC000817965769 586855446 /nfs/dbraw/zinc/85/54/46/586855446.db2.gz ZVKRUEJQBKWLLA-AWEZNQCLSA-N 2 0 230.355 2.453 20 0 BEADRP CCCCC[C@@H](C)[NH2+]CC1=CC[NH2+]CC1 ZINC000817968741 586855964 /nfs/dbraw/zinc/85/59/64/586855964.db2.gz WRNDWLPJHMTDHU-GFCCVEGCSA-N 2 0 210.365 2.465 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+][C@H]1CCC[NH2+]CC1 ZINC000817968536 586855987 /nfs/dbraw/zinc/85/59/87/586855987.db2.gz LFYQGQWUOMNFFM-RWMBFGLXSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH3+])C[NH2+][C@@H]1CC[C@H]2CCCC[C@H]2C1 ZINC000817971264 586858748 /nfs/dbraw/zinc/85/87/48/586858748.db2.gz LNBBKTHCMGCMOI-QNWHQSFQSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000817976675 586860312 /nfs/dbraw/zinc/86/03/12/586860312.db2.gz QYKXNIFRSGVSPD-RWMBFGLXSA-N 2 0 222.376 2.153 20 0 BEADRP C[NH+](C)CCCCCCC[NH2+]CC1(O)CCC1 ZINC000819390261 586960945 /nfs/dbraw/zinc/96/09/45/586960945.db2.gz RXNHVPYPRFGODO-UHFFFAOYSA-N 2 0 242.407 2.003 20 0 BEADRP Cc1cc([C@@H]2CCC[N@@H+]2CC2CC[NH2+]CC2)no1 ZINC000823578917 587232164 /nfs/dbraw/zinc/23/21/64/587232164.db2.gz KHWQFGVFCKDOHO-AWEZNQCLSA-N 2 0 249.358 2.120 20 0 BEADRP CC(C)[C@@H]1C[C@H]1C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000834894308 587769589 /nfs/dbraw/zinc/76/95/89/587769589.db2.gz SGXDKJXCBKTCGP-MNFFZHCASA-N 2 0 236.403 2.493 20 0 BEADRP c1ccc2c(c1)cncc2CNC[C@H]1CCC[NH2+]1 ZINC000841035162 587936891 /nfs/dbraw/zinc/93/68/91/587936891.db2.gz INORUIMQMGUYND-CQSZACIVSA-N 2 0 241.338 2.076 20 0 BEADRP [NH3+][C@@H](C[NH2+]C1CCCCCCC1)C1CC1 ZINC000841050670 587939703 /nfs/dbraw/zinc/93/97/03/587939703.db2.gz KBGYNYBEPDWQCF-ZDUSSCGKSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@H](CC[NH3+])[NH2+]Cc1ccc2c(c1)CC(C)(C)O2 ZINC000841053107 587939876 /nfs/dbraw/zinc/93/98/76/587939876.db2.gz ZONDDWNLOLOVBA-LLVKDONJSA-N 2 0 248.370 2.227 20 0 BEADRP CCCCCC[C@H](C)[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000841081374 587944552 /nfs/dbraw/zinc/94/45/52/587944552.db2.gz WBSALCSDINHQST-WUHRBBMRSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H](C[N@@H+]1CC[C@]2(CCC[NH2+]2)C1)C(C)(C)C ZINC000841105340 587946830 /nfs/dbraw/zinc/94/68/30/587946830.db2.gz KIRODYTYJBEPPE-TZMCWYRMSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)(C)[C@H](C[NH3+])NCc1ccnc(Cl)c1 ZINC000842475114 588029077 /nfs/dbraw/zinc/02/90/77/588029077.db2.gz JVLPWGYQOHMRNB-JTQLQIEISA-N 2 0 241.766 2.198 20 0 BEADRP C[C@H]([NH2+]CCCCCCC[NH3+])[C@@H]1CCCOC1 ZINC000842478674 588029914 /nfs/dbraw/zinc/02/99/14/588029914.db2.gz MHBXZDXTWGIVSF-UONOGXRCSA-N 2 0 242.407 2.300 20 0 BEADRP [NH3+]C1CCC([NH2+]Cc2cccnc2Cl)CC1 ZINC000843105061 588081626 /nfs/dbraw/zinc/08/16/26/588081626.db2.gz PRGHAHPISACXCN-UHFFFAOYSA-N 2 0 239.750 2.095 20 0 BEADRP [NH3+]CCCCCC[NH2+]Cc1cccc(O)c1 ZINC000843127235 588085095 /nfs/dbraw/zinc/08/50/95/588085095.db2.gz CVDOXGZPBUPTJH-UHFFFAOYSA-N 2 0 222.332 2.001 20 0 BEADRP C[C@H](N)[C@@H]1CCCC[N@@H+]1CCCCCCC[NH3+] ZINC000843347948 588102558 /nfs/dbraw/zinc/10/25/58/588102558.db2.gz YXEAJFDMSLKFBW-KBPBESRZSA-N 2 0 241.423 2.097 20 0 BEADRP C[C@H](N)[C@H]1CCCC[N@@H+]1CCCCCCC[NH3+] ZINC000843347951 588102686 /nfs/dbraw/zinc/10/26/86/588102686.db2.gz YXEAJFDMSLKFBW-UONOGXRCSA-N 2 0 241.423 2.097 20 0 BEADRP [NH3+]CCCCCC[N@@H+]1CCOCC2(CCC2)C1 ZINC000846224534 588261712 /nfs/dbraw/zinc/26/17/12/588261712.db2.gz ZMZPMGLPXXTHID-UHFFFAOYSA-N 2 0 240.391 2.008 20 0 BEADRP CC[C@H]([NH2+]CCN1CCCC1)[C@H]1CCCCO1 ZINC000847089859 588305848 /nfs/dbraw/zinc/30/58/48/588305848.db2.gz LJZPEALHZUSGGI-UONOGXRCSA-N 2 0 240.391 2.020 20 0 BEADRP CC(C)[C@H]1CC[C@H]1[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000848557159 588396958 /nfs/dbraw/zinc/39/69/58/588396958.db2.gz FVOQTXBYRARQRS-XJFOESAGSA-N 2 0 224.392 2.351 20 0 BEADRP Cc1cc(C[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)c(C)o1 ZINC000848562061 588397714 /nfs/dbraw/zinc/39/77/14/588397714.db2.gz GRZJQBBZBBMQCV-XBXGTLAGSA-N 2 0 236.359 2.326 20 0 BEADRP C[C@H](O)c1ccc(C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)cc1 ZINC000848717895 588407836 /nfs/dbraw/zinc/40/78/36/588407836.db2.gz XACUTDYKDVGZBW-TUKIKUTGSA-N 2 0 248.370 2.099 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@@H]2C=CCC2)[C@H]2CCC[C@H]21 ZINC000850506205 588552858 /nfs/dbraw/zinc/55/28/58/588552858.db2.gz CLCOFTAKLSGUJG-YIYPIFLZSA-N 2 0 220.360 2.167 20 0 BEADRP C[N@H+](Cc1cc(C2CC2)no1)C1CCC([NH3+])CC1 ZINC000852741309 588698423 /nfs/dbraw/zinc/69/84/23/588698423.db2.gz QGFHERVPSCQRFF-UHFFFAOYSA-N 2 0 249.358 2.254 20 0 BEADRP C1=CCC(C[N@@H+]2CCC3(C2)CC[NH2+]CC3)C1 ZINC000852746844 588698747 /nfs/dbraw/zinc/69/87/47/588698747.db2.gz RNNIOZOCFFSRGK-UHFFFAOYSA-N 2 0 220.360 2.028 20 0 BEADRP CC(C)=CCC[N@@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000852746703 588698895 /nfs/dbraw/zinc/69/88/95/588698895.db2.gz PHKHHPKTXAVASG-UHFFFAOYSA-N 2 0 222.376 2.418 20 0 BEADRP C[C@H]([NH3+])CN(C)CCCc1c(F)cccc1F ZINC000863567818 589299877 /nfs/dbraw/zinc/29/98/77/589299877.db2.gz GZWFXCMKYSGPKP-JTQLQIEISA-N 2 0 242.313 2.176 20 0 BEADRP CCc1cc(N2CC[C@H]3[C@@H](CC[N@@H+]3C)C2)cc[nH+]1 ZINC000866206198 589480250 /nfs/dbraw/zinc/48/02/50/589480250.db2.gz BYVAPYLYPSMFKE-WFASDCNBSA-N 2 0 245.370 2.174 20 0 BEADRP C[N@H+](Cc1coc(C2CC2)n1)C1CCC([NH3+])CC1 ZINC000866660933 589508223 /nfs/dbraw/zinc/50/82/23/589508223.db2.gz IXICCLFJBIJNNW-UHFFFAOYSA-N 2 0 249.358 2.254 20 0 BEADRP C(CC1CC1)C[NH+]1CCC([C@H]2CC[NH2+]C2)CC1 ZINC000866666741 589509318 /nfs/dbraw/zinc/50/93/18/589509318.db2.gz WCYUEWDADKVWCZ-HNNXBMFYSA-N 2 0 236.403 2.498 20 0 BEADRP CC(C)(C)[C@@]1(C[NH3+])CC[N@H+](CC2CCC2)C1 ZINC000866703583 589513583 /nfs/dbraw/zinc/51/35/83/589513583.db2.gz KBROADZITSRMRS-CQSZACIVSA-N 2 0 224.392 2.483 20 0 BEADRP CC(C)(C)[C@]1(C[NH3+])CC[N@H+](Cc2ccncc2)C1 ZINC000866706413 589514427 /nfs/dbraw/zinc/51/44/27/589514427.db2.gz HZTMUZXNUSBNLU-HNNXBMFYSA-N 2 0 247.386 2.279 20 0 BEADRP CC(C)(C)[C@@]1(C[NH3+])CC[N@H+](CCCF)C1 ZINC000866709703 589514590 /nfs/dbraw/zinc/51/45/90/589514590.db2.gz ZBNGTQHCPVPSNY-GFCCVEGCSA-N 2 0 216.344 2.043 20 0 BEADRP [NH3+]CCCCCC[N@@H+]1CC[C@@H]2CSC[C@H]2C1 ZINC000866704865 589514667 /nfs/dbraw/zinc/51/46/67/589514667.db2.gz ZAFAXPRKSYZRKG-CHWSQXEVSA-N 2 0 242.432 2.190 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CC[C@](C[NH3+])(C(C)(C)C)C1 ZINC000866706705 589514792 /nfs/dbraw/zinc/51/47/92/589514792.db2.gz CBRCWGPTCHANEN-YRGRVCCFSA-N 2 0 224.392 2.339 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CC(C)(C)SC)[C@H](C)C1 ZINC000122160114 589557488 /nfs/dbraw/zinc/55/74/88/589557488.db2.gz GREXUTXZCBMEMX-NEPJUHHUSA-N 2 0 244.448 2.448 20 0 BEADRP CC[C@@H]1C[N@H+](CCc2cccs2)CC[C@@H]1[NH3+] ZINC000122882848 589642604 /nfs/dbraw/zinc/64/26/04/589642604.db2.gz BYLXOVIVYIJYOQ-YPMHNXCESA-N 2 0 238.400 2.350 20 0 BEADRP C[N@H+](CCCCCC[NH3+])CCCc1ccncc1 ZINC000872155333 589885939 /nfs/dbraw/zinc/88/59/39/589885939.db2.gz IVSIBKWKEXPQHA-UHFFFAOYSA-N 2 0 249.402 2.465 20 0 BEADRP CC[N@@H+]1CCN(c2cc[nH+]cc2C2CC2)C[C@H]1C ZINC000872492131 589944477 /nfs/dbraw/zinc/94/44/77/589944477.db2.gz CLHTUCODGWBRLZ-GFCCVEGCSA-N 2 0 245.370 2.489 20 0 BEADRP Cc1cc(N2CC[C@H]3[C@H]2CCC[N@H+]3C)cc[nH+]1 ZINC000872780119 589969804 /nfs/dbraw/zinc/96/98/04/589969804.db2.gz JQLNXHOTOOJGPE-UONOGXRCSA-N 2 0 231.343 2.063 20 0 BEADRP Cc1cc(N2CC[C@H]3[C@@H]2CCC[N@H+]3C)cc[nH+]1 ZINC000872780117 589970147 /nfs/dbraw/zinc/97/01/47/589970147.db2.gz JQLNXHOTOOJGPE-KBPBESRZSA-N 2 0 231.343 2.063 20 0 BEADRP C[C@H](C[C@@H]1CCC[NH2+]1)[NH2+][C@@H]1CCCC[C@@H]1F ZINC000873217696 589998408 /nfs/dbraw/zinc/99/84/08/589998408.db2.gz PMTCXMBWQYIXPR-MROQNXINSA-N 2 0 228.355 2.387 20 0 BEADRP CCC[C@H](C)C[NH2+]C1(CCOC)CC[NH2+]CC1 ZINC000873225426 589999029 /nfs/dbraw/zinc/99/90/29/589999029.db2.gz YGQPAWIWAVDQPU-ZDUSSCGKSA-N 2 0 242.407 2.171 20 0 BEADRP COC[C@@H](CC(C)C)[NH2+][C@@H](C)C1CC[NH2+]CC1 ZINC000873220676 589999130 /nfs/dbraw/zinc/99/91/30/589999130.db2.gz RAPAOKMHEMLGJS-GXTWGEPZSA-N 2 0 242.407 2.025 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@H](C)C1)C1CC[NH2+]CC1 ZINC000873222216 589999518 /nfs/dbraw/zinc/99/95/18/589999518.db2.gz GXRKCHJPEYRNFU-GMXVVIOVSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)(C)[NH2+]CCN1CC[C@@H]2CSC[C@H]2C1 ZINC000873221920 590000121 /nfs/dbraw/zinc/00/01/21/590000121.db2.gz TYOKECOOZIEUIP-VXGBXAGGSA-N 2 0 242.432 2.059 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+][C@@H]1CCCC[C@@H]1F ZINC000873238969 590005599 /nfs/dbraw/zinc/00/55/99/590005599.db2.gz KQSVPWGASAJAKJ-WUHRBBMRSA-N 2 0 228.355 2.374 20 0 BEADRP [NH3+]C[C@H]1CC[C@H]([NH2+][C@@H]2CC[C@H]2C2CC2)CC1 ZINC000873238863 590005638 /nfs/dbraw/zinc/00/56/38/590005638.db2.gz IJERLFTVFFPPFI-DOERSZECSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]CC[C@@H]1CCCS1 ZINC000873243266 590006592 /nfs/dbraw/zinc/00/65/92/590006592.db2.gz KIRLUYYXGUDBRZ-FRRDWIJNSA-N 2 0 242.432 2.250 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CCCS1)[C@H]1CCC[NH2+]1 ZINC000873242987 590007062 /nfs/dbraw/zinc/00/70/62/590007062.db2.gz HNSOZSVWJBYUHH-GRYCIOLGSA-N 2 0 228.405 2.002 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@H]2C[C@@H]([NH3+])C2)C[C@H]1C ZINC000873251668 590008200 /nfs/dbraw/zinc/00/82/00/590008200.db2.gz MXFCUJQKBXLGHR-KVSVUVNWSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H](CCCc1cccnc1)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873251108 590008233 /nfs/dbraw/zinc/00/82/33/590008233.db2.gz SZZFRGAJAYIILO-AEGPPILISA-N 2 0 247.386 2.120 20 0 BEADRP CCC[C@@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1cccnc1 ZINC000873250600 590008327 /nfs/dbraw/zinc/00/83/27/590008327.db2.gz QCCKILIJOQNEDW-KWCYVHTRSA-N 2 0 233.359 2.250 20 0 BEADRP COc1ccc([C@@H](C)[NH2+]C[C@H]2C[C@@H]([NH3+])C2)c(C)c1 ZINC000873251895 590008878 /nfs/dbraw/zinc/00/88/78/590008878.db2.gz YBFWSFHPQRHJNH-UPJWGTAASA-N 2 0 248.370 2.392 20 0 BEADRP CC[C@@H]1CCC[C@@H]([NH2+]C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000873254273 590009403 /nfs/dbraw/zinc/00/94/03/590009403.db2.gz PDOFKFPQWFHYQJ-FVCCEPFGSA-N 2 0 210.365 2.282 20 0 BEADRP CCOc1ccccc1[C@H](C)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873254010 590009650 /nfs/dbraw/zinc/00/96/50/590009650.db2.gz JAKXPYNTWIAMIK-RWMBFGLXSA-N 2 0 248.370 2.473 20 0 BEADRP Cc1ccccc1C[C@@H](C)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873253724 590009685 /nfs/dbraw/zinc/00/96/85/590009685.db2.gz DARVMKJOKLXBOU-NFAWXSAZSA-N 2 0 232.371 2.253 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccsc1 ZINC000873253605 590009824 /nfs/dbraw/zinc/00/98/24/590009824.db2.gz BCGFBOQSOXIULL-ATZCPNFKSA-N 2 0 210.346 2.136 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1ccc(Cl)cn1 ZINC000873254899 590009976 /nfs/dbraw/zinc/00/99/76/590009976.db2.gz ATERNKTVZKEUPO-QXEWZRGKSA-N 2 0 239.750 2.123 20 0 BEADRP C[C@H]1CC(C)(C)C[C@@H]1[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873255258 590010021 /nfs/dbraw/zinc/01/00/21/590010021.db2.gz FMQBQXHCGRBNAY-BJDJZHNGSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1ccc(Cl)cn1 ZINC000873254898 590010139 /nfs/dbraw/zinc/01/01/39/590010139.db2.gz ATERNKTVZKEUPO-FXPVBKGRSA-N 2 0 239.750 2.123 20 0 BEADRP CC1(C)CCC([NH2+]C[C@H]2C[C@@H]([NH3+])C2)CC1 ZINC000873254435 590010157 /nfs/dbraw/zinc/01/01/57/590010157.db2.gz TWVYYYQZOVRVJY-PHIMTYICSA-N 2 0 210.365 2.282 20 0 BEADRP CCC[C@@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1ccccn1 ZINC000873255130 590010413 /nfs/dbraw/zinc/01/04/13/590010413.db2.gz DJXBKIDFSMYRHN-JHJVBQTASA-N 2 0 233.359 2.250 20 0 BEADRP C[C@@H](CSC(C)(C)C)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873255722 590010556 /nfs/dbraw/zinc/01/05/56/590010556.db2.gz IWMWHQQSMSXVNC-DCAQKATOSA-N 2 0 230.421 2.234 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+][C@H]2CCCC23CCCC3)C1 ZINC000873255619 590010808 /nfs/dbraw/zinc/01/08/08/590010808.db2.gz IIZWSJLWRPEYRE-AVGNSLFASA-N 2 0 222.376 2.426 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+]C[C@H]2C[C@@H]([NH3+])C2)cc1 ZINC000873256142 590010982 /nfs/dbraw/zinc/01/09/82/590010982.db2.gz MEZOTVJROQFAJS-BZPMIXESSA-N 2 0 218.344 2.383 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+][C@H]2CCc3ccc(F)cc32)C1 ZINC000873257169 590011410 /nfs/dbraw/zinc/01/14/10/590011410.db2.gz DYYWODDBVWKQFW-WFBYXXMGSA-N 2 0 234.318 2.140 20 0 BEADRP CC[C@H](Cc1ccccc1)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873256537 590011436 /nfs/dbraw/zinc/01/14/36/590011436.db2.gz OZMJYCGOCOFCKB-QLFBSQMISA-N 2 0 232.371 2.335 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+][C@H]2CCCc3ccccc32)C1 ZINC000873256659 590011557 /nfs/dbraw/zinc/01/15/57/590011557.db2.gz BXJMVPBJXVUYHV-WHOFXGATSA-N 2 0 230.355 2.391 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccc2c(c1)CCO2 ZINC000873256928 590011664 /nfs/dbraw/zinc/01/16/64/590011664.db2.gz RCGXIFLJVMFKJT-COPLHBTASA-N 2 0 246.354 2.009 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+][C@@H](C2CC2)C2CCCC2)C1 ZINC000873256957 590011748 /nfs/dbraw/zinc/01/17/48/590011748.db2.gz RLGOABNWDPSFQW-LERXQTSPSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)C1C(C)(C)C1(C)C ZINC000873257257 590011860 /nfs/dbraw/zinc/01/18/60/590011860.db2.gz RQVOTLGSLGEAKX-GMTAPVOTSA-N 2 0 224.392 2.384 20 0 BEADRP C[C@@H](Cc1cccs1)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873257466 590012087 /nfs/dbraw/zinc/01/20/87/590012087.db2.gz HWAHWRIFKNEVRY-DCAQKATOSA-N 2 0 224.373 2.006 20 0 BEADRP CCOc1ccccc1[C@H](C)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873257602 590012093 /nfs/dbraw/zinc/01/20/93/590012093.db2.gz JAKXPYNTWIAMIK-AVGNSLFASA-N 2 0 248.370 2.473 20 0 BEADRP COc1ccc([C@@H](C)[NH2+]C[C@H]2C[C@H]([NH3+])C2)c(C)c1 ZINC000873257863 590012185 /nfs/dbraw/zinc/01/21/85/590012185.db2.gz YBFWSFHPQRHJNH-JHJVBQTASA-N 2 0 248.370 2.392 20 0 BEADRP C[C@@H]1CCC[C@@H](C)C1[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873257848 590012378 /nfs/dbraw/zinc/01/23/78/590012378.db2.gz VJFLHOHBCCGIHJ-DDHJBXDOSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@H](Cc1ccc(F)cc1)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873258056 590012551 /nfs/dbraw/zinc/01/25/51/590012551.db2.gz LQLPUOVMMJWWCI-MPKXVKKWSA-N 2 0 236.334 2.084 20 0 BEADRP CC[C@H](Cc1cccs1)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873258241 590012709 /nfs/dbraw/zinc/01/27/09/590012709.db2.gz YVGYRSHTLXGXSK-IJLUTSLNSA-N 2 0 238.400 2.396 20 0 BEADRP CCC[C@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1cccnc1 ZINC000873258315 590012884 /nfs/dbraw/zinc/01/28/84/590012884.db2.gz QCCKILIJOQNEDW-UBHSHLNASA-N 2 0 233.359 2.250 20 0 BEADRP CC[C@H](Cc1ccccc1)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873258362 590012904 /nfs/dbraw/zinc/01/29/04/590012904.db2.gz OZMJYCGOCOFCKB-RBSFLKMASA-N 2 0 232.371 2.335 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1ccc2c(c1)CCO2 ZINC000873258525 590012910 /nfs/dbraw/zinc/01/29/10/590012910.db2.gz RCGXIFLJVMFKJT-MJVIPROJSA-N 2 0 246.354 2.009 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccco1 ZINC000873260022 590013305 /nfs/dbraw/zinc/01/33/05/590013305.db2.gz QTNFJKUWSHEXEE-RVMXOQNASA-N 2 0 234.343 2.461 20 0 BEADRP C[C@H]1CCC[C@@H]1[NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000873260417 590013476 /nfs/dbraw/zinc/01/34/76/590013476.db2.gz ZZJKJANNTOKETI-HPCHECBXSA-N 2 0 222.376 2.295 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+][C@H](C)C1CC[NH2+]CC1 ZINC000873269519 590015288 /nfs/dbraw/zinc/01/52/88/590015288.db2.gz QUMXYHLBELIVNK-WZRBSPASSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@H]1CC[C@@H]1[NH2+][C@H](C)C1CC[NH2+]CC1 ZINC000873269516 590015447 /nfs/dbraw/zinc/01/54/47/590015447.db2.gz QUMXYHLBELIVNK-MDZLAQPJSA-N 2 0 210.365 2.153 20 0 BEADRP Cc1cncc([C@@H](C)[NH2+][C@@H](C)C2CC[NH2+]CC2)c1 ZINC000873271966 590016410 /nfs/dbraw/zinc/01/64/10/590016410.db2.gz NQDBZYHYTKKZHC-QWHCGFSZSA-N 2 0 247.386 2.429 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]C1([C@H]2CCCCO2)CCC1 ZINC000873277524 590017821 /nfs/dbraw/zinc/01/78/21/590017821.db2.gz TUTAKSXOFHCNMZ-YNEHKIRRSA-N 2 0 240.391 2.194 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]Cc1cccc2ncccc12 ZINC000873283881 590019830 /nfs/dbraw/zinc/01/98/30/590019830.db2.gz LOVMACHSGMZTLO-HIFRSBDPSA-N 2 0 241.338 2.204 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]Cc1cc(N)cc(F)c1 ZINC000873291538 590023154 /nfs/dbraw/zinc/02/31/54/590023154.db2.gz WYIZUJCLHPYORZ-JTQLQIEISA-N 2 0 239.338 2.015 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]C1CC(Nc2ccccc2)C1 ZINC000873295294 590024176 /nfs/dbraw/zinc/02/41/76/590024176.db2.gz DZJCTGJEOGJGPX-XOEAPDPESA-N 2 0 247.386 2.345 20 0 BEADRP Cc1ccc(OCC[N@H+]2CC[C@@H]([NH3+])C[C@@H]2C)cc1 ZINC000124596097 590061510 /nfs/dbraw/zinc/06/15/10/590061510.db2.gz MPGOWJJYQHADGT-UONOGXRCSA-N 2 0 248.370 2.185 20 0 BEADRP CCCC[NH2+]CCC[NH+]1CCC(C)CC1 ZINC000020146326 590078040 /nfs/dbraw/zinc/07/80/40/590078040.db2.gz KCSQLAFLUFBBCM-UHFFFAOYSA-N 2 0 212.381 2.498 20 0 BEADRP C[C@@H](CC1CCCC1)[NH2+][C@@H]1CCN(C)C1 ZINC000125586228 590171683 /nfs/dbraw/zinc/17/16/83/590171683.db2.gz AIWHJZRENOYRIG-WCQYABFASA-N 2 0 210.365 2.249 20 0 BEADRP CC[C@@H](C)[C@H](C[NH+]1CCC([NH+](C)C)CC1)OC ZINC000876596488 590219914 /nfs/dbraw/zinc/21/99/14/590219914.db2.gz RGBUPVIQBLDEAD-OCCSQVGLSA-N 2 0 242.407 2.074 20 0 BEADRP CC[C@H](C)[C@H](C[NH+]1CCC([NH+](C)C)CC1)OC ZINC000876596487 590219927 /nfs/dbraw/zinc/21/99/27/590219927.db2.gz RGBUPVIQBLDEAD-JSGCOSHPSA-N 2 0 242.407 2.074 20 0 BEADRP C[NH+](C)CCCC[NH2+]Cc1nc(Cl)cs1 ZINC000876988671 590265660 /nfs/dbraw/zinc/26/56/60/590265660.db2.gz IRUSYYWVYOAUIF-UHFFFAOYSA-N 2 0 247.795 2.228 20 0 BEADRP C[NH+]1CCC2(CC1)CC[NH+](CC1(F)CC1)CC2 ZINC000877684799 590391944 /nfs/dbraw/zinc/39/19/44/590391944.db2.gz YMLOJIBEPJODPN-UHFFFAOYSA-N 2 0 240.366 2.296 20 0 BEADRP CC(C)CC[N@@H+]1CC[C@@H]2[C@H](CC[NH+]2C)C1 ZINC000877740161 590406112 /nfs/dbraw/zinc/40/61/12/590406112.db2.gz IUCZJLMTGKADSU-CHWSQXEVSA-N 2 0 210.365 2.059 20 0 BEADRP CC(C)C1(C[N@@H+]2CC[C@@H]3[C@@H](CC[NH+]3C)C2)CC1 ZINC000877738846 590406695 /nfs/dbraw/zinc/40/66/95/590406695.db2.gz MOAAABAGEOMOJB-UONOGXRCSA-N 2 0 236.403 2.449 20 0 BEADRP C=C/C=C\CC[NH+]1CCC(C[NH+](C)C)CC1 ZINC000877969776 590462035 /nfs/dbraw/zinc/46/20/35/590462035.db2.gz HMLYDALFATXAFH-WAYWQWQTSA-N 2 0 222.376 2.392 20 0 BEADRP C[NH+](C)C[C@H]1CC[N@H+](CCCC2CC2)C1 ZINC000878104827 590495157 /nfs/dbraw/zinc/49/51/57/590495157.db2.gz QHXMKYABYXUKHE-CYBMUJFWSA-N 2 0 210.365 2.060 20 0 BEADRP C=C/C=C/CC[NH+]1CC[C@H](C[N@@H+](C)CC)C1 ZINC000878167687 590513833 /nfs/dbraw/zinc/51/38/33/590513833.db2.gz XTAQYJGBDQPQLC-PSKZRQQASA-N 2 0 222.376 2.392 20 0 BEADRP CC[NH+](CC)CCC[N@@H+]1C[C@H](OC)CC[C@@H]1C ZINC000879326838 590747590 /nfs/dbraw/zinc/74/75/90/590747590.db2.gz TZABLFFIELICBA-UONOGXRCSA-N 2 0 242.407 2.218 20 0 BEADRP CC[C@@H](C)[NH+]1CCC(C)([NH+]2CCC2)CC1 ZINC000880473798 591037708 /nfs/dbraw/zinc/03/77/08/591037708.db2.gz OVQGJRYAQTZDJR-GFCCVEGCSA-N 2 0 210.365 2.345 20 0 BEADRP CCc1ccccc1C[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000129278748 591274038 /nfs/dbraw/zinc/27/40/38/591274038.db2.gz PHYKLJDMJQJDDC-OAHLLOKOSA-N 2 0 232.371 2.481 20 0 BEADRP c1nc2n(c1C[NH2+]CC1(CC3CC3)CC1)CCC2 ZINC000883248245 591589887 /nfs/dbraw/zinc/58/98/87/591589887.db2.gz MNJDEMOMOCICDB-UHFFFAOYSA-N 2 0 245.370 2.499 20 0 BEADRP CCN1CC[C@@H]1C[NH2+][C@@H](C)CCC1CC1 ZINC000883355317 591626057 /nfs/dbraw/zinc/62/60/57/591626057.db2.gz OEQGGBSREGOLJZ-WCQYABFASA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H]1C[N@H+](CC[C@@H]2CCCC2(F)F)CC[C@@H]1[NH3+] ZINC000883417810 591653828 /nfs/dbraw/zinc/65/38/28/591653828.db2.gz NSFKDSANWZQVLX-WOPDTQHZSA-N 2 0 246.345 2.481 20 0 BEADRP CC(C)(C)[C@H](CN)[NH2+]C[C@H]1CCC2(CCC2)O1 ZINC000883429736 591659991 /nfs/dbraw/zinc/65/99/91/591659991.db2.gz CPOCJVUHIWFPHC-NEPJUHHUSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@H]1[C@@H]([NH3+])CCN1CC[C@H]1CCCC1(F)F ZINC000883430657 591662061 /nfs/dbraw/zinc/66/20/61/591662061.db2.gz ZRMNKQRMHTWWNL-AXFHLTTASA-N 2 0 232.318 2.233 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CCC[NH2+]C1)c1cccc(F)c1 ZINC000132027488 591684469 /nfs/dbraw/zinc/68/44/69/591684469.db2.gz QPXXIGZAUWEOEX-NEPJUHHUSA-N 2 0 236.334 2.476 20 0 BEADRP CSCC[C@@H](C)[NH2+][C@H](C)C1CC[NH+](C)CC1 ZINC000134076748 591882344 /nfs/dbraw/zinc/88/23/44/591882344.db2.gz SPTILQUSTNTHCY-VXGBXAGGSA-N 2 0 244.448 2.448 20 0 BEADRP C[C@@H]1CC[N@H+](CCC[NH3+])[C@H]1c1ccccc1 ZINC000886857793 592369204 /nfs/dbraw/zinc/36/92/04/592369204.db2.gz ADBFLKNMYIMBQP-TZMCWYRMSA-N 2 0 218.344 2.418 20 0 BEADRP CCCC[N@@H+]1CCN(c2cc[nH+]cc2)C[C@H]1C ZINC000887130847 592449004 /nfs/dbraw/zinc/44/90/04/592449004.db2.gz LRPCIFLAXJDBNT-CYBMUJFWSA-N 2 0 233.359 2.392 20 0 BEADRP CS[C@@H]1CC[C@H]([NH2+][C@H]2CCCC[C@H]2C[NH3+])C1 ZINC000300387867 592510399 /nfs/dbraw/zinc/51/03/99/592510399.db2.gz NHDAINSJQPXXNM-RVMXOQNASA-N 2 0 242.432 2.378 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]CC[C@@H]1CCCCO1 ZINC000223779480 592543435 /nfs/dbraw/zinc/54/34/35/592543435.db2.gz NSYQRFYQGDCNLK-IHRRRGAJSA-N 2 0 240.391 2.053 20 0 BEADRP C[NH+](C)CCC[NH2+]Cc1cccc2ncccc12 ZINC000124200902 592716722 /nfs/dbraw/zinc/71/67/22/592716722.db2.gz FPPYRXBNRADQAD-UHFFFAOYSA-N 2 0 243.354 2.276 20 0 BEADRP C[C@@H]([NH2+]CC(C)(C)C[NH+](C)C)C1(Cl)CC1 ZINC000695683792 987331381 /nfs/dbraw/zinc/33/13/81/987331381.db2.gz CXQDQBJKLZPBHI-SNVBAGLBSA-N 2 0 232.799 2.324 20 0 BEADRP Cc1noc(C)c1[C@H](C)[NH2+]CC1=CC[N@H+](C)CC1 ZINC000925707323 634393738 /nfs/dbraw/zinc/39/37/38/634393738.db2.gz PEEQTFKTQFMLER-JTQLQIEISA-N 2 0 249.358 2.204 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+]C[C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000925708330 634399845 /nfs/dbraw/zinc/39/98/45/634399845.db2.gz KVAXQVHWQVAVLZ-VOAKCMCISA-N 2 0 222.376 2.153 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+]CC1CCC(F)CC1 ZINC000925713005 634417511 /nfs/dbraw/zinc/41/75/11/634417511.db2.gz RIYXKRFSGFCCNJ-HTAVTVPLSA-N 2 0 228.355 2.245 20 0 BEADRP C[C@@H]1SCC[C@@H]1[NH2+][C@@H]1CC[NH2+]C12CCCC2 ZINC000925713802 634417814 /nfs/dbraw/zinc/41/78/14/634417814.db2.gz UJHQXTAQSAFNOM-SDDRHHMPSA-N 2 0 240.416 2.145 20 0 BEADRP CC[C@H]1C[N@H+](CC[C@H]2CCC[NH2+]C2)CCS1 ZINC000253056078 634469801 /nfs/dbraw/zinc/46/98/01/634469801.db2.gz AOSMSEJPAJJCTA-OLZOCXBDSA-N 2 0 242.432 2.204 20 0 BEADRP C[C@@H]1CCC[C@@H]1C[NH2+]CC1CC[NH+](C)CC1 ZINC000230664530 635491384 /nfs/dbraw/zinc/49/13/84/635491384.db2.gz MRXRTSUCEKRWSP-TZMCWYRMSA-N 2 0 224.392 2.354 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]C[C@@H]2C[C@H]2C(F)(F)F)C12CCC2 ZINC000925831930 635468803 /nfs/dbraw/zinc/46/88/03/635468803.db2.gz MWHUHSROSQMZQM-JXUBOQSCSA-N 2 0 248.292 2.044 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CC[NH2+]C23CCC3)CCS1 ZINC000925857689 635549024 /nfs/dbraw/zinc/54/90/24/635549024.db2.gz HWDBZXXVPOCKLH-GRYCIOLGSA-N 2 0 240.416 2.145 20 0 BEADRP CC1(C)C[N@H+](CCCCCCC[NH3+])CCO1 ZINC000036232714 635555977 /nfs/dbraw/zinc/55/59/77/635555977.db2.gz CEVUVOVAKALPID-UHFFFAOYSA-N 2 0 228.380 2.006 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCC[C@@H]2C[NH3+])CCS1 ZINC000925860941 635556032 /nfs/dbraw/zinc/55/60/32/635556032.db2.gz MLFDHHIIDPJSML-FDYHWXHSSA-N 2 0 242.432 2.378 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+]C1CCCCCCC1 ZINC000234709816 635559139 /nfs/dbraw/zinc/55/91/39/635559139.db2.gz AHSFABZNTZOGQI-CQSZACIVSA-N 2 0 242.407 2.443 20 0 BEADRP C[N@H+](Cc1ccc(F)cc1)CC(C)(C)C[NH3+] ZINC000051286127 631432131 /nfs/dbraw/zinc/43/21/31/631432131.db2.gz WFDZOCTZSZUYAM-UHFFFAOYSA-N 2 0 224.323 2.242 20 0 BEADRP C[N@@H+]1C[C@@H]2C[NH+](CCCC3CCC3)C[C@]2(C)C1 ZINC000933733215 631494341 /nfs/dbraw/zinc/49/43/41/631494341.db2.gz GNMFZKZIDONQFB-CABCVRRESA-N 2 0 236.403 2.450 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+]C[C@H]1CC1(Cl)Cl ZINC000308695397 631520345 /nfs/dbraw/zinc/52/03/45/631520345.db2.gz STNFAOWEDDQDMB-DTWKUNHWSA-N 2 0 239.190 2.110 20 0 BEADRP C[N@H+](CCC1CC1)C[C@@]1(C)CCC[NH2+]C1 ZINC000308810328 631528439 /nfs/dbraw/zinc/52/84/39/631528439.db2.gz CCVVCUSVWSKDJS-ZDUSSCGKSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@H]1CSCCC[N@@H+]1CC[C@H]1CCC[NH+]1C ZINC000934303796 631771860 /nfs/dbraw/zinc/77/18/60/631771860.db2.gz MGBJBYKEYXTDQY-QWHCGFSZSA-N 2 0 242.432 2.298 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CCSC(F)(F)F ZINC000309006759 631798544 /nfs/dbraw/zinc/79/85/44/631798544.db2.gz NLPGJLMMTCDZIM-QMMMGPOBSA-N 2 0 244.326 2.347 20 0 BEADRP CCN(CC[NH2+]CC1(C)CCC1)C(C)C ZINC000309027703 631809945 /nfs/dbraw/zinc/80/99/45/631809945.db2.gz BSYYJNFUWZRPFY-UHFFFAOYSA-N 2 0 212.381 2.497 20 0 BEADRP CC[C@H](C)NC(=[NH2+])NCC[NH+](C(C)C)C(C)C ZINC000848980947 631841750 /nfs/dbraw/zinc/84/17/50/631841750.db2.gz MHVFTLUVYZFLSR-LBPRGKRZSA-N 2 0 242.411 2.018 20 0 BEADRP C[C@H]1CCCN1CC[NH2+]C1CC(C)(C)C1 ZINC000309113048 631887973 /nfs/dbraw/zinc/88/79/73/631887973.db2.gz KICDNNCZAPULGP-NSHDSACASA-N 2 0 210.365 2.249 20 0 BEADRP CSC1(C[NH2+][C@@H]2CCCC[C@H]2C[NH3+])CCC1 ZINC000235088377 631944568 /nfs/dbraw/zinc/94/45/68/631944568.db2.gz JRPPMSVVLUEXAI-NWDGAFQWSA-N 2 0 242.432 2.379 20 0 BEADRP C[C@@H]([NH2+]C1CCC([NH3+])CC1)c1cncc(F)c1 ZINC000235182722 631995582 /nfs/dbraw/zinc/99/55/82/631995582.db2.gz VLZREOLNSXXZKJ-UHEGKEBESA-N 2 0 237.322 2.141 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+]C1CC(C(F)F)C1 ZINC000309352588 632010397 /nfs/dbraw/zinc/01/03/97/632010397.db2.gz NFPUKFZPFKUWPH-UHFFFAOYSA-N 2 0 234.334 2.350 20 0 BEADRP CC[N@H+](CC[C@H]1CCC[NH2+]C1)CC(C)C ZINC000051918976 632013134 /nfs/dbraw/zinc/01/31/34/632013134.db2.gz LAXQYNPOHZWJJC-CYBMUJFWSA-N 2 0 212.381 2.354 20 0 BEADRP C[C@@H]1C[C@H](C[N@H+](C)C2CCCC2)CC[NH2+]1 ZINC000235364332 632028629 /nfs/dbraw/zinc/02/86/29/632028629.db2.gz YVVAQYMKIRUPRE-VXGBXAGGSA-N 2 0 210.365 2.249 20 0 BEADRP CS[C@@H]1CC[C@H]([NH2+][C@@H]2CCCC[C@@H]2C[NH3+])C1 ZINC000235165079 632391460 /nfs/dbraw/zinc/39/14/60/632391460.db2.gz NHDAINSJQPXXNM-YVECIDJPSA-N 2 0 242.432 2.378 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCOc2ccccc21 ZINC000227122363 632417990 /nfs/dbraw/zinc/41/79/90/632417990.db2.gz AWKWSYYSTOMYNW-FPMFFAJLSA-N 2 0 246.354 2.227 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCC2CCC2)CC[N@@H+]1C ZINC000161867829 632439875 /nfs/dbraw/zinc/43/98/75/632439875.db2.gz NPOZMAIEMDPEAV-YPMHNXCESA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H]1C[C@H](C)[N@H+](C[C@]2(C)CCC[NH2+]C2)C1 ZINC000157967006 632454705 /nfs/dbraw/zinc/45/47/05/632454705.db2.gz SAQMVCPTEJXAAY-FRRDWIJNSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1C[C@H](C)C[N@@H+](C[C@@]2(C)CCC[NH2+]C2)C1 ZINC000219751178 632561472 /nfs/dbraw/zinc/56/14/72/632561472.db2.gz STIHNLVQLMFBQI-MJBXVCDLSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H]1C[C@H](C[N@H+](C)CC2CCCC2)CC[NH2+]1 ZINC000235364728 632678382 /nfs/dbraw/zinc/67/83/82/632678382.db2.gz XGJOYLGVOMIHRI-TZMCWYRMSA-N 2 0 224.392 2.497 20 0 BEADRP CC[NH+]1CCC(CC[NH2+][C@H]2CC[C@H]2C)CC1 ZINC000309942832 632685468 /nfs/dbraw/zinc/68/54/68/632685468.db2.gz CFZWYWZYOWWPDW-OCCSQVGLSA-N 2 0 224.392 2.497 20 0 BEADRP C[N@H+]1C[C@H]2CC[C@@H](C1)C2[NH2+]Cc1ccccc1 ZINC000924543594 632795394 /nfs/dbraw/zinc/79/53/94/632795394.db2.gz UDAQWDVNQRLRCM-YIONKMFJSA-N 2 0 230.355 2.116 20 0 BEADRP C(C1CC1)[NH+]1CCC([NH2+]C2CCCC2)CC1 ZINC000236573348 632996527 /nfs/dbraw/zinc/99/65/27/632996527.db2.gz MZBLFPDYJUQMLA-UHFFFAOYSA-N 2 0 222.376 2.393 20 0 BEADRP CC[C@H](C)C[C@H](C)[NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2 ZINC000328239239 633748224 /nfs/dbraw/zinc/74/82/24/633748224.db2.gz AQORXONMTIEWKH-YQFOFLOKSA-N 2 0 236.403 2.397 20 0 BEADRP CC(C)C1(C[NH2+][C@H]2[C@@H]3[NH2+]C[C@H]4C[C@H]2C[C@H]34)CC1 ZINC000328566536 633775085 /nfs/dbraw/zinc/77/50/85/633775085.db2.gz MVMWBBCQEKNTNF-MEBFFEOJSA-N 2 0 234.387 2.009 20 0 BEADRP CC(C)CCC[NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32 ZINC000328566138 633776336 /nfs/dbraw/zinc/77/63/36/633776336.db2.gz MKRDYSDXSVNZJJ-QSLWVIQJSA-N 2 0 222.376 2.009 20 0 BEADRP C[C@@H](C[NH2+]CC1CC[NH+](C)CC1)c1ccncc1 ZINC000893096960 633832514 /nfs/dbraw/zinc/83/25/14/633832514.db2.gz CHHOZGMXIVARSO-ZDUSSCGKSA-N 2 0 247.386 2.117 20 0 BEADRP CC[C@H]1CC[N@H+](C[C@@]2(C)CCC[NH2+]C2)C1 ZINC000228740337 633904394 /nfs/dbraw/zinc/90/43/94/633904394.db2.gz OCQSRSRIODELDZ-STQMWFEESA-N 2 0 210.365 2.108 20 0 BEADRP C[C@H](C1CC1)[N@@H+]1CC[C@@]2(C1)CCC[NH+](C)C2 ZINC000930575998 633906491 /nfs/dbraw/zinc/90/64/91/633906491.db2.gz AVXSLDMLKSYHIE-OCCSQVGLSA-N 2 0 222.376 2.203 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1CC[C@@]2(C1)CCC[NH+](C)C2 ZINC000930578245 633906514 /nfs/dbraw/zinc/90/65/14/633906514.db2.gz RIZHGHPTWINCNL-ILXRZTDVSA-N 2 0 236.403 2.450 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@@H]([NH3+])CC(C)(C)C1)C1CC1 ZINC000925586315 634092086 /nfs/dbraw/zinc/09/20/86/634092086.db2.gz CGQORXPWNNTIAZ-MVWJERBFSA-N 2 0 210.365 2.281 20 0 BEADRP CCC(O)(CC)C[NH2+][C@@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925615445 634162095 /nfs/dbraw/zinc/16/20/95/634162095.db2.gz GHVWAGRLVJTNQT-NWDGAFQWSA-N 2 0 242.407 2.033 20 0 BEADRP Cc1cc(C[NH2+][C@H]2C[C@H]([NH3+])CC(C)(C)C2)ccn1 ZINC000925680744 634278926 /nfs/dbraw/zinc/27/89/26/634278926.db2.gz TVQFBMOWCWZVIA-KBPBESRZSA-N 2 0 247.386 2.386 20 0 BEADRP CCC[C@H](C[NH2+][C@H]1C[C@@H]([NH3+])CC(C)(C)C1)OC ZINC000925680238 634279568 /nfs/dbraw/zinc/27/95/68/634279568.db2.gz NPBBVTYPMLBCJM-FRRDWIJNSA-N 2 0 242.407 2.297 20 0 BEADRP C[C@H]1[C@H]2CC[C@@H](C[C@H]1[NH2+][C@@H]1CCCC[C@H]1F)[NH2+]2 ZINC000925687675 634304636 /nfs/dbraw/zinc/30/46/36/634304636.db2.gz BJQKLKFLGOSPGD-PRSXHHODSA-N 2 0 240.366 2.386 20 0 BEADRP CC(C)C[C@@H]1C[C@H]1[NH2+][C@H]1C[C@H]([NH3+])C12CCC2 ZINC000925696904 634356879 /nfs/dbraw/zinc/35/68/79/634356879.db2.gz VMAUUECTXDWPDB-NDBYEHHHSA-N 2 0 222.376 2.281 20 0 BEADRP CC(C)C[C@@H]1C[C@H]1[NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2 ZINC000925696901 634358876 /nfs/dbraw/zinc/35/88/76/634358876.db2.gz VMAUUECTXDWPDB-FDYHWXHSSA-N 2 0 222.376 2.281 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@@H]([NH3+])CC(C)(C)C2)CS1 ZINC000925697063 634360328 /nfs/dbraw/zinc/36/03/28/634360328.db2.gz MJXVSZGAXTYEFO-KKOKHZNYSA-N 2 0 242.432 2.376 20 0 BEADRP c1cc(C[NH2+]CCC2CC2)c2c(c1)C[NH2+]CC2 ZINC000123993181 634368146 /nfs/dbraw/zinc/36/81/46/634368146.db2.gz MVCXNNYVEXIYQK-UHFFFAOYSA-N 2 0 230.355 2.222 20 0 BEADRP CCCCCC[NH+]1CCC(OCCC[NH3+])CC1 ZINC000094069969 635176273 /nfs/dbraw/zinc/17/62/73/635176273.db2.gz WHDVPEJTISBNPI-UHFFFAOYSA-N 2 0 242.407 2.397 20 0 BEADRP CC(C)[C@@H](Cc1ccccc1)[NH2+][C@H](C)C1C[NH2+]C1 ZINC000925768159 635187773 /nfs/dbraw/zinc/18/77/73/635187773.db2.gz TVEPVVXCBNZBJL-CZUORRHYSA-N 2 0 246.398 2.451 20 0 BEADRP COc1ccc(Cl)cc1C[NH2+]C[C@H](C)C[NH3+] ZINC000258836977 635211294 /nfs/dbraw/zinc/21/12/94/635211294.db2.gz VSYVOZGQCBLPRP-SECBINFHSA-N 2 0 242.750 2.033 20 0 BEADRP FC1(F)CC[NH2+]C[C@H]1C[NH2+][C@@H]1CCC12CCC2 ZINC000925775573 635247111 /nfs/dbraw/zinc/24/71/11/635247111.db2.gz HMUOKLZRYQMWGN-WDEREUQCSA-N 2 0 244.329 2.154 20 0 BEADRP [NH3+][C@@H]1CCCC[C@H]1[NH2+]CCc1cccc(F)c1 ZINC000259217941 635256150 /nfs/dbraw/zinc/25/61/50/635256150.db2.gz XKTNHKVOIFQYEM-ZIAGYGMSSA-N 2 0 236.334 2.228 20 0 BEADRP CC[C@@H]([NH2+]C[C@H]1C[NH2+]CCC1(F)F)C(C)C ZINC000925777501 635260713 /nfs/dbraw/zinc/26/07/13/635260713.db2.gz FDPUOOYEACVJIO-GHMZBOCLSA-N 2 0 234.334 2.255 20 0 BEADRP CC[C@H]([NH2+]C[C@H]1C[NH2+]CCC1(F)F)C(C)C ZINC000925777503 635260922 /nfs/dbraw/zinc/26/09/22/635260922.db2.gz FDPUOOYEACVJIO-MNOVXSKESA-N 2 0 234.334 2.255 20 0 BEADRP CC(C)[C@H]1CCCC[C@@H]1[NH2+][C@@H]1C[NH2+]C[C@H]1C ZINC000925781288 635272876 /nfs/dbraw/zinc/27/28/76/635272876.db2.gz DCBDVVNHPUTGNE-YIYPIFLZSA-N 2 0 224.392 2.399 20 0 BEADRP CC[C@@H]1CCCC[C@@H]1[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000925783757 635292909 /nfs/dbraw/zinc/29/29/09/635292909.db2.gz GSSOXVKQIXDYML-MQYQWHSLSA-N 2 0 224.392 2.400 20 0 BEADRP C[NH+](C)CCC[NH2+][C@@H]1CCOC2(CCCC2)C1 ZINC000094366474 635311725 /nfs/dbraw/zinc/31/17/25/635311725.db2.gz IZFGONLQBLXNPV-CYBMUJFWSA-N 2 0 240.391 2.020 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1C[NH2+]C[C@H]1C)c1cccs1 ZINC000925790549 635315405 /nfs/dbraw/zinc/31/54/05/635315405.db2.gz IQPRZRPXWFKXTM-MXWKQRLJSA-N 2 0 224.373 2.254 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@@H]1c2ccccc2C[C@@H]1C ZINC000925790323 635316278 /nfs/dbraw/zinc/31/62/78/635316278.db2.gz GZEZJDSULBHEIV-LMWOUKEDSA-N 2 0 244.382 2.365 20 0 BEADRP Cc1ccncc1[C@@H](C)[NH2+]CC[C@@H]1C[NH2+]C[C@H]1C ZINC000925798364 635335833 /nfs/dbraw/zinc/33/58/33/635335833.db2.gz QTIFFSIQNPUIFX-MGPQQGTHSA-N 2 0 247.386 2.286 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+][C@@H]1CCC[C@H]1CCF ZINC000925802035 635349988 /nfs/dbraw/zinc/34/99/88/635349988.db2.gz CSBOJYVVRFBUGR-XJFOESAGSA-N 2 0 242.382 2.350 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]CC[C@@H]1C[C@H]1C1CC1 ZINC000925802742 635350793 /nfs/dbraw/zinc/35/07/93/635350793.db2.gz QMMDQUGHGQGTQR-REBRKWNGSA-N 2 0 236.403 2.400 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1C[NH2+]C[C@H]1C)[C@@H]1CC1(C)C ZINC000925802764 635353227 /nfs/dbraw/zinc/35/32/27/635353227.db2.gz IQLXNGSAPBUWJH-LPWJVIDDSA-N 2 0 224.392 2.256 20 0 BEADRP COC[C@H](C[NH2+][C@@H](C)CCCC[NH3+])C(C)C ZINC000925873892 635594675 /nfs/dbraw/zinc/59/46/75/635594675.db2.gz MVDACPMRFWJTDK-STQMWFEESA-N 2 0 230.396 2.012 20 0 BEADRP Cc1ccc(OCC[N@H+]2CC[C@H]([C@@H](C)[NH3+])C2)cc1 ZINC000163197710 636212376 /nfs/dbraw/zinc/21/23/76/636212376.db2.gz LLBUTRIDTFBXIY-KGLIPLIRSA-N 2 0 248.370 2.043 20 0 BEADRP [NH3+]C[C@@H]1CC[N@H+](CCOC2CCCCCC2)C1 ZINC000430947396 636371334 /nfs/dbraw/zinc/37/13/34/636371334.db2.gz DQOGNGWUIMCEOT-ZDUSSCGKSA-N 2 0 240.391 2.006 20 0 BEADRP CC(C)[NH+](CCC[NH2+][C@H]1COC[C@H]1C)C(C)C ZINC000925197112 636376139 /nfs/dbraw/zinc/37/61/39/636376139.db2.gz QBOTWPZFSQEDEK-KGLIPLIRSA-N 2 0 242.407 2.120 20 0 BEADRP C[C@H]([NH2+]Cc1cccc(O)c1)C1CC[NH+](C)CC1 ZINC000154461163 636631950 /nfs/dbraw/zinc/63/19/50/636631950.db2.gz DUOVEQNJYOOCLJ-LBPRGKRZSA-N 2 0 248.370 2.212 20 0 BEADRP C[C@H]1C[C@H]1C[NH+]1CCC([NH2+]C2CCC2)CC1 ZINC000897981650 636854090 /nfs/dbraw/zinc/85/40/90/636854090.db2.gz PPSNEHPVCQFYRW-RYUDHWBXSA-N 2 0 222.376 2.249 20 0 BEADRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]CCc1ccc(F)cc1 ZINC000089147130 636904708 /nfs/dbraw/zinc/90/47/08/636904708.db2.gz NOBBYMZAKNGVTO-OCCSQVGLSA-N 2 0 236.334 2.085 20 0 BEADRP CCCCCC[N@@H+]1CCC[C@H](C[NH2+]C)C1 ZINC000041043327 636954941 /nfs/dbraw/zinc/95/49/41/636954941.db2.gz MDXOIWYAGHUEKA-CYBMUJFWSA-N 2 0 212.381 2.498 20 0 BEADRP CC1([NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)CC(F)(F)C1 ZINC000873197959 636980940 /nfs/dbraw/zinc/98/09/40/636980940.db2.gz WXFHROSEPOFNTE-MNOVXSKESA-N 2 0 244.329 2.391 20 0 BEADRP CSC(C)(C)C[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000154215229 637034057 /nfs/dbraw/zinc/03/40/57/637034057.db2.gz LFTDLDLMKHMDRY-QWRGUYRKSA-N 2 0 230.421 2.200 20 0 BEADRP CNc1ccccc1C[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000902266767 637289736 /nfs/dbraw/zinc/28/97/36/637289736.db2.gz UHFQBHOHBPMOPX-OCCSQVGLSA-N 2 0 247.386 2.301 20 0 BEADRP CO[C@@H]1CCC[C@H]1[NH2+]CCCC[N@H+](C)C1CC1 ZINC000903182506 637351010 /nfs/dbraw/zinc/35/10/10/637351010.db2.gz CGVNWPIEHWFXFC-ZIAGYGMSSA-N 2 0 240.391 2.018 20 0 BEADRP COC1CCC([N@H+](C)C[C@@H]2CC[C@H]([NH3+])C2)CC1 ZINC000903437777 637361743 /nfs/dbraw/zinc/36/17/43/637361743.db2.gz LWCCELFDZSCRFO-KBHBFKLGSA-N 2 0 240.391 2.003 20 0 BEADRP C[C@@H]1C[C@H]2CCCC[C@H]2[N@@H+]1C[C@@H]1C[NH2+]C[C@H]1C ZINC000903437848 637363330 /nfs/dbraw/zinc/36/33/30/637363330.db2.gz NQGPBMOGAPQCIK-ARILJUKYSA-N 2 0 236.403 2.495 20 0 BEADRP COc1ccc([C@@H](C)[NH2+]C[C@H]2C[C@@H]([NH3+])C2)cc1C ZINC000904443352 637410843 /nfs/dbraw/zinc/41/08/43/637410843.db2.gz GYRWKDMXQDZSGD-BZPMIXESSA-N 2 0 248.370 2.392 20 0 BEADRP C[C@H](C[NH2+]CC1([NH3+])CC1)c1ccc(F)cc1 ZINC000904441981 637411488 /nfs/dbraw/zinc/41/14/88/637411488.db2.gz BMNPJBBIJRSLPF-SNVBAGLBSA-N 2 0 222.307 2.010 20 0 BEADRP CC(C)([NH3+])c1ccc(NC[C@]2(C)CC[NH2+]C2)cc1 ZINC000904475939 637425510 /nfs/dbraw/zinc/42/55/10/637425510.db2.gz OCNBHPVXZRARLQ-OAHLLOKOSA-N 2 0 247.386 2.292 20 0 BEADRP C[C@H]1C[NH2+]C[C@@H](Nc2ccc(C(C)(C)[NH3+])cc2)C1 ZINC000904475576 637426310 /nfs/dbraw/zinc/42/63/10/637426310.db2.gz LWBLEWDPHKYMQN-RISCZKNCSA-N 2 0 247.386 2.290 20 0 BEADRP [NH3+]C1CC([NH2+]Cc2ccc(C(F)F)cc2)C1 ZINC000906511518 638185964 /nfs/dbraw/zinc/18/59/64/638185964.db2.gz YRQPSHVWACXCBO-UHFFFAOYSA-N 2 0 226.270 2.204 20 0 BEADRP C[C@H](CC[NH2+][C@H]1C[C@H]([NH3+])C1)c1ccccc1 ZINC000906516959 638187365 /nfs/dbraw/zinc/18/73/65/638187365.db2.gz ALQBRKYXOMTMNY-MRVWCRGKSA-N 2 0 218.344 2.260 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+][C@H]2CCC[C@@H](C(F)(F)F)C2)C1 ZINC000906518916 638188584 /nfs/dbraw/zinc/18/85/84/638188584.db2.gz UXARPYILYBLTDX-DOLQZWNJSA-N 2 0 236.281 2.187 20 0 BEADRP CCCC[NH2+][C@H](C)CN(CC)CCC ZINC000906532058 638200228 /nfs/dbraw/zinc/20/02/28/638200228.db2.gz XUPJRZYXCFTNQZ-GFCCVEGCSA-N 2 0 200.370 2.497 20 0 BEADRP CCCC[NH2+]CCC[N@H+](C)CC(C)C ZINC000906534012 638202476 /nfs/dbraw/zinc/20/24/76/638202476.db2.gz MGCKBCSBUAUAKO-UHFFFAOYSA-N 2 0 200.370 2.354 20 0 BEADRP CCCC[N@H+](C)CC(C)(C)C[NH+](C)C ZINC000906537853 638204279 /nfs/dbraw/zinc/20/42/79/638204279.db2.gz NSNADNKXLKWTLG-UHFFFAOYSA-N 2 0 200.370 2.306 20 0 BEADRP [NH3+]C[C@@H]1CC[N@H+](Cc2ccc(C(F)F)cc2)C1 ZINC000150284530 639477551 /nfs/dbraw/zinc/47/75/51/639477551.db2.gz VOTZIQZOEXNVHH-NSHDSACASA-N 2 0 240.297 2.405 20 0 BEADRP C[NH+](C)C1(C)CC[NH+](C[Si](C)(C)C)CC1 ZINC000931351498 640167517 /nfs/dbraw/zinc/16/75/17/640167517.db2.gz OXDLXLZETGYESY-UHFFFAOYSA-N 2 0 228.456 2.280 20 0 BEADRP CC[C@H](C[C@@](C)(O)CC)[NH2+][C@@H](C)CC[NH+](C)C ZINC000924855144 640326797 /nfs/dbraw/zinc/32/67/97/640326797.db2.gz VNGIOBLONKAOJO-MJBXVCDLSA-N 2 0 244.423 2.246 20 0 BEADRP CC[C@H](C[C@@](C)(O)CC)[NH2+]CCCC[NH+](C)C ZINC000924856342 640352341 /nfs/dbraw/zinc/35/23/41/640352341.db2.gz WMERTRRTAHDIIU-KGLIPLIRSA-N 2 0 244.423 2.248 20 0 BEADRP C[C@H](C1CC1)[N@@H+]1CCN(c2cc[nH+]cc2)C[C@@H]1C ZINC000931764335 640357582 /nfs/dbraw/zinc/35/75/82/640357582.db2.gz PTIKMRHNJDXJOM-QWHCGFSZSA-N 2 0 245.370 2.391 20 0 BEADRP CC[C@@H](C)[C@H](C)[NH2+]CC1CC[NH+](C)CC1 ZINC000044515972 640398224 /nfs/dbraw/zinc/39/82/24/640398224.db2.gz CUDWZPIFDGYTFJ-NEPJUHHUSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@@]2(C)CCC[NH2+]C2)C[C@@H]1C ZINC000221706059 640418645 /nfs/dbraw/zinc/41/86/45/640418645.db2.gz KZPNGGIIRSSJII-RDBSUJKOSA-N 2 0 224.392 2.354 20 0 BEADRP CSCC[C@H](C)[N@H+](C)C[C@]1(C)CCC[NH2+]C1 ZINC000156903824 640516622 /nfs/dbraw/zinc/51/66/22/640516622.db2.gz CITRJNVQDBHUGK-QWHCGFSZSA-N 2 0 244.448 2.450 20 0 BEADRP C[C@H](C[N@@H+]1CC[C@@H](C[NH3+])C1)c1ccccc1 ZINC000224206893 640605771 /nfs/dbraw/zinc/60/57/71/640605771.db2.gz AXCCSGLZYHMTOD-OLZOCXBDSA-N 2 0 218.344 2.071 20 0 BEADRP CC[C@H]1CC[N@H+](C[C@]2(C)CCC[NH2+]C2)C1 ZINC000166351945 640631402 /nfs/dbraw/zinc/63/14/02/640631402.db2.gz OCQSRSRIODELDZ-QWHCGFSZSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@H](C[NH2+]C1CCSCC1)C[NH+]1CCCC1 ZINC000057994433 640659147 /nfs/dbraw/zinc/65/91/47/640659147.db2.gz BXDDLXYFJXXKSU-GFCCVEGCSA-N 2 0 242.432 2.204 20 0 BEADRP CCC(CC)C[N@@H+]1C[C@@H]2C[NH+](C)C[C@]2(C)C1 ZINC000933734359 640757881 /nfs/dbraw/zinc/75/78/81/640757881.db2.gz RKYYYQGRRIOHQB-UONOGXRCSA-N 2 0 224.392 2.306 20 0 BEADRP CCCCCC[N@@H+]1C[C@@H]2C[NH+](C)C[C@]2(C)C1 ZINC000933741178 640757961 /nfs/dbraw/zinc/75/79/61/640757961.db2.gz SNTWHKLBNPXWFJ-UONOGXRCSA-N 2 0 224.392 2.450 20 0 BEADRP CC(C)[C@@H]1CCC[N@@H+]1C[C@@]1(C)CCC[NH2+]C1 ZINC000226564323 640776811 /nfs/dbraw/zinc/77/68/11/640776811.db2.gz IWKCFUXWOQMEID-KBPBESRZSA-N 2 0 224.392 2.497 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[N@@H+]2CCC[C@@H]3CCC[C@H]32)C1 ZINC000228226284 640866751 /nfs/dbraw/zinc/86/67/51/640866751.db2.gz NZSLPMSNWYSLSQ-IGQOVBAYSA-N 2 0 222.376 2.378 20 0 BEADRP Cc1ccccc1OCC[N@H+]1CC[C@H]([NH3+])C[C@H]1C ZINC000228348546 640871585 /nfs/dbraw/zinc/87/15/85/640871585.db2.gz BOKZDPXUVZSEBS-KGLIPLIRSA-N 2 0 248.370 2.185 20 0 BEADRP CSCC[C@H](C)[NH2+]CC1CC[NH+](C)CC1 ZINC000228879412 640902938 /nfs/dbraw/zinc/90/29/38/640902938.db2.gz KTUGRTYCGZPECR-NSHDSACASA-N 2 0 230.421 2.059 20 0 BEADRP CCCCCC[N@@H+]1CC[C@@H](C)[C@@H](C[NH3+])C1 ZINC000228986599 640909061 /nfs/dbraw/zinc/90/90/61/640909061.db2.gz JHSGXEFDUZQBCQ-OLZOCXBDSA-N 2 0 212.381 2.483 20 0 BEADRP C[C@@H]([NH2+]C1CCC([NH3+])CC1)c1cncs1 ZINC000229127600 640925191 /nfs/dbraw/zinc/92/51/91/640925191.db2.gz QRUSPMZQKWYVCB-XNWIYYODSA-N 2 0 225.361 2.064 20 0 BEADRP CC[C@@H](C)C[NH2+]C[C@@H](C)C[NH+]1CCCC1 ZINC000062071317 641019039 /nfs/dbraw/zinc/01/90/39/641019039.db2.gz WFBMQJABEYOHOQ-CHWSQXEVSA-N 2 0 212.381 2.354 20 0 BEADRP CC[C@@H](C)C[NH2+]C[C@H](C)C[NH+]1CCCC1 ZINC000062071321 641019809 /nfs/dbraw/zinc/01/98/09/641019809.db2.gz WFBMQJABEYOHOQ-OLZOCXBDSA-N 2 0 212.381 2.354 20 0 BEADRP CCC[C@](C)(O)C[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000230687127 641087789 /nfs/dbraw/zinc/08/77/89/641087789.db2.gz VUARDMXPTCUMJH-KFWWJZLASA-N 2 0 248.370 2.272 20 0 BEADRP C[C@@]1(C[NH+]2CCCCCC2)CCC[NH2+]C1 ZINC000062861650 641101446 /nfs/dbraw/zinc/10/14/46/641101446.db2.gz APWLYCSLUVQFHW-CYBMUJFWSA-N 2 0 210.365 2.252 20 0 BEADRP CCC[NH+]1CCC([NH2+]CCC(C)(C)OC)CC1 ZINC000231024917 641125276 /nfs/dbraw/zinc/12/52/76/641125276.db2.gz VPTPFTPACWWTAJ-UHFFFAOYSA-N 2 0 242.407 2.266 20 0 BEADRP c1ccc([C@H]2CC[N@@H+](C[C@@H]3CCC[NH2+]C3)C2)cc1 ZINC000050599372 641190637 /nfs/dbraw/zinc/19/06/37/641190637.db2.gz GMSNDDHMMIXEQL-ZBFHGGJFSA-N 2 0 244.382 2.476 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@H]1C[NH3+])c1ccco1 ZINC000088169564 641320302 /nfs/dbraw/zinc/32/03/02/641320302.db2.gz NTUXZPQNSBPZOO-GARJFASQSA-N 2 0 208.305 2.058 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@@H]1C[NH3+])c1cccc(O)c1 ZINC000089149716 641477618 /nfs/dbraw/zinc/47/76/18/641477618.db2.gz REHLVQKFVNCCTM-ZKYQVNSYSA-N 2 0 234.343 2.170 20 0 BEADRP CC1CCC(C[NH2+]C[C@H]2CCC[NH2+]2)CC1 ZINC000232814925 641694165 /nfs/dbraw/zinc/69/41/65/641694165.db2.gz KNUXEAUPLOBAIY-WXRRBKDZSA-N 2 0 210.365 2.154 20 0 BEADRP CC1CC(C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C)C2)C1 ZINC000929847633 641762396 /nfs/dbraw/zinc/76/23/96/641762396.db2.gz MPNVKGIDIYDWBA-NEXFUWMNSA-N 2 0 236.403 2.449 20 0 BEADRP CC[N@H+](CC1CC1)C[C@]1(C)CCC[NH2+]C1 ZINC000068947609 642813616 /nfs/dbraw/zinc/81/36/16/642813616.db2.gz YSOSVXWOLZAKGC-CYBMUJFWSA-N 2 0 210.365 2.108 20 0 BEADRP CC[C@@H](C)C[NH2+]Cc1ccc(CC[NH3+])cc1 ZINC000070533177 643033623 /nfs/dbraw/zinc/03/36/23/643033623.db2.gz KFWSVPYWMUNCNY-GFCCVEGCSA-N 2 0 220.360 2.324 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CCC2CCC2)[C@H](C)C1 ZINC000090233322 643077969 /nfs/dbraw/zinc/07/79/69/643077969.db2.gz AQOKPWXPDOWZQA-OCCSQVGLSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@H]2CCCCC[NH2+]2)C1 ZINC000253310285 643191282 /nfs/dbraw/zinc/19/12/82/643191282.db2.gz UDXLALDOCZBSJW-FRRDWIJNSA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@@H]1CCCC[C@H]1[NH2+]C[C@@H]1CCC[NH2+]1 ZINC000233922587 643265240 /nfs/dbraw/zinc/26/52/40/643265240.db2.gz UXMBZFHWTXMKMS-FRRDWIJNSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]1CCC[N@H+](CCC[NH2+]C2CC2)CC1 ZINC000082496677 643326845 /nfs/dbraw/zinc/32/68/45/643326845.db2.gz UFKLDOHGGVFOBH-LBPRGKRZSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@H+](C)C1CCCCCC1 ZINC000082560474 643343099 /nfs/dbraw/zinc/34/30/99/643343099.db2.gz VZKJHRYPEHWBRR-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH2+]C[C@@H]1CCC[N@H+](CCc2cccs2)C1 ZINC000082602425 643353966 /nfs/dbraw/zinc/35/39/66/643353966.db2.gz MLNLMZWHASRVET-LBPRGKRZSA-N 2 0 238.400 2.222 20 0 BEADRP C[C@H]1C[N@H+](C[C@@H]2CC[NH2+]C2)Cc2ccccc21 ZINC000843356219 643362629 /nfs/dbraw/zinc/36/26/29/643362629.db2.gz HTVRRHIWVARPAI-QWHCGFSZSA-N 2 0 230.355 2.215 20 0 BEADRP Clc1ccc(C[NH2+]C[C@@H]2CCC[NH2+]C2)s1 ZINC000070600406 643386046 /nfs/dbraw/zinc/38/60/46/643386046.db2.gz MCINAFWCNRPXKM-SECBINFHSA-N 2 0 244.791 2.491 20 0 BEADRP C[C@@H]1CCC[N@H+](CCC[NH2+]C2CC2)CC1 ZINC000082496676 643509457 /nfs/dbraw/zinc/50/94/57/643509457.db2.gz UFKLDOHGGVFOBH-GFCCVEGCSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@H]1CC[C@H](C)[N@H+](CCC[NH2+]C2CC2)C1 ZINC000084046561 643641724 /nfs/dbraw/zinc/64/17/24/643641724.db2.gz MXNKIBCQPHNFAG-RYUDHWBXSA-N 2 0 210.365 2.249 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]CCc1ccsc1 ZINC000084216481 643652051 /nfs/dbraw/zinc/65/20/51/643652051.db2.gz DKIKJVKJVORTIV-QWHCGFSZSA-N 2 0 238.400 2.398 20 0 BEADRP Cl/C=C/C[N@@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC000846220063 643652444 /nfs/dbraw/zinc/65/24/44/643652444.db2.gz ABCIQJUHVCROQD-LOKFXGJOSA-N 2 0 242.794 2.451 20 0 BEADRP C[N@H+](CC[C@@H]1CC[NH2+]C1)C1CCCCC1 ZINC000084384507 643659057 /nfs/dbraw/zinc/65/90/57/643659057.db2.gz JXGKCFBQXJRURJ-LBPRGKRZSA-N 2 0 210.365 2.251 20 0 BEADRP [NH3+]C[C@H]1CC[N@@H+]([C@H]2CCCc3ccccc32)C1 ZINC000050245394 643661476 /nfs/dbraw/zinc/66/14/76/643661476.db2.gz NWZIHPNDOZRZIH-DOMZBBRYSA-N 2 0 230.355 2.345 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@@H](C[NH3+])C2)cc1C ZINC000050245459 643661802 /nfs/dbraw/zinc/66/18/02/643661802.db2.gz QYQVTZWGNRXXOR-AWEZNQCLSA-N 2 0 218.344 2.084 20 0 BEADRP CC[NH+]1CCC(C[NH2+]C[C@@H]2CCC=CO2)CC1 ZINC000050269649 643672580 /nfs/dbraw/zinc/67/25/80/643672580.db2.gz HRRFALSMJAQAAD-AWEZNQCLSA-N 2 0 238.375 2.001 20 0 BEADRP C[C@@H]1C[C@H](C)C[N@@H+](C[C@@H]2CC[C@H]([NH3+])C2)C1 ZINC000085014378 643680828 /nfs/dbraw/zinc/68/08/28/643680828.db2.gz WYDDCNDIOALUIC-XQHKEYJVSA-N 2 0 210.365 2.092 20 0 BEADRP C(C1CCC2(CC2)CC1)[NH+]1C[C@@H]2C[NH2+]C[C@H]2C1 ZINC000929311369 644065629 /nfs/dbraw/zinc/06/56/29/644065629.db2.gz CIULPWQZHASRAO-KBPBESRZSA-N 2 0 234.387 2.108 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]Cc2ccsc2)C1 ZINC000086404136 644130789 /nfs/dbraw/zinc/13/07/89/644130789.db2.gz MKWDGXXQKGBXIT-WDEREUQCSA-N 2 0 210.346 2.108 20 0 BEADRP C(C1CC[NH2+]CC1)[N@@H+]1C[C@H](C2CC2)C[C@@H]1C1CC1 ZINC000923273207 644307430 /nfs/dbraw/zinc/30/74/30/644307430.db2.gz UTJJIJUBZBRHRS-HZPDHXFCSA-N 2 0 248.414 2.497 20 0 BEADRP c1n[nH]cc1[C@@H]1CCCCN1CCC[NH2+]C1CC1 ZINC000923324182 644351160 /nfs/dbraw/zinc/35/11/60/644351160.db2.gz DDKGXJFFUDZKKU-AWEZNQCLSA-N 2 0 248.374 2.079 20 0 BEADRP C[C@H]([NH3+])[C@H]1CC[N@H+](CCc2cccc(F)c2)C1 ZINC000923333050 644354402 /nfs/dbraw/zinc/35/44/02/644354402.db2.gz SWWDHBFOGNKJMD-AAEUAGOBSA-N 2 0 236.334 2.037 20 0 BEADRP CCCCCC[C@H](O)C[NH2+][C@@H]1CCCC[C@H]1[NH3+] ZINC000923383827 644396724 /nfs/dbraw/zinc/39/67/24/644396724.db2.gz MUDBCVAFYHMWNE-BFHYXJOUSA-N 2 0 242.407 2.177 20 0 BEADRP c1cncc([C@@H]2CC[N@@H+](CCC[NH2+]C3CC3)C2)c1 ZINC000923383563 644396830 /nfs/dbraw/zinc/39/68/30/644396830.db2.gz KASPCZARRDINCO-CQSZACIVSA-N 2 0 245.370 2.013 20 0 BEADRP CCCCCC[C@H](O)C[N@@H+]1CC[C@H]([NH3+])C[C@@H]1C ZINC000923392202 644398134 /nfs/dbraw/zinc/39/81/34/644398134.db2.gz IIOZYAKZXCMRGU-IHRRRGAJSA-N 2 0 242.407 2.129 20 0 BEADRP C[C@H]1CC[C@H](C)N(CC[NH2+]C(C)(C)C)C1 ZINC000084047060 644415155 /nfs/dbraw/zinc/41/51/55/644415155.db2.gz IKXIBSPLKGSXMV-RYUDHWBXSA-N 2 0 212.381 2.495 20 0 BEADRP C[C@@H]1CC[C@H](C)[N@H+](C[C@@H]2CC[C@H]([NH3+])C2)C1 ZINC000085016285 644436049 /nfs/dbraw/zinc/43/60/49/644436049.db2.gz OTICXAHIGWGDEF-XQHKEYJVSA-N 2 0 210.365 2.234 20 0 BEADRP C[C@@H](C[N@@H+]1CC[C@@H]2CC[NH2+][C@@H]2C1)C(C)(C)C ZINC000923453919 644441627 /nfs/dbraw/zinc/44/16/27/644441627.db2.gz CZDJFDPZPMTZOZ-RWMBFGLXSA-N 2 0 224.392 2.352 20 0 BEADRP CC1(C)C(C[NH2+][C@@H]2CCC[C@H]2C[NH3+])C1(C)C ZINC000086239370 644457763 /nfs/dbraw/zinc/45/77/63/644457763.db2.gz OPBQTRQDAUQQDK-WDEREUQCSA-N 2 0 224.392 2.386 20 0 BEADRP CC1(C)C(C[NH2+][C@@H]2CCC[C@@H]2C[NH3+])C1(C)C ZINC000086239368 644459391 /nfs/dbraw/zinc/45/93/91/644459391.db2.gz OPBQTRQDAUQQDK-GHMZBOCLSA-N 2 0 224.392 2.386 20 0 BEADRP [NH3+]CC[C@@H]1CC[N@@H+]([C@H]2CCc3ccc(F)cc32)C1 ZINC000923482571 644459465 /nfs/dbraw/zinc/45/94/65/644459465.db2.gz RJKCTYCVPRIXOG-ABAIWWIYSA-N 2 0 248.345 2.484 20 0 BEADRP CCc1cccc(C[N@@H+]2CC[C@H](CC[NH3+])C2)c1 ZINC000923480507 644460502 /nfs/dbraw/zinc/46/05/02/644460502.db2.gz HZWQAUHZQUMCKA-AWEZNQCLSA-N 2 0 232.371 2.420 20 0 BEADRP C=C/C=C/CC[N@@H+]1CC[C@H](C[NH3+])[C@H](C)C1 ZINC000923488342 644461258 /nfs/dbraw/zinc/46/12/58/644461258.db2.gz DSKXQBGNUUTHQK-IJWDBEHRSA-N 2 0 208.349 2.035 20 0 BEADRP C=C/C=C\CC[N@@H+]1CC[C@H](C[NH3+])[C@@H](C)C1 ZINC000923488344 644462705 /nfs/dbraw/zinc/46/27/05/644462705.db2.gz DSKXQBGNUUTHQK-OEFFGFFESA-N 2 0 208.349 2.035 20 0 BEADRP C[C@@H]1C[N@H+](CCCC2CCC2)CC[C@H]1C[NH3+] ZINC000923489759 644465369 /nfs/dbraw/zinc/46/53/69/644465369.db2.gz KQXDVSBYSVDLAU-OCCSQVGLSA-N 2 0 224.392 2.483 20 0 BEADRP C[C@H]1C[N@H+](CC=C(Cl)Cl)CC[C@H]1C[NH3+] ZINC000923488756 644465796 /nfs/dbraw/zinc/46/57/96/644465796.db2.gz GEDLVMKOTBXFLQ-IUCAKERBSA-N 2 0 237.174 2.222 20 0 BEADRP CCc1ccc(CC[N@@H+]2CC[C@H](CC[NH3+])C2)cc1 ZINC000923491200 644465899 /nfs/dbraw/zinc/46/58/99/644465899.db2.gz KZSAVEMTYYHFEX-INIZCTEOSA-N 2 0 246.398 2.462 20 0 BEADRP C[C@@H]1C[N@H+](CCCC2CC2)CC[C@H]1C[NH3+] ZINC000923492588 644467500 /nfs/dbraw/zinc/46/75/00/644467500.db2.gz XLVNQWHZORKTIB-YPMHNXCESA-N 2 0 210.365 2.093 20 0 BEADRP C[C@@H]1C[N@H+](CC[C@@H]2C[C@H]2C2CC2)CC[C@H]1C[NH3+] ZINC000923491936 644467902 /nfs/dbraw/zinc/46/79/02/644467902.db2.gz KUSZMMWIBSJDPJ-RZFFKMDDSA-N 2 0 236.403 2.339 20 0 BEADRP C[C@@H]1C[N@H+](CCCC2CC2)CC[C@@H]1C[NH3+] ZINC000923492585 644467942 /nfs/dbraw/zinc/46/79/42/644467942.db2.gz XLVNQWHZORKTIB-DGCLKSJQSA-N 2 0 210.365 2.093 20 0 BEADRP Cc1cccc(C[N@@H+]2CC[C@@H](C[NH3+])[C@H](C)C2)c1 ZINC000923498720 644472391 /nfs/dbraw/zinc/47/23/91/644472391.db2.gz JJDHUWYLLHNXIQ-HIFRSBDPSA-N 2 0 232.371 2.412 20 0 BEADRP Cc1ccc(CC[N@@H+]2CC[C@@H](C[NH3+])[C@H](C)C2)cc1 ZINC000923498338 644472996 /nfs/dbraw/zinc/47/29/96/644472996.db2.gz OEQOSNWYPHSVLZ-ZBFHGGJFSA-N 2 0 246.398 2.454 20 0 BEADRP C[C@@H]1C[N@H+](CCc2cccs2)CC[C@H]1C[NH3+] ZINC000923497848 644473992 /nfs/dbraw/zinc/47/39/92/644473992.db2.gz MTEMXQLBVYMSRT-NEPJUHHUSA-N 2 0 238.400 2.207 20 0 BEADRP C[C@@H]1C[N@@H+]([C@H]2C[C@@H]2c2ccccc2)C[C@H]1C[NH3+] ZINC000923515500 644480171 /nfs/dbraw/zinc/48/01/71/644480171.db2.gz XBNIVKHFEAUEFU-NGFQHRJXSA-N 2 0 230.355 2.069 20 0 BEADRP C[C@H](c1ccccc1F)[N@@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1 ZINC000923518546 644483126 /nfs/dbraw/zinc/48/31/26/644483126.db2.gz NDOXJFRXVWSBRX-FRRDWIJNSA-N 2 0 248.345 2.428 20 0 BEADRP Cc1ccc(C)c(C[N@@H+]2C[C@@H]3CC[NH2+]C[C@@H]3C2)c1 ZINC000923521138 644483956 /nfs/dbraw/zinc/48/39/56/644483956.db2.gz QSAKRBDJRWWUDU-GOEBONIOSA-N 2 0 244.382 2.345 20 0 BEADRP C([C@H]1CC[NH2+]C1)[N@@H+]1C[C@H](C2CC2)C[C@@H]1C1CC1 ZINC000923526419 644485445 /nfs/dbraw/zinc/48/54/45/644485445.db2.gz PYKZSJZYTJHUEQ-NILFDRSVSA-N 2 0 234.387 2.106 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]CCOc1ccccc1 ZINC000089145805 644536126 /nfs/dbraw/zinc/53/61/26/644536126.db2.gz YDEIBPPIIWZNFA-DZGCQCFKSA-N 2 0 248.370 2.173 20 0 BEADRP C[N@H+](CC[C@@H]1CC[NH2+]C1)Cc1ccc(F)cc1 ZINC000089749196 644565759 /nfs/dbraw/zinc/56/57/59/644565759.db2.gz DPZBKSDBMHRHKP-LBPRGKRZSA-N 2 0 236.334 2.257 20 0 BEADRP C[N@@H+](Cc1ccoc1)CC1CC[NH+](C)CC1 ZINC000093089227 644678033 /nfs/dbraw/zinc/67/80/33/644678033.db2.gz BVAUXTURQWMXNE-UHFFFAOYSA-N 2 0 222.332 2.053 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+][C@H]1CCCc2occc21 ZINC000250154449 644747653 /nfs/dbraw/zinc/74/76/53/644747653.db2.gz CCYUQOXJJFPZIR-DRZSPHRISA-N 2 0 234.343 2.374 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@H]1C[NH3+])c1cccc(O)c1 ZINC000251554820 644809197 /nfs/dbraw/zinc/80/91/97/644809197.db2.gz REHLVQKFVNCCTM-JKOKRWQUSA-N 2 0 234.343 2.170 20 0 BEADRP C[C@@H]1CC[C@H](C)[N@H+](CC[C@H]2CCC[NH2+]C2)C1 ZINC000251849009 644826561 /nfs/dbraw/zinc/82/65/61/644826561.db2.gz OURFWNYDKLTFAK-HZSPNIEDSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[NH+](CCC2C[C@H]3CC[C@@H](C2)[NH2+]3)C[C@H]1C ZINC000251880596 644830150 /nfs/dbraw/zinc/83/01/50/644830150.db2.gz UTROKQBBOIBDKS-MLQJFRMTSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@@H]1C[C@@H]1[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCCC[NH2+]1 ZINC000252200064 644842747 /nfs/dbraw/zinc/84/27/47/644842747.db2.gz WCXHMKNOIHJRNU-KSTCHIGDSA-N 2 0 222.376 2.295 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H]2CCC[C@@H](C)C2)C1 ZINC000252438399 644850629 /nfs/dbraw/zinc/85/06/29/644850629.db2.gz AYTUGLYRFRWHKY-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP CCC[C@@H](C)C[N@@H+]1CC[C@@]2(CCC[NH2+]2)C1 ZINC000415135600 644886128 /nfs/dbraw/zinc/88/61/28/644886128.db2.gz GJNRDVJHXIPHDI-OLZOCXBDSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@@]2(C)CCC[NH2+]C2)C[C@H]1C ZINC000253068703 644934082 /nfs/dbraw/zinc/93/40/82/644934082.db2.gz KZPNGGIIRSSJII-MCIONIFRSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@H]1CC[N@H+](CCc2cccs2)C[C@H]1C[NH3+] ZINC000253202447 644944049 /nfs/dbraw/zinc/94/40/49/644944049.db2.gz YXIKOPUIGYRLET-NWDGAFQWSA-N 2 0 238.400 2.207 20 0 BEADRP CC(C)CC[NH2+][C@H]1CC[NH2+]C12CCCC2 ZINC000843129098 645266316 /nfs/dbraw/zinc/26/63/16/645266316.db2.gz RDAXIABBGPVBIA-LBPRGKRZSA-N 2 0 210.365 2.297 20 0 BEADRP C[N@H+]1C[C@H]2CC[C@@H](C1)C2[NH2+][C@@H]1CCCC[C@H]1F ZINC000926588524 645301312 /nfs/dbraw/zinc/30/13/12/645301312.db2.gz ZEHQOHPLPOXMLO-DYPLGBCKSA-N 2 0 240.366 2.197 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H]2CC3CCC2CC3)C1 ZINC000926665644 645345425 /nfs/dbraw/zinc/34/54/25/645345425.db2.gz JNQUYANDBSSABB-FJGURNMVSA-N 2 0 236.403 2.495 20 0 BEADRP C/C=C\C[NH2+][C@@H]1CCCN2CCCC[C@H]12 ZINC000926764230 645410290 /nfs/dbraw/zinc/41/02/90/645410290.db2.gz CIPXRLVCRTXPGW-LLGAQUFESA-N 2 0 208.349 2.169 20 0 BEADRP C[C@@H]1CN(C2CC2)C[C@@H]1[NH2+]CCC1CC=CC1 ZINC000926951950 645499704 /nfs/dbraw/zinc/49/97/04/645499704.db2.gz HLRCAXZNJPRGEA-DOMZBBRYSA-N 2 0 234.387 2.415 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@@]2(C)CCCCO2)CC1 ZINC000927025981 645525050 /nfs/dbraw/zinc/52/50/50/645525050.db2.gz ZIXSPFBBDBONCI-CQSZACIVSA-N 2 0 240.391 2.020 20 0 BEADRP CCCCOCCC[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000925491516 645541642 /nfs/dbraw/zinc/54/16/42/645541642.db2.gz VVQGJHLVERJMCT-CYBMUJFWSA-N 2 0 240.391 2.067 20 0 BEADRP Cc1ccc(OCC[N@@H+]2CCC[C@@H](C[NH3+])C2)cc1 ZINC000011888587 645645923 /nfs/dbraw/zinc/64/59/23/645645923.db2.gz XGGJKPRMFOWHAD-AWEZNQCLSA-N 2 0 248.370 2.045 20 0 BEADRP CCOCCC[NH2+][C@H]1CCCN2CCCC[C@@H]12 ZINC000924523934 646046898 /nfs/dbraw/zinc/04/68/98/646046898.db2.gz CZKZOSPZGDBHHA-KBPBESRZSA-N 2 0 240.391 2.020 20 0 BEADRP C[NH+](C)CCC[NH2+][C@@H]1CCOC12CCCCC2 ZINC000924541473 646061503 /nfs/dbraw/zinc/06/15/03/646061503.db2.gz VECFEGNAICHRGA-CYBMUJFWSA-N 2 0 240.391 2.020 20 0 BEADRP C[N@H+]1C[C@H]2CC[C@@H](C1)C2[NH2+]C[C@H]1CC=CCC1 ZINC000924805590 646108163 /nfs/dbraw/zinc/10/81/63/646108163.db2.gz KPOXQLILXAGQCI-RDGKXADDSA-N 2 0 234.387 2.273 20 0 BEADRP CC1(C[NH2+][C@H](CCC[NH3+])c2ccccc2)COC1 ZINC000925482153 646295262 /nfs/dbraw/zinc/29/52/62/646295262.db2.gz LUUWVKMDLXJLJN-CQSZACIVSA-N 2 0 248.370 2.093 20 0 BEADRP CC1(C)[C@H]([NH2+]CC2CCC2)[C@@H]2CCC[NH2+][C@@H]21 ZINC000925484377 646296350 /nfs/dbraw/zinc/29/63/50/646296350.db2.gz DLUYBUQKDFSJDE-FRRDWIJNSA-N 2 0 222.376 2.153 20 0 BEADRP C([NH2+][C@@H]1CC[NH2+]C12CCC2)C1CCSCC1 ZINC000925486336 646296810 /nfs/dbraw/zinc/29/68/10/646296810.db2.gz HDJRPHKBCLJOLH-GFCCVEGCSA-N 2 0 240.416 2.004 20 0 BEADRP C[C@@H]1C[C@@H]1[NH2+][C@@H]1CC[NH2+]C[C@@H]1C1CCCC1 ZINC000925493398 646299881 /nfs/dbraw/zinc/29/98/81/646299881.db2.gz XMMJOLSBMOSNJY-ZRJCITRHSA-N 2 0 222.376 2.153 20 0 BEADRP C[N@H+]1C[C@H]2CC[C@@H](C1)C2[NH2+]CC1(C)CCC1 ZINC000925498570 646300950 /nfs/dbraw/zinc/30/09/50/646300950.db2.gz QTHGDARFAPQRJR-FUNVUKJBSA-N 2 0 222.376 2.106 20 0 BEADRP CC1(C)C[C@@H]([NH3+])C[C@H]([NH2+]Cc2cccnc2)C1 ZINC000925494071 646302572 /nfs/dbraw/zinc/30/25/72/646302572.db2.gz MZNDAPHUPGHAGB-STQMWFEESA-N 2 0 233.359 2.077 20 0 BEADRP CSC(C)(C)C[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000925526255 646316844 /nfs/dbraw/zinc/31/68/44/646316844.db2.gz HUZHWEBFCRQNFB-JTQLQIEISA-N 2 0 228.405 2.002 20 0 BEADRP CSC(C)(C)C[NH2+][C@@H]1CC[NH2+]C12CCCC2 ZINC000925527140 646318274 /nfs/dbraw/zinc/31/82/74/646318274.db2.gz MCHPYSNZGLOKGT-LLVKDONJSA-N 2 0 242.432 2.392 20 0 BEADRP COCCCCC[NH2+][C@@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925531429 646320234 /nfs/dbraw/zinc/32/02/34/646320234.db2.gz ZFCKOUKUZWSBIK-CHWSQXEVSA-N 2 0 242.407 2.299 20 0 BEADRP CC1(C)C[C@@H]([NH2+]CCc2cccnc2)C[C@@H]([NH3+])C1 ZINC000925536180 646322289 /nfs/dbraw/zinc/32/22/89/646322289.db2.gz OFFSCAHNDHGDFJ-KGLIPLIRSA-N 2 0 247.386 2.120 20 0 BEADRP CC1(C)C[C@@H]([NH2+]CC[C@H]2CCCO2)C[C@@H]([NH3+])C1 ZINC000925537671 646322505 /nfs/dbraw/zinc/32/25/05/646322505.db2.gz ZYPYMOBCBXRZJK-FRRDWIJNSA-N 2 0 240.391 2.051 20 0 BEADRP C([NH2+][C@@H]1CC[NH2+]C[C@@H]1C1CCCC1)C1CC1 ZINC000925535041 646322968 /nfs/dbraw/zinc/32/29/68/646322968.db2.gz BBCVLLJUXFRRNN-ZIAGYGMSSA-N 2 0 222.376 2.154 20 0 BEADRP COCCCC[NH2+][C@@H](c1ccccc1)[C@@H](C)N ZINC000925560567 646336121 /nfs/dbraw/zinc/33/61/21/646336121.db2.gz ZMNGFUMBILEYAQ-TZMCWYRMSA-N 2 0 236.359 2.091 20 0 BEADRP C([NH2+][C@@H]1CC[NH2+]C12CCCC2)C1(C2CC2)CC1 ZINC000925589784 646348517 /nfs/dbraw/zinc/34/85/17/646348517.db2.gz KFHAHLOENIZEGO-CYBMUJFWSA-N 2 0 234.387 2.441 20 0 BEADRP C1CC([NH2+][C@H]2CC[NH2+]C[C@H]2C2CCCC2)C1 ZINC000925593392 646349108 /nfs/dbraw/zinc/34/91/08/646349108.db2.gz GGQBTUVBDVPIED-KBPBESRZSA-N 2 0 222.376 2.297 20 0 BEADRP CC1(C)C[C@H]1C[NH2+][C@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C ZINC000925595398 646351957 /nfs/dbraw/zinc/35/19/57/646351957.db2.gz JVOFGJKDQYGHSY-RNJOBUHISA-N 2 0 236.403 2.399 20 0 BEADRP C1=CC[C@@H](C[NH2+][C@@H]2CC[NH2+]C23CCC3)CC1 ZINC000925618855 646364215 /nfs/dbraw/zinc/36/42/15/646364215.db2.gz YQMICPZXFDFKHX-CHWSQXEVSA-N 2 0 220.360 2.217 20 0 BEADRP C([NH2+][C@@H]1CC[NH2+]C12CCC2)C12CCC(CC1)C2 ZINC000925627446 646373834 /nfs/dbraw/zinc/37/38/34/646373834.db2.gz YUDDWWQGAIHEJQ-ROKHWSDSSA-N 2 0 234.387 2.441 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]C[C@@H]2CCC(F)(F)C2)C12CCC2 ZINC000925654654 646390336 /nfs/dbraw/zinc/39/03/36/646390336.db2.gz HAZJUJYYMUDWBV-MXWKQRLJSA-N 2 0 244.329 2.281 20 0 BEADRP C[C@@H]1CCC[C@@H]1C[NH2+][C@@H]1CC[NH2+]C1(C)C ZINC000925653007 646390349 /nfs/dbraw/zinc/39/03/49/646390349.db2.gz CIPYJVLUKSDKBC-IJLUTSLNSA-N 2 0 210.365 2.153 20 0 BEADRP CC1(C)C[C@@H]([NH3+])C[C@@H]([NH2+]C2CC(F)(F)C2)C1 ZINC000925651483 646392201 /nfs/dbraw/zinc/39/22/01/646392201.db2.gz DKHKASJHYIMKGR-DTWKUNHWSA-N 2 0 232.318 2.280 20 0 BEADRP CSC1(C[NH2+][C@@H]2CC[NH2+]C2(C)C)CCC1 ZINC000925656200 646394590 /nfs/dbraw/zinc/39/45/90/646394590.db2.gz IPLKJRZZBKCKNC-SNVBAGLBSA-N 2 0 228.405 2.002 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]CC2(C(F)(F)F)CC2)C12CCC2 ZINC000925673874 646402140 /nfs/dbraw/zinc/40/21/40/646402140.db2.gz ZJMVQAYFEKCZHG-RKDXNWHRSA-N 2 0 248.292 2.188 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+]CC2(C(F)(F)F)CC2)C12CCC2 ZINC000925673870 646402631 /nfs/dbraw/zinc/40/26/31/646402631.db2.gz ZJMVQAYFEKCZHG-DTWKUNHWSA-N 2 0 248.292 2.188 20 0 BEADRP COCC(C)(C)C[NH2+][C@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925674729 646404352 /nfs/dbraw/zinc/40/43/52/646404352.db2.gz SODMAPABABTTFM-NEPJUHHUSA-N 2 0 242.407 2.155 20 0 BEADRP CC1(C)C[C@H]([NH3+])C[C@@H]([NH2+]CCCCF)C1 ZINC000925678059 646406161 /nfs/dbraw/zinc/40/61/61/646406161.db2.gz ZLOLKBZXTBSXNL-GHMZBOCLSA-N 2 0 216.344 2.232 20 0 BEADRP C[C@H](F)CC[NH2+][C@@H]1CC[NH2+]C[C@H]1C1CCCC1 ZINC000925678175 646406535 /nfs/dbraw/zinc/40/65/35/646406535.db2.gz SJWZGBOLSZQDON-FPMFFAJLSA-N 2 0 242.382 2.492 20 0 BEADRP CC/C=C\C[NH2+][C@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C ZINC000925679024 646406582 /nfs/dbraw/zinc/40/65/82/646406582.db2.gz BNLWSIMJJCNHEV-GSNWTGLJSA-N 2 0 222.376 2.319 20 0 BEADRP COCC[C@H](C)C[NH2+][C@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925685494 646412234 /nfs/dbraw/zinc/41/22/34/646412234.db2.gz JSKAQLHXTIXZDD-AVGNSLFASA-N 2 0 242.407 2.155 20 0 BEADRP Cc1ccncc1C[NH2+][C@@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925689370 646414495 /nfs/dbraw/zinc/41/44/95/646414495.db2.gz IESRDSOOINPOQO-ZIAGYGMSSA-N 2 0 247.386 2.386 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000925688242 646414600 /nfs/dbraw/zinc/41/46/00/646414600.db2.gz CFFFUQMCONLLQQ-HNNXBMFYSA-N 3 0 249.402 2.056 20 0 BEADRP CCO[C@H]1C[C@@H]([NH2+][C@@H]2C[C@H]([NH3+])CC(C)(C)C2)C1 ZINC000925693101 646418457 /nfs/dbraw/zinc/41/84/57/646418457.db2.gz LFTPAUWSGXQREP-WUHRBBMRSA-N 2 0 240.391 2.050 20 0 BEADRP C1[C@@H]([NH2+][C@H]2CC[NH2+]C23CCCC3)[C@@H]1C1CCC1 ZINC000925706866 646430406 /nfs/dbraw/zinc/43/04/06/646430406.db2.gz OLSIPTYDUYMITE-MJBXVCDLSA-N 2 0 234.387 2.439 20 0 BEADRP CC1(C)[C@H](C[NH2+][C@H]2C[C@H]([NH3+])C23CCC3)C1(F)F ZINC000925706540 646431117 /nfs/dbraw/zinc/43/11/17/646431117.db2.gz LLTUUONSHAUPFU-GUBZILKMSA-N 2 0 244.329 2.137 20 0 BEADRP CC1(C)C[C@H]([NH3+])C[C@@H]([NH2+]CCc2ccoc2)C1 ZINC000925709032 646432525 /nfs/dbraw/zinc/43/25/25/646432525.db2.gz NRAAXZIZOOCWHS-CHWSQXEVSA-N 2 0 236.359 2.318 20 0 BEADRP CC1(C)C[C@@H]([NH3+])C[C@H]([NH2+]CCCCCC[NH3+])C1 ZINC000925707230 646432658 /nfs/dbraw/zinc/43/26/58/646432658.db2.gz DKXGPCBATDXLBV-STQMWFEESA-N 3 0 241.423 2.001 20 0 BEADRP CC1(C)C[C@@H]([NH2+]CCc2ccoc2)C[C@@H]([NH3+])C1 ZINC000925709033 646433350 /nfs/dbraw/zinc/43/33/50/646433350.db2.gz NRAAXZIZOOCWHS-OLZOCXBDSA-N 2 0 236.359 2.318 20 0 BEADRP C[C@@H](N)[C@H]([NH2+][C@H](C)CCCC[NH3+])c1ccccc1 ZINC000925711827 646436014 /nfs/dbraw/zinc/43/60/14/646436014.db2.gz SJWCDQQVADYOBC-NFAWXSAZSA-N 2 0 249.402 2.182 20 0 BEADRP CC1(C)C[C@@H]([NH2+]Cc2cccc(N)c2)C[C@@H]([NH3+])C1 ZINC000925714676 646438638 /nfs/dbraw/zinc/43/86/38/646438638.db2.gz USGLLNWVXHBYMA-KGLIPLIRSA-N 2 0 247.386 2.264 20 0 BEADRP C[C@]1(CC[NH2+][C@@H]2C[C@@H]([NH3+])C23CCC3)CC1(F)F ZINC000925712723 646438872 /nfs/dbraw/zinc/43/88/72/646438872.db2.gz ZIQOWBOKHPRJSD-MXWKQRLJSA-N 2 0 244.329 2.281 20 0 BEADRP C[C@]1(CC[NH2+][C@H]2C[C@@H]([NH3+])C23CCC3)CC1(F)F ZINC000925712725 646439676 /nfs/dbraw/zinc/43/96/76/646439676.db2.gz ZIQOWBOKHPRJSD-VWYCJHECSA-N 2 0 244.329 2.281 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+][C@H]1CCCC12CC2 ZINC000925723575 646447745 /nfs/dbraw/zinc/44/77/45/646447745.db2.gz BPRZTYAWBZRBNZ-QWRGUYRKSA-N 2 0 208.349 2.049 20 0 BEADRP C(C[C@@H]1CCSC1)[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000925724806 646449692 /nfs/dbraw/zinc/44/96/92/646449692.db2.gz NFKSQEZRYFVIGK-VXGBXAGGSA-N 2 0 240.416 2.004 20 0 BEADRP CCC[C@@H](CN[C@H]1CC[NH2+]C12CCC2)OCC ZINC000925724026 646449983 /nfs/dbraw/zinc/44/99/83/646449983.db2.gz VRNYRNQJEOZAEL-STQMWFEESA-N 2 0 240.391 2.066 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+][C@@H]2CCCC[C@@H]2F)C12CCC2 ZINC000925726340 646451706 /nfs/dbraw/zinc/45/17/06/646451706.db2.gz RJQSTMYYKJTBPJ-QCNOEVLYSA-N 2 0 226.339 2.127 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]1[NH2+]CC1(CC2CC2)CC1 ZINC000925734535 646451867 /nfs/dbraw/zinc/45/18/67/646451867.db2.gz SCLHBRKSQWPAPJ-RYUDHWBXSA-N 2 0 208.349 2.036 20 0 BEADRP CC1(C)[C@@H]([NH2+]C[C@H]2C=CCC2)[C@@H]2CCC[NH2+][C@@H]21 ZINC000925731009 646454376 /nfs/dbraw/zinc/45/43/76/646454376.db2.gz IURIOVSCAXCGHD-CRWXNKLISA-N 2 0 234.387 2.319 20 0 BEADRP CC1(C)C[C@@]1(C)C[NH2+][C@H]1CC[NH2+]C1(C)C ZINC000925733415 646455412 /nfs/dbraw/zinc/45/54/12/646455412.db2.gz IQQMPFOPLTWPIY-GWCFXTLKSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]([NH2+]CC1(CC2CC2)CC1)[C@H]1CC[NH2+]C1 ZINC000925734775 646458320 /nfs/dbraw/zinc/45/83/20/646458320.db2.gz ULQYAGSBJKCRBV-YPMHNXCESA-N 2 0 222.376 2.154 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+]C[C@@H]1C=CCC1 ZINC000925733482 646458328 /nfs/dbraw/zinc/45/83/28/646458328.db2.gz VTRPFIFTJARHTA-BFKVFCTQSA-N 2 0 220.360 2.058 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]C[C@]1(C)CC1(C)C ZINC000925734953 646458602 /nfs/dbraw/zinc/45/86/02/646458602.db2.gz WDXNLKOHBKGEQH-DYEKYZERSA-N 2 0 224.392 2.400 20 0 BEADRP CO[C@H]1C[C@H](C[NH2+][C@H](c2ccccc2)[C@H](C)N)C1 ZINC000925735465 646459805 /nfs/dbraw/zinc/45/98/05/646459805.db2.gz GGSGAWWFUCDFCO-JURCDPSOSA-N 2 0 248.370 2.090 20 0 BEADRP CC(C)O[C@@H]1C[C@@H]([NH2+]CCC(C)(C)[NH3+])C1(C)C ZINC000925736513 646460979 /nfs/dbraw/zinc/46/09/79/646460979.db2.gz AWLIPVMTQLWBJB-VXGBXAGGSA-N 2 0 242.407 2.296 20 0 BEADRP CC[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1C[NH2+]C[C@H]1C ZINC000925784411 646464309 /nfs/dbraw/zinc/46/43/09/646464309.db2.gz NJBMFBRECJEWBO-FVCCEPFGSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@@H]([NH2+][C@@H]1C[NH2+]C[C@H]1C)[C@@H]1CC1(C)C ZINC000925782484 646464749 /nfs/dbraw/zinc/46/47/49/646464749.db2.gz GPTYSDYTAUYRCA-WRWGMCAJSA-N 2 0 210.365 2.009 20 0 BEADRP CC[C@H]1CC[C@H]1[NH+]1CCC([NH3+])(CC)CC1 ZINC000925759823 646464908 /nfs/dbraw/zinc/46/49/08/646464908.db2.gz MHJRXOHHMVLSRR-NWDGAFQWSA-N 2 0 210.365 2.378 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@@H]1CC2(CCC2)CO1 ZINC000925772506 646471367 /nfs/dbraw/zinc/47/13/67/646471367.db2.gz IINRCFQYYHTZBJ-OLZOCXBDSA-N 2 0 240.391 2.053 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1CCC[C@]12CCCO2 ZINC000925772139 646472817 /nfs/dbraw/zinc/47/28/17/646472817.db2.gz GDTPIDLROFNMDP-MCIONIFRSA-N 2 0 240.391 2.195 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1C[C@H]1[C@H]1C[C@H]1C)[C@H]1CCC[NH2+]1 ZINC000925771831 646473768 /nfs/dbraw/zinc/47/37/68/646473768.db2.gz DIGXXSRXGWHEFE-BBMNEWJDSA-N 2 0 222.376 2.009 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+]C[C@@H]1C[NH2+]CCC1(F)F ZINC000925776231 646476136 /nfs/dbraw/zinc/47/61/36/646476136.db2.gz KHYWCJHCTGYORS-SRVKXCTJSA-N 2 0 246.345 2.255 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+]C1CCC(C(F)F)CC1 ZINC000925783720 646479709 /nfs/dbraw/zinc/47/97/09/646479709.db2.gz GMNNEGCAZJXOHY-ZYGVAYEYSA-N 2 0 246.345 2.255 20 0 BEADRP CCCC[C@@H](C)[C@@H](C)[NH2+][C@@H]1C[NH2+]C[C@H]1C ZINC000925785498 646480709 /nfs/dbraw/zinc/48/07/09/646480709.db2.gz PLJRYAGMRCVNHY-FDYHWXHSSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@@H]1CC(C)(C)C[C@@H]1[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000925785060 646480847 /nfs/dbraw/zinc/48/08/47/646480847.db2.gz LAYNCJWSRYNROP-NDBYEHHHSA-N 2 0 224.392 2.256 20 0 BEADRP CCC[C@H]1CCC[C@@H]1[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000925785252 646481185 /nfs/dbraw/zinc/48/11/85/646481185.db2.gz MHZLUEIQBOVWNK-RFGFWPKPSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@H]1CC[C@@H]1C1CCC1 ZINC000925785382 646481875 /nfs/dbraw/zinc/48/18/75/646481875.db2.gz NCTXTDUAJGSSQO-CABNGKKXSA-N 2 0 222.376 2.010 20 0 BEADRP CC[C@@H]1CCCC[C@H]1[NH2+][C@@H]1C[NH2+]C[C@H]1C ZINC000925784410 646481999 /nfs/dbraw/zinc/48/19/99/646481999.db2.gz NJBMFBRECJEWBO-FDYHWXHSSA-N 2 0 210.365 2.153 20 0 BEADRP Cc1cc([C@@H](C)[NH2+]C[C@@H]2C[NH2+]C[C@H]2C)c(C)o1 ZINC000925790852 646485230 /nfs/dbraw/zinc/48/52/30/646485230.db2.gz LSBPNPDCIYKWCM-XWIASGKRSA-N 2 0 236.359 2.403 20 0 BEADRP C[C@H](CSC(C)(C)C)[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000925793275 646485558 /nfs/dbraw/zinc/48/55/58/646485558.db2.gz XTEOODZRVWCMIL-UTUOFQBUSA-N 2 0 244.448 2.352 20 0 BEADRP CSC1CCC(C[NH2+][C@H]2CCC[C@@H]2[NH3+])CC1 ZINC000925803373 646485804 /nfs/dbraw/zinc/48/58/04/646485804.db2.gz YOLFYLBLFDLGLP-TYUFSLCMSA-N 2 0 242.432 2.378 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]C[C@]12C[C@H]1CCCC2 ZINC000925803377 646486922 /nfs/dbraw/zinc/48/69/22/646486922.db2.gz YQWLIZCYFRCOQN-RVMXOQNASA-N 2 0 210.365 2.282 20 0 BEADRP CC[C@H]([NH2+]CC[C@@H]1C[NH2+]C[C@H]1C)C(C)C ZINC000925798514 646487205 /nfs/dbraw/zinc/48/72/05/646487205.db2.gz LHXDCBGNJGMANY-UPJWGTAASA-N 2 0 212.381 2.256 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]C[C@]12C[C@H]1CCCC2 ZINC000925802564 646487423 /nfs/dbraw/zinc/48/74/23/646487423.db2.gz ORIFQMRPHMRULL-NDBYEHHHSA-N 2 0 208.349 2.036 20 0 BEADRP CC[C@H]([NH2+]CC[C@@H]1C[NH2+]C[C@H]1C)[C@H]1C[C@H]1C ZINC000925797038 646487650 /nfs/dbraw/zinc/48/76/50/646487650.db2.gz SWJVBQVBLLFONZ-POQQGIQPSA-N 2 0 224.392 2.256 20 0 BEADRP C[C@H]([NH2+]C[C@]12C[C@H]1CCCC2)[C@H]1CCC[NH2+]1 ZINC000925803276 646488020 /nfs/dbraw/zinc/48/80/20/646488020.db2.gz WPRCYSDAVYEGLZ-DGAVXFQQSA-N 2 0 222.376 2.297 20 0 BEADRP CC[C@@H]([NH2+]CC[C@@H]1C[NH2+]C[C@H]1C)C1CCC1 ZINC000925803506 646488719 /nfs/dbraw/zinc/48/87/19/646488719.db2.gz QDYASXLHTXFGCQ-MRVWCRGKSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@@H](c1ccccn1)C1CC1 ZINC000925824135 646496852 /nfs/dbraw/zinc/49/68/52/646496852.db2.gz VOLVHXPTWSSEKH-MISXGVKJSA-N 2 0 233.359 2.248 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]C[C@]12CCC[C@H]1OCC2 ZINC000925831435 646501410 /nfs/dbraw/zinc/50/14/10/646501410.db2.gz JXQRUSTZSMCSLM-BFHYXJOUSA-N 2 0 240.391 2.053 20 0 BEADRP COc1ccc([C@H](C)[NH2+][C@@H](C)C2C[NH2+]C2)cc1C ZINC000925833130 646503185 /nfs/dbraw/zinc/50/31/85/646503185.db2.gz ZMMYRWZXEZNGBK-RYUDHWBXSA-N 2 0 248.370 2.262 20 0 BEADRP C[C@@H]1CCC[C@H]1[NH2+]C[C@]12CCC[C@H]1[NH2+]CC2 ZINC000925840056 646506309 /nfs/dbraw/zinc/50/63/09/646506309.db2.gz GRCSSNXCSOQXNY-AAVRWANBSA-N 2 0 222.376 2.297 20 0 BEADRP CCC[C@@H](C)[NH2+]C[C@]12CCC[C@H]1[NH2+]CC2 ZINC000925840758 646506634 /nfs/dbraw/zinc/50/66/34/646506634.db2.gz KTLWNOKGWJXOMN-JHJVBQTASA-N 2 0 210.365 2.297 20 0 BEADRP C([NH2+][C@@H]1CCCSC1)[C@]12CCC[C@H]1[NH2+]CC2 ZINC000925839328 646506739 /nfs/dbraw/zinc/50/67/39/646506739.db2.gz ABAXWAKQMARZTE-JHJVBQTASA-N 2 0 240.416 2.004 20 0 BEADRP CC[C@@H]([NH2+]C[C@]12CCC[C@H]1[NH2+]CC2)C1CC1 ZINC000925844573 646508663 /nfs/dbraw/zinc/50/86/63/646508663.db2.gz VCABAQKDDIDKCO-MGPQQGTHSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H]([NH2+]C[C@]12CCC[C@H]1[NH2+]CC2)c1ccncc1 ZINC000925846111 646509808 /nfs/dbraw/zinc/50/98/08/646509808.db2.gz OPFOVQBKHDBUTI-NWANDNLSSA-N 2 0 245.370 2.264 20 0 BEADRP CCC[C@H](O)CC[NH2+][C@@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925856097 646510983 /nfs/dbraw/zinc/51/09/83/646510983.db2.gz JEZGXRAYDTXMDA-UPJWGTAASA-N 2 0 242.407 2.033 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@H]1CCS[C@@H](C)C1 ZINC000925861198 646513634 /nfs/dbraw/zinc/51/36/34/646513634.db2.gz OFLBOZKUQSDFIB-WOPDTQHZSA-N 2 0 230.421 2.378 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H]([NH3+])C2)CCS1 ZINC000925860699 646514875 /nfs/dbraw/zinc/51/48/75/646514875.db2.gz JQJDNWFLKYFCDI-WRWGMCAJSA-N 2 0 228.405 2.130 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+][C@@H]1CCCc2cccnc21 ZINC000925871679 646521405 /nfs/dbraw/zinc/52/14/05/646521405.db2.gz DKFLBYSPMJICBX-NTZNESFSSA-N 2 0 233.359 2.174 20 0 BEADRP C[C@@H]1CCCC[C@H]1[NH2+]C[C@@H]1CC[C@H]([NH3+])C1 ZINC000925876509 646527573 /nfs/dbraw/zinc/52/75/73/646527573.db2.gz ADIJDTGBZBVZIX-FVCCEPFGSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CC[C@H]([NH3+])C1)[C@@H]1CC1(C)C ZINC000925880172 646528732 /nfs/dbraw/zinc/52/87/32/646528732.db2.gz PGZAGMVZINNIHQ-USZNOCQGSA-N 2 0 210.365 2.138 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[NH2+][C@@H]2CCCC23CCC3)C1 ZINC000925879402 646529186 /nfs/dbraw/zinc/52/91/86/646529186.db2.gz DBWPKBASTHWZJX-YNEHKIRRSA-N 2 0 222.376 2.426 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CC[C@H]([NH3+])C1)[C@H]1CC1(C)C ZINC000925880173 646529718 /nfs/dbraw/zinc/52/97/18/646529718.db2.gz PGZAGMVZINNIHQ-WHOHXGKFSA-N 2 0 210.365 2.138 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]C[C@]23C[C@H]2CCC3)C1 ZINC000925880977 646530688 /nfs/dbraw/zinc/53/06/88/646530688.db2.gz OUNGAGPKROCGPB-VOAKCMCISA-N 2 0 208.349 2.036 20 0 BEADRP Cc1cncc([C@H](C)[NH2+]C[C@@H]2CC[C@H]([NH3+])C2)c1 ZINC000925881468 646530957 /nfs/dbraw/zinc/53/09/57/646530957.db2.gz BLKIAHMJDGDABS-SCRDCRAPSA-N 2 0 233.359 2.168 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]C1([C@@H]2CCCCO2)CC1 ZINC000925893922 646535053 /nfs/dbraw/zinc/53/50/53/646535053.db2.gz SFYFNOJYZGQAIJ-STQMWFEESA-N 2 0 240.391 2.195 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2CCc3ccccc3C2)CC1 ZINC000034289457 646554756 /nfs/dbraw/zinc/55/47/56/646554756.db2.gz XNJRTNRWKMAWCR-UHFFFAOYSA-N 2 0 244.382 2.387 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@H]1[NH2+][C@@H]1CCc2nc[nH]c2C1 ZINC000926450624 646642460 /nfs/dbraw/zinc/64/24/60/646642460.db2.gz PMYBQZSFWZYOTN-DEKYYXRVSA-N 2 0 233.359 2.291 20 0 BEADRP C[C@@H]([NH2+]C[C@H](C)C[NH+](C)C)C1CC(F)(F)C1 ZINC000926475777 646653050 /nfs/dbraw/zinc/65/30/50/646653050.db2.gz WRQLENAYLVIRRR-VHSXEESVSA-N 2 0 234.334 2.208 20 0 BEADRP C[C@H](C[NH2+][C@H](C)C1CC(F)(F)C1)C[NH+](C)C ZINC000926475773 646653599 /nfs/dbraw/zinc/65/35/99/646653599.db2.gz WRQLENAYLVIRRR-NXEZZACHSA-N 2 0 234.334 2.208 20 0 BEADRP C[C@H](C[NH2+][C@@H]1C[C@H]2C=C[C@@H]1CC2)C[NH+](C)C ZINC000926474046 646654031 /nfs/dbraw/zinc/65/40/31/646654031.db2.gz NQAKDHNFRMIUOQ-XJFOESAGSA-N 2 0 222.376 2.128 20 0 BEADRP CC[C@H](C[C@@](C)(O)CC)[NH2+]C[C@H](C)C[NH+](C)C ZINC000926473701 646654089 /nfs/dbraw/zinc/65/40/89/646654089.db2.gz NFBPHRKEVWFKTC-MJBXVCDLSA-N 2 0 244.423 2.103 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+]CCC2CC=CC2)C12CCC2 ZINC000724221187 711570161 /nfs/dbraw/zinc/57/01/61/711570161.db2.gz ZELNLUKWMXSHKQ-QWHCGFSZSA-N 2 0 220.360 2.202 20 0 BEADRP CC[C@H]1C[C@H](C)C[N@@H+]1CCC[NH2+]C1CC1 ZINC000399137192 711744250 /nfs/dbraw/zinc/74/42/50/711744250.db2.gz XPEFBDVWXYJPFC-AAEUAGOBSA-N 2 0 210.365 2.249 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]C[C@@H]2C[C@H]2C(F)(F)F)C1 ZINC000925833528 711759846 /nfs/dbraw/zinc/75/98/46/711759846.db2.gz SSMDIYSITHEIIO-SGIHWFKDSA-N 2 0 236.281 2.044 20 0 BEADRP C[NH+](C)CCCC(C)(C)[NH2+]C[C@H]1CCC=CO1 ZINC000387280520 711786690 /nfs/dbraw/zinc/78/66/90/711786690.db2.gz GALLGATVYWZCEL-CYBMUJFWSA-N 2 0 240.391 2.389 20 0 BEADRP Cc1ccccc1C[N@@H+]1CC[C@H](CC[NH3+])C1 ZINC000160064531 711805754 /nfs/dbraw/zinc/80/57/54/711805754.db2.gz NBFSZIUAWIFNAF-ZDUSSCGKSA-N 2 0 218.344 2.166 20 0 BEADRP Cc1ccsc1C[N@H+]1CC[C@@H](C)[C@@H](C[NH3+])C1 ZINC000229065719 711837325 /nfs/dbraw/zinc/83/73/25/711837325.db2.gz DSFLDCQYYBKWSA-PWSUYJOCSA-N 2 0 238.400 2.473 20 0 BEADRP C[C@H]1CCC[N@@H+]1CC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000703804425 712088062 /nfs/dbraw/zinc/08/80/62/712088062.db2.gz GHLFIXXZWFNYSY-WODVXLOZSA-N 2 0 208.349 2.001 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCSC1)[C@H]1CCC[NH2+]C1 ZINC000704810568 712118495 /nfs/dbraw/zinc/11/84/95/712118495.db2.gz BVJYLNBTCSCION-AVGNSLFASA-N 2 0 242.432 2.107 20 0 BEADRP CCC[C@H](C[NH2+][C@H]1C[C@H]([NH3+])C12CCC2)OCC ZINC000705378630 712129849 /nfs/dbraw/zinc/12/98/49/712129849.db2.gz YTUHMTNIGDNSSE-AGIUHOORSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@H](C[N@@H+]1CC[C@@H](C[NH3+])C1)CC(C)(C)C ZINC000709120945 712209333 /nfs/dbraw/zinc/20/93/33/712209333.db2.gz BADAMCPPXGMCIS-RYUDHWBXSA-N 2 0 212.381 2.339 20 0 BEADRP CC1(C)C[C@H](C[NH+]2CCC([NH3+])CC2)C(C)(C)O1 ZINC000709685953 712215542 /nfs/dbraw/zinc/21/55/42/712215542.db2.gz LPSMNBCZUOJPMZ-LLVKDONJSA-N 2 0 240.391 2.003 20 0 BEADRP C[NH2+]CCC[N@H+](C)C[C@@H]1CC(C)(C)OC1(C)C ZINC000709698154 712216057 /nfs/dbraw/zinc/21/60/57/712216057.db2.gz YTUXCMXFSCHOCV-LBPRGKRZSA-N 2 0 242.407 2.121 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]C[C@@]23C[C@@H]2CCCC3)C1 ZINC000710593785 712264208 /nfs/dbraw/zinc/26/42/08/712264208.db2.gz QDRAOYRHGHUHJK-RFQIPJPRSA-N 2 0 222.376 2.426 20 0 BEADRP CC1(C)CC[C@H](C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)OC1 ZINC000711387623 712296684 /nfs/dbraw/zinc/29/66/84/712296684.db2.gz CSMMDWGNUWCJNN-FRRDWIJNSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H]1CSCC[N@H+](C[C@]2(C)CCC[NH2+]C2)C1 ZINC000379538599 712387773 /nfs/dbraw/zinc/38/77/73/712387773.db2.gz DRSYCTADWCUIAM-QWHCGFSZSA-N 2 0 242.432 2.061 20 0 BEADRP C[N@H+](C[C@H]1CCC2(CCC2)O1)CC(C)(C)C[NH3+] ZINC000712437661 712430102 /nfs/dbraw/zinc/43/01/02/712430102.db2.gz KDLFJPGNFGKVPW-GFCCVEGCSA-N 2 0 240.391 2.005 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]CC[C@@H]2C[C@H]2C2CC2)C1 ZINC000712747516 712448733 /nfs/dbraw/zinc/44/87/33/712448733.db2.gz CUDMOCQYPABHJG-RFGFWPKPSA-N 2 0 222.376 2.282 20 0 BEADRP C=C/C=C\CC[NH2+]CC1CC[NH+](C)CC1 ZINC000713697865 712469363 /nfs/dbraw/zinc/46/93/63/712469363.db2.gz YCPGVBNASMZVFQ-PLNGDYQASA-N 2 0 208.349 2.050 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CCCS1)[C@@H]1CCCC[NH2+]1 ZINC000715623807 712528103 /nfs/dbraw/zinc/52/81/03/712528103.db2.gz RGZDHSIRQFEBQA-AVGNSLFASA-N 2 0 242.432 2.392 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]CCCCC2CC2)C1 ZINC000716412945 712559192 /nfs/dbraw/zinc/55/91/92/712559192.db2.gz LIFRQWXMRCNVIK-STQMWFEESA-N 2 0 210.365 2.426 20 0 BEADRP CC1(C[NH2+]C[C@@H]2C[NH2+]CCC2(F)F)CCC1 ZINC000717310026 712646456 /nfs/dbraw/zinc/64/64/56/712646456.db2.gz ZBZJHOXQTCKLEK-JTQLQIEISA-N 2 0 232.318 2.011 20 0 BEADRP C[C@@H](CC1CCC1)[NH2+]C[C@@H]1C[NH2+]CCC1(F)F ZINC000717335328 712649220 /nfs/dbraw/zinc/64/92/20/712649220.db2.gz NKGQPZFKDBJXOB-JQWIXIFHSA-N 2 0 246.345 2.400 20 0 BEADRP COCC(C)(C)CC[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000718662715 712776515 /nfs/dbraw/zinc/77/65/15/712776515.db2.gz AOJCHHBGBCNLRM-STQMWFEESA-N 2 0 242.407 2.121 20 0 BEADRP CO[C@H]1CCC[C@@H]([NH2+]CCCC[NH+](C)C)CC1 ZINC000718843272 712785995 /nfs/dbraw/zinc/78/59/95/712785995.db2.gz PXZZQQWTOFXKCS-KGLIPLIRSA-N 2 0 242.407 2.266 20 0 BEADRP CSCC1CC[NH+](CC[C@@H]2CC[NH2+]C2)CC1 ZINC000719298461 712804132 /nfs/dbraw/zinc/80/41/32/712804132.db2.gz GZLLIQBJOLGRBE-LBPRGKRZSA-N 2 0 242.432 2.061 20 0 BEADRP C[C@H]1CC[N@H+](CCCCCCC[NH3+])CCO1 ZINC000719780205 712824917 /nfs/dbraw/zinc/82/49/17/712824917.db2.gz VNUGHENREBEJGQ-ZDUSSCGKSA-N 2 0 228.380 2.006 20 0 BEADRP C[C@H](CC1CCC1)[NH2+]CC[C@@H]1C[NH2+]C[C@H]1C ZINC000722553440 710716027 /nfs/dbraw/zinc/71/60/27/710716027.db2.gz HVTRVGCIBROFNR-YRGRVCCFSA-N 2 0 224.392 2.400 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1CCC[C@@H](CC[NH3+])C1 ZINC000723075314 710724675 /nfs/dbraw/zinc/72/46/75/710724675.db2.gz APBFFVOJZHZJCN-XQQFMLRXSA-N 2 0 210.365 2.093 20 0 BEADRP C[C@H]1SCC[C@@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000381825926 710724915 /nfs/dbraw/zinc/72/49/15/710724915.db2.gz MHNOWAFARQPAGV-XYTAGDGMSA-N 2 0 240.416 2.095 20 0 BEADRP Cc1ccccc1OCC[N@@H+]1CC[C@H](CC[NH3+])C1 ZINC000723669332 710731793 /nfs/dbraw/zinc/73/17/93/710731793.db2.gz HPZGQECYCWJSLQ-AWEZNQCLSA-N 2 0 248.370 2.045 20 0 BEADRP CC[C@H]([NH2+][C@@H](C)CC[NH+](C)C)[C@H]1CCCOC1 ZINC000723957647 710734679 /nfs/dbraw/zinc/73/46/79/710734679.db2.gz DNRKOYKPJHREGM-IHRRRGAJSA-N 2 0 242.407 2.121 20 0 BEADRP CC[C@H]([NH2+]CCCC[NH+](C)C)[C@H]1CCCOC1 ZINC000724006089 710735748 /nfs/dbraw/zinc/73/57/48/710735748.db2.gz JRUMKVVNSBAQOG-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@]1(C[N@@H+]2CCC3(CCC3)C2)CCC[NH2+]C1 ZINC000380534490 712901293 /nfs/dbraw/zinc/90/12/93/712901293.db2.gz NAWZWCAYTRBMFD-ZDUSSCGKSA-N 2 0 222.376 2.252 20 0 BEADRP C[C@@H]1OCC[N@H+](CCCCCCC[NH3+])[C@H]1C ZINC000380492811 712901388 /nfs/dbraw/zinc/90/13/88/712901388.db2.gz AYTFQNFSUKSUIY-STQMWFEESA-N 2 0 228.380 2.005 20 0 BEADRP C[C@H](C[N@@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1)c1ccccc1 ZINC000384298959 710868855 /nfs/dbraw/zinc/86/88/55/710868855.db2.gz HXRAAUPWNWIZOR-VNQPRFMTSA-N 2 0 244.382 2.331 20 0 BEADRP C[C@@H](C[N@@H+]1CC[C@@H](CC[NH3+])C1)c1ccccc1 ZINC000385182923 711006920 /nfs/dbraw/zinc/00/69/20/711006920.db2.gz PIJJKLZRHSZHHV-UONOGXRCSA-N 2 0 232.371 2.461 20 0 BEADRP C[C@H](C[N@@H+]1CC[C@@H](CC[NH3+])C1)c1ccccc1 ZINC000385182930 711006951 /nfs/dbraw/zinc/00/69/51/711006951.db2.gz PIJJKLZRHSZHHV-ZIAGYGMSSA-N 2 0 232.371 2.461 20 0 BEADRP CSC(C)(C)CC[NH2+][C@@H](C)CC[NH+](C)C ZINC000385258500 711008531 /nfs/dbraw/zinc/00/85/31/711008531.db2.gz UOLLJFANTJRGGY-NSHDSACASA-N 2 0 232.437 2.448 20 0 BEADRP C[C@@H]([N@H+](C)C[C@]1(C)CCC[NH2+]C1)C1(C)CC1 ZINC000385467754 711013075 /nfs/dbraw/zinc/01/30/75/711013075.db2.gz ORWSYBSOILDMJJ-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP C([NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23)C(C1CC1)C1CC1 ZINC000385587167 711014358 /nfs/dbraw/zinc/01/43/58/711014358.db2.gz HFRKBDVSGKOVED-XNHWPECASA-N 2 0 246.398 2.009 20 0 BEADRP CC1CCC(C[NH2+][C@H]2[C@@H]3[NH2+]C[C@H]4C[C@H]2C[C@H]34)CC1 ZINC000385514715 711015369 /nfs/dbraw/zinc/01/53/69/711015369.db2.gz NXSGCMTXMTUIAX-SEEQJVSKSA-N 2 0 248.414 2.399 20 0 BEADRP CC(C)(CC[NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23)C1CC1 ZINC000385592991 711016031 /nfs/dbraw/zinc/01/60/31/711016031.db2.gz IZMANBUPJVFUCD-WPTOEGHWSA-N 2 0 248.414 2.399 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@@H]2CC23CCCC3)CC1 ZINC000387178854 711041693 /nfs/dbraw/zinc/04/16/93/711041693.db2.gz UWEONMCZFFIXSR-CYBMUJFWSA-N 2 0 222.376 2.251 20 0 BEADRP CS[C@@H]1CC[C@@H]([NH2+][C@@H](C)CCCC[NH3+])C1 ZINC000389731739 711087751 /nfs/dbraw/zinc/08/77/51/711087751.db2.gz SPOJQDLBYJMLCU-QJPTWQEYSA-N 2 0 230.421 2.378 20 0 BEADRP CS[C@@H]1CC[C@@H]([NH2+][C@H](C)CCCC[NH3+])C1 ZINC000389731736 711088357 /nfs/dbraw/zinc/08/83/57/711088357.db2.gz SPOJQDLBYJMLCU-IJLUTSLNSA-N 2 0 230.421 2.378 20 0 BEADRP CC(F)(F)CCC[NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2 ZINC000390106191 711106396 /nfs/dbraw/zinc/10/63/96/711106396.db2.gz SUYXYXWFVZLEGI-NGDQXYMTSA-N 2 0 244.329 2.008 20 0 BEADRP C[C@H]([NH2+][C@@H](C)C1(C)CC1)C1CC[NH+](C)CC1 ZINC000390516476 711122337 /nfs/dbraw/zinc/12/23/37/711122337.db2.gz DBRSWKKCMHEYBG-RYUDHWBXSA-N 2 0 224.392 2.495 20 0 BEADRP CC(C)C[NH+]1CCC([NH2+][C@H]2CC[C@H]2C)CC1 ZINC000390575062 711127181 /nfs/dbraw/zinc/12/71/81/711127181.db2.gz OFFLJHHPHXMFML-OCCSQVGLSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@H]2[C@@H]3[NH2+]C[C@H]4C[C@H]2C[C@H]34)C1 ZINC000392816590 711152468 /nfs/dbraw/zinc/15/24/68/711152468.db2.gz ANNOJOUXQBLVBW-MRKIUDBFSA-N 2 0 234.387 2.151 20 0 BEADRP CC[C@@H]1C[N@H+](CCCC2CC2)CC[C@@H]1[NH3+] ZINC000394569086 711195177 /nfs/dbraw/zinc/19/51/77/711195177.db2.gz PDFMDFMPYRTMJC-OLZOCXBDSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@@H]1CC[N@H+](CCCC2CC2)C[C@H]1C[NH3+] ZINC000394668596 711196918 /nfs/dbraw/zinc/19/69/18/711196918.db2.gz RAZGDHCSDURKLG-DGCLKSJQSA-N 2 0 210.365 2.093 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+][C@H]1CC2CCC1CC2 ZINC000381123555 710603389 /nfs/dbraw/zinc/60/33/89/710603389.db2.gz JBCPNIBHPJYCHJ-ABXWRUBCSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H](CC[NH3+])[NH2+]Cc1cnc2ccccc2c1 ZINC000383193130 710978606 /nfs/dbraw/zinc/97/86/06/710978606.db2.gz SISMSHLCOSICRB-LLVKDONJSA-N 2 0 229.327 2.062 20 0 BEADRP C1[C@@H]([NH2+][C@@H]2[C@H]3C[C@H]4C[NH2+][C@H]2[C@H]4C3)[C@H]2CCCC[C@@H]12 ZINC000712399785 711448656 /nfs/dbraw/zinc/44/86/56/711448656.db2.gz AGPRSBPHFCOHQT-WYYGYCARSA-N 2 0 246.398 2.151 20 0 BEADRP CO[C@@H](C[N@@H+]1CCC[C@@H](C[NH3+])C1)c1ccccc1 ZINC000382366589 711503334 /nfs/dbraw/zinc/50/33/34/711503334.db2.gz XZADMMOQHNPRKP-ZFWWWQNUSA-N 2 0 248.370 2.045 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1CC[C@]2(C1)CCC[NH2+]C2 ZINC000723106495 711504240 /nfs/dbraw/zinc/50/42/40/711504240.db2.gz MOFQPXWZTMTOCU-HZSPNIEDSA-N 2 0 222.376 2.108 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1C[C@@H]2CCC[C@H]([NH3+])[C@H]2C1 ZINC000723126405 711506540 /nfs/dbraw/zinc/50/65/40/711506540.db2.gz JDTBEXNKZSKIJI-QMVSFRDZSA-N 2 0 222.376 2.092 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@@H](CC[NH3+])C2)c(C)c1 ZINC000723669943 711533217 /nfs/dbraw/zinc/53/32/17/711533217.db2.gz MGMJJYWAOWCYTL-CQSZACIVSA-N 2 0 232.371 2.474 20 0 BEADRP Cc1cc(C[N@@H+]2CC[C@H](CC[NH3+])C2)ccc1F ZINC000723669550 711533537 /nfs/dbraw/zinc/53/35/37/711533537.db2.gz JKAUGJXVIBUSBB-LBPRGKRZSA-N 2 0 236.334 2.305 20 0 BEADRP C[C@@H]1CCCC[C@H]1C[N@@H+]1CC[C@H](CC[NH3+])C1 ZINC000723678359 711533938 /nfs/dbraw/zinc/53/39/38/711533938.db2.gz JZZPOORMCCEWGF-RDBSUJKOSA-N 2 0 224.392 2.483 20 0 BEADRP Cc1cc(C)nc(C[NH+]2CCC(CC[NH3+])CC2)c1 ZINC000723846566 711539116 /nfs/dbraw/zinc/53/91/16/711539116.db2.gz UWRPWXLYHRWSIF-UHFFFAOYSA-N 2 0 247.386 2.259 20 0 BEADRP C[C@@H]1C[N@H+](CCCC2CCC2)C[C@H]1CC[NH3+] ZINC000723892014 711543975 /nfs/dbraw/zinc/54/39/75/711543975.db2.gz SPARJNMWOXNVGA-TZMCWYRMSA-N 2 0 224.392 2.483 20 0 BEADRP C[C@@H](c1ccncc1)[N@@H+]1C[C@@H](C)[C@H](CC[NH3+])C1 ZINC000723890788 711544141 /nfs/dbraw/zinc/54/41/41/711544141.db2.gz IGELBUWASAUJSH-MBNYWOFBSA-N 2 0 233.359 2.059 20 0 BEADRP CO[C@H]1CC[C@@H]1[N@H+](C)CCCCCCC[NH3+] ZINC000724205276 711569345 /nfs/dbraw/zinc/56/93/45/711569345.db2.gz ADUPICYPVHOILN-STQMWFEESA-N 2 0 228.380 2.005 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]CCC1CC=CC1 ZINC000724203846 711569553 /nfs/dbraw/zinc/56/95/53/711569553.db2.gz VWZFYEKQMDPKCQ-UONOGXRCSA-N 2 0 222.376 2.450 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+]CCC1CC=CC1 ZINC000724203844 711569616 /nfs/dbraw/zinc/56/96/16/711569616.db2.gz VWZFYEKQMDPKCQ-KGLIPLIRSA-N 2 0 222.376 2.450 20 0 BEADRP C[C@@H]([NH2+]CCCC[N@H+](C)C1CC1)c1ccnnc1 ZINC000926559852 711646686 /nfs/dbraw/zinc/64/66/86/711646686.db2.gz PJHBOMFFVNAMPB-GFCCVEGCSA-N 2 0 248.374 2.002 20 0 BEADRP CC1CC([NH2+][C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)C1 ZINC000252909534 711651638 /nfs/dbraw/zinc/65/16/38/711651638.db2.gz AFBDGDOCMSEXJD-PNKMZZHYSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@@H]1CCC[C@@H]1C[NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32 ZINC000383104495 711667940 /nfs/dbraw/zinc/66/79/40/711667940.db2.gz CSVRDWRYGUNIQM-UBRSESRLSA-N 2 0 234.387 2.009 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+][C@@H]1CCC1(C)C ZINC000722509456 711760254 /nfs/dbraw/zinc/76/02/54/711760254.db2.gz UNQNEQRIWHXULR-IJLUTSLNSA-N 2 0 210.365 2.010 20 0 BEADRP [NH3+][C@H]1CCCCC[C@@H]1[NH2+]C[C@]12C[C@H]1CCC2 ZINC000925880317 711762109 /nfs/dbraw/zinc/76/21/09/711762109.db2.gz JEIZWHNQPZDPRS-RFGFWPKPSA-N 2 0 222.376 2.426 20 0 BEADRP Cc1ccccc1C[N@@H+]1CC[C@@H](CC[NH3+])C1 ZINC000160064684 711805530 /nfs/dbraw/zinc/80/55/30/711805530.db2.gz NBFSZIUAWIFNAF-CYBMUJFWSA-N 2 0 218.344 2.166 20 0 BEADRP Cc1cccc(C[N@@H+]2CC[C@H](CC[NH3+])C2)c1 ZINC000160042536 711805670 /nfs/dbraw/zinc/80/56/70/711805670.db2.gz AZHVIAQPDDHXMT-ZDUSSCGKSA-N 2 0 218.344 2.166 20 0 BEADRP C[NH+]1CCC(C[NH2+]C[C@H]2CCCCS2)CC1 ZINC000087683107 711838411 /nfs/dbraw/zinc/83/84/11/711838411.db2.gz HNQFWMMITPXKKV-CYBMUJFWSA-N 2 0 242.432 2.204 20 0 BEADRP C[C@@H]1CC[C@H](C)[N@H+]1C[C@H]1CCCC[NH2+]C1 ZINC000706428795 711914209 /nfs/dbraw/zinc/91/42/09/711914209.db2.gz AQLYKZISHOXWTA-XQQFMLRXSA-N 2 0 210.365 2.249 20 0 BEADRP C1CC1[C@H]1CC[C@H]1[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000530216510 711937717 /nfs/dbraw/zinc/93/77/17/711937717.db2.gz PYJSRPWPNRDONH-UPJWGTAASA-N 2 0 220.360 2.049 20 0 BEADRP CSC[C@@H]1CCC[N@@H+]1C[C@@H]1CCCC[NH2+]C1 ZINC000700271375 711989443 /nfs/dbraw/zinc/98/94/43/711989443.db2.gz AVROYTOTEGKLJQ-OLZOCXBDSA-N 2 0 242.432 2.204 20 0 BEADRP CCSC1(C[NH2+][C@@H]2CCCN[C@@H]2C)CC1 ZINC000700796459 712005737 /nfs/dbraw/zinc/00/57/37/712005737.db2.gz WVDBGVFJOXGJQX-GHMZBOCLSA-N 2 0 228.405 2.002 20 0 BEADRP C[N@@H+]1CCCC[C@@H](C[NH2+]C[C@H]2CCC=CO2)C1 ZINC000700812279 712006812 /nfs/dbraw/zinc/00/68/12/712006812.db2.gz HRXWHALCXXTDFG-UONOGXRCSA-N 2 0 238.375 2.001 20 0 BEADRP C[N@@H+]1CCCC[C@@H](C[NH2+]C[C@@H]2CCC=CO2)C1 ZINC000700812276 712007019 /nfs/dbraw/zinc/00/70/19/712007019.db2.gz HRXWHALCXXTDFG-KBPBESRZSA-N 2 0 238.375 2.001 20 0 BEADRP CC1(C)C[C@]1(C)C[NH2+][C@H]1CCC[C@H]1C[NH3+] ZINC000701983931 712034402 /nfs/dbraw/zinc/03/44/02/712034402.db2.gz IZONWNBNWQMXKO-GMXVVIOVSA-N 2 0 210.365 2.140 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C[C@@]2(C)CC2(C)C)CC[N@@H+]1C ZINC000701980778 712034506 /nfs/dbraw/zinc/03/45/06/712034506.db2.gz JZWZZYPDMXUBJA-MBNYWOFBSA-N 2 0 224.392 2.495 20 0 BEADRP Cc1cc(C[N@H+](C)CCCCCC[NH3+])ccn1 ZINC000703158678 712066674 /nfs/dbraw/zinc/06/66/74/712066674.db2.gz GCSXYHIHMQNTTR-UHFFFAOYSA-N 2 0 235.375 2.341 20 0 BEADRP C[C@H](C[N@H+](C)C[C@H]1C[C@@H]([NH3+])C1)C(C)(C)C ZINC000703441033 712075452 /nfs/dbraw/zinc/07/54/52/712075452.db2.gz ZAXINSMIMCYVSX-UTUOFQBUSA-N 2 0 212.381 2.338 20 0 BEADRP C[NH+]1CCC(C[NH2+]CC[C@H]2CCSC2)CC1 ZINC000704790149 712116935 /nfs/dbraw/zinc/11/69/35/712116935.db2.gz KKQOHORJWBCOIW-ZDUSSCGKSA-N 2 0 242.432 2.061 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]CC[C@@H]1CCSC1 ZINC000704797960 712117785 /nfs/dbraw/zinc/11/77/85/712117785.db2.gz OHMRMFJRKQRKCX-AGIUHOORSA-N 2 0 242.432 2.237 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CC[C@@H]1CCSC1 ZINC000704840194 712119125 /nfs/dbraw/zinc/11/91/25/712119125.db2.gz GSPOJOUFEQKPIO-NWDGAFQWSA-N 2 0 230.421 2.237 20 0 BEADRP CCC[C@H](C[NH2+][C@H]1C[C@@H]([NH3+])C12CCC2)OCC ZINC000705378633 712129709 /nfs/dbraw/zinc/12/97/09/712129709.db2.gz YTUHMTNIGDNSSE-UPJWGTAASA-N 2 0 240.391 2.051 20 0 BEADRP CC[N@H+](CCC[NH2+]C1CC1)[C@H](C)C(C)C ZINC000706481196 712147541 /nfs/dbraw/zinc/14/75/41/712147541.db2.gz QLNZUHYTADAENI-GFCCVEGCSA-N 2 0 212.381 2.495 20 0 BEADRP C1=CC[C@H](CC[NH2+][C@H]2[C@@H]3[NH2+]C[C@H]4C[C@H]2C[C@H]34)CC1 ZINC000706841509 712157505 /nfs/dbraw/zinc/15/75/05/712157505.db2.gz CDMOTEXUUSROTO-RWHKXBQASA-N 2 0 246.398 2.319 20 0 BEADRP CSC1CC([NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)C1 ZINC000706927320 712161856 /nfs/dbraw/zinc/16/18/56/712161856.db2.gz GSQRQQHTWZHUQP-IGJPJIBNSA-N 2 0 240.416 2.097 20 0 BEADRP Cc1cc(C)[nH+]c(NCC2CC[NH+](C)CC2)c1 ZINC000707940052 712174169 /nfs/dbraw/zinc/17/41/69/712174169.db2.gz FAHNBPZXFAPNDZ-UHFFFAOYSA-N 2 0 233.359 2.452 20 0 BEADRP C[C@@H](C[N@@H+]1CC[C@H](C[NH3+])C1)CC(C)(C)C ZINC000709120949 712209226 /nfs/dbraw/zinc/20/92/26/712209226.db2.gz BADAMCPPXGMCIS-VXGBXAGGSA-N 2 0 212.381 2.339 20 0 BEADRP C[C@@H]1[C@H]2CC[C@@H](C[C@@H]1[NH2+][C@@H]1CCCSC1)[NH2+]2 ZINC000709284555 712219045 /nfs/dbraw/zinc/21/90/45/712219045.db2.gz NQPFJNVLCNOAQH-MLGHIDQZSA-N 2 0 240.416 2.001 20 0 BEADRP C[C@@H]1[C@H]2CC[C@@H](C[C@@H]1[NH2+][C@@H]1CCCC13CC3)[NH2+]2 ZINC000709371529 712220500 /nfs/dbraw/zinc/22/05/00/712220500.db2.gz MAJCOLGVYIUSRG-XHJNMGKDSA-N 2 0 234.387 2.438 20 0 BEADRP C[C@@H]1[C@H]2CC[C@@H](C[C@@H]1[NH2+][C@H]1CCCC13CC3)[NH2+]2 ZINC000709371524 712220533 /nfs/dbraw/zinc/22/05/33/712220533.db2.gz MAJCOLGVYIUSRG-BJJPWKGXSA-N 2 0 234.387 2.438 20 0 BEADRP C[C@@H]1[C@H]2CC[C@@H](C[C@@H]1[NH2+]C1CCCC1)[NH2+]2 ZINC000709374468 712220617 /nfs/dbraw/zinc/22/06/17/712220617.db2.gz QNEMBIZBDMAUOD-MGAJPHDKSA-N 2 0 208.349 2.048 20 0 BEADRP [NH3+][C@H]1C[C@H]2C[C@@H](C1)[N@H+](CC1CCCCC1)C2 ZINC000709824567 712228629 /nfs/dbraw/zinc/22/86/29/712228629.db2.gz FKWDJNUOXWHOMJ-IHRRRGAJSA-N 2 0 222.376 2.378 20 0 BEADRP C1=CCC(C[N@@H+]2CC[C@@]3(C2)CCC[NH2+]C3)C1 ZINC000709919932 712232704 /nfs/dbraw/zinc/23/27/04/712232704.db2.gz OAGSLJOBUOKMOK-AWEZNQCLSA-N 2 0 220.360 2.028 20 0 BEADRP C[C@H](CC1CCC1)[NH2+][C@H]1C[C@@H]([NH3+])C12CCC2 ZINC000710271216 712250172 /nfs/dbraw/zinc/25/01/72/712250172.db2.gz JONRCCHLISUANM-RTXFEEFZSA-N 2 0 222.376 2.425 20 0 BEADRP C[C@H](C[N@@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1)C(C)(C)C ZINC000710720033 712255473 /nfs/dbraw/zinc/25/54/73/712255473.db2.gz MCNNFYDAQMKNOB-FRRDWIJNSA-N 2 0 224.392 2.210 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@H]1CCC(C)(C)CO1 ZINC000711389455 712296765 /nfs/dbraw/zinc/29/67/65/712296765.db2.gz IYXPHVZTYOGQJE-CHWSQXEVSA-N 2 0 242.407 2.299 20 0 BEADRP [NH3+]CCCCCCC[N@@H+]1CC[C@@H](CF)C1 ZINC000711497431 712306975 /nfs/dbraw/zinc/30/69/75/712306975.db2.gz WXHIKFBHYBZOQJ-LBPRGKRZSA-N 2 0 216.344 2.187 20 0 BEADRP C[NH+]1CCC(C[NH2+]CC2=CCCCC2)CC1 ZINC000379586850 712389249 /nfs/dbraw/zinc/38/92/49/712389249.db2.gz KVUBZQLFIPFNHP-UHFFFAOYSA-N 2 0 222.376 2.418 20 0 BEADRP CC[C@H]1CCCN(C[C@@H]([NH3+])CC(F)F)C1 ZINC000379783113 712399047 /nfs/dbraw/zinc/39/90/47/712399047.db2.gz GUGLZUIIEOBDGJ-UWVGGRQHSA-N 2 0 220.307 2.091 20 0 BEADRP CC1(C)CC[C@H]1[NH2+]C[C@H]1CCCCC[NH2+]1 ZINC000379789848 712399471 /nfs/dbraw/zinc/39/94/71/712399471.db2.gz IXOQCAZXQPKGDP-VXGBXAGGSA-N 2 0 210.365 2.297 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+][C@@H]2C[C@@H]3CCCC[C@H]23)C12CCC2 ZINC000712373207 712428186 /nfs/dbraw/zinc/42/81/86/712428186.db2.gz HAHRLCOTSUQVFN-PDWCTOEPSA-N 2 0 234.387 2.425 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+][C@@H]2C[C@@H]3CCCC[C@H]23)C12CCC2 ZINC000712373206 712428235 /nfs/dbraw/zinc/42/82/35/712428235.db2.gz HAHRLCOTSUQVFN-ODXJTPSBSA-N 2 0 234.387 2.425 20 0 BEADRP C1[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)[C@H]2CCCC[C@@H]12 ZINC000712488503 712431370 /nfs/dbraw/zinc/43/13/70/712431370.db2.gz REDIZEIEHHFQKR-ZRGDOOIKSA-N 2 0 234.387 2.438 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[C@@H]2CCCC[C@H]12)[C@@H]1CCC[NH2+]1 ZINC000712496338 712431483 /nfs/dbraw/zinc/43/14/83/712431483.db2.gz WXPNEDPGBUCRQD-IKOXMDCHSA-N 2 0 222.376 2.295 20 0 BEADRP Cc1cc(NC[C@H]2CC[N@H+]2C)c2ccccc2[nH+]1 ZINC000712525122 712440830 /nfs/dbraw/zinc/44/08/30/712440830.db2.gz BKDBYXIFBPXPKK-GFCCVEGCSA-N 2 0 241.338 2.081 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1C[C@H]1C1CC1)[C@@H]1CCC[NH2+]1 ZINC000712748174 712448685 /nfs/dbraw/zinc/44/86/85/712448685.db2.gz DTXWGOZTURQICB-ZZVYKPCYSA-N 2 0 222.376 2.153 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+]CC[C@@H]2C[C@H]2C2CC2)C12CCC2 ZINC000712751236 712449488 /nfs/dbraw/zinc/44/94/88/712449488.db2.gz QYVANTNBBVZFFC-ZOBORPQBSA-N 2 0 234.387 2.282 20 0 BEADRP C=C/C=C\CC[NH2+][C@H]1CC[NH2+]CC1(C)C ZINC000713464409 712460662 /nfs/dbraw/zinc/46/06/62/712460662.db2.gz JSGYHVNZIVNYSQ-FJOGCWAESA-N 2 0 208.349 2.096 20 0 BEADRP CC1(C)CC[C@@H](C[NH+]2CCC(C)([NH3+])CC2)OC1 ZINC000713595935 712466406 /nfs/dbraw/zinc/46/64/06/712466406.db2.gz JOTKTRHTRBKNSE-LBPRGKRZSA-N 2 0 240.391 2.005 20 0 BEADRP C=C/C=C\CC[N@@H+](C)C1CCC([NH3+])CC1 ZINC000713700930 712469332 /nfs/dbraw/zinc/46/93/32/712469332.db2.gz DQFLEKZRVHFDQX-PLNGDYQASA-N 2 0 208.349 2.320 20 0 BEADRP C=C/C=C/CC[N@@H+](C)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000713731293 712470856 /nfs/dbraw/zinc/47/08/56/712470856.db2.gz FDRSGQFQADQSIX-ZIRQINBESA-N 2 0 220.360 2.334 20 0 BEADRP C=C/C=C/CC[N@H+]1C[C@@H]2CCC[C@H]([NH3+])[C@H]2C1 ZINC000713741428 712471022 /nfs/dbraw/zinc/47/10/22/712471022.db2.gz UNIIIYURTYLSOC-UCLKDPGMSA-N 2 0 220.360 2.178 20 0 BEADRP C[N@H+](C[C@@H]1CCCC(C)(C)O1)CC(C)(C)C[NH3+] ZINC000714379847 712480091 /nfs/dbraw/zinc/48/00/91/712480091.db2.gz LUDIVIZJJGKFOA-LBPRGKRZSA-N 2 0 242.407 2.251 20 0 BEADRP CC(C)(C[NH3+])C1CC[NH+](Cc2ccccn2)CC1 ZINC000714454427 712490327 /nfs/dbraw/zinc/49/03/27/712490327.db2.gz FZJLHLVTVLZNHI-UHFFFAOYSA-N 2 0 247.386 2.279 20 0 BEADRP CCC1([NH3+])CC[NH+](C2Cc3ccccc3C2)CC1 ZINC000714756156 712497679 /nfs/dbraw/zinc/49/76/79/712497679.db2.gz AJSHIVIRGHTWKO-UHFFFAOYSA-N 2 0 244.382 2.357 20 0 BEADRP CC[C@H]1C[N@H+](CC[C@@H]2C[C@H]2C2CC2)CC[C@H]1[NH3+] ZINC000714833107 712501108 /nfs/dbraw/zinc/50/11/08/712501108.db2.gz RZKKEVAVSHJDMS-PMOUVXMZSA-N 2 0 236.403 2.482 20 0 BEADRP CC[C@H](COC)[NH2+]C1CCC(C)([NH+](C)C)CC1 ZINC000715506549 712523982 /nfs/dbraw/zinc/52/39/82/712523982.db2.gz AUGMCSGBGPVPKW-IYXRBSQSSA-N 2 0 242.407 2.264 20 0 BEADRP CC[C@@H](COC)[NH2+]C1CCC(C)([NH+](C)C)CC1 ZINC000715506548 712524135 /nfs/dbraw/zinc/52/41/35/712524135.db2.gz AUGMCSGBGPVPKW-HSBZDZAISA-N 2 0 242.407 2.264 20 0 BEADRP CO[C@@H](C)[C@@H](C)[NH2+]C1CCC(C)([NH+](C)C)CC1 ZINC000715511222 712524553 /nfs/dbraw/zinc/52/45/53/712524553.db2.gz UMFHELYOPGRIFD-KBHBFKLGSA-N 2 0 242.407 2.262 20 0 BEADRP CCC[C@H](C[NH2+][C@H]1CCC[C@H]([NH+](C)C)C1)OC ZINC000715532492 712526158 /nfs/dbraw/zinc/52/61/58/712526158.db2.gz MLNDFDKCAGEFDD-MELADBBJSA-N 2 0 242.407 2.264 20 0 BEADRP CC[C@](C)(C[NH2+][C@H]1CCC[C@H]([NH+](C)C)C1)OC ZINC000715543932 712527345 /nfs/dbraw/zinc/52/73/45/712527345.db2.gz OSFVEERIKZPQLK-MELADBBJSA-N 2 0 242.407 2.264 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]CC[C@H]1CCCS1 ZINC000715600102 712527771 /nfs/dbraw/zinc/52/77/71/712527771.db2.gz ICKMLSBPIRKXSS-YNEHKIRRSA-N 2 0 242.432 2.379 20 0 BEADRP CC[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@@H]([NH+](C)C)C2)CO1 ZINC000715560756 712528821 /nfs/dbraw/zinc/52/88/21/712528821.db2.gz DSWDTWUOPPHTQA-IGQOVBAYSA-N 2 0 240.391 2.016 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]CCCCC2CC2)C12CCC2 ZINC000716369650 712556869 /nfs/dbraw/zinc/55/68/69/712556869.db2.gz LOHPIORDUXMESV-STQMWFEESA-N 2 0 222.376 2.426 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@@H]2C[C@@H]2[C@@H]2C[C@@H]2C)CC1 ZINC000716584504 712564151 /nfs/dbraw/zinc/56/41/51/712564151.db2.gz PPJSCKJWIBAUSO-VIRABCJISA-N 2 0 236.403 2.352 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@@H]2C[C@@H]2[C@@H]2C[C@H]2C)CC1 ZINC000716584503 712564270 /nfs/dbraw/zinc/56/42/70/712564270.db2.gz PPJSCKJWIBAUSO-OSRDXIQISA-N 2 0 236.403 2.352 20 0 BEADRP C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000716546526 712567674 /nfs/dbraw/zinc/56/76/74/712567674.db2.gz PTMZAUSDWZPSMY-UCKQBZRPSA-N 2 0 222.376 2.138 20 0 BEADRP C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000716639565 712568617 /nfs/dbraw/zinc/56/86/17/712568617.db2.gz VZPXEEGEBCECHF-VTMBPIDISA-N 2 0 248.414 2.495 20 0 BEADRP C[N@H+](CCCF)CCCC1CC[NH2+]CC1 ZINC000716807137 712575931 /nfs/dbraw/zinc/57/59/31/712575931.db2.gz AIQNQJFNUDWDIM-UHFFFAOYSA-N 2 0 216.344 2.058 20 0 BEADRP CC(C)C[C@H](C)[NH2+]C[C@@H]1C[NH2+]CCC1(F)F ZINC000717015807 712604638 /nfs/dbraw/zinc/60/46/38/712604638.db2.gz BQRUXEKCVOPOIO-QWRGUYRKSA-N 2 0 234.334 2.255 20 0 BEADRP CC(C)C[C@@H](C)[NH2+]C[C@@H]1C[NH2+]CCC1(F)F ZINC000717015806 712604663 /nfs/dbraw/zinc/60/46/63/712604663.db2.gz BQRUXEKCVOPOIO-MNOVXSKESA-N 2 0 234.334 2.255 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@H]2CC3CCC2CC3)CC1 ZINC000379852510 712616915 /nfs/dbraw/zinc/61/69/15/712616915.db2.gz KTWBIJNDEIYRCX-ZALBZXLWSA-N 2 0 236.403 2.497 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]CC[C@@H]2CC[C@H]3C[C@H]32)C1 ZINC000717070524 712628190 /nfs/dbraw/zinc/62/81/90/712628190.db2.gz UGPSHJZTXRUHST-HPCHECBXSA-N 2 0 222.376 2.282 20 0 BEADRP C(C[C@@H]1CC[C@@H]2C[C@@H]21)[NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32 ZINC000717136866 712634595 /nfs/dbraw/zinc/63/45/95/712634595.db2.gz NCPBAKOKPBLSOZ-QVFPMHOFSA-N 2 0 246.398 2.009 20 0 BEADRP CC1(C)CC[C@H]1[NH2+]C[C@H]1C[NH2+]CCC1(F)F ZINC000717305462 712645997 /nfs/dbraw/zinc/64/59/97/712645997.db2.gz NVFCCPNPVNIXGJ-NXEZZACHSA-N 2 0 232.318 2.009 20 0 BEADRP CCC(CC)C[NH2+]C[C@@H]1C[NH2+]CCC1(F)F ZINC000717311521 712646306 /nfs/dbraw/zinc/64/63/06/712646306.db2.gz YPCKHUSOOYLQDC-NSHDSACASA-N 2 0 234.334 2.257 20 0 BEADRP [NH3+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2CC1CC=CC1 ZINC000717321457 712649025 /nfs/dbraw/zinc/64/90/25/712649025.db2.gz OVSJIJCYFUZCNI-AGUYFDCRSA-N 2 0 220.360 2.297 20 0 BEADRP CC(C)[C@H]1C[N@H+](C[C@@H]2CC[C@H]([NH3+])C2)CCS1 ZINC000718015618 712736708 /nfs/dbraw/zinc/73/67/08/712736708.db2.gz WBKHHBGFPARRKT-FRRDWIJNSA-N 2 0 242.432 2.187 20 0 BEADRP C[N@H+](CCCC(C)(F)F)CC(C)(C)[NH3+] ZINC000718613048 712773553 /nfs/dbraw/zinc/77/35/53/712773553.db2.gz SNUYWSWVRHTQAJ-UHFFFAOYSA-N 2 0 208.296 2.091 20 0 BEADRP CC(F)(F)CCC[N@@H+]1CC[C@@H](CC[NH3+])C1 ZINC000718639109 712776277 /nfs/dbraw/zinc/77/62/77/712776277.db2.gz ASUVOQXFKKKWMV-SNVBAGLBSA-N 2 0 220.307 2.093 20 0 BEADRP C[C@@H](C[NH2+][C@@H]1CCSC1)C[NH+]1CCCCC1 ZINC000038041651 712801402 /nfs/dbraw/zinc/80/14/02/712801402.db2.gz GIKKLCGTDAZDLJ-QWHCGFSZSA-N 2 0 242.432 2.204 20 0 BEADRP C[C@H]1CC([NH2+]C[C@H]2C[C@H]([NH3+])C2)C[C@H](C)C1 ZINC000719376285 712807073 /nfs/dbraw/zinc/80/70/73/712807073.db2.gz GHVQZSADHVUGSC-DDHJBXDOSA-N 2 0 210.365 2.138 20 0 BEADRP CC(C)CC[N@@H+]1C[C@H](C[NH3+])[C@H](C(F)(F)F)C1 ZINC000720806741 712867139 /nfs/dbraw/zinc/86/71/39/712867139.db2.gz RAOPMJCQJXMOQS-VHSXEESVSA-N 2 0 238.297 2.102 20 0 BEADRP CC(C)C[C@H](C)[NH2+]CC[C@@H]1C[NH2+]C[C@H]1C ZINC000721075667 712889859 /nfs/dbraw/zinc/88/98/59/712889859.db2.gz NVAPBVWMXICQMC-FRRDWIJNSA-N 2 0 212.381 2.256 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+]C1CCCCC1 ZINC000721075605 712890025 /nfs/dbraw/zinc/89/00/25/712890025.db2.gz NUBYNEGICYANFM-VXGBXAGGSA-N 2 0 210.365 2.154 20 0 BEADRP CC[C@@H](C)[C@@H](C)[NH2+]CC[C@@H]1C[NH2+]C[C@H]1C ZINC000721120708 712892273 /nfs/dbraw/zinc/89/22/73/712892273.db2.gz JEOYRDSGIBWUIK-FDYHWXHSSA-N 2 0 212.381 2.256 20 0 BEADRP C[C@H]([NH2+]CCN1CCC[C@@H]1C)C1CCC1 ZINC000380354069 712892939 /nfs/dbraw/zinc/89/29/39/712892939.db2.gz WHKOPDFPNJLOJR-RYUDHWBXSA-N 2 0 210.365 2.249 20 0 BEADRP CCO[C@H]1CCC[C@H]([NH2+]CCCC[NH+](C)C)C1 ZINC000721170034 712894751 /nfs/dbraw/zinc/89/47/51/712894751.db2.gz XFWRHAJYMVLNML-KBPBESRZSA-N 2 0 242.407 2.266 20 0 BEADRP CS[C@@H](C)CC[N@H+](C)CC1CC[NH+](C)CC1 ZINC001208141240 957014443 /nfs/dbraw/zinc/01/44/43/957014443.db2.gz JSPYFSKWSDDVMJ-LBPRGKRZSA-N 2 0 244.448 2.402 20 0 BEADRP Cc1cc(C)[nH+]c(N(C)CC2CC[NH+](C)CC2)c1 ZINC001165040857 721930782 /nfs/dbraw/zinc/93/07/82/721930782.db2.gz QYNJNXFVQYVVDJ-UHFFFAOYSA-N 2 0 247.386 2.476 20 0 BEADRP CCC(CC)C[N@@H+]1CCCC[C@@H](C[NH3+])C1 ZINC000308846795 959526820 /nfs/dbraw/zinc/52/68/20/959526820.db2.gz LPOARYKWNJFOKF-ZDUSSCGKSA-N 2 0 212.381 2.483 20 0 BEADRP CC[C@@H]1CC[C@H]([NH+]2CCC(C)([NH3+])CC2)C1 ZINC000309517382 959897398 /nfs/dbraw/zinc/89/73/98/959897398.db2.gz ZAMQIZUWKCYYKI-NEPJUHHUSA-N 2 0 210.365 2.378 20 0 BEADRP C[N@@H+]1CCC[C@H](CC[NH2+][C@H]2C[C@H]3C[C@H]3C2)C1 ZINC001167898232 961529444 /nfs/dbraw/zinc/52/94/44/961529444.db2.gz QDGXRGHPYIDNCU-MQYQWHSLSA-N 2 0 222.376 2.106 20 0 BEADRP C[NH+](C)C1CCC([NH+]2CC(C(F)F)C2)CC1 ZINC001168329989 964463900 /nfs/dbraw/zinc/46/39/00/964463900.db2.gz MCSDGVVJFIYOKE-UHFFFAOYSA-N 2 0 232.318 2.056 20 0 BEADRP CCCC[C@@H](C)[NH2+]CC[C@@H](C)[NH+](C)C ZINC000697868677 964596191 /nfs/dbraw/zinc/59/61/91/964596191.db2.gz CKOTXFUXPXHAKE-VXGBXAGGSA-N 2 0 200.370 2.495 20 0 BEADRP CC[NH+](CC)CCOC1CCC([NH+](C)C)CC1 ZINC001224926781 965103829 /nfs/dbraw/zinc/10/38/29/965103829.db2.gz AOONSFGPQFTUCM-UHFFFAOYSA-N 2 0 242.407 2.218 20 0 BEADRP CC1(C[N@@H+]2CC[C@H]3C[C@@]3([NH3+])C2)CCCCC1 ZINC001235166334 966023625 /nfs/dbraw/zinc/02/36/25/966023625.db2.gz RICTZLRAHPNZRH-GXTWGEPZSA-N 2 0 222.376 2.380 20 0 BEADRP c1cncc([C@@H]2CCC[N@H+]2C[C@H]2CCC[NH2+]C2)c1 ZINC000249911893 1165831929 /nfs/dbraw/zinc/83/19/29/1165831929.db2.gz OMDWRBNDAQWOAO-ZFWWWQNUSA-N 2 0 245.370 2.218 20 0 BEADRP Cc1csc(C[N@@H+]2CCC[C@@H]([NH3+])CC2)c1 ZINC001205102631 967346573 /nfs/dbraw/zinc/34/65/73/967346573.db2.gz UWUBOUPYXSNAAX-LLVKDONJSA-N 2 0 224.373 2.370 20 0 BEADRP CSCC[C@H](C)[NH2+]CC[C@@H]1CCC[N@@H+]1C ZINC000707909434 967388542 /nfs/dbraw/zinc/38/85/42/967388542.db2.gz HXMJSQJESRDPSZ-RYUDHWBXSA-N 2 0 230.421 2.202 20 0 BEADRP C[C@@H]1c2ccccc2CC[N@H+]1CCCC[NH3+] ZINC001205164927 967404935 /nfs/dbraw/zinc/40/49/35/967404935.db2.gz WNFYGEBJVWXEDP-GFCCVEGCSA-N 2 0 218.344 2.345 20 0 BEADRP C[C@@H]1C[N@H+](CC(C)(C)C)CCC[C@@H]1C[NH3+] ZINC001205981144 967918895 /nfs/dbraw/zinc/91/88/95/967918895.db2.gz BXWMJAUPGZPUKG-VXGBXAGGSA-N 2 0 212.381 2.339 20 0 BEADRP C[C@@H](C[NH+](C)C)Nc1cc[nH+]c(C2CC2)c1 ZINC001163782442 968117850 /nfs/dbraw/zinc/11/78/50/968117850.db2.gz INFLKLPQZLIYAI-JTQLQIEISA-N 2 0 219.332 2.321 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CCC[C@@](C)(C[NH3+])CC1 ZINC001206295633 968202962 /nfs/dbraw/zinc/20/29/62/968202962.db2.gz MKAHFTZPPDOLCF-JHJVBQTASA-N 2 0 210.365 2.093 20 0 BEADRP COC(C)(C)CC[N@@H+]1CCC[C@](C)(C[NH3+])CC1 ZINC001206295764 968200520 /nfs/dbraw/zinc/20/05/20/968200520.db2.gz NJKYYQVRQYUWSO-AWEZNQCLSA-N 2 0 242.407 2.252 20 0 BEADRP CC(C)[NH+]1CCC2(CCC[N@H+](C)C2)CC1 ZINC000167270761 1165964337 /nfs/dbraw/zinc/96/43/37/1165964337.db2.gz JQMXQOZRJXDLKH-UHFFFAOYSA-N 2 0 210.365 2.203 20 0 BEADRP Cc1cc(Nc2cc[nH+]c(N)c2)cc[nH+]1 ZINC000257667437 1166069781 /nfs/dbraw/zinc/06/97/81/1166069781.db2.gz KXCZCOWPZGAWLN-UHFFFAOYSA-N 2 0 200.245 2.111 20 0 BEADRP [NH3+]CCCC[N@@H+]1CCc2c(Cl)cccc2C1 ZINC000082790932 1166079298 /nfs/dbraw/zinc/07/92/98/1166079298.db2.gz NIWLLAPDKRVBQY-UHFFFAOYSA-N 2 0 238.762 2.437 20 0 BEADRP C[NH+](C)CC(C)(C)C[NH+]1C2CCC1CC2 ZINC001207284125 968719111 /nfs/dbraw/zinc/71/91/11/968719111.db2.gz JMULUMRZMIRTCV-UHFFFAOYSA-N 2 0 210.365 2.201 20 0 BEADRP CCC[N@H+](CC)CCC1CC[NH+](C)CC1 ZINC001207480083 968799093 /nfs/dbraw/zinc/79/90/93/968799093.db2.gz TZKUESUPKMAQJM-UHFFFAOYSA-N 2 0 212.381 2.450 20 0 BEADRP CC[C@H](C)[C@@H](C)[NH2+]C[C@H]1C[NH+]2CCC1CC2 ZINC001207723696 968867136 /nfs/dbraw/zinc/86/71/36/968867136.db2.gz MUPSPEHMLSTJOB-SCRDCRAPSA-N 2 0 224.392 2.352 20 0 BEADRP CCC(CC)C[N@@H+]1CC[C@@H]2[NH2+]CCC[C@@H]2C1 ZINC000129189031 1166159790 /nfs/dbraw/zinc/15/97/90/1166159790.db2.gz UNRGAQPCHRQAEI-KGLIPLIRSA-N 2 0 224.392 2.497 20 0 BEADRP CCC(CC)C[N@@H+]1CC[C@H]2[NH2+]CCC[C@@H]2C1 ZINC000129188794 1166159931 /nfs/dbraw/zinc/15/99/31/1166159931.db2.gz UNRGAQPCHRQAEI-ZIAGYGMSSA-N 2 0 224.392 2.497 20 0 BEADRP CSCC[N@H+](C)CC1(C)CC[NH+](C)CC1 ZINC001208110846 969009468 /nfs/dbraw/zinc/00/94/68/969009468.db2.gz HIPIYLOMHWBGSD-UHFFFAOYSA-N 2 0 230.421 2.013 20 0 BEADRP CS[C@@H](C)CC[N@@H+]1C[C@H]2CC[NH+](C)C[C@H]2C1 ZINC001208145585 969064533 /nfs/dbraw/zinc/06/45/33/969064533.db2.gz YNJPVISGSXKICW-XQQFMLRXSA-N 2 0 242.432 2.012 20 0 BEADRP C[N@@H+]1CC[C@]2(C1)CCCN(c1cc[nH+]cc1)C2 ZINC000224244296 1166219043 /nfs/dbraw/zinc/21/90/43/1166219043.db2.gz MPNOVHORSSFHBA-AWEZNQCLSA-N 2 0 231.343 2.004 20 0 BEADRP CCC(CC)[N@H+](CC)C[C@H](O)C[NH+](CC)CC ZINC001253188413 969106094 /nfs/dbraw/zinc/10/60/94/969106094.db2.gz YAAVYMJFCCIXAY-CQSZACIVSA-N 2 0 244.423 2.200 20 0 BEADRP CCC1CC[NH+](C[C@H]2CCC[N@H+](C)C2)CC1 ZINC001208608206 969146560 /nfs/dbraw/zinc/14/65/60/969146560.db2.gz RZJPWTZJOZBNDH-AWEZNQCLSA-N 2 0 224.392 2.450 20 0 BEADRP C[C@@H]1C[N@H+](C[C@H]2CCC[NH+](C)C2)CCC1(F)F ZINC001208609272 969147537 /nfs/dbraw/zinc/14/75/37/969147537.db2.gz ZYJZLEJZRJHNIO-NEPJUHHUSA-N 2 0 246.345 2.305 20 0 BEADRP CC[C@H]1CN(c2cc(C)nc(C)n2)[C@@H](CC)C[NH2+]1 ZINC000086466405 1166278177 /nfs/dbraw/zinc/27/81/77/1166278177.db2.gz PNXKHVHSLZYFPS-STQMWFEESA-N 2 0 248.374 2.060 20 0 BEADRP CCCCC[C@H](O)C[N@H+](CC)CCC[NH+](C)C ZINC001253540538 969210982 /nfs/dbraw/zinc/21/09/82/969210982.db2.gz FIYKEFJNKVNPFP-AWEZNQCLSA-N 2 0 244.423 2.201 20 0 BEADRP CC/C=C\CC[N@H+]1C[C@H]2C[NH+](CC)C[C@H]2C1 ZINC001208733023 969217045 /nfs/dbraw/zinc/21/70/45/969217045.db2.gz AOHOZPHBRQQQJX-YOQOKRQFSA-N 2 0 222.376 2.226 20 0 BEADRP CC[NH+]1C[C@H]2C[NH+](CCCC(C)C)C[C@@H]2C1 ZINC001208737758 969228651 /nfs/dbraw/zinc/22/86/51/969228651.db2.gz ZZNVXJRNMSEDCP-KBPBESRZSA-N 2 0 224.392 2.306 20 0 BEADRP CC[C@H](C[C@@H](C)CC)[N@H+](C)CCC[NH3+] ZINC000227744761 1166308186 /nfs/dbraw/zinc/30/81/86/1166308186.db2.gz NYICZAMSKZTNLI-NWDGAFQWSA-N 2 0 200.370 2.482 20 0 BEADRP CC(C)[C@H](C[NH3+])C[N@@H+]1CC[C@@H]2CCCC[C@@H]21 ZINC000226598143 1166310677 /nfs/dbraw/zinc/31/06/77/1166310677.db2.gz DZKMQXVZBMIEBF-MJBXVCDLSA-N 2 0 224.392 2.482 20 0 BEADRP [NH3+]CCC[N@H+](C1CCCCC1)[C@@H]1CCCOC1 ZINC000224833550 1166337181 /nfs/dbraw/zinc/33/71/81/1166337181.db2.gz JZLVPYNVCSLTOD-CQSZACIVSA-N 2 0 240.391 2.149 20 0 BEADRP CCCC[N@H+](C)CCC[NH2+]C[C@H](O)C(C)(C)C ZINC001253740862 969362416 /nfs/dbraw/zinc/36/24/16/969362416.db2.gz LLVHNTXXFKQNJT-ZDUSSCGKSA-N 2 0 244.423 2.105 20 0 BEADRP CC[C@@H](C)C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169078819 969398211 /nfs/dbraw/zinc/39/82/11/969398211.db2.gz HNSQLEUDVURXFO-FVCCEPFGSA-N 2 0 210.365 2.247 20 0 BEADRP CCC[N@H+](CCCCOC)CCC[NH+](C)C ZINC001209219203 969406187 /nfs/dbraw/zinc/40/61/87/969406187.db2.gz FPKISMUTUOZSFC-UHFFFAOYSA-N 2 0 230.396 2.077 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CCC(C)(C)C1)C2 ZINC001169139380 969444530 /nfs/dbraw/zinc/44/45/30/969444530.db2.gz BNKRUECPPNNYTB-ITGUQSILSA-N 2 0 222.376 2.344 20 0 BEADRP CN1[C@@H]2CC[C@H]1C[C@@H]([N@H+](C)C(C)(C)C)C2 ZINC001169141820 969456727 /nfs/dbraw/zinc/45/67/27/969456727.db2.gz YBFSFECCXNSBCN-GDNZZTSVSA-N 2 0 210.365 2.342 20 0 BEADRP CC(C)(C)CC[N@@H+]1CC[C@@H]2[NH2+]CCC[C@H]2C1 ZINC000250691872 1166423205 /nfs/dbraw/zinc/42/32/05/1166423205.db2.gz KBPLCYRFBKIEBP-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP [NH3+]Cc1ccccc1C[NH2+]C1CCCC1 ZINC000129792635 1166448570 /nfs/dbraw/zinc/44/85/70/1166448570.db2.gz PYECEHWZKPKMCF-UHFFFAOYSA-N 2 0 204.317 2.178 20 0 BEADRP C[C@@H]1CCC[N@@H+]([C@H]2CCC[NH+](C)CC2)C1 ZINC001254516481 969691087 /nfs/dbraw/zinc/69/10/87/969691087.db2.gz MUROCHZCGBCAPW-OLZOCXBDSA-N 2 0 210.365 2.203 20 0 BEADRP CSC1CC[NH+]([C@H]2CCC[N@H+](C)CC2)CC1 ZINC001254522486 969706753 /nfs/dbraw/zinc/70/67/53/969706753.db2.gz GTFDACRWZJKWTJ-LBPRGKRZSA-N 2 0 242.432 2.298 20 0 BEADRP CC[C@H]1CCC[N@@H+]1[C@@H]1CCC[NH+](C)CC1 ZINC001254522077 969707898 /nfs/dbraw/zinc/70/78/98/969707898.db2.gz BMSUZWITJLCNIM-QWHCGFSZSA-N 2 0 210.365 2.345 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH+]2CCC(C(F)F)CC2)CC1 ZINC001254526216 969714865 /nfs/dbraw/zinc/71/48/65/969714865.db2.gz PVMJDPQMFXFBSD-GFCCVEGCSA-N 2 0 246.345 2.448 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH+]2CCC3(CCC3)C2)CC1 ZINC001254525189 969723078 /nfs/dbraw/zinc/72/30/78/969723078.db2.gz HFLALUBRHCSESU-CYBMUJFWSA-N 2 0 222.376 2.347 20 0 BEADRP CC(C)(C)[C@@H]1CC[N@H+](CC2(C[NH3+])CCC2)C1 ZINC000166294581 1166554672 /nfs/dbraw/zinc/55/46/72/1166554672.db2.gz JUGVOQXASYHMQA-GFCCVEGCSA-N 2 0 224.392 2.483 20 0 BEADRP [NH3+]CCC[N@H+]([C@H]1CCSC1)C1CCCCC1 ZINC001255269063 970020821 /nfs/dbraw/zinc/02/08/21/970020821.db2.gz WQWUFAMAFXMYAF-ZDUSSCGKSA-N 2 0 242.432 2.475 20 0 BEADRP CCCC[C@H](C)[N@@H+]1C[C@H]2CC[NH+](C)C[C@H]2C1 ZINC001255324869 970106119 /nfs/dbraw/zinc/10/61/19/970106119.db2.gz GXOOZGXZFKRSKI-MJBXVCDLSA-N 2 0 224.392 2.449 20 0 BEADRP CN(c1cc[nH+]cc1C(F)(F)F)C(C)(C)C[NH3+] ZINC001170058739 970106885 /nfs/dbraw/zinc/10/68/85/970106885.db2.gz CXBOTHAFRDSTIV-UHFFFAOYSA-N 2 0 247.264 2.274 20 0 BEADRP C[C@H]1CC[C@@H]([NH+]2CCC3(C[NH+](C)C3)CC2)C1 ZINC001170152945 970466679 /nfs/dbraw/zinc/46/66/79/970466679.db2.gz YGUNCFNNKPJRDL-QWHCGFSZSA-N 2 0 222.376 2.203 20 0 BEADRP CC[C@@H](C)C[N@@H+]1CCC[C@@]2(CCC[NH2+]C2)C1 ZINC000228080215 1166750480 /nfs/dbraw/zinc/75/04/80/1166750480.db2.gz YSNBNHRHEXZVCQ-ZIAGYGMSSA-N 2 0 224.392 2.498 20 0 BEADRP CC[C@H]1C[C@@H]([NH2+]CCCCCCC[NH3+])CCO1 ZINC001170178091 970553346 /nfs/dbraw/zinc/55/33/46/970553346.db2.gz MZNJIGUJMNPGDF-KBPBESRZSA-N 2 0 242.407 2.443 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]CC1CSC1 ZINC001255942632 970574454 /nfs/dbraw/zinc/57/44/54/970574454.db2.gz GZVOUQASOUBSFA-LLVKDONJSA-N 2 0 230.421 2.059 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]CC1CC(OC)C1 ZINC001255954848 970578842 /nfs/dbraw/zinc/57/88/42/970578842.db2.gz JHNVHKJHGGPTFM-HSBZDZAISA-N 2 0 242.407 2.121 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]C[C@H]1C[C@H](F)C1 ZINC001255945045 970579041 /nfs/dbraw/zinc/57/90/41/970579041.db2.gz JCQAPXMSIDBNPH-JHJVBQTASA-N 2 0 230.371 2.445 20 0 BEADRP CCCC[C@H](CO)[NH2+][C@@H](C)CC[NH+](CC)CC ZINC001255946616 970581219 /nfs/dbraw/zinc/58/12/19/970581219.db2.gz XDPBKEYENHUSBF-UONOGXRCSA-N 2 0 244.423 2.248 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]CCC1CC1 ZINC001255946782 970581265 /nfs/dbraw/zinc/58/12/65/970581265.db2.gz ZUZNKOMIOQODBZ-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP CC(C)(C)[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000036960305 1166819904 /nfs/dbraw/zinc/81/99/04/1166819904.db2.gz PINSJFJPFXQERS-UHFFFAOYSA-N 2 0 233.359 2.439 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]C1(CO)CCCC1 ZINC001255946777 970583162 /nfs/dbraw/zinc/58/31/62/970583162.db2.gz ZTAILKKKKUTNFF-CYBMUJFWSA-N 2 0 242.407 2.002 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+][C@H]1CC1(C)C ZINC001255948179 970584774 /nfs/dbraw/zinc/58/47/74/970584774.db2.gz GRJUMIRHSWVGTJ-RYUDHWBXSA-N 2 0 212.381 2.495 20 0 BEADRP C[C@@H](C[NH2+][C@@H](C)[C@@H]1CCC[NH2+]1)C(C)(C)C ZINC000400480483 970586799 /nfs/dbraw/zinc/58/67/99/970586799.db2.gz FMSLVYFCBGGEGV-SRVKXCTJSA-N 2 0 212.381 2.399 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+][C@@H](CCO)C(C)C ZINC001255953165 970590470 /nfs/dbraw/zinc/59/04/70/970590470.db2.gz XVKUOPQZJYXGKJ-KBPBESRZSA-N 2 0 244.423 2.103 20 0 BEADRP C[C@H]1C[NH2+]CC[N@H+](CCCC2CCCC2)C1 ZINC000225275602 1166858584 /nfs/dbraw/zinc/85/85/84/1166858584.db2.gz CNAVHSFXFPDESM-ZDUSSCGKSA-N 2 0 224.392 2.498 20 0 BEADRP [NH2+]=CNc1ccc([C@@H]2CCC[NH2+]C2)cc1 ZINC001167870726 1166877604 /nfs/dbraw/zinc/87/76/04/1166877604.db2.gz ALGYMXUEQOLBBC-LLVKDONJSA-N 2 0 203.289 2.173 20 0 BEADRP CC[C@@H]1CC[C@H](C)[N@H+](C[C@]2(C)CC[NH2+]C2)C1 ZINC000304412141 1166914781 /nfs/dbraw/zinc/91/47/81/1166914781.db2.gz YHBPBYOPSRVIBY-BFHYXJOUSA-N 2 0 224.392 2.497 20 0 BEADRP CN1CCC([N@@H+]2CCC3(CCCC3)C2)CC1 ZINC001256207659 970713582 /nfs/dbraw/zinc/71/35/82/970713582.db2.gz REISMQVAGMRMDZ-UHFFFAOYSA-N 2 0 222.376 2.347 20 0 BEADRP CCSC[C@H](C)[NH2+]CC(C)(C)C[NH+](C)C ZINC001173292606 975170457 /nfs/dbraw/zinc/17/04/57/975170457.db2.gz ZTDUNQNOOQDSCI-NSHDSACASA-N 2 0 232.437 2.305 20 0 BEADRP CC1(C)C[C@H]([N@@H+]2CCCC[C@H](C[NH3+])C2)CCO1 ZINC000310449326 1167151067 /nfs/dbraw/zinc/15/10/67/1167151067.db2.gz XRJQEQNYZTUYCW-CHWSQXEVSA-N 2 0 240.391 2.005 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]CC(C)C ZINC000308508812 1167185189 /nfs/dbraw/zinc/18/51/89/1167185189.db2.gz JXIBPNWZUSXHDV-LBPRGKRZSA-N 2 0 200.370 2.352 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H](C)Cc1cccc(Cl)c1 ZINC000309322875 1167290625 /nfs/dbraw/zinc/29/06/25/1167290625.db2.gz HKZYHKIQAJSOCM-GHMZBOCLSA-N 2 0 240.778 2.455 20 0 BEADRP CC(C)C[C@@H](CNc1cc[nH+]cc1)[NH+](C)C ZINC000309422871 1167304120 /nfs/dbraw/zinc/30/41/20/1167304120.db2.gz AETKSDMSYDBJDA-ZDUSSCGKSA-N 2 0 221.348 2.470 20 0 BEADRP CC(C)[C@H](C[NH3+])C[N@H+](C)[C@@H](C)C1(C)CC1 ZINC000385505075 1167393712 /nfs/dbraw/zinc/39/37/12/1167393712.db2.gz LOWIRHOQTCDEET-NWDGAFQWSA-N 2 0 212.381 2.338 20 0 BEADRP C([C@H]1CCCC[NH2+]1)[N@@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC000227167685 1167446426 /nfs/dbraw/zinc/44/64/26/1167446426.db2.gz CYKPDYNGQBVWRG-MJBXVCDLSA-N 2 0 222.376 2.393 20 0 BEADRP C[NH+](C)Cc1ccccc1C1=CC[NH2+]CC1 ZINC000033487566 1167551196 /nfs/dbraw/zinc/55/11/96/1167551196.db2.gz XRXLKFJTGIEDOX-UHFFFAOYSA-N 2 0 216.328 2.125 20 0 BEADRP FC1(F)CC[NH+](CC2C[C@H]3CC[C@@H](C2)[NH2+]3)CC1 ZINC000699236988 1167761452 /nfs/dbraw/zinc/76/14/52/1167761452.db2.gz XZLLGPKYJDBRLA-YOGCLGLASA-N 2 0 244.329 2.248 20 0 BEADRP C[N@H+](CCC[NH3+])Cc1cccc2c1CCCC2 ZINC001235435761 1167790084 /nfs/dbraw/zinc/79/00/84/1167790084.db2.gz XXALCXNLGVIPCB-UHFFFAOYSA-N 2 0 232.371 2.346 20 0 BEADRP Cc1cc2[nH]ccc2c(N2CCC[C@H]([NH3+])[C@@H]2C)[nH+]1 ZINC001157740992 970764563 /nfs/dbraw/zinc/76/45/63/970764563.db2.gz JDQYQBNFJDWLDV-JQWIXIFHSA-N 2 0 244.342 2.187 20 0 BEADRP CC[C@@H]1CC[C@@H]([NH2+]C[C@@H]2CC[N@H+](C)C2)C1 ZINC000070643337 978861996 /nfs/dbraw/zinc/86/19/96/978861996.db2.gz DBURVKNRIMMDND-FRRDWIJNSA-N 2 0 210.365 2.106 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@H]2CSC2(C)C)CC1 ZINC001181204447 979016583 /nfs/dbraw/zinc/01/65/83/979016583.db2.gz DTZHHZLZSRTNDP-LBPRGKRZSA-N 2 0 242.432 2.202 20 0 BEADRP CCC1CCC([N@@H+]2C[C@@H]3CC[NH2+]C[C@@H]3C2)CC1 ZINC000310528336 1168239683 /nfs/dbraw/zinc/23/96/83/1168239683.db2.gz NMNBTCYWFBRTIS-RAFNIBEQSA-N 2 0 236.403 2.497 20 0 BEADRP C(C1CCC1)[NH+]1CCC([C@H]2CCC[NH2+]2)CC1 ZINC000083839930 1168281423 /nfs/dbraw/zinc/28/14/23/1168281423.db2.gz DKUPRICHQCQCGK-CQSZACIVSA-N 2 0 222.376 2.251 20 0 BEADRP [NH3+]CC1CC[NH+]([C@@H]2CCc3c2cccc3F)CC1 ZINC000149336455 1168317296 /nfs/dbraw/zinc/31/72/96/1168317296.db2.gz QCRSXPRXMIEYJD-OAHLLOKOSA-N 2 0 248.345 2.484 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]C[C@@H]2CC[N@H+](C)C2)C1 ZINC000037484633 1168418432 /nfs/dbraw/zinc/41/84/32/1168418432.db2.gz BBTVVGXGKRDVLS-AGIUHOORSA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)CC[C@H](C)[NH2+]C[C@H]1CC[N@H+](C)C1 ZINC000037484739 1168418699 /nfs/dbraw/zinc/41/86/99/1168418699.db2.gz ARIUGHDZUNOUIH-QWHCGFSZSA-N 2 0 212.381 2.352 20 0 BEADRP C[NH+](C)C[C@H]1CCCN1c1cc2[nH]ccc2c[nH+]1 ZINC001165070936 1168428956 /nfs/dbraw/zinc/42/89/56/1168428956.db2.gz AQJYGEVUQJUKPI-GFCCVEGCSA-N 2 0 244.342 2.093 20 0 BEADRP C[C@@H]1CCC[C@H]([N@H+](C)CCC[NH+](C)C)C1 ZINC000337344930 1168458783 /nfs/dbraw/zinc/45/87/83/1168458783.db2.gz ZMYRPGAQZSZVOK-OLZOCXBDSA-N 2 0 212.381 2.449 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]Cc2cccs2)C12CCC2 ZINC000405207782 1168465087 /nfs/dbraw/zinc/46/50/87/1168465087.db2.gz BDGTZVJIFLSLJQ-GHMZBOCLSA-N 2 0 222.357 2.108 20 0 BEADRP Cc1ccc2c(c1)C1(C[C@@H]2[NH3+])CC[NH2+]CC1 ZINC001239320191 980530623 /nfs/dbraw/zinc/53/06/23/980530623.db2.gz ZGQFWBGHYXGPNO-ZDUSSCGKSA-N 2 0 216.328 2.020 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]C[C@H]1CCC[C@@H](C)C1 ZINC001345105260 980544343 /nfs/dbraw/zinc/54/43/43/980544343.db2.gz RKBNYBXSZTVLTR-UPJWGTAASA-N 2 0 212.381 2.400 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@H]1CCCC12CCC2 ZINC001345484166 980618488 /nfs/dbraw/zinc/61/84/88/980618488.db2.gz VZYCOGXNCOZACE-RYUDHWBXSA-N 2 0 210.365 2.297 20 0 BEADRP C[N@@H+]1CC[C@@H]2C[NH+]([C@H]3C[C@@H]4[C@H](C3)C4(C)C)C[C@@H]2C1 ZINC001170752859 1168591585 /nfs/dbraw/zinc/59/15/85/1168591585.db2.gz KXRQJFKTFORZBU-QKGCVVFFSA-N 2 0 248.414 2.305 20 0 BEADRP CC(C)CC[N@@H+]1CCCC[C@]12CC[NH2+]C2 ZINC000257690694 1168600113 /nfs/dbraw/zinc/60/01/13/1168600113.db2.gz NMBYORZWJSDGEV-CYBMUJFWSA-N 2 0 210.365 2.251 20 0 BEADRP CCC[N@H+](CCC[NH+](C)C)[C@@H]1CCCOCC1 ZINC001170840339 1168606905 /nfs/dbraw/zinc/60/69/05/1168606905.db2.gz MFQFLFMQAXVQIW-CQSZACIVSA-N 2 0 242.407 2.219 20 0 BEADRP C1C[N@H+]([C@H]2CCCSC2)[C@]2(C1)CCC[NH2+]C2 ZINC000257696482 1168608055 /nfs/dbraw/zinc/60/80/55/1168608055.db2.gz KHNUJBKVWPHHAZ-STQMWFEESA-N 2 0 240.416 2.100 20 0 BEADRP C1C[N@H+]([C@@H]2CCCSC2)[C@@]2(C1)CCC[NH2+]C2 ZINC000257696478 1168608082 /nfs/dbraw/zinc/60/80/82/1168608082.db2.gz KHNUJBKVWPHHAZ-CHWSQXEVSA-N 2 0 240.416 2.100 20 0 BEADRP CO[C@@H]1CCC[C@@H]([NH2+]CCCCCCC[NH3+])C1 ZINC001172922874 1168683643 /nfs/dbraw/zinc/68/36/43/1168683643.db2.gz JKMKHKYVGPBJGR-ZIAGYGMSSA-N 2 0 242.407 2.443 20 0 BEADRP CO[C@@H]1CCC[C@@H]([NH2+]C(C)(C)CC[NH+](C)C)C1 ZINC001172921122 1168684519 /nfs/dbraw/zinc/68/45/19/1168684519.db2.gz VBKSLWGMAPDLTC-CHWSQXEVSA-N 2 0 242.407 2.264 20 0 BEADRP CC[C@H](C)C[N@H+]1CC[C@@H](C[NH3+])[C@@H](C)CC1 ZINC001205605134 1168791452 /nfs/dbraw/zinc/79/14/52/1168791452.db2.gz ZFSKTNUGBGMHML-AVGNSLFASA-N 2 0 212.381 2.339 20 0 BEADRP C[NH+](C)CCC[N@H+](C)[C@H]1CCC(C)(C)C1 ZINC000348935888 1168838368 /nfs/dbraw/zinc/83/83/68/1168838368.db2.gz QMWSZCMPLBALGS-LBPRGKRZSA-N 2 0 212.381 2.449 20 0 BEADRP CC1(C)CO[C@H](CC[NH2+][C@H]2CCC[C@H]([NH3+])C2)C1 ZINC000717287183 1168967477 /nfs/dbraw/zinc/96/74/77/1168967477.db2.gz ZJQNWYIIVPWOEX-RWMBFGLXSA-N 2 0 240.391 2.051 20 0 BEADRP C[NH2+][C@@]12CC[C@@]([NH2+]C[C@H]3C[C@@H]3C)(C1)CCC2 ZINC001276034041 1169063067 /nfs/dbraw/zinc/06/30/67/1169063067.db2.gz QFKSNLKVDXOEKZ-RFQIPJPRSA-N 2 0 222.376 2.297 20 0 BEADRP C[NH2+][C@@]12CC[C@@]([NH2+]C[C@H]3C[C@H]3C)(C1)CCC2 ZINC001276034043 1169064479 /nfs/dbraw/zinc/06/44/79/1169064479.db2.gz QFKSNLKVDXOEKZ-YIYPIFLZSA-N 2 0 222.376 2.297 20 0 BEADRP CC[NH+]1C[C@@H]2C[NH+](CCC(C)(C)C)C[C@H]2C1 ZINC001202114949 983567352 /nfs/dbraw/zinc/56/73/52/983567352.db2.gz JRQXXACXUQWJLC-CHWSQXEVSA-N 2 0 224.392 2.306 20 0 BEADRP C[C@H]1C[C@@H](C[N@H+]2C[C@@H]3CC=CC[C@@H]3C2)CC[NH2+]1 ZINC000394902637 1169256823 /nfs/dbraw/zinc/25/68/23/1169256823.db2.gz NRXAQMBWCAOXTI-ZQDZILKHSA-N 2 0 234.387 2.273 20 0 BEADRP CC(C)(C)C1CCC([NH2+][C@@H]2C[C@H]2N)CC1 ZINC001255497187 1169258168 /nfs/dbraw/zinc/25/81/68/1169258168.db2.gz IPUVSNHFKOAYRT-KIDURHIOSA-N 2 0 210.365 2.281 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[N@@H+]1CCC[C@H](OC)C1 ZINC001255954437 1169272256 /nfs/dbraw/zinc/27/22/56/1169272256.db2.gz DOQOVZANTXYCGZ-KBPBESRZSA-N 2 0 242.407 2.218 20 0 BEADRP [NH3+]Cc1cccc(Nc2ccc3c(c2)C[NH2+]C3)c1 ZINC001159648951 1169438669 /nfs/dbraw/zinc/43/86/69/1169438669.db2.gz IVEXJBFJDJUFRN-UHFFFAOYSA-N 2 0 239.322 2.492 20 0 BEADRP CC(C)(C)[NH2+]C1CCC([NH+]2CCOCC2)CC1 ZINC001256675802 970912914 /nfs/dbraw/zinc/91/29/14/970912914.db2.gz JAMUVCMADQFMNX-UHFFFAOYSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@@H](Cc1ccncc1)[N@H+](C)C1CCC([NH3+])CC1 ZINC001256723707 970944252 /nfs/dbraw/zinc/94/42/52/970944252.db2.gz ZRMWJBHRSDNBLW-GRTSSRMGSA-N 2 0 247.386 2.214 20 0 BEADRP [NH3+]C[C@@H]1CCC[N@H+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)C1 ZINC000403507822 970956577 /nfs/dbraw/zinc/95/65/77/970956577.db2.gz BGRWPZMOARQIBQ-RQJABVFESA-N 2 0 222.376 2.093 20 0 BEADRP C[C@@H]1CC[N@@H+](C2CCN(c3cc[nH+]cc3)CC2)C1 ZINC001256857835 970999234 /nfs/dbraw/zinc/99/92/34/970999234.db2.gz WSALNIDREQJIET-CYBMUJFWSA-N 2 0 245.370 2.392 20 0 BEADRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)S2 ZINC000403654059 971008557 /nfs/dbraw/zinc/00/85/57/971008557.db2.gz IBOYQVIKHLSNLX-JVGWCMFKSA-N 2 0 240.416 2.130 20 0 BEADRP CCCC[C@@H](C)[N@H+](C)CCC[NH+](C)C ZINC000352414550 971025829 /nfs/dbraw/zinc/02/58/29/971025829.db2.gz IIAZRYPPEZFFHT-GFCCVEGCSA-N 2 0 200.370 2.449 20 0 BEADRP C[C@@H]([NH3+])c1cccc(C2=C[NH2+]CCC2)c1 ZINC001243951404 971040623 /nfs/dbraw/zinc/04/06/23/971040623.db2.gz GJGCHXSGTANVTD-SNVBAGLBSA-N 2 0 202.301 2.431 20 0 BEADRP CC[C@@H]1C[N@H+](CCCCCC[NH3+])[C@@H](C)CO1 ZINC000403862637 971074509 /nfs/dbraw/zinc/07/45/09/971074509.db2.gz WJLPSIAEFMPDGK-QWHCGFSZSA-N 2 0 228.380 2.005 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCCCC[NH+](C)C)C[C@H](C)O1 ZINC001257073730 971087917 /nfs/dbraw/zinc/08/79/17/971087917.db2.gz UEJVIEPPWRVNDS-BTTYYORXSA-N 2 0 242.407 2.264 20 0 BEADRP CC[C@@H]1C[N@H+](CCCCCCC[NH3+])[C@H](C)CO1 ZINC000403915626 971090422 /nfs/dbraw/zinc/09/04/22/971090422.db2.gz OPDNKBAPYNHXIM-ZIAGYGMSSA-N 2 0 242.407 2.395 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]C[C@H]2CC(C)(C)O2)CC1 ZINC001257207778 971128568 /nfs/dbraw/zinc/12/85/68/971128568.db2.gz JFYXBIICVWOJMP-CYBMUJFWSA-N 2 0 240.391 2.016 20 0 BEADRP CCC[C@@H](CC)[N@@H+]1C[C@H]2CC[NH+](C)C[C@H]2C1 ZINC001257261473 971159212 /nfs/dbraw/zinc/15/92/12/971159212.db2.gz YWNCKBHXTUOWGY-HZSPNIEDSA-N 2 0 224.392 2.449 20 0 BEADRP CCC[C@H](CC)[N@@H+]1C[C@H]2CC[NH+](C)C[C@H]2C1 ZINC001257261475 971160856 /nfs/dbraw/zinc/16/08/56/971160856.db2.gz YWNCKBHXTUOWGY-RDBSUJKOSA-N 2 0 224.392 2.449 20 0 BEADRP CCC(CC)[NH2+][C@@H]1C[C@H]2CC[N@H+](C1)[C@H]2C ZINC001257290723 971175258 /nfs/dbraw/zinc/17/52/58/971175258.db2.gz ALBCAFAMHIDGAH-DMDPSCGWSA-N 2 0 210.365 2.247 20 0 BEADRP CCC1(C[NH2+][C@@H]2C[C@H]([NH3+])C23CCC3)CCC1 ZINC000405201037 971208471 /nfs/dbraw/zinc/20/84/71/971208471.db2.gz AOAUARYTPCZZCG-NWDGAFQWSA-N 2 0 222.376 2.426 20 0 BEADRP CCC1(C[NH2+][C@@H]2C[C@@H]([NH3+])C23CCC3)CCC1 ZINC000405201044 971210307 /nfs/dbraw/zinc/21/03/07/971210307.db2.gz AOAUARYTPCZZCG-VXGBXAGGSA-N 2 0 222.376 2.426 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]CCCc2ccccc2)C12CCC2 ZINC000405232926 971213503 /nfs/dbraw/zinc/21/35/03/971213503.db2.gz BVWQHFSMHLEOLC-GJZGRUSLSA-N 2 0 244.382 2.479 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]CCc2cccc(F)c2)C12CCC2 ZINC000405234161 971214371 /nfs/dbraw/zinc/21/43/71/971214371.db2.gz RZSFDTJANNSJGO-ZIAGYGMSSA-N 2 0 248.345 2.228 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+]CCCC(F)(F)F)C12CCC2 ZINC000405226229 971214654 /nfs/dbraw/zinc/21/46/54/971214654.db2.gz DEMQUCSPXNJCKQ-DTWKUNHWSA-N 2 0 236.281 2.188 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+]CC2=CCCCC2)C12CCC2 ZINC000405257364 971217763 /nfs/dbraw/zinc/21/77/63/971217763.db2.gz LKAUNZBIGAYWRC-QWHCGFSZSA-N 2 0 220.360 2.346 20 0 BEADRP Cc1cccc(C[NH2+][C@@H]2C[C@@H]([NH3+])C23CCC3)c1 ZINC000405256274 971220575 /nfs/dbraw/zinc/22/05/75/971220575.db2.gz MLIMGADDYRHEQO-ZIAGYGMSSA-N 2 0 230.355 2.355 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]CC2=CCCCC2)C12CCC2 ZINC000405257362 971221000 /nfs/dbraw/zinc/22/10/00/971221000.db2.gz LKAUNZBIGAYWRC-OLZOCXBDSA-N 2 0 220.360 2.346 20 0 BEADRP C[C@H](CC(F)(F)F)[NH2+][C@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405272489 971225805 /nfs/dbraw/zinc/22/58/05/971225805.db2.gz SPYFWCCDKKZEQG-HLTSFMKQSA-N 2 0 236.281 2.187 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]CCc2cccs2)C12CCC2 ZINC000405261657 971227704 /nfs/dbraw/zinc/22/77/04/971227704.db2.gz NLNSWSUMSVFBSK-NEPJUHHUSA-N 2 0 236.384 2.150 20 0 BEADRP C[C@]1(C[NH2+][C@H]2C[C@@H]([NH3+])C23CCC3)CCCS1 ZINC000405275585 971227876 /nfs/dbraw/zinc/22/78/76/971227876.db2.gz WVQBTLJLHDZGDQ-GRYCIOLGSA-N 2 0 240.416 2.132 20 0 BEADRP Cc1ccccc1C[NH2+][C@H]1C[C@H]([NH3+])C12CCC2 ZINC000405269579 971228358 /nfs/dbraw/zinc/22/83/58/971228358.db2.gz TZIJZUCUMQTCPS-KBPBESRZSA-N 2 0 230.355 2.355 20 0 BEADRP CC1(C)[C@H]([NH3+])C[C@@H]1[NH2+]CCc1cccc(F)c1 ZINC000405309455 971232828 /nfs/dbraw/zinc/23/28/28/971232828.db2.gz ZWHKSYUPRFXVPF-OLZOCXBDSA-N 2 0 236.334 2.084 20 0 BEADRP CCCCOCCC[NH2+][C@H]1C[C@H]([NH3+])C12CCC2 ZINC000405343267 971235102 /nfs/dbraw/zinc/23/51/02/971235102.db2.gz JKIQSLKVWSOCFZ-STQMWFEESA-N 2 0 240.391 2.053 20 0 BEADRP CCCC(CCC)[N@H+](C)C[C@H](C)C[NH3+] ZINC001257334078 971240455 /nfs/dbraw/zinc/24/04/55/971240455.db2.gz ZWQMHXMJTNFLLC-LLVKDONJSA-N 2 0 200.370 2.482 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+]CC2CCCCC2)C12CCC2 ZINC000405360462 971243504 /nfs/dbraw/zinc/24/35/04/971243504.db2.gz TYTIETDVRBAPEK-QWHCGFSZSA-N 2 0 222.376 2.426 20 0 BEADRP Cc1csc(C[NH2+][C@H]2C[C@@H]([NH3+])C23CCC3)c1 ZINC000405378817 971246276 /nfs/dbraw/zinc/24/62/76/971246276.db2.gz CGJVRXBLSQMYDT-NEPJUHHUSA-N 2 0 236.384 2.416 20 0 BEADRP CC(C)C1(C[NH2+][C@@H]2C[C@H]([NH3+])C23CCC3)CC1 ZINC000405372911 971248408 /nfs/dbraw/zinc/24/84/08/971248408.db2.gz ZODRFVUZCXMXAF-NWDGAFQWSA-N 2 0 222.376 2.282 20 0 BEADRP C([NH2+]C1CCCC1)C12CC[NH+](CC1)CC2 ZINC001257345301 971254829 /nfs/dbraw/zinc/25/48/29/971254829.db2.gz NYABXQAZMOKPPQ-UHFFFAOYSA-N 2 0 208.349 2.005 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@H]2C[C@@H]([NH3+])C23CCC3)C1 ZINC000405443658 971255445 /nfs/dbraw/zinc/25/54/45/971255445.db2.gz FFOPFBZZUUYUDF-KXNHARMFSA-N 2 0 208.349 2.035 20 0 BEADRP CCCCCC[NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405466713 971258905 /nfs/dbraw/zinc/25/89/05/971258905.db2.gz JZRVLCIALRDEJG-VXGBXAGGSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@H]([NH3+])C12CCC2)C1CCC1 ZINC000405469383 971258939 /nfs/dbraw/zinc/25/89/39/971258939.db2.gz KOBPGWDZWBLXCE-ZMLRMANQSA-N 2 0 208.349 2.035 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+]CC2CCCC2)C12CCC2 ZINC000405473275 971259085 /nfs/dbraw/zinc/25/90/85/971259085.db2.gz LHIMNMDBGKJRCA-NWDGAFQWSA-N 2 0 208.349 2.036 20 0 BEADRP CC(C)(CC[N@@H+]1CC[C@@H](CC[NH3+])C1)C1CC1 ZINC000406016430 971323276 /nfs/dbraw/zinc/32/32/76/971323276.db2.gz WQZCHJIVHCUKEF-GFCCVEGCSA-N 2 0 224.392 2.483 20 0 BEADRP c1cc2c(cc[nH+]c2NCC[C@H]2CCC[NH2+]2)[nH]1 ZINC001158628345 971358664 /nfs/dbraw/zinc/35/86/64/971358664.db2.gz GAJJTMMJAOLOLA-SNVBAGLBSA-N 2 0 230.315 2.117 20 0 BEADRP CC(C)[N@@H+]1CCC[C@@H](OCCCC[NH+](C)C)C1 ZINC001224991615 974123871 /nfs/dbraw/zinc/12/38/71/974123871.db2.gz XIBNKMZKUBVVLM-CQSZACIVSA-N 2 0 242.407 2.218 20 0 BEADRP CCCCC[C@H](C)[N@H+](C)C[C@@H](C)C[NH3+] ZINC001257504664 971421750 /nfs/dbraw/zinc/42/17/50/971421750.db2.gz YZSIGWYNHNHMCI-RYUDHWBXSA-N 2 0 200.370 2.482 20 0 BEADRP CC[NH+](CC)C[C@@H](C)OCCCC[NH+](C)C ZINC001224992878 974122189 /nfs/dbraw/zinc/12/21/89/974122189.db2.gz VBYQTEXFEAXKOG-CYBMUJFWSA-N 2 0 230.396 2.075 20 0 BEADRP C[C@H]1C[C@H]([NH+]2CC3(C2)CC[NH2+]C3)CC(C)(C)C1 ZINC000724057022 971438559 /nfs/dbraw/zinc/43/85/59/971438559.db2.gz OLHOREFDXVWTPD-STQMWFEESA-N 2 0 236.403 2.497 20 0 BEADRP C[NH+](C)CCCCC[NH2+][C@H]1CCCSC1 ZINC001257657375 971458849 /nfs/dbraw/zinc/45/88/49/971458849.db2.gz DABIWWQXCGUERQ-LBPRGKRZSA-N 2 0 230.421 2.204 20 0 BEADRP C[NH+](C)[C@H]1CC[C@@H]([NH2+][C@H]2CCCSC2)CC1 ZINC001257669045 971473268 /nfs/dbraw/zinc/47/32/68/971473268.db2.gz XCGXEGGVMVMTAD-RWMBFGLXSA-N 2 0 242.432 2.344 20 0 BEADRP CC1(C)C[C@H](OCCCCCCC[NH3+])CC[NH2+]1 ZINC001217938594 971539093 /nfs/dbraw/zinc/53/90/93/971539093.db2.gz QDSHJLGIWUKVDD-CYBMUJFWSA-N 2 0 242.407 2.443 20 0 BEADRP CC(C)C[NH+]1CCC([NH2+]CCn2cccc2)CC1 ZINC001258002264 971553520 /nfs/dbraw/zinc/55/35/20/971553520.db2.gz GJSNRVBQBHTYPJ-UHFFFAOYSA-N 2 0 249.402 2.198 20 0 BEADRP CC(C)C[NH+]1CCC([N@@H+]2CC[C@@H](C)C2)CC1 ZINC001258013814 971550497 /nfs/dbraw/zinc/55/04/97/971550497.db2.gz XQLNMGDSLGYVQQ-CYBMUJFWSA-N 2 0 224.392 2.449 20 0 BEADRP CC(C)C[NH+]1CCC([N@@H+]2CC[C@H]2C)CC1 ZINC001258012770 971552151 /nfs/dbraw/zinc/55/21/51/971552151.db2.gz GLSHYZCOUZFFDF-GFCCVEGCSA-N 2 0 210.365 2.201 20 0 BEADRP C[C@H]([NH3+])c1ccc(O[C@@H]2C[NH2+]CC[C@H]2C)cc1 ZINC001218044501 971586518 /nfs/dbraw/zinc/58/65/18/971586518.db2.gz BVXZVIVYQILJEX-UHIISALHSA-N 2 0 234.343 2.083 20 0 BEADRP [NH3+]Cc1cccc(O[C@H]2CCC23CC[NH2+]CC3)c1 ZINC001218079496 971597232 /nfs/dbraw/zinc/59/72/32/971597232.db2.gz HGEPVUVWZLTIGO-AWEZNQCLSA-N 2 0 246.354 2.056 20 0 BEADRP [NH3+]Cc1ccc(O[C@@H]2CCC[C@]23CC[NH2+]C3)cc1 ZINC001218091185 971597887 /nfs/dbraw/zinc/59/78/87/971597887.db2.gz DEUVBESRKXPDDQ-HUUCEWRRSA-N 2 0 246.354 2.056 20 0 BEADRP [NH3+]Cc1ccc(O[C@@H]2CCC[C@@]23CC[NH2+]C3)cc1 ZINC001218091183 971599124 /nfs/dbraw/zinc/59/91/24/971599124.db2.gz DEUVBESRKXPDDQ-CABCVRRESA-N 2 0 246.354 2.056 20 0 BEADRP C[N@@H+]1CCC[C@@H](Oc2cccc(C[NH3+])c2)CC1 ZINC001218211956 971630359 /nfs/dbraw/zinc/63/03/59/971630359.db2.gz NXZKIKOXWULAJD-CYBMUJFWSA-N 2 0 234.343 2.008 20 0 BEADRP Cc1ncn([C@H]2C[C@@H]3[C@H](C2)C3(C)C)c1CC[NH3+] ZINC001170715040 971632742 /nfs/dbraw/zinc/63/27/42/971632742.db2.gz DTTRIISHQQBBLT-ZSBIGDGJSA-N 2 0 233.359 2.300 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH2+][C@H]2C[C@@H]3[C@H](C2)C3(C)C)CC1 ZINC001170721688 971642276 /nfs/dbraw/zinc/64/22/76/971642276.db2.gz YLAOSUQMMSKZBK-FQUUOJAGSA-N 2 0 236.403 2.495 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH2+][C@@H]2C[C@@H]3[C@H](C2)C3(C)C)CC1 ZINC001170721693 971646671 /nfs/dbraw/zinc/64/66/71/971646671.db2.gz YLAOSUQMMSKZBK-XDQVBPFNSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@@H]1CCC[N@H+](C[C@@]2(C)CCC[NH2+]C2)CC1 ZINC000216861623 971678318 /nfs/dbraw/zinc/67/83/18/971678318.db2.gz VXOJCELMRUMVMI-KGLIPLIRSA-N 2 0 224.392 2.498 20 0 BEADRP C[NH+]1CCC2(C[NH+]([C@H]3C[C@@H]4[C@H](C3)C4(C)C)C2)CC1 ZINC001170764742 971753808 /nfs/dbraw/zinc/75/38/08/971753808.db2.gz MBMNZKAEJRRLGE-BTTYYORXSA-N 2 0 248.414 2.449 20 0 BEADRP CC[N@@H+]1CCC[C@@H](C[NH2+][C@H]2CCC2(C)C)C1 ZINC000309681686 971759691 /nfs/dbraw/zinc/75/96/91/971759691.db2.gz ZPYFOHOAOZKXCT-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP CC[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCC2(C)C)C1 ZINC000309681682 971760502 /nfs/dbraw/zinc/76/05/02/971760502.db2.gz ZPYFOHOAOZKXCT-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CC[C@@H](Oc2ccc([C@@H]3C[C@H]3[NH3+])cc2)C[NH2+]1 ZINC001218410417 971782208 /nfs/dbraw/zinc/78/22/08/971782208.db2.gz ZTSGULMYQFCCTR-QPKOPYBWSA-N 2 0 246.354 2.021 20 0 BEADRP CC[NH+](CC)CCCC[NH2+][C@H]1CCCOCC1 ZINC001170774887 971797796 /nfs/dbraw/zinc/79/77/96/971797796.db2.gz FKLZBNRESKSNFD-AWEZNQCLSA-N 2 0 242.407 2.267 20 0 BEADRP CC1(C)C[C@H]([NH2+]C2CCC(CC[NH3+])CC2)CO1 ZINC001172278615 974491037 /nfs/dbraw/zinc/49/10/37/974491037.db2.gz JBHBVYPYRSQEPI-BPCQOVAHSA-N 2 0 240.391 2.051 20 0 BEADRP CC/C=C/[NH2+]C1CC[NH+](CCCOC)CC1 ZINC001172246254 974508571 /nfs/dbraw/zinc/50/85/71/974508571.db2.gz IEXKWWQMJKSNJA-XBXARRHUSA-N 2 0 226.364 2.001 20 0 BEADRP [NH3+]CC1(F)CC[NH+](CCCC(F)(F)F)CC1 ZINC001222526471 972538870 /nfs/dbraw/zinc/53/88/70/972538870.db2.gz BLAIOOFCVKOOGT-UHFFFAOYSA-N 2 0 242.260 2.092 20 0 BEADRP CC(C)CCC[NH+]1CCC(F)(C[NH3+])CC1 ZINC001222527712 972541352 /nfs/dbraw/zinc/54/13/52/972541352.db2.gz PSGKUXVTHMLKKA-UHFFFAOYSA-N 2 0 216.344 2.185 20 0 BEADRP CC[C@@H](C)OCC[C@@H](C)[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC001172321404 974531644 /nfs/dbraw/zinc/53/16/44/974531644.db2.gz KGOQARZDIXJMSC-YIYPIFLZSA-N 2 0 242.407 2.440 20 0 BEADRP CC[C@H](C)OCC[C@@H](C)[N@H+](C)C[C@@H](C)C[NH3+] ZINC001172326034 974535121 /nfs/dbraw/zinc/53/51/21/974535121.db2.gz ABXKNBXOUHCQKK-XQQFMLRXSA-N 2 0 230.396 2.107 20 0 BEADRP C[C@@H]([NH3+])CCNc1ccc([C@H]2CCC[NH2+]2)cc1 ZINC001170890871 972042859 /nfs/dbraw/zinc/04/28/59/972042859.db2.gz JGHXTPJZOWROAG-BXUZGUMPSA-N 2 0 233.359 2.260 20 0 BEADRP CC(C)(C)c1ccc(N[C@@H]([NH3+])CCC[NH3+])cc1 ZINC001170900230 972063135 /nfs/dbraw/zinc/06/31/35/972063135.db2.gz QPGIFXDJYSLVQW-CYBMUJFWSA-N 2 0 235.375 2.420 20 0 BEADRP Cc1cc(C)c(N[C@@H]([NH3+])CCC[NH3+])c(C)c1 ZINC001170900543 972066280 /nfs/dbraw/zinc/06/62/80/972066280.db2.gz VSSQZGYVPAXMFC-GFCCVEGCSA-N 2 0 221.348 2.047 20 0 BEADRP CCOC1CCC([NH2+][C@@H]2CCCC[NH2+]C2)CC1 ZINC001246089502 972142446 /nfs/dbraw/zinc/14/24/46/972142446.db2.gz FNQXMIVYMGLORE-ROKHWSDSSA-N 2 0 240.391 2.066 20 0 BEADRP C[C@@H]1[NH2+]CCC[C@H]1C[NH2+]C1Cc2ccccc2C1 ZINC001246113151 972178117 /nfs/dbraw/zinc/17/81/17/972178117.db2.gz SJDUWSQLUOEJSM-WFASDCNBSA-N 2 0 244.382 2.132 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+][C@@H]1CCc2cccc(F)c2C1 ZINC001170978395 972198756 /nfs/dbraw/zinc/19/87/56/972198756.db2.gz VTTJQJKLTWMSEE-BYCMXARLSA-N 2 0 248.345 2.152 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+][C@H]1CCc2cccc(F)c2C1 ZINC001170978396 972199026 /nfs/dbraw/zinc/19/90/26/972199026.db2.gz VTTJQJKLTWMSEE-TUKIKUTGSA-N 2 0 248.345 2.152 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCNc3ccccc32)CC[NH2+]1 ZINC001246228761 972234258 /nfs/dbraw/zinc/23/42/58/972234258.db2.gz JFBOHFMJROZWTK-TYNCELHUSA-N 2 0 245.370 2.273 20 0 BEADRP CS[C@H](C)CC[N@H+](C)CC1CC[NH+](C)CC1 ZINC001208141238 957015598 /nfs/dbraw/zinc/01/55/98/957015598.db2.gz JSPYFSKWSDDVMJ-GFCCVEGCSA-N 2 0 244.448 2.402 20 0 BEADRP CC1CC[NH+](C[C@@H]2CCC[N@H+](C)C2)CC1 ZINC001208603583 957095576 /nfs/dbraw/zinc/09/55/76/957095576.db2.gz FCWFVFFKVRVEKZ-CYBMUJFWSA-N 2 0 210.365 2.060 20 0 BEADRP C[NH+](C)C[C@@]12C[C@@H]1C[N@H+](CCC1CCCC1)C2 ZINC001208696795 957133483 /nfs/dbraw/zinc/13/34/83/957133483.db2.gz ZCTGUHGRZHCIRK-HUUCEWRRSA-N 2 0 236.403 2.450 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@H]1CSc2ccccc2C1 ZINC001246306976 972268752 /nfs/dbraw/zinc/26/87/52/972268752.db2.gz UQHQWEBYGVZPJY-CMPLNLGQSA-N 2 0 236.384 2.030 20 0 BEADRP C[N@@H+]1CC[C@H](Nc2ccc([C@@H]3CCC[NH2+]3)cc2)C1 ZINC001167278819 957627505 /nfs/dbraw/zinc/62/75/05/957627505.db2.gz TYMGJEJLHYVWRC-GJZGRUSLSA-N 2 0 245.370 2.227 20 0 BEADRP CO[C@H](C[N@@H+]1CC[C@@H](CC[NH3+])C1)c1ccccc1 ZINC000386019273 957777800 /nfs/dbraw/zinc/77/78/00/957777800.db2.gz WRTCWLMSDQTGSF-UKRRQHHQSA-N 2 0 248.370 2.045 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]Cc2ccc3ncoc3c2)CC[NH2+]1 ZINC001246335594 972295177 /nfs/dbraw/zinc/29/51/77/972295177.db2.gz ZPTCXCWDNHTPGS-ZYHUDNBSSA-N 2 0 245.326 2.058 20 0 BEADRP C[C@H]1C[C@H]([NH2+]C2CC3(C2)CC(F)(F)C3)CC[NH2+]1 ZINC001246336307 972298091 /nfs/dbraw/zinc/29/80/91/972298091.db2.gz UNWIFSUPZWPXDQ-VHSXEESVSA-N 2 0 244.329 2.294 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@@]23C[C@@H]2CCCC3)CC1 ZINC000693210958 957924677 /nfs/dbraw/zinc/92/46/77/957924677.db2.gz IAYFRWRQBOKXAB-KBPBESRZSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC2CC(C)(C)C2)CC[NH2+]1 ZINC000706561391 958004821 /nfs/dbraw/zinc/00/48/21/958004821.db2.gz XKYUWMNLRVZWJV-ZYHUDNBSSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CC2CC(C)(C)C2)CC[NH2+]1 ZINC000706561388 958005058 /nfs/dbraw/zinc/00/50/58/958005058.db2.gz XKYUWMNLRVZWJV-CMPLNLGQSA-N 2 0 210.365 2.153 20 0 BEADRP CCc1ccc(C[C@@H](C)[NH2+][C@H]2CC23C[NH2+]C3)cc1 ZINC001246443971 972316468 /nfs/dbraw/zinc/31/64/68/972316468.db2.gz IWHVKVCLKTWVFH-DOMZBBRYSA-N 2 0 244.382 2.132 20 0 BEADRP CCCC[C@@H](CC)[NH2+]CCC[NH2+]CCCC[NH3+] ZINC001246458799 972327015 /nfs/dbraw/zinc/32/70/15/972327015.db2.gz VZKQGRMOPJMKGH-CQSZACIVSA-N 3 0 243.439 2.263 20 0 BEADRP CC[N@H+](CCCCCCC[NH3+])[C@@H]1CCCOC1 ZINC000402762869 958328121 /nfs/dbraw/zinc/32/81/21/958328121.db2.gz FUCBZENYLXCBKM-CQSZACIVSA-N 2 0 242.407 2.397 20 0 BEADRP C[C@H](Cc1ccco1)[NH2+]C[C@@H]1C[NH2+]C[C@@H](C)C1 ZINC000398805633 958395403 /nfs/dbraw/zinc/39/54/03/958395403.db2.gz PHFDSOQEVYHZHT-XQQFMLRXSA-N 2 0 236.359 2.046 20 0 BEADRP CC1(C)CC[C@@H]([NH2+]C[C@@H]2CC[NH2+]C[C@@H]2F)C1 ZINC001246474662 972346697 /nfs/dbraw/zinc/34/66/97/972346697.db2.gz ADDXWHNLKBLHLN-TUAOUCFPSA-N 2 0 228.355 2.102 20 0 BEADRP [NH3+][C@@H]1CCCC[C@@H]1[NH2+]C1Cc2ccccc2C1 ZINC001246479271 972349743 /nfs/dbraw/zinc/34/97/43/972349743.db2.gz SSNFXGJWGWPFHT-CABCVRRESA-N 2 0 230.355 2.013 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[N@@H+]2CCCc3ccccc3C2)C1 ZINC000693545051 958757546 /nfs/dbraw/zinc/75/75/46/958757546.db2.gz IAUGNDCQZGXYTB-JNSHFYNHSA-N 2 0 230.355 2.172 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)S2 ZINC000403654064 958764464 /nfs/dbraw/zinc/76/44/64/958764464.db2.gz IBOYQVIKHLSNLX-ZZIFITQXSA-N 2 0 240.416 2.130 20 0 BEADRP C([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)[C@]12C[C@H]1CCC2 ZINC000693570443 958865297 /nfs/dbraw/zinc/86/52/97/958865297.db2.gz ZKNWNGZWAJZENO-AHDPXTMNSA-N 2 0 234.387 2.154 20 0 BEADRP C([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)[C@]12C[C@H]1CCC2 ZINC000693570704 958865671 /nfs/dbraw/zinc/86/56/71/958865671.db2.gz ZKNWNGZWAJZENO-KHMAMNHCSA-N 2 0 234.387 2.154 20 0 BEADRP CC1(C)C[C@@H]1C[NH2+][C@@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C ZINC000693677372 959188942 /nfs/dbraw/zinc/18/89/42/959188942.db2.gz JVOFGJKDQYGHSY-FVCCEPFGSA-N 2 0 236.403 2.399 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2)c1cccnc1 ZINC000405254072 959424496 /nfs/dbraw/zinc/42/44/96/959424496.db2.gz LJTYEXWMQXWGAV-CYZMBNFOSA-N 2 0 231.343 2.002 20 0 BEADRP CCC[C@H](C)C[N@@H+]1CCCC[C@@H](C[NH3+])C1 ZINC000308799153 959504056 /nfs/dbraw/zinc/50/40/56/959504056.db2.gz DFKZPGBYUUELOQ-STQMWFEESA-N 2 0 212.381 2.483 20 0 BEADRP [NH3+]CCCCCCCO[C@@H]1CCC[NH2+]C[C@@H]1F ZINC001217766058 959579232 /nfs/dbraw/zinc/57/92/32/959579232.db2.gz PVLZQSUECCYDKC-QWHCGFSZSA-N 2 0 246.370 2.002 20 0 BEADRP Cc1ccc(C[N@H+](C)C[C@H]2C[C@@H]([NH3+])C2)s1 ZINC000693967026 959622797 /nfs/dbraw/zinc/62/27/97/959622797.db2.gz VQDUADCOLRZCCL-PHIMTYICSA-N 2 0 224.373 2.226 20 0 BEADRP [NH3+][C@@H]1C[C@H]1c1ccc(O[C@H]2CCCC[NH2+]C2)cc1 ZINC001217974737 959809574 /nfs/dbraw/zinc/80/95/74/959809574.db2.gz KKEQGCRUZXMXDW-SOUVJXGZSA-N 2 0 246.354 2.022 20 0 BEADRP Cc1cc(C[N@H+]2C[C@H](C)[C@H](C[NH3+])C2)cc(C)c1O ZINC000708829836 959860420 /nfs/dbraw/zinc/86/04/20/959860420.db2.gz IBAAEDNNGRIPLB-GXTWGEPZSA-N 2 0 248.370 2.036 20 0 BEADRP C[C@H]1C[N@@H+]([C@H]2C[C@H](C)C[C@H](C)C2)C[C@H]1C[NH3+] ZINC000708873246 959996721 /nfs/dbraw/zinc/99/67/21/959996721.db2.gz YCTKIPWPYCQRNU-MEBFFEOJSA-N 2 0 224.392 2.338 20 0 BEADRP C[C@@H]1CCC[N@H+](CCNc2cc[nH+]cc2)C1 ZINC000309803130 960129708 /nfs/dbraw/zinc/12/97/08/960129708.db2.gz ROBHYPTUJPTMTE-GFCCVEGCSA-N 2 0 219.332 2.225 20 0 BEADRP C[NH+]1CCC(C[NH2+]CCCOC(C)(C)C)CC1 ZINC000695278951 960180997 /nfs/dbraw/zinc/18/09/97/960180997.db2.gz GGKSMHKNHJHFBG-UHFFFAOYSA-N 2 0 242.407 2.123 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)C2(Cl)CC2)C1 ZINC000695635915 960310906 /nfs/dbraw/zinc/31/09/06/960310906.db2.gz DVDWPICQYNDOAZ-NEPJUHHUSA-N 2 0 244.810 2.468 20 0 BEADRP C[C@H]([NH2+][C@H]1CCCC2(CC2)C1)[C@H]1CCC[NH2+]1 ZINC000695725397 960405424 /nfs/dbraw/zinc/40/54/24/960405424.db2.gz WWEKUBFVAFTXGF-RWMBFGLXSA-N 2 0 222.376 2.439 20 0 BEADRP C[NH+]1CCC(CC[N@@H+]2CCC[C@@H](CF)C2)CC1 ZINC001207484317 960451634 /nfs/dbraw/zinc/45/16/34/960451634.db2.gz JFGIUQOSKXRCFZ-AWEZNQCLSA-N 2 0 242.382 2.400 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+]C1CCC(F)(F)CC1 ZINC000925631932 960480790 /nfs/dbraw/zinc/48/07/90/960480790.db2.gz ZBNIRCIQIYPTGL-JTQLQIEISA-N 2 0 232.318 2.294 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+][C@H]1CCCC12CCCC2 ZINC000925781592 961129157 /nfs/dbraw/zinc/12/91/57/961129157.db2.gz AYRLHXILZCXZHN-UPJWGTAASA-N 2 0 222.376 2.297 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[N@H+](C)CCF ZINC001167835281 961209442 /nfs/dbraw/zinc/20/94/42/961209442.db2.gz QSRDMBPNSKHYFV-LBPRGKRZSA-N 2 0 218.360 2.398 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@H]2C[C@H]3C[C@H]3C2)CC1 ZINC001167892826 961497856 /nfs/dbraw/zinc/49/78/56/961497856.db2.gz BHSKBNIYFRUWPQ-IMRBUKKESA-N 2 0 222.376 2.247 20 0 BEADRP CC1CC[NH+](CCC[NH2+][C@H]2C[C@H]3C[C@H]3C2)CC1 ZINC001167895959 961518107 /nfs/dbraw/zinc/51/81/07/961518107.db2.gz XZJBGRXEOMUAQZ-FICVDOATSA-N 2 0 236.403 2.497 20 0 BEADRP CC[NH+](CC)CCCC[NH2+][C@@H]1C[C@H]2C[C@H]2C1 ZINC001167895968 961519942 /nfs/dbraw/zinc/51/99/42/961519942.db2.gz YDKNLTOIGHJTBP-BTTYYORXSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH+](C)[C@H]1CC[C@H]([NH2+][C@@H]2C[C@H]3C[C@H]3C2)CC1 ZINC001167918471 961908096 /nfs/dbraw/zinc/90/80/96/961908096.db2.gz UQMFDFXIMDBYII-DPFGLZSQSA-N 2 0 222.376 2.247 20 0 BEADRP Cc1cc(O)cc(C[N@@H+]2CCCC[C@@H](C[NH3+])C2)c1 ZINC001206632346 962120548 /nfs/dbraw/zinc/12/05/48/962120548.db2.gz JIBAJXHIDRLDOF-ZDUSSCGKSA-N 2 0 248.370 2.261 20 0 BEADRP Cc1cc(C[N@@H+]2CCCC[C@@H](C[NH3+])C2)cnc1C ZINC001206632292 962127289 /nfs/dbraw/zinc/12/72/89/962127289.db2.gz IKTSCTZTUUOJQJ-AWEZNQCLSA-N 2 0 247.386 2.259 20 0 BEADRP Cc1c(O)cccc1C[N@@H+]1CCCC[C@@H](C[NH3+])C1 ZINC001206632376 962127805 /nfs/dbraw/zinc/12/78/05/962127805.db2.gz JZEPOAXPFLAELJ-ZDUSSCGKSA-N 2 0 248.370 2.261 20 0 BEADRP C[C@@H]1CC[C@H]([NH+]2CC3(C2)CCC[NH2+]C3)C[C@H]1C ZINC000709984271 962206932 /nfs/dbraw/zinc/20/69/32/962206932.db2.gz RHKAKHHIZYEJAX-MCIONIFRSA-N 2 0 236.403 2.497 20 0 BEADRP C[N@@H+]1CCC[C@H]1CC[NH2+][C@H]1CCOC(C)(C)C1 ZINC000710384753 962374602 /nfs/dbraw/zinc/37/46/02/962374602.db2.gz MZFQKCYTDGAPSI-STQMWFEESA-N 2 0 240.391 2.018 20 0 BEADRP C[N@@H+]1CCC[C@@H]1CC[NH2+][C@@H]1CCOC(C)(C)C1 ZINC000710384745 962376342 /nfs/dbraw/zinc/37/63/42/962376342.db2.gz MZFQKCYTDGAPSI-CHWSQXEVSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CC[C@@H]2CCC[N@@H+]2C)C1 ZINC000710448744 962382231 /nfs/dbraw/zinc/38/22/31/962382231.db2.gz ZTNXAKBDJYQRAY-AGIUHOORSA-N 2 0 210.365 2.249 20 0 BEADRP C1C[C@H]2CC([NH+]3C[C@@H]4CCCC[C@H]4C3)C[C@@H]1[NH2+]2 ZINC000710749516 962458795 /nfs/dbraw/zinc/45/87/95/962458795.db2.gz RRUCPMGSFQACKQ-JZAZDWQXSA-N 2 0 234.387 2.391 20 0 BEADRP CCC[N@H+](CCC[NH+](C)C)[C@H]1C[C@H]2C[C@H]2C1 ZINC001167948472 962592660 /nfs/dbraw/zinc/59/26/60/962592660.db2.gz NFNHFWGWFNJEAB-WDNDVIMCSA-N 2 0 224.392 2.449 20 0 BEADRP C[C@@H]1C[C@@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167959900 962843347 /nfs/dbraw/zinc/84/33/47/962843347.db2.gz UMYZOAQTMHNCJC-MYLLAERPSA-N 2 0 234.387 2.390 20 0 BEADRP Cc1c[nH+]c(N[C@@H]2CCC[C@H]([NH3+])C2)cc1C ZINC001154987725 962932149 /nfs/dbraw/zinc/93/21/49/962932149.db2.gz NBSALJLBFSGDHO-NWDGAFQWSA-N 2 0 219.332 2.380 20 0 BEADRP Cc1c[nH+]c(NC[C@H]2C[NH2+][C@H](C)C2)c(C)c1 ZINC001155101071 962975241 /nfs/dbraw/zinc/97/52/41/962975241.db2.gz ILHCMWJBCJIGGQ-VXGBXAGGSA-N 2 0 219.332 2.108 20 0 BEADRP Cc1c[nH+]c(NC[C@H]2C[NH2+][C@H](C)C2)cc1C ZINC001155102121 962978202 /nfs/dbraw/zinc/97/82/02/962978202.db2.gz NTSYKQRZEROAOY-VXGBXAGGSA-N 2 0 219.332 2.108 20 0 BEADRP Cc1cc(C)[nH+]c(N[C@H]2CC[C@@H]3C[NH2+]C[C@@H]32)c1 ZINC001155583304 963117583 /nfs/dbraw/zinc/11/75/83/963117583.db2.gz KQRZBBARMSSPNQ-AGIUHOORSA-N 2 0 231.343 2.108 20 0 BEADRP Cc1ccc(N[C@H]2C[NH+]3CCC2CC3)nc1C ZINC001155662835 963147001 /nfs/dbraw/zinc/14/70/01/963147001.db2.gz PEIUXINDNGCVAL-ZDUSSCGKSA-N 2 0 231.343 2.205 20 0 BEADRP Cc1cc2[nH]ccc2c(N(CCC[NH3+])C(C)C)[nH+]1 ZINC001156118066 963257752 /nfs/dbraw/zinc/25/77/52/963257752.db2.gz PWQXDHCBDIVOOF-UHFFFAOYSA-N 2 0 246.358 2.435 20 0 BEADRP COC[C@H]1CCCC[N@H+](CCCCCC[NH3+])C1 ZINC000696642586 963332084 /nfs/dbraw/zinc/33/20/84/963332084.db2.gz BFXHRVNMBKBNPU-AWEZNQCLSA-N 2 0 242.407 2.254 20 0 BEADRP Cc1ccc(NC2(C)CC[NH2+]CC2)[nH+]c1C ZINC001157401825 963597744 /nfs/dbraw/zinc/59/77/44/963597744.db2.gz UBKOCEQRHJVDGT-UHFFFAOYSA-N 2 0 219.332 2.252 20 0 BEADRP CCCC[N@H+](C)CCC[NH2+][C@H]1CCO[C@H](C)C1 ZINC001168075750 963614880 /nfs/dbraw/zinc/61/48/80/963614880.db2.gz QNFXQWAFPUFXMK-KGLIPLIRSA-N 2 0 242.407 2.266 20 0 BEADRP CC(C)[C@H](C)[N@H+](C)C[C@H]1CCCC[NH2+]C1 ZINC000697038393 963665045 /nfs/dbraw/zinc/66/50/45/963665045.db2.gz CJHIPYOXYNVMFA-STQMWFEESA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C2CCC(CC[NH3+])CC2)CCO1 ZINC001168090325 963681816 /nfs/dbraw/zinc/68/18/16/963681816.db2.gz CESITGIGXQWSGE-BLYZHGLHSA-N 2 0 240.391 2.051 20 0 BEADRP C[NH2+]CC[C@H](C)[NH2+]C[C@H]1CCCC[C@@H]1C ZINC000714413448 963691091 /nfs/dbraw/zinc/69/10/91/963691091.db2.gz QRZAFQBJYAAXBO-RWMBFGLXSA-N 2 0 212.381 2.400 20 0 BEADRP [NH3+]C[C@]1(F)CCN(c2nccc3ccccc32)C1 ZINC001157808414 963729908 /nfs/dbraw/zinc/72/99/08/963729908.db2.gz GGDSFAGRUJLGCJ-CQSZACIVSA-N 2 0 245.301 2.112 20 0 BEADRP CCN(c1cc2[nH]ccc2c[nH+]1)[C@@H]1CCC[NH2+]C1 ZINC001158201079 963831240 /nfs/dbraw/zinc/83/12/40/963831240.db2.gz SRXOSSOLHXEAEL-GFCCVEGCSA-N 2 0 244.342 2.141 20 0 BEADRP COc1cc(NC=CC2CC[NH2+]CC2)[nH+]cc1C ZINC001159416292 964079159 /nfs/dbraw/zinc/07/91/59/964079159.db2.gz RKPIKUIVVOHFFQ-VMPITWQZSA-N 2 0 247.342 2.324 20 0 BEADRP C1=C(Nc2ccc(C3CC[NH2+]CC3)cc2)C[NH2+]C1 ZINC001159598045 964129809 /nfs/dbraw/zinc/12/98/09/964129809.db2.gz DGUPHACEDSFUTK-UHFFFAOYSA-N 2 0 243.354 2.053 20 0 BEADRP Cc1cc(Nc2cccc3c2C[NH2+]C3)cc(C)[nH+]1 ZINC001159766534 964188119 /nfs/dbraw/zinc/18/81/19/964188119.db2.gz AKOSZVIVHOGCQK-UHFFFAOYSA-N 2 0 239.322 2.467 20 0 BEADRP CC[NH2+]Cc1cccc(NC2=CCC[NH2+]CC2)c1 ZINC001159956968 964234434 /nfs/dbraw/zinc/23/44/34/964234434.db2.gz ZJLRMMFAJJISQW-UHFFFAOYSA-N 2 0 245.370 2.475 20 0 BEADRP c1cc2c(cc[nH+]c2NC[C@H]2CCCC[NH2+]2)[nH]1 ZINC001160146024 964259749 /nfs/dbraw/zinc/25/97/49/964259749.db2.gz YIEYCAFXGBNYHI-SNVBAGLBSA-N 2 0 230.315 2.117 20 0 BEADRP C[NH+](C)C1CCC([NH2+]C[C@H]2CC(C)(C)O2)CC1 ZINC001168298428 964386045 /nfs/dbraw/zinc/38/60/45/964386045.db2.gz SOMSDECMVRFCNJ-WXRRBKDZSA-N 2 0 240.391 2.016 20 0 BEADRP CC(C)[NH+]1CC(Nc2cc[nH+]c3c2ccn3C)C1 ZINC001168317427 964432896 /nfs/dbraw/zinc/43/28/96/964432896.db2.gz KYNMMBWUZSTBMF-UHFFFAOYSA-N 2 0 244.342 2.078 20 0 BEADRP Cc1c[nH+]c(NCc2ccccc2C[NH3+])c(N)c1 ZINC001160907074 964440645 /nfs/dbraw/zinc/44/06/45/964440645.db2.gz JAPQCYIIFJMSBC-UHFFFAOYSA-N 2 0 242.326 2.043 20 0 BEADRP CC(C)(C)[C@H](C[NH3+])Nc1cc2[nH]ccc2c[nH+]1 ZINC001160911697 964442064 /nfs/dbraw/zinc/44/20/64/964442064.db2.gz AYNNDJMOTMRNNN-NSHDSACASA-N 2 0 232.331 2.348 20 0 BEADRP C[NH+](C)C1CCC([N@@H+]2C[C@@H]3C[C@H]2C[C@@H]3F)CC1 ZINC001168327976 964460079 /nfs/dbraw/zinc/46/00/79/964460079.db2.gz VXAYUSZDJCJXLZ-ASUPZPJHSA-N 2 0 240.366 2.292 20 0 BEADRP CC(C)[C@@H]1C[C@@H]([NH2+]CC[C@H](C)[NH+](C)C)CCO1 ZINC000697824945 964548562 /nfs/dbraw/zinc/54/85/62/964548562.db2.gz DKGLEQFJOPLZNX-IHRRRGAJSA-N 2 0 242.407 2.120 20 0 BEADRP CCCC[C@H](C)[NH2+]CC[C@H](C)[NH+](C)C ZINC000697868675 964593933 /nfs/dbraw/zinc/59/39/33/964593933.db2.gz CKOTXFUXPXHAKE-RYUDHWBXSA-N 2 0 200.370 2.495 20 0 BEADRP CCC[C@@H](C)C[NH2+]CC[C@@H](C)[NH+](C)C ZINC000697871976 964599480 /nfs/dbraw/zinc/59/94/80/964599480.db2.gz QGNXHFGYLYAAOF-VXGBXAGGSA-N 2 0 200.370 2.352 20 0 BEADRP C[NH+](C)CCNc1cc[nH+]c(N2CCCCC2)c1 ZINC001161668845 964673131 /nfs/dbraw/zinc/67/31/31/964673131.db2.gz RLURGLYDCMTONI-UHFFFAOYSA-N 2 0 248.374 2.045 20 0 BEADRP C[NH+](C)CCNc1ccc([C@@H]2CCC[NH2+]2)cc1 ZINC001161669098 964678370 /nfs/dbraw/zinc/67/83/70/964678370.db2.gz YNXYMISGWLGSGK-AWEZNQCLSA-N 2 0 233.359 2.085 20 0 BEADRP C(C1CC1)[NH+]1CCC([NH2+][C@@H]2CC23CCC3)CC1 ZINC001168365486 964714743 /nfs/dbraw/zinc/71/47/43/964714743.db2.gz SJSDYAFARRLZNC-CQSZACIVSA-N 2 0 234.387 2.393 20 0 BEADRP CC(C)(C)[NH+]1CC(Nc2[nH+]ccc3[nH]ccc32)C1 ZINC001162220384 964880340 /nfs/dbraw/zinc/88/03/40/964880340.db2.gz QZRJSJXNOPQYSM-UHFFFAOYSA-N 2 0 244.342 2.458 20 0 BEADRP Cc1cc(N(C)C)[nH+]cc1N[C@@H]1CCC[C@@H]([NH3+])C1 ZINC001162395725 964955475 /nfs/dbraw/zinc/95/54/75/964955475.db2.gz FPZLABDDCJFFIS-VXGBXAGGSA-N 2 0 248.374 2.138 20 0 BEADRP [NH3+][C@H]1CCC[C@H](Nc2ccc(C3([NH3+])CC3)cc2)C1 ZINC001162399333 964958707 /nfs/dbraw/zinc/95/87/07/964958707.db2.gz BAXDQRDNHXDOPH-JSGCOSHPSA-N 2 0 245.370 2.316 20 0 BEADRP [NH3+][C@H]1CCC[C@H](Nc2cccn3c[nH+]cc23)C1 ZINC001162404469 964962931 /nfs/dbraw/zinc/96/29/31/964962931.db2.gz MVTXCIDELWVRIS-QWRGUYRKSA-N 2 0 230.315 2.016 20 0 BEADRP [NH3+][C@@H]1CCc2c1cccc2N[C@H]1CCC[C@@H]([NH3+])C1 ZINC001162404767 964963293 /nfs/dbraw/zinc/96/32/93/964963293.db2.gz QNAJFPMAUQWCNZ-UHIISALHSA-N 2 0 245.370 2.314 20 0 BEADRP F[C@@H]1C[NH2+][C@H](CNc2cc[nH+]c(C3CC3)c2)C1 ZINC001162481765 964996541 /nfs/dbraw/zinc/99/65/41/964996541.db2.gz WJJNDZMHEFFBMF-JQWIXIFHSA-N 2 0 235.306 2.071 20 0 BEADRP Cc1ccc(NC[C@]2(F)CCCC[NH2+]C2)nc1 ZINC001162572599 965050624 /nfs/dbraw/zinc/05/06/24/965050624.db2.gz HKBFNGPDCUADBV-ZDUSSCGKSA-N 2 0 237.322 2.284 20 0 BEADRP CC(C)(C)C(=[NH2+])Nc1cnc2c(c1)C[NH2+]CC2 ZINC001162664804 965098064 /nfs/dbraw/zinc/09/80/64/965098064.db2.gz PNEKYNBTUQXJMQ-UHFFFAOYSA-N 2 0 232.331 2.163 20 0 BEADRP C[C@@H]1CCCC[N@@H+]1CCCNc1cccc(N)[nH+]1 ZINC000168744370 965119629 /nfs/dbraw/zinc/11/96/29/965119629.db2.gz XZCYSRHYXJNSNU-GFCCVEGCSA-N 2 0 248.374 2.340 20 0 BEADRP C1=C[C@H]([NH2+][C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)CC1 ZINC000698277944 965169848 /nfs/dbraw/zinc/16/98/48/965169848.db2.gz MSEXMNOJWLCOEG-REWJHTLYSA-N 2 0 220.360 2.215 20 0 BEADRP Cc1ccc(NC[C@@H]2CC[NH2+]C[C@@H]2F)[nH+]c1C ZINC001162802904 965173803 /nfs/dbraw/zinc/17/38/03/965173803.db2.gz YXRVUUDGKYFGOL-RYUDHWBXSA-N 2 0 237.322 2.058 20 0 BEADRP C[C@@H]([NH3+])c1ccc2c(ccn2-c2c[nH+]cn2C)c1 ZINC001162910601 965205927 /nfs/dbraw/zinc/20/59/27/965205927.db2.gz VCLPYNYSCFNZFN-SNVBAGLBSA-N 2 0 240.310 2.384 20 0 BEADRP CCCC[C@@H](CC)[NH2+]CCSCC[NH3+] ZINC001257413219 1169867245 /nfs/dbraw/zinc/86/72/45/1169867245.db2.gz UQVDYDIHBIXZPQ-LLVKDONJSA-N 2 0 218.410 2.237 20 0 BEADRP CC(C)[N@@H+]1CC[C@@H](Nc2cc(N)cc[nH+]2)[C@@H](C)C1 ZINC001163356963 965362084 /nfs/dbraw/zinc/36/20/84/965362084.db2.gz HQBRJADVCVMUEN-WCQYABFASA-N 2 0 248.374 2.195 20 0 BEADRP CCN(C)c1cc(OC2CC[NH+](C)CC2)cc[nH+]1 ZINC001163583148 965464307 /nfs/dbraw/zinc/46/43/07/965464307.db2.gz NVPJSPCUEBCJAT-UHFFFAOYSA-N 2 0 249.358 2.011 20 0 BEADRP CCOc1ccc(C[N@@H+]2CCC[C@H]([NH3+])CC2)cc1 ZINC001205094680 965729282 /nfs/dbraw/zinc/72/92/82/965729282.db2.gz OACZNZFMLLKBKB-AWEZNQCLSA-N 2 0 248.370 2.399 20 0 BEADRP COc1cc(C)ccc1C[N@@H+]1CCC[C@@H]([NH3+])CC1 ZINC001205094827 965732486 /nfs/dbraw/zinc/73/24/86/965732486.db2.gz QWQHJNNUGYBZJH-CQSZACIVSA-N 2 0 248.370 2.317 20 0 BEADRP [NH3+][C@H]1CCC[N@H+](CC2Cc3ccccc3C2)CC1 ZINC001205095527 965755842 /nfs/dbraw/zinc/75/58/42/965755842.db2.gz YKTWABWPSPPGJD-INIZCTEOSA-N 2 0 244.382 2.215 20 0 BEADRP C[C@H](C[NH+](C)C)Oc1cccc2c1CC[N@H+](C)C2 ZINC001234421299 965819818 /nfs/dbraw/zinc/81/98/18/965819818.db2.gz CUVFTODSBRFXCY-GFCCVEGCSA-N 2 0 248.370 2.003 20 0 BEADRP CCCOCCC[NH2+]C1CCC([NH+](C)C)CC1 ZINC000715196961 965822032 /nfs/dbraw/zinc/82/20/32/965822032.db2.gz ARXNRZCIXONCIG-UHFFFAOYSA-N 2 0 242.407 2.266 20 0 BEADRP C([NH2+][C@]12C[C@H]1CCCC2)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000699294656 965832890 /nfs/dbraw/zinc/83/28/90/965832890.db2.gz VQMOHUQJFUBBMJ-HKJOBYGYSA-N 2 0 234.387 2.439 20 0 BEADRP C([NH2+]C1CCCC1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000699305754 965843007 /nfs/dbraw/zinc/84/30/07/965843007.db2.gz QWESQMWNBZXNJJ-VGPLMAKISA-N 2 0 208.349 2.049 20 0 BEADRP COc1ccc(C)c(C[N@@H+]2CCC[C@H]([NH3+])CC2)c1 ZINC001205124668 965898889 /nfs/dbraw/zinc/89/88/89/965898889.db2.gz XPOJWCAKZBHZIJ-AWEZNQCLSA-N 2 0 248.370 2.317 20 0 BEADRP Cc1cccc(C[NH2+][C@@H](C)C2CC[NH2+]CC2)c1 ZINC000400362679 965945258 /nfs/dbraw/zinc/94/52/58/965945258.db2.gz QNAXRLBNKVHJFA-ZDUSSCGKSA-N 2 0 232.371 2.473 20 0 BEADRP Cc1cccc(C[NH2+][C@H](C)C2CC[NH2+]CC2)c1 ZINC000400362676 965947966 /nfs/dbraw/zinc/94/79/66/965947966.db2.gz QNAXRLBNKVHJFA-CYBMUJFWSA-N 2 0 232.371 2.473 20 0 BEADRP C[C@H]([NH2+]Cc1cccc(F)c1)C1CC[NH2+]CC1 ZINC000400362715 965948145 /nfs/dbraw/zinc/94/81/45/965948145.db2.gz QNYHNMMGEARGRA-NSHDSACASA-N 2 0 236.334 2.303 20 0 BEADRP CC1=C[C@@H](C)[C@@H](C[N@H+]2C[C@H]3C[NH2+]C[C@H]3C2)CC1 ZINC001234979705 965982685 /nfs/dbraw/zinc/98/26/85/965982685.db2.gz QVNJVQMNUUYYPP-TUVASFSCSA-N 2 0 234.387 2.130 20 0 BEADRP Cc1ccc(N2CC[C@]3(C2)CCC[NH2+]C3)[nH+]c1C ZINC001165235935 966001958 /nfs/dbraw/zinc/00/19/58/966001958.db2.gz AKCLYHSNICUHBG-OAHLLOKOSA-N 2 0 245.370 2.278 20 0 BEADRP c1ncc(C[NH+]2CCC([C@H]3CCCC[NH2+]3)CC2)o1 ZINC001235230231 966033721 /nfs/dbraw/zinc/03/37/21/966033721.db2.gz TWHAKBSLCBGRIX-CQSZACIVSA-N 2 0 249.358 2.029 20 0 BEADRP CCc1cc(NCC[C@H]2CCC[N@H+](C)C2)cc[nH+]1 ZINC001165300921 966039115 /nfs/dbraw/zinc/03/91/15/966039115.db2.gz UQWJGAPUSVSKIW-CYBMUJFWSA-N 2 0 247.386 2.210 20 0 BEADRP Cc1cc(C)cc(C[N@H+]2C[C@H]3CC[C@@H](C2)[C@@H]3[NH3+])c1 ZINC001235960513 966176235 /nfs/dbraw/zinc/17/62/35/966176235.db2.gz YNBOFDNQQDWOIW-MUJYYYPQSA-N 2 0 244.382 2.473 20 0 BEADRP C[C@@H](C[NH+]1CC(C)(C[NH3+])C1)c1ccccc1 ZINC001206711037 966184784 /nfs/dbraw/zinc/18/47/84/966184784.db2.gz DHKMLZKWPXIWKI-LBPRGKRZSA-N 2 0 218.344 2.071 20 0 BEADRP CCCC[C@H](CC)C[NH+]1CC(C)(C[NH3+])C1 ZINC001206710933 966185689 /nfs/dbraw/zinc/18/56/89/966185689.db2.gz BAZGBEPIEXQKIN-LBPRGKRZSA-N 2 0 212.381 2.483 20 0 BEADRP CC(C)C[N@H+](C)Cc1ccc2c(c1)CC[NH2+]C2 ZINC001204611198 967105624 /nfs/dbraw/zinc/10/56/24/967105624.db2.gz DKRIRLDNSKUCGO-UHFFFAOYSA-N 2 0 232.371 2.420 20 0 BEADRP C[NH+](C)Cc1ccc(-c2c[nH+]ccc2N)cc1 ZINC001204631505 967110606 /nfs/dbraw/zinc/11/06/06/967110606.db2.gz CETGBDHSNZPETE-UHFFFAOYSA-N 2 0 227.311 2.223 20 0 BEADRP Cc1ccc([C@H](C)CCN2CCC[NH2+]CC2)o1 ZINC001204654895 967115664 /nfs/dbraw/zinc/11/56/64/967115664.db2.gz BPAZDJGXPWTWNS-GFCCVEGCSA-N 2 0 236.359 2.377 20 0 BEADRP CC(C)(C)c1ccc(C[NH+]2CCC(C[NH3+])CC2)[nH]1 ZINC001205033753 967295409 /nfs/dbraw/zinc/29/54/09/967295409.db2.gz QEBHVEKPCGJBGU-UHFFFAOYSA-N 2 0 249.402 2.483 20 0 BEADRP [NH3+]CC1CC[NH+](Cc2cc3ccccc3[nH]2)CC1 ZINC001205033483 967298711 /nfs/dbraw/zinc/29/87/11/967298711.db2.gz IKJFSXZMWNOBSR-UHFFFAOYSA-N 2 0 243.354 2.339 20 0 BEADRP CN(C)c1cccc(C[N@@H+]2CCC[C@@H]([NH3+])CC2)c1 ZINC001205109481 967353122 /nfs/dbraw/zinc/35/31/22/967353122.db2.gz GYHMZXWCVOAAAY-CQSZACIVSA-N 2 0 247.386 2.066 20 0 BEADRP COc1cccc(C)c1C[N@@H+]1CCC[C@@H]([NH3+])CC1 ZINC001205117753 967362990 /nfs/dbraw/zinc/36/29/90/967362990.db2.gz UISLUXXRFFBTLE-CYBMUJFWSA-N 2 0 248.370 2.317 20 0 BEADRP Cc1cc(C[N@H+]2C[C@H](C)[C@H](C[NH3+])C2)sc1C ZINC001205150482 967393602 /nfs/dbraw/zinc/39/36/02/967393602.db2.gz CXQLUESCDBBXDB-CMPLNLGQSA-N 2 0 238.400 2.392 20 0 BEADRP COc1ccccc1C[N@@H+]1CCC[C@@](C)([NH3+])CC1 ZINC001205256075 967447509 /nfs/dbraw/zinc/44/75/09/967447509.db2.gz MOAJTPZBEAMOQI-OAHLLOKOSA-N 2 0 248.370 2.399 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@@H]2C[C@H]3C=C[C@@H]2C3)C[C@H]1C[NH3+] ZINC001205297120 967496814 /nfs/dbraw/zinc/49/68/14/967496814.db2.gz ZKBTVZOWGRVMSJ-QKGCVVFFSA-N 2 0 234.387 2.115 20 0 BEADRP c1[nH+]cn2cc(CC[NH+]3CCCCC3)ccc12 ZINC001250240987 967550988 /nfs/dbraw/zinc/55/09/88/967550988.db2.gz AYJLFVHOSQAIHB-UHFFFAOYSA-N 2 0 229.327 2.363 20 0 BEADRP C[NH+](C)CCCCNc1ccc(C2([NH3+])CC2)cc1 ZINC001161730771 967619182 /nfs/dbraw/zinc/61/91/82/967619182.db2.gz GKNHHICQZOPQCC-UHFFFAOYSA-N 2 0 247.386 2.388 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCC[C@](F)(C[NH3+])CC1 ZINC001205536731 967672617 /nfs/dbraw/zinc/67/26/17/967672617.db2.gz ACXRJZMQXDUUDS-NWDGAFQWSA-N 2 0 216.344 2.185 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCC[C@@](F)(C[NH3+])CC1 ZINC001205536732 967674741 /nfs/dbraw/zinc/67/47/41/967674741.db2.gz ACXRJZMQXDUUDS-RYUDHWBXSA-N 2 0 216.344 2.185 20 0 BEADRP Nc1[nH+]c2ccccc2n1-c1ccc2c[nH+]cn2c1 ZINC001250323701 967701414 /nfs/dbraw/zinc/70/14/14/967701414.db2.gz ISTMSJZZLSZPFM-UHFFFAOYSA-N 2 0 249.277 2.255 20 0 BEADRP CCc1cc(Nc2ccc3c[nH+]cn3c2)cc[nH+]1 ZINC001250330185 967718281 /nfs/dbraw/zinc/71/82/81/967718281.db2.gz RLGBHTJAQNQTNC-UHFFFAOYSA-N 2 0 238.294 2.457 20 0 BEADRP C[C@H]1CC[N@H+](Cc2ccccc2)CC[C@@H]1C[NH3+] ZINC001205603625 967719926 /nfs/dbraw/zinc/71/99/26/967719926.db2.gz RHXGYYZFKVABAN-DZGCQCFKSA-N 2 0 232.371 2.493 20 0 BEADRP Cc1cncc(C[N@H+]2CC[C@@H](C)[C@H](C[NH3+])CC2)c1 ZINC001205617583 967723862 /nfs/dbraw/zinc/72/38/62/967723862.db2.gz LCGYTXNEGSYDRW-HIFRSBDPSA-N 2 0 247.386 2.197 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@@H](C[NH3+])[C@@H](C)CC2)cn1 ZINC001205626319 967732665 /nfs/dbraw/zinc/73/26/65/967732665.db2.gz FQTMEXMALQDEKU-WFASDCNBSA-N 2 0 247.386 2.197 20 0 BEADRP Cc1ccncc1C[N@@H+]1CC[C@@H](C[NH3+])[C@@H](C)CC1 ZINC001205625596 967735723 /nfs/dbraw/zinc/73/57/23/967735723.db2.gz BSCDQDYIYSIQFM-KBPBESRZSA-N 2 0 247.386 2.197 20 0 BEADRP CCC[N@H+](CCC[NH+](C)C)CC1CC(OC)C1 ZINC001205697022 967782640 /nfs/dbraw/zinc/78/26/40/967782640.db2.gz QZYDEDGUXTZCAB-UHFFFAOYSA-N 2 0 242.407 2.075 20 0 BEADRP CCc1ccc(C[N@@H+]2CC[C@@H](CC[NH3+])C2)s1 ZINC000700631480 967803584 /nfs/dbraw/zinc/80/35/84/967803584.db2.gz PFLUSYQIKIZTGN-LLVKDONJSA-N 2 0 238.400 2.481 20 0 BEADRP C[NH+]1CCC(C[NH2+]C[C@@H]2CCC[C@@H]3C[C@@H]32)CC1 ZINC000694689092 967923214 /nfs/dbraw/zinc/92/32/14/967923214.db2.gz FVSQZAVGTCVNFR-ILXRZTDVSA-N 2 0 236.403 2.354 20 0 BEADRP Cc1cc(C)c(C[N@@H+]2CCC[C@@H](C[NH3+])[C@@H](C)C2)[nH]1 ZINC001205991323 967938983 /nfs/dbraw/zinc/93/89/83/967938983.db2.gz ACJOBCMETNYTFQ-JSGCOSHPSA-N 2 0 249.402 2.438 20 0 BEADRP Cc1cccc(C[N@@H+]2CCC[C@H](C[NH3+])[C@@H](C)C2)n1 ZINC001205992541 967939733 /nfs/dbraw/zinc/93/97/33/967939733.db2.gz FFFFWJSCFQMICT-GXTWGEPZSA-N 2 0 247.386 2.197 20 0 BEADRP Cc1cccc2c1C[N@H+](CCCC[NH3+])C2 ZINC001206082475 968054182 /nfs/dbraw/zinc/05/41/82/968054182.db2.gz ZTKNQMNFEHRIHT-UHFFFAOYSA-N 2 0 204.317 2.050 20 0 BEADRP CC(C)C[N@H+](C)CC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000699305743 968077191 /nfs/dbraw/zinc/07/71/91/968077191.db2.gz QMXWFOWJCIMANJ-YHWZYXNKSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@@H](C[NH+](C)C)Nc1ccc([C@@H]2CCC[NH2+]2)cc1 ZINC001163776569 968112610 /nfs/dbraw/zinc/11/26/10/968112610.db2.gz DLNBXPXMOJSJDG-WFASDCNBSA-N 2 0 247.386 2.473 20 0 BEADRP C[C@H](C[NH+](C)C)Nc1ccc(C2([NH3+])CCC2)cc1 ZINC001163776552 968113818 /nfs/dbraw/zinc/11/38/18/968113818.db2.gz DDFULAVRQVCUNN-GFCCVEGCSA-N 2 0 247.386 2.387 20 0 BEADRP C[C@H]([NH3+])c1ccc(N[C@@H](C)C[NH+](C)C)cc1 ZINC001163776850 968118359 /nfs/dbraw/zinc/11/83/59/968118359.db2.gz MVMIZTPBDOHZCQ-QWRGUYRKSA-N 2 0 221.348 2.068 20 0 BEADRP CC(C)CC[N@@H+]1CCC[C@](C)(C[NH3+])CC1 ZINC001206292457 968201992 /nfs/dbraw/zinc/20/19/92/968201992.db2.gz BFJJCTVHWBDPMX-ZDUSSCGKSA-N 2 0 212.381 2.483 20 0 BEADRP Cc1ccncc1C[N@@H+]1CCC[C@@](C)(C[NH3+])CC1 ZINC001206310831 968219663 /nfs/dbraw/zinc/21/96/63/968219663.db2.gz DAHLHSCCWFBVJI-OAHLLOKOSA-N 2 0 247.386 2.341 20 0 BEADRP Cc1cccc(C[N@@H+]2CCCC[C@](C)(C[NH3+])C2)n1 ZINC001206542320 968365147 /nfs/dbraw/zinc/36/51/47/968365147.db2.gz YFTYPBRCYXAIHO-OAHLLOKOSA-N 2 0 247.386 2.341 20 0 BEADRP C[C@]1(C[NH3+])CCCC[N@H+](Cc2ccc(O)cc2)C1 ZINC001206540133 968367002 /nfs/dbraw/zinc/36/70/02/968367002.db2.gz AKRXVNURBVSSSO-OAHLLOKOSA-N 2 0 248.370 2.343 20 0 BEADRP Cc1cncc(C[N@@H+]2CCCC[C@](C)(C[NH3+])C2)c1 ZINC001206547079 968373750 /nfs/dbraw/zinc/37/37/50/968373750.db2.gz BKFSMMJOKPWQJU-OAHLLOKOSA-N 2 0 247.386 2.341 20 0 BEADRP C[C@@]1(C[NH3+])CCCC[N@H+](Cc2cccc(N)c2)C1 ZINC001206563510 968386741 /nfs/dbraw/zinc/38/67/41/968386741.db2.gz FIMGCSYDTAEMDO-HNNXBMFYSA-N 2 0 247.386 2.220 20 0 BEADRP CCCC[N@@H+]1C[C@@H]2CC[C@@H]([NH+](C)C)C[C@@H]2C1 ZINC001120281390 968560648 /nfs/dbraw/zinc/56/06/48/968560648.db2.gz CGCZXNPJCQLYRQ-BFHYXJOUSA-N 2 0 224.392 2.449 20 0 BEADRP CCCCNc1cccc(N2CCC([NH3+])CC2)[nH+]1 ZINC001154828074 968683235 /nfs/dbraw/zinc/68/32/35/968683235.db2.gz OEYNPPSKLDOPBC-UHFFFAOYSA-N 2 0 248.374 2.221 20 0 BEADRP CSC1CC[NH+](CC(C)(C)C[NH+](C)C)CC1 ZINC001207287112 968693956 /nfs/dbraw/zinc/69/39/56/968693956.db2.gz XTHIZJUGFFTPCO-UHFFFAOYSA-N 2 0 244.448 2.402 20 0 BEADRP C[NH+](C)CC(C)(C)C[N@@H+]1CC2CCC1CC2 ZINC001207282020 968711093 /nfs/dbraw/zinc/71/10/93/968711093.db2.gz CIUAEGFQZZLASK-UHFFFAOYSA-N 2 0 224.392 2.449 20 0 BEADRP C=Cc1ccccc1C[NH+]1CCC([NH3+])CC1 ZINC001240831684 968728866 /nfs/dbraw/zinc/72/88/66/968728866.db2.gz QPDLGAKGLYYFQL-UHFFFAOYSA-N 2 0 216.328 2.253 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2CCCC[C@@H](F)C2)CC1 ZINC001207391339 968745649 /nfs/dbraw/zinc/74/56/49/968745649.db2.gz GTRSQTFPECPRHQ-CYBMUJFWSA-N 2 0 228.355 2.152 20 0 BEADRP C[NH+]1CCC(C[NH+]2CC3(C2)CCCC3)CC1 ZINC001207393927 968752496 /nfs/dbraw/zinc/75/24/96/968752496.db2.gz FRJZBFZKOJCPCJ-UHFFFAOYSA-N 2 0 222.376 2.204 20 0 BEADRP C[C@H]1CCC[N@H+](CC2CC[NH2+]CC2)C[C@H]1C ZINC001207437011 968767878 /nfs/dbraw/zinc/76/78/78/968767878.db2.gz ZNZVGPDXXGLBPT-QWHCGFSZSA-N 2 0 224.392 2.354 20 0 BEADRP C[N@H+](CCC1CC[NH+](C)CC1)Cc1ccncc1 ZINC001207479084 968793817 /nfs/dbraw/zinc/79/38/17/968793817.db2.gz CXWLRROVPBRHJE-UHFFFAOYSA-N 2 0 247.386 2.245 20 0 BEADRP C[C@@H]1C[C@H](F)C[N@@H+]1CCC1CC[NH+](C)CC1 ZINC001207479390 968795327 /nfs/dbraw/zinc/79/53/27/968795327.db2.gz HLZQUQPSZITANX-YPMHNXCESA-N 2 0 228.355 2.151 20 0 BEADRP C[NH+]1CCC(CC[NH+]2C[C@H]3CCC[C@@H]3C2)CC1 ZINC001207480201 968796860 /nfs/dbraw/zinc/79/68/60/968796860.db2.gz WUBAJAZFTHGDKS-HUUCEWRRSA-N 2 0 236.403 2.450 20 0 BEADRP C[NH+]1CCC(CC[NH+]2CC3CC(C3)C2)CC1 ZINC001207487126 968798800 /nfs/dbraw/zinc/79/88/00/968798800.db2.gz HRJJBGJVJLEPTI-UHFFFAOYSA-N 2 0 222.376 2.060 20 0 BEADRP C[C@H]1CCC[N@H+](C[C@H]2CCCC[NH2+]C2)CC1 ZINC000829275999 968828476 /nfs/dbraw/zinc/82/84/76/968828476.db2.gz RLPKSISKKRXXLQ-KBPBESRZSA-N 2 0 224.392 2.498 20 0 BEADRP C[NH+]1CC2(C1)CC[NH+](C[C@H]1C[C@H]3C=C[C@@H]1C3)CC2 ZINC001207632111 968847639 /nfs/dbraw/zinc/84/76/39/968847639.db2.gz MIBADMAVCXNEQG-RRFJBIMHSA-N 2 0 246.398 2.226 20 0 BEADRP CC[NH+]1C[C@@H]2C[NH+](C[C@@H]3C[C@H]4C=C[C@@H]3C4)C[C@H]2C1 ZINC001207633792 968851715 /nfs/dbraw/zinc/85/17/15/968851715.db2.gz AHMDPMKVRROYAA-ZVDSWSACSA-N 2 0 246.398 2.082 20 0 BEADRP CC[NH+]1C[C@@H]2C[NH+](C[C@H]3C[C@H]4C=C[C@@H]3C4)C[C@H]2C1 ZINC001207633790 968852831 /nfs/dbraw/zinc/85/28/31/968852831.db2.gz AHMDPMKVRROYAA-UYJHQMFVSA-N 2 0 246.398 2.082 20 0 BEADRP CC(C)O[C@H]1CCC[N@H+](CCCCCC[NH3+])C1 ZINC000404519255 968896394 /nfs/dbraw/zinc/89/63/94/968896394.db2.gz OKOGANPOJZYKQG-AWEZNQCLSA-N 2 0 242.407 2.395 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@H]([NH2+]CC3(C)CCCC3)[C@@H]2C1 ZINC001207843943 968900155 /nfs/dbraw/zinc/90/01/55/968900155.db2.gz JBODQXVWOWPHTJ-MJBXVCDLSA-N 2 0 236.403 2.497 20 0 BEADRP COCc1ccc(C[NH+]2CCC(C[NH3+])CC2)cc1 ZINC000088569371 968975534 /nfs/dbraw/zinc/97/55/34/968975534.db2.gz QNEWTABXYPQFSL-UHFFFAOYSA-N 2 0 248.370 2.004 20 0 BEADRP C[C@@H]1C[C@H](F)C[N@@H+]1CC1(C)CC[NH+](C)CC1 ZINC001208108603 969000929 /nfs/dbraw/zinc/00/09/29/969000929.db2.gz WRRMUQWUDUQTGM-NEPJUHHUSA-N 2 0 228.355 2.151 20 0 BEADRP C[NH+]1CCC(C)(C[N@@H+]2CCC[C@H](F)C2)CC1 ZINC001208105802 969001767 /nfs/dbraw/zinc/00/17/67/969001767.db2.gz CMCKHKSJVDRPII-LBPRGKRZSA-N 2 0 228.355 2.152 20 0 BEADRP CC[NH+](CC)CC1(C[NH+](C)C)CCCC1 ZINC001208181989 969114076 /nfs/dbraw/zinc/11/40/76/969114076.db2.gz IXBKQDABERUDHO-UHFFFAOYSA-N 2 0 212.381 2.450 20 0 BEADRP C[C@@H]1CC[N@H+](CC2(C[NH+](C)C)CCCC2)C1 ZINC001208185289 969119049 /nfs/dbraw/zinc/11/90/49/969119049.db2.gz ZPVHCWKQHZQQOP-CYBMUJFWSA-N 2 0 224.392 2.450 20 0 BEADRP C[NH+](C)CC1(C[N@H+](C)C2CC2)CCCC1 ZINC001208183848 969119607 /nfs/dbraw/zinc/11/96/07/969119607.db2.gz IEJXWNLEOVKEBF-UHFFFAOYSA-N 2 0 210.365 2.203 20 0 BEADRP C[C@@H](C[NH+](C)C)Nc1cc(N2CCCC2)cc[nH+]1 ZINC001155915941 969123625 /nfs/dbraw/zinc/12/36/25/969123625.db2.gz KQAKQAYGMZXROU-LBPRGKRZSA-N 2 0 248.374 2.044 20 0 BEADRP CCC[N@H+](C[C@H](O)C[NH2+]C(C)(C)C)[C@@H](C)CC ZINC001253384923 969149182 /nfs/dbraw/zinc/14/91/82/969149182.db2.gz MTUAOUHVOGSHJG-QWHCGFSZSA-N 2 0 244.423 2.246 20 0 BEADRP CC[NH+]1CCC(C[NH+]2CCC(CF)CC2)CC1 ZINC001208598620 969151591 /nfs/dbraw/zinc/15/15/91/969151591.db2.gz VBQCRXODQWRVPG-UHFFFAOYSA-N 2 0 242.382 2.400 20 0 BEADRP CC[NH+]1CCC(C[N@H+](CCOC)C(C)C)CC1 ZINC001208600800 969151624 /nfs/dbraw/zinc/15/16/24/969151624.db2.gz WTWQYDRHMXQFEV-UHFFFAOYSA-N 2 0 242.407 2.075 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2CCC[C@H](C)C2)CC1 ZINC001208595506 969151840 /nfs/dbraw/zinc/15/18/40/969151840.db2.gz UWZYUOWSPKPYGF-ZDUSSCGKSA-N 2 0 224.392 2.450 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2CCC[C@@H]3C[C@@H]32)CC1 ZINC001208602870 969153468 /nfs/dbraw/zinc/15/34/68/969153468.db2.gz PSYIBIVOJIBYKW-KGLIPLIRSA-N 2 0 222.376 2.203 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2CCC[C@@H]2CF)CC1 ZINC001208603917 969156162 /nfs/dbraw/zinc/15/61/62/969156162.db2.gz IWJDABDDYBEXHM-CYBMUJFWSA-N 2 0 228.355 2.152 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH+]2CCCC(F)(F)CC2)C1 ZINC001208604162 969157785 /nfs/dbraw/zinc/15/77/85/969157785.db2.gz LTBXETHRTYDYNW-LBPRGKRZSA-N 2 0 246.345 2.449 20 0 BEADRP CC[N@H+]1C[C@@H]2C[NH+](CCC3CCCC3)C[C@@H]2C1 ZINC001208699312 969198721 /nfs/dbraw/zinc/19/87/21/969198721.db2.gz TWYORUIJNNCIKI-GASCZTMLSA-N 2 0 236.403 2.450 20 0 BEADRP Cc1cncc(C[N@@H+]2CCC[C@H](C[NH3+])[C@H](C)C2)c1 ZINC001205993515 969229202 /nfs/dbraw/zinc/22/92/02/969229202.db2.gz HZDXHXGFXVERKA-UKRRQHHQSA-N 2 0 247.386 2.197 20 0 BEADRP C[C@@H]1C[N@H+](Cc2cccc(O)c2)CCC[C@H]1C[NH3+] ZINC001205994864 969251586 /nfs/dbraw/zinc/25/15/86/969251586.db2.gz MRXXEWXQTKUXRF-OCCSQVGLSA-N 2 0 248.370 2.199 20 0 BEADRP Cc1ccnc(C[N@@H+]2CCC[C@@H](C[NH3+])[C@H](C)C2)c1 ZINC001205994398 969253161 /nfs/dbraw/zinc/25/31/61/969253161.db2.gz LJYSWOTUGOTCTE-KGLIPLIRSA-N 2 0 247.386 2.197 20 0 BEADRP CC[N@H+](C[C@H]1CCC=CO1)C1CCN(C)CC1 ZINC001208880132 969271299 /nfs/dbraw/zinc/27/12/99/969271299.db2.gz IVVMIGWXTDOWPJ-CQSZACIVSA-N 2 0 238.375 2.095 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]CC1CC(F)(F)C1)C2 ZINC001169092830 969387118 /nfs/dbraw/zinc/38/71/18/969387118.db2.gz CTYZVGAQJSZEOA-CNDDSTCGSA-N 2 0 244.329 2.247 20 0 BEADRP CCC[C@@H](C)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169099619 969390081 /nfs/dbraw/zinc/39/00/81/969390081.db2.gz CPXDLEUJNIEIRU-LPWJVIDDSA-N 2 0 210.365 2.390 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]CCC1CCC1)C2 ZINC001169097927 969393218 /nfs/dbraw/zinc/39/32/18/969393218.db2.gz FIRHYKYNRFTWBU-ZSOGYDGISA-N 2 0 222.376 2.391 20 0 BEADRP CCC(C)(C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169078830 969398870 /nfs/dbraw/zinc/39/88/70/969398870.db2.gz HVMZTHQGGVSIKU-ZSBIGDGJSA-N 2 0 210.365 2.390 20 0 BEADRP CCCCC[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169081029 969401924 /nfs/dbraw/zinc/40/19/24/969401924.db2.gz PGPQZTMZWGGYQT-XYYAHUGASA-N 2 0 210.365 2.391 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+][C@@H]1CC[C@@H](F)C1)C2 ZINC001169080309 969404825 /nfs/dbraw/zinc/40/48/25/969404825.db2.gz MKXOZRKMGONXRD-VEGXAWMVSA-N 2 0 226.339 2.092 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+][C@@H]1CC13CCC3)C2 ZINC001169116571 969412688 /nfs/dbraw/zinc/41/26/88/969412688.db2.gz RDVRBPYOQUAPQL-FVCCEPFGSA-N 2 0 220.360 2.144 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1C[C@@H]3CCC[C@@H]3C1)C2 ZINC001169126546 969434588 /nfs/dbraw/zinc/43/45/88/969434588.db2.gz WCSDJRGANQPYBN-SBAKFKMJSA-N 2 0 234.387 2.344 20 0 BEADRP C[N@H+](CCC1CC1)[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169155660 969470029 /nfs/dbraw/zinc/47/00/29/969470029.db2.gz ULRCHSPHQABJBW-BTTYYORXSA-N 2 0 222.376 2.344 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1C[C@@H]3C[C@H]1C[C@@H]3F)C2 ZINC001169155854 969472536 /nfs/dbraw/zinc/47/25/36/969472536.db2.gz VKBKDWHNFCUOEH-VPCRRHSYSA-N 2 0 238.350 2.044 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@@H]2CCC[C@H]2F)CC1 ZINC001169219581 969488266 /nfs/dbraw/zinc/48/82/66/969488266.db2.gz FAMWDTNWWKJDDS-WCQYABFASA-N 2 0 228.355 2.199 20 0 BEADRP CC[N@H+](C)C1CC[NH+](C[C@H]2C[C@@H]2C)CC1 ZINC001209427103 969498034 /nfs/dbraw/zinc/49/80/34/969498034.db2.gz OKBCGBXLPYYFHP-NWDGAFQWSA-N 2 0 210.365 2.059 20 0 BEADRP C(C[N@@H+]1CCCC12CC2)C[NH+]1CCCCC1 ZINC001209447653 969516636 /nfs/dbraw/zinc/51/66/36/969516636.db2.gz BHMLCTHTHHGWQB-UHFFFAOYSA-N 2 0 222.376 2.491 20 0 BEADRP C[C@@H]([NH3+])c1ccn(-c2cc[nH+]c(C3CC3)c2)n1 ZINC001169234975 969520936 /nfs/dbraw/zinc/52/09/36/969520936.db2.gz MYDWSSYVQUFKGK-SECBINFHSA-N 2 0 228.299 2.164 20 0 BEADRP C[N@H+]1C[C@@H]2C[NH+](C3CCC4(CC4)CC3)C[C@@H]2C1 ZINC001254445963 969632356 /nfs/dbraw/zinc/63/23/56/969632356.db2.gz SHOCYYWXAYQGEH-BETUJISGSA-N 2 0 234.387 2.203 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH2+]C2(CC3CC3)CC2)CC1 ZINC001254511963 969683156 /nfs/dbraw/zinc/68/31/56/969683156.db2.gz HNSNJVONZXPFMW-CYBMUJFWSA-N 2 0 222.376 2.393 20 0 BEADRP C[N@H+](CCc1ccncc1)[C@H]1CCC[NH+](C)CC1 ZINC001254522153 969711176 /nfs/dbraw/zinc/71/11/76/969711176.db2.gz CZYPOMNLTUHXCK-HNNXBMFYSA-N 2 0 247.386 2.040 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH+]2CCC[C@H](CF)C2)CC1 ZINC001254524665 969721287 /nfs/dbraw/zinc/72/12/87/969721287.db2.gz YIOFIXUNOWACDW-OLZOCXBDSA-N 2 0 228.355 2.152 20 0 BEADRP Cc1[nH+]ccc(NC(C)(C)CC[NH+](C)C)c1F ZINC001169717989 969832099 /nfs/dbraw/zinc/83/20/99/969832099.db2.gz LTJBZUUIVDGLRT-UHFFFAOYSA-N 2 0 239.338 2.093 20 0 BEADRP Oc1ccc(NCC23CC[NH+](CC2)CC3)cc1 ZINC001169802287 969850521 /nfs/dbraw/zinc/85/05/21/969850521.db2.gz LDYJYUIJAIICCB-UHFFFAOYSA-N 2 0 232.327 2.290 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)C1Cc2ccccc2C1 ZINC001255026253 969850790 /nfs/dbraw/zinc/85/07/90/969850790.db2.gz RQAKMNAOPNKRPZ-UHFFFAOYSA-N 2 0 246.398 2.427 20 0 BEADRP C[NH+](C)CCC(C)(C)[NH2+]C1CCSCC1 ZINC001255081847 969875590 /nfs/dbraw/zinc/87/55/90/969875590.db2.gz AGYYRQUBLFKSES-UHFFFAOYSA-N 2 0 230.421 2.202 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)C1CCSCC1 ZINC001255094468 969931114 /nfs/dbraw/zinc/93/11/14/969931114.db2.gz DCDZARCBORIKLG-UHFFFAOYSA-N 2 0 230.421 2.156 20 0 BEADRP C[NH2+]CC1C[NH+](C[C@@H]2CCC(C)=C[C@@H]2C)C1 ZINC001210560882 969940463 /nfs/dbraw/zinc/94/04/63/969940463.db2.gz BNUHSIDPNVHUSM-JSGCOSHPSA-N 2 0 222.376 2.130 20 0 BEADRP [NH2+]=CN[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001255126485 969943691 /nfs/dbraw/zinc/94/36/91/969943691.db2.gz MUULPGPNIPZGQT-QDMKHBRRSA-N 2 0 243.354 2.379 20 0 BEADRP [NH3+]C1(CC2CC2)CC[NH+]([C@@H]2CCSC2)CC1 ZINC001255276809 970029631 /nfs/dbraw/zinc/02/96/31/970029631.db2.gz YZFOVELGXKXBKZ-GFCCVEGCSA-N 2 0 240.416 2.085 20 0 BEADRP [NH2+]=CN[C@H]1CCC[N@H+](Cc2ccccc2)CC1 ZINC001255387975 970126132 /nfs/dbraw/zinc/12/61/32/970126132.db2.gz WQMOBMOGAJFUCV-AWEZNQCLSA-N 2 0 231.343 2.238 20 0 BEADRP CC(C)CCC[C@@H](C)[NH2+]CCSCC[NH3+] ZINC001170065470 970133302 /nfs/dbraw/zinc/13/33/02/970133302.db2.gz ZBNTWWHAMXHZJO-GFCCVEGCSA-N 2 0 232.437 2.483 20 0 BEADRP C[NH2+]Cc1ccc(Nc2cc[nH+]c(C)c2)cc1 ZINC001211127534 970154873 /nfs/dbraw/zinc/15/48/73/970154873.db2.gz NCADGKJYYPKUOT-UHFFFAOYSA-N 2 0 227.311 2.275 20 0 BEADRP COC1CCC([NH2+]CCCCCCC[NH3+])CC1 ZINC001255451161 970182784 /nfs/dbraw/zinc/18/27/84/970182784.db2.gz HPXCPKKPBMRXAP-UHFFFAOYSA-N 2 0 242.407 2.443 20 0 BEADRP COC1CCC([NH2+]C(C)(C)C(C)(C)[NH3+])CC1 ZINC001255451788 970184333 /nfs/dbraw/zinc/18/43/33/970184333.db2.gz VWDPNIQDTRUGRL-UHFFFAOYSA-N 2 0 228.380 2.050 20 0 BEADRP C[N@@H+]1CCC[C@@H](n2c(C[NH3+])cc3ccccc32)C1 ZINC001255467415 970193354 /nfs/dbraw/zinc/19/33/54/970193354.db2.gz CGTLOGDIMPCANC-CYBMUJFWSA-N 2 0 243.354 2.367 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CCCCC[NH+](C)C)C1 ZINC001170098582 970282805 /nfs/dbraw/zinc/28/28/05/970282805.db2.gz ULIAMVBQOKWNPA-CHWSQXEVSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+]CC[C@H]2CCC[N@@H+]2C)C1 ZINC001170114040 970328698 /nfs/dbraw/zinc/32/86/98/970328698.db2.gz ZTNXAKBDJYQRAY-YNEHKIRRSA-N 2 0 210.365 2.249 20 0 BEADRP COC[C@@H](C)[NH2+]C1CC[NH+](CC(C)(C)C)CC1 ZINC001255563660 970348651 /nfs/dbraw/zinc/34/86/51/970348651.db2.gz WURNQLMUCPSGAG-GFCCVEGCSA-N 2 0 242.407 2.121 20 0 BEADRP COC[C@H](C)[N@H+](C1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001255563505 970349149 /nfs/dbraw/zinc/34/91/49/970349149.db2.gz VMTTXOPSPJSKKY-OBJOEFQTSA-N 2 0 240.391 2.146 20 0 BEADRP C[C@H]1CC[C@@H]([N@H+](C)C2CCN(C)CC2)C1 ZINC001170124230 970368863 /nfs/dbraw/zinc/36/88/63/970368863.db2.gz FVPPQXYIYHLJOA-WCQYABFASA-N 2 0 210.365 2.201 20 0 BEADRP C[C@H](CC(F)(F)F)[NH2+][C@@]1(C)CCCN(C)C1 ZINC001255644128 970417813 /nfs/dbraw/zinc/41/78/13/970417813.db2.gz LCEBVCGIHUNSTL-ZJUUUORDSA-N 2 0 238.297 2.401 20 0 BEADRP C[C@@H]1C[C@H](F)C[N@@H+]1C1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001255674119 970453926 /nfs/dbraw/zinc/45/39/26/970453926.db2.gz KZXWAIWTQSFWRU-ZBBUEOHVSA-N 2 0 240.366 2.434 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)[C@H]1CC[C@H](C)C1 ZINC001170156376 970481399 /nfs/dbraw/zinc/48/13/99/970481399.db2.gz DUDNIHKFWMOWPX-STQMWFEESA-N 2 0 212.381 2.449 20 0 BEADRP CCC[NH+]1C[C@@H]2C[NH+]([C@@H]3CC[C@@H](C)C3)C[C@H]2C1 ZINC001170159243 970486288 /nfs/dbraw/zinc/48/62/88/970486288.db2.gz RTQGBAPBCMRDDT-KBUPBQIOSA-N 2 0 236.403 2.449 20 0 BEADRP C[C@H](C[NH3+])C[N@H+](C)[C@H](C)Cc1ccccc1F ZINC001255841328 970500561 /nfs/dbraw/zinc/50/05/61/970500561.db2.gz RTIAIMVEZPOHGW-VXGBXAGGSA-N 2 0 238.350 2.283 20 0 BEADRP CC[C@H]1C[C@H]([NH2+]C(C)(C)CC[NH+](C)C)CCO1 ZINC001170176042 970546987 /nfs/dbraw/zinc/54/69/87/970546987.db2.gz OUIBNYHZJGVCHM-OLZOCXBDSA-N 2 0 242.407 2.264 20 0 BEADRP CSC[C@H]1CCC[N@@H+]1C[C@]1(C)CCC[NH2+]C1 ZINC000400130852 970548702 /nfs/dbraw/zinc/54/87/02/970548702.db2.gz SBEGGUXVCUMSGP-CHWSQXEVSA-N 2 0 242.432 2.204 20 0 BEADRP [NH3+]C[C@H]1CC[N@H+](C[C@@H]2CC3CCC2CC3)C1 ZINC000400131572 970549208 /nfs/dbraw/zinc/54/92/08/970549208.db2.gz VGFZHIKAIFMQNU-HHTDUIENSA-N 2 0 222.376 2.093 20 0 BEADRP CC[NH+](CC)CC[C@H](C)NC1(CF)CC1 ZINC001255941250 970564178 /nfs/dbraw/zinc/56/41/78/970564178.db2.gz MLZRROVDQSMIIY-NSHDSACASA-N 2 0 216.344 2.199 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]C(C)(C)C ZINC001255940022 970569268 /nfs/dbraw/zinc/56/92/68/970569268.db2.gz LTZRMYMESYWREM-LLVKDONJSA-N 2 0 200.370 2.495 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]CC1(O)CCCC1 ZINC001255941237 970572616 /nfs/dbraw/zinc/57/26/16/970572616.db2.gz LVQCPMBKVXEUMO-ZDUSSCGKSA-N 2 0 242.407 2.002 20 0 BEADRP CSC[C@H]1CCC[N@@H+]1CCCCCC[NH3+] ZINC000400299570 970574176 /nfs/dbraw/zinc/57/41/76/970574176.db2.gz SYEBHCXOBVNYFS-GFCCVEGCSA-N 2 0 230.421 2.333 20 0 BEADRP C[C@H]([NH2+]Cc1ccccc1F)C1CC[NH2+]CC1 ZINC000400318569 970574370 /nfs/dbraw/zinc/57/43/70/970574370.db2.gz AZAZYYBERPIRDE-NSHDSACASA-N 2 0 236.334 2.303 20 0 BEADRP CC(C)C[C@@H](C)[NH2+][C@H](C)C1CC[NH2+]CC1 ZINC000400336381 970578558 /nfs/dbraw/zinc/57/85/58/970578558.db2.gz GAKRLZLJPDQQQJ-VXGBXAGGSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)c1ccncc1 ZINC000400359750 970580896 /nfs/dbraw/zinc/58/08/96/970580896.db2.gz PTTUXCSFDPQFGM-RYUDHWBXSA-N 2 0 233.359 2.120 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)c1cccnc1)C1CC[NH2+]CC1 ZINC000400390766 970585069 /nfs/dbraw/zinc/58/50/69/970585069.db2.gz ZXEZDLLDEVCCJW-NEPJUHHUSA-N 2 0 233.359 2.120 20 0 BEADRP C[C@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)c1cccc(O)c1 ZINC000400437893 970589208 /nfs/dbraw/zinc/58/92/08/970589208.db2.gz NFAQIKMBFCXYSP-RYUDHWBXSA-N 2 0 248.370 2.431 20 0 BEADRP CCC(CC)C[NH2+][C@H](C)C1CC[NH2+]CC1 ZINC000400492586 970595051 /nfs/dbraw/zinc/59/50/51/970595051.db2.gz ZUUJOSOBTJLTKP-LLVKDONJSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[C@@H](C)C1)C1CC[NH2+]CC1 ZINC000400519672 970597859 /nfs/dbraw/zinc/59/78/59/970597859.db2.gz GXRKCHJPEYRNFU-MDZLAQPJSA-N 2 0 210.365 2.153 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[N@H+](C)[C@H]1CCCOC1 ZINC001255969066 970606813 /nfs/dbraw/zinc/60/68/13/970606813.db2.gz STUBICAUXABXCL-KGLIPLIRSA-N 2 0 242.407 2.218 20 0 BEADRP C[C@H](Cc1ccco1)[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000400996875 970653585 /nfs/dbraw/zinc/65/35/85/970653585.db2.gz CFXNCAZMYSJWHT-XJFOESAGSA-N 2 0 248.370 2.188 20 0 BEADRP C[NH+]1CCC(n2ccc3cccc(C[NH3+])c32)CC1 ZINC001256200525 970693387 /nfs/dbraw/zinc/69/33/87/970693387.db2.gz UYKHZZGEIOUCOV-UHFFFAOYSA-N 2 0 243.354 2.367 20 0 BEADRP C[C@@H]1CCC[N@@H+](C2CCN(C)CC2)[C@@H]1C ZINC001256207231 970714849 /nfs/dbraw/zinc/71/48/49/970714849.db2.gz DAHXUSYAADEEHS-VXGBXAGGSA-N 2 0 210.365 2.201 20 0 BEADRP CC(C)CC[C@H](C)[N@H+](C)C[C@@H](C)C[NH3+] ZINC001256357583 970733582 /nfs/dbraw/zinc/73/35/82/970733582.db2.gz IBYATORXIZULOB-RYUDHWBXSA-N 2 0 200.370 2.338 20 0 BEADRP Cc1csc(C[NH+]2CCC(F)(C[NH3+])CC2)c1 ZINC001222532549 972551058 /nfs/dbraw/zinc/55/10/58/972551058.db2.gz NCYCZAIRBBWKAS-UHFFFAOYSA-N 2 0 242.363 2.319 20 0 BEADRP CCCCC[C@H](C)[N@@H+]1CCC[C@](O)(C[NH3+])CC1 ZINC001246545983 972660032 /nfs/dbraw/zinc/66/00/32/972660032.db2.gz XUBJYZWDTIIYLM-UONOGXRCSA-N 2 0 242.407 2.131 20 0 BEADRP CSCC[C@H](C)[N@@H+]1CCC[C@@](F)(C[NH3+])CC1 ZINC001246549578 972696379 /nfs/dbraw/zinc/69/63/79/972696379.db2.gz MMYXUUXDALAISA-RYUDHWBXSA-N 2 0 248.411 2.281 20 0 BEADRP C[C@@]1([NH3+])CCC[N@@H+]([C@H]2CCCSC2)CC1 ZINC001246554025 972744180 /nfs/dbraw/zinc/74/41/80/972744180.db2.gz USEODRNRKORXQE-NWDGAFQWSA-N 2 0 228.405 2.085 20 0 BEADRP C[C@]1([NH3+])CCC[N@@H+]([C@@H]2CCCSC2)CC1 ZINC001246554023 972745868 /nfs/dbraw/zinc/74/58/68/972745868.db2.gz USEODRNRKORXQE-NEPJUHHUSA-N 2 0 228.405 2.085 20 0 BEADRP CCC[C@H](C)[N@@H+]1CCC[C@@H](C[NH3+])[C@H](C)C1 ZINC001246562873 972787185 /nfs/dbraw/zinc/78/71/85/972787185.db2.gz BQVAXCISEYNAQT-AGIUHOORSA-N 2 0 212.381 2.482 20 0 BEADRP CCC(CC)[N@@H+]1CCC[C@@H](C[NH3+])[C@H](C)C1 ZINC001246570826 972843709 /nfs/dbraw/zinc/84/37/09/972843709.db2.gz WAOYUPUOOVKNMF-NEPJUHHUSA-N 2 0 212.381 2.482 20 0 BEADRP C[C@]1(F)CCCC[N@@H+](C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC001246579574 972909405 /nfs/dbraw/zinc/90/94/05/972909405.db2.gz ZPYGNEHWWOZHPG-PIGZVRMJSA-N 2 0 240.366 2.484 20 0 BEADRP CC1(C[NH3+])C[NH+]([C@@H]2CCCC(C)(C)C2)C1 ZINC001246602170 973028223 /nfs/dbraw/zinc/02/82/23/973028223.db2.gz VZOFULYFSICERK-LLVKDONJSA-N 2 0 210.365 2.236 20 0 BEADRP CCCC[C@H](C)[N@@H+]1C[C@H]2CCC[NH2+][C@H]2C1 ZINC001246655150 973071090 /nfs/dbraw/zinc/07/10/90/973071090.db2.gz GJZJEZIUCIOBBU-XQQFMLRXSA-N 2 0 210.365 2.249 20 0 BEADRP CCCOC1CCN([C@H]2CC[C@H](C)[NH2+]C2)CC1 ZINC001246793491 973093684 /nfs/dbraw/zinc/09/36/84/973093684.db2.gz ZTRDTCGFMFNDFK-STQMWFEESA-N 2 0 240.391 2.018 20 0 BEADRP C[C@H]1CC([N@@H+]2CCCC3(C[NH2+]C3)C2)C[C@H](C)C1 ZINC001246794254 973097481 /nfs/dbraw/zinc/09/74/81/973097481.db2.gz ZMEGEUCAROVEQS-CHWSQXEVSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H]1CC([N@H+]2C[C@H]3CC[C@@H](C2)[C@@H]3[NH3+])C[C@H](C)C1 ZINC001246839071 973143974 /nfs/dbraw/zinc/14/39/74/973143974.db2.gz APYZHVUHTQJOEZ-XLFUENPSSA-N 2 0 236.403 2.480 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@H]2[C@@H](C1)C2(F)F)[C@H]1CCC[NH2+]1 ZINC001328614500 973196539 /nfs/dbraw/zinc/19/65/39/973196539.db2.gz FROQHWGOKSNIEY-RNWYCLNJSA-N 2 0 244.329 2.150 20 0 BEADRP CC(C)CC[C@H](C)N1C[C@H]2CC[C@@H](C1)[NH2+]C2 ZINC001246866312 973220107 /nfs/dbraw/zinc/22/01/07/973220107.db2.gz JFMTWUSJTMIABR-IHRRRGAJSA-N 2 0 224.392 2.495 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+]C[C@H](C)C(C)(C)C ZINC000234726601 973729631 /nfs/dbraw/zinc/72/96/31/973729631.db2.gz BNNIEYHEPRVQCF-NWDGAFQWSA-N 2 0 230.396 2.012 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+]C1CCCCCCC1 ZINC000234776876 973740311 /nfs/dbraw/zinc/74/03/11/973740311.db2.gz AHSFABZNTZOGQI-AWEZNQCLSA-N 2 0 242.407 2.443 20 0 BEADRP F[C@@H]1CCC[C@H]([NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)C1 ZINC001329499109 973800721 /nfs/dbraw/zinc/80/07/21/973800721.db2.gz ONQLGWRDYWNVCG-RFGFWPKPSA-N 2 0 240.366 2.484 20 0 BEADRP Fc1cc2nc[nH]c2cc1NC[C@H]1CCCC[NH2+]1 ZINC001171335161 973868199 /nfs/dbraw/zinc/86/81/99/973868199.db2.gz NAPLUAYUXXCZRT-SECBINFHSA-N 2 0 248.305 2.256 20 0 BEADRP Cc1cccc2c1CC[C@@H]([NH2+]CCCC[NH3+])C2 ZINC001171553897 974100326 /nfs/dbraw/zinc/10/03/26/974100326.db2.gz WKNQCFHEFMLJDR-CQSZACIVSA-N 2 0 232.371 2.181 20 0 BEADRP COCC[N@H+](C)C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171628690 974107988 /nfs/dbraw/zinc/10/79/88/974107988.db2.gz GKIAJOLXMNLKSA-UHFFFAOYSA-N 2 0 242.407 2.216 20 0 BEADRP C[NH+]1C(C)(C)CC([NH2+]C[C@@H]2CCO2)CC1(C)C ZINC001171622255 974114477 /nfs/dbraw/zinc/11/44/77/974114477.db2.gz YJXUHFQIYCXDHH-LBPRGKRZSA-N 2 0 240.391 2.016 20 0 BEADRP C[NH+]1C(C)(C)CC([NH2+][C@H]2CCOC2)CC1(C)C ZINC001171614350 974115788 /nfs/dbraw/zinc/11/57/88/974115788.db2.gz YDHPZNJTNMJQOA-NSHDSACASA-N 2 0 240.391 2.016 20 0 BEADRP C[NH+](C)CCCCO[C@H]1CC[C@H]([NH+](C)C)CC1 ZINC001224991696 974124594 /nfs/dbraw/zinc/12/45/94/974124594.db2.gz YXGGZHCEEHOEPW-HDJSIYSDSA-N 2 0 242.407 2.218 20 0 BEADRP [NH3+][C@H]1CC[N@H+](CCCC(F)(F)F)CC[C@@H]1F ZINC001206153640 974259834 /nfs/dbraw/zinc/25/98/34/974259834.db2.gz CXAMZBPKYKONHI-IUCAKERBSA-N 2 0 242.260 2.090 20 0 BEADRP CN1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]C1(C)CC1)C2 ZINC001172101166 974334455 /nfs/dbraw/zinc/33/44/55/974334455.db2.gz XECFOYRXXZCICW-ZSBIGDGJSA-N 2 0 208.349 2.144 20 0 BEADRP C[C@H]([NH3+])c1nccn1[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172098430 974336235 /nfs/dbraw/zinc/33/62/35/974336235.db2.gz DWPHZWXIDWHONC-RVMXOQNASA-N 2 0 248.374 2.091 20 0 BEADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]CC1CC1)C2 ZINC001172100135 974346811 /nfs/dbraw/zinc/34/68/11/974346811.db2.gz NMXBIFCJCQQITD-XYYAHUGASA-N 2 0 208.349 2.001 20 0 BEADRP CSCCC[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172103099 974360878 /nfs/dbraw/zinc/36/08/78/974360878.db2.gz RVOAEWQSKWBUJH-CLLJXQQHSA-N 2 0 242.432 2.344 20 0 BEADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]CC1(F)CCC1)C2 ZINC001172107768 974369852 /nfs/dbraw/zinc/36/98/52/974369852.db2.gz BXFKATZVSGUJSB-XYYAHUGASA-N 2 0 240.366 2.484 20 0 BEADRP CN1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCCC1)C2 ZINC001172115152 974378825 /nfs/dbraw/zinc/37/88/25/974378825.db2.gz VIBFBUBPTJIKHY-CLLJXQQHSA-N 2 0 208.349 2.098 20 0 BEADRP C[C@@H]1C[C@@H](F)C[N@@H+]1[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172120479 974380636 /nfs/dbraw/zinc/38/06/36/974380636.db2.gz KZXWAIWTQSFWRU-XGFWRYKXSA-N 2 0 240.366 2.434 20 0 BEADRP C[C@@H]1C[C@H](F)C[N@@H+]1[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172120486 974384146 /nfs/dbraw/zinc/38/41/46/974384146.db2.gz KZXWAIWTQSFWRU-XHJNMGKDSA-N 2 0 240.366 2.434 20 0 BEADRP [NH3+]CCCC[NH2+][C@@H]1CSc2ccccc2C1 ZINC001172185667 974396582 /nfs/dbraw/zinc/39/65/82/974396582.db2.gz UHUCXSSQCXEYOI-LBPRGKRZSA-N 2 0 236.384 2.032 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+][C@@H]1CSc2ccccc2C1 ZINC001172192088 974400644 /nfs/dbraw/zinc/40/06/44/974400644.db2.gz BHSXFAUFMKDYSQ-RWMBFGLXSA-N 2 0 248.395 2.173 20 0 BEADRP C[NH+](C)Cc1ccc(O[C@@H]2CCC[N@H+](C)C2)cc1 ZINC001225330816 974405449 /nfs/dbraw/zinc/40/54/49/974405449.db2.gz QRICVQNQGVXDFJ-OAHLLOKOSA-N 2 0 248.370 2.221 20 0 BEADRP CCCC[N@H+](C)CCC[NH2+][C@@H]1COC(C)(C)C1 ZINC001172269558 974486416 /nfs/dbraw/zinc/48/64/16/974486416.db2.gz FWVWHTDCBWWGOJ-ZDUSSCGKSA-N 2 0 242.407 2.266 20 0 BEADRP CC[C@H](C)OCC[C@H](C)[NH2+]C[C@H]1CC[N@H+](C)C1 ZINC001172315676 974521617 /nfs/dbraw/zinc/52/16/17/974521617.db2.gz CLAYFPBLKAVOLF-MELADBBJSA-N 2 0 242.407 2.121 20 0 BEADRP CC[C@H](C)OCC[C@H](C)[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC001172321403 974531544 /nfs/dbraw/zinc/53/15/44/974531544.db2.gz KGOQARZDIXJMSC-XDQVBPFNSA-N 2 0 242.407 2.440 20 0 BEADRP CC[C@H](C)OCC[C@H](C)[NH+]1CCC(C)([NH3+])CC1 ZINC001172327062 974535202 /nfs/dbraw/zinc/53/52/02/974535202.db2.gz CQBGYWPLZCMOAO-STQMWFEESA-N 2 0 242.407 2.393 20 0 BEADRP C[NH+](C)[C@H]1CC[C@@H]([NH2+][C@@H]2COC(C)(C)C2)CC1 ZINC001172282257 974542781 /nfs/dbraw/zinc/54/27/81/974542781.db2.gz RAIBSARBFMLWIM-RWMBFGLXSA-N 2 0 240.391 2.016 20 0 BEADRP Cc1cc(N2CCC[C@@]3(CC[N@@H+](C)C3)C2)cc[nH+]1 ZINC001277063963 974641439 /nfs/dbraw/zinc/64/14/39/974641439.db2.gz CUHLZJINYWOQBG-HNNXBMFYSA-N 2 0 245.370 2.312 20 0 BEADRP CCOCC[C@H](C)[NH2+]Cc1ccccc1C[NH3+] ZINC001172413333 974679556 /nfs/dbraw/zinc/67/95/56/974679556.db2.gz ALCNZUGDLULEMW-LBPRGKRZSA-N 2 0 236.359 2.050 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+]CCc1ccc(F)cc1F ZINC001331419315 974713398 /nfs/dbraw/zinc/71/33/98/974713398.db2.gz QCUMDANPKUOMEV-ZDUSSCGKSA-N 2 0 242.313 2.080 20 0 BEADRP CC[C@@H](CC(C)C)[NH2+]CCSCC[NH3+] ZINC001172394506 974747275 /nfs/dbraw/zinc/74/72/75/974747275.db2.gz VTJIYZXSDTYEBJ-NSHDSACASA-N 2 0 218.410 2.093 20 0 BEADRP CC(C)OCC[C@H](C)[NH2+][C@@H]1CCC[N@H+](C)CC1 ZINC001172437790 974792649 /nfs/dbraw/zinc/79/26/49/974792649.db2.gz JGKDOPFLVYICLU-UONOGXRCSA-N 2 0 242.407 2.264 20 0 BEADRP CC(C)OCC[C@@H](C)[NH+]1CCC(C)([NH3+])CC1 ZINC001172443912 974804051 /nfs/dbraw/zinc/80/40/51/974804051.db2.gz SSJLCHHWADFNGV-GFCCVEGCSA-N 2 0 228.380 2.003 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H]1CCc2ccccc2C1 ZINC001331820707 974827841 /nfs/dbraw/zinc/82/78/41/974827841.db2.gz ILULFXUGRZWWIP-DOMZBBRYSA-N 2 0 232.371 2.132 20 0 BEADRP N[C@@H]1C[C@H]1[NH2+][C@@H]1CC[C@@H](c2ccccc2)C1 ZINC001172552631 974866757 /nfs/dbraw/zinc/86/67/57/974866757.db2.gz GUYHFKHQVDXJCA-AAVRWANBSA-N 2 0 216.328 2.012 20 0 BEADRP CC[N@H+](Cc1ccc(O)cc1)C1CCN(C)CC1 ZINC001204093298 974896459 /nfs/dbraw/zinc/89/64/59/974896459.db2.gz BTTCRWKGOQJHBQ-UHFFFAOYSA-N 2 0 248.370 2.308 20 0 BEADRP CO[C@@H]1CCC[C@@H]([NH2+]Cc2ccccc2C[NH3+])C1 ZINC001172924669 974972758 /nfs/dbraw/zinc/97/27/58/974972758.db2.gz XLEFVHHAGZAGMY-HUUCEWRRSA-N 2 0 248.370 2.193 20 0 BEADRP CC(C)(C)[NH+]1CCC(Oc2cc[nH+]c(N)c2)CC1 ZINC001226653530 975000325 /nfs/dbraw/zinc/00/03/25/975000325.db2.gz JYVINSVIBGYSPG-UHFFFAOYSA-N 2 0 249.358 2.306 20 0 BEADRP CC[NH+](CC)C1CCC([NH2+]CC(F)F)CC1 ZINC001173105921 975025948 /nfs/dbraw/zinc/02/59/48/975025948.db2.gz NPCXCCPFLYKXAP-UHFFFAOYSA-N 2 0 234.334 2.494 20 0 BEADRP CC[NH+](CC)C1CCC([NH2+]CCCOC)CC1 ZINC001173105686 975026514 /nfs/dbraw/zinc/02/65/14/975026514.db2.gz MFCPCJRZKRVXTA-UHFFFAOYSA-N 2 0 242.407 2.266 20 0 BEADRP CC[NH+](CC)C1CCC([NH+]2CCC2)CC1 ZINC001173107989 975026827 /nfs/dbraw/zinc/02/68/27/975026827.db2.gz AGXFBXFBKWSDCK-UHFFFAOYSA-N 2 0 210.365 2.345 20 0 BEADRP CCSC[C@@H](C)[N@H+](CCC[NH3+])C(C)C ZINC001173293183 975169560 /nfs/dbraw/zinc/16/95/60/975169560.db2.gz XZJMREWWZMIYJJ-LLVKDONJSA-N 2 0 218.410 2.187 20 0 BEADRP CCSC[C@H](C)[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC001173293204 975170987 /nfs/dbraw/zinc/17/09/87/975170987.db2.gz YQNWEHVLURYLST-STQMWFEESA-N 2 0 244.448 2.450 20 0 BEADRP CCSC[C@H](C)[NH2+]Cc1ccccc1C[NH3+] ZINC001173298160 975188092 /nfs/dbraw/zinc/18/80/92/975188092.db2.gz LGUBCVUYUGUKFI-NSHDSACASA-N 2 0 238.400 2.377 20 0 BEADRP CCSC[C@H](C)[NH+]1C[C@H]2C[NH+](CC)C[C@@H]2C1 ZINC001173307683 975217429 /nfs/dbraw/zinc/21/74/29/975217429.db2.gz IRLUJQRTHQEAAV-YNEHKIRRSA-N 2 0 242.432 2.012 20 0 BEADRP CCSC[C@@H](C)[NH+]1CCC2(C[NH+](C)C2)CC1 ZINC001173315281 975304670 /nfs/dbraw/zinc/30/46/70/975304670.db2.gz OVRNHXOKAFYESI-GFCCVEGCSA-N 2 0 242.432 2.156 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@H]2CCC[C@@H](F)C2)CC1 ZINC001333835181 976111359 /nfs/dbraw/zinc/11/13/59/976111359.db2.gz WFXAMTLAQZSNON-OLZOCXBDSA-N 2 0 228.355 2.199 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC001334389960 976488448 /nfs/dbraw/zinc/48/84/48/976488448.db2.gz KQKVXBOURRWFEG-DZGCQCFKSA-N 3 0 249.402 2.054 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC001334389964 976489429 /nfs/dbraw/zinc/48/94/29/976489429.db2.gz KQKVXBOURRWFEG-ZFWWWQNUSA-N 3 0 249.402 2.054 20 0 BEADRP CCc1cc(Nc2ccc3[nH+]ccn3c2)cc[nH+]1 ZINC001174278641 976513883 /nfs/dbraw/zinc/51/38/83/976513883.db2.gz OIGVTTNPMIBTSZ-UHFFFAOYSA-N 2 0 238.294 2.457 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[N@@H+]2CC[C@H](Cc3ccccc3)C2)C1 ZINC001334775083 976644891 /nfs/dbraw/zinc/64/48/91/976644891.db2.gz QYOGEWTUSZJYEE-OAGGEKHMSA-N 2 0 244.382 2.288 20 0 BEADRP C[C@@H](c1cccc(O[C@@H]2CC[N@H+](C)C2)c1)[NH+](C)C ZINC001229625594 976916265 /nfs/dbraw/zinc/91/62/65/976916265.db2.gz IDQDXBKJMSGZLZ-SWLSCSKDSA-N 2 0 248.370 2.392 20 0 BEADRP C[N@@H+]1CCC[C@H]2CN(c3cc[nH+]cc3)CC[C@@H]21 ZINC001336391778 977656591 /nfs/dbraw/zinc/65/65/91/977656591.db2.gz NFGAWVRZIADVHU-JSGCOSHPSA-N 2 0 231.343 2.002 20 0 BEADRP CC1([NH+]2CCC2)CCN(c2cc[nH+]cc2)CC1 ZINC001336410184 977671843 /nfs/dbraw/zinc/67/18/43/977671843.db2.gz AZOHAROFMMRYLE-UHFFFAOYSA-N 2 0 231.343 2.146 20 0 BEADRP C[NH+](C)CCCNc1cc[nH+]c2c(O)cccc12 ZINC001336431281 977680683 /nfs/dbraw/zinc/68/06/83/977680683.db2.gz FYZVFNAOBHWMHE-UHFFFAOYSA-N 2 0 245.326 2.304 20 0 BEADRP c1c2c[nH+]ccc2[nH]c1C[NH+]1CCCC1 ZINC001232012332 977838976 /nfs/dbraw/zinc/83/89/76/977838976.db2.gz YVEUCQYXZYJHOJ-UHFFFAOYSA-N 2 0 201.273 2.159 20 0 BEADRP FC1CC[NH+](Cc2cc3c[nH+]ccc3[nH]2)CC1 ZINC001232011758 977841780 /nfs/dbraw/zinc/84/17/80/977841780.db2.gz OOOODYDHDPFGMU-UHFFFAOYSA-N 2 0 233.290 2.497 20 0 BEADRP CO[C@H](C)C1C[NH+](Cc2cc3c[nH+]ccc3[nH]2)C1 ZINC001232017194 977846597 /nfs/dbraw/zinc/84/65/97/977846597.db2.gz MQDGGFTYFKZJJY-SNVBAGLBSA-N 2 0 245.326 2.030 20 0 BEADRP C[NH+](C)[C@@H]1CC[C@H]2C[N@H+](Cc3ccoc3)C[C@@H]2C1 ZINC001336889260 978030512 /nfs/dbraw/zinc/03/05/12/978030512.db2.gz QITRCIQNIMPIFD-SOUVJXGZSA-N 2 0 248.370 2.442 20 0 BEADRP CC[C@@H](CNc1cc[nH+]c(C)c1)[NH+]1CCCC1 ZINC001336971088 978091310 /nfs/dbraw/zinc/09/13/10/978091310.db2.gz WXMMESZZNDPKPD-AWEZNQCLSA-N 2 0 233.359 2.098 20 0 BEADRP c1cc(N2CC3(CC[N@H+]3C3CCCC3)C2)cc[nH+]1 ZINC001277693035 978207502 /nfs/dbraw/zinc/20/75/02/978207502.db2.gz CTJOSLQVNSLZFF-UHFFFAOYSA-N 2 0 243.354 2.289 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2C[C@@H](C)C[C@H]2C)CC1 ZINC001179898652 978781651 /nfs/dbraw/zinc/78/16/51/978781651.db2.gz RKRJEWMOMYGVLV-QWHCGFSZSA-N 2 0 224.392 2.449 20 0 BEADRP CCN1CCC[C@H]([NH2+]CC[C@H]2CCCCO2)C1 ZINC001180311046 978855489 /nfs/dbraw/zinc/85/54/89/978855489.db2.gz WPDCZTDOKVJGGY-UONOGXRCSA-N 2 0 240.391 2.020 20 0 BEADRP CC[C@H]1CC[C@H]([NH2+]C[C@@H]2CC[N@H+](C)C2)C1 ZINC000070643336 978861042 /nfs/dbraw/zinc/86/10/42/978861042.db2.gz DBURVKNRIMMDND-AVGNSLFASA-N 2 0 210.365 2.106 20 0 BEADRP CC1=C[C@H](C)[C@H](CN2CC[C@@H]3[NH2+]CC[C@@H]32)CC1 ZINC001235005051 978947658 /nfs/dbraw/zinc/94/76/58/978947658.db2.gz VWBYIUXOKAPWBI-AJNGGQMLSA-N 2 0 234.387 2.415 20 0 BEADRP CCCC[C@@H](CC)CN1CC[C@H]2C[NH2+]C[C@H]21 ZINC001235007482 978950222 /nfs/dbraw/zinc/95/02/22/978950222.db2.gz OUISFNUOCAIFDM-HZSPNIEDSA-N 2 0 224.392 2.497 20 0 BEADRP C1=C[C@@H]2C[C@H]1C[C@H]2C[N@@H+]1CCCC[C@@]12CC[NH2+]C2 ZINC001235124237 978976454 /nfs/dbraw/zinc/97/64/54/978976454.db2.gz LIFMWFYSFIMCAN-FZKCQIBNSA-N 2 0 246.398 2.417 20 0 BEADRP CC1=C[C@@H](C)[C@@H](C[N@@H+]2C[C@@H]3CC[NH2+][C@@H]3C2)CC1 ZINC001235189203 978993200 /nfs/dbraw/zinc/99/32/00/978993200.db2.gz XSGUAPZLSMQTMR-APIJFGDWSA-N 2 0 234.387 2.273 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH+]1CCC([C@H]2CCCC[NH2+]2)CC1 ZINC001235231215 978998252 /nfs/dbraw/zinc/99/82/52/978998252.db2.gz DITYPRZQQJKYQK-BPLDGKMQSA-N 2 0 236.403 2.497 20 0 BEADRP C(C1CC1)[NH+]1CCC([C@H]2CCCC[NH2+]2)CC1 ZINC001235231961 978999648 /nfs/dbraw/zinc/99/96/48/978999648.db2.gz FZMGVBSSACPODO-CQSZACIVSA-N 2 0 222.376 2.251 20 0 BEADRP CC/C=C\CCCCC[N@H+]1C[C@@H]2[C@@H]([NH3+])[C@@H]2C1 ZINC001235211043 979000726 /nfs/dbraw/zinc/00/07/26/979000726.db2.gz TVDSNXMOPJLDKU-YBVSHCEHSA-N 2 0 222.376 2.402 20 0 BEADRP CC(C)=CCC[C@H](C)C[N@H+]1C[C@@H]2[C@H]([NH3+])[C@@H]2C1 ZINC001235284136 979016949 /nfs/dbraw/zinc/01/69/49/979016949.db2.gz UGLNMQLGIGRNLH-FQUUOJAGSA-N 2 0 222.376 2.258 20 0 BEADRP [NH3+][C@H]1[C@H]2C[N@@H+](CCCCCc3ccccc3)C[C@@H]12 ZINC001235282115 979018331 /nfs/dbraw/zinc/01/83/31/979018331.db2.gz AXYWWWAZLVSHCG-MUJYYYPQSA-N 2 0 244.382 2.288 20 0 BEADRP Cc1ccccc1O[C@H]1CC[N@H+](CCCC[NH3+])C1 ZINC001235675022 979111619 /nfs/dbraw/zinc/11/16/19/979111619.db2.gz MRIHHIAMNWVUNX-AWEZNQCLSA-N 2 0 248.370 2.187 20 0 BEADRP C[NH2+]CCC[N@H+](C)C12CC3CC(CC(C3)C1)C2 ZINC001235690060 979118242 /nfs/dbraw/zinc/11/82/42/979118242.db2.gz JUWYMCNXLWGECM-UHFFFAOYSA-N 2 0 236.403 2.497 20 0 BEADRP Cc1ccc(C[N@@H+]2CCCC3(C[NH2+]C3)C2)c(C)c1 ZINC001235710789 979129294 /nfs/dbraw/zinc/12/92/94/979129294.db2.gz FBTJBHVZETZPHT-UHFFFAOYSA-N 2 0 244.382 2.489 20 0 BEADRP [NH3+]CCCC[N@@H+]1CC[C@H]1c1ccccc1 ZINC001235949851 979222481 /nfs/dbraw/zinc/22/24/81/979222481.db2.gz VAWUEZKPAQEHLN-ZDUSSCGKSA-N 2 0 204.317 2.172 20 0 BEADRP CC1(C[N@@H+]2C[C@H]3CC[C@]3([NH3+])C2)CCCCC1 ZINC001235981993 979259892 /nfs/dbraw/zinc/25/98/92/979259892.db2.gz ZUAJVVIGKRLKEA-OCCSQVGLSA-N 2 0 222.376 2.380 20 0 BEADRP CC/C=C\CCC[N@@H+]1CC[C@@H](C[NH2+]C)C1 ZINC001236068296 979358018 /nfs/dbraw/zinc/35/80/18/979358018.db2.gz XQBRMCUKSDFHQY-ZFDPJTLLSA-N 2 0 210.365 2.274 20 0 BEADRP C[C@@H]1CN(Cc2cccc3c2CCCC3)C[C@@H]1[NH3+] ZINC001236092780 979384257 /nfs/dbraw/zinc/38/42/57/979384257.db2.gz CTPZWWRBMCPQRQ-WBMJQRKESA-N 2 0 244.382 2.344 20 0 BEADRP C[N@@H+]1CCC[C@@H](CC[NH2+][C@@H]2C[C@@H]3CCC[C@H]23)C1 ZINC001182250415 979481282 /nfs/dbraw/zinc/48/12/82/979481282.db2.gz JKLBVZIULVVZSE-ZQDZILKHSA-N 2 0 236.403 2.497 20 0 BEADRP Fc1ccc(C[N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)cc1 ZINC001236313948 979524638 /nfs/dbraw/zinc/52/46/38/979524638.db2.gz BHGROPYAJHQEMB-OKILXGFUSA-N 2 0 248.345 2.257 20 0 BEADRP Cc1cccc(C[N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)c1 ZINC001236314449 979525687 /nfs/dbraw/zinc/52/56/87/979525687.db2.gz MXFYHGHAGQNARQ-IYBDPMFKSA-N 2 0 244.382 2.426 20 0 BEADRP C[N@H+](CCC1CCCCC1)[C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001236412492 979587576 /nfs/dbraw/zinc/58/75/76/979587576.db2.gz VQILIPBBQHPTKO-WDNDVIMCSA-N 2 0 222.376 2.106 20 0 BEADRP C[NH+](C)Cc1cccc(-c2cc(N)cc[nH+]2)c1 ZINC001236414562 979588641 /nfs/dbraw/zinc/58/86/41/979588641.db2.gz PBZOZJQGUPWIHM-UHFFFAOYSA-N 2 0 227.311 2.392 20 0 BEADRP CCOC(C)(C)C[N@@H+]1CCCC[C@@](C)(C[NH3+])C1 ZINC001206542352 979651946 /nfs/dbraw/zinc/65/19/46/979651946.db2.gz YZQQYFHYWJVSSI-AWEZNQCLSA-N 2 0 242.407 2.252 20 0 BEADRP C[C@]1(C[NH3+])CCCC[N@H+](CCC(F)(F)F)C1 ZINC001206542349 979655726 /nfs/dbraw/zinc/65/57/26/979655726.db2.gz YTBNZXRKCBHXDY-SNVBAGLBSA-N 2 0 238.297 2.390 20 0 BEADRP CCC(CC)[N@H+](C[C@@H](C)N)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236781974 979730061 /nfs/dbraw/zinc/73/00/61/979730061.db2.gz DBBXKJQGBOXZGE-YRGRVCCFSA-N 2 0 241.423 2.094 20 0 BEADRP C[C@@]1([NH3+])CCC[N@H+](C[C@H]2C[C@H]3C=C[C@@H]2C3)CC1 ZINC001205257230 979755444 /nfs/dbraw/zinc/75/54/44/979755444.db2.gz UQGWMVJBVZGARO-GBJTYRQASA-N 2 0 234.387 2.402 20 0 BEADRP C[C@H]([NH3+])CN(C)Cc1ccc(F)c2cc[nH]c21 ZINC001236909671 979793983 /nfs/dbraw/zinc/79/39/83/979793983.db2.gz VCMJTSTUQFZLJC-VIFPVBQESA-N 2 0 235.306 2.086 20 0 BEADRP C[N@H+](CCCC[NH3+])[C@@H]1CCc2ccccc21 ZINC001237256775 979854922 /nfs/dbraw/zinc/85/49/22/979854922.db2.gz AXPWOSIMCKFOKR-CQSZACIVSA-N 2 0 218.344 2.345 20 0 BEADRP C[N@H+](CCCC[NH3+])[C@H]1CCc2ccccc21 ZINC001237256774 979856285 /nfs/dbraw/zinc/85/62/85/979856285.db2.gz AXPWOSIMCKFOKR-AWEZNQCLSA-N 2 0 218.344 2.345 20 0 BEADRP Cc1cc(C[NH2+]C[C@H]2C[NH+]3CCC2CC3)c(C)o1 ZINC001184135169 979944869 /nfs/dbraw/zinc/94/48/69/979944869.db2.gz LYDOVZFSSQPECA-HNNXBMFYSA-N 2 0 248.370 2.328 20 0 BEADRP C[C@H](CC1CC1)[NH2+]C[C@@H]1C[NH+]2CCC1CC2 ZINC001184134135 979944923 /nfs/dbraw/zinc/94/49/23/979944923.db2.gz AHRHRYGKCMJBFI-BXUZGUMPSA-N 2 0 222.376 2.106 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]C[C@@H]1C[NH+]2CCC1CC2 ZINC001184134138 979945773 /nfs/dbraw/zinc/94/57/73/979945773.db2.gz AHRHRYGKCMJBFI-SMDDNHRTSA-N 2 0 222.376 2.106 20 0 BEADRP C[C@@H]([NH2+]CC1CC[NH+](C)CC1)c1ccc[nH]1 ZINC001342997825 979972304 /nfs/dbraw/zinc/97/23/04/979972304.db2.gz GCSOSDWANKOQHB-LLVKDONJSA-N 2 0 221.348 2.007 20 0 BEADRP C[N@@H+]1CCC2(C1)CC[NH+](CCCCF)CC2 ZINC001278206796 980233525 /nfs/dbraw/zinc/23/35/25/980233525.db2.gz JGRLOAKYAAFKRU-UHFFFAOYSA-N 2 0 228.355 2.154 20 0 BEADRP c1[nH+]cn2cc(C3=CCC[NH2+]CC3)ccc12 ZINC001238940142 980378276 /nfs/dbraw/zinc/37/82/76/980378276.db2.gz NCLZMFAFWYANTH-UHFFFAOYSA-N 2 0 213.284 2.101 20 0 BEADRP [NH3+][C@@H]1CCc2c1cccc2C1=CCC[NH2+]CC1 ZINC001238947308 980386034 /nfs/dbraw/zinc/38/60/34/980386034.db2.gz NKMPVRJQKMEUNW-OAHLLOKOSA-N 2 0 228.339 2.399 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]CCc1ccc(F)cc1F ZINC001345103464 980550817 /nfs/dbraw/zinc/55/08/17/980550817.db2.gz FTGTXSKSUHDADF-JTQLQIEISA-N 2 0 242.313 2.095 20 0 BEADRP [NH3+]C[C@]1(F)CCC[N@H+](C[C@H]2CC=CCC2)CC1 ZINC001205539439 980915142 /nfs/dbraw/zinc/91/51/42/980915142.db2.gz ZDTLOSJQXFDSNE-KBPBESRZSA-N 2 0 240.366 2.496 20 0 BEADRP C[NH+](C)Cc1cccc(-c2cncc(C[NH3+])c2)c1 ZINC001239797268 980935041 /nfs/dbraw/zinc/93/50/41/980935041.db2.gz NJDIUZJSUKVAHB-UHFFFAOYSA-N 2 0 241.338 2.269 20 0 BEADRP [NH3+]Cc1cncc(-c2ccc3c(c2)[C@@H]([NH3+])CC3)c1 ZINC001239809889 980952437 /nfs/dbraw/zinc/95/24/37/980952437.db2.gz ZVEMFUIDKFCUMB-HNNXBMFYSA-N 2 0 239.322 2.153 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H]1CC[C@@H]2[C@H](C1)C2(F)F ZINC001347281705 981031822 /nfs/dbraw/zinc/03/18/22/981031822.db2.gz LDOSIYVQXZFSCS-DAWVFNFOSA-N 2 0 232.318 2.136 20 0 BEADRP COC(C)(C)CC[N@@H+]1CC[C@@H](C)[C@H](C[NH3+])CC1 ZINC001205599917 981152279 /nfs/dbraw/zinc/15/22/79/981152279.db2.gz AMWWIRHSVGSAMJ-OLZOCXBDSA-N 2 0 242.407 2.108 20 0 BEADRP CC(C)CC[N@@H+]1CC[C@@H](C)[C@@H](C[NH3+])CC1 ZINC001205601376 981160916 /nfs/dbraw/zinc/16/09/16/981160916.db2.gz DYELBMKBBNTSGJ-CHWSQXEVSA-N 2 0 212.381 2.339 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@@H](C[NH3+])[C@@H](C)CC2)o1 ZINC001205604818 981180456 /nfs/dbraw/zinc/18/04/56/981180456.db2.gz XUUMHOKJVIUUML-AAEUAGOBSA-N 2 0 236.359 2.395 20 0 BEADRP Nc1cc[nH+]c2cc(C3=CC[NH2+]CC3)ccc12 ZINC001240468286 981402905 /nfs/dbraw/zinc/40/29/05/981402905.db2.gz DSCYIIGYSKGDIO-UHFFFAOYSA-N 2 0 225.295 2.194 20 0 BEADRP CC[NH+](CC)Cc1cncc(C2=CC[NH2+]CC2)c1 ZINC001240468214 981403800 /nfs/dbraw/zinc/40/38/00/981403800.db2.gz BSYLOWJFUBKFBY-UHFFFAOYSA-N 2 0 245.370 2.300 20 0 BEADRP C[N@@H+]1CCc2cc(C3=CC[NH2+]CC3)ccc2C1 ZINC001240469440 981405312 /nfs/dbraw/zinc/40/53/12/981405312.db2.gz YSRMQDQTGOCCFX-UHFFFAOYSA-N 2 0 228.339 2.051 20 0 BEADRP C[C@@H]([NH3+])c1ccccc1C1=CC[NH2+]CC1 ZINC001240469964 981407469 /nfs/dbraw/zinc/40/74/69/981407469.db2.gz HPMCGLIRKZHZRN-SNVBAGLBSA-N 2 0 202.301 2.083 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@@H](C)CC(C)(C)C ZINC001348853680 981459841 /nfs/dbraw/zinc/45/98/41/981459841.db2.gz URSMHWGEPCZUFK-QWRGUYRKSA-N 2 0 200.370 2.399 20 0 BEADRP C[N@H+](Cc1ccc(C2=CCC[NH2+]C2)nc1)C1CC1 ZINC001240656465 981567311 /nfs/dbraw/zinc/56/73/11/981567311.db2.gz AKWNPASMIQRTGF-UHFFFAOYSA-N 2 0 243.354 2.053 20 0 BEADRP C[NH+](C)Cc1ccccc1C1=CCC[NH2+]C1 ZINC001240658700 981567790 /nfs/dbraw/zinc/56/77/90/981567790.db2.gz GZGXZVODUBVHMA-UHFFFAOYSA-N 2 0 216.328 2.125 20 0 BEADRP c1cc([C@H]2CC[NH2+]C2)ccc1C1=CCC[NH2+]C1 ZINC001240670782 981579470 /nfs/dbraw/zinc/57/94/70/981579470.db2.gz NVISVMPODOJMPX-HNNXBMFYSA-N 2 0 228.339 2.140 20 0 BEADRP [NH3+][C@@H]1CCc2c1cccc2C1=CCC[NH2+]C1 ZINC001240670043 981581059 /nfs/dbraw/zinc/58/10/59/981581059.db2.gz CVJUZPNEWMUXJF-CQSZACIVSA-N 2 0 214.312 2.009 20 0 BEADRP [NH3+][C@@H]1CCc2ccc(C3=CCC[NH2+]C3)cc21 ZINC001240671380 981582978 /nfs/dbraw/zinc/58/29/78/981582978.db2.gz ULFRDSJLUDIMPH-CQSZACIVSA-N 2 0 214.312 2.009 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]Cc2cccn2C2CC2)C1 ZINC001349877261 981801297 /nfs/dbraw/zinc/80/12/97/981801297.db2.gz DLTDDFKSRSZJCM-JNSHFYNHSA-N 2 0 247.386 2.253 20 0 BEADRP Cc1ccccc1NC(=[NH2+])NCC[N@@H+](C)C(C)C ZINC001349912076 981812545 /nfs/dbraw/zinc/81/25/45/981812545.db2.gz UECSMJSNLVZQNS-UHFFFAOYSA-N 2 0 248.374 2.271 20 0 BEADRP C(c1ccc([C@@H]2CCC[NH2+]2)cn1)=C1CC[NH2+]CC1 ZINC001240873342 981914338 /nfs/dbraw/zinc/91/43/38/981914338.db2.gz AZCSBCIBMJWUSL-HNNXBMFYSA-N 2 0 243.354 2.273 20 0 BEADRP C(c1ccc2c(c1)C[NH2+]CC2)=C1CC[NH2+]CC1 ZINC001240876375 981925788 /nfs/dbraw/zinc/92/57/88/981925788.db2.gz YGDVRTNVWDOHPP-UHFFFAOYSA-N 2 0 228.339 2.099 20 0 BEADRP C[C@@H]([NH3+])c1ccc(C=C2CC[NH2+]CC2)cc1 ZINC001240877445 981929766 /nfs/dbraw/zinc/92/97/66/981929766.db2.gz VKBFFOPZOYYCQF-LLVKDONJSA-N 2 0 216.328 2.473 20 0 BEADRP C[C@@H]([NH3+])c1cccc(C=C2CC[NH2+]CC2)c1 ZINC001240878812 981932268 /nfs/dbraw/zinc/93/22/68/981932268.db2.gz OOEUWWAECUFDDC-LLVKDONJSA-N 2 0 216.328 2.473 20 0 BEADRP C[C@@H]1[C@H]2CC[C@@H](C[C@@H]1[NH2+][C@H]1CCC[C@H](F)C1)[NH2+]2 ZINC001350959278 982139552 /nfs/dbraw/zinc/13/95/52/982139552.db2.gz XNODQIRSFIWCIY-WFQJECDVSA-N 2 0 240.366 2.386 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H](C)Cc1ccc(F)cc1 ZINC001326035820 982374257 /nfs/dbraw/zinc/37/42/57/982374257.db2.gz BTUAZUIIRJUTHN-VXGBXAGGSA-N 2 0 238.350 2.344 20 0 BEADRP C[C@@H]([NH3+])c1ccc(C2=CC[N@H+](C)CC2)cc1 ZINC001241327144 982489424 /nfs/dbraw/zinc/48/94/24/982489424.db2.gz IAFRVPLXWVKFTQ-LLVKDONJSA-N 2 0 216.328 2.425 20 0 BEADRP CC[C@@H](C)[C@H](C)[N@@H+]1C[C@H]2CN(C)C[C@@]2(C)C1 ZINC001198271598 982688946 /nfs/dbraw/zinc/68/89/46/982688946.db2.gz WYVCKAZKYCUFNZ-RQJABVFESA-N 2 0 224.392 2.305 20 0 BEADRP C[C@H]([NH3+])c1cccc(C2=CCC[N@H+](C)C2)c1 ZINC001241570735 982821938 /nfs/dbraw/zinc/82/19/38/982821938.db2.gz OCEPQELISFDSRF-NSHDSACASA-N 2 0 216.328 2.425 20 0 BEADRP C1=CC[C@@H](C[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)CC1 ZINC000037408318 982938573 /nfs/dbraw/zinc/93/85/73/982938573.db2.gz LKDBLTXRTTVDRA-ZIAGYGMSSA-N 2 0 234.387 2.417 20 0 BEADRP CC[N@@H+]1C[C@H](C)N(c2cc[nH+]cc2)C[C@H]1C ZINC001354019628 983117136 /nfs/dbraw/zinc/11/71/36/983117136.db2.gz UBOVYSZGSRIGEY-NEPJUHHUSA-N 2 0 219.332 2.001 20 0 BEADRP C[NH+](C)C[C@@]12C[C@@H]1C[N@H+](C[C@@H]1CC=CCC1)C2 ZINC001201426302 983226501 /nfs/dbraw/zinc/22/65/01/983226501.db2.gz CUQSANQMDYCELT-RBSFLKMASA-N 2 0 234.387 2.226 20 0 BEADRP Nc1[nH]c2ccc(C3=C[C@H]4CC[C@@H](C3)[NH2+]4)cc2[nH+]1 ZINC001242025924 983237126 /nfs/dbraw/zinc/23/71/26/983237126.db2.gz BWTZALSNCJNLDS-MNOVXSKESA-N 2 0 240.310 2.053 20 0 BEADRP CCC[NH+]1C[C@@H]2C[NH+](CC(C)(C)C)C[C@H]2C1 ZINC001201441372 983243056 /nfs/dbraw/zinc/24/30/56/983243056.db2.gz CSEHLXVUYCDJJD-CHWSQXEVSA-N 2 0 224.392 2.306 20 0 BEADRP CCC[NH+]1C[C@@H]2C[NH+](C[C@H](C)CC)C[C@H]2C1 ZINC001201516848 983314462 /nfs/dbraw/zinc/31/44/62/983314462.db2.gz DMKPZFXLMQXTJJ-MGPQQGTHSA-N 2 0 224.392 2.306 20 0 BEADRP CC[NH+]1C[C@@H]2C[NH+](CCc3ccccc3)C[C@H]2C1 ZINC001201609536 983371825 /nfs/dbraw/zinc/37/18/25/983371825.db2.gz GKOSGZYDNOUMJA-HZPDHXFCSA-N 2 0 244.382 2.113 20 0 BEADRP CN1CCC[C@@H]2C[N@H+](CCc3ccccc3)C[C@@H]21 ZINC001201606092 983375470 /nfs/dbraw/zinc/37/54/70/983375470.db2.gz IJZYYHDXBSEGEN-CVEARBPZSA-N 2 0 244.382 2.255 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C[C@@H]2CC[N@H+](C)C2)C[C@@H]1C ZINC000082836862 983384088 /nfs/dbraw/zinc/38/40/88/983384088.db2.gz LXQXEXNCOGRKQX-ZOBORPQBSA-N 2 0 224.392 2.352 20 0 BEADRP CCCC[NH+]1C[C@H]2C[NH+](CCC)C[C@@H]2C1 ZINC001201717227 983423598 /nfs/dbraw/zinc/42/35/98/983423598.db2.gz GUDVYAPPAJVZHF-CHWSQXEVSA-N 2 0 210.365 2.060 20 0 BEADRP CCCCC[NH+]1CCC2(C[NH+](C)C2)CC1 ZINC001201737142 983444588 /nfs/dbraw/zinc/44/45/88/983444588.db2.gz DGFWSCNPKAWUSJ-UHFFFAOYSA-N 2 0 210.365 2.204 20 0 BEADRP CCCCCC[NH+]1C[C@H]2C[NH+](CC)C[C@@H]2C1 ZINC001201756312 983458638 /nfs/dbraw/zinc/45/86/38/983458638.db2.gz IHDYSOVHQQNHHG-ZIAGYGMSSA-N 2 0 224.392 2.450 20 0 BEADRP Cc1cnccc1O[C@H]1CC[N@H+](CC2CC2)C1 ZINC001201952032 983520431 /nfs/dbraw/zinc/52/04/31/983520431.db2.gz GBPDSGOBESXJGX-ZDUSSCGKSA-N 2 0 232.327 2.253 20 0 BEADRP CC[N@H+]1C[C@@H]2C[NH+](CC3CCCC3)C[C@@H]2C1 ZINC001202190305 983593674 /nfs/dbraw/zinc/59/36/74/983593674.db2.gz NUDUMSVKVOOYBV-OKILXGFUSA-N 2 0 222.376 2.060 20 0 BEADRP Cc1c(N)cc[nH+]c1-c1ccc2c(c1)C[NH2+]C2 ZINC001242673548 984041665 /nfs/dbraw/zinc/04/16/65/984041665.db2.gz GKSHKOUEZFKIGM-UHFFFAOYSA-N 2 0 225.295 2.242 20 0 BEADRP C[C@@H]1C[N@H+](Cc2ccccc2)CCC[C@H]1C[NH3+] ZINC001205985219 984301071 /nfs/dbraw/zinc/30/10/71/984301071.db2.gz WODXCDNADFUUSF-HIFRSBDPSA-N 2 0 232.371 2.493 20 0 BEADRP C[NH2+]Cc1ccc(-c2cc(N)c(C)c[nH+]2)cc1 ZINC001242990672 984353041 /nfs/dbraw/zinc/35/30/41/984353041.db2.gz QYKASDLCDHZGPG-UHFFFAOYSA-N 2 0 227.311 2.359 20 0 BEADRP C[NH2+]Cc1cccc(-c2[nH+]ccc3c2CCN3)c1 ZINC001242995279 984358434 /nfs/dbraw/zinc/35/84/34/984358434.db2.gz JFZYBYJEGWVWTI-UHFFFAOYSA-N 2 0 239.322 2.436 20 0 BEADRP [NH3+]CC1CC[NH+]([C@@H]2C[C@@H]2c2cccc(F)c2)CC1 ZINC001580265436 984483007 /nfs/dbraw/zinc/48/30/07/984483007.db2.gz IUEAAJJSLCGMAK-HUUCEWRRSA-N 2 0 248.345 2.352 20 0 BEADRP C[NH2+][C@@]12CC[C@@]([NH2+]CC3CC3)(C1)CCC2 ZINC001275137197 984504207 /nfs/dbraw/zinc/50/42/07/984504207.db2.gz RSRABEJXLGKWKR-QWHCGFSZSA-N 2 0 208.349 2.051 20 0 BEADRP Fc1cc(C2=CC[NH2+]C2)ccc1[C@@H]1CCC[NH2+]1 ZINC001243111518 984575034 /nfs/dbraw/zinc/57/50/34/984575034.db2.gz QOSDFRCRDVIHAP-AWEZNQCLSA-N 2 0 232.302 2.237 20 0 BEADRP C1=C(c2ccc(C[NH+]3CCCC3)cc2)C[NH2+]C1 ZINC001243112497 984581251 /nfs/dbraw/zinc/58/12/51/984581251.db2.gz ZHBOQTPFHAZNFG-UHFFFAOYSA-N 2 0 228.339 2.269 20 0 BEADRP C[N@@H+]1CCC2(C1)CC[NH+](Cc1ccoc1)CC2 ZINC001275944004 984740108 /nfs/dbraw/zinc/74/01/08/984740108.db2.gz XCCOWFKGJFMSAH-UHFFFAOYSA-N 2 0 234.343 2.197 20 0 BEADRP C[C@H](Cc1ccncc1)[NH2+]CC(C)(C)C[NH+](C)C ZINC001256723544 984765048 /nfs/dbraw/zinc/76/50/48/984765048.db2.gz WBBSPJUBSHXTAI-CYBMUJFWSA-N 2 0 249.402 2.190 20 0 BEADRP CCC(CC)[NH2+]C(C)(C)CC[NH+](C)C ZINC001257290310 984870675 /nfs/dbraw/zinc/87/06/75/984870675.db2.gz RYBFDZBMGQTUCH-UHFFFAOYSA-N 2 0 200.370 2.495 20 0 BEADRP CCn1ccc(C[N@H+](C)C[C@@H](C[NH3+])C(C)C)c1 ZINC001578350434 984984619 /nfs/dbraw/zinc/98/46/19/984984619.db2.gz OSOWZDPJWPZOTA-CQSZACIVSA-N 2 0 237.391 2.171 20 0 BEADRP CCC[C@@H](C)CC[C@H](C)[NH2+]CCOCC[NH3+] ZINC001257469079 985088706 /nfs/dbraw/zinc/08/87/06/985088706.db2.gz SVQOTNOUCGPAJQ-OLZOCXBDSA-N 2 0 230.396 2.156 20 0 BEADRP C[N@H+](CCC[NH3+])[C@@H]1CCC[C@H]1C(C)(C)C ZINC001578466476 985098903 /nfs/dbraw/zinc/09/89/03/985098903.db2.gz OERWNFQHXZDKSS-VXGBXAGGSA-N 2 0 212.381 2.482 20 0 BEADRP CCCCC[C@H](C)[N@H+]1C[C@H]2C[NH+](C)C[C@H]2C1 ZINC001257517322 985191301 /nfs/dbraw/zinc/19/13/01/985191301.db2.gz UVRABRFMNCFKEI-MELADBBJSA-N 2 0 224.392 2.449 20 0 BEADRP C[NH2+]C[C@@H](C)[NH2+]CC1(CCOC)CCCCC1 ZINC001578638352 985248162 /nfs/dbraw/zinc/24/81/62/985248162.db2.gz LVXQUPRXGYMFDO-CYBMUJFWSA-N 2 0 242.407 2.171 20 0 BEADRP CNc1ccc(C)cc1C[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC001578757611 985326890 /nfs/dbraw/zinc/32/68/90/985326890.db2.gz UUDQPNOPIMLVDT-RYUDHWBXSA-N 2 0 235.375 2.252 20 0 BEADRP CC(C)C[C@@H](C)C[C@H](C)[NH2+]CCOCC[NH3+] ZINC001258054408 985356624 /nfs/dbraw/zinc/35/66/24/985356624.db2.gz COFHZKFJBRPKOZ-OLZOCXBDSA-N 2 0 230.396 2.012 20 0 BEADRP CCC[N@H+](C)Cc1cc2c(s1)CC[NH2+]C2 ZINC000688037645 985509141 /nfs/dbraw/zinc/50/91/41/985509141.db2.gz CSGWFRKCILJRSR-UHFFFAOYSA-N 2 0 224.373 2.236 20 0 BEADRP CO[C@@H]1CCC[C@@H]([NH2+]CCCCCC[NH3+])CC1 ZINC001578938376 985556031 /nfs/dbraw/zinc/55/60/31/985556031.db2.gz SKMXMHJTHBKNQM-ZIAGYGMSSA-N 2 0 242.407 2.443 20 0 BEADRP C[C@H](Cc1ccco1)[NH2+]CC12CC[NH+](CC1)CC2 ZINC001258177530 985572825 /nfs/dbraw/zinc/57/28/25/985572825.db2.gz XNAXWWKMNIMOJU-CYBMUJFWSA-N 2 0 248.370 2.286 20 0 BEADRP [NH3+]CCc1ccc(/C=C/C2CC[NH2+]CC2)cc1 ZINC001243897805 985589210 /nfs/dbraw/zinc/58/92/10/985589210.db2.gz VOTNYYWUCLCJTP-ZZXKWVIFSA-N 2 0 230.355 2.201 20 0 BEADRP COCC1(C[NH2+]Cc2cccc(C[NH3+])c2)CCC1 ZINC001578982795 985603722 /nfs/dbraw/zinc/60/37/22/985603722.db2.gz GLLVZADBKINTHN-UHFFFAOYSA-N 2 0 248.370 2.052 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@@H+]1CCC[C@H]1C1CCC1 ZINC000688287013 985607007 /nfs/dbraw/zinc/60/70/07/985607007.db2.gz BHKDOOPHPXUONQ-XBFCOCLRSA-N 2 0 222.376 2.106 20 0 BEADRP CSCC[C@H](C)[NH2+]C(C)(C)C(C)(C)[NH3+] ZINC001258207782 985630986 /nfs/dbraw/zinc/63/09/86/985630986.db2.gz JEQGUBRBZODAGT-VIFPVBQESA-N 2 0 218.410 2.234 20 0 BEADRP COCC[C@@H]([NH3+])C[NH2+][C@H](C)CCC=C(C)C ZINC001579001079 985648731 /nfs/dbraw/zinc/64/87/31/985648731.db2.gz FMEDIQYITMIAPP-CHWSQXEVSA-N 2 0 228.380 2.075 20 0 BEADRP C[C@H]([NH3+])c1cccc(C2=C[NH2+]CCC2)c1 ZINC001243951403 985654761 /nfs/dbraw/zinc/65/47/61/985654761.db2.gz GJGCHXSGTANVTD-JTQLQIEISA-N 2 0 202.301 2.431 20 0 BEADRP CC[C@@H](CC(F)F)C[N@@H+]1CCC[C@H](C[NH3+])C1 ZINC000688760804 985719402 /nfs/dbraw/zinc/71/94/02/985719402.db2.gz LUMZCBBJCPFYJO-WDEREUQCSA-N 2 0 234.334 2.339 20 0 BEADRP COc1cc(C[NH2+][C@H]2CC[C@H]([NH3+])CC2)ccc1C ZINC001579154181 985815932 /nfs/dbraw/zinc/81/59/32/985815932.db2.gz WQPDABGNZILYBD-HDJSIYSDSA-N 2 0 248.370 2.363 20 0 BEADRP C[C@@H]([NH2+]C[C@]12C[C@H]1C[NH2+]C2)c1cccs1 ZINC001579415031 985885505 /nfs/dbraw/zinc/88/55/05/985885505.db2.gz XNBODPNVTVOZMQ-JFGNBEQYSA-N 2 0 222.357 2.008 20 0 BEADRP C[C@@H](CC1CC1)[NH+]1CCN(c2cc[nH+]cc2)CC1 ZINC001258458298 985906142 /nfs/dbraw/zinc/90/61/42/985906142.db2.gz RZFHUULUVAGQOB-ZDUSSCGKSA-N 2 0 245.370 2.392 20 0 BEADRP Cc1cc(C)cc(CC[NH2+]CC(C)(C)[NH3+])c1 ZINC001579579553 986093028 /nfs/dbraw/zinc/09/30/28/986093028.db2.gz HQPQDWNONGMFEI-UHFFFAOYSA-N 2 0 220.360 2.173 20 0 BEADRP CCCC[C@H](CCC)[N@@H+]1CCO[C@@H](C[NH3+])C1 ZINC001258752890 986114647 /nfs/dbraw/zinc/11/46/47/986114647.db2.gz NAQIJATZUGLOLU-STQMWFEESA-N 2 0 228.380 2.005 20 0 BEADRP Cc1cccc(C[C@H](C)[NH2+][C@H]2C[C@@H]([NH3+])C2)c1 ZINC001579759605 986208460 /nfs/dbraw/zinc/20/84/60/986208460.db2.gz PGOYOPYPOPHXDD-FPMFFAJLSA-N 2 0 218.344 2.005 20 0 BEADRP CC[C@H]1CC[N@H+](CC2CC[NH+](CC)CC2)C1 ZINC001461887232 986215123 /nfs/dbraw/zinc/21/51/23/986215123.db2.gz UBOKANDDMXFNEL-ZDUSSCGKSA-N 2 0 224.392 2.450 20 0 BEADRP Cc1cccc(C[NH2+]CC2=CC[NH2+]CC2)c1F ZINC001579761304 986216789 /nfs/dbraw/zinc/21/67/89/986216789.db2.gz YUECSAHHQYOBNF-UHFFFAOYSA-N 2 0 234.318 2.143 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2CC[C@@H](C)[C@H]2C)CC1 ZINC001461886959 986218013 /nfs/dbraw/zinc/21/80/13/986218013.db2.gz KMHMGFYPKRRJGE-CHWSQXEVSA-N 2 0 224.392 2.449 20 0 BEADRP Cc1cc[nH+]c(NC2CC(C[NH3+])C2)c1C1CC1 ZINC001579813316 986236517 /nfs/dbraw/zinc/23/65/17/986236517.db2.gz UGMYRQZEEZRUGI-UHFFFAOYSA-N 2 0 231.343 2.417 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2CCCSCC2)CC1 ZINC001462068950 986275807 /nfs/dbraw/zinc/27/58/07/986275807.db2.gz DDBJTBCEEWQMDH-UHFFFAOYSA-N 2 0 242.432 2.157 20 0 BEADRP CC[C@H]1C[N@H+](CCCCCC[NH3+])C[C@@H](C)O1 ZINC000689190733 986384187 /nfs/dbraw/zinc/38/41/87/986384187.db2.gz MUTHBKLIEHYMGQ-OLZOCXBDSA-N 2 0 228.380 2.005 20 0 BEADRP FC1(F)CC[C@@H](CC[NH2+]C[C@@H]2CCC[NH2+]C2)C1 ZINC001580023857 986417283 /nfs/dbraw/zinc/41/72/83/986417283.db2.gz IHIWJKHBRNGZRG-NWDGAFQWSA-N 2 0 246.345 2.401 20 0 BEADRP Fc1ccc(C2([NH2+]CC[C@H]3CC[NH2+]C3)CC2)cc1 ZINC001580029465 986429927 /nfs/dbraw/zinc/42/99/27/986429927.db2.gz TVYVEZDFVVMKKS-GFCCVEGCSA-N 2 0 248.345 2.404 20 0 BEADRP CC1CCC([NH2+]C[C@@H]2C[NH+]3CCC2CC3)CC1 ZINC001462638657 986466434 /nfs/dbraw/zinc/46/64/34/986466434.db2.gz YRZQWSTVCCLUOF-HNFVBEJKSA-N 2 0 236.403 2.497 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]C[C@H]1CCC=CO1 ZINC001462672622 986505777 /nfs/dbraw/zinc/50/57/77/986505777.db2.gz KPWLWWQZVCXEDQ-ZIAGYGMSSA-N 2 0 240.391 2.389 20 0 BEADRP CC1(C)CC([NH3+])CC(C)(C)[NH+]1[C@H]1CCCOC1 ZINC001254367616 986592878 /nfs/dbraw/zinc/59/28/78/986592878.db2.gz KPVRZBQLAOGIGB-LBPRGKRZSA-N 2 0 240.391 2.146 20 0 BEADRP CC(C)[N@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@@H]1CCCOC1 ZINC001254372167 986594597 /nfs/dbraw/zinc/59/45/97/986594597.db2.gz RBELWCUJZGMXPX-MGPQQGTHSA-N 2 0 240.391 2.146 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCCOC1)CC(C)(C)CC[NH3+] ZINC001254369909 986601111 /nfs/dbraw/zinc/60/11/11/986601111.db2.gz MDIRYJXEFLPRHR-STQMWFEESA-N 2 0 242.407 2.156 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH+]2CC3(C2)CCCC3)CC1 ZINC001254519767 986657955 /nfs/dbraw/zinc/65/79/55/986657955.db2.gz KIGPHJMSGRGHMU-CYBMUJFWSA-N 2 0 222.376 2.347 20 0 BEADRP [NH3+]CC1(C[NH2+]CC2CCC=CCC2)CCC1 ZINC001580243495 986695519 /nfs/dbraw/zinc/69/55/19/986695519.db2.gz IPYYAZIZHCSGIN-UHFFFAOYSA-N 2 0 222.376 2.451 20 0 BEADRP [NH3+]CC1CC([NH2+]C[C@@H]2CC3CCC2CC3)C1 ZINC001580256012 986708409 /nfs/dbraw/zinc/70/84/09/986708409.db2.gz PDYGEUBGJMOEJY-PRTVBDMESA-N 2 0 222.376 2.140 20 0 BEADRP [NH3+]C/C=C\C[NH2+]C1CC(Sc2ccccc2)C1 ZINC001580280213 986729166 /nfs/dbraw/zinc/72/91/66/986729166.db2.gz AGXLLYMQHNNKME-PLNGDYQASA-N 2 0 248.395 2.414 20 0 BEADRP [NH3+]CC[C@@H]1CC[N@H+](C[C@H]2C[C@H]2c2ccccc2)C1 ZINC001580288771 986732530 /nfs/dbraw/zinc/73/25/30/986732530.db2.gz XMZPOFUAJMLHHK-BMFZPTHFSA-N 2 0 244.382 2.461 20 0 BEADRP [NH3+]CC[C@H]1CCCC[N@@H+]1CC1CCSCC1 ZINC001580286309 986734482 /nfs/dbraw/zinc/73/44/82/986734482.db2.gz CKEZVBDIUUKMDR-CYBMUJFWSA-N 2 0 242.432 2.333 20 0 BEADRP [NH3+]CCC[NH2+]Cc1c(Cl)ccc2cccnc21 ZINC001580298685 986735566 /nfs/dbraw/zinc/73/55/66/986735566.db2.gz XECJSDYERZRTSM-UHFFFAOYSA-N 2 0 249.745 2.327 20 0 BEADRP [NH3+]CCCCCC[NH2+]C[C@H]1CC1(Cl)Cl ZINC001580293270 986738653 /nfs/dbraw/zinc/73/86/53/986738653.db2.gz KKZFWDPTOMRDEN-SECBINFHSA-N 2 0 239.190 2.289 20 0 BEADRP [NH3+]CCCCCC[NH2+]C1([C@@H]2CCCCO2)CC1 ZINC001580293356 986738847 /nfs/dbraw/zinc/73/88/47/986738847.db2.gz URNVGEKIOJFYAI-ZDUSSCGKSA-N 2 0 240.391 2.197 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[N@@H+]2CCCC[C@@H]2c2cc[nH]n2)C1 ZINC001580387088 986812735 /nfs/dbraw/zinc/81/27/35/986812735.db2.gz KFFOHIZGWYOYLL-OUCADQQQSA-N 2 0 248.374 2.064 20 0 BEADRP C[NH+](C)Cc1ccc(-c2ccncc2C[NH3+])cc1 ZINC001245556944 986942668 /nfs/dbraw/zinc/94/26/68/986942668.db2.gz CAYJMOXNLQOQPU-UHFFFAOYSA-N 2 0 241.338 2.269 20 0 BEADRP CC(C)([NH3+])c1cccc(-c2ccncc2C[NH3+])c1 ZINC001245559901 986953512 /nfs/dbraw/zinc/95/35/12/986953512.db2.gz IMVOYZQAZPTSQV-UHFFFAOYSA-N 2 0 241.338 2.401 20 0 BEADRP COC[C@@H](C)[N@H+](CC(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001255565419 987017432 /nfs/dbraw/zinc/01/74/32/987017432.db2.gz PNOKCRWCWWEIIG-MGPQQGTHSA-N 2 0 242.407 2.249 20 0 BEADRP C[C@@H](Cc1ccccc1F)[NH2+][C@@H]1CCC[C@@H]1[NH3+] ZINC001255841784 987074810 /nfs/dbraw/zinc/07/48/10/987074810.db2.gz KLHFRJCLWVYOIJ-LEWSCRJBSA-N 2 0 236.334 2.226 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]C[C@H]1CCCOC1 ZINC001255944789 987078186 /nfs/dbraw/zinc/07/81/86/987078186.db2.gz ZKJGBSHJHYWLJR-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]C[C@H]1CCCOC1 ZINC001255944792 987078850 /nfs/dbraw/zinc/07/88/50/987078850.db2.gz ZKJGBSHJHYWLJR-ZIAGYGMSSA-N 2 0 242.407 2.123 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]C(C)(C)CC(C)=O ZINC001255950002 987093900 /nfs/dbraw/zinc/09/39/00/987093900.db2.gz DWQZRSDJXUVITH-GFCCVEGCSA-N 2 0 242.407 2.454 20 0 BEADRP Nc1[nH]c2ccc(-c3ccc4c[nH+]cn4c3)cc2[nH+]1 ZINC001245896225 987116476 /nfs/dbraw/zinc/11/64/76/987116476.db2.gz NDENTHGGJPCREE-UHFFFAOYSA-N 2 0 249.277 2.460 20 0 BEADRP CC(C)([NH3+])c1ccc(-c2cccc(C[NH3+])n2)cc1 ZINC001245908563 987135943 /nfs/dbraw/zinc/13/59/43/987135943.db2.gz VSGMWSCPIQKRTC-UHFFFAOYSA-N 2 0 241.338 2.401 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CC[N@H+](C[C@@H]2CC3CCC2CC3)C1 ZINC000691657813 987288302 /nfs/dbraw/zinc/28/83/02/987288302.db2.gz AIQKXNBCFRNUME-RYKAKRHSSA-N 2 0 236.403 2.482 20 0 BEADRP [NH3+]C1(C[NH2+][C@H]2CCCC[C@@H]2C2CC2)CC1 ZINC000695988521 987337685 /nfs/dbraw/zinc/33/76/85/987337685.db2.gz SUTJKBLPCBWVST-NEPJUHHUSA-N 2 0 208.349 2.036 20 0 BEADRP C[C@@H]1SCC[N@H+](C[C@H]2CCCC[NH2+]C2)[C@H]1C ZINC000697058709 987346474 /nfs/dbraw/zinc/34/64/74/987346474.db2.gz TYRWPJPVOHUGDB-AVGNSLFASA-N 2 0 242.432 2.202 20 0 BEADRP CC(C)[N@H+](CC1CC1)C[C@@H]1CCCC[NH2+]C1 ZINC000697054077 987346781 /nfs/dbraw/zinc/34/67/81/987346781.db2.gz ZXRVODIFAAVVOS-CQSZACIVSA-N 2 0 224.392 2.497 20 0 BEADRP CC1(C)C[N@H+](C[C@@H]2CCCC[NH2+]C2)CCS1 ZINC000697054712 987346798 /nfs/dbraw/zinc/34/67/98/987346798.db2.gz DSPWJTZBILRIJP-GFCCVEGCSA-N 2 0 242.432 2.204 20 0 BEADRP CC[C@H]1C[N@H+](C[C@@H]2CCCC[NH2+]C2)CCS1 ZINC000697054784 987347773 /nfs/dbraw/zinc/34/77/73/987347773.db2.gz FZCGTSYJMJSPRA-OLZOCXBDSA-N 2 0 242.432 2.204 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCC[C@H]2C)CC[NH2+]1 ZINC001246066971 987354196 /nfs/dbraw/zinc/35/41/96/987354196.db2.gz SQSCZDJTWXXKFS-FVCCEPFGSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H]1C[C@H]([NH2+]C2(C)CCCCC2)CC[NH2+]1 ZINC001246080746 987376252 /nfs/dbraw/zinc/37/62/52/987376252.db2.gz JQASRWZKMWPGNU-NWDGAFQWSA-N 2 0 210.365 2.439 20 0 BEADRP [NH3+]CCc1cn([C@H]2CCC[NH2+]C2)c2ccccc12 ZINC001246082219 987378715 /nfs/dbraw/zinc/37/87/15/987378715.db2.gz OBAGEYKQWFDDQF-ZDUSSCGKSA-N 2 0 243.354 2.067 20 0 BEADRP C[C@@H]1CC[C@@H](n2ccc3cc(C[NH3+])ccc32)C[NH2+]1 ZINC001246085396 987385959 /nfs/dbraw/zinc/38/59/59/987385959.db2.gz QPKAFUUDYXSVGS-BXUZGUMPSA-N 2 0 243.354 2.413 20 0 BEADRP CC[C@H](C)OCC[C@H](C)[NH2+][C@H]1CCCC[NH2+]C1 ZINC001246089918 987392672 /nfs/dbraw/zinc/39/26/72/987392672.db2.gz HSSDPYFAKQWJQJ-IHRRRGAJSA-N 2 0 242.407 2.312 20 0 BEADRP C[C@@H]1CC[C@@H](C[NH2+][C@H]2C[C@@H]3[C@H](C2)C3(C)C)C[NH2+]1 ZINC001246098916 987415819 /nfs/dbraw/zinc/41/58/19/987415819.db2.gz QKGVTEMIRQWZTH-XGFWRYKXSA-N 2 0 236.403 2.399 20 0 BEADRP CC(C)OCC[C@@H](C)[NH2+]C[C@@H]1CC[C@@H](C)[NH2+]C1 ZINC001246099480 987418792 /nfs/dbraw/zinc/41/87/92/987418792.db2.gz RHGASAOGDHHTSH-MGPQQGTHSA-N 2 0 242.407 2.168 20 0 BEADRP CC(C)OCC[C@@H](C)[NH2+]C[C@H]1CC[C@H](C)[NH2+]C1 ZINC001246099482 987418919 /nfs/dbraw/zinc/41/89/19/987418919.db2.gz RHGASAOGDHHTSH-MJBXVCDLSA-N 2 0 242.407 2.168 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]C[C@H]2C[NH2+]C[C@@H](C)C2)C1 ZINC001246102101 987425525 /nfs/dbraw/zinc/42/55/25/987425525.db2.gz QZTDYYDAFKHJKH-XJFOESAGSA-N 2 0 224.392 2.400 20 0 BEADRP CSCC[C@H](C)[NH2+]C[C@H]1CC[C@@H](C)C[NH2+]1 ZINC001246105082 987434882 /nfs/dbraw/zinc/43/48/82/987434882.db2.gz LPXKMCODMYXWNF-GRYCIOLGSA-N 2 0 230.421 2.106 20 0 BEADRP C[C@H]1CC[C@@H](n2cc(C[NH3+])c3ccccc32)C[NH2+]1 ZINC001246109279 987440426 /nfs/dbraw/zinc/44/04/26/987440426.db2.gz NDQNMEDHIDIKDG-WCQYABFASA-N 2 0 243.354 2.413 20 0 BEADRP C[C@@H]1C[C@H](n2ccc3c2cccc3C[NH3+])CC[NH2+]1 ZINC001246112165 987445937 /nfs/dbraw/zinc/44/59/37/987445937.db2.gz DCIUVSORTNRWRS-DGCLKSJQSA-N 2 0 243.354 2.413 20 0 BEADRP CCSC[C@H](C)[NH2+]C[C@@H]1CCC[NH2+][C@@H]1C ZINC001246110515 987446232 /nfs/dbraw/zinc/44/62/32/987446232.db2.gz MCIWCYISKJMUIW-TUAOUCFPSA-N 2 0 230.421 2.106 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2C[C@@H](F)CN2)CC(C)(C)C1 ZINC001246111880 987446849 /nfs/dbraw/zinc/44/68/49/987446849.db2.gz OSIJVSYVKMBJDW-LPWJVIDDSA-N 2 0 242.382 2.491 20 0 BEADRP C[NH+](C)[C@H](CNc1cc[nH+]cc1)c1cccs1 ZINC001116177453 987461330 /nfs/dbraw/zinc/46/13/30/987461330.db2.gz JJXMAJHTQKMPLL-GFCCVEGCSA-N 2 0 247.367 2.280 20 0 BEADRP CCCCCC[C@H](CC)[NH2+]CCC1(O)C[NH2+]C1 ZINC001246117900 987463839 /nfs/dbraw/zinc/46/38/39/987463839.db2.gz NBJBLDBUFXKFNI-ZDUSSCGKSA-N 2 0 242.407 2.049 20 0 BEADRP CC[C@@H]1CC[C@H]([NH2+]C[C@H]2C[NH2+]CC[C@@H]2C)C1 ZINC001246120679 987468684 /nfs/dbraw/zinc/46/86/84/987468684.db2.gz NJYDTGWSJHWSRW-DGAVXFQQSA-N 2 0 224.392 2.400 20 0 BEADRP FC(F)c1cccc(C[NH2+]C2CC[NH2+]CC2)c1 ZINC001246125137 987473391 /nfs/dbraw/zinc/47/33/91/987473391.db2.gz HHAOIDPYFJHWDI-UHFFFAOYSA-N 2 0 240.297 2.466 20 0 BEADRP C[C@H]1CC([NH2+][C@@H]2C[NH2+]CC23CC3)C[C@H](C)C1 ZINC001246127980 987478879 /nfs/dbraw/zinc/47/88/79/987478879.db2.gz CZPLZYZJSZICFV-NQBHXWOUSA-N 2 0 222.376 2.153 20 0 BEADRP C1CC12C[NH2+]C[C@@H]2[NH2+]C1CCCCCCC1 ZINC001246131461 987484473 /nfs/dbraw/zinc/48/44/73/987484473.db2.gz KCRBWNYESLJRAY-ZDUSSCGKSA-N 2 0 222.376 2.441 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@@H]2C[NH2+]CC23CC3)C[C@@H]1C ZINC001246135224 987487831 /nfs/dbraw/zinc/48/78/31/987487831.db2.gz SYORIVJODBGVPE-MROQNXINSA-N 2 0 222.376 2.153 20 0 BEADRP CC1(C)CCC[C@@H]([NH2+][C@H]2C[NH2+]CC23CC3)C1 ZINC001246136395 987493619 /nfs/dbraw/zinc/49/36/19/987493619.db2.gz WTSJIXYSZFDKFS-NEPJUHHUSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H]1CC([NH2+][C@H]2CC[C@@H]3C[NH2+]C[C@@H]32)C[C@H](C)C1 ZINC001246145193 987503668 /nfs/dbraw/zinc/50/36/68/987503668.db2.gz PADVIRTYXYECEK-FPVZYODXSA-N 2 0 236.403 2.399 20 0 BEADRP CCC[C@H](C)CC[C@H](C)[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001246147890 987504175 /nfs/dbraw/zinc/50/41/75/987504175.db2.gz LBHJASKSCWHGJJ-QSLWVIQJSA-N 2 0 224.392 2.399 20 0 BEADRP CC[C@@H]1C[C@@H]([NH2+]CCCCC[NH3+])C[C@H](CC)[NH2+]1 ZINC001246165448 987528017 /nfs/dbraw/zinc/52/80/17/987528017.db2.gz QZYLXNUSIUCFRF-BTTYYORXSA-N 3 0 241.423 2.014 20 0 BEADRP CC(C)SCC[N@@H+]1C[C@H]2CC[NH+](C)C[C@H]2C1 ZINC001473703453 987529124 /nfs/dbraw/zinc/52/91/24/987529124.db2.gz NGRNNSCHFWWQGM-OLZOCXBDSA-N 2 0 242.432 2.012 20 0 BEADRP Cc1cccc2c1CC[C@@H]([NH2+]C[C@H]1CCC[NH2+]1)C2 ZINC001246188401 987573984 /nfs/dbraw/zinc/57/39/84/987573984.db2.gz WNIFTBWSROALRJ-HUUCEWRRSA-N 2 0 244.382 2.194 20 0 BEADRP CC(C)C[C@H](C)C[C@H](C)[NH2+]C[C@H]1CC[NH2+]1 ZINC001246192977 987580273 /nfs/dbraw/zinc/58/02/73/987580273.db2.gz KWDZQHXNPYTIAG-RWMBFGLXSA-N 2 0 212.381 2.399 20 0 BEADRP CC[C@H](C)OCC[C@@H](C)[NH2+]C[C@H]1CCC[NH2+]C1 ZINC001246198242 987590088 /nfs/dbraw/zinc/59/00/88/987590088.db2.gz OBJXNTOMAHAYRA-RDBSUJKOSA-N 2 0 242.407 2.169 20 0 BEADRP CC[C@@H](CC(C)C)[NH2+]C[C@H]1CCC[NH2+]C1 ZINC001246199709 987593957 /nfs/dbraw/zinc/59/39/57/987593957.db2.gz ZDTAHDHVJMODHH-STQMWFEESA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[NH2+][C@@H](C)C1)c1ccc(O)cc1 ZINC001246205122 987598114 /nfs/dbraw/zinc/59/81/14/987598114.db2.gz RQCCQHWSPPBTIQ-GMXVVIOVSA-N 2 0 234.343 2.183 20 0 BEADRP CC(C)COCC[C@H](C)[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC001246206789 987603033 /nfs/dbraw/zinc/60/30/33/987603033.db2.gz TZAHHOSLBXQLDV-BFHYXJOUSA-N 2 0 242.407 2.297 20 0 BEADRP CC[C@@H](C)OCC[C@@H](C)[NH2+]C[C@H]1CCC[NH2+]C1 ZINC001246216583 987612533 /nfs/dbraw/zinc/61/25/33/987612533.db2.gz OBJXNTOMAHAYRA-MCIONIFRSA-N 2 0 242.407 2.169 20 0 BEADRP Cc1ccc(CN[C@H]2CC[NH2+][C@@H](C)C2)c(F)c1 ZINC001246229565 987626213 /nfs/dbraw/zinc/62/62/13/987626213.db2.gz DJRYTQIPPNGYOA-AAEUAGOBSA-N 2 0 236.334 2.364 20 0 BEADRP C[C@H]1C[C@H]([NH2+]C2CCCCCCC2)C[NH2+]1 ZINC001246242296 987645937 /nfs/dbraw/zinc/64/59/37/987645937.db2.gz DCMVDFQFPFSAHH-AAEUAGOBSA-N 2 0 210.365 2.439 20 0 BEADRP Cc1cccc2c1CC[C@@H]([NH2+]CC(C)(C)C[NH3+])C2 ZINC001246253559 987652924 /nfs/dbraw/zinc/65/29/24/987652924.db2.gz ZQBNUQASPTUZLH-CQSZACIVSA-N 2 0 246.398 2.427 20 0 BEADRP CCC1([NH2+][C@H]2C[NH2+][C@@H](C)C2)CCCCC1 ZINC001246253242 987653573 /nfs/dbraw/zinc/65/35/73/987653573.db2.gz DDLJPYKBZYOWQK-NWDGAFQWSA-N 2 0 210.365 2.439 20 0 BEADRP C[C@@H]1C[C@H](N2CC[C@H]([NH3+])c3ccccc32)CC[NH2+]1 ZINC001246259598 987656061 /nfs/dbraw/zinc/65/60/61/987656061.db2.gz BERRZBUYIRMPQK-BZPMIXESSA-N 2 0 245.370 2.037 20 0 BEADRP C[C@@H]1C[C@@H](N[C@@H]2CCc3ccc(O)cc32)CC[NH2+]1 ZINC001246285035 987679067 /nfs/dbraw/zinc/67/90/67/987679067.db2.gz FDWCCVPCWHXMTQ-IFUGULHKSA-N 2 0 246.354 2.110 20 0 BEADRP Cc1cccc(C(=[NH2+])NC2C[C@H]3CC[C@@H](C2)[NH2+]3)c1 ZINC001246294644 987687016 /nfs/dbraw/zinc/68/70/16/987687016.db2.gz RPLOKYMBVXXJCQ-PBWFPOADSA-N 2 0 243.354 2.193 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[NH2+][C@@H](C)C1)c1cccc(N)c1 ZINC001246296668 987690580 /nfs/dbraw/zinc/69/05/80/987690580.db2.gz JECYUTRPXLBECJ-COPLHBTASA-N 2 0 233.359 2.060 20 0 BEADRP CCCOC1CCC([NH2+]C[C@@H]([NH3+])CC)CC1 ZINC001246310903 987710458 /nfs/dbraw/zinc/71/04/58/987710458.db2.gz AGOSXEFBNAJTBB-HIFPTAJRSA-N 2 0 228.380 2.051 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@@H](C)CC(C)(C)SC ZINC001246312065 987712217 /nfs/dbraw/zinc/71/22/17/987712217.db2.gz FJUUUAUTIJYTOZ-VHSXEESVSA-N 2 0 218.410 2.234 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@H]1CCc2c(C)cccc2C1 ZINC001246315723 987722342 /nfs/dbraw/zinc/72/23/42/987722342.db2.gz VPUGFHTVZIDSJU-KGLIPLIRSA-N 2 0 232.371 2.179 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H](c2cccnc2)C2CC2)CC[NH2+]1 ZINC001246325511 987730262 /nfs/dbraw/zinc/73/02/62/987730262.db2.gz ASEVCPXHEVMUSF-KCPJHIHWSA-N 2 0 245.370 2.263 20 0 BEADRP Cc1cccc2c1CC[C@H]([NH2+]C[C@H]([NH3+])C(C)C)C2 ZINC001246332892 987737148 /nfs/dbraw/zinc/73/71/48/987737148.db2.gz NWSQISJVHZDECV-HOCLYGCPSA-N 2 0 246.398 2.425 20 0 BEADRP Cc1ccc2c(c1)C[C@H]([NH2+]C[C@@H]([NH3+])C(C)C)CC2 ZINC001246332571 987738902 /nfs/dbraw/zinc/73/89/02/987738902.db2.gz NPLXSJPKVPAWEB-HZPDHXFCSA-N 2 0 246.398 2.425 20 0 BEADRP [NH3+][C@@]12CC[C@@]([NH2+][C@H]3C[C@H]4C[C@H]4C3)(C1)CCC2 ZINC001246342312 987751482 /nfs/dbraw/zinc/75/14/82/987751482.db2.gz SJUCLJJQHDXMKJ-MQLXINIDSA-N 2 0 220.360 2.179 20 0 BEADRP C[C@H](Cc1cccc(O)c1)[NH2+][C@H]1CC[NH2+][C@H](C)C1 ZINC001246344721 987751548 /nfs/dbraw/zinc/75/15/48/987751548.db2.gz COOIRAMZKGZUFT-BZPMIXESSA-N 2 0 248.370 2.053 20 0 BEADRP CC[NH+]1CCC(C[NH2+]CC[C@H](C)F)CC1 ZINC001474543528 987754377 /nfs/dbraw/zinc/75/43/77/987754377.db2.gz XXXIKEDROWOCHB-NSHDSACASA-N 2 0 216.344 2.056 20 0 BEADRP Fc1ccc2c(c1)CC[C@H]([NH2+][C@@H]1CCCNC1)C2 ZINC001246357211 987763569 /nfs/dbraw/zinc/76/35/69/987763569.db2.gz KXHAJXYRNBBECG-LSDHHAIUSA-N 2 0 248.345 2.025 20 0 BEADRP COc1cccc(C(C)(C)[NH2+]C2CC[NH2+]CC2)c1 ZINC001246362780 987767315 /nfs/dbraw/zinc/76/73/15/987767315.db2.gz QTWINCZJYCFLMQ-UHFFFAOYSA-N 2 0 248.370 2.272 20 0 BEADRP CC[C@@H]1C[C@@H](NC(C)(C)CC[NH3+])C[C@H](CC)[NH2+]1 ZINC001246362483 987767338 /nfs/dbraw/zinc/76/73/38/987767338.db2.gz LWPQJQLCRDVLFV-CLLJXQQHSA-N 2 0 241.423 2.013 20 0 BEADRP COCc1ccc(C[NH2+][C@@H]2CC[NH2+][C@@H](C)C2)cc1 ZINC001246368034 987773214 /nfs/dbraw/zinc/77/32/14/987773214.db2.gz NPVDZHBTXALIFR-SWLSCSKDSA-N 2 0 248.370 2.063 20 0 BEADRP C[C@H]1C[C@H]([NH2+][C@H]2CCc3ccccc3C2)CC[NH2+]1 ZINC001246363598 987773246 /nfs/dbraw/zinc/77/32/46/987773246.db2.gz KVBFWHLEHRSJIX-VBNZEHGJSA-N 2 0 244.382 2.274 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CC2Cc3ccccc3C2)CC[NH2+]1 ZINC001246378645 987775894 /nfs/dbraw/zinc/77/58/94/987775894.db2.gz XXVHFXVHSSFDOW-LRDDRELGSA-N 2 0 244.382 2.132 20 0 BEADRP CC1([NH2+]C2CC[NH2+]CC2)CCC(F)(F)CC1 ZINC001246409870 987790054 /nfs/dbraw/zinc/79/00/54/987790054.db2.gz DDTBVZDLZUODNH-UHFFFAOYSA-N 2 0 232.318 2.296 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]C[C@@]2(C)CCC[NH2+]2)C1 ZINC001246457776 987816387 /nfs/dbraw/zinc/81/63/87/987816387.db2.gz UZIRCVZKLSUEEQ-FRRDWIJNSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]C[C@@]2(C)CCC[NH2+]2)C1 ZINC001246457777 987817484 /nfs/dbraw/zinc/81/74/84/987817484.db2.gz UZIRCVZKLSUEEQ-JHJVBQTASA-N 2 0 210.365 2.297 20 0 BEADRP C[NH2+][C@H]1C[C@H]([NH2+]C2C[C@@H](C)C[C@H](C)C2)C1 ZINC001246459893 987819531 /nfs/dbraw/zinc/81/95/31/987819531.db2.gz HTBLJIUNSHFWBL-ZPFDUUQYSA-N 2 0 210.365 2.151 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]C[C@@H]2CC[NH2+]C[C@@H]2F)C1 ZINC001246477315 987833509 /nfs/dbraw/zinc/83/35/09/987833509.db2.gz NWICJZDNJAXNNZ-VOAKCMCISA-N 2 0 228.355 2.102 20 0 BEADRP CC1CCC([NH2+]C[C@@H]2CC[NH2+]C[C@@H]2F)CC1 ZINC001246478435 987837214 /nfs/dbraw/zinc/83/72/14/987837214.db2.gz WHOWKORCMKDQRB-MVKMKZAISA-N 2 0 228.355 2.102 20 0 BEADRP CC[C@H](C)OCC[C@@H](C)[N@@H+]1C[C@H](C)[C@H](C[NH3+])C1 ZINC001246538456 987899015 /nfs/dbraw/zinc/89/90/15/987899015.db2.gz CCUVMRDCXGJJMG-RFQIPJPRSA-N 2 0 242.407 2.107 20 0 BEADRP CC[C@@H](C)OCC[C@@H](C)[NH+]1CCC(C[NH3+])CC1 ZINC001246540926 987901221 /nfs/dbraw/zinc/90/12/21/987901221.db2.gz XKPAJIUNGIWMSR-CHWSQXEVSA-N 2 0 242.407 2.251 20 0 BEADRP C[C@H]1C[N@@H+]([C@H]2CCC[C@H](C)C2)C[C@H]1C[NH3+] ZINC001246539295 987902209 /nfs/dbraw/zinc/90/22/09/987902209.db2.gz HECQLJLNRQBCLU-RVMXOQNASA-N 2 0 210.365 2.092 20 0 BEADRP CC[C@@H](C)OCC[C@H](C)[NH+]1CCC(C[NH3+])CC1 ZINC001246540959 987905733 /nfs/dbraw/zinc/90/57/33/987905733.db2.gz XKPAJIUNGIWMSR-QWHCGFSZSA-N 2 0 242.407 2.251 20 0 BEADRP CC[C@H](C)OCC[C@@H](C)[NH+]1CCC(C[NH3+])CC1 ZINC001246540929 987906169 /nfs/dbraw/zinc/90/61/69/987906169.db2.gz XKPAJIUNGIWMSR-OLZOCXBDSA-N 2 0 242.407 2.251 20 0 BEADRP C[C@@H](Cc1ccncc1)[N@@H+]1CCC[C@@](C)([NH3+])CC1 ZINC001246548384 987932813 /nfs/dbraw/zinc/93/28/13/987932813.db2.gz GKXQUCGGILPRRI-DZGCQCFKSA-N 2 0 247.386 2.216 20 0 BEADRP [NH3+][C@H]1CCC[N@@H+](C2CCC(F)(F)CC2)CC1 ZINC001246549240 987937498 /nfs/dbraw/zinc/93/74/98/987937498.db2.gz WDEBYTHTJWYKFB-JTQLQIEISA-N 2 0 232.318 2.378 20 0 BEADRP CC(C)OC1CCC([N@@H+]2CC[C@@H]([NH3+])[C@H]2C)CC1 ZINC001246548316 987938385 /nfs/dbraw/zinc/93/83/85/987938385.db2.gz HLLSACZWIJHPEF-BLYZHGLHSA-N 2 0 240.391 2.144 20 0 BEADRP C[C@@]1([NH3+])CCC[N@@H+](C2CCSCC2)CC1 ZINC001246552429 987949803 /nfs/dbraw/zinc/94/98/03/987949803.db2.gz OJQMSQQWXOPEOT-GFCCVEGCSA-N 2 0 228.405 2.085 20 0 BEADRP C[C@H](Cc1ccccn1)[N@@H+]1CCC[C@](C)([NH3+])CC1 ZINC001246553089 987951438 /nfs/dbraw/zinc/95/14/38/987951438.db2.gz QWIAFTSRSYVGNQ-HIFRSBDPSA-N 2 0 247.386 2.216 20 0 BEADRP C[C@@H](Cc1ccccn1)[N@@H+]1CCC[C@](C)([NH3+])CC1 ZINC001246553092 987953817 /nfs/dbraw/zinc/95/38/17/987953817.db2.gz QWIAFTSRSYVGNQ-ZFWWWQNUSA-N 2 0 247.386 2.216 20 0 BEADRP CC[C@@H]1C[C@@H]([N@@H+]2CCC[C@](C)([NH3+])CC2)CCO1 ZINC001246551690 987955335 /nfs/dbraw/zinc/95/53/35/987955335.db2.gz MKFQZNDFZPNPCM-MJBXVCDLSA-N 2 0 240.391 2.147 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]Cc1ccc(Cl)cc1 ZINC001117953360 987968331 /nfs/dbraw/zinc/96/83/31/987968331.db2.gz FNHNSCUIWSHAOI-SNVBAGLBSA-N 2 0 226.751 2.428 20 0 BEADRP F[C@@H]1CCC[N@@H+](C2C[C@H]3CC[C@@H](C2)[NH2+]3)CC1 ZINC001246556779 987968753 /nfs/dbraw/zinc/96/87/53/987968753.db2.gz DBNMLPBEUJHUAW-FKJOKYEKSA-N 2 0 226.339 2.093 20 0 BEADRP CSCC[C@H](C)[N@@H+]1CC[C@H](C)[C@@H](C[NH3+])CC1 ZINC001246555391 987969968 /nfs/dbraw/zinc/96/99/68/987969968.db2.gz DVSIYTSHRDEUAG-RWMBFGLXSA-N 2 0 244.448 2.435 20 0 BEADRP CC[C@@H]1CC[C@H]([N@@H+]2CCC(F)(F)[C@H](C[NH3+])C2)C1 ZINC001246557585 987974158 /nfs/dbraw/zinc/97/41/58/987974158.db2.gz MIZWOROXXRCCCN-UTUOFQBUSA-N 2 0 246.345 2.481 20 0 BEADRP C[C@H]1CC[N@@H+](C2CCSCC2)CC[C@H]1C[NH3+] ZINC001246557250 987977425 /nfs/dbraw/zinc/97/74/25/987977425.db2.gz KFXFTQMWIMDWRS-RYUDHWBXSA-N 2 0 242.432 2.189 20 0 BEADRP [NH3+]C[C@@H]1CC[C@H]([NH2+]Cc2ccc3c(c2)CCC3)C1 ZINC001118015864 987982448 /nfs/dbraw/zinc/98/24/48/987982448.db2.gz NURYQDXRMDAZRT-WBMJQRKESA-N 2 0 244.382 2.392 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@@H]1CCc2c1cccc2F ZINC001118060118 987999552 /nfs/dbraw/zinc/99/95/52/987999552.db2.gz WHLNQSTWAYMGCC-IINYFYTJSA-N 2 0 236.334 2.401 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@H](C)c1ccc(C)nc1C ZINC001118058474 988000597 /nfs/dbraw/zinc/00/05/97/988000597.db2.gz KONKVPAVUFVXRY-CMPLNLGQSA-N 2 0 235.375 2.347 20 0 BEADRP CC1([NH2+][C@@H]2C[C@H]([NH3+])c3ccccc32)CC1 ZINC001118118919 988020769 /nfs/dbraw/zinc/02/07/69/988020769.db2.gz KQDNVEDJDQBJML-NWDGAFQWSA-N 2 0 202.301 2.273 20 0 BEADRP C[C@H]1C[N@@H+](C2CCSCC2)CCC[C@H]1C[NH3+] ZINC001246564959 988021139 /nfs/dbraw/zinc/02/11/39/988021139.db2.gz GWVNVMNDNQAXHU-RYUDHWBXSA-N 2 0 242.432 2.189 20 0 BEADRP [NH3+]CCCC[NH2+][C@H]1CCc2c1cc(F)cc2F ZINC001118121209 988023018 /nfs/dbraw/zinc/02/30/18/988023018.db2.gz BPMRCGTWSHLFKD-ZDUSSCGKSA-N 2 0 240.297 2.281 20 0 BEADRP CSC(C)(C)C[C@H](C)[N@@H+]1C[C@@H](C)[C@H]([NH3+])C1 ZINC001246569042 988039749 /nfs/dbraw/zinc/03/97/49/988039749.db2.gz UQJRYHFFWGSONC-OUAUKWLOSA-N 2 0 230.421 2.186 20 0 BEADRP F[C@H]1CCCC[N@@H+](C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC001246568998 988041741 /nfs/dbraw/zinc/04/17/41/988041741.db2.gz ULALOPODSKWINL-ACJTYDJDSA-N 2 0 226.339 2.093 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2CCCC[C@](C)(F)C2)CC[NH2+]1 ZINC001246571613 988051868 /nfs/dbraw/zinc/05/18/68/988051868.db2.gz DMCFKPUVUHPLSN-UPJWGTAASA-N 2 0 228.355 2.341 20 0 BEADRP C[C@@H]1C[C@@H]([N@@H+]2CCC[C@@](C)(F)CC2)CC[NH2+]1 ZINC001246573130 988059423 /nfs/dbraw/zinc/05/94/23/988059423.db2.gz YUBYOFQTQWTFPD-FRRDWIJNSA-N 2 0 228.355 2.341 20 0 BEADRP C[C@]1(C[NH3+])CCC[N@@H+]([C@H]2CCCOCC2)CC1 ZINC001246574614 988072547 /nfs/dbraw/zinc/07/25/47/988072547.db2.gz IIBSCVFZIZNWKB-KBPBESRZSA-N 2 0 240.391 2.006 20 0 BEADRP CCCc1ccc(C[N@@H+]2CC[C@@H](C[NH3+])C2)cc1 ZINC001118196296 988084409 /nfs/dbraw/zinc/08/44/09/988084409.db2.gz AWIJTVKAABTWFF-HNNXBMFYSA-N 2 0 232.371 2.420 20 0 BEADRP C[C@@H]1C[C@@H]([N@@H+]2CCC[C@@H](C)[C@@H](C)C2)CC[NH2+]1 ZINC001246578152 988093966 /nfs/dbraw/zinc/09/39/66/988093966.db2.gz YJQMPHGCOLYBLB-RQJABVFESA-N 2 0 224.392 2.495 20 0 BEADRP CCSC[C@H](C)[N@@H+]1CCCC[C@@H](C[NH3+])C1 ZINC001246582508 988112351 /nfs/dbraw/zinc/11/23/51/988112351.db2.gz NCWSZHBRWQODCA-RYUDHWBXSA-N 2 0 230.421 2.189 20 0 BEADRP CC(C)OCC[C@H](C)[N@@H+]1CCCC[C@H](C[NH3+])C1 ZINC001246584166 988128579 /nfs/dbraw/zinc/12/85/79/988128579.db2.gz SOQUJIIKDGVMBP-UONOGXRCSA-N 2 0 242.407 2.251 20 0 BEADRP C[C@@]1(C[NH3+])CCCC[N@@H+]([C@H]2C[C@H]3C[C@H]3C2)C1 ZINC001246585012 988132206 /nfs/dbraw/zinc/13/22/06/988132206.db2.gz NRZXXXUJXNWLTQ-DGAVXFQQSA-N 2 0 222.376 2.236 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2CCCC[C@](C)(C[NH3+])C2)CCO1 ZINC001246585587 988134133 /nfs/dbraw/zinc/13/41/33/988134133.db2.gz PIEDEAYFKWHYIY-MGPQQGTHSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2CCC[C@H](C)CC2)CC[NH2+]1 ZINC001246584423 988135561 /nfs/dbraw/zinc/13/55/61/988135561.db2.gz ALUDKAYKLDXMEI-YNEHKIRRSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@]1(C[NH3+])CCCC[N@@H+]([C@H]2CCCOCC2)C1 ZINC001246593918 988184480 /nfs/dbraw/zinc/18/44/80/988184480.db2.gz OTSZHERGZFZJFL-UONOGXRCSA-N 2 0 240.391 2.006 20 0 BEADRP CCC[C@H](C)CC[C@H](C)[NH+]1CC(C[NH3+])C1 ZINC001246594105 988186715 /nfs/dbraw/zinc/18/67/15/988186715.db2.gz JSJLJIJMPVOTKF-RYUDHWBXSA-N 2 0 212.381 2.482 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2CCC(F)(F)C(C)(C)C2)CC[NH2+]1 ZINC001246593977 988188542 /nfs/dbraw/zinc/18/85/42/988188542.db2.gz CNLSZIJHYAFXDO-GHMZBOCLSA-N 2 0 246.345 2.494 20 0 BEADRP CCSC[C@@H](C)[N@@H+]1CCC[C@]12CCC[NH2+]C2 ZINC001246609523 988225108 /nfs/dbraw/zinc/22/51/08/988225108.db2.gz LUTGYTPXUVUQAR-OLZOCXBDSA-N 2 0 242.432 2.346 20 0 BEADRP CC[C@H]1CC[C@H]([NH+]2CCC(F)(C[NH3+])CC2)C1 ZINC001246618229 988254845 /nfs/dbraw/zinc/25/48/45/988254845.db2.gz HUZARURPTMILCM-RYUDHWBXSA-N 2 0 228.355 2.328 20 0 BEADRP C[C@H]1CCC[C@@H]([NH+]2CCC(F)(C[NH3+])CC2)C1 ZINC001246627582 988300841 /nfs/dbraw/zinc/30/08/41/988300841.db2.gz NPGSAJPNQVOKIP-NWDGAFQWSA-N 2 0 228.355 2.328 20 0 BEADRP CC(C)C1CCC([N@@H+]2CCC3(C[NH2+]C3)C2)CC1 ZINC001246628968 988305191 /nfs/dbraw/zinc/30/51/91/988305191.db2.gz FDSJKQGVJZRUFZ-UHFFFAOYSA-N 2 0 236.403 2.497 20 0 BEADRP CC1CCC([N@@H+]2CC[C@H]3[NH2+]CC[C@H]32)CC1 ZINC001246635509 988324844 /nfs/dbraw/zinc/32/48/44/988324844.db2.gz CBSVSPMQVNDZDK-FIYWTHMPSA-N 2 0 208.349 2.001 20 0 BEADRP CC[C@H](CC(C)C)[N@@H+]1CC[C@@H]2[NH2+]CC[C@H]21 ZINC001246638658 988338319 /nfs/dbraw/zinc/33/83/19/988338319.db2.gz BSZFQDLWTPNLJJ-FRRDWIJNSA-N 2 0 210.365 2.247 20 0 BEADRP C[C@@H]1CC[C@@H]([N@@H+]2CC[C@H]3[NH2+]CC[C@H]32)C[C@@H]1C ZINC001246642106 988347080 /nfs/dbraw/zinc/34/70/80/988347080.db2.gz ZEYVORMFGNMNBC-XVIXHAIJSA-N 2 0 222.376 2.247 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2CC[C@H]3C[NH2+]C[C@H]32)C[C@@H]1C ZINC001246644879 988358809 /nfs/dbraw/zinc/35/88/09/988358809.db2.gz JKVJDJFCXRXNMX-IKOXMDCHSA-N 2 0 222.376 2.105 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2CC[C@@H]3[NH2+]CC[C@H]32)C[C@H]1C ZINC001246647143 988360554 /nfs/dbraw/zinc/36/05/54/988360554.db2.gz ZEYVORMFGNMNBC-PEBLQZBPSA-N 2 0 222.376 2.247 20 0 BEADRP CC(C)C1CCC([N@@H+]2C[C@@H]3CC[NH2+][C@@H]3C2)CC1 ZINC001246650894 988376091 /nfs/dbraw/zinc/37/60/91/988376091.db2.gz JPSFNXNRRHRUQT-OOJKYFRXSA-N 2 0 236.403 2.495 20 0 BEADRP CCC[C@H](Cc1ccccc1)[N@H+]1C[C@@H]2[C@H]([NH3+])[C@@H]2C1 ZINC001246657929 988386305 /nfs/dbraw/zinc/38/63/05/988386305.db2.gz AOGLKUOMMWXMKW-LVQVYYBASA-N 2 0 244.382 2.287 20 0 BEADRP CCC[C@@H](Cc1ccccc1)[N@H+]1C[C@@H]2[C@H]([NH3+])[C@@H]2C1 ZINC001246657927 988388590 /nfs/dbraw/zinc/38/85/90/988388590.db2.gz AOGLKUOMMWXMKW-JONQDZQNSA-N 2 0 244.382 2.287 20 0 BEADRP C[C@@H]1CC[C@@H]([N@@H+]2C[C@H]3CCC[NH2+][C@H]3C2)C[C@@H]1C ZINC001246661416 988395993 /nfs/dbraw/zinc/39/59/93/988395993.db2.gz XDSBXHAHRYUXKM-KHMAMNHCSA-N 2 0 236.403 2.495 20 0 BEADRP CCCC[C@@H](CC(C)C)[N@H+]1C[C@@H]2[C@H]([NH3+])[C@@H]2C1 ZINC001246661857 988400849 /nfs/dbraw/zinc/40/08/49/988400849.db2.gz MHCHQAMZUXPSLY-FQUUOJAGSA-N 2 0 224.392 2.480 20 0 BEADRP CC[C@@H]1CC[C@H]([N@@H+]2C[C@H]3CCC[C@@]3([NH3+])C2)C1 ZINC001246666801 988408479 /nfs/dbraw/zinc/40/84/79/988408479.db2.gz RTBDHAAIRCJBPT-YIYPIFLZSA-N 2 0 222.376 2.378 20 0 BEADRP CC[C@H](CC(C)C)[N@@H+]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC001246667419 988408998 /nfs/dbraw/zinc/40/89/98/988408998.db2.gz KLKSKHSCSZQZIG-MGPQQGTHSA-N 2 0 224.392 2.352 20 0 BEADRP CC[C@H]1CC[C@H]([N@@H+]2C[C@H]3CCC[C@@]3([NH3+])C2)C1 ZINC001246666800 988411827 /nfs/dbraw/zinc/41/18/27/988411827.db2.gz RTBDHAAIRCJBPT-RFQIPJPRSA-N 2 0 222.376 2.378 20 0 BEADRP C[C@@H]1CC[C@@H](N2CC[C@@H](c3ccncc3)C2)C[NH2+]1 ZINC001246775770 988454397 /nfs/dbraw/zinc/45/43/97/988454397.db2.gz LDLUTRWJNWSZJP-BPLDGKMQSA-N 2 0 245.370 2.011 20 0 BEADRP C[NH2+]Cc1ccc(NC2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC001246776156 988457036 /nfs/dbraw/zinc/45/70/36/988457036.db2.gz HHCVQWTWNJLMBG-YIONKMFJSA-N 2 0 245.370 2.101 20 0 BEADRP c1ccc([C@H]2CCC[N@H+](C3CC[NH2+]CC3)C2)nc1 ZINC001246808158 988490992 /nfs/dbraw/zinc/49/09/92/988490992.db2.gz RNBGSGRDZUOBHR-ZDUSSCGKSA-N 2 0 245.370 2.013 20 0 BEADRP C[C@H]1C[C@H]([N@@H+]2CCC[C@@H]2c2cccnc2)CC[NH2+]1 ZINC001246834770 988532656 /nfs/dbraw/zinc/53/26/56/988532656.db2.gz GRIWUJRGCQAVSH-NWANDNLSSA-N 2 0 245.370 2.359 20 0 BEADRP C[C@@H]1C[C@H]([N@H+](C)C[C@@H]2CC2(C)C)CC[NH2+]1 ZINC001246846177 988553372 /nfs/dbraw/zinc/55/33/72/988553372.db2.gz NDDBSKYPKCPMMD-GRYCIOLGSA-N 2 0 210.365 2.105 20 0 BEADRP CCCCC[C@H](C)[N@@H+]1C[C@H]2CC[NH2+]C[C@H]2C1 ZINC001246845910 988554462 /nfs/dbraw/zinc/55/44/62/988554462.db2.gz NERUPRRCAVXVSR-MJBXVCDLSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H](Cc1cccc(F)c1)N1C[C@H]2CC[C@]2([NH3+])C1 ZINC001246854164 988568745 /nfs/dbraw/zinc/56/87/45/988568745.db2.gz PCNHZNJFIFLZQM-KYOSRNDESA-N 2 0 248.345 2.180 20 0 BEADRP [NH3+][C@@]12CC[C@H]1C[N@@H+](C1CCC3(CC3)CC1)C2 ZINC001246859343 988584300 /nfs/dbraw/zinc/58/43/00/988584300.db2.gz JWNDMUDRULCZPO-SMDDNHRTSA-N 2 0 220.360 2.132 20 0 BEADRP C[NH2+]C[C@H]1CC[N@@H+]([C@H](C)Cc2ccc(C)cc2)C1 ZINC001246863876 988614255 /nfs/dbraw/zinc/61/42/55/988614255.db2.gz LZQIQHZPHLTMDG-GDBMZVCRSA-N 2 0 246.398 2.467 20 0 BEADRP C[C@H]1C[C@H]([N@@H+]2CCC[C@@H]2c2ccccn2)CC[NH2+]1 ZINC001246884314 988651815 /nfs/dbraw/zinc/65/18/15/988651815.db2.gz AIIFANYEGHNOCQ-GZBFAFLISA-N 2 0 245.370 2.359 20 0 BEADRP CCC[N@H+](C1CCOCC1)[C@@H]1CC[NH2+][C@@H](C)C1 ZINC001246900256 988673675 /nfs/dbraw/zinc/67/36/75/988673675.db2.gz UOTJSRDMYYEVPC-GXTWGEPZSA-N 2 0 240.391 2.018 20 0 BEADRP CCC[N@H+](CC(C)C)[C@@H]1CSC2(C[NH2+]C2)C1 ZINC001246911253 988695188 /nfs/dbraw/zinc/69/51/88/988695188.db2.gz OIIAVQFDHUTTLZ-LBPRGKRZSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H]1CCC[C@H]([N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)C1 ZINC001246928731 988747602 /nfs/dbraw/zinc/74/76/02/988747602.db2.gz BTMCBCPGVNNINB-KBXIAJHMSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H]1CC[C@H]([N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)C1 ZINC001246935401 988767717 /nfs/dbraw/zinc/76/77/17/988767717.db2.gz VDBMWDDJAWCDJQ-FQUUOJAGSA-N 2 0 222.376 2.106 20 0 BEADRP C[C@H]1CC[C@@H]([N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)C1 ZINC001246935403 988768756 /nfs/dbraw/zinc/76/87/56/988768756.db2.gz VDBMWDDJAWCDJQ-IGQOVBAYSA-N 2 0 222.376 2.106 20 0 BEADRP CO[C@@H]1C[N@@H+]([C@@H](C)C[C@H](C)CC(C)C)C[C@@H]1N ZINC001246983892 988816234 /nfs/dbraw/zinc/81/62/34/988816234.db2.gz VTJDXDOLENTBCH-ZOBORPQBSA-N 2 0 242.407 2.105 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]Cc1cccc(C)c1C ZINC001325627619 989218896 /nfs/dbraw/zinc/21/88/96/989218896.db2.gz UUEQZHCTGQNRJB-GFCCVEGCSA-N 2 0 220.360 2.391 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]Cc1ccccc1C ZINC001325624506 989221307 /nfs/dbraw/zinc/22/13/07/989221307.db2.gz DVTJJETVKWFCHT-GFCCVEGCSA-N 2 0 206.333 2.083 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H]1CCC[C@@H](C)[C@@H]1C ZINC001325741761 989244816 /nfs/dbraw/zinc/24/48/16/989244816.db2.gz MLHCKWDZUWVDSP-FVCCEPFGSA-N 2 0 212.381 2.399 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H](C)c1cccc(OC)c1 ZINC001325742691 989249643 /nfs/dbraw/zinc/24/96/43/989249643.db2.gz GKLUOIIULGTJPC-VXGBXAGGSA-N 2 0 236.359 2.344 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H]1C[C@H](OC(C)C)C1(C)C ZINC001325744828 989249769 /nfs/dbraw/zinc/24/97/69/989249769.db2.gz VLUVJVCFFQDBJZ-UPJWGTAASA-N 2 0 242.407 2.166 20 0 BEADRP CCOc1cccc([C@H](C)[NH2+]CCCC[NH3+])c1 ZINC001325755937 989252550 /nfs/dbraw/zinc/25/25/50/989252550.db2.gz LUSOWBARBMYRQO-LBPRGKRZSA-N 2 0 236.359 2.475 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H](C1CC1)C1CCC1 ZINC001325755722 989252850 /nfs/dbraw/zinc/25/28/50/989252850.db2.gz GONUSIWMBVRYEF-MFKMUULPSA-N 2 0 210.365 2.153 20 0 BEADRP FCC[NH+]1CCC([C@H]2CCC[NH2+]CC2)CC1 ZINC001119684321 989336683 /nfs/dbraw/zinc/33/66/83/989336683.db2.gz SSQZXWQGIPJKLB-LBPRGKRZSA-N 2 0 228.355 2.058 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@@H](C)c1ccsc1 ZINC001326036643 989337951 /nfs/dbraw/zinc/33/79/51/989337951.db2.gz SCEGVVGEDFYBBS-UWVGGRQHSA-N 2 0 212.362 2.397 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@@H]1CCCc2ccc(O)cc21 ZINC001326037495 989338303 /nfs/dbraw/zinc/33/83/03/989338303.db2.gz XETCPMPZNUKOCA-XHDPSFHLSA-N 2 0 248.370 2.357 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]C/C=C/C1CC1 ZINC001326036394 989338437 /nfs/dbraw/zinc/33/84/37/989338437.db2.gz QKTGMJYVULWBSQ-UFFNRZRYSA-N 2 0 245.370 2.466 20 0 BEADRP CCC1(CC)[C@H]([NH2+]CC[C@@H](C)[NH2+]C)C[C@@H]1OC ZINC001326037031 989339215 /nfs/dbraw/zinc/33/92/15/989339215.db2.gz UPRDWGANCDBBQT-UPJWGTAASA-N 2 0 242.407 2.168 20 0 BEADRP C[C@@H]1C[C@H]1[C@@H]1C[C@H]1[NH2+]C1CCC(C[NH3+])CC1 ZINC001119701483 989349809 /nfs/dbraw/zinc/34/98/09/989349809.db2.gz PNFUZOFWYAXXGZ-CJECOITKSA-N 2 0 222.376 2.138 20 0 BEADRP COc1cc(C[NH2+][C@H](C)C[C@@H](C)[NH3+])ccc1F ZINC001326200787 989420305 /nfs/dbraw/zinc/42/03/05/989420305.db2.gz CZQKECVNQQMZOZ-NXEZZACHSA-N 2 0 240.322 2.050 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]Cc1ccc2c(c1)CCC2 ZINC001326459428 989568195 /nfs/dbraw/zinc/56/81/95/989568195.db2.gz OIUNSCVMIMNJSE-VXGBXAGGSA-N 2 0 232.371 2.391 20 0 BEADRP CCCN(CC[NH+]1CCCC1)c1cc[nH+]cc1 ZINC001120860957 989931080 /nfs/dbraw/zinc/93/10/80/989931080.db2.gz ZEFWPDBFWQQYAL-UHFFFAOYSA-N 2 0 233.359 2.394 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CCC(F)F)CC1(C)C ZINC001308550679 991031956 /nfs/dbraw/zinc/03/19/56/991031956.db2.gz SMBSBCJHIAEMSV-VIFPVBQESA-N 2 0 220.307 2.104 20 0 BEADRP CCC[N@H+](CCC[NH3+])[C@@H](C)Cc1ccco1 ZINC001258176413 991073986 /nfs/dbraw/zinc/07/39/86/991073986.db2.gz UPAAOARQUZGKEL-LBPRGKRZSA-N 2 0 224.348 2.271 20 0 BEADRP C[C@H](Cc1ccco1)[N@H+]1C[C@H]2[C@H](C1)CCCN2C ZINC001258196919 991111070 /nfs/dbraw/zinc/11/10/70/991111070.db2.gz BNTLSOYACQAMAQ-IPYPFGDCSA-N 2 0 248.370 2.237 20 0 BEADRP C[C@@H](Cc1ccco1)[NH+]1CCC2(C[NH+](C)C2)CC1 ZINC001258198661 991115898 /nfs/dbraw/zinc/11/58/98/991115898.db2.gz IZXBBNPCGQMNRM-ZDUSSCGKSA-N 2 0 248.370 2.238 20 0 BEADRP CSCC[C@H](C)[NH+]1CCC([NH+](C)C)CC1 ZINC001258212760 991133611 /nfs/dbraw/zinc/13/36/11/991133611.db2.gz IJISTXCIESGAHX-NSHDSACASA-N 2 0 230.421 2.154 20 0 BEADRP CSCC[C@@H](C)[N@@H+]1C[C@H]2C[C@@]2(C[NH+](C)C)C1 ZINC001258223793 991159897 /nfs/dbraw/zinc/15/98/97/991159897.db2.gz FIJPJGUOIDYLBD-JHJVBQTASA-N 2 0 242.432 2.012 20 0 BEADRP CSCC[C@@H](C)[N@@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC001258226763 991162040 /nfs/dbraw/zinc/16/20/40/991162040.db2.gz RHHBGBGAQLLMOE-CHWSQXEVSA-N 2 0 242.432 2.156 20 0 BEADRP CC[NH+]1C[C@@H]2C[NH+]([C@@H](C)CCSC)C[C@H]2C1 ZINC001258227859 991168372 /nfs/dbraw/zinc/16/83/72/991168372.db2.gz HJKDKHDJTTUUIG-YNEHKIRRSA-N 2 0 242.432 2.012 20 0 BEADRP CSC(C)(C)C[C@H](C)[NH2+]CCn1ccnc1 ZINC001258320149 991243409 /nfs/dbraw/zinc/24/34/09/991243409.db2.gz MPYHDEVLFLHEAP-NSHDSACASA-N 2 0 241.404 2.393 20 0 BEADRP CC(C)SCC[NH2+][C@@H]1CC[C@@H]2C[N@H+](C)C[C@H]12 ZINC001308984331 991252719 /nfs/dbraw/zinc/25/27/19/991252719.db2.gz HGSBODJXOVUNOB-FRRDWIJNSA-N 2 0 242.432 2.058 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@@H]([NH2+]C3CC4(CCC4)C3)[C@@H]2C1 ZINC001308983729 991252862 /nfs/dbraw/zinc/25/28/62/991252862.db2.gz AVYILQVSOFLQMX-IACUBPJLSA-N 2 0 234.387 2.249 20 0 BEADRP CCCCC(CCCC)[N@@H+]1CCO[C@H](C[NH3+])C1 ZINC001258377860 991332228 /nfs/dbraw/zinc/33/22/28/991332228.db2.gz BYJYRVKZXXYQHK-CQSZACIVSA-N 2 0 242.407 2.395 20 0 BEADRP COCCC1([NH3+])CC[NH+]([C@@H](C)CC2CC2)CC1 ZINC001258452937 991402212 /nfs/dbraw/zinc/40/22/12/991402212.db2.gz DZVSVISNKJUKJK-LBPRGKRZSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@@H](CC1CC1)[N@@H+]1C[C@H]2CC[NH+](C)C[C@H]2C1 ZINC001258460588 991413304 /nfs/dbraw/zinc/41/33/04/991413304.db2.gz IWKNYLRXCMONKL-YUTCNCBUSA-N 2 0 222.376 2.059 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[C@@H]2C[N@H+](C)C[C@H]12 ZINC001560622563 991523203 /nfs/dbraw/zinc/52/32/03/991523203.db2.gz KSRMRUOLXDYHLW-PEBLQZBPSA-N 2 0 222.376 2.105 20 0 BEADRP CCC[C@@H](Cc1ccccc1)[N@@H+]1CC[C@@H](N)C1 ZINC001258648996 991580671 /nfs/dbraw/zinc/58/06/71/991580671.db2.gz ATTBYRYHCAQSLZ-CABCVRRESA-N 2 0 232.371 2.431 20 0 BEADRP CCCCC[C@@H](CCC)[N@@H+]1CCO[C@H](C[NH3+])C1 ZINC001258661482 991597907 /nfs/dbraw/zinc/59/79/07/991597907.db2.gz GFSMVEDUALUGSB-ZIAGYGMSSA-N 2 0 242.407 2.395 20 0 BEADRP CCC(CC)[NH2+]C[C@@H]1C[NH+]2CCC1CC2 ZINC001561034403 991693427 /nfs/dbraw/zinc/69/34/27/991693427.db2.gz PCFLGIHZBLVVMP-GFCCVEGCSA-N 2 0 210.365 2.106 20 0 BEADRP CC1(C)CC([NH2+]C[C@@H]2C[NH+]3CCC2CC3)C1 ZINC001561034222 991695506 /nfs/dbraw/zinc/69/55/06/991695506.db2.gz KJYAJIUGJPDKTB-GFCCVEGCSA-N 2 0 222.376 2.106 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[C@H]2C[N@H+](C)C[C@@H]21)C1CCC1 ZINC001561053645 991712309 /nfs/dbraw/zinc/71/23/09/991712309.db2.gz XZYWYUREPOJRHZ-ZQDZILKHSA-N 2 0 236.403 2.495 20 0 BEADRP CCC[NH+]1CCC([NH2+]C23CC(C2)C3)CC1 ZINC001258764827 991727685 /nfs/dbraw/zinc/72/76/85/991727685.db2.gz LYXDCDGXUSFZHC-UHFFFAOYSA-N 2 0 208.349 2.003 20 0 BEADRP CCC[NH+]1CCC([NH2+]C2(C)CCOCC2)CC1 ZINC001258768037 991733815 /nfs/dbraw/zinc/73/38/15/991733815.db2.gz VEMCRGRQPDAMQT-UHFFFAOYSA-N 2 0 240.391 2.020 20 0 BEADRP CCC[NH+]1CCC([N@H+]2C[C@@H]3[C@H](C2)C3(C)C)CC1 ZINC001258775280 991738415 /nfs/dbraw/zinc/73/84/15/991738415.db2.gz ILUXDYHHGAIKKS-OKILXGFUSA-N 2 0 236.403 2.449 20 0 BEADRP CC[C@H](Cc1ccccc1)[NH2+][C@@H]1CCC[C@@H]1[NH3+] ZINC001258844743 991878152 /nfs/dbraw/zinc/87/81/52/991878152.db2.gz RFVYYVADNRRQSX-QLFBSQMISA-N 2 0 232.371 2.477 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H]1C[C@H]1C ZINC001258898440 991887163 /nfs/dbraw/zinc/88/71/63/991887163.db2.gz XLLBLCWRAPAHDJ-AGIUHOORSA-N 2 0 212.381 2.495 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[N@H+](C)C(C)(C)CN ZINC001258902739 991892060 /nfs/dbraw/zinc/89/20/60/991892060.db2.gz ZBHMPDKCIXFTCZ-CYBMUJFWSA-N 2 0 243.439 2.166 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H]1C[C@H](OC)C1 ZINC001258900069 991894190 /nfs/dbraw/zinc/89/41/90/991894190.db2.gz ZOGUNUCGFJMPMO-IHRRRGAJSA-N 2 0 242.407 2.264 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CC[C@H](OC)C1 ZINC001258907703 991895881 /nfs/dbraw/zinc/89/58/81/991895881.db2.gz MVALTROYWCVYNB-KGLIPLIRSA-N 2 0 242.407 2.218 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCOC[C@H]1C ZINC001258907281 991899534 /nfs/dbraw/zinc/89/95/34/991899534.db2.gz HKWMHHKAZLQWMS-ZIAGYGMSSA-N 2 0 242.407 2.218 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC(=O)CC1 ZINC001258908468 991899558 /nfs/dbraw/zinc/89/95/58/991899558.db2.gz VYPAFXQMNFMSSP-ZDUSSCGKSA-N 2 0 240.391 2.162 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CC(COC)C1 ZINC001258907297 991900410 /nfs/dbraw/zinc/90/04/10/991900410.db2.gz HUNMJSQYPGLYGX-ZDUSSCGKSA-N 2 0 242.407 2.075 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H]1C[C@H](C)CC[C@H]1C ZINC001261424080 992297486 /nfs/dbraw/zinc/29/74/86/992297486.db2.gz MQRDXSFRECWTRA-FDYHWXHSSA-N 2 0 212.381 2.399 20 0 BEADRP C1[NH2+]C[C@@H]2[C@H]1[C@H]2[NH2+][C@H]1CC[C@H]2CCCC[C@@H]2C1 ZINC001261424116 992293620 /nfs/dbraw/zinc/29/36/20/992293620.db2.gz NSTFQZLBTCRMGT-JEWKUQAESA-N 2 0 234.387 2.153 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@H]1CCC12CCCC2 ZINC001261424064 992297435 /nfs/dbraw/zinc/29/74/35/992297435.db2.gz MGQXDUNXMQJFPR-RYUDHWBXSA-N 2 0 210.365 2.297 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@H]([NH2+]CCC(C)(C)C)[C@H]2C1 ZINC001474757048 992524116 /nfs/dbraw/zinc/52/41/16/992524116.db2.gz OTAHFWVGBKLQIC-AVGNSLFASA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H](C[NH2+]Cc1cccn1C1CC1)C[NH+](C)C ZINC001262031438 992618011 /nfs/dbraw/zinc/61/80/11/992618011.db2.gz RORHLAIJEIPMLD-LBPRGKRZSA-N 2 0 235.375 2.110 20 0 BEADRP C1=CCC(CC[NH2+]CC2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC001574774661 992901010 /nfs/dbraw/zinc/90/10/10/992901010.db2.gz ORMJBIKMFAACGR-GOOCMWNKSA-N 2 0 234.387 2.463 20 0 BEADRP C1=C[C@H]2CC[C@@H](C1)[N@H+]2C[C@H]1CCCC[NH2+]C1 ZINC001574774709 992902683 /nfs/dbraw/zinc/90/26/83/992902683.db2.gz PFUYORRKZXLQMX-MELADBBJSA-N 2 0 220.360 2.169 20 0 BEADRP C(C1CCC1)[N@@H+]1CCCC[C@@]12CCC[NH2+]C2 ZINC001574774986 992903442 /nfs/dbraw/zinc/90/34/42/992903442.db2.gz SIWCOGSEKYFQMI-AWEZNQCLSA-N 2 0 222.376 2.395 20 0 BEADRP C([NH2+][C@H]1CC[C@H]1C1CC1)[C@@H]1CCC[NH2+]CC1 ZINC001574799787 992908791 /nfs/dbraw/zinc/90/87/91/992908791.db2.gz FPJZBFKFSYJFCL-XBFCOCLRSA-N 2 0 222.376 2.154 20 0 BEADRP C([NH2+][C@@H]1CC[C@H]1C1CC1)[C@@H]1CCC[NH2+]CC1 ZINC001574799777 992909363 /nfs/dbraw/zinc/90/93/63/992909363.db2.gz FPJZBFKFSYJFCL-KWCYVHTRSA-N 2 0 222.376 2.154 20 0 BEADRP C([NH2+][C@@H]1C[C@@H]2CCC[C@H]12)[C@@H]1CCC[NH2+]CC1 ZINC001574801038 992914342 /nfs/dbraw/zinc/91/43/42/992914342.db2.gz MOUOKBUJCPVYIM-ZOBORPQBSA-N 2 0 222.376 2.154 20 0 BEADRP C/C(=C\c1ccccc1)CNCC12CC(C1)C[NH2+]2 ZINC001574981090 992962158 /nfs/dbraw/zinc/96/21/58/992962158.db2.gz ZRYSPIVZTCPGEP-NTUHNPAUSA-N 2 0 242.366 2.432 20 0 BEADRP CC(C)(C)[C@@H]1CCC[C@@H]1[NH2+]C[C@@]12C[C@@H]1C[NH2+]C2 ZINC001575120397 992990104 /nfs/dbraw/zinc/99/01/04/992990104.db2.gz SYZGKNPWFBDPIQ-CXTNEJHOSA-N 2 0 236.403 2.400 20 0 BEADRP CC(C)(C)CC[C@@H]([NH3+])C[NH2+]CC[C@H]1CCCO1 ZINC001575130300 992992448 /nfs/dbraw/zinc/99/24/48/992992448.db2.gz JMAVFVUHWRWJRP-CHWSQXEVSA-N 2 0 242.407 2.299 20 0 BEADRP CC(C)(C)CC[C@@H]([NH3+])C[NH2+][C@@H]1CCCC[C@H]1O ZINC001575131077 992993505 /nfs/dbraw/zinc/99/35/05/992993505.db2.gz SFJJPJQTKQXKSP-JHJVBQTASA-N 2 0 242.407 2.033 20 0 BEADRP CC(C)(C)O[C@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H]([NH3+])C2)C1 ZINC001575254122 993000326 /nfs/dbraw/zinc/00/03/26/993000326.db2.gz YSOWSHOVAXULDE-FDYHWXHSSA-N 2 0 240.391 2.192 20 0 BEADRP CC(C)CCn1cccc1C[NH2+]CC[C@H](C)[NH3+] ZINC001575588218 993075706 /nfs/dbraw/zinc/07/57/06/993075706.db2.gz XFMMWVDZKRDWJI-ZDUSSCGKSA-N 2 0 237.391 2.361 20 0 BEADRP CC(C)OC1(C[NH2+][C@H]2C[C@@H]([NH3+])C2(C)C)CCC1 ZINC001575748626 993103212 /nfs/dbraw/zinc/10/32/12/993103212.db2.gz BZNRJZILKCYSFC-NEPJUHHUSA-N 2 0 240.391 2.050 20 0 BEADRP C[C@H](CC1CCC1)[NH2+]C1CC(CC[NH3+])C1 ZINC001575934948 993133971 /nfs/dbraw/zinc/13/39/71/993133971.db2.gz UTTNJLYTPFZXKQ-QFWMXSHPSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)[C@@H]1C[C@H]1[NH2+][C@H](C)C[C@H]1CCC[NH2+]1 ZINC001575940766 993134406 /nfs/dbraw/zinc/13/44/06/993134406.db2.gz BKZFWEHUVKPEIN-FVCCEPFGSA-N 2 0 210.365 2.151 20 0 BEADRP C[C@@H](C[NH+]1CC2(C1)CC[NH2+]CC2)C(C)(C)C ZINC001576004805 993154190 /nfs/dbraw/zinc/15/41/90/993154190.db2.gz GYWGWBSEETYLQR-LBPRGKRZSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@H](CO)[N@H+](CCCCCC[NH3+])C1CCCC1 ZINC001576039274 993165089 /nfs/dbraw/zinc/16/50/89/993165089.db2.gz ZFHQRALFSOPKOO-CYBMUJFWSA-N 2 0 242.407 2.131 20 0 BEADRP C[C@H](Cc1ccc(O)cc1)[NH2+]CCC(C)(C)[NH3+] ZINC001576052112 993168159 /nfs/dbraw/zinc/16/81/59/993168159.db2.gz GWBCEKMEIMJLHS-LLVKDONJSA-N 2 0 236.359 2.040 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@H]1C1CCCC1)C1C[NH2+]C1 ZINC001576245327 993228565 /nfs/dbraw/zinc/22/85/65/993228565.db2.gz OPDKJEARWLAXRG-SUHUHFCYSA-N 2 0 222.376 2.010 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CC[C@@H]([NH3+])C1)C1CCSCC1 ZINC001576245146 993229979 /nfs/dbraw/zinc/22/99/79/993229979.db2.gz NYJORFVMIREFHP-GMXVVIOVSA-N 2 0 242.432 2.235 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[NH2+]C[C@H]1C)[C@H]1CC2CCC1CC2 ZINC001576252803 993231732 /nfs/dbraw/zinc/23/17/32/993231732.db2.gz TZXOBTRFCQTNRF-IOXRHEGJSA-N 2 0 236.403 2.399 20 0 BEADRP CC1(C)[C@H]([NH3+])C[C@H]1[NH2+]CCC[C@H]1CCCCO1 ZINC001576380335 993288019 /nfs/dbraw/zinc/28/80/19/993288019.db2.gz OLMFZRAPNQWYSL-JHJVBQTASA-N 2 0 240.391 2.051 20 0 BEADRP [NH3+]C[C@H]1CCCC[N@H+](Cc2ccsc2)C1 ZINC000379908975 993292873 /nfs/dbraw/zinc/29/28/73/993292873.db2.gz LJSBZNFMPKHUJB-LLVKDONJSA-N 2 0 224.373 2.309 20 0 BEADRP CC1=CCC[C@H](C)[C@H]1C[NH2+][C@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC001576554803 993341664 /nfs/dbraw/zinc/34/16/64/993341664.db2.gz BLYVWGSECFLRPT-AICCOOGYSA-N 2 0 234.387 2.461 20 0 BEADRP CC1=CCC[C@@H](C)[C@H]1C[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC001576555492 993342053 /nfs/dbraw/zinc/34/20/53/993342053.db2.gz HYVSTPZZCIFQRM-KBXIAJHMSA-N 2 0 234.387 2.130 20 0 BEADRP CC1=CC[C@@H]([NH2+]CC[C@@H]2C[NH2+]C[C@H]2C)CC1 ZINC001576556108 993343831 /nfs/dbraw/zinc/34/38/31/993343831.db2.gz NOGZAYGXVNSQEX-MGPQQGTHSA-N 2 0 222.376 2.320 20 0 BEADRP Cc1ncsc1C[N@@H+]1CCCC[C@H](C[NH3+])C1 ZINC000380752190 993344895 /nfs/dbraw/zinc/34/48/95/993344895.db2.gz UJJFVYNHAKHNKF-LLVKDONJSA-N 2 0 239.388 2.012 20 0 BEADRP C[C@@H]1C[C@H](C[NH2+]CC[C@H]2CCCS2)CC[NH2+]1 ZINC001576596921 993360477 /nfs/dbraw/zinc/36/04/77/993360477.db2.gz CASDAQZDUZWSBU-JHJVBQTASA-N 2 0 242.432 2.250 20 0 BEADRP C[C@@H]1C[C@@H]([NH3+])CC[N@@H+]1CC12CCC(CC1)C2 ZINC001576608559 993366446 /nfs/dbraw/zinc/36/64/46/993366446.db2.gz UNJIQEHAFMBHIZ-ZIHBUVQPSA-N 2 0 222.376 2.378 20 0 BEADRP C[C@H]1CCC(C)(C)C[C@@H]1[NH2+][C@@H]1CC[NH2+]C1 ZINC001576647936 993382225 /nfs/dbraw/zinc/38/22/25/993382225.db2.gz VNQAVMFGHNUVEE-TUAOUCFPSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]CC2=CC[NH2+]CC2)CC1 ZINC001576679564 993391708 /nfs/dbraw/zinc/39/17/08/993391708.db2.gz CTTTZQVBSKKTHE-OCCSQVGLSA-N 2 0 222.376 2.465 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C/C=C/C2CC2)CC[N@@H+]1C ZINC000382312863 993447564 /nfs/dbraw/zinc/44/75/64/993447564.db2.gz QPCUKPDTDLLCIG-NAGRZINJSA-N 2 0 208.349 2.025 20 0 BEADRP CC[C@H](C)[C@@H](C[NH+]1CCC(CC[NH3+])CC1)OC ZINC001576960575 993466487 /nfs/dbraw/zinc/46/64/87/993466487.db2.gz GCNQXWIWULAHFG-GXTWGEPZSA-N 2 0 242.407 2.108 20 0 BEADRP CC[C@H](C)[C@H](C[NH+]1CCC(CC[NH3+])CC1)OC ZINC001576960577 993469099 /nfs/dbraw/zinc/46/90/99/993469099.db2.gz GCNQXWIWULAHFG-JSGCOSHPSA-N 2 0 242.407 2.108 20 0 BEADRP CC[C@H](C)[C@H](C[N@@H+]1CC[C@@H]([NH3+])[C@@H](CC)C1)OC ZINC001576961228 993471067 /nfs/dbraw/zinc/47/10/67/993471067.db2.gz LZTCBGMRFQORMR-FQUUOJAGSA-N 2 0 242.407 2.107 20 0 BEADRP CC[C@@H](CC(F)F)C[N@@H+]1C[C@H]2C[NH2+]C[C@@]2(C)C1 ZINC001577044140 993487618 /nfs/dbraw/zinc/48/76/18/993487618.db2.gz PDCCVHOSZDDIIM-LOWVWBTDSA-N 2 0 246.345 2.209 20 0 BEADRP CC[C@H]([NH2+]CCCCCC[NH3+])[C@H]1CCCO1 ZINC001577175602 993531431 /nfs/dbraw/zinc/53/14/31/993531431.db2.gz CJRKYLMJBBOASF-QWHCGFSZSA-N 2 0 228.380 2.053 20 0 BEADRP CC[C@H]([NH2+][C@H]1C[C@H]2CC[C@@H]1[NH2+]2)C1CCC1 ZINC001577176244 993534098 /nfs/dbraw/zinc/53/40/98/993534098.db2.gz XNLQRWCRSAIUBM-VOAKCMCISA-N 2 0 208.349 2.048 20 0 BEADRP CC[C@H]1CC[N@H+](CCC2CC[NH2+]CC2)[C@@H]1C ZINC001577263386 993564362 /nfs/dbraw/zinc/56/43/62/993564362.db2.gz RMWFVMXRIMBMTH-OCCSQVGLSA-N 2 0 224.392 2.497 20 0 BEADRP CCC[C@H](C)CC[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC001577340831 993604618 /nfs/dbraw/zinc/60/46/18/993604618.db2.gz KQTUYOLJEPETSU-QWHCGFSZSA-N 2 0 212.381 2.402 20 0 BEADRP CCC[C@@H]1[C@H](C)CCC[N@@H+]1C[C@@]12C[C@@H]1C[NH2+]C2 ZINC001577374833 993630782 /nfs/dbraw/zinc/63/07/82/993630782.db2.gz HGFMBEBNSJSNFQ-TUVASFSCSA-N 2 0 236.403 2.497 20 0 BEADRP CCCCO[C@@H]1C[C@H]([NH2+]C/C=C\C[NH3+])C1(C)C ZINC001577463373 993667350 /nfs/dbraw/zinc/66/73/50/993667350.db2.gz UWYNOBOIUVSVNB-ASOISWSRSA-N 2 0 240.391 2.075 20 0 BEADRP C1[C@H]([NH2+]C2CC[NH2+]CC2)C12CCCCC2 ZINC000386871350 993695905 /nfs/dbraw/zinc/69/59/05/993695905.db2.gz HAIPRCDOQVWCRS-LBPRGKRZSA-N 2 0 208.349 2.051 20 0 BEADRP C[N@H+](C[C@@H]1CC1(C)C)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000700672772 993846175 /nfs/dbraw/zinc/84/61/75/993846175.db2.gz NJPMFUKPSUBXGJ-ACJTYDJDSA-N 2 0 222.376 2.247 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+]C[C@H]1CCOC1 ZINC000019915192 1170140746 /nfs/dbraw/zinc/14/07/46/1170140746.db2.gz YNIBCTQHAMFVRH-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+]C[C@H]1CCCO1 ZINC000020049036 1170141811 /nfs/dbraw/zinc/14/18/11/1170141811.db2.gz OOVJGHUDCNPUTI-UONOGXRCSA-N 2 0 242.407 2.266 20 0 BEADRP COc1ccccc1/C=C\C[NH2+]CCC[NH+](C)C ZINC001620695127 1170147559 /nfs/dbraw/zinc/14/75/59/1170147559.db2.gz SYCWZAJQVFSHKY-TWGQIWQCSA-N 2 0 248.370 2.250 20 0 BEADRP CC[C@H]1CC[N@H+](CC2CC[NH+](C)CC2)[C@@H]1C ZINC001621270275 1170756743 /nfs/dbraw/zinc/75/67/43/1170756743.db2.gz QYSAKBDPOZMOLB-OCCSQVGLSA-N 2 0 224.392 2.449 20 0 BEADRP CCOCC(C)(C)[NH2+]CC1CC[NH+](CC)CC1 ZINC001621363508 1170783346 /nfs/dbraw/zinc/78/33/46/1170783346.db2.gz LIAYBZIVYRCXGN-UHFFFAOYSA-N 2 0 242.407 2.123 20 0 BEADRP CC1(C)CC[C@H]([NH2+]C[C@H]2C[NH+]3CCC2CC3)C1 ZINC001621551533 1170845013 /nfs/dbraw/zinc/84/50/13/1170845013.db2.gz LFRSOUAKCSFMHB-KBPBESRZSA-N 2 0 236.403 2.497 20 0 BEADRP CCC[N@H+](CCc1ccccn1)C1CC[NH2+]CC1 ZINC000037662669 1170964774 /nfs/dbraw/zinc/96/47/74/1170964774.db2.gz ZMJPOXGTRRJQCU-UHFFFAOYSA-N 2 0 247.386 2.088 20 0 BEADRP CCCC[C@@H](CC)C[N@H+](C)CCC[NH3+] ZINC000043454487 1171288811 /nfs/dbraw/zinc/28/88/11/1171288811.db2.gz HXASIGVEWQOPLT-GFCCVEGCSA-N 2 0 200.370 2.483 20 0 BEADRP CC(C)CC[C@H](C)[NH+]1CCC(C[NH3+])CC1 ZINC000044512118 1171389434 /nfs/dbraw/zinc/38/94/34/1171389434.db2.gz WDBGQCKDSBKKRM-LBPRGKRZSA-N 2 0 212.381 2.482 20 0 BEADRP C[N@H+](CC[C@H]1CCCC[NH2+]1)CC(C)(C)C ZINC000045074020 1171432922 /nfs/dbraw/zinc/43/29/22/1171432922.db2.gz HVVYVVRRZQGXGY-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP CC(C)CCC[C@@H](C)[N@@H+]1CCC[NH2+]CC1 ZINC000049660681 1171718322 /nfs/dbraw/zinc/71/83/22/1171718322.db2.gz HKFAXXQAZJSRGA-CYBMUJFWSA-N 2 0 212.381 2.497 20 0 BEADRP CCCC1CC[NH+]([C@H](C)CC[NH2+]C)CC1 ZINC000052373914 1171961591 /nfs/dbraw/zinc/96/15/91/1171961591.db2.gz IHUSVONTTXWFEA-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@H]([NH2+]CCCC1CC1)C1CC[NH+](C)CC1 ZINC000161717861 538917300 /nfs/dbraw/zinc/91/73/00/538917300.db2.gz ZJIWAXFGZZYYBG-LBPRGKRZSA-N 2 0 224.392 2.497 20 0 BEADRP CC1(C)CCCC[C@@H]1[NH2+]C[C@@H]([NH3+])C1CC1 ZINC000560942795 322993579 /nfs/dbraw/zinc/99/35/79/322993579.db2.gz ILFMZGGJOUBWAT-NEPJUHHUSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]Cc1ccc(F)c(F)c1 ZINC000422907628 398157122 /nfs/dbraw/zinc/15/71/22/398157122.db2.gz XGTXIYADKKQZJB-DTWKUNHWSA-N 2 0 228.286 2.180 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CCCc1cccc(F)c1 ZINC000422906932 398157275 /nfs/dbraw/zinc/15/72/75/398157275.db2.gz KOYTVEXVBNOUNC-GFCCVEGCSA-N 2 0 238.350 2.475 20 0 BEADRP CCC1(CC)[C@H]([NH2+][C@H](C)C[C@@H](C)[NH3+])C[C@H]1OC ZINC000422943703 398159800 /nfs/dbraw/zinc/15/98/00/398159800.db2.gz RDGURCYWILVPJI-FDYHWXHSSA-N 2 0 242.407 2.296 20 0 BEADRP C[C@@H](C[N@@H+]1C[C@@H](C[NH3+])C[C@H]1C)C(C)(C)C ZINC000379814369 398170349 /nfs/dbraw/zinc/17/03/49/398170349.db2.gz PTZUNLMPGVRZRO-QJPTWQEYSA-N 2 0 212.381 2.338 20 0 BEADRP CC[C@H]([NH2+]CCC[NH+]1CCCC1)[C@H]1C[C@@H]1C ZINC000321169712 262812205 /nfs/dbraw/zinc/81/22/05/262812205.db2.gz YIDSGSWUGBDKKV-IHRRRGAJSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1cc(F)ccc1C[N@H+]1CC[C@H]([C@H](C)[NH3+])C1 ZINC000228152902 178085004 /nfs/dbraw/zinc/08/50/04/178085004.db2.gz PIQNNGBSKFCRMP-AAEUAGOBSA-N 2 0 236.334 2.303 20 0 BEADRP Cc1cc(F)ccc1C[N@@H+]1CC[C@](C)(C[NH3+])C1 ZINC000235751353 178086241 /nfs/dbraw/zinc/08/62/41/178086241.db2.gz BLBFMOZWGLXXAN-CQSZACIVSA-N 2 0 236.334 2.305 20 0 BEADRP CS[C@@H]1CC[C@@H]1[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000336696017 398194458 /nfs/dbraw/zinc/19/44/58/398194458.db2.gz LWLTWNFHCPMIDC-ZDEQEGDKSA-N 2 0 240.416 2.097 20 0 BEADRP C[C@H](C[NH2+]C[C@@H]1CCC[NH2+]1)c1ccccc1 ZINC000235464897 398195048 /nfs/dbraw/zinc/19/50/48/398195048.db2.gz UVTLDDMWTYUECZ-OCCSQVGLSA-N 2 0 218.344 2.132 20 0 BEADRP C[C@H]([NH2+]C[C@H]1Cc2ccccc21)[C@H]1CCCC[NH2+]1 ZINC000386094527 398197169 /nfs/dbraw/zinc/19/71/69/398197169.db2.gz IQMQTKVHEMHWBL-JGGQBBKZSA-N 2 0 244.382 2.447 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+][C@@H]1CCC[C@H](C2CC2)C1 ZINC000424388838 398184368 /nfs/dbraw/zinc/18/43/68/398184368.db2.gz ZTBAOSTVEGJWDO-RFQIPJPRSA-N 2 0 222.376 2.425 20 0 BEADRP Cc1cc(N2CC[C@@H]([NH+]3CCCCC3)C2)cc[nH+]1 ZINC000274871298 178117099 /nfs/dbraw/zinc/11/70/99/178117099.db2.gz FRFQDRVFWJEJHW-OAHLLOKOSA-N 2 0 245.370 2.455 20 0 BEADRP Cc1cc(N2CC[C@H]3CC[C@@H](C2)[N@@H+]3C)cc[nH+]1 ZINC000274390010 178118940 /nfs/dbraw/zinc/11/89/40/178118940.db2.gz VGRLQXQMBQJGFM-OCCSQVGLSA-N 2 0 231.343 2.063 20 0 BEADRP C[C@@H]1CC[N@H+](CCCC2CC[NH2+]CC2)[C@H]1C ZINC000380602290 398202330 /nfs/dbraw/zinc/20/23/30/398202330.db2.gz HJGSJNOUCVGFNQ-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP CO[C@H]1CCC[C@@H]([NH2+]CC2([NH3+])CCCCC2)C1 ZINC000643496601 398205725 /nfs/dbraw/zinc/20/57/25/398205725.db2.gz CQYMDWSRZVMBPE-OLZOCXBDSA-N 2 0 240.391 2.195 20 0 BEADRP Cc1cc(NC(=O)CN2CCC(C)CC2)ccn1 ZINC000137210404 178131294 /nfs/dbraw/zinc/13/12/94/178131294.db2.gz ALIGOIWTSCNEQH-UHFFFAOYSA-N 2 0 247.342 2.060 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCCC[C@H]1C[NH3+])CC(F)F ZINC000647801219 398207818 /nfs/dbraw/zinc/20/78/18/398207818.db2.gz RPGXYIBZMATDBU-DCAQKATOSA-N 2 0 234.334 2.385 20 0 BEADRP Cc1cccnc1[C@@H]([NH2+]C[C@@H]1CC[NH2+]C1)C(C)C ZINC000649414608 398218281 /nfs/dbraw/zinc/21/82/81/398218281.db2.gz LNGFWJZYWDATRF-KGLIPLIRSA-N 2 0 247.386 2.286 20 0 BEADRP Cc1cc(NCC2([NH+](C)C)CCC2)cc[nH+]1 ZINC000165254888 178156583 /nfs/dbraw/zinc/15/65/83/178156583.db2.gz GWTMICHSRDACEN-UHFFFAOYSA-N 2 0 219.332 2.286 20 0 BEADRP Cc1cc(NCC[N@@H+](C)C(C)C)cc[nH+]1 ZINC000229566678 178159340 /nfs/dbraw/zinc/15/93/40/178159340.db2.gz CEYAIWZFOVRSHA-UHFFFAOYSA-N 2 0 207.321 2.142 20 0 BEADRP CCOc1cccc(C[NH2+][C@@H]2CCC[NH2+]CC2)c1 ZINC000129119602 398224845 /nfs/dbraw/zinc/22/48/45/398224845.db2.gz GXLUHOPXSHVGTQ-CQSZACIVSA-N 2 0 248.370 2.317 20 0 BEADRP Cc1cc(NC[C@H]2CCC[C@@H]([NH3+])C2)cc[nH+]1 ZINC000227669858 178170557 /nfs/dbraw/zinc/17/05/57/178170557.db2.gz GIDCZFWPCZKDLD-NWDGAFQWSA-N 2 0 219.332 2.319 20 0 BEADRP [NH3+]CC[C@H]1CCCC[N@@H+]1Cc1cccc(O)c1 ZINC000070148780 398220832 /nfs/dbraw/zinc/22/08/32/398220832.db2.gz BSLJZKCXTKPBDJ-CYBMUJFWSA-N 2 0 234.343 2.096 20 0 BEADRP CC(C)C[N@H+](CCCc1cncn1C)C1CC1 ZINC000576408055 365587899 /nfs/dbraw/zinc/58/78/99/365587899.db2.gz BWZIKVRGSBGLQO-UHFFFAOYSA-N 2 0 235.375 2.473 20 0 BEADRP Cc1cc(N[C@H]2CCCC[C@H]2C[NH3+])cc[nH+]1 ZINC000229576051 178188684 /nfs/dbraw/zinc/18/86/84/178188684.db2.gz QUIYZYGGVDKSGH-AAEUAGOBSA-N 2 0 219.332 2.319 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@@H]2CC[NH2+]C2)[C@@H]2CCCC[C@H]12 ZINC000647880340 398223190 /nfs/dbraw/zinc/22/31/90/398223190.db2.gz JSMBQFLJUPNZAR-KBUPBQIOSA-N 2 0 236.403 2.497 20 0 BEADRP Cc1cc(N[C@@H]2CC[NH2+]C2)c2ccccc2[nH+]1 ZINC000052093672 178183488 /nfs/dbraw/zinc/18/34/88/178183488.db2.gz OVAAEUDUWKFROZ-LLVKDONJSA-N 2 0 227.311 2.317 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C2CCC([NH+](C)C)CC2)[C@@H]1C ZINC000421364956 192333163 /nfs/dbraw/zinc/33/31/63/192333163.db2.gz ABWQOWBCFJNZIK-KPHYFBGPSA-N 2 0 224.392 2.493 20 0 BEADRP Cc1cc([C@@H](C)[NH2+]CCC[NH3+])c(C)s1 ZINC000037713511 178224390 /nfs/dbraw/zinc/22/43/90/178224390.db2.gz VNKPRLKQNZPBSA-SECBINFHSA-N 2 0 212.362 2.364 20 0 BEADRP CCSCC[NH2+]C1CCC([NH+](C)C)CC1 ZINC000421366789 192333507 /nfs/dbraw/zinc/33/35/07/192333507.db2.gz CVJDQGNXKIDGJG-UHFFFAOYSA-N 2 0 230.421 2.202 20 0 BEADRP COc1cccc(Cl)c1C[NH2+]CCCC[NH3+] ZINC000162016524 349523461 /nfs/dbraw/zinc/52/34/61/349523461.db2.gz UXFUNEWZUAQVPZ-UHFFFAOYSA-N 2 0 242.750 2.177 20 0 BEADRP Cc1cc([C@H](C)[NH2+]CCCC[NH3+])c(C)o1 ZINC000037715243 178247623 /nfs/dbraw/zinc/24/76/23/178247623.db2.gz GJBOLJOEIOOPSS-JTQLQIEISA-N 2 0 210.321 2.286 20 0 BEADRP C[NH+](C)Cc1ccc(-c2ncc[nH]2)cc1F ZINC000649438054 398240152 /nfs/dbraw/zinc/24/01/52/398240152.db2.gz RSOURJBOTVRAMK-UHFFFAOYSA-N 2 0 219.263 2.277 20 0 BEADRP C[C@H]1C[C@@H]([N@H+](C)C2CCCCC2)CC[NH2+]1 ZINC000229539153 538939427 /nfs/dbraw/zinc/93/94/27/538939427.db2.gz PZHBMFMTNTYDNX-AAEUAGOBSA-N 2 0 210.365 2.391 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]C[C@H]2CCCOC2)c2ccccc21 ZINC000252794509 136227129 /nfs/dbraw/zinc/22/71/29/136227129.db2.gz YXMMVVYDQGMHBT-KCPJHIHWSA-N 2 0 246.354 2.147 20 0 BEADRP c1ccc2c(c1)CC[C@H]2[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000643534304 398239716 /nfs/dbraw/zinc/23/97/16/398239716.db2.gz QBRSYXQEXFOXSF-CABCVRRESA-N 2 0 242.366 2.406 20 0 BEADRP c1ccc2c(c1)CC[C@@H]2[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000643534307 398239757 /nfs/dbraw/zinc/23/97/57/398239757.db2.gz QBRSYXQEXFOXSF-LSDHHAIUSA-N 2 0 242.366 2.406 20 0 BEADRP CCC(CC)C[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000037408346 168361675 /nfs/dbraw/zinc/36/16/75/168361675.db2.gz LAIBNRWEXWPJPP-ZDUSSCGKSA-N 2 0 224.392 2.497 20 0 BEADRP CCN1CCC[C@@H]([NH2+][C@H]2CCCC23CC3)C1 ZINC000566500765 323003683 /nfs/dbraw/zinc/00/36/83/323003683.db2.gz QUUNUABATQKPNC-OLZOCXBDSA-N 2 0 222.376 2.393 20 0 BEADRP C[C@@H]1CCC[C@H](C)[N@H+](C[C@@H]2CC[NH2+]C2)C1 ZINC000381615839 398254279 /nfs/dbraw/zinc/25/42/79/398254279.db2.gz VEZKRZHDMVYNPY-FRRDWIJNSA-N 2 0 210.365 2.106 20 0 BEADRP C[NH+](C)C1CC([NH2+]C[C@@H]2C[C@H]2c2ccccc2)C1 ZINC000576648906 365650946 /nfs/dbraw/zinc/65/09/46/365650946.db2.gz VGDQDVIUYMTKJZ-LBDPXKHJSA-N 2 0 244.382 2.472 20 0 BEADRP CC1CC[NH+](C[C@@H]2CC[NH2+][C@@H](C)C2)CC1 ZINC000232835429 136229894 /nfs/dbraw/zinc/22/98/94/136229894.db2.gz KXKINBIMLLCKRF-QWHCGFSZSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]([NH2+]C1CC([NH+]2CCCCC2)C1)C1CC1 ZINC000370113770 398249704 /nfs/dbraw/zinc/24/97/04/398249704.db2.gz VGOQONXQWMLWDP-XGNXJENSSA-N 2 0 222.376 2.391 20 0 BEADRP CC(C)[NH2+]CCC[NH2+][C@H](C)[C@@H]1CC1(C)C ZINC000576694688 365658709 /nfs/dbraw/zinc/65/87/09/365658709.db2.gz MSHXZBIVKSFWLE-NEPJUHHUSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@H](C[N@@H+]1CC[C@H]2[NH2+]CC[C@H]2C1)C(C)(C)C ZINC000381595576 398265204 /nfs/dbraw/zinc/26/52/04/398265204.db2.gz JRISTSNIMWOORZ-FRRDWIJNSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H](CCCC(F)(F)F)[NH2+]CCCC[NH3+] ZINC000166664040 361854914 /nfs/dbraw/zinc/85/49/14/361854914.db2.gz BWLSAZARANVQFS-VIFPVBQESA-N 2 0 226.286 2.436 20 0 BEADRP CC(C)OCCC[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000037221631 538962071 /nfs/dbraw/zinc/96/20/71/538962071.db2.gz KFXGVFDBYBCWQJ-ZDUSSCGKSA-N 2 0 242.407 2.121 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)[C@@H]1C[C@H]1C ZINC000321136986 342751208 /nfs/dbraw/zinc/75/12/08/342751208.db2.gz URTIDVHFBVBIRZ-RQJABVFESA-N 2 0 224.392 2.352 20 0 BEADRP Cc1cc(N)cc(C[NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)c1 ZINC000335365123 398286952 /nfs/dbraw/zinc/28/69/52/398286952.db2.gz YIPJPUXLBHJZCZ-WFASDCNBSA-N 2 0 247.386 2.150 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@H](C)[C@H](C[NH3+])C2)c(C)n1 ZINC000335614041 136237546 /nfs/dbraw/zinc/23/75/46/136237546.db2.gz NHXKWCRLSNABJM-XHDPSFHLSA-N 2 0 247.386 2.115 20 0 BEADRP CC(C)C[C@H](C)[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000378930517 346862254 /nfs/dbraw/zinc/86/22/54/346862254.db2.gz LNSHHZCVCIVQIA-IGQOVBAYSA-N 2 0 224.392 2.399 20 0 BEADRP Fc1ccc2c(c1)CN(C[C@@H]1CCC[NH2+]C1)CC2 ZINC000335338223 398285195 /nfs/dbraw/zinc/28/51/95/398285195.db2.gz HKDJGRDSGXJRBX-GFCCVEGCSA-N 2 0 248.345 2.183 20 0 BEADRP CC[NH+](CC)CCNc1cc(C)ccn1 ZINC000031572150 342790435 /nfs/dbraw/zinc/79/04/35/342790435.db2.gz AUNNWVPUSFLSFD-UHFFFAOYSA-N 2 0 207.321 2.144 20 0 BEADRP CC[C@@H](C)C[NH2+]C[C@H]1CC[N@@H+](C(C)C)C1 ZINC000040622286 538971838 /nfs/dbraw/zinc/97/18/38/538971838.db2.gz DVLASFIIZGGXPS-CHWSQXEVSA-N 2 0 212.381 2.352 20 0 BEADRP Cc1cc(C[NH2+]C[C@@H]2CCC[NH2+]C2)c(C)s1 ZINC000583981906 342817506 /nfs/dbraw/zinc/81/75/06/342817506.db2.gz HJBZCQOMTLFDLF-GFCCVEGCSA-N 2 0 238.400 2.454 20 0 BEADRP CC1(C)CCC[C@H]1[NH2+][C@H]1CCc2nc[nH]c2C1 ZINC000336479884 342807586 /nfs/dbraw/zinc/80/75/86/342807586.db2.gz UAXSQQANBZSOBY-GXFFZTMASA-N 2 0 233.359 2.435 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCC(F)(F)C1)C1CC[NH+](C)CC1 ZINC000379918905 538981445 /nfs/dbraw/zinc/98/14/45/538981445.db2.gz PPYAFLGEUZIOAH-PWSUYJOCSA-N 2 0 246.345 2.494 20 0 BEADRP CN1CCC[C@@H]([NH2+][C@H]2CCC23CCCC3)C1 ZINC000381647617 539005650 /nfs/dbraw/zinc/00/56/50/539005650.db2.gz CASKNXNUNIVDPF-OLZOCXBDSA-N 2 0 222.376 2.393 20 0 BEADRP C[NH+](C)C1CCC([NH2+]Cc2nccs2)CC1 ZINC000381400005 538999713 /nfs/dbraw/zinc/99/97/13/538999713.db2.gz QRSGDLVGXVQPPT-UHFFFAOYSA-N 2 0 239.388 2.106 20 0 BEADRP CC(C)C1CC([NH2+]C[C@H]2CCC[N@H+](C)C2)C1 ZINC000232537748 342856701 /nfs/dbraw/zinc/85/67/01/342856701.db2.gz SQOQEQDBSVVAEM-IYXRBSQSSA-N 2 0 224.392 2.352 20 0 BEADRP CCCC1(C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)CC1 ZINC000233042068 342894097 /nfs/dbraw/zinc/89/40/97/342894097.db2.gz IUFFVMRGJQZGMO-NEPJUHHUSA-N 2 0 210.365 2.426 20 0 BEADRP CCC1(C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)CCC1 ZINC000233088950 342895075 /nfs/dbraw/zinc/89/50/75/342895075.db2.gz RNHRJRVJKBCELJ-VXGBXAGGSA-N 2 0 210.365 2.426 20 0 BEADRP CCC1(C[NH2+][C@H]2CCC[C@H]([NH3+])C2)CCC1 ZINC000232886175 342887194 /nfs/dbraw/zinc/88/71/94/342887194.db2.gz RNHRJRVJKBCELJ-RYUDHWBXSA-N 2 0 210.365 2.426 20 0 BEADRP CCc1ccc(C[N@@H+]2CC[C@@](C)(C[NH3+])C2)s1 ZINC000234157791 342917283 /nfs/dbraw/zinc/91/72/83/342917283.db2.gz GTPHBBKOHKEOJP-ZDUSSCGKSA-N 2 0 238.400 2.481 20 0 BEADRP C[C@H]1[C@@H]([NH2+]Cc2ccccc2)CCCN1C ZINC000306328385 398339606 /nfs/dbraw/zinc/33/96/06/398339606.db2.gz NIJPXCLERMPTQK-JSGCOSHPSA-N 2 0 218.344 2.259 20 0 BEADRP CC[C@H]([NH2+]CCCC[NH3+])c1ccccc1 ZINC000037714767 342943384 /nfs/dbraw/zinc/94/33/84/342943384.db2.gz UBWPMOABABYCTP-ZDUSSCGKSA-N 2 0 206.333 2.466 20 0 BEADRP CC[C@H](CSC)[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000162387676 349683519 /nfs/dbraw/zinc/68/35/19/349683519.db2.gz MRYSGFNAQBSGMJ-FRRDWIJNSA-N 2 0 242.432 2.344 20 0 BEADRP CCc1cc(NC[C@H](C)C[NH+](C)C)cc[nH+]1 ZINC000307817403 529556559 /nfs/dbraw/zinc/55/65/59/529556559.db2.gz NMIZXIPYEDXEOW-NSHDSACASA-N 2 0 221.348 2.254 20 0 BEADRP C[C@@H](Cc1ccccc1F)[NH2+]CCCC[NH3+] ZINC000162531376 349726118 /nfs/dbraw/zinc/72/61/18/349726118.db2.gz XGISKUHHYGPETB-NSHDSACASA-N 2 0 224.323 2.085 20 0 BEADRP C[C@H](C[N@H+](C)CCOCC[NH3+])C1CCCCC1 ZINC000384075629 343037989 /nfs/dbraw/zinc/03/79/89/343037989.db2.gz WIJHAECBFDDVHY-CYBMUJFWSA-N 2 0 242.407 2.110 20 0 BEADRP C[C@@H]1c2c(F)cccc2CCN1CC(C)(C)[NH3+] ZINC000576822961 365694627 /nfs/dbraw/zinc/69/46/27/365694627.db2.gz KRSFPPVIPUHUOO-SNVBAGLBSA-N 2 0 236.334 2.482 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)C1CC1 ZINC000400961836 529661146 /nfs/dbraw/zinc/66/11/46/529661146.db2.gz MWWMNFOQJNUIKY-FQUUOJAGSA-N 2 0 222.376 2.153 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]CC2(C3CC3)CC2)C1 ZINC000236295616 343089105 /nfs/dbraw/zinc/08/91/05/343089105.db2.gz OEGYZXMAGRTABU-NEPJUHHUSA-N 2 0 208.349 2.036 20 0 BEADRP C[N@H+](CCOCC[NH3+])CC1CCC(C)(C)CC1 ZINC000383625615 362043900 /nfs/dbraw/zinc/04/39/00/362043900.db2.gz WFOGWMQDWBGHRM-UHFFFAOYSA-N 2 0 242.407 2.110 20 0 BEADRP CC[N@H+](C)C[C@@H]1CC[NH+](C2CCCC2)C1 ZINC000120109123 343108722 /nfs/dbraw/zinc/10/87/22/343108722.db2.gz FEGZLYWWVUJZLL-LBPRGKRZSA-N 2 0 210.365 2.203 20 0 BEADRP CCOc1ccc(C[N@@H+]2CC[C@@H]([NH3+])C[C@@H]2C)cc1 ZINC000131473985 343183795 /nfs/dbraw/zinc/18/37/95/343183795.db2.gz IYTBJFSIMGWWNY-GXTWGEPZSA-N 2 0 248.370 2.397 20 0 BEADRP C[C@H]([NH2+]CC1CC[NH2+]CC1)c1cccc(F)c1 ZINC000094009615 343151602 /nfs/dbraw/zinc/15/16/02/343151602.db2.gz KXNKHFVSKRLMNV-NSHDSACASA-N 2 0 236.334 2.476 20 0 BEADRP C[C@@H](CCc1ccco1)[NH2+]CC1CC[NH2+]CC1 ZINC000094009602 343151773 /nfs/dbraw/zinc/15/17/73/343151773.db2.gz HBGTXRRDNMVNNC-LBPRGKRZSA-N 2 0 236.359 2.190 20 0 BEADRP c1cc2c(o1)CCC[C@@H]2[NH2+]CC1CC[NH2+]CC1 ZINC000094009653 343151858 /nfs/dbraw/zinc/15/18/58/343151858.db2.gz UJSTUVNFZYXOCY-ZDUSSCGKSA-N 2 0 234.343 2.246 20 0 BEADRP CC1CC([NH2+]Cc2ccc(C[NH3+])cc2)C1 ZINC000123545715 343162330 /nfs/dbraw/zinc/16/23/30/343162330.db2.gz GIDIBQBZNYVHIQ-UHFFFAOYSA-N 2 0 204.317 2.033 20 0 BEADRP C[C@H]1C[C@@H]([NH3+])CC[N@@H+]1Cc1ccc2c(c1)CCC2 ZINC000124495465 343162541 /nfs/dbraw/zinc/16/25/41/343162541.db2.gz PXBUIXSKYSTARG-LRDDRELGSA-N 2 0 244.382 2.487 20 0 BEADRP CCCOc1ccc(C[N@H+](C)CCC[NH3+])cc1 ZINC000133727840 343186212 /nfs/dbraw/zinc/18/62/12/343186212.db2.gz GZOHVNBXTUUEOD-UHFFFAOYSA-N 2 0 236.359 2.256 20 0 BEADRP CN(CCC[NH3+])Cc1cc(F)cc(Cl)c1 ZINC000168297975 343209900 /nfs/dbraw/zinc/20/99/00/343209900.db2.gz IZKCHWNFXUJWRR-UHFFFAOYSA-N 2 0 230.714 2.260 20 0 BEADRP C[C@H]1C[C@@H]1CN1CCC2(CCC[N@@H+]2C)CC1 ZINC000625291169 343223169 /nfs/dbraw/zinc/22/31/69/343223169.db2.gz XSLNPLORXUHXER-QWHCGFSZSA-N 2 0 222.376 2.203 20 0 BEADRP C[N@H+](CC[C@@H]1CCC[NH2+]C1)CC1CCCC1 ZINC000082492422 136276733 /nfs/dbraw/zinc/27/67/33/136276733.db2.gz BUKQTFOEZZWWCK-ZDUSSCGKSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@H]1CCCN(CC[NH2+]C(C)(C)C)CC1 ZINC000082489063 136276779 /nfs/dbraw/zinc/27/67/79/136276779.db2.gz MKMYYDZMCJRGPU-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H](CCc1ccco1)[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000132022602 343187480 /nfs/dbraw/zinc/18/74/80/343187480.db2.gz RPPVQIPEDIFZJA-QWHCGFSZSA-N 2 0 236.359 2.190 20 0 BEADRP CCC[NH+]1CCC([NH2+]C[C@@H]2CCCS2)CC1 ZINC000087668018 136282208 /nfs/dbraw/zinc/28/22/08/136282208.db2.gz QRGHPCIXOONFSA-ZDUSSCGKSA-N 2 0 242.432 2.346 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]CC1CC[NH+](C)CC1 ZINC000069662469 343288148 /nfs/dbraw/zinc/28/81/48/343288148.db2.gz JPEQKXOTPZNKGM-NSHDSACASA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@H](C)C[NH+]1CCC(CC[NH2+]C)CC1 ZINC000069730281 343289957 /nfs/dbraw/zinc/28/99/57/343289957.db2.gz NJWHIXTZGUDOPT-LBPRGKRZSA-N 2 0 212.381 2.354 20 0 BEADRP [NH3+]CCC[NH2+][C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000069381547 343277969 /nfs/dbraw/zinc/27/79/69/343277969.db2.gz IJAWRVGOGPHHBA-IUCAKERBSA-N 2 0 224.270 2.046 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]1[NH2+]C1CCC(C(F)F)CC1 ZINC000335617741 136296593 /nfs/dbraw/zinc/29/65/93/136296593.db2.gz YVXQLAOCVJSVIM-TVUZUIDESA-N 2 0 232.318 2.280 20 0 BEADRP [NH3+]C[C@H]1CC[N@H+](CCCc2cccc(F)c2)C1 ZINC000348757858 136297099 /nfs/dbraw/zinc/29/70/99/136297099.db2.gz YTHULJPEYOBXPF-CYBMUJFWSA-N 2 0 236.334 2.039 20 0 BEADRP Fc1ccc2c(c1)CC[C@H]2[NH2+]C1CC[NH2+]CC1 ZINC000335601262 136295223 /nfs/dbraw/zinc/29/52/23/136295223.db2.gz JPQZCGNJDRDTSI-CQSZACIVSA-N 2 0 234.318 2.155 20 0 BEADRP CCC[C@H]([NH2+]C[C@@H](O)C[N@H+](C)CC)C(C)(C)C ZINC000584061422 343309948 /nfs/dbraw/zinc/30/99/48/343309948.db2.gz KUHSWGITAFUXMT-OLZOCXBDSA-N 2 0 244.423 2.103 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+]CCC[NH+]2CCCC2)C1 ZINC000070642868 343337363 /nfs/dbraw/zinc/33/73/63/343337363.db2.gz CWRAWKUEJBAWOA-QWHCGFSZSA-N 2 0 210.365 2.251 20 0 BEADRP CCOc1ccc(C[NH2+]C2CCN(C)CC2)cc1 ZINC000037248628 343340931 /nfs/dbraw/zinc/34/09/31/343340931.db2.gz KCLRRGBNRKGAMV-UHFFFAOYSA-N 2 0 248.370 2.269 20 0 BEADRP CN(CCC[NH+](C)C)Cc1cc(F)cc(F)c1 ZINC000348918315 136307772 /nfs/dbraw/zinc/30/77/72/136307772.db2.gz BRKWXGZKQIARMF-UHFFFAOYSA-N 2 0 242.313 2.348 20 0 BEADRP Cc1c[nH+]ccc1N1CCC2(CCC[N@H+]2C)CC1 ZINC000335679984 136320262 /nfs/dbraw/zinc/32/02/62/136320262.db2.gz FIKAMWHKHWMUGQ-UHFFFAOYSA-N 2 0 245.370 2.455 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@@H]2COC(C)(C)C2)CC1 ZINC000335656186 136376344 /nfs/dbraw/zinc/37/63/44/136376344.db2.gz JIFQJBDPOJTVQF-ZDUSSCGKSA-N 2 0 240.391 2.016 20 0 BEADRP CC(C)(C)CC[N@@H+]1CC[C@]2(CC[NH2+]C2)C1 ZINC000083987796 343512911 /nfs/dbraw/zinc/51/29/11/343512911.db2.gz JSEAHXSPSQCWPC-ZDUSSCGKSA-N 2 0 210.365 2.108 20 0 BEADRP CC(C)CCC[N@@H+]1CC[C@@]2(CC[NH2+]C2)C1 ZINC000083987795 343513144 /nfs/dbraw/zinc/51/31/44/343513144.db2.gz FEFKKCCEPOQMMN-CYBMUJFWSA-N 2 0 210.365 2.108 20 0 BEADRP CC[N@@H+]1CCC[C@H](C[NH2+]CC2(C)CC2)C1 ZINC000379974361 365770622 /nfs/dbraw/zinc/77/06/22/365770622.db2.gz CTADPKYEGWMQNE-GFCCVEGCSA-N 2 0 210.365 2.108 20 0 BEADRP CC[C@@H]1C[N@H+](CCC2CCC2)CC[C@@H]1[NH3+] ZINC000398751678 488223833 /nfs/dbraw/zinc/22/38/33/488223833.db2.gz BYSHWFOIHCZORA-OLZOCXBDSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@@H]([N@H+](C)CC1CC[NH2+]CC1)C1(C)CC1 ZINC000087365096 343645432 /nfs/dbraw/zinc/64/54/32/343645432.db2.gz XOICYZCTNLUBCX-LLVKDONJSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@H]1CCC(C)(C)C1 ZINC000087771431 343660020 /nfs/dbraw/zinc/66/00/20/343660020.db2.gz PWJZYLDLOFPJRK-NEPJUHHUSA-N 2 0 212.381 2.495 20 0 BEADRP Clc1cccc(CC[NH2+]C2CC[NH2+]CC2)c1 ZINC000059533411 343710039 /nfs/dbraw/zinc/71/00/39/343710039.db2.gz AFWVUTNKYIZBBH-UHFFFAOYSA-N 2 0 238.762 2.224 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+][C@H](C)CCC[NH3+])CO2 ZINC000576458582 343750724 /nfs/dbraw/zinc/75/07/24/343750724.db2.gz OXVNPAIDJVDZPE-DGCLKSJQSA-N 2 0 234.343 2.146 20 0 BEADRP CC1(C)CCC[C@@H](C[N@@H+]2CC[C@@H]3C[NH2+]C[C@@H]32)C1 ZINC000576804881 343758912 /nfs/dbraw/zinc/75/89/12/343758912.db2.gz AIJPGQHXPQBVEY-MCIONIFRSA-N 2 0 236.403 2.497 20 0 BEADRP CC(C)[C@H]1CC[C@H]1[NH2+]CC1=CC[N@H+](C)CC1 ZINC000336665063 537815936 /nfs/dbraw/zinc/81/59/36/537815936.db2.gz LKBNVBQAPVKWGX-ZIAGYGMSSA-N 2 0 222.376 2.273 20 0 BEADRP [NH3+]C1CCC([NH2+]Cc2cccc(F)c2F)CC1 ZINC000111038909 537812557 /nfs/dbraw/zinc/81/25/57/537812557.db2.gz OEBYDJJOVHGFCY-UHFFFAOYSA-N 2 0 240.297 2.324 20 0 BEADRP CN1CCC([NH2+]C[C@H]2CCCC2(C)C)CC1 ZINC000336511541 346981322 /nfs/dbraw/zinc/98/13/22/346981322.db2.gz BYQYPNSBMLQVHQ-GFCCVEGCSA-N 2 0 224.392 2.497 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+]CC2(C)CCC2)C1 ZINC000336683338 537823929 /nfs/dbraw/zinc/82/39/29/537823929.db2.gz JWCCTHOVFKOZFR-GFCCVEGCSA-N 2 0 210.365 2.108 20 0 BEADRP CC[NH+]1CCC(N[C@H]2COc3ccccc32)CC1 ZINC000070528545 343952270 /nfs/dbraw/zinc/95/22/70/343952270.db2.gz PPHKWMLSNLFDFB-AWEZNQCLSA-N 2 0 246.354 2.194 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000634733440 344113284 /nfs/dbraw/zinc/11/32/84/344113284.db2.gz FYIFOVKNAVEJGV-IJLUTSLNSA-N 2 0 210.365 2.010 20 0 BEADRP CCC[C@@H](C[NH2+]C[C@@H]1CC[N@@H+](C(C)C)C1)OC ZINC000395209461 362348065 /nfs/dbraw/zinc/34/80/65/362348065.db2.gz UYAVHCMSMASGMU-KBPBESRZSA-N 2 0 242.407 2.121 20 0 BEADRP C[N@H+](C[C@@H]1CCSC1)CC1CC[NH+](C)CC1 ZINC000494980900 529956937 /nfs/dbraw/zinc/95/69/37/529956937.db2.gz PVYSBCJVSOJFPJ-ZDUSSCGKSA-N 2 0 242.432 2.013 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H]1CCCC12CCC2 ZINC000518359967 344210453 /nfs/dbraw/zinc/21/04/53/344210453.db2.gz IRDSJJJYIIWUEM-GFCCVEGCSA-N 2 0 210.365 2.298 20 0 BEADRP Cc1cccc(CC[NH2+][C@H]2CC[N@@H+](C)C[C@@H]2C)c1 ZINC000130739153 344225133 /nfs/dbraw/zinc/22/51/33/344225133.db2.gz SWWCGZJOQRVZFE-HOCLYGCPSA-N 2 0 246.398 2.467 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@H]2CC=CCC2)[C@@H](C)C1 ZINC000228205939 259374802 /nfs/dbraw/zinc/37/48/02/259374802.db2.gz PQEQXRXDTAPIBQ-IHRRRGAJSA-N 2 0 222.376 2.415 20 0 BEADRP C[N@H+](C[C@H]1CCSC1)CC1CC[NH+](C)CC1 ZINC000494980899 529972424 /nfs/dbraw/zinc/97/24/24/529972424.db2.gz PVYSBCJVSOJFPJ-CYBMUJFWSA-N 2 0 242.432 2.013 20 0 BEADRP CCCCN(CC)CC[NH2+]C(C)(C)C ZINC000042302533 344450083 /nfs/dbraw/zinc/45/00/83/344450083.db2.gz BHGLOBDFIRVZJH-UHFFFAOYSA-N 2 0 200.370 2.497 20 0 BEADRP CC(C)C[N@H+](CC1CC[NH2+]CC1)C1CC1 ZINC000042559856 344458291 /nfs/dbraw/zinc/45/82/91/344458291.db2.gz SNXZUDOSNNJVCD-UHFFFAOYSA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)[C@H](C)[NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000224434931 344480706 /nfs/dbraw/zinc/48/07/06/344480706.db2.gz JICUYKZJQAUSGO-RWMBFGLXSA-N 2 0 212.381 2.493 20 0 BEADRP CC(C)OCC[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000056524766 344481785 /nfs/dbraw/zinc/48/17/85/344481785.db2.gz FRLOJYXLURUEBE-UHFFFAOYSA-N 2 0 242.407 2.075 20 0 BEADRP CCCCC[N@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000152385315 344532928 /nfs/dbraw/zinc/53/29/28/344532928.db2.gz AVIJWZXFOHUYMN-CYBMUJFWSA-N 2 0 212.381 2.450 20 0 BEADRP Cc1ccsc1C[NH+]1CCC(C[NH3+])CC1 ZINC000044511976 344541174 /nfs/dbraw/zinc/54/11/74/344541174.db2.gz WEMCNRSPBVXNQE-UHFFFAOYSA-N 2 0 224.373 2.227 20 0 BEADRP CCCC[C@H](C)[NH2+]CCCC[NH+](C)C ZINC000045664035 344574595 /nfs/dbraw/zinc/57/45/95/344574595.db2.gz ZCYAFRACKSSCKC-LBPRGKRZSA-N 2 0 200.370 2.497 20 0 BEADRP CC(C)C[C@@H](C)[NH2+][C@@H]1CCN(C2CC2)C1 ZINC000044684203 344545198 /nfs/dbraw/zinc/54/51/98/344545198.db2.gz RXOPLWJTDRXTAW-VXGBXAGGSA-N 2 0 210.365 2.247 20 0 BEADRP CC[C@@H]([NH3+])CN[C@H](C)c1sc(C)nc1C ZINC000049538808 344651912 /nfs/dbraw/zinc/65/19/12/344651912.db2.gz UIFOANBBALSIHK-GMSGAONNSA-N 2 0 227.377 2.148 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+][C@H]1CCC[C@@H](C)C1 ZINC000049551639 344652914 /nfs/dbraw/zinc/65/29/14/344652914.db2.gz AMEBKHAIFFGZSP-AGIUHOORSA-N 2 0 212.381 2.495 20 0 BEADRP CC(C)C[C@@H](C)[NH2+][C@H](C)CC[NH+](C)C ZINC000049553079 344652957 /nfs/dbraw/zinc/65/29/57/344652957.db2.gz UGCFMHVVXIVWGS-VXGBXAGGSA-N 2 0 200.370 2.351 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+]Cc1cccs1 ZINC000049551896 344652986 /nfs/dbraw/zinc/65/29/86/344652986.db2.gz AIRLVVYRFRWMJR-JTQLQIEISA-N 2 0 212.362 2.178 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H]1[C@@H](C)[C@@H](C)O[C@H]1C ZINC000625975925 344640263 /nfs/dbraw/zinc/64/02/63/344640263.db2.gz FRCUZDVTUIUZNZ-CRWXNKLISA-N 2 0 242.407 2.120 20 0 BEADRP CC/C=C/C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000385094030 344884905 /nfs/dbraw/zinc/88/49/05/344884905.db2.gz YNIMPVSQMNCDLT-PYDIIWFVSA-N 2 0 222.376 2.463 20 0 BEADRP CC/C=C\C[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000385094027 344885425 /nfs/dbraw/zinc/88/54/25/344885425.db2.gz YNIMPVSQMNCDLT-JXABGOGHSA-N 2 0 222.376 2.463 20 0 BEADRP C[NH+](C)C[C@@H]1CC[N@H+](C[C@@]2(C)CCCS2)C1 ZINC000628174021 344894508 /nfs/dbraw/zinc/89/45/08/344894508.db2.gz UJQKNQIQNIRSLT-QWHCGFSZSA-N 2 0 242.432 2.156 20 0 BEADRP C[NH+]1CCC(C)(C[NH2+][C@@H]2CC[C@H]2C2CC2)CC1 ZINC000348377527 537879281 /nfs/dbraw/zinc/87/92/81/537879281.db2.gz NDOWMLYBPPPPJC-UONOGXRCSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H]1CC[C@]2(CC[N@H+](CC34CC(C3)C[NH2+]4)C2)C1 ZINC000634993344 345189972 /nfs/dbraw/zinc/18/99/72/345189972.db2.gz RGXBIWJSOMYDSP-LQULJDIASA-N 2 0 234.387 2.251 20 0 BEADRP CC(C)[C@H](C[NH3+])CNc1ccc([C@@H](C)[NH3+])cc1 ZINC000634995034 345183788 /nfs/dbraw/zinc/18/37/88/345183788.db2.gz SOJZPKJGPAWRKC-DGCLKSJQSA-N 2 0 235.375 2.349 20 0 BEADRP C[C@@]1(C[NH+]2CCC(CCF)CC2)CC[NH2+]C1 ZINC000634998277 345198336 /nfs/dbraw/zinc/19/83/36/345198336.db2.gz CVOVGCJXJTZDIN-CYBMUJFWSA-N 2 0 228.355 2.058 20 0 BEADRP CC(C)C[C@@H]([NH3+])C[NH2+][C@@H]1CCCC12CC2 ZINC000634998773 345198892 /nfs/dbraw/zinc/19/88/92/345198892.db2.gz KQXIGUZYHYECNR-VXGBXAGGSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)C[C@H]([NH3+])C[NH2+][C@@H]1CCCC12CC2 ZINC000634998771 345199211 /nfs/dbraw/zinc/19/92/11/345199211.db2.gz KQXIGUZYHYECNR-NWDGAFQWSA-N 2 0 210.365 2.282 20 0 BEADRP CCOc1ccc(C[N@@H+]2C[C@H](C)[C@H](C[NH3+])C2)cc1 ZINC000634999847 345201291 /nfs/dbraw/zinc/20/12/91/345201291.db2.gz AQURBSVDWVUSQA-GXTWGEPZSA-N 2 0 248.370 2.112 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)c1ccncc1 ZINC000635007330 345202854 /nfs/dbraw/zinc/20/28/54/345202854.db2.gz PHNPPKFIHJOLQR-OBJOEFQTSA-N 2 0 233.359 2.250 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCCC12CC2)[C@H]1CCC[NH2+]1 ZINC000635004142 345206853 /nfs/dbraw/zinc/20/68/53/345206853.db2.gz NIZKQMVSGFFRPZ-QJPTWQEYSA-N 2 0 208.349 2.049 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCCC12CC2)[C@@H]1CCC[NH2+]1 ZINC000635004135 345207170 /nfs/dbraw/zinc/20/71/70/345207170.db2.gz NIZKQMVSGFFRPZ-GRYCIOLGSA-N 2 0 208.349 2.049 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCCC12CC2 ZINC000635004314 345207490 /nfs/dbraw/zinc/20/74/90/345207490.db2.gz OGBBHHGKVYFOSK-SDDRHHMPSA-N 2 0 208.349 2.036 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]([NH3+])Cc1ccccc1)C1CC1 ZINC000635004665 345208770 /nfs/dbraw/zinc/20/87/70/345208770.db2.gz JWNZMHJFOVRCMR-DOMZBBRYSA-N 2 0 232.371 2.335 20 0 BEADRP [NH3+]C[C@H]1CC[C@H]([NH2+][C@@H]2CCC23CCC3)CC1 ZINC000635004652 345208778 /nfs/dbraw/zinc/20/87/78/345208778.db2.gz JPYRBLDJPCUFOZ-JHJVBQTASA-N 2 0 222.376 2.426 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+][C@H]1CC[C@H](C[NH3+])CC1 ZINC000635005038 345209104 /nfs/dbraw/zinc/20/91/04/345209104.db2.gz LJSFZXKQMHEXNP-LPWJVIDDSA-N 2 0 210.365 2.282 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+][C@H]1CC[C@H](C[NH3+])CC1 ZINC000635005036 345209266 /nfs/dbraw/zinc/20/92/66/345209266.db2.gz LJSFZXKQMHEXNP-FDYHWXHSSA-N 2 0 210.365 2.282 20 0 BEADRP CCC[C@H](CCO)[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000635005982 345210074 /nfs/dbraw/zinc/21/00/74/345210074.db2.gz XCGZDQIGHBKSRF-KCPJHIHWSA-N 2 0 248.370 2.272 20 0 BEADRP Cc1ncc([C@H](C)[NH2+][C@@H](C)C[C@@H](C)[NH3+])s1 ZINC000635006334 345210486 /nfs/dbraw/zinc/21/04/86/345210486.db2.gz MDFABEYSOMKLKH-VGMNWLOBSA-N 2 0 227.377 2.228 20 0 BEADRP [NH3+]CC1CCC([NH2+][C@@H]2C[C@H]2C(F)(F)F)CC1 ZINC000635010882 345212803 /nfs/dbraw/zinc/21/28/03/345212803.db2.gz BVXNKTLZVGEJHG-YDYPAMBWSA-N 2 0 236.281 2.044 20 0 BEADRP C[C@H](CC1CCC1)[NH2+][C@@H](C)[C@H]1CCC[NH2+]1 ZINC000635011370 345213929 /nfs/dbraw/zinc/21/39/29/345213929.db2.gz FBUAJSQSXDRHFU-NTZNESFSSA-N 2 0 210.365 2.295 20 0 BEADRP COC[C@H]([NH2+][C@H]1CC[NH2+]CC(C)(C)C1)C(C)C ZINC000635009258 345216419 /nfs/dbraw/zinc/21/64/19/345216419.db2.gz GOGVGIBIIOSHNN-STQMWFEESA-N 2 0 242.407 2.025 20 0 BEADRP COC[C@@H]([NH2+][C@H]1CC[NH2+]CC(C)(C)C1)C(C)C ZINC000635009257 345216718 /nfs/dbraw/zinc/21/67/18/345216718.db2.gz GOGVGIBIIOSHNN-QWHCGFSZSA-N 2 0 242.407 2.025 20 0 BEADRP CCSCC[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C)C1 ZINC000158467771 345336144 /nfs/dbraw/zinc/33/61/44/345336144.db2.gz CATCVZCDHXHIPW-OLZOCXBDSA-N 2 0 242.432 2.156 20 0 BEADRP CCSCC[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C)C1 ZINC000158467618 345336252 /nfs/dbraw/zinc/33/62/52/345336252.db2.gz CATCVZCDHXHIPW-CHWSQXEVSA-N 2 0 242.432 2.156 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000081636373 345488610 /nfs/dbraw/zinc/48/86/10/345488610.db2.gz AKYXCMLBQAYLRP-ZDUSSCGKSA-N 2 0 210.365 2.060 20 0 BEADRP COCC[C@H](C)[NH2+]C1CCC(C[NH+](C)C)CC1 ZINC000090668723 345574382 /nfs/dbraw/zinc/57/43/82/345574382.db2.gz SXDWQXWIFCOLED-HSBZDZAISA-N 2 0 242.407 2.121 20 0 BEADRP Clc1cc(Cl)cc(CN[C@@H]2CC[NH2+]C2)c1 ZINC000216081989 345743222 /nfs/dbraw/zinc/74/32/22/345743222.db2.gz JNJNPCDEIGJTBF-LLVKDONJSA-N 2 0 245.153 2.445 20 0 BEADRP CSCCCN1CCC[C@H]([NH2+]C(C)C)C1 ZINC000070585659 345788585 /nfs/dbraw/zinc/78/85/85/345788585.db2.gz DGHBYGKSJNIDEJ-LBPRGKRZSA-N 2 0 230.421 2.202 20 0 BEADRP C[NH+](C)Cc1ccc(C2=CC[NH2+]CC2)cc1 ZINC000033487574 345800727 /nfs/dbraw/zinc/80/07/27/345800727.db2.gz JAKLDDZIABVKEI-UHFFFAOYSA-N 2 0 216.328 2.125 20 0 BEADRP CSCCCC[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000401010342 346032863 /nfs/dbraw/zinc/03/28/63/346032863.db2.gz GPDFRWWBKCLYHP-RWMBFGLXSA-N 2 0 242.432 2.107 20 0 BEADRP Cc1cccc(C)c1C[N@H+]1CC[C@@H]([C@@H](C)[NH3+])C1 ZINC000163214777 179034921 /nfs/dbraw/zinc/03/49/21/179034921.db2.gz IPURWBODKIZTEQ-ZIAGYGMSSA-N 2 0 232.371 2.473 20 0 BEADRP Cc1cccc(C)c1C[NH2+]CCC[NH+](C)C ZINC000083350873 179037876 /nfs/dbraw/zinc/03/78/76/179037876.db2.gz BLEABXUXTPCVAC-UHFFFAOYSA-N 2 0 220.360 2.345 20 0 BEADRP C[C@H](CC1CC1)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000069662176 349952658 /nfs/dbraw/zinc/95/26/58/349952658.db2.gz UXGRXJAZNSKQMP-DGCLKSJQSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H](CC1CC1)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000069662170 349952721 /nfs/dbraw/zinc/95/27/21/349952721.db2.gz UXGRXJAZNSKQMP-YPMHNXCESA-N 2 0 210.365 2.106 20 0 BEADRP Cc1cccc(C[N@H+](C)CC2CC[NH2+]CC2)c1 ZINC000042435894 179064457 /nfs/dbraw/zinc/06/44/57/179064457.db2.gz YOHUDHVQMLIDFE-UHFFFAOYSA-N 2 0 232.371 2.426 20 0 BEADRP Cc1cccc(CC[NH2+][C@@H]2CN(C)C[C@@H]2C)c1 ZINC000358078623 179059458 /nfs/dbraw/zinc/05/94/58/179059458.db2.gz DILMVVGMZRCPTL-DZGCQCFKSA-N 2 0 232.371 2.077 20 0 BEADRP CC[N@H+](CC(C)C)C[C@@H]1CCCC[NH2+]C1 ZINC000669379130 537975477 /nfs/dbraw/zinc/97/54/77/537975477.db2.gz SXGIUQIZMWBNFK-CYBMUJFWSA-N 2 0 212.381 2.354 20 0 BEADRP C[C@H]([NH3+])c1ccc(N[C@H]2CCC[C@H]([NH3+])C2)cc1 ZINC000574927206 346415879 /nfs/dbraw/zinc/41/58/79/346415879.db2.gz AABRFTRHNPCYQS-JKOKRWQUSA-N 2 0 233.359 2.388 20 0 BEADRP Cc1cccc(C[N@H+]2C[C@H](C[NH3+])C[C@@H]2C)c1 ZINC000122344790 179084826 /nfs/dbraw/zinc/08/48/26/179084826.db2.gz UKQFXGDBFGXMLS-JSGCOSHPSA-N 2 0 218.344 2.164 20 0 BEADRP Cc1cccc(C[NH2+]C[C@@H](C)C[NH+](C)C)c1 ZINC000291638177 179092733 /nfs/dbraw/zinc/09/27/33/179092733.db2.gz BCVGNSDQCSVNNG-CYBMUJFWSA-N 2 0 220.360 2.282 20 0 BEADRP C[C@@H]1CCC(C)(C)[N@@H+]1CC[C@@H]1CC[NH2+]C1 ZINC000641801052 362752850 /nfs/dbraw/zinc/75/28/50/362752850.db2.gz LYCMVCPFFJSVAM-NEPJUHHUSA-N 2 0 210.365 2.249 20 0 BEADRP Cc1ccc(F)cc1C[NH2+][C@H]1C[C@@H]([NH3+])C1(C)C ZINC000641802353 362759919 /nfs/dbraw/zinc/75/99/19/362759919.db2.gz JMMMLVJWBPDGMK-OLZOCXBDSA-N 2 0 236.334 2.350 20 0 BEADRP Cc1cccnc1CN1[C@H](C)[C@@H](C)CC[C@H]1C[NH3+] ZINC000641809493 362766137 /nfs/dbraw/zinc/76/61/37/362766137.db2.gz QQADHQOFYCWAET-YUTCNCBUSA-N 2 0 247.386 2.338 20 0 BEADRP CC[NH2+]CCC[NH2+]C1CCC(C(F)F)CC1 ZINC000580181436 346617028 /nfs/dbraw/zinc/61/70/28/346617028.db2.gz XGMWYVRTKHXQTA-UHFFFAOYSA-N 2 0 234.334 2.400 20 0 BEADRP C[C@@H]([NH2+]C[C@H](C)C[NH+]1CCCC1)C1CCC1 ZINC000178243730 346662987 /nfs/dbraw/zinc/66/29/87/346662987.db2.gz PCIZFYCSEUEDIC-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)[N@H+](CCC[NH3+])Cc1cccc(F)c1 ZINC000036883458 346669304 /nfs/dbraw/zinc/66/93/04/346669304.db2.gz SEVRJVDTDRRAOJ-UHFFFAOYSA-N 2 0 224.323 2.385 20 0 BEADRP CC[C@H](C)[N@@H+]1CC[C@@H](c2nccn2C)C1 ZINC000580211796 346684694 /nfs/dbraw/zinc/68/46/94/346684694.db2.gz JRYRTROLTPEAIO-WDEREUQCSA-N 2 0 207.321 2.008 20 0 BEADRP CC[C@@H](C)[N@@H+]1CC[C@H](c2nccn2C)C1 ZINC000580211794 346685329 /nfs/dbraw/zinc/68/53/29/346685329.db2.gz JRYRTROLTPEAIO-MNOVXSKESA-N 2 0 207.321 2.008 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C2CC([NH+](C)C)C2)C[C@H]1C ZINC000580216035 346701042 /nfs/dbraw/zinc/70/10/42/346701042.db2.gz LEIIGYRSZDWGQV-BFKVFCTQSA-N 2 0 224.392 2.493 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C2CC([NH+](C)C)C2)C[C@@H]1C ZINC000580216037 346701093 /nfs/dbraw/zinc/70/10/93/346701093.db2.gz LEIIGYRSZDWGQV-LYGKVCMISA-N 2 0 224.392 2.493 20 0 BEADRP C[C@H]([NH2+]CC1=CC[N@H+](C)CC1)c1ccoc1 ZINC000381733178 346772332 /nfs/dbraw/zinc/77/23/32/346772332.db2.gz NXAUZMSYLNCZBB-NSHDSACASA-N 2 0 220.316 2.192 20 0 BEADRP C[C@@H]1OCC[C@]1(C)[NH2+]CC[C@@H]1CCCC[N@@H+]1C ZINC000300422527 346746031 /nfs/dbraw/zinc/74/60/31/346746031.db2.gz HOUFCWFYDAAVRW-IHRRRGAJSA-N 2 0 240.391 2.018 20 0 BEADRP Cc1cccc(OCC[N@@H+]2CCC[C@@H](C[NH3+])C2)c1 ZINC000011888576 179165433 /nfs/dbraw/zinc/16/54/33/179165433.db2.gz BHWFXGULFDAUQU-AWEZNQCLSA-N 2 0 248.370 2.045 20 0 BEADRP C[N@H+]1CC=C(C[NH2+][C@H]2CCC[C@H]3C[C@H]32)CC1 ZINC000378669432 346803919 /nfs/dbraw/zinc/80/39/19/346803919.db2.gz IVJMFMAPYMNJAY-MJBXVCDLSA-N 2 0 220.360 2.027 20 0 BEADRP Cc1cc(F)ccc1CN1C[C@@H]2CCC[C@]2([NH3+])C1 ZINC000622004669 370655360 /nfs/dbraw/zinc/65/53/60/370655360.db2.gz SHDLVZOGITZRBL-ZFWWWQNUSA-N 2 0 248.345 2.447 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+][C@H](C)[C@@H]1CCCC[NH2+]1 ZINC000388007558 347151806 /nfs/dbraw/zinc/15/18/06/347151806.db2.gz NAYDPHXIWLRMBS-NDBYEHHHSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+][C@@H](C)[C@H]1CCCC[NH2+]1 ZINC000388007559 347152076 /nfs/dbraw/zinc/15/20/76/347152076.db2.gz NAYDPHXIWLRMBS-QNWHQSFQSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@H]2CCC[NH2+]C2)[C@@H](C)C1 ZINC000252100166 133648720 /nfs/dbraw/zinc/64/87/20/133648720.db2.gz IGYZBENVAABSJN-RFGFWPKPSA-N 2 0 224.392 2.400 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@@H](c2cccnc2)C2CC2)C1 ZINC000581143658 347220972 /nfs/dbraw/zinc/22/09/72/347220972.db2.gz XLGILDHLVTYSNR-RBSFLKMASA-N 2 0 245.370 2.392 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000319245568 347340515 /nfs/dbraw/zinc/34/05/15/347340515.db2.gz WZTIUWXMZSDMDH-RWMBFGLXSA-N 2 0 212.381 2.400 20 0 BEADRP FC1(C[NH2+]CCCCC[NH+]2CCCC2)CC1 ZINC000382144001 347399678 /nfs/dbraw/zinc/39/96/78/347399678.db2.gz NJXXKIFOGSZWKG-UHFFFAOYSA-N 2 0 228.355 2.344 20 0 BEADRP C[C@@H](CCC(F)(F)F)[NH2+]C[C@H]1CCCN1C ZINC000390681395 347425968 /nfs/dbraw/zinc/42/59/68/347425968.db2.gz ZXVPMFCNHIRAKH-VHSXEESVSA-N 2 0 238.297 2.401 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000319487585 259396388 /nfs/dbraw/zinc/39/63/88/259396388.db2.gz GWCWRXMCIJWVGW-AVGNSLFASA-N 2 0 212.381 2.400 20 0 BEADRP Cc1ccccc1CC[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000129309014 179267467 /nfs/dbraw/zinc/26/74/67/179267467.db2.gz QMFSSZPPLOSEOF-OAHLLOKOSA-N 2 0 232.371 2.269 20 0 BEADRP Cc1ccccc1C[N@H+](C)C[C@H]1CC[NH2+]C1 ZINC000051890030 179270009 /nfs/dbraw/zinc/27/00/09/179270009.db2.gz FROQAXUHRNBWRW-ZDUSSCGKSA-N 2 0 218.344 2.036 20 0 BEADRP Cc1ccccc1C[N@H+]1CC[C@H](C[NH+](C)C)C1 ZINC000172196753 179275857 /nfs/dbraw/zinc/27/58/57/179275857.db2.gz CLAZIRNDKZUPEC-CQSZACIVSA-N 2 0 232.371 2.379 20 0 BEADRP Cc1ccccc1C[C@@H](C)[NH2+]C[C@H](C)C[NH3+] ZINC000309396111 179288193 /nfs/dbraw/zinc/28/81/93/179288193.db2.gz UMINDUQADLDYRK-DGCLKSJQSA-N 2 0 220.360 2.110 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](CC)C2CC2)C1 ZINC000151137390 192371162 /nfs/dbraw/zinc/37/11/62/192371162.db2.gz ZWAFCOFRNMHMNP-JSGCOSHPSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]C[C@H]1CCCC1(F)F ZINC000390713469 259398519 /nfs/dbraw/zinc/39/85/19/259398519.db2.gz XMCALPCWNSEMOT-NXEZZACHSA-N 2 0 220.307 2.139 20 0 BEADRP C[N@H+](CCC1CCC1)C[C@H]1CCC[NH+](C)C1 ZINC000659949755 490113084 /nfs/dbraw/zinc/11/30/84/490113084.db2.gz VYSQWASIBDEMAI-AWEZNQCLSA-N 2 0 224.392 2.450 20 0 BEADRP Cc1ccccc1[C@@H]1CCC[N@H+]1C[C@H](C)[NH3+] ZINC000336405943 179327380 /nfs/dbraw/zinc/32/73/80/179327380.db2.gz DSLRHJMTZVLHKH-JSGCOSHPSA-N 2 0 218.344 2.479 20 0 BEADRP CC[C@H](C)C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000054466859 348020241 /nfs/dbraw/zinc/02/02/41/348020241.db2.gz HNSQLEUDVURXFO-WODVXLOZSA-N 2 0 210.365 2.247 20 0 BEADRP Cc1ccccc1[C@H](C)[NH2+][C@H]1CCN(C)C1 ZINC000042544514 179339659 /nfs/dbraw/zinc/33/96/59/179339659.db2.gz BSPXSDDJBJPGJS-STQMWFEESA-N 2 0 218.344 2.350 20 0 BEADRP CCSCC[NH2+][C@@H]1CCCN2CCCC[C@@H]12 ZINC000594611917 348082107 /nfs/dbraw/zinc/08/21/07/348082107.db2.gz PGXTYLZATNFFGA-OLZOCXBDSA-N 2 0 242.432 2.346 20 0 BEADRP C[C@H](CSCCF)[NH2+]CCCC[NH+](C)C ZINC000595012968 348185391 /nfs/dbraw/zinc/18/53/91/348185391.db2.gz HAQZOZYAUKSPSQ-LLVKDONJSA-N 2 0 236.400 2.009 20 0 BEADRP CSCCC[N@@H+]1CCC[C@]2(CC[NH+](C)C2)C1 ZINC000595507812 348264984 /nfs/dbraw/zinc/26/49/84/348264984.db2.gz RGWAJMUGHTWVDK-CYBMUJFWSA-N 2 0 242.432 2.157 20 0 BEADRP CCSCC[N@@H+]1CCC[C@]2(CC[NH+](C)C2)C1 ZINC000595508854 348265084 /nfs/dbraw/zinc/26/50/84/348265084.db2.gz YVXCRVKBVZAPEO-CYBMUJFWSA-N 2 0 242.432 2.157 20 0 BEADRP C1C([NH2+][C@H]2CCSC2)CC1[NH+]1CCCCC1 ZINC000335606480 187393395 /nfs/dbraw/zinc/39/33/95/187393395.db2.gz OJRBAEIGIBJNGG-HIFPTAJRSA-N 2 0 240.416 2.098 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CCCOCC2)CC1(C)C ZINC000623484838 362909005 /nfs/dbraw/zinc/90/90/05/362909005.db2.gz DKNBOTCNWXWLQW-OLZOCXBDSA-N 2 0 240.391 2.018 20 0 BEADRP C([NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)[C@@H]1CCCS1 ZINC000128074370 187395606 /nfs/dbraw/zinc/39/56/06/187395606.db2.gz RUXARMORPGJVPC-XQQFMLRXSA-N 2 0 240.416 2.098 20 0 BEADRP CCc1ccc(CNC[C@@H]2CCC[N@H+](C)C2)o1 ZINC000051724954 323190806 /nfs/dbraw/zinc/19/08/06/323190806.db2.gz NLYRHVPBKINLCC-LBPRGKRZSA-N 2 0 236.359 2.273 20 0 BEADRP CSCC1(CC[NH2+][C@H](C)[C@@H]2CCC[NH2+]2)CC1 ZINC000596650243 348605430 /nfs/dbraw/zinc/60/54/30/348605430.db2.gz KGOQJXXXTALXOA-NEPJUHHUSA-N 2 0 242.432 2.250 20 0 BEADRP CCSC1(C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)CC1 ZINC000596653180 348606903 /nfs/dbraw/zinc/60/69/03/348606903.db2.gz SCVZHXYLOQSKMT-FOSCPWQOSA-N 2 0 240.416 2.145 20 0 BEADRP CCC(CC)[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000250372699 535083572 /nfs/dbraw/zinc/08/35/72/535083572.db2.gz AMBGMZFHRRFJPT-STQMWFEESA-N 2 0 210.365 2.391 20 0 BEADRP CSC[C@H](C)[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC000598965329 349068882 /nfs/dbraw/zinc/06/88/82/349068882.db2.gz XZFGIMGPBLHBSB-WDEREUQCSA-N 2 0 230.421 2.200 20 0 BEADRP CCC[N@H+](C)C[C@H]1CC[NH+]([C@H](C)CC)C1 ZINC000248375589 349126878 /nfs/dbraw/zinc/12/68/78/349126878.db2.gz XFYATVOPTXIIJU-CHWSQXEVSA-N 2 0 212.381 2.449 20 0 BEADRP CC[C@H](C)C[NH2+][C@@H]1CC[N@H+](C)[C@H]2CCC[C@@H]21 ZINC000421873248 192397857 /nfs/dbraw/zinc/39/78/57/192397857.db2.gz HHIUTPUKYSLNGT-DGAVXFQQSA-N 2 0 224.392 2.495 20 0 BEADRP CCOc1cccc(C[N@@H+]2CC[C@H]([NH3+])C[C@H]2C)c1 ZINC000252687380 349210172 /nfs/dbraw/zinc/21/01/72/349210172.db2.gz LDDBVEJWLULUKB-OCCSQVGLSA-N 2 0 248.370 2.397 20 0 BEADRP CC[C@](C)(C[NH2+][C@H](C)C1CC[NH+](C)CC1)OC ZINC000322568094 538035513 /nfs/dbraw/zinc/03/55/13/538035513.db2.gz YOQHTALEZQKKEY-TZMCWYRMSA-N 2 0 242.407 2.121 20 0 BEADRP CC(C)(C)CCC[N@@H+]1CCC[C@@H](C[NH3+])C1 ZINC000300835216 349357650 /nfs/dbraw/zinc/35/76/50/349357650.db2.gz ILTZZZLQAAWTPN-LBPRGKRZSA-N 2 0 212.381 2.483 20 0 BEADRP CC[C@@H]([NH2+]CCC[NH+](CC)CC)[C@@H]1CCOC1 ZINC000131453659 191014214 /nfs/dbraw/zinc/01/42/14/191014214.db2.gz NNVUWGQZUIUAIU-ZIAGYGMSSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@H](c1ccncc1)N1CC[C@@H](C[NH+](C)C)C1 ZINC000603939454 350056738 /nfs/dbraw/zinc/05/67/38/350056738.db2.gz MDFBZUHXMQTVKY-OLZOCXBDSA-N 2 0 233.359 2.026 20 0 BEADRP CCC(CC)[C@H](O)C[NH2+][C@@H]1CCCCC[C@H]1[NH3+] ZINC000422700754 192434352 /nfs/dbraw/zinc/43/43/52/192434352.db2.gz ANCRXIVQAYBNEK-MGPQQGTHSA-N 2 0 242.407 2.033 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CCO[C@H]1CCCC[C@H]1C ZINC000422711435 192438228 /nfs/dbraw/zinc/43/82/28/192438228.db2.gz NCIWDGGMNUOZLP-MCIONIFRSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]Cc1ccc2ccccc2n1 ZINC000422706664 192436216 /nfs/dbraw/zinc/43/62/16/192436216.db2.gz UULXXNBMRRXLOU-LBPRGKRZSA-N 2 0 243.354 2.452 20 0 BEADRP [NH3+]CC1CCC([NH2+]Cc2ccc(F)cc2)CC1 ZINC000422727103 192444385 /nfs/dbraw/zinc/44/43/85/192444385.db2.gz GPBFVXGYZWJFLN-UHFFFAOYSA-N 2 0 236.334 2.433 20 0 BEADRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)C1CCCC1 ZINC000422732587 192446255 /nfs/dbraw/zinc/44/62/55/192446255.db2.gz PYPPABOGIADVLG-RAQOOLMWSA-N 2 0 222.376 2.438 20 0 BEADRP Cc1ccc([C@H](C)[NH2+][C@H](C)C2C[NH2+]C2)cc1 ZINC000422718640 192441198 /nfs/dbraw/zinc/44/11/98/192441198.db2.gz LQHGRNLAVAVCGS-NWDGAFQWSA-N 2 0 218.344 2.254 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCC[C@H]3C[C@H]32)CCN1C ZINC000304424142 350155527 /nfs/dbraw/zinc/15/55/27/350155527.db2.gz AHHRONQSITVESW-MBJXGIAVSA-N 2 0 222.376 2.247 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCC[C@H]1C)C[NH+]1CCCC1 ZINC000083402361 350196461 /nfs/dbraw/zinc/19/64/61/350196461.db2.gz WMRXFPXICXMAJT-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1ccc(OCC[NH2+][C@H]2CCC[C@@H]2C[NH3+])cc1 ZINC000422757438 192456015 /nfs/dbraw/zinc/45/60/15/192456015.db2.gz MUBCAQRKROLPJD-HIFRSBDPSA-N 2 0 248.370 2.091 20 0 BEADRP C[C@H](F)CC[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623533115 362952621 /nfs/dbraw/zinc/95/26/21/362952621.db2.gz TXTZGDBRMSKNIH-QWRGUYRKSA-N 2 0 216.344 2.197 20 0 BEADRP C[C@H](F)CC[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623533116 362952683 /nfs/dbraw/zinc/95/26/83/362952683.db2.gz TXTZGDBRMSKNIH-WDEREUQCSA-N 2 0 216.344 2.197 20 0 BEADRP CC(C)[C@H](C)[NH2+]Cc1ccc(C[NH3+])cc1 ZINC000319251420 350265134 /nfs/dbraw/zinc/26/51/34/350265134.db2.gz XTIGSKVAVVXQOG-NSHDSACASA-N 2 0 206.333 2.279 20 0 BEADRP CC[C@@H]([NH2+][C@@H](C)C1C[NH2+]C1)c1ccccc1 ZINC000422777901 192464586 /nfs/dbraw/zinc/46/45/86/192464586.db2.gz GQABXBBBVFYHPT-SMDDNHRTSA-N 2 0 218.344 2.335 20 0 BEADRP C[C@H](Cc1ccsc1)[NH2+][C@@H]1CC[NH2+]C[C@H]1C ZINC000309339126 350322830 /nfs/dbraw/zinc/32/28/30/350322830.db2.gz KHUMXFONCCFESO-NQBHXWOUSA-N 2 0 238.400 2.267 20 0 BEADRP Cc1ncsc1CN1CCC[C@H](C)[C@H]1C[NH3+] ZINC000228290507 180316356 /nfs/dbraw/zinc/31/63/56/180316356.db2.gz PRBUBWTUBUPDTO-GXSJLCMTSA-N 2 0 239.388 2.011 20 0 BEADRP Cc1ncsc1C[NH2+][C@H](C)CCCC[NH3+] ZINC000308862406 180321778 /nfs/dbraw/zinc/32/17/78/180321778.db2.gz PQJFEFFEQSBOQU-SECBINFHSA-N 2 0 227.377 2.059 20 0 BEADRP CC[C@](C)(C[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1)OC ZINC000623538714 362958752 /nfs/dbraw/zinc/95/87/52/362958752.db2.gz RIBKIFNNWZBMRI-TZMCWYRMSA-N 2 0 242.407 2.264 20 0 BEADRP CC(C)[C@@H]1C[C@@H]([NH2+][C@H](C)CC[NH+](C)C)CCO1 ZINC000227104473 350482197 /nfs/dbraw/zinc/48/21/97/350482197.db2.gz GDCZFBDZZJVULH-RDBSUJKOSA-N 2 0 242.407 2.120 20 0 BEADRP CC[C@@H](C[NH2+]CCC[NH2+]C)c1ccccc1 ZINC000163308242 350516945 /nfs/dbraw/zinc/51/69/45/350516945.db2.gz FQTZHEVQVMLYAP-ZDUSSCGKSA-N 2 0 220.360 2.379 20 0 BEADRP CC[NH2+][C@H]1CCCC[C@H]1C[NH+](CC)CC ZINC000060720697 350499046 /nfs/dbraw/zinc/49/90/46/350499046.db2.gz NNLSWNZYQXHCHB-STQMWFEESA-N 2 0 212.381 2.497 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C[C@@H]2C[C@H]2C2CC2)CC1(C)C ZINC000623542613 362961198 /nfs/dbraw/zinc/96/11/98/362961198.db2.gz LGTQWMYNLAJUPW-IHRRRGAJSA-N 2 0 236.403 2.495 20 0 BEADRP CC[C@@H]1CCC[C@H]([NH2+]CCC[NH+](C)C)C1 ZINC000070562241 350535985 /nfs/dbraw/zinc/53/59/85/350535985.db2.gz IVLYXTLGKJCNOF-OLZOCXBDSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+][C@@H]2CC[N@H+](C)C(C)(C)C2)O1 ZINC000623545187 362964934 /nfs/dbraw/zinc/96/49/34/362964934.db2.gz AAXAGOUQTLARPD-JHJVBQTASA-N 2 0 240.391 2.016 20 0 BEADRP CC[C@@H]1CCC[C@H]1[NH2+]CC1=CC[NH2+]CC1 ZINC000577483026 365965325 /nfs/dbraw/zinc/96/53/25/365965325.db2.gz GGFZHIRJJQPLED-CHWSQXEVSA-N 2 0 208.349 2.074 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+]Cc1cccs1 ZINC000129218480 490609117 /nfs/dbraw/zinc/60/91/17/490609117.db2.gz QQSJLUMPMGLOOU-LLVKDONJSA-N 2 0 212.362 2.211 20 0 BEADRP CCC(C)(C)CC[N@@H+]1CC[C@@H]2[NH2+]CC[C@@H]2C1 ZINC000428029321 191109451 /nfs/dbraw/zinc/10/94/51/191109451.db2.gz ABSCJAUJNRPTGF-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP COCC[C@@H](C)C[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623548950 362969343 /nfs/dbraw/zinc/96/93/43/362969343.db2.gz KAYCSAXXVSPELE-OLZOCXBDSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H]([NH2+]CCN1CCC[C@H](C)C1)C1(C)CC1 ZINC000156702928 191116471 /nfs/dbraw/zinc/11/64/71/191116471.db2.gz DDIDMQIMQRGEHS-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H]([NH2+][C@@H](C)CCC[NH3+])c1ccncc1 ZINC000422792450 192469911 /nfs/dbraw/zinc/46/99/11/192469911.db2.gz XANIAUASQWFTGW-WCQYABFASA-N 2 0 221.348 2.250 20 0 BEADRP C/C=C\C[NH2+]Cc1ccc(OCC[NH+](C)C)cc1 ZINC000623739078 350883349 /nfs/dbraw/zinc/88/33/49/350883349.db2.gz HRYOVOWNFOZSSD-PLNGDYQASA-N 2 0 248.370 2.293 20 0 BEADRP CCCC[C@H](C)[NH2+]C[C@@H](C)C[NH+](C)C ZINC000336691297 350984184 /nfs/dbraw/zinc/98/41/84/350984184.db2.gz PSFRJFLOSHKMGP-NEPJUHHUSA-N 2 0 200.370 2.352 20 0 BEADRP CCCC[C@H](C)[NH2+]C[C@H](C)C[NH+](C)C ZINC000336691300 350984207 /nfs/dbraw/zinc/98/42/07/350984207.db2.gz PSFRJFLOSHKMGP-RYUDHWBXSA-N 2 0 200.370 2.352 20 0 BEADRP CCCN1CC[C@@H]([NH2+][C@@H](C)[C@@H]2C[C@H]2C2CC2)C1 ZINC000623572974 363003448 /nfs/dbraw/zinc/00/34/48/363003448.db2.gz TZYQNNRHEUOHEK-ATGSNQNLSA-N 2 0 236.403 2.495 20 0 BEADRP CSCC[NH2+][C@@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000086501073 351165561 /nfs/dbraw/zinc/16/55/61/351165561.db2.gz KDGUJAZBECZYMI-NWDGAFQWSA-N 2 0 230.421 2.250 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]C[C@@]2(C)CCCS2)C1 ZINC000628326973 351263788 /nfs/dbraw/zinc/26/37/88/351263788.db2.gz CZDMTAMSDAFSIC-FRRDWIJNSA-N 2 0 242.432 2.202 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+]CC2CC=CC2)CC1(C)C ZINC000623612615 363051963 /nfs/dbraw/zinc/05/19/63/363051963.db2.gz BERBWRLFVGNGJG-CYBMUJFWSA-N 2 0 222.376 2.415 20 0 BEADRP C[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1)c1cncs1 ZINC000577731081 366046792 /nfs/dbraw/zinc/04/67/92/366046792.db2.gz YALPHXGWAAYPCR-SNVBAGLBSA-N 2 0 247.367 2.453 20 0 BEADRP CCC[C@H](C[NH+]1CCC(C[NH+](C)C)CC1)OC ZINC000637906715 351776363 /nfs/dbraw/zinc/77/63/63/351776363.db2.gz CXWLMZHPDHPICR-CQSZACIVSA-N 2 0 242.407 2.075 20 0 BEADRP c1ccc(C[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)cc1 ZINC000307298458 351912338 /nfs/dbraw/zinc/91/23/38/351912338.db2.gz AJKXLOLBWRVZPN-QLFBSQMISA-N 2 0 230.355 2.164 20 0 BEADRP CCC[N@H+](CC1CCC1)C1CC[NH2+]CC1 ZINC000083839902 351957174 /nfs/dbraw/zinc/95/71/74/351957174.db2.gz KROPPIDWOMRNKJ-UHFFFAOYSA-N 2 0 210.365 2.251 20 0 BEADRP CC[C@H](C)[C@@H](C[NH2+]CCC[N@H+](C)C(C)C)OC ZINC000638337034 352155434 /nfs/dbraw/zinc/15/54/34/352155434.db2.gz BOUGLVCJNMSXDN-UONOGXRCSA-N 2 0 244.423 2.367 20 0 BEADRP C[C@@H](C[NH2+]C[C@@H]1C[C@H]2C[C@H]2C1)C[NH+]1CCCC1 ZINC000638387825 352197117 /nfs/dbraw/zinc/19/71/17/352197117.db2.gz YGIPMPIYUAXIQF-XQLPTFJDSA-N 2 0 236.403 2.354 20 0 BEADRP CC[C@@H](C[NH2+]C[C@@](C)(CC)OC)N1CCCC1 ZINC000638353525 352167605 /nfs/dbraw/zinc/16/76/05/352167605.db2.gz APBFZMRNCQUGEX-UONOGXRCSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@H](c1ccccc1)[N@@H+]1C[C@@H]2CC[C@H]([NH3+])[C@@H]2C1 ZINC000212584109 363118977 /nfs/dbraw/zinc/11/89/77/363118977.db2.gz WSZJTFIYZKVUHL-BEAPCOKYSA-N 2 0 230.355 2.417 20 0 BEADRP CCC[C@H](C[NH2+]C[C@@H]1CC[N@H+](CCC)C1)OC ZINC000638410037 352217520 /nfs/dbraw/zinc/21/75/20/352217520.db2.gz TYLJAJMWWOJSKD-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP C(=C\c1ccccc1)\C[NH2+][C@H]1CCC[NH2+]CC1 ZINC000414919669 352282398 /nfs/dbraw/zinc/28/23/98/352282398.db2.gz VOHJJPQDTGBFIK-UVCVVPOWSA-N 2 0 230.355 2.432 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H]1CCCC[C@@H]1OC ZINC000037211030 358470338 /nfs/dbraw/zinc/47/03/38/358470338.db2.gz MFJYQWWYRRLRNP-KGLIPLIRSA-N 2 0 242.407 2.266 20 0 BEADRP CC(C)[C@H]1CCCC[N@@H+]1CC1CC[NH2+]CC1 ZINC000178973771 535176360 /nfs/dbraw/zinc/17/63/60/535176360.db2.gz UVKOWESIIKSBQR-CQSZACIVSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1cccc(C[NH2+]C[C@@H]2CCC[N@@H+](C)C2)c1 ZINC000044535124 352351554 /nfs/dbraw/zinc/35/15/54/352351554.db2.gz SROFFZXXOCXQIP-HNNXBMFYSA-N 2 0 232.371 2.426 20 0 BEADRP C[NH+]1CCC(CC[NH2+]C[C@@H]2C[C@H]3C[C@H]3C2)CC1 ZINC000638566097 352391799 /nfs/dbraw/zinc/39/17/99/352391799.db2.gz AASSFJFCZMUKBH-QDMKHBRRSA-N 2 0 236.403 2.354 20 0 BEADRP Cc1ccc(CC[NH2+]C[C@@H]2CCC[N@@H+](C)C2)cc1 ZINC000638589801 352420867 /nfs/dbraw/zinc/42/08/67/352420867.db2.gz YUSQGFPGBTYZDM-INIZCTEOSA-N 2 0 246.398 2.469 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C2CCCCCC2)CC[NH2+]1 ZINC000235407631 187789151 /nfs/dbraw/zinc/78/91/51/187789151.db2.gz NYPFZJFPGKJMLM-YPMHNXCESA-N 2 0 210.365 2.439 20 0 BEADRP C[N@H+](CC1CCCCC1)CC1CC[NH2+]CC1 ZINC000042495606 352622082 /nfs/dbraw/zinc/62/20/82/352622082.db2.gz RBTRBMZOEPVUSC-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP COC1([C@@H](C)[NH2+]CCC[NH+]2CCCC2)CCC1 ZINC000412024889 191239964 /nfs/dbraw/zinc/23/99/64/191239964.db2.gz ONJVKWBMXIVWJR-CYBMUJFWSA-N 2 0 240.391 2.020 20 0 BEADRP CC1([NH2+]CC2CC[NH2+]CC2)Cc2ccccc2C1 ZINC000336054616 535188057 /nfs/dbraw/zinc/18/80/57/535188057.db2.gz MPBBXFUQXDVPQM-UHFFFAOYSA-N 2 0 244.382 2.133 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C2CCC([NH+](C)C)CC2)CCO1 ZINC000334217134 352817852 /nfs/dbraw/zinc/81/78/52/352817852.db2.gz CRQOQLCAKZPSIV-NELGMTEASA-N 2 0 240.391 2.016 20 0 BEADRP C[N@@H+]1CCCC12CCN(Cc1cccnc1)CC2 ZINC000334243049 352831248 /nfs/dbraw/zinc/83/12/48/352831248.db2.gz QYUNNVZEFPDOOW-UHFFFAOYSA-N 2 0 245.370 2.142 20 0 BEADRP CO[C@@H](C[NH2+][C@H](C)CCCC[NH3+])C(C)(C)C ZINC000422812124 192477279 /nfs/dbraw/zinc/47/72/79/192477279.db2.gz PYALAPYLOZYXGG-NEPJUHHUSA-N 2 0 230.396 2.155 20 0 BEADRP CC(C)([NH3+])C[N@@H+]1CCCC2(CCCC2)C1 ZINC000261582003 535198588 /nfs/dbraw/zinc/19/85/88/535198588.db2.gz NXRSFUFXMMVTEB-UHFFFAOYSA-N 2 0 210.365 2.380 20 0 BEADRP CC(C)CC[C@@H](C)[NH2+]C[C@@H]([NH3+])C(C)C ZINC000414791278 259433986 /nfs/dbraw/zinc/43/39/86/259433986.db2.gz HMYMTISQZDSKPF-VXGBXAGGSA-N 2 0 200.370 2.384 20 0 BEADRP C(C[NH2+][C@@H]1CCC[C@@H]2C[C@@H]21)C[NH+]1CCCC1 ZINC000304582216 188076174 /nfs/dbraw/zinc/07/61/74/188076174.db2.gz OHZMBUHPQPZXNM-HZSPNIEDSA-N 2 0 222.376 2.251 20 0 BEADRP Cc1nc(CNCC2([NH3+])CCCCC2)cs1 ZINC000049539068 353167961 /nfs/dbraw/zinc/16/79/61/353167961.db2.gz BSCNFSBLIYXPPK-UHFFFAOYSA-N 2 0 239.388 2.203 20 0 BEADRP CC(C)C[C@H](C)C[N@@H+]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000309436650 188137318 /nfs/dbraw/zinc/13/73/18/188137318.db2.gz NEGDYMYOAIEQQS-MELADBBJSA-N 2 0 224.392 2.210 20 0 BEADRP C(C1CCCC1)[N@H+]1CC[C@H]2C[NH2+]C[C@H]2CC1 ZINC000335269668 188161603 /nfs/dbraw/zinc/16/16/03/188161603.db2.gz MJCDWBLOTQAXSL-OKILXGFUSA-N 2 0 222.376 2.108 20 0 BEADRP CC1(C)CC[C@H]1[NH2+][C@@H]1CCc2nc[nH]c2C1 ZINC000335602627 188161967 /nfs/dbraw/zinc/16/19/67/188161967.db2.gz ZXTBMSGCNJBWJI-BXKDBHETSA-N 2 0 219.332 2.045 20 0 BEADRP C[C@@H]([NH2+]CCCC1CC1)C1CC[NH+](C)CC1 ZINC000161717968 538111660 /nfs/dbraw/zinc/11/16/60/538111660.db2.gz ZJIWAXFGZZYYBG-GFCCVEGCSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)C[C@H](C)C[C@H](C)[NH2+]CCC[NH3+] ZINC000308851067 188165046 /nfs/dbraw/zinc/16/50/46/188165046.db2.gz RGWMNOWTMHRVHI-RYUDHWBXSA-N 2 0 200.370 2.386 20 0 BEADRP CCO[C@@H]1C[C@@H]1[NH2+][C@@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000563700101 353274089 /nfs/dbraw/zinc/27/40/89/353274089.db2.gz FQJLFMUTJZYHGI-XDQVBPFNSA-N 2 0 240.391 2.064 20 0 BEADRP c1coc(CC[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)c1 ZINC000250069967 353267439 /nfs/dbraw/zinc/26/74/39/353267439.db2.gz ACTOBCLKHMPQNO-RRFJBIMHSA-N 2 0 248.370 2.332 20 0 BEADRP CC[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)C2CCC2)C1 ZINC000336768281 353279301 /nfs/dbraw/zinc/27/93/01/353279301.db2.gz QSIOFSOHALNVRB-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H](Cc1ccsc1)[NH2+]CCC[NH+](C)C ZINC000122115430 324029031 /nfs/dbraw/zinc/02/90/31/324029031.db2.gz ZANSPWJRRKDQNH-LLVKDONJSA-N 2 0 226.389 2.220 20 0 BEADRP C(C1CCCCCC1)[NH+]1C[C@H]2C[NH2+]C[C@@H]2C1 ZINC000085282046 538115927 /nfs/dbraw/zinc/11/59/27/538115927.db2.gz VBPQKOQVDGJQBO-ZIAGYGMSSA-N 2 0 222.376 2.108 20 0 BEADRP CC1(C)C[N@H+](CCC2CC[NH2+]CC2)CCS1 ZINC000133359429 353414704 /nfs/dbraw/zinc/41/47/04/353414704.db2.gz NCMMWPGIYZOMLW-UHFFFAOYSA-N 2 0 242.432 2.204 20 0 BEADRP C[C@@H]([NH2+]CCOC(C)(C)C)C1CC[NH+](C)CC1 ZINC000308727735 538117343 /nfs/dbraw/zinc/11/73/43/538117343.db2.gz HMSOJBIFHCDJAB-GFCCVEGCSA-N 2 0 242.407 2.121 20 0 BEADRP C(CC1CCCC1)C[N@@H+]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000357068183 188422203 /nfs/dbraw/zinc/42/22/03/188422203.db2.gz DKWFPLQEUWACPA-HUUCEWRRSA-N 2 0 236.403 2.498 20 0 BEADRP CC[C@@H]1C[C@H](C)C[N@@H+]1CCCn1ccnc1 ZINC000343306099 353524866 /nfs/dbraw/zinc/52/48/66/353524866.db2.gz UPDMOSXZSHPAFQ-QWHCGFSZSA-N 2 0 221.348 2.394 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@@H]1CCC[C@H]2C[C@H]21 ZINC000308877935 353586593 /nfs/dbraw/zinc/58/65/93/353586593.db2.gz UVSCMMZSQTZCPH-YNEHKIRRSA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@H]([NH2+]C[C@@H](C)C[NH3+])c1ccccc1OC ZINC000336716535 188438710 /nfs/dbraw/zinc/43/87/10/188438710.db2.gz QDHSRUGIFNRBQG-AAEUAGOBSA-N 2 0 236.359 2.331 20 0 BEADRP CCC[C@@H](C[N@H+](C)CCC[NH+]1CCCC1)OC ZINC000639132482 353841709 /nfs/dbraw/zinc/84/17/09/353841709.db2.gz OXMHJDXAIAXNLM-AWEZNQCLSA-N 2 0 242.407 2.219 20 0 BEADRP Cc1cc(C)cc(C[NH2+]CCCC[NH3+])c1 ZINC000043393582 188505782 /nfs/dbraw/zinc/50/57/82/188505782.db2.gz GLCMSGKUVOYGHC-UHFFFAOYSA-N 2 0 206.333 2.132 20 0 BEADRP C[NH+](C)CCC[N@H+](C)C[C@@H]1CC=CCC1 ZINC000344023530 354084406 /nfs/dbraw/zinc/08/44/06/354084406.db2.gz ATDQTZWWDFPTKN-CYBMUJFWSA-N 2 0 210.365 2.226 20 0 BEADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)[C@H]2CC2(F)F)C1 ZINC000639170765 354125545 /nfs/dbraw/zinc/12/55/45/354125545.db2.gz XOMWPJIQSGXCFW-SDDRHHMPSA-N 2 0 246.345 2.350 20 0 BEADRP CC(C)[N@@H+]1CC[C@H](C[NH2+][C@@H](C)[C@H]2CC2(F)F)C1 ZINC000639170764 354126029 /nfs/dbraw/zinc/12/60/29/354126029.db2.gz XOMWPJIQSGXCFW-QJPTWQEYSA-N 2 0 246.345 2.350 20 0 BEADRP CC[C@H](C)[C@@H](C[N@H+](CC)CCC[NH+](C)C)OC ZINC000639175025 354190566 /nfs/dbraw/zinc/19/05/66/354190566.db2.gz GNOBGTUDKUDURI-UONOGXRCSA-N 2 0 244.423 2.321 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]C[C@@H]2C[C@H]2C2CC2)[C@H](C)C1 ZINC000449742833 202018515 /nfs/dbraw/zinc/01/85/15/202018515.db2.gz RMVGRGVCRSRSRX-UQOMUDLDSA-N 2 0 236.403 2.352 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)C[C@](C)(OC)C1CC1 ZINC000639175765 354206093 /nfs/dbraw/zinc/20/60/93/354206093.db2.gz PSJJBXCHWBLLDR-AWEZNQCLSA-N 2 0 242.407 2.075 20 0 BEADRP CCC[C@H](C[N@H+](C)[C@@H]1CCN(C)C[C@H]1C)OC ZINC000639180425 354278519 /nfs/dbraw/zinc/27/85/19/354278519.db2.gz WSDMMQOMWOFQNG-MGPQQGTHSA-N 2 0 242.407 2.074 20 0 BEADRP C[C@H]1CN(C)C[C@@H]1[NH2+]C1CCC(C(F)F)CC1 ZINC000334702084 354494984 /nfs/dbraw/zinc/49/49/84/354494984.db2.gz ILAOVNQNCUQJSQ-XKGSQUFQSA-N 2 0 246.345 2.350 20 0 BEADRP CSCC[N@@H+]1CCCC2(CC[NH+](C)CC2)C1 ZINC000366912488 354754342 /nfs/dbraw/zinc/75/43/42/354754342.db2.gz MMAHTPZEDJANFR-UHFFFAOYSA-N 2 0 242.432 2.157 20 0 BEADRP CC[N@H+](CCC1CC1)C[C@H]1CCC[NH2+]C1 ZINC000233466787 363403847 /nfs/dbraw/zinc/40/38/47/363403847.db2.gz PVOONYAXBSNEBW-ZDUSSCGKSA-N 2 0 210.365 2.108 20 0 BEADRP CCCC[N@H+](CC)C[C@H]1CC[NH2+][C@@H](C)C1 ZINC000232962200 363389099 /nfs/dbraw/zinc/38/90/99/363389099.db2.gz VPMCHYHOFSVVDF-STQMWFEESA-N 2 0 212.381 2.497 20 0 BEADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@@H](C)C1(C)CC1 ZINC000166032892 354871928 /nfs/dbraw/zinc/87/19/28/354871928.db2.gz NWQMAKFTGQUJOR-QWHCGFSZSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCCCC1(C)C)C1C[NH2+]C1 ZINC000335145917 354856190 /nfs/dbraw/zinc/85/61/90/354856190.db2.gz JRYBAXWVULJNIO-CMPLNLGQSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]([NH3+])c1ccc(NC2CCC([NH3+])CC2)cc1 ZINC000335174740 354941623 /nfs/dbraw/zinc/94/16/23/354941623.db2.gz DFDXQYJPCCXBSK-PWQPVHBWSA-N 2 0 233.359 2.388 20 0 BEADRP C[C@H]([NH2+]C1CCc2ccccc2CC1)C1C[NH2+]C1 ZINC000335174929 354942367 /nfs/dbraw/zinc/94/23/67/354942367.db2.gz DAOLBWWACMJQNG-LBPRGKRZSA-N 2 0 244.382 2.132 20 0 BEADRP CC1(C)CCCC[C@H]1[NH2+]C[C@@H]1CC[NH2+]C1 ZINC000335175821 354944339 /nfs/dbraw/zinc/94/43/39/354944339.db2.gz PQSKPGPESYYESS-VXGBXAGGSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1)[C@H]1CCCO1 ZINC000346559518 354968480 /nfs/dbraw/zinc/96/84/80/354968480.db2.gz OOEUZKWYGZFRKV-RFQIPJPRSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CCCC12CC[NH+](C)CC2 ZINC000335204524 355039848 /nfs/dbraw/zinc/03/98/48/355039848.db2.gz NZPLRDGYJWCREB-CHWSQXEVSA-N 2 0 222.376 2.203 20 0 BEADRP CC[C@H]1C[C@@H](C[N@H+](C)CC(C)(C)C[NH3+])CCO1 ZINC000346679950 355010976 /nfs/dbraw/zinc/01/09/76/355010976.db2.gz MKZUBORYWRXTRF-STQMWFEESA-N 2 0 242.407 2.108 20 0 BEADRP Cc1noc(C)c1CN[C@@H]1CCCCC[C@H]1[NH3+] ZINC000335192940 355025947 /nfs/dbraw/zinc/02/59/47/355025947.db2.gz HMRCPCJNTNPNTI-CHWSQXEVSA-N 2 0 237.347 2.041 20 0 BEADRP C[C@@H]([NH3+])CN1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000335229455 355071876 /nfs/dbraw/zinc/07/18/76/355071876.db2.gz FGOHWTAKSAVABB-ZYHUDNBSSA-N 2 0 238.762 2.477 20 0 BEADRP Fc1ccc2c(c1)CC[N@@H+](CC[C@@H]1CC[NH2+]C1)C2 ZINC000335238308 355100169 /nfs/dbraw/zinc/10/01/69/355100169.db2.gz FKNFGLQBQZRWEX-LBPRGKRZSA-N 2 0 248.345 2.183 20 0 BEADRP C[C@@H]1Cc2ccccc2C[N@@H+]1C[C@@H]1CCC[NH2+]C1 ZINC000346975497 355209320 /nfs/dbraw/zinc/20/93/20/355209320.db2.gz JEOZXBLISFPACL-ZIAGYGMSSA-N 2 0 244.382 2.433 20 0 BEADRP CC[C@@]1(C)CCC[N@H+](C[C@@H]2CCC[NH2+]C2)C1 ZINC000346977890 355211734 /nfs/dbraw/zinc/21/17/34/355211734.db2.gz NECZOWBPQOIPNF-KGLIPLIRSA-N 2 0 224.392 2.498 20 0 BEADRP C[NH+](C)CCCC(C)(C)[NH2+]CCC[C@@H]1CCO1 ZINC000639231811 355191365 /nfs/dbraw/zinc/19/13/65/355191365.db2.gz SMMWNUWCJKVZNK-CYBMUJFWSA-N 2 0 242.407 2.266 20 0 BEADRP CCSCC[C@@H](C)[N@H+](C)C[C@@H]1CCC[NH2+]C1 ZINC000347012158 355204835 /nfs/dbraw/zinc/20/48/35/355204835.db2.gz UUSFBSJTNKRNJK-CHWSQXEVSA-N 2 0 244.448 2.450 20 0 BEADRP CCSCC[C@H](C)[N@H+](C)C[C@@H]1CCC[NH2+]C1 ZINC000347012160 355205173 /nfs/dbraw/zinc/20/51/73/355205173.db2.gz UUSFBSJTNKRNJK-QWHCGFSZSA-N 2 0 244.448 2.450 20 0 BEADRP C[N@H+](CCCC[NH2+]CCC[C@H]1CCO1)C1CC1 ZINC000639244130 355230775 /nfs/dbraw/zinc/23/07/75/355230775.db2.gz GZYCBEIIAFBCND-AWEZNQCLSA-N 2 0 240.391 2.020 20 0 BEADRP CSC1(C[N@H+](C)C[C@H]2CCC[NH+](C)C2)CC1 ZINC000347597954 355250797 /nfs/dbraw/zinc/25/07/97/355250797.db2.gz XAZSBIQDHDBWAG-LBPRGKRZSA-N 2 0 242.432 2.156 20 0 BEADRP CCC[C@H](C[NH2+]Cc1ccc2c[nH+]cn2c1)OC ZINC000639257449 355302087 /nfs/dbraw/zinc/30/20/87/355302087.db2.gz UFZZQVYWKBGLEH-CQSZACIVSA-N 2 0 247.342 2.239 20 0 BEADRP C[C@@H]([NH3+])c1ccc(NC[C@@]2(C)CC[NH2+]C2)cc1 ZINC000414800394 191571744 /nfs/dbraw/zinc/57/17/44/191571744.db2.gz HXMGNEOCJSXJLT-RISCZKNCSA-N 2 0 233.359 2.118 20 0 BEADRP c1ccc(OCCCC[NH2+]C[C@@H]2CCC[NH2+]2)cc1 ZINC000414821938 191584530 /nfs/dbraw/zinc/58/45/30/191584530.db2.gz CZGYJPLTBGJGPZ-AWEZNQCLSA-N 2 0 248.370 2.187 20 0 BEADRP C[C@@H](C[NH2+]CC[C@H]1CC[NH2+]C1)c1ccccc1 ZINC000414830388 191590439 /nfs/dbraw/zinc/59/04/39/191590439.db2.gz LYZMTDYEPLMDKF-KBPBESRZSA-N 2 0 232.371 2.379 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CCC[C@H]([NH3+])C1 ZINC000414992013 191642483 /nfs/dbraw/zinc/64/24/83/191642483.db2.gz BKWGMWAGESETEC-VOAKCMCISA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[C@H](C[NH3+])C2)C1 ZINC000415051378 191654338 /nfs/dbraw/zinc/65/43/38/191654338.db2.gz ZIOSAHUNHQNMHS-MROQNXINSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H](CCc1ccccc1)C[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000415021654 191655821 /nfs/dbraw/zinc/65/58/21/191655821.db2.gz CHUUTTVOLYCEQR-ARLBYUKCSA-N 2 0 244.382 2.063 20 0 BEADRP CC[NH2+]Cc1cccc(NC[C@@]2(C)CC[NH2+]C2)c1 ZINC000414874404 191610393 /nfs/dbraw/zinc/61/03/93/191610393.db2.gz YCXUIFQEEPVAJV-HNNXBMFYSA-N 2 0 247.386 2.208 20 0 BEADRP Cc1c[nH+]ccc1N1CCC[C@H]([NH+](C)C)CC1 ZINC000335832602 355560163 /nfs/dbraw/zinc/56/01/63/355560163.db2.gz RPMLHVRXTSZYGP-ZDUSSCGKSA-N 2 0 233.359 2.311 20 0 BEADRP Cc1ccccc1C[NH2+]C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000415092654 191676960 /nfs/dbraw/zinc/67/69/60/191676960.db2.gz UBSUUXITIAXNLK-ZIAGYGMSSA-N 2 0 232.371 2.473 20 0 BEADRP Cc1ccsc1C[NH2+][C@@H]1CC[C@@H](C[NH3+])C1 ZINC000415032291 191658184 /nfs/dbraw/zinc/65/81/84/191658184.db2.gz HYFVZXCYLJTBSC-GHMZBOCLSA-N 2 0 224.373 2.274 20 0 BEADRP [NH3+]C[C@H]1CC[C@@H]([NH2+]Cc2cc(F)cc(F)c2)C1 ZINC000415034701 191658447 /nfs/dbraw/zinc/65/84/47/191658447.db2.gz KDNSOLMGGQRMNK-TVQRCGJNSA-N 2 0 240.297 2.182 20 0 BEADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@@H]2CCc3ccccc3C2)C1 ZINC000415034541 191658684 /nfs/dbraw/zinc/65/86/84/191658684.db2.gz JYKVUICRUUBQJO-DAXOMENPSA-N 2 0 244.382 2.261 20 0 BEADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@H]2CCc3ccccc3C2)C1 ZINC000415034542 191658806 /nfs/dbraw/zinc/65/88/06/191658806.db2.gz JYKVUICRUUBQJO-KCXAZCMYSA-N 2 0 244.382 2.261 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]CC2CCSCC2)C1 ZINC000639313604 355692054 /nfs/dbraw/zinc/69/20/54/355692054.db2.gz YYJNWOPNSYSANT-BETUJISGSA-N 2 0 242.432 2.059 20 0 BEADRP CCCN1CC[C@@H]([NH2+]C[C@H](CC(C)C)OC)C1 ZINC000639330336 355747133 /nfs/dbraw/zinc/74/71/33/355747133.db2.gz NZGNPZHIDAMDSF-KGLIPLIRSA-N 2 0 242.407 2.121 20 0 BEADRP CCCN1CCC[C@H]1C[NH2+][C@H](C)CCCOC ZINC000353986613 355748071 /nfs/dbraw/zinc/74/80/71/355748071.db2.gz JZTGXDZHBUIQAE-KGLIPLIRSA-N 2 0 242.407 2.266 20 0 BEADRP CCOc1ccc(C[N@@H+]2C[C@@H](C[NH3+])C[C@@H]2C)cc1 ZINC000216029096 355798286 /nfs/dbraw/zinc/79/82/86/355798286.db2.gz WGAVVGBFHSRTLX-GXTWGEPZSA-N 2 0 248.370 2.254 20 0 BEADRP C[C@H]1C[C@@H](C[NH3+])CN1Cc1c(F)cccc1F ZINC000216042053 355802425 /nfs/dbraw/zinc/80/24/25/355802425.db2.gz SKDAFQQLRFDGGE-UWVGGRQHSA-N 2 0 240.297 2.134 20 0 BEADRP C[C@H]1CC(C)(C)C[C@@H]1[NH2+]CCC[NH+](C)C ZINC000192390000 355982124 /nfs/dbraw/zinc/98/21/24/355982124.db2.gz YPEYTFWNVHSKKB-RYUDHWBXSA-N 2 0 212.381 2.352 20 0 BEADRP CCC(C)(C)CC[N@@H+]1C[C@@H]2CC[C@@H]([NH3+])[C@@H]2C1 ZINC000351494627 356003197 /nfs/dbraw/zinc/00/31/97/356003197.db2.gz OLTYAYQOPFGGGH-YNEHKIRRSA-N 2 0 224.392 2.482 20 0 BEADRP Cc1ccc(CC[N@@H+]2CC[C@@H]3[NH2+]CC[C@@H]3C2)cc1 ZINC000335906396 356105819 /nfs/dbraw/zinc/10/58/19/356105819.db2.gz DDUNNXGGHUFYTG-CVEARBPZSA-N 2 0 244.382 2.221 20 0 BEADRP C[C@H](F)CC[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C)C1 ZINC000351882135 356120553 /nfs/dbraw/zinc/12/05/53/356120553.db2.gz PAWWWSODHUGBPX-XQQFMLRXSA-N 2 0 228.355 2.151 20 0 BEADRP C[N@H+](CCCC[NH2+][C@H]1COC(C)(C)C1)C1CC1 ZINC000418082448 191964128 /nfs/dbraw/zinc/96/41/28/191964128.db2.gz IYPSKZZDJILSCH-GFCCVEGCSA-N 2 0 240.391 2.018 20 0 BEADRP CCc1ccc(CC[N@@H+]2CC[C@H]([C@@H](C)[NH3+])C2)cc1 ZINC000351861574 356099161 /nfs/dbraw/zinc/09/91/61/356099161.db2.gz KRIDWAGZXOIVOM-CJNGLKHVSA-N 2 0 246.398 2.461 20 0 BEADRP Cc1ccc(CC[N@H+]2CC[C@H]([C@H](C)[NH3+])C2)cc1 ZINC000351861982 356099770 /nfs/dbraw/zinc/09/97/70/356099770.db2.gz MRYFCJPGDDJQNY-ZFWWWQNUSA-N 2 0 232.371 2.207 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCCCF)[C@@H](C)C1 ZINC000351866490 356102245 /nfs/dbraw/zinc/10/22/45/356102245.db2.gz XDHSWVOCAXCIEJ-QWHCGFSZSA-N 2 0 230.371 2.398 20 0 BEADRP COC[C@@H](C)C[N@H+](C)C1CC[NH+](C(C)C)CC1 ZINC000526114538 356227251 /nfs/dbraw/zinc/22/72/51/356227251.db2.gz CSJFZNWFFWOTSH-ZDUSSCGKSA-N 2 0 242.407 2.074 20 0 BEADRP C[NH2+]C[C@@H](C)CNc1cc[nH+]c2ccc(C)cc12 ZINC000420217903 192193692 /nfs/dbraw/zinc/19/36/92/192193692.db2.gz XUFBIKQGJNSTGO-GFCCVEGCSA-N 2 0 243.354 2.233 20 0 BEADRP CCCC[N@H+](C)CC1CC[NH+](CC(C)=O)CC1 ZINC000639455795 356240993 /nfs/dbraw/zinc/24/09/93/356240993.db2.gz WRWCQFNEQJLURM-UHFFFAOYSA-N 2 0 240.391 2.019 20 0 BEADRP Cc1ccc(C[C@H]2CCC[N@H+]2C[C@H](C)[NH3+])cc1 ZINC000420298199 192204444 /nfs/dbraw/zinc/20/44/44/192204444.db2.gz GZTWYGZGJVVCHT-DZGCQCFKSA-N 2 0 232.371 2.349 20 0 BEADRP CC(C)C[N@@H+](Cc1ccccc1)C[C@H](C)[NH3+] ZINC000420296877 192204807 /nfs/dbraw/zinc/20/48/07/192204807.db2.gz CILFCLXPBYHNJA-ZDUSSCGKSA-N 2 0 220.360 2.492 20 0 BEADRP C[C@H]([NH3+])C[N@@H+]1CCCC2(CCCCC2)C1 ZINC000420298796 192205282 /nfs/dbraw/zinc/20/52/82/192205282.db2.gz HUTGDDYGRABUIM-LBPRGKRZSA-N 2 0 210.365 2.380 20 0 BEADRP CC[N@H+](CC[C@@H]1CC[NH2+]C1)[C@@H](C)C(C)C ZINC000420295765 192205671 /nfs/dbraw/zinc/20/56/71/192205671.db2.gz CQJMFDHACRFTMD-STQMWFEESA-N 2 0 212.381 2.352 20 0 BEADRP CCC[N@H+](C)C[C@@H](C[NH3+])c1ccc(OC)cc1 ZINC000420302961 192206152 /nfs/dbraw/zinc/20/61/52/192206152.db2.gz KCNMNVIXNKNETO-CYBMUJFWSA-N 2 0 236.359 2.079 20 0 BEADRP CC(C)C[C@H](C)[NH2+][C@H](C)CC[NH+](C)C ZINC000049553080 535300476 /nfs/dbraw/zinc/30/04/76/535300476.db2.gz UGCFMHVVXIVWGS-NEPJUHHUSA-N 2 0 200.370 2.351 20 0 BEADRP C[N@H+](CCCCC(F)(F)F)C1CC[NH2+]CC1 ZINC000420273940 192197334 /nfs/dbraw/zinc/19/73/34/192197334.db2.gz NZGYSXSDWYHMLV-UHFFFAOYSA-N 2 0 238.297 2.403 20 0 BEADRP C[C@H]([NH3+])[C@H]1CCCN(Cc2ncc(C3CC3)o2)C1 ZINC000420290929 192200910 /nfs/dbraw/zinc/20/09/10/192200910.db2.gz MQCWOTXBMMLLEV-JQWIXIFHSA-N 2 0 249.358 2.111 20 0 BEADRP COCCC1(C[NH2+][C@@H](C)C[C@@H](C)[NH3+])CCCC1 ZINC000422884479 192497596 /nfs/dbraw/zinc/49/75/96/192497596.db2.gz DXKFNOUQVREURF-OLZOCXBDSA-N 2 0 242.407 2.299 20 0 BEADRP CCCCC[N@@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1 ZINC000420331970 192214645 /nfs/dbraw/zinc/21/46/45/192214645.db2.gz CJEJVYJODXASAW-KGLIPLIRSA-N 2 0 224.392 2.498 20 0 BEADRP CCCCC[NH+]1CCC([C@@H]2OCC[C@H]2[NH3+])CC1 ZINC000420337048 192214751 /nfs/dbraw/zinc/21/47/51/192214751.db2.gz WICJURVEJJEJFP-KGLIPLIRSA-N 2 0 240.391 2.005 20 0 BEADRP CCCCC[N@@H+]1CCC[C@@H]([C@H]2CC[NH2+]C2)C1 ZINC000420331971 192215241 /nfs/dbraw/zinc/21/52/41/192215241.db2.gz CJEJVYJODXASAW-UONOGXRCSA-N 2 0 224.392 2.498 20 0 BEADRP CCCCC[N@@H+]1CCC[C@]2(CC[NH2+]C2)C1 ZINC000420351729 192218394 /nfs/dbraw/zinc/21/83/94/192218394.db2.gz AFUMPMNYLJTOKZ-CYBMUJFWSA-N 2 0 210.365 2.252 20 0 BEADRP C(C[N@@H+]1CCC[C@H]1C1CCC1)[C@@H]1CC[NH2+]C1 ZINC000420306639 192208729 /nfs/dbraw/zinc/20/87/29/192208729.db2.gz QREMSUZPLMMJRH-JSGCOSHPSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@@H]1CCC[C@H](C)[N@H+](CC[C@@H]2CC[NH2+]C2)C1 ZINC000420305664 192209150 /nfs/dbraw/zinc/20/91/50/192209150.db2.gz PTKXXBMWMFZTJU-RDBSUJKOSA-N 2 0 224.392 2.497 20 0 BEADRP CCc1cccc(C[N@@H+]2C[C@@H]3CC[C@H]([NH3+])[C@H]3C2)c1 ZINC000420311393 192211078 /nfs/dbraw/zinc/21/10/78/192211078.db2.gz RBDVXMNDVUEMCZ-JYJNAYRXSA-N 2 0 244.382 2.418 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CC[N@H+](CCCCC(F)(F)F)C1 ZINC000420312232 192211201 /nfs/dbraw/zinc/21/12/01/192211201.db2.gz RYRRBPFRLOPQTK-VHSXEESVSA-N 2 0 238.297 2.388 20 0 BEADRP C[C@]1(C[NH3+])CC[N@H+](CCCc2ccsc2)C1 ZINC000420313353 192212184 /nfs/dbraw/zinc/21/21/84/192212184.db2.gz JLUOTOKKOYJSRR-CYBMUJFWSA-N 2 0 238.400 2.351 20 0 BEADRP [NH3+]C1(C[NH2+]C[C@@H]2CCCC(F)(F)C2)CCC1 ZINC000420316151 192212914 /nfs/dbraw/zinc/21/29/14/192212914.db2.gz XXULTBWMDSNBSU-SNVBAGLBSA-N 2 0 232.318 2.283 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H](C)c1ccccc1C ZINC000420368810 192225802 /nfs/dbraw/zinc/22/58/02/192225802.db2.gz IKXNBCQSGCWBRU-LBPRGKRZSA-N 2 0 206.333 2.255 20 0 BEADRP CCSCC[N@@H+]1CCC[C@@H]([C@@H]2CC[NH2+]C2)C1 ZINC000420328337 192229571 /nfs/dbraw/zinc/22/95/71/192229571.db2.gz MHXCHPCZPQNTLG-CHWSQXEVSA-N 2 0 242.432 2.061 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCC[C@@H](Nc2ccccc2)C1 ZINC000420355339 192219996 /nfs/dbraw/zinc/21/99/96/192219996.db2.gz FHRCLQPXIFXNBH-OAHLLOKOSA-N 2 0 247.386 2.172 20 0 BEADRP [NH3+]CCC[NH2+][C@@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000420410996 192239872 /nfs/dbraw/zinc/23/98/72/192239872.db2.gz RNOONDRPFTYVAV-ZFWWWQNUSA-N 2 0 248.370 2.093 20 0 BEADRP C[C@@H]([NH2+]C[C@H](C)[NH3+])[C@@H](C)c1ccccc1 ZINC000420417327 192241300 /nfs/dbraw/zinc/24/13/00/192241300.db2.gz WJVMFVFYXCDKBC-QJPTWQEYSA-N 2 0 206.333 2.115 20 0 BEADRP CC[C@H](C)[NH+]1CCC([C@@H]2OCCC[C@H]2[NH3+])CC1 ZINC000420379799 192233424 /nfs/dbraw/zinc/23/34/24/192233424.db2.gz NPIBVYCVEVXRKC-YUTCNCBUSA-N 2 0 240.391 2.003 20 0 BEADRP CC(C)(C)CC[N@@H+]1CC[C@]2(C1)CCC[NH2+]C2 ZINC000336161041 134111075 /nfs/dbraw/zinc/11/10/75/134111075.db2.gz WLWZSFHMBIIMIK-CQSZACIVSA-N 2 0 224.392 2.498 20 0 BEADRP CCc1cc(N2CC[NH+](C(C)C)CC2)cc[nH+]1 ZINC000336195205 134125599 /nfs/dbraw/zinc/12/55/99/134125599.db2.gz SNVBVIMZGVGWMJ-UHFFFAOYSA-N 2 0 233.359 2.174 20 0 BEADRP C[C@H](C[C@@H]1CCCO1)[NH2+][C@@H]1CCCCC[C@H]1[NH3+] ZINC000422907308 192502584 /nfs/dbraw/zinc/50/25/84/192502584.db2.gz WWGQVGMFDIHJBL-XJFOESAGSA-N 2 0 240.391 2.194 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]CC1Cc2ccccc2C1 ZINC000422977798 192514748 /nfs/dbraw/zinc/51/47/48/192514748.db2.gz GGCKFTRPKVYZKO-LBPRGKRZSA-N 2 0 232.371 2.118 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@H]1CCc2c1cccc2O ZINC000422979131 192516525 /nfs/dbraw/zinc/51/65/25/192516525.db2.gz LJHJUUUCGLCREL-GWCFXTLKSA-N 2 0 234.343 2.097 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H]1CCCC(F)(F)C1 ZINC000422987869 192519524 /nfs/dbraw/zinc/51/95/24/192519524.db2.gz HOONMUSMLBXTIN-NXEZZACHSA-N 2 0 220.307 2.281 20 0 BEADRP Cc1cc(C)c(C[N@H+]2C[C@@H](O)CC[C@H]2C)c(C)n1 ZINC000639685689 356600667 /nfs/dbraw/zinc/60/06/67/356600667.db2.gz LQQMXPNBHUINOT-OCCSQVGLSA-N 2 0 248.370 2.352 20 0 BEADRP CCC[C@@H](C)C[N@@H+]1CCC[C@@H](CC[NH3+])C1 ZINC000224295620 535325551 /nfs/dbraw/zinc/32/55/51/535325551.db2.gz QWLXGMQOWMZGIR-OLZOCXBDSA-N 2 0 212.381 2.483 20 0 BEADRP C[C@H](CCCC(F)(F)F)[NH2+][C@H](C)C1C[NH2+]C1 ZINC000423074915 192559535 /nfs/dbraw/zinc/55/95/35/192559535.db2.gz NDUVVVJKIMZCRQ-RKDXNWHRSA-N 2 0 238.297 2.305 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]C1(Cc2ccccc2)CC1 ZINC000423054745 192552588 /nfs/dbraw/zinc/55/25/88/192552588.db2.gz UYADGWXOSJXTNY-QWHCGFSZSA-N 2 0 232.371 2.477 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]C[C@H]1CCC(F)(F)C1 ZINC000423096039 192566102 /nfs/dbraw/zinc/56/61/02/192566102.db2.gz NVADBMZYXOFBKB-AEJSXWLSSA-N 2 0 220.307 2.137 20 0 BEADRP Cc1cccc(CCC[NH2+][C@H]2CCC[C@@H]2C[NH3+])n1 ZINC000423100155 192568095 /nfs/dbraw/zinc/56/80/95/192568095.db2.gz GJVIGPILYRZDQH-HIFRSBDPSA-N 2 0 247.386 2.040 20 0 BEADRP C[NH+]1CCC2(CC[N@H+](CC3CCC3)C2)CC1 ZINC000639754921 356658175 /nfs/dbraw/zinc/65/81/75/356658175.db2.gz CIOZWMSSJPAZQW-UHFFFAOYSA-N 2 0 222.376 2.204 20 0 BEADRP COCC1(CC[NH2+][C@H](C)CCCC[NH3+])CCC1 ZINC000423126602 192577421 /nfs/dbraw/zinc/57/74/21/192577421.db2.gz BDRDVRJRFSVZEH-CYBMUJFWSA-N 2 0 242.407 2.300 20 0 BEADRP F[C@@H]1CC[C@H]([NH2+][C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)C1 ZINC000423128848 192577901 /nfs/dbraw/zinc/57/79/01/192577901.db2.gz QPHLZRDGNNHDBT-IKOXMDCHSA-N 2 0 240.366 2.387 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]C[C@H]1COc2ccccc21 ZINC000423128107 192578391 /nfs/dbraw/zinc/57/83/91/192578391.db2.gz VCCDYLCLPVAKFJ-STQMWFEESA-N 2 0 248.370 2.270 20 0 BEADRP CC[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)C1CCC1 ZINC000392298126 259469356 /nfs/dbraw/zinc/46/93/56/259469356.db2.gz WSKCBDORHRKEHA-CQSZACIVSA-N 2 0 222.376 2.417 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[N@H+](C)C(C)(C)C1)C1CC1 ZINC000623341412 356742285 /nfs/dbraw/zinc/74/22/85/356742285.db2.gz AVRJWNSLIMUOCG-PWSUYJOCSA-N 2 0 210.365 2.247 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H]1CC[C@@H](C)[C@H](C)C1 ZINC000578185296 366367568 /nfs/dbraw/zinc/36/75/68/366367568.db2.gz YCPYTFOHHZHZDG-JHJVBQTASA-N 2 0 212.381 2.400 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H]1CC[C@@H](C)[C@@H](C)C1 ZINC000578185295 366367840 /nfs/dbraw/zinc/36/78/40/366367840.db2.gz YCPYTFOHHZHZDG-FRRDWIJNSA-N 2 0 212.381 2.400 20 0 BEADRP CC(C)CC[C@H]1CCCC[N@@H+]1CCOCC[NH3+] ZINC000357099868 356814722 /nfs/dbraw/zinc/81/47/22/356814722.db2.gz DOZINYJNENRKLK-CQSZACIVSA-N 2 0 242.407 2.252 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+]CC[C@H]2CCCO2)CC1(C)C ZINC000623353640 356781577 /nfs/dbraw/zinc/78/15/77/356781577.db2.gz SCFYAGVAKYUVQI-CHWSQXEVSA-N 2 0 240.391 2.018 20 0 BEADRP CO[C@@H]1C[C@@H]([NH2+][C@H](C)CCCC[NH3+])C12CCC2 ZINC000423172997 192607290 /nfs/dbraw/zinc/60/72/90/192607290.db2.gz WKQIVEKSMWEDMI-JHJVBQTASA-N 2 0 240.391 2.051 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]C1(C2CCC2)CCC1 ZINC000423171899 192607722 /nfs/dbraw/zinc/60/77/22/192607722.db2.gz QLJWRPNINDHQGD-WDEREUQCSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)CC[NH+](C)C)[C@@H]1C[C@H]1C1CC1 ZINC000623384176 356909408 /nfs/dbraw/zinc/90/94/08/356909408.db2.gz REESCWCYGZPNFA-XCCSTKFXSA-N 2 0 224.392 2.351 20 0 BEADRP C[N@@H+]1CC[C@H](NCc2cscn2)CC1(C)C ZINC000623387235 356917340 /nfs/dbraw/zinc/91/73/40/356917340.db2.gz RGBXVNSCGWKRRB-JTQLQIEISA-N 2 0 239.388 2.106 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1CCCC[C@H]1F ZINC000423184078 192613485 /nfs/dbraw/zinc/61/34/85/192613485.db2.gz MTQACTABOITQEF-IJLUTSLNSA-N 2 0 216.344 2.374 20 0 BEADRP C[C@H](CC(C)(C)C)[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000423238388 192646119 /nfs/dbraw/zinc/64/61/19/192646119.db2.gz ACZVINVNVPZTIO-NEPJUHHUSA-N 2 0 212.381 2.400 20 0 BEADRP FCCC[C@@H]1CCC[C@H]1[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000423241594 192646620 /nfs/dbraw/zinc/64/66/20/192646620.db2.gz DIKAIMKNCXBSCC-MELADBBJSA-N 2 0 242.382 2.494 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+]CCN1CC[C@H](C)C1 ZINC000389932607 357069488 /nfs/dbraw/zinc/06/94/88/357069488.db2.gz LMWYJLMLIPRAMX-YNEHKIRRSA-N 2 0 210.365 2.106 20 0 BEADRP C[NH+](C)CCCC[NH2+]CC1Cc2ccccc2C1 ZINC000390292958 357087612 /nfs/dbraw/zinc/08/76/12/357087612.db2.gz PPFUAWCPYAIKRV-UHFFFAOYSA-N 2 0 246.398 2.333 20 0 BEADRP CC[NH+]1CCC(CC[NH2+][C@H](C)CCOC)CC1 ZINC000121806374 357154689 /nfs/dbraw/zinc/15/46/89/357154689.db2.gz DFDXMFZVGAUKSF-CYBMUJFWSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)(C)[C@@H]1CC[C@@H]1[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000423249693 192651770 /nfs/dbraw/zinc/65/17/70/192651770.db2.gz PKWHXURPXJHPMG-XQQFMLRXSA-N 2 0 224.392 2.400 20 0 BEADRP CCC(C)(C)[N@H+](C)C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000261535052 535355668 /nfs/dbraw/zinc/35/56/68/535355668.db2.gz NPAIHMJSYRRMLS-VXGBXAGGSA-N 2 0 212.381 2.495 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H](Cc1ccccc1)C1CC1 ZINC000423271209 192664302 /nfs/dbraw/zinc/66/43/02/192664302.db2.gz IRXOIACKTSVQIU-XJKSGUPXSA-N 2 0 246.398 2.453 20 0 BEADRP C[C@H]([NH2+][C@H]1CCCSC1)C1CC[NH+](C)CC1 ZINC000157133233 538810292 /nfs/dbraw/zinc/81/02/92/538810292.db2.gz BEULIQOQBJSEFS-AAEUAGOBSA-N 2 0 242.432 2.202 20 0 BEADRP C[N@@H+]1CCCC[C@@H](C[NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)C1 ZINC000628425709 357253050 /nfs/dbraw/zinc/25/30/50/357253050.db2.gz SNBGIOCXBXMITM-LJISPDSOSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]([NH2+]C1C[C@@H](C)O[C@H](C)C1)[C@H]1CCCC[NH2+]1 ZINC000582480735 357316509 /nfs/dbraw/zinc/31/65/09/357316509.db2.gz SPPVTESGEFCQHW-HKUMRIAESA-N 2 0 240.391 2.063 20 0 BEADRP CCN1CCC[C@@H]1C[NH2+][C@H]1C[C@@H](C)O[C@@H](C)C1 ZINC000582706290 357374935 /nfs/dbraw/zinc/37/49/35/357374935.db2.gz RBVZRNSDDVFQJT-ZOBORPQBSA-N 2 0 240.391 2.016 20 0 BEADRP CC[C@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)[C@@H]1C[C@@H]1C ZINC000423284337 192677471 /nfs/dbraw/zinc/67/74/71/192677471.db2.gz YDGAFRZSNCBTJU-FQUUOJAGSA-N 2 0 224.392 2.400 20 0 BEADRP CCC([NH3+])(CC)CN[C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000423290024 192682146 /nfs/dbraw/zinc/68/21/46/192682146.db2.gz CABLLSCIVSBMSA-KBPBESRZSA-N 2 0 247.386 2.238 20 0 BEADRP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]CC(C1CC1)C1CC1 ZINC000394834708 357382844 /nfs/dbraw/zinc/38/28/44/357382844.db2.gz UEDSFJCJNXITAO-NHYWBVRUSA-N 2 0 236.403 2.352 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]CC(C1CC1)C1CC1 ZINC000394834704 357383013 /nfs/dbraw/zinc/38/30/13/357383013.db2.gz UEDSFJCJNXITAO-ABAIWWIYSA-N 2 0 236.403 2.352 20 0 BEADRP CCCC[C@@H](COC)[NH2+]CCC[NH+]1CCCC1 ZINC000178413572 535358431 /nfs/dbraw/zinc/35/84/31/535358431.db2.gz HBFVHMOMVBEVIR-AWEZNQCLSA-N 2 0 242.407 2.267 20 0 BEADRP C[NH2+]Cc1cccc(N[C@H]2CCC[C@@H]([NH3+])C2)c1 ZINC000582975877 357449993 /nfs/dbraw/zinc/44/99/93/357449993.db2.gz QYAXSSGBEHKJFW-OCCSQVGLSA-N 2 0 233.359 2.088 20 0 BEADRP C[NH2+]Cc1cccc(N[C@H]2CCC[C@H]([NH3+])C2)c1 ZINC000582975876 357450313 /nfs/dbraw/zinc/45/03/13/357450313.db2.gz QYAXSSGBEHKJFW-JSGCOSHPSA-N 2 0 233.359 2.088 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]CCC(F)(F)F ZINC000063099444 357526135 /nfs/dbraw/zinc/52/61/35/357526135.db2.gz SFDKIKCLOXLEAA-OPRDCNLKSA-N 2 0 238.297 2.257 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@H]2CC[C@@H](C)C2)CC1 ZINC000230407062 357539501 /nfs/dbraw/zinc/53/95/01/357539501.db2.gz CNAYQKFNFDKNPK-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H](C[NH2+]C1CC(C)C1)C[NH+]1CCCCC1 ZINC000231787580 357628735 /nfs/dbraw/zinc/62/87/35/357628735.db2.gz NWNVOWWEYIJPRR-MOKVOYLWSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]([NH2+]CCC[NH+]1CCCCC1)[C@H]1C[C@H]1C ZINC000321554359 357589426 /nfs/dbraw/zinc/58/94/26/357589426.db2.gz MAKBSYBNIGMPEA-RDBSUJKOSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)CCOCC[N@H+](C)[C@H]1CCC[NH2+]CC1 ZINC000231668616 357618656 /nfs/dbraw/zinc/61/86/56/357618656.db2.gz GZXFROHUJCLFMK-AWEZNQCLSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1C[NH3+] ZINC000685939344 538886487 /nfs/dbraw/zinc/88/64/87/538886487.db2.gz WMERLLDQCPOUQM-JSGCOSHPSA-N 2 0 218.344 2.103 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+]CCC1CCCCC1 ZINC000234715166 357827266 /nfs/dbraw/zinc/82/72/66/357827266.db2.gz CMBXOLYYAPDHEY-CQSZACIVSA-N 2 0 242.407 2.300 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+]CCC1CCCCC1 ZINC000234781786 357828655 /nfs/dbraw/zinc/82/86/55/357828655.db2.gz CMBXOLYYAPDHEY-AWEZNQCLSA-N 2 0 242.407 2.300 20 0 BEADRP CSCC[C@H](C)[N@H+](C)C[C@@H]1CC[NH2+][C@@H](C)C1 ZINC000235055354 357841624 /nfs/dbraw/zinc/84/16/24/357841624.db2.gz QAVJSYGRDGBXOB-RWMBFGLXSA-N 2 0 244.448 2.448 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C[C@@H]2CC2(C)C)CC1(C)C ZINC000623417044 357869377 /nfs/dbraw/zinc/86/93/77/357869377.db2.gz QKKMFYJFBRKAKS-RYUDHWBXSA-N 2 0 224.392 2.495 20 0 BEADRP C[NH+](C)CCOCC[NH2+][C@@H]1CCCCC1(C)C ZINC000219324046 357995562 /nfs/dbraw/zinc/99/55/62/357995562.db2.gz WDICCVKZICRGPE-CYBMUJFWSA-N 2 0 242.407 2.123 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]C[C@@H]2C[C@H]2C2CCC2)C1 ZINC000584479861 357996626 /nfs/dbraw/zinc/99/66/26/357996626.db2.gz KAGOQDYEWBIYRC-CRWXNKLISA-N 2 0 222.376 2.282 20 0 BEADRP CCC[NH+]1CCC(C)([NH+]2CCCC2)CC1 ZINC000639980781 358025730 /nfs/dbraw/zinc/02/57/30/358025730.db2.gz DEHYAPYROBQCMZ-UHFFFAOYSA-N 2 0 210.365 2.347 20 0 BEADRP Cc1csc([C@H](C)N[C@@H]2CCC[NH2+]CC2)n1 ZINC000168758873 134247928 /nfs/dbraw/zinc/24/79/28/134247928.db2.gz RSWHLDDYOOJHQD-WDEREUQCSA-N 2 0 239.388 2.244 20 0 BEADRP CC(C)C[N@H+](C)CC[C@H]1CCCC[NH+]1C ZINC000075860865 325317823 /nfs/dbraw/zinc/31/78/23/325317823.db2.gz FGQQGMNLEXDXDA-CYBMUJFWSA-N 2 0 212.381 2.449 20 0 BEADRP [NH3+]CCCCCC[NH2+]Cc1ccccc1 ZINC000038302016 358144782 /nfs/dbraw/zinc/14/47/82/358144782.db2.gz HUOLQRCLUIBWIH-UHFFFAOYSA-N 2 0 206.333 2.295 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]C2CC([NH+](C)C)C2)C1 ZINC000584790304 358179936 /nfs/dbraw/zinc/17/99/36/358179936.db2.gz LNYAFTBZEXOAHE-OKZRHMCRSA-N 2 0 210.365 2.247 20 0 BEADRP CC(C)(C)C[NH2+]Cc1ccc(C[NH3+])cc1 ZINC000040494951 358237575 /nfs/dbraw/zinc/23/75/75/358237575.db2.gz XGFSWEASUFENMS-UHFFFAOYSA-N 2 0 206.333 2.281 20 0 BEADRP CC(C)C[C@@H]([NH3+])C[NH2+][C@H]1CCc2cc(N)ccc21 ZINC000578206655 366391152 /nfs/dbraw/zinc/39/11/52/366391152.db2.gz ZWOFAOMDHGHHLS-HIFRSBDPSA-N 2 0 247.386 2.219 20 0 BEADRP C([C@H]1CCC[NH2+]C1)[N@H+](C1CC1)C1CCCC1 ZINC000226435597 358339812 /nfs/dbraw/zinc/33/98/12/358339812.db2.gz FNJZHTOBJFDSGU-LBPRGKRZSA-N 2 0 222.376 2.393 20 0 BEADRP C[C@@H](c1cccc(F)c1)[N@@H+]1CC[C@@H](C[NH3+])C1 ZINC000219122271 134274422 /nfs/dbraw/zinc/27/44/22/134274422.db2.gz XMRDWBJBEDGNIL-QWRGUYRKSA-N 2 0 222.307 2.167 20 0 BEADRP C[N@H+](CCC[NH3+])Cc1cccc(C2CC2)c1 ZINC000227742522 358363025 /nfs/dbraw/zinc/36/30/25/358363025.db2.gz GVPAPXDABBVUGZ-UHFFFAOYSA-N 2 0 218.344 2.345 20 0 BEADRP CC[N@H+](C)C[C@H]1CC[NH+](CC2CCC2)C1 ZINC000173887053 134278622 /nfs/dbraw/zinc/27/86/22/134278622.db2.gz SKOCIVBENXPSCT-CYBMUJFWSA-N 2 0 210.365 2.060 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@H](C)C2(C)CC2)CC1 ZINC000044517664 358388976 /nfs/dbraw/zinc/38/89/76/358388976.db2.gz KNKLDMGHMGWSFB-GFCCVEGCSA-N 2 0 224.392 2.497 20 0 BEADRP COc1ccccc1CC[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000230285263 358396636 /nfs/dbraw/zinc/39/66/36/358396636.db2.gz BCBHWHHXBKJTFL-UONOGXRCSA-N 2 0 248.370 2.097 20 0 BEADRP CCCCOCCC[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000229340586 358402162 /nfs/dbraw/zinc/40/21/62/358402162.db2.gz PNUZTXRHIOIFCZ-QWHCGFSZSA-N 2 0 228.380 2.053 20 0 BEADRP C[C@H]1C[C@H](C[NH3+])C[N@@H+]1CCCc1ccccc1 ZINC000131486387 358678596 /nfs/dbraw/zinc/67/85/96/358678596.db2.gz AOEROUQKYHJYKH-DZGCQCFKSA-N 2 0 232.371 2.288 20 0 BEADRP C[C@@H]1C[C@H](C[NH3+])C[N@@H+]1CCCc1ccccc1 ZINC000131486164 358678684 /nfs/dbraw/zinc/67/86/84/358678684.db2.gz AOEROUQKYHJYKH-UKRRQHHQSA-N 2 0 232.371 2.288 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000132078292 358705278 /nfs/dbraw/zinc/70/52/78/358705278.db2.gz XHIBOUBAEPTLBU-LSDHHAIUSA-N 2 0 247.386 2.063 20 0 BEADRP CCOCCC[NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000131914993 358700511 /nfs/dbraw/zinc/70/05/11/358700511.db2.gz PZQVMLMDWRBCJU-KGLIPLIRSA-N 2 0 234.343 2.147 20 0 BEADRP C[N@H+](CCCF)CC[C@H]1CCCC[NH+]1C ZINC000133836582 358770617 /nfs/dbraw/zinc/77/06/17/358770617.db2.gz UFKSOCAYYMWFSL-GFCCVEGCSA-N 2 0 216.344 2.152 20 0 BEADRP Cc1cc(C)cc(OCCCN2CC[C@@H]([NH3+])C2)c1 ZINC000050243289 358721195 /nfs/dbraw/zinc/72/11/95/358721195.db2.gz OVDQRYXYXBWAGV-CQSZACIVSA-N 2 0 248.370 2.105 20 0 BEADRP C[NH2+]CCC[N@@H+]1CC[C@H](c2ccccc2)C1 ZINC000050600623 358734155 /nfs/dbraw/zinc/73/41/55/358734155.db2.gz TWLFPRBWCYLNLY-AWEZNQCLSA-N 2 0 218.344 2.085 20 0 BEADRP CCC[C@H](O)C[NH2+][C@@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000134363867 358787399 /nfs/dbraw/zinc/78/73/99/358787399.db2.gz BAPHXZMXAWXCAQ-IHRRRGAJSA-N 2 0 242.407 2.048 20 0 BEADRP C[C@H](CC[NH3+])[NH2+]Cc1ccc2ncccc2c1 ZINC000136137774 358865105 /nfs/dbraw/zinc/86/51/05/358865105.db2.gz PTAFBSIIUIIMOX-LLVKDONJSA-N 2 0 229.327 2.062 20 0 BEADRP Cc1cc([C@@H]([NH2+]CC2C[NH2+]C2)C2CC2)ccc1F ZINC000423308361 192696221 /nfs/dbraw/zinc/69/62/21/192696221.db2.gz XPFIZHAMDVETKW-HNNXBMFYSA-N 2 0 248.345 2.394 20 0 BEADRP C[C@@H]1CC[N@H+](CCC[NH+]2CCCCC2)C1 ZINC000137675823 358899378 /nfs/dbraw/zinc/89/93/78/358899378.db2.gz KBOBVPBQYQBLRQ-CYBMUJFWSA-N 2 0 210.365 2.204 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]CCc2ccsc2)C1 ZINC000086403616 358968246 /nfs/dbraw/zinc/96/82/46/358968246.db2.gz LDWGYNNUBMCVPM-RYUDHWBXSA-N 2 0 224.373 2.150 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]CCc2ccsc2)C1 ZINC000086403619 358968657 /nfs/dbraw/zinc/96/86/57/358968657.db2.gz LDWGYNNUBMCVPM-NEPJUHHUSA-N 2 0 224.373 2.150 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H]2CCO[C@H](C)C2)CC1 ZINC000070347249 359050123 /nfs/dbraw/zinc/05/01/23/359050123.db2.gz HSPSEYKEAZKTQS-OCCSQVGLSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@@H]1Cc2ccccc2[C@H]1[NH2+]CCCC[NH3+] ZINC000423319092 192704680 /nfs/dbraw/zinc/70/46/80/192704680.db2.gz CFJKVCXTQSVTQZ-RISCZKNCSA-N 2 0 218.344 2.248 20 0 BEADRP C[C@@H]([NH2+]CC1=CC[NH2+]CC1)c1cccc(F)c1 ZINC000423334071 192713173 /nfs/dbraw/zinc/71/31/73/192713173.db2.gz FMTPVXDUSLKFLQ-LLVKDONJSA-N 2 0 234.318 2.396 20 0 BEADRP CCC[C@@H]([NH2+]CCCC[NH3+])c1cccnc1 ZINC000423332858 192713418 /nfs/dbraw/zinc/71/34/18/192713418.db2.gz RIOOSMGQULXNTK-CYBMUJFWSA-N 2 0 221.348 2.251 20 0 BEADRP COCC[N@H+](CCC[NH3+])[C@H](C)c1ccccc1 ZINC000070376043 359052429 /nfs/dbraw/zinc/05/24/29/359052429.db2.gz UBCJUSKUCIBRCJ-CYBMUJFWSA-N 2 0 236.359 2.045 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC[C@@H](C)C1)C[NH+]1CCCC1 ZINC000070762692 359062691 /nfs/dbraw/zinc/06/26/91/359062691.db2.gz VJXAVWFAEDEYKP-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)OCC[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000613754880 363633216 /nfs/dbraw/zinc/63/32/16/363633216.db2.gz SWSZHZJHIGSPOH-UHFFFAOYSA-N 2 0 242.407 2.264 20 0 BEADRP CCC[C@@H]([NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21)C(C)(C)C ZINC000423420144 192749992 /nfs/dbraw/zinc/74/99/92/192749992.db2.gz AYWDOQCAQFKUCS-KXNHARMFSA-N 2 0 210.365 2.009 20 0 BEADRP CC1CC([NH2+][C@@H]2CC[N@H+](C)C(C)(C)C2)C1 ZINC000623439115 359331216 /nfs/dbraw/zinc/33/12/16/359331216.db2.gz WVCKQTGEJKPUTM-MOENNCHZSA-N 2 0 210.365 2.247 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CCCSC2)CC1(C)C ZINC000623439385 359332558 /nfs/dbraw/zinc/33/25/58/359332558.db2.gz GRPPWZBOXXFELC-NWDGAFQWSA-N 2 0 242.432 2.344 20 0 BEADRP CC[C@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)[C@@H]1C[C@@H]1C ZINC000423437825 192769695 /nfs/dbraw/zinc/76/96/95/192769695.db2.gz QVBDFSNGYMGWKK-WCDYYPSBSA-N 2 0 236.403 2.399 20 0 BEADRP C[C@@H]([NH2+]C1CCC(C(F)F)CC1)[C@H](C)[NH3+] ZINC000423455279 192776835 /nfs/dbraw/zinc/77/68/35/192776835.db2.gz CGDYKQJRWDPODX-AFWXGSBKSA-N 2 0 220.307 2.136 20 0 BEADRP C[C@@H]1OCC[C@H]1[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000423512546 192799910 /nfs/dbraw/zinc/79/99/10/192799910.db2.gz UYDRUEFHPVBLIC-NWANDNLSSA-N 2 0 248.370 2.234 20 0 BEADRP CC(C)C1CC([NH2+][C@@H]2CC[C@H](C[NH3+])C2)C1 ZINC000423520450 192801940 /nfs/dbraw/zinc/80/19/40/192801940.db2.gz WBETWZODGNHYED-GMKTYKIGSA-N 2 0 210.365 2.138 20 0 BEADRP CC[C@@H]1C[C@@H]([NH2+][C@@H](C)CCCC[NH3+])CCO1 ZINC000423543926 192809362 /nfs/dbraw/zinc/80/93/62/192809362.db2.gz IDFFOYGNJBGSBD-RWMBFGLXSA-N 2 0 228.380 2.051 20 0 BEADRP C(C[C@H]1CCC[NH2+]C1)SCC1CC[NH2+]CC1 ZINC000580441358 359550339 /nfs/dbraw/zinc/55/03/39/359550339.db2.gz PSAPNPMCQMPJSR-GFCCVEGCSA-N 2 0 242.432 2.109 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@H](C)C2CC2)CC1 ZINC000132949969 491143687 /nfs/dbraw/zinc/14/36/87/491143687.db2.gz QDELYYHNGVSOON-NSHDSACASA-N 2 0 210.365 2.106 20 0 BEADRP CSCC[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000169241713 359878167 /nfs/dbraw/zinc/87/81/67/359878167.db2.gz NORLPCYEWBZECI-VXGBXAGGSA-N 2 0 222.357 2.084 20 0 BEADRP CC[NH+](CC)CCC[N@@H+]1CC[C@](C)(COC)C1 ZINC000451202090 202380520 /nfs/dbraw/zinc/38/05/20/202380520.db2.gz LWZHZFUGPHRKBL-AWEZNQCLSA-N 2 0 242.407 2.077 20 0 BEADRP [NH3+]CCCC[NH2+]Cc1ccc(C2CC2)cc1 ZINC000087011883 359893538 /nfs/dbraw/zinc/89/35/38/359893538.db2.gz FBOJRMPIZHICAJ-UHFFFAOYSA-N 2 0 218.344 2.393 20 0 BEADRP CC(C)CC[N@H+](CC1CC[NH2+]CC1)C1CC1 ZINC000088444590 359954273 /nfs/dbraw/zinc/95/42/73/359954273.db2.gz HGVBMBWBDVNKCT-UHFFFAOYSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]([NH3+])[C@H]1COCC[C@@H]1[NH2+]CCCC(C)(C)C ZINC000578878480 366664909 /nfs/dbraw/zinc/66/49/09/366664909.db2.gz UWRFQHHHEZIXIY-XQQFMLRXSA-N 2 0 242.407 2.155 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]Cc1cccc(F)c1 ZINC000089140770 359992655 /nfs/dbraw/zinc/99/26/55/359992655.db2.gz FNRDMDRZUAGEAC-JSGCOSHPSA-N 2 0 236.334 2.433 20 0 BEADRP C[C@H]([NH2+][C@H]1CCCC[C@@H]1C[NH3+])c1cccnc1 ZINC000089140102 359992845 /nfs/dbraw/zinc/99/28/45/359992845.db2.gz LKRGSACBTKPNEZ-SCRDCRAPSA-N 2 0 233.359 2.250 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]Cc1cccc(F)c1 ZINC000089140768 359993155 /nfs/dbraw/zinc/99/31/55/359993155.db2.gz FNRDMDRZUAGEAC-GXTWGEPZSA-N 2 0 236.334 2.433 20 0 BEADRP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]CC1(C)CCCC1 ZINC000089555364 360026193 /nfs/dbraw/zinc/02/61/93/360026193.db2.gz IAPZSHYFRUURSX-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP Cc1ccccc1C[N@H+](C)CC[C@@H]1CC[NH2+]C1 ZINC000089749188 360037287 /nfs/dbraw/zinc/03/72/87/360037287.db2.gz LHIAZRDVKJSELO-AWEZNQCLSA-N 2 0 232.371 2.426 20 0 BEADRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]Cc1ccc(F)cc1F ZINC000089150510 359993887 /nfs/dbraw/zinc/99/38/87/359993887.db2.gz YUVZIHCJVIHTER-RNCFNFMXSA-N 2 0 240.297 2.182 20 0 BEADRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]Cc1ccc(F)c(F)c1 ZINC000089150403 359994160 /nfs/dbraw/zinc/99/41/60/359994160.db2.gz VFKMFTFOCZBGEG-ZWNOBZJWSA-N 2 0 240.297 2.182 20 0 BEADRP CCC1(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)CC1 ZINC000090219446 360065966 /nfs/dbraw/zinc/06/59/66/360065966.db2.gz VDXFCZBOUYYXFI-CHWSQXEVSA-N 2 0 222.376 2.393 20 0 BEADRP COCCCC[NH2+][C@@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000093516158 360256029 /nfs/dbraw/zinc/25/60/29/360256029.db2.gz SIJOKKXHBTZBHP-KBPBESRZSA-N 2 0 242.407 2.313 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]Cc2ccc(F)cc2F)C1 ZINC000093215772 360222906 /nfs/dbraw/zinc/22/29/06/360222906.db2.gz PFPUWPSGCZAFKO-RYUDHWBXSA-N 2 0 240.297 2.324 20 0 BEADRP CC1(C)C[C@@H]([NH2+]CCN2CCCC2)C(C)(C)O1 ZINC000094422702 360307257 /nfs/dbraw/zinc/30/72/57/360307257.db2.gz XDWBIKAFFMNWAU-GFCCVEGCSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@H+](C)C(C)(C)C2)CCO1 ZINC000623481308 360443436 /nfs/dbraw/zinc/44/34/36/360443436.db2.gz ZLLZYFCKQAVUSA-JHJVBQTASA-N 2 0 240.391 2.016 20 0 BEADRP c1cn(CCC[NH2+][C@H]2CC[C@@H]2C2CC2)cn1 ZINC000309577995 491152060 /nfs/dbraw/zinc/15/20/60/491152060.db2.gz RAAZKNKTMVYXAA-OLZOCXBDSA-N 2 0 219.332 2.051 20 0 BEADRP C[C@@H]([NH2+]C1(C2CC2)CC1)C1CC[NH+](C)CC1 ZINC000309606072 491152227 /nfs/dbraw/zinc/15/22/27/491152227.db2.gz YQORRCNSGAIJKV-LLVKDONJSA-N 2 0 222.376 2.249 20 0 BEADRP CC[C@H](C)C[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000156086424 360947313 /nfs/dbraw/zinc/94/73/13/360947313.db2.gz YVGHZDKCZGZPLW-YNEHKIRRSA-N 2 0 210.365 2.249 20 0 BEADRP CC(C)Oc1cccc(C[NH2+]C[C@@H](C)C[NH3+])c1 ZINC000414883495 200773541 /nfs/dbraw/zinc/77/35/41/200773541.db2.gz VDRIVLNBNSPYRC-LBPRGKRZSA-N 2 0 236.359 2.158 20 0 BEADRP CC[C@@H]1CCC[C@H]([NH2+]CC2([NH3+])CCOCC2)C1 ZINC000629388760 361035303 /nfs/dbraw/zinc/03/53/03/361035303.db2.gz SPIJJXWFQXXCBE-OLZOCXBDSA-N 2 0 240.391 2.053 20 0 BEADRP CC1(C)CCC[C@@H]([NH2+]CC2([NH3+])CCOCC2)C1 ZINC000629387256 361038805 /nfs/dbraw/zinc/03/88/05/361038805.db2.gz GIYSEIZSKPRABN-GFCCVEGCSA-N 2 0 240.391 2.053 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+][C@@H]1CC[NH2+][C@H]1C ZINC000629408035 361056834 /nfs/dbraw/zinc/05/68/34/361056834.db2.gz OXUVZYQSEMZPAL-HRDYMLBCSA-N 2 0 224.270 2.057 20 0 BEADRP CCCC[C@H]1CCC[C@H]1[NH2+]CCOCCC[NH3+] ZINC000629400484 361051604 /nfs/dbraw/zinc/05/16/04/361051604.db2.gz ZECKBSXVMSPKHK-UONOGXRCSA-N 2 0 242.407 2.300 20 0 BEADRP CCCC[C@@H]1CCC[C@@H]1[NH2+]CCOCC[NH2+]C ZINC000629405813 361054117 /nfs/dbraw/zinc/05/41/17/361054117.db2.gz UATQHFLLQRLQFR-KGLIPLIRSA-N 2 0 242.407 2.171 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+][C@H]1CC[C@@H](C)[C@@H](C)C1 ZINC000629406528 361054479 /nfs/dbraw/zinc/05/44/79/361054479.db2.gz NIJYSLSFBKFDLE-QNWJLWSRSA-N 2 0 210.365 2.151 20 0 BEADRP CCC[C@@H](C)CCC[N@@H+]1CCC[NH2+]CC1 ZINC000629505902 361101011 /nfs/dbraw/zinc/10/10/11/361101011.db2.gz PZUFRXQWDKLYQY-CYBMUJFWSA-N 2 0 212.381 2.498 20 0 BEADRP CCC[C@H](C)CCC[N@@H+]1CC[C@@H](C[NH3+])C1 ZINC000629511422 361105985 /nfs/dbraw/zinc/10/59/85/361105985.db2.gz ILYMBJYWXVFXCP-STQMWFEESA-N 2 0 212.381 2.483 20 0 BEADRP c1ccc2c(c1)CC([NH2+]CCC[C@H]1CCC[NH2+]1)C2 ZINC000414970865 219885216 /nfs/dbraw/zinc/88/52/16/219885216.db2.gz KUUNYTBLVLFATA-OAHLLOKOSA-N 2 0 244.382 2.276 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1[NH2+]C1CCC2(CC2)CC1 ZINC000629527392 361129676 /nfs/dbraw/zinc/12/96/76/361129676.db2.gz URBMXBSUCHEFEE-QWHCGFSZSA-N 2 0 222.376 2.439 20 0 BEADRP CC[C@@H]1CC[C@@H](C)C[C@H]1[NH2+]CCOCC[NH2+]C ZINC000629530237 361143670 /nfs/dbraw/zinc/14/36/70/361143670.db2.gz AIKUMUWRNYCWOW-MGPQQGTHSA-N 2 0 242.407 2.027 20 0 BEADRP CC[C@@H]1C[C@@H](C)CC[C@H]1[NH2+]CCOCC[NH2+]C ZINC000629529550 361143705 /nfs/dbraw/zinc/14/37/05/361143705.db2.gz GTEIKJKUDKXVDD-BFHYXJOUSA-N 2 0 242.407 2.027 20 0 BEADRP C[NH2+]CCOCC[NH2+][C@H]1CCCC[C@@H]1C(C)C ZINC000629529948 361146599 /nfs/dbraw/zinc/14/65/99/361146599.db2.gz REWXQNWXIHROGQ-KGLIPLIRSA-N 2 0 242.407 2.027 20 0 BEADRP CCCC[C@H](C)[C@H](C)[NH2+]CC1([NH3+])CCOCC1 ZINC000629521796 361122219 /nfs/dbraw/zinc/12/22/19/361122219.db2.gz UNDWNAINDPRXOM-STQMWFEESA-N 2 0 242.407 2.299 20 0 BEADRP CC1(C)CC(CN2CC[C@H]3CC[NH2+][C@@H]3C2)C1 ZINC000629534002 361163675 /nfs/dbraw/zinc/16/36/75/361163675.db2.gz HVESJYFKBNBHOH-CHWSQXEVSA-N 2 0 222.376 2.106 20 0 BEADRP COC[C@@H](C)[N@H+](C)CCCC[NH+]1CCCCC1 ZINC000640533517 361302275 /nfs/dbraw/zinc/30/22/75/361302275.db2.gz UFFIXPNEXTUDKP-CQSZACIVSA-N 2 0 242.407 2.219 20 0 BEADRP C[C@H]1CCC[N@H+](CCCC[NH2+]C2CSC2)C1 ZINC000309783644 491156436 /nfs/dbraw/zinc/15/64/36/491156436.db2.gz NLLAXCCZDAWYJU-LBPRGKRZSA-N 2 0 242.432 2.204 20 0 BEADRP CC1CC(C[NH2+][C@H]2CC[NH2+]CC[C@H]2C)C1 ZINC000622044442 370672845 /nfs/dbraw/zinc/67/28/45/370672845.db2.gz FSVHQJDOIGLPOY-KPFVRQRISA-N 2 0 210.365 2.010 20 0 BEADRP CC1CC(C[NH2+][C@@H]2CCCC[C@H]2C[NH3+])C1 ZINC000622044342 370673003 /nfs/dbraw/zinc/67/30/03/370673003.db2.gz BHYIOSHLSYMADQ-IFWUJCSASA-N 2 0 210.365 2.140 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]CC[C@@H]1CC1(F)F ZINC000622043655 370673920 /nfs/dbraw/zinc/67/39/20/370673920.db2.gz HBERAUSNUKQYJT-MXWKQRLJSA-N 2 0 232.318 2.009 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CC1(F)F)[C@@H]1CCCC[NH2+]1 ZINC000622043660 370675777 /nfs/dbraw/zinc/67/57/77/370675777.db2.gz HFLQJAMDQSNUNR-DCAQKATOSA-N 2 0 232.318 2.152 20 0 BEADRP [NH3+]CC1CCC([NH2+]CC[C@H]2CC2(F)F)CC1 ZINC000622043771 370675907 /nfs/dbraw/zinc/67/59/07/370675907.db2.gz KZTBOZWEKNYMNW-YVNMAJEFSA-N 2 0 232.318 2.139 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@H]1CCCc2ccccc2C1 ZINC000622044892 370678852 /nfs/dbraw/zinc/67/88/52/370678852.db2.gz WTIMKZCMXNSPNO-WFASDCNBSA-N 2 0 232.371 2.261 20 0 BEADRP CCO[C@H]1C[C@H]([NH2+]CC[C@H](C)[NH3+])C1(CC)CC ZINC000622045471 370680111 /nfs/dbraw/zinc/68/01/11/370680111.db2.gz XGJAQCHGVGFXRJ-AVGNSLFASA-N 2 0 242.407 2.297 20 0 BEADRP CC(C)CCC[N@@H+]1CC[C@H](C[NH+](C)C)C1 ZINC000429043303 201060152 /nfs/dbraw/zinc/06/01/52/201060152.db2.gz FFMPXNJTYDYNKW-CYBMUJFWSA-N 2 0 212.381 2.306 20 0 BEADRP CC(C)[C@@H]1CCC[C@@H]([NH2+]CCOCCC[NH3+])C1 ZINC000629536523 361399664 /nfs/dbraw/zinc/39/96/64/361399664.db2.gz GNQMOUOGPWFFCT-ZIAGYGMSSA-N 2 0 242.407 2.156 20 0 BEADRP Cc1ccc([C@H](C)[NH2+]CCOCCC[NH3+])cc1 ZINC000629539756 361401219 /nfs/dbraw/zinc/40/12/19/361401219.db2.gz NRFMTXMWXUHFPH-ZDUSSCGKSA-N 2 0 236.359 2.011 20 0 BEADRP C[C@]1(C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)C[C@H]2C[C@H]2C1 ZINC000629537533 361401326 /nfs/dbraw/zinc/40/13/26/361401326.db2.gz KZRMLNNIWGKVDJ-MEBFFEOJSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@H]([NH2+]C[C@]1(C)C[C@H]2C[C@H]2C1)[C@@H]1CCC[NH2+]1 ZINC000629538096 361402652 /nfs/dbraw/zinc/40/26/52/361402652.db2.gz NIAGFBHKFYABOT-HPCHECBXSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]([NH2+]CCOCCC[NH3+])[C@H]1CCCC[C@H]1C ZINC000629538567 361403578 /nfs/dbraw/zinc/40/35/78/361403578.db2.gz NWPVYKNOZVEMEL-MCIONIFRSA-N 2 0 242.407 2.156 20 0 BEADRP Cc1cccc([C@@H](C)[NH2+]CCOCCC[NH3+])c1 ZINC000629538747 361403789 /nfs/dbraw/zinc/40/37/89/361403789.db2.gz LFVALDOGOIRWQU-CYBMUJFWSA-N 2 0 236.359 2.011 20 0 BEADRP CC(C)[C@@H](N[C@@H]1CC[NH2+][C@H]1C)c1cccnc1 ZINC000629543543 361411493 /nfs/dbraw/zinc/41/14/93/361411493.db2.gz BTSQYMUGOKTWIH-IACUBPJLSA-N 2 0 233.359 2.119 20 0 BEADRP CCC[N@H+](C)C[C@H]1CC[NH+]([C@@H](C)CC)C1 ZINC000181134726 366789392 /nfs/dbraw/zinc/78/93/92/366789392.db2.gz XFYATVOPTXIIJU-QWHCGFSZSA-N 2 0 212.381 2.449 20 0 BEADRP CCC[N@H+](C)C[C@@H]1CC[NH+]([C@@H](C)CC)C1 ZINC000181134706 366789700 /nfs/dbraw/zinc/78/97/00/366789700.db2.gz XFYATVOPTXIIJU-STQMWFEESA-N 2 0 212.381 2.449 20 0 BEADRP CCC1(CC)[C@H]([NH2+]CCC[NH+](C)C)C[C@H]1OC ZINC000181393015 366806939 /nfs/dbraw/zinc/80/69/39/366806939.db2.gz AGNDGOLUKZELMQ-CHWSQXEVSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+][C@@H]1CCC[C@H]1CCCF ZINC000629544263 361423554 /nfs/dbraw/zinc/42/35/54/361423554.db2.gz HENDHUWBVRWUGS-WUHRBBMRSA-N 2 0 228.355 2.245 20 0 BEADRP C[C@@H]1CC(C)(C)C[C@@H]1[NH2+][C@@H]1CC[NH2+][C@H]1C ZINC000629545680 361426366 /nfs/dbraw/zinc/42/63/66/361426366.db2.gz QAZFMBQVELFISU-KXNHARMFSA-N 2 0 210.365 2.151 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]C[C@@H]1CCCC12CC2 ZINC000629555067 361435984 /nfs/dbraw/zinc/43/59/84/361435984.db2.gz QUFKRCRIJKRNOK-SRVKXCTJSA-N 2 0 210.365 2.282 20 0 BEADRP c1ccc(C[C@H]2CC[C@@H]([NH2+][C@@H]3CC[NH2+]C3)C2)cc1 ZINC000629553261 361437492 /nfs/dbraw/zinc/43/74/92/361437492.db2.gz SPDZRFKCYIEFBF-BZUAXINKSA-N 2 0 244.382 2.349 20 0 BEADRP C[C@@H]1C[N@@H+](C[C@H]2CCC[NH2+]C2)C[C@H](C)C1(F)F ZINC000629553172 361437644 /nfs/dbraw/zinc/43/76/44/361437644.db2.gz VJIZYJRUUSYQBX-TUAOUCFPSA-N 2 0 246.345 2.209 20 0 BEADRP C[C@@H]1C[NH+](C[C@H]2CCC[NH2+]C2)C[C@@H](C)C1(F)F ZINC000629553173 361437877 /nfs/dbraw/zinc/43/78/77/361437877.db2.gz VJIZYJRUUSYQBX-UTUOFQBUSA-N 2 0 246.345 2.209 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCCC12CC2)[C@@H]1CCC[NH2+]1 ZINC000629554277 361440139 /nfs/dbraw/zinc/44/01/39/361440139.db2.gz HGYIPMFUXMZEAZ-AVGNSLFASA-N 2 0 222.376 2.297 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]C[C@H]1CCCC12CC2 ZINC000629555208 361445944 /nfs/dbraw/zinc/44/59/44/361445944.db2.gz RVCYJYJWITTZBO-YNEHKIRRSA-N 2 0 222.376 2.284 20 0 BEADRP C([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)[C@H]1CCCC12CC2 ZINC000629555626 361447257 /nfs/dbraw/zinc/44/72/57/361447257.db2.gz ZNADDUUZTOFJMJ-HABKJSAYSA-N 2 0 234.387 2.439 20 0 BEADRP Cc1ccccc1[C@@H](C)[NH2+]CCOCCC[NH3+] ZINC000629541959 361418060 /nfs/dbraw/zinc/41/80/60/361418060.db2.gz VBFAPJCBIQISKT-CYBMUJFWSA-N 2 0 236.359 2.011 20 0 BEADRP C[C@H]1C[C@@H]1C[N@@H+]1CCC[C@@H](C)[C@H]1CCC[NH3+] ZINC000629544039 361418166 /nfs/dbraw/zinc/41/81/66/361418166.db2.gz DAQVGCIEWFGFJB-XJFOESAGSA-N 2 0 224.392 2.482 20 0 BEADRP CC(C)C[N@@H+]1CC[C@@H](C(F)(F)F)[C@H](C[NH3+])C1 ZINC000629563980 361458321 /nfs/dbraw/zinc/45/83/21/361458321.db2.gz IUOSXGIKQBVYGU-NXEZZACHSA-N 2 0 238.297 2.102 20 0 BEADRP C(C[NH+](C1CC1)C1CC1)[C@H]1CCC[NH2+]C1 ZINC000629567391 361458794 /nfs/dbraw/zinc/45/87/94/361458794.db2.gz KXJTVRKWAZPQMH-LLVKDONJSA-N 2 0 208.349 2.003 20 0 BEADRP C[N@H+](CC1CCCC1)C[C@@H]1CCC[NH+](C)C1 ZINC000152390327 201198771 /nfs/dbraw/zinc/19/87/71/201198771.db2.gz CZSBKJHSUQUBRG-CQSZACIVSA-N 2 0 224.392 2.450 20 0 BEADRP Cc1cnccc1C[NH2+]C[C@@H](N)c1ccccc1 ZINC000629647948 361538879 /nfs/dbraw/zinc/53/88/79/361538879.db2.gz LNLKGXLKBCIMTG-OAHLLOKOSA-N 2 0 241.338 2.180 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)C(C)(C)C ZINC000152459330 201200779 /nfs/dbraw/zinc/20/07/79/201200779.db2.gz VGHMXPUWMHNNPU-RYUDHWBXSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CC1=Cc2ccccc2OC1 ZINC000629649755 361546841 /nfs/dbraw/zinc/54/68/41/361546841.db2.gz FWTLRGPOHTYNRJ-RYUDHWBXSA-N 2 0 246.354 2.178 20 0 BEADRP CCCCC[NH2+][C@H]1CC[N@H+](CC)C[C@@H]1C ZINC000152215290 201192202 /nfs/dbraw/zinc/19/22/02/201192202.db2.gz XFDNHZZPZHCRRX-STQMWFEESA-N 2 0 212.381 2.497 20 0 BEADRP C[N@H+](CCOCC[NH3+])C[C@H]1CCCC(C)(C)C1 ZINC000629661262 361594907 /nfs/dbraw/zinc/59/49/07/361594907.db2.gz BSBLSILMHIGATO-ZDUSSCGKSA-N 2 0 242.407 2.110 20 0 BEADRP CCC[C@H](C)C[N@@H+]1C[C@@]2(C)C[NH2+]C[C@@]2(C)C1 ZINC000629665245 361595703 /nfs/dbraw/zinc/59/57/03/361595703.db2.gz LGQIKVPDNBPQCH-MELADBBJSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+]C[C@@H]1CCC[C@@H](C)C1 ZINC000629672446 361614514 /nfs/dbraw/zinc/61/45/14/361614514.db2.gz SDVACCIKBVSEIY-YVECIDJPSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H](Cc1ccccc1)C[N@@H+]1CC[C@@H](C[NH3+])C1 ZINC000435378808 201264452 /nfs/dbraw/zinc/26/44/52/201264452.db2.gz KAPBGEUSQXXVEV-HIFRSBDPSA-N 2 0 232.371 2.146 20 0 BEADRP CC[N@H+](Cc1ccc(C)nc1)[C@@H]1CCC[NH2+]CC1 ZINC000435392198 201267996 /nfs/dbraw/zinc/26/79/96/201267996.db2.gz GHIHOSNWMXMSLR-OAHLLOKOSA-N 2 0 247.386 2.354 20 0 BEADRP Cc1ccc(C[C@H](C)[N@H+](C)CCC[NH3+])cc1 ZINC000435396779 201269388 /nfs/dbraw/zinc/26/93/88/201269388.db2.gz YJXXQWNACVRMLB-ZDUSSCGKSA-N 2 0 220.360 2.207 20 0 BEADRP [NH3+][C@@H]1CCc2c1cccc2C1=CC[NH2+]CC1 ZINC000629723511 361664491 /nfs/dbraw/zinc/66/44/91/361664491.db2.gz NSJWTFYOVXXNOZ-CQSZACIVSA-N 2 0 214.312 2.009 20 0 BEADRP c1cc(C2=CC[NH2+]CC2)ccc1C[C@H]1CC[NH2+]C1 ZINC000629723891 361665585 /nfs/dbraw/zinc/66/55/85/361665585.db2.gz TWKXVCOSUWFRBV-CQSZACIVSA-N 2 0 242.366 2.215 20 0 BEADRP CCC[N@H+](Cc1ccccn1)[C@H]1CCC[NH2+]CC1 ZINC000435615360 201278404 /nfs/dbraw/zinc/27/84/04/201278404.db2.gz HNHWHLSWJOZUCZ-HNNXBMFYSA-N 2 0 247.386 2.436 20 0 BEADRP C[C@H]([NH3+])c1ccc(C2=CC[NH2+]CC2)cc1 ZINC000629723962 361666026 /nfs/dbraw/zinc/66/60/26/361666026.db2.gz VBXOFWPSHCZRGR-JTQLQIEISA-N 2 0 202.301 2.083 20 0 BEADRP C[NH2+]CCC[NH+]1CCC(OCCC(C)C)CC1 ZINC000435876037 201291993 /nfs/dbraw/zinc/29/19/93/201291993.db2.gz GOLYXWXWAAZPTI-UHFFFAOYSA-N 2 0 242.407 2.123 20 0 BEADRP CC[N@H+](CCC[NH2+]C)Cc1ccc(OC)cc1 ZINC000435877931 201292320 /nfs/dbraw/zinc/29/23/20/201292320.db2.gz WJSOPIUAEMNGDC-UHFFFAOYSA-N 2 0 236.359 2.127 20 0 BEADRP CC[C@H]([NH3+])Cc1ccc(C2=CC[NH2+]CC2)cc1 ZINC000629722897 361663576 /nfs/dbraw/zinc/66/35/76/361663576.db2.gz GTRKCYSDZQUHCL-HNNXBMFYSA-N 2 0 230.355 2.343 20 0 BEADRP [NH3+]CC1(c2ccc(C3=CC[NH2+]CC3)cc2)CCC1 ZINC000629722866 361663858 /nfs/dbraw/zinc/66/38/58/361663858.db2.gz GAYXIGPQDVORAV-UHFFFAOYSA-N 2 0 242.366 2.444 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCc2ccccc2[C@@H]1C ZINC000435879471 201293612 /nfs/dbraw/zinc/29/36/12/201293612.db2.gz CRJVBGIJAJKUQM-LBPRGKRZSA-N 2 0 218.344 2.215 20 0 BEADRP [NH3+]C1C[C@H]2CCC[C@@H](C1)C2[NH2+]C1CCCC1 ZINC000334858903 181345049 /nfs/dbraw/zinc/34/50/49/181345049.db2.gz XFWILLSCVGXIFP-KCXRBIIJSA-N 2 0 222.376 2.425 20 0 BEADRP [NH3+]CCC[NH2+][C@H]1CCC[C@@H]1c1ccccc1 ZINC000437779773 201371192 /nfs/dbraw/zinc/37/11/92/201371192.db2.gz CAJVAUYCYWRIBJ-KGLIPLIRSA-N 2 0 218.344 2.261 20 0 BEADRP CC[C@@H](Cc1ccc(C)cc1)[NH2+]CCC[NH3+] ZINC000437768101 201371476 /nfs/dbraw/zinc/37/14/76/201371476.db2.gz AQSXWUWCMMEYMY-AWEZNQCLSA-N 2 0 220.360 2.255 20 0 BEADRP C[C@H](CCc1ccccc1F)[NH2+]CCC[NH3+] ZINC000437772183 201371828 /nfs/dbraw/zinc/37/18/28/201371828.db2.gz JKOXEGQNJQXMDL-LLVKDONJSA-N 2 0 224.323 2.085 20 0 BEADRP C[C@@H](C[NH2+][C@@H](C1CC1)C1CCC1)C[NH+](C)C ZINC000453224467 202712256 /nfs/dbraw/zinc/71/22/56/202712256.db2.gz AXGZAGOPMIHUOA-SMDDNHRTSA-N 2 0 224.392 2.352 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@@H](C1CC1)C1CCC1 ZINC000453091319 202699422 /nfs/dbraw/zinc/69/94/22/202699422.db2.gz PPZTVNUFFXCTGQ-CQSZACIVSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]([NH2+]CC1(C)CC[NH2+]CC1)c1cscn1 ZINC000573316011 364795058 /nfs/dbraw/zinc/79/50/58/364795058.db2.gz VUFOYESDJGAUMM-SNVBAGLBSA-N 2 0 239.388 2.183 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+]CC1CC[NH2+]CC1 ZINC000573436885 364830778 /nfs/dbraw/zinc/83/07/78/364830778.db2.gz MXADMKJXGDCOPF-LBPRGKRZSA-N 2 0 233.359 2.040 20 0 BEADRP CCO[C@H](CC[NH+](C)C)C[NH2+]CC1(C)CCC1 ZINC000434753552 541390498 /nfs/dbraw/zinc/39/04/98/541390498.db2.gz GAMMDFFIHMAPSP-CYBMUJFWSA-N 2 0 242.407 2.123 20 0 BEADRP COC1CCC(C[NH2+][C@H]2CCC[C@H]([NH3+])C2)CC1 ZINC000573696560 364896780 /nfs/dbraw/zinc/89/67/80/364896780.db2.gz JVQFQZAPCNVPAG-QPPOZKHWSA-N 2 0 240.391 2.051 20 0 BEADRP [NH3+]CCCCCC[N@@H+]1CCOc2ccccc2C1 ZINC000063013462 181375453 /nfs/dbraw/zinc/37/54/53/181375453.db2.gz JHHQAMQCPBXMDO-UHFFFAOYSA-N 2 0 248.370 2.400 20 0 BEADRP CCC[C@H]1CCC[N@H+](C[C@H]2CC[NH2+]C2)C1 ZINC000309843147 541429852 /nfs/dbraw/zinc/42/98/52/541429852.db2.gz RAMQXRTWIOZHSD-STQMWFEESA-N 2 0 210.365 2.108 20 0 BEADRP [NH3+]CCC[N@H+](CC1CC1)CC1CCCC1 ZINC000309589217 181379991 /nfs/dbraw/zinc/37/99/91/181379991.db2.gz YBTJIFRONHPQOM-UHFFFAOYSA-N 2 0 210.365 2.237 20 0 BEADRP CN(CCC[NH3+])Cc1ccccc1OCC1CC1 ZINC000574691829 365122450 /nfs/dbraw/zinc/12/24/50/365122450.db2.gz SVMBPDDOUPHAOD-UHFFFAOYSA-N 2 0 248.370 2.256 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)C1C[NH2+]C1)[C@@H]1CC2CCC1CC2 ZINC000575873237 365399430 /nfs/dbraw/zinc/39/94/30/365399430.db2.gz LNWMWSUZRCVKMN-XILHMQAWSA-N 2 0 236.403 2.399 20 0 BEADRP CC(C)[NH2+]CCC[NH2+][C@@H](C(C)C)C1CC1 ZINC000575914103 365410773 /nfs/dbraw/zinc/41/07/73/365410773.db2.gz BYNMGUZNYOLGEU-ZDUSSCGKSA-N 2 0 212.381 2.399 20 0 BEADRP [NH3+]C[C@@H]1CCC[N@H+](CCCc2ccsc2)C1 ZINC000579712580 366989152 /nfs/dbraw/zinc/98/91/52/366989152.db2.gz RXGFIOPISDBOFU-ZDUSSCGKSA-N 2 0 238.400 2.351 20 0 BEADRP C(C[NH2+][C@@H]1CCCC12CC2)C[NH+]1CCCC1 ZINC000579853812 367052726 /nfs/dbraw/zinc/05/27/26/367052726.db2.gz CBRRFIGGGNXSBH-CYBMUJFWSA-N 2 0 222.376 2.395 20 0 BEADRP c1ccc(CC[N@@H+]2CCC[C@@H]3C[NH2+]CC[C@H]32)cc1 ZINC000631887136 370835090 /nfs/dbraw/zinc/83/50/90/370835090.db2.gz OCGUHYSEZDXCRR-HZPDHXFCSA-N 2 0 244.382 2.303 20 0 BEADRP CC(C)N(Cc1ccccn1)C[C@]1(C)CC[NH2+]C1 ZINC000580893667 367199179 /nfs/dbraw/zinc/19/91/79/367199179.db2.gz ZIXZUZNMVOAQRE-OAHLLOKOSA-N 2 0 247.386 2.292 20 0 BEADRP C[C@@H]1C[C@@H](C[N@H+](C)Cc2cccc(O)c2)CC[NH2+]1 ZINC000580939947 367210570 /nfs/dbraw/zinc/21/05/70/367210570.db2.gz NKZDVDVQNBLKHF-OCCSQVGLSA-N 2 0 248.370 2.212 20 0 BEADRP CC(C)C[C@@H](N)C[N@@H+]1C[C@H](C)CC1(C)C ZINC000380576899 367245564 /nfs/dbraw/zinc/24/55/64/367245564.db2.gz VIWIKQWORONPNJ-VXGBXAGGSA-N 2 0 212.381 2.480 20 0 BEADRP C(=C\c1ccccc1)\CN1CC[C@@]2(CC[NH2+]C2)C1 ZINC000381082598 367348841 /nfs/dbraw/zinc/34/88/41/367348841.db2.gz IUNQKCWCRVIKKQ-HQQUCIOCSA-N 2 0 242.366 2.385 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+]CC1=CC[N@H+](C)CC1 ZINC000381357995 367388019 /nfs/dbraw/zinc/38/80/19/367388019.db2.gz DTBPOCUVBJMZJG-KGLIPLIRSA-N 2 0 222.376 2.417 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]C2(C3CC3)CC2)CC1 ZINC000381363008 367388054 /nfs/dbraw/zinc/38/80/54/367388054.db2.gz DLQIUWYQEKCLQI-UHFFFAOYSA-N 2 0 222.376 2.391 20 0 BEADRP CC[C@@H](C[N@H+](C)CCC[NH3+])c1ccccc1 ZINC000382089734 367484639 /nfs/dbraw/zinc/48/46/39/367484639.db2.gz XUSONCOZSCAYFA-ZDUSSCGKSA-N 2 0 220.360 2.461 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+][C@H]1CCC[C@H]2C[C@H]21 ZINC000382181448 367494949 /nfs/dbraw/zinc/49/49/49/367494949.db2.gz ZNMRCCKAFUCEGM-RVMXOQNASA-N 2 0 210.365 2.105 20 0 BEADRP CC(C)[C@@H]([NH2+]CCC[NH2+]C1CC1)C1CC1 ZINC000382548864 367537056 /nfs/dbraw/zinc/53/70/56/367537056.db2.gz RPABIPHTZZBTEM-CYBMUJFWSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH2+]CCC[NH2+]C1CC1)c1ccccc1 ZINC000382586380 367544881 /nfs/dbraw/zinc/54/48/81/367544881.db2.gz UETDZONYVXLWBK-LBPRGKRZSA-N 2 0 218.344 2.479 20 0 BEADRP CCOc1cccc(C[NH2+]CCC[NH2+]C2CC2)c1 ZINC000382593821 367546860 /nfs/dbraw/zinc/54/68/60/367546860.db2.gz ITQBBECNYZCKPS-UHFFFAOYSA-N 2 0 248.370 2.317 20 0 BEADRP C[C@@H]1CCCC[C@H]1[NH2+]CCC[NH2+]C1CC1 ZINC000382602026 367547746 /nfs/dbraw/zinc/54/77/46/367547746.db2.gz SLNHVBZATCPRIT-DGCLKSJQSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H](C[NH3+])N(C)Cc1cccc(C2CC2)c1 ZINC000382983298 367579819 /nfs/dbraw/zinc/57/98/19/367579819.db2.gz ZAEJTGUZBCJQGF-LLVKDONJSA-N 2 0 218.344 2.343 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]CC1CC(F)(F)C1 ZINC000383149441 367601095 /nfs/dbraw/zinc/60/10/95/367601095.db2.gz ODGSBXOOELDCEW-FOGDFJRCSA-N 2 0 246.345 2.350 20 0 BEADRP CCC[NH+]1CCC([NH2+]CC2CC(F)(F)C2)CC1 ZINC000383155690 367602908 /nfs/dbraw/zinc/60/29/08/367602908.db2.gz IHARXIGAXMCXTK-UHFFFAOYSA-N 2 0 246.345 2.496 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+]CC1CC(F)(F)C1 ZINC000383199936 367604906 /nfs/dbraw/zinc/60/49/06/367604906.db2.gz YVAOEPOSPBAXHI-GHMZBOCLSA-N 2 0 232.318 2.139 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]CC1CC(F)(F)C1 ZINC000383199943 367605585 /nfs/dbraw/zinc/60/55/85/367605585.db2.gz YVAOEPOSPBAXHI-WDEREUQCSA-N 2 0 232.318 2.139 20 0 BEADRP CCC[NH2+]CC[NH2+]C[C@@H]1CCC[C@@H](C)C1 ZINC000383112715 367597548 /nfs/dbraw/zinc/59/75/48/367597548.db2.gz IDESIYQXLOEIHT-CHWSQXEVSA-N 2 0 212.381 2.402 20 0 BEADRP CCC[C@@H](C)[C@@H]1CCC[N@@H+]1CCC[NH2+]C ZINC000581612321 367635037 /nfs/dbraw/zinc/63/50/37/367635037.db2.gz LVGZUFLGDTUUPD-OLZOCXBDSA-N 2 0 212.381 2.497 20 0 BEADRP CC[C@@H]1[C@@H](C)CCN1CC[NH2+]C(C)(C)C ZINC000384009027 367668045 /nfs/dbraw/zinc/66/80/45/367668045.db2.gz KAGFZARRBRTRCG-NWDGAFQWSA-N 2 0 212.381 2.495 20 0 BEADRP CCCCC[N@H+](C[C@H](O)CN(C)CC)C(C)C ZINC000384049833 367670073 /nfs/dbraw/zinc/67/00/73/367670073.db2.gz WLXLNYDUXRPNOF-CQSZACIVSA-N 2 0 244.423 2.200 20 0 BEADRP C[C@@H]([NH3+])CN1CCC(OCc2ccccc2)CC1 ZINC000384031283 367670352 /nfs/dbraw/zinc/67/03/52/367670352.db2.gz AXDGZZYGEVJNHJ-CYBMUJFWSA-N 2 0 248.370 2.015 20 0 BEADRP CC[C@@H]1[C@H](C)CC[N@@H+]1C[C@H]1CC[NH2+][C@H](C)C1 ZINC000384156547 367673466 /nfs/dbraw/zinc/67/34/66/367673466.db2.gz LPKOOOMJKVLJIL-YIYPIFLZSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@H]1CCCSC1 ZINC000384175988 367674469 /nfs/dbraw/zinc/67/44/69/367674469.db2.gz VNMJSDOKGNSFRH-VXGBXAGGSA-N 2 0 230.421 2.237 20 0 BEADRP CSCC1CCC([NH2+]C[C@H]2CCC[NH2+]2)CC1 ZINC000385353619 367822249 /nfs/dbraw/zinc/82/22/49/367822249.db2.gz FYDUWFLMHRRKQF-WXRRBKDZSA-N 2 0 242.432 2.250 20 0 BEADRP C[C@H]([N@H+](C)CC[C@H]1CCC[NH2+]C1)C1(C)CC1 ZINC000385417291 367827824 /nfs/dbraw/zinc/82/78/24/367827824.db2.gz ZHKIHCMJHOJTFF-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CC2([NH3+])CCCCC2)[C@H]1C ZINC000386085139 367910005 /nfs/dbraw/zinc/91/00/05/367910005.db2.gz DTWBGWABCBXYDW-GRYCIOLGSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]([NH2+]CC1(C)CCC1)[C@@H]1CCCC[NH2+]1 ZINC000386127257 367915460 /nfs/dbraw/zinc/91/54/60/367915460.db2.gz NXXBKFVXXHSRPO-NEPJUHHUSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]([NH2+][C@H]1CC=CCC1)[C@@H]1CCCC[NH2+]1 ZINC000386125378 367915812 /nfs/dbraw/zinc/91/58/12/367915812.db2.gz NQUMITAELWXBJG-AVGNSLFASA-N 2 0 208.349 2.215 20 0 BEADRP COc1cccc(C[N@@H+]2C[C@@H](C)[C@](C)(C[NH3+])C2)c1 ZINC000386215094 367932140 /nfs/dbraw/zinc/93/21/40/367932140.db2.gz YFYZPMPFCVCKFK-IUODEOHRSA-N 2 0 248.370 2.112 20 0 BEADRP C[C@@H]([NH2+]CC1CCCC1)[C@@H]1CCCC[NH2+]1 ZINC000385984603 367893292 /nfs/dbraw/zinc/89/32/92/367893292.db2.gz DBWNCRRILBDTRG-YPMHNXCESA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]([NH2+]CC1CCCC1)[C@H]1CCCC[NH2+]1 ZINC000385984600 367893308 /nfs/dbraw/zinc/89/33/08/367893308.db2.gz DBWNCRRILBDTRG-DGCLKSJQSA-N 2 0 210.365 2.297 20 0 BEADRP CSCCCC[NH2+][C@H](C)[C@@H]1CCCC[NH2+]1 ZINC000386596409 367999011 /nfs/dbraw/zinc/99/90/11/367999011.db2.gz SVENNJIBXAMGCM-NEPJUHHUSA-N 2 0 230.421 2.250 20 0 BEADRP CSC1(C[NH2+][C@@H](C)[C@H]2CCCC[NH2+]2)CCC1 ZINC000386598233 367999784 /nfs/dbraw/zinc/99/97/84/367999784.db2.gz UBAONMAWVJGHDF-NWDGAFQWSA-N 2 0 242.432 2.392 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(C[NH3+])cc2)[C@H]1C ZINC000386310586 367949027 /nfs/dbraw/zinc/94/90/27/367949027.db2.gz WUBYWVCJZGWWMD-UHIISALHSA-N 2 0 218.344 2.279 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+][C@H]1CC12CCCC2 ZINC000387025123 368042248 /nfs/dbraw/zinc/04/22/48/368042248.db2.gz NGAYLCGCKNEZAR-XQQFMLRXSA-N 2 0 222.376 2.426 20 0 BEADRP [NH3+]CCc1cccc(-c2ccc(C[NH3+])cc2)c1 ZINC000005763206 368371841 /nfs/dbraw/zinc/37/18/41/368371841.db2.gz NLYSWAPDRCWOBQ-UHFFFAOYSA-N 2 0 226.323 2.314 20 0 BEADRP C[C@@H](C[N@H+](C)C[C@H]1CC[NH2+]C1)C(C)(C)C ZINC000399697691 368486603 /nfs/dbraw/zinc/48/66/03/368486603.db2.gz BLUJAYOHLSOWSY-RYUDHWBXSA-N 2 0 212.381 2.210 20 0 BEADRP C[C@H](C[N@H+](C)C[C@H]1CC[NH2+]C1)C(C)(C)C ZINC000399697686 368487361 /nfs/dbraw/zinc/48/73/61/368487361.db2.gz BLUJAYOHLSOWSY-NEPJUHHUSA-N 2 0 212.381 2.210 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]CCc2cccs2)C1 ZINC000086402008 368879746 /nfs/dbraw/zinc/87/97/46/368879746.db2.gz KCILGDIMEMQHAH-WDEREUQCSA-N 2 0 224.373 2.150 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCC[C@@H]([NH3+])C1)C1CCCC1 ZINC000088162989 368906778 /nfs/dbraw/zinc/90/67/78/368906778.db2.gz SMPRYMGHYAGJJI-RTXFEEFZSA-N 2 0 210.365 2.425 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]CC(C1CC1)C1CC1 ZINC000084223080 368850254 /nfs/dbraw/zinc/85/02/54/368850254.db2.gz PXJDILBAPPDSFW-JSGCOSHPSA-N 2 0 222.376 2.140 20 0 BEADRP CC(C)OC[C@H](C)[NH2+]C[C@@H]1CCCC[N@H+](C)C1 ZINC000623657093 368998154 /nfs/dbraw/zinc/99/81/54/368998154.db2.gz JRBYVINUVSXNDU-KBPBESRZSA-N 2 0 242.407 2.121 20 0 BEADRP N[C@H]1CCCCC[N@H+](C[C@@H]2C[C@H]3C[C@H]3C2)C1 ZINC000631834853 369040671 /nfs/dbraw/zinc/04/06/71/369040671.db2.gz HDULDWJHYFQVSX-CRWXNKLISA-N 2 0 222.376 2.236 20 0 BEADRP C[C@H](Cc1ccsc1)N[C@@H](C)[C@H]1CCC[NH2+]1 ZINC000400483036 369350684 /nfs/dbraw/zinc/35/06/84/369350684.db2.gz WPTAGDQTUUEHOP-NTZNESFSSA-N 2 0 238.400 2.409 20 0 BEADRP C[C@@H]([NH2+]CC(C1CC1)C1CC1)[C@H]1CCC[NH2+]1 ZINC000400631320 369351810 /nfs/dbraw/zinc/35/18/10/369351810.db2.gz LTBKAWNRIMEAJT-QMTHXVAHSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H]1C[N@H+](CCCc2ccccc2)C[C@H]1C[NH3+] ZINC000631843096 369373181 /nfs/dbraw/zinc/37/31/81/369373181.db2.gz JGCWODWIDVAGJA-DZGCQCFKSA-N 2 0 232.371 2.146 20 0 BEADRP C[C@H]1C[C@@H]1C[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000459656182 203330305 /nfs/dbraw/zinc/33/03/05/203330305.db2.gz FXPLJWSRZDQASC-CMPLNLGQSA-N 2 0 215.300 2.080 20 0 BEADRP CC[C@@H](C)C[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC000459723598 203342975 /nfs/dbraw/zinc/34/29/75/203342975.db2.gz AGPISJSQXYJKFF-OLZOCXBDSA-N 2 0 212.381 2.354 20 0 BEADRP C[N@@H+]1CCC[C@@H](CC[NH2+]CC(C)(C)C)C1 ZINC000459732721 203345902 /nfs/dbraw/zinc/34/59/02/203345902.db2.gz MPXHIENATIXJQZ-LBPRGKRZSA-N 2 0 212.381 2.354 20 0 BEADRP CC(C)[C@@H](C)[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC000459736644 203346345 /nfs/dbraw/zinc/34/63/45/203346345.db2.gz QEFSUWFEHVGBHT-CHWSQXEVSA-N 2 0 212.381 2.352 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC000459776121 203365297 /nfs/dbraw/zinc/36/52/97/203365297.db2.gz KCANJWWJJMKGRC-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP CCC1CC([NH2+]CC[C@@H]2CCC[N@H+](C)C2)C1 ZINC000459798406 203374321 /nfs/dbraw/zinc/37/43/21/203374321.db2.gz XQAGILBFSYVHQG-MOKVOYLWSA-N 2 0 224.392 2.497 20 0 BEADRP CC[NH+]1CCC(CC[NH2+][C@H](C)C2CC2)CC1 ZINC000165384842 203383991 /nfs/dbraw/zinc/38/39/91/203383991.db2.gz FYPHNOGLXDIWMS-GFCCVEGCSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC[C@H]2CCC[N@H+](C)C2)[C@H]1C ZINC000459783934 203368024 /nfs/dbraw/zinc/36/80/24/203368024.db2.gz NMJWWDMVZUDEFV-RQJABVFESA-N 2 0 224.392 2.352 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)C2CC2)C1 ZINC000165265531 203383771 /nfs/dbraw/zinc/38/37/71/203383771.db2.gz XHSPPKIHNBZQIZ-NWDGAFQWSA-N 2 0 210.365 2.106 20 0 BEADRP C[N@@H+]1CCC[C@H]1CC[NH2+][C@H]1CCC[C@@H]2C[C@@H]21 ZINC000459795037 203371834 /nfs/dbraw/zinc/37/18/34/203371834.db2.gz XGVGBIPVMITCNQ-RFGFWPKPSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000252135867 369999197 /nfs/dbraw/zinc/99/91/97/369999197.db2.gz LLZKBJNVLGPPPU-HZSPNIEDSA-N 2 0 224.392 2.402 20 0 BEADRP COc1ccc(C)cc1C[N@@H+]1C[C@@H](C[NH3+])C[C@H]1C ZINC000252698587 370117676 /nfs/dbraw/zinc/11/76/76/370117676.db2.gz NYKAIWCVHBKNNN-CHWSQXEVSA-N 2 0 248.370 2.173 20 0 BEADRP CCOc1ccc(C[N@@H+]2CC[C@@H]([C@H](C)[NH3+])C2)cc1 ZINC000252754354 370122674 /nfs/dbraw/zinc/12/26/74/370122674.db2.gz BAXMBCKYOZUBNV-GXTWGEPZSA-N 2 0 248.370 2.254 20 0 BEADRP COc1cccc([C@H](C)[N@@H+]2CC[C@H]([C@H](C)[NH3+])C2)c1 ZINC000252763349 370125247 /nfs/dbraw/zinc/12/52/47/370125247.db2.gz HLUMIFWZKIFFGL-OBJOEFQTSA-N 2 0 248.370 2.425 20 0 BEADRP CC(C)[C@H]1CC[C@@H]1[NH2+]CCN1CC[C@@H](C)C1 ZINC000309676205 370241977 /nfs/dbraw/zinc/24/19/77/370241977.db2.gz LUQCSETVUVWRKV-MCIONIFRSA-N 2 0 224.392 2.352 20 0 BEADRP C([NH2+][C@]12CCC[C@@H]1C[NH2+]C2)[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000631867587 370303622 /nfs/dbraw/zinc/30/36/22/370303622.db2.gz XEQLWJVNJZTWPP-QMIVOQANSA-N 2 0 234.387 2.154 20 0 BEADRP CC1CC(C[NH2+][C@@H]2CC[N@H+](C)[C@H]3CCC[C@@H]32)C1 ZINC000621770702 370513601 /nfs/dbraw/zinc/51/36/01/370513601.db2.gz WFDRFPFFVSSKDE-ODGNXRKOSA-N 2 0 236.403 2.495 20 0 BEADRP CC[NH+]1CCC([NH2+]CC2CC(C)C2)CC1 ZINC000621739785 370497486 /nfs/dbraw/zinc/49/74/86/370497486.db2.gz XUHYRTGMTRQELB-UHFFFAOYSA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@H](CC(F)F)C[N@@H+]1C[C@@H]2CCC[C@]2([NH3+])C1 ZINC000621784431 370535626 /nfs/dbraw/zinc/53/56/26/370535626.db2.gz OVRSSUCOFLPBTB-MDZLAQPJSA-N 2 0 246.345 2.481 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+][C@@]2(C)CCCOC2)CC1(C)C ZINC000623908127 371150052 /nfs/dbraw/zinc/15/00/52/371150052.db2.gz PULIHWSOCPVZQU-OCCSQVGLSA-N 2 0 240.391 2.018 20 0 BEADRP CC(C)[C@H](C)[NH2+]C[C@H]1CCCC[N@H+](C)C1 ZINC000624120447 371321382 /nfs/dbraw/zinc/32/13/82/371321382.db2.gz ZKEXPWFGPDJRIO-QWHCGFSZSA-N 2 0 212.381 2.352 20 0 BEADRP CC(C)[C@@H](C)[NH2+]C[C@@H]1CCCC[N@H+](C)C1 ZINC000624120446 371321449 /nfs/dbraw/zinc/32/14/49/371321449.db2.gz ZKEXPWFGPDJRIO-OLZOCXBDSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCCC[N@H+](C)C2)[C@H]1C ZINC000624124120 371325058 /nfs/dbraw/zinc/32/50/58/371325058.db2.gz XTDSHSXYNFRKQQ-RFGFWPKPSA-N 2 0 224.392 2.352 20 0 BEADRP CCC(F)(F)C[NH2+][C@H](C)C1CC[NH+](C)CC1 ZINC000624148181 371344313 /nfs/dbraw/zinc/34/43/13/371344313.db2.gz XSILGPAAKCRFQO-SNVBAGLBSA-N 2 0 234.334 2.352 20 0 BEADRP C[N@@H+]1CCC[C@H]1CC[NH+]1CCC2(CCC2)C1 ZINC000162256984 371641208 /nfs/dbraw/zinc/64/12/08/371641208.db2.gz IRTCYPVMGRGTSZ-ZDUSSCGKSA-N 2 0 222.376 2.347 20 0 BEADRP C[C@@H]1OCC[C@H]1[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000134203505 372178996 /nfs/dbraw/zinc/17/89/96/372178996.db2.gz YFFZSPSKQKTXJO-WCQYABFASA-N 2 0 240.391 2.016 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@H+](C)C(C)(C)C2)[C@@H](C)O1 ZINC000631218276 372240627 /nfs/dbraw/zinc/24/06/27/372240627.db2.gz MHSCYJOFIRUHJD-LPWJVIDDSA-N 2 0 240.391 2.015 20 0 BEADRP C[C@@H](c1ccccn1)N1CCCCC[C@H]([NH3+])C1 ZINC000631834282 372618825 /nfs/dbraw/zinc/61/88/25/372618825.db2.gz UBYWLOYZHIJNRQ-STQMWFEESA-N 2 0 233.359 2.346 20 0 BEADRP CCO[C@H](C[N@@H+]1CCCCC[C@H]([NH3+])C1)C1CC1 ZINC000631835334 372622908 /nfs/dbraw/zinc/62/29/08/372622908.db2.gz SAWBHTAUXOWYSQ-UONOGXRCSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@H](C[N@H+]1C[C@@H](C[NH3+])[C@H](C)C1)C(C)(C)C ZINC000631837059 372627825 /nfs/dbraw/zinc/62/78/25/372627825.db2.gz MJDFPDORDOBHLL-IJLUTSLNSA-N 2 0 212.381 2.195 20 0 BEADRP C[C@@H](C[N@H+]1C[C@@H](C[NH3+])[C@H](C)C1)C(C)(C)C ZINC000631837058 372627842 /nfs/dbraw/zinc/62/78/42/372627842.db2.gz MJDFPDORDOBHLL-GRYCIOLGSA-N 2 0 212.381 2.195 20 0 BEADRP C[C@@H]1C[N@H+](CCCC(C)(C)C)C[C@H]1C[NH3+] ZINC000631837832 372630180 /nfs/dbraw/zinc/63/01/80/372630180.db2.gz FYGCXUVPJRURON-VXGBXAGGSA-N 2 0 212.381 2.339 20 0 BEADRP Cc1cc(C)cc(C[N@H+]2C[C@H](C)[C@H](C[NH3+])C2)c1 ZINC000631844457 372643280 /nfs/dbraw/zinc/64/32/80/372643280.db2.gz XLDPZFZRFUFVRV-DZGCQCFKSA-N 2 0 232.371 2.330 20 0 BEADRP C[C@H]1C[C@@H]([NH3+])CN1CCCCC(F)(F)F ZINC000631862522 372663101 /nfs/dbraw/zinc/66/31/01/372663101.db2.gz QKNXVKJGJGDOMA-DTWKUNHWSA-N 2 0 224.270 2.141 20 0 BEADRP FC1(F)CC[C@H](C[NH2+][C@]23CCC[C@@H]2C[NH2+]C3)C1 ZINC000631867047 372667974 /nfs/dbraw/zinc/66/79/74/372667974.db2.gz HSQORMPDDCARKV-TUAOUCFPSA-N 2 0 244.329 2.154 20 0 BEADRP C([C@H]1CC[NH2+]C1)[N@@H+]1CCC[C@H](C2CCC2)CC1 ZINC000631873779 372675590 /nfs/dbraw/zinc/67/55/90/372675590.db2.gz WBCADJVWECMQBS-ZFWWWQNUSA-N 2 0 236.403 2.498 20 0 BEADRP CC(C)CC[N@@H+]1CCC[C@H]2C[NH2+]CC[C@@H]21 ZINC000631884991 372682982 /nfs/dbraw/zinc/68/29/82/372682982.db2.gz RKRRVSKXYSJTBB-STQMWFEESA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H](C[N@H+](C)CCC[NH3+])C1CCCCC1 ZINC000379981675 373099943 /nfs/dbraw/zinc/09/99/43/373099943.db2.gz HSHLEADPMODECW-LBPRGKRZSA-N 2 0 212.381 2.483 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]C1CCSCC1 ZINC000161585339 205528084 /nfs/dbraw/zinc/52/80/84/205528084.db2.gz NGMYNWHOPGQRMU-NQBHXWOUSA-N 2 0 242.432 2.200 20 0 BEADRP COCCC[C@@H](C)[NH2+][C@H]1CCC[C@H]([NH+](C)C)C1 ZINC000178305213 134306007 /nfs/dbraw/zinc/30/60/07/134306007.db2.gz ISPSKAKNKBEYHR-RDBSUJKOSA-N 2 0 242.407 2.264 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+][C@@H]1C[C@H]1C1CCC1 ZINC000424381315 206038170 /nfs/dbraw/zinc/03/81/70/206038170.db2.gz YJXAVLUQEQUKPS-IGQOVBAYSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@H]1[C@H](c2ccccc2)C[C@@H]1[NH2+]CCC[NH3+] ZINC000437759646 206070268 /nfs/dbraw/zinc/07/02/68/206070268.db2.gz DOAWTWQHKXQQMK-YUTCNCBUSA-N 2 0 218.344 2.117 20 0 BEADRP Cc1ccc(C)c(C[NH2+][C@H](C)CC[NH3+])c1 ZINC000220538812 134309443 /nfs/dbraw/zinc/30/94/43/134309443.db2.gz OYZJOALBAMBAQR-GFCCVEGCSA-N 2 0 206.333 2.130 20 0 BEADRP CCC[N@H+](CC)C[C@H](C)Nc1cc[nH+]c(C)c1 ZINC000357773365 169127136 /nfs/dbraw/zinc/12/71/36/169127136.db2.gz GJWNCXOERBATPA-ZDUSSCGKSA-N 2 0 235.375 2.344 20 0 BEADRP CCC[N@H+](CC)C[C@H](C)Nc1cc(C)ncn1 ZINC000357817356 169130341 /nfs/dbraw/zinc/13/03/41/169130341.db2.gz ZCFPTOILYUXUFC-LBPRGKRZSA-N 2 0 236.363 2.317 20 0 BEADRP CCC[N@H+](CC1CC1)C[C@@H]1CCC[NH2+]C1 ZINC000042491162 169138284 /nfs/dbraw/zinc/13/82/84/169138284.db2.gz BRTHZIPZORWRHM-CYBMUJFWSA-N 2 0 210.365 2.108 20 0 BEADRP CCC[NH+](CCC)CCC[NH2+]CC1(C)COC1 ZINC000352830738 169147404 /nfs/dbraw/zinc/14/74/04/169147404.db2.gz VCSAOYKSMINJBX-UHFFFAOYSA-N 2 0 242.407 2.125 20 0 BEADRP CCC[N@H+](CCC[NH+](CC)CC)CC(C)(C)O ZINC000338315904 169155870 /nfs/dbraw/zinc/15/58/70/169155870.db2.gz PUSQHTVUFYSVDR-UHFFFAOYSA-N 2 0 244.423 2.201 20 0 BEADRP CCC[NH+]1CCC(C[NH2+][C@@H](C)[C@H](C)OC)CC1 ZINC000361156068 169187214 /nfs/dbraw/zinc/18/72/14/169187214.db2.gz QPROAIYPBCARSO-STQMWFEESA-N 2 0 242.407 2.121 20 0 BEADRP CCC[NH+]1CCC([NH2+]CCCCCOC)CC1 ZINC000122616041 169187976 /nfs/dbraw/zinc/18/79/76/169187976.db2.gz RRRQCDHKWCVYJI-UHFFFAOYSA-N 2 0 242.407 2.267 20 0 BEADRP CCC[NH+]1CCC([NH2+]CCCSC)CC1 ZINC000020190089 169188401 /nfs/dbraw/zinc/18/84/01/169188401.db2.gz NPCFXNQFSABNJF-UHFFFAOYSA-N 2 0 230.421 2.204 20 0 BEADRP CCC[NH+]1CCC([NH2+]C[C@@H]2CC[C@@H](C)O2)CC1 ZINC000127736670 169188675 /nfs/dbraw/zinc/18/86/75/169188675.db2.gz QCZCWZQDXBEGTJ-OCCSQVGLSA-N 2 0 240.391 2.018 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H](C)CCCCO)CC1 ZINC000352701778 169189732 /nfs/dbraw/zinc/18/97/32/169189732.db2.gz NXWHWFTYGUBNOW-ZDUSSCGKSA-N 2 0 242.407 2.002 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H](C)[C@@H]2CCCO2)CC1 ZINC000020205796 169189897 /nfs/dbraw/zinc/18/98/97/169189897.db2.gz XHMINQOXFUIFEL-JSGCOSHPSA-N 2 0 240.391 2.018 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H](C)C2CC2)CC1 ZINC000020189718 169189926 /nfs/dbraw/zinc/18/99/26/169189926.db2.gz UMGXLDAKCAPAJL-NSHDSACASA-N 2 0 210.365 2.249 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H]2CSC[C@@H]2C)CC1 ZINC000304575755 169190071 /nfs/dbraw/zinc/19/00/71/169190071.db2.gz XQVOAAAVJHQVHV-AAEUAGOBSA-N 2 0 242.432 2.202 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+]CCC(C)C)C1 ZINC000076453766 169206966 /nfs/dbraw/zinc/20/69/66/169206966.db2.gz QETFLROOSXLZSY-ZDUSSCGKSA-N 2 0 212.381 2.354 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)C(C)(C)OC)C1 ZINC000340197245 169207302 /nfs/dbraw/zinc/20/73/02/169207302.db2.gz DRSAVNJZBYNLOT-STQMWFEESA-N 2 0 242.407 2.121 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+]CCSCC)C1 ZINC000336765290 169207419 /nfs/dbraw/zinc/20/74/19/169207419.db2.gz QSFMMYVUDCVAFL-LBPRGKRZSA-N 2 0 230.421 2.061 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)COC(C)C)C1 ZINC000337339614 169208656 /nfs/dbraw/zinc/20/86/56/169208656.db2.gz OSUIRJSHLPWNBR-UONOGXRCSA-N 2 0 242.407 2.121 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H]2CC[C@H]2CC)C1 ZINC000336782972 169209091 /nfs/dbraw/zinc/20/90/91/169209091.db2.gz ZDIVGGNMCSDJIH-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP c1cc([C@@H]2CCC[N@H+]2CC2CC[NH2+]CC2)ccn1 ZINC000132294912 183361165 /nfs/dbraw/zinc/36/11/65/183361165.db2.gz UKBGIKFQLIMVDL-HNNXBMFYSA-N 2 0 245.370 2.218 20 0 BEADRP c1ccc(CC[N@@H+]2CC[C@H]3[NH2+]CCC[C@@H]3C2)cc1 ZINC000082729011 183393090 /nfs/dbraw/zinc/39/30/90/183393090.db2.gz DDDAPRBYVQIKCF-HZPDHXFCSA-N 2 0 244.382 2.303 20 0 BEADRP CCC[NH2+][C@@H]1CC[N@H+](CCCOCC)C[C@@H]1C ZINC000049709335 169282415 /nfs/dbraw/zinc/28/24/15/169282415.db2.gz SSLVMFMCBUQXMV-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP CCC[C@@H](C)[NH2+]CCN1CCC(C)CC1 ZINC000040770989 169369534 /nfs/dbraw/zinc/36/95/34/169369534.db2.gz AFDZHPPNGHUSCX-CYBMUJFWSA-N 2 0 212.381 2.497 20 0 BEADRP CCC[C@@H](C)[NH2+]C[C@H](C)C[NH+]1CCCC1 ZINC000062078125 169369549 /nfs/dbraw/zinc/36/95/49/169369549.db2.gz RGROBZWMNSNWSK-QWHCGFSZSA-N 2 0 212.381 2.497 20 0 BEADRP CCC[C@@H](C)C[N@@H+]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC000352539757 169357863 /nfs/dbraw/zinc/35/78/63/169357863.db2.gz CMAJSUOCDKYPOS-KGLIPLIRSA-N 2 0 224.392 2.498 20 0 BEADRP c1cncc(C[NH2+]CC2CC[NH+](C3CC3)CC2)c1 ZINC000278302310 183494622 /nfs/dbraw/zinc/49/46/22/183494622.db2.gz CXJFCMIYEGLBGC-UHFFFAOYSA-N 2 0 245.370 2.046 20 0 BEADRP CC[C@H](C)C[N@H+](C)CCC[NH+]1CCCC1 ZINC000179309689 134320022 /nfs/dbraw/zinc/32/00/22/134320022.db2.gz ZKORIVSUVXKBSW-ZDUSSCGKSA-N 2 0 212.381 2.450 20 0 BEADRP C[C@@H](C[NH2+]C[C@@H]1CCSC1)C[NH+]1CCCC1 ZINC000224420374 134347051 /nfs/dbraw/zinc/34/70/51/134347051.db2.gz QLSQJDHRDHJLOA-STQMWFEESA-N 2 0 242.432 2.061 20 0 BEADRP CCC[C@H](CC)[NH2+]CCCC[NH+](C)C ZINC000224613782 134349321 /nfs/dbraw/zinc/34/93/21/134349321.db2.gz ZZXLDWJWXRCONW-LBPRGKRZSA-N 2 0 200.370 2.497 20 0 BEADRP [NH3+]C[C@H]1CCCCN1C[C@@H]1CCC(F)(F)C1 ZINC000301020432 383846994 /nfs/dbraw/zinc/84/69/94/383846994.db2.gz ZSWOBXWADCFZCG-GHMZBOCLSA-N 2 0 232.318 2.235 20 0 BEADRP C[N@H+](CCc1ccccc1)[C@H]1CCC[NH2+]CC1 ZINC000088243170 383888290 /nfs/dbraw/zinc/88/82/90/383888290.db2.gz HTZZTINVKYPBKB-HNNXBMFYSA-N 2 0 232.371 2.303 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)o1 ZINC000401109866 383933622 /nfs/dbraw/zinc/93/36/22/383933622.db2.gz GXLWTLVBTGYFQI-FRRDWIJNSA-N 2 0 234.343 2.066 20 0 BEADRP Cc1cnccc1CC[NH2+][C@H]1C[C@@H](C)O[C@@H](C)C1 ZINC000560113872 383905379 /nfs/dbraw/zinc/90/53/79/383905379.db2.gz NJXFTOUGEBYKGT-NHAGDIPZSA-N 2 0 248.370 2.478 20 0 BEADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@@H]2CCCc3cccnc32)C1 ZINC000643542767 383984072 /nfs/dbraw/zinc/98/40/72/383984072.db2.gz XJPFCUFVWYPJRA-KWCYVHTRSA-N 2 0 245.370 2.176 20 0 BEADRP Cc1ncc([C@H](C)[NH2+][C@H]2CC[C@H](C[NH3+])C2)s1 ZINC000643542731 383984400 /nfs/dbraw/zinc/98/44/00/383984400.db2.gz LKZMUSQWJIFFFQ-LSJOCFKGSA-N 2 0 239.388 2.230 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1ccncc1 ZINC000037649297 383991770 /nfs/dbraw/zinc/99/17/70/383991770.db2.gz AQNAYYQJCDGLJG-STQMWFEESA-N 2 0 245.370 2.217 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCCCC[NH+]2CCCC2)CO1 ZINC000647213170 383962575 /nfs/dbraw/zinc/96/25/75/383962575.db2.gz RFJAUASIXZTAPH-KGLIPLIRSA-N 2 0 240.391 2.020 20 0 BEADRP C1=C(CC[NH2+]C(C2CC2)C2CC2)CC[NH2+]C1 ZINC000643545545 384010076 /nfs/dbraw/zinc/01/00/76/384010076.db2.gz XCXNJLRAEXCLPU-UHFFFAOYSA-N 2 0 220.360 2.074 20 0 BEADRP CC[C@@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)C1CC1 ZINC000643545968 384012530 /nfs/dbraw/zinc/01/25/30/384012530.db2.gz GOMWVZDBCXCGIX-CHWSQXEVSA-N 2 0 222.376 2.439 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]CCc1cccc2[nH]ccc21 ZINC000569447678 384050047 /nfs/dbraw/zinc/05/00/47/384050047.db2.gz NVVMYZODUOHQDG-UKRRQHHQSA-N 2 0 243.354 2.180 20 0 BEADRP CCC[C@H](C)C[N@@H+]1CC[C@]2(C1)CCC[NH2+]C2 ZINC000564973527 384053765 /nfs/dbraw/zinc/05/37/65/384053765.db2.gz NRQKIIISPOKHPD-UONOGXRCSA-N 2 0 224.392 2.498 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CC2(C)CCC2)[C@H](C)C1 ZINC000090219867 384035609 /nfs/dbraw/zinc/03/56/09/384035609.db2.gz IFGIANBTQISFAK-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000643549041 384038640 /nfs/dbraw/zinc/03/86/40/384038640.db2.gz ZJEOUXFIOBDNFN-JHJVBQTASA-N 2 0 222.376 2.439 20 0 BEADRP CC[C@@H]1C[N@H+](C[C@@H]2CCC(F)(F)C2)CC[C@@H]1[NH3+] ZINC000302380967 384156286 /nfs/dbraw/zinc/15/62/86/384156286.db2.gz IGZVMKUIJDWMAZ-UTUOFQBUSA-N 2 0 246.345 2.481 20 0 BEADRP Cn1cccc1C[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000092381353 384176733 /nfs/dbraw/zinc/17/67/33/384176733.db2.gz JVQPRQYTONDLTC-UHFFFAOYSA-N 2 0 249.402 2.189 20 0 BEADRP Cc1cnccc1C[N@H+]1CCC[C@@H](C)[C@@H]1CC[NH3+] ZINC000404265906 384166640 /nfs/dbraw/zinc/16/66/40/384166640.db2.gz HHTKPNIPEAPNGK-DOMZBBRYSA-N 2 0 247.386 2.339 20 0 BEADRP C[NH2+]CCC[N@@H+]1[C@H](C)C[C@@H]2CCCC[C@@H]21 ZINC000309636646 384185547 /nfs/dbraw/zinc/18/55/47/384185547.db2.gz MYGIERPFAZSWBT-AGIUHOORSA-N 2 0 210.365 2.249 20 0 BEADRP C[N@H+](C[C@@H]1CCC[NH2+]C1)[C@@H]1CCC(C)(C)C1 ZINC000234335884 384178124 /nfs/dbraw/zinc/17/81/24/384178124.db2.gz RDPKKIHJHGFTRL-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@@H]2CCc3ccccc3C2)C1 ZINC000222999304 384182297 /nfs/dbraw/zinc/18/22/97/384182297.db2.gz HLXQWGPADKOEAF-BZUAXINKSA-N 2 0 244.382 2.403 20 0 BEADRP CCc1ccc(C[N@@H+]2CC[C@H]([C@@H](C)[NH3+])C2)cc1 ZINC000163260135 384196254 /nfs/dbraw/zinc/19/62/54/384196254.db2.gz XINJRGVYNJBMMG-DOMZBBRYSA-N 2 0 232.371 2.418 20 0 BEADRP CCCC[NH+]1CCC2(CCC[N@@H+]2C)CC1 ZINC000336531978 384232440 /nfs/dbraw/zinc/23/24/40/384232440.db2.gz RPOFLCHJOFLHMZ-UHFFFAOYSA-N 2 0 210.365 2.347 20 0 BEADRP C[C@@]1(C[NH3+])CCN(c2cc[nH+]c3ccccc32)C1 ZINC000235416482 384223732 /nfs/dbraw/zinc/22/37/32/384223732.db2.gz HTRKZTLGJQAFJB-HNNXBMFYSA-N 2 0 241.338 2.410 20 0 BEADRP CSCCC[N@H+](C)[C@@H]1CCN(C)[C@@H](C)C1 ZINC000173527570 384224179 /nfs/dbraw/zinc/22/41/79/384224179.db2.gz FXDIFAZOSYUKDS-NWDGAFQWSA-N 2 0 230.421 2.154 20 0 BEADRP COC1(C[NH+]2CCC([C@H](C)[NH3+])CC2)CCCC1 ZINC000319480925 384249084 /nfs/dbraw/zinc/24/90/84/384249084.db2.gz SINKBUCYPWJBGV-LBPRGKRZSA-N 2 0 240.391 2.005 20 0 BEADRP c1coc(CN2CC[C@@H](C[NH+]3CCCC3)C2)c1 ZINC000093596911 384250412 /nfs/dbraw/zinc/25/04/12/384250412.db2.gz OIGXDBGFQVNQJN-ZDUSSCGKSA-N 2 0 234.343 2.197 20 0 BEADRP CCC[C@H](C)[N@H+](C)C[C@H]1CC[NH2+][C@@H](C)C1 ZINC000300055978 384283000 /nfs/dbraw/zinc/28/30/00/384283000.db2.gz LWNBUPILRFOOJA-AVGNSLFASA-N 2 0 212.381 2.495 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCC[N@@H+]2CCCC[C@H]2C)CO1 ZINC000401975652 384355931 /nfs/dbraw/zinc/35/59/31/384355931.db2.gz TYHVZPFCXWSQAL-MGPQQGTHSA-N 2 0 240.391 2.018 20 0 BEADRP C[N@H+](CC[C@@H]1CCC[NH+]1C)CC(C)(C)C ZINC000120497668 384358757 /nfs/dbraw/zinc/35/87/57/384358757.db2.gz FIXNWEYKALBDPE-LBPRGKRZSA-N 2 0 212.381 2.449 20 0 BEADRP C[C@@H]1CCC[C@@H](C[NH+]2CCC([NH3+])CC2)C1 ZINC000084344413 384391697 /nfs/dbraw/zinc/39/16/97/384391697.db2.gz XZOHCXNNXJSUOL-VXGBXAGGSA-N 2 0 210.365 2.236 20 0 BEADRP Cc1cnc(CCn2ccnc2)c(C)c1 ZINC000335620486 384397942 /nfs/dbraw/zinc/39/79/42/384397942.db2.gz ALPLLDGHJQYSLT-UHFFFAOYSA-N 2 0 201.273 2.138 20 0 BEADRP C[NH+](C)CCCC[NH2+]Cc1ccc(F)c(F)c1 ZINC000045598388 384400792 /nfs/dbraw/zinc/40/07/92/384400792.db2.gz HLQYWQUUDJYDBZ-UHFFFAOYSA-N 2 0 242.313 2.396 20 0 BEADRP C[C@]1(C[NH3+])CCN(c2cc[nH+]c3ccccc32)C1 ZINC000235735405 384412098 /nfs/dbraw/zinc/41/20/98/384412098.db2.gz HTRKZTLGJQAFJB-OAHLLOKOSA-N 2 0 241.338 2.410 20 0 BEADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)cc1 ZINC000521369811 384426945 /nfs/dbraw/zinc/42/69/45/384426945.db2.gz FKNYPVWVLNWWOW-TUKIKUTGSA-N 3 0 247.386 2.066 20 0 BEADRP Cc1ccc(F)cc1C[N@H+]1CC[C@@H]([C@H](C)[NH3+])C1 ZINC000229060492 384415978 /nfs/dbraw/zinc/41/59/78/384415978.db2.gz CZTNHRXIRRGYBT-NWDGAFQWSA-N 2 0 236.334 2.303 20 0 BEADRP CC(C)[C@H](C)C[NH2+][C@H]1CCCC[C@@H]1C[NH3+] ZINC000084217039 384376919 /nfs/dbraw/zinc/37/69/19/384376919.db2.gz FDQYHCSGRCLJME-UPJWGTAASA-N 2 0 212.381 2.386 20 0 BEADRP C[N@H+]1CC=C(C[NH2+][C@@H]2CCC23CCC3)CC1 ZINC000335602319 384378005 /nfs/dbraw/zinc/37/80/05/384378005.db2.gz QCMMQMGGPVTGSN-CYBMUJFWSA-N 2 0 220.360 2.171 20 0 BEADRP C[C@@H]1CCC[C@@H]1C[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000300240685 259651483 /nfs/dbraw/zinc/65/14/83/259651483.db2.gz FQUDZKXOQKKKDA-NDBYEHHHSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]([NH2+]C1CCC([NH3+])CC1)[C@H]1CC1(C)C ZINC000335652519 384433024 /nfs/dbraw/zinc/43/30/24/384433024.db2.gz IZRJQBCLPYDFQU-HBIQZDMRSA-N 2 0 210.365 2.281 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]CCc1ccc2[nH]ccc2c1 ZINC000569330261 384470454 /nfs/dbraw/zinc/47/04/54/384470454.db2.gz DYVQYGRAFVHQJS-UKRRQHHQSA-N 2 0 243.354 2.180 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]CCc1ccc2[nH]ccc2c1 ZINC000569330260 384471527 /nfs/dbraw/zinc/47/15/27/384471527.db2.gz DYVQYGRAFVHQJS-HIFRSBDPSA-N 2 0 243.354 2.180 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@H]2CCCSC2)CC1 ZINC000061572204 384508811 /nfs/dbraw/zinc/50/88/11/384508811.db2.gz PZVSFYWSMBSHTP-ZDUSSCGKSA-N 2 0 242.432 2.344 20 0 BEADRP C[C@H]([NH2+]CCC[NH+](C)C)C1CCCCC1 ZINC000037213663 384493036 /nfs/dbraw/zinc/49/30/36/384493036.db2.gz QFKLUJXQZFBTER-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP CC[C@H]([NH2+]CCC[N@H+](C)CCOC)C1CCC1 ZINC000449080496 384536524 /nfs/dbraw/zinc/53/65/24/384536524.db2.gz WQWYDVGZVFHYNK-AWEZNQCLSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@@H]2CCC(F)(F)C2)C[C@H]1C[NH3+] ZINC000306053942 384568537 /nfs/dbraw/zinc/56/85/37/384568537.db2.gz WXWNKODGXHLZMY-IJLUTSLNSA-N 2 0 246.345 2.339 20 0 BEADRP C[NH+](C)CCC[NH2+]CCc1ccc(Cl)cc1 ZINC000103269952 384605944 /nfs/dbraw/zinc/60/59/44/384605944.db2.gz DSNKGPKWHYHEIY-UHFFFAOYSA-N 2 0 240.778 2.424 20 0 BEADRP C[C@@H](CC[NH2+]Cc1cc[nH]c1)[NH+]1CCCCC1 ZINC000184339607 384595478 /nfs/dbraw/zinc/59/54/78/384595478.db2.gz UDYSYNHAISLVAV-ZDUSSCGKSA-N 2 0 235.375 2.369 20 0 BEADRP C[C@@H](C[NH2+][C@H]1CCC12CCCC2)C[NH+](C)C ZINC000309769739 384599514 /nfs/dbraw/zinc/59/95/14/384599514.db2.gz OJQTYSWHZLNCBE-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H](CF)[NH2+]Cc1cc(-n2ccnc2)cs1 ZINC000309850632 384667269 /nfs/dbraw/zinc/66/72/69/384667269.db2.gz XPZZEXDRWKSCNL-VIFPVBQESA-N 2 0 239.319 2.381 20 0 BEADRP CC(C)CSCC[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000309608939 384638265 /nfs/dbraw/zinc/63/82/65/384638265.db2.gz MBKQQQBOXFRGLF-CHWSQXEVSA-N 2 0 244.448 2.448 20 0 BEADRP C[C@@H]([NH3+])[C@@H]1CC[N@H+](CCCC(C)(C)C)C1 ZINC000300896324 384638597 /nfs/dbraw/zinc/63/85/97/384638597.db2.gz QGPQAXIKNMGPCI-VXGBXAGGSA-N 2 0 212.381 2.482 20 0 BEADRP Cc1cccc(CN2CC[C@@H]3CC[NH2+][C@@H]3C2)c1C ZINC000647532753 384640035 /nfs/dbraw/zinc/64/00/35/384640035.db2.gz CNBAVTFEDKEGML-GOEBONIOSA-N 2 0 244.382 2.487 20 0 BEADRP C[N@H+]1CC=C(C[NH2+]Cc2cccc(F)c2)CC1 ZINC000271875021 384646404 /nfs/dbraw/zinc/64/64/04/384646404.db2.gz ZCNDJMVQJZYDAV-UHFFFAOYSA-N 2 0 234.318 2.177 20 0 BEADRP C([NH2+]C[C@H]1CC[C@@H]2C[C@@H]2C1)[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000403385778 384647468 /nfs/dbraw/zinc/64/74/68/384647468.db2.gz QZCKMRSNDYFGMZ-XQLPTFJDSA-N 2 0 248.414 2.497 20 0 BEADRP Cc1cc(C)c(CN(C)CC[NH3+])c(C)c1 ZINC000053299939 384650769 /nfs/dbraw/zinc/65/07/69/384650769.db2.gz SHZYCOURDNLCMM-UHFFFAOYSA-N 2 0 206.333 2.002 20 0 BEADRP C[N@H+](CCC1CC1)CC[C@H]1CCC[NH+]1C ZINC000162615727 384651661 /nfs/dbraw/zinc/65/16/61/384651661.db2.gz BOEXXRDDZKDPBR-CYBMUJFWSA-N 2 0 210.365 2.203 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+]C[C@H]1CCCC(C)(C)C1 ZINC000556932273 384661276 /nfs/dbraw/zinc/66/12/76/384661276.db2.gz NEOSOOUHKHOTIB-RYUDHWBXSA-N 2 0 212.381 2.387 20 0 BEADRP CC(F)(F)CC[NH2+][C@@H]1CCCC[C@@H]1C[NH3+] ZINC000357716674 384683562 /nfs/dbraw/zinc/68/35/62/384683562.db2.gz OWQBZLCFGJGDKC-NXEZZACHSA-N 2 0 220.307 2.139 20 0 BEADRP CC1(C[N@@H+]2CCC[C@H]([C@@H]3CCC[NH2+]C3)C2)CC1 ZINC000647542818 384703476 /nfs/dbraw/zinc/70/34/76/384703476.db2.gz CKOIFMOWLOMTAG-KGLIPLIRSA-N 2 0 236.403 2.498 20 0 BEADRP CC(C)(C)[C@@H]1CCCC[C@@H]1[NH2+]CCOCC[NH3+] ZINC000357067662 384773059 /nfs/dbraw/zinc/77/30/59/384773059.db2.gz CVNJNTIBVDDFTD-OLZOCXBDSA-N 2 0 242.407 2.156 20 0 BEADRP CC[NH2+]Cc1cccc(N[C@H]2C[NH2+]C[C@H](C)C2)c1 ZINC000647546386 384728839 /nfs/dbraw/zinc/72/88/39/384728839.db2.gz HXZFYWWPLDIPEL-IUODEOHRSA-N 2 0 247.386 2.206 20 0 BEADRP CC(C)C[C@H](C)[NH2+][C@H](CN)CC(C)C ZINC000308457476 384733377 /nfs/dbraw/zinc/73/33/77/384733377.db2.gz FFHDFSNZBZLHPK-RYUDHWBXSA-N 2 0 200.370 2.384 20 0 BEADRP CCSCCC[NH2+][C@@H]1CCCC[C@H]1C[NH3+] ZINC000300968117 384739739 /nfs/dbraw/zinc/73/97/39/384739739.db2.gz RNEGOWBMCJJMOR-NWDGAFQWSA-N 2 0 230.421 2.237 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]Cc1ccc2cnccc2c1 ZINC000647552275 384757383 /nfs/dbraw/zinc/75/73/83/384757383.db2.gz ORAZQCJKKCLVJT-NEPJUHHUSA-N 2 0 243.354 2.450 20 0 BEADRP FC1CCC(C[NH2+][C@H]2CCC[NH2+]CC2)CC1 ZINC000647553100 384764720 /nfs/dbraw/zinc/76/47/20/384764720.db2.gz AYZBKVNBDVNFKK-BPCQOVAHSA-N 2 0 228.355 2.246 20 0 BEADRP CC(C)C[C@H](C)[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000336666808 384767317 /nfs/dbraw/zinc/76/73/17/384767317.db2.gz DRSRBFQTJTYXEU-QWHCGFSZSA-N 2 0 212.381 2.400 20 0 BEADRP CC(C)C[C@H]([NH3+])C[NH2+]CC1CCC(F)CC1 ZINC000647553118 384768980 /nfs/dbraw/zinc/76/89/80/384768980.db2.gz BNIUBJJJSZOSCG-BPCQOVAHSA-N 2 0 230.371 2.478 20 0 BEADRP C[C@@H]([NH2+]C1CCC(F)(F)CC1)[C@@H]1CCC[NH2+]1 ZINC000335027342 384772011 /nfs/dbraw/zinc/77/20/11/384772011.db2.gz SAMUWJAOJGHRSQ-KOLCDFICSA-N 2 0 232.318 2.294 20 0 BEADRP C(C[C@@H]1CCC[NH2+]C1)[NH2+][C@@H]1CC[C@H]1C1CC1 ZINC000423268346 384784497 /nfs/dbraw/zinc/78/44/97/384784497.db2.gz GCCRSVQQIOKGCK-FPMFFAJLSA-N 2 0 222.376 2.154 20 0 BEADRP C[C@]1(C[NH2+][C@@H]2CC[C@@H]2C2CC2)CCC[NH2+]C1 ZINC000423332187 384801989 /nfs/dbraw/zinc/80/19/89/384801989.db2.gz HBTRLQJPUUISQR-MCIONIFRSA-N 2 0 222.376 2.154 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000423339582 384812854 /nfs/dbraw/zinc/81/28/54/384812854.db2.gz LJKZRWBWMQLAAZ-BFHYXJOUSA-N 2 0 224.392 2.400 20 0 BEADRP CC[C@H](C[NH2+][C@@H]1C[C@H](C)[C@H]1C)N1CCCC1 ZINC000336674452 384873034 /nfs/dbraw/zinc/87/30/34/384873034.db2.gz BGVXWAATOQXBDF-REWJHTLYSA-N 2 0 224.392 2.495 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@H]2CCC23CCC3)C1 ZINC000423370325 384840974 /nfs/dbraw/zinc/84/09/74/384840974.db2.gz PLJKVYRNZLYMMK-UTUOFQBUSA-N 2 0 208.349 2.179 20 0 BEADRP Cc1cncc([C@H](C)[NH2+][C@@H]2CCC[C@H]([NH3+])C2)c1 ZINC000423373472 384850123 /nfs/dbraw/zinc/85/01/23/384850123.db2.gz HMDAPCYOVQKEBV-FPMFFAJLSA-N 2 0 233.359 2.311 20 0 BEADRP Cc1ncc([C@H](C)[NH2+][C@H]2CCC[C@@H]([NH3+])C2)c(C)n1 ZINC000423393653 384852581 /nfs/dbraw/zinc/85/25/81/384852581.db2.gz QUMRPISAEKGWJG-UHTWSYAYSA-N 2 0 248.374 2.014 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@@H]([NH3+])C1)C1CCSCC1 ZINC000423392454 384854039 /nfs/dbraw/zinc/85/40/39/384854039.db2.gz QFIITLSECDGRNR-CYZMBNFOSA-N 2 0 242.432 2.378 20 0 BEADRP C(C[NH2+]C[C@@H]1CC[C@H]2C[C@H]2C1)C[NH+]1CCCC1 ZINC000403769133 384857106 /nfs/dbraw/zinc/85/71/06/384857106.db2.gz UASMNIPCDKMKJI-QLFBSQMISA-N 2 0 236.403 2.498 20 0 BEADRP C[NH+](C)CCCC[NH2+]C[C@@H]1CC[C@H]2C[C@H]2C1 ZINC000403777009 384858091 /nfs/dbraw/zinc/85/80/91/384858091.db2.gz WMTAPSBGOWPAGU-HZSPNIEDSA-N 2 0 224.392 2.354 20 0 BEADRP CC[C@H](c1ccccc1)N1CC[C@@H]([NH2+]C)C1 ZINC000225574869 384868646 /nfs/dbraw/zinc/86/86/46/384868646.db2.gz QRRYNSSHMWMHIQ-ZIAGYGMSSA-N 2 0 218.344 2.431 20 0 BEADRP C[NH+](C)CCC[NH2+][C@H]1CCC[C@H]1CCCF ZINC000309957372 384949325 /nfs/dbraw/zinc/94/93/25/384949325.db2.gz JBHNIPNPAOFXJI-STQMWFEESA-N 2 0 230.371 2.446 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]1[NH2+]CCC1CCCCC1 ZINC000259042080 384952636 /nfs/dbraw/zinc/95/26/36/384952636.db2.gz PGXZVSALOJJIMJ-STQMWFEESA-N 2 0 210.365 2.426 20 0 BEADRP CC(C)CCC[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000258994680 384954149 /nfs/dbraw/zinc/95/41/49/384954149.db2.gz MBDHVFBDEJAJCT-CYBMUJFWSA-N 2 0 212.381 2.402 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H]2CCC[C@H]2[NH3+])cc1 ZINC000258953110 384955385 /nfs/dbraw/zinc/95/53/85/384955385.db2.gz KNUBDJATYIKWKN-ZIAGYGMSSA-N 2 0 218.344 2.007 20 0 BEADRP Fc1ccc(C[NH2+]CC[C@@H]2CCC[NH2+]C2)cc1 ZINC000258953678 384955466 /nfs/dbraw/zinc/95/54/66/384955466.db2.gz ISTNKXWYKBFQKN-LBPRGKRZSA-N 2 0 236.334 2.305 20 0 BEADRP Cc1ccc(C)c(C[NH2+]CC[C@H]2CC[NH2+]C2)c1 ZINC000258981101 384955618 /nfs/dbraw/zinc/95/56/18/384955618.db2.gz KYLQFNIJKHYCIM-CQSZACIVSA-N 2 0 232.371 2.393 20 0 BEADRP Cc1ccc(C)c(C[NH2+]CC[C@@H]2CC[NH2+]C2)c1 ZINC000258981099 384956775 /nfs/dbraw/zinc/95/67/75/384956775.db2.gz KYLQFNIJKHYCIM-AWEZNQCLSA-N 2 0 232.371 2.393 20 0 BEADRP COc1ccc(C[N@@H+]2CC[C@H]([NH3+])C[C@@H]2C)cc1 ZINC000049707623 384899484 /nfs/dbraw/zinc/89/94/84/384899484.db2.gz DJYGJKUQAAIGTJ-AAEUAGOBSA-N 2 0 234.343 2.007 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CCC[N@H+](Cc2cccc(F)c2)C1 ZINC000111763713 384902800 /nfs/dbraw/zinc/90/28/00/384902800.db2.gz HUMWVAHQAOEDDW-WCQYABFASA-N 2 0 236.334 2.385 20 0 BEADRP CC[C@H]1CCC[N@H+](C[C@H]2CCC[NH2+]C2)C1 ZINC000251613280 384918335 /nfs/dbraw/zinc/91/83/35/384918335.db2.gz DQMJOFRFMSIZNX-STQMWFEESA-N 2 0 210.365 2.108 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CCC[NH2+]1)c1ccccc1 ZINC000258684944 384931019 /nfs/dbraw/zinc/93/10/19/384931019.db2.gz ISDQRBVDXZVCFI-TZMCWYRMSA-N 2 0 218.344 2.479 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCC[NH2+]1)c1ccccc1 ZINC000258684939 384932326 /nfs/dbraw/zinc/93/23/26/384932326.db2.gz ISDQRBVDXZVCFI-GXTWGEPZSA-N 2 0 218.344 2.479 20 0 BEADRP C[C@H](NC[C@@H]1CCC[N@H+](C)C1)c1ccoc1 ZINC000087290074 384935613 /nfs/dbraw/zinc/93/56/13/384935613.db2.gz GIVRKPQGKQCSNU-RYUDHWBXSA-N 2 0 222.332 2.272 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1ccccc1 ZINC000258632723 384937478 /nfs/dbraw/zinc/93/74/78/384937478.db2.gz DBRYBGPBRLSUSX-QWHCGFSZSA-N 2 0 218.344 2.337 20 0 BEADRP Cc1ccc(CC[NH2+]C2CC[NH2+]CC2)c(C)c1 ZINC000258871429 384947065 /nfs/dbraw/zinc/94/70/65/384947065.db2.gz FZSXZTBPWZBDBC-UHFFFAOYSA-N 2 0 232.371 2.188 20 0 BEADRP F[C@@H]1CC[C@@H]([NH2+]C2CC[NH+](CC3CC3)CC2)C1 ZINC000557446931 384947044 /nfs/dbraw/zinc/94/70/44/384947044.db2.gz VRPQMWLRVWHMOS-TZMCWYRMSA-N 2 0 240.366 2.341 20 0 BEADRP COc1ccc(C[NH2+]C[C@@H](C)C[NH3+])c(Cl)c1 ZINC000258838800 384947519 /nfs/dbraw/zinc/94/75/19/384947519.db2.gz VXUWFUVUSYAJJB-VIFPVBQESA-N 2 0 242.750 2.033 20 0 BEADRP Cc1cncc(C[N@H+]2CCC[C@@H](C)[C@H]2CC[NH3+])c1 ZINC000404315866 384969106 /nfs/dbraw/zinc/96/91/06/384969106.db2.gz ZZDRSZXLILVDGA-UKRRQHHQSA-N 2 0 247.386 2.339 20 0 BEADRP C[C@@H](Cc1ccsc1)[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000087646883 384984132 /nfs/dbraw/zinc/98/41/32/384984132.db2.gz NATMZGHGHRGXAB-AAEUAGOBSA-N 2 0 238.400 2.268 20 0 BEADRP CO[C@H](C)CC[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000310336331 384989389 /nfs/dbraw/zinc/98/93/89/384989389.db2.gz MWHPQWUYCLJHPY-LERXQTSPSA-N 2 0 234.343 2.146 20 0 BEADRP CC(C)C1([NH2+]CC[C@@H]2CCC[N@@H+]2C)CC1 ZINC000339521303 385012943 /nfs/dbraw/zinc/01/29/43/385012943.db2.gz JZKQEWAFRLAUMJ-LBPRGKRZSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+][C@@H]1CCO[C@@H]1C ZINC000226433457 385014162 /nfs/dbraw/zinc/01/41/62/385014162.db2.gz XCCWNUHXDJDGHV-YIYPIFLZSA-N 2 0 240.391 2.064 20 0 BEADRP C[N@H+](CCc1cccs1)CC1CC[NH2+]CC1 ZINC000086440984 385017646 /nfs/dbraw/zinc/01/76/46/385017646.db2.gz YVEDSCYMMQDWJI-UHFFFAOYSA-N 2 0 238.400 2.222 20 0 BEADRP C[C@H](CNc1ccncc1Cl)[NH+](C)C ZINC000086833077 385052551 /nfs/dbraw/zinc/05/25/51/385052551.db2.gz XYCUWMLMSBMSIL-MRVPVSSYSA-N 2 0 213.712 2.097 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+]C1C[C@@H](C)C[C@H](C)C1 ZINC000300023292 385053720 /nfs/dbraw/zinc/05/37/20/385053720.db2.gz DVGSJFCKLVMNAF-AVGNSLFASA-N 2 0 242.407 2.155 20 0 BEADRP CC(C)C1([NH2+][C@H]2C[C@@H](C)N(C3CC3)C2)CC1 ZINC000340477801 385069494 /nfs/dbraw/zinc/06/94/94/385069494.db2.gz IKCDAFYKCOINQS-NEPJUHHUSA-N 2 0 222.376 2.390 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+]C[C@@H]1CCCC[C@H]1C ZINC000300024703 385075914 /nfs/dbraw/zinc/07/59/14/385075914.db2.gz OCNSODWSZBUFNA-RDBSUJKOSA-N 2 0 242.407 2.156 20 0 BEADRP CC1(C)[C@H]([NH3+])C[C@@H]1NCc1ccccc1F ZINC000404806679 385077049 /nfs/dbraw/zinc/07/70/49/385077049.db2.gz ZCMRCCVHDHZRGY-NEPJUHHUSA-N 2 0 222.307 2.041 20 0 BEADRP Cc1ccc(F)cc1C[N@H+]1CC[C@H]([C@@H](C)[NH3+])C1 ZINC000157116092 385078279 /nfs/dbraw/zinc/07/82/79/385078279.db2.gz CZTNHRXIRRGYBT-NEPJUHHUSA-N 2 0 236.334 2.303 20 0 BEADRP CC(C)[C@H]1CC[C@@H]1[NH2+]CCC[NH2+]C1CC1 ZINC000423550995 385024585 /nfs/dbraw/zinc/02/45/85/385024585.db2.gz IZQVWLCTPCVOSM-OLZOCXBDSA-N 2 0 210.365 2.153 20 0 BEADRP COC[C@@H]([NH2+]CC[C@@H]1CCCC[N@@H+]1C)C(C)C ZINC000086700179 385039467 /nfs/dbraw/zinc/03/94/67/385039467.db2.gz IBXWHIZYGKGFTE-UONOGXRCSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+]Cc1ccccc1C(F)(F)F ZINC000310411001 385041485 /nfs/dbraw/zinc/04/14/85/385041485.db2.gz MJIUIDQWENRKAX-VIFPVBQESA-N 2 0 246.276 2.390 20 0 BEADRP COCc1cccc(C[N@@H+]2CC[C@@H]([NH3+])[C@@H](C)C2)c1 ZINC000227056108 385085836 /nfs/dbraw/zinc/08/58/36/385085836.db2.gz ZQNBPLZTTNPUAA-SWLSCSKDSA-N 2 0 248.370 2.002 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+][C@@H]1CC[C@H](C)C[C@H]1C ZINC000300025152 385094456 /nfs/dbraw/zinc/09/44/56/385094456.db2.gz QVSMPQDQXSQHAQ-RFQIPJPRSA-N 2 0 242.407 2.155 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)C1CCC1 ZINC000177943968 385140711 /nfs/dbraw/zinc/14/07/11/385140711.db2.gz FHNBTYNGADTUSR-NWDGAFQWSA-N 2 0 222.376 2.249 20 0 BEADRP Cc1ccoc1C[NH2+][C@@H](C)CCCC[NH3+] ZINC000308821351 385191653 /nfs/dbraw/zinc/19/16/53/385191653.db2.gz GRPDCVSNNQXOFH-NSHDSACASA-N 2 0 210.321 2.195 20 0 BEADRP CC(C)CCC[N@@H+]1CC[C@H]2[NH2+]CC[C@H]2C1 ZINC000308823640 385194278 /nfs/dbraw/zinc/19/42/78/385194278.db2.gz HFEDIZAONRTMOW-QWHCGFSZSA-N 2 0 210.365 2.106 20 0 BEADRP c1ccc2c(c1)CCC[N@@H+](CC1CC[NH2+]CC1)C2 ZINC000062944715 385195884 /nfs/dbraw/zinc/19/58/84/385195884.db2.gz MNUVWPRKOCRSNA-UHFFFAOYSA-N 2 0 244.382 2.434 20 0 BEADRP Cc1c[nH+]ccc1NC[C@@H]1CCC[C@@H]([NH3+])C1 ZINC000227674082 385197654 /nfs/dbraw/zinc/19/76/54/385197654.db2.gz SWSHSLHFTFVLLL-VXGBXAGGSA-N 2 0 219.332 2.319 20 0 BEADRP [NH3+][C@@H]1CCCC[C@H]1[NH2+][C@@H]1CC[C@H]1C1CC1 ZINC000424370896 385150734 /nfs/dbraw/zinc/15/07/34/385150734.db2.gz DXZOTCXVPJKDLM-UMSGYPCISA-N 2 0 208.349 2.035 20 0 BEADRP C1CC12C[C@@H]2[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000424373156 385154652 /nfs/dbraw/zinc/15/46/52/385154652.db2.gz IZVPWJXHJSGRMG-RVMXOQNASA-N 2 0 220.360 2.049 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CC23CC3)[C@@H]2CCC[C@H]21 ZINC000424321270 385163372 /nfs/dbraw/zinc/16/33/72/385163372.db2.gz KCMFLPRVTBXEMI-WUHRBBMRSA-N 2 0 220.360 2.001 20 0 BEADRP C[C@H](c1cccnc1)[NH+]1CCC([C@H](C)[NH3+])CC1 ZINC000110643860 385173478 /nfs/dbraw/zinc/17/34/78/385173478.db2.gz CBINASZVGXFCBM-NWDGAFQWSA-N 2 0 233.359 2.202 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+]CC1CC[NH+](C)CC1 ZINC000449133531 385208574 /nfs/dbraw/zinc/20/85/74/385208574.db2.gz YUCAOPVDXKLQPM-GFCCVEGCSA-N 2 0 236.359 2.142 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H]1CCO[C@@H]1C ZINC000119776489 385212214 /nfs/dbraw/zinc/21/22/14/385212214.db2.gz WPNXLYXNQGIWOR-BFHYXJOUSA-N 2 0 242.407 2.264 20 0 BEADRP CC[C@H]1CC[N@H+](CCC2CC[NH2+]CC2)C1 ZINC000108324289 385232712 /nfs/dbraw/zinc/23/27/12/385232712.db2.gz STPGQGKHNXUXEP-LBPRGKRZSA-N 2 0 210.365 2.108 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H]2CCC[C@H]3C[C@H]32)C1 ZINC000304562939 385238800 /nfs/dbraw/zinc/23/88/00/385238800.db2.gz LOBJZUAVAZXHEG-FQUUOJAGSA-N 2 0 222.376 2.106 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]CC1=CC[N@H+](C)CC1 ZINC000308875319 385242132 /nfs/dbraw/zinc/24/21/32/385242132.db2.gz SCDHGTOLXHYREZ-NSHDSACASA-N 2 0 208.349 2.027 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]Cc1ccccc1F ZINC000308892986 385247328 /nfs/dbraw/zinc/24/73/28/385247328.db2.gz YNEOZPWJASLEJI-JTQLQIEISA-N 2 0 210.296 2.043 20 0 BEADRP C[C@@H](C[NH2+]CC1CCCCC1)C[NH+](C)C ZINC000308953522 385307167 /nfs/dbraw/zinc/30/71/67/385307167.db2.gz YJIDGWCSFHICGR-LBPRGKRZSA-N 2 0 212.381 2.354 20 0 BEADRP C[C@H]([NH2+]CCCC[NH3+])c1ccc(F)cc1F ZINC000037714960 385309276 /nfs/dbraw/zinc/30/92/76/385309276.db2.gz DCEXBPAWNYUVMP-VIFPVBQESA-N 2 0 228.286 2.354 20 0 BEADRP CC(C)(C[N@@H+]1CC[C@@H](C[NH3+])C1)c1ccccc1 ZINC000647490638 385282671 /nfs/dbraw/zinc/28/26/71/385282671.db2.gz FSMZCQTZCMQCDG-ZDUSSCGKSA-N 2 0 232.371 2.245 20 0 BEADRP [NH3+]C[C@@H]1CC[N@H+](Cc2cccc3cnccc32)C1 ZINC000647490891 385282955 /nfs/dbraw/zinc/28/29/55/385282955.db2.gz WZPHRBDLOQOUKY-LBPRGKRZSA-N 2 0 241.338 2.015 20 0 BEADRP C[C@H]1C[C@H](C)[N@H+](CCC2CC[NH2+]CC2)C1 ZINC000157893674 385300533 /nfs/dbraw/zinc/30/05/33/385300533.db2.gz MCRPDVMSLZZPJJ-RYUDHWBXSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]([NH3+])C1CC[NH+](CCCCCF)CC1 ZINC000308931451 385301799 /nfs/dbraw/zinc/30/17/99/385301799.db2.gz NYMFIGKWDCSZPR-LLVKDONJSA-N 2 0 216.344 2.185 20 0 BEADRP C[C@H](CC1CCC1)[NH2+][C@@H]1CCCC[C@H]1[NH3+] ZINC000643973337 385341021 /nfs/dbraw/zinc/34/10/21/385341021.db2.gz BWZAHMLNVLVQGM-RAIGVLPGSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@@H](CC1CCC1)[NH2+][C@@H]1CCCC[C@H]1[NH3+] ZINC000643973336 385341047 /nfs/dbraw/zinc/34/10/47/385341047.db2.gz BWZAHMLNVLVQGM-CYZMBNFOSA-N 2 0 210.365 2.425 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@H]([C@H](C)[NH3+])C2)c(C)c1 ZINC000228149014 385348997 /nfs/dbraw/zinc/34/89/97/385348997.db2.gz LLTNFRPXZNJWMF-ZFWWWQNUSA-N 2 0 232.371 2.473 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH+](C)CCSC)[C@H](C)C1 ZINC000178978704 385355094 /nfs/dbraw/zinc/35/50/94/385355094.db2.gz MGALPTRIMWGCIE-NEPJUHHUSA-N 2 0 230.421 2.012 20 0 BEADRP CCOCCC[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000131914399 385367139 /nfs/dbraw/zinc/36/71/39/385367139.db2.gz PZQVMLMDWRBCJU-UONOGXRCSA-N 2 0 234.343 2.147 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@@H](C)c1cccc(F)c1 ZINC000308972841 385328106 /nfs/dbraw/zinc/32/81/06/385328106.db2.gz HFXJGVYXYOVKKC-UWVGGRQHSA-N 2 0 210.296 2.071 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC2(C)CCC2)CC[N@@H+]1C ZINC000181243979 385404425 /nfs/dbraw/zinc/40/44/25/385404425.db2.gz ACEFXFRSGWKDBZ-VXGBXAGGSA-N 2 0 210.365 2.249 20 0 BEADRP CC(C)N(C)C[C@@H](C)[NH2+]C[C@@H]1CCSC1 ZINC000309075397 385406014 /nfs/dbraw/zinc/40/60/14/385406014.db2.gz JRNMQYZXWATVMF-NEPJUHHUSA-N 2 0 230.421 2.058 20 0 BEADRP C[C@H]1[C@@H]([NH2+]CCC(C)(C)C)CCCN1C ZINC000309090943 385414124 /nfs/dbraw/zinc/41/41/24/385414124.db2.gz BEQRFHPLZDKSIE-RYUDHWBXSA-N 2 0 212.381 2.495 20 0 BEADRP C[C@H]([NH2+]CCC[NH+]1CCCCC1)C1CC1 ZINC000020128784 385418857 /nfs/dbraw/zinc/41/88/57/385418857.db2.gz LFGQMZDRSCYCBO-LBPRGKRZSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCN(C)C2CCCC2)[C@H]1C ZINC000309257500 385501356 /nfs/dbraw/zinc/50/13/56/385501356.db2.gz ARKMMSNHEBZPSY-MBNYWOFBSA-N 2 0 224.392 2.495 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@H]2C[C@@H](C)[C@H]2C)CC1 ZINC000309279134 385508335 /nfs/dbraw/zinc/50/83/35/385508335.db2.gz FFXSFYMFCPPWDM-BZPMIXESSA-N 2 0 224.392 2.493 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]Cc1ccc(F)cc1 ZINC000309325274 385530364 /nfs/dbraw/zinc/53/03/64/385530364.db2.gz HUJGYUOEWCPNSC-NSHDSACASA-N 2 0 224.323 2.433 20 0 BEADRP COC(C)(C)[C@H](C)[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000302510658 385535518 /nfs/dbraw/zinc/53/55/18/385535518.db2.gz VFCWYCMLPMKXAR-LBPRGKRZSA-N 2 0 242.407 2.121 20 0 BEADRP CC[C@H](C)[C@@H](C)[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000319020017 385540211 /nfs/dbraw/zinc/54/02/11/385540211.db2.gz QSQKDZZZCNABLS-TUAOUCFPSA-N 2 0 210.365 2.153 20 0 BEADRP C(C[C@H]1CCC[NH2+]C1)[NH2+]C1CCCCC1 ZINC000054309143 385564218 /nfs/dbraw/zinc/56/42/18/385564218.db2.gz YYMLRPFOOZKDAN-GFCCVEGCSA-N 2 0 210.365 2.298 20 0 BEADRP c1csc(C[NH2+]CC[C@@H]2CCC[NH2+]C2)c1 ZINC000054309140 385564257 /nfs/dbraw/zinc/56/42/57/385564257.db2.gz ATTOEZWCOMFAED-NSHDSACASA-N 2 0 224.373 2.227 20 0 BEADRP CC(C)C[C@@H](C)C[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000414848217 385606280 /nfs/dbraw/zinc/60/62/80/385606280.db2.gz KLZHCXZWKKZWFU-CHWSQXEVSA-N 2 0 212.381 2.258 20 0 BEADRP Cc1[nH+]ccc(NCC[N@@H+](C)C(C)C)c1Cl ZINC000336650088 385602992 /nfs/dbraw/zinc/60/29/92/385602992.db2.gz HJIGGIXOSUPUQN-UHFFFAOYSA-N 2 0 241.766 2.217 20 0 BEADRP C[C@H]([NH2+]CCC[NH+]1CCCC1)[C@@H]1CC1(C)C ZINC000309444125 385584187 /nfs/dbraw/zinc/58/41/87/385584187.db2.gz KXKPWEVJLZHUNY-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP Cc1cscc1C[NH2+][C@@H](C)CCC[NH3+] ZINC000336679297 385621178 /nfs/dbraw/zinc/62/11/78/385621178.db2.gz FWNJYXNFGCNMLY-JTQLQIEISA-N 2 0 212.362 2.274 20 0 BEADRP Cc1ccc(C[NH2+][C@H](C)CCC[NH3+])s1 ZINC000336682910 385645496 /nfs/dbraw/zinc/64/54/96/385645496.db2.gz ITLFYUCAXNGTNQ-SECBINFHSA-N 2 0 212.362 2.274 20 0 BEADRP CCC[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000020523813 385673082 /nfs/dbraw/zinc/67/30/82/385673082.db2.gz CPXDLEUJNIEIRU-WODVXLOZSA-N 2 0 210.365 2.390 20 0 BEADRP Cc1csc(C[NH2+][C@@H](C)CCCC[NH3+])n1 ZINC000336688291 385708256 /nfs/dbraw/zinc/70/82/56/385708256.db2.gz LNAIYBDPCVISSA-VIFPVBQESA-N 2 0 227.377 2.059 20 0 BEADRP Cc1csc(C[NH2+][C@H](C)CCCC[NH3+])n1 ZINC000336688289 385709135 /nfs/dbraw/zinc/70/91/35/385709135.db2.gz LNAIYBDPCVISSA-SECBINFHSA-N 2 0 227.377 2.059 20 0 BEADRP CC(C)C[C@H](C)C[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000414856186 385710056 /nfs/dbraw/zinc/71/00/56/385710056.db2.gz OASNXIBQYITESJ-QWHCGFSZSA-N 2 0 212.381 2.258 20 0 BEADRP C[NH2+]CCC[NH2+][C@H]1CCC(C)(C)C[C@@H]1C ZINC000414857550 385730881 /nfs/dbraw/zinc/73/08/81/385730881.db2.gz DWJOJOXAGRYJEV-RYUDHWBXSA-N 2 0 212.381 2.400 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H](C)Cc1ccccc1C ZINC000414858243 385734584 /nfs/dbraw/zinc/73/45/84/385734584.db2.gz IIPNKXKDILHYLT-ZDUSSCGKSA-N 2 0 220.360 2.125 20 0 BEADRP C[C@@H]1C[C@H]1C[N@@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000488291046 385734673 /nfs/dbraw/zinc/73/46/73/385734673.db2.gz GVRPXNXETTZCDX-RDBSUJKOSA-N 2 0 222.376 2.060 20 0 BEADRP Cc1ccccc1C[NH2+][C@@H](C)[C@H]1CCC[NH2+]C1 ZINC000414859948 385738759 /nfs/dbraw/zinc/73/87/59/385738759.db2.gz UZYSJNSGBHXAHJ-ZFWWWQNUSA-N 2 0 232.371 2.473 20 0 BEADRP Cc1ccccc1C[NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1 ZINC000414859943 385738830 /nfs/dbraw/zinc/73/88/30/385738830.db2.gz UZYSJNSGBHXAHJ-DZGCQCFKSA-N 2 0 232.371 2.473 20 0 BEADRP CC(C)CSCC[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000309608942 385739827 /nfs/dbraw/zinc/73/98/27/385739827.db2.gz MBKQQQBOXFRGLF-STQMWFEESA-N 2 0 244.448 2.448 20 0 BEADRP CC(C)(C)[NH2+]CCNCC1([NH3+])CCCCCC1 ZINC000414860933 385743630 /nfs/dbraw/zinc/74/36/30/385743630.db2.gz QUZXFRIDBOTLAE-UHFFFAOYSA-N 2 0 241.423 2.016 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H]1CSC[C@H]1C ZINC000336698545 385753162 /nfs/dbraw/zinc/75/31/62/385753162.db2.gz ONXMONXTOICKEB-VXGBXAGGSA-N 2 0 230.421 2.059 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H]1CSC[C@@H]1C ZINC000336698542 385753175 /nfs/dbraw/zinc/75/31/75/385753175.db2.gz ONXMONXTOICKEB-NWDGAFQWSA-N 2 0 230.421 2.059 20 0 BEADRP C([NH2+][C@H]1CCC[C@@H]1C1CC1)[C@@H]1CCC[NH2+]C1 ZINC000414863895 385761181 /nfs/dbraw/zinc/76/11/81/385761181.db2.gz YKTLSCUCRXOUMG-BNOWGMLFSA-N 2 0 222.376 2.154 20 0 BEADRP CC[NH2+]Cc1cccc(N[C@H]2CCC[NH2+]CC2)c1 ZINC000414863241 385761232 /nfs/dbraw/zinc/76/12/32/385761232.db2.gz IJRBQQPZXHQNBX-AWEZNQCLSA-N 2 0 247.386 2.350 20 0 BEADRP CC(C)[C@H](CN[C@@H]1CC[NH2+]C1)c1ccccc1 ZINC000414866525 385779758 /nfs/dbraw/zinc/77/97/58/385779758.db2.gz FITSDYZSLWXBIL-CABCVRRESA-N 2 0 232.371 2.378 20 0 BEADRP C[C@H](C[NH2+]Cc1cccc2cc[nH]c21)C[NH+](C)C ZINC000291804023 385722985 /nfs/dbraw/zinc/72/29/85/385722985.db2.gz XMWVLGMCRRZBBC-GFCCVEGCSA-N 2 0 245.370 2.455 20 0 BEADRP C[NH2+]CCC[NH2+][C@H](C)CCc1ccsc1 ZINC000414857301 385727100 /nfs/dbraw/zinc/72/71/00/385727100.db2.gz CNZNZNYHHMPWEF-LLVKDONJSA-N 2 0 226.389 2.268 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@H]1C[C@@H](C)[C@H]1C ZINC000336711669 385800347 /nfs/dbraw/zinc/80/03/47/385800347.db2.gz UNVDTPIAWDIJFD-UPJWGTAASA-N 2 0 212.381 2.351 20 0 BEADRP Cc1ccc(CCC[NH2+][C@@H]2CC[NH2+][C@H](C)C2)cn1 ZINC000414945428 385800491 /nfs/dbraw/zinc/80/04/91/385800491.db2.gz IHBOQVZPJSJIBO-UKRRQHHQSA-N 2 0 247.386 2.053 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+]C[C@H]1C[C@@H]1c1ccccc1 ZINC000647800412 385806591 /nfs/dbraw/zinc/80/65/91/385806591.db2.gz AVTYFZJRPLYGSL-APIJFGDWSA-N 2 0 230.355 2.260 20 0 BEADRP CC1([NH2+]C/C=C/c2ccccc2)CC[NH2+]CC1 ZINC000414948146 385807415 /nfs/dbraw/zinc/80/74/15/385807415.db2.gz XTRSFXYFBDNDQO-VMPITWQZSA-N 2 0 230.355 2.432 20 0 BEADRP C[C@@H](C[NH2+][C@@H](C)[C@H]1CCCC[NH2+]1)CC(F)F ZINC000647800562 385807810 /nfs/dbraw/zinc/80/78/10/385807810.db2.gz FGYWEMBRTHSLFL-OUAUKWLOSA-N 2 0 234.334 2.398 20 0 BEADRP C[C@H](CCC1CC1)[NH2+][C@@H]1CC[NH2+][C@H](C)C1 ZINC000414948672 385809286 /nfs/dbraw/zinc/80/92/86/385809286.db2.gz MNMLGEDEPBQZFQ-NQBHXWOUSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@@H](C[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)CC(F)F ZINC000647801606 385813616 /nfs/dbraw/zinc/81/36/16/385813616.db2.gz YYOWLLOBWGLOGV-NFLHVTIKSA-N 2 0 232.318 2.150 20 0 BEADRP Cc1ccncc1[C@@H](C)[NH2+]C[C@@H]1CCCN1C ZINC000271377288 385822313 /nfs/dbraw/zinc/82/23/13/385822313.db2.gz HVIOHNWNLKUTKR-OLZOCXBDSA-N 2 0 233.359 2.135 20 0 BEADRP COCc1cccc(C[NH2+][C@@H]2CC[NH2+][C@H](C)C2)c1 ZINC000414952440 385825331 /nfs/dbraw/zinc/82/53/31/385825331.db2.gz QSTCZMYEAMXXEM-IUODEOHRSA-N 2 0 248.370 2.063 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+]C[C@@H](C)CC(C)C ZINC000414953235 385831240 /nfs/dbraw/zinc/83/12/40/385831240.db2.gz JJNFWJDZKYGGKG-NWDGAFQWSA-N 2 0 200.370 2.256 20 0 BEADRP CC(C)[C@@H]1CCC[N@@H+]1CCC1CC[NH2+]CC1 ZINC000084126315 385858129 /nfs/dbraw/zinc/85/81/29/385858129.db2.gz SWBQQTGRENNTLU-AWEZNQCLSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]Cc1cnc(C(C)(C)C)s1 ZINC000414869634 385838445 /nfs/dbraw/zinc/83/84/45/385838445.db2.gz BADVFAYBBBAYJQ-SECBINFHSA-N 2 0 241.404 2.125 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CC1CCC(F)CC1 ZINC000647804257 385840561 /nfs/dbraw/zinc/84/05/61/385840561.db2.gz MWCVXOWILPGAQL-JYBOHDQNSA-N 2 0 216.344 2.230 20 0 BEADRP CC[NH2+][C@H](C)CNCc1cc(F)cc(F)c1 ZINC000414956433 385846229 /nfs/dbraw/zinc/84/62/29/385846229.db2.gz NHIGPLMEBLDECE-SECBINFHSA-N 2 0 228.286 2.052 20 0 BEADRP CC[C@@H](Cc1ccccc1)[NH2+]C[C@H](C)C[NH3+] ZINC000414870692 385849157 /nfs/dbraw/zinc/84/91/57/385849157.db2.gz CDUSHZDIAVOZLV-OCCSQVGLSA-N 2 0 220.360 2.192 20 0 BEADRP C[C@@H](C[NH2+]C/C=C\c1ccccc1)C[NH+](C)C ZINC000336719685 385852243 /nfs/dbraw/zinc/85/22/43/385852243.db2.gz RRHKEBGDNZIGKA-YHAOYDPOSA-N 2 0 232.371 2.487 20 0 BEADRP CCN(C)CC[NH2+][C@H]1CS[C@H](C(C)(C)C)C1 ZINC000309678845 385791413 /nfs/dbraw/zinc/79/14/13/385791413.db2.gz YXLNXNOXBDVVFF-NEPJUHHUSA-N 2 0 244.448 2.448 20 0 BEADRP CC(C)C1([NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)CC1 ZINC000647797905 385792531 /nfs/dbraw/zinc/79/25/31/385792531.db2.gz GUPGWCKHNOLXIU-YNEHKIRRSA-N 2 0 222.376 2.153 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@@H]2CCC23CCC3)CC1 ZINC000309679338 385792892 /nfs/dbraw/zinc/79/28/92/385792892.db2.gz YZGBDNZYDXCHPX-CYBMUJFWSA-N 2 0 222.376 2.251 20 0 BEADRP CCOc1ccc(C[NH2+][C@H]2CC[NH2+][C@H](C)C2)cc1 ZINC000414945792 385793632 /nfs/dbraw/zinc/79/36/32/385793632.db2.gz IWKVQKWDNFKORQ-OCCSQVGLSA-N 2 0 248.370 2.315 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]C/C=C/c1ccc(F)cc1 ZINC000414874695 385886702 /nfs/dbraw/zinc/88/67/02/385886702.db2.gz IUSVSTPNYRQPGU-KXMPLOMGSA-N 2 0 222.307 2.023 20 0 BEADRP C[C@H]([NH3+])c1ccc(NC(=O)CCC(C)(C)[NH3+])cc1 ZINC000647840231 385886948 /nfs/dbraw/zinc/88/69/48/385886948.db2.gz WIPMSPBTKNYFAN-JTQLQIEISA-N 2 0 249.358 2.162 20 0 BEADRP CC(C)CCC[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000122132903 385888137 /nfs/dbraw/zinc/88/81/37/385888137.db2.gz GSDHUHDQDJRVIO-STQMWFEESA-N 2 0 212.381 2.495 20 0 BEADRP CC(C)CCC[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000122132513 385889257 /nfs/dbraw/zinc/88/92/57/385889257.db2.gz GSDHUHDQDJRVIO-QWHCGFSZSA-N 2 0 212.381 2.495 20 0 BEADRP CCCC[N@@H+]1CC[C@@]2(C1)CCC[NH+](C)C2 ZINC000335038401 385928752 /nfs/dbraw/zinc/92/87/52/385928752.db2.gz QALSWPDQFPIQHP-ZDUSSCGKSA-N 2 0 210.365 2.204 20 0 BEADRP CCC[NH2+]CC[NH2+][C@@H]1CC[C@@H](C)[C@@H](C)C1 ZINC000414874958 385891690 /nfs/dbraw/zinc/89/16/90/385891690.db2.gz TZSBUKVGZJMXCY-FRRDWIJNSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+]Cc1ccc(Cl)cc1F ZINC000414876177 385905239 /nfs/dbraw/zinc/90/52/39/385905239.db2.gz KWMQYIBNVKEVLG-QMMMGPOBSA-N 2 0 230.714 2.164 20 0 BEADRP CC1(C[NH2+][C@H]2CCCCC[C@@H]2[NH3+])CCOCC1 ZINC000335038136 385929332 /nfs/dbraw/zinc/92/93/32/385929332.db2.gz HCAZAQJUWDEHRI-STQMWFEESA-N 2 0 240.391 2.053 20 0 BEADRP CCC[NH2+]CC[NH2+][C@H]1CCC[C@H]1C(C)C ZINC000414876387 385906441 /nfs/dbraw/zinc/90/64/41/385906441.db2.gz VTHFQUSULYUELM-STQMWFEESA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H](C[NH2+]CC1([NH3+])CCC1)c1ccccc1 ZINC000414876522 385908685 /nfs/dbraw/zinc/90/86/85/385908685.db2.gz LKRQUNISQKGIDS-GFCCVEGCSA-N 2 0 218.344 2.261 20 0 BEADRP Cc1ccc(CN2CC[C@@H]3CC[N@@H+](C)C[C@H]32)o1 ZINC000272544113 385910593 /nfs/dbraw/zinc/91/05/93/385910593.db2.gz CGCXPEIMNBVDPR-GXTWGEPZSA-N 2 0 234.343 2.114 20 0 BEADRP CC(C)=CCC[NH2+][C@H](C)[C@H]1CCCC[NH2+]1 ZINC000397769936 385913509 /nfs/dbraw/zinc/91/35/09/385913509.db2.gz UPRNRMIJVLQEFL-CHWSQXEVSA-N 2 0 210.365 2.463 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@H]2CCc3ccccc3C2)C1 ZINC000250844219 385926513 /nfs/dbraw/zinc/92/65/13/385926513.db2.gz HLXQWGPADKOEAF-OAGGEKHMSA-N 2 0 244.382 2.403 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+]Cc1cc2cc(F)ccc2o1 ZINC000414878140 385926853 /nfs/dbraw/zinc/92/68/53/385926853.db2.gz NTQBBTSPCJDBGQ-VIFPVBQESA-N 2 0 236.290 2.256 20 0 BEADRP C[N@H+](CCCn1ccnc1)Cc1ccsc1 ZINC000272070024 385873009 /nfs/dbraw/zinc/87/30/09/385873009.db2.gz FCPWKUMVSBXAPQ-UHFFFAOYSA-N 2 0 235.356 2.467 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]C[C@H](C)Cc1ccccc1 ZINC000414873519 385876883 /nfs/dbraw/zinc/87/68/83/385876883.db2.gz HKPQPRSXGJNWQC-CHWSQXEVSA-N 2 0 220.360 2.050 20 0 BEADRP COC[C@@H](CC(C)C)[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000414961087 385882281 /nfs/dbraw/zinc/88/22/81/385882281.db2.gz IHNFNNIUBIPRGO-ZIAGYGMSSA-N 2 0 242.407 2.169 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]CC1CCSCC1 ZINC000335019229 385977342 /nfs/dbraw/zinc/97/73/42/385977342.db2.gz LVQPYSWGVYQJFJ-DGCLKSJQSA-N 2 0 242.432 2.107 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+]CC1CCSCC1 ZINC000335019228 385977421 /nfs/dbraw/zinc/97/74/21/385977421.db2.gz LVQPYSWGVYQJFJ-AAEUAGOBSA-N 2 0 242.432 2.107 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]CC1CCSCC1 ZINC000335019262 385978500 /nfs/dbraw/zinc/97/85/00/385978500.db2.gz NAPONXLLUPLIIR-CHWSQXEVSA-N 2 0 242.432 2.379 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+]C1CCCCC1 ZINC000335023349 385985729 /nfs/dbraw/zinc/98/57/29/385985729.db2.gz GTFDJBWASBJQJE-AAEUAGOBSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H]1CCCC[C@H]1C1CC1 ZINC000414881050 385989648 /nfs/dbraw/zinc/98/96/48/385989648.db2.gz RWDUEMARWQFVED-KGYLQXTDSA-N 2 0 210.365 2.140 20 0 BEADRP C[C@H](C[NH2+]C[C@@H]([NH3+])C1CC1)Cc1ccccc1 ZINC000414881365 385992145 /nfs/dbraw/zinc/99/21/45/385992145.db2.gz AHNVKGFZHBMUBF-SWLSCSKDSA-N 2 0 232.371 2.192 20 0 BEADRP Cc1ccc(CC[NH2+]CC2([NH3+])CCC2)cc1 ZINC000342121631 385933237 /nfs/dbraw/zinc/93/32/37/385933237.db2.gz IOSGFQBFFILMKB-UHFFFAOYSA-N 2 0 218.344 2.009 20 0 BEADRP CC1(C[NH2+][C@H]2CCC[C@@H]2[NH3+])Cc2ccccc2C1 ZINC000335044214 385938764 /nfs/dbraw/zinc/93/87/64/385938764.db2.gz XSERYUWLPRWJBH-GJZGRUSLSA-N 2 0 244.382 2.261 20 0 BEADRP CC1(C[NH2+][C@@H]2CCC[C@@H]2[NH3+])Cc2ccccc2C1 ZINC000335044219 385939526 /nfs/dbraw/zinc/93/95/26/385939526.db2.gz XSERYUWLPRWJBH-LSDHHAIUSA-N 2 0 244.382 2.261 20 0 BEADRP C[C@@H](CC[NH3+])[NH2+]Cc1cnc(C2CCC2)s1 ZINC000414879170 385941063 /nfs/dbraw/zinc/94/10/63/385941063.db2.gz IDDQBGZNRRCHHK-VIFPVBQESA-N 2 0 239.388 2.238 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](C)[C@H]2C[C@@H]2C)C1 ZINC000414066980 385943124 /nfs/dbraw/zinc/94/31/24/385943124.db2.gz IMGYRMKSBHITDD-DGAVXFQQSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1CCC[C@@H](C)C1[NH2+]CC1([NH3+])CCC1 ZINC000335051105 385949946 /nfs/dbraw/zinc/94/99/46/385949946.db2.gz BZRFJLBQFTXIJU-GHMZBOCLSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]C[C@H]1CCCCS1 ZINC000251283022 385960930 /nfs/dbraw/zinc/96/09/30/385960930.db2.gz MXKZNYGZJMQMJP-YNEHKIRRSA-N 2 0 242.432 2.379 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H](C)CCc1cccc(F)c1 ZINC000414880440 385970131 /nfs/dbraw/zinc/97/01/31/385970131.db2.gz QRDSVZDVXNIXHA-VXGBXAGGSA-N 2 0 238.350 2.331 20 0 BEADRP CC(C)C1CC([NH2+][C@H]2CCC[C@@H]([NH3+])C2)C1 ZINC000335015540 385971275 /nfs/dbraw/zinc/97/12/75/385971275.db2.gz ZDMBAUQENDMVDX-QBHFIFKDSA-N 2 0 210.365 2.281 20 0 BEADRP CCC[C@@H](C)C[NH2+][C@H]1CC[NH2+]CC1(C)C ZINC000414973970 385998562 /nfs/dbraw/zinc/99/85/62/385998562.db2.gz NGSLSTYQESIHKN-NEPJUHHUSA-N 2 0 212.381 2.400 20 0 BEADRP COC(C)(C)[C@H](C)[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC000414169827 386016856 /nfs/dbraw/zinc/01/68/56/386016856.db2.gz BODLPBZMNOWFFD-STQMWFEESA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)c1cccnc1 ZINC000414185504 386024790 /nfs/dbraw/zinc/02/47/90/386024790.db2.gz OTDAYPUSAYMWGX-KBPBESRZSA-N 2 0 247.386 2.464 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]CC2=CC[NH2+]CC2)C1 ZINC000335061873 386029996 /nfs/dbraw/zinc/02/99/96/386029996.db2.gz YSUODMGFCMOKGM-YPMHNXCESA-N 2 0 208.349 2.074 20 0 BEADRP Cc1nc2ccc(C[NH2+]C[C@@H](C)C[NH3+])cc2s1 ZINC000414883980 386032620 /nfs/dbraw/zinc/03/26/20/386032620.db2.gz VJYDIORANGMZCF-VIFPVBQESA-N 2 0 249.383 2.289 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)C1(C)CC1 ZINC000414202931 386039704 /nfs/dbraw/zinc/03/97/04/386039704.db2.gz ZONDGVKEAGMPBV-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H](C[NH2+]C/C=C/c1ccccc1)C[NH+](C)C ZINC000291762388 386040481 /nfs/dbraw/zinc/04/04/81/386040481.db2.gz RRHKEBGDNZIGKA-DNGMOHDESA-N 2 0 232.371 2.487 20 0 BEADRP C[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)[C@H]1C[C@H]1C ZINC000414159813 386046374 /nfs/dbraw/zinc/04/63/74/386046374.db2.gz YTEIEWYEWOYAJE-JMSVASOKSA-N 2 0 236.403 2.495 20 0 BEADRP C[NH2+]Cc1ccc(NC[C@@H]2CC[NH2+][C@H](C)C2)cc1 ZINC000414979044 386048728 /nfs/dbraw/zinc/04/87/28/386048728.db2.gz TUZNTUAVZIQGJD-TZMCWYRMSA-N 2 0 247.386 2.206 20 0 BEADRP CCc1cccc(C[N@@H+]2CC[C@H]([NH3+])[C@H](C)C2)c1 ZINC000334997508 386053203 /nfs/dbraw/zinc/05/32/03/386053203.db2.gz DHWYBVVNHABFIP-DOMZBBRYSA-N 2 0 232.371 2.418 20 0 BEADRP CC[C@H]([NH3+])C[NH2+]C1CCC2(CCOCC2)CC1 ZINC000414986152 386101964 /nfs/dbraw/zinc/10/19/64/386101964.db2.gz XKHIHKWDSVWOFT-LBPRGKRZSA-N 2 0 240.391 2.053 20 0 BEADRP C[C@H](CC[NH3+])[NH2+]Cc1ccc(C2CC2)cc1 ZINC000414889189 386111662 /nfs/dbraw/zinc/11/16/62/386111662.db2.gz GAHRPVHLBNCDJA-LLVKDONJSA-N 2 0 218.344 2.391 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@H](C)CCc1ccccc1F ZINC000414981887 386062177 /nfs/dbraw/zinc/06/21/77/386062177.db2.gz CKDGMYSKLQFRNZ-DGCLKSJQSA-N 2 0 238.350 2.474 20 0 BEADRP CCC[NH+]1CCC([NH2+]C[C@H](C)CCOC)CC1 ZINC000414212548 386067492 /nfs/dbraw/zinc/06/74/92/386067492.db2.gz WUIUCYHPJAVWFE-CYBMUJFWSA-N 2 0 242.407 2.123 20 0 BEADRP Cc1ccccc1C[C@H](C)[NH2+]C[C@H]([NH3+])C1CC1 ZINC000414885829 386069627 /nfs/dbraw/zinc/06/96/27/386069627.db2.gz GTHYTZFCPBHHJO-WFASDCNBSA-N 2 0 232.371 2.253 20 0 BEADRP Cc1ccccc1C[C@@H](C)[NH2+]C[C@@H]([NH3+])C1CC1 ZINC000414885823 386069899 /nfs/dbraw/zinc/06/98/99/386069899.db2.gz GTHYTZFCPBHHJO-IUODEOHRSA-N 2 0 232.371 2.253 20 0 BEADRP C[C@H]1C[N@H+](C[C@@H]2C[C@H]2c2ccccc2)CC[C@@H]1[NH3+] ZINC000414653886 386072790 /nfs/dbraw/zinc/07/27/90/386072790.db2.gz FIAUZWUGQSRHIK-TUUVXOQKSA-N 2 0 244.382 2.459 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+][C@H]1CC1(C)C ZINC000414227778 386077699 /nfs/dbraw/zinc/07/76/99/386077699.db2.gz XOLBYBXNFITZAE-RHYQMDGZSA-N 2 0 210.365 2.103 20 0 BEADRP C[NH2+][C@H]1CCN(C[C@@H]2C[C@H]2c2ccccc2)C1 ZINC000414655760 386081814 /nfs/dbraw/zinc/08/18/14/386081814.db2.gz LXXZZYWRVORVAT-KKUMJFAQSA-N 2 0 230.355 2.084 20 0 BEADRP C[C@@H](C[NH2+][C@@H]1CCC12CCC2)N(C)C1CC1 ZINC000336728775 386082135 /nfs/dbraw/zinc/08/21/35/386082135.db2.gz CRGKMCVQRDCNEL-WCQYABFASA-N 2 0 222.376 2.391 20 0 BEADRP C[C@H](C[NH2+]C[C@H]([NH3+])C1CC1)c1ccc(F)cc1 ZINC000414888494 386098486 /nfs/dbraw/zinc/09/84/86/386098486.db2.gz JWVJCZSSWLFINI-YGRLFVJLSA-N 2 0 236.334 2.256 20 0 BEADRP COC(C)(C)[C@H](C)[NH2+][C@H]1CCC[C@H]([NH+](C)C)C1 ZINC000340260978 386147181 /nfs/dbraw/zinc/14/71/81/386147181.db2.gz UDZNQAUVUAVVIO-AVGNSLFASA-N 2 0 242.407 2.262 20 0 BEADRP COC(C)(C)[C@H](C)[NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1 ZINC000340260985 386148333 /nfs/dbraw/zinc/14/83/33/386148333.db2.gz UDZNQAUVUAVVIO-XQQFMLRXSA-N 2 0 242.407 2.262 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H]1CCc2ccccc2C1 ZINC000336729901 386148371 /nfs/dbraw/zinc/14/83/71/386148371.db2.gz XQVKHHQGWNCUQC-DOMZBBRYSA-N 2 0 232.371 2.261 20 0 BEADRP C[C@@H](CCc1ccsc1)[NH2+]C[C@H]([NH3+])C1CC1 ZINC000414891861 386148479 /nfs/dbraw/zinc/14/84/79/386148479.db2.gz OTDSKJMVJCQRJE-GWCFXTLKSA-N 2 0 238.400 2.396 20 0 BEADRP CC(C)C[C@H](C)C[C@H](C)[NH2+][C@H]1CC[NH2+]C1 ZINC000414892767 386151811 /nfs/dbraw/zinc/15/18/11/386151811.db2.gz YIYUXJRZJZTJPX-AVGNSLFASA-N 2 0 212.381 2.399 20 0 BEADRP C[C@H](CCc1ccccc1)C[NH2+][C@@H]1CC[NH2+]C1 ZINC000414893253 386154327 /nfs/dbraw/zinc/15/43/27/386154327.db2.gz YYHYHOCMTMXVOI-UKRRQHHQSA-N 2 0 232.371 2.207 20 0 BEADRP Cc1cc(N2CCC(C[NH+](C)C)CC2)cc[nH+]1 ZINC000335296763 386159546 /nfs/dbraw/zinc/15/95/46/386159546.db2.gz PPAHCBOWXLOQLO-UHFFFAOYSA-N 2 0 233.359 2.168 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@@H](C)CCC(F)(F)F ZINC000414993663 386161649 /nfs/dbraw/zinc/16/16/49/386161649.db2.gz TUZMCAKIYZMASU-YUMQZZPRSA-N 2 0 212.259 2.044 20 0 BEADRP [NH3+][C@H](C[NH2+][C@@H]1CCC[C@H](C2CC2)C1)C1CC1 ZINC000414894269 386171111 /nfs/dbraw/zinc/17/11/11/386171111.db2.gz SQKBGUBKUWLBFS-BFHYXJOUSA-N 2 0 222.376 2.282 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+]C1CCC(C(F)(F)F)CC1 ZINC000414995832 386178987 /nfs/dbraw/zinc/17/89/87/386178987.db2.gz WTKKXRSLHHPBRC-HWOCKDDLSA-N 2 0 238.297 2.434 20 0 BEADRP [NH3+]CCC[NH+]1CCC(OC2CCCCC2)CC1 ZINC000414688049 386179875 /nfs/dbraw/zinc/17/98/75/386179875.db2.gz CTMOZOUKZAFQKV-UHFFFAOYSA-N 2 0 240.391 2.149 20 0 BEADRP C[C@@H]([NH2+]C[C@H]([NH3+])C1CC1)C1CCCCC1 ZINC000414895220 386182978 /nfs/dbraw/zinc/18/29/78/386182978.db2.gz WBTUVBQPWKZLTL-MFKMUULPSA-N 2 0 210.365 2.282 20 0 BEADRP CC[N@H+](CCc1cccs1)C[C@H]1CC[NH2+]C1 ZINC000647879835 386184801 /nfs/dbraw/zinc/18/48/01/386184801.db2.gz IGAFNZOUDUBCQB-LBPRGKRZSA-N 2 0 238.400 2.222 20 0 BEADRP C[C@@H]1CCC[C@@H](C[NH2+]C[C@@H]([NH3+])C2CC2)C1 ZINC000414895809 386187019 /nfs/dbraw/zinc/18/70/19/386187019.db2.gz ZVBUYRBNUGGTOK-NQBHXWOUSA-N 2 0 210.365 2.140 20 0 BEADRP Cc1ccccc1C[C@H]1CCC[N@@H+]1CCC[NH3+] ZINC000414691619 386187114 /nfs/dbraw/zinc/18/71/14/386187114.db2.gz JXPDYPDNUAMDJT-OAHLLOKOSA-N 2 0 232.371 2.351 20 0 BEADRP CC[C@@H]1CCC[C@@H]([NH2+]C[C@H]([NH3+])C2CC2)C1 ZINC000414895066 386187658 /nfs/dbraw/zinc/18/76/58/386187658.db2.gz VPDZFLTUQXDDOK-RTXFEEFZSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1CCC[C@H](C[NH2+]C[C@@H]([NH3+])C2CC2)C1 ZINC000414895810 386188831 /nfs/dbraw/zinc/18/88/31/386188831.db2.gz ZVBUYRBNUGGTOK-NTZNESFSSA-N 2 0 210.365 2.140 20 0 BEADRP CO[C@H](C)C[N@H+](C[C@@H]1CC[NH2+][C@@H](C)C1)C(C)C ZINC000414691357 386189239 /nfs/dbraw/zinc/18/92/39/386189239.db2.gz BJWMLFVSFYSUIV-BFHYXJOUSA-N 2 0 242.407 2.120 20 0 BEADRP Cc1cccc(NC2CC[NH+](CCC[NH3+])CC2)c1 ZINC000414703745 386208170 /nfs/dbraw/zinc/20/81/70/386208170.db2.gz MSUALGRFKKDWIN-UHFFFAOYSA-N 2 0 247.386 2.220 20 0 BEADRP Cc1cccc(C[NH2+]CC2(C)CC[NH2+]CC2)c1 ZINC000414896902 386209021 /nfs/dbraw/zinc/20/90/21/386209021.db2.gz ARKNAROWGCGLNT-UHFFFAOYSA-N 2 0 232.371 2.474 20 0 BEADRP C[C@H]1C[C@@H](c2ccccc2)C[N@@H+]1CCC[NH3+] ZINC000414702791 386210594 /nfs/dbraw/zinc/21/05/94/386210594.db2.gz LXCUNFJNPDJMBZ-GXTWGEPZSA-N 2 0 218.344 2.213 20 0 BEADRP COc1ccccc1/C=C/C[NH2+]CCCC[NH3+] ZINC000414897761 386212365 /nfs/dbraw/zinc/21/23/65/386212365.db2.gz CMCBZLMWJNLZQF-SOFGYWHQSA-N 2 0 234.343 2.037 20 0 BEADRP C[C@@H](CC[NH3+])[NH2+]Cc1ccc(OCC2CC2)cc1 ZINC000414897564 386212850 /nfs/dbraw/zinc/21/28/50/386212850.db2.gz RPCXVVRORTZNKX-LBPRGKRZSA-N 2 0 248.370 2.302 20 0 BEADRP CC[N@H+](C[C@H]1CC[NH2+][C@@H](C)C1)C1CCC1 ZINC000414704295 386213114 /nfs/dbraw/zinc/21/31/14/386213114.db2.gz MVBZBSBYDOSZIV-RYUDHWBXSA-N 2 0 210.365 2.249 20 0 BEADRP [NH3+]CCC[N@@H+](Cc1ccc(F)cc1)CC1CC1 ZINC000414707055 386216459 /nfs/dbraw/zinc/21/64/59/386216459.db2.gz OZXQYTOOUICRNE-UHFFFAOYSA-N 2 0 236.334 2.387 20 0 BEADRP C[C@@H]1C[C@H](c2ccc(F)cc2)C[N@@H+]1CCC[NH3+] ZINC000414707118 386217412 /nfs/dbraw/zinc/21/74/12/386217412.db2.gz PBKJOHPPOVUFOY-YPMHNXCESA-N 2 0 236.334 2.352 20 0 BEADRP CCOc1cccc(C[NH2+]C[C@@H]2CCC[NH2+]C2)c1 ZINC000132178564 386226333 /nfs/dbraw/zinc/22/63/33/386226333.db2.gz RHPXOBFTWXVKIX-CQSZACIVSA-N 2 0 248.370 2.175 20 0 BEADRP CC[NH+](CC)CCN[C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000131886937 386227132 /nfs/dbraw/zinc/22/71/32/386227132.db2.gz LUKPNPRVMJHJRW-HUUCEWRRSA-N 2 0 247.386 2.063 20 0 BEADRP CC[NH+](CC)CCN[C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000131886549 386227932 /nfs/dbraw/zinc/22/79/32/386227932.db2.gz LUKPNPRVMJHJRW-LSDHHAIUSA-N 2 0 247.386 2.063 20 0 BEADRP CCCc1cccc(C[NH2+][C@@H](C)CC[NH3+])c1 ZINC000414898764 386231848 /nfs/dbraw/zinc/23/18/48/386231848.db2.gz TYNQENSRUYTFCE-LBPRGKRZSA-N 2 0 220.360 2.466 20 0 BEADRP CCC[C@H](CC)[NH2+]C[C@H]1CC[N@H+](CC)C1 ZINC000125231057 386235649 /nfs/dbraw/zinc/23/56/49/386235649.db2.gz DOHFINOLJHAOKA-OLZOCXBDSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H]1CC[C@@H](C)[NH+]1C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000414716424 386238232 /nfs/dbraw/zinc/23/82/32/386238232.db2.gz XWIZKGBXHVGLFA-FDYHWXHSSA-N 2 0 210.365 2.247 20 0 BEADRP C[C@@H]1CC[C@H](C)[N@H+]1C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000414716425 386238890 /nfs/dbraw/zinc/23/88/90/386238890.db2.gz XWIZKGBXHVGLFA-FVCCEPFGSA-N 2 0 210.365 2.247 20 0 BEADRP CC(C)(C)CC[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000415003317 386257233 /nfs/dbraw/zinc/25/72/33/386257233.db2.gz FSFMFMIAUXRQPU-QWHCGFSZSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1C[C@H](c2ccccc2)C[N@@H+]1C[C@@H]1CC[NH2+]C1 ZINC000647885882 386297835 /nfs/dbraw/zinc/29/78/35/386297835.db2.gz DRFTWKROMNKOCK-FMKPAKJESA-N 2 0 244.382 2.474 20 0 BEADRP CC(C)C[C@@H](C)[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000415005330 386298693 /nfs/dbraw/zinc/29/86/93/386298693.db2.gz JEHUCUCQINTUCC-KWCYVHTRSA-N 2 0 224.392 2.399 20 0 BEADRP CCn1cncc1CNc1cc(C)ccn1 ZINC000416424405 386300797 /nfs/dbraw/zinc/30/07/97/386300797.db2.gz CSXBAIAHDZVWJW-UHFFFAOYSA-N 2 0 216.288 2.219 20 0 BEADRP Cc1cc(C[NH2+][C@@H](C)CC[NH3+])cc2cccnc12 ZINC000414901732 386309781 /nfs/dbraw/zinc/30/97/81/386309781.db2.gz XJXKHTTXYOPWGE-LBPRGKRZSA-N 2 0 243.354 2.370 20 0 BEADRP C[C@@H]([NH3+])[C@@H](C)[NH2+]CCCCOc1ccccc1 ZINC000415005880 386312272 /nfs/dbraw/zinc/31/22/72/386312272.db2.gz AXEJZDLHBCIQBI-CHWSQXEVSA-N 2 0 236.359 2.171 20 0 BEADRP CSCC[N@@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000336682357 386340739 /nfs/dbraw/zinc/34/07/39/386340739.db2.gz RPNOCJGNKIBCKM-CYBMUJFWSA-N 2 0 242.432 2.013 20 0 BEADRP Cc1cc(C[NH2+]C2CC[NH2+]CC2)c(C)s1 ZINC000335278832 386345316 /nfs/dbraw/zinc/34/53/16/386345316.db2.gz QSHVVOXMRMDKQZ-UHFFFAOYSA-N 2 0 224.373 2.207 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+]Cc1ccsc1 ZINC000335278749 386345418 /nfs/dbraw/zinc/34/54/18/386345418.db2.gz NQPPMWNBLIIGOT-MPEURRAXSA-N 2 0 236.384 2.354 20 0 BEADRP CC(C)C[N@@H+]1CC2(C[C@@H]1C)CC[NH2+]CC2 ZINC000335278951 386361096 /nfs/dbraw/zinc/36/10/96/386361096.db2.gz MVYUTFHMGCPUQH-LBPRGKRZSA-N 2 0 210.365 2.106 20 0 BEADRP Fc1cccc([C@@H]2CCN2C[C@@H]2CC[NH2+]C2)c1 ZINC000647890039 386365599 /nfs/dbraw/zinc/36/55/99/386365599.db2.gz IQBKAUMETFJGEQ-RISCZKNCSA-N 2 0 234.318 2.182 20 0 BEADRP CC[N@H+](CCCO)CCCc1cnccc1C ZINC000290041845 386387057 /nfs/dbraw/zinc/38/70/57/386387057.db2.gz OBGZKBVFTPNCTE-UHFFFAOYSA-N 2 0 236.359 2.027 20 0 BEADRP C[NH+](C)CC1CC[NH+](CCC2CC2)CC1 ZINC000336698787 386384962 /nfs/dbraw/zinc/38/49/62/386384962.db2.gz SVUHLHFPFUOGMK-UHFFFAOYSA-N 2 0 210.365 2.060 20 0 BEADRP C[C@@H]1C[C@@H](C[N@H+](C)[C@@H]2CC2(C)C)CC[NH2+]1 ZINC000414741518 386325687 /nfs/dbraw/zinc/32/56/87/386325687.db2.gz MNYYBZLLZOINKV-GRYCIOLGSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@H]1[C@@H](Cc2ccccc2)CC[N@@H+]1CCC[NH3+] ZINC000414740224 386330100 /nfs/dbraw/zinc/33/01/00/386330100.db2.gz JRCHLIUSXOGVSI-DZGCQCFKSA-N 2 0 232.371 2.288 20 0 BEADRP C[C@@H]([NH2+]CC1(C)CC[NH2+]CC1)C1CCC1 ZINC000414910802 386438748 /nfs/dbraw/zinc/43/87/48/386438748.db2.gz SSPPRZTYVAMCCV-LLVKDONJSA-N 2 0 210.365 2.154 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH+](C)C[C@H](C)COC)C[C@@H]1C ZINC000527366089 386446118 /nfs/dbraw/zinc/44/61/18/386446118.db2.gz FQKANPPILBFWEV-IHRRRGAJSA-N 2 0 242.407 2.074 20 0 BEADRP C[C@@H]1OCC[C@@H]1[NH2+]CCCCC[NH+]1CCCC1 ZINC000339500237 386450992 /nfs/dbraw/zinc/45/09/92/386450992.db2.gz YQNKGYBNQLSDMG-KBPBESRZSA-N 2 0 240.391 2.020 20 0 BEADRP CC[C@@H]([NH2+][C@H](C)CC[NH+](C)C)c1ccncc1 ZINC000347419479 386398288 /nfs/dbraw/zinc/39/82/88/386398288.db2.gz NKPZSTPEEPSDIQ-TZMCWYRMSA-N 2 0 235.375 2.463 20 0 BEADRP CCC[C@]1(CO)CCCN1CC[NH2+]C(C)(C)C ZINC000414758174 386404181 /nfs/dbraw/zinc/40/41/81/386404181.db2.gz MFWPIRATDQYPNV-CQSZACIVSA-N 2 0 242.407 2.002 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]Cc2ccc(F)c(F)c2)C1 ZINC000093215560 386405621 /nfs/dbraw/zinc/40/56/21/386405621.db2.gz DHLPWEFTDVFWTA-WDEREUQCSA-N 2 0 240.297 2.324 20 0 BEADRP CC(C)(C)[C@@H]1CCC[N@H+](CCOCC[NH3+])CC1 ZINC000093232487 386406775 /nfs/dbraw/zinc/40/67/75/386406775.db2.gz CQNRAQCXWHNVRV-CYBMUJFWSA-N 2 0 242.407 2.110 20 0 BEADRP C[C@H](CC1CCOCC1)[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000414909752 386414873 /nfs/dbraw/zinc/41/48/73/386414873.db2.gz CJRMHTJPEXAJOL-XBFCOCLRSA-N 2 0 240.391 2.051 20 0 BEADRP Cc1cc(C)c2c(c1)C[N@@H+](C[C@H]1CC[NH2+]C1)CC2 ZINC000647991291 386419589 /nfs/dbraw/zinc/41/95/89/386419589.db2.gz WSSJSTJHFBFDHW-AWEZNQCLSA-N 2 0 244.382 2.271 20 0 BEADRP CC[C@@H]1C[C@@H](C)C[N@@H+]1CC[C@@H]1CC[NH2+]C1 ZINC000399148416 386427159 /nfs/dbraw/zinc/42/71/59/386427159.db2.gz GCVIQBLCXQRYEQ-FRRDWIJNSA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@@H]1C[C@@H](C)C[N@@H+]1CCC1CC[NH2+]CC1 ZINC000399164033 386428202 /nfs/dbraw/zinc/42/82/02/386428202.db2.gz LUZQSENITHRGKH-TZMCWYRMSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2CCCC[C@@H](C)C2)CC[NH2+]1 ZINC000414765495 386431361 /nfs/dbraw/zinc/43/13/61/386431361.db2.gz ZXXREUTUXGURLN-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1cc(C[NH2+][C@H]2C[C@@H](C)N(C3CC3)C2)ccn1 ZINC000391182046 386466301 /nfs/dbraw/zinc/46/63/01/386466301.db2.gz KPVGHJOBXZBYAF-OCCSQVGLSA-N 2 0 245.370 2.105 20 0 BEADRP C[C@@H](CCCC(F)(F)F)[NH2+]C1CC[NH2+]CC1 ZINC000414775836 386476219 /nfs/dbraw/zinc/47/62/19/386476219.db2.gz DLDPARLLAHHUMM-VIFPVBQESA-N 2 0 238.297 2.449 20 0 BEADRP C([NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)[C@H]1CC12CC2 ZINC000417345927 386488517 /nfs/dbraw/zinc/48/85/17/386488517.db2.gz YMAJJKXIYJALCK-JHJVBQTASA-N 2 0 220.360 2.003 20 0 BEADRP CC[C@H](Cc1ccccc1)[NH2+][C@@H](C)[C@H](C)[NH3+] ZINC000415015847 386500805 /nfs/dbraw/zinc/50/08/05/386500805.db2.gz NHOQSMSVQDHLGD-SGMGOOAPSA-N 2 0 220.360 2.333 20 0 BEADRP C[C@@H](CC1CCCC1)[NH2+]C1CC[NH2+]CC1 ZINC000414781971 386501238 /nfs/dbraw/zinc/50/12/38/386501238.db2.gz OBUJDYVVTISBIB-NSHDSACASA-N 2 0 210.365 2.297 20 0 BEADRP CC(C)n1cc(C[NH2+][C@@H](C)CCCC[NH3+])cn1 ZINC000415016439 386502458 /nfs/dbraw/zinc/50/24/58/386502458.db2.gz POTRKRQHPFFKEZ-LBPRGKRZSA-N 2 0 238.379 2.071 20 0 BEADRP CC(C)C[C@H](C)C[NH2+][C@@H]1CC[NH2+]C1(C)C ZINC000415050430 386504955 /nfs/dbraw/zinc/50/49/55/386504955.db2.gz YRZGXQANNBBQKH-NWDGAFQWSA-N 2 0 212.381 2.399 20 0 BEADRP CCc1ccc(C[NH2+][C@@H]2CC[C@@H](C[NH3+])C2)cc1 ZINC000415049236 386506148 /nfs/dbraw/zinc/50/61/48/386506148.db2.gz XNTVGWABNVVLRS-HUUCEWRRSA-N 2 0 232.371 2.466 20 0 BEADRP C[C@@H]([NH2+][C@@H]1Cc2ccc(Cl)cc2C1)[C@H](C)[NH3+] ZINC000415019164 386506335 /nfs/dbraw/zinc/50/63/35/386506335.db2.gz RPIWFSXSZPDEMU-IGJMFERPSA-N 2 0 238.762 2.133 20 0 BEADRP Cc1ccc(CCC[NH2+][C@H](C)CCCC[NH3+])cn1 ZINC000415019779 386509316 /nfs/dbraw/zinc/50/93/16/386509316.db2.gz WGIKVSOKPKHRPE-CYBMUJFWSA-N 2 0 249.402 2.430 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@H]2CC[C@H](C[NH3+])C2)C1 ZINC000415051380 386509683 /nfs/dbraw/zinc/50/96/83/386509683.db2.gz ZIOSAHUNHQNMHS-VOAKCMCISA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)[C@@H](C[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21)c1ccccc1 ZINC000415020401 386510641 /nfs/dbraw/zinc/51/06/41/386510641.db2.gz ATTYKMLYHJQJJJ-WCVJEAGWSA-N 2 0 244.382 2.234 20 0 BEADRP CC(C)C[C@@H](C)C[NH2+][C@@H](C)CCC[NH3+] ZINC000415025735 386513254 /nfs/dbraw/zinc/51/32/54/386513254.db2.gz RMQCNHLMXCZTPB-NEPJUHHUSA-N 2 0 200.370 2.386 20 0 BEADRP C[C@H](CCc1ccc(F)cc1)[NH2+][C@@H](C)[C@H](C)[NH3+] ZINC000415024978 386513467 /nfs/dbraw/zinc/51/34/67/386513467.db2.gz ZIPKAHIUPWQLQX-WOPDTQHZSA-N 2 0 238.350 2.472 20 0 BEADRP [NH3+]C[C@H]1CC[C@H](C[NH2+]C[C@H]2CCSC2)CC1 ZINC000415025506 386513734 /nfs/dbraw/zinc/51/37/34/386513734.db2.gz QIFJZQIEKAQTTF-JHJVBQTASA-N 2 0 242.432 2.094 20 0 BEADRP C[C@H](CCc1ccc(F)cc1)[NH2+][C@H](C)[C@H](C)[NH3+] ZINC000415024973 386514219 /nfs/dbraw/zinc/51/42/19/386514219.db2.gz ZIPKAHIUPWQLQX-GRYCIOLGSA-N 2 0 238.350 2.472 20 0 BEADRP Cc1ccc(C[NH2+][C@@H](C)CCC[NH3+])cc1F ZINC000415023457 386514769 /nfs/dbraw/zinc/51/47/69/386514769.db2.gz MWUWOIYUFXJCFS-NSHDSACASA-N 2 0 224.323 2.351 20 0 BEADRP c1cn(CC[N@@H+]2CC[C@@H](CC3CC3)C2)cn1 ZINC000339674267 386515808 /nfs/dbraw/zinc/51/58/08/386515808.db2.gz UJVBSKNSXPAEKB-ZDUSSCGKSA-N 2 0 219.332 2.005 20 0 BEADRP Cc1ccc(F)cc1C[NH2+][C@@H](C)CCC[NH3+] ZINC000415026391 386515975 /nfs/dbraw/zinc/51/59/75/386515975.db2.gz UDRBSZYLVUEPLM-NSHDSACASA-N 2 0 224.323 2.351 20 0 BEADRP CCC(C)(C)[C@@H](C)[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000519643957 386516117 /nfs/dbraw/zinc/51/61/17/386516117.db2.gz WHVUNHNLEUTACD-VXGBXAGGSA-N 2 0 212.381 2.400 20 0 BEADRP CC1(C)CC([NH2+][C@@H]2[C@H]3C[NH2+]C[C@H]32)CC(C)(C)C1 ZINC000415029457 386516480 /nfs/dbraw/zinc/51/64/80/386516480.db2.gz CSSHECHYVGKWQS-ITGUQSILSA-N 2 0 236.403 2.399 20 0 BEADRP c1ccc([C@@H]2CCC[C@@H]2[NH2+][C@@H]2[C@H]3C[NH2+]C[C@H]32)cc1 ZINC000415029296 386517158 /nfs/dbraw/zinc/51/71/58/386517158.db2.gz CMFLEJKPDFSBGC-ARKGTOAJSA-N 2 0 242.366 2.130 20 0 BEADRP C[C@@H]1CC(C)(C)CC[C@@H]1[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000415031613 386518534 /nfs/dbraw/zinc/51/85/34/386518534.db2.gz GKEWVCYJBHNBCC-BNDIWNMDSA-N 2 0 222.376 2.009 20 0 BEADRP [NH3+]C[C@@H]1CC[C@H]([NH2+]C/C=C/c2ccccc2)C1 ZINC000415032346 386519650 /nfs/dbraw/zinc/51/96/50/386519650.db2.gz IAJWTYTUFAKXBJ-PWZNUNQRSA-N 2 0 230.355 2.417 20 0 BEADRP Cc1ccsc1C[NH2+][C@@H]1CC[C@H](C[NH3+])C1 ZINC000415032297 386520175 /nfs/dbraw/zinc/52/01/75/386520175.db2.gz HYFVZXCYLJTBSC-WDEREUQCSA-N 2 0 224.373 2.274 20 0 BEADRP CC[C@@H]1CCC[C@@H](C[NH2+][C@@H]2[C@H]3C[NH2+]C[C@H]32)C1 ZINC000415042159 386530343 /nfs/dbraw/zinc/53/03/43/386530343.db2.gz SDVKEIAZTVTFIK-POQQGIQPSA-N 2 0 222.376 2.010 20 0 BEADRP [NH3+]C[C@@H]1CC[C@H]([NH2+]Cc2cc(F)cc(F)c2)C1 ZINC000415034699 386520959 /nfs/dbraw/zinc/52/09/59/386520959.db2.gz KDNSOLMGGQRMNK-RNCFNFMXSA-N 2 0 240.297 2.182 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]C/C=C\c1ccccc1 ZINC000414787879 386530311 /nfs/dbraw/zinc/53/03/11/386530311.db2.gz CVORLGAERQDORQ-PYMSSDGJSA-N 2 0 230.355 2.417 20 0 BEADRP [NH3+]C[C@@H]1CC[C@H]([NH2+]Cc2c(F)cccc2F)C1 ZINC000415037388 386524925 /nfs/dbraw/zinc/52/49/25/386524925.db2.gz MGPYEKUCTOZQAY-ZJUUUORDSA-N 2 0 240.297 2.182 20 0 BEADRP CCC[C@H](C[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21)c1ccccc1 ZINC000415039269 386527000 /nfs/dbraw/zinc/52/70/00/386527000.db2.gz PBEVNRXVTBMGRZ-WCVJEAGWSA-N 2 0 244.382 2.378 20 0 BEADRP CCCc1cccc(C[NH2+]C2CC[NH2+]CC2)c1 ZINC000414787579 386527771 /nfs/dbraw/zinc/52/77/71/386527771.db2.gz ZFEOEDOUFMANFB-UHFFFAOYSA-N 2 0 232.371 2.481 20 0 BEADRP CCOc1ccc(C[N@@H+]2CC[C@H]([NH3+])[C@H](C)C2)cc1 ZINC000094338823 386457628 /nfs/dbraw/zinc/45/76/28/386457628.db2.gz BTFFKLRFYNDOMV-DOMZBBRYSA-N 2 0 248.370 2.254 20 0 BEADRP Cc1cccc(C)c1CC[NH2+]CC(C)(C)[NH3+] ZINC000415077075 386576969 /nfs/dbraw/zinc/57/69/69/386576969.db2.gz DQQFMVLXBQHOLG-UHFFFAOYSA-N 2 0 220.360 2.173 20 0 BEADRP Cc1cc(C[NH2+]C[C@]2(C)CC[NH2+]C2)ccc1F ZINC000415077067 386578268 /nfs/dbraw/zinc/57/82/68/386578268.db2.gz DOOMCGXBZKOABJ-CQSZACIVSA-N 2 0 236.334 2.223 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC000414800631 386588353 /nfs/dbraw/zinc/58/83/53/386588353.db2.gz SIVZXORJFUHQCG-KKUMJFAQSA-N 2 0 232.371 2.363 20 0 BEADRP c1ccc2c(c1)CC[C@@H]2C[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000415081652 386591036 /nfs/dbraw/zinc/59/10/36/386591036.db2.gz NBSFGMNTRZANOQ-UKRRQHHQSA-N 2 0 244.382 2.306 20 0 BEADRP CC[C@H](COC)NCC[NH2+]C1CCCCCC1 ZINC000414799913 386594406 /nfs/dbraw/zinc/59/44/06/386594406.db2.gz FFOBEZDPIYWWNS-CYBMUJFWSA-N 2 0 242.407 2.313 20 0 BEADRP CC[C@@H](COC)NCC[NH2+]C1CCCCCC1 ZINC000414799914 386594610 /nfs/dbraw/zinc/59/46/10/386594610.db2.gz FFOBEZDPIYWWNS-ZDUSSCGKSA-N 2 0 242.407 2.313 20 0 BEADRP C[N@H+](CCCC[NH2+]C1CCSCC1)C1CC1 ZINC000453405386 386595049 /nfs/dbraw/zinc/59/50/49/386595049.db2.gz QMDGKDITBLIHNH-UHFFFAOYSA-N 2 0 242.432 2.346 20 0 BEADRP CC(C)([NH3+])C[NH2+]CCCc1cccc(F)c1 ZINC000415083832 386596008 /nfs/dbraw/zinc/59/60/08/386596008.db2.gz FURUVRDVIUMTGN-UHFFFAOYSA-N 2 0 224.323 2.085 20 0 BEADRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]Cc1cc(F)cc(F)c1 ZINC000414788614 386532481 /nfs/dbraw/zinc/53/24/81/386532481.db2.gz DQLQMMNEIBDXQD-MFKMUULPSA-N 2 0 240.297 2.182 20 0 BEADRP [NH3+]C[C@@H]1CC[C@H]([NH2+]CC2CCCCC2)C1 ZINC000415046332 386532509 /nfs/dbraw/zinc/53/25/09/386532509.db2.gz UZPIGGYHVFIZLJ-OLZOCXBDSA-N 2 0 210.365 2.284 20 0 BEADRP Cc1ccc(F)cc1C[NH2+][C@H]1CC[C@H](C[NH3+])C1 ZINC000415046834 386534245 /nfs/dbraw/zinc/53/42/45/386534245.db2.gz VJGGMDDBGBTBLE-FZMZJTMJSA-N 2 0 236.334 2.351 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCC[C@@H]([C@@H]2CC[NH2+]C2)C1 ZINC000414789065 386535071 /nfs/dbraw/zinc/53/50/71/386535071.db2.gz XUFANYGWCGZELO-BFHYXJOUSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H](C[NH2+]C1CC(C)(C)C1)N(C)C1CC1 ZINC000336755401 386537665 /nfs/dbraw/zinc/53/76/65/386537665.db2.gz IVHBPEXEMKCZFT-JTQLQIEISA-N 2 0 210.365 2.247 20 0 BEADRP CC1(C)CCC[C@H]1[C@@H]1CC[N@H+](CCN)C1 ZINC000647995410 386538623 /nfs/dbraw/zinc/53/86/23/386538623.db2.gz VVLGEQQQTKVPKV-NEPJUHHUSA-N 2 0 210.365 2.093 20 0 BEADRP CC[C@]1(C)CC[N@H+](CC[C@@H]2CCC[NH2+]C2)C1 ZINC000399386458 386538589 /nfs/dbraw/zinc/53/85/89/386538589.db2.gz RIUVNBMEEYTJOP-UONOGXRCSA-N 2 0 224.392 2.498 20 0 BEADRP COc1ccccc1CN[C@@H](C[NH3+])C(C)(C)C ZINC000415060030 386542423 /nfs/dbraw/zinc/54/24/23/386542423.db2.gz VWNLMLFCIMOLBI-ZDUSSCGKSA-N 2 0 236.359 2.158 20 0 BEADRP CC(C)(C)[C@@H](C[NH3+])NCc1cccc(F)c1F ZINC000415059709 386542748 /nfs/dbraw/zinc/54/27/48/386542748.db2.gz VMSUJGXLYVZUGF-LLVKDONJSA-N 2 0 242.313 2.428 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+]CC1C[NH2+]C1)[C@H](C)C2 ZINC000335460896 386543283 /nfs/dbraw/zinc/54/32/83/386543283.db2.gz HASNRCIEFWXDNF-IAQYHMDHSA-N 2 0 230.355 2.037 20 0 BEADRP Cc1ccc2c(c1)[C@@H]([NH2+]CC1C[NH2+]C1)[C@H](C)C2 ZINC000335460895 386544059 /nfs/dbraw/zinc/54/40/59/386544059.db2.gz HASNRCIEFWXDNF-ABAIWWIYSA-N 2 0 230.355 2.037 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+]CCC[NH2+]C1CC1 ZINC000415063566 386545824 /nfs/dbraw/zinc/54/58/24/386545824.db2.gz AGUDHQFLUXMMJB-SECBINFHSA-N 2 0 238.297 2.449 20 0 BEADRP Cc1ccccc1C1([NH2+]C[C@@H]2CC[NH2+]C2)CC1 ZINC000647995279 386547580 /nfs/dbraw/zinc/54/75/80/386547580.db2.gz LICCIBKDXATOFO-CYBMUJFWSA-N 2 0 230.355 2.183 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CC2C[NH2+]C2)c2ccccc21 ZINC000335463622 386548000 /nfs/dbraw/zinc/54/80/00/386548000.db2.gz YYPIXXDAUAPPGT-IINYFYTJSA-N 2 0 216.328 2.044 20 0 BEADRP CC(C)C[C@@H](C)C[NH2+][C@@H]1CCCC[NH2+]C1 ZINC000415069131 386551161 /nfs/dbraw/zinc/55/11/61/386551161.db2.gz GCNWHMOJKUQPEZ-CHWSQXEVSA-N 2 0 212.381 2.400 20 0 BEADRP CC1CCC([NH2+][C@@H]2CCCC[NH2+]C2)CC1 ZINC000415069264 386551337 /nfs/dbraw/zinc/55/13/37/386551337.db2.gz OPSPVZOOYBNHSQ-WXRRBKDZSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)c1cccnc1)[C@H]1CCC[NH2+]C1 ZINC000415081709 386597358 /nfs/dbraw/zinc/59/73/58/386597358.db2.gz KUSBBUSRDCDSOR-SCRDCRAPSA-N 2 0 233.359 2.120 20 0 BEADRP C[C@H](CCC1CC1)[NH2+][C@H]1CCCC[NH2+]C1 ZINC000415070319 386554080 /nfs/dbraw/zinc/55/40/80/386554080.db2.gz IFEDAHNWTXPLKG-YPMHNXCESA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+][C@@H]1CCCC[NH2+]C1 ZINC000415070980 386554238 /nfs/dbraw/zinc/55/42/38/386554238.db2.gz JJHGOIBKIDWTPA-NXEZZACHSA-N 2 0 238.297 2.449 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@@H]1CCC[C@H](C)[C@H]1C ZINC000414794290 386557327 /nfs/dbraw/zinc/55/73/27/386557327.db2.gz LSVJAZJEJIXQTK-UMSGYPCISA-N 2 0 212.381 2.384 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@H]1CCC[C@@H]1C1CC1 ZINC000414793339 386564246 /nfs/dbraw/zinc/56/42/46/386564246.db2.gz KGTVFSUEVOIZQV-UPJWGTAASA-N 2 0 210.365 2.138 20 0 BEADRP CC[C@H]([NH2+]C1CCC(C[NH3+])CC1)[C@@H]1CCCO1 ZINC000415074627 386566581 /nfs/dbraw/zinc/56/65/81/386566581.db2.gz DAOQGSVKBNVUHZ-HOAMVYINSA-N 2 0 240.391 2.051 20 0 BEADRP COc1cc(C[NH2+]CC2CC[NH2+]CC2)ccc1C ZINC000415074098 386572738 /nfs/dbraw/zinc/57/27/38/386572738.db2.gz BWGRBMSVOZVZBJ-UHFFFAOYSA-N 2 0 248.370 2.093 20 0 BEADRP COCc1ccc(C[NH2+][C@H]2CCC[C@H]2C[NH3+])cc1 ZINC000414795561 386573633 /nfs/dbraw/zinc/57/36/33/386573633.db2.gz MYOITAUEVJOTMQ-GJZGRUSLSA-N 2 0 248.370 2.050 20 0 BEADRP C[C@H](C[NH2+][C@H](CN)C1CC1)c1ccc(F)cc1 ZINC000414807478 386619332 /nfs/dbraw/zinc/61/93/32/386619332.db2.gz OCGFIJJNBZSFDH-QMTHXVAHSA-N 2 0 236.334 2.256 20 0 BEADRP CCCC[C@H](COC)[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000414924376 386623966 /nfs/dbraw/zinc/62/39/66/386623966.db2.gz KBASYSREZRFGCM-JHJVBQTASA-N 2 0 228.380 2.051 20 0 BEADRP CCC([NH3+])(CC)C[NH2+]CCCc1ccc(C)nc1 ZINC000414808938 386624858 /nfs/dbraw/zinc/62/48/58/386624858.db2.gz LNRXTJOCAIGTRF-UHFFFAOYSA-N 2 0 249.402 2.430 20 0 BEADRP [NH3+]CC1CCC([NH2+][C@H]2CCC[C@@H]3C[C@@H]32)CC1 ZINC000415104996 386625132 /nfs/dbraw/zinc/62/51/32/386625132.db2.gz FNCXEMJNGXKSRB-UTAXJDLNSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[NH2+]C1)C1CCC(F)(F)CC1 ZINC000335498953 386625731 /nfs/dbraw/zinc/62/57/31/386625731.db2.gz ZQVFLSCSDVMWDP-GXSJLCMTSA-N 2 0 232.318 2.152 20 0 BEADRP c1cc2c(o1)CCC[C@H]2[NH2+]CC1=CC[NH2+]CC1 ZINC000335500123 386627803 /nfs/dbraw/zinc/62/78/03/386627803.db2.gz MMPUFSHMHZTMHH-CYBMUJFWSA-N 2 0 232.327 2.166 20 0 BEADRP CCC([NH3+])(CC)C[NH2+][C@H](C)CC1CCOCC1 ZINC000414809257 386628244 /nfs/dbraw/zinc/62/82/44/386628244.db2.gz LVFMTJAQNLUURI-GFCCVEGCSA-N 2 0 242.407 2.299 20 0 BEADRP CCC([NH3+])(CC)C[NH2+]C1CCC(OC)CC1 ZINC000414809312 386628407 /nfs/dbraw/zinc/62/84/07/386628407.db2.gz LZWSUZZCROXDEZ-UHFFFAOYSA-N 2 0 228.380 2.051 20 0 BEADRP C[C@@H](CCCc1cccnc1)[NH2+]C1CC[NH2+]CC1 ZINC000415105947 386628567 /nfs/dbraw/zinc/62/85/67/386628567.db2.gz GWYAUOSAPTUNJC-ZDUSSCGKSA-N 2 0 247.386 2.134 20 0 BEADRP CO[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1)CC(C)C ZINC000417379455 386655814 /nfs/dbraw/zinc/65/58/14/386655814.db2.gz UOIPWPRXNZVQHU-MJBXVCDLSA-N 2 0 242.407 2.120 20 0 BEADRP C1=C(C[NH2+][C@@H]2CCC23CCCC3)CC[NH2+]C1 ZINC000335502036 386629497 /nfs/dbraw/zinc/62/94/97/386629497.db2.gz UDAAGVQSIYZHHF-CYBMUJFWSA-N 2 0 220.360 2.219 20 0 BEADRP C1=C(C[NH2+][C@H]2CCC23CCCC3)CC[NH2+]C1 ZINC000335502037 386629529 /nfs/dbraw/zinc/62/95/29/386629529.db2.gz UDAAGVQSIYZHHF-ZDUSSCGKSA-N 2 0 220.360 2.219 20 0 BEADRP C[C@H]1Cc2ccccc2[C@@H]1[NH2+]CC1=CC[NH2+]CC1 ZINC000335501393 386629622 /nfs/dbraw/zinc/62/96/22/386629622.db2.gz SNUPNBQDHQVURT-BLLLJJGKSA-N 2 0 242.366 2.429 20 0 BEADRP [NH3+]C[C@H](NCc1ccc(Cl)s1)C1CC1 ZINC000414812178 386640131 /nfs/dbraw/zinc/64/01/31/386640131.db2.gz XAZFWFSDIXPIDJ-VIFPVBQESA-N 2 0 230.764 2.228 20 0 BEADRP CCOC[C@H](C)[NH2+]Cc1ccc([C@H](C)[NH3+])cc1 ZINC000414813144 386641735 /nfs/dbraw/zinc/64/17/35/386641735.db2.gz SLCCZAAYZUHQKH-RYUDHWBXSA-N 2 0 236.359 2.221 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]C[C@H]2CC23CC3)[C@H](C)C1 ZINC000417372117 386643539 /nfs/dbraw/zinc/64/35/39/386643539.db2.gz WNMBSRCMFOYHCV-UPJWGTAASA-N 2 0 222.376 2.106 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]C[C@H]1CC12CC2 ZINC000417371116 386644261 /nfs/dbraw/zinc/64/42/61/386644261.db2.gz VAUYLEDYZJIRPF-LPWJVIDDSA-N 2 0 222.376 2.105 20 0 BEADRP C[C@H]([NH2+][C@H]1CCCc2c(F)cccc21)C1C[NH2+]C1 ZINC000335511425 386646919 /nfs/dbraw/zinc/64/69/19/386646919.db2.gz HXYRJXSWRKPBAB-BONVTDFDSA-N 2 0 248.345 2.401 20 0 BEADRP CO[C@H](C[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1)CC(C)C ZINC000417379456 386654415 /nfs/dbraw/zinc/65/44/15/386654415.db2.gz UOIPWPRXNZVQHU-RDBSUJKOSA-N 2 0 242.407 2.120 20 0 BEADRP CC(C)C[NH2+]Cc1ccc([C@H](C)[NH3+])cc1 ZINC000414801672 386602039 /nfs/dbraw/zinc/60/20/39/386602039.db2.gz AKFLQOSHRLCZMU-NSHDSACASA-N 2 0 206.333 2.452 20 0 BEADRP C[C@H](CCc1cccc(F)c1)[NH2+]CC(C)(C)[NH3+] ZINC000414801675 386604164 /nfs/dbraw/zinc/60/41/64/386604164.db2.gz JOOPGVWXRCQDMN-LLVKDONJSA-N 2 0 238.350 2.474 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1CCC[C@@H](F)C1 ZINC000520231101 386609531 /nfs/dbraw/zinc/60/95/31/386609531.db2.gz ADVSZCFDVAKCTP-IJLUTSLNSA-N 2 0 216.344 2.374 20 0 BEADRP Cc1ccccc1OCCC[NH2+]CC(C)(C)[NH3+] ZINC000415089989 386610179 /nfs/dbraw/zinc/61/01/79/386610179.db2.gz ZMIOFVPCCJACJL-UHFFFAOYSA-N 2 0 236.359 2.091 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCCC[NH2+]C1)C1CCSCC1 ZINC000335493673 386614818 /nfs/dbraw/zinc/61/48/18/386614818.db2.gz CCVAPOQULHFZFQ-WCQYABFASA-N 2 0 242.432 2.250 20 0 BEADRP C1CC12CCC([NH2+][C@@H]1CCCC[NH2+]C1)CC2 ZINC000335495828 386618755 /nfs/dbraw/zinc/61/87/55/386618755.db2.gz NQKYYESPMCRVBP-CYBMUJFWSA-N 2 0 222.376 2.441 20 0 BEADRP CC(C)[C@@H](Cc1ccc(F)cc1)[NH2+]CCC[NH3+] ZINC000415113143 386619040 /nfs/dbraw/zinc/61/90/40/386619040.db2.gz SMWJNVYDPZNWPQ-CQSZACIVSA-N 2 0 238.350 2.331 20 0 BEADRP Cc1ccccc1C[C@H](C)[NH2+]CC[C@H](C)[NH3+] ZINC000414820166 386665782 /nfs/dbraw/zinc/66/57/82/386665782.db2.gz IWRYBEYWNNADIK-STQMWFEESA-N 2 0 220.360 2.253 20 0 BEADRP CNCC[NH2+]C[C@@H](C)CC1CCCCC1 ZINC000414822759 386670956 /nfs/dbraw/zinc/67/09/56/386670956.db2.gz GXMACWSEFJHIJO-LBPRGKRZSA-N 2 0 212.381 2.402 20 0 BEADRP C[C@H](CCc1ccsc1)[NH2+]CC[C@H](C)[NH3+] ZINC000414823928 386679931 /nfs/dbraw/zinc/67/99/31/386679931.db2.gz PRMDSLAEUYYYDI-WDEREUQCSA-N 2 0 226.389 2.396 20 0 BEADRP CC1(C)CCC[C@@H]1[NH2+]CC1=CC[NH2+]CC1 ZINC000335520274 386658507 /nfs/dbraw/zinc/65/85/07/386658507.db2.gz QMSLPZIHRHTALV-LBPRGKRZSA-N 2 0 208.349 2.074 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]C/C=C/c1ccccc1 ZINC000414830757 386709621 /nfs/dbraw/zinc/70/96/21/386709621.db2.gz CKGODURFDLENPY-PPGNKHEKSA-N 2 0 218.344 2.145 20 0 BEADRP CC[C@@H]1C[N@H+](C[C@H]2CCC(F)(F)C2)CC[C@H]1[NH3+] ZINC000302380965 386710818 /nfs/dbraw/zinc/71/08/18/386710818.db2.gz IGZVMKUIJDWMAZ-QJPTWQEYSA-N 2 0 246.345 2.481 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]C[C@H](C)c1ccccc1 ZINC000414830792 386710835 /nfs/dbraw/zinc/71/08/35/386710835.db2.gz CKNKZECGQBOBLQ-STQMWFEESA-N 2 0 220.360 2.235 20 0 BEADRP C[C@H]([NH3+])CC[NH2+]CCSCc1ccccc1 ZINC000414824826 386684224 /nfs/dbraw/zinc/68/42/24/386684224.db2.gz RMHMKVYNFZEUJV-LBPRGKRZSA-N 2 0 238.400 2.247 20 0 BEADRP C[C@H]([NH3+])CC[NH2+]Cc1ccc(OCC2CC2)cc1 ZINC000414823440 386684953 /nfs/dbraw/zinc/68/49/53/386684953.db2.gz OQWIPDFSWXUVCZ-LBPRGKRZSA-N 2 0 248.370 2.302 20 0 BEADRP C[NH2+]CCC[N@H+](C)C[C@@H]1CCCC[C@H]1C ZINC000394834711 386691854 /nfs/dbraw/zinc/69/18/54/386691854.db2.gz QDKDOBKEPNTEEC-OLZOCXBDSA-N 2 0 212.381 2.354 20 0 BEADRP Cc1cccc(C)c1C[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000414826111 386694262 /nfs/dbraw/zinc/69/42/62/386694262.db2.gz INCDBCIHKDPNQW-AWEZNQCLSA-N 2 0 232.371 2.393 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]CC[C@@H]2CC[NH2+]C2)[C@@H]1C ZINC000414827510 386695826 /nfs/dbraw/zinc/69/58/26/386695826.db2.gz HDXQXKYXDSLMEA-MQYQWHSLSA-N 2 0 224.392 2.400 20 0 BEADRP CC[C@@H](C)C[NH+]1CCC([C@@H]2CC[NH2+]C2)CC1 ZINC000357047075 386699760 /nfs/dbraw/zinc/69/97/60/386699760.db2.gz IYVLSRPQBPLEQL-TZMCWYRMSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000414831592 386706019 /nfs/dbraw/zinc/70/60/19/386706019.db2.gz NGIATSBXRZSRMJ-UPJWGTAASA-N 2 0 210.365 2.154 20 0 BEADRP CN(Cc1cc(F)ccc1F)C1CC[NH2+]CC1 ZINC000043459171 386707138 /nfs/dbraw/zinc/70/71/38/386707138.db2.gz JTSMMXUCZGWWAI-UHFFFAOYSA-N 2 0 240.297 2.149 20 0 BEADRP C(=C\c1ccccc1)\C[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000414836257 386730688 /nfs/dbraw/zinc/73/06/88/386730688.db2.gz URFSZMHTHFXMGO-UVCVVPOWSA-N 2 0 230.355 2.289 20 0 BEADRP COC[C@@H](CC(C)C)[NH2+][C@H](CN)CC(C)C ZINC000414836712 386731751 /nfs/dbraw/zinc/73/17/51/386731751.db2.gz IXIFYKWKYDTXIB-QWHCGFSZSA-N 2 0 230.396 2.011 20 0 BEADRP Fc1cccc(F)c1CNC[C@H]1CCC[NH2+]C1 ZINC000414837044 386732062 /nfs/dbraw/zinc/73/20/62/386732062.db2.gz VJFURRIEIPTEPI-JTQLQIEISA-N 2 0 240.297 2.054 20 0 BEADRP Cc1ccccc1CN[C@H](C[NH3+])CC(C)C ZINC000414837226 386736329 /nfs/dbraw/zinc/73/63/29/386736329.db2.gz JEVUDHYKIRGWON-AWEZNQCLSA-N 2 0 220.360 2.458 20 0 BEADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+]C2CCC3(CC3)CC2)C1 ZINC000335486510 386716398 /nfs/dbraw/zinc/71/63/98/386716398.db2.gz HEOQTAGNJPAKMO-DGCLKSJQSA-N 2 0 222.376 2.426 20 0 BEADRP CC(C)CC[C@@H](C)[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000414831829 386718458 /nfs/dbraw/zinc/71/84/58/386718458.db2.gz NYSYOEOIGOZIJF-OLZOCXBDSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]C2CCC3(CC3)CC2)CC[NH2+]1 ZINC000335540277 386719120 /nfs/dbraw/zinc/71/91/20/386719120.db2.gz ZZWWUXWHZMFRNT-AAEUAGOBSA-N 2 0 222.376 2.439 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000414832759 386720092 /nfs/dbraw/zinc/72/00/92/386720092.db2.gz OTIJDGQGIBDUSX-HZSPNIEDSA-N 2 0 224.392 2.402 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000414838713 386740166 /nfs/dbraw/zinc/74/01/66/386740166.db2.gz XGKANYORDRISDH-NXEZZACHSA-N 2 0 238.297 2.307 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CC[C@@H](C)[C@H](C)C1 ZINC000414834128 386721636 /nfs/dbraw/zinc/72/16/36/386721636.db2.gz GYEDKRQJUXPWEQ-UMSGYPCISA-N 2 0 212.381 2.256 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H](C)CCc1ccccc1 ZINC000414834265 386723228 /nfs/dbraw/zinc/72/32/28/386723228.db2.gz HFQVSLXUGMIPFA-KBPBESRZSA-N 2 0 234.387 2.453 20 0 BEADRP c1ccc2c(c1)CC[C@H]([NH2+]CC[C@H]1CC[NH2+]C1)C2 ZINC000414834284 386723468 /nfs/dbraw/zinc/72/34/68/386723468.db2.gz QNQNCJCIINGDAM-CJNGLKHVSA-N 2 0 244.382 2.133 20 0 BEADRP COC1(CC[NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)CCC1 ZINC000336663982 386753158 /nfs/dbraw/zinc/75/31/58/386753158.db2.gz WSABQULOYXKJDD-CHWSQXEVSA-N 2 0 240.391 2.018 20 0 BEADRP c1ccc2c(c1)C[NH+](CCC1CC[NH2+]CC1)C2 ZINC000050911431 386755817 /nfs/dbraw/zinc/75/58/17/386755817.db2.gz PCHLHGLFZGWBGU-UHFFFAOYSA-N 2 0 230.355 2.392 20 0 BEADRP c1cnc2ccc(CN3CCC[NH2+]CC3)cc2c1 ZINC000020247792 386791536 /nfs/dbraw/zinc/79/15/36/386791536.db2.gz DMYKJNZVVIMPGP-UHFFFAOYSA-N 2 0 241.338 2.030 20 0 BEADRP C[N@H+](Cc1cccc(F)c1)CC(C)(C)C[NH3+] ZINC000051214181 386778622 /nfs/dbraw/zinc/77/86/22/386778622.db2.gz KWJXRZSZAYZDRW-UHFFFAOYSA-N 2 0 224.323 2.242 20 0 BEADRP CCC1CC([NH2+]CC2(C)CC[NH+](C)CC2)C1 ZINC000336672949 386822114 /nfs/dbraw/zinc/82/21/14/386822114.db2.gz AXBZCBQDQUJMBW-UHFFFAOYSA-N 2 0 224.392 2.497 20 0 BEADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@@H]2CCCc3occc32)C1 ZINC000331398501 386847251 /nfs/dbraw/zinc/84/72/51/386847251.db2.gz RXVMKPARQXBXLV-NTZNESFSSA-N 2 0 234.343 2.374 20 0 BEADRP C[N@H+]1CC=C(C[NH2+]C2CC3(CCC3)C2)CC1 ZINC000334787535 386848665 /nfs/dbraw/zinc/84/86/65/386848665.db2.gz RVHSKCZEEWQOST-UHFFFAOYSA-N 2 0 220.360 2.171 20 0 BEADRP CO[C@H](C)[C@@H](C)[NH2+]CC(C)(C)C[NH+]1CCCC1 ZINC000357842140 386854704 /nfs/dbraw/zinc/85/47/04/386854704.db2.gz ATSPRGWKKWSTLZ-CHWSQXEVSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2CCCC3(CC3)C2)CC[NH2+]1 ZINC000334833059 386871276 /nfs/dbraw/zinc/87/12/76/386871276.db2.gz MLXQMHFWYILIHR-CHWSQXEVSA-N 2 0 222.376 2.251 20 0 BEADRP c1ccc2c(N[C@H]3CC[NH2+]C3)cc[nH+]c2c1 ZINC000052094011 386875010 /nfs/dbraw/zinc/87/50/10/386875010.db2.gz HBFJSDBVMBKXLQ-JTQLQIEISA-N 2 0 213.284 2.009 20 0 BEADRP Cc1ccc(C[NH2+]C2(C)CC[NH2+]CC2)cc1 ZINC000334840183 386884295 /nfs/dbraw/zinc/88/42/95/386884295.db2.gz ANJOCCQFQMMCHJ-UHFFFAOYSA-N 2 0 218.344 2.227 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CCC[C@H]([NH3+])C2)cc1F ZINC000334847489 386895759 /nfs/dbraw/zinc/89/57/59/386895759.db2.gz USNAYYCZUGVFIF-STQMWFEESA-N 2 0 236.334 2.494 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CCC[NH2+]CC2)cc1F ZINC000334848337 386896917 /nfs/dbraw/zinc/89/69/17/386896917.db2.gz RJECYAYHRPEVCM-ZDUSSCGKSA-N 2 0 236.334 2.366 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC(C)(C)C2)CC[NH2+]1 ZINC000414941965 386899186 /nfs/dbraw/zinc/89/91/86/386899186.db2.gz DCTDMQHBUYGENN-IJLUTSLNSA-N 2 0 210.365 2.295 20 0 BEADRP [NH3+]C1(C[NH2+][C@H]2CCc3ccccc3C2)CCC1 ZINC000334856139 386909400 /nfs/dbraw/zinc/90/94/00/386909400.db2.gz GHHKDFHYYBZQKT-AWEZNQCLSA-N 2 0 230.355 2.015 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CC[NH2+]C[C@H]2C)cc1C ZINC000334857332 386909479 /nfs/dbraw/zinc/90/94/79/386909479.db2.gz NEPOYLPQYAEHLU-UKRRQHHQSA-N 2 0 232.371 2.391 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CC[NH2+]C[C@H]2C)cc1F ZINC000334858390 386911424 /nfs/dbraw/zinc/91/14/24/386911424.db2.gz SHNZKRHZWWMLEX-BXUZGUMPSA-N 2 0 236.334 2.222 20 0 BEADRP Cc1ccc(C)c(C[NH2+][C@@H]2CC[NH2+]C[C@H]2C)c1 ZINC000334859368 386912575 /nfs/dbraw/zinc/91/25/75/386912575.db2.gz YSEFFPUZBZLVNS-UKRRQHHQSA-N 2 0 232.371 2.391 20 0 BEADRP c1cncc(C[N@@H+]2CCCC[C@H]2[C@@H]2CC[NH2+]C2)c1 ZINC000334867975 386925681 /nfs/dbraw/zinc/92/56/81/386925681.db2.gz HEOBKYZNFJNTQQ-CABCVRRESA-N 2 0 245.370 2.046 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)C1CC1 ZINC000093977907 386927314 /nfs/dbraw/zinc/92/73/14/386927314.db2.gz WFDMGXKNUNUYAG-RAIGVLPGSA-N 2 0 208.349 2.001 20 0 BEADRP C[C@H](O)CC(C)(C)C[NH2+][C@H]1CCCCC[C@H]1[NH3+] ZINC000331968561 386933532 /nfs/dbraw/zinc/93/35/32/386933532.db2.gz LEQGSNVSKSGETK-XQQFMLRXSA-N 2 0 242.407 2.033 20 0 BEADRP C[C@]1(C[NH2+]C2Cc3ccccc3C2)CCC[NH2+]C1 ZINC000334875840 386936577 /nfs/dbraw/zinc/93/65/77/386936577.db2.gz UQXIMQDZTANDCN-INIZCTEOSA-N 2 0 244.382 2.133 20 0 BEADRP CC(C)(C)C[C@H](O)C[NH2+][C@H]1CCCCC[C@H]1[NH3+] ZINC000332018338 386942861 /nfs/dbraw/zinc/94/28/61/386942861.db2.gz QNTCPCDHUQXRPN-XQQFMLRXSA-N 2 0 242.407 2.033 20 0 BEADRP Nc1ccc2c(c1)CCC[C@@H]2[NH2+][C@H]1CCC[C@H]1[NH3+] ZINC000332077082 386959096 /nfs/dbraw/zinc/95/90/96/386959096.db2.gz YRYZRUUCIAXSND-ILXRZTDVSA-N 2 0 245.370 2.116 20 0 BEADRP C[C@@H]1CC[C@@]2(CC[N@H+](CCn3ccnc3)C2)C1 ZINC000334890108 386962811 /nfs/dbraw/zinc/96/28/11/386962811.db2.gz MSJUVDAKKWLQKF-ZIAGYGMSSA-N 2 0 233.359 2.395 20 0 BEADRP C[C@@H](NCCc1cccs1)[C@H]1CCCC[NH2+]1 ZINC000395193840 386977887 /nfs/dbraw/zinc/97/78/87/386977887.db2.gz JMOHMQIHMCLNAR-DGCLKSJQSA-N 2 0 238.400 2.411 20 0 BEADRP CS[C@@H]1CC[C@H]1[NH2+]CCC[N@H+](C)C(C)C ZINC000425359398 386978163 /nfs/dbraw/zinc/97/81/63/386978163.db2.gz PXXPEUNPIYTMNL-VXGBXAGGSA-N 2 0 230.421 2.200 20 0 BEADRP C[C@H](NCCc1cccs1)[C@@H]1CCCC[NH2+]1 ZINC000395193837 386978952 /nfs/dbraw/zinc/97/89/52/386978952.db2.gz JMOHMQIHMCLNAR-AAEUAGOBSA-N 2 0 238.400 2.411 20 0 BEADRP CC/C=C/CC[N@@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC000368631203 386996285 /nfs/dbraw/zinc/99/62/85/386996285.db2.gz GTXSFJOHKOJEKF-ISZGNANSSA-N 2 0 222.376 2.370 20 0 BEADRP Cc1ccc(CN[C@H]2CC[N@@H+](C)C[C@H]2C)nc1C ZINC000314760245 386997999 /nfs/dbraw/zinc/99/79/99/386997999.db2.gz KASJLUQPKGJINY-DOMZBBRYSA-N 2 0 247.386 2.128 20 0 BEADRP C(C1CC1)[NH+](CC1CC1)C[C@@H]1CCC[NH2+]C1 ZINC000070064249 387043596 /nfs/dbraw/zinc/04/35/96/387043596.db2.gz GBPRPXOUKIZFER-CQSZACIVSA-N 2 0 222.376 2.108 20 0 BEADRP Fc1cccc2c1C[N@H+](CC[C@@H]1CC[NH2+]C1)CC2 ZINC000334966013 387046318 /nfs/dbraw/zinc/04/63/18/387046318.db2.gz DHJHADNWEMWYQQ-LBPRGKRZSA-N 2 0 248.345 2.183 20 0 BEADRP Fc1cccc2c1C[N@H+](CC[C@H]1CC[NH2+]C1)CC2 ZINC000334966012 387046917 /nfs/dbraw/zinc/04/69/17/387046917.db2.gz DHJHADNWEMWYQQ-GFCCVEGCSA-N 2 0 248.345 2.183 20 0 BEADRP CCOc1ccc(CN2CC[C@H](C[NH2+]C)C2)cc1 ZINC000109347987 387056200 /nfs/dbraw/zinc/05/62/00/387056200.db2.gz HCMDVEMZFNJBRA-CQSZACIVSA-N 2 0 248.370 2.127 20 0 BEADRP Cc1ccc(C[N@H+]2C[C@H](C[NH3+])C[C@H]2C)s1 ZINC000228060894 387063184 /nfs/dbraw/zinc/06/31/84/387063184.db2.gz PQXMVIBZBVQHSA-KOLCDFICSA-N 2 0 224.373 2.226 20 0 BEADRP C[C@]1(c2ccccc2)CC[C@H]([NH2+]CC2C[NH2+]C2)C1 ZINC000423299471 387130188 /nfs/dbraw/zinc/13/01/88/387130188.db2.gz BUOJRRNMNQMJIW-HOTGVXAUSA-N 2 0 244.382 2.306 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@H]([C@@H](C)[NH3+])C2)cc1C ZINC000126922524 387073959 /nfs/dbraw/zinc/07/39/59/387073959.db2.gz PRCNGZXCSUWUII-HIFRSBDPSA-N 2 0 232.371 2.473 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@@H]1CCCOc2ccccc21 ZINC000423301170 387132529 /nfs/dbraw/zinc/13/25/29/387132529.db2.gz SQPBPNMUQCYBED-WCQYABFASA-N 2 0 234.343 2.085 20 0 BEADRP Cc1cccc2c1CC[C@H]2[NH2+]C[C@@H](C)C[NH3+] ZINC000423298574 387130882 /nfs/dbraw/zinc/13/08/82/387130882.db2.gz OOPXJBIGCBAAFW-IINYFYTJSA-N 2 0 218.344 2.167 20 0 BEADRP [NH3+]C[C@@H]1CC[N@@H+]([C@@H]2CCCc3ccc(F)cc32)C1 ZINC000334998255 387090140 /nfs/dbraw/zinc/09/01/40/387090140.db2.gz MXVCDUAJPSKNBP-XHDPSFHLSA-N 2 0 248.345 2.484 20 0 BEADRP Cc1ccc(C[N@H+]2CCC[C@@H]([C@@H](C)[NH3+])C2)c(C)n1 ZINC000334998960 387091809 /nfs/dbraw/zinc/09/18/09/387091809.db2.gz XFYXEXVXOMYSJJ-TZMCWYRMSA-N 2 0 247.386 2.258 20 0 BEADRP CC[C@](C)(C[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)OC ZINC000322514414 387092572 /nfs/dbraw/zinc/09/25/72/387092572.db2.gz JTUQVBUJCCDHNK-MELADBBJSA-N 2 0 240.391 2.018 20 0 BEADRP Cc1ccc(F)cc1C[NH2+]CCC[NH2+]C1CC1 ZINC000228409770 387092975 /nfs/dbraw/zinc/09/29/75/387092975.db2.gz NRGBNWAWCLRYTD-UHFFFAOYSA-N 2 0 236.334 2.366 20 0 BEADRP C[C@H]1C[NH2+]CC[C@H]1[NH2+]C1CCC2(CC2)CC1 ZINC000335007602 387102738 /nfs/dbraw/zinc/10/27/38/387102738.db2.gz PARVQYVPHSYBED-WCQYABFASA-N 2 0 222.376 2.297 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]C1CCC2(CC2)CC1 ZINC000335011961 387106999 /nfs/dbraw/zinc/10/69/99/387106999.db2.gz WPKUSXZDRQDFQS-NEPJUHHUSA-N 2 0 208.349 2.179 20 0 BEADRP CC[C@H]1CCCCN1CC[NH2+]C1CCOCC1 ZINC000062767649 387114827 /nfs/dbraw/zinc/11/48/27/387114827.db2.gz PBPPVYZAHWEPQZ-AWEZNQCLSA-N 2 0 240.391 2.020 20 0 BEADRP CC1=CCC[NH+](CC[C@H]2CCC[N@H+]2C)C1 ZINC000335025087 387116015 /nfs/dbraw/zinc/11/60/15/387116015.db2.gz GXTCBZABIDJWPE-CYBMUJFWSA-N 2 0 208.349 2.123 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CC[NH2+]CC[C@@H]2C)cc1 ZINC000335026555 387118027 /nfs/dbraw/zinc/11/80/27/387118027.db2.gz QFHAQNXLLQZBGT-DZGCQCFKSA-N 2 0 232.371 2.473 20 0 BEADRP Cc1cc(C)c(C[NH2+][C@@H]2CC[NH2+]CC[C@H]2C)cn1 ZINC000335028857 387122599 /nfs/dbraw/zinc/12/25/99/387122599.db2.gz ZHURDHLQIYOFBN-IAQYHMDHSA-N 2 0 247.386 2.176 20 0 BEADRP CCOc1ccccc1C[N@@H+]1C[C@H](C[NH3+])C[C@H]1C ZINC000250508308 387124391 /nfs/dbraw/zinc/12/43/91/387124391.db2.gz GWXAQLAIUSSMOU-OLZOCXBDSA-N 2 0 248.370 2.254 20 0 BEADRP CC1(C[NH2+][C@H]2CCCCC[C@H]2[NH3+])CCC1 ZINC000335031792 387126991 /nfs/dbraw/zinc/12/69/91/387126991.db2.gz IVCWHDVICFPXCC-NEPJUHHUSA-N 2 0 210.365 2.426 20 0 BEADRP COc1ccsc1[C@H](C)[NH2+]C[C@H](C)C[NH3+] ZINC000423299881 387129044 /nfs/dbraw/zinc/12/90/44/387129044.db2.gz CMVRKQQBZWIOCC-BDAKNGLRSA-N 2 0 228.361 2.002 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H]1c2cc(F)ccc2C[C@@H]1C ZINC000423298617 387130061 /nfs/dbraw/zinc/13/00/61/387130061.db2.gz OUZDOYHPIWWCAR-BFVZDQMLSA-N 2 0 236.334 2.243 20 0 BEADRP C[C@H](O)C[C@H](C)[NH2+][C@@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000228090559 387067915 /nfs/dbraw/zinc/06/79/15/387067915.db2.gz GRXBOFOXLFVHJM-XUXIUFHCSA-N 2 0 242.407 2.046 20 0 BEADRP CC(C)CC[C@@H]([NH2+]C[C@@H](C)C[NH3+])C1CC1 ZINC000423306063 387141358 /nfs/dbraw/zinc/14/13/58/387141358.db2.gz LDAFPLXTWKVSNE-WCQYABFASA-N 2 0 212.381 2.386 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H](C)[C@@H]1CCCC[C@@H]1C ZINC000423306036 387141748 /nfs/dbraw/zinc/14/17/48/387141748.db2.gz KYLQNMFTFUPVMA-YVECIDJPSA-N 2 0 212.381 2.386 20 0 BEADRP CC(C)C[C@H](C)C[C@H](C)[NH2+]CC1C[NH2+]C1 ZINC000423308749 387142741 /nfs/dbraw/zinc/14/27/41/387142741.db2.gz YGFAEYZJSZHEQQ-RYUDHWBXSA-N 2 0 212.381 2.256 20 0 BEADRP C[C@@H]([NH2+]CC1C[NH2+]C1)c1cccc(Cl)c1 ZINC000423308368 387143620 /nfs/dbraw/zinc/14/36/20/387143620.db2.gz XQHBKMVFOQGTKV-SECBINFHSA-N 2 0 224.735 2.210 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H](C1CC1)C1CCCC1 ZINC000423308534 387143858 /nfs/dbraw/zinc/14/38/58/387143858.db2.gz OREDLPKICYYART-MFKMUULPSA-N 2 0 210.365 2.140 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@H]1CCCc2cc(F)ccc21 ZINC000423308122 387144020 /nfs/dbraw/zinc/14/40/20/387144020.db2.gz NXLPTCXTWSSUDX-HZMBPMFUSA-N 2 0 236.334 2.388 20 0 BEADRP CC[C@@H]1C[C@H](C)CC[C@H]1[NH2+]CC1C[NH2+]C1 ZINC000423307346 387144393 /nfs/dbraw/zinc/14/43/93/387144393.db2.gz VTFNBDJTMJMKDH-RAIGVLPGSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]([NH2+]CC1C[NH2+]C1)c1ccc2c(c1)CCC2 ZINC000423309050 387145986 /nfs/dbraw/zinc/14/59/86/387145986.db2.gz YRSCHKZAQCJDCJ-LLVKDONJSA-N 2 0 230.355 2.045 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@@H]1CCCc2ccc(F)cc21 ZINC000423310630 387146498 /nfs/dbraw/zinc/14/64/98/387146498.db2.gz SDIVLVBKKWAWCU-IINYFYTJSA-N 2 0 236.334 2.388 20 0 BEADRP CC(C)CO[C@@H]1C[C@@H]([NH2+]C[C@H](C)C[NH3+])C1(C)C ZINC000423311486 387149483 /nfs/dbraw/zinc/14/94/83/387149483.db2.gz UBELJDWFSNBGFQ-JHJVBQTASA-N 2 0 242.407 2.011 20 0 BEADRP CCC[C@@H]([NH2+]C[C@@H](C)C[NH3+])c1ccccn1 ZINC000423313268 387152139 /nfs/dbraw/zinc/15/21/39/387152139.db2.gz WTAIOVWJJJQNST-NWDGAFQWSA-N 2 0 221.348 2.107 20 0 BEADRP [NH3+][C@H](C[NH2+][C@@H](Cc1ccccc1)C1CC1)C1CC1 ZINC000423315183 387153649 /nfs/dbraw/zinc/15/36/49/387153649.db2.gz IQPRHBCZNWNTJI-CVEARBPZSA-N 2 0 244.382 2.335 20 0 BEADRP C[C@@H]1Cc2ccccc2[C@H]1[NH2+]C[C@@H]([NH3+])C1CC1 ZINC000423314844 387154308 /nfs/dbraw/zinc/15/43/08/387154308.db2.gz HXZDLNSSXCOXSR-KMUNFCNLSA-N 2 0 230.355 2.247 20 0 BEADRP C[C@H]([NH2+]C[C@H]([NH3+])C1CC1)C1C(C)(C)C1(C)C ZINC000423318983 387158770 /nfs/dbraw/zinc/15/87/70/387158770.db2.gz LHIKEVOEBKNMOS-ONGXEEELSA-N 2 0 224.392 2.384 20 0 BEADRP C[C@@H]1Cc2ccccc2[C@@H]1[NH2+]CCCC[NH3+] ZINC000423319090 387159255 /nfs/dbraw/zinc/15/92/55/387159255.db2.gz CFJKVCXTQSVTQZ-BXUZGUMPSA-N 2 0 218.344 2.248 20 0 BEADRP C[C@@H]1CC(C)(C)C[C@@H]1[NH2+]C[C@H]([NH3+])C1CC1 ZINC000423317775 387159373 /nfs/dbraw/zinc/15/93/73/387159373.db2.gz KOEBNWOUROYAKO-USWWRNFRSA-N 2 0 210.365 2.138 20 0 BEADRP [NH3+]CCCC[NH2+][C@H](Cc1ccccc1)C1CC1 ZINC000423320913 387160787 /nfs/dbraw/zinc/16/07/87/387160787.db2.gz GTTDLHCILHZYPJ-OAHLLOKOSA-N 2 0 232.371 2.336 20 0 BEADRP Cc1nc2c(s1)[C@H]([NH2+]CCCC[NH3+])CCC2 ZINC000423321212 387161212 /nfs/dbraw/zinc/16/12/12/387161212.db2.gz FASHRAOTNHRPCA-SNVBAGLBSA-N 2 0 239.388 2.157 20 0 BEADRP CCC1(CC)[C@H](OC)C[C@@H]1[NH2+]CC1([NH3+])CCC1 ZINC000423319994 387162365 /nfs/dbraw/zinc/16/23/65/387162365.db2.gz FYGGTZKPXHESDL-NWDGAFQWSA-N 2 0 240.391 2.051 20 0 BEADRP CCCCO[C@H]1C[C@@H]([NH2+]CCCC[NH3+])C1(C)C ZINC000423322882 387164933 /nfs/dbraw/zinc/16/49/33/387164933.db2.gz JANFVDVZVUAYFI-OLZOCXBDSA-N 2 0 242.407 2.299 20 0 BEADRP CC(C)[C@@H]([NH2+]CCCC[NH3+])c1ccc(F)cn1 ZINC000423323478 387167374 /nfs/dbraw/zinc/16/73/74/387167374.db2.gz JMNNBSTZIJMQRU-CYBMUJFWSA-N 2 0 239.338 2.246 20 0 BEADRP Cc1ccncc1[C@@H](C)[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000423324197 387168689 /nfs/dbraw/zinc/16/86/89/387168689.db2.gz AUCHGCAISRRIRV-HIFRSBDPSA-N 2 0 247.386 2.430 20 0 BEADRP CC(C)[C@H]([NH2+]CCCC[NH3+])c1cccnc1 ZINC000423323928 387168884 /nfs/dbraw/zinc/16/88/84/387168884.db2.gz JQHDFRDWMNUFPI-ZDUSSCGKSA-N 2 0 221.348 2.107 20 0 BEADRP C[C@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)c1ccncc1 ZINC000423328483 387170446 /nfs/dbraw/zinc/17/04/46/387170446.db2.gz DSHDMUDFWMWQMJ-JSGCOSHPSA-N 2 0 233.359 2.122 20 0 BEADRP C[C@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)c1ccncc1 ZINC000423328481 387170629 /nfs/dbraw/zinc/17/06/29/387170629.db2.gz DSHDMUDFWMWQMJ-GXTWGEPZSA-N 2 0 233.359 2.122 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]([NH3+])C1CC1)c1ccccc1 ZINC000423329455 387173249 /nfs/dbraw/zinc/17/32/49/387173249.db2.gz SVBLGIZMMOAARL-KGLIPLIRSA-N 2 0 218.344 2.465 20 0 BEADRP CC(C)[C@@H]1CCC[C@H]([NH2+]CC2C[NH2+]C2)C1 ZINC000423331683 387175260 /nfs/dbraw/zinc/17/52/60/387175260.db2.gz UTCBOHGYFCJUKI-OLZOCXBDSA-N 2 0 210.365 2.010 20 0 BEADRP CC[C@@H]([NH2+]CC1C[NH2+]C1)c1ccsc1 ZINC000423331791 387179094 /nfs/dbraw/zinc/17/90/94/387179094.db2.gz UWQBKPOIQSLYII-LLVKDONJSA-N 2 0 210.346 2.008 20 0 BEADRP C[C@H](C[C@H]1CCCCC[NH2+]1)[NH2+][C@H]1CCCOC1 ZINC000251208122 387185466 /nfs/dbraw/zinc/18/54/66/387185466.db2.gz LVQWYOFXJINCOT-MCIONIFRSA-N 2 0 240.391 2.066 20 0 BEADRP CCC1(CC)[C@H]([NH2+]CCCC[NH3+])[C@H](C)[C@H]1OC ZINC000423341856 387189448 /nfs/dbraw/zinc/18/94/48/387189448.db2.gz YDMHTEILQNLIAE-YNEHKIRRSA-N 2 0 242.407 2.155 20 0 BEADRP CC(C)n1cc([C@@H](C)[NH2+]CC2=CC[NH2+]CC2)cn1 ZINC000423341814 387190845 /nfs/dbraw/zinc/19/08/45/387190845.db2.gz KJFWUBZPBLYAPH-GFCCVEGCSA-N 2 0 248.374 2.034 20 0 BEADRP C[C@H]([NH2+]CC1C[NH2+]C1)C1CCC(F)(F)CC1 ZINC000423300938 387133052 /nfs/dbraw/zinc/13/30/52/387133052.db2.gz GBQWDDIRHUCHFK-VIFPVBQESA-N 2 0 232.318 2.009 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H]1CCCOc2ccccc21 ZINC000423301169 387133103 /nfs/dbraw/zinc/13/31/03/387133103.db2.gz SQPBPNMUQCYBED-DGCLKSJQSA-N 2 0 234.343 2.085 20 0 BEADRP Fc1ccc([C@H]2CCC[C@H]2[NH2+]CC2C[NH2+]C2)cc1 ZINC000423300743 387133238 /nfs/dbraw/zinc/13/32/38/387133238.db2.gz FGMLCSBYASDAIJ-HUUCEWRRSA-N 2 0 248.345 2.271 20 0 BEADRP CCC[C@H]([NH2+]CC1C[NH2+]C1)c1ccc(OC)cc1 ZINC000423300046 387133477 /nfs/dbraw/zinc/13/34/77/387133477.db2.gz CYDNHBYIWXGNTR-HNNXBMFYSA-N 2 0 248.370 2.345 20 0 BEADRP CCCC[C@H](C[NH3+])N[C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000423303412 387137050 /nfs/dbraw/zinc/13/70/50/387137050.db2.gz XBKDXESYTBRTLL-UGFHNGPFSA-N 2 0 247.386 2.238 20 0 BEADRP C[C@@H]([NH2+]CC1C[NH2+]C1)[C@@H](C)C1CCCCC1 ZINC000423303652 387137669 /nfs/dbraw/zinc/13/76/69/387137669.db2.gz MGFDPMHGXMHCSX-VXGBXAGGSA-N 2 0 224.392 2.400 20 0 BEADRP c1ccc([C@H]2CCC[C@H]2[NH2+]CC2C[NH2+]C2)cc1 ZINC000423303572 387137722 /nfs/dbraw/zinc/13/77/22/387137722.db2.gz LZDJQUZWAVVYSH-HUUCEWRRSA-N 2 0 230.355 2.132 20 0 BEADRP c1ccc([C@@H]2CCC[C@H]2[NH2+]CC2C[NH2+]C2)cc1 ZINC000423303573 387138110 /nfs/dbraw/zinc/13/81/10/387138110.db2.gz LZDJQUZWAVVYSH-LSDHHAIUSA-N 2 0 230.355 2.132 20 0 BEADRP CCC[NH2+]CC[NH2+][C@H]1CCC[C@@H]1CCCF ZINC000423305381 387139792 /nfs/dbraw/zinc/13/97/92/387139792.db2.gz BNFHOWFUXRKNDE-OLZOCXBDSA-N 2 0 230.371 2.494 20 0 BEADRP C[C@@H]([NH2+]C[C@@H](C)C[NH3+])C1C(C)(C)C1(C)C ZINC000423304790 387140402 /nfs/dbraw/zinc/14/04/02/387140402.db2.gz ZLWXVNYICVFHOO-VHSXEESVSA-N 2 0 212.381 2.242 20 0 BEADRP CC(C)(C)[C@H]1CC[C@H]1[NH2+]CC1=CC[NH2+]CC1 ZINC000423351470 387202645 /nfs/dbraw/zinc/20/26/45/387202645.db2.gz IDFNMEYROICPPP-QWHCGFSZSA-N 2 0 222.376 2.320 20 0 BEADRP COc1cccc2c1CCC[C@H]2[NH2+]CCC[NH3+] ZINC000643496761 387219486 /nfs/dbraw/zinc/21/94/86/387219486.db2.gz CVERTLGPAVYQFZ-CYBMUJFWSA-N 2 0 234.343 2.011 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[NH2+][C@H](C)C1)c1ccccc1 ZINC000423368278 387220206 /nfs/dbraw/zinc/22/02/06/387220206.db2.gz FCPUWTXTUUUBFP-BZPMIXESSA-N 2 0 218.344 2.478 20 0 BEADRP CC(C)C1CC([NH2+][C@H]2CCC[NH2+]CC2)C1 ZINC000643485088 387221164 /nfs/dbraw/zinc/22/11/64/387221164.db2.gz RTCRRPLYFBOYLF-CPCZMJQVSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@H]([NH2+][C@H]1CCC[C@H]([NH3+])C1)c1ccncc1 ZINC000423368796 387221811 /nfs/dbraw/zinc/22/18/11/387221811.db2.gz NOEWGCGQHBPYFL-IHRRRGAJSA-N 2 0 233.359 2.392 20 0 BEADRP CCOc1cccc(C[N@@H+]2CC[C@H]([NH3+])[C@H](C)C2)c1 ZINC000094339171 387223321 /nfs/dbraw/zinc/22/33/21/387223321.db2.gz QJMRYCNSBGAUPI-DOMZBBRYSA-N 2 0 248.370 2.254 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@H]1CC[C@H]1C(C)(C)C ZINC000423372967 387226260 /nfs/dbraw/zinc/22/62/60/387226260.db2.gz BREVZXPPVIMERZ-UTUOFQBUSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@H]1CC[C@H]1C(C)(C)C ZINC000423401437 387236830 /nfs/dbraw/zinc/23/68/30/387236830.db2.gz QWJJZTKNHPDGRI-NDBYEHHHSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+][C@H]1CCc2cc(F)ccc21 ZINC000423402060 387237641 /nfs/dbraw/zinc/23/76/41/387237641.db2.gz RFUUYYZHRJTFOZ-KMUNFCNLSA-N 2 0 248.345 2.401 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)[C@H]1C[C@H]1C ZINC000423419040 387248866 /nfs/dbraw/zinc/24/88/66/387248866.db2.gz IHNWFKOMZWFCOH-ITGHMWBKSA-N 2 0 224.392 2.386 20 0 BEADRP CC(C)[C@@H]([NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21)c1ccccc1 ZINC000423420643 387251187 /nfs/dbraw/zinc/25/11/87/387251187.db2.gz BSBKLRFKLKYOIE-BARDWOONSA-N 2 0 230.355 2.191 20 0 BEADRP [NH3+]C1(C[NH2+][C@H](C2CC2)C2CCC2)CCC1 ZINC000423346108 387196103 /nfs/dbraw/zinc/19/61/03/387196103.db2.gz ZIHVAXHUAGCWBD-LBPRGKRZSA-N 2 0 208.349 2.036 20 0 BEADRP CC[C@H](Cc1cccs1)[NH2+]C1CC[NH2+]CC1 ZINC000643496207 387196152 /nfs/dbraw/zinc/19/61/52/387196152.db2.gz ZXZNFOOAUXEDTP-LLVKDONJSA-N 2 0 238.400 2.411 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1CC[NH2+]C1)c1ccccc1OC ZINC000423348069 387196465 /nfs/dbraw/zinc/19/64/65/387196465.db2.gz SLHGHGLRESAWQF-OCCSQVGLSA-N 2 0 248.370 2.345 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H]1CC[NH2+]C1)c1ccccc1OC ZINC000423348070 387196632 /nfs/dbraw/zinc/19/66/32/387196632.db2.gz SLHGHGLRESAWQF-TZMCWYRMSA-N 2 0 248.370 2.345 20 0 BEADRP CC(C)C1CC([NH2+]C[C@@]2(C)CCC[NH2+]C2)C1 ZINC000423347689 387198404 /nfs/dbraw/zinc/19/84/04/387198404.db2.gz RSBJJHIRNMRWCF-RUXDESIVSA-N 2 0 224.392 2.400 20 0 BEADRP CC[C@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)[C@@H]1C[C@H]1C ZINC000423348059 387198444 /nfs/dbraw/zinc/19/84/44/387198444.db2.gz SJXDOBDJSZELOR-YIYPIFLZSA-N 2 0 224.392 2.400 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@@H]1CCC[C@@H](c2cccnc2)C1 ZINC000423464007 387312465 /nfs/dbraw/zinc/31/24/65/387312465.db2.gz LRCIUYGVTUHTID-VHDGCEQUSA-N 2 0 247.386 2.435 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H]1CCCc2c(O)cccc21 ZINC000423464365 387312680 /nfs/dbraw/zinc/31/26/80/387312680.db2.gz VUAQKWPFYCYPPS-BXUZGUMPSA-N 2 0 248.370 2.487 20 0 BEADRP Cc1cncc([C@@H](C)[NH2+][C@@H](C)CCC[NH3+])c1 ZINC000423466303 387315255 /nfs/dbraw/zinc/31/52/55/387315255.db2.gz XCSBOXWAYOEECJ-NWDGAFQWSA-N 2 0 221.348 2.168 20 0 BEADRP Cc1cc([C@@H](C)[NH2+]CCC[C@@H]2CCC[NH2+]2)no1 ZINC000423467603 387315942 /nfs/dbraw/zinc/31/59/42/387315942.db2.gz BKSOKRYHWUDLBM-VXGBXAGGSA-N 2 0 237.347 2.166 20 0 BEADRP COCC[C@@H]1CCC[C@H]1[NH2+][C@H](C)CCCC[NH3+] ZINC000423428872 387254411 /nfs/dbraw/zinc/25/44/11/387254411.db2.gz JQSAYOMNFCFLOM-HZSPNIEDSA-N 2 0 242.407 2.299 20 0 BEADRP COCC[C@@H]1CCC[C@@H]1[NH2+][C@@H](C)CCCC[NH3+] ZINC000423428874 387255572 /nfs/dbraw/zinc/25/55/72/387255572.db2.gz JQSAYOMNFCFLOM-IHRRRGAJSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]CCCC1CC1 ZINC000161717270 387259500 /nfs/dbraw/zinc/25/95/00/387259500.db2.gz JXOHPAMIXXVZAG-DYEKYZERSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCCC2CC2)CC[N@@H+]1C ZINC000161713063 387259973 /nfs/dbraw/zinc/25/99/73/387259973.db2.gz WSAYBROODFHCRM-DGCLKSJQSA-N 2 0 210.365 2.249 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@@H]1CCC[C@@H]2C[C@@]21C ZINC000423377713 387260185 /nfs/dbraw/zinc/26/01/85/387260185.db2.gz FFYIJVZUKHRVTE-LPWJVIDDSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@H]([NH2+][C@H]1CC[NH2+][C@@H](C)C1)c1ccncc1 ZINC000423384122 387267402 /nfs/dbraw/zinc/26/74/02/387267402.db2.gz QACGCKPEFBMGBP-UBHSHLNASA-N 2 0 233.359 2.263 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@H](C)[C@H]2C[C@H]2C)CC1 ZINC000321513469 387268350 /nfs/dbraw/zinc/26/83/50/387268350.db2.gz IAFFSCQSGBGVEE-BZPMIXESSA-N 2 0 224.392 2.493 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CCCC23CCC3)CC[NH2+]1 ZINC000423388041 387271800 /nfs/dbraw/zinc/27/18/00/387271800.db2.gz SXGHAGWDAKVCBN-UPJWGTAASA-N 2 0 222.376 2.439 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@H]1CC(C)(C)C[C@@H]1C ZINC000423388056 387271841 /nfs/dbraw/zinc/27/18/41/387271841.db2.gz SXNZOYBEXPKXOP-TUAOUCFPSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@H]1CCC12CCCC2 ZINC000423389753 387274123 /nfs/dbraw/zinc/27/41/23/387274123.db2.gz JQMOGUDYFBUPFX-AGIUHOORSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@H]([NH2+][C@H]2CC[NH2+]C[C@H]2C)C1 ZINC000423394077 387278012 /nfs/dbraw/zinc/27/80/12/387278012.db2.gz MRIQIWDODFCIOO-XHJNMGKDSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@H]([NH2+][C@@H]2CC[NH2+]C[C@H]2C)C1 ZINC000423394078 387279069 /nfs/dbraw/zinc/27/90/69/387279069.db2.gz MRIQIWDODFCIOO-XVIXHAIJSA-N 2 0 224.392 2.399 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@@H](C)CC(C)(C)C ZINC000423396084 387280614 /nfs/dbraw/zinc/28/06/14/387280614.db2.gz TUHAPJRYEXAPJA-WDEREUQCSA-N 2 0 200.370 2.399 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H](C)c1ccc(C)nc1C ZINC000643498995 387281442 /nfs/dbraw/zinc/28/14/42/387281442.db2.gz IVBRIHTZDXYDJG-LBPRGKRZSA-N 2 0 235.375 2.349 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)c1ccccn1 ZINC000423436411 387286471 /nfs/dbraw/zinc/28/64/71/387286471.db2.gz ZTIDQYXTLSUQFN-IHRRRGAJSA-N 2 0 247.386 2.497 20 0 BEADRP Cc1ccc([C@H]([NH2+][C@@H]2[C@H]3C[NH2+]C[C@H]32)C2CC2)cc1 ZINC000423434020 387286646 /nfs/dbraw/zinc/28/66/46/387286646.db2.gz NQIVAAIMORNMNL-XUWVNRHRSA-N 2 0 242.366 2.254 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H](C)c1ccc(F)cn1 ZINC000423438357 387288250 /nfs/dbraw/zinc/28/82/50/387288250.db2.gz RIPJGUXWZMHJBJ-MNOVXSKESA-N 2 0 239.338 2.389 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@@H](C)C1C(C)(C)C1(C)C ZINC000423440671 387289474 /nfs/dbraw/zinc/28/94/74/387289474.db2.gz AVNGMKJFCFKRDI-VHSXEESVSA-N 2 0 212.381 2.384 20 0 BEADRP CCSCC[N@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000121034034 387290867 /nfs/dbraw/zinc/29/08/67/387290867.db2.gz PLJLBKPLNICDAH-LBPRGKRZSA-N 2 0 230.421 2.013 20 0 BEADRP CC(C)[C@@H]1CCCC[C@H]1[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000423440046 387291107 /nfs/dbraw/zinc/29/11/07/387291107.db2.gz SVYNLYWINRDJGE-ODXJTPSBSA-N 2 0 222.376 2.009 20 0 BEADRP CCCCO[C@@H]1C[C@H]([NH2+][C@@H](C)[C@H](C)[NH3+])C1(C)C ZINC000423444716 387295953 /nfs/dbraw/zinc/29/59/53/387295953.db2.gz LYWQAJTWBOWGSP-ZDEQEGDKSA-N 2 0 242.407 2.296 20 0 BEADRP C[C@H]([NH3+])[C@H](C)[NH2+][C@@H]1c2ccccc2C[C@H]1C ZINC000423448586 387297137 /nfs/dbraw/zinc/29/71/37/387297137.db2.gz QOQQWFDBTSTWAL-ZHPDPMBESA-N 2 0 218.344 2.245 20 0 BEADRP CC1CC([NH2+]CC[C@@H]2CCC[N@H+](C)C2)C1 ZINC000459790941 387297847 /nfs/dbraw/zinc/29/78/47/387297847.db2.gz RCBPQPDTCZZUSA-CPCZMJQVSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]([NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21)[C@@H]1CCCC[C@H]1C ZINC000423450310 387299880 /nfs/dbraw/zinc/29/98/80/387299880.db2.gz HGQQKHNJIBLGQS-KJKVDNPUSA-N 2 0 222.376 2.009 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)[C@H](C)[NH3+])C1C(C)(C)C1(C)C ZINC000423454101 387301341 /nfs/dbraw/zinc/30/13/41/387301341.db2.gz YNUKTQGSEXVMOL-LPEHRKFASA-N 2 0 212.381 2.382 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]Cc1ccc2c(c1)CCCN2 ZINC000423453166 387301772 /nfs/dbraw/zinc/30/17/72/387301772.db2.gz XIDMOAIQWXENAV-LBPRGKRZSA-N 2 0 247.386 2.262 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)c1ccoc1 ZINC000583257681 387305116 /nfs/dbraw/zinc/30/51/16/387305116.db2.gz QLYOVHWFWHGKOR-DDTOSNHZSA-N 2 0 234.343 2.318 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@@H](Cc1ccccc1)C1CC1 ZINC000423457460 387307263 /nfs/dbraw/zinc/30/72/63/387307263.db2.gz FTCSWFBXBMPFAX-CABCVRRESA-N 2 0 232.371 2.335 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[C@H]([NH3+])C1)[C@H]1C[C@H]1C ZINC000423461392 387309009 /nfs/dbraw/zinc/30/90/09/387309009.db2.gz CISOZPMWAAEDQD-MOLYVOAJSA-N 2 0 210.365 2.138 20 0 BEADRP CCC[C@H](C)[C@@H](CC)[NH2+]C[C@H]1C[NH2+]CCCO1 ZINC000423519632 387354250 /nfs/dbraw/zinc/35/42/50/387354250.db2.gz PMGYUFITMUDPSJ-BFHYXJOUSA-N 2 0 242.407 2.169 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@@H]2CC[C@@H]2SC)CC1 ZINC000515298896 387358706 /nfs/dbraw/zinc/35/87/06/387358706.db2.gz WKDREZSKGMNBRP-OLZOCXBDSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@H]([NH2+]CCC1=CC[NH2+]CC1)c1ccncc1 ZINC000423539629 387366141 /nfs/dbraw/zinc/36/61/41/387366141.db2.gz OZYLMWQWIODVGM-LBPRGKRZSA-N 2 0 231.343 2.042 20 0 BEADRP CCC[C@@H](N[C@H](C)C1C[NH2+]C1)c1ccccn1 ZINC000643453403 387369500 /nfs/dbraw/zinc/36/95/00/387369500.db2.gz QFBGVMYKUVGYQZ-BXUZGUMPSA-N 2 0 233.359 2.120 20 0 BEADRP CC[C@@H]1C[C@H]([NH2+][C@@H](C)[C@@H]2CCCC[NH2+]2)CCO1 ZINC000423545637 387369549 /nfs/dbraw/zinc/36/95/49/387369549.db2.gz JTDVKFWQQZYODZ-DGAVXFQQSA-N 2 0 240.391 2.064 20 0 BEADRP CC[C@H]([NH2+]CCC[NH2+]C1CC1)[C@@H]1C[C@H]1C ZINC000423546522 387369796 /nfs/dbraw/zinc/36/97/96/387369796.db2.gz FLERSVUMBYSYSQ-RTXFEEFZSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1Cc2ccccc21)[C@H]1CCCC[NH2+]1 ZINC000643453503 387370017 /nfs/dbraw/zinc/37/00/17/387370017.db2.gz IQMQTKVHEMHWBL-IVMMDQJWSA-N 2 0 244.382 2.447 20 0 BEADRP CC[C@@H]1C[C@H]([NH2+][C@@H]2CCCCC[C@@H]2[NH3+])CCO1 ZINC000423554059 387372223 /nfs/dbraw/zinc/37/22/23/387372223.db2.gz RGMLGIXQYGVVNJ-YIYPIFLZSA-N 2 0 240.391 2.194 20 0 BEADRP C(C[NH2+]C1CC1)C[NH2+][C@H]1CCCC12CCC2 ZINC000423550952 387372790 /nfs/dbraw/zinc/37/27/90/387372790.db2.gz IUUBNLRXIKMPNR-ZDUSSCGKSA-N 2 0 222.376 2.441 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCCC[NH2+]C1)[C@H]1C[C@@H]1C ZINC000423557698 387375541 /nfs/dbraw/zinc/37/55/41/387375541.db2.gz NNWLFXHMKXNBQH-RNJOBUHISA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@H]1C[C@@H]([NH2+]C2CCC(C[NH3+])CC2)CCO1 ZINC000423561336 387376881 /nfs/dbraw/zinc/37/68/81/387376881.db2.gz VVTHWVUBKOADOH-HOAMVYINSA-N 2 0 240.391 2.051 20 0 BEADRP CCCC[C@H](C)[NH2+]CCC1=CC[NH2+]CC1 ZINC000423563855 387378015 /nfs/dbraw/zinc/37/80/15/387378015.db2.gz ROFJROUHTBGXSK-LBPRGKRZSA-N 2 0 210.365 2.465 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@H]1c2ccccc2C[C@@H]1C ZINC000423478384 387324231 /nfs/dbraw/zinc/32/42/31/387324231.db2.gz UNLUCFRVKDJROG-VHRBIJSZSA-N 2 0 218.344 2.247 20 0 BEADRP C[NH+](C)CCCC[NH2+]C1CC(OC(C)(C)C)C1 ZINC000352557982 387324436 /nfs/dbraw/zinc/32/44/36/387324436.db2.gz SSALWMIGFXKGAY-UHFFFAOYSA-N 2 0 242.407 2.264 20 0 BEADRP COc1ccccc1[C@H](C)[NH2+][C@H]1CC[C@@H](C[NH3+])C1 ZINC000423491652 387335177 /nfs/dbraw/zinc/33/51/77/387335177.db2.gz KEJGVJJCBAPXEL-XQQFMLRXSA-N 2 0 248.370 2.473 20 0 BEADRP CC(C)[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])C1)c1cccnc1 ZINC000423491903 387336191 /nfs/dbraw/zinc/33/61/91/387336191.db2.gz KRVFQOTZGBWVSR-QEJZJMRPSA-N 2 0 247.386 2.496 20 0 BEADRP C[C@@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1ccco1 ZINC000423491532 387336601 /nfs/dbraw/zinc/33/66/01/387336601.db2.gz ZINZNJSQJBQWPT-VXGBXAGGSA-N 2 0 222.332 2.462 20 0 BEADRP Cc1nc([C@H](C)[NH2+][C@@H]2CC[C@H](C[NH3+])C2)cs1 ZINC000423493557 387337688 /nfs/dbraw/zinc/33/76/88/387337688.db2.gz BVWYNUIDJNSPIN-INTQDDNPSA-N 2 0 239.388 2.230 20 0 BEADRP CCC[C@@H]([NH2+]C[C@H]1C[NH2+]CCCO1)C(C)(C)C ZINC000423495705 387338851 /nfs/dbraw/zinc/33/88/51/387338851.db2.gz UZZAQJOSCSPFDD-CHWSQXEVSA-N 2 0 242.407 2.169 20 0 BEADRP C[C@@H]1C[C@H]1C[N@@H+]1CC[C@@]2(C1)CCC[NH+](C)C2 ZINC000354178731 387340327 /nfs/dbraw/zinc/34/03/27/387340327.db2.gz XQLVYIOZKBFTPA-RDBSUJKOSA-N 2 0 222.376 2.060 20 0 BEADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@H]2CCCC23CCC3)C1 ZINC000423500828 387340886 /nfs/dbraw/zinc/34/08/86/387340886.db2.gz JARAHUCXPXDBSD-UPJWGTAASA-N 2 0 222.376 2.426 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[C@@H](C[NH3+])C1)C1CCC1 ZINC000423499184 387341416 /nfs/dbraw/zinc/34/14/16/387341416.db2.gz HNVYOVCXHUDRMY-RTXFEEFZSA-N 2 0 210.365 2.282 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H](C)[C@H]1C[C@H]1C ZINC000322002899 387346865 /nfs/dbraw/zinc/34/68/65/387346865.db2.gz HDLLEAMLQZYHLW-UPJWGTAASA-N 2 0 212.381 2.352 20 0 BEADRP CCC[C@H](C)[C@H](CC)[NH2+]C[C@H]1C[NH2+]CCCO1 ZINC000423520035 387352205 /nfs/dbraw/zinc/35/22/05/387352205.db2.gz PMGYUFITMUDPSJ-MJBXVCDLSA-N 2 0 242.407 2.169 20 0 BEADRP CCCN(CC)C[C@@H](C)[NH2+][C@H]1CCOC[C@H]1C ZINC000515859441 387430934 /nfs/dbraw/zinc/43/09/34/387430934.db2.gz RNBUGZRFWBLHMN-MCIONIFRSA-N 2 0 242.407 2.121 20 0 BEADRP COCC1(CC[NH2+][C@@H]2CCCCC[C@@H]2[NH3+])CC1 ZINC000515846276 387435765 /nfs/dbraw/zinc/43/57/65/387435765.db2.gz LOHGELYJKIGCEX-QWHCGFSZSA-N 2 0 240.391 2.053 20 0 BEADRP C[N@H+]1CC=C(C[NH2+]Cc2ccccc2)CC1 ZINC000271789764 387447140 /nfs/dbraw/zinc/44/71/40/387447140.db2.gz GISNCLLHUYZECU-UHFFFAOYSA-N 2 0 216.328 2.038 20 0 BEADRP CC[C@H](Cc1cccs1)[NH2+]C[C@@H]1CCC[NH2+]1 ZINC000643505739 387453586 /nfs/dbraw/zinc/45/35/86/387453586.db2.gz ZYBFCWLILAHJQD-NEPJUHHUSA-N 2 0 238.400 2.411 20 0 BEADRP CC[C@H](Cc1cccs1)[NH2+]C[C@H]1CCC[NH2+]1 ZINC000643505742 387453720 /nfs/dbraw/zinc/45/37/20/387453720.db2.gz ZYBFCWLILAHJQD-VXGBXAGGSA-N 2 0 238.400 2.411 20 0 BEADRP CC(C)(C[NH2+][C@@H]1CCC[C@H]1[NH3+])[C@@H]1CCCCO1 ZINC000643466639 387388631 /nfs/dbraw/zinc/38/86/31/387388631.db2.gz JYRJEMKWEAHLRI-UPJWGTAASA-N 2 0 240.391 2.051 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]C[C@H](C)C(C)(C)C ZINC000643455205 387390929 /nfs/dbraw/zinc/39/09/29/387390929.db2.gz GOPYPALBKMLZEJ-GARJFASQSA-N 2 0 200.370 2.384 20 0 BEADRP C[C@@H]([NH2+]C1(c2ccc(F)cc2)CCC1)C1C[NH2+]C1 ZINC000643467790 387407158 /nfs/dbraw/zinc/40/71/58/387407158.db2.gz KNKRRXUOYQRLSF-LLVKDONJSA-N 2 0 248.345 2.402 20 0 BEADRP C[C@@H](C[NH2+][C@H](C)[C@H]1CCCC[NH2+]1)C1CC1 ZINC000643468282 387418138 /nfs/dbraw/zinc/41/81/38/387418138.db2.gz IBILQXKYVZLGMM-DMDPSCGWSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC[NH2+]CC[C@@H]1C)C1CC1 ZINC000643468334 387418779 /nfs/dbraw/zinc/41/87/79/387418779.db2.gz QLXGMZYGROJWIK-LOWVWBTDSA-N 2 0 210.365 2.010 20 0 BEADRP CC[C@@H]([NH2+]C[C@H](C)C1CC1)[C@@H]1CCC[NH2+]1 ZINC000643468351 387419042 /nfs/dbraw/zinc/41/90/42/387419042.db2.gz SYEDNKKBLJKCDK-UHTWSYAYSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)(C)CCC[N@@H+]1CC[C@@]2(CC[NH2+]C2)C1 ZINC000304598015 387494529 /nfs/dbraw/zinc/49/45/29/387494529.db2.gz QEDQSSXKOFCJQI-CQSZACIVSA-N 2 0 224.392 2.498 20 0 BEADRP CC(C)(C)CCC[N@@H+]1CC[C@]2(CC[NH2+]C2)C1 ZINC000304598009 387495344 /nfs/dbraw/zinc/49/53/44/387495344.db2.gz QEDQSSXKOFCJQI-AWEZNQCLSA-N 2 0 224.392 2.498 20 0 BEADRP Cc1n[nH]cc1[C@@H](C)NC[C@@H]([NH3+])c1ccccc1 ZINC000643508856 387498852 /nfs/dbraw/zinc/49/88/52/387498852.db2.gz JAPOXYAENZSWBM-QMTHXVAHSA-N 2 0 244.342 2.069 20 0 BEADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+]C2CCSCC2)C1 ZINC000040622658 387500000 /nfs/dbraw/zinc/50/00/00/387500000.db2.gz GBLVZYISLAPOAF-LBPRGKRZSA-N 2 0 242.432 2.202 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@H](C2CC2)C2CCC2)CC1 ZINC000324685873 387500830 /nfs/dbraw/zinc/50/08/30/387500830.db2.gz SNBWJGHVYKTJRD-HNNXBMFYSA-N 2 0 236.403 2.497 20 0 BEADRP COC(C)(C)[C@@H](C)[NH2+]CCC1CC[NH+](C)CC1 ZINC000310059879 387534402 /nfs/dbraw/zinc/53/44/02/387534402.db2.gz BLXVLYAMWHTZJU-GFCCVEGCSA-N 2 0 242.407 2.121 20 0 BEADRP CC(C)[NH2+]CCCN[C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000643508499 387486339 /nfs/dbraw/zinc/48/63/39/387486339.db2.gz TWORRUOCINUWMI-LSDHHAIUSA-N 2 0 247.386 2.109 20 0 BEADRP CC(C)[NH2+]CCCN[C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000643508497 387486777 /nfs/dbraw/zinc/48/67/77/387486777.db2.gz TWORRUOCINUWMI-GJZGRUSLSA-N 2 0 247.386 2.109 20 0 BEADRP CC[C@@H](Cc1cccs1)[NH2+]CC(C)(C)[NH3+] ZINC000643513118 387596925 /nfs/dbraw/zinc/59/69/25/387596925.db2.gz ISHFNKREZWVGJW-JTQLQIEISA-N 2 0 226.389 2.396 20 0 BEADRP CCCCOCCN1CC[C@H](C[N@H+](C)CC)C1 ZINC000362348478 387597823 /nfs/dbraw/zinc/59/78/23/387597823.db2.gz JIGVCGGBLAOXQY-CQSZACIVSA-N 2 0 242.407 2.077 20 0 BEADRP CC(C)C[N@@H+]1CCCC2(CC[NH+](C)CC2)C1 ZINC000375998371 387599500 /nfs/dbraw/zinc/59/95/00/387599500.db2.gz GEPZXZVWHGBHFN-UHFFFAOYSA-N 2 0 224.392 2.450 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@H]1CCc2c1cc(F)cc2F ZINC000643514848 387599844 /nfs/dbraw/zinc/59/98/44/387599844.db2.gz QHBQOCDLMILPKE-SDBXPKJASA-N 2 0 240.297 2.137 20 0 BEADRP COc1cccc([C@H](C)[NH2+][C@@H](C)C[C@@H](C)[NH3+])c1 ZINC000422714722 387628927 /nfs/dbraw/zinc/62/89/27/387628927.db2.gz RIQDJJREDJPIRV-WOPDTQHZSA-N 2 0 236.359 2.472 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CCO[C@H]1CCCC[C@H]1C ZINC000422716306 387629312 /nfs/dbraw/zinc/62/93/12/387629312.db2.gz UGFHHGCJQSPTBO-RFGFWPKPSA-N 2 0 242.407 2.297 20 0 BEADRP C[C@H]([NH3+])[C@H](Cc1ccccc1)[NH2+]C[C@@H]1C[C@@H]1C ZINC000422703610 387618326 /nfs/dbraw/zinc/61/83/26/387618326.db2.gz NOHSNAPWVHTFMR-JURCDPSOSA-N 2 0 232.371 2.191 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@@H](C)C1)[C@H]1CCC[NH2+]1 ZINC000422702787 387619285 /nfs/dbraw/zinc/61/92/85/387619285.db2.gz LPLFJCSAWJOUJS-YVECIDJPSA-N 2 0 210.365 2.295 20 0 BEADRP Clc1cccc2c1CC[C@@H]2[NH2+]CC1C[NH2+]C1 ZINC000643516035 387620068 /nfs/dbraw/zinc/62/00/68/387620068.db2.gz PPCBTGFRACLZEN-ZDUSSCGKSA-N 2 0 236.746 2.136 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+][C@H]1[C@H](C)CCC[C@@H]1C ZINC000422708771 387623534 /nfs/dbraw/zinc/62/35/34/387623534.db2.gz YEJHWSODOFMDLG-RFQIPJPRSA-N 2 0 242.407 2.155 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CCO[C@@H]1CCCC[C@H]1C ZINC000422711436 387624807 /nfs/dbraw/zinc/62/48/07/387624807.db2.gz NCIWDGGMNUOZLP-MGPQQGTHSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@H]([NH2+]CCCC[NH3+])c1cc(F)ccc1F ZINC000037714997 387565136 /nfs/dbraw/zinc/56/51/36/387565136.db2.gz CWXKSVIQVNELPF-VIFPVBQESA-N 2 0 228.286 2.354 20 0 BEADRP C[C@@H](Cc1cccs1)[NH2+]C[C@H]([NH3+])C1CC1 ZINC000643516559 387627869 /nfs/dbraw/zinc/62/78/69/387627869.db2.gz SBOJZXAVVLYRSO-CABZTGNLSA-N 2 0 224.373 2.006 20 0 BEADRP CC[C@@H](C[NH2+][C@@H](C)C1C[NH2+]C1)c1ccccc1 ZINC000422716454 387627916 /nfs/dbraw/zinc/62/79/16/387627916.db2.gz NEFLZPJNLFSJNR-STQMWFEESA-N 2 0 232.371 2.378 20 0 BEADRP Cc1cccc(C(C)(C)C[NH2+][C@H](C)C2C[NH2+]C2)c1 ZINC000422792424 387694508 /nfs/dbraw/zinc/69/45/08/387694508.db2.gz ZDNPQPSTKNQKPD-CYBMUJFWSA-N 2 0 246.398 2.470 20 0 BEADRP CN(CC[N@H+](C)CC(C)(C)C[NH3+])c1ccccc1 ZINC000430590742 387630598 /nfs/dbraw/zinc/63/05/98/387630598.db2.gz LXMZLQAFQCZCLK-UHFFFAOYSA-N 2 0 249.402 2.040 20 0 BEADRP Cc1ccc(CCN2CC[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000430590003 387631786 /nfs/dbraw/zinc/63/17/86/387631786.db2.gz JPEDFYJIXLWZJZ-CVEARBPZSA-N 2 0 244.382 2.364 20 0 BEADRP CC(C)[C@@H]1CCC[C@H]([NH2+][C@H](C)C2C[NH2+]C2)C1 ZINC000422722237 387632396 /nfs/dbraw/zinc/63/23/96/387632396.db2.gz XHLVEIOHEXDYKY-BZPMIXESSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCCC[C@H]1C)[C@H]1CCC[NH2+]1 ZINC000422726823 387635177 /nfs/dbraw/zinc/63/51/77/387635177.db2.gz GAMKZSUXASMUTL-FDYHWXHSSA-N 2 0 210.365 2.295 20 0 BEADRP C[NH+](C)[C@H]1CCC[N@H+](C[C@H]2CCC=CO2)CC1 ZINC000376475693 387637685 /nfs/dbraw/zinc/63/76/85/387637685.db2.gz BPNLQFIYHSROMQ-UONOGXRCSA-N 2 0 238.375 2.095 20 0 BEADRP [NH3+][C@H]1CCCCC[C@H]1[NH2+]CCC1CCOCC1 ZINC000422734385 387642911 /nfs/dbraw/zinc/64/29/11/387642911.db2.gz SELVTTAGCNOMDZ-UONOGXRCSA-N 2 0 240.391 2.053 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H](C)C[C@H](C)[NH3+] ZINC000422736013 387643520 /nfs/dbraw/zinc/64/35/20/387643520.db2.gz VMLJCKQWDAKJLG-MELADBBJSA-N 3 0 243.439 2.212 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H](C)Cc1ccccc1F ZINC000422739695 387646716 /nfs/dbraw/zinc/64/67/16/387646716.db2.gz LZHXNHACBVJSQH-SRVKXCTJSA-N 2 0 238.350 2.472 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)[C@@H]1C[C@H]1C1CC1 ZINC000527636763 387647315 /nfs/dbraw/zinc/64/73/15/387647315.db2.gz DPTFUOZMFVDAFT-KNPMLCFXSA-N 2 0 248.414 2.495 20 0 BEADRP CCCC[C@@H](CC)C[NH2+][C@H](C)C1C[NH2+]C1 ZINC000422741444 387647412 /nfs/dbraw/zinc/64/74/12/387647412.db2.gz DRHQUVFSAKHYDU-VXGBXAGGSA-N 2 0 212.381 2.400 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]CCc1ccccc1Cl ZINC000422788510 387653748 /nfs/dbraw/zinc/65/37/48/387653748.db2.gz VMARNGRWBIDXOS-CHWSQXEVSA-N 2 0 238.762 2.352 20 0 BEADRP Cc1ccc(OCC[NH2+][C@@H]2CCC[C@H]2C[NH3+])cc1 ZINC000422757437 387660393 /nfs/dbraw/zinc/66/03/93/387660393.db2.gz MUBCAQRKROLPJD-DZGCQCFKSA-N 2 0 248.370 2.091 20 0 BEADRP Cc1ccccc1OCCC[N@@H+]1CC[C@@H](C[NH3+])C1 ZINC000430924292 387660590 /nfs/dbraw/zinc/66/05/90/387660590.db2.gz AATSZAWQOYAEAX-AWEZNQCLSA-N 2 0 248.370 2.045 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CCSc1ccccc1 ZINC000422756381 387660959 /nfs/dbraw/zinc/66/09/59/387660959.db2.gz CHLLERLFWYRZCJ-NWDGAFQWSA-N 2 0 238.400 2.494 20 0 BEADRP Cc1ccc(C[C@H](C)[NH2+][C@@H](C)C2C[NH2+]C2)s1 ZINC000422757310 387660965 /nfs/dbraw/zinc/66/09/65/387660965.db2.gz HUZMYKBLTROEOF-ONGXEEELSA-N 2 0 238.400 2.185 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]CCCNc1ccccc1 ZINC000422758292 387661128 /nfs/dbraw/zinc/66/11/28/387661128.db2.gz NTUWHNNAOOTXKS-DZGCQCFKSA-N 2 0 247.386 2.206 20 0 BEADRP CCc1ccc(CC[N@@H+]2CC[C@@H](C[NH3+])C2)cc1 ZINC000430924475 387661758 /nfs/dbraw/zinc/66/17/58/387661758.db2.gz IHYWJEMLJLRUAW-HNNXBMFYSA-N 2 0 232.371 2.072 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]CCOc1ccccc1 ZINC000422761199 387663714 /nfs/dbraw/zinc/66/37/14/387663714.db2.gz QWEODVWJDSIJAE-UKRRQHHQSA-N 2 0 248.370 2.043 20 0 BEADRP CC[C@@H]([NH2+]CCc1cccs1)[C@@H]1CCC[NH2+]1 ZINC000422763660 387665208 /nfs/dbraw/zinc/66/52/08/387665208.db2.gz UHZBOSNGWGKFNO-OLZOCXBDSA-N 2 0 238.400 2.411 20 0 BEADRP CS[C@@H]1CCC[C@H]([NH2+][C@@H]2CCC[C@H]2[NH3+])C1 ZINC000422770716 387669419 /nfs/dbraw/zinc/66/94/19/387669419.db2.gz XAMVGQVREDIVBB-IRCOFANPSA-N 2 0 228.405 2.130 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCc2nc[nH]c2C1)[C@@H]1C[C@H]1C1CC1 ZINC000527714010 387670083 /nfs/dbraw/zinc/67/00/83/387670083.db2.gz YDJWVYMNYCHPOS-XEZLXBQYSA-N 2 0 245.370 2.291 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]Cc1ccccc1F ZINC000422771601 387670157 /nfs/dbraw/zinc/67/01/57/387670157.db2.gz XLLIERXGFDBVSV-NXEZZACHSA-N 2 0 210.296 2.041 20 0 BEADRP CCO[C@@H]1C[C@H]([NH2+][C@@H](C)C[C@H](C)[NH3+])C12CCC2 ZINC000422777108 387675372 /nfs/dbraw/zinc/67/53/72/387675372.db2.gz FFLGLHAAIDSROU-ZDEQEGDKSA-N 2 0 240.391 2.050 20 0 BEADRP C[NH+](C)CCC[NH2+]C1CCC2(CCCO2)CC1 ZINC000376956960 387681091 /nfs/dbraw/zinc/68/10/91/387681091.db2.gz UIWCRMIDWZGGAF-UHFFFAOYSA-N 2 0 240.391 2.020 20 0 BEADRP CO[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)CCCC[NH3+] ZINC000422783446 387683096 /nfs/dbraw/zinc/68/30/96/387683096.db2.gz HLARJZUWOGBQBA-YNEHKIRRSA-N 2 0 228.380 2.051 20 0 BEADRP [NH3+]C[C@H]1CCC[N@H+](CCCOc2ccccc2)C1 ZINC000044530184 387684800 /nfs/dbraw/zinc/68/48/00/387684800.db2.gz GBEXMMYXBDXPIX-CQSZACIVSA-N 2 0 248.370 2.126 20 0 BEADRP C[C@@H]([NH2+]C[C@@H](C)Cc1cccs1)C1C[NH2+]C1 ZINC000422787681 387685773 /nfs/dbraw/zinc/68/57/73/387685773.db2.gz UWXVEIIILVOPBN-WDEREUQCSA-N 2 0 238.400 2.124 20 0 BEADRP C[C@@H]([NH2+]CC1CC[NH+](C)CC1)c1cccc(O)c1 ZINC000044515727 387686021 /nfs/dbraw/zinc/68/60/21/387686021.db2.gz JEZNXLYWAKRSKY-GFCCVEGCSA-N 2 0 248.370 2.385 20 0 BEADRP C[C@@H](C[NH2+][C@H](C)C1C[NH2+]C1)Cc1cccs1 ZINC000422787678 387686313 /nfs/dbraw/zinc/68/63/13/387686313.db2.gz UWXVEIIILVOPBN-GHMZBOCLSA-N 2 0 238.400 2.124 20 0 BEADRP CCOc1cccc([C@@H](C)[NH2+]C2CC[NH2+]CC2)c1 ZINC000422786167 387686650 /nfs/dbraw/zinc/68/66/50/387686650.db2.gz SGXIYGBMHOVXQE-GFCCVEGCSA-N 2 0 248.370 2.488 20 0 BEADRP CC[C@@H](F)CN1CC[C@H](C[NH+]2CCCC2)C1 ZINC000440771961 387688717 /nfs/dbraw/zinc/68/87/17/387688717.db2.gz SWAQDLJBPFVJAZ-CHWSQXEVSA-N 2 0 228.355 2.152 20 0 BEADRP COc1ccc(CCC[NH2+][C@@H]2CCC[C@H]2[NH3+])cc1 ZINC000422744180 387689751 /nfs/dbraw/zinc/68/97/51/387689751.db2.gz VQBMRVHXQNUSKX-HUUCEWRRSA-N 2 0 248.370 2.097 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCC[C@@H]1[NH3+])c1ccc(F)cc1 ZINC000422744190 387690984 /nfs/dbraw/zinc/69/09/84/387690984.db2.gz SOGZBOHENDYSGU-DDTOSNHZSA-N 2 0 236.334 2.399 20 0 BEADRP Cc1cc(C)c(C[NH2+][C@H](C)C2C[NH2+]C2)c(C)c1 ZINC000422792517 387693849 /nfs/dbraw/zinc/69/38/49/387693849.db2.gz ZIXUIDASHZZIHS-CYBMUJFWSA-N 2 0 232.371 2.309 20 0 BEADRP CO[C@H](C)[C@@H](C)[NH2+]CCC[NH+]1CCC(C)CC1 ZINC000128592624 387750469 /nfs/dbraw/zinc/75/04/69/387750469.db2.gz SBKDAWBAJXUAMZ-ZIAGYGMSSA-N 2 0 242.407 2.121 20 0 BEADRP CC[C@H]1CCC[C@@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000422872308 387752456 /nfs/dbraw/zinc/75/24/56/387752456.db2.gz GNVKNQUDYPHVDQ-MWWBDVBNSA-N 2 0 222.376 2.438 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)[C@@H]1CC12CC2 ZINC000527846513 387752666 /nfs/dbraw/zinc/75/26/66/387752666.db2.gz FPKRAKOIHQRHSD-SCRDCRAPSA-N 2 0 234.387 2.249 20 0 BEADRP CC(C)CC1(C[NH2+][C@@H](C)C2C[NH2+]C2)CCC1 ZINC000422879594 387754247 /nfs/dbraw/zinc/75/42/47/387754247.db2.gz VOYUJIPVQXHWDU-LBPRGKRZSA-N 2 0 224.392 2.400 20 0 BEADRP Cc1ccc(C[NH2+][C@H](C)C[C@@H](C)[NH3+])cc1F ZINC000422800191 387699766 /nfs/dbraw/zinc/69/97/66/387699766.db2.gz ZNMKABDWVCFMIT-GHMZBOCLSA-N 2 0 224.323 2.350 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@H]1CCc2ccccc21 ZINC000422799510 387700188 /nfs/dbraw/zinc/70/01/88/387700188.db2.gz XCEPZKVALARYFS-MJVIPROJSA-N 2 0 218.344 2.389 20 0 BEADRP C[C@@H]([NH2+][C@H](c1ccccc1)C1CC1)C1C[NH2+]C1 ZINC000422805061 387703087 /nfs/dbraw/zinc/70/30/87/387703087.db2.gz LOVUNPZMVQEPJB-IAQYHMDHSA-N 2 0 230.355 2.335 20 0 BEADRP CCO[C@H](CC[NH2+][C@@H](C)C[C@@H](C)[NH3+])C(C)C ZINC000422810822 387707182 /nfs/dbraw/zinc/70/71/82/387707182.db2.gz NYJSDEVNFYZRCQ-FRRDWIJNSA-N 2 0 230.396 2.153 20 0 BEADRP Cc1ccc2[nH]c(C[NH2+][C@H](C)CCC[NH3+])nc2c1 ZINC000422808681 387707912 /nfs/dbraw/zinc/70/79/12/387707912.db2.gz LIMXSXQTWGXPPV-LLVKDONJSA-N 2 0 246.358 2.088 20 0 BEADRP CO[C@H](C[NH2+][C@H](C)CCCC[NH3+])C(C)(C)C ZINC000422812127 387710790 /nfs/dbraw/zinc/71/07/90/387710790.db2.gz PYALAPYLOZYXGG-VXGBXAGGSA-N 2 0 230.396 2.155 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC(C)(C)C[C@H]1C)C1C[NH2+]C1 ZINC000422819917 387716562 /nfs/dbraw/zinc/71/65/62/387716562.db2.gz OJULRAXHLHMGNQ-MDZLAQPJSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@H]([NH2+]CCCOC1CCCC1)[C@@H]1CCC[NH2+]1 ZINC000422822891 387717583 /nfs/dbraw/zinc/71/75/83/387717583.db2.gz BSTMORMGLDEYGK-JSGCOSHPSA-N 2 0 240.391 2.066 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCC[NH2+]CC1)[C@@H]1C[C@@H]1C ZINC000643522965 387724417 /nfs/dbraw/zinc/72/44/17/387724417.db2.gz QSIIMYCWLIVITC-LOWDOPEQSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]C[C@@H]2CC[C@@H](C)O2)CC1 ZINC000127735714 387726640 /nfs/dbraw/zinc/72/66/40/387726640.db2.gz XEYDMXWZGFMNJA-OCCSQVGLSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCCC1(C)C)[C@@H]1CCC[NH2+]1 ZINC000422839646 387727745 /nfs/dbraw/zinc/72/77/45/387727745.db2.gz RAVSBGBICMONQP-WOPDTQHZSA-N 2 0 210.365 2.295 20 0 BEADRP COC1CCC(C[NH2+][C@H](C)CCCC[NH3+])CC1 ZINC000422842900 387733054 /nfs/dbraw/zinc/73/30/54/387733054.db2.gz ZMQMOCZKIHDYHY-IYXRBSQSSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@@H]([NH2+][C@@H](c1cccs1)C1CC1)C1C[NH2+]C1 ZINC000422789716 387733295 /nfs/dbraw/zinc/73/32/95/387733295.db2.gz BMKXHOXDJRSPNV-NOZJJQNGSA-N 2 0 236.384 2.397 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@@H]([NH3+])C1)c1ccoc1 ZINC000643523951 387733623 /nfs/dbraw/zinc/73/36/23/387733623.db2.gz PMNHFGBUSYHAKF-MVWJERBFSA-N 2 0 208.305 2.200 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@@H]([NH3+])C1)c1ccoc1 ZINC000643523952 387733714 /nfs/dbraw/zinc/73/37/14/387733714.db2.gz PMNHFGBUSYHAKF-WCQGTBRESA-N 2 0 208.305 2.200 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]C[C@@H](C)N(C)c1ccccc1 ZINC000422854839 387737056 /nfs/dbraw/zinc/73/70/56/387737056.db2.gz DEJGPWOTURRERG-ZIAGYGMSSA-N 2 0 249.402 2.228 20 0 BEADRP CC[C@@H]([NH2+][C@@H](CCC[NH3+])COC)C(C)(C)C ZINC000422856448 387741874 /nfs/dbraw/zinc/74/18/74/387741874.db2.gz FKBLDRYHJDBIBV-NWDGAFQWSA-N 2 0 230.396 2.155 20 0 BEADRP CCC1(C[NH2+][C@@H](C)C2C[NH2+]C2)CCCC1 ZINC000422892189 387762418 /nfs/dbraw/zinc/76/24/18/387762418.db2.gz XRFPOWODQYSMAE-NSHDSACASA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1CCC[C@@H]2OCC[C@H]21 ZINC000422890116 387763489 /nfs/dbraw/zinc/76/34/89/387763489.db2.gz RFXMTTFTFNJWRM-RQJABVFESA-N 2 0 240.391 2.051 20 0 BEADRP Cc1cccnc1[C@@H]1CCC[C@H]([NH2+]C[C@@H](C)[NH3+])C1 ZINC000643527104 387763672 /nfs/dbraw/zinc/76/36/72/387763672.db2.gz JWWLTLMQPKXCKG-MCIONIFRSA-N 2 0 247.386 2.353 20 0 BEADRP CC[C@H]([NH2+]CC1CCCC1)[C@@H]1CCC[NH2+]1 ZINC000422894770 387765845 /nfs/dbraw/zinc/76/58/45/387765845.db2.gz DFUKUYHHTJPJSD-STQMWFEESA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]([NH3+])C[NH2+][C@@H](C)CCCC(F)(F)F ZINC000643527584 387766443 /nfs/dbraw/zinc/76/64/43/387766443.db2.gz OSWWBWTVZRDGFM-YUMQZZPRSA-N 2 0 212.259 2.044 20 0 BEADRP Cc1nc(CC[NH2+][C@H](C)CCC[NH3+])sc1C ZINC000422896657 387766625 /nfs/dbraw/zinc/76/66/25/387766625.db2.gz YLTNQALXEFMWJW-SECBINFHSA-N 2 0 241.404 2.019 20 0 BEADRP C[C@H]([NH3+])C[NH2+][C@@H]1CC[C@H](Cc2ccccc2)C1 ZINC000643527700 387768380 /nfs/dbraw/zinc/76/83/80/387768380.db2.gz RFJWEQKFZFNMTM-NWANDNLSSA-N 2 0 232.371 2.335 20 0 BEADRP C[C@H]([NH3+])C[NH2+][C@H]1CCCCc2ccccc21 ZINC000643528682 387770783 /nfs/dbraw/zinc/77/07/83/387770783.db2.gz MUXAACBHMPTKCU-FZMZJTMJSA-N 2 0 218.344 2.391 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]C[C@@H]1CCc2ccccc21 ZINC000422912308 387771131 /nfs/dbraw/zinc/77/11/31/387771131.db2.gz VXTQRKMODQERPE-SCRDCRAPSA-N 2 0 232.371 2.432 20 0 BEADRP C[C@@H]([NH3+])C[NH2+][C@H](C)CCc1ccc(F)cc1 ZINC000643529029 387771370 /nfs/dbraw/zinc/77/13/70/387771370.db2.gz SZELAAFIKWTLKJ-GHMZBOCLSA-N 2 0 224.323 2.084 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]CCCc1cccc(F)c1 ZINC000422912260 387771435 /nfs/dbraw/zinc/77/14/35/387771435.db2.gz VRIFESDIXJTHIQ-ZIAGYGMSSA-N 2 0 236.334 2.228 20 0 BEADRP CC(C)[C@H]1CC[C@@H]([NH2+]C[C@H](C)[NH3+])C[C@H]1C ZINC000643529176 387771554 /nfs/dbraw/zinc/77/15/54/387771554.db2.gz WMCWQEBZJUULCR-YVECIDJPSA-N 2 0 212.381 2.384 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]C[C@H]1CCc2ccccc21 ZINC000422912307 387771650 /nfs/dbraw/zinc/77/16/50/387771650.db2.gz VXTQRKMODQERPE-OUCADQQQSA-N 2 0 232.371 2.432 20 0 BEADRP C[C@@H]([NH2+][C@H](Cc1ccccc1)C1CC1)C1C[NH2+]C1 ZINC000422914464 387771956 /nfs/dbraw/zinc/77/19/56/387771956.db2.gz UHVSOIBVGFFPLC-MLGOLLRUSA-N 2 0 244.382 2.205 20 0 BEADRP Cc1ccc(C[C@@H]([NH2+]C[C@@H](C)[NH3+])C2CC2)cc1 ZINC000643529062 387773012 /nfs/dbraw/zinc/77/30/12/387773012.db2.gz UFPJBUFHJLDTCJ-IUODEOHRSA-N 2 0 232.371 2.253 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]Cc1cnc2ccccc2c1 ZINC000422915794 387774122 /nfs/dbraw/zinc/77/41/22/387774122.db2.gz ZAAPOTFLOMUFAM-VXGBXAGGSA-N 2 0 243.354 2.450 20 0 BEADRP Cc1cccc(CC[C@@H](C)[NH2+]C[C@@H](C)[NH3+])c1 ZINC000643529379 387777379 /nfs/dbraw/zinc/77/73/79/387777379.db2.gz ZBXOFGVXRLTGHV-CHWSQXEVSA-N 2 0 220.360 2.253 20 0 BEADRP Cc1cc(C)cc(C[C@H](C)[NH2+][C@H](C)C2C[NH2+]C2)c1 ZINC000422923156 387777487 /nfs/dbraw/zinc/77/74/87/387777487.db2.gz RHFKXHXBMASYFE-UONOGXRCSA-N 2 0 246.398 2.432 20 0 BEADRP Cc1cc(C)cc(C[C@@H](C)[NH2+][C@H](C)C2C[NH2+]C2)c1 ZINC000422923157 387777734 /nfs/dbraw/zinc/77/77/34/387777734.db2.gz RHFKXHXBMASYFE-ZIAGYGMSSA-N 2 0 246.398 2.432 20 0 BEADRP CCC1(C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)CC1 ZINC000422923230 387778160 /nfs/dbraw/zinc/77/81/60/387778160.db2.gz VKPOFJAQLQALPG-FOSCPWQOSA-N 2 0 208.349 2.049 20 0 BEADRP CCCC1(C[NH2+][C@@H]2CCC[C@H]2[NH3+])CCC1 ZINC000422927341 387779165 /nfs/dbraw/zinc/77/91/65/387779165.db2.gz GDYOTBJQVOWYHZ-VXGBXAGGSA-N 2 0 210.365 2.426 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]C1CC(C)C1 ZINC000422925309 387780489 /nfs/dbraw/zinc/78/04/89/387780489.db2.gz ZYLPZDIALVJPQK-QDYJBQRPSA-N 2 0 233.359 2.298 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]CC1(C2CC2)CC1 ZINC000422932630 387780606 /nfs/dbraw/zinc/78/06/06/387780606.db2.gz GDSHQDFFSHTLDX-OLZOCXBDSA-N 2 0 222.376 2.426 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]C1(c2ccccc2)CC1 ZINC000422931189 387780908 /nfs/dbraw/zinc/78/09/08/387780908.db2.gz AXYALOWREMOMSO-GFCCVEGCSA-N 2 0 218.344 2.393 20 0 BEADRP C[C@@H]1CN(C2CC2)C[C@H]1[NH2+]CC1CC=CC1 ZINC000527942033 387781311 /nfs/dbraw/zinc/78/13/11/387781311.db2.gz APHRRBBWKPBFLN-BXUZGUMPSA-N 2 0 220.360 2.025 20 0 BEADRP C[C@H]([NH2+]C1C[C@@H](C)O[C@H](C)C1)[C@@H]1CCCC[NH2+]1 ZINC000643477784 387782379 /nfs/dbraw/zinc/78/23/79/387782379.db2.gz SPPVTESGEFCQHW-NMKXLXIOSA-N 2 0 240.391 2.063 20 0 BEADRP COc1ccc(C[NH2+][C@@H](C)C[C@H](C)[NH3+])cc1F ZINC000422937248 387782669 /nfs/dbraw/zinc/78/26/69/387782669.db2.gz JCLZLVWXNBNFRK-UWVGGRQHSA-N 2 0 240.322 2.050 20 0 BEADRP CCOCCC1(C[NH2+][C@@H]2CCC[C@@H]2[NH3+])CCC1 ZINC000422937995 387782709 /nfs/dbraw/zinc/78/27/09/387782709.db2.gz KKVCJMVWKZMXJL-QWHCGFSZSA-N 2 0 240.391 2.053 20 0 BEADRP C[C@@H]([NH2+]C1(c2ccccc2)CCC1)C1C[NH2+]C1 ZINC000422937969 387783317 /nfs/dbraw/zinc/78/33/17/387783317.db2.gz KGQNSBBDLLAFEV-GFCCVEGCSA-N 2 0 230.355 2.263 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]CCc1cccc(F)c1F ZINC000422959475 387812490 /nfs/dbraw/zinc/81/24/90/387812490.db2.gz SEFYXXVFUQTCOW-JTQLQIEISA-N 2 0 242.313 2.224 20 0 BEADRP CCC[C@H](C)[NH2+]CCCN1CCCO[C@@H](C)C1 ZINC000432424863 387789005 /nfs/dbraw/zinc/78/90/05/387789005.db2.gz KEYPZWMOGLYQDQ-KBPBESRZSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@H](Cc1ccc(O)cc1)[NH2+][C@H]1CCC[C@@H]1C[NH3+] ZINC000422979579 387792051 /nfs/dbraw/zinc/79/20/51/387792051.db2.gz NCZCGHVRXHWHTB-KYOSRNDESA-N 2 0 248.370 2.040 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H]2CCC[C@@H]2C[NH3+])cc1 ZINC000422983811 387793279 /nfs/dbraw/zinc/79/32/79/387793279.db2.gz VDCNUTOGDNGUQD-HUUCEWRRSA-N 2 0 232.371 2.255 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCC[C@@H]1C[NH3+])Oc1ccccc1 ZINC000422983012 387793345 /nfs/dbraw/zinc/79/33/45/387793345.db2.gz SDELCAPUFCGUMB-NFAWXSAZSA-N 2 0 248.370 2.171 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCC[C@H]1C[NH3+])Oc1ccccc1 ZINC000422983014 387793919 /nfs/dbraw/zinc/79/39/19/387793919.db2.gz SDELCAPUFCGUMB-VNHYZAJKSA-N 2 0 248.370 2.171 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+][C@H](C)c1ccccc1 ZINC000422986724 387795114 /nfs/dbraw/zinc/79/51/14/387795114.db2.gz HFMFHXXJCVJXHV-GRYCIOLGSA-N 2 0 206.333 2.463 20 0 BEADRP C[C@H]([NH2+]CC1Cc2ccccc2C1)[C@@H]1CCC[NH2+]1 ZINC000422984761 387795619 /nfs/dbraw/zinc/79/56/19/387795619.db2.gz ZCVQFDBSNTYQHV-LRDDRELGSA-N 2 0 244.382 2.132 20 0 BEADRP CSc1cc(C[NH2+][C@H](C)C[C@@H](C)[NH3+])ccn1 ZINC000422984667 387796250 /nfs/dbraw/zinc/79/62/50/387796250.db2.gz BFPMNRZYCDEPCN-NXEZZACHSA-N 2 0 239.388 2.019 20 0 BEADRP FC1(F)CCC[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000422992863 387799660 /nfs/dbraw/zinc/79/96/60/387799660.db2.gz RUZGISCUHBKAFF-FBTJUVTCSA-N 2 0 244.329 2.437 20 0 BEADRP [NH3+][C@H]1CCCCC[C@H]1[NH2+]CCCc1ccccn1 ZINC000422998358 387804335 /nfs/dbraw/zinc/80/43/35/387804335.db2.gz PZQWYDAJXYISOD-LSDHHAIUSA-N 2 0 247.386 2.264 20 0 BEADRP CCC[C@H](CCO)C[NH2+][C@H]1CCCCC[C@H]1[NH3+] ZINC000423002332 387807246 /nfs/dbraw/zinc/80/72/46/387807246.db2.gz FUZZHUVITLFZLZ-MCIONIFRSA-N 2 0 242.407 2.035 20 0 BEADRP Cc1cccc(C)c1OCC[NH2+][C@@H]1CCC[C@H]1[NH3+] ZINC000422948671 387808215 /nfs/dbraw/zinc/80/82/15/387808215.db2.gz RVFCMYDZOWRZOH-ZIAGYGMSSA-N 2 0 248.370 2.152 20 0 BEADRP CCC[NH+]1CCC([NH2+]CC2(SC)CC2)CC1 ZINC000193815535 387809725 /nfs/dbraw/zinc/80/97/25/387809725.db2.gz FNQQZDHDEPRBEW-UHFFFAOYSA-N 2 0 242.432 2.346 20 0 BEADRP CC1(C)C[C@@H]1C[NH2+]C1CCC(C[NH3+])CC1 ZINC000422954833 387809791 /nfs/dbraw/zinc/80/97/91/387809791.db2.gz JXYTUEZULXPDPN-MOENNCHZSA-N 2 0 210.365 2.140 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)CCc1ccco1)[C@H]1CCC[NH2+]1 ZINC000422961982 387811231 /nfs/dbraw/zinc/81/12/31/387811231.db2.gz DRRIMISLMSPQNS-OUCADQQQSA-N 2 0 236.359 2.331 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+]C[C@@H](C)[NH3+])[C@@H](C)C2 ZINC000643526607 387757375 /nfs/dbraw/zinc/75/73/75/387757375.db2.gz CCGUSYWKKQWRJA-MISXGVKJSA-N 2 0 218.344 2.165 20 0 BEADRP CC[C@@H](NC[C@H](C)[NH3+])c1ccccc1F ZINC000643527838 387758218 /nfs/dbraw/zinc/75/82/18/387758218.db2.gz UAHBLUQFLRYAMA-JOYOIKCWSA-N 2 0 210.296 2.214 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@@H](C)[C@H]2CC23CC3)CC1 ZINC000527859001 387758788 /nfs/dbraw/zinc/75/87/88/387758788.db2.gz NXTXMFZJFALOKQ-GXTWGEPZSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H]([NH2+]CC1CC[NH+](C)CC1)[C@@H]1CC12CC2 ZINC000527859681 387759842 /nfs/dbraw/zinc/75/98/42/387759842.db2.gz RJTBKIMNXNDCJK-AAEUAGOBSA-N 2 0 222.376 2.106 20 0 BEADRP Cc1ccc(C[C@H](C)[NH2+][C@H](C)C2C[NH2+]C2)c(C)c1 ZINC000422886255 387761215 /nfs/dbraw/zinc/76/12/15/387761215.db2.gz INVWIWMMJBINOT-UONOGXRCSA-N 2 0 246.398 2.432 20 0 BEADRP CC[C@H]([NH2+][C@H]1CC12CCCC2)[C@@H]1CCC[NH2+]1 ZINC000423069227 387872865 /nfs/dbraw/zinc/87/28/65/387872865.db2.gz ASSBLKXGERHHJU-AVGNSLFASA-N 2 0 222.376 2.439 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CC=CCC1)[C@H]1CCC[NH2+]1 ZINC000422972550 387821150 /nfs/dbraw/zinc/82/11/50/387821150.db2.gz MCRKSBSPNHELHB-FRRDWIJNSA-N 2 0 208.349 2.073 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+]C/C=C/c1ccccc1 ZINC000422973231 387822142 /nfs/dbraw/zinc/82/21/42/387822142.db2.gz BLSSYDOQGOAGDL-RZIFZGNASA-N 2 0 248.370 2.043 20 0 BEADRP C[C@H]([NH2+]CC1CCC(C)CC1)C1C[NH2+]C1 ZINC000422974679 387822790 /nfs/dbraw/zinc/82/27/90/387822790.db2.gz RQJQUJJKLVEXQC-CXQJBGSLSA-N 2 0 210.365 2.010 20 0 BEADRP CCCC(O)(CCC)C[NH2+][C@H]1CCC[C@H]1C[NH3+] ZINC000422974983 387823417 /nfs/dbraw/zinc/82/34/17/387823417.db2.gz FVTBDCJFIAHTPN-STQMWFEESA-N 2 0 242.407 2.035 20 0 BEADRP CC(C)[NH+](CCCN[C@H](C)C[C@@H](C)[NH3+])C(C)C ZINC000423003552 387825815 /nfs/dbraw/zinc/82/58/15/387825815.db2.gz HWCOTVPWYGAWOM-ZIAGYGMSSA-N 2 0 243.439 2.211 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CC1(CCO)CCCCC1 ZINC000423004108 387825876 /nfs/dbraw/zinc/82/58/76/387825876.db2.gz JEHYATRNTVCSMV-QWHCGFSZSA-N 2 0 242.407 2.035 20 0 BEADRP CC(C)[C@@H](O)C(C)(C)C[NH2+][C@H](C)CCCC[NH3+] ZINC000423006615 387828003 /nfs/dbraw/zinc/82/80/03/387828003.db2.gz WBDGFIJYTJIBEQ-CHWSQXEVSA-N 2 0 244.423 2.137 20 0 BEADRP CC(C)CSCC[NH2+][C@H]1CC[NH2+]CC[C@@H]1C ZINC000423008446 387831099 /nfs/dbraw/zinc/83/10/99/387831099.db2.gz AHKPTVBBXWRHSU-STQMWFEESA-N 2 0 244.448 2.353 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CC1(C2CC2)CCC1 ZINC000423008232 387831905 /nfs/dbraw/zinc/83/19/05/387831905.db2.gz ZLFBRUZMVDURIG-WDEREUQCSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]([NH2+]CC1CCC(C)(C)CC1)C1C[NH2+]C1 ZINC000423010718 387833312 /nfs/dbraw/zinc/83/33/12/387833312.db2.gz HGUIDVBGFRGJNL-LLVKDONJSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H]([NH2+][C@H](c1cccnc1)C1CC1)[C@@H]1CC[NH2+]C1 ZINC000423009476 387834705 /nfs/dbraw/zinc/83/47/05/387834705.db2.gz CXWMAHPTRNOXPI-LNSITVRQSA-N 2 0 245.370 2.120 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CC12CCC(CC1)C2 ZINC000423013660 387835459 /nfs/dbraw/zinc/83/54/59/387835459.db2.gz NECBQBBCEUAYRY-ZSVAQUKISA-N 2 0 210.365 2.282 20 0 BEADRP Cc1cnccc1CC[NH2+][C@@H]1CCCC[C@@H]1C[NH3+] ZINC000423014109 387836326 /nfs/dbraw/zinc/83/63/26/387836326.db2.gz OHNPXPQKGPCWDU-HUUCEWRRSA-N 2 0 247.386 2.040 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CC12CCC(CC1)C2 ZINC000423013658 387836496 /nfs/dbraw/zinc/83/64/96/387836496.db2.gz NECBQBBCEUAYRY-OKZRHMCRSA-N 2 0 210.365 2.282 20 0 BEADRP CCCNc1ccc(C[NH2+][C@@H]2CCC[C@@H]2[NH3+])cc1 ZINC000423073477 387873478 /nfs/dbraw/zinc/87/34/78/387873478.db2.gz ITFBOAINROSKPA-LSDHHAIUSA-N 2 0 247.386 2.478 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]CCC1Cc2ccccc2C1 ZINC000423016289 387838283 /nfs/dbraw/zinc/83/82/83/387838283.db2.gz SRZBDSFWJZUVOT-CVEARBPZSA-N 2 0 244.382 2.261 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+]CCC1Cc2ccccc2C1 ZINC000423016292 387839213 /nfs/dbraw/zinc/83/92/13/387839213.db2.gz SRZBDSFWJZUVOT-JKSUJKDBSA-N 2 0 244.382 2.261 20 0 BEADRP CO[C@@H]1CCC[C@@H]1C[NH2+][C@@H]1CCCCC[C@@H]1[NH3+] ZINC000423019142 387840921 /nfs/dbraw/zinc/84/09/21/387840921.db2.gz UEQAMIZLDUMZSW-XJFOESAGSA-N 2 0 240.391 2.051 20 0 BEADRP CC(C)(C)[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H]2[NH3+])CCO1 ZINC000423031273 387846699 /nfs/dbraw/zinc/84/66/99/387846699.db2.gz WXPUKOQJWPPIRE-XQHKEYJVSA-N 2 0 240.391 2.050 20 0 BEADRP COCCC(C)(C)C[NH2+][C@H]1CC[NH2+]CC[C@H]1C ZINC000423030337 387846788 /nfs/dbraw/zinc/84/67/88/387846788.db2.gz BIDZIYZIBICQPI-OLZOCXBDSA-N 2 0 242.407 2.027 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CCCCS1)[C@H]1CCC[NH2+]1 ZINC000423033993 387848367 /nfs/dbraw/zinc/84/83/67/387848367.db2.gz PJEGXYYHGNLUOP-IJLUTSLNSA-N 2 0 228.405 2.002 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000643533999 387850043 /nfs/dbraw/zinc/85/00/43/387850043.db2.gz JGCHSKUPZGIWPX-TZMCWYRMSA-N 2 0 248.370 2.332 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CCC[C@@H]1CCCCO1 ZINC000423036505 387850668 /nfs/dbraw/zinc/85/06/68/387850668.db2.gz LEVZWJDLRXQVSG-KGLIPLIRSA-N 2 0 242.407 2.443 20 0 BEADRP [NH3+]CC1CCC([NH2+]CC[C@H]2CCCCO2)CC1 ZINC000423038568 387853197 /nfs/dbraw/zinc/85/31/97/387853197.db2.gz DAQUTILBRZIGLW-JXQTWKCFSA-N 2 0 240.391 2.053 20 0 BEADRP Cc1csc([C@H](C)C[NH2+][C@H](C)C[C@H](C)[NH3+])n1 ZINC000423039551 387853830 /nfs/dbraw/zinc/85/38/30/387853830.db2.gz QUVXAFZXXVNLNE-KXUCPTDWSA-N 2 0 241.404 2.270 20 0 BEADRP C[C@H]([NH2+]CCC[C@@H]1CCCCO1)[C@@H]1CCC[NH2+]1 ZINC000423041669 387854515 /nfs/dbraw/zinc/85/45/15/387854515.db2.gz XQHTYDSSVUKAPC-IHRRRGAJSA-N 2 0 240.391 2.066 20 0 BEADRP COCC[C@H]([NH2+][C@H](C)CCC[NH3+])c1ccco1 ZINC000423041776 387855326 /nfs/dbraw/zinc/85/53/26/387855326.db2.gz JTAKCNVTJKNPEH-NEPJUHHUSA-N 2 0 240.347 2.074 20 0 BEADRP C[C@H]([NH2+]CCC[C@H]1CCCCO1)[C@H]1CCC[NH2+]1 ZINC000423041667 387856131 /nfs/dbraw/zinc/85/61/31/387856131.db2.gz XQHTYDSSVUKAPC-BFHYXJOUSA-N 2 0 240.391 2.066 20 0 BEADRP CC(C)C[C@@H]1C[C@@H]([NH2+][C@H](C)CCC[NH3+])CCO1 ZINC000423043289 387856319 /nfs/dbraw/zinc/85/63/19/387856319.db2.gz OEGFKRQBSKSHKG-HZSPNIEDSA-N 2 0 242.407 2.297 20 0 BEADRP C[C@@H](CCC1CC1)[NH2+][C@@H](C)[C@H]1CCC[NH2+]1 ZINC000423045728 387856792 /nfs/dbraw/zinc/85/67/92/387856792.db2.gz DIWLZQQWPBFXJY-GMXVVIOVSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)CCC1CC1)[C@H]1CCC[NH2+]1 ZINC000423045727 387858095 /nfs/dbraw/zinc/85/80/95/387858095.db2.gz DIWLZQQWPBFXJY-DMDPSCGWSA-N 2 0 210.365 2.295 20 0 BEADRP C[N@H+]1C[C@@H]2C[NH+](CCCC3CCCC3)C[C@@H]2C1 ZINC000193606677 387858808 /nfs/dbraw/zinc/85/88/08/387858808.db2.gz UNKDCEWIMVLXAI-GASCZTMLSA-N 2 0 236.403 2.450 20 0 BEADRP CCc1ccccc1C[N@H+]1C[C@H]2C[NH+](C)C[C@H]2C1 ZINC000193645715 387859933 /nfs/dbraw/zinc/85/99/33/387859933.db2.gz XAROQLACVRGBMJ-IYBDPMFKSA-N 2 0 244.382 2.242 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCCCC[C@H]1[NH3+])C(F)(F)F ZINC000423052226 387860458 /nfs/dbraw/zinc/86/04/58/387860458.db2.gz PFUSZPBAOHIJNZ-OPRDCNLKSA-N 2 0 238.297 2.434 20 0 BEADRP CC[C@H]([NH2+]CCN1CCCC1)[C@H]1C[C@H]1C ZINC000322062905 387874419 /nfs/dbraw/zinc/87/44/19/387874419.db2.gz RJGCVGINYCGTNZ-AGIUHOORSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]([NH2+][C@H]1C[C@H](C)[N@H+](C)C[C@H]1C)C1CC1 ZINC000036908632 387861416 /nfs/dbraw/zinc/86/14/16/387861416.db2.gz WUSBWJKUCHKNBM-BLFANLJRSA-N 2 0 210.365 2.103 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]C1(Cc2ccccc2)CC1 ZINC000423054744 387862297 /nfs/dbraw/zinc/86/22/97/387862297.db2.gz UYADGWXOSJXTNY-OLZOCXBDSA-N 2 0 232.371 2.477 20 0 BEADRP C[C@H](C[NH2+]C1CCC([NH3+])CC1)c1ccncc1 ZINC000643460311 387874518 /nfs/dbraw/zinc/87/45/18/387874518.db2.gz OJDMSEMBGUKTGD-LMWSTFAQSA-N 2 0 233.359 2.045 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+][C@H]2CCCC[C@@H]2O)c2ccccc21 ZINC000423060603 387865484 /nfs/dbraw/zinc/86/54/84/387865484.db2.gz IOQNHHSXIVDSAY-AJNGGQMLSA-N 2 0 246.354 2.024 20 0 BEADRP CC(C)C(C)(C)C[NH2+][C@H](C)C[C@@H](C)[NH3+] ZINC000423060312 387865741 /nfs/dbraw/zinc/86/57/41/387865741.db2.gz OEJPINXTEWDOLP-GHMZBOCLSA-N 2 0 200.370 2.384 20 0 BEADRP C/C=C\C[C@H](CO)[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000423057707 387865802 /nfs/dbraw/zinc/86/58/02/387865802.db2.gz ZSFJTIPKNCSAOB-KZMBYTFQSA-N 2 0 246.354 2.048 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[C@@H](C)C1)[C@@H]1CCC[NH2+]1 ZINC000423062021 387867458 /nfs/dbraw/zinc/86/74/58/387867458.db2.gz MCRDBOLXOMYKBQ-NDBYEHHHSA-N 2 0 210.365 2.295 20 0 BEADRP CC(C)[C@@H]([NH2+][C@H]1CC12CC[NH2+]CC2)C1CC1 ZINC000643536170 387868015 /nfs/dbraw/zinc/86/80/15/387868015.db2.gz RZSVDKBUFWMUBJ-QWHCGFSZSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)C1CCCC1 ZINC000643536952 387868966 /nfs/dbraw/zinc/86/89/66/387868966.db2.gz XLZIJKNCTYMDDP-WCQYABFASA-N 2 0 222.376 2.297 20 0 BEADRP CC(C)C(C[NH2+][C@H]1CCC[C@H]1[NH3+])C(C)C ZINC000423068346 387869011 /nfs/dbraw/zinc/86/90/11/387869011.db2.gz JVCONBBQWJWBHW-OLZOCXBDSA-N 2 0 212.381 2.384 20 0 BEADRP CCC(O)(CC)CC[NH2+][C@H]1CCCC[C@H]1C[NH3+] ZINC000423067097 387869028 /nfs/dbraw/zinc/86/90/28/387869028.db2.gz GHZAGFNQDFNGIQ-STQMWFEESA-N 2 0 242.407 2.035 20 0 BEADRP CC(C)=CC[NH2+][C@@H](C)c1ccc(C[NH3+])nc1C ZINC000423067734 387870166 /nfs/dbraw/zinc/87/01/66/387870166.db2.gz IECNQTCVQVEAQH-NSHDSACASA-N 2 0 233.359 2.466 20 0 BEADRP CC(C)C1CC([NH2+][C@H]2CCC[C@H]2C[NH3+])C1 ZINC000423067846 387870521 /nfs/dbraw/zinc/87/05/21/387870521.db2.gz AHQREBRYQCPVSP-WTIISPKJSA-N 2 0 210.365 2.138 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[C@H](OC)C1)[C@H]1CCCC[NH2+]1 ZINC000423068317 387870797 /nfs/dbraw/zinc/87/07/97/387870797.db2.gz JRDXGOZVASKHRR-ZOBORPQBSA-N 2 0 240.391 2.064 20 0 BEADRP Cc1c[nH+]ccc1NC[C@H]1CC[N@@H+]1C1CCCC1 ZINC000528207105 387871550 /nfs/dbraw/zinc/87/15/50/387871550.db2.gz AAQSZEIOENEDBM-CQSZACIVSA-N 2 0 245.370 2.241 20 0 BEADRP CC[C@@H]([NH2+][C@@H]1CC12CCCC2)[C@@H]1CCC[NH2+]1 ZINC000423069228 387872544 /nfs/dbraw/zinc/87/25/44/387872544.db2.gz ASSBLKXGERHHJU-FRRDWIJNSA-N 2 0 222.376 2.439 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]CCC1=CCCCC1 ZINC000422965119 387814231 /nfs/dbraw/zinc/81/42/31/387814231.db2.gz NTZKOFZSJAQXPX-CHWSQXEVSA-N 2 0 208.349 2.346 20 0 BEADRP CC(C)[N@H+](C)CCCNCc1ccco1 ZINC000163638817 387816977 /nfs/dbraw/zinc/81/69/77/387816977.db2.gz GMYUVGSBWGHDRF-UHFFFAOYSA-N 2 0 210.321 2.100 20 0 BEADRP COc1cccc([C@H]2CCCN2C[C@@H](C)[NH3+])c1 ZINC000442667144 387819681 /nfs/dbraw/zinc/81/96/81/387819681.db2.gz YGJAXQUTODAHIU-BXUZGUMPSA-N 2 0 234.343 2.179 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000423101259 387889883 /nfs/dbraw/zinc/88/98/83/387889883.db2.gz VSAYZIWPVNFSRC-ZBBUEOHVSA-N 2 0 222.376 2.295 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+][C@H]1CCCCC[C@H]1[NH3+] ZINC000423104995 387890667 /nfs/dbraw/zinc/89/06/67/387890667.db2.gz HZAVXWHTTMXIKV-WOPDTQHZSA-N 2 0 210.365 2.425 20 0 BEADRP COCC[C@H]([NH2+][C@@H](C)[C@@H]1CCC[NH2+]1)C(C)(C)C ZINC000423105908 387891081 /nfs/dbraw/zinc/89/10/81/387891081.db2.gz CRCMPFXSYHMATJ-AVGNSLFASA-N 2 0 242.407 2.168 20 0 BEADRP CC1=CCC[C@@H](C)[C@H]1C[N@H+]1C[C@H]2C[NH+](C)C[C@H]2C1 ZINC000194543023 387893261 /nfs/dbraw/zinc/89/32/61/387893261.db2.gz ADKJSMTXAOIOAS-WCVJEAGWSA-N 2 0 248.414 2.472 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CC1(C(F)(F)F)CCC1 ZINC000423111864 387893648 /nfs/dbraw/zinc/89/36/48/387893648.db2.gz RABOSKXSZDCJKM-IUCAKERBSA-N 2 0 238.297 2.434 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCC1(C)C)[C@H]1CCCC[NH2+]1 ZINC000423109975 387894263 /nfs/dbraw/zinc/89/42/63/387894263.db2.gz OHHNMWGJKIJTPJ-IJLUTSLNSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H]1CCc2ccccc2OC1 ZINC000423108751 387894379 /nfs/dbraw/zinc/89/43/79/387894379.db2.gz GHBPWCQZILPWNX-TZMCWYRMSA-N 2 0 248.370 2.097 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+][C@H]1CC12CCCC2 ZINC000423075239 387875048 /nfs/dbraw/zinc/87/50/48/387875048.db2.gz OCHLOTDDMFBMHK-AGIUHOORSA-N 2 0 222.376 2.297 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCN(C)[C@H](C)C1)[C@@H]1C[C@@H]1C ZINC000322068554 387875901 /nfs/dbraw/zinc/87/59/01/387875901.db2.gz SECLLWXUOXFXOR-MRTXSQPYSA-N 2 0 224.392 2.493 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]C1CCC2(CC2)CC1 ZINC000423078801 387876178 /nfs/dbraw/zinc/87/61/78/387876178.db2.gz WTYLAYKIQWWARP-WDEREUQCSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]C1CCC2(CC2)CC1 ZINC000423078798 387876888 /nfs/dbraw/zinc/87/68/88/387876888.db2.gz WTYLAYKIQWWARP-MNOVXSKESA-N 2 0 210.365 2.425 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H]1CCCc2cccnc21 ZINC000643539329 387879667 /nfs/dbraw/zinc/87/96/67/387879667.db2.gz MYBKSWPHTPJCRB-DGCLKSJQSA-N 2 0 233.359 2.176 20 0 BEADRP Cc1ncc([C@H](C)[NH2+][C@@H](C)CCC[NH3+])s1 ZINC000643539249 387879801 /nfs/dbraw/zinc/87/98/01/387879801.db2.gz MRFIFUHUUVJZRO-IUCAKERBSA-N 2 0 227.377 2.230 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCCc2ccccc2C1)[C@H](C)[NH3+] ZINC000643540103 387880850 /nfs/dbraw/zinc/88/08/50/387880850.db2.gz JJHHWYYPBYVTBC-ZOWXZIJZSA-N 2 0 232.371 2.259 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@H](CC)Cc1cccs1 ZINC000643540329 387881000 /nfs/dbraw/zinc/88/10/00/387881000.db2.gz YNBYXVSRFRSLJN-GHMZBOCLSA-N 2 0 226.389 2.396 20 0 BEADRP CC[C@@H]([NH2+]CC1(SC)CCC1)[C@@H]1CCC[NH2+]1 ZINC000423086385 387881324 /nfs/dbraw/zinc/88/13/24/387881324.db2.gz LXFOSCRBQVZZQH-NEPJUHHUSA-N 2 0 242.432 2.392 20 0 BEADRP CC[C@H]([NH2+][C@H](C)CC[NH+](C)C)[C@H]1C[C@H]1C ZINC000322072367 387883212 /nfs/dbraw/zinc/88/32/12/387883212.db2.gz SRBDLCRMKUCZNC-NDBYEHHHSA-N 2 0 212.381 2.351 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC000423096042 387884735 /nfs/dbraw/zinc/88/47/35/387884735.db2.gz NVADBMZYXOFBKB-LPEHRKFASA-N 2 0 220.307 2.137 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC000423093657 387884956 /nfs/dbraw/zinc/88/49/56/387884956.db2.gz IIYFSFTZUGKOFW-IJLUTSLNSA-N 2 0 246.345 2.400 20 0 BEADRP c1cc2cc(CC[NH2+]C3CC[NH2+]CC3)ccc2[nH]1 ZINC000423095954 387885624 /nfs/dbraw/zinc/88/56/24/387885624.db2.gz GNUNNIBEUMOGPP-UHFFFAOYSA-N 2 0 243.354 2.052 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CCc1ccc2[nH]ccc2c1 ZINC000423098372 387886323 /nfs/dbraw/zinc/88/63/23/387886323.db2.gz KSKIISFMUQYODF-GFCCVEGCSA-N 2 0 245.370 2.427 20 0 BEADRP Cc1cccc(CCC[NH2+][C@@H](C)C[C@@H](C)[NH3+])n1 ZINC000423098472 387887358 /nfs/dbraw/zinc/88/73/58/387887358.db2.gz CTWFEXJYUYMZJC-YPMHNXCESA-N 2 0 235.375 2.038 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CC[C@H](C)F ZINC000423140127 387917892 /nfs/dbraw/zinc/91/78/92/387917892.db2.gz XKMIXFZUIAEWPZ-UWVGGRQHSA-N 2 0 239.338 2.247 20 0 BEADRP C=Cc1ccc(CC[NH2+][C@H](C)C2C[NH2+]C2)cc1 ZINC000423141596 387918102 /nfs/dbraw/zinc/91/81/02/387918102.db2.gz QTQYYESBYZFDEA-GFCCVEGCSA-N 2 0 230.355 2.070 20 0 BEADRP CC(F)(F)CC[NH2+][C@H]1CCCCC[C@H]1[NH3+] ZINC000423142946 387919751 /nfs/dbraw/zinc/91/97/51/387919751.db2.gz BVSJGFSMWRUCRX-ZJUUUORDSA-N 2 0 220.307 2.281 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[N@@H+]1CCC[C@]2(CCSC2)C1 ZINC000423163722 387899426 /nfs/dbraw/zinc/89/94/26/387899426.db2.gz RNTWLLBWAVDEEM-AVGNSLFASA-N 2 0 242.432 2.331 20 0 BEADRP C[NH+](C)CC1CC[NH+](CC2=CCCC2)CC1 ZINC000645777797 387901872 /nfs/dbraw/zinc/90/18/72/387901872.db2.gz LKILTZYZJUTWAI-UHFFFAOYSA-N 2 0 222.376 2.370 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C1CC(C(F)(F)F)C1 ZINC000423122217 387902439 /nfs/dbraw/zinc/90/24/39/387902439.db2.gz JQHCVSZIOIRAEM-XNWIYYODSA-N 2 0 238.297 2.434 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@H]1CC2CCC1CC2 ZINC000423124199 387903506 /nfs/dbraw/zinc/90/35/06/387903506.db2.gz GCZXDYQFCQDLGT-QOKXSHCXSA-N 2 0 210.365 2.281 20 0 BEADRP C[C@@H]([NH3+])[C@@H](Cc1ccccc1)[NH2+]CC[C@H](C)F ZINC000423129553 387907483 /nfs/dbraw/zinc/90/74/83/387907483.db2.gz FGWNIPJMQCMXLU-OUCADQQQSA-N 2 0 238.350 2.283 20 0 BEADRP C[C@@H]([NH2+]C[C@]1(C)C[C@H]1c1ccccc1)C1C[NH2+]C1 ZINC000423129155 387907566 /nfs/dbraw/zinc/90/75/66/387907566.db2.gz DVOCIGNMKHYQDL-KCXAZCMYSA-N 2 0 244.382 2.378 20 0 BEADRP COCC(C)(C)CCC[NH2+][C@@H](C)[C@H]1CCC[NH2+]1 ZINC000423129220 387907765 /nfs/dbraw/zinc/90/77/65/387907765.db2.gz QWITUOWATYYIQS-QWHCGFSZSA-N 2 0 242.407 2.169 20 0 BEADRP C[C@H](F)CC[NH2+][C@H](Cc1ccccc1)[C@H](C)[NH3+] ZINC000423129555 387907776 /nfs/dbraw/zinc/90/77/76/387907776.db2.gz FGWNIPJMQCMXLU-SGMGOOAPSA-N 2 0 238.350 2.283 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[C@H](F)C1)[C@H]1CCCC[NH2+]1 ZINC000423129216 387908301 /nfs/dbraw/zinc/90/83/01/387908301.db2.gz QWFFHISOUWFSEM-QNWHQSFQSA-N 2 0 228.355 2.387 20 0 BEADRP C[C@@H]([NH2+][C@H]1C[C@H](c2ccc(F)cc2)C1)C1C[NH2+]C1 ZINC000423128910 387908387 /nfs/dbraw/zinc/90/83/87/387908387.db2.gz LFZXXEUISOZXER-IXPVHAAZSA-N 2 0 248.345 2.269 20 0 BEADRP Cc1cccc2c1OC[C@@H]([NH2+][C@@H](C)CCC[NH3+])C2 ZINC000423133302 387909166 /nfs/dbraw/zinc/90/91/66/387909166.db2.gz CUFQCYWMCIIBJJ-JSGCOSHPSA-N 2 0 248.370 2.016 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CSc2ccccc21)C1C[NH2+]C1 ZINC000423143333 387919580 /nfs/dbraw/zinc/91/95/80/387919580.db2.gz CQHQIUKZQJUQPY-ZYHUDNBSSA-N 2 0 248.395 2.073 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]C[C@@H]1CCCSC1 ZINC000423133697 387911339 /nfs/dbraw/zinc/91/13/39/387911339.db2.gz VXCVGQCAMYBYND-AGIUHOORSA-N 2 0 242.432 2.107 20 0 BEADRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]C1CC(C(F)(F)F)C1 ZINC000423136861 387913935 /nfs/dbraw/zinc/91/39/35/387913935.db2.gz ZQEYQKSYSLWRNF-WOOKNIGNSA-N 2 0 236.281 2.044 20 0 BEADRP CC[C@H]1CC[C@H]([NH2+][C@@H]2CCC[C@@H]2[NH3+])CC1 ZINC000423137677 387916417 /nfs/dbraw/zinc/91/64/17/387916417.db2.gz WTXPNXIDXJDJRV-ZDEQEGDKSA-N 2 0 210.365 2.425 20 0 BEADRP CC[C@@H]1CCC[C@H]1C[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000423151856 387929631 /nfs/dbraw/zinc/92/96/31/387929631.db2.gz CZZSZLWGRCNWHX-TUAOUCFPSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@H]([NH2+]CC(C)(C)C1CCC1)C1C[NH2+]C1 ZINC000423150987 387930250 /nfs/dbraw/zinc/93/02/50/387930250.db2.gz JNXNRQCHPZODDB-JTQLQIEISA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]([NH2+]CC(C)(C)C1CCC1)C1C[NH2+]C1 ZINC000423150988 387930457 /nfs/dbraw/zinc/93/04/57/387930457.db2.gz JNXNRQCHPZODDB-SNVBAGLBSA-N 2 0 210.365 2.010 20 0 BEADRP Cc1csc(C[NH2+][C@@H](C)C[C@@H](C)[NH3+])c1 ZINC000423156942 387937534 /nfs/dbraw/zinc/93/75/34/387937534.db2.gz UPFUWTXGICGBLE-ZJUUUORDSA-N 2 0 212.362 2.272 20 0 BEADRP Cc1ccc(F)c(CC[NH2+][C@H]2CCC[C@H]2[NH3+])c1 ZINC000423151385 387930540 /nfs/dbraw/zinc/93/05/40/387930540.db2.gz KCFFJHVMPJMJOC-KGLIPLIRSA-N 2 0 236.334 2.146 20 0 BEADRP C[C@H](CC(C)(C)C)[NH2+][C@@H]1CCOC[C@H]1[C@H](C)[NH3+] ZINC000423157654 387937383 /nfs/dbraw/zinc/93/73/83/387937383.db2.gz BKNZWJQKWIZFAK-MROQNXINSA-N 2 0 242.407 2.153 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CCc2ccccc21)C1C[NH2+]C1 ZINC000423142710 387920457 /nfs/dbraw/zinc/92/04/57/387920457.db2.gz BHJMHTCIGBJTLS-TZMCWYRMSA-N 2 0 244.382 2.304 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H]1C[C@H]1C(C)C)[C@@H]1CCC[NH2+]1 ZINC000423148447 387924124 /nfs/dbraw/zinc/92/41/24/387924124.db2.gz GBDVYZCUGFGNNT-FQUUOJAGSA-N 2 0 224.392 2.399 20 0 BEADRP CCn1ccnc1[C@@H](C)[NH2+][C@H](C)CCCC[NH3+] ZINC000423146891 387924425 /nfs/dbraw/zinc/92/44/25/387924425.db2.gz BNJMASAVFPJBFA-VXGBXAGGSA-N 2 0 238.379 2.071 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)C1(C)CC1 ZINC000044533950 387937167 /nfs/dbraw/zinc/93/71/67/387937167.db2.gz HQTBDDFTVQZHTD-NEPJUHHUSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@@H]2C[C@H]2C2CCC2)CC[N@@H+]1C ZINC000424287752 387951803 /nfs/dbraw/zinc/95/18/03/387951803.db2.gz HWUZDLKXFKCEFO-BEAPCOKYSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@@H]([NH2+]CCC1CC(F)(F)C1)[C@H]1CCC[NH2+]1 ZINC000423167608 387951945 /nfs/dbraw/zinc/95/19/45/387951945.db2.gz SPRRMTUAEJWCEH-MWLCHTKSSA-N 2 0 232.318 2.152 20 0 BEADRP CC[C@H]([NH2+]CCC[NH+]1CCCC1)[C@@H]1C[C@H]1C ZINC000321169714 387952470 /nfs/dbraw/zinc/95/24/70/387952470.db2.gz YIDSGSWUGBDKKV-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000423167203 387952553 /nfs/dbraw/zinc/95/25/53/387952553.db2.gz DTSUSJIZEKCWKY-QNWHQSFQSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CC(C)(C)C1(O)CCCC1 ZINC000423168908 387955032 /nfs/dbraw/zinc/95/50/32/387955032.db2.gz VIMUDMMBQGYZLQ-NWDGAFQWSA-N 2 0 242.407 2.033 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CC(C)(C)C1(O)CCCC1 ZINC000423168910 387955168 /nfs/dbraw/zinc/95/51/68/387955168.db2.gz VIMUDMMBQGYZLQ-VXGBXAGGSA-N 2 0 242.407 2.033 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)[C@H]1C[C@H]1C ZINC000321159190 387955306 /nfs/dbraw/zinc/95/53/06/387955306.db2.gz XBTPULVAWUTXJN-QMVSFRDZSA-N 2 0 222.376 2.247 20 0 BEADRP CO[C@H]1c2ccccc2C[C@H]1[NH2+][C@@H](C)CCC[NH3+] ZINC000423171035 387956117 /nfs/dbraw/zinc/95/61/17/387956117.db2.gz NFHKYAVTXKPBIP-GLQYFDAESA-N 2 0 248.370 2.016 20 0 BEADRP CC[C@H](C)[C@H](C[NH2+]C1CCC(C[NH3+])CC1)OC ZINC000423158653 387939161 /nfs/dbraw/zinc/93/91/61/387939161.db2.gz OLJNBTKZMBCGOG-ABXWRUBCSA-N 2 0 242.407 2.155 20 0 BEADRP CC[C@]1(C(C)C)C[C@@H]1[NH2+][C@@H](C)[C@@H]1CC[NH2+]C1 ZINC000423158207 387939531 /nfs/dbraw/zinc/93/95/31/387939531.db2.gz CJZRDORNNJDBLI-RFQIPJPRSA-N 2 0 224.392 2.399 20 0 BEADRP FC1(F)CC(CC[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000423159063 387939771 /nfs/dbraw/zinc/93/97/71/387939771.db2.gz FECMHVYMCIOFME-FOSCPWQOSA-N 2 0 244.329 2.294 20 0 BEADRP CCO[C@H]1C[C@@H]([NH2+][C@H]2C[C@@H]([NH3+])c3ccccc32)C1 ZINC000423160734 387940431 /nfs/dbraw/zinc/94/04/31/387940431.db2.gz HTOLXPIDFCKTNB-BVIHXZOGSA-N 2 0 246.354 2.288 20 0 BEADRP CCO[C@H]1C[C@@H]([NH2+][C@@H]2C[C@H]([NH3+])c3ccccc32)C1 ZINC000423160735 387941231 /nfs/dbraw/zinc/94/12/31/387941231.db2.gz HTOLXPIDFCKTNB-IDTSFGKNSA-N 2 0 246.354 2.288 20 0 BEADRP C[C@H](CCC[NH3+])[N@@H+]1CCC[C@@]2(CCSC2)C1 ZINC000423161416 387942634 /nfs/dbraw/zinc/94/26/34/387942634.db2.gz NUOBNXWEWZNJFC-CHWSQXEVSA-N 2 0 242.432 2.333 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+]C[C@@H]1C[C@H]1C1CC1 ZINC000423162399 387942646 /nfs/dbraw/zinc/94/26/46/387942646.db2.gz LAHCWWPJWNOWLQ-ZOBORPQBSA-N 2 0 222.376 2.140 20 0 BEADRP CC[C@@H]([NH2+][C@H]1C[C@@H](OC(C)C)C1)[C@@H]1CCC[NH2+]1 ZINC000423162380 387944269 /nfs/dbraw/zinc/94/42/69/387944269.db2.gz KXDZCFROJBUGTI-RQJABVFESA-N 2 0 240.391 2.063 20 0 BEADRP Cc1ccc(CC[NH2+][C@H]2CCCC[C@@H]2C[NH3+])nc1 ZINC000423162661 387944529 /nfs/dbraw/zinc/94/45/29/387944529.db2.gz LLBNHWNAADXRAW-HIFRSBDPSA-N 2 0 247.386 2.040 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+][C@@H](C)CCC=C(C)C ZINC000423165036 387947525 /nfs/dbraw/zinc/94/75/25/387947525.db2.gz XPOQJJOKYLIBKC-UONOGXRCSA-N 2 0 242.407 2.465 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)[C@@H]1CCC[C@@H](C)C1)C1C[NH2+]C1 ZINC000423164951 387948893 /nfs/dbraw/zinc/94/88/93/387948893.db2.gz PBYYZXMJNOVCNV-YVECIDJPSA-N 2 0 224.392 2.399 20 0 BEADRP CCC[C@@H]([NH2+][C@@H]1CC[NH2+]C1)C1CCCC1 ZINC000423171394 387956461 /nfs/dbraw/zinc/95/64/61/387956461.db2.gz OHGQQAZWJNVGDS-CHWSQXEVSA-N 2 0 210.365 2.297 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@@H]2C[C@H]2C2CCC2)CC1 ZINC000424297648 387958187 /nfs/dbraw/zinc/95/81/87/387958187.db2.gz RHUFCBMPSDAIPS-ZFWWWQNUSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]C[C@@H]1C[C@H]1C1CC1 ZINC000423170768 387958229 /nfs/dbraw/zinc/95/82/29/387958229.db2.gz YULOCWKZSKEVHA-VZZFWQQMSA-N 2 0 222.376 2.010 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]C1(C2CCC2)CCC1 ZINC000423171897 387959619 /nfs/dbraw/zinc/95/96/19/387959619.db2.gz QLJWRPNINDHQGD-MNOVXSKESA-N 2 0 210.365 2.425 20 0 BEADRP C[C@@H]([NH2+]CC1([NH3+])CCCCC1)[C@H]1C[C@H]1C ZINC000423187485 387972096 /nfs/dbraw/zinc/97/20/96/387972096.db2.gz XVEVORLFCOQPCG-UTUOFQBUSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]([NH2+]CCC[NH3+])c1cc(F)c(F)c(F)c1 ZINC000423177498 387963403 /nfs/dbraw/zinc/96/34/03/387963403.db2.gz IWSUIIXKBRTYBW-ZETCQYMHSA-N 2 0 232.249 2.103 20 0 BEADRP CC[C@@H]1CC[N@H+](CC[C@H]2CCC[NH+]2C)C1 ZINC000245594210 387963846 /nfs/dbraw/zinc/96/38/46/387963846.db2.gz HBBJFUQGDKIZKQ-CHWSQXEVSA-N 2 0 210.365 2.203 20 0 BEADRP CO[C@@H](c1ccccc1)[C@@H](C)[NH2+]C1CC[NH2+]CC1 ZINC000423184630 387970272 /nfs/dbraw/zinc/97/02/72/387970272.db2.gz MJMGEOKUXGKGHY-IUODEOHRSA-N 2 0 248.370 2.104 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1C[C@H]1C1CC1)[C@@H]1CCCC[NH2+]1 ZINC000423170273 387957831 /nfs/dbraw/zinc/95/78/31/387957831.db2.gz XQYZSSYQQLKKCP-PYJNHQTQSA-N 2 0 222.376 2.153 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1CC[N@H+](CC)C1)c1ccncc1 ZINC000453067926 387978801 /nfs/dbraw/zinc/97/88/01/387978801.db2.gz SFIQSVDKJLMBDD-ZFWWWQNUSA-N 2 0 247.386 2.464 20 0 BEADRP C[C@@H]1CC[C@@H](C)[C@@H]([NH2+]C2CC[NH2+]CC2)C1 ZINC000423195540 387979363 /nfs/dbraw/zinc/97/93/63/387979363.db2.gz ZIWDVPHSXKJVHV-WZRBSPASSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]1CCc2c(F)cccc2[C@H]1[NH2+]CCC[NH3+] ZINC000423195174 387980690 /nfs/dbraw/zinc/98/06/90/387980690.db2.gz SKUWTLKKTSHRIH-HZMBPMFUSA-N 2 0 236.334 2.388 20 0 BEADRP Cc1cc([C@@H](C)[NH2+]CCC[NH3+])cc(C)c1F ZINC000423188670 387973237 /nfs/dbraw/zinc/97/32/37/387973237.db2.gz MDLDDIXDBOWNMR-LLVKDONJSA-N 2 0 224.323 2.442 20 0 BEADRP c1ccc(CC[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000106868239 387973738 /nfs/dbraw/zinc/97/37/38/387973738.db2.gz IONPZCPSSSCTFZ-HZPDHXFCSA-N 2 0 244.382 2.446 20 0 BEADRP CC[C@H](NCCC[NH+](C)C)c1ccncc1 ZINC000453061244 387977273 /nfs/dbraw/zinc/97/72/73/387977273.db2.gz SJHSURGZXDJAHR-ZDUSSCGKSA-N 2 0 221.348 2.074 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C2CC2)C2CCC2)C1 ZINC000453068858 387978454 /nfs/dbraw/zinc/97/84/54/387978454.db2.gz TVYMFRFXPSYVCW-IUODEOHRSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+][C@@H]1CCCC[C@H]1F ZINC000423193219 387978475 /nfs/dbraw/zinc/97/84/75/387978475.db2.gz VLUIETFLJUKJDQ-QNWHQSFQSA-N 2 0 228.355 2.245 20 0 BEADRP C[NH2+]CCC[NH2+][C@H](C)c1csc(C)c1 ZINC000423201239 387987644 /nfs/dbraw/zinc/98/76/44/387987644.db2.gz OEXAHLWWBWOBTG-SNVBAGLBSA-N 2 0 212.362 2.317 20 0 BEADRP CCCC[C@@H](C)[C@H](C)[NH2+]CCC[NH2+]C ZINC000423201437 387987993 /nfs/dbraw/zinc/98/79/93/387987993.db2.gz ORJRCERJMKJQOX-NEPJUHHUSA-N 2 0 200.370 2.400 20 0 BEADRP CC(C)[C@H]([NH2+]C[C@@H]1CCC[NH2+]C1)c1cccnc1 ZINC000423202615 387989090 /nfs/dbraw/zinc/98/90/90/387989090.db2.gz BEGPTABTNDTKRS-HIFRSBDPSA-N 2 0 247.386 2.368 20 0 BEADRP CC(C)[C@H]1C[C@H]([NH2+][C@@H]2CCCC[C@H]2[NH3+])CCO1 ZINC000424364949 387990416 /nfs/dbraw/zinc/99/04/16/387990416.db2.gz FOZANZCAIQVMRL-AAVRWANBSA-N 2 0 240.391 2.050 20 0 BEADRP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1)c1cccc(O)c1 ZINC000423205777 387991040 /nfs/dbraw/zinc/99/10/40/387991040.db2.gz BKPODQGDTSTVAM-SGMGOOAPSA-N 2 0 248.370 2.431 20 0 BEADRP C[NH2+]CCC[NH2+][C@H]1CCc2ccc(C)cc21 ZINC000423205056 387991723 /nfs/dbraw/zinc/99/17/23/387991723.db2.gz VEVOIQWSWGNLIL-AWEZNQCLSA-N 2 0 218.344 2.181 20 0 BEADRP CCCC[C@H](COC)[NH2+][C@@H]1CCCC[C@H]1[NH3+] ZINC000424366199 387991891 /nfs/dbraw/zinc/99/18/91/387991891.db2.gz IRPHPDLRBOJQAN-JHJVBQTASA-N 2 0 228.380 2.051 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CCCC[C@H]2[NH3+])C1 ZINC000424367791 387992373 /nfs/dbraw/zinc/99/23/73/387992373.db2.gz NVQUPGQWFQHGHG-YVECIDJPSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@H]1CCC[C@H]([NH2+][C@@H]2CCCC[C@H]2[NH3+])C1 ZINC000424367790 387992456 /nfs/dbraw/zinc/99/24/56/387992456.db2.gz NVQUPGQWFQHGHG-WUHRBBMRSA-N 2 0 210.365 2.425 20 0 BEADRP C[NH2+]CCC[NH2+][C@H]1CCc2c1cccc2C ZINC000423208512 387994186 /nfs/dbraw/zinc/99/41/86/387994186.db2.gz YVZVVENWKUJSHT-AWEZNQCLSA-N 2 0 218.344 2.181 20 0 BEADRP Cc1cccnc1[C@H]1CCC[C@@H]([NH2+]CCC[NH3+])C1 ZINC000423196600 387982061 /nfs/dbraw/zinc/98/20/61/387982061.db2.gz VQMSDFHMKOCHNL-UONOGXRCSA-N 2 0 247.386 2.355 20 0 BEADRP Cc1cccc(C[C@H]([NH2+]CCC[NH3+])C2CC2)c1 ZINC000423196629 387982429 /nfs/dbraw/zinc/98/24/29/387982429.db2.gz VTEPUSLKSHCMOG-HNNXBMFYSA-N 2 0 232.371 2.255 20 0 BEADRP Cc1ccc([C@@H]([NH2+]CCC[NH3+])C2CCC2)o1 ZINC000423196876 387982470 /nfs/dbraw/zinc/98/24/70/387982470.db2.gz WTQSODKNDKEVDF-ZDUSSCGKSA-N 2 0 222.332 2.368 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H](Cc1ccccc1)C(C)C ZINC000423198213 387983221 /nfs/dbraw/zinc/98/32/21/387983221.db2.gz DSGIQCUMPASXOK-HNNXBMFYSA-N 2 0 234.387 2.453 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1C[C@H](OCC(C)C)C1(C)C ZINC000423198063 387983968 /nfs/dbraw/zinc/98/39/68/387983968.db2.gz CUIFOYQCGAXFIM-OLZOCXBDSA-N 2 0 242.407 2.025 20 0 BEADRP C[NH2+]CCC[NH2+][C@H]1CCSc2ccccc21 ZINC000423198287 387984464 /nfs/dbraw/zinc/98/44/64/387984464.db2.gz FAPMXNPWXPJPSM-LBPRGKRZSA-N 2 0 236.384 2.423 20 0 BEADRP CC[C@H]([NH2+]CCC[NH2+]C)c1cccs1 ZINC000423198011 387984573 /nfs/dbraw/zinc/98/45/73/387984573.db2.gz CNRNBNZPDBITAQ-JTQLQIEISA-N 2 0 212.362 2.398 20 0 BEADRP CC[C@@H](N[C@@H]1CC[NH2+]C1)c1cccc(F)c1 ZINC000423212513 387995721 /nfs/dbraw/zinc/99/57/21/387995721.db2.gz JRZZTOXQPXNDGK-CHWSQXEVSA-N 2 0 222.307 2.228 20 0 BEADRP C[NH2+]CCC[NH2+][C@H]1CCC[C@@H](C(C)C)C1 ZINC000423198877 387985557 /nfs/dbraw/zinc/98/55/57/387985557.db2.gz IKJXCWCWDIXKRE-OLZOCXBDSA-N 2 0 212.381 2.400 20 0 BEADRP C[NH2+]CCC[NH2+][C@H](C)C1CCC(F)(F)CC1 ZINC000423199359 387986576 /nfs/dbraw/zinc/98/65/76/387986576.db2.gz JXAPWKMYEUPVOX-SNVBAGLBSA-N 2 0 234.334 2.400 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H](C)c1cc2c(s1)CCC2 ZINC000423200301 387986727 /nfs/dbraw/zinc/98/67/27/387986727.db2.gz LRFYFIPDQKRZQY-JTQLQIEISA-N 2 0 238.400 2.497 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CCC[NH2+]C1)C1CCSCC1 ZINC000423210085 387995846 /nfs/dbraw/zinc/99/58/46/387995846.db2.gz JPJSTADEPCQPIE-VXGBXAGGSA-N 2 0 242.432 2.107 20 0 BEADRP [NH3+][C@@H]1CCCC[C@H]1[NH2+][C@H]1CC[C@@H]1C1CCC1 ZINC000424372248 387997394 /nfs/dbraw/zinc/99/73/94/387997394.db2.gz HQVYXYPUTFJWRS-YIYPIFLZSA-N 2 0 222.376 2.425 20 0 BEADRP [NH3+][C@@H]1CCCC[C@H]1[NH2+][C@H]1CCc2ccccc2C1 ZINC000424374116 387998499 /nfs/dbraw/zinc/99/84/99/387998499.db2.gz YMVZMAKXQQQMFX-ARFHVFGLSA-N 2 0 244.382 2.403 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]C[C@@H]1C[C@H]1C1CCC1 ZINC000424375614 387998791 /nfs/dbraw/zinc/99/87/91/387998791.db2.gz KNWORQUUJAFXGG-AAXDQBDMSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCCC[C@H]1[NH3+])C1CCCC1 ZINC000424374022 387998799 /nfs/dbraw/zinc/99/87/99/387998799.db2.gz KPBQEQMSULYJBS-RAIGVLPGSA-N 2 0 210.365 2.425 20 0 BEADRP CC(C)CC[C@H]([NH2+][C@H]1CC[NH2+]C1)C1CC1 ZINC000423216999 387999182 /nfs/dbraw/zinc/99/91/82/387999182.db2.gz RCAGKLJZFRCENM-STQMWFEESA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@@H]([NH2+]C[C@H]2CCC[NH2+]C2)C1 ZINC000423216377 387999851 /nfs/dbraw/zinc/99/98/51/387999851.db2.gz RUXOWTVGXJXQJI-RFGFWPKPSA-N 2 0 224.392 2.400 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+][C@@H](C)[C@H]1CCC[NH2+]C1 ZINC000423216869 388000518 /nfs/dbraw/zinc/00/05/18/388000518.db2.gz PFUIWXFGHZXKSF-RNJOBUHISA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1C[C@H]1C1CCC1)[C@@H]1CCC[NH2+]1 ZINC000424382586 388000932 /nfs/dbraw/zinc/00/09/32/388000932.db2.gz SFNKNGPBJLGTCI-PYJNHQTQSA-N 2 0 222.376 2.153 20 0 BEADRP CC(C)[C@H]([NH2+]CC[C@H](C)[NH3+])c1ccc(F)cn1 ZINC000423222436 388001813 /nfs/dbraw/zinc/00/18/13/388001813.db2.gz AYPHTMBCYVZQHT-GWCFXTLKSA-N 2 0 239.338 2.245 20 0 BEADRP CC(C)CO[C@@H]1C[C@H]([NH2+]CC[C@H](C)[NH3+])C1(C)C ZINC000423223346 388004445 /nfs/dbraw/zinc/00/44/45/388004445.db2.gz GCNUALCOZHTVAF-RWMBFGLXSA-N 2 0 242.407 2.153 20 0 BEADRP CC[C@@H]([NH2+]CC[C@@H](C)[NH3+])c1ccccc1OC ZINC000423223661 388005566 /nfs/dbraw/zinc/00/55/66/388005566.db2.gz HBCHXQAZKFLLJM-DGCLKSJQSA-N 2 0 236.359 2.473 20 0 BEADRP CCc1cccnc1[C@@H](C)[NH2+]CC[C@H](C)[NH3+] ZINC000423223960 388005570 /nfs/dbraw/zinc/00/55/70/388005570.db2.gz IBUOPJRDMAXGCQ-WDEREUQCSA-N 2 0 221.348 2.032 20 0 BEADRP Cc1c([C@@H](C)[NH2+]CC[C@H](C)[NH3+])cnn1C(C)C ZINC000423223443 388005766 /nfs/dbraw/zinc/00/57/66/388005766.db2.gz GNFOLFDBYBNVDD-WDEREUQCSA-N 2 0 238.379 2.160 20 0 BEADRP CC[C@H]([NH2+]CC[C@H](C)[NH3+])c1ccccc1OC ZINC000423223660 388006410 /nfs/dbraw/zinc/00/64/10/388006410.db2.gz HBCHXQAZKFLLJM-AAEUAGOBSA-N 2 0 236.359 2.473 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H]1c2ccccc2C[C@H]1C ZINC000423224182 388006424 /nfs/dbraw/zinc/00/64/24/388006424.db2.gz ILHVNIHLEJCRTA-SUNKGSAMSA-N 2 0 218.344 2.247 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H](C)c1cc(F)cc(F)c1 ZINC000423226002 388009025 /nfs/dbraw/zinc/00/90/25/388009025.db2.gz PAWSTNPENIAVAH-IUCAKERBSA-N 2 0 228.286 2.353 20 0 BEADRP CC[C@H]([NH2+]CC[C@H](C)[NH3+])c1ccccc1 ZINC000423240889 388024458 /nfs/dbraw/zinc/02/44/58/388024458.db2.gz XPOYYACVPKCLKQ-AAEUAGOBSA-N 2 0 206.333 2.465 20 0 BEADRP FCCC[C@@H]1CCC[C@@H]1[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000423241593 388024964 /nfs/dbraw/zinc/02/49/64/388024964.db2.gz DIKAIMKNCXBSCC-IHRRRGAJSA-N 2 0 242.382 2.494 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1ccsc1 ZINC000423243111 388025570 /nfs/dbraw/zinc/02/55/70/388025570.db2.gz GFYUPFUGZDHEPI-QWRGUYRKSA-N 2 0 224.373 2.398 20 0 BEADRP CC[C@H](C)C[N@@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000246151567 388013783 /nfs/dbraw/zinc/01/37/83/388013783.db2.gz CDPFHFWLGWJEDL-KBPBESRZSA-N 2 0 224.392 2.450 20 0 BEADRP C[C@H](C[NH2+][C@@H](C1CC1)C1CCC1)C[NH+](C)C ZINC000453224462 388014750 /nfs/dbraw/zinc/01/47/50/388014750.db2.gz AXGZAGOPMIHUOA-BXUZGUMPSA-N 2 0 224.392 2.352 20 0 BEADRP COc1cccc2c1CC[C@H]2[NH2+]CC[C@H](C)[NH3+] ZINC000423229649 388015713 /nfs/dbraw/zinc/01/57/13/388015713.db2.gz HMIJQRIAPMJNKP-GXFFZTMASA-N 2 0 234.343 2.009 20 0 BEADRP COc1ccc2c(c1)CCC[C@@H]2[NH2+]CC[C@H](C)[NH3+] ZINC000423238489 388022595 /nfs/dbraw/zinc/02/25/95/388022595.db2.gz VEYRPILJMXKZMV-NHYWBVRUSA-N 2 0 248.370 2.400 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@@H]([NH2+]CC[C@H]2CC[NH2+]C2)C1 ZINC000423252072 388033659 /nfs/dbraw/zinc/03/36/59/388033659.db2.gz TULHNNKOBXLWIT-RQJABVFESA-N 2 0 224.392 2.400 20 0 BEADRP Cc1cccc(NCC[C@H]2CCC[NH2+]C2)[nH+]1 ZINC000082486986 388035004 /nfs/dbraw/zinc/03/50/04/388035004.db2.gz UBAIRUPRWHRVMV-GFCCVEGCSA-N 2 0 219.332 2.192 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H](C)c1ccccc1 ZINC000423255729 388036538 /nfs/dbraw/zinc/03/65/38/388036538.db2.gz APXJSANXXIKPMG-RYUDHWBXSA-N 2 0 206.333 2.193 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+]CC[C@H]2CC[NH2+]C2)o1 ZINC000423254671 388036729 /nfs/dbraw/zinc/03/67/29/388036729.db2.gz ZBZPXVPZPMOUID-VXGBXAGGSA-N 2 0 222.332 2.238 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H]1CCCc2ccc(O)cc21 ZINC000423255504 388036921 /nfs/dbraw/zinc/03/69/21/388036921.db2.gz AGODOKZPSFVGLI-ABAIWWIYSA-N 2 0 248.370 2.215 20 0 BEADRP C(C[C@@H]1CC[NH2+]C1)[NH2+][C@H]1CC[C@H]1C1CCC1 ZINC000423254658 388037352 /nfs/dbraw/zinc/03/73/52/388037352.db2.gz ZAUPHIXDTWQPGL-UBHSHLNASA-N 2 0 222.376 2.154 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H]1CCCc2ccc(O)cc21 ZINC000423255506 388037680 /nfs/dbraw/zinc/03/76/80/388037680.db2.gz AGODOKZPSFVGLI-NHYWBVRUSA-N 2 0 248.370 2.215 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)c1ccncc1 ZINC000423262281 388040412 /nfs/dbraw/zinc/04/04/12/388040412.db2.gz UXLDJUJEJIWGJF-OLZOCXBDSA-N 2 0 233.359 2.122 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)c1cccc(O)c1 ZINC000423262074 388040995 /nfs/dbraw/zinc/04/09/95/388040995.db2.gz UFIFDLUSJGINLH-OLZOCXBDSA-N 2 0 248.370 2.433 20 0 BEADRP CC(C)C[C@H](C[NH3+])N[C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000423264671 388042068 /nfs/dbraw/zinc/04/20/68/388042068.db2.gz QAJGXMMLCKGGRJ-DFBGVHRSSA-N 2 0 247.386 2.094 20 0 BEADRP C[C@@H]1CC(C)(C)C[C@@H]1[NH2+]C[C@H]1CCC[NH2+]1 ZINC000423243448 388026420 /nfs/dbraw/zinc/02/64/20/388026420.db2.gz WNMNJRBDSQDEOT-UTUOFQBUSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1cccc(O)c1 ZINC000423244176 388027617 /nfs/dbraw/zinc/02/76/17/388027617.db2.gz HJULLOHJBBONJR-RYUDHWBXSA-N 2 0 234.343 2.042 20 0 BEADRP C(C[C@H]1CC[NH2+]C1)[NH2+][C@H]1CCCC12CCC2 ZINC000423245482 388028149 /nfs/dbraw/zinc/02/81/49/388028149.db2.gz JAJHSXVTQRBDAK-OLZOCXBDSA-N 2 0 222.376 2.298 20 0 BEADRP FCCC[C@@H]1CCC[C@H]1[NH2+]C[C@H]1CCC[NH2+]1 ZINC000423245964 388028928 /nfs/dbraw/zinc/02/89/28/388028928.db2.gz YZJSTHJMJJBSPV-YNEHKIRRSA-N 2 0 228.355 2.246 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CC[NH2+]C1)C1CCSCC1 ZINC000423245471 388029030 /nfs/dbraw/zinc/02/90/30/388029030.db2.gz IZYUDMRPJLMEBA-NEPJUHHUSA-N 2 0 242.432 2.107 20 0 BEADRP c1ccc2c(c1)CC[C@@H]2[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000423246073 388030525 /nfs/dbraw/zinc/03/05/25/388030525.db2.gz JUPKWHWOKXGBKQ-WFASDCNBSA-N 2 0 230.355 2.263 20 0 BEADRP CCc1cccnc1[C@@H](C)[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000423248746 388031143 /nfs/dbraw/zinc/03/11/43/388031143.db2.gz NSFWFAOMQGTTNS-CHWSQXEVSA-N 2 0 247.386 2.294 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1cccc(F)c1 ZINC000423249733 388031332 /nfs/dbraw/zinc/03/13/32/388031332.db2.gz PNSFGZWHBZQLRZ-VXGBXAGGSA-N 2 0 236.334 2.476 20 0 BEADRP C(C[C@H]1CC[NH2+]C1)[NH2+][C@@H]1CCC12CCCC2 ZINC000423249317 388031539 /nfs/dbraw/zinc/03/15/39/388031539.db2.gz OQDYFABIYFDMJD-CHWSQXEVSA-N 2 0 222.376 2.298 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+][C@H](C)CCCc1cccnc1 ZINC000423274166 388054431 /nfs/dbraw/zinc/05/44/31/388054431.db2.gz LMVNKUUYRSXIIJ-HIFRSBDPSA-N 2 0 249.402 2.366 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H](c1cccnc1)C1CCC1 ZINC000423274349 388054912 /nfs/dbraw/zinc/05/49/12/388054912.db2.gz MAEQWABKMGQBLA-SWLSCSKDSA-N 2 0 247.386 2.368 20 0 BEADRP CC(C)[C@@H]1C[C@H]1C[NH2+][C@@H]1CC[N@H+](C)C[C@@H]1C ZINC000453350585 388055734 /nfs/dbraw/zinc/05/57/34/388055734.db2.gz LOJOATCZCYOPRJ-XDQVBPFNSA-N 2 0 224.392 2.208 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+][C@@H]1C[C@H](C)CC[C@@H]1C ZINC000423276323 388057141 /nfs/dbraw/zinc/05/71/41/388057141.db2.gz OINRAWBGDKLEMJ-MROQNXINSA-N 2 0 212.381 2.384 20 0 BEADRP C([C@@H]1CCC[NH2+]C1)[N@@H+]1CCC[C@H]2CCC[C@H]21 ZINC000083701085 388059044 /nfs/dbraw/zinc/05/90/44/388059044.db2.gz OKPGHPGGXNNHFU-MGPQQGTHSA-N 2 0 222.376 2.251 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H](C)c1ccc(OC)cc1 ZINC000423278154 388059127 /nfs/dbraw/zinc/05/91/27/388059127.db2.gz QPHNOPFKDYOYQV-NEPJUHHUSA-N 2 0 236.359 2.201 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CCCC12CCC2 ZINC000423278847 388059576 /nfs/dbraw/zinc/05/95/76/388059576.db2.gz RRVRPTFNQCKTRO-NWDGAFQWSA-N 2 0 210.365 2.154 20 0 BEADRP C(C1CC[NH2+]CC1)[N@@H+]1CCC[C@@H]2CCC[C@H]21 ZINC000083701135 388059538 /nfs/dbraw/zinc/05/95/38/388059538.db2.gz IRPUNYSVHOHOHY-UONOGXRCSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@@H](Cc1ccoc1)[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000423278797 388060313 /nfs/dbraw/zinc/06/03/13/388060313.db2.gz ROROXPYLLZZZQA-QWHCGFSZSA-N 2 0 236.359 2.190 20 0 BEADRP C[C@@H](Cc1ccoc1)[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000423278798 388061041 /nfs/dbraw/zinc/06/10/41/388061041.db2.gz ROROXPYLLZZZQA-STQMWFEESA-N 2 0 236.359 2.190 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCC[NH2+]C1)[C@@H]1CC1(C)C ZINC000423280045 388061802 /nfs/dbraw/zinc/06/18/02/388061802.db2.gz UEKPTWDEHQGJEX-XQQFMLRXSA-N 2 0 224.392 2.400 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CCc2c1cccc2C ZINC000423280982 388062069 /nfs/dbraw/zinc/06/20/69/388062069.db2.gz VEJIDOJAAJUFQS-XHDPSFHLSA-N 2 0 232.371 2.427 20 0 BEADRP CCC[C@@H]([NH2+]C[C@@H](C)C[NH2+]C)c1cccnc1 ZINC000423279968 388062467 /nfs/dbraw/zinc/06/24/67/388062467.db2.gz TVRCPUJJHXQXHD-GXTWGEPZSA-N 2 0 235.375 2.368 20 0 BEADRP CCC[C@@H]([NH2+]C[C@@H](C)C[NH2+]C)C1CCC1 ZINC000423280639 388062475 /nfs/dbraw/zinc/06/24/75/388062475.db2.gz VAPKRCHQNGAOLU-WCQYABFASA-N 2 0 212.381 2.400 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H]1CCc2c1cccc2C ZINC000423280980 388062535 /nfs/dbraw/zinc/06/25/35/388062535.db2.gz VEJIDOJAAJUFQS-IAQYHMDHSA-N 2 0 232.371 2.427 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H]1CCc2ccccc21 ZINC000423280975 388062747 /nfs/dbraw/zinc/06/27/47/388062747.db2.gz VDDNNUPBQLODLY-FZMZJTMJSA-N 2 0 218.344 2.119 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]C1C2CC3CC(C2)CC1C3 ZINC000423282007 388063684 /nfs/dbraw/zinc/06/36/84/388063684.db2.gz WEELCLMYPRHSEP-GFSREQAASA-N 2 0 236.403 2.256 20 0 BEADRP CC(C)([NH3+])C[NH2+][C@H](Cc1ccccc1)C1CC1 ZINC000423281844 388064167 /nfs/dbraw/zinc/06/41/67/388064167.db2.gz CABNJVZLJDBYHF-CQSZACIVSA-N 2 0 232.371 2.335 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H](C1CC1)C1CCC1 ZINC000423282367 388065095 /nfs/dbraw/zinc/06/50/95/388065095.db2.gz WLLHVLTXLWESNK-MFKMUULPSA-N 2 0 210.365 2.010 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H](C1CC1)C1CCCC1 ZINC000423283118 388065113 /nfs/dbraw/zinc/06/51/13/388065113.db2.gz XFRSNHLYAAVQPN-SMDDNHRTSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCCC[N@H+](C)C2CC2)[C@H](C)O1 ZINC000453389446 388066853 /nfs/dbraw/zinc/06/68/53/388066853.db2.gz CKGXFVVMLJCCNM-DYEKYZERSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)[C@H]1C[C@H]1C ZINC000423284666 388067515 /nfs/dbraw/zinc/06/75/15/388067515.db2.gz YRCUSVNRAQHQKY-VOAKCMCISA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCCC[N@H+](C)C2CC2)[C@H](C)O1 ZINC000453389447 388068003 /nfs/dbraw/zinc/06/80/03/388068003.db2.gz CKGXFVVMLJCCNM-MBNYWOFBSA-N 2 0 240.391 2.016 20 0 BEADRP CC(C)[C@H]([NH2+][C@@H]1CCC[C@@H]([NH3+])C1)C1CC1 ZINC000324224229 388114636 /nfs/dbraw/zinc/11/46/36/388114636.db2.gz FXFZDSNPFXYDOE-UPJWGTAASA-N 2 0 210.365 2.281 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+][C@H]1CC=CCC1 ZINC000084066791 388070954 /nfs/dbraw/zinc/07/09/54/388070954.db2.gz XEADMHTWLUHBPI-YIYPIFLZSA-N 2 0 222.376 2.413 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCCC[C@@H]1C[NH3+])c1ccco1 ZINC000084216002 388073199 /nfs/dbraw/zinc/07/31/99/388073199.db2.gz GAMGJRLKUVMGSE-QJPTWQEYSA-N 2 0 222.332 2.448 20 0 BEADRP CCC([NH3+])(CC)C[NH2+][C@@H](COC)C1CCCC1 ZINC000423288593 388073144 /nfs/dbraw/zinc/07/31/44/388073144.db2.gz TWRCTSQXNIDFFC-ZDUSSCGKSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@@H](CCCc1cccnc1)[NH2+]CC(C)(C)[NH3+] ZINC000423288768 388073484 /nfs/dbraw/zinc/07/34/84/388073484.db2.gz UWTZNLDHISCAGR-LBPRGKRZSA-N 2 0 235.375 2.120 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+]Cc1ccccc1 ZINC000084215452 388073768 /nfs/dbraw/zinc/07/37/68/388073768.db2.gz AQVMHPUPDGCRMP-KGLIPLIRSA-N 2 0 218.344 2.294 20 0 BEADRP CCC([NH3+])(CC)CN[C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000423290026 388074125 /nfs/dbraw/zinc/07/41/25/388074125.db2.gz CABLLSCIVSBMSA-UONOGXRCSA-N 2 0 247.386 2.238 20 0 BEADRP CCO[C@@H]1C[C@H]([NH2+]CC(C)(C)[NH3+])C12CCCC2 ZINC000423289594 388074386 /nfs/dbraw/zinc/07/43/86/388074386.db2.gz XUQKDOFLRKUHPN-NWDGAFQWSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CCCc1ccccc1 ZINC000336658397 388074997 /nfs/dbraw/zinc/07/49/97/388074997.db2.gz MTHQZPBFTLFRSA-CYBMUJFWSA-N 2 0 220.360 2.336 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]Cc1cccc(F)c1 ZINC000084218471 388075247 /nfs/dbraw/zinc/07/52/47/388075247.db2.gz ILKOPSIHLNOYFY-WCQYABFASA-N 2 0 222.307 2.043 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H](C)c1cc2c(s1)CCC2 ZINC000423294814 388077104 /nfs/dbraw/zinc/07/71/04/388077104.db2.gz CUFCCGPWYUAFDK-ZJUUUORDSA-N 2 0 238.400 2.482 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@@H](C)c1ccc2c(c1)CCC2 ZINC000423294444 388077222 /nfs/dbraw/zinc/07/72/22/388077222.db2.gz BYUKXNVXSJSLGB-RYUDHWBXSA-N 2 0 232.371 2.421 20 0 BEADRP C[C@@H]([NH2+]C[C@@H](C)C[NH3+])c1ccc2c(c1)CCC2 ZINC000423294443 388077293 /nfs/dbraw/zinc/07/72/93/388077293.db2.gz BYUKXNVXSJSLGB-NWDGAFQWSA-N 2 0 232.371 2.421 20 0 BEADRP CCC[NH2+]CC[NH2+]C1CCC2(CC2)CC1 ZINC000423295461 388077538 /nfs/dbraw/zinc/07/75/38/388077538.db2.gz AMVPQDXMWVCUIV-UHFFFAOYSA-N 2 0 210.365 2.298 20 0 BEADRP CCc1nc(C)c([C@H](C)[NH2+]C[C@H](C)C[NH3+])s1 ZINC000423295547 388077698 /nfs/dbraw/zinc/07/76/98/388077698.db2.gz FCRMAJBFRHSWLK-BDAKNGLRSA-N 2 0 241.404 2.259 20 0 BEADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H]2CCOC[C@H]2C)cc1 ZINC000423296458 388078684 /nfs/dbraw/zinc/07/86/84/388078684.db2.gz ZHNRDBPMJMFMON-TYNCELHUSA-N 2 0 248.370 2.221 20 0 BEADRP CCC[C@H]([NH2+]C[C@H](C)C[NH3+])c1cccnc1 ZINC000423298433 388080306 /nfs/dbraw/zinc/08/03/06/388080306.db2.gz AACGURXOQKDCDV-YPMHNXCESA-N 2 0 221.348 2.107 20 0 BEADRP Cc1ccc2c(c1)OCCC[C@@H]2[NH2+]C[C@H](C)C[NH3+] ZINC000423298389 388080311 /nfs/dbraw/zinc/08/03/11/388080311.db2.gz OGAFVDWBLDBRED-OCCSQVGLSA-N 2 0 248.370 2.393 20 0 BEADRP Cc1ccccc1C[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000086403264 388101326 /nfs/dbraw/zinc/10/13/26/388101326.db2.gz JKIYZIXUMKZRHK-KGLIPLIRSA-N 2 0 218.344 2.355 20 0 BEADRP Cc1ccccc1C[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000086403262 388101352 /nfs/dbraw/zinc/10/13/52/388101352.db2.gz JKIYZIXUMKZRHK-ZIAGYGMSSA-N 2 0 218.344 2.355 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]Cc2ccccc2)C1 ZINC000086401669 388101540 /nfs/dbraw/zinc/10/15/40/388101540.db2.gz CRTKMMPQFUSCPW-QWHCGFSZSA-N 2 0 204.317 2.046 20 0 BEADRP CSCCC[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000086494486 388104009 /nfs/dbraw/zinc/10/40/09/388104009.db2.gz WXTWDRARRHDWTH-UPJWGTAASA-N 2 0 242.432 2.250 20 0 BEADRP C(C[N@@H+]1C[C@@H]2CCC[C@@H]2C1)[C@@H]1CCC[NH2+]C1 ZINC000162728888 388106792 /nfs/dbraw/zinc/10/67/92/388106792.db2.gz DNFGVZUXGHICIJ-MELADBBJSA-N 2 0 222.376 2.108 20 0 BEADRP CC(C)[C@@H](C)[N@H+](CC1CC[NH2+]CC1)C1CC1 ZINC000086702082 388107144 /nfs/dbraw/zinc/10/71/44/388107144.db2.gz CCBOMXSBPVNABF-GFCCVEGCSA-N 2 0 224.392 2.495 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H]2CCCOCC2)CC1 ZINC000086870143 388109353 /nfs/dbraw/zinc/10/93/53/388109353.db2.gz KFAZXWBXDZJNHN-CYBMUJFWSA-N 2 0 240.391 2.020 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@H]2CS[C@H](C)C2)CC1 ZINC000086934588 388110878 /nfs/dbraw/zinc/11/08/78/388110878.db2.gz FHDANSFJEHFFIG-DGCLKSJQSA-N 2 0 242.432 2.343 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H]1CCc2ccc(OC)cc21 ZINC000423267416 388045361 /nfs/dbraw/zinc/04/53/61/388045361.db2.gz DYWAKBKYFUQDJT-IAQYHMDHSA-N 2 0 248.370 2.128 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H](C)c1ccccc1N(C)C ZINC000423267471 388045891 /nfs/dbraw/zinc/04/58/91/388045891.db2.gz FEKBXOUWFPUFOO-QWHCGFSZSA-N 2 0 249.402 2.259 20 0 BEADRP C[C@H]([NH2+][C@H]1CCCC[C@@H]1C[NH3+])c1cncs1 ZINC000423269384 388047520 /nfs/dbraw/zinc/04/75/20/388047520.db2.gz FQVNWYGHEWNFGA-AXFHLTTASA-N 2 0 239.388 2.311 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+]CCC[NH+]1CCCC1 ZINC000449219526 388159129 /nfs/dbraw/zinc/15/91/29/388159129.db2.gz NPAMLZYOVROJQQ-CYBMUJFWSA-N 2 0 236.359 2.286 20 0 BEADRP C[C@@H]1CN(C2CC2)C[C@@H]1[NH2+]CCC(C)(F)F ZINC000449355257 388180839 /nfs/dbraw/zinc/18/08/39/388180839.db2.gz XIFFKZJFDSJSDQ-KOLCDFICSA-N 2 0 232.318 2.104 20 0 BEADRP CC[C@@H]([NH2+][C@H]1CCC[NH2+]CC1)C1CCC1 ZINC000324875047 388125502 /nfs/dbraw/zinc/12/55/02/388125502.db2.gz CPDSLZNPEKIOKM-QWHCGFSZSA-N 2 0 210.365 2.297 20 0 BEADRP COCC[N@H+](C)CCC[NH2+][C@@H](C)CC(C)(C)C ZINC000449076457 388139956 /nfs/dbraw/zinc/13/99/56/388139956.db2.gz HMVQNIOBLRQHTP-ZDUSSCGKSA-N 2 0 244.423 2.369 20 0 BEADRP CCC[NH2+][C@H](C)C(=O)Nc1ccc([C@@H](C)[NH3+])cc1 ZINC000449124152 388145432 /nfs/dbraw/zinc/14/54/32/388145432.db2.gz FSTBTXRWDFTCGE-GHMZBOCLSA-N 2 0 249.358 2.033 20 0 BEADRP CC[N@@H+]1CC[C@@H](NCc2ccnc(C)c2)[C@H](C)C1 ZINC000449402887 388195512 /nfs/dbraw/zinc/19/55/12/388195512.db2.gz NQMREMRKCPZOHM-IUODEOHRSA-N 2 0 247.386 2.210 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+][C@H](C)C2CC2)[C@@H](C)C1 ZINC000449440038 388206885 /nfs/dbraw/zinc/20/68/85/388206885.db2.gz KAAVRKKGRUQBIK-DMDPSCGWSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@H]1C[C@H]1C[NH2+]C(C)(C)CCC[NH+](C)C ZINC000449529814 388217231 /nfs/dbraw/zinc/21/72/31/388217231.db2.gz ZZSFSOVEFXURAK-RYUDHWBXSA-N 2 0 212.381 2.352 20 0 BEADRP C[N@H+](CC[C@@H]1CCC[NH+]1C)[C@H]1CC1(C)C ZINC000489515942 388219277 /nfs/dbraw/zinc/21/92/77/388219277.db2.gz PEKPTJVOGGHHIO-RYUDHWBXSA-N 2 0 210.365 2.201 20 0 BEADRP C[C@@H](Cc1ccoc1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000449561258 388232531 /nfs/dbraw/zinc/23/25/31/388232531.db2.gz TWGOTNVPZXUEOL-PRTUASRFSA-N 2 0 248.370 2.425 20 0 BEADRP CC[C@H]1CC[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000449561478 388232677 /nfs/dbraw/zinc/23/26/77/388232677.db2.gz VNWBGGMUHYIRLH-APYLGABCSA-N 2 0 222.376 2.390 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000449561480 388232789 /nfs/dbraw/zinc/23/27/89/388232789.db2.gz VNWBGGMUHYIRLH-RKFYDKJMSA-N 2 0 222.376 2.390 20 0 BEADRP C[C@H](CN)[NH2+][C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000235460235 388369441 /nfs/dbraw/zinc/36/94/41/388369441.db2.gz JCMULZMCBMJUIK-IWSPIJDZSA-N 2 0 224.270 2.044 20 0 BEADRP C[C@H](C[NH3+])N[C@H](C)c1ccc(Cl)s1 ZINC000235462165 388369613 /nfs/dbraw/zinc/36/96/13/388369613.db2.gz NAJHOUWOCXZKOB-RNFRBKRXSA-N 2 0 218.753 2.399 20 0 BEADRP C[C@@H](O)[C@H](C)[NH2+]CCCCC[NH+]1CCCCC1 ZINC000572752016 388373187 /nfs/dbraw/zinc/37/31/87/388373187.db2.gz YQTIIXBXASPRER-UONOGXRCSA-N 2 0 242.407 2.002 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC2CCSCC2)CC[N@@H+]1C ZINC000133657895 388388551 /nfs/dbraw/zinc/38/85/51/388388551.db2.gz HSGPWRDXQASNIR-DGCLKSJQSA-N 2 0 242.432 2.202 20 0 BEADRP C([NH2+][C@H](C1CC1)C1CCC1)C1CC[NH2+]CC1 ZINC000324787172 388389729 /nfs/dbraw/zinc/38/97/29/388389729.db2.gz IOCPDSKGXAGESK-AWEZNQCLSA-N 2 0 222.376 2.154 20 0 BEADRP c1ccc(C[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)cc1 ZINC000252674329 388455323 /nfs/dbraw/zinc/45/53/23/388455323.db2.gz QFWSRKSYZUNQFS-GJZGRUSLSA-N 2 0 230.355 2.403 20 0 BEADRP c1ccc(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)cc1 ZINC000252674328 388455340 /nfs/dbraw/zinc/45/53/40/388455340.db2.gz QFWSRKSYZUNQFS-CABCVRRESA-N 2 0 230.355 2.403 20 0 BEADRP Cc1ccc(C[N@@H+]2C[C@H](C[NH3+])[C@@H](C)C[C@H]2C)nc1 ZINC000397264796 388455548 /nfs/dbraw/zinc/45/55/48/388455548.db2.gz IQWDKXVMOISJGX-MJBXVCDLSA-N 2 0 247.386 2.195 20 0 BEADRP Cc1ncccc1C[N@@H+]1C[C@H](C[NH3+])[C@H](C)C[C@H]1C ZINC000397264293 388455960 /nfs/dbraw/zinc/45/59/60/388455960.db2.gz IOWKMBYEMAIDHS-JMSVASOKSA-N 2 0 247.386 2.195 20 0 BEADRP CCC[C@@H](C)C[N@H+]1CC[C@H]2C[NH2+]C[C@H]2CC1 ZINC000309532862 388456645 /nfs/dbraw/zinc/45/66/45/388456645.db2.gz WKOATDYKFWGMSH-MCIONIFRSA-N 2 0 224.392 2.354 20 0 BEADRP CCC[C@H](C)C[N@H+]1CC[C@H]2C[NH2+]C[C@H]2CC1 ZINC000309532863 388456705 /nfs/dbraw/zinc/45/67/05/388456705.db2.gz WKOATDYKFWGMSH-MELADBBJSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]CCCC(F)(F)F ZINC000336696436 388463110 /nfs/dbraw/zinc/46/31/10/388463110.db2.gz TWGPZRZBKNJZSW-QMMMGPOBSA-N 2 0 212.259 2.046 20 0 BEADRP CC(C)[C@@H]1CCCC[C@@H]1[NH2+]C[C@H](C)C[NH3+] ZINC000336693619 388463448 /nfs/dbraw/zinc/46/34/48/388463448.db2.gz NJKIIFQVBKJLGC-AGIUHOORSA-N 2 0 212.381 2.386 20 0 BEADRP CCN1CCC[C@H]1C[NH2+][C@H]1CCC1(C)C ZINC000336703123 388465186 /nfs/dbraw/zinc/46/51/86/388465186.db2.gz QIJWIZOSUYZRHM-RYUDHWBXSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CCc1ccsc1 ZINC000336716376 388467786 /nfs/dbraw/zinc/46/77/86/388467786.db2.gz XGFARJWSNDVFLO-NSHDSACASA-N 2 0 226.389 2.398 20 0 BEADRP CCS[C@@H]1CC[C@@H]([N@H+](C)CCC[NH2+]C)C1 ZINC000336719422 388468099 /nfs/dbraw/zinc/46/80/99/388468099.db2.gz YEMQVQMZHDTJJW-VXGBXAGGSA-N 2 0 230.421 2.202 20 0 BEADRP C[C@@H]([NH2+]C[C@H](C)C[NH+](C)C)C1CCSCC1 ZINC000336725244 388470431 /nfs/dbraw/zinc/47/04/31/388470431.db2.gz BKNZYWTYRZXGBA-NWDGAFQWSA-N 2 0 244.448 2.305 20 0 BEADRP CCC[NH+](CCC)CCC[NH2+]CC1(O)CCC1 ZINC000573083664 388418915 /nfs/dbraw/zinc/41/89/15/388418915.db2.gz AKVHBYQYOHDWBT-UHFFFAOYSA-N 2 0 242.407 2.003 20 0 BEADRP Cc1cnccc1C[NH2+]C[C@@H](C)C[NH+]1CCCC1 ZINC000296413381 388422491 /nfs/dbraw/zinc/42/24/91/388422491.db2.gz MDWYCZJWDFHFBK-CYBMUJFWSA-N 2 0 247.386 2.212 20 0 BEADRP CC[C@@H](C)[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000166321077 388424788 /nfs/dbraw/zinc/42/47/88/388424788.db2.gz OCMUBIISZKNONS-LLVKDONJSA-N 2 0 210.365 2.249 20 0 BEADRP CCc1cc(N[C@@H](C)C[NH+](C)C)cc[nH+]1 ZINC000307778481 388426880 /nfs/dbraw/zinc/42/68/80/388426880.db2.gz VWYPXDXHPHRLDV-JTQLQIEISA-N 2 0 207.321 2.006 20 0 BEADRP CC(C)C[C@@H]1CC[N@H+](CC[C@@H]2CC[NH2+]C2)C1 ZINC000307824514 388427701 /nfs/dbraw/zinc/42/77/01/388427701.db2.gz XIOYNJJQUXQFRW-KBPBESRZSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1COc2ccccc2C1 ZINC000336887904 388429881 /nfs/dbraw/zinc/42/98/81/388429881.db2.gz DOMQDECYEBYOGZ-OCCSQVGLSA-N 2 0 248.370 2.097 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+][C@@H]1CCC[C@@H]([NH3+])C1)CO2 ZINC000514872998 256725670 /nfs/dbraw/zinc/72/56/70/256725670.db2.gz MBICGTGEQROHBD-YRGRVCCFSA-N 2 0 246.354 2.288 20 0 BEADRP CCC[NH+]1CCC([NH2+]C[C@@](C)(CC)OC)CC1 ZINC000322548012 388437907 /nfs/dbraw/zinc/43/79/07/388437907.db2.gz UVXAIDHDTCYPQV-CQSZACIVSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CCCc1cccs1 ZINC000517123141 388538043 /nfs/dbraw/zinc/53/80/43/388538043.db2.gz WPYIASBXQIQRGC-QWRGUYRKSA-N 2 0 226.389 2.396 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CCCc1cccs1 ZINC000517123140 388538741 /nfs/dbraw/zinc/53/87/41/388538741.db2.gz WPYIASBXQIQRGC-MNOVXSKESA-N 2 0 226.389 2.396 20 0 BEADRP Cn1cncc1CCC[N@@H+]1CCCC2(CC2)C1 ZINC000517167937 388540974 /nfs/dbraw/zinc/54/09/74/388540974.db2.gz BWIWOEABUQZIKQ-UHFFFAOYSA-N 2 0 233.359 2.229 20 0 BEADRP F[C@@H]1CCC[C@@H]1N[C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000340529479 388492664 /nfs/dbraw/zinc/49/26/64/388492664.db2.gz JVIAENNPGYMVAX-XQHKEYJVSA-N 2 0 226.339 2.093 20 0 BEADRP CO[C@H](C[NH2+]C1CC[NH+](C(C)C)CC1)C(C)C ZINC000341284430 388494969 /nfs/dbraw/zinc/49/49/69/388494969.db2.gz PUPXEXYHHOIPRA-CQSZACIVSA-N 2 0 242.407 2.120 20 0 BEADRP C1[C@@H]2C[C@@H]([NH2+][C@H]3CC[N@@H+]4CCC[C@@H]4C3)C[C@H]12 ZINC000397749363 388496475 /nfs/dbraw/zinc/49/64/75/388496475.db2.gz OQNQRWGVYOPSGC-ZUWCUPBKSA-N 2 0 220.360 2.001 20 0 BEADRP CC(C)C[C@H]1CCC[N@@H+]1C[C@@H]1CCC[NH2+]C1 ZINC000346832535 388520448 /nfs/dbraw/zinc/52/04/48/388520448.db2.gz QXEGAEZHXGSDSM-ZIAGYGMSSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[N@@H+]1C[C@@H]2CC[C@@H]([NH3+])[C@@H]2C1 ZINC000346842709 388520508 /nfs/dbraw/zinc/52/05/08/388520508.db2.gz IKDRWOKRBYQDHF-UXXRCYHCSA-N 2 0 236.403 2.482 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CC[N@H+](C[C@H]2CCCC[C@@H]2C)C1 ZINC000346663851 388520821 /nfs/dbraw/zinc/52/08/21/388520821.db2.gz XDRUCEFOGTUPED-IGQOVBAYSA-N 2 0 224.392 2.482 20 0 BEADRP CC[C@@H]1CCC[C@H](C[N@@H+]2CC[C@H](C[NH3+])C2)C1 ZINC000347093875 388521716 /nfs/dbraw/zinc/52/17/16/388521716.db2.gz GUQGYRUDRCRMGF-HZSPNIEDSA-N 2 0 224.392 2.483 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@@H](C)Cc1ccsc1 ZINC000516958064 388528989 /nfs/dbraw/zinc/52/89/89/388528989.db2.gz YNKHQQNHILPZAV-CMPLNLGQSA-N 2 0 226.389 2.252 20 0 BEADRP C/C(Cl)=C/CN1[C@@H]2CC[C@H]1CC[N@@H+](C)C2 ZINC000528508129 388536482 /nfs/dbraw/zinc/53/64/82/388536482.db2.gz LQTDRZCBVWQJKI-JUYDSFNJSA-N 2 0 228.767 2.298 20 0 BEADRP CC1(C)OCC[C@H]1[NH2+]CCC[NH+]1CCCCC1 ZINC000328202295 388586138 /nfs/dbraw/zinc/58/61/38/388586138.db2.gz GINKHGGATGJTGF-CYBMUJFWSA-N 2 0 240.391 2.020 20 0 BEADRP CO[C@@H](C[NH+]1CCC(C[NH3+])CC1)c1ccccc1 ZINC000379232149 388599529 /nfs/dbraw/zinc/59/95/29/388599529.db2.gz STXKQJMJZMVTCG-HNNXBMFYSA-N 2 0 248.370 2.045 20 0 BEADRP CO[C@H](C[NH+]1CCC(C[NH3+])CC1)c1ccccc1 ZINC000379232150 388600204 /nfs/dbraw/zinc/60/02/04/388600204.db2.gz STXKQJMJZMVTCG-OAHLLOKOSA-N 2 0 248.370 2.045 20 0 BEADRP C[C@H]1CCC[C@@H](C[N@@H+]2C[C@@H]3CCC[NH2+][C@@H]3C2)C1 ZINC000220396911 388604840 /nfs/dbraw/zinc/60/48/40/388604840.db2.gz GXQFRDSJRVWWGQ-LJISPDSOSA-N 2 0 236.403 2.497 20 0 BEADRP CCSCC[N@H+](C)[C@H]1CC[NH+](CC)C[C@@H]1C ZINC000245445643 388579860 /nfs/dbraw/zinc/57/98/60/388579860.db2.gz ZBRAWCMEJDBGLS-STQMWFEESA-N 2 0 244.448 2.402 20 0 BEADRP CC[C@H](O)C[NH2+]CCCC[N@@H+]1CCCC[C@@H]1C ZINC000521029776 256834417 /nfs/dbraw/zinc/83/44/17/256834417.db2.gz QXRZLJLVOVPQAK-KBPBESRZSA-N 2 0 242.407 2.002 20 0 BEADRP C[C@@H]1CC([NH2+][C@@H]2CCCC[C@H]2C[NH3+])C[C@@H](C)O1 ZINC000521983281 388672544 /nfs/dbraw/zinc/67/25/44/388672544.db2.gz NTEBJVOAECPJMX-NRWUCQMLSA-N 2 0 240.391 2.050 20 0 BEADRP CC[C@H](C)[N@@H+]1CC[C@@H](C[NH+](CC)CC)C1 ZINC000248373987 388677364 /nfs/dbraw/zinc/67/73/64/388677364.db2.gz NBMUDDKVYMFFPT-STQMWFEESA-N 2 0 212.381 2.449 20 0 BEADRP C[C@H](CC1CCC1)[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000530176285 388620822 /nfs/dbraw/zinc/62/08/22/388620822.db2.gz AKINQRPZNMKSAE-DGCLKSJQSA-N 2 0 222.376 2.439 20 0 BEADRP CCCC[C@H](C)[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000530176691 388622006 /nfs/dbraw/zinc/62/20/06/388622006.db2.gz JWALNLYBTVJDKM-RYUDHWBXSA-N 2 0 210.365 2.439 20 0 BEADRP C[C@H](CCc1ccco1)N[C@H]1CC[NH2+]C12CCC2 ZINC000530178662 388622086 /nfs/dbraw/zinc/62/20/86/388622086.db2.gz PNNCRCNOMWMRSK-OCCSQVGLSA-N 2 0 248.370 2.475 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]C[C@@H]1CC[C@H]2C[C@H]2C1 ZINC000530206303 388627051 /nfs/dbraw/zinc/62/70/51/388627051.db2.gz AJVYDLUVHZJVKM-IEECTRCBSA-N 2 0 210.365 2.138 20 0 BEADRP C[NH2+]C[C@@H]1CCC[N@H+](CC2CC(C)(C)C2)C1 ZINC000530209322 388627635 /nfs/dbraw/zinc/62/76/35/388627635.db2.gz IWZWHMZYLBSAPM-LBPRGKRZSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CCC[N@H+](CC2CC(C)(C)C2)C1 ZINC000530213070 388628265 /nfs/dbraw/zinc/62/82/65/388628265.db2.gz TTYLTTHMKOAKFU-WCQYABFASA-N 2 0 224.392 2.482 20 0 BEADRP C[C@@H]([NH3+])[C@@H]1CCC[N@H+](CC2CC(C)(C)C2)C1 ZINC000530213068 388628287 /nfs/dbraw/zinc/62/82/87/388628287.db2.gz TTYLTTHMKOAKFU-DGCLKSJQSA-N 2 0 224.392 2.482 20 0 BEADRP CCC[C@H](C[NH2+][C@H]1CCC[C@@H]([NH3+])C1)OCC ZINC000530214336 388629627 /nfs/dbraw/zinc/62/96/27/388629627.db2.gz XXNLDLBVCMBSHV-FRRDWIJNSA-N 2 0 228.380 2.051 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[NH2+]C12CCC2)C(C)(C)C ZINC000530216295 388629985 /nfs/dbraw/zinc/62/99/85/388629985.db2.gz AFADZDBNTDVFDJ-MNOVXSKESA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[NH2+]C12CCC2)[C@H]1CC1(C)C ZINC000530217647 388630256 /nfs/dbraw/zinc/63/02/56/388630256.db2.gz URYMNCVXKJUVGO-TUAOUCFPSA-N 2 0 222.376 2.295 20 0 BEADRP CC[C@H]1C[N@H+](CC2CC(C)(C)C2)CC[C@H]1[NH3+] ZINC000530217919 388630279 /nfs/dbraw/zinc/63/02/79/388630279.db2.gz JCWDBKXJBDBPEG-QWHCGFSZSA-N 2 0 224.392 2.482 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[NH2+]C12CCC2)[C@H]1C[C@@H]1C ZINC000530216142 388630546 /nfs/dbraw/zinc/63/05/46/388630546.db2.gz MVYIMMVHRFWUKG-ZDEQEGDKSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC[NH2+]C12CCC2)C(C)(C)C ZINC000530216294 388630953 /nfs/dbraw/zinc/63/09/53/388630953.db2.gz AFADZDBNTDVFDJ-GHMZBOCLSA-N 2 0 210.365 2.295 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]CC1CC=CC1 ZINC000530218772 388631385 /nfs/dbraw/zinc/63/13/85/388631385.db2.gz XEPGPYNNEVLWAH-CHWSQXEVSA-N 2 0 208.349 2.202 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]CC[C@@H]1CC=CCC1 ZINC000530221903 388633012 /nfs/dbraw/zinc/63/30/12/388633012.db2.gz PQXKORLXXZBFEA-UPJWGTAASA-N 2 0 208.349 2.202 20 0 BEADRP C[C@H]([NH2+]C1CCC([NH3+])CC1)c1ncccc1F ZINC000530223090 388634286 /nfs/dbraw/zinc/63/42/86/388634286.db2.gz MOKFKNTYOZYWGW-WHXUTIOJSA-N 2 0 237.322 2.141 20 0 BEADRP C[C@@H]1CC[N@H+](CC2CC(C)(C)C2)C[C@H]1C[NH3+] ZINC000530222912 388634711 /nfs/dbraw/zinc/63/47/11/388634711.db2.gz IRNCGANPUMHQSV-DGCLKSJQSA-N 2 0 224.392 2.339 20 0 BEADRP CCOCCCC[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@H]1C ZINC000246871914 388653755 /nfs/dbraw/zinc/65/37/55/388653755.db2.gz DMWNNKBDYCGZJE-HZSPNIEDSA-N 2 0 242.407 2.121 20 0 BEADRP CCOCCCC[NH2+][C@H]1CC[N@H+](CC)C[C@@H]1C ZINC000246899427 388654728 /nfs/dbraw/zinc/65/47/28/388654728.db2.gz FTTJJHLURWJWDW-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP CO[C@@H]1CCC[C@H]1[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000227540244 388752276 /nfs/dbraw/zinc/75/22/76/388752276.db2.gz SVZUKDWXJXUJDS-KBUPBQIOSA-N 2 0 246.354 2.288 20 0 BEADRP COC[C@H]([NH2+]C1CC[NH+](C(C)C)CC1)C(C)C ZINC000086683123 388690955 /nfs/dbraw/zinc/69/09/55/388690955.db2.gz XQKDOSQHNBVUJK-AWEZNQCLSA-N 2 0 242.407 2.120 20 0 BEADRP C[C@H]([NH2+]CC1CC[NH+](C)CC1)c1cncs1 ZINC000126247600 388692487 /nfs/dbraw/zinc/69/24/87/388692487.db2.gz LWHUYFXICLVBRC-JTQLQIEISA-N 2 0 239.388 2.136 20 0 BEADRP C[N@H+](CCC(C)(C)C)[C@H]1CCC[NH2+]CC1 ZINC000226448853 388719526 /nfs/dbraw/zinc/71/95/26/388719526.db2.gz XTZBEMOJDLYEEF-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CC=C(C)C)[C@@H](C)C1 ZINC000249692548 388731625 /nfs/dbraw/zinc/73/16/25/388731625.db2.gz XHCPIYDFYBWYDN-STQMWFEESA-N 2 0 210.365 2.273 20 0 BEADRP CSCCCC[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000252703049 388771906 /nfs/dbraw/zinc/77/19/06/388771906.db2.gz BVZGTHZHIBGPLJ-STQMWFEESA-N 2 0 242.432 2.346 20 0 BEADRP CCOC[C@H](C)[NH2+][C@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000250479418 388790129 /nfs/dbraw/zinc/79/01/29/388790129.db2.gz FMTKTDGDVANNIN-HZSPNIEDSA-N 2 0 242.407 2.312 20 0 BEADRP C[C@@H]1CCC[C@@H]1C[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000300240684 388835086 /nfs/dbraw/zinc/83/50/86/388835086.db2.gz FQUDZKXOQKKKDA-LPWJVIDDSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)COCCC[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000129838800 388872284 /nfs/dbraw/zinc/87/22/84/388872284.db2.gz ALMFLNALDHYSHP-KGLIPLIRSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CC2CCC1CC2)C1C[NH2+]C1 ZINC000564988685 388905751 /nfs/dbraw/zinc/90/57/51/388905751.db2.gz NSYDROGYTNPUTO-XVSSEFHLSA-N 2 0 222.376 2.010 20 0 BEADRP C[NH2+]CCC[N@@H+]1CC[C@H](C)[C@@H]2CCCC[C@@H]21 ZINC000564989822 388906264 /nfs/dbraw/zinc/90/62/64/388906264.db2.gz IPAUNGXKZNNPLS-IHRRRGAJSA-N 2 0 224.392 2.497 20 0 BEADRP CC1(C[NH2+]Cc2ccc3c[nH+]cn3c2)CC1 ZINC000565760817 388967868 /nfs/dbraw/zinc/96/78/68/388967868.db2.gz QJZGHEDVLLDXLU-UHFFFAOYSA-N 2 0 215.300 2.224 20 0 BEADRP CCCCN(C)C[C@@H](C)[NH2+][C@H]1CCOC[C@@H]1C ZINC000565510478 388949901 /nfs/dbraw/zinc/94/99/01/388949901.db2.gz FJISVXVKFYOBQT-MJBXVCDLSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)N[C@@H](C)C[C@H](C)[NH3+] ZINC000566009782 388983240 /nfs/dbraw/zinc/98/32/40/388983240.db2.gz LPCWZMVINIWHGU-FQUUOJAGSA-N 2 0 241.423 2.013 20 0 BEADRP C([NH2+][C@H]1CCC[NH2+]CC1)[C@H]1CCCCS1 ZINC000168773085 533372107 /nfs/dbraw/zinc/37/21/07/533372107.db2.gz VPRWSIWPKDAOSU-NWDGAFQWSA-N 2 0 228.405 2.004 20 0 BEADRP C[C@@H]([NH2+]CCCc1ccccc1)[C@H]1CCC[NH2+]1 ZINC000400785095 533391315 /nfs/dbraw/zinc/39/13/15/533391315.db2.gz QNKJYQNOFKCVPG-UKRRQHHQSA-N 2 0 232.371 2.349 20 0 BEADRP Cc1cc(N2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)cc[nH+]1 ZINC000274918803 132204533 /nfs/dbraw/zinc/20/45/33/132204533.db2.gz OTPKBPGOFJQGFP-ZFWWWQNUSA-N 2 0 245.370 2.311 20 0 BEADRP [NH3+]C[C@@H]1CCCN(c2cc[nH+]c3ccccc32)C1 ZINC000044532198 132225224 /nfs/dbraw/zinc/22/52/24/132225224.db2.gz PACKYJFLTFIOBS-LBPRGKRZSA-N 2 0 241.338 2.410 20 0 BEADRP Cc1cc(N2CCC([NH2+]CC3CC3)CC2)cc[nH+]1 ZINC000162906713 132233610 /nfs/dbraw/zinc/23/36/10/132233610.db2.gz FFUHLVWJZCDMFL-UHFFFAOYSA-N 2 0 245.370 2.358 20 0 BEADRP Cc1cc(N2CCC([C@@H]3CCC[NH2+]3)CC2)cc[nH+]1 ZINC000162878547 132233717 /nfs/dbraw/zinc/23/37/17/132233717.db2.gz YMLCLDGNUSJQRG-HNNXBMFYSA-N 2 0 245.370 2.358 20 0 BEADRP C[C@H]1C[NH2+]CCN1c1cc[nH+]c2ccccc21 ZINC000054374748 132233904 /nfs/dbraw/zinc/23/39/04/132233904.db2.gz XJWZYUDWNXKVIF-NSHDSACASA-N 2 0 227.311 2.033 20 0 BEADRP CC[N@@H+]1C[C@@H](C)N(c2cc[nH+]c(C)c2)C[C@H]1C ZINC000357701758 132274884 /nfs/dbraw/zinc/27/48/84/132274884.db2.gz XNDFOTDPSARFNU-CHWSQXEVSA-N 2 0 233.359 2.309 20 0 BEADRP Cc1c[nH+]ccc1N1CC[N@H+](C)[C@H](C(C)C)C1 ZINC000358915265 132275765 /nfs/dbraw/zinc/27/57/65/132275765.db2.gz NKDMNEQYAZGXIU-AWEZNQCLSA-N 2 0 233.359 2.166 20 0 BEADRP C[C@@H]1C[C@H]1[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000052272859 132362123 /nfs/dbraw/zinc/36/21/23/132362123.db2.gz UHCJZRGFPDMTLK-BXUZGUMPSA-N 2 0 231.343 2.048 20 0 BEADRP C[C@H]1C[C@@H]1[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000052272857 132362205 /nfs/dbraw/zinc/36/22/05/132362205.db2.gz UHCJZRGFPDMTLK-FZMZJTMJSA-N 2 0 231.343 2.048 20 0 BEADRP CCC[NH+]1CCC([NH2+]C2CC(C)C2)CC1 ZINC000162329545 133520284 /nfs/dbraw/zinc/52/02/84/133520284.db2.gz NZBFECCQPOXICO-UHFFFAOYSA-N 2 0 210.365 2.249 20 0 BEADRP COCC[C@H](C)[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000347120405 133805384 /nfs/dbraw/zinc/80/53/84/133805384.db2.gz ZRJHQSJDYDTSJA-LBPRGKRZSA-N 2 0 240.391 2.018 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+]Cc1ccccc1F ZINC000335277410 133823179 /nfs/dbraw/zinc/82/31/79/133823179.db2.gz KMMNHLDBPHCYKT-JHJIOBLFSA-N 2 0 248.345 2.431 20 0 BEADRP CC[NH+](CC)CCOCC[NH2+][C@@H]1CCC[C@H]1C ZINC000349674636 133901991 /nfs/dbraw/zinc/90/19/91/133901991.db2.gz ZLARWFKIYYGRHB-ZIAGYGMSSA-N 2 0 242.407 2.123 20 0 BEADRP C[N@@H+]1CC[C@]2(CC[NH+](CC3CCCC3)C2)C1 ZINC000336125087 134092468 /nfs/dbraw/zinc/09/24/68/134092468.db2.gz ZUDGLIKITDRSEW-AWEZNQCLSA-N 2 0 222.376 2.204 20 0 BEADRP CCc1cc(N2CC[C@]3(CC[N@H+](C)C3)C2)cc[nH+]1 ZINC000336201593 134130980 /nfs/dbraw/zinc/13/09/80/134130980.db2.gz ZTLMDJDLBSEUCS-HNNXBMFYSA-N 2 0 245.370 2.176 20 0 BEADRP Cc1ccc(CN2CCC[C@@H]2C[NH3+])c(C)c1 ZINC000168805473 134247140 /nfs/dbraw/zinc/24/71/40/134247140.db2.gz BMAPWJDSBYMSDL-CQSZACIVSA-N 2 0 218.344 2.227 20 0 BEADRP C[C@@H](C[N@@H+]1CCC[C@@H](C[NH3+])C1)c1ccccc1 ZINC000217529610 134248487 /nfs/dbraw/zinc/24/84/87/134248487.db2.gz QIKLPOPRTBEGTO-KBPBESRZSA-N 2 0 232.371 2.461 20 0 BEADRP CC(C)C[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000169231478 134250125 /nfs/dbraw/zinc/25/01/25/134250125.db2.gz ACTKCCVGUYWYCS-QWHCGFSZSA-N 2 0 204.317 2.377 20 0 BEADRP C[C@@H](CC[NH3+])[NH2+]Cc1ccc(Cl)s1 ZINC000220507594 134309426 /nfs/dbraw/zinc/30/94/26/134309426.db2.gz HIMHPIIKUGDOON-ZETCQYMHSA-N 2 0 218.753 2.228 20 0 BEADRP CCCC[C@H](COC)[NH2+]CCC[NH+]1CCCC1 ZINC000178413582 134310114 /nfs/dbraw/zinc/31/01/14/134310114.db2.gz HBFVHMOMVBEVIR-CQSZACIVSA-N 2 0 242.407 2.267 20 0 BEADRP C[NH+]1CCC(CC[NH2+]C[C@@H]2CCSC2)CC1 ZINC000224480000 134348185 /nfs/dbraw/zinc/34/81/85/134348185.db2.gz ZIRWYSSAGJIRFY-ZDUSSCGKSA-N 2 0 242.432 2.061 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C[C@@]2(C)CCCS2)CC[N@@H+]1C ZINC000224566450 134348575 /nfs/dbraw/zinc/34/85/75/134348575.db2.gz SPGWQVHLELUAQB-FRRDWIJNSA-N 2 0 242.432 2.344 20 0 BEADRP C[NH+]1CCC(C)(C[NH2+]C[C@H]2CCSC2)CC1 ZINC000226345373 134360971 /nfs/dbraw/zinc/36/09/71/134360971.db2.gz WJKSQMCUISNEIJ-GFCCVEGCSA-N 2 0 242.432 2.061 20 0 BEADRP CC(C)O[C@@H]1C[C@@H]([NH2+]CCC[NH+](C)C)C1(C)C ZINC000185186646 134372253 /nfs/dbraw/zinc/37/22/53/134372253.db2.gz BZXUAGGTAATLCA-CHWSQXEVSA-N 2 0 242.407 2.120 20 0 BEADRP C[C@H]([NH2+]CC1(C)CC[NH+](C)CC1)C1(C)CC1 ZINC000227495214 134381312 /nfs/dbraw/zinc/38/13/12/134381312.db2.gz XUWICAWLOLHTQI-LBPRGKRZSA-N 2 0 224.392 2.497 20 0 BEADRP C(C1CC1)[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000155597938 134694079 /nfs/dbraw/zinc/69/40/79/134694079.db2.gz ZVSCKDKFYPEPDY-UHFFFAOYSA-N 2 0 222.376 2.204 20 0 BEADRP Cc1c[nH+]ccc1N[C@H](C)CC[NH+](C)C ZINC000070047261 134908085 /nfs/dbraw/zinc/90/80/85/134908085.db2.gz HLDOVEOWTNFEMV-LLVKDONJSA-N 2 0 207.321 2.142 20 0 BEADRP Cc1c[nH+]ccc1N1CC[N@@H+]2CCCC[C@H]2C1 ZINC000248664176 135017988 /nfs/dbraw/zinc/01/79/88/135017988.db2.gz KQEJKFKPIIBOSG-ZDUSSCGKSA-N 2 0 231.343 2.065 20 0 BEADRP CCN(C)CC[NH2+][C@@H]1C[C@@H](OC(C)C)C1(C)C ZINC000248727750 135020531 /nfs/dbraw/zinc/02/05/31/135020531.db2.gz CWUPJPBVOZIXOA-CHWSQXEVSA-N 2 0 242.407 2.120 20 0 BEADRP COCC[C@@H](C)[NH2+]CCC[N@@H+]1CCCC[C@H]1C ZINC000249837292 135046031 /nfs/dbraw/zinc/04/60/31/135046031.db2.gz XFELAOGTECLDIA-ZIAGYGMSSA-N 2 0 242.407 2.266 20 0 BEADRP c1coc(CC[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)c1 ZINC000250090124 135049245 /nfs/dbraw/zinc/04/92/45/135049245.db2.gz OUOOAHJYDHTKBJ-OLZOCXBDSA-N 2 0 234.343 2.039 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H]2CC[C@@H](C)C2)C1 ZINC000250330343 135052743 /nfs/dbraw/zinc/05/27/43/135052743.db2.gz OKIIXYJIHKVQRS-UPJWGTAASA-N 2 0 210.365 2.106 20 0 BEADRP CCO[C@@H]1C[C@H]([NH2+][C@H](C)CC[NH+](C)C)C1(C)C ZINC000250574836 135053576 /nfs/dbraw/zinc/05/35/76/135053576.db2.gz XBEJJXFMNBEPLX-FRRDWIJNSA-N 2 0 242.407 2.120 20 0 BEADRP CCC[C@@H](C)[N@H+](C)CC[C@H]1CCC[NH2+]C1 ZINC000251347841 135068584 /nfs/dbraw/zinc/06/85/84/135068584.db2.gz PYEUMORPPLPSMQ-CHWSQXEVSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@H]1CCCC[N@@H+]1CCC[NH2+][C@H]1CCCOC1 ZINC000251556846 135071683 /nfs/dbraw/zinc/07/16/83/135071683.db2.gz ADVDMASHOYPGNI-KBPBESRZSA-N 2 0 240.391 2.020 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)C1(C)CC1 ZINC000251699889 135074467 /nfs/dbraw/zinc/07/44/67/135074467.db2.gz XFXDIWCKFYAMSY-XQQFMLRXSA-N 2 0 222.376 2.391 20 0 BEADRP CC[C@H](C)C[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@H]1C ZINC000251763025 135076854 /nfs/dbraw/zinc/07/68/54/135076854.db2.gz HTLOIIFJKSVNMK-QNWHQSFQSA-N 2 0 212.381 2.351 20 0 BEADRP C[C@H]1C[N@H+](Cc2ccc3c(c2)CCC3)CC[C@H]1[NH3+] ZINC000251837175 135079437 /nfs/dbraw/zinc/07/94/37/135079437.db2.gz QBTLNIVLAUZURD-BLLLJJGKSA-N 2 0 244.382 2.344 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C2CC[NH2+]CC2)C[C@H]1C ZINC000251976526 135082869 /nfs/dbraw/zinc/08/28/69/135082869.db2.gz YLIOJJZTNSRMGA-WZRBSPASSA-N 2 0 210.365 2.153 20 0 BEADRP C[N@H+](CCc1cccs1)C[C@@H]1CCC[NH2+]C1 ZINC000086440967 135085421 /nfs/dbraw/zinc/08/54/21/135085421.db2.gz DTPKPYABQUVLLD-GFCCVEGCSA-N 2 0 238.400 2.222 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+][C@H]1CCN2CCCC[C@H]12 ZINC000252171361 135086086 /nfs/dbraw/zinc/08/60/86/135086086.db2.gz OACOQGIYOAHRGI-ZOBORPQBSA-N 2 0 222.376 2.391 20 0 BEADRP C[C@@H]1CCC[N@H+](C[C@H]2CCC[NH2+]C2)CC1 ZINC000252205670 135086300 /nfs/dbraw/zinc/08/63/00/135086300.db2.gz VBELMGPTCORLOO-OLZOCXBDSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@@H](C[C@H]1CCC[NH2+]1)[NH2+]C1CCCCC1 ZINC000086494727 135087299 /nfs/dbraw/zinc/08/72/99/135087299.db2.gz XAXBDPOENKOGLX-WCQYABFASA-N 2 0 210.365 2.439 20 0 BEADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]C1CCC1 ZINC000086501045 135088351 /nfs/dbraw/zinc/08/83/51/135088351.db2.gz LCAUEIKESIDJIV-YPMHNXCESA-N 2 0 210.365 2.439 20 0 BEADRP C[C@@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]C1CCC1 ZINC000086501043 135088416 /nfs/dbraw/zinc/08/84/16/135088416.db2.gz LCAUEIKESIDJIV-AAEUAGOBSA-N 2 0 210.365 2.439 20 0 BEADRP CCC[C@H](C)C[N@H+](C)CC(C)(C)C[NH3+] ZINC000086637537 135091561 /nfs/dbraw/zinc/09/15/61/135091561.db2.gz DZZPIIIZJXTYJB-NSHDSACASA-N 2 0 200.370 2.339 20 0 BEADRP C[C@@H]1CCCC[C@H]1[NH2+]CC1CC[NH2+]CC1 ZINC000086700221 135095536 /nfs/dbraw/zinc/09/55/36/135095536.db2.gz RQTPKIDVJMASPH-DGCLKSJQSA-N 2 0 210.365 2.154 20 0 BEADRP CC1(C)CCCC[C@@H]1[NH2+]C1CC[NH2+]CC1 ZINC000086873844 135099066 /nfs/dbraw/zinc/09/90/66/135099066.db2.gz WLFMQFGYUFUPOU-LBPRGKRZSA-N 2 0 210.365 2.297 20 0 BEADRP CC1(C)CCCC[C@H]1[NH2+]C1CC[NH2+]CC1 ZINC000086873846 135099741 /nfs/dbraw/zinc/09/97/41/135099741.db2.gz WLFMQFGYUFUPOU-GFCCVEGCSA-N 2 0 210.365 2.297 20 0 BEADRP Cc1ccsc1C[N@@H+]1CC[C@H]([NH3+])[C@H](C)C1 ZINC000086884473 135099843 /nfs/dbraw/zinc/09/98/43/135099843.db2.gz SNXWKUQNDKWVLI-MNOVXSKESA-N 2 0 224.373 2.226 20 0 BEADRP CCC1(C[NH2+][C@H]2CC[N@H+](C)C[C@H]2C)CC1 ZINC000252731048 135103596 /nfs/dbraw/zinc/10/35/96/135103596.db2.gz OAQAORWHXKEUOQ-NEPJUHHUSA-N 2 0 210.365 2.106 20 0 BEADRP COc1ccc(C)cc1C[N@@H+]1CC[C@H]([C@H](C)[NH3+])C1 ZINC000252791000 135110571 /nfs/dbraw/zinc/11/05/71/135110571.db2.gz ZKKNUYLSCFVGML-STQMWFEESA-N 2 0 248.370 2.173 20 0 BEADRP CCSCCC[NH2+][C@@H]1CC[N@H+](C)C[C@H]1C ZINC000252806712 135111197 /nfs/dbraw/zinc/11/11/97/135111197.db2.gz CIMDOSMHFSGGJD-VXGBXAGGSA-N 2 0 230.421 2.059 20 0 BEADRP CCSCCC[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000252816519 135111877 /nfs/dbraw/zinc/11/18/77/135111877.db2.gz KMJVVIQMIYHQLA-STQMWFEESA-N 2 0 242.432 2.346 20 0 BEADRP CC(C)CC[N@@H+]1C[C@@H]2CCC[C@@H]([NH3+])[C@H]2C1 ZINC000252861962 135114301 /nfs/dbraw/zinc/11/43/01/135114301.db2.gz NUCLYPABRYEUJQ-RWMBFGLXSA-N 2 0 210.365 2.092 20 0 BEADRP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]Cc1cccc(F)c1 ZINC000252892585 135116368 /nfs/dbraw/zinc/11/63/68/135116368.db2.gz NYOWOXNMTHBALP-SMDDNHRTSA-N 2 0 236.334 2.256 20 0 BEADRP Cc1cccc(C[NH2+][C@@H]2CC[N@@H+](C)C[C@H]2C)c1 ZINC000252890552 135116424 /nfs/dbraw/zinc/11/64/24/135116424.db2.gz HSGQEBFLXRMXIJ-UKRRQHHQSA-N 2 0 232.371 2.425 20 0 BEADRP C(C1CC[NH2+]CC1)[N@@H+]1CC2C[C@@H]3CC1C[C@H](C2)C3 ZINC000262304728 135117721 /nfs/dbraw/zinc/11/77/21/135117721.db2.gz XZGWGISIPAZPMI-PJPHBNEVSA-N 2 0 248.414 2.497 20 0 BEADRP C[C@H]1CC[C@H]([NH2+][C@@H]2CCC[NH2+]CC2)CC1 ZINC000253128195 135122492 /nfs/dbraw/zinc/12/24/92/135122492.db2.gz MWAJVHMXEGSCOA-JHJVBQTASA-N 2 0 210.365 2.297 20 0 BEADRP Cc1ccsc1C[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000087310052 135123566 /nfs/dbraw/zinc/12/35/66/135123566.db2.gz NKKPCEPCJAAPJF-LLVKDONJSA-N 2 0 224.373 2.146 20 0 BEADRP C[C@@H]1CC[N@H+](CCc2ccccc2)C[C@H]1C[NH3+] ZINC000253237441 135124944 /nfs/dbraw/zinc/12/49/44/135124944.db2.gz OYSUCDPVLWUZII-UKRRQHHQSA-N 2 0 232.371 2.146 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@H]2CCCC[C@@H]2C[NH3+])C1 ZINC000253285780 135125907 /nfs/dbraw/zinc/12/59/07/135125907.db2.gz OAUJZIDOXZYVBN-NDBYEHHHSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CC[C@H]2CCC[NH2+]C2)C1 ZINC000253290151 135126230 /nfs/dbraw/zinc/12/62/30/135126230.db2.gz PNJMXLHMDUPUEO-UPJWGTAASA-N 2 0 210.365 2.154 20 0 BEADRP C(C1CCCC1)[NH+]1CCC2(CC[NH2+]C2)CC1 ZINC000257671248 135138514 /nfs/dbraw/zinc/13/85/14/135138514.db2.gz IMRRZYKUGCXCDX-UHFFFAOYSA-N 2 0 222.376 2.252 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@]3(CC[NH2+]C3)C2)cc1C ZINC000257684126 135139271 /nfs/dbraw/zinc/13/92/71/135139271.db2.gz LSTXSQCSZOEVFO-INIZCTEOSA-N 2 0 244.382 2.489 20 0 BEADRP C(C1CCCCC1)[N@@H+]1CC[C@@]2(CCC[NH2+]2)C1 ZINC000257690648 135139351 /nfs/dbraw/zinc/13/93/51/135139351.db2.gz NKRPDRPJGXNMJL-AWEZNQCLSA-N 2 0 222.376 2.395 20 0 BEADRP C(C1CCCC1)[N@@H+]1CC[C@]2(CCC[NH2+]2)C1 ZINC000257686826 135139448 /nfs/dbraw/zinc/13/94/48/135139448.db2.gz MLALDHNTQRQGGS-CYBMUJFWSA-N 2 0 208.349 2.005 20 0 BEADRP Cc1ccc(C)c(C[N@@H+]2CC[C@@]3(CC[NH2+]C3)C2)c1 ZINC000257737986 135140831 /nfs/dbraw/zinc/14/08/31/135140831.db2.gz YJESFOKPQNOMDY-MRXNPFEDSA-N 2 0 244.382 2.489 20 0 BEADRP CCN(C)CC[NH2+]CCC1CCCCC1 ZINC000087473405 135142999 /nfs/dbraw/zinc/14/29/99/135142999.db2.gz CRDSZICLKQUOBL-UHFFFAOYSA-N 2 0 212.381 2.498 20 0 BEADRP CNCC[NH2+][C@@H]1C[C@@H](C)CC[C@H]1C(C)C ZINC000261527264 135150935 /nfs/dbraw/zinc/15/09/35/135150935.db2.gz ILINFHFXQJYIOQ-RWMBFGLXSA-N 2 0 212.381 2.256 20 0 BEADRP CC[C@H]([NH2+][C@H](C)[C@H](C)[NH3+])c1ccccc1 ZINC000261530265 135157262 /nfs/dbraw/zinc/15/72/62/135157262.db2.gz CDCRCTIXXRHFIV-LOWVWBTDSA-N 2 0 206.333 2.463 20 0 BEADRP C[C@H](C1CC1)[N@H+](C)C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000261530767 135158358 /nfs/dbraw/zinc/15/83/58/135158358.db2.gz CZKPCMOMCASSEL-IJLUTSLNSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@@H]1CCC[N@H+](C[C@@H]2CC[NH2+][C@H](C)C2)C1 ZINC000261531336 135159897 /nfs/dbraw/zinc/15/98/97/135159897.db2.gz GDUQVBUYTYSRJG-JHJVBQTASA-N 2 0 210.365 2.106 20 0 BEADRP CC1CCC(C[NH2+]C[C@H]2CCC[NH2+]C2)CC1 ZINC000087647179 135160766 /nfs/dbraw/zinc/16/07/66/135160766.db2.gz BADKRDQLPBFRFX-RUXDESIVSA-N 2 0 224.392 2.402 20 0 BEADRP CS[C@@H]1CCC[C@@H]([NH2+][C@H]2CCC[NH2+]CC2)C1 ZINC000261532378 135162245 /nfs/dbraw/zinc/16/22/45/135162245.db2.gz AFMCSOSOKCQECM-YNEHKIRRSA-N 2 0 242.432 2.392 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[NH2+]C[C@@H]1C)c1ccsc1 ZINC000261532224 135162442 /nfs/dbraw/zinc/16/24/42/135162442.db2.gz JRYRWXZGJWXDDE-JBLDHEPKSA-N 2 0 224.373 2.397 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+][C@@H]1CCCC[C@H]1C[NH3+] ZINC000261532864 135163212 /nfs/dbraw/zinc/16/32/12/135163212.db2.gz KLGWZNIDTULJDQ-TUAOUCFPSA-N 2 0 210.365 2.282 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+][C@@H]1CCCC[C@@H]1C[NH3+] ZINC000261532865 135164403 /nfs/dbraw/zinc/16/44/03/135164403.db2.gz KLGWZNIDTULJDQ-UTUOFQBUSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H](CN1C[C@H](C)[C@H]([NH3+])C1)c1ccccc1 ZINC000261533333 135165255 /nfs/dbraw/zinc/16/52/55/135165255.db2.gz GPMHLKIBQHNTNL-MBNYWOFBSA-N 2 0 218.344 2.069 20 0 BEADRP C[C@@H]1C[C@H](C)C[N@@H+](C[C@H]2CC[NH2+][C@@H](C)C2)C1 ZINC000261534733 135167723 /nfs/dbraw/zinc/16/77/23/135167723.db2.gz TYIMXBXKLXKSEE-CRWXNKLISA-N 2 0 224.392 2.352 20 0 BEADRP CC1CCC([NH2+][C@H]2CC[NH2+]C[C@@H]2C)CC1 ZINC000261534827 135168298 /nfs/dbraw/zinc/16/82/98/135168298.db2.gz NCCFOCSYULLSJT-MVKMKZAISA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1C[C@H](C)C[N@@H+](C[C@H]2CC[NH2+][C@H](C)C2)C1 ZINC000261534735 135168318 /nfs/dbraw/zinc/16/83/18/135168318.db2.gz TYIMXBXKLXKSEE-RQJABVFESA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1C[C@H](C[NH+]2C[C@@H]3CCC[C@H]3C2)CC[NH2+]1 ZINC000261534999 135169194 /nfs/dbraw/zinc/16/91/94/135169194.db2.gz VLRLSDLJSDDBBN-MQYQWHSLSA-N 2 0 222.376 2.106 20 0 BEADRP CC1(C)C[C@@H]1C[NH2+][C@H]1CCCC[C@H]1C[NH3+] ZINC000261536369 135171105 /nfs/dbraw/zinc/17/11/05/135171105.db2.gz RKRZMJPEQLIEJF-TUAOUCFPSA-N 2 0 210.365 2.140 20 0 BEADRP C[C@]1(C[NH2+][C@@H]2CCCC[C@@H]2C[NH3+])CCCS1 ZINC000087792748 135171468 /nfs/dbraw/zinc/17/14/68/135171468.db2.gz FEZGHORLLIHIMT-JHJVBQTASA-N 2 0 242.432 2.379 20 0 BEADRP Cc1[nH+]ccc(NC[C@H]2CCC[NH2+]2)c1Cl ZINC000261537091 135172993 /nfs/dbraw/zinc/17/29/93/135172993.db2.gz UVRCRAILTQRUEO-SECBINFHSA-N 2 0 225.723 2.207 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]1[NH2+]CC1CCCC1 ZINC000261536870 135173472 /nfs/dbraw/zinc/17/34/72/135173472.db2.gz UBMYBWSHVTZFKD-GFCCVEGCSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@H]2CCC[NH2+]2)C[C@@H]1C ZINC000261537705 135174369 /nfs/dbraw/zinc/17/43/69/135174369.db2.gz WFELSUDSWVFUSN-MROQNXINSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@H]2CCC[NH2+]2)[C@H](C)C1 ZINC000261538778 135177331 /nfs/dbraw/zinc/17/73/31/135177331.db2.gz ZHEQYJQCLGTVCK-LPWJVIDDSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@@H]1[C@H](C)CC[N@@H+]1C[C@@]1(C)CC[NH2+]C1 ZINC000261539800 135178624 /nfs/dbraw/zinc/17/86/24/135178624.db2.gz DEPZGYNZQVWNCI-UPJWGTAASA-N 2 0 210.365 2.106 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]1[NH2+]CCc1ccccc1 ZINC000261543983 135184687 /nfs/dbraw/zinc/18/46/87/135184687.db2.gz DJNKWOSTHVOHDB-CQSZACIVSA-N 2 0 232.371 2.207 20 0 BEADRP CCO[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H]([NH3+])C2)C1(C)C ZINC000261544460 135185159 /nfs/dbraw/zinc/18/51/59/135185159.db2.gz YFNCRNSLQOBOBF-QNWHQSFQSA-N 2 0 240.391 2.050 20 0 BEADRP Cc1nc(C)c(C[NH2+]C2CCC([NH3+])CC2)s1 ZINC000084148969 135187798 /nfs/dbraw/zinc/18/77/98/135187798.db2.gz FNYQOBIWMMWGHL-UHFFFAOYSA-N 2 0 239.388 2.119 20 0 BEADRP C(C1CCCCCC1)[N@@H+]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000261553547 135193024 /nfs/dbraw/zinc/19/30/24/135193024.db2.gz NZMDATUUTGIFAF-CABCVRRESA-N 2 0 236.403 2.498 20 0 BEADRP C[C@@H]1COCC[C@@H]1[NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000261558245 135198498 /nfs/dbraw/zinc/19/84/98/135198498.db2.gz DBXMRYFZEVHEII-RABLLNBGSA-N 2 0 246.354 2.146 20 0 BEADRP C[C@@H]1[C@@H]([NH3+])CCN1Cc1cccc(C2CC2)c1 ZINC000261558864 135199787 /nfs/dbraw/zinc/19/97/87/135199787.db2.gz SUIRFAXHGTYVFR-ABAIWWIYSA-N 2 0 230.355 2.486 20 0 BEADRP C[C@@H]1CCC[C@@H](C[N@@H+]2CC[C@]3(CC[NH2+]C3)C2)C1 ZINC000261560150 135201432 /nfs/dbraw/zinc/20/14/32/135201432.db2.gz UFZXTCGQTKOVBL-KFWWJZLASA-N 2 0 236.403 2.498 20 0 BEADRP C(C[N@@H+]1CC[C@H]2C[NH2+]C[C@H]2C1)C1CCCC1 ZINC000261560692 135202073 /nfs/dbraw/zinc/20/20/73/135202073.db2.gz AEJADTCRJHQOOG-KBPBESRZSA-N 2 0 222.376 2.108 20 0 BEADRP Cc1ccccc1C[N@@H+]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000261561710 135202733 /nfs/dbraw/zinc/20/27/33/135202733.db2.gz VRTWUIFDHCVLAI-ZFWWWQNUSA-N 2 0 230.355 2.036 20 0 BEADRP Cc1cccc(C[N@@H+]2CC[C@H]3C[NH2+]C[C@H]3C2)c1 ZINC000261561383 135202920 /nfs/dbraw/zinc/20/29/20/135202920.db2.gz VHFYVHGZICLGLM-GJZGRUSLSA-N 2 0 230.355 2.036 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@@H]3C[NH2+]C[C@@H]3C2)cc1 ZINC000261562010 135203521 /nfs/dbraw/zinc/20/35/21/135203521.db2.gz VXJZSGZBIAIVKM-HUUCEWRRSA-N 2 0 230.355 2.036 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@@H]3C[NH2+]C[C@H]3C2)cc1 ZINC000261562008 135203789 /nfs/dbraw/zinc/20/37/89/135203789.db2.gz VXJZSGZBIAIVKM-CABCVRRESA-N 2 0 230.355 2.036 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@@H]3[NH2+]CC[C@@H]3C2)c(C)c1 ZINC000261562768 135204307 /nfs/dbraw/zinc/20/43/07/135204307.db2.gz GQAOJNDEPBCGAN-CVEARBPZSA-N 2 0 244.382 2.487 20 0 BEADRP C[C@H]1C[NH2+]CC[C@@H]1[NH2+]C1C2CC3CC(C2)CC1C3 ZINC000261565147 135207289 /nfs/dbraw/zinc/20/72/89/135207289.db2.gz HQTBZGOZCRAUJH-YZQVSVNPSA-N 2 0 248.414 2.399 20 0 BEADRP Cc1c[nH+]ccc1NCC1([NH3+])CCCCC1 ZINC000261566137 135208522 /nfs/dbraw/zinc/20/85/22/135208522.db2.gz DIRSCVBVBMVTRI-UHFFFAOYSA-N 2 0 219.332 2.464 20 0 BEADRP Cc1ccccc1C[C@@H](C)[NH2+]CC(C)(C)[NH3+] ZINC000261567033 135209356 /nfs/dbraw/zinc/20/93/56/135209356.db2.gz DVGGBLZYXULRHG-GFCCVEGCSA-N 2 0 220.360 2.253 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CC[NH2+]C[C@@H]2C)cc1 ZINC000261567793 135209812 /nfs/dbraw/zinc/20/98/12/135209812.db2.gz FDECRWUYGUMLAU-GXTWGEPZSA-N 2 0 218.344 2.083 20 0 BEADRP Cc1ccccc1C[C@H](C)[NH2+][C@@H](C)[C@@H](C)[NH3+] ZINC000261568616 135209994 /nfs/dbraw/zinc/20/99/94/135209994.db2.gz FQOYLXKHECKHQT-XQQFMLRXSA-N 2 0 220.360 2.251 20 0 BEADRP Cc1cccc(C[N@@H+]2CC[C@@H]3C[NH2+]C[C@H]3C2)c1C ZINC000261569481 135210910 /nfs/dbraw/zinc/21/09/10/135210910.db2.gz JWNAPEQBXWNWAX-ZBFHGGJFSA-N 2 0 244.382 2.345 20 0 BEADRP Cc1ccc(C[N@@H+]2C[C@@H]3CC[C@H]([NH3+])[C@H]3C2)cc1C ZINC000261569198 135211504 /nfs/dbraw/zinc/21/15/04/135211504.db2.gz JPTRGPMHCOVEIA-JYJNAYRXSA-N 2 0 244.382 2.473 20 0 BEADRP [NH3+]C[C@@H]1CCN(Cc2cc(Cl)ccc2F)C1 ZINC000164138295 135213127 /nfs/dbraw/zinc/21/31/27/135213127.db2.gz NCEXBMVIAUASGD-VIFPVBQESA-N 2 0 242.725 2.260 20 0 BEADRP CC[C@H]([NH2+]CCC[NH3+])c1cccc(F)c1 ZINC000164077992 135213262 /nfs/dbraw/zinc/21/32/62/135213262.db2.gz FLOLMDDWLKVYTC-LBPRGKRZSA-N 2 0 210.296 2.215 20 0 BEADRP CCSCCC[NH2+][C@@H]1CC[N@H+](C)C[C@@H]1C ZINC000164021886 135213294 /nfs/dbraw/zinc/21/32/94/135213294.db2.gz CIMDOSMHFSGGJD-NWDGAFQWSA-N 2 0 230.421 2.059 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@H]3[NH2+]CC[C@H]3C2)cc1C ZINC000261572172 135214146 /nfs/dbraw/zinc/21/41/46/135214146.db2.gz LMSLJIOOTXITCN-JKSUJKDBSA-N 2 0 244.382 2.487 20 0 BEADRP Cc1ccc(C)c(C[N@@H+]2CC[C@H]3[NH2+]CC[C@@H]3C2)c1 ZINC000261574270 135215773 /nfs/dbraw/zinc/21/57/73/135215773.db2.gz MQROYXJMEJMJKV-GDBMZVCRSA-N 2 0 244.382 2.487 20 0 BEADRP COCC(C)(C)C[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000261576193 135217631 /nfs/dbraw/zinc/21/76/31/135217631.db2.gz NMJPTVXILSGSIB-ZIAGYGMSSA-N 2 0 248.370 2.393 20 0 BEADRP Cc1cccc(CN2CC[C@H]([NH3+])[C@H]2C)c1C ZINC000261576596 135217774 /nfs/dbraw/zinc/21/77/74/135217774.db2.gz KKGGXUAVNQYDLW-OCCSQVGLSA-N 2 0 218.344 2.225 20 0 BEADRP C(C[C@@H]1CC[NH2+]C1)[NH2+]C1CCCCCC1 ZINC000084384919 135217868 /nfs/dbraw/zinc/21/78/68/135217868.db2.gz YSPHHSKAKNBQBR-LBPRGKRZSA-N 2 0 210.365 2.298 20 0 BEADRP Cc1[nH+]ccc(N2C[C@@H](C)[NH2+]C[C@H]2C)c1Cl ZINC000261576984 135218486 /nfs/dbraw/zinc/21/84/86/135218486.db2.gz KSFQLJPTZAUGSC-RKDXNWHRSA-N 2 0 239.750 2.230 20 0 BEADRP Cc1cccc(C)c1C[N@@H+]1C[C@@H]2CC[C@@H]([NH3+])[C@H]2C1 ZINC000261578012 135218844 /nfs/dbraw/zinc/21/88/44/135218844.db2.gz ORUGOYHYMZZVAS-CWRNSKLLSA-N 2 0 244.382 2.473 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+]Cc1cccc(Cl)c1 ZINC000261578211 135218895 /nfs/dbraw/zinc/21/88/95/135218895.db2.gz LOOKKXWRUKCZRG-MFKMUULPSA-N 2 0 238.762 2.428 20 0 BEADRP Cc1cccc(C[N@@H+]2CC[C@@]3(CC[NH2+]C3)C2)c1C ZINC000261578957 135219541 /nfs/dbraw/zinc/21/95/41/135219541.db2.gz PFJODEJQBYDGGN-MRXNPFEDSA-N 2 0 244.382 2.489 20 0 BEADRP C[C@@H](Cc1ccc(F)cc1)[NH2+]CC(C)(C)[NH3+] ZINC000261579152 135219927 /nfs/dbraw/zinc/21/99/27/135219927.db2.gz MCDNTNHKMYHUBB-JTQLQIEISA-N 2 0 224.323 2.084 20 0 BEADRP CC1(C[N@@H+]2C[C@@H]3CCC[C@H]([NH3+])[C@@H]3C2)CCC1 ZINC000261580793 135221364 /nfs/dbraw/zinc/22/13/64/135221364.db2.gz NDJFEOZGWJGZGI-XQQFMLRXSA-N 2 0 222.376 2.236 20 0 BEADRP Cc1cc(C)cc(C[N@@H+]2C[C@@H]3CC[C@H]([NH3+])[C@H]3C2)c1 ZINC000261583186 135224117 /nfs/dbraw/zinc/22/41/17/135224117.db2.gz RQZSOLQXXCRMCT-JYJNAYRXSA-N 2 0 244.382 2.473 20 0 BEADRP C(C1CCCCC1)[N@@H+]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000261584822 135226261 /nfs/dbraw/zinc/22/62/61/135226261.db2.gz QBAJWFPYERFNAI-KBPBESRZSA-N 2 0 222.376 2.108 20 0 BEADRP COCc1cccc(C[N@@H+]2CC[C@@](C)(C[NH3+])C2)c1 ZINC000261584606 135226332 /nfs/dbraw/zinc/22/63/32/135226332.db2.gz SKNXHTFUFDLAPF-HNNXBMFYSA-N 2 0 248.370 2.004 20 0 BEADRP C[C@H]1C[NH2+]CC[C@H]1[NH2+]Cc1ccc(Cl)cc1 ZINC000261585828 135227045 /nfs/dbraw/zinc/22/70/45/135227045.db2.gz QRASTWATVZZQRZ-GXFFZTMASA-N 2 0 238.762 2.428 20 0 BEADRP COc1cccc([C@H](C)[NH2+][C@H]2CC[NH2+]C[C@H]2C)c1 ZINC000261585534 135227058 /nfs/dbraw/zinc/22/70/58/135227058.db2.gz SZFKQRKXAGJVRU-XUJVJEKNSA-N 2 0 248.370 2.344 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+]Cc1ccc(Cl)cc1 ZINC000261585830 135227234 /nfs/dbraw/zinc/22/72/34/135227234.db2.gz QRASTWATVZZQRZ-ZWNOBZJWSA-N 2 0 238.762 2.428 20 0 BEADRP [NH3+][C@@H]1CC[C@@H]2C[N@H+](CCC3CCCC3)C[C@@H]12 ZINC000261589703 135229985 /nfs/dbraw/zinc/22/99/85/135229985.db2.gz UCSIQIRFKKDSBG-MGPQQGTHSA-N 2 0 222.376 2.236 20 0 BEADRP C[C@@H]1C[N@H+](CC(C)(C)[NH3+])[C@H]2CCCC[C@H]12 ZINC000261590907 135230708 /nfs/dbraw/zinc/23/07/08/135230708.db2.gz UVGLJFXHTIZQTK-UTUOFQBUSA-N 2 0 210.365 2.234 20 0 BEADRP Cc1ccc(F)c(C[N@@H+]2C[C@@H]3CC[C@H]([NH3+])[C@H]3C2)c1 ZINC000261591020 135231852 /nfs/dbraw/zinc/23/18/52/135231852.db2.gz XJACCEMKZAKCRO-WHOFXGATSA-N 2 0 248.345 2.303 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+][C@@H]1CCC[C@H]1[C@H]1CCC[NH2+]1 ZINC000261598526 135237196 /nfs/dbraw/zinc/23/71/96/135237196.db2.gz ZPXBDOZDKLLUPN-MBJXGIAVSA-N 2 0 222.376 2.295 20 0 BEADRP Cc1cccc(C[N@@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@@H]3C2)c1 ZINC000261546220 135238269 /nfs/dbraw/zinc/23/82/69/135238269.db2.gz GRGCUMVSEXEEKM-RRFJBIMHSA-N 2 0 230.355 2.164 20 0 BEADRP C([C@@H]1CCC[NH2+]C1)[N@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000261547390 135240270 /nfs/dbraw/zinc/24/02/70/135240270.db2.gz MHSPCQAWSLPLQQ-MCIONIFRSA-N 2 0 222.376 2.108 20 0 BEADRP C[C@@H]1CCCC[C@H]1C[N@@H+]1CC[C@@](C)(C[NH3+])C1 ZINC000261682785 135245890 /nfs/dbraw/zinc/24/58/90/135245890.db2.gz HBZMKQIFUMZRRY-RDBSUJKOSA-N 2 0 224.392 2.483 20 0 BEADRP C[C@H]1CC2(CCC2)C[N@@H+]1C[C@H]1CCC[NH2+]C1 ZINC000261749102 135249991 /nfs/dbraw/zinc/24/99/91/135249991.db2.gz LRJOZIXNYFPQDR-STQMWFEESA-N 2 0 222.376 2.251 20 0 BEADRP CS[C@H]1CCCC[N@H+](C[C@@]2(C)CC[NH2+]C2)C1 ZINC000261759670 135250940 /nfs/dbraw/zinc/25/09/40/135250940.db2.gz LDLMSKSTNMGGJA-STQMWFEESA-N 2 0 242.432 2.204 20 0 BEADRP C(C1CC1)[N@H+](CC1CCC1)C[C@@H]1CCC[NH2+]C1 ZINC000261783768 135252922 /nfs/dbraw/zinc/25/29/22/135252922.db2.gz OALNXKYHHSTHOE-OAHLLOKOSA-N 2 0 236.403 2.498 20 0 BEADRP C[C@@]1(C[NH3+])CC[N@@H+]([C@H]2CCc3ccc(F)cc32)C1 ZINC000261815866 135255439 /nfs/dbraw/zinc/25/54/39/135255439.db2.gz PCMFQBMUHYHXNT-GJZGRUSLSA-N 2 0 248.345 2.484 20 0 BEADRP Cn1cccc1[C@@H]1CCC[N@@H+]1C[C@@]1(C)CC[NH2+]C1 ZINC000261867951 135258368 /nfs/dbraw/zinc/25/83/68/135258368.db2.gz OGEBFWIOUGWAFJ-GJZGRUSLSA-N 2 0 247.386 2.162 20 0 BEADRP C(C1CC1)[N@H+](CC1CCC1)CC1CC[NH2+]CC1 ZINC000261905250 135262046 /nfs/dbraw/zinc/26/20/46/135262046.db2.gz YYZJHDUTCGIJFH-UHFFFAOYSA-N 2 0 236.403 2.498 20 0 BEADRP CC[C@]1(C)CCC[N@H+](C[C@]2(C)CC[NH2+]C2)C1 ZINC000261918608 135262728 /nfs/dbraw/zinc/26/27/28/135262728.db2.gz ZZFDMFIRTSZNFN-ZIAGYGMSSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH+]1CCC([NH2+]CC2CC2)CC1 ZINC000261948514 135265350 /nfs/dbraw/zinc/26/53/50/135265350.db2.gz NNXTWXZFEUVSCU-DGCLKSJQSA-N 2 0 222.376 2.106 20 0 BEADRP CCc1cccc(F)c1CN1C[C@@H](C)[C@@H]([NH3+])C1 ZINC000261964079 135266781 /nfs/dbraw/zinc/26/67/81/135266781.db2.gz HOEVBLRMYFBDPR-YGRLFVJLSA-N 2 0 236.334 2.167 20 0 BEADRP CC(C)[C@@H]1CCC[N@H+](C[C@H]2CCC[NH2+]C2)C1 ZINC000261982467 135269805 /nfs/dbraw/zinc/26/98/05/135269805.db2.gz RNYHWSMDDPKJTN-UONOGXRCSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@H]1C[C@@H]1C[N@@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000262017361 135272919 /nfs/dbraw/zinc/27/29/19/135272919.db2.gz VUNZJOKHBPPRGI-XZDPQHSOSA-N 2 0 244.382 2.317 20 0 BEADRP CC(C)[C@@H]1CCC[N@H+](CC2CC[NH2+]CC2)C1 ZINC000262054189 135276663 /nfs/dbraw/zinc/27/66/63/135276663.db2.gz ZZTZVFLLTCVKON-CQSZACIVSA-N 2 0 224.392 2.354 20 0 BEADRP C[N@H+](C[C@]1(C)CC[NH2+]C1)[C@@H]1CCC(C)(C)C1 ZINC000262075163 135277372 /nfs/dbraw/zinc/27/73/72/135277372.db2.gz SKYXHOWRNMGDKB-TZMCWYRMSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1Cc2ccccc2C[N@@H+]1C[C@@]1(C)CC[NH2+]C1 ZINC000262118909 135279482 /nfs/dbraw/zinc/27/94/82/135279482.db2.gz XDZSNOYQAKZAKZ-BBRMVZONSA-N 2 0 244.382 2.433 20 0 BEADRP [NH3+]CCN1CCC[C@@H]1Cc1ccccc1Cl ZINC000262991613 135325522 /nfs/dbraw/zinc/32/55/22/135325522.db2.gz NVUYQLNYJCDEQC-GFCCVEGCSA-N 2 0 238.762 2.306 20 0 BEADRP CC(C)CC[N@@H+]1CCC[C@H]2C[NH+](C)CC[C@H]21 ZINC000334356231 135369667 /nfs/dbraw/zinc/36/96/67/135369667.db2.gz MTUINFFTJLUFAL-UONOGXRCSA-N 2 0 224.392 2.449 20 0 BEADRP CC(C)(C)CC[N@@H+]1CCC[C@]2(CC[NH2+]C2)C1 ZINC000334357193 135372645 /nfs/dbraw/zinc/37/26/45/135372645.db2.gz PKVGWNDIYMADCN-CQSZACIVSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@H](C[NH2+]Cc1cc[nH]c1)C[NH+]1CCCCC1 ZINC000080773890 135384601 /nfs/dbraw/zinc/38/46/01/135384601.db2.gz LHSQIVLALSFWAZ-CYBMUJFWSA-N 2 0 235.375 2.226 20 0 BEADRP C[C@H]([NH2+][C@H]1CCc2nc[nH]c2C1)c1nccs1 ZINC000334404853 135392993 /nfs/dbraw/zinc/39/29/93/135392993.db2.gz HBJLATHWPZMGEK-IUCAKERBSA-N 2 0 248.355 2.074 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@@H]([NH3+])C1)c1cccnc1 ZINC000088169834 135516867 /nfs/dbraw/zinc/51/68/67/135516867.db2.gz VWNHKFSYIJLCTR-CYZMBNFOSA-N 2 0 219.332 2.002 20 0 BEADRP C[C@H]([NH2+][C@H]1CCCC[C@H]1C[NH3+])c1ccco1 ZINC000088169555 135517157 /nfs/dbraw/zinc/51/71/57/135517157.db2.gz GAMGJRLKUVMGSE-SRVKXCTJSA-N 2 0 222.332 2.448 20 0 BEADRP C[C@@H]1CCC[C@H]1C[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000230665225 135549131 /nfs/dbraw/zinc/54/91/31/135549131.db2.gz XRHLLWRCHKVNGJ-FRRDWIJNSA-N 2 0 210.365 2.154 20 0 BEADRP Cc1csc(C[NH2+][C@@H](C)CCC[NH3+])c1 ZINC000344616076 135786933 /nfs/dbraw/zinc/78/69/33/135786933.db2.gz SUGUKDORDRMIOO-JTQLQIEISA-N 2 0 212.362 2.274 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+]C1CCCCC1 ZINC000334875552 135830352 /nfs/dbraw/zinc/83/03/52/135830352.db2.gz NUWIDUIIJJTMGE-KCXRBIIJSA-N 2 0 222.376 2.425 20 0 BEADRP C[C@@H]1CCCC[C@H]1[NH2+]CC1=CC[NH2+]CC1 ZINC000335061433 135885856 /nfs/dbraw/zinc/88/58/56/135885856.db2.gz TZPALTRFODUKGT-DGCLKSJQSA-N 2 0 208.349 2.074 20 0 BEADRP C[C@@H]1CCCN1Cc1ncc(CN(C)C)s1 ZINC000347769792 136008650 /nfs/dbraw/zinc/00/86/50/136008650.db2.gz HUTJQQALAJXTSH-SNVBAGLBSA-N 2 0 239.388 2.189 20 0 BEADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@@H]1CC[C@@H]1CC ZINC000348069914 136026242 /nfs/dbraw/zinc/02/62/42/136026242.db2.gz HBEOIXDVRJKAGP-BFHYXJOUSA-N 2 0 242.407 2.121 20 0 BEADRP Cc1cc(N)cc(C[NH2+][C@H]2CC[N@@H+](C)C[C@H]2C)c1 ZINC000335356512 136062015 /nfs/dbraw/zinc/06/20/15/136062015.db2.gz DKUGESOVWICPHD-DOMZBBRYSA-N 2 0 247.386 2.007 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCC2(F)CCC2)CN1C1CC1 ZINC000348324692 136069976 /nfs/dbraw/zinc/06/99/76/136069976.db2.gz KYWMWKFQRNIYFW-NEPJUHHUSA-N 2 0 240.366 2.484 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CCC2(F)CCC2)CN1C1CC1 ZINC000348324696 136070053 /nfs/dbraw/zinc/07/00/53/136070053.db2.gz KYWMWKFQRNIYFW-RYUDHWBXSA-N 2 0 240.366 2.484 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCC2(F)CCC2)CN1C1CC1 ZINC000348324697 136070088 /nfs/dbraw/zinc/07/00/88/136070088.db2.gz KYWMWKFQRNIYFW-VXGBXAGGSA-N 2 0 240.366 2.484 20 0 BEADRP Cc1cc(N)cc(C[NH2+][C@@H]2CC[NH2+]CC[C@@H]2C)c1 ZINC000335363901 136095117 /nfs/dbraw/zinc/09/51/17/136095117.db2.gz UAJUFNFNOKJHHD-SWLSCSKDSA-N 2 0 247.386 2.055 20 0 BEADRP Cc1cc(N)cc(C[NH2+][C@@H]2CCCCC[C@@H]2[NH3+])c1 ZINC000335364716 136095283 /nfs/dbraw/zinc/09/52/83/136095283.db2.gz WDNQNOWSTWYLEE-LSDHHAIUSA-N 2 0 247.386 2.327 20 0 BEADRP CC(C)([NH3+])C[NH2+][C@@H]1CCCC12CCCC2 ZINC000335596095 136105042 /nfs/dbraw/zinc/10/50/42/136105042.db2.gz CXOCXFSAARVHKS-LLVKDONJSA-N 2 0 210.365 2.426 20 0 BEADRP C(C1CCCCC1)[NH+]1CCC2(CC[NH2+]2)CC1 ZINC000335562865 136106749 /nfs/dbraw/zinc/10/67/49/136106749.db2.gz YXYIURJRELTWFX-UHFFFAOYSA-N 2 0 222.376 2.395 20 0 BEADRP C[C@H]1Cc2ccc(F)cc2[C@H]1[NH2+]C1CC[NH2+]CC1 ZINC000335568795 136108789 /nfs/dbraw/zinc/10/87/89/136108789.db2.gz SOWGQAWPNHMSOS-BONVTDFDSA-N 2 0 248.345 2.401 20 0 BEADRP CN(C)c1cccc(C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)c1 ZINC000517177195 397939388 /nfs/dbraw/zinc/93/93/88/397939388.db2.gz XEMNFEMXOPJOBN-UONOGXRCSA-N 2 0 247.386 2.112 20 0 BEADRP CC(C)CCOCC[NH2+][C@H]1CC[NH2+]CC1(C)C ZINC000302317856 397911127 /nfs/dbraw/zinc/91/11/27/397911127.db2.gz LDBHSTPCGGCNGL-ZDUSSCGKSA-N 2 0 242.407 2.027 20 0 BEADRP C[C@H]([NH2+]CCC[NH3+])[C@H]1CC2CCC1CC2 ZINC000382158591 397916136 /nfs/dbraw/zinc/91/61/36/397916136.db2.gz OYOIMBROBAXMCC-YWPUVAFDSA-N 2 0 210.365 2.140 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H](C)Cc1ccc(F)cc1 ZINC000414829696 398050260 /nfs/dbraw/zinc/05/02/60/398050260.db2.gz BHYOYGSMQPJXRL-RYUDHWBXSA-N 2 0 238.350 2.202 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]Cc1c(C)cccc1C ZINC000414829415 398050402 /nfs/dbraw/zinc/05/04/02/398050402.db2.gz AQHSAKKFLFJNMU-NSHDSACASA-N 2 0 220.360 2.249 20 0 BEADRP C[C@H](C[N@H+](C)C[C@@H]1CC[NH2+]C1)c1ccccc1 ZINC000382752867 397972139 /nfs/dbraw/zinc/97/21/39/397972139.db2.gz JDZDRUHLAKLCCE-ZIAGYGMSSA-N 2 0 232.371 2.331 20 0 BEADRP NC[C@@H]1CCC[N@@H+]1CCCc1ccccc1 ZINC000019843309 397983895 /nfs/dbraw/zinc/98/38/95/397983895.db2.gz LTQMRPNCLOKBQW-AWEZNQCLSA-N 2 0 218.344 2.042 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]Cc1ccc(C)c(F)c1 ZINC000414829483 398050912 /nfs/dbraw/zinc/05/09/12/398050912.db2.gz BCCMPUYOCDBEAL-SNVBAGLBSA-N 2 0 224.323 2.079 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]C[C@H](C)Cc1ccccc1 ZINC000414850664 398058316 /nfs/dbraw/zinc/05/83/16/398058316.db2.gz ZRCNABHJIVZELA-KGLIPLIRSA-N 2 0 234.387 2.310 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000128907787 398098244 /nfs/dbraw/zinc/09/82/44/398098244.db2.gz CDVUKLZHBLNSSX-CHWSQXEVSA-N 2 0 236.359 2.332 20 0 BEADRP CCOc1cccc(C[NH2+][C@H]2CC[NH2+][C@@H](C)C2)c1 ZINC000414945753 398121261 /nfs/dbraw/zinc/12/12/61/398121261.db2.gz IVAQVSYJIRENHS-JSGCOSHPSA-N 2 0 248.370 2.315 20 0 BEADRP C[C@H](Cc1ccco1)[NH2+]CCCC[NH+](C)C ZINC000062772080 1172779724 /nfs/dbraw/zinc/77/97/24/1172779724.db2.gz TYKOCJYVJMEOHT-GFCCVEGCSA-N 2 0 224.348 2.142 20 0 BEADRP C[C@H]1C[C@@H]1C[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000668782164 487529374 /nfs/dbraw/zinc/52/93/74/487529374.db2.gz AIDZUKLDTRDFCO-SWLSCSKDSA-N 2 0 236.403 2.354 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@H]1CC[C@@H](C)SC1 ZINC000655703343 487557240 /nfs/dbraw/zinc/55/72/40/487557240.db2.gz OLHXVUAVICBKTA-UTUOFQBUSA-N 2 0 230.421 2.200 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000308877927 487570041 /nfs/dbraw/zinc/57/00/41/487570041.db2.gz UVSCMMZSQTZCPH-FRRDWIJNSA-N 2 0 210.365 2.106 20 0 BEADRP Cc1ccc(F)cc1C[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000334845226 487572528 /nfs/dbraw/zinc/57/25/28/487572528.db2.gz KCHXTHNRQCHSET-ZIAGYGMSSA-N 2 0 236.334 2.494 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]Cc2cccc3c2NCC3)C1 ZINC000334849107 487574003 /nfs/dbraw/zinc/57/40/03/487574003.db2.gz VDIVYAJWHMIKGE-ZIAGYGMSSA-N 2 0 245.370 2.014 20 0 BEADRP C[NH+]1CCC(C)(C[NH2+][C@H]2CCC[C@@H]3C[C@@H]32)CC1 ZINC000393415510 487574700 /nfs/dbraw/zinc/57/47/00/487574700.db2.gz DJNZQBJFIXTRPO-RDBSUJKOSA-N 2 0 236.403 2.497 20 0 BEADRP CC(C)OCCC[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000020197881 167221440 /nfs/dbraw/zinc/22/14/40/167221440.db2.gz CIHHZCOCDFTTKE-UHFFFAOYSA-N 2 0 242.407 2.264 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H]1CS[C@@H](C)C1 ZINC000086934273 487589067 /nfs/dbraw/zinc/58/90/67/487589067.db2.gz VCPYSZORGYMAER-RYUDHWBXSA-N 2 0 230.421 2.202 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@@H]2CS[C@H](C)C2)CC1 ZINC000086935665 487593333 /nfs/dbraw/zinc/59/33/33/487593333.db2.gz ATSRSMYXMXLHEX-YPMHNXCESA-N 2 0 242.432 2.202 20 0 BEADRP CC1CCC([NH2+][C@@H]2CC[C@@H]3C[N@H+](C)C[C@@H]23)CC1 ZINC001651698335 1172976197 /nfs/dbraw/zinc/97/61/97/1172976197.db2.gz VIELEPHZLKWKGJ-VIGLNQMMSA-N 2 0 236.403 2.495 20 0 BEADRP CC[C@H](CC(F)F)C[N@@H+]1CC[C@@H]([C@@H](C)[NH3+])C1 ZINC000662267746 409568468 /nfs/dbraw/zinc/56/84/68/409568468.db2.gz YIDDHVDQEMDAMA-GMTAPVOTSA-N 2 0 234.334 2.337 20 0 BEADRP CO[C@H](C[N@@H+]1CCCC[C@@H]1[C@@H](C)[NH3+])C1CCC1 ZINC000662236389 409524185 /nfs/dbraw/zinc/52/41/85/409524185.db2.gz XCHSBDKAPOXROO-MRVWCRGKSA-N 2 0 240.391 2.003 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CCC[N@H+](CC2CC=CC2)C1 ZINC000662244508 409533422 /nfs/dbraw/zinc/53/34/22/409533422.db2.gz HUDMYJSGVJZGNW-WCQYABFASA-N 2 0 208.349 2.012 20 0 BEADRP CCC[N@H+](C[C@@H]1C[C@H]2C[C@H]2C1)C1CC[NH2+]CC1 ZINC000662261729 409554571 /nfs/dbraw/zinc/55/45/71/409554571.db2.gz AJVSXYPNIYMPPE-BTTYYORXSA-N 2 0 236.403 2.497 20 0 BEADRP FCC[C@@H]1CCC[N@H+](CC[C@@H]2CC[NH2+]C2)C1 ZINC000662310191 409633050 /nfs/dbraw/zinc/63/30/50/409633050.db2.gz HNWZVAKUMNKLJA-STQMWFEESA-N 2 0 228.355 2.058 20 0 BEADRP CC[C@H](CC(F)F)C[N@@H+]1CC[C@@](C)(C[NH3+])C1 ZINC000662272875 409578508 /nfs/dbraw/zinc/57/85/08/409578508.db2.gz JNKHIPRRSUWAOL-PWSUYJOCSA-N 2 0 234.334 2.339 20 0 BEADRP [NH3+]CCC1CC[NH+](Cc2cc(C3CC3)no2)CC1 ZINC000662283812 409614899 /nfs/dbraw/zinc/61/48/99/409614899.db2.gz KQVIJDSLFVTZTQ-UHFFFAOYSA-N 2 0 249.358 2.113 20 0 BEADRP CO[C@H](C[N@@H+]1CC[C@H]([NH3+])C[C@H]1C)C1CCCC1 ZINC000662284277 409615431 /nfs/dbraw/zinc/61/54/31/409615431.db2.gz MJIRHMJSRGEEBY-KWCYVHTRSA-N 2 0 240.391 2.003 20 0 BEADRP COc1ccc(C[NH2+]CC[C@@H]2CCC[NH2+]C2)cc1 ZINC000259107923 409733283 /nfs/dbraw/zinc/73/32/83/409733283.db2.gz VADMUAVYPGLTSV-ZDUSSCGKSA-N 2 0 248.370 2.175 20 0 BEADRP CC(C)SCC[NH2+][C@@H]1CC[N@H+](C)C[C@@H]1C ZINC000308837581 167332129 /nfs/dbraw/zinc/33/21/29/167332129.db2.gz XDZATKQUDSQGQH-NWDGAFQWSA-N 2 0 230.421 2.058 20 0 BEADRP C[C@H]([NH3+])[C@H]1CC[N@H+](C[C@@H](C)C(C)(C)C)C1 ZINC000308778197 409905913 /nfs/dbraw/zinc/90/59/13/409905913.db2.gz BITYDJCGAZNBRK-WOPDTQHZSA-N 2 0 212.381 2.338 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+]CCC1CC[NH2+]CC1 ZINC000309049755 410208459 /nfs/dbraw/zinc/20/84/59/410208459.db2.gz OWPQQJZMUKLBBB-LBPRGKRZSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1CCC[C@H](C[NH2+]CC23CC(C2)C[NH2+]3)C1 ZINC000663501530 410278160 /nfs/dbraw/zinc/27/81/60/410278160.db2.gz XJXPHQPFQHGPPL-KBHBFKLGSA-N 2 0 222.376 2.154 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+]Cc1cccc2c1CCC2 ZINC000650703865 410335629 /nfs/dbraw/zinc/33/56/29/410335629.db2.gz VOULDSMBYVILMX-WBMJQRKESA-N 2 0 244.382 2.263 20 0 BEADRP C[C@@H]1C[C@H](C[NH3+])C[N@@H+]1Cc1cccc2c1CCC2 ZINC000650703184 410336487 /nfs/dbraw/zinc/33/64/87/410336487.db2.gz ORTMJTLUAYOFAR-CHWSQXEVSA-N 2 0 244.382 2.344 20 0 BEADRP C[C@H]1C[C@@H]1C[NH2+]Cc1ccc(C[NH3+])cc1F ZINC000650717072 410355471 /nfs/dbraw/zinc/35/54/71/410355471.db2.gz QZSVQCSUMACINP-JOYOIKCWSA-N 2 0 222.307 2.030 20 0 BEADRP C[C@H]1C[C@H]1C[NH2+]Cc1ccc(C[NH3+])cc1F ZINC000650717071 410355952 /nfs/dbraw/zinc/35/59/52/410355952.db2.gz QZSVQCSUMACINP-CABZTGNLSA-N 2 0 222.307 2.030 20 0 BEADRP [NH3+]CC1(CC[NH2+]Cc2ccc(F)c(F)c2)CC1 ZINC000650712004 410342980 /nfs/dbraw/zinc/34/29/80/410342980.db2.gz MHAWHGITSHQFEV-UHFFFAOYSA-N 2 0 240.297 2.183 20 0 BEADRP CC[C@H](C)C[NH2+]Cc1ccc(C[NH3+])cc1F ZINC000650716832 410352728 /nfs/dbraw/zinc/35/27/28/410352728.db2.gz KSRZRNAJHNOWLJ-JTQLQIEISA-N 2 0 224.323 2.420 20 0 BEADRP Cc1ccc(CC[NH+]2CCC(C)([NH3+])CC2)cc1 ZINC000071536462 410374363 /nfs/dbraw/zinc/37/43/63/410374363.db2.gz WZYZVPWZWRBXKT-UHFFFAOYSA-N 2 0 232.371 2.351 20 0 BEADRP CC(C)(C)C[C@@H]1C[C@H]1[NH2+][C@@H]1CCC[C@@H]1[NH3+] ZINC000650741960 410375182 /nfs/dbraw/zinc/37/51/82/410375182.db2.gz OOWQYITZTFDBKW-NNYUYHANSA-N 2 0 210.365 2.281 20 0 BEADRP C[C@@H]([NH2+]CCC1(C[NH3+])CC1)c1ccoc1 ZINC000650744587 410379995 /nfs/dbraw/zinc/37/99/95/410379995.db2.gz RHFHLVZCLXXECB-SNVBAGLBSA-N 2 0 208.305 2.059 20 0 BEADRP C[C@H]([NH2+]CCC1(C[NH3+])CC1)C1CCCC1 ZINC000650743930 410380210 /nfs/dbraw/zinc/38/02/10/410380210.db2.gz BOJRMNYMJLYZRX-NSHDSACASA-N 2 0 210.365 2.284 20 0 BEADRP [NH3+]CC1(CC[NH2+][C@H]2CCCc3occc32)CC1 ZINC000650746348 410383064 /nfs/dbraw/zinc/38/30/64/410383064.db2.gz ADNQZEMNCSYNAW-LBPRGKRZSA-N 2 0 234.343 2.376 20 0 BEADRP C[C@H]([NH2+]CCC1(C[NH3+])CC1)c1cccc(O)c1 ZINC000650745476 410383187 /nfs/dbraw/zinc/38/31/87/410383187.db2.gz HNLMEMASXCZIPL-NSHDSACASA-N 2 0 234.343 2.172 20 0 BEADRP C[C@]12C[C@H]1CCC[C@@H]2[NH2+]CCC1(C[NH3+])CC1 ZINC000650746712 410384639 /nfs/dbraw/zinc/38/46/39/410384639.db2.gz JKQFKQBCVLSVRZ-AGIUHOORSA-N 2 0 222.376 2.284 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+]CCC1CC[NH2+]CC1 ZINC000650762566 410409576 /nfs/dbraw/zinc/40/95/76/410409576.db2.gz DVBBKZQGSIWFLS-ZDUSSCGKSA-N 2 0 247.386 2.430 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+]CCC1CC[NH2+]CC1 ZINC000650762277 410411258 /nfs/dbraw/zinc/41/12/58/410411258.db2.gz YWSWUJRFPJKUKN-GFCCVEGCSA-N 2 0 236.359 2.190 20 0 BEADRP COC[C@H](CC(C)C)[NH2+]CCC1CC[NH2+]CC1 ZINC000650763833 410411883 /nfs/dbraw/zinc/41/18/83/410411883.db2.gz KINNHSAKCPROEY-AWEZNQCLSA-N 2 0 242.407 2.027 20 0 BEADRP CO[C@@H](C[N@@H+]1CC[C@](C)(C[NH3+])C1)c1ccccc1 ZINC000393283941 410674415 /nfs/dbraw/zinc/67/44/15/410674415.db2.gz BRSKJNDFRBRNLL-LSDHHAIUSA-N 2 0 248.370 2.045 20 0 BEADRP CC[C@@H]([NH2+]C[C@@]1(C)CC1(F)F)[C@@H]1CCC[NH2+]1 ZINC000665267547 410739504 /nfs/dbraw/zinc/73/95/04/410739504.db2.gz YKXPKORFLUJJFA-OUAUKWLOSA-N 2 0 232.318 2.152 20 0 BEADRP C[C@H]([NH2+]CCC(C)(F)F)C1CC[NH+](C)CC1 ZINC000393680145 410754818 /nfs/dbraw/zinc/75/48/18/410754818.db2.gz NUGOQJSLFSAYFJ-JTQLQIEISA-N 2 0 234.334 2.352 20 0 BEADRP CC[C@@H]1C[C@H](C)CC[C@H]1[NH2+][C@H](C)C[NH2+]C ZINC000665296793 410815210 /nfs/dbraw/zinc/81/52/10/410815210.db2.gz XXEGZCPAEXCSSG-FDYHWXHSSA-N 2 0 212.381 2.399 20 0 BEADRP CC[C@@H]1C[C@H](C)CC[C@@H]1[NH2+][C@@H](C)C[NH2+]C ZINC000665296795 410814286 /nfs/dbraw/zinc/81/42/86/410814286.db2.gz XXEGZCPAEXCSSG-XQHKEYJVSA-N 2 0 212.381 2.399 20 0 BEADRP CC(C)[NH2+]CCC[NH+](C(C)C)C(C)C ZINC000125687240 167102084 /nfs/dbraw/zinc/10/20/84/167102084.db2.gz IZKRILOJDDEORN-UHFFFAOYSA-N 2 0 200.370 2.493 20 0 BEADRP CC[NH+](CC)CCNc1cc[nH+]c(C)c1 ZINC000084950863 169782247 /nfs/dbraw/zinc/78/22/47/169782247.db2.gz GSLQCLHBVKDEAN-UHFFFAOYSA-N 2 0 207.321 2.144 20 0 BEADRP CC[NH+](CC)CCSC[C@@H](C)[NH+](C)C ZINC000358858648 169783198 /nfs/dbraw/zinc/78/31/98/169783198.db2.gz HUBQHWVMNYFIRZ-LLVKDONJSA-N 2 0 218.410 2.012 20 0 BEADRP CC(C)OCC[N@H+](CCC[NH3+])CC1CCCC1 ZINC000352519930 167228189 /nfs/dbraw/zinc/22/81/89/167228189.db2.gz SWIZCSUHMFOCGB-UHFFFAOYSA-N 2 0 242.407 2.252 20 0 BEADRP CC(C)OCC[N@H+](C)C1CC[NH+](C(C)C)CC1 ZINC000336716959 167228203 /nfs/dbraw/zinc/22/82/03/167228203.db2.gz XAXBCZNRMCLKKV-UHFFFAOYSA-N 2 0 242.407 2.216 20 0 BEADRP CC(C)OCC[NH2+][C@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000160050083 167244803 /nfs/dbraw/zinc/24/48/03/167244803.db2.gz VALGQLMYHBEMHX-KGLIPLIRSA-N 2 0 242.407 2.312 20 0 BEADRP CC(C)OC[C@@H](C)[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000374325891 167259705 /nfs/dbraw/zinc/25/97/05/167259705.db2.gz CYTZAOKQVUYKID-RDBSUJKOSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@@H]([NH3+])C1)[C@H]1CC1(C)C ZINC000397837521 410936749 /nfs/dbraw/zinc/93/67/49/410936749.db2.gz SZYOVEOKBZXBAW-IRCOFANPSA-N 2 0 210.365 2.281 20 0 BEADRP CC(C)SCC[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@@H]1C ZINC000309408776 167332902 /nfs/dbraw/zinc/33/29/02/167332902.db2.gz VGUWPJDESYXNGT-YNEHKIRRSA-N 2 0 244.448 2.446 20 0 BEADRP CC(C)[C@@H](C)C[NH2+][C@H](C)CCCC[NH3+] ZINC000308637290 167362049 /nfs/dbraw/zinc/36/20/49/167362049.db2.gz BKDBDQRAXGTSCX-NWDGAFQWSA-N 2 0 200.370 2.386 20 0 BEADRP CCC1CC([NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)C1 ZINC000310013061 410996455 /nfs/dbraw/zinc/99/64/55/410996455.db2.gz JMTKCPPXYJJJGY-YIOUJQMASA-N 2 0 222.376 2.391 20 0 BEADRP Cc1cc(N(C)CC[NH+]2CCCCC2)cc[nH+]1 ZINC000651477566 411059484 /nfs/dbraw/zinc/05/94/84/411059484.db2.gz CLZSIPDLKDBPLU-UHFFFAOYSA-N 2 0 233.359 2.312 20 0 BEADRP COC[C@H](CC(C)(C)C)[NH2+][C@H](C)CC[NH+](C)C ZINC000651693979 411136659 /nfs/dbraw/zinc/13/66/59/411136659.db2.gz LCBVNZNYILANDF-OLZOCXBDSA-N 2 0 244.423 2.367 20 0 BEADRP COC[C@H](CC(C)(C)C)[NH2+][C@@H](C)CC[NH+](C)C ZINC000651693981 411136672 /nfs/dbraw/zinc/13/66/72/411136672.db2.gz LCBVNZNYILANDF-STQMWFEESA-N 2 0 244.423 2.367 20 0 BEADRP CC(C)C[N@H+](C)CCC[NH2+]C[C@@H]1C[C@H]1C ZINC000651865869 411147603 /nfs/dbraw/zinc/14/76/03/411147603.db2.gz KQLCMTSALPHJOK-OLZOCXBDSA-N 2 0 212.381 2.210 20 0 BEADRP CC(C)C[N@H+](C)CCC[NH2+][C@@H]1CCSC1 ZINC000651865689 411147958 /nfs/dbraw/zinc/14/79/58/411147958.db2.gz DNCWUENLYACNDP-GFCCVEGCSA-N 2 0 230.421 2.059 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)C1CCC1 ZINC000400989536 411168400 /nfs/dbraw/zinc/16/84/00/411168400.db2.gz XIHPXBQJWWVQTJ-DOERSZECSA-N 2 0 222.376 2.153 20 0 BEADRP C[N@@H+]1CCC[C@@H]2C[NH+](C[C@@H]3C[C@H]4C[C@H]4C3)CC[C@@H]21 ZINC000660012303 411173881 /nfs/dbraw/zinc/17/38/81/411173881.db2.gz SQHRIZRNLLIPMM-LJIZCISZSA-N 2 0 248.414 2.449 20 0 BEADRP FC1(F)CC(C[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)C1 ZINC000401040865 411174574 /nfs/dbraw/zinc/17/45/74/411174574.db2.gz TYFXYXXGPJATSY-SDDRHHMPSA-N 2 0 244.329 2.009 20 0 BEADRP CC(C)C[N@H+](C)CCC[NH2+][C@@H]1CCOC1(C)C ZINC000652222383 411175790 /nfs/dbraw/zinc/17/57/90/411175790.db2.gz MUUKBJVALXKKIB-CYBMUJFWSA-N 2 0 242.407 2.121 20 0 BEADRP CC(C)C[N@H+](C)CCC[NH2+][C@@H](C)[C@H]1CCCO1 ZINC000652221937 411175898 /nfs/dbraw/zinc/17/58/98/411175898.db2.gz AIQRZAKXYBCGJH-UONOGXRCSA-N 2 0 242.407 2.121 20 0 BEADRP c1csc(C[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)c1 ZINC000401071176 411176500 /nfs/dbraw/zinc/17/65/00/411176500.db2.gz NCFASXAHJZENGW-GRYCIOLGSA-N 2 0 236.384 2.226 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]CC2CCC(F)CC2)C1 ZINC000656193354 411200878 /nfs/dbraw/zinc/20/08/78/411200878.db2.gz HQIKJLAGKGSRCB-FIYWTHMPSA-N 2 0 228.355 2.374 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]CC2CCC(F)CC2)C1 ZINC000656193356 411200912 /nfs/dbraw/zinc/20/09/12/411200912.db2.gz HQIKJLAGKGSRCB-TUUUFIMRSA-N 2 0 228.355 2.374 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]CC2CCC(F)CC2)C1 ZINC000656193355 411201013 /nfs/dbraw/zinc/20/10/13/411201013.db2.gz HQIKJLAGKGSRCB-IFWUJCSASA-N 2 0 228.355 2.374 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]CCCOC2CCCC2)C1 ZINC000656197215 411202774 /nfs/dbraw/zinc/20/27/74/411202774.db2.gz PMICIMVXDRFVPL-QWHCGFSZSA-N 2 0 240.391 2.195 20 0 BEADRP COCC1(C[NH2+][C@@H]2C[C@H]([NH3+])c3ccccc32)CC1 ZINC000656200076 411204098 /nfs/dbraw/zinc/20/40/98/411204098.db2.gz JBZKLPZLYZTKLP-UONOGXRCSA-N 2 0 246.354 2.147 20 0 BEADRP Cc1cnc(CC[NH2+][C@H]2CCC[C@H]([NH3+])C2)c(C)c1 ZINC000656200336 411204323 /nfs/dbraw/zinc/20/43/23/411204323.db2.gz LWEFXWQHSMUTQS-KBPBESRZSA-N 2 0 247.386 2.100 20 0 BEADRP COc1c(C)cccc1CN[C@H](C)[C@@H]1CCC[NH2+]1 ZINC000656201411 411206888 /nfs/dbraw/zinc/20/68/88/411206888.db2.gz WYLGIZXXYWMVBW-OCCSQVGLSA-N 2 0 248.370 2.234 20 0 BEADRP Cc1nccc(N[C@@H]2CCC[N@@H+]3CCCC[C@H]23)n1 ZINC000656226189 411215182 /nfs/dbraw/zinc/21/51/82/411215182.db2.gz LLZXDBHCPNDIMN-CHWSQXEVSA-N 2 0 246.358 2.214 20 0 BEADRP CCCC[N@@H+]1CCCC[C@@H]1[C@H]1C[C@@H]([NH3+])CCO1 ZINC000652360346 411217563 /nfs/dbraw/zinc/21/75/63/411217563.db2.gz FXFKFCJNKNJLMK-BFHYXJOUSA-N 2 0 240.391 2.147 20 0 BEADRP C([C@@H]1CC[NH2+]C1)[N@H+](C1CC1)C1CCCC1 ZINC000309720080 411218870 /nfs/dbraw/zinc/21/88/70/411218870.db2.gz VQJDEJDWVJZTCB-LLVKDONJSA-N 2 0 208.349 2.003 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1)c1ccccn1 ZINC000658064215 411229416 /nfs/dbraw/zinc/22/94/16/411229416.db2.gz MLMRGAKYBRSXMV-MGPQQGTHSA-N 2 0 247.386 2.257 20 0 BEADRP C[NH2+]CCC[NH2+][C@H](C1CC1)C1CCCC1 ZINC000423202858 411238122 /nfs/dbraw/zinc/23/81/22/411238122.db2.gz RMUJJMUYOMBEJB-ZDUSSCGKSA-N 2 0 210.365 2.154 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CC[C@H](C)SC2)C1 ZINC000655693956 411239520 /nfs/dbraw/zinc/23/95/20/411239520.db2.gz BIQKVFOAOLXVQU-YNEHKIRRSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CCC[NH+]2CCCC2)CS1 ZINC000655694860 411239832 /nfs/dbraw/zinc/23/98/32/411239832.db2.gz HUFTVEBDYQFHOE-CHWSQXEVSA-N 2 0 242.432 2.346 20 0 BEADRP CCC(C)(C)C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000400983197 411167304 /nfs/dbraw/zinc/16/73/04/411167304.db2.gz WVPFRQBYILXCHU-RWMBFGLXSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H]1CCC[N@@H+]1CCCC1CC[NH2+]CC1 ZINC000050952811 411269721 /nfs/dbraw/zinc/26/97/21/411269721.db2.gz AFNYKXLSHVEBQC-LBPRGKRZSA-N 2 0 210.365 2.251 20 0 BEADRP CC[C@H](C)[N@H+](C)CCCC1CC[NH2+]CC1 ZINC000050952587 411269798 /nfs/dbraw/zinc/26/97/98/411269798.db2.gz TWZVOOJWQPXRKS-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP CCC[C@@H]1CCC[N@H+](C[C@H]2CC[NH2+]C2)C1 ZINC000309843142 411276538 /nfs/dbraw/zinc/27/65/38/411276538.db2.gz RAMQXRTWIOZHSD-OLZOCXBDSA-N 2 0 210.365 2.108 20 0 BEADRP CCC[C@H]1CCC[N@H+](C[C@@H]2CC[NH2+]C2)C1 ZINC000309843144 411276638 /nfs/dbraw/zinc/27/66/38/411276638.db2.gz RAMQXRTWIOZHSD-QWHCGFSZSA-N 2 0 210.365 2.108 20 0 BEADRP CCC(CC)C[N@H+](CC)C[C@@H]1CC[NH2+]C1 ZINC000051889640 411285763 /nfs/dbraw/zinc/28/57/63/411285763.db2.gz CSCAROODDCDRNL-CYBMUJFWSA-N 2 0 212.381 2.354 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCC(C)(C)F)CC[N@@H+]1C ZINC000658193776 411288359 /nfs/dbraw/zinc/28/83/59/411288359.db2.gz YONYOEUHWPJUGN-MNOVXSKESA-N 2 0 216.344 2.197 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CCC(C)(C)F)[C@H](C)C1 ZINC000658193403 411288464 /nfs/dbraw/zinc/28/84/64/411288464.db2.gz UNMRRPBMMIOHCU-NEPJUHHUSA-N 2 0 230.371 2.445 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CCc2ccoc2)[C@@H](C)C1 ZINC000658202197 411291109 /nfs/dbraw/zinc/29/11/09/411291109.db2.gz VGODWZBLQMKEJB-JSGCOSHPSA-N 2 0 236.359 2.142 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCC[C@H]3C[C@H]32)CC[N@@H+]1C ZINC000658204772 411291917 /nfs/dbraw/zinc/29/19/17/411291917.db2.gz BIPUTNQOVLDKGD-GZBLMMOJSA-N 2 0 236.403 2.495 20 0 BEADRP CCC[NH+]1CCC([NH2+]C[C@]2(C)CC2(F)F)CC1 ZINC000658217908 411298087 /nfs/dbraw/zinc/29/80/87/411298087.db2.gz GEIAVCIFNCQDKL-LBPRGKRZSA-N 2 0 246.345 2.496 20 0 BEADRP CC[C@H]([NH2+]CC[C@H]1CCC[N@@H+]1C)C1CC1 ZINC000658236330 411305870 /nfs/dbraw/zinc/30/58/70/411305870.db2.gz INWQLCYMKMXVCQ-OLZOCXBDSA-N 2 0 210.365 2.249 20 0 BEADRP C[N@H+](C/C=C\c1ccccc1)C1CC[NH2+]CC1 ZINC000082182939 411306680 /nfs/dbraw/zinc/30/66/80/411306680.db2.gz PFMPDTRROMGAJB-YVMONPNESA-N 2 0 230.355 2.384 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2C(C)(C)C2(F)F)CC[N@@H+]1C ZINC000658279764 411319426 /nfs/dbraw/zinc/31/94/26/411319426.db2.gz CPDBQPQESAMTIX-OUAUKWLOSA-N 2 0 246.345 2.350 20 0 BEADRP C[C@@H](c1ccncc1)[N@@H+]1C[C@@H]2CCC[C@]2(C[NH3+])C1 ZINC000402907791 411321311 /nfs/dbraw/zinc/32/13/11/411321311.db2.gz XVRULQZTEPBFFP-QEJZJMRPSA-N 2 0 245.370 2.203 20 0 BEADRP c1ccc2c(c1)CCC[N@@H+](C[C@H]1CC[NH2+]C1)C2 ZINC000062944702 411324952 /nfs/dbraw/zinc/32/49/52/411324952.db2.gz HCOQZDXWFLRSFP-ZDUSSCGKSA-N 2 0 230.355 2.044 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[C@@H](C)SC1)C[NH+](C)C ZINC000655769877 411252140 /nfs/dbraw/zinc/25/21/40/411252140.db2.gz RFKTVQZBYLBNNF-IJLUTSLNSA-N 2 0 230.421 2.058 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC[C@@H](C)SC1)C[NH+](C)C ZINC000655769878 411252227 /nfs/dbraw/zinc/25/22/27/411252227.db2.gz RFKTVQZBYLBNNF-UTUOFQBUSA-N 2 0 230.421 2.058 20 0 BEADRP CCc1ccc(C[N@@H+]2CC[C@@H](C[NH3+])C2)s1 ZINC000050248242 411256480 /nfs/dbraw/zinc/25/64/80/411256480.db2.gz IPRIUBLYWMWBCL-JTQLQIEISA-N 2 0 224.373 2.091 20 0 BEADRP CC(C)[C@H]1C[C@H]([NH2+]CC2([NH3+])CCCC2)CCO1 ZINC000656789275 411369657 /nfs/dbraw/zinc/36/96/57/411369657.db2.gz LEKDXBAPUSROAY-CHWSQXEVSA-N 2 0 240.391 2.051 20 0 BEADRP CC(C[NH+]1CC[C@@H]2C[C@@H]2C1)C[N@@H+]1CC[C@@H]2C[C@@H]2C1 ZINC000661974293 411341335 /nfs/dbraw/zinc/34/13/35/411341335.db2.gz VSSSVRQTAOLSOC-KLHDSHLOSA-N 2 0 248.414 2.306 20 0 BEADRP CC1=CC[C@H]([NH2+][C@H]2CCn3ccnc3C2)CC1 ZINC000336472101 168121320 /nfs/dbraw/zinc/12/13/20/168121320.db2.gz CEDNCLHZJMXDJW-STQMWFEESA-N 2 0 231.343 2.286 20 0 BEADRP CC1=C[C@H](C)C[C@H](C[N@H+]2C[C@H]3C[NH+](C)C[C@H]3C2)C1 ZINC000356392090 168131381 /nfs/dbraw/zinc/13/13/81/168131381.db2.gz JRXNXWFSZXHSLI-QCEMKRCNSA-N 2 0 248.414 2.472 20 0 BEADRP CC1CC([NH2+][C@@H]2CC[N@H+](C)[C@@H]3CCC[C@@H]32)C1 ZINC000309759813 168148037 /nfs/dbraw/zinc/14/80/37/168148037.db2.gz IKWIIXKQTMMFGP-YTPFDHIKSA-N 2 0 222.376 2.247 20 0 BEADRP CC1CC([NH2+][C@@H]2CC[N@H+](C)[C@H]3CCC[C@@H]32)C1 ZINC000309759811 168148353 /nfs/dbraw/zinc/14/83/53/168148353.db2.gz IKWIIXKQTMMFGP-YAWVXEGQSA-N 2 0 222.376 2.247 20 0 BEADRP CC1CC([NH2+][C@@H]2CC[N@H+](C)[C@H]3CCC[C@H]32)C1 ZINC000309759807 168148518 /nfs/dbraw/zinc/14/85/18/168148518.db2.gz IKWIIXKQTMMFGP-LFGDDXOXSA-N 2 0 222.376 2.247 20 0 BEADRP CC1CCC([N@H+](C)CC2CC[NH2+]CC2)CC1 ZINC000042488228 168157639 /nfs/dbraw/zinc/15/76/39/168157639.db2.gz KSAFXJWHFIIURS-UHFFFAOYSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CCC[N@H+](Cc2ccccn2)[C@@H]1CC[NH3+] ZINC000404360305 411391421 /nfs/dbraw/zinc/39/14/21/411391421.db2.gz DWXVNHHJYKQGQV-TZMCWYRMSA-N 2 0 233.359 2.031 20 0 BEADRP CC[C@H](C)[NH2+]Cc1cccc2c1CC[NH2+]C2 ZINC000125648766 411391482 /nfs/dbraw/zinc/39/14/82/411391482.db2.gz ZXVQXNMVPPPDDT-NSHDSACASA-N 2 0 218.344 2.220 20 0 BEADRP C[C@@H]1CCC[N@H+](CC2CCC2)[C@H]1CC[NH3+] ZINC000404392557 411393172 /nfs/dbraw/zinc/39/31/72/411393172.db2.gz YWNJMKYYKWIFNA-YPMHNXCESA-N 2 0 210.365 2.236 20 0 BEADRP Cc1ccc(C[N@H+]2CCC[C@H](C)[C@@H]2CC[NH3+])cn1 ZINC000404431449 411396201 /nfs/dbraw/zinc/39/62/01/411396201.db2.gz OTYRJTZEUWDYRR-WFASDCNBSA-N 2 0 247.386 2.339 20 0 BEADRP CC(C)[C@@H]1C[C@H]1C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000647797879 411404920 /nfs/dbraw/zinc/40/49/20/411404920.db2.gz GFBVLELIQFEKAG-LXFSFDBISA-N 2 0 236.403 2.256 20 0 BEADRP CC[C@H](C)[NH2+]Cc1ccccc1C[NH2+]C ZINC000404693470 411405394 /nfs/dbraw/zinc/40/53/94/411405394.db2.gz UKEADHXNDCICAK-NSHDSACASA-N 2 0 206.333 2.294 20 0 BEADRP C[C@@H]1C[N@H+](CC(C)(C)[NH3+])CCc2ccccc21 ZINC000404804930 411407878 /nfs/dbraw/zinc/40/78/78/411407878.db2.gz XKYVVFDFUNLWMN-GFCCVEGCSA-N 2 0 232.371 2.386 20 0 BEADRP C[C@H]1C[N@H+](C[C@@H]2CC[NH2+]C2)CCc2ccccc21 ZINC000404880769 411410803 /nfs/dbraw/zinc/41/08/03/411410803.db2.gz FVQYXAYFJZRMOH-UONOGXRCSA-N 2 0 244.382 2.258 20 0 BEADRP CCCC[NH2+]Cc1ccnn1-c1cc[nH+]cc1 ZINC000657285747 411444473 /nfs/dbraw/zinc/44/44/73/411444473.db2.gz IPHABMVUCLFFQC-UHFFFAOYSA-N 2 0 230.315 2.157 20 0 BEADRP CC(C)C[NH2+]Cc1ccnn1-c1cc[nH+]cc1 ZINC000657286266 411445548 /nfs/dbraw/zinc/44/55/48/411445548.db2.gz NDUFGKMRTRDMJD-UHFFFAOYSA-N 2 0 230.315 2.013 20 0 BEADRP CC(C)CCC[NH2+][C@@H](C)[C@H]1CCC[NH2+]C1 ZINC000414825841 411450039 /nfs/dbraw/zinc/45/00/39/411450039.db2.gz UJEWTUBPAPQBDW-STQMWFEESA-N 2 0 212.381 2.400 20 0 BEADRP CC[C@@H]1OCC[C@H]1[NH2+]CC[C@@H]1CCCC[N@@H+]1C ZINC000657369581 411483438 /nfs/dbraw/zinc/48/34/38/411483438.db2.gz FASFIZPQJIBVCX-MJBXVCDLSA-N 2 0 240.391 2.018 20 0 BEADRP C[NH+](C)C1CC([NH2+]C2CCC3(CC3)CC2)C1 ZINC000655792406 411515213 /nfs/dbraw/zinc/51/52/13/411515213.db2.gz PNCYKBGOUYFNDU-UHFFFAOYSA-N 2 0 222.376 2.391 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]C2CCC(F)(F)CC2)C1 ZINC000655803262 411518808 /nfs/dbraw/zinc/51/88/08/411518808.db2.gz OTQFTDKBQISUEV-KLPPZKSPSA-N 2 0 246.345 2.494 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)C1CCC1 ZINC000655805461 411519409 /nfs/dbraw/zinc/51/94/09/411519409.db2.gz HSFWQGWAAWYSJB-GMXVVIOVSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@H]1CCC[C@H]([NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)C1 ZINC000655806942 411520373 /nfs/dbraw/zinc/52/03/73/411520373.db2.gz DTSIPFWZIDKBRE-XDQVBPFNSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)C1 ZINC000655806941 411520520 /nfs/dbraw/zinc/52/05/20/411520520.db2.gz DTSIPFWZIDKBRE-SYQHCUMBSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)C1 ZINC000655805873 411520694 /nfs/dbraw/zinc/52/06/94/411520694.db2.gz MRQDEJNWCYPTPE-LPWJVIDDSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1ccccn1 ZINC000655805731 411520698 /nfs/dbraw/zinc/52/06/98/411520698.db2.gz RRQOZLFBPBZPLJ-UPJWGTAASA-N 2 0 233.359 2.072 20 0 BEADRP CC[C@@H](C)[C@@H](C)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655807908 411521749 /nfs/dbraw/zinc/52/17/49/411521749.db2.gz WAXSJMCHRLSVQL-LPWJVIDDSA-N 2 0 212.381 2.351 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccsc2C)C1 ZINC000293726439 170007554 /nfs/dbraw/zinc/00/75/54/170007554.db2.gz YWHGABBKOFQLDE-LBPRGKRZSA-N 2 0 238.400 2.488 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+]C[C@@H]2CC=CCC2)C1 ZINC000224996906 170008647 /nfs/dbraw/zinc/00/86/47/170008647.db2.gz MHZUPRZVHCWLDL-KGLIPLIRSA-N 2 0 222.376 2.274 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H]2CCC23CCC3)C1 ZINC000309953723 170010150 /nfs/dbraw/zinc/01/01/50/170010150.db2.gz HIKPEQRBDDCSHZ-STQMWFEESA-N 2 0 222.376 2.251 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(C)cc2)C1 ZINC000037643771 170015092 /nfs/dbraw/zinc/01/50/92/170015092.db2.gz XSLPMLYMGOCXFU-OAHLLOKOSA-N 2 0 232.371 2.426 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH+](C)CCC2CC2)[C@@H](C)C1 ZINC000336671497 170018029 /nfs/dbraw/zinc/01/80/29/170018029.db2.gz YULJXPKRASGVSH-JSGCOSHPSA-N 2 0 224.392 2.449 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH+](C)CC2CC2)C[C@@H]1C ZINC000336648177 170019222 /nfs/dbraw/zinc/01/92/22/170019222.db2.gz NRSAZOIPPIDPJF-AAEUAGOBSA-N 2 0 210.365 2.201 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]C[C@@H]2CC2(C)C)[C@@H](C)C1 ZINC000309426296 170021565 /nfs/dbraw/zinc/02/15/65/170021565.db2.gz FIFFYMMZZJRRNB-AVGNSLFASA-N 2 0 224.392 2.352 20 0 BEADRP CCN1C[C@H]([NH2+]Cc2cscc2C)[C@@H](C)C1 ZINC000309648239 170036526 /nfs/dbraw/zinc/03/65/26/170036526.db2.gz NBDAJQINQUBLGW-GWCFXTLKSA-N 2 0 238.400 2.486 20 0 BEADRP CC[NH2+]CC1CC[NH+]([C@@H](C)c2ccccn2)CC1 ZINC000131481139 170111568 /nfs/dbraw/zinc/11/15/68/170111568.db2.gz NZXMAOBCSDFJAT-ZDUSSCGKSA-N 2 0 247.386 2.464 20 0 BEADRP C([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)C1CC1 ZINC000663346968 411632538 /nfs/dbraw/zinc/63/25/38/411632538.db2.gz YWUIKBXVRYDWCM-AWEZNQCLSA-N 2 0 222.376 2.108 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)C1CC1 ZINC000663346264 411634141 /nfs/dbraw/zinc/63/41/41/411634141.db2.gz RUJBOCFBQVTNAD-JSGCOSHPSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H]1CN(C)C[C@H]1[NH2+][C@@H]1CC[C@@H]1c1ccccc1 ZINC000657713610 411586249 /nfs/dbraw/zinc/58/62/49/411586249.db2.gz IHOQKOMUBNUDJO-LCGIIJARSA-N 2 0 244.382 2.472 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H]2CCCSCC2)C1 ZINC000657843496 411610720 /nfs/dbraw/zinc/61/07/20/411610720.db2.gz ZDNNABBLQLFZOC-STQMWFEESA-N 2 0 242.432 2.204 20 0 BEADRP CC[C@@H](C)C[N@@H+]1CCC[C@@]2(CC[NH+](C)C2)C1 ZINC000660654952 411613045 /nfs/dbraw/zinc/61/30/45/411613045.db2.gz DGUNANXNJUXBCR-KGLIPLIRSA-N 2 0 224.392 2.450 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH2+][C@H]2CCCSCC2)C1 ZINC000657875881 411615278 /nfs/dbraw/zinc/61/52/78/411615278.db2.gz IOJCBXXMDKMEIV-STQMWFEESA-N 2 0 242.432 2.204 20 0 BEADRP C[N@@H+]1CCC[C@@H](CNc2[nH+]ccc3[nH]ccc32)C1 ZINC000663578765 411705473 /nfs/dbraw/zinc/70/54/73/411705473.db2.gz LYMBUUDYILWBEY-NSHDSACASA-N 2 0 244.342 2.317 20 0 BEADRP C[C@H]1CC([NH2+]CC23CC(C2)C[NH2+]3)C[C@H](C)C1 ZINC000663498335 411681355 /nfs/dbraw/zinc/68/13/55/411681355.db2.gz OURDELYRLSLSEO-IBQNZTRDSA-N 2 0 222.376 2.153 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+]Cc1ccccc1N(C)C ZINC000663498177 411681629 /nfs/dbraw/zinc/68/16/29/411681629.db2.gz MGMZRKAKMGCFSW-CQSZACIVSA-N 2 0 249.402 2.216 20 0 BEADRP C[C@@H](C[NH2+]CC12CC(C1)C[NH2+]2)c1ccc(F)cc1 ZINC000663500819 411683115 /nfs/dbraw/zinc/68/31/15/411683115.db2.gz OYFVIFMMNHGTCN-BZUNDVKYSA-N 2 0 248.345 2.271 20 0 BEADRP CC(C)C[C@H](C)C[NH2+]CC12CC(C1)C[NH2+]2 ZINC000663500885 411683877 /nfs/dbraw/zinc/68/38/77/411683877.db2.gz QHEDMFCCMFLGNB-HIFPTAJRSA-N 2 0 210.365 2.010 20 0 BEADRP Cc1cccc2c1CCC[C@@H]2[NH2+]CCC[NH3+] ZINC000663504532 411687059 /nfs/dbraw/zinc/68/70/59/411687059.db2.gz ZQTQQFUPHQDRFJ-AWEZNQCLSA-N 2 0 218.344 2.311 20 0 BEADRP CCC(CC)(CC)C[NH2+][C@@H](C)C[NH2+]C ZINC000663510758 411692664 /nfs/dbraw/zinc/69/26/64/411692664.db2.gz SLBBSNIEKZBVDX-NSHDSACASA-N 2 0 200.370 2.400 20 0 BEADRP CCN(CCC[NH+](C)C)c1[nH+]ccc2[nH]ccc21 ZINC000663838014 411758642 /nfs/dbraw/zinc/75/86/42/411758642.db2.gz YZXZEDAUMLCXSW-UHFFFAOYSA-N 2 0 246.358 2.341 20 0 BEADRP CC[C@@H](C)C[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000297387636 170708356 /nfs/dbraw/zinc/70/83/56/170708356.db2.gz BCRSGORRDUKTMK-LLVKDONJSA-N 2 0 217.316 2.470 20 0 BEADRP CC[NH+](CC)CCC[N@@H+]1CC[C@@H]2C[C@@H]2C1 ZINC000661966891 411924008 /nfs/dbraw/zinc/92/40/08/411924008.db2.gz AMHJFAFQSWOGRB-CHWSQXEVSA-N 2 0 210.365 2.060 20 0 BEADRP CC[C@@H]1C[N@H+](Cc2cccc(OC)c2)CC[C@@H]1[NH3+] ZINC000134100231 412058854 /nfs/dbraw/zinc/05/88/54/412058854.db2.gz YOBRXQPRMUSGAU-HIFRSBDPSA-N 2 0 248.370 2.254 20 0 BEADRP CC[C@H](CC(F)F)C[N@@H+]1CC[C@H]([NH3+])[C@H](C)C1 ZINC000662245509 412040947 /nfs/dbraw/zinc/04/09/47/412040947.db2.gz RTNWMUKWTVGKCO-MXWKQRLJSA-N 2 0 234.334 2.337 20 0 BEADRP CC[C@@H](C[NH2+][C@](C)(CN)C1CC1)CC(F)F ZINC000662247378 412045335 /nfs/dbraw/zinc/04/53/35/412045335.db2.gz GCZDTGSTWVJVHR-BXKDBHETSA-N 2 0 234.334 2.385 20 0 BEADRP CO[C@H](C[N@H+](C)CC[C@H]([NH3+])C(C)C)C1CCC1 ZINC000662248034 412047739 /nfs/dbraw/zinc/04/77/39/412047739.db2.gz RFBVAEXMZFUHHX-UONOGXRCSA-N 2 0 242.407 2.107 20 0 BEADRP C[C@H]1C[C@@H](C[NH3+])C[N@@H+]1CCCC1CCC1 ZINC000662265500 412055908 /nfs/dbraw/zinc/05/59/08/412055908.db2.gz PRZLWABROQEWKW-AAEUAGOBSA-N 2 0 210.365 2.236 20 0 BEADRP CC[C@H](CC(F)F)C[N@@H+]1C[C@H](C[NH3+])C[C@@H]1C ZINC000662263445 412055974 /nfs/dbraw/zinc/05/59/74/412055974.db2.gz BHSBLUQHHPYEKX-AXFHLTTASA-N 2 0 234.334 2.337 20 0 BEADRP C[C@@H]1C[C@H](C[NH3+])C[N@@H+]1CCCC1CCC1 ZINC000662265501 412056648 /nfs/dbraw/zinc/05/66/48/412056648.db2.gz PRZLWABROQEWKW-DGCLKSJQSA-N 2 0 210.365 2.236 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000336741157 171042622 /nfs/dbraw/zinc/04/26/22/171042622.db2.gz QUKSPISXMHRAEQ-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+]CCC[NH+]1CCCC1 ZINC000336764474 171059660 /nfs/dbraw/zinc/05/96/60/171059660.db2.gz QASJUDUEYQRTKS-CHWSQXEVSA-N 2 0 210.365 2.251 20 0 BEADRP CC1([NH3+])CC[NH+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC000662271538 412062319 /nfs/dbraw/zinc/06/23/19/412062319.db2.gz VZZYLULZDNKIOI-UPJWGTAASA-N 2 0 222.376 2.236 20 0 BEADRP C(C[NH+]1CCC2(CC[NH2+]C2)CC1)C1CCC1 ZINC000662272011 412062536 /nfs/dbraw/zinc/06/25/36/412062536.db2.gz BDFPOXZHEFPKJF-UHFFFAOYSA-N 2 0 222.376 2.252 20 0 BEADRP C(C[NH+]1CCC([C@@H]2CC[NH2+]C2)CC1)C1CCC1 ZINC000662272684 412063862 /nfs/dbraw/zinc/06/38/62/412063862.db2.gz HYALUNWJUBWINJ-OAHLLOKOSA-N 2 0 236.403 2.498 20 0 BEADRP CC[C@@H]1CO[C@H](C)CN1CCC[NH+](CC)CC ZINC000338251490 171112385 /nfs/dbraw/zinc/11/23/85/171112385.db2.gz PNDPBODHRNVQQZ-ZIAGYGMSSA-N 2 0 242.407 2.218 20 0 BEADRP CC[C@@H]1C[C@@H](C)C[N@@H+]1CCn1ccnc1C ZINC000336700772 171118578 /nfs/dbraw/zinc/11/85/78/171118578.db2.gz LGSKCCKWVLXJQK-DGCLKSJQSA-N 2 0 221.348 2.312 20 0 BEADRP CC[C@@](C)(CO)[NH2+]CCCc1ccc(C)nc1 ZINC000354561301 171169250 /nfs/dbraw/zinc/16/92/50/171169250.db2.gz BEZXEPYTJNCPIB-AWEZNQCLSA-N 2 0 236.359 2.073 20 0 BEADRP CC[C@H](C)C[NH2+]CCC[N@H+](C)C(C)C ZINC000128857392 171285339 /nfs/dbraw/zinc/28/53/39/171285339.db2.gz HCDKFSKVKCSXCM-LBPRGKRZSA-N 2 0 200.370 2.352 20 0 BEADRP CC[C@H](C)[N@@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000662293856 412082726 /nfs/dbraw/zinc/08/27/26/412082726.db2.gz OSDQDVFDNJQEMX-GXTWGEPZSA-N 2 0 224.392 2.497 20 0 BEADRP c1coc(C2CC[NH+](CC[C@@H]3CC[NH2+]C3)CC2)c1 ZINC000662298934 412085860 /nfs/dbraw/zinc/08/58/60/412085860.db2.gz SZHBLPVSIWPAAG-ZDUSSCGKSA-N 2 0 248.370 2.459 20 0 BEADRP CC[C@H](C)[N@@H+]1CCC[C@H](c2ncc[nH]2)C1 ZINC000273133991 171317904 /nfs/dbraw/zinc/31/79/04/171317904.db2.gz VLBDSGGTNJABFH-QWRGUYRKSA-N 2 0 207.321 2.388 20 0 BEADRP CC[C@H](C)[C@@H](C)[NH2+]CC1=CC[N@H+](C)CC1 ZINC000336729577 171364427 /nfs/dbraw/zinc/36/44/27/171364427.db2.gz JDKSUNLPZLSPQU-NWDGAFQWSA-N 2 0 210.365 2.273 20 0 BEADRP CC[C@H](C)[N@@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000662294071 412081818 /nfs/dbraw/zinc/08/18/18/412081818.db2.gz OSDQDVFDNJQEMX-JSGCOSHPSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+]CCC[NH+]1CCCC1 ZINC000020129212 171388697 /nfs/dbraw/zinc/38/86/97/171388697.db2.gz FZLSSQOESNOILK-STQMWFEESA-N 2 0 212.381 2.497 20 0 BEADRP CC[C@H](C)[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1)OC ZINC000362974924 171393655 /nfs/dbraw/zinc/39/36/55/171393655.db2.gz CCHNPYVECONCFP-DGAVXFQQSA-N 2 0 242.407 2.120 20 0 BEADRP Cc1cccc([C@H](C)N2CC3CC2(C[NH3+])C3)c1 ZINC000662304631 412088557 /nfs/dbraw/zinc/08/85/57/412088557.db2.gz SDYBTVHQYNLWDI-OPFPJEHXSA-N 2 0 230.355 2.479 20 0 BEADRP C([C@H]1CC[NH2+]C1)[N@@H+]1CC[C@@H](C2CCCCC2)C1 ZINC000662305436 412091411 /nfs/dbraw/zinc/09/14/11/412091411.db2.gz HPXQXOMYECBDKN-DZGCQCFKSA-N 2 0 236.403 2.498 20 0 BEADRP CCOCCC[N@@H+]1CCC[C@@H](C)[C@H]1CCC[NH3+] ZINC000662315388 412096553 /nfs/dbraw/zinc/09/65/53/412096553.db2.gz SJPOBAMLKXCQQM-ZIAGYGMSSA-N 2 0 242.407 2.252 20 0 BEADRP C(C[N@@H+]1CCC[C@H](C2CCC2)C1)[C@H]1CC[NH2+]C1 ZINC000662317272 412098028 /nfs/dbraw/zinc/09/80/28/412098028.db2.gz OBGLBTOOXMSJLK-HIFRSBDPSA-N 2 0 236.403 2.498 20 0 BEADRP CCc1ccc(CN2CC[C@@H](F)[C@H]([NH3+])C2)cc1 ZINC000662325170 412102320 /nfs/dbraw/zinc/10/23/20/412102320.db2.gz JJIHESRLQYMQFY-ZIAGYGMSSA-N 2 0 236.334 2.120 20 0 BEADRP C[NH2+]CCC[N@H+](C)C[C@H]1CCc2ccccc21 ZINC000662324383 412102371 /nfs/dbraw/zinc/10/23/71/412102371.db2.gz WTEKODURVZWMTK-CQSZACIVSA-N 2 0 232.371 2.258 20 0 BEADRP C[N@H+](CC[C@@H]1CCC[NH2+]C1)C[C@@H]1CC1(C)C ZINC000662331579 412104938 /nfs/dbraw/zinc/10/49/38/412104938.db2.gz NRLNLXGRGYMEPO-STQMWFEESA-N 2 0 224.392 2.354 20 0 BEADRP CC12CC(C1)C[N@@H+]2Cc1cccc2c1CC[NH2+]C2 ZINC000662337249 412108711 /nfs/dbraw/zinc/10/87/11/412108711.db2.gz KJSGKHPNTIKSFX-UHFFFAOYSA-N 2 0 242.366 2.317 20 0 BEADRP C[N@H+](CC[C@@H]1CCC[NH+]1C)C[C@@H]1CC1(C)C ZINC000662345689 412115501 /nfs/dbraw/zinc/11/55/01/412115501.db2.gz LCEFZRZFNCCBPN-STQMWFEESA-N 2 0 224.392 2.449 20 0 BEADRP CC1(C)[C@@H](C[NH2+]C2CCC(C[NH3+])CC2)C1(F)F ZINC000665273827 412215633 /nfs/dbraw/zinc/21/56/33/412215633.db2.gz DYHOJZNCNOAXNQ-VQXHTEKXSA-N 2 0 246.345 2.385 20 0 BEADRP CC[C@H](C)CC[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000665238383 412179258 /nfs/dbraw/zinc/17/92/58/412179258.db2.gz XGCZGQJMJXBMTN-REWJHTLYSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@H](C)C[C@H](C)C1)C1C[NH2+]C1 ZINC000665239611 412180324 /nfs/dbraw/zinc/18/03/24/412180324.db2.gz VVVMQMFFYUQQIS-QNWHQSFQSA-N 2 0 224.392 2.256 20 0 BEADRP C[C@@H]([NH2+]CC1([NH3+])CCCC1)[C@@H]1CC1(C)C ZINC000665246824 412191445 /nfs/dbraw/zinc/19/14/45/412191445.db2.gz OYYDGTODHTZNOX-MNOVXSKESA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]CCC(C)(C)F ZINC000665261537 412204023 /nfs/dbraw/zinc/20/40/23/412204023.db2.gz FNNYICOOCBCHCO-GHMZBOCLSA-N 2 0 216.344 2.102 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+][C@@H]1CCc2ccccc21 ZINC000665262251 412205235 /nfs/dbraw/zinc/20/52/35/412205235.db2.gz XCEPZKVALARYFS-JTNHKYCSSA-N 2 0 218.344 2.389 20 0 BEADRP [NH3+][C@H]1CCCCC[C@@H]1[NH2+]CCc1ccoc1 ZINC000665262278 412205828 /nfs/dbraw/zinc/20/58/28/412205828.db2.gz XWDQSOBEVWTHIV-STQMWFEESA-N 2 0 222.332 2.072 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@@H]1CCC[C@H](C)O1 ZINC000665265530 412208456 /nfs/dbraw/zinc/20/84/56/412208456.db2.gz XOZVKRQTLGKZFC-AGIUHOORSA-N 2 0 228.380 2.051 20 0 BEADRP C[C@]1(CC[NH2+][C@H]2CCC[C@@H]2C[NH3+])CC1(F)F ZINC000665266823 412210809 /nfs/dbraw/zinc/21/08/09/412210809.db2.gz KIWVYMVKOIAFAC-VWYCJHECSA-N 2 0 232.318 2.139 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[NH2+]CC[C@H]1C)c1ccccn1 ZINC000665232905 412172459 /nfs/dbraw/zinc/17/24/59/412172459.db2.gz XJYANQPOBIAIPY-UMVBOHGHSA-N 2 0 247.386 2.163 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+][C@@H]2C[C@H]3CC[C@@H]2O3)c2ccccc21 ZINC000422748069 412172564 /nfs/dbraw/zinc/17/25/64/412172564.db2.gz RTYGUKJOYLNZBO-CGYQILHKSA-N 2 0 244.338 2.041 20 0 BEADRP CC1(C)C[C@]1(C)[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000665275448 412216638 /nfs/dbraw/zinc/21/66/38/412216638.db2.gz KYCGBLPQBPLLGP-SFTQSGBHSA-N 2 0 222.376 2.153 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]CC1=CCCC1 ZINC000665274168 412216837 /nfs/dbraw/zinc/21/68/37/412216837.db2.gz LHHOXQVAEMYHHW-STQMWFEESA-N 2 0 208.349 2.204 20 0 BEADRP CC[C@H]([NH2+]C[C@H]1C(C)(C)C1(F)F)[C@@H]1CCC[NH2+]1 ZINC000665274689 412216851 /nfs/dbraw/zinc/21/68/51/412216851.db2.gz WFTVIBZHCBVDML-DCAQKATOSA-N 2 0 246.345 2.398 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H]1C(C)(C)C1(F)F)[C@@H]1CCC[NH2+]1 ZINC000665274691 412217089 /nfs/dbraw/zinc/21/70/89/412217089.db2.gz WFTVIBZHCBVDML-OUAUKWLOSA-N 2 0 246.345 2.398 20 0 BEADRP CC1(C)[C@H](C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1(F)F ZINC000665274257 412218202 /nfs/dbraw/zinc/21/82/02/412218202.db2.gz MJIRZSRUAFTZIC-IXMYILBSSA-N 2 0 244.329 2.150 20 0 BEADRP C[C@@H]1CC(C)(C)C[C@H]1[NH2+]CC12CC(C1)C[NH2+]2 ZINC000665279710 412222618 /nfs/dbraw/zinc/22/26/18/412222618.db2.gz KHYUVWHGHPJYED-KTEZZQQRSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H](CC(C)(C)C)[NH2+]CC12CC(C1)C[NH2+]2 ZINC000665279676 412223069 /nfs/dbraw/zinc/22/30/69/412223069.db2.gz JJNKDMBBPLOKNE-XSRFYTQQSA-N 2 0 210.365 2.153 20 0 BEADRP C([NH2+][C@@H]1CCC12CCCC2)C12CC(C1)C[NH2+]2 ZINC000665279834 412223246 /nfs/dbraw/zinc/22/32/46/412223246.db2.gz NIGMGFMQRLZDNE-MBHSVXNSSA-N 2 0 220.360 2.051 20 0 BEADRP Cc1cncc([C@@H](C)[NH2+]CC[C@@H]([NH3+])C(C)C)c1 ZINC000665282132 412225791 /nfs/dbraw/zinc/22/57/91/412225791.db2.gz RHOPDTYOIAMCFY-TZMCWYRMSA-N 2 0 235.375 2.414 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+][C@H](C)C(C)(C)C ZINC000665281128 412225919 /nfs/dbraw/zinc/22/59/19/412225919.db2.gz VKXBUIMQJLKPIX-GHMZBOCLSA-N 2 0 200.370 2.384 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+][C@@H](C)[C@H]1CC1(C)C ZINC000665282084 412226640 /nfs/dbraw/zinc/22/66/40/412226640.db2.gz QJFHUQAWZXLAMJ-QJPTWQEYSA-N 2 0 212.381 2.384 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CCCc1ccco1 ZINC000665283888 412228640 /nfs/dbraw/zinc/22/86/40/412228640.db2.gz WRWWWHOKCDRVGE-LBPRGKRZSA-N 2 0 224.348 2.319 20 0 BEADRP [NH3+][C@H]1CCCCC[C@H]1[NH2+]CCCc1ccco1 ZINC000665283652 412229260 /nfs/dbraw/zinc/22/92/60/412229260.db2.gz RRVRVOWFFBEYKQ-UONOGXRCSA-N 2 0 236.359 2.462 20 0 BEADRP c1coc(CCC[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)c1 ZINC000665283722 412229501 /nfs/dbraw/zinc/22/95/01/412229501.db2.gz SWGFDKUNEMOIQW-MELADBBJSA-N 2 0 248.370 2.190 20 0 BEADRP CCC[C@H](C)[C@H](CC)[NH2+][C@H](C)C[NH2+]C ZINC000665296423 412242889 /nfs/dbraw/zinc/24/28/89/412242889.db2.gz SIENRVHIYJYHGP-TUAOUCFPSA-N 2 0 200.370 2.399 20 0 BEADRP C[NH2+]C[C@@H](C)[NH2+]C(C1CCC1)C1CCC1 ZINC000665297896 412244441 /nfs/dbraw/zinc/24/44/41/412244441.db2.gz NVGOZRARHGFXRS-SNVBAGLBSA-N 2 0 210.365 2.153 20 0 BEADRP C[NH2+]C[C@H](C)[NH2+][C@H]1CCC[C@@H](C(C)C)C1 ZINC000665298546 412245770 /nfs/dbraw/zinc/24/57/70/412245770.db2.gz XWYCVXTXYSQIQP-XQQFMLRXSA-N 2 0 212.381 2.399 20 0 BEADRP CC(C)(C[NH2+]C1CC[NH2+]CC1)CC(F)(F)F ZINC000665301429 412249847 /nfs/dbraw/zinc/24/98/47/412249847.db2.gz XNEMLRIWALQVDF-UHFFFAOYSA-N 2 0 238.297 2.307 20 0 BEADRP CC[C@@H]([NH2+][C@@H](C)C1CC[NH+](C)CC1)C1CC1 ZINC000324512982 487625277 /nfs/dbraw/zinc/62/52/77/487625277.db2.gz USTKKLNBXCSWQX-SMDDNHRTSA-N 2 0 224.392 2.495 20 0 BEADRP C[N@H+](Cc1cccs1)C1CCC([NH3+])CC1 ZINC000055144347 172892397 /nfs/dbraw/zinc/89/23/97/172892397.db2.gz JGDISJRLMJURQF-UHFFFAOYSA-N 2 0 224.373 2.450 20 0 BEADRP CN1CCC[C@@H]([NH2+]CCc2ccc(F)cc2)C1 ZINC000076683305 173020717 /nfs/dbraw/zinc/02/07/17/173020717.db2.gz APYMBQQUNOVFFZ-CQSZACIVSA-N 2 0 236.334 2.052 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH2+]Cc2ccc(F)cc2)CC1 ZINC000076683309 173021221 /nfs/dbraw/zinc/02/12/21/173021221.db2.gz XLMVCIAZDBQJSX-CQSZACIVSA-N 2 0 236.334 2.400 20 0 BEADRP C[N@@H+]1CCC[C@@H]1CC[NH+]1CCCCCC1 ZINC000124616693 173029079 /nfs/dbraw/zinc/02/90/79/173029079.db2.gz UBPLILOIEIEQRR-CYBMUJFWSA-N 2 0 210.365 2.347 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH3+])[C@@H]1c1cccs1 ZINC000069796360 173042226 /nfs/dbraw/zinc/04/22/26/173042226.db2.gz DPKWXOKHANQUNA-MWLCHTKSSA-N 2 0 210.346 2.090 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH2+]Cc2ccccc2)CC1 ZINC000076647099 173045551 /nfs/dbraw/zinc/04/55/51/173045551.db2.gz UNVBVZINQUNNCC-AWEZNQCLSA-N 2 0 218.344 2.261 20 0 BEADRP C[N@@H+]1CCC[C@H]1CC[NH+]1CC2CCC1CC2 ZINC000371390479 173051734 /nfs/dbraw/zinc/05/17/34/173051734.db2.gz WPKPDMHOBNZETO-MOKVOYLWSA-N 2 0 222.376 2.345 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]Cc2cccnc2)[C@H]2CCC[C@@H]21 ZINC000367620689 173153585 /nfs/dbraw/zinc/15/35/85/173153585.db2.gz QUGOVTIOUXRJRX-ILXRZTDVSA-N 2 0 245.370 2.044 20 0 BEADRP C[N@H+]1C[C@@H]2C[NH+]([C@H]3CCC(C)(C)C3)C[C@@H]2C1 ZINC000375733656 173197893 /nfs/dbraw/zinc/19/78/93/173197893.db2.gz BWHAPWVFJWFTFO-XQQFMLRXSA-N 2 0 222.376 2.059 20 0 BEADRP C[NH2+]CC1CC[NH+](Cc2ccsc2)CC1 ZINC000051756230 173338327 /nfs/dbraw/zinc/33/83/27/173338327.db2.gz UGXSSWRTFQOVKC-UHFFFAOYSA-N 2 0 224.373 2.180 20 0 BEADRP C[NH2+]CC1CC[NH+]([C@H](C)c2ccccn2)CC1 ZINC000063158980 173338372 /nfs/dbraw/zinc/33/83/72/173338372.db2.gz FFMSJKLHYXIDOT-GFCCVEGCSA-N 2 0 233.359 2.074 20 0 BEADRP C[NH2+]CC1CC[NH+](Cc2ccc(C)s2)CC1 ZINC000063158895 173338761 /nfs/dbraw/zinc/33/87/61/173338761.db2.gz YOVDQVMGVBMYCU-UHFFFAOYSA-N 2 0 238.400 2.488 20 0 BEADRP C[NH2+]CCC1CC[NH+](CCCOC(C)C)CC1 ZINC000354269832 173342779 /nfs/dbraw/zinc/34/27/79/173342779.db2.gz ASBDGQACWQCVPU-UHFFFAOYSA-N 2 0 242.407 2.123 20 0 BEADRP C[NH2+]CCC1CC[NH+](CCC(F)(F)F)CC1 ZINC000070914898 173343333 /nfs/dbraw/zinc/34/33/33/173343333.db2.gz GZEDZNJGRIPWAC-UHFFFAOYSA-N 2 0 238.297 2.260 20 0 BEADRP C[NH2+]CCC[N@H+](C)CCCC(C)(C)C ZINC000300804458 173345694 /nfs/dbraw/zinc/34/56/94/173345694.db2.gz FAJXQSHRWBKPRU-UHFFFAOYSA-N 2 0 200.370 2.354 20 0 BEADRP C[NH2+]CCC[N@H+](C)Cc1ccc2c(c1)CCC2 ZINC000124983640 173346278 /nfs/dbraw/zinc/34/62/78/173346278.db2.gz GFIAHMRVRGLBDJ-UHFFFAOYSA-N 2 0 232.371 2.217 20 0 BEADRP C[NH2+]CCC[N@H+](C)[C@H](C)c1ccc(OC)cc1 ZINC000124777315 173346336 /nfs/dbraw/zinc/34/63/36/173346336.db2.gz DNPQAZSOXVYNGK-GFCCVEGCSA-N 2 0 236.359 2.298 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCC[C@H]1C1CCCC1 ZINC000045086635 173347414 /nfs/dbraw/zinc/34/74/14/173347414.db2.gz REEPJCOEBWXTEO-ZDUSSCGKSA-N 2 0 210.365 2.251 20 0 BEADRP C[NH2+]CCC[NH2+]Cc1c(C)cccc1C ZINC000083344899 173349178 /nfs/dbraw/zinc/34/91/78/173349178.db2.gz HDUOXRPOIBAROZ-UHFFFAOYSA-N 2 0 206.333 2.003 20 0 BEADRP C[NH2+]CCNc1cc(C)[nH+]c2ccccc12 ZINC000054244753 173356963 /nfs/dbraw/zinc/35/69/63/173356963.db2.gz GETNRLMDFVMMGU-UHFFFAOYSA-N 2 0 215.300 2.175 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](CCCCC(F)(F)F)C1 ZINC000124396854 173369587 /nfs/dbraw/zinc/36/95/87/173369587.db2.gz BZVFUWVNKDBQEN-JTQLQIEISA-N 2 0 238.297 2.260 20 0 BEADRP C[NH2+]C[C@@H]1CCCN1c1cc[nH+]c2ccccc21 ZINC000053704012 173369703 /nfs/dbraw/zinc/36/97/03/173369703.db2.gz MHOGUYNAGCJBIT-LBPRGKRZSA-N 2 0 241.338 2.423 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@@H+]([C@@H]2CCc3ccc(F)cc32)C1 ZINC000336578219 173370784 /nfs/dbraw/zinc/37/07/84/173370784.db2.gz XWAMORDMIVXZQN-XHDPSFHLSA-N 2 0 248.345 2.354 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](Cc2coc3ccccc23)C1 ZINC000131032935 173370985 /nfs/dbraw/zinc/37/09/85/173370985.db2.gz HPFWIPDSJIIIHT-LBPRGKRZSA-N 2 0 244.338 2.474 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](Cc2cccc(C)c2C)C1 ZINC000071142595 173371074 /nfs/dbraw/zinc/37/10/74/173371074.db2.gz MJCJUUVQPGBFGO-AWEZNQCLSA-N 2 0 232.371 2.345 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](C[C@H](C)c2ccccc2)C1 ZINC000251074332 173371195 /nfs/dbraw/zinc/37/11/95/173371195.db2.gz GCKDVGNWRPGYLR-KBPBESRZSA-N 2 0 232.371 2.331 20 0 BEADRP C[NH2+]C[C@H]1CCC[N@H+](Cc2ccccc2C)C1 ZINC000011888677 173379290 /nfs/dbraw/zinc/37/92/90/173379290.db2.gz CFKBBMDKVJFXRF-CQSZACIVSA-N 2 0 232.371 2.426 20 0 BEADRP C[NH2+]C[C@H]1CC[N@H+](CCC2CCCCC2)C1 ZINC000053031469 173381028 /nfs/dbraw/zinc/38/10/28/173381028.db2.gz BJHMGBUIMXUZRL-CQSZACIVSA-N 2 0 224.392 2.498 20 0 BEADRP C[NH2+]C[C@H]1CC[N@H+](CCCc2ccccc2)C1 ZINC000011892052 173381863 /nfs/dbraw/zinc/38/18/63/173381863.db2.gz YBNCTWRPIRHPKI-OAHLLOKOSA-N 2 0 232.371 2.161 20 0 BEADRP CSc1cccnc1NCc1cnc(C)n1C ZINC000668287427 487626567 /nfs/dbraw/zinc/62/65/67/487626567.db2.gz BSCZEKHRDWBJFZ-UHFFFAOYSA-N 2 0 248.355 2.458 20 0 BEADRP COC1(C[NH2+]CCC[NH+]2CCCC2)CCCC1 ZINC000336656794 174000385 /nfs/dbraw/zinc/00/03/85/174000385.db2.gz MCRGIRNKZZYWKN-UHFFFAOYSA-N 2 0 240.391 2.021 20 0 BEADRP CC1(C)CC[N@H+](CCCC2CC[NH2+]CC2)C1 ZINC000087255012 487627897 /nfs/dbraw/zinc/62/78/97/487627897.db2.gz RSIQLAPDYNZKQN-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP COCCC(C)(C)C[NH2+][C@@H](C)CCCC[NH3+] ZINC000309375078 174143278 /nfs/dbraw/zinc/14/32/78/174143278.db2.gz PZYWHXLOKDMRJP-LBPRGKRZSA-N 2 0 230.396 2.156 20 0 BEADRP COCCCCC[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@H]1C ZINC000122695103 174184175 /nfs/dbraw/zinc/18/41/75/174184175.db2.gz YZQSYCIJLHGKED-HZSPNIEDSA-N 2 0 242.407 2.121 20 0 BEADRP COCC[C@@H]1CCC[C@@H]1[NH2+][C@H](C)CC[NH+](C)C ZINC000337410444 174397017 /nfs/dbraw/zinc/39/70/17/174397017.db2.gz VSTIAZZMUOGERX-RDBSUJKOSA-N 2 0 242.407 2.121 20 0 BEADRP COCC[C@H](C)[NH2+]CCCCC[NH+]1CCCC1 ZINC000340475545 174406093 /nfs/dbraw/zinc/40/60/93/174406093.db2.gz DBVRWLHGXADFIE-AWEZNQCLSA-N 2 0 242.407 2.267 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+]CC(C)(C)C(C)(C)C ZINC000336652713 174561818 /nfs/dbraw/zinc/56/18/18/174561818.db2.gz DBYJYORUPFTSKB-LBPRGKRZSA-N 2 0 244.423 2.402 20 0 BEADRP CC(C)[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000053659675 487629600 /nfs/dbraw/zinc/62/96/00/487629600.db2.gz BFHSQRMNZLHBMJ-UHFFFAOYSA-N 2 0 247.386 2.292 20 0 BEADRP COc1ccc(C)cc1C[N@@H+]1CC[C@](C)(C[NH3+])C1 ZINC000234858042 175074947 /nfs/dbraw/zinc/07/49/47/175074947.db2.gz IONCKPMFXIOTOO-OAHLLOKOSA-N 2 0 248.370 2.174 20 0 BEADRP COc1cccc(C[NH+]2CCC([C@H](C)[NH3+])CC2)c1 ZINC000111611464 175257273 /nfs/dbraw/zinc/25/72/73/175257273.db2.gz QGGOTEGWHWNZKS-LBPRGKRZSA-N 2 0 248.370 2.254 20 0 BEADRP COc1cccc(C[N@@H+]2CCC[C@@H](CC[NH3+])C2)c1 ZINC000070074238 175258206 /nfs/dbraw/zinc/25/82/06/175258206.db2.gz KKCALSCCZZHGOH-ZDUSSCGKSA-N 2 0 248.370 2.256 20 0 BEADRP COc1cccc(C[NH2+]C2CCC([NH3+])CC2)c1 ZINC000051693546 175262967 /nfs/dbraw/zinc/26/29/67/175262967.db2.gz NCUQHZVETOQAHV-UHFFFAOYSA-N 2 0 234.343 2.055 20 0 BEADRP COc1cccc([C@@H](C)[NH2+]C[C@@H]2CCC[NH2+]C2)c1 ZINC000132186911 175286718 /nfs/dbraw/zinc/28/67/18/175286718.db2.gz LMYCQUOWSZKLPV-CHWSQXEVSA-N 2 0 248.370 2.345 20 0 BEADRP COc1cccc([C@H](C)[NH2+]C2CC[NH2+]CC2)c1 ZINC000038041494 175292124 /nfs/dbraw/zinc/29/21/24/175292124.db2.gz HFHBEEMVCNODLN-NSHDSACASA-N 2 0 234.343 2.098 20 0 BEADRP COc1cccc([C@H](C)[NH2+]C[C@@H]2CCC[NH2+]C2)c1 ZINC000132186726 175293022 /nfs/dbraw/zinc/29/30/22/175293022.db2.gz LMYCQUOWSZKLPV-QWHCGFSZSA-N 2 0 248.370 2.345 20 0 BEADRP COc1ccccc1C[N@H+](C)CC1CC[NH2+]CC1 ZINC000042442367 175325107 /nfs/dbraw/zinc/32/51/07/175325107.db2.gz TWORQPIEADGYGL-UHFFFAOYSA-N 2 0 248.370 2.127 20 0 BEADRP CS[C@H]1CC[C@@H]1[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000309848187 175569858 /nfs/dbraw/zinc/56/98/58/175569858.db2.gz HSFXPLZOMWPDPG-STQMWFEESA-N 2 0 242.432 2.343 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]CCC1CC[NH+](C)CC1 ZINC000122138295 175656425 /nfs/dbraw/zinc/65/64/25/175656425.db2.gz KSYLUCCLXIPCJG-LBPRGKRZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H](CCC1CC1)[NH2+][C@@H](C)CC[NH+](C)C ZINC000308874026 175661592 /nfs/dbraw/zinc/66/15/92/175661592.db2.gz RVYACOQPMFJNJB-RYUDHWBXSA-N 2 0 212.381 2.495 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]CCCc1ccccc1 ZINC000336658421 175664826 /nfs/dbraw/zinc/66/48/26/175664826.db2.gz MTHQZPBFTLFRSA-ZDUSSCGKSA-N 2 0 220.360 2.336 20 0 BEADRP C[C@@H](c1cccc(O)c1)[N@H+](C)CC1CC[NH2+]CC1 ZINC000094011025 176017742 /nfs/dbraw/zinc/01/77/42/176017742.db2.gz RNXBLPIFVPIFCW-LBPRGKRZSA-N 2 0 248.370 2.385 20 0 BEADRP C[C@@H]1CCCC[N@@H+]1CCC[NH2+]Cc1cc[nH]c1 ZINC000080773208 176070483 /nfs/dbraw/zinc/07/04/83/176070483.db2.gz JNRSRWGBLCEWQO-CYBMUJFWSA-N 2 0 235.375 2.369 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[NH2+]CCC[NH+](C)C ZINC000122588388 176076730 /nfs/dbraw/zinc/07/67/30/176076730.db2.gz VBUDBSQSGAORFM-CHWSQXEVSA-N 2 0 212.381 2.354 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[N@@H+]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000357045036 176077059 /nfs/dbraw/zinc/07/70/59/176077059.db2.gz HMEVJWXMEMXBFD-LXTVHRRPSA-N 2 0 236.403 2.354 20 0 BEADRP C[C@@H]1CCCC[C@H]1[NH2+]C1CCC([NH3+])CC1 ZINC000051692906 176087898 /nfs/dbraw/zinc/08/78/98/176087898.db2.gz XBJSBKWDCYGEQI-IKWCTNDRSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@@H]1CCC[N@H+](CC2CC[NH2+]CC2)[C@@H]1C ZINC000050564932 176096341 /nfs/dbraw/zinc/09/63/41/176096341.db2.gz KCSAISMNIWUKGG-VXGBXAGGSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1CCC[C@@H](C)[NH+]1C[C@@H]1CCC[NH2+]C1 ZINC000019507009 176116611 /nfs/dbraw/zinc/11/66/11/176116611.db2.gz YTQFOZSUKFBQCQ-JHJVBQTASA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H]1CCC[C@@H]([N@H+](C)C[C@@H]2CCC[NH2+]C2)C1 ZINC000042495706 176120926 /nfs/dbraw/zinc/12/09/26/176120926.db2.gz LCBANQWDZGQMCW-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CCC[C@@H]1C[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000300244543 176128394 /nfs/dbraw/zinc/12/83/94/176128394.db2.gz YBPNIFVWULNFES-SYQHCUMBSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1CCC[C@@H]1C[NH2+][C@@H]1CC[N@H+](C)C[C@H]1C ZINC000336751978 176128752 /nfs/dbraw/zinc/12/87/52/176128752.db2.gz CRNNJBUSBORSKR-AAVRWANBSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1CCC[C@H]1[NH2+]CC[C@@H]1CCC[N@@H+]1C ZINC000309153730 176150797 /nfs/dbraw/zinc/15/07/97/176150797.db2.gz WZBDZGKDNVMHTC-FRRDWIJNSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H]1CC[N@H+](CC[C@@H]2CCCC[NH+]2C)C1 ZINC000336347245 176169747 /nfs/dbraw/zinc/16/97/47/176169747.db2.gz AXBYJNWFTCSNGK-OLZOCXBDSA-N 2 0 210.365 2.203 20 0 BEADRP C[C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C[NH3+] ZINC000059535378 176176148 /nfs/dbraw/zinc/17/61/48/176176148.db2.gz FKMJKEQHUVZBJG-OCCSQVGLSA-N 2 0 218.344 2.103 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CC2(C)CC[NH2+]CC2)C1 ZINC000129443541 176211873 /nfs/dbraw/zinc/21/18/73/176211873.db2.gz BTKGIAVEDAEQTH-VXGBXAGGSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]C1CCCC1 ZINC000036907483 176277952 /nfs/dbraw/zinc/27/79/52/176277952.db2.gz DPAJTUCYATWMFY-NQBHXWOUSA-N 2 0 210.365 2.247 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+][C@H]1CSC1(C)C ZINC000309823378 176278208 /nfs/dbraw/zinc/27/82/08/176278208.db2.gz WVTQGNGZADXBRE-WYUUTHIRSA-N 2 0 242.432 2.199 20 0 BEADRP C[C@@H]1C[C@@H](C)C[NH+](CC[C@@H]2CCC[NH2+]C2)C1 ZINC000051918886 176361783 /nfs/dbraw/zinc/36/17/83/176361783.db2.gz DTTPXXKDUUTOLF-MCIONIFRSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H]1C[C@@H](C[NH3+])C[N@@H+]1Cc1ccc2c(c1)CCC2 ZINC000131760383 176367542 /nfs/dbraw/zinc/36/75/42/176367542.db2.gz OXGZFWVRIBTNJD-OCCSQVGLSA-N 2 0 244.382 2.344 20 0 BEADRP C[C@@H]1C[C@@H](C[N@@H+]2CCCC(C)(C)C2)CC[NH2+]1 ZINC000235380805 176369153 /nfs/dbraw/zinc/36/91/53/176369153.db2.gz VJSXXZBHWXUWCE-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[C@@H](C[N@@H+]2CCc3ccccc3C2)CC[NH2+]1 ZINC000235413641 176369192 /nfs/dbraw/zinc/36/91/92/176369192.db2.gz HNOUVSUKFPDUMS-KGLIPLIRSA-N 2 0 244.382 2.433 20 0 BEADRP C[C@@H]1C[C@@H]([NH3+])CC[N@@H+]1Cc1cccs1 ZINC000049712691 176370749 /nfs/dbraw/zinc/37/07/49/176370749.db2.gz RPMZHVZUTQBWJA-ZJUUUORDSA-N 2 0 210.346 2.060 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+]Cc1ccc(C[NH+](C)C)cc1 ZINC000340172933 176396463 /nfs/dbraw/zinc/39/64/63/176396463.db2.gz DHFCSXUJOLOFSA-IUODEOHRSA-N 2 0 232.371 2.494 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC2(C)CC[NH+](C)CC2)[C@H]1C ZINC000309275792 176495243 /nfs/dbraw/zinc/49/52/43/176495243.db2.gz DSSGMGNLLUGMEJ-AGIUHOORSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@H](C[NH2+][C@H](C)C1CCCC1)C[NH+](C)C ZINC000336714663 176684536 /nfs/dbraw/zinc/68/45/36/176684536.db2.gz WCAJIDMFQVVTJW-VXGBXAGGSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H](F)CC[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@H]1C ZINC000340471973 176740922 /nfs/dbraw/zinc/74/09/22/176740922.db2.gz XXZDUYROMVARHS-NOOOWODRSA-N 2 0 216.344 2.053 20 0 BEADRP C[C@H]([NH2+]CCCC[NH3+])c1ccc(F)cc1 ZINC000037714818 176843152 /nfs/dbraw/zinc/84/31/52/176843152.db2.gz NAOQLXZZLZPHBV-JTQLQIEISA-N 2 0 210.296 2.215 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@@H]([NH3+])C1)c1cccc(O)c1 ZINC000222958960 176896544 /nfs/dbraw/zinc/89/65/44/176896544.db2.gz BMXILSSBTGFDMS-CYZMBNFOSA-N 2 0 234.343 2.313 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1)C1CC1 ZINC000251533371 176896952 /nfs/dbraw/zinc/89/69/52/176896952.db2.gz KKGABOSSRUNFIV-IGHBBLSQSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@H](c1ccncc1)[N@H+](C)CCCn1ccnc1 ZINC000181085149 177050250 /nfs/dbraw/zinc/05/02/50/177050250.db2.gz KOVZRVDPPJQFEN-CYBMUJFWSA-N 2 0 244.342 2.361 20 0 BEADRP C[C@H]1CCC[N@H+](CC[C@@H]2CCC[NH+]2C)C1 ZINC000124631131 177099594 /nfs/dbraw/zinc/09/95/94/177099594.db2.gz CEFHIKARRVAVCP-STQMWFEESA-N 2 0 210.365 2.203 20 0 BEADRP C[C@@H]1CCC[C@H](C)[N@H+]1CC[C@H]1CC[NH2+]C1 ZINC000134197523 177116667 /nfs/dbraw/zinc/11/66/67/177116667.db2.gz QOJGMBZILUXYAD-FRRDWIJNSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@H]1CCC[C@@H]([N@H+](C)CC2CC[NH2+]CC2)C1 ZINC000042495700 177120357 /nfs/dbraw/zinc/12/03/57/177120357.db2.gz HUMOLXMHUWORFZ-GXTWGEPZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1CCC[C@H]([N@H+](C)CC2CC[NH2+]CC2)C1 ZINC000042495696 177133965 /nfs/dbraw/zinc/13/39/65/177133965.db2.gz HUMOLXMHUWORFZ-JSGCOSHPSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]Cc1ccccc1 ZINC000242522261 177234420 /nfs/dbraw/zinc/23/44/20/177234420.db2.gz IOHGIIBXOUYHLW-GXTWGEPZSA-N 2 0 218.344 2.116 20 0 BEADRP C[C@H]1C[N@H+](CCCC(C)(C)C)CC[C@H]1[NH3+] ZINC000300836075 177248779 /nfs/dbraw/zinc/24/87/79/177248779.db2.gz INTNPPMNVQNEMS-NWDGAFQWSA-N 2 0 212.381 2.482 20 0 BEADRP C[C@H]1C[N@H+](CC[C@H]2CC[NH2+]C2)C(C)(C)C1 ZINC000335631444 177254957 /nfs/dbraw/zinc/25/49/57/177254957.db2.gz PBPAGEFQEGDBPY-VXGBXAGGSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]1CSC[C@H]1[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000297611110 177307214 /nfs/dbraw/zinc/30/72/14/177307214.db2.gz VCFGPLKNTMPXFV-GXFFZTMASA-N 2 0 247.367 2.175 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CCC[NH+](C)C)C[C@@H](C)C1 ZINC000238850826 177318564 /nfs/dbraw/zinc/31/85/64/177318564.db2.gz CWHACVBARSMTPG-ITGUQSILSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H]1C[C@@H](C[N@H+](C)CC2CCCC2)CC[NH2+]1 ZINC000235697274 177323330 /nfs/dbraw/zinc/32/33/30/177323330.db2.gz XGJOYLGVOMIHRI-JSGCOSHPSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1C[C@@H](C[NH3+])C[N@@H+]1CCCC(C)(C)C ZINC000300958960 177323709 /nfs/dbraw/zinc/32/37/09/177323709.db2.gz YFAGVUXRAUIKNV-RYUDHWBXSA-N 2 0 212.381 2.482 20 0 BEADRP C[C@H]1C[C@@H]([NH3+])CC[N@@H+]1CCc1cccs1 ZINC000049712300 177326911 /nfs/dbraw/zinc/32/69/11/177326911.db2.gz DDKJDMUDZFHXEL-QWRGUYRKSA-N 2 0 224.373 2.102 20 0 BEADRP C[C@H]1C[C@H](C[NH3+])CN1c1cc[nH+]c2ccccc21 ZINC000216234740 177362337 /nfs/dbraw/zinc/36/23/37/177362337.db2.gz UCJQQOSKTCHTGQ-NWDGAFQWSA-N 2 0 241.338 2.408 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CC2(C)CCC2)CC[N@@H+]1C ZINC000181243998 177369683 /nfs/dbraw/zinc/36/96/83/177369683.db2.gz ACEFXFRSGWKDBZ-NWDGAFQWSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CCC(C)(F)F)CN1C1CC1 ZINC000357710358 177369775 /nfs/dbraw/zinc/36/97/75/177369775.db2.gz OOXMTNZJJNAXMA-UWVGGRQHSA-N 2 0 232.318 2.247 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CCc2ccc(O)cc2)CC[N@@H+]1C ZINC000156113507 177371107 /nfs/dbraw/zinc/37/11/07/177371107.db2.gz STRYNYQFCVQJRC-GXTWGEPZSA-N 2 0 248.370 2.007 20 0 BEADRP C[C@H]1OCC[C@H]1[NH2+]CCCCC[NH+]1CCCC1 ZINC000339500242 177407282 /nfs/dbraw/zinc/40/72/82/177407282.db2.gz YQNKGYBNQLSDMG-ZIAGYGMSSA-N 2 0 240.391 2.020 20 0 BEADRP Cc1ccsc1C[NH2+]CC1([NH3+])CCCC1 ZINC000087310063 487639788 /nfs/dbraw/zinc/63/97/88/487639788.db2.gz XSEJFPNHDBBMJJ-UHFFFAOYSA-N 2 0 224.373 2.418 20 0 BEADRP CCC[C@H](C)C[N@@H+]1CC[C@@H]([NH3+])[C@@H](CC)C1 ZINC000226011530 487643628 /nfs/dbraw/zinc/64/36/28/487643628.db2.gz SQABZFBHKYFATE-RWMBFGLXSA-N 2 0 212.381 2.482 20 0 BEADRP C[NH+](C)CCCC[NH2+]C/C=C/c1ccncc1 ZINC000486937923 225274366 /nfs/dbraw/zinc/27/43/66/225274366.db2.gz MGEJLTUHNUWTAG-AATRIKPKSA-N 2 0 233.359 2.026 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C/C=C\c2ccncc2)CC[N@@H+]1C ZINC000487321844 225299180 /nfs/dbraw/zinc/29/91/80/225299180.db2.gz RMAGFDVJMFTMLE-SQLJOLKNSA-N 2 0 245.370 2.167 20 0 BEADRP C[C@H]1C[C@@H]1C[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000488326255 225373879 /nfs/dbraw/zinc/37/38/79/225373879.db2.gz LJOKAFPRSDFFGW-GXTWGEPZSA-N 2 0 224.392 2.306 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000488358716 225386869 /nfs/dbraw/zinc/38/68/69/225386869.db2.gz XZNGOGZDKFIUBI-RBSFLKMASA-N 2 0 236.403 2.450 20 0 BEADRP C[C@@H](c1ccccn1)[NH+]1CCC(C[NH+](C)C)CC1 ZINC000488401022 225391516 /nfs/dbraw/zinc/39/15/16/225391516.db2.gz VFOUKSUPEAVSOJ-ZDUSSCGKSA-N 2 0 247.386 2.416 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2CC[C@H](C3CC3)C2)CC[NH2+]1 ZINC000400041230 225346509 /nfs/dbraw/zinc/34/65/09/225346509.db2.gz PANXYSCYJMOLHQ-BZPMIXESSA-N 2 0 222.376 2.106 20 0 BEADRP COCC(C)(C)C[NH2+][C@H]1CCC[C@H]([NH+](C)C)C1 ZINC000494080721 226260634 /nfs/dbraw/zinc/26/06/34/226260634.db2.gz VJLNAFWSTOVKIU-STQMWFEESA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H](CCC1CC1)[NH2+][C@H](C)[C@@H]1CCC[NH2+]1 ZINC000400332964 226341036 /nfs/dbraw/zinc/34/10/36/226341036.db2.gz DIWLZQQWPBFXJY-WZRBSPASSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC[C@@H](C)CC1)[C@H]1CCC[NH2+]1 ZINC000400639241 226348420 /nfs/dbraw/zinc/34/84/20/226348420.db2.gz NPTFXRSKFJPSGI-FDYHWXHSSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[NH2+]C[C@H]1C)[C@@H]1CC1(C)C ZINC000397775115 262745759 /nfs/dbraw/zinc/74/57/59/262745759.db2.gz IBNOOGJUFAAIOI-WYUUTHIRSA-N 2 0 210.365 2.009 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+]C[C@H](C)C(C)(C)C ZINC000163005219 487677634 /nfs/dbraw/zinc/67/76/34/487677634.db2.gz NGDZCINGBKVDGB-WDEREUQCSA-N 2 0 200.370 2.242 20 0 BEADRP CC[NH2+]CC1CC[NH+](Cc2cncc(C)c2)CC1 ZINC000228622023 487695321 /nfs/dbraw/zinc/69/53/21/487695321.db2.gz KRPKIFZNFGXDEV-UHFFFAOYSA-N 2 0 247.386 2.212 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCC[C@H]1C[NH3+])CC(F)(F)F ZINC000396917960 262826878 /nfs/dbraw/zinc/82/68/78/262826878.db2.gz VXZHOEQCXKNEFM-GUBZILKMSA-N 2 0 238.297 2.292 20 0 BEADRP CC(C)CSCC[NH2+][C@H](C)CCC[NH3+] ZINC000397419546 262925585 /nfs/dbraw/zinc/92/55/85/262925585.db2.gz UBFSKYQIFATJFZ-LLVKDONJSA-N 2 0 218.410 2.093 20 0 BEADRP C[C@H](c1ccncc1)[N@@H+]1CCC[C@@H](CC[NH3+])C1 ZINC000226325634 487710936 /nfs/dbraw/zinc/71/09/36/487710936.db2.gz LNVKLPADSXMBRT-OLZOCXBDSA-N 2 0 233.359 2.203 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC2(C)CC[NH+](C)CC2)CS1 ZINC000226343856 487714638 /nfs/dbraw/zinc/71/46/38/487714638.db2.gz HKDZTSSTQHXRKG-NEPJUHHUSA-N 2 0 242.432 2.202 20 0 BEADRP CC[C@H](C)C[N@@H+]1C[C@@H]2CCC[C@]2(C[NH3+])C1 ZINC000308891330 487722810 /nfs/dbraw/zinc/72/28/10/487722810.db2.gz HPHLQISGXQDDMM-AVGNSLFASA-N 2 0 210.365 2.093 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H]1CS[C@@H](C)C1 ZINC000086934272 487727048 /nfs/dbraw/zinc/72/70/48/487727048.db2.gz VCPYSZORGYMAER-NWDGAFQWSA-N 2 0 230.421 2.202 20 0 BEADRP CCO[C@H]1C[C@@H]([NH2+]CC2([NH3+])CCCC2)C1(C)C ZINC000233769681 487742093 /nfs/dbraw/zinc/74/20/93/487742093.db2.gz LOTNNEUPSUEOBI-NEPJUHHUSA-N 2 0 240.391 2.051 20 0 BEADRP CC/C=C\C[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000384814457 487747760 /nfs/dbraw/zinc/74/77/60/487747760.db2.gz CWTLIVADHXJLHD-FJOGCWAESA-N 2 0 210.365 2.273 20 0 BEADRP CC/C=C/C[NH2+][C@H](C)C1CC[NH+](C)CC1 ZINC000384814456 487747775 /nfs/dbraw/zinc/74/77/75/487747775.db2.gz CWTLIVADHXJLHD-BTDICHCPSA-N 2 0 210.365 2.273 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]C[C@@H]2Cc3ccccc32)C1 ZINC000222963788 487748239 /nfs/dbraw/zinc/74/82/39/487748239.db2.gz NDLQVFLMAHWMFA-BFHYXJOUSA-N 2 0 230.355 2.186 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]C[C@@H]2Cc3ccccc32)C1 ZINC000222963855 487748678 /nfs/dbraw/zinc/74/86/78/487748678.db2.gz NDLQVFLMAHWMFA-MJBXVCDLSA-N 2 0 230.355 2.186 20 0 BEADRP CCCC(CCC)[NH2+]C[C@@]1(COC)CCC[NH2+]1 ZINC000414949506 487773522 /nfs/dbraw/zinc/77/35/22/487773522.db2.gz ZTHIWJSNGOHJKI-CQSZACIVSA-N 2 0 242.407 2.313 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@H]2C2CC2)CC[NH2+]1 ZINC000414951291 487773684 /nfs/dbraw/zinc/77/36/84/487773684.db2.gz PNLIRSVKZXACNB-ZZVYKPCYSA-N 2 0 222.376 2.295 20 0 BEADRP CC1(C)CC([NH2+]CCCC[NH3+])CC(C)(C)O1 ZINC001172646424 974895876 /nfs/dbraw/zinc/89/58/76/974895876.db2.gz AHUIBXIACDTMJP-UHFFFAOYSA-N 2 0 228.380 2.051 20 0 BEADRP CC[C@H]1C[N@H+](Cc2ccc(OC)cc2)CC[C@H]1[NH3+] ZINC000251770954 487796509 /nfs/dbraw/zinc/79/65/09/487796509.db2.gz MLFBPYQMOPIRBW-DZGCQCFKSA-N 2 0 248.370 2.254 20 0 BEADRP C[NH+](C)CCC[NH2+][C@H]1CCCC(C)(C)C1 ZINC000070682646 487796857 /nfs/dbraw/zinc/79/68/57/487796857.db2.gz AGJGKTPBXDKEBA-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H](C[NH2+]CCC[NH2+]C1CC1)C(C)(C)C ZINC000163005444 487796946 /nfs/dbraw/zinc/79/69/46/487796946.db2.gz DOYSJWAEMPZKOG-NSHDSACASA-N 2 0 212.381 2.400 20 0 BEADRP CC[C@@H]1C[N@H+](CC2CCCC2)CC[C@H]1[NH3+] ZINC000251784113 487798493 /nfs/dbraw/zinc/79/84/93/487798493.db2.gz NFNSFCFEEKOLCQ-CHWSQXEVSA-N 2 0 210.365 2.236 20 0 BEADRP C([C@@H]1CC[NH2+]C1)[N@@H+]1CCC[C@@H]2CCCC[C@@H]21 ZINC000051889550 487812314 /nfs/dbraw/zinc/81/23/14/487812314.db2.gz VREHMDIWTGXLNE-RDBSUJKOSA-N 2 0 222.376 2.251 20 0 BEADRP CC[C@]1(C)CCC[C@@H]1[NH2+]CCC[NH+](C)C ZINC000651666854 487813047 /nfs/dbraw/zinc/81/30/47/487813047.db2.gz QFRWGWIOGRAXRG-QWHCGFSZSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H]1CCCC[C@H]1[N@H+](C)C[C@H]1CC[NH2+]C1 ZINC000252126013 487816811 /nfs/dbraw/zinc/81/68/11/487816811.db2.gz KBOIENMSRJEDCI-FRRDWIJNSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1CC[N@H+](CC[C@H]2CCC[NH2+]C2)[C@H](C)C1 ZINC000252209816 487821998 /nfs/dbraw/zinc/82/19/98/487821998.db2.gz WAEQMMVZWAVTNX-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCC[C@@H]([C@H]2CCC[NH2+]2)C1 ZINC000252417670 487823869 /nfs/dbraw/zinc/82/38/69/487823869.db2.gz SUSIWNCPSNUWKN-BFHYXJOUSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1ccc(CCC[NH2+][C@H]2CCC[C@H]([NH3+])C2)cn1 ZINC000414932891 487830621 /nfs/dbraw/zinc/83/06/21/487830621.db2.gz WDMANDTWGROWHG-GJZGRUSLSA-N 2 0 247.386 2.182 20 0 BEADRP Cc1ccc(C[NH2+]CCC[C@@H]2CCC[NH2+]2)cn1 ZINC000414960976 487831295 /nfs/dbraw/zinc/83/12/95/487831295.db2.gz BACCTCASJVUZBH-CQSZACIVSA-N 2 0 233.359 2.012 20 0 BEADRP CC[C@H]1c2ccccc2CC[N@H+]1CCC[NH3+] ZINC000666640937 487849993 /nfs/dbraw/zinc/84/99/93/487849993.db2.gz FPVRHKNBYOIMST-AWEZNQCLSA-N 2 0 218.344 2.345 20 0 BEADRP C[C@@H](CC1CCC1)[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000666789039 487859441 /nfs/dbraw/zinc/85/94/41/487859441.db2.gz ATHCOXJKSCZFCE-WCQYABFASA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H](CC1CCC1)[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000666789040 487859491 /nfs/dbraw/zinc/85/94/91/487859491.db2.gz ATHCOXJKSCZFCE-YPMHNXCESA-N 2 0 210.365 2.154 20 0 BEADRP c1cc2cc(CN[C@@H]3CCC[NH2+]C3)ccc2cn1 ZINC000666814499 487867648 /nfs/dbraw/zinc/86/76/48/487867648.db2.gz CWYRXQICSDRAJK-OAHLLOKOSA-N 2 0 241.338 2.076 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]Cc1cccc(F)c1F ZINC000666743843 487869528 /nfs/dbraw/zinc/86/95/28/487869528.db2.gz HAKRREHEDIKUJN-JOYOIKCWSA-N 2 0 240.297 2.182 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+]C[C@H]1CCOc2ccccc21 ZINC000666741417 487869596 /nfs/dbraw/zinc/86/95/96/487869596.db2.gz QSSFMGHPVYOZOY-OCCSQVGLSA-N 2 0 248.370 2.126 20 0 BEADRP COC[C@@]1(C[NH2+]C[C@@H](C)C(C)(C)C)CCC[NH2+]1 ZINC000666891905 487875570 /nfs/dbraw/zinc/87/55/70/487875570.db2.gz BVQCIYBSISVTQR-OCCSQVGLSA-N 2 0 242.407 2.027 20 0 BEADRP Clc1cscc1C[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000666787439 487880169 /nfs/dbraw/zinc/88/01/69/487880169.db2.gz SXNCHOFBKAHNAA-SECBINFHSA-N 2 0 244.791 2.491 20 0 BEADRP Clc1cscc1C[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000666787440 487879945 /nfs/dbraw/zinc/87/99/45/487879945.db2.gz SXNCHOFBKAHNAA-VIFPVBQESA-N 2 0 244.791 2.491 20 0 BEADRP [NH3+]C1(C[NH2+]Cc2cccc3cnccc32)CCC1 ZINC000666828304 487887774 /nfs/dbraw/zinc/88/77/74/487887774.db2.gz GJGUKEVFWMWUNG-UHFFFAOYSA-N 2 0 241.338 2.206 20 0 BEADRP C[C@@H](CC1CCC1)[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000666953741 487891498 /nfs/dbraw/zinc/89/14/98/487891498.db2.gz GORCUQYISKUIKN-WCQYABFASA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H](CCC(F)(F)F)[NH2+][C@H]1CCC[NH2+]CC1 ZINC000666858015 487892230 /nfs/dbraw/zinc/89/22/30/487892230.db2.gz SVUPTBDQLGHCMX-UWVGGRQHSA-N 2 0 238.297 2.449 20 0 BEADRP CC(C)C[C@@H](C)C[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000666858968 487891739 /nfs/dbraw/zinc/89/17/39/487891739.db2.gz PVIMAQWVTCHRCK-CHWSQXEVSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H](CC1CCC1)[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000666857875 487892296 /nfs/dbraw/zinc/89/22/96/487892296.db2.gz NORBYRPPWGOECI-DGCLKSJQSA-N 2 0 210.365 2.297 20 0 BEADRP C[NH+]1CCC(C[NH2+]CC2CCSCC2)CC1 ZINC000229221534 487895097 /nfs/dbraw/zinc/89/50/97/487895097.db2.gz MZKLIFNETXKXEA-UHFFFAOYSA-N 2 0 242.432 2.061 20 0 BEADRP CC[C@H]([NH3+])C[NH2+]CC(C)(C)c1ccccc1 ZINC000666910415 487901528 /nfs/dbraw/zinc/90/15/28/487901528.db2.gz DYIUIGGSHPTOIW-ZDUSSCGKSA-N 2 0 220.360 2.291 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1C[C@@H](C)O[C@@H](C)C1 ZINC000666936656 487907078 /nfs/dbraw/zinc/90/70/78/487907078.db2.gz VYBXUTOBQPQUJF-FVCCEPFGSA-N 2 0 228.380 2.050 20 0 BEADRP Cc1ccsc1C[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000666950859 487913446 /nfs/dbraw/zinc/91/34/46/487913446.db2.gz NNCYTCBJXXLWJE-GFCCVEGCSA-N 2 0 236.384 2.288 20 0 BEADRP C([NH2+][C@@H]1CC12CC[NH2+]CC2)C1CCCCC1 ZINC000666952395 487914075 /nfs/dbraw/zinc/91/40/75/487914075.db2.gz VBSOVIMXCOABJT-CYBMUJFWSA-N 2 0 222.376 2.298 20 0 BEADRP C([NH2+][C@H]1CC12CC[NH2+]CC2)C1CCCCC1 ZINC000666952396 487914135 /nfs/dbraw/zinc/91/41/35/487914135.db2.gz VBSOVIMXCOABJT-ZDUSSCGKSA-N 2 0 222.376 2.298 20 0 BEADRP Fc1ccccc1C[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000666952542 487913865 /nfs/dbraw/zinc/91/38/65/487913865.db2.gz ZYQQUXPJVUYBMX-CYBMUJFWSA-N 2 0 234.318 2.057 20 0 BEADRP CC(C)(C)CC[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000666953615 487915184 /nfs/dbraw/zinc/91/51/84/487915184.db2.gz CAGROUDXGBCGGE-LLVKDONJSA-N 2 0 210.365 2.154 20 0 BEADRP CCCC[C@@H](C)[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000666954509 487915872 /nfs/dbraw/zinc/91/58/72/487915872.db2.gz WRMNNDLINMNFNQ-VXGBXAGGSA-N 2 0 210.365 2.297 20 0 BEADRP CC1CCC([NH2+][C@@H]2CC23CC[NH2+]CC3)CC1 ZINC000666953913 487916083 /nfs/dbraw/zinc/91/60/83/487916083.db2.gz KVXBVGITJFUGLN-WXRRBKDZSA-N 2 0 222.376 2.297 20 0 BEADRP CC1(C)CCC[C@H]1[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000666954099 487916166 /nfs/dbraw/zinc/91/61/66/487916166.db2.gz PTLPIVWKFWKMTI-VXGBXAGGSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@H]2CC23CC[NH2+]CC3)C1 ZINC000666954072 487916193 /nfs/dbraw/zinc/91/61/93/487916193.db2.gz PCQXMQXUNNQPLT-AGIUHOORSA-N 2 0 222.376 2.297 20 0 BEADRP CC1(C)CC[C@H]([NH2+][C@@H]2CC23CC[NH2+]CC3)C1 ZINC000666953690 487916222 /nfs/dbraw/zinc/91/62/22/487916222.db2.gz FBSVDOOHTBBQGY-NWDGAFQWSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC12CC[NH2+]CC2)C(C)(C)C ZINC000666955493 487917214 /nfs/dbraw/zinc/91/72/14/487917214.db2.gz RLNXLVHHFXDDBJ-NEPJUHHUSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H](C[NH+]1C[C@H]2C[NH2+]C[C@@H]2C1)c1ccc(F)cc1 ZINC000682156080 487917391 /nfs/dbraw/zinc/91/73/91/487917391.db2.gz HXOHQEZCLLSPRD-MRVWCRGKSA-N 2 0 248.345 2.080 20 0 BEADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+]Cc2cccc(F)c2F)C1 ZINC000666962229 487919749 /nfs/dbraw/zinc/91/97/49/487919749.db2.gz UDDCNUICJHPROH-MWLCHTKSSA-N 2 0 240.297 2.182 20 0 BEADRP C[C@H](CC1CCC1)[NH2+][C@@H]1CC[C@H](C[NH3+])C1 ZINC000666963977 487919837 /nfs/dbraw/zinc/91/98/37/487919837.db2.gz UNEIISCTHULNNJ-KGYLQXTDSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H](CC1CCC1)[NH2+][C@H]1CCCC[NH2+]C1 ZINC000666993017 487923456 /nfs/dbraw/zinc/92/34/56/487923456.db2.gz WSLBDZGRPHPNFX-YPMHNXCESA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@@H](C)C[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000666995623 487925167 /nfs/dbraw/zinc/92/51/67/487925167.db2.gz UJYWVKGVSCKPLI-VXGBXAGGSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1C[N@H+](CCC(C)(C)C2CC2)CC[C@@H]1[NH3+] ZINC000382254338 487935223 /nfs/dbraw/zinc/93/52/23/487935223.db2.gz VVZDTUNYIIWSMK-YPMHNXCESA-N 2 0 224.392 2.482 20 0 BEADRP C[C@H]([NH2+][C@H]1CS[C@H](C)C1)C1CC[NH+](C)CC1 ZINC000396470949 487935343 /nfs/dbraw/zinc/93/53/43/487935343.db2.gz XEBIOURAYRUCOU-NTZNESFSSA-N 2 0 242.432 2.200 20 0 BEADRP CCc1cc(N[C@H]2CC[N@@H+](C3CC3)C2)cc[nH+]1 ZINC000307767734 487945054 /nfs/dbraw/zinc/94/50/54/487945054.db2.gz IIHYXTUWSNEOOR-ZDUSSCGKSA-N 2 0 231.343 2.293 20 0 BEADRP CC(C)(C[NH2+][C@@H]1CCC[C@H]1[NH3+])C1CCC1 ZINC000258988136 322880601 /nfs/dbraw/zinc/88/06/01/322880601.db2.gz MKXPORWBYZOVCE-VXGBXAGGSA-N 2 0 210.365 2.282 20 0 BEADRP COCC[N@H+](C)CCC[NH2+]C1CCC(C)CC1 ZINC000561359705 323000286 /nfs/dbraw/zinc/00/02/86/323000286.db2.gz CVIFGPXTZQDCPO-UHFFFAOYSA-N 2 0 242.407 2.123 20 0 BEADRP [NH3+]Cc1ccc(C[NH2+][C@@H]2CC[C@H]2C2CC2)cc1 ZINC000564729929 323011805 /nfs/dbraw/zinc/01/18/05/323011805.db2.gz VYUMOEKDWROAKQ-LSDHHAIUSA-N 2 0 230.355 2.424 20 0 BEADRP [NH3+]Cc1ccc(C[NH2+][C@@H]2CC[C@@H]2C2CC2)cc1 ZINC000564729928 323011876 /nfs/dbraw/zinc/01/18/76/323011876.db2.gz VYUMOEKDWROAKQ-HUUCEWRRSA-N 2 0 230.355 2.424 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+][C@H]1CC[C@H](C[NH3+])C1 ZINC000562962657 323036628 /nfs/dbraw/zinc/03/66/28/323036628.db2.gz JPOXTEFIKYKRNV-AGIUHOORSA-N 2 0 236.359 2.318 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000562962796 323036692 /nfs/dbraw/zinc/03/66/92/323036692.db2.gz HBOOBOLVEACKFH-UPJWGTAASA-N 2 0 210.365 2.297 20 0 BEADRP CC(C)(C[NH2+][C@@H]1CCC[C@@H]([NH3+])C1)c1ccccn1 ZINC000569825189 323041548 /nfs/dbraw/zinc/04/15/48/323041548.db2.gz NLCVJIVHOLUJLH-CHWSQXEVSA-N 2 0 247.386 2.219 20 0 BEADRP CC(C)(C[NH2+][C@@H]1CCC[C@H]([NH3+])C1)c1ccccn1 ZINC000569825195 323041638 /nfs/dbraw/zinc/04/16/38/323041638.db2.gz NLCVJIVHOLUJLH-QWHCGFSZSA-N 2 0 247.386 2.219 20 0 BEADRP CC(C)(C[NH2+][C@H]1CCC[C@H]([NH3+])C1)c1ccccn1 ZINC000569825197 323041641 /nfs/dbraw/zinc/04/16/41/323041641.db2.gz NLCVJIVHOLUJLH-STQMWFEESA-N 2 0 247.386 2.219 20 0 BEADRP CC[N@H+](CC[C@@H]1CCCC[NH+]1C)C[C@@H](C)OC ZINC000569897532 323043670 /nfs/dbraw/zinc/04/36/70/323043670.db2.gz PASRFZRZWZUBOW-KGLIPLIRSA-N 2 0 242.407 2.218 20 0 BEADRP CO[C@H](C[NH2+][C@@H]1CCC[C@@H]([NH3+])C1)c1ccccc1 ZINC000570815676 323071509 /nfs/dbraw/zinc/07/15/09/323071509.db2.gz CZRAQCQUOVNNMP-RBSFLKMASA-N 2 0 248.370 2.234 20 0 BEADRP [NH3+]CCC1CC[NH+](CCCCCF)CC1 ZINC000308944288 323081685 /nfs/dbraw/zinc/08/16/85/323081685.db2.gz UBZSWZZOTZMILC-UHFFFAOYSA-N 2 0 216.344 2.187 20 0 BEADRP CC(C)[C@H](C)[NH2+]C[C@H](N)c1ccccc1 ZINC000319631696 323085595 /nfs/dbraw/zinc/08/55/95/323085595.db2.gz ZOWRILNDYPAEQC-AAEUAGOBSA-N 2 0 206.333 2.321 20 0 BEADRP C[C@@H]1CCCC[C@H]1C[N@@H+]1CC[C@@H]2C[NH2+]C[C@@H]21 ZINC000394824369 323085691 /nfs/dbraw/zinc/08/56/91/323085691.db2.gz JEDMBDYJGQQACR-MQYQWHSLSA-N 2 0 222.376 2.106 20 0 BEADRP C[C@H]1CCCC[C@@H]1C[N@@H+]1CC[C@@H]2C[NH2+]C[C@@H]21 ZINC000394824367 323085700 /nfs/dbraw/zinc/08/57/00/323085700.db2.gz JEDMBDYJGQQACR-DGAVXFQQSA-N 2 0 222.376 2.106 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]Cc1cnc(C2CC2)s1 ZINC000563135910 323094953 /nfs/dbraw/zinc/09/49/53/323094953.db2.gz VYQHOZXYYOHHPS-RKDXNWHRSA-N 2 0 239.388 2.236 20 0 BEADRP CC(C)[C@@H]([NH2+]CC[C@H]1CCC[NH2+]C1)C1CC1 ZINC000571037688 323104425 /nfs/dbraw/zinc/10/44/25/323104425.db2.gz GQDCTTPLKDSUPP-TZMCWYRMSA-N 2 0 224.392 2.400 20 0 BEADRP CC[NH2+]Cc1cccc(N[C@H]2CCC[C@H]([NH3+])C2)c1 ZINC000563423563 323124251 /nfs/dbraw/zinc/12/42/51/323124251.db2.gz GVRHHOFPMCQHAM-ZFWWWQNUSA-N 2 0 247.386 2.478 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H](C)CC(C)(C)C ZINC000571312829 323141075 /nfs/dbraw/zinc/14/10/75/323141075.db2.gz HDXWOXYULJLIFY-LLVKDONJSA-N 2 0 200.370 2.400 20 0 BEADRP C([NH2+][C@@H]1CC[C@H]1C1CCC1)C1CC[NH2+]CC1 ZINC000571514118 323146436 /nfs/dbraw/zinc/14/64/36/323146436.db2.gz FSLPUNSEQAAJFK-UONOGXRCSA-N 2 0 222.376 2.154 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@H](C)COC(C)C)CC1 ZINC000571532042 323147178 /nfs/dbraw/zinc/14/71/78/323147178.db2.gz OLCOASBGPQPCML-CYBMUJFWSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H](CCc1ccccc1)C[NH2+]C[C@H]1CC[NH2+]C1 ZINC000414919152 323152019 /nfs/dbraw/zinc/15/20/19/323152019.db2.gz WHGNBPZRXXMOMX-ZBFHGGJFSA-N 2 0 246.398 2.454 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+]C/C=C\c1ccccc1 ZINC000414956075 323152230 /nfs/dbraw/zinc/15/22/30/323152230.db2.gz MZHDQHASTMSHAA-DBVFPWQWSA-N 2 0 230.355 2.287 20 0 BEADRP CCC[C@H](CC)[NH2+]CC1(COC)CC[NH2+]CC1 ZINC000414971342 323152357 /nfs/dbraw/zinc/15/23/57/323152357.db2.gz ITRDCDZKUGUBLJ-ZDUSSCGKSA-N 2 0 242.407 2.171 20 0 BEADRP C[C@@H]1C[N@@H+](CC[C@H]2CCC[NH+]2C)C[C@H](C)S1 ZINC000535469758 323173316 /nfs/dbraw/zinc/17/33/16/323173316.db2.gz VNOFLIJHDVSIMK-FRRDWIJNSA-N 2 0 242.432 2.297 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]CCOC(C)(C)C ZINC000308722982 323177317 /nfs/dbraw/zinc/17/73/17/323177317.db2.gz FBDIXWRTDBIDFR-UPJWGTAASA-N 2 0 242.407 2.120 20 0 BEADRP C[N@H+](CCCOCc1ccccc1)C1CC([NH3+])C1 ZINC000395117082 323187581 /nfs/dbraw/zinc/18/75/81/323187581.db2.gz VVDLTXCLQZCEJV-UHFFFAOYSA-N 2 0 248.370 2.015 20 0 BEADRP CC(C)(CO)CC[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000395120824 323188023 /nfs/dbraw/zinc/18/80/23/323188023.db2.gz GOKMNWXNKYQMNR-UONOGXRCSA-N 2 0 248.370 2.129 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000530216557 323217217 /nfs/dbraw/zinc/21/72/17/323217217.db2.gz QKUSLLYMSDNORK-QWRGUYRKSA-N 2 0 208.349 2.049 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000530216558 323217349 /nfs/dbraw/zinc/21/73/49/323217349.db2.gz QKUSLLYMSDNORK-WDEREUQCSA-N 2 0 208.349 2.049 20 0 BEADRP CC(C)[C@@H]([NH2+][C@H]1CC[NH2+]C12CCC2)C1CC1 ZINC000530225903 323219108 /nfs/dbraw/zinc/21/91/08/323219108.db2.gz XZJLQYZVELGMEI-QWHCGFSZSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@@H](C1CC1)C1CCC1 ZINC000324701765 323263711 /nfs/dbraw/zinc/26/37/11/323263711.db2.gz YLQIRYMELFLMQJ-GXFFZTMASA-N 2 0 210.365 2.282 20 0 BEADRP COCC[C@@H]1CCC[C@H]1[NH2+]CCC[NH2+]C(C)C ZINC000563951262 323330100 /nfs/dbraw/zinc/33/01/00/323330100.db2.gz UKRWGQOIHXGRAY-UONOGXRCSA-N 2 0 242.407 2.169 20 0 BEADRP CC(C)[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)C1CC1 ZINC000152472979 323336091 /nfs/dbraw/zinc/33/60/91/323336091.db2.gz CBAQYHSGINJPBW-WFASDCNBSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@H]1CCC[C@@H]1[NH2+]CCC1CC[NH+](C)CC1 ZINC000122078979 324026400 /nfs/dbraw/zinc/02/64/00/324026400.db2.gz WVFNHRHETGZGOS-JSGCOSHPSA-N 2 0 224.392 2.497 20 0 BEADRP COCC1([NH2+][C@H](C)C[C@@H]2CCCCC[NH2+]2)CC1 ZINC000517730964 324176543 /nfs/dbraw/zinc/17/65/43/324176543.db2.gz ROFIFPVGFFKMLB-OLZOCXBDSA-N 2 0 240.391 2.066 20 0 BEADRP FCCC[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCCC[NH2+]1 ZINC000304297947 324199697 /nfs/dbraw/zinc/19/96/97/324199697.db2.gz ZXUDQOOKNJUUQR-RWMBFGLXSA-N 2 0 228.355 2.246 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)C2CC(F)(F)C2)C1 ZINC000529530149 324325479 /nfs/dbraw/zinc/32/54/79/324325479.db2.gz GHIMTBUHIQLVQC-MNOVXSKESA-N 2 0 246.345 2.352 20 0 BEADRP [NH3+]CC/C=C\c1ccc(C2=CC[NH2+]CC2)cc1 ZINC000530248631 324558471 /nfs/dbraw/zinc/55/84/71/324558471.db2.gz QGUOOPMOVASHJC-IWQZZHSRSA-N 2 0 228.339 2.425 20 0 BEADRP C[N@H+](CCC[NH+]1CCCC1)CC1(C)CC1 ZINC000545992573 325254713 /nfs/dbraw/zinc/25/47/13/325254713.db2.gz KDLVCBLEOVMAEL-UHFFFAOYSA-N 2 0 210.365 2.204 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+]CC1CC[NH+](C)CC1 ZINC000133336044 325287192 /nfs/dbraw/zinc/28/71/92/325287192.db2.gz AFWWZPJAKLOULK-KGLIPLIRSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@H]1CCC[C@@H]1[NH2+]CC1CC[NH+](C)CC1 ZINC000133336248 325287272 /nfs/dbraw/zinc/28/72/72/325287272.db2.gz AFWWZPJAKLOULK-KBPBESRZSA-N 2 0 224.392 2.497 20 0 BEADRP CCSCC[N@@H+]1CC[C@H](C[NH+](CC)CC)C1 ZINC000076002914 325325530 /nfs/dbraw/zinc/32/55/30/325325530.db2.gz UZJHEXOIRIRWQG-CYBMUJFWSA-N 2 0 244.448 2.403 20 0 BEADRP C[C@@H]1C[C@H](C)[N@H+]1CC[C@@H]1CCCC[NH+]1C ZINC000547769861 325392039 /nfs/dbraw/zinc/39/20/39/325392039.db2.gz UQGAMNQTQFQKPM-XQQFMLRXSA-N 2 0 210.365 2.344 20 0 BEADRP C[NH+](C)Cc1ccc(C[NH2+]Cc2cc[nH]c2)cc1 ZINC000086249668 325612465 /nfs/dbraw/zinc/61/24/65/325612465.db2.gz VTYBZUUEPUWEAA-UHFFFAOYSA-N 2 0 243.354 2.366 20 0 BEADRP C[NH2+]CCC[NH2+]C[C@H]1CCCC(C)(C)C1 ZINC000565762638 325953013 /nfs/dbraw/zinc/95/30/13/325953013.db2.gz BHSHHYHBOCGAMK-LBPRGKRZSA-N 2 0 212.381 2.402 20 0 BEADRP C[C@@H]1CC(C)(C)C[C@H]1[NH2+]C1CC([NH+](C)C)C1 ZINC000566805607 326084866 /nfs/dbraw/zinc/08/48/66/326084866.db2.gz JAAYFIDMJCOXHL-IKWCTNDRSA-N 2 0 224.392 2.493 20 0 BEADRP Cc1cccnc1CCC[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000566985646 326100315 /nfs/dbraw/zinc/10/03/15/326100315.db2.gz RZQQOUHDJQAYKQ-UONOGXRCSA-N 2 0 247.386 2.182 20 0 BEADRP Cc1ccc(CCN[C@@H](C)[C@H]2CCCC[NH2+]2)o1 ZINC000567260372 326152242 /nfs/dbraw/zinc/15/22/42/326152242.db2.gz PZTNGAJHAZMDBF-GXTWGEPZSA-N 2 0 236.359 2.251 20 0 BEADRP CSC1(C[NH2+]CC2(C)CC2)CC[NH+](C)CC1 ZINC000309880468 326173695 /nfs/dbraw/zinc/17/36/95/326173695.db2.gz VCYKYRJQIATVQV-UHFFFAOYSA-N 2 0 242.432 2.204 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H](C1CC1)C1CCC1 ZINC000567462609 326197721 /nfs/dbraw/zinc/19/77/21/326197721.db2.gz WQWKOLOJQFSMHA-CYBMUJFWSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H]([NH3+])c1ccc(OCC[C@H]2CC[NH2+]C2)cc1 ZINC000567673875 326243020 /nfs/dbraw/zinc/24/30/20/326243020.db2.gz PQBGWDXKPGWTAQ-NWDGAFQWSA-N 2 0 234.343 2.085 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]CCOCC2CCCC2)C1 ZINC000313267546 326261141 /nfs/dbraw/zinc/26/11/41/326261141.db2.gz UILWAJQMDCEMIC-KBPBESRZSA-N 2 0 240.391 2.053 20 0 BEADRP COC[C@H](C)[NH2+]CCCC[N@@H+]1CCCC[C@H]1C ZINC000157897439 326299172 /nfs/dbraw/zinc/29/91/72/326299172.db2.gz TXPQUMGADNBVOA-UONOGXRCSA-N 2 0 242.407 2.266 20 0 BEADRP Cc1ccc(CC[NH2+][C@H]2CCC[C@@H]([NH3+])C2)cc1 ZINC000568248480 326334229 /nfs/dbraw/zinc/33/42/29/326334229.db2.gz SGWHHHOAJIYABY-CABCVRRESA-N 2 0 232.371 2.397 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)cc1 ZINC000568248482 326334354 /nfs/dbraw/zinc/33/43/54/326334354.db2.gz SGWHHHOAJIYABY-HUUCEWRRSA-N 2 0 232.371 2.397 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H]1CCC[C@H]1CCCF ZINC000569211339 326395188 /nfs/dbraw/zinc/39/51/88/326395188.db2.gz FDZVDUUDFMIDON-STQMWFEESA-N 2 0 230.371 2.494 20 0 BEADRP C[C@@H](O)[C@@H](C)[NH2+]CCCCC[NH+]1CCCCC1 ZINC000572752017 326408760 /nfs/dbraw/zinc/40/87/60/326408760.db2.gz YQTIIXBXASPRER-ZIAGYGMSSA-N 2 0 242.407 2.002 20 0 BEADRP C[NH+]1CCC(CC[NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)CC1 ZINC000302715746 487977736 /nfs/dbraw/zinc/97/77/36/487977736.db2.gz ZGSLAQCFDIVPMJ-QLFBSQMISA-N 2 0 236.403 2.497 20 0 BEADRP C1=C(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)CCC1 ZINC000401027253 488000143 /nfs/dbraw/zinc/00/01/43/488000143.db2.gz KOZRYILJPMTYTG-KGLIPLIRSA-N 2 0 220.360 2.313 20 0 BEADRP Cc1ccc(C[N@H+](C)C[C@@H]2CC[NH2+]C2)s1 ZINC000309636516 488004476 /nfs/dbraw/zinc/00/44/76/488004476.db2.gz MSMVTDNRZZZNEO-LLVKDONJSA-N 2 0 224.373 2.098 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CC2(C[C@H]1C)CC[NH2+]CC2 ZINC000424377034 533716464 /nfs/dbraw/zinc/71/64/64/533716464.db2.gz LPAQFAIXCILICM-JHJVBQTASA-N 2 0 222.376 2.106 20 0 BEADRP CC[C@H](C)[N@H+](C)Cc1ccnn1-c1cc[nH+]cc1 ZINC000667505280 488033295 /nfs/dbraw/zinc/03/32/95/488033295.db2.gz KHQJBBUQWGIJEL-LBPRGKRZSA-N 2 0 244.342 2.498 20 0 BEADRP C[C@H]([N@H+](C)CC[C@@H]1CC[NH2+]C1)C(C)(C)C ZINC000084385448 488049957 /nfs/dbraw/zinc/04/99/57/488049957.db2.gz GTOFTBSJCQXCOL-RYUDHWBXSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H]([N@H+](C)CC[C@@H]1CC[NH2+]C1)C(C)(C)C ZINC000084385450 488049650 /nfs/dbraw/zinc/04/96/50/488049650.db2.gz GTOFTBSJCQXCOL-NEPJUHHUSA-N 2 0 212.381 2.352 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+]C2CCCC2)CC1(C)C ZINC000084477026 488053864 /nfs/dbraw/zinc/05/38/64/488053864.db2.gz VVCSDTXYKGFAGZ-GFCCVEGCSA-N 2 0 210.365 2.391 20 0 BEADRP Cc1ncc(C[N@@H+]2CC[C@@H](c3ccco3)C2)n1C ZINC000667618667 488060384 /nfs/dbraw/zinc/06/03/84/488060384.db2.gz DZSCSEKVZJPCCV-GFCCVEGCSA-N 2 0 245.326 2.311 20 0 BEADRP C[C@@H](C[NH2+][C@@H]1CCC[C@@H]2C[C@@H]21)C[NH+]1CCCC1 ZINC000378957364 488114108 /nfs/dbraw/zinc/11/41/08/488114108.db2.gz NFIWDWRFZSIXOJ-LJISPDSOSA-N 2 0 236.403 2.497 20 0 BEADRP C[NH2+]C1CC[NH+](C[C@@H]2CC[C@H]3C[C@H]3C2)CC1 ZINC000403335002 488121260 /nfs/dbraw/zinc/12/12/60/488121260.db2.gz BBFUUWIFKZNHTD-FRRDWIJNSA-N 2 0 222.376 2.106 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CC[N@H+](C[C@@H]2CC[C@H]3C[C@H]3C2)C1 ZINC000403506643 488124755 /nfs/dbraw/zinc/12/47/55/488124755.db2.gz BAQZPTLXGCIHPS-MEBFFEOJSA-N 2 0 222.376 2.092 20 0 BEADRP [NH3+]CC1CC[NH+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC000403583094 488128229 /nfs/dbraw/zinc/12/82/29/488128229.db2.gz CJGARWDPSYCCPG-MCIONIFRSA-N 2 0 222.376 2.093 20 0 BEADRP c1cc(C[NH+]2C[C@H]3C[NH2+]C[C@@H]3C2)cc(C2CC2)c1 ZINC000094522262 487538490 /nfs/dbraw/zinc/53/84/90/487538490.db2.gz JVXFIFBWPSWNAN-HZPDHXFCSA-N 2 0 242.366 2.215 20 0 BEADRP [NH3+]C[C@H]1CC[N@H+](Cc2ccccc2C2CC2)C1 ZINC000094528203 487539110 /nfs/dbraw/zinc/53/91/10/487539110.db2.gz BGSXLELWNBWRQN-GFCCVEGCSA-N 2 0 230.355 2.345 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[C@H]1c1ccco1)C1CC[NH+](C)CC1 ZINC000666266949 487547905 /nfs/dbraw/zinc/54/79/05/487547905.db2.gz KKLMTQHILXENED-MRVWCRGKSA-N 2 0 248.370 2.455 20 0 BEADRP CCN(CC[NH3+])Cc1ccc(C)c(Cl)c1 ZINC000231819641 487477457 /nfs/dbraw/zinc/47/74/57/487477457.db2.gz IDUZHJRKTYUFFW-UHFFFAOYSA-N 2 0 226.751 2.429 20 0 BEADRP CC1([NH3+])CC[NH+](CCOCc2ccccc2)CC1 ZINC000662271579 487517376 /nfs/dbraw/zinc/51/73/76/487517376.db2.gz XJVRNNMFMAKQKU-UHFFFAOYSA-N 2 0 248.370 2.016 20 0 BEADRP C[N@H+](CC1CC=CC1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000662266372 490042908 /nfs/dbraw/zinc/04/29/08/490042908.db2.gz WZCHZYKRGFBQOP-PBWFPOADSA-N 2 0 220.360 2.167 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@@H]2[C@@H]3CCC[C@@H]32)CC1 ZINC000668668928 488086916 /nfs/dbraw/zinc/08/69/16/488086916.db2.gz HEKHJCLWWDRFGX-BTTYYORXSA-N 2 0 222.376 2.247 20 0 BEADRP C([C@H]1CC[C@@H]2C[C@@H]2C1)[N@H+]1CC[C@H]2C[NH2+]C[C@H]2CC1 ZINC000403752736 488135951 /nfs/dbraw/zinc/13/59/51/488135951.db2.gz PHIPXINHUVOMDZ-NPJQDHAYSA-N 2 0 248.414 2.354 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]CC(C)(C)c1ccccc1 ZINC000258814107 488137421 /nfs/dbraw/zinc/13/74/21/488137421.db2.gz SSCVDOICFXUIQN-GFCCVEGCSA-N 2 0 220.360 2.149 20 0 BEADRP Cc1noc(C)c1[C@H](C)[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000093216531 488139986 /nfs/dbraw/zinc/13/99/86/488139986.db2.gz RXWFKMJEXYHAFC-KPXOXKRLSA-N 2 0 237.347 2.212 20 0 BEADRP Cc1ccc(CC[NH2+]C2CC[NH2+]CC2)cc1C ZINC000259269514 488158551 /nfs/dbraw/zinc/15/85/51/488158551.db2.gz ZQQJPSQFJBWTNH-UHFFFAOYSA-N 2 0 232.371 2.188 20 0 BEADRP C[NH2+]CC1CC[NH+](CCC2CCC2)CC1 ZINC000398629691 488220733 /nfs/dbraw/zinc/22/07/33/488220733.db2.gz JOMAOPNLKBJYKO-UHFFFAOYSA-N 2 0 210.365 2.108 20 0 BEADRP CCc1ccc(C[NH2+]C[C@@H]2CCC[NH2+]C2)s1 ZINC000225139796 488229892 /nfs/dbraw/zinc/22/98/92/488229892.db2.gz JCTGIVNJZLEIJX-LLVKDONJSA-N 2 0 238.400 2.400 20 0 BEADRP C/C(=C\c1ccccc1)C[NH+]1C[C@@H]2C[NH2+]C[C@H]2C1 ZINC000678343287 488243321 /nfs/dbraw/zinc/24/33/21/488243321.db2.gz PBPJUZAWZYWQDZ-HJEFBLDRSA-N 2 0 242.366 2.241 20 0 BEADRP [NH3+]C1(C[NH2+]C(C2CC2)C2CC2)CCCC1 ZINC000049237980 488277005 /nfs/dbraw/zinc/27/70/05/488277005.db2.gz NAELIRKMTSCAJO-UHFFFAOYSA-N 2 0 208.349 2.036 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@H]2CCC(F)(F)C2)[C@H](C)C1 ZINC000679073691 488304453 /nfs/dbraw/zinc/30/44/53/488304453.db2.gz NFROUMNEVSRKOK-WOPDTQHZSA-N 2 0 246.345 2.494 20 0 BEADRP CC[NH+](CC)CCC[N@H+](C)CC(O)(CC)CC ZINC000679134496 488311768 /nfs/dbraw/zinc/31/17/68/488311768.db2.gz ZJORPIZYYRCYDN-UHFFFAOYSA-N 2 0 244.423 2.201 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]Cc1ccccc1C1CC1 ZINC000666825921 490097218 /nfs/dbraw/zinc/09/72/18/490097218.db2.gz ABSOAWAKAJSQIH-LLVKDONJSA-N 2 0 218.344 2.248 20 0 BEADRP C[NH2+]C[C@H]1CCN(C/C=C\c2ccccc2)C1 ZINC000214449407 490113382 /nfs/dbraw/zinc/11/33/82/490113382.db2.gz PNVHGPMKHOVKRV-GTBONMDNSA-N 2 0 230.355 2.241 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H]1CCC[C@@H](OC)C1 ZINC000070325875 490206627 /nfs/dbraw/zinc/20/66/27/490206627.db2.gz JNHZTKZBHGWEIA-UONOGXRCSA-N 2 0 242.407 2.266 20 0 BEADRP Cc1cc(C)cc(C[N@@H+](C)CC2CN(C)C2)c1 ZINC000668539819 490357795 /nfs/dbraw/zinc/35/77/95/490357795.db2.gz NHNVNJWTQRJAAU-UHFFFAOYSA-N 2 0 232.371 2.297 20 0 BEADRP C[C@@]1(C[NH3+])CC[N@H+](C[C@H]2CCC(F)(F)C2)C1 ZINC000300802355 490568964 /nfs/dbraw/zinc/56/89/64/490568964.db2.gz DCTPNDQNNGXZQK-QWRGUYRKSA-N 2 0 232.318 2.093 20 0 BEADRP CC1(C)CC[C@H]([NH2+][C@@H]2CCC[C@H]([NH3+])C2)C1 ZINC000128572937 490581856 /nfs/dbraw/zinc/58/18/56/490581856.db2.gz WREZXLNJRZAORT-TUAOUCFPSA-N 2 0 210.365 2.425 20 0 BEADRP C([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)C1CCCC1 ZINC000400942765 491069131 /nfs/dbraw/zinc/06/91/31/491069131.db2.gz BUGRDFCOCMYNSD-MGPQQGTHSA-N 2 0 222.376 2.154 20 0 BEADRP CCC[N@@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000662293304 491087494 /nfs/dbraw/zinc/08/74/94/491087494.db2.gz GIPJTHSLXNLLKU-ZDUSSCGKSA-N 2 0 210.365 2.108 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H](C)C[NH3+])c1cccs1 ZINC000336696524 491106417 /nfs/dbraw/zinc/10/64/17/491106417.db2.gz UCBJPOOVPVOYBP-VHSXEESVSA-N 2 0 212.362 2.384 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2Cc3ccccc32)CC[N@@H+]1C ZINC000121596803 491106557 /nfs/dbraw/zinc/10/65/57/491106557.db2.gz UJPRUQVFDISSBM-SNPRPXQTSA-N 2 0 244.382 2.399 20 0 BEADRP C[C@@H](C[N@@H+]1C[C@@H]2CCC[NH2+][C@@H]2C1)C(C)(C)C ZINC000304311235 491109989 /nfs/dbraw/zinc/10/99/89/491109989.db2.gz QMSCXPASFUPQKU-RWMBFGLXSA-N 2 0 224.392 2.352 20 0 BEADRP Cc1c[nH+]ccc1N[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000070047291 491117550 /nfs/dbraw/zinc/11/75/50/491117550.db2.gz VNDVFXAAEZWMMH-LLVKDONJSA-N 2 0 217.316 2.039 20 0 BEADRP C[C@H]([NH2+]CC1(C)CCC1)C1CC[NH+](C)CC1 ZINC000090220117 491123904 /nfs/dbraw/zinc/12/39/04/491123904.db2.gz BELZUOYOSOJHCG-LBPRGKRZSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@@H]1CCCc2cccnc21 ZINC000091661468 491131414 /nfs/dbraw/zinc/13/14/14/491131414.db2.gz SGDXWGQYUWCJMA-CQSZACIVSA-N 2 0 247.386 2.390 20 0 BEADRP COc1ccc(C[NH2+][C@@H]2CCC[C@@H]2C[NH3+])c(C)c1 ZINC000562960245 491133358 /nfs/dbraw/zinc/13/33/58/491133358.db2.gz LYJGHGILMKNJHJ-IUODEOHRSA-N 2 0 248.370 2.221 20 0 BEADRP C[N@H+]1CC=C(C[NH2+]CC2(C)CCC2)CC1 ZINC000308965922 491141520 /nfs/dbraw/zinc/14/15/20/491141520.db2.gz VPGSPUOJXNXXMN-UHFFFAOYSA-N 2 0 208.349 2.028 20 0 BEADRP CSC[C@H]1CCC[N@@H+]1C[C@H]([NH3+])CC(C)C ZINC000400010307 533816142 /nfs/dbraw/zinc/81/61/42/533816142.db2.gz VLFZEFHMCMCZIZ-VXGBXAGGSA-N 2 0 230.421 2.187 20 0 BEADRP CC[C@@H](C)C[N@H+](CC)[C@H]1CCC[NH2+]CC1 ZINC000251798059 535512447 /nfs/dbraw/zinc/51/24/47/535512447.db2.gz KHIXURKDGLDEJI-OLZOCXBDSA-N 2 0 212.381 2.497 20 0 BEADRP Cc1cc(N)cc(C[NH2+]C2CCC(C[NH3+])CC2)c1 ZINC000414958398 533887424 /nfs/dbraw/zinc/88/74/24/533887424.db2.gz CWFJUVVOYNOZKX-UHFFFAOYSA-N 2 0 247.386 2.184 20 0 BEADRP C[C@H]([NH2+]C[C@@]1(C)CCCS1)[C@@H]1CCC[NH2+]1 ZINC000400579506 533892827 /nfs/dbraw/zinc/89/28/27/533892827.db2.gz QGUVFBCZRQGKST-SDDRHHMPSA-N 2 0 228.405 2.002 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CC2CCCC2)[C@H](C)C1 ZINC000166861135 535768372 /nfs/dbraw/zinc/76/83/72/535768372.db2.gz BZYHWXRVAGGKKO-OCCSQVGLSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)C1 ZINC000400960206 534257694 /nfs/dbraw/zinc/25/76/94/534257694.db2.gz IKEQGJMBRZOPER-XGFWRYKXSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H]1C[C@H](C)[N@H+](CC2CC[NH+](C)CC2)C1 ZINC000892105238 582792528 /nfs/dbraw/zinc/79/25/28/582792528.db2.gz XSWFJTQSIBHGRP-RYUDHWBXSA-N 2 0 210.365 2.059 20 0 BEADRP C[C@@H]1C[N@H+](CCC(C)(C)C)C[C@@]1(C)C[NH3+] ZINC000309061066 534460461 /nfs/dbraw/zinc/46/04/61/534460461.db2.gz VWVLUDIHKVIXLQ-DGCLKSJQSA-N 2 0 212.381 2.339 20 0 BEADRP C[N@@H+]1CCC[C@H]1CC[NH+]1CC[C@H](C2CC2)C1 ZINC000348072805 536389977 /nfs/dbraw/zinc/38/99/77/536389977.db2.gz KVDDBXDTMMDJRG-KBPBESRZSA-N 2 0 222.376 2.203 20 0 BEADRP CC(C)C(C)(C)C[NH2+][C@@H](C)[C@@H]1CCC[NH2+]1 ZINC000400514677 527571158 /nfs/dbraw/zinc/57/11/58/527571158.db2.gz MNUDXAKILLWVHD-RYUDHWBXSA-N 2 0 212.381 2.399 20 0 BEADRP CC[NH+](CC)C[C@@H]1CC[N@H+](C[C@@H]2C[C@H]2C)C1 ZINC000488351660 528175692 /nfs/dbraw/zinc/17/56/92/528175692.db2.gz FSKVYUXDQYLKJT-RDBSUJKOSA-N 2 0 224.392 2.306 20 0 BEADRP CCC[N@@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000261699300 534963759 /nfs/dbraw/zinc/96/37/59/534963759.db2.gz JPJCFAUAVGAMAI-KGLIPLIRSA-N 2 0 218.344 2.071 20 0 BEADRP CC(C)(C)[C@@H]1CCC[N@@H+]1C[C@]1(C)CC[NH2+]C1 ZINC000262110973 535074761 /nfs/dbraw/zinc/07/47/61/535074761.db2.gz WKHVMTRERXNDMK-GXTWGEPZSA-N 2 0 224.392 2.497 20 0 BEADRP CCC[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCCC[NH2+]1 ZINC000086499893 535185627 /nfs/dbraw/zinc/18/56/27/535185627.db2.gz YJHUGCGXKOIEGL-RWMBFGLXSA-N 2 0 210.365 2.297 20 0 BEADRP CC1(C)CCC[C@H]1[NH2+][C@H]1CCC[NH2+]CC1 ZINC000168770337 535309397 /nfs/dbraw/zinc/30/93/97/535309397.db2.gz VQBZZFNQTVKSCA-NWDGAFQWSA-N 2 0 210.365 2.297 20 0 BEADRP CC(C)C[C@H]1CCC[N@@H+]1CC1CC[NH2+]CC1 ZINC000261812443 535327381 /nfs/dbraw/zinc/32/73/81/535327381.db2.gz RQCCKTWESOLVSL-CQSZACIVSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H](C)C[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000227329564 535523078 /nfs/dbraw/zinc/52/30/78/535523078.db2.gz VNRPLXBQALJWOD-GFCCVEGCSA-N 2 0 212.381 2.354 20 0 BEADRP CCC[C@H](C)C[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000226867026 535614588 /nfs/dbraw/zinc/61/45/88/535614588.db2.gz ZAJNUGLUQJHGEL-AVGNSLFASA-N 2 0 212.381 2.495 20 0 BEADRP CC[N@H+](CC1CC1)C[C@H]1CC[NH2+][C@H](C)C1 ZINC000261536035 535698045 /nfs/dbraw/zinc/69/80/45/535698045.db2.gz QEDHLTREQHCBGO-YPMHNXCESA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@@H]([NH2+]CC(C)(C)[NH3+])c1ccccc1 ZINC000261531514 535802927 /nfs/dbraw/zinc/80/29/27/535802927.db2.gz GVLXDZDGLXIVBD-GFCCVEGCSA-N 2 0 206.333 2.465 20 0 BEADRP CC[C@H]([NH2+][C@H]1CC[NH2+]C1)C1CCCCC1 ZINC000086729801 535946995 /nfs/dbraw/zinc/94/69/95/535946995.db2.gz OYFNLPWBFHJAMN-STQMWFEESA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@@]1(C)CC[N@H+](C[C@]2(C)CC[NH2+]C2)C1 ZINC000261557553 536048219 /nfs/dbraw/zinc/04/82/19/536048219.db2.gz XKGPJDLZNUOWIV-QWHCGFSZSA-N 2 0 210.365 2.108 20 0 BEADRP C[N@@H+]1CCC[C@@H]1CC[NH+]1C[C@@H]2[C@H](C1)C2(C)C ZINC000348204968 536370952 /nfs/dbraw/zinc/37/09/52/536370952.db2.gz VZRTUGDZVJDDRO-UPJWGTAASA-N 2 0 222.376 2.059 20 0 BEADRP CO[C@H](C[NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21)C1CC1 ZINC000262002032 536647482 /nfs/dbraw/zinc/64/74/82/536647482.db2.gz PXVLFXJALXIERM-QLFBSQMISA-N 2 0 246.354 2.146 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC[C@@H]1C1CC1)C[NH+]1CCCC1 ZINC000348106939 566264364 /nfs/dbraw/zinc/26/43/64/566264364.db2.gz PQFUWEFDFVFNCE-YUELXQCFSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[C@H]1C1CC1)C[NH+]1CCCC1 ZINC000348106938 566264841 /nfs/dbraw/zinc/26/48/41/566264841.db2.gz PQFUWEFDFVFNCE-VHDGCEQUSA-N 2 0 236.403 2.497 20 0 BEADRP C([NH2+][C@H]1CC[C@@H]1C1CC1)[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000348072192 566261388 /nfs/dbraw/zinc/26/13/88/566261388.db2.gz ABIZOJKEJDVDJJ-GLQYFDAESA-N 2 0 234.387 2.249 20 0 BEADRP CCCSC[C@H](C)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000892946695 583015306 /nfs/dbraw/zinc/01/53/06/583015306.db2.gz KTVTYQGNBKVFRE-QWHCGFSZSA-N 2 0 244.448 2.450 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@H]2C[C@H](O)c3ccccc32)C1 ZINC000854228999 588780995 /nfs/dbraw/zinc/78/09/95/588780995.db2.gz FRVLBMLQOPHIKZ-PKIAMQTDSA-N 2 0 246.354 2.024 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H]1C=CCC1 ZINC000854221336 588780129 /nfs/dbraw/zinc/78/01/29/588780129.db2.gz KNLNOIUUESTZIF-CMPLNLGQSA-N 2 0 231.343 2.218 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1C[C@@H](O)c2ccccc21 ZINC000854229225 588780776 /nfs/dbraw/zinc/78/07/76/588780776.db2.gz IIFYLJAKMIEOJG-KCPJHIHWSA-N 2 0 248.370 2.272 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H]2C[C@@H](O)c3ccccc32)C1 ZINC000854228996 588780938 /nfs/dbraw/zinc/78/09/38/588780938.db2.gz FRVLBMLQOPHIKZ-BAESOJJISA-N 2 0 246.354 2.024 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H]2CC[C@@H]2C2CC2)C1 ZINC000348089611 582495925 /nfs/dbraw/zinc/49/59/25/582495925.db2.gz UBUDWFOKDOFFKN-YUELXQCFSA-N 2 0 236.403 2.497 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CC[C@H]2C2CC2)C1 ZINC000348089610 582495937 /nfs/dbraw/zinc/49/59/37/582495937.db2.gz UBUDWFOKDOFFKN-VHDGCEQUSA-N 2 0 236.403 2.497 20 0 BEADRP C[NH+](C)C(C)(C)CNc1cc(N)[nH+]cc1Cl ZINC000891495910 582693096 /nfs/dbraw/zinc/69/30/96/582693096.db2.gz WLPXHTFRBJQFJX-UHFFFAOYSA-N 2 0 242.754 2.069 20 0 BEADRP C[C@H]1C[N@@H+](CC2CC[NH+](C)CC2)CC[C@@H]1C ZINC000892066936 582782902 /nfs/dbraw/zinc/78/29/02/582782902.db2.gz ZRLYIJGNCUPQJM-STQMWFEESA-N 2 0 224.392 2.306 20 0 BEADRP CC[C@@H]1C[C@@H](C)C[N@@H+]1CC1CC[NH+](C)CC1 ZINC000892068941 582784499 /nfs/dbraw/zinc/78/44/99/582784499.db2.gz WPFSVMAEUONXSZ-TZMCWYRMSA-N 2 0 224.392 2.449 20 0 BEADRP CC1(C)CCCC[C@@H]1[NH2+]C[C@H]([NH3+])C1CC1 ZINC000560942797 582840975 /nfs/dbraw/zinc/84/09/75/582840975.db2.gz ILFMZGGJOUBWAT-RYUDHWBXSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)[C@H]1CC[N@@H+]1CC1CC[NH+](C)CC1 ZINC000892403614 582877510 /nfs/dbraw/zinc/87/75/10/582877510.db2.gz OPIYXLDEFYFKJW-CYBMUJFWSA-N 2 0 210.365 2.059 20 0 BEADRP CC(C)C[N@H+](C)CCCNCc1nccs1 ZINC000651866765 583147455 /nfs/dbraw/zinc/14/74/55/583147455.db2.gz QMMUBJHUVJPYEJ-UHFFFAOYSA-N 2 0 241.404 2.211 20 0 BEADRP CC[C@@H]1[C@H](C)CC[N@@H+]1CC1CC[NH+](C)CC1 ZINC000893674302 583193634 /nfs/dbraw/zinc/19/36/34/583193634.db2.gz YUNFREATYGOHLA-TZMCWYRMSA-N 2 0 224.392 2.449 20 0 BEADRP CCCCCC[N@@H+]1C[C@@H]2CCC[C@]2([NH3+])C1 ZINC000857086987 588887105 /nfs/dbraw/zinc/88/71/05/588887105.db2.gz OZSAIIDWCOHLON-STQMWFEESA-N 2 0 210.365 2.380 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2CCC[C@@](C)(F)C2)CC1 ZINC000894659281 583504395 /nfs/dbraw/zinc/50/43/95/583504395.db2.gz QAWJSFSKNCCWMV-CYBMUJFWSA-N 2 0 228.355 2.152 20 0 BEADRP C[NH+]1CCC(C[N@H+]2C[C@@H]3CCCC[C@@H]3C2)CC1 ZINC000894722039 583514547 /nfs/dbraw/zinc/51/45/47/583514547.db2.gz HPHIPUKTJULXPK-GASCZTMLSA-N 2 0 236.403 2.450 20 0 BEADRP CCCN(CCC[NH+](C)C)Cc1ocnc1C ZINC000894776241 583516741 /nfs/dbraw/zinc/51/67/41/583516741.db2.gz DTYMFEQNQFXPRD-UHFFFAOYSA-N 2 0 239.363 2.147 20 0 BEADRP CCC1(CC)C[NH+](CC2CC[NH+](C)CC2)C1 ZINC000894820279 583525136 /nfs/dbraw/zinc/52/51/36/583525136.db2.gz ULPQGTIFYHEBOQ-UHFFFAOYSA-N 2 0 224.392 2.450 20 0 BEADRP CCC1(C)C[NH+](CC2CC[NH+](C)CC2)C1 ZINC000894840815 583530175 /nfs/dbraw/zinc/53/01/75/583530175.db2.gz RGQIQVSYRNHHPC-UHFFFAOYSA-N 2 0 210.365 2.060 20 0 BEADRP C(=C/c1ccccc1)\CC[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC000323665572 583532517 /nfs/dbraw/zinc/53/25/17/583532517.db2.gz DMKRXWINOLZRMX-POTOTVBWSA-N 2 0 242.366 2.241 20 0 BEADRP C[NH+]1CCC(C[NH2+]CC2CCC(F)CC2)CC1 ZINC000895120770 583595003 /nfs/dbraw/zinc/59/50/03/583595003.db2.gz HGAPTDHEDFAFIQ-UHFFFAOYSA-N 2 0 242.382 2.446 20 0 BEADRP C[C@@H](CSCCF)[NH2+]CC[C@H](C)[NH+](C)C ZINC000895291535 583637080 /nfs/dbraw/zinc/63/70/80/583637080.db2.gz FWZOGPGAWVNBRQ-QWRGUYRKSA-N 2 0 236.400 2.007 20 0 BEADRP C[C@H](CC[NH2+][C@@H]1C[C@H]2CCC[C@H]2C1)[NH+](C)C ZINC000895429606 583669024 /nfs/dbraw/zinc/66/90/24/583669024.db2.gz QQIMNQLKWYURFH-YIYPIFLZSA-N 2 0 224.392 2.495 20 0 BEADRP CC(C)([NH2+]Cc1cnc[nH]1)[C@@H](O)c1ccccc1 ZINC000895663632 583702647 /nfs/dbraw/zinc/70/26/47/583702647.db2.gz ZGCQKBOKNZYNPU-ZDUSSCGKSA-N 2 0 245.326 2.012 20 0 BEADRP Cc1ccc(CCC[NH2+][C@@H]2CCN(C)[C@@H]2C)cn1 ZINC000896555943 583811584 /nfs/dbraw/zinc/81/15/84/583811584.db2.gz SKIMVAFFDBRXHJ-UKRRQHHQSA-N 2 0 247.386 2.005 20 0 BEADRP C[N@@H+]1C[C@@H]2C[NH+](CC3(C)CCCC3)C[C@]2(C)C1 ZINC000897620367 584032596 /nfs/dbraw/zinc/03/25/96/584032596.db2.gz NXGGCIYJCBUZTG-HIFRSBDPSA-N 2 0 236.403 2.450 20 0 BEADRP CC(C)C[N@H+](C)CC(C)(C)C[NH+](C)C ZINC000898308263 584109629 /nfs/dbraw/zinc/10/96/29/584109629.db2.gz VNNVATTYWVVIDF-UHFFFAOYSA-N 2 0 200.370 2.162 20 0 BEADRP C(CC1CC1)C[N@@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1 ZINC000866666083 584121630 /nfs/dbraw/zinc/12/16/30/584121630.db2.gz NFJZEHRPFQNKHD-CABCVRRESA-N 2 0 236.403 2.498 20 0 BEADRP CCc1cccnc1[C@H](C)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873249689 584128233 /nfs/dbraw/zinc/12/82/33/584128233.db2.gz CAARQDCMYLBCEW-GMXVVIOVSA-N 2 0 233.359 2.032 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[C@@H]1C1CC1)C1CC[NH2+]CC1 ZINC000873271860 584128646 /nfs/dbraw/zinc/12/86/46/584128646.db2.gz MSEIFWBPFLXYLD-GDLCADMTSA-N 2 0 222.376 2.153 20 0 BEADRP CNc1ccc(C)cc1C[NH2+]CCCC[NH+](C)C ZINC000902128787 584529611 /nfs/dbraw/zinc/52/96/11/584529611.db2.gz FGCDWAUTEVTMFC-UHFFFAOYSA-N 2 0 249.402 2.468 20 0 BEADRP CNc1ccccc1C[NH2+]CC1CC[NH+](C)CC1 ZINC000902199954 584537164 /nfs/dbraw/zinc/53/71/64/584537164.db2.gz ZNMMCDHMMNRELX-UHFFFAOYSA-N 2 0 247.386 2.160 20 0 BEADRP CSC[C@@H](C)[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000902331943 584562912 /nfs/dbraw/zinc/56/29/12/584562912.db2.gz WZTVKGSMGXHNFH-GHMZBOCLSA-N 2 0 230.421 2.106 20 0 BEADRP CC(C)OCCC[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000902331985 584562954 /nfs/dbraw/zinc/56/29/54/584562954.db2.gz XUFRSTOXYNULTC-CYBMUJFWSA-N 2 0 242.407 2.169 20 0 BEADRP CC(C)=CC[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000902377166 584568575 /nfs/dbraw/zinc/56/85/75/584568575.db2.gz RRGWSHQWLIQUMX-LBPRGKRZSA-N 2 0 210.365 2.320 20 0 BEADRP CC(C)=CC[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000902377165 584568600 /nfs/dbraw/zinc/56/86/00/584568600.db2.gz RRGWSHQWLIQUMX-GFCCVEGCSA-N 2 0 210.365 2.320 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]([NH2+]CCc2ccco2)C1 ZINC000902359895 584571298 /nfs/dbraw/zinc/57/12/98/584571298.db2.gz HZHHLKAZVPBPCP-LBPRGKRZSA-N 2 0 236.359 2.190 20 0 BEADRP C[C@@H]1Cc2ccccc2[C@@H]1[NH2+]CC1([NH3+])CC1 ZINC000902412533 584576398 /nfs/dbraw/zinc/57/63/98/584576398.db2.gz COAZKEIRUIITQL-ZWNOBZJWSA-N 2 0 216.328 2.001 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]([NH2+]CCCCF)C1 ZINC000902386875 584579173 /nfs/dbraw/zinc/57/91/73/584579173.db2.gz HFMJPVSIPLCDTD-NSHDSACASA-N 2 0 216.344 2.104 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]([NH2+]CC2=CCCC2)C1 ZINC000902395708 584585356 /nfs/dbraw/zinc/58/53/56/584585356.db2.gz FDRBFHYGGLTJSB-CYBMUJFWSA-N 2 0 222.376 2.465 20 0 BEADRP C[C@@]1(C[NH2+][C@H]2CC[NH2+]CC(C)(C)C2)CC1(F)F ZINC000902400958 584586776 /nfs/dbraw/zinc/58/67/76/584586776.db2.gz YNVUEIOHUWZOMK-JQWIXIFHSA-N 2 0 246.345 2.400 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H](C2CC2)C2CCCC2)CC1 ZINC000902404970 584588676 /nfs/dbraw/zinc/58/86/76/584588676.db2.gz HSBKTGGKFGDNHP-GFCCVEGCSA-N 2 0 208.349 2.036 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CC(C)(C)C1CCOCC1 ZINC000902432229 584595425 /nfs/dbraw/zinc/59/54/25/584595425.db2.gz ORGBKWRYIMIRCR-NEPJUHHUSA-N 2 0 242.407 2.155 20 0 BEADRP CC1(C)C[NH2+]C[C@@H]1[NH2+][C@@H]1CCC[C@@H]1CCCF ZINC000902440836 584597335 /nfs/dbraw/zinc/59/73/35/584597335.db2.gz ARSOZOOVUFRAOL-UPJWGTAASA-N 2 0 242.382 2.492 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+][C@H]2C[NH2+]CC2(C)C)C1 ZINC000902445372 584598836 /nfs/dbraw/zinc/59/88/36/584598836.db2.gz LUPBFPQUTUNIRX-UTUOFQBUSA-N 2 0 210.365 2.153 20 0 BEADRP [NH3+]C1(CN[C@H]2CCc3ccc(Cl)cc32)CC1 ZINC000902414668 584600411 /nfs/dbraw/zinc/60/04/11/584600411.db2.gz YYPTYULWRKSXPR-LBPRGKRZSA-N 2 0 236.746 2.408 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2)C1CCCCC1 ZINC000902472856 584600980 /nfs/dbraw/zinc/60/09/80/584600980.db2.gz JJULLSJBYGLZFO-RUZUBIRVSA-N 2 0 222.376 2.438 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902472721 584601334 /nfs/dbraw/zinc/60/13/34/584601334.db2.gz GFJVSAVZOJHVKI-NAWOPXAZSA-N 2 0 208.349 2.048 20 0 BEADRP CC[C@@H]1CCC[C@@H]([NH2+][C@@H]2C[C@H]3CC[C@@H]2[NH2+]3)C1 ZINC000902474481 584602007 /nfs/dbraw/zinc/60/20/07/584602007.db2.gz FOPVYEHJMIKGJA-XGFWRYKXSA-N 2 0 222.376 2.438 20 0 BEADRP CC(C)[C@@H]1CCC[C@H]1[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902474146 584602033 /nfs/dbraw/zinc/60/20/33/584602033.db2.gz CWNZDDBPJWBSJM-XHJNMGKDSA-N 2 0 222.376 2.294 20 0 BEADRP CC(C)[C@@H]1CCC[C@@H]1[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902474137 584602242 /nfs/dbraw/zinc/60/22/42/584602242.db2.gz CWNZDDBPJWBSJM-IKOXMDCHSA-N 2 0 222.376 2.294 20 0 BEADRP C[C@@H](CC1CCC1)[NH2+][C@@H]1C[NH2+]CC1(C)C ZINC000902448110 584604908 /nfs/dbraw/zinc/60/49/08/584604908.db2.gz CHJHUMPZIHLBHU-CMPLNLGQSA-N 2 0 210.365 2.153 20 0 BEADRP CC1(C)C[C@H]([NH2+][C@@H]2CCC[C@H]2[NH3+])CCS1 ZINC000902449983 584606251 /nfs/dbraw/zinc/60/62/51/584606251.db2.gz AZTVZIPUNFACQS-GMTAPVOTSA-N 2 0 228.405 2.130 20 0 BEADRP CC1(C)C[C@H]([NH2+][C@@H]2CCC[C@H]2C[NH3+])CCS1 ZINC000902451176 584606806 /nfs/dbraw/zinc/60/68/06/584606806.db2.gz GHFLTWQNMPIBIO-QJPTWQEYSA-N 2 0 242.432 2.378 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@@H]1CCSC(C)(C)C1 ZINC000902454282 584608526 /nfs/dbraw/zinc/60/85/26/584608526.db2.gz SCYFOEFHTPSLLA-HBNTYKKESA-N 2 0 230.421 2.376 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CCC=CCCC1)C1C[NH2+]C1 ZINC000902454811 584609135 /nfs/dbraw/zinc/60/91/35/584609135.db2.gz IKKBDDIHQOGTPM-OLZOCXBDSA-N 2 0 222.376 2.320 20 0 BEADRP CC[C@H]([NH2+][C@@H]1C[C@@H]2CCC[C@@H]12)[C@@H]1CCC[NH2+]1 ZINC000902459188 584610783 /nfs/dbraw/zinc/61/07/83/584610783.db2.gz YLAVISXYYIZOPX-ZUWCUPBKSA-N 2 0 222.376 2.295 20 0 BEADRP CC[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H]21)[C@@H]1CCC[NH2+]1 ZINC000902459186 584610863 /nfs/dbraw/zinc/61/08/63/584610863.db2.gz YLAVISXYYIZOPX-IKOXMDCHSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]C[C@H]1CCCC(C)(C)O1 ZINC000902460615 584611660 /nfs/dbraw/zinc/61/16/60/584611660.db2.gz HPNKGIDBBAMUSG-QJPTWQEYSA-N 2 0 228.380 2.050 20 0 BEADRP C1CC1[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902463634 584612295 /nfs/dbraw/zinc/61/22/95/584612295.db2.gz AERUVHRGIZAXCH-BTFPBAQTSA-N 2 0 234.387 2.438 20 0 BEADRP C1CC1[C@H]1CCCC[C@H]1[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902463635 584612698 /nfs/dbraw/zinc/61/26/98/584612698.db2.gz AERUVHRGIZAXCH-NJVJYBDUSA-N 2 0 234.387 2.438 20 0 BEADRP CC[C@H]1CCC[C@H]([NH2+][C@@H]2C[C@@H]3CC[C@H]2[NH2+]3)C1 ZINC000902465010 584613101 /nfs/dbraw/zinc/61/31/01/584613101.db2.gz FOPVYEHJMIKGJA-QSLWVIQJSA-N 2 0 222.376 2.438 20 0 BEADRP CC(C)(C)[C@H]1CC[C@@H]1[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902466797 584614124 /nfs/dbraw/zinc/61/41/24/584614124.db2.gz MVJZKIJXKGQQQX-QNWJLWSRSA-N 2 0 222.376 2.294 20 0 BEADRP CC(C)(C)[C@H]1CC[C@@H]1[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902468202 584614688 /nfs/dbraw/zinc/61/46/88/584614688.db2.gz MVJZKIJXKGQQQX-JZRPKSSGSA-N 2 0 222.376 2.294 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+][C@@H]2CCc3cc(F)ccc32)C1 ZINC000902489960 584617135 /nfs/dbraw/zinc/61/71/35/584617135.db2.gz SYUOGECXBKIELG-GAJTVXKRSA-N 2 0 234.318 2.140 20 0 BEADRP Cc1ccc([C@H](C)[NH2+][C@H]2C[C@H](C[NH3+])C2)s1 ZINC000902490033 584617330 /nfs/dbraw/zinc/61/73/30/584617330.db2.gz UPFGYIOYNHUTIQ-DCAQKATOSA-N 2 0 224.373 2.444 20 0 BEADRP C[C@@H]1CC([NH2+][C@@H]2C[C@@H]3CC[C@H]2[NH2+]3)C[C@@H](C)C1 ZINC000902471513 584617503 /nfs/dbraw/zinc/61/75/03/584617503.db2.gz PVZJMBYHYYMXLZ-FFNLUWKOSA-N 2 0 222.376 2.294 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+][C@H]2CCCc3ccccc3C2)C1 ZINC000902490735 584618114 /nfs/dbraw/zinc/61/81/14/584618114.db2.gz VDGCZAYGSSJROH-RCBQFDQVSA-N 2 0 244.382 2.261 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+][C@@H]2CCC[C@H](C3CC3)C2)C1 ZINC000902491666 584618309 /nfs/dbraw/zinc/61/83/09/584618309.db2.gz YGWFXPYTZSNQKL-DEQVHRJGSA-N 2 0 222.376 2.282 20 0 BEADRP CC[C@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)C1CCCC1 ZINC000902491737 584618344 /nfs/dbraw/zinc/61/83/44/584618344.db2.gz YJDKCUPMSBEGOJ-DRZSPHRISA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1CC=CC[C@H]1[NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2 ZINC000902502452 584620861 /nfs/dbraw/zinc/62/08/61/584620861.db2.gz FUKCYTITTWXCMD-FDYHWXHSSA-N 2 0 220.360 2.201 20 0 BEADRP CC[C@H]([NH2+]C[C@H]1CCCCC[NH2+]1)C1CC1 ZINC000902482429 584624211 /nfs/dbraw/zinc/62/42/11/584624211.db2.gz LDWMDRWWCLFHEE-OLZOCXBDSA-N 2 0 210.365 2.297 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+][C@@H]2CCCC[C@@H]2C2CC2)C1 ZINC000902484112 584624891 /nfs/dbraw/zinc/62/48/91/584624891.db2.gz CVNPFESLQNBRSL-FMKGYKFTSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)C1C(C)(C)C1(C)C ZINC000902485590 584625155 /nfs/dbraw/zinc/62/51/55/584625155.db2.gz BBERGTWBADFGAP-GMTAPVOTSA-N 2 0 224.392 2.384 20 0 BEADRP COc1ccsc1[C@@H](C)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902486056 584625165 /nfs/dbraw/zinc/62/51/65/584625165.db2.gz OMJQJQZFDHMPMV-OPRDCNLKSA-N 2 0 240.372 2.145 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+][C@H]2CCCC23CCCC3)C1 ZINC000902486094 584625366 /nfs/dbraw/zinc/62/53/66/584625366.db2.gz PFWKTLSNEBHODK-AVGNSLFASA-N 2 0 222.376 2.426 20 0 BEADRP C[C@@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1cccnc1Cl ZINC000902485552 584625415 /nfs/dbraw/zinc/62/54/15/584625415.db2.gz AFPOOYBCVYIODP-OPRDCNLKSA-N 2 0 239.750 2.123 20 0 BEADRP CCc1ccc([C@H](C)[NH2+][C@H]2C[C@H](C[NH3+])C2)o1 ZINC000902486394 584625478 /nfs/dbraw/zinc/62/54/78/584625478.db2.gz GNHVTCUMIYOFFG-DCAQKATOSA-N 2 0 222.332 2.230 20 0 BEADRP C[C@@H]1CCC[C@H](C)[C@H]1[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902486379 584625486 /nfs/dbraw/zinc/62/54/86/584625486.db2.gz GFROLQFEONZFGL-YOTBANQPSA-N 2 0 210.365 2.138 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+][C@@H]2CCCOc3ccccc32)C1 ZINC000902487106 584625930 /nfs/dbraw/zinc/62/59/30/584625930.db2.gz JQIWMMJJMMXSTE-YRGRVCCFSA-N 2 0 246.354 2.227 20 0 BEADRP CC[C@@H]1CCCC[C@H]1[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902487336 584626259 /nfs/dbraw/zinc/62/62/59/584626259.db2.gz SZMNLHCJUNHPLH-FDYHWXHSSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)C1CCCCC1 ZINC000902489498 584627504 /nfs/dbraw/zinc/62/75/04/584627504.db2.gz SBQZGRKMPCDUCC-NQBHXWOUSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H](c1ccncc1)C1CC1 ZINC000902515183 584629294 /nfs/dbraw/zinc/62/92/94/584629294.db2.gz UAJWNLUYCQKQJC-COPLHBTASA-N 2 0 233.359 2.248 20 0 BEADRP Cl/C=C\C[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000902516016 584630162 /nfs/dbraw/zinc/63/01/62/584630162.db2.gz BROZXZFZGONTGT-PHABENIHSA-N 2 0 228.767 2.249 20 0 BEADRP Cn1cncc1CC[NH2+]C1C[C@@H]2CCC[C@H]2C1 ZINC000902957538 584705803 /nfs/dbraw/zinc/70/58/03/584705803.db2.gz KEYOSOWOZRBNFU-RYUDHWBXSA-N 2 0 233.359 2.131 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@H+](C)CCCc1ccccc1 ZINC000903431157 584761486 /nfs/dbraw/zinc/76/14/86/584761486.db2.gz FPXAXJMMMDVUFZ-ZBFHGGJFSA-N 2 0 246.398 2.407 20 0 BEADRP C[C@H](C1CC1)[N@H+](C[C@@H]1CC[C@H]([NH3+])C1)C1CC1 ZINC000903431060 584761598 /nfs/dbraw/zinc/76/15/98/584761598.db2.gz KYQNNFWPUZEMLD-WZRBSPASSA-N 2 0 222.376 2.377 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@H+](C1CC1)C1CCCC1 ZINC000903431449 584761950 /nfs/dbraw/zinc/76/19/50/584761950.db2.gz OUDUZUMAAPTRTM-NEPJUHHUSA-N 2 0 222.376 2.249 20 0 BEADRP COCC[N@H+](C[C@@H]1CC[C@H]([NH3+])C1)C1CCCC1 ZINC000903435386 584762339 /nfs/dbraw/zinc/76/23/39/584762339.db2.gz RLNZIALSXUMCTC-OLZOCXBDSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@@H+]1C[C@@H](C)CCC[C@H]1C ZINC000903440168 584763408 /nfs/dbraw/zinc/76/34/08/584763408.db2.gz VIHVLHLIIJHKFT-DGAVXFQQSA-N 2 0 224.392 2.352 20 0 BEADRP CCSCC[C@@H](C)[N@H+](C)C[C@@H]1C[NH2+]C[C@H]1C ZINC000903441413 584763497 /nfs/dbraw/zinc/76/34/97/584763497.db2.gz QWGKRZKOXYSPFB-UPJWGTAASA-N 2 0 244.448 2.305 20 0 BEADRP CC[C@H]1CCC[C@@H]1[NH2+]C[C@@H]1CC[C@H]([NH3+])C1 ZINC000903458514 584765428 /nfs/dbraw/zinc/76/54/28/584765428.db2.gz BTHZIXRYABQUQI-VOAKCMCISA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@H]1CC[C@@H](C)C[C@@H]1C ZINC000903458925 584765960 /nfs/dbraw/zinc/76/59/60/584765960.db2.gz NFFDTUZHDNZNOR-BJJPWKGXSA-N 2 0 224.392 2.256 20 0 BEADRP C[C@@H]([NH3+])[C@@H]1CC[N@H+](Cc2ccc3cc[nH]c3c2)C1 ZINC000903447136 584770906 /nfs/dbraw/zinc/77/09/06/584770906.db2.gz GOFGYSHYKISOQK-BXUZGUMPSA-N 2 0 243.354 2.337 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[N@@H+]2CCC[C@@H]2c2cccnc2)C1 ZINC000903454438 584773461 /nfs/dbraw/zinc/77/34/61/584773461.db2.gz CBZSBCUYMLQFMF-NWANDNLSSA-N 2 0 245.370 2.346 20 0 BEADRP CC1(C)CC(C[NH2+][C@@H]2CC[NH2+]C23CCC3)C1 ZINC000903472757 584776012 /nfs/dbraw/zinc/77/60/12/584776012.db2.gz WBLSTHHABZJBRV-GFCCVEGCSA-N 2 0 222.376 2.297 20 0 BEADRP C([NH2+][C@H]1CC[NH2+]C12CCC2)[C@@H]1CC[C@H]2C[C@H]2C1 ZINC000903473017 584776285 /nfs/dbraw/zinc/77/62/85/584776285.db2.gz YUHFQUMFNKVJTL-RQJABVFESA-N 2 0 234.387 2.297 20 0 BEADRP C=C/C=C/CC[NH2+][C@@H]1CC[NH2+]C12CCCC2 ZINC000903481841 584777791 /nfs/dbraw/zinc/77/77/91/584777791.db2.gz OCUVPMIAPFRUPI-ITDFMYJTSA-N 2 0 220.360 2.383 20 0 BEADRP C=C/C=C/CC[NH2+][C@H]1CC[NH2+]C12CCCC2 ZINC000903481842 584778195 /nfs/dbraw/zinc/77/81/95/584778195.db2.gz OCUVPMIAPFRUPI-OOPCZODUSA-N 2 0 220.360 2.383 20 0 BEADRP C[C@@H]1CCC(C)(C)[N@@H+]1C[C@@H]1CC[C@H]([NH3+])C1 ZINC000903482860 584778502 /nfs/dbraw/zinc/77/85/02/584778502.db2.gz WEFHDMZNWCXEEV-UTUOFQBUSA-N 2 0 210.365 2.377 20 0 BEADRP CCSCCC[NH2+][C@H]1CC[NH2+]C12CCCC2 ZINC000903482967 584778587 /nfs/dbraw/zinc/77/85/87/584778587.db2.gz AIILNUXMTPFHDV-LBPRGKRZSA-N 2 0 242.432 2.394 20 0 BEADRP CC1(C)[C@@H]([NH3+])C[C@@H]1[NH2+]Cc1ccc2cc[nH]c2c1 ZINC000903482632 584778832 /nfs/dbraw/zinc/77/88/32/584778832.db2.gz NLTINWCFGNZOCY-KBPBESRZSA-N 2 0 243.354 2.383 20 0 BEADRP C[C@@H]([NH3+])C1CC[NH+](CC2CC(C)C2)CC1 ZINC000903716437 584791992 /nfs/dbraw/zinc/79/19/92/584791992.db2.gz MZRXKSLAPHYOAB-MOENNCHZSA-N 2 0 210.365 2.092 20 0 BEADRP CCCC[N@H+](CCOC)C[C@H]1CCCC[NH2+]C1 ZINC000903729707 584792976 /nfs/dbraw/zinc/79/29/76/584792976.db2.gz QWPUYEXSNHXPGO-AWEZNQCLSA-N 2 0 242.407 2.125 20 0 BEADRP [NH3+]CC1CC[NH+](Cc2ccccc2CF)CC1 ZINC000903713562 584793462 /nfs/dbraw/zinc/79/34/62/584793462.db2.gz VSFYZKNAVZJQOV-UHFFFAOYSA-N 2 0 236.334 2.327 20 0 BEADRP C[C@H]1C[N@H+](Cc2ccccc2CF)CC[C@@H]1[NH3+] ZINC000903716019 584794095 /nfs/dbraw/zinc/79/40/95/584794095.db2.gz GCIMUIGWBYCARK-FZMZJTMJSA-N 2 0 236.334 2.325 20 0 BEADRP CC1CC(C[N@@H+]2C[C@@H]3CCC[C@H]([NH3+])[C@H]3C2)C1 ZINC000903743089 584796616 /nfs/dbraw/zinc/79/66/16/584796616.db2.gz IEPBWOKAWSQDSP-TYCJUYHCSA-N 2 0 222.376 2.092 20 0 BEADRP NC[C@@]12CC[C@H]1CCC[N@@H+]2CCc1ccccc1 ZINC000903795031 584798934 /nfs/dbraw/zinc/79/89/34/584798934.db2.gz HXXZJBYKJVMXCS-CVEARBPZSA-N 2 0 244.382 2.432 20 0 BEADRP FCCC1CC[NH+](C[C@H]2CCCC[NH2+]C2)CC1 ZINC000903777021 584799084 /nfs/dbraw/zinc/79/90/84/584799084.db2.gz ZBICLSQCLBVSBW-AWEZNQCLSA-N 2 0 242.382 2.448 20 0 BEADRP CC1CC(C[N@@H+]2CCCC[C@@]3(CC[NH2+]C3)C2)C1 ZINC000903784707 584800076 /nfs/dbraw/zinc/80/00/76/584800076.db2.gz QKMZQPXVPJJZLW-NRXISQOPSA-N 2 0 236.403 2.498 20 0 BEADRP Cc1cccc(C)c1C[N@H+](C)C[C@H]1CC[NH2+]C1 ZINC000903827476 584805050 /nfs/dbraw/zinc/80/50/50/584805050.db2.gz UFPFDNVVNQVVHT-AWEZNQCLSA-N 2 0 232.371 2.345 20 0 BEADRP C[C@H]1CSCCC[N@@H+]1CC[C@@H]1CCC[NH2+]C1 ZINC000903829232 584805844 /nfs/dbraw/zinc/80/58/44/584805844.db2.gz CLCZCZXQNJLULC-STQMWFEESA-N 2 0 242.432 2.204 20 0 BEADRP [NH3+][C@@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccccc1CF)C2 ZINC000903840971 584807036 /nfs/dbraw/zinc/80/70/36/584807036.db2.gz VLZTWAXMFRAQPU-GLQYFDAESA-N 2 0 248.345 2.468 20 0 BEADRP C([C@@H]1CC[C@@H]2C[C@@H]2C1)[N@@H+]1CCC[C@@]12CC[NH2+]C2 ZINC000903871435 584815148 /nfs/dbraw/zinc/81/51/48/584815148.db2.gz UNDNXJWGVGCXSX-KBXIAJHMSA-N 2 0 234.387 2.251 20 0 BEADRP C[C@@]1(C2CC2)COCC[N@@H+]1CCCCCC[NH3+] ZINC000903883661 584818375 /nfs/dbraw/zinc/81/83/75/584818375.db2.gz ZBEGIYANTBHGCQ-AWEZNQCLSA-N 2 0 240.391 2.006 20 0 BEADRP C[C@H]1CC([NH2+]C[C@H]([NH3+])CC(F)F)C[C@H](C)C1 ZINC000903922125 584823175 /nfs/dbraw/zinc/82/31/75/584823175.db2.gz VEHXOBNBEJVSOC-OPRDCNLKSA-N 2 0 234.334 2.383 20 0 BEADRP C[C@H]1C[C@H]([NH2+]C[C@H]([NH3+])CC(F)F)C[C@@H](C)C1 ZINC000903922126 584823177 /nfs/dbraw/zinc/82/31/77/584823177.db2.gz VEHXOBNBEJVSOC-YTWAJWBKSA-N 2 0 234.334 2.383 20 0 BEADRP C[C@@H](CC(C)(C)C)[NH2+]C[C@@H]([NH3+])CC(F)F ZINC000903925447 584823820 /nfs/dbraw/zinc/82/38/20/584823820.db2.gz FMZIXTAOBLDGEG-IUCAKERBSA-N 2 0 222.323 2.383 20 0 BEADRP C[C@H]1CC(C)(C)CN1C[C@@H]([NH3+])CC(F)F ZINC000903929184 584824098 /nfs/dbraw/zinc/82/40/98/584824098.db2.gz BMZXJIGGAGSABT-IUCAKERBSA-N 2 0 220.307 2.089 20 0 BEADRP Cc1cc(F)ccc1C[NH2+]CCC(C)(C)[NH3+] ZINC000903938882 584824182 /nfs/dbraw/zinc/82/41/82/584824182.db2.gz OLIMMOUJTBZIEL-UHFFFAOYSA-N 2 0 224.323 2.351 20 0 BEADRP [NH3+][C@H](CC(F)F)CN1CC[C@@H](C2CCC2)C1 ZINC000903929152 584824258 /nfs/dbraw/zinc/82/42/58/584824258.db2.gz AZYCGOWJADZVPY-GHMZBOCLSA-N 2 0 232.318 2.091 20 0 BEADRP CC(C)([NH3+])CC[NH2+]Cc1cccc2cnccc21 ZINC000903938818 584826762 /nfs/dbraw/zinc/82/67/62/584826762.db2.gz LRYZPJIWWSJERK-UHFFFAOYSA-N 2 0 243.354 2.452 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1C[NH2+]CCC1(F)F ZINC000903957395 584827384 /nfs/dbraw/zinc/82/73/84/584827384.db2.gz QKOXLZPLIAKFOI-VWYCJHECSA-N 2 0 232.318 2.009 20 0 BEADRP CC(C)CCC[NH2+]C[C@H]1C[NH2+]CCC1(F)F ZINC000903958412 584827404 /nfs/dbraw/zinc/82/74/04/584827404.db2.gz ZRMHHQFQKMRBJL-NSHDSACASA-N 2 0 234.334 2.257 20 0 BEADRP C[C@H](CC1CC1)[NH2+]C[C@@H]1C[NH2+]CCC1(F)F ZINC000903958338 584827509 /nfs/dbraw/zinc/82/75/09/584827509.db2.gz XYIURHMQIWYAHQ-KOLCDFICSA-N 2 0 232.318 2.009 20 0 BEADRP C[C@@H]1C[C@@H](C[NH2+]Cc2cc(C3CC3)no2)CC[NH2+]1 ZINC000903954095 584831705 /nfs/dbraw/zinc/83/17/05/584831705.db2.gz QAARVUBPEMDOAN-MNOVXSKESA-N 2 0 249.358 2.030 20 0 BEADRP FC1(F)CC[NH2+]C[C@@H]1C[NH2+]CC1CCCCC1 ZINC000903954935 584832019 /nfs/dbraw/zinc/83/20/19/584832019.db2.gz IZAARXRYEKBUDF-GFCCVEGCSA-N 2 0 246.345 2.401 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+][C@H]1CCCC1(C)C ZINC000903973910 584832662 /nfs/dbraw/zinc/83/26/62/584832662.db2.gz IVFUDTBSUVCWTO-UPJWGTAASA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+]CCC(C)(C)C ZINC000903978965 584833054 /nfs/dbraw/zinc/83/30/54/584833054.db2.gz PUYVYSNIGYVZHJ-VXGBXAGGSA-N 2 0 212.381 2.258 20 0 BEADRP CC(C)C1CCC([NH2+][C@@H]2C[NH2+]C[C@H]2C)CC1 ZINC000903964121 584834185 /nfs/dbraw/zinc/83/41/85/584834185.db2.gz MJKSRDPFUJOWIW-BLYZHGLHSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@H](CC1CCCC1)[NH2+][C@@H]1C[NH2+]C[C@H]1C ZINC000903964102 584834260 /nfs/dbraw/zinc/83/42/60/584834260.db2.gz LTHLBJJINUOREQ-NQBHXWOUSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+][C@H]1CC[C@@H](C)C[C@@H]1C ZINC000903965019 584834531 /nfs/dbraw/zinc/83/45/31/584834531.db2.gz YHXJEIJDYIDYDB-RXGFPQBGSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@@H]1CCC[C@H](C)C1 ZINC000903968398 584834860 /nfs/dbraw/zinc/83/48/60/584834860.db2.gz UYRZRRNUIYTUOR-QNWHQSFQSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1C[NH2+]C[C@H]1C)C1CCCCC1 ZINC000903967703 584834846 /nfs/dbraw/zinc/83/48/46/584834846.db2.gz LFCLNCYWNUWLOX-BZPMIXESSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+]CCC1CCCCC1 ZINC000903968366 584835055 /nfs/dbraw/zinc/83/50/55/584835055.db2.gz UGENSKRRKVSSEQ-TZMCWYRMSA-N 2 0 224.392 2.402 20 0 BEADRP CC(C)CC[C@@H](C)[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000903968007 584835226 /nfs/dbraw/zinc/83/52/26/584835226.db2.gz OUUTXKISEXIKBN-UPJWGTAASA-N 2 0 212.381 2.256 20 0 BEADRP CC(C)(/C=C/Cl)[NH2+]CC1CC[NH2+]CC1 ZINC000903988228 584835906 /nfs/dbraw/zinc/83/59/06/584835906.db2.gz PJIODEXAEWTKQE-AATRIKPKSA-N 2 0 216.756 2.107 20 0 BEADRP C[C@@H](C[N@H+](C)C[C@H]1C[C@@H]([NH3+])C1)c1ccccc1 ZINC000904316553 584863333 /nfs/dbraw/zinc/86/33/33/584863333.db2.gz PRKMZBGTBHSTBQ-KCQAQPDRSA-N 2 0 232.371 2.459 20 0 BEADRP C[C@H]1c2ccccc2CC[N@H+]1C[C@H]1C[C@@H]([NH3+])C1 ZINC000904317167 584863792 /nfs/dbraw/zinc/86/37/92/584863792.db2.gz CUIXBLSIQSFCJW-SGMGOOAPSA-N 2 0 230.355 2.343 20 0 BEADRP CCCC[N@H+](CCOC)C[C@@]1(C)CCC[NH2+]C1 ZINC000904321529 584863866 /nfs/dbraw/zinc/86/38/66/584863866.db2.gz ZNWXRYJKAYFZGQ-AWEZNQCLSA-N 2 0 242.407 2.125 20 0 BEADRP CCCO[C@@H]1CCC[N@H+](C[C@H]2C[C@@H]([NH3+])C2)CC1 ZINC000904320045 584863917 /nfs/dbraw/zinc/86/39/17/584863917.db2.gz BUGHFMUWJDRJHT-HZSPNIEDSA-N 2 0 240.391 2.005 20 0 BEADRP CCC[N@H+](C[C@H]1C[C@@H]([NH3+])C1)C[C@@H]1CCCCO1 ZINC000904318551 584864196 /nfs/dbraw/zinc/86/41/96/584864196.db2.gz SAGBJALZAYLLCJ-MJBXVCDLSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@@H]1C[C@H]2CCCC[C@@H]2[N@@H+]1C[C@H]1C[C@@H]([NH3+])C1 ZINC000904321322 584864204 /nfs/dbraw/zinc/86/42/04/584864204.db2.gz WKZXERGMKPHTTR-POQQGIQPSA-N 2 0 222.376 2.377 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+]C2(c3ccccc3)CC2)C1 ZINC000904328078 584865216 /nfs/dbraw/zinc/86/52/16/584865216.db2.gz LYFYESDVVZFVLR-BJHJDKERSA-N 2 0 216.328 2.003 20 0 BEADRP CCSCC[C@H](C)[N@H+](C)C[C@H]1C[C@@H]([NH3+])C1 ZINC000904327010 584865251 /nfs/dbraw/zinc/86/52/51/584865251.db2.gz WSHBILUMXCZOJZ-SDDRHHMPSA-N 2 0 230.421 2.187 20 0 BEADRP COCC(C)(C)[NH2+]C[C@@H]([NH3+])CCC(C)(C)C ZINC000904328527 584865326 /nfs/dbraw/zinc/86/53/26/584865326.db2.gz QKISAHJUDBAXIZ-NSHDSACASA-N 2 0 230.396 2.155 20 0 BEADRP CCC[C@@](C)(CO)[NH2+]C[C@@H]([NH3+])CCC(C)(C)C ZINC000904330036 584865996 /nfs/dbraw/zinc/86/59/96/584865996.db2.gz XJNUHWJVHBFKKA-JSGCOSHPSA-N 2 0 244.423 2.281 20 0 BEADRP [NH3+][C@H]1C[C@@H](CNc2ccc3c(c2)CCCN3)C1 ZINC000904354470 584870396 /nfs/dbraw/zinc/87/03/96/584870396.db2.gz ZISJSWRPSYKBKL-KLPPZKSPSA-N 2 0 231.343 2.194 20 0 BEADRP CC[C@H]([NH2+]C1CC(C[NH3+])C1)c1c(C)noc1C ZINC000904360836 584871909 /nfs/dbraw/zinc/87/19/09/584871909.db2.gz PVSOATDUJXZTAJ-MCIGGMRASA-N 2 0 237.347 2.069 20 0 BEADRP CC(C)(C)CC[C@H]([NH3+])C[NH2+]CCc1ccccn1 ZINC000904368407 584872796 /nfs/dbraw/zinc/87/27/96/584872796.db2.gz RHEHAHVPMPIPMS-ZDUSSCGKSA-N 2 0 249.402 2.367 20 0 BEADRP C[C@]1(C[N@@H+]2CC[C@@H](C3CCC3)C2)CCC[NH2+]C1 ZINC000904372692 584873769 /nfs/dbraw/zinc/87/37/69/584873769.db2.gz GRIGVQYNELRCEF-CABCVRRESA-N 2 0 236.403 2.498 20 0 BEADRP Cc1ccccc1C1([NH2+]C[C@H]2C[C@@H]([NH3+])C2)CC1 ZINC000904373891 584873917 /nfs/dbraw/zinc/87/39/17/584873917.db2.gz LDCKSUQPKURTHA-BETUJISGSA-N 2 0 230.355 2.311 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+]Cc2c(F)cccc2Cl)C1 ZINC000904364209 584874187 /nfs/dbraw/zinc/87/41/87/584874187.db2.gz UKKGGBUMWWRQRW-DTORHVGOSA-N 2 0 242.725 2.306 20 0 BEADRP C[C@H]([NH2+]C1CC(C[NH3+])C1)c1ccccc1 ZINC000904364238 584874227 /nfs/dbraw/zinc/87/42/27/584874227.db2.gz JOBRYMVHMGVWOQ-ZBOXLXRLSA-N 2 0 204.317 2.075 20 0 BEADRP CC(C)[C@@H](C[NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1cccnc1 ZINC000904364341 584874378 /nfs/dbraw/zinc/87/43/78/584874378.db2.gz VQZSGNWVISGOPU-VHDGCEQUSA-N 2 0 247.386 2.148 20 0 BEADRP Cc1ccccc1C1(C[NH2+]C2CC(C[NH3+])C2)CC1 ZINC000904366489 584874616 /nfs/dbraw/zinc/87/46/16/584874616.db2.gz LZMKHHQTILILGR-UHFFFAOYSA-N 2 0 244.382 2.354 20 0 BEADRP CC(C)(C)CC[C@H]([NH3+])C[NH2+]CC1CCOCC1 ZINC000904365918 584874732 /nfs/dbraw/zinc/87/47/32/584874732.db2.gz BLQHFZYZFHOTDY-ZDUSSCGKSA-N 2 0 242.407 2.156 20 0 BEADRP C[C@@H](C[NH2+]C[C@@]1(C)CCC[NH2+]C1)c1ccncc1 ZINC000904381598 584876989 /nfs/dbraw/zinc/87/69/89/584876989.db2.gz ZLQWTGGBMSSBCL-ZFWWWQNUSA-N 2 0 247.386 2.164 20 0 BEADRP C[C@]1(C[NH2+][C@@H]2CCCC[C@@H]2F)CCC[NH2+]C1 ZINC000904383972 584877165 /nfs/dbraw/zinc/87/71/65/584877165.db2.gz FNMADLVCOBLZIS-XQQFMLRXSA-N 2 0 228.355 2.246 20 0 BEADRP C[C@@H]1C[N@H+](C[C@H]2C[C@@H]([NH3+])C2)Cc2ccccc21 ZINC000904383808 584877179 /nfs/dbraw/zinc/87/71/79/584877179.db2.gz DXMXDHYKGPHWPQ-BZPMIXESSA-N 2 0 230.355 2.343 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@H]2c3ccccc3CC[C@@H]2F)C1 ZINC000904386174 584878057 /nfs/dbraw/zinc/87/80/57/584878057.db2.gz RHVIEBZAIHRMPF-FDEJFUCISA-N 2 0 248.345 2.339 20 0 BEADRP COc1cc(C[N@@H+]2CC[C@H](CC[NH3+])C2)ccc1C ZINC000904405798 584878564 /nfs/dbraw/zinc/87/85/64/584878564.db2.gz PTGLIRBYROJIRX-ZDUSSCGKSA-N 2 0 248.370 2.174 20 0 BEADRP C[C@H]1C[N@H+](CC2(C)CCC2)CC[C@H]1C[NH3+] ZINC000904409386 584879312 /nfs/dbraw/zinc/87/93/12/584879312.db2.gz ASWKSAOBKIMVPI-RYUDHWBXSA-N 2 0 210.365 2.093 20 0 BEADRP C(=C/c1ccccc1)\C[N@@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1 ZINC000904420664 584881840 /nfs/dbraw/zinc/88/18/40/584881840.db2.gz DCGNNVGEXMVEBG-YOSLTCIPSA-N 2 0 242.366 2.241 20 0 BEADRP Cc1ccc2c(c1)CC[C@@H]2[NH2+][C@@H](C)[C@H](C)[NH3+] ZINC000817977265 584993289 /nfs/dbraw/zinc/99/32/89/584993289.db2.gz FUSFKGFBVBUEKQ-MJVIPROJSA-N 2 0 218.344 2.308 20 0 BEADRP C[C@H]1CC[C@H]1[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000839165341 585095161 /nfs/dbraw/zinc/09/51/61/585095161.db2.gz NKPGXCDSQLSUQO-GXFFZTMASA-N 2 0 215.300 2.222 20 0 BEADRP C[N@@H+]1CCC[C@@H](CC[NH2+]Cc2ccoc2)C1 ZINC000839182662 585096713 /nfs/dbraw/zinc/09/67/13/585096713.db2.gz OSFKUMMOEXJNSQ-LBPRGKRZSA-N 2 0 222.332 2.101 20 0 BEADRP C[C@H](c1ccccn1)[N@H+](C)CC1CC[NH+](C)CC1 ZINC000750043118 585209712 /nfs/dbraw/zinc/20/97/12/585209712.db2.gz RGPKEAKAXJZLCH-CYBMUJFWSA-N 2 0 247.386 2.416 20 0 BEADRP C[NH+](C)[C@H]1CCCN(Cc2ccoc2)CC1 ZINC000763616966 585451248 /nfs/dbraw/zinc/45/12/48/585451248.db2.gz UGMDUHZQQSPGEC-ZDUSSCGKSA-N 2 0 222.332 2.196 20 0 BEADRP CC[NH+](CC)CCC[N@H+](C)CCCF ZINC000766085626 585497468 /nfs/dbraw/zinc/49/74/68/585497468.db2.gz GIUONRCCWZBNSU-UHFFFAOYSA-N 2 0 204.333 2.010 20 0 BEADRP C[C@H](C1CC1)[N@@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000782182445 585810385 /nfs/dbraw/zinc/81/03/85/585810385.db2.gz HDFFEUIWFGNBND-CHWSQXEVSA-N 2 0 222.376 2.203 20 0 BEADRP CC[N@H+](C)C[C@H]1CC[NH+]([C@@H](C)C2CC2)C1 ZINC000782191547 585811482 /nfs/dbraw/zinc/81/14/82/585811482.db2.gz XAVGKFIIMJSRHD-NWDGAFQWSA-N 2 0 210.365 2.059 20 0 BEADRP [NH3+]CCCCCC[NH2+]Cc1cccc2c1NCC2 ZINC000843127898 586413518 /nfs/dbraw/zinc/41/35/18/586413518.db2.gz RQRMAKVXZRUGGG-UHFFFAOYSA-N 2 0 247.386 2.263 20 0 BEADRP [NH3+]Cc1ccc(-c2cccc3c2CC[NH2+]C3)cc1 ZINC000757212802 586439283 /nfs/dbraw/zinc/43/92/83/586439283.db2.gz JVBOABDYCRVAFG-UHFFFAOYSA-N 2 0 238.334 2.458 20 0 BEADRP CCC(CC)(C[NH2+][C@@H]1CCC[C@@H]1[NH3+])SC ZINC000817898430 586834604 /nfs/dbraw/zinc/83/46/04/586834604.db2.gz FOSMBZCTZRYCNB-WDEREUQCSA-N 2 0 230.421 2.378 20 0 BEADRP C[C@@H]([NH2+]C[C@@H](C)C(C)(C)C)[C@@H]1CCC[NH2+]1 ZINC000817893536 586833599 /nfs/dbraw/zinc/83/35/99/586833599.db2.gz FMSLVYFCBGGEGV-UTUOFQBUSA-N 2 0 212.381 2.399 20 0 BEADRP Cc1cccc(F)c1C[NH2+][C@@H]1CCC[C@@H]1C[NH3+] ZINC000817897156 586835356 /nfs/dbraw/zinc/83/53/56/586835356.db2.gz GJAAPYQWROCPFA-BXUZGUMPSA-N 2 0 236.334 2.351 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CCNc1ccccc1 ZINC000817899092 586836348 /nfs/dbraw/zinc/83/63/48/586836348.db2.gz CQAKVMFWXHIMGL-CYBMUJFWSA-N 2 0 235.375 2.206 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+]CCSC(C)(C)C ZINC000817907648 586836641 /nfs/dbraw/zinc/83/66/41/586836641.db2.gz GZZKDTQVEUNYOX-RYUDHWBXSA-N 2 0 244.448 2.496 20 0 BEADRP Cc1cccc(OCCC[NH2+][C@@H]2CCC[C@H]2[NH3+])c1 ZINC000817907776 586837286 /nfs/dbraw/zinc/83/72/86/586837286.db2.gz WETJPPWQBRKENW-HUUCEWRRSA-N 2 0 248.370 2.233 20 0 BEADRP CC[C@H]([NH2+]CCC1CCC1)[C@@H]1CCC[NH2+]1 ZINC000817907864 586837448 /nfs/dbraw/zinc/83/74/48/586837448.db2.gz XVJXJOFKECRRCK-STQMWFEESA-N 2 0 210.365 2.297 20 0 BEADRP CCOc1cccc([C@@H](C)[NH2+]CC[C@H](C)[NH3+])c1 ZINC000817952141 586848031 /nfs/dbraw/zinc/84/80/31/586848031.db2.gz HYBMXCIHJYFTTE-NWDGAFQWSA-N 2 0 236.359 2.473 20 0 BEADRP CC[C@H]([NH2+]C[C@H](C)C[NH3+])c1ccc2c(c1)CCO2 ZINC000817961987 586852272 /nfs/dbraw/zinc/85/22/72/586852272.db2.gz FTXYJVXFIRQFNX-RISCZKNCSA-N 2 0 248.370 2.257 20 0 BEADRP Cc1cc(F)ccc1[C@H](C)[NH2+]C[C@@H](C)C[NH3+] ZINC000817961619 586852621 /nfs/dbraw/zinc/85/26/21/586852621.db2.gz AZMVEYLYAZMDDD-ONGXEEELSA-N 2 0 224.323 2.380 20 0 BEADRP CCOc1cccc([C@H](C)[NH2+]C[C@H](C)C[NH3+])c1 ZINC000817961828 586852759 /nfs/dbraw/zinc/85/27/59/586852759.db2.gz DHKHZPCIIUSOAO-NEPJUHHUSA-N 2 0 236.359 2.331 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000817968533 586856386 /nfs/dbraw/zinc/85/63/86/586856386.db2.gz LFYQGQWUOMNFFM-AGIUHOORSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)[N@H+](CC1CC[NH+](C)CC1)C1CC1 ZINC000201325328 589082334 /nfs/dbraw/zinc/08/23/34/589082334.db2.gz CLMJSKRUUFXRIZ-UHFFFAOYSA-N 2 0 210.365 2.201 20 0 BEADRP C[C@H]1CC[C@H]1[NH2+]CCCC[N@H+](C)C1CC1 ZINC000834909622 587770340 /nfs/dbraw/zinc/77/03/40/587770340.db2.gz SPQUITOBSMPDLN-WCQYABFASA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H](C[N@@H+]1CC[C@]2(CCC[NH2+]2)C1)C(C)(C)C ZINC000841105337 587946173 /nfs/dbraw/zinc/94/61/73/587946173.db2.gz KIRODYTYJBEPPE-GXTWGEPZSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)(C)[C@H](C[NH3+])NCc1ccc(Cl)cn1 ZINC000842474875 588028798 /nfs/dbraw/zinc/02/87/98/588028798.db2.gz DGWPHWYDLCIUFP-NSHDSACASA-N 2 0 241.766 2.198 20 0 BEADRP C[N@H+](Cc1ccc2c(c1)COC2)CC(C)(C)C[NH3+] ZINC000843056619 588077970 /nfs/dbraw/zinc/07/79/70/588077970.db2.gz SSESEBAITLAEDF-UHFFFAOYSA-N 2 0 248.370 2.134 20 0 BEADRP CC[C@@H]1C[C@@H](C[NH+]2CCC(C)([NH3+])CC2)CCO1 ZINC000843108461 588082226 /nfs/dbraw/zinc/08/22/26/588082226.db2.gz SVVYMMRASSMVMI-QWHCGFSZSA-N 2 0 240.391 2.005 20 0 BEADRP [NH3+]CCCCCC[NH2+]Cc1cccnc1Cl ZINC000843128669 588082596 /nfs/dbraw/zinc/08/25/96/588082596.db2.gz ZIHPIKDSJPWCPO-UHFFFAOYSA-N 2 0 241.766 2.344 20 0 BEADRP C[C@H](CC1CCOCC1)[NH2+]CCCCCC[NH3+] ZINC000843126870 588084186 /nfs/dbraw/zinc/08/41/86/588084186.db2.gz KKUIHSVUHBQVJC-CYBMUJFWSA-N 2 0 242.407 2.300 20 0 BEADRP Cc1cc(C[NH2+][C@@H](C)C[C@H](C)[NH3+])cnc1Cl ZINC000843126841 588084525 /nfs/dbraw/zinc/08/45/25/588084525.db2.gz AGIVVRSEZAEMEJ-UWVGGRQHSA-N 2 0 241.766 2.259 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]Cc1cncc2ccccc21 ZINC000843127989 588084979 /nfs/dbraw/zinc/08/49/79/588084979.db2.gz GRGFQYNYFKDEHF-NEPJUHHUSA-N 2 0 243.354 2.450 20 0 BEADRP C[C@@H]([NH2+]CCCCCC[NH3+])c1ccncc1 ZINC000843340628 588100931 /nfs/dbraw/zinc/10/09/31/588100931.db2.gz CPDBVSOZBJGZLB-GFCCVEGCSA-N 2 0 221.348 2.251 20 0 BEADRP C[C@H]([NH2+]CCCCCC[NH3+])c1ccc(F)cn1 ZINC000843340752 588101210 /nfs/dbraw/zinc/10/12/10/588101210.db2.gz DUZQJHZZIWMKKN-NSHDSACASA-N 2 0 239.338 2.390 20 0 BEADRP [NH3+]CCCCCC[N@H+](C[C@H]1CCOC1)C1CC1 ZINC000846217387 588259819 /nfs/dbraw/zinc/25/98/19/588259819.db2.gz GBNOXWQHEILHDX-CYBMUJFWSA-N 2 0 240.391 2.006 20 0 BEADRP CC1(C)C[N@H+](CCCCCC[NH3+])C(C)(C)CO1 ZINC000846218974 588260828 /nfs/dbraw/zinc/26/08/28/588260828.db2.gz AYHZPLITXZTUBS-UHFFFAOYSA-N 2 0 242.407 2.395 20 0 BEADRP CC(C)C[C@H]1COCC[N@@H+]1CCCCCC[NH3+] ZINC000846217913 588260887 /nfs/dbraw/zinc/26/08/87/588260887.db2.gz INGZJAPYLGKNPK-AWEZNQCLSA-N 2 0 242.407 2.252 20 0 BEADRP CCOC[C@H]1CCC[N@H+](CCCCCC[NH3+])C1 ZINC000846218832 588260982 /nfs/dbraw/zinc/26/09/82/588260982.db2.gz YCKUATSPGYRZRE-AWEZNQCLSA-N 2 0 242.407 2.254 20 0 BEADRP NC[C@@H]([NH2+]CCCCCC[NH3+])C1CCCCC1 ZINC000846221045 588261290 /nfs/dbraw/zinc/26/12/90/588261290.db2.gz RERVLTWNIYRXEE-CQSZACIVSA-N 2 0 241.423 2.003 20 0 BEADRP Cl/C=C/C[NH+]1CCC([C@@H]2CC[NH2+]C2)CC1 ZINC000846220584 588261315 /nfs/dbraw/zinc/26/13/15/588261315.db2.gz LTUAUYCYNUXNHG-ZGTSGANGSA-N 2 0 228.767 2.060 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H]2CC[C@H]2C2CC2)C1 ZINC000848559514 588397018 /nfs/dbraw/zinc/39/70/18/588397018.db2.gz XURQFBOPEALVKX-AHLTXXRQSA-N 2 0 222.376 2.105 20 0 BEADRP [NH3+]CCCCCC[NH2+]Cc1ccc(F)cc1 ZINC000107787197 588405950 /nfs/dbraw/zinc/40/59/50/588405950.db2.gz HQVCMAXVBYDVDY-UHFFFAOYSA-N 2 0 224.323 2.434 20 0 BEADRP Cc1cccc(NC(=[NH2+])NCC[NH+]2CCCC2)c1 ZINC000848982511 588424146 /nfs/dbraw/zinc/42/41/46/588424146.db2.gz RYMVRGKXGBAHFG-UHFFFAOYSA-N 2 0 246.358 2.027 20 0 BEADRP C[C@@H]1CCCN1CC[NH2+][C@@H]1CCCSCC1 ZINC000850439223 588546526 /nfs/dbraw/zinc/54/65/26/588546526.db2.gz MDVOCWRGJOOVPG-CHWSQXEVSA-N 2 0 242.432 2.346 20 0 BEADRP C[C@@H]1CCCN1CC[NH2+][C@H]1CCCSCC1 ZINC000850439224 588546577 /nfs/dbraw/zinc/54/65/77/588546577.db2.gz MDVOCWRGJOOVPG-OLZOCXBDSA-N 2 0 242.432 2.346 20 0 BEADRP C[C@@H](CN1CCC(C)CC1)[NH2+][C@@H]1CC[C@@H]1C ZINC000850544235 588559425 /nfs/dbraw/zinc/55/94/25/588559425.db2.gz UVGKAWASYYKWJB-MELADBBJSA-N 2 0 224.392 2.495 20 0 BEADRP CCC(CC)NC(=[NH2+])NCCC[N@H+](C)C(C)C ZINC000864452597 589365523 /nfs/dbraw/zinc/36/55/23/589365523.db2.gz OJYUOHHRXMRFKI-UHFFFAOYSA-N 2 0 242.411 2.019 20 0 BEADRP CCCC[N@H+](C)CCNC(=[NH2+])NC(CC)CC ZINC000864458832 589368175 /nfs/dbraw/zinc/36/81/75/589368175.db2.gz UHTBWRVNBXAPFP-UHFFFAOYSA-N 2 0 242.411 2.021 20 0 BEADRP C[C@H](CCc1cccnc1)[NH2+][C@H](C)CC[NH+](C)C ZINC000866250217 589482745 /nfs/dbraw/zinc/48/27/45/589482745.db2.gz WOBVRYJPWUCNNM-ZIAGYGMSSA-N 2 0 249.402 2.333 20 0 BEADRP CC(C)[C@](C)(C[NH3+])[NH2+]C[C@@H]1CCC(C)(C)CO1 ZINC000866661823 589508553 /nfs/dbraw/zinc/50/85/53/589508553.db2.gz VOQUJQURKJSYJN-JSGCOSHPSA-N 2 0 242.407 2.155 20 0 BEADRP [NH3+]CC[C@H]1CCC[N@H+](Cc2coc(C3CC3)n2)C1 ZINC000866665702 589509613 /nfs/dbraw/zinc/50/96/13/589509613.db2.gz ZLZKIEMWXZWDGC-LLVKDONJSA-N 2 0 249.358 2.113 20 0 BEADRP N[C@@H]1CCCCC[N@H+](CCCCCCC[NH3+])C1 ZINC000866671696 589510825 /nfs/dbraw/zinc/51/08/25/589510825.db2.gz YLVZRVORNFAXNO-CQSZACIVSA-N 2 0 241.423 2.099 20 0 BEADRP CC(C)C[N@@H+]1CC[C@](C[NH3+])(C(C)(C)C)C1 ZINC000866704181 589513656 /nfs/dbraw/zinc/51/36/56/589513656.db2.gz RNGXSVWXLVRMTO-CYBMUJFWSA-N 2 0 212.381 2.339 20 0 BEADRP CC[C@H]1C[N@H+](CCc2cccs2)CC[C@@H]1[NH3+] ZINC000122883060 589642613 /nfs/dbraw/zinc/64/26/13/589642613.db2.gz BYLXOVIVYIJYOQ-AAEUAGOBSA-N 2 0 238.400 2.350 20 0 BEADRP C[NH2+]CCC[N@@H+]1CC[C@]2(CCc3ccccc32)C1 ZINC000872146127 589884978 /nfs/dbraw/zinc/88/49/78/589884978.db2.gz GIIVXRYRJAOJME-MRXNPFEDSA-N 2 0 244.382 2.186 20 0 BEADRP C[C@]12C[NH2+]C[C@H]1C[N@H+](CCCC1CCCC1)C2 ZINC000872153345 589885329 /nfs/dbraw/zinc/88/53/29/589885329.db2.gz JTHAIHNWOZXHPP-LSDHHAIUSA-N 2 0 236.403 2.498 20 0 BEADRP Cc1cnc([C@@H](C)[N@H+](C)CCCCCC[NH3+])o1 ZINC000872155869 589886206 /nfs/dbraw/zinc/88/62/06/589886206.db2.gz ZDKYURBYFHJREK-GFCCVEGCSA-N 2 0 239.363 2.495 20 0 BEADRP CCc1nocc1C[N@H+](C)CCCCCC[NH3+] ZINC000872155843 589886416 /nfs/dbraw/zinc/88/64/16/589886416.db2.gz YCWTWHZRMDWVQI-UHFFFAOYSA-N 2 0 239.363 2.188 20 0 BEADRP CC[NH+](CC)CC[NH+]=c1cc[nH]cc1C1CC1 ZINC000872386554 589930013 /nfs/dbraw/zinc/93/00/13/589930013.db2.gz QYBUSOKVWSPTIG-UHFFFAOYSA-N 2 0 233.359 2.135 20 0 BEADRP [NH3+][C@@H]1C[C@H]1c1ccc(N[C@H]2CCC[NH2+]CC2)cc1 ZINC000873216808 589997922 /nfs/dbraw/zinc/99/79/22/589997922.db2.gz YGXHVWWFDXENJQ-AEGPPILISA-N 2 0 245.370 2.055 20 0 BEADRP CC(C)CCC[NH2+][C@]12CCC[C@@H]1[NH2+]CC2 ZINC000873232101 590000731 /nfs/dbraw/zinc/00/07/31/590000731.db2.gz VPRRIYWRAVNXPP-STQMWFEESA-N 2 0 210.365 2.297 20 0 BEADRP CCC[C@@H](C)C[NH2+]C1(CCOC)CC[NH2+]CC1 ZINC000873225425 590000937 /nfs/dbraw/zinc/00/09/37/590000937.db2.gz YGQPAWIWAVDQPU-CYBMUJFWSA-N 2 0 242.407 2.171 20 0 BEADRP CCC(CC)C[NH2+][C@]12CCC[C@H]1[NH2+]CC2 ZINC000873229811 590001670 /nfs/dbraw/zinc/00/16/70/590001670.db2.gz GJORUKXVMMZFSP-OLZOCXBDSA-N 2 0 210.365 2.297 20 0 BEADRP CCC[C@H](C)C[NH2+][C@@]12CCC[C@H]1[NH2+]CC2 ZINC000873229725 590001904 /nfs/dbraw/zinc/00/19/04/590001904.db2.gz FDZYGZAJVWAQML-YNEHKIRRSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]CC[C@@H]1CCSC1 ZINC000873235974 590003715 /nfs/dbraw/zinc/00/37/15/590003715.db2.gz SBSDUSMOFMYDFZ-UPJWGTAASA-N 2 0 242.432 2.107 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CCSC1)[C@@H]1CCCC[NH2+]1 ZINC000873236290 590004178 /nfs/dbraw/zinc/00/41/78/590004178.db2.gz VKZNJWIWFXPVHS-AGIUHOORSA-N 2 0 242.432 2.250 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CCSC1)[C@@H]1CCCC[NH2+]1 ZINC000873236293 590004599 /nfs/dbraw/zinc/00/45/99/590004599.db2.gz VKZNJWIWFXPVHS-UPJWGTAASA-N 2 0 242.432 2.250 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+][C@@H]1CCCC[C@@H]1F ZINC000873239401 590005006 /nfs/dbraw/zinc/00/50/06/590005006.db2.gz VLUIETFLJUKJDQ-MROQNXINSA-N 2 0 228.355 2.245 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+][C@@H]1CCCC[C@@H]1F ZINC000873239403 590005989 /nfs/dbraw/zinc/00/59/89/590005989.db2.gz VLUIETFLJUKJDQ-YVECIDJPSA-N 2 0 228.355 2.245 20 0 BEADRP CC[C@H]([NH2+]CC[C@@H]1CCCS1)[C@@H]1CCC[NH2+]1 ZINC000873243869 590006297 /nfs/dbraw/zinc/00/62/97/590006297.db2.gz NXDCQTOCYGCLCA-AVGNSLFASA-N 2 0 242.432 2.392 20 0 BEADRP CC[C@@H]([NH2+]CC[C@H]1CCCS1)[C@@H]1CCC[NH2+]1 ZINC000873243871 590007056 /nfs/dbraw/zinc/00/70/56/590007056.db2.gz NXDCQTOCYGCLCA-UPJWGTAASA-N 2 0 242.432 2.392 20 0 BEADRP CC(C)(C[NH2+][C@H]1CCC[C@@H]1[NH3+])C(C)(F)F ZINC000873250699 590008120 /nfs/dbraw/zinc/00/81/20/590008120.db2.gz GXUKGUPRXWWJJB-IUCAKERBSA-N 2 0 220.307 2.137 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CC(C)(C)C(C)(F)F ZINC000873251033 590008350 /nfs/dbraw/zinc/00/83/50/590008350.db2.gz IAYTZBGAEIGCFJ-RKDXNWHRSA-N 2 0 222.323 2.383 20 0 BEADRP CC(C)[C@H]1CCC[C@H]1[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873253023 590008968 /nfs/dbraw/zinc/00/89/68/590008968.db2.gz XRBMTWWQDZWWDO-YVECIDJPSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H]1Cc2ccccc2[C@H]1[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873252832 590009069 /nfs/dbraw/zinc/00/90/69/590009069.db2.gz WEYSDJGPSPHSIF-ZSEWYUTFSA-N 2 0 230.355 2.247 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1cc(F)cc(F)c1 ZINC000873253758 590009308 /nfs/dbraw/zinc/00/93/08/590009308.db2.gz DOKOURWWYDXKNF-KKFJDGPESA-N 2 0 240.297 2.353 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@@H]2CCCOc3ccccc32)C1 ZINC000873254209 590009461 /nfs/dbraw/zinc/00/94/61/590009461.db2.gz NFURSPRREYRLMV-MBNYWOFBSA-N 2 0 246.354 2.227 20 0 BEADRP Cc1ccc2c(c1)CC[C@@H]2[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873253826 590009687 /nfs/dbraw/zinc/00/96/87/590009687.db2.gz FRWXMRMVQJOLMK-LNSITVRQSA-N 2 0 230.355 2.309 20 0 BEADRP CC[C@H]1CCC[C@H]([NH2+]C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000873254275 590009863 /nfs/dbraw/zinc/00/98/63/590009863.db2.gz PDOFKFPQWFHYQJ-RVMXOQNASA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccnc(Cl)c1 ZINC000873254338 590009878 /nfs/dbraw/zinc/00/98/78/590009878.db2.gz QXJMVJGMHMQSNP-KKZNHRDASA-N 2 0 239.750 2.123 20 0 BEADRP COc1ccc2c(c1)[C@@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)CC2 ZINC000873254501 590010095 /nfs/dbraw/zinc/01/00/95/590010095.db2.gz VKQMSSYDFGHENY-NVBFEUDRSA-N 2 0 246.354 2.009 20 0 BEADRP C[C@@H]1CCC[C@H](C)[C@H]1[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873254496 590010150 /nfs/dbraw/zinc/01/01/50/590010150.db2.gz VJFLHOHBCCGIHJ-CXYFJQCHSA-N 2 0 210.365 2.138 20 0 BEADRP COc1ccc(C)cc1[C@H](C)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873255293 590010232 /nfs/dbraw/zinc/01/02/32/590010232.db2.gz FJVQFZLQWAUZBO-RWMBFGLXSA-N 2 0 248.370 2.392 20 0 BEADRP Cc1cc([C@@H](C)[NH2+]C[C@H]2C[C@H]([NH3+])C2)cs1 ZINC000873255362 590010673 /nfs/dbraw/zinc/01/06/73/590010673.db2.gz GXTISEWEPPEWHN-CKYFFXLPSA-N 2 0 224.373 2.444 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccccc1 ZINC000873256453 590011496 /nfs/dbraw/zinc/01/14/96/590011496.db2.gz OAJRSNPMTWZTHI-WZRBSPASSA-N 2 0 204.317 2.075 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+][C@H]2CCC[C@H](C3CC3)C2)C1 ZINC000873256302 590011588 /nfs/dbraw/zinc/01/15/88/590011588.db2.gz MZTNMQSFCSGLDH-PYJNHQTQSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)C1C(C)(C)C1(C)C ZINC000873257255 590011626 /nfs/dbraw/zinc/01/16/26/590011626.db2.gz RQVOTLGSLGEAKX-DCAQKATOSA-N 2 0 224.392 2.384 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+][C@H]2CCCOc3ccccc32)C1 ZINC000873256308 590011807 /nfs/dbraw/zinc/01/18/07/590011807.db2.gz NFURSPRREYRLMV-OBJOEFQTSA-N 2 0 246.354 2.227 20 0 BEADRP C[C@@H](CCc1ccccc1)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873256856 590011868 /nfs/dbraw/zinc/01/18/68/590011868.db2.gz QLNDHQJVCXOXDM-AEGPPILISA-N 2 0 232.371 2.335 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+][C@@H]2CCC[C@H]2CCCF)C1 ZINC000873259021 590013149 /nfs/dbraw/zinc/01/31/49/590013149.db2.gz XNIYCGRFIGVLMD-ZDEQEGDKSA-N 2 0 228.355 2.232 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1ccccc1 ZINC000873258328 590013096 /nfs/dbraw/zinc/01/30/96/590013096.db2.gz OAJRSNPMTWZTHI-NQBHXWOUSA-N 2 0 204.317 2.075 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1cccs1 ZINC000873258761 590013128 /nfs/dbraw/zinc/01/31/28/590013128.db2.gz UKIVWNPORSWYKJ-GUBZILKMSA-N 2 0 210.346 2.136 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000873259498 590013364 /nfs/dbraw/zinc/01/33/64/590013364.db2.gz GASVNUKGRFYZFQ-DEQVHRJGSA-N 2 0 222.376 2.295 20 0 BEADRP Cc1ccsc1[C@@H](C)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873259171 590013643 /nfs/dbraw/zinc/01/36/43/590013643.db2.gz YNPUKRBPBGDTCQ-GMTAPVOTSA-N 2 0 224.373 2.444 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000873262516 590013952 /nfs/dbraw/zinc/01/39/52/590013952.db2.gz ZPPOFKNHWQFZDN-RNJOBUHISA-N 2 0 222.376 2.295 20 0 BEADRP CC[C@H]1CC[C@H]1[NH2+][C@H](C)C1CC[NH2+]CC1 ZINC000873269518 590015760 /nfs/dbraw/zinc/01/57/60/590015760.db2.gz QUMXYHLBELIVNK-NTZNESFSSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+][C@@H](C)C1CC[NH2+]CC1 ZINC000873271523 590016363 /nfs/dbraw/zinc/01/63/63/590016363.db2.gz IZBGYNPVXJIYDI-FPMFFAJLSA-N 2 0 224.392 2.399 20 0 BEADRP CC[C@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)[C@@H]1C[C@H]1C ZINC000873273165 590017042 /nfs/dbraw/zinc/01/70/42/590017042.db2.gz YRHGFCWHUWIQHL-WVWOOGAGSA-N 2 0 224.392 2.399 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+]CCC[C@@H]1C=CCC1 ZINC000873280915 590018271 /nfs/dbraw/zinc/01/82/71/590018271.db2.gz FAHNCRAAJKCKMZ-ZIAGYGMSSA-N 2 0 240.391 2.076 20 0 BEADRP C([C@@H]1CCC[NH2+]C1)[NH+]1CCCCCCC1 ZINC000020266244 590093545 /nfs/dbraw/zinc/09/35/45/590093545.db2.gz LDPSEVMDESXUQV-CYBMUJFWSA-N 2 0 210.365 2.252 20 0 BEADRP CC[C@H](C)[C@@H](C[NH2+]C[C@@H]1CCCN1CC)OC ZINC000876882028 590252766 /nfs/dbraw/zinc/25/27/66/590252766.db2.gz XPVXHUXSDOATPF-MELADBBJSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H](CC(F)(F)F)[NH2+]CC1CC[NH+](C)CC1 ZINC000126388086 590296923 /nfs/dbraw/zinc/29/69/23/590296923.db2.gz RYINUUAHMWRNLL-VIFPVBQESA-N 2 0 238.297 2.259 20 0 BEADRP C[N@@H+]1CC[C@H]2C[NH+](CCc3ccccc3)CC[C@@H]21 ZINC000877743493 590410729 /nfs/dbraw/zinc/41/07/29/590410729.db2.gz WJSQAVRBSNHSPY-HOTGVXAUSA-N 2 0 244.382 2.255 20 0 BEADRP C=C/C=C/CC[NH+]1CCC([NH+](C)C)CC1 ZINC000877958705 590458388 /nfs/dbraw/zinc/45/83/88/590458388.db2.gz DLHJIGGVVWWXGY-AATRIKPKSA-N 2 0 208.349 2.145 20 0 BEADRP C[N@@H+]1CC[C@@]2(CC[NH+](CCCC3CC3)C2)C1 ZINC000878644672 590600532 /nfs/dbraw/zinc/60/05/32/590600532.db2.gz AYMYPEJUQIKCIY-CQSZACIVSA-N 2 0 222.376 2.204 20 0 BEADRP C[N@@H+]1CC[C@]2(CC[NH+](CCCC3CC3)C2)C1 ZINC000878644671 590600811 /nfs/dbraw/zinc/60/08/11/590600811.db2.gz AYMYPEJUQIKCIY-AWEZNQCLSA-N 2 0 222.376 2.204 20 0 BEADRP C[NH+]1CCC2(CC1)CC[NH+](CCCF)CC2 ZINC000879249620 590721246 /nfs/dbraw/zinc/72/12/46/590721246.db2.gz WTZXOBIZBONIDW-UHFFFAOYSA-N 2 0 228.355 2.154 20 0 BEADRP CC(C)C[N@H+](CCF)CC1CC[NH+](C)CC1 ZINC000879704837 590852859 /nfs/dbraw/zinc/85/28/59/590852859.db2.gz VHIZCTGWXKBPIF-UHFFFAOYSA-N 2 0 230.371 2.256 20 0 BEADRP CCCC[N@@H+]1CCN(c2cc[nH+]cc2)[C@@H](C)C1 ZINC000880262605 590980833 /nfs/dbraw/zinc/98/08/33/590980833.db2.gz QELUMYRJUPIPRU-ZDUSSCGKSA-N 2 0 233.359 2.392 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CCN(c2cc[nH+]cc2)[C@@H](C)C1 ZINC000880259549 590980971 /nfs/dbraw/zinc/98/09/71/590980971.db2.gz WAPLJJHDWAPPTG-HZSPNIEDSA-N 2 0 245.370 2.248 20 0 BEADRP C[N@@H+]1CCCC[C@H]1CC[NH+]1CC[C@@H](CF)C1 ZINC000880295315 590988884 /nfs/dbraw/zinc/98/88/84/590988884.db2.gz JWBVFNTVTPONEU-STQMWFEESA-N 2 0 228.355 2.152 20 0 BEADRP C[C@H]1C[C@H]1C[NH+]1CCC(C)([NH+]2CCC2)CC1 ZINC000880476119 591053592 /nfs/dbraw/zinc/05/35/92/591053592.db2.gz NTMHJIDGNQOVOG-STQMWFEESA-N 2 0 222.376 2.203 20 0 BEADRP c1ccc2c(c1)CC[C@H]([NH2+][C@H]1CCC[NH2+]CC1)C2 ZINC000129220782 591269947 /nfs/dbraw/zinc/26/99/47/591269947.db2.gz AESJTXFICXVWMF-HOTGVXAUSA-N 2 0 244.382 2.276 20 0 BEADRP C1=C[C@H](C[NH2+]C2CC[NH+](CC3CC3)CC2)CC1 ZINC000883246401 591587268 /nfs/dbraw/zinc/58/72/68/591587268.db2.gz HWZLPCBQTOZRQS-ZDUSSCGKSA-N 2 0 234.387 2.417 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]C[C@H]2C=CCC2)[C@H](C)C1 ZINC000883247013 591588215 /nfs/dbraw/zinc/58/82/15/591588215.db2.gz XHBYMRZJMNKGCK-RDBSUJKOSA-N 2 0 222.376 2.273 20 0 BEADRP C=C/C=C/CC[NH2+][C@@H]1CC[N@@H+](CC)C[C@H]1C ZINC000883267772 591601274 /nfs/dbraw/zinc/60/12/74/591601274.db2.gz POWNVQCDJDBCPQ-JLVOYYQZSA-N 2 0 222.376 2.439 20 0 BEADRP CCN1CC[C@H]1C[NH2+]C1CC(OC(C)(C)C)C1 ZINC000883355071 591626669 /nfs/dbraw/zinc/62/66/69/591626669.db2.gz IJYPPHIFSIRBDP-CPCZMJQVSA-N 2 0 240.391 2.016 20 0 BEADRP FC1(F)CCC[C@H]1CCN1CCC[NH2+]CC1 ZINC000883415502 591652483 /nfs/dbraw/zinc/65/24/83/591652483.db2.gz WYXQEFBFPDGBNG-NSHDSACASA-N 2 0 232.318 2.107 20 0 BEADRP [NH3+]C[C@@H]1CC[N@H+](CC[C@H]2CCCC2(F)F)C1 ZINC000883417171 591652607 /nfs/dbraw/zinc/65/26/07/591652607.db2.gz PUBFCCGRABVPQD-WDEREUQCSA-N 2 0 232.318 2.093 20 0 BEADRP C=C/C=C\CC[N@H+](C1CC1)C1CC[NH2+]CC1 ZINC000883415763 591653143 /nfs/dbraw/zinc/65/31/43/591653143.db2.gz DMPPJOIDAIIIDZ-ARJAWSKDSA-N 2 0 220.360 2.335 20 0 BEADRP C[N@H+](CC[C@H]1CCCC1(F)F)C1CC[NH2+]CC1 ZINC000883416132 591653278 /nfs/dbraw/zinc/65/32/78/591653278.db2.gz MMEKMQOXZAHTHW-LLVKDONJSA-N 2 0 246.345 2.496 20 0 BEADRP C[NH2+]C[C@H]1CCCN1CC[C@@H]1CCCC1(F)F ZINC000883418133 591654807 /nfs/dbraw/zinc/65/48/07/591654807.db2.gz YOLZRQINHATEOF-NWDGAFQWSA-N 2 0 246.345 2.496 20 0 BEADRP C[C@H]1c2ccccc2CCN1C[C@@H]1C[C@H](F)C[NH2+]1 ZINC000883421081 591655392 /nfs/dbraw/zinc/65/53/92/591655392.db2.gz BCFXUYOYPLKPSG-UBHSHLNASA-N 2 0 248.345 2.306 20 0 BEADRP C=C/C=C\CC[NH2+][C@@H]1[C@H](C)CCN[C@H]1C ZINC000883429636 591660540 /nfs/dbraw/zinc/66/05/40/591660540.db2.gz AORYCBUOGPINEW-BDTQGIJQSA-N 2 0 208.349 2.095 20 0 BEADRP C[C@H]1[C@@H]([NH3+])CCN1CC[C@@H]1CCCC1(F)F ZINC000883430658 591661825 /nfs/dbraw/zinc/66/18/25/591661825.db2.gz ZRMNKQRMHTWWNL-DCAQKATOSA-N 2 0 232.318 2.233 20 0 BEADRP CC1(C)Nc2ccccc2[C@@H]1[NH2+]C[C@@H]1CC[NH2+]C1 ZINC000883462428 591673768 /nfs/dbraw/zinc/67/37/68/591673768.db2.gz QUBSCWDFJXUSDC-RISCZKNCSA-N 2 0 245.370 2.131 20 0 BEADRP COCCCCC[N@@H+]1CC[NH2+]CCC12CCC2 ZINC000883458629 591674390 /nfs/dbraw/zinc/67/43/90/591674390.db2.gz QVALEBDDEYFOAG-UHFFFAOYSA-N 2 0 240.391 2.021 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]CC2CCOCC2)c2ccccc21 ZINC000132111840 591687413 /nfs/dbraw/zinc/68/74/13/591687413.db2.gz VHXCYVVKDQKBIP-CABCVRRESA-N 2 0 246.354 2.147 20 0 BEADRP CC[C@H]1C[N@H+](CCCCCC[NH3+])CCS1 ZINC000133055971 591761545 /nfs/dbraw/zinc/76/15/45/591761545.db2.gz FBQIGRVPGNITEO-LBPRGKRZSA-N 2 0 230.421 2.333 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+]Cc2ccc(CC[NH3+])cc2)C1 ZINC000133101600 591764624 /nfs/dbraw/zinc/76/46/24/591764624.db2.gz YRECSQCWAXJVOH-SWLSCSKDSA-N 2 0 232.371 2.466 20 0 BEADRP Cc1ccc(F)cc1C[NH2+]C1CCC([NH3+])CC1 ZINC000220817906 592355473 /nfs/dbraw/zinc/35/54/73/592355473.db2.gz AQGBPMKPTDCJDZ-UHFFFAOYSA-N 2 0 236.334 2.494 20 0 BEADRP [NH3+]CCCCCC[N@@H+]1CC[C@@H]([C@@H]2CCCO2)C1 ZINC000886860271 592369838 /nfs/dbraw/zinc/36/98/38/592369838.db2.gz YGXJYBMBYVNFSB-KGLIPLIRSA-N 2 0 240.391 2.006 20 0 BEADRP C[C@@H]1CC[N@H+](CCOCC[NH3+])[C@H]1c1ccccc1 ZINC000886858262 592370752 /nfs/dbraw/zinc/37/07/52/592370752.db2.gz UAJGODNDOHIWCP-UKRRQHHQSA-N 2 0 248.370 2.045 20 0 BEADRP CC(C)CC[N@@H+]1CCCC[C@]2(CC[NH2+]C2)C1 ZINC000886865163 592373302 /nfs/dbraw/zinc/37/33/02/592373302.db2.gz BZWYFOLTVDSAKE-CQSZACIVSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CCCC[C@@]2(CC[NH2+]C2)C1 ZINC000886873926 592377112 /nfs/dbraw/zinc/37/71/12/592377112.db2.gz BOFYTCMINVOAHK-MCIONIFRSA-N 2 0 222.376 2.108 20 0 BEADRP CC[C@@H](C)[N@@H+]1CCN(c2cc[nH+]cc2)C[C@H]1C ZINC000887134911 592448392 /nfs/dbraw/zinc/44/83/92/592448392.db2.gz SGHDYNFTKFLCNZ-CHWSQXEVSA-N 2 0 233.359 2.391 20 0 BEADRP CCC[N@@H+]1CCN(c2cc[nH+]cc2)C[C@@H]1C ZINC000887130510 592448493 /nfs/dbraw/zinc/44/84/93/592448493.db2.gz FRQWYKDCZUTZCX-LBPRGKRZSA-N 2 0 219.332 2.002 20 0 BEADRP C[C@H]1CN(c2cc[nH+]cc2)CC[N@@H+]1CC1CC1 ZINC000887132917 592448955 /nfs/dbraw/zinc/44/89/55/592448955.db2.gz QAVYXJWFYXUYSB-LBPRGKRZSA-N 2 0 231.343 2.002 20 0 BEADRP CC(C)(C)C[C@@H]1C[C@H]1[NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32 ZINC000925707216 634393630 /nfs/dbraw/zinc/39/36/30/634393630.db2.gz DIAIGJYQCIYTGS-UWGWRVQFSA-N 2 0 248.414 2.397 20 0 BEADRP CC(C)(C)C[C@@H]1C[C@H]1[NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2 ZINC000925707213 634393169 /nfs/dbraw/zinc/39/31/69/634393169.db2.gz DIAIGJYQCIYTGS-CNBXDPTCSA-N 2 0 248.414 2.397 20 0 BEADRP C[C@@H]1SCC[C@@H]1[NH2+][C@@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925713024 634417386 /nfs/dbraw/zinc/41/73/86/634417386.db2.gz RKWYQTZEAOKJIF-QCNOEVLYSA-N 2 0 242.432 2.376 20 0 BEADRP CC1CC(C[NH2+][C@@H]2CC[NH2+]C23CCCC3)C1 ZINC000925720707 634458004 /nfs/dbraw/zinc/45/80/04/634458004.db2.gz HRHSSTQXGMIFOK-WXRRBKDZSA-N 2 0 222.376 2.297 20 0 BEADRP FC1(F)C[C@H]1CC[NH2+][C@H]1CC[NH2+]C12CCCC2 ZINC000925720353 634458080 /nfs/dbraw/zinc/45/80/80/634458080.db2.gz GSDXWTZRKSBVKE-MNOVXSKESA-N 2 0 244.329 2.296 20 0 BEADRP C/C=C\C[NH2+][C@@H]1CC[NH2+]C[C@H]1C1CCCC1 ZINC000925720121 634459163 /nfs/dbraw/zinc/45/91/63/634459163.db2.gz WPZIOCUAPOHMQF-KUHFFWNOSA-N 2 0 222.376 2.320 20 0 BEADRP Cc1ccc(C[NH2+]CC2CC[NH+](C)CC2)nc1C ZINC000313815597 634525561 /nfs/dbraw/zinc/52/55/61/634525561.db2.gz BUTCPZXJPRJQAD-UHFFFAOYSA-N 2 0 247.386 2.130 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H]1CCc2ccccc2OC1 ZINC000423103985 634549326 /nfs/dbraw/zinc/54/93/26/634549326.db2.gz BDHJCMVRKLPVLP-SGMGOOAPSA-N 2 0 248.370 2.096 20 0 BEADRP C1=C[C@H](CCC[NH2+][C@@H]2[C@H]3C[C@H]4C[NH2+][C@H]2[C@H]4C3)CC1 ZINC000925730802 634560048 /nfs/dbraw/zinc/56/00/48/634560048.db2.gz QBYDEKCFBNKQNS-SBOZNWLOSA-N 2 0 246.398 2.319 20 0 BEADRP [NH3+]CC[C@H]1CC[N@H+](Cc2cc(F)ccc2F)C1 ZINC000125577372 634565476 /nfs/dbraw/zinc/56/54/76/634565476.db2.gz AJZCAGQMIPGRKK-JTQLQIEISA-N 2 0 240.297 2.136 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]C[C@H]1C=CCC1 ZINC000925731710 634568436 /nfs/dbraw/zinc/56/84/36/634568436.db2.gz MQAWBONWGRTIQX-AAEUAGOBSA-N 2 0 245.370 2.466 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+]CC1(CC2CC2)CC1 ZINC000925734813 634584456 /nfs/dbraw/zinc/58/44/56/634584456.db2.gz VEJJPIYVOZNYJT-LBPRGKRZSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+]CC1(C)CC(F)(F)C1 ZINC000925734728 634585588 /nfs/dbraw/zinc/58/55/88/634585588.db2.gz UHWUBWSEHUHDJB-QWRGUYRKSA-N 2 0 246.345 2.400 20 0 BEADRP FC1(F)CC[NH2+]C[C@@H]1C[NH2+][C@H]1CC[C@H]1C1CC1 ZINC000925778187 635265952 /nfs/dbraw/zinc/26/59/52/635265952.db2.gz RWNCMSKWMMCJRZ-WOPDTQHZSA-N 2 0 244.329 2.009 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CC[NH2+]C23CCC3)CCS1 ZINC000925857694 635548779 /nfs/dbraw/zinc/54/87/79/635548779.db2.gz HWDBZXXVPOCKLH-UTUOFQBUSA-N 2 0 240.416 2.145 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCS[C@H](C)C1)[C@@H]1CCCC[NH2+]1 ZINC000925861588 635556108 /nfs/dbraw/zinc/55/61/08/635556108.db2.gz QJQXRVLDKSDYJN-NDBYEHHHSA-N 2 0 242.432 2.391 20 0 BEADRP C[C@H]([NH2+][C@H]1CCS[C@H](C)C1)[C@@H]1CCCC[NH2+]1 ZINC000925861589 635556697 /nfs/dbraw/zinc/55/66/97/635556697.db2.gz QJQXRVLDKSDYJN-VOAKCMCISA-N 2 0 242.432 2.391 20 0 BEADRP CC[C@H]([NH2+]C[C@@H](COC)C(C)C)[C@@H]1CCC[NH2+]1 ZINC000925874935 635596330 /nfs/dbraw/zinc/59/63/30/635596330.db2.gz XPNMCEPOFMBRRC-IHRRRGAJSA-N 2 0 242.407 2.025 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[NH2+][C@H]2CCCc3cccnc32)C1 ZINC000925881161 635607510 /nfs/dbraw/zinc/60/75/10/635607510.db2.gz YHKRHOFPHGEOKA-YUTCNCBUSA-N 2 0 245.370 2.176 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]CC1CCC=CCC1 ZINC000925882140 635610150 /nfs/dbraw/zinc/61/01/50/635610150.db2.gz XOPSCLFYSLDVBU-KBPBESRZSA-N 2 0 222.376 2.450 20 0 BEADRP Cc1ncc([C@H](C)[NH2+]C[C@@H]2CC[C@H]([NH3+])C2)s1 ZINC000925883328 635610989 /nfs/dbraw/zinc/61/09/89/635610989.db2.gz VEOPVNARZIJEOB-GDPRMGEGSA-N 2 0 239.388 2.230 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+]C[C@@H]1CC1(Cl)Cl ZINC000308695395 631356089 /nfs/dbraw/zinc/35/60/89/631356089.db2.gz STNFAOWEDDQDMB-BDAKNGLRSA-N 2 0 239.190 2.110 20 0 BEADRP CC(C)[C@H]1CCC[N@@H+]1CC1CC[NH+](C)CC1 ZINC000891618376 631411045 /nfs/dbraw/zinc/41/10/45/631411045.db2.gz PUTXQXVVTGSQIA-CQSZACIVSA-N 2 0 224.392 2.449 20 0 BEADRP CCC(C)(C)OCC[NH2+]CC1CC[NH+](C)CC1 ZINC000308552487 631422190 /nfs/dbraw/zinc/42/21/90/631422190.db2.gz ZWIKSKMAZLDLBX-UHFFFAOYSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@@H]1C[N@@H+](CC2CC[NH+](C)CC2)C[C@H](C)S1 ZINC000891822067 631504987 /nfs/dbraw/zinc/50/49/87/631504987.db2.gz KZLMZSQMPRRMSC-TXEJJXNPSA-N 2 0 242.432 2.154 20 0 BEADRP C[C@@H](C[NH2+]C[C@@H]1CCC=CO1)C[NH+]1CCCC1 ZINC000062078927 631646447 /nfs/dbraw/zinc/64/64/47/631646447.db2.gz FYJRGXBPNXZONH-KBPBESRZSA-N 2 0 238.375 2.001 20 0 BEADRP CC(C)(C[NH2+]CC1([NH3+])CC1)c1ccccc1 ZINC000259185412 631785919 /nfs/dbraw/zinc/78/59/19/631785919.db2.gz VIBYVSJKEZNHJM-UHFFFAOYSA-N 2 0 218.344 2.045 20 0 BEADRP C[C@@H]1CC[C@H]1[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000309033010 631805817 /nfs/dbraw/zinc/80/58/17/631805817.db2.gz CVRCDGXCERIIBY-VXGBXAGGSA-N 2 0 210.365 2.106 20 0 BEADRP CSC1(C[NH2+][C@H]2CCCC[C@@H]2C[NH3+])CCC1 ZINC000235116023 631961371 /nfs/dbraw/zinc/96/13/71/631961371.db2.gz JRPPMSVVLUEXAI-NEPJUHHUSA-N 2 0 242.432 2.379 20 0 BEADRP CC[C@@H]1CCC[N@H+](CC[C@@H]2CCC[NH2+]C2)C1 ZINC000051919035 632011896 /nfs/dbraw/zinc/01/18/96/632011896.db2.gz XKEBKRCVTQBFQV-KGLIPLIRSA-N 2 0 224.392 2.498 20 0 BEADRP CCCCCC[N@@H+]1CC[C@@]2(CC[NH2+]C2)C1 ZINC000308890424 632093614 /nfs/dbraw/zinc/09/36/14/632093614.db2.gz XWVIZZMDRKBCKP-CYBMUJFWSA-N 2 0 210.365 2.252 20 0 BEADRP C[C@@H]1CCC[C@H](C[N@@H+]2CC[C@H](CC[NH3+])C2)C1 ZINC000309480283 632416800 /nfs/dbraw/zinc/41/68/00/632416800.db2.gz WNQIBEFJYSKGLK-RDBSUJKOSA-N 2 0 224.392 2.483 20 0 BEADRP C[C@]1(C[NH2+][C@H]2CCCC[C@H]2C[NH3+])CCCS1 ZINC000250783807 632545787 /nfs/dbraw/zinc/54/57/87/632545787.db2.gz FEZGHORLLIHIMT-RWMBFGLXSA-N 2 0 242.432 2.379 20 0 BEADRP C[C@H](C1CC1)[N@H+](C)C[C@@]1(C)CCC[NH2+]C1 ZINC000219754930 632564125 /nfs/dbraw/zinc/56/41/25/632564125.db2.gz NRYXWBRWGQJGMK-YPMHNXCESA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@]1(C[NH3+])CC[N@H+](Cc2ccc3c(c2)CCC3)C1 ZINC000235416090 632704794 /nfs/dbraw/zinc/70/47/94/632704794.db2.gz FIPXVRBDYOSUNV-INIZCTEOSA-N 2 0 244.382 2.346 20 0 BEADRP C[N@H+]1C[C@H]2CC[C@@H](C1)C2[NH2+]Cc1ccccc1F ZINC000924549919 632812112 /nfs/dbraw/zinc/81/21/12/632812112.db2.gz GBDZWSXWNXGYGG-NNQSOWQGSA-N 2 0 248.345 2.256 20 0 BEADRP C[C@H]1CC[N@H+](CCc2cccs2)C[C@@H]1C[NH3+] ZINC000167664665 633130889 /nfs/dbraw/zinc/13/08/89/633130889.db2.gz YXIKOPUIGYRLET-RYUDHWBXSA-N 2 0 238.400 2.207 20 0 BEADRP CC(C)[C@@H]1C[C@H]1C[NH2+]CC1CC[NH+](C)CC1 ZINC000894741683 635919203 /nfs/dbraw/zinc/91/92/03/635919203.db2.gz JTIVWUNLAMSTCR-KBPBESRZSA-N 2 0 224.392 2.210 20 0 BEADRP Cc1ccc(C[C@@H](C)[NH2+]C2CC[NH2+]CC2)s1 ZINC000070716126 636028522 /nfs/dbraw/zinc/02/85/22/636028522.db2.gz XZEGZEZOLFNFEG-SNVBAGLBSA-N 2 0 238.400 2.329 20 0 BEADRP C[N@@H+]1CC[C@]2(CC[NH+](CC3(C)CCC3)C2)C1 ZINC000334907633 636068713 /nfs/dbraw/zinc/06/87/13/636068713.db2.gz SPXRQZVKAWNHIX-AWEZNQCLSA-N 2 0 222.376 2.204 20 0 BEADRP CCC(C)(C)C[NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2 ZINC000328460802 633764702 /nfs/dbraw/zinc/76/47/02/633764702.db2.gz UNMIBZFSQFCIHR-NWBUJAPZSA-N 2 0 222.376 2.009 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@H]2[C@@H]3[NH2+]C[C@H]4C[C@H]2C[C@H]34)[C@@H](C)C1 ZINC000328469811 633767773 /nfs/dbraw/zinc/76/77/73/633767773.db2.gz ZAWTWYUMUKVEOY-XMMDLHNASA-N 2 0 248.414 2.397 20 0 BEADRP C[C@H]1CC[C@H]1[NH2+]CC1(C[NH+](C)C)CCCC1 ZINC000309819610 633783535 /nfs/dbraw/zinc/78/35/35/633783535.db2.gz WAXVVIAZHZTLAZ-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1CC[C@@H]1[NH2+]CC1(C[NH+](C)C)CCCC1 ZINC000309819611 633785438 /nfs/dbraw/zinc/78/54/38/633785438.db2.gz WAXVVIAZHZTLAZ-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP CCCCOCC[NH2+]C1CC[NH+](CCC)CC1 ZINC000040506021 633817895 /nfs/dbraw/zinc/81/78/95/633817895.db2.gz STHXQZCPOVPASZ-UHFFFAOYSA-N 2 0 242.407 2.267 20 0 BEADRP CS[C@@H]1CCC[C@@H]([NH2+][C@H]2CC[NH2+]C2(C)C)C1 ZINC000925507597 633840983 /nfs/dbraw/zinc/84/09/83/633840983.db2.gz ZFQAYUISYCCJQU-UTUOFQBUSA-N 2 0 242.432 2.391 20 0 BEADRP CO[C@H](C[NH2+][C@@H]1C[C@H]([NH3+])CC(C)(C)C1)C(C)C ZINC000925526382 633909050 /nfs/dbraw/zinc/90/90/50/633909050.db2.gz IGQVDJHGWLAEMQ-YNEHKIRRSA-N 2 0 242.407 2.153 20 0 BEADRP C[C@H](C[NH2+][C@H]1C[C@H]([NH3+])C12CCC2)c1ccncc1 ZINC000925541123 633955712 /nfs/dbraw/zinc/95/57/12/633955712.db2.gz HMUUOVTWYREYSU-XBFCOCLRSA-N 2 0 245.370 2.045 20 0 BEADRP C[C@H](C[NH2+][C@H]1C[C@@H]([NH3+])C12CCC2)c1ccncc1 ZINC000925541106 633956244 /nfs/dbraw/zinc/95/62/44/633956244.db2.gz HMUUOVTWYREYSU-BNOWGMLFSA-N 2 0 245.370 2.045 20 0 BEADRP CC[NH+]1CCC(CC[NH2+][C@@H]2CC[C@H]2C)CC1 ZINC000309942833 633967710 /nfs/dbraw/zinc/96/77/10/633967710.db2.gz CFZWYWZYOWWPDW-TZMCWYRMSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2C[C@H]([NH3+])CC(C)(C)C2)cn1 ZINC000925563175 634048061 /nfs/dbraw/zinc/04/80/61/634048061.db2.gz SKYBFKMYKVEGMV-KBPBESRZSA-N 2 0 247.386 2.386 20 0 BEADRP CC[NH+]1CCC([NH2+]CCC2CCC2)CC1 ZINC000162334937 634078438 /nfs/dbraw/zinc/07/84/38/634078438.db2.gz DCWROXORAHFGQP-UHFFFAOYSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[NH2+]C12CCCC2)C1CC1 ZINC000925585309 634090449 /nfs/dbraw/zinc/09/04/49/634090449.db2.gz TUALFIQQZBGTIL-CMPLNLGQSA-N 2 0 208.349 2.049 20 0 BEADRP CCC(O)(CC)C[NH2+][C@@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925615582 634159654 /nfs/dbraw/zinc/15/96/54/634159654.db2.gz GHVWAGRLVJTNQT-VXGBXAGGSA-N 2 0 242.407 2.033 20 0 BEADRP [NH3+]CCC[C@@H]([NH2+]CCCF)c1ccccc1 ZINC000925619201 634178042 /nfs/dbraw/zinc/17/80/42/634178042.db2.gz LTRBDULXPQVIGD-CYBMUJFWSA-N 2 0 224.323 2.416 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+]CC1(C2CC2)CCC1 ZINC000925620959 634179873 /nfs/dbraw/zinc/17/98/73/634179873.db2.gz DVONBPDUTCMWOS-GFCCVEGCSA-N 2 0 222.376 2.297 20 0 BEADRP CSC1(C[NH2+][C@@H]2CC[NH2+]C23CCC3)CCC1 ZINC000925655273 634218111 /nfs/dbraw/zinc/21/81/11/634218111.db2.gz GDTJMAYSOHIXMC-LLVKDONJSA-N 2 0 240.416 2.146 20 0 BEADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+][C@H]1CCO[C@@H]1C ZINC000252751882 634229529 /nfs/dbraw/zinc/22/95/29/634229529.db2.gz XCCWNUHXDJDGHV-MQYQWHSLSA-N 2 0 240.391 2.064 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+][C@H]2CC[NH2+]C2(C)C)C1 ZINC000925664292 634236221 /nfs/dbraw/zinc/23/62/21/634236221.db2.gz XVINGDRHRKFTCN-WOPDTQHZSA-N 2 0 210.365 2.153 20 0 BEADRP CC1(C)SC[C@@H]1[NH2+][C@@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925666861 634240244 /nfs/dbraw/zinc/24/02/44/634240244.db2.gz OKOCBEQWMGOCJI-MXWKQRLJSA-N 2 0 242.432 2.376 20 0 BEADRP FC1(F)CC(C[NH2+][C@@H]2CC[NH2+]C23CCCC3)C1 ZINC000925672550 634257901 /nfs/dbraw/zinc/25/79/01/634257901.db2.gz IDJHBCGVWIIAJC-LLVKDONJSA-N 2 0 244.329 2.296 20 0 BEADRP C[C@H](F)CC[NH2+][C@@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925676596 634265036 /nfs/dbraw/zinc/26/50/36/634265036.db2.gz KLNUTJLJMNTAFJ-HBNTYKKESA-N 2 0 216.344 2.230 20 0 BEADRP Cc1cc(C[NH2+][C@@H]2C[C@@H]([NH3+])CC(C)(C)C2)ccn1 ZINC000925680747 634279331 /nfs/dbraw/zinc/27/93/31/634279331.db2.gz TVQFBMOWCWZVIA-ZIAGYGMSSA-N 2 0 247.386 2.386 20 0 BEADRP C[C@H](CC(C)(C)O)[NH2+][C@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925682764 634286794 /nfs/dbraw/zinc/28/67/94/634286794.db2.gz ZRMXQAWCJZRGQZ-WOPDTQHZSA-N 2 0 242.407 2.032 20 0 BEADRP COC(C)(C)CC[NH+]1CCC(C)([NH+](C)C)CC1 ZINC000931352468 634370618 /nfs/dbraw/zinc/37/06/18/634370618.db2.gz MAUOEJWWLUPLOG-UHFFFAOYSA-N 2 0 242.407 2.218 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]C[C@@H]1C[NH2+]CCC1(F)F ZINC000925777546 635259105 /nfs/dbraw/zinc/25/91/05/635259105.db2.gz POCKWJKBWBBGSV-VWYCJHECSA-N 2 0 232.318 2.009 20 0 BEADRP CC(C)[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1C[NH2+]C[C@H]1C ZINC000925781290 635271900 /nfs/dbraw/zinc/27/19/00/635271900.db2.gz DCBDVVNHPUTGNE-ZOBORPQBSA-N 2 0 224.392 2.399 20 0 BEADRP CC(C)[C@@H]1CCCC[C@H]1[NH2+][C@@H]1C[NH2+]C[C@H]1C ZINC000925781283 635272025 /nfs/dbraw/zinc/27/20/25/635272025.db2.gz DCBDVVNHPUTGNE-XJFOESAGSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+]C(C1CCC1)C1CCC1 ZINC000925782680 635278529 /nfs/dbraw/zinc/27/85/29/635278529.db2.gz AEDZDJLLTLWRMO-RISCZKNCSA-N 2 0 236.403 2.400 20 0 BEADRP C[C@@H]1Cc2ccccc2[C@H]1[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000925790322 635314031 /nfs/dbraw/zinc/31/40/31/635314031.db2.gz GZEZJDSULBHEIV-HLSYRSCKSA-N 2 0 244.382 2.365 20 0 BEADRP C[C@@H](Cc1cccs1)[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000925792902 635325651 /nfs/dbraw/zinc/32/56/51/635325651.db2.gz WYQSWGSXRPLFFH-WOPDTQHZSA-N 2 0 238.400 2.124 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+]CC[C@@H]1C[NH2+]C[C@H]1C ZINC000925798344 635337563 /nfs/dbraw/zinc/33/75/63/635337563.db2.gz QTIFFSIQNPUIFX-HZSPNIEDSA-N 2 0 247.386 2.286 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CC1C[C@H]2CC[C@@H](C1)S2 ZINC000925800322 635343706 /nfs/dbraw/zinc/34/37/06/635343706.db2.gz FKLHQSLKDJALRP-PBYDBYKOSA-N 2 0 242.432 2.376 20 0 BEADRP CCc1onc(C)c1C[NH2+][C@@H](C)CCCC[NH3+] ZINC000925891376 635618524 /nfs/dbraw/zinc/61/85/24/635618524.db2.gz VFKRMHQEKBHUNJ-JTQLQIEISA-N 2 0 239.363 2.153 20 0 BEADRP C[C@@]1(C[N@@H+]2C[C@@H]3CCC[C@@H]3C2)CCC[NH2+]C1 ZINC000126288953 635748736 /nfs/dbraw/zinc/74/87/36/635748736.db2.gz BJLBOJAGXAMSQV-HZSPNIEDSA-N 2 0 222.376 2.108 20 0 BEADRP C[NH+](C)CCCCCCC[NH2+]Cc1ncc[nH]1 ZINC000067694959 636768397 /nfs/dbraw/zinc/76/83/97/636768397.db2.gz ZQWAPBUGXANOHH-UHFFFAOYSA-N 2 0 238.379 2.011 20 0 BEADRP C[C@@H]1CCC[N@H+](CCC[NH2+]C2CC2)[C@H]1C ZINC000252175612 636780927 /nfs/dbraw/zinc/78/09/27/636780927.db2.gz OXFMRIAUDDFZDK-NEPJUHHUSA-N 2 0 210.365 2.249 20 0 BEADRP CCC[C@H](C)C[N@@H+]1C[C@@H]2C[NH+](C)C[C@]2(C)C1 ZINC000897621547 636825335 /nfs/dbraw/zinc/82/53/35/636825335.db2.gz HVZCBCHSXNRICU-MELADBBJSA-N 2 0 224.392 2.306 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH+]1CCC([NH2+]C2CCC2)CC1 ZINC000897981651 636853374 /nfs/dbraw/zinc/85/33/74/636853374.db2.gz PPSNEHPVCQFYRW-VXGBXAGGSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@H](CCc1cccnc1)[NH2+]C[C@H](C)C[NH+](C)C ZINC000866364821 636881398 /nfs/dbraw/zinc/88/13/98/636881398.db2.gz QBZNNUXKIWUGEW-UONOGXRCSA-N 2 0 249.402 2.190 20 0 BEADRP C[N@@H+](CCc1cccs1)CC[C@@H]1CC[NH2+]C1 ZINC000086442353 636886719 /nfs/dbraw/zinc/88/67/19/636886719.db2.gz FRUMPCPTDQOMMX-LBPRGKRZSA-N 2 0 238.400 2.222 20 0 BEADRP COCC[C@H](C)[N@@H+]1CC[C@@](C[NH3+])(C(C)(C)C)C1 ZINC000866707716 636932162 /nfs/dbraw/zinc/93/21/62/636932162.db2.gz VSFVKUPGYMOCQR-JSGCOSHPSA-N 2 0 242.407 2.108 20 0 BEADRP CC(C)(C)C[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000041051409 636958447 /nfs/dbraw/zinc/95/84/47/636958447.db2.gz JHXLCIWCZUAJGC-NSHDSACASA-N 2 0 210.365 2.106 20 0 BEADRP C1=C[C@@H]2CC[C@H]1C[C@@H]2[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000924650062 636974500 /nfs/dbraw/zinc/97/45/00/636974500.db2.gz POUNTDNKBLZQFX-AYDFFVQHSA-N 2 0 246.398 2.415 20 0 BEADRP C1=C[C@@H]2CC[C@H]1C[C@@H]2[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000924650068 636974526 /nfs/dbraw/zinc/97/45/26/636974526.db2.gz POUNTDNKBLZQFX-NHIYQJMISA-N 2 0 246.398 2.415 20 0 BEADRP CO[C@H]1CCC[C@H]1[NH2+]CCCC[N@H+](C)C1CC1 ZINC000903182504 637352004 /nfs/dbraw/zinc/35/20/04/637352004.db2.gz CGVNWPIEHWFXFC-KGLIPLIRSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@@H]1C[C@@H]2CCCC[C@H]2[N@@H+]1C[C@H]1CCC[NH2+]1 ZINC000903436754 637360856 /nfs/dbraw/zinc/36/08/56/637360856.db2.gz BFWRXEQQTZLPQR-XJFOESAGSA-N 2 0 222.376 2.391 20 0 BEADRP COc1cccc([C@@H](C)[NH2+]C[C@@H]2C[NH2+]C[C@H]2C)c1 ZINC000903461605 637361667 /nfs/dbraw/zinc/36/16/67/637361667.db2.gz VOGZMVWJKOZONQ-BZPMIXESSA-N 2 0 248.370 2.201 20 0 BEADRP CC[C@@H]1CCC[C@@H](C[NH2+]CC2([NH3+])CC2)C1 ZINC000904449088 637414925 /nfs/dbraw/zinc/41/49/25/637414925.db2.gz FZSBZEKJNYGODB-VXGBXAGGSA-N 2 0 210.365 2.284 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CC[NH2+][C@H](C)C1)c1cncs1 ZINC000904468361 637423577 /nfs/dbraw/zinc/42/35/77/637423577.db2.gz AKEAXSQEHSGJIZ-OUAUKWLOSA-N 2 0 239.388 2.182 20 0 BEADRP CC(C)([NH3+])c1ccc(NC[C@@]2(C)CC[NH2+]C2)cc1 ZINC000904475937 637424812 /nfs/dbraw/zinc/42/48/12/637424812.db2.gz OCNBHPVXZRARLQ-HNNXBMFYSA-N 2 0 247.386 2.292 20 0 BEADRP CSCC(C)(C)[NH2+]C[C@H]1CC[NH2+][C@H](C)C1 ZINC000904476333 637425271 /nfs/dbraw/zinc/42/52/71/637425271.db2.gz QMNWYZYCCXGCAF-MNOVXSKESA-N 2 0 230.421 2.106 20 0 BEADRP CC(C)(C)[NH2+]CCN1C[C@@H]2CSC[C@]2(C)C1 ZINC000904475108 637425362 /nfs/dbraw/zinc/42/53/62/637425362.db2.gz ILMJTTMCCLAKLP-YPMHNXCESA-N 2 0 242.432 2.059 20 0 BEADRP CC(C)([NH3+])c1ccc(N[C@@H]2CCC[NH2+]C2)cc1 ZINC000904471063 637426039 /nfs/dbraw/zinc/42/60/39/637426039.db2.gz WFVMZOQPULOOCP-CYBMUJFWSA-N 2 0 233.359 2.044 20 0 BEADRP CSCC(C)(C)[NH2+]CC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000904476348 637426097 /nfs/dbraw/zinc/42/60/97/637426097.db2.gz QOGZAHISMGPTAE-YOGCLGLASA-N 2 0 242.432 2.248 20 0 BEADRP CC(C)Oc1cccc(C[NH2+][C@H]2C[C@H]([NH3+])C2)c1 ZINC000906508030 638179714 /nfs/dbraw/zinc/17/97/14/638179714.db2.gz IBFHYCUQFSMPEA-JOCQHMNTSA-N 2 0 234.343 2.053 20 0 BEADRP CC[C@H]1CCC[C@H](C[NH2+]C2CC([NH3+])C2)C1 ZINC000906510161 638184446 /nfs/dbraw/zinc/18/44/46/638184446.db2.gz OKGWCNLKCSITTF-ZSVAQUKISA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H](C(F)(F)F)C2)C1 ZINC000906518921 638187158 /nfs/dbraw/zinc/18/71/58/638187158.db2.gz UXARPYILYBLTDX-ZYUZMQFOSA-N 2 0 236.281 2.187 20 0 BEADRP CCCC[NH2+]CC1CC[NH+](CCC)CC1 ZINC000906529421 638195128 /nfs/dbraw/zinc/19/51/28/638195128.db2.gz POIXSLYEJUEZPP-UHFFFAOYSA-N 2 0 212.381 2.498 20 0 BEADRP CCSCC[N@@H+]1C[C@@]2(C)CN(C)C[C@@]2(C)C1 ZINC000931310392 640147013 /nfs/dbraw/zinc/14/70/13/640147013.db2.gz JHCAPWHDYDVJQO-BETUJISGSA-N 2 0 242.432 2.013 20 0 BEADRP C[C@@H](C1CC1)[NH+]1CCC(C)([NH+](C)C)CC1 ZINC000931355017 640166797 /nfs/dbraw/zinc/16/67/97/640166797.db2.gz NXQUKTRGANMKIK-NSHDSACASA-N 2 0 210.365 2.201 20 0 BEADRP C[N@@H+]1CC[C@@H]2C[NH+](CC3CCCC3)C[C@@H]2C1 ZINC000931432689 640199275 /nfs/dbraw/zinc/19/92/75/640199275.db2.gz ABYOIGVCOANJHG-KGLIPLIRSA-N 2 0 222.376 2.060 20 0 BEADRP CC/C=C\CC[N@@H+]1C[C@@H]2CC[NH+](C)C[C@@H]2C1 ZINC000931435470 640203487 /nfs/dbraw/zinc/20/34/87/640203487.db2.gz DXYOLJINUXRKMC-OQOSRZTISA-N 2 0 222.376 2.226 20 0 BEADRP CCC(CC)C[N@@H+]1C[C@@H]2CC[NH+](C)C[C@@H]2C1 ZINC000931441925 640208183 /nfs/dbraw/zinc/20/81/83/640208183.db2.gz QWTOIJWORXVLOI-UONOGXRCSA-N 2 0 224.392 2.306 20 0 BEADRP CCCCC[N@@H+]1CCc2nccc(N)c2C1 ZINC000931512175 640242579 /nfs/dbraw/zinc/24/25/79/640242579.db2.gz GGKDOMVGAKLLJS-UHFFFAOYSA-N 2 0 219.332 2.212 20 0 BEADRP CC1CC(CN2CC[C@H]3[C@H](CC[N@@H+]3C)C2)C1 ZINC000931547312 640268207 /nfs/dbraw/zinc/26/82/07/640268207.db2.gz QJTAXPCAYGHPFY-PQAZSJQKSA-N 2 0 222.376 2.059 20 0 BEADRP CC(C)OCCC[N@H+](C)CC1CC[NH+](C)CC1 ZINC000151031484 640276755 /nfs/dbraw/zinc/27/67/55/640276755.db2.gz QQFYNVCZRMLTMS-UHFFFAOYSA-N 2 0 242.407 2.075 20 0 BEADRP CC[C@H](C[C@](C)(O)CC)[NH2+]CCCC[NH+](C)C ZINC000924856346 640352231 /nfs/dbraw/zinc/35/22/31/640352231.db2.gz WMERTRRTAHDIIU-ZIAGYGMSSA-N 2 0 244.423 2.248 20 0 BEADRP CC[C@@H](C)[C@@H](C)[NH2+]CC1CC[NH+](C)CC1 ZINC000044515968 640398863 /nfs/dbraw/zinc/39/88/63/640398863.db2.gz CUDWZPIFDGYTFJ-VXGBXAGGSA-N 2 0 212.381 2.352 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@@H](c1ccccn1)C1CC1 ZINC000932376671 640506273 /nfs/dbraw/zinc/50/62/73/640506273.db2.gz FFKFKMDXBBLCMH-OAHLLOKOSA-N 2 0 247.386 2.464 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@H+](C)C1CCC(C)CC1 ZINC000223931987 640593709 /nfs/dbraw/zinc/59/37/09/640593709.db2.gz OEBILXHHFQLXCU-DKNRTOFZSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@H](C[NH2+]C1CCCC1)C[NH+]1CCCC1 ZINC000057994368 640658471 /nfs/dbraw/zinc/65/84/71/640658471.db2.gz RCPGUZYIZVRVCK-GFCCVEGCSA-N 2 0 210.365 2.251 20 0 BEADRP CC(C)=CCC[NH+]1C[C@H]2C[N@@H+](C)C[C@@]2(C)C1 ZINC000933734901 640756624 /nfs/dbraw/zinc/75/66/24/640756624.db2.gz TZZYYDUDDPGFFP-KGLIPLIRSA-N 2 0 222.376 2.226 20 0 BEADRP C[N@@H+]1C[C@@H]2C[NH+](CC3CC4(CCC4)C3)C[C@]2(C)C1 ZINC000933733623 640761584 /nfs/dbraw/zinc/76/15/84/640761584.db2.gz GGRIYGWJRQLDTN-CABCVRRESA-N 2 0 248.414 2.450 20 0 BEADRP C[NH2+][C@@H]1CCN([C@@H](C)c2cccc(C)c2)C1 ZINC000226414252 640762202 /nfs/dbraw/zinc/76/22/02/640762202.db2.gz HPSFYDGFZGLEGP-GXTWGEPZSA-N 2 0 218.344 2.350 20 0 BEADRP C[C@@H]1C[N@@H+](C[C@@]2(C)CCC[NH2+]C2)C[C@H](C)S1 ZINC000226682748 640788506 /nfs/dbraw/zinc/78/85/06/640788506.db2.gz WCFJTWBLMOOWIT-XQQFMLRXSA-N 2 0 242.432 2.202 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@H]1CCc2cccnc21 ZINC000226818229 640794233 /nfs/dbraw/zinc/79/42/33/640794233.db2.gz YISQHWHNZJUFKD-ZDUSSCGKSA-N 2 0 233.359 2.000 20 0 BEADRP C[C@@H]1C[C@H](N[C@@H]2CCc3cccnc32)CC[N@@H+]1C ZINC000226826123 640797882 /nfs/dbraw/zinc/79/78/82/640797882.db2.gz ASAKNLLKELPBQP-MRVWCRGKSA-N 2 0 245.370 2.141 20 0 BEADRP C[C@@H]1C[C@@H]1[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000227540358 640838606 /nfs/dbraw/zinc/83/86/06/640838606.db2.gz QRRFUAMNLPDOMP-WRSRJMLGSA-N 2 0 202.301 2.129 20 0 BEADRP C([C@H]1CCC[NH2+]1)[N@@H+]1CCC[C@@H]2CCC[C@H]21 ZINC000228015532 640855157 /nfs/dbraw/zinc/85/51/57/640855157.db2.gz FCBHVLLQMLDUJW-YNEHKIRRSA-N 2 0 208.349 2.003 20 0 BEADRP CC[C@@H]1CC[N@H+](C[C@@]2(C)CCC[NH2+]C2)C1 ZINC000228740328 640892862 /nfs/dbraw/zinc/89/28/62/640892862.db2.gz OCQSRSRIODELDZ-OLZOCXBDSA-N 2 0 210.365 2.108 20 0 BEADRP CC(C)c1ccc(C[NH2+]C2CC([NH3+])C2)cc1 ZINC000087651825 640957571 /nfs/dbraw/zinc/95/75/71/640957571.db2.gz CQJUIZHICWJBDA-UHFFFAOYSA-N 2 0 218.344 2.389 20 0 BEADRP Cc1nc(C)c([C@@H](C)[NH2+]C[C@@H]2CC[NH2+]C2)s1 ZINC000062117083 641024052 /nfs/dbraw/zinc/02/40/52/641024052.db2.gz DJHBSPROLIXLDI-LDYMZIIASA-N 2 0 239.388 2.020 20 0 BEADRP C[C@]1(C[NH2+]C2CCCCC2)CCC[NH2+]C1 ZINC000062862195 641100175 /nfs/dbraw/zinc/10/01/75/641100175.db2.gz BFKGDUNWFLGRCR-ZDUSSCGKSA-N 2 0 210.365 2.298 20 0 BEADRP COC(C)(C)CC[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000231026197 641133268 /nfs/dbraw/zinc/13/32/68/641133268.db2.gz QTJUNDPTUFDZHM-CHWSQXEVSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@H]1CC[C@H](C[N@H+](C)C2(C[NH3+])CCCCC2)O1 ZINC000231997416 641225704 /nfs/dbraw/zinc/22/57/04/641225704.db2.gz FZLKOUQJCFDYAO-QWHCGFSZSA-N 2 0 240.391 2.147 20 0 BEADRP CSCC(C)(C)[NH2+]CC[C@@H]1CCC[N@@H+]1C ZINC000934670618 641242773 /nfs/dbraw/zinc/24/27/73/641242773.db2.gz VGVLYHIYGXSJQK-NSHDSACASA-N 2 0 230.421 2.202 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@H]1C[NH3+])C1CCCC1 ZINC000088162887 641319676 /nfs/dbraw/zinc/31/96/76/641319676.db2.gz LOBYTSRXOANCBY-DRZSPHRISA-N 2 0 210.365 2.282 20 0 BEADRP CCOC1CC[NH+](CCCCCC[NH3+])CC1 ZINC000040690199 641534625 /nfs/dbraw/zinc/53/46/25/641534625.db2.gz WDUGLVSYDOAOBO-UHFFFAOYSA-N 2 0 228.380 2.006 20 0 BEADRP CC[C@@H]1CO[C@H](C)C[N@@H+]1CCCCCCC[NH3+] ZINC000042452097 641552277 /nfs/dbraw/zinc/55/22/77/641552277.db2.gz GQAXKTIRMLKWPH-ZIAGYGMSSA-N 2 0 242.407 2.395 20 0 BEADRP CC[C@@H]1CO[C@H](C)C[N@@H+]1CCCCCC[NH3+] ZINC000042452025 641552425 /nfs/dbraw/zinc/55/24/25/641552425.db2.gz VJAPJVZTJPQNLF-CHWSQXEVSA-N 2 0 228.380 2.005 20 0 BEADRP [NH3+]CCCCCCC[N@@H+]1CCO[C@@H]2CCC[C@@H]21 ZINC000043428043 641563441 /nfs/dbraw/zinc/56/34/41/641563441.db2.gz BBVNGFFCALAWHZ-UONOGXRCSA-N 2 0 240.391 2.149 20 0 BEADRP C[NH+]1CCC(CC[NH2+]C[C@@H]2CCC=CO2)CC1 ZINC000187572836 641717542 /nfs/dbraw/zinc/71/75/42/641717542.db2.gz XEWFBLUFPJENDC-AWEZNQCLSA-N 2 0 238.375 2.001 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH+]1CCN(c2cc[nH+]cc2)CC1 ZINC000929834215 641729020 /nfs/dbraw/zinc/72/90/20/641729020.db2.gz GZUOUOHFRQJDJU-KGLIPLIRSA-N 2 0 245.370 2.250 20 0 BEADRP Cc1ccc(CC[N@@H+]2CC[C@@H](CC[NH3+])C2)cc1 ZINC000076679630 641821132 /nfs/dbraw/zinc/82/11/32/641821132.db2.gz UZTCGNBXKHLGJL-OAHLLOKOSA-N 2 0 232.371 2.208 20 0 BEADRP CC[NH+](CC)CCSC[C@H]1CCC[N@@H+]1C ZINC000917110466 642012205 /nfs/dbraw/zinc/01/22/05/642012205.db2.gz RXVOEECXBLUPHN-GFCCVEGCSA-N 2 0 230.421 2.156 20 0 BEADRP CCC(C)(C)C[NH2+]C[C@H]1CC[NH2+][C@H](C)C1 ZINC000232897470 642205353 /nfs/dbraw/zinc/20/53/53/642205353.db2.gz ITPPKPSDCANYHT-NEPJUHHUSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCCC2(CC2)C1)C[NH+](C)C ZINC000723560991 711517598 /nfs/dbraw/zinc/51/75/98/711517598.db2.gz VLBUHXOTRUCWKF-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+][C@H]1CC[NH2+]C[C@@H]1C1CCCC1 ZINC000925472172 642391163 /nfs/dbraw/zinc/39/11/63/642391163.db2.gz AYURWSFHGMQMMW-NGFQHRJXSA-N 2 0 236.403 2.400 20 0 BEADRP COc1ccc(C[NH2+]CCN2CCCC2)c(C)c1 ZINC000921490465 642627519 /nfs/dbraw/zinc/62/75/19/642627519.db2.gz JWDPNBSUGFJMPT-UHFFFAOYSA-N 2 0 248.370 2.189 20 0 BEADRP CC1(C)C[C@@H]1C[NH2+][C@@H]1CCCC[C@@H]1C[NH3+] ZINC000232957713 642637260 /nfs/dbraw/zinc/63/72/60/642637260.db2.gz RKRZMJPEQLIEJF-IJLUTSLNSA-N 2 0 210.365 2.140 20 0 BEADRP C[C@@H]1C[N@@H+](CCCCCC[NH3+])C[C@H](C)S1 ZINC000069910029 642932435 /nfs/dbraw/zinc/93/24/35/642932435.db2.gz SQJHSOBCUBVQSX-TXEJJXNPSA-N 2 0 230.421 2.331 20 0 BEADRP CC[C@H](C)C[NH2+]Cc1ccc(CC[NH3+])cc1 ZINC000070533178 643036163 /nfs/dbraw/zinc/03/61/63/643036163.db2.gz KFWSVPYWMUNCNY-LBPRGKRZSA-N 2 0 220.360 2.324 20 0 BEADRP C[C@H]([NH2+]CCCCCC[NH3+])c1nccs1 ZINC000070733414 643066706 /nfs/dbraw/zinc/06/67/06/643066706.db2.gz LRIJZASONZCBPE-JTQLQIEISA-N 2 0 227.377 2.313 20 0 BEADRP CN(c1cc[nH+]c2ccccc21)[C@H]1CC[NH2+]C1 ZINC000071311614 643122237 /nfs/dbraw/zinc/12/22/37/643122237.db2.gz DWBVLUQNNREUJV-NSHDSACASA-N 2 0 227.311 2.033 20 0 BEADRP C[C@@H]1CCC[N@H+](C[C@]2(C)CCC[NH2+]C2)CC1 ZINC000082491036 643325503 /nfs/dbraw/zinc/32/55/03/643325503.db2.gz VXOJCELMRUMVMI-ZIAGYGMSSA-N 2 0 224.392 2.498 20 0 BEADRP CCC1(CC)CC[N@H+](C[C@@H]2C[NH2+]C[C@H]2C)C1 ZINC000232889760 643345188 /nfs/dbraw/zinc/34/51/88/643345188.db2.gz ZOXZUXPDEMVDMT-OLZOCXBDSA-N 2 0 224.392 2.354 20 0 BEADRP c1c(C[NH+]2CCCCC2)sc2c1C[NH2+]CC2 ZINC000142578884 643370377 /nfs/dbraw/zinc/37/03/77/643370377.db2.gz OCYZITBZICUUDI-UHFFFAOYSA-N 2 0 236.384 2.380 20 0 BEADRP CC1CCC([NH2+][C@@H]2CCC[C@H]2C[NH3+])CC1 ZINC000084217597 643649661 /nfs/dbraw/zinc/64/96/61/643649661.db2.gz HAOOSEZGYOBHKQ-PYNQCMFNSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+]CCc1ccsc1 ZINC000084216479 643649947 /nfs/dbraw/zinc/64/99/47/643649947.db2.gz DKIKJVKJVORTIV-OLZOCXBDSA-N 2 0 238.400 2.398 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]CCc1ccsc1 ZINC000084220724 643650571 /nfs/dbraw/zinc/65/05/71/643650571.db2.gz NOWVUAWGECPQFE-RYUDHWBXSA-N 2 0 224.373 2.008 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@@H]1C[NH3+])c1ccccc1 ZINC000084217292 643650721 /nfs/dbraw/zinc/65/07/21/643650721.db2.gz RQALVUIAUHFWBW-YUTCNCBUSA-N 2 0 218.344 2.465 20 0 BEADRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]CCc1ccsc1 ZINC000084220710 643651841 /nfs/dbraw/zinc/65/18/41/643651841.db2.gz NOWVUAWGECPQFE-VXGBXAGGSA-N 2 0 224.373 2.008 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+]CCC(F)(F)F ZINC000084216775 643651856 /nfs/dbraw/zinc/65/18/56/643651856.db2.gz ZXORTTFZPRVETQ-RKDXNWHRSA-N 2 0 224.270 2.046 20 0 BEADRP CC[C@@H]1CCC[N@H+](CC[C@@H]2CC[NH2+]C2)CC1 ZINC000084386095 643659592 /nfs/dbraw/zinc/65/95/92/643659592.db2.gz IJTWVYMJHXWYNI-KGLIPLIRSA-N 2 0 224.392 2.498 20 0 BEADRP CC[C@H]1CCC[N@H+](CC[C@@H]2CC[NH2+]C2)CC1 ZINC000084386098 643659753 /nfs/dbraw/zinc/65/97/53/643659753.db2.gz IJTWVYMJHXWYNI-KBPBESRZSA-N 2 0 224.392 2.498 20 0 BEADRP [NH3+]C[C@H]1CC[N@@H+]([C@@H]2CCCc3ccccc32)C1 ZINC000050245395 643660856 /nfs/dbraw/zinc/66/08/56/643660856.db2.gz NWZIHPNDOZRZIH-IUODEOHRSA-N 2 0 230.355 2.345 20 0 BEADRP Cc1ccc(C)c(C[NH2+]C2CC[NH2+]CC2)c1 ZINC000084487061 643663182 /nfs/dbraw/zinc/66/31/82/643663182.db2.gz RXXYPAQBKSHMOV-UHFFFAOYSA-N 2 0 218.344 2.145 20 0 BEADRP CC[NH+]1CCC(C[NH2+]C[C@H]2CCC=CO2)CC1 ZINC000050269650 643672741 /nfs/dbraw/zinc/67/27/41/643672741.db2.gz HRRFALSMJAQAAD-CQSZACIVSA-N 2 0 238.375 2.001 20 0 BEADRP CC(C)C[C@@H]1CC[N@H+](C[C@@H]2C[NH2+]C[C@H]2C)C1 ZINC000307826095 643674638 /nfs/dbraw/zinc/67/46/38/643674638.db2.gz YTGGONKADYDMPQ-RDBSUJKOSA-N 2 0 224.392 2.210 20 0 BEADRP CC[C@@H]1CCC[N@H+](C[C@@H]2CC[C@H]([NH3+])C2)C1 ZINC000085014697 643678653 /nfs/dbraw/zinc/67/86/53/643678653.db2.gz KINPNUYVSSBICA-UPJWGTAASA-N 2 0 210.365 2.236 20 0 BEADRP C[C@@H]([NH2+]CC12CC3CC(CC(C3)C1)C2)C1C[NH2+]C1 ZINC000422753197 643882219 /nfs/dbraw/zinc/88/22/19/643882219.db2.gz ICXCMSZQOGOGGQ-UWJCENJNSA-N 2 0 248.414 2.400 20 0 BEADRP C(C1CCC2(CC2)CC1)[NH+]1C[C@H]2C[NH2+]C[C@@H]2C1 ZINC000929311370 644065568 /nfs/dbraw/zinc/06/55/68/644065568.db2.gz CIULPWQZHASRAO-ZIAGYGMSSA-N 2 0 234.387 2.108 20 0 BEADRP CC1([NH+]2CCC2)CCC([NH2+]Cc2cocn2)CC1 ZINC000922845410 644119713 /nfs/dbraw/zinc/11/97/13/644119713.db2.gz PZTIXDXOAPUNES-UHFFFAOYSA-N 2 0 249.358 2.171 20 0 BEADRP CC1([NH+]2CCC2)CCC([NH2+]CC2(F)CC2)CC1 ZINC000922845178 644119971 /nfs/dbraw/zinc/11/99/71/644119971.db2.gz MRRLILWMLCVDPS-UHFFFAOYSA-N 2 0 240.366 2.485 20 0 BEADRP C[N@@H+](CCc1cccs1)CC[C@H]1CC[NH2+]C1 ZINC000086442355 644137211 /nfs/dbraw/zinc/13/72/11/644137211.db2.gz FRUMPCPTDQOMMX-GFCCVEGCSA-N 2 0 238.400 2.222 20 0 BEADRP CC[N@H+](CC1CC[NH2+]CC1)[C@H](C)C(C)C ZINC000086701841 644166385 /nfs/dbraw/zinc/16/63/85/644166385.db2.gz UBJFXSYGIPQGHO-GFCCVEGCSA-N 2 0 212.381 2.352 20 0 BEADRP C([NH2+]C1CCCCC1)[C@@H]1CCCCC[NH2+]1 ZINC000081003208 644303090 /nfs/dbraw/zinc/30/30/90/644303090.db2.gz XETVQFNBPHODBU-ZDUSSCGKSA-N 2 0 210.365 2.441 20 0 BEADRP CC(C)CC[C@H](O)C[N@H+](C)CC[C@H]([NH3+])C(C)C ZINC000923298986 644336942 /nfs/dbraw/zinc/33/69/42/644336942.db2.gz VWERRYRLOORYNW-KBPBESRZSA-N 2 0 244.423 2.089 20 0 BEADRP CC12CC(C1)C[N@@H+]2CCC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000923397040 644404990 /nfs/dbraw/zinc/40/49/90/644404990.db2.gz AYWUUUCBDSIYKY-QRFUTXMCSA-N 2 0 234.387 2.391 20 0 BEADRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]CCC1CCCC1 ZINC000084219975 644421389 /nfs/dbraw/zinc/42/13/89/644421389.db2.gz SXANWZHUBKQYQH-CHWSQXEVSA-N 2 0 210.365 2.284 20 0 BEADRP CCCCCC[C@H](O)C[NH2+][C@@H]1C[C@H]([NH3+])C1(C)C ZINC000923420263 644424206 /nfs/dbraw/zinc/42/42/06/644424206.db2.gz HFLSFXKHIWXGLI-RWMBFGLXSA-N 2 0 242.407 2.033 20 0 BEADRP C[C@H]1CCC(C)(C)[N@@H+]1CCC[NH2+]C1CC1 ZINC000923420441 644424769 /nfs/dbraw/zinc/42/47/69/644424769.db2.gz IUWIDPMXXJABRW-NSHDSACASA-N 2 0 210.365 2.391 20 0 BEADRP CCO[C@@H]1C[C@H]([NH2+]C2CCC([NH3+])CC2)C1(C)C ZINC000085398249 644440654 /nfs/dbraw/zinc/44/06/54/644440654.db2.gz BMFWILSUFCRWET-IFWUJCSASA-N 2 0 240.391 2.050 20 0 BEADRP CCc1cccc(C[N@@H+]2CC[C@@H](CC[NH3+])C2)c1 ZINC000923480508 644458867 /nfs/dbraw/zinc/45/88/67/644458867.db2.gz HZWQAUHZQUMCKA-CQSZACIVSA-N 2 0 232.371 2.420 20 0 BEADRP [NH3+]CC[C@@H]1CC[N@@H+]([C@@H]2CCc3ccc(F)cc32)C1 ZINC000923482572 644458912 /nfs/dbraw/zinc/45/89/12/644458912.db2.gz RJKCTYCVPRIXOG-IAQYHMDHSA-N 2 0 248.345 2.484 20 0 BEADRP C[C@H]1C[N@H+](CCCC2CCC2)CC[C@H]1C[NH3+] ZINC000923489757 644464461 /nfs/dbraw/zinc/46/44/61/644464461.db2.gz KQXDVSBYSVDLAU-JSGCOSHPSA-N 2 0 224.392 2.483 20 0 BEADRP C[C@@H]1C[N@H+](CC=C(Cl)Cl)CC[C@H]1C[NH3+] ZINC000923488754 644465106 /nfs/dbraw/zinc/46/51/06/644465106.db2.gz GEDLVMKOTBXFLQ-BDAKNGLRSA-N 2 0 237.174 2.222 20 0 BEADRP C[C@H]1C[N@H+](CC2CC(C)(C)C2)CC[C@H]1C[NH3+] ZINC000923489830 644465630 /nfs/dbraw/zinc/46/56/30/644465630.db2.gz LQHWOVBKBYSZJF-AAEUAGOBSA-N 2 0 224.392 2.339 20 0 BEADRP C[C@@H]1C[N@H+](CC2CC(C)(C)C2)CC[C@H]1C[NH3+] ZINC000923489833 644465870 /nfs/dbraw/zinc/46/58/70/644465870.db2.gz LQHWOVBKBYSZJF-YPMHNXCESA-N 2 0 224.392 2.339 20 0 BEADRP COc1ccc(C[N@@H+]2CC[C@@H](C[NH3+])[C@H](C)C2)cc1 ZINC000923499600 644473491 /nfs/dbraw/zinc/47/34/91/644473491.db2.gz TWWMEEUONJVDHO-OCCSQVGLSA-N 2 0 248.370 2.112 20 0 BEADRP Cc1ccc(CC[N@@H+]2CC[C@H](C[NH3+])[C@H](C)C2)cc1 ZINC000923498334 644474260 /nfs/dbraw/zinc/47/42/60/644474260.db2.gz OEQOSNWYPHSVLZ-GDBMZVCRSA-N 2 0 246.398 2.454 20 0 BEADRP C[C@@H]1C[N@@H+]([C@H]2C[C@H]2c2ccccc2)C[C@H]1C[NH3+] ZINC000923515501 644479343 /nfs/dbraw/zinc/47/93/43/644479343.db2.gz XBNIVKHFEAUEFU-RZFFKMDDSA-N 2 0 230.355 2.069 20 0 BEADRP C1=CCC(C[N@@H+]2CC[C@]3(C2)CCCC[NH2+]3)C1 ZINC000923532353 644489305 /nfs/dbraw/zinc/48/93/05/644489305.db2.gz CLRADAHNNYPGII-AWEZNQCLSA-N 2 0 220.360 2.171 20 0 BEADRP CC(C)[C@H](C)[N@@H+]1CC[C@@]2(C1)CCCC[NH2+]2 ZINC000923533726 644489360 /nfs/dbraw/zinc/48/93/60/644489360.db2.gz NTCZIMVQRRNAMK-QWHCGFSZSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]C2CC[NH2+]CC2)[C@H]1C ZINC000245224841 644518284 /nfs/dbraw/zinc/51/82/84/644518284.db2.gz GLILUBLVMICMFH-NTZNESFSSA-N 2 0 210.365 2.153 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+]CCOC1CCCC1 ZINC000089146426 644535620 /nfs/dbraw/zinc/53/56/20/644535620.db2.gz YYNFGMLVKSRGTA-OCCSQVGLSA-N 2 0 240.391 2.053 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]Cc1ccccc1F ZINC000089139620 644536054 /nfs/dbraw/zinc/53/60/54/644536054.db2.gz OUVFNDFJZTTXNJ-SMDDNHRTSA-N 2 0 236.334 2.433 20 0 BEADRP CC(C)CCOCC[N@H+](C)C1CCC([NH3+])CC1 ZINC000091847629 644641981 /nfs/dbraw/zinc/64/19/81/644641981.db2.gz OCFPMYHMAXECBE-UHFFFAOYSA-N 2 0 242.407 2.251 20 0 BEADRP C[C@@H](C[C@H]1CCCCC[NH2+]1)[NH2+]C1CCOCC1 ZINC000093514914 644694586 /nfs/dbraw/zinc/69/45/86/644694586.db2.gz MWNOLZXOWAEZED-GXTWGEPZSA-N 2 0 240.391 2.066 20 0 BEADRP CC[N@@H+](Cc1ccccn1)C[C@@H]1CC[C@H]([NH3+])C1 ZINC000094918316 644733490 /nfs/dbraw/zinc/73/34/90/644733490.db2.gz XAMZBMXRPUVRBM-OLZOCXBDSA-N 2 0 233.359 2.031 20 0 BEADRP C[C@@H]1CC[N@H+](CCC2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000251718972 644819104 /nfs/dbraw/zinc/81/91/04/644819104.db2.gz PPDICNYAKYCLDD-RLAWYHOSSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000252178631 644840612 /nfs/dbraw/zinc/84/06/12/644840612.db2.gz PNVTXFIWCYSUKC-NDBYEHHHSA-N 2 0 210.365 2.425 20 0 BEADRP C(CC1CCC1)[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000252730991 644891592 /nfs/dbraw/zinc/89/15/92/644891592.db2.gz NVQOWWBZIZOMPD-KBPBESRZSA-N 2 0 222.376 2.393 20 0 BEADRP C[C@H]([NH3+])[C@H]1CC[N@H+](C[C@H]2CCC[C@@H](C)C2)C1 ZINC000252754384 644899939 /nfs/dbraw/zinc/89/99/39/644899939.db2.gz BBLMGAFLDVWLFC-RFGFWPKPSA-N 2 0 224.392 2.482 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H]2CCCSC2)C1 ZINC000252787539 644906690 /nfs/dbraw/zinc/90/66/90/644906690.db2.gz BBEPVTJNTYGMKM-STQMWFEESA-N 2 0 242.432 2.204 20 0 BEADRP C[NH+](C)[C@@H]1CCC[C@H]([NH2+][C@H]2CCCSC2)C1 ZINC000252807618 644908547 /nfs/dbraw/zinc/90/85/47/644908547.db2.gz CYTVXHVKYVZDFE-RWMBFGLXSA-N 2 0 242.432 2.344 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)C1(Cl)CC1 ZINC000926665999 645345232 /nfs/dbraw/zinc/34/52/32/645345232.db2.gz ODVSHHIDQHKRPH-MXWKQRLJSA-N 2 0 230.783 2.076 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+]CCC1CC[NH2+]CC1 ZINC000844922867 645348120 /nfs/dbraw/zinc/34/81/20/645348120.db2.gz BYXOPFFQUMZPTQ-UONOGXRCSA-N 2 0 224.392 2.400 20 0 BEADRP Cc1cccc(C[NH2+][C@H]2C[C@H]([NH3+])CC(C)(C)C2)n1 ZINC000925485892 645429593 /nfs/dbraw/zinc/42/95/93/645429593.db2.gz PLCRAURXRLCTDL-JSGCOSHPSA-N 2 0 247.386 2.386 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CCC(C)(C)OC)[C@H](C)C1 ZINC000866503729 645729417 /nfs/dbraw/zinc/72/94/17/645729417.db2.gz VTACXWYQWOGZQB-CHWSQXEVSA-N 2 0 242.407 2.121 20 0 BEADRP C[N@H+]1C[C@H]2CC[C@@H](C1)C2[NH2+]C1CCCCC1 ZINC000924542626 646061612 /nfs/dbraw/zinc/06/16/12/646061612.db2.gz MYGNFJPIINBOKX-ONXXMXGDSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@@H]1CC[C@@H](C)C1[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000924646784 646084165 /nfs/dbraw/zinc/08/41/65/646084165.db2.gz HGBYFLNIJIGYAC-UPJWGTAASA-N 2 0 236.403 2.495 20 0 BEADRP C[C@H]1CC[C@H](C)C1[NH2+]CC1CC[NH+](C)CC1 ZINC000924963222 646144234 /nfs/dbraw/zinc/14/42/34/646144234.db2.gz JDEPNFOUADJGSE-RYUDHWBXSA-N 2 0 224.392 2.352 20 0 BEADRP CC1(C)C[C@H]([NH3+])C[C@@H]([NH2+]C[C@H]2CCCCO2)C1 ZINC000925477561 646289134 /nfs/dbraw/zinc/28/91/34/646289134.db2.gz BUJKYPMOGHAOLB-JHJVBQTASA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+][C@@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925478963 646291301 /nfs/dbraw/zinc/29/13/01/646291301.db2.gz FPXVRQAWGSAFQR-DDHJBXDOSA-N 2 0 210.365 2.138 20 0 BEADRP Fc1ccc(CCN[C@H]2CC[NH2+]C23CCC3)cc1 ZINC000925488775 646299601 /nfs/dbraw/zinc/29/96/01/646299601.db2.gz LGJINMXGGBZKQG-AWEZNQCLSA-N 2 0 248.345 2.242 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+]CCc1ccccc1 ZINC000925502314 646303623 /nfs/dbraw/zinc/30/36/23/646303623.db2.gz KRTIGIVPGPSJCS-PJPHBNEVSA-N 2 0 244.382 2.335 20 0 BEADRP CSCC[C@@H](C)[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000925510384 646307307 /nfs/dbraw/zinc/30/73/07/646307307.db2.gz VPQHAOVGCHDDME-MNOVXSKESA-N 2 0 228.405 2.002 20 0 BEADRP CC[C@H]([NH2+][C@@H]1C[C@H]([NH3+])C12CCC2)c1ccncc1 ZINC000925520040 646312340 /nfs/dbraw/zinc/31/23/40/646312340.db2.gz DUBCXRUJZBAUJH-MELADBBJSA-N 2 0 245.370 2.392 20 0 BEADRP CSC(C)(C)C[NH2+][C@H]1CC[NH2+]C12CCCC2 ZINC000925527141 646313643 /nfs/dbraw/zinc/31/36/43/646313643.db2.gz MCHPYSNZGLOKGT-NSHDSACASA-N 2 0 242.432 2.392 20 0 BEADRP CCO[C@H](CC[NH2+][C@@H]1CC[NH2+]C1(C)C)C(C)C ZINC000925526702 646317271 /nfs/dbraw/zinc/31/72/71/646317271.db2.gz KDKLDZSHVNVRHO-CHWSQXEVSA-N 2 0 242.407 2.168 20 0 BEADRP CC1(C)C[C@H]([NH3+])C[C@@H]([NH2+][C@H]2CCCSC2)C1 ZINC000925530669 646319065 /nfs/dbraw/zinc/31/90/65/646319065.db2.gz LGVHAODPAXKEMH-GRYCIOLGSA-N 2 0 242.432 2.378 20 0 BEADRP C([NH2+][C@H]1CC[NH2+]C12CCCC2)[C@@H]1CCCS1 ZINC000925553541 646330929 /nfs/dbraw/zinc/33/09/29/646330929.db2.gz TZOVXHUKRDYFJP-RYUDHWBXSA-N 2 0 240.416 2.146 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+]C[C@@]1(C)CCCS1 ZINC000925553744 646331559 /nfs/dbraw/zinc/33/15/59/646331559.db2.gz VHECMVWAZSCCGR-ZYHUDNBSSA-N 2 0 228.405 2.002 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+]CCC1CCC1 ZINC000925580124 646345476 /nfs/dbraw/zinc/34/54/76/646345476.db2.gz KRHLLCSSYMZHEC-VTXSZYRJSA-N 2 0 222.376 2.282 20 0 BEADRP CCCC1(C[NH2+][C@H]2CC[NH2+]C23CCC3)CC1 ZINC000925586341 646347267 /nfs/dbraw/zinc/34/72/67/646347267.db2.gz CMVUHKAREUFXFW-LBPRGKRZSA-N 2 0 222.376 2.441 20 0 BEADRP CC1(C)C[C@H]1C[NH2+][C@@H]1CC[NH2+]C12CCCC2 ZINC000925593531 646349839 /nfs/dbraw/zinc/34/98/39/646349839.db2.gz CKVBUUZIXMRVHF-NWDGAFQWSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H]1CC[C@H]([NH2+][C@H]2CC[NH2+]C23CCC3)CC1 ZINC000925597989 646350719 /nfs/dbraw/zinc/35/07/19/646350719.db2.gz ZRGRVGDJABHNRD-AVGNSLFASA-N 2 0 222.376 2.439 20 0 BEADRP C1CC([NH2+][C@@H]2CC[NH2+]C[C@@H]2C2CCCC2)C1 ZINC000925593395 646351345 /nfs/dbraw/zinc/35/13/45/646351345.db2.gz GGQBTUVBDVPIED-ZIAGYGMSSA-N 2 0 222.376 2.297 20 0 BEADRP CC1(C[NH2+][C@H]2CC[NH2+]C2(C)C)CCCC1 ZINC000925594139 646351455 /nfs/dbraw/zinc/35/14/55/646351455.db2.gz JLXIMDYWMFHTQG-NSHDSACASA-N 2 0 210.365 2.297 20 0 BEADRP CC1(C[NH2+][C@H]2CC[NH2+]C23CCC3)CCCC1 ZINC000925596295 646351793 /nfs/dbraw/zinc/35/17/93/646351793.db2.gz SARBIOKAQUBLQD-LBPRGKRZSA-N 2 0 222.376 2.441 20 0 BEADRP CCC[C@](C)(O)C[NH2+][C@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925613632 646362596 /nfs/dbraw/zinc/36/25/96/646362596.db2.gz UKUFGCZKXOZKKR-OBJOEFQTSA-N 2 0 242.407 2.033 20 0 BEADRP CC1(C)[C@H]([NH2+][C@@H]2CC=CCC2)[C@@H]2CCC[NH2+][C@@H]21 ZINC000925619337 646367798 /nfs/dbraw/zinc/36/77/98/646367798.db2.gz MRXTYNIINVICLO-YIYPIFLZSA-N 2 0 234.387 2.461 20 0 BEADRP CC(C)CSCCC[NH2+][C@@H]1CC[NH2+]C1(C)C ZINC000925627704 646374106 /nfs/dbraw/zinc/37/41/06/646374106.db2.gz ZGOCKPQLEPCHMY-GFCCVEGCSA-N 2 0 244.448 2.496 20 0 BEADRP CC(C)[NH2+]C1CC[NH+]([C@H](C)C2CC2)CC1 ZINC000929962396 646379142 /nfs/dbraw/zinc/37/91/42/646379142.db2.gz SZOGQSAQWHEEDH-LLVKDONJSA-N 2 0 210.365 2.247 20 0 BEADRP CSCCCCC[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000925641179 646381555 /nfs/dbraw/zinc/38/15/55/646381555.db2.gz BAFFXKFENSFLBT-LBPRGKRZSA-N 2 0 242.432 2.394 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+][C@@H]1CC12CCCC2 ZINC000925651474 646392058 /nfs/dbraw/zinc/39/20/58/646392058.db2.gz DGMDRLDBXKHGPZ-NFMDPKQHSA-N 2 0 234.387 2.425 20 0 BEADRP CC1(CC[NH2+][C@H]2CC[NH2+]C23CCCC3)CC1 ZINC000925653805 646392334 /nfs/dbraw/zinc/39/23/34/646392334.db2.gz OCOHHNSGDOSPTL-LBPRGKRZSA-N 2 0 222.376 2.441 20 0 BEADRP CC1(C)C[C@@H]([NH2+]C[C@H]2CCSC2)C[C@@H]([NH3+])C1 ZINC000925652876 646392691 /nfs/dbraw/zinc/39/26/91/646392691.db2.gz HWQHPGLTCUWOFW-UTUOFQBUSA-N 2 0 242.432 2.235 20 0 BEADRP CC1(C)CC[C@H]1[NH2+][C@H]1CC[NH2+]C12CCCC2 ZINC000925674618 646402876 /nfs/dbraw/zinc/40/28/76/646402876.db2.gz SNPMHJOOANCFOF-NEPJUHHUSA-N 2 0 222.376 2.439 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+][C@@H]1CC[NH2+]C12CCCC2 ZINC000925674619 646403386 /nfs/dbraw/zinc/40/33/86/646403386.db2.gz SNPMHJOOANCFOF-NWDGAFQWSA-N 2 0 222.376 2.439 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+]CCC1(F)CCC1 ZINC000925675067 646404232 /nfs/dbraw/zinc/40/42/32/646404232.db2.gz UFVXKSASZBNPKO-MPEURRAXSA-N 2 0 240.366 2.374 20 0 BEADRP CC1(C)C[C@@H]([NH3+])C[C@@H]([NH2+]CCCCF)C1 ZINC000925678062 646406843 /nfs/dbraw/zinc/40/68/43/646406843.db2.gz ZLOLKBZXTBSXNL-WDEREUQCSA-N 2 0 216.344 2.232 20 0 BEADRP C1[C@@H]2[C@H]1CCC[C@H]2[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000925686005 646412593 /nfs/dbraw/zinc/41/25/93/646412593.db2.gz PGSMOFJSPHHLRY-UMSGYPCISA-N 2 0 220.360 2.049 20 0 BEADRP CCO[C@H]1C[C@@H]([NH2+][C@H]2C[C@H]([NH3+])CC(C)(C)C2)C1 ZINC000925693103 646418110 /nfs/dbraw/zinc/41/81/10/646418110.db2.gz LFTPAUWSGXQREP-ZDEQEGDKSA-N 2 0 240.391 2.050 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]C[C@@H]2C[C@H]2C2CCC2)C12CCC2 ZINC000925702399 646426305 /nfs/dbraw/zinc/42/63/05/646426305.db2.gz CNHVNRZNFZEATP-IGQOVBAYSA-N 2 0 234.387 2.282 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+]C[C@@H]2C[C@H]2C2CCC2)C12CCC2 ZINC000925702400 646427543 /nfs/dbraw/zinc/42/75/43/646427543.db2.gz CNHVNRZNFZEATP-XDQVBPFNSA-N 2 0 234.387 2.282 20 0 BEADRP C[C@H]1[C@H]2CC[C@@H](C[C@@H]1[NH2+][C@@H]1C[C@H]1C1CCC1)[NH2+]2 ZINC000925702216 646427846 /nfs/dbraw/zinc/42/78/46/646427846.db2.gz AWXPJJXVROKAKA-LKUTUIMVSA-N 2 0 234.387 2.294 20 0 BEADRP CC1(C)[C@@H]([NH2+][C@@H]2C=CCC2)[C@@H]2CCC[NH2+][C@@H]21 ZINC000925708112 646432984 /nfs/dbraw/zinc/43/29/84/646432984.db2.gz CWFNQHBJMZAQQM-NDBYEHHHSA-N 2 0 220.360 2.071 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H](c1ccccc1)[C@H](C)N ZINC000925711829 646436138 /nfs/dbraw/zinc/43/61/38/646436138.db2.gz SJWCDQQVADYOBC-VNHYZAJKSA-N 2 0 249.402 2.182 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+][C@@H]1C[C@H]1C1CCC1 ZINC000925711214 646436795 /nfs/dbraw/zinc/43/67/95/646436795.db2.gz XJRQXWOBERPNQC-DMFQKCBSSA-N 2 0 234.387 2.281 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]CC2CCC(F)CC2)C12CCC2 ZINC000925711279 646437240 /nfs/dbraw/zinc/43/72/40/646437240.db2.gz LYIQHEJDUNLJEV-FIYWTHMPSA-N 2 0 240.366 2.374 20 0 BEADRP CC1(C)C[C@]1(C)[NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2 ZINC000925716877 646440723 /nfs/dbraw/zinc/44/07/23/646440723.db2.gz RNXWKDPQJZVJPT-FOGDFJRCSA-N 2 0 208.349 2.035 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+][C@@H]1CCCC12CC2 ZINC000925723571 646447938 /nfs/dbraw/zinc/44/79/38/646447938.db2.gz BPRZTYAWBZRBNZ-GHMZBOCLSA-N 2 0 208.349 2.049 20 0 BEADRP CCC[C@H](CCO)[NH2+][C@@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925725194 646450342 /nfs/dbraw/zinc/45/03/42/646450342.db2.gz RRAINFGFWROSFT-JHJVBQTASA-N 2 0 242.407 2.033 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CC1(CC2CC2)CC1 ZINC000925733125 646455589 /nfs/dbraw/zinc/45/55/89/646455589.db2.gz GAAUAQOVXQWUCJ-GHMZBOCLSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]([NH2+]CC(C)(C)CC(F)F)[C@H]1CC[NH2+]C1 ZINC000925735353 646458704 /nfs/dbraw/zinc/45/87/04/646458704.db2.gz ZIXMDGPTOCVIMA-UWVGGRQHSA-N 2 0 234.334 2.255 20 0 BEADRP COc1ccc2c(c1)[C@H]([NH2+]CCC(C)(C)[NH3+])CC2 ZINC000925741510 646462664 /nfs/dbraw/zinc/46/26/64/646462664.db2.gz TYYVXXNJJRAFRT-CQSZACIVSA-N 2 0 248.370 2.400 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1C[NH2+]C[C@H]1C)C(C)(C)C ZINC000925786568 646463831 /nfs/dbraw/zinc/46/38/31/646463831.db2.gz UFJRJOKSQZRZIF-WOPDTQHZSA-N 2 0 212.381 2.256 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH+]1CCC([NH3+])(CC)CC1 ZINC000925759821 646464213 /nfs/dbraw/zinc/46/42/13/646464213.db2.gz MHJRXOHHMVLSRR-NEPJUHHUSA-N 2 0 210.365 2.378 20 0 BEADRP CCC1([NH3+])CC[NH+]([C@H](C)C2CCOCC2)CC1 ZINC000925757948 646466782 /nfs/dbraw/zinc/46/67/82/646466782.db2.gz XINBJMMHYMXBDI-GFCCVEGCSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]C[C@@H]1CC2(CCC2)CO1 ZINC000925772508 646471496 /nfs/dbraw/zinc/47/14/96/646471496.db2.gz IINRCFQYYHTZBJ-STQMWFEESA-N 2 0 240.391 2.053 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1C[C@H]1[C@H]1C[C@H]1C)[C@@H]1CCC[NH2+]1 ZINC000925771834 646472258 /nfs/dbraw/zinc/47/22/58/646472258.db2.gz DIGXXSRXGWHEFE-WCQYUDONSA-N 2 0 222.376 2.009 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1C[C@H]1[C@H]1C[C@H]1C)[C@H]1CCC[NH2+]1 ZINC000925771833 646472373 /nfs/dbraw/zinc/47/23/73/646472373.db2.gz DIGXXSRXGWHEFE-UYYXNEDZSA-N 2 0 222.376 2.009 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H]1CCC[C@]12CCCO2 ZINC000925772141 646473355 /nfs/dbraw/zinc/47/33/55/646473355.db2.gz GDTPIDLROFNMDP-MJBXVCDLSA-N 2 0 240.391 2.195 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1C[NH2+]CCC1(F)F)[C@@H]1C[C@@H]1C ZINC000925778306 646475614 /nfs/dbraw/zinc/47/56/14/646475614.db2.gz SIWZECZXXKHIST-YFKTTZPYSA-N 2 0 246.345 2.255 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1C[NH2+]CCC1(F)F)[C@H]1C[C@@H]1C ZINC000925778298 646475644 /nfs/dbraw/zinc/47/56/44/646475644.db2.gz SIWZECZXXKHIST-BJDJZHNGSA-N 2 0 246.345 2.255 20 0 BEADRP CC[C@H]([NH2+][C@@H]1C[NH2+]C[C@H]1C)[C@@H]1CC1(C)C ZINC000925782480 646478800 /nfs/dbraw/zinc/47/88/00/646478800.db2.gz GPTYSDYTAUYRCA-NOOOWODRSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+]C(C1CCC1)C1CCC1 ZINC000925782294 646479432 /nfs/dbraw/zinc/47/94/32/646479432.db2.gz FDTREWYCLLXZJW-ZWNOBZJWSA-N 2 0 222.376 2.153 20 0 BEADRP CC(C)[C@H]([NH2+]C[C@H]1C[NH2+]CCC1(F)F)C1CC1 ZINC000925782336 646480087 /nfs/dbraw/zinc/48/00/87/646480087.db2.gz LIWKGIHCURIHKE-NEPJUHHUSA-N 2 0 246.345 2.255 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@@H]1CC[C@@H]1C(C)(C)C ZINC000925786348 646480791 /nfs/dbraw/zinc/48/07/91/646480791.db2.gz ROOFYJCLYALUIW-MROQNXINSA-N 2 0 224.392 2.256 20 0 BEADRP C[C@H]1CC(C)(C)C[C@H]1[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000925785061 646481523 /nfs/dbraw/zinc/48/15/23/646481523.db2.gz LAYNCJWSRYNROP-QNWHQSFQSA-N 2 0 224.392 2.256 20 0 BEADRP C[C@@H]1CC(C)(C)C[C@H]1[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000925785059 646481543 /nfs/dbraw/zinc/48/15/43/646481543.db2.gz LAYNCJWSRYNROP-FVCCEPFGSA-N 2 0 224.392 2.256 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@H]1CC(C)(C)C[C@@H]1C ZINC000925785062 646481744 /nfs/dbraw/zinc/48/17/44/646481744.db2.gz LAYNCJWSRYNROP-RNJOBUHISA-N 2 0 224.392 2.256 20 0 BEADRP CC[C@H]([NH2+]C[C@H]1C[NH2+]CCC1(F)F)C1CC1 ZINC000925786924 646482745 /nfs/dbraw/zinc/48/27/45/646482745.db2.gz XYPWZCIEZYHKAE-MNOVXSKESA-N 2 0 232.318 2.009 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@@H]1CCCC12CCC2 ZINC000925786497 646482757 /nfs/dbraw/zinc/48/27/57/646482757.db2.gz SQTZNCCYEAXVLH-FRRDWIJNSA-N 2 0 222.376 2.154 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1C[NH2+]C[C@H]1C)C(C)(C)C ZINC000925795633 646484731 /nfs/dbraw/zinc/48/47/31/646484731.db2.gz HIOVAPFMKVSNRQ-IJLUTSLNSA-N 2 0 212.381 2.256 20 0 BEADRP C[C@@H](CCc1ccco1)[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000925788869 646485295 /nfs/dbraw/zinc/48/52/95/646485295.db2.gz CQACSVIGYBDTKV-AGIUHOORSA-N 2 0 236.359 2.046 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@@H](C1CC1)C1CCC1 ZINC000925788226 646485329 /nfs/dbraw/zinc/48/53/29/646485329.db2.gz ZGTZBNIMUUFCBV-DDTOSNHZSA-N 2 0 222.376 2.010 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+][C@H]1CC[C@@H]1C1CC1 ZINC000925802461 646486627 /nfs/dbraw/zinc/48/66/27/646486627.db2.gz HHBZWFGIEOTNQB-ZRJCITRHSA-N 2 0 222.376 2.010 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+]CC[C@@H]1CC[C@@H]2C[C@@H]21 ZINC000925805220 646488278 /nfs/dbraw/zinc/48/82/78/646488278.db2.gz RJSFQAZORRXSBH-LOWDOPEQSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+][C@H]1CC[C@@H]1C1CCC1 ZINC000925803802 646488300 /nfs/dbraw/zinc/48/83/00/646488300.db2.gz VSXNDJZJYFMAOE-NGFQHRJXSA-N 2 0 236.403 2.400 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+][C@H]1CCCc2occc21 ZINC000925803855 646489068 /nfs/dbraw/zinc/48/90/68/646489068.db2.gz WQINZIVKCDFSRC-BZPMIXESSA-N 2 0 248.370 2.492 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@H](c1ccccn1)C1CC1 ZINC000925824136 646497227 /nfs/dbraw/zinc/49/72/27/646497227.db2.gz VOLVHXPTWSSEKH-MJVIPROJSA-N 2 0 233.359 2.248 20 0 BEADRP C[C@@H]1C[C@H]1[C@@H]1C[C@H]1[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000925825203 646498375 /nfs/dbraw/zinc/49/83/75/646498375.db2.gz YAKYDZMXLJNWKT-LPZKKVOTSA-N 2 0 234.387 2.009 20 0 BEADRP Cc1cc(F)ccc1[C@@H](C)[NH2+][C@H](C)C1C[NH2+]C1 ZINC000925828685 646499029 /nfs/dbraw/zinc/49/90/29/646499029.db2.gz ZGDQGSWRLXMTKE-GHMZBOCLSA-N 2 0 236.334 2.393 20 0 BEADRP Cc1cc(F)ccc1[C@@H](C)[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000925828686 646499413 /nfs/dbraw/zinc/49/94/13/646499413.db2.gz ZGDQGSWRLXMTKE-WDEREUQCSA-N 2 0 236.334 2.393 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]CCC1CC=CC1 ZINC000925830311 646501932 /nfs/dbraw/zinc/50/19/32/646501932.db2.gz CMCHGISUZHZGAR-OCCSQVGLSA-N 2 0 222.376 2.320 20 0 BEADRP Cc1cnc(C[NH2+][C@H]2CC[NH2+]CC[C@@H]2C)c(C)c1 ZINC000925838562 646507018 /nfs/dbraw/zinc/50/70/18/646507018.db2.gz YUCAYRHKQNGVSM-JSGCOSHPSA-N 2 0 247.386 2.176 20 0 BEADRP C[C@H]1C[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)CCS1 ZINC000925861160 646514605 /nfs/dbraw/zinc/51/46/05/646514605.db2.gz NRMLSHJZLLYJLP-DMRUHBNHSA-N 2 0 240.416 2.143 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H]([NH3+])C2)CCS1 ZINC000925860696 646514619 /nfs/dbraw/zinc/51/46/19/646514619.db2.gz JQJDNWFLKYFCDI-DDHJBXDOSA-N 2 0 228.405 2.130 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[NH2+][C@H]2CCCC23CCC3)C1 ZINC000925879401 646528764 /nfs/dbraw/zinc/52/87/64/646528764.db2.gz DBWPKBASTHWZJX-XQQFMLRXSA-N 2 0 222.376 2.426 20 0 BEADRP CC(C)[C@H]1CC[C@H]1[NH2+]C[C@@H]1CC[C@H]([NH3+])C1 ZINC000925879399 646528839 /nfs/dbraw/zinc/52/88/39/646528839.db2.gz DAZMBEHVLPZDQW-YVECIDJPSA-N 2 0 210.365 2.138 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[NH2+][C@H]2CCC23CCC3)C1 ZINC000925879390 646529213 /nfs/dbraw/zinc/52/92/13/646529213.db2.gz CWEUETAYJZJKCJ-TUAOUCFPSA-N 2 0 208.349 2.036 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+]C[C@@H]1CC[C@H]([NH3+])C1 ZINC000925881990 646530422 /nfs/dbraw/zinc/53/04/22/646530422.db2.gz ICZJOCFUILTXPO-BBBLOLIVSA-N 2 0 238.297 2.434 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]C[C@]23C[C@H]2CCC3)C1 ZINC000925880978 646531119 /nfs/dbraw/zinc/53/11/19/646531119.db2.gz OUNGAGPKROCGPB-XQHKEYJVSA-N 2 0 208.349 2.036 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[NH2+][C@@H]2CCC[C@H]2CCF)C1 ZINC000925881150 646531289 /nfs/dbraw/zinc/53/12/89/646531289.db2.gz YECFMCUCLLOXDM-WUHRBBMRSA-N 2 0 228.355 2.232 20 0 BEADRP C[C@@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1ncco1 ZINC000926114610 646576727 /nfs/dbraw/zinc/57/67/27/646576727.db2.gz PNTIQTDCVRVKFR-LLVKDONJSA-N 2 0 237.347 2.057 20 0 BEADRP C[C@@H]1CC[C@@H](C)C1[NH2+][C@@H]1CCc2nc[nH]c2C1 ZINC000926450626 646641573 /nfs/dbraw/zinc/64/15/73/646641573.db2.gz PMYBQZSFWZYOTN-GMTAPVOTSA-N 2 0 233.359 2.291 20 0 BEADRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]CCC1CC=CC1 ZINC000724200689 711569034 /nfs/dbraw/zinc/56/90/34/711569034.db2.gz PVVAMQJWJUCGMC-OLZOCXBDSA-N 2 0 208.349 2.060 20 0 BEADRP C[NH+]1CCC(C[NH2+]C[C@@]2(C)CC2(C)C)CC1 ZINC000701983492 712034356 /nfs/dbraw/zinc/03/43/56/712034356.db2.gz VZTBVIPGLNTDLI-CQSZACIVSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CCSC1)[C@H]1CCC[NH2+]C1 ZINC000704810570 712118169 /nfs/dbraw/zinc/11/81/69/712118169.db2.gz BVJYLNBTCSCION-XQQFMLRXSA-N 2 0 242.432 2.107 20 0 BEADRP CCOC[C@@H]1CC[N@H+](CCCCCCC[NH3+])C1 ZINC000707565409 712175449 /nfs/dbraw/zinc/17/54/49/712175449.db2.gz SUYMAUFROKHINP-CQSZACIVSA-N 2 0 242.407 2.254 20 0 BEADRP C[C@@H](C[N@H+](C)CCC[NH3+])CC(C)(C)C ZINC000708315135 712186734 /nfs/dbraw/zinc/18/67/34/712186734.db2.gz SRXBGHWLIOQFBY-LLVKDONJSA-N 2 0 200.370 2.339 20 0 BEADRP C[N@H+](C[C@H]1CC(C)(C)CO1)C1CCC([NH3+])CC1 ZINC000708330007 712187197 /nfs/dbraw/zinc/18/71/97/712187197.db2.gz FSQMDCFETCTSFH-WXRRBKDZSA-N 2 0 240.391 2.003 20 0 BEADRP CCC[C@@H]1CCC[N@H+](C[C@@H]2C[NH2+]C[C@H]2C)C1 ZINC000708503625 712212025 /nfs/dbraw/zinc/21/20/25/712212025.db2.gz XCPLGCPFILZMHB-MCIONIFRSA-N 2 0 224.392 2.354 20 0 BEADRP C[NH2+][C@@H]1CCN(CC2CCC3(CC3)CC2)C1 ZINC000709994884 712238788 /nfs/dbraw/zinc/23/87/88/712238788.db2.gz BBEGETYXIOWLLF-CYBMUJFWSA-N 2 0 222.376 2.251 20 0 BEADRP CSC(C)(C)C[NH2+][C@@H](C)CCCC[NH3+] ZINC000379523755 712387156 /nfs/dbraw/zinc/38/71/56/712387156.db2.gz FEOYBTPEOXTQHN-JTQLQIEISA-N 2 0 218.410 2.235 20 0 BEADRP CSCC[C@@H](C)[NH2+][C@@H](C)CCCC[NH3+] ZINC000379517230 712387238 /nfs/dbraw/zinc/38/72/38/712387238.db2.gz AWOVBJBKLUNYPO-WDEREUQCSA-N 2 0 218.410 2.235 20 0 BEADRP C=C/C=C\CC[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000713691411 712469172 /nfs/dbraw/zinc/46/91/72/712469172.db2.gz BJJDWECBBMIAPC-NTQVKLLNSA-N 2 0 208.349 2.191 20 0 BEADRP C=C/C=C\CC[NH+]1CCC(CC[NH3+])CC1 ZINC000713729626 712470747 /nfs/dbraw/zinc/47/07/47/712470747.db2.gz BNIZGWZIBUTFML-ARJAWSKDSA-N 2 0 208.349 2.180 20 0 BEADRP C=C/C=C/CC[N@H+]1CCC[C@@H](CC[NH3+])C1 ZINC000713729163 712470842 /nfs/dbraw/zinc/47/08/42/712470842.db2.gz AVBPUGFJUPAANG-OOPCZODUSA-N 2 0 208.349 2.180 20 0 BEADRP C=C/C=C/CC[N@H+]1C[C@@H]2CCC[C@H]([NH3+])[C@@H]2C1 ZINC000713741426 712471058 /nfs/dbraw/zinc/47/10/58/712471058.db2.gz UNIIIYURTYLSOC-PYDIIWFVSA-N 2 0 220.360 2.178 20 0 BEADRP CC(C)C1CC([NH2+]C[C@@H]2CC[C@H]([NH3+])C2)C1 ZINC000714664157 712495313 /nfs/dbraw/zinc/49/53/13/712495313.db2.gz NOSYOQWZCYOZDJ-IGJPJIBNSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@]1(C[NH3+])CC[N@H+](CC[C@@H]2C[C@H]2C2CC2)C1 ZINC000714921496 712499751 /nfs/dbraw/zinc/49/97/51/712499751.db2.gz ZEKKKAICNKDVIN-RDBSUJKOSA-N 2 0 222.376 2.093 20 0 BEADRP C[C@H]1OCC[C@@H]1[NH2+]C1CCC(C)([NH+](C)C)CC1 ZINC000715513602 712525081 /nfs/dbraw/zinc/52/50/81/712525081.db2.gz RPNNIWJXGSVGIX-ZIHBUVQPSA-N 2 0 240.391 2.016 20 0 BEADRP FC1(F)CC[NH2+]C[C@H]1C[NH2+]C(C1CC1)C1CC1 ZINC000717318654 712646713 /nfs/dbraw/zinc/64/67/13/712646713.db2.gz YQTDDMOWWRQHJN-NSHDSACASA-N 2 0 244.329 2.009 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H]1CC[N@H+](CC)C1)C(C)C ZINC000037484317 712650780 /nfs/dbraw/zinc/65/07/80/712650780.db2.gz VKYVUPSRQKSDCK-QWHCGFSZSA-N 2 0 212.381 2.352 20 0 BEADRP CCCC[C@@H](C)[NH2+]C[C@@H]1CC[N@H+](CC)C1 ZINC000037484312 712650948 /nfs/dbraw/zinc/65/09/48/712650948.db2.gz GALKURQDIPGZHO-OLZOCXBDSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@H]1CC[C@H](C)C1[NH2+]CCCC[NH+](C)C ZINC000380189192 712708435 /nfs/dbraw/zinc/70/84/35/712708435.db2.gz HDHSUDCJDKSGAM-RYUDHWBXSA-N 2 0 212.381 2.352 20 0 BEADRP COCC(C)(C)CC[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000718662711 712776833 /nfs/dbraw/zinc/77/68/33/712776833.db2.gz AOJCHHBGBCNLRM-QWHCGFSZSA-N 2 0 242.407 2.121 20 0 BEADRP CO[C@@H]1CCC[C@H]([NH2+]C2CC([NH+](C)C)C2)CC1 ZINC000718823696 712783877 /nfs/dbraw/zinc/78/38/77/712783877.db2.gz IPKOKMSZBGTIHK-GFJIZPEISA-N 2 0 240.391 2.016 20 0 BEADRP CCCCC[N@@H+]1C[C@H](C[NH3+])[C@H](C(F)(F)F)C1 ZINC000720809506 712867347 /nfs/dbraw/zinc/86/73/47/712867347.db2.gz ZVYWWTYZEJTZFG-VHSXEESVSA-N 2 0 238.297 2.246 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000381318695 710622226 /nfs/dbraw/zinc/62/22/26/710622226.db2.gz NYQQCAIKKDGFMD-RYSNWHEDSA-N 2 0 222.376 2.391 20 0 BEADRP CN(C)[C@@H](C[NH2+]C1CC2(CCC2)C1)C1CC1 ZINC000381712180 710682718 /nfs/dbraw/zinc/68/27/18/710682718.db2.gz KLTILZRYBSZUPK-ZDUSSCGKSA-N 2 0 222.376 2.249 20 0 BEADRP CCC[NH+]1CCC(C[NH2+][C@H]2CC[C@@H]2C)CC1 ZINC000381712188 710682747 /nfs/dbraw/zinc/68/27/47/710682747.db2.gz KLTUXOCQCHHBQI-JSGCOSHPSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+][C@@H]1CCC(C)(C)C1 ZINC000722524897 710715809 /nfs/dbraw/zinc/71/58/09/710715809.db2.gz GUNZSWSBVNORNW-JHJVBQTASA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1SCC[C@@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000381825928 710724984 /nfs/dbraw/zinc/72/49/84/710724984.db2.gz MHNOWAFARQPAGV-ZZIFITQXSA-N 2 0 240.416 2.095 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1CC[C@H]([NH3+])[C@@H](CC)C1 ZINC000723119093 710726376 /nfs/dbraw/zinc/72/63/76/710726376.db2.gz WPJIOWAVRJUGPP-VOAKCMCISA-N 2 0 210.365 2.092 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+]C[C@]2(C)CCCS2)C1 ZINC000382099357 710776214 /nfs/dbraw/zinc/77/62/14/710776214.db2.gz BEMFWOOQCJTESA-OLZOCXBDSA-N 2 0 242.432 2.204 20 0 BEADRP CSC(C)(C)CC[NH2+]CCCC[NH+](C)C ZINC000385275613 711010486 /nfs/dbraw/zinc/01/04/86/711010486.db2.gz YLDRWYJTFOESRF-UHFFFAOYSA-N 2 0 232.437 2.450 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32 ZINC000385486674 711013790 /nfs/dbraw/zinc/01/37/90/711013790.db2.gz HETWZSJHWLNYBP-FFNDWZFNSA-N 2 0 248.414 2.399 20 0 BEADRP CSC(C)(C)CC[NH2+]CC1CC[NH+](C)CC1 ZINC000385771060 711018284 /nfs/dbraw/zinc/01/82/84/711018284.db2.gz AXYAZFBAODHXNP-UHFFFAOYSA-N 2 0 244.448 2.450 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+]CCN1CCC[C@H]1C ZINC000390344588 711112782 /nfs/dbraw/zinc/11/27/82/711112782.db2.gz NTOZEWAZMYGTEY-RDBSUJKOSA-N 2 0 224.392 2.495 20 0 BEADRP CC(C)CC1(C[NH2+][C@@H]2[C@H]3C[C@H]4C[NH2+][C@H]2[C@H]4C3)CC1 ZINC000391779701 711140245 /nfs/dbraw/zinc/14/02/45/711140245.db2.gz NCIXOTNFMNTPQA-LXFSFDBISA-N 2 0 248.414 2.399 20 0 BEADRP CC(C)C[C@H](C)[NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23 ZINC000392871598 711153545 /nfs/dbraw/zinc/15/35/45/711153545.db2.gz JLNYROZZTTZURR-BSCCGWMCSA-N 2 0 222.376 2.007 20 0 BEADRP CSC(C)(C)C[NH2+][C@H](C)[C@H]1CCCC[NH2+]1 ZINC000395092412 711201125 /nfs/dbraw/zinc/20/11/25/711201125.db2.gz VLUCRZWPHOXDFN-GHMZBOCLSA-N 2 0 230.421 2.248 20 0 BEADRP C[N@H+](C[C@@H]([NH3+])CC(F)F)C1CC(C)(C)C1 ZINC000395467797 711211155 /nfs/dbraw/zinc/21/11/55/711211155.db2.gz SOWSDUWJGOUUGH-QMMMGPOBSA-N 2 0 220.307 2.089 20 0 BEADRP C[N@H+](C[C@]1(C)CCC[NH2+]C1)C1CC(C)(C)C1 ZINC000395458741 711212276 /nfs/dbraw/zinc/21/22/76/711212276.db2.gz DCXKFVCCBOJNGD-CQSZACIVSA-N 2 0 224.392 2.497 20 0 BEADRP COC(C)(C)[C@H](C)[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000396445649 711221310 /nfs/dbraw/zinc/22/13/10/711221310.db2.gz PGFDGRJHNLQOMX-RYUDHWBXSA-N 2 0 242.407 2.120 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@H]2CCCC2(F)F)CC1 ZINC000398008598 711399393 /nfs/dbraw/zinc/39/93/93/711399393.db2.gz RKQSOCWGTYVIGY-NSHDSACASA-N 2 0 232.318 2.106 20 0 BEADRP C[C@H](CCC1CC1)[NH2+]C[C@@H]1CC[C@H]([NH3+])C1 ZINC000398238108 711405798 /nfs/dbraw/zinc/40/57/98/711405798.db2.gz XHFBUVQEWTZANT-RTXFEEFZSA-N 2 0 210.365 2.282 20 0 BEADRP C[NH2+]CCC[N@H+](C)CC[C@@H]1CC1(Cl)Cl ZINC000399262834 711426030 /nfs/dbraw/zinc/42/60/30/711426030.db2.gz PQMUJGDFTHYXPC-SECBINFHSA-N 2 0 239.190 2.112 20 0 BEADRP C[C@@H]1CC[C@H]1[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000381258188 710612132 /nfs/dbraw/zinc/61/21/32/710612132.db2.gz RHYIIIWNWLGUQG-BXUZGUMPSA-N 2 0 222.376 2.249 20 0 BEADRP CC(C)(C[NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32)C1CCC1 ZINC000384907156 711000370 /nfs/dbraw/zinc/00/03/70/711000370.db2.gz ATNNNEBCJHKCGC-XSXPHNMFSA-N 2 0 248.414 2.399 20 0 BEADRP CSC(C)(C)CC[NH2+]CC1=CC[N@H+](C)CC1 ZINC000392290031 711144599 /nfs/dbraw/zinc/14/45/99/711144599.db2.gz JEQBYJDKCHCUJA-UHFFFAOYSA-N 2 0 242.432 2.370 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC2CCC1CC2)N(C)C ZINC000394337144 711190107 /nfs/dbraw/zinc/19/01/07/711190107.db2.gz YTAOENOOEOJPNI-IKWCTNDRSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC2CCC1CC2)N(C)C ZINC000394337147 711190112 /nfs/dbraw/zinc/19/01/12/711190112.db2.gz YTAOENOOEOJPNI-XVSSEFHLSA-N 2 0 210.365 2.105 20 0 BEADRP CC[C@@H]1C[N@H+](CCCC2CC2)CC[C@H]1[NH3+] ZINC000394569083 711195062 /nfs/dbraw/zinc/19/50/62/711195062.db2.gz PDFMDFMPYRTMJC-CHWSQXEVSA-N 2 0 210.365 2.236 20 0 BEADRP C[N@H+](CCC(C)(C)C)C[C@@H]1CC[C@H]([NH3+])C1 ZINC000399687039 711433844 /nfs/dbraw/zinc/43/38/44/711433844.db2.gz TXCMATGXAIYAQA-NEPJUHHUSA-N 2 0 212.381 2.482 20 0 BEADRP CCOC1CC[NH+](CCCCCCC[NH3+])CC1 ZINC000040690184 711483317 /nfs/dbraw/zinc/48/33/17/711483317.db2.gz KKGQIDILHTYDQC-UHFFFAOYSA-N 2 0 242.407 2.397 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH+]1CCC(CC[NH3+])CC1 ZINC000723079606 711499551 /nfs/dbraw/zinc/49/95/51/711499551.db2.gz NSZJSOMUOGJVID-OLZOCXBDSA-N 2 0 210.365 2.093 20 0 BEADRP C[N@H+](CCC[NH3+])C[C@H]1CCCC(C)(C)C1 ZINC000390433282 711512374 /nfs/dbraw/zinc/51/23/74/711512374.db2.gz AYQUHSZTVYOTTN-LBPRGKRZSA-N 2 0 212.381 2.483 20 0 BEADRP [NH3+]CC[C@H]1CC[N@H+](C/C=C/c2ccccc2)C1 ZINC000723713943 711535926 /nfs/dbraw/zinc/53/59/26/711535926.db2.gz XSYUVDCQQFZHEX-SZTZYQKNSA-N 2 0 230.355 2.371 20 0 BEADRP C=C/C=C\CC[N@H+]1C[C@@H](C)[C@H](CC[NH3+])C1 ZINC000723886940 711543365 /nfs/dbraw/zinc/54/33/65/711543365.db2.gz OLSQSLPGCQMBPU-DIABFLQPSA-N 2 0 208.349 2.035 20 0 BEADRP CCC[C@H](C)C[N@@H+]1C[C@@H](C)[C@H](CC[NH3+])C1 ZINC000723900628 711544282 /nfs/dbraw/zinc/54/42/82/711544282.db2.gz KWZRJIUGWUSWIZ-YNEHKIRRSA-N 2 0 212.381 2.339 20 0 BEADRP C[C@@H]1C[N@H+](C[C@H]2CCC(F)(F)C2)C[C@H]1CC[NH3+] ZINC000723893995 711544442 /nfs/dbraw/zinc/54/44/42/711544442.db2.gz IAQYBSYHPHHYKS-GRYCIOLGSA-N 2 0 246.345 2.339 20 0 BEADRP CC(C)=CCC[N@H+]1C[C@@H](C)[C@H](CC[NH3+])C1 ZINC000723891316 711544463 /nfs/dbraw/zinc/54/44/63/711544463.db2.gz LQCBNGAWZXBQTF-CHWSQXEVSA-N 2 0 210.365 2.259 20 0 BEADRP C[C@@H]1C[N@H+](CCCCCF)C[C@H]1CC[NH3+] ZINC000723907430 711544933 /nfs/dbraw/zinc/54/49/33/711544933.db2.gz BWJWLOBSRPORRB-VXGBXAGGSA-N 2 0 216.344 2.043 20 0 BEADRP CC[N@@H+](Cc1ccoc1)CC1CC[NH+](C)CC1 ZINC000891901873 711557579 /nfs/dbraw/zinc/55/75/79/711557579.db2.gz HJUQRCZQARXGLG-UHFFFAOYSA-N 2 0 236.359 2.443 20 0 BEADRP C1=CCC(CC[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)C1 ZINC000724127665 711562782 /nfs/dbraw/zinc/56/27/82/711562782.db2.gz ACJNPBJNIOCOKO-RRFJBIMHSA-N 2 0 234.387 2.320 20 0 BEADRP C1=CCC(CC[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)C1 ZINC000724127666 711563230 /nfs/dbraw/zinc/56/32/30/711563230.db2.gz ACJNPBJNIOCOKO-SOUVJXGZSA-N 2 0 234.387 2.320 20 0 BEADRP C[C@@H]([NH2+]CCC1CC=CC1)[C@H]1CCCC[NH2+]1 ZINC000724202163 711569588 /nfs/dbraw/zinc/56/95/88/711569588.db2.gz KHSIIVFFKPGGOB-TZMCWYRMSA-N 2 0 222.376 2.463 20 0 BEADRP C[C@H]([NH2+]CCC1CC=CC1)[C@@H]1CCCC[NH2+]1 ZINC000724202161 711569989 /nfs/dbraw/zinc/56/99/89/711569989.db2.gz KHSIIVFFKPGGOB-JSGCOSHPSA-N 2 0 222.376 2.463 20 0 BEADRP FC1(C2CC2)CC[NH+](C[C@H]2CCC[NH2+]C2)CC1 ZINC000724803900 711616129 /nfs/dbraw/zinc/61/61/29/711616129.db2.gz HCRHJGMNIKQUGI-LBPRGKRZSA-N 2 0 240.366 2.200 20 0 BEADRP CC(C)[C@@H]1CC[N@H+](CC[C@H]2CCC[NH2+]C2)C1 ZINC000252868840 711650956 /nfs/dbraw/zinc/65/09/56/711650956.db2.gz RRBARWFKRLEQNM-ZIAGYGMSSA-N 2 0 224.392 2.354 20 0 BEADRP CCC1(C[NH2+][C@@H]2[C@H]3C[C@H]4C[NH2+][C@H]2[C@H]4C3)CCC1 ZINC000383102745 711668206 /nfs/dbraw/zinc/66/82/06/711668206.db2.gz CFQFWTULDQOANB-YHQUGGNUSA-N 2 0 234.387 2.153 20 0 BEADRP C[C@@H](c1ccccn1)[N@@H+]1C[C@@H]2CC[NH+](C)C[C@@H]2C1 ZINC000931439927 711714045 /nfs/dbraw/zinc/71/40/45/711714045.db2.gz YNZAYMWZQSUWNM-MELADBBJSA-N 2 0 245.370 2.026 20 0 BEADRP C(C1CCCCC1)[N@@H+]1CCC[C@]12CC[NH2+]C2 ZINC000257643766 711720995 /nfs/dbraw/zinc/72/09/95/711720995.db2.gz BNAPVEQNMGNZDY-CQSZACIVSA-N 2 0 222.376 2.395 20 0 BEADRP C[C@H](c1ccncc1)[N@@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000257662238 711724429 /nfs/dbraw/zinc/72/44/29/711724429.db2.gz CCFJQVFDZZJLNH-CYBMUJFWSA-N 2 0 245.370 2.218 20 0 BEADRP C[C@H]([NH2+]C[C@]12C[C@H]1CCC2)[C@@H]1CCCC[NH2+]1 ZINC000925879807 711761871 /nfs/dbraw/zinc/76/18/71/711761871.db2.gz CNLCJTIYFZOPSW-CRWXNKLISA-N 2 0 222.376 2.297 20 0 BEADRP [NH3+]C[C@H]1CCCN1c1cc[nH+]c2ccccc21 ZINC000053663505 711775092 /nfs/dbraw/zinc/77/50/92/711775092.db2.gz LKXQHLIREUTJRE-LLVKDONJSA-N 2 0 227.311 2.162 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[N@@H+]2CCC[C@@H]3CCC[C@@H]32)C1 ZINC000227802610 711832923 /nfs/dbraw/zinc/83/29/23/711832923.db2.gz NZSLPMSNWYSLSQ-FQUUOJAGSA-N 2 0 222.376 2.378 20 0 BEADRP COC[C@@H](C[N@H+](C)CC[C@H]([NH3+])C(C)C)C(C)C ZINC000721959943 711948355 /nfs/dbraw/zinc/94/83/55/711948355.db2.gz IVTUIRIOILTHJF-KGLIPLIRSA-N 2 0 244.423 2.210 20 0 BEADRP C[NH2+]CCOCC[N@H+](C)C[C@@H](C)CC(C)(C)C ZINC000709184512 711978152 /nfs/dbraw/zinc/97/81/52/711978152.db2.gz AURAOYAZGZJFNJ-ZDUSSCGKSA-N 2 0 244.423 2.227 20 0 BEADRP CC[C@H]1CCC[N@H+](C[C@@H]2CCCC[NH2+]C2)C1 ZINC000700239999 711988251 /nfs/dbraw/zinc/98/82/51/711988251.db2.gz ZLVFKYMPDKSVLD-UONOGXRCSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H](CC[NH2+][C@@H]1CCOC2(CCC2)C1)[NH+](C)C ZINC000700604730 712001029 /nfs/dbraw/zinc/00/10/29/712001029.db2.gz DSSNQQFXIJRZNK-QWHCGFSZSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@@H]1CC[C@H]1[NH2+]C[C@H]1CCCC[N@H+](C)C1 ZINC000700799735 712005651 /nfs/dbraw/zinc/00/56/51/712005651.db2.gz LLUCWCFAKHKZPA-JHJVBQTASA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]([NH2+]C[C@]1(C)CC1(C)C)[C@H]1CCC[NH2+]1 ZINC000701943246 712032670 /nfs/dbraw/zinc/03/26/70/712032670.db2.gz ITSYDYRSSIATMW-LOWVWBTDSA-N 2 0 210.365 2.153 20 0 BEADRP CC1(C)CC(C[NH2+][C@@H]2C[C@@H]([NH3+])C23CCC3)C1 ZINC000702008086 712036761 /nfs/dbraw/zinc/03/67/61/712036761.db2.gz UFCLKWPIZRBXSI-VXGBXAGGSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@]12C[NH2+]C[C@@]1(C)C[N@H+](CCCC1CC1)C2 ZINC000702584660 712055956 /nfs/dbraw/zinc/05/59/56/712055956.db2.gz UHWQOTGHELDCHP-OKILXGFUSA-N 2 0 222.376 2.108 20 0 BEADRP CC(C)C[C@H]1CCC[N@@H+]1C[C@H]1C[C@@H]([NH3+])C1 ZINC000703614532 712081491 /nfs/dbraw/zinc/08/14/91/712081491.db2.gz BNFCCMLWQUSDSD-FRRDWIJNSA-N 2 0 210.365 2.234 20 0 BEADRP CC(C)C[C@H]1CC[N@H+](C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000703614665 712081524 /nfs/dbraw/zinc/08/15/24/712081524.db2.gz CZJUEZCJNPMPLZ-UPJWGTAASA-N 2 0 210.365 2.092 20 0 BEADRP CCC[C@@H](C[NH2+]CC1CC[NH+](C)CC1)OCC ZINC000705343476 712129398 /nfs/dbraw/zinc/12/93/98/712129398.db2.gz KYPZLTCQFGZPJB-AWEZNQCLSA-N 2 0 242.407 2.123 20 0 BEADRP C1=CC[C@H](CC[NH2+][C@@H]2[C@H]3C[C@H]4C[NH2+][C@H]2[C@H]4C3)CC1 ZINC000706841516 712157960 /nfs/dbraw/zinc/15/79/60/712157960.db2.gz CDMOTEXUUSROTO-SBOZNWLOSA-N 2 0 246.398 2.319 20 0 BEADRP C[C@H](C[NH+]1C[C@@H]2C[NH2+]C[C@H]2C1)CC(C)(C)C ZINC000709121829 712209322 /nfs/dbraw/zinc/20/93/22/712209322.db2.gz GQAIAHUKIZPULE-AVGNSLFASA-N 2 0 224.392 2.210 20 0 BEADRP [NH3+][C@H]1C[C@H]2C[C@@H](C1)[N@H+](CCCc1ccccc1)C2 ZINC000709842178 712229482 /nfs/dbraw/zinc/22/94/82/712229482.db2.gz KMIKMPRUHUCJQS-JYJNAYRXSA-N 2 0 244.382 2.431 20 0 BEADRP C[C@@H]1C[C@@H]([NH3+])CC[N@@H+]1C[C@H]1C[C@@H]2[C@H](C1)C2(F)F ZINC000710511331 712253700 /nfs/dbraw/zinc/25/37/00/712253700.db2.gz VRSSHSHUVXSJGW-LDMBFOFVSA-N 2 0 244.329 2.089 20 0 BEADRP C[NH+]1CCC(C[NH2+]C[C@@]23C[C@@H]2CCCC3)CC1 ZINC000710513067 712254178 /nfs/dbraw/zinc/25/41/78/712254178.db2.gz PPZULZPNMOCLFC-LSDHHAIUSA-N 2 0 236.403 2.498 20 0 BEADRP C[N@H+](CCCCCC[NH3+])C[C@@H]1CCSC1 ZINC000710704931 712255070 /nfs/dbraw/zinc/25/50/70/712255070.db2.gz FIYJVVNGYHFTBD-LBPRGKRZSA-N 2 0 230.421 2.190 20 0 BEADRP C[C@@H](CC[NH2+][C@@H]1C[C@@H]2CC[C@@H](C2)C1)[NH+](C)C ZINC000710931258 712265929 /nfs/dbraw/zinc/26/59/29/712265929.db2.gz QINSFXWXPNBOSZ-FQUUOJAGSA-N 2 0 224.392 2.495 20 0 BEADRP C1=C[C@H](C[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)CC1 ZINC000711719510 712319595 /nfs/dbraw/zinc/31/95/95/712319595.db2.gz NLZVNXMHPCJCER-BFHYXJOUSA-N 2 0 220.360 2.169 20 0 BEADRP [NH3+]CCC[N@H+](CCOC1CC1)Cc1ccccc1 ZINC000711766195 712327302 /nfs/dbraw/zinc/32/73/02/712327302.db2.gz RVAQDGWSIFUUBF-UHFFFAOYSA-N 2 0 248.370 2.016 20 0 BEADRP CC(C)C1([NH2+]CC2CC[NH+](C)CC2)CC1 ZINC000379734422 712393083 /nfs/dbraw/zinc/39/30/83/712393083.db2.gz DOPCGRCFHIIYLY-UHFFFAOYSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+]CCCCn1ccnc1 ZINC000379780206 712398946 /nfs/dbraw/zinc/39/89/46/712398946.db2.gz BZXSKLAPOGMFBU-NEPJUHHUSA-N 2 0 207.321 2.051 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[C@@H]2CCCC[C@H]12)[C@H]1CCC[NH2+]1 ZINC000712496342 712431379 /nfs/dbraw/zinc/43/13/79/712431379.db2.gz WXPNEDPGBUCRQD-MBJXGIAVSA-N 2 0 222.376 2.295 20 0 BEADRP C=C/C=C\CC[N@H+]1CCCC[C@@H]1CC[NH3+] ZINC000713734689 712470485 /nfs/dbraw/zinc/47/04/85/712470485.db2.gz LGWNHINBKOSNGU-DHCBQETCSA-N 2 0 208.349 2.322 20 0 BEADRP C=C/C=C\CC[N@H+]1C[C@H](C[NH3+])[C@H](C(F)(F)F)C1 ZINC000713757102 712472047 /nfs/dbraw/zinc/47/20/47/712472047.db2.gz FPZHTRUUYRGFLX-CBZSPVTBSA-N 2 0 248.292 2.188 20 0 BEADRP CC1(C)CCC[C@@H](C[N@@H+]2CCC[C@@H](C[NH3+])C2)O1 ZINC000714373039 712484504 /nfs/dbraw/zinc/48/45/04/712484504.db2.gz BDIZJUPVVNTPEK-STQMWFEESA-N 2 0 240.391 2.005 20 0 BEADRP C[C@@H]1C[C@H]([NH3+])CC[N@@H+]1C[C@H]1CCCC(C)(C)O1 ZINC000714374719 712484689 /nfs/dbraw/zinc/48/46/89/712484689.db2.gz NRVRVZLBYLUQPJ-JHJVBQTASA-N 2 0 240.391 2.146 20 0 BEADRP [NH3+]C[C@H]1CCC[N@H+](CC[C@@H]2C[C@H]2C2CC2)C1 ZINC000714920699 712499784 /nfs/dbraw/zinc/49/97/84/712499784.db2.gz QCWCBAOFHCHYHT-BNOWGMLFSA-N 2 0 222.376 2.093 20 0 BEADRP C[C@]12C[NH2+]C[C@@]1(C)C[N@H+](CC[C@@H]1C[C@H]1C1CC1)C2 ZINC000714833256 712501285 /nfs/dbraw/zinc/50/12/85/712501285.db2.gz TWHPJPFRFMURGI-QXSJWSMHSA-N 2 0 248.414 2.354 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2 ZINC000388720995 712501725 /nfs/dbraw/zinc/50/17/25/712501725.db2.gz SKFSSVMVISYWEO-QLMDPUNJSA-N 2 0 234.387 2.151 20 0 BEADRP C[NH+](C)C1(C)CCC([NH2+]Cc2ccccn2)CC1 ZINC000715506627 712523807 /nfs/dbraw/zinc/52/38/07/712523807.db2.gz BGRQDYGZCUZJKM-UHFFFAOYSA-N 2 0 247.386 2.434 20 0 BEADRP CO[C@@H]1CCC[C@@H]1[NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000715541795 712526516 /nfs/dbraw/zinc/52/65/16/712526516.db2.gz IOXRAMOWKZHGJM-RFQIPJPRSA-N 2 0 240.391 2.016 20 0 BEADRP CSC1CC([NH2+][C@H]2CCC[C@@H]([NH+](C)C)C2)C1 ZINC000715545639 712527113 /nfs/dbraw/zinc/52/71/13/712527113.db2.gz ZSKPAEYAKUIIOJ-GMKTYKIGSA-N 2 0 242.432 2.343 20 0 BEADRP C[C@@H](Cc1ccco1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000036993737 712528841 /nfs/dbraw/zinc/52/88/41/712528841.db2.gz MRJOUFIMPYYTRA-FUDCBSFHSA-N 2 0 248.370 2.425 20 0 BEADRP C[C@H]([NH2+]CCCC[NH+](C)C)c1ccns1 ZINC000716022652 712546933 /nfs/dbraw/zinc/54/69/33/712546933.db2.gz NZWFSINEPXMRJC-JTQLQIEISA-N 2 0 227.377 2.136 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]CCCCC2CC2)C12CCC2 ZINC000716369640 712556920 /nfs/dbraw/zinc/55/69/20/712556920.db2.gz LOHPIORDUXMESV-CHWSQXEVSA-N 2 0 222.376 2.426 20 0 BEADRP C[C@H]([NH2+]CCCCC1CC1)[C@H]1CCC[NH2+]1 ZINC000716371507 712557030 /nfs/dbraw/zinc/55/70/30/712557030.db2.gz XJKORCAWCURDGN-WCQYABFASA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C[NH2+][C@@H]1CCCC[C@H]1C[NH3+] ZINC000716582875 712564280 /nfs/dbraw/zinc/56/42/80/712564280.db2.gz LQJUIPGNIIESLH-ARSDKDGVSA-N 2 0 236.403 2.386 20 0 BEADRP COC1CC[NH+](CCCCCCC[NH3+])CC1 ZINC000037266472 712565079 /nfs/dbraw/zinc/56/50/79/712565079.db2.gz XHWBEQWIQXSJIJ-UHFFFAOYSA-N 2 0 228.380 2.006 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C ZINC000716544855 712567702 /nfs/dbraw/zinc/56/77/02/712567702.db2.gz IQPUOTDOBRJITF-RGDJUOJXSA-N 2 0 224.392 2.386 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@H]1[C@H]1C[C@H]1C)[C@H]1CCCC[NH2+]1 ZINC000716630907 712568004 /nfs/dbraw/zinc/56/80/04/712568004.db2.gz ATAGNTRXLCHCLL-ARSDKDGVSA-N 2 0 236.403 2.399 20 0 BEADRP C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000716639548 712568345 /nfs/dbraw/zinc/56/83/45/712568345.db2.gz VZPXEEGEBCECHF-FGZZBPHYSA-N 2 0 248.414 2.495 20 0 BEADRP C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000716648566 712568692 /nfs/dbraw/zinc/56/86/92/712568692.db2.gz DZEWDZFVIMTNBB-OBLWIEQESA-N 2 0 234.387 2.151 20 0 BEADRP FC1(F)CC[NH2+]C[C@H]1C[NH2+]C1CCCCC1 ZINC000717020211 712605245 /nfs/dbraw/zinc/60/52/45/712605245.db2.gz MVTYCUWGAYRUHD-JTQLQIEISA-N 2 0 232.318 2.154 20 0 BEADRP C(C[C@@H]1CC[C@@H]2C[C@@H]21)[NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23 ZINC000717136857 712634615 /nfs/dbraw/zinc/63/46/15/712634615.db2.gz NCPBAKOKPBLSOZ-FVEFAZKQSA-N 2 0 246.398 2.009 20 0 BEADRP CC1(C)CC[C@H]([NH2+]C[C@H]2C[NH2+]CCC2(F)F)C1 ZINC000717317977 712646732 /nfs/dbraw/zinc/64/67/32/712646732.db2.gz UHNUJEAHBRWBCP-MNOVXSKESA-N 2 0 246.345 2.400 20 0 BEADRP CC1(C)C[C@@H]([NH3+])C[C@H]([NH2+]CCc2ccccn2)C1 ZINC000925494808 712696256 /nfs/dbraw/zinc/69/62/56/712696256.db2.gz MFWNLYJONDZXAS-JSGCOSHPSA-N 2 0 247.386 2.120 20 0 BEADRP C1=CCCC([NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)CC1 ZINC000718019519 712736377 /nfs/dbraw/zinc/73/63/77/712736377.db2.gz OGFIROAVMCLREQ-GZBFAFLISA-N 2 0 234.387 2.463 20 0 BEADRP CCCC[NH2+]C[C@H](C)C[NH+]1CCCCC1 ZINC000037997637 712798478 /nfs/dbraw/zinc/79/84/78/712798478.db2.gz KAHJELKYVBWVFM-ZDUSSCGKSA-N 2 0 212.381 2.498 20 0 BEADRP CC[C@H]1CCCC[C@H]1[NH2+]C1CC[NH2+]CC1 ZINC000038041119 712801685 /nfs/dbraw/zinc/80/16/85/712801685.db2.gz VANCXQXZPWKDJR-WCQYABFASA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1CCCC[C@H]1[NH2+][C@@H]1C[NH2+]CC1(C)C ZINC000720775850 712864756 /nfs/dbraw/zinc/86/47/56/712864756.db2.gz ALRRFOZDAJYPEO-IJLUTSLNSA-N 2 0 210.365 2.153 20 0 BEADRP CCC(CC)C[N@@H+]1CCC[C@@H]2[NH2+]CC[C@H]21 ZINC000720905481 712876914 /nfs/dbraw/zinc/87/69/14/712876914.db2.gz YVLJQBCAOGWBMU-QWHCGFSZSA-N 2 0 210.365 2.249 20 0 BEADRP CC(C)C[C@@H](C)[NH2+]CC[C@@H]1C[NH2+]C[C@H]1C ZINC000721102889 712890793 /nfs/dbraw/zinc/89/07/93/712890793.db2.gz NVAPBVWMXICQMC-JHJVBQTASA-N 2 0 212.381 2.256 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+][C@@H]1CCCC[C@@H]1C ZINC000721123529 712891411 /nfs/dbraw/zinc/89/14/11/712891411.db2.gz XPBTWURDHMCQFJ-REWJHTLYSA-N 2 0 224.392 2.400 20 0 BEADRP CCO[C@@H]1CCC[C@H]([NH2+]C[C@@H](C)C[NH+](C)C)C1 ZINC000721169346 712894135 /nfs/dbraw/zinc/89/41/35/712894135.db2.gz VUBCFCHTTMXQQO-HZSPNIEDSA-N 2 0 242.407 2.121 20 0 BEADRP CCO[C@@H]1CCC[C@@H]([NH2+][C@@H](C)CC[NH+](C)C)C1 ZINC000721169969 712894536 /nfs/dbraw/zinc/89/45/36/712894536.db2.gz WJTADHOUQCEKJG-BFHYXJOUSA-N 2 0 242.407 2.264 20 0 BEADRP CCO[C@@H]1CCC[C@H]([NH2+][C@H](C)CC[NH+](C)C)C1 ZINC000721169973 712894701 /nfs/dbraw/zinc/89/47/01/712894701.db2.gz WJTADHOUQCEKJG-HZSPNIEDSA-N 2 0 242.407 2.264 20 0 BEADRP CCCC[C@H](C)[NH2+]C[C@H]1C[NH2+]C[C@H](C)C1 ZINC000398720954 958369102 /nfs/dbraw/zinc/36/91/02/958369102.db2.gz AYWDCGKCEZKRIC-FRRDWIJNSA-N 2 0 212.381 2.400 20 0 BEADRP [NH3+]CC[C@@H]1CC[N@H+](C[C@H]2CCC(F)(F)C2)C1 ZINC000300952076 959389002 /nfs/dbraw/zinc/38/90/02/959389002.db2.gz OKCHGWJKYFRSME-MNOVXSKESA-N 2 0 232.318 2.093 20 0 BEADRP C[C@]1(C[NH2+][C@H]2C[C@H]([NH3+])C23CCC3)CCCS1 ZINC000405275588 959427638 /nfs/dbraw/zinc/42/76/38/959427638.db2.gz WVQBTLJLHDZGDQ-SDDRHHMPSA-N 2 0 240.416 2.132 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H]2CCC[C@H](C)C2)C1 ZINC000252438400 959572071 /nfs/dbraw/zinc/57/20/71/959572071.db2.gz AYTUGLYRFRWHKY-MJBXVCDLSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H]1CC[C@@H]([NH+]2CCC(C)([NH3+])CC2)C1 ZINC000309517386 959896250 /nfs/dbraw/zinc/89/62/50/959896250.db2.gz ZAMQIZUWKCYYKI-VXGBXAGGSA-N 2 0 210.365 2.378 20 0 BEADRP C[C@@H]1CC[N@@H+](C2CCC([NH+](C)C)CC2)C1 ZINC001168313408 964418859 /nfs/dbraw/zinc/41/88/59/964418859.db2.gz BRUIXRFDXKCXNC-PNESKVBLSA-N 2 0 210.365 2.201 20 0 BEADRP C[C@H](CC[NH2+]CC1CCCCC1)[NH+](C)C ZINC000697878820 964605294 /nfs/dbraw/zinc/60/52/94/964605294.db2.gz MIINVJFSJKYKFU-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H](CC[NH2+]C1CCC(C)CC1)[NH+](C)C ZINC000697878155 964603194 /nfs/dbraw/zinc/60/31/94/964603194.db2.gz JJVZHYZIADGDAR-CPCZMJQVSA-N 2 0 212.381 2.495 20 0 BEADRP C[C@H](CC[NH2+]C[C@@H]1CC=CCC1)[NH+](C)C ZINC000697877834 964603471 /nfs/dbraw/zinc/60/34/71/964603471.db2.gz FPBGTFPLRADVLR-CHWSQXEVSA-N 2 0 210.365 2.273 20 0 BEADRP Cc1cc(C[N@@H+]2CCC[C@H]([NH3+])CC2)cs1 ZINC001205124201 965888139 /nfs/dbraw/zinc/88/81/39/965888139.db2.gz LIACYQGJVIKDFB-LBPRGKRZSA-N 2 0 224.373 2.370 20 0 BEADRP CC1=C[C@H](C)[C@@H](C[N@@H+]2CC[C@](C)([NH3+])C2)CC1 ZINC001204762774 967154257 /nfs/dbraw/zinc/15/42/57/967154257.db2.gz DFNNKZOISLXKRU-MJBXVCDLSA-N 2 0 222.376 2.402 20 0 BEADRP C[C@@H]1CC[N@H+](CC(C)(C)C)CC[C@H]1C[NH3+] ZINC001205599960 967716396 /nfs/dbraw/zinc/71/63/96/967716396.db2.gz ATMOFOCWWZEMDQ-NEPJUHHUSA-N 2 0 212.381 2.339 20 0 BEADRP CCCCC[N@@H+]1CCC[C@@H](C[NH3+])[C@@H](C)C1 ZINC001205984689 967934637 /nfs/dbraw/zinc/93/46/37/967934637.db2.gz UEBGOAMDNHBMQM-STQMWFEESA-N 2 0 212.381 2.483 20 0 BEADRP C[C@H]1CC([NH+]2CCC(C[NH3+])CC2)C[C@H](C)C1 ZINC000082831469 1166079902 /nfs/dbraw/zinc/07/99/02/1166079902.db2.gz MHYZVWMGYMPRKE-VXGBXAGGSA-N 2 0 224.392 2.482 20 0 BEADRP CC(C)(C)CCC[N@@H+]1CC[C@H](CC[NH3+])C1 ZINC000300827607 1166149889 /nfs/dbraw/zinc/14/98/89/1166149889.db2.gz HUGPGQRMNYIBTI-LBPRGKRZSA-N 2 0 212.381 2.483 20 0 BEADRP CC[C@@]1(C[NH2+][C@H]2CC[C@H](C)C2)CCC[NH2+]1 ZINC000129396760 1166181233 /nfs/dbraw/zinc/18/12/33/1166181233.db2.gz GJZNXGNGASXMAK-AVGNSLFASA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@@]1(C[NH2+]C2CCCCC2)CCC[NH2+]1 ZINC000215384810 1166216545 /nfs/dbraw/zinc/21/65/45/1166216545.db2.gz LXQJEWUOWHYZST-ZDUSSCGKSA-N 2 0 210.365 2.441 20 0 BEADRP CS[C@@H](C)CCN1CC[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001208154753 969080336 /nfs/dbraw/zinc/08/03/36/969080336.db2.gz NREOALQGIJAPMM-XQQFMLRXSA-N 2 0 242.432 2.297 20 0 BEADRP C[N@H+](CCCC[NH3+])Cc1ccc(F)cc1F ZINC000258946318 1166234433 /nfs/dbraw/zinc/23/44/33/1166234433.db2.gz QVKSQBGDEPQOLB-UHFFFAOYSA-N 2 0 228.286 2.136 20 0 BEADRP C([C@H]1CCC[NH2+]1)[N@@H+]1CC[C@H]2CCCC[C@@H]2C1 ZINC000227648605 1166239276 /nfs/dbraw/zinc/23/92/76/1166239276.db2.gz DBZSIGILGQEISC-MGPQQGTHSA-N 2 0 222.376 2.251 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2CCC[C@@H]2C)CC1 ZINC001208594211 969150763 /nfs/dbraw/zinc/15/07/63/969150763.db2.gz LNOFXUJPXOTUAJ-LBPRGKRZSA-N 2 0 210.365 2.203 20 0 BEADRP CC/C=C\CC[N@@H+]1C[C@H]2CC[NH+](C)C[C@H]2C1 ZINC001208726906 969212859 /nfs/dbraw/zinc/21/28/59/969212859.db2.gz DXYOLJINUXRKMC-VSVUCHCSSA-N 2 0 222.376 2.226 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]CC1(C)CCC1)C2 ZINC001169091847 969408216 /nfs/dbraw/zinc/40/82/16/969408216.db2.gz WDPWZMMFRQNXNS-XYYAHUGASA-N 2 0 222.376 2.391 20 0 BEADRP CC[N@H+](C)C1CC[NH+](C[C@H]2C[C@H]2C)CC1 ZINC001209427108 969494983 /nfs/dbraw/zinc/49/49/83/969494983.db2.gz OKBCGBXLPYYFHP-VXGBXAGGSA-N 2 0 210.365 2.059 20 0 BEADRP CCC(CC)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000250788639 1166430873 /nfs/dbraw/zinc/43/08/73/1166430873.db2.gz YCGMGHQKLDRPCR-CLLJXQQHSA-N 2 0 210.365 2.390 20 0 BEADRP [NH3+]CCC[C@H]1CCCC[N@@H+]([C@H]2CCCOC2)C1 ZINC001254376267 969591579 /nfs/dbraw/zinc/59/15/79/969591579.db2.gz WSHQLFDGDASRQL-KGLIPLIRSA-N 2 0 240.391 2.006 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]C[C@@H]2CCC[C@@H]3C[C@@H]32)C12CCC2 ZINC000694305646 1166508356 /nfs/dbraw/zinc/50/83/56/1166508356.db2.gz AWUOSFFQJFXSNV-HTOAHKCRSA-N 2 0 234.387 2.282 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]C[C@@H]2CCC[C@H]3C[C@H]32)C12CCC2 ZINC000694305651 1166506882 /nfs/dbraw/zinc/50/68/82/1166506882.db2.gz AWUOSFFQJFXSNV-QNSTZXKLSA-N 2 0 234.387 2.282 20 0 BEADRP C[NH+](C)[C@H]1CC[C@@H]([NH2+]C2CCSCC2)CC1 ZINC001255088029 969921878 /nfs/dbraw/zinc/92/18/78/969921878.db2.gz UOHRTZDAFCVNOX-BJHJDKERSA-N 2 0 242.432 2.344 20 0 BEADRP [NH3+]CCC[C@@H]1CCCC[N@@H+]([C@H]2CCSC2)C1 ZINC001255280327 970034352 /nfs/dbraw/zinc/03/43/52/970034352.db2.gz YYUDMKSOSWSDCI-STQMWFEESA-N 2 0 242.432 2.333 20 0 BEADRP C[C@H]1C[C@@H]([N@H+](C)CC2CC(F)(F)C2)CC[NH2+]1 ZINC000394748726 1166612845 /nfs/dbraw/zinc/61/28/45/1166612845.db2.gz ZMYXJFDBTQJAJP-ONGXEEELSA-N 2 0 232.318 2.104 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCCC(F)(F)F)CC[NH2+]1 ZINC000709318303 1166692039 /nfs/dbraw/zinc/69/20/39/1166692039.db2.gz HKOODRKZLQFAAN-RKDXNWHRSA-N 2 0 224.270 2.059 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+][C@@H](CO)CC(C)C ZINC001255941341 970569683 /nfs/dbraw/zinc/56/96/83/970569683.db2.gz ORTFRKBXGWYEJJ-ZIAGYGMSSA-N 2 0 244.423 2.103 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]C1(C)CCOCC1 ZINC001255941809 970570043 /nfs/dbraw/zinc/57/00/43/970570043.db2.gz XLLSIIVDJMWAHJ-ZDUSSCGKSA-N 2 0 242.407 2.266 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]C1CCC(=O)CC1 ZINC001255945711 970577434 /nfs/dbraw/zinc/57/74/34/970577434.db2.gz IHPOCYROFLUCKA-LBPRGKRZSA-N 2 0 240.391 2.208 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]C[C@@H]1CCCCO1 ZINC001255944170 970578981 /nfs/dbraw/zinc/57/89/81/970578981.db2.gz SHDFOJWMFGVXQZ-KBPBESRZSA-N 2 0 242.407 2.266 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]C[C@H]1CC(C)(C)O1 ZINC001255947586 970581722 /nfs/dbraw/zinc/58/17/22/970581722.db2.gz SXBLCPNRIYUXMQ-CHWSQXEVSA-N 2 0 242.407 2.264 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]C1(CO)CCCC1 ZINC001255946778 970581934 /nfs/dbraw/zinc/58/19/34/970581934.db2.gz ZTAILKKKKUTNFF-ZDUSSCGKSA-N 2 0 242.407 2.002 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]C[C@]1(C)CCOC1 ZINC001255951296 970583239 /nfs/dbraw/zinc/58/32/39/970583239.db2.gz HULWTIFJULXMSK-KGLIPLIRSA-N 2 0 242.407 2.123 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[N@H+](C)C(C)C ZINC001255955104 970586733 /nfs/dbraw/zinc/58/67/33/970586733.db2.gz NZEUJOGZKPPLLW-GFCCVEGCSA-N 2 0 200.370 2.447 20 0 BEADRP CC[NH+](CC)CC[C@H](C)NC(C)(C)C(C)(C)[NH3+] ZINC001255953144 970589997 /nfs/dbraw/zinc/58/99/97/970589997.db2.gz XKHXSXDEEYFTPK-LBPRGKRZSA-N 2 0 243.439 2.212 20 0 BEADRP CC(C)[C@H]1CCC[C@@H]([NH2+][C@@H]2C[NH2+]C[C@H]2C)C1 ZINC000925784861 1166832141 /nfs/dbraw/zinc/83/21/41/1166832141.db2.gz OIDHSXDPFVAVLJ-XJFOESAGSA-N 2 0 224.392 2.399 20 0 BEADRP C[NH+]1CCC([N@@H+]2CC[C@@H]3CCC[C@H]3C2)CC1 ZINC001256205057 970704918 /nfs/dbraw/zinc/70/49/18/970704918.db2.gz VKGULSPKSARELR-STQMWFEESA-N 2 0 222.376 2.203 20 0 BEADRP C[C@@H]1[C@H]([NH3+])CC[N@@H+]1C1CCC2(CC2)CC1 ZINC000710198306 1166988084 /nfs/dbraw/zinc/98/80/84/1166988084.db2.gz DNDJXRGOJHUXBG-ZYHUDNBSSA-N 2 0 208.349 2.131 20 0 BEADRP CCC[N@H+]1C[C@@H]2C[NH+]([C@@H]3C[C@H]4C[C@H]4C3)C[C@@H]2C1 ZINC001167949403 1167006001 /nfs/dbraw/zinc/00/60/01/1167006001.db2.gz WWQTWCMGXFKSCW-SBAKFKMJSA-N 2 0 234.387 2.059 20 0 BEADRP CCSC[C@@H](C)[N@H+](C)CC1CC[NH+](C)CC1 ZINC001173306733 975211681 /nfs/dbraw/zinc/21/16/81/975211681.db2.gz PYPRCPMWRXDUKJ-GFCCVEGCSA-N 2 0 244.448 2.402 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+][C@H]2CCC[C@@H](F)C2)C12CCC2 ZINC001332875575 975304039 /nfs/dbraw/zinc/30/40/39/975304039.db2.gz BVZAKCWYQGWMNG-KXNHARMFSA-N 2 0 226.339 2.127 20 0 BEADRP CCC[C@H](C)[N@H+](C)C[C@H](C[NH3+])C(C)C ZINC000251355473 1167135043 /nfs/dbraw/zinc/13/50/43/1167135043.db2.gz RLLBTDJMDAJQOX-RYUDHWBXSA-N 2 0 200.370 2.338 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2C[C@@H]3CC[C@H]([NH3+])[C@H]3C2)C[C@H]1C ZINC000310463325 1167157725 /nfs/dbraw/zinc/15/77/25/1167157725.db2.gz YNNCZNPMVCRISH-UMBPPFEGSA-N 2 0 236.403 2.480 20 0 BEADRP C1CCC2(C1)CC[N@@H+](C1CC[NH2+]CC1)C2 ZINC000308926567 1167222648 /nfs/dbraw/zinc/22/26/48/1167222648.db2.gz MJQUFDVJXWIAMV-UHFFFAOYSA-N 2 0 208.349 2.005 20 0 BEADRP CCCC[C@H](C)[N@H+](C)CC1CC[NH2+]CC1 ZINC000309023472 1167240301 /nfs/dbraw/zinc/24/03/01/1167240301.db2.gz WKZALUMOPUXKMZ-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP CC[N@@H+]1CCC[C@H](C[NH2+][C@H]2CC[C@@H]2C)C1 ZINC000309037572 1167243669 /nfs/dbraw/zinc/24/36/69/1167243669.db2.gz JCAMUXYHBAEEDR-XQQFMLRXSA-N 2 0 210.365 2.106 20 0 BEADRP CCSCC[NH2+][C@H](C)CC[NH+](CC)CC ZINC000309046740 1167243691 /nfs/dbraw/zinc/24/36/91/1167243691.db2.gz PBFYHYUYNGIHPN-GFCCVEGCSA-N 2 0 232.437 2.450 20 0 BEADRP CC[N@@H+]1CCC[C@H](C[NH2+][C@H]2CC[C@H]2C)C1 ZINC000309037571 1167244803 /nfs/dbraw/zinc/24/48/03/1167244803.db2.gz JCAMUXYHBAEEDR-UPJWGTAASA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)[C@H](C[NH3+])C[N@H+](C)[C@H](C)C1(C)CC1 ZINC000385505078 1167393353 /nfs/dbraw/zinc/39/33/53/1167393353.db2.gz LOWIRHOQTCDEET-VXGBXAGGSA-N 2 0 212.381 2.338 20 0 BEADRP CC(C)[C@@H](C[NH3+])C[N@H+](C)[C@H](C)C1(C)CC1 ZINC000385505073 1167393983 /nfs/dbraw/zinc/39/39/83/1167393983.db2.gz LOWIRHOQTCDEET-NEPJUHHUSA-N 2 0 212.381 2.338 20 0 BEADRP C[NH+](C)CCC[N@H+](C)[C@@H]1CCC(C)(C)C1 ZINC000348935887 1167428335 /nfs/dbraw/zinc/42/83/35/1167428335.db2.gz QMWSZCMPLBALGS-GFCCVEGCSA-N 2 0 212.381 2.449 20 0 BEADRP C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000147192529 1167438721 /nfs/dbraw/zinc/43/87/21/1167438721.db2.gz HLTSXIQQDWKWBM-QKDCVEJESA-N 2 0 230.355 2.401 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@@H+]([C@@H]2CC[C@H](C)[C@H](C)C2)C1 ZINC000251990284 1167468612 /nfs/dbraw/zinc/46/86/12/1167468612.db2.gz ZGUMAYXONPMNFO-RFQIPJPRSA-N 2 0 224.392 2.352 20 0 BEADRP CCC[C@H](C[N@H+](C)C1C[C@H]2CC[C@@H](C1)[NH2+]2)OC ZINC000386447804 1167711574 /nfs/dbraw/zinc/71/15/74/1167711574.db2.gz NOQPGYYVJCPPHF-QNMSZWNNSA-N 2 0 240.391 2.016 20 0 BEADRP CCN1CCC[C@@H]([NH2+]CC[C@H]2CCCCO2)C1 ZINC001180311047 978854345 /nfs/dbraw/zinc/85/43/45/978854345.db2.gz WPDCZTDOKVJGGY-ZIAGYGMSSA-N 2 0 240.391 2.020 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+][C@@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC001340062634 978963968 /nfs/dbraw/zinc/96/39/68/978963968.db2.gz HIYWARVGHFWZQM-KKOKHZNYSA-N 2 0 210.365 2.281 20 0 BEADRP [NH3+]CCCC[N@@H+]1CCOC[C@H]1C1CCCCC1 ZINC001236432610 1168226167 /nfs/dbraw/zinc/22/61/67/1168226167.db2.gz ACQXYQFTYUEPBQ-AWEZNQCLSA-N 2 0 240.391 2.006 20 0 BEADRP CC(C)(C)[NH+]1CCC([NH2+]CCC(F)F)CC1 ZINC001184314560 980000146 /nfs/dbraw/zinc/00/01/46/980000146.db2.gz SMWWTJFRQPFVHI-UHFFFAOYSA-N 2 0 234.334 2.494 20 0 BEADRP C[NH+](C)C1CCC([NH+]2CCCCC2)CC1 ZINC000202466157 1168456816 /nfs/dbraw/zinc/45/68/16/1168456816.db2.gz ZGIHAKYRLPZHLF-UHFFFAOYSA-N 2 0 210.365 2.345 20 0 BEADRP Cc1ccc2c(c1)[C@@H]([NH3+])CC21CC[NH2+]CC1 ZINC001239318282 980528929 /nfs/dbraw/zinc/52/89/29/980528929.db2.gz PZNMVIZBULFTPU-ZDUSSCGKSA-N 2 0 216.328 2.020 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H](C)c1ccc(C)nc1C ZINC001345483547 980617800 /nfs/dbraw/zinc/61/78/00/980617800.db2.gz SPSPIODCMLASNZ-ZYHUDNBSSA-N 2 0 235.375 2.205 20 0 BEADRP CCC[N@H+](CCC[NH+](C)C)[C@H]1CCCOCC1 ZINC001170840337 1168606520 /nfs/dbraw/zinc/60/65/20/1168606520.db2.gz MFQFLFMQAXVQIW-AWEZNQCLSA-N 2 0 242.407 2.219 20 0 BEADRP CC(C)C[NH+]1CCC([NH2+][C@H]2C[C@@H]2C2CC2)CC1 ZINC000716667512 1168782650 /nfs/dbraw/zinc/78/26/50/1168782650.db2.gz NRHJMWKJIVGDDX-CABCVRRESA-N 2 0 236.403 2.495 20 0 BEADRP CCC[C@H](C)C[N@@H+]1C[C@H]2CC[NH+](C)C[C@H]2C1 ZINC001201542918 983301895 /nfs/dbraw/zinc/30/18/95/983301895.db2.gz MYSAHGCEGIKMII-MJBXVCDLSA-N 2 0 224.392 2.306 20 0 BEADRP CCCC[C@@H](O)C[NH2+]CCC[NH+]1CCCCC1 ZINC001252110948 983688872 /nfs/dbraw/zinc/68/88/72/983688872.db2.gz QPXBNOSJADPXOQ-CQSZACIVSA-N 2 0 242.407 2.003 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2CC[C@]3(CC[NH+](C)C3)C2)C1 ZINC000339211249 984020649 /nfs/dbraw/zinc/02/06/49/984020649.db2.gz GUJCFSZJSRVAHS-RDBSUJKOSA-N 2 0 222.376 2.203 20 0 BEADRP CCOc1cc[nH+]c(N[C@@H]2CCC[C@H]([NH3+])C2)c1 ZINC001154986621 1169417812 /nfs/dbraw/zinc/41/78/12/1169417812.db2.gz UGRIIGPRIALIMN-WDEREUQCSA-N 2 0 235.331 2.162 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H](C)c1ccccc1 ZINC001329024928 973413768 /nfs/dbraw/zinc/41/37/68/973413768.db2.gz WLLHOGFDGYJRAB-NEPJUHHUSA-N 2 0 206.333 2.335 20 0 BEADRP CSCC[C@H](C)[N@H+]1C[C@@H]2CC[NH2+]CC[C@@H]2C1 ZINC001246933134 973591432 /nfs/dbraw/zinc/59/14/32/973591432.db2.gz QQMMEJKBCNSAJL-RWMBFGLXSA-N 2 0 242.432 2.059 20 0 BEADRP Cc1ccc(C[NH+]2CCC(F)(C[NH3+])CC2)cc1 ZINC001222531622 972533265 /nfs/dbraw/zinc/53/32/65/972533265.db2.gz FLVBSZZMPVLTOB-UHFFFAOYSA-N 2 0 236.334 2.258 20 0 BEADRP CC(C)CC[C@H](C)[N@H+]1C[C@H]2C[NH+](C)C[C@H]2C1 ZINC001256371308 970786126 /nfs/dbraw/zinc/78/61/26/970786126.db2.gz MZYFRFWMWRKWSU-MELADBBJSA-N 2 0 224.392 2.305 20 0 BEADRP CC(C)[N@H+](CCC[NH3+])[C@@H](C)Cc1ccccn1 ZINC001256396863 970803112 /nfs/dbraw/zinc/80/31/12/970803112.db2.gz LVDWGPMCAFNWNO-ZDUSSCGKSA-N 2 0 235.375 2.072 20 0 BEADRP C[C@H](Cc1ccccn1)[N@H+](C)C1CCC([NH3+])CC1 ZINC001256399648 970805376 /nfs/dbraw/zinc/80/53/76/970805376.db2.gz QPVZLZAONYSICO-DNOWBOINSA-N 2 0 247.386 2.214 20 0 BEADRP C[C@H](Cc1ccccn1)[NH2+]C(C)(C)CC[NH+](C)C ZINC001256401988 970809024 /nfs/dbraw/zinc/80/90/24/970809024.db2.gz XDNFVSWMEXGBOI-CYBMUJFWSA-N 2 0 249.402 2.333 20 0 BEADRP C[C@H]1C[C@H](NC=[NH2+])CC[N@@H+]1Cc1ccccc1 ZINC001256523197 970856949 /nfs/dbraw/zinc/85/69/49/970856949.db2.gz NKWUVTBBYQAROC-GXTWGEPZSA-N 2 0 231.343 2.236 20 0 BEADRP C[C@H]1C[C@@H](NC=[NH2+])CC[N@@H+]1Cc1ccccc1 ZINC001256523199 970857018 /nfs/dbraw/zinc/85/70/18/970857018.db2.gz NKWUVTBBYQAROC-JSGCOSHPSA-N 2 0 231.343 2.236 20 0 BEADRP CC(C)(C)[NH+]1CCC(n2cccc2CC[NH3+])CC1 ZINC001256564117 970864393 /nfs/dbraw/zinc/86/43/93/970864393.db2.gz SBCGKOANQSLZMG-UHFFFAOYSA-N 2 0 249.402 2.425 20 0 BEADRP CCC[C@H](C)C[N@@H+]1CCC(F)(F)[C@H](C[NH3+])C1 ZINC000403136478 970881749 /nfs/dbraw/zinc/88/17/49/970881749.db2.gz BWWZNONVSCAWDX-WDEREUQCSA-N 2 0 234.334 2.339 20 0 BEADRP [NH3+]C[C@H]1C[N@H+](CC2CCCC2)CCC1(F)F ZINC000403199492 970892662 /nfs/dbraw/zinc/89/26/62/970892662.db2.gz ZFGVHFLDKSCUBY-NSHDSACASA-N 2 0 232.318 2.093 20 0 BEADRP CC(C)[N@H+](CCC[NH3+])[C@H](C)Cc1ccncc1 ZINC001256718421 970936708 /nfs/dbraw/zinc/93/67/08/970936708.db2.gz IPJVXKSDKPNBMT-CYBMUJFWSA-N 2 0 235.375 2.072 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H](C)Cc1ccncc1 ZINC001256717032 970933251 /nfs/dbraw/zinc/93/32/51/970933251.db2.gz XZJBGPXJWBWOEL-AWEZNQCLSA-N 2 0 249.402 2.334 20 0 BEADRP C[C@@H](Cc1ccncc1)[NH2+][C@@H]1CCC[N@H+](C)CC1 ZINC001256721750 970941898 /nfs/dbraw/zinc/94/18/98/970941898.db2.gz UTTNUTXIDOGEHI-DZGCQCFKSA-N 2 0 247.386 2.087 20 0 BEADRP C[C@H](Cc1ccncc1)[NH2+]C(C)(C)C(C)(C)[NH3+] ZINC001256728646 970950594 /nfs/dbraw/zinc/95/05/94/970950594.db2.gz JAYWQEZVCQJTQY-LLVKDONJSA-N 2 0 235.375 2.118 20 0 BEADRP C[NH2+]Cc1cccc(Nc2cc[nH+]c(C)c2)c1F ZINC001216218600 970990268 /nfs/dbraw/zinc/99/02/68/970990268.db2.gz FZHQSDSFDHWLJH-UHFFFAOYSA-N 2 0 245.301 2.414 20 0 BEADRP Cn1cc[nH+]c1Nc1cccc(C[NH+](C)C)c1F ZINC001216227270 970995374 /nfs/dbraw/zinc/99/53/74/970995374.db2.gz YLJOUXUBLBLWGE-UHFFFAOYSA-N 2 0 248.305 2.364 20 0 BEADRP C[C@H]1CC[N@@H+](C2CCN(c3cc[nH+]cc3)CC2)C1 ZINC001256857836 970998037 /nfs/dbraw/zinc/99/80/37/970998037.db2.gz WSALNIDREQJIET-ZDUSSCGKSA-N 2 0 245.370 2.392 20 0 BEADRP C([C@@H]1CC[C@H]2C[C@H]2C1)[N@@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000403637634 970998346 /nfs/dbraw/zinc/99/83/46/970998346.db2.gz GRURIJOKTYXMRO-QLFBSQMISA-N 2 0 248.414 2.498 20 0 BEADRP CNc1cc(Nc2cc[nH+]c3c2CCC3)cc[nH+]1 ZINC001216333262 971043680 /nfs/dbraw/zinc/04/36/80/971043680.db2.gz NZXVQVDQXDOGHN-UHFFFAOYSA-N 2 0 240.310 2.173 20 0 BEADRP CC[C@H]1C[N@H+](CCCCCCC[NH3+])[C@H](C)CO1 ZINC000403915624 971088001 /nfs/dbraw/zinc/08/80/01/971088001.db2.gz OPDNKBAPYNHXIM-KGLIPLIRSA-N 2 0 242.407 2.395 20 0 BEADRP C[C@H]1CC([NH2+]C(C)(C)C(C)(C)[NH3+])C[C@H](C)O1 ZINC001257082859 971096601 /nfs/dbraw/zinc/09/66/01/971096601.db2.gz CGSKMYNZGSUPFF-UWVGGRQHSA-N 2 0 228.380 2.048 20 0 BEADRP CCC[C@@H](CC)N(CCC[NH3+])CCC[NH+](C)C ZINC001257250305 971143616 /nfs/dbraw/zinc/14/36/16/971143616.db2.gz YPJJDEBHGRGRKE-CQSZACIVSA-N 2 0 243.439 2.168 20 0 BEADRP CC(C)O[C@H]1CCC[N@H+](CCC[NH2+]C2CC2)C1 ZINC000404676147 971177309 /nfs/dbraw/zinc/17/73/09/971177309.db2.gz XZAQFLARIWEKBQ-AWEZNQCLSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@H]1C[C@H](C[NH+]2CCC(F)(F)CC2)CC[NH2+]1 ZINC000405013369 971189550 /nfs/dbraw/zinc/18/95/50/971189550.db2.gz GHRFXDYGMWTHAK-WDEREUQCSA-N 2 0 232.318 2.106 20 0 BEADRP [NH3+]CCCCCC[NH+]1CCC(F)(F)CC1 ZINC000405121215 971199605 /nfs/dbraw/zinc/19/96/05/971199605.db2.gz WKYXURIPQCMIOY-UHFFFAOYSA-N 2 0 220.307 2.237 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+]CCc2cccc(F)c2)C12CCC2 ZINC000405234158 971212637 /nfs/dbraw/zinc/21/26/37/971212637.db2.gz RZSFDTJANNSJGO-UONOGXRCSA-N 2 0 248.345 2.228 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+]C2Cc3ccccc3C2)C12CCC2 ZINC000405238171 971213096 /nfs/dbraw/zinc/21/30/96/971213096.db2.gz GFEBWCCTDGOVFR-LSDHHAIUSA-N 2 0 242.366 2.013 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]C2Cc3ccccc3C2)C12CCC2 ZINC000405238168 971213534 /nfs/dbraw/zinc/21/35/34/971213534.db2.gz GFEBWCCTDGOVFR-CABCVRRESA-N 2 0 242.366 2.013 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+][C@H]1C[C@H]([NH3+])C12CCC2 ZINC000405224824 971214338 /nfs/dbraw/zinc/21/43/38/971214338.db2.gz OBMJTKRADVSEHM-XBFCOCLRSA-N 2 0 248.370 2.460 20 0 BEADRP CSCCCCC[NH2+][C@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405236760 971214465 /nfs/dbraw/zinc/21/44/65/971214465.db2.gz FBRDRALJKOSGGL-NEPJUHHUSA-N 2 0 242.432 2.379 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]C[C@@H]2CCCC2(F)F)C12CCC2 ZINC000405270627 971221632 /nfs/dbraw/zinc/22/16/32/971221632.db2.gz RQJKQKKEAQDXQN-AXFHLTTASA-N 2 0 244.329 2.281 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]C[C@H]2CCCC2(F)F)C12CCC2 ZINC000405270629 971222447 /nfs/dbraw/zinc/22/24/47/971222447.db2.gz RQJKQKKEAQDXQN-GMTAPVOTSA-N 2 0 244.329 2.281 20 0 BEADRP CCC[C@H](C)[N@@H+]1C[C@H]2CC[NH+](C)C[C@H]2C1 ZINC001257321130 971222717 /nfs/dbraw/zinc/22/27/17/971222717.db2.gz YRIZVRAFIVSCAM-XQQFMLRXSA-N 2 0 210.365 2.059 20 0 BEADRP CCC[C@H](C)[N@@H+]1C[C@H]2C[C@@]2(C[NH+](C)C)C1 ZINC001257324905 971228514 /nfs/dbraw/zinc/22/85/14/971228514.db2.gz WUEUTYRHXVAGGU-YNEHKIRRSA-N 2 0 210.365 2.059 20 0 BEADRP CCSCC[C@H](C)[NH2+][C@@H]1C[C@H]([NH3+])C12CCC2 ZINC000405278868 971228600 /nfs/dbraw/zinc/22/86/00/971228600.db2.gz YJFKYHGNVXJJJH-SDDRHHMPSA-N 2 0 242.432 2.378 20 0 BEADRP C[C@H](CC(F)(F)F)[NH2+][C@@H]1C[C@H]([NH3+])C12CCC2 ZINC000405272491 971229029 /nfs/dbraw/zinc/22/90/29/971229029.db2.gz SPYFWCCDKKZEQG-HRDYMLBCSA-N 2 0 236.281 2.187 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]C[C@@H]2CC[C@@H]3C[C@@H]3C2)C12CCC2 ZINC000405337826 971234766 /nfs/dbraw/zinc/23/47/66/971234766.db2.gz BDOFCIDOPTVMPS-RGDJUOJXSA-N 2 0 234.387 2.282 20 0 BEADRP [NH3+]CCCCCCO[C@@H]1C[NH2+]Cc2ccccc21 ZINC001217940955 1169547499 /nfs/dbraw/zinc/54/74/99/1169547499.db2.gz MQCCXXXWWZWVIO-OAHLLOKOSA-N 2 0 248.370 2.367 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]C[C@@H]2CC[C@H]3C[C@H]3C2)C12CCC2 ZINC000405337822 971236950 /nfs/dbraw/zinc/23/69/50/971236950.db2.gz BDOFCIDOPTVMPS-ITGHMWBKSA-N 2 0 234.387 2.282 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+]CCC2CCCC2)C12CCC2 ZINC000405352586 971241572 /nfs/dbraw/zinc/24/15/72/971241572.db2.gz PEASADJSFIVYMN-QWHCGFSZSA-N 2 0 222.376 2.426 20 0 BEADRP C[C@H]1CC[C@H]([NH2+][C@H]2C[C@@H]([NH3+])C23CCC3)CC1 ZINC000405376505 971249790 /nfs/dbraw/zinc/24/97/90/971249790.db2.gz BMRMGLRTOZBWGS-LPWJVIDDSA-N 2 0 222.376 2.425 20 0 BEADRP C[C@H]([NH2+][C@H]1C[C@H]([NH3+])C12CCC2)C1CCC1 ZINC000405469377 971257864 /nfs/dbraw/zinc/25/78/64/971257864.db2.gz KOBPGWDZWBLXCE-DLOVCJGASA-N 2 0 208.349 2.035 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+]CCC2CCC2)C12CCC2 ZINC000405430956 971252554 /nfs/dbraw/zinc/25/25/54/971252554.db2.gz AWKXXUKSMIHNGU-NWDGAFQWSA-N 2 0 208.349 2.036 20 0 BEADRP CC(C)(C)CC[NH2+][C@@H]1C[C@H]([NH3+])C12CCC2 ZINC000405439414 971253835 /nfs/dbraw/zinc/25/38/35/971253835.db2.gz DGFVGPJOXZRWNE-WDEREUQCSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]CCCC2CC2)C12CCC2 ZINC000405430244 971255279 /nfs/dbraw/zinc/25/52/79/971255279.db2.gz APYJKRHRJONERA-RYUDHWBXSA-N 2 0 208.349 2.036 20 0 BEADRP COc1cccc(C[NH2+][C@@H]2C[C@@H]([NH3+])C23CCC3)c1 ZINC000405493507 971262941 /nfs/dbraw/zinc/26/29/41/971262941.db2.gz PNMCXMSLJNLLOC-ZIAGYGMSSA-N 2 0 246.354 2.055 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+][C@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405509880 971263794 /nfs/dbraw/zinc/26/37/94/971263794.db2.gz SNJXBVHCCRGBPH-KXNHARMFSA-N 2 0 208.349 2.035 20 0 BEADRP CC[C@H](C)[NH2+]CCCC1CC[NH+](C)CC1 ZINC001257432434 971340625 /nfs/dbraw/zinc/34/06/25/971340625.db2.gz XQSFRRYOXRWFRZ-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP CCC[N@H+](CCC[NH+](C)C)[C@@H](C)CC ZINC001257446967 971362479 /nfs/dbraw/zinc/36/24/79/971362479.db2.gz UUMXSHCLZSPHGI-LBPRGKRZSA-N 2 0 200.370 2.449 20 0 BEADRP C[C@@]1(C[NH3+])CCCN(c2[nH+]ccc3[nH]ccc32)C1 ZINC001158675110 971388163 /nfs/dbraw/zinc/38/81/63/971388163.db2.gz ICIKWKNNWGLWJW-AWEZNQCLSA-N 2 0 244.342 2.128 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1OCc1cccc(C[NH3+])c1 ZINC001217779307 971400529 /nfs/dbraw/zinc/40/05/29/971400529.db2.gz CYWJGWFLMKBJPP-SWLSCSKDSA-N 2 0 248.370 2.050 20 0 BEADRP C[C@H]1C[NH2+]CCC[C@@H]1OCc1ccccc1C[NH3+] ZINC001217781396 971403370 /nfs/dbraw/zinc/40/33/70/971403370.db2.gz RQEVJOOJZOTSQE-WFASDCNBSA-N 2 0 248.370 2.050 20 0 BEADRP C[NH+](C)CC1CC[NH+]([C@@H]2CCCSC2)CC1 ZINC001257678697 971482082 /nfs/dbraw/zinc/48/20/82/971482082.db2.gz XGCVCWYADHETNB-CYBMUJFWSA-N 2 0 242.432 2.156 20 0 BEADRP C[C@H]1CC[C@H](OCCCCCCC[NH3+])C[NH2+]1 ZINC001217914189 971514617 /nfs/dbraw/zinc/51/46/17/971514617.db2.gz XDBABFLPGVEPGY-STQMWFEESA-N 2 0 228.380 2.053 20 0 BEADRP CC(C)C[NH+]1CCC(n2cccc2C[NH3+])CC1 ZINC001258002743 971555075 /nfs/dbraw/zinc/55/50/75/971555075.db2.gz BLTLWDAXJGAHKL-UHFFFAOYSA-N 2 0 235.375 2.240 20 0 BEADRP C[C@@H]1C[NH2+]CCC[C@H]1Oc1ccc2c(c1)C[NH2+]C2 ZINC001217989089 971562584 /nfs/dbraw/zinc/56/25/84/971562584.db2.gz LZCCFBIJPBUDBM-IAQYHMDHSA-N 2 0 246.354 2.057 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1Oc1cccc2c1C[NH2+]C2 ZINC001218027898 971576201 /nfs/dbraw/zinc/57/62/01/971576201.db2.gz BHIJZWQXCLRKKY-FZMZJTMJSA-N 2 0 246.354 2.057 20 0 BEADRP [NH3+]Cc1ccccc1O[C@@H]1CCC[C@]12CC[NH2+]C2 ZINC001218089475 971596730 /nfs/dbraw/zinc/59/67/30/971596730.db2.gz FUHJXMLZRXIFQQ-HUUCEWRRSA-N 2 0 246.354 2.056 20 0 BEADRP C[NH2+][C@H]1CC[C@H](Oc2ccc(C[NH3+])cc2)CC1 ZINC001218189897 971625441 /nfs/dbraw/zinc/62/54/41/971625441.db2.gz NQSBWKIAMNCXEC-MQMHXKEQSA-N 2 0 234.343 2.055 20 0 BEADRP CCN1CCC([NH2+][C@H]2C[C@@H]3[C@H](C2)C3(C)C)CC1 ZINC001170714985 971633927 /nfs/dbraw/zinc/63/39/27/971633927.db2.gz CTOMLUHINZCEOK-BTTYYORXSA-N 2 0 236.403 2.495 20 0 BEADRP N[C@@H]1CC[N@H+](C[C@@H]2CC=CCC2)CC[C@@H]1F ZINC001206155565 974327519 /nfs/dbraw/zinc/32/75/19/974327519.db2.gz MGGVDBYUVHOCRS-FRRDWIJNSA-N 2 0 226.339 2.104 20 0 BEADRP C[N@@H+]1CCC[C@@H]1CC[NH2+][C@@H]1C[C@@H]2[C@H](C1)C2(C)C ZINC001170724410 971655844 /nfs/dbraw/zinc/65/58/44/971655844.db2.gz JIVZODBRRWHDKH-SYQHCUMBSA-N 2 0 236.403 2.495 20 0 BEADRP CC1(C)[C@@H]2C[C@@H]([NH+]3CCC(C)([NH3+])CC3)C[C@@H]21 ZINC001170727549 971665001 /nfs/dbraw/zinc/66/50/01/971665001.db2.gz OBUABCHEVVJQSK-CNDDSTCGSA-N 2 0 222.376 2.234 20 0 BEADRP C[NH+](C)CCC[N@H+](C)[C@@H]1C[C@@H]2[C@H](C1)C2(C)C ZINC001170737916 971682430 /nfs/dbraw/zinc/68/24/30/971682430.db2.gz DDWGZZOWHDSLOP-XYYAHUGASA-N 2 0 224.392 2.305 20 0 BEADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]C[C@H]1C[C@H](F)C1)C2 ZINC001172101721 974358806 /nfs/dbraw/zinc/35/88/06/974358806.db2.gz AAZKMYMKOSTMOT-ZAEXQNMVSA-N 2 0 240.366 2.339 20 0 BEADRP CCCC[N@H+](C)CCC[NH2+][C@H]1CCCOCC1 ZINC001170775746 971799870 /nfs/dbraw/zinc/79/98/70/971799870.db2.gz LSTIWFAZXZWPRF-AWEZNQCLSA-N 2 0 242.407 2.267 20 0 BEADRP C[C@H]([NH3+])c1ccc(O[C@@H]2CC[C@H]3C[NH2+]C[C@H]32)cc1 ZINC001218461834 971824308 /nfs/dbraw/zinc/82/43/08/971824308.db2.gz AZEULKGMQMOMNV-OBCWZRDOSA-N 2 0 246.354 2.083 20 0 BEADRP CC1(C)C[C@H](Oc2ccc(C[NH3+])cc2)CC[NH2+]1 ZINC001218478863 971828319 /nfs/dbraw/zinc/82/83/19/971828319.db2.gz PSIFTRDVYJURHQ-CYBMUJFWSA-N 2 0 234.343 2.055 20 0 BEADRP CCC[C@H](C)C[NH+]1CCC(F)(C[NH3+])CC1 ZINC001222526519 972542313 /nfs/dbraw/zinc/54/23/13/972542313.db2.gz CMAVBVMXDAGCCP-NSHDSACASA-N 2 0 216.344 2.185 20 0 BEADRP C[NH+](C)Cc1cc(F)cc(C[N@H+](C)C2CC2)c1 ZINC001232144897 1169682370 /nfs/dbraw/zinc/68/23/70/1169682370.db2.gz NKTMXUBVJFOLPO-UHFFFAOYSA-N 2 0 236.334 2.482 20 0 BEADRP Cc1ccsc1C[NH+]1CCC(F)(C[NH3+])CC1 ZINC001222531978 972546102 /nfs/dbraw/zinc/54/61/02/972546102.db2.gz HTOWLGOUKUIXEW-UHFFFAOYSA-N 2 0 242.363 2.319 20 0 BEADRP C[NH+](C)C1CCC([NH2+][C@@H]2C[C@H]2C2CC2)CC1 ZINC000309984364 971911392 /nfs/dbraw/zinc/91/13/92/971911392.db2.gz XRRMBRLJAHUWEM-CLRIEMFWSA-N 2 0 222.376 2.247 20 0 BEADRP C[C@@H]([NH3+])CCNc1ccccc1C(C)(C)[NH3+] ZINC001170890090 972039582 /nfs/dbraw/zinc/03/95/82/972039582.db2.gz DPGDVQXGJXDCRX-SNVBAGLBSA-N 2 0 221.348 2.030 20 0 BEADRP CC1=Cc2cccc(N[C@@H]([NH3+])CCC[NH3+])c2C1 ZINC001170899710 972057591 /nfs/dbraw/zinc/05/75/91/972057591.db2.gz DQQWBKWRINZQHR-CQSZACIVSA-N 2 0 231.343 2.082 20 0 BEADRP CC1=Cc2cccc(N[C@H]([NH3+])CCC[NH3+])c2C1 ZINC001170899708 972061125 /nfs/dbraw/zinc/06/11/25/972061125.db2.gz DQQWBKWRINZQHR-AWEZNQCLSA-N 2 0 231.343 2.082 20 0 BEADRP CSc1cc(N[C@@H]([NH3+])CCC[NH3+])ccc1C ZINC001170903259 972075002 /nfs/dbraw/zinc/07/50/02/972075002.db2.gz ISCCFYUJHFPYBC-GFCCVEGCSA-N 2 0 239.388 2.153 20 0 BEADRP CCCCc1cccc(N[C@@H]([NH3+])CCC[NH3+])c1 ZINC001170902499 972077766 /nfs/dbraw/zinc/07/77/66/972077766.db2.gz DTCPWNFPVXVUTL-CQSZACIVSA-N 2 0 235.375 2.465 20 0 BEADRP CCC1CCC([NH2+][C@@H]2CC[NH2+][C@@H]2C)CC1 ZINC001246113601 972177912 /nfs/dbraw/zinc/17/79/12/972177912.db2.gz XBRAITDNHKIJHN-IKWCTNDRSA-N 2 0 210.365 2.295 20 0 BEADRP C[N@@H+]1CCC=C(c2ccc([C@@H]3CC[NH2+]C3)cc2)C1 ZINC001241571279 1169732558 /nfs/dbraw/zinc/73/25/58/1169732558.db2.gz XNWYCRLTJUUIPF-OAHLLOKOSA-N 2 0 242.366 2.482 20 0 BEADRP C[C@H]1CC([NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]23)C[C@H](C)C1 ZINC001246178578 972207386 /nfs/dbraw/zinc/20/73/86/972207386.db2.gz PADVIRTYXYECEK-MYYUVRNCSA-N 2 0 236.403 2.399 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C2(Cc3ccccc3)CC2)CC[NH2+]1 ZINC001246187048 972211409 /nfs/dbraw/zinc/21/14/09/972211409.db2.gz FPYQQIHGEMKXTG-UKRRQHHQSA-N 2 0 244.382 2.492 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@H]2C[C@@H]([NH3+])C2)CC(C)(C)C1 ZINC001246190717 972213365 /nfs/dbraw/zinc/21/33/65/972213365.db2.gz RRESNSRJXWDVKA-WISYIIOYSA-N 2 0 210.365 2.281 20 0 BEADRP CC1(C)CC([NH2+]C[C@H]2CCC[NH2+]2)CC(C)(C)O1 ZINC001246187927 972213614 /nfs/dbraw/zinc/21/36/14/972213614.db2.gz RJSZCXRUICASCL-LLVKDONJSA-N 2 0 240.391 2.064 20 0 BEADRP COC1CCC([N@H+](C)CCCCCC[NH3+])CC1 ZINC000710782723 956870772 /nfs/dbraw/zinc/87/07/72/956870772.db2.gz XSDKNISCLLCGFV-UHFFFAOYSA-N 2 0 242.407 2.395 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@H+]1[C@@H]2CC[C@H]1CC(C)C2 ZINC000692940871 956885350 /nfs/dbraw/zinc/88/53/50/956885350.db2.gz NREFATIJYOIBFL-YUSLTOFOSA-N 2 0 222.376 2.105 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH+]2CCC(C)(C)CC2)C1 ZINC001208606285 957091840 /nfs/dbraw/zinc/09/18/40/957091840.db2.gz DTDLEGKCYVRLMK-ZDUSSCGKSA-N 2 0 224.392 2.450 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH+]2CC[C@@]3(CC3(F)F)C2)C1 ZINC001208608038 957092298 /nfs/dbraw/zinc/09/22/98/957092298.db2.gz FFWLNUVBWLTUMV-VXGBXAGGSA-N 2 0 244.329 2.059 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH+]2CCC[C@H](CF)C2)C1 ZINC001208613670 957108046 /nfs/dbraw/zinc/10/80/46/957108046.db2.gz XORMEPLPFXMULV-CHWSQXEVSA-N 2 0 228.355 2.010 20 0 BEADRP Cc1cccc(C(=[NH2+])N[C@@H]2CC[C@H](C)[NH2+]C2)c1 ZINC001246285312 972255452 /nfs/dbraw/zinc/25/54/52/972255452.db2.gz RJACSVCMGLWXEA-WCQYABFASA-N 2 0 231.343 2.050 20 0 BEADRP FC[C@H]1[C@@H]2C[N@H+](CCC[NH+]3CCCCC3)C[C@H]12 ZINC001209451374 957477691 /nfs/dbraw/zinc/47/76/91/957477691.db2.gz WIJLTDWOBIEFPC-ZSOGYDGISA-N 2 0 240.366 2.010 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@@H]1CCc2cc(F)ccc2C1 ZINC001246313813 972276097 /nfs/dbraw/zinc/27/60/97/972276097.db2.gz LNXWBDBAUSOIIT-UONOGXRCSA-N 2 0 236.334 2.010 20 0 BEADRP C[C@@H]1CC[C@@H](C[NH2+]C2CCCCC2)C[NH2+]1 ZINC000397543179 957681498 /nfs/dbraw/zinc/68/14/98/957681498.db2.gz ZAPBZJVGIOZXED-VXGBXAGGSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]1C[C@H]([NH2+]Cc2ccc3ncoc3c2)CC[NH2+]1 ZINC001246335589 972294956 /nfs/dbraw/zinc/29/49/56/972294956.db2.gz ZPTCXCWDNHTPGS-CMPLNLGQSA-N 2 0 245.326 2.058 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]C2CC3(C2)CC(F)(F)C3)CC[NH2+]1 ZINC001246336303 972297593 /nfs/dbraw/zinc/29/75/93/972297593.db2.gz UNWIFSUPZWPXDQ-UWVGGRQHSA-N 2 0 244.329 2.294 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+][C@H]2CC[C@H](C)NC2)CC1 ZINC001246365974 972305513 /nfs/dbraw/zinc/30/55/13/972305513.db2.gz WBDZXLQYWUOUOZ-RVMXOQNASA-N 2 0 210.365 2.295 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1CCC[C@H]([C@@H](C)[NH3+])C1 ZINC000723122322 958161474 /nfs/dbraw/zinc/16/14/74/958161474.db2.gz OPFPFUQLTAPWHT-NDBYEHHHSA-N 2 0 210.365 2.092 20 0 BEADRP CCC1CCC([NH2+][C@H]2C[C@@](C)([NH3+])C2)CC1 ZINC001246460430 972332596 /nfs/dbraw/zinc/33/25/96/972332596.db2.gz MSGLQUBYQVMYFT-BPNZPQAUSA-N 2 0 210.365 2.425 20 0 BEADRP CC[C@]1([NH2+][C@@H]2CCC[C@@H](C)C2)CC[NH2+]C1 ZINC001246461877 972336122 /nfs/dbraw/zinc/33/61/22/972336122.db2.gz QHBGXPVPTHBTDF-UPJWGTAASA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@H]1CC[C@@H]([NH2+]C[C@@]2(C)CCC[NH2+]2)C1 ZINC001246466027 972339907 /nfs/dbraw/zinc/33/99/07/972339907.db2.gz KEHXUSNSDMBCCS-YNEHKIRRSA-N 2 0 210.365 2.297 20 0 BEADRP CCCC[C@H](C)[NH2+]C[C@H]1C[NH2+]C[C@@H](C)C1 ZINC000398720956 958373447 /nfs/dbraw/zinc/37/34/47/958373447.db2.gz AYWDCGKCEZKRIC-RWMBFGLXSA-N 2 0 212.381 2.400 20 0 BEADRP [NH3+]C[C@H]1C[N@H+](CCC2CCCC2)CCC1(F)F ZINC000403285771 958441126 /nfs/dbraw/zinc/44/11/26/958441126.db2.gz QXPQDCJGLSBYJT-LBPRGKRZSA-N 2 0 246.345 2.483 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[N@@H+]2CC[C@@H](c3ccccc3)C2)C1 ZINC000693547770 958762396 /nfs/dbraw/zinc/76/23/96/958762396.db2.gz SBZIEJGGZJOHIU-YUELXQCFSA-N 2 0 230.355 2.213 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@H]2CCCC[C@@H]2C2CC2)C1 ZINC000693562209 958806941 /nfs/dbraw/zinc/80/69/41/958806941.db2.gz MVTOLCGDNQXQTK-CABNGKKXSA-N 2 0 222.376 2.282 20 0 BEADRP CC1CCC([N@H+](C)C[C@H]2C[C@@H]([NH3+])C2)CC1 ZINC000693569467 958864928 /nfs/dbraw/zinc/86/49/28/958864928.db2.gz RCBZAMUJRLPIQK-UNTZMWQOSA-N 2 0 210.365 2.234 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+][C@@H]2CCCC[C@@H]2C2CC2)C1 ZINC000693602694 958937505 /nfs/dbraw/zinc/93/75/05/958937505.db2.gz MVTOLCGDNQXQTK-FMKGYKFTSA-N 2 0 222.376 2.282 20 0 BEADRP Cc1ccc([C@H](C)[NH2+][C@@H](C)C2C[NH2+]C2)s1 ZINC000686245414 959088776 /nfs/dbraw/zinc/08/87/76/959088776.db2.gz CBGQAOLVYQMYKX-UWVGGRQHSA-N 2 0 224.373 2.315 20 0 BEADRP CCOC(C)(C)C[N@@H+]1CCC[C@@]12CCC[NH2+]C2 ZINC001222237549 972415940 /nfs/dbraw/zinc/41/59/40/972415940.db2.gz MORCLMZKLURTQM-CQSZACIVSA-N 2 0 240.391 2.020 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@H]([NH3+])C12CCC2)c1cccnc1 ZINC000405254080 959421076 /nfs/dbraw/zinc/42/10/76/959421076.db2.gz LJTYEXWMQXWGAV-WCFLWFBJSA-N 2 0 231.343 2.002 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]CC2(C3CC3)CC2)C12CCC2 ZINC000405258565 959425196 /nfs/dbraw/zinc/42/51/96/959425196.db2.gz HUCMFZNZYPMVDH-RYUDHWBXSA-N 2 0 220.360 2.036 20 0 BEADRP [NH3+]CCCCCCCO[C@H]1CCC[NH2+]C[C@H]1F ZINC001217766057 959582120 /nfs/dbraw/zinc/58/21/20/959582120.db2.gz PVLZQSUECCYDKC-OLZOCXBDSA-N 2 0 246.370 2.002 20 0 BEADRP CC1(C)C[C@@H](OCc2cccc(C[NH3+])c2)CC[NH2+]1 ZINC001217936509 959788173 /nfs/dbraw/zinc/78/81/73/959788173.db2.gz OEWMUAVLABTMTR-AWEZNQCLSA-N 2 0 248.370 2.193 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H](C)Cc1ccccc1Cl ZINC000309276428 959825382 /nfs/dbraw/zinc/82/53/82/959825382.db2.gz DVGGTMLYSYYFHR-MNOVXSKESA-N 2 0 240.778 2.455 20 0 BEADRP C[C@H]([NH3+])c1ccc(O[C@@H]2CC[C@@]23CC[NH2+]C3)cc1 ZINC001218126138 959870913 /nfs/dbraw/zinc/87/09/13/959870913.db2.gz YVPLRBDGKWYPFK-GLQYFDAESA-N 2 0 246.354 2.227 20 0 BEADRP [NH3+]Cc1ccccc1OC1CC2(C1)CCC[NH2+]C2 ZINC001218255924 959916860 /nfs/dbraw/zinc/91/68/60/959916860.db2.gz PMEVQGZKYPWTNI-UHFFFAOYSA-N 2 0 246.354 2.056 20 0 BEADRP C[C@@H]1CC[N@H+](CCC2CCCC2)C[C@@H]1[NH3+] ZINC000300747537 959922730 /nfs/dbraw/zinc/92/27/30/959922730.db2.gz JXHFPXQKVKXXPT-YPMHNXCESA-N 2 0 210.365 2.236 20 0 BEADRP CCC1CCC([N@@H+]2C[C@H](C)[C@H](C[NH3+])C2)CC1 ZINC000708884952 960076886 /nfs/dbraw/zinc/07/68/86/960076886.db2.gz BIAWHVXJZMKCBT-RJZJGCCBSA-N 2 0 224.392 2.482 20 0 BEADRP Cc1cccc2c1C[N@H+](CC1CC[NH2+]CC1)C2 ZINC001207436551 960090731 /nfs/dbraw/zinc/09/07/31/960090731.db2.gz NVUSVZXZQVMWKK-UHFFFAOYSA-N 2 0 230.355 2.310 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+][C@H]1CCCC2(CC2)C1 ZINC000695690581 960375505 /nfs/dbraw/zinc/37/55/05/960375505.db2.gz ODAMBDIBVMIXFX-STQMWFEESA-N 2 0 240.391 2.053 20 0 BEADRP C[NH+]1CCC(CC[N@@H+]2CCC[C@H](CF)C2)CC1 ZINC001207484328 960451985 /nfs/dbraw/zinc/45/19/85/960451985.db2.gz JFGIUQOSKXRCFZ-CQSZACIVSA-N 2 0 242.382 2.400 20 0 BEADRP C/C(=C\C=C\N)[NH2+]CCC[N@H+]1CCCC[C@H]1C ZINC001167753398 960542635 /nfs/dbraw/zinc/54/26/35/960542635.db2.gz OBCNBPHBNSLTHF-QUZUDMBRSA-N 2 0 237.391 2.217 20 0 BEADRP C[C@H]1CCCC[N@@H+]1CCCNc1ccc[n+](C)c1 ZINC001167753314 960543887 /nfs/dbraw/zinc/54/38/87/960543887.db2.gz HDPLSAHAXRMWHG-AWEZNQCLSA-N 2 0 248.394 2.188 20 0 BEADRP C[C@H](C[NH3+])C[N@H+](C)[C@@H]1CCCC(C)(C)C1 ZINC000709525824 960634276 /nfs/dbraw/zinc/63/42/76/960634276.db2.gz RTKRSYRGDVFZRW-VXGBXAGGSA-N 2 0 212.381 2.482 20 0 BEADRP [NH3+]CC1(F)CC[NH+](Cc2cccs2)CC1 ZINC001222533414 972523784 /nfs/dbraw/zinc/52/37/84/972523784.db2.gz YCXJPSJJZKWGRG-UHFFFAOYSA-N 2 0 228.336 2.011 20 0 BEADRP C[C@@H](Cc1ccco1)[N@@H+]1CCC[C@@H]([NH3+])CC1 ZINC001246539078 972528415 /nfs/dbraw/zinc/52/84/15/972528415.db2.gz ATHBRRKLTHOCDE-NWDGAFQWSA-N 2 0 222.332 2.024 20 0 BEADRP C[C@H]1C[NH2+]C[C@@H](C[NH2+]C2CCCCC2)C1 ZINC000398808946 961031655 /nfs/dbraw/zinc/03/16/55/961031655.db2.gz OPXNYVQNCMMJFS-NEPJUHHUSA-N 2 0 210.365 2.154 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[N@H+](C)CC1COC1 ZINC001167836812 961215135 /nfs/dbraw/zinc/21/51/35/961215135.db2.gz HPELDGUJRHEVKC-CYBMUJFWSA-N 2 0 242.407 2.075 20 0 BEADRP CO[C@@H](C[N@H+](C)C1CCC([NH3+])CC1)C1CCC1 ZINC000692219534 961360484 /nfs/dbraw/zinc/36/04/84/961360484.db2.gz ZQBZEMVZZUOJKM-RUXDESIVSA-N 2 0 240.391 2.003 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H]1C[C@H]2C[C@H]2C1 ZINC001167892142 961493998 /nfs/dbraw/zinc/49/39/98/961493998.db2.gz SGDFNOSBZBIKKM-ITGUQSILSA-N 2 0 210.365 2.106 20 0 BEADRP C(C1CCCCC1)[NH+]1CC2(C1)CCC[NH2+]C2 ZINC000709809479 961631716 /nfs/dbraw/zinc/63/17/16/961631716.db2.gz SRYRDMMEKACGLP-UHFFFAOYSA-N 2 0 222.376 2.252 20 0 BEADRP C(C1CC1)[NH+]1CCC([NH2+][C@H]2C[C@H]3C[C@H]3C2)CC1 ZINC001167912091 961821177 /nfs/dbraw/zinc/82/11/77/961821177.db2.gz HGCHPPKIIUMBCD-NHAGDIPZSA-N 2 0 234.387 2.249 20 0 BEADRP c1cc(N2CC[NH+]([C@@H]3C[C@H]4C[C@H]4C3)CC2)cc[nH+]1 ZINC001167923760 961989966 /nfs/dbraw/zinc/98/99/66/961989966.db2.gz ITRNCSKUNNVBGT-AGGWBTHJSA-N 2 0 243.354 2.002 20 0 BEADRP Cc1ccc(C[N@@H+]2CCCC[C@@H](C[NH3+])C2)cc1O ZINC001206632248 962122772 /nfs/dbraw/zinc/12/27/72/962122772.db2.gz HOCBAWZMAFLBKG-AWEZNQCLSA-N 2 0 248.370 2.261 20 0 BEADRP C[C@]1([NH3+])CC[N@@H+](C2CCC3(CC3)CC2)C1 ZINC000710149200 962334144 /nfs/dbraw/zinc/33/41/44/962334144.db2.gz IUMGUHNRHCBXIM-LBPRGKRZSA-N 2 0 208.349 2.132 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CC[C@H]2CCC[N@@H+]2C)C1 ZINC000710448748 962379195 /nfs/dbraw/zinc/37/91/95/962379195.db2.gz ZTNXAKBDJYQRAY-FRRDWIJNSA-N 2 0 210.365 2.249 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH2+]CCCc2ccccn2)CC1 ZINC000710433511 962379920 /nfs/dbraw/zinc/37/99/20/962379920.db2.gz IRDQULXGMBLAQC-HNNXBMFYSA-N 2 0 247.386 2.088 20 0 BEADRP CCC1CC[NH+](C2C[C@H]3CC[C@@H](C2)[NH2+]3)CC1 ZINC000710775093 962465007 /nfs/dbraw/zinc/46/50/07/962465007.db2.gz WMZSGRMVLVUKNR-PBWFPOADSA-N 2 0 222.376 2.391 20 0 BEADRP Cc1cnc(NC(=[NH2+])C(C)(C)C)c(C[NH3+])c1 ZINC001155179585 963002779 /nfs/dbraw/zinc/00/27/79/963002779.db2.gz ARVCZTFCJACDRN-UHFFFAOYSA-N 2 0 220.320 2.284 20 0 BEADRP CC[N@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1 ZINC001167982069 963064038 /nfs/dbraw/zinc/06/40/38/963064038.db2.gz VFYHYZVSTNUOAD-PBWFPOADSA-N 2 0 222.376 2.344 20 0 BEADRP c1cc2c(cc[nH+]c2N[C@@]23CCC[C@@H]2[NH2+]CC3)[nH]1 ZINC001155402321 963066058 /nfs/dbraw/zinc/06/60/58/963066058.db2.gz JHUUSBYKCYRNLA-GXTWGEPZSA-N 2 0 242.326 2.259 20 0 BEADRP Cc1cc2[nH]ccc2c(N[C@H](C)C[NH+](C)C)[nH+]1 ZINC001155916266 963202073 /nfs/dbraw/zinc/20/20/73/963202073.db2.gz NRRXLTHIEZNMCJ-SNVBAGLBSA-N 2 0 232.331 2.233 20 0 BEADRP Cc1c[nH+]c(N2C[C@H]3C[C@@]3(C[NH+](C)C)C2)cc1C ZINC001156395516 963330226 /nfs/dbraw/zinc/33/02/26/963330226.db2.gz MONXODNMYAXGDB-UKRRQHHQSA-N 2 0 245.370 2.086 20 0 BEADRP COc1cc[nH+]c(NCC[C@@H]2CCC[N@H+](C)C2)c1 ZINC001156380683 963332506 /nfs/dbraw/zinc/33/25/06/963332506.db2.gz IYQSRRHWXIHREL-LBPRGKRZSA-N 2 0 249.358 2.234 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]C2CCC(CC[NH3+])CC2)CCO1 ZINC001168090324 963680553 /nfs/dbraw/zinc/68/05/53/963680553.db2.gz CESITGIGXQWSGE-ABXWRUBCSA-N 2 0 240.391 2.051 20 0 BEADRP CCC[N@H+](CCC[NH+](C)C)[C@H]1CCO[C@H](C)C1 ZINC001168141952 963847546 /nfs/dbraw/zinc/84/75/46/963847546.db2.gz KNPYWDCFKWTLDR-KGLIPLIRSA-N 2 0 242.407 2.218 20 0 BEADRP CCOc1cc[nH+]c(N2CCC[C@](C)(C[NH3+])C2)c1 ZINC001158679828 963903953 /nfs/dbraw/zinc/90/39/53/963903953.db2.gz ZNMHVFNKOWFNEB-CQSZACIVSA-N 2 0 249.358 2.046 20 0 BEADRP CC[N@H+]1C[C@@H]2C[NH+](C3CCC(C)CC3)C[C@@H]2C1 ZINC001168225411 964008251 /nfs/dbraw/zinc/00/82/51/964008251.db2.gz ZPOKIWKYAHDBCE-HFDVOGEKSA-N 2 0 236.403 2.449 20 0 BEADRP C[C@@H]([NH3+])CCNc1cccc(C2CC2)n1 ZINC001159780097 964187964 /nfs/dbraw/zinc/18/79/64/964187964.db2.gz PXNCKHNDUIFYOV-SECBINFHSA-N 2 0 205.305 2.108 20 0 BEADRP c1nc2c(cccc2Nc2cc[nH+]cc2)[nH]1 ZINC001213026191 964410940 /nfs/dbraw/zinc/41/09/40/964410940.db2.gz MSDLQPMFDVSENH-UHFFFAOYSA-N 2 0 210.240 2.123 20 0 BEADRP CC(C)[NH+]1CC(Nc2cccc3c2CC[C@@H]3[NH3+])C1 ZINC001168317423 964431380 /nfs/dbraw/zinc/43/13/80/964431380.db2.gz KTVVRQPPIFQVOW-AWEZNQCLSA-N 2 0 245.370 2.137 20 0 BEADRP C[NH+](C)C1CCC([NH+]2C3CCC2CC3)CC1 ZINC001168324826 964445836 /nfs/dbraw/zinc/44/58/36/964445836.db2.gz YAERCEDIKNDYKW-UHFFFAOYSA-N 2 0 222.376 2.486 20 0 BEADRP C[N@H+](C[C@@H]1C[C@H]2C[C@H]2C1)C1CCC([NH3+])CC1 ZINC000697782954 964518493 /nfs/dbraw/zinc/51/84/93/964518493.db2.gz DQHDYWKSSKGHAF-NSQMUIRCSA-N 2 0 222.376 2.234 20 0 BEADRP CC(C)[C@@H]1C[C@H]([NH2+]CC[C@@H](C)[NH+](C)C)CCO1 ZINC000697824946 964549188 /nfs/dbraw/zinc/54/91/88/964549188.db2.gz DKGLEQFJOPLZNX-MCIONIFRSA-N 2 0 242.407 2.120 20 0 BEADRP C[C@@H](CC[NH2+][C@@H]1CCCSCC1)[NH+](C)C ZINC000697846251 964565795 /nfs/dbraw/zinc/56/57/95/964565795.db2.gz BZIIGUOBLCEKMP-NWDGAFQWSA-N 2 0 230.421 2.202 20 0 BEADRP C[NH+](C)CCCCNc1c[nH+]cc2cc[nH]c21 ZINC001161731226 964719194 /nfs/dbraw/zinc/71/91/94/964719194.db2.gz VUSFVINVXFXNPN-UHFFFAOYSA-N 2 0 232.331 2.317 20 0 BEADRP [NH3+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C[C@@H]1C[C@H]2C[C@H]2C1 ZINC000697934445 964747535 /nfs/dbraw/zinc/74/75/35/964747535.db2.gz ZXRNYRYSLGSHOZ-ABIMDTOASA-N 2 0 234.387 2.377 20 0 BEADRP Cc1cc(N(C)C)[nH+]cc1N[C@H]1CCC[C@H]([NH3+])C1 ZINC001162395723 964956778 /nfs/dbraw/zinc/95/67/78/964956778.db2.gz FPZLABDDCJFFIS-RYUDHWBXSA-N 2 0 248.374 2.138 20 0 BEADRP [NH3+][C@H]1CCC[C@@H](Nc2c[nH+]cc3cc[nH]c32)C1 ZINC001162396449 964956823 /nfs/dbraw/zinc/95/68/23/964956823.db2.gz JJMOZTVQHVQLDO-WDEREUQCSA-N 2 0 230.315 2.245 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H](Nc2ccc(C3([NH3+])CC3)cc2)C1 ZINC001162399337 964959143 /nfs/dbraw/zinc/95/91/43/964959143.db2.gz BAXDQRDNHXDOPH-TZMCWYRMSA-N 2 0 245.370 2.316 20 0 BEADRP CCc1cccc(N[C@@H]2CCC[C@H]([NH3+])C2)n1 ZINC001162401566 964959980 /nfs/dbraw/zinc/95/99/80/964959980.db2.gz LHQUZCDXSJRTCJ-CMPLNLGQSA-N 2 0 219.332 2.326 20 0 BEADRP Cn1ccc2c1[nH+]ccc2N[C@@H]1CCC[C@@H]([NH3+])C1 ZINC001162405695 964966049 /nfs/dbraw/zinc/96/60/49/964966049.db2.gz WUQCXSYDBXOSEL-GHMZBOCLSA-N 2 0 244.342 2.255 20 0 BEADRP Cc1ccc(NC[C@H]2CCC[NH2+]C[C@H]2C)[nH+]c1N ZINC001162460219 964988082 /nfs/dbraw/zinc/98/80/82/964988082.db2.gz HYGSQTWBFWOCNS-VXGBXAGGSA-N 2 0 248.374 2.020 20 0 BEADRP Cc1c[nH+]c(NC[C@H]2C[NH2+][C@H](C)C2)c2[nH]ccc21 ZINC001162552682 965042424 /nfs/dbraw/zinc/04/24/24/965042424.db2.gz ODCOKNXIUDFUAZ-GHMZBOCLSA-N 2 0 244.342 2.281 20 0 BEADRP CC[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CC[C@H](C)C2)C1 ZINC000164468197 965089515 /nfs/dbraw/zinc/08/95/15/965089515.db2.gz GDDKHENKRRFJEC-BFHYXJOUSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C=CCC1)C1CC[NH+](C)CC1 ZINC000698207358 965105984 /nfs/dbraw/zinc/10/59/84/965105984.db2.gz WLVFBEALUMOTGD-DGCLKSJQSA-N 2 0 208.349 2.025 20 0 BEADRP C1=C[C@H]([NH2+]C2CCN(c3cc[nH+]cc3)CC2)CC1 ZINC000698240596 965124964 /nfs/dbraw/zinc/12/49/64/965124964.db2.gz NIFXDROUGYKUNR-ZDUSSCGKSA-N 2 0 243.354 2.359 20 0 BEADRP C/C=C(\NC=[NH2+])n1c2ccccc2nc1[C@H](C)[NH3+] ZINC001162759969 965155048 /nfs/dbraw/zinc/15/50/48/965155048.db2.gz VEHNKLKRXIEDEP-GPUHIPEOSA-N 2 0 243.314 2.071 20 0 BEADRP CC(C)[C@H]([NH3+])CC[N@H+](C)CC1CC(C)C1 ZINC000691033370 965268429 /nfs/dbraw/zinc/26/84/29/965268429.db2.gz NAYCNFXWKUZTLV-WXRRBKDZSA-N 2 0 212.381 2.338 20 0 BEADRP C[NH+](C)CC1CCC(Nc2cc(N)cc[nH+]2)CC1 ZINC001163296970 965324845 /nfs/dbraw/zinc/32/48/45/965324845.db2.gz YTWAYAAJYYPLAR-UHFFFAOYSA-N 2 0 248.374 2.196 20 0 BEADRP CC(C)[N@@H+]1CC[C@H](Nc2cc(N)cc[nH+]2)[C@H](C)C1 ZINC001163356965 965364034 /nfs/dbraw/zinc/36/40/34/965364034.db2.gz HQBRJADVCVMUEN-YPMHNXCESA-N 2 0 248.374 2.195 20 0 BEADRP c1cc2c[nH+]cc(N[C@H]3C[NH+]4CCC3CC4)c2[nH]1 ZINC001163393469 965396064 /nfs/dbraw/zinc/39/60/64/965396064.db2.gz ZYTBTYLUQAXXTF-ZDUSSCGKSA-N 2 0 242.326 2.069 20 0 BEADRP Cc1cc2[nH+]ccn2cc1N[C@H](C)C[NH+](C)C ZINC001163777512 965580598 /nfs/dbraw/zinc/58/05/98/965580598.db2.gz XATIBQNVNSSEMQ-LLVKDONJSA-N 2 0 232.331 2.005 20 0 BEADRP [NH3+][C@H]1CCC[N@H+](Cc2ccc3cc[nH]c3c2)CC1 ZINC001205094728 965728192 /nfs/dbraw/zinc/72/81/92/965728192.db2.gz OTRFWOZKQWFRKW-AWEZNQCLSA-N 2 0 243.354 2.481 20 0 BEADRP COc1ccc(C[N@@H+]2CCC[C@@H]([NH3+])CC2)cc1C ZINC001205095481 965744819 /nfs/dbraw/zinc/74/48/19/965744819.db2.gz YCUSOEBIWOZDIG-CQSZACIVSA-N 2 0 248.370 2.317 20 0 BEADRP CC(C)N(CCC[NH3+])c1ccccc1C(C)(C)[NH3+] ZINC001164129114 965749588 /nfs/dbraw/zinc/74/95/88/965749588.db2.gz YRRVHXIPKPIRNO-UHFFFAOYSA-N 2 0 249.402 2.444 20 0 BEADRP CC(C)[C@@H]1CC[N@H+](CC2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000699206724 965815670 /nfs/dbraw/zinc/81/56/70/965815670.db2.gz YZVGIHVNUHTNNN-NUDNTCICSA-N 2 0 236.403 2.495 20 0 BEADRP Cc1cc(F)ccc1C[N@@H+]1CCC[C@H]([NH3+])CC1 ZINC001205109543 965828050 /nfs/dbraw/zinc/82/80/50/965828050.db2.gz ICJIRGOMRKLWBL-AWEZNQCLSA-N 2 0 236.334 2.447 20 0 BEADRP COc1ccc(C[N@@H+]2CCC[C@H]([NH3+])CC2)c(C)c1 ZINC001205109695 965829122 /nfs/dbraw/zinc/82/91/22/965829122.db2.gz JLCMMIJMZAXLED-AWEZNQCLSA-N 2 0 248.370 2.317 20 0 BEADRP C[C@@H]1CC[C@@H](C[NH3+])CN1c1[nH+]ccc2[nH]ccc21 ZINC001164456853 965892225 /nfs/dbraw/zinc/89/22/25/965892225.db2.gz TUYOITFPQGEGCK-MNOVXSKESA-N 2 0 244.342 2.127 20 0 BEADRP Cc1c(N)cc[nH+]c1NCC[C@H]1CCC[N@@H+](C)C1 ZINC001165261315 966011660 /nfs/dbraw/zinc/01/16/60/966011660.db2.gz NZCNXJUKRFZTRA-GFCCVEGCSA-N 2 0 248.374 2.116 20 0 BEADRP [NH3+][C@@]12CC[C@@H]1CN(CCCc1ccccc1F)C2 ZINC001235980509 966197014 /nfs/dbraw/zinc/19/70/14/966197014.db2.gz PSCGMKQKIQVFFI-UKRRQHHQSA-N 2 0 248.345 2.181 20 0 BEADRP CC(C)[N@H+](Cc1ccc[nH]1)C1CCN(C)CC1 ZINC001204010969 966853074 /nfs/dbraw/zinc/85/30/74/966853074.db2.gz UHKDCONFIXHNCB-UHFFFAOYSA-N 2 0 235.375 2.319 20 0 BEADRP CC(C)[C@@H]1C[C@H]1[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC001204128144 966899023 /nfs/dbraw/zinc/89/90/23/966899023.db2.gz IXJUVWXWBVTONI-XDQVBPFNSA-N 2 0 222.376 2.247 20 0 BEADRP C[NH+]1CCC2(CC[N@H+](Cc3ccoc3)C2)CC1 ZINC001204245575 966942221 /nfs/dbraw/zinc/94/22/21/966942221.db2.gz OPDLYEBBTAPMRV-UHFFFAOYSA-N 2 0 234.343 2.197 20 0 BEADRP CC/C=C\CC[N@@H+]1CCC[C@@H](C[NH2+]C)C1 ZINC001205000297 967281280 /nfs/dbraw/zinc/28/12/80/967281280.db2.gz CSTVJVWPKFKXFU-ZFDPJTLLSA-N 2 0 210.365 2.274 20 0 BEADRP COc1cc(C)cc(C[NH+]2CCC(C[NH3+])CC2)c1 ZINC001205046279 967301157 /nfs/dbraw/zinc/30/11/57/967301157.db2.gz AXDAGDSZEBKTMS-UHFFFAOYSA-N 2 0 248.370 2.174 20 0 BEADRP [NH3+]CC1CC[NH+](Cc2cncc(C3CC3)c2)CC1 ZINC001205058225 967311914 /nfs/dbraw/zinc/31/19/14/967311914.db2.gz HCTRCYBUCSDGQB-UHFFFAOYSA-N 2 0 245.370 2.130 20 0 BEADRP Cc1cc(CN2[C@@H](C)CC[C@H]2C[NH3+])cs1 ZINC001205089130 967337502 /nfs/dbraw/zinc/33/75/02/967337502.db2.gz YKUQZTFIECXHDR-CABZTGNLSA-N 2 0 224.373 2.368 20 0 BEADRP COc1cc(C[N@@H+]2CCC[C@@H]([NH3+])CC2)ccc1C ZINC001205109071 967352308 /nfs/dbraw/zinc/35/23/08/967352308.db2.gz AHAUBAUCSQUAFY-CQSZACIVSA-N 2 0 248.370 2.317 20 0 BEADRP Cc1cc(C[N@@H+]2CCC[C@H]([NH3+])CC2)cc(C)n1 ZINC001205116893 967362609 /nfs/dbraw/zinc/36/26/09/967362609.db2.gz IRGUOCRMCZETLG-AWEZNQCLSA-N 2 0 233.359 2.012 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@H]([NH3+])CC2)cc1O ZINC001205116528 967368072 /nfs/dbraw/zinc/36/80/72/967368072.db2.gz BHGZNNBOEYKENF-ZDUSSCGKSA-N 2 0 234.343 2.014 20 0 BEADRP COc1c(C)cccc1C[N@@H+]1CCC[C@@H]([NH3+])CC1 ZINC001205124691 967372200 /nfs/dbraw/zinc/37/22/00/967372200.db2.gz YDMGXNLXYOAHNN-CQSZACIVSA-N 2 0 248.370 2.317 20 0 BEADRP Cc1cc(F)cc(C[N@H+]2C[C@H](C)[C@H](C[NH3+])C2)c1 ZINC001205146433 967388213 /nfs/dbraw/zinc/38/82/13/967388213.db2.gz WBHXTUGOMYJNKF-WCQYABFASA-N 2 0 236.334 2.161 20 0 BEADRP Cc1ncccc1C[N@@H+]1CCC[C@](C)([NH3+])CC1 ZINC001205266702 967454747 /nfs/dbraw/zinc/45/47/47/967454747.db2.gz WJEROUVAALZMDX-AWEZNQCLSA-N 2 0 233.359 2.093 20 0 BEADRP C[C@@]1([NH3+])CCC[N@H+](Cc2cccs2)CC1 ZINC001205263860 967455183 /nfs/dbraw/zinc/45/51/83/967455183.db2.gz CXJBDKBLTCVSBV-GFCCVEGCSA-N 2 0 224.373 2.451 20 0 BEADRP Cc1ccnc(C[N@@H+]2CCC[C@@](C)([NH3+])CC2)c1 ZINC001205265828 967455875 /nfs/dbraw/zinc/45/58/75/967455875.db2.gz RQQJPMRYZOEWLJ-CQSZACIVSA-N 2 0 233.359 2.093 20 0 BEADRP C[NH2+]Cc1cccc(CC[NH+]2CCCC2)c1F ZINC001250168188 967466590 /nfs/dbraw/zinc/46/65/90/967466590.db2.gz QMMUOGAQDKAABI-UHFFFAOYSA-N 2 0 236.334 2.183 20 0 BEADRP C[C@]1([NH3+])CCC[N@H+](Cc2ccc3n2CCC3)CC1 ZINC001205296122 967496375 /nfs/dbraw/zinc/49/63/75/967496375.db2.gz HLQNTFUQODTFLT-HNNXBMFYSA-N 2 0 247.386 2.138 20 0 BEADRP CC[C@@H](C)C[N@@H+]1CCC[C@@](F)(C[NH3+])CC1 ZINC001205536729 967666065 /nfs/dbraw/zinc/66/60/65/967666065.db2.gz ACXRJZMQXDUUDS-NEPJUHHUSA-N 2 0 216.344 2.185 20 0 BEADRP CSCCC[N@@H+]1CC[C@@H](C)[C@H](C[NH3+])CC1 ZINC001205603583 967721092 /nfs/dbraw/zinc/72/10/92/967721092.db2.gz QOUFCKSHKPOONP-NEPJUHHUSA-N 2 0 230.421 2.046 20 0 BEADRP Cc1cc(C[N@@H+]2CC[C@@H](C[NH3+])[C@@H](C)CC2)ccn1 ZINC001205617569 967726995 /nfs/dbraw/zinc/72/69/95/967726995.db2.gz KZNMVPWQPNSPCK-WFASDCNBSA-N 2 0 247.386 2.197 20 0 BEADRP Cc1ccncc1C[N@H+]1CC[C@@H](C)[C@@H](C[NH3+])CC1 ZINC001205625599 967736917 /nfs/dbraw/zinc/73/69/17/967736917.db2.gz BSCDQDYIYSIQFM-ZIAGYGMSSA-N 2 0 247.386 2.197 20 0 BEADRP C[C@H]1CC[N@H+](Cc2ccccc2N)CC[C@@H]1C[NH3+] ZINC001205653355 967740671 /nfs/dbraw/zinc/74/06/71/967740671.db2.gz SVVZKTXARLWYFJ-QWHCGFSZSA-N 2 0 247.386 2.076 20 0 BEADRP CS[C@H](C)CC[N@@H+]1CCC[C@H](C[NH3+])[C@@H](C)C1 ZINC001205981712 967898492 /nfs/dbraw/zinc/89/84/92/967898492.db2.gz FWRPTWBQSGLAHA-YNEHKIRRSA-N 2 0 244.448 2.435 20 0 BEADRP C[C@H]1C[N@H+](CCC2CC2)CCC[C@H]1C[NH3+] ZINC001205984708 967929231 /nfs/dbraw/zinc/92/92/31/967929231.db2.gz UKSSZRWVMOJZEA-AAEUAGOBSA-N 2 0 210.365 2.093 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@H](C[NH3+])[C@H](C)C2)cn1 ZINC001206003527 967957529 /nfs/dbraw/zinc/95/75/29/967957529.db2.gz IZYZPZBPWCOLCK-IUODEOHRSA-N 2 0 247.386 2.197 20 0 BEADRP Cc1ccncc1C[N@@H+]1CCC[C@H](C[NH3+])[C@@H](C)C1 ZINC001206003456 967961761 /nfs/dbraw/zinc/96/17/61/967961761.db2.gz IFEYKAYUHQTXJB-UONOGXRCSA-N 2 0 247.386 2.197 20 0 BEADRP C[C@H]1C[N@H+](Cc2ccccc2N)CCC[C@@H]1C[NH3+] ZINC001206026211 967984689 /nfs/dbraw/zinc/98/46/89/967984689.db2.gz QXMJLTNAHKHDIN-QWHCGFSZSA-N 2 0 247.386 2.076 20 0 BEADRP C[C@H]1C[N@H+](Cc2ccccc2N)CCC[C@H]1C[NH3+] ZINC001206026212 967986503 /nfs/dbraw/zinc/98/65/03/967986503.db2.gz QXMJLTNAHKHDIN-STQMWFEESA-N 2 0 247.386 2.076 20 0 BEADRP CCc1cccc(CN2CC[C@@H](C)[C@H]([NH3+])C2)c1 ZINC001206043684 968006501 /nfs/dbraw/zinc/00/65/01/968006501.db2.gz RKJHFKURANVTEO-IUODEOHRSA-N 2 0 232.371 2.418 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@@H]1CCc2cc(F)ccc21 ZINC001118122105 968009070 /nfs/dbraw/zinc/00/90/70/968009070.db2.gz PEVZFXNYJIFNEI-IINYFYTJSA-N 2 0 236.334 2.401 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H]1CCc2cc(F)ccc21 ZINC001118122106 968009912 /nfs/dbraw/zinc/00/99/12/968009912.db2.gz PEVZFXNYJIFNEI-QMTHXVAHSA-N 2 0 236.334 2.401 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@H]2CCCC[C@H]2C2CC2)C1 ZINC000693562218 968075726 /nfs/dbraw/zinc/07/57/26/968075726.db2.gz MVTOLCGDNQXQTK-GHYVTOPFSA-N 2 0 222.376 2.282 20 0 BEADRP Cc1cc(C[N@@H+]2CC[C@@H]([NH3+])[C@H](F)CC2)cs1 ZINC001206214221 968148363 /nfs/dbraw/zinc/14/83/63/968148363.db2.gz XWTCNWDLLMULDH-VXGBXAGGSA-N 2 0 242.363 2.318 20 0 BEADRP C[C@H]1C[NH2+]CCCN1Cc1ccc2c(c1)CCC2 ZINC001206257914 968176114 /nfs/dbraw/zinc/17/61/14/968176114.db2.gz MTMJNUMWTFGHJT-ZDUSSCGKSA-N 2 0 244.382 2.359 20 0 BEADRP C[C@@]1(C[NH3+])CCC[N@H+](C[C@H]2CCCCO2)CC1 ZINC001206297263 968208245 /nfs/dbraw/zinc/20/82/45/968208245.db2.gz XAJUKPBXVFTJBG-ZIAGYGMSSA-N 2 0 240.391 2.006 20 0 BEADRP Cc1cncc(C[N@@H+]2CCC[C@](C)(C[NH3+])CC2)c1 ZINC001206304976 968213361 /nfs/dbraw/zinc/21/33/61/968213361.db2.gz SJSNMFATYFVCFG-HNNXBMFYSA-N 2 0 247.386 2.341 20 0 BEADRP CS[C@@H](C)CC[N@@H+]1CCCC[C@](F)(CN)C1 ZINC001206334965 968239617 /nfs/dbraw/zinc/23/96/17/968239617.db2.gz BIVFUTXTSFMPHV-RYUDHWBXSA-N 2 0 248.411 2.281 20 0 BEADRP CSCCC[N@@H+]1CCCC[C@@](C)(C[NH3+])C1 ZINC001206541996 968353255 /nfs/dbraw/zinc/35/32/55/968353255.db2.gz ORJGTAOOBATCIJ-LBPRGKRZSA-N 2 0 230.421 2.190 20 0 BEADRP C[C@]1(C[NH3+])CCCC[N@H+](CCC2CC2)C1 ZINC001206542034 968367322 /nfs/dbraw/zinc/36/73/22/968367322.db2.gz PMUIOVBXZHUYFM-CYBMUJFWSA-N 2 0 210.365 2.237 20 0 BEADRP Cc1cncc(C[N@@H+]2CCCC[C@@](C)(C[NH3+])C2)c1 ZINC001206547077 968372115 /nfs/dbraw/zinc/37/21/15/968372115.db2.gz BKFSMMJOKPWQJU-HNNXBMFYSA-N 2 0 247.386 2.341 20 0 BEADRP Cc1ccncc1C[N@@H+]1CCCC[C@@](C)(C[NH3+])C1 ZINC001206554544 968378506 /nfs/dbraw/zinc/37/85/06/968378506.db2.gz FCXSXAWZTOHNRK-HNNXBMFYSA-N 2 0 247.386 2.341 20 0 BEADRP CCCC[N@@H+]1C[C@@H]2CC[C@@H]([NH+](C)C)C[C@H]2C1 ZINC001120281392 968559183 /nfs/dbraw/zinc/55/91/83/968559183.db2.gz CGCZXNPJCQLYRQ-MELADBBJSA-N 2 0 224.392 2.449 20 0 BEADRP CCCC[N@@H+]1C[C@@H]2CC[C@H]([NH+](C)C)C[C@@H]2C1 ZINC001120281393 968561330 /nfs/dbraw/zinc/56/13/30/968561330.db2.gz CGCZXNPJCQLYRQ-MJBXVCDLSA-N 2 0 224.392 2.449 20 0 BEADRP C[C@@H]1CCCC[N@@H+]1CC(C)(C)C[NH+](C)C ZINC001207276477 968710040 /nfs/dbraw/zinc/71/00/40/968710040.db2.gz XSERGBYWXTZCHD-GFCCVEGCSA-N 2 0 212.381 2.449 20 0 BEADRP C[NH+](C)CC(C)(C)C[N@@H+]1CC[C@@]2(CC2(F)F)C1 ZINC001207286505 968719970 /nfs/dbraw/zinc/71/99/70/968719970.db2.gz VLYRCCJIKGDRPF-GFCCVEGCSA-N 2 0 246.345 2.305 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2CC[C@H]3CCC[C@H]3C2)CC1 ZINC001207395508 968749143 /nfs/dbraw/zinc/74/91/43/968749143.db2.gz SHCHXBZWVTZPKJ-CABCVRRESA-N 2 0 236.403 2.450 20 0 BEADRP C[C@H]1CC[N@H+](CC2CC[NH+](C)CC2)[C@@H](C)C1 ZINC001207398311 968749427 /nfs/dbraw/zinc/74/94/27/968749427.db2.gz HBRQOIGDVHWSCL-STQMWFEESA-N 2 0 224.392 2.449 20 0 BEADRP CC[N@@H+](Cc1ccccn1)CC1CC[NH+](C)CC1 ZINC001207399023 968750497 /nfs/dbraw/zinc/75/04/97/968750497.db2.gz VZSLXKAOMHJPJY-UHFFFAOYSA-N 2 0 247.386 2.245 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2CC[C@@](C)(F)[C@@H](F)C2)CC1 ZINC001207395044 968751578 /nfs/dbraw/zinc/75/15/78/968751578.db2.gz OJXSXWNQMFYGCH-QWHCGFSZSA-N 2 0 246.345 2.100 20 0 BEADRP C(C1CC[NH2+]CC1)[N@@H+]1CC[C@@H]2CCC[C@@H]2C1 ZINC001207436017 968769994 /nfs/dbraw/zinc/76/99/94/968769994.db2.gz RZNCDFWHZQUDPA-UONOGXRCSA-N 2 0 222.376 2.108 20 0 BEADRP Cc1ccc2c(c1)CC[N@@H+](CC1CC[NH2+]CC1)C2 ZINC001207441979 968773768 /nfs/dbraw/zinc/77/37/68/968773768.db2.gz OMEWOIYICYYLBH-UHFFFAOYSA-N 2 0 244.382 2.353 20 0 BEADRP c1ccc([C@@H]2CC[N@H+]2CC2CC[NH2+]CC2)cc1 ZINC001207439073 968775996 /nfs/dbraw/zinc/77/59/96/968775996.db2.gz KSTBVWUMHDDKEX-HNNXBMFYSA-N 2 0 230.355 2.433 20 0 BEADRP CC1CC[NH+](CCC2CC[NH+](C)CC2)CC1 ZINC001207479382 968792896 /nfs/dbraw/zinc/79/28/96/968792896.db2.gz HEHJSQUKZNGAGG-UHFFFAOYSA-N 2 0 224.392 2.450 20 0 BEADRP C[C@@H]1C[C@@H](F)C[N@@H+]1CCC1CC[NH+](C)CC1 ZINC001207479389 968795449 /nfs/dbraw/zinc/79/54/49/968795449.db2.gz HLZQUQPSZITANX-DGCLKSJQSA-N 2 0 228.355 2.151 20 0 BEADRP C[NH+]1CCC(CC[N@@H+]2CC[C@](C)(CF)C2)CC1 ZINC001207480162 968797310 /nfs/dbraw/zinc/79/73/10/968797310.db2.gz VKGKYQAULQCHEB-CQSZACIVSA-N 2 0 242.382 2.400 20 0 BEADRP CC(C)[C@H]1CCC[N@@H+]1C[C@H]1CCCC[NH2+]C1 ZINC000829274393 968825756 /nfs/dbraw/zinc/82/57/56/968825756.db2.gz DCHQHNYNBPYUFW-UONOGXRCSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H](CC[NH2+]C1Cc2ccccc2C1)[NH+](C)C ZINC000829318859 968827671 /nfs/dbraw/zinc/82/76/71/968827671.db2.gz AHXPXWIWEFSRKN-GFCCVEGCSA-N 2 0 232.371 2.084 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]CCC[C@H]1CCO1 ZINC001207858098 968893296 /nfs/dbraw/zinc/89/32/96/968893296.db2.gz DIQZRZORESEGGJ-KGLIPLIRSA-N 2 0 242.407 2.266 20 0 BEADRP Cc1[nH+]c(NC[C@H]2C[NH2+][C@H](C)C2)cc2[nH]ccc21 ZINC001155102048 968894672 /nfs/dbraw/zinc/89/46/72/968894672.db2.gz QTSONKRVGRHUJS-MWLCHTKSSA-N 2 0 244.342 2.281 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@@H]([NH2+]CC3(C)CCCC3)[C@H]2C1 ZINC001207843942 968898662 /nfs/dbraw/zinc/89/86/62/968898662.db2.gz JBODQXVWOWPHTJ-MELADBBJSA-N 2 0 236.403 2.497 20 0 BEADRP C[NH+]1CCc2cc(C3=CC[N@H+](C)CC3)ccc2C1 ZINC001241328177 968977481 /nfs/dbraw/zinc/97/74/81/968977481.db2.gz YHZHUKZXKINUKT-UHFFFAOYSA-N 2 0 242.366 2.393 20 0 BEADRP C[C@@H]1C[N@H+](CC2(C)CC[NH+](C)CC2)C[C@@H]1F ZINC001208108265 968993659 /nfs/dbraw/zinc/99/36/59/968993659.db2.gz RMQUTOFNGVRYHH-NEPJUHHUSA-N 2 0 228.355 2.008 20 0 BEADRP C[NH+]1CCC(C)(C[NH+]2CCC(CF)CC2)CC1 ZINC001208113758 969005263 /nfs/dbraw/zinc/00/52/63/969005263.db2.gz NUWZJIZXKGYKNM-UHFFFAOYSA-N 2 0 242.382 2.400 20 0 BEADRP CC/C=C\CCC[N@H+]1C[C@H]2C[NH+](C)C[C@H]2C1 ZINC001208135988 969044240 /nfs/dbraw/zinc/04/42/40/969044240.db2.gz MRRJDAMSKUBELH-XTBPLBNGSA-N 2 0 222.376 2.226 20 0 BEADRP Nc1[nH]c2ccc(-c3ccc(C[NH3+])cc3)cc2[nH+]1 ZINC001241913614 969144248 /nfs/dbraw/zinc/14/42/48/969144248.db2.gz DHIBLOOGUOTBJP-UHFFFAOYSA-N 2 0 238.294 2.271 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2C[C@@H]3CCC[C@@H]3C2)CC1 ZINC001208593164 969152082 /nfs/dbraw/zinc/15/20/82/969152082.db2.gz OWUCCDBHNKTVKM-GASCZTMLSA-N 2 0 236.403 2.450 20 0 BEADRP C[C@H]1CCC[N@H+](C[C@@H]2CCC[NH+](C)C2)C1 ZINC001208604155 969156345 /nfs/dbraw/zinc/15/63/45/969156345.db2.gz LRJJKCUKDQCIGZ-QWHCGFSZSA-N 2 0 210.365 2.060 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH+]2C[C@@H]3CCCC[C@@H]3C2)C1 ZINC001208608719 969161277 /nfs/dbraw/zinc/16/12/77/969161277.db2.gz WJGJKNNQKBKVAA-KFWWJZLASA-N 2 0 236.403 2.450 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH+]2CC[C@@](C)(CF)C2)C1 ZINC001208607258 969161311 /nfs/dbraw/zinc/16/13/11/969161311.db2.gz KXMLWNWMGAYRBL-OLZOCXBDSA-N 2 0 228.355 2.010 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH+]2C[C@@H]3CCCC[C@H]3C2)C1 ZINC001208618314 969176307 /nfs/dbraw/zinc/17/63/07/969176307.db2.gz WJGJKNNQKBKVAA-ILXRZTDVSA-N 2 0 236.403 2.450 20 0 BEADRP [NH3+]CCc1ccc(C2=C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC001242025990 969179094 /nfs/dbraw/zinc/17/90/94/969179094.db2.gz KCDOQQXJOUIGGX-CABCVRRESA-N 2 0 228.339 2.096 20 0 BEADRP CCCCC[C@@H](O)C[NH2+]C(C)(C)CC[NH+](C)C ZINC001253553500 969228386 /nfs/dbraw/zinc/22/83/86/969228386.db2.gz GRJDVPFEVWHEJC-CYBMUJFWSA-N 2 0 244.423 2.248 20 0 BEADRP Cc1ccnc(C[N@@H+]2CCC[C@H](C[NH3+])[C@@H](C)C2)c1 ZINC001205994404 969253503 /nfs/dbraw/zinc/25/35/03/969253503.db2.gz LJYSWOTUGOTCTE-UONOGXRCSA-N 2 0 247.386 2.197 20 0 BEADRP Cc1cnccc1C[N@@H+]1CCC[C@@H](C[NH3+])[C@H](C)C1 ZINC001205995731 969263293 /nfs/dbraw/zinc/26/32/93/969263293.db2.gz PSICHOYFJPVYRV-KGLIPLIRSA-N 2 0 247.386 2.197 20 0 BEADRP C1=CC[NH+](C[C@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC001208945411 969312696 /nfs/dbraw/zinc/31/26/96/969312696.db2.gz BVWWZXJHWBLTGB-MRXNPFEDSA-N 2 0 242.366 2.380 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]C1(C)CCC1)C2 ZINC001169096412 969390357 /nfs/dbraw/zinc/39/03/57/969390357.db2.gz WDIHFCXULBAIEI-CNDDSTCGSA-N 2 0 208.349 2.144 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]C1CCCC1)C2 ZINC001169079200 969397533 /nfs/dbraw/zinc/39/75/33/969397533.db2.gz JTIDVVUETYEDDX-XYYAHUGASA-N 2 0 208.349 2.144 20 0 BEADRP CC(C)CC[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169078824 969399654 /nfs/dbraw/zinc/39/96/54/969399654.db2.gz HPDLMMYBHNDDBF-XYYAHUGASA-N 2 0 210.365 2.247 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+][C@H]1CC[C@@H](F)C1)C2 ZINC001169080308 969403124 /nfs/dbraw/zinc/40/31/24/969403124.db2.gz MKXOZRKMGONXRD-RXGFPQBGSA-N 2 0 226.339 2.092 20 0 BEADRP CC1CC([N@H+](C)[C@H]2C[C@H]3CC[C@@H](C2)[NH+]3C)C1 ZINC001169126120 969426308 /nfs/dbraw/zinc/42/63/08/969426308.db2.gz PVYJTFAQSVDXSE-XEJFGBPMSA-N 2 0 222.376 2.342 20 0 BEADRP CC1(C)C[C@H](Nc2cc[nH+]cc2)C[C@](C)(C[NH3+])C1 ZINC001169138655 969435865 /nfs/dbraw/zinc/43/58/65/969435865.db2.gz RYOFDORUCMPHAG-ZFWWWQNUSA-N 2 0 247.386 2.459 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+][C@H]1C=CCCC1)C2 ZINC001169115280 969457893 /nfs/dbraw/zinc/45/78/93/969457893.db2.gz ICHMIQQWVOQYMS-FQUUOJAGSA-N 2 0 220.360 2.310 20 0 BEADRP CC[N@H+](C)C1CC[NH+](C[C@@H]2C[C@@H]2C)CC1 ZINC001209427107 969498337 /nfs/dbraw/zinc/49/83/37/969498337.db2.gz OKBCGBXLPYYFHP-RYUDHWBXSA-N 2 0 210.365 2.059 20 0 BEADRP CC[NH+]1CCC([NH2+]CCc2ccccc2O)CC1 ZINC001169229617 969504105 /nfs/dbraw/zinc/50/41/05/969504105.db2.gz FJBCNRRQHYEYGK-UHFFFAOYSA-N 2 0 248.370 2.009 20 0 BEADRP F[C@@H]1C[C@@H]2C[C@H]1C[N@@H+]2CCC[NH+]1CCCCC1 ZINC001209449122 969518522 /nfs/dbraw/zinc/51/85/22/969518522.db2.gz SQVZDLANODCBJR-MELADBBJSA-N 2 0 240.366 2.295 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH2+][C@@H]2CCc3ncccc32)CC1 ZINC001254506943 969673795 /nfs/dbraw/zinc/67/37/95/969673795.db2.gz DDUCEFOKQIXHGV-IUODEOHRSA-N 2 0 245.370 2.143 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH2+]CCCc2cccnc2)CC1 ZINC001254505179 969675561 /nfs/dbraw/zinc/67/55/61/969675561.db2.gz ZQHWNTVVCOQLHM-HNNXBMFYSA-N 2 0 247.386 2.088 20 0 BEADRP C[N@H+](CC1CC(F)(F)C1)[C@H]1CCC[NH+](C)CC1 ZINC001254524367 969704555 /nfs/dbraw/zinc/70/45/55/969704555.db2.gz AZXYFPOIXHHXCC-LBPRGKRZSA-N 2 0 246.345 2.448 20 0 BEADRP C[N@H+](CC(C)(C)C)[C@@H]1CCC[NH+](C)CC1 ZINC001254523685 969705395 /nfs/dbraw/zinc/70/53/95/969705395.db2.gz QVTYGWSSWCFDPA-GFCCVEGCSA-N 2 0 212.381 2.449 20 0 BEADRP C[N@H+](C[C@@H]1CC1(C)C)[C@H]1CCC[NH+](C)CC1 ZINC001254524850 969713370 /nfs/dbraw/zinc/71/33/70/969713370.db2.gz CVKZBRJJLWACKF-STQMWFEESA-N 2 0 224.392 2.449 20 0 BEADRP C[C@@H]1C[C@@H](C)C[NH+]([C@@H]2CCC[N@H+](C)CC2)C1 ZINC001254524914 969723292 /nfs/dbraw/zinc/72/32/92/969723292.db2.gz DQWJPHYCYNZQFJ-MGPQQGTHSA-N 2 0 224.392 2.449 20 0 BEADRP C[C@H]1C[N@H+]([C@@H]2CCC[NH+](C)CC2)C2(CC2)C1 ZINC001254530046 969725745 /nfs/dbraw/zinc/72/57/45/969725745.db2.gz UDMHKGVOPLFVEW-CHWSQXEVSA-N 2 0 222.376 2.345 20 0 BEADRP Cn1ccc2c1[nH+]ccc2NCC[C@H]1CCC[NH2+]1 ZINC001169569378 969766401 /nfs/dbraw/zinc/76/64/01/969766401.db2.gz NFKVVWHWXKIQHM-LLVKDONJSA-N 2 0 244.342 2.127 20 0 BEADRP C[C@H]([NH3+])c1ccc(NCC[C@H]2CCC[NH2+]2)cc1 ZINC001169567658 969767071 /nfs/dbraw/zinc/76/70/71/969767071.db2.gz OEAWTKSXLRUITD-WCQYABFASA-N 2 0 233.359 2.260 20 0 BEADRP C1[NH+]([C@H]2CC3CCN(CC3)C2)CC12CCCC2 ZINC001254855279 969808279 /nfs/dbraw/zinc/80/82/79/969808279.db2.gz MJLWFZJYFWJJSV-AWEZNQCLSA-N 2 0 234.387 2.347 20 0 BEADRP [NH3+]Cc1ccn(-c2cc[nH+]cc2C(F)(F)F)c1 ZINC001169725109 969815668 /nfs/dbraw/zinc/81/56/68/969815668.db2.gz IMOCILPWZVEQOT-UHFFFAOYSA-N 2 0 241.216 2.350 20 0 BEADRP [NH3+]Cc1ccn(-c2ccc([C@H]3CCC[NH2+]3)cc2)c1 ZINC001169725888 969817807 /nfs/dbraw/zinc/81/78/07/969817807.db2.gz LORRPYUUVUFMRQ-OAHLLOKOSA-N 2 0 241.338 2.361 20 0 BEADRP [NH3+]CCC[C@@H]1CCCC[N@@H+](C2CCOCC2)C1 ZINC001255038255 969859040 /nfs/dbraw/zinc/85/90/40/969859040.db2.gz IRPMVIWHGYXELM-ZDUSSCGKSA-N 2 0 240.391 2.006 20 0 BEADRP CC(C)[NH+]1CCC(C[NH2+][C@@H]2CCSC2)CC1 ZINC001255269664 970018779 /nfs/dbraw/zinc/01/87/79/970018779.db2.gz NSLXBDWWLSIHIO-CYBMUJFWSA-N 2 0 242.432 2.202 20 0 BEADRP CN1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@H]1CCSC1)C2 ZINC001255272189 970022921 /nfs/dbraw/zinc/02/29/21/970022921.db2.gz SIVRKQLHBYVSIC-RVMXOQNASA-N 2 0 240.416 2.097 20 0 BEADRP CN1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H]1CCSC1)C2 ZINC001255272188 970023621 /nfs/dbraw/zinc/02/36/21/970023621.db2.gz SIVRKQLHBYVSIC-FVCCEPFGSA-N 2 0 240.416 2.097 20 0 BEADRP C[NH+]1CCC(CCC[NH2+][C@@H]2CCSC2)CC1 ZINC001255273996 970025644 /nfs/dbraw/zinc/02/56/44/970025644.db2.gz KBONIDYJRYHGDZ-CYBMUJFWSA-N 2 0 242.432 2.204 20 0 BEADRP CCC[N@H+](CCC[NH+](C)C)[C@@H]1CCSC1 ZINC001255295478 970057504 /nfs/dbraw/zinc/05/75/04/970057504.db2.gz YEGLHXLRWJTDJO-GFCCVEGCSA-N 2 0 230.421 2.156 20 0 BEADRP C[N@@H+]1CC[C@@H](n2ccc3cc(CC[NH3+])ccc32)C1 ZINC001255423237 970147603 /nfs/dbraw/zinc/14/76/03/970147603.db2.gz JVZIUIQQKQCMMK-CQSZACIVSA-N 2 0 243.354 2.019 20 0 BEADRP C[NH2+]Cc1cccc(N(C)c2cc(N)cc[nH+]2)c1 ZINC001211137922 970159174 /nfs/dbraw/zinc/15/91/74/970159174.db2.gz CDVPJNWBDNUYCG-UHFFFAOYSA-N 2 0 242.326 2.151 20 0 BEADRP C[N@@H+]1CCC[C@H](n2c(C[NH3+])cc3ccccc32)C1 ZINC001255467416 970193864 /nfs/dbraw/zinc/19/38/64/970193864.db2.gz CGTLOGDIMPCANC-ZDUSSCGKSA-N 2 0 243.354 2.367 20 0 BEADRP C[N@@H+]1CCC[C@@H](n2cc(C[NH3+])c3ccccc32)C1 ZINC001255468899 970194945 /nfs/dbraw/zinc/19/49/45/970194945.db2.gz ZDSGLBCGHHPTLV-CYBMUJFWSA-N 2 0 243.354 2.367 20 0 BEADRP C[N@@H+]1CCC[C@H](n2ccc3c2cccc3C[NH3+])C1 ZINC001255467382 970195984 /nfs/dbraw/zinc/19/59/84/970195984.db2.gz BPAHHYLLZNRYAL-ZDUSSCGKSA-N 2 0 243.354 2.367 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CC23CC[NH+](CC2)CC3)C1 ZINC001170099473 970285674 /nfs/dbraw/zinc/28/56/74/970285674.db2.gz ASGRCVKYJNUSII-OLZOCXBDSA-N 2 0 222.376 2.251 20 0 BEADRP CCC[N@H+](CCC[NH3+])[C@@H]1CCOC(C)(C)C1 ZINC001255527565 970292994 /nfs/dbraw/zinc/29/29/94/970292994.db2.gz ORHFMYIINMMQSU-GFCCVEGCSA-N 2 0 228.380 2.005 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]Cc2ccccc2C[NH3+])C1 ZINC001170111185 970321679 /nfs/dbraw/zinc/32/16/79/970321679.db2.gz AYYFJLFPCJHRPG-BXUZGUMPSA-N 2 0 218.344 2.424 20 0 BEADRP COC[C@H](C)[N@H+](CC1CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001255561145 970345441 /nfs/dbraw/zinc/34/54/41/970345441.db2.gz DMCIYYXJBQMMNL-UBHSHLNASA-N 2 0 240.391 2.003 20 0 BEADRP COC[C@H](C)[N@H+](C(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001255563786 970353352 /nfs/dbraw/zinc/35/33/52/970353352.db2.gz YIERISSPWMMSOO-AVGNSLFASA-N 2 0 228.380 2.002 20 0 BEADRP CCCC[NH+]1CCC(C[NH2+][C@H](C)COC)CC1 ZINC001255564396 970354387 /nfs/dbraw/zinc/35/43/87/970354387.db2.gz YNSBHDWWPFVJCU-CYBMUJFWSA-N 2 0 242.407 2.123 20 0 BEADRP COC[C@@H](C)[NH2+]C[C@@H](C)CC(C)(C)CC[NH3+] ZINC001255564053 970355742 /nfs/dbraw/zinc/35/57/42/970355742.db2.gz UFQWTLOEXKIQLK-NWDGAFQWSA-N 2 0 230.396 2.012 20 0 BEADRP COCCC1([NH3+])CC[NH+]([C@H]2CC[C@@H](C)C2)CC1 ZINC001170124275 970369051 /nfs/dbraw/zinc/36/90/51/970369051.db2.gz XARULVVURSTMBA-OLZOCXBDSA-N 2 0 240.391 2.005 20 0 BEADRP Fc1ccc(C2=CC[NH2+]C2)cc1C[NH+]1CCCC1 ZINC001243116080 970369415 /nfs/dbraw/zinc/36/94/15/970369415.db2.gz QTQJIHPSVWEQOX-UHFFFAOYSA-N 2 0 246.329 2.408 20 0 BEADRP Cc1ccc(C[C@@H](C)[NH2+]C[C@@H]2CC[N@H+](C)C2)cc1 ZINC001255773958 970478639 /nfs/dbraw/zinc/47/86/39/970478639.db2.gz SHSVAGDAKJAAGA-ZBFHGGJFSA-N 2 0 246.398 2.467 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)[C@@H]1CC[C@H](C)C1 ZINC001170156375 970482245 /nfs/dbraw/zinc/48/22/45/970482245.db2.gz DUDNIHKFWMOWPX-QWHCGFSZSA-N 2 0 212.381 2.449 20 0 BEADRP Cc1ccc(C[C@H](C)[NH2+][C@@H]2CCC[C@@H]2[NH3+])cc1 ZINC001255782528 970487182 /nfs/dbraw/zinc/48/71/82/970487182.db2.gz AWBVXKBOWVYYQS-AEGPPILISA-N 2 0 232.371 2.395 20 0 BEADRP CC[C@@H]1C[C@@H]([NH2+]C(C)(C)CC[NH+](C)C)CCO1 ZINC001170176043 970548305 /nfs/dbraw/zinc/54/83/05/970548305.db2.gz OUIBNYHZJGVCHM-QWHCGFSZSA-N 2 0 242.407 2.264 20 0 BEADRP CC[C@H]1C[C@@H]([NH2+]C(C)(C)C(C)(C)[NH3+])CCO1 ZINC001170183391 970557329 /nfs/dbraw/zinc/55/73/29/970557329.db2.gz RIXNQZBNKMOOBA-QWRGUYRKSA-N 2 0 228.380 2.050 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]CCc1ccccn1 ZINC001255940298 970571983 /nfs/dbraw/zinc/57/19/83/970571983.db2.gz WCPTYEFYRJHKPJ-CQSZACIVSA-N 2 0 249.402 2.334 20 0 BEADRP CSC[C@@H]1CCC[N@@H+]1CCCCCC[NH3+] ZINC000400299572 970573662 /nfs/dbraw/zinc/57/36/62/970573662.db2.gz SYEBHCXOBVNYFS-LBPRGKRZSA-N 2 0 230.421 2.333 20 0 BEADRP CC(C)C[C@H](C)[NH2+][C@H](C)C1CC[NH2+]CC1 ZINC000400336378 970579685 /nfs/dbraw/zinc/57/96/85/970579685.db2.gz GAKRLZLJPDQQQJ-NWDGAFQWSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@H]([NH2+]Cc1cccs1)C1CC[NH2+]CC1 ZINC000400380485 970582971 /nfs/dbraw/zinc/58/29/71/970582971.db2.gz WSZPYSLVEPAGCI-JTQLQIEISA-N 2 0 224.373 2.226 20 0 BEADRP Cc1ccc(C[NH2+][C@H](C)C2CC[NH2+]CC2)cc1 ZINC000400366071 970583530 /nfs/dbraw/zinc/58/35/30/970583530.db2.gz RSRSAHPHJHZNCH-CYBMUJFWSA-N 2 0 232.371 2.473 20 0 BEADRP COc1ccccc1C[NH2+][C@@H](C)C1CC[NH2+]CC1 ZINC000400440315 970589462 /nfs/dbraw/zinc/58/94/62/970589462.db2.gz MHTOJMGRWYATDR-LBPRGKRZSA-N 2 0 248.370 2.173 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[N@H+](C)C1CCOCC1 ZINC001255955473 970591119 /nfs/dbraw/zinc/59/11/19/970591119.db2.gz UPYIFKPJROSQPI-ZDUSSCGKSA-N 2 0 242.407 2.218 20 0 BEADRP CC[C@H]1C[C@@H]([NH2+]CC[C@H]2CCC[N@@H+]2C)CCO1 ZINC001170194533 970591461 /nfs/dbraw/zinc/59/14/61/970591461.db2.gz IBFMCKUADTZBME-MJBXVCDLSA-N 2 0 240.391 2.018 20 0 BEADRP CC[C@H]1C[C@H]([NH2+]CC[C@H]2CCC[N@@H+]2C)CCO1 ZINC001170194532 970593396 /nfs/dbraw/zinc/59/33/96/970593396.db2.gz IBFMCKUADTZBME-MCIONIFRSA-N 2 0 240.391 2.018 20 0 BEADRP COc1ccc(C[NH2+][C@@H](C)C2CC[NH2+]CC2)cc1 ZINC000400489632 970595685 /nfs/dbraw/zinc/59/56/85/970595685.db2.gz YTSQFKPHEMYBBL-LBPRGKRZSA-N 2 0 248.370 2.173 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)C(C)(C)C ZINC000400483282 970596381 /nfs/dbraw/zinc/59/63/81/970596381.db2.gz WTAVEFJODIWYHO-WDEREUQCSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC[C@@H](C)C1)C1CC[NH2+]CC1 ZINC000400519674 970598524 /nfs/dbraw/zinc/59/85/24/970598524.db2.gz GXRKCHJPEYRNFU-NQBHXWOUSA-N 2 0 210.365 2.153 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[N@H+](C)[C@@H]1CCCOC1 ZINC001255969068 970606696 /nfs/dbraw/zinc/60/66/96/970606696.db2.gz STUBICAUXABXCL-ZIAGYGMSSA-N 2 0 242.407 2.218 20 0 BEADRP C[C@@H](Cc1ccccc1Cl)[NH2+]C1(C[NH3+])CC1 ZINC001170264326 970647837 /nfs/dbraw/zinc/64/78/37/970647837.db2.gz XGDMGRVUPFIBPG-JTQLQIEISA-N 2 0 238.762 2.352 20 0 BEADRP C[NH+]1CC(CNc2ccc([C@H]3CCC[NH2+]3)cc2)C1 ZINC001170253928 970661173 /nfs/dbraw/zinc/66/11/73/970661173.db2.gz FJWYTDHXYJXYCB-OAHLLOKOSA-N 2 0 245.370 2.085 20 0 BEADRP C[C@@H]1CC[N@@H+](C2CCN(C)CC2)[C@H](C)C1 ZINC001256207346 970715032 /nfs/dbraw/zinc/71/50/32/970715032.db2.gz FNLVBRDAKALFDE-VXGBXAGGSA-N 2 0 210.365 2.201 20 0 BEADRP CC(C)CC[C@@H](C)[NH2+]CCSCC[NH3+] ZINC001256358947 970759165 /nfs/dbraw/zinc/75/91/65/970759165.db2.gz YVUCQCDUTKZCLR-LLVKDONJSA-N 2 0 218.410 2.093 20 0 BEADRP CC(C)COCC[C@@H](C)[N@@H+]1[C@@H](C)CC[C@H]1CN ZINC001246540437 972559473 /nfs/dbraw/zinc/55/94/73/972559473.db2.gz GUKGVLOURHFJCB-MJBXVCDLSA-N 2 0 242.407 2.249 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]Cc1ccc(C)c(F)c1 ZINC001327416460 972570096 /nfs/dbraw/zinc/57/00/96/972570096.db2.gz SNWBNNJIZCGYFK-LLVKDONJSA-N 2 0 224.323 2.222 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]Cc1cnc2ccccc2c1 ZINC001327416968 972570834 /nfs/dbraw/zinc/57/08/34/972570834.db2.gz WHGIKFHZFOHMNK-LBPRGKRZSA-N 2 0 243.354 2.322 20 0 BEADRP CCCC(CCC)[N@@H+]1CCC[C@@](O)(C[NH3+])CC1 ZINC001246541387 972574602 /nfs/dbraw/zinc/57/46/02/972574602.db2.gz HHUPWKACQGGYGM-AWEZNQCLSA-N 2 0 242.407 2.131 20 0 BEADRP CC1(C)[C@@H]2C[C@@H]([N@@H+]3CCC[C@H]([NH3+])CC3)C[C@@H]21 ZINC001246543052 972592173 /nfs/dbraw/zinc/59/21/73/972592173.db2.gz RTNFVVZKGHKUHD-ZDEQEGDKSA-N 2 0 222.376 2.234 20 0 BEADRP CCCCC[C@H](C)[N@@H+]1CCCC[C@](O)(C[NH3+])C1 ZINC001246557965 972778607 /nfs/dbraw/zinc/77/86/07/972778607.db2.gz JSJXMZXCRKBYJE-KBPBESRZSA-N 2 0 242.407 2.131 20 0 BEADRP C[C@H]1C[N@@H+](C2CCCC2)CCC[C@H]1C[NH3+] ZINC001246559492 972789519 /nfs/dbraw/zinc/78/95/19/972789519.db2.gz ANIRXWNIHJRNEN-RYUDHWBXSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@@H](CC1CC1)[N@@H+]1CCC[C@H](C[NH3+])[C@H](C)C1 ZINC001246566903 972819274 /nfs/dbraw/zinc/81/92/74/972819274.db2.gz JVMNQNOJMLNGTE-MBNYWOFBSA-N 2 0 224.392 2.482 20 0 BEADRP CC(C)([NH3+])CNc1ccc([C@H]2CCC[NH2+]2)cc1 ZINC001171192942 972840759 /nfs/dbraw/zinc/84/07/59/972840759.db2.gz OKKOBMGEKWVACM-CYBMUJFWSA-N 2 0 233.359 2.260 20 0 BEADRP CCC(CC)[N@@H+]1CCC[C@@H](C[NH3+])[C@@H](C)C1 ZINC001246570828 972844476 /nfs/dbraw/zinc/84/44/76/972844476.db2.gz WAOYUPUOOVKNMF-RYUDHWBXSA-N 2 0 212.381 2.482 20 0 BEADRP CC(C)([NH3+])CNc1cccc(C2=[NH+]CCC2)c1 ZINC001171193654 972845248 /nfs/dbraw/zinc/84/52/48/972845248.db2.gz DOKFVUVGWMKRAX-UHFFFAOYSA-N 2 0 231.343 2.419 20 0 BEADRP C[N@@H+]1CC[C@@H](c2ccc(NCC(C)(C)[NH3+])cc2)C1 ZINC001171194480 972847848 /nfs/dbraw/zinc/84/78/48/972847848.db2.gz PCCGITFQHAUPIO-CYBMUJFWSA-N 2 0 247.386 2.255 20 0 BEADRP CC1(C)C[C@H]([N@@H+]2CCC[C@](C)(C[NH3+])CC2)CO1 ZINC001246572981 972865215 /nfs/dbraw/zinc/86/52/15/972865215.db2.gz DSOHJILIZWFVCE-JSGCOSHPSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@@]1(F)CCCC[N@@H+](C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC001246579579 972908639 /nfs/dbraw/zinc/90/86/39/972908639.db2.gz ZPYGNEHWWOZHPG-QNMSZWNNSA-N 2 0 240.366 2.484 20 0 BEADRP CC(C)C[C@@H](C)C[C@@H](C)[N@H+]1C[C@@H]2[C@H]([NH3+])[C@@H]2C1 ZINC001246666658 973076037 /nfs/dbraw/zinc/07/60/37/973076037.db2.gz WVMYHYMFPFBHBB-XGFWRYKXSA-N 2 0 224.392 2.336 20 0 BEADRP CCc1ccc(C[C@H](C)[N@H+]2C[C@@H]3[C@@H]([NH3+])[C@@H]3C2)cc1 ZINC001246661454 973078352 /nfs/dbraw/zinc/07/83/52/973078352.db2.gz XPUHYORMDQDULT-DANNLKNASA-N 2 0 244.382 2.069 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+]Cc1cccc2c[nH]nc21 ZINC001328508244 973119244 /nfs/dbraw/zinc/11/92/44/973119244.db2.gz XDCZJZRQKFNOMI-CYBMUJFWSA-N 2 0 246.358 2.026 20 0 BEADRP CC1(C)CCC[C@H]([N@@H+]2C[C@H]3CC[NH2+]C[C@H]3C2)C1 ZINC001246848429 973154483 /nfs/dbraw/zinc/15/44/83/973154483.db2.gz VIAJSSHAJFGBNE-RDBSUJKOSA-N 2 0 236.403 2.497 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]C[C@H]1CCCC[C@@H]1C ZINC001328676852 973225496 /nfs/dbraw/zinc/22/54/96/973225496.db2.gz HVBMQZMTSGLGTQ-YNEHKIRRSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H]1C[C@H]1C[N@@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001329433399 973772414 /nfs/dbraw/zinc/77/24/14/973772414.db2.gz NAZQHWCFYMACHC-OLZOCXBDSA-N 2 0 222.376 2.108 20 0 BEADRP F[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)C1 ZINC001329499111 973799038 /nfs/dbraw/zinc/79/90/38/973799038.db2.gz ONQLGWRDYWNVCG-XJFOESAGSA-N 2 0 240.366 2.484 20 0 BEADRP [NH3+][C@@H]1CCc2c1cccc2NC[C@@H]1CCCC[NH2+]1 ZINC001171334856 973866010 /nfs/dbraw/zinc/86/60/10/973866010.db2.gz KLXXGOSZMWXKGK-SMDDNHRTSA-N 2 0 245.370 2.187 20 0 BEADRP [NH3+]C1(c2ccc(NC[C@H]3CCCC[NH2+]3)cc2)CC1 ZINC001171334231 973874123 /nfs/dbraw/zinc/87/41/23/973874123.db2.gz KJBMIRRDNMCWOR-CQSZACIVSA-N 2 0 245.370 2.188 20 0 BEADRP [NH3+]CCCC[NH2+][C@H]1CCc2c(F)cccc2C1 ZINC001171401582 974008165 /nfs/dbraw/zinc/00/81/65/974008165.db2.gz MXUPZKJRAGLJSO-LBPRGKRZSA-N 2 0 236.334 2.012 20 0 BEADRP N[C@H]1CC[N@H+](CCC2CCCC2)CC[C@H]1F ZINC001206156908 974334390 /nfs/dbraw/zinc/33/43/90/974334390.db2.gz UFCPOKZPPHJIOO-OLZOCXBDSA-N 2 0 228.355 2.328 20 0 BEADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]CC1CCC1)C2 ZINC001172099064 974336165 /nfs/dbraw/zinc/33/61/65/974336165.db2.gz FECMMCPKCPORJD-BTTYYORXSA-N 2 0 222.376 2.391 20 0 BEADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1C[C@H]3CC[C@@H]1C3)C2 ZINC001172125152 974352843 /nfs/dbraw/zinc/35/28/43/974352843.db2.gz OUOHUDGPTIGBIO-AHDPXTMNSA-N 2 0 234.387 2.486 20 0 BEADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]CCC1CC1)C2 ZINC001172107631 974364981 /nfs/dbraw/zinc/36/49/81/974364981.db2.gz IXMOPYXNGLDHOT-ZSOGYDGISA-N 2 0 222.376 2.391 20 0 BEADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]CCn1cccc1)C2 ZINC001172104064 974369230 /nfs/dbraw/zinc/36/92/30/974369230.db2.gz ZIGGIQXGIPMNFZ-QDMKHBRRSA-N 2 0 247.386 2.093 20 0 BEADRP CN1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC(F)CC1)C2 ZINC001172115733 974381330 /nfs/dbraw/zinc/38/13/30/974381330.db2.gz ZPLVEAYHSQTMLS-WDNDVIMCSA-N 2 0 240.366 2.436 20 0 BEADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC[C@H](F)C1)C2 ZINC001172120900 974387737 /nfs/dbraw/zinc/38/77/37/974387737.db2.gz GZWXUWAHQONBCM-IGQOVBAYSA-N 2 0 240.366 2.436 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+][C@H]1CSc2ccccc2C1 ZINC001172192087 974399700 /nfs/dbraw/zinc/39/97/00/974399700.db2.gz BHSXFAUFMKDYSQ-FRRDWIJNSA-N 2 0 248.395 2.173 20 0 BEADRP C[NH+](C)Cc1ccc(O[C@H]2CCC[N@H+](C)C2)cc1 ZINC001225330815 974404395 /nfs/dbraw/zinc/40/43/95/974404395.db2.gz QRICVQNQGVXDFJ-HNNXBMFYSA-N 2 0 248.370 2.221 20 0 BEADRP CC[C@@H](C)OCC[C@H](C)[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC001172342112 974609319 /nfs/dbraw/zinc/60/93/19/974609319.db2.gz KGOQARZDIXJMSC-CRWXNKLISA-N 2 0 242.407 2.440 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@@H](F)[C@@H]([NH3+])CC2)s1 ZINC001206165319 974830312 /nfs/dbraw/zinc/83/03/12/974830312.db2.gz NISARWPKDXUQBF-NEPJUHHUSA-N 2 0 242.363 2.318 20 0 BEADRP CO[C@@H]1CCC[C@H]([NH2+]C(C)(C)C(C)(C)[NH3+])C1 ZINC001172926269 974970529 /nfs/dbraw/zinc/97/05/29/974970529.db2.gz PCOGHHSRRCDYCU-WDEREUQCSA-N 2 0 228.380 2.050 20 0 BEADRP CO[C@@H]1CCC[C@H]([NH2+]Cc2ccccc2C[NH3+])C1 ZINC001172924670 974972972 /nfs/dbraw/zinc/97/29/72/974972972.db2.gz XLEFVHHAGZAGMY-LSDHHAIUSA-N 2 0 248.370 2.193 20 0 BEADRP C[C@H]1C[C@@H](n2ccnc2[C@@H]2CCC[NH2+]C2)CCO1 ZINC001173173277 975050731 /nfs/dbraw/zinc/05/07/31/975050731.db2.gz FGAIMTMPGVTPBC-XQQFMLRXSA-N 2 0 249.358 2.090 20 0 BEADRP CCCC[C@@H](CC(C)C)[N@@H+]1CCO[C@H](C[NH3+])C1 ZINC001173251037 975088448 /nfs/dbraw/zinc/08/84/48/975088448.db2.gz YDRWUODHYCFCPD-UONOGXRCSA-N 2 0 242.407 2.251 20 0 BEADRP CCCC[C@@H](CC(C)C)[N@@H+]1CCO[C@@H](C[NH3+])C1 ZINC001173251035 975088897 /nfs/dbraw/zinc/08/88/97/975088897.db2.gz YDRWUODHYCFCPD-KBPBESRZSA-N 2 0 242.407 2.251 20 0 BEADRP CC[C@@H]1CC[C@H]([N@H+]2C[C@H]3C[NH+](CC)C[C@H]3C2)C1 ZINC001173282507 975238268 /nfs/dbraw/zinc/23/82/68/975238268.db2.gz GWSGTUNOXMNYNU-KBXIAJHMSA-N 2 0 236.403 2.449 20 0 BEADRP CCSC[C@H](C)[NH+]1CC2(C1)CC[NH+](C)CC2 ZINC001173314839 975304873 /nfs/dbraw/zinc/30/48/73/975304873.db2.gz LMSKZQAFKHVMRJ-LBPRGKRZSA-N 2 0 242.432 2.156 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@H]2CCC[C@H](F)C2)CC1 ZINC001333835185 976111880 /nfs/dbraw/zinc/11/18/80/976111880.db2.gz WFXAMTLAQZSNON-STQMWFEESA-N 2 0 228.355 2.199 20 0 BEADRP Cc1c[nH+]ccc1Nc1ccc2[nH+]ccn2c1 ZINC001174276025 976505407 /nfs/dbraw/zinc/50/54/07/976505407.db2.gz OOXHPVYWBNOYLB-UHFFFAOYSA-N 2 0 224.267 2.203 20 0 BEADRP CC1(C)C[C@@H]([NH2+]C/C=C/C2CC2)C[C@@H]([NH3+])C1 ZINC001335252891 976899648 /nfs/dbraw/zinc/89/96/48/976899648.db2.gz QOCASHRVWHHSCX-HNFMAKEJSA-N 2 0 222.376 2.448 20 0 BEADRP CC1(C)C[C@H]([NH3+])C[C@@H]([NH2+]C/C=C/C2CC2)C1 ZINC001335252886 976899826 /nfs/dbraw/zinc/89/98/26/976899826.db2.gz QOCASHRVWHHSCX-CDJBXZAQSA-N 2 0 222.376 2.448 20 0 BEADRP C[C@@H](C[NH+](C)C)Oc1ccccc1C[NH+](C)C ZINC001229699417 976947677 /nfs/dbraw/zinc/94/76/77/976947677.db2.gz NJZVIHMYHHKJDS-LBPRGKRZSA-N 2 0 236.359 2.077 20 0 BEADRP [NH3+]Cc1ccc(Nc2cc[nH+]c3c2CCC3)cc1 ZINC001175966873 977835292 /nfs/dbraw/zinc/83/52/92/977835292.db2.gz SRHQWGVPVLSPBQ-UHFFFAOYSA-N 2 0 239.322 2.195 20 0 BEADRP C[C@@H]1C[N@H+](Cc2cc3c[nH+]ccc3[nH]2)CCCO1 ZINC001232012160 977839133 /nfs/dbraw/zinc/83/91/33/977839133.db2.gz UIJFPGOLDJPJJY-LLVKDONJSA-N 2 0 245.326 2.174 20 0 BEADRP C[N@H+](Cc1cc2c[nH+]ccc2[nH]1)C1CC1 ZINC001232012171 977840679 /nfs/dbraw/zinc/84/06/79/977840679.db2.gz UQLBXUVMJJQPIS-UHFFFAOYSA-N 2 0 201.273 2.157 20 0 BEADRP COC[C@@H]1CCC[N@@H+]1Cc1cc2c[nH+]ccc2[nH]1 ZINC001232010854 977840825 /nfs/dbraw/zinc/84/08/25/977840825.db2.gz DZIMNEPUQPPAAS-ZDUSSCGKSA-N 2 0 245.326 2.174 20 0 BEADRP CC(C)[N@H+](C)Cc1cc2c[nH+]ccc2[nH]1 ZINC001232011944 977841073 /nfs/dbraw/zinc/84/10/73/977841073.db2.gz QEJNEZNWAQUWNG-UHFFFAOYSA-N 2 0 203.289 2.403 20 0 BEADRP c1c2c[nH+]ccc2[nH]c1C[N@@H+]1C[C@@H]2C[C@@H]2C1 ZINC001232011609 977841520 /nfs/dbraw/zinc/84/15/20/977841520.db2.gz HICGHMGFVWPNRJ-PHIMTYICSA-N 2 0 213.284 2.015 20 0 BEADRP COC[C@@H]1CC[N@H+](Cc2cc3c[nH+]ccc3[nH]2)C1 ZINC001232010784 977841615 /nfs/dbraw/zinc/84/16/15/977841615.db2.gz AOQISHDFUCFCEV-LLVKDONJSA-N 2 0 245.326 2.031 20 0 BEADRP F[C@@H]1C[C@@H]2C[C@H]1C[N@@H+]2Cc1cc2c[nH+]ccc2[nH]1 ZINC001232015548 977843377 /nfs/dbraw/zinc/84/33/77/977843377.db2.gz YJXVFCSZCSPNFJ-WCFLWFBJSA-N 2 0 245.301 2.495 20 0 BEADRP CC[N@H+](Cc1cc2c[nH+]ccc2[nH]1)CC(C)(C)O ZINC001232015182 977844037 /nfs/dbraw/zinc/84/40/37/977844037.db2.gz CHPGYFDJWQMFNI-UHFFFAOYSA-N 2 0 247.342 2.156 20 0 BEADRP CC1([NH+]2CCC2)CCC([NH2+]C2CSC2)CC1 ZINC001336857103 978004259 /nfs/dbraw/zinc/00/42/59/978004259.db2.gz FLGDCZOEUOQQPU-UHFFFAOYSA-N 2 0 240.416 2.098 20 0 BEADRP CN(CCC[NH+]1CCCC1)c1cc[nH+]cc1 ZINC001336909837 978047880 /nfs/dbraw/zinc/04/78/80/978047880.db2.gz QIVQNHRJJRBKKZ-UHFFFAOYSA-N 2 0 219.332 2.004 20 0 BEADRP C[C@H]1C[C@H]([NH+]2CCCC2)CN1c1cc[nH+]cc1 ZINC001336908698 978049603 /nfs/dbraw/zinc/04/96/03/978049603.db2.gz GVRINRUBFFVBER-JSGCOSHPSA-N 2 0 231.343 2.145 20 0 BEADRP Cc1cccnc1N1CCC[C@@]2(CC[N@@H+](C)C2)C1 ZINC001277708327 978262361 /nfs/dbraw/zinc/26/23/61/978262361.db2.gz SOBZVVDMCIRUJF-HNNXBMFYSA-N 2 0 245.370 2.312 20 0 BEADRP Cc1ccnc(N[C@@H]2CC[C@H]3C[N@@H+](C)C[C@@H]32)c1 ZINC001337432178 978335793 /nfs/dbraw/zinc/33/57/93/978335793.db2.gz QNETWCAWPSZYDO-RWMBFGLXSA-N 2 0 231.343 2.142 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC001337805554 978504277 /nfs/dbraw/zinc/50/42/77/978504277.db2.gz NFYZBQQHUOKNKX-UTUOFQBUSA-N 2 0 210.365 2.153 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@H](NCc3ccccc3F)[C@H]2C1 ZINC001179815694 978758891 /nfs/dbraw/zinc/75/88/91/978758891.db2.gz IVBQBFJPCIZAGB-YDHLFZDLSA-N 2 0 248.345 2.256 20 0 BEADRP Cc1cccc(C[NH2+][C@@H]2CC[C@@H]3C[N@@H+](C)C[C@H]23)c1 ZINC001179818655 978761230 /nfs/dbraw/zinc/76/12/30/978761230.db2.gz ZFHBCDFYJIVSTM-OWCLPIDISA-N 2 0 244.382 2.425 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2C[C@H](C)C[C@H]2C)CC1 ZINC001179898650 978780667 /nfs/dbraw/zinc/78/06/67/978780667.db2.gz RKRJEWMOMYGVLV-CHWSQXEVSA-N 2 0 224.392 2.449 20 0 BEADRP CC[C@@H]1CC[C@@H]([NH2+]C[C@@H]2CCC[N@H+](C)C2)C1 ZINC000070643705 978861588 /nfs/dbraw/zinc/86/15/88/978861588.db2.gz GOVANNKDETXSBV-HZSPNIEDSA-N 2 0 224.392 2.497 20 0 BEADRP CC[N@H+](CCNc1cc[nH+]cc1C1CC1)C1CC1 ZINC001339561737 978872047 /nfs/dbraw/zinc/87/20/47/978872047.db2.gz SUWKGVOGZYWCPZ-UHFFFAOYSA-N 2 0 245.370 2.277 20 0 BEADRP CC1=C[C@H](C)[C@H](C[N@@H+]2CC[C@@]3(CC[NH2+]3)C2)CC1 ZINC001235062683 978967968 /nfs/dbraw/zinc/96/79/68/978967968.db2.gz BTCKIVOANMOZEJ-KKUMJFAQSA-N 2 0 234.387 2.417 20 0 BEADRP C[C@H](CC[N@H+]1C[C@@H]2[C@@H]([NH3+])[C@@H]2C1)CC(C)(C)C ZINC001235211542 979000516 /nfs/dbraw/zinc/00/05/16/979000516.db2.gz XLWWUBYWJDUQTE-NDBYEHHHSA-N 2 0 224.392 2.338 20 0 BEADRP C(C1CC1)[NH+]1CCC([C@@H]2CCCC[NH2+]2)CC1 ZINC001235231960 979000708 /nfs/dbraw/zinc/00/07/08/979000708.db2.gz FZMGVBSSACPODO-AWEZNQCLSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@H](CC[N@H+]1C[C@@H]2[C@H]([NH3+])[C@@H]2C1)CC(C)(C)C ZINC001235284473 979017447 /nfs/dbraw/zinc/01/74/47/979017447.db2.gz XLWWUBYWJDUQTE-FVCCEPFGSA-N 2 0 224.392 2.338 20 0 BEADRP [NH3+]CCCC[N@@H+]1CC[C@@H]1COCc1ccccc1 ZINC001235716079 979129792 /nfs/dbraw/zinc/12/97/92/979129792.db2.gz YGRAREBGJVEAPF-OAHLLOKOSA-N 2 0 248.370 2.016 20 0 BEADRP CC(C)CCC[N@@H+]1CCCC2(C[NH2+]C2)C1 ZINC001235710540 979130844 /nfs/dbraw/zinc/13/08/44/979130844.db2.gz AJTPDWBTLWZFIC-UHFFFAOYSA-N 2 0 210.365 2.108 20 0 BEADRP CCC[C@@H](C)C[N@@H+]1CCCC2(C[NH2+]C2)C1 ZINC001235710845 979131156 /nfs/dbraw/zinc/13/11/56/979131156.db2.gz HVEMWOQZNXPAGB-GFCCVEGCSA-N 2 0 210.365 2.108 20 0 BEADRP C[N@H+](CC[C@H]1CCCC[NH2+]1)C[C@H]1CC1(C)C ZINC001235959554 979225815 /nfs/dbraw/zinc/22/58/15/979225815.db2.gz YRUHZIIAFDIEPQ-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP CCc1ccccc1C[N@H+]1C[C@H]2CC[C@@H](C1)[C@@H]2[NH3+] ZINC001235959610 979229044 /nfs/dbraw/zinc/22/90/44/979229044.db2.gz LOTJBQVVOMXAGG-MUJYYYPQSA-N 2 0 244.382 2.418 20 0 BEADRP CC/C=C\CCC[N@@H+]1C[C@H]2CC[C@]2([NH3+])C1 ZINC001235981103 979260728 /nfs/dbraw/zinc/26/07/28/979260728.db2.gz UNFQIVCJVABOMV-JXLSXLBDSA-N 2 0 208.349 2.156 20 0 BEADRP CCCC[N@@H+]1C[C@H]2C[NH2+]C[C@@]2(c2ccccc2)C1 ZINC001236006289 979294282 /nfs/dbraw/zinc/29/42/82/979294282.db2.gz OJVUWKBLYBKJPI-CVEARBPZSA-N 2 0 244.382 2.260 20 0 BEADRP CC/C=C\CCC[N@H+]1C[C@H]([NH3+])C[C@H](C)C1 ZINC001236043963 979337223 /nfs/dbraw/zinc/33/72/23/979337223.db2.gz HBNDFKIVQOTBMG-OEFFGFFESA-N 2 0 210.365 2.402 20 0 BEADRP CCC[C@H](C)C[N@@H+]1C[C@H]2CC[C@@H](C1)[NH2+]C2 ZINC001236060422 979353555 /nfs/dbraw/zinc/35/35/55/979353555.db2.gz QDVLEQTXOQYKFW-AVGNSLFASA-N 2 0 210.365 2.106 20 0 BEADRP Nc1ccc2c(c1)CC[N@@H+](CCCCCC[NH3+])C2 ZINC001236104283 979391987 /nfs/dbraw/zinc/39/19/87/979391987.db2.gz AGYFADIUVXDODW-UHFFFAOYSA-N 2 0 247.386 2.146 20 0 BEADRP CC1(C)CCC2(CC[NH+](CCCC[NH3+])CC2)O1 ZINC001236183666 979438429 /nfs/dbraw/zinc/43/84/29/979438429.db2.gz ZRGXXOBTQDNGPQ-UHFFFAOYSA-N 2 0 240.391 2.149 20 0 BEADRP [NH3+]Cc1ccccc1-c1cccc2c1CC[NH2+]C2 ZINC001236355809 979550121 /nfs/dbraw/zinc/55/01/21/979550121.db2.gz UOUZKZFPDNBMOX-UHFFFAOYSA-N 2 0 238.334 2.458 20 0 BEADRP CC(C)CC[N@@H+]1CCCC[C@@](C)(C[NH3+])C1 ZINC001206542131 979648739 /nfs/dbraw/zinc/64/87/39/979648739.db2.gz SDXMLUZCXBQJDL-ZDUSSCGKSA-N 2 0 212.381 2.483 20 0 BEADRP C[C@H]([NH3+])CN(C)Cc1ccc2cc(O)ccc2c1 ZINC001236894799 979784359 /nfs/dbraw/zinc/78/43/59/979784359.db2.gz DOFOFAJFLOSBNU-NSHDSACASA-N 2 0 244.338 2.324 20 0 BEADRP Cc1ncsc1C[N@@H+]1CCC[C@@](C)([NH3+])CC1 ZINC001205266736 979821899 /nfs/dbraw/zinc/82/18/99/979821899.db2.gz XAYCMXDNZHTMEC-GFCCVEGCSA-N 2 0 239.388 2.155 20 0 BEADRP CS[C@H](C)CC[N@@H+]1CC[C@@H]2[NH2+]CCC[C@H]2C1 ZINC001237383584 979879669 /nfs/dbraw/zinc/87/96/69/979879669.db2.gz QQAIOHKBXDQBBJ-AGIUHOORSA-N 2 0 242.432 2.202 20 0 BEADRP Cc1cc(O)cc(C[N@@H+]2CCC[C@@](C)([NH3+])CC2)c1 ZINC001205281529 979885163 /nfs/dbraw/zinc/88/51/63/979885163.db2.gz ULYGCISKMJRWLZ-OAHLLOKOSA-N 2 0 248.370 2.404 20 0 BEADRP CCc1cccc(C[N@@H+]2CCC[C@@](C)([NH3+])CC2)n1 ZINC001205287937 979930417 /nfs/dbraw/zinc/93/04/17/979930417.db2.gz DUANUYYXFDWFKV-OAHLLOKOSA-N 2 0 247.386 2.347 20 0 BEADRP Cc1cc(C[NH2+]C[C@@H]2C[NH+]3CCC2CC3)c(C)o1 ZINC001184135170 979945209 /nfs/dbraw/zinc/94/52/09/979945209.db2.gz LYDOVZFSSQPECA-OAHLLOKOSA-N 2 0 248.370 2.328 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@H]([NH2+]C[C@@H]3CC[C@@H]4C[C@@H]4C3)[C@H]2C1 ZINC001184388517 980063139 /nfs/dbraw/zinc/06/31/39/980063139.db2.gz RBCSLZRMNBMZNS-LGFJLYTPSA-N 2 0 248.414 2.352 20 0 BEADRP c1[nH+]cn2c1cccc2C[N@@H+]1CCC[C@H]2C[C@H]21 ZINC001238109678 980161854 /nfs/dbraw/zinc/16/18/54/980161854.db2.gz IQAJOBKPEQBAGS-SMDDNHRTSA-N 2 0 227.311 2.319 20 0 BEADRP [NH3+]C[C@H]1CCC[N@H+](C[C@H]2CC3CCC2CC3)C1 ZINC000691663196 980382193 /nfs/dbraw/zinc/38/21/93/980382193.db2.gz RRXRKPZOKDRZIB-HXSCFSKGSA-N 2 0 236.403 2.483 20 0 BEADRP [NH3+]C[C@H]1CCC[N@H+](C[C@@H]2CC3CCC2CC3)C1 ZINC000691663200 980383371 /nfs/dbraw/zinc/38/33/71/980383371.db2.gz RRXRKPZOKDRZIB-JYVUQVBGSA-N 2 0 236.403 2.483 20 0 BEADRP C[N@@H+]1CCc2ccc(C3=CCC[NH2+]CC3)cc2C1 ZINC001238951554 980388418 /nfs/dbraw/zinc/38/84/18/980388418.db2.gz WIILDRHNPSSVBO-UHFFFAOYSA-N 2 0 242.366 2.441 20 0 BEADRP Cc1ccc2c(c1)C1(C[C@H]2[NH3+])CC[NH2+]CC1 ZINC001239320190 980531202 /nfs/dbraw/zinc/53/12/02/980531202.db2.gz ZGQFWBGHYXGPNO-CYBMUJFWSA-N 2 0 216.328 2.020 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]CCc1ccc(F)cc1F ZINC001345103465 980549702 /nfs/dbraw/zinc/54/97/02/980549702.db2.gz FTGTXSKSUHDADF-SNVBAGLBSA-N 2 0 242.313 2.095 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]Cc1ccc2c(c1)CCC2 ZINC001345104196 980551282 /nfs/dbraw/zinc/55/12/82/980551282.db2.gz LBSQLJWHGHXTSM-GFCCVEGCSA-N 2 0 232.371 2.263 20 0 BEADRP CC(C)(C)C[N@@H+]1CCC[C@@](F)(C[NH3+])CC1 ZINC001205537224 980904548 /nfs/dbraw/zinc/90/45/48/980904548.db2.gz GINDTEBRXHKIIO-LBPRGKRZSA-N 2 0 216.344 2.185 20 0 BEADRP C[C@@H]([NH3+])c1ccc(-c2cncc(C[NH3+])c2)cc1 ZINC001239798388 980937817 /nfs/dbraw/zinc/93/78/17/980937817.db2.gz OWTZQJULSJTBGZ-SNVBAGLBSA-N 2 0 227.311 2.227 20 0 BEADRP CCCCC[N@@H+]1CC[C@@H](C)[C@H](C[NH3+])CC1 ZINC001205602645 981165961 /nfs/dbraw/zinc/16/59/61/981165961.db2.gz KXRDNHFAAANRKN-OLZOCXBDSA-N 2 0 212.381 2.483 20 0 BEADRP C[C@H]1CCC[N@H+](CCCCNc2cc[nH+]cc2)C1 ZINC001347772058 981169531 /nfs/dbraw/zinc/16/95/31/981169531.db2.gz JZNLBQLFYYIGJM-AWEZNQCLSA-N 2 0 247.386 2.428 20 0 BEADRP Cc1c[nH]c(C[N@H+]2CC[C@@H](C)[C@@H](C[NH3+])CC2)c1C ZINC001205625257 981270979 /nfs/dbraw/zinc/27/09/79/981270979.db2.gz ANUJZYQKDVSXTA-BXUZGUMPSA-N 2 0 249.402 2.438 20 0 BEADRP CO[C@@H]1CC[C@H]([NH2+][C@H]2CC[N@H+](C)C(C)(C)C2)C1 ZINC001348100599 981281234 /nfs/dbraw/zinc/28/12/34/981281234.db2.gz YFSFFZCTDWMZJU-RWMBFGLXSA-N 2 0 240.391 2.016 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]C[C@H]1CCOc2ccccc21 ZINC001348516701 981379715 /nfs/dbraw/zinc/37/97/15/981379715.db2.gz WKQRMLYPSZCYHR-CHWSQXEVSA-N 2 0 248.370 2.140 20 0 BEADRP c1cc(C2=CC[NH2+]CC2)ccc1C[NH+]1CCC1 ZINC001240469303 981405541 /nfs/dbraw/zinc/40/55/41/981405541.db2.gz SSQIXHJWHFECNA-UHFFFAOYSA-N 2 0 228.339 2.269 20 0 BEADRP C[NH+](C)Cc1cc(C2=CC[NH2+]CC2)ccc1F ZINC001240470503 981406937 /nfs/dbraw/zinc/40/69/37/981406937.db2.gz KRUSXGKMSMJLON-UHFFFAOYSA-N 2 0 234.318 2.264 20 0 BEADRP CC[NH+](CC)Cc1ccncc1C1=CC[NH2+]CC1 ZINC001240470120 981407036 /nfs/dbraw/zinc/40/70/36/981407036.db2.gz AFUSZEUDVFAPLC-UHFFFAOYSA-N 2 0 245.370 2.300 20 0 BEADRP C[N@@H+]1CC[C@H](c2ccc(C3=CC[NH2+]CC3)cc2)C1 ZINC001240470278 981407148 /nfs/dbraw/zinc/40/71/48/981407148.db2.gz LKBLTYBVHNSYET-INIZCTEOSA-N 2 0 242.366 2.482 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CCc1ccc(N(C)C)cc1 ZINC001348841366 981454281 /nfs/dbraw/zinc/45/42/81/981454281.db2.gz SLHLULPHRZTDFP-STQMWFEESA-N 2 0 249.402 2.011 20 0 BEADRP CC[NH+](CC)Cc1ccncc1C1=CCC[NH2+]C1 ZINC001240671331 981582768 /nfs/dbraw/zinc/58/27/68/981582768.db2.gz SDAVAMUVWQHMNW-UHFFFAOYSA-N 2 0 245.370 2.300 20 0 BEADRP C(c1cc(N2CCCC2)cc[nH+]1)=C1CC[NH2+]CC1 ZINC001240874071 981915933 /nfs/dbraw/zinc/91/59/33/981915933.db2.gz OXJYABHJNLOWTJ-UHFFFAOYSA-N 2 0 243.354 2.449 20 0 BEADRP C(c1ccc2c(c1)CC[NH2+]C2)=C1CC[NH2+]CC1 ZINC001240875823 981921438 /nfs/dbraw/zinc/92/14/38/981921438.db2.gz NWXKVKADKFYTAY-UHFFFAOYSA-N 2 0 228.339 2.099 20 0 BEADRP C[C@H]([NH3+])c1ccc(C=C2CC[NH2+]CC2)cc1 ZINC001240877446 981929141 /nfs/dbraw/zinc/92/91/41/981929141.db2.gz VKBFFOPZOYYCQF-NSHDSACASA-N 2 0 216.328 2.473 20 0 BEADRP C[NH+](C)/C=C/c1ccncc1C=C1CC[NH2+]CC1 ZINC001240879292 981936325 /nfs/dbraw/zinc/93/63/25/981936325.db2.gz OADMWQGTTHXGEB-UXBLZVDNSA-N 2 0 243.354 2.381 20 0 BEADRP CCC[NH2+]CCN[C@H](CCC[NH3+])c1ccccc1 ZINC001350955949 982132851 /nfs/dbraw/zinc/13/28/51/982132851.db2.gz KLMQSRRFPRSTBB-OAHLLOKOSA-N 2 0 249.402 2.056 20 0 BEADRP C[N@H+]1CC=C(c2ccc3c(c2)C[NH2+]CC3)CC1 ZINC001241319176 982471633 /nfs/dbraw/zinc/47/16/33/982471633.db2.gz DUMZEBOXYYDJAV-UHFFFAOYSA-N 2 0 228.339 2.051 20 0 BEADRP C[N@H+]1CC=C(c2ccc3c(c2)CC[NH2+]C3)CC1 ZINC001241319307 982477982 /nfs/dbraw/zinc/47/79/82/982477982.db2.gz HGLIDGYUMPQPKN-UHFFFAOYSA-N 2 0 228.339 2.051 20 0 BEADRP C[N@H+]1CC=C(c2cccc(C3([NH3+])CC3)c2)CC1 ZINC001241330036 982492412 /nfs/dbraw/zinc/49/24/12/982492412.db2.gz GJTAKJKVKYKKSP-UHFFFAOYSA-N 2 0 228.339 2.353 20 0 BEADRP COC[C@@H](C)[NH2+]CCC1CC[NH+](C(C)C)CC1 ZINC001352862680 982606270 /nfs/dbraw/zinc/60/62/70/982606270.db2.gz LRBNQYKMDJYXTF-CYBMUJFWSA-N 2 0 242.407 2.121 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]CC[C@@H]2CC[C@H]3C[C@H]32)C12CCC2 ZINC000717024843 983031269 /nfs/dbraw/zinc/03/12/69/983031269.db2.gz VOLZYERDAOFODQ-YHQUGGNUSA-N 2 0 234.387 2.282 20 0 BEADRP CC[N@@H+]1C[C@H](C)N(c2cc[nH+]cc2)C[C@@H]1C ZINC001354019631 983116991 /nfs/dbraw/zinc/11/69/91/983116991.db2.gz UBOVYSZGSRIGEY-RYUDHWBXSA-N 2 0 219.332 2.001 20 0 BEADRP Cc1c(N)cc[nH+]c1-c1ccc(C[NH3+])cc1 ZINC001241912911 983130620 /nfs/dbraw/zinc/13/06/20/983130620.db2.gz ZAIXJQSJICYLDL-UHFFFAOYSA-N 2 0 213.284 2.098 20 0 BEADRP [NH3+]Cc1ccc(-c2cccn3c[nH+]cc23)cc1 ZINC001241918463 983137422 /nfs/dbraw/zinc/13/74/22/983137422.db2.gz XGWNTMLICXEDMH-UHFFFAOYSA-N 2 0 223.279 2.460 20 0 BEADRP CS[C@H]1CCC[C@@H]([NH2+]CCCN2CCC2)C1 ZINC001354171428 983181534 /nfs/dbraw/zinc/18/15/34/983181534.db2.gz QSEPLSNSTJCZRN-OLZOCXBDSA-N 2 0 242.432 2.346 20 0 BEADRP CC[N@@H+]1CC[C@@H]2C[NH+](Cc3ccccc3)C[C@H]2C1 ZINC001201587735 983349550 /nfs/dbraw/zinc/34/95/50/983349550.db2.gz XFDKMCLDPCNZCF-HZPDHXFCSA-N 2 0 244.382 2.460 20 0 BEADRP CC[N@@H+]1CCCC[C@H]1C[C@@H]1CCC[NH+]1C ZINC001201586903 983351668 /nfs/dbraw/zinc/35/16/68/983351668.db2.gz WNGVAPXNOWYUDP-STQMWFEESA-N 2 0 210.365 2.345 20 0 BEADRP C[NH+]1CCC2(C[NH+](CCc3ccccc3)C2)CC1 ZINC001201606224 983375084 /nfs/dbraw/zinc/37/50/84/983375084.db2.gz QCGLGFSIRCSPNC-UHFFFAOYSA-N 2 0 244.382 2.257 20 0 BEADRP CC[N@H+]1C[C@@H]2C[NH+](CCc3ccccc3)C[C@@H]2C1 ZINC001201609537 983375363 /nfs/dbraw/zinc/37/53/63/983375363.db2.gz GKOSGZYDNOUMJA-IYBDPMFKSA-N 2 0 244.382 2.113 20 0 BEADRP CCC[NH+]1CCC(C2CC[NH+](C)CC2)CC1 ZINC001201643549 983396734 /nfs/dbraw/zinc/39/67/34/983396734.db2.gz RQDUWUJSHLVBBS-UHFFFAOYSA-N 2 0 224.392 2.450 20 0 BEADRP CCC[NH+]1C[C@@H]2C[NH+](Cc3ccccc3)C[C@H]2C1 ZINC001201643355 983398052 /nfs/dbraw/zinc/39/80/52/983398052.db2.gz GZIULWRJHNMFMH-HZPDHXFCSA-N 2 0 244.382 2.460 20 0 BEADRP CCCCC[N@@H+]1C[C@H]2C[C@@]2(C[NH+](C)C)C1 ZINC001201737533 983446757 /nfs/dbraw/zinc/44/67/57/983446757.db2.gz SJZWJEXFBGIPFV-CHWSQXEVSA-N 2 0 210.365 2.060 20 0 BEADRP CC(C)CC[C@@H](O)C[NH2+]CCC[N@H+](C)C(C)C ZINC001356569832 983630555 /nfs/dbraw/zinc/63/05/55/983630555.db2.gz QAIYWEGUIGZRRC-CQSZACIVSA-N 2 0 244.423 2.103 20 0 BEADRP CCCC[C@@H](O)C[NH2+]CCCC[NH+](CC)CC ZINC001252108408 983668252 /nfs/dbraw/zinc/66/82/52/983668252.db2.gz NZTNPJHOMYXTKB-CQSZACIVSA-N 2 0 244.423 2.249 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CC[C@H]3C[N@@H+](C)C[C@@H]32)cc1 ZINC001474302673 983902086 /nfs/dbraw/zinc/90/20/86/983902086.db2.gz CKULLGIGSYMHSY-HRCADAONSA-N 2 0 244.382 2.425 20 0 BEADRP c1ccc([C@H]2C[C@@H]2[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000149816169 983957549 /nfs/dbraw/zinc/95/75/49/983957549.db2.gz OOUPHCVQCFQHLO-FVPDABNVSA-N 2 0 242.366 2.415 20 0 BEADRP C[NH2+][C@@]12CC[C@@]([NH2+]Cc3ccc[nH]3)(C1)CCC2 ZINC001275044876 984444639 /nfs/dbraw/zinc/44/46/39/984444639.db2.gz GYWPZRNAIHKMGY-UONOGXRCSA-N 2 0 233.359 2.169 20 0 BEADRP C[N@H+]1C[C@@H]2CC[NH+](C3CCCC3)CC[C@@H]2C1 ZINC001275044544 984449879 /nfs/dbraw/zinc/44/98/79/984449879.db2.gz BPTGVIOFCHHIPC-BETUJISGSA-N 2 0 222.376 2.203 20 0 BEADRP CC[NH+]1CCC2(CC[N@H+](Cc3ccc[nH]3)C2)CC1 ZINC001275085059 984480521 /nfs/dbraw/zinc/48/05/21/984480521.db2.gz MXONOTHMIQTNEY-UHFFFAOYSA-N 2 0 247.386 2.323 20 0 BEADRP C[NH2+][C@@]12CC[C@@]([NH2+]CC3CCC3)(C1)CCC2 ZINC001275181386 984510738 /nfs/dbraw/zinc/51/07/38/984510738.db2.gz ZDYZLWPVFJUREC-UONOGXRCSA-N 2 0 222.376 2.441 20 0 BEADRP [NH3+]C1(c2ccccc2C2=CC[NH2+]C2)CCC1 ZINC001243111707 984577843 /nfs/dbraw/zinc/57/78/43/984577843.db2.gz NDCADXSTCGNHDN-UHFFFAOYSA-N 2 0 214.312 2.011 20 0 BEADRP CC(C)[NH2+]CC[NH2+][C@H]1C[C@H](C)C[C@H](C)C1 ZINC000719345226 984631730 /nfs/dbraw/zinc/63/17/30/984631730.db2.gz HKHXUZSARKWJPA-ITGUQSILSA-N 2 0 212.381 2.399 20 0 BEADRP CCO[C@@H]1CCCC[C@H]1[NH2+][C@H]1CC[C@H](C[NH3+])C1 ZINC001578148912 984856490 /nfs/dbraw/zinc/85/64/90/984856490.db2.gz NSWHANSRSOOYAX-IGQOVBAYSA-N 2 0 240.391 2.051 20 0 BEADRP CCS[C@@H]1CCC[C@H]1[NH2+]C[C@H]1CC[C@@H]([NH3+])C1 ZINC001578216717 984867258 /nfs/dbraw/zinc/86/72/58/984867258.db2.gz PUNLSMBMVQGIFD-UMSGYPCISA-N 2 0 242.432 2.378 20 0 BEADRP COCCC1([NH3+])CC[NH+](C2CCCCC2)CC1 ZINC001257453968 985048913 /nfs/dbraw/zinc/04/89/13/985048913.db2.gz ZPCNYSRADCMXER-UHFFFAOYSA-N 2 0 240.391 2.149 20 0 BEADRP C[N@H+](CCCCOC(C)(C)C)CC(C)(C)C[NH3+] ZINC001578465789 985101479 /nfs/dbraw/zinc/10/14/79/985101479.db2.gz ODCGKLSNRXJJST-UHFFFAOYSA-N 2 0 244.423 2.498 20 0 BEADRP CCCCCC(CCCCC)[NH2+]C[C@H](O)C[NH3+] ZINC001257549792 985231786 /nfs/dbraw/zinc/23/17/86/985231786.db2.gz DEVRKHMHQPGQIC-CQSZACIVSA-N 2 0 244.423 2.425 20 0 BEADRP CO[C@@H]1CC[C@H](C)[N@H+](CCCCCC[NH3+])C1 ZINC000687191889 985257073 /nfs/dbraw/zinc/25/70/73/985257073.db2.gz BNLQZWUXBYQGGL-QWHCGFSZSA-N 2 0 228.380 2.005 20 0 BEADRP CO[C@H]1CC[C@@H](C)[N@H+](CCCCCC[NH3+])C1 ZINC000687191888 985257451 /nfs/dbraw/zinc/25/74/51/985257451.db2.gz BNLQZWUXBYQGGL-OLZOCXBDSA-N 2 0 228.380 2.005 20 0 BEADRP CNc1ccccc1C[NH2+][C@@H]1C[C@H]([NH3+])C12CCC2 ZINC001578764563 985325385 /nfs/dbraw/zinc/32/53/85/985325385.db2.gz YROSKFNUNUMIEY-UONOGXRCSA-N 2 0 245.370 2.088 20 0 BEADRP CC(C)C[C@H](C)C[C@H](C)[NH2+]CCOCC[NH3+] ZINC001258054410 985354951 /nfs/dbraw/zinc/35/49/51/985354951.db2.gz COFHZKFJBRPKOZ-STQMWFEESA-N 2 0 230.396 2.012 20 0 BEADRP CO[C@](C)(C[N@@H+]1CCCCC[C@@H]([NH3+])C1)C1CC1 ZINC001578897016 985478463 /nfs/dbraw/zinc/47/84/63/985478463.db2.gz HVOXVDSLPDWEOV-ZIAGYGMSSA-N 2 0 240.391 2.005 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H]1COC[C@@H]1C ZINC000688024901 985497968 /nfs/dbraw/zinc/49/79/68/985497968.db2.gz NHDFUYDRZSKKOT-MELADBBJSA-N 2 0 242.407 2.121 20 0 BEADRP CC[C@@H](C)[NH2+]Cc1cc2c(s1)CC[NH2+]C2 ZINC000688037622 985507979 /nfs/dbraw/zinc/50/79/79/985507979.db2.gz CBXAJTUESJRZSM-SECBINFHSA-N 2 0 224.373 2.282 20 0 BEADRP CC(C)[N@H+](C)Cc1cc2c(s1)CC[NH2+]C2 ZINC000688038472 985509100 /nfs/dbraw/zinc/50/91/00/985509100.db2.gz LJPMKGKLDQNEIZ-UHFFFAOYSA-N 2 0 224.373 2.234 20 0 BEADRP CO[C@@H](C[NH2+]C1(C[NH3+])CCCCC1)CC(C)C ZINC001578912590 985514900 /nfs/dbraw/zinc/51/49/00/985514900.db2.gz JNLSGTLRSCCDPZ-CYBMUJFWSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@@H](Cc1ccco1)[NH2+]CC12CC[NH+](CC1)CC2 ZINC001258177531 985570683 /nfs/dbraw/zinc/57/06/83/985570683.db2.gz XNAXWWKMNIMOJU-ZDUSSCGKSA-N 2 0 248.370 2.286 20 0 BEADRP C[NH+](C)Cc1cccc(/C=C/C2CC[NH2+]CC2)n1 ZINC001243895180 985576905 /nfs/dbraw/zinc/57/69/05/985576905.db2.gz ZVQUFECFVXXPHB-VOTSOKGWSA-N 2 0 245.370 2.156 20 0 BEADRP [NH3+][C@H](CC(F)F)C[N@@H+]1CCC[C@@H]1C1CCC1 ZINC000688242614 985588116 /nfs/dbraw/zinc/58/81/16/985588116.db2.gz VHGDVTZWLSGJEG-GHMZBOCLSA-N 2 0 232.318 2.233 20 0 BEADRP [NH3+]Cc1cccc(/C=C/C2CC[NH2+]CC2)c1F ZINC001243897755 985587865 /nfs/dbraw/zinc/58/78/65/985587865.db2.gz SOCGOSUSXWHPND-SNAWJCMRSA-N 2 0 234.318 2.297 20 0 BEADRP C(CC1CCC1)C[N@@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1 ZINC000688381985 985625473 /nfs/dbraw/zinc/62/54/73/985625473.db2.gz PPXWMJSYCICJSX-UONOGXRCSA-N 2 0 222.376 2.108 20 0 BEADRP C[NH+](C)Cc1ccc(C2=C[NH2+]CCC2)cc1 ZINC001243950573 985634798 /nfs/dbraw/zinc/63/47/98/985634798.db2.gz GADHXFMMXFOTRV-UHFFFAOYSA-N 2 0 216.328 2.473 20 0 BEADRP COCC[C@@H]([NH3+])C[NH2+]CC(C)(C)C1=CCCC1 ZINC001579001085 985645458 /nfs/dbraw/zinc/64/54/58/985645458.db2.gz FNZLUNNOXSHXGZ-CYBMUJFWSA-N 2 0 240.391 2.076 20 0 BEADRP COc1cccc(C[NH2+][C@H]2C[C@@H]([NH3+])C2(C)C)c1C ZINC001579277709 985827812 /nfs/dbraw/zinc/82/78/12/985827812.db2.gz KNSHHGOORUROGB-KGLIPLIRSA-N 2 0 248.370 2.219 20 0 BEADRP COc1cccc([C@@H]2C[C@H]2C[NH2+]CC(C)(C)[NH3+])c1 ZINC001579285938 985830345 /nfs/dbraw/zinc/83/03/45/985830345.db2.gz UWFLEGMHVQFHHK-JSGCOSHPSA-N 2 0 248.370 2.126 20 0 BEADRP CSCC1CCC([NH2+][C@H]2CC[NH2+][C@@H]2C)CC1 ZINC001579371041 985864914 /nfs/dbraw/zinc/86/49/14/985864914.db2.gz VRXSAPYBQMSWOQ-XVSSEFHLSA-N 2 0 242.432 2.248 20 0 BEADRP [NH3+]C[C@H]1CCCC[N@H+](CCCc2ccncc2)C1 ZINC001206606112 985894209 /nfs/dbraw/zinc/89/42/09/985894209.db2.gz DNSRKESDTJYVOD-OAHLLOKOSA-N 2 0 247.386 2.075 20 0 BEADRP [NH3+]C[C@@H]1CCCC[N@H+](C[C@@H]2C[C@H]3C=C[C@@H]2C3)C1 ZINC001206606786 985935378 /nfs/dbraw/zinc/93/53/78/985935378.db2.gz SKGZWBPAJLSXAK-XQLPTFJDSA-N 2 0 234.387 2.259 20 0 BEADRP CCCCC[C@@H](CCC)[NH2+]CCOCC[NH3+] ZINC001258661316 985997021 /nfs/dbraw/zinc/99/70/21/985997021.db2.gz DSGCZCWHAVIPSB-CYBMUJFWSA-N 2 0 230.396 2.300 20 0 BEADRP Cc1cc(C[N@H+]2CCC[C@H]([C@@H](C)[NH3+])C2)cc(C)n1 ZINC001579598176 986110239 /nfs/dbraw/zinc/11/02/39/986110239.db2.gz GYXKIMXDXZRSCI-HIFRSBDPSA-N 2 0 247.386 2.258 20 0 BEADRP Cc1cc(C[N@H+]2C[C@@H](C)[C@H](CC[NH3+])C2)c(C)o1 ZINC001579598533 986118691 /nfs/dbraw/zinc/11/86/91/986118691.db2.gz ZRTJBNVWLAHNHE-ZWNOBZJWSA-N 2 0 236.359 2.313 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2C[C@H](C[NH3+])C2)cc1C ZINC001579696805 986178599 /nfs/dbraw/zinc/17/85/99/986178599.db2.gz GLAMHJIWQZGSBP-HDJSIYSDSA-N 2 0 218.344 2.130 20 0 BEADRP Cc1coc(C[NH2+]C[C@H]2C[C@H]3CC[C@@H](C2)[NH2+]3)c1 ZINC001579830760 986256112 /nfs/dbraw/zinc/25/61/12/986256112.db2.gz VTSIPLXSGPSPLN-CLLJXQQHSA-N 2 0 234.343 2.208 20 0 BEADRP CCC[N@H+](CCC[NH+](C)C)CC1CCC1 ZINC001202792958 986312648 /nfs/dbraw/zinc/31/26/48/986312648.db2.gz PMAKYLNCEWNASH-UHFFFAOYSA-N 2 0 212.381 2.450 20 0 BEADRP FC(F)C1CC([NH2+]C[C@H]2CCC[NH2+]CC2)C1 ZINC001580024127 986428308 /nfs/dbraw/zinc/42/83/08/986428308.db2.gz QINCLLPVAACCOL-WHXUTIOJSA-N 2 0 232.318 2.009 20 0 BEADRP Fc1cccc2c1CCC[C@@H]2[NH2+]CC1C[NH2+]C1 ZINC001580033851 986434189 /nfs/dbraw/zinc/43/41/89/986434189.db2.gz AIRFRYRQFJFZJG-AWEZNQCLSA-N 2 0 234.318 2.012 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@H]([NH2+][C@@H]3CC[C@H]3C3CCC3)[C@H]2C1 ZINC001462674642 986504429 /nfs/dbraw/zinc/50/44/29/986504429.db2.gz YXXHIYMLCXKQJR-GVRJEKJASA-N 2 0 248.414 2.495 20 0 BEADRP [NH3+][C@]12CCC[C@H]1C[N@H+](CC1CC3(CCC3)C1)C2 ZINC001580158562 986628302 /nfs/dbraw/zinc/62/83/02/986628302.db2.gz SUKBRYOTICYQAQ-ZFWWWQNUSA-N 2 0 234.387 2.380 20 0 BEADRP [NH3+][C@H]1CC12CC([NH2+][C@@H]1C[C@@H]3CCCC[C@H]13)C2 ZINC001580166752 986643730 /nfs/dbraw/zinc/64/37/30/986643730.db2.gz RNPZEOYYHZPDKW-BVNMLTRDSA-N 2 0 220.360 2.035 20 0 BEADRP C[C@@H]1C[N@@H+]([C@@H]2CCC[NH+](C)CC2)CCC1(F)F ZINC001254516815 986653651 /nfs/dbraw/zinc/65/36/51/986653651.db2.gz QAYPYOGYXZBCRG-VXGBXAGGSA-N 2 0 246.345 2.448 20 0 BEADRP C[C@H]1C[N@@H+]([C@@H]2CCC[NH+](C)CC2)CCC1(F)F ZINC001254516813 986659614 /nfs/dbraw/zinc/65/96/14/986659614.db2.gz QAYPYOGYXZBCRG-NWDGAFQWSA-N 2 0 246.345 2.448 20 0 BEADRP [NH3+]CC1(C[NH2+]C[C@@H]2C[C@H]2C2CCC2)CCC1 ZINC001580244136 986693378 /nfs/dbraw/zinc/69/33/78/986693378.db2.gz QJJWZBPNFXVOOX-STQMWFEESA-N 2 0 222.376 2.141 20 0 BEADRP [NH3+]CC1CC([NH2+]C[C@H]2CC3CCC2CC3)C1 ZINC001580256011 986710228 /nfs/dbraw/zinc/71/02/28/986710228.db2.gz PDYGEUBGJMOEJY-JEFIIJIESA-N 2 0 222.376 2.140 20 0 BEADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@@H]2C[C@@]2(F)c2ccccc2)C1 ZINC001580258257 986714422 /nfs/dbraw/zinc/71/44/22/986714422.db2.gz LGXPSWIIKGJBMB-FAAHXZRKSA-N 2 0 248.345 2.341 20 0 BEADRP [NH3+]CC[C@H]1CC[N@H+](Cc2cccn2C(F)F)C1 ZINC001580288355 986731770 /nfs/dbraw/zinc/73/17/70/986731770.db2.gz KBBIJTVEGCXPEP-JTQLQIEISA-N 2 0 243.301 2.054 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+]Cc2cccc(Cl)c2F)C1 ZINC001580421857 986838918 /nfs/dbraw/zinc/83/89/18/986838918.db2.gz SMSVNBVWRRHLGE-WAAGHKOSSA-N 2 0 242.725 2.306 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+][C@@H]2CCC[C@H]2Cc2ccccc2)C1 ZINC001580423200 986842235 /nfs/dbraw/zinc/84/22/35/986842235.db2.gz UCBQKFMGSPTIOF-CAOSSQGBSA-N 2 0 244.382 2.477 20 0 BEADRP CCCC[C@@H](C)N(CCC[NH3+])CCC[NH+](C)C ZINC001255315010 986909002 /nfs/dbraw/zinc/90/90/02/986909002.db2.gz ZPXSGSZWLOTLEF-CQSZACIVSA-N 2 0 243.439 2.168 20 0 BEADRP [NH3+]Cc1cnccc1-c1c[nH+]cc2cc[nH]c21 ZINC001245559217 986951516 /nfs/dbraw/zinc/95/15/16/986951516.db2.gz DMLCUHSLLBWGJY-UHFFFAOYSA-N 2 0 224.267 2.084 20 0 BEADRP CC(C)([NH3+])c1ccc(-c2ccncc2C[NH3+])cc1 ZINC001245559883 986954151 /nfs/dbraw/zinc/95/41/51/986954151.db2.gz HXZHNULOBRSYPQ-UHFFFAOYSA-N 2 0 241.338 2.401 20 0 BEADRP COC[C@H](C)[N@H+](CC(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001255565417 987019853 /nfs/dbraw/zinc/01/98/53/987019853.db2.gz PNOKCRWCWWEIIG-IHRRRGAJSA-N 2 0 242.407 2.249 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]C[C@@H]1CCCOC1 ZINC001255944787 987076412 /nfs/dbraw/zinc/07/64/12/987076412.db2.gz ZKJGBSHJHYWLJR-KGLIPLIRSA-N 2 0 242.407 2.123 20 0 BEADRP CCCOCC[NH2+][C@@H](C)CC[NH+](CC)CC ZINC001255946460 987087296 /nfs/dbraw/zinc/08/72/96/987087296.db2.gz VKLYJPRHKLAXOO-ZDUSSCGKSA-N 2 0 230.396 2.123 20 0 BEADRP CC(C)([NH3+])c1ccc(-c2cc(C[NH3+])ccn2)cc1 ZINC001245903428 987130009 /nfs/dbraw/zinc/13/00/09/987130009.db2.gz OYDVUUOHAHOEIT-UHFFFAOYSA-N 2 0 241.338 2.401 20 0 BEADRP CCCCC[C@@H](O)C[N@@H+]1CCC[C@](C)([NH3+])CC1 ZINC001246020322 987310091 /nfs/dbraw/zinc/31/00/91/987310091.db2.gz KQOVEPXQNLBHEW-KGLIPLIRSA-N 2 0 242.407 2.131 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+][C@H]2CCC23CCCC3)C1 ZINC000693771054 987315601 /nfs/dbraw/zinc/31/56/01/987315601.db2.gz SNXOQXRZMWYUEF-SRVKXCTJSA-N 2 0 208.349 2.036 20 0 BEADRP CC1(C)CCC[N@@H+]1C[C@H]1CCCC[NH2+]C1 ZINC000697039324 987345893 /nfs/dbraw/zinc/34/58/93/987345893.db2.gz FZCYBYICHPKXDX-LBPRGKRZSA-N 2 0 210.365 2.251 20 0 BEADRP CC[C@H]1CC[N@H+](C[C@H]2CCCC[NH2+]C2)C1 ZINC000697044077 987345983 /nfs/dbraw/zinc/34/59/83/987345983.db2.gz ZEMJLSWVOCGFDM-STQMWFEESA-N 2 0 210.365 2.108 20 0 BEADRP CC1(C)CCC[N@@H+]1C[C@@H]1CCCC[NH2+]C1 ZINC000697039323 987346610 /nfs/dbraw/zinc/34/66/10/987346610.db2.gz FZCYBYICHPKXDX-GFCCVEGCSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@@H]1SCC[N@H+](C[C@@H]2CCCC[NH2+]C2)[C@H]1C ZINC000697058714 987346690 /nfs/dbraw/zinc/34/66/90/987346690.db2.gz TYRWPJPVOHUGDB-RWMBFGLXSA-N 2 0 242.432 2.202 20 0 BEADRP CCC[N@H+](C[C@@H]1CCCC[NH2+]C1)C1CC1 ZINC000697039773 987346898 /nfs/dbraw/zinc/34/68/98/987346898.db2.gz GVTCZXJJHKPKAC-GFCCVEGCSA-N 2 0 210.365 2.251 20 0 BEADRP C([C@@H]1CCCC[NH2+]C1)[N@@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC000697052292 987348308 /nfs/dbraw/zinc/34/83/08/987348308.db2.gz MXPFKWSSNLXYEM-MCIONIFRSA-N 2 0 222.376 2.108 20 0 BEADRP CC[C@@H]1C[C@H](C)C[N@@H+]1C[C@H]1CCCC[NH2+]C1 ZINC000697037161 987348394 /nfs/dbraw/zinc/34/83/94/987348394.db2.gz OBGWUAAIFFDMND-MELADBBJSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H]1C[C@H](C)C[N@@H+]1C[C@@H]1CCCC[NH2+]C1 ZINC000697037159 987348609 /nfs/dbraw/zinc/34/86/09/987348609.db2.gz OBGWUAAIFFDMND-BFHYXJOUSA-N 2 0 224.392 2.497 20 0 BEADRP CC1([NH2+][C@@H]2CCCC[NH2+]C2)CCCCC1 ZINC001246079743 987370806 /nfs/dbraw/zinc/37/08/06/987370806.db2.gz FQKWCQTUBGDDRV-GFCCVEGCSA-N 2 0 210.365 2.441 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc3c(c2)CCC3)CC[NH2+]1 ZINC001246078956 987372160 /nfs/dbraw/zinc/37/21/60/987372160.db2.gz IKTMJHUHSVEDGH-WBMJQRKESA-N 2 0 244.382 2.405 20 0 BEADRP CC(C)OCC[C@@H](C)[NH2+]C[C@@H]1C[NH2+]C[C@@H](C)C1 ZINC001246096183 987408340 /nfs/dbraw/zinc/40/83/40/987408340.db2.gz DIICDDLEDMGRKQ-MJBXVCDLSA-N 2 0 242.407 2.025 20 0 BEADRP CSCC[C@H](C)[NH2+]C[C@@H]1CC[C@H](C)[NH2+]C1 ZINC001246099004 987412099 /nfs/dbraw/zinc/41/20/99/987412099.db2.gz QYDFQXGMGDCZIQ-SDDRHHMPSA-N 2 0 230.421 2.106 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+][C@H]2C[C@@H]3[C@H](C2)C3(C)C)[NH2+]C1 ZINC001246102753 987427270 /nfs/dbraw/zinc/42/72/70/987427270.db2.gz FIBOXGMJDLBSFE-XGFWRYKXSA-N 2 0 236.403 2.399 20 0 BEADRP C[C@H](CC1CC1)[NH2+]C[C@H]1C[NH2+]C[C@@H](C)C1 ZINC001246107178 987437146 /nfs/dbraw/zinc/43/71/46/987437146.db2.gz ZITXRHSFIMEARC-DMDPSCGWSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@H]1C[NH2+]C[C@@H]1[NH2+][C@@H]1C[C@H](C)CC(C)(C)C1 ZINC001246108742 987442133 /nfs/dbraw/zinc/44/21/33/987442133.db2.gz MRTLBRBZQWCLME-RVMXOQNASA-N 2 0 224.392 2.399 20 0 BEADRP C[C@H](CC1CC1)[NH2+]C[C@@H]1C[NH2+]CC[C@@H]1C ZINC001246113428 987451601 /nfs/dbraw/zinc/45/16/01/987451601.db2.gz QUPXKJGNOSJSHK-LOWVWBTDSA-N 2 0 210.365 2.010 20 0 BEADRP CC(C)CCC[C@H](C)[NH2+][C@@H]1C[NH2+]C[C@@H]1C ZINC001246115481 987452885 /nfs/dbraw/zinc/45/28/85/987452885.db2.gz IABXRPMSTQARBD-RWMBFGLXSA-N 2 0 212.381 2.399 20 0 BEADRP [NH3+]Cc1cccc2c1ccn2[C@H]1CCC[NH2+]C1 ZINC001246115290 987454419 /nfs/dbraw/zinc/45/44/19/987454419.db2.gz RIRCFUFKNCGZOF-LBPRGKRZSA-N 2 0 229.327 2.025 20 0 BEADRP CC1CCC([NH2+]C[C@@H]2C[NH2+]CC[C@H]2C)CC1 ZINC001246117252 987460139 /nfs/dbraw/zinc/46/01/39/987460139.db2.gz YPTWZPOORIRRSU-DKNRTOFZSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H]1C[NH2+]C[C@H]1[NH2+]C1CCCCCCC1 ZINC001246117668 987460268 /nfs/dbraw/zinc/46/02/68/987460268.db2.gz TUHHJDUKMNMTKT-WCQYABFASA-N 2 0 210.365 2.297 20 0 BEADRP CCCCCC[C@@H](CC)[NH2+]CCC1(O)C[NH2+]C1 ZINC001246117899 987463121 /nfs/dbraw/zinc/46/31/21/987463121.db2.gz NBJBLDBUFXKFNI-CYBMUJFWSA-N 2 0 242.407 2.049 20 0 BEADRP CC[C@@H]1CC[C@H]([NH2+]C[C@H]2C[NH2+]CC[C@H]2C)C1 ZINC001246120681 987467586 /nfs/dbraw/zinc/46/75/86/987467586.db2.gz NJYDTGWSJHWSRW-SYQHCUMBSA-N 2 0 224.392 2.400 20 0 BEADRP CC[C@@H]1CC[C@H]([NH2+]C[C@@H]2C[NH2+]CC[C@H]2C)C1 ZINC001246120680 987469991 /nfs/dbraw/zinc/46/99/91/987469991.db2.gz NJYDTGWSJHWSRW-MQYQWHSLSA-N 2 0 224.392 2.400 20 0 BEADRP C1[C@@H]2C[C@H]([NH2+][C@@H]3CCC4(C3)CC[NH2+]CC4)C[C@H]12 ZINC001246134461 987489760 /nfs/dbraw/zinc/48/97/60/987489760.db2.gz SPBQRFSPJCMFIU-RQJABVFESA-N 2 0 234.387 2.297 20 0 BEADRP CCC1CCC([NH2+][C@H]2C[NH2+]CC23CC3)CC1 ZINC001246136423 987493047 /nfs/dbraw/zinc/49/30/47/987493047.db2.gz XBARPTOHZKKYQJ-BPCQOVAHSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@]2(F)CC[NH2+]C2)CC(C)(C)C1 ZINC001246142521 987498187 /nfs/dbraw/zinc/49/81/87/987498187.db2.gz IVEADAAXDLXMNB-DYEKYZERSA-N 2 0 242.382 2.492 20 0 BEADRP CCCCC[C@@H](CC)[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001246150987 987513014 /nfs/dbraw/zinc/51/30/14/987513014.db2.gz VCUMPBYJDWGCJZ-NDBYEHHHSA-N 2 0 210.365 2.153 20 0 BEADRP CCCC[C@@H]1C[C@H]([NH2+]CCCCC[NH3+])CC[NH2+]1 ZINC001246163781 987525769 /nfs/dbraw/zinc/52/57/69/987525769.db2.gz JJMWGLFQMKKJQV-ZIAGYGMSSA-N 3 0 241.423 2.016 20 0 BEADRP C[C@@H]1C[C@@H](n2ccc3ccc(C[NH3+])cc32)CC[NH2+]1 ZINC001246167309 987527237 /nfs/dbraw/zinc/52/72/37/987527237.db2.gz FHJDDARWABPVIP-RISCZKNCSA-N 2 0 243.354 2.413 20 0 BEADRP [NH3+]Cc1ccc2ccn([C@H]3CCC[NH2+]C3)c2c1 ZINC001246167163 987527590 /nfs/dbraw/zinc/52/75/90/987527590.db2.gz CZSHFFFNQLRUHK-ZDUSSCGKSA-N 2 0 229.327 2.025 20 0 BEADRP Cc1ccc(CC[NH2+][C@H]2CC[NH2+][C@H](C)C2)s1 ZINC001246167111 987528748 /nfs/dbraw/zinc/52/87/48/987528748.db2.gz CQPHSZFBPKWITB-PWSUYJOCSA-N 2 0 238.400 2.329 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CC2(F)CCCCC2)CC[NH2+]1 ZINC001246176206 987543459 /nfs/dbraw/zinc/54/34/59/987543459.db2.gz MKHXBHHLELAXIH-NEPJUHHUSA-N 2 0 228.355 2.389 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC[NH2+]C(C)(C)C1)c1cccc(N)c1 ZINC001246177999 987550485 /nfs/dbraw/zinc/55/04/85/987550485.db2.gz XNMSHELSWXSERG-BXUZGUMPSA-N 2 0 247.386 2.450 20 0 BEADRP CCCC1CCC([NH2+]C[C@H]2CC[NH2+]2)CC1 ZINC001246194658 987587068 /nfs/dbraw/zinc/58/70/68/987587068.db2.gz SJEKIZBNYOUUJQ-WXRRBKDZSA-N 2 0 210.365 2.297 20 0 BEADRP CC1(C)[C@@H]2C[C@@H]([NH2+][C@@H]3CCC[C@@H]([NH3+])C3)C[C@@H]21 ZINC001246203646 987600930 /nfs/dbraw/zinc/60/09/30/987600930.db2.gz CDWUZRJZGFAUHU-VEGXAWMVSA-N 2 0 222.376 2.281 20 0 BEADRP CC[C@@H]1CC[C@@H]([NH2+][C@@H]2CCC[C@@H]([NH3+])C2)C1 ZINC001246206453 987603841 /nfs/dbraw/zinc/60/38/41/987603841.db2.gz PISDPAXZQOFEBA-FDYHWXHSSA-N 2 0 210.365 2.425 20 0 BEADRP CC(C)OCC[C@H](C)[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC001246206364 987604418 /nfs/dbraw/zinc/60/44/18/987604418.db2.gz NNCUHMFVFCEZKN-YNEHKIRRSA-N 2 0 228.380 2.050 20 0 BEADRP C[C@@H]1CC[C@H](NCc2ccc3[nH]ccc3c2)C[NH2+]1 ZINC001246228975 987625229 /nfs/dbraw/zinc/62/52/29/987625229.db2.gz IZVNAZQQSJNWTQ-RISCZKNCSA-N 2 0 243.354 2.398 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCc3ncccc32)CC[NH2+]1 ZINC001246231920 987628789 /nfs/dbraw/zinc/62/87/89/987628789.db2.gz UZPDONRNTVNOIL-TYNCELHUSA-N 2 0 245.370 2.189 20 0 BEADRP Cc1c[nH+]c2ccccc2c1N1CC([NH+](C)C)C1 ZINC001116577663 987634083 /nfs/dbraw/zinc/63/40/83/987634083.db2.gz OTSKFVOKJRJBLH-UHFFFAOYSA-N 2 0 241.338 2.293 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCCCc2ccccn2)CC[NH2+]1 ZINC001246237240 987634614 /nfs/dbraw/zinc/63/46/14/987634614.db2.gz HEMOWHIGAUBTBO-UKRRQHHQSA-N 2 0 247.386 2.134 20 0 BEADRP [NH2+]=C(N[C@@H]1CCC[NH2+]C1)C1CCCCCC1 ZINC001246240754 987642515 /nfs/dbraw/zinc/64/25/15/987642515.db2.gz OKAUASIIOVFCTG-GFCCVEGCSA-N 2 0 223.364 2.276 20 0 BEADRP CO[C@H]1C[NH2+]C[C@@H]1NC(CC(C)C)CC(C)C ZINC001246241260 987643346 /nfs/dbraw/zinc/64/33/46/987643346.db2.gz VVOSPGTYFDTTLI-KBPBESRZSA-N 2 0 242.407 2.024 20 0 BEADRP CC[N@@H+]1CCC[C@@H](C[NH2+]C2CC(C(F)F)C2)C1 ZINC001116619926 987646033 /nfs/dbraw/zinc/64/60/33/987646033.db2.gz YFDOBEUEPODDMM-UNXYVOJBSA-N 2 0 246.345 2.352 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C2CCCCCCC2)C[NH2+]1 ZINC001246242301 987646589 /nfs/dbraw/zinc/64/65/89/987646589.db2.gz DCMVDFQFPFSAHH-YPMHNXCESA-N 2 0 210.365 2.439 20 0 BEADRP C[C@@H]1C[C@H](N2CC[C@@H]([NH3+])c3ccccc32)CC[NH2+]1 ZINC001246259601 987656597 /nfs/dbraw/zinc/65/65/97/987656597.db2.gz BERRZBUYIRMPQK-YRGRVCCFSA-N 2 0 245.370 2.037 20 0 BEADRP C[C@@H]1CC[C@@H](N2CC[C@@H]([NH3+])c3ccccc32)C[NH2+]1 ZINC001246261855 987656765 /nfs/dbraw/zinc/65/67/65/987656765.db2.gz NMXLGPOOYGNFOB-YRGRVCCFSA-N 2 0 245.370 2.037 20 0 BEADRP C[C@H]1CC[C@H]([NH2+][C@H]2CCCC[NH2+]C2)CC1 ZINC001246264693 987658213 /nfs/dbraw/zinc/65/82/13/987658213.db2.gz OPSPVZOOYBNHSQ-AVGNSLFASA-N 2 0 210.365 2.297 20 0 BEADRP CCC[NH2+]CC[NH2+][C@@H](CC)CC(C)C ZINC001246273330 987665672 /nfs/dbraw/zinc/66/56/72/987665672.db2.gz YXNOZVFXUVHHGT-LBPRGKRZSA-N 2 0 200.370 2.400 20 0 BEADRP CC1(C)CCC[C@@H]1[NH2+][C@@H]1CCCC[NH2+]C1 ZINC001246283455 987678717 /nfs/dbraw/zinc/67/87/17/987678717.db2.gz CEIQGIYYLZREBG-NEPJUHHUSA-N 2 0 210.365 2.297 20 0 BEADRP CC[NH+]1CCC(C[N@H+](C)[C@@H]2CCSC2)CC1 ZINC001474401161 987711685 /nfs/dbraw/zinc/71/16/85/987711685.db2.gz HPTPIJMHFDOGHW-CYBMUJFWSA-N 2 0 242.432 2.156 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+]C1CCC(OC(C)C)CC1 ZINC001246313670 987717800 /nfs/dbraw/zinc/71/78/00/987717800.db2.gz KAINRATUSWWEAX-PNESKVBLSA-N 2 0 228.380 2.050 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@H](C)Cc1ccc(C)cc1 ZINC001246315107 987721270 /nfs/dbraw/zinc/72/12/70/987721270.db2.gz HFYGSEBLQLLDDY-OCCSQVGLSA-N 2 0 220.360 2.253 20 0 BEADRP CCC[C@@H]([NH2+]C1CC[NH2+]CC1)c1ccncc1 ZINC001246328134 987735104 /nfs/dbraw/zinc/73/51/04/987735104.db2.gz WSVJGRJZOZPGAS-CQSZACIVSA-N 2 0 233.359 2.264 20 0 BEADRP Cc1cccc2c1CC[C@H]([NH2+]C[C@@H]([NH3+])C(C)C)C2 ZINC001246332891 987738031 /nfs/dbraw/zinc/73/80/31/987738031.db2.gz NWSQISJVHZDECV-GOEBONIOSA-N 2 0 246.398 2.425 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]Cc2cccc3ncoc32)CC[NH2+]1 ZINC001246335580 987746651 /nfs/dbraw/zinc/74/66/51/987746651.db2.gz ZINPZPLZILJXRJ-ZYHUDNBSSA-N 2 0 245.326 2.058 20 0 BEADRP CC[C@@H]1C[C@H](NC(C)(C)CC[NH3+])C[C@H](CC)[NH2+]1 ZINC001246362484 987767836 /nfs/dbraw/zinc/76/78/36/987767836.db2.gz LWPQJQLCRDVLFV-ITGUQSILSA-N 2 0 241.423 2.013 20 0 BEADRP CC[C@H]1CC(NC(C)(C)CC[NH3+])C[C@H](CC)[NH2+]1 ZINC001246362485 987768769 /nfs/dbraw/zinc/76/87/69/987768769.db2.gz LWPQJQLCRDVLFV-RYUDHWBXSA-N 2 0 241.423 2.013 20 0 BEADRP C[C@H]1C[C@H]([NH2+]C(C)(C)Cc2ccccn2)CC[NH2+]1 ZINC001246432849 987799685 /nfs/dbraw/zinc/79/96/85/987799685.db2.gz IDRFBNURGBYYEM-QWHCGFSZSA-N 2 0 247.386 2.133 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C(C)(C)Cc2cccnc2)CC[NH2+]1 ZINC001246444653 987801841 /nfs/dbraw/zinc/80/18/41/987801841.db2.gz AQQFKANOXJMZHH-OCCSQVGLSA-N 2 0 247.386 2.133 20 0 BEADRP Cc1ncccc1[C@@H]([NH2+]C1CC[NH2+]CC1)C1CC1 ZINC001246443167 987802141 /nfs/dbraw/zinc/80/21/41/987802141.db2.gz GHWMLNXICDVKOI-HNNXBMFYSA-N 2 0 245.370 2.183 20 0 BEADRP FC(F)(F)[C@@H]1CCC[C@H]([NH2+][C@H]2CC23C[NH2+]C3)C1 ZINC001246445124 987802965 /nfs/dbraw/zinc/80/29/65/987802965.db2.gz MMLNMXZDVUMQPS-UTLUCORTSA-N 2 0 248.292 2.059 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2C[C@@H]3C[C@H]([C@@H]2C)C3(C)C)C[NH2+]1 ZINC001246443139 987803284 /nfs/dbraw/zinc/80/32/84/987803284.db2.gz LTWSPMIYQPPNNI-GSZZWUTPSA-N 2 0 236.403 2.397 20 0 BEADRP c1ccc([C@@H]2CC[C@@H]([NH2+][C@@H]3CC34C[NH2+]C4)C2)cc1 ZINC001246446353 987804847 /nfs/dbraw/zinc/80/48/47/987804847.db2.gz RLGCVHFCUILFBC-RBSFLKMASA-N 2 0 242.366 2.274 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CC23C[NH2+]C3)CC(C)(C)C1 ZINC001246446375 987805339 /nfs/dbraw/zinc/80/53/39/987805339.db2.gz RVUOZNJFFHKOGN-WOPDTQHZSA-N 2 0 222.376 2.153 20 0 BEADRP C1[C@@H]([NH2+]C2CCCCCCC2)C12C[NH2+]C2 ZINC001246448387 987805649 /nfs/dbraw/zinc/80/56/49/987805649.db2.gz YHHBZAIDYCRUCQ-GFCCVEGCSA-N 2 0 208.349 2.051 20 0 BEADRP CC[C@@H](C)C[C@H](CC)[NH2+]CCCNCCC[NH3+] ZINC001246451887 987809279 /nfs/dbraw/zinc/80/92/79/987809279.db2.gz ICOGFOBAZNFFGY-KGLIPLIRSA-N 2 0 243.439 2.119 20 0 BEADRP CC[NH+]1CCC(C[NH2+]C(C)(C)CSC)CC1 ZINC001474742095 987812889 /nfs/dbraw/zinc/81/28/89/987812889.db2.gz YVNOOEQMCQPSAM-UHFFFAOYSA-N 2 0 244.448 2.450 20 0 BEADRP CCCCC[C@@H](C)[NH2+]CCC[NH2+]CCCC[NH3+] ZINC001246456606 987813429 /nfs/dbraw/zinc/81/34/29/987813429.db2.gz JXABRESOJMTPBC-CQSZACIVSA-N 3 0 243.439 2.263 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]C[C@H]2C[NH+]3CCC2CC3)C1 ZINC001474735452 987813438 /nfs/dbraw/zinc/81/34/38/987813438.db2.gz PHRWVRCLQJLYOZ-SNPRPXQTSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]C[C@@H]2C[NH+]3CCC2CC3)C1 ZINC001474735450 987813550 /nfs/dbraw/zinc/81/35/50/987813550.db2.gz PHRWVRCLQJLYOZ-BPLDGKMQSA-N 2 0 236.403 2.497 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]C[C@H]1C[NH+]2CCC1CC2 ZINC001474735255 987814260 /nfs/dbraw/zinc/81/42/60/987814260.db2.gz MBOYDIIOCOOQEC-XBFCOCLRSA-N 2 0 222.376 2.106 20 0 BEADRP C[C@H]1CCC[C@H]([NH2+]C[C@@]2(C)CCC[NH2+]2)C1 ZINC001246457778 987815268 /nfs/dbraw/zinc/81/52/68/987815268.db2.gz UZIRCVZKLSUEEQ-RWMBFGLXSA-N 2 0 210.365 2.297 20 0 BEADRP C[NH2+][C@H]1C[C@H]([NH2+][C@H]2C[C@H](C)C[C@H](C)C2)C1 ZINC001246459891 987816064 /nfs/dbraw/zinc/81/60/64/987816064.db2.gz HTBLJIUNSHFWBL-FOPUMGAHSA-N 2 0 210.365 2.151 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+][C@H]2C[C@@](C)([NH3+])C2)C[C@H]1C ZINC001246460740 987819472 /nfs/dbraw/zinc/81/94/72/987819472.db2.gz MUCBLPDSXMTJLN-VEGXAWMVSA-N 2 0 210.365 2.281 20 0 BEADRP CCCC[C@@H](C)[NH2+]C[C@@H]1CC[NH2+]C[C@@H]1F ZINC001246478145 987827815 /nfs/dbraw/zinc/82/78/15/987827815.db2.gz SVTZAPGMORWTKC-WOPDTQHZSA-N 2 0 216.344 2.102 20 0 BEADRP CCCCC[C@H](C)[NH2+]C[C@@H]1CC[NH2+]C[C@@H]1F ZINC001246474872 987831062 /nfs/dbraw/zinc/83/10/62/987831062.db2.gz BVMYRJSPGLWMOR-AVGNSLFASA-N 2 0 230.371 2.492 20 0 BEADRP C[C@@H]1CC[C@@H](N[C@@H]2CCc3sccc32)C[NH2+]1 ZINC001246478158 987834111 /nfs/dbraw/zinc/83/41/11/987834111.db2.gz LRROKOXPBVEPJQ-CKYFFXLPSA-N 2 0 236.384 2.466 20 0 BEADRP CC(C)COCC[C@H](C)[NH2+][C@H]1CCCC[C@H]1[NH3+] ZINC001246479224 987837392 /nfs/dbraw/zinc/83/73/92/987837392.db2.gz SKHRFOCPYIGUDC-MJBXVCDLSA-N 2 0 242.407 2.297 20 0 BEADRP CC[C@@H]1CC[C@@H]([NH2+][C@H]2CCCC[C@H]2[NH3+])C1 ZINC001246479893 987838095 /nfs/dbraw/zinc/83/80/95/987838095.db2.gz VSRVHAGHMYWQNG-LPWJVIDDSA-N 2 0 210.365 2.425 20 0 BEADRP CC1(C)CC[C@H]([NH2+][C@H]2CCCC[C@H]2[NH3+])C1 ZINC001246478401 987838338 /nfs/dbraw/zinc/83/83/38/987838338.db2.gz OKZIRUKPWMJONU-TUAOUCFPSA-N 2 0 210.365 2.425 20 0 BEADRP [NH3+]Cc1cc2cccc(F)c2n1C1CC[NH2+]CC1 ZINC001246479117 987838403 /nfs/dbraw/zinc/83/84/03/987838403.db2.gz RQJZFMAQUWDASY-UHFFFAOYSA-N 2 0 247.317 2.164 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@H]1[NH2+][C@H]1CCCC[NH2+]C1 ZINC001246493387 987846638 /nfs/dbraw/zinc/84/66/38/987846638.db2.gz GOVMAEDMWJGYGY-QNWHQSFQSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C23CC([NH3+])(C2)C3)CC(C)(C)C1 ZINC001246506508 987860534 /nfs/dbraw/zinc/86/05/34/987860534.db2.gz WMUPNWIZAFHLDU-IENTYSSBSA-N 2 0 222.376 2.425 20 0 BEADRP CCC[N@@H+]([C@H](C)CC[NH2+]C)[C@@H](C)CC ZINC001246526801 987878441 /nfs/dbraw/zinc/87/84/41/987878441.db2.gz CRIXAFALJCJEMQ-NWDGAFQWSA-N 2 0 200.370 2.495 20 0 BEADRP CSC(C)(C)C[C@H](C)[N@@H+]1CC[C@](C)([NH3+])C1 ZINC001246529492 987887472 /nfs/dbraw/zinc/88/74/72/987887472.db2.gz KNLMRLOLNYUUDW-JQWIXIFHSA-N 2 0 230.421 2.330 20 0 BEADRP CC[C@@H](C)OCC[C@@H](C)[N@@H+]1C[C@H](C)[C@H](C[NH3+])C1 ZINC001246538454 987897273 /nfs/dbraw/zinc/89/72/73/987897273.db2.gz CCUVMRDCXGJJMG-REWJHTLYSA-N 2 0 242.407 2.107 20 0 BEADRP CC[C@@H]1CC[C@H]([N@@H+]2CCC[C@H]([NH3+])CC2)C1 ZINC001246539260 987904840 /nfs/dbraw/zinc/90/48/40/987904840.db2.gz GPBUZHPAQFDDKA-AGIUHOORSA-N 2 0 210.365 2.378 20 0 BEADRP C[C@H]1C[N@@H+]([C@@H]2CCCC(C)(C)C2)C[C@H]1C[NH3+] ZINC001246539307 987905932 /nfs/dbraw/zinc/90/59/32/987905932.db2.gz HMRHMIUOXIVJDM-YNEHKIRRSA-N 2 0 224.392 2.482 20 0 BEADRP CC(C)COCC[C@@H](C)[N@@H+]1CCC[C@H]([NH3+])CC1 ZINC001246541812 987908201 /nfs/dbraw/zinc/90/82/01/987908201.db2.gz NSEKRSUTZPXJSL-KGLIPLIRSA-N 2 0 242.407 2.251 20 0 BEADRP C[C@H]1C[N@@H+](C2C[C@@H](C)C[C@H](C)C2)C[C@H]1C[NH3+] ZINC001246544700 987922733 /nfs/dbraw/zinc/92/27/33/987922733.db2.gz YCTKIPWPYCQRNU-ZDEQEGDKSA-N 2 0 224.392 2.338 20 0 BEADRP Cc1ccc2c(c1)C[N@H+]([C@H]1CC[NH2+][C@H](C)C1)CC2 ZINC001246547682 987925925 /nfs/dbraw/zinc/92/59/25/987925925.db2.gz MCZSYUFUBHUXES-CJNGLKHVSA-N 2 0 244.382 2.494 20 0 BEADRP C[C@H](CC(F)(F)F)[N@@H+]1CCC[C@H]([NH3+])CC1 ZINC001246548206 987939323 /nfs/dbraw/zinc/93/93/23/987939323.db2.gz SUJLEHKQVXJYME-BDAKNGLRSA-N 2 0 224.270 2.141 20 0 BEADRP CC[C@@H]1C[C@H]([N@@H+]2CCC[C@](C)([NH3+])CC2)CCO1 ZINC001246551688 987951354 /nfs/dbraw/zinc/95/13/54/987951354.db2.gz MKFQZNDFZPNPCM-MCIONIFRSA-N 2 0 240.391 2.147 20 0 BEADRP F[C@H]1CCC[N@@H+](C2C[C@H]3CC[C@@H](C2)[NH2+]3)CC1 ZINC001246556776 987966933 /nfs/dbraw/zinc/96/69/33/987966933.db2.gz DBNMLPBEUJHUAW-ACJTYDJDSA-N 2 0 226.339 2.093 20 0 BEADRP CCC[C@@H](CC)[N@@H+]1CCC(F)(F)[C@H](C[NH3+])C1 ZINC001246558286 987972621 /nfs/dbraw/zinc/97/26/21/987972621.db2.gz OWHGLZLENXWSOS-GHMZBOCLSA-N 2 0 234.334 2.481 20 0 BEADRP CCC[C@H](CC)[N@@H+]1CCC(F)(F)[C@H](C[NH3+])C1 ZINC001246558288 987975709 /nfs/dbraw/zinc/97/57/09/987975709.db2.gz OWHGLZLENXWSOS-MNOVXSKESA-N 2 0 234.334 2.481 20 0 BEADRP C[C@H]1CC[N@@H+](C2CCCC2)CC[C@@H]1C[NH3+] ZINC001246558592 987976717 /nfs/dbraw/zinc/97/67/17/987976717.db2.gz MQPYQKBLGQPPRI-NWDGAFQWSA-N 2 0 210.365 2.236 20 0 BEADRP CCC[C@H](CC)[N@@H+]1CCC(F)(F)[C@@H](C[NH3+])C1 ZINC001246558290 987978214 /nfs/dbraw/zinc/97/82/14/987978214.db2.gz OWHGLZLENXWSOS-QWRGUYRKSA-N 2 0 234.334 2.481 20 0 BEADRP CCOCC[C@H](C)[N@@H+]1CCC[C@@H](C[NH3+])[C@H](C)C1 ZINC001246559232 987980950 /nfs/dbraw/zinc/98/09/50/987980950.db2.gz CLPGVGUHFFONKT-RDBSUJKOSA-N 2 0 242.407 2.108 20 0 BEADRP CSCC[C@H](C)[N@@H+]1CCC[C@@H](C[NH3+])[C@@H](C)C1 ZINC001246559539 987981026 /nfs/dbraw/zinc/98/10/26/987981026.db2.gz BFLYFGWCWZSRHI-AVGNSLFASA-N 2 0 244.448 2.435 20 0 BEADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+]Cc2ccc3c(c2)CCC3)C1 ZINC001118015863 987982082 /nfs/dbraw/zinc/98/20/82/987982082.db2.gz NURYQDXRMDAZRT-MLGOLLRUSA-N 2 0 244.382 2.392 20 0 BEADRP CCOCC[C@H](C)[N@@H+]1CCC[C@H](C[NH3+])[C@H](C)C1 ZINC001246559224 987988074 /nfs/dbraw/zinc/98/80/74/987988074.db2.gz CLPGVGUHFFONKT-HZSPNIEDSA-N 2 0 242.407 2.108 20 0 BEADRP CCCC[C@@H](C)[N@@H+]1CCC(F)(F)[C@H](C[NH3+])C1 ZINC001246561634 987992869 /nfs/dbraw/zinc/99/28/69/987992869.db2.gz RLWGXQJROKCINW-GHMZBOCLSA-N 2 0 234.334 2.481 20 0 BEADRP CCC[C@H](C)[N@@H+]1CC[C@H](C)[C@@H](C[NH3+])CC1 ZINC001246561920 987995579 /nfs/dbraw/zinc/99/55/79/987995579.db2.gz USPCKZLEKUXPRL-RWMBFGLXSA-N 2 0 212.381 2.482 20 0 BEADRP CCSC[C@H](C)[N@@H+]1CCC[C@H](C[NH3+])[C@@H](C)C1 ZINC001246563597 988003906 /nfs/dbraw/zinc/00/39/06/988003906.db2.gz RZQZVGUMTJUMJC-RWMBFGLXSA-N 2 0 244.448 2.435 20 0 BEADRP C[C@H](CC1CC1)[N@@H+]1CC[C@@H](C)[C@H](C[NH3+])CC1 ZINC001246563694 988004175 /nfs/dbraw/zinc/00/41/75/988004175.db2.gz XNYZMGKPMNROIE-BZPMIXESSA-N 2 0 224.392 2.482 20 0 BEADRP C[C@@H]1C[C@@H]([N@@H+]2CCC(F)(F)[C@H](C)C2)CC[NH2+]1 ZINC001246562941 988008939 /nfs/dbraw/zinc/00/89/39/988008939.db2.gz IKNHWNOWWILWQV-MXWKQRLJSA-N 2 0 232.318 2.104 20 0 BEADRP CS[C@@H]1CC[C@@H]([NH2+]C2CCC(C[NH3+])CC2)C1 ZINC001118118878 988019876 /nfs/dbraw/zinc/01/98/76/988019876.db2.gz KLIHEUQBRCOTFP-FIYWTHMPSA-N 2 0 242.432 2.378 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@H]1CCc2ccc(F)cc21 ZINC001118122125 988027337 /nfs/dbraw/zinc/02/73/37/988027337.db2.gz PQAQXZFPLGTPAR-HZMBPMFUSA-N 2 0 236.334 2.401 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2CCC[C@H](C[NH3+])[C@H](C)C2)C1 ZINC001246567932 988034199 /nfs/dbraw/zinc/03/41/99/988034199.db2.gz NELLSDZIAPVAML-SYQHCUMBSA-N 2 0 224.392 2.482 20 0 BEADRP C[C@@H]1CCN([C@@H]2CCC[NH2+]C2)CCC1(F)F ZINC001246569677 988048890 /nfs/dbraw/zinc/04/88/90/988048890.db2.gz RSFOLKJBXAYPHK-GHMZBOCLSA-N 2 0 232.318 2.106 20 0 BEADRP C[C@@H]1C[C@@H]([N@@H+]2CCC[C@](C)(F)CC2)CC[NH2+]1 ZINC001246573129 988058704 /nfs/dbraw/zinc/05/87/04/988058704.db2.gz YUBYOFQTQWTFPD-AGIUHOORSA-N 2 0 228.355 2.341 20 0 BEADRP CCOCC[C@H](C)[N@@H+]1CCC[C@](C)(C[NH3+])CC1 ZINC001246571258 988063527 /nfs/dbraw/zinc/06/35/27/988063527.db2.gz AREYRNVZLFEHKS-KBPBESRZSA-N 2 0 242.407 2.252 20 0 BEADRP C[NH2+]Cc1ccc2c(ccn2[C@@H]2CCC[NH2+]C2)c1 ZINC001246572468 988065255 /nfs/dbraw/zinc/06/52/55/988065255.db2.gz HCWJRPDXHKBUOY-CQSZACIVSA-N 2 0 243.354 2.285 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2CCC[C@](C)(C[NH3+])CC2)CCO1 ZINC001246576613 988085125 /nfs/dbraw/zinc/08/51/25/988085125.db2.gz LTSHHWBNKMLITL-MCIONIFRSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@H]1C[C@H]([N@@H+]2CCC[C@@](C)(C[NH3+])CC2)CCO1 ZINC001246579845 988105247 /nfs/dbraw/zinc/10/52/47/988105247.db2.gz LTSHHWBNKMLITL-BFHYXJOUSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@@]1(C[NH3+])CCCC[N@@H+](C2CCCC2)C1 ZINC001246584356 988123166 /nfs/dbraw/zinc/12/31/66/988123166.db2.gz LSJXYXLYZJMCSO-ZDUSSCGKSA-N 2 0 210.365 2.380 20 0 BEADRP C[C@]1(C[NH3+])CCCC[N@@H+]([C@H]2C[C@H]3C[C@H]3C2)C1 ZINC001246585015 988130966 /nfs/dbraw/zinc/13/09/66/988130966.db2.gz NRZXXXUJXNWLTQ-ZOBORPQBSA-N 2 0 222.376 2.236 20 0 BEADRP C[C@@H]1CC[C@@H]([NH+]2CC(C)(C[NH3+])C2)C[C@@H]1C ZINC001246586491 988142756 /nfs/dbraw/zinc/14/27/56/988142756.db2.gz BFKBSLADLIXBPI-GRYCIOLGSA-N 2 0 210.365 2.092 20 0 BEADRP CC[C@H](Cc1ccccc1)[NH+]1CC(C)(C[NH3+])C1 ZINC001246597632 988199603 /nfs/dbraw/zinc/19/96/03/988199603.db2.gz MBOCECPFCHWFJA-CQSZACIVSA-N 2 0 232.371 2.288 20 0 BEADRP CCCCC[C@H](CC)[NH+]1CC(C[NH2+]C)C1 ZINC001246597071 988199673 /nfs/dbraw/zinc/19/96/73/988199673.db2.gz LRFGBXSQGRQHKX-ZDUSSCGKSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2CCC[C@@]23CCC[NH2+]C3)C1 ZINC001246608773 988229202 /nfs/dbraw/zinc/22/92/02/988229202.db2.gz JQSFOCFCROBADP-HZSPNIEDSA-N 2 0 222.376 2.393 20 0 BEADRP C[C@H](CC1CC1)[N@@H+]1CCC[C@@]12CCC[NH2+]C2 ZINC001246613398 988241006 /nfs/dbraw/zinc/24/10/06/988241006.db2.gz YWYDPKQYAJYZID-TZMCWYRMSA-N 2 0 222.376 2.393 20 0 BEADRP CCC[C@@H](CC)[NH+]1CCC(F)(C[NH3+])CC1 ZINC001246624818 988280046 /nfs/dbraw/zinc/28/00/46/988280046.db2.gz FRBCVYVPYAJKHJ-LLVKDONJSA-N 2 0 216.344 2.328 20 0 BEADRP CCCCC[C@@H](CC)[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC001246628083 988291071 /nfs/dbraw/zinc/29/10/71/988291071.db2.gz WVPQFPZHIMULPB-HZSPNIEDSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CCC[C@@H]([N@@H+]2CC[C@@H]3[NH2+]CC[C@H]32)C1 ZINC001246629652 988304620 /nfs/dbraw/zinc/30/46/20/988304620.db2.gz FQPZPGIEUVFHPP-FVCCEPFGSA-N 2 0 208.349 2.001 20 0 BEADRP CC1CCC([NH+]2CCC(F)(C[NH3+])CC2)CC1 ZINC001246629956 988311369 /nfs/dbraw/zinc/31/13/69/988311369.db2.gz RBSHEXACSIPXBH-UHFFFAOYSA-N 2 0 228.355 2.328 20 0 BEADRP CC(C)CC[C@H](C)[N@@H+]1CC[C@H]2C[NH2+]CC[C@H]21 ZINC001246629672 988311633 /nfs/dbraw/zinc/31/16/33/988311633.db2.gz ZFUOFMZDLTUJEP-MELADBBJSA-N 2 0 224.392 2.495 20 0 BEADRP CC[C@@H](CC(C)C)[N@@H+]1CC[C@@]2(CC[NH2+]C2)C1 ZINC001246631784 988318498 /nfs/dbraw/zinc/31/84/98/988318498.db2.gz SIOPDWHSQXIUHE-UONOGXRCSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)CC[C@@H](C)N1CC[C@H]2[NH2+]CC[C@H]21 ZINC001246636196 988327884 /nfs/dbraw/zinc/32/78/84/988327884.db2.gz FORKKPOBYIFSCZ-JHJVBQTASA-N 2 0 210.365 2.247 20 0 BEADRP CC1(C)CCC[C@H]([N@@H+]2CC[C@H]3[NH2+]CC[C@H]32)C1 ZINC001246636374 988328725 /nfs/dbraw/zinc/32/87/25/988328725.db2.gz GLOOVYGWHCNHOJ-YNEHKIRRSA-N 2 0 222.376 2.391 20 0 BEADRP CC[C@@H](C)C[C@@H](CC)[N@@H+]1CC[C@H]2C[NH2+]C[C@H]21 ZINC001246643814 988358776 /nfs/dbraw/zinc/35/87/76/988358776.db2.gz DJBDXGRZCKIJRS-XJFOESAGSA-N 2 0 224.392 2.495 20 0 BEADRP CC(C)CC[C@@H](C)[N@@H+]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC001246649488 988373544 /nfs/dbraw/zinc/37/35/44/988373544.db2.gz ZWPXSKYPFDUOFG-MCIONIFRSA-N 2 0 224.392 2.352 20 0 BEADRP CC[C@@H](CC(C)C)[N@@H+]1C[C@H]2CCC[NH2+][C@H]2C1 ZINC001246657338 988384779 /nfs/dbraw/zinc/38/47/79/988384779.db2.gz LYAPPIBBZBABMU-RDBSUJKOSA-N 2 0 224.392 2.495 20 0 BEADRP CCC[C@H](C)CC[C@H](C)[N@H+]1C[C@@H]2[C@@H]([NH3+])[C@@H]2C1 ZINC001246660593 988392625 /nfs/dbraw/zinc/39/26/25/988392625.db2.gz VOMDTPRPHJXJAN-QSLWVIQJSA-N 2 0 224.392 2.480 20 0 BEADRP C[C@@H]1C[C@H]([N@H+]2C[C@@H]3[C@H]([NH3+])[C@@H]3C2)CC(C)(C)C1 ZINC001246659787 988394237 /nfs/dbraw/zinc/39/42/37/988394237.db2.gz HENGGZJFUBQPRD-RXGFPQBGSA-N 2 0 222.376 2.090 20 0 BEADRP C[C@@H]1CC([N@@H+]2CC[C@@H]3C[NH2+]C[C@@H]3C2)C[C@@H](C)C1 ZINC001246666414 988405599 /nfs/dbraw/zinc/40/55/99/988405599.db2.gz JKXBESTWCJFNSE-IGQOVBAYSA-N 2 0 236.403 2.352 20 0 BEADRP C[C@@H]1CC[C@@H]([N@@H+]2CC[C@@H]3C[NH2+]C[C@@H]3C2)C[C@@H]1C ZINC001246667445 988409412 /nfs/dbraw/zinc/40/94/12/988409412.db2.gz KROHLJIPCZFNHG-XLWJZTARSA-N 2 0 236.403 2.352 20 0 BEADRP CC1(C)CCC[C@@H]([N@@H+]2CC[C@@H]3C[NH2+]C[C@@H]3C2)C1 ZINC001246668898 988411534 /nfs/dbraw/zinc/41/15/34/988411534.db2.gz PRUXAGQRCJKFBR-MGPQQGTHSA-N 2 0 236.403 2.497 20 0 BEADRP CCCCC[C@@H](C)[N@@H+]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC001246668239 988411680 /nfs/dbraw/zinc/41/16/80/988411680.db2.gz MQOOBFZIGQGXCY-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP CCc1ccc(C[C@H](C)[N@H+](C)CCC[NH3+])cc1 ZINC001246681805 988432017 /nfs/dbraw/zinc/43/20/17/988432017.db2.gz QSLLRKVCQKFKDA-ZDUSSCGKSA-N 2 0 234.387 2.461 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2CCC[C@@H]2c2ccccn2)CC[NH2+]1 ZINC001246786831 988470703 /nfs/dbraw/zinc/47/07/03/988470703.db2.gz AIIFANYEGHNOCQ-UMVBOHGHSA-N 2 0 245.370 2.359 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@H]2[C@@H](C1)C2(F)F)[C@@H]1CCC[NH2+]1 ZINC001118607850 988477803 /nfs/dbraw/zinc/47/78/03/988477803.db2.gz FROQHWGOKSNIEY-MJDLHHQISA-N 2 0 244.329 2.150 20 0 BEADRP CCCCC[C@H](C)[N@@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1 ZINC001246845908 988547606 /nfs/dbraw/zinc/54/76/06/988547606.db2.gz NERUPRRCAVXVSR-MELADBBJSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@H]1CCC[N@@H+]([C@H]2CC[NH2+][C@H](C)C2)C1 ZINC001246851169 988570978 /nfs/dbraw/zinc/57/09/78/988570978.db2.gz YSHLPAJQSFDQCS-AGIUHOORSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@H]1C[C@H]([N@@H+]2C[C@@H]3CC[C@]3([NH3+])C2)C[C@@H](C)C1 ZINC001246852230 988573066 /nfs/dbraw/zinc/57/30/66/988573066.db2.gz ICDFBZXQVJUZAV-VJTDZRGJSA-N 2 0 222.376 2.234 20 0 BEADRP COc1ccc([C@H](C)[N@H+](C)C2CC[NH2+]CC2)cc1 ZINC001246853018 988574902 /nfs/dbraw/zinc/57/49/02/988574902.db2.gz QJYIVPBYMZLEPC-LBPRGKRZSA-N 2 0 248.370 2.440 20 0 BEADRP CC[C@H](CC(C)C)[N@@H+]1CC[C@@H](C[NH2+]C)C1 ZINC001246866135 988620887 /nfs/dbraw/zinc/62/08/87/988620887.db2.gz ZXTQXFAZDOEERL-QWHCGFSZSA-N 2 0 212.381 2.352 20 0 BEADRP C[NH2+]CC[C@@H](C)[N@@H+]1Cc2ccccc2C[C@H]1C ZINC001246874044 988634377 /nfs/dbraw/zinc/63/43/77/988634377.db2.gz UVBNDJVPWHJJTD-CHWSQXEVSA-N 2 0 232.371 2.431 20 0 BEADRP C[C@@H]1C[N@H+](C2C[C@H]3CC[C@@H](C2)[NH2+]3)C2(CC2)C1 ZINC001246897929 988671380 /nfs/dbraw/zinc/67/13/80/988671380.db2.gz WOCNTFMVVPZHRR-ACJTYDJDSA-N 2 0 220.360 2.144 20 0 BEADRP C[NH2+]CC[C@@H](C)[N@@H+]1CC[C@H]2CCCC[C@@H]2C1 ZINC001246917903 988718770 /nfs/dbraw/zinc/71/87/70/988718770.db2.gz BUBMBTSLYOJWRO-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@H]1CC[C@H]([N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)C1 ZINC001246941957 988774324 /nfs/dbraw/zinc/77/43/24/988774324.db2.gz MVMVGWALVRBVLB-XQLPTFJDSA-N 2 0 236.403 2.497 20 0 BEADRP C(=C\C1CC1)\C[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC001324300423 988788163 /nfs/dbraw/zinc/78/81/63/988788163.db2.gz VNEVRXWTGVCMND-UPHRSURJSA-N 2 0 234.387 2.417 20 0 BEADRP Cc1ccc2c(c1)CC[N@@H+]([C@H]1CC[NH2+][C@@H](C)C1)C2 ZINC001246964130 988791350 /nfs/dbraw/zinc/79/13/50/988791350.db2.gz BQPNCDANRVMFON-BBRMVZONSA-N 2 0 244.382 2.494 20 0 BEADRP Cc1ccc2c(c1)CC[N@@H+]([C@@H]1CC[NH2+][C@@H](C)C1)C2 ZINC001246964135 988796406 /nfs/dbraw/zinc/79/64/06/988796406.db2.gz BQPNCDANRVMFON-XJKSGUPXSA-N 2 0 244.382 2.494 20 0 BEADRP CO[C@@H]1C[N@@H+]([C@H](C)C[C@H](C)CC(C)C)C[C@@H]1N ZINC001246983890 988815229 /nfs/dbraw/zinc/81/52/29/988815229.db2.gz VTJDXDOLENTBCH-YIYPIFLZSA-N 2 0 242.407 2.105 20 0 BEADRP CC1(C)[C@@H]2C[C@@H](N3CC[C@H]4[NH2+]CCC[C@H]4C3)C[C@@H]21 ZINC001247016731 988842769 /nfs/dbraw/zinc/84/27/69/988842769.db2.gz XNSNGCQBUWHFIX-BTFPBAQTSA-N 2 0 248.414 2.495 20 0 BEADRP C[C@@H]1CC[C@H](N2CC[C@@H]3[NH2+]CCC[C@H]3C2)C1 ZINC001247016396 988844420 /nfs/dbraw/zinc/84/44/20/988844420.db2.gz USGLBMIEVVDJPB-RFGFWPKPSA-N 2 0 222.376 2.249 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C/C=C/C2CC2)[C@@H]2CCC[C@H]21 ZINC001324969395 989036597 /nfs/dbraw/zinc/03/65/97/989036597.db2.gz RAXSORIWVBRDJR-PGQSHUBFSA-N 2 0 234.387 2.415 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C/C=C\C2CC2)[C@@H]2CCC[C@H]21 ZINC001324969392 989037621 /nfs/dbraw/zinc/03/76/21/989037621.db2.gz RAXSORIWVBRDJR-GKAAIYSZSA-N 2 0 234.387 2.415 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]C1CCC(CSC)CC1 ZINC001325720706 989237569 /nfs/dbraw/zinc/23/75/69/989237569.db2.gz GIFYKQDVLRNWBX-HIFPTAJRSA-N 2 0 244.448 2.496 20 0 BEADRP C[C@@H]([NH2+]CCCCOc1ccccc1)C1C[NH2+]C1 ZINC001325717020 989238345 /nfs/dbraw/zinc/23/83/45/989238345.db2.gz KOUJASODQUQRJS-CYBMUJFWSA-N 2 0 248.370 2.043 20 0 BEADRP C[C@H]([NH2+]CCCCOc1ccccc1)C1C[NH2+]C1 ZINC001325717021 989239559 /nfs/dbraw/zinc/23/95/59/989239559.db2.gz KOUJASODQUQRJS-ZDUSSCGKSA-N 2 0 248.370 2.043 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H](C)CSC(C)(C)C ZINC001325743288 989247575 /nfs/dbraw/zinc/24/75/75/989247575.db2.gz LBMNBQSDHQHNJB-GHMZBOCLSA-N 2 0 232.437 2.352 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H](C)Cc1cccs1 ZINC001325744242 989249942 /nfs/dbraw/zinc/24/99/42/989249942.db2.gz RYMXUIPUDQDAFY-MNOVXSKESA-N 2 0 226.389 2.267 20 0 BEADRP Cc1cc(N2CC[NH+](C(C)(C)C)CC2)cc[nH+]1 ZINC001325776859 989260097 /nfs/dbraw/zinc/26/00/97/989260097.db2.gz QKJTWWKPUDALAL-UHFFFAOYSA-N 2 0 233.359 2.311 20 0 BEADRP C[C@H]([NH2+]CCCC[NH3+])c1ccnc(Cl)c1 ZINC001326035957 989325507 /nfs/dbraw/zinc/32/55/07/989325507.db2.gz MWKZZIVYOVSSIM-VIFPVBQESA-N 2 0 227.739 2.125 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H]1CC[C@@H](C)C[C@@H]1C ZINC001326040435 989343112 /nfs/dbraw/zinc/34/31/12/989343112.db2.gz XXINOSBHBUILEK-YVECIDJPSA-N 2 0 212.381 2.399 20 0 BEADRP C[NH+]1CCC(C[NH2+]Cc2cccn2C2CC2)CC1 ZINC001326429485 989553658 /nfs/dbraw/zinc/55/36/58/989553658.db2.gz FVCUGXUTAMSJQA-UHFFFAOYSA-N 2 0 247.386 2.254 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]C1[C@H](C)CCC[C@H]1C ZINC001326472531 989571615 /nfs/dbraw/zinc/57/16/15/989571615.db2.gz AJYDABSZHPZNDT-IJLUTSLNSA-N 2 0 212.381 2.399 20 0 BEADRP CCc1cc(N2CCC[N@@H+]3CCC[C@H]3C2)cc[nH+]1 ZINC001326492222 989585174 /nfs/dbraw/zinc/58/51/74/989585174.db2.gz NVOXXDKOGDTOHY-HNNXBMFYSA-N 2 0 245.370 2.319 20 0 BEADRP F[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)C1 ZINC001326581439 989617331 /nfs/dbraw/zinc/61/73/31/989617331.db2.gz AJVTWERYPGUPPN-MQLXINIDSA-N 2 0 240.366 2.245 20 0 BEADRP CC[N@H+](CCC[NH2+]C[C@@H](C)O)C1CCCCC1 ZINC001120590115 989762516 /nfs/dbraw/zinc/76/25/16/989762516.db2.gz WJEAQGSOCXZYER-CYBMUJFWSA-N 2 0 242.407 2.002 20 0 BEADRP C[N@@H+]1CCCC[C@H]1CNc1cc[nH+]cc1C1CC1 ZINC001120884893 989948316 /nfs/dbraw/zinc/94/83/16/989948316.db2.gz RZIMCDOIFMUIJW-ZDUSSCGKSA-N 2 0 245.370 2.277 20 0 BEADRP CC(C)=CCC[C@@H](C)[NH2+]CCC[N@H+](C)CCO ZINC001258086754 990996167 /nfs/dbraw/zinc/99/61/67/990996167.db2.gz DCVSBAQWBTXQLX-CQSZACIVSA-N 2 0 242.407 2.025 20 0 BEADRP Cc1cc(CNCC[C@@H](C)[NH+](C)C)cc(C)n1 ZINC001308480026 991004859 /nfs/dbraw/zinc/00/48/59/991004859.db2.gz YNTBUQCUNSWASF-CYBMUJFWSA-N 2 0 235.375 2.128 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+]CCC(F)F)CC1(C)C ZINC001308550667 991032411 /nfs/dbraw/zinc/03/24/11/991032411.db2.gz SMBSBCJHIAEMSV-SECBINFHSA-N 2 0 220.307 2.104 20 0 BEADRP C[C@@H](Cc1ccco1)[N@@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC001258194864 991106451 /nfs/dbraw/zinc/10/64/51/991106451.db2.gz LRTNSWINLFIYFC-ZFWWWQNUSA-N 2 0 248.370 2.238 20 0 BEADRP CCN1CCC[C@@H]([NH2+]CC[C@]2(C)CC2(F)F)C1 ZINC001308868415 991188179 /nfs/dbraw/zinc/18/81/79/991188179.db2.gz ODRVOEFQBQZDKX-VXGBXAGGSA-N 2 0 246.345 2.496 20 0 BEADRP CCN1CCC[C@H]([NH2+]CC[C@@]2(C)CC2(F)F)C1 ZINC001308868414 991190808 /nfs/dbraw/zinc/19/08/08/991190808.db2.gz ODRVOEFQBQZDKX-RYUDHWBXSA-N 2 0 246.345 2.496 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[N@H+](C)C[C@H]12)[C@@H]1C[C@H]1C1CC1 ZINC001308985545 991249917 /nfs/dbraw/zinc/24/99/17/991249917.db2.gz XPHWJMXSDNKKLN-OVCQRUGDSA-N 2 0 248.414 2.351 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[N@H+](C)C[C@H]21)[C@@H]1C[C@H]1C1CC1 ZINC001308985546 991250723 /nfs/dbraw/zinc/25/07/23/991250723.db2.gz XPHWJMXSDNKKLN-YHDIRRJESA-N 2 0 248.414 2.351 20 0 BEADRP CSC(C)(C)C[C@@H](C)[NH2+]C[C@@H](C)C[NH3+] ZINC001258333935 991260264 /nfs/dbraw/zinc/26/02/64/991260264.db2.gz QISIDTPLZGASIB-VHSXEESVSA-N 2 0 218.410 2.091 20 0 BEADRP CSC(C)(C)C[C@@H](C)[NH2+]C[C@H](C)C[NH3+] ZINC001258333924 991261962 /nfs/dbraw/zinc/26/19/62/991261962.db2.gz QISIDTPLZGASIB-NXEZZACHSA-N 2 0 218.410 2.091 20 0 BEADRP C[C@@H](CC1CC1)[NH+]1CCC([NH+](C)C)CC1 ZINC001258457979 991415871 /nfs/dbraw/zinc/41/58/71/991415871.db2.gz NGKGQFMJBFFPCR-NSHDSACASA-N 2 0 210.365 2.201 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)[C@@H](C)CC1CC1 ZINC001258470112 991437765 /nfs/dbraw/zinc/43/77/65/991437765.db2.gz LKFRLBITMXTKDB-LBPRGKRZSA-N 2 0 212.381 2.449 20 0 BEADRP C1[C@H]2CCC[C@H]([NH2+][C@@H]3CC[N@@H+]4CCC[C@H]4C3)[C@@H]12 ZINC001560500812 991486143 /nfs/dbraw/zinc/48/61/43/991486143.db2.gz DNFJOCUWIWKGKC-MRLBHPIUSA-N 2 0 234.387 2.391 20 0 BEADRP C[C@H](Cc1cccnc1)[NH2+][C@H]1CCC[N@H+](C)CC1 ZINC001258613198 991536782 /nfs/dbraw/zinc/53/67/82/991536782.db2.gz LFBKMGKZFBDRFR-HIFRSBDPSA-N 2 0 247.386 2.087 20 0 BEADRP CCC[N@H+](CCC[NH3+])[C@@H](C)Cc1cccnc1 ZINC001258613671 991540908 /nfs/dbraw/zinc/54/09/08/991540908.db2.gz VWDUMXITXPBLRA-ZDUSSCGKSA-N 2 0 235.375 2.073 20 0 BEADRP CCCCC[C@H](CCC)[N@@H+]1CCO[C@H](C[NH3+])C1 ZINC001258661481 991599221 /nfs/dbraw/zinc/59/92/21/991599221.db2.gz GFSMVEDUALUGSB-UONOGXRCSA-N 2 0 242.407 2.395 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)C[C@]1(C)CCCCO1 ZINC001560811589 991610617 /nfs/dbraw/zinc/61/06/17/991610617.db2.gz QFLRBUZCAJCLIO-AWEZNQCLSA-N 2 0 242.407 2.219 20 0 BEADRP C[C@@H]1C[C@H](NC(=[NH2+])SCC[NH3+])CC(C)(C)C1 ZINC001258687125 991622757 /nfs/dbraw/zinc/62/27/57/991622757.db2.gz MRFAMBNUZQSWJL-ZJUUUORDSA-N 2 0 243.420 2.417 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[C@H]2C[N@H+](C)C[C@H]21)C1CCC1 ZINC001561053643 991709858 /nfs/dbraw/zinc/70/98/58/991709858.db2.gz XZYWYUREPOJRHZ-LJISPDSOSA-N 2 0 236.403 2.495 20 0 BEADRP CC[C@@H](C)C[C@H](CC)NC(=[NH2+])SCC[NH3+] ZINC001258780579 991749462 /nfs/dbraw/zinc/74/94/62/991749462.db2.gz PIIKMBUUPZHGSC-ZJUUUORDSA-N 2 0 231.409 2.417 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+][C@H]2CCC[C@H]([NH3+])C2)C1 ZINC001258813179 991821698 /nfs/dbraw/zinc/82/16/98/991821698.db2.gz BWEDVWQSUBGHHW-XQHKEYJVSA-N 2 0 210.365 2.425 20 0 BEADRP CC[NH+]1C[C@@H]2C[NH+]([C@@H]3CCC[C@@H](C)C3)C[C@H]2C1 ZINC001258830994 991862710 /nfs/dbraw/zinc/86/27/10/991862710.db2.gz XGLJTDHKOBUZRD-KBUPBQIOSA-N 2 0 236.403 2.449 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCO[C@H](C)C1 ZINC001258907563 991890375 /nfs/dbraw/zinc/89/03/75/991890375.db2.gz KMVMPSHGQDNYJK-ZIAGYGMSSA-N 2 0 242.407 2.218 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)n1nccc1C[NH3+] ZINC001258897464 991890689 /nfs/dbraw/zinc/89/06/89/991890689.db2.gz KDYKGJHWAKPBBS-LBPRGKRZSA-N 2 0 238.379 2.025 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1ncco1 ZINC001258897659 991892947 /nfs/dbraw/zinc/89/29/47/991892947.db2.gz NARHLQRAPFUCOS-LBPRGKRZSA-N 2 0 239.363 2.275 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]CC1CC(=O)C1 ZINC001258899250 991895460 /nfs/dbraw/zinc/89/54/60/991895460.db2.gz IUDXWKCYJKVYBL-GFCCVEGCSA-N 2 0 240.391 2.066 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1C[C@@H]2C[C@@H]2C1 ZINC001258909634 991897940 /nfs/dbraw/zinc/89/79/40/991897940.db2.gz HEHDZTGUXXBUNX-MCIONIFRSA-N 2 0 224.392 2.449 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[N@H+](C)CC(C)=O ZINC001258908606 991898360 /nfs/dbraw/zinc/89/83/60/991898360.db2.gz YRVXIXMXKWSFBR-GFCCVEGCSA-N 2 0 228.380 2.018 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC(=O)CC1 ZINC001258908467 991900921 /nfs/dbraw/zinc/90/09/21/991900921.db2.gz VYPAFXQMNFMSSP-CYBMUJFWSA-N 2 0 240.391 2.162 20 0 BEADRP C[N@H+]1CC=C(C[NH2+]Cc2cccn2C2CC2)CC1 ZINC001261255462 992225332 /nfs/dbraw/zinc/22/53/32/992225332.db2.gz YZAYKLWVSPJBIY-UHFFFAOYSA-N 2 0 245.370 2.175 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]C/C=C\c1ccccc1 ZINC001261370259 992275880 /nfs/dbraw/zinc/27/58/80/992275880.db2.gz CWONDIGYJZRLHL-OYVUYXNMSA-N 2 0 218.344 2.287 20 0 BEADRP C[C@H](CSC(C)(C)C)[NH2+]CCCC[NH3+] ZINC001261423996 992292496 /nfs/dbraw/zinc/29/24/96/992292496.db2.gz KNYFAKIVUPIHRE-SNVBAGLBSA-N 2 0 218.410 2.235 20 0 BEADRP Cc1csc(CCC[NH2+][C@@H](C)C[C@@H](C)[NH3+])n1 ZINC001261423318 992295575 /nfs/dbraw/zinc/29/55/75/992295575.db2.gz SXLDABMBUHXRGU-ZJUUUORDSA-N 2 0 241.404 2.100 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]CCCOCc1ccccc1 ZINC001261423437 992296297 /nfs/dbraw/zinc/29/62/97/992296297.db2.gz WFVPEWXVPGLZTO-CABCVRRESA-N 2 0 248.370 2.063 20 0 BEADRP CC1=CCC[C@H](C)[C@H]1C[NH2+][C@]1(C)CC[NH2+]C1 ZINC001573624541 992654217 /nfs/dbraw/zinc/65/42/17/992654217.db2.gz DFANJODFGQYOCM-MELADBBJSA-N 2 0 222.376 2.320 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CCCC(F)F)[C@H](C)C1 ZINC001262160374 992722046 /nfs/dbraw/zinc/72/20/46/992722046.db2.gz CMQJDTGLAYGOSD-MNOVXSKESA-N 2 0 234.334 2.352 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+]C[C@H]1CCc2ccccc21 ZINC001262202570 992800214 /nfs/dbraw/zinc/80/02/14/992800214.db2.gz XACZCVSTOJTYLF-UKRRQHHQSA-N 2 0 244.382 2.447 20 0 BEADRP [NH3+][C@@H]1C[C@@H]1C1CC[NH+](CC2CCCC2)CC1 ZINC001574269517 992835469 /nfs/dbraw/zinc/83/54/69/992835469.db2.gz ZVKAFHBNHCIDKH-ZIAGYGMSSA-N 2 0 222.376 2.236 20 0 BEADRP C[N@H+]1CC=C(C[NH2+]CCc2ccc(F)cc2)CC1 ZINC001262364561 992861320 /nfs/dbraw/zinc/86/13/20/992861320.db2.gz ASQIRLQGPWPQDD-UHFFFAOYSA-N 2 0 248.345 2.220 20 0 BEADRP C([N@H+](C1CC1)C1CCCCC1)[C@@]12C[C@@H]1C[NH2+]C2 ZINC001574794554 992907583 /nfs/dbraw/zinc/90/75/83/992907583.db2.gz DVFRDXKQKDIXOK-DOMZBBRYSA-N 2 0 234.387 2.393 20 0 BEADRP C([NH2+][C@H]1C[C@@H]2CCC[C@@H]21)[C@H]1CCCCC[NH2+]1 ZINC001574801583 992912786 /nfs/dbraw/zinc/91/27/86/992912786.db2.gz RWULSPXAYGAETO-CRWXNKLISA-N 2 0 222.376 2.297 20 0 BEADRP C([NH2+][C@@H]1C[C@@H]2CCC[C@H]12)[C@H]1CCCCC[NH2+]1 ZINC001574801584 992912984 /nfs/dbraw/zinc/91/29/84/992912984.db2.gz RWULSPXAYGAETO-RFQIPJPRSA-N 2 0 222.376 2.297 20 0 BEADRP C([NH2+][C@@H]1C[C@@H]2CC[C@@H](C2)C1)[C@@H]1CCC[NH2+]C1 ZINC001574799943 992913008 /nfs/dbraw/zinc/91/30/08/992913008.db2.gz FZSGPRZIPBOJIV-XJFOESAGSA-N 2 0 222.376 2.154 20 0 BEADRP C([NH2+][C@H]1C[C@@H]2CCC[C@@H]21)[C@@H]1CCC[NH2+]CC1 ZINC001574801029 992913822 /nfs/dbraw/zinc/91/38/22/992913822.db2.gz MOUOKBUJCPVYIM-RFGFWPKPSA-N 2 0 222.376 2.154 20 0 BEADRP C=C/C=C/CC[NH2+][C@@H]1CC[NH2+]CC[C@H]1C ZINC001574887725 992935888 /nfs/dbraw/zinc/93/58/88/992935888.db2.gz ASRBXLRMFFLLAJ-IJWDBEHRSA-N 2 0 208.349 2.096 20 0 BEADRP C/C(=C/c1ccccc1)CNCC12CC(C1)C[NH2+]2 ZINC001574981091 992960354 /nfs/dbraw/zinc/96/03/54/992960354.db2.gz ZRYSPIVZTCPGEP-QPEQYQDCSA-N 2 0 242.366 2.432 20 0 BEADRP CC(C)(C)C1CC([NH2+]C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC001575118279 992990439 /nfs/dbraw/zinc/99/04/39/992990439.db2.gz COGNHDWRPITQLS-CIWCUSHGSA-N 2 0 210.365 2.138 20 0 BEADRP CC(C)(C[NH3+])C[NH2+]CC1(CC2CC2)CC1 ZINC001575315103 993002861 /nfs/dbraw/zinc/00/28/61/993002861.db2.gz IAHHLGGIUCFATG-UHFFFAOYSA-N 2 0 210.365 2.141 20 0 BEADRP CC(C)(C[NH3+])C[NH+]1CC(C2CCCCC2)C1 ZINC001575314850 993011073 /nfs/dbraw/zinc/01/10/73/993011073.db2.gz AFLIEACPRMZWIV-UHFFFAOYSA-N 2 0 224.392 2.483 20 0 BEADRP CC(C)(C[NH2+][C@@H]1C[C@H]([NH3+])C1(C)C)C1CC1 ZINC001575334960 993014004 /nfs/dbraw/zinc/01/40/04/993014004.db2.gz WLJALPAQBGFRQQ-WDEREUQCSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H](C[NH+]1C[C@H](C)C[C@@H](C)C1)Nc1cc[nH+]cc1 ZINC001262671528 993014369 /nfs/dbraw/zinc/01/43/69/993014369.db2.gz IYBIUDJHOOKODO-MCIONIFRSA-N 2 0 247.386 2.282 20 0 BEADRP CC(C)[NH+]1CCC(CCNc2cc[nH+]cc2)CC1 ZINC001262673586 993016305 /nfs/dbraw/zinc/01/63/05/993016305.db2.gz UQZXJLQVXXZCHH-UHFFFAOYSA-N 2 0 247.386 2.426 20 0 BEADRP Cc1cc(F)cc(N[C@H](C)CC[NH+](C)C)n1 ZINC001262680440 993022225 /nfs/dbraw/zinc/02/22/25/993022225.db2.gz CSHBKPIKWAZNGL-SECBINFHSA-N 2 0 225.311 2.281 20 0 BEADRP CC(C)C[NH+]1CCC([C@H]2[NH2+]CC23CCC3)CC1 ZINC001575596060 993078387 /nfs/dbraw/zinc/07/83/87/993078387.db2.gz WELWAMQTTQIKQI-CQSZACIVSA-N 2 0 236.403 2.497 20 0 BEADRP CC(C)Cc1ccc(C[NH2+][C@@H](C)CC[NH3+])cn1 ZINC001575656093 993090701 /nfs/dbraw/zinc/09/07/01/993090701.db2.gz UTSJBWJDFQJHOH-LBPRGKRZSA-N 2 0 235.375 2.107 20 0 BEADRP CC(C)[C@@H]1C[C@H]1[NH2+][C@@H](C)C[C@@H]1CCC[NH2+]1 ZINC001575940770 993132579 /nfs/dbraw/zinc/13/25/79/993132579.db2.gz BKZFWEHUVKPEIN-ZDEQEGDKSA-N 2 0 210.365 2.151 20 0 BEADRP CC(C)[C@@H]1C[C@H]1[NH2+][C@H](C)C[C@@H]1CCC[NH2+]1 ZINC001575940767 993133702 /nfs/dbraw/zinc/13/37/02/993133702.db2.gz BKZFWEHUVKPEIN-MROQNXINSA-N 2 0 210.365 2.151 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H]1C[C@@H]2CC[C@@H](C2)C1 ZINC001575952866 993136187 /nfs/dbraw/zinc/13/61/87/993136187.db2.gz SUPZWLKMIWNBHI-NDBYEHHHSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H]1C[C@@H]2CC[C@@H](C2)C1 ZINC001575952864 993136654 /nfs/dbraw/zinc/13/66/54/993136654.db2.gz SUPZWLKMIWNBHI-FVCCEPFGSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@@H]1C[C@@H]2CC[C@@H](C2)C1 ZINC001575952867 993137092 /nfs/dbraw/zinc/13/70/92/993137092.db2.gz SUPZWLKMIWNBHI-RVMXOQNASA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H](C[NH2+]Cc1cccc(N)c1)C[NH+]1CCCC1 ZINC001576033070 993160261 /nfs/dbraw/zinc/16/02/61/993160261.db2.gz LNIJWYMNODCJKM-CYBMUJFWSA-N 2 0 247.386 2.090 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H](C)[C@@H]1C[C@H]1C1CC1 ZINC001576152473 993189461 /nfs/dbraw/zinc/18/94/61/993189461.db2.gz IIYTVUUWYMKTIA-SXTJYALSSA-N 2 0 210.365 2.136 20 0 BEADRP CC(C)[C@@H](C[NH2+]C[C@@H](C)[NH3+])c1ccccc1 ZINC001576159242 993198123 /nfs/dbraw/zinc/19/81/23/993198123.db2.gz OAYYXVKEVKHPMO-TZMCWYRMSA-N 2 0 220.360 2.363 20 0 BEADRP CC1(C)CC(C[NH2+]CC2(C[NH3+])CCC2)C1 ZINC001576396252 993295997 /nfs/dbraw/zinc/29/59/97/993295997.db2.gz XLKHKSOTADRMHT-UHFFFAOYSA-N 2 0 210.365 2.141 20 0 BEADRP CC1(C)CC[C@@H](C[NH2+]C[C@H]2CCSC2)[NH2+]C1 ZINC001576420965 993298294 /nfs/dbraw/zinc/29/82/94/993298294.db2.gz DSWDSVTVIQEPEG-NEPJUHHUSA-N 2 0 242.432 2.107 20 0 BEADRP CC1(C)CCC[C@@H]1C[NH2+]CC1(C[NH3+])CC1 ZINC001576434433 993304588 /nfs/dbraw/zinc/30/45/88/993304588.db2.gz GTYYGGWCBDQSMM-LLVKDONJSA-N 2 0 210.365 2.141 20 0 BEADRP CC1(C)CCC[C@H]1C[NH2+]CC1(C[NH3+])CC1 ZINC001576434435 993302651 /nfs/dbraw/zinc/30/26/51/993302651.db2.gz GTYYGGWCBDQSMM-NSHDSACASA-N 2 0 210.365 2.141 20 0 BEADRP CCC1CCC([N@@H+]2CC[C@@H]([NH3+])[C@H]2C)CC1 ZINC000380081816 993310054 /nfs/dbraw/zinc/31/00/54/993310054.db2.gz KTYMLNLZGLPSDN-IKWCTNDRSA-N 2 0 210.365 2.377 20 0 BEADRP CC[C@@H]1C[C@@H]([N@@H+]2CCCC[C@@H](C[NH3+])C2)CCO1 ZINC000380075543 993312604 /nfs/dbraw/zinc/31/26/04/993312604.db2.gz RBXVCOGWQJIWAM-MELADBBJSA-N 2 0 240.391 2.005 20 0 BEADRP CC1(C[N@@H+]2C[C@@H]3CCC[C@@]3([NH3+])C2)CCCC1 ZINC001576503430 993324494 /nfs/dbraw/zinc/32/44/94/993324494.db2.gz STVWDSLMQGWRNU-GXTWGEPZSA-N 2 0 222.376 2.380 20 0 BEADRP CC(C)CCC[C@@H](C)[N@H+](C)CCC[NH3+] ZINC000380284519 993325531 /nfs/dbraw/zinc/32/55/31/993325531.db2.gz ZRFINZGOTPSJNS-GFCCVEGCSA-N 2 0 200.370 2.482 20 0 BEADRP CC1=CCC[C@@H](C)[C@@H]1C[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC001576555488 993341389 /nfs/dbraw/zinc/34/13/89/993341389.db2.gz HYVSTPZZCIFQRM-APIJFGDWSA-N 2 0 234.387 2.130 20 0 BEADRP CC1=CC[C@H]([NH2+]CC[C@@H]2C[NH2+]C[C@H]2C)CC1 ZINC001576556107 993341554 /nfs/dbraw/zinc/34/15/54/993341554.db2.gz NOGZAYGXVNSQEX-MCIONIFRSA-N 2 0 222.376 2.320 20 0 BEADRP CC1=CCC[C@H](C)[C@@H]1C[NH2+][C@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC001576554814 993342191 /nfs/dbraw/zinc/34/21/91/993342191.db2.gz BLYVWGSECFLRPT-QRTUWBSPSA-N 2 0 234.387 2.461 20 0 BEADRP C[C@@H]1C[C@@H](CNc2ccc3c([nH+]2)CCC3)CC[NH2+]1 ZINC001576596872 993362237 /nfs/dbraw/zinc/36/22/37/993362237.db2.gz BGWDTVGELCENPS-NEPJUHHUSA-N 2 0 245.370 2.370 20 0 BEADRP C[C@@H]1C[C@H]([NH3+])CC[N@@H+]1CC12CCC(CC1)C2 ZINC001576608557 993365280 /nfs/dbraw/zinc/36/52/80/993365280.db2.gz UNJIQEHAFMBHIZ-NELGMTEASA-N 2 0 222.376 2.378 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@@H]2C[C@H]2C2CC2)CC1 ZINC000381521474 993403272 /nfs/dbraw/zinc/40/32/72/993403272.db2.gz UUYAJXYOOYODGT-UONOGXRCSA-N 2 0 222.376 2.247 20 0 BEADRP C[NH+](C)C1CCC([NH2+]C2CC(F)(F)C2)CC1 ZINC000381785560 993426088 /nfs/dbraw/zinc/42/60/88/993426088.db2.gz YSIQRPDEBTYOSF-UHFFFAOYSA-N 2 0 232.318 2.247 20 0 BEADRP C[C@@H]1C[N@H+](CC2(C[NH3+])CCC2)CCC1(F)F ZINC001576800768 993428837 /nfs/dbraw/zinc/42/88/37/993428837.db2.gz LPOJBFILYNGHHQ-SNVBAGLBSA-N 2 0 232.318 2.093 20 0 BEADRP Cc1ccc(N[C@H]2CCC[C@@H]([NH3+])C2)nc1 ZINC000382434505 993459146 /nfs/dbraw/zinc/45/91/46/993459146.db2.gz UHBBORSQYMYUOP-MNOVXSKESA-N 2 0 205.305 2.072 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+]C[C@@H]1CCC[NH2+]CC1 ZINC001576962890 993470928 /nfs/dbraw/zinc/47/09/28/993470928.db2.gz WJPAVHVECSBRON-RWMBFGLXSA-N 2 0 212.381 2.400 20 0 BEADRP CC[C@H]([NH3+])C[NH2+]CC1C2CC3CC(C2)CC1C3 ZINC001577124432 993509348 /nfs/dbraw/zinc/50/93/48/993509348.db2.gz ANHGYWJOJPQEDY-BPHCLYMKSA-N 2 0 236.403 2.386 20 0 BEADRP CC[C@@H]1CCCC[C@@H]1C[NH2+][C@H]1C[C@H]([NH3+])C1 ZINC001577254369 993564504 /nfs/dbraw/zinc/56/45/04/993564504.db2.gz JVGQQARKDPIACJ-FDYHWXHSSA-N 2 0 210.365 2.282 20 0 BEADRP CCC[C@@H](C[NH2+]C1(C[NH3+])CCCCC1)OC ZINC001577358125 993616354 /nfs/dbraw/zinc/61/63/54/993616354.db2.gz PZOMJEAUMPRENC-LBPRGKRZSA-N 2 0 228.380 2.053 20 0 BEADRP CCC[C@@H]1[C@H](C)CCC[N@@H+]1C[C@]12C[C@H]1C[NH2+]C2 ZINC001577374832 993626774 /nfs/dbraw/zinc/62/67/74/993626774.db2.gz HGFMBEBNSJSNFQ-LXTVHRRPSA-N 2 0 236.403 2.497 20 0 BEADRP CN(C)[C@@H](C[NH2+]C1CC(C)(C)C1)C1CC1 ZINC000389908436 993767793 /nfs/dbraw/zinc/76/77/93/993767793.db2.gz IAHDRINDUNYUHG-LBPRGKRZSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH+]2CCC(C)([NH3+])CC2)C1 ZINC000390672438 993800376 /nfs/dbraw/zinc/80/03/76/993800376.db2.gz VYEUAEJBXIIJEN-VXGBXAGGSA-N 2 0 210.365 2.378 20 0 BEADRP CCCCC[N@@H+]1C[C@H]2C[NH+](C)C[C@@]2(C)C1 ZINC001308121057 995555285 /nfs/dbraw/zinc/55/52/85/995555285.db2.gz MEZKVEZSAWMGSH-OLZOCXBDSA-N 2 0 210.365 2.060 20 0 BEADRP CC[C@@H]1CCC[N@H+](CC2CC[NH2+]CC2)C1 ZINC000036169884 1170198884 /nfs/dbraw/zinc/19/88/84/1170198884.db2.gz NQKRTTCXCHUPHP-GFCCVEGCSA-N 2 0 210.365 2.108 20 0 BEADRP CCOCC[NH2+][C@H](C)CCC[NH+](CC)CC ZINC000035098238 1170644221 /nfs/dbraw/zinc/64/42/21/1170644221.db2.gz KENYAMNKVGKYEA-CYBMUJFWSA-N 2 0 230.396 2.123 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[C@H]3C[N@H+](C)C[C@@H]32)C1 ZINC001621108267 1170717645 /nfs/dbraw/zinc/71/76/45/1170717645.db2.gz KWWHDXMPDBDEPF-CAEXGNQWSA-N 2 0 236.403 2.495 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC001621452400 1170810989 /nfs/dbraw/zinc/81/09/89/1170810989.db2.gz UXTNUILVQQSWJK-ZIAGYGMSSA-N 2 0 222.376 2.060 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@H]([NH2+][C@H]3CCC(C)(C)C3)[C@H]2C1 ZINC001621569799 1170854726 /nfs/dbraw/zinc/85/47/26/1170854726.db2.gz FBDVZMFMTKOXJO-XUXIUFHCSA-N 2 0 236.403 2.495 20 0 BEADRP CC[NH+](CC)C[C@@H](O)C[NH2+]C1CCCCCC1 ZINC000037856023 1170983604 /nfs/dbraw/zinc/98/36/04/1170983604.db2.gz NOIOQIMUBSZRAN-AWEZNQCLSA-N 2 0 242.407 2.002 20 0 BEADRP C[N@H+](C1CCCC1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000040746560 1171152398 /nfs/dbraw/zinc/15/23/98/1171152398.db2.gz AGJALCVJPBMROK-QYJAPNMZSA-N 2 0 208.349 2.144 20 0 BEADRP CCCCC[C@@H](C)[NH2+]C[C@H](O)C[NH+](CC)CC ZINC000042229481 1171217255 /nfs/dbraw/zinc/21/72/55/1171217255.db2.gz RUXDSMYUOFBAHQ-KGLIPLIRSA-N 2 0 244.423 2.248 20 0 BEADRP c1coc(C[N@@H+](CC2CC[NH2+]CC2)C2CC2)c1 ZINC000042693292 1171248918 /nfs/dbraw/zinc/24/89/18/1171248918.db2.gz NMRPGYSNKIQYMA-UHFFFAOYSA-N 2 0 234.343 2.244 20 0 BEADRP C[C@@H]1CCCC[N@@H+]1CCCNc1cc(N)cc[nH+]1 ZINC000043568348 1171302651 /nfs/dbraw/zinc/30/26/51/1171302651.db2.gz UKHPBYVEVIOMNA-GFCCVEGCSA-N 2 0 248.374 2.340 20 0 BEADRP CC(C)CCC[C@H](C)[N@@H+]1CCC[NH2+]CC1 ZINC000049660683 1171717729 /nfs/dbraw/zinc/71/77/29/1171717729.db2.gz HKFAXXQAZJSRGA-ZDUSSCGKSA-N 2 0 212.381 2.497 20 0 BEADRP COc1ccc(C[NH2+]CCC[C@@H]2CCC[NH2+]2)cc1 ZINC000414979958 398135487 /nfs/dbraw/zinc/13/54/87/398135487.db2.gz VUPBOHWLRYENEF-CQSZACIVSA-N 2 0 248.370 2.317 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+]C[C@H](C)Cc1ccccc1 ZINC000414994228 398137947 /nfs/dbraw/zinc/13/79/47/398137947.db2.gz UOFOSMXCIINPDO-TZMCWYRMSA-N 2 0 220.360 2.192 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCC[NH+]2CCCCC2)[C@H]1C ZINC000309324718 136210426 /nfs/dbraw/zinc/21/04/26/136210426.db2.gz HVWPKVJHRBRKAZ-HZSPNIEDSA-N 2 0 224.392 2.497 20 0 BEADRP COc1ccc(C2([NH2+][C@H](C)CCC[NH3+])CC2)cc1 ZINC000422941675 398159519 /nfs/dbraw/zinc/15/95/19/398159519.db2.gz VISUBYHYDRQDTR-GFCCVEGCSA-N 2 0 248.370 2.401 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CCOC1CCCCC1 ZINC000422941831 398159722 /nfs/dbraw/zinc/15/97/22/398159722.db2.gz IPSZMPDKWDSSGN-NWDGAFQWSA-N 2 0 228.380 2.051 20 0 BEADRP Cc1ccccc1C1(C[NH2+][C@H](C)C2C[NH2+]C2)CC1 ZINC000422907326 398157380 /nfs/dbraw/zinc/15/73/80/398157380.db2.gz WYHYJCDMWXITOB-CYBMUJFWSA-N 2 0 244.382 2.224 20 0 BEADRP C[C@H](C[N@@H+]1C[C@@H](C[NH3+])C[C@H]1C)C(C)(C)C ZINC000379814367 398170590 /nfs/dbraw/zinc/17/05/90/398170590.db2.gz PTZUNLMPGVRZRO-IJLUTSLNSA-N 2 0 212.381 2.338 20 0 BEADRP C[N@@H+](Cc1ccc(F)cc1)CC1CC[NH2+]CC1 ZINC000042437116 398172544 /nfs/dbraw/zinc/17/25/44/398172544.db2.gz XTGPKUKCAMMVMU-UHFFFAOYSA-N 2 0 236.334 2.257 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]C[C@@H]1CC=CCC1 ZINC000422976841 398160955 /nfs/dbraw/zinc/16/09/55/398160955.db2.gz VQBKKHYNAZVXCW-MCIONIFRSA-N 2 0 222.376 2.320 20 0 BEADRP CCc1cnccc1[C@H](C)[NH2+][C@@H](C)C[C@@H](C)[NH3+] ZINC000423019932 398161071 /nfs/dbraw/zinc/16/10/71/398161071.db2.gz XVYVBJLLAAZTNT-WOPDTQHZSA-N 2 0 235.375 2.420 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H]1CC1(C)C ZINC000423021288 398161919 /nfs/dbraw/zinc/16/19/19/398161919.db2.gz BPAJCQQKFLNXGJ-GWCFXTLKSA-N 2 0 233.359 2.298 20 0 BEADRP CC(C)C[C@@H]([NH3+])C[NH2+][C@H]1CCC[C@@H]2C[C@@H]21 ZINC000415118354 398162965 /nfs/dbraw/zinc/16/29/65/398162965.db2.gz YBHXJBXROLAKFY-NDBYEHHHSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]C[C@@H](C)CC(F)(F)F ZINC000423174528 398164235 /nfs/dbraw/zinc/16/42/35/398164235.db2.gz CIAXKJHKAAOLBX-XHNCKOQMSA-N 2 0 226.286 2.290 20 0 BEADRP Cc1cc(F)ccc1CC[NH2+][C@@H](C)CCC[NH3+] ZINC000310518549 178084087 /nfs/dbraw/zinc/08/40/87/178084087.db2.gz LLVJGIYAKABSLH-LBPRGKRZSA-N 2 0 238.350 2.394 20 0 BEADRP Cc1cc(F)ccc1C[N@@H+]1CCC[C@@H](C[NH3+])C1 ZINC000050580334 178084786 /nfs/dbraw/zinc/08/47/86/178084786.db2.gz BBLWGLDWVPPZPC-LBPRGKRZSA-N 2 0 236.334 2.305 20 0 BEADRP Cc1cc(F)ccc1C[NH2+][C@@H]1CC[NH2+][C@@H](C)C1 ZINC000334865324 178087325 /nfs/dbraw/zinc/08/73/25/178087325.db2.gz SIVQNLGDMOOZNW-SMDDNHRTSA-N 2 0 236.334 2.364 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCC[NH+]2CCCCC2)[C@@H]1C ZINC000309324723 136217976 /nfs/dbraw/zinc/21/79/76/136217976.db2.gz HVWPKVJHRBRKAZ-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H](C[NH2+][C@@H](C)[C@H]1CCCC[NH2+]1)C1CC1 ZINC000386090441 398197534 /nfs/dbraw/zinc/19/75/34/398197534.db2.gz IBILQXKYVZLGMM-NTZNESFSSA-N 2 0 210.365 2.153 20 0 BEADRP Cc1cc(N2CCC[C@@H]([NH+](C)C)CC2)cc[nH+]1 ZINC000277205680 178114045 /nfs/dbraw/zinc/11/40/45/178114045.db2.gz QBUBYCHOQHFSGR-CYBMUJFWSA-N 2 0 233.359 2.311 20 0 BEADRP Cc1cc(N2CCC[N@@H+]3CCC[C@@H]3C2)cc[nH+]1 ZINC000372227315 178114257 /nfs/dbraw/zinc/11/42/57/178114257.db2.gz LDXCLKONZWMLDQ-CQSZACIVSA-N 2 0 231.343 2.065 20 0 BEADRP COC[C@H]([NH2+]CCCC[NH+](C)C)C1CCCC1 ZINC000446842750 201697470 /nfs/dbraw/zinc/69/74/70/201697470.db2.gz YBCNWBCIGWTAPB-AWEZNQCLSA-N 2 0 242.407 2.123 20 0 BEADRP Cc1cc(N2CC[C@@H]([NH+]3CCCC3)C2)cc[nH+]1 ZINC000302218027 178117810 /nfs/dbraw/zinc/11/78/10/178117810.db2.gz KLWQGJTWKJKGPM-CQSZACIVSA-N 2 0 231.343 2.065 20 0 BEADRP Cc1cc(N2CC[C@H]([NH+]3CCCCC3)C2)cc[nH+]1 ZINC000274871295 178119036 /nfs/dbraw/zinc/11/90/36/178119036.db2.gz FRFQDRVFWJEJHW-HNNXBMFYSA-N 2 0 245.370 2.455 20 0 BEADRP Cc1cc(N2CC[C@H](C[NH3+])C2)c2ccccc2[nH+]1 ZINC000019439058 178120047 /nfs/dbraw/zinc/12/00/47/178120047.db2.gz PZNIFTAJDVVEPN-GFCCVEGCSA-N 2 0 241.338 2.328 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H](CC)c1ccncc1 ZINC000576386357 365581204 /nfs/dbraw/zinc/58/12/04/365581204.db2.gz GUFMKHARIXJKAK-ZDUSSCGKSA-N 2 0 221.348 2.122 20 0 BEADRP Cc1cc(NCC[N@H+]2CC=CCC2)cc[nH+]1 ZINC000280301077 178161332 /nfs/dbraw/zinc/16/13/32/178161332.db2.gz RKQKZXZHKSWKDU-UHFFFAOYSA-N 2 0 217.316 2.064 20 0 BEADRP Cc1cc(NC[C@@H]2CCC[C@H]([NH3+])C2)cc[nH+]1 ZINC000227669863 178167432 /nfs/dbraw/zinc/16/74/32/178167432.db2.gz GIDCZFWPCZKDLD-NEPJUHHUSA-N 2 0 219.332 2.319 20 0 BEADRP [NH3+]CC[C@@H]1CCC[N@H+](Cc2ccccc2F)C1 ZINC000070169343 398221587 /nfs/dbraw/zinc/22/15/87/398221587.db2.gz NACZYFVJAJJUKD-LBPRGKRZSA-N 2 0 236.334 2.387 20 0 BEADRP Cc1cc(N[C@H](C)[C@H]2CCC[NH2+]C2)cc[nH+]1 ZINC000229574542 178186336 /nfs/dbraw/zinc/18/63/36/178186336.db2.gz BVBWFXJLZWTIPY-NEPJUHHUSA-N 2 0 219.332 2.190 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCC[C@@H]1C[NH3+])CC(F)(F)F ZINC000396917961 262827328 /nfs/dbraw/zinc/82/73/28/262827328.db2.gz VXZHOEQCXKNEFM-IVZWLZJFSA-N 2 0 238.297 2.292 20 0 BEADRP CCC(CC)C[N@@H+]1CC[C@@H]2[NH2+]CC[C@H]2C1 ZINC000336713147 168351818 /nfs/dbraw/zinc/35/18/18/168351818.db2.gz VJPYILLMAYXVGC-STQMWFEESA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]([NH2+]C1CCC([NH+](C)C)CC1)[C@@H]1C[C@H]1C ZINC000421371314 192335875 /nfs/dbraw/zinc/33/58/75/192335875.db2.gz JNJKBVYFKYMULF-XPXVYLNCSA-N 2 0 224.392 2.493 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2CCC[C@@H](C)[C@@H]2C)CC[NH2+]1 ZINC000229546093 538939579 /nfs/dbraw/zinc/93/95/79/538939579.db2.gz BFFRSWMZRDXURF-FVCCEPFGSA-N 2 0 210.365 2.247 20 0 BEADRP Cc1cc([C@H](C)N[C@H]2CC[N@@H+]3CCC[C@H]3C2)no1 ZINC000337547551 178258194 /nfs/dbraw/zinc/25/81/94/178258194.db2.gz MKOCWPMJYVIFHL-AVGNSLFASA-N 2 0 249.358 2.260 20 0 BEADRP CCOc1ccccc1C[N@@H+]1CC[C@H]([C@H](C)[NH3+])C1 ZINC000252779484 136226815 /nfs/dbraw/zinc/22/68/15/136226815.db2.gz LSZQQGXAFGYWEW-STQMWFEESA-N 2 0 248.370 2.254 20 0 BEADRP CCC(CC)C[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000037408347 168361607 /nfs/dbraw/zinc/36/16/07/168361607.db2.gz LAIBNRWEXWPJPP-CYBMUJFWSA-N 2 0 224.392 2.497 20 0 BEADRP CCC(CC)C[NH2+][C@@H]1CC[NH2+]CC1(C)C ZINC000300883110 168363278 /nfs/dbraw/zinc/36/32/78/168363278.db2.gz SQHFOJORNTXHBB-GFCCVEGCSA-N 2 0 212.381 2.400 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@H]1C[C@@H](C)O[C@@H](C)C1 ZINC000576582280 365630393 /nfs/dbraw/zinc/63/03/93/365630393.db2.gz IOKHAGJBIWOBEY-WDNDVIMCSA-N 2 0 242.407 2.262 20 0 BEADRP CCC[C@H](C[NH2+]C1CC[NH+](CCC)CC1)OC ZINC000356344613 398247532 /nfs/dbraw/zinc/24/75/32/398247532.db2.gz XCIPHOFSAQWSKM-CQSZACIVSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@H]([NH2+]Cc1ccc(C[NH3+])cc1)c1ccccn1 ZINC000576637606 365645988 /nfs/dbraw/zinc/64/59/88/365645988.db2.gz SLJKYTPYGYKXCB-LBPRGKRZSA-N 2 0 241.338 2.391 20 0 BEADRP C[NH2+]CCCN1CCCc2sccc2C1 ZINC000381479319 398258974 /nfs/dbraw/zinc/25/89/74/398258974.db2.gz CCCVWEJVJUHZJS-UHFFFAOYSA-N 2 0 224.373 2.106 20 0 BEADRP C[C@H]([NH2+]C[C@H]1Cc2ccccc21)[C@@H]1CCCC[NH2+]1 ZINC000386094524 398263235 /nfs/dbraw/zinc/26/32/35/398263235.db2.gz IQMQTKVHEMHWBL-BJJXKVORSA-N 2 0 244.382 2.447 20 0 BEADRP Cc1cccc(CC[N@@H+](C)C[C@@H]2CC[NH+](C)C2)c1 ZINC000449262920 398266412 /nfs/dbraw/zinc/26/64/12/398266412.db2.gz FYSJXIUHQKGWCQ-INIZCTEOSA-N 2 0 246.398 2.421 20 0 BEADRP CCC[C@@H]1C[C@H]1[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@@H]1C ZINC000090176101 398270390 /nfs/dbraw/zinc/27/03/90/398270390.db2.gz VNTJYJUWWWZKQF-ODXJTPSBSA-N 2 0 224.392 2.493 20 0 BEADRP CCSCC[NH2+]C[C@@H]1CCN1C1CCCC1 ZINC000600204195 342701430 /nfs/dbraw/zinc/70/14/30/342701430.db2.gz PIUYVHHMQXDBOZ-ZDUSSCGKSA-N 2 0 242.432 2.346 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCc2cc(F)ccc21)C1C[NH2+]C1 ZINC000335602398 136235582 /nfs/dbraw/zinc/23/55/82/136235582.db2.gz ZIOQGPGZLJVWPX-LKFCYVNXSA-N 2 0 234.318 2.011 20 0 BEADRP CC(C)CCC[N@@H+]1CCC[C@@H](CC[NH3+])C1 ZINC000165543845 361842040 /nfs/dbraw/zinc/84/20/40/361842040.db2.gz PFJSTGBXRXESFE-ZDUSSCGKSA-N 2 0 212.381 2.483 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@H]1CCC[C@@H]1C ZINC000165715218 361844658 /nfs/dbraw/zinc/84/46/58/361844658.db2.gz CERARHALVOMXKN-STQMWFEESA-N 2 0 212.381 2.495 20 0 BEADRP Cc1ccc2c(c1)CC[C@@H]2[NH2+]C1CC[NH2+]CC1 ZINC000335602368 136235702 /nfs/dbraw/zinc/23/57/02/136235702.db2.gz YKQOMZAQNUPYPQ-HNNXBMFYSA-N 2 0 230.355 2.324 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H]1CCC[C@@H]1C ZINC000083389770 398280820 /nfs/dbraw/zinc/28/08/20/398280820.db2.gz NUVFNGJUGRABEX-QWHCGFSZSA-N 2 0 212.381 2.497 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@@H](C)[C@H](C[NH3+])C2)c(C)n1 ZINC000335614036 136237386 /nfs/dbraw/zinc/23/73/86/136237386.db2.gz NHXKWCRLSNABJM-IAQYHMDHSA-N 2 0 247.386 2.115 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)[C@H]1C[C@@H]1C ZINC000321136987 342751184 /nfs/dbraw/zinc/75/11/84/342751184.db2.gz URTIDVHFBVBIRZ-XUXIUFHCSA-N 2 0 224.392 2.352 20 0 BEADRP FC(F)C1CCC([NH2+]C2CC[NH2+]CC2)CC1 ZINC000335611738 136236922 /nfs/dbraw/zinc/23/69/22/136236922.db2.gz IUSPPSRICWVAPS-UHFFFAOYSA-N 2 0 232.318 2.152 20 0 BEADRP Cc1cc2c(c(C3=CC[NH2+]CC3)c1)C[NH2+]CC2 ZINC000630051009 361914640 /nfs/dbraw/zinc/91/46/40/361914640.db2.gz HSZGFDGFYSJVLY-UHFFFAOYSA-N 2 0 228.339 2.017 20 0 BEADRP C(C[NH+]1CCCC1)C[N@@H+]1CCC2(CCC2)C1 ZINC000162257442 349624020 /nfs/dbraw/zinc/62/40/20/349624020.db2.gz HJNFYGSLBUKLGJ-UHFFFAOYSA-N 2 0 222.376 2.348 20 0 BEADRP FC1(F)CC[C@H]([NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)C1 ZINC000383928840 539012262 /nfs/dbraw/zinc/01/22/62/539012262.db2.gz BHCOFLJHKWKGTD-SRVKXCTJSA-N 2 0 244.329 2.391 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CSC[C@H]1C)C1CC[NH+](C)CC1 ZINC000381433348 539000546 /nfs/dbraw/zinc/00/05/46/539000546.db2.gz CAEHXCWCQNIAME-NQBHXWOUSA-N 2 0 242.432 2.058 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCC2(C)C)C1 ZINC000389388652 539016352 /nfs/dbraw/zinc/01/63/52/539016352.db2.gz UOQFGUXMWOHZBJ-NEPJUHHUSA-N 2 0 210.365 2.106 20 0 BEADRP C[N@H+](CC1CC1)C[C@H]1CC[NH+](CC2CCC2)C1 ZINC000350764162 398301652 /nfs/dbraw/zinc/30/16/52/398301652.db2.gz ONQLSOABYMRCKW-OAHLLOKOSA-N 2 0 236.403 2.450 20 0 BEADRP CC[C@@H]1CCC[N@H+](C[C@@H]2CCC[NH2+]C2)C1 ZINC000036169892 342894554 /nfs/dbraw/zinc/89/45/54/342894554.db2.gz DQMJOFRFMSIZNX-CHWSQXEVSA-N 2 0 210.365 2.108 20 0 BEADRP CC(C)C1(C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)CC1 ZINC000232727745 342879394 /nfs/dbraw/zinc/87/93/94/342879394.db2.gz FELIBMYCWFOYPT-NEPJUHHUSA-N 2 0 210.365 2.282 20 0 BEADRP CCC[C@H](C)[NH2+]Cc1ccc(C[NH3+])cc1 ZINC000233337655 342901277 /nfs/dbraw/zinc/90/12/77/342901277.db2.gz VMBCLHMFOLTCQY-NSHDSACASA-N 2 0 206.333 2.424 20 0 BEADRP C[C@@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1cscn1 ZINC000580312081 346893339 /nfs/dbraw/zinc/89/33/39/346893339.db2.gz JBZXBBDNZIAQFR-MNOVXSKESA-N 2 0 239.388 2.326 20 0 BEADRP Cc1ccc([C@H](C)[NH2+]CCCC[NH3+])cc1 ZINC000037714766 342943456 /nfs/dbraw/zinc/94/34/56/342943456.db2.gz DGLYTQFAYYOJIC-LBPRGKRZSA-N 2 0 206.333 2.385 20 0 BEADRP CC[C@@H](C[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1)c1ccccc1 ZINC000479953106 529474436 /nfs/dbraw/zinc/47/44/36/529474436.db2.gz GQUGJXMIQJGODG-CWRNSKLLSA-N 2 0 244.382 2.331 20 0 BEADRP COCCC[C@H](C)[NH2+]C[C@@H](C)C[NH+]1CCCC1 ZINC000178244178 536666710 /nfs/dbraw/zinc/66/67/10/536666710.db2.gz HISJLBWNRKXGEN-KGLIPLIRSA-N 2 0 242.407 2.123 20 0 BEADRP C[NH+](C)CC(C)(C)C[NH2+][C@@H]1CCC[C@H]2C[C@H]21 ZINC000304577205 259335326 /nfs/dbraw/zinc/33/53/26/259335326.db2.gz NMFYGGCVCSODGM-YNEHKIRRSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1C[N@H+](C/C=C\c2ccccc2)CC[C@@H]1[NH3+] ZINC000211315019 342985716 /nfs/dbraw/zinc/98/57/16/342985716.db2.gz YMPMBDKWTYYQOB-DBVFPWQWSA-N 2 0 230.355 2.369 20 0 BEADRP C[C@@H]1C[C@@H](C[N@H+]2C[C@@H](C)S[C@@H](C)C2)CC[NH2+]1 ZINC000235382363 343011778 /nfs/dbraw/zinc/01/17/78/343011778.db2.gz WFBPDXIQSQSZEK-NDBYEHHHSA-N 2 0 242.432 2.200 20 0 BEADRP C[C@H]1c2c(F)cccc2CCN1CC(C)(C)[NH3+] ZINC000576822960 365694833 /nfs/dbraw/zinc/69/48/33/365694833.db2.gz KRSFPPVIPUHUOO-JTQLQIEISA-N 2 0 236.334 2.482 20 0 BEADRP CC[N@H+](Cc1ccc(-n2ccnc2)nc1)C(C)C ZINC000177088004 346921834 /nfs/dbraw/zinc/92/18/34/346921834.db2.gz JBYQWWRIOAAZKJ-UHFFFAOYSA-N 2 0 244.342 2.498 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)C(C)C ZINC000400937299 529661204 /nfs/dbraw/zinc/66/12/04/529661204.db2.gz BHXORWNSIDXYOL-DGAVXFQQSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@H]([NH2+][C@H]1CCCC[C@@H]1C[NH3+])c1ccoc1 ZINC000576861478 365704903 /nfs/dbraw/zinc/70/49/03/365704903.db2.gz XWAFIGLJJHNLKV-LOWVWBTDSA-N 2 0 222.332 2.448 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCCC[C@@H]1C[NH3+])c1ccoc1 ZINC000576861475 365705192 /nfs/dbraw/zinc/70/51/92/365705192.db2.gz XWAFIGLJJHNLKV-DMDPSCGWSA-N 2 0 222.332 2.448 20 0 BEADRP CC(C)[C@H](C)C[NH2+][C@H](C)[C@@H]1CCCC[NH2+]1 ZINC000386597521 343079180 /nfs/dbraw/zinc/07/91/80/343079180.db2.gz TWAVFVOTNYPPMK-UPJWGTAASA-N 2 0 212.381 2.399 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]CC2(C3CC3)CC2)C1 ZINC000236314215 343091759 /nfs/dbraw/zinc/09/17/59/343091759.db2.gz OEGYZXMAGRTABU-VXGBXAGGSA-N 2 0 208.349 2.036 20 0 BEADRP Cc1ccccc1C[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000168729953 136269869 /nfs/dbraw/zinc/26/98/69/136269869.db2.gz VTPCMHPXDOSEGL-CQSZACIVSA-N 2 0 218.344 2.227 20 0 BEADRP COCc1ccccc1C[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000093214618 343151159 /nfs/dbraw/zinc/15/11/59/343151159.db2.gz DDLVOUMZEQGFMK-LSDHHAIUSA-N 2 0 248.370 2.193 20 0 BEADRP Cc1cccc(CC[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)c1 ZINC000093215805 343151345 /nfs/dbraw/zinc/15/13/45/343151345.db2.gz NDSSOEYVZJXMRE-HUUCEWRRSA-N 2 0 232.371 2.397 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]CCCOc2ccccc2)C1 ZINC000093215836 343151364 /nfs/dbraw/zinc/15/13/64/343151364.db2.gz GDUJXRCULGPZLB-KGLIPLIRSA-N 2 0 248.370 2.315 20 0 BEADRP c1ccc2c(c1)CC[C@H]([NH2+]CC1CC[NH2+]CC1)C2 ZINC000094010420 343151721 /nfs/dbraw/zinc/15/17/21/343151721.db2.gz DPYYTDCQUQCCLO-INIZCTEOSA-N 2 0 244.382 2.133 20 0 BEADRP Cc1ccccc1CC[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000094183059 343152561 /nfs/dbraw/zinc/15/25/61/343152561.db2.gz AOPJMCQKPRLAMH-LSDHHAIUSA-N 2 0 232.371 2.397 20 0 BEADRP C[C@@H]1CCC[N@H+](CC[C@@H]2CCC[NH2+]C2)CC1 ZINC000082489431 136276548 /nfs/dbraw/zinc/27/65/48/136276548.db2.gz MGMANOWYINNTSM-KGLIPLIRSA-N 2 0 224.392 2.498 20 0 BEADRP CCc1ccccc1C[N@H+](C)CCC[NH2+]C ZINC000087472121 136281494 /nfs/dbraw/zinc/28/14/94/136281494.db2.gz HRMOSNMDSXTNRU-UHFFFAOYSA-N 2 0 220.360 2.290 20 0 BEADRP c1[nH+]cn2cc(C[NH2+]C3CCCC3)ccc12 ZINC000297575344 136291221 /nfs/dbraw/zinc/29/12/21/136291221.db2.gz RORKYGTYBYXXBR-UHFFFAOYSA-N 2 0 215.300 2.367 20 0 BEADRP [NH3+]C[C@@H]1CC[N@H+](CCCc2cccc(F)c2)C1 ZINC000348757859 136297268 /nfs/dbraw/zinc/29/72/68/136297268.db2.gz YTHULJPEYOBXPF-ZDUSSCGKSA-N 2 0 236.334 2.039 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+]CCC[NH+](C)C ZINC000035451290 343297166 /nfs/dbraw/zinc/29/71/66/343297166.db2.gz YIWVQEZDORWFMY-GFCCVEGCSA-N 2 0 224.348 2.142 20 0 BEADRP CCC1([NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)CC1 ZINC000335626662 136299574 /nfs/dbraw/zinc/29/95/74/136299574.db2.gz VYUCOWCTGSNKEO-VXGBXAGGSA-N 2 0 208.349 2.145 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CCC[NH+]2CCCC2)C1 ZINC000070642867 343337300 /nfs/dbraw/zinc/33/73/00/343337300.db2.gz CWRAWKUEJBAWOA-CHWSQXEVSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@H]1CCC[C@@H]1[NH2+]CCC[NH+]1CCCC1 ZINC000070829452 343341247 /nfs/dbraw/zinc/34/12/47/343341247.db2.gz VZDJMBHXFJTVMJ-STQMWFEESA-N 2 0 210.365 2.251 20 0 BEADRP c1ccc2c(c1)CC[C@H]2C[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000335650857 136305095 /nfs/dbraw/zinc/30/50/95/136305095.db2.gz QSELBDNLLMWYPW-LSDHHAIUSA-N 2 0 244.382 2.448 20 0 BEADRP CC(C)C1CCC([NH2+][C@@H]2CC[NH2+]C2)CC1 ZINC000335640871 136308448 /nfs/dbraw/zinc/30/84/48/136308448.db2.gz CBXWCULTTQPWIM-WXRRBKDZSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)(C)[C@@H]1CC[N@H+](C[C@@H]2CCC[NH2+]C2)C1 ZINC000166228459 136314636 /nfs/dbraw/zinc/31/46/36/136314636.db2.gz WCENZTRHPDZKQW-CHWSQXEVSA-N 2 0 224.392 2.354 20 0 BEADRP CSCCC[N@@H+]1CCC2(C1)CC[NH+](C)CC2 ZINC000602877062 349806991 /nfs/dbraw/zinc/80/69/91/349806991.db2.gz LHSPUIMXBHMYNK-UHFFFAOYSA-N 2 0 242.432 2.157 20 0 BEADRP Cc1cc(N2CCC3(CCC[N@H+]3C)CC2)cc[nH+]1 ZINC000335691333 136325374 /nfs/dbraw/zinc/32/53/74/136325374.db2.gz ZSLBWEZAWCWHGM-UHFFFAOYSA-N 2 0 245.370 2.455 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CC[C@H](C2CC[NH+](C)CC2)C1 ZINC000349157522 136327849 /nfs/dbraw/zinc/32/78/49/136327849.db2.gz YTPCJFVNDMXXMU-VHDGCEQUSA-N 2 0 236.403 2.306 20 0 BEADRP CC[C@H]1CCC[C@H](C[N@H+]2C[C@H]3C[NH2+]C[C@H]3C2)C1 ZINC000394501781 259360475 /nfs/dbraw/zinc/36/04/75/259360475.db2.gz BHVMEHSVEQMXNE-ZQDZILKHSA-N 2 0 236.403 2.354 20 0 BEADRP CSCCC[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C)C1 ZINC000247974715 136373442 /nfs/dbraw/zinc/37/34/42/136373442.db2.gz HQCHMDAGYCLRQX-CHWSQXEVSA-N 2 0 242.432 2.156 20 0 BEADRP CC(C)c1ccc(C[NH2+]C[C@H](C)C[NH3+])cc1 ZINC000258739869 136373740 /nfs/dbraw/zinc/37/37/40/136373740.db2.gz KUFRQASWAWAQRK-GFCCVEGCSA-N 2 0 220.360 2.494 20 0 BEADRP COc1ccccc1C[NH2+]CCCC[NH+](C)C ZINC000045598375 343531524 /nfs/dbraw/zinc/53/15/24/343531524.db2.gz WLWODTYQLMONQV-UHFFFAOYSA-N 2 0 236.359 2.127 20 0 BEADRP Cc1ccc(C[NH2+][C@@H](C)CC[NH+](C)C)cc1 ZINC000049551772 343602103 /nfs/dbraw/zinc/60/21/03/343602103.db2.gz JRXNQGRRTWIMOE-ZDUSSCGKSA-N 2 0 220.360 2.425 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+]Cc1ccccc1 ZINC000049553434 343602619 /nfs/dbraw/zinc/60/26/19/343602619.db2.gz MLMOONRZFJQICV-GFCCVEGCSA-N 2 0 206.333 2.116 20 0 BEADRP CC/C=C\CC[N@@H+]1CCc2nc[nH]c2C1 ZINC000625436235 343733758 /nfs/dbraw/zinc/73/37/58/343733758.db2.gz GTNCSNZHIJMTEX-ARJAWSKDSA-N 2 0 205.305 2.124 20 0 BEADRP Cc1ccc(C[NH+]2CCC(C[NH3+])CC2)cc1C ZINC000011889020 343772043 /nfs/dbraw/zinc/77/20/43/343772043.db2.gz WUMPLEGTFWNUQK-UHFFFAOYSA-N 2 0 232.371 2.474 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]CC1(C)CCC1 ZINC000090219874 343750053 /nfs/dbraw/zinc/75/00/53/343750053.db2.gz DKCLPCRMJLBEIG-NEPJUHHUSA-N 2 0 210.365 2.106 20 0 BEADRP Cc1ccc2c(c1)[C@@H]([NH2+][C@@H](C)CCC[NH3+])CO2 ZINC000576458581 343750550 /nfs/dbraw/zinc/75/05/50/343750550.db2.gz OXVNPAIDJVDZPE-AAEUAGOBSA-N 2 0 234.343 2.146 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+][C@@H](C)CCC[NH3+])CO2 ZINC000576458583 343750760 /nfs/dbraw/zinc/75/07/60/343750760.db2.gz OXVNPAIDJVDZPE-WCQYABFASA-N 2 0 234.343 2.146 20 0 BEADRP CC1(C[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)CCC1 ZINC000336667027 537816295 /nfs/dbraw/zinc/81/62/95/537816295.db2.gz LYYHWELNXZLKNA-LBPRGKRZSA-N 2 0 222.376 2.251 20 0 BEADRP CCCCOCC[N@@H+]1CCC[C@H]([NH+](C)C)CC1 ZINC000429543429 192366752 /nfs/dbraw/zinc/36/67/52/192366752.db2.gz WDOAIBUNIZMGQM-AWEZNQCLSA-N 2 0 242.407 2.219 20 0 BEADRP CCCCOCC[N@@H+]1CCC[C@@H]([NH+](C)C)CC1 ZINC000429543432 192366602 /nfs/dbraw/zinc/36/66/02/192366602.db2.gz WDOAIBUNIZMGQM-CQSZACIVSA-N 2 0 242.407 2.219 20 0 BEADRP CC[C@@H]([NH2+]CCC[NH+](C)C)C1CCCC1 ZINC000387655688 346992503 /nfs/dbraw/zinc/99/25/03/346992503.db2.gz LTRUXJVVDIVJJP-CYBMUJFWSA-N 2 0 212.381 2.497 20 0 BEADRP Cc1ccc(C[NH2+]CC2CC[NH+](C)CC2)cc1 ZINC000044515305 178604034 /nfs/dbraw/zinc/60/40/34/178604034.db2.gz VAUHAMALKXTFHD-UHFFFAOYSA-N 2 0 232.371 2.426 20 0 BEADRP CC[C@H](C)C[NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000221317382 259371768 /nfs/dbraw/zinc/37/17/68/259371768.db2.gz PNCAQOZWCDDGES-YNEHKIRRSA-N 2 0 212.381 2.495 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H](C)Cc1ccsc1 ZINC000573355049 344107330 /nfs/dbraw/zinc/10/73/30/344107330.db2.gz BARGFHMVQRZUIL-NSHDSACASA-N 2 0 226.389 2.268 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H]1CCc2ccccc21 ZINC000573355043 344107396 /nfs/dbraw/zinc/10/73/96/344107396.db2.gz AOASEUOQSUNRHH-CQSZACIVSA-N 2 0 218.344 2.263 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H]1CCc2ccccc21 ZINC000573355042 344107629 /nfs/dbraw/zinc/10/76/29/344107629.db2.gz AOASEUOQSUNRHH-AWEZNQCLSA-N 2 0 218.344 2.263 20 0 BEADRP Cc1ncccc1C[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000634732887 344108320 /nfs/dbraw/zinc/10/83/20/344108320.db2.gz RISBUGWWHVOXHB-CQSZACIVSA-N 2 0 247.386 2.258 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]([NH2+]C[C@@H]2CCSC2)C1 ZINC000634733550 344113755 /nfs/dbraw/zinc/11/37/55/344113755.db2.gz IFRUGNZJBBGVSD-NWDGAFQWSA-N 2 0 242.432 2.107 20 0 BEADRP CC[C@@H](C)C[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000634733661 344113991 /nfs/dbraw/zinc/11/39/91/344113991.db2.gz KUFJKPATNQWJLU-VXGBXAGGSA-N 2 0 212.381 2.400 20 0 BEADRP C[N@H+](C[C@@H]1CCSC1)C[C@@H]1CCC[NH+](C)C1 ZINC000495060197 529956975 /nfs/dbraw/zinc/95/69/75/529956975.db2.gz PZLZHIVKCRPXJB-OLZOCXBDSA-N 2 0 242.432 2.013 20 0 BEADRP CCC(CC)[NH2+]C[C@H]1CC[N@@H+](C(C)C)C1 ZINC000040621441 344125205 /nfs/dbraw/zinc/12/52/05/344125205.db2.gz NPLDKIAVAMREJO-GFCCVEGCSA-N 2 0 212.381 2.495 20 0 BEADRP Cc1cnccc1CN(C)CC[C@H]([NH3+])C(C)C ZINC000384906737 344221686 /nfs/dbraw/zinc/22/16/86/344221686.db2.gz AQVDJCBJSBWEFG-AWEZNQCLSA-N 2 0 235.375 2.195 20 0 BEADRP Cc1cccc(CC[NH2+][C@@H]2CC[N@@H+](C)C[C@@H]2C)c1 ZINC000130738935 344225373 /nfs/dbraw/zinc/22/53/73/344225373.db2.gz SWWCGZJOQRVZFE-GOEBONIOSA-N 2 0 246.398 2.467 20 0 BEADRP Cc1ccsc1C[NH2+]CC1CC[NH2+]CC1 ZINC000040720695 344245246 /nfs/dbraw/zinc/24/52/46/344245246.db2.gz YDMRZTHHDUSQLS-UHFFFAOYSA-N 2 0 224.373 2.146 20 0 BEADRP C[C@@H]1C[C@H]([NH3+])CN1Cc1cnc2ccccc2c1 ZINC000385066255 344314177 /nfs/dbraw/zinc/31/41/77/344314177.db2.gz GQYYELGVECCJTM-RISCZKNCSA-N 2 0 241.338 2.156 20 0 BEADRP C[C@@H]1C[C@@H]([NH3+])CN1Cc1cnc2ccccc2c1 ZINC000385066253 344314257 /nfs/dbraw/zinc/31/42/57/344314257.db2.gz GQYYELGVECCJTM-BXUZGUMPSA-N 2 0 241.338 2.156 20 0 BEADRP CCC[C@H](C)[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000132417346 344302053 /nfs/dbraw/zinc/30/20/53/344302053.db2.gz MUAWYPUPNOEPCQ-YNEHKIRRSA-N 2 0 210.365 2.391 20 0 BEADRP c1ccc(C[N@@H+]2CC[C@H]3C[NH2+]CC[C@H]3C2)cc1 ZINC000101750521 344425058 /nfs/dbraw/zinc/42/50/58/344425058.db2.gz HMEQPPDSBRYYKW-GJZGRUSLSA-N 2 0 230.355 2.118 20 0 BEADRP CC[C@H]([NH2+]CCc1ccccc1)[C@@H]1CCC[NH2+]1 ZINC000145760618 344368932 /nfs/dbraw/zinc/36/89/32/344368932.db2.gz FLTAMTAKWJLKNG-GJZGRUSLSA-N 2 0 232.371 2.349 20 0 BEADRP CCc1ccc(CN2C[C@@H]([NH3+])C[C@@H]2C)cc1 ZINC000385200168 344376627 /nfs/dbraw/zinc/37/66/27/344376627.db2.gz QYHMDURVEVIISZ-FZMZJTMJSA-N 2 0 218.344 2.171 20 0 BEADRP C[C@@H](C[NH2+]C1CC[NH2+]CC1)c1ccc(F)cc1 ZINC000215653949 344392748 /nfs/dbraw/zinc/39/27/48/344392748.db2.gz IBXGYPALLSACIH-NSHDSACASA-N 2 0 236.334 2.271 20 0 BEADRP CC(C)C[N@H+](CCC[NH3+])CC1CCCC1 ZINC000043417571 344501681 /nfs/dbraw/zinc/50/16/81/344501681.db2.gz RWXYOHFOCUDCND-UHFFFAOYSA-N 2 0 212.381 2.483 20 0 BEADRP C[N@H+](CCC1CC[NH2+]CC1)CC(C)(C)C ZINC000045074292 344555787 /nfs/dbraw/zinc/55/57/87/344555787.db2.gz AZOFTZHCUBHECZ-UHFFFAOYSA-N 2 0 212.381 2.354 20 0 BEADRP Cc1ccc(C)c(C[N@H+](C)CCC[NH3+])c1 ZINC000049256635 344601298 /nfs/dbraw/zinc/60/12/98/344601298.db2.gz WIOSHHQATYMTRE-UHFFFAOYSA-N 2 0 206.333 2.084 20 0 BEADRP Cc1ccsc1C[NH2+][C@@H](C)CC[NH+](C)C ZINC000049551913 344652761 /nfs/dbraw/zinc/65/27/61/344652761.db2.gz RYWISOCYCVQZEU-NSHDSACASA-N 2 0 226.389 2.486 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+][C@@H](C)CC[NH+](C)C ZINC000049553674 344653186 /nfs/dbraw/zinc/65/31/86/344653186.db2.gz ZSKOACMGGWVAJB-SRVKXCTJSA-N 2 0 200.370 2.351 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+]C[C@@H]1CC=CCC1 ZINC000049553549 344653254 /nfs/dbraw/zinc/65/32/54/344653254.db2.gz ZMLBAOYXPHHSGY-QWHCGFSZSA-N 2 0 210.365 2.273 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H]1[C@H](C)O[C@H](C)[C@H]1C ZINC000625975926 344640397 /nfs/dbraw/zinc/64/03/97/344640397.db2.gz FRCUZDVTUIUZNZ-MQYQWHSLSA-N 2 0 242.407 2.120 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000569616295 344683497 /nfs/dbraw/zinc/68/34/97/344683497.db2.gz QRIDRUZBTQCGNC-VHDGCEQUSA-N 2 0 236.403 2.495 20 0 BEADRP CSC[C@@H]1CCC[N@@H+]1CC[C@H]1CCC[NH2+]C1 ZINC000399997684 344748694 /nfs/dbraw/zinc/74/86/94/344748694.db2.gz LJDNHOMCPUFNNE-OLZOCXBDSA-N 2 0 242.432 2.204 20 0 BEADRP CSC[C@H]1CCC[N@@H+]1CCC1CC[NH2+]CC1 ZINC000399993728 344748711 /nfs/dbraw/zinc/74/87/11/344748711.db2.gz IGLCTYRAPREGHQ-CYBMUJFWSA-N 2 0 242.432 2.204 20 0 BEADRP CSC1(C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)CCC1 ZINC000235118653 344802106 /nfs/dbraw/zinc/80/21/06/344802106.db2.gz NIZILLLCRWFDHJ-MNOVXSKESA-N 2 0 228.405 2.132 20 0 BEADRP C[NH+]1CCC(C[NH2+]CC2(C)CCC2)CC1 ZINC000234311576 537865225 /nfs/dbraw/zinc/86/52/25/537865225.db2.gz UHHISSHNRNIVIK-UHFFFAOYSA-N 2 0 210.365 2.108 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH2+]CC2(C)CCC2)C1 ZINC000234336205 537866283 /nfs/dbraw/zinc/86/62/83/537866283.db2.gz YGSRHMSNRNWKAO-LBPRGKRZSA-N 2 0 210.365 2.108 20 0 BEADRP CCOCCCC[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000339076106 537872382 /nfs/dbraw/zinc/87/23/82/537872382.db2.gz SFEZTFSMGHFBTK-KBPBESRZSA-N 2 0 240.391 2.020 20 0 BEADRP Cc1ccc([C@H](C)C[N@H+]2C[C@H]3C[NH2+]C[C@H]3C2)cc1 ZINC000628191881 344946599 /nfs/dbraw/zinc/94/65/99/344946599.db2.gz YGSYAXSUPOHCLI-BMFZPTHFSA-N 2 0 244.382 2.250 20 0 BEADRP [NH3+]C[C@@H]1CC[C@H]([NH2+]Cc2ccc(F)cc2F)C1 ZINC000583428570 344947013 /nfs/dbraw/zinc/94/70/13/344947013.db2.gz GSARZHMAHIBHAP-SKDRFNHKSA-N 2 0 240.297 2.182 20 0 BEADRP CC(C)=CC[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C)C1 ZINC000248008061 345012843 /nfs/dbraw/zinc/01/28/43/345012843.db2.gz KZTPLPXCGNGXHF-UONOGXRCSA-N 2 0 222.376 2.369 20 0 BEADRP C([NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)C1CCCC1 ZINC000155845854 345106265 /nfs/dbraw/zinc/10/62/65/345106265.db2.gz YYUPDPZZLUYRJG-UONOGXRCSA-N 2 0 222.376 2.393 20 0 BEADRP CCC(CC)(CC)[NH2+]CC12CC(C1)C[NH2+]2 ZINC000634993421 345190531 /nfs/dbraw/zinc/19/05/31/345190531.db2.gz UIRHXOFHFROTHH-UHFFFAOYSA-N 2 0 210.365 2.297 20 0 BEADRP CC(C)[C@@H](C[NH3+])C[NH2+]Cc1ccc([C@@H](C)[NH3+])cc1 ZINC000634994403 345181950 /nfs/dbraw/zinc/18/19/50/345181950.db2.gz BOPUEJDOSFZMHT-DOMZBBRYSA-N 3 0 249.402 2.027 20 0 BEADRP C1=CC[C@H]([NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)CC1 ZINC000156130008 345130111 /nfs/dbraw/zinc/13/01/11/345130111.db2.gz BDPAISBURWTYQS-MJBXVCDLSA-N 2 0 220.360 2.312 20 0 BEADRP C1=CC[C@H]([NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)CC1 ZINC000156130137 345130345 /nfs/dbraw/zinc/13/03/45/345130345.db2.gz BDPAISBURWTYQS-MELADBBJSA-N 2 0 220.360 2.312 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCCCS2)CC[N@@H+]1C ZINC000156157480 345133905 /nfs/dbraw/zinc/13/39/05/345133905.db2.gz OGCPYAHJXZQHBB-UPJWGTAASA-N 2 0 242.432 2.344 20 0 BEADRP C([N@@H+]1CC[C@@H]2CCCC[C@@H]21)C12CC(C1)C[NH2+]2 ZINC000634996582 345188788 /nfs/dbraw/zinc/18/87/88/345188788.db2.gz OKLIKUTZCGTWIJ-QPPOZKHWSA-N 2 0 220.360 2.003 20 0 BEADRP C[C@@H]1CCCC[C@]1(C)[NH2+]CC12CC(C1)C[NH2+]2 ZINC000634996575 345188805 /nfs/dbraw/zinc/18/88/05/345188805.db2.gz OERJCNYONGASKY-ZIHBUVQPSA-N 2 0 222.376 2.297 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@@H]2CCCC23CC3)C1 ZINC000634997013 345194241 /nfs/dbraw/zinc/19/42/41/345194241.db2.gz BCVLGXNBMHOFKJ-IJLUTSLNSA-N 2 0 208.349 2.179 20 0 BEADRP C[C@H](C[C@H]1CCC[NH2+]1)[NH2+][C@H]1CCCC12CC2 ZINC000634997612 345197280 /nfs/dbraw/zinc/19/72/80/345197280.db2.gz OZHRGDSBCCWAAX-UPJWGTAASA-N 2 0 222.376 2.439 20 0 BEADRP CC(C)C[C@H]([NH3+])C[NH2+][C@]12C[C@H]1CCCC2 ZINC000635001287 345197322 /nfs/dbraw/zinc/19/73/22/345197322.db2.gz MYURTFBZYIGUGK-FRRDWIJNSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)(C)[NH2+]CC[NH2+][C@H]1CCCC12CC2 ZINC000634999224 345199418 /nfs/dbraw/zinc/19/94/18/345199418.db2.gz RJGSMWAKPNHQIE-NSHDSACASA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1C[C@H](C[NH2+][C@H]2CCCC23CC3)CC[NH2+]1 ZINC000634999317 345199562 /nfs/dbraw/zinc/19/95/62/345199562.db2.gz SGKZSBSZJVTOND-UPJWGTAASA-N 2 0 222.376 2.297 20 0 BEADRP Cc1ccsc1C[N@H+]1C[C@H](C)[C@H](C[NH3+])C1 ZINC000634999744 345200471 /nfs/dbraw/zinc/20/04/71/345200471.db2.gz YNWZGCQEXRIFHS-WDEREUQCSA-N 2 0 224.373 2.083 20 0 BEADRP CCOc1ccccc1C[N@H+]1C[C@@H](C[NH3+])[C@H](C)C1 ZINC000635000504 345202166 /nfs/dbraw/zinc/20/21/66/345202166.db2.gz PSMVAUYCAWYXCW-TZMCWYRMSA-N 2 0 248.370 2.112 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCCC12CC2)[C@H]1CCC[NH2+]1 ZINC000635004147 345207057 /nfs/dbraw/zinc/20/70/57/345207057.db2.gz NIZKQMVSGFFRPZ-UTUOFQBUSA-N 2 0 208.349 2.049 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[NH2+]CC(C)(C)C1)[C@H]1C[C@H]1C ZINC000635004762 345208309 /nfs/dbraw/zinc/20/83/09/345208309.db2.gz DXGHRNMIGISELR-NDBYEHHHSA-N 2 0 224.392 2.399 20 0 BEADRP [NH3+]C[C@H]1CC[C@H]([NH2+][C@H]2CCC23CCC3)CC1 ZINC000635004651 345208342 /nfs/dbraw/zinc/20/83/42/345208342.db2.gz JPYRBLDJPCUFOZ-AVGNSLFASA-N 2 0 222.376 2.426 20 0 BEADRP CO[C@H]1CCC[C@H]([NH2+][C@H]2CC[C@H](C[NH3+])CC2)C1 ZINC000635006904 345211195 /nfs/dbraw/zinc/21/11/95/345211195.db2.gz ULOHTKZCUWSZDC-XUXIUFHCSA-N 2 0 240.391 2.051 20 0 BEADRP CO[C@@H]1CCC[C@H]([NH2+][C@H]2CC[C@H](C[NH3+])CC2)C1 ZINC000635006903 345211499 /nfs/dbraw/zinc/21/14/99/345211499.db2.gz ULOHTKZCUWSZDC-XDQVBPFNSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[NH2+]CC(C)(C)C1)C1CC1 ZINC000635011118 345212660 /nfs/dbraw/zinc/21/26/60/345212660.db2.gz MHBATPVWVMNCNK-CMPLNLGQSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)[C@@H](C)[NH2+]Cc1cccc2c1CC[NH2+]C2 ZINC000635012565 345214169 /nfs/dbraw/zinc/21/41/69/345214169.db2.gz WJCHVXSJMMDQMF-GFCCVEGCSA-N 2 0 232.371 2.466 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CC[NH2+]CC(C)(C)C2)[C@@H]1C ZINC000635012812 345215065 /nfs/dbraw/zinc/21/50/65/345215065.db2.gz VRALVHLNUMUFHX-NDBYEHHHSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[NH2+]CC(C)(C)C2)[C@@H]1C ZINC000635012811 345215315 /nfs/dbraw/zinc/21/53/15/345215315.db2.gz VRALVHLNUMUFHX-LPWJVIDDSA-N 2 0 224.392 2.399 20 0 BEADRP CSCCC[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C)C1 ZINC000158475932 345337908 /nfs/dbraw/zinc/33/79/08/345337908.db2.gz HQCHMDAGYCLRQX-STQMWFEESA-N 2 0 242.432 2.156 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@H](C)CC2CC2)CC1 ZINC000133287451 345368170 /nfs/dbraw/zinc/36/81/70/345368170.db2.gz SHSULJMXESIBDO-GFCCVEGCSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1c[nH+]ccc1N[C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000158367920 345326846 /nfs/dbraw/zinc/32/68/46/345326846.db2.gz QREUCTWCOMPDIR-CHWSQXEVSA-N 2 0 231.343 2.429 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]CC1(C2CC2)CCC1 ZINC000090724227 345575672 /nfs/dbraw/zinc/57/56/72/345575672.db2.gz JWINGNHVDHBKRN-OCCSQVGLSA-N 2 0 236.403 2.497 20 0 BEADRP CSc1ccc(C[NH2+]CCCC[NH+](C)C)o1 ZINC000641713098 362625354 /nfs/dbraw/zinc/62/53/54/362625354.db2.gz PRFZCQBTEDSJMW-UHFFFAOYSA-N 2 0 242.388 2.433 20 0 BEADRP CC[C@@H](C)[C@@H](C)[NH2+]CC1(COC)CC[NH2+]CC1 ZINC000319102835 259384742 /nfs/dbraw/zinc/38/47/42/259384742.db2.gz FJSOOYFTZHBRFO-CHWSQXEVSA-N 2 0 242.407 2.027 20 0 BEADRP CC[C@@H](C)[C@@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000319126692 259385065 /nfs/dbraw/zinc/38/50/65/259385065.db2.gz IMYXSYMNJDYXAH-PNKOWGENSA-N 2 0 210.365 2.294 20 0 BEADRP C[C@H](C[N@@H+]1C[C@H](C[NH3+])C[C@H]1C)c1ccccc1 ZINC000216056290 345743725 /nfs/dbraw/zinc/74/37/25/345743725.db2.gz VKIQLAPYQKBGDH-MCIONIFRSA-N 2 0 232.371 2.459 20 0 BEADRP CC[C@H](C)[C@@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000319126690 259385034 /nfs/dbraw/zinc/38/50/34/259385034.db2.gz IMYXSYMNJDYXAH-KZKMVBDOSA-N 2 0 210.365 2.294 20 0 BEADRP C[C@@H]([NH2+]CCCC[NH+](C)C)C1CC(F)(F)C1 ZINC000628210117 345812592 /nfs/dbraw/zinc/81/25/92/345812592.db2.gz HCVYLUZVQALTDM-SNVBAGLBSA-N 2 0 234.334 2.352 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@H]2CC[C@H](C)C2)CC1 ZINC000070643700 345793432 /nfs/dbraw/zinc/79/34/32/345793432.db2.gz FDRPFUJCLLNMHL-JSGCOSHPSA-N 2 0 224.392 2.497 20 0 BEADRP CC1(C)C[C@@H]1C[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000300358574 345852904 /nfs/dbraw/zinc/85/29/04/345852904.db2.gz IPVXRFFYDJXAEH-AGIUHOORSA-N 2 0 222.376 2.249 20 0 BEADRP C[NH+](C)C1CC[NH+](CC2CCCC2)CC1 ZINC000202466192 346070813 /nfs/dbraw/zinc/07/08/13/346070813.db2.gz HLUQOXSUWBZSLD-UHFFFAOYSA-N 2 0 210.365 2.203 20 0 BEADRP Cc1ccccc1[C@@H](C)[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC000090320068 537956776 /nfs/dbraw/zinc/95/67/76/537956776.db2.gz NZDSDZBHTWOTNB-MCIONIFRSA-N 2 0 230.355 2.207 20 0 BEADRP Cc1cccc(C)c1CN1C[C@@H]2CCC[NH2+][C@@H]2C1 ZINC000221388133 179035014 /nfs/dbraw/zinc/03/50/14/179035014.db2.gz HDVBUHSGRUAXCF-GOEBONIOSA-N 2 0 244.382 2.487 20 0 BEADRP CC(C)C[NH2+]C[C@H](C)N1CCCC[C@H]1C ZINC000052378552 346321675 /nfs/dbraw/zinc/32/16/75/346321675.db2.gz IKMDKKJRPXPMIM-OLZOCXBDSA-N 2 0 212.381 2.495 20 0 BEADRP C[C@@H]1CCC[N@H+](C[C@H]2CCCC[NH2+]C2)[C@H]1C ZINC000669378554 537969390 /nfs/dbraw/zinc/96/93/90/537969390.db2.gz GODLHYWPBQHANE-RDBSUJKOSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1cccc(CC[NH2+][C@H](C)CCC[NH3+])c1 ZINC000336653322 179059835 /nfs/dbraw/zinc/05/98/35/179059835.db2.gz JIKFNUUAQKRPPY-CYBMUJFWSA-N 2 0 220.360 2.255 20 0 BEADRP Cc1cccc(CC[NH2+][C@@H](C)CCC[NH3+])c1 ZINC000336653328 179058431 /nfs/dbraw/zinc/05/84/31/179058431.db2.gz JIKFNUUAQKRPPY-ZDUSSCGKSA-N 2 0 220.360 2.255 20 0 BEADRP C[C@H]([NH3+])c1ccc(N[C@@H]2CCC[C@H]([NH3+])C2)cc1 ZINC000574927208 346415859 /nfs/dbraw/zinc/41/58/59/346415859.db2.gz AABRFTRHNPCYQS-VHRBIJSZSA-N 2 0 233.359 2.388 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCC[C@H]([NH3+])C1)c1nccs1 ZINC000300361827 346432189 /nfs/dbraw/zinc/43/21/89/346432189.db2.gz IQMFYHCVYKACOW-VWYCJHECSA-N 2 0 239.388 2.106 20 0 BEADRP Cc1ccc(CN(C)[C@H]2CC[N@H+](C)[C@@H](C)C2)nc1 ZINC000334175558 346438765 /nfs/dbraw/zinc/43/87/65/346438765.db2.gz CJKZYYYVKLFKEJ-ZFWWWQNUSA-N 2 0 247.386 2.305 20 0 BEADRP Cc1cccc(C[NH2+][C@@H]2CCN(C3CC3)C2)c1 ZINC000044683891 179097160 /nfs/dbraw/zinc/09/71/60/179097160.db2.gz SBXPIZKAGXWCJG-CQSZACIVSA-N 2 0 230.355 2.321 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H]2C[C@H]([NH3+])C2(C)C)cc1 ZINC000641802610 362755145 /nfs/dbraw/zinc/75/51/45/362755145.db2.gz NRLCTDJBUFCHLZ-UONOGXRCSA-N 2 0 232.371 2.253 20 0 BEADRP CO[C@H](C[NH2+][C@H]1C[C@H]([NH3+])C1(C)C)c1ccccc1 ZINC000641801103 362755397 /nfs/dbraw/zinc/75/53/97/362755397.db2.gz NBYMOGMNNLOWQI-RDBSUJKOSA-N 2 0 248.370 2.090 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2C[C@H]([NH3+])C2(C)C)cc1F ZINC000641801789 362756118 /nfs/dbraw/zinc/75/61/18/362756118.db2.gz VQPOUHTZYJORFB-QWHCGFSZSA-N 2 0 236.334 2.350 20 0 BEADRP CC1(C)[C@H]([NH2+]CCCC2CCC2)C[C@@H]1[NH3+] ZINC000641802165 362758144 /nfs/dbraw/zinc/75/81/44/362758144.db2.gz YLBAULFOKHMPDH-NWDGAFQWSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1CC[C@H](CN)[N@H+](C[C@H]2CCCCO2)[C@@H]1C ZINC000641806334 362764365 /nfs/dbraw/zinc/76/43/65/362764365.db2.gz QOZWLPCQGAMIGS-AAVRWANBSA-N 2 0 240.391 2.003 20 0 BEADRP CC(C)C[C@H](C)C[N@@H+]1CC[C@H]([NH3+])C[C@H]1C ZINC000301012146 346566906 /nfs/dbraw/zinc/56/69/06/346566906.db2.gz YZIPOXSYKJSEMR-XQQFMLRXSA-N 2 0 212.381 2.480 20 0 BEADRP CC[NH+](CC)CCCSCC1CC[NH2+]CC1 ZINC000577175700 365858654 /nfs/dbraw/zinc/85/86/54/365858654.db2.gz HIKGOWGURMKCNE-UHFFFAOYSA-N 2 0 244.448 2.451 20 0 BEADRP C[C@@H](c1ccccc1)[N@@H+]1C[C@@H](C[NH3+])C[C@H]1C ZINC000252699705 346780677 /nfs/dbraw/zinc/78/06/77/346780677.db2.gz VTIFYBOKHPLFSV-FRRDWIJNSA-N 2 0 218.344 2.417 20 0 BEADRP C[C@H](Cc1ccsc1)[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000168737376 346742550 /nfs/dbraw/zinc/74/25/50/346742550.db2.gz IDHUHLLPSVGBJJ-DGCLKSJQSA-N 2 0 238.400 2.411 20 0 BEADRP CCCC[N@H+](CCCn1ccnc1)CCOC ZINC000182775426 347106505 /nfs/dbraw/zinc/10/65/05/347106505.db2.gz QOSPXZWHDAXKFJ-UHFFFAOYSA-N 2 0 239.363 2.022 20 0 BEADRP Cc1cccc(OCC[N@@H+]2CC[C@@H]([NH3+])[C@H](C)C2)c1 ZINC000042896878 179165551 /nfs/dbraw/zinc/16/55/51/179165551.db2.gz VMLPKQNOTQOUAZ-UKRRQHHQSA-N 2 0 248.370 2.043 20 0 BEADRP CCC(C)(C)[C@@H](C)[NH2+]CCC[N@H+](C)CCOC ZINC000582044731 347126249 /nfs/dbraw/zinc/12/62/49/347126249.db2.gz GKEGGHMFVITZCD-CYBMUJFWSA-N 2 0 244.423 2.369 20 0 BEADRP CC[NH+]1CCC([NH2+]CCC2(F)CCC2)CC1 ZINC000309643955 347129313 /nfs/dbraw/zinc/12/93/13/347129313.db2.gz LOGUIVMVRHYYKH-UHFFFAOYSA-N 2 0 228.355 2.343 20 0 BEADRP Cc1cccc([C@H](C)N2CCC[C@H]([NH3+])C2)c1 ZINC000041046881 179192711 /nfs/dbraw/zinc/19/27/11/179192711.db2.gz JCYOGLULNHMTGV-JSGCOSHPSA-N 2 0 218.344 2.479 20 0 BEADRP Cc1cccc([C@H](C)N2CCC[NH2+]CC2)c1 ZINC000022101210 179193370 /nfs/dbraw/zinc/19/33/70/179193370.db2.gz KNFNMFICEFUASK-ZDUSSCGKSA-N 2 0 218.344 2.351 20 0 BEADRP C(C[NH+]1C[C@@H]2C[NH2+]C[C@H]2C1)C1CCCCC1 ZINC000085734156 347240507 /nfs/dbraw/zinc/24/05/07/347240507.db2.gz JPLCKFBXJXXXFV-KBPBESRZSA-N 2 0 222.376 2.108 20 0 BEADRP Cc1cccc([C@H](C)[N@@H+]2CC[C@H](C[NH3+])C2)c1 ZINC000050245513 179195169 /nfs/dbraw/zinc/19/51/69/179195169.db2.gz UQMWVBRNPKQUTF-QWHCGFSZSA-N 2 0 218.344 2.337 20 0 BEADRP Cc1cccc([C@H](C)[NH2+][C@@H]2CCN(C)C2)c1 ZINC000042545810 179196426 /nfs/dbraw/zinc/19/64/26/179196426.db2.gz RCKBNSQSWSVBMR-GXTWGEPZSA-N 2 0 218.344 2.350 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+][C@@H]1CC[NH2+]C[C@H]1C ZINC000310484323 347289664 /nfs/dbraw/zinc/28/96/64/347289664.db2.gz DOKFLBYXWIJWGP-YRGRVCCFSA-N 2 0 236.359 2.188 20 0 BEADRP Cc1ncc(C[NH2+]C(C)(C)CCC[NH+](C)C)o1 ZINC000628299581 347427820 /nfs/dbraw/zinc/42/78/20/347427820.db2.gz TUMBHGRKGMERGF-UHFFFAOYSA-N 2 0 239.363 2.193 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CC(C1CC1)C1CC1 ZINC000577214319 365884299 /nfs/dbraw/zinc/88/42/99/365884299.db2.gz AYZXYHNWBWRCOL-NXEZZACHSA-N 2 0 210.365 2.138 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@@H](C)[C@@H]1CCCOC1 ZINC000356877080 187377036 /nfs/dbraw/zinc/37/70/36/187377036.db2.gz RVNCSHIRFXTCBH-UONOGXRCSA-N 2 0 242.407 2.121 20 0 BEADRP CC[NH+]1CCC([NH2+]CC2(C(F)F)CC2)CC1 ZINC000336771271 347462434 /nfs/dbraw/zinc/46/24/34/347462434.db2.gz UJDVSKHXZRSQAH-UHFFFAOYSA-N 2 0 232.318 2.106 20 0 BEADRP Cc1nc(C)c([C@@H](C)[NH2+]C[C@@H](C)C[NH3+])s1 ZINC000054345893 347770968 /nfs/dbraw/zinc/77/09/68/347770968.db2.gz YSEXKBLJRHFAAW-JGVFFNPUSA-N 2 0 227.377 2.005 20 0 BEADRP Cc1ccccc1C[C@H](C)[NH2+][C@@H]1CN(C)C[C@H]1C ZINC000358002521 179290709 /nfs/dbraw/zinc/29/07/09/179290709.db2.gz GHYJWQNQQKIGBZ-IJEWVQPXSA-N 2 0 246.398 2.466 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]C[C@@H]1CCCC1(F)F ZINC000390713876 259398613 /nfs/dbraw/zinc/39/86/13/259398613.db2.gz XMCALPCWNSEMOT-ZJUUUORDSA-N 2 0 220.307 2.139 20 0 BEADRP Cc1ccccc1[C@@H](C)NC[C@H]1CCC[NH2+]1 ZINC000235213512 179321686 /nfs/dbraw/zinc/32/16/86/179321686.db2.gz GPOMRGYMJMZDEP-CHWSQXEVSA-N 2 0 218.344 2.398 20 0 BEADRP Cc1ccccc1[C@H]1CCC[N@H+]1C[C@@H](C)[NH3+] ZINC000336405948 179347755 /nfs/dbraw/zinc/34/77/55/179347755.db2.gz DSLRHJMTZVLHKH-TZMCWYRMSA-N 2 0 218.344 2.479 20 0 BEADRP Cc1cccnc1C[N@@H+]1CCCC[C@@H]1CC[NH3+] ZINC000161853713 179372058 /nfs/dbraw/zinc/37/20/58/179372058.db2.gz XOPUJGVGOXSFQW-CYBMUJFWSA-N 2 0 233.359 2.093 20 0 BEADRP CC(C)C[C@@H](CN(C)C)[NH2+][C@H](C)CCCC[NH3+] ZINC000336692492 187393273 /nfs/dbraw/zinc/39/32/73/187393273.db2.gz HUZKCMUFBBYMAW-KGLIPLIRSA-N 2 0 243.439 2.070 20 0 BEADRP CC(C)[C@@H]1CC[C@H]([NH2+]CCC[NH3+])C[C@H]1C ZINC000336688767 187393322 /nfs/dbraw/zinc/39/33/22/187393322.db2.gz VUZUNMYFUOZYDT-AGIUHOORSA-N 2 0 212.381 2.386 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+][C@@H]2CCCOCC2)CC1(C)C ZINC000623484837 362908950 /nfs/dbraw/zinc/90/89/50/362908950.db2.gz DKNBOTCNWXWLQW-CHWSQXEVSA-N 2 0 240.391 2.018 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@H]2CCCOCC2)CC1(C)C ZINC000623484840 362909260 /nfs/dbraw/zinc/90/92/60/362909260.db2.gz DKNBOTCNWXWLQW-STQMWFEESA-N 2 0 240.391 2.018 20 0 BEADRP C1CC2(C1)C[C@@H]([NH2+]C1CCCC1)CC[NH2+]2 ZINC000129779442 490169062 /nfs/dbraw/zinc/16/90/62/490169062.db2.gz RCEMGCWLUQAWRP-LBPRGKRZSA-N 2 0 208.349 2.193 20 0 BEADRP CCSC1(C[NH2+][C@H]2CC[NH2+]CC[C@H]2C)CC1 ZINC000596650116 348605241 /nfs/dbraw/zinc/60/52/41/348605241.db2.gz GURNUVWSIHAHOM-NEPJUHHUSA-N 2 0 242.432 2.250 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CC[C@H]([NH3+])C1)c1ccccc1 ZINC000669384881 538018260 /nfs/dbraw/zinc/01/82/60/538018260.db2.gz LHTDYTSJARXWOS-SCRDCRAPSA-N 2 0 218.344 2.465 20 0 BEADRP Cc1c[nH+]ccc1NC1CCC([NH3+])CC1 ZINC000070046079 179711451 /nfs/dbraw/zinc/71/14/51/179711451.db2.gz HZEXDESTQVCWHV-UHFFFAOYSA-N 2 0 205.305 2.072 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C[C@@H]2CCSC2)CC1(C)C ZINC000623509999 362935659 /nfs/dbraw/zinc/93/56/59/362935659.db2.gz BJPLQZVDMYWHDQ-RYUDHWBXSA-N 2 0 242.432 2.202 20 0 BEADRP CSC[C@@H](C)[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC000598965325 349068751 /nfs/dbraw/zinc/06/87/51/349068751.db2.gz XZFGIMGPBLHBSB-GHMZBOCLSA-N 2 0 230.421 2.200 20 0 BEADRP CSCCC[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1 ZINC000598962972 349068082 /nfs/dbraw/zinc/06/80/82/349068082.db2.gz DYYMJOMLTRVLSY-NSHDSACASA-N 2 0 230.421 2.202 20 0 BEADRP COC1([C@@H](C)[NH2+]CCC[NH+](C)C)CCCCC1 ZINC000421804923 192384383 /nfs/dbraw/zinc/38/43/83/192384383.db2.gz VFRBDQLABAFSFS-CYBMUJFWSA-N 2 0 242.407 2.266 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+][C@H]2CSC2(C)C)CC1(C)C ZINC000623516293 362940658 /nfs/dbraw/zinc/94/06/58/362940658.db2.gz LVMNBSJQJPTDOK-MNOVXSKESA-N 2 0 242.432 2.343 20 0 BEADRP CCc1ccc(C[N@@H+]2C[C@H](C[NH3+])C[C@H]2C)s1 ZINC000250453238 349171173 /nfs/dbraw/zinc/17/11/73/349171173.db2.gz ZVZJRIJMNSQSRI-MNOVXSKESA-N 2 0 238.400 2.480 20 0 BEADRP CC(C)[C@@H]([NH2+][C@@H]1CC[NH2+]C12CCC2)C1CC1 ZINC000530225899 323219137 /nfs/dbraw/zinc/21/91/37/323219137.db2.gz XZJLQYZVELGMEI-CHWSQXEVSA-N 2 0 222.376 2.295 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+]CC1CC[NH2+]CC1 ZINC000388633900 349279226 /nfs/dbraw/zinc/27/92/26/349279226.db2.gz LWKTZYDLVDBDGJ-OLZOCXBDSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1CC[C@H]1[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623524324 362945018 /nfs/dbraw/zinc/94/50/18/362945018.db2.gz OASJFEAYKRVBPG-GRYCIOLGSA-N 2 0 210.365 2.247 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+][C@H](C)C1CC[NH+](C)CC1 ZINC000388027487 490262676 /nfs/dbraw/zinc/26/26/76/490262676.db2.gz PHHIVMVFXCASNC-BZPMIXESSA-N 2 0 224.392 2.352 20 0 BEADRP CSC1CC[NH+](CC[C@@H]2CCC[NH2+]C2)CC1 ZINC000300868094 349381910 /nfs/dbraw/zinc/38/19/10/349381910.db2.gz QGLYKNLUQJOAAX-LBPRGKRZSA-N 2 0 242.432 2.204 20 0 BEADRP C(=C\c1ccccc1)\C[NH2+]C1CC[NH2+]CC1 ZINC000144218324 350015667 /nfs/dbraw/zinc/01/56/67/350015667.db2.gz BTFILKAVYSWTML-DAXSKMNVSA-N 2 0 216.328 2.041 20 0 BEADRP CCc1nc(C)c(C[NH2+][C@@H](C)CCCC[NH3+])o1 ZINC000311852918 350042603 /nfs/dbraw/zinc/04/26/03/350042603.db2.gz PXRDIGZDHWHJCS-JTQLQIEISA-N 2 0 239.363 2.153 20 0 BEADRP CCc1ccc(C[N@@H+]2CC[C@@H](C[NH2+]C)C2)s1 ZINC000070798693 350059130 /nfs/dbraw/zinc/05/91/30/350059130.db2.gz WWQBRUGKYWUHCU-NSHDSACASA-N 2 0 238.400 2.352 20 0 BEADRP C[N@H+](CCC[NH2+]C1CSC1)C1CCCCC1 ZINC000390549790 538048620 /nfs/dbraw/zinc/04/86/20/538048620.db2.gz OHTNQASWUXMCJN-UHFFFAOYSA-N 2 0 242.432 2.346 20 0 BEADRP CC(C)C[NH2+]C(C)(C)CCC[NH+](C)C ZINC000395679926 323237125 /nfs/dbraw/zinc/23/71/25/323237125.db2.gz STHZOPUWTZMLQP-UHFFFAOYSA-N 2 0 200.370 2.352 20 0 BEADRP Cc1nc([C@H](C)[NH2+]C2CCC([NH3+])CC2)cs1 ZINC000051694000 180049299 /nfs/dbraw/zinc/04/92/99/180049299.db2.gz GPGIYESHMIAEAT-PUSIOWJLSA-N 2 0 239.388 2.372 20 0 BEADRP CC(C)[C@@H]1CCC[C@@H]([NH2+][C@@H](C)C2C[NH2+]C2)C1 ZINC000422722238 192442018 /nfs/dbraw/zinc/44/20/18/192442018.db2.gz XHLVEIOHEXDYKY-OUCADQQQSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@H]2CCC[C@H]3C[C@H]32)CCN1C ZINC000304424140 350155907 /nfs/dbraw/zinc/15/59/07/350155907.db2.gz AHHRONQSITVESW-HTOAHKCRSA-N 2 0 222.376 2.247 20 0 BEADRP C[C@@H]([NH2+]CCC[NH+]1CCCC1)C(C)(C)C ZINC000133301268 191039417 /nfs/dbraw/zinc/03/94/17/191039417.db2.gz RYKBVKJKPROCGI-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP Cc1nccc(NC[C@H](C)[N@@H+]2CCC[C@H](C)C2)n1 ZINC000266190671 180201337 /nfs/dbraw/zinc/20/13/37/180201337.db2.gz BTMHVRGPQNQWKH-RYUDHWBXSA-N 2 0 248.374 2.317 20 0 BEADRP CSCCCC[NH2+][C@@H]1CCCCC[C@@H]1[NH3+] ZINC000422754428 192454955 /nfs/dbraw/zinc/45/49/55/192454955.db2.gz JOTUEVUACKETMW-NWDGAFQWSA-N 2 0 230.421 2.379 20 0 BEADRP C[C@@H]1C[C@@H]1c1ccc(CN2C[C@@H]3C[NH2+]C[C@H]3C2)o1 ZINC000252218698 538086566 /nfs/dbraw/zinc/08/65/66/538086566.db2.gz ZUGDNDALWTXABJ-UHXUPSOCSA-N 2 0 246.354 2.054 20 0 BEADRP Cc1ccccc1C[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000422770624 192462068 /nfs/dbraw/zinc/46/20/68/192462068.db2.gz UYIRLGUQRYHJGZ-RYUDHWBXSA-N 2 0 206.333 2.210 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+][C@H](C2CC2)C2CCC2)C1 ZINC000324870986 350313330 /nfs/dbraw/zinc/31/33/30/350313330.db2.gz CBWGYTNFYJMDGI-DOMZBBRYSA-N 2 0 236.403 2.497 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+][C@@H](C2CC2)C2CCC2)C1 ZINC000324871787 350313394 /nfs/dbraw/zinc/31/33/94/350313394.db2.gz CBWGYTNFYJMDGI-IUODEOHRSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H](Cc1ccsc1)[NH2+][C@H]1CC[NH2+]C[C@@H]1C ZINC000309339125 350322717 /nfs/dbraw/zinc/32/27/17/350322717.db2.gz KHUMXFONCCFESO-LOWVWBTDSA-N 2 0 238.400 2.267 20 0 BEADRP C[C@H](Cc1ccsc1)[NH2+][C@@H]1CC[NH2+]C[C@@H]1C ZINC000309339124 350322795 /nfs/dbraw/zinc/32/27/95/350322795.db2.gz KHUMXFONCCFESO-DMDPSCGWSA-N 2 0 238.400 2.267 20 0 BEADRP CC(C)(CCO)C[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000227904909 191095983 /nfs/dbraw/zinc/09/59/83/191095983.db2.gz QBNPWQQSKLCIHN-UONOGXRCSA-N 2 0 248.370 2.129 20 0 BEADRP CC[C@@H]1CCC[N@@H+]1CC[C@H]1CCC[NH+]1C ZINC000336645794 350415540 /nfs/dbraw/zinc/41/55/40/350415540.db2.gz IYLMZJBEEUMYET-CHWSQXEVSA-N 2 0 210.365 2.345 20 0 BEADRP [NH3+]CCCC[NH2+][C@H]1CCCc2sccc21 ZINC000061328174 350510625 /nfs/dbraw/zinc/51/06/25/350510625.db2.gz YUGFPTBBDAPGHY-NSHDSACASA-N 2 0 224.373 2.454 20 0 BEADRP CCCCC[NH+]1CCC(CC[NH2+]C)CC1 ZINC000070188854 350512461 /nfs/dbraw/zinc/51/24/61/350512461.db2.gz LWABMGHYZPIEDP-UHFFFAOYSA-N 2 0 212.381 2.498 20 0 BEADRP CC[C@H](C[NH2+]CCC[NH2+]C)c1ccccc1 ZINC000163308371 350516889 /nfs/dbraw/zinc/51/68/89/350516889.db2.gz FQTZHEVQVMLYAP-CYBMUJFWSA-N 2 0 220.360 2.379 20 0 BEADRP CC1(C)CC[NH+](CC2CC[NH2+]CC2)CC1 ZINC000060313617 350498268 /nfs/dbraw/zinc/49/82/68/350498268.db2.gz AHEQHCGUTOFSRD-UHFFFAOYSA-N 2 0 210.365 2.108 20 0 BEADRP Cc1cc(C[NH2+]CCCC[N@@H+](C)C2CC2)ccn1 ZINC000623545011 362965735 /nfs/dbraw/zinc/96/57/35/362965735.db2.gz WYNQSTQNGWPICD-UHFFFAOYSA-N 2 0 247.386 2.354 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+]CC1=CC[NH2+]CC1 ZINC000577483027 365965461 /nfs/dbraw/zinc/96/54/61/365965461.db2.gz GGFZHIRJJQPLED-OLZOCXBDSA-N 2 0 208.349 2.074 20 0 BEADRP COCCN1CCC[C@H]1C[NH2+][C@@H](C)C(C)(C)C ZINC000163418832 350520570 /nfs/dbraw/zinc/52/05/70/350520570.db2.gz JZINZQZRHDMTCI-STQMWFEESA-N 2 0 242.407 2.121 20 0 BEADRP COCCN1CCC[C@H]1C[NH2+][C@H](C)C(C)(C)C ZINC000163418954 350521143 /nfs/dbraw/zinc/52/11/43/350521143.db2.gz JZINZQZRHDMTCI-OLZOCXBDSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+]CCC[NH2+]C1CC1 ZINC000382576733 350881221 /nfs/dbraw/zinc/88/12/21/350881221.db2.gz GNTVSXQZTFNTOA-GFCCVEGCSA-N 2 0 236.359 2.332 20 0 BEADRP C/C=C/C[NH2+]Cc1ccc(OCC[NH+](C)C)cc1 ZINC000623739079 350884252 /nfs/dbraw/zinc/88/42/52/350884252.db2.gz HRYOVOWNFOZSSD-SNAWJCMRSA-N 2 0 248.370 2.293 20 0 BEADRP Cc1cc(N[C@@H]2CCCC[C@@H]2C[NH3+])cc[nH+]1 ZINC000229576030 187472683 /nfs/dbraw/zinc/47/26/83/187472683.db2.gz QUIYZYGGVDKSGH-DGCLKSJQSA-N 2 0 219.332 2.319 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@@H](F)C1)[C@@H]1CCCC[NH2+]1 ZINC000577611605 366016948 /nfs/dbraw/zinc/01/69/48/366016948.db2.gz TWALEVYVDCCQEL-RNJOBUHISA-N 2 0 228.355 2.387 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CCCC2(C)C)C1 ZINC000086856769 351038204 /nfs/dbraw/zinc/03/82/04/351038204.db2.gz QNAAKZYHTIAQJO-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+]CCc2ccoc2)CC1(C)C ZINC000623569727 362998836 /nfs/dbraw/zinc/99/88/36/362998836.db2.gz VBTHMYXKIVCFGW-CYBMUJFWSA-N 2 0 236.359 2.285 20 0 BEADRP C[C@@H]1CC[C@@H](N(C)Cc2ccccc2)C[NH2+]1 ZINC000306987303 351404080 /nfs/dbraw/zinc/40/40/80/351404080.db2.gz YOHBDVNKHVUXCV-TZMCWYRMSA-N 2 0 218.344 2.259 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+]CCCC1CC1 ZINC000577740193 366049446 /nfs/dbraw/zinc/04/94/46/366049446.db2.gz NKPUCYADLDSTIU-AAEUAGOBSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC(C)(C)C[NH+](C)C)C[C@H](C)O1 ZINC000577815825 366068616 /nfs/dbraw/zinc/06/86/16/366068616.db2.gz XSQMHGSKXFGXHL-ITGUQSILSA-N 2 0 242.407 2.120 20 0 BEADRP CCC[C@H](C[N@H+](C)C[C@H]1CCC[NH+](C)C1)OC ZINC000637930616 351807054 /nfs/dbraw/zinc/80/70/54/351807054.db2.gz QGJLDQRSKIHSCS-UONOGXRCSA-N 2 0 242.407 2.075 20 0 BEADRP CCC[C@H](C[N@@H+]1CC[C@@H](C[NH+](C)CC)C1)OC ZINC000638131887 352001555 /nfs/dbraw/zinc/00/15/55/352001555.db2.gz FDSXJYKNRHGNFJ-UONOGXRCSA-N 2 0 242.407 2.075 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CC[NH2+]C1)[C@@H](C)c1ccccc1 ZINC000414899936 352174797 /nfs/dbraw/zinc/17/47/97/352174797.db2.gz CVPXMPBBNBEDCY-RDBSUJKOSA-N 2 0 232.371 2.378 20 0 BEADRP C[C@H](c1ccccc1)[C@H](C)[NH2+]C[C@H]1CC[NH2+]C1 ZINC000414899934 352175006 /nfs/dbraw/zinc/17/50/06/352175006.db2.gz CVPXMPBBNBEDCY-IHRRRGAJSA-N 2 0 232.371 2.378 20 0 BEADRP c1cn(CCCC[NH2+]C[C@@H]2C[C@H]3C[C@H]3C2)cn1 ZINC000638404652 352211394 /nfs/dbraw/zinc/21/13/94/352211394.db2.gz IOIAUKTZRWXGMQ-BTTYYORXSA-N 2 0 233.359 2.299 20 0 BEADRP CCC[C@@H](C[NH2+]C[C@@H]1CC[N@H+](CCC)C1)OC ZINC000638410035 352217326 /nfs/dbraw/zinc/21/73/26/352217326.db2.gz TYLJAJMWWOJSKD-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP CCC[C@H](C[NH2+]C[C@H]1CC[N@H+](CCC)C1)OC ZINC000638410038 352217487 /nfs/dbraw/zinc/21/74/87/352217487.db2.gz TYLJAJMWWOJSKD-ZIAGYGMSSA-N 2 0 242.407 2.123 20 0 BEADRP COC[C@@H](CC(C)C)[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000414919519 352281903 /nfs/dbraw/zinc/28/19/03/352281903.db2.gz XFOOTZBQZNHTGY-KGLIPLIRSA-N 2 0 242.407 2.027 20 0 BEADRP C(=C/c1ccccc1)\C[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000414919667 352282374 /nfs/dbraw/zinc/28/23/74/352282374.db2.gz VOHJJPQDTGBFIK-SGJXGLNRSA-N 2 0 230.355 2.432 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H]1CCCC[C@H]1OC ZINC000037211033 358470233 /nfs/dbraw/zinc/47/02/33/358470233.db2.gz MFJYQWWYRRLRNP-UONOGXRCSA-N 2 0 242.407 2.266 20 0 BEADRP Cc1cccc(C[NH2+]C[C@H]2CCC[N@@H+](C)C2)c1 ZINC000044535126 352351895 /nfs/dbraw/zinc/35/18/95/352351895.db2.gz SROFFZXXOCXQIP-OAHLLOKOSA-N 2 0 232.371 2.426 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+]C[C@@H](C)Cc1ccccc1 ZINC000414955722 352374687 /nfs/dbraw/zinc/37/46/87/352374687.db2.gz MRVXRXDONNOUPX-UONOGXRCSA-N 2 0 234.387 2.453 20 0 BEADRP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]CC12CCC(CC1)C2 ZINC000334259857 352871076 /nfs/dbraw/zinc/87/10/76/352871076.db2.gz RBLGVXXGRQXHMC-FGZQJIAISA-N 2 0 236.403 2.497 20 0 BEADRP CCC[NH+]1CCC([NH2+]C[C@@H]2C[C@H]3C[C@H]3C2)CC1 ZINC000638849105 353029147 /nfs/dbraw/zinc/02/91/47/353029147.db2.gz PVGLFTHDFXDZOZ-BTTYYORXSA-N 2 0 236.403 2.497 20 0 BEADRP Cn1cncc1CC[NH2+][C@@H]1CCC12CCCC2 ZINC000353274685 188060338 /nfs/dbraw/zinc/06/03/38/188060338.db2.gz JMYMXYOOHLCXFA-CYBMUJFWSA-N 2 0 233.359 2.275 20 0 BEADRP C[N@H+](CC1CC1)C[C@@H]1CC[NH+](CCCF)C1 ZINC000361529308 188071802 /nfs/dbraw/zinc/07/18/02/188071802.db2.gz DNBWJHJAFFKENV-ZDUSSCGKSA-N 2 0 228.355 2.010 20 0 BEADRP CC(C)C[C@@H](C)C[N@@H+]1CC[C@@]2(CC[NH2+]C2)C1 ZINC000304514174 188076659 /nfs/dbraw/zinc/07/66/59/188076659.db2.gz DSHXKISDGOSVPJ-ZIAGYGMSSA-N 2 0 224.392 2.354 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccccc2)C1 ZINC000044534111 188123482 /nfs/dbraw/zinc/12/34/82/188123482.db2.gz ACWIQGVZQNTNBK-AWEZNQCLSA-N 2 0 218.344 2.118 20 0 BEADRP CC(C)([NH2+]Cc1cnc[nH]1)c1ccccc1 ZINC000163809432 188160087 /nfs/dbraw/zinc/16/00/87/188160087.db2.gz HSDGCSGSOFASHE-UHFFFAOYSA-N 2 0 215.300 2.435 20 0 BEADRP CC(C)=CC[NH2+][C@@H]1CC[N@@H+](C)[C@H]2CCC[C@@H]21 ZINC000309453283 188168023 /nfs/dbraw/zinc/16/80/23/188168023.db2.gz LRSCGKMXJPJZFR-MCIONIFRSA-N 2 0 222.376 2.415 20 0 BEADRP CC(C)=CC[NH2+][C@@H]1CC[N@@H+](C)[C@@H]2CCC[C@@H]21 ZINC000309453285 188168742 /nfs/dbraw/zinc/16/87/42/188168742.db2.gz LRSCGKMXJPJZFR-MGPQQGTHSA-N 2 0 222.376 2.415 20 0 BEADRP CC(C)([NH3+])CNc1cc[nH+]c2ccccc12 ZINC000095936709 188147922 /nfs/dbraw/zinc/14/79/22/188147922.db2.gz AXSCDWMDNZVKDO-UHFFFAOYSA-N 2 0 215.300 2.384 20 0 BEADRP C([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)C1CCSCC1 ZINC000335019311 188180703 /nfs/dbraw/zinc/18/07/03/188180703.db2.gz NMCQHYVQIKAPQE-FUNVUKJBSA-N 2 0 240.416 2.002 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+]CCC1CC[NH+](C)CC1 ZINC000122078785 324025725 /nfs/dbraw/zinc/02/57/25/324025725.db2.gz WVFNHRHETGZGOS-OCCSQVGLSA-N 2 0 224.392 2.497 20 0 BEADRP CCO[C@@H]1C[C@@H]1[NH2+][C@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000563700104 353275254 /nfs/dbraw/zinc/27/52/54/353275254.db2.gz FQJLFMUTJZYHGI-ZOBORPQBSA-N 2 0 240.391 2.064 20 0 BEADRP CC[C@@H]1CCC[N@H+](CC2CC[NH2+]CC2)CC1 ZINC000070613549 353260416 /nfs/dbraw/zinc/26/04/16/353260416.db2.gz JYSATIXALATYNK-CYBMUJFWSA-N 2 0 224.392 2.498 20 0 BEADRP CC[C@@H]1CCC[N@H+](C[C@]2(C)CC[NH2+]C2)CC1 ZINC000070613872 353260619 /nfs/dbraw/zinc/26/06/19/353260619.db2.gz VCLMMGRARILWOS-ZIAGYGMSSA-N 2 0 224.392 2.498 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000336769186 353284352 /nfs/dbraw/zinc/28/43/52/353284352.db2.gz VIQWLZCMOKQWQJ-NEPJUHHUSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H](C[N@@H+]1CC[C@@H]([NH3+])[C@H](C)C1)c1ccccc1 ZINC000251791575 353288179 /nfs/dbraw/zinc/28/81/79/353288179.db2.gz NLMVPNGWBMQFEC-UMVBOHGHSA-N 2 0 232.371 2.459 20 0 BEADRP CC(C)(C)[C@H]1CC[N@H+](C[C@H]2CCC[NH2+]C2)C1 ZINC000252876160 353313207 /nfs/dbraw/zinc/31/32/07/353313207.db2.gz WCENZTRHPDZKQW-STQMWFEESA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H]1CCC[C@H]1[NH2+]Cc1ccc(C[NH3+])cc1 ZINC000572522376 324189349 /nfs/dbraw/zinc/18/93/49/324189349.db2.gz AKUAIKWYEWXDIF-BXUZGUMPSA-N 2 0 218.344 2.424 20 0 BEADRP CC(C)C1CC[NH+](C[C@]2(C)CC[NH2+]C2)CC1 ZINC000232540562 353732872 /nfs/dbraw/zinc/73/28/72/353732872.db2.gz MQKKMWKSATVTFO-CQSZACIVSA-N 2 0 224.392 2.354 20 0 BEADRP Fc1cccc2c1CC[N@H+](CC1CC[NH2+]CC1)C2 ZINC000336433615 181005398 /nfs/dbraw/zinc/00/53/98/181005398.db2.gz DSZZRPKCYKLMIP-UHFFFAOYSA-N 2 0 248.345 2.183 20 0 BEADRP CC(C)[C@@H]1CC[N@H+](CCCn2ccnc2)C1 ZINC000343324788 353707406 /nfs/dbraw/zinc/70/74/06/353707406.db2.gz XRCDXRAIRWNYML-CYBMUJFWSA-N 2 0 221.348 2.251 20 0 BEADRP CC(C)C[NH+](C)CCOCC[N@@H+](C)CC(C)C ZINC000343626930 353948119 /nfs/dbraw/zinc/94/81/19/353948119.db2.gz QHYBLOKWZIGURU-UHFFFAOYSA-N 2 0 244.423 2.179 20 0 BEADRP C[C@@H]1CC[N@H+](CCc2cncn2C)CC1(C)C ZINC000334562186 354117476 /nfs/dbraw/zinc/11/74/76/354117476.db2.gz JTFDKXUDVKLGES-GFCCVEGCSA-N 2 0 235.375 2.331 20 0 BEADRP c1ccc(C[N@@H+]2CC[C@H]3[NH2+]CCC[C@H]3C2)cc1 ZINC000252476225 363333226 /nfs/dbraw/zinc/33/32/26/363333226.db2.gz MAIRFDXCHHKPFG-LSDHHAIUSA-N 2 0 230.355 2.261 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]C[C@@H]2C[C@H]2C2CC2)[C@@H](C)C1 ZINC000449742830 202018157 /nfs/dbraw/zinc/01/81/57/202018157.db2.gz RMVGRGVCRSRSRX-CYUUQNCZSA-N 2 0 236.403 2.352 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)C[C@@H](CC(C)C)OC ZINC000639175270 354194113 /nfs/dbraw/zinc/19/41/13/354194113.db2.gz KDZGVXZETPVWKV-CQSZACIVSA-N 2 0 244.423 2.321 20 0 BEADRP CCCC[C@@H](COC)[NH2+]CC1=CC[N@H+](C)CC1 ZINC000344281012 354200542 /nfs/dbraw/zinc/20/05/42/354200542.db2.gz ABKJBSMKRUYMPN-AWEZNQCLSA-N 2 0 240.391 2.043 20 0 BEADRP CSc1ccccc1CN1CCC[C@H]([NH3+])C1 ZINC000334585408 354208752 /nfs/dbraw/zinc/20/87/52/354208752.db2.gz FZOWOOWGDLRKMH-LBPRGKRZSA-N 2 0 236.384 2.332 20 0 BEADRP Cn1cncc1CC[N@@H+]1CC(C)(C)[C@H]2CCC[C@@H]21 ZINC000334586026 354209925 /nfs/dbraw/zinc/20/99/25/354209925.db2.gz UJSJJAUDPSXVFH-KBPBESRZSA-N 2 0 247.386 2.473 20 0 BEADRP CCC[C@H](C[N@H+](CC)CCC[NH+](C)C)OC ZINC000639175922 354210487 /nfs/dbraw/zinc/21/04/87/354210487.db2.gz RMTHBDRQEODSHV-CYBMUJFWSA-N 2 0 230.396 2.075 20 0 BEADRP C[C@@H]1C[N@H+](CC[C@H]2CCC[NH+]2C)CCC1(F)F ZINC000334685096 354430777 /nfs/dbraw/zinc/43/07/77/354430777.db2.gz VNEDBJLLOZSNGF-VXGBXAGGSA-N 2 0 246.345 2.448 20 0 BEADRP C[C@H]1CN(C)C[C@H]1[NH2+]CC1=CCCCC1 ZINC000334654500 354448042 /nfs/dbraw/zinc/44/80/42/354448042.db2.gz VVJRHSQAPKLWBG-WCQYABFASA-N 2 0 208.349 2.027 20 0 BEADRP C[C@@H]1CN(C)C[C@@H]1[NH2+]C1CCC(C(F)F)CC1 ZINC000334702086 354495127 /nfs/dbraw/zinc/49/51/27/354495127.db2.gz ILAOVNQNCUQJSQ-YYJSSNLHSA-N 2 0 246.345 2.350 20 0 BEADRP CSC1(CN2CC[C@H]3CC[C@@H](C2)[N@@H+]3C)CC1 ZINC000335134059 354782201 /nfs/dbraw/zinc/78/22/01/354782201.db2.gz FMNCXDOJBFFWSL-NEPJUHHUSA-N 2 0 240.416 2.051 20 0 BEADRP CCC(C)(C)C[NH2+]C[C@H]([NH3+])CC(C)C ZINC000232893472 363388855 /nfs/dbraw/zinc/38/88/55/363388855.db2.gz UTOKRGYOZFMAQF-LLVKDONJSA-N 2 0 200.370 2.386 20 0 BEADRP CCC[N@H+](C[C@@H]1CC[NH2+][C@@H](C)C1)C1CC1 ZINC000233076819 363392520 /nfs/dbraw/zinc/39/25/20/363392520.db2.gz GPNZLNQFZJBTSS-NWDGAFQWSA-N 2 0 210.365 2.249 20 0 BEADRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@@H](C)C1(C)CC1 ZINC000166032769 354871804 /nfs/dbraw/zinc/87/18/04/354871804.db2.gz NWQMAKFTGQUJOR-STQMWFEESA-N 2 0 242.407 2.121 20 0 BEADRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@@H](C)C(C)(C)C ZINC000166032015 354864343 /nfs/dbraw/zinc/86/43/43/354864343.db2.gz NHOSZUCDULHSNH-STQMWFEESA-N 2 0 244.423 2.367 20 0 BEADRP Cc1cc(Cl)ccc1C[NH2+][C@@H](C)CC[NH3+] ZINC000235087715 363437481 /nfs/dbraw/zinc/43/74/81/363437481.db2.gz GBMCJVRXFAIKST-JTQLQIEISA-N 2 0 226.751 2.475 20 0 BEADRP COC1CCC([NH2+][C@@H]2CCCN(C)[C@H]2C)CC1 ZINC000346329419 354898205 /nfs/dbraw/zinc/89/82/05/354898205.db2.gz MQQIDADIKLUGFL-GFJIZPEISA-N 2 0 240.391 2.016 20 0 BEADRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@@H](CC)C1CC1 ZINC000166050585 354937520 /nfs/dbraw/zinc/93/75/20/354937520.db2.gz MNIOGYZBSAICOW-KBPBESRZSA-N 2 0 242.407 2.121 20 0 BEADRP CC1(C)CCCC[C@@H]1[NH2+]C[C@H]1CC[NH2+]C1 ZINC000335175820 354944026 /nfs/dbraw/zinc/94/40/26/354944026.db2.gz PQSKPGPESYYESS-RYUDHWBXSA-N 2 0 210.365 2.154 20 0 BEADRP CCN1CCCC[C@@H]1C[NH2+][C@@H](C)[C@H]1CCCO1 ZINC000346566063 354970593 /nfs/dbraw/zinc/97/05/93/354970593.db2.gz RNAOYIOAIHMMGE-BFHYXJOUSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@H]1C[C@H]1C[N@@H+]1CCCC12CC[NH+](C)CC2 ZINC000335204528 355039674 /nfs/dbraw/zinc/03/96/74/355039674.db2.gz NZPLRDGYJWCREB-STQMWFEESA-N 2 0 222.376 2.203 20 0 BEADRP CC(C[NH+]1CC[C@H](C)C1)C[N@@H+]1CC[C@H](C)C1 ZINC000346638028 355015633 /nfs/dbraw/zinc/01/56/33/355015633.db2.gz GKFVRKBZCKOGFZ-STQMWFEESA-N 2 0 224.392 2.306 20 0 BEADRP c1ccc2c(c1)CCC([NH2+]C1CC[NH2+]CC1)CC2 ZINC000335181917 355079813 /nfs/dbraw/zinc/07/98/13/355079813.db2.gz WIXLGJKXQOWUOI-UHFFFAOYSA-N 2 0 244.382 2.276 20 0 BEADRP CC[NH+](CC)CCN(CC(C)C)CC(C)(C)[NH3+] ZINC000346837509 355132668 /nfs/dbraw/zinc/13/26/68/355132668.db2.gz VYLWGKUUCPJNDD-UHFFFAOYSA-N 2 0 243.439 2.024 20 0 BEADRP CCCO[C@@H]1CCC[N@H+](CC(C)(C)[NH3+])CC1 ZINC000346842736 355134365 /nfs/dbraw/zinc/13/43/65/355134365.db2.gz IKYBMDNGJAWNCM-GFCCVEGCSA-N 2 0 228.380 2.005 20 0 BEADRP C[C@@H]1C[C@H](C)CC[N@H+](CC2CC[NH2+]CC2)C1 ZINC000346989547 355189334 /nfs/dbraw/zinc/18/93/34/355189334.db2.gz RTLYOWSUIVNMQK-CHWSQXEVSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@H]([NH2+][C@H]1CCc2c1cccc2F)C1C[NH2+]C1 ZINC000335257371 355193784 /nfs/dbraw/zinc/19/37/84/355193784.db2.gz GDJJQVROGOYNKV-XPTSAGLGSA-N 2 0 234.318 2.011 20 0 BEADRP C[C@@H]1C[N@H+](CC2CC[NH2+]CC2)[C@H]2CCCC[C@@H]12 ZINC000347000578 355198086 /nfs/dbraw/zinc/19/80/86/355198086.db2.gz GMIODMFGYKLEMG-SNPRPXQTSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]1C[N@H+](C[C@@H]2CCC[NH2+]C2)[C@@H]2CCCC[C@H]21 ZINC000347008687 355202939 /nfs/dbraw/zinc/20/29/39/355202939.db2.gz RVOZTYNRKJMBFL-APIJFGDWSA-N 2 0 236.403 2.497 20 0 BEADRP CC1(C)CCCN1CC[NH2+]CCC[C@H]1CCO1 ZINC000639241837 355228275 /nfs/dbraw/zinc/22/82/75/355228275.db2.gz JLZFLSZMTABOLB-ZDUSSCGKSA-N 2 0 240.391 2.020 20 0 BEADRP C[NH+](C)C[C@H]1CC[N@H+](CC2CCCC2)C1 ZINC000113512207 355248493 /nfs/dbraw/zinc/24/84/93/355248493.db2.gz XJTJOTUTOHMARC-CYBMUJFWSA-N 2 0 210.365 2.060 20 0 BEADRP CC[C@H](C[N@@H+]1CC[C@H](C[NH+](CC)CC)C1)OC ZINC000412975997 191345867 /nfs/dbraw/zinc/34/58/67/191345867.db2.gz HGJZYKGIVSIXKD-ZIAGYGMSSA-N 2 0 242.407 2.075 20 0 BEADRP CC[C@H](C[N@@H+]1CC[C@@H](C[NH+](CC)CC)C1)OC ZINC000412975995 191346034 /nfs/dbraw/zinc/34/60/34/191346034.db2.gz HGJZYKGIVSIXKD-UONOGXRCSA-N 2 0 242.407 2.075 20 0 BEADRP [NH3+]CCC[N@@H+]1CCSC2(CCCCC2)C1 ZINC000335280726 355245072 /nfs/dbraw/zinc/24/50/72/355245072.db2.gz XADDEIPMYSXOAQ-UHFFFAOYSA-N 2 0 228.405 2.087 20 0 BEADRP C[NH+](C)C[C@@H]1CC[N@H+](CC2CCCCC2)C1 ZINC000113511972 355247746 /nfs/dbraw/zinc/24/77/46/355247746.db2.gz IZBBBJXBUZTRNQ-AWEZNQCLSA-N 2 0 224.392 2.450 20 0 BEADRP CCN(Cc1ncc(CN(C)C)s1)C(C)C ZINC000347675360 355262291 /nfs/dbraw/zinc/26/22/91/355262291.db2.gz PAYRJEXGAWPXFL-UHFFFAOYSA-N 2 0 241.404 2.435 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CC[C@@H]2CCC[N@H+](C)C2)CS1 ZINC000639256767 355300219 /nfs/dbraw/zinc/30/02/19/355300219.db2.gz FQTDWRMVEBMJDF-FRRDWIJNSA-N 2 0 242.432 2.202 20 0 BEADRP CC[NH+](CC)CCOCC[NH2+][C@H]1CCC[C@H]1C ZINC000349674628 355408231 /nfs/dbraw/zinc/40/82/31/355408231.db2.gz ZLARWFKIYYGRHB-KGLIPLIRSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+][C@H]1CC[C@@H](C)C[C@@H]1C ZINC000414790924 191568871 /nfs/dbraw/zinc/56/88/71/191568871.db2.gz HFGNSSUKQJAIGI-VOAKCMCISA-N 2 0 212.381 2.384 20 0 BEADRP COC[C@H](CC(C)C)[NH2+][C@H]1CCCC[C@@H]1C[NH3+] ZINC000414791946 191569413 /nfs/dbraw/zinc/56/94/13/191569413.db2.gz BPJPLTVQZCNKAW-RDBSUJKOSA-N 2 0 242.407 2.155 20 0 BEADRP C[C@@H](CCc1ccsc1)[NH2+]C[C@@H]1CCC[NH2+]1 ZINC000414821452 191585032 /nfs/dbraw/zinc/58/50/32/191585032.db2.gz CFNSGBIRDCIXDV-AAEUAGOBSA-N 2 0 238.400 2.411 20 0 BEADRP CC(C)[C@@H]1CCC[C@H]1[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000414825547 191587217 /nfs/dbraw/zinc/58/72/17/191587217.db2.gz COKPPFNMJYYVLR-HZSPNIEDSA-N 2 0 224.392 2.400 20 0 BEADRP CC(C)(C)CC[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000414825667 191587609 /nfs/dbraw/zinc/58/76/09/191587609.db2.gz HLWHLTCIPNIQRE-FOSCPWQOSA-N 2 0 210.365 2.295 20 0 BEADRP [NH3+]CCCC[NH2+]Cc1cc(Cl)ccc1F ZINC000162957108 491079717 /nfs/dbraw/zinc/07/97/17/491079717.db2.gz TXHNPQSAGAIJHX-UHFFFAOYSA-N 2 0 230.714 2.308 20 0 BEADRP [NH3+]CCCC[NH2+]Cc1ccc(Cl)cc1F ZINC000162956983 491079729 /nfs/dbraw/zinc/07/97/29/491079729.db2.gz XNZBRUNCSKMTET-UHFFFAOYSA-N 2 0 230.714 2.308 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H](C)CCC(C)C ZINC000414849306 191600164 /nfs/dbraw/zinc/60/01/64/191600164.db2.gz XYWVNZCDJZGWSU-VXGBXAGGSA-N 2 0 200.370 2.256 20 0 BEADRP C[NH2+]Cc1ccccc1NC[C@@H]([NH3+])CC(C)C ZINC000414865223 191605509 /nfs/dbraw/zinc/60/55/09/191605509.db2.gz KLLHRVFPNKZNKW-ZDUSSCGKSA-N 2 0 235.375 2.191 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@H]1CCCC[C@H]1C1CC1 ZINC000414992980 191643735 /nfs/dbraw/zinc/64/37/35/191643735.db2.gz SKIYDFOUOTVBBX-AVGNSLFASA-N 2 0 210.365 2.282 20 0 BEADRP c1cc(C[NH2+][C@@H]2C[C@H]2C2CC[NH2+]CC2)cs1 ZINC000415009359 191648724 /nfs/dbraw/zinc/64/87/24/191648724.db2.gz NWXIDQTWCRYDCM-QWHCGFSZSA-N 2 0 236.384 2.226 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]C[C@@H](C)CC1CCOCC1 ZINC000415025458 191655059 /nfs/dbraw/zinc/65/50/59/191655059.db2.gz QZQRTPZRRYFLEM-QWHCGFSZSA-N 2 0 242.407 2.156 20 0 BEADRP COc1ccc2oc(C[NH2+]C[C@@H](C)C[NH3+])cc2c1 ZINC000414873257 191608854 /nfs/dbraw/zinc/60/88/54/191608854.db2.gz GWTBVMRUSZCFRM-JTQLQIEISA-N 2 0 248.326 2.126 20 0 BEADRP Cc1ccncc1C[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000414967670 191636177 /nfs/dbraw/zinc/63/61/77/191636177.db2.gz QREHDFATELFDSB-CQSZACIVSA-N 2 0 233.359 2.012 20 0 BEADRP Cc1ccccc1C[NH2+]C[C@H]1CC[NH2+][C@@H](C)C1 ZINC000415092651 191676556 /nfs/dbraw/zinc/67/65/56/191676556.db2.gz UBSUUXITIAXNLK-KBPBESRZSA-N 2 0 232.371 2.473 20 0 BEADRP CC(C)OCC(C)(C)[NH2+]C[C@H]1CC[NH2+][C@H](C)C1 ZINC000415121836 191685120 /nfs/dbraw/zinc/68/51/20/191685120.db2.gz KTHAKAIWYUQCNF-OLZOCXBDSA-N 2 0 242.407 2.168 20 0 BEADRP c1c[nH]c([C@@H]2CCC[N@H+]2CC2CC[NH2+]CC2)c1 ZINC000335855800 355600208 /nfs/dbraw/zinc/60/02/08/355600208.db2.gz WJSVDCYSLVNGSV-AWEZNQCLSA-N 2 0 233.359 2.151 20 0 BEADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+]C/C=C\c2ccccc2)C1 ZINC000415032339 191657816 /nfs/dbraw/zinc/65/78/16/191657816.db2.gz IAJWTYTUFAKXBJ-DGPIVGRDSA-N 2 0 230.355 2.417 20 0 BEADRP Cc1ccoc1C[NH+]1CCC(C[NH+](C)C)CC1 ZINC000350141381 355613602 /nfs/dbraw/zinc/61/36/02/355613602.db2.gz BTVTULHQGDOSNW-UHFFFAOYSA-N 2 0 236.359 2.362 20 0 BEADRP [NH3+]C[C@H]1CC[C@@H]([NH2+]CC2CCCCC2)C1 ZINC000415046333 191661986 /nfs/dbraw/zinc/66/19/86/191661986.db2.gz UZPIGGYHVFIZLJ-QWHCGFSZSA-N 2 0 210.365 2.284 20 0 BEADRP C[N@@H+]1CC[C@]2(CC[NH+]([C@H]3C=CCCC3)C2)C1 ZINC000335887759 355679549 /nfs/dbraw/zinc/67/95/49/355679549.db2.gz CFBLXFVFIGLAGK-KBPBESRZSA-N 2 0 220.360 2.123 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)[C@H]1CC1(F)F ZINC000639347484 355794176 /nfs/dbraw/zinc/79/41/76/355794176.db2.gz ODVUMYZZZGKQRS-SDDRHHMPSA-N 2 0 246.345 2.352 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)[C@H]1CC1(F)F ZINC000639347483 355794203 /nfs/dbraw/zinc/79/42/03/355794203.db2.gz ODVUMYZZZGKQRS-QJPTWQEYSA-N 2 0 246.345 2.352 20 0 BEADRP CCC[C@@H](C[NH2+]C[C@@H]1CCCC[N@H+](C)C1)OC ZINC000639347803 355794668 /nfs/dbraw/zinc/79/46/68/355794668.db2.gz QYOUJVSKGRARKJ-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP CC[C@]1(C)CC[N@H+](CC[C@@H]2CC[NH2+]C2)C1 ZINC000399376574 355867776 /nfs/dbraw/zinc/86/77/76/355867776.db2.gz OBCPRJFPTMFAMU-QWHCGFSZSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@@H]1C[C@H](C)[C@H](C)[N@H+](CC2CC[NH2+]CC2)C1 ZINC000166718078 355830346 /nfs/dbraw/zinc/83/03/46/355830346.db2.gz DYOKXNYRPWMRNI-AGIUHOORSA-N 2 0 224.392 2.352 20 0 BEADRP CCC1([NH+](C)C)CC[NH+](CC(C)C)CC1 ZINC000639379852 355915425 /nfs/dbraw/zinc/91/54/25/355915425.db2.gz RXPNMMRESLAEFF-UHFFFAOYSA-N 2 0 212.381 2.449 20 0 BEADRP C[C@@H](C[NH2+]C[C@H]1CC[NH2+][C@H](C)C1)c1ccncc1 ZINC000530244370 355920659 /nfs/dbraw/zinc/92/06/59/355920659.db2.gz KPDBKKFQYBDFNN-MJBXVCDLSA-N 2 0 247.386 2.163 20 0 BEADRP C[C@@H]1C[C@@H](C[NH3+])C[N@@H+]1C/C=C/c1ccccc1 ZINC000216193728 355925394 /nfs/dbraw/zinc/92/53/94/355925394.db2.gz FLAIQOKFGJKICM-JGOVJGDKSA-N 2 0 230.355 2.369 20 0 BEADRP C[C@@H]1C[C@@H]([N@H+](C)CC2(C)CC2)CCN1C ZINC000582217390 355937755 /nfs/dbraw/zinc/93/77/55/355937755.db2.gz WTOBODGJVIAACU-NEPJUHHUSA-N 2 0 210.365 2.201 20 0 BEADRP C[C@H]1C[C@H]([N@H+](C)CC2(C)CC2)CCN1C ZINC000582217391 355938057 /nfs/dbraw/zinc/93/80/57/355938057.db2.gz WTOBODGJVIAACU-NWDGAFQWSA-N 2 0 210.365 2.201 20 0 BEADRP C[C@@H]1C[NH+](CC[C@H]2CCCC[N@@H+]2C)C[C@H]1C ZINC000351439997 355992112 /nfs/dbraw/zinc/99/21/12/355992112.db2.gz ZXBXCPQIAUTYLW-MGPQQGTHSA-N 2 0 224.392 2.449 20 0 BEADRP C([NH2+]C1C2CC3CC(C2)CC1C3)[C@@H]1CCC[NH2+]1 ZINC000216495235 355996684 /nfs/dbraw/zinc/99/66/84/355996684.db2.gz YYEHWKSTTLJKKR-BPHCLYMKSA-N 2 0 234.387 2.153 20 0 BEADRP Cc1nc(Cn2cnc3c2CCCC3)[nH]c1C ZINC000628371984 356033785 /nfs/dbraw/zinc/03/37/85/356033785.db2.gz RQONYEJOQWRVFV-UHFFFAOYSA-N 2 0 230.315 2.150 20 0 BEADRP [NH3+]CCC[NH2+][C@@H](c1ccccc1)C1CCC1 ZINC000420297924 192204699 /nfs/dbraw/zinc/20/46/99/192204699.db2.gz GPRLUNGIMPKXHF-AWEZNQCLSA-N 2 0 218.344 2.466 20 0 BEADRP CSc1ccccc1C[N@@H+]1CC[C@@H](C[NH3+])C1 ZINC000420298774 192205210 /nfs/dbraw/zinc/20/52/10/192205210.db2.gz SQIGIBOHHQRACH-NSHDSACASA-N 2 0 236.384 2.189 20 0 BEADRP CCSCC[C@H](C)[N@H+](C)CC[C@H]1CC[NH2+]C1 ZINC000420298866 192205451 /nfs/dbraw/zinc/20/54/51/192205451.db2.gz IDIZKAKTRIBOOS-QWHCGFSZSA-N 2 0 244.448 2.450 20 0 BEADRP [NH3+]C1CC[NH+](CCCc2ccsc2)CC1 ZINC000420280639 192199058 /nfs/dbraw/zinc/19/90/58/192199058.db2.gz YTGBIDPMISQJHW-UHFFFAOYSA-N 2 0 224.373 2.104 20 0 BEADRP CC[N@H+](CC[C@@H]1CCCO1)[C@@H]1CCC[NH2+]CC1 ZINC000420300990 192207014 /nfs/dbraw/zinc/20/70/14/192207014.db2.gz ABEHWVCBGQZIDF-KGLIPLIRSA-N 2 0 240.391 2.020 20 0 BEADRP CC(C)[N@H+](CC[C@@H]1CCC[NH2+]C1)C1CC1 ZINC000420301730 192207057 /nfs/dbraw/zinc/20/70/57/192207057.db2.gz IXLRBYULZNJEGU-LBPRGKRZSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H]([NH3+])[C@@H]1CCCN(Cc2ncc(C3CC3)o2)C1 ZINC000420290931 192200943 /nfs/dbraw/zinc/20/09/43/192200943.db2.gz MQCWOTXBMMLLEV-ZYHUDNBSSA-N 2 0 249.358 2.111 20 0 BEADRP CCc1cccc(C[N@@H+]2CC[C@H]3C[NH2+]C[C@H]3C2)c1 ZINC000420314912 192213305 /nfs/dbraw/zinc/21/33/05/192213305.db2.gz LRGRCELNJNUTQJ-HOTGVXAUSA-N 2 0 244.382 2.290 20 0 BEADRP CC(C)[C@@H]1C[N@H+](CC[C@@H]2CC[NH2+]C2)CCS1 ZINC000420314105 192213415 /nfs/dbraw/zinc/21/34/15/192213415.db2.gz YSVUWFCXCCTVGV-STQMWFEESA-N 2 0 242.432 2.059 20 0 BEADRP COc1ccccc1CCC[N@H+](C)C1CC([NH3+])C1 ZINC000420344001 192215881 /nfs/dbraw/zinc/21/58/81/192215881.db2.gz XOSHHWWZXDXRPN-UHFFFAOYSA-N 2 0 248.370 2.049 20 0 BEADRP FCCCCC[N@@H+]1CCC[C@]2(CC[NH2+]C2)C1 ZINC000420353209 192217702 /nfs/dbraw/zinc/21/77/02/192217702.db2.gz AWIPWJCWBVNYKN-CYBMUJFWSA-N 2 0 228.355 2.202 20 0 BEADRP Cc1cnc([C@H](C)[N@@H+]2CCC[C@@H](CC[NH3+])C2)o1 ZINC000420305472 192209256 /nfs/dbraw/zinc/20/92/56/192209256.db2.gz GKKKDZFDJFZYOU-RYUDHWBXSA-N 2 0 237.347 2.105 20 0 BEADRP [NH3+]CC[C@H]1CCC[N@H+](CCCc2ccncc2)C1 ZINC000420305078 192209583 /nfs/dbraw/zinc/20/95/83/192209583.db2.gz FVSLCVWQSHQTTB-OAHLLOKOSA-N 2 0 247.386 2.075 20 0 BEADRP COc1ccc([C@H](C[NH3+])C[N@@H+]2CCC[C@@H]2C)cc1 ZINC000420306610 192209693 /nfs/dbraw/zinc/20/96/93/192209693.db2.gz QNBBTOONRRNWPM-GXTWGEPZSA-N 2 0 248.370 2.222 20 0 BEADRP Cc1ccccc1C[C@H]1CCC[N@H+]1C[C@H](C)[NH3+] ZINC000420308405 192210049 /nfs/dbraw/zinc/21/00/49/192210049.db2.gz SCPNQXSVKDFUQO-DZGCQCFKSA-N 2 0 232.371 2.349 20 0 BEADRP CC(C)[C@H]1C[N@H+](CC[C@@H]2CC[NH2+]C2)CCS1 ZINC000420314104 192212897 /nfs/dbraw/zinc/21/28/97/192212897.db2.gz YSVUWFCXCCTVGV-QWHCGFSZSA-N 2 0 242.432 2.059 20 0 BEADRP C[N@H+](CCCc1ccsc1)C1CC([NH3+])C1 ZINC000420325364 192229132 /nfs/dbraw/zinc/22/91/32/192229132.db2.gz DBFSRKASAXHFEX-UHFFFAOYSA-N 2 0 224.373 2.102 20 0 BEADRP CCc1cccc(OCC[N@H+](C)C2CC([NH3+])C2)c1 ZINC000420324755 192229413 /nfs/dbraw/zinc/22/94/13/192229413.db2.gz CKTDNQRHTHCBEE-UHFFFAOYSA-N 2 0 248.370 2.049 20 0 BEADRP c1cncc([C@H]2CCC[N@H+]2CC[C@@H]2CC[NH2+]C2)c1 ZINC000420354792 192219394 /nfs/dbraw/zinc/21/93/94/192219394.db2.gz DKELWUYPNHISHL-DZGCQCFKSA-N 2 0 245.370 2.218 20 0 BEADRP NC[C@H]([NH2+]Cc1cccc(N)c1)C1CCCCC1 ZINC000420364693 192223197 /nfs/dbraw/zinc/22/31/97/192223197.db2.gz KNDGLRPDUMGEJE-HNNXBMFYSA-N 2 0 247.386 2.266 20 0 BEADRP C[C@H]([NH2+]CCC1CC[NH2+]CC1)c1cccnc1 ZINC000420363141 192223607 /nfs/dbraw/zinc/22/36/07/192223607.db2.gz BFNGSRDAZYNQDN-LBPRGKRZSA-N 2 0 233.359 2.122 20 0 BEADRP CC[C@H](C)[NH+]1CCC([C@H]2C[C@@H]([NH3+])CCO2)CC1 ZINC000420389456 192234727 /nfs/dbraw/zinc/23/47/27/192234727.db2.gz MCQKOGSXPHOJJT-FPMFFAJLSA-N 2 0 240.391 2.003 20 0 BEADRP CCSCC[N@@H+]1CCCC[C@H]1[C@H]1CC[NH2+]C1 ZINC000420396048 192237178 /nfs/dbraw/zinc/23/71/78/192237178.db2.gz LMJMOSBNDFBCIT-STQMWFEESA-N 2 0 242.432 2.204 20 0 BEADRP CC[C@H](C)[C@@H](C)[NH2+]CCC1CC[NH2+]CC1 ZINC000420410185 192239077 /nfs/dbraw/zinc/23/90/77/192239077.db2.gz REQWTDFMHSUSHO-NWDGAFQWSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H]([NH3+])C[NH2+][C@@H](C)[C@@H](C)c1ccccc1 ZINC000420417330 192241310 /nfs/dbraw/zinc/24/13/10/192241310.db2.gz WJVMFVFYXCDKBC-TUAOUCFPSA-N 2 0 206.333 2.115 20 0 BEADRP C[C@@H]1CCCC[N@H+](CCC2CC[NH2+]CC2)C1 ZINC000420376323 192232404 /nfs/dbraw/zinc/23/24/04/192232404.db2.gz QKWCKFSRVMRTLO-CYBMUJFWSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCC[C@H]([NH3+])C2)[C@H]1C ZINC000386080297 356490113 /nfs/dbraw/zinc/49/01/13/356490113.db2.gz DACAMVMKCCNNGB-FHUSYTEZSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCN2CCCC2(C)C)[C@H](C)O1 ZINC000449782245 202035269 /nfs/dbraw/zinc/03/52/69/202035269.db2.gz KIXLVJUHTZRUQP-AGIUHOORSA-N 2 0 240.391 2.016 20 0 BEADRP CO[C@@H](C)C[N@H+](C)Cc1c(C)cc(C)nc1C ZINC000639644339 356557254 /nfs/dbraw/zinc/55/72/54/356557254.db2.gz PYFSAWYOSSYTOG-LBPRGKRZSA-N 2 0 236.359 2.474 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]CC1(C2CC2)CC1 ZINC000422937759 192511765 /nfs/dbraw/zinc/51/17/65/192511765.db2.gz OPWOBFKZMOXHQJ-YPMHNXCESA-N 2 0 222.376 2.154 20 0 BEADRP CCOCCC1(C[NH2+][C@@H](C)CCC[NH3+])CCC1 ZINC000422938342 192512205 /nfs/dbraw/zinc/51/22/05/192512205.db2.gz KOXCLFCSUPJPJG-ZDUSSCGKSA-N 2 0 242.407 2.300 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H](C)C[C@H]1CCCO1 ZINC000422899725 192513834 /nfs/dbraw/zinc/51/38/34/192513834.db2.gz IDURCOONUSERTA-FRRDWIJNSA-N 2 0 228.380 2.051 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+][C@H]1CCCC(F)(F)C1 ZINC000422986614 192519658 /nfs/dbraw/zinc/51/96/58/192519658.db2.gz CWTQPLXCCOXENH-AEJSXWLSSA-N 2 0 218.291 2.034 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]CC1(CCO)CCCCC1 ZINC000422990370 192521602 /nfs/dbraw/zinc/52/16/02/192521602.db2.gz BWCHZBYJIQEURL-ZDUSSCGKSA-N 2 0 242.407 2.036 20 0 BEADRP CC(C)CSCCC[NH2+][C@H](C)CCC[NH3+] ZINC000423012408 192538407 /nfs/dbraw/zinc/53/84/07/192538407.db2.gz KRJAYDCWKBSKAH-GFCCVEGCSA-N 2 0 232.437 2.483 20 0 BEADRP COCC[C@H]([NH2+][C@@H](C)C[C@H](C)[NH3+])c1ccco1 ZINC000423036350 192548557 /nfs/dbraw/zinc/54/85/57/192548557.db2.gz ANHGZSNAPWATAD-SRVKXCTJSA-N 2 0 240.347 2.073 20 0 BEADRP CC[C@@H]([NH2+][C@H]1CC12CCCC2)[C@@H]1CCC[NH2+]1 ZINC000423069226 192557803 /nfs/dbraw/zinc/55/78/03/192557803.db2.gz ASSBLKXGERHHJU-AGIUHOORSA-N 2 0 222.376 2.439 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCC12CCCC2)[C@H]1CCC[NH2+]1 ZINC000423075881 192560170 /nfs/dbraw/zinc/56/01/70/192560170.db2.gz PORCEYPISZYIFH-UPJWGTAASA-N 2 0 222.376 2.439 20 0 BEADRP CCc1cc(NCC[N@@H+](CC)C(C)C)cc[nH+]1 ZINC000450302295 202123659 /nfs/dbraw/zinc/12/36/59/202123659.db2.gz HIYMYCYWXXHFNI-UHFFFAOYSA-N 2 0 235.375 2.208 20 0 BEADRP CC(C)C[C@@H]1OCCC[C@@H]1[NH2+][C@H](C)CCC[NH3+] ZINC000423052536 192552973 /nfs/dbraw/zinc/55/29/73/192552973.db2.gz QDUGJFOCHJOHBI-RDBSUJKOSA-N 2 0 242.407 2.297 20 0 BEADRP Cc1cccc(CCC[NH2+][C@@H](C)CCC[NH3+])n1 ZINC000423102357 192568205 /nfs/dbraw/zinc/56/82/05/192568205.db2.gz KAMJIFMRVDWOSK-LBPRGKRZSA-N 2 0 235.375 2.040 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H](C)c1ccc2n[nH]cc2c1 ZINC000423104919 192568952 /nfs/dbraw/zinc/56/89/52/192568952.db2.gz HNMQYZUFCMZZLG-MNOVXSKESA-N 2 0 246.358 2.341 20 0 BEADRP COCC[C@@H]([NH2+]C1CCC([NH3+])CC1)C(C)(C)C ZINC000423115390 192573987 /nfs/dbraw/zinc/57/39/87/192573987.db2.gz NEUJTRJBMFNFOR-WXRRBKDZSA-N 2 0 242.407 2.297 20 0 BEADRP CCOCC(C)(C)C[NH2+]C1CCC(C[NH3+])CC1 ZINC000423130429 192578076 /nfs/dbraw/zinc/57/80/76/192578076.db2.gz YHVUNBHGOVPCSI-UHFFFAOYSA-N 2 0 242.407 2.156 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+]C[C@@H]1CC[N@@H+](C(C)C)C1 ZINC000381390368 356691022 /nfs/dbraw/zinc/69/10/22/356691022.db2.gz NYXUNEYPERYAFS-BFHYXJOUSA-N 2 0 224.392 2.495 20 0 BEADRP C[NH+](C)C[C@@H]1CC[N@H+](C[C@H]2CCC(F)(F)C2)C1 ZINC000450408143 202156242 /nfs/dbraw/zinc/15/62/42/202156242.db2.gz VFBVJJBRAKYHHP-RYUDHWBXSA-N 2 0 246.345 2.305 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CCc2ccco2)CC1(C)C ZINC000623338586 356734255 /nfs/dbraw/zinc/73/42/55/356734255.db2.gz HIAVSTBRMZSYSD-LBPRGKRZSA-N 2 0 236.359 2.285 20 0 BEADRP CC[C@H](C)[C@@H](C[NH2+]C1CCC(C[NH3+])CC1)OC ZINC000423158656 192597630 /nfs/dbraw/zinc/59/76/30/192597630.db2.gz OLJNBTKZMBCGOG-GFJIZPEISA-N 2 0 242.407 2.155 20 0 BEADRP CCc1cc(N2C[C@@H](C)[N@@H+](C)[C@@H](C)C2)cc[nH+]1 ZINC000450543014 202192724 /nfs/dbraw/zinc/19/27/24/202192724.db2.gz IXLUZJMVMJZHMV-TXEJJXNPSA-N 2 0 233.359 2.173 20 0 BEADRP C[C@H]([NH2+]CC1([NH3+])CCCCC1)[C@@H]1CCCOC1 ZINC000423175622 192608546 /nfs/dbraw/zinc/60/85/46/192608546.db2.gz FAQACBOEHKBMDD-QWHCGFSZSA-N 2 0 240.391 2.053 20 0 BEADRP CCCCOCC[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623383435 356907176 /nfs/dbraw/zinc/90/71/76/356907176.db2.gz UHLYAEYHBUCAFG-ZDUSSCGKSA-N 2 0 242.407 2.266 20 0 BEADRP CC[C@H]([NH2+]CCC[NH3+])c1cc(C)ccc1OC ZINC000423179422 192611927 /nfs/dbraw/zinc/61/19/27/192611927.db2.gz DDEPZFMFVJPEGD-ZDUSSCGKSA-N 2 0 236.359 2.393 20 0 BEADRP CC[NH+]1CCC([NH2+]CCCOCC(C)C)CC1 ZINC000020147172 356999577 /nfs/dbraw/zinc/99/95/77/356999577.db2.gz DMHQTQUHQZAYFJ-UHFFFAOYSA-N 2 0 242.407 2.123 20 0 BEADRP CCC[C@H](C)C[N@@H+]1C[C@@H](C)[C@](C)(C[NH3+])C1 ZINC000389575518 356993946 /nfs/dbraw/zinc/99/39/46/356993946.db2.gz CLWROHRWPYCJSZ-YNEHKIRRSA-N 2 0 212.381 2.339 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H](C)c1csc(C)c1 ZINC000423201238 192624691 /nfs/dbraw/zinc/62/46/91/192624691.db2.gz OEXAHLWWBWOBTG-JTQLQIEISA-N 2 0 212.362 2.317 20 0 BEADRP CC(C)(C)[C@@H]1CC[C@H]1[NH2+]C[C@@H]1CCC[NH2+]1 ZINC000423231147 192640715 /nfs/dbraw/zinc/64/07/15/192640715.db2.gz FUJKJUGEEOHOPV-QJPTWQEYSA-N 2 0 210.365 2.153 20 0 BEADRP COc1ccc([C@H](C)[NH2+]CC[C@H](C)[NH3+])c(F)c1 ZINC000423229471 192641466 /nfs/dbraw/zinc/64/14/66/192641466.db2.gz HDVZIFFOZVWJEZ-UWVGGRQHSA-N 2 0 240.322 2.222 20 0 BEADRP C[NH+](C)[C@H]1CCC[C@H]([NH2+]CC2(C)CC2)C1 ZINC000389984731 357079003 /nfs/dbraw/zinc/07/90/03/357079003.db2.gz LJOGETHPNYEUDO-RYUDHWBXSA-N 2 0 210.365 2.249 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]CCOCc2ccccc2)C1 ZINC000390229027 357086763 /nfs/dbraw/zinc/08/67/63/357086763.db2.gz FEJGJJIPPWAFEH-LSDHHAIUSA-N 2 0 248.370 2.063 20 0 BEADRP CC[NH+]1CCC(C[NH2+]C2CC(C)(C)C2)CC1 ZINC000390527721 357100813 /nfs/dbraw/zinc/10/08/13/357100813.db2.gz HKZPYABBFDWFNJ-UHFFFAOYSA-N 2 0 224.392 2.497 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]C[C@H]2CCCC2(F)F)C1 ZINC000390872666 357119168 /nfs/dbraw/zinc/11/91/68/357119168.db2.gz POUWKOKRRMDEJJ-GMTAPVOTSA-N 2 0 232.318 2.281 20 0 BEADRP CC[C@H]1CCC[C@@H]1[NH2+]CCC1=CC[NH2+]CC1 ZINC000583687701 357120211 /nfs/dbraw/zinc/12/02/11/357120211.db2.gz JMYZXYQJGVFSOP-KBPBESRZSA-N 2 0 222.376 2.465 20 0 BEADRP CCC(C)(C)[N@H+](C)C[C@@H]1CC[NH2+][C@@H](C)C1 ZINC000232825507 535355099 /nfs/dbraw/zinc/35/50/99/535355099.db2.gz NPAIHMJSYRRMLS-NWDGAFQWSA-N 2 0 212.381 2.495 20 0 BEADRP CCN(CC)C[C@H](C)[NH2+][C@@H](C)[C@@H]1CCCOC1 ZINC000356849534 538819744 /nfs/dbraw/zinc/81/97/44/538819744.db2.gz PSLANNGPNUUWMM-MELADBBJSA-N 2 0 242.407 2.121 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000423285370 192679455 /nfs/dbraw/zinc/67/94/55/192679455.db2.gz ZLMSDOPXOHPATC-RDBSUJKOSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@@H](C)CCCC[NH3+])cc1 ZINC000423290713 192681801 /nfs/dbraw/zinc/68/18/01/192681801.db2.gz FDHKYNDYBYMOGS-QWHCGFSZSA-N 3 0 249.402 2.313 20 0 BEADRP Cc1cc(C[NH2+]CC[C@@H]2CC[NH2+]C2)c(C)s1 ZINC000582653512 357364283 /nfs/dbraw/zinc/36/42/83/357364283.db2.gz LUJIHSQHPLZAIU-LBPRGKRZSA-N 2 0 238.400 2.454 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@@H](C)CCCOC)CC1 ZINC000395421492 357432831 /nfs/dbraw/zinc/43/28/31/357432831.db2.gz UAHURGZGSOCBRD-ZDUSSCGKSA-N 2 0 242.407 2.123 20 0 BEADRP Cc1ccsc1CC[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000582915654 357434932 /nfs/dbraw/zinc/43/49/32/357434932.db2.gz IJSIHIILWSZDFG-NEPJUHHUSA-N 2 0 238.400 2.459 20 0 BEADRP C[N@@H+]1CCC[C@@H]1CCSCC1CC[NH2+]CC1 ZINC000583082307 357474068 /nfs/dbraw/zinc/47/40/68/357474068.db2.gz PXJVUMSSXIYABA-CYBMUJFWSA-N 2 0 242.432 2.204 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]CCC(F)(F)F ZINC000063099442 357526060 /nfs/dbraw/zinc/52/60/60/357526060.db2.gz SFDKIKCLOXLEAA-BBBLOLIVSA-N 2 0 238.297 2.257 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@@H]2CCC[C@H]2C)CC1 ZINC000230657353 357545330 /nfs/dbraw/zinc/54/53/30/357545330.db2.gz LNAYWQQDHULVMG-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP CC1CCC([NH2+][C@@H]2CCC[NH2+]CC2)CC1 ZINC000168698550 538879355 /nfs/dbraw/zinc/87/93/55/538879355.db2.gz MWAJVHMXEGSCOA-OTTFEQOBSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]([NH2+]CC1CC[NH2+]CC1)[C@H]1CC1(C)C ZINC000397757181 357675355 /nfs/dbraw/zinc/67/53/55/357675355.db2.gz DGUXIIHDMTZIRT-ZYHUDNBSSA-N 2 0 210.365 2.010 20 0 BEADRP CCCC[C@H](C)[NH2+]CC1(COC)CC[NH2+]CC1 ZINC000232985054 357688547 /nfs/dbraw/zinc/68/85/47/357688547.db2.gz MLGNGNUBGPBUQG-ZDUSSCGKSA-N 2 0 242.407 2.171 20 0 BEADRP C[C@@H](CCC1CCCC1)[NH2+]CC1C[NH2+]C1 ZINC000423302746 192691439 /nfs/dbraw/zinc/69/14/39/192691439.db2.gz KFTNCDPNKVYBHE-NSHDSACASA-N 2 0 210.365 2.154 20 0 BEADRP COCCCCC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000192780459 357851539 /nfs/dbraw/zinc/85/15/39/357851539.db2.gz HUQCESGCAPMENF-AGUYFDCRSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1)C1CC1 ZINC000398171608 357857964 /nfs/dbraw/zinc/85/79/64/357857964.db2.gz IFACBPYIWVYPKD-SNVBAGLBSA-N 2 0 204.317 2.033 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+]CCC1=CCCCC1 ZINC000234714967 357827133 /nfs/dbraw/zinc/82/71/33/357827133.db2.gz CEWAOSAINNVXFR-CQSZACIVSA-N 2 0 240.391 2.220 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+]C1C[C@H](C)C[C@@H](C)C1 ZINC000234777474 357828220 /nfs/dbraw/zinc/82/82/20/357828220.db2.gz DVGSJFCKLVMNAF-UPJWGTAASA-N 2 0 242.407 2.155 20 0 BEADRP C[C@@H](CCc1ccccc1)[NH2+]C[C@@H]1CCC[NH2+]1 ZINC000235099187 357847948 /nfs/dbraw/zinc/84/79/48/357847948.db2.gz TZQRLYFZWULRPA-ZFWWWQNUSA-N 2 0 232.371 2.349 20 0 BEADRP Cc1cccc(OCC[N@H+]2CC[C@@H]([NH3+])C[C@H]2C)c1 ZINC000218482446 357925592 /nfs/dbraw/zinc/92/55/92/357925592.db2.gz NECPUYJBHXJNAD-ZIAGYGMSSA-N 2 0 248.370 2.185 20 0 BEADRP C[NH2+]CCSC[C@H]1CCCC[N@@H+]1C(C)C ZINC000583810409 357955725 /nfs/dbraw/zinc/95/57/25/357955725.db2.gz NIFKGSMZUHAJTJ-GFCCVEGCSA-N 2 0 230.421 2.202 20 0 BEADRP CC(C)[N@@H+]1CC[C@H](C[NH2+][C@@H](C)CC2CC2)C1 ZINC000229692398 491119226 /nfs/dbraw/zinc/11/92/26/491119226.db2.gz HRPADKIECJKYNH-GXTWGEPZSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H](Cc1cccs1)[NH2+][C@H]1CCC[NH2+]CC1 ZINC000168723910 134247243 /nfs/dbraw/zinc/24/72/43/134247243.db2.gz ROZVKNNGDLVYSZ-NEPJUHHUSA-N 2 0 238.400 2.411 20 0 BEADRP Fc1ccc(C[NH2+][C@H]2CCC[NH2+]CC2)cc1 ZINC000168701997 134246410 /nfs/dbraw/zinc/24/64/10/134246410.db2.gz VMVJRXIONGRXBH-ZDUSSCGKSA-N 2 0 222.307 2.057 20 0 BEADRP CC(C)OCCC[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@@H]1C ZINC000217940275 134251057 /nfs/dbraw/zinc/25/10/57/134251057.db2.gz IZZXJKQGTQMQAL-BFHYXJOUSA-N 2 0 242.407 2.120 20 0 BEADRP CCCC[C@H](C[NH3+])N[C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000423303409 192692339 /nfs/dbraw/zinc/69/23/39/192692339.db2.gz XBKDXESYTBRTLL-DFBGVHRSSA-N 2 0 247.386 2.238 20 0 BEADRP CCC1([NH+](C)C)CC[NH+]([C@@H](C)CCOC)CC1 ZINC000640017303 358080374 /nfs/dbraw/zinc/08/03/74/358080374.db2.gz LVHGTJMICKNWTA-ZDUSSCGKSA-N 2 0 242.407 2.218 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]C(C2CC2)C2CC2)C1 ZINC000086402322 491123832 /nfs/dbraw/zinc/12/38/32/491123832.db2.gz HBOSQUMJIVJVSP-VXGBXAGGSA-N 2 0 208.349 2.035 20 0 BEADRP CCC(C)(C)[C@@H](C)[NH2+]C[C@H]([NH3+])C(C)C ZINC000584774431 358175041 /nfs/dbraw/zinc/17/50/41/358175041.db2.gz TZVHXZQROKIMCY-MNOVXSKESA-N 2 0 200.370 2.384 20 0 BEADRP CC1CCN(CC[NH2+]C(C2CC2)C2CC2)CC1 ZINC000040771379 358246019 /nfs/dbraw/zinc/24/60/19/358246019.db2.gz MIVLVYIECQQHRB-UHFFFAOYSA-N 2 0 236.403 2.497 20 0 BEADRP CSCC[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000172434630 134265907 /nfs/dbraw/zinc/26/59/07/134265907.db2.gz LZXVLDIHPLIOHH-ZDUSSCGKSA-N 2 0 242.432 2.300 20 0 BEADRP CCC[C@@H](C)C[N@@H+]1CC[C@H](C[NH+](C)C)C1 ZINC000180230505 366397371 /nfs/dbraw/zinc/39/73/71/366397371.db2.gz BSTWGJPXWSPUKG-CHWSQXEVSA-N 2 0 212.381 2.306 20 0 BEADRP CC[N@H+](C)C[C@H]1CC[NH+](CCCCCOC)C1 ZINC000173924572 134276476 /nfs/dbraw/zinc/27/64/76/134276476.db2.gz WPDOTTRXRMDAHK-CQSZACIVSA-N 2 0 242.407 2.077 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@@H](C)C2CC2)CC1 ZINC000044517505 358388751 /nfs/dbraw/zinc/38/87/51/358388751.db2.gz IEMRJLZSBKYJGS-NSHDSACASA-N 2 0 210.365 2.106 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@@H](C)c2cccnc2)CC1 ZINC000044517483 358388834 /nfs/dbraw/zinc/38/88/34/358388834.db2.gz DRRMHQXUGQWEDY-ZDUSSCGKSA-N 2 0 247.386 2.464 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1cccc(O)c1 ZINC000044534562 358389706 /nfs/dbraw/zinc/38/97/06/358389706.db2.gz ZXDUYUYVSOILOH-QWHCGFSZSA-N 2 0 248.370 2.385 20 0 BEADRP C[C@@H]1CCC[NH+]1CCC[N@H+]1CCC[C@@H]1C ZINC000173989117 134277412 /nfs/dbraw/zinc/27/74/12/134277412.db2.gz FVXDOWTUIMMQKR-BETUJISGSA-N 2 0 210.365 2.345 20 0 BEADRP CCN1CCC[C@H]([NH2+]C2CCC(OC)CC2)C1 ZINC000130028231 358605647 /nfs/dbraw/zinc/60/56/47/358605647.db2.gz KJLPXEGTZUUSLN-MOKVOYLWSA-N 2 0 240.391 2.018 20 0 BEADRP CCOC[C@H](C)[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000130579943 358632391 /nfs/dbraw/zinc/63/23/91/358632391.db2.gz CCSOYYORJLJEPD-LBPRGKRZSA-N 2 0 242.407 2.264 20 0 BEADRP C[C@@H]1C[C@H](C[NH3+])C[N@@H+]1CCCOc1ccccc1 ZINC000131597180 358684650 /nfs/dbraw/zinc/68/46/50/358684650.db2.gz OOXZVUSMUMBUDU-ZIAGYGMSSA-N 2 0 248.370 2.125 20 0 BEADRP CC[C@H](CCO)C[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000132184226 358709770 /nfs/dbraw/zinc/70/97/70/358709770.db2.gz MBRODTKYPCJFLK-BYCMXARLSA-N 2 0 248.370 2.129 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CCCC(F)(F)F)CC[N@@H+]1C ZINC000132334470 358719076 /nfs/dbraw/zinc/71/90/76/358719076.db2.gz KESZLUBLUSPBQK-VHSXEESVSA-N 2 0 238.297 2.401 20 0 BEADRP C[C@H]([NH2+]Cc1ccc(C[NH3+])cc1)[C@@H]1CCCOC1 ZINC000578324013 366512826 /nfs/dbraw/zinc/51/28/26/366512826.db2.gz CJHVTTGBNIRXMJ-SWLSCSKDSA-N 2 0 248.370 2.050 20 0 BEADRP CC(C)Oc1ccc([C@H](C)[NH2+]CC2C[NH2+]C2)cc1 ZINC000423308378 192696600 /nfs/dbraw/zinc/69/66/00/192696600.db2.gz XQOWFQRHJZLONS-LBPRGKRZSA-N 2 0 248.370 2.344 20 0 BEADRP CC[N@@H+]1CCC[C@@H]1CNc1cc[nH+]cc1C ZINC000070046752 359039858 /nfs/dbraw/zinc/03/98/58/359039858.db2.gz HMNLWQLWPMHUQS-GFCCVEGCSA-N 2 0 219.332 2.286 20 0 BEADRP CC(C)[C@H](Cc1ccccc1)[NH2+]C[C@@H](C)C[NH3+] ZINC000423312777 192700021 /nfs/dbraw/zinc/70/00/21/192700021.db2.gz VSFXWEFRBNKUSP-ZFWWWQNUSA-N 2 0 234.387 2.438 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@@H](C)[C@@H]1C[C@H]1c1ccccc1 ZINC000423313956 192701860 /nfs/dbraw/zinc/70/18/60/192701860.db2.gz XMGKBPHKAXJDBS-JURCDPSOSA-N 2 0 232.371 2.363 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CCC[NH+]2CCCCC2)CCO1 ZINC000070346225 359050715 /nfs/dbraw/zinc/05/07/15/359050715.db2.gz RKKZOFOCILNMLA-UONOGXRCSA-N 2 0 240.391 2.020 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]CC2=CC[NH2+]CC2)[C@@H]1C ZINC000423328767 192709310 /nfs/dbraw/zinc/70/93/10/192709310.db2.gz ATULSJZAWNQGNY-BZPMIXESSA-N 2 0 222.376 2.320 20 0 BEADRP CCO[C@H]1C[C@H]([NH2+]CCCC[NH3+])C1(CC)CC ZINC000423330647 192711626 /nfs/dbraw/zinc/71/16/26/192711626.db2.gz PMQVMENYYLJADC-STQMWFEESA-N 2 0 242.407 2.299 20 0 BEADRP C[C@]12C[C@H]1CCC[C@@H]2[NH2+]CC1=CC[NH2+]CC1 ZINC000423343970 192720683 /nfs/dbraw/zinc/72/06/83/192720683.db2.gz DVUUIXSUBZUJLI-RDBSUJKOSA-N 2 0 220.360 2.074 20 0 BEADRP CC[C@@H]1CCCC[C@H]1[NH2+]CC1=CC[NH2+]CC1 ZINC000423344383 192720749 /nfs/dbraw/zinc/72/07/49/192720749.db2.gz MSKSSUVTSBHVJH-ZIAGYGMSSA-N 2 0 222.376 2.465 20 0 BEADRP CC[C@H]([NH2+]CC1=CC[NH2+]CC1)C1CCCC1 ZINC000423360513 192730945 /nfs/dbraw/zinc/73/09/45/192730945.db2.gz WBLZPDHZZQNFMA-AWEZNQCLSA-N 2 0 222.376 2.465 20 0 BEADRP CC[C@H]1CC[C@@H]1[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000423432026 192766080 /nfs/dbraw/zinc/76/60/80/192766080.db2.gz JBSVFIQWRUQAFF-DOERSZECSA-N 2 0 222.376 2.153 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+]CC2(C)CC2)CC1(C)C ZINC000623439657 359332543 /nfs/dbraw/zinc/33/25/43/359332543.db2.gz SBAUEJAOTNGCSE-LLVKDONJSA-N 2 0 210.365 2.249 20 0 BEADRP CC[C@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)[C@H]1C[C@H]1C ZINC000423437824 192769653 /nfs/dbraw/zinc/76/96/53/192769653.db2.gz QVBDFSNGYMGWKK-QPGZIWCOSA-N 2 0 236.403 2.399 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+]C[C@@H]1CCC[C@H]([NH3+])C1 ZINC000423467409 192782223 /nfs/dbraw/zinc/78/22/23/192782223.db2.gz IVSKKEREXFXQIG-BZPMIXESSA-N 2 0 236.359 2.318 20 0 BEADRP C(C[NH2+][C@H]1CCC12CCC2)C[C@@H]1CCC[NH2+]1 ZINC000423487225 192791677 /nfs/dbraw/zinc/79/16/77/192791677.db2.gz TYJQAOGPUSEAFD-STQMWFEESA-N 2 0 222.376 2.441 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+][C@@H]1CC[C@H](C[NH3+])C1 ZINC000423518602 192801303 /nfs/dbraw/zinc/80/13/03/192801303.db2.gz UZQMCWBFPZSTIK-RWMBFGLXSA-N 2 0 233.359 2.168 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+][C@H]1CC[C@H](C[NH3+])C1 ZINC000423518599 192802462 /nfs/dbraw/zinc/80/24/62/192802462.db2.gz UZQMCWBFPZSTIK-AVGNSLFASA-N 2 0 233.359 2.168 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000423508071 192797638 /nfs/dbraw/zinc/79/76/38/192797638.db2.gz KKVMLRGJPCNXPT-KCQAQPDRSA-N 3 0 249.402 2.182 20 0 BEADRP CC[C@H]([NH2+]CCC1=CC[NH2+]CC1)c1ccncc1 ZINC000423537804 192808005 /nfs/dbraw/zinc/80/80/05/192808005.db2.gz LBSHYEPSUFGZNM-HNNXBMFYSA-N 2 0 245.370 2.432 20 0 BEADRP CC[C@@H]([NH2+]CCC1=CC[NH2+]CC1)C(C)C ZINC000423553021 192811312 /nfs/dbraw/zinc/81/13/12/192811312.db2.gz JYYZGSRSXTZYBA-CYBMUJFWSA-N 2 0 210.365 2.320 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+][C@H](C)CC[NH+](C)C ZINC000309000646 491141481 /nfs/dbraw/zinc/14/14/81/491141481.db2.gz NZBOUFCPFJAXPQ-AGIUHOORSA-N 2 0 212.381 2.351 20 0 BEADRP C[C@@H](C[NH2+][C@H](C)C1CC[NH+](C)CC1)C1CC1 ZINC000132958926 491143833 /nfs/dbraw/zinc/14/38/33/491143833.db2.gz QAGWRMDAEJLANU-NWDGAFQWSA-N 2 0 224.392 2.352 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CCCC23CC3)C1 ZINC000578454352 366573594 /nfs/dbraw/zinc/57/35/94/366573594.db2.gz XLDZAYNGWDHVOO-CHWSQXEVSA-N 2 0 222.376 2.251 20 0 BEADRP CCC1(CC)CC[N@H+](C[C@@]2(C)CC[NH2+]C2)C1 ZINC000087255325 359904046 /nfs/dbraw/zinc/90/40/46/359904046.db2.gz RHFJMOYJTULALP-ZDUSSCGKSA-N 2 0 224.392 2.498 20 0 BEADRP CC1(C)CC[C@H]([NH2+]CCCn2ccnc2)C1 ZINC000087769811 359926714 /nfs/dbraw/zinc/92/67/14/359926714.db2.gz BGEZGLNYQFMMNE-LBPRGKRZSA-N 2 0 221.348 2.442 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@H]2CCC[C@H](F)C2)C1 ZINC000578787451 366650583 /nfs/dbraw/zinc/65/05/83/366650583.db2.gz PEOVDXUUAZIOMO-USZNOCQGSA-N 2 0 214.328 2.127 20 0 BEADRP COCc1cccc(C[NH2+]C2CCC([NH3+])CC2)c1 ZINC000088553674 359965815 /nfs/dbraw/zinc/96/58/15/359965815.db2.gz VYQUWGBNSSLLPD-UHFFFAOYSA-N 2 0 248.370 2.193 20 0 BEADRP COCc1ccc(C[NH2+]C2CCC([NH3+])CC2)cc1 ZINC000088568374 359967611 /nfs/dbraw/zinc/96/76/11/359967611.db2.gz FUVAEWHVGSETET-UHFFFAOYSA-N 2 0 248.370 2.193 20 0 BEADRP c1ccc2c(c1)CC[N@@H+](CC[C@H]1CC[NH2+]C1)C2 ZINC000089749101 360036598 /nfs/dbraw/zinc/03/65/98/360036598.db2.gz CYYWDDBQFLESLZ-CYBMUJFWSA-N 2 0 230.355 2.044 20 0 BEADRP COCc1cccc(C[NH2+][C@H]2CCC[C@H]2C[NH3+])c1 ZINC000089150223 359993901 /nfs/dbraw/zinc/99/39/01/359993901.db2.gz BWKLLHWGOGOJMA-GJZGRUSLSA-N 2 0 248.370 2.050 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]CCCOc1ccccc1 ZINC000089150543 359994135 /nfs/dbraw/zinc/99/41/35/359994135.db2.gz JERVFUSNRQGWOZ-DZGCQCFKSA-N 2 0 248.370 2.173 20 0 BEADRP COCc1ccccc1C[NH2+][C@@H]1CCC[C@H]1C[NH3+] ZINC000089149878 359994140 /nfs/dbraw/zinc/99/41/40/359994140.db2.gz ZCGAEWAIUHBVFQ-SWLSCSKDSA-N 2 0 248.370 2.050 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc(F)c(F)c1 ZINC000089150406 359994258 /nfs/dbraw/zinc/99/42/58/359994258.db2.gz VFKMFTFOCZBGEG-GWCFXTLKSA-N 2 0 240.297 2.182 20 0 BEADRP C([NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)C1(C2CC2)CC1 ZINC000090772697 360086310 /nfs/dbraw/zinc/08/63/10/360086310.db2.gz VUZHWDSIQVJVQA-UONOGXRCSA-N 2 0 234.387 2.393 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@H]1CCOC2(CCC2)C1 ZINC000094370485 360306429 /nfs/dbraw/zinc/30/64/29/360306429.db2.gz KMHDUSWRRFRUJW-OLZOCXBDSA-N 2 0 240.391 2.018 20 0 BEADRP c1nc2n(c1C[NH2+][C@@H]1CCCC13CC3)CCC2 ZINC000631192305 360573564 /nfs/dbraw/zinc/57/35/64/360573564.db2.gz KLQGJSWCTDGMHE-GFCCVEGCSA-N 2 0 231.343 2.252 20 0 BEADRP C[C@@H](CC1CCC1)[NH2+]CC1=CC[N@H+](C)CC1 ZINC000309520315 491149888 /nfs/dbraw/zinc/14/98/88/491149888.db2.gz ZUZGMZOPDKTBHU-LBPRGKRZSA-N 2 0 222.376 2.417 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@@H](C)CCCC(F)(F)F ZINC000414882297 200774005 /nfs/dbraw/zinc/77/40/05/200774005.db2.gz TXWAMIURNVDRHG-IUCAKERBSA-N 2 0 226.286 2.292 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H](c1cccnc1)C1CC1 ZINC000423017030 200855299 /nfs/dbraw/zinc/85/52/99/200855299.db2.gz VHSJCMDYMBKXNJ-RISCZKNCSA-N 2 0 233.359 2.250 20 0 BEADRP C[NH2+]CCOCC[NH2+][C@H]1CCC(C)(C)C[C@H]1C ZINC000629404194 361050309 /nfs/dbraw/zinc/05/03/09/361050309.db2.gz LROGNINQQFUUFR-OLZOCXBDSA-N 2 0 242.407 2.027 20 0 BEADRP C[NH2+]CCOCC[NH2+][C@@H](C)CCC1CCCC1 ZINC000629405853 361053350 /nfs/dbraw/zinc/05/33/50/361053350.db2.gz VQSKGWNMGPFFFN-ZDUSSCGKSA-N 2 0 242.407 2.171 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+][C@@H]1CCC[C@H](C2CC2)C1 ZINC000629408343 361059640 /nfs/dbraw/zinc/05/96/40/361059640.db2.gz UBXUDVPATKCRMD-SCUASFONSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+]CC1CCCCCC1 ZINC000629408444 361059737 /nfs/dbraw/zinc/05/97/37/361059737.db2.gz VHHJOFRBSDXDGT-WCQYABFASA-N 2 0 210.365 2.297 20 0 BEADRP Cc1nc(C(C)C)ccc1C[N@@H+]1CC[C@@H](C[NH3+])C1 ZINC000629510642 361108591 /nfs/dbraw/zinc/10/85/91/361108591.db2.gz DMRYERMHSZHDOU-ZDUSSCGKSA-N 2 0 247.386 2.294 20 0 BEADRP CCC[C@H](C)CCCN1CCO[C@H]([C@H](C)[NH3+])C1 ZINC000629515994 361109691 /nfs/dbraw/zinc/10/96/91/361109691.db2.gz YUEYLDTZTDDQKC-IHRRRGAJSA-N 2 0 242.407 2.251 20 0 BEADRP Cc1cccc2c1C[C@H]([NH2+][C@@H](C)C[C@@H](C)[NH3+])CO2 ZINC000629513162 361110308 /nfs/dbraw/zinc/11/03/08/361110308.db2.gz FMJCENGYULFGEW-AGIUHOORSA-N 2 0 248.370 2.014 20 0 BEADRP CCC[C@H](C)CCC[N@H+](C)CCC[NH3+] ZINC000629515007 361112147 /nfs/dbraw/zinc/11/21/47/361112147.db2.gz OTOYFQQLSMUJJE-LBPRGKRZSA-N 2 0 200.370 2.483 20 0 BEADRP CCC[C@H](C)[C@H](CC)[NH2+]CC1([NH3+])CCOCC1 ZINC000629520316 361116374 /nfs/dbraw/zinc/11/63/74/361116374.db2.gz GEHBDLRLMPHYLG-STQMWFEESA-N 2 0 242.407 2.299 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1[NH2+][C@@H](C)[C@H]1CC1(C)C ZINC000629527487 361131111 /nfs/dbraw/zinc/13/11/11/361131111.db2.gz WYNDXVURJKPHEE-WHOHXGKFSA-N 2 0 210.365 2.151 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1[NH2+][C@@H](C)CCC1CC1 ZINC000629526952 361131550 /nfs/dbraw/zinc/13/15/50/361131550.db2.gz FVDANOFZHOXHJU-WCFLWFBJSA-N 2 0 210.365 2.295 20 0 BEADRP CCC[C@H]([NH2+]CCOCC[NH2+]C)C1CCCC1 ZINC000629531090 361145763 /nfs/dbraw/zinc/14/57/63/361145763.db2.gz ZWCCLSGCKCRKCR-AWEZNQCLSA-N 2 0 242.407 2.171 20 0 BEADRP C[NH2+]CCOCC[NH2+][C@@H]1CCC[C@H](C(C)C)C1 ZINC000629530815 361145856 /nfs/dbraw/zinc/14/58/56/361145856.db2.gz RXLSPDVDCSOKTQ-UONOGXRCSA-N 2 0 242.407 2.027 20 0 BEADRP C[NH2+]CCOCC[NH2+][C@@H]1CCCC[C@H]1C(C)C ZINC000629529949 361146548 /nfs/dbraw/zinc/14/65/48/361146548.db2.gz REWXQNWXIHROGQ-UONOGXRCSA-N 2 0 242.407 2.027 20 0 BEADRP CCO[C@H](C[N@@H+]1CCCC[C@H]1CC[NH3+])C1CC1 ZINC000629531657 361148810 /nfs/dbraw/zinc/14/88/10/361148810.db2.gz SUIWLOSJSLONAX-UONOGXRCSA-N 2 0 240.391 2.005 20 0 BEADRP CCCC[C@H](C)[C@@H](C)[NH2+]CC1([NH3+])CCOCC1 ZINC000629521795 361121831 /nfs/dbraw/zinc/12/18/31/361121831.db2.gz UNDWNAINDPRXOM-QWHCGFSZSA-N 2 0 242.407 2.299 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1N[C@@H](C)c1ccccc1OC ZINC000629524189 361122108 /nfs/dbraw/zinc/12/21/08/361122108.db2.gz NKSFJFNMKZJXPR-FPMFFAJLSA-N 2 0 248.370 2.486 20 0 BEADRP CC[C@H]([NH2+]CC1([NH3+])CCOCC1)C1CCCC1 ZINC000629522083 361123549 /nfs/dbraw/zinc/12/35/49/361123549.db2.gz XGMSYSAEEWKMCT-ZDUSSCGKSA-N 2 0 240.391 2.053 20 0 BEADRP CC[C@@H]([NH2+]CC1([NH3+])CCOCC1)C1CCCC1 ZINC000629522082 361123649 /nfs/dbraw/zinc/12/36/49/361123649.db2.gz XGMSYSAEEWKMCT-CYBMUJFWSA-N 2 0 240.391 2.053 20 0 BEADRP C[C@H]1CC[C@H](C)[N@H+](CCCc2cncn2C)C1 ZINC000579137397 366721854 /nfs/dbraw/zinc/72/18/54/366721854.db2.gz AZERKVAZAUYTKR-STQMWFEESA-N 2 0 235.375 2.473 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]CC[C@@H]1CC1(F)F ZINC000622043845 370675283 /nfs/dbraw/zinc/67/52/83/370675283.db2.gz NNAKMAUQVPWRGI-HBNTYKKESA-N 2 0 232.318 2.139 20 0 BEADRP FC1(F)C[C@@H]1CC[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000622043721 370675713 /nfs/dbraw/zinc/67/57/13/370675713.db2.gz IQQINODSPYCCTB-WISYIIOYSA-N 2 0 244.329 2.009 20 0 BEADRP CC1CC(C[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)C1 ZINC000622044316 370675995 /nfs/dbraw/zinc/67/59/95/370675995.db2.gz ARFJHSQZHCHSGC-PNKMZZHYSA-N 2 0 222.376 2.010 20 0 BEADRP CO[C@@H](c1ccccc1)[C@H](C)[NH2+]CC[C@H](C)[NH3+] ZINC000622044840 370676735 /nfs/dbraw/zinc/67/67/35/370676735.db2.gz UVNZJBCRKUMVQD-SGMGOOAPSA-N 2 0 236.359 2.090 20 0 BEADRP Cc1ccc([C@H](C)[NH2+]CC[C@H](C)[NH3+])c(C)n1 ZINC000622045423 370679792 /nfs/dbraw/zinc/67/97/92/370679792.db2.gz SWYKMMROFHDMEH-ONGXEEELSA-N 2 0 221.348 2.086 20 0 BEADRP C[C@]1(C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)C[C@H]2C[C@H]2C1 ZINC000629537528 361401266 /nfs/dbraw/zinc/40/12/66/361401266.db2.gz KZRMLNNIWGKVDJ-ITGHMWBKSA-N 2 0 222.376 2.282 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+]CCOCCC[NH3+])cc1 ZINC000629539755 361401298 /nfs/dbraw/zinc/40/12/98/361401298.db2.gz NRFMTXMWXUHFPH-CYBMUJFWSA-N 2 0 236.359 2.011 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCOCCC[NH3+])c2ccccc21 ZINC000629535357 361410069 /nfs/dbraw/zinc/41/00/69/361410069.db2.gz BZTOIDBNKDDIAQ-IUODEOHRSA-N 2 0 248.370 2.190 20 0 BEADRP C[C@@H](N[C@@H]1CC[NH2+][C@H]1C)c1cc(F)cc(F)c1 ZINC000629547105 361430264 /nfs/dbraw/zinc/43/02/64/361430264.db2.gz GFVDPHXGENNCNV-VYUIOLGVSA-N 2 0 240.297 2.366 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]C[C@H]1CCCC12CC2 ZINC000629555066 361435455 /nfs/dbraw/zinc/43/54/55/361435455.db2.gz QUFKRCRIJKRNOK-SDDRHHMPSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]C[C@@H]1CCCC12CC2 ZINC000629555068 361435741 /nfs/dbraw/zinc/43/57/41/361435741.db2.gz QUFKRCRIJKRNOK-TUAOUCFPSA-N 2 0 210.365 2.282 20 0 BEADRP c1ccc(C[C@H]2CC[C@H]([NH2+][C@@H]3CC[NH2+]C3)C2)cc1 ZINC000629553262 361437685 /nfs/dbraw/zinc/43/76/85/361437685.db2.gz SPDZRFKCYIEFBF-OWCLPIDISA-N 2 0 244.382 2.349 20 0 BEADRP CC[C@@H]1C[C@@H](C)CC[C@H]1[NH2+][C@@H]1CC[NH2+]C1 ZINC000629553319 361438711 /nfs/dbraw/zinc/43/87/11/361438711.db2.gz JCLYVLMQJXVSEH-UMSGYPCISA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CCCC12CC2)[C@H]1CCC[NH2+]1 ZINC000629554278 361440193 /nfs/dbraw/zinc/44/01/93/361440193.db2.gz HGYIPMFUXMZEAZ-FRRDWIJNSA-N 2 0 222.376 2.297 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CCCC12CC2 ZINC000629555206 361446257 /nfs/dbraw/zinc/44/62/57/361446257.db2.gz RVCYJYJWITTZBO-XQQFMLRXSA-N 2 0 222.376 2.284 20 0 BEADRP C[C@@H]1C[N@@H+]([C@H]2CCc3ccc(F)cc32)CC[C@H]1[NH3+] ZINC000430941313 201158835 /nfs/dbraw/zinc/15/88/35/201158835.db2.gz VPRCWGIJHVLZDR-KMUNFCNLSA-N 2 0 248.345 2.482 20 0 BEADRP C[N@H+](CCOCC[NH3+])C[C@H]1CCCCC1(C)C ZINC000629581273 361470611 /nfs/dbraw/zinc/47/06/11/361470611.db2.gz UKZAQYHJFURDFN-CYBMUJFWSA-N 2 0 242.407 2.110 20 0 BEADRP COc1cccc2c1CN(C[C@@H]1CCC[NH2+]C1)C2 ZINC000629580904 361471684 /nfs/dbraw/zinc/47/16/84/361471684.db2.gz YCPXODGWOVAGKT-GFCCVEGCSA-N 2 0 246.354 2.010 20 0 BEADRP C[C@]12C[NH2+]C[C@@]1(C)C[N@H+](CCC1CCC1)C2 ZINC000629595939 361483149 /nfs/dbraw/zinc/48/31/49/361483149.db2.gz UJKVVJDYCROJDH-OKILXGFUSA-N 2 0 222.376 2.108 20 0 BEADRP C[NH2+]CCC[NH2+]Cc1ccc(C)c(Cl)c1 ZINC000163318943 361453040 /nfs/dbraw/zinc/45/30/40/361453040.db2.gz SWKIGTZGKSDUQW-UHFFFAOYSA-N 2 0 226.751 2.348 20 0 BEADRP CC(C)C[C@@H]([NH3+])C[NH2+]C[C@H](C)c1ccncc1 ZINC000629656141 361561752 /nfs/dbraw/zinc/56/17/52/361561752.db2.gz OBCYOXTVMCFQCZ-GXTWGEPZSA-N 2 0 235.375 2.148 20 0 BEADRP CC(C)CCC[N@@H+]1C[C@@]2(C)C[NH2+]C[C@@]2(C)C1 ZINC000629667381 361589041 /nfs/dbraw/zinc/58/90/41/361589041.db2.gz PJNDEQHXUTWDDR-OKILXGFUSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+]C[C@H]1CCC[C@@H](C)C1 ZINC000629672441 361614496 /nfs/dbraw/zinc/61/44/96/361614496.db2.gz SDVACCIKBVSEIY-MROQNXINSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H](Cc1ccccc1)C[N@@H+]1CC[C@H](C[NH3+])C1 ZINC000435378809 201265274 /nfs/dbraw/zinc/26/52/74/201265274.db2.gz KAPBGEUSQXXVEV-UKRRQHHQSA-N 2 0 232.371 2.146 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](C[C@@H](C)Cc2ccccc2)C1 ZINC000435377072 201265518 /nfs/dbraw/zinc/26/55/18/201265518.db2.gz XUHHPSSGITZWTN-HOCLYGCPSA-N 2 0 246.398 2.407 20 0 BEADRP CCC(CC)C[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000154174948 201265981 /nfs/dbraw/zinc/26/59/81/201265981.db2.gz DXBIIQRZHASUKU-DGCLKSJQSA-N 2 0 212.381 2.495 20 0 BEADRP CC[N@H+](Cc1ccc(C)nc1)[C@H]1CCC[NH2+]CC1 ZINC000435392195 201268254 /nfs/dbraw/zinc/26/82/54/201268254.db2.gz GHIHOSNWMXMSLR-HNNXBMFYSA-N 2 0 247.386 2.354 20 0 BEADRP CO[C@H](c1ccc(C2=CC[NH2+]CC2)cc1)[C@@H](C)[NH3+] ZINC000629723268 361664868 /nfs/dbraw/zinc/66/48/68/361664868.db2.gz LUOURNACHWBYNT-ABAIWWIYSA-N 2 0 246.354 2.098 20 0 BEADRP C[C@@H]([NH2+]CCC[NH+]1CCCCC1)[C@H]1CCCO1 ZINC000154413970 201277755 /nfs/dbraw/zinc/27/77/55/201277755.db2.gz HTCLUIDSMNLLHL-ZIAGYGMSSA-N 2 0 240.391 2.020 20 0 BEADRP C[NH2+]CCC[N@H+](C)[C@H](C)Cc1ccc(C)cc1 ZINC000435873636 201292093 /nfs/dbraw/zinc/29/20/93/201292093.db2.gz DYZMRVUTUMFGHP-CQSZACIVSA-N 2 0 234.387 2.467 20 0 BEADRP C[C@H]([NH3+])CCc1ccc(C2=CC[NH2+]CC2)cc1 ZINC000629722950 361663409 /nfs/dbraw/zinc/66/34/09/361663409.db2.gz IJFCFKKYABSVNO-LBPRGKRZSA-N 2 0 230.355 2.343 20 0 BEADRP c1cc(C2=CC[NH2+]CC2)cc([C@@H]2CCC[NH2+]2)c1 ZINC000629722789 361663864 /nfs/dbraw/zinc/66/38/64/361663864.db2.gz DTEJQJBGTCHUJU-HNNXBMFYSA-N 2 0 228.339 2.488 20 0 BEADRP CC[N@H+](CCC[NH2+]C)Cc1ccccc1C ZINC000435882306 201296308 /nfs/dbraw/zinc/29/63/08/201296308.db2.gz XXSYWRLLWJHWJG-UHFFFAOYSA-N 2 0 220.360 2.426 20 0 BEADRP C[NH2+]CCC[N@@H+]1CC[C@@H](Cc2ccccc2)C1 ZINC000435880141 201293589 /nfs/dbraw/zinc/29/35/89/201293589.db2.gz NOGYXIYAAPBKKE-HNNXBMFYSA-N 2 0 232.371 2.161 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCC[C@@H]1c1cccc(OC)c1 ZINC000435872706 201294117 /nfs/dbraw/zinc/29/41/17/201294117.db2.gz QCHQMIOIWIQONU-OAHLLOKOSA-N 2 0 248.370 2.442 20 0 BEADRP C[NH+](C)CCC1CC[NH+](CC2CC2)CC1 ZINC000155676440 201345007 /nfs/dbraw/zinc/34/50/07/201345007.db2.gz KOFUEFJFXUVDFD-UHFFFAOYSA-N 2 0 210.365 2.060 20 0 BEADRP CSc1ccccc1C[C@H](C)[NH2+]CCC[NH3+] ZINC000437768980 201371969 /nfs/dbraw/zinc/37/19/69/201371969.db2.gz CVDAULSPJKQCMS-NSHDSACASA-N 2 0 238.400 2.278 20 0 BEADRP [NH3+]CC1CC[NH+](Cc2ccc(F)cc2F)CC1 ZINC000044511882 181365759 /nfs/dbraw/zinc/36/57/59/181365759.db2.gz BVBJXHJKSYQWDG-UHFFFAOYSA-N 2 0 240.297 2.136 20 0 BEADRP [NH3+]CC1CC[NH+](Cc2cccc(F)c2F)CC1 ZINC000036888774 181365282 /nfs/dbraw/zinc/36/52/82/181365282.db2.gz FMBRRLLFXKVAJM-UHFFFAOYSA-N 2 0 240.297 2.136 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH+](C)CC2(C)CC2)[C@H](C)C1 ZINC000573633583 364880181 /nfs/dbraw/zinc/88/01/81/364880181.db2.gz HDMHDWVVFURXKB-OLZOCXBDSA-N 2 0 224.392 2.449 20 0 BEADRP CCC[N@H+](C)C[C@H]1CC[NH+]([C@H](C)CCOC)C1 ZINC000446785326 541391309 /nfs/dbraw/zinc/39/13/09/541391309.db2.gz KYWFGCUGDAUKAW-ZIAGYGMSSA-N 2 0 242.407 2.075 20 0 BEADRP Cc1cnccc1C[NH2+]CC[C@H]1CCC[N@@H+](C)C1 ZINC000573806727 364921266 /nfs/dbraw/zinc/92/12/66/364921266.db2.gz OJMBFDITFUBSGN-CQSZACIVSA-N 2 0 247.386 2.212 20 0 BEADRP [NH3+]CCCC[N@@H+]1CCC[C@H]2CCCC[C@H]21 ZINC000036826509 181376439 /nfs/dbraw/zinc/37/64/39/181376439.db2.gz WRNWAXPGEMRLNZ-CHWSQXEVSA-N 2 0 210.365 2.380 20 0 BEADRP [NH3+]CCCC[NH2+]Cc1cccc2cccnc21 ZINC000037715153 181377909 /nfs/dbraw/zinc/37/79/09/181377909.db2.gz FUFXWRPEFKZHEA-UHFFFAOYSA-N 2 0 229.327 2.063 20 0 BEADRP [NH3+]CCCC[NH2+][C@@H](c1ccccc1)C1CC1 ZINC000041045567 181377931 /nfs/dbraw/zinc/37/79/31/181377931.db2.gz ZWHVRMPRNHSPRK-AWEZNQCLSA-N 2 0 218.344 2.466 20 0 BEADRP [NH3+]CCCC[NH2+]Cc1ccccc1Cl ZINC000037714607 181377483 /nfs/dbraw/zinc/37/74/83/181377483.db2.gz NYOAATMWAPNIRV-UHFFFAOYSA-N 2 0 212.724 2.169 20 0 BEADRP COc1cccc2c1CCC[C@@H]2N[C@H](C)[C@H](C)[NH3+] ZINC000573953365 364953995 /nfs/dbraw/zinc/95/39/95/364953995.db2.gz ZVYPQCGCOSRBJV-WDMOLILDSA-N 2 0 248.370 2.398 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]Cc1cc(C)sc1C ZINC000574174962 365003743 /nfs/dbraw/zinc/00/37/43/365003743.db2.gz HLGPKXBLLWOILL-VIFPVBQESA-N 2 0 226.389 2.310 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+][C@H]1CC[NH2+][C@H](C)C1 ZINC000574191059 365006874 /nfs/dbraw/zinc/00/68/74/365006874.db2.gz ALMNGMSDWKCLKF-NDBYEHHHSA-N 2 0 210.365 2.295 20 0 BEADRP CCCOc1ccc(C[NH2+][C@@H](C)CC[NH3+])cc1 ZINC000574782110 365142682 /nfs/dbraw/zinc/14/26/82/365142682.db2.gz LSXFIHVYQQLFJU-LBPRGKRZSA-N 2 0 236.359 2.302 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[C@@H](C[NH3+])C1 ZINC000574802196 365146362 /nfs/dbraw/zinc/14/63/62/365146362.db2.gz AUZSXYLOJRVUKE-LPWJVIDDSA-N 2 0 210.365 2.282 20 0 BEADRP Cc1cc(NCC[N@@H+]2CCCC(C)(C)C2)cc[nH+]1 ZINC000443957216 193032424 /nfs/dbraw/zinc/03/24/24/193032424.db2.gz KSNBFAINTKSBJK-UHFFFAOYSA-N 2 0 247.386 2.346 20 0 BEADRP C(C1CC1)[NH+]1CCC([NH2+]C2CCC2)CC1 ZINC000379805740 365274461 /nfs/dbraw/zinc/27/44/61/365274461.db2.gz NUFSGHNSLASWSW-UHFFFAOYSA-N 2 0 208.349 2.003 20 0 BEADRP C[C@H]([NH2+][C@@H](C)[C@@H]1CC2CCC1CC2)C1C[NH2+]C1 ZINC000575873236 365398742 /nfs/dbraw/zinc/39/87/42/365398742.db2.gz LNWMWSUZRCVKMN-NMOTYAQPSA-N 2 0 236.403 2.399 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+]CC1CC[NH+](C)CC1 ZINC000381177205 541460666 /nfs/dbraw/zinc/46/06/66/541460666.db2.gz VJPBIMQZZLQPHR-UONOGXRCSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+][C@H]1CCC[C@H](F)C1 ZINC000575989226 365437005 /nfs/dbraw/zinc/43/70/05/365437005.db2.gz XILGATKOSNNGGP-VOAKCMCISA-N 2 0 228.355 2.245 20 0 BEADRP C[N@H+](CC[C@H]1CCC[NH2+]C1)Cc1cccc(O)c1 ZINC000576016230 365452567 /nfs/dbraw/zinc/45/25/67/365452567.db2.gz NLAIXZSVWJXSPF-CYBMUJFWSA-N 2 0 248.370 2.214 20 0 BEADRP c1cn(CCC[NH+]2C[C@H]3CCCC[C@@H]3C2)cn1 ZINC000182829791 366948509 /nfs/dbraw/zinc/94/85/09/366948509.db2.gz USVUCRNSXKJTSR-ZIAGYGMSSA-N 2 0 233.359 2.395 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H]1C[C@@H](OC)C1(CC)CC ZINC000580827656 367177992 /nfs/dbraw/zinc/17/79/92/367177992.db2.gz XVQJCRUDGDTDGA-QWHCGFSZSA-N 2 0 242.407 2.169 20 0 BEADRP C(C[N@@H+]1[C@H]2CC[C@@H]1CCC2)[C@H]1CC[NH2+]C1 ZINC000380647468 367265650 /nfs/dbraw/zinc/26/56/50/367265650.db2.gz WKKHKRWNLMWDLH-UPJWGTAASA-N 2 0 208.349 2.003 20 0 BEADRP CC[C@H]1CCC[C@@H]1[NH2+]CC1=CC[N@H+](C)CC1 ZINC000381357994 367388101 /nfs/dbraw/zinc/38/81/01/367388101.db2.gz DTBPOCUVBJMZJG-KBPBESRZSA-N 2 0 222.376 2.417 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@@H]2C[C@@H](C)[C@@H]2C)CC1 ZINC000381382784 367391161 /nfs/dbraw/zinc/39/11/61/367391161.db2.gz LDMOLYZDDDTLHL-MBNYWOFBSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@H](C[NH2+][C@H](C)Cc1ccsc1)C[NH+](C)C ZINC000381455940 367407397 /nfs/dbraw/zinc/40/73/97/367407397.db2.gz IJRPRCURNRACCP-VXGBXAGGSA-N 2 0 240.416 2.466 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])NCc1noc2ccccc12 ZINC000581440237 367473187 /nfs/dbraw/zinc/47/31/87/367473187.db2.gz ZJAHTOHVSZWSQW-VHSXEESVSA-N 2 0 233.315 2.043 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]CCC[NH2+]C2CC2)C1 ZINC000382604787 367548066 /nfs/dbraw/zinc/54/80/66/367548066.db2.gz VRIYZMDTRDOFGO-YPMHNXCESA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]1CCC[C@@H]([NH2+]CCC[NH2+]C2CC2)C1 ZINC000382604786 367548720 /nfs/dbraw/zinc/54/87/20/367548720.db2.gz VRIYZMDTRDOFGO-WCQYABFASA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H](c1ccncc1)[N@H+](C)C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000383923005 367659935 /nfs/dbraw/zinc/65/99/35/367659935.db2.gz HXOXLXGVPCRTBH-MGPQQGTHSA-N 2 0 247.386 2.463 20 0 BEADRP CC[C@H]1[C@@H](C)CC[N@@H+]1CCC1CC[NH2+]CC1 ZINC000384026595 367669301 /nfs/dbraw/zinc/66/93/01/367669301.db2.gz YEZMKPBYPQIIJL-JSGCOSHPSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]([NH3+])CN1CCC(OCc2ccccc2)CC1 ZINC000384031284 367669797 /nfs/dbraw/zinc/66/97/97/367669797.db2.gz AXDGZZYGEVJNHJ-ZDUSSCGKSA-N 2 0 248.370 2.015 20 0 BEADRP CC[C@@H]1[C@H](C)CC[N@@H+]1C[C@@H]1CC[NH2+][C@@H](C)C1 ZINC000384156545 367672800 /nfs/dbraw/zinc/67/28/00/367672800.db2.gz LPKOOOMJKVLJIL-XJFOESAGSA-N 2 0 224.392 2.495 20 0 BEADRP CC/C=C/C[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000384889882 367752336 /nfs/dbraw/zinc/75/23/36/367752336.db2.gz SZQBPCLDVKAEIE-CDJBXZAQSA-N 2 0 208.349 2.169 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)[C@@H]1C ZINC000385668406 367853252 /nfs/dbraw/zinc/85/32/52/367853252.db2.gz PHYKOMFUNCNUIC-NCXFDQOBSA-N 2 0 222.376 2.246 20 0 BEADRP C(C1CCCCCC1)[N@@H+]1CC[C@@H]2C[NH2+]C[C@@H]21 ZINC000385359935 367821839 /nfs/dbraw/zinc/82/18/39/367821839.db2.gz HUUPHSDABQQQRG-KGLIPLIRSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@@H](CCN1CC[C@@H]2C[NH2+]C[C@@H]21)c1ccccc1 ZINC000385409979 367826133 /nfs/dbraw/zinc/82/61/33/367826133.db2.gz YTYPXBYWUQUZCC-IMJJTQAJSA-N 2 0 244.382 2.474 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCC[C@H]([NH3+])C2)[C@@H]1C ZINC000386080298 367909233 /nfs/dbraw/zinc/90/92/33/367909233.db2.gz DACAMVMKCCNNGB-KVSVUVNWSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CC1(C)C)[C@H]1CCCC[NH2+]1 ZINC000386100085 367912639 /nfs/dbraw/zinc/91/26/39/367912639.db2.gz JQHZTZLVKPOQFY-SDDRHHMPSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC1(C)C)[C@@H]1CCCC[NH2+]1 ZINC000386129365 367915922 /nfs/dbraw/zinc/91/59/22/367915922.db2.gz OHHNMWGJKIJTPJ-SDDRHHMPSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC1(C)C)[C@H]1CCCC[NH2+]1 ZINC000386129372 367916114 /nfs/dbraw/zinc/91/61/14/367916114.db2.gz OHHNMWGJKIJTPJ-TUAOUCFPSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H](c1cccnc1)[N@H+]1CC[C@H]2C[NH2+]C[C@H]2CC1 ZINC000386181225 367925984 /nfs/dbraw/zinc/92/59/84/367925984.db2.gz IWDVHWFKQGQPNP-YUELXQCFSA-N 2 0 245.370 2.074 20 0 BEADRP C[C@H]([NH2+]C[C@]1(C)CCCS1)[C@H]1CCCC[NH2+]1 ZINC000386536706 367988993 /nfs/dbraw/zinc/98/89/93/367988993.db2.gz CBVUJVZQMCDJAY-XQQFMLRXSA-N 2 0 242.432 2.392 20 0 BEADRP C[C@H]([NH2+]CC1CCSCC1)[C@@H]1CCCC[NH2+]1 ZINC000386567236 367994051 /nfs/dbraw/zinc/99/40/51/367994051.db2.gz KNPUPANPQBIODX-AAEUAGOBSA-N 2 0 242.432 2.250 20 0 BEADRP CC(C)OCCCC[NH2+][C@@H](C)[C@H]1CCCC[NH2+]1 ZINC000386476574 367978646 /nfs/dbraw/zinc/97/86/46/367978646.db2.gz RIVRHRYZKDOFQG-UONOGXRCSA-N 2 0 242.407 2.312 20 0 BEADRP CCOCC(C)(C)C[NH2+][C@H](C)[C@H]1CCCC[NH2+]1 ZINC000386505995 367981684 /nfs/dbraw/zinc/98/16/84/367981684.db2.gz WMPTVIVGCDVPDG-CHWSQXEVSA-N 2 0 242.407 2.169 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CC12CCCC2 ZINC000387025117 368041500 /nfs/dbraw/zinc/04/15/00/368041500.db2.gz NGAYLCGCKNEZAR-AVGNSLFASA-N 2 0 222.376 2.426 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H]1CC12CCCC2 ZINC000386904375 368032658 /nfs/dbraw/zinc/03/26/58/368032658.db2.gz BUBLCZZBUMNFJI-NWDGAFQWSA-N 2 0 210.365 2.426 20 0 BEADRP C[NH+](C)CCCC(C)(C)[NH2+]Cc1cc[nH]c1 ZINC000387164906 368084830 /nfs/dbraw/zinc/08/48/30/368084830.db2.gz FVRIBPSMVROZPY-UHFFFAOYSA-N 2 0 223.364 2.225 20 0 BEADRP C[C@H](C[N@H+](C)C[C@@H]1CC[NH2+]C1)C(C)(C)C ZINC000399697693 368486303 /nfs/dbraw/zinc/48/63/03/368486303.db2.gz BLUJAYOHLSOWSY-VXGBXAGGSA-N 2 0 212.381 2.210 20 0 BEADRP C[C@H](Cc1ccsc1)[NH2+][C@@H]1CC[C@H](C[NH3+])C1 ZINC000567220629 326144288 /nfs/dbraw/zinc/14/42/88/326144288.db2.gz HHUSJJQLNFUYMQ-NTZNESFSSA-N 2 0 238.400 2.396 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]CCc2ccccc2)C1 ZINC000086401891 368880222 /nfs/dbraw/zinc/88/02/22/368880222.db2.gz QISVAEBUPQPFHA-ZIAGYGMSSA-N 2 0 218.344 2.089 20 0 BEADRP c1ccc2c(c1)CC[NH+](CC[C@H]1CC[NH2+]C1)CC2 ZINC000089749519 368952519 /nfs/dbraw/zinc/95/25/19/368952519.db2.gz TUOGDPMQIHBWAX-CQSZACIVSA-N 2 0 244.382 2.087 20 0 BEADRP C[N@@H+]1CCCC[C@@H](C[NH2+][C@@H]2CCCSC2)C1 ZINC000623656992 368998168 /nfs/dbraw/zinc/99/81/68/368998168.db2.gz HHZAHOAAHCZMRE-QWHCGFSZSA-N 2 0 242.432 2.204 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)C1CC1 ZINC000623655838 368991763 /nfs/dbraw/zinc/99/17/63/368991763.db2.gz GZPJSKKWKHMYDS-VXGBXAGGSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1C[N@H+](CCCC2CCC2)C[C@H]1C[NH3+] ZINC000631836729 369088789 /nfs/dbraw/zinc/08/87/89/369088789.db2.gz FZKXJWXTONATET-DGCLKSJQSA-N 2 0 210.365 2.093 20 0 BEADRP CCc1ccc(C[N@@H+]2C[C@H](C)[C@H](C[NH3+])C2)cc1 ZINC000631837392 369094355 /nfs/dbraw/zinc/09/43/55/369094355.db2.gz RZXVYIYBLMLVIM-SWLSCSKDSA-N 2 0 232.371 2.276 20 0 BEADRP c1ccc2c(c1)CCC[C@@H]2[NH+]1C[C@H]2C[NH2+]C[C@@H]2C1 ZINC000107856108 369362554 /nfs/dbraw/zinc/36/25/54/369362554.db2.gz PUJHUFLTTXDVAQ-FMKPAKJESA-N 2 0 242.366 2.215 20 0 BEADRP Cc1ccccc1OCCCN1C[C@H]([NH3+])C[C@H]1C ZINC000631858545 369442725 /nfs/dbraw/zinc/44/27/25/369442725.db2.gz AAOUMPGBFZSKHA-ZIAGYGMSSA-N 2 0 248.370 2.185 20 0 BEADRP C[N@@H+]1CCC[C@@H](CC[NH2+]Cc2cccc(O)c2)C1 ZINC000459728006 203344535 /nfs/dbraw/zinc/34/45/35/203344535.db2.gz HXBCARLSZTUGMF-ZDUSSCGKSA-N 2 0 248.370 2.214 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CC[C@@H]2CCC[N@H+](C)C2)C1 ZINC000459732731 203345761 /nfs/dbraw/zinc/34/57/61/203345761.db2.gz MSQMRISNRYGPIN-HZSPNIEDSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H]1OCC[C@H]1[NH2+]CCC[NH+]1CCCCC1 ZINC000459770634 203363526 /nfs/dbraw/zinc/36/35/26/203363526.db2.gz HPIBQHDHWUNANL-KGLIPLIRSA-N 2 0 240.391 2.020 20 0 BEADRP C[C@@H]1CSC[C@H]1[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC000459798037 203372958 /nfs/dbraw/zinc/37/29/58/203372958.db2.gz XKELHXXGWGDTRY-JHJVBQTASA-N 2 0 242.432 2.059 20 0 BEADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)C2CC2)C1 ZINC000165293168 203383900 /nfs/dbraw/zinc/38/39/00/203383900.db2.gz VKQGXOPBVUMMTB-QWHCGFSZSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC[C@@H]2CCC[N@H+](C)C2)[C@@H]1C ZINC000459783932 203367191 /nfs/dbraw/zinc/36/71/91/203367191.db2.gz NMJWWDMVZUDEFV-MQYQWHSLSA-N 2 0 224.392 2.352 20 0 BEADRP CC(C)[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)C1CC1 ZINC000158250426 326312962 /nfs/dbraw/zinc/31/29/62/326312962.db2.gz DXKZCFSBKURKSH-JSGCOSHPSA-N 2 0 224.392 2.352 20 0 BEADRP C[N@@H+]1CCC[C@@H]1CC[NH2+][C@H]1CCC1(C)C ZINC000568182725 326322219 /nfs/dbraw/zinc/32/22/19/326322219.db2.gz ZOXVEXZVBDTGDJ-NEPJUHHUSA-N 2 0 210.365 2.249 20 0 BEADRP COc1ccccc1C[N@@H+]1CC[C@@H](C)[C@H](C[NH3+])C1 ZINC000253199452 370161555 /nfs/dbraw/zinc/16/15/55/370161555.db2.gz WKBONDJEZHGZOB-TZMCWYRMSA-N 2 0 248.370 2.112 20 0 BEADRP CC1CC(C[NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)C1 ZINC000621771811 370514739 /nfs/dbraw/zinc/51/47/39/370514739.db2.gz NGKGNURXKTWFEF-MVKMKZAISA-N 2 0 210.365 2.105 20 0 BEADRP CC1CC(C[NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)C1 ZINC000621771813 370515089 /nfs/dbraw/zinc/51/50/89/370515089.db2.gz NGKGNURXKTWFEF-PYNQCMFNSA-N 2 0 210.365 2.105 20 0 BEADRP CCC[NH+]1CCC([NH2+]CC[C@@H]2CC2(F)F)CC1 ZINC000621734145 370490545 /nfs/dbraw/zinc/49/05/45/370490545.db2.gz GMCCSHYQDGDFKK-LLVKDONJSA-N 2 0 246.345 2.496 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]CC[C@H]2CC2(F)F)CC1 ZINC000621734276 370490789 /nfs/dbraw/zinc/49/07/89/370490789.db2.gz JLTKAVLCDQHKEO-NSHDSACASA-N 2 0 246.345 2.494 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CC2CC(C)C2)[C@@H](C)C1 ZINC000621739715 370497134 /nfs/dbraw/zinc/49/71/34/370497134.db2.gz UHDXQWVWWIRZHZ-GNRIBBGQSA-N 2 0 224.392 2.352 20 0 BEADRP [NH3+][C@]12CCC[C@H]1C[N@H+](CC1CCCCC1)C2 ZINC000621777649 370527144 /nfs/dbraw/zinc/52/71/44/370527144.db2.gz DJBVHYATJHXSHZ-KBPBESRZSA-N 2 0 222.376 2.380 20 0 BEADRP [NH3+][C@@]12CCC[C@H]1C[N@H+](CCCC1CCC1)C2 ZINC000621783467 370534231 /nfs/dbraw/zinc/53/42/31/370534231.db2.gz BXRYMNLCFPGMPP-UONOGXRCSA-N 2 0 222.376 2.380 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+]CCCC(C)(C)C ZINC000313287845 370577834 /nfs/dbraw/zinc/57/78/34/370577834.db2.gz XWTINYDLIZRNSZ-LBPRGKRZSA-N 2 0 230.396 2.156 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H](C[NH2+]Cc2ccccc2)C1 ZINC000070503230 181580669 /nfs/dbraw/zinc/58/06/69/181580669.db2.gz AJQUQEQNKJSLHS-ZIAGYGMSSA-N 2 0 218.344 2.294 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)c1ccncc1 ZINC000624122647 371323058 /nfs/dbraw/zinc/32/30/58/371323058.db2.gz XNAKRCPUCLYEIP-ZIAGYGMSSA-N 2 0 247.386 2.464 20 0 BEADRP C[N@@H+]1CCCC[C@H](C[NH2+][C@@H]2CCC[C@H]3C[C@H]32)C1 ZINC000624123893 371324445 /nfs/dbraw/zinc/32/44/45/371324445.db2.gz SNBGIOCXBXMITM-LXTVHRRPSA-N 2 0 236.403 2.497 20 0 BEADRP C[N@@H+]1CCCC[C@@H](C[NH2+][C@@H]2CCC[C@H]3C[C@H]32)C1 ZINC000624123891 371324458 /nfs/dbraw/zinc/32/44/58/371324458.db2.gz SNBGIOCXBXMITM-BYNSBNAKSA-N 2 0 236.403 2.497 20 0 BEADRP CC[C@@H](CSC)[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000162359010 371663746 /nfs/dbraw/zinc/66/37/46/371663746.db2.gz GRSIQDAYYFSEFR-AAEUAGOBSA-N 2 0 244.448 2.448 20 0 BEADRP CSC1(C[NH2+][C@@H](C)C2CC[NH+](C)CC2)CC1 ZINC000228023760 371977447 /nfs/dbraw/zinc/97/74/47/371977447.db2.gz KTZWOJQHDYQDFF-NSHDSACASA-N 2 0 242.432 2.202 20 0 BEADRP CC1([NH3+])CC[NH+](C[C@H]2CCC(F)(F)C2)CC1 ZINC000631824818 372589855 /nfs/dbraw/zinc/58/98/55/372589855.db2.gz RANYKAJEHFNMBJ-JTQLQIEISA-N 2 0 232.318 2.235 20 0 BEADRP FCCC1CC[NH+](C[C@@H]2CCC[NH2+]C2)CC1 ZINC000631836914 372625836 /nfs/dbraw/zinc/62/58/36/372625836.db2.gz JJSGVSOEQQZWTN-CYBMUJFWSA-N 2 0 228.355 2.058 20 0 BEADRP CC(C)C[C@H](C)C[N@H+]1C[C@@H](C[NH3+])[C@H](C)C1 ZINC000631838933 372633578 /nfs/dbraw/zinc/63/35/78/372633578.db2.gz XFNPIURGBFOAOT-YNEHKIRRSA-N 2 0 212.381 2.195 20 0 BEADRP C[C@@H](c1ccc(F)cc1)[N@H+]1C[C@@H](C[NH3+])[C@H](C)C1 ZINC000631839554 372635752 /nfs/dbraw/zinc/63/57/52/372635752.db2.gz HRABYVDZHUTUSH-NTZNESFSSA-N 2 0 236.334 2.413 20 0 BEADRP Cc1ccc(CC[N@@H+]2C[C@@H](C[NH3+])[C@H](C)C2)cc1 ZINC000631840519 372636021 /nfs/dbraw/zinc/63/60/21/372636021.db2.gz SXOISGHQXVHUOW-UKRRQHHQSA-N 2 0 232.371 2.064 20 0 BEADRP C[C@@H](c1ccccc1F)[N@H+]1C[C@@H](C[NH3+])[C@H](C)C1 ZINC000631841633 372638402 /nfs/dbraw/zinc/63/84/02/372638402.db2.gz NKARUANFGWFBQI-GRYCIOLGSA-N 2 0 236.334 2.413 20 0 BEADRP C[C@@H]1C[N@H+](Cc2cccc(Cl)c2)C[C@H]1C[NH3+] ZINC000631844064 372643040 /nfs/dbraw/zinc/64/30/40/372643040.db2.gz UYGQQEXXWVPTRX-ZYHUDNBSSA-N 2 0 238.762 2.367 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]1[NH2+]C[C@H]1CCC(F)(F)C1 ZINC000631827001 372605608 /nfs/dbraw/zinc/60/56/08/372605608.db2.gz CCZNEMWSAILFQR-WDEREUQCSA-N 2 0 246.345 2.400 20 0 BEADRP [NH3+]CCC[N@@H+]1CCC[C@@H](C2CCC2)CC1 ZINC000631873984 372675548 /nfs/dbraw/zinc/67/55/48/372675548.db2.gz XGGYWHUOFKLZNG-CYBMUJFWSA-N 2 0 210.365 2.237 20 0 BEADRP CC(C)[NH2+]C1CC[NH+](CC[C@H]2CCCO2)CC1 ZINC000189656127 259557957 /nfs/dbraw/zinc/55/79/57/259557957.db2.gz ZMXJNBVWEICVOR-CQSZACIVSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@@H]1CCCC[C@H]1[NH2+][C@@H]1CCCC[C@H]1[NH3+] ZINC000424369442 206038634 /nfs/dbraw/zinc/03/86/34/206038634.db2.gz BVCLEFGVFWBPDF-FDYHWXHSSA-N 2 0 210.365 2.425 20 0 BEADRP [NH3+][C@@H]1CCCC[C@H]1[NH2+][C@H]1CCC12CCC2 ZINC000424380358 206039381 /nfs/dbraw/zinc/03/93/81/206039381.db2.gz WXZVLFLIYFQZEZ-UTUOFQBUSA-N 2 0 208.349 2.179 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](CCc2ccc(C)cc2)C1 ZINC000430915327 206061490 /nfs/dbraw/zinc/06/14/90/206061490.db2.gz CEQYOLOELAAUNK-HNNXBMFYSA-N 2 0 232.371 2.079 20 0 BEADRP CC(C)CCC[NH+]1CCC2(CC[NH2+]C2)CC1 ZINC000430909043 206061723 /nfs/dbraw/zinc/06/17/23/206061723.db2.gz LWUDZKMWZSPPCS-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP CCCC[C@@H](C)[N@H+](C)CCc1cncn1C ZINC000459497238 206130891 /nfs/dbraw/zinc/13/08/91/206130891.db2.gz IWIXHTNUKXASGN-GFCCVEGCSA-N 2 0 223.364 2.473 20 0 BEADRP C[N@H+](CCC[NH3+])Cc1cccc2ncccc12 ZINC000381976353 487528136 /nfs/dbraw/zinc/52/81/36/487528136.db2.gz CVQLYDHVUMQAEX-UHFFFAOYSA-N 2 0 229.327 2.015 20 0 BEADRP CCC[N@H+](CCC[NH3+])Cc1ccc(F)cc1 ZINC000036731896 169156350 /nfs/dbraw/zinc/15/63/50/169156350.db2.gz IMQXEBAFJPWACN-UHFFFAOYSA-N 2 0 224.323 2.387 20 0 BEADRP CCC[N@H+](CCC[NH+](C)C)CC(C)C ZINC000336687061 169156693 /nfs/dbraw/zinc/15/66/93/169156693.db2.gz MEEXOOHFWDSCID-UHFFFAOYSA-N 2 0 200.370 2.306 20 0 BEADRP CCC[N@H+](CC[C@H]1CCC[NH2+]C1)C1CC1 ZINC000051918961 169170070 /nfs/dbraw/zinc/17/00/70/169170070.db2.gz KBNJLVLPCHUVST-GFCCVEGCSA-N 2 0 210.365 2.251 20 0 BEADRP CCC[NH+]1CCC([N@H+](C)CCCCOC)CC1 ZINC000117881980 169186015 /nfs/dbraw/zinc/18/60/15/169186015.db2.gz RMFVQAJXDUQHCF-UHFFFAOYSA-N 2 0 242.407 2.219 20 0 BEADRP CCC[NH+]1CCC(C[NH2+]C[C@@H]2C[C@H]2C)CC1 ZINC000336783189 169186457 /nfs/dbraw/zinc/18/64/57/169186457.db2.gz ZQXYQPPXAPHEFL-OCCSQVGLSA-N 2 0 224.392 2.354 20 0 BEADRP CCC[NH+]1CCC([NH2+]C2CCSCC2)CC1 ZINC000035120905 169188908 /nfs/dbraw/zinc/18/89/08/169188908.db2.gz QCTTWWIRDOOYDB-UHFFFAOYSA-N 2 0 242.432 2.346 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H]2CCCSC2)CC1 ZINC000061572206 169189674 /nfs/dbraw/zinc/18/96/74/169189674.db2.gz CQFZTHJXLOCVTO-ZDUSSCGKSA-N 2 0 242.432 2.346 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H](C)CCCOC)CC1 ZINC000359616996 169190026 /nfs/dbraw/zinc/19/00/26/169190026.db2.gz CSYUVZVGXPCKGL-CYBMUJFWSA-N 2 0 242.407 2.266 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H]2CC[C@@H](F)C2)CC1 ZINC000336742728 169190048 /nfs/dbraw/zinc/19/00/48/169190048.db2.gz SHCXHPXTZVDVGW-DGCLKSJQSA-N 2 0 228.355 2.341 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccncc2)C1 ZINC000156487926 169206375 /nfs/dbraw/zinc/20/63/75/169206375.db2.gz GOEDZZMCOMJCIJ-KBPBESRZSA-N 2 0 247.386 2.464 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](C)COC(C)C)C1 ZINC000337339615 169208194 /nfs/dbraw/zinc/20/81/94/169208194.db2.gz OSUIRJSHLPWNBR-ZIAGYGMSSA-N 2 0 242.407 2.121 20 0 BEADRP c1cc2c(o1)CCC[C@@H]2[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000128924787 183373009 /nfs/dbraw/zinc/37/30/09/183373009.db2.gz DIOABYGLEZNHLJ-YPMHNXCESA-N 2 0 234.343 2.389 20 0 BEADRP c1cc2c(s1)CCC[C@@H]2[NH2+]C1CC[NH2+]CC1 ZINC000061360291 183373390 /nfs/dbraw/zinc/37/33/90/183373390.db2.gz ZDCQSBLAJJREQI-LBPRGKRZSA-N 2 0 236.384 2.467 20 0 BEADRP c1[nH+]cn2cc(C[NH2+]C[C@@H]3CCSC3)ccc12 ZINC000297497642 183376321 /nfs/dbraw/zinc/37/63/21/183376321.db2.gz LBQAFHZVNHXFGW-LBPRGKRZSA-N 2 0 247.367 2.177 20 0 BEADRP c1ccc(CCC[N@@H+]2CC[C@]3(CC[NH2+]C3)C2)cc1 ZINC000031994631 183391658 /nfs/dbraw/zinc/39/16/58/183391658.db2.gz AIZUTGQRJCORCJ-INIZCTEOSA-N 2 0 244.382 2.305 20 0 BEADRP CCC[C@@H](CC)[NH2+]C[C@H](C)C[NH+](C)C ZINC000336681170 169379836 /nfs/dbraw/zinc/37/98/36/169379836.db2.gz HIMKVSUGUHINFC-NWDGAFQWSA-N 2 0 200.370 2.352 20 0 BEADRP CC[C@@H](C)[C@H](C)[N@@H+]1C[C@H]2CC[NH+](C)C[C@H]2C1 ZINC001644099396 1172526087 /nfs/dbraw/zinc/52/60/87/1172526087.db2.gz PICIYNDEBMLFQJ-RQJABVFESA-N 2 0 224.392 2.305 20 0 BEADRP C[C@H](C[NH2+]C[C@@H]1CCSC1)C[NH+]1CCCC1 ZINC000224420427 134347246 /nfs/dbraw/zinc/34/72/46/134347246.db2.gz QLSQJDHRDHJLOA-OLZOCXBDSA-N 2 0 242.432 2.061 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CCC[NH2+]C1)c1cccs1 ZINC000087646198 383855702 /nfs/dbraw/zinc/85/57/02/383855702.db2.gz INIYIAWWOFTMKA-MNOVXSKESA-N 2 0 224.373 2.398 20 0 BEADRP [NH3+][C@@H]1CCC[C@H](C[NH2+]Cc2cccs2)C1 ZINC000070503175 383931570 /nfs/dbraw/zinc/93/15/70/383931570.db2.gz OCLMMCLMGDALIW-WDEREUQCSA-N 2 0 224.373 2.355 20 0 BEADRP C[C@@H](C[NH2+]C1CCC(F)(F)CC1)C[NH+](C)C ZINC000647212719 383956835 /nfs/dbraw/zinc/95/68/35/383956835.db2.gz SATUMDORJPBKBS-JTQLQIEISA-N 2 0 234.334 2.352 20 0 BEADRP CSCC[C@H](C)[N@H+](C)C[C@H]1CC[NH2+][C@@H](C)C1 ZINC000300056445 383972908 /nfs/dbraw/zinc/97/29/08/383972908.db2.gz QAVJSYGRDGBXOB-AVGNSLFASA-N 2 0 244.448 2.448 20 0 BEADRP Cc1[nH+]ccc(N2CCC[N@@H+](C)CC2)c1Cl ZINC000558392090 383977820 /nfs/dbraw/zinc/97/78/20/383977820.db2.gz IMGJLVXROAMITN-UHFFFAOYSA-N 2 0 239.750 2.185 20 0 BEADRP C[C@@H](CC1CCC1)[NH2+]CCC1=CC[NH2+]CC1 ZINC000643545544 384009087 /nfs/dbraw/zinc/00/90/87/384009087.db2.gz VKTGZAHMTPFJCF-LBPRGKRZSA-N 2 0 222.376 2.465 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]CCc1cccc2[nH]ccc21 ZINC000569447676 384051087 /nfs/dbraw/zinc/05/10/87/384051087.db2.gz NVVMYZODUOHQDG-HIFRSBDPSA-N 2 0 243.354 2.180 20 0 BEADRP CCC1(C[NH2+][C@@H]2C[C@@H](C)[N@H+](C)C[C@@H]2C)CC1 ZINC000090219709 384035964 /nfs/dbraw/zinc/03/59/64/384035964.db2.gz FPZGULZXHNXWJL-YNEHKIRRSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H]([NH2+]C1CC[NH2+]CC1)c1ccccc1 ZINC000038040466 384061856 /nfs/dbraw/zinc/06/18/56/384061856.db2.gz YIHGPADYGNMOGL-NSHDSACASA-N 2 0 204.317 2.089 20 0 BEADRP Cn1ccc(C[NH+]2CCC(CC[NH+](C)C)CC2)c1 ZINC000092381086 384176161 /nfs/dbraw/zinc/17/61/61/384176161.db2.gz WQLGCMPHWSJFAY-UHFFFAOYSA-N 2 0 249.402 2.189 20 0 BEADRP Cc1ccc(C)c(C[N@H+]2CC[C@H]([C@@H](C)[NH3+])C2)c1 ZINC000163206075 384165304 /nfs/dbraw/zinc/16/53/04/384165304.db2.gz NPBQKRQRYPCKBR-KGLIPLIRSA-N 2 0 232.371 2.473 20 0 BEADRP C[C@@H]([NH2+]CC1CC[NH2+]CC1)c1ccccc1 ZINC000041231936 384183748 /nfs/dbraw/zinc/18/37/48/384183748.db2.gz CCQBPQBESONPKL-GFCCVEGCSA-N 2 0 218.344 2.337 20 0 BEADRP C[C@@H]([NH2+]CCC1CC[NH+](C)CC1)c1cccnc1 ZINC000092746296 384191991 /nfs/dbraw/zinc/19/19/91/384191991.db2.gz ZWVGVKJPVVBCRW-CYBMUJFWSA-N 2 0 247.386 2.464 20 0 BEADRP C[C@@H]([NH3+])C1CC[NH+](Cc2ccsc2)CC1 ZINC000082474675 384232228 /nfs/dbraw/zinc/23/22/28/384232228.db2.gz WBSNUHDRQYTFTR-SNVBAGLBSA-N 2 0 224.373 2.307 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@H](C)CC(F)F)CC1 ZINC000647317335 384237970 /nfs/dbraw/zinc/23/79/70/384237970.db2.gz LTMDSFRQKXCPHB-SNVBAGLBSA-N 2 0 234.334 2.352 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]C[C@H]1CC=CCC1 ZINC000132873013 384216706 /nfs/dbraw/zinc/21/67/06/384216706.db2.gz LCPZSQVASYECBE-RDBSUJKOSA-N 2 0 222.376 2.273 20 0 BEADRP C[N@H+](Cc1ccsc1)CC(C)(C)C[NH3+] ZINC000051216653 384229678 /nfs/dbraw/zinc/22/96/78/384229678.db2.gz MYRPCKRPLGPWAW-UHFFFAOYSA-N 2 0 212.362 2.165 20 0 BEADRP C[C@H]([NH2+]C1CC1)c1cccc(OCC[NH+](C)C)c1 ZINC000132684019 384242913 /nfs/dbraw/zinc/24/29/13/384242913.db2.gz NGKDQFIHSWPDNA-LBPRGKRZSA-N 2 0 248.370 2.440 20 0 BEADRP COC1(C[NH+]2CCC(CC[NH3+])CC2)CCCC1 ZINC000319478484 384251262 /nfs/dbraw/zinc/25/12/62/384251262.db2.gz RXCVPWAUUHASTR-UHFFFAOYSA-N 2 0 240.391 2.006 20 0 BEADRP CC[C@H]1C[N@H+](CC2(OC)CCCC2)CC[C@@H]1[NH3+] ZINC000319456332 384251294 /nfs/dbraw/zinc/25/12/94/384251294.db2.gz OCXSXEAPRMUKQX-STQMWFEESA-N 2 0 240.391 2.005 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H]1CC(C)(C)C[C@H]1C ZINC000569566732 384251508 /nfs/dbraw/zinc/25/15/08/384251508.db2.gz YCRKMSKFPDCVOF-VXGBXAGGSA-N 2 0 212.381 2.400 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H]2CCC[C@H]3C[C@H]32)C1 ZINC000558700063 384252206 /nfs/dbraw/zinc/25/22/06/384252206.db2.gz PJECVSPMODDHMB-BARDWOONSA-N 2 0 236.403 2.497 20 0 BEADRP COC1(C[N@@H+]2CCC[C@@H](CC[NH3+])C2)CCCC1 ZINC000319509349 384255971 /nfs/dbraw/zinc/25/59/71/384255971.db2.gz XHWZKAIHUANNJL-ZDUSSCGKSA-N 2 0 240.391 2.006 20 0 BEADRP CC[C@H]([NH2+]C[C@H]1CC[N@H+](CC)C1)C1CC1 ZINC000083055493 384278919 /nfs/dbraw/zinc/27/89/19/384278919.db2.gz UFFBWFOMBNABCF-YPMHNXCESA-N 2 0 210.365 2.106 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+]CC1(C2CC2)CC1 ZINC000236238310 384287601 /nfs/dbraw/zinc/28/76/01/384287601.db2.gz VSPMZFKYJCZFRG-DGCLKSJQSA-N 2 0 222.376 2.284 20 0 BEADRP COC(C)(C)C[N@H+](C)CC[C@@H]1CCCC[NH+]1C ZINC000533479203 384361811 /nfs/dbraw/zinc/36/18/11/384361811.db2.gz SCDZZNHYCUFKNY-ZDUSSCGKSA-N 2 0 242.407 2.218 20 0 BEADRP COc1cc(CN2CC[C@@H]([NH3+])C[C@@H]2C)ccc1C ZINC000569619093 384363148 /nfs/dbraw/zinc/36/31/48/384363148.db2.gz OKUMDCDACQSCHM-GXTWGEPZSA-N 2 0 248.370 2.315 20 0 BEADRP CC1(C)[C@H]([NH3+])C[C@@H]1[NH2+]CCCCC(F)(F)F ZINC000405472050 384366880 /nfs/dbraw/zinc/36/68/80/384366880.db2.gz LBXWLWOHGLLRRV-BDAKNGLRSA-N 2 0 238.297 2.434 20 0 BEADRP CC1(C)[C@H]([NH2+]CCCc2ccccc2)C[C@@H]1[NH3+] ZINC000405431075 384331517 /nfs/dbraw/zinc/33/15/17/384331517.db2.gz AXRFRLMRLQEOND-UONOGXRCSA-N 2 0 232.371 2.335 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@H](C)[C@@H](C[NH3+])C2)s1 ZINC000229060650 384415419 /nfs/dbraw/zinc/41/54/19/384415419.db2.gz CNHUWTXKMZMZPT-JQWIXIFHSA-N 2 0 238.400 2.473 20 0 BEADRP Cc1ccsc1CN[C@H]1CCC[NH2+][C@@H]1C ZINC000335642689 384418971 /nfs/dbraw/zinc/41/89/71/384418971.db2.gz HHYLSAHJHFQTID-MNOVXSKESA-N 2 0 224.373 2.287 20 0 BEADRP Cc1ccsc1CN[C@@H]1CCC[NH2+][C@H]1C ZINC000335642691 384419398 /nfs/dbraw/zinc/41/93/98/384419398.db2.gz HHYLSAHJHFQTID-WDEREUQCSA-N 2 0 224.373 2.287 20 0 BEADRP C[N@H+]1CC=C(C[NH2+][C@@H]2CCC(C)(C)C2)CC1 ZINC000335602283 384378077 /nfs/dbraw/zinc/37/80/77/384378077.db2.gz GALCLFZUKGVOQX-CYBMUJFWSA-N 2 0 222.376 2.417 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@@H]2CCC2(C)C)CC1 ZINC000308843698 384378552 /nfs/dbraw/zinc/37/85/52/384378552.db2.gz ZDZWNCSZYKBUMN-GFCCVEGCSA-N 2 0 210.365 2.106 20 0 BEADRP CC[N@H+](CCC[NH3+])Cc1ccccc1C ZINC000036731795 384455512 /nfs/dbraw/zinc/45/55/12/384455512.db2.gz RWYFXQLHTSSNJK-UHFFFAOYSA-N 2 0 206.333 2.166 20 0 BEADRP C[C@H]([NH2+]C1CCC([NH3+])CC1)[C@H]1CC1(C)C ZINC000335652520 384433463 /nfs/dbraw/zinc/43/34/63/384433463.db2.gz IZRJQBCLPYDFQU-WNYYMSAVSA-N 2 0 210.365 2.281 20 0 BEADRP CC1=CC[C@@H]([NH2+]CCN2CC[C@H](C)C2)CC1 ZINC000556833867 384515063 /nfs/dbraw/zinc/51/50/63/384515063.db2.gz NWBACSFLSNBBEM-UONOGXRCSA-N 2 0 222.376 2.417 20 0 BEADRP CO[C@H](C)[C@H](C)[NH2+]C1CC[NH+](CC(C)C)CC1 ZINC000358016556 384517668 /nfs/dbraw/zinc/51/76/68/384517668.db2.gz GSVMZWVJFGBLQW-QWHCGFSZSA-N 2 0 242.407 2.120 20 0 BEADRP COC[C@H]([NH2+][C@@H]1CCC[C@H]([NH3+])C1)C1CCCC1 ZINC000423364811 384546678 /nfs/dbraw/zinc/54/66/78/384546678.db2.gz JYJPKGPMQNULAY-MJBXVCDLSA-N 2 0 240.391 2.051 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCC[C@H]([NH3+])C1)[C@@H]1C[C@@H]1C ZINC000423370257 384548780 /nfs/dbraw/zinc/54/87/80/384548780.db2.gz PIHRIFTXDKRKEA-YYHQMBLXSA-N 2 0 210.365 2.281 20 0 BEADRP C(C1CCCCC1)[N@@H+]1CC[C@@H]2CC[NH2+][C@@H]2C1 ZINC000643065747 384578187 /nfs/dbraw/zinc/57/81/87/384578187.db2.gz FRZCFKWPZVTQNQ-UONOGXRCSA-N 2 0 222.376 2.251 20 0 BEADRP C(C1CCCCC1)[N@@H+]1CC[C@@H]2CC[NH2+][C@H]2C1 ZINC000643065745 384580801 /nfs/dbraw/zinc/58/08/01/384580801.db2.gz FRZCFKWPZVTQNQ-KBPBESRZSA-N 2 0 222.376 2.251 20 0 BEADRP CSCCCN(C)C[C@@H]([NH3+])CC(C)C ZINC000300862793 384615942 /nfs/dbraw/zinc/61/59/42/384615942.db2.gz PLJGQVXHIAGTSK-NSHDSACASA-N 2 0 218.410 2.045 20 0 BEADRP C[C@@H]([NH3+])C1CC[NH+](Cc2cccc(F)c2)CC1 ZINC000111727055 384624595 /nfs/dbraw/zinc/62/45/95/384624595.db2.gz HEIXSWKMVIXGQT-LLVKDONJSA-N 2 0 236.334 2.385 20 0 BEADRP C[C@H]1CCC[C@@H]([NH2+]CC2=CC[N@H+](C)CC2)C1 ZINC000309769220 384595050 /nfs/dbraw/zinc/59/50/50/384595050.db2.gz KCHPGNKXHCYYBZ-GXTWGEPZSA-N 2 0 222.376 2.417 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCN2CCC[C@@H](C)C2)[C@H]1C ZINC000309772305 384595282 /nfs/dbraw/zinc/59/52/82/384595282.db2.gz KSOSTVPMUJLYGL-YIYPIFLZSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H](C[NH2+]C1CCC2(CC2)CC1)C[NH+](C)C ZINC000309781644 384598514 /nfs/dbraw/zinc/59/85/14/384598514.db2.gz RJVXMLLVWKZGLT-LBPRGKRZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H](C[NH2+][C@@H]1CCC12CCCC2)C[NH+](C)C ZINC000309769738 384599614 /nfs/dbraw/zinc/59/96/14/384599614.db2.gz OJQTYSWHZLNCBE-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]C2CC(C(F)(F)F)C2)C1 ZINC000568247599 384601685 /nfs/dbraw/zinc/60/16/85/384601685.db2.gz RDYJLWNVSPXOJA-MXAZLMSGSA-N 2 0 236.281 2.187 20 0 BEADRP Cc1cccc(CN2CC[C@H]3CC[NH2+][C@H]3C2)c1C ZINC000647532755 384638686 /nfs/dbraw/zinc/63/86/86/384638686.db2.gz CNBAVTFEDKEGML-ZBFHGGJFSA-N 2 0 244.382 2.487 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H]2CC[C@@H]3C[C@@H]3C2)[C@@H](C)C1 ZINC000647357250 384644136 /nfs/dbraw/zinc/64/41/36/384644136.db2.gz ZOTMAKFBMAYVIM-JARUQAPTSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@H](C[N@@H+]1CC[C@H]2CC[NH2+][C@@H]2C1)C(C)(C)C ZINC000647533983 384645581 /nfs/dbraw/zinc/64/55/81/384645581.db2.gz CZDJFDPZPMTZOZ-JHJVBQTASA-N 2 0 224.392 2.352 20 0 BEADRP c1cn(CCC[NH2+]C[C@@H]2CC[C@@H]3C[C@@H]3C2)cn1 ZINC000403414316 384656149 /nfs/dbraw/zinc/65/61/49/384656149.db2.gz VBYYAVZLXHCBHJ-MCIONIFRSA-N 2 0 233.359 2.299 20 0 BEADRP CC(C)CCC[NH2+][C@@H]1CN(C2CC2)C[C@@H]1C ZINC000336656504 384656905 /nfs/dbraw/zinc/65/69/05/384656905.db2.gz HYZMSHNSYOUSNI-GXTWGEPZSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H](CC[NH3+])[NH2+]Cc1ccc(C(F)F)cc1 ZINC000556932332 384661014 /nfs/dbraw/zinc/66/10/14/384661014.db2.gz XRQARNSNBMHOIG-VIFPVBQESA-N 2 0 228.286 2.451 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H]1CCCCC1(C)C ZINC000556933994 384661705 /nfs/dbraw/zinc/66/17/05/384661705.db2.gz BFLAAUHXNHKLPV-NEPJUHHUSA-N 2 0 212.381 2.400 20 0 BEADRP C[NH+](C)C1CCC([NH2+]Cc2ccco2)CC1 ZINC000309934437 384724616 /nfs/dbraw/zinc/72/46/16/384724616.db2.gz ZHQXXDLZQWHVKT-UHFFFAOYSA-N 2 0 222.332 2.242 20 0 BEADRP CCCC1CCC([NH2+][C@H]2CC[NH2+]C2)CC1 ZINC000086729391 384679740 /nfs/dbraw/zinc/67/97/40/384679740.db2.gz BCLWNNAYYYPSCV-BPCQOVAHSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CCC(C)(F)F ZINC000357714870 384683194 /nfs/dbraw/zinc/68/31/94/384683194.db2.gz IRRWMQDHSBBFAX-VIFPVBQESA-N 2 0 208.296 2.139 20 0 BEADRP C[NH+](C)CCC[NH2+][C@@H]1CCCCC1(C)C ZINC000086842577 384703257 /nfs/dbraw/zinc/70/32/57/384703257.db2.gz FMTJMSQQLDBYGE-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC000647543428 384710530 /nfs/dbraw/zinc/71/05/30/384710530.db2.gz NFWZQPWIANTLLS-LXTVHRRPSA-N 2 0 236.403 2.354 20 0 BEADRP CC(C)C[N@@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC000647543251 384713237 /nfs/dbraw/zinc/71/32/37/384713237.db2.gz KAALCUQFAKAUCO-UONOGXRCSA-N 2 0 224.392 2.354 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000423220341 384778423 /nfs/dbraw/zinc/77/84/23/384778423.db2.gz YCQYVZZYHGJRFX-AVGNSLFASA-N 2 0 210.365 2.010 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)C1CCCC1 ZINC000054081317 384731324 /nfs/dbraw/zinc/73/13/24/384731324.db2.gz AQVGAELORJIDAU-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH+](C)CCC[NH2+][C@@H]1CS[C@H](C(C)(C)C)C1 ZINC000309980459 384758959 /nfs/dbraw/zinc/75/89/59/384758959.db2.gz VYEUZAWHSGVHNM-RYUDHWBXSA-N 2 0 244.448 2.448 20 0 BEADRP C[C@H](C[NH2+]CC(C)(C)C)Cn1ccnc1 ZINC000163815094 384760352 /nfs/dbraw/zinc/76/03/52/384760352.db2.gz QQNCTENQMJDQCW-LLVKDONJSA-N 2 0 209.337 2.155 20 0 BEADRP CC[C@@H](C)[N@H+](C)CCNC(=[NH2+])Nc1ccccc1 ZINC000103338646 384762512 /nfs/dbraw/zinc/76/25/12/384762512.db2.gz SVNDJFPHKAEBEQ-GFCCVEGCSA-N 2 0 248.374 2.353 20 0 BEADRP C[C@H]1C[C@@H](C[NH2+]CC2CCC(F)CC2)CC[NH2+]1 ZINC000647553111 384764471 /nfs/dbraw/zinc/76/44/71/384764471.db2.gz BLZNABIQLGMAHM-AHPWVWPOSA-N 2 0 242.382 2.492 20 0 BEADRP C[C@@H]1C[C@H](C[NH2+]CC2CCC(F)CC2)CC[NH2+]1 ZINC000647553113 384764905 /nfs/dbraw/zinc/76/49/05/384764905.db2.gz BLZNABIQLGMAHM-NELGMTEASA-N 2 0 242.382 2.492 20 0 BEADRP CC(C)C[C@@H]([NH3+])C[NH2+]CC1CCC(F)CC1 ZINC000647553119 384768732 /nfs/dbraw/zinc/76/87/32/384768732.db2.gz BNIUBJJJSZOSCG-WXRRBKDZSA-N 2 0 230.371 2.478 20 0 BEADRP C([NH2+][C@H]1CC[NH2+]C12CCCC2)[C@@H]1CCSC1 ZINC000647553475 384768836 /nfs/dbraw/zinc/76/88/36/384768836.db2.gz ALJGRUBCXLIXBH-RYUDHWBXSA-N 2 0 240.416 2.004 20 0 BEADRP FC1CCC(C[NH2+]CC2CC[NH2+]CC2)CC1 ZINC000647553160 384768886 /nfs/dbraw/zinc/76/88/86/384768886.db2.gz DPTLPGTXAFSZLT-UHFFFAOYSA-N 2 0 228.355 2.104 20 0 BEADRP CC(C)(C)[NH2+]CC[NH2+]CC1CCC(F)CC1 ZINC000647553320 384769381 /nfs/dbraw/zinc/76/93/81/384769381.db2.gz RJZOIIRJOSZBKY-UHFFFAOYSA-N 2 0 230.371 2.492 20 0 BEADRP Cc1ccsc1C[NH2+]C1CCC([NH3+])CC1 ZINC000051692942 384770561 /nfs/dbraw/zinc/77/05/61/384770561.db2.gz UGESFLXCAGXUSW-UHFFFAOYSA-N 2 0 224.373 2.416 20 0 BEADRP C[C@H]([NH2+]C1CCC(F)(F)CC1)[C@H]1CCC[NH2+]1 ZINC000335027341 384772442 /nfs/dbraw/zinc/77/24/42/384772442.db2.gz SAMUWJAOJGHRSQ-GXSJLCMTSA-N 2 0 232.318 2.294 20 0 BEADRP C(C[C@@H]1CCC[NH2+]C1)[NH2+][C@H]1CC[C@H]1C1CC1 ZINC000423268348 384782796 /nfs/dbraw/zinc/78/27/96/384782796.db2.gz GCCRSVQQIOKGCK-UBHSHLNASA-N 2 0 222.376 2.154 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CCc2ccc(F)cc21 ZINC000423280273 384786785 /nfs/dbraw/zinc/78/67/85/384786785.db2.gz UHSVKDNOLNAGSV-IINYFYTJSA-N 2 0 236.334 2.258 20 0 BEADRP C[C@H](CC[NH2+]C[C@@H]1C[C@H]1C)[NH+]1CCCCC1 ZINC000309757141 384794885 /nfs/dbraw/zinc/79/48/85/384794885.db2.gz LURZBBUMBMFANN-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP CN(Cc1ccco1)C[C@@H]1CCC[N@H+](C)C1 ZINC000104095915 384799094 /nfs/dbraw/zinc/79/90/94/384799094.db2.gz YQZLYXMGNWPJSJ-GFCCVEGCSA-N 2 0 222.332 2.053 20 0 BEADRP C[C@H](CCC1CC1)[NH2+][C@H]1CC[NH2+]C[C@@H]1C ZINC000398111060 384805034 /nfs/dbraw/zinc/80/50/34/384805034.db2.gz XETCOIZCYZINFU-LOWVWBTDSA-N 2 0 210.365 2.153 20 0 BEADRP CC1(C[NH2+][C@@H]2CC[C@H]2C2CC2)CC[NH2+]CC1 ZINC000423338730 384813591 /nfs/dbraw/zinc/81/35/91/384813591.db2.gz UVFJEUWXONIARI-QWHCGFSZSA-N 2 0 222.376 2.154 20 0 BEADRP COC[C@H]([NH2+][C@H]1CCC[C@@H]([NH3+])C1)C1CCCC1 ZINC000423364812 384841385 /nfs/dbraw/zinc/84/13/85/384841385.db2.gz JYJPKGPMQNULAY-RDBSUJKOSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@@H]([NH3+])C1)c1cncs1 ZINC000423368132 384842881 /nfs/dbraw/zinc/84/28/81/384842881.db2.gz DBPMWNDUYDNTBB-AEJSXWLSSA-N 2 0 225.361 2.064 20 0 BEADRP CCC[N@H+](C)C[C@H]1CC[NH+](CCSC)C1 ZINC000177035859 384848145 /nfs/dbraw/zinc/84/81/45/384848145.db2.gz YRGZUAKOJLENHZ-GFCCVEGCSA-N 2 0 230.421 2.013 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+]C[C@@H]2CC[C@@H]3C[C@@H]3C2)C1 ZINC000403676263 384850210 /nfs/dbraw/zinc/85/02/10/384850210.db2.gz PBWZYZUYTGOSHZ-TUVASFSCSA-N 2 0 236.403 2.354 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CCC[N@H+](CCc2ccccc2)C1 ZINC000104424498 384851022 /nfs/dbraw/zinc/85/10/22/384851022.db2.gz RFFOXKXUQRKNFZ-DZGCQCFKSA-N 2 0 232.371 2.288 20 0 BEADRP C(C[NH2+]C[C@@H]1CC[C@@H]2C[C@@H]2C1)C[NH+]1CCCC1 ZINC000403769132 384858244 /nfs/dbraw/zinc/85/82/44/384858244.db2.gz UASMNIPCDKMKJI-KFWWJZLASA-N 2 0 236.403 2.498 20 0 BEADRP C[C@H](C[NH2+]Cc1cc2ccccc2[nH]1)C[NH+](C)C ZINC000644414863 384869327 /nfs/dbraw/zinc/86/93/27/384869327.db2.gz IMHNIWBLCRJHLM-GFCCVEGCSA-N 2 0 245.370 2.455 20 0 BEADRP CCOc1ccc(C[NH2+]CCCC[NH3+])cc1F ZINC000258922916 384951302 /nfs/dbraw/zinc/95/13/02/384951302.db2.gz OOIQOBROIBZEBG-UHFFFAOYSA-N 2 0 240.322 2.053 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]CCC1CCCCC1 ZINC000259042069 384952924 /nfs/dbraw/zinc/95/29/24/384952924.db2.gz PGXZVSALOJJIMJ-OLZOCXBDSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]CCCOc1ccccc1 ZINC000310303774 384960965 /nfs/dbraw/zinc/96/09/65/384960965.db2.gz UXTXTCQBVDFXCB-ZDUSSCGKSA-N 2 0 236.359 2.173 20 0 BEADRP Cc1ccc(CC[NH2+]CC2CC[NH2+]CC2)c(C)c1 ZINC000258956494 384956510 /nfs/dbraw/zinc/95/65/10/384956510.db2.gz IXWNBOVGAYKTOH-UHFFFAOYSA-N 2 0 246.398 2.435 20 0 BEADRP CSCCCC[NH2+][C@@H](C)CCCC[NH3+] ZINC000308652321 384893952 /nfs/dbraw/zinc/89/39/52/384893952.db2.gz LBRUBIQMLIUFHR-NSHDSACASA-N 2 0 218.410 2.237 20 0 BEADRP CCCCC[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000127650895 384911138 /nfs/dbraw/zinc/91/11/38/384911138.db2.gz RQWSTZLWMOGRNF-CHWSQXEVSA-N 2 0 210.365 2.393 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]C[C@](C)(CC)OC)[C@H](C)C1 ZINC000449474814 384919990 /nfs/dbraw/zinc/91/99/90/384919990.db2.gz KJFNBGKITQRKFO-RDBSUJKOSA-N 2 0 242.407 2.121 20 0 BEADRP FC1(F)CC[NH+](CC[C@@H]2CCC[NH2+]C2)CC1 ZINC000259441224 384959528 /nfs/dbraw/zinc/95/95/28/384959528.db2.gz JVESYGZHYTVPTN-NSHDSACASA-N 2 0 232.318 2.107 20 0 BEADRP CC[C@@H]([NH2+]CCC[N@H+](C)C(C)C)[C@H]1CCOC1 ZINC000336677886 384929260 /nfs/dbraw/zinc/92/92/60/384929260.db2.gz ACJJZFMAPUDDDQ-UONOGXRCSA-N 2 0 242.407 2.121 20 0 BEADRP CC[C@@H]([NH2+]CCC[N@H+](C)C(C)C)[C@@H]1CCOC1 ZINC000336677889 384930022 /nfs/dbraw/zinc/93/00/22/384930022.db2.gz ACJJZFMAPUDDDQ-ZIAGYGMSSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@H]1C1CCC1)C1CC[NH+](C)CC1 ZINC000643908608 384934094 /nfs/dbraw/zinc/93/40/94/384934094.db2.gz PSCPHHUPUMIJAT-TUKIKUTGSA-N 2 0 236.403 2.495 20 0 BEADRP Cc1ccsc1CC[NH2+][C@@H]1CCC[C@H]1[NH3+] ZINC000258800989 384934735 /nfs/dbraw/zinc/93/47/35/384934735.db2.gz CDTDFWSRGMEPPS-GHMZBOCLSA-N 2 0 224.373 2.068 20 0 BEADRP CC[N@@H+]1CC[C@H](CN[C@@H](C)c2ccoc2)C1 ZINC000087289884 384938932 /nfs/dbraw/zinc/93/89/32/384938932.db2.gz MFJGSSMDRUOYIC-NWDGAFQWSA-N 2 0 222.332 2.272 20 0 BEADRP CC(C)(C[NH2+][C@@H]1CCC[C@@H]1[NH3+])c1ccccc1 ZINC000258762652 384939338 /nfs/dbraw/zinc/93/93/38/384939338.db2.gz APVWJUVHYOFJAC-UONOGXRCSA-N 2 0 232.371 2.434 20 0 BEADRP CCC[N@H+](C)C[C@H]1CC[NH+](CC2(C)CC2)C1 ZINC000555595032 384940484 /nfs/dbraw/zinc/94/04/84/384940484.db2.gz AVXSIJCSDNLQQI-CYBMUJFWSA-N 2 0 224.392 2.450 20 0 BEADRP CSc1ccc(C[NH2+]C[C@@H](C)C[NH3+])cc1 ZINC000258767598 384942659 /nfs/dbraw/zinc/94/26/59/384942659.db2.gz NUIHAMTVDYLACZ-JTQLQIEISA-N 2 0 224.373 2.093 20 0 BEADRP Fc1cccc(C[NH2+]CC[C@H]2CCC[NH2+]2)c1 ZINC000258873377 384947400 /nfs/dbraw/zinc/94/74/00/384947400.db2.gz AYDICXGHAOAYBB-CYBMUJFWSA-N 2 0 222.307 2.057 20 0 BEADRP C[C@@H]1CCC[N@H+](C[C@@H]2CCCCO2)[C@H]1CC[NH3+] ZINC000404281182 384966417 /nfs/dbraw/zinc/96/64/17/384966417.db2.gz FAWRGGXLJSPLQP-RDBSUJKOSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@H](C1CC1)[N@H+](C[C@@H]1CCC[NH2+]C1)C1CC1 ZINC000226436283 385021131 /nfs/dbraw/zinc/02/11/31/385021131.db2.gz UXZYBFWGLBDNEC-VXGBXAGGSA-N 2 0 222.376 2.249 20 0 BEADRP C(CC[NH2+][C@@H]1CCCOC1)CC[NH+]1CCCC1 ZINC000340480631 384974889 /nfs/dbraw/zinc/97/48/89/384974889.db2.gz SPCKFVVBHSXBST-CQSZACIVSA-N 2 0 240.391 2.021 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@@H]([NH3+])C[C@@H]2C)s1 ZINC000050225606 384987790 /nfs/dbraw/zinc/98/77/90/384987790.db2.gz XDFPYVIBHICQNK-GXSJLCMTSA-N 2 0 224.373 2.368 20 0 BEADRP C[NH+](C)CC[C@H]([NH2+]Cc1cc[nH]c1)C(C)(C)C ZINC000086254394 385002519 /nfs/dbraw/zinc/00/25/19/385002519.db2.gz ZEMVYUQEKLCPOM-ZDUSSCGKSA-N 2 0 237.391 2.471 20 0 BEADRP C1C[C@H]2CC([NH2+]C3CCCCC3)C[C@@H]1[NH2+]2 ZINC000129789745 385013911 /nfs/dbraw/zinc/01/39/11/385013911.db2.gz HDVWBHASUBTKOS-FUNVUKJBSA-N 2 0 208.349 2.192 20 0 BEADRP C(C[C@H]1CCC[NH2+]1)[NH2+]CC1CCCCC1 ZINC000259156405 384964230 /nfs/dbraw/zinc/96/42/30/384964230.db2.gz XVCYWHGQQVHBIG-CYBMUJFWSA-N 2 0 210.365 2.298 20 0 BEADRP COc1cccc([C@H](C)[NH2+][C@@H]2C[C@@H]([NH3+])C2(C)C)c1 ZINC000404759388 385053164 /nfs/dbraw/zinc/05/31/64/385053164.db2.gz BHHBBSQUIFHBIA-ZLKJLUDKSA-N 2 0 248.370 2.472 20 0 BEADRP CC1(C)[C@@H]([NH3+])C[C@@H]1[NH2+]Cc1cccc(F)c1 ZINC000404779649 385056190 /nfs/dbraw/zinc/05/61/90/385056190.db2.gz MTCGITAXMBCQGA-RYUDHWBXSA-N 2 0 222.307 2.041 20 0 BEADRP Cc1ccc(F)cc1CN1CC[C@H]([NH3+])[C@H](C)C1 ZINC000157085012 385062148 /nfs/dbraw/zinc/06/21/48/385062148.db2.gz MPFLJVRKQUVRSD-RISCZKNCSA-N 2 0 236.334 2.303 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H](C)C(C)(C)OC ZINC000300919371 385063536 /nfs/dbraw/zinc/06/35/36/385063536.db2.gz DSQBICFWPZOPFZ-LBPRGKRZSA-N 2 0 230.396 2.121 20 0 BEADRP CC(C)C1([NH2+][C@H]2C[C@H](C)N(C3CC3)C2)CC1 ZINC000340477809 385068720 /nfs/dbraw/zinc/06/87/20/385068720.db2.gz IKCDAFYKCOINQS-RYUDHWBXSA-N 2 0 222.376 2.390 20 0 BEADRP CC1=CC[C@@H]([NH2+][C@@H](C)CC[NH+](C)C)CC1 ZINC000518411651 385079692 /nfs/dbraw/zinc/07/96/92/385079692.db2.gz RCZYMRYKQMDKIS-QWHCGFSZSA-N 2 0 210.365 2.415 20 0 BEADRP CC[C@H](C)C[N@@H+]1C[C@H](C[NH3+])[C@@H](C)C[C@@H]1C ZINC000397324447 385082486 /nfs/dbraw/zinc/08/24/86/385082486.db2.gz OFGFDTAYXTZXAB-CYDGBPFRSA-N 2 0 212.381 2.338 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+]CCC[NH2+]C1CC1 ZINC000423550997 385023972 /nfs/dbraw/zinc/02/39/72/385023972.db2.gz IZQVWLCTPCVOSM-STQMWFEESA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+]CCC[NH2+]C1CC1 ZINC000423550996 385025227 /nfs/dbraw/zinc/02/52/27/385025227.db2.gz IZQVWLCTPCVOSM-QWHCGFSZSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+][C@@H]1CCCC[NH2+]C1 ZINC000423567886 385027120 /nfs/dbraw/zinc/02/71/20/385027120.db2.gz VGLMBZKCAPEEFQ-AGIUHOORSA-N 2 0 210.365 2.153 20 0 BEADRP Cc1ccc(CC[N@@H+]2CC[C@H]3C[NH2+]C[C@@H]3C2)cc1 ZINC000334141481 385028189 /nfs/dbraw/zinc/02/81/89/385028189.db2.gz HMNOKLIRGOARLQ-JKSUJKDBSA-N 2 0 244.382 2.079 20 0 BEADRP Cc1ccc(F)cc1C[NH+]1CCC(C[NH3+])CC1 ZINC000157027764 385047175 /nfs/dbraw/zinc/04/71/75/385047175.db2.gz BEMIZFKUICYLID-UHFFFAOYSA-N 2 0 236.334 2.305 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]CC1(C2CC2)CC1 ZINC000090773016 385093926 /nfs/dbraw/zinc/09/39/26/385093926.db2.gz FOXCHWRXMNTXEQ-YRGRVCCFSA-N 2 0 236.403 2.495 20 0 BEADRP CC(C)(C[NH+]1CCC([NH3+])CC1)c1ccccc1 ZINC000647481905 385190507 /nfs/dbraw/zinc/19/05/07/385190507.db2.gz APTUXCNCVNKCQF-UHFFFAOYSA-N 2 0 232.371 2.387 20 0 BEADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+][C@@H]1CC12CC2 ZINC000424373917 385153911 /nfs/dbraw/zinc/15/39/11/385153911.db2.gz KFICGXOWJWLBKU-FRRDWIJNSA-N 2 0 222.376 2.439 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H]2CC23CC3)CC1 ZINC000424331609 385169483 /nfs/dbraw/zinc/16/94/83/385169483.db2.gz VNIVZLSDFVWKFD-LBPRGKRZSA-N 2 0 208.349 2.003 20 0 BEADRP C[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)C1(C)CC1 ZINC000336762970 385175413 /nfs/dbraw/zinc/17/54/13/385175413.db2.gz ONSGARBCBUNADC-LLVKDONJSA-N 2 0 208.349 2.027 20 0 BEADRP CC[C@@H](C)C[C@H](CC)[NH2+]CCN(C)C ZINC000019266309 385179130 /nfs/dbraw/zinc/17/91/30/385179130.db2.gz VSOZEDLIDKKJEG-NEPJUHHUSA-N 2 0 200.370 2.352 20 0 BEADRP CC(C)C[C@H](C)C[N@@H+]1C[C@@H]2CCC[NH2+][C@@H]2C1 ZINC000300987394 385221514 /nfs/dbraw/zinc/22/15/14/385221514.db2.gz VBERXDRECRSPLG-MELADBBJSA-N 2 0 224.392 2.352 20 0 BEADRP CC(C)C[C@H](C)C[N@@H+]1CC[C@](C)(C[NH3+])C1 ZINC000300986632 385221933 /nfs/dbraw/zinc/22/19/33/385221933.db2.gz UXKYYFSLGMFCAQ-QWHCGFSZSA-N 2 0 212.381 2.339 20 0 BEADRP CCSCCC[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@H]1C ZINC000300990033 385223331 /nfs/dbraw/zinc/22/33/31/385223331.db2.gz VSZFFQNMZRHCCS-FRRDWIJNSA-N 2 0 244.448 2.448 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]C[C@H](c1ccccc1)N(C)C ZINC000310965988 385257229 /nfs/dbraw/zinc/25/72/29/385257229.db2.gz BGOSMTJQEVZLKV-UKRRQHHQSA-N 2 0 249.402 2.006 20 0 BEADRP C[C@H](CC1CC1)[NH2+]CC1=CC[N@H+](C)CC1 ZINC000308875313 385241382 /nfs/dbraw/zinc/24/13/82/385241382.db2.gz SCDHGTOLXHYREZ-LLVKDONJSA-N 2 0 208.349 2.027 20 0 BEADRP CC[C@@H]([NH2+]CCC[NH3+])c1ccccc1OC ZINC000037713697 385306830 /nfs/dbraw/zinc/30/68/30/385306830.db2.gz HLIFVYZNAUPIEG-GFCCVEGCSA-N 2 0 222.332 2.085 20 0 BEADRP C[C@H](C[NH2+]CC1CCCCC1)C[NH+](C)C ZINC000308953520 385307600 /nfs/dbraw/zinc/30/76/00/385307600.db2.gz YJIDGWCSFHICGR-GFCCVEGCSA-N 2 0 212.381 2.354 20 0 BEADRP [NH3+]C[C@@H]1CCC[N@H+](C/C=C/c2ccccc2)C1 ZINC000044529436 385309311 /nfs/dbraw/zinc/30/93/11/385309311.db2.gz DZPCSYAGAXXUTP-LWUPOJRFSA-N 2 0 230.355 2.371 20 0 BEADRP CC[C@H]1CCC[C@@H](C[N@@H+]2CCCNCC2)C1 ZINC000346679776 385258495 /nfs/dbraw/zinc/25/84/95/385258495.db2.gz ATFAJTWAGNAPFJ-UONOGXRCSA-N 2 0 224.392 2.498 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H](C)C[NH3+])c1ccccc1 ZINC000308981060 385323534 /nfs/dbraw/zinc/32/35/34/385323534.db2.gz KIPJQNJOOSEZJX-WCQYABFASA-N 2 0 206.333 2.322 20 0 BEADRP CC(C)[C@@H]([NH3+])CC[N@H+](C)CCCCCF ZINC000308924207 385295774 /nfs/dbraw/zinc/29/57/74/385295774.db2.gz LOJSPZWQFJRIIT-LBPRGKRZSA-N 2 0 218.360 2.431 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H](C)c1ccccc1F ZINC000308993931 385336533 /nfs/dbraw/zinc/33/65/33/385336533.db2.gz OSWUDVYFKQBCGF-ZJUUUORDSA-N 2 0 210.296 2.071 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@H]1CCC12CCC2 ZINC000309045576 385388985 /nfs/dbraw/zinc/38/89/85/385388985.db2.gz OICOGHCYTUESIO-LBPRGKRZSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@]1(C)CCCS1 ZINC000309019301 385372735 /nfs/dbraw/zinc/37/27/35/385372735.db2.gz STLMVNQUEMKNNU-NEPJUHHUSA-N 2 0 230.421 2.379 20 0 BEADRP CCC1CC([NH2+][C@@H]2CCN(C)[C@@H](C)C2)C1 ZINC000309176627 385451045 /nfs/dbraw/zinc/45/10/45/385451045.db2.gz MXTLLXBUADMFJA-GMKTYKIGSA-N 2 0 210.365 2.247 20 0 BEADRP CCC(CC)C[NH2+][C@@H]1CC[NH2+]CC[C@H]1C ZINC000422863273 385464655 /nfs/dbraw/zinc/46/46/55/385464655.db2.gz RNXPPDVLBYQAGJ-DGCLKSJQSA-N 2 0 212.381 2.400 20 0 BEADRP CCC1CC([NH2+]C[C@@H]2CC[N@H+](CC)C2)C1 ZINC000309202542 385477552 /nfs/dbraw/zinc/47/75/52/385477552.db2.gz RPGXJBIYJUMHMC-CPCZMJQVSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000309274948 385507181 /nfs/dbraw/zinc/50/71/81/385507181.db2.gz DRGKZJLJNPHTHH-KXUCPTDWSA-N 2 0 238.297 2.292 20 0 BEADRP COC(C)(C)[C@@H](C)[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000302510657 385535255 /nfs/dbraw/zinc/53/52/55/385535255.db2.gz VFCWYCMLPMKXAR-GFCCVEGCSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@@H](C)CCc1ccccc1 ZINC000309341403 385540889 /nfs/dbraw/zinc/54/08/89/385540889.db2.gz LCRHFOHXBPTHBA-STQMWFEESA-N 2 0 220.360 2.192 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@@H]1CCc2ccccc21 ZINC000309353786 385545641 /nfs/dbraw/zinc/54/56/41/385545641.db2.gz CCWRUTAQUIMLEC-SMDDNHRTSA-N 2 0 218.344 2.391 20 0 BEADRP C[C@@H](F)CC[N@@H+]1CC[C@@]2(C1)CCC[NH+](C)C2 ZINC000334219517 385520512 /nfs/dbraw/zinc/52/05/12/385520512.db2.gz FUJHWHWWFBNTFR-OLZOCXBDSA-N 2 0 228.355 2.152 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CCc1ccccc1 ZINC000309309352 385525636 /nfs/dbraw/zinc/52/56/36/385525636.db2.gz DTOXDCLBQYASDJ-CYBMUJFWSA-N 2 0 220.360 2.336 20 0 BEADRP C[C@@H]([NH2+]CCC[NH3+])[C@H](C)c1ccccc1 ZINC000309376646 385558050 /nfs/dbraw/zinc/55/80/50/385558050.db2.gz CTKALDBATMGIKM-NWDGAFQWSA-N 2 0 206.333 2.117 20 0 BEADRP CCc1ccccc1C[NH2+][C@H](C)CCC[NH3+] ZINC000309384771 385558561 /nfs/dbraw/zinc/55/85/61/385558561.db2.gz GXYNCMUZEBPEOP-GFCCVEGCSA-N 2 0 220.360 2.466 20 0 BEADRP CC(C)C[C@@H](C)C[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000414848218 385606921 /nfs/dbraw/zinc/60/69/21/385606921.db2.gz KLZHCXZWKKZWFU-OLZOCXBDSA-N 2 0 212.381 2.258 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@H]1CCCc2occc21 ZINC000336676053 385602648 /nfs/dbraw/zinc/60/26/48/385602648.db2.gz VNAMMSZKFIPIRN-JQWIXIFHSA-N 2 0 222.332 2.374 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)[C@H]1C ZINC000336650100 385602729 /nfs/dbraw/zinc/60/27/29/385602729.db2.gz DLMNUWGYZLETME-UHXUPSOCSA-N 2 0 222.376 2.105 20 0 BEADRP CC(C)=CC[NH2+][C@@H]1CC[N@@H+](C)[C@H]2CCC[C@H]21 ZINC000309453287 385585242 /nfs/dbraw/zinc/58/52/42/385585242.db2.gz LRSCGKMXJPJZFR-MJBXVCDLSA-N 2 0 222.376 2.415 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCCN(C)[C@H]1C)[C@@H]1CC1(C)C ZINC000309458200 385589963 /nfs/dbraw/zinc/58/99/63/385589963.db2.gz OAWIODQMGZWHNT-ZDEQEGDKSA-N 2 0 224.392 2.493 20 0 BEADRP CCOc1cccc(C[NH2+]C[C@@H](C)C[NH2+]C)c1 ZINC000414848376 385614287 /nfs/dbraw/zinc/61/42/87/385614287.db2.gz WVZYQYAUYRENPF-LBPRGKRZSA-N 2 0 236.359 2.030 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H](C)Cc1ccccc1C ZINC000414848359 385615272 /nfs/dbraw/zinc/61/52/72/385615272.db2.gz WUSYOGZZOSGAHC-JSGCOSHPSA-N 2 0 234.387 2.371 20 0 BEADRP CC1(C)C[C@@H]1[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000251104113 385617154 /nfs/dbraw/zinc/61/71/54/385617154.db2.gz AWTLYUULITXOEX-RVMXOQNASA-N 2 0 222.376 2.295 20 0 BEADRP CCSCC[NH2+]C1CC[NH+](CC(C)C)CC1 ZINC000336680089 385630866 /nfs/dbraw/zinc/63/08/66/385630866.db2.gz XKVPFVBDGOOUBP-UHFFFAOYSA-N 2 0 244.448 2.450 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H]1C[C@@H](C)[C@@H]1C ZINC000336677600 385608870 /nfs/dbraw/zinc/60/88/70/385608870.db2.gz HYUQVQFHFTULJT-FRRDWIJNSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H]([NH2+]Cc1ccc(F)cc1)[C@H]1CCC[NH2+]C1 ZINC000414851471 385659080 /nfs/dbraw/zinc/65/90/80/385659080.db2.gz JLVWGJCBTSYUPH-AAEUAGOBSA-N 2 0 236.334 2.303 20 0 BEADRP C([NH2+][C@H]1CCCC[C@H]1C1CC1)[C@@H]1CCC[NH2+]1 ZINC000414853783 385690793 /nfs/dbraw/zinc/69/07/93/385690793.db2.gz YCKAIYSETACBFS-IHRRRGAJSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H]([NH2+]CC1=CC[N@H+](C)CC1)C1CCCC1 ZINC000309557243 385695816 /nfs/dbraw/zinc/69/58/16/385695816.db2.gz KAJZLLIYAXEAKU-LBPRGKRZSA-N 2 0 222.376 2.417 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)o1 ZINC000647792825 385696576 /nfs/dbraw/zinc/69/65/76/385696576.db2.gz AEXKJEUXUPRZQN-BFHYXJOUSA-N 2 0 248.370 2.108 20 0 BEADRP Clc1csc(C[NH2+]C[C@@H]2CCC[NH2+]C2)c1 ZINC000414856552 385714694 /nfs/dbraw/zinc/71/46/94/385714694.db2.gz OILALIRRHQKPGV-SECBINFHSA-N 2 0 244.791 2.491 20 0 BEADRP C[C@@H](CN(C)C)[NH2+][C@H]1CCC12CCCC2 ZINC000336735818 385716378 /nfs/dbraw/zinc/71/63/78/385716378.db2.gz ONRICXNYQFMBEL-RYUDHWBXSA-N 2 0 210.365 2.249 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1CCC(C)(C)C[C@H]1C ZINC000414857551 385730203 /nfs/dbraw/zinc/73/02/03/385730203.db2.gz DWJOJOXAGRYJEV-VXGBXAGGSA-N 2 0 212.381 2.400 20 0 BEADRP Cc1ccc(C[NH2+][C@@H](C)[C@@H]2CCC[NH2+]C2)cc1 ZINC000414858577 385735865 /nfs/dbraw/zinc/73/58/65/385735865.db2.gz SAVIIHZESYJWGW-DZGCQCFKSA-N 2 0 232.371 2.473 20 0 BEADRP CC[NH2+][C@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185709281 385735868 /nfs/dbraw/zinc/73/58/68/385735868.db2.gz AGFMLAUXFKWXCB-NEPJUHHUSA-N 2 0 210.365 2.249 20 0 BEADRP CC(C)[C@H]1CCCC[C@H]1[NH2+]C[C@H](C)C[NH3+] ZINC000336693623 385736410 /nfs/dbraw/zinc/73/64/10/385736410.db2.gz NJKIIFQVBKJLGC-JHJVBQTASA-N 2 0 212.381 2.386 20 0 BEADRP CC(C)CSCC[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000309608940 385739980 /nfs/dbraw/zinc/73/99/80/385739980.db2.gz MBKQQQBOXFRGLF-OLZOCXBDSA-N 2 0 244.448 2.448 20 0 BEADRP CC[C@@H](C)C[C@H](CC)[NH2+]CCC[NH2+]C ZINC000414859346 385740726 /nfs/dbraw/zinc/74/07/26/385740726.db2.gz MOIOYRMSZGAQHK-NEPJUHHUSA-N 2 0 200.370 2.400 20 0 BEADRP C[NH2+]CCC[NH2+][C@H](C)[C@@H](C)c1ccccc1 ZINC000414861666 385752965 /nfs/dbraw/zinc/75/29/65/385752965.db2.gz SSHMKSQTACKNKQ-CHWSQXEVSA-N 2 0 220.360 2.378 20 0 BEADRP [NH3+][C@H]1CCCN(CCCOCc2ccccc2)C1 ZINC000336698005 385754412 /nfs/dbraw/zinc/75/44/12/385754412.db2.gz BUQYZXXJSSWLOW-HNNXBMFYSA-N 2 0 248.370 2.016 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@H]1C)[C@H]1CCC[NH2+]C1 ZINC000414863097 385756815 /nfs/dbraw/zinc/75/68/15/385756815.db2.gz XXWUISQREWNBOT-VOAKCMCISA-N 2 0 210.365 2.153 20 0 BEADRP C([NH2+][C@H]1CCC[C@H]1C1CC1)[C@@H]1CCC[NH2+]C1 ZINC000414863898 385761212 /nfs/dbraw/zinc/76/12/12/385761212.db2.gz YKTLSCUCRXOUMG-XBFCOCLRSA-N 2 0 222.376 2.154 20 0 BEADRP CC[NH2+]Cc1cccc(NC[C@@H]2CCC[NH2+]C2)c1 ZINC000414864176 385767094 /nfs/dbraw/zinc/76/70/94/385767094.db2.gz JMXKUZQEFHFSGU-CQSZACIVSA-N 2 0 247.386 2.208 20 0 BEADRP CC(C)[C@@H](CN[C@H]1CC[NH2+]C1)c1ccccc1 ZINC000414866528 385781004 /nfs/dbraw/zinc/78/10/04/385781004.db2.gz FITSDYZSLWXBIL-LSDHHAIUSA-N 2 0 232.371 2.378 20 0 BEADRP CC[C@@H](COC)[NH2+]CC1([NH3+])CCCCCC1 ZINC000414857376 385724139 /nfs/dbraw/zinc/72/41/39/385724139.db2.gz DAMGWTIQLVFNNB-LBPRGKRZSA-N 2 0 228.380 2.053 20 0 BEADRP CC(C)C[C@@H]1C[C@H]1[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000647799882 385799114 /nfs/dbraw/zinc/79/91/14/385799114.db2.gz RZFPJHANUXSTKE-XPABHHOTSA-N 2 0 236.403 2.399 20 0 BEADRP C([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)[C@@H]1C[C@H]1C1CCC1 ZINC000647799404 385800260 /nfs/dbraw/zinc/80/02/60/385800260.db2.gz FLEIQXWUVLUEPF-CWVYHPPDSA-N 2 0 248.414 2.400 20 0 BEADRP F[C@@H]1CCCC[C@H]1[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000647799474 385801004 /nfs/dbraw/zinc/80/10/04/385801004.db2.gz IEBDDWJCAFCDMD-DHGKCCLASA-N 2 0 240.366 2.245 20 0 BEADRP C1[C@@H]([NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)[C@@H]1C1CCC1 ZINC000647799703 385802841 /nfs/dbraw/zinc/80/28/41/385802841.db2.gz OLNOFDBQVWFPLR-SBJFKYEJSA-N 2 0 234.387 2.153 20 0 BEADRP C1[C@@H]([NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)[C@@H]1C1CCC1 ZINC000647799704 385803188 /nfs/dbraw/zinc/80/31/88/385803188.db2.gz OLNOFDBQVWFPLR-VYDRJRHOSA-N 2 0 234.387 2.153 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]1[NH2+]C[C@H]1C[C@@H]1c1ccccc1 ZINC000647800414 385806411 /nfs/dbraw/zinc/80/64/11/385806411.db2.gz AVTYFZJRPLYGSL-KBXIAJHMSA-N 2 0 230.355 2.260 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+]Cc1ccc(F)c2cccnc12 ZINC000414871619 385856768 /nfs/dbraw/zinc/85/67/68/385856768.db2.gz DPRPWKYPGXGXDG-JTQLQIEISA-N 2 0 247.317 2.058 20 0 BEADRP C[C@H](C[NH2+][C@@H](C)[C@@H]1CCCC[NH2+]1)CC(F)F ZINC000647800557 385807403 /nfs/dbraw/zinc/80/74/03/385807403.db2.gz FGYWEMBRTHSLFL-DCAQKATOSA-N 2 0 234.334 2.398 20 0 BEADRP C[C@H](CCC1CC1)[NH2+][C@H]1CC[NH2+][C@H](C)C1 ZINC000414948673 385809816 /nfs/dbraw/zinc/80/98/16/385809816.db2.gz MNMLGEDEPBQZFQ-WZRBSPASSA-N 2 0 210.365 2.295 20 0 BEADRP CCC[NH2+]CC[NH2+][C@H](C)CCC(F)(F)F ZINC000414867799 385810837 /nfs/dbraw/zinc/81/08/37/385810837.db2.gz JEOCUDHRRVAHHU-SECBINFHSA-N 2 0 226.286 2.307 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H](C)CC(F)F)[C@@H]1CCC[NH2+]1 ZINC000647801123 385811100 /nfs/dbraw/zinc/81/11/00/385811100.db2.gz OQRRPFJTOQDGBI-AXFHLTTASA-N 2 0 234.334 2.398 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[NH2+][C@@H](C)C2)C1 ZINC000414950313 385817153 /nfs/dbraw/zinc/81/71/53/385817153.db2.gz OJRMLVOIYNRJNN-MROQNXINSA-N 2 0 210.365 2.295 20 0 BEADRP Cc1ccncc1[C@@H](C)[NH2+]C[C@H]1CCCN1C ZINC000271377285 385822485 /nfs/dbraw/zinc/82/24/85/385822485.db2.gz HVIOHNWNLKUTKR-CHWSQXEVSA-N 2 0 233.359 2.135 20 0 BEADRP CC[C@H](C[N@H+](C)CC[C@H]1CCCC[NH+]1C)OC ZINC000412977223 385823335 /nfs/dbraw/zinc/82/33/35/385823335.db2.gz LBLIFVUXXYPOTP-ZIAGYGMSSA-N 2 0 242.407 2.218 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCC[C@H]2C)CC[NH2+]1 ZINC000414954538 385829140 /nfs/dbraw/zinc/82/91/40/385829140.db2.gz SQSCZDJTWXXKFS-FDYHWXHSSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H]([NH2+]Cc1ccc(C[NH3+])cc1)C1CCOCC1 ZINC000647803308 385837517 /nfs/dbraw/zinc/83/75/17/385837517.db2.gz SUBBYTYQZZTUIG-LBPRGKRZSA-N 2 0 248.370 2.050 20 0 BEADRP CO[C@H]1CCC[C@H]([NH2+]Cc2ccc(C[NH3+])cc2)C1 ZINC000647803231 385839570 /nfs/dbraw/zinc/83/95/70/385839570.db2.gz OVUYGXMHPNSSKD-GJZGRUSLSA-N 2 0 248.370 2.193 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[C@H]2C1)[C@H]1CCCC[NH2+]1 ZINC000647804278 385840376 /nfs/dbraw/zinc/84/03/76/385840376.db2.gz NHWMKFWSTAXABL-QSLWVIQJSA-N 2 0 222.376 2.295 20 0 BEADRP [NH3+]CC1CCC([NH2+][C@@H]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC000647804089 385840383 /nfs/dbraw/zinc/84/03/83/385840383.db2.gz IPVUQHBPAXGBSO-QNOVJUQQSA-N 2 0 222.376 2.282 20 0 BEADRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]CC1CCC(F)CC1 ZINC000647804317 385841018 /nfs/dbraw/zinc/84/10/18/385841018.db2.gz OZXPYIQSBQMRJU-KPFVRQRISA-N 2 0 228.355 2.232 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H](C)[C@]1(C)CCCO1 ZINC000340462342 385849962 /nfs/dbraw/zinc/84/99/62/385849962.db2.gz LTNNGYLZHGSPQM-KBPBESRZSA-N 2 0 242.407 2.266 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H](C)[C@@]1(C)CCCO1 ZINC000340462345 385850027 /nfs/dbraw/zinc/85/00/27/385850027.db2.gz LTNNGYLZHGSPQM-ZIAGYGMSSA-N 2 0 242.407 2.266 20 0 BEADRP CSCCCCC[NH2+][C@H]1CC[N@H+](C)C[C@@H]1C ZINC000309689618 385791456 /nfs/dbraw/zinc/79/14/56/385791456.db2.gz ISMFLIFWMSACGS-STQMWFEESA-N 2 0 244.448 2.450 20 0 BEADRP CCSCCC[NH2+][C@@H]1CC[N@H+](CC)C[C@H]1C ZINC000309679385 385792726 /nfs/dbraw/zinc/79/27/26/385792726.db2.gz ZBILEYDAZHJJPQ-CHWSQXEVSA-N 2 0 244.448 2.450 20 0 BEADRP CSCCCCC[NH2+][C@@H]1CC[N@H+](C)C[C@H]1C ZINC000309689593 385793233 /nfs/dbraw/zinc/79/32/33/385793233.db2.gz ISMFLIFWMSACGS-CHWSQXEVSA-N 2 0 244.448 2.450 20 0 BEADRP C[C@H](CCC1CCCC1)[NH2+][C@@H]1CC[NH2+]C1 ZINC000414867057 385795488 /nfs/dbraw/zinc/79/54/88/385795488.db2.gz FYTUOYQBUBMXIX-DGCLKSJQSA-N 2 0 210.365 2.297 20 0 BEADRP [NH3+]CC1CCC([NH2+]C2Cc3ccccc3C2)CC1 ZINC000335037236 385928725 /nfs/dbraw/zinc/92/87/25/385928725.db2.gz BQRPYAZRBWWCFH-UHFFFAOYSA-N 2 0 244.382 2.261 20 0 BEADRP C[N@H+](CCC[NH3+])CCCc1cccc(F)c1 ZINC000647847672 385899123 /nfs/dbraw/zinc/89/91/23/385899123.db2.gz ZGJASXKJYYDNEO-UHFFFAOYSA-N 2 0 224.323 2.039 20 0 BEADRP CCCC[C@H](CC)[NH2+]C[C@@]1(COC)CCC[NH2+]1 ZINC000414963751 385899995 /nfs/dbraw/zinc/89/99/95/385899995.db2.gz XLAHSFUROAVWMJ-UONOGXRCSA-N 2 0 242.407 2.313 20 0 BEADRP Cc1cc(N)cc(C[NH2+][C@@H](C)C[C@@H]2CCC[NH2+]2)c1 ZINC000414964005 385902504 /nfs/dbraw/zinc/90/25/04/385902504.db2.gz LKFKSBAJPBAJPO-WFASDCNBSA-N 2 0 247.386 2.197 20 0 BEADRP COC[C@]1(C[NH2+]C[C@@H](C)CC(C)C)CCC[NH2+]1 ZINC000414965502 385905171 /nfs/dbraw/zinc/90/51/71/385905171.db2.gz ZORDNHXXOCNVJC-UONOGXRCSA-N 2 0 242.407 2.027 20 0 BEADRP C[C@@H](C[NH2+]CC1([NH3+])CCC1)c1ccccc1 ZINC000414876523 385909702 /nfs/dbraw/zinc/90/97/02/385909702.db2.gz LKRQUNISQKGIDS-LBPRGKRZSA-N 2 0 218.344 2.261 20 0 BEADRP COC[C@]1(C[NH2+][C@H](C)CCC(C)C)CCC[NH2+]1 ZINC000414964848 385909713 /nfs/dbraw/zinc/90/97/13/385909713.db2.gz YPNXXVQDHRJGFO-ZIAGYGMSSA-N 2 0 242.407 2.169 20 0 BEADRP Cc1ccc(CN2CC[C@H]3CC[N@@H+](C)C[C@@H]32)o1 ZINC000272544119 385910252 /nfs/dbraw/zinc/91/02/52/385910252.db2.gz CGCXPEIMNBVDPR-OCCSQVGLSA-N 2 0 234.343 2.114 20 0 BEADRP CCCC[C@H](COC)[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000414965229 385914761 /nfs/dbraw/zinc/91/47/61/385914761.db2.gz NJOJKVSXGCMGIT-ZIAGYGMSSA-N 2 0 242.407 2.313 20 0 BEADRP C([NH2+][C@@H]1CCCC12CCCC2)[C@H]1CCC[NH2+]1 ZINC000335033069 385920303 /nfs/dbraw/zinc/92/03/03/385920303.db2.gz OFSBQNVQNBLIQX-CHWSQXEVSA-N 2 0 222.376 2.441 20 0 BEADRP Fc1ccc(C[NH2+]CCC[C@@H]2CCC[NH2+]2)cc1 ZINC000414966564 385922698 /nfs/dbraw/zinc/92/26/98/385922698.db2.gz GTDQGPHCFYPDOJ-CQSZACIVSA-N 2 0 236.334 2.448 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]CC1(C)CCC1 ZINC000335034025 385924363 /nfs/dbraw/zinc/92/43/63/385924363.db2.gz STUAYAFNUJSHHW-NEPJUHHUSA-N 2 0 210.365 2.154 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@@H](C)CCC(F)(F)F ZINC000414958594 385859625 /nfs/dbraw/zinc/85/96/25/385859625.db2.gz PDZFZUPRGNOKGO-DTWKUNHWSA-N 2 0 226.286 2.305 20 0 BEADRP CCCOc1cccc(C[NH2+]C[C@H](C)C[NH3+])c1 ZINC000414871601 385861311 /nfs/dbraw/zinc/86/13/11/385861311.db2.gz DKOWIVCSYRKKRT-GFCCVEGCSA-N 2 0 236.359 2.160 20 0 BEADRP C[C@@H]([NH2+]CC(C)(C)C[NH+](C)C)[C@]1(C)CCCO1 ZINC000340473675 385877789 /nfs/dbraw/zinc/87/77/89/385877789.db2.gz KGRRBPBTBATRJF-OCCSQVGLSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H]([NH2+]C1CCCCCC1)[C@@H]1CCC[NH2+]1 ZINC000335037240 385928393 /nfs/dbraw/zinc/92/83/93/385928393.db2.gz BSCWARQBJXOYQX-AAEUAGOBSA-N 2 0 210.365 2.439 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]CC1CCC(F)(F)CC1 ZINC000335020930 385980198 /nfs/dbraw/zinc/98/01/98/385980198.db2.gz CZGXXUHQUBSZJA-MNOVXSKESA-N 2 0 232.318 2.281 20 0 BEADRP C[C@H](C[NH2+]C[C@H]([NH3+])C1CC1)Cc1ccccc1 ZINC000414881370 385990769 /nfs/dbraw/zinc/99/07/69/385990769.db2.gz AHNVKGFZHBMUBF-WFASDCNBSA-N 2 0 232.371 2.192 20 0 BEADRP C[C@H]([NH2+][C@H]1CCCc2ccccc21)C1C[NH2+]C1 ZINC000335039062 385930479 /nfs/dbraw/zinc/93/04/79/385930479.db2.gz LSRUKJYEDZEDBO-NHYWBVRUSA-N 2 0 230.355 2.262 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCCc2ccccc21)C1C[NH2+]C1 ZINC000335039060 385931695 /nfs/dbraw/zinc/93/16/95/385931695.db2.gz LSRUKJYEDZEDBO-ABAIWWIYSA-N 2 0 230.355 2.262 20 0 BEADRP COC1CCC([NH2+]CCC[C@@H]2CCC[NH2+]2)CC1 ZINC000414968055 385934200 /nfs/dbraw/zinc/93/42/00/385934200.db2.gz RDPBGOVTFRAYST-HSBZDZAISA-N 2 0 240.391 2.066 20 0 BEADRP CC1CCC(C[NH2+][C@H]2CCC[C@H]2[NH3+])CC1 ZINC000335043590 385935274 /nfs/dbraw/zinc/93/52/74/385935274.db2.gz PIGMUURKJNIFAM-TUUUFIMRSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H](C[C@H]1CCCCC[NH2+]1)[NH2+]C[C@H]1CCCO1 ZINC000251156698 385935484 /nfs/dbraw/zinc/93/54/84/385935484.db2.gz BOFCXGWBJPMSTJ-MGPQQGTHSA-N 2 0 240.391 2.066 20 0 BEADRP CC[NH+](CC)CCSC[C@H]1CC[N@H+](C)C1 ZINC000187690454 134477060 /nfs/dbraw/zinc/47/70/60/134477060.db2.gz NUILRHXYZKYIHZ-LBPRGKRZSA-N 2 0 230.421 2.013 20 0 BEADRP CC[C@H](C[C@@H](C)CC)[NH2+]C[C@@H](C)C[NH3+] ZINC000414879112 385948423 /nfs/dbraw/zinc/94/84/23/385948423.db2.gz PCGDSXCIRFPUNY-SDDRHHMPSA-N 2 0 200.370 2.386 20 0 BEADRP CC1([NH3+])CC[NH+](CCCc2ccsc2)CC1 ZINC000647924277 385950358 /nfs/dbraw/zinc/95/03/58/385950358.db2.gz UILWTHYSNHIVSJ-UHFFFAOYSA-N 2 0 238.400 2.494 20 0 BEADRP [NH3+]C1CCC([NH2+][C@H]2CCC23CCC3)CC1 ZINC000335052915 385951694 /nfs/dbraw/zinc/95/16/94/385951694.db2.gz WEEQDXYPPRGPBO-MCIGGMRASA-N 2 0 208.349 2.179 20 0 BEADRP C[C@@H]1C[C@H](C)[N@H+](C/C=C\Cl)C[C@H]1C[NH3+] ZINC000397245509 385954607 /nfs/dbraw/zinc/95/46/07/385954607.db2.gz AQJLGTGIJXHSEB-HITJCYSQSA-N 2 0 216.756 2.044 20 0 BEADRP CC[C@H](C[NH2+]C[C@H](C)C[NH3+])c1ccccc1 ZINC000414879988 385963023 /nfs/dbraw/zinc/96/30/23/385963023.db2.gz QFOWJKLSJZRESR-CHWSQXEVSA-N 2 0 220.360 2.365 20 0 BEADRP CC[C@H]1CC[C@@H]1[NH2+]CCC[NH+](CC)CC ZINC000336747100 385969029 /nfs/dbraw/zinc/96/90/29/385969029.db2.gz BTAQXWULSKWFFV-STQMWFEESA-N 2 0 212.381 2.497 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]Cc1ccc2c(c1)CCCN2 ZINC000335013873 385971833 /nfs/dbraw/zinc/97/18/33/385971833.db2.gz CTZKBLUISFXPAZ-HIFRSBDPSA-N 2 0 245.370 2.014 20 0 BEADRP C(C[NH2+]C1CCCCC1)C[C@@H]1CCC[NH2+]1 ZINC000336771024 386022283 /nfs/dbraw/zinc/02/22/83/386022283.db2.gz XGLQAJPZDAAUAP-CYBMUJFWSA-N 2 0 210.365 2.441 20 0 BEADRP FCCCC[NH+]1CCC(c2ncc[nH]2)CC1 ZINC000286314253 386022938 /nfs/dbraw/zinc/02/29/38/386022938.db2.gz HGDRJZSMNRBOEN-UHFFFAOYSA-N 2 0 225.311 2.339 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+]C1Cc2ccccc2C1 ZINC000221920888 386026300 /nfs/dbraw/zinc/02/63/00/386026300.db2.gz KTQBCZQVMYDWCA-UHFFFAOYSA-N 2 0 246.398 2.474 20 0 BEADRP Cc1ccc2c(c1)[C@@H]([NH2+]CC1=CC[NH2+]CC1)CC2 ZINC000335060754 386027117 /nfs/dbraw/zinc/02/71/17/386027117.db2.gz QZQWEOWJUZRBMC-INIZCTEOSA-N 2 0 242.366 2.492 20 0 BEADRP CC[C@@H]([NH3+])CNCc1coc2ccccc12 ZINC000414977032 386028372 /nfs/dbraw/zinc/02/83/72/386028372.db2.gz JJZSNQVRQNRYEY-LLVKDONJSA-N 2 0 218.300 2.260 20 0 BEADRP C[C@@H]1CCCC[C@H]1C[NH2+]C[C@H]([NH3+])C1CC1 ZINC000414883187 386033352 /nfs/dbraw/zinc/03/33/52/386033352.db2.gz CVHRPUATTXDXPH-WXHSDQCUSA-N 2 0 210.365 2.140 20 0 BEADRP COCc1cccc(C[NH2+][C@H]2CCC[NH2+]CC2)c1 ZINC000129158410 386033579 /nfs/dbraw/zinc/03/35/79/386033579.db2.gz QOODTTGJSIOZBA-HNNXBMFYSA-N 2 0 248.370 2.065 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+]Cc1cccc(Cl)c1F ZINC000414884246 386045411 /nfs/dbraw/zinc/04/54/11/386045411.db2.gz VYEXCRVLTYRVQT-QMMMGPOBSA-N 2 0 230.714 2.164 20 0 BEADRP COC[C@@H]([NH2+]Cc1ccc2c[nH+]cn2c1)C(C)C ZINC000414162071 386046227 /nfs/dbraw/zinc/04/62/27/386046227.db2.gz CUZGGMKWXJLKCS-CQSZACIVSA-N 2 0 247.342 2.095 20 0 BEADRP C1CC1[C@@H]1CCC[C@H]([NH2+]C2CC[NH2+]CC2)C1 ZINC000335078289 386049668 /nfs/dbraw/zinc/04/96/68/386049668.db2.gz PHGDWRJMMREHRO-OCCSQVGLSA-N 2 0 222.376 2.297 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@@H]2CC3CCC2CC3)C1 ZINC000309520716 386051342 /nfs/dbraw/zinc/05/13/42/386051342.db2.gz UBCXZFNSVIPCGJ-YTPFDHIKSA-N 2 0 222.376 2.425 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@H]([NH3+])C2CC2)[C@H](C)C1 ZINC000414889122 386103802 /nfs/dbraw/zinc/10/38/02/386103802.db2.gz KVQZPCJTPGDDTG-AAXDQBDMSA-N 2 0 210.365 2.138 20 0 BEADRP c1ccc(C[C@@H]2CC[C@@H]([NH2+][C@H]3CC[NH2+]C3)C2)cc1 ZINC000414889086 386107253 /nfs/dbraw/zinc/10/72/53/386107253.db2.gz SPDZRFKCYIEFBF-XHSDSOJGSA-N 2 0 244.382 2.349 20 0 BEADRP C[C@H]([NH2+]C1CCC([NH+](C)C)CC1)C1CC1 ZINC000336773113 386111352 /nfs/dbraw/zinc/11/13/52/386111352.db2.gz YRQYVKOXBIYQKK-PKSQDBQZSA-N 2 0 210.365 2.247 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@H]1CCC[C@@H](C2CC2)C1 ZINC000414986710 386113543 /nfs/dbraw/zinc/11/35/43/386113543.db2.gz YCQPCAQVNAKKKY-AGIUHOORSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]([NH3+])[C@H]1CC[N@H+](C[C@@H]2C[C@H]2c2ccccc2)C1 ZINC000414665778 386113843 /nfs/dbraw/zinc/11/38/43/386113843.db2.gz VXUYPEYEBPPIFM-OEAJRASXSA-N 2 0 244.382 2.459 20 0 BEADRP C[NH+](C)[C@@H]1CCC[C@H]([NH2+][C@H]2CCOC2(C)C)C1 ZINC000340254713 386119825 /nfs/dbraw/zinc/11/98/25/386119825.db2.gz FKYLTDAEYWDBMA-XQQFMLRXSA-N 2 0 240.391 2.016 20 0 BEADRP FC(F)(F)C1CC([NH2+][C@H]2CCC[NH2+]CC2)C1 ZINC000335017808 386059544 /nfs/dbraw/zinc/05/95/44/386059544.db2.gz NOPFHNYPLLWHIR-KYHHOPLUSA-N 2 0 236.281 2.059 20 0 BEADRP C1CC12CCC([NH2+][C@H]1CCC[NH2+]CC1)CC2 ZINC000335010795 386059597 /nfs/dbraw/zinc/05/95/97/386059597.db2.gz PPWYEGVZKVHRKJ-LBPRGKRZSA-N 2 0 222.376 2.441 20 0 BEADRP CC[C@H]1CC[C@@H]1[NH2+]CCC[N@H+](C)C(C)C ZINC000336771831 386063098 /nfs/dbraw/zinc/06/30/98/386063098.db2.gz WZUVBHZLWLONQL-STQMWFEESA-N 2 0 212.381 2.495 20 0 BEADRP COc1ccccc1C[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000414982655 386064473 /nfs/dbraw/zinc/06/44/73/386064473.db2.gz YRWXXMSRDPOTGZ-CQSZACIVSA-N 2 0 248.370 2.317 20 0 BEADRP C[C@H]1C[N@H+](C[C@@H]2C[C@H]2c2ccccc2)CC[C@H]1[NH3+] ZINC000414653879 386072170 /nfs/dbraw/zinc/07/21/70/386072170.db2.gz FIAUZWUGQSRHIK-QCEMKRCNSA-N 2 0 244.382 2.459 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@H]2CC2(C)C)[C@@H]2CCC[C@@H]21 ZINC000414217390 386074011 /nfs/dbraw/zinc/07/40/11/386074011.db2.gz CCSCJFYWAXFXHA-CYDGBPFRSA-N 2 0 222.376 2.247 20 0 BEADRP CC[C@H]([NH3+])CNCc1cccc2c1OC(C)(C)C2 ZINC000414984049 386082036 /nfs/dbraw/zinc/08/20/36/386082036.db2.gz UQTBJTYRJSKDES-ZDUSSCGKSA-N 2 0 248.370 2.227 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H](C)[C@H](C)c1ccccc1 ZINC000414887748 386095382 /nfs/dbraw/zinc/09/53/82/386095382.db2.gz ZKEHWASEYRQDAF-AGIUHOORSA-N 2 0 220.360 2.363 20 0 BEADRP [NH3+][C@@H](C[NH2+]CCCCOc1ccccc1)C1CC1 ZINC000414892051 386145278 /nfs/dbraw/zinc/14/52/78/386145278.db2.gz PFVXNOFUDLQJCT-HNNXBMFYSA-N 2 0 248.370 2.173 20 0 BEADRP CC(C)C[C@H](C)C[C@@H](C)[NH2+][C@H]1CC[NH2+]C1 ZINC000414892769 386150407 /nfs/dbraw/zinc/15/04/07/386150407.db2.gz YIYUXJRZJZTJPX-XQQFMLRXSA-N 2 0 212.381 2.399 20 0 BEADRP CC(C)[N@H+](C[C@H]1CC[NH2+][C@@H](C)C1)C1CC1 ZINC000414677462 386157413 /nfs/dbraw/zinc/15/74/13/386157413.db2.gz OVADFTHQSJGXPT-RYUDHWBXSA-N 2 0 210.365 2.247 20 0 BEADRP COc1ccccc1C[C@H]1CCC[N@@H+]1CCC[NH3+] ZINC000414683807 386167506 /nfs/dbraw/zinc/16/75/06/386167506.db2.gz BXTRAVWZWYWANS-CQSZACIVSA-N 2 0 248.370 2.051 20 0 BEADRP CC[C@H]([NH2+]CC1CC[NH+](C)CC1)c1ccncc1 ZINC000453114440 386172402 /nfs/dbraw/zinc/17/24/02/386172402.db2.gz VNICLRNBBSLSAZ-HNNXBMFYSA-N 2 0 247.386 2.464 20 0 BEADRP C[C@@H]1CCC[C@H](C[NH2+]C[C@H]([NH3+])C2CC2)C1 ZINC000414895808 386188908 /nfs/dbraw/zinc/18/89/08/386188908.db2.gz ZVBUYRBNUGGTOK-MDZLAQPJSA-N 2 0 210.365 2.140 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+][C@@H]2C[C@H]2c2ccco2)[C@H](C)C1 ZINC000414335088 386127681 /nfs/dbraw/zinc/12/76/81/386127681.db2.gz IZMKKGFLGZRAAZ-AAVRWANBSA-N 2 0 248.370 2.455 20 0 BEADRP C[C@H](CC[NH3+])[NH2+]C/C=C/c1ccccc1 ZINC000414890636 386131488 /nfs/dbraw/zinc/13/14/88/386131488.db2.gz UKQGSOOBOCNTCU-FZKGZDJFSA-N 2 0 204.317 2.027 20 0 BEADRP [NH3+]CCC[N@@H+]1CCC[C@H]1c1ccsc1 ZINC000414670355 386135019 /nfs/dbraw/zinc/13/50/19/386135019.db2.gz DBMPHTQXLYFYJT-NSHDSACASA-N 2 0 210.346 2.234 20 0 BEADRP C[C@H](c1ccc(F)cc1)[N@H+](C)C[C@@H]1CC[NH2+]C1 ZINC000647874410 386136426 /nfs/dbraw/zinc/13/64/26/386136426.db2.gz RZFCFJDUKODIBQ-VXGBXAGGSA-N 2 0 236.334 2.428 20 0 BEADRP c1ccc([C@@H]2CCC[N@H+]2C[C@@H]2CC[NH2+]C2)cc1 ZINC000647874482 386139636 /nfs/dbraw/zinc/13/96/36/386139636.db2.gz ZSRCRDFIXHAXEU-HIFRSBDPSA-N 2 0 230.355 2.433 20 0 BEADRP c1csc([C@H]2CCC[N@H+]2C[C@H]2CC[NH2+]C2)c1 ZINC000647872812 386141317 /nfs/dbraw/zinc/14/13/17/386141317.db2.gz WXSJDKSHDPPKIF-NWDGAFQWSA-N 2 0 236.384 2.495 20 0 BEADRP c1coc([C@@H]2C[C@H]2[NH2+]C2CCN(C3CC3)CC2)c1 ZINC000414356015 386142578 /nfs/dbraw/zinc/14/25/78/386142578.db2.gz ZPFYSFUVBMQIJO-ZIAGYGMSSA-N 2 0 246.354 2.352 20 0 BEADRP CCCC[N@H+](CCOC)C[C@@H]1CC[NH2+][C@@H](C)C1 ZINC000414701167 386202858 /nfs/dbraw/zinc/20/28/58/386202858.db2.gz UBNVRQYRPRSPKU-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP CC[C@H](C)[C@@H](C)[N@H+](C[C@H]1CC[NH2+]C1)C1CC1 ZINC000647884521 386259452 /nfs/dbraw/zinc/25/94/52/386259452.db2.gz ZECYVXSBODGPAU-XQQFMLRXSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H](c1ccccn1)[N@H+](C)C[C@H]1CC[NH2+][C@H](C)C1 ZINC000414702607 386211256 /nfs/dbraw/zinc/21/12/56/386211256.db2.gz ICUZAHJLTBWGLW-RDBSUJKOSA-N 2 0 247.386 2.463 20 0 BEADRP Cc1ccc(C)c(C[N@H+]2C[C@H](C[NH3+])C[C@@H]2C)c1 ZINC000131677920 386214879 /nfs/dbraw/zinc/21/48/79/386214879.db2.gz DJCRXGQGHNOFAK-KBPBESRZSA-N 2 0 232.371 2.473 20 0 BEADRP CC(C)Oc1cccc(CNC[C@H]([NH3+])C2CC2)c1 ZINC000414897852 386216447 /nfs/dbraw/zinc/21/64/47/386216447.db2.gz SEDJICRPSYTKAR-HNNXBMFYSA-N 2 0 248.370 2.301 20 0 BEADRP C[C@H]1C[C@H](c2ccc(F)cc2)C[N@@H+]1CCC[NH3+] ZINC000414707109 386217030 /nfs/dbraw/zinc/21/70/30/386217030.db2.gz PBKJOHPPOVUFOY-AAEUAGOBSA-N 2 0 236.334 2.352 20 0 BEADRP CC(C)Oc1cccc(CNC[C@@H]([NH3+])C2CC2)c1 ZINC000414897853 386217810 /nfs/dbraw/zinc/21/78/10/386217810.db2.gz SEDJICRPSYTKAR-OAHLLOKOSA-N 2 0 248.370 2.301 20 0 BEADRP [NH3+]CCCC[NH2+]Cc1ccccc1OCC1CC1 ZINC000414898114 386222056 /nfs/dbraw/zinc/22/20/56/386222056.db2.gz DBFHYPNYQGWPGO-UHFFFAOYSA-N 2 0 248.370 2.304 20 0 BEADRP C[C@H](c1cccnc1)[N@H+](C)C[C@H]1CC[NH2+][C@H](C)C1 ZINC000414709935 386224795 /nfs/dbraw/zinc/22/47/95/386224795.db2.gz KPFWMLQJVYFAOH-MCIONIFRSA-N 2 0 247.386 2.463 20 0 BEADRP CCOc1cccc(C[NH2+]C[C@H]2CCC[NH2+]C2)c1 ZINC000132178690 386226812 /nfs/dbraw/zinc/22/68/12/386226812.db2.gz RHPXOBFTWXVKIX-AWEZNQCLSA-N 2 0 248.370 2.175 20 0 BEADRP c1cncc([C@@H]2CCC[N@H+]2CC2CC[NH2+]CC2)c1 ZINC000132292356 386228427 /nfs/dbraw/zinc/22/84/27/386228427.db2.gz JQXKFWINMCNHOS-HNNXBMFYSA-N 2 0 245.370 2.218 20 0 BEADRP CCc1ccccc1C[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000132271296 386229860 /nfs/dbraw/zinc/22/98/60/386229860.db2.gz QQVHXKFVJXLRRR-ZDUSSCGKSA-N 2 0 232.371 2.338 20 0 BEADRP CC(C)C[C@@H]([NH3+])CN(C)[C@H](C)c1cccnc1 ZINC000414716705 386237906 /nfs/dbraw/zinc/23/79/06/386237906.db2.gz SQOXSTVWZQBTTP-TZMCWYRMSA-N 2 0 235.375 2.448 20 0 BEADRP CC(C)C[C@H]([NH3+])CN(C)[C@H](C)c1cccnc1 ZINC000414716704 386238236 /nfs/dbraw/zinc/23/82/36/386238236.db2.gz SQOXSTVWZQBTTP-OCCSQVGLSA-N 2 0 235.375 2.448 20 0 BEADRP CO[C@H](C)CN(CC[NH2+]C(C)(C)C)C(C)C ZINC000414716637 386238655 /nfs/dbraw/zinc/23/86/55/386238655.db2.gz XIQMFHWKYHINMM-GFCCVEGCSA-N 2 0 230.396 2.120 20 0 BEADRP C[C@H]1SCC[N@H+](CCC2CC[NH2+]CC2)[C@H]1C ZINC000132526265 386241644 /nfs/dbraw/zinc/24/16/44/386241644.db2.gz YPQKENNBTPTURS-NWDGAFQWSA-N 2 0 242.432 2.202 20 0 BEADRP CCCC[C@@H](COC)[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000414899527 386246732 /nfs/dbraw/zinc/24/67/32/386246732.db2.gz CLMDUZITDAASCT-UONOGXRCSA-N 2 0 242.407 2.171 20 0 BEADRP COc1ccc(C[NH2+]C[C@H]2CCC[C@@H]([NH3+])C2)cc1 ZINC000415003466 386254317 /nfs/dbraw/zinc/25/43/17/386254317.db2.gz XFQNXUBNXKMAGO-UONOGXRCSA-N 2 0 248.370 2.302 20 0 BEADRP CC[C@H]1c2ccsc2CC[N@H+]1CCC[NH3+] ZINC000414693061 386194313 /nfs/dbraw/zinc/19/43/13/386194313.db2.gz BRHOZABJBBNCPC-NSHDSACASA-N 2 0 224.373 2.406 20 0 BEADRP Cc1ccncc1CCC[NH2+]CCCC[NH+](C)C ZINC000289325900 386283686 /nfs/dbraw/zinc/28/36/86/386283686.db2.gz UGPPYPYSVYBWRU-UHFFFAOYSA-N 2 0 249.402 2.254 20 0 BEADRP C(C1CCCCC1)[N@@H+]1CC[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000133252629 386288770 /nfs/dbraw/zinc/28/87/70/386288770.db2.gz ILXMOHLQWSZBCA-KGLIPLIRSA-N 2 0 222.376 2.393 20 0 BEADRP C[C@@H](CC[NH3+])[NH2+]Cc1cccc2c1OC(C)(C)C2 ZINC000414901440 386292349 /nfs/dbraw/zinc/29/23/49/386292349.db2.gz WZXWVLXPTDRAFT-NSHDSACASA-N 2 0 248.370 2.227 20 0 BEADRP Cc1ccc(C[C@@H](C)[N@H+](C)C[C@@H]2CC[NH2+]C2)cc1 ZINC000647886089 386294468 /nfs/dbraw/zinc/29/44/68/386294468.db2.gz PZSZCUFLZUATQV-GDBMZVCRSA-N 2 0 246.398 2.467 20 0 BEADRP CCC[C@@]1(C)CCC[N@H+](C[C@H]2CC[NH2+]C2)C1 ZINC000647886118 386294613 /nfs/dbraw/zinc/29/46/13/386294613.db2.gz XKWLNKGAINCQJF-KBPBESRZSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H](C[NH2+]C1CC2(CCC2)C1)N(C)C1CC1 ZINC000336730952 386294780 /nfs/dbraw/zinc/29/47/80/386294780.db2.gz FBCKPWJJGTWMRR-NSHDSACASA-N 2 0 222.376 2.391 20 0 BEADRP C[C@H](CCc1cccc(F)c1)[NH2+][C@H](C)[C@H](C)[NH3+] ZINC000415006383 386325005 /nfs/dbraw/zinc/32/50/05/386325005.db2.gz BIRQPBREOHWHCB-GRYCIOLGSA-N 2 0 238.350 2.472 20 0 BEADRP C[C@@H]1c2ccccc2CC[N@H+]1C[C@@H]1CC[NH2+]C1 ZINC000647884443 386263403 /nfs/dbraw/zinc/26/34/03/386263403.db2.gz QKNNKCOMESBINQ-CHWSQXEVSA-N 2 0 230.355 2.215 20 0 BEADRP CC(C)C[C@H]1CCCC[N@@H+]1C[C@@H]1CC[NH2+]C1 ZINC000647888169 386340904 /nfs/dbraw/zinc/34/09/04/386340904.db2.gz VEMHKBDLASNELL-ZIAGYGMSSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1[C@H](N2CCCC2)CC[N@@H+]1CCC1CC1 ZINC000347349109 386343211 /nfs/dbraw/zinc/34/32/11/386343211.db2.gz VEXXCMNBFDWXFZ-TZMCWYRMSA-N 2 0 222.376 2.345 20 0 BEADRP CC[C@@H](C)C[N@@H+]1CC2(C[C@@H]1C)CC[NH2+]CC2 ZINC000335277588 386343950 /nfs/dbraw/zinc/34/39/50/386343950.db2.gz JSLPTMVEBFTWFR-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH+](C)CCC1CC[NH+](Cc2cccnc2)CC1 ZINC000339291720 386345764 /nfs/dbraw/zinc/34/57/64/386345764.db2.gz WCCCWBXPIBVLOX-UHFFFAOYSA-N 2 0 247.386 2.245 20 0 BEADRP C[Si](C)(C)C[NH+]1CCC(c2ncc[nH]2)CC1 ZINC000265540684 386347856 /nfs/dbraw/zinc/34/78/56/386347856.db2.gz WSNFEVJSDZZGHU-UHFFFAOYSA-N 2 0 237.423 2.467 20 0 BEADRP CC(C)Cc1ncc(C[NH2+]CCCC[NH3+])s1 ZINC000414904585 386350618 /nfs/dbraw/zinc/35/06/18/386350618.db2.gz NAFHRFOOOKGGPG-UHFFFAOYSA-N 2 0 241.404 2.170 20 0 BEADRP C([C@H]1CC[NH2+]C1)[NH+]1CCC(C2CCCC2)CC1 ZINC000647889960 386362927 /nfs/dbraw/zinc/36/29/27/386362927.db2.gz ALZDNXIMCHIHQO-ZDUSSCGKSA-N 2 0 236.403 2.498 20 0 BEADRP Fc1cccc([C@H]2CCN2C[C@H]2CC[NH2+]C2)c1 ZINC000647890040 386365514 /nfs/dbraw/zinc/36/55/14/386365514.db2.gz IQBKAUMETFJGEQ-SMDDNHRTSA-N 2 0 234.318 2.182 20 0 BEADRP C[C@@]1(C[NH2+]Cc2cccc(F)c2)CCC[NH2+]C1 ZINC000414906004 386366856 /nfs/dbraw/zinc/36/68/56/386366856.db2.gz PLEGWOBFWAQKHW-CQSZACIVSA-N 2 0 236.334 2.305 20 0 BEADRP COC1CC([NH2+][C@H](CC[NH+](C)C)C(C)(C)C)C1 ZINC000347394340 386382404 /nfs/dbraw/zinc/38/24/04/386382404.db2.gz YDXUWTYNBUKKIS-WXRRBKDZSA-N 2 0 242.407 2.120 20 0 BEADRP CC(C)(O)C(C)(C)C[NH2+][C@H]1CCCCC[C@@H]1[NH3+] ZINC000331953065 386329083 /nfs/dbraw/zinc/32/90/83/386329083.db2.gz JLSYXBPFZUQCES-RYUDHWBXSA-N 2 0 242.407 2.033 20 0 BEADRP CC[C@H](CSC)[N@H+](C)CCc1cncn1C ZINC000298394136 386336098 /nfs/dbraw/zinc/33/60/98/386336098.db2.gz LMPMKZJZBQDSOG-LLVKDONJSA-N 2 0 241.404 2.036 20 0 BEADRP CC(C)[C@H]1CC[N@H+](CC[C@@H]2CCC[NH+]2C)C1 ZINC000336681585 386336648 /nfs/dbraw/zinc/33/66/48/386336648.db2.gz QWSHAMKSXMCEKQ-KBPBESRZSA-N 2 0 224.392 2.449 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3F)C[C@@H]21 ZINC000230047010 386337103 /nfs/dbraw/zinc/33/71/03/386337103.db2.gz BKFMLEFIOYCBQP-OSAQELSMSA-N 2 0 248.345 2.385 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+]CC(C)(C)CC(C)C ZINC000391133699 386444702 /nfs/dbraw/zinc/44/47/02/386444702.db2.gz OHVQJDOCGGFNHS-CYBMUJFWSA-N 2 0 244.423 2.402 20 0 BEADRP COC[C@@H](CC(C)C)[NH2+]CC1(C)CC[NH2+]CC1 ZINC000414911035 386450514 /nfs/dbraw/zinc/45/05/14/386450514.db2.gz TUPUZJXNBZLSPB-CYBMUJFWSA-N 2 0 242.407 2.027 20 0 BEADRP Cc1ccncc1CCC[N@H+]1CCO[C@H](C)[C@@H]1C ZINC000290188119 386404710 /nfs/dbraw/zinc/40/47/10/386404710.db2.gz ZUAUTFSJRMXLRS-UONOGXRCSA-N 2 0 248.370 2.432 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000414909619 386409622 /nfs/dbraw/zinc/40/96/22/386409622.db2.gz TWENQSDEOBWRLI-NXEZZACHSA-N 2 0 238.297 2.449 20 0 BEADRP [NH3+]C[C@@H]1CC[N@H+](CCCCOc2ccccc2)C1 ZINC000339408896 386415498 /nfs/dbraw/zinc/41/54/98/386415498.db2.gz FYTNTYMAZGTPPD-AWEZNQCLSA-N 2 0 248.370 2.126 20 0 BEADRP C[C@H](C[C@H]1CCC[NH2+]1)[NH2+]CCc1ccccc1 ZINC000093462328 386416755 /nfs/dbraw/zinc/41/67/55/386416755.db2.gz QURXJOUDYSAHGI-UKRRQHHQSA-N 2 0 232.371 2.349 20 0 BEADRP C[C@H]([NH3+])C[N@@H+]1C[C@H](c2ccccc2)C[C@H]1C ZINC000442664584 386418361 /nfs/dbraw/zinc/41/83/61/386418361.db2.gz MNYGRXUINYDJFF-OUCADQQQSA-N 2 0 218.344 2.212 20 0 BEADRP C[C@@H]([NH3+])[C@H](C)NCc1cnc(C2CCC2)s1 ZINC000415009382 386419922 /nfs/dbraw/zinc/41/99/22/386419922.db2.gz NZUJAZBGUWWFNB-BDAKNGLRSA-N 2 0 239.388 2.236 20 0 BEADRP C[C@H]1OCC[C@@H]1[NH2+]CCCCC[NH+]1CCCC1 ZINC000339500239 386452018 /nfs/dbraw/zinc/45/20/18/386452018.db2.gz YQNKGYBNQLSDMG-KGLIPLIRSA-N 2 0 240.391 2.020 20 0 BEADRP C[NH+]1CCC([C@@H]2CC[N@H+](Cc3ccco3)C2)CC1 ZINC000290331654 386423497 /nfs/dbraw/zinc/42/34/97/386423497.db2.gz DURYXNJJFIGBHD-CQSZACIVSA-N 2 0 248.370 2.443 20 0 BEADRP C[C@H]1C[C@H](C[N@@H+]2CCCC[C@@H](C)C2)CC[NH2+]1 ZINC000414765493 386430884 /nfs/dbraw/zinc/43/08/84/386430884.db2.gz ZXXREUTUXGURLN-HZSPNIEDSA-N 2 0 224.392 2.497 20 0 BEADRP CO[C@H](C)C[N@H+](CC[C@@H]1CCC[NH+]1C)C(C)C ZINC000336714277 386432494 /nfs/dbraw/zinc/43/24/94/386432494.db2.gz QPHPUVCEJWYRBA-KGLIPLIRSA-N 2 0 242.407 2.216 20 0 BEADRP Cc1cc(C[NH2+][C@H]2C[C@H](C)N(C3CC3)C2)ccn1 ZINC000391182044 386468707 /nfs/dbraw/zinc/46/87/07/386468707.db2.gz KPVGHJOBXZBYAF-JSGCOSHPSA-N 2 0 245.370 2.105 20 0 BEADRP CC1(C[N@@H+]2CCC[C@@H]([C@@H]3CC[NH2+]C3)C2)CCC1 ZINC000414775196 386469703 /nfs/dbraw/zinc/46/97/03/386469703.db2.gz GGSQITKINANGRQ-ZIAGYGMSSA-N 2 0 236.403 2.498 20 0 BEADRP CC(C)C[C@@H](C)C[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000414912554 386476440 /nfs/dbraw/zinc/47/64/40/386476440.db2.gz YOPKORGNWQNWAM-CHWSQXEVSA-N 2 0 212.381 2.400 20 0 BEADRP [NH3+]CCCC[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC000414913480 386480355 /nfs/dbraw/zinc/48/03/55/386480355.db2.gz VWOXAOIBEKDUQY-KBPBESRZSA-N 2 0 218.344 2.119 20 0 BEADRP COC[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)C(C)C ZINC000353528615 386480781 /nfs/dbraw/zinc/48/07/81/386480781.db2.gz OBNGTTKHGFRQOL-JXQTWKCFSA-N 2 0 242.407 2.120 20 0 BEADRP CC[NH2+][C@H](C)CN[C@@H](C)CCc1ccco1 ZINC000519538607 386481753 /nfs/dbraw/zinc/48/17/53/386481753.db2.gz JOIIMDOFWHTIOX-NWDGAFQWSA-N 2 0 224.348 2.188 20 0 BEADRP CC(C)(C)[C@@H]1CC[C@H]1[NH2+]C1CC[NH2+]CC1 ZINC000335453498 386528998 /nfs/dbraw/zinc/52/89/98/386528998.db2.gz WCBVSGQJGSXFMG-VXGBXAGGSA-N 2 0 210.365 2.153 20 0 BEADRP Cc1ccccc1C[NH2+]CC1(C)CC[NH2+]CC1 ZINC000414913678 386494580 /nfs/dbraw/zinc/49/45/80/386494580.db2.gz WMWUCUPJIJQWRR-UHFFFAOYSA-N 2 0 232.371 2.474 20 0 BEADRP CC[C@@H](Cc1ccccc1)[NH2+]C1CC[NH2+]CC1 ZINC000414780936 386498580 /nfs/dbraw/zinc/49/85/80/386498580.db2.gz MEQZZQPSRUTPQI-AWEZNQCLSA-N 2 0 232.371 2.349 20 0 BEADRP C[C@@H]([NH3+])[C@@H](C)[NH2+]C[C@@H](C)Cc1ccccc1 ZINC000415014685 386500308 /nfs/dbraw/zinc/50/03/08/386500308.db2.gz MEGADJGJGPQQMX-YNEHKIRRSA-N 2 0 220.360 2.191 20 0 BEADRP C[C@@H]([NH2+]C[C@@H](C)Cc1ccccc1)[C@H](C)[NH3+] ZINC000415014683 386500942 /nfs/dbraw/zinc/50/09/42/386500942.db2.gz MEGADJGJGPQQMX-RWMBFGLXSA-N 2 0 220.360 2.191 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+]C1C[C@H](C)C[C@@H](C)C1 ZINC000414787809 386529646 /nfs/dbraw/zinc/52/96/46/386529646.db2.gz CRIBUPPLDQJFPU-NQBHXWOUSA-N 2 0 212.381 2.384 20 0 BEADRP CC(C)n1cc(C[NH2+][C@H](C)CCCC[NH3+])cn1 ZINC000415016438 386502013 /nfs/dbraw/zinc/50/20/13/386502013.db2.gz POTRKRQHPFFKEZ-GFCCVEGCSA-N 2 0 238.379 2.071 20 0 BEADRP CC(C)[C@H]1C[C@@H]([NH2+][C@H](C)CCCC[NH3+])CCO1 ZINC000415017563 386503626 /nfs/dbraw/zinc/50/36/26/386503626.db2.gz SKHZBWLVSVWEIG-HZSPNIEDSA-N 2 0 242.407 2.297 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C[C@@H]2CC23CC3)[C@H]2CCC[C@H]21 ZINC000417339912 386505685 /nfs/dbraw/zinc/50/56/85/386505685.db2.gz OWXNMWJZTPESMD-RFQIPJPRSA-N 2 0 234.387 2.249 20 0 BEADRP CC(C)(C)C[N@@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1 ZINC000414783751 386507319 /nfs/dbraw/zinc/50/73/19/386507319.db2.gz QMJOFFZZXNFTGM-OLZOCXBDSA-N 2 0 224.392 2.354 20 0 BEADRP [NH3+]C[C@@H]1CC[C@H]([NH2+]Cc2ccccc2F)C1 ZINC000415051269 386508080 /nfs/dbraw/zinc/50/80/80/386508080.db2.gz ZBMPASYBZOVWRS-PWSUYJOCSA-N 2 0 222.307 2.043 20 0 BEADRP CC(C)c1cnc(C[NH2+][C@H](C)CCC[NH3+])s1 ZINC000415019768 386508334 /nfs/dbraw/zinc/50/83/34/386508334.db2.gz ITVHDODGPORRKF-SNVBAGLBSA-N 2 0 241.404 2.484 20 0 BEADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+]Cc2ccccc2F)C1 ZINC000415051271 386508751 /nfs/dbraw/zinc/50/87/51/386508751.db2.gz ZBMPASYBZOVWRS-ZYHUDNBSSA-N 2 0 222.307 2.043 20 0 BEADRP COc1ccc(C)cc1C[NH2+][C@@H](C)CCC[NH3+] ZINC000415026170 386513303 /nfs/dbraw/zinc/51/33/03/386513303.db2.gz SSLFPUJOLUWMMT-LBPRGKRZSA-N 2 0 236.359 2.221 20 0 BEADRP [NH3+]C[C@H]1CC[C@H](C[NH2+][C@@H]2CCCSC2)CC1 ZINC000415028453 386516282 /nfs/dbraw/zinc/51/62/82/386516282.db2.gz YPXREIRRNMLUNL-JHJVBQTASA-N 2 0 242.432 2.237 20 0 BEADRP CCC(C)(C)[C@H](C)[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000519643953 386516597 /nfs/dbraw/zinc/51/65/97/386516597.db2.gz WHVUNHNLEUTACD-RYUDHWBXSA-N 2 0 212.381 2.400 20 0 BEADRP COc1ccc(C)cc1C[NH2+][C@@H]1CC[C@H](C[NH3+])C1 ZINC000415031127 386518492 /nfs/dbraw/zinc/51/84/92/386518492.db2.gz GMHFIIRHLJNYFK-GXTWGEPZSA-N 2 0 248.370 2.221 20 0 BEADRP CC[N@H+](CCn1ccnc1)CC(C)(C)C ZINC000291152091 386519306 /nfs/dbraw/zinc/51/93/06/386519306.db2.gz DVJAGGGOLFJXKT-UHFFFAOYSA-N 2 0 209.337 2.251 20 0 BEADRP CC(C)CCC[C@H](C)[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000415031240 386519704 /nfs/dbraw/zinc/51/97/04/386519704.db2.gz GADSFSNIUIKBCY-WUHRBBMRSA-N 2 0 210.365 2.009 20 0 BEADRP Cc1ccc(F)c(C[NH2+][C@H]2CC[C@@H](C[NH3+])C2)c1 ZINC000415034631 386521222 /nfs/dbraw/zinc/52/12/22/386521222.db2.gz KBTIYJNPUPCJSL-YPMHNXCESA-N 2 0 236.334 2.351 20 0 BEADRP Cc1ccc(F)c(C[NH2+][C@@H]2CC[C@H](C[NH3+])C2)c1 ZINC000415034629 386521241 /nfs/dbraw/zinc/52/12/41/386521241.db2.gz KBTIYJNPUPCJSL-WCQYABFASA-N 2 0 236.334 2.351 20 0 BEADRP CC(C)C[C@H](C)C[NH2+][C@@H]1CC[C@@H](C[NH3+])C1 ZINC000415036007 386524203 /nfs/dbraw/zinc/52/42/03/386524203.db2.gz KZKVUWOTLONRNY-YNEHKIRRSA-N 2 0 212.381 2.386 20 0 BEADRP C([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)C1CCCCC1 ZINC000335451834 386524439 /nfs/dbraw/zinc/52/44/39/386524439.db2.gz WRRJVRWKBVKPNQ-PBWFPOADSA-N 2 0 222.376 2.439 20 0 BEADRP Cc1cccc(C[NH2+][C@@H]2CC[C@H](C[NH3+])C2)c1 ZINC000415038416 386524616 /nfs/dbraw/zinc/52/46/16/386524616.db2.gz NJNGCQZSJSVJMG-GXTWGEPZSA-N 2 0 218.344 2.212 20 0 BEADRP C1CCC2(C1)CCC[C@@H]2[NH2+]C1CC[NH2+]CC1 ZINC000335452731 386526662 /nfs/dbraw/zinc/52/66/62/386526662.db2.gz RKOABOJARSXNJA-ZDUSSCGKSA-N 2 0 222.376 2.441 20 0 BEADRP CCc1ccc(C[N@@H+]2CC[C@@H]([NH3+])[C@H](C)C2)cc1 ZINC000094339166 386457375 /nfs/dbraw/zinc/45/73/75/386457375.db2.gz UHSCNENIZQZPMG-IUODEOHRSA-N 2 0 232.371 2.418 20 0 BEADRP CC[N@H+](CC[C@H]1CCC[NH2+]C1)Cc1ccccn1 ZINC000094916676 386462438 /nfs/dbraw/zinc/46/24/38/386462438.db2.gz XOPUFNPFJZCSHV-CQSZACIVSA-N 2 0 247.386 2.293 20 0 BEADRP Cc1cccc(C)c1CC[NH2+]C[C@]1(C)CC[NH2+]C1 ZINC000415077130 386576495 /nfs/dbraw/zinc/57/64/95/386576495.db2.gz DVYWCCUOBSVJIP-INIZCTEOSA-N 2 0 246.398 2.435 20 0 BEADRP C[C@H](CCC1CC1)[NH2+][C@H]1CN(C)C[C@H]1C ZINC000336757238 386580217 /nfs/dbraw/zinc/58/02/17/386580217.db2.gz JXWBVYOOCDMXKP-WZRBSPASSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@@H]1C[C@H](C[NH2+]CCc2cccs2)CC[NH2+]1 ZINC000415080002 386582636 /nfs/dbraw/zinc/58/26/36/386582636.db2.gz IZBBLDOJDQHLSG-VXGBXAGGSA-N 2 0 238.400 2.268 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)CCCC[NH3+])c1ccccn1 ZINC000336644142 386586065 /nfs/dbraw/zinc/58/60/65/386586065.db2.gz BUURXPOQQGXHLM-NWDGAFQWSA-N 2 0 221.348 2.250 20 0 BEADRP C[C@@H]1C[C@H](C[NH2+]CCc2ccccc2)CC[NH2+]1 ZINC000415078740 386589122 /nfs/dbraw/zinc/58/91/22/386589122.db2.gz GWHAWWBSUBFZCM-UKRRQHHQSA-N 2 0 232.371 2.207 20 0 BEADRP c1c2ccccc2oc1CC[NH2+]C1CC[NH2+]CC1 ZINC000415082650 386594972 /nfs/dbraw/zinc/59/49/72/386594972.db2.gz DMGMMIUDRIXMHK-UHFFFAOYSA-N 2 0 244.338 2.317 20 0 BEADRP C[C@@H](CCc1ccsc1)[NH2+][C@@H](CN)C1CC1 ZINC000414803033 386596541 /nfs/dbraw/zinc/59/65/41/386596541.db2.gz IYSOZUZHGRPCHC-GWCFXTLKSA-N 2 0 238.400 2.396 20 0 BEADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@H]2CCC[C@H]2C2CC2)C1 ZINC000415046371 386531429 /nfs/dbraw/zinc/53/14/29/386531429.db2.gz VCNCHVZLOGMRCL-SAXRGWBVSA-N 2 0 222.376 2.282 20 0 BEADRP CCc1cccc(C[NH2+]CCC[NH+](C)C)c1 ZINC000519701733 386536033 /nfs/dbraw/zinc/53/60/33/386536033.db2.gz GCFKXWMGVGNRJK-UHFFFAOYSA-N 2 0 220.360 2.290 20 0 BEADRP C[C@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)C1CCC1 ZINC000414918539 386546135 /nfs/dbraw/zinc/54/61/35/386546135.db2.gz UTTMZOABGIYFFC-AAEUAGOBSA-N 2 0 210.365 2.154 20 0 BEADRP CC(C)C[C@@H](C)C[NH2+][C@H]1CCCC[NH2+]C1 ZINC000415069132 386551521 /nfs/dbraw/zinc/55/15/21/386551521.db2.gz GCNWHMOJKUQPEZ-OLZOCXBDSA-N 2 0 212.381 2.400 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCCC[C@@H]1[C@H]1CC[NH2+]C1 ZINC000415053105 386554123 /nfs/dbraw/zinc/55/41/23/386554123.db2.gz NZOOVTCGKDKULK-MELADBBJSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)[N@@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000647974876 386555081 /nfs/dbraw/zinc/55/50/81/386555081.db2.gz AEWLAVCMRPSYAD-CHWSQXEVSA-N 2 0 210.365 2.106 20 0 BEADRP Cc1cc(C[NH2+][C@H]2CCC[C@@H]2C[NH3+])ccc1F ZINC000414794276 386558354 /nfs/dbraw/zinc/55/83/54/386558354.db2.gz LQNQHSNKWTVVHE-OCCSQVGLSA-N 2 0 236.334 2.351 20 0 BEADRP Fc1cccc(C2([NH2+]C[C@H]3CC[NH2+]C3)CCC2)c1 ZINC000647996273 386571828 /nfs/dbraw/zinc/57/18/28/386571828.db2.gz HCTZJFXGDQBMSJ-LBPRGKRZSA-N 2 0 248.345 2.404 20 0 BEADRP C[C@H](C[NH2+]CC(C)(C)[NH3+])Cc1ccccc1 ZINC000414809600 386620163 /nfs/dbraw/zinc/62/01/63/386620163.db2.gz VSHBQPCETXJMLS-LBPRGKRZSA-N 2 0 220.360 2.192 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCCC[C@H]1C1CCC1 ZINC000647997633 386621026 /nfs/dbraw/zinc/62/10/26/386621026.db2.gz UMUFGRWKVZQIHT-ZDUSSCGKSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@H](CCc1ccccc1F)[NH2+]CC(C)(C)[NH3+] ZINC000414809635 386621393 /nfs/dbraw/zinc/62/13/93/386621393.db2.gz VVYUZBVRAUWJEO-LLVKDONJSA-N 2 0 238.350 2.474 20 0 BEADRP CCOc1ccccc1C[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000414924390 386622937 /nfs/dbraw/zinc/62/29/37/386622937.db2.gz KBYJASYTZZQJRS-ZIAGYGMSSA-N 2 0 248.370 2.445 20 0 BEADRP Cc1cc(C(F)(F)F)ccc1CN(C)CC[NH3+] ZINC000415101399 386624279 /nfs/dbraw/zinc/62/42/79/386624279.db2.gz BTQPXWKTLGDZII-UHFFFAOYSA-N 2 0 246.276 2.404 20 0 BEADRP CC(C)C[C@H]([NH3+])C[NH2+][C@]1(C)CC=CCC1 ZINC000415105865 386629003 /nfs/dbraw/zinc/62/90/03/386629003.db2.gz GRIURAGCTPKKIZ-QWHCGFSZSA-N 2 0 210.365 2.448 20 0 BEADRP CCc1ccc(CC[N@@H+]2C[C@@H](C[NH3+])C[C@@H]2C)cc1 ZINC000442759905 386630624 /nfs/dbraw/zinc/63/06/24/386630624.db2.gz SPXRBCGITHWYBN-XJKSGUPXSA-N 2 0 246.398 2.461 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CC2=CC[NH2+]CC2)C[C@@H](C)C1 ZINC000335501361 386630813 /nfs/dbraw/zinc/63/08/13/386630813.db2.gz RYULCHLDJJEOGJ-IMRBUKKESA-N 2 0 222.376 2.320 20 0 BEADRP CCc1ccc(CC[N@@H+]2C[C@H](C[NH3+])C[C@@H]2C)cc1 ZINC000442759900 386631167 /nfs/dbraw/zinc/63/11/67/386631167.db2.gz SPXRBCGITHWYBN-BBRMVZONSA-N 2 0 246.398 2.461 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CC[NH2+][C@H](C)C1)c1cccc(O)c1 ZINC000415120490 386631831 /nfs/dbraw/zinc/63/18/31/386631831.db2.gz YGYLBVNMOIPSAQ-JHJVBQTASA-N 2 0 248.370 2.431 20 0 BEADRP C[C@H]([NH3+])c1ccc(NC[C@H]2CCC[NH2+]C2)cc1 ZINC000414813272 386643352 /nfs/dbraw/zinc/64/33/52/386643352.db2.gz QOYMVGFDBNHJPH-RYUDHWBXSA-N 2 0 233.359 2.118 20 0 BEADRP C[N@H+](Cc1ccccc1)CC(C)(C)C[NH3+] ZINC000049813625 386656106 /nfs/dbraw/zinc/65/61/06/386656106.db2.gz PCFWAVKWNWBGNT-UHFFFAOYSA-N 2 0 206.333 2.103 20 0 BEADRP Cc1csc(C[NH2+]C2CCC(C[NH3+])CC2)n1 ZINC000415085094 386600920 /nfs/dbraw/zinc/60/09/20/386600920.db2.gz QFTBEWJABZKHSZ-UHFFFAOYSA-N 2 0 239.388 2.059 20 0 BEADRP C[C@H](C[NH2+][C@H]1CNCC[C@H]1C)Cc1ccccc1 ZINC000414922965 386602403 /nfs/dbraw/zinc/60/24/03/386602403.db2.gz GPHDQXSXADLLOA-LZWOXQAQSA-N 2 0 246.398 2.453 20 0 BEADRP C[C@H](CCc1ccc(F)cc1)[NH2+]CC(C)(C)[NH3+] ZINC000414804124 386605558 /nfs/dbraw/zinc/60/55/58/386605558.db2.gz MVZHGVCANCODDI-LLVKDONJSA-N 2 0 238.350 2.474 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+][C@H](C)CCC(F)(F)F ZINC000414803855 386605953 /nfs/dbraw/zinc/60/59/53/386605953.db2.gz WYAKXFVDUZSYTR-BDAKNGLRSA-N 2 0 226.286 2.290 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@H]1CCC[C@@H](F)C1 ZINC000520231102 386609971 /nfs/dbraw/zinc/60/99/71/386609971.db2.gz ADVSZCFDVAKCTP-UTUOFQBUSA-N 2 0 216.344 2.374 20 0 BEADRP CC[C@H]([NH2+][C@H](C)C[C@H]1CCC[NH2+]1)[C@@H]1CCCO1 ZINC000415090105 386610421 /nfs/dbraw/zinc/61/04/21/386610421.db2.gz ZYCYCQWUYYYGEV-MQYQWHSLSA-N 2 0 240.391 2.064 20 0 BEADRP CC(C)([NH3+])C[NH2+]CCc1ccccc1Cl ZINC000415093811 386612527 /nfs/dbraw/zinc/61/25/27/386612527.db2.gz WCNIGQZXRUJJRE-UHFFFAOYSA-N 2 0 226.751 2.209 20 0 BEADRP Cc1ccccc1CC[NH2+]C[C@@]1(C)CC[NH2+]C1 ZINC000415093495 386613137 /nfs/dbraw/zinc/61/31/37/386613137.db2.gz VKHDADZOIUETQW-OAHLLOKOSA-N 2 0 232.371 2.127 20 0 BEADRP C[C@H]([NH2+][C@H]1CCCC[NH2+]C1)C1CCSCC1 ZINC000335493671 386613539 /nfs/dbraw/zinc/61/35/39/386613539.db2.gz CCVAPOQULHFZFQ-AAEUAGOBSA-N 2 0 242.432 2.250 20 0 BEADRP C([NH2+][C@@H]1CCC[C@H](C2CC2)C1)[C@@H]1CCC[NH2+]1 ZINC000414820062 386663382 /nfs/dbraw/zinc/66/33/82/386663382.db2.gz ACQVPDXUPYJIQA-MJBXVCDLSA-N 2 0 222.376 2.297 20 0 BEADRP CN(CCC[NH+]1CCCC1)CCc1cccnc1 ZINC000337222391 386663506 /nfs/dbraw/zinc/66/35/06/386663506.db2.gz LXQMDGGADDBODA-UHFFFAOYSA-N 2 0 247.386 2.042 20 0 BEADRP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[NH2+]C1)C1CCC1 ZINC000414818686 386667054 /nfs/dbraw/zinc/66/70/54/386667054.db2.gz FSVRVCVXZUMXTC-GVXVVHGQSA-N 2 0 210.365 2.153 20 0 BEADRP Cc1cc2cc(CN[C@H](C)C[NH3+])oc2cc1C ZINC000414926618 386676890 /nfs/dbraw/zinc/67/68/90/386676890.db2.gz KBKSZXWWFMXSEC-LLVKDONJSA-N 2 0 232.327 2.486 20 0 BEADRP C[C@H]([NH2+]CCC(C)(C)C)[C@@H]1CCC[NH2+]C1 ZINC000414824026 386680072 /nfs/dbraw/zinc/68/00/72/386680072.db2.gz PWWKNZCHHMMNDI-NWDGAFQWSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H](Cc1ccc(F)cc1)[NH2+]CC[C@H](C)[NH3+] ZINC000414823769 386680703 /nfs/dbraw/zinc/68/07/03/386680703.db2.gz PIYBNEBDNUFYNG-WDEREUQCSA-N 2 0 224.323 2.084 20 0 BEADRP C[C@@H](C[NH2+]C[C@@H]1CCC[NH2+]C1)Cc1ccccc1 ZINC000414831006 386710535 /nfs/dbraw/zinc/71/05/35/386710535.db2.gz PBRBLCAFMCIHOU-GDBMZVCRSA-N 2 0 246.398 2.454 20 0 BEADRP CC1(C)CCC[C@@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000414824461 386683378 /nfs/dbraw/zinc/68/33/78/386683378.db2.gz FXNJVWGQQHCJTC-HNGCFSAESA-N 2 0 222.376 2.438 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H]1CCC[C@H](C2CC2)C1 ZINC000414825141 386687201 /nfs/dbraw/zinc/68/72/01/386687201.db2.gz SANZXOQVZJTACX-WCFLWFBJSA-N 2 0 210.365 2.282 20 0 BEADRP C(=C/c1ccccc1)\C[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000414825507 386691271 /nfs/dbraw/zinc/69/12/71/386691271.db2.gz CJPMFIXXHPKSQQ-SZTZYQKNSA-N 2 0 230.355 2.289 20 0 BEADRP Cc1ccc(F)cc1C[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000414827160 386691366 /nfs/dbraw/zinc/69/13/66/386691366.db2.gz GSWMLTYQABSUEY-GFCCVEGCSA-N 2 0 236.334 2.223 20 0 BEADRP CCNCC[NH2+][C@H]1C[C@@H](C)CC(C)(C)C1 ZINC000414830237 386705429 /nfs/dbraw/zinc/70/54/29/386705429.db2.gz NRTAWVNNNDKWJP-NEPJUHHUSA-N 2 0 212.381 2.400 20 0 BEADRP CCC[C@@H]([NH2+]C1CC[NH2+]CC1)C1CCC1 ZINC000324969434 386706260 /nfs/dbraw/zinc/70/62/60/386706260.db2.gz ZTDUWDYIFABEKO-CYBMUJFWSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H](C[NH2+]CC[C@H]1CC[NH2+]C1)c1ccccc1 ZINC000414830392 386706551 /nfs/dbraw/zinc/70/65/51/386706551.db2.gz LYZMTDYEPLMDKF-KGLIPLIRSA-N 2 0 232.371 2.379 20 0 BEADRP Clc1csc(C[NH2+]CC[C@@H]2CC[NH2+]C2)c1 ZINC000414829992 386707986 /nfs/dbraw/zinc/70/79/86/386707986.db2.gz LKXFENHUGYMUPF-VIFPVBQESA-N 2 0 244.791 2.491 20 0 BEADRP COc1cc(C[NH2+]CC[C@@H]2CC[NH2+]C2)ccc1C ZINC000414833064 386708684 /nfs/dbraw/zinc/70/86/84/386708684.db2.gz PAULDGCWPZEVAY-ZDUSSCGKSA-N 2 0 248.370 2.093 20 0 BEADRP C[C@H]1CCCC[C@@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000414838731 386739901 /nfs/dbraw/zinc/73/99/01/386739901.db2.gz XGOJVADCHMWIPU-MWWBDVBNSA-N 2 0 222.376 2.438 20 0 BEADRP CCOc1cccc(C[NH2+]CC[C@@H]2CC[NH2+]C2)c1 ZINC000414831679 386714427 /nfs/dbraw/zinc/71/44/27/386714427.db2.gz NKVLTLGSXSFKTQ-ZDUSSCGKSA-N 2 0 248.370 2.175 20 0 BEADRP Cc1nccn1CC[N@H+]1CC[C@@H](C)[C@H](C)C1 ZINC000335485509 386715159 /nfs/dbraw/zinc/71/51/59/386715159.db2.gz FPFUPLRVDIMAPC-VXGBXAGGSA-N 2 0 221.348 2.169 20 0 BEADRP CC(C)(C)C[NH+]1CCC([C@@H]2CC[NH2+]C2)CC1 ZINC000357084333 386715805 /nfs/dbraw/zinc/71/58/05/386715805.db2.gz PRBLNOCXACLWQP-CYBMUJFWSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@H]1C[C@H]([NH2+]C2CCC3(CC3)CC2)CC[NH2+]1 ZINC000335540280 386719037 /nfs/dbraw/zinc/71/90/37/386719037.db2.gz ZZWWUXWHZMFRNT-WCQYABFASA-N 2 0 222.376 2.439 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H]1CCCC[C@@H]1C1CC1 ZINC000414834872 386725054 /nfs/dbraw/zinc/72/50/54/386725054.db2.gz HZKGPGVNBXCIHG-YUTCNCBUSA-N 2 0 224.392 2.400 20 0 BEADRP CC[C@H]1CC[N@@H+]1Cc1cccc2nccn21 ZINC000292771825 386725351 /nfs/dbraw/zinc/72/53/51/386725351.db2.gz KMAVAQAUVZNEFN-NSHDSACASA-N 2 0 215.300 2.319 20 0 BEADRP C[NH+](C)CCSCC[C@H]1CCCC[N@@H+]1C ZINC000340697112 386727035 /nfs/dbraw/zinc/72/70/35/386727035.db2.gz OTAUOFYIQCEWPK-GFCCVEGCSA-N 2 0 230.421 2.156 20 0 BEADRP Cc1cc(C[N@@H+]2CCC[C@H](C[NH3+])C2)ccc1F ZINC000050559344 386728918 /nfs/dbraw/zinc/72/89/18/386728918.db2.gz HTESUXGYBPBIAS-CYBMUJFWSA-N 2 0 236.334 2.305 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H](C)CCC(F)(F)F ZINC000414839741 386746180 /nfs/dbraw/zinc/74/61/80/386746180.db2.gz MOWRJAMVIJLKOF-RKDXNWHRSA-N 2 0 226.286 2.163 20 0 BEADRP COC1(CC[NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)CCC1 ZINC000336663984 386752929 /nfs/dbraw/zinc/75/29/29/386752929.db2.gz WSABQULOYXKJDD-OLZOCXBDSA-N 2 0 240.391 2.018 20 0 BEADRP COC[C@@H](CC(C)C)[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000414841448 386753876 /nfs/dbraw/zinc/75/38/76/386753876.db2.gz OIHZDIYRIJTBBL-UONOGXRCSA-N 2 0 242.407 2.027 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)C1CCC1 ZINC000414842621 386762558 /nfs/dbraw/zinc/76/25/58/386762558.db2.gz PFRIMCCHLWDATN-NEPJUHHUSA-N 2 0 210.365 2.154 20 0 BEADRP [NH3+]C[C@@H]1CCC[N@@H+]([C@@H]2CCc3ccc(F)cc32)C1 ZINC000334143458 386742361 /nfs/dbraw/zinc/74/23/61/386742361.db2.gz RPLZIDFDKHDAFR-XHDPSFHLSA-N 2 0 248.345 2.484 20 0 BEADRP COc1cc(C[NH2+]C[C@@H]2CCC[NH2+]C2)ccc1C ZINC000414846266 386816583 /nfs/dbraw/zinc/81/65/83/386816583.db2.gz DVLKGKGVQLGGBL-CQSZACIVSA-N 2 0 248.370 2.093 20 0 BEADRP C[C@@H](C[NH2+][C@H]1CCc2ccccc21)C[NH+](C)C ZINC000293303839 386811357 /nfs/dbraw/zinc/81/13/57/386811357.db2.gz DURDTMUZBCXRBN-WFASDCNBSA-N 2 0 232.371 2.461 20 0 BEADRP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+][C@H]2COC(C)(C)C2)C1 ZINC000417959256 386824548 /nfs/dbraw/zinc/82/45/48/386824548.db2.gz LPGYIAOLQDSPCB-JHJVBQTASA-N 2 0 240.391 2.016 20 0 BEADRP CC[C@@H](Cc1ccccc1)[NH2+]C[C@H](C)C[NH2+]C ZINC000414847149 386833033 /nfs/dbraw/zinc/83/30/33/386833033.db2.gz VIMOMEFUEMFBAE-HIFRSBDPSA-N 2 0 234.387 2.453 20 0 BEADRP C[C@H](CCCCO)[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000398538508 386837113 /nfs/dbraw/zinc/83/71/13/386837113.db2.gz UBZKTNSUIGXBNT-BYCMXARLSA-N 2 0 248.370 2.272 20 0 BEADRP C[C@@H]1Cc2ccccc2C[N@@H+]1CC[C@@H]1CC[NH2+]C1 ZINC000334784450 386842089 /nfs/dbraw/zinc/84/20/89/386842089.db2.gz MDDJVTCGPAZOEP-KGLIPLIRSA-N 2 0 244.382 2.433 20 0 BEADRP CCOc1ccc(C[NH2+]C2(C)CC[NH2+]CC2)cc1 ZINC000414938291 386848552 /nfs/dbraw/zinc/84/85/52/386848552.db2.gz IHMFVQVMKWDVJB-UHFFFAOYSA-N 2 0 248.370 2.317 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]Cc1ccc(F)cc1F ZINC000336674517 386852952 /nfs/dbraw/zinc/85/29/52/386852952.db2.gz UUQBKHNOHMVAHH-SECBINFHSA-N 2 0 228.286 2.182 20 0 BEADRP CCOC[C@H](C)[NH2+]CC(C)(C)C[NH+]1CCCC1 ZINC000357847511 386854510 /nfs/dbraw/zinc/85/45/10/386854510.db2.gz JGHAFTKPPDQHQY-ZDUSSCGKSA-N 2 0 242.407 2.123 20 0 BEADRP Cc1c[nH+]ccc1N1CC[C@H]([NH+]2CCCCC2)C1 ZINC000335749658 386875178 /nfs/dbraw/zinc/87/51/78/386875178.db2.gz FPEFIEJAELCBAQ-AWEZNQCLSA-N 2 0 245.370 2.455 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C/C=C/c2ccccc2)CC[NH2+]1 ZINC000414942461 386890474 /nfs/dbraw/zinc/89/04/74/386890474.db2.gz DNAQQCYVDJKOBX-JGOVJGDKSA-N 2 0 230.355 2.430 20 0 BEADRP Cc1ccc(F)cc1C[NH2+][C@@H]1CC[NH2+]C[C@@H]1C ZINC000334859681 386913698 /nfs/dbraw/zinc/91/36/98/386913698.db2.gz ZXHQTXOXTWHVNW-SMDDNHRTSA-N 2 0 236.334 2.222 20 0 BEADRP CC1(C[NH2+]C2Cc3ccccc3C2)CC[NH2+]CC1 ZINC000334861375 386915568 /nfs/dbraw/zinc/91/55/68/386915568.db2.gz CNXWTDMZISXYFT-UHFFFAOYSA-N 2 0 244.382 2.133 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CCC(C)(C)C2)CC[NH2+]1 ZINC000414941966 386897632 /nfs/dbraw/zinc/89/76/32/386897632.db2.gz DCTDMQHBUYGENN-UTUOFQBUSA-N 2 0 210.365 2.295 20 0 BEADRP Fc1cc(CN[C@H]2CCC[NH2+]C2)ccc1Cl ZINC000334850882 386901029 /nfs/dbraw/zinc/90/10/29/386901029.db2.gz XRYBFKMNPFDIEK-JTQLQIEISA-N 2 0 242.725 2.321 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CC[NH2+][C@@H](C)C2)cc1 ZINC000334864393 386919668 /nfs/dbraw/zinc/91/96/68/386919668.db2.gz PHOJWWZRJUXBTK-JSGCOSHPSA-N 2 0 218.344 2.225 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CC[NH2+]C[C@@H]2C)c(C)c1 ZINC000334853617 386904059 /nfs/dbraw/zinc/90/40/59/386904059.db2.gz FAKOIAUYVCNPIO-ZFWWWQNUSA-N 2 0 232.371 2.391 20 0 BEADRP C[C@@]1(C[NH2+][C@H]2CCc3ccccc32)CC[NH2+]C1 ZINC000334865169 386922048 /nfs/dbraw/zinc/92/20/48/386922048.db2.gz RALDCXZVLJRHPB-LSDHHAIUSA-N 2 0 230.355 2.263 20 0 BEADRP C[C@@H]1Cc2ccccc2[C@H]1[NH2+]C1CC[NH2+]CC1 ZINC000334866408 386924747 /nfs/dbraw/zinc/92/47/47/386924747.db2.gz QDNRLGBWNBHYDY-ABAIWWIYSA-N 2 0 230.355 2.262 20 0 BEADRP CC(C)C[N@@H+]1CCCC[C@@H]1[C@H]1CC[NH2+]C1 ZINC000334867369 386926648 /nfs/dbraw/zinc/92/66/48/386926648.db2.gz CVXUKJKHQOJTEK-QWHCGFSZSA-N 2 0 210.365 2.106 20 0 BEADRP c1cc(C[N@@H+]2CCCC[C@@H]2[C@@H]2CC[NH2+]C2)ccn1 ZINC000334868523 386926922 /nfs/dbraw/zinc/92/69/22/386926922.db2.gz LKQYYGFUGQJFSM-HUUCEWRRSA-N 2 0 245.370 2.046 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)C1CC1 ZINC000093977909 386927249 /nfs/dbraw/zinc/92/72/49/386927249.db2.gz WFDMGXKNUNUYAG-KGYLQXTDSA-N 2 0 208.349 2.001 20 0 BEADRP CC(C)(C)C[C@H](O)C[NH2+][C@@H]1CCCCC[C@@H]1[NH3+] ZINC000332018336 386941893 /nfs/dbraw/zinc/94/18/93/386941893.db2.gz QNTCPCDHUQXRPN-RWMBFGLXSA-N 2 0 242.407 2.033 20 0 BEADRP C[C@@H]1CCC[C@H]1[NH2+]CC1([NH3+])CCCCC1 ZINC000334816909 386942765 /nfs/dbraw/zinc/94/27/65/386942765.db2.gz CZIATLSZKGAXGS-VXGBXAGGSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@H]1CC[C@]2(CC[N@H+](CCn3ccnc3)C2)C1 ZINC000334890099 386962884 /nfs/dbraw/zinc/96/28/84/386962884.db2.gz MSJUVDAKKWLQKF-KBPBESRZSA-N 2 0 233.359 2.395 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H]1CC[C@@H]1SC ZINC000425356534 386968787 /nfs/dbraw/zinc/96/87/87/386968787.db2.gz PLZLLVFKSYPWGO-NEPJUHHUSA-N 2 0 230.421 2.202 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H]1CC[C@H]1SC ZINC000425356535 386969013 /nfs/dbraw/zinc/96/90/13/386969013.db2.gz PLZLLVFKSYPWGO-NWDGAFQWSA-N 2 0 230.421 2.202 20 0 BEADRP Cc1ccc(CN[C@H]2CC[N@@H+](C)C[C@@H]2C)nc1C ZINC000314760272 386998717 /nfs/dbraw/zinc/99/87/17/386998717.db2.gz KASJLUQPKGJINY-WFASDCNBSA-N 2 0 247.386 2.128 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CC2(C)CC[NH2+]CC2)[C@@H]1C ZINC000395157271 386948999 /nfs/dbraw/zinc/94/89/99/386948999.db2.gz LNXPRNGOFLWPRB-IJLUTSLNSA-N 2 0 210.365 2.010 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]C1CCC2(CC2)CC1 ZINC000335011989 387030228 /nfs/dbraw/zinc/03/02/28/387030228.db2.gz WPKUSXZDRQDFQS-VXGBXAGGSA-N 2 0 208.349 2.179 20 0 BEADRP Cc1c[nH+]ccc1NCC1(C)CC[NH2+]CC1 ZINC000160012601 387040742 /nfs/dbraw/zinc/04/07/42/387040742.db2.gz RLSFYQXRCKJRJG-UHFFFAOYSA-N 2 0 219.332 2.192 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CC2CC(F)(F)C2)[C@@H](C)C1 ZINC000425957006 387046927 /nfs/dbraw/zinc/04/69/27/387046927.db2.gz ZNQKZYYBVOWSPW-CMPLNLGQSA-N 2 0 246.345 2.352 20 0 BEADRP C[C@H]1CCCC[N@H+](CC[C@H]2CC[NH2+]C2)C1 ZINC000334966025 387047034 /nfs/dbraw/zinc/04/70/34/387047034.db2.gz DNPNFIITOIVFAB-QWHCGFSZSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@H]([NH3+])CN1Cc2ccccc2C(C)(C)C1 ZINC000334967723 387051612 /nfs/dbraw/zinc/05/16/12/387051612.db2.gz JLJBEWWXNNHTAT-NSHDSACASA-N 2 0 218.344 2.127 20 0 BEADRP C[NH+](C)CCC[NH2+][C@H]1CC[C@@H]1C1CCC1 ZINC000336764769 387054701 /nfs/dbraw/zinc/05/47/01/387054701.db2.gz QIUZMAJKHBLCCC-OLZOCXBDSA-N 2 0 210.365 2.106 20 0 BEADRP CN(CC[NH3+])[C@H]1CCCc2ccc(F)cc21 ZINC000334971579 387057046 /nfs/dbraw/zinc/05/70/46/387057046.db2.gz JTBGKXIVGCQVBG-ZDUSSCGKSA-N 2 0 222.307 2.094 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CCc1c[nH]c2ccccc12 ZINC000336788643 387061963 /nfs/dbraw/zinc/06/19/63/387061963.db2.gz HKJNVPHNZRSVRU-GFCCVEGCSA-N 2 0 245.370 2.427 20 0 BEADRP C(C[NH+]1C[C@H]2CCC[C@@H]2C1)C1CC[NH2+]CC1 ZINC000126264895 387013009 /nfs/dbraw/zinc/01/30/09/387013009.db2.gz TVXBEYFWKNUNMU-ZIAGYGMSSA-N 2 0 222.376 2.108 20 0 BEADRP Fc1cccc(CNC2C[C@H]3CC[C@@H](C2)[NH2+]3)c1 ZINC000334883209 387025449 /nfs/dbraw/zinc/02/54/49/387025449.db2.gz RFUNUSASZIGBPB-PBWFPOADSA-N 2 0 234.318 2.198 20 0 BEADRP Cc1ccsc1C[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000334882556 387025655 /nfs/dbraw/zinc/02/56/55/387025655.db2.gz OWECWIZBISRELZ-FOSCPWQOSA-N 2 0 236.384 2.429 20 0 BEADRP CCOc1ccccc1C[N@@H+]1CC[C@H]([C@@H](C)[NH3+])C1 ZINC000126903235 387072332 /nfs/dbraw/zinc/07/23/32/387072332.db2.gz LSZQQGXAFGYWEW-OLZOCXBDSA-N 2 0 248.370 2.254 20 0 BEADRP CCOc1ccc(C[N@@H+]2CC[C@@H]([C@@H](C)[NH3+])C2)cc1 ZINC000126904083 387072631 /nfs/dbraw/zinc/07/26/31/387072631.db2.gz BAXMBCKYOZUBNV-TZMCWYRMSA-N 2 0 248.370 2.254 20 0 BEADRP CC(C)[C@H]([NH2+]C[C@H](C)C[NH3+])c1ccc(F)cn1 ZINC000423298507 387130446 /nfs/dbraw/zinc/13/04/46/387130446.db2.gz AIDAJWIXMHIIOQ-MFKMUULPSA-N 2 0 239.338 2.102 20 0 BEADRP [NH3+]CC[C@@H]1CCCC[N@@H+]1CCOc1ccccc1 ZINC000111380561 387077870 /nfs/dbraw/zinc/07/78/70/387077870.db2.gz CGQYQFVSXUHDCN-AWEZNQCLSA-N 2 0 248.370 2.269 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CC2(C3CC3)CC2)[C@@H](C)C1 ZINC000246359317 387078174 /nfs/dbraw/zinc/07/81/74/387078174.db2.gz IIZYEYHLZSPTOD-GXTWGEPZSA-N 2 0 236.403 2.497 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CC2(C3CC3)CC2)[C@@H](C)C1 ZINC000246359332 387078280 /nfs/dbraw/zinc/07/82/80/387078280.db2.gz IIZYEYHLZSPTOD-JSGCOSHPSA-N 2 0 236.403 2.497 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]2C[N@H+](Cc3cccc(F)c3)C[C@H]21 ZINC000228476409 387088082 /nfs/dbraw/zinc/08/80/82/387088082.db2.gz WBTDBTBXAMNBMC-NWANDNLSSA-N 2 0 248.345 2.385 20 0 BEADRP [NH3+]C[C@H]1CC[N@@H+]([C@H]2CCCc3ccc(F)cc32)C1 ZINC000334998252 387090565 /nfs/dbraw/zinc/09/05/65/387090565.db2.gz MXVCDUAJPSKNBP-ABAIWWIYSA-N 2 0 248.345 2.484 20 0 BEADRP C[N@H+](Cc1cccc(F)c1)[C@@H]1CCC[NH2+]CC1 ZINC000111824526 387092550 /nfs/dbraw/zinc/09/25/50/387092550.db2.gz KPBPQPUYVNFRFZ-CQSZACIVSA-N 2 0 236.334 2.400 20 0 BEADRP Cc1ccc(C[N@H+]2CCC[C@@H]([C@H](C)[NH3+])C2)c(C)n1 ZINC000334998957 387092759 /nfs/dbraw/zinc/09/27/59/387092759.db2.gz XFYXEXVXOMYSJJ-GXTWGEPZSA-N 2 0 247.386 2.258 20 0 BEADRP CCc1ccc(C[N@@H+]2CC[C@@H](C[NH2+]C)C2)cc1 ZINC000071142127 387094797 /nfs/dbraw/zinc/09/47/97/387094797.db2.gz FHWKHJVKNKIZQE-HNNXBMFYSA-N 2 0 232.371 2.290 20 0 BEADRP CC(C)(C)C1CC([NH2+][C@@H]2CCC[C@@H]2[NH3+])C1 ZINC000335004775 387099763 /nfs/dbraw/zinc/09/97/63/387099763.db2.gz FPNMHTLLUQQXLE-MMVSWEMESA-N 2 0 210.365 2.281 20 0 BEADRP CCC(CC)C[N@@H+]1C[C@@H]2CCC[C@@H]([NH3+])[C@@H]2C1 ZINC000228533420 387102203 /nfs/dbraw/zinc/10/22/03/387102203.db2.gz CXNWCHNUDGIZSF-BFHYXJOUSA-N 2 0 224.392 2.482 20 0 BEADRP CCC[C@H](C)C[N@@H+]1C[C@@H]2CCC[C@@H]([NH3+])[C@@H]2C1 ZINC000228535063 387102262 /nfs/dbraw/zinc/10/22/62/387102262.db2.gz GIJVFFVYVVHYIS-IGQOVBAYSA-N 2 0 224.392 2.482 20 0 BEADRP CO[C@H]1CC[C@H]([NH2+]C2CC[NH+](C(C)C)CC2)C1 ZINC000188799365 387104597 /nfs/dbraw/zinc/10/45/97/387104597.db2.gz XYWUTYSOLVQBGF-KBPBESRZSA-N 2 0 240.391 2.016 20 0 BEADRP CCc1ccccc1C[N@@H+]1C[C@H](C[NH3+])C[C@H]1C ZINC000250262664 387112869 /nfs/dbraw/zinc/11/28/69/387112869.db2.gz DVDAHRXMHABHPY-OLZOCXBDSA-N 2 0 232.371 2.418 20 0 BEADRP Cc1cccc(C[NH2+][C@@H]2CC[NH2+]CC[C@@H]2C)c1 ZINC000335025418 387115880 /nfs/dbraw/zinc/11/58/80/387115880.db2.gz RREWFJMJOPTARB-DZGCQCFKSA-N 2 0 232.371 2.473 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]CC12CCC(CC1)C2 ZINC000335024960 387116112 /nfs/dbraw/zinc/11/61/12/387116112.db2.gz RAGZAGWQWXGWKD-QBHFIFKDSA-N 2 0 208.349 2.036 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+]Cc1ccccc1 ZINC000335024911 387116741 /nfs/dbraw/zinc/11/67/41/387116741.db2.gz PMGFEVZELPQVIY-GXTWGEPZSA-N 2 0 218.344 2.164 20 0 BEADRP [NH3+]C1(C[NH2+]C2CCc3ccccc3CC2)CCC1 ZINC000335026140 387119066 /nfs/dbraw/zinc/11/90/66/387119066.db2.gz XPSQSQDPKRCRGX-UHFFFAOYSA-N 2 0 244.382 2.405 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]1[NH2+]C1CCC(F)(F)CC1 ZINC000335028049 387120035 /nfs/dbraw/zinc/12/00/35/387120035.db2.gz VUGFMIXHXYJRNF-UWVGGRQHSA-N 2 0 218.291 2.034 20 0 BEADRP Cc1ccc([C@@H]2CCC[C@@H]2[NH2+]CC2C[NH2+]C2)cc1 ZINC000423298759 387130075 /nfs/dbraw/zinc/13/00/75/387130075.db2.gz AFYDAFMHLXTROT-HOTGVXAUSA-N 2 0 244.382 2.440 20 0 BEADRP CO[C@H](C)C[N@H+](CCC1CC[NH2+]CC1)C(C)C ZINC000359215339 387068026 /nfs/dbraw/zinc/06/80/26/387068026.db2.gz JUCUZWSLWZKRBT-CYBMUJFWSA-N 2 0 242.407 2.121 20 0 BEADRP Fc1ccc2c(c1)CCC[C@@H]2[NH2+]CC1C[NH2+]C1 ZINC000423306156 387141451 /nfs/dbraw/zinc/14/14/51/387141451.db2.gz SFHYDQUPMHUPNH-AWEZNQCLSA-N 2 0 234.318 2.012 20 0 BEADRP CC(C)CC[C@@H]([NH2+]C[C@H](C)C[NH3+])C1CC1 ZINC000423306062 387141459 /nfs/dbraw/zinc/14/14/59/387141459.db2.gz LDAFPLXTWKVSNE-DGCLKSJQSA-N 2 0 212.381 2.386 20 0 BEADRP CC[C@H]([NH2+]C[C@@H](C)C[NH3+])c1cccc(F)c1 ZINC000423305633 387141974 /nfs/dbraw/zinc/14/19/74/387141974.db2.gz KUDYPFCZMFNYRK-GWCFXTLKSA-N 2 0 224.323 2.461 20 0 BEADRP CC[C@@H]([NH2+]C[C@H](C)C[NH3+])c1cccc(F)c1 ZINC000423305636 387141983 /nfs/dbraw/zinc/14/19/83/387141983.db2.gz KUDYPFCZMFNYRK-ZWNOBZJWSA-N 2 0 224.323 2.461 20 0 BEADRP CCCOc1ccc([C@@H](C)[NH2+]CC2C[NH2+]C2)cc1 ZINC000423305480 387142079 /nfs/dbraw/zinc/14/20/79/387142079.db2.gz QSYILKFVCNXTPG-GFCCVEGCSA-N 2 0 248.370 2.345 20 0 BEADRP CCC[NH2+]CC[NH2+][C@@H](C)C1CCSCC1 ZINC000423307949 387143330 /nfs/dbraw/zinc/14/33/30/387143330.db2.gz IIXHJUOMCMBXFN-NSHDSACASA-N 2 0 230.421 2.107 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H](C1CC1)C1CCCC1 ZINC000423308535 387144418 /nfs/dbraw/zinc/14/44/18/387144418.db2.gz OREDLPKICYYART-ZWNOBZJWSA-N 2 0 210.365 2.140 20 0 BEADRP CCC[C@H](Cc1ccccc1)[NH2+]CC1C[NH2+]C1 ZINC000423308681 387144554 /nfs/dbraw/zinc/14/45/54/387144554.db2.gz YDCDDXAQBBPCFL-OAHLLOKOSA-N 2 0 232.371 2.207 20 0 BEADRP CCC[NH2+]CC[NH2+][C@@H]1CCC[C@H]2C[C@]21C ZINC000423310791 387149139 /nfs/dbraw/zinc/14/91/39/387149139.db2.gz OLDDGODVOYNZMI-YNEHKIRRSA-N 2 0 210.365 2.154 20 0 BEADRP CC(C)CO[C@@H]1C[C@H]([NH2+]C[C@@H](C)C[NH3+])C1(C)C ZINC000423311487 387149704 /nfs/dbraw/zinc/14/97/04/387149704.db2.gz UBELJDWFSNBGFQ-RWMBFGLXSA-N 2 0 242.407 2.011 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@H]1CCCC12CCCC2 ZINC000423313246 387151183 /nfs/dbraw/zinc/15/11/83/387151183.db2.gz WQSYEGOIFPEXQV-RYUDHWBXSA-N 2 0 210.365 2.284 20 0 BEADRP CC[C@@H]([NH2+]CC1C[NH2+]C1)c1cccc(C)c1 ZINC000423312881 387151656 /nfs/dbraw/zinc/15/16/56/387151656.db2.gz DYHHILBGKPBCEF-CQSZACIVSA-N 2 0 218.344 2.255 20 0 BEADRP C[C@H]1Cc2ccc(F)cc2[C@H]1[NH2+]CCCC[NH3+] ZINC000423315378 387153063 /nfs/dbraw/zinc/15/30/63/387153063.db2.gz APBWAHXHTNWLGY-HZMBPMFUSA-N 2 0 236.334 2.388 20 0 BEADRP C[C@@H]1Cc2ccccc2[C@H]1[NH2+]C[C@H]([NH3+])C1CC1 ZINC000423314845 387154016 /nfs/dbraw/zinc/15/40/16/387154016.db2.gz HXZDLNSSXCOXSR-ONERCXAPSA-N 2 0 230.355 2.247 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H](C2CC2)C2CCCC2)CCC1 ZINC000423316403 387156401 /nfs/dbraw/zinc/15/64/01/387156401.db2.gz AQEUXGVIFFUJKL-CYBMUJFWSA-N 2 0 222.376 2.426 20 0 BEADRP CC(C)O[C@H]1C[C@H]([NH2+]CC2([NH3+])CCC2)C1(C)C ZINC000423315960 387157046 /nfs/dbraw/zinc/15/70/46/387157046.db2.gz BHVDIRCNJSDQDW-RYUDHWBXSA-N 2 0 240.391 2.050 20 0 BEADRP CCCCO[C@@H]1C[C@@H]([NH2+]C[C@@H](C)C[NH3+])C1(C)C ZINC000423316191 387157247 /nfs/dbraw/zinc/15/72/47/387157247.db2.gz ZQTJDWNOMFPSBO-YNEHKIRRSA-N 2 0 242.407 2.155 20 0 BEADRP [NH3+][C@H](C[NH2+][C@H]1CCC12CCCC2)C1CC1 ZINC000423318365 387158871 /nfs/dbraw/zinc/15/88/71/387158871.db2.gz KXEDPNPXRLUECB-NEPJUHHUSA-N 2 0 208.349 2.036 20 0 BEADRP C[C@H]([NH2+]C[C@@H]([NH3+])C1CC1)C1C(C)(C)C1(C)C ZINC000423318980 387158944 /nfs/dbraw/zinc/15/89/44/387158944.db2.gz LHIKEVOEBKNMOS-GXSJLCMTSA-N 2 0 224.392 2.384 20 0 BEADRP CC[C@@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)C1CC1 ZINC000423318160 387159032 /nfs/dbraw/zinc/15/90/32/387159032.db2.gz CFDVBFRFQDUEMN-OLZOCXBDSA-N 2 0 210.365 2.154 20 0 BEADRP CCC[NH2+]CC[NH2+][C@H]1CCCC12CCC2 ZINC000423317792 387160225 /nfs/dbraw/zinc/16/02/25/387160225.db2.gz YTGSNJXICRKZTA-LBPRGKRZSA-N 2 0 210.365 2.298 20 0 BEADRP CCC1(CC)[C@H]([NH2+]CC2([NH3+])CCC2)C[C@H]1OC ZINC000423319996 387162472 /nfs/dbraw/zinc/16/24/72/387162472.db2.gz FYGGTZKPXHESDL-VXGBXAGGSA-N 2 0 240.391 2.051 20 0 BEADRP CCC[C@@H]([NH2+]C[C@H]([NH3+])C1CC1)C1CCC1 ZINC000423324398 387168547 /nfs/dbraw/zinc/16/85/47/387168547.db2.gz PGXIMZCHTMFQBY-QWHCGFSZSA-N 2 0 210.365 2.282 20 0 BEADRP C[N@H+](CC1CC1)C(C)(C)CN1CCCC1 ZINC000418147079 387169890 /nfs/dbraw/zinc/16/98/90/387169890.db2.gz QGTKMZUQJFKYHK-UHFFFAOYSA-N 2 0 210.365 2.203 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@H]([NH2+]C[C@@H]([NH3+])C2CC2)C1 ZINC000423330372 387175862 /nfs/dbraw/zinc/17/58/62/387175862.db2.gz UFPMBKWANHZIFA-LYIQGSDWSA-N 2 0 210.365 2.138 20 0 BEADRP CCC1CC([NH2+]C[C@@]2(C)CCC[NH2+]C2)C1 ZINC000423332259 387177444 /nfs/dbraw/zinc/17/74/44/387177444.db2.gz HEZFBJBIEYAVLH-BPCQOVAHSA-N 2 0 210.365 2.154 20 0 BEADRP COc1ccc([C@H](C)[NH2+]CCCC[NH3+])c(C)c1 ZINC000423337427 387185595 /nfs/dbraw/zinc/18/55/95/387185595.db2.gz VOUXFNUQVUYFQD-LBPRGKRZSA-N 2 0 236.359 2.393 20 0 BEADRP C1=C(C[NH2+][C@H]2CCC[C@H](C3CC3)C2)CC[NH2+]C1 ZINC000423337196 387186025 /nfs/dbraw/zinc/18/60/25/387186025.db2.gz HLMYUWHYJDRWMB-GJZGRUSLSA-N 2 0 234.387 2.465 20 0 BEADRP CC(C)[C@H]1CCC[C@@H]1[NH2+]CC1=CC[NH2+]CC1 ZINC000423337976 387186028 /nfs/dbraw/zinc/18/60/28/387186028.db2.gz HWMLHEZSSDAHQD-KGLIPLIRSA-N 2 0 222.376 2.320 20 0 BEADRP CC[C@@H]([NH2+]CC1=CC[NH2+]CC1)C1CCC1 ZINC000423340011 387188783 /nfs/dbraw/zinc/18/87/83/387188783.db2.gz BUARPKMPSWFCNQ-CYBMUJFWSA-N 2 0 208.349 2.074 20 0 BEADRP C[C@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)c1cccc(O)c1 ZINC000423341739 387190297 /nfs/dbraw/zinc/19/02/97/387190297.db2.gz MUDWVIXFJRGLLY-WFASDCNBSA-N 2 0 248.370 2.433 20 0 BEADRP [NH3+]CCCC[NH2+]C1CCc2ccccc2CC1 ZINC000423341144 387190380 /nfs/dbraw/zinc/19/03/80/387190380.db2.gz XQPKJXKMJNOZAA-UHFFFAOYSA-N 2 0 232.371 2.263 20 0 BEADRP C1=C(C[NH2+][C@H](C2CC2)C2CCCC2)CC[NH2+]C1 ZINC000423342082 387190591 /nfs/dbraw/zinc/19/05/91/387190591.db2.gz CSGCDPDPRJDBPR-HNNXBMFYSA-N 2 0 234.387 2.465 20 0 BEADRP CC[C@H]1CCCC[C@@H]1[NH2+]CC1([NH3+])CCC1 ZINC000423340511 387190640 /nfs/dbraw/zinc/19/06/40/387190640.db2.gz XGQYTCGTLSNRGD-RYUDHWBXSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H]1c2ccccc2C[C@@H]1C ZINC000423299938 387133273 /nfs/dbraw/zinc/13/32/73/387133273.db2.gz QODDEZIJDQBZIP-UHIISALHSA-N 2 0 218.344 2.104 20 0 BEADRP CC(C)[C@H]([NH2+]CC1C[NH2+]C1)c1ccccc1 ZINC000423302776 387134155 /nfs/dbraw/zinc/13/41/55/387134155.db2.gz KLZUSJGAAJIRTA-AWEZNQCLSA-N 2 0 218.344 2.193 20 0 BEADRP C[C@@H]([NH2+]C[C@@H](C)C[NH3+])c1nccc2ccccc21 ZINC000423302661 387134764 /nfs/dbraw/zinc/13/47/64/387134764.db2.gz HSLFYHRVYKLBCT-NWDGAFQWSA-N 2 0 243.354 2.480 20 0 BEADRP Cc1cc([C@H](C)[NH2+]C[C@@H](C)C[NH3+])oc1C ZINC000423302391 387135217 /nfs/dbraw/zinc/13/52/17/387135217.db2.gz HIAIRMNXBXMWHE-WPRPVWTQSA-N 2 0 210.321 2.142 20 0 BEADRP Cc1cccc(CC[C@@H](C)[NH2+]CC2C[NH2+]C2)c1 ZINC000423302138 387135498 /nfs/dbraw/zinc/13/54/98/387135498.db2.gz IXQIHOYGAPRNDZ-CYBMUJFWSA-N 2 0 232.371 2.125 20 0 BEADRP CC[C@@H]1C[C@H](C)CC[C@@H]1[NH2+]C[C@@H](C)C[NH3+] ZINC000423301801 387135820 /nfs/dbraw/zinc/13/58/20/387135820.db2.gz GNJPRYDJPZNAGJ-XQHKEYJVSA-N 2 0 212.381 2.386 20 0 BEADRP CCc1ccc([C@H](C)[NH2+]CC2C[NH2+]C2)s1 ZINC000423304289 387137331 /nfs/dbraw/zinc/13/73/31/387137331.db2.gz NTQKEIHDKSFNMQ-VIFPVBQESA-N 2 0 224.373 2.181 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000423346504 387194114 /nfs/dbraw/zinc/19/41/14/387194114.db2.gz PVOGTQFMKQEYFK-UPJWGTAASA-N 2 0 210.365 2.154 20 0 BEADRP CCc1ccc([C@@H](C)[NH2+]CC2C[NH2+]C2)cc1 ZINC000423303627 387138207 /nfs/dbraw/zinc/13/82/07/387138207.db2.gz MCVVBFVBBKWEIE-LLVKDONJSA-N 2 0 218.344 2.119 20 0 BEADRP c1ccc([C@H]2CC[C@H]([NH2+]CC3C[NH2+]C3)C2)cc1 ZINC000423304411 387138734 /nfs/dbraw/zinc/13/87/34/387138734.db2.gz NUJYCFYHQDHZIC-GJZGRUSLSA-N 2 0 230.355 2.132 20 0 BEADRP CCC[NH2+]CC[NH2+][C@@H]1C[C@@H](C)CC[C@@H]1C ZINC000423305459 387138765 /nfs/dbraw/zinc/13/87/65/387138765.db2.gz BZYUVRFELLVELG-RWMBFGLXSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H](c1ccc(F)cc1)C1CC1 ZINC000423304360 387139001 /nfs/dbraw/zinc/13/90/01/387139001.db2.gz YLEVYPPEJCRYPM-YGRLFVJLSA-N 2 0 236.334 2.461 20 0 BEADRP CC(C)CCOCC[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000119518547 387139270 /nfs/dbraw/zinc/13/92/70/387139270.db2.gz XZHWNNRZIWAMPW-KGLIPLIRSA-N 2 0 242.407 2.121 20 0 BEADRP CC(C)CC[C@@H](C)[NH2+]CC1=CC[NH2+]CC1 ZINC000423350407 387203074 /nfs/dbraw/zinc/20/30/74/387203074.db2.gz ZJFYLORQAPFZPF-GFCCVEGCSA-N 2 0 210.365 2.320 20 0 BEADRP Cc1ccncc1C[NH2+]CCC1CC[NH+](C)CC1 ZINC000229937984 387204255 /nfs/dbraw/zinc/20/42/55/387204255.db2.gz LULMVKFNPUBCQN-UHFFFAOYSA-N 2 0 247.386 2.212 20 0 BEADRP COc1cccc([C@@H](C)[NH2+]CC[C@H]2CCC[NH2+]2)c1 ZINC000423353224 387206211 /nfs/dbraw/zinc/20/62/11/387206211.db2.gz BGFGNYCEHSKKJV-TZMCWYRMSA-N 2 0 248.370 2.488 20 0 BEADRP CCC[C@H]([NH2+]CCC[NH+](C)C)C1CCC1 ZINC000322462130 259707393 /nfs/dbraw/zinc/70/73/93/259707393.db2.gz LUROGXIJIAOHSS-ZDUSSCGKSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@H](CC(C)(C)C)[NH2+]CC1=CC[NH2+]CC1 ZINC000423362102 387212366 /nfs/dbraw/zinc/21/23/66/387212366.db2.gz XLVDGEQJEBBWHT-LLVKDONJSA-N 2 0 210.365 2.320 20 0 BEADRP C(C[C@H]1CCC[NH2+]1)[NH2+][C@H]1CCCC12CCC2 ZINC000423361376 387212812 /nfs/dbraw/zinc/21/28/12/387212812.db2.gz RWGGKIVRVIVTCS-OLZOCXBDSA-N 2 0 222.376 2.441 20 0 BEADRP Cc1cnccc1C[NH2+]CCCC[N@@H+](C)C1CC1 ZINC000571991388 387214847 /nfs/dbraw/zinc/21/48/47/387214847.db2.gz YAQGCBFXQVHMLB-UHFFFAOYSA-N 2 0 247.386 2.354 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)C1CCSCC1 ZINC000423371773 387223011 /nfs/dbraw/zinc/22/30/11/387223011.db2.gz FQWAEWGIWLHJSL-NQBHXWOUSA-N 2 0 242.432 2.248 20 0 BEADRP COc1cccc([C@H](C)[NH2+][C@H]2CC[NH2+][C@@H](C)C2)c1 ZINC000423372698 387226196 /nfs/dbraw/zinc/22/61/96/387226196.db2.gz IKTDGTPKHASWCF-OBJOEFQTSA-N 2 0 248.370 2.486 20 0 BEADRP C[C@H]([NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21)[C@H]1CCCC[C@H]1C ZINC000423425837 387253345 /nfs/dbraw/zinc/25/33/45/387253345.db2.gz HGQQKHNJIBLGQS-XNJGVTPASA-N 2 0 222.376 2.009 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@@H]1CCC[C@H]1CCCF ZINC000423396997 387231557 /nfs/dbraw/zinc/23/15/57/387231557.db2.gz NYWWEQUZRSUURU-ZOBORPQBSA-N 2 0 242.382 2.492 20 0 BEADRP [NH3+]CCCC[NH2+][C@H]1CCCOc2ccccc21 ZINC000423326474 387232774 /nfs/dbraw/zinc/23/27/74/387232774.db2.gz MGRRWKIKLDXOPE-ZDUSSCGKSA-N 2 0 234.343 2.229 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+][C@@H]1CCc2c1cccc2F ZINC000423400917 387233685 /nfs/dbraw/zinc/23/36/85/387233685.db2.gz QNBYBZCZXAYEDD-VCTAVGKDSA-N 2 0 248.345 2.401 20 0 BEADRP FCCC[C@@H]1CCC[C@@H]1[NH2+]CC1CC[NH2+]CC1 ZINC000643497415 387238604 /nfs/dbraw/zinc/23/86/04/387238604.db2.gz QJLMCAWBILNBEA-KBPBESRZSA-N 2 0 242.382 2.494 20 0 BEADRP Cc1ccnc([C@@H](C)[NH2+]CC2=CC[N@H+](C)CC2)c1 ZINC000353618570 387242948 /nfs/dbraw/zinc/24/29/48/387242948.db2.gz GQWFDXHCBOSPJL-CYBMUJFWSA-N 2 0 245.370 2.303 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+][C@@H]1CCCC12CCC2 ZINC000423406327 387243086 /nfs/dbraw/zinc/24/30/86/387243086.db2.gz UQJWGSUAWYLLMI-JHJVBQTASA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]1CCC[C@H](C)[C@H]1[NH2+][C@H]1CC[NH2+]C[C@H]1C ZINC000423407834 387243170 /nfs/dbraw/zinc/24/31/70/387243170.db2.gz WKQCSZSYFLWSON-BJJPWKGXSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@H]1CCCC12CCC2 ZINC000423406322 387243944 /nfs/dbraw/zinc/24/39/44/387243944.db2.gz UQJWGSUAWYLLMI-AGIUHOORSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@@H]1CCCC12CCC2 ZINC000423406326 387244066 /nfs/dbraw/zinc/24/40/66/387244066.db2.gz UQJWGSUAWYLLMI-FRRDWIJNSA-N 2 0 222.376 2.297 20 0 BEADRP CCC[C@H]([NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21)C(C)(C)C ZINC000423420146 387249367 /nfs/dbraw/zinc/24/93/67/387249367.db2.gz AYWDOQCAQFKUCS-WHOHXGKFSA-N 2 0 210.365 2.009 20 0 BEADRP CC(C)[C@@H](C)[NH2+]C[C@H]1CC[C@H](C[NH3+])CC1 ZINC000423421322 387250381 /nfs/dbraw/zinc/25/03/81/387250381.db2.gz KCOFGAQYZONMEX-JHJVBQTASA-N 2 0 212.381 2.386 20 0 BEADRP CC(C)[C@H](C)[NH2+]C[C@H]1CC[C@H](C[NH3+])CC1 ZINC000423421321 387251029 /nfs/dbraw/zinc/25/10/29/387251029.db2.gz KCOFGAQYZONMEX-AVGNSLFASA-N 2 0 212.381 2.386 20 0 BEADRP CC[C@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)C1CC1 ZINC000423424739 387251771 /nfs/dbraw/zinc/25/17/71/387251771.db2.gz CSXPHOPTSXYWID-MELADBBJSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]([NH2+]CC1(C)CC[NH2+]CC1)[C@H]1C[C@H]1C ZINC000423345762 387195356 /nfs/dbraw/zinc/19/53/56/387195356.db2.gz ZABMNHLDFUWWIJ-UTUOFQBUSA-N 2 0 210.365 2.010 20 0 BEADRP Cc1ccnc([C@H](C)[NH2+]CC2(C)CC[NH2+]CC2)c1 ZINC000423346115 387195471 /nfs/dbraw/zinc/19/54/71/387195471.db2.gz ZJLBAEGAKWSWHV-ZDUSSCGKSA-N 2 0 247.386 2.430 20 0 BEADRP CC(C)C1CC([NH2+]C[C@]2(C)CCC[NH2+]C2)C1 ZINC000423347688 387197415 /nfs/dbraw/zinc/19/74/15/387197415.db2.gz RSBJJHIRNMRWCF-JXQTWKCFSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CC2=CC[NH2+]CC2)C[C@@H]1C ZINC000423348180 387197657 /nfs/dbraw/zinc/19/76/57/387197657.db2.gz SCDQYSDEWFJVJE-DYEKYZERSA-N 2 0 222.376 2.320 20 0 BEADRP CCC[C@H]([NH2+]CC1=CC[NH2+]CC1)c1cccnc1 ZINC000423347769 387198012 /nfs/dbraw/zinc/19/80/12/387198012.db2.gz RBHUNGANTHHVPQ-HNNXBMFYSA-N 2 0 245.370 2.432 20 0 BEADRP C[C@@H](CC1CCCC1)[NH2+]CC1=CC[NH2+]CC1 ZINC000423350616 387202105 /nfs/dbraw/zinc/20/21/05/387202105.db2.gz ZXPARBWYYQTQAC-LBPRGKRZSA-N 2 0 222.376 2.465 20 0 BEADRP Cc1ccnc([C@@H](C)[NH2+][C@@H](C)CCC[NH3+])c1 ZINC000423465539 387313144 /nfs/dbraw/zinc/31/31/44/387313144.db2.gz WOLHCBWZBGMWDJ-NWDGAFQWSA-N 2 0 221.348 2.168 20 0 BEADRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)[C@@H]1C[C@H]1C ZINC000321903004 387313869 /nfs/dbraw/zinc/31/38/69/387313869.db2.gz NYSWDCSEBISATE-BVMMLCNSSA-N 2 0 222.376 2.246 20 0 BEADRP Cc1cc([C@H](C)[NH2+]CCC[C@H]2CCC[NH2+]2)no1 ZINC000423467601 387315893 /nfs/dbraw/zinc/31/58/93/387315893.db2.gz BKSOKRYHWUDLBM-RYUDHWBXSA-N 2 0 237.347 2.166 20 0 BEADRP CCCC[C@H](C)[C@@H](C)[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000423429481 387254731 /nfs/dbraw/zinc/25/47/31/387254731.db2.gz LOAZXTDEYORYOM-OBPIAQAESA-N 2 0 210.365 2.009 20 0 BEADRP CCCC[NH+]1CCC([NH2+][C@@H]2CCO[C@@H]2C)CC1 ZINC000120658775 387262283 /nfs/dbraw/zinc/26/22/83/387262283.db2.gz KKTSYRFGLFLFPN-TZMCWYRMSA-N 2 0 240.391 2.018 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+]C1C2CC3CC(C2)CC1C3 ZINC000423382977 387265505 /nfs/dbraw/zinc/26/55/05/387265505.db2.gz OXSLIJCESRIWNF-IBEXFIOLSA-N 2 0 236.403 2.399 20 0 BEADRP CC[C@H]([NH2+][C@H]1CC[NH2+][C@H](C)C1)c1ccncc1 ZINC000423384124 387267763 /nfs/dbraw/zinc/26/77/63/387267763.db2.gz QACGCKPEFBMGBP-XBFCOCLRSA-N 2 0 233.359 2.263 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+][C@@H]1CCC12CCCC2 ZINC000423389757 387273166 /nfs/dbraw/zinc/27/31/66/387273166.db2.gz JQMOGUDYFBUPFX-JHJVBQTASA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@H]2CCC23CCCC3)CC[NH2+]1 ZINC000423394534 387280683 /nfs/dbraw/zinc/28/06/83/387280683.db2.gz ZWQCCFNKDHPXPJ-AGIUHOORSA-N 2 0 222.376 2.439 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCC23CCCC3)CC[NH2+]1 ZINC000423394536 387282217 /nfs/dbraw/zinc/28/22/17/387282217.db2.gz ZWQCCFNKDHPXPJ-FRRDWIJNSA-N 2 0 222.376 2.439 20 0 BEADRP C[C@H]([NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21)C(C)(C)c1ccccc1 ZINC000423431550 387284826 /nfs/dbraw/zinc/28/48/26/387284826.db2.gz LTYSHONPBOQKES-SPWCGHHHSA-N 2 0 244.382 2.160 20 0 BEADRP COC[C@@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)C(C)C ZINC000423434809 387286256 /nfs/dbraw/zinc/28/62/56/387286256.db2.gz YDFNOLOVIUXXTO-MGPQQGTHSA-N 2 0 242.407 2.012 20 0 BEADRP C[C@@H]([NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21)C1CCCCCC1 ZINC000423434110 387286728 /nfs/dbraw/zinc/28/67/28/387286728.db2.gz NVJDHXUQUQXTJY-ZZVYKPCYSA-N 2 0 222.376 2.153 20 0 BEADRP CCOC[C@@H]1CCC[C@H]1[NH2+][C@@H](C)CCCC[NH3+] ZINC000423438691 387289012 /nfs/dbraw/zinc/28/90/12/387289012.db2.gz RRZFIWAFSCFZSZ-MELADBBJSA-N 2 0 242.407 2.299 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@@H](C)C1C(C)(C)C1(C)C ZINC000423440670 387289456 /nfs/dbraw/zinc/28/94/56/387289456.db2.gz AVNGMKJFCFKRDI-UWVGGRQHSA-N 2 0 212.381 2.384 20 0 BEADRP CC1(C)CC[C@H]1[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000423440234 387290048 /nfs/dbraw/zinc/29/00/48/387290048.db2.gz OPINQALLJFYPBB-YNEHKIRRSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H]([NH3+])[C@H](C)[NH2+][C@H]1CCC[C@@H]1CCCF ZINC000423441814 387291200 /nfs/dbraw/zinc/29/12/00/387291200.db2.gz BESAOVKQPCWNNY-YFKTTZPYSA-N 2 0 216.344 2.230 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000423440233 387291367 /nfs/dbraw/zinc/29/13/67/387291367.db2.gz OPINQALLJFYPBB-XQQFMLRXSA-N 2 0 222.376 2.153 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+][C@@H]1[C@H]3C[NH2+]C[C@H]31)[C@H](C)C2 ZINC000423441477 387292471 /nfs/dbraw/zinc/29/24/71/387292471.db2.gz UMSYOGGXITWSIU-IRHMCKRBSA-N 2 0 242.366 2.036 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000423442106 387292684 /nfs/dbraw/zinc/29/26/84/387292684.db2.gz UVWOSLYSMQCTLT-DFBGVHRSSA-N 3 0 247.386 2.238 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+][C@@H]1[C@H]3C[NH2+]C[C@H]31)[C@@H](C)C2 ZINC000423441475 387293095 /nfs/dbraw/zinc/29/30/95/387293095.db2.gz UMSYOGGXITWSIU-BVEJOUGXSA-N 2 0 242.366 2.036 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)[C@@H]1CC1(C)C ZINC000423445356 387295616 /nfs/dbraw/zinc/29/56/16/387295616.db2.gz RVESXSCXRLBYEP-DOERSZECSA-N 2 0 236.403 2.399 20 0 BEADRP CC(C)[C@H](C)[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000423447165 387298100 /nfs/dbraw/zinc/29/81/00/387298100.db2.gz TVSHKWOTMMZJLW-WCFLWFBJSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@H]([NH3+])[C@H](C)[NH2+][C@H]1c2ccccc2C[C@H]1C ZINC000423448585 387298196 /nfs/dbraw/zinc/29/81/96/387298196.db2.gz QOQQWFDBTSTWAL-YAMSLAJTSA-N 2 0 218.344 2.245 20 0 BEADRP Cc1ccc(CCC[NH2+]CC(C)(C)N(C)C)cn1 ZINC000353931684 387299642 /nfs/dbraw/zinc/29/96/42/387299642.db2.gz JPTUMYNNYSHSPP-UHFFFAOYSA-N 3 0 249.402 2.252 20 0 BEADRP C[C@@H]([NH2+][C@H](Cc1ccccc1)C1CC1)[C@H](C)[NH3+] ZINC000423450164 387300456 /nfs/dbraw/zinc/30/04/56/387300456.db2.gz SOFPJQYXDKNSSG-YWPYICTPSA-N 2 0 232.371 2.333 20 0 BEADRP CC(C)CO[C@@H]1C[C@H]([NH2+][C@@H](C)[C@H](C)[NH3+])C1(C)C ZINC000423454122 387301371 /nfs/dbraw/zinc/30/13/71/387301371.db2.gz YPJZIHBIKQARQG-ZDEQEGDKSA-N 2 0 242.407 2.151 20 0 BEADRP C[C@@H]([NH2+][C@H](C)C1C(C)(C)C1(C)C)[C@H](C)[NH3+] ZINC000423454100 387302071 /nfs/dbraw/zinc/30/20/71/387302071.db2.gz YNUKTQGSEXVMOL-IVZWLZJFSA-N 2 0 212.381 2.382 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@H]1CCC[C@H]1CCCF ZINC000423457029 387304031 /nfs/dbraw/zinc/30/40/31/387304031.db2.gz FDQKMETXZCNSLY-SRVKXCTJSA-N 2 0 216.344 2.232 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@@H](Cc1ccccc1)C1CC1 ZINC000423457461 387305600 /nfs/dbraw/zinc/30/56/00/387305600.db2.gz FTCSWFBXBMPFAX-GJZGRUSLSA-N 2 0 232.371 2.335 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+][C@H]1CCC[C@H]([NH3+])C1)CO2 ZINC000514872997 387306006 /nfs/dbraw/zinc/30/60/06/387306006.db2.gz MBICGTGEQROHBD-SGMGOOAPSA-N 2 0 246.354 2.288 20 0 BEADRP CC[C@@H]([NH2+][C@@H](C)CCC[NH3+])c1ccc(F)cn1 ZINC000423457760 387306307 /nfs/dbraw/zinc/30/63/07/387306307.db2.gz PMOCTIPCSNEPFL-CMPLNLGQSA-N 2 0 239.338 2.389 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@H](Cc1ccccc1)C1CC1 ZINC000423457462 387306437 /nfs/dbraw/zinc/30/64/37/387306437.db2.gz FTCSWFBXBMPFAX-HUUCEWRRSA-N 2 0 232.371 2.335 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+][C@H]1CCC[C@@H]([NH3+])C1)CO2 ZINC000514872993 387306496 /nfs/dbraw/zinc/30/64/96/387306496.db2.gz MBICGTGEQROHBD-MBNYWOFBSA-N 2 0 246.354 2.288 20 0 BEADRP COc1ccc2c(c1)[C@@H]([NH2+][C@H](C)CCC[NH3+])CC2 ZINC000423460981 387308343 /nfs/dbraw/zinc/30/83/43/387308343.db2.gz SIYJBYUCGKYNES-ABAIWWIYSA-N 2 0 248.370 2.400 20 0 BEADRP COc1ccc2c(c1)[C@@H]([NH2+][C@@H](C)CCC[NH3+])CC2 ZINC000423460984 387308559 /nfs/dbraw/zinc/30/85/59/387308559.db2.gz SIYJBYUCGKYNES-NHYWBVRUSA-N 2 0 248.370 2.400 20 0 BEADRP Cc1ccc2c(c1)[C@@H]([NH2+][C@@H]1[C@H]3C[NH2+]C[C@H]31)[C@H](C)C2 ZINC000423461383 387308991 /nfs/dbraw/zinc/30/89/91/387308991.db2.gz UMSYOGGXITWSIU-DMHMKPBJSA-N 2 0 242.366 2.036 20 0 BEADRP CC1(C)CC[C@H]([NH2+]CCC2=CC[NH2+]CC2)C1 ZINC000423535352 387361041 /nfs/dbraw/zinc/36/10/41/387361041.db2.gz CRXVFPPADSMXKG-ZDUSSCGKSA-N 2 0 222.376 2.465 20 0 BEADRP C1=C(CC[NH2+][C@@H]2CC[C@@H]2C2CCC2)CC[NH2+]C1 ZINC000423534549 387361193 /nfs/dbraw/zinc/36/11/93/387361193.db2.gz ACOBNMRXAKVZPV-HUUCEWRRSA-N 2 0 234.387 2.465 20 0 BEADRP C[C@H]([NH2+][C@H]1CCCC[NH2+]C1)[C@H]1CC1(C)C ZINC000423541764 387365958 /nfs/dbraw/zinc/36/59/58/387365958.db2.gz AAFOMUUPLFDZHI-SDDRHHMPSA-N 2 0 210.365 2.153 20 0 BEADRP CC1(C)CC[C@H]1[NH2+]CCC1=CC[NH2+]CC1 ZINC000423541463 387366426 /nfs/dbraw/zinc/36/64/26/387366426.db2.gz RWYIYZQPIATAOA-GFCCVEGCSA-N 2 0 208.349 2.074 20 0 BEADRP C1=C(CC[NH2+][C@@H]2CCC23CCC3)CC[NH2+]C1 ZINC000423545103 387367577 /nfs/dbraw/zinc/36/75/77/387367577.db2.gz XOXFGCAPETTXMR-CYBMUJFWSA-N 2 0 220.360 2.219 20 0 BEADRP CC[C@H]1CC[C@H]1[NH2+]CCC1=CC[NH2+]CC1 ZINC000423542753 387368732 /nfs/dbraw/zinc/36/87/32/387368732.db2.gz UECONQDCULAEBD-QWHCGFSZSA-N 2 0 208.349 2.074 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCO[C@H](CC)C1)[C@@H]1CCC[NH2+]1 ZINC000423546235 387370750 /nfs/dbraw/zinc/37/07/50/387370750.db2.gz KMBBFUFGOWGYDZ-MQYQWHSLSA-N 2 0 240.391 2.064 20 0 BEADRP C[C@H]1CCC[C@@H]([NH2+]CCC2=CC[NH2+]CC2)C1 ZINC000423547906 387371105 /nfs/dbraw/zinc/37/11/05/387371105.db2.gz GDLMDEYSHXYQAY-GXTWGEPZSA-N 2 0 222.376 2.465 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]C[C@@H]1Cc2ccccc21 ZINC000643453647 387371206 /nfs/dbraw/zinc/37/12/06/387371206.db2.gz OVLJGZUXLVNJDY-GVXVVHGQSA-N 2 0 218.344 2.042 20 0 BEADRP CC[C@@H]1C[C@H]([NH2+][C@@H]2CCCCC[C@H]2[NH3+])CCO1 ZINC000423554055 387372560 /nfs/dbraw/zinc/37/25/60/387372560.db2.gz RGMLGIXQYGVVNJ-AAVRWANBSA-N 2 0 240.391 2.194 20 0 BEADRP C(C[NH2+]C1CC1)C[NH2+][C@@H]1CCCC12CCC2 ZINC000423550951 387373803 /nfs/dbraw/zinc/37/38/03/387373803.db2.gz IUUBNLRXIKMPNR-CYBMUJFWSA-N 2 0 222.376 2.441 20 0 BEADRP C[C@]12C[C@H]1CCC[C@H]2[NH2+]CCC[NH2+]C1CC1 ZINC000423561693 387377952 /nfs/dbraw/zinc/37/79/52/387377952.db2.gz PZJXXZJSVXMFOH-BNOWGMLFSA-N 2 0 222.376 2.297 20 0 BEADRP CO[C@@H](C)C[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000372707097 387322145 /nfs/dbraw/zinc/32/21/45/387322145.db2.gz RXEVACKBGRLNJU-LBPRGKRZSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1ccccn1 ZINC000423474360 387322196 /nfs/dbraw/zinc/32/21/96/387322196.db2.gz HFZZVPZCMNNBSK-QWHCGFSZSA-N 2 0 233.359 2.264 20 0 BEADRP CO[C@H](C)C[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000372707096 387322394 /nfs/dbraw/zinc/32/23/94/387322394.db2.gz RXEVACKBGRLNJU-GFCCVEGCSA-N 2 0 240.391 2.018 20 0 BEADRP CC[C@H]([NH3+])C[NH2+]C1CCC(CSC)CC1 ZINC000423475162 387322570 /nfs/dbraw/zinc/32/25/70/387322570.db2.gz RRVNRBFCPGJHDR-CXQJBGSLSA-N 2 0 230.421 2.235 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@@H](C)CCCc1cccnc1 ZINC000423478936 387327448 /nfs/dbraw/zinc/32/74/48/387327448.db2.gz UXUMQVZZWWQIGU-GXTWGEPZSA-N 2 0 235.375 2.120 20 0 BEADRP CCC1CC([NH2+]C[C@H]2CCC[C@@H]([NH3+])C2)C1 ZINC000423481953 387327679 /nfs/dbraw/zinc/32/76/79/387327679.db2.gz XDOFUQMQGJTULY-CMOBGSAGSA-N 2 0 210.365 2.282 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@@H]1CCCC12CCCC2 ZINC000423486010 387331680 /nfs/dbraw/zinc/33/16/80/387331680.db2.gz ZJMZUIVMBBGNRF-NWDGAFQWSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1cccnc1 ZINC000423487978 387332959 /nfs/dbraw/zinc/33/29/59/387332959.db2.gz VCRLDKNVMIMQKV-OCCSQVGLSA-N 2 0 233.359 2.264 20 0 BEADRP Cc1cc(N)cc(C[NH2+][C@@H]2CCCC[C@@H]2C[NH3+])c1 ZINC000423486343 387333623 /nfs/dbraw/zinc/33/36/23/387333623.db2.gz WJCILUSUNVTIKH-UKRRQHHQSA-N 2 0 247.386 2.184 20 0 BEADRP Cc1ccc([C@H](C)[NH2+][C@H]2CC[C@@H](C[NH3+])C2)o1 ZINC000423492221 387336390 /nfs/dbraw/zinc/33/63/90/387336390.db2.gz MFXDMRBKKQJABO-TUAOUCFPSA-N 2 0 222.332 2.366 20 0 BEADRP CC(C)[C@H]([NH2+][C@@H]1CC[C@H](C[NH3+])C1)c1cccnc1 ZINC000423491902 387336616 /nfs/dbraw/zinc/33/66/16/387336616.db2.gz KRVFQOTZGBWVSR-CFVMTHIKSA-N 2 0 247.386 2.496 20 0 BEADRP Cc1nc([C@H](C)[NH2+][C@H]2CC[C@@H](C[NH3+])C2)cs1 ZINC000423493554 387338514 /nfs/dbraw/zinc/33/85/14/387338514.db2.gz BVWYNUIDJNSPIN-GDPRMGEGSA-N 2 0 239.388 2.230 20 0 BEADRP Cc1ccc(CCC[NH2+][C@H](C)CC[NH+](C)C)cn1 ZINC000354180920 387343183 /nfs/dbraw/zinc/34/31/83/387343183.db2.gz JZDPZTWNNUBAFL-CQSZACIVSA-N 2 0 249.402 2.252 20 0 BEADRP Cc1cncc([C@H](C)[NH2+][C@@H]2CC[C@H](C[NH3+])C2)c1 ZINC000423502199 387343178 /nfs/dbraw/zinc/34/31/78/387343178.db2.gz JSBKXKIXSQIDKL-SGMGOOAPSA-N 2 0 233.359 2.168 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[NH2+]C2)c(C)n1 ZINC000643500777 387345262 /nfs/dbraw/zinc/34/52/62/387345262.db2.gz FAFGCXKFWQXGFG-OCCSQVGLSA-N 2 0 247.386 2.349 20 0 BEADRP CC(C)=CCC[C@H](C)[NH2+]C[C@@H]1C[NH2+]CCCO1 ZINC000423506030 387345715 /nfs/dbraw/zinc/34/57/15/387345715.db2.gz GXSKKGYTBKSPPE-KBPBESRZSA-N 2 0 240.391 2.089 20 0 BEADRP CCOC[C@H]1CCC[C@H]1[NH2+]CCCC[NH+](C)C ZINC000354211426 387347143 /nfs/dbraw/zinc/34/71/43/387347143.db2.gz MWEBYNWGJBECRM-ZIAGYGMSSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@@H]1OCC[C@@H]1[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000423512547 387347261 /nfs/dbraw/zinc/34/72/61/387347261.db2.gz UYDRUEFHPVBLIC-QEJZJMRPSA-N 2 0 248.370 2.234 20 0 BEADRP C[C@@H]1OCC[C@@H]1[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000423512544 387347807 /nfs/dbraw/zinc/34/78/07/387347807.db2.gz UYDRUEFHPVBLIC-AEGPPILISA-N 2 0 248.370 2.234 20 0 BEADRP C[C@@H]1C[C@H]1C[NH2+]CCCCC[NH+]1CCCC1 ZINC000354235436 387349092 /nfs/dbraw/zinc/34/90/92/387349092.db2.gz GDKPETCAGNPGFQ-KGLIPLIRSA-N 2 0 224.392 2.498 20 0 BEADRP CCSCC[N@@H+]1CCCC12CC[NH+](C)CC2 ZINC000374324430 387443661 /nfs/dbraw/zinc/44/36/61/387443661.db2.gz MCBQEGPNECPUFW-UHFFFAOYSA-N 2 0 242.432 2.300 20 0 BEADRP c1ccc2c(c1)CCC[C@@H]([NH2+]C[C@@H]1CCC[NH2+]1)C2 ZINC000643505769 387455365 /nfs/dbraw/zinc/45/53/65/387455365.db2.gz JFOMSRHVJDHADJ-CVEARBPZSA-N 2 0 244.382 2.276 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CC(C)(C)[C@@H]1CCCCO1 ZINC000643466831 387389776 /nfs/dbraw/zinc/38/97/76/387389776.db2.gz PTCAOPJZMLWNHQ-XQQFMLRXSA-N 2 0 242.407 2.297 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]Cc1nccc2ccccc21 ZINC000643468535 387410808 /nfs/dbraw/zinc/41/08/08/387410808.db2.gz UOSDRESPNCEYNM-NWDGAFQWSA-N 2 0 243.354 2.450 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]Cc1nccc2ccccc21 ZINC000643468536 387410996 /nfs/dbraw/zinc/41/09/96/387410996.db2.gz UOSDRESPNCEYNM-RYUDHWBXSA-N 2 0 243.354 2.450 20 0 BEADRP C[C@H](C[NH2+]C(C1CCC1)C1CCC1)N(C)C ZINC000304312855 387460932 /nfs/dbraw/zinc/46/09/32/387460932.db2.gz KPMUAUSUKIOEJE-LLVKDONJSA-N 2 0 224.392 2.495 20 0 BEADRP CC[NH+](CC)CCC[N@H+](CC)C[C@H](C)OC ZINC000361570471 387495686 /nfs/dbraw/zinc/49/56/86/387495686.db2.gz WOIJZZLLVLCDOQ-ZDUSSCGKSA-N 2 0 230.396 2.075 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000643509291 387502221 /nfs/dbraw/zinc/50/22/21/387502221.db2.gz UWCIHJSVMTXPLR-OLZOCXBDSA-N 2 0 236.359 2.190 20 0 BEADRP CO[C@@H]1CCC[C@H]([NH2+][C@H]2CCCC[C@@H]2C[NH3+])C1 ZINC000643475299 387509055 /nfs/dbraw/zinc/50/90/55/387509055.db2.gz CDZLOZZTSGAYSM-RQJABVFESA-N 2 0 240.391 2.051 20 0 BEADRP CO[C@@H]1CCC[C@H]([NH2+][C@@H](C)CCCC[NH3+])C1 ZINC000643475373 387509730 /nfs/dbraw/zinc/50/97/30/387509730.db2.gz NPVCAZJSTKYHBG-RWMBFGLXSA-N 2 0 228.380 2.051 20 0 BEADRP CCN(CC)[C@H](C)C[NH2+][C@@H](C)[C@H]1CCCOC1 ZINC000355295867 387516239 /nfs/dbraw/zinc/51/62/39/387516239.db2.gz SFJNGIMXPOVDQQ-RDBSUJKOSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H](C[NH2+][C@@H](C)CCC[NH3+])CC(F)(F)F ZINC000396922147 387516198 /nfs/dbraw/zinc/51/61/98/387516198.db2.gz GSFTUUXWYWCTFP-IUCAKERBSA-N 2 0 226.286 2.292 20 0 BEADRP CC[NH+](CC)CC1CC[NH+](CCCF)CC1 ZINC000361648938 387517686 /nfs/dbraw/zinc/51/76/86/387517686.db2.gz VSZPVQKEXHDVOH-UHFFFAOYSA-N 2 0 230.371 2.400 20 0 BEADRP CO[C@@H]1CCCC[C@@H]1[NH2+]CC[C@H]1CCC[N@@H+]1C ZINC000361748985 387528390 /nfs/dbraw/zinc/52/83/90/387528390.db2.gz CRUKYFZISLRMCM-HZSPNIEDSA-N 2 0 240.391 2.018 20 0 BEADRP Cc1cc(C)c(C[NH2+][C@H]2CCCC[C@H]2C[NH3+])cn1 ZINC000397026981 387533123 /nfs/dbraw/zinc/53/31/23/387533123.db2.gz OEZDZZFVFZPWOG-ZFWWWQNUSA-N 2 0 247.386 2.306 20 0 BEADRP CC[N@@H+]1CC[C@H](N(C)CC2(F)CC2)C[C@H]1C ZINC000527219146 387539979 /nfs/dbraw/zinc/53/99/79/387539979.db2.gz IHRZLMUDOXDWIL-NEPJUHHUSA-N 2 0 228.355 2.293 20 0 BEADRP CC[N@H+](CCCn1ccnc1)CC1CCC1 ZINC000361484274 387468194 /nfs/dbraw/zinc/46/81/94/387468194.db2.gz IPPDTJQPSXRNSI-UHFFFAOYSA-N 2 0 221.348 2.395 20 0 BEADRP CO[C@H](C)[C@H](C)[NH2+]CC1(C[NH+](C)C)CCCC1 ZINC000355069923 387474682 /nfs/dbraw/zinc/47/46/82/387474682.db2.gz SIWBFYJHEQPLFR-QWHCGFSZSA-N 2 0 242.407 2.121 20 0 BEADRP CC(C)[NH2+]CCCN[C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000643508498 387486177 /nfs/dbraw/zinc/48/61/77/387486177.db2.gz TWORRUOCINUWMI-HUUCEWRRSA-N 2 0 247.386 2.109 20 0 BEADRP CCC1(O)CCC([NH2+][C@H](C)CCCC[NH3+])CC1 ZINC000643474148 387489064 /nfs/dbraw/zinc/48/90/64/387489064.db2.gz HSFJCIIBFOECQV-IYXRBSQSSA-N 2 0 242.407 2.177 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H]1CCc2c1cc(F)cc2F ZINC000643514845 387599545 /nfs/dbraw/zinc/59/95/45/387599545.db2.gz QHBQOCDLMILPKE-AMIZOPFISA-N 2 0 240.297 2.137 20 0 BEADRP C[C@@H](CC[NH3+])[NH2+]Cc1cccc(C2CC2)c1 ZINC000422552352 387599692 /nfs/dbraw/zinc/59/96/92/387599692.db2.gz GXBBAXOKJPFHAJ-NSHDSACASA-N 2 0 218.344 2.391 20 0 BEADRP Cc1nccn1CCC[N@@H+]1CC(C)=C[C@H](C)C1 ZINC000430266681 387603739 /nfs/dbraw/zinc/60/37/39/387603739.db2.gz YLRVFINZTFIUEM-LBPRGKRZSA-N 2 0 233.359 2.480 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]CCc1c(F)cccc1F ZINC000422698496 387615411 /nfs/dbraw/zinc/61/54/11/387615411.db2.gz ZOAKKOKODOSFJI-JTQLQIEISA-N 2 0 242.313 2.224 20 0 BEADRP C[C@@H]([NH2+][C@H]1[C@H](C)CCC[C@@H]1C)C1C[NH2+]C1 ZINC000422703571 387617442 /nfs/dbraw/zinc/61/74/42/387617442.db2.gz NJGFLXOERIIELJ-XZUYRWCXSA-N 2 0 210.365 2.009 20 0 BEADRP CC[C@@H](Cc1ccccc1)[NH2+][C@H](C)C1C[NH2+]C1 ZINC000422702866 387617666 /nfs/dbraw/zinc/61/76/66/387617666.db2.gz GDYOIUUUYSWLHQ-DOMZBBRYSA-N 2 0 232.371 2.205 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]Cc1ccc2ccccc2n1 ZINC000422702915 387618067 /nfs/dbraw/zinc/61/80/67/387618067.db2.gz LSMNIJOWKPYJFS-RYUDHWBXSA-N 2 0 243.354 2.450 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCC[C@@H](C)C1)[C@@H]1CCC[NH2+]1 ZINC000422702785 387618886 /nfs/dbraw/zinc/61/88/86/387618886.db2.gz LPLFJCSAWJOUJS-LPWJVIDDSA-N 2 0 210.365 2.295 20 0 BEADRP Cc1ccsc1C[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000422709538 387622298 /nfs/dbraw/zinc/62/22/98/387622298.db2.gz ZJARYFMHUIMOPB-UWVGGRQHSA-N 2 0 212.362 2.272 20 0 BEADRP CC[C@H](Cc1cccs1)[NH2+]C[C@H]([NH3+])C1CC1 ZINC000643516418 387623677 /nfs/dbraw/zinc/62/36/77/387623677.db2.gz RNBGFFNRNHXVOY-YPMHNXCESA-N 2 0 238.400 2.396 20 0 BEADRP Cc1ccsc1C[NH2+][C@H](C)C[C@H](C)[NH3+] ZINC000422709539 387623930 /nfs/dbraw/zinc/62/39/30/387623930.db2.gz ZJARYFMHUIMOPB-VHSXEESVSA-N 2 0 212.362 2.272 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[NH2+][C@H]1CCC[C@H]1[NH3+] ZINC000422708165 387623939 /nfs/dbraw/zinc/62/39/39/387623939.db2.gz XECHHJYFFCUHPW-LPWJVIDDSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CCO[C@@H]1CCCC[C@@H]1C ZINC000422711434 387626007 /nfs/dbraw/zinc/62/60/07/387626007.db2.gz NCIWDGGMNUOZLP-BFHYXJOUSA-N 2 0 242.407 2.299 20 0 BEADRP COCC(C)(C)C[NH+]1CCC([NH2+]C(C)C)CC1 ZINC000426397588 387565207 /nfs/dbraw/zinc/56/52/07/387565207.db2.gz UKNZPRQWFYGFBS-UHFFFAOYSA-N 2 0 242.407 2.121 20 0 BEADRP Cc1cc(C)c(C[NH2+]CCCC[NH3+])c(C)c1 ZINC000037714648 387565387 /nfs/dbraw/zinc/56/53/87/387565387.db2.gz GOXORAQCTAZPSQ-UHFFFAOYSA-N 2 0 220.360 2.440 20 0 BEADRP [NH3+][C@H](C[NH2+][C@H]1CCCc2ccccc2C1)C1CC1 ZINC000643516689 387629903 /nfs/dbraw/zinc/62/99/03/387629903.db2.gz JWHRNYZQAIAEFY-JKSUJKDBSA-N 2 0 244.382 2.261 20 0 BEADRP Cc1ccc([C@H](C)[NH2+][C@@H](C)C2C[NH2+]C2)cc1 ZINC000422718941 387631460 /nfs/dbraw/zinc/63/14/60/387631460.db2.gz LQHGRNLAVAVCGS-RYUDHWBXSA-N 2 0 218.344 2.254 20 0 BEADRP C[C@@H]([NH2+]Cc1cccc(Cl)c1)C1C[NH2+]C1 ZINC000422727089 387635293 /nfs/dbraw/zinc/63/52/93/387635293.db2.gz GMEQEZGRPLYCGR-SECBINFHSA-N 2 0 224.735 2.038 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]C1CCCC1 ZINC000422727678 387635878 /nfs/dbraw/zinc/63/58/78/387635878.db2.gz DAMSHUBFJIZOHL-SNVBAGLBSA-N 2 0 233.359 2.442 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)CCc1ccccc1)C1C[NH2+]C1 ZINC000422730876 387639278 /nfs/dbraw/zinc/63/92/78/387639278.db2.gz MPHPTBIKIKUNBP-QWHCGFSZSA-N 2 0 232.371 2.205 20 0 BEADRP COCCCCC[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000166395611 387641711 /nfs/dbraw/zinc/64/17/11/387641711.db2.gz CAOAORRTKFXVRY-UONOGXRCSA-N 2 0 240.391 2.020 20 0 BEADRP CCCCOCCC[NH2+][C@H](CC)[C@@H]1CCC[NH2+]1 ZINC000422738918 387645292 /nfs/dbraw/zinc/64/52/92/387645292.db2.gz ZQFMIRGIGOZGOM-KGLIPLIRSA-N 2 0 242.407 2.313 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[C@@H](C)C[C@H]1C)C1C[NH2+]C1 ZINC000422737341 387646351 /nfs/dbraw/zinc/64/63/51/387646351.db2.gz XJVBIDQZJJVKAO-UZWSLXQKSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]CCc1ccccc1 ZINC000422741592 387647945 /nfs/dbraw/zinc/64/79/45/387647945.db2.gz DWPGQKBOWWKJJZ-HIFRSBDPSA-N 2 0 232.371 2.207 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)[C@@H]2C[C@H]2C2CC2)C1 ZINC000527639396 387649041 /nfs/dbraw/zinc/64/90/41/387649041.db2.gz CAKNMCPHBNGGHK-DHMWGJHJSA-N 2 0 236.403 2.352 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CCC[C@@H](C)C1)C1C[NH2+]C1 ZINC000422741252 387649098 /nfs/dbraw/zinc/64/90/98/387649098.db2.gz DBHYFYBYHBNFAW-UPJWGTAASA-N 2 0 224.392 2.400 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)[C@@H]2C[C@H]2C2CC2)C1 ZINC000527639399 387649089 /nfs/dbraw/zinc/64/90/89/387649089.db2.gz CAKNMCPHBNGGHK-UXOAXIEHSA-N 2 0 236.403 2.352 20 0 BEADRP CC[C@H]([NH2+]C1CCCCC1)[C@@H]1CCC[NH2+]1 ZINC000422747019 387651332 /nfs/dbraw/zinc/65/13/32/387651332.db2.gz OXBYUVBWERDYMU-STQMWFEESA-N 2 0 210.365 2.439 20 0 BEADRP [NH3+][C@H]1CCCCC[C@H]1[NH2+]CCc1ccccc1 ZINC000422748879 387654152 /nfs/dbraw/zinc/65/41/52/387654152.db2.gz WOEOOLOKOBTHLC-LSDHHAIUSA-N 2 0 232.371 2.479 20 0 BEADRP CC[C@H]([NH2+]CCCCSC)[C@@H]1CCC[NH2+]1 ZINC000422749986 387655859 /nfs/dbraw/zinc/65/58/59/387655859.db2.gz BRDHQIBBNKGWDM-RYUDHWBXSA-N 2 0 230.421 2.250 20 0 BEADRP CSCCCC[NH2+][C@H]1CCCCC[C@@H]1[NH3+] ZINC000422754429 387658247 /nfs/dbraw/zinc/65/82/47/387658247.db2.gz JOTUEVUACKETMW-RYUDHWBXSA-N 2 0 230.421 2.379 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]1[NH2+]CCSc1ccccc1 ZINC000422756391 387661338 /nfs/dbraw/zinc/66/13/38/387661338.db2.gz CICKDKIUDCTSDV-STQMWFEESA-N 2 0 236.384 2.248 20 0 BEADRP Cc1ccc(C[C@@H](C)[NH2+][C@H](C)C2C[NH2+]C2)s1 ZINC000422757309 387661729 /nfs/dbraw/zinc/66/17/29/387661729.db2.gz HUZMYKBLTROEOF-MWLCHTKSSA-N 2 0 238.400 2.185 20 0 BEADRP C[C@@H]([NH2+]CCCNc1ccccc1)[C@@H]1CCC[NH2+]1 ZINC000422758687 387661883 /nfs/dbraw/zinc/66/18/83/387661883.db2.gz OFESJAAXBVYZGA-HIFRSBDPSA-N 2 0 247.386 2.219 20 0 BEADRP CCc1ccc(CC[N@@H+]2CC[C@@H]([NH3+])[C@@H](C)C2)cc1 ZINC000430953866 387662712 /nfs/dbraw/zinc/66/27/12/387662712.db2.gz DBSYYHOIQGLIPA-XJKSGUPXSA-N 2 0 246.398 2.461 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)[C@@H]1C[C@H]1C1CC1 ZINC000527656710 387662921 /nfs/dbraw/zinc/66/29/21/387662921.db2.gz JBDSYYVYTCHZHH-JURCDPSOSA-N 2 0 236.403 2.352 20 0 BEADRP C[C@H](CCC(C)(C)C)[NH2+][C@H](C)C1C[NH2+]C1 ZINC000422760531 387663763 /nfs/dbraw/zinc/66/37/63/387663763.db2.gz QFYSLEAESZJTTH-GHMZBOCLSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@@H]1CCC[C@H](C[NH2+][C@@H]2CCC[C@@H]2[NH3+])C1 ZINC000422765634 387665337 /nfs/dbraw/zinc/66/53/37/387665337.db2.gz QZNDPTWWBPRSIL-MROQNXINSA-N 2 0 210.365 2.282 20 0 BEADRP CC[C@H]([NH2+][C@H](C)C1C[NH2+]C1)c1ccc(OC)cc1 ZINC000422767442 387667653 /nfs/dbraw/zinc/66/76/53/387667653.db2.gz RBNHVCJLHNELPC-ABAIWWIYSA-N 2 0 248.370 2.344 20 0 BEADRP Cc1ccccc1C[NH2+][C@@H](C)C[C@@H](C)[NH3+] ZINC000422770622 387670017 /nfs/dbraw/zinc/67/00/17/387670017.db2.gz UYIRLGUQRYHJGZ-NEPJUHHUSA-N 2 0 206.333 2.210 20 0 BEADRP CC(C)OCCC[NH2+][C@H]1CCCCC[C@H]1[NH3+] ZINC000422773425 387670982 /nfs/dbraw/zinc/67/09/82/387670982.db2.gz ZVRPOTUNHNKTNS-OLZOCXBDSA-N 2 0 228.380 2.051 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CCOC1CCCCCC1 ZINC000422770002 387671206 /nfs/dbraw/zinc/67/12/06/387671206.db2.gz WCQSOUVFDBECCR-OLZOCXBDSA-N 2 0 242.407 2.441 20 0 BEADRP CC[C@@H]([NH2+][C@@H]1CCC[NH2+]CC1)c1ccncc1 ZINC000422775775 387672928 /nfs/dbraw/zinc/67/29/28/387672928.db2.gz CGXRBJLRVIKLMZ-ZIAGYGMSSA-N 2 0 233.359 2.264 20 0 BEADRP CCOc1cccc([C@H](C)[NH2+][C@@H](C)C2C[NH2+]C2)c1 ZINC000422779795 387677381 /nfs/dbraw/zinc/67/73/81/387677381.db2.gz JEGHBAIPTGEXME-RYUDHWBXSA-N 2 0 248.370 2.344 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]Cc1cccc2cccnc21 ZINC000422781215 387681503 /nfs/dbraw/zinc/68/15/03/387681503.db2.gz LDUSBSMSUQJFKN-NWDGAFQWSA-N 2 0 243.354 2.450 20 0 BEADRP CCOc1cccc([C@H](C)[NH2+]C2CC[NH2+]CC2)c1 ZINC000422786168 387685528 /nfs/dbraw/zinc/68/55/28/387685528.db2.gz SGXIYGBMHOVXQE-LBPRGKRZSA-N 2 0 248.370 2.488 20 0 BEADRP CC[C@H](F)CN(C)[C@@H]1CC[N@H+](CC)C[C@H]1C ZINC000440770707 387690831 /nfs/dbraw/zinc/69/08/31/387690831.db2.gz KSZSYUCCHGMPGZ-FRRDWIJNSA-N 2 0 230.371 2.397 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CCCOc1ccccc1 ZINC000422791265 387691843 /nfs/dbraw/zinc/69/18/43/387691843.db2.gz QBENKJURDASRPA-STQMWFEESA-N 2 0 236.359 2.171 20 0 BEADRP CC[C@@H]1CCC[C@H]([NH2+][C@@H](C)C2C[NH2+]C2)C1 ZINC000422792509 387692662 /nfs/dbraw/zinc/69/26/62/387692662.db2.gz XCWLPRWYHOQTSU-LOWVWBTDSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)CCOCC[NH2+][C@H]1CC[NH2+]CC[C@@H]1C ZINC000422790314 387693674 /nfs/dbraw/zinc/69/36/74/387693674.db2.gz XOWPPFYMDQJVOE-KBPBESRZSA-N 2 0 242.407 2.027 20 0 BEADRP Cc1ccc(OCCC[NH2+][C@H]2CCC[C@H]2[NH3+])cc1 ZINC000422860459 387744856 /nfs/dbraw/zinc/74/48/56/387744856.db2.gz MKBRHGMIVQSKFR-CABCVRRESA-N 2 0 248.370 2.233 20 0 BEADRP C[C@@H](Cc1cccs1)[NH2+][C@@H]1CC[NH2+][C@H](C)C1 ZINC000643525499 387747690 /nfs/dbraw/zinc/74/76/90/387747690.db2.gz YXOWWLGUEKBPKA-GRYCIOLGSA-N 2 0 238.400 2.409 20 0 BEADRP COc1cc(C)ccc1C[NH2+][C@@H](C)CCC[NH3+] ZINC000422871988 387750719 /nfs/dbraw/zinc/75/07/19/387750719.db2.gz FEOSBAJUDSSTAQ-LBPRGKRZSA-N 2 0 236.359 2.221 20 0 BEADRP C[C@]1(C[NH2+]C2CCC(C[NH3+])CC2)CCCS1 ZINC000422874143 387752672 /nfs/dbraw/zinc/75/26/72/387752672.db2.gz MZXQOGASJQKDRD-WXRRBKDZSA-N 2 0 242.432 2.379 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)[C@@H]1CC12CC2 ZINC000527846509 387753484 /nfs/dbraw/zinc/75/34/84/387753484.db2.gz FPKRAKOIHQRHSD-OBJOEFQTSA-N 2 0 234.387 2.249 20 0 BEADRP COc1cc(C)ccc1C[NH2+][C@H](C)C[C@@H](C)[NH3+] ZINC000422872783 387753571 /nfs/dbraw/zinc/75/35/71/387753571.db2.gz IPRFMBCYLIISRA-VXGBXAGGSA-N 2 0 236.359 2.219 20 0 BEADRP C[C@H](C[NH2+][C@H](C)[C@@H]1CC12CC2)C[NH+]1CCCC1 ZINC000527852498 387754052 /nfs/dbraw/zinc/75/40/52/387754052.db2.gz RHGMGTVKSALWHE-MCIONIFRSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H](C[NH2+][C@@H](C)[C@@H]1CC12CC2)C[NH+]1CCCC1 ZINC000527852502 387754841 /nfs/dbraw/zinc/75/48/41/387754841.db2.gz RHGMGTVKSALWHE-RDBSUJKOSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2CCC[C@H]2C1)C1C[NH2+]C1 ZINC000422796287 387699404 /nfs/dbraw/zinc/69/94/04/387699404.db2.gz YCHCPNNDFGWCME-ZJQBRPOHSA-N 2 0 222.376 2.153 20 0 BEADRP COCC[C@H](C)[NH2+]CCC[N@@H+]1CCCC[C@@H]1C ZINC000045017652 387700841 /nfs/dbraw/zinc/70/08/41/387700841.db2.gz XFELAOGTECLDIA-KBPBESRZSA-N 2 0 242.407 2.266 20 0 BEADRP COCC[C@H](C)[NH2+]CCC[N@@H+]1CCCC[C@H]1C ZINC000045017650 387701076 /nfs/dbraw/zinc/70/10/76/387701076.db2.gz XFELAOGTECLDIA-UONOGXRCSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CCCc2ccccc21)C1C[NH2+]C1 ZINC000422802591 387702821 /nfs/dbraw/zinc/70/28/21/387702821.db2.gz HNVVPNJICZFQMU-TZMCWYRMSA-N 2 0 244.382 2.304 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)[C@H]2CC23CC3)C1 ZINC000527849188 387755013 /nfs/dbraw/zinc/75/50/13/387755013.db2.gz KSDOVBIZQVIOMC-YNEHKIRRSA-N 2 0 222.376 2.106 20 0 BEADRP CCSCC[C@@H](C)[NH2+][C@@H](C)[C@@H]1CCC[NH2+]1 ZINC000422802557 387703288 /nfs/dbraw/zinc/70/32/88/387703288.db2.gz DQFCKCXPSBTGKL-WOPDTQHZSA-N 2 0 230.421 2.248 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]Cc1cc(F)cc(F)c1 ZINC000422807476 387706394 /nfs/dbraw/zinc/70/63/94/387706394.db2.gz PAHQJGGDCRNJCF-RKDXNWHRSA-N 2 0 228.286 2.180 20 0 BEADRP C[C@@H]([NH2+]CCC1CCCCC1)C1C[NH2+]C1 ZINC000422813950 387711315 /nfs/dbraw/zinc/71/13/15/387711315.db2.gz ZHXWNFVGQRITEM-LLVKDONJSA-N 2 0 210.365 2.154 20 0 BEADRP CCSCC[C@H](C)[NH2+][C@H](C)C[C@@H](C)[NH3+] ZINC000422812440 387712210 /nfs/dbraw/zinc/71/22/10/387712210.db2.gz WGEUAHVWEAPNGA-OUAUKWLOSA-N 2 0 218.410 2.234 20 0 BEADRP CCO[C@H](CC[NH2+][C@H](C)CCC[NH3+])C(C)C ZINC000422814595 387715082 /nfs/dbraw/zinc/71/50/82/387715082.db2.gz VOPKUWMZZUNAFB-CHWSQXEVSA-N 2 0 230.396 2.155 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CCc1cc(F)ccc1F ZINC000422819857 387717652 /nfs/dbraw/zinc/71/76/52/387717652.db2.gz JCSJIGZPZIAJMX-ZJUUUORDSA-N 2 0 242.313 2.223 20 0 BEADRP CC(C)Oc1ccc(C[NH2+][C@@H](C)C2C[NH2+]C2)cc1 ZINC000422823489 387720402 /nfs/dbraw/zinc/72/04/02/387720402.db2.gz DKBLGXHOYMZOMR-LBPRGKRZSA-N 2 0 248.370 2.171 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CCCOC1CCCC1 ZINC000422825797 387720674 /nfs/dbraw/zinc/72/06/74/387720674.db2.gz KJPIGZKWXWVWQM-CYBMUJFWSA-N 2 0 242.407 2.443 20 0 BEADRP C1CC([C@H]2CC[C@@H]2[NH2+][C@@H]2CCC[NH2+]CC2)C1 ZINC000643522878 387726042 /nfs/dbraw/zinc/72/60/42/387726042.db2.gz UFIVGUJALDAIKB-MCIONIFRSA-N 2 0 222.376 2.297 20 0 BEADRP COCc1cccc(C[NH2+][C@H](C)C[C@H](C)[NH3+])c1 ZINC000422879378 387755598 /nfs/dbraw/zinc/75/55/98/387755598.db2.gz KHUITWSUTCHGBV-NWDGAFQWSA-N 2 0 236.359 2.048 20 0 BEADRP Cc1cc(F)ccc1CC[NH2+][C@H]1CCC[C@H]1[NH3+] ZINC000422849227 387735512 /nfs/dbraw/zinc/73/55/12/387735512.db2.gz BPUVUJXOHIQSLQ-KGLIPLIRSA-N 2 0 236.334 2.146 20 0 BEADRP Cc1nccn1CC[N@H+]1CCC(F)(F)C[C@@H]1C ZINC000528774096 387735496 /nfs/dbraw/zinc/73/54/96/387735496.db2.gz SZDPWWDOKUJXSW-JTQLQIEISA-N 2 0 243.301 2.311 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@H]2CCCc3cccnc32)C1 ZINC000643524092 387736279 /nfs/dbraw/zinc/73/62/79/387736279.db2.gz HDHFVTKIZIWUNC-RDBSUJKOSA-N 2 0 245.370 2.319 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]C[C@H](C)N(C)c1ccccc1 ZINC000422854836 387738595 /nfs/dbraw/zinc/73/85/95/387738595.db2.gz DEJGPWOTURRERG-KBPBESRZSA-N 2 0 249.402 2.228 20 0 BEADRP Cc1ncc([C@H](C)[NH2+][C@H]2CCC[C@@H]([NH3+])C2)s1 ZINC000643524238 387738737 /nfs/dbraw/zinc/73/87/37/387738737.db2.gz XYZHHMVPZBYVNZ-GDPRMGEGSA-N 2 0 239.388 2.372 20 0 BEADRP CO[C@@H]1C[C@H]([NH2+][C@@H]2CCCCC[C@@H]2[NH3+])C1(C)C ZINC000422856062 387741421 /nfs/dbraw/zinc/74/14/21/387741421.db2.gz WMSLSBMXFVJWDQ-QNWHQSFQSA-N 2 0 240.391 2.050 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CCOc2ccccc21 ZINC000422889577 387762807 /nfs/dbraw/zinc/76/28/07/387762807.db2.gz PWJVVRKHZBJQGA-YUTCNCBUSA-N 2 0 246.354 2.022 20 0 BEADRP CO[C@H](C)[C@@H](C)[NH2+]C[C@@H](C)C[NH+]1CCCCC1 ZINC000129201044 387763196 /nfs/dbraw/zinc/76/31/96/387763196.db2.gz TWTNUQJEWRGBNN-MGPQQGTHSA-N 2 0 242.407 2.121 20 0 BEADRP CO[C@H](C)[C@H](C)[NH2+]C[C@@H](C)C[NH+]1CCCCC1 ZINC000129200601 387764201 /nfs/dbraw/zinc/76/42/01/387764201.db2.gz TWTNUQJEWRGBNN-HZSPNIEDSA-N 2 0 242.407 2.121 20 0 BEADRP CC(C)C1CCC([NH2+][C@@H](C)C2C[NH2+]C2)CC1 ZINC000422895402 387765081 /nfs/dbraw/zinc/76/50/81/387765081.db2.gz VWMAVIHSRKZVFO-DCBWTQNWSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@@H]([NH2+]CCN1CC[C@@H](C)C1)C1CCCC1 ZINC000309506218 387812003 /nfs/dbraw/zinc/81/20/03/387812003.db2.gz VZBOYDTZHKNVSZ-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP COc1ccc([C@H]2C[C@@H]2[C@@H](C)[NH2+]C[C@@H](C)[NH3+])cc1 ZINC000643527745 387767163 /nfs/dbraw/zinc/76/71/63/387767163.db2.gz RSAXOVKMPXNXKS-YIKOMLBNSA-N 2 0 248.370 2.124 20 0 BEADRP CSc1ccccc1C[C@@H](C)[NH2+]C[C@@H](C)[NH3+] ZINC000643527622 387767201 /nfs/dbraw/zinc/76/72/01/387767201.db2.gz PIDXUNXXONOWOX-GHMZBOCLSA-N 2 0 238.400 2.276 20 0 BEADRP C[C@H]([NH3+])C[NH2+][C@H]1CC[C@@H](Cc2ccccc2)C1 ZINC000643527701 387767786 /nfs/dbraw/zinc/76/77/86/387767786.db2.gz RFJWEQKFZFNMTM-QEJZJMRPSA-N 2 0 232.371 2.335 20 0 BEADRP CSc1ccccc1C[C@H](C)[NH2+]C[C@H](C)[NH3+] ZINC000643527624 387768538 /nfs/dbraw/zinc/76/85/38/387768538.db2.gz PIDXUNXXONOWOX-QWRGUYRKSA-N 2 0 238.400 2.276 20 0 BEADRP C[C@H]([NH2+]CC(C)(C)Cc1ccccc1)C1C[NH2+]C1 ZINC000422910984 387768666 /nfs/dbraw/zinc/76/86/66/387768666.db2.gz JSBRTOFICGOXQO-ZDUSSCGKSA-N 2 0 246.398 2.453 20 0 BEADRP Cc1cccc(C[C@@H]([NH2+]C[C@@H](C)[NH3+])C2CC2)c1 ZINC000643528658 387769183 /nfs/dbraw/zinc/76/91/83/387769183.db2.gz MORVMGXQTJWMLT-IUODEOHRSA-N 2 0 232.371 2.253 20 0 BEADRP C[C@H]([NH3+])C[NH2+][C@@H](C)CCc1cccc(F)c1 ZINC000643528557 387770384 /nfs/dbraw/zinc/77/03/84/387770384.db2.gz LJPLUEOYCJDFLM-QWRGUYRKSA-N 2 0 224.323 2.084 20 0 BEADRP CC(C)[C@@H](Cc1ccc(F)cc1)[NH2+]C[C@H](C)[NH3+] ZINC000643528962 387772328 /nfs/dbraw/zinc/77/23/28/387772328.db2.gz RUJFKFLRNAUNRS-SMDDNHRTSA-N 2 0 238.350 2.330 20 0 BEADRP Cc1ccc(C[C@@H]([NH2+]C[C@H](C)[NH3+])C2CC2)cc1 ZINC000643529063 387772701 /nfs/dbraw/zinc/77/27/01/387772701.db2.gz UFPJBUFHJLDTCJ-SWLSCSKDSA-N 2 0 232.371 2.253 20 0 BEADRP CCC[C@@H](Cc1ccccc1)[NH2+]C[C@@H](C)[NH3+] ZINC000643529321 387776441 /nfs/dbraw/zinc/77/64/41/387776441.db2.gz YNLWHDNZFRAJMI-OCCSQVGLSA-N 2 0 220.360 2.335 20 0 BEADRP C[C@@H]([NH3+])C[NH2+][C@@H](C)Cc1coc2ccccc12 ZINC000643529894 387776462 /nfs/dbraw/zinc/77/64/62/387776462.db2.gz UNBWQVUENFEBQN-MNOVXSKESA-N 2 0 232.327 2.301 20 0 BEADRP C[C@@H]([NH3+])C[NH2+]C1CCC(OC2CCCC2)CC1 ZINC000643529645 387776918 /nfs/dbraw/zinc/77/69/18/387776918.db2.gz IUASJOWAFASXBW-LKSINWNRSA-N 2 0 240.391 2.194 20 0 BEADRP CC(C)[C@H]1OCCC[C@@H]1C[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000422922008 387777243 /nfs/dbraw/zinc/77/72/43/387777243.db2.gz RPDWTFKZEJJSEC-IGQOVBAYSA-N 2 0 242.407 2.153 20 0 BEADRP C[C@H]([NH3+])[C@@H](Cc1ccccc1)[NH2+]CC1(C)CC1 ZINC000422922147 387777754 /nfs/dbraw/zinc/77/77/54/387777754.db2.gz SCHLNKVVWGXRFM-GXTWGEPZSA-N 2 0 232.371 2.335 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H]1C[C@@H]1Cc1ccccc1 ZINC000422926848 387780075 /nfs/dbraw/zinc/78/00/75/387780075.db2.gz XQNHMEKAABQLTK-VHDGCEQUSA-N 2 0 232.371 2.335 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CC2CC=CC2)CC[N@@H+]1C ZINC000527945547 387781443 /nfs/dbraw/zinc/78/14/43/387781443.db2.gz SGIYLIYGBRAERS-AAEUAGOBSA-N 2 0 208.349 2.025 20 0 BEADRP COc1ccc(C[NH2+][C@@H](C)C[C@@H](C)[NH3+])cc1F ZINC000422937250 387783366 /nfs/dbraw/zinc/78/33/66/387783366.db2.gz JCLZLVWXNBNFRK-ZJUUUORDSA-N 2 0 240.322 2.050 20 0 BEADRP Cc1cc(C)cc(OCC[NH2+][C@@H]2CCC[C@@H]2[NH3+])c1 ZINC000422944360 387785803 /nfs/dbraw/zinc/78/58/03/387785803.db2.gz MBRHIDDFTPBZSP-LSDHHAIUSA-N 2 0 248.370 2.152 20 0 BEADRP Cc1ccccc1OCC[NH2+][C@@H](C)C[C@@H](C)[NH3+] ZINC000422944478 387786407 /nfs/dbraw/zinc/78/64/07/387786407.db2.gz MHXPAWOGHSUCNM-OLZOCXBDSA-N 2 0 236.359 2.089 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]C[C@H]1CCc2ccccc21 ZINC000422902098 387787298 /nfs/dbraw/zinc/78/72/98/387787298.db2.gz CXMONUHMHACGSC-GXTWGEPZSA-N 2 0 232.371 2.433 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]C[C@H]2CCCCO2)CC1 ZINC000049855612 387787415 /nfs/dbraw/zinc/78/74/15/387787415.db2.gz UCDIPXJALMTJQU-CQSZACIVSA-N 2 0 240.391 2.018 20 0 BEADRP CCC(CC)[NH2+]CCCN1CCCO[C@@H](C)C1 ZINC000432423227 387788069 /nfs/dbraw/zinc/78/80/69/387788069.db2.gz IXVBDLDWHWWQAB-ZDUSSCGKSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@H](C[NH2+][C@@H](C)C[C@H](C)[NH3+])Oc1ccccc1 ZINC000422980907 387792030 /nfs/dbraw/zinc/79/20/30/387792030.db2.gz MRKACFCMAKKCQA-RWMBFGLXSA-N 2 0 236.359 2.169 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]C/C=C/c1ccccc1 ZINC000422980453 387792274 /nfs/dbraw/zinc/79/22/74/387792274.db2.gz PSGKUIVSOSAOPB-BNDLJXMOSA-N 2 0 218.344 2.415 20 0 BEADRP Cc1ccc(CC[NH2+][C@H](C)C[C@@H](C)[NH3+])cc1 ZINC000422983690 387792982 /nfs/dbraw/zinc/79/29/82/387792982.db2.gz UOAOYCHECGCDAX-CHWSQXEVSA-N 2 0 220.360 2.253 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H](C)Cc1ccc(O)cc1 ZINC000422982960 387794001 /nfs/dbraw/zinc/79/40/01/387794001.db2.gz YHIQSLKAFJNKEN-SRVKXCTJSA-N 2 0 236.359 2.039 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+][C@@H]1CCCC(F)(F)C1 ZINC000422986617 387796753 /nfs/dbraw/zinc/79/67/53/387796753.db2.gz CWTQPLXCCOXENH-OPRDCNLKSA-N 2 0 218.291 2.034 20 0 BEADRP CCN(CCC[NH+](C)C)c1cc[nH+]cc1C ZINC000425249210 387797899 /nfs/dbraw/zinc/79/78/99/387797899.db2.gz AXGFPFOFQDNQKM-UHFFFAOYSA-N 2 0 221.348 2.168 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]C[C@H]1[C@@H]2c3ccccc3C[C@H]12 ZINC000422988956 387798262 /nfs/dbraw/zinc/79/82/62/387798262.db2.gz JZXMIVSCSSUJLC-DGXTUMSLSA-N 2 0 242.366 2.042 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]C[C@H]1[C@@H]2c3ccccc3C[C@H]12 ZINC000422987856 387798311 /nfs/dbraw/zinc/79/83/11/387798311.db2.gz HNXZHHOZCZHIGK-RAEVTNRLSA-N 2 0 244.382 2.289 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]CC1(Cc2ccccc2)CC1 ZINC000422991280 387801191 /nfs/dbraw/zinc/80/11/91/387801191.db2.gz ASQGUNJLCSAEBL-HUUCEWRRSA-N 2 0 244.382 2.479 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+][C@H]1CCCC(F)(F)C1 ZINC000422995789 387801567 /nfs/dbraw/zinc/80/15/67/387801567.db2.gz ZEUSMBDFXHKKBQ-GARJFASQSA-N 2 0 232.318 2.281 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]C[C@H]1CCc2ccccc2C1 ZINC000643478045 387802283 /nfs/dbraw/zinc/80/22/83/387802283.db2.gz PURWDMFUIIFXDD-APHBMKBZSA-N 2 0 244.382 2.261 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H](C)[C@@H]1COc2ccccc21 ZINC000422997761 387802851 /nfs/dbraw/zinc/80/28/51/387802851.db2.gz BVSNBXOSJCIWQY-BZPMIXESSA-N 2 0 248.370 2.268 20 0 BEADRP COc1cc(C)cc(C[NH2+][C@@H]2CCC[C@H]2C[NH3+])c1 ZINC000423001381 387805721 /nfs/dbraw/zinc/80/57/21/387805721.db2.gz IBGOSYUQRCLNAX-DZGCQCFKSA-N 2 0 248.370 2.221 20 0 BEADRP COc1cc(C)cc(C[NH2+][C@H]2CCC[C@H]2C[NH3+])c1 ZINC000423001384 387806040 /nfs/dbraw/zinc/80/60/40/387806040.db2.gz IBGOSYUQRCLNAX-ZFWWWQNUSA-N 2 0 248.370 2.221 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CC1(C)C)[C@@H]1CCCC[NH2+]1 ZINC000422954776 387809711 /nfs/dbraw/zinc/80/97/11/387809711.db2.gz JQHZTZLVKPOQFY-WOPDTQHZSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CCc1cccc(F)c1F ZINC000422961015 387811286 /nfs/dbraw/zinc/81/12/86/387811286.db2.gz YDRJDAAVLFPSGC-UWVGGRQHSA-N 2 0 242.313 2.223 20 0 BEADRP Cc1ccccc1C[C@H]([NH2+]C[C@@H](C)[NH3+])C1CC1 ZINC000643526676 387756740 /nfs/dbraw/zinc/75/67/40/387756740.db2.gz DRVAAQSQCCPPOU-DOMZBBRYSA-N 2 0 232.371 2.253 20 0 BEADRP CC[C@H](NC[C@H](C)[NH3+])c1ccccc1F ZINC000643527837 387757965 /nfs/dbraw/zinc/75/79/65/387757965.db2.gz UAHBLUQFLRYAMA-CABZTGNLSA-N 2 0 210.296 2.214 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+]C[C@H](C)[NH3+])[C@H](C)C2 ZINC000643526608 387758399 /nfs/dbraw/zinc/75/83/99/387758399.db2.gz CCGUSYWKKQWRJA-UHIISALHSA-N 2 0 218.344 2.165 20 0 BEADRP CC[C@@H](NC[C@@H](C)[NH3+])c1ccccc1F ZINC000643527836 387758635 /nfs/dbraw/zinc/75/86/35/387758635.db2.gz UAHBLUQFLRYAMA-BXKDBHETSA-N 2 0 210.296 2.214 20 0 BEADRP COc1cccc2c1CC[C@@H]2[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000422888909 387759267 /nfs/dbraw/zinc/75/92/67/387759267.db2.gz OGVQRTPEQZTOCX-MJVIPROJSA-N 2 0 248.370 2.398 20 0 BEADRP Cc1nc(C)c(CC[NH2+][C@@H](C)C[C@@H](C)[NH3+])s1 ZINC000422885574 387759636 /nfs/dbraw/zinc/75/96/36/387759636.db2.gz HAWHDSGJYLVQTN-BDAKNGLRSA-N 2 0 241.404 2.018 20 0 BEADRP C[C@H]([NH2+]CC1CC[NH+](C)CC1)[C@H]1CC12CC2 ZINC000527859684 387759784 /nfs/dbraw/zinc/75/97/84/387759784.db2.gz RJTBKIMNXNDCJK-WCQYABFASA-N 2 0 222.376 2.106 20 0 BEADRP C[C@@H]([NH2+]CC1CC[NH+](C)CC1)[C@@H]1CC12CC2 ZINC000527859686 387759879 /nfs/dbraw/zinc/75/98/79/387759879.db2.gz RJTBKIMNXNDCJK-YPMHNXCESA-N 2 0 222.376 2.106 20 0 BEADRP Cc1nc(C)c(CC[NH2+][C@@H](C)CCC[NH3+])s1 ZINC000422888718 387760205 /nfs/dbraw/zinc/76/02/05/387760205.db2.gz NPDJNCAGBONMAI-VIFPVBQESA-N 2 0 241.404 2.019 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CC=CCC1)[C@@H]1CCCC[NH2+]1 ZINC000422972944 387821619 /nfs/dbraw/zinc/82/16/19/387821619.db2.gz NDNOJVJOBZDDPZ-MCIONIFRSA-N 2 0 222.376 2.463 20 0 BEADRP C[C@@H]([NH2+]CCCCc1ccccc1)C1C[NH2+]C1 ZINC000643458231 387822486 /nfs/dbraw/zinc/82/24/86/387822486.db2.gz CBBFINYKQZEZDB-CYBMUJFWSA-N 2 0 232.371 2.207 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CCC[C@@H]([NH+](C)C)CC1 ZINC000432796994 387823912 /nfs/dbraw/zinc/82/39/12/387823912.db2.gz JMJIMIQSQHVICG-JHJVBQTASA-N 2 0 210.365 2.059 20 0 BEADRP C[C@@H]([NH2+]CC1CCC(C)CC1)C1C[NH2+]C1 ZINC000422974680 387824256 /nfs/dbraw/zinc/82/42/56/387824256.db2.gz RQJQUJJKLVEXQC-MOENNCHZSA-N 2 0 210.365 2.010 20 0 BEADRP CCCC[C@H]([NH3+])C(=O)Nc1ccc([C@@H](C)[NH3+])cc1 ZINC000442722568 387829057 /nfs/dbraw/zinc/82/90/57/387829057.db2.gz XQEBQPKIZJUNTH-MFKMUULPSA-N 2 0 249.358 2.162 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@H](CCO)C1CCCCC1 ZINC000423007812 387831297 /nfs/dbraw/zinc/83/12/97/387831297.db2.gz RTEQIWBTLPITRT-SGMGOOAPSA-N 2 0 242.407 2.033 20 0 BEADRP CC[C@@H](C)[C@H]([NH3+])C(=O)Nc1ccc([C@@H](C)[NH3+])cc1 ZINC000442732058 387831509 /nfs/dbraw/zinc/83/15/09/387831509.db2.gz USDHWQPKHDGZCK-BREBYQMCSA-N 2 0 249.358 2.018 20 0 BEADRP CC[C@@H]([NH2+][C@H](C)CCC[NH3+])c1c(C)noc1C ZINC000423008798 387831585 /nfs/dbraw/zinc/83/15/85/387831585.db2.gz BBKNEUUMDRWASB-BXKDBHETSA-N 2 0 239.363 2.460 20 0 BEADRP CC[C@H]([NH2+][C@@H](C)CCC[NH3+])c1c(C)noc1C ZINC000423008799 387831989 /nfs/dbraw/zinc/83/19/89/387831989.db2.gz BBKNEUUMDRWASB-CABZTGNLSA-N 2 0 239.363 2.460 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]CC12CCC(CC1)C2 ZINC000423011495 387833046 /nfs/dbraw/zinc/83/30/46/387833046.db2.gz IXEBCGRZMQVUEW-QPPOZKHWSA-N 2 0 222.376 2.284 20 0 BEADRP C[C@H]([NH2+][C@@H](c1cccnc1)C1CC1)[C@@H]1CC[NH2+]C1 ZINC000423009477 387833932 /nfs/dbraw/zinc/83/39/32/387833932.db2.gz CXWMAHPTRNOXPI-NJZAAPMLSA-N 2 0 245.370 2.120 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000423010131 387833960 /nfs/dbraw/zinc/83/39/60/387833960.db2.gz XDGYIZOOUBFTJT-BKQLOGFTSA-N 2 0 234.343 2.083 20 0 BEADRP CC(C)CSCC[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000423012170 387835787 /nfs/dbraw/zinc/83/57/87/387835787.db2.gz KEPWUQMNBSBKCT-QWRGUYRKSA-N 2 0 218.410 2.091 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@@H](c1cccnc1)C1CC1 ZINC000423011998 387835830 /nfs/dbraw/zinc/83/58/30/387835830.db2.gz JXHZEORHWGZIQK-MISXGVKJSA-N 2 0 233.359 2.248 20 0 BEADRP CC(C)CSCC[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000423013128 387835867 /nfs/dbraw/zinc/83/58/67/387835867.db2.gz MDJQOVQFYNUZFG-FUNVUKJBSA-N 2 0 242.432 2.248 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]C1CCC(F)(F)CC1 ZINC000423015259 387838307 /nfs/dbraw/zinc/83/83/07/387838307.db2.gz QOQQNVUDZJXWSN-RKDXNWHRSA-N 2 0 220.307 2.280 20 0 BEADRP Cc1cnccc1CC[NH2+][C@@H]1CCCCC[C@@H]1[NH3+] ZINC000423016238 387838640 /nfs/dbraw/zinc/83/86/40/387838640.db2.gz SKRYVDXFQVOXOG-LSDHHAIUSA-N 3 0 247.386 2.182 20 0 BEADRP CC[C@H]([NH2+][C@H]1CC1(C)C)[C@@H]1CCCC[NH2+]1 ZINC000423027123 387843452 /nfs/dbraw/zinc/84/34/52/387843452.db2.gz OHZLVFQWMIGWAH-SRVKXCTJSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]C[C@H]1CCCCS1 ZINC000423029074 387845810 /nfs/dbraw/zinc/84/58/10/387845810.db2.gz HPCLHZDZBVWAPZ-JHJVBQTASA-N 2 0 242.432 2.250 20 0 BEADRP CC(C)(C)[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@H]2[NH3+])CCO1 ZINC000423031269 387846689 /nfs/dbraw/zinc/84/66/89/387846689.db2.gz WXPUKOQJWPPIRE-NDBYEHHHSA-N 2 0 240.391 2.050 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]CCC[C@H]1CCCCO1 ZINC000423029444 387846910 /nfs/dbraw/zinc/84/69/10/387846910.db2.gz AHTMFABTBLGJMZ-BFHYXJOUSA-N 2 0 240.391 2.053 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CCCCS1)[C@@H]1CCC[NH2+]1 ZINC000423033994 387849140 /nfs/dbraw/zinc/84/91/40/387849140.db2.gz PJEGXYYHGNLUOP-UTUOFQBUSA-N 2 0 228.405 2.002 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CCC[C@@H]1CCCCO1 ZINC000423035475 387850649 /nfs/dbraw/zinc/85/06/49/387850649.db2.gz JOCURWWEOUFBHA-XQQFMLRXSA-N 2 0 228.380 2.051 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H]1CCCCS1)[C@@H]1CCC[NH2+]1 ZINC000423036429 387850730 /nfs/dbraw/zinc/85/07/30/387850730.db2.gz UAAPQRJVKWAGKM-XQQFMLRXSA-N 2 0 242.432 2.392 20 0 BEADRP CC[C@H](CC(F)(F)F)[NH2+][C@H](C)CCC[NH3+] ZINC000423035405 387850837 /nfs/dbraw/zinc/85/08/37/387850837.db2.gz JHZWKDZEGOXULS-RKDXNWHRSA-N 2 0 226.286 2.434 20 0 BEADRP COCC[C@H]([NH2+][C@H](C)C[C@@H](C)[NH3+])c1ccco1 ZINC000423036352 387851055 /nfs/dbraw/zinc/85/10/55/387851055.db2.gz ANHGZSNAPWATAD-UTUOFQBUSA-N 2 0 240.347 2.073 20 0 BEADRP COCCC(C)(C)C[NH2+][C@H]1CCCCC[C@@H]1[NH3+] ZINC000423035712 387851378 /nfs/dbraw/zinc/85/13/78/387851378.db2.gz JTMZRWIJHNPWBT-STQMWFEESA-N 2 0 242.407 2.299 20 0 BEADRP Cc1csc([C@H](C)C[NH2+][C@H](C)C[C@@H](C)[NH3+])n1 ZINC000423039552 387852560 /nfs/dbraw/zinc/85/25/60/387852560.db2.gz QUVXAFZXXVNLNE-OPRDCNLKSA-N 2 0 241.404 2.270 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CCCCO1)[C@H]1CCCC[NH2+]1 ZINC000423039217 387852589 /nfs/dbraw/zinc/85/25/89/387852589.db2.gz DZGDQUWOSNSQHS-MGPQQGTHSA-N 2 0 240.391 2.066 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@@H](C)c1ccncc1 ZINC000643460231 387874251 /nfs/dbraw/zinc/87/42/51/387874251.db2.gz DAHTXFAIXIVOGK-CHWSQXEVSA-N 2 0 235.375 2.292 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CC[C@H]1CCO[C@H](C)C1 ZINC000423038975 387852739 /nfs/dbraw/zinc/85/27/39/387852739.db2.gz ZKDIGCRTWLNLFW-MCIONIFRSA-N 2 0 242.407 2.299 20 0 BEADRP COC1CCC(CC[NH2+][C@H]2CCC[C@@H]2[NH3+])CC1 ZINC000423039515 387853806 /nfs/dbraw/zinc/85/38/06/387853806.db2.gz QORPWIHMWBKOFR-HOAMVYINSA-N 2 0 240.391 2.051 20 0 BEADRP CS[C@H](C[NH2+][C@H](C)CCC[NH3+])C(C)(C)C ZINC000423038682 387853828 /nfs/dbraw/zinc/85/38/28/387853828.db2.gz YZHHXXKWHIBYRK-GHMZBOCLSA-N 2 0 232.437 2.481 20 0 BEADRP COC1CCC(CC[NH2+][C@H]2CCC[C@H]2[NH3+])CC1 ZINC000423039517 387853926 /nfs/dbraw/zinc/85/39/26/387853926.db2.gz QORPWIHMWBKOFR-PQAZSJQKSA-N 2 0 240.391 2.051 20 0 BEADRP Cc1csc([C@H](C)C[NH2+][C@@H](C)C[C@H](C)[NH3+])n1 ZINC000423039553 387854019 /nfs/dbraw/zinc/85/40/19/387854019.db2.gz QUVXAFZXXVNLNE-UTLUCORTSA-N 2 0 241.404 2.270 20 0 BEADRP CC(C)C[C@@H]1OCCC[C@@H]1[NH2+][C@@H](C)C[C@@H](C)[NH3+] ZINC000423047225 387857510 /nfs/dbraw/zinc/85/75/10/387857510.db2.gz FWGQGJZBAYYADF-RFGFWPKPSA-N 2 0 242.407 2.296 20 0 BEADRP CC(C)C[C@@H]1C[C@H]([NH2+][C@H](C)C[C@@H](C)[NH3+])CCO1 ZINC000423046267 387857597 /nfs/dbraw/zinc/85/75/97/387857597.db2.gz TUQKOTXIRCUDFT-AAVRWANBSA-N 2 0 242.407 2.296 20 0 BEADRP CCC(O)(CC)CC[NH2+][C@H](C)CCCC[NH3+] ZINC000423075210 387874326 /nfs/dbraw/zinc/87/43/26/387874326.db2.gz WHCJCHXJWYWCAR-GFCCVEGCSA-N 2 0 230.396 2.035 20 0 BEADRP C1[C@@H]([NH2+][C@H]2CCC23CCCC3)C12CC[NH2+]CC2 ZINC000643534687 387859827 /nfs/dbraw/zinc/85/98/27/387859827.db2.gz ABRJHRYVSVZOKZ-QWHCGFSZSA-N 2 0 234.387 2.441 20 0 BEADRP C[C@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1cncc(F)c1 ZINC000643534755 387860602 /nfs/dbraw/zinc/86/06/02/387860602.db2.gz CHOPXEQYJQEBHT-GWCFXTLKSA-N 2 0 249.333 2.013 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCC[C@@H](C)CC1)C1C[NH2+]C1 ZINC000423059926 387864174 /nfs/dbraw/zinc/86/41/74/387864174.db2.gz NFDZTTAOEFXORV-NQBHXWOUSA-N 2 0 210.365 2.153 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+][C@H]2CCCC[C@@H]2O)c2ccccc21 ZINC000423060605 387864367 /nfs/dbraw/zinc/86/43/67/387864367.db2.gz IOQNHHSXIVDSAY-XQLPTFJDSA-N 2 0 246.354 2.024 20 0 BEADRP C[C@H]([NH2+][C@H]1CC12CC[NH2+]CC2)[C@H]1CC1(C)C ZINC000643536038 387865833 /nfs/dbraw/zinc/86/58/33/387865833.db2.gz MHZJJEFYTYBIGX-TUAOUCFPSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)[C@@H]1CC1(C)C ZINC000643536036 387865916 /nfs/dbraw/zinc/86/59/16/387865916.db2.gz MHZJJEFYTYBIGX-SDDRHHMPSA-N 2 0 222.376 2.153 20 0 BEADRP CC[C@H]([NH2+][C@H]1CC[C@@H](C)C1)[C@@H]1CCC[NH2+]1 ZINC000423062023 387867696 /nfs/dbraw/zinc/86/76/96/387867696.db2.gz MCRDBOLXOMYKBQ-VOAKCMCISA-N 2 0 210.365 2.295 20 0 BEADRP CC(C)[C@H]([NH2+][C@H]1CC12CC[NH2+]CC2)C1CC1 ZINC000643536171 387868046 /nfs/dbraw/zinc/86/80/46/387868046.db2.gz RZSVDKBUFWMUBJ-STQMWFEESA-N 2 0 222.376 2.153 20 0 BEADRP CC(C)C1CC([NH2+][C@H]2CCC[C@@H]2C[NH3+])C1 ZINC000423067847 387869802 /nfs/dbraw/zinc/86/98/02/387869802.db2.gz AHQREBRYQCPVSP-XVSSEFHLSA-N 2 0 210.365 2.138 20 0 BEADRP CCC(O)(CC)CC[NH2+][C@H]1CCCCC[C@H]1[NH3+] ZINC000423065801 387869855 /nfs/dbraw/zinc/86/98/55/387869855.db2.gz CMMCAQKADDCQRT-OLZOCXBDSA-N 2 0 242.407 2.177 20 0 BEADRP CCC(O)(CC)CC[NH2+][C@@H]1CCCCC[C@H]1[NH3+] ZINC000423065800 387869988 /nfs/dbraw/zinc/86/99/88/387869988.db2.gz CMMCAQKADDCQRT-CHWSQXEVSA-N 2 0 242.407 2.177 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]C[C@@](C)(O)C1CCCCC1 ZINC000423072306 387871425 /nfs/dbraw/zinc/87/14/25/387871425.db2.gz JCPPQCIPZGFPGW-TZMCWYRMSA-N 2 0 242.407 2.035 20 0 BEADRP CCOC1CC(CC[NH2+][C@H](C)CCCC[NH3+])C1 ZINC000423072183 387872346 /nfs/dbraw/zinc/87/23/46/387872346.db2.gz PHKUDQARBIWUNE-IYXRBSQSSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@@H]([NH2+]C1CC(c2ccccc2)C1)C1C[NH2+]C1 ZINC000422967319 387816590 /nfs/dbraw/zinc/81/65/90/387816590.db2.gz OXHLIPJOIHVFCD-NUYPLMSZSA-N 2 0 230.355 2.130 20 0 BEADRP C[C@@H]([NH2+]CC1(Cc2ccccc2)CC1)C1C[NH2+]C1 ZINC000423002727 387819171 /nfs/dbraw/zinc/81/91/71/387819171.db2.gz ZJSPGKPOIDWHNN-CYBMUJFWSA-N 2 0 244.382 2.207 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+][C@@H]1CCCCC[C@@H]1[NH3+] ZINC000423104993 387890622 /nfs/dbraw/zinc/89/06/22/387890622.db2.gz HZAVXWHTTMXIKV-TUAOUCFPSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CCc1cccc2[nH]ccc21 ZINC000423105163 387890779 /nfs/dbraw/zinc/89/07/79/387890779.db2.gz CAKKGNDGJDSLCI-RYUDHWBXSA-N 2 0 245.370 2.426 20 0 BEADRP Cc1cc([C@@H](C)[NH2+][C@@H](C)CCCC[NH3+])no1 ZINC000423105765 387891101 /nfs/dbraw/zinc/89/11/01/387891101.db2.gz CKEOWQAIBZONSW-GXSJLCMTSA-N 2 0 225.336 2.151 20 0 BEADRP COCC[C@@H]([NH2+][C@@H](C)[C@H]1CCC[NH2+]1)C(C)(C)C ZINC000423105914 387891134 /nfs/dbraw/zinc/89/11/34/387891134.db2.gz CRCMPFXSYHMATJ-YNEHKIRRSA-N 2 0 242.407 2.168 20 0 BEADRP COCC[C@H]([NH2+][C@H](C)[C@@H]1CCC[NH2+]1)C(C)(C)C ZINC000423105906 387892021 /nfs/dbraw/zinc/89/20/21/387892021.db2.gz CRCMPFXSYHMATJ-AGIUHOORSA-N 2 0 242.407 2.168 20 0 BEADRP CC[NH+](CC)CCCSCC[NH+](C)C ZINC000194551625 387892323 /nfs/dbraw/zinc/89/23/23/387892323.db2.gz TVKSOKNITVFINO-UHFFFAOYSA-N 2 0 218.410 2.013 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000423113486 387896983 /nfs/dbraw/zinc/89/69/83/387896983.db2.gz UISSOWCPIUNGAP-MBYGNEARSA-N 2 0 208.349 2.048 20 0 BEADRP CCCNc1ccc(C[NH2+][C@@H]2CCC[C@H]2[NH3+])cc1 ZINC000423073476 387874982 /nfs/dbraw/zinc/87/49/82/387874982.db2.gz ITFBOAINROSKPA-HUUCEWRRSA-N 2 0 247.386 2.478 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCN(C)[C@H](C)C1)[C@H]1C[C@@H]1C ZINC000322068560 387875529 /nfs/dbraw/zinc/87/55/29/387875529.db2.gz SECLLWXUOXFXOR-ZSLBOAEBSA-N 2 0 224.392 2.493 20 0 BEADRP CC(C)C1CC([NH2+][C@@H](C)[C@@H]2CCC[NH2+]C2)C1 ZINC000423077638 387875785 /nfs/dbraw/zinc/87/57/85/387875785.db2.gz MLQRICWFRCOTRN-MRFVTOPCSA-N 2 0 224.392 2.399 20 0 BEADRP C1[C@H]([NH2+][C@@H]2CC[C@H]2C2CCC2)C12CC[NH2+]CC2 ZINC000643536867 387876458 /nfs/dbraw/zinc/87/64/58/387876458.db2.gz XBSLULVLLJWNOI-MJBXVCDLSA-N 2 0 234.387 2.297 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC12CCCC2)[C@@H]1CCC[NH2+]1 ZINC000423075876 387877374 /nfs/dbraw/zinc/87/73/74/387877374.db2.gz PORCEYPISZYIFH-AVGNSLFASA-N 2 0 222.376 2.439 20 0 BEADRP FC(F)[C@H]1C[C@@H]1[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000423116078 387898414 /nfs/dbraw/zinc/89/84/14/387898414.db2.gz ZKTSEQGCBFSHDM-NGDQXYMTSA-N 2 0 244.329 2.150 20 0 BEADRP C[C@@H]([NH2+]Cc1ccc(C2CC2)cc1)C1C[NH2+]C1 ZINC000423081789 387877801 /nfs/dbraw/zinc/87/78/01/387877801.db2.gz VOIHWQLLWSWLJD-LLVKDONJSA-N 2 0 230.355 2.262 20 0 BEADRP C[C@H]([NH2+]CC1(C)CCC(C)CC1)C1C[NH2+]C1 ZINC000423082571 387878159 /nfs/dbraw/zinc/87/81/59/387878159.db2.gz DLTVAHQCUCZIBV-LXVYMNJGSA-N 2 0 224.392 2.400 20 0 BEADRP CC1(CC[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)CC1 ZINC000423082080 387878658 /nfs/dbraw/zinc/87/86/58/387878658.db2.gz CLCWDOFVXZBITN-FOSCPWQOSA-N 2 0 208.349 2.049 20 0 BEADRP CC1(CC[NH2+][C@H]2CCCCC[C@@H]2[NH3+])CC1 ZINC000423084725 387878684 /nfs/dbraw/zinc/87/86/84/387878684.db2.gz IQBRHWVEJROOBO-RYUDHWBXSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCCc2ccccc2C1)[C@H](C)[NH3+] ZINC000643540102 387880784 /nfs/dbraw/zinc/88/07/84/387880784.db2.gz JJHHWYYPBYVTBC-YWPYICTPSA-N 2 0 232.371 2.259 20 0 BEADRP CC[C@H](Cc1cccs1)[NH2+][C@@H](C)[C@@H](C)[NH3+] ZINC000643539945 387880924 /nfs/dbraw/zinc/88/09/24/387880924.db2.gz YEJBDATZTGDBQM-OUAUKWLOSA-N 2 0 226.389 2.395 20 0 BEADRP CC[C@H](Cc1cccs1)[NH2+][C@@H](C)[C@H](C)[NH3+] ZINC000643539942 387881968 /nfs/dbraw/zinc/88/19/68/387881968.db2.gz YEJBDATZTGDBQM-GARJFASQSA-N 2 0 226.389 2.395 20 0 BEADRP C[C@H]([NH3+])[C@H](C)[NH2+][C@H]1CCCc2ccccc2C1 ZINC000643540100 387882193 /nfs/dbraw/zinc/88/21/93/387882193.db2.gz JJHHWYYPBYVTBC-HUBLWGQQSA-N 2 0 232.371 2.259 20 0 BEADRP C[C@H]([NH2+][C@H]1C[C@H](c2cccc(F)c2)C1)C1C[NH2+]C1 ZINC000423092382 387883002 /nfs/dbraw/zinc/88/30/02/387883002.db2.gz BRTRFWNZECHZAJ-WBIUFABUSA-N 2 0 248.345 2.269 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H]1C1CC1)[C@@H]1CCC[NH2+]C1 ZINC000423092753 387883206 /nfs/dbraw/zinc/88/32/06/387883206.db2.gz DHAXNBNCIJTJHK-IGHBBLSQSA-N 2 0 222.376 2.153 20 0 BEADRP CC[C@H]([NH2+]CC1(SC)CC1)[C@@H]1CCC[NH2+]1 ZINC000423091638 387883405 /nfs/dbraw/zinc/88/34/05/387883405.db2.gz YACOPLQBJZDRKL-QWRGUYRKSA-N 2 0 228.405 2.002 20 0 BEADRP COC1CCC(C)(C[NH2+][C@H](C)C[C@@H](C)[NH3+])CC1 ZINC000423089826 387883615 /nfs/dbraw/zinc/88/36/15/387883615.db2.gz WDTFONJYSSFSDF-IWMBGFJWSA-N 2 0 242.407 2.297 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]CC[C@@H]1C[C@@H](C)O[C@@H](C)C1 ZINC000423116315 387898588 /nfs/dbraw/zinc/89/85/88/387898588.db2.gz PIIZLFZBBGJJBT-FQUUOJAGSA-N 2 0 242.407 2.297 20 0 BEADRP CC1(C)C(C[NH2+][C@@H]2CCC[C@@H]2[NH3+])C1(C)C ZINC000423096405 387885605 /nfs/dbraw/zinc/88/56/05/387885605.db2.gz OUASHTSBMZFNSS-VHSXEESVSA-N 2 0 210.365 2.138 20 0 BEADRP CC(C)SCC[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000423099462 387887102 /nfs/dbraw/zinc/88/71/02/387887102.db2.gz AMRZJMMNSQZDGX-FOSCPWQOSA-N 2 0 228.405 2.001 20 0 BEADRP [NH3+]CC1CCC([NH2+]CCC2(F)CCC2)CC1 ZINC000423099450 387887354 /nfs/dbraw/zinc/88/73/54/387887354.db2.gz ALVVTKMXVZZSFI-UHFFFAOYSA-N 2 0 228.355 2.376 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]CC1(C(F)(F)F)CCC1 ZINC000423115864 387898799 /nfs/dbraw/zinc/89/87/99/387898799.db2.gz YXNLEUNLBFFJHY-VIFPVBQESA-N 2 0 238.297 2.436 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CC1(c2ccccn2)CCC1 ZINC000423101871 387889214 /nfs/dbraw/zinc/88/92/14/387889214.db2.gz DJWXHIXMYFIWIZ-CHWSQXEVSA-N 2 0 247.386 2.219 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CC1(c2ccccn2)CCC1 ZINC000423101872 387889261 /nfs/dbraw/zinc/88/92/61/387889261.db2.gz DJWXHIXMYFIWIZ-OLZOCXBDSA-N 2 0 247.386 2.219 20 0 BEADRP CO[C@H](C)[C@@H](C)[NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000423141116 387918735 /nfs/dbraw/zinc/91/87/35/387918735.db2.gz OANSKVKGXCEOGC-MHWZDGSBSA-N 2 0 234.343 2.144 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCCC(F)(F)C1)C1C[NH2+]C1 ZINC000423117801 387899464 /nfs/dbraw/zinc/89/94/64/387899464.db2.gz XHAXUVSYCJXESC-VHSXEESVSA-N 2 0 232.318 2.009 20 0 BEADRP COCC(C)(C)CCC[NH2+][C@@H]1CCC[C@H]1C[NH3+] ZINC000423121494 387900613 /nfs/dbraw/zinc/90/06/13/387900613.db2.gz INSHYGMRFVLSBC-QWHCGFSZSA-N 2 0 242.407 2.156 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]C1CC(C(F)(F)F)C1 ZINC000423119830 387901285 /nfs/dbraw/zinc/90/12/85/387901285.db2.gz FNWLSJUQBVKFSN-MSIFESELSA-N 2 0 224.270 2.043 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H]1CC2CCC1CC2 ZINC000423124204 387902614 /nfs/dbraw/zinc/90/26/14/387902614.db2.gz GCZXDYQFCQDLGT-YJEBHAJESA-N 2 0 210.365 2.281 20 0 BEADRP C[C@@H](C[C@H]1CCCCC[NH2+]1)[NH2+][C@H]1CCCOC1 ZINC000423124046 387903688 /nfs/dbraw/zinc/90/36/88/387903688.db2.gz LVQWYOFXJINCOT-MJBXVCDLSA-N 2 0 240.391 2.066 20 0 BEADRP C=Cc1ccc(CC[NH2+][C@@H](C)[C@@H]2CC[NH2+]C2)cc1 ZINC000423125555 387904370 /nfs/dbraw/zinc/90/43/70/387904370.db2.gz ADXJHSFMMJABKE-XJKSGUPXSA-N 2 0 244.382 2.460 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@H]1COc2ccccc21 ZINC000423128105 387905343 /nfs/dbraw/zinc/90/53/43/387905343.db2.gz VCCDYLCLPVAKFJ-OLZOCXBDSA-N 2 0 248.370 2.270 20 0 BEADRP CCCc1nc(C)c(C[NH2+][C@@H](C)CCC[NH3+])o1 ZINC000423130167 387906768 /nfs/dbraw/zinc/90/67/68/387906768.db2.gz MRBSXILEZQPGHD-JTQLQIEISA-N 2 0 239.363 2.153 20 0 BEADRP F[C@@H]1CC[C@H]([NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)C1 ZINC000423128850 387907687 /nfs/dbraw/zinc/90/76/87/387907687.db2.gz QPHLZRDGNNHDBT-XHJNMGKDSA-N 2 0 240.366 2.387 20 0 BEADRP C[C@H](F)CC[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000423131226 387909010 /nfs/dbraw/zinc/90/90/10/387909010.db2.gz HPGTUZIDSNVGTE-WUHRBBMRSA-N 2 0 228.355 2.245 20 0 BEADRP CC[C@H]([NH2+]C[C@H]1CCCSC1)[C@@H]1CCC[NH2+]1 ZINC000423131943 387909118 /nfs/dbraw/zinc/90/91/18/387909118.db2.gz UCNVGRSOGZHSNI-AGIUHOORSA-N 2 0 242.432 2.250 20 0 BEADRP CC1(C)CCC[C@@H]1C[NH2+][C@@H]1CCC[C@H]1[NH3+] ZINC000423132614 387909128 /nfs/dbraw/zinc/90/91/28/387909128.db2.gz JNGZILODCCSARW-IJLUTSLNSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H](F)CC[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000423131223 387909583 /nfs/dbraw/zinc/90/95/83/387909583.db2.gz HPGTUZIDSNVGTE-LOWDOPEQSA-N 2 0 228.355 2.245 20 0 BEADRP CC1(C)CCC[C@@H]1C[NH2+][C@H]1CCC[C@H]1[NH3+] ZINC000423132615 387909646 /nfs/dbraw/zinc/90/96/46/387909646.db2.gz JNGZILODCCSARW-UTUOFQBUSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+][C@H]1CC[C@@H](F)C1 ZINC000423132455 387909709 /nfs/dbraw/zinc/90/97/09/387909709.db2.gz UQESBBGVCMZKCG-KXNHARMFSA-N 2 0 214.328 2.127 20 0 BEADRP Cc1cccc2c1OC[C@H]([NH2+][C@@H](C)CCC[NH3+])C2 ZINC000423133301 387909802 /nfs/dbraw/zinc/90/98/02/387909802.db2.gz CUFQCYWMCIIBJJ-GXTWGEPZSA-N 2 0 248.370 2.016 20 0 BEADRP C=Cc1ccc(CC[NH2+][C@@H]2CCC[C@@H]2[NH3+])cc1 ZINC000423134693 387910863 /nfs/dbraw/zinc/91/08/63/387910863.db2.gz DXSFYMRHJIWMLC-LSDHHAIUSA-N 2 0 230.355 2.342 20 0 BEADRP C[C@@H]([NH2+]C[C@H](c1ccccc1)C1CC1)C1C[NH2+]C1 ZINC000423133327 387912140 /nfs/dbraw/zinc/91/21/40/387912140.db2.gz QDKNXXMCPNFOFX-MLGOLLRUSA-N 2 0 244.382 2.378 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC2CCC1CC2)[C@@H]1CCC[NH2+]1 ZINC000423138924 387915953 /nfs/dbraw/zinc/91/59/53/387915953.db2.gz YVEBUJKQOROWDE-JKZOPUQSSA-N 2 0 222.376 2.295 20 0 BEADRP CSCC1CCC([NH2+][C@H](C)C2C[NH2+]C2)CC1 ZINC000423154101 387932194 /nfs/dbraw/zinc/93/21/94/387932194.db2.gz HDJAQFHQIRKZLU-XSRFYTQQSA-N 2 0 242.432 2.106 20 0 BEADRP CC[C@H](C)[C@H](C[NH2+][C@H]1CCCCC[C@H]1[NH3+])OC ZINC000423156262 387934255 /nfs/dbraw/zinc/93/42/55/387934255.db2.gz KWBCDWNPBJRVOZ-CRWXNKLISA-N 2 0 242.407 2.297 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1)C1CC1 ZINC000423156198 387935220 /nfs/dbraw/zinc/93/52/20/387935220.db2.gz KKGABOSSRUNFIV-FMKGYKFTSA-N 2 0 222.376 2.295 20 0 BEADRP CC[C@@H]1CCC[C@@H]1C[NH2+][C@@H]1CCC[C@H]1[NH3+] ZINC000423156266 387935499 /nfs/dbraw/zinc/93/54/99/387935499.db2.gz KWORSGMFAIKTAB-FDYHWXHSSA-N 2 0 210.365 2.282 20 0 BEADRP CC(F)(F)CCC[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000423146072 387923108 /nfs/dbraw/zinc/92/31/08/387923108.db2.gz NUSUXNOZZGGRLI-ZACCUICWSA-N 2 0 232.318 2.294 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+]CCC(C)(F)F ZINC000423145041 387923404 /nfs/dbraw/zinc/92/34/04/387923404.db2.gz ITUGVDSJMWHURG-VHSXEESVSA-N 2 0 220.307 2.009 20 0 BEADRP CC(C)[C@@H]1C[C@H]1C[NH2+][C@H](C)[C@@H]1CCC[NH2+]1 ZINC000423146505 387923518 /nfs/dbraw/zinc/92/35/18/387923518.db2.gz AOTQQQRRTOREDZ-VOAKCMCISA-N 2 0 210.365 2.009 20 0 BEADRP CC[C@H]([NH2+][C@@H](C)CCCC[NH3+])C(F)F ZINC000423145999 387923689 /nfs/dbraw/zinc/92/36/89/387923689.db2.gz NKKYCAAHYFAZFO-IUCAKERBSA-N 2 0 208.296 2.137 20 0 BEADRP F[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000423148185 387924355 /nfs/dbraw/zinc/92/43/55/387924355.db2.gz UTIXIQNJSHIZQA-RGDJUOJXSA-N 2 0 240.366 2.387 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+][C@@H]1CCCCC[C@@H]1[NH3+] ZINC000423147566 387925739 /nfs/dbraw/zinc/92/57/39/387925739.db2.gz CWPIMXRVCOPNJB-MROQNXINSA-N 2 0 210.365 2.282 20 0 BEADRP CCO[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)CCCC[NH3+] ZINC000423157710 387937141 /nfs/dbraw/zinc/93/71/41/387937141.db2.gz BMPWPZGZCFWXLZ-BFHYXJOUSA-N 2 0 242.407 2.441 20 0 BEADRP C[C@H]([NH2+]CCC1CC(F)(F)C1)[C@H]1CCC[NH2+]1 ZINC000423167606 387952140 /nfs/dbraw/zinc/95/21/40/387952140.db2.gz SPRRMTUAEJWCEH-GXSJLCMTSA-N 2 0 232.318 2.152 20 0 BEADRP CC[C@H]([NH2+]CC1(N(C)C)CCC1)[C@H]1C[C@@H]1C ZINC000321153030 387952750 /nfs/dbraw/zinc/95/27/50/387952750.db2.gz WLISNLOWYLUVIV-AVGNSLFASA-N 2 0 224.392 2.495 20 0 BEADRP CC(C)C[C@@H]1C[C@H]1[NH2+][C@H]1CC[NH2+]CC[C@H]1C ZINC000423167919 387952977 /nfs/dbraw/zinc/95/29/77/387952977.db2.gz GBKUKUXZZZBNOT-YIYPIFLZSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000423167201 387953067 /nfs/dbraw/zinc/95/30/67/387953067.db2.gz DTSUSJIZEKCWKY-FVCCEPFGSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]C[C@@H]1C[C@H]1C1CCC1 ZINC000424288181 387953271 /nfs/dbraw/zinc/95/32/71/387953271.db2.gz IGLOJIYQASLAGX-UQOMUDLDSA-N 2 0 236.403 2.352 20 0 BEADRP CCO[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000423169235 387954965 /nfs/dbraw/zinc/95/49/65/387954965.db2.gz VTXIMCHZDGVGIY-WUHRBBMRSA-N 2 0 228.380 2.050 20 0 BEADRP CSCC1CCC([NH2+][C@@H]2CCC[C@@H]2[NH3+])CC1 ZINC000423159124 387939273 /nfs/dbraw/zinc/93/92/73/387939273.db2.gz OUZWIPLWZCPOFS-IFWUJCSASA-N 2 0 242.432 2.378 20 0 BEADRP CC[C@]1(C(C)C)C[C@@H]1[NH2+][C@@H]1CCC[C@H]1[NH3+] ZINC000423160760 387941989 /nfs/dbraw/zinc/94/19/89/387941989.db2.gz HULSAPNJPIRPMA-FVCCEPFGSA-N 2 0 210.365 2.281 20 0 BEADRP CC[C@]1(C(C)C)C[C@H]1[NH2+][C@H](CCC[NH3+])COC ZINC000423160957 387942157 /nfs/dbraw/zinc/94/21/57/387942157.db2.gz IDGNBQGQQRNLST-MGPQQGTHSA-N 2 0 242.407 2.155 20 0 BEADRP C[C@@H](CCC[NH3+])[N@@H+]1CCC[C@@]2(CCSC2)C1 ZINC000423161418 387943567 /nfs/dbraw/zinc/94/35/67/387943567.db2.gz NUOBNXWEWZNJFC-QWHCGFSZSA-N 2 0 242.432 2.333 20 0 BEADRP CC[N@H+](C)C[C@@H]1CC[NH+]([C@@H]2C=CCCC2)C1 ZINC000245466131 387947714 /nfs/dbraw/zinc/94/77/14/387947714.db2.gz YVCXIVFZSRNSGZ-UONOGXRCSA-N 2 0 222.376 2.369 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1CC[N@H+](CC)C1)[C@H]1C[C@H]1C ZINC000321096411 387948199 /nfs/dbraw/zinc/94/81/99/387948199.db2.gz OGMGPKLYCBCSQK-RFGFWPKPSA-N 2 0 224.392 2.352 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)[C@@H]1C[C@H]1C ZINC000321097756 387948506 /nfs/dbraw/zinc/94/85/06/387948506.db2.gz OKQWFHGOOLBSSH-OSRDXIQISA-N 2 0 236.403 2.495 20 0 BEADRP CC(C)=CCC[C@H](C)[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000423165964 387949898 /nfs/dbraw/zinc/94/98/98/387949898.db2.gz YOCXXKPHTVUIDI-RYUDHWBXSA-N 2 0 210.365 2.319 20 0 BEADRP CO[C@H]1c2ccccc2C[C@H]1[NH2+][C@H](C)C[C@@H](C)[NH3+] ZINC000423171894 387958766 /nfs/dbraw/zinc/95/87/66/387958766.db2.gz QLCKASQGBRMOCL-FKGLVLAHSA-N 2 0 248.370 2.014 20 0 BEADRP COC1CCC([NH2+][C@H](C)[C@H]2CCCC[NH2+]2)CC1 ZINC000423172320 387958823 /nfs/dbraw/zinc/95/88/23/387958823.db2.gz SEXYCCGINHVOSS-BLYZHGLHSA-N 2 0 240.391 2.064 20 0 BEADRP CO[C@H]1c2ccccc2C[C@H]1[NH2+][C@@H](C)C[C@@H](C)[NH3+] ZINC000423171892 387959870 /nfs/dbraw/zinc/95/98/70/387959870.db2.gz QLCKASQGBRMOCL-BVIHXZOGSA-N 2 0 248.370 2.014 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]C1(C2CCC2)CCC1 ZINC000423171896 387960019 /nfs/dbraw/zinc/96/00/19/387960019.db2.gz QLJWRPNINDHQGD-GHMZBOCLSA-N 2 0 210.365 2.425 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CS[C@H](C)C1)[C@@H]1CCC[NH2+]1 ZINC000423173004 387960747 /nfs/dbraw/zinc/96/07/47/387960747.db2.gz WLKXDRCEUVKSMA-RHYQMDGZSA-N 2 0 228.405 2.001 20 0 BEADRP CC[C@H]([NH2+][C@H]1CS[C@H](C)C1)[C@@H]1CCC[NH2+]1 ZINC000423173006 387960797 /nfs/dbraw/zinc/96/07/97/387960797.db2.gz WLKXDRCEUVKSMA-WYUUTHIRSA-N 2 0 228.405 2.001 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CS[C@@H](C)C1)[C@@H]1CCC[NH2+]1 ZINC000423173003 387960860 /nfs/dbraw/zinc/96/08/60/387960860.db2.gz WLKXDRCEUVKSMA-BJDJZHNGSA-N 2 0 228.405 2.001 20 0 BEADRP COc1ccc(Cl)cc1[C@@H](C)[NH2+]CCC[NH3+] ZINC000423175595 387961375 /nfs/dbraw/zinc/96/13/75/387961375.db2.gz DYUYQRIPKZUJTM-SECBINFHSA-N 2 0 242.750 2.348 20 0 BEADRP C[C@@H]1[C@H](C)SCC[N@@H+]1CC[C@H]1CCC[NH+]1C ZINC000245605392 387965369 /nfs/dbraw/zinc/96/53/69/387965369.db2.gz JYMAPSHBYWEFBV-FRRDWIJNSA-N 2 0 242.432 2.297 20 0 BEADRP CC[C@H](C[NH2+][C@H]1CCC[C@@H]1[NH3+])CC(F)(F)F ZINC000423180933 387967717 /nfs/dbraw/zinc/96/77/17/387967717.db2.gz KXHQZNAUSOPSJG-GUBZILKMSA-N 2 0 238.297 2.434 20 0 BEADRP CC[C@H](C[NH2+][C@@H](C)C1C[NH2+]C1)CC(F)(F)F ZINC000423185569 387969094 /nfs/dbraw/zinc/96/90/94/387969094.db2.gz NYNWPLNYDRYOKM-IUCAKERBSA-N 2 0 238.297 2.163 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+][C@@H]1C[C@H]1c1ccco1 ZINC000423185528 387970582 /nfs/dbraw/zinc/97/05/82/387970582.db2.gz NWHYQZPCQCSSIM-FVCCEPFGSA-N 2 0 234.343 2.243 20 0 BEADRP C[C@@H]1CN(C2CC2)C[C@@H]1[NH2+]C[C@@H]1C[C@H]1C1CCC1 ZINC000424295620 387957195 /nfs/dbraw/zinc/95/71/95/387957195.db2.gz PVURWBDBSMYFCV-XTBFLFJDSA-N 2 0 248.414 2.495 20 0 BEADRP C[C@@H]1CN(C2CC2)C[C@H]1[NH2+]C[C@@H]1C[C@H]1C1CCC1 ZINC000424295619 387957250 /nfs/dbraw/zinc/95/72/50/387957250.db2.gz PVURWBDBSMYFCV-SHPPOPEUSA-N 2 0 248.414 2.495 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+][C@@H]1C[C@H]1c1ccccc1F ZINC000423170642 387957315 /nfs/dbraw/zinc/95/73/15/387957315.db2.gz MMRKZWAVXDQKCS-KOXOONSLSA-N 2 0 236.334 2.397 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+][C@@H]1C[C@H]1c1ccccc1F ZINC000423170640 387957809 /nfs/dbraw/zinc/95/78/09/387957809.db2.gz MMRKZWAVXDQKCS-IUCKATPISA-N 2 0 236.334 2.397 20 0 BEADRP COc1ccc([C@@H]([NH2+]CCC[NH3+])C(C)C)cc1 ZINC000423195436 387979480 /nfs/dbraw/zinc/97/94/80/387979480.db2.gz SNCCVWYZBITARD-AWEZNQCLSA-N 2 0 236.359 2.331 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@@H]([NH2+]C2CC[NH2+]CC2)C1 ZINC000423195528 387979773 /nfs/dbraw/zinc/97/97/73/387979773.db2.gz ZIWDVPHSXKJVHV-MDZLAQPJSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@H](C)[NH2+][C@@H]1CC[N@H+](C)[C@@H]2CCC[C@H]21 ZINC000453051383 387973441 /nfs/dbraw/zinc/97/34/41/387973441.db2.gz BEVUKRLPUUTTCY-WUHRBBMRSA-N 2 0 210.365 2.247 20 0 BEADRP C[C@@H]([NH2+]C1CCCCC1)[C@H]1CCCC[NH2+]1 ZINC000238375659 387973564 /nfs/dbraw/zinc/97/35/64/387973564.db2.gz SDFAWIMHEMUDAO-DGCLKSJQSA-N 2 0 210.365 2.439 20 0 BEADRP CCC[C@H]([NH2+]CCC[NH3+])c1ccc(OC)cc1 ZINC000423188456 387974201 /nfs/dbraw/zinc/97/42/01/387974201.db2.gz ZGKHJGARVUQGPV-AWEZNQCLSA-N 2 0 236.359 2.475 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CCCCC[C@@H]2[NH3+])CS1 ZINC000423189905 387974375 /nfs/dbraw/zinc/97/43/75/387974375.db2.gz RMHKHGUVWPVCQE-RHYQMDGZSA-N 2 0 228.405 2.130 20 0 BEADRP C[N@@H+]1CCC[C@@H]1CC[NH+]1C[C@H]2CCC[C@@H]2C1 ZINC000245701717 387975012 /nfs/dbraw/zinc/97/50/12/387975012.db2.gz XUPHFIQYOBGQSB-MGPQQGTHSA-N 2 0 222.376 2.203 20 0 BEADRP CC(C)[C@@H]([NH2+]C1CC[NH2+]CC1)c1cccnc1 ZINC000423190157 387976871 /nfs/dbraw/zinc/97/68/71/387976871.db2.gz RXEVUEPNDKFZAY-CQSZACIVSA-N 2 0 233.359 2.120 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H](C)c1ccc(C)cc1 ZINC000423192468 387978061 /nfs/dbraw/zinc/97/80/61/387978061.db2.gz VKSFJUYKEGZOIX-LBPRGKRZSA-N 2 0 206.333 2.255 20 0 BEADRP CC(C)[C@H]([NH2+]C[C@H]1CCC[NH2+]C1)c1cccnc1 ZINC000423202617 387989572 /nfs/dbraw/zinc/98/95/72/387989572.db2.gz BEGPTABTNDTKRS-ZFWWWQNUSA-N 2 0 247.386 2.368 20 0 BEADRP C[NH2+]CCC[NH2+][C@H]1CCCc2ccc(OC)cc21 ZINC000423204087 387989718 /nfs/dbraw/zinc/98/97/18/387989718.db2.gz UIJJVBMVZPXREK-HNNXBMFYSA-N 2 0 248.370 2.272 20 0 BEADRP COC[C@@H]([NH2+]CC1([NH3+])CCCCCC1)C1CC1 ZINC000423202598 387989740 /nfs/dbraw/zinc/98/97/40/387989740.db2.gz REKJOFOMPTXUMY-CYBMUJFWSA-N 2 0 240.391 2.053 20 0 BEADRP C[C@@H]1CC(C)(C)C[C@H]1[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000423202646 387989837 /nfs/dbraw/zinc/98/98/37/387989837.db2.gz BIDKTDBFGDOCNU-JHJVBQTASA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CC1([NH3+])CCCCCC1 ZINC000423202561 387990060 /nfs/dbraw/zinc/99/00/60/387990060.db2.gz RBJPCKIOVZNDFI-ZDUSSCGKSA-N 3 0 241.423 2.145 20 0 BEADRP CC[C@H]1C[C@@H](C[NH2+][C@@H]2CCCC[C@H]2[NH3+])CCO1 ZINC000424365881 387992957 /nfs/dbraw/zinc/99/29/57/387992957.db2.gz HXAXIQZJVVYTFH-IGQOVBAYSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[NH2+]C1)C1CCSCC1 ZINC000423210084 387995140 /nfs/dbraw/zinc/99/51/40/387995140.db2.gz JPJSTADEPCQPIE-RYUDHWBXSA-N 2 0 242.432 2.107 20 0 BEADRP CCc1nc2c(s1)[C@H]([NH2+]CCC[NH3+])CCC2 ZINC000423197467 387982001 /nfs/dbraw/zinc/98/20/01/387982001.db2.gz ZNSPXAWGYDDLGD-SECBINFHSA-N 2 0 239.388 2.021 20 0 BEADRP Cc1ccc([C@H]([NH2+]CCC[NH3+])C2CCC2)o1 ZINC000423196875 387982195 /nfs/dbraw/zinc/98/21/95/387982195.db2.gz WTQSODKNDKEVDF-CYBMUJFWSA-N 2 0 222.332 2.368 20 0 BEADRP Cc1cccc2c1[C@H](C)C[C@H]2[NH2+]CCC[NH3+] ZINC000423196642 387982538 /nfs/dbraw/zinc/98/25/38/387982538.db2.gz VTNFBDMTJPRJOR-DGCLKSJQSA-N 2 0 218.344 2.482 20 0 BEADRP C[C@@H](CCc1c(F)cccc1F)[NH2+]CCC[NH3+] ZINC000423197240 387982647 /nfs/dbraw/zinc/98/26/47/387982647.db2.gz YNQMLSTXLMYZQF-JTQLQIEISA-N 2 0 242.313 2.224 20 0 BEADRP C[NH2+]CCC[NH2+][C@H](c1cccnc1)C1CCC1 ZINC000423198163 387983898 /nfs/dbraw/zinc/98/38/98/387983898.db2.gz DLLLPVSYTAEZLE-AWEZNQCLSA-N 2 0 233.359 2.122 20 0 BEADRP C[NH2+]CCC[NH2+][C@H]1c2cc(F)ccc2C[C@@H]1C ZINC000423198043 387984182 /nfs/dbraw/zinc/98/41/82/387984182.db2.gz CQCSXBIAIGQWPX-IINYFYTJSA-N 2 0 236.334 2.258 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1c2ccccc2C[C@@H]1C ZINC000423198249 387984535 /nfs/dbraw/zinc/98/45/35/387984535.db2.gz DVKKJDWKGULPSU-FZMZJTMJSA-N 2 0 218.344 2.119 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1CCc2c1cccc2F ZINC000423198500 387984807 /nfs/dbraw/zinc/98/48/07/387984807.db2.gz GGAQYDBFGAPFJG-CYBMUJFWSA-N 2 0 222.307 2.012 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1CCC[C@@H](c2cccnc2)C1 ZINC000423198918 387985473 /nfs/dbraw/zinc/98/54/73/387985473.db2.gz IQVRSKMZULYAAL-UKRRQHHQSA-N 2 0 247.386 2.307 20 0 BEADRP CC[C@@H]([NH2+][C@@H]1C[C@H]1C1CCC1)[C@@H]1CCC[NH2+]1 ZINC000424372924 387997721 /nfs/dbraw/zinc/99/77/21/387997721.db2.gz IWGMDQCIKHRMTD-RFQIPJPRSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)c1ccccn1 ZINC000420399471 387999176 /nfs/dbraw/zinc/99/91/76/387999176.db2.gz HYRUSEONKDVQMR-STQMWFEESA-N 2 0 233.359 2.122 20 0 BEADRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)C1(C)CC1 ZINC000423216752 387999420 /nfs/dbraw/zinc/99/94/20/387999420.db2.gz QSWMLVAIXOTDBV-WSMDXJOWSA-N 2 0 208.349 2.048 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]C[C@@H]1C[C@H]1C1CCC1 ZINC000424375619 387999736 /nfs/dbraw/zinc/99/97/36/387999736.db2.gz KNWORQUUJAFXGG-URBCHYCLSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1C[C@H]1C1CCC1)[C@H]1CCC[NH2+]1 ZINC000424382589 388000915 /nfs/dbraw/zinc/00/09/15/388000915.db2.gz SFNKNGPBJLGTCI-VZZFWQQMSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@H](C1CC1)C1CCCC1 ZINC000423222609 388004359 /nfs/dbraw/zinc/00/43/59/388004359.db2.gz BWBHQLGZYHKXKX-GWCFXTLKSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@H]1CCCc2sccc21 ZINC000423223508 388006050 /nfs/dbraw/zinc/00/60/50/388006050.db2.gz AHAVRPNQKAQGOY-ONGXEEELSA-N 2 0 224.373 2.452 20 0 BEADRP COc1ccc2c(c1)[C@@H]([NH2+]CC[C@H](C)[NH3+])CC2 ZINC000423224579 388006474 /nfs/dbraw/zinc/00/64/74/388006474.db2.gz CMUGYABGEVLKHR-HZMBPMFUSA-N 2 0 234.343 2.009 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H]1CCCc2ccc(O)cc21 ZINC000423225950 388009517 /nfs/dbraw/zinc/00/95/17/388009517.db2.gz OVTZWHGAWUYBMN-IINYFYTJSA-N 2 0 234.343 2.097 20 0 BEADRP CCO[C@@H]1C[C@H]([NH2+]CC[C@H](C)[NH3+])C12CCCC2 ZINC000423226849 388011210 /nfs/dbraw/zinc/01/12/10/388011210.db2.gz SNQCDUCBHZPYMA-RWMBFGLXSA-N 2 0 240.391 2.051 20 0 BEADRP CCc1cc(N[C@@H]2CCC[C@@H]([NH+](C)C)C2)cc[nH+]1 ZINC000450368992 387996325 /nfs/dbraw/zinc/99/63/25/387996325.db2.gz LPEXCJGFHAZWDH-UKRRQHHQSA-N 2 0 247.386 2.351 20 0 BEADRP CCO[C@H]1C[C@@H]([NH2+][C@@H]2CCCC[C@H]2[NH3+])C1(C)C ZINC000424372124 387996785 /nfs/dbraw/zinc/99/67/85/387996785.db2.gz HCEWVMIPPHOBAK-LPWJVIDDSA-N 2 0 240.391 2.050 20 0 BEADRP Cc1nc([C@H](C)[NH2+]CC[C@@H]2CC[NH2+]C2)cs1 ZINC000423240727 388024508 /nfs/dbraw/zinc/02/45/08/388024508.db2.gz CRDWUFCCAZXSQE-ONGXEEELSA-N 2 0 239.388 2.102 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H]1CCc2c1cccc2F ZINC000423227835 388013169 /nfs/dbraw/zinc/01/31/69/388013169.db2.gz XFVPATGRADQKJO-TVQRCGJNSA-N 2 0 222.307 2.140 20 0 BEADRP CC[C@@H](C)C[N@@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000246151573 388013892 /nfs/dbraw/zinc/01/38/92/388013892.db2.gz CDPFHFWLGWJEDL-KGLIPLIRSA-N 2 0 224.392 2.450 20 0 BEADRP C[C@]12C[C@H]1CCC[C@@H]2[NH2+]C1CCC([NH3+])CC1 ZINC000423234061 388018198 /nfs/dbraw/zinc/01/81/98/388018198.db2.gz PAAZOUICCANROV-JKZOPUQSSA-N 2 0 222.376 2.425 20 0 BEADRP FC(F)C1CCC([NH2+]C[C@H]2CCC[NH2+]2)CC1 ZINC000423233718 388018590 /nfs/dbraw/zinc/01/85/90/388018590.db2.gz KKWRGIYGDCVBBC-VQXHTEKXSA-N 2 0 232.318 2.152 20 0 BEADRP FC(F)C1CCC([NH2+]C[C@@H]2CCC[NH2+]2)CC1 ZINC000423233717 388018676 /nfs/dbraw/zinc/01/86/76/388018676.db2.gz KKWRGIYGDCVBBC-ILDUYXDCSA-N 2 0 232.318 2.152 20 0 BEADRP COCC[C@H]1CCC[C@H]1[NH2+]C1CCC([NH3+])CC1 ZINC000423233790 388019307 /nfs/dbraw/zinc/01/93/07/388019307.db2.gz OTZJWHLFTAECHE-BLYZHGLHSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H](CC[NH3+])[NH2+]Cc1ccccc1Cl ZINC000066147940 388022267 /nfs/dbraw/zinc/02/22/67/388022267.db2.gz BJAUEFKAXSWKPX-VIFPVBQESA-N 2 0 212.724 2.167 20 0 BEADRP C[C@@H]([NH2+]CC[C@H](C)[NH3+])c1ccc(F)cc1 ZINC000423238549 388023203 /nfs/dbraw/zinc/02/32/03/388023203.db2.gz VPDLPQKFSAOQFF-VHSXEESVSA-N 2 0 210.296 2.214 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1cccs1 ZINC000423249055 388032315 /nfs/dbraw/zinc/03/23/15/388032315.db2.gz ODTVOCYOEXPODG-WDEREUQCSA-N 2 0 224.373 2.398 20 0 BEADRP Cc1cc[nH+]c(NCC[C@@H]2CCC[NH2+]C2)c1 ZINC000082487026 388034842 /nfs/dbraw/zinc/03/48/42/388034842.db2.gz HMHYFCNKJBAJJX-LBPRGKRZSA-N 2 0 219.332 2.192 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)c1ccco1 ZINC000423255430 388036639 /nfs/dbraw/zinc/03/66/39/388036639.db2.gz CBRLDXCQFSXJGX-NEPJUHHUSA-N 2 0 222.332 2.320 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)c1cncs1 ZINC000423256675 388037243 /nfs/dbraw/zinc/03/72/43/388037243.db2.gz FPYWLFXFKLUQNP-QWRGUYRKSA-N 2 0 239.388 2.183 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+][C@@H]1CC[N@H+](C)[C@H]2CCC[C@@H]21 ZINC000453303020 388039641 /nfs/dbraw/zinc/03/96/41/388039641.db2.gz BAXWELFZJNIBHZ-KHMAMNHCSA-N 2 0 236.403 2.495 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H]1CCC12CCCC2 ZINC000423266128 388043907 /nfs/dbraw/zinc/04/39/07/388043907.db2.gz CWQPXDZAIASFHS-NEPJUHHUSA-N 2 0 210.365 2.154 20 0 BEADRP CC(C)[C@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1cccnc1 ZINC000423243888 388028398 /nfs/dbraw/zinc/02/83/98/388028398.db2.gz GSQYGRZCUIMTFZ-ZFWWWQNUSA-N 2 0 247.386 2.368 20 0 BEADRP CC(C)=CCC[C@H](C)[NH2+]C[C@@H]1CCC[NH2+]1 ZINC000423246601 388029561 /nfs/dbraw/zinc/02/95/61/388029561.db2.gz ZLXZRTDVJCNFPO-STQMWFEESA-N 2 0 210.365 2.463 20 0 BEADRP C[C@@H]1CC(C)(C)C[C@@H]1[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000423249246 388031177 /nfs/dbraw/zinc/03/11/77/388031177.db2.gz OHYKXSQAHZOSHR-AGIUHOORSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1cccc(F)c1 ZINC000423249732 388031963 /nfs/dbraw/zinc/03/19/63/388031963.db2.gz PNSFGZWHBZQLRZ-RYUDHWBXSA-N 2 0 236.334 2.476 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H]1CCc2ccc(C)cc21 ZINC000423274631 388055838 /nfs/dbraw/zinc/05/58/38/388055838.db2.gz MEPKJRWQZXOMBW-IUODEOHRSA-N 2 0 232.371 2.427 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@H]1C[C@H](C)CC[C@@H]1C ZINC000423276325 388056791 /nfs/dbraw/zinc/05/67/91/388056791.db2.gz OINRAWBGDKLEMJ-XQHKEYJVSA-N 2 0 212.381 2.384 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CCc2cc(F)ccc21 ZINC000423276429 388057457 /nfs/dbraw/zinc/05/74/57/388057457.db2.gz ONEATSGUNRDBQJ-IINYFYTJSA-N 2 0 236.334 2.258 20 0 BEADRP CC(C)[C@@H]1C[C@H]1C[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000453362259 388060400 /nfs/dbraw/zinc/06/04/00/388060400.db2.gz QYNAGTXDMHYPFM-RFGFWPKPSA-N 2 0 224.392 2.351 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H](C)c1ccc2c(c1)COC2 ZINC000423279712 388061426 /nfs/dbraw/zinc/06/14/26/388061426.db2.gz SVGREXHXFJORHO-VXGBXAGGSA-N 2 0 248.370 2.223 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]C1C2CC3CC(C2)CC1C3 ZINC000423282009 388063119 /nfs/dbraw/zinc/06/31/19/388063119.db2.gz WEELCLMYPRHSEP-IBEXFIOLSA-N 2 0 236.403 2.256 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]C[C@@H]1C[C@H]1C1CC1 ZINC000453382598 388065994 /nfs/dbraw/zinc/06/59/94/388065994.db2.gz ZGAWKLKUJCFQBH-MFHWUAJNSA-N 2 0 236.403 2.351 20 0 BEADRP CC(C)C1CC([NH2+]CC[C@@H]2CCC[NH2+]C2)C1 ZINC000423283121 388066070 /nfs/dbraw/zinc/06/60/70/388066070.db2.gz XGBUYEYZQNSTNH-HSBZDZAISA-N 2 0 224.392 2.400 20 0 BEADRP CC[C@@H]1CCCC[C@H]1[NH2+]C[C@H](C)C[NH2+]C ZINC000423284416 388067138 /nfs/dbraw/zinc/06/71/38/388067138.db2.gz YLDWFLKRNPIIHJ-JHJVBQTASA-N 2 0 212.381 2.400 20 0 BEADRP CC[C@@H]1CCCC[C@H]1[NH2+]C[C@@H](C)C[NH2+]C ZINC000423284419 388067651 /nfs/dbraw/zinc/06/76/51/388067651.db2.gz YLDWFLKRNPIIHJ-YNEHKIRRSA-N 2 0 212.381 2.400 20 0 BEADRP C[N@H+](CCCC[NH2+][C@@H]1CCOC1(C)C)C1CC1 ZINC000453389461 388068084 /nfs/dbraw/zinc/06/80/84/388068084.db2.gz CMJNTMAWYWITKT-CYBMUJFWSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCCC[N@H+](C)C2CC2)[C@@H]1C ZINC000453396861 388070144 /nfs/dbraw/zinc/07/01/44/388070144.db2.gz IWWWADXJWPERAL-YRGRVCCFSA-N 2 0 224.392 2.495 20 0 BEADRP CCc1ccc(C[N@@H+]2CC[C@]3(CC[NH2+]C3)C2)cc1 ZINC000084072923 388070648 /nfs/dbraw/zinc/07/06/48/388070648.db2.gz RPBABASJPCHYJY-INIZCTEOSA-N 2 0 244.382 2.434 20 0 BEADRP CCO[C@H]1C[C@H]([NH2+]CC(C)(C)[NH3+])C1(CC)CC ZINC000423286907 388071535 /nfs/dbraw/zinc/07/15/35/388071535.db2.gz JJFWQRNYHGVTQN-RYUDHWBXSA-N 2 0 242.407 2.297 20 0 BEADRP CC(C)CO[C@@H]1C[C@@H]([NH2+]CC(C)(C)[NH3+])C1(C)C ZINC000423290372 388073949 /nfs/dbraw/zinc/07/39/49/388073949.db2.gz ZVPBVTYNUZSPEP-VXGBXAGGSA-N 2 0 242.407 2.153 20 0 BEADRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]Cc1cccc(F)c1 ZINC000084218465 388075437 /nfs/dbraw/zinc/07/54/37/388075437.db2.gz ILKOPSIHLNOYFY-DGCLKSJQSA-N 2 0 222.307 2.043 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]Cc1ccc(F)cc1 ZINC000084217746 388075541 /nfs/dbraw/zinc/07/55/41/388075541.db2.gz ADVNANUONCYZQX-WCQYABFASA-N 2 0 222.307 2.043 20 0 BEADRP CC[C@@H](c1ccc(F)cc1)[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC000084221683 388075586 /nfs/dbraw/zinc/07/55/86/388075586.db2.gz HIMFLNDJATVPDK-GUTXKFCHSA-N 2 0 248.345 2.428 20 0 BEADRP COC(C)(C)[C@@H](C)[NH2+]CCCC[N@H+](C)C1CC1 ZINC000453410038 388075630 /nfs/dbraw/zinc/07/56/30/388075630.db2.gz UQKNKPDNCKFMLQ-GFCCVEGCSA-N 2 0 242.407 2.264 20 0 BEADRP CCC([NH3+])(CC)C[NH2+][C@@H]1CCC[C@@H]1CCOC ZINC000423292280 388076460 /nfs/dbraw/zinc/07/64/60/388076460.db2.gz MILDJLDMRDCUPT-CHWSQXEVSA-N 2 0 242.407 2.299 20 0 BEADRP CCc1nc(C)c([C@@H](C)[NH2+]C[C@H](C)C[NH3+])s1 ZINC000423295550 388076968 /nfs/dbraw/zinc/07/69/68/388076968.db2.gz FCRMAJBFRHSWLK-RKDXNWHRSA-N 2 0 241.404 2.259 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H](C)C[NH3+])c1ccc(F)cc1 ZINC000423295544 388077007 /nfs/dbraw/zinc/07/70/07/388077007.db2.gz FCLNSQUVJFBLBR-GXFFZTMASA-N 2 0 224.323 2.461 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H](C)c1cc(F)cc(F)c1 ZINC000423296663 388078056 /nfs/dbraw/zinc/07/80/56/388078056.db2.gz HGZUQJIRCQPNRD-RKDXNWHRSA-N 2 0 228.286 2.210 20 0 BEADRP CO[C@H](C)[C@H](C)[NH2+]Cc1ccc([C@H](C)[NH3+])cc1 ZINC000423296451 388078739 /nfs/dbraw/zinc/07/87/39/388078739.db2.gz ZGNPQJFNZNEWLP-SDDRHHMPSA-N 2 0 236.359 2.219 20 0 BEADRP Cc1nc2c(s1)[C@H]([NH2+]C[C@@H](C)C[NH3+])CCC2 ZINC000423297514 388080160 /nfs/dbraw/zinc/08/01/60/388080160.db2.gz KPICBQODINCPCP-WCBMZHEXSA-N 2 0 239.388 2.013 20 0 BEADRP C[C@@H]([NH2+]CCCC[N@H+](C)C1CC1)C1CC1 ZINC000453435837 388082080 /nfs/dbraw/zinc/08/20/80/388082080.db2.gz URUQRRXOMONPKU-LLVKDONJSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@H]1C[C@@H]1C[NH2+]CCCC[N@H+](C)C1CC1 ZINC000453593807 388088736 /nfs/dbraw/zinc/08/87/36/388088736.db2.gz HSZOLIWMWXNPRL-NWDGAFQWSA-N 2 0 210.365 2.106 20 0 BEADRP Cc1ccncc1C[NH2+]CCCC[N@@H+](C)C1CC1 ZINC000453602510 388091090 /nfs/dbraw/zinc/09/10/90/388091090.db2.gz WFWXJBXAKZVVNV-UHFFFAOYSA-N 2 0 247.386 2.354 20 0 BEADRP CC(C)[C@H]([NH2+][C@@H]1CCC[NH2+]CC1)C1CC1 ZINC000324262463 388115746 /nfs/dbraw/zinc/11/57/46/388115746.db2.gz LXTTZTYLJAWNKJ-OLZOCXBDSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)[C@H]([NH2+][C@H]1CCC[NH2+]CC1)C1CC1 ZINC000324262469 388115980 /nfs/dbraw/zinc/11/59/80/388115980.db2.gz LXTTZTYLJAWNKJ-STQMWFEESA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@@H]2CCCOCC2)CC1 ZINC000086870140 388109106 /nfs/dbraw/zinc/10/91/06/388109106.db2.gz JYPBXSIQIHRULW-CYBMUJFWSA-N 2 0 240.391 2.018 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H]2CS[C@H](C)C2)CC1 ZINC000086934592 388110867 /nfs/dbraw/zinc/11/08/67/388110867.db2.gz CBMIBYMUMQTBAY-DGCLKSJQSA-N 2 0 242.432 2.344 20 0 BEADRP Cc1ccnc([C@H](C)[NH2+][C@@H]2CCC[C@@H]2C[NH3+])c1 ZINC000423265854 388044769 /nfs/dbraw/zinc/04/47/69/388044769.db2.gz DBUKNNMVMQHQOD-YNEHKIRRSA-N 2 0 233.359 2.168 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1C[C@H](OC(C)C)C1(C)C ZINC000423266964 388045120 /nfs/dbraw/zinc/04/51/20/388045120.db2.gz DMNAFMLJFLMRDR-XQQFMLRXSA-N 2 0 242.407 2.024 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H]1CCc2ccc(OC)cc21 ZINC000423267417 388045842 /nfs/dbraw/zinc/04/58/42/388045842.db2.gz DYWAKBKYFUQDJT-NHYWBVRUSA-N 2 0 248.370 2.128 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]C1[C@H](C)CCC[C@H]1C ZINC000423269137 388048429 /nfs/dbraw/zinc/04/84/29/388048429.db2.gz GSHSMNARHZMQGW-QJPTWQEYSA-N 2 0 212.381 2.256 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H]1CCCOc2ccccc21 ZINC000423269575 388049047 /nfs/dbraw/zinc/04/90/47/388049047.db2.gz HFSCRIKNXMXSKD-JSGCOSHPSA-N 2 0 248.370 2.345 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+][C@H](C)CC(C)(C)C ZINC000423271312 388049591 /nfs/dbraw/zinc/04/95/91/388049591.db2.gz IXBZUGKOYBWXSF-MNOVXSKESA-N 2 0 200.370 2.384 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H]1CCCOc2ccccc21 ZINC000423269577 388050020 /nfs/dbraw/zinc/05/00/20/388050020.db2.gz HFSCRIKNXMXSKD-TZMCWYRMSA-N 2 0 248.370 2.345 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H](Cc1ccccc1)C1CC1 ZINC000423271205 388050114 /nfs/dbraw/zinc/05/01/14/388050114.db2.gz IRXOIACKTSVQIU-BBRMVZONSA-N 2 0 246.398 2.453 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H](C)CC(C)(C)C ZINC000423271964 388050831 /nfs/dbraw/zinc/05/08/31/388050831.db2.gz JMZVNNMWNVPPRE-GHMZBOCLSA-N 2 0 200.370 2.256 20 0 BEADRP C[C@@H](Cc1ccoc1)[NH2+]CCC[NH+]1CCCC1 ZINC000449219527 388158913 /nfs/dbraw/zinc/15/89/13/388158913.db2.gz NPAMLZYOVROJQQ-ZDUSSCGKSA-N 2 0 236.359 2.286 20 0 BEADRP C[C@H]1C[C@@H]1C[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC000488464205 388181025 /nfs/dbraw/zinc/18/10/25/388181025.db2.gz RGNFRHTYQQQAFB-SWLSCSKDSA-N 2 0 232.371 2.494 20 0 BEADRP COCC1CCC([NH2+][C@@H](C)CC[NH+](C)C)CC1 ZINC000449106370 388143027 /nfs/dbraw/zinc/14/30/27/388143027.db2.gz HUSODTCNAFTOPT-HSBZDZAISA-N 2 0 242.407 2.121 20 0 BEADRP CCC[NH2+][C@H](C)C(=O)Nc1ccc([C@H](C)[NH3+])cc1 ZINC000449124155 388145577 /nfs/dbraw/zinc/14/55/77/388145577.db2.gz FSTBTXRWDFTCGE-WDEREUQCSA-N 2 0 249.358 2.033 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CC[N@H+](CC2CCCCC2)C1 ZINC000166224739 388254463 /nfs/dbraw/zinc/25/44/63/388254463.db2.gz CYYCZCKLPMETPY-WCQYABFASA-N 2 0 210.365 2.236 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@H]1CC[C@H](C)C1 ZINC000164421977 388238190 /nfs/dbraw/zinc/23/81/90/388238190.db2.gz PTECQPJVAUOSNZ-STQMWFEESA-N 2 0 212.381 2.495 20 0 BEADRP Cc1ccc(CCC[NH2+][C@@H]2COCC2(C)C)cn1 ZINC000449624385 388244970 /nfs/dbraw/zinc/24/49/70/388244970.db2.gz OGLSEQHZLIONFV-CQSZACIVSA-N 2 0 248.370 2.337 20 0 BEADRP CCSCC[NH2+]C[C@H](C)C[NH+]1CCCC1 ZINC000164794331 388248133 /nfs/dbraw/zinc/24/81/33/388248133.db2.gz XPWBDQSHWGETSQ-LBPRGKRZSA-N 2 0 230.421 2.061 20 0 BEADRP C[C@@]1(C[NH3+])CC[N@H+](CC2CCCCC2)C1 ZINC000235438333 388369687 /nfs/dbraw/zinc/36/96/87/388369687.db2.gz KXLRCEVTXWWCNA-ZDUSSCGKSA-N 2 0 210.365 2.237 20 0 BEADRP CC1CCC([NH2+]C[C@@H](C2CC2)N(C)C)CC1 ZINC000164442182 388378374 /nfs/dbraw/zinc/37/83/74/388378374.db2.gz LHVNEOUNTZEBKB-UBHUBRDASA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1C[N@H+](C[C@H]2CCC(F)(F)C2)CC[C@@H]1[NH3+] ZINC000300785735 388394116 /nfs/dbraw/zinc/39/41/16/388394116.db2.gz BEBQREPYARJJFF-VWYCJHECSA-N 2 0 232.318 2.091 20 0 BEADRP C[C@@H]1C[C@@H]([NH3+])CC[N@@H+]1C[C@H]1CCC(F)(F)C1 ZINC000300997954 388397280 /nfs/dbraw/zinc/39/72/80/388397280.db2.gz VHKLEWWKLKSFKN-VWYCJHECSA-N 2 0 232.318 2.233 20 0 BEADRP CCC[C@@H]([NH2+]CCN(C)CCOC)C1CCC1 ZINC000322720780 388444999 /nfs/dbraw/zinc/44/49/99/388444999.db2.gz SXPQLPZPQPGORU-CQSZACIVSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)C1(C)CC1 ZINC000322716442 388445202 /nfs/dbraw/zinc/44/52/02/388445202.db2.gz PTXLPQXXCZJNDE-WODVXLOZSA-N 2 0 222.376 2.390 20 0 BEADRP Cc1cccnc1CC[NH2+][C@@H]1CCCC[C@H]1C[NH3+] ZINC000405034068 388449417 /nfs/dbraw/zinc/44/94/17/388449417.db2.gz QHEGYZKHVJBSRS-DZGCQCFKSA-N 2 0 247.386 2.040 20 0 BEADRP Cc1ncccc1C[N@@H+]1C[C@H](C[NH3+])[C@@H](C)C[C@@H]1C ZINC000397264290 388455994 /nfs/dbraw/zinc/45/59/94/388455994.db2.gz IOWKMBYEMAIDHS-HUBLWGQQSA-N 2 0 247.386 2.195 20 0 BEADRP Cc1ncccc1C[N@@H+]1C[C@H](C[NH3+])[C@H](C)C[C@@H]1C ZINC000397264295 388456081 /nfs/dbraw/zinc/45/60/81/388456081.db2.gz IOWKMBYEMAIDHS-XUJVJEKNSA-N 2 0 247.386 2.195 20 0 BEADRP CCN1CCC[C@@H]1C[NH2+][C@@H]1CCC1(C)C ZINC000336703127 388465545 /nfs/dbraw/zinc/46/55/45/388465545.db2.gz QIJWIZOSUYZRHM-VXGBXAGGSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@H](C[NH2+][C@H](C)C1CCSCC1)C[NH+](C)C ZINC000336725246 388470337 /nfs/dbraw/zinc/47/03/37/388470337.db2.gz BKNZYWTYRZXGBA-VXGBXAGGSA-N 2 0 244.448 2.305 20 0 BEADRP CCO[C@@H]1C[C@H]([NH2+][C@H](C)CCCC[NH3+])C1(C)C ZINC000336731442 388471528 /nfs/dbraw/zinc/47/15/28/388471528.db2.gz YVKANEPVOAWDRV-FRRDWIJNSA-N 2 0 242.407 2.297 20 0 BEADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@@H](C)[C@@H](C)CC ZINC000165940108 388413742 /nfs/dbraw/zinc/41/37/42/388413742.db2.gz HOOIHZKBFAMATP-MELADBBJSA-N 2 0 244.423 2.367 20 0 BEADRP C[N@@H+]1CCC[C@H]2C[NH+](C3CCCC3)CC[C@H]21 ZINC000245630666 388426119 /nfs/dbraw/zinc/42/61/19/388426119.db2.gz PYGVYQQLMWTVOK-GXTWGEPZSA-N 2 0 222.376 2.345 20 0 BEADRP COC[C@H](C)C[N@H+](CCC[NH3+])CC1CCCC1 ZINC000573249158 388433141 /nfs/dbraw/zinc/43/31/41/388433141.db2.gz WZLRIPLJHAHZKZ-CYBMUJFWSA-N 2 0 242.407 2.110 20 0 BEADRP C[C@@H](c1ccccn1)[N@H+]1CC[C@H]2C[NH2+]C[C@H]2CC1 ZINC000311187842 388493321 /nfs/dbraw/zinc/49/33/21/388493321.db2.gz BPSGWVDTJJNSCZ-MELADBBJSA-N 2 0 245.370 2.074 20 0 BEADRP CO[C@@H](C[NH2+]C1CC[NH+](C(C)C)CC1)C(C)C ZINC000341284429 388495784 /nfs/dbraw/zinc/49/57/84/388495784.db2.gz PUPXEXYHHOIPRA-AWEZNQCLSA-N 2 0 242.407 2.120 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@H](C)[N@H+](C)C[C@H]2C)CS1 ZINC000397796018 388499593 /nfs/dbraw/zinc/49/95/93/388499593.db2.gz ANLLFKJMHIAKMH-RXGFPQBGSA-N 2 0 242.432 2.199 20 0 BEADRP CC(C)C[C@@H]1CCC[N@@H+]1C[C@@H]1CCC[NH2+]C1 ZINC000346832533 388520350 /nfs/dbraw/zinc/52/03/50/388520350.db2.gz QXEGAEZHXGSDSM-KGLIPLIRSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[N@@H+]1C[C@@H]2CC[C@H]([NH3+])[C@H]2C1 ZINC000346842690 388520420 /nfs/dbraw/zinc/52/04/20/388520420.db2.gz IKDRWOKRBYQDHF-MRLBHPIUSA-N 2 0 236.403 2.482 20 0 BEADRP CC[C@H]1CCC[C@H](C[NH2+][C@H]2CC[NH2+]C2)C1 ZINC000516878615 388522724 /nfs/dbraw/zinc/52/27/24/388522724.db2.gz QLCFCVGOBWXTGT-AVGNSLFASA-N 2 0 210.365 2.154 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+]CC(C)(C)C ZINC000163788005 135184590 /nfs/dbraw/zinc/18/45/90/135184590.db2.gz RHWHUFKJCUFNAZ-UHFFFAOYSA-N 2 0 200.370 2.352 20 0 BEADRP Cc1cncc([C@@H](C)[NH2+]CC2CC[NH+](C)CC2)c1 ZINC000184345962 256844664 /nfs/dbraw/zinc/84/46/64/256844664.db2.gz KQKHXKZIPJJJFL-CYBMUJFWSA-N 2 0 247.386 2.382 20 0 BEADRP CO[C@H](C[N@@H+]1CC[C@H]([NH3+])[C@@H](C)C1)c1ccccc1 ZINC000379181732 388595714 /nfs/dbraw/zinc/59/57/14/388595714.db2.gz GOZMZMXFSFDUDY-AEGPPILISA-N 2 0 248.370 2.043 20 0 BEADRP C[C@@H]1OCC[C@H]1[NH2+][C@H](CC[NH+](C)C)C(C)(C)C ZINC000245938837 388611177 /nfs/dbraw/zinc/61/11/77/388611177.db2.gz LVABDRWHUDKYFP-YNEHKIRRSA-N 2 0 242.407 2.120 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@H](C)[C@H]1CCCCO1 ZINC000356693290 388551547 /nfs/dbraw/zinc/55/15/47/388551547.db2.gz IZDVAKCMCNAZGN-JHJVBQTASA-N 2 0 228.380 2.051 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[C@@H](C[NH3+])C1)c1ccoc1 ZINC000517553984 388552900 /nfs/dbraw/zinc/55/29/00/388552900.db2.gz LCSQLDZCXSSHIL-UMNHJUIQSA-N 2 0 208.305 2.058 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@H](C[NH3+])C1)c1ccoc1 ZINC000517553982 388553253 /nfs/dbraw/zinc/55/32/53/388553253.db2.gz LCSQLDZCXSSHIL-JBLDHEPKSA-N 2 0 208.305 2.058 20 0 BEADRP CS[C@@H]1CC[N@H+](CC[C@@H]2CCCC[NH+]2C)C1 ZINC000521192234 388564181 /nfs/dbraw/zinc/56/41/81/388564181.db2.gz OCILFBUQBHIHSM-QWHCGFSZSA-N 2 0 242.432 2.298 20 0 BEADRP CCC[C@@H](C)C[NH+]1CCC([NH2+]CCOC)CC1 ZINC000548881183 388568267 /nfs/dbraw/zinc/56/82/67/388568267.db2.gz DAJZTGOZOSSLPO-CYBMUJFWSA-N 2 0 242.407 2.123 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH+](C)CC(C)C)[C@@H](C)C1 ZINC000245426803 388578920 /nfs/dbraw/zinc/57/89/20/388578920.db2.gz LMYVGJUYUHMYBT-STQMWFEESA-N 2 0 212.381 2.305 20 0 BEADRP C[C@H](C1CC1)[N@H+](C)CC[C@@H]1CCC[NH+]1C ZINC000125016390 388668851 /nfs/dbraw/zinc/66/88/51/388668851.db2.gz KKOOLZVGFCUJIQ-YPMHNXCESA-N 2 0 210.365 2.201 20 0 BEADRP C[N@@H+]1CCC[C@]2(CC[NH+](CC3(C)CC3)C2)C1 ZINC000552110889 388669439 /nfs/dbraw/zinc/66/94/39/388669439.db2.gz GINYSKWZYUUBTR-AWEZNQCLSA-N 2 0 222.376 2.204 20 0 BEADRP CC[NH+](CC)CCC[N@@H+]1CC[C@@H](C)[C@@H]1C ZINC000191804371 388671032 /nfs/dbraw/zinc/67/10/32/388671032.db2.gz DKRNZHFQAXQCHV-OLZOCXBDSA-N 2 0 212.381 2.449 20 0 BEADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]C(C)C)[C@@H](C)C1 ZINC000247977824 388672138 /nfs/dbraw/zinc/67/21/38/388672138.db2.gz LNZCAAJHTOVZHE-KBPBESRZSA-N 2 0 242.407 2.121 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH+](C)CC2CC2)[C@@H](C)C1 ZINC000248293020 388675572 /nfs/dbraw/zinc/67/55/72/388675572.db2.gz XGTLWMFBTMPVOI-WCQYABFASA-N 2 0 210.365 2.059 20 0 BEADRP CCC(CC)C[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000530179106 388621369 /nfs/dbraw/zinc/62/13/69/388621369.db2.gz TXLHBEDXFOJJJI-GFCCVEGCSA-N 2 0 210.365 2.297 20 0 BEADRP Cc1ccc(CN[C@H]2CC[NH2+]C23CCC3)s1 ZINC000530178688 388621530 /nfs/dbraw/zinc/62/15/30/388621530.db2.gz QEZFFUMNLXTCMW-LBPRGKRZSA-N 2 0 236.384 2.431 20 0 BEADRP CCC[C@H](C[NH2+][C@@H]1CC[NH2+]CC[C@H]1C)OCC ZINC000530212613 388627593 /nfs/dbraw/zinc/62/75/93/388627593.db2.gz RDBPGNMVAGONMS-MGPQQGTHSA-N 2 0 242.407 2.169 20 0 BEADRP C[C@H]([NH3+])[C@H]1CCC[N@H+](CC2CC(C)(C)C2)C1 ZINC000530213066 388627957 /nfs/dbraw/zinc/62/79/57/388627957.db2.gz TTYLTTHMKOAKFU-AAEUAGOBSA-N 2 0 224.392 2.482 20 0 BEADRP C[NH2+]CC1CC[NH+](CC2CC(C)(C)C2)CC1 ZINC000530210091 388627967 /nfs/dbraw/zinc/62/79/67/388627967.db2.gz LHOWCDIBRRAZHO-UHFFFAOYSA-N 2 0 224.392 2.354 20 0 BEADRP CC[C@@H]([NH2+][C@@H]1CC[NH2+]C12CCC2)C(C)C ZINC000530217461 388629974 /nfs/dbraw/zinc/62/99/74/388629974.db2.gz GQBWZNLADXFZKB-VXGBXAGGSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@@H]([NH3+])[C@@H]1CC[N@H+](CC2CC(C)(C)C2)C1 ZINC000530216406 388630290 /nfs/dbraw/zinc/63/02/90/388630290.db2.gz BHQYIMAWPYHNHG-ZYHUDNBSSA-N 2 0 210.365 2.092 20 0 BEADRP CC[C@H](C)[C@@H](C)[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000530216351 388630473 /nfs/dbraw/zinc/63/04/73/388630473.db2.gz AXPAGDWQOXAFPT-QJPTWQEYSA-N 2 0 210.365 2.295 20 0 BEADRP CC(C)[C@@H]1CCC[N@@H+]1CC[C@H]1CC[NH2+]C1 ZINC000251361057 388643032 /nfs/dbraw/zinc/64/30/32/388643032.db2.gz DHVUDBOQQPPAHM-OLZOCXBDSA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@H]([NH2+]CC[C@H]1CCC[N@@H+]1C)[C@H]1CCCO1 ZINC000248603830 388685423 /nfs/dbraw/zinc/68/54/23/388685423.db2.gz OPIULKKYDMHDCR-HZSPNIEDSA-N 2 0 240.391 2.018 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CCCSC)[C@@H](C)C1 ZINC000223736837 388658250 /nfs/dbraw/zinc/65/82/50/388658250.db2.gz JEZDTZNQDHXQGL-NWDGAFQWSA-N 2 0 230.421 2.059 20 0 BEADRP CC[C@H]([NH2+]CC[C@H]1CCC[N@@H+]1C)[C@@H]1CCCO1 ZINC000248603834 388685724 /nfs/dbraw/zinc/68/57/24/388685724.db2.gz OPIULKKYDMHDCR-RDBSUJKOSA-N 2 0 240.391 2.018 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]C[C@@H]2CCCCS2)C1 ZINC000227006723 388736746 /nfs/dbraw/zinc/73/67/46/388736746.db2.gz RBYJKEDBDWLPGK-UTUOFQBUSA-N 2 0 228.405 2.132 20 0 BEADRP C[C@H](CC1CC1)[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000251214398 388745998 /nfs/dbraw/zinc/74/59/98/388745998.db2.gz NCHMNIFHVAOTIW-XBFCOCLRSA-N 2 0 222.376 2.391 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@H]2CCC[N@H+](C)C2)C1 ZINC000251763260 388752417 /nfs/dbraw/zinc/75/24/17/388752417.db2.gz DSABJECGWJNNGA-UPJWGTAASA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000423559716 388694096 /nfs/dbraw/zinc/69/40/96/388694096.db2.gz UGQFNGBGGBZNDK-RMEBNNNOSA-N 2 0 236.403 2.399 20 0 BEADRP [NH3+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000521398903 388704440 /nfs/dbraw/zinc/70/44/40/388704440.db2.gz GMASNXQZSDUFSG-CQSZACIVSA-N 2 0 230.355 2.247 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@H]2C[C@@H]2C(F)F)[C@@H]2CCC[C@@H]21 ZINC000554095447 388800051 /nfs/dbraw/zinc/80/00/51/388800051.db2.gz FNDHLNSTAPQOMF-HTFCKZLJSA-N 2 0 244.329 2.102 20 0 BEADRP CCC(CC)C[NH2+][C@@H]1CC[N@H+](C)C[C@H]1C ZINC000252708760 388772315 /nfs/dbraw/zinc/77/23/15/388772315.db2.gz BAQNCAXKNZVKOY-DGCLKSJQSA-N 2 0 212.381 2.352 20 0 BEADRP CCOC[C@@H](C)[NH2+]CCC[NH+]1CCC(C)CC1 ZINC000128591892 388772841 /nfs/dbraw/zinc/77/28/41/388772841.db2.gz PECPFTDKAVEQKJ-CQSZACIVSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]CC2(C)CC2)CC1 ZINC000228828186 388774592 /nfs/dbraw/zinc/77/45/92/388774592.db2.gz XWLBPMIOIHMZJC-UHFFFAOYSA-N 2 0 210.365 2.249 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]CCOC2CCCCC2)C1 ZINC000093216152 388829787 /nfs/dbraw/zinc/82/97/87/388829787.db2.gz IXZOULNDXDFNFY-OLZOCXBDSA-N 2 0 240.391 2.195 20 0 BEADRP CC[NH+](CC)CCC[NH+]1C2CCC1CC2 ZINC000554803391 388830825 /nfs/dbraw/zinc/83/08/25/388830825.db2.gz NDMPTPOLUILLQC-UHFFFAOYSA-N 2 0 210.365 2.345 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CCCC2CC2)[C@H](C)C1 ZINC000129727947 388868361 /nfs/dbraw/zinc/86/83/61/388868361.db2.gz RSXUKPMYRCLOON-TZMCWYRMSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH2+]CCC[N@@H+]1CC[C@H](C)[C@H]2CCCC[C@H]21 ZINC000564989821 388906600 /nfs/dbraw/zinc/90/66/00/388906600.db2.gz IPAUNGXKZNNPLS-BFHYXJOUSA-N 2 0 224.392 2.497 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]CCC2CC(F)(F)C2)C1 ZINC000565226876 388929211 /nfs/dbraw/zinc/92/92/11/388929211.db2.gz OSVUKDXUMKVVAC-WDEREUQCSA-N 2 0 232.318 2.281 20 0 BEADRP CCC[NH2+]CC[NH2+][C@@H](C)C(C)(C)CC ZINC000565710351 388964676 /nfs/dbraw/zinc/96/46/76/388964676.db2.gz HBBSYAIMOYPBHZ-NSHDSACASA-N 2 0 200.370 2.400 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H]1CCC[C@H](C)[C@H]1C ZINC000566087903 388986541 /nfs/dbraw/zinc/98/65/41/388986541.db2.gz BVLZTMQSMZWHCK-YNEHKIRRSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H]([NH2+]CC1CC(C)(C)C1)[C@@H]1CCC[NH2+]1 ZINC000566091244 388987031 /nfs/dbraw/zinc/98/70/31/388987031.db2.gz KFTBCMQUZHCAGH-PWSUYJOCSA-N 2 0 210.365 2.153 20 0 BEADRP Cc1c[nH+]ccc1NCC1CC[NH+](C2CC2)CC1 ZINC000358917906 177650330 /nfs/dbraw/zinc/65/03/30/177650330.db2.gz XJFBLZHSXKAQOX-UHFFFAOYSA-N 2 0 245.370 2.098 20 0 BEADRP Cc1ccc(C[NH2+]CC2=CC[N@H+](C)CC2)s1 ZINC000271823046 389025933 /nfs/dbraw/zinc/02/59/33/389025933.db2.gz NGHSSWXAYDPGBU-UHFFFAOYSA-N 2 0 236.384 2.408 20 0 BEADRP C([NH2+][C@@H]1CCC[NH2+]CC1)[C@H]1CCCCS1 ZINC000168772924 533369010 /nfs/dbraw/zinc/36/90/10/533369010.db2.gz VPRWSIWPKDAOSU-VXGBXAGGSA-N 2 0 228.405 2.004 20 0 BEADRP C([NH2+][C@H]1CCC[NH2+]CC1)[C@@H]1CCCCS1 ZINC000168773003 533371873 /nfs/dbraw/zinc/37/18/73/533371873.db2.gz VPRWSIWPKDAOSU-RYUDHWBXSA-N 2 0 228.405 2.004 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)C1CCCC1)[C@H]1CCC[NH2+]1 ZINC000400378474 533495321 /nfs/dbraw/zinc/49/53/21/533495321.db2.gz JMFGYNGFYSLMHM-DMDPSCGWSA-N 2 0 210.365 2.295 20 0 BEADRP CC[C@H](C)[NH+]1CCN(c2cc[nH+]c(C)c2)CC1 ZINC000295899641 132221299 /nfs/dbraw/zinc/22/12/99/132221299.db2.gz FALUZLOKXJIBGO-ZDUSSCGKSA-N 2 0 233.359 2.311 20 0 BEADRP C[C@H]1C[C@H]1[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000052272861 132362114 /nfs/dbraw/zinc/36/21/14/132362114.db2.gz UHCJZRGFPDMTLK-SMDDNHRTSA-N 2 0 231.343 2.048 20 0 BEADRP C(C1CCC1)[NH+]1CCC([C@@H]2CCC[NH2+]2)CC1 ZINC000083839925 133561516 /nfs/dbraw/zinc/56/15/16/133561516.db2.gz DKUPRICHQCQCGK-AWEZNQCLSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@@H]1CCSCC[N@@H+]1CC[C@H]1CCC[NH+]1C ZINC000335938085 134013029 /nfs/dbraw/zinc/01/30/29/134013029.db2.gz OAFKSKFMSOHTBF-CHWSQXEVSA-N 2 0 242.432 2.298 20 0 BEADRP CC[N@H+](C)C[C@H]1CC[NH+](CC[C@@H](C)F)C1 ZINC000352003347 134034424 /nfs/dbraw/zinc/03/44/24/134034424.db2.gz LLXTYQZFSNGIHB-VXGBXAGGSA-N 2 0 216.344 2.008 20 0 BEADRP Cn1cccc1[C@@H]1CCC[N@@H+]1CC1CC[NH2+]CC1 ZINC000336053438 134061026 /nfs/dbraw/zinc/06/10/26/134061026.db2.gz XUKMLNIARFJXER-HNNXBMFYSA-N 2 0 247.386 2.162 20 0 BEADRP CSCCC[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000169241875 134250021 /nfs/dbraw/zinc/25/00/21/134250021.db2.gz ROIQVIAFHNZAHT-QWHCGFSZSA-N 2 0 236.384 2.474 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@@H]1CCCC[C@@H]1C ZINC000219154517 134274678 /nfs/dbraw/zinc/27/46/78/134274678.db2.gz FMZIHPBZNLKUQT-YNEHKIRRSA-N 2 0 212.381 2.495 20 0 BEADRP COCCC[C@H](C)[NH2+][C@H]1CCC[C@H]([NH+](C)C)C1 ZINC000178305198 134305987 /nfs/dbraw/zinc/30/59/87/134305987.db2.gz ISPSKAKNKBEYHR-IHRRRGAJSA-N 2 0 242.407 2.264 20 0 BEADRP C[C@H](CC[NH3+])[NH2+]Cc1ccc(Cl)s1 ZINC000220507653 134309200 /nfs/dbraw/zinc/30/92/00/134309200.db2.gz HIMHPIIKUGDOON-SSDOTTSWSA-N 2 0 218.753 2.228 20 0 BEADRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@@H](C)C1CCC1 ZINC000178377500 134309381 /nfs/dbraw/zinc/30/93/81/134309381.db2.gz OXQREBQKAOWKCT-JSGCOSHPSA-N 2 0 242.407 2.121 20 0 BEADRP Cc1ccc(C[NH2+][C@@H](C)CC[NH3+])c(C)c1 ZINC000220516452 134309528 /nfs/dbraw/zinc/30/95/28/134309528.db2.gz BBSUBJIQLDUDAO-LBPRGKRZSA-N 2 0 206.333 2.130 20 0 BEADRP C[C@H](CC[NH3+])[NH2+]Cc1coc2ccccc12 ZINC000220512890 134309612 /nfs/dbraw/zinc/30/96/12/134309612.db2.gz PAHYPLOHNGHXBX-SNVBAGLBSA-N 2 0 218.300 2.260 20 0 BEADRP Cc1cccc(C[NH2+][C@H](C)CC[NH3+])c1C ZINC000220528694 134309687 /nfs/dbraw/zinc/30/96/87/134309687.db2.gz MLXULTKRLHTUQM-LLVKDONJSA-N 2 0 206.333 2.130 20 0 BEADRP CSc1ccc(C[NH2+][C@@H](C)CC[NH3+])cc1 ZINC000220518808 134309780 /nfs/dbraw/zinc/30/97/80/134309780.db2.gz HKXYYRHBHFDAOA-JTQLQIEISA-N 2 0 224.373 2.235 20 0 BEADRP C(C1CC[NH2+]CC1)[N@@H+]1CCC[C@H]1C1CCC1 ZINC000178971067 134314151 /nfs/dbraw/zinc/31/41/51/134314151.db2.gz NVKDJDYBEJYSMM-AWEZNQCLSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@@H]1CCC[C@H](C)[N@H+](CC2CC[NH2+]CC2)C1 ZINC000178974079 134314179 /nfs/dbraw/zinc/31/41/79/134314179.db2.gz MGFOVQNMAVNECR-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H](C)C[N@H+](C)CC[C@@H]1CCC[NH+]1C ZINC000179309652 134320299 /nfs/dbraw/zinc/32/02/99/134320299.db2.gz FYJRRRQXCOKMFO-OLZOCXBDSA-N 2 0 212.381 2.449 20 0 BEADRP c1cn2c(cccc2C[NH2+]Cc2ccoc2)n1 ZINC000179420186 134320953 /nfs/dbraw/zinc/32/09/53/134320953.db2.gz UKFZYEOZQFOFDO-UHFFFAOYSA-N 2 0 227.267 2.217 20 0 BEADRP CC(C)C[C@H](C[NH2+]C[C@@H]1CCSC1)N(C)C ZINC000224307700 134345876 /nfs/dbraw/zinc/34/58/76/134345876.db2.gz WSKJQQXTTRIFIC-QWHCGFSZSA-N 2 0 244.448 2.305 20 0 BEADRP C[C@@H](C[NH2+]C[C@H]1CCSC1)C[NH+]1CCCC1 ZINC000224420457 134347214 /nfs/dbraw/zinc/34/72/14/134347214.db2.gz QLSQJDHRDHJLOA-QWHCGFSZSA-N 2 0 242.432 2.061 20 0 BEADRP CC(C)[C@@H]([NH3+])CC[N@H+](C)C[C@@H]1CCSC1 ZINC000224622058 134349474 /nfs/dbraw/zinc/34/94/74/134349474.db2.gz NAULQEGMBFCWCL-RYUDHWBXSA-N 2 0 230.421 2.045 20 0 BEADRP COCC[C@H](C)[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000227541266 134382940 /nfs/dbraw/zinc/38/29/40/134382940.db2.gz PGHKVUVKERTPKP-ZLKJLUDKSA-N 2 0 234.343 2.146 20 0 BEADRP CCN(C)CC[NH2+]C[C@@H]1CCC[C@@H](C)C1 ZINC000227552036 134383219 /nfs/dbraw/zinc/38/32/19/134383219.db2.gz OHKRTDLXXXAIOO-CHWSQXEVSA-N 2 0 212.381 2.354 20 0 BEADRP COc1ccc(C[N@H+](C)CCC[NH3+])cc1Cl ZINC000227744568 134392394 /nfs/dbraw/zinc/39/23/94/134392394.db2.gz VICJZWOQHILOKS-UHFFFAOYSA-N 2 0 242.750 2.129 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+][C@@H](C)c1ccccc1 ZINC000234741625 134585241 /nfs/dbraw/zinc/58/52/41/134585241.db2.gz GKSCJGJMMBHNJM-GXTWGEPZSA-N 2 0 236.359 2.091 20 0 BEADRP C[C@@H]([NH2+]CCCC[NH+](C)C)C1CCCC1 ZINC000054081440 134756480 /nfs/dbraw/zinc/75/64/80/134756480.db2.gz OTRREEUFPYILJC-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP [NH3+]CCCC[NH2+]Cc1ccc2ncccc2c1 ZINC000069502038 134900593 /nfs/dbraw/zinc/90/05/93/134900593.db2.gz MEDJXHXGSNVYQG-UHFFFAOYSA-N 2 0 229.327 2.063 20 0 BEADRP Cc1cccc(C[NH2+]CCC[NH2+]C2CC2)c1 ZINC000163443128 134986899 /nfs/dbraw/zinc/98/68/99/134986899.db2.gz QLARYSOMYOBMKV-UHFFFAOYSA-N 2 0 218.344 2.227 20 0 BEADRP C[C@H]1CCC[C@H]1[NH2+]CC1CC[NH+](C)CC1 ZINC000070828354 135014092 /nfs/dbraw/zinc/01/40/92/135014092.db2.gz HTPNMBAWTQQIKJ-WCQYABFASA-N 2 0 210.365 2.106 20 0 BEADRP CCN1CCC[C@H]1C[NH2+][C@H](C)C1(C)CC1 ZINC000248897557 135026626 /nfs/dbraw/zinc/02/66/26/135026626.db2.gz MYABEOKOYGZXEH-NEPJUHHUSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H]([NH2+][C@H]1C[C@@H](C)[N@H+](C)C[C@H]1C)C1CC1 ZINC000249331246 135037092 /nfs/dbraw/zinc/03/70/92/135037092.db2.gz WUSBWJKUCHKNBM-UZWSLXQKSA-N 2 0 210.365 2.103 20 0 BEADRP CC(C)OCCC[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000250577309 135053829 /nfs/dbraw/zinc/05/38/29/135053829.db2.gz FOPUAUSBUNVECE-KGLIPLIRSA-N 2 0 240.391 2.018 20 0 BEADRP CC[C@@H](C)C[N@H+](C)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000252018434 135082234 /nfs/dbraw/zinc/08/22/34/135082234.db2.gz WYOVUARAIRKMQA-FKJOKYEKSA-N 2 0 210.365 2.247 20 0 BEADRP C[C@H]1CCC[N@H+](CC2CC[NH2+]CC2)[C@H]1C ZINC000252126391 135084712 /nfs/dbraw/zinc/08/47/12/135084712.db2.gz KCSAISMNIWUKGG-RYUDHWBXSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@H]2CCCCS2)CC[N@@H+]1C ZINC000252148267 135085938 /nfs/dbraw/zinc/08/59/38/135085938.db2.gz OGCPYAHJXZQHBB-JHJVBQTASA-N 2 0 242.432 2.344 20 0 BEADRP C1CC([NH2+][C@H]2CCC[C@H]2[C@H]2CCCC[NH2+]2)C1 ZINC000086500060 135087372 /nfs/dbraw/zinc/08/73/72/135087372.db2.gz CNGPJEIAUDUBLH-MJBXVCDLSA-N 2 0 222.376 2.439 20 0 BEADRP C1CC1[NH2+][C@H]1CCC[C@@H]1[C@H]1CCCC[NH2+]1 ZINC000086499878 135087438 /nfs/dbraw/zinc/08/74/38/135087438.db2.gz ZKIHBVNAKCCARB-UPJWGTAASA-N 2 0 208.349 2.049 20 0 BEADRP C[C@@H]1CCC[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000252219231 135087959 /nfs/dbraw/zinc/08/79/59/135087959.db2.gz YOQHIUQNLZTACV-RKFYDKJMSA-N 2 0 222.376 2.390 20 0 BEADRP CCSCC[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000078031270 135090637 /nfs/dbraw/zinc/09/06/37/135090637.db2.gz JBXZAZWINFDZLG-UHFFFAOYSA-N 2 0 244.448 2.403 20 0 BEADRP Cc1csc([C@H](C)[NH2+]C2CCC([NH3+])CC2)n1 ZINC000086730392 135096026 /nfs/dbraw/zinc/09/60/26/135096026.db2.gz LBFAQWONSWFNNI-WHXUTIOJSA-N 2 0 239.388 2.372 20 0 BEADRP CC(C)CC[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C)C1 ZINC000252695928 135096606 /nfs/dbraw/zinc/09/66/06/135096606.db2.gz AYPGVLVFQCYHSV-KBPBESRZSA-N 2 0 224.392 2.449 20 0 BEADRP CSCC[C@@H](C)[N@H+](C)C[C@H]1CCC[NH2+]C1 ZINC000252690071 135096807 /nfs/dbraw/zinc/09/68/07/135096807.db2.gz TWDQYWZOJIZKNF-NEPJUHHUSA-N 2 0 230.421 2.059 20 0 BEADRP CC1CC([NH2+][C@@H]2C[C@H](C)[N@H+](C)C[C@H]2C)C1 ZINC000252728833 135103420 /nfs/dbraw/zinc/10/34/20/135103420.db2.gz CZKKEYFJCCWXLD-APSDNXJZSA-N 2 0 210.365 2.103 20 0 BEADRP Cc1cc(N2C[C@@H](C)[C@H]([NH3+])C2)c2ccccc2[nH+]1 ZINC000261551120 135109134 /nfs/dbraw/zinc/10/91/34/135109134.db2.gz SDXFWNMPBOQFLG-ZWNOBZJWSA-N 2 0 241.338 2.327 20 0 BEADRP C[C@@H]1C[C@H](C[NH+]2Cc3ccccc3C2)CC[NH2+]1 ZINC000261539970 135109140 /nfs/dbraw/zinc/10/91/40/135109140.db2.gz CVOGTYIDIURRIJ-CHWSQXEVSA-N 2 0 230.355 2.390 20 0 BEADRP C[C@@H]([NH2+]C1CCC(C(F)(F)F)CC1)[C@H](C)[NH3+] ZINC000261568934 135110038 /nfs/dbraw/zinc/11/00/38/135110038.db2.gz FZRAZBAQRLAIOS-AFWXGSBKSA-N 2 0 238.297 2.433 20 0 BEADRP COc1ccc(C)cc1C[N@@H+]1CC[C@@H]([C@H](C)[NH3+])C1 ZINC000252790998 135110615 /nfs/dbraw/zinc/11/06/15/135110615.db2.gz ZKKNUYLSCFVGML-QWHCGFSZSA-N 2 0 248.370 2.173 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]Cc1ccc(F)cc1 ZINC000252894787 135116312 /nfs/dbraw/zinc/11/63/12/135116312.db2.gz WQPXUVKWDCBGPF-BXUZGUMPSA-N 2 0 236.334 2.256 20 0 BEADRP C[C@@H]1CC[N@H+](Cc2cccc(F)c2)C[C@H]1C[NH3+] ZINC000253199033 135124092 /nfs/dbraw/zinc/12/40/92/135124092.db2.gz WCKKLOUOPSZFKP-DGCLKSJQSA-N 2 0 236.334 2.242 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@H]2CCCC[C@H]2C[NH3+])C1 ZINC000253285781 135126364 /nfs/dbraw/zinc/12/63/64/135126364.db2.gz OAUJZIDOXZYVBN-VOAKCMCISA-N 2 0 210.365 2.282 20 0 BEADRP CCCCC[NH+]1CCC([C@@H]2CC[NH2+]C2)CC1 ZINC000259138995 135137356 /nfs/dbraw/zinc/13/73/56/135137356.db2.gz DLXUUXJOVPXOJQ-CQSZACIVSA-N 2 0 224.392 2.498 20 0 BEADRP c1ccc(CC[NH+]2CCC3(CC[NH2+]C3)CC2)cc1 ZINC000257639688 135137921 /nfs/dbraw/zinc/13/79/21/135137921.db2.gz APERKWSQWTVZAW-UHFFFAOYSA-N 2 0 244.382 2.305 20 0 BEADRP CC(C)CC[NH+]1CCC2(CC[NH2+]C2)CC1 ZINC000257685124 135139236 /nfs/dbraw/zinc/13/92/36/135139236.db2.gz LYPJFEUOCWWWTG-UHFFFAOYSA-N 2 0 210.365 2.108 20 0 BEADRP Cc1ccc(C)c(C[N@@H+]2CC[C@]3(CC[NH2+]C3)C2)c1 ZINC000257737985 135140744 /nfs/dbraw/zinc/14/07/44/135140744.db2.gz YJESFOKPQNOMDY-INIZCTEOSA-N 2 0 244.382 2.489 20 0 BEADRP CC(C)[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH2+]C1 ZINC000257789557 135141525 /nfs/dbraw/zinc/14/15/25/135141525.db2.gz XGYZEFMDIWROOC-KGLIPLIRSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH2+]CCCN(C)Cc1ccc(F)c(C)c1 ZINC000087472267 135142959 /nfs/dbraw/zinc/14/29/59/135142959.db2.gz XIUDVIKOLIKXIA-UHFFFAOYSA-N 2 0 224.323 2.175 20 0 BEADRP C[NH2+]CCCN(C)Cc1ccc(C)s1 ZINC000087472299 135142969 /nfs/dbraw/zinc/14/29/69/135142969.db2.gz KZBVCHWVRWNHSN-UHFFFAOYSA-N 2 0 212.362 2.098 20 0 BEADRP CNCC[NH2+][C@@H]1C[C@H](C)CC[C@H]1C(C)C ZINC000261527263 135151239 /nfs/dbraw/zinc/15/12/39/135151239.db2.gz ILINFHFXQJYIOQ-FRRDWIJNSA-N 2 0 212.381 2.256 20 0 BEADRP C[C@@H]([NH3+])CN1CCC[C@H]1c1ccsc1 ZINC000261529061 135155207 /nfs/dbraw/zinc/15/52/07/135155207.db2.gz AFUAFBCHHIXVQG-KOLCDFICSA-N 2 0 210.346 2.232 20 0 BEADRP CC[C@H]([NH2+][C@H](C)[C@@H](C)[NH3+])c1ccccc1 ZINC000261530267 135157619 /nfs/dbraw/zinc/15/76/19/135157619.db2.gz CDCRCTIXXRHFIV-WZRBSPASSA-N 2 0 206.333 2.463 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+][C@@H]1CCCC1(C)C ZINC000261530600 135158115 /nfs/dbraw/zinc/15/81/15/135158115.db2.gz CUFCAXXKWVDTMV-IJLUTSLNSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]C[C@@H]2CCC[NH2+]2)[C@H]1C ZINC000261530823 135158739 /nfs/dbraw/zinc/15/87/39/135158739.db2.gz DFSJYTCDCBXGBU-VOAKCMCISA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH3+])[C@H](C)[NH2+]C[C@@H](C)c1ccccc1 ZINC000261531657 135161061 /nfs/dbraw/zinc/16/10/61/135161061.db2.gz HKLLTGQAVHNDHM-WOPDTQHZSA-N 2 0 206.333 2.115 20 0 BEADRP C[C@H]1C[C@H](C[NH3+])C[N@@H+]1CCC1CCCC1 ZINC000261531589 135161239 /nfs/dbraw/zinc/16/12/39/135161239.db2.gz HEGSHJVHWVDGEM-WCQYABFASA-N 2 0 210.365 2.236 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[NH2+]C1)C1CCCC1 ZINC000087647309 135161343 /nfs/dbraw/zinc/16/13/43/135161343.db2.gz LYBKILNMIGMTHZ-NWDGAFQWSA-N 2 0 210.365 2.154 20 0 BEADRP CC1CCC([NH2+]C[C@H]2CCC[NH2+]C2)CC1 ZINC000087646012 135161382 /nfs/dbraw/zinc/16/13/82/135161382.db2.gz RTVILVUEDVOYSA-CPCZMJQVSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]C[C@@H]2CCC[NH2+]C2)C1 ZINC000087646343 135161384 /nfs/dbraw/zinc/16/13/84/135161384.db2.gz JACKSXYTNGWUCF-JHJVBQTASA-N 2 0 210.365 2.154 20 0 BEADRP Cc1[nH+]ccc(N[C@@H]2CCC[NH2+]C2)c1Cl ZINC000261531913 135162119 /nfs/dbraw/zinc/16/21/19/135162119.db2.gz IJJBHONITIDGQA-SECBINFHSA-N 2 0 225.723 2.207 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[NH2+]C[C@H]1C)c1ccsc1 ZINC000261532227 135162434 /nfs/dbraw/zinc/16/24/34/135162434.db2.gz JRYRWXZGJWXDDE-SCVCMEIPSA-N 2 0 224.373 2.397 20 0 BEADRP CC1(C)CC[C@H]1[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000261532601 135163234 /nfs/dbraw/zinc/16/32/34/135163234.db2.gz JXNUEOUCORBLLO-YPMHNXCESA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H](C[C@H]1CCCCC[NH2+]1)[NH2+][C@H]1CCSC1 ZINC000261533918 135165832 /nfs/dbraw/zinc/16/58/32/135165832.db2.gz LFRXWXHHKJRCCX-UPJWGTAASA-N 2 0 242.432 2.392 20 0 BEADRP Cc1ccc(C)c(CN2C[C@H](C)[C@H]([NH3+])C2)c1 ZINC000261534253 135166752 /nfs/dbraw/zinc/16/67/52/135166752.db2.gz PASPCRFCOCPAPP-GXTWGEPZSA-N 2 0 218.344 2.082 20 0 BEADRP CC[N@H+](CC1CCC1)C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000261534466 135166942 /nfs/dbraw/zinc/16/69/42/135166942.db2.gz QSRIDKGPERMGCK-TZMCWYRMSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2C[C@@H]3CCC[C@@H]3C2)CC[NH2+]1 ZINC000261535000 135168651 /nfs/dbraw/zinc/16/86/51/135168651.db2.gz VLRLSDLJSDDBBN-SYQHCUMBSA-N 2 0 222.376 2.106 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+]C[C@H]1CCC[C@H]([NH3+])C1 ZINC000261535057 135168901 /nfs/dbraw/zinc/16/89/01/135168901.db2.gz NPEFDBDQWIEZCJ-SRVKXCTJSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+][C@@H]1CCC(C)(C)C1 ZINC000261536361 135171096 /nfs/dbraw/zinc/17/10/96/135171096.db2.gz RJROZGJAIQMICC-IJLUTSLNSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1CC[C@H]([N@H+](C)C[C@H]2CCC[NH2+]C2)C1 ZINC000261536746 135172048 /nfs/dbraw/zinc/17/20/48/135172048.db2.gz STWCNQFYYRDJCH-AGIUHOORSA-N 2 0 210.365 2.106 20 0 BEADRP CC[N@H+](CC(C)C)C[C@H]1CC[NH2+][C@H](C)C1 ZINC000261536882 135172822 /nfs/dbraw/zinc/17/28/22/135172822.db2.gz UBVWLVHWMKHXQM-OLZOCXBDSA-N 2 0 212.381 2.352 20 0 BEADRP CCC[C@@H]1C[C@@H]1[NH2+][C@@H]1CCCC[C@@H]1C[NH3+] ZINC000261537907 135174640 /nfs/dbraw/zinc/17/46/40/135174640.db2.gz WQFKQQDPDDADMJ-LPWJVIDDSA-N 2 0 210.365 2.282 20 0 BEADRP CC[C@@H]1CC[N@H+](C[C@@H]2CC[NH2+][C@H](C)C2)C1 ZINC000261538469 135176141 /nfs/dbraw/zinc/17/61/41/135176141.db2.gz YFKGEZUVMPFYGK-JHJVBQTASA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)SCC[NH2+][C@H]1CCCC[C@H]1C[NH3+] ZINC000261538720 135176310 /nfs/dbraw/zinc/17/63/10/135176310.db2.gz ZBJRIAHAIQSIKJ-RYUDHWBXSA-N 2 0 230.421 2.235 20 0 BEADRP CC[C@@H]1C[C@@H](C)C[N@@H+]1CC1CC[NH2+]CC1 ZINC000261539019 135177360 /nfs/dbraw/zinc/17/73/60/135177360.db2.gz BJONZPNEMNGSHX-DGCLKSJQSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1C[N@@H+]([C@H]2CCCc3ccccc32)C[C@H]1[NH3+] ZINC000261540052 135178612 /nfs/dbraw/zinc/17/86/12/135178612.db2.gz DEILVRRDRKFJOK-DFBGVHRSSA-N 2 0 230.355 2.343 20 0 BEADRP C[C@H](C[NH3+])N(C)CCSc1ccccc1 ZINC000261539700 135178931 /nfs/dbraw/zinc/17/89/31/135178931.db2.gz DAAAAHLQGLKJTG-LLVKDONJSA-N 2 0 224.373 2.058 20 0 BEADRP CCc1ccccc1C[N@@H+]1CC[C@@](C)(C[NH3+])C1 ZINC000261541251 135180645 /nfs/dbraw/zinc/18/06/45/135180645.db2.gz BAJWBVHNHGCULZ-HNNXBMFYSA-N 2 0 232.371 2.420 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]CC[C@H]1CCCCO1 ZINC000261542205 135182657 /nfs/dbraw/zinc/18/26/57/135182657.db2.gz NSYQRFYQGDCNLK-BFHYXJOUSA-N 2 0 240.391 2.053 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CC[NH2+]CC2(C)C)cc1 ZINC000261543384 135183948 /nfs/dbraw/zinc/18/39/48/135183948.db2.gz DAUZKLWLPSGMHL-CQSZACIVSA-N 2 0 232.371 2.473 20 0 BEADRP CCO[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H]([NH3+])C2)C1(C)C ZINC000261544458 135185330 /nfs/dbraw/zinc/18/53/30/135185330.db2.gz YFNCRNSLQOBOBF-FVCCEPFGSA-N 2 0 240.391 2.050 20 0 BEADRP Cc1cc(N2C[C@H](C)[C@H]([NH3+])C2)c2ccccc2[nH+]1 ZINC000261551117 135190149 /nfs/dbraw/zinc/19/01/49/135190149.db2.gz SDXFWNMPBOQFLG-GXFFZTMASA-N 2 0 241.338 2.327 20 0 BEADRP Cc1cccc(C[N@@H+]2CC[C@H]3[NH2+]CC[C@H]3C2)c1C ZINC000261553062 135192422 /nfs/dbraw/zinc/19/24/22/135192422.db2.gz ABOOVRFOPLPRTJ-JKSUJKDBSA-N 2 0 244.382 2.487 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@@H]1C[NH3+])c1ccco1 ZINC000084218867 135192482 /nfs/dbraw/zinc/19/24/82/135192482.db2.gz NTUXZPQNSBPZOO-HBNTYKKESA-N 2 0 208.305 2.058 20 0 BEADRP C[C@H](CC1CC1)[NH2+][C@@H]1CCCC[C@@H]1C[NH3+] ZINC000084216921 135193126 /nfs/dbraw/zinc/19/31/26/135193126.db2.gz GFZOIPZEYWVBPU-RAIGVLPGSA-N 2 0 210.365 2.282 20 0 BEADRP CC1(C)CCC(C[N@H+]2C[C@H]3C[NH2+]C[C@H]3C2)CC1 ZINC000261553836 135193608 /nfs/dbraw/zinc/19/36/08/135193608.db2.gz OGTZZHDLIRRYIY-OKILXGFUSA-N 2 0 236.403 2.354 20 0 BEADRP Cc1ncccc1C[N@@H+]1CCCC[C@@H]1CC[NH3+] ZINC000261555232 135195518 /nfs/dbraw/zinc/19/55/18/135195518.db2.gz PNPYHRSLIVLPQN-CQSZACIVSA-N 2 0 233.359 2.093 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[NH2+]C[C@@H]1C)c1ccc(F)cc1 ZINC000261558429 135199264 /nfs/dbraw/zinc/19/92/64/135199264.db2.gz SJMSFSURCXEBPR-COPLHBTASA-N 2 0 236.334 2.474 20 0 BEADRP C(C[N@@H+]1CC[C@H]2C[NH2+]C[C@@H]2C1)C1CCCC1 ZINC000261560707 135202306 /nfs/dbraw/zinc/20/23/06/135202306.db2.gz AEJADTCRJHQOOG-UONOGXRCSA-N 2 0 222.376 2.108 20 0 BEADRP CCc1ccc(C[N@@H+]2CC[C@H]3C[NH2+]C[C@H]3C2)cc1 ZINC000261561596 135202691 /nfs/dbraw/zinc/20/26/91/135202691.db2.gz FZSFWDYBRZCXMJ-HOTGVXAUSA-N 2 0 244.382 2.290 20 0 BEADRP C[C@@H]1[C@H]([NH3+])CCN1Cc1coc2ccccc12 ZINC000261563689 135205068 /nfs/dbraw/zinc/20/50/68/135205068.db2.gz XDIKNKOHFXWATR-ZWNOBZJWSA-N 2 0 230.311 2.354 20 0 BEADRP Fc1cccc(CN2CC[C@H]3[NH2+]CC[C@@H]3C2)c1 ZINC000261563401 135205147 /nfs/dbraw/zinc/20/51/47/135205147.db2.gz XBCRYJORSRBKLU-TZMCWYRMSA-N 2 0 234.318 2.010 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2CCc3ccccc3C2)CC[NH2+]1 ZINC000261565090 135206891 /nfs/dbraw/zinc/20/68/91/135206891.db2.gz HNOUVSUKFPDUMS-ZIAGYGMSSA-N 2 0 244.382 2.433 20 0 BEADRP Cc1cccc(C[N@@H+]2CC[C@](C)(C[NH3+])C2)c1C ZINC000261565874 135207405 /nfs/dbraw/zinc/20/74/05/135207405.db2.gz YPUFJQBWKGSRHY-OAHLLOKOSA-N 2 0 232.371 2.474 20 0 BEADRP Cc1cccc(C[N@@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@H]3C2)c1C ZINC000261565664 135207994 /nfs/dbraw/zinc/20/79/94/135207994.db2.gz HXAQDRVUJNSRLH-HRCADAONSA-N 2 0 244.382 2.473 20 0 BEADRP Cc1cccc(C[N@@H+]2CC[C@H]3C[NH2+]C[C@H]3C2)c1C ZINC000261569479 135211149 /nfs/dbraw/zinc/21/11/49/135211149.db2.gz JWNAPEQBXWNWAX-HOCLYGCPSA-N 2 0 244.382 2.345 20 0 BEADRP Cc1ccc(C[N@@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@H]3C2)cc1C ZINC000261569197 135211190 /nfs/dbraw/zinc/21/11/90/135211190.db2.gz JPTRGPMHCOVEIA-HRCADAONSA-N 2 0 244.382 2.473 20 0 BEADRP Cc1cccc(C[N@@H+]2CC[C@H]3C[NH2+]C[C@@H]3C2)c1C ZINC000261569478 135211423 /nfs/dbraw/zinc/21/14/23/135211423.db2.gz JWNAPEQBXWNWAX-GOEBONIOSA-N 2 0 244.382 2.345 20 0 BEADRP CCSCCC[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000164030826 135212170 /nfs/dbraw/zinc/21/21/70/135212170.db2.gz UUSDBDCPOYMSRM-NEPJUHHUSA-N 2 0 230.421 2.202 20 0 BEADRP C[N@H+](CC1(C)CCC1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000261575066 135216563 /nfs/dbraw/zinc/21/65/63/135216563.db2.gz JOQQJIJFWFSHLR-FUNVUKJBSA-N 2 0 222.376 2.391 20 0 BEADRP Cc1ccc(C[NH2+][C@@](C)(C[NH3+])C(C)C)cc1 ZINC000261575430 135216708 /nfs/dbraw/zinc/21/67/08/135216708.db2.gz JRYNUCDONJQCOP-AWEZNQCLSA-N 2 0 220.360 2.458 20 0 BEADRP Cc1cc(F)ccc1CN1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000261576474 135217725 /nfs/dbraw/zinc/21/77/25/135217725.db2.gz NQXHUKXOXULNQA-TZMCWYRMSA-N 2 0 248.345 2.175 20 0 BEADRP Cc1[nH+]ccc(N2C[C@@H](C)[NH2+]C[C@@H]2C)c1Cl ZINC000261576980 135218709 /nfs/dbraw/zinc/21/87/09/135218709.db2.gz KSFQLJPTZAUGSC-BDAKNGLRSA-N 2 0 239.750 2.230 20 0 BEADRP Cc1ccoc1C[NH2+][C@H]1CCCC[C@@H]1C[NH3+] ZINC000261579249 135219615 /nfs/dbraw/zinc/21/96/15/135219615.db2.gz MHMYHGZACUBKOJ-NEPJUHHUSA-N 2 0 222.332 2.195 20 0 BEADRP CC1(C[N@@H+]2C[C@@H]3CCC[C@H]([NH3+])[C@H]3C2)CCC1 ZINC000261580786 135221817 /nfs/dbraw/zinc/22/18/17/135221817.db2.gz NDJFEOZGWJGZGI-AVGNSLFASA-N 2 0 222.376 2.236 20 0 BEADRP Cc1cc(C)cc(C[N@@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@H]3C2)c1 ZINC000261583185 135224011 /nfs/dbraw/zinc/22/40/11/135224011.db2.gz RQZSOLQXXCRMCT-HRCADAONSA-N 2 0 244.382 2.473 20 0 BEADRP Cc1[nH+]ccc(NCC[C@H]2CC[NH2+]C2)c1Cl ZINC000261584393 135224875 /nfs/dbraw/zinc/22/48/75/135224875.db2.gz PUYQBULPCZJSRC-SNVBAGLBSA-N 2 0 239.750 2.455 20 0 BEADRP C[C@H](C[N@@H+]1C[C@@H]2CC[C@H]([NH3+])[C@H]2C1)c1ccccc1 ZINC000261585223 135225726 /nfs/dbraw/zinc/22/57/26/135225726.db2.gz SWEFSVPLJLCQKM-OEAJRASXSA-N 2 0 244.382 2.459 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[NH2+]C[C@@H]2C)C[C@H]1C ZINC000261586987 135228413 /nfs/dbraw/zinc/22/84/13/135228413.db2.gz RLOLMQJTJSSXLZ-PEBLQZBPSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@H]([NH3+])[C@H](C)[NH2+]C1C2CC3CC(C2)CC1C3 ZINC000261589028 135229263 /nfs/dbraw/zinc/22/92/63/135229263.db2.gz SUWQYLJTWHUURA-AQHGOLAQSA-N 2 0 222.376 2.136 20 0 BEADRP [NH3+][C@@H]1CC[C@@H]2C[N@H+](C/C=C/c3ccccc3)C[C@H]12 ZINC000261589264 135230449 /nfs/dbraw/zinc/23/04/49/135230449.db2.gz WEYFXHHMOUYZGT-UENUHNEHSA-N 2 0 242.366 2.369 20 0 BEADRP Cc1cccc(C)c1C[N@@H+]1CC[C@@H]2[NH2+]CC[C@@H]2C1 ZINC000261593520 135234023 /nfs/dbraw/zinc/23/40/23/135234023.db2.gz ZFNACOHVQZINRO-ZBFHGGJFSA-N 2 0 244.382 2.487 20 0 BEADRP Cc1cccc(C)c1C[N@@H+]1CC[C@@H]2[NH2+]CC[C@H]2C1 ZINC000261593519 135234364 /nfs/dbraw/zinc/23/43/64/135234364.db2.gz ZFNACOHVQZINRO-HOCLYGCPSA-N 2 0 244.382 2.487 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@@H]3C[NH2+]C[C@H]3C2)s1 ZINC000261597502 135236784 /nfs/dbraw/zinc/23/67/84/135236784.db2.gz ZDOLFHVFOUEKDZ-NEPJUHHUSA-N 2 0 236.384 2.098 20 0 BEADRP CC[C@@H]1C[C@@H](C)C[N@@H+]1C[C@H]1CCC[NH2+]C1 ZINC000261546361 135238235 /nfs/dbraw/zinc/23/82/35/135238235.db2.gz KWYUBRNJUFHSOI-FRRDWIJNSA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@@H]1C[C@H](C)C[N@@H+]1C[C@@H]1CCC[NH2+]C1 ZINC000261546364 135238727 /nfs/dbraw/zinc/23/87/27/135238727.db2.gz KWYUBRNJUFHSOI-YNEHKIRRSA-N 2 0 210.365 2.106 20 0 BEADRP CCC[N@H+](C[C@H]1C[C@H]1C)C1CC[NH2+]CC1 ZINC000261547318 135240151 /nfs/dbraw/zinc/24/01/51/135240151.db2.gz MCHPFPOSWMXQQB-VXGBXAGGSA-N 2 0 210.365 2.106 20 0 BEADRP CCC[N@H+](C[C@@H]1C[C@H]1C)C1CC[NH2+]CC1 ZINC000261547315 135240500 /nfs/dbraw/zinc/24/05/00/135240500.db2.gz MCHPFPOSWMXQQB-NEPJUHHUSA-N 2 0 210.365 2.106 20 0 BEADRP Clc1ccc(C[NH2+]CC[C@H]2CC[NH2+]C2)s1 ZINC000084386078 135244500 /nfs/dbraw/zinc/24/45/00/135244500.db2.gz SXNGYVZPUGRXHO-SECBINFHSA-N 2 0 244.791 2.491 20 0 BEADRP CC(C)[N@@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000261715714 135247287 /nfs/dbraw/zinc/24/72/87/135247287.db2.gz KRVUHEKCIQFCRK-KGLIPLIRSA-N 2 0 218.344 2.069 20 0 BEADRP CC(C)[C@@H]1C[N@H+](C[C@]2(C)CC[NH2+]C2)CCS1 ZINC000261729282 135248243 /nfs/dbraw/zinc/24/82/43/135248243.db2.gz GZBJBWCMIQPTKL-QWHCGFSZSA-N 2 0 242.432 2.059 20 0 BEADRP C[C@@H]1CC2(CCC2)C[N@@H+]1C[C@]1(C)CC[NH2+]C1 ZINC000261740106 135249200 /nfs/dbraw/zinc/24/92/00/135249200.db2.gz IHBACOPDXKTAJN-CHWSQXEVSA-N 2 0 222.376 2.251 20 0 BEADRP Fc1cccc2c1CN(C[C@@H]1CCC[NH2+]C1)CC2 ZINC000261760796 135250589 /nfs/dbraw/zinc/25/05/89/135250589.db2.gz CZCWZCCEKBNAGN-GFCCVEGCSA-N 2 0 248.345 2.183 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH+]1CCC([C@@H]2CCC[NH2+]2)CC1 ZINC000261760765 135250815 /nfs/dbraw/zinc/25/08/15/135250815.db2.gz CYDVLUXSSZRSKX-BNOWGMLFSA-N 2 0 222.376 2.106 20 0 BEADRP C(C1CC1)[N@H+](CC1CCC1)C[C@H]1CCC[NH2+]C1 ZINC000261783767 135252547 /nfs/dbraw/zinc/25/25/47/135252547.db2.gz OALNXKYHHSTHOE-HNNXBMFYSA-N 2 0 236.403 2.498 20 0 BEADRP COc1cc(C[N@@H+]2C[C@H](C[NH3+])C[C@H]2C)ccc1C ZINC000261787633 135252982 /nfs/dbraw/zinc/25/29/82/135252982.db2.gz FYYJGFKQUCXKPM-OCCSQVGLSA-N 2 0 248.370 2.173 20 0 BEADRP C[C@H]1C[C@@H]1C[NH+]1CCC([NH2+]CC2CC2)CC1 ZINC000261948516 135264836 /nfs/dbraw/zinc/26/48/36/135264836.db2.gz NNXTWXZFEUVSCU-WCQYABFASA-N 2 0 222.376 2.106 20 0 BEADRP Cc1ccc(C[N@@H+](C)C[C@@]2(C)CC[NH2+]C2)s1 ZINC000261953955 135265678 /nfs/dbraw/zinc/26/56/78/135265678.db2.gz GJOWFQNWBMPHSI-ZDUSSCGKSA-N 2 0 238.400 2.488 20 0 BEADRP C[C@@H](C[NH+]1CCC([NH3+])CC1)c1ccc(F)cc1 ZINC000261953064 135266502 /nfs/dbraw/zinc/26/65/02/135266502.db2.gz OGIRYWHIWMHQAF-NSHDSACASA-N 2 0 236.334 2.352 20 0 BEADRP C[C@@H]1C[C@H]1C[N@@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000262017355 135272951 /nfs/dbraw/zinc/27/29/51/135272951.db2.gz VUNZJOKHBPPRGI-BVUBDWEXSA-N 2 0 244.382 2.317 20 0 BEADRP COc1cc(C[N@@H+]2CC[C@@H]([NH3+])[C@@H](C)C2)ccc1C ZINC000262016355 135273059 /nfs/dbraw/zinc/27/30/59/135273059.db2.gz VSZYROQXOODIGO-GXTWGEPZSA-N 2 0 248.370 2.173 20 0 BEADRP FC(F)C[N@H+](CC1CCC1)CC1CC[NH2+]CC1 ZINC000262013768 135273118 /nfs/dbraw/zinc/27/31/18/135273118.db2.gz VIXLBXQBDTYBFI-UHFFFAOYSA-N 2 0 246.345 2.353 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000262017359 135273264 /nfs/dbraw/zinc/27/32/64/135273264.db2.gz VUNZJOKHBPPRGI-MIGQKNRLSA-N 2 0 244.382 2.317 20 0 BEADRP COc1cc(C[NH2+]C2CCC([NH3+])CC2)ccc1C ZINC000262026688 135274251 /nfs/dbraw/zinc/27/42/51/135274251.db2.gz WQPDABGNZILYBD-UHFFFAOYSA-N 2 0 248.370 2.363 20 0 BEADRP C[C@@H]1Cc2ccccc2C[N@@H+]1C[C@@]1(C)CC[NH2+]C1 ZINC000262118910 135279924 /nfs/dbraw/zinc/27/99/24/135279924.db2.gz XDZSNOYQAKZAKZ-CJNGLKHVSA-N 2 0 244.382 2.433 20 0 BEADRP Cc1ccc(OC2CCN(CC[NH3+])CC2)cc1C ZINC000262891829 135323038 /nfs/dbraw/zinc/32/30/38/135323038.db2.gz CNJSQKXAHQXKNJ-UHFFFAOYSA-N 2 0 248.370 2.105 20 0 BEADRP C[NH+](C)CCC[NH2+][C@H]1CCC[C@@H](C2CC2)C1 ZINC000081624259 135388493 /nfs/dbraw/zinc/38/84/93/135388493.db2.gz VTVATOHGEBIAKP-KGLIPLIRSA-N 2 0 224.392 2.497 20 0 BEADRP [NH3+]C[C@@H]1CCC[N@H+](Cc2ccc3c(c2)CCC3)C1 ZINC000078793936 135396029 /nfs/dbraw/zinc/39/60/29/135396029.db2.gz KJKXIHGVGYADEX-AWEZNQCLSA-N 2 0 244.382 2.346 20 0 BEADRP CC[C@@H](COC)[NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000079707270 135397235 /nfs/dbraw/zinc/39/72/35/135397235.db2.gz SVVDAXKQKLKJBE-NSHDSACASA-N 2 0 242.407 2.310 20 0 BEADRP CC[C@@H](COC)[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000079713029 135397338 /nfs/dbraw/zinc/39/73/38/135397338.db2.gz QDROPGKAPAJRIU-LBPRGKRZSA-N 2 0 242.407 2.264 20 0 BEADRP C[C@]1([NH2+]CC2CC[NH2+]CC2)CC=CCC1 ZINC000334853302 135405938 /nfs/dbraw/zinc/40/59/38/135405938.db2.gz JGCPMKDLDQVZRB-ZDUSSCGKSA-N 2 0 208.349 2.074 20 0 BEADRP C[C@H]1CCCC[C@H]1C[NH+]1CCC(C[NH3+])CC1 ZINC000346688372 135475907 /nfs/dbraw/zinc/47/59/07/135475907.db2.gz NPVJTAPAAHBSGS-JSGCOSHPSA-N 2 0 224.392 2.483 20 0 BEADRP CCO[C@@H]1C[C@@H]([NH2+]CCCC[NH+](C)C)C1(C)C ZINC000085398157 135483625 /nfs/dbraw/zinc/48/36/25/135483625.db2.gz SMFXBJPMXQLNAL-CHWSQXEVSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H](C[C@H]1CCC[NH2+]1)[NH2+]CCc1cccs1 ZINC000086494983 135492730 /nfs/dbraw/zinc/49/27/30/135492730.db2.gz XBJGKLGOFMTUGY-NWDGAFQWSA-N 2 0 238.400 2.411 20 0 BEADRP C[C@@H]1CC[C@@H](C[NH2+]C2CCC([NH3+])CC2)C1 ZINC000230412522 135535686 /nfs/dbraw/zinc/53/56/86/135535686.db2.gz MWLCJROPNXIADJ-OKZRHMCRSA-N 2 0 210.365 2.282 20 0 BEADRP c1ccc([C@@H]2CC[N@@H+](CC[C@@H]3CC[NH2+]C3)C2)cc1 ZINC000089749381 135541212 /nfs/dbraw/zinc/54/12/12/135541212.db2.gz WEHQXUMYSGVZNU-GOEBONIOSA-N 2 0 244.382 2.476 20 0 BEADRP CC[C@@H](COC)[NH2+]C1CCC(C[NH+](C)C)CC1 ZINC000090707192 135552279 /nfs/dbraw/zinc/55/22/79/135552279.db2.gz FTAUYOXJIQYTIP-MOKVOYLWSA-N 2 0 242.407 2.121 20 0 BEADRP CCC(CC)C[NH+]1CCC(OCCC[NH3+])CC1 ZINC000094070108 135610535 /nfs/dbraw/zinc/61/05/35/135610535.db2.gz SAZGGPRHEGBMOG-UHFFFAOYSA-N 2 0 242.407 2.252 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]Cc1ccccc1 ZINC000335024913 135866894 /nfs/dbraw/zinc/86/68/94/135866894.db2.gz PMGFEVZELPQVIY-OCCSQVGLSA-N 2 0 218.344 2.164 20 0 BEADRP Cc1ccnc([C@H](C)[NH2+]C2CCC([NH3+])CC2)c1 ZINC000335050595 135873482 /nfs/dbraw/zinc/87/34/82/135873482.db2.gz ORQWWZAQENPBMR-HIFPTAJRSA-N 2 0 233.359 2.311 20 0 BEADRP [NH3+]C1CCC([NH2+][C@@H]2CCC23CCC3)CC1 ZINC000335052914 135874503 /nfs/dbraw/zinc/87/45/03/135874503.db2.gz WEEQDXYPPRGPBO-HTAVTVPLSA-N 2 0 208.349 2.179 20 0 BEADRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@H](CC)C1CC1 ZINC000166050724 135930635 /nfs/dbraw/zinc/93/06/35/135930635.db2.gz MNIOGYZBSAICOW-UONOGXRCSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H]1CCCC[C@H]1C[N@H+](C)C1CC[NH2+]CC1 ZINC000335336882 136044665 /nfs/dbraw/zinc/04/46/65/136044665.db2.gz VNOOMWHPTMTKEF-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)CC[N@@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC000335321078 136049779 /nfs/dbraw/zinc/04/97/79/136049779.db2.gz KMOFQYPFKBCJBA-ZDUSSCGKSA-N 2 0 210.365 2.060 20 0 BEADRP Cc1cnc([C@H](C)[N@@H+]2CCC3(C2)CC[NH2+]CC3)o1 ZINC000335390833 136090762 /nfs/dbraw/zinc/09/07/62/136090762.db2.gz BDGUXKYCRQOTSI-LBPRGKRZSA-N 2 0 249.358 2.120 20 0 BEADRP Fc1ccc2c(c1)[C@@H]([NH2+]CC1C[NH2+]C1)CCC2 ZINC000335551531 136098198 /nfs/dbraw/zinc/09/81/98/136098198.db2.gz GSPFSWGTXSWICK-AWEZNQCLSA-N 2 0 234.318 2.012 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+]CC1C[NH2+]C1)CCC2 ZINC000335552528 136098412 /nfs/dbraw/zinc/09/84/12/136098412.db2.gz OFPGFGBYBDEDEI-OAHLLOKOSA-N 2 0 230.355 2.181 20 0 BEADRP C[C@H]1CCc2c(F)cccc2[C@H]1[NH2+]CC1C[NH2+]C1 ZINC000335553062 136098962 /nfs/dbraw/zinc/09/89/62/136098962.db2.gz STZVDGFCNOPRGJ-BONVTDFDSA-N 2 0 248.345 2.258 20 0 BEADRP CC[C@H](C)C[N@@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC000335571544 136109939 /nfs/dbraw/zinc/10/99/39/136109939.db2.gz FLVRDMSGMPPFBC-QWHCGFSZSA-N 2 0 210.365 2.060 20 0 BEADRP C[NH2+]C[C@@H]1C[C@H](F)CN1C[C@@H](C)C(C)(C)C ZINC000647540549 397782415 /nfs/dbraw/zinc/78/24/15/397782415.db2.gz ZRDHJTGCQQGMCN-WOPDTQHZSA-N 2 0 230.371 2.300 20 0 BEADRP C[C@H]([NH2+]C1CCC([NH3+])CC1)[C@@H]1CC1(C)C ZINC000335652521 397786583 /nfs/dbraw/zinc/78/65/83/397786583.db2.gz IZRJQBCLPYDFQU-XKGSQUFQSA-N 2 0 210.365 2.281 20 0 BEADRP CC[C@H]1CC[C@@H](C)[N@@H+]1CCn1ccnc1C ZINC000357525650 397937544 /nfs/dbraw/zinc/93/75/44/397937544.db2.gz FAEXDRCPKLIXAV-YPMHNXCESA-N 2 0 221.348 2.454 20 0 BEADRP CN(C)c1cccc(C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)c1 ZINC000517177196 397939834 /nfs/dbraw/zinc/93/98/34/397939834.db2.gz XEMNFEMXOPJOBN-ZIAGYGMSSA-N 2 0 247.386 2.112 20 0 BEADRP [NH3+][C@H]1CCC[C@H](Nc2cc[nH+]c3ccccc23)C1 ZINC000382460032 397951466 /nfs/dbraw/zinc/95/14/66/397951466.db2.gz URADUHFKVCDZGB-RYUDHWBXSA-N 2 0 241.338 2.339 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000449079190 397951475 /nfs/dbraw/zinc/95/14/75/397951475.db2.gz XPQGHSZADYYIGK-TZMCWYRMSA-N 2 0 248.370 2.285 20 0 BEADRP C[C@@H](Cc1ccoc1)[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000449079188 397951550 /nfs/dbraw/zinc/95/15/50/397951550.db2.gz XPQGHSZADYYIGK-JSGCOSHPSA-N 2 0 248.370 2.285 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)[C@@H]1C ZINC000385668402 397952751 /nfs/dbraw/zinc/95/27/51/397952751.db2.gz PHYKOMFUNCNUIC-JRBXHMHVSA-N 2 0 222.376 2.246 20 0 BEADRP CC(C)C[N@@H+]1CC[C@@H](C2CC[NH+](C)CC2)C1 ZINC000334458393 397924871 /nfs/dbraw/zinc/92/48/71/397924871.db2.gz QZCCCSLVJGHSCM-CQSZACIVSA-N 2 0 224.392 2.306 20 0 BEADRP CSCC[C@@H](C)[N@H+](C)C[C@]1(C)CC[NH2+]C1 ZINC000156882142 397926917 /nfs/dbraw/zinc/92/69/17/397926917.db2.gz SHEVVPZFANWOON-VXGBXAGGSA-N 2 0 230.421 2.059 20 0 BEADRP C[NH2+]C1CC[NH+](C[C@@H]2C[C@H]2c2ccccc2)CC1 ZINC000414672276 398013036 /nfs/dbraw/zinc/01/30/36/398013036.db2.gz NMWDKTYGZUEPDY-HOCLYGCPSA-N 2 0 244.382 2.474 20 0 BEADRP CC[C@@H](C)N(C)CC[NH2+]CC1(COC)CCC1 ZINC000383452280 398020216 /nfs/dbraw/zinc/02/02/16/398020216.db2.gz HMPNBPNKEXSISO-CYBMUJFWSA-N 2 0 242.407 2.123 20 0 BEADRP C(C1CCCC1)[NH+]1CCC([C@H]2CC[NH2+]C2)CC1 ZINC000357055399 397974407 /nfs/dbraw/zinc/97/44/07/397974407.db2.gz RCKPKUPGRKIADN-HNNXBMFYSA-N 2 0 236.403 2.498 20 0 BEADRP C[C@H](CC1CC1)[NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1 ZINC000414817725 398042364 /nfs/dbraw/zinc/04/23/64/398042364.db2.gz BOJPSUKBSUYLNT-NTZNESFSSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H](CSCCF)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000595046322 397979719 /nfs/dbraw/zinc/97/97/19/397979719.db2.gz KXLWJYNAVPMCIU-SDDRHHMPSA-N 2 0 248.411 2.007 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[C@@H](C)C1)[C@H]1CCC[NH2+]C1 ZINC000414853994 398062066 /nfs/dbraw/zinc/06/20/66/398062066.db2.gz LSHPHKKEOGPEBM-NDBYEHHHSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000414858847 398065757 /nfs/dbraw/zinc/06/57/57/398065757.db2.gz SPZPIOXXLOHYNH-IHRRRGAJSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]([NH3+])[C@H](C)[NH2+][C@H](C)Cc1cccs1 ZINC000389297139 398068884 /nfs/dbraw/zinc/06/88/84/398068884.db2.gz GZLDWBYAPUDLEI-BBBLOLIVSA-N 2 0 212.362 2.004 20 0 BEADRP CC[C@H]1CN(CCC[NH+](CC)CC)[C@H](C)CO1 ZINC000649735589 398076741 /nfs/dbraw/zinc/07/67/41/398076741.db2.gz NIXCWSYIPYWEEO-KGLIPLIRSA-N 2 0 242.407 2.218 20 0 BEADRP CC[C@H](O)[C@H](CC)[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000313148079 398094848 /nfs/dbraw/zinc/09/48/48/398094848.db2.gz KCZRBEDUXQFOLH-XQLPTFJDSA-N 2 0 248.370 2.270 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H](C)Cc1ccc(F)cc1 ZINC000414829694 398051008 /nfs/dbraw/zinc/05/10/08/398051008.db2.gz BHYOYGSMQPJXRL-NWDGAFQWSA-N 2 0 238.350 2.202 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+][C@@H]1CCN(CC2CC2)C1 ZINC000648450097 398051820 /nfs/dbraw/zinc/05/18/20/398051820.db2.gz SWHOBRNZFHQSHL-IUODEOHRSA-N 2 0 248.370 2.285 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]Cc1cnc(C2CC2)s1 ZINC000556952669 398058600 /nfs/dbraw/zinc/05/86/00/398058600.db2.gz ICEXJYCQMWTBIJ-VIFPVBQESA-N 2 0 239.388 2.238 20 0 BEADRP CCCC[C@@H](CC)[NH2+]CCC[NH+](C)C ZINC000068985615 398099331 /nfs/dbraw/zinc/09/93/31/398099331.db2.gz ATCOZSIQWDQLFB-GFCCVEGCSA-N 2 0 200.370 2.497 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@H]([NH3+])c3ccccc32)[C@H](C)O1 ZINC000384635431 398100665 /nfs/dbraw/zinc/10/06/65/398100665.db2.gz RWCBCLWIBJTKBP-BUVBEKAXSA-N 2 0 246.354 2.287 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CCCC1(F)F ZINC000390837724 398107597 /nfs/dbraw/zinc/10/75/97/398107597.db2.gz AOHDNFSZMCTOAU-DCAQKATOSA-N 2 0 232.318 2.139 20 0 BEADRP CC[C@H]([NH2+]CCC[NH+](C)C)[C@H]1CC1(C)C ZINC000397674525 398121310 /nfs/dbraw/zinc/12/13/10/398121310.db2.gz GSHPHXDCJJDEFW-NEPJUHHUSA-N 2 0 212.381 2.352 20 0 BEADRP CSCCCC[NH2+][C@H]1CCCC[C@@H]1C[NH3+] ZINC000229207815 398113037 /nfs/dbraw/zinc/11/30/37/398113037.db2.gz MSXDMBAIMLCMNU-NEPJUHHUSA-N 2 0 230.421 2.237 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C[C@@H]2CCCS2)CC1(C)C ZINC000623445464 398130942 /nfs/dbraw/zinc/13/09/42/398130942.db2.gz RVFLHRSGGUGWMJ-RYUDHWBXSA-N 2 0 242.432 2.344 20 0 BEADRP C[C@@H](Cc1ccco1)[NH2+]CCCC[NH+](C)C ZINC000062772079 1172781555 /nfs/dbraw/zinc/78/15/55/1172781555.db2.gz TYKOCJYVJMEOHT-LBPRGKRZSA-N 2 0 224.348 2.142 20 0 BEADRP C[C@@H](CCC1CC1)[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000398235352 322866842 /nfs/dbraw/zinc/86/68/42/322866842.db2.gz VVZGGBPBSMJANX-AAEUAGOBSA-N 2 0 210.365 2.154 20 0 BEADRP Cc1ccc(C[NH2+]CC[C@@H]2CC[NH2+]C2)cc1 ZINC000258650560 322875526 /nfs/dbraw/zinc/87/55/26/322875526.db2.gz FWZZRRZTYXGGSG-CQSZACIVSA-N 2 0 218.344 2.084 20 0 BEADRP Cc1ccccc1C[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000258864241 322879072 /nfs/dbraw/zinc/87/90/72/322879072.db2.gz AFHRWBRGMRMCOU-AWEZNQCLSA-N 2 0 232.371 2.474 20 0 BEADRP CCOc1ccc(C[NH2+]CC[C@H]2CCC[NH2+]2)cc1 ZINC000259144784 322882256 /nfs/dbraw/zinc/88/22/56/322882256.db2.gz XKXFSEIEGVJMMW-CQSZACIVSA-N 2 0 248.370 2.317 20 0 BEADRP COc1ccccc1C[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000259144501 322882325 /nfs/dbraw/zinc/88/23/25/322882325.db2.gz XHHIXAPTABJAKR-CYBMUJFWSA-N 2 0 248.370 2.175 20 0 BEADRP Cc1ccc(F)c(C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)c1 ZINC000334843188 487570297 /nfs/dbraw/zinc/57/02/97/487570297.db2.gz CSVWNXPCSNRFEN-CHWSQXEVSA-N 2 0 236.334 2.494 20 0 BEADRP CC(C)OCC[NH2+][C@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000160050366 167243530 /nfs/dbraw/zinc/24/35/30/167243530.db2.gz VALGQLMYHBEMHX-ZIAGYGMSSA-N 2 0 242.407 2.312 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2CC[C@@H](C3CC3)C2)CC1 ZINC001651862628 1172996641 /nfs/dbraw/zinc/99/66/41/1172996641.db2.gz LCKHSBVJOQYORZ-OAHLLOKOSA-N 2 0 236.403 2.450 20 0 BEADRP CC[C@H](CC(F)F)C[N@@H+]1CC[C@H]([C@@H](C)[NH3+])C1 ZINC000662267749 409569934 /nfs/dbraw/zinc/56/99/34/409569934.db2.gz YIDDHVDQEMDAMA-MXWKQRLJSA-N 2 0 234.334 2.337 20 0 BEADRP CC[C@@H](CC(F)F)C[N@@H+]1CC[C@@]2(CC[NH2+]C2)C1 ZINC000662264458 409560613 /nfs/dbraw/zinc/56/06/13/409560613.db2.gz DHAXZANEWPIOHJ-WCQYABFASA-N 2 0 246.345 2.353 20 0 BEADRP C[C@H]([NH3+])[C@H]1CCC[N@H+](CC2CC=CC2)C1 ZINC000662244504 409535747 /nfs/dbraw/zinc/53/57/47/409535747.db2.gz HUDMYJSGVJZGNW-AAEUAGOBSA-N 2 0 208.349 2.012 20 0 BEADRP C[C@H]([NH3+])C1CC[NH+](Cc2cc(C3CC3)no2)CC1 ZINC000662245551 409539468 /nfs/dbraw/zinc/53/94/68/409539468.db2.gz KNIYMOWVDCMCAG-JTQLQIEISA-N 2 0 249.358 2.111 20 0 BEADRP CC1(C)CCCC[C@H]1C[N@@H+]1CC[C@@H](C[NH3+])C1 ZINC000662247742 409549223 /nfs/dbraw/zinc/54/92/23/409549223.db2.gz ZOBYZJRQMOZNMJ-STQMWFEESA-N 2 0 224.392 2.483 20 0 BEADRP C1=CCC(C[N@@H+]2CCC[C@H]([C@H]3CCC[NH2+]3)C2)C1 ZINC000662263509 409554863 /nfs/dbraw/zinc/55/48/63/409554863.db2.gz BVMGPPNAGGBQGM-LSDHHAIUSA-N 2 0 234.387 2.417 20 0 BEADRP CC[C@@H]1C[N@H+](C[C@@H]2C[C@H]3C[C@H]3C2)CC[C@@H]1[NH3+] ZINC000662270503 409572369 /nfs/dbraw/zinc/57/23/69/409572369.db2.gz LPMNQFBEHDFVSE-RGDJUOJXSA-N 2 0 222.376 2.092 20 0 BEADRP CO[C@H](C[NH+]1CCC(C)([NH3+])CC1)C1CCCC1 ZINC000662269832 409572860 /nfs/dbraw/zinc/57/28/60/409572860.db2.gz FSQJPLSYDHGXHM-CYBMUJFWSA-N 2 0 240.391 2.005 20 0 BEADRP CC[C@H]1C[N@H+](CCC=C(C)C)CC[C@@H]1[NH3+] ZINC000662269679 409573553 /nfs/dbraw/zinc/57/35/53/409573553.db2.gz CVFFTEVARRAWNN-STQMWFEESA-N 2 0 210.365 2.402 20 0 BEADRP C1=CCC(C[NH+]2CCC([C@@H]3CC[NH2+]C3)CC2)C1 ZINC000662272900 409578876 /nfs/dbraw/zinc/57/88/76/409578876.db2.gz KKIDIERKTJNICG-OAHLLOKOSA-N 2 0 234.387 2.274 20 0 BEADRP C(C[N@@H+]1CCC[C@@H]([C@@H]2CC[NH2+]C2)C1)C1CCC1 ZINC000662275057 409584701 /nfs/dbraw/zinc/58/47/01/409584701.db2.gz QOTMYEVXRKBPDE-HUUCEWRRSA-N 2 0 236.403 2.498 20 0 BEADRP CC(C)SCC[NH2+][C@@H]1CC[N@H+](C)C[C@H]1C ZINC000308837583 167332461 /nfs/dbraw/zinc/33/24/61/167332461.db2.gz XDZATKQUDSQGQH-VXGBXAGGSA-N 2 0 230.421 2.058 20 0 BEADRP C[N@H+](Cc1ccsc1)[C@@H]1CCC[NH2+]CC1 ZINC000082666687 409849228 /nfs/dbraw/zinc/84/92/28/409849228.db2.gz XBTOOQXNGAWESU-GFCCVEGCSA-N 2 0 224.373 2.322 20 0 BEADRP CC(C)[C@@H]1CCC[N@@H+]1C[C@]1(C)CC[NH2+]C1 ZINC000084126957 409872863 /nfs/dbraw/zinc/87/28/63/409872863.db2.gz DGFYXAXNYDSJPT-QWHCGFSZSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H](C[NH2+][C@@H](C)CC1CCC1)C[NH+](C)C ZINC000308911326 409938382 /nfs/dbraw/zinc/93/83/82/409938382.db2.gz MQQRUIKDLVGXBK-NEPJUHHUSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H]1CCC[C@@H](CC[N@H+](C)CCC[NH3+])C1 ZINC000390477607 410024664 /nfs/dbraw/zinc/02/46/64/410024664.db2.gz LJEXWSGWVJYGOE-STQMWFEESA-N 2 0 212.381 2.483 20 0 BEADRP C[C@@H](c1cccc(F)c1)[N@H+](C)CCC[NH3+] ZINC000133223337 410248505 /nfs/dbraw/zinc/24/85/05/410248505.db2.gz ZWQMLSUWVDFYJN-JTQLQIEISA-N 2 0 210.296 2.167 20 0 BEADRP CC(C)[C@H]1CCC[C@@H]1[NH2+]CC12CC(C1)C[NH2+]2 ZINC000663498173 410275522 /nfs/dbraw/zinc/27/55/22/410275522.db2.gz MXYQVADCMJXFLP-DKNRTOFZSA-N 2 0 222.376 2.153 20 0 BEADRP CC(C)[C@@H]1CCC[C@H]1[NH2+]CC12CC(C1)C[NH2+]2 ZINC000663498182 410276507 /nfs/dbraw/zinc/27/65/07/410276507.db2.gz MXYQVADCMJXFLP-YIFLHPOLSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H]1C[C@H]([NH2+]Cc2cccc3c2CCC3)CC[NH2+]1 ZINC000650703501 410332645 /nfs/dbraw/zinc/33/26/45/410332645.db2.gz CEIRMDPHZPCIQL-SWLSCSKDSA-N 2 0 244.382 2.405 20 0 BEADRP c1cc2c(c(C[NH2+]C3CC[NH2+]CC3)c1)CCC2 ZINC000650703743 410335208 /nfs/dbraw/zinc/33/52/08/410335208.db2.gz PWFDCZQPBHVDIA-UHFFFAOYSA-N 2 0 230.355 2.017 20 0 BEADRP CC[C@H](OCC[NH2+]CCC[NH3+])c1ccccc1 ZINC000650710365 410339634 /nfs/dbraw/zinc/33/96/34/410339634.db2.gz NTYAYDQCNRZOAW-AWEZNQCLSA-N 2 0 236.359 2.093 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CCC[C@@H](C)[C@H]1CC[NH3+] ZINC000650711702 410339928 /nfs/dbraw/zinc/33/99/28/410339928.db2.gz AKWPUORCABKCGS-FDYHWXHSSA-N 2 0 210.365 2.092 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CCC[C@H](C)[C@H]1CC[NH3+] ZINC000650711705 410340397 /nfs/dbraw/zinc/34/03/97/410340397.db2.gz AKWPUORCABKCGS-UMSGYPCISA-N 2 0 210.365 2.092 20 0 BEADRP [NH3+]CC1(CC[NH2+]Cc2cccc3c2CCC3)CC1 ZINC000650714181 410346511 /nfs/dbraw/zinc/34/65/11/410346511.db2.gz VHOLHTKPDUBWTF-UHFFFAOYSA-N 2 0 244.382 2.394 20 0 BEADRP C[C@H](CCC1CC1)[NH2+]CCC1(C[NH3+])CC1 ZINC000650714053 410346649 /nfs/dbraw/zinc/34/66/49/410346649.db2.gz OZXNTHATEYDQEK-LLVKDONJSA-N 2 0 210.365 2.284 20 0 BEADRP CC[C@H]([NH2+]CCC1CC[NH2+]CC1)C(C)C ZINC000650763578 410415350 /nfs/dbraw/zinc/41/53/50/410415350.db2.gz DPYPILFWESJWBX-ZDUSSCGKSA-N 2 0 212.381 2.400 20 0 BEADRP Cc1ccccc1[C@@H]1C[C@H]1[NH2+][C@H]1CCC[C@H]1[NH3+] ZINC000650742325 410374454 /nfs/dbraw/zinc/37/44/54/410374454.db2.gz VWJOKSAXFZOFPW-LJISPDSOSA-N 2 0 230.355 2.320 20 0 BEADRP CC(C)[C@@H]([NH2+]CCC1(C[NH3+])CC1)C1CC1 ZINC000650745253 410381425 /nfs/dbraw/zinc/38/14/25/410381425.db2.gz CJOSSSZPWSSLHL-GFCCVEGCSA-N 2 0 210.365 2.140 20 0 BEADRP C[C@H](Cc1cccs1)[NH2+]CCC1(C[NH3+])CC1 ZINC000650743963 410381454 /nfs/dbraw/zinc/38/14/54/410381454.db2.gz CGYKUGYURCAGIC-LLVKDONJSA-N 2 0 238.400 2.398 20 0 BEADRP CC(C)[C@@H]([NH2+]CCC1(C[NH3+])CC1)c1cccnc1 ZINC000650745823 410382771 /nfs/dbraw/zinc/38/27/71/410382771.db2.gz OLDJKZFXCUHCAO-CQSZACIVSA-N 2 0 247.386 2.497 20 0 BEADRP C[C@H]([NH2+]CCC1(C[NH3+])CC1)[C@@H]1CC1(C)C ZINC000650747092 410384668 /nfs/dbraw/zinc/38/46/68/410384668.db2.gz RIVUZJKZRLYNLB-QWRGUYRKSA-N 2 0 210.365 2.140 20 0 BEADRP [NH3+]CC1(CC[NH2+][C@@H]2CCCC23CCC3)CC1 ZINC000650748365 410390739 /nfs/dbraw/zinc/39/07/39/410390739.db2.gz SIYUIWHNSVIZBM-GFCCVEGCSA-N 2 0 222.376 2.428 20 0 BEADRP Cc1cc([C@@H](C)[NH2+]CCC2CC[NH2+]CC2)no1 ZINC000650762802 410412317 /nfs/dbraw/zinc/41/23/17/410412317.db2.gz KVMHIARONNRKRJ-LLVKDONJSA-N 2 0 237.347 2.023 20 0 BEADRP C[C@H]([NH2+]CCC1CC[NH2+]CC1)c1cncs1 ZINC000650764216 410413965 /nfs/dbraw/zinc/41/39/65/410413965.db2.gz SZLLSGUDYPEXDA-JTQLQIEISA-N 2 0 239.388 2.183 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]CCC1CC[NH2+]CC1 ZINC000650764264 410414002 /nfs/dbraw/zinc/41/40/02/410414002.db2.gz UUHROHREQXOKED-NSHDSACASA-N 2 0 210.365 2.154 20 0 BEADRP CC(C)C[C@@H](C)[NH2+]CCC1CC[NH2+]CC1 ZINC000650763609 410414262 /nfs/dbraw/zinc/41/42/62/410414262.db2.gz FKJKTORYWSKTCJ-GFCCVEGCSA-N 2 0 212.381 2.400 20 0 BEADRP CO[C@@H](C[N@@H+]1CC[C@@](C)(C[NH3+])C1)c1ccccc1 ZINC000393283936 410673314 /nfs/dbraw/zinc/67/33/14/410673314.db2.gz BRSKJNDFRBRNLL-GJZGRUSLSA-N 2 0 248.370 2.045 20 0 BEADRP CC[C@H](NCCc1cnccc1C)[C@@H]1CCC[NH2+]1 ZINC000665239207 410730124 /nfs/dbraw/zinc/73/01/24/410730124.db2.gz OBGKGBKAPQIANI-GJZGRUSLSA-N 2 0 247.386 2.053 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+][C@@H]1CC[C@@H]1c1ccccc1 ZINC000665274023 410743575 /nfs/dbraw/zinc/74/35/75/410743575.db2.gz ICUJSGBQJRROHZ-LXTVHRRPSA-N 2 0 230.355 2.402 20 0 BEADRP CC[C@@H]1C[C@H](C)CC[C@@H]1[NH2+][C@H](C)C[NH2+]C ZINC000665296794 410814567 /nfs/dbraw/zinc/81/45/67/410814567.db2.gz XXEGZCPAEXCSSG-LPWJVIDDSA-N 2 0 212.381 2.399 20 0 BEADRP C[NH2+]C[C@@H](C)[NH2+][C@H](C1CC1)C1CCCC1 ZINC000665298574 410831864 /nfs/dbraw/zinc/83/18/64/410831864.db2.gz YKPCYKYMMOPCOY-MFKMUULPSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)C[NH2+][C@@H]1CCC[C@H]1[C@H]1CCC[NH2+]1 ZINC000250557522 167011739 /nfs/dbraw/zinc/01/17/39/167011739.db2.gz FCUDGHZDYQXJOD-YNEHKIRRSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)[NH2+]C1CC[NH+](C[C@@H]2C[C@H]2C)CC1 ZINC000336769575 167094643 /nfs/dbraw/zinc/09/46/43/167094643.db2.gz VTUGTKBJSZYKBO-NEPJUHHUSA-N 2 0 210.365 2.105 20 0 BEADRP CC(C)[NH2+]Cc1cccc(OCC[NH+](C)C)c1 ZINC000033465877 167118250 /nfs/dbraw/zinc/11/82/50/167118250.db2.gz SOCVLZSPWCMQPV-UHFFFAOYSA-N 2 0 236.359 2.125 20 0 BEADRP CC(C)[NH2+][C@H](CC[NH+](C)C)C(C)(C)C ZINC000125571372 167138864 /nfs/dbraw/zinc/13/88/64/167138864.db2.gz JAMXLLJVCLKZBU-LLVKDONJSA-N 2 0 200.370 2.351 20 0 BEADRP CC(C)OCCCC[NH2+][C@H]1CC[N@H+](C)C[C@H]1C ZINC000341277151 167205693 /nfs/dbraw/zinc/20/56/93/167205693.db2.gz KFIIORXNPSJKSN-KGLIPLIRSA-N 2 0 242.407 2.121 20 0 BEADRP CC(C)OC[C@H](C)[NH2+]C[C@@H](C)C[NH+]1CCCC1 ZINC000337337567 167264796 /nfs/dbraw/zinc/26/47/96/167264796.db2.gz MZNRRAAMIQVYAV-KGLIPLIRSA-N 2 0 242.407 2.121 20 0 BEADRP CC(C)SCC[NH2+][C@H]1CC[N@H+](C)C[C@H]1C ZINC000308837580 167333895 /nfs/dbraw/zinc/33/38/95/167333895.db2.gz XDZATKQUDSQGQH-NEPJUHHUSA-N 2 0 230.421 2.058 20 0 BEADRP CC(C)SCC[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000304325760 167333442 /nfs/dbraw/zinc/33/34/42/167333442.db2.gz SVLFBSJFILVEQY-STQMWFEESA-N 2 0 242.432 2.344 20 0 BEADRP CC(C)[C@@H](C)[NH2+]CCN1CCCCCC1 ZINC000040767260 167380677 /nfs/dbraw/zinc/38/06/77/167380677.db2.gz DGNVMIZNWVAYPV-CYBMUJFWSA-N 2 0 212.381 2.497 20 0 BEADRP CC[C@@H]([NH2+][C@H](C)C1CC[NH+](C)CC1)C(F)F ZINC000651364332 410952467 /nfs/dbraw/zinc/95/24/67/410952467.db2.gz HFOZFYUMZXOCTQ-MWLCHTKSSA-N 2 0 234.334 2.350 20 0 BEADRP CCC1CC([NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)C1 ZINC000310013060 410996779 /nfs/dbraw/zinc/99/67/79/410996779.db2.gz JMTKCPPXYJJJGY-HHTDUIENSA-N 2 0 222.376 2.391 20 0 BEADRP CC(C)[C@H]1C[C@@H]([NH2+]C2CCC([NH3+])CC2)CCO1 ZINC000070361137 167498537 /nfs/dbraw/zinc/49/85/37/167498537.db2.gz GQNYVJBRMKNFHP-CLRIEMFWSA-N 2 0 240.391 2.050 20 0 BEADRP CC[C@](C)(C[NH2+]C1CCC([NH+](C)C)CC1)OC ZINC000651420229 411001506 /nfs/dbraw/zinc/00/15/06/411001506.db2.gz PQKVZDURNSNZII-JXQTWKCFSA-N 2 0 242.407 2.264 20 0 BEADRP Cc1c[nH+]ccc1N(C)CC[NH+]1CCCCC1 ZINC000651477721 411059523 /nfs/dbraw/zinc/05/95/23/411059523.db2.gz HDTAQULVNAUZAI-UHFFFAOYSA-N 2 0 233.359 2.312 20 0 BEADRP CCC[C@H](C)[NH2+]CCC[NH+](CC)CC ZINC000019943331 411074905 /nfs/dbraw/zinc/07/49/05/411074905.db2.gz SVOGMUHIAJNUPU-LBPRGKRZSA-N 2 0 200.370 2.497 20 0 BEADRP COC[C@@H](CC(C)(C)C)[NH2+][C@H]1CCCN(C)C1 ZINC000651684980 411136107 /nfs/dbraw/zinc/13/61/07/411136107.db2.gz DYWQHMXBYGJZDR-QWHCGFSZSA-N 2 0 242.407 2.121 20 0 BEADRP CC(C)C[N@H+](C)CCC[NH2+][C@H](C)COC(C)C ZINC000651865013 411147699 /nfs/dbraw/zinc/14/76/99/411147699.db2.gz LAFNPSBMLRANNN-CQSZACIVSA-N 2 0 244.423 2.367 20 0 BEADRP CC(C)C[N@H+](C)CCC[NH2+][C@@H](C)COC(C)C ZINC000651865012 411147754 /nfs/dbraw/zinc/14/77/54/411147754.db2.gz LAFNPSBMLRANNN-AWEZNQCLSA-N 2 0 244.423 2.367 20 0 BEADRP CC(C)C[N@H+](C)CCC[NH2+][C@@H]1C[C@@H](C)O[C@@H]1C ZINC000651864704 411147993 /nfs/dbraw/zinc/14/79/93/411147993.db2.gz BCUGSUZRCUOKDO-MGPQQGTHSA-N 2 0 242.407 2.120 20 0 BEADRP CC(C)[C@H]1CCC[N@H+](C[C@@H]2CC[NH2+]C2)CC1 ZINC000070622068 411153842 /nfs/dbraw/zinc/15/38/42/411153842.db2.gz ZYULCDFUQHRBAL-KGLIPLIRSA-N 2 0 224.392 2.354 20 0 BEADRP [NH3+]CCOCC[N@@H+]1CCC[C@H]1CC1CCCC1 ZINC000655949293 411161743 /nfs/dbraw/zinc/16/17/43/411161743.db2.gz SLEKQDAGRWUAIB-AWEZNQCLSA-N 2 0 240.391 2.006 20 0 BEADRP C1[C@H]([NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)C12CCCC2 ZINC000400989617 411168623 /nfs/dbraw/zinc/16/86/23/411168623.db2.gz XVRMTHOBRZGHFT-RQJABVFESA-N 2 0 234.387 2.297 20 0 BEADRP CC(C)C1(C[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)CC1 ZINC000401005629 411169417 /nfs/dbraw/zinc/16/94/17/411169417.db2.gz PBVVYSFZWJKIJC-BFHYXJOUSA-N 2 0 236.403 2.400 20 0 BEADRP COC[C@H](CC(C)(C)C)[NH2+]C[C@H](C)C[NH+](C)C ZINC000652201032 411171292 /nfs/dbraw/zinc/17/12/92/411171292.db2.gz RFWRLBNXXAWREZ-STQMWFEESA-N 2 0 244.423 2.225 20 0 BEADRP COC(C)(C)[C@H](C)[NH2+]CCC[N@H+](C)CC(C)C ZINC000652222380 411175403 /nfs/dbraw/zinc/17/54/03/411175403.db2.gz MTFKSSAOYZYKTB-ZDUSSCGKSA-N 2 0 244.423 2.367 20 0 BEADRP c1cc(C[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)cs1 ZINC000401082188 411177135 /nfs/dbraw/zinc/17/71/35/411177135.db2.gz SEPBEUKJVCOPMO-JHJVBQTASA-N 2 0 236.384 2.226 20 0 BEADRP CC[C@@H](C)C[N@H+](C1CC1)C1CC[NH2+]CC1 ZINC000310036688 411196045 /nfs/dbraw/zinc/19/60/45/411196045.db2.gz UNEQAVMKDMNAQT-LLVKDONJSA-N 2 0 210.365 2.249 20 0 BEADRP Cc1cccc(CCC[NH2+][C@@H]2CCC[C@H]([NH3+])C2)n1 ZINC000656199178 411202049 /nfs/dbraw/zinc/20/20/49/411202049.db2.gz VIVVZQHGILHZEK-DZGCQCFKSA-N 2 0 247.386 2.182 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]CCCOC2CCCC2)C1 ZINC000656197214 411203299 /nfs/dbraw/zinc/20/32/99/411203299.db2.gz PMICIMVXDRFVPL-OLZOCXBDSA-N 2 0 240.391 2.195 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]Cc2ccc(Cl)cn2)C1 ZINC000656198391 411203523 /nfs/dbraw/zinc/20/35/23/411203523.db2.gz SRLQSURCFKXSMJ-QWRGUYRKSA-N 2 0 239.750 2.095 20 0 BEADRP COCC1(C[NH2+][C@@H]2C[C@@H]([NH3+])c3ccccc32)CC1 ZINC000656200077 411203931 /nfs/dbraw/zinc/20/39/31/411203931.db2.gz JBZKLPZLYZTKLP-ZIAGYGMSSA-N 2 0 246.354 2.147 20 0 BEADRP Cc1cnc(CC[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)c(C)c1 ZINC000656200339 411204868 /nfs/dbraw/zinc/20/48/68/411204868.db2.gz LWEFXWQHSMUTQS-ZIAGYGMSSA-N 2 0 247.386 2.100 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)C1CCC(F)(F)CC1)C1C[NH2+]C1 ZINC000656201958 411207850 /nfs/dbraw/zinc/20/78/50/411207850.db2.gz VUEKZNURSFHTJN-VHSXEESVSA-N 2 0 246.345 2.398 20 0 BEADRP CC[C@H]([NH2+][C@H](C)CCCC[NH3+])[C@@H]1CCCCO1 ZINC000656201852 411207880 /nfs/dbraw/zinc/20/78/80/411207880.db2.gz SYTYIFAYVBMHQY-RDBSUJKOSA-N 2 0 242.407 2.441 20 0 BEADRP CCCCC[C@H]1CCC[N@@H+]1CCOCC[NH3+] ZINC000652343688 411208412 /nfs/dbraw/zinc/20/84/12/411208412.db2.gz FTOWCFXDOQZRGQ-ZDUSSCGKSA-N 2 0 228.380 2.006 20 0 BEADRP CC(C)CC[C@@H]1CCC[N@@H+]1C[C@@H]1CC[NH2+]C1 ZINC000652343514 411208469 /nfs/dbraw/zinc/20/84/69/411208469.db2.gz OSBPNTCCVVXXRW-KGLIPLIRSA-N 2 0 224.392 2.497 20 0 BEADRP CCCC[N@@H+]1CCC[C@H]([C@@H]2C[C@@H]([NH3+])CCO2)C1 ZINC000652346352 411208886 /nfs/dbraw/zinc/20/88/86/411208886.db2.gz ZOZVRFAJZHSLEW-IHRRRGAJSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@H]1CN(CC[NH3+])CCc2ccc(Cl)cc21 ZINC000652353593 411211992 /nfs/dbraw/zinc/21/19/92/411211992.db2.gz UGUJWRJOOLXSPO-JTQLQIEISA-N 2 0 238.762 2.260 20 0 BEADRP Cc1cc(N[C@@H]2CCC[N@@H+]3CCCC[C@H]23)cc[nH+]1 ZINC000656226756 411212680 /nfs/dbraw/zinc/21/26/80/411212680.db2.gz OAWJTKRTNXJYQG-HUUCEWRRSA-N 2 0 245.370 2.241 20 0 BEADRP C[C@@H]1CCC[N@H+](Cc2cccc(N)c2)[C@H]1CC[NH3+] ZINC000652356107 411215602 /nfs/dbraw/zinc/21/56/02/411215602.db2.gz SCDOEEXXZNIFLV-DOMZBBRYSA-N 2 0 247.386 2.218 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[NH2+]CC1)c1cccc(O)c1 ZINC000129104354 411230022 /nfs/dbraw/zinc/23/00/22/411230022.db2.gz KGVWOCBPVUBFIF-WCQYABFASA-N 2 0 234.343 2.185 20 0 BEADRP CC[C@H](C)[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000658356604 411231972 /nfs/dbraw/zinc/23/19/72/411231972.db2.gz KCTWMDUFALOIOM-LBPRGKRZSA-N 2 0 224.392 2.497 20 0 BEADRP COCCC1(C[NH2+][C@H](C)C[C@@H](C)[NH3+])CCCC1 ZINC000422884478 411233138 /nfs/dbraw/zinc/23/31/38/411233138.db2.gz DXKFNOUQVREURF-CHWSQXEVSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+]CCC[NH+]2CCCC2)CS1 ZINC000655694862 411239884 /nfs/dbraw/zinc/23/98/84/411239884.db2.gz HUFTVEBDYQFHOE-QWHCGFSZSA-N 2 0 242.432 2.346 20 0 BEADRP CC(C)[C@H](C)[NH2+][C@H]1CCN(C(C)(C)C)C1 ZINC000658091078 411242026 /nfs/dbraw/zinc/24/20/26/411242026.db2.gz KTLYZRCSZTUTCP-RYUDHWBXSA-N 2 0 212.381 2.493 20 0 BEADRP C[C@@H]1CCC[C@@H]1C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000400880129 411165568 /nfs/dbraw/zinc/16/55/68/411165568.db2.gz ADODZBDEQZKZMT-UXXRCYHCSA-N 2 0 236.403 2.400 20 0 BEADRP CCC(C)(C)C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000400983200 411167569 /nfs/dbraw/zinc/16/75/69/411167569.db2.gz WVPFRQBYILXCHU-YNEHKIRRSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C[C@H]2CCC[N@H+](C)C2)CS1 ZINC000655712164 411266715 /nfs/dbraw/zinc/26/67/15/411266715.db2.gz RHUFVXBGZRFKBJ-JHJVBQTASA-N 2 0 242.432 2.202 20 0 BEADRP CC[C@@H](C)[N@H+](C)CCCC1CC[NH2+]CC1 ZINC000050952585 411269269 /nfs/dbraw/zinc/26/92/69/411269269.db2.gz TWZVOOJWQPXRKS-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP CCCCC[N@H+](C1CC1)C1CC[NH2+]CC1 ZINC000309850075 411276768 /nfs/dbraw/zinc/27/67/68/411276768.db2.gz XDPQUQIQMAMKEC-UHFFFAOYSA-N 2 0 210.365 2.393 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CCCOC(C)(C)C)CC[N@@H+]1C ZINC000658188033 411284442 /nfs/dbraw/zinc/28/44/42/411284442.db2.gz ZDCDYYZCBAKYGS-QWHCGFSZSA-N 2 0 242.407 2.264 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCCOC(C)(C)C)CC[N@@H+]1C ZINC000658188032 411284518 /nfs/dbraw/zinc/28/45/18/411284518.db2.gz ZDCDYYZCBAKYGS-OLZOCXBDSA-N 2 0 242.407 2.264 20 0 BEADRP C[C@H]([NH2+]CCC(C)(C)F)C1CC[NH+](C)CC1 ZINC000658193021 411288265 /nfs/dbraw/zinc/28/82/65/411288265.db2.gz RQRXWIMGPCCSGV-NSHDSACASA-N 2 0 230.371 2.445 20 0 BEADRP C[C@@H]([NH2+]CCc1ccoc1)C1CC[NH+](C)CC1 ZINC000658197434 411290323 /nfs/dbraw/zinc/29/03/23/411290323.db2.gz GQQYUGBASCSNTB-GFCCVEGCSA-N 2 0 236.359 2.142 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCS[C@@H]1C)C1CC[NH+](C)CC1 ZINC000309851213 411295151 /nfs/dbraw/zinc/29/51/51/411295151.db2.gz XXBYTEQXEBSJBF-DMDPSCGWSA-N 2 0 242.432 2.200 20 0 BEADRP C[C@H]([NH2+]C[C@]1(C)CC1(F)F)C1CC[NH+](C)CC1 ZINC000658217293 411296629 /nfs/dbraw/zinc/29/66/29/411296629.db2.gz FXIDYWJEBMWCRN-JQWIXIFHSA-N 2 0 246.345 2.352 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]C[C@]2(C)CC2(F)F)[C@@H](C)C1 ZINC000658220093 411299653 /nfs/dbraw/zinc/29/96/53/411299653.db2.gz OXOSJYMRQCLCQR-SRVKXCTJSA-N 2 0 246.345 2.352 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC[C@]2(C)CC2(F)F)CC[N@@H+]1C ZINC000658223088 411302416 /nfs/dbraw/zinc/30/24/16/411302416.db2.gz SKGZFQSBBJGRJY-IJLUTSLNSA-N 2 0 246.345 2.494 20 0 BEADRP CCC[C@@H](C)C[N@@H+]1C[C@@H]2CCC[C@]2(C[NH3+])C1 ZINC000402753210 411310979 /nfs/dbraw/zinc/31/09/79/411310979.db2.gz DCSPJJYJFBGFER-RDBSUJKOSA-N 2 0 224.392 2.483 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@@H]2C(C)(C)C2(F)F)CC[N@@H+]1C ZINC000658279762 411319867 /nfs/dbraw/zinc/31/98/67/411319867.db2.gz CPDBQPQESAMTIX-GMTAPVOTSA-N 2 0 246.345 2.350 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CCC2CC[NH+](C)CC2)CS1 ZINC000125129476 411349789 /nfs/dbraw/zinc/34/97/89/411349789.db2.gz SWPDCWRXWNGRKM-WCQYABFASA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H](C[N@@H+]1CC[C@H]2CC[C@@H](C1)[NH2+]2)C(C)(C)C ZINC000304265492 411357039 /nfs/dbraw/zinc/35/70/39/411357039.db2.gz JUOBJWLYYCQQNH-XQQFMLRXSA-N 2 0 224.392 2.495 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H]2CCc3ccccc3C2)CCCC1 ZINC000656789681 411369936 /nfs/dbraw/zinc/36/99/36/411369936.db2.gz VFHDCAIZDWBXJP-OAHLLOKOSA-N 2 0 244.382 2.405 20 0 BEADRP C[C@@H]1CN(C2CC2)C[C@@H]1[NH2+]CCCc1ccco1 ZINC000658328046 411336043 /nfs/dbraw/zinc/33/60/43/411336043.db2.gz TWJCLPJULRXLAN-DOMZBBRYSA-N 2 0 248.370 2.285 20 0 BEADRP C[C@H]1CN(C2CC2)C[C@@H]1[NH2+]CCCc1ccco1 ZINC000658328049 411336117 /nfs/dbraw/zinc/33/61/17/411336117.db2.gz TWJCLPJULRXLAN-WFASDCNBSA-N 2 0 248.370 2.285 20 0 BEADRP CC1(C[NH+]2CCC([C@H]3CC[NH2+]C3)CC2)CCC1 ZINC000357061078 168023208 /nfs/dbraw/zinc/02/32/08/168023208.db2.gz ZIMCINPLAVMJCH-AWEZNQCLSA-N 2 0 236.403 2.498 20 0 BEADRP CC1(C[NH+]2CCC([C@@H]3CC[NH2+]C3)CC2)CCC1 ZINC000357061080 168023942 /nfs/dbraw/zinc/02/39/42/168023942.db2.gz ZIMCINPLAVMJCH-CQSZACIVSA-N 2 0 236.403 2.498 20 0 BEADRP CC1=CC[NH+](CC[C@H]2CCC[N@H+]2C)CC1 ZINC000336556113 168112202 /nfs/dbraw/zinc/11/22/02/168112202.db2.gz GRBGCABHJAPBNU-CYBMUJFWSA-N 2 0 208.349 2.123 20 0 BEADRP CC1=CC[NH+](CC[C@@H]2CCC[N@H+]2C)CC1 ZINC000336556114 168112479 /nfs/dbraw/zinc/11/24/79/168112479.db2.gz GRBGCABHJAPBNU-ZDUSSCGKSA-N 2 0 208.349 2.123 20 0 BEADRP C[N@@H+]1CC[C@]2(C1)CCC[NH+](CC1CC=CC1)C2 ZINC000660659644 411374699 /nfs/dbraw/zinc/37/46/99/411374699.db2.gz ACAKAYIWXYEGLH-HNNXBMFYSA-N 2 0 234.387 2.370 20 0 BEADRP C[C@H]1CN(C)C[C@@H]1[NH2+]CC1CCC(C)CC1 ZINC000336777865 168156663 /nfs/dbraw/zinc/15/66/63/168156663.db2.gz JSKFKBYNLBTBGK-YIOUJQMASA-N 2 0 224.392 2.352 20 0 BEADRP CC1CCC([NH2+]C2CCC([NH3+])CC2)CC1 ZINC000051692880 168163395 /nfs/dbraw/zinc/16/33/95/168163395.db2.gz TYLOJYIIWLGSLH-UHFFFAOYSA-N 2 0 210.365 2.425 20 0 BEADRP CC1CCC([NH2+]C[C@H]2CCC[N@H+](C)C2)CC1 ZINC000044535154 168164749 /nfs/dbraw/zinc/16/47/49/168164749.db2.gz VTGWZOJOEVFGBP-ROKHWSDSSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CCC[N@H+](Cc2ccccn2)[C@H]1CC[NH3+] ZINC000404360303 411391605 /nfs/dbraw/zinc/39/16/05/411391605.db2.gz DWXVNHHJYKQGQV-OCCSQVGLSA-N 2 0 233.359 2.031 20 0 BEADRP C[C@H]1CCC[N@H+](Cc2cccnc2)[C@H]1CC[NH3+] ZINC000404379084 411392430 /nfs/dbraw/zinc/39/24/30/411392430.db2.gz LOKHHMAWBSLIDR-JSGCOSHPSA-N 2 0 233.359 2.031 20 0 BEADRP C[C@@H]1CCC[N@H+](C[C@H]2CCSC2)[C@H]1CC[NH3+] ZINC000404492788 411398953 /nfs/dbraw/zinc/39/89/53/411398953.db2.gz CMFFBBHWJIJEJW-UPJWGTAASA-N 2 0 242.432 2.189 20 0 BEADRP C[C@@H]1CCC[N@H+](C[C@@H]2CCSC2)[C@H]1CC[NH3+] ZINC000404492785 411399212 /nfs/dbraw/zinc/39/92/12/411399212.db2.gz CMFFBBHWJIJEJW-AGIUHOORSA-N 2 0 242.432 2.189 20 0 BEADRP C[C@H]1C[N@H+](CC(C)(C)[NH3+])CCc2ccccc21 ZINC000404804932 411408250 /nfs/dbraw/zinc/40/82/50/411408250.db2.gz XKYVVFDFUNLWMN-LBPRGKRZSA-N 2 0 232.371 2.386 20 0 BEADRP C[C@@H]1C[N@H+](C[C@H]2CC[NH2+]C2)CCc2ccccc21 ZINC000404880766 411411229 /nfs/dbraw/zinc/41/12/29/411411229.db2.gz FVQYXAYFJZRMOH-KGLIPLIRSA-N 2 0 244.382 2.258 20 0 BEADRP CCO[C@@H]1C[N@@H+]([C@@H](C)c2ccccc2)C[C@H]1C[NH3+] ZINC000405471223 411431093 /nfs/dbraw/zinc/43/10/93/411431093.db2.gz UXGPQVROZNPOAS-NWANDNLSSA-N 2 0 248.370 2.043 20 0 BEADRP CCO[C@@H]1C[N@@H+]([C@H](C)c2ccccc2)C[C@H]1C[NH3+] ZINC000405471220 411431226 /nfs/dbraw/zinc/43/12/26/411431226.db2.gz UXGPQVROZNPOAS-BPLDGKMQSA-N 2 0 248.370 2.043 20 0 BEADRP CCC[C@H](C)[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000415003714 411482614 /nfs/dbraw/zinc/48/26/14/411482614.db2.gz GMAHPEBNTPCZQB-WCFLWFBJSA-N 2 0 210.365 2.153 20 0 BEADRP CC1(C[NH2+]Cc2ccnn2-c2cc[nH+]cc2)CC1 ZINC000657387667 411490465 /nfs/dbraw/zinc/49/04/65/411490465.db2.gz SMURRIJAXJDPFM-UHFFFAOYSA-N 2 0 242.326 2.157 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@H]2CCCSC2)CC1 ZINC000061589311 169951924 /nfs/dbraw/zinc/95/19/24/169951924.db2.gz SBZKIGNIDABVMO-ZDUSSCGKSA-N 2 0 242.432 2.204 20 0 BEADRP C[NH+](C)C[C@H]1CC[N@H+](CCCC2CCC2)C1 ZINC000659927379 411499865 /nfs/dbraw/zinc/49/98/65/411499865.db2.gz QDFDQBYIIFWQOO-CQSZACIVSA-N 2 0 224.392 2.450 20 0 BEADRP CC(C)=CCC[NH2+]Cc1cnc2n1CCC2 ZINC000657448883 411509907 /nfs/dbraw/zinc/50/99/07/411509907.db2.gz WUDCTXAIDJJIFX-UHFFFAOYSA-N 2 0 219.332 2.275 20 0 BEADRP CC[N@@H+]1CCC[C@H](C[NH2+]C[C@H]2CCSC2)C1 ZINC000336773920 169974253 /nfs/dbraw/zinc/97/42/53/169974253.db2.gz WLNLAMAGYRFKIQ-CHWSQXEVSA-N 2 0 242.432 2.061 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]C2CC(C)(C)C2)C1 ZINC000655803656 411518348 /nfs/dbraw/zinc/51/83/48/411518348.db2.gz BJVKBGIRFUTTLW-KLPPZKSPSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1cccnc1 ZINC000655804937 411519375 /nfs/dbraw/zinc/51/93/75/411519375.db2.gz GRMSXZOZEIPZQD-BZPMIXESSA-N 2 0 233.359 2.072 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H](C2CC2)C2CCC2)C1 ZINC000655803976 411519709 /nfs/dbraw/zinc/51/97/09/411519709.db2.gz KRUBZJYTRCZZSS-GLQYFDAESA-N 2 0 236.403 2.495 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1ccco1 ZINC000655806905 411520233 /nfs/dbraw/zinc/52/02/33/411520233.db2.gz DIUILBUVPCFWHZ-UTUOFQBUSA-N 2 0 222.332 2.270 20 0 BEADRP C[C@H]1CCC[C@@H]([NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)C1 ZINC000655806924 411520522 /nfs/dbraw/zinc/52/05/22/411520522.db2.gz DTSIPFWZIDKBRE-IGQOVBAYSA-N 2 0 224.392 2.495 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]Cc2ccccc2F)C1 ZINC000655826378 411529719 /nfs/dbraw/zinc/52/97/19/411529719.db2.gz UQBZGFBAHZFSBF-BJHJDKERSA-N 2 0 236.334 2.256 20 0 BEADRP CCC[C@@H](C)C[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655826509 411529793 /nfs/dbraw/zinc/52/97/93/411529793.db2.gz GRADXSKYHUZXGF-UPJWGTAASA-N 2 0 212.381 2.352 20 0 BEADRP c1nc2n(c1C[NH2+][C@@H](C1CC1)C1CCC1)CCC2 ZINC000657486989 411530915 /nfs/dbraw/zinc/53/09/15/411530915.db2.gz FABKBJIQEHLESH-OAHLLOKOSA-N 2 0 245.370 2.498 20 0 BEADRP C[C@H](Cc1ccccn1)[NH2+][C@H]1CCN(C)[C@@H](C)C1 ZINC000655836746 411531876 /nfs/dbraw/zinc/53/18/76/411531876.db2.gz NXLOXLSDMFTHBI-IPYPFGDCSA-N 2 0 247.386 2.085 20 0 BEADRP CC(C)(C)C[NH2+]Cc1ccnn1-c1cc[nH+]cc1 ZINC000657326466 411465699 /nfs/dbraw/zinc/46/56/99/411465699.db2.gz DMIREYMTIJOBLC-UHFFFAOYSA-N 2 0 244.342 2.403 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+]CC2CCCCC2)C1 ZINC000037484205 170007395 /nfs/dbraw/zinc/00/73/95/170007395.db2.gz YDBSZXYECNMITE-AWEZNQCLSA-N 2 0 224.392 2.498 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cncc(C)c2)C1 ZINC000184285032 170008400 /nfs/dbraw/zinc/00/84/00/170008400.db2.gz UQXLZRBTYBDKIQ-KBPBESRZSA-N 2 0 247.386 2.382 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH+](C)CC(C)C)C[C@H]1C ZINC000336643801 170009137 /nfs/dbraw/zinc/00/91/37/170009137.db2.gz DSODZKHMPBFUQF-CHWSQXEVSA-N 2 0 212.381 2.447 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]C2CC(F)(F)C2)[C@@H](C)C1 ZINC000309676848 170012566 /nfs/dbraw/zinc/01/25/66/170012566.db2.gz YBGGHOUPZHIMMU-GXSJLCMTSA-N 2 0 232.318 2.104 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CCCCF)[C@H](C)C1 ZINC000309063946 170013300 /nfs/dbraw/zinc/01/33/00/170013300.db2.gz YHLQEGPPODKSSE-VXGBXAGGSA-N 2 0 216.344 2.056 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+]CC2CCCCC2)C1 ZINC000037484204 170015968 /nfs/dbraw/zinc/01/59/68/170015968.db2.gz YDBSZXYECNMITE-CQSZACIVSA-N 2 0 224.392 2.498 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CCC[C@@H](C)C2)C1 ZINC000224995161 170016007 /nfs/dbraw/zinc/01/60/07/170016007.db2.gz AYTUGLYRFRWHKY-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)[C@@H]2CC2(C)C)C1 ZINC000309973733 170016291 /nfs/dbraw/zinc/01/62/91/170016291.db2.gz RESWJAKVCSRVCU-XQQFMLRXSA-N 2 0 224.392 2.352 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2cccc(O)c2)C1 ZINC000249372160 170017045 /nfs/dbraw/zinc/01/70/45/170017045.db2.gz DBVQTCPPJBSYMT-CHWSQXEVSA-N 2 0 248.370 2.385 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+]Cc2ccsc2C)C1 ZINC000293726437 170017146 /nfs/dbraw/zinc/01/71/46/170017146.db2.gz YWHGABBKOFQLDE-GFCCVEGCSA-N 2 0 238.400 2.488 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]C[C@H]2CCSC2)[C@H](C)C1 ZINC000336779018 170020065 /nfs/dbraw/zinc/02/00/65/170020065.db2.gz MZGUFMJUXDOLFG-UPJWGTAASA-N 2 0 242.432 2.059 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CC2(C)CC2)[C@@H](C)C1 ZINC000309054340 170020109 /nfs/dbraw/zinc/02/01/09/170020109.db2.gz SSWVVRAKGVDXIG-RYUDHWBXSA-N 2 0 210.365 2.106 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]C[C@H]2CC2(C)C)[C@@H](C)C1 ZINC000309426302 170021442 /nfs/dbraw/zinc/02/14/42/170021442.db2.gz FIFFYMMZZJRRNB-XQQFMLRXSA-N 2 0 224.392 2.352 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H]2CC[C@@H]2C)[C@@H](C)C1 ZINC000336746413 170021911 /nfs/dbraw/zinc/02/19/11/170021911.db2.gz BKLBCAXYAGYYME-RVMXOQNASA-N 2 0 210.365 2.105 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@H]2CSC2(C)C)[C@@H](C)C1 ZINC000336779647 170022528 /nfs/dbraw/zinc/02/25/28/170022528.db2.gz PABRWJZNXNEKRN-SRVKXCTJSA-N 2 0 242.432 2.200 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H]2CC2(C)C)[C@H](C)C1 ZINC000309043409 170022781 /nfs/dbraw/zinc/02/27/81/170022781.db2.gz MUAGHNVKEZFJBD-GRYCIOLGSA-N 2 0 210.365 2.105 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@H]2CC2(C)C)[C@H](C)C1 ZINC000309043412 170022843 /nfs/dbraw/zinc/02/28/43/170022843.db2.gz MUAGHNVKEZFJBD-WOPDTQHZSA-N 2 0 210.365 2.105 20 0 BEADRP CC[C@@H]1C[C@H]([NH2+]CCC[N@H+](C)CC(C)C)CO1 ZINC000657501639 411538346 /nfs/dbraw/zinc/53/83/46/411538346.db2.gz YQWCUPIWVUDQML-UONOGXRCSA-N 2 0 242.407 2.121 20 0 BEADRP c1cc(CC[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)co1 ZINC000657653332 411570725 /nfs/dbraw/zinc/57/07/25/411570725.db2.gz JJZJZAPHNIFSGK-UONOGXRCSA-N 2 0 234.343 2.039 20 0 BEADRP CC[NH+]1CCC(Nc2[nH+]ccc3[nH]ccc32)CC1 ZINC000663354208 411635287 /nfs/dbraw/zinc/63/52/87/411635287.db2.gz MAZLLQAGJJIORD-UHFFFAOYSA-N 2 0 244.342 2.459 20 0 BEADRP Cc1ncc(C[NH2+][C@@H](C(C)C)C2CC2)n1C ZINC000657757313 411590146 /nfs/dbraw/zinc/59/01/46/411590146.db2.gz QDTJKVPEKSPCHC-ZDUSSCGKSA-N 2 0 221.348 2.253 20 0 BEADRP CC1(C)C[C@]1(C)[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000657761396 411591472 /nfs/dbraw/zinc/59/14/72/411591472.db2.gz KAOBNEKQXWUZLL-OBJOEFQTSA-N 2 0 222.376 2.391 20 0 BEADRP CC1(C)C[C@]1(C)[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000657761397 411591632 /nfs/dbraw/zinc/59/16/32/411591632.db2.gz KAOBNEKQXWUZLL-SCRDCRAPSA-N 2 0 222.376 2.391 20 0 BEADRP C[NH+](C)CC(C)(C)C[NH2+][C@@H]1CCCSCC1 ZINC000657816861 411606246 /nfs/dbraw/zinc/60/62/46/411606246.db2.gz OTLPHGHBKHHCSS-GFCCVEGCSA-N 2 0 244.448 2.450 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@H]2CCCSCC2)CC1 ZINC000657873972 411614709 /nfs/dbraw/zinc/61/47/09/411614709.db2.gz XCLKMFCEKBJURU-ZDUSSCGKSA-N 2 0 242.432 2.204 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH2+][C@@H]2CCCSCC2)C1 ZINC000657875880 411614956 /nfs/dbraw/zinc/61/49/56/411614956.db2.gz IOJCBXXMDKMEIV-QWHCGFSZSA-N 2 0 242.432 2.204 20 0 BEADRP C[N@@H+]1CC[C@@]2(C1)CCC[NH+](CC1CCC1)C2 ZINC000660658130 411615049 /nfs/dbraw/zinc/61/50/49/411615049.db2.gz CLMSCZHTSQVDMI-CQSZACIVSA-N 2 0 222.376 2.204 20 0 BEADRP CC(C)C[N@@H+]1CCC[C@]2(CC[NH+](C)C2)C1 ZINC000660656823 411615317 /nfs/dbraw/zinc/61/53/17/411615317.db2.gz VCUDTBZRHGLEDV-CYBMUJFWSA-N 2 0 210.365 2.060 20 0 BEADRP C[N@@H+]1CC[C@@]2(C1)CCC[NH+](CCCCF)C2 ZINC000660665136 411615867 /nfs/dbraw/zinc/61/58/67/411615867.db2.gz URKDKPSJZRPULA-CYBMUJFWSA-N 2 0 228.355 2.154 20 0 BEADRP C[N@@H+]1CCC[C@H](CNc2[nH+]ccc3[nH]ccc32)C1 ZINC000663578764 411705026 /nfs/dbraw/zinc/70/50/26/411705026.db2.gz LYMBUUDYILWBEY-LLVKDONJSA-N 2 0 244.342 2.317 20 0 BEADRP CCO[C@@H]1C[C@H]([NH2+][C@@H](C)CCCC[NH3+])C1(C)C ZINC000336731444 170491107 /nfs/dbraw/zinc/49/11/07/170491107.db2.gz YVKANEPVOAWDRV-RWMBFGLXSA-N 2 0 242.407 2.297 20 0 BEADRP CC[C@@H](C)[N@H+](CC)CCCc1cncn1C ZINC000661103919 411708747 /nfs/dbraw/zinc/70/87/47/411708747.db2.gz INWBPVUJIUWBFW-GFCCVEGCSA-N 2 0 223.364 2.473 20 0 BEADRP C[C@H](CC[NH+](C)C)Nc1[nH+]ccc2[nH]ccc21 ZINC000663451511 411659480 /nfs/dbraw/zinc/65/94/80/411659480.db2.gz CKSHNUCOEHYMEI-SNVBAGLBSA-N 2 0 232.331 2.315 20 0 BEADRP Cc1ccccc1C[C@H](C)[NH2+]CC12CC(C1)C[NH2+]2 ZINC000663497072 411678884 /nfs/dbraw/zinc/67/88/84/411678884.db2.gz BBSCUVKERYKDQZ-HLIUYOAVSA-N 2 0 244.382 2.268 20 0 BEADRP CC[C@H]1CCC[C@@H]([NH2+]CC23CC(C2)C[NH2+]3)C1 ZINC000663497774 411679609 /nfs/dbraw/zinc/67/96/09/411679609.db2.gz JVPPRTLRGUKHNS-RJZJGCCBSA-N 2 0 222.376 2.297 20 0 BEADRP CC[C@@H]1CCC[C@@H]([NH2+]CC23CC(C2)C[NH2+]3)C1 ZINC000663497771 411679997 /nfs/dbraw/zinc/67/99/97/411679997.db2.gz JVPPRTLRGUKHNS-NELGMTEASA-N 2 0 222.376 2.297 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+]Cc1ccc(F)c(F)c1 ZINC000663498907 411680954 /nfs/dbraw/zinc/68/09/54/411680954.db2.gz SQRFQFRDXAKCPS-CYBMUJFWSA-N 2 0 242.313 2.428 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CC23CC(C2)C[NH2+]3)C[C@@H]1C ZINC000663498143 411681588 /nfs/dbraw/zinc/68/15/88/411681588.db2.gz MHYQOJRPTLDHSS-NFMDPKQHSA-N 2 0 222.376 2.153 20 0 BEADRP C([NH2+][C@@H]1CCC[C@@H](C2CC2)C1)C12CC(C1)C[NH2+]2 ZINC000663498570 411681637 /nfs/dbraw/zinc/68/16/37/411681637.db2.gz QENBSCXGIGXVPI-INTODGSJSA-N 2 0 234.387 2.297 20 0 BEADRP C[C@@]1(C[N@@H+]2CCC[C@H](C3CCC3)C2)CC[NH2+]C1 ZINC000663499125 411682188 /nfs/dbraw/zinc/68/21/88/411682188.db2.gz ATONQDZBJMPTJG-LSDHHAIUSA-N 2 0 236.403 2.498 20 0 BEADRP C[C@H](C[NH2+]CC12CC(C1)C[NH2+]2)c1ccc(F)cc1 ZINC000663500821 411684056 /nfs/dbraw/zinc/68/40/56/411684056.db2.gz OYFVIFMMNHGTCN-XIKARTHZSA-N 2 0 248.345 2.271 20 0 BEADRP C[N@@H+]1CCC[C@@H]1CC[NH+]1C[C@@H]2CCCC[C@@H]21 ZINC000660933312 411684164 /nfs/dbraw/zinc/68/41/64/411684164.db2.gz OQPIICOSEABOCN-MJBXVCDLSA-N 2 0 222.376 2.345 20 0 BEADRP COc1cccc(C2([NH2+]CCC[NH3+])CCC2)c1 ZINC000663503900 411688645 /nfs/dbraw/zinc/68/86/45/411688645.db2.gz SMGCAOXDKQUHQE-UHFFFAOYSA-N 2 0 234.343 2.013 20 0 BEADRP C[NH2+]C[C@@H](C)[NH2+]C[C@H]1CCCC(C)(C)C1 ZINC000663508779 411690180 /nfs/dbraw/zinc/69/01/80/411690180.db2.gz DKTRKYZICCPUJJ-NEPJUHHUSA-N 2 0 212.381 2.400 20 0 BEADRP C[NH2+]C[C@H](C)[NH2+][C@H]1CCC[C@@H](C2CC2)C1 ZINC000663509286 411691873 /nfs/dbraw/zinc/69/18/73/411691873.db2.gz IQJWPNRHMBRXDP-UHTWSYAYSA-N 2 0 210.365 2.153 20 0 BEADRP C[NH+](C)[C@H](CNc1[nH+]ccc2[nH]ccc21)C1CC1 ZINC000663548473 411702809 /nfs/dbraw/zinc/70/28/09/411702809.db2.gz RCRIILYGEQCIRH-CYBMUJFWSA-N 2 0 244.342 2.315 20 0 BEADRP CC[N@@H+]1CCN(c2[nH+]ccc3[nH]ccc32)[C@@H](C)C1 ZINC000663905145 411770470 /nfs/dbraw/zinc/77/04/70/411770470.db2.gz PUFCOPNJFNIBTH-NSHDSACASA-N 2 0 244.342 2.093 20 0 BEADRP Cc1cc[nH+]c(NCC[C@@H](C)[NH+](C)C)c1 ZINC000664242682 411895038 /nfs/dbraw/zinc/89/50/38/411895038.db2.gz GCDNXVQEHNUAAP-LLVKDONJSA-N 2 0 207.321 2.142 20 0 BEADRP Cc1[nH+]ccc(NCC[C@@H](C)[NH+](C)C)c1Cl ZINC000664246033 411897605 /nfs/dbraw/zinc/89/76/05/411897605.db2.gz RNWJIIHNZJLJNG-SECBINFHSA-N 2 0 241.766 2.217 20 0 BEADRP CN(CC1C[NH+](C)C1)c1ccnc2ccsc21 ZINC000664331509 411923583 /nfs/dbraw/zinc/92/35/83/411923583.db2.gz XJMXWUDMCRCLSC-UHFFFAOYSA-N 2 0 247.367 2.294 20 0 BEADRP Cc1c[nH+]ccc1NC[C@@H]1CC[N@@H+]1C(C)(C)C ZINC000664142382 411870073 /nfs/dbraw/zinc/87/00/73/411870073.db2.gz JHBRCGLKHSDDDQ-LBPRGKRZSA-N 2 0 233.359 2.097 20 0 BEADRP CCCN(C)CC(C)(C)[NH2+]CC[C@H]1CCOC1 ZINC000662179371 412021338 /nfs/dbraw/zinc/02/13/38/412021338.db2.gz KDIDHUSYSYAHSG-ZDUSSCGKSA-N 2 0 242.407 2.123 20 0 BEADRP [NH3+]CC1CC[NH+](CCCC2CCC2)CC1 ZINC000662234676 412033728 /nfs/dbraw/zinc/03/37/28/412033728.db2.gz LJBCHVCBHWEHHV-UHFFFAOYSA-N 2 0 210.365 2.237 20 0 BEADRP CC[C@H](CC(F)F)C[N@@H+]1CC[C@@H](C[NH2+]C)C1 ZINC000662244106 412039058 /nfs/dbraw/zinc/03/90/58/412039058.db2.gz BUEQYIWFVWSILS-MNOVXSKESA-N 2 0 234.334 2.209 20 0 BEADRP CN(CC[C@@H]1CCC[N@@H+]1C)CC1=CCSC1 ZINC000662262709 412054973 /nfs/dbraw/zinc/05/49/73/412054973.db2.gz CLLZXSALOBYPKK-ZDUSSCGKSA-N 2 0 240.416 2.076 20 0 BEADRP CC[C@@H]1CCC[C@H]1[NH2+]C1CCC([NH3+])CC1 ZINC000229635444 171001636 /nfs/dbraw/zinc/00/16/36/171001636.db2.gz CDDVDRWNVAXSTF-IKWCTNDRSA-N 2 0 210.365 2.425 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]CCN(CC)C1CC1 ZINC000336766850 171041774 /nfs/dbraw/zinc/04/17/74/171041774.db2.gz RXNLRXNHQXRHBY-YPMHNXCESA-N 2 0 210.365 2.249 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]CC1=CC[N@H+](C)CC1 ZINC000336748835 171042285 /nfs/dbraw/zinc/04/22/85/171042285.db2.gz CZUGPKNMFGWKBC-OLZOCXBDSA-N 2 0 208.349 2.027 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000309612751 171045748 /nfs/dbraw/zinc/04/57/48/171045748.db2.gz AQWVQYUFZYSFPU-SYQHCUMBSA-N 2 0 222.376 2.391 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+]C[C@H]1CCC[N@H+](CC)C1 ZINC000310036768 171059181 /nfs/dbraw/zinc/05/91/81/171059181.db2.gz UNXCJDIKDNUZMF-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H]1C[N@H+](C[C@@H]2CC[NH2+][C@@H](C)C2)CCS1 ZINC000233952018 171085640 /nfs/dbraw/zinc/08/56/40/171085640.db2.gz IHCGJTOYNRXHTN-YNEHKIRRSA-N 2 0 242.432 2.202 20 0 BEADRP CC(C)=CCC[NH+]1CCC2(CC[NH2+]C2)CC1 ZINC000662273833 412065869 /nfs/dbraw/zinc/06/58/69/412065869.db2.gz QBHRBDUHWOJQLM-UHFFFAOYSA-N 2 0 222.376 2.418 20 0 BEADRP C[C@H]1CC[N@H+](CCCC2CCC2)C[C@H]1C[NH3+] ZINC000662280466 412071144 /nfs/dbraw/zinc/07/11/44/412071144.db2.gz FBDDGEJABNCNTD-GXTWGEPZSA-N 2 0 224.392 2.483 20 0 BEADRP CC(C)=CCC[N@H+]1CC[C@H](C)[C@H](C[NH3+])C1 ZINC000662282665 412073184 /nfs/dbraw/zinc/07/31/84/412073184.db2.gz PRRMRGUIPJKGAF-QWHCGFSZSA-N 2 0 210.365 2.259 20 0 BEADRP CO[C@H](C[NH2+][C@@H]1CCCC[C@H]1[NH3+])C1CCCC1 ZINC000662283075 412074252 /nfs/dbraw/zinc/07/42/52/412074252.db2.gz KIRVDLRDRTVVLY-MGPQQGTHSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@H]1CC2(C[N@@H+]1C[C@@H]1C[C@H]3C[C@H]3C1)CC[NH2+]CC2 ZINC000662283047 412075196 /nfs/dbraw/zinc/07/51/96/412075196.db2.gz KCCMLSMJAFGMHN-XQLPTFJDSA-N 2 0 248.414 2.497 20 0 BEADRP CC[C@H](CC(F)F)C[N@@H+]1CC[C@H]([NH3+])C[C@@H]1C ZINC000662282904 412076040 /nfs/dbraw/zinc/07/60/40/412076040.db2.gz DGAUQYCKLCWKPF-AXFHLTTASA-N 2 0 234.334 2.479 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCC[C@H]2C[NH+](C)CC[C@H]21 ZINC000336686539 171281919 /nfs/dbraw/zinc/28/19/19/171281919.db2.gz WNVIOSPCKKQOTF-MELADBBJSA-N 2 0 224.392 2.449 20 0 BEADRP CC[C@H](C)C[N@@H+]1CC[C@]2(C1)CCC[NH2+]C2 ZINC000335619801 171282496 /nfs/dbraw/zinc/28/24/96/171282496.db2.gz NASYOPGEMZCVST-QWHCGFSZSA-N 2 0 210.365 2.108 20 0 BEADRP CC[C@H](C)C[NH2+]C[C@@H](C)C[NH+]1CCCC1 ZINC000062071318 171284576 /nfs/dbraw/zinc/28/45/76/171284576.db2.gz WFBMQJABEYOHOQ-QWHCGFSZSA-N 2 0 212.381 2.354 20 0 BEADRP CC[C@H](C)[N@@H+]1CC[C@@H](OCC[NH+](CC)CC)C1 ZINC000337260812 171319590 /nfs/dbraw/zinc/31/95/90/171319590.db2.gz XKODXWDSCRPPTK-UONOGXRCSA-N 2 0 242.407 2.218 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCC[C@H](c2ccccc2)C1 ZINC000662284859 412078442 /nfs/dbraw/zinc/07/84/42/412078442.db2.gz QDBKRAXRLMYGHP-HNNXBMFYSA-N 2 0 232.371 2.476 20 0 BEADRP CC[C@H](C)[NH2+]C[C@@H](CC(C)C)N(C)C ZINC000020201691 171340826 /nfs/dbraw/zinc/34/08/26/171340826.db2.gz APNDAMVXOVUPIG-NWDGAFQWSA-N 2 0 200.370 2.351 20 0 BEADRP CC[C@H](C)[NH2+]C[C@@H]1CCCn2cc(C)nc21 ZINC000366207405 171340876 /nfs/dbraw/zinc/34/08/76/171340876.db2.gz AYLBTYDURKMVCJ-JQWIXIFHSA-N 2 0 221.348 2.457 20 0 BEADRP CCC[NH+]1CCC([C@@H]2CCC[NH2+]C2)CC1 ZINC000662290494 412079875 /nfs/dbraw/zinc/07/98/75/412079875.db2.gz VVXGOYONSMFYRO-CYBMUJFWSA-N 2 0 210.365 2.108 20 0 BEADRP COCC[NH2+]C1CC[NH+](CCC=C(C)C)CC1 ZINC000662287125 412080556 /nfs/dbraw/zinc/08/05/56/412080556.db2.gz WGZXIODZNLEGJJ-UHFFFAOYSA-N 2 0 240.391 2.043 20 0 BEADRP C[N@H+](CCCC(C)(C)C)CC(C)(C)[NH3+] ZINC000662293721 412081567 /nfs/dbraw/zinc/08/15/67/412081567.db2.gz IJBAVNKNDWFDLN-UHFFFAOYSA-N 2 0 200.370 2.482 20 0 BEADRP CCC(C)(C)CC[N@H+](C)CC(C)(C)[NH3+] ZINC000662294109 412081618 /nfs/dbraw/zinc/08/16/18/412081618.db2.gz JALKKVJUZVSFSK-UHFFFAOYSA-N 2 0 200.370 2.482 20 0 BEADRP CC[C@H](C)[C@@H](C[NH2+][C@@H](C)CCCC[NH3+])OC ZINC000362976037 171368410 /nfs/dbraw/zinc/36/84/10/171368410.db2.gz IWSNXMWWMCQSCG-RWMBFGLXSA-N 2 0 230.396 2.155 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+]C[C@@H]1CC[N@H+](CC)C1 ZINC000037484273 171389064 /nfs/dbraw/zinc/38/90/64/171389064.db2.gz PPFDCIHSNHBGOP-AVGNSLFASA-N 2 0 212.381 2.352 20 0 BEADRP CC[C@H](C)[C@H](C[NH2+][C@@H]1CCCC[C@@H]1C[NH3+])OC ZINC000362974751 171392943 /nfs/dbraw/zinc/39/29/43/171392943.db2.gz BPWJVYBYVPLZIE-DGAVXFQQSA-N 2 0 242.407 2.155 20 0 BEADRP C(C[NH+]1CCC(C2CCC2)CC1)[C@H]1CC[NH2+]C1 ZINC000662299291 412086837 /nfs/dbraw/zinc/08/68/37/412086837.db2.gz NKVAYJUBZADEHJ-CYBMUJFWSA-N 2 0 236.403 2.498 20 0 BEADRP C[C@@H]([NH3+])C[N@@H+]1CC[C@H](C2CCCCC2)C1 ZINC000662305364 412090646 /nfs/dbraw/zinc/09/06/46/412090646.db2.gz GFAUVCRMZADUSQ-YPMHNXCESA-N 2 0 210.365 2.236 20 0 BEADRP C([C@H]1CC[NH2+]C1)[N@@H+]1CCC[C@H](C2CCC2)C1 ZINC000662317797 412098405 /nfs/dbraw/zinc/09/84/05/412098405.db2.gz SRCKECZRBKKNOH-JSGCOSHPSA-N 2 0 222.376 2.108 20 0 BEADRP C([C@H]1CC[NH2+]C1)[N@@H+]1CCC[C@@H](C2CCC2)C1 ZINC000662317796 412098423 /nfs/dbraw/zinc/09/84/23/412098423.db2.gz SRCKECZRBKKNOH-GXTWGEPZSA-N 2 0 222.376 2.108 20 0 BEADRP C[C@@H]1CCC[N@H+](CCCF)[C@@H]1CCC[NH3+] ZINC000662318427 412098880 /nfs/dbraw/zinc/09/88/80/412098880.db2.gz ZFGQNDNHCZUZBY-VXGBXAGGSA-N 2 0 216.344 2.185 20 0 BEADRP C[N@H+](C[C@@H]1CC[NH2+]C1)C[C@H]1CCc2ccccc21 ZINC000662322547 412099741 /nfs/dbraw/zinc/09/97/41/412099741.db2.gz NAFDBNYXEDMZFS-UKRRQHHQSA-N 2 0 244.382 2.258 20 0 BEADRP CC[C@H](COCC1CC1)[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000665236511 412175843 /nfs/dbraw/zinc/17/58/43/412175843.db2.gz OIVGIZYCBDEIEF-BFHYXJOUSA-N 2 0 240.391 2.051 20 0 BEADRP CC[C@H](C)CC[NH2+][C@@H]1CC[NH2+]CC[C@H]1C ZINC000665238195 412179222 /nfs/dbraw/zinc/17/92/22/412179222.db2.gz SVKKCHKVNNVKOY-YNEHKIRRSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H]([NH2+]CC1C[C@H](C)C[C@@H](C)C1)C1C[NH2+]C1 ZINC000665239612 412179563 /nfs/dbraw/zinc/17/95/63/412179563.db2.gz VVVMQMFFYUQQIS-UTUOFQBUSA-N 2 0 224.392 2.256 20 0 BEADRP [NH3+]C1(C[NH2+][C@H]2CCC23CCC3)CCCC1 ZINC000665246368 412190792 /nfs/dbraw/zinc/19/07/92/412190792.db2.gz CTYDJGMRQWYLTL-NSHDSACASA-N 2 0 208.349 2.180 20 0 BEADRP CC(C)[C@H]([NH2+]CC1([NH3+])CCCC1)C1CC1 ZINC000665247614 412192742 /nfs/dbraw/zinc/19/27/42/412192742.db2.gz GCZNKLLCEZWJLA-LBPRGKRZSA-N 2 0 210.365 2.282 20 0 BEADRP CC[C@@H]1CCC[C@H]1[NH2+]CC1([NH3+])CCCC1 ZINC000665249280 412194716 /nfs/dbraw/zinc/19/47/16/412194716.db2.gz MKUZLENVDJAEBS-VXGBXAGGSA-N 2 0 210.365 2.426 20 0 BEADRP CC(C)(F)CC[NH2+][C@H]1CCCC[C@@H]1C[NH3+] ZINC000665261681 412203322 /nfs/dbraw/zinc/20/33/22/412203322.db2.gz JJTQZOQETHYUIR-MNOVXSKESA-N 2 0 216.344 2.232 20 0 BEADRP CC(C)(F)CC[NH2+][C@H]1CCCCC[C@@H]1[NH3+] ZINC000665261790 412203632 /nfs/dbraw/zinc/20/36/32/412203632.db2.gz LKPMHRMWNONLPG-QWRGUYRKSA-N 2 0 216.344 2.374 20 0 BEADRP C[C@@H]1CCC[C@H](C[NH2+][C@@H]2CCCCC[C@H]2[NH3+])O1 ZINC000665264650 412207081 /nfs/dbraw/zinc/20/70/81/412207081.db2.gz FLQUQBLQPUOMLF-AAVRWANBSA-N 2 0 240.391 2.194 20 0 BEADRP C[C@@H]1CCC[C@H](C[NH2+][C@@H]2CCCCC[C@@H]2[NH3+])O1 ZINC000665264653 412207631 /nfs/dbraw/zinc/20/76/31/412207631.db2.gz FLQUQBLQPUOMLF-YIYPIFLZSA-N 2 0 240.391 2.194 20 0 BEADRP C(C[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)CC1CCC1 ZINC000665267444 412210573 /nfs/dbraw/zinc/21/05/73/412210573.db2.gz WUKXXNRUOGDQCE-PBWFPOADSA-N 2 0 222.376 2.439 20 0 BEADRP C[C@H]([NH2+]CC[C@]1(C)CC1(F)F)[C@H]1CCC[NH2+]1 ZINC000665267283 412210882 /nfs/dbraw/zinc/21/08/82/412210882.db2.gz TXKFEXDWFCFLPH-HBNTYKKESA-N 2 0 232.318 2.152 20 0 BEADRP C[C@@H]([NH2+]CC[C@@]1(C)CC1(F)F)[C@@H]1CCC[NH2+]1 ZINC000665267286 412211172 /nfs/dbraw/zinc/21/11/72/412211172.db2.gz TXKFEXDWFCFLPH-VWYCJHECSA-N 2 0 232.318 2.152 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H]1CCc2cc(N)ccc21 ZINC000665272065 412213711 /nfs/dbraw/zinc/21/37/11/412213711.db2.gz XFCLFYSMRJGVCC-XHDPSFHLSA-N 2 0 247.386 2.363 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CCc1noc2ccccc12 ZINC000665231881 412170547 /nfs/dbraw/zinc/17/05/47/412170547.db2.gz ABCAZDPKJYFCDC-QWRGUYRKSA-N 2 0 247.342 2.086 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]C[C@H]1C(C)(C)C1(F)F ZINC000665273816 412215858 /nfs/dbraw/zinc/21/58/58/412215858.db2.gz DRXQSZFSIMHKJJ-VWYCJHECSA-N 2 0 246.345 2.255 20 0 BEADRP CO[C@H](C[NH2+][C@H]1CCC[C@H]([NH3+])C1)C1CCCC1 ZINC000665275765 412218464 /nfs/dbraw/zinc/21/84/64/412218464.db2.gz RCBRABSKMWWZFP-MELADBBJSA-N 2 0 240.391 2.051 20 0 BEADRP CO[C@H](C[NH2+][C@@H](C)CCCC[NH3+])C1CCCC1 ZINC000665275709 412219648 /nfs/dbraw/zinc/21/96/48/412219648.db2.gz PSUVFVPDEKRSLI-GXTWGEPZSA-N 2 0 242.407 2.299 20 0 BEADRP CC1(C)CCC[C@H]([NH2+]CC23CC(C2)C[NH2+]3)C1 ZINC000665278331 412221578 /nfs/dbraw/zinc/22/15/78/412221578.db2.gz BETDUBZTNVQTFD-LXVYMNJGSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]1CC[C@@H](C)[C@H]([NH2+]CC23CC(C2)C[NH2+]3)C1 ZINC000665279647 412223060 /nfs/dbraw/zinc/22/30/60/412223060.db2.gz IJEVFMARUQCIJN-LRUBOHGLSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H](CC(C)(C)C)[NH2+]CC12CC(C1)C[NH2+]2 ZINC000665279677 412223698 /nfs/dbraw/zinc/22/36/98/412223698.db2.gz JJNKDMBBPLOKNE-ZBOXLXRLSA-N 2 0 210.365 2.153 20 0 BEADRP FCCC[C@H]1CCC[C@@H]1[NH2+]CC12CC(C1)C[NH2+]2 ZINC000665280060 412224574 /nfs/dbraw/zinc/22/45/74/412224574.db2.gz SBEFKJDMPIUPNG-DKNRTOFZSA-N 2 0 240.366 2.246 20 0 BEADRP COCC1CCC([NH2+]CC[C@@H]([NH3+])C(C)C)CC1 ZINC000665281456 412226004 /nfs/dbraw/zinc/22/60/04/412226004.db2.gz DAKCNMTZSOURPW-JXQTWKCFSA-N 2 0 242.407 2.155 20 0 BEADRP Cc1ncc([C@H](C)[NH2+]CC[C@@H]([NH3+])C(C)C)s1 ZINC000665281239 412226897 /nfs/dbraw/zinc/22/68/97/412226897.db2.gz YCEXODWIHHLXCK-GXSJLCMTSA-N 2 0 241.404 2.476 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+][C@@H](C)c1cncs1 ZINC000665281083 412226967 /nfs/dbraw/zinc/22/69/67/412226967.db2.gz UBIVPBNTRIHXSD-VHSXEESVSA-N 2 0 227.377 2.167 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+][C@@H](C)c1ccccn1 ZINC000665281345 412227028 /nfs/dbraw/zinc/22/70/28/412227028.db2.gz ZYPFJVVZUWDTAN-NWDGAFQWSA-N 2 0 221.348 2.106 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]CCCc1ccco1 ZINC000665283653 412229449 /nfs/dbraw/zinc/22/94/49/412229449.db2.gz RRVRVOWFFBEYKQ-ZIAGYGMSSA-N 2 0 236.359 2.462 20 0 BEADRP C[C@@H](C[NH2+][C@H](C)C1C[NH2+]C1)C1CCCCC1 ZINC000665283641 412229560 /nfs/dbraw/zinc/22/95/60/412229560.db2.gz RMVCEAHFWJBPHW-NWDGAFQWSA-N 2 0 224.392 2.400 20 0 BEADRP COc1cccc(C[NH2+][C@H]2CCC[C@H]2C[NH3+])c1C ZINC000665294852 412241384 /nfs/dbraw/zinc/24/13/84/412241384.db2.gz XPGCKEHSDMXZON-JSGCOSHPSA-N 2 0 248.370 2.221 20 0 BEADRP C[NH2+]C[C@H](C)[NH2+][C@H](C)C1C(C)(C)C1(C)C ZINC000665296709 412244656 /nfs/dbraw/zinc/24/46/56/412244656.db2.gz WZMOHBPTTIPVBM-VHSXEESVSA-N 2 0 212.381 2.255 20 0 BEADRP CCc1nc(C[NH2+][C@@H](C)CCCC[NH3+])cs1 ZINC000328164555 171987125 /nfs/dbraw/zinc/98/71/25/171987125.db2.gz WBQDWHSZLBPJQT-JTQLQIEISA-N 2 0 241.404 2.313 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@H]2CC[C@H]2C2CCC2)CC1 ZINC000337990802 172987533 /nfs/dbraw/zinc/98/75/33/172987533.db2.gz CSKVOGGJGWTKCS-GJZGRUSLSA-N 2 0 236.403 2.497 20 0 BEADRP C[N@@H+]1CCC[C@@H]1CC[NH+]1CCC(C(F)F)CC1 ZINC000336678549 173027095 /nfs/dbraw/zinc/02/70/95/173027095.db2.gz BQIQSBVWFCLAJC-GFCCVEGCSA-N 2 0 246.345 2.448 20 0 BEADRP C[N@@H+]1CCC[C@@H]2C[NH+](CCCCF)CC[C@H]21 ZINC000367158583 173036290 /nfs/dbraw/zinc/03/62/90/173036290.db2.gz TVEVJMHEDBUNRN-CHWSQXEVSA-N 2 0 228.355 2.152 20 0 BEADRP C[N@@H+]1CC[C@@H](C[NH2+]C2CCCCCC2)C1 ZINC000037484614 173114740 /nfs/dbraw/zinc/11/47/40/173114740.db2.gz KEOTVXSNMQREOS-LBPRGKRZSA-N 2 0 210.365 2.251 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CCCCF)[C@H]2CCC[C@H]21 ZINC000336763903 173152150 /nfs/dbraw/zinc/15/21/50/173152150.db2.gz MQQDKERDGRPLFF-FRRDWIJNSA-N 2 0 228.355 2.199 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CCC2CC2)[C@@H]2CCC[C@@H]21 ZINC000309436391 173153386 /nfs/dbraw/zinc/15/33/86/173153386.db2.gz HHYVFKQGGPIPQI-IHRRRGAJSA-N 2 0 222.376 2.249 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CC(C)(C)C)[C@@H]2CCC[C@H]21 ZINC000368600185 173153486 /nfs/dbraw/zinc/15/34/86/173153486.db2.gz AYLGWYYKZBCPIR-RWMBFGLXSA-N 2 0 224.392 2.495 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CCC[C@@H]2F)[C@@H]2CCC[C@H]21 ZINC000340525611 173155067 /nfs/dbraw/zinc/15/50/67/173155067.db2.gz WVMNOXKPDVJCNZ-QSLWVIQJSA-N 2 0 240.366 2.339 20 0 BEADRP C[NH2+]C1CC[NH+](C[C@@H]2CCCC[C@@H]2C)CC1 ZINC000042864251 173322887 /nfs/dbraw/zinc/32/28/87/173322887.db2.gz SGTDZEQRHDGHTK-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP C[NH2+]CC1CC[NH+](Cc2cccc(C)c2)CC1 ZINC000011889151 173338780 /nfs/dbraw/zinc/33/87/80/173338780.db2.gz SPSRVDKWTJNKHI-UHFFFAOYSA-N 2 0 232.371 2.426 20 0 BEADRP C[NH2+]CCC1CC[NH+]([C@@H](C)c2ccccn2)CC1 ZINC000070188877 173342951 /nfs/dbraw/zinc/34/29/51/173342951.db2.gz QKPOKHIBVZRRHM-ZDUSSCGKSA-N 2 0 247.386 2.464 20 0 BEADRP C[NH2+]CCC[N@H+](C)C[C@@H](C)CC(C)C ZINC000300853046 173345781 /nfs/dbraw/zinc/34/57/81/173345781.db2.gz FOFNWCRBMMIDRO-LBPRGKRZSA-N 2 0 200.370 2.210 20 0 BEADRP C[NH2+]CCC[N@H+](C)Cc1ccccc1C ZINC000042436100 173346068 /nfs/dbraw/zinc/34/60/68/173346068.db2.gz DJSRXHZNBXMGHS-UHFFFAOYSA-N 2 0 206.333 2.036 20 0 BEADRP C[NH2+]C[C@@H]1CCC[N@H+](Cc2cccc(C)c2)C1 ZINC000011888680 173367874 /nfs/dbraw/zinc/36/78/74/173367874.db2.gz LBLODXXLWBXUAJ-HNNXBMFYSA-N 2 0 232.371 2.426 20 0 BEADRP C[NH2+]C[C@@H]1CCCN1C[C@@H](C)c1ccccc1 ZINC000227724005 173369002 /nfs/dbraw/zinc/36/90/02/173369002.db2.gz FNKILNQUMLSMIB-HIFRSBDPSA-N 2 0 232.371 2.474 20 0 BEADRP C[NH2+]C[C@@H]1CCCN1C/C=C/c1ccccc1 ZINC000133218733 173369105 /nfs/dbraw/zinc/36/91/05/173369105.db2.gz CXIVNQIFPJGTPJ-BOSPYUDASA-N 2 0 230.355 2.384 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](Cc2cc(C)cc(C)c2)C1 ZINC000071142603 173370757 /nfs/dbraw/zinc/37/07/57/173370757.db2.gz DCBCIJYYKVBDQH-AWEZNQCLSA-N 2 0 232.371 2.345 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC000226628833 173370818 /nfs/dbraw/zinc/37/08/18/173370818.db2.gz LZWHOWKJRAMZKN-STQMWFEESA-N 2 0 218.344 2.289 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](Cc2ccc3c(c2)CCC3)C1 ZINC000070499615 173371258 /nfs/dbraw/zinc/37/12/58/173371258.db2.gz JXEKONALGQNRPW-AWEZNQCLSA-N 2 0 244.382 2.217 20 0 BEADRP C[NH2+]C[C@H]1CCCN1CCCc1ccccc1 ZINC000019933380 173380024 /nfs/dbraw/zinc/38/00/24/173380024.db2.gz ODHLWWDBQSRVOF-OAHLLOKOSA-N 2 0 232.371 2.303 20 0 BEADRP C[NH2+]C[C@H]1CC[N@H+](CCCCC(F)(F)F)C1 ZINC000124397081 173380667 /nfs/dbraw/zinc/38/06/67/173380667.db2.gz BZVFUWVNKDBQEN-SNVBAGLBSA-N 2 0 238.297 2.260 20 0 BEADRP C[NH2+]C[C@H]1CC[N@H+](CC2CCC(C)CC2)C1 ZINC000063145790 173380811 /nfs/dbraw/zinc/38/08/11/173380811.db2.gz IKBLZEIVXOJSKB-JXQTWKCFSA-N 2 0 224.392 2.354 20 0 BEADRP C[NH2+]C[C@H]1CC[N@H+](Cc2cc(C)cc(C)c2)C1 ZINC000071142600 173381301 /nfs/dbraw/zinc/38/13/01/173381301.db2.gz DCBCIJYYKVBDQH-CQSZACIVSA-N 2 0 232.371 2.345 20 0 BEADRP C[NH2+]C[C@H]1CC[N@@H+]([C@H](C)c2cccc(OC)c2)C1 ZINC000071141897 173381927 /nfs/dbraw/zinc/38/19/27/173381927.db2.gz SSYYRUZYGDJCRT-CHWSQXEVSA-N 2 0 248.370 2.298 20 0 BEADRP C[NH2+][C@H]1CCN(c2cc[nH+]c3ccccc32)C1 ZINC000129122442 173467297 /nfs/dbraw/zinc/46/72/97/173467297.db2.gz LTEPWXMJPVHSCQ-NSHDSACASA-N 2 0 227.311 2.033 20 0 BEADRP CCC1(CC)CC[N@H+](C[C@@H]2CC[NH2+]C2)C1 ZINC000087254652 487627123 /nfs/dbraw/zinc/62/71/23/487627123.db2.gz ZCWLKDLBLOQKIV-GFCCVEGCSA-N 2 0 210.365 2.108 20 0 BEADRP COCC1(C[NH2+][C@@H](C)CC(C)C)CC[NH2+]CC1 ZINC000336718801 174103969 /nfs/dbraw/zinc/10/39/69/174103969.db2.gz VIAXRMHURBHBGV-ZDUSSCGKSA-N 2 0 242.407 2.027 20 0 BEADRP COCCC[C@@H](C)[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000356782032 174260962 /nfs/dbraw/zinc/26/09/62/174260962.db2.gz KFKGPIODQPCNTM-CYBMUJFWSA-N 2 0 242.407 2.123 20 0 BEADRP COCC[C@@H](C)[NH2+]C[C@@H](C)C[NH+]1CCCCC1 ZINC000045037478 174382744 /nfs/dbraw/zinc/38/27/44/174382744.db2.gz ABVYPXZFGVKVDP-ZIAGYGMSSA-N 2 0 242.407 2.123 20 0 BEADRP COCC[C@@H]1CCC[C@H]1[NH2+]CCCC[NH+](C)C ZINC000337500032 174397255 /nfs/dbraw/zinc/39/72/55/174397255.db2.gz AOKMYXNIOAUHRT-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP COc1ccc(C[N@@H+]2CCC[C@H]([C@H](C)[NH3+])C2)cc1 ZINC000107954023 175099481 /nfs/dbraw/zinc/09/94/81/175099481.db2.gz LMXRJYXRGGDZGW-JSGCOSHPSA-N 2 0 248.370 2.254 20 0 BEADRP CC(C)C[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000053660882 487630004 /nfs/dbraw/zinc/63/00/04/487630004.db2.gz IMKYDQAKCOFWFH-UHFFFAOYSA-N 2 0 224.392 2.354 20 0 BEADRP COc1ccc([C@H](C)[NH2+]C[C@@H](C)C[NH3+])cc1F ZINC000310540337 175188777 /nfs/dbraw/zinc/18/87/77/175188777.db2.gz SJWOBOJQRKOYRD-UWVGGRQHSA-N 2 0 240.322 2.080 20 0 BEADRP COc1cccc(C[N@H+](C)C[C@H]2CCC[NH2+]C2)c1 ZINC000042442302 175255479 /nfs/dbraw/zinc/25/54/79/175255479.db2.gz MCPOTEUIACVSOT-AWEZNQCLSA-N 2 0 248.370 2.127 20 0 BEADRP COc1cccc(C[N@@H+]2CCCC[C@@H]2CC[NH3+])c1 ZINC000075777999 175257295 /nfs/dbraw/zinc/25/72/95/175257295.db2.gz FDQVTMVPDHIXLQ-CQSZACIVSA-N 2 0 248.370 2.399 20 0 BEADRP COc1cccc(C[NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)c1 ZINC000090720203 175268083 /nfs/dbraw/zinc/26/80/83/175268083.db2.gz CDCILXJLVUVTOC-OCCSQVGLSA-N 2 0 248.370 2.268 20 0 BEADRP COc1cccc(C[NH2+][C@H]2CC[N@H+](C)C[C@@H]2C)c1 ZINC000105480729 175268381 /nfs/dbraw/zinc/26/83/81/175268381.db2.gz ZGYKOAUGHLRSPA-WFASDCNBSA-N 2 0 248.370 2.125 20 0 BEADRP COc1cccc([C@@H](C)[N@@H+]2CCC[C@H](C[NH3+])C2)c1 ZINC000044527654 175286711 /nfs/dbraw/zinc/28/67/11/175286711.db2.gz RRFGCTKXUIJSCM-CHWSQXEVSA-N 2 0 248.370 2.427 20 0 BEADRP COc1cccc([C@@H](C)[NH2+][C@H]2CCN(C)C2)c1 ZINC000042544296 175287873 /nfs/dbraw/zinc/28/78/73/175287873.db2.gz WTEMZKXLENHNSN-YPMHNXCESA-N 2 0 234.343 2.050 20 0 BEADRP COc1cccc([C@H](C)[NH2+][C@H](C)CCC[NH3+])c1 ZINC000310514709 175293170 /nfs/dbraw/zinc/29/31/70/175293170.db2.gz KRXYRVFLWTXHOL-NEPJUHHUSA-N 2 0 236.359 2.473 20 0 BEADRP COc1ccccc1C[NH+]1CCC([C@H](C)[NH3+])CC1 ZINC000104436288 175325865 /nfs/dbraw/zinc/32/58/65/175325865.db2.gz KEHKQXOKYCRUHA-LBPRGKRZSA-N 2 0 248.370 2.254 20 0 BEADRP COc1ccccc1[C@H](C)[NH2+][C@H]1CCC[C@H]1C[NH3+] ZINC000149128905 175351741 /nfs/dbraw/zinc/35/17/41/175351741.db2.gz MVYNUZRJFZVPOY-OBJOEFQTSA-N 2 0 248.370 2.473 20 0 BEADRP COc1ccccc1[C@H](C)[NH2+][C@@H](C)CCC[NH3+] ZINC000310492849 175352190 /nfs/dbraw/zinc/35/21/90/175352190.db2.gz GICWDQSXUGDCNP-RYUDHWBXSA-N 2 0 236.359 2.473 20 0 BEADRP CSC1(C[NH+]2CCC([NH2+]C(C)C)CC2)CC1 ZINC000336716693 175448313 /nfs/dbraw/zinc/44/83/13/175448313.db2.gz WIUITPLPHQTTQL-UHFFFAOYSA-N 2 0 242.432 2.344 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H](C)CC(F)(F)F ZINC000308860567 175649686 /nfs/dbraw/zinc/64/96/86/175649686.db2.gz PDUCLVZEENRAPI-BDAKNGLRSA-N 2 0 226.286 2.434 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]CCc1ccc(F)cc1 ZINC000309486777 175665100 /nfs/dbraw/zinc/66/51/00/175665100.db2.gz XFZCJLCXJHNMMC-NSHDSACASA-N 2 0 224.323 2.085 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]CC[C@H](C)c1ccccc1 ZINC000309267709 175675724 /nfs/dbraw/zinc/67/57/24/175675724.db2.gz CKZSLDGNQVLIAJ-OLZOCXBDSA-N 2 0 220.360 2.365 20 0 BEADRP C[C@@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1ccccn1 ZINC000227495460 175866662 /nfs/dbraw/zinc/86/66/62/175866662.db2.gz AISNCAHDJMUBRA-CYBMUJFWSA-N 2 0 247.386 2.464 20 0 BEADRP C[C@@H]([NH2+]CCC[NH+]1CCCC1)c1ccncc1 ZINC000020129013 175875988 /nfs/dbraw/zinc/87/59/88/175875988.db2.gz BWVCQXAAPYXYIK-CYBMUJFWSA-N 2 0 233.359 2.218 20 0 BEADRP C[C@@H](c1cccs1)N(C)CC(C)(C)[NH3+] ZINC000049717082 176032741 /nfs/dbraw/zinc/03/27/41/176032741.db2.gz JZGNRNLMUPEWQE-VIFPVBQESA-N 2 0 212.362 2.478 20 0 BEADRP C[C@@H]1CCCC[N@@H+]1CCC[NH2+][C@@H]1CCSC1 ZINC000019912919 176071827 /nfs/dbraw/zinc/07/18/27/176071827.db2.gz SMJFOKQZKVIBGJ-CHWSQXEVSA-N 2 0 242.432 2.346 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[N@@H+]1C[C@@H]2CCC[NH2+][C@@H]2C1 ZINC000346158790 176076703 /nfs/dbraw/zinc/07/67/03/176076703.db2.gz AJRHWVIPXWLCCF-APIJFGDWSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]1CCCC[C@H]1C[NH2+]C1CC[NH2+]CC1 ZINC000042859663 176084778 /nfs/dbraw/zinc/08/47/78/176084778.db2.gz ZPZJICWFVVSSJU-NEPJUHHUSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1CCCC[C@H]1[N@H+](C)CC1CC[NH2+]CC1 ZINC000042610999 176086721 /nfs/dbraw/zinc/08/67/21/176086721.db2.gz JBVPRWCQBUWEBS-TZMCWYRMSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CCC[N@H+](CC[C@@H]2CCC[NH+]2C)C1 ZINC000124630914 176097721 /nfs/dbraw/zinc/09/77/21/176097721.db2.gz CEFHIKARRVAVCP-OLZOCXBDSA-N 2 0 210.365 2.203 20 0 BEADRP C[C@@H]1CCC[N@H+](C[C@@H]2CCC[NH2+]C2)[C@@H]1C ZINC000050564934 176100435 /nfs/dbraw/zinc/10/04/35/176100435.db2.gz HUHIKYFQIDCGHS-JHJVBQTASA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1CCC[C@@H](C)C1[NH2+]CCC[NH+](C)C ZINC000019958261 176113257 /nfs/dbraw/zinc/11/32/57/176113257.db2.gz GGGJVALCHITYFW-VXGBXAGGSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H]1CCC[C@@H](CCN[C@H]2CC[NH2+]C2)C1 ZINC000251604798 176117208 /nfs/dbraw/zinc/11/72/08/176117208.db2.gz CUXNURRAYIXTJP-AGIUHOORSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1CCC[C@@H](C[N@@H+]2CC[C@@H](C[NH3+])C2)C1 ZINC000227573890 176117395 /nfs/dbraw/zinc/11/73/95/176117395.db2.gz KXQMSPQWDLBSJD-UPJWGTAASA-N 2 0 210.365 2.093 20 0 BEADRP C[C@@H]1CCC[C@@H]([N@H+](C)C[C@H]2CCC[NH2+]C2)C1 ZINC000251779854 176120702 /nfs/dbraw/zinc/12/07/02/176120702.db2.gz LCBANQWDZGQMCW-HZSPNIEDSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]C2CCC([NH3+])CC2)C1 ZINC000051692920 176122397 /nfs/dbraw/zinc/12/23/97/176122397.db2.gz GJVDRBRZSYDSON-IKWCTNDRSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]CC2CC[NH+](C)CC2)C1 ZINC000044515361 176143278 /nfs/dbraw/zinc/14/32/78/176143278.db2.gz ZSHWUEAKMWSPOC-OCCSQVGLSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+][C@@H]1CC[N@H+](C)[C@H]2CCC[C@@H]21 ZINC000309829091 176218070 /nfs/dbraw/zinc/21/80/70/176218070.db2.gz YBQKDAGYLWXZHS-RGDJUOJXSA-N 2 0 222.376 2.247 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@H]2CCC[NH2+]C2)C[C@H]1C ZINC000251525169 176233385 /nfs/dbraw/zinc/23/33/85/176233385.db2.gz ACNARBXHXSZUKL-MQYQWHSLSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]CC1=CCCCC1 ZINC000336236004 176268620 /nfs/dbraw/zinc/26/86/20/176268620.db2.gz GIPIORSPFUVUOC-OCCSQVGLSA-N 2 0 222.376 2.417 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC000302212514 176270375 /nfs/dbraw/zinc/27/03/75/176270375.db2.gz XWTJNLFAVVKOJY-IJLUTSLNSA-N 2 0 246.345 2.352 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[N@H+](C)C[C@H]1C)C(F)(F)F ZINC000309727264 176271570 /nfs/dbraw/zinc/27/15/70/176271570.db2.gz DKHHLQPHBFDWTM-OPRDCNLKSA-N 2 0 238.297 2.115 20 0 BEADRP C[C@@H]1C[N@H+](CC2CCCCCC2)C[C@@H]1[NH3+] ZINC000235356269 176286635 /nfs/dbraw/zinc/28/66/35/176286635.db2.gz ZVRBWVXUAJALGW-YPMHNXCESA-N 2 0 210.365 2.236 20 0 BEADRP C[C@@H]1C[N@H+](CCCC(C)(C)C)CC[C@@H]1[NH3+] ZINC000300835338 176287396 /nfs/dbraw/zinc/28/73/96/176287396.db2.gz INTNPPMNVQNEMS-NEPJUHHUSA-N 2 0 212.381 2.482 20 0 BEADRP C[C@@H]1CSC[C@@H]1[NH2+]CCC1CC[NH+](C)CC1 ZINC000304405957 176352141 /nfs/dbraw/zinc/35/21/41/176352141.db2.gz HXLAWPBNISKLAR-YPMHNXCESA-N 2 0 242.432 2.059 20 0 BEADRP C[C@@H]1C[C@@H]([NH3+])CC[N@@H+]1CCC1CCCC1 ZINC000049713045 176370730 /nfs/dbraw/zinc/37/07/30/176370730.db2.gz OCGLWQCRBLRXMP-YPMHNXCESA-N 2 0 210.365 2.378 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCC2(C)CC2)CC[N@@H+]1C ZINC000336760057 176374850 /nfs/dbraw/zinc/37/48/50/176374850.db2.gz LYHRGWAZWWKIHI-NEPJUHHUSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCc2cccs2)CC[N@@H+]1C ZINC000129659064 176376050 /nfs/dbraw/zinc/37/60/50/176376050.db2.gz YHDATGJFMAUXTB-NEPJUHHUSA-N 2 0 238.400 2.363 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1)C(F)(F)F ZINC000336725141 176376080 /nfs/dbraw/zinc/37/60/80/176376080.db2.gz BJZPSSJNMXEZCB-BBBLOLIVSA-N 2 0 238.297 2.257 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCc2ccccc2)CC[N@@H+]1C ZINC000129596578 176376231 /nfs/dbraw/zinc/37/62/31/176376231.db2.gz PFOBTMUVZQNKRG-HIFRSBDPSA-N 2 0 232.371 2.301 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccccc2)CC[N@@H+]1C ZINC000073655699 176377462 /nfs/dbraw/zinc/37/74/62/176377462.db2.gz KZTLAVPYGULHBC-OCCSQVGLSA-N 2 0 218.344 2.259 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+]C1CCC(C[NH+](C)C)CC1 ZINC000309452241 176395515 /nfs/dbraw/zinc/39/55/15/176395515.db2.gz MVBUFGZQEFOBOT-NELGMTEASA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000228701066 176397363 /nfs/dbraw/zinc/39/73/63/176397363.db2.gz XTFLNGUQWDDFDI-DMTCVQMQSA-N 2 0 216.328 2.377 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H]1CCOc2ccccc21 ZINC000310384159 176620837 /nfs/dbraw/zinc/62/08/37/176620837.db2.gz JRZLKCJIEJSQGN-DGCLKSJQSA-N 2 0 234.343 2.227 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H]1CCOc2ccccc21 ZINC000310384163 176620996 /nfs/dbraw/zinc/62/09/96/176620996.db2.gz JRZLKCJIEJSQGN-YPMHNXCESA-N 2 0 234.343 2.227 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCc2ccccc2C1)C[NH+](C)C ZINC000291709195 176686228 /nfs/dbraw/zinc/68/62/28/176686228.db2.gz LBHIQBFSBLKSBP-CJNGLKHVSA-N 2 0 246.398 2.331 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]Cc1cnc(C2CC2)s1 ZINC000556952667 322932127 /nfs/dbraw/zinc/93/21/27/322932127.db2.gz ICEXJYCQMWTBIJ-SECBINFHSA-N 2 0 239.388 2.238 20 0 BEADRP C[C@H](c1ccccn1)N(C)C[C@@H]1CCC[NH2+]C1 ZINC000095068225 177042231 /nfs/dbraw/zinc/04/22/31/177042231.db2.gz AEVYYNQGMOLKNQ-CHWSQXEVSA-N 2 0 233.359 2.074 20 0 BEADRP C[C@H]1CC([NH2+]CCC[NH+](C)C)C[C@H](C)C1 ZINC000082829456 177065506 /nfs/dbraw/zinc/06/55/06/177065506.db2.gz CWHACVBARSMTPG-VXGBXAGGSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H]1CCCC[N@@H+]1CCC[NH2+]Cc1ccn(C)c1 ZINC000091007084 177075323 /nfs/dbraw/zinc/07/53/23/177075323.db2.gz BJHJTBSOCFXTQP-AWEZNQCLSA-N 2 0 249.402 2.379 20 0 BEADRP C[C@@H]1[C@@H](C)CCC[N@@H+]1CCC1CC[NH2+]CC1 ZINC000050565083 177098212 /nfs/dbraw/zinc/09/82/12/177098212.db2.gz YRTHNYBSOKWNCL-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1CCC[N@H+](CCCC2CC[NH2+]CC2)C1 ZINC000050952292 177098401 /nfs/dbraw/zinc/09/84/01/177098401.db2.gz KAAOQSAMUUHDIY-ZDUSSCGKSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H]1CCC[C@H](C)[N@H+]1C[C@@H]1CCC[NH2+]C1 ZINC000019507011 177117834 /nfs/dbraw/zinc/11/78/34/177117834.db2.gz YTQFOZSUKFBQCQ-FRRDWIJNSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@H]1CCC[C@@H]([NH+]2CCC(C[NH3+])CC2)C1 ZINC000044511959 177121222 /nfs/dbraw/zinc/12/12/22/177121222.db2.gz CONRXVQGEDTUMS-WCQYABFASA-N 2 0 210.365 2.236 20 0 BEADRP C[C@H]1CCC[C@@H]([NH2+]CC2CC[NH+](C)CC2)C1 ZINC000044515367 177123102 /nfs/dbraw/zinc/12/31/02/177123102.db2.gz ZSHWUEAKMWSPOC-GXTWGEPZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1CCC[C@H](C)C1[NH2+]CCC[NH+](C)C ZINC000019958272 177130387 /nfs/dbraw/zinc/13/03/87/177130387.db2.gz GGGJVALCHITYFW-RYUDHWBXSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H]1CC[N@H+](CCCCCF)C[C@@H]1C[NH3+] ZINC000336695472 177160967 /nfs/dbraw/zinc/16/09/67/177160967.db2.gz NWIANVCSFZTACX-RYUDHWBXSA-N 2 0 216.344 2.043 20 0 BEADRP C[C@H]1CC[N@H+](Cc2ccc(F)cc2)C[C@@H]1C[NH3+] ZINC000163392463 177164127 /nfs/dbraw/zinc/16/41/27/177164127.db2.gz FEBDUFSVLGLESC-AAEUAGOBSA-N 2 0 236.334 2.242 20 0 BEADRP C[C@H]1CC[C@H]([NH2+]CC2([NH3+])CCCCC2)C1 ZINC000129454630 177204584 /nfs/dbraw/zinc/20/45/84/177204584.db2.gz MCGCXODUHPXTSL-RYUDHWBXSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@H]1CC[C@H]([NH2+]CC2=CC[N@H+](C)CC2)C1 ZINC000309105910 177204739 /nfs/dbraw/zinc/20/47/39/177204739.db2.gz HWKXDEILZBQEHM-AAEUAGOBSA-N 2 0 208.349 2.027 20 0 BEADRP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]CC1CCCCC1 ZINC000252710419 177233592 /nfs/dbraw/zinc/23/35/92/177233592.db2.gz GPLNZMMVGDJOCD-GXTWGEPZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@@H]1C ZINC000309050388 177239188 /nfs/dbraw/zinc/23/91/88/177239188.db2.gz PIVVJSVBOPVVLH-RXGFPQBGSA-N 2 0 210.365 2.103 20 0 BEADRP C[C@H]1C[N@H+](CCC2CC[NH2+]CC2)C(C)(C)C1 ZINC000336538744 177247086 /nfs/dbraw/zinc/24/70/86/177247086.db2.gz MAXCZRNLHWNUIO-GFCCVEGCSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1C[N@H+](CC[C@@H]2CC[NH2+]C2)C(C)(C)C1 ZINC000335631441 177253850 /nfs/dbraw/zinc/25/38/50/177253850.db2.gz PBPAGEFQEGDBPY-NEPJUHHUSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]1C[N@H+](CCc2ccc(F)cc2)CC[C@@H]1[NH3+] ZINC000049708187 177254867 /nfs/dbraw/zinc/25/48/67/177254867.db2.gz LKJRAQRTOSXBCU-FZMZJTMJSA-N 2 0 236.334 2.037 20 0 BEADRP C[C@H](Cc1ccccc1)C[N@@H+]1C[C@H](C)[C@H]([NH3+])C1 ZINC000340693028 177257186 /nfs/dbraw/zinc/25/71/86/177257186.db2.gz WXKOYBGDRLIFOZ-VNHYZAJKSA-N 2 0 232.371 2.144 20 0 BEADRP C[C@H](C[NH2+][C@@H]1C[C@H](C)[C@@H]1C)C[NH+]1CCCC1 ZINC000309346837 177331878 /nfs/dbraw/zinc/33/18/78/177331878.db2.gz MJJFXJNICYTMFC-ZOBORPQBSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1CCC[C@@H]1C[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000300244542 177332674 /nfs/dbraw/zinc/33/26/74/177332674.db2.gz YBPNIFVWULNFES-RQJABVFESA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H](C[C@@H]1CCCO1)[NH2+][C@H]1CCN(C)[C@@H](C)C1 ZINC000360933839 177333578 /nfs/dbraw/zinc/33/35/78/177333578.db2.gz WJJRVLVDCCSGMU-RFGFWPKPSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@H]1C[C@H](C[N@H+](C)CC2CCCC2)CC[NH2+]1 ZINC000235723557 177361297 /nfs/dbraw/zinc/36/12/97/177361297.db2.gz XGJOYLGVOMIHRI-GXTWGEPZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1C[C@H](C[N@H+](C)C2CCCC2)CC[NH2+]1 ZINC000235723388 177361316 /nfs/dbraw/zinc/36/13/16/177361316.db2.gz YVVAQYMKIRUPRE-NWDGAFQWSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CCC2(C)CC2)CC[N@@H+]1C ZINC000336760058 177368794 /nfs/dbraw/zinc/36/87/94/177368794.db2.gz LYHRGWAZWWKIHI-NWDGAFQWSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CCC2(C)CC2)CN1C1CC1 ZINC000336677013 177368908 /nfs/dbraw/zinc/36/89/08/177368908.db2.gz BIFGGOBXRGDYPU-RYUDHWBXSA-N 2 0 222.376 2.391 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]CC(C)(C)C ZINC000040492885 177369106 /nfs/dbraw/zinc/36/91/06/177369106.db2.gz ZERYNCXKMOEEKK-WOPDTQHZSA-N 2 0 212.381 2.351 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]C1CCCC1 ZINC000036907482 177369730 /nfs/dbraw/zinc/36/97/30/177369730.db2.gz DPAJTUCYATWMFY-MDZLAQPJSA-N 2 0 210.365 2.247 20 0 BEADRP C[C@H](C[C@@H]1CCCO1)[NH2+][C@@H]1CCN(C)[C@@H](C)C1 ZINC000360933840 177372031 /nfs/dbraw/zinc/37/20/31/177372031.db2.gz WJJRVLVDCCSGMU-RQJABVFESA-N 2 0 240.391 2.016 20 0 BEADRP C[C@H]1C[C@H]1C[NH2+]CC(C)(C)C[NH+]1CCCC1 ZINC000336749560 177380853 /nfs/dbraw/zinc/38/08/53/177380853.db2.gz UDHZSZJALGGDAS-STQMWFEESA-N 2 0 224.392 2.354 20 0 BEADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+][C@@H]1C[C@@H]1C ZINC000224245824 177386128 /nfs/dbraw/zinc/38/61/28/177386128.db2.gz PZSZSXXNEMHNQU-QNWHQSFQSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@@H]1Cc2c(ncn2Cc2c[nH]cn2)C[C@@H]1C ZINC000295142888 177391674 /nfs/dbraw/zinc/39/16/74/177391674.db2.gz LEZUIYQXUJIAGS-VHSXEESVSA-N 2 0 230.315 2.025 20 0 BEADRP C[C@@H]([N@H+](C)C[C@@H]1CCC[NH2+]C1)C1(C)CC1 ZINC000226439200 487640086 /nfs/dbraw/zinc/64/00/86/487640086.db2.gz CURNQZUKQFPNCM-VXGBXAGGSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]([NH2+]CC1(C)CCCC1)[C@H]1CCC[NH2+]1 ZINC000400422270 225245782 /nfs/dbraw/zinc/24/57/82/225245782.db2.gz XIRJLEUSBKHJRM-NWDGAFQWSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000488352452 225383427 /nfs/dbraw/zinc/38/34/27/225383427.db2.gz NVTPFPNJCWPNTO-BPLDGKMQSA-N 2 0 236.403 2.306 20 0 BEADRP CSCCCCC[NH2+][C@H](C)[C@@H]1CCC[NH2+]1 ZINC000400356945 226341633 /nfs/dbraw/zinc/34/16/33/226341633.db2.gz AVXNCUOTIDDBSV-NEPJUHHUSA-N 2 0 230.421 2.250 20 0 BEADRP C[C@H]([NH2+][C@H]1CCCC[C@H]1C)[C@@H]1CCC[NH2+]1 ZINC000400368645 226342195 /nfs/dbraw/zinc/34/21/95/226342195.db2.gz GAMKZSUXASMUTL-VOAKCMCISA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H]([NH2+]CC1C(C)(C)C1(C)C)[C@@H]1CCC[NH2+]1 ZINC000400498319 226345067 /nfs/dbraw/zinc/34/50/67/226345067.db2.gz BKDBCILJGCFVQW-QWRGUYRKSA-N 2 0 224.392 2.399 20 0 BEADRP CSC1(C[NH2+][C@H](C)[C@H]2CCC[NH2+]2)CCC1 ZINC000400507639 226345152 /nfs/dbraw/zinc/34/51/52/226345152.db2.gz IJPKATJFZVABQR-GHMZBOCLSA-N 2 0 228.405 2.002 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CCC[C@H]1C)[C@H]1CCC[NH2+]1 ZINC000400678493 226348943 /nfs/dbraw/zinc/34/89/43/226348943.db2.gz WGIWZWNGRBSHMD-FDYHWXHSSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)C(C)(C)C ZINC000400941005 226352551 /nfs/dbraw/zinc/35/25/51/226352551.db2.gz CVGDWUYQCLWXQT-ZDEQEGDKSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)[C@@H]1CC1(C)C ZINC000401171455 226353154 /nfs/dbraw/zinc/35/31/54/226353154.db2.gz WXRWJAAEBLVMLT-VJTDZRGJSA-N 2 0 236.403 2.399 20 0 BEADRP C[C@H]1CN(C)C[C@@H]1[NH2+]Cc1cccc2[nH]ccc21 ZINC000674912611 487653675 /nfs/dbraw/zinc/65/36/75/487653675.db2.gz JQELBKSYRJLUQO-NHYWBVRUSA-N 2 0 243.354 2.208 20 0 BEADRP F[C@H]1CC[C@@H]([NH2+]C2CC[NH+](CC3CC3)CC2)C1 ZINC000557446925 322937474 /nfs/dbraw/zinc/93/74/74/322937474.db2.gz VRPQMWLRVWHMOS-GXTWGEPZSA-N 2 0 240.366 2.341 20 0 BEADRP CC(C)[N@@H+]1CCCN(c2cc[nH+]cc2)CC1 ZINC000145849225 487669773 /nfs/dbraw/zinc/66/97/73/487669773.db2.gz FZPAYWUOHYVFTL-UHFFFAOYSA-N 2 0 219.332 2.002 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)c1ccco1 ZINC000401018256 229168733 /nfs/dbraw/zinc/16/87/33/229168733.db2.gz BHJKCKUCMRJZFR-ZDEQEGDKSA-N 2 0 234.343 2.318 20 0 BEADRP C[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C[C@H]1C[NH3+] ZINC000307576060 229216474 /nfs/dbraw/zinc/21/64/74/229216474.db2.gz LWVSSRANZONVSB-UMVBOHGHSA-N 2 0 232.371 2.492 20 0 BEADRP CC[C@H](C)C[N@H+](CC)C[C@H](O)C[NH+](C)C(C)C ZINC000383842530 487677591 /nfs/dbraw/zinc/67/75/91/487677591.db2.gz ZQXQYXCBICDIEI-UONOGXRCSA-N 2 0 244.423 2.056 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH2+]C[C@]2(C)CCCS2)C1 ZINC000087792727 487686731 /nfs/dbraw/zinc/68/67/31/487686731.db2.gz YUTMPNUTEHAENN-STQMWFEESA-N 2 0 242.432 2.204 20 0 BEADRP C[C@H]([NH2+]CC1(C)CC[NH+](C)CC1)[C@H]1CC12CC2 ZINC000527889013 262890947 /nfs/dbraw/zinc/89/09/47/262890947.db2.gz WQJQZHCYROVFAB-QWHCGFSZSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CCC[N@@H+]([C@@H](C)c2ccncc2)C1 ZINC000226332184 487712763 /nfs/dbraw/zinc/71/27/63/487712763.db2.gz MUUPRRMLDMJSTE-SGMGOOAPSA-N 2 0 233.359 2.202 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@@H]1CCOC(C)(C)C1 ZINC000226336189 487713754 /nfs/dbraw/zinc/71/37/54/487713754.db2.gz UQHBJLSLGSKABG-CYBMUJFWSA-N 2 0 242.407 2.264 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CC2(C)CC[NH+](C)CC2)CS1 ZINC000226343859 487714453 /nfs/dbraw/zinc/71/44/53/487714453.db2.gz HKDZTSSTQHXRKG-RYUDHWBXSA-N 2 0 242.432 2.202 20 0 BEADRP CC[NH+](CC)CCC[NH2+]C[C@](C)(CC)OC ZINC000233455638 487717225 /nfs/dbraw/zinc/71/72/25/487717225.db2.gz BPWBGVWSXSAWIV-ZDUSSCGKSA-N 2 0 230.396 2.123 20 0 BEADRP CCO[C@H]1C[C@H]([NH2+]CC2([NH3+])CCCC2)C1(C)C ZINC000233763975 487739789 /nfs/dbraw/zinc/73/97/89/487739789.db2.gz LOTNNEUPSUEOBI-RYUDHWBXSA-N 2 0 240.391 2.051 20 0 BEADRP CCO[C@@H]1C[C@H]([NH2+]CC[C@@H]([NH3+])C(C)C)C1(C)C ZINC000233766280 487740031 /nfs/dbraw/zinc/74/00/31/487740031.db2.gz MGGQGSVJZRPOFW-FRRDWIJNSA-N 2 0 242.407 2.153 20 0 BEADRP CC(C)[C@@H]([NH3+])CC[N@H+](C)[C@H](C)c1ccncc1 ZINC000251357689 487754741 /nfs/dbraw/zinc/75/47/41/487754741.db2.gz UQTGCGLPEDRPQH-OCCSQVGLSA-N 2 0 235.375 2.448 20 0 BEADRP C[C@@H](C[NH2+]CC[C@H]1CC[NH2+]C1)C(C)(C)C ZINC000162946395 487793565 /nfs/dbraw/zinc/79/35/65/487793565.db2.gz YQXFCZGIRDLCFU-RYUDHWBXSA-N 2 0 212.381 2.258 20 0 BEADRP C[NH2+]C1CC[NH+](C[C@H](C)C(C)(C)C)CC1 ZINC000162967004 487794447 /nfs/dbraw/zinc/79/44/47/487794447.db2.gz MPLJPIKWGRWBHY-NSHDSACASA-N 2 0 212.381 2.352 20 0 BEADRP CC[C@@H]1C[N@H+](CCOc2ccccc2)CC[C@H]1[NH3+] ZINC000251788161 487799098 /nfs/dbraw/zinc/79/90/98/487799098.db2.gz NKLWUJXOMGINSY-UKRRQHHQSA-N 2 0 248.370 2.125 20 0 BEADRP Cc1ccsc1C[N@H+]1CC[C@@H]([NH3+])C[C@H]1C ZINC000227349374 487810088 /nfs/dbraw/zinc/81/00/88/487810088.db2.gz CUYFBTRQWPWLET-GHMZBOCLSA-N 2 0 224.373 2.368 20 0 BEADRP Cc1cccc(C[NH2+]CCc2cn(C)cn2)c1 ZINC000313288777 487811890 /nfs/dbraw/zinc/81/18/90/487811890.db2.gz ZNWSGAVSGJKOST-UHFFFAOYSA-N 2 0 229.327 2.061 20 0 BEADRP CC[C@]1(C)CCC[C@H]1[NH2+]CCC[NH+](C)C ZINC000651666852 487813158 /nfs/dbraw/zinc/81/31/58/487813158.db2.gz QFRWGWIOGRAXRG-CHWSQXEVSA-N 2 0 212.381 2.497 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@@H](C)C(C)(C)OC)CC1 ZINC000302338183 487818582 /nfs/dbraw/zinc/81/85/82/487818582.db2.gz DUFBFDNCAJOQMH-LBPRGKRZSA-N 2 0 242.407 2.121 20 0 BEADRP CCC[N@H+](CCC[NH3+])CCc1cccs1 ZINC000414758920 487821124 /nfs/dbraw/zinc/82/11/24/487821124.db2.gz VQSMKVGNTXICDS-UHFFFAOYSA-N 2 0 226.389 2.351 20 0 BEADRP CC[C@@H]1CCCCC[N@@H+]1C[C@H]1CC[NH2+]C1 ZINC000252681290 487828625 /nfs/dbraw/zinc/82/86/25/487828625.db2.gz AAGIJTMNFJZHQX-QWHCGFSZSA-N 2 0 210.365 2.251 20 0 BEADRP CCC[C@@H](C[NH2+]CCC1CC[NH+](C)CC1)OC ZINC000386152047 487829477 /nfs/dbraw/zinc/82/94/77/487829477.db2.gz SIHYHUNLOVAJIT-AWEZNQCLSA-N 2 0 242.407 2.123 20 0 BEADRP CCc1ncc(C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)s1 ZINC000414936227 487831242 /nfs/dbraw/zinc/83/12/42/487831242.db2.gz ZDKYAPVVJNQFER-NXEZZACHSA-N 2 0 239.388 2.065 20 0 BEADRP CCc1ncc(C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)s1 ZINC000414936240 487831339 /nfs/dbraw/zinc/83/13/39/487831339.db2.gz ZDKYAPVVJNQFER-VHSXEESVSA-N 2 0 239.388 2.065 20 0 BEADRP CCc1ncc(C[NH2+][C@H]2CCC[C@H]([NH3+])C2)s1 ZINC000414936233 487831479 /nfs/dbraw/zinc/83/14/79/487831479.db2.gz ZDKYAPVVJNQFER-UWVGGRQHSA-N 2 0 239.388 2.065 20 0 BEADRP CC[C@H](C[NH2+]CCC[NH3+])Oc1ccccc1C ZINC000415074997 487835841 /nfs/dbraw/zinc/83/58/41/487835841.db2.gz DNOBIRUJYGBBPY-CYBMUJFWSA-N 2 0 236.359 2.091 20 0 BEADRP Cc1cccc(CC[NH2+]C2CCC(C[NH3+])CC2)n1 ZINC000415102312 487837307 /nfs/dbraw/zinc/83/73/07/487837307.db2.gz IPKJVASZJHTQHZ-UHFFFAOYSA-N 2 0 247.386 2.040 20 0 BEADRP CCC1CC([NH2+]C[C@@H]2CCC[N@H+](C)C2)C1 ZINC000389941813 487847573 /nfs/dbraw/zinc/84/75/73/487847573.db2.gz OUWWFDBVOVSBEU-CPCZMJQVSA-N 2 0 210.365 2.106 20 0 BEADRP CSC(C)(C)C[NH2+]CC1CC[NH+](C)CC1 ZINC000229087644 640920958 /nfs/dbraw/zinc/92/09/58/640920958.db2.gz OZNSXNGLYXBPQN-UHFFFAOYSA-N 2 0 230.421 2.059 20 0 BEADRP c1ccc2c(c1)ccnc2CN[C@@H]1CCC[NH2+]C1 ZINC000666814079 487867443 /nfs/dbraw/zinc/86/74/43/487867443.db2.gz FNXDIPZLMLPRJH-CYBMUJFWSA-N 2 0 241.338 2.076 20 0 BEADRP COC[C@]1(C[NH2+]C[C@@H](C)C(C)(C)C)CCC[NH2+]1 ZINC000666891906 487875691 /nfs/dbraw/zinc/87/56/91/487875691.db2.gz BVQCIYBSISVTQR-TZMCWYRMSA-N 2 0 242.407 2.027 20 0 BEADRP COC[C@@]1(C[NH2+]C[C@H](C)C(C)(C)C)CCC[NH2+]1 ZINC000666891904 487875946 /nfs/dbraw/zinc/87/59/46/487875946.db2.gz BVQCIYBSISVTQR-JSGCOSHPSA-N 2 0 242.407 2.027 20 0 BEADRP Cc1ccc(F)cc1C[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000666856546 487891107 /nfs/dbraw/zinc/89/11/07/487891107.db2.gz OVOUAKDLOYLRAP-CQSZACIVSA-N 2 0 236.334 2.366 20 0 BEADRP Cc1ccccc1C[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000666950984 487909995 /nfs/dbraw/zinc/90/99/95/487909995.db2.gz VLTIDKGDDUOHDA-AWEZNQCLSA-N 2 0 230.355 2.227 20 0 BEADRP C[C@H]1CCC[C@@H]([NH2+]CCC[NH+](C)C)CC1 ZINC000083427151 487910949 /nfs/dbraw/zinc/91/09/49/487910949.db2.gz MJEFXIQNXGDSBI-QWHCGFSZSA-N 2 0 212.381 2.497 20 0 BEADRP CCc1ccc(C[NH2+][C@@H]2CC23CC[NH2+]CC3)cc1 ZINC000666950917 487913492 /nfs/dbraw/zinc/91/34/92/487913492.db2.gz QKHRVNFTWNTNMM-OAHLLOKOSA-N 2 0 244.382 2.481 20 0 BEADRP CCC[C@@H](CC)[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000666953901 487915966 /nfs/dbraw/zinc/91/59/66/487915966.db2.gz KLLVCWNOSAGTJD-VXGBXAGGSA-N 2 0 210.365 2.297 20 0 BEADRP CCCC[C@H](C)[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000666954508 487916042 /nfs/dbraw/zinc/91/60/42/487916042.db2.gz WRMNNDLINMNFNQ-RYUDHWBXSA-N 2 0 210.365 2.297 20 0 BEADRP CCCC[C@@H](C)[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000666954506 487916235 /nfs/dbraw/zinc/91/62/35/487916235.db2.gz WRMNNDLINMNFNQ-NEPJUHHUSA-N 2 0 210.365 2.297 20 0 BEADRP CCCC[C@H](C)[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000666954507 487916250 /nfs/dbraw/zinc/91/62/50/487916250.db2.gz WRMNNDLINMNFNQ-NWDGAFQWSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[C@H](C[NH3+])C1)C(C)(C)C ZINC000666964030 487919632 /nfs/dbraw/zinc/91/96/32/487919632.db2.gz CSUHJNXSLXWQBD-GRYCIOLGSA-N 2 0 212.381 2.386 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC[C@@H](C[NH3+])C1)C(C)(C)C ZINC000666964032 487919644 /nfs/dbraw/zinc/91/96/44/487919644.db2.gz CSUHJNXSLXWQBD-UTUOFQBUSA-N 2 0 212.381 2.386 20 0 BEADRP [NH3+]C[C@H]1CC[C@H]([NH2+]Cc2cccc(F)c2F)C1 ZINC000666962230 487919963 /nfs/dbraw/zinc/91/99/63/487919963.db2.gz UDDCNUICJHPROH-ONGXEEELSA-N 2 0 240.297 2.182 20 0 BEADRP C1CC2(C1)C[C@@H]([NH2+]C1CCSCC1)CC[NH2+]2 ZINC000666995209 487920970 /nfs/dbraw/zinc/92/09/70/487920970.db2.gz GJQMRVAHVVBPAN-LBPRGKRZSA-N 2 0 240.416 2.146 20 0 BEADRP C[C@H](CC1CCC1)[NH2+]CCC[NH2+]C1CC1 ZINC000666991366 487922173 /nfs/dbraw/zinc/92/21/73/487922173.db2.gz BJKIUVVURPAOAU-LLVKDONJSA-N 2 0 210.365 2.297 20 0 BEADRP CC1CC([NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)C1 ZINC000666995179 487924588 /nfs/dbraw/zinc/92/45/88/487924588.db2.gz FKJOYOPOBYBQJQ-MOENNCHZSA-N 2 0 208.349 2.049 20 0 BEADRP Cc1cc(N[C@@H]2CC[N@@H+](C3CC3)C2)cc[nH+]1 ZINC000229565606 487926591 /nfs/dbraw/zinc/92/65/91/487926591.db2.gz KTVLTKFJAKNMJO-GFCCVEGCSA-N 2 0 217.316 2.039 20 0 BEADRP C[C@@H]1C[C@@H](C)[N@H+](CCCC2CC[NH2+]CC2)C1 ZINC000157983257 487932052 /nfs/dbraw/zinc/93/20/52/487932052.db2.gz PZDUFOJIIZFIPY-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[C@H](C)[N@H+](CCCC2CC[NH2+]CC2)C1 ZINC000157982996 487932084 /nfs/dbraw/zinc/93/20/84/487932084.db2.gz PZDUFOJIIZFIPY-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP FC1(F)C[C@@]12CC[N@H+](CC[C@H]1CCC[NH2+]C1)C2 ZINC000652364480 487934228 /nfs/dbraw/zinc/93/42/28/487934228.db2.gz SQAYIKROTAFWTH-VXGBXAGGSA-N 2 0 244.329 2.107 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C2CCC([NH+](C)C)CC2)CS1 ZINC000666207375 487935458 /nfs/dbraw/zinc/93/54/58/487935458.db2.gz AKGCBVCQAIVNMI-IGJPJIBNSA-N 2 0 242.432 2.343 20 0 BEADRP CC1=CCC[C@H](C)[C@H]1C[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC000682404681 487947572 /nfs/dbraw/zinc/94/75/72/487947572.db2.gz HYVSTPZZCIFQRM-XQLPTFJDSA-N 2 0 234.387 2.130 20 0 BEADRP COCC1(CC[NH2+][C@H]2CCC[C@@H]([NH3+])C2)CCC1 ZINC000566480835 323000986 /nfs/dbraw/zinc/00/09/86/323000986.db2.gz BBVGCRDWOYDSJY-OLZOCXBDSA-N 2 0 240.391 2.053 20 0 BEADRP CCN1CCC[C@H]([NH2+][C@H]2CCCC23CC3)C1 ZINC000566500775 323003761 /nfs/dbraw/zinc/00/37/61/323003761.db2.gz QUUNUABATQKPNC-STQMWFEESA-N 2 0 222.376 2.393 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](C)C2CC2)C1 ZINC000247401209 323012999 /nfs/dbraw/zinc/01/29/99/323012999.db2.gz XHSPPKIHNBZQIZ-VXGBXAGGSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H](C[NH2+][C@H]1C[C@@H](C)O[C@@H](C)C1)N(C)C1CC1 ZINC000562517647 323022590 /nfs/dbraw/zinc/02/25/90/323022590.db2.gz JYJIOHQXZGCHST-WUHRBBMRSA-N 2 0 240.391 2.015 20 0 BEADRP CC[C@H](C)N(C)CC[NH2+][C@H]1C[C@@H](C)O[C@@H](C)C1 ZINC000562518992 323022744 /nfs/dbraw/zinc/02/27/44/323022744.db2.gz SXECNNROCKQDSX-IGQOVBAYSA-N 2 0 242.407 2.262 20 0 BEADRP CCC(C)(C)[C@H](C)[NH2+]C[C@H](C)C[NH2+]C ZINC000562956128 323035013 /nfs/dbraw/zinc/03/50/13/323035013.db2.gz GUHFQKHMQXIKHB-MNOVXSKESA-N 2 0 200.370 2.256 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H](C)c1cccc(F)c1 ZINC000562956186 323035017 /nfs/dbraw/zinc/03/50/17/323035017.db2.gz LGVMQXNBQSVPJI-NSHDSACASA-N 2 0 224.323 2.476 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+][C@@H]1CC[C@H](C[NH3+])C1 ZINC000562962658 323036552 /nfs/dbraw/zinc/03/65/52/323036552.db2.gz JPOXTEFIKYKRNV-FRRDWIJNSA-N 2 0 236.359 2.318 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+][C@H]1CC[C@@H](C[NH3+])C1 ZINC000562962662 323036620 /nfs/dbraw/zinc/03/66/20/323036620.db2.gz JPOXTEFIKYKRNV-UPJWGTAASA-N 2 0 236.359 2.318 20 0 BEADRP Cc1ncc(C[NH2+]C[C@@H]2CCCCS2)n1C ZINC000570582600 323064093 /nfs/dbraw/zinc/06/40/93/323064093.db2.gz BBWBEUAUYDFXLE-LBPRGKRZSA-N 2 0 239.388 2.104 20 0 BEADRP CO[C@H](C[NH2+][C@H]1CCC[C@@H]([NH3+])C1)c1ccccc1 ZINC000570815675 323071515 /nfs/dbraw/zinc/07/15/15/323071515.db2.gz CZRAQCQUOVNNMP-QLFBSQMISA-N 2 0 248.370 2.234 20 0 BEADRP CCC1(C[NH2+][C@@H]2C[C@H]([NH3+])c3ccccc32)COC1 ZINC000393961079 323098920 /nfs/dbraw/zinc/09/89/20/323098920.db2.gz DYKJLIPAHIAQCP-UONOGXRCSA-N 2 0 246.354 2.147 20 0 BEADRP c1ccc([C@H](CC2CC2)[NH2+][C@@H]2[C@H]3C[NH2+]C[C@H]32)cc1 ZINC000571194778 323137892 /nfs/dbraw/zinc/13/78/92/323137892.db2.gz LGUZLQYXOPRCBD-XUWVNRHRSA-N 2 0 242.366 2.335 20 0 BEADRP c1ccc([C@@H](CC2CC2)[NH2+][C@@H]2[C@H]3C[NH2+]C[C@H]32)cc1 ZINC000571194777 323137904 /nfs/dbraw/zinc/13/79/04/323137904.db2.gz LGUZLQYXOPRCBD-QXSJWSMHSA-N 2 0 242.366 2.335 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]Cc1ccnc2ccccc12 ZINC000571296069 323140653 /nfs/dbraw/zinc/14/06/53/323140653.db2.gz QXBMLTVQEYNXME-LBPRGKRZSA-N 2 0 243.354 2.452 20 0 BEADRP C[C@@H]1CC(C)(C)C[C@H]1[NH2+]CC1CC[NH2+]CC1 ZINC000571394827 323143353 /nfs/dbraw/zinc/14/33/53/323143353.db2.gz PCKKCHLVYWXWGI-DGCLKSJQSA-N 2 0 224.392 2.400 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@@H]1CCC[C@H](C)[C@H]1C ZINC000414956063 323152240 /nfs/dbraw/zinc/15/22/40/323152240.db2.gz MYDYOJBIRPJJCD-UMSGYPCISA-N 2 0 212.381 2.399 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+]C/C=C/c1ccccc1 ZINC000414956076 323152242 /nfs/dbraw/zinc/15/22/42/323152242.db2.gz MZHDQHASTMSHAA-IEOKHJKGSA-N 2 0 230.355 2.287 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@H](C)CCC(C)C ZINC000414956074 323152264 /nfs/dbraw/zinc/15/22/64/323152264.db2.gz MYRMVKVZADHXAZ-VXGBXAGGSA-N 2 0 200.370 2.399 20 0 BEADRP CCCCC[N@@H+]1CC[C@@H](c2nccn2C)C1 ZINC000541892865 323161991 /nfs/dbraw/zinc/16/19/91/323161991.db2.gz ODQDUIWEYJDMIC-GFCCVEGCSA-N 2 0 221.348 2.400 20 0 BEADRP Cc1nccn1CC[N@@H+](C)Cc1cccc(O)c1 ZINC000535035017 323164084 /nfs/dbraw/zinc/16/40/84/323164084.db2.gz UGHACOHZEQAVQF-UHFFFAOYSA-N 2 0 245.326 2.029 20 0 BEADRP CCc1ccc([C@@H](C)[NH2+]CC2CC[NH2+]CC2)o1 ZINC000571669346 323177081 /nfs/dbraw/zinc/17/70/81/323177081.db2.gz HTSJBJKSEBJYGE-LLVKDONJSA-N 2 0 236.359 2.492 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]CCOC(C)(C)C ZINC000308722979 323177361 /nfs/dbraw/zinc/17/73/61/323177361.db2.gz FBDIXWRTDBIDFR-AGIUHOORSA-N 2 0 242.407 2.120 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CCN2CC[C@@H](C)C2)C1 ZINC000308824573 323179298 /nfs/dbraw/zinc/17/92/98/323179298.db2.gz DGYBHMZVWBAVEN-UPJWGTAASA-N 2 0 210.365 2.106 20 0 BEADRP C[N@@H+]1CCC[C@@H]1CC[NH2+]C1(C2CC2)CC1 ZINC000308923526 323181804 /nfs/dbraw/zinc/18/18/04/323181804.db2.gz HOJSIGJOAXYSAI-GFCCVEGCSA-N 2 0 208.349 2.003 20 0 BEADRP C[C@H](CC(C)(C)C)[NH2+][C@@H]1CC[NH2+]C[C@@H]1C ZINC000395136327 323188724 /nfs/dbraw/zinc/18/87/24/323188724.db2.gz RTLRVQBKVZSEJH-QJPTWQEYSA-N 2 0 212.381 2.399 20 0 BEADRP CC[C@@H]([NH2+][C@H]1CC[NH2+]C12CCC2)C1CCC1 ZINC000530213641 323216843 /nfs/dbraw/zinc/21/68/43/323216843.db2.gz BDLUIHJXGPSYNB-OLZOCXBDSA-N 2 0 222.376 2.439 20 0 BEADRP COCC[C@H]1CCC[C@H]1[NH2+]CCC[NH2+]C(C)C ZINC000563951263 323330274 /nfs/dbraw/zinc/33/02/74/323330274.db2.gz UKRWGQOIHXGRAY-ZIAGYGMSSA-N 2 0 242.407 2.169 20 0 BEADRP CC(C)[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)C1CC1 ZINC000152473094 323338073 /nfs/dbraw/zinc/33/80/73/323338073.db2.gz CBAQYHSGINJPBW-DOMZBBRYSA-N 2 0 236.403 2.495 20 0 BEADRP CC(C)(C)[C@H]1CC[C@H]1[NH2+]CC1CC[NH2+]CC1 ZINC000572510485 324136778 /nfs/dbraw/zinc/13/67/78/324136778.db2.gz RNOAEPFUPXNHJG-QWHCGFSZSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H]([NH2+]CCCc1ccccc1)[C@H]1CCC[NH2+]1 ZINC000400785083 324168726 /nfs/dbraw/zinc/16/87/26/324168726.db2.gz QNKJYQNOFKCVPG-DZGCQCFKSA-N 2 0 232.371 2.349 20 0 BEADRP CCCCC[N@@H+]1C[C@H](C[NH3+])[C@H](C)C[C@H]1C ZINC000397339384 324211965 /nfs/dbraw/zinc/21/19/65/324211965.db2.gz VBHNJPVWBHBDFS-UPJWGTAASA-N 2 0 212.381 2.482 20 0 BEADRP CCCCC[N@@H+]1C[C@H](C[NH3+])[C@@H](C)C[C@H]1C ZINC000397339385 324212842 /nfs/dbraw/zinc/21/28/42/324212842.db2.gz VBHNJPVWBHBDFS-XQQFMLRXSA-N 2 0 212.381 2.482 20 0 BEADRP CC[N@H+](C)C[C@@H]1CCN(C/C=C(\C)Cl)C1 ZINC000528396506 324220371 /nfs/dbraw/zinc/22/03/71/324220371.db2.gz IEPCQZHTWCRWDB-JVOXIWMLSA-N 2 0 230.783 2.403 20 0 BEADRP C[C@@H]([NH2+]CC(C)(C)N(C)C)C1CC(F)(F)C1 ZINC000529537375 324322126 /nfs/dbraw/zinc/32/21/26/324322126.db2.gz WCGBKSKLJGSHJF-SECBINFHSA-N 2 0 234.334 2.350 20 0 BEADRP CC1(C)CC(C[NH+]2CCC3(CC[NH2+]3)CC2)C1 ZINC000530227399 324547753 /nfs/dbraw/zinc/54/77/53/324547753.db2.gz XDYKTOPLQKHXSB-UHFFFAOYSA-N 2 0 222.376 2.251 20 0 BEADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+][C@H]2CSC[C@H]2C)C1 ZINC000304365259 325146169 /nfs/dbraw/zinc/14/61/69/325146169.db2.gz FFYHAEMWNOEDRZ-AGIUHOORSA-N 2 0 242.432 2.058 20 0 BEADRP COCc1cccc(C[N@@H+]2CC[C@H]([NH3+])C[C@H]2C)c1 ZINC000131440336 325151646 /nfs/dbraw/zinc/15/16/46/325151646.db2.gz VVEDYSANBGIZTE-DOMZBBRYSA-N 2 0 248.370 2.145 20 0 BEADRP COCc1cccc(C[N@@H+]2CC[C@@H]([NH3+])C[C@@H]2C)c1 ZINC000131440156 325151688 /nfs/dbraw/zinc/15/16/88/325151688.db2.gz VVEDYSANBGIZTE-SWLSCSKDSA-N 2 0 248.370 2.145 20 0 BEADRP CO[C@@H]1CCC[C@H]1[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000132081937 325197748 /nfs/dbraw/zinc/19/77/48/325197748.db2.gz SVZUKDWXJXUJDS-GBJTYRQASA-N 2 0 246.354 2.288 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@H]2CCCC23CC3)CC1 ZINC000565245555 325886252 /nfs/dbraw/zinc/88/62/52/325886252.db2.gz WXMHKXSLNZGIMX-ZDUSSCGKSA-N 2 0 222.376 2.251 20 0 BEADRP CC[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1)[C@H]1CCOC1 ZINC000565421922 325908864 /nfs/dbraw/zinc/90/88/64/325908864.db2.gz IPXYFINXZQLMJJ-LSDHHAIUSA-N 2 0 248.370 2.050 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]CC2Cc3ccccc3C2)C1 ZINC000565609812 325935111 /nfs/dbraw/zinc/93/51/11/325935111.db2.gz RMZYZPZDDDHLKW-HOTGVXAUSA-N 2 0 244.382 2.261 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]C2CCC(F)(F)CC2)C1 ZINC000566483158 326056419 /nfs/dbraw/zinc/05/64/19/326056419.db2.gz ZHFNKSSXVBBWHK-KOLCDFICSA-N 2 0 232.318 2.424 20 0 BEADRP C[N@H+](C[C@H]1CCC[NH+](C)C1)CC1(C)CC1 ZINC000566832784 326086128 /nfs/dbraw/zinc/08/61/28/326086128.db2.gz MQZSLNYWBXTCEB-LBPRGKRZSA-N 2 0 210.365 2.060 20 0 BEADRP CSC1(C[N@H+](C)CCC[NH+](C)C)CCC1 ZINC000567408300 326185103 /nfs/dbraw/zinc/18/51/03/326185103.db2.gz GXWQHGDDCRWROP-UHFFFAOYSA-N 2 0 230.421 2.156 20 0 BEADRP CC[NH2+]CCC[NH2+]C1CCC(CSC)CC1 ZINC000567639108 326236152 /nfs/dbraw/zinc/23/61/52/326236152.db2.gz WCSMVADWZXFUNG-UHFFFAOYSA-N 2 0 244.448 2.497 20 0 BEADRP Cc1ccc(F)c(C[NH2+][C@H](C)C[C@@H](C)[NH3+])c1 ZINC000567871137 326274098 /nfs/dbraw/zinc/27/40/98/326274098.db2.gz SBNPFWMKQISYAS-GHMZBOCLSA-N 2 0 224.323 2.350 20 0 BEADRP CCCC[C@H](COC)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000158198833 326311306 /nfs/dbraw/zinc/31/13/06/326311306.db2.gz WWMVQRXHQORWGW-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP C[N@@H+]1CCC[C@@H]1CC[NH2+][C@@H]1CCC1(C)C ZINC000568182728 326322013 /nfs/dbraw/zinc/32/20/13/326322013.db2.gz ZOXVEXZVBDTGDJ-VXGBXAGGSA-N 2 0 210.365 2.249 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@H]2CC[C@@H]2C2CC2)CC1 ZINC000568310738 326343968 /nfs/dbraw/zinc/34/39/68/326343968.db2.gz QEJZIFAOQFGQQD-CABCVRRESA-N 2 0 236.403 2.497 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H]1CCc2cc(F)ccc21 ZINC000568987663 326385072 /nfs/dbraw/zinc/38/50/72/326385072.db2.gz LAAMVFMFSBVYEL-AWEZNQCLSA-N 2 0 236.334 2.402 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H](C)CCc1ccco1 ZINC000569106283 326390304 /nfs/dbraw/zinc/39/03/04/326390304.db2.gz YDLWGDJFCXDJJW-LBPRGKRZSA-N 2 0 224.348 2.190 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@H]2CCc3c2cccc3O)C1 ZINC000573107548 326430043 /nfs/dbraw/zinc/43/00/43/326430043.db2.gz XRUMUZVHYPKKKG-GYSYKLTISA-N 2 0 246.354 2.239 20 0 BEADRP CCN1CCN(c2ccncc2Cl)C[C@@H]1C ZINC000677152181 487984658 /nfs/dbraw/zinc/98/46/58/487984658.db2.gz JSOVTNQHMZVILT-JTQLQIEISA-N 2 0 239.750 2.265 20 0 BEADRP CCC[N@H+](CC(C)C)C[C@@H](O)C[NH+](C)C(C)C ZINC000310437648 488023396 /nfs/dbraw/zinc/02/33/96/488023396.db2.gz UZBDBGQYMKXCLN-AWEZNQCLSA-N 2 0 244.423 2.056 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000488326263 533717028 /nfs/dbraw/zinc/71/70/28/533717028.db2.gz LJOKAFPRSDFFGW-TZMCWYRMSA-N 2 0 224.392 2.306 20 0 BEADRP CC[C@H]1CCC[N@@H+]1Cc1cnc(C)n1C ZINC000667544389 488041150 /nfs/dbraw/zinc/04/11/50/488041150.db2.gz FTSZUUMRMPONQD-NSHDSACASA-N 2 0 207.321 2.103 20 0 BEADRP COc1c(C)cccc1C[NH2+][C@H](C)C[C@@H](C)[NH3+] ZINC000656200810 488066213 /nfs/dbraw/zinc/06/62/13/488066213.db2.gz QZEJWNANYCYLTA-VXGBXAGGSA-N 2 0 236.359 2.219 20 0 BEADRP C[C@H](Cc1ccccn1)[NH2+][C@@H](C)CCCC[NH3+] ZINC000656200799 488066505 /nfs/dbraw/zinc/06/65/05/488066505.db2.gz FLNLIMYXLKOUCK-QWHCGFSZSA-N 2 0 235.375 2.120 20 0 BEADRP COc1c(C)cccc1C[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000656200852 488067037 /nfs/dbraw/zinc/06/70/37/488067037.db2.gz SDFXNLIHINUENN-KBPBESRZSA-N 2 0 248.370 2.363 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCC[C@@H]([NH3+])C1)CC(F)F ZINC000656200900 488067689 /nfs/dbraw/zinc/06/76/89/488067689.db2.gz YGSXIKLLANMCQM-AEJSXWLSSA-N 2 0 220.307 2.137 20 0 BEADRP c1nc2n(c1C[N@@H+]1CCC3(CCC3)C1)CCC2 ZINC000667644653 488067808 /nfs/dbraw/zinc/06/78/08/488067808.db2.gz QODXHFFANFFXLG-UHFFFAOYSA-N 2 0 231.343 2.205 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCC[C@H]([NH3+])C1)CC(F)F ZINC000656200903 488067868 /nfs/dbraw/zinc/06/78/68/488067868.db2.gz YGSXIKLLANMCQM-LPEHRKFASA-N 2 0 220.307 2.137 20 0 BEADRP CC[C@H]1CC[N@H+](CCCC2CC[NH2+]CC2)C1 ZINC000166328034 488074759 /nfs/dbraw/zinc/07/47/59/488074759.db2.gz OVIWBDNQTBPXQW-ZDUSSCGKSA-N 2 0 224.392 2.498 20 0 BEADRP Cc1ccnc(CN(C)[C@@H]2CC[N@H+](C)[C@H](C)C2)c1 ZINC000683010617 488090797 /nfs/dbraw/zinc/09/07/97/488090797.db2.gz CIFDNNGOQCENOW-UKRRQHHQSA-N 2 0 247.386 2.305 20 0 BEADRP CC[C@H]1CC[N@H+](Cc2cnc3n2CCC3)C1 ZINC000667698043 488092118 /nfs/dbraw/zinc/09/21/18/488092118.db2.gz VWUBOFMURPPJRW-NSHDSACASA-N 2 0 219.332 2.061 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH2+]CC2CCSCC2)C1 ZINC000229214716 488100240 /nfs/dbraw/zinc/10/02/40/488100240.db2.gz ZTUZUEPMCROEFI-ZDUSSCGKSA-N 2 0 242.432 2.061 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)C1 ZINC000667796578 488123665 /nfs/dbraw/zinc/12/36/65/488123665.db2.gz PJECVSPMODDHMB-LJISPDSOSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]1C[C@H](C[NH3+])C[N@@H+]1C[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000403587553 488127270 /nfs/dbraw/zinc/12/72/70/488127270.db2.gz DEYRIVUXDOZATR-KSTCHIGDSA-N 2 0 222.376 2.092 20 0 BEADRP C([C@@H]1CC[C@@H]2C[C@@H]2C1)[N@@H+]1CC[C@]2(CC[NH2+]C2)C1 ZINC000403587561 488127429 /nfs/dbraw/zinc/12/74/29/488127429.db2.gz DFLNRESMCIUZQB-KBXIAJHMSA-N 2 0 234.387 2.108 20 0 BEADRP Cc1ccc(CC[NH2+][C@H]2CCCN(C)C2)cc1 ZINC000076679572 488128590 /nfs/dbraw/zinc/12/85/90/488128590.db2.gz IJNUBUDHDDYMMR-HNNXBMFYSA-N 2 0 232.371 2.221 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](C[C@@H]3CC[C@@H]4C[C@@H]4C3)C[C@H]21 ZINC000403697582 488132613 /nfs/dbraw/zinc/13/26/13/488132613.db2.gz BMFJUTMJHJCEHR-YTQIUSBHSA-N 2 0 248.414 2.482 20 0 BEADRP c1cc2cc(C[NH2+]C3CC[NH2+]CC3)ccc2cn1 ZINC000168772984 487540423 /nfs/dbraw/zinc/54/04/23/487540423.db2.gz HWRLWVATFFPXCG-UHFFFAOYSA-N 2 0 241.338 2.076 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH2+][C@H]2CC23CCC3)CC1 ZINC000721159603 974930959 /nfs/dbraw/zinc/93/09/59/974930959.db2.gz CVSMYIDIYPVLJN-RYUDHWBXSA-N 2 0 208.349 2.003 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@H]2CCC[C@@H]3C[C@@H]32)CC1 ZINC000382159379 487532700 /nfs/dbraw/zinc/53/27/00/487532700.db2.gz SGCSWCBTGIFUOZ-RDBSUJKOSA-N 2 0 222.376 2.106 20 0 BEADRP CC[N@H+](CCC(F)(F)F)CC1CC[NH2+]CC1 ZINC000086703159 487532885 /nfs/dbraw/zinc/53/28/85/487532885.db2.gz GHSHELMJSTWSBT-UHFFFAOYSA-N 2 0 238.297 2.260 20 0 BEADRP C[N@H+](CCC1CCCCC1)C[C@@H]1CC[NH2+]C1 ZINC000258863513 488140582 /nfs/dbraw/zinc/14/05/82/488140582.db2.gz IWZOXAOETUQUPX-CQSZACIVSA-N 2 0 224.392 2.498 20 0 BEADRP CCN(CC[NH3+])CCc1c(F)cccc1Cl ZINC000231819612 487477378 /nfs/dbraw/zinc/47/73/78/487477378.db2.gz ISDUSNIDFCJRMW-UHFFFAOYSA-N 2 0 244.741 2.302 20 0 BEADRP CC[NH+]1CCC(n2cnc3c2CCCC3)CC1 ZINC000671439112 487484088 /nfs/dbraw/zinc/48/40/88/487484088.db2.gz NREJLBWGPBPLEY-UHFFFAOYSA-N 2 0 233.359 2.419 20 0 BEADRP Cc1ccc(C[NH2+][C@H](C)C2CC[NH+](C)CC2)cn1 ZINC000062051202 487491395 /nfs/dbraw/zinc/49/13/95/487491395.db2.gz CVGLUVAPWRVHPC-CYBMUJFWSA-N 2 0 247.386 2.210 20 0 BEADRP C[C@@H]1C[C@@H](C[NH3+])C[N@@H+]1CCC(C)(C)C1CC1 ZINC000405967607 487495245 /nfs/dbraw/zinc/49/52/45/487495245.db2.gz SGUILRAHMAVFPG-NEPJUHHUSA-N 2 0 224.392 2.482 20 0 BEADRP Cc1ccc(CCC[N@H+]2C[C@H]3C[NH2+]C[C@H]3C2)cc1 ZINC000680046169 487526280 /nfs/dbraw/zinc/52/62/80/487526280.db2.gz RFPZQYMALJDDBD-IYBDPMFKSA-N 2 0 244.382 2.079 20 0 BEADRP C[C@@H](C[NH2+][C@H]1CC[NH2+]C[C@H]1C)C(C)(C)C ZINC000379943470 488162435 /nfs/dbraw/zinc/16/24/35/488162435.db2.gz CPMSHDHIYYEHRC-WOPDTQHZSA-N 2 0 212.381 2.256 20 0 BEADRP Fc1cccc(C[NH2+][C@H]2CC23CC[NH2+]CC3)c1 ZINC000666950682 487890614 /nfs/dbraw/zinc/89/06/14/487890614.db2.gz ANYQJOPTMOHXCC-ZDUSSCGKSA-N 2 0 234.318 2.057 20 0 BEADRP C(C1CC1)N1CC[C@H]([NH2+][C@H]2CCC[C@@H]3C[C@@H]32)C1 ZINC000667859195 488140150 /nfs/dbraw/zinc/14/01/50/488140150.db2.gz HXBNAAZKLKQOKG-QPSCCSFWSA-N 2 0 234.387 2.249 20 0 BEADRP CC1(C)CCC[C@H](C[NH+]2C[C@@H]3C[NH2+]C[C@H]3C2)C1 ZINC000678343079 488243488 /nfs/dbraw/zinc/24/34/88/488243488.db2.gz LSFGOOQRUQKHMI-IHRRRGAJSA-N 2 0 236.403 2.354 20 0 BEADRP Cc1cccc(CCC[N@H+]2C[C@H]3C[NH2+]C[C@H]3C2)c1 ZINC000679214958 488317667 /nfs/dbraw/zinc/31/76/67/488317667.db2.gz VXEIWOGBXQTGCZ-IYBDPMFKSA-N 2 0 244.382 2.079 20 0 BEADRP CCc1cc(N[C@H](C)C2=CC[N@H+](C)CC2)ncn1 ZINC000679708765 488364847 /nfs/dbraw/zinc/36/48/47/488364847.db2.gz YADOFLQYMYPMLC-LLVKDONJSA-N 2 0 246.358 2.101 20 0 BEADRP COc1ccc(C[N@@H+]2CC[C@H]([NH3+])C[C@@H]2C)cc1C ZINC000131534489 490083507 /nfs/dbraw/zinc/08/35/07/490083507.db2.gz NPWDWYQKWPHRBG-JSGCOSHPSA-N 2 0 248.370 2.315 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+]CCCc1ccco1 ZINC000665283125 490096180 /nfs/dbraw/zinc/09/61/80/490096180.db2.gz HUBXCCCFQVXQMK-OCCSQVGLSA-N 2 0 236.359 2.319 20 0 BEADRP COc1ccc(C[N@H+](C)C[C@@H]2CC[NH2+]C2)cc1C ZINC000259008575 490126263 /nfs/dbraw/zinc/12/62/63/490126263.db2.gz XKDASSUQFHPEOV-CQSZACIVSA-N 2 0 248.370 2.045 20 0 BEADRP CCCC[NH+]1CCC([NH2+][C@H]2CCCOC2)CC1 ZINC000070464674 490216002 /nfs/dbraw/zinc/21/60/02/490216002.db2.gz WGWPTBIWSDSRQM-AWEZNQCLSA-N 2 0 240.391 2.020 20 0 BEADRP CC(C)CCC[N@H+]1CC[C@H]2C[NH2+]C[C@H]2CC1 ZINC000390799174 490221966 /nfs/dbraw/zinc/22/19/66/490221966.db2.gz WGEWPSORNDBLEH-OKILXGFUSA-N 2 0 224.392 2.354 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@H]2CCS[C@H]2C)CC1 ZINC000220551377 490226735 /nfs/dbraw/zinc/22/67/35/490226735.db2.gz NNVOPFQUYJJMEM-AAEUAGOBSA-N 2 0 242.432 2.343 20 0 BEADRP CC(C)[NH2+][C@H]1CCCN(CC[C@@H]2CCCO2)C1 ZINC000071201119 490258452 /nfs/dbraw/zinc/25/84/52/490258452.db2.gz TZJBPERYLMSXRB-KBPBESRZSA-N 2 0 240.391 2.018 20 0 BEADRP CC[C@@H]1C[N@H+](CCc2ccccc2)CC[C@H]1[NH3+] ZINC000251703410 490260177 /nfs/dbraw/zinc/26/01/77/490260177.db2.gz JBWFBMMQKGBHTC-HUUCEWRRSA-N 2 0 232.371 2.288 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000388027494 490262700 /nfs/dbraw/zinc/26/27/00/490262700.db2.gz PHHIVMVFXCASNC-SCRDCRAPSA-N 2 0 224.392 2.352 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1CC[N@@H+](C(C)C)C1)C1CC1 ZINC000083055793 490318338 /nfs/dbraw/zinc/31/83/38/490318338.db2.gz KUBAUVWQDBVZGI-JSGCOSHPSA-N 2 0 224.392 2.495 20 0 BEADRP C(C1CC1)[NH+]1CCC([NH2+][C@@H]2[C@@H]3CCC[C@@H]32)CC1 ZINC000668669443 490496553 /nfs/dbraw/zinc/49/65/53/490496553.db2.gz SXWKYFOUWLVQIB-QDMKHBRRSA-N 2 0 234.387 2.249 20 0 BEADRP Cc1ncccc1C[N@H+]1CCC[C@H](C)[C@@H]1CC[NH3+] ZINC000404292490 491093554 /nfs/dbraw/zinc/09/35/54/491093554.db2.gz LVJHNICPMZWTLE-WFASDCNBSA-N 2 0 247.386 2.339 20 0 BEADRP CC(C)(C)CC[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000259087922 491101994 /nfs/dbraw/zinc/10/19/94/491101994.db2.gz TYRGQHHGUVJUTC-LBPRGKRZSA-N 2 0 212.381 2.402 20 0 BEADRP Cc1ccncc1[C@@H](C)NC[C@@H](C)C[NH+](C)C ZINC000293659103 491114318 /nfs/dbraw/zinc/11/43/18/491114318.db2.gz LUIHTCRZTMCQIS-DGCLKSJQSA-N 2 0 235.375 2.238 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1Cc2ccccc21 ZINC000227077822 491138034 /nfs/dbraw/zinc/13/80/34/491138034.db2.gz RONDBQFZNZFUGK-YDHLFZDLSA-N 2 0 230.355 2.043 20 0 BEADRP CCC[C@H](C)[N@@H+]1CCC[C@]12CCC[NH2+]C2 ZINC000757135098 582514044 /nfs/dbraw/zinc/51/40/44/582514044.db2.gz YKEFQTJKBYWEMV-STQMWFEESA-N 2 0 210.365 2.393 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000400987787 533793752 /nfs/dbraw/zinc/79/37/52/533793752.db2.gz WIRCYEOTEMFWCJ-HTOAHKCRSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H](CCC1CC1)[NH2+][C@@H](C)[C@@H]1CCC[NH2+]1 ZINC000400332961 533826046 /nfs/dbraw/zinc/82/60/46/533826046.db2.gz DIWLZQQWPBFXJY-MDZLAQPJSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+][C@@H](C)[C@H]1CCC[NH2+]1 ZINC000400364950 534000870 /nfs/dbraw/zinc/00/08/70/534000870.db2.gz DRRIMISLMSPQNS-MBNYWOFBSA-N 2 0 236.359 2.331 20 0 BEADRP C[C@@H]1C[C@H]1C[N@@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000488352457 534024052 /nfs/dbraw/zinc/02/40/52/534024052.db2.gz NVTPFPNJCWPNTO-YUELXQCFSA-N 2 0 236.403 2.306 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@H]2CC[C@H]2C2CC2)CC1 ZINC000309647849 582903730 /nfs/dbraw/zinc/90/37/30/582903730.db2.gz MWIVXDWDOWSNKM-KBPBESRZSA-N 2 0 222.376 2.106 20 0 BEADRP C[NH2+]C[C@H]1CCN(c2cc[nH+]c(C)c2Cl)C1 ZINC000261580763 536468760 /nfs/dbraw/zinc/46/87/60/536468760.db2.gz NCYSPRUPADECNY-SNVBAGLBSA-N 2 0 239.750 2.089 20 0 BEADRP CC(C)CCC[N@@H+]1C[C@@H](C)[C@](C)(C[NH3+])C1 ZINC000309035473 527703443 /nfs/dbraw/zinc/70/34/43/527703443.db2.gz FRPNGAPJNCFEHX-CHWSQXEVSA-N 2 0 212.381 2.339 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+]C/C=C/c2ccncc2)C1 ZINC000486986780 527743240 /nfs/dbraw/zinc/74/32/40/527743240.db2.gz ZKHLNODXCAUKFB-BWPKMQGJSA-N 2 0 245.370 2.026 20 0 BEADRP CCC[C@H](C)[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000401044136 528066203 /nfs/dbraw/zinc/06/62/03/528066203.db2.gz LFKKQXHBFPFTCU-ZDEQEGDKSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)C[C@@H]([NH3+])C[N@@H+]1CC[C@@H](C2CC2)C1 ZINC000400006184 528346708 /nfs/dbraw/zinc/34/67/08/528346708.db2.gz RLKLPELXYBQTEU-CHWSQXEVSA-N 2 0 210.365 2.092 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+][C@@H]1CCCC[C@H]1[NH3+] ZINC000424377709 528706799 /nfs/dbraw/zinc/70/67/99/528706799.db2.gz RPGOEUYSUWYVQF-QNWHQSFQSA-N 2 0 210.365 2.281 20 0 BEADRP CC[NH+]1CCC([NH2+]CCC(O)(CC)CC)CC1 ZINC000471796899 528987043 /nfs/dbraw/zinc/98/70/43/528987043.db2.gz FQWQAVKDMGVIJV-UHFFFAOYSA-N 2 0 242.407 2.002 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+][C@H](C)[C@@H]1CCC[NH2+]1 ZINC000400461629 529312294 /nfs/dbraw/zinc/31/22/94/529312294.db2.gz RSAIEVRAIFJBHI-NDBYEHHHSA-N 2 0 210.365 2.295 20 0 BEADRP CC1(C)Cc2cccc(C[NH2+]CCCC[NH3+])c2O1 ZINC000080508917 534956622 /nfs/dbraw/zinc/95/66/22/534956622.db2.gz GFKYOHIXDSOGLV-UHFFFAOYSA-N 2 0 248.370 2.229 20 0 BEADRP CC(C)[N@H+](CC[C@@H]1CCC[NH+]1C)C1CC1 ZINC000179241917 535073892 /nfs/dbraw/zinc/07/38/92/535073892.db2.gz ZWUWURIIEPUFQB-LBPRGKRZSA-N 2 0 210.365 2.344 20 0 BEADRP CC(C)[C@H]1CCC[N@@H+]1C[C@H]1CC[NH2+][C@H](C)C1 ZINC000261533669 535182686 /nfs/dbraw/zinc/18/26/86/535182686.db2.gz JSPHLAMKDGFSQD-HZSPNIEDSA-N 2 0 224.392 2.495 20 0 BEADRP CC(C)[C@](C)(O)C[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000261569442 535285146 /nfs/dbraw/zinc/28/51/46/535285146.db2.gz JUHMPSMLHJAUNA-RRFJBIMHSA-N 2 0 248.370 2.128 20 0 BEADRP CC1(C)C[C@H]([NH2+]CC2C[NH2+]C2)c2ccccc21 ZINC000335553518 535367551 /nfs/dbraw/zinc/36/75/51/535367551.db2.gz ZPXZLZHIXTXTJW-AWEZNQCLSA-N 2 0 230.355 2.218 20 0 BEADRP CC[NH2+]CC1CCN(c2cc[nH+]cc2C)CC1 ZINC000070489879 535461622 /nfs/dbraw/zinc/46/16/22/535461622.db2.gz XTPLVWXVHIRWEM-UHFFFAOYSA-N 2 0 233.359 2.216 20 0 BEADRP CC[NH+](CC)C[C@H]1CC[N@H+](CC2CCC2)C1 ZINC000174211828 535597771 /nfs/dbraw/zinc/59/77/71/535597771.db2.gz NJWJGVTXSIZUGP-CQSZACIVSA-N 2 0 224.392 2.450 20 0 BEADRP CC[N@H+](C[C@@H]1CCSC1)[C@@H]1CCC[NH2+]CC1 ZINC000261995546 535773322 /nfs/dbraw/zinc/77/33/22/535773322.db2.gz SULOQBLFOQKYPQ-QWHCGFSZSA-N 2 0 242.432 2.204 20 0 BEADRP CC[C@]1(C)CC[N@H+](C[C@]2(C)CC[NH2+]C2)C1 ZINC000261557551 535910477 /nfs/dbraw/zinc/91/04/77/535910477.db2.gz XKGPJDLZNUOWIV-CHWSQXEVSA-N 2 0 210.365 2.108 20 0 BEADRP CCc1ccccc1C[N@@H+]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000261554051 535937050 /nfs/dbraw/zinc/93/70/50/535937050.db2.gz AOXVSQNJHNTAEQ-GOEBONIOSA-N 2 0 244.382 2.290 20 0 BEADRP CC[C@@]1(C)CC[N@H+](C[C@@H]2CCC[NH2+]C2)C1 ZINC000261554800 536048966 /nfs/dbraw/zinc/04/89/66/536048966.db2.gz UPQHMGHJFJKKTG-OLZOCXBDSA-N 2 0 210.365 2.108 20 0 BEADRP C[N@H+](CCC[NH+]1CCCC1)C1CCCC1 ZINC000179239216 536346405 /nfs/dbraw/zinc/34/64/05/536346405.db2.gz UGNCHFJRHOFRCM-UHFFFAOYSA-N 2 0 210.365 2.347 20 0 BEADRP C[NH2+][C@H]1CCCN(c2cc[nH+]c3ccccc32)C1 ZINC000053205035 536415394 /nfs/dbraw/zinc/41/53/94/536415394.db2.gz VAADTBUCXPVYOD-LBPRGKRZSA-N 2 0 241.338 2.423 20 0 BEADRP CO[C@@H](C[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1)C(C)(C)C ZINC000154907567 536516611 /nfs/dbraw/zinc/51/66/11/536516611.db2.gz QPQOCXBSLAJZDJ-AVGNSLFASA-N 2 0 242.407 2.120 20 0 BEADRP CO[C@@H]1CC[C@H]([NH2+][C@@H]2C[C@H]([NH3+])c3ccccc32)C1 ZINC000261576243 536706474 /nfs/dbraw/zinc/70/64/74/536706474.db2.gz NOAVOPBXPCMETB-IDTSFGKNSA-N 2 0 246.354 2.288 20 0 BEADRP COc1ccc(C[NH2+][C@@H]2CC[N@H+](C)C[C@H]2C)cc1 ZINC000252889537 536897822 /nfs/dbraw/zinc/89/78/22/536897822.db2.gz DXMIZAQHJGFTMO-IUODEOHRSA-N 2 0 248.370 2.125 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCCC1(F)F)C1CC[NH+](C)CC1 ZINC000398040138 583118508 /nfs/dbraw/zinc/11/85/08/583118508.db2.gz RNPONMQWCNOUPF-CMPLNLGQSA-N 2 0 246.345 2.494 20 0 BEADRP CC(C)[C@@](C)(C[NH3+])[NH2+]CCC1SCCS1 ZINC000853023269 588716773 /nfs/dbraw/zinc/71/67/73/588716773.db2.gz RCJBLDLXHCBFPL-LLVKDONJSA-N 2 0 248.461 2.146 20 0 BEADRP C([NH2+]C1CCCCCCC1)C12CC(C1)C[NH2+]2 ZINC000853246898 588728634 /nfs/dbraw/zinc/72/86/34/588728634.db2.gz VZJWXULHQWBEIV-UHFFFAOYSA-N 2 0 222.376 2.441 20 0 BEADRP C[C@H]([NH2+]CCC[NH3+])c1ccc2c(c1)CCCO2 ZINC000853249579 588729213 /nfs/dbraw/zinc/72/92/13/588729213.db2.gz RKPKQWNSJGNDJI-NSHDSACASA-N 2 0 234.343 2.011 20 0 BEADRP CCC(N)=[NH+]OC[C@H]1CCCC[N@@H+]1C(C)C ZINC000853656117 588752704 /nfs/dbraw/zinc/75/27/04/588752704.db2.gz JCFYYBOCSGMTHE-LLVKDONJSA-N 2 0 227.352 2.158 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H]1C=CCC1 ZINC000854221337 588780165 /nfs/dbraw/zinc/78/01/65/588780165.db2.gz KNLNOIUUESTZIF-JQWIXIFHSA-N 2 0 231.343 2.218 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+][C@H]1CC[C@H]1C(C)C ZINC000854229935 588780875 /nfs/dbraw/zinc/78/08/75/588780875.db2.gz ARQQKANOQRCKRZ-XQQFMLRXSA-N 2 0 212.381 2.384 20 0 BEADRP CCCCC[N@@H+]1CCC[C@@]12CCC[NH2+]C2 ZINC000757127723 582503602 /nfs/dbraw/zinc/50/36/02/582503602.db2.gz HVPNJFWZYAYDPY-CYBMUJFWSA-N 2 0 210.365 2.395 20 0 BEADRP CC(C)C[N@H+](CC1CC[NH+](C)CC1)C1CC1 ZINC000891667934 582707731 /nfs/dbraw/zinc/70/77/31/582707731.db2.gz LBELXVCGSLVYDX-UHFFFAOYSA-N 2 0 224.392 2.449 20 0 BEADRP CC[C@H]1CCC[N@@H+]1CC1CC[NH+](C)CC1 ZINC000891780821 582720278 /nfs/dbraw/zinc/72/02/78/582720278.db2.gz CNIMYJDXZMDSEQ-ZDUSSCGKSA-N 2 0 210.365 2.203 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2CC[C@H](c3ccco3)C2)CC1 ZINC000892019617 582762284 /nfs/dbraw/zinc/76/22/84/582762284.db2.gz NDJGDDNIXUNGAZ-AWEZNQCLSA-N 2 0 248.370 2.411 20 0 BEADRP C[C@@H]1CC[C@H](C)[N@H+](CC2CC[NH+](C)CC2)C1 ZINC000892069315 582783922 /nfs/dbraw/zinc/78/39/22/582783922.db2.gz HWQYRMNCUJPWDC-OLZOCXBDSA-N 2 0 224.392 2.449 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2CC[C@@H](C3CC3)C2)CC1 ZINC000892144399 582799117 /nfs/dbraw/zinc/79/91/17/582799117.db2.gz NWAXUGBZOFYLOU-CQSZACIVSA-N 2 0 222.376 2.060 20 0 BEADRP C[N@H+](CCC1CC1)CC1CC[NH+](C)CC1 ZINC000743848753 582858910 /nfs/dbraw/zinc/85/89/10/582858910.db2.gz CODKPHKCNTVXHM-UHFFFAOYSA-N 2 0 210.365 2.060 20 0 BEADRP C(C[NH+]1C[C@H]2C[NH2+]C[C@@H]2C1)C1CCCCCC1 ZINC000394611664 582998067 /nfs/dbraw/zinc/99/80/67/582998067.db2.gz HZTJQJSNBCGMRO-HUUCEWRRSA-N 2 0 236.403 2.498 20 0 BEADRP CC(C)C[N@H+](C)CCCNCc1cscn1 ZINC000651866594 583147192 /nfs/dbraw/zinc/14/71/92/583147192.db2.gz KBJMJDVMYKISEH-UHFFFAOYSA-N 2 0 241.404 2.211 20 0 BEADRP Cc1cc(N[C@@H](C)C[NH+](C)C)nc(C2CCC2)n1 ZINC000893857473 583233460 /nfs/dbraw/zinc/23/34/60/583233460.db2.gz OQLUTJQJMSPKFP-NSHDSACASA-N 2 0 248.374 2.415 20 0 BEADRP CCCCCC[N@@H+]1C[C@@H]2CCC[C@@]2([NH3+])C1 ZINC000857086986 588886850 /nfs/dbraw/zinc/88/68/50/588886850.db2.gz OZSAIIDWCOHLON-QWHCGFSZSA-N 2 0 210.365 2.380 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2C[C@H](C3CC3)[C@H]2C2CC2)CC1 ZINC000894735103 583514398 /nfs/dbraw/zinc/51/43/98/583514398.db2.gz GJHKNPOCVHWLLA-HZPDHXFCSA-N 2 0 248.414 2.449 20 0 BEADRP Cc1coc(C[N@H+]2CC[C@@H](c3nccn3C)C2)c1 ZINC000894779349 583519493 /nfs/dbraw/zinc/51/94/93/583519493.db2.gz GRMPNKCNAVIUHN-GFCCVEGCSA-N 2 0 245.326 2.311 20 0 BEADRP COC1(C[C@@H](C)[NH2+]CC[C@H](C)[NH+](C)C)CCC1 ZINC000895294577 583638103 /nfs/dbraw/zinc/63/81/03/583638103.db2.gz RTRGIIKZZHEZSI-OLZOCXBDSA-N 2 0 242.407 2.264 20 0 BEADRP CC1=CC[C@H]([NH2+]CC[C@@H](C)[NH+](C)C)CC1 ZINC000895294350 583638481 /nfs/dbraw/zinc/63/84/81/583638481.db2.gz UJYMSPDZZVTDMJ-OLZOCXBDSA-N 2 0 210.365 2.415 20 0 BEADRP C[C@H](CC1CCOCC1)[NH2+]CC[C@@H](C)[NH+](C)C ZINC000895292940 583639273 /nfs/dbraw/zinc/63/92/73/583639273.db2.gz DZDCXYDTVQNHRT-CHWSQXEVSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H](CC[NH2+]C1C[C@@H]2CCC[C@H]2C1)[NH+](C)C ZINC000895429603 583668788 /nfs/dbraw/zinc/66/87/88/583668788.db2.gz QQIMNQLKWYURFH-AGIUHOORSA-N 2 0 224.392 2.495 20 0 BEADRP C[N@H+](C[C@H]1CC1(C)C)CC1CC[NH+](C)CC1 ZINC000895480449 583680460 /nfs/dbraw/zinc/68/04/60/583680460.db2.gz GZAQXPLISOORFD-CYBMUJFWSA-N 2 0 224.392 2.306 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2Cc3ccc(O)cc3C2)CC1 ZINC000895557651 583690437 /nfs/dbraw/zinc/69/04/37/583690437.db2.gz DHTMFSRGONJDDM-UHFFFAOYSA-N 2 0 246.354 2.050 20 0 BEADRP C[N@@H+]1CC[C@H]1CNc1cc[nH+]c2c(O)cccc12 ZINC000895770617 583724802 /nfs/dbraw/zinc/72/48/02/583724802.db2.gz QEMBQCNMAKQHNO-JTQLQIEISA-N 2 0 243.310 2.056 20 0 BEADRP C[N@@H+]1CC[C@@H]1CNc1cc[nH+]c2c(O)cccc12 ZINC000895770619 583725069 /nfs/dbraw/zinc/72/50/69/583725069.db2.gz QEMBQCNMAKQHNO-SNVBAGLBSA-N 2 0 243.310 2.056 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2CCC[C@H](CF)C2)CC1 ZINC000896000966 583760150 /nfs/dbraw/zinc/76/01/50/583760150.db2.gz ZYQFVERHYUKFAH-CYBMUJFWSA-N 2 0 228.355 2.010 20 0 BEADRP C[C@@H]1[C@H]([NH2+]C[C@@H]2C[C@H]2c2ccccc2)CCN1C ZINC000896555600 583811508 /nfs/dbraw/zinc/81/15/08/583811508.db2.gz PGJPIEQZJSNZCZ-SYAUCNOPSA-N 2 0 244.382 2.472 20 0 BEADRP C[NH+](C)CC1CC[NH+](C/C=C\Cl)CC1 ZINC000727932308 583837590 /nfs/dbraw/zinc/83/75/90/583837590.db2.gz ZSLLUACDJYNGBN-UTCJRWHESA-N 2 0 216.756 2.013 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+]CCCCCCO)CC1(C)C ZINC000858155478 588936340 /nfs/dbraw/zinc/93/63/40/588936340.db2.gz JSQFDCDMLHIMTI-CYBMUJFWSA-N 2 0 242.407 2.002 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2C[C@@H]3CCC[C@@H]3C2)CC1 ZINC000898072192 584083025 /nfs/dbraw/zinc/08/30/25/584083025.db2.gz ZRSQUMVLKLJVFN-OKILXGFUSA-N 2 0 222.376 2.060 20 0 BEADRP C[C@H]1C[C@H]1C[N@H+](C)CC(C)(C)C[NH+](C)C ZINC000898307732 584109580 /nfs/dbraw/zinc/10/95/80/584109580.db2.gz GHZFSZFXTLSHEB-RYUDHWBXSA-N 2 0 212.381 2.162 20 0 BEADRP C[NH+](C)CC(C)(C)C[N@H+](C)C[C@H]1CCSC1 ZINC000898307622 584109884 /nfs/dbraw/zinc/10/98/84/584109884.db2.gz DWMDOYPYMDYSKQ-GFCCVEGCSA-N 2 0 244.448 2.259 20 0 BEADRP CC[C@@](C)(C[N@H+](C)CC(C)(C)C[NH+](C)C)OC ZINC000898308223 584109928 /nfs/dbraw/zinc/10/99/28/584109928.db2.gz SVLDKSJYBRAEDT-AWEZNQCLSA-N 2 0 244.423 2.321 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@H]([NH2+]C[C@H]2C[C@H]([NH3+])C2)C1 ZINC000873255603 584128039 /nfs/dbraw/zinc/12/80/39/584128039.db2.gz ICHYFNYGVSPDFH-NZEXEKPDSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H](Cc1ccccc1F)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873251202 584128149 /nfs/dbraw/zinc/12/81/49/584128149.db2.gz VDQJBRRBSLOOJU-GMXVVIOVSA-N 2 0 236.334 2.084 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccc(Cl)cn1 ZINC000873249518 584128343 /nfs/dbraw/zinc/12/83/43/584128343.db2.gz ATERNKTVZKEUPO-KKZNHRDASA-N 2 0 239.750 2.123 20 0 BEADRP Cc1ccccc1[C@@H](C)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873259098 584128853 /nfs/dbraw/zinc/12/88/53/584128853.db2.gz XTLWVVMBXRNGEJ-JHJVBQTASA-N 2 0 218.344 2.383 20 0 BEADRP CCn1cc[nH+]c1NCc1nccn1C1CC1 ZINC000902114893 584527644 /nfs/dbraw/zinc/52/76/44/584527644.db2.gz TVDHLYUDMWKDOH-UHFFFAOYSA-N 2 0 231.303 2.047 20 0 BEADRP CSCCC[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000902330556 584562257 /nfs/dbraw/zinc/56/22/57/584562257.db2.gz POOKHMXSEZXRSA-NSHDSACASA-N 2 0 230.421 2.107 20 0 BEADRP CSCCC[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000902330555 584562287 /nfs/dbraw/zinc/56/22/87/584562287.db2.gz POOKHMXSEZXRSA-LLVKDONJSA-N 2 0 230.421 2.107 20 0 BEADRP CC(C)OCCC[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000902331986 584563197 /nfs/dbraw/zinc/56/31/97/584563197.db2.gz XUFRSTOXYNULTC-ZDUSSCGKSA-N 2 0 242.407 2.169 20 0 BEADRP CO[C@@H](C[NH2+][C@H]1CC[NH2+]CC(C)(C)C1)C(C)C ZINC000902333892 584563342 /nfs/dbraw/zinc/56/33/42/584563342.db2.gz MVGRWUMGNVHXAK-STQMWFEESA-N 2 0 242.407 2.025 20 0 BEADRP CO[C@H](C[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1)C(C)C ZINC000902333889 584563650 /nfs/dbraw/zinc/56/36/50/584563650.db2.gz MVGRWUMGNVHXAK-CHWSQXEVSA-N 2 0 242.407 2.025 20 0 BEADRP CSC(C)(C)C[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000902333513 584563852 /nfs/dbraw/zinc/56/38/52/584563852.db2.gz KEOMRDOUELHPIW-LLVKDONJSA-N 2 0 244.448 2.496 20 0 BEADRP C[C@@H](C[NH2+][C@H]1CC[NH2+]CC(C)(C)C1)C1CC1 ZINC000902350859 584569249 /nfs/dbraw/zinc/56/92/49/584569249.db2.gz BXKRKZFRDLXVNG-AAEUAGOBSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1)C1CC1 ZINC000902350860 584569278 /nfs/dbraw/zinc/56/92/78/584569278.db2.gz BXKRKZFRDLXVNG-DGCLKSJQSA-N 2 0 224.392 2.400 20 0 BEADRP CCC[C@H]([NH2+]CC1([NH3+])CC1)C1CCCC1 ZINC000902407783 584575078 /nfs/dbraw/zinc/57/50/78/584575078.db2.gz URHDHOVOPLYGGV-LBPRGKRZSA-N 2 0 210.365 2.426 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000902386297 584578552 /nfs/dbraw/zinc/57/85/52/584578552.db2.gz FGIQOXAPADJFKQ-FRRDWIJNSA-N 2 0 224.392 2.400 20 0 BEADRP CCC[C@@H](C[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1)OC ZINC000902389228 584580299 /nfs/dbraw/zinc/58/02/99/584580299.db2.gz TTYFTWRBQCYEEQ-OLZOCXBDSA-N 2 0 242.407 2.169 20 0 BEADRP COCC[C@@H](C)C[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000902390093 584581240 /nfs/dbraw/zinc/58/12/40/584581240.db2.gz GXNLBQGBWJVFQW-CHWSQXEVSA-N 2 0 242.407 2.027 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]([NH2+]CC2CC=CC2)C1 ZINC000902394328 584584815 /nfs/dbraw/zinc/58/48/15/584584815.db2.gz AWABNEZMWNHXKN-CYBMUJFWSA-N 2 0 222.376 2.320 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]([NH2+]C[C@H]2C=CCC2)C1 ZINC000902404611 584589127 /nfs/dbraw/zinc/58/91/27/584589127.db2.gz XJIOEFFVEWRTKA-STQMWFEESA-N 2 0 222.376 2.320 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H]2CCC[C@H](C3CC3)C2)CC1 ZINC000902416912 584591337 /nfs/dbraw/zinc/59/13/37/584591337.db2.gz PFWZOANCDIMTIP-NWDGAFQWSA-N 2 0 208.349 2.036 20 0 BEADRP CC[C@@H](Cc1cccs1)[NH2+]CC1([NH3+])CC1 ZINC000902418211 584591798 /nfs/dbraw/zinc/59/17/98/584591798.db2.gz WKPNBJRXABQDKB-JTQLQIEISA-N 2 0 224.373 2.150 20 0 BEADRP CC(C)(C[NH2+][C@H]1CC[NH2+]C12CCC2)C1CC1 ZINC000902429232 584594990 /nfs/dbraw/zinc/59/49/90/584594990.db2.gz COMOVQOCZNUFHZ-LBPRGKRZSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+]CC(C)(C)C1CC1 ZINC000902434679 584595891 /nfs/dbraw/zinc/59/58/91/584595891.db2.gz ZCFDTQAONJZBHU-AAEUAGOBSA-N 2 0 224.392 2.400 20 0 BEADRP CC1(C)C[NH2+]C[C@H]1[NH2+]C1CCC2(CC2)CC1 ZINC000902440878 584597220 /nfs/dbraw/zinc/59/72/20/584597220.db2.gz AVIDBGKFUXVHMM-GFCCVEGCSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]([NH2+][C@H]1C[NH2+]CC1(C)C)C1CCSCC1 ZINC000902443176 584598531 /nfs/dbraw/zinc/59/85/31/584598531.db2.gz KJHZLFMXRUKFJZ-PWSUYJOCSA-N 2 0 242.432 2.106 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@H]2C[NH2+]CC2(C)C)C1 ZINC000902445373 584598765 /nfs/dbraw/zinc/59/87/65/584598765.db2.gz LUPBFPQUTUNIRX-WOPDTQHZSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)S2 ZINC000902445859 584598977 /nfs/dbraw/zinc/59/89/77/584598977.db2.gz MWDRDXSSCPGUNY-RTWBTXMESA-N 2 0 228.405 2.128 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H](c2ccccc2)C2CC2)CC1 ZINC000902413137 584599753 /nfs/dbraw/zinc/59/97/53/584599753.db2.gz JEJPGPXSOUWHGD-ZDUSSCGKSA-N 2 0 216.328 2.219 20 0 BEADRP Cc1ccc2c(c1)[C@@H]([NH2+]CC1([NH3+])CC1)CCC2 ZINC000902413378 584599945 /nfs/dbraw/zinc/59/99/45/584599945.db2.gz KZXDSAWQHSIOJN-AWEZNQCLSA-N 2 0 230.355 2.453 20 0 BEADRP CC(C)CC[C@@H](C)[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902472524 584600919 /nfs/dbraw/zinc/60/09/19/584600919.db2.gz CJBRGNSRAWUFLU-FVCCEPFGSA-N 2 0 210.365 2.294 20 0 BEADRP CC[C@H]([NH2+]CC1([NH3+])CC1)C1CCCCC1 ZINC000902415114 584601008 /nfs/dbraw/zinc/60/10/08/584601008.db2.gz AXNQONISSOMKGY-LBPRGKRZSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@@H]2C[C@H]3CC[C@@H]2[NH2+]3)C1 ZINC000902473241 584601120 /nfs/dbraw/zinc/60/11/20/584601120.db2.gz VUOXQZRVHZKHQU-RXGFPQBGSA-N 2 0 208.349 2.048 20 0 BEADRP CC[C@H]1CCC[C@H]([NH2+][C@@H]2C[C@H]3CC[C@@H]2[NH2+]3)C1 ZINC000902474478 584602104 /nfs/dbraw/zinc/60/21/04/584602104.db2.gz FOPVYEHJMIKGJA-PDWCTOEPSA-N 2 0 222.376 2.438 20 0 BEADRP CC[C@H]1CCC[C@@H]1[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902476170 584602462 /nfs/dbraw/zinc/60/24/62/584602462.db2.gz MVPABWCNFDHBDF-FPYNETTCSA-N 2 0 208.349 2.048 20 0 BEADRP CC1(C)CCCC[C@H]1[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902475959 584602919 /nfs/dbraw/zinc/60/29/19/584602919.db2.gz KKBQYARTPWIILZ-YVECIDJPSA-N 2 0 222.376 2.438 20 0 BEADRP CC1(C)C[NH2+]C[C@@H]1[NH2+][C@@H]1CCCC12CCC2 ZINC000902447564 584604491 /nfs/dbraw/zinc/60/44/91/584604491.db2.gz ZQWBILILAGTDCJ-NEPJUHHUSA-N 2 0 222.376 2.297 20 0 BEADRP CC1(C)C[NH2+]C[C@H]1[NH2+][C@@H](C1CC1)C1CCC1 ZINC000902447548 584604816 /nfs/dbraw/zinc/60/48/16/584604816.db2.gz ZLXUKTCQXDCLIZ-CHWSQXEVSA-N 2 0 222.376 2.153 20 0 BEADRP CC1(C)C[NH2+]C[C@@H]1[NH2+][C@H]1CCCC1(C)C ZINC000902448906 584605644 /nfs/dbraw/zinc/60/56/44/584605644.db2.gz JFRDRJIZSHMLHY-QWRGUYRKSA-N 2 0 210.365 2.153 20 0 BEADRP CC1(C)C[C@H]([NH2+][C@@H]2CCC[C@@H]2[NH3+])CCS1 ZINC000902449985 584606008 /nfs/dbraw/zinc/60/60/08/584606008.db2.gz AZTVZIPUNFACQS-OUAUKWLOSA-N 2 0 228.405 2.130 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCCC2(CC2)C1 ZINC000902450022 584606400 /nfs/dbraw/zinc/60/64/00/584606400.db2.gz BRDOTKFJUQAGMJ-UTUOFQBUSA-N 2 0 208.349 2.179 20 0 BEADRP C1[C@H]2CCC[C@H]2[C@H]1[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000902453472 584608018 /nfs/dbraw/zinc/60/80/18/584608018.db2.gz DBZWMRDYUSKMJU-OJVARPOJSA-N 2 0 234.387 2.153 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+][C@H]1CCSC(C)(C)C1 ZINC000902453252 584608134 /nfs/dbraw/zinc/60/81/34/584608134.db2.gz OGZDIPJFTIDBFL-WDEREUQCSA-N 2 0 242.432 2.391 20 0 BEADRP C1[C@H]2CCC[C@@H]2[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000902453953 584608857 /nfs/dbraw/zinc/60/88/57/584608857.db2.gz GHVFPSULEBPTOU-RSDXJVJXSA-N 2 0 220.360 2.048 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@H]1CCSC(C)(C)C1 ZINC000902454280 584608969 /nfs/dbraw/zinc/60/89/69/584608969.db2.gz SCYFOEFHTPSLLA-DCAQKATOSA-N 2 0 230.421 2.376 20 0 BEADRP CC1(C)CCC[C@H](C[NH2+][C@H]2CCC[C@H]2C[NH3+])O1 ZINC000902460248 584610776 /nfs/dbraw/zinc/61/07/76/584610776.db2.gz FUSBBYNDOWPVAC-XQQFMLRXSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H]([NH2+]CCC1CCC(F)(F)CC1)C1C[NH2+]C1 ZINC000902458462 584610838 /nfs/dbraw/zinc/61/08/38/584610838.db2.gz XQBVARSVXZFWOD-SNVBAGLBSA-N 2 0 246.345 2.400 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@H]1CCCC(C)(C)O1 ZINC000902462635 584612196 /nfs/dbraw/zinc/61/21/96/584612196.db2.gz WOBJWPJOLAQZQS-CHWSQXEVSA-N 2 0 242.407 2.441 20 0 BEADRP C[C@@H]1CC(C)(C)C[C@H]1[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902464836 584612931 /nfs/dbraw/zinc/61/29/31/584612931.db2.gz DCLJUSHROQSXBY-UJPOAAIJSA-N 2 0 222.376 2.294 20 0 BEADRP CC(C)[C@@H]1CCC[C@@H]1[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902464816 584613082 /nfs/dbraw/zinc/61/30/82/584613082.db2.gz CWNZDDBPJWBSJM-QSLWVIQJSA-N 2 0 222.376 2.294 20 0 BEADRP C1CC1[C@H]([NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2)C1CCC1 ZINC000902464804 584613286 /nfs/dbraw/zinc/61/32/86/584613286.db2.gz CXGWZVDBZQNZDB-XJFOESAGSA-N 2 0 220.360 2.048 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902465473 584613721 /nfs/dbraw/zinc/61/37/21/584613721.db2.gz GFJVSAVZOJHVKI-KSSYENDESA-N 2 0 208.349 2.048 20 0 BEADRP C[C@@H](CC(C)(C)C)[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902466066 584613836 /nfs/dbraw/zinc/61/38/36/584613836.db2.gz IPVYOWTWWOLWAK-NNYUYHANSA-N 2 0 210.365 2.294 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2)C1CCCCC1 ZINC000902466067 584614154 /nfs/dbraw/zinc/61/41/54/584614154.db2.gz JJULLSJBYGLZFO-YXCITZCRSA-N 2 0 222.376 2.438 20 0 BEADRP FCCC[C@H]1CCC[C@@H]1[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902467611 584614544 /nfs/dbraw/zinc/61/45/44/584614544.db2.gz PNQVAKVWKCXYGA-PEBLQZBPSA-N 2 0 240.366 2.387 20 0 BEADRP CCC[C@H]([NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2)C1CCC1 ZINC000902467597 584614576 /nfs/dbraw/zinc/61/45/76/584614576.db2.gz PKBYRSZUNPZSRB-ZOBORPQBSA-N 2 0 222.376 2.438 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+][C@@H]2C[C@H]3CC[C@@H]2[NH2+]3)[C@@H](C)C1 ZINC000902469169 584615343 /nfs/dbraw/zinc/61/53/43/584615343.db2.gz YOXYJNCGPKQTEZ-CLHCLYRXSA-N 2 0 222.376 2.294 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@@H]2C[C@H]3CC[C@@H]2[NH2+]3)[C@H](C)C1 ZINC000902469170 584615680 /nfs/dbraw/zinc/61/56/80/584615680.db2.gz YOXYJNCGPKQTEZ-IZMFDJJNSA-N 2 0 222.376 2.294 20 0 BEADRP CCC[C@@H]([NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2)C1CCC1 ZINC000902469357 584615723 /nfs/dbraw/zinc/61/57/23/584615723.db2.gz PKBYRSZUNPZSRB-REWJHTLYSA-N 2 0 222.376 2.438 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+]C2CCc3ccccc3CC2)C1 ZINC000902490142 584617726 /nfs/dbraw/zinc/61/77/26/584617726.db2.gz TVMFVMJIXXSDQC-YGUOUDRMSA-N 2 0 244.382 2.261 20 0 BEADRP C[C@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1cccc(F)c1 ZINC000902490529 584617887 /nfs/dbraw/zinc/61/78/87/584617887.db2.gz WAQTYMAYIFEIGI-KWBADKCTSA-N 2 0 222.307 2.214 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+][C@H]2CCC[C@@H](C3CC3)C2)C1 ZINC000902491673 584617894 /nfs/dbraw/zinc/61/78/94/584617894.db2.gz YGWFXPYTZSNQKL-RUZUBIRVSA-N 2 0 222.376 2.282 20 0 BEADRP COc1ccc([C@@H](C)[NH2+][C@H]2C[C@H](C[NH3+])C2)cc1 ZINC000902490557 584618487 /nfs/dbraw/zinc/61/84/87/584618487.db2.gz WRUMPRGUOIIXEN-NQBHXWOUSA-N 2 0 234.343 2.083 20 0 BEADRP CC(C)[NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000902503917 584621095 /nfs/dbraw/zinc/62/10/95/584621095.db2.gz TXIWVTMQNYHZKH-HIFRSBDPSA-N 2 0 246.354 2.240 20 0 BEADRP C[C@@H]1CC=CC[C@H]1[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000902504253 584621416 /nfs/dbraw/zinc/62/14/16/584621416.db2.gz NCQCPAVRQXKULI-JHJVBQTASA-N 2 0 220.360 2.215 20 0 BEADRP C[C@@H]1CC=CC[C@H]1[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000902505793 584621452 /nfs/dbraw/zinc/62/14/52/584621452.db2.gz UCWOQSYDESEANA-FDYHWXHSSA-N 2 0 208.349 2.201 20 0 BEADRP Cc1ncccc1CC[NH2+][C@H]1CCCCC[C@@H]1[NH3+] ZINC000902511756 584623521 /nfs/dbraw/zinc/62/35/21/584623521.db2.gz FJUIARWQAJYKLH-GJZGRUSLSA-N 2 0 247.386 2.182 20 0 BEADRP C([NH2+][C@@H]1CC[C@H]1C1CC1)[C@@H]1CCCCC[NH2+]1 ZINC000902482162 584623936 /nfs/dbraw/zinc/62/39/36/584623936.db2.gz JXOJHVBPPAJUKS-MELADBBJSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+][C@H]2C[C@H](C[NH3+])C2)[C@H](C)C1 ZINC000902485359 584624566 /nfs/dbraw/zinc/62/45/66/584624566.db2.gz JXTJJECHTITXKL-SYLRKERUSA-N 2 0 210.365 2.138 20 0 BEADRP CO[C@H](c1ccccc1)[C@H](C)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902485759 584625380 /nfs/dbraw/zinc/62/53/80/584625380.db2.gz NWBUXTLBFLAVJP-JURCDPSOSA-N 2 0 248.370 2.090 20 0 BEADRP C[C@H](CCCc1cccnc1)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902486086 584625348 /nfs/dbraw/zinc/62/53/48/584625348.db2.gz PCZIPWOPBMFWNC-BPLDGKMQSA-N 2 0 247.386 2.120 20 0 BEADRP C[C@H]1Cc2ccccc2[C@H]1[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902485617 584625427 /nfs/dbraw/zinc/62/54/27/584625427.db2.gz BRWIANFTIPXGNU-UHXUCMFUSA-N 2 0 230.355 2.247 20 0 BEADRP CC(C)(C)[C@H]1CC[C@@H]1[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902485695 584625547 /nfs/dbraw/zinc/62/55/47/584625547.db2.gz MWZZQMHMOIOVBS-BJDJZHNGSA-N 2 0 210.365 2.138 20 0 BEADRP Cc1ccccc1[C@H](C)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902486610 584626017 /nfs/dbraw/zinc/62/60/17/584626017.db2.gz APNTZENVTRHOER-AVGNSLFASA-N 2 0 218.344 2.383 20 0 BEADRP C[C@@H](CC1CCCC1)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902489403 584627242 /nfs/dbraw/zinc/62/72/42/584627242.db2.gz PUFFEZQCLIDVJK-DRZSPHRISA-N 2 0 210.365 2.282 20 0 BEADRP Cc1cccc2c1CC[C@@H]2[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902488833 584627401 /nfs/dbraw/zinc/62/74/01/584627401.db2.gz OUSHHMXTIIWWHU-HUBLWGQQSA-N 2 0 230.355 2.309 20 0 BEADRP C[C@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1ccc(F)cc1F ZINC000902488798 584627585 /nfs/dbraw/zinc/62/75/85/584627585.db2.gz NWTWMRBTYMKEMW-QXEWZRGKSA-N 2 0 240.297 2.353 20 0 BEADRP CC(C)[C@H]1CCC[C@@H]1[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902489339 584627714 /nfs/dbraw/zinc/62/77/14/584627714.db2.gz PEKIKEZJZBEBFE-LPWJVIDDSA-N 2 0 210.365 2.138 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+]C1(C)C(C)(C)C1(C)C ZINC000902521340 584631591 /nfs/dbraw/zinc/63/15/91/584631591.db2.gz RIRIXTLJQRNJDI-NSHDSACASA-N 2 0 242.407 2.155 20 0 BEADRP C1CC1N1CC[C@@H]([NH2+]C2C[C@H]3CCC[C@@H]3C2)C1 ZINC000902793939 584673251 /nfs/dbraw/zinc/67/32/51/584673251.db2.gz OYPUCVLISKNVQI-JHJVBQTASA-N 2 0 234.387 2.391 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2C[C@H]3CCC[C@H]3C2)C1 ZINC000902796980 584674728 /nfs/dbraw/zinc/67/47/28/584674728.db2.gz SARCGRACNOVHRP-APIJFGDWSA-N 2 0 236.403 2.497 20 0 BEADRP Cn1cncc1CC[NH2+][C@@H]1C[C@H]2CCC[C@H]2C1 ZINC000902957537 584705628 /nfs/dbraw/zinc/70/56/28/584705628.db2.gz KEYOSOWOZRBNFU-CLLJXQQHSA-N 2 0 233.359 2.131 20 0 BEADRP C[C@@H](F)CC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C1CC1 ZINC000903178618 584733216 /nfs/dbraw/zinc/73/32/16/584733216.db2.gz XQNLUYXSNNQOMW-WDFAYWTNSA-N 2 0 240.366 2.482 20 0 BEADRP C[N@H+]1C[C@H]2CC[C@@H](C1)C2[NH2+]CC(C)(C)C1CC1 ZINC000903240688 584738111 /nfs/dbraw/zinc/73/81/11/584738111.db2.gz XAIPFESWVLEDCY-ONXXMXGDSA-N 2 0 236.403 2.352 20 0 BEADRP C[C@@H]1C[C@H]1[C@@H]1C[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000903254362 584739542 /nfs/dbraw/zinc/73/95/42/584739542.db2.gz PXEZOZGIBLUPFN-ULDVTWLKSA-N 2 0 234.387 2.246 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@H+]1Cc2ccccc2[C@H](C)C1 ZINC000903427277 584761283 /nfs/dbraw/zinc/76/12/83/584761283.db2.gz ULAYWIJGKMTJJS-NFAWXSAZSA-N 2 0 244.382 2.461 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@@H+]1C[C@@H](C)CCC[C@@H]1C ZINC000903440167 584763226 /nfs/dbraw/zinc/76/32/26/584763226.db2.gz VIHVLHLIIJHKFT-CRWXNKLISA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@@H+]1C[C@H](C)CCC[C@@H]1C ZINC000903440170 584763338 /nfs/dbraw/zinc/76/33/38/584763338.db2.gz VIHVLHLIIJHKFT-MQYQWHSLSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@@H+]1Cc2ccccc2C[C@@H]1C ZINC000903439894 584763412 /nfs/dbraw/zinc/76/34/12/584763412.db2.gz PIKQMBGQMVFCMX-WWGRRREGSA-N 2 0 244.382 2.289 20 0 BEADRP CCSCC[C@H](C)[N@H+](C)C[C@@H]1C[NH2+]C[C@H]1C ZINC000903441412 584763511 /nfs/dbraw/zinc/76/35/11/584763511.db2.gz QWGKRZKOXYSPFB-AGIUHOORSA-N 2 0 244.448 2.305 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@H+](C1CC1)C1CC[NH2+]CC1 ZINC000903422087 584763925 /nfs/dbraw/zinc/76/39/25/584763925.db2.gz VTXWFPKOIJYMNA-NEPJUHHUSA-N 2 0 222.376 2.249 20 0 BEADRP CC[C@H]1CCC[C@H]1[NH2+]C[C@@H]1CC[C@H]([NH3+])C1 ZINC000903458512 584765400 /nfs/dbraw/zinc/76/54/00/584765400.db2.gz BTHZIXRYABQUQI-MROQNXINSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1C[NH2+]C[C@H]1C)c1ccccc1 ZINC000903459012 584766093 /nfs/dbraw/zinc/76/60/93/584766093.db2.gz PNPWIWOVORIALA-BZPMIXESSA-N 2 0 218.344 2.193 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000903459180 584766112 /nfs/dbraw/zinc/76/61/12/584766112.db2.gz RLORPNNJDUQDMR-NDBYEHHHSA-N 2 0 210.365 2.010 20 0 BEADRP CC[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000903459178 584766160 /nfs/dbraw/zinc/76/61/60/584766160.db2.gz RLORPNNJDUQDMR-FVCCEPFGSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]1C[N@@H+](C[C@@H]2CC[C@H]([NH3+])C2)C[C@H](C)C1(F)F ZINC000903464237 584767171 /nfs/dbraw/zinc/76/71/71/584767171.db2.gz FAQSXCZHLYJHLB-KXNHARMFSA-N 2 0 246.345 2.337 20 0 BEADRP CC(C)[N@@H+](Cc1ccccn1)C[C@@H]1C[NH2+]C[C@H]1C ZINC000903442704 584767844 /nfs/dbraw/zinc/76/78/44/584767844.db2.gz ZCNSAZOZUSUCBB-KGLIPLIRSA-N 2 0 247.386 2.148 20 0 BEADRP Cl/C=C/C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C1CC1 ZINC000903445127 584769380 /nfs/dbraw/zinc/76/93/80/584769380.db2.gz RSWNVAZPVMPOLN-AQEVESNVSA-N 2 0 240.778 2.486 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH+]1CCC([C@@H]2CC[NH2+]C2)CC1 ZINC000903451473 584771720 /nfs/dbraw/zinc/77/17/20/584771720.db2.gz AFIFXIIIWIEMKV-YUELXQCFSA-N 2 0 236.403 2.354 20 0 BEADRP CC(F)(F)CCC[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000903471607 584775486 /nfs/dbraw/zinc/77/54/86/584775486.db2.gz KNHCYUZYSUOFRD-SNVBAGLBSA-N 2 0 232.318 2.296 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1CCCC[C@@]2(CC[NH2+]C2)C1 ZINC000903481404 584777920 /nfs/dbraw/zinc/77/79/20/584777920.db2.gz ATSKFMMZZAMTLI-ILXRZTDVSA-N 2 0 236.403 2.498 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+][C@@H]1CC[NH2+]C12CCCC2 ZINC000903481590 584778132 /nfs/dbraw/zinc/77/81/32/584778132.db2.gz HDEDZTTWZIUSEA-FRRDWIJNSA-N 2 0 222.376 2.297 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1CCCC[C@]2(CC[NH2+]C2)C1 ZINC000903481405 584778151 /nfs/dbraw/zinc/77/81/51/584778151.db2.gz ATSKFMMZZAMTLI-QLFBSQMISA-N 2 0 236.403 2.498 20 0 BEADRP CC1(C)CN([C@H]2CCc3ccc(F)cc32)C[C@@H]1[NH3+] ZINC000903556321 584782981 /nfs/dbraw/zinc/78/29/81/584782981.db2.gz UVGKJTFHXOFRAF-KBPBESRZSA-N 2 0 248.345 2.482 20 0 BEADRP C[C@H]1C[N@H+](Cc2ccccc2CF)CC[C@H]1[NH3+] ZINC000903716021 584793973 /nfs/dbraw/zinc/79/39/73/584793973.db2.gz GCIMUIGWBYCARK-SMDDNHRTSA-N 2 0 236.334 2.325 20 0 BEADRP FCc1ccccc1C[N@@H+]1CC[C@@]2(CC[NH2+]C2)C1 ZINC000903744727 584796924 /nfs/dbraw/zinc/79/69/24/584796924.db2.gz XSCWFRKHSXJMAN-OAHLLOKOSA-N 2 0 248.345 2.342 20 0 BEADRP CC1CC(C[N@@H+]2CC3(C[C@H]2C)CC[NH2+]CC3)C1 ZINC000903762547 584797457 /nfs/dbraw/zinc/79/74/57/584797457.db2.gz AECIWTCCRRAILJ-ROKHWSDSSA-N 2 0 236.403 2.497 20 0 BEADRP C[N@H+](C[C@@H]1CC1(C)C)C[C@H]1CCCC[NH2+]C1 ZINC000903769894 584798098 /nfs/dbraw/zinc/79/80/98/584798098.db2.gz QXQRTESYMMNWKE-STQMWFEESA-N 2 0 224.392 2.354 20 0 BEADRP CC1(C)[C@H]([NH3+])C[C@@H]1[NH2+]Cc1ccccc1CF ZINC000903783170 584800510 /nfs/dbraw/zinc/80/05/10/584800510.db2.gz VTKFUWGTJSDQFM-OLZOCXBDSA-N 2 0 236.334 2.372 20 0 BEADRP C[C@@H](C[NH2+][C@@H]1C[NH2+]CC1(C)C)C(C)(C)C ZINC000903821643 584803963 /nfs/dbraw/zinc/80/39/63/584803963.db2.gz OLUXVRVWVAWKLL-WDEREUQCSA-N 2 0 212.381 2.256 20 0 BEADRP C[C@]12C[N@H+](CC[C@H]3CC[NH2+]C3)C[C@H]1[C@H]1CC[C@@H]2C1 ZINC000903827196 584805061 /nfs/dbraw/zinc/80/50/61/584805061.db2.gz QGEBYSHKSWLOAP-DGADGQDISA-N 2 0 248.414 2.354 20 0 BEADRP C[C@@H]1CSCCC[N@@H+]1CC[C@@H]1CCC[NH2+]C1 ZINC000903829230 584805770 /nfs/dbraw/zinc/80/57/70/584805770.db2.gz CLCZCZXQNJLULC-OLZOCXBDSA-N 2 0 242.432 2.204 20 0 BEADRP [NH3+][C@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccccc1F)C2 ZINC000903849215 584808007 /nfs/dbraw/zinc/80/80/07/584808007.db2.gz BAHXUTIJDPNXND-DRZSPHRISA-N 2 0 234.318 2.137 20 0 BEADRP Cc1cc(C)nc(CN2CC[C@@H]3CC[C@@]32C[NH3+])c1 ZINC000903862622 584813046 /nfs/dbraw/zinc/81/30/46/584813046.db2.gz AUHYGBABKRSADG-DZGCQCFKSA-N 2 0 245.370 2.012 20 0 BEADRP C[C@@H](CC(C)(C)C)[NH2+]C[C@H]([NH3+])CC(F)F ZINC000903925334 584823614 /nfs/dbraw/zinc/82/36/14/584823614.db2.gz FMZIXTAOBLDGEG-DTWKUNHWSA-N 2 0 222.323 2.383 20 0 BEADRP Fc1cccc(C[NH2+]CC2C[C@H]3CC[C@@H](C2)[NH2+]3)c1 ZINC000903922921 584823758 /nfs/dbraw/zinc/82/37/58/584823758.db2.gz HKSZVBZAOZXTBG-LQDVMPOASA-N 2 0 248.345 2.446 20 0 BEADRP C[C@]1([NH2+]C[C@H](N)CC(F)F)CC=CCC1 ZINC000903929694 584824103 /nfs/dbraw/zinc/82/41/03/584824103.db2.gz JQHWVJAEHNDXAU-KOLCDFICSA-N 2 0 218.291 2.057 20 0 BEADRP C1=C[C@@H]([NH2+]Cc2cccc3c2CC[NH2+]C3)CC1 ZINC000903933276 584825131 /nfs/dbraw/zinc/82/51/31/584825131.db2.gz NWMBORYYINYDCJ-CQSZACIVSA-N 2 0 228.339 2.141 20 0 BEADRP C[C@@H](C[C@H]1CCCCC[NH2+]1)NCCC(C)(C)[NH3+] ZINC000903939439 584825957 /nfs/dbraw/zinc/82/59/57/584825957.db2.gz HKQSTWLKVZNXHO-QWHCGFSZSA-N 2 0 241.423 2.014 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]C[C@@H]1C[NH2+]CCC1(F)F ZINC000903958340 584827741 /nfs/dbraw/zinc/82/77/41/584827741.db2.gz XYIURHMQIWYAHQ-ONGXEEELSA-N 2 0 232.318 2.009 20 0 BEADRP CC(C)([NH3+])CC[NH2+]Cc1ccc2cnccc2c1 ZINC000903939616 584828991 /nfs/dbraw/zinc/82/89/91/584828991.db2.gz KLHBCRYPTZBGED-UHFFFAOYSA-N 2 0 243.354 2.452 20 0 BEADRP CC(C)C[C@@H]([NH3+])C[NH2+]C1CCC=CCC1 ZINC000903962896 584829032 /nfs/dbraw/zinc/82/90/32/584829032.db2.gz LVXTVZINDNHVBI-GFCCVEGCSA-N 2 0 210.365 2.448 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+][C@H]1CCC[C@@H](C)C1 ZINC000903975095 584832507 /nfs/dbraw/zinc/83/25/07/584832507.db2.gz XBRAPMLRFROLAJ-SYQHCUMBSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1CCC[C@H]1[NH2+]CC[C@@H]1C[NH2+]C[C@H]1C ZINC000903974796 584832497 /nfs/dbraw/zinc/83/24/97/584832497.db2.gz SUWLNCIMODYCTP-FDYHWXHSSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+][C@H]1CC[C@@H](C)[C@@H](C)C1 ZINC000903964097 584833908 /nfs/dbraw/zinc/83/39/08/584833908.db2.gz LJADWHKUEKEHNH-RXGFPQBGSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@H]1C[C@H](C[NH2+]C2CCC=CCC2)CC[NH2+]1 ZINC000903964562 584834027 /nfs/dbraw/zinc/83/40/27/584834027.db2.gz UGLXIAAHRHRKNL-QWHCGFSZSA-N 2 0 222.376 2.463 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+]CC1CCCCCC1 ZINC000903964505 584834281 /nfs/dbraw/zinc/83/42/81/584834281.db2.gz KINCLYMFQHQRLP-OCCSQVGLSA-N 2 0 224.392 2.402 20 0 BEADRP CC(C)[C@H]1CCC[C@@H]1[NH2+][C@@H]1C[NH2+]C[C@H]1C ZINC000903965046 584834574 /nfs/dbraw/zinc/83/45/74/584834574.db2.gz YUZQWJHRJDZLIN-FVCCEPFGSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[NH2+]C[C@H]1C)C1CCCCC1 ZINC000903964806 584834592 /nfs/dbraw/zinc/83/45/92/584834592.db2.gz WGMMUELEWJTSMX-NQBHXWOUSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+]C[C@@H]1CCC[C@@H](C)C1 ZINC000903965023 584834763 /nfs/dbraw/zinc/83/47/63/584834763.db2.gz YLAFTAMIGKZEJC-FDYHWXHSSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@H](CC1CCCC1)[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000903967082 584834951 /nfs/dbraw/zinc/83/49/51/584834951.db2.gz GSACVUSBFSILPH-BZPMIXESSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+]C[C@H]1CCC[C@H](C)C1 ZINC000903968315 584834954 /nfs/dbraw/zinc/83/49/54/584834954.db2.gz SEHKKPCVNBLELM-CRWXNKLISA-N 2 0 224.392 2.258 20 0 BEADRP Cc1cccc(C)c1C[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000903967478 584834972 /nfs/dbraw/zinc/83/49/72/584834972.db2.gz JVIGEEZKLBQNGV-KGLIPLIRSA-N 2 0 232.371 2.249 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+]C[C@@H]1CCCC[C@H]1C ZINC000903967067 584835012 /nfs/dbraw/zinc/83/50/12/584835012.db2.gz GDMGLJRADQUVBC-MQYQWHSLSA-N 2 0 224.392 2.258 20 0 BEADRP CC(C)[N@H+](C)C[C@@H]([NH3+])CCC(C)(C)C ZINC000904301640 584861389 /nfs/dbraw/zinc/86/13/89/584861389.db2.gz KZUAPSVFJVRRRJ-NSHDSACASA-N 2 0 200.370 2.480 20 0 BEADRP CC[N@H+](CCc1cccs1)C[C@H]1C[C@@H]([NH3+])C1 ZINC000904309994 584862642 /nfs/dbraw/zinc/86/26/42/584862642.db2.gz UKWZYGDMBXAMRT-TXEJJXNPSA-N 2 0 238.400 2.350 20 0 BEADRP C[N@@H+](Cc1ccc(F)c(F)c1)C[C@H]1C[C@@H]([NH3+])C1 ZINC000904308186 584862782 /nfs/dbraw/zinc/86/27/82/584862782.db2.gz LQIORYXSRDTGMX-PHIMTYICSA-N 2 0 240.297 2.134 20 0 BEADRP C[N@H+](C[C@@]1(C)CCC[NH2+]C1)C(C1CC1)C1CC1 ZINC000904313777 584863291 /nfs/dbraw/zinc/86/32/91/584863291.db2.gz JYVWPTJDBZFIAG-HNNXBMFYSA-N 2 0 236.403 2.497 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[N@@H+]2CC3C[C@@H]4CC2C[C@H](C3)C4)C1 ZINC000904336828 584863488 /nfs/dbraw/zinc/86/34/88/584863488.db2.gz VJRUOZRFQNADNP-VNNHIJIPSA-N 2 0 234.387 2.234 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[N@@H+]2CC[C@@H](c3cccc(F)c3)C2)C1 ZINC000904316984 584863915 /nfs/dbraw/zinc/86/39/15/584863915.db2.gz BPACRROYEJHODE-KYOSRNDESA-N 2 0 248.345 2.352 20 0 BEADRP C[C@@H](c1cccc(O)c1)[N@H+](C)C[C@H]1C[C@@H]([NH3+])C1 ZINC000904320787 584864284 /nfs/dbraw/zinc/86/42/84/584864284.db2.gz PGTYURGJHAXRBS-GMXVVIOVSA-N 2 0 234.343 2.122 20 0 BEADRP C[N@H+](C[C@H]([NH3+])CCC(C)(C)C)C[C@H]1CCOC1 ZINC000904326952 584865269 /nfs/dbraw/zinc/86/52/69/584865269.db2.gz UOTZOKFAWBKNDD-CHWSQXEVSA-N 2 0 242.407 2.108 20 0 BEADRP CC(C)C[C@@H]1CCC[N@H+](C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000904325293 584865312 /nfs/dbraw/zinc/86/53/12/584865312.db2.gz VFVNUMKYOWYUBU-MELADBBJSA-N 2 0 224.392 2.482 20 0 BEADRP C[N@H+](C[C@@H]([NH3+])CCC(C)(C)C)C[C@@H]1CCOC1 ZINC000904326955 584865645 /nfs/dbraw/zinc/86/56/45/584865645.db2.gz UOTZOKFAWBKNDD-STQMWFEESA-N 2 0 242.407 2.108 20 0 BEADRP CC(C)[N@H+](CC1CCC1)C[C@H]1C[C@@H]([NH3+])C1 ZINC000904348302 584868058 /nfs/dbraw/zinc/86/80/58/584868058.db2.gz PUTVNQGZEMNFMS-BETUJISGSA-N 2 0 210.365 2.234 20 0 BEADRP C[N@H+](C[C@H]1C[C@@H]([NH3+])C1)[C@H]1CCC(C)(C)C1 ZINC000904350134 584868950 /nfs/dbraw/zinc/86/89/50/584868950.db2.gz GTAUSMMVISKSRO-TUAOUCFPSA-N 2 0 210.365 2.234 20 0 BEADRP C[C@@H]1CC([NH2+]C2CC(C[NH3+])C2)C[C@@H](C)C1 ZINC000904360106 584871591 /nfs/dbraw/zinc/87/15/91/584871591.db2.gz HPXAVNKJRMYRAD-QKIYJJFGSA-N 2 0 210.365 2.138 20 0 BEADRP CC[C@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1c(C)noc1C ZINC000904361167 584872060 /nfs/dbraw/zinc/87/20/60/584872060.db2.gz WVNBDZSLTOKTOJ-TUAOUCFPSA-N 2 0 237.347 2.069 20 0 BEADRP COc1ccccc1[C@H](C)[NH2+]C1CC(C[NH3+])C1 ZINC000904360678 584872081 /nfs/dbraw/zinc/87/20/81/584872081.db2.gz NZGULVJEMBYVHG-UNXYVOJBSA-N 2 0 234.343 2.083 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@H]2C[C@@H]2C2CCCCC2)C1 ZINC000904368390 584872534 /nfs/dbraw/zinc/87/25/34/584872534.db2.gz QYBBCOIQWURXLG-CABNGKKXSA-N 2 0 222.376 2.282 20 0 BEADRP [NH3+]CC1CC([NH2+][C@H]2C[C@H]2C2CCCCC2)C1 ZINC000904367571 584872788 /nfs/dbraw/zinc/87/27/88/584872788.db2.gz FIOFGXZGUHRILF-FFKWVLBGSA-N 2 0 222.376 2.282 20 0 BEADRP CCOCc1ccccc1C[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000904367780 584872912 /nfs/dbraw/zinc/87/29/12/584872912.db2.gz IXPBPAUEWSSWQA-JNSHFYNHSA-N 2 0 248.370 2.050 20 0 BEADRP CC(C)(C)c1ccncc1C[NH2+]C1CC(C[NH3+])C1 ZINC000904373797 584873778 /nfs/dbraw/zinc/87/37/78/584873778.db2.gz WOCDWSNTIWHLOJ-UHFFFAOYSA-N 2 0 247.386 2.206 20 0 BEADRP CC(C)(C)CC[C@@H]([NH3+])C[NH2+]C[C@@]1(C)CCCO1 ZINC000904366854 584874888 /nfs/dbraw/zinc/87/48/88/584874888.db2.gz RHHCPNLTXWVXSW-TZMCWYRMSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1c(F)cccc1F ZINC000904389703 584875643 /nfs/dbraw/zinc/87/56/43/584875643.db2.gz RGWNICUOBIPKAN-LPEHRKFASA-N 2 0 240.297 2.353 20 0 BEADRP CC(C)[C@H]([NH3+])CCNC[C@H]([NH3+])CCC(C)(C)C ZINC000904380000 584876461 /nfs/dbraw/zinc/87/64/61/584876461.db2.gz ZFCCGQNKZRAERZ-CHWSQXEVSA-N 2 0 243.439 2.103 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@H]([NH3+])CCC(C)(C)C)[C@@H](C)O1 ZINC000904384295 584877157 /nfs/dbraw/zinc/87/71/57/584877157.db2.gz JORBMVNANGSDMZ-LPWJVIDDSA-N 2 0 242.407 2.296 20 0 BEADRP C[C@H](C[NH2+]C[C@]1(C)CCC[NH2+]C1)c1ccncc1 ZINC000904381597 584877540 /nfs/dbraw/zinc/87/75/40/584877540.db2.gz ZLQWTGGBMSSBCL-UKRRQHHQSA-N 2 0 247.386 2.164 20 0 BEADRP CC[C@H]([NH2+]C1CC(C[NH3+])C1)c1ccccc1OC ZINC000904385284 584877679 /nfs/dbraw/zinc/87/76/79/584877679.db2.gz UQOCPKNPBZRSII-YIZWMMSDSA-N 2 0 248.370 2.473 20 0 BEADRP [NH3+]CC1CC([NH2+][C@@H]2c3ccccc3CC[C@H]2F)C1 ZINC000904386019 584877742 /nfs/dbraw/zinc/87/77/42/584877742.db2.gz MZEISRLQRYBSNO-CKCNXQLGSA-N 2 0 248.345 2.339 20 0 BEADRP C[C@H]1C[N@H+](Cc2cccs2)CC[C@H]1C[NH3+] ZINC000904412843 584879595 /nfs/dbraw/zinc/87/95/95/584879595.db2.gz XTGVCKCWFCJMGY-QWRGUYRKSA-N 2 0 224.373 2.165 20 0 BEADRP COc1ccccc1C[N@@H+]1CC[C@H](C[NH3+])[C@@H](C)C1 ZINC000904411858 584879714 /nfs/dbraw/zinc/87/97/14/584879714.db2.gz OLYMYHISTWAKOF-QWHCGFSZSA-N 2 0 248.370 2.112 20 0 BEADRP CCCC[N@@H+]1CCCC12CC[NH+](C)CC2 ZINC000769160048 584958795 /nfs/dbraw/zinc/95/87/95/584958795.db2.gz AAMRSDZDYORKKG-UHFFFAOYSA-N 2 0 210.365 2.347 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@@H](C)CSC(C)(C)C ZINC000817957276 584991625 /nfs/dbraw/zinc/99/16/25/584991625.db2.gz ADIFIQUWOHHLIM-WDEREUQCSA-N 2 0 232.437 2.480 20 0 BEADRP Cc1ccc2c(c1)CC[C@@H]2[NH2+][C@@H](C)[C@@H](C)[NH3+] ZINC000817977266 584993354 /nfs/dbraw/zinc/99/33/54/584993354.db2.gz FUSFKGFBVBUEKQ-SUNKGSAMSA-N 2 0 218.344 2.308 20 0 BEADRP CC[NH+]1CCC(CC[NH2+]Cc2ccoc2)CC1 ZINC000742378109 585125579 /nfs/dbraw/zinc/12/55/79/585125579.db2.gz WZVYJNXOXXXLIF-UHFFFAOYSA-N 2 0 236.359 2.491 20 0 BEADRP CCCC[N@@H+]1CC[C@@H](C2CC[NH+](C)CC2)C1 ZINC000757641736 585343612 /nfs/dbraw/zinc/34/36/12/585343612.db2.gz GTOHZBPKCNHBIB-CQSZACIVSA-N 2 0 224.392 2.450 20 0 BEADRP CCCC[N@@H+]1CC[C@H](C2CC[NH+](C)CC2)C1 ZINC000757641735 585343815 /nfs/dbraw/zinc/34/38/15/585343815.db2.gz GTOHZBPKCNHBIB-AWEZNQCLSA-N 2 0 224.392 2.450 20 0 BEADRP C[C@H](C1CC1)[NH+]1CCN(c2cc[nH+]cc2)CC1 ZINC000777446447 585712558 /nfs/dbraw/zinc/71/25/58/585712558.db2.gz LWCCRFHTBZCMTG-GFCCVEGCSA-N 2 0 231.343 2.002 20 0 BEADRP C[C@H](C1CC1)[NH+]1CCC(C[NH+](C)C)CC1 ZINC000777691175 585718706 /nfs/dbraw/zinc/71/87/06/585718706.db2.gz VAGRDPQTFFIHMJ-LLVKDONJSA-N 2 0 210.365 2.059 20 0 BEADRP CC[NH+](CC)C[C@@H]1CC[N@@H+]([C@@H](C)C2CC2)C1 ZINC000782184316 585810733 /nfs/dbraw/zinc/81/07/33/585810733.db2.gz CMYOUDDLXHQEMN-STQMWFEESA-N 2 0 224.392 2.449 20 0 BEADRP CC[C@@H]1C[N@H+](CC2CC[NH+](C)CC2)CCS1 ZINC000788480633 585925420 /nfs/dbraw/zinc/92/54/20/585925420.db2.gz BWBRTCIMLQIVED-CYBMUJFWSA-N 2 0 242.432 2.156 20 0 BEADRP CSCC[C@H](C)[N@H+](C)CC1CC[NH+](C)CC1 ZINC000788493877 585925632 /nfs/dbraw/zinc/92/56/32/585925632.db2.gz JMWUCRZDJSPQON-LBPRGKRZSA-N 2 0 244.448 2.402 20 0 BEADRP C[C@@H]1C[C@H]1C[N@@H+]1CCCC2(CC[NH+](C)CC2)C1 ZINC000798956978 586154587 /nfs/dbraw/zinc/15/45/87/586154587.db2.gz SECRWKPFDCMKQF-KGLIPLIRSA-N 2 0 236.403 2.450 20 0 BEADRP C[NH+](C)C[C@@H]1CC[N@H+](CCSC(C)(C)C)C1 ZINC000801921372 586277784 /nfs/dbraw/zinc/27/77/84/586277784.db2.gz AOAPOEOHAJXEDW-LBPRGKRZSA-N 2 0 244.448 2.402 20 0 BEADRP C[NH+](C)C[C@H]1CC[N@H+](CCSC(C)(C)C)C1 ZINC000801921371 586277925 /nfs/dbraw/zinc/27/79/25/586277925.db2.gz AOAPOEOHAJXEDW-GFCCVEGCSA-N 2 0 244.448 2.402 20 0 BEADRP [NH3+]Cc1ccc(-c2ccc3c(c2)CC[NH2+]C3)cc1 ZINC000757215968 586440774 /nfs/dbraw/zinc/44/07/74/586440774.db2.gz OQMOOTKPIMTPLZ-UHFFFAOYSA-N 2 0 238.334 2.458 20 0 BEADRP CC(C)[NH2+]C1CCN(CCC(=O)C(C)C)CC1 ZINC000808736546 586486147 /nfs/dbraw/zinc/48/61/47/586486147.db2.gz UEAONGJVKBVWHC-UHFFFAOYSA-N 2 0 240.391 2.064 20 0 BEADRP CCC[N@H+](CCC[NH+](C)C)C[C@H]1CCC=CO1 ZINC000809757793 586517742 /nfs/dbraw/zinc/51/77/42/586517742.db2.gz XWBHABJJKYDWFT-CQSZACIVSA-N 2 0 240.391 2.343 20 0 BEADRP CS[C@@H]1CC[C@@H]([NH2+][C@H](C)[C@@H]2CCC[NH2+]2)C1 ZINC000817897106 586831444 /nfs/dbraw/zinc/83/14/44/586831444.db2.gz FHHCBLNXUUOLAC-KKOKHZNYSA-N 2 0 228.405 2.001 20 0 BEADRP C[C@H]([NH3+])[C@@H]1COCC[C@@H]1[NH2+]C[C@@H](C)C(C)(C)C ZINC000817893966 586834011 /nfs/dbraw/zinc/83/40/11/586834011.db2.gz JTOJKAKXRNSHFW-VOAKCMCISA-N 2 0 242.407 2.011 20 0 BEADRP CS[C@@H]1CC[C@@H]([NH2+][C@H](C)[C@H]2CCC[NH2+]2)C1 ZINC000817897104 586834665 /nfs/dbraw/zinc/83/46/65/586834665.db2.gz FHHCBLNXUUOLAC-DDHJBXDOSA-N 2 0 228.405 2.001 20 0 BEADRP CC[C@@H]([NH2+]CC(C)(C)SC)[C@@H]1CCC[NH2+]1 ZINC000817898313 586834727 /nfs/dbraw/zinc/83/47/27/586834727.db2.gz FJDZGWHHEXRYCT-MNOVXSKESA-N 2 0 230.421 2.248 20 0 BEADRP CC[C@H]([NH2+][C@H]1CC[C@H](SC)C1)[C@@H]1CCC[NH2+]1 ZINC000817897270 586835030 /nfs/dbraw/zinc/83/50/30/586835030.db2.gz JCRXIWYWFCWXND-CYDGBPFRSA-N 2 0 242.432 2.391 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[C@@H](SC)C1)[C@@H]1CCC[NH2+]1 ZINC000817897271 586835460 /nfs/dbraw/zinc/83/54/60/586835460.db2.gz JCRXIWYWFCWXND-NDBYEHHHSA-N 2 0 242.432 2.391 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+]CCNc1ccccc1 ZINC000817899543 586835712 /nfs/dbraw/zinc/83/57/12/586835712.db2.gz GQFQAMYZRFGJSP-UKRRQHHQSA-N 2 0 247.386 2.206 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]CCNc1ccccc1 ZINC000817900308 586836148 /nfs/dbraw/zinc/83/61/48/586836148.db2.gz MFPGFLSIOUBNCF-CABCVRRESA-N 2 0 247.386 2.348 20 0 BEADRP Cc1cccc(C)c1C[NH2+][C@@H]1CCC[C@@H]1[NH3+] ZINC000817909095 586836808 /nfs/dbraw/zinc/83/68/08/586836808.db2.gz XQTMCYBEZJNHLA-UONOGXRCSA-N 2 0 218.344 2.273 20 0 BEADRP Cc1cccc(C)c1C[NH2+][C@H](C)C1C[NH2+]C1 ZINC000817909104 586837279 /nfs/dbraw/zinc/83/72/79/586837279.db2.gz XUZSZOKZHYUURA-GFCCVEGCSA-N 2 0 218.344 2.001 20 0 BEADRP CC[C@H]([NH2+]CCC[NH3+])c1ccc2c(c1)CCCO2 ZINC000817939086 586843851 /nfs/dbraw/zinc/84/38/51/586843851.db2.gz YRQOPSQIPLSXCM-AWEZNQCLSA-N 2 0 248.370 2.401 20 0 BEADRP CCOc1cccc([C@H](C)[NH2+]C[C@@H](C)C[NH3+])c1 ZINC000817961830 586852337 /nfs/dbraw/zinc/85/23/37/586852337.db2.gz DHKHZPCIIUSOAO-RYUDHWBXSA-N 2 0 236.359 2.331 20 0 BEADRP Cc1ccc2c(c1)CC[C@H]2[NH2+]C[C@H](C)C[NH3+] ZINC000817962450 586853467 /nfs/dbraw/zinc/85/34/67/586853467.db2.gz MJLITHKGROVINV-BXUZGUMPSA-N 2 0 218.344 2.167 20 0 BEADRP C[C@H]([NH3+])C[NH2+][C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000817971337 586856680 /nfs/dbraw/zinc/85/66/80/586856680.db2.gz CLSWXNOFFSFQRR-YIZRAAEISA-N 2 0 224.270 2.044 20 0 BEADRP C[C@H](CSC(C)(C)C)[NH2+][C@@H](C)[C@H](C)[NH3+] ZINC000817978014 586861842 /nfs/dbraw/zinc/86/18/42/586861842.db2.gz TVNAYRGQLURIHY-UTLUCORTSA-N 2 0 218.410 2.232 20 0 BEADRP C[C@@H](O)C[NH2+]CCCCCCC[NH+]1CCCC1 ZINC000818974326 586919508 /nfs/dbraw/zinc/91/95/08/586919508.db2.gz LDIYMFGVEHWCFS-CQSZACIVSA-N 2 0 242.407 2.003 20 0 BEADRP CC[C@](C)([NH2+]CCC[NH3+])c1ccccc1 ZINC000841010923 587935233 /nfs/dbraw/zinc/93/52/33/587935233.db2.gz WGINNGDCMFUJFL-ZDUSSCGKSA-N 2 0 206.333 2.250 20 0 BEADRP Cc1cc(C[NH2+][C@@H](C)CCC[NH3+])cnc1Cl ZINC000841078924 587944747 /nfs/dbraw/zinc/94/47/47/587944747.db2.gz DJVMOJLUOBKHMO-JTQLQIEISA-N 2 0 241.766 2.260 20 0 BEADRP CCCCCC[C@@H](C)[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000841081373 587945011 /nfs/dbraw/zinc/94/50/11/587945011.db2.gz WBSALCSDINHQST-NDBYEHHHSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]Cc1cncc2ccccc21 ZINC000841080763 587945121 /nfs/dbraw/zinc/94/51/21/587945121.db2.gz PZWSSPVSSKBAQZ-LBPRGKRZSA-N 2 0 243.354 2.452 20 0 BEADRP C[C@@H]([NH3+])c1ccc(NC(=O)CCCCC[NH3+])cc1 ZINC000841849157 587978004 /nfs/dbraw/zinc/97/80/04/587978004.db2.gz YANZXRVWYSGEFO-LLVKDONJSA-N 2 0 249.358 2.164 20 0 BEADRP [NH3+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1cccc(O)c1 ZINC000843053981 588077356 /nfs/dbraw/zinc/07/73/56/588077356.db2.gz OFRQFSKIWXWKHR-AGUYFDCRSA-N 2 0 246.354 2.236 20 0 BEADRP CC[C@H]1C[C@@H](C[NH2+]C2CCC([NH3+])CC2)CCO1 ZINC000843105556 588081742 /nfs/dbraw/zinc/08/17/42/588081742.db2.gz VXVAYWRUKZAPCB-ABXWRUBCSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]Cc1cncc2ccccc21 ZINC000843127993 588084964 /nfs/dbraw/zinc/08/49/64/588084964.db2.gz GRGFQYNYFKDEHF-NWDGAFQWSA-N 2 0 243.354 2.450 20 0 BEADRP [NH3+]CCCCCC[NH2+][C@H]1CC[C@@H]1C1CC1 ZINC000843340292 588101009 /nfs/dbraw/zinc/10/10/09/588101009.db2.gz ABTHIWKSLYBSED-OLZOCXBDSA-N 2 0 210.365 2.284 20 0 BEADRP C[NH2+]CCC[N@H+]1Cc2ccccc2[C@@H](C)C1 ZINC000843355994 588103029 /nfs/dbraw/zinc/10/30/29/588103029.db2.gz ADQJVLGGCKJIRK-LBPRGKRZSA-N 2 0 218.344 2.215 20 0 BEADRP [NH3+]CCCCCCC[N@@H+]1CCCC[C@@H]1CC[NH3+] ZINC000843384588 588105620 /nfs/dbraw/zinc/10/56/20/588105620.db2.gz UKZITKRQDMAKEO-CQSZACIVSA-N 2 0 241.423 2.099 20 0 BEADRP C[NH+]1CCC(CC[NH2+]CC(C)(C)C)CC1 ZINC000105454121 588173776 /nfs/dbraw/zinc/17/37/76/588173776.db2.gz KQRGPJRFTOLJGJ-UHFFFAOYSA-N 2 0 212.381 2.354 20 0 BEADRP CCc1cccc(C[NH2+][C@H]2CCN(C)C2)c1 ZINC000845935739 588250658 /nfs/dbraw/zinc/25/06/58/588250658.db2.gz SUHBVRNBOJCHGC-AWEZNQCLSA-N 2 0 218.344 2.043 20 0 BEADRP CC(C)C[N@H+](C)CCC[NH2+][C@@H]1CC[C@@H]1C ZINC000845997129 588252921 /nfs/dbraw/zinc/25/29/21/588252921.db2.gz VBDZVUWRSLLURG-QWHCGFSZSA-N 2 0 212.381 2.352 20 0 BEADRP [NH3+]CCCCCC[N@H+](C[C@@H]1CCOC1)C1CC1 ZINC000846217388 588259886 /nfs/dbraw/zinc/25/98/86/588259886.db2.gz GBNOXWQHEILHDX-ZDUSSCGKSA-N 2 0 240.391 2.006 20 0 BEADRP CC(C)CO[C@H]1CC[N@H+](CCCCCC[NH3+])C1 ZINC000846219693 588260718 /nfs/dbraw/zinc/26/07/18/588260718.db2.gz VYNFCHYXHWSPCQ-AWEZNQCLSA-N 2 0 242.407 2.252 20 0 BEADRP Cl/C=C\C[NH+]1CCC([C@@H]2CC[NH2+]C2)CC1 ZINC000846220582 588261048 /nfs/dbraw/zinc/26/10/48/588261048.db2.gz LTUAUYCYNUXNHG-KYXXQBJFSA-N 2 0 228.767 2.060 20 0 BEADRP Cl/C=C\C[N@@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1 ZINC000846221253 588261358 /nfs/dbraw/zinc/26/13/58/588261358.db2.gz VICACEDIOOXPKE-VHGJUTQGSA-N 2 0 228.767 2.060 20 0 BEADRP [NH3+]CCCCCC[N@@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000846229301 588261981 /nfs/dbraw/zinc/26/19/81/588261981.db2.gz SMEPWYKJDYKJIN-LLVKDONJSA-N 2 0 232.318 2.237 20 0 BEADRP C[C@H]([NH2+]Cc1cnc2n1CCC2)c1ccc[nH]1 ZINC000850229242 588530715 /nfs/dbraw/zinc/53/07/15/588530715.db2.gz YFHORPYUBARQNB-JTQLQIEISA-N 2 0 230.315 2.008 20 0 BEADRP c1cc(C[NH2+]CC2CC[NH+](CC3CC3)CC2)co1 ZINC000850419260 588545134 /nfs/dbraw/zinc/54/51/34/588545134.db2.gz CKFLTGMJTLLXQL-UHFFFAOYSA-N 2 0 248.370 2.491 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@@H]2C=CCC2)[C@@H]2CCC[C@@H]21 ZINC000850506204 588552847 /nfs/dbraw/zinc/55/28/47/588552847.db2.gz CLCOFTAKLSGUJG-RFGFWPKPSA-N 2 0 220.360 2.167 20 0 BEADRP C[N@@H+]1CCCC[C@@H](C[NH2+]C2CC(C(F)F)C2)C1 ZINC000862483591 589217038 /nfs/dbraw/zinc/21/70/38/589217038.db2.gz VDGQZBXKPKTUCC-UNXYVOJBSA-N 2 0 246.345 2.352 20 0 BEADRP C1C[C@@H]([NH2+][C@H]2CC[C@@H]3CCCC[C@@H]3C2)C[NH2+]1 ZINC000863488054 589293872 /nfs/dbraw/zinc/29/38/72/589293872.db2.gz DQEKDOYOTGQRDT-RFQIPJPRSA-N 2 0 222.376 2.297 20 0 BEADRP CCO[C@H](C[N@H+](C)C1CCC([NH3+])CC1)C1CC1 ZINC000863541622 589297345 /nfs/dbraw/zinc/29/73/45/589297345.db2.gz KMXNHOBLSGPYJW-JXQTWKCFSA-N 2 0 240.391 2.003 20 0 BEADRP C[NH2+]CCC[N@@H+]1C[C@@H]2C[C@@H](c3ccccc3)[C@@H]2C1 ZINC000863558000 589299167 /nfs/dbraw/zinc/29/91/67/589299167.db2.gz UPSGBEGAVJCXIA-HRCADAONSA-N 2 0 244.382 2.331 20 0 BEADRP C[C@H]([NH3+])CN(C)Cc1cc2cc(F)ccc2o1 ZINC000863652056 589307759 /nfs/dbraw/zinc/30/77/59/589307759.db2.gz PIQSLNJOQJUJSQ-VIFPVBQESA-N 2 0 236.290 2.351 20 0 BEADRP CN(CC[NH+](C)C)c1cc[nH+]cc1C(F)(F)F ZINC000865577920 589448429 /nfs/dbraw/zinc/44/84/29/589448429.db2.gz SXMDGEPPUALGEY-UHFFFAOYSA-N 2 0 247.264 2.098 20 0 BEADRP CC(C)[NH+]1CCC(CC[NH2+]CC2CC2)CC1 ZINC000865716852 589458404 /nfs/dbraw/zinc/45/84/04/589458404.db2.gz FYXWSEJUZHPPBM-UHFFFAOYSA-N 2 0 224.392 2.497 20 0 BEADRP CS[C@H]1C[C@H]([NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)C1 ZINC000865733263 589459241 /nfs/dbraw/zinc/45/92/41/589459241.db2.gz GSQRQQHTWZHUQP-RVMXOQNASA-N 2 0 240.416 2.097 20 0 BEADRP CCc1cc(N2CC[C@H]3[C@H](CC[N@@H+]3C)C2)cc[nH+]1 ZINC000866206193 589480098 /nfs/dbraw/zinc/48/00/98/589480098.db2.gz BYVAPYLYPSMFKE-DOMZBBRYSA-N 2 0 245.370 2.174 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CCC(C)(C)OC)[C@@H](C)C1 ZINC000866503731 589497899 /nfs/dbraw/zinc/49/78/99/589497899.db2.gz VTACXWYQWOGZQB-QWHCGFSZSA-N 2 0 242.407 2.121 20 0 BEADRP Cc1cc(C)c(C[N@@H+]2CCC[C@@H](C[NH3+])C2)c(C)n1 ZINC000866659833 589507884 /nfs/dbraw/zinc/50/78/84/589507884.db2.gz VRUKLPXOZYTMER-AWEZNQCLSA-N 2 0 247.386 2.178 20 0 BEADRP CC(C)[C@@](C)(C[NH3+])[NH2+]C[C@@H]1CCC(C)(C)CO1 ZINC000866661822 589508836 /nfs/dbraw/zinc/50/88/36/589508836.db2.gz VOQUJQURKJSYJN-GXTWGEPZSA-N 2 0 242.407 2.155 20 0 BEADRP CC(C)(C)[C@]1(C[NH3+])CC[N@H+](Cc2cccnc2)C1 ZINC000866708061 589514801 /nfs/dbraw/zinc/51/48/01/589514801.db2.gz XMMFONZMVDAAOO-HNNXBMFYSA-N 2 0 247.386 2.279 20 0 BEADRP CC(=O)C1CC[NH+](CCCCCCC[NH3+])CC1 ZINC000872146506 589885282 /nfs/dbraw/zinc/88/52/82/589885282.db2.gz PKVASOPTCPCVJM-UHFFFAOYSA-N 2 0 240.391 2.197 20 0 BEADRP CC(C)[NH+]1CCN(c2cc[nH+]cc2C2CC2)CC1 ZINC000872405558 589935672 /nfs/dbraw/zinc/93/56/72/589935672.db2.gz BSIINTQBUPQQTD-UHFFFAOYSA-N 2 0 245.370 2.489 20 0 BEADRP C[C@H]1C[C@H](Nc2cc[nH+]cc2C2CC2)CC[N@@H+]1C ZINC000872463053 589941734 /nfs/dbraw/zinc/94/17/34/589941734.db2.gz HKKVXKVODPJSHG-WCQYABFASA-N 2 0 245.370 2.276 20 0 BEADRP C[C@@H](CCNc1cc[nH+]cc1C1CC1)[NH+](C)C ZINC000872596083 589954866 /nfs/dbraw/zinc/95/48/66/589954866.db2.gz BQFDJKONHDTGDT-NSHDSACASA-N 2 0 233.359 2.133 20 0 BEADRP CCC[C@H](C)C[NH2+][C@@H](C)C1CC[NH2+]CC1 ZINC000873222264 589999745 /nfs/dbraw/zinc/99/97/45/589999745.db2.gz IZISTMWYKPYASK-RYUDHWBXSA-N 2 0 212.381 2.400 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@@H]2CCCC[C@@H]2F)C1 ZINC000873217629 589998005 /nfs/dbraw/zinc/99/80/05/589998005.db2.gz MNCABZDSHFMZSD-WISYIIOYSA-N 2 0 214.328 2.127 20 0 BEADRP C[C@@H](C[C@H]1CCC[NH2+]1)[NH2+][C@@H]1CCCC[C@@H]1F ZINC000873217697 589998046 /nfs/dbraw/zinc/99/80/46/589998046.db2.gz PMTCXMBWQYIXPR-QNWHQSFQSA-N 2 0 228.355 2.387 20 0 BEADRP F[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000873216055 589998152 /nfs/dbraw/zinc/99/81/52/589998152.db2.gz IEBDDWJCAFCDMD-KSTCHIGDSA-N 2 0 240.366 2.245 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H]2CCCC[C@@H]2F)C1 ZINC000873217627 589998422 /nfs/dbraw/zinc/99/84/22/589998422.db2.gz MNCABZDSHFMZSD-NOOOWODRSA-N 2 0 214.328 2.127 20 0 BEADRP CCCC[C@@H](COC)[NH2+][C@H](C)C1CC[NH2+]CC1 ZINC000873220089 589998877 /nfs/dbraw/zinc/99/88/77/589998877.db2.gz JBBGZMZNDPYKOD-OCCSQVGLSA-N 2 0 242.407 2.169 20 0 BEADRP COCCC1([NH2+]CCC(C)(C)C)CC[NH2+]CC1 ZINC000873225339 590000646 /nfs/dbraw/zinc/00/06/46/590000646.db2.gz OTUXUSKPVDBJEA-UHFFFAOYSA-N 2 0 242.407 2.171 20 0 BEADRP C([NH2+][C@H]1CCCCC12CC[NH2+]CC2)C1CC1 ZINC000873232872 590000701 /nfs/dbraw/zinc/00/07/01/590000701.db2.gz PCPWODUCUDQDBV-ZDUSSCGKSA-N 2 0 222.376 2.298 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CCCS1)[C@@H]1CCC[NH2+]1 ZINC000873242989 590006461 /nfs/dbraw/zinc/00/64/61/590006461.db2.gz HNSOZSVWJBYUHH-UTUOFQBUSA-N 2 0 228.405 2.002 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CCCS1)[C@@H]1CCCC[NH2+]1 ZINC000873244348 590006509 /nfs/dbraw/zinc/00/65/09/590006509.db2.gz RGZDHSIRQFEBQA-AGIUHOORSA-N 2 0 242.432 2.392 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@H]2CCCC23CCC3)C1 ZINC000873248446 590006754 /nfs/dbraw/zinc/00/67/54/590006754.db2.gz AJJAOZWCAKBMSZ-TUAOUCFPSA-N 2 0 208.349 2.036 20 0 BEADRP CO[C@@H](c1ccccc1)[C@H](C)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873248634 590007600 /nfs/dbraw/zinc/00/76/00/590007600.db2.gz CISVZULNZXASCX-DDHJSBNISA-N 2 0 248.370 2.090 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@@H]2CCCc3ccc(O)cc32)C1 ZINC000873249301 590007779 /nfs/dbraw/zinc/00/77/79/590007779.db2.gz KNHGRVWBMYWYBA-IFUGULHKSA-N 2 0 246.354 2.097 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@@H]2CCCC23CCCC3)C1 ZINC000873249100 590007802 /nfs/dbraw/zinc/00/78/02/590007802.db2.gz IIZWSJLWRPEYRE-FRRDWIJNSA-N 2 0 222.376 2.426 20 0 BEADRP CC(C)(C)[C@@H]1CC[C@@H]1[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873249230 590007849 /nfs/dbraw/zinc/00/78/49/590007849.db2.gz IYVYPYRDRDQZOZ-KXNHARMFSA-N 2 0 210.365 2.138 20 0 BEADRP CCC[C@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1cccnc1 ZINC000873250602 590007925 /nfs/dbraw/zinc/00/79/25/590007925.db2.gz QCCKILIJOQNEDW-YUTCNCBUSA-N 2 0 233.359 2.250 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C[C@H]2C[C@@H]([NH3+])C2)C[C@H]1C ZINC000873251669 590008400 /nfs/dbraw/zinc/00/84/00/590008400.db2.gz MXFCUJQKBXLGHR-NJMOYASZSA-N 2 0 210.365 2.138 20 0 BEADRP CC(C)(C[NH2+][C@@H]1CCC[C@H]1[NH3+])C(C)(F)F ZINC000873250700 590008416 /nfs/dbraw/zinc/00/84/16/590008416.db2.gz GXUKGUPRXWWJJB-RKDXNWHRSA-N 2 0 220.307 2.137 20 0 BEADRP CC(C)(C[NH2+][C@@H]1CCC[C@@H]1[NH3+])C(C)(F)F ZINC000873250697 590008512 /nfs/dbraw/zinc/00/85/12/590008512.db2.gz GXUKGUPRXWWJJB-DTWKUNHWSA-N 2 0 220.307 2.137 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@@H]2CCCc3c(O)cccc32)C1 ZINC000873250335 590008539 /nfs/dbraw/zinc/00/85/39/590008539.db2.gz PBYULBNBFOPQEK-UHIISALHSA-N 2 0 246.354 2.097 20 0 BEADRP C[C@H](CC1CCCC1)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873253071 590008866 /nfs/dbraw/zinc/00/88/66/590008866.db2.gz YVKPBDJNRBEJOC-RTXFEEFZSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]C[C@H]2C[C@@H]([NH3+])C2)[C@@H]1C ZINC000873252384 590008809 /nfs/dbraw/zinc/00/88/09/590008809.db2.gz QUEDTSSNUPEGCL-KVSVUVNWSA-N 2 0 210.365 2.138 20 0 BEADRP COc1ccsc1[C@H](C)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873251732 590008990 /nfs/dbraw/zinc/00/89/90/590008990.db2.gz NTJFYBUVDLZSCI-LPEHRKFASA-N 2 0 240.372 2.145 20 0 BEADRP CC(C)C[C@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccccn1 ZINC000873253132 590009054 /nfs/dbraw/zinc/00/90/54/590009054.db2.gz ZMSFYKIHALQRCU-GUTXKFCHSA-N 2 0 247.386 2.496 20 0 BEADRP CC[C@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccccc1OC ZINC000873253783 590009441 /nfs/dbraw/zinc/00/94/41/590009441.db2.gz FDIVICVIMXSTTR-SCRDCRAPSA-N 2 0 248.370 2.473 20 0 BEADRP CC(C)=CCC[C@H](C)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873254250 590009815 /nfs/dbraw/zinc/00/98/15/590009815.db2.gz ONHBJOZZTUNFHE-RWMBFGLXSA-N 2 0 210.365 2.448 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1cccc(F)c1 ZINC000873255290 590010437 /nfs/dbraw/zinc/01/04/37/590010437.db2.gz FFWQOAVDNSBSMO-OUJBWJOFSA-N 2 0 222.307 2.214 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+][C@H](Cc2ccccc2)C2CC2)C1 ZINC000873255785 590010794 /nfs/dbraw/zinc/01/07/94/590010794.db2.gz KDYIJZQTAAUSPA-FVQBIDKESA-N 2 0 244.382 2.335 20 0 BEADRP CC[C@@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1ccc(OC)cc1 ZINC000873256585 590011412 /nfs/dbraw/zinc/01/14/12/590011412.db2.gz AKJYZDZHQBZMJF-UXIGCNINSA-N 2 0 248.370 2.473 20 0 BEADRP COc1ccc(C)cc1[C@@H](C)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873257189 590011450 /nfs/dbraw/zinc/01/14/50/590011450.db2.gz FJVQFZLQWAUZBO-JHJVBQTASA-N 2 0 248.370 2.392 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+][C@H]2CCCc3c(O)cccc32)C1 ZINC000873256844 590011479 /nfs/dbraw/zinc/01/14/79/590011479.db2.gz PBYULBNBFOPQEK-MJVIPROJSA-N 2 0 246.354 2.097 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+][C@@H]2CCc3ccc(F)cc32)C1 ZINC000873257066 590011700 /nfs/dbraw/zinc/01/17/00/590011700.db2.gz DYYWODDBVWKQFW-GAJTVXKRSA-N 2 0 234.318 2.140 20 0 BEADRP C[C@H](CCc1ccccc1)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873256858 590011887 /nfs/dbraw/zinc/01/18/87/590011887.db2.gz QLNDHQJVCXOXDM-YUELXQCFSA-N 2 0 232.371 2.335 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1ccccc1F ZINC000873258174 590012160 /nfs/dbraw/zinc/01/21/60/590012160.db2.gz NLXXHKRBFYMRHH-DCAQKATOSA-N 2 0 222.307 2.214 20 0 BEADRP C[C@@H]1Cc2ccccc2[C@@H]1[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873257966 590012175 /nfs/dbraw/zinc/01/21/75/590012175.db2.gz WEYSDJGPSPHSIF-NLRBGTRBSA-N 2 0 230.355 2.247 20 0 BEADRP C([NH2+]C1CCCC1)[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000873258515 590012696 /nfs/dbraw/zinc/01/26/96/590012696.db2.gz QWESQMWNBZXNJJ-LMKPVCQUSA-N 2 0 208.349 2.049 20 0 BEADRP CC(C)[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873258192 590012872 /nfs/dbraw/zinc/01/28/72/590012872.db2.gz XRBMTWWQDZWWDO-CYDGBPFRSA-N 2 0 210.365 2.138 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+][C@H]2CCC[C@H]2CCCF)C1 ZINC000873259018 590012955 /nfs/dbraw/zinc/01/29/55/590012955.db2.gz XNIYCGRFIGVLMD-CYDGBPFRSA-N 2 0 228.355 2.232 20 0 BEADRP C[C@@H](Cc1ccccc1F)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873258686 590012976 /nfs/dbraw/zinc/01/29/76/590012976.db2.gz VDQJBRRBSLOOJU-GVXVVHGQSA-N 2 0 236.334 2.084 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccoc1 ZINC000873259505 590013351 /nfs/dbraw/zinc/01/33/51/590013351.db2.gz GAWPXXMDPHRNRJ-VTPLQMEGSA-N 2 0 234.343 2.461 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccco1 ZINC000873260021 590013410 /nfs/dbraw/zinc/01/34/10/590013410.db2.gz QTNFJKUWSHEXEE-FVCCEPFGSA-N 2 0 234.343 2.461 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+]C[C@H]2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000873259662 590013693 /nfs/dbraw/zinc/01/36/93/590013693.db2.gz JDZGVEDESPXGLI-QNSTZXKLSA-N 2 0 222.376 2.295 20 0 BEADRP C([NH2+][C@@H]1CCCSC1)[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000873264737 590014818 /nfs/dbraw/zinc/01/48/18/590014818.db2.gz QVSGFTKZSUXKBJ-YVECIDJPSA-N 2 0 240.416 2.002 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccncc1 ZINC000873264413 590015025 /nfs/dbraw/zinc/01/50/25/590015025.db2.gz OZSASFAXPHRXCJ-RJZRQDKASA-N 2 0 245.370 2.263 20 0 BEADRP Cc1cc([C@H](C)[NH2+][C@H](C)C2CC[NH2+]CC2)no1 ZINC000873269046 590015435 /nfs/dbraw/zinc/01/54/35/590015435.db2.gz KGMRNJDPDQHWRY-MNOVXSKESA-N 2 0 237.347 2.022 20 0 BEADRP C[C@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)c1ccoc1 ZINC000873270998 590015906 /nfs/dbraw/zinc/01/59/06/590015906.db2.gz CGJKYFXDJABWPJ-QWRGUYRKSA-N 2 0 222.332 2.318 20 0 BEADRP Cc1cc([C@H](C)[NH2+][C@@H](C)C2CC[NH2+]CC2)no1 ZINC000873271620 590016179 /nfs/dbraw/zinc/01/61/79/590016179.db2.gz KGMRNJDPDQHWRY-QWRGUYRKSA-N 2 0 237.347 2.022 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[C@H]1C1CC1)C1CC[NH2+]CC1 ZINC000873271859 590016333 /nfs/dbraw/zinc/01/63/33/590016333.db2.gz MSEIFWBPFLXYLD-BPNCWPANSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]([NH2+]CCC[C@@H]1C=CCC1)[C@@H]1CCC[NH2+]1 ZINC000873282563 590019143 /nfs/dbraw/zinc/01/91/43/590019143.db2.gz VCSAGZCZLIQOIG-MCIONIFRSA-N 2 0 222.376 2.463 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]CCC[C@@H]1C=CCC1 ZINC000873283110 590019275 /nfs/dbraw/zinc/01/92/75/590019275.db2.gz YOZFEQSICHSCQE-JHJVBQTASA-N 2 0 208.349 2.202 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]CCC[C@H]1C=CCC1 ZINC000873283113 590019474 /nfs/dbraw/zinc/01/94/74/590019474.db2.gz YOZFEQSICHSCQE-YNEHKIRRSA-N 2 0 208.349 2.202 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]CCC[C@H]1C=CCC1 ZINC000873283112 590019504 /nfs/dbraw/zinc/01/95/04/590019504.db2.gz YOZFEQSICHSCQE-XQQFMLRXSA-N 2 0 208.349 2.202 20 0 BEADRP C[C@H]([NH2+]CCC[C@H]1C=CCC1)[C@@H]1CCC[NH2+]1 ZINC000873282562 590019574 /nfs/dbraw/zinc/01/95/74/590019574.db2.gz VCSAGZCZLIQOIG-IHRRRGAJSA-N 2 0 222.376 2.463 20 0 BEADRP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+]CCC[C@H]2CCO2)C1 ZINC000877074128 590278346 /nfs/dbraw/zinc/27/83/46/590278346.db2.gz ZSTBVNOCRSZXFP-MCIONIFRSA-N 2 0 240.391 2.018 20 0 BEADRP CC(C)C[NH+]1CCC2(CC[NH+](C)CC2)CC1 ZINC000877684790 590391695 /nfs/dbraw/zinc/39/16/95/590391695.db2.gz XYNPZWBAYQTTLU-UHFFFAOYSA-N 2 0 224.392 2.450 20 0 BEADRP C[N@@H+]1CC[C@H]2C[NH+](CCc3ccccc3)CC[C@H]21 ZINC000877743495 590410419 /nfs/dbraw/zinc/41/04/19/590410419.db2.gz WJSQAVRBSNHSPY-JKSUJKDBSA-N 2 0 244.382 2.255 20 0 BEADRP C[NH+]1CCC2(CC[N@H+](C[Si](C)(C)C)C2)CC1 ZINC000878865231 590634436 /nfs/dbraw/zinc/63/44/36/590634436.db2.gz VYDJHWUGMOBRIO-UHFFFAOYSA-N 2 0 240.467 2.282 20 0 BEADRP C[N@@H+]1CCCC[C@@H]1CC[NH+]1CCC(F)CC1 ZINC000880242481 590975873 /nfs/dbraw/zinc/97/58/73/590975873.db2.gz AUBZGOKOUBFUKS-CYBMUJFWSA-N 2 0 228.355 2.295 20 0 BEADRP CC[C@@H](C)[N@@H+]1CCN(c2cc[nH+]cc2)[C@@H](C)C1 ZINC000880258903 590979428 /nfs/dbraw/zinc/97/94/28/590979428.db2.gz DTDKOFKGIJKAIV-OLZOCXBDSA-N 2 0 233.359 2.391 20 0 BEADRP CCC[N@@H+]1CCN(c2cc[nH+]cc2)[C@H](C)C1 ZINC000880262449 590980921 /nfs/dbraw/zinc/98/09/21/590980921.db2.gz ZSKBWWGAGYOBCQ-GFCCVEGCSA-N 2 0 219.332 2.002 20 0 BEADRP CC1([NH+]2CCC2)CC[NH+](CCC2CC2)CC1 ZINC000880472867 591054084 /nfs/dbraw/zinc/05/40/84/591054084.db2.gz GWLNLLPTYGGBQA-UHFFFAOYSA-N 2 0 222.376 2.347 20 0 BEADRP c1ccc2c(c1)OCC[C@@H]2[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000129046139 591224695 /nfs/dbraw/zinc/22/46/95/591224695.db2.gz YWETUUGZXQICEB-OCCSQVGLSA-N 2 0 246.354 2.242 20 0 BEADRP c1ccc2c(c1)CC[C@@H]([NH2+][C@H]1CCC[NH2+]CC1)C2 ZINC000129220994 591270489 /nfs/dbraw/zinc/27/04/89/591270489.db2.gz AESJTXFICXVWMF-JKSUJKDBSA-N 2 0 244.382 2.276 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+]C[C@H]2C=CCC2)CC1(C)C ZINC000883236706 591582586 /nfs/dbraw/zinc/58/25/86/591582586.db2.gz IWGMXYIJANPITI-QWHCGFSZSA-N 2 0 222.376 2.415 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C[C@@H]2C=CCC2)CC1(C)C ZINC000883236705 591582758 /nfs/dbraw/zinc/58/27/58/591582758.db2.gz IWGMXYIJANPITI-OLZOCXBDSA-N 2 0 222.376 2.415 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C[C@@H]2C=CCC2)[C@H]2CCC[C@@H]21 ZINC000883245586 591585855 /nfs/dbraw/zinc/58/58/55/591585855.db2.gz NYJLBENQQMZIOY-KBXIAJHMSA-N 2 0 234.387 2.415 20 0 BEADRP CCN1CC[C@H]1C[NH2+][C@H](C)CC1(OC)CCC1 ZINC000883355835 591626157 /nfs/dbraw/zinc/62/61/57/591626157.db2.gz YTBDGJJNFMCOID-OLZOCXBDSA-N 2 0 240.391 2.018 20 0 BEADRP CCN1CC[C@H]1C[NH2+][C@@H](C)CCC1CC1 ZINC000883355315 591626263 /nfs/dbraw/zinc/62/62/63/591626263.db2.gz OEQGGBSREGOLJZ-AAEUAGOBSA-N 2 0 210.365 2.249 20 0 BEADRP C[NH2+]C[C@H]1CC[N@H+](CC[C@H]2CCCC2(F)F)C1 ZINC000883416951 591652324 /nfs/dbraw/zinc/65/23/24/591652324.db2.gz JLQUAGUJSRAHJX-VXGBXAGGSA-N 2 0 246.345 2.353 20 0 BEADRP C[NH2+]C1CC[NH+](CC[C@H]2CCCC2(F)F)CC1 ZINC000883416854 591652843 /nfs/dbraw/zinc/65/28/43/591652843.db2.gz HEWGDOULUNKJOE-LLVKDONJSA-N 2 0 246.345 2.496 20 0 BEADRP C=C/C=C\CC[NH2+][C@@H]1[C@H](C)CCN[C@@H]1C ZINC000883429637 591660860 /nfs/dbraw/zinc/66/08/60/591660860.db2.gz AORYCBUOGPINEW-QUFGHOJKSA-N 2 0 208.349 2.095 20 0 BEADRP C=C/C=C\CC[N@@H+]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC000883429908 591662218 /nfs/dbraw/zinc/66/22/18/591662218.db2.gz HZRJEFBBPYKIBK-NQHOJNORSA-N 2 0 220.360 2.194 20 0 BEADRP CC1(C)CCC[C@@H](C[NH2+][C@@H]2CCCC[C@H]2[NH3+])O1 ZINC000883434600 591664537 /nfs/dbraw/zinc/66/45/37/591664537.db2.gz WNJHFIHXTBHZCH-YNEHKIRRSA-N 2 0 240.391 2.194 20 0 BEADRP CC1(C)Nc2ccccc2[C@@H]1[NH2+]C[C@H]1CC[NH2+]C1 ZINC000883462427 591674176 /nfs/dbraw/zinc/67/41/76/591674176.db2.gz QUBSCWDFJXUSDC-FZMZJTMJSA-N 2 0 245.370 2.131 20 0 BEADRP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+][C@@H]2CCCSC2)C1 ZINC000134807669 591951225 /nfs/dbraw/zinc/95/12/25/591951225.db2.gz CYTVXHVKYVZDFE-JHJVBQTASA-N 2 0 242.432 2.344 20 0 BEADRP Cc1ccncc1C[N@@H+](C)C1CCC([NH3+])CC1 ZINC000135501628 592015510 /nfs/dbraw/zinc/01/55/10/592015510.db2.gz YGJBUPKLUTVMBX-UHFFFAOYSA-N 2 0 233.359 2.092 20 0 BEADRP C[NH2+]CCC1CC[NH+](C/C=C\Cl)CC1 ZINC000216623727 592058004 /nfs/dbraw/zinc/05/80/04/592058004.db2.gz WFQJGILKURLBHD-KXFIGUGUSA-N 2 0 216.756 2.060 20 0 BEADRP CCCC[N@@H+]1CCCC[C@]2(CC[NH2+]C2)C1 ZINC000886865505 592374134 /nfs/dbraw/zinc/37/41/34/592374134.db2.gz MJZHFTUMEFQLLO-CYBMUJFWSA-N 2 0 210.365 2.252 20 0 BEADRP C[N@H+](CCCF)CCC[NH+]1CCCCC1 ZINC000887141390 592455487 /nfs/dbraw/zinc/45/54/87/592455487.db2.gz RCJASHUMGBDIMD-UHFFFAOYSA-N 2 0 216.344 2.154 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC[NH2+]C12CCC2)CC(F)F ZINC000925707238 634393206 /nfs/dbraw/zinc/39/32/06/634393206.db2.gz DPHFRXGCKSDVOH-UWVGGRQHSA-N 2 0 232.318 2.152 20 0 BEADRP [NH3+]C1C[C@H]2CCC[C@@H](C1)C2[NH2+][C@@H]1C=CCC1 ZINC000925709462 634405393 /nfs/dbraw/zinc/40/53/93/634405393.db2.gz FHNOWVKVUXLMKH-NFMDPKQHSA-N 2 0 220.360 2.201 20 0 BEADRP [NH3+]C1C[C@H]2CCC[C@@H](C1)C2[NH2+]CCc1ccoc1 ZINC000925711698 634411674 /nfs/dbraw/zinc/41/16/74/634411674.db2.gz VJBHEKAAEJXKBU-DGKWVBSXSA-N 2 0 248.370 2.318 20 0 BEADRP [NH3+]CC[C@H]1CC[N@H+](CCCc2ccccc2)C1 ZINC000125516318 634527683 /nfs/dbraw/zinc/52/76/83/634527683.db2.gz YPGOMTDNDSCHTG-HNNXBMFYSA-N 2 0 232.371 2.290 20 0 BEADRP CC[C@](C)(O)C[NH2+][C@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000093516701 634559289 /nfs/dbraw/zinc/55/92/89/634559289.db2.gz OGXKOFLCXXDOJV-RDBSUJKOSA-N 2 0 242.407 2.048 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]CC1(CC2CC2)CC1 ZINC000925732459 634574395 /nfs/dbraw/zinc/57/43/95/634574395.db2.gz BEGUKURZNOSUFY-STQMWFEESA-N 2 0 222.376 2.284 20 0 BEADRP C[C@H]([NH2+]CC1(CC2CC2)CC1)[C@H]1CCC[NH2+]1 ZINC000925732778 634577459 /nfs/dbraw/zinc/57/74/59/634577459.db2.gz CXSIDBXUQAXEGK-WCQYABFASA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H]([NH2+]CC1(CC2CC2)CC1)[C@@H]1CCC[NH2+]1 ZINC000925732775 634577485 /nfs/dbraw/zinc/57/74/85/634577485.db2.gz CXSIDBXUQAXEGK-AAEUAGOBSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CC(C)(C)CC(F)F ZINC000925734739 634584277 /nfs/dbraw/zinc/58/42/77/634584277.db2.gz UIVCKKJRYNJLIT-BDAKNGLRSA-N 2 0 222.323 2.383 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CC1(C)CC(F)(F)C1 ZINC000925733864 634582843 /nfs/dbraw/zinc/58/28/43/634582843.db2.gz LVDDKGSWUGKXRV-IUCAKERBSA-N 2 0 220.307 2.137 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CC1(C)CC(F)(F)C1 ZINC000925733863 634582953 /nfs/dbraw/zinc/58/29/53/634582953.db2.gz LVDDKGSWUGKXRV-DTWKUNHWSA-N 2 0 220.307 2.137 20 0 BEADRP C(CCC1CC1)C[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000925735680 634586323 /nfs/dbraw/zinc/58/63/23/634586323.db2.gz WLMQHIQHSHQUQM-CYBMUJFWSA-N 2 0 222.376 2.441 20 0 BEADRP CC(C)([NH3+])CC[NH2+][C@H]1CCCc2c(O)cccc21 ZINC000925736478 634589521 /nfs/dbraw/zinc/58/95/21/634589521.db2.gz AEJIMIRKCOSBBC-ZDUSSCGKSA-N 2 0 248.370 2.487 20 0 BEADRP CC(C)([NH3+])CC[NH2+][C@@H]1CCC[C@@H]2C[C@@]21C ZINC000925739360 634599796 /nfs/dbraw/zinc/59/97/96/634599796.db2.gz WHVFPVXAYIIOBU-WZRBSPASSA-N 2 0 210.365 2.282 20 0 BEADRP c1ccc([C@H]([NH2+][C@@H]2CCC[NH2+]CC2)C2CC2)nc1 ZINC000925821892 635398676 /nfs/dbraw/zinc/39/86/76/635398676.db2.gz KNTWSWLIEQYTNM-UKRRQHHQSA-N 2 0 245.370 2.264 20 0 BEADRP c1ccc([C@@H]([NH2+][C@H]2CCC[NH2+]CC2)C2CC2)nc1 ZINC000925821893 635399388 /nfs/dbraw/zinc/39/93/88/635399388.db2.gz KNTWSWLIEQYTNM-ZFWWWQNUSA-N 2 0 245.370 2.264 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CCCC[C@H]2C[NH3+])CCS1 ZINC000925860946 635555935 /nfs/dbraw/zinc/55/59/35/635555935.db2.gz MLFDHHIIDPJSML-XQHKEYJVSA-N 2 0 242.432 2.378 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[NH2+][C@@H]2CCCc3cccnc32)C1 ZINC000925881159 635607614 /nfs/dbraw/zinc/60/76/14/635607614.db2.gz YHKRHOFPHGEOKA-IACUBPJLSA-N 2 0 245.370 2.176 20 0 BEADRP Cc1ncc([C@@H](C)[NH2+]C2CCN(C)CC2)s1 ZINC000090400654 631290471 /nfs/dbraw/zinc/29/04/71/631290471.db2.gz CMYZUQIXHGQVCA-SECBINFHSA-N 2 0 239.388 2.196 20 0 BEADRP C[C@@H]1C[C@H](N(C)C/C=C\Cl)CC[N@@H+]1C ZINC000255341196 631302704 /nfs/dbraw/zinc/30/27/04/631302704.db2.gz MPBGZMLXLDAIIC-DPIUTZRQSA-N 2 0 216.756 2.153 20 0 BEADRP Cc1ccc([C@H](C)[NH2+]CCC(C)(C)[NH3+])o1 ZINC000308854655 631694726 /nfs/dbraw/zinc/69/47/26/631694726.db2.gz IDNJKYBWSGNPHG-JTQLQIEISA-N 2 0 210.321 2.366 20 0 BEADRP CCC1CC[NH+](CC[C@H]2CCC[NH2+]C2)CC1 ZINC000051919116 632013185 /nfs/dbraw/zinc/01/31/85/632013185.db2.gz JQJQUYJUIDTQEN-CQSZACIVSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@H](C[NH2+]C1[C@H](C)CC[C@H]1C)N(C)C1CC1 ZINC000924968499 635815795 /nfs/dbraw/zinc/81/57/95/635815795.db2.gz ZJNIZLLXBTVSJW-IJLUTSLNSA-N 2 0 224.392 2.493 20 0 BEADRP C[C@@H](CN1CCC[C@@H](C)C1)[NH2+][C@@H]1CC[C@H]1C ZINC000309559211 632495414 /nfs/dbraw/zinc/49/54/14/632495414.db2.gz KNCXWROZMDEORD-YIYPIFLZSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)C1(Cl)CC1 ZINC000926573780 632571246 /nfs/dbraw/zinc/57/12/46/632571246.db2.gz QBVPQSPIFUDYCR-RYUDHWBXSA-N 2 0 244.810 2.468 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000309659485 632625105 /nfs/dbraw/zinc/62/51/05/632625105.db2.gz AOOMPMSHUJRNGS-RISCZKNCSA-N 2 0 222.376 2.391 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2CCCC(C)(C)C2)CC[NH2+]1 ZINC000235367384 632680573 /nfs/dbraw/zinc/68/05/73/632680573.db2.gz VJSXXZBHWXUWCE-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1ncccc1C[N@@H+](C)C1CCC([NH3+])CC1 ZINC000310506313 632750748 /nfs/dbraw/zinc/75/07/48/632750748.db2.gz OIDDGCFBOGZEPC-UHFFFAOYSA-N 2 0 233.359 2.092 20 0 BEADRP C[C@H]1C[C@@H](C[N@@H+]2C[C@@H]3CCC[C@@H]3C2)CC[NH2+]1 ZINC000235744124 632825703 /nfs/dbraw/zinc/82/57/03/632825703.db2.gz VLRLSDLJSDDBBN-XDQVBPFNSA-N 2 0 222.376 2.106 20 0 BEADRP COc1ccc([C@H](C)[NH2+]CCC(C)(C)[NH3+])cc1 ZINC000306088104 635956423 /nfs/dbraw/zinc/95/64/23/635956423.db2.gz HXZIMAFGSISKOW-NSHDSACASA-N 2 0 236.359 2.473 20 0 BEADRP CC1(C)CCC[C@H]([NH2+]C[C@@H]2CCC[NH2+]2)C1 ZINC000232805699 636048160 /nfs/dbraw/zinc/04/81/60/636048160.db2.gz JQTDUQWIOUNOBD-RYUDHWBXSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H](CC[NH2+][C@H](C)C1CC(F)(F)C1)[NH+](C)C ZINC000895291030 636131619 /nfs/dbraw/zinc/13/16/19/636131619.db2.gz YQDMKQXVHUGFLS-NXEZZACHSA-N 2 0 234.334 2.350 20 0 BEADRP Cc1ccc(CC[NH2+]CC[C@@H](C)[NH+](C)C)cc1 ZINC000895291922 636131992 /nfs/dbraw/zinc/13/19/92/636131992.db2.gz KFTRKMZDUMGEJS-CQSZACIVSA-N 2 0 234.387 2.467 20 0 BEADRP [NH3+]CCCCCC[NH2+]Cc1cccs1 ZINC000040397564 633750326 /nfs/dbraw/zinc/75/03/26/633750326.db2.gz XJTABWLMSCWILV-UHFFFAOYSA-N 2 0 212.362 2.357 20 0 BEADRP CC(C)CC[C@H](C)[NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2 ZINC000328466393 633768335 /nfs/dbraw/zinc/76/83/35/633768335.db2.gz XIIMRIUWHVZLDD-UQGHGMQMSA-N 2 0 236.403 2.397 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32 ZINC000328566133 633775504 /nfs/dbraw/zinc/77/55/04/633775504.db2.gz MKQBBMCWFBZSNM-CLSQCYNNSA-N 2 0 222.376 2.007 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1CC[C@]2(C1)CCC[NH+](C)C2 ZINC000930578246 633906311 /nfs/dbraw/zinc/90/63/11/633906311.db2.gz RIZHGHPTWINCNL-QLFBSQMISA-N 2 0 236.403 2.450 20 0 BEADRP CC1(C[NH2+][C@@H]2C[C@H]([NH3+])CC(C)(C)C2)CC1 ZINC000925576694 634076845 /nfs/dbraw/zinc/07/68/45/634076845.db2.gz MBCLOXREKHVDET-WDEREUQCSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)C1(C[NH2+][C@H]2CC[NH2+]C2(C)C)CC1 ZINC000925579630 634080674 /nfs/dbraw/zinc/08/06/74/634080674.db2.gz NBGLERJNHTUXBK-NSHDSACASA-N 2 0 210.365 2.153 20 0 BEADRP CO[C@@H](C)C[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000925646301 634203296 /nfs/dbraw/zinc/20/32/96/634203296.db2.gz UWMOGFHKICNCJL-JSGCOSHPSA-N 2 0 236.359 2.091 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+][C@@H]2CC[NH2+]C2(C)C)C1 ZINC000925664289 634235684 /nfs/dbraw/zinc/23/56/84/634235684.db2.gz XVINGDRHRKFTCN-GRYCIOLGSA-N 2 0 210.365 2.153 20 0 BEADRP FC1(F)CC(C[NH2+][C@H]2CC[NH2+]C23CCCC3)C1 ZINC000925672552 634259317 /nfs/dbraw/zinc/25/93/17/634259317.db2.gz IDJHBCGVWIIAJC-NSHDSACASA-N 2 0 244.329 2.296 20 0 BEADRP FCCCC[NH2+][C@@H]1CC[NH2+]C[C@H]1C1CCCC1 ZINC000925677635 634270589 /nfs/dbraw/zinc/27/05/89/634270589.db2.gz XFPHPFIXFLSYBI-UONOGXRCSA-N 2 0 242.382 2.494 20 0 BEADRP CCC1([NH2+][C@@H]2C[C@H]([NH3+])CC(C)(C)C2)CC1 ZINC000925681347 634280062 /nfs/dbraw/zinc/28/00/62/634280062.db2.gz XGDLPOQJQDCATH-WDEREUQCSA-N 2 0 210.365 2.425 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)C12CCC2 ZINC000925686910 634299006 /nfs/dbraw/zinc/29/90/06/634299006.db2.gz XNFASBSKGYGBIK-NZEXEKPDSA-N 2 0 220.360 2.035 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@H]([NH3+])CC(C)(C)C2)CS1 ZINC000925697065 634359335 /nfs/dbraw/zinc/35/93/35/634359335.db2.gz MJXVSZGAXTYEFO-KXNHARMFSA-N 2 0 242.432 2.376 20 0 BEADRP Cc1cccc(C[NH2+]CCC(C)(C)[NH3+])c1 ZINC000258847530 635212872 /nfs/dbraw/zinc/21/28/72/635212872.db2.gz HLRHGFXBXYOPKX-UHFFFAOYSA-N 2 0 206.333 2.212 20 0 BEADRP C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000925772529 635213744 /nfs/dbraw/zinc/21/37/44/635213744.db2.gz IKFQXXZRABMWBB-RKQHYHRCSA-N 2 0 234.387 2.153 20 0 BEADRP [NH3+]C1(C[NH2+]Cc2cccc3ccccc32)CC1 ZINC000259091739 635239557 /nfs/dbraw/zinc/23/95/57/635239557.db2.gz NRDOEKIJNIZPTM-UHFFFAOYSA-N 2 0 226.323 2.421 20 0 BEADRP C[C@@H](C1CC1)[NH+]1CCC(C)([NH+]2CCC2)CC1 ZINC000931700921 635252324 /nfs/dbraw/zinc/25/23/24/635252324.db2.gz SJFOODGKXLXEAE-LBPRGKRZSA-N 2 0 222.376 2.345 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[NH2+]C[C@H]1C)[C@H]1CCCC[C@H]1C ZINC000925783648 635291649 /nfs/dbraw/zinc/29/16/49/635291649.db2.gz KOCIZMIMSLXSNA-PEBLQZBPSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+][C@@H]1C[C@H](C)CC[C@H]1C ZINC000925784356 635298050 /nfs/dbraw/zinc/29/80/50/635298050.db2.gz MTVCTSZYMIHUEO-SYLRKERUSA-N 2 0 210.365 2.009 20 0 BEADRP CC[C@H]([NH2+]CC[C@@H]1C[NH2+]C[C@H]1C)C1CC1 ZINC000925802158 635350197 /nfs/dbraw/zinc/35/01/97/635350197.db2.gz XXKZMBNPTQPBIO-RTXFEEFZSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CC[C@@H]1C[C@H]1C1CC1 ZINC000925803520 635354310 /nfs/dbraw/zinc/35/43/10/635354310.db2.gz ZKBWVPGRPFFGIF-WFFHOREQSA-N 2 0 210.365 2.138 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]CC[C@@H]1C[NH2+]C[C@H]1C ZINC000925803825 635355609 /nfs/dbraw/zinc/35/56/09/635355609.db2.gz VZJOLUCHMYRHFO-LPWJVIDDSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@H]1C[N@H+](CCCCCCC[NH3+])[C@@H](C)CO1 ZINC000223221921 635363810 /nfs/dbraw/zinc/36/38/10/635363810.db2.gz DVTBGNYSBNZVBI-STQMWFEESA-N 2 0 228.380 2.005 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+][C@H]2CCCOCC2)c2ccccc21 ZINC000261555000 635496941 /nfs/dbraw/zinc/49/69/41/635496941.db2.gz BEQSXUGPDHYSOC-NILFDRSVSA-N 2 0 246.354 2.290 20 0 BEADRP C[N@@H+]1C[C@@H]2C[NH+](C[C@H]3CC=CCC3)C[C@]2(C)C1 ZINC000897621940 636827989 /nfs/dbraw/zinc/82/79/89/636827989.db2.gz ZTRUHFCIUVKKDK-ZNMIVQPWSA-N 2 0 234.387 2.226 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]Cc2cccc(F)c2)C1 ZINC000086402575 636886376 /nfs/dbraw/zinc/88/63/76/636886376.db2.gz HLGJHGLYWZBHLJ-STQMWFEESA-N 2 0 222.307 2.185 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+]Cc1ccc(F)cc1 ZINC000089139597 636904814 /nfs/dbraw/zinc/90/48/14/636904814.db2.gz YXLYJNRXNWEPQH-TZMCWYRMSA-N 2 0 236.334 2.433 20 0 BEADRP CCCCCC[N@@H+]1CCC[C@@H](C[NH2+]C)C1 ZINC000041043328 636954594 /nfs/dbraw/zinc/95/45/94/636954594.db2.gz MDXOIWYAGHUEKA-ZDUSSCGKSA-N 2 0 212.381 2.498 20 0 BEADRP C1=C[C@@H]2CC[C@H]1C[C@H]2[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000924650070 636973545 /nfs/dbraw/zinc/97/35/45/636973545.db2.gz POUNTDNKBLZQFX-TTZDDIAXSA-N 2 0 246.398 2.415 20 0 BEADRP CCC1CC[NH+](C[C@H]2CCC[NH2+]C2)CC1 ZINC000042447392 637256658 /nfs/dbraw/zinc/25/66/58/637256658.db2.gz XRDMOLNXFUOKRP-ZDUSSCGKSA-N 2 0 210.365 2.108 20 0 BEADRP CC1(C)C[C@H]1C[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000902363309 637297992 /nfs/dbraw/zinc/29/79/92/637297992.db2.gz KUBYCEHYNWQBHS-NWDGAFQWSA-N 2 0 224.392 2.400 20 0 BEADRP CC1(C)C[C@H]1C[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000902363311 637300038 /nfs/dbraw/zinc/30/00/38/637300038.db2.gz KUBYCEHYNWQBHS-RYUDHWBXSA-N 2 0 224.392 2.400 20 0 BEADRP C[NH2+]C[C@@H]1CCCCN1CCCc1ccncc1 ZINC000903529150 637367784 /nfs/dbraw/zinc/36/77/84/637367784.db2.gz LNXUHGLSSOVXTN-HNNXBMFYSA-N 2 0 247.386 2.088 20 0 BEADRP C[C@]12C[N@H+](C[C@H]3C[C@@H]([NH3+])C3)C[C@H]1[C@H]1CC[C@@H]2C1 ZINC000904462490 637405901 /nfs/dbraw/zinc/40/59/01/637405901.db2.gz KMVCDOQGPGXLEF-JRULLXGZSA-N 2 0 234.387 2.092 20 0 BEADRP CC[C@H](C[NH2+]CC1([NH3+])CC1)c1ccccc1 ZINC000904450347 637417555 /nfs/dbraw/zinc/41/75/55/637417555.db2.gz PKUCKHBCNRUJSB-GFCCVEGCSA-N 2 0 218.344 2.261 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CC[NH2+][C@H](C)C1)c1cncs1 ZINC000904468359 637423662 /nfs/dbraw/zinc/42/36/62/637423662.db2.gz AKEAXSQEHSGJIZ-GMTAPVOTSA-N 2 0 239.388 2.182 20 0 BEADRP CC(C)([NH3+])c1ccc(N[C@@H]2CCC[NH2+]CC2)cc1 ZINC000904476266 637425008 /nfs/dbraw/zinc/42/50/08/637425008.db2.gz PDMWZZXBFXNVBB-CYBMUJFWSA-N 2 0 247.386 2.434 20 0 BEADRP CC(C)([NH3+])c1ccc(NC2CC(C[NH3+])C2)cc1 ZINC000904477420 637427595 /nfs/dbraw/zinc/42/75/95/637427595.db2.gz WCMUNARGKQLXJI-UHFFFAOYSA-N 2 0 233.359 2.030 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]Cc2csc3ccccc23)C1 ZINC000906508584 638181464 /nfs/dbraw/zinc/18/14/64/638181464.db2.gz QQWINBOQPRCADM-XYPYZODXSA-N 2 0 232.352 2.481 20 0 BEADRP CC[C@@H]1CCC[C@H](C[NH2+]C2CC([NH3+])C2)C1 ZINC000906510158 638183942 /nfs/dbraw/zinc/18/39/42/638183942.db2.gz OKGWCNLKCSITTF-IALDZJHCSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)Oc1ccc(C[NH2+]C2CC([NH3+])C2)cc1 ZINC000906510782 638183970 /nfs/dbraw/zinc/18/39/70/638183970.db2.gz WWEFBDYTKPETQH-UHFFFAOYSA-N 2 0 234.343 2.053 20 0 BEADRP CC[C@H]1CCC[C@@H](C[NH2+]C2CC([NH3+])C2)C1 ZINC000906510160 638183990 /nfs/dbraw/zinc/18/39/90/638183990.db2.gz OKGWCNLKCSITTF-ZFDZMSFRSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+]C1CC([NH2+]C/C=C/c2ccc(F)cc2F)C1 ZINC000906510710 638184426 /nfs/dbraw/zinc/18/44/26/638184426.db2.gz RVKQAIGPFPXGOV-OWOJBTEDSA-N 2 0 238.281 2.057 20 0 BEADRP CCCc1cccc(C[NH2+][C@H]2C[C@H]([NH3+])C2)c1 ZINC000906518407 638188202 /nfs/dbraw/zinc/18/82/02/638188202.db2.gz YLZFABUZNVFLFB-HDJSIYSDSA-N 2 0 218.344 2.218 20 0 BEADRP CCCC[NH2+]CC1(C[NH+](C)C)CCCC1 ZINC000906527964 638193012 /nfs/dbraw/zinc/19/30/12/638193012.db2.gz PCLZGXLHEOHHSR-UHFFFAOYSA-N 2 0 212.381 2.498 20 0 BEADRP CC1CC(C[N@@H+]2CCC[C@]3(CC[NH+](C)C3)C2)C1 ZINC000930601384 639817172 /nfs/dbraw/zinc/81/71/72/639817172.db2.gz HFPMLQFOZNOOPT-YMAMQOFZSA-N 2 0 236.403 2.450 20 0 BEADRP C[C@H](C1CC1)[N@@H+]1CCC[C@@]2(CC[NH+](C)C2)C1 ZINC000930602257 639817644 /nfs/dbraw/zinc/81/76/44/639817644.db2.gz OLYWYGRYUYLNBP-OCCSQVGLSA-N 2 0 222.376 2.203 20 0 BEADRP C[C@H](C1CC1)[N@@H+]1CCCN(c2cc[nH+]cc2)CC1 ZINC000930805015 639911008 /nfs/dbraw/zinc/91/10/08/639911008.db2.gz NLQPZCOVEQODIT-CYBMUJFWSA-N 2 0 245.370 2.392 20 0 BEADRP C[C@H](c1cccnc1)[N@@H+]1C[C@@H]2CC[NH+](C)C[C@@H]2C1 ZINC000931433428 640202735 /nfs/dbraw/zinc/20/27/35/640202735.db2.gz BOAKPLVMAMDKDZ-VHDGCEQUSA-N 2 0 245.370 2.026 20 0 BEADRP C[N@@H+]1CC[C@@H]2C[NH+](CCC3CCCC3)C[C@@H]2C1 ZINC000931436939 640203394 /nfs/dbraw/zinc/20/33/94/640203394.db2.gz VMWREQAFAJXSSB-CABCVRRESA-N 2 0 236.403 2.450 20 0 BEADRP C[N@@H+]1CC[C@@H]2C[NH+](CCCC3CCC3)C[C@@H]2C1 ZINC000931441449 640207168 /nfs/dbraw/zinc/20/71/68/640207168.db2.gz IPXJCJBCLJSJAH-CABCVRRESA-N 2 0 236.403 2.450 20 0 BEADRP C[N@@H+]1CC[C@@H]2C[NH+](C[C@@H]3CC[C@@H]4C[C@@H]4C3)C[C@@H]2C1 ZINC000931441416 640207834 /nfs/dbraw/zinc/20/78/34/640207834.db2.gz HQTCRPQVXYEJBX-SUJAAXHWSA-N 2 0 248.414 2.306 20 0 BEADRP CCCCCC[NH2+]CC1CC[NH+](C)CC1 ZINC000044515193 640399514 /nfs/dbraw/zinc/39/95/14/640399514.db2.gz DEHZWXSRLQCRHL-UHFFFAOYSA-N 2 0 212.381 2.498 20 0 BEADRP CCSCCC[NH2+]CC1CC[NH+](C)CC1 ZINC000164021433 640436939 /nfs/dbraw/zinc/43/69/39/640436939.db2.gz PMDXGGBLRKPWBH-UHFFFAOYSA-N 2 0 230.421 2.061 20 0 BEADRP C[NH+]1CCC(C[NH2+]CCCC2CC2)CC1 ZINC000156885604 640516454 /nfs/dbraw/zinc/51/64/54/640516454.db2.gz FFYADFGRHUGRFV-UHFFFAOYSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@H+](C)[C@@H]1CCCC[C@@H]1C ZINC000223932914 640594025 /nfs/dbraw/zinc/59/40/25/640594025.db2.gz OCIMHMAJFFCUSX-RFQIPJPRSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH+]1[C@@H](C)CCC[C@@H]1C ZINC000223930639 640594197 /nfs/dbraw/zinc/59/41/97/640594197.db2.gz QEQLTEPAJONUCC-VOAKCMCISA-N 2 0 210.365 2.105 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CC(C)(C)SC)[C@@H](C)C1 ZINC000224403054 640615427 /nfs/dbraw/zinc/61/54/27/640615427.db2.gz GREXUTXZCBMEMX-NWDGAFQWSA-N 2 0 244.448 2.448 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@@H+]1CC[C@@H]2CCCC[C@@H]21 ZINC000226592279 640779216 /nfs/dbraw/zinc/77/92/16/640779216.db2.gz OJQJDQXGRIUKTB-RFGFWPKPSA-N 2 0 222.376 2.106 20 0 BEADRP C[C@H]1CCC[N@H+](C[C@@H]2CC[C@H]([NH3+])C2)[C@H]1C ZINC000717951702 711492802 /nfs/dbraw/zinc/49/28/02/711492802.db2.gz JDPFGPJVSKQTER-RVMXOQNASA-N 2 0 210.365 2.234 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@@H]2CCc3cccnc32)CC1 ZINC000226817614 640793319 /nfs/dbraw/zinc/79/33/19/640793319.db2.gz ZRIPVUOOQUTKKP-CQSZACIVSA-N 2 0 245.370 2.000 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@H]2CCc3cccnc32)CC1 ZINC000226817621 640793783 /nfs/dbraw/zinc/79/37/83/640793783.db2.gz ZRIPVUOOQUTKKP-AWEZNQCLSA-N 2 0 245.370 2.000 20 0 BEADRP C([C@H]1CCC[NH2+]1)[N@@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC000227167771 640816494 /nfs/dbraw/zinc/81/64/94/640816494.db2.gz FCBHVLLQMLDUJW-XQQFMLRXSA-N 2 0 208.349 2.003 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@H](C)[C@@H](C[NH3+])C2)cc1 ZINC000229064979 640919756 /nfs/dbraw/zinc/91/97/56/640919756.db2.gz HGWYNHIXNXPMCB-ZFWWWQNUSA-N 2 0 232.371 2.412 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]C[C@@H]2CCC[NH2+]C2)[C@@H]1C ZINC000087646083 640954751 /nfs/dbraw/zinc/95/47/51/640954751.db2.gz BIEZVYUKOWKDJY-SYQHCUMBSA-N 2 0 224.392 2.400 20 0 BEADRP Cc1nc(C)c([C@H](C)[NH2+]C[C@H]2CC[NH2+]C2)s1 ZINC000062117086 641023740 /nfs/dbraw/zinc/02/37/40/641023740.db2.gz DJHBSPROLIXLDI-KWQFWETISA-N 2 0 239.388 2.020 20 0 BEADRP C[C@@H]1CC[C@@H](C[NH2+][C@@H]2CCC[NH2+]CC2)C1 ZINC000230412216 641053090 /nfs/dbraw/zinc/05/30/90/641053090.db2.gz KZYQOWMVQMICMK-JHJVBQTASA-N 2 0 210.365 2.154 20 0 BEADRP CCC[NH+](CCC)C[C@]1(C)CCC[NH2+]C1 ZINC000062861667 641100750 /nfs/dbraw/zinc/10/07/50/641100750.db2.gz PXKPUKPXBBFZCB-CYBMUJFWSA-N 2 0 212.381 2.498 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]CCSC(F)(F)F)C1 ZINC000231937999 641216699 /nfs/dbraw/zinc/21/66/99/641216699.db2.gz DQKBVOCMSUDGCY-HTQZYQBOSA-N 2 0 242.310 2.099 20 0 BEADRP CC[NH+](CC)CCC[NH2+]C(C)(C)CSC ZINC000934666227 641223203 /nfs/dbraw/zinc/22/32/03/641223203.db2.gz DYFWBVFWUSEEIS-UHFFFAOYSA-N 2 0 232.437 2.450 20 0 BEADRP COc1ccc(C[NH2+][C@@H]2CCCC[C@@H]2C[NH3+])cc1 ZINC000089139321 641464197 /nfs/dbraw/zinc/46/41/97/641464197.db2.gz QWIFDXBIIXHNKU-UKRRQHHQSA-N 2 0 248.370 2.302 20 0 BEADRP CC[C@H]1CO[C@@H](C)C[N@@H+]1CCCCCC[NH3+] ZINC000042452031 641552092 /nfs/dbraw/zinc/55/20/92/641552092.db2.gz VJAPJVZTJPQNLF-STQMWFEESA-N 2 0 228.380 2.005 20 0 BEADRP CC1CC(C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C)C2)C1 ZINC000929847634 641762282 /nfs/dbraw/zinc/76/22/82/641762282.db2.gz MPNVKGIDIYDWBA-PFSRBDOWSA-N 2 0 236.403 2.449 20 0 BEADRP CCCC[NH2+]Cc1ccc(-n2ccnc2C)nc1 ZINC000916838426 641981101 /nfs/dbraw/zinc/98/11/01/641981101.db2.gz BVRFFWRSMYBBQV-UHFFFAOYSA-N 2 0 244.342 2.465 20 0 BEADRP CSC(C)(C)C[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000154214930 641981916 /nfs/dbraw/zinc/98/19/16/641981916.db2.gz LFTDLDLMKHMDRY-GHMZBOCLSA-N 2 0 230.421 2.200 20 0 BEADRP CSC(C)(C)C[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000154318199 642028631 /nfs/dbraw/zinc/02/86/31/642028631.db2.gz IGAVABVHKXGNTE-NSHDSACASA-N 2 0 244.448 2.448 20 0 BEADRP CC1(C[NH2+][C@H]2CCCC[C@H]2C[NH3+])CCC1 ZINC000233027955 642645618 /nfs/dbraw/zinc/64/56/18/642645618.db2.gz WEZYVDQDMLRODJ-RYUDHWBXSA-N 2 0 210.365 2.284 20 0 BEADRP CCCC1(C[NH2+][C@@H]2CCC[NH2+]CC2)CC1 ZINC000233034218 642646699 /nfs/dbraw/zinc/64/66/99/642646699.db2.gz DMVPVXCRTHKPAO-GFCCVEGCSA-N 2 0 210.365 2.298 20 0 BEADRP CC[N@@H+](Cc1ccccc1)C[C@@H]1C[NH2+]C[C@H]1C ZINC000233486912 642674100 /nfs/dbraw/zinc/67/41/00/642674100.db2.gz LGCCPDONUZMKQH-HIFRSBDPSA-N 2 0 232.371 2.364 20 0 BEADRP CC[C@@H](C)C[N@H+](CC)C[C@@H]1C[NH2+]C[C@H]1C ZINC000233826016 642699428 /nfs/dbraw/zinc/69/94/28/642699428.db2.gz YLWOODJKQSKPET-UPJWGTAASA-N 2 0 212.381 2.210 20 0 BEADRP C[C@@H]1C[NH+](C[C@]2(C)CCC[NH2+]C2)C[C@@H](C)S1 ZINC000069910103 642933585 /nfs/dbraw/zinc/93/35/85/642933585.db2.gz WCFJTWBLMOOWIT-JHJVBQTASA-N 2 0 242.432 2.202 20 0 BEADRP C(CC1CCC1)[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000090233284 643077941 /nfs/dbraw/zinc/07/79/41/643077941.db2.gz NVQOWWBZIZOMPD-ZIAGYGMSSA-N 2 0 222.376 2.393 20 0 BEADRP CC[C@@H]1C[C@H](C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)CCO1 ZINC000414910527 643085525 /nfs/dbraw/zinc/08/55/25/643085525.db2.gz DBWJVNFIWZCMPH-YIYPIFLZSA-N 2 0 240.391 2.051 20 0 BEADRP CC[C@H]1COCC[N@@H+]1CCCCCCC[NH3+] ZINC000036326907 643144386 /nfs/dbraw/zinc/14/43/86/643144386.db2.gz VFHNVMZAAANIAZ-ZDUSSCGKSA-N 2 0 228.380 2.006 20 0 BEADRP CC[C@@H]1COCC[N@@H+]1CCCCCCC[NH3+] ZINC000036326905 643145934 /nfs/dbraw/zinc/14/59/34/643145934.db2.gz VFHNVMZAAANIAZ-CYBMUJFWSA-N 2 0 228.380 2.006 20 0 BEADRP CSCCCC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000183863946 643175325 /nfs/dbraw/zinc/17/53/25/643175325.db2.gz REDXGXCLXMSBSR-YHWZYXNKSA-N 2 0 242.432 2.344 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1CN(C)Cc1ccsc1 ZINC000082560410 643342938 /nfs/dbraw/zinc/34/29/38/643342938.db2.gz MVSQFOWOHYXAIB-PWSUYJOCSA-N 2 0 224.373 2.035 20 0 BEADRP Cc1ncsc1C[N@H+](C)CCCCCC[NH3+] ZINC000082633723 643357437 /nfs/dbraw/zinc/35/74/37/643357437.db2.gz RGWQUOCQSDRYNY-UHFFFAOYSA-N 2 0 241.404 2.402 20 0 BEADRP CC(C)C[N@H+](C[C@@H]1C[NH2+]C[C@H]1C)C(C)C ZINC000082560736 643513113 /nfs/dbraw/zinc/51/31/13/643513113.db2.gz FJXSHXVXGWUGHI-OLZOCXBDSA-N 2 0 212.381 2.208 20 0 BEADRP C[C@@H]1C[NH+](CCCCCCC[NH3+])C[C@H]1C ZINC000086015353 643629762 /nfs/dbraw/zinc/62/97/62/643629762.db2.gz GFBFXYKTJXXZPH-CHWSQXEVSA-N 2 0 212.381 2.483 20 0 BEADRP C[C@@H]1CC[C@@H](C)[N@H+](CCC[NH2+]C2CC2)C1 ZINC000084046567 643642955 /nfs/dbraw/zinc/64/29/55/643642955.db2.gz MXNKIBCQPHNFAG-VXGBXAGGSA-N 2 0 210.365 2.249 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]CCc1ccsc1 ZINC000084216482 643651371 /nfs/dbraw/zinc/65/13/71/643651371.db2.gz DKIKJVKJVORTIV-STQMWFEESA-N 2 0 238.400 2.398 20 0 BEADRP C[NH2+]CCC[N@H+](C)[C@@H]1C[C@@H]1c1ccccc1 ZINC000846222427 643651917 /nfs/dbraw/zinc/65/19/17/643651917.db2.gz OIEXAJXZUMXAEG-ZIAGYGMSSA-N 2 0 218.344 2.084 20 0 BEADRP CC[C@H](c1ccccc1)[N@@H+]1CC[C@H](C[NH3+])C1 ZINC000050245129 643656659 /nfs/dbraw/zinc/65/66/59/643656659.db2.gz DQIKBATVYWXJMY-TZMCWYRMSA-N 2 0 218.344 2.418 20 0 BEADRP C[C@H](C[N@@H+]1CC[C@H](C[NH3+])C1)c1ccccc1 ZINC000050245505 643662056 /nfs/dbraw/zinc/66/20/56/643662056.db2.gz AXCCSGLZYHMTOD-CHWSQXEVSA-N 2 0 218.344 2.071 20 0 BEADRP C[C@H]1CCC[C@H](C)[NH+]1C[C@@H]1CC[C@H]([NH3+])C1 ZINC000085014432 643680779 /nfs/dbraw/zinc/68/07/79/643680779.db2.gz URFQBDLLKUTDQI-RVMXOQNASA-N 2 0 210.365 2.377 20 0 BEADRP CC(C)[C@@H]1CCC[N@@H+]1CC[C@H]1CCC[NH2+]C1 ZINC000251451262 643802467 /nfs/dbraw/zinc/80/24/67/643802467.db2.gz XDVGEVPANYXWQM-KGLIPLIRSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000086401993 644130525 /nfs/dbraw/zinc/13/05/25/644130525.db2.gz PNVTXFIWCYSUKC-XQHKEYJVSA-N 2 0 210.365 2.425 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+]C[C@@H]2CCC=CO2)C1 ZINC000194261423 644311896 /nfs/dbraw/zinc/31/18/96/644311896.db2.gz SGNLVVLKHPCFDX-KGLIPLIRSA-N 2 0 238.375 2.001 20 0 BEADRP CCCCCC[C@H](O)C[N@H+](C)CC(C)(C)C[NH3+] ZINC000923294801 644331686 /nfs/dbraw/zinc/33/16/86/644331686.db2.gz QARUHDPJBQURNT-ZDUSSCGKSA-N 2 0 244.423 2.234 20 0 BEADRP C(C[NH2+]C1CC1)C[N@@H+]1CCC[C@@H]2CCC[C@H]21 ZINC000083700365 644406917 /nfs/dbraw/zinc/40/69/17/644406917.db2.gz SAQRORBVPUHVOC-GXTWGEPZSA-N 2 0 222.376 2.393 20 0 BEADRP Cc1ccc([C@H](C)[NH2+][C@H]2CCC[C@@H]2C[NH3+])o1 ZINC000084219228 644420645 /nfs/dbraw/zinc/42/06/45/644420645.db2.gz DXXSUNNSNXKZDW-TUAOUCFPSA-N 2 0 222.332 2.366 20 0 BEADRP C[C@H]1C[N@H+](CCCCCF)CC[C@@H]1C[NH3+] ZINC000923495299 644463239 /nfs/dbraw/zinc/46/32/39/644463239.db2.gz BGEOUJUQBIWVCF-NWDGAFQWSA-N 2 0 216.344 2.043 20 0 BEADRP C[C@H]1C[N@H+](CCCC(C)(F)F)CC[C@@H]1C[NH3+] ZINC000923490525 644464505 /nfs/dbraw/zinc/46/45/05/644464505.db2.gz DFJJVZFHTRINEH-WDEREUQCSA-N 2 0 234.334 2.339 20 0 BEADRP CCc1ccc(CC[N@@H+]2CC[C@@H](CC[NH3+])C2)cc1 ZINC000923491202 644464740 /nfs/dbraw/zinc/46/47/40/644464740.db2.gz KZSAVEMTYYHFEX-MRXNPFEDSA-N 2 0 246.398 2.462 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[NH2+]C1)C1CCCCC1 ZINC000086729799 644471060 /nfs/dbraw/zinc/47/10/60/644471060.db2.gz OYFNLPWBFHJAMN-OLZOCXBDSA-N 2 0 210.365 2.297 20 0 BEADRP Cc1cccc(C[N@@H+]2CC[C@@H](C[NH3+])[C@@H](C)C2)c1 ZINC000923498724 644472699 /nfs/dbraw/zinc/47/26/99/644472699.db2.gz JJDHUWYLLHNXIQ-ZFWWWQNUSA-N 2 0 232.371 2.412 20 0 BEADRP COc1cccc(C[N@@H+]2CC[C@H](C[NH3+])[C@@H](C)C2)c1 ZINC000923498549 644473155 /nfs/dbraw/zinc/47/31/55/644473155.db2.gz OTXWEAPOSASSOA-GXTWGEPZSA-N 2 0 248.370 2.112 20 0 BEADRP COc1ccc(C[N@@H+]2CC[C@H](C[NH3+])[C@@H](C)C2)cc1 ZINC000923499597 644473468 /nfs/dbraw/zinc/47/34/68/644473468.db2.gz TWWMEEUONJVDHO-GXTWGEPZSA-N 2 0 248.370 2.112 20 0 BEADRP Cc1ccc(CC[N@@H+]2CC[C@@H](C[NH3+])[C@@H](C)C2)cc1 ZINC000923498337 644473610 /nfs/dbraw/zinc/47/36/10/644473610.db2.gz OEQOSNWYPHSVLZ-HOCLYGCPSA-N 2 0 246.398 2.454 20 0 BEADRP C[C@H]1C[N@H+](Cc2cccc(F)c2)CC[C@@H]1C[NH3+] ZINC000923498340 644473622 /nfs/dbraw/zinc/47/36/22/644473622.db2.gz HICJHAOKZXJCIE-WCQYABFASA-N 2 0 236.334 2.242 20 0 BEADRP C[C@@H]1C[N@H+](Cc2ccccc2F)CC[C@H]1C[NH3+] ZINC000923504200 644475174 /nfs/dbraw/zinc/47/51/74/644475174.db2.gz PWNHQOLPDZCBNO-NEPJUHHUSA-N 2 0 236.334 2.242 20 0 BEADRP C[C@H]1C[N@H+](Cc2ccc(F)cc2)CC[C@H]1C[NH3+] ZINC000923503677 644476992 /nfs/dbraw/zinc/47/69/92/644476992.db2.gz KTUJCNZISMZDIP-AAEUAGOBSA-N 2 0 236.334 2.242 20 0 BEADRP C[C@H]1C[N@H+](Cc2ccc(F)cc2)CC[C@@H]1C[NH3+] ZINC000923503679 644477776 /nfs/dbraw/zinc/47/77/76/644477776.db2.gz KTUJCNZISMZDIP-WCQYABFASA-N 2 0 236.334 2.242 20 0 BEADRP Cc1cc(C)cc(C[N@@H+]2C[C@@H]3CC[NH2+]C[C@@H]3C2)c1 ZINC000923521428 644482567 /nfs/dbraw/zinc/48/25/67/644482567.db2.gz UAEUXYYFTDKJAN-JKSUJKDBSA-N 2 0 244.382 2.345 20 0 BEADRP CC[C@@H](C)C[N@@H+]1CC[C@]2(C1)CCCC[NH2+]2 ZINC000923534210 644490630 /nfs/dbraw/zinc/49/06/30/644490630.db2.gz RNVGWFNPDIKXFZ-OLZOCXBDSA-N 2 0 210.365 2.251 20 0 BEADRP C[NH2+]CCC[N@H+](CCc1ccccc1)C1CC1 ZINC000923554727 644498729 /nfs/dbraw/zinc/49/87/29/644498729.db2.gz OPDCCAGEUMJCEC-UHFFFAOYSA-N 2 0 232.371 2.303 20 0 BEADRP Cc1cccc(C[N@H+](C)CC[C@H]2CC[NH2+]C2)c1 ZINC000089749186 644565464 /nfs/dbraw/zinc/56/54/64/644565464.db2.gz UBJLARHAKPHPCW-CQSZACIVSA-N 2 0 232.371 2.426 20 0 BEADRP C[N@H+](CC1CC[NH+](C)CC1)CC(C)(C)C ZINC000093089346 644676400 /nfs/dbraw/zinc/67/64/00/644676400.db2.gz PKELQJILPSZPIT-UHFFFAOYSA-N 2 0 212.381 2.306 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+]C[C@H]2CCC=CO2)C1 ZINC000249035451 644709573 /nfs/dbraw/zinc/70/95/73/644709573.db2.gz SGNLVVLKHPCFDX-ZIAGYGMSSA-N 2 0 238.375 2.001 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+][C@H]1CCc2ccccc21 ZINC000250851436 644784055 /nfs/dbraw/zinc/78/40/55/644784055.db2.gz MAZDANFVIUBXLZ-CFVMTHIKSA-N 2 0 230.355 2.391 20 0 BEADRP C[C@@H]1C[C@@H](C)C[NH+](CC[C@H]2CCC[NH2+]C2)C1 ZINC000251764407 644820106 /nfs/dbraw/zinc/82/01/06/644820106.db2.gz DTTPXXKDUUTOLF-MGPQQGTHSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H]1C[N@H+](CCc2cccc(F)c2)CC[C@H]1[NH3+] ZINC000251913655 644830966 /nfs/dbraw/zinc/83/09/66/644830966.db2.gz XJIIIDAGCBVIMP-BXUZGUMPSA-N 2 0 236.334 2.037 20 0 BEADRP C[NH+](C)CC(C)(C)C[NH2+][C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000304577189 644917979 /nfs/dbraw/zinc/91/79/79/644917979.db2.gz NMFYGGCVCSODGM-FRRDWIJNSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@]2(C)CCC[NH2+]C2)C[C@H]1C ZINC000253068704 644933584 /nfs/dbraw/zinc/93/35/84/644933584.db2.gz KZPNGGIIRSSJII-MGPQQGTHSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H](c1ccccn1)[N@@H+]1CC[C@@H](C)[C@H](C[NH3+])C1 ZINC000253193905 644944172 /nfs/dbraw/zinc/94/41/72/644944172.db2.gz PGNPCXMABTXDFZ-FRRDWIJNSA-N 2 0 233.359 2.059 20 0 BEADRP C([NH2+][C@H]1CC[NH2+]C12CCCC2)C1CCCC1 ZINC000843129001 645266337 /nfs/dbraw/zinc/26/63/37/645266337.db2.gz ODOYMBZLWWQENO-ZDUSSCGKSA-N 2 0 222.376 2.441 20 0 BEADRP C[C@H]([NH2+]CC[C@]1(C)C[C@]1(F)Cl)[C@@H]1CCC[NH2+]1 ZINC000844923179 645348304 /nfs/dbraw/zinc/34/83/04/645348304.db2.gz HZGMRXOLAPWDPY-NNYUYHANSA-N 2 0 248.773 2.421 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@]2(C)CCCCO2)CC1 ZINC000927025978 645525963 /nfs/dbraw/zinc/52/59/63/645525963.db2.gz ZIXSPFBBDBONCI-AWEZNQCLSA-N 2 0 240.391 2.020 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]C[C@]23C[C@H]2CCC3)[C@@H](C)C1 ZINC000927119013 645555415 /nfs/dbraw/zinc/55/54/15/645555415.db2.gz IOLOFGPWTKYOJT-YJNKXOJESA-N 2 0 236.403 2.497 20 0 BEADRP CCc1cc(N2CC[C@H]3[C@H]2CCC[N@@H+]3C)cc[nH+]1 ZINC000872779766 645767683 /nfs/dbraw/zinc/76/76/83/645767683.db2.gz TUCARJRVVRZZLD-LSDHHAIUSA-N 2 0 245.370 2.317 20 0 BEADRP C[C@@H]1C[C@H]1C[NH2+][C@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C ZINC000925482024 645861626 /nfs/dbraw/zinc/86/16/26/645861626.db2.gz PTWDJZVVQCONPX-FHUSYTEZSA-N 2 0 222.376 2.009 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H](C)Cc1ccccn1 ZINC000924530068 646049903 /nfs/dbraw/zinc/04/99/03/646049903.db2.gz ZIEABMYNCPCFNP-CQSZACIVSA-N 2 0 249.402 2.334 20 0 BEADRP CC(C)CC[NH+]1CCC([NH2+]C2CC2)CC1 ZINC000924530924 646049999 /nfs/dbraw/zinc/04/99/99/646049999.db2.gz JYKVLEYRKAPABB-UHFFFAOYSA-N 2 0 210.365 2.249 20 0 BEADRP CCCC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CCOC ZINC000924532630 646052682 /nfs/dbraw/zinc/05/26/82/646052682.db2.gz XCDMSWVABPVBDO-AGUYFDCRSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+][C@@H]1C[C@H]2C=C[C@@H]1CC2 ZINC000924851512 646119793 /nfs/dbraw/zinc/11/97/93/646119793.db2.gz FLJNJTQRGOZFJT-IGQOVBAYSA-N 2 0 222.376 2.271 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1NC[C@@H]1Cc2ccccc21 ZINC000925490776 646299226 /nfs/dbraw/zinc/29/92/26/646299226.db2.gz OVTRTVVBCCDVPG-GXTWGEPZSA-N 2 0 230.355 2.056 20 0 BEADRP CSCC[NH2+][C@H]1CC[NH2+]C[C@@H]1C1CCCC1 ZINC000925501786 646303463 /nfs/dbraw/zinc/30/34/63/646303463.db2.gz CATFKPUCQAAHJL-OLZOCXBDSA-N 2 0 242.432 2.107 20 0 BEADRP COCCCCC[NH2+][C@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925531515 646320587 /nfs/dbraw/zinc/32/05/87/646320587.db2.gz ZFCKOUKUZWSBIK-OLZOCXBDSA-N 2 0 242.407 2.299 20 0 BEADRP C([NH2+][C@H]1CC[NH2+]C[C@@H]1C1CCCC1)C1CC1 ZINC000925535038 646322306 /nfs/dbraw/zinc/32/23/06/646322306.db2.gz BBCVLLJUXFRRNN-KGLIPLIRSA-N 2 0 222.376 2.154 20 0 BEADRP CC1(C)C[C@H]([NH3+])C[C@@H]([NH2+]CC[C@H]2CCCO2)C1 ZINC000925537672 646322925 /nfs/dbraw/zinc/32/29/25/646322925.db2.gz ZYPYMOBCBXRZJK-JHJVBQTASA-N 2 0 240.391 2.051 20 0 BEADRP COCCCC[NH2+][C@H](c1ccccc1)[C@@H](C)N ZINC000925560566 646334896 /nfs/dbraw/zinc/33/48/96/646334896.db2.gz ZMNGFUMBILEYAQ-OCCSQVGLSA-N 2 0 236.359 2.091 20 0 BEADRP CCOCC[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000925560704 646336457 /nfs/dbraw/zinc/33/64/57/646336457.db2.gz GTPJIIVVTFMLIK-AWEZNQCLSA-N 2 0 236.359 2.093 20 0 BEADRP C1CCC2(C1)[NH2+]CC[C@@H]2[NH2+]C1CCSCC1 ZINC000925591995 646349236 /nfs/dbraw/zinc/34/92/36/646349236.db2.gz UWAQFFMZEPNHQB-LBPRGKRZSA-N 2 0 240.416 2.146 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+]CCCC(F)(F)F ZINC000925606923 646357643 /nfs/dbraw/zinc/35/76/43/646357643.db2.gz ZFOKCOWGVLJLKP-MRVPVSSYSA-N 2 0 224.270 2.059 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+]C[C@H]1CC=CCC1 ZINC000925614819 646363360 /nfs/dbraw/zinc/36/33/60/646363360.db2.gz CPTKDIAOOOXRJE-NWDGAFQWSA-N 2 0 208.349 2.073 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+][C@@H]1CC=CCC1 ZINC000925619479 646367815 /nfs/dbraw/zinc/36/78/15/646367815.db2.gz NYBKRNCMBJRICT-NFMDPKQHSA-N 2 0 220.360 2.201 20 0 BEADRP C1=CC[C@@H]([NH2+][C@H]2CC[NH2+]C23CCCC3)CC1 ZINC000925620690 646368067 /nfs/dbraw/zinc/36/80/67/646368067.db2.gz XGZIUCJMFFRFJK-OLZOCXBDSA-N 2 0 220.360 2.359 20 0 BEADRP Cc1cncc(C[NH2+][C@H]2C[C@@H]([NH3+])CC(C)(C)C2)c1 ZINC000925629719 646374486 /nfs/dbraw/zinc/37/44/86/646374486.db2.gz NLSKUEAOQWTIMX-KGLIPLIRSA-N 2 0 247.386 2.386 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]CC23CCC(CC2)C3)C12CCC2 ZINC000925627048 646374623 /nfs/dbraw/zinc/37/46/23/646374623.db2.gz VVOMWAKXGIMLGH-DKNRTOFZSA-N 2 0 234.387 2.426 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+]CCC[C@H]1CCCCO1 ZINC000925638953 646381936 /nfs/dbraw/zinc/38/19/36/646381936.db2.gz HUHYKRNIEWTKKV-OLZOCXBDSA-N 2 0 240.391 2.066 20 0 BEADRP C[C@@H]1CCC[C@@H]1C[NH2+][C@H]1CC[NH2+]C1(C)C ZINC000925653008 646388869 /nfs/dbraw/zinc/38/88/69/646388869.db2.gz CIPYJVLUKSDKBC-UTUOFQBUSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1CCC[C@H]1C[NH2+][C@H]1CC[NH2+]C1(C)C ZINC000925653010 646390066 /nfs/dbraw/zinc/39/00/66/646390066.db2.gz CIPYJVLUKSDKBC-WOPDTQHZSA-N 2 0 210.365 2.153 20 0 BEADRP CC1(C)C[C@@H]([NH3+])C[C@H]([NH2+]C2CC(F)(F)C2)C1 ZINC000925651484 646392462 /nfs/dbraw/zinc/39/24/62/646392462.db2.gz DKHKASJHYIMKGR-IUCAKERBSA-N 2 0 232.318 2.280 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+][C@@H]2CC[NH2+]C23CCC3)C1 ZINC000925661192 646395826 /nfs/dbraw/zinc/39/58/26/646395826.db2.gz BTMKVJPLHCYWKK-FRRDWIJNSA-N 2 0 222.376 2.297 20 0 BEADRP CC1(C)[C@@H]([NH2+]CCCCF)[C@@H]2CCC[NH2+][C@@H]21 ZINC000925674922 646400064 /nfs/dbraw/zinc/40/00/64/646400064.db2.gz FLLFWVUXEKJVNA-SRVKXCTJSA-N 2 0 228.355 2.102 20 0 BEADRP COCC(C)(C)CCC[NH2+][C@@H]1CC[NH2+]C1(C)C ZINC000925670917 646400477 /nfs/dbraw/zinc/40/04/77/646400477.db2.gz AREPWGXYTDXWGT-GFCCVEGCSA-N 2 0 242.407 2.169 20 0 BEADRP CC(C)C1([NH2+][C@H]2CC[NH2+]C23CCC3)CC1 ZINC000925677447 646407034 /nfs/dbraw/zinc/40/70/34/646407034.db2.gz QCGKLMYUQCEVDU-NSHDSACASA-N 2 0 208.349 2.049 20 0 BEADRP CC(C)C1([NH2+][C@@H]2CC[NH2+]C23CCC3)CC1 ZINC000925677446 646407685 /nfs/dbraw/zinc/40/76/85/646407685.db2.gz QCGKLMYUQCEVDU-LLVKDONJSA-N 2 0 208.349 2.049 20 0 BEADRP C[C@H](CCCCO)[NH2+][C@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925678618 646407865 /nfs/dbraw/zinc/40/78/65/646407865.db2.gz DQBPKEKJAILHII-UPJWGTAASA-N 2 0 242.407 2.033 20 0 BEADRP CC1(C)C[C@@H]1[NH2+][C@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C ZINC000925684928 646410636 /nfs/dbraw/zinc/41/06/36/646410636.db2.gz DYVPEKBFGUIYSW-RHYQMDGZSA-N 2 0 222.376 2.151 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]CCC2CC(F)(F)C2)C12CCC2 ZINC000925685637 646412971 /nfs/dbraw/zinc/41/29/71/646412971.db2.gz NWVMNATUYTYQBK-GHMZBOCLSA-N 2 0 244.329 2.281 20 0 BEADRP CCO[C@H]1C[C@@H]([NH2+][C@@H]2C[C@@H]([NH3+])CC(C)(C)C2)C1 ZINC000925693097 646418114 /nfs/dbraw/zinc/41/81/14/646418114.db2.gz LFTPAUWSGXQREP-LPWJVIDDSA-N 2 0 240.391 2.050 20 0 BEADRP C[C@@H]1[C@H]2CC[C@@H](C[C@H]1[NH2+][C@@H]1C[C@H]1C1CCC1)[NH2+]2 ZINC000925702219 646426762 /nfs/dbraw/zinc/42/67/62/646426762.db2.gz AWXPJJXVROKAKA-UDYJRIAMSA-N 2 0 234.387 2.294 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]C[C@@H]2C[C@H]2C2CCC2)C12CCC2 ZINC000925702398 646427464 /nfs/dbraw/zinc/42/74/64/646427464.db2.gz CNHVNRZNFZEATP-FQUUOJAGSA-N 2 0 234.387 2.282 20 0 BEADRP C1[C@@H]2C[C@@H]([NH2+][C@H]3CC[NH2+]C34CCCC4)C[C@H]12 ZINC000925704961 646428656 /nfs/dbraw/zinc/42/86/56/646428656.db2.gz JBOSWKCWNFBOIX-RNJOBUHISA-N 2 0 220.360 2.049 20 0 BEADRP CC1(C)[C@H]([NH2+]CC2=CCCC2)[C@@H]2CCC[NH2+][C@@H]21 ZINC000925707038 646431179 /nfs/dbraw/zinc/43/11/79/646431179.db2.gz MZHTXAUPCVVPGU-HZSPNIEDSA-N 2 0 234.387 2.463 20 0 BEADRP C([NH2+][C@@H]1CC[NH2+]C12CCC2)[C@H]1CCC[C@H]2C[C@H]21 ZINC000925708294 646432190 /nfs/dbraw/zinc/43/21/90/646432190.db2.gz KPBWJDUKMZSCPP-REWJHTLYSA-N 2 0 234.387 2.297 20 0 BEADRP C([NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32)[C@@H]1C[C@H]1C1CCC1 ZINC000925711084 646436990 /nfs/dbraw/zinc/43/69/90/646436990.db2.gz WUEVZGNLMULSAK-NLWNOMGPSA-N 2 0 246.398 2.009 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+]CCCC1CCC1 ZINC000925712141 646437003 /nfs/dbraw/zinc/43/70/03/646437003.db2.gz WDLMLIFGNPLGMM-GFCCVEGCSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H](C[NH2+][C@H]1CC[NH2+]C1(C)C)CC(F)F ZINC000925713825 646438548 /nfs/dbraw/zinc/43/85/48/646438548.db2.gz UTVAEGQRLCSJKK-BDAKNGLRSA-N 2 0 220.307 2.008 20 0 BEADRP CC1(C)C[C@]1(C)[NH2+][C@H]1C[C@H]([NH3+])C12CCC2 ZINC000925716878 646440992 /nfs/dbraw/zinc/44/09/92/646440992.db2.gz RNXWKDPQJZVJPT-NHCYSSNCSA-N 2 0 208.349 2.035 20 0 BEADRP CC(C)[C@H]([NH3+])CCN[C@H](c1ccccc1)[C@@H](C)[NH3+] ZINC000925715797 646441335 /nfs/dbraw/zinc/44/13/35/646441335.db2.gz MERUTFAAGIXRAR-YUELXQCFSA-N 2 0 249.402 2.038 20 0 BEADRP C([NH2+][C@H]1CC[NH2+]C12CCC2)[C@H]1CCCC12CC2 ZINC000925719849 646444429 /nfs/dbraw/zinc/44/44/29/646444429.db2.gz VCOAQCMNTCYTKY-OLZOCXBDSA-N 2 0 234.387 2.441 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+]CC[C@H]1CC1(F)F ZINC000925721992 646445787 /nfs/dbraw/zinc/44/57/87/646445787.db2.gz SBFVRDRUENXSTA-IDSCEKSVSA-N 2 0 244.329 2.137 20 0 BEADRP C(C[C@@H]1CCCS1)[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000925723416 646447634 /nfs/dbraw/zinc/44/76/34/646447634.db2.gz UYAPHHLOMIXTGB-NWDGAFQWSA-N 2 0 240.416 2.146 20 0 BEADRP C(C[C@H]1CCSC1)[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000925724803 646450018 /nfs/dbraw/zinc/45/00/18/646450018.db2.gz NFKSQEZRYFVIGK-NWDGAFQWSA-N 2 0 240.416 2.004 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1C=CCC1)[C@@H]1CCCC[NH2+]1 ZINC000925731527 646455474 /nfs/dbraw/zinc/45/54/74/646455474.db2.gz LTDYEMPQCXLTDJ-UPJWGTAASA-N 2 0 208.349 2.073 20 0 BEADRP CC1(C[NH2+][C@H]2CC[NH2+]C2(C)C)CC(F)(F)C1 ZINC000925732809 646455659 /nfs/dbraw/zinc/45/56/59/646455659.db2.gz DFGKAKCDGPXWBC-VIFPVBQESA-N 2 0 232.318 2.152 20 0 BEADRP CC1(C)C[C@]1(C)C[NH2+][C@H]1CC[NH2+]C1(C)C ZINC000925733416 646455802 /nfs/dbraw/zinc/45/58/02/646455802.db2.gz IQQMPFOPLTWPIY-GXFFZTMASA-N 2 0 210.365 2.153 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]CC2(CC3CC3)CC2)C1 ZINC000925732844 646456608 /nfs/dbraw/zinc/45/66/08/646456608.db2.gz DQVFBQITWUQHAC-QWHCGFSZSA-N 2 0 222.376 2.426 20 0 BEADRP C([NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2)C1(CC2CC2)CC1 ZINC000925735316 646458614 /nfs/dbraw/zinc/45/86/14/646458614.db2.gz ZACGWEFIVLPSOO-LXFSFDBISA-N 2 0 246.398 2.153 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]C[C@@]1(C)CC1(C)C ZINC000925734954 646458831 /nfs/dbraw/zinc/45/88/31/646458831.db2.gz WDXNLKOHBKGEQH-MBNYWOFBSA-N 2 0 224.392 2.400 20 0 BEADRP CC(C)O[C@H]1C[C@@H]([NH2+]CCC(C)(C)[NH3+])C1(C)C ZINC000925736510 646461216 /nfs/dbraw/zinc/46/12/16/646461216.db2.gz AWLIPVMTQLWBJB-NEPJUHHUSA-N 2 0 242.407 2.296 20 0 BEADRP CCC1(CC)[C@H]([NH2+]CCC(C)(C)[NH3+])C[C@H]1OC ZINC000925740785 646462034 /nfs/dbraw/zinc/46/20/34/646462034.db2.gz LJRUNPXDCBVOAP-VXGBXAGGSA-N 2 0 242.407 2.297 20 0 BEADRP CC(C)([NH3+])CC[NH2+][C@@H]1CCCC12CCOCC2 ZINC000925739173 646462323 /nfs/dbraw/zinc/46/23/23/646462323.db2.gz UPIQIYGJKJRHSM-GFCCVEGCSA-N 2 0 240.391 2.053 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+]C[C@H]1C[NH2+]CCC1(F)F ZINC000925776233 646474846 /nfs/dbraw/zinc/47/48/46/646474846.db2.gz KHYWCJHCTGYORS-WOPDTQHZSA-N 2 0 246.345 2.255 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+]C[C@@H]1C[NH2+]CCC1(F)F ZINC000925776230 646475281 /nfs/dbraw/zinc/47/52/81/646475281.db2.gz KHYWCJHCTGYORS-SDDRHHMPSA-N 2 0 246.345 2.255 20 0 BEADRP CC1(C)C[C@@H]([NH3+])C[C@@H]([NH2+]CC[C@H]2CCCO2)C1 ZINC000925776735 646475312 /nfs/dbraw/zinc/47/53/12/646475312.db2.gz ZYPYMOBCBXRZJK-YNEHKIRRSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+][C@@H]1CCCC12CCCC2 ZINC000925781590 646476630 /nfs/dbraw/zinc/47/66/30/646476630.db2.gz AYRLHXILZCXZHN-JHJVBQTASA-N 2 0 222.376 2.297 20 0 BEADRP CC[C@@H]1CCC[C@H]1[NH2+]C[C@H]1C[NH2+]CCC1(F)F ZINC000925779970 646477255 /nfs/dbraw/zinc/47/72/55/646477255.db2.gz COYHMKRMQAUKKB-IJLUTSLNSA-N 2 0 246.345 2.400 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1C[NH2+]CCC1(F)F ZINC000925779972 646477662 /nfs/dbraw/zinc/47/76/62/646477662.db2.gz COYHMKRMQAUKKB-WOPDTQHZSA-N 2 0 246.345 2.400 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+][C@@H]1CC(C)(C)C[C@@H]1C ZINC000925782441 646478934 /nfs/dbraw/zinc/47/89/34/646478934.db2.gz GMPHLOCSBCCGAV-IRCOFANPSA-N 2 0 210.365 2.009 20 0 BEADRP CC[C@@H]([NH2+][C@@H]1C[NH2+]C[C@H]1C)[C@H]1CC1(C)C ZINC000925782479 646479005 /nfs/dbraw/zinc/47/90/05/646479005.db2.gz GPTYSDYTAUYRCA-DDHJBXDOSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+][C@H]1CC(C)(C)C[C@H]1C ZINC000925782447 646479765 /nfs/dbraw/zinc/47/97/65/646479765.db2.gz GMPHLOCSBCCGAV-WISYIIOYSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@@H]1CC[C@H]1C1CCC1 ZINC000925785388 646481910 /nfs/dbraw/zinc/48/19/10/646481910.db2.gz NCTXTDUAJGSSQO-VZZFWQQMSA-N 2 0 222.376 2.010 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@H]1CCC[C@H]1CCCF ZINC000925786521 646482524 /nfs/dbraw/zinc/48/25/24/646482524.db2.gz SXEAPMUTDJAXSM-RFGFWPKPSA-N 2 0 242.382 2.350 20 0 BEADRP CC[C@@H]([NH2+]C[C@H]1C[NH2+]CCC1(F)F)C1CC1 ZINC000925786923 646482922 /nfs/dbraw/zinc/48/29/22/646482922.db2.gz XYPWZCIEZYHKAE-GHMZBOCLSA-N 2 0 232.318 2.009 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1C[NH2+]C[C@H]1C)C(C)(C)C ZINC000925795631 646486270 /nfs/dbraw/zinc/48/62/70/646486270.db2.gz HIOVAPFMKVSNRQ-GRYCIOLGSA-N 2 0 212.381 2.256 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1C[NH2+]C[C@H]1C)C1CCCC1 ZINC000925786505 646483527 /nfs/dbraw/zinc/48/35/27/646483527.db2.gz SWPPVBZMNQAFSD-XBFCOCLRSA-N 2 0 224.392 2.400 20 0 BEADRP Cc1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1C[NH2+]C[C@H]1C)CC2 ZINC000925790636 646485304 /nfs/dbraw/zinc/48/53/04/646485304.db2.gz JKBBQJIJLFHNJY-INWMFGNUSA-N 2 0 244.382 2.427 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+][C@H](C1CC1)C1CCC1 ZINC000925799090 646486362 /nfs/dbraw/zinc/48/63/62/646486362.db2.gz YDEYDYIEWHFRLM-DFBGVHRSSA-N 2 0 236.403 2.400 20 0 BEADRP CC[C@H]([NH2+]CC[C@@H]1C[NH2+]C[C@H]1C)[C@H]1C[C@@H]1C ZINC000925797040 646486738 /nfs/dbraw/zinc/48/67/38/646486738.db2.gz SWJVBQVBLLFONZ-ZSLBOAEBSA-N 2 0 224.392 2.256 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+][C@H]1CC[C@H]1C1CC1 ZINC000925802462 646486973 /nfs/dbraw/zinc/48/69/73/646486973.db2.gz HHBZWFGIEOTNQB-ZZVYKPCYSA-N 2 0 222.376 2.010 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+]C[C@]12C[C@H]1CCCC2 ZINC000925801321 646487003 /nfs/dbraw/zinc/48/70/03/646487003.db2.gz IQRGMKDRGVGCNU-DYEKYZERSA-N 2 0 222.376 2.297 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+]CC[C@@H]1C[C@H]1C1CC1 ZINC000925801005 646487468 /nfs/dbraw/zinc/48/74/68/646487468.db2.gz IENVJCCJEKRWDT-FRRDWIJNSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]Cc1nccc2c1CCCC2 ZINC000925804735 646487854 /nfs/dbraw/zinc/48/78/54/646487854.db2.gz CEUQHOHEVGEGBM-VXGBXAGGSA-N 2 0 247.386 2.176 20 0 BEADRP C(C[C@@H]1CC[C@H]2C[C@H]21)[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000925806260 646488777 /nfs/dbraw/zinc/48/87/77/646488777.db2.gz ZFSUKOPJOWWSDE-XUXIUFHCSA-N 2 0 234.387 2.297 20 0 BEADRP C(C[C@@H]1CC[C@@H]2C[C@@H]21)[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000925806258 646488855 /nfs/dbraw/zinc/48/88/55/646488855.db2.gz ZFSUKOPJOWWSDE-DGAVXFQQSA-N 2 0 234.387 2.297 20 0 BEADRP C([NH2+][C@@H]1CC[NH2+]C12CCC2)[C@@]12C[C@@H]1CCCC2 ZINC000925802639 646489164 /nfs/dbraw/zinc/48/91/64/646489164.db2.gz PIKWHFJOGRRFBW-BFHYXJOUSA-N 2 0 234.387 2.441 20 0 BEADRP C[C@@H]1C[C@H]1[C@@H]1C[C@H]1[NH2+][C@@H]1CCCCC[C@H]1[NH3+] ZINC000925821268 646495007 /nfs/dbraw/zinc/49/50/07/646495007.db2.gz GMBKOXDWWHSLLD-BUCHIQEDSA-N 2 0 222.376 2.281 20 0 BEADRP C[C@H]([NH2+][C@H](c1ccccn1)C1CC1)[C@H]1CC[NH2+]C1 ZINC000925822690 646496268 /nfs/dbraw/zinc/49/62/68/646496268.db2.gz NZBXBQRFZQMCTH-WHOFXGATSA-N 2 0 245.370 2.120 20 0 BEADRP C([NH2+][C@@H]1CC[C@H]2CCCC[C@@H]2C1)C1C[NH2+]C1 ZINC000723659716 711531882 /nfs/dbraw/zinc/53/18/82/711531882.db2.gz VMXVIGOOHJIIJV-MGPQQGTHSA-N 2 0 222.376 2.154 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1CCS[C@H](C)C1 ZINC000925861194 646514014 /nfs/dbraw/zinc/51/40/14/646514014.db2.gz OFLBOZKUQSDFIB-IJLUTSLNSA-N 2 0 230.421 2.378 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCSC2(CCC2)C1)C1C[NH2+]C1 ZINC000925862080 646514409 /nfs/dbraw/zinc/51/44/09/646514409.db2.gz XNYDVKRKQSGNPZ-PWSUYJOCSA-N 2 0 240.416 2.002 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)CCS1 ZINC000925861161 646515404 /nfs/dbraw/zinc/51/54/04/646515404.db2.gz NRMLSHJZLLYJLP-GCFWVWJCSA-N 2 0 240.416 2.143 20 0 BEADRP CC1CCC([NH2+]C[C@@H]2CC[C@H]([NH3+])C2)CC1 ZINC000925876957 646526987 /nfs/dbraw/zinc/52/69/87/646526987.db2.gz KEQQVVRINYGEKA-QBHFIFKDSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]([NH2+]CC1CCC=CCC1)[C@@H]1CCC[NH2+]1 ZINC000925881770 646529236 /nfs/dbraw/zinc/52/92/36/646529236.db2.gz UUPNLRKDQFILBX-OCCSQVGLSA-N 2 0 222.376 2.463 20 0 BEADRP CCc1cccnc1[C@H](C)[NH2+]C[C@@H]1CC[C@H]([NH3+])C1 ZINC000925883759 646533066 /nfs/dbraw/zinc/53/30/66/646533066.db2.gz XGKMSFKJQNFMPH-SCRDCRAPSA-N 2 0 247.386 2.422 20 0 BEADRP C[C@@H]1CC[C@@H](C)C1[NH2+][C@H]1CCc2nc[nH]c2C1 ZINC000926450627 646642060 /nfs/dbraw/zinc/64/20/60/646642060.db2.gz PMYBQZSFWZYOTN-MXWKQRLJSA-N 2 0 233.359 2.291 20 0 BEADRP C[C@@H](C[NH2+][C@H]1C[C@H]2C=C[C@@H]1CC2)C[NH+](C)C ZINC000926474042 646653736 /nfs/dbraw/zinc/65/37/36/646653736.db2.gz NQAKDHNFRMIUOQ-FQUUOJAGSA-N 2 0 222.376 2.128 20 0 BEADRP FC1(C2CC2)CC[NH+](CC[C@@H]2CC[NH2+]C2)CC1 ZINC000724799476 711615424 /nfs/dbraw/zinc/61/54/24/711615424.db2.gz AKAPDWCRLAVRCZ-LBPRGKRZSA-N 2 0 240.366 2.200 20 0 BEADRP C[C@@H](C[NH2+][C@@H]1CC2CCC1CC2)C[NH+](C)C ZINC000382229754 711643125 /nfs/dbraw/zinc/64/31/25/711643125.db2.gz GTHQVJKOIQDLBG-GFJIZPEISA-N 2 0 224.392 2.352 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC2CCC1CC2)C[NH+](C)C ZINC000382229755 711643347 /nfs/dbraw/zinc/64/33/47/711643347.db2.gz GTHQVJKOIQDLBG-RYSNWHEDSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@H]([NH2+]CC1(C)CC(F)(F)C1)[C@H]1CCC[NH2+]1 ZINC000720899256 711686680 /nfs/dbraw/zinc/68/66/80/711686680.db2.gz GKMNSUCWCFSUHQ-VHSXEESVSA-N 2 0 232.318 2.152 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)C1(Cl)CC1 ZINC000700807817 711852474 /nfs/dbraw/zinc/85/24/74/711852474.db2.gz DTQDNPZOADJTOQ-VXGBXAGGSA-N 2 0 244.810 2.468 20 0 BEADRP CCCCC[C@@H](C)[NH2+]C[C@@]1(COC)CCC[NH2+]1 ZINC000701282064 711858050 /nfs/dbraw/zinc/85/80/50/711858050.db2.gz BYRYDNFQTHFDFL-ZIAGYGMSSA-N 2 0 242.407 2.313 20 0 BEADRP CC1(C)C[C@]1(C)C[NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2 ZINC000702000063 712036126 /nfs/dbraw/zinc/03/61/26/712036126.db2.gz BHQIZRHNGHRIJT-NQBHXWOUSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC[C@H]2CCSC2)CC[N@@H+]1C ZINC000704789762 712117113 /nfs/dbraw/zinc/11/71/13/712117113.db2.gz HROPLSPMRSBFAK-FRRDWIJNSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CC[C@H]1CCSC1 ZINC000704840193 712119214 /nfs/dbraw/zinc/11/92/14/712119214.db2.gz GSPOJOUFEQKPIO-NEPJUHHUSA-N 2 0 230.421 2.237 20 0 BEADRP CC(C)[C@H]([NH3+])CC[N@H+](C)C[C@@H]1CC(C)(C)CO1 ZINC000708334754 712188435 /nfs/dbraw/zinc/18/84/35/712188435.db2.gz AHFNBHAANXHZAI-QWHCGFSZSA-N 2 0 242.407 2.107 20 0 BEADRP C[N@H+](C[C@H]1CC(C)(C)OC1(C)C)C1CC([NH3+])C1 ZINC000709702367 712216116 /nfs/dbraw/zinc/21/61/16/712216116.db2.gz MZSVBXPEYHYKGS-VOMCLLRMSA-N 2 0 240.391 2.002 20 0 BEADRP C[C@H](CC1CCC1)[NH2+][C@H]1C[C@H]([NH3+])C12CCC2 ZINC000710271217 712250297 /nfs/dbraw/zinc/25/02/97/712250297.db2.gz JONRCCHLISUANM-WXHSDQCUSA-N 2 0 222.376 2.425 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@@H]1CCC(C)(C)CO1 ZINC000711389459 712296693 /nfs/dbraw/zinc/29/66/93/712296693.db2.gz IYXPHVZTYOGQJE-OLZOCXBDSA-N 2 0 242.407 2.299 20 0 BEADRP CC1(C)CC[C@H](C[NH2+][C@H]2CCC[C@H]([NH3+])C2)OC1 ZINC000711387638 712296694 /nfs/dbraw/zinc/29/66/94/712296694.db2.gz CSMMDWGNUWCJNN-RWMBFGLXSA-N 2 0 240.391 2.051 20 0 BEADRP FC[C@H]1CCC[N@H+](CCC2CC[NH2+]CC2)C1 ZINC000711442778 712301025 /nfs/dbraw/zinc/30/10/25/712301025.db2.gz JNHYNIUMURYHCL-CYBMUJFWSA-N 2 0 228.355 2.058 20 0 BEADRP CC[C@@H](C)C[N@@H+]1CC[NH2+]CCC12CCC2 ZINC000713173125 712453366 /nfs/dbraw/zinc/45/33/66/712453366.db2.gz DIMSASNJUCGBDD-GFCCVEGCSA-N 2 0 210.365 2.251 20 0 BEADRP C=C/C=C\CC[NH2+][C@H](C)C1CC[NH+](C)CC1 ZINC000713695073 712469378 /nfs/dbraw/zinc/46/93/78/712469378.db2.gz MKBCMSACPBRSGO-CFHLNLSMSA-N 2 0 222.376 2.439 20 0 BEADRP C=C/C=C/CC[N@H+]1CCC[C@H]([C@H](C)[NH3+])C1 ZINC000713700484 712469575 /nfs/dbraw/zinc/46/95/75/712469575.db2.gz CENYBCZWMXCIQY-WWKJKZQJSA-N 2 0 208.349 2.178 20 0 BEADRP CC1(C)CCC[C@@H](C[N@@H+]2CC[C@@H](CC[NH3+])C2)O1 ZINC000714339379 712482617 /nfs/dbraw/zinc/48/26/17/712482617.db2.gz SHVLJHFDPXOIEG-OLZOCXBDSA-N 2 0 240.391 2.005 20 0 BEADRP CO[C@@H]1CCC[C@H]1[NH2+]C1CCC([NH+](C)C)CC1 ZINC000715551264 712528321 /nfs/dbraw/zinc/52/83/21/712528321.db2.gz HEFBLDNYNAFDHX-NWINJMCUSA-N 2 0 240.391 2.016 20 0 BEADRP CC[C@@H](C)C[N@H+](C)CCCCCC[NH3+] ZINC000037173546 712550228 /nfs/dbraw/zinc/55/02/28/712550228.db2.gz VNIPDNIMUSTPCB-GFCCVEGCSA-N 2 0 200.370 2.483 20 0 BEADRP C[C@@H]([NH2+]CCCCC1CC1)[C@H]1CCC[NH2+]1 ZINC000716371506 712556934 /nfs/dbraw/zinc/55/69/34/712556934.db2.gz XJKORCAWCURDGN-DGCLKSJQSA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+]C[C@H]1C[NH2+]CCC1(F)F ZINC000717045328 712624705 /nfs/dbraw/zinc/62/47/05/712624705.db2.gz HYWJFQHLZIVSFX-GARJFASQSA-N 2 0 234.334 2.255 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+]C[C@@H]1C[NH2+]CCC1(F)F ZINC000717045304 712624867 /nfs/dbraw/zinc/62/48/67/712624867.db2.gz HYWJFQHLZIVSFX-DCAQKATOSA-N 2 0 234.334 2.255 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+]C[C@H]1C[NH2+]CCC1(F)F ZINC000717047332 712624972 /nfs/dbraw/zinc/62/49/72/712624972.db2.gz LOTMYCPUKDDKMO-UTUOFQBUSA-N 2 0 246.345 2.400 20 0 BEADRP C[C@@H](CCC1CC1)[NH2+]C[C@@H]1C[NH2+]CCC1(F)F ZINC000717348728 712650085 /nfs/dbraw/zinc/65/00/85/712650085.db2.gz JPOSAUOUTYKQNB-JQWIXIFHSA-N 2 0 246.345 2.400 20 0 BEADRP CC(C)[C@H](C)[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000037485324 712650717 /nfs/dbraw/zinc/65/07/17/712650717.db2.gz SIBOLWGNPWOXSP-RYUDHWBXSA-N 2 0 210.365 2.105 20 0 BEADRP CC(C)[C@H](C)[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000037485326 712650885 /nfs/dbraw/zinc/65/08/85/712650885.db2.gz SIBOLWGNPWOXSP-NWDGAFQWSA-N 2 0 210.365 2.105 20 0 BEADRP C[NH+]1CCC(C[NH2+]C2(C3CC3)CCC2)CC1 ZINC000717892692 712732210 /nfs/dbraw/zinc/73/22/10/712732210.db2.gz HVJRUJYLKVPKBI-UHFFFAOYSA-N 2 0 222.376 2.251 20 0 BEADRP COCC(C)(C)CC[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000718662706 712776570 /nfs/dbraw/zinc/77/65/70/712776570.db2.gz AOJCHHBGBCNLRM-OLZOCXBDSA-N 2 0 242.407 2.121 20 0 BEADRP CO[C@@H]1CCC[C@H]([NH2+]CCCC[NH+](C)C)CC1 ZINC000718843275 712785859 /nfs/dbraw/zinc/78/58/59/712785859.db2.gz PXZZQQWTOFXKCS-UONOGXRCSA-N 2 0 242.407 2.266 20 0 BEADRP CSCC1CC[NH+](C[C@@]2(C)CC[NH2+]C2)CC1 ZINC000719268354 712802814 /nfs/dbraw/zinc/80/28/14/712802814.db2.gz IUBKWCXLLBNLTI-ZDUSSCGKSA-N 2 0 242.432 2.061 20 0 BEADRP CCCCC[N@H+]1C[C@H](C(F)(F)F)[C@@H](C[NH3+])C1 ZINC000720809505 712866940 /nfs/dbraw/zinc/86/69/40/712866940.db2.gz ZVYWWTYZEJTZFG-UWVGGRQHSA-N 2 0 238.297 2.246 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+][C@H]1CCC(C)(C)C1 ZINC000722524899 710715303 /nfs/dbraw/zinc/71/53/03/710715303.db2.gz GUNZSWSBVNORNW-UPJWGTAASA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1C[N@H+](C[C@@H]2CCC[C@H](C)C2)C[C@H]1[NH3+] ZINC000723469763 710727874 /nfs/dbraw/zinc/72/78/74/710727874.db2.gz IALMBPNPHJGOON-UMSGYPCISA-N 2 0 210.365 2.092 20 0 BEADRP C[C@@H]1C[C@H](C)CC[N@H+](CCC[NH2+]C2CC2)C1 ZINC000723808554 710729705 /nfs/dbraw/zinc/72/97/05/710729705.db2.gz LARNAIMKZFOVRQ-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP CCc1nc(C[NH2+]CCCCCC[NH3+])cs1 ZINC000382032070 710767203 /nfs/dbraw/zinc/76/72/03/710767203.db2.gz UPFNVMNDDCLSKA-UHFFFAOYSA-N 2 0 241.404 2.314 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+]C[C@]2(C)CCCS2)C1 ZINC000382099360 710776067 /nfs/dbraw/zinc/77/60/67/710776067.db2.gz BEMFWOOQCJTESA-STQMWFEESA-N 2 0 242.432 2.204 20 0 BEADRP CCCCC[C@@H](C)[NH2+]CC1(O)CC[NH+](C)CC1 ZINC000397537419 710909238 /nfs/dbraw/zinc/90/92/38/710909238.db2.gz IEMXUBQOGAFXAT-CYBMUJFWSA-N 2 0 242.407 2.002 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC1(C)C)C1CC[NH+](C)CC1 ZINC000380540984 712901687 /nfs/dbraw/zinc/90/16/87/712901687.db2.gz HECBPOITASSMBH-AAEUAGOBSA-N 2 0 224.392 2.495 20 0 BEADRP CC(C)(C)[C@@H]1CC[N@H+](C[C@H]([NH3+])CC(F)F)C1 ZINC000380612376 712901754 /nfs/dbraw/zinc/90/17/54/712901754.db2.gz YMTHLMKMMAUMHQ-NXEZZACHSA-N 2 0 234.334 2.337 20 0 BEADRP C[C@H](Cc1ccc(F)cc1)[NH2+]CCC(C)(C)[NH3+] ZINC000384092122 710988616 /nfs/dbraw/zinc/98/86/16/710988616.db2.gz ZDTFBKICYAPYCH-LLVKDONJSA-N 2 0 238.350 2.474 20 0 BEADRP CCCN(CC)C[C@H](C)[NH2+][C@@H]1CC[C@H]1C ZINC000389869002 711093435 /nfs/dbraw/zinc/09/34/35/711093435.db2.gz IIDFIMMUBBCNDG-FRRDWIJNSA-N 2 0 212.381 2.495 20 0 BEADRP C[C@@H]([NH3+])CN(C)CC[C@@H](C)c1ccccc1 ZINC000390257107 711109565 /nfs/dbraw/zinc/10/95/65/711109565.db2.gz XESDDBMZYRPISB-CHWSQXEVSA-N 2 0 220.360 2.459 20 0 BEADRP C[N@H+]1CC=C(C[NH2+][C@@H]2CC3CCC2CC3)CC1 ZINC000392249312 711143700 /nfs/dbraw/zinc/14/37/00/711143700.db2.gz UCBAKWCEUFXHQO-PESDSKBTSA-N 2 0 234.387 2.417 20 0 BEADRP C([NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2)C1(C2CC2)CCC1 ZINC000391420723 711138582 /nfs/dbraw/zinc/13/85/82/711138582.db2.gz DBSRRJZQBTWQAE-RCZQDCHWSA-N 2 0 246.398 2.153 20 0 BEADRP CC(C)(C)CC[NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32 ZINC000392832582 711153534 /nfs/dbraw/zinc/15/35/34/711153534.db2.gz IILKKDWLCJDWNA-JZRPKSSGSA-N 2 0 222.376 2.009 20 0 BEADRP C[C@@H]([NH3+])[C@H]1CCC[N@H+](CCCC2CC2)C1 ZINC000394570136 711195510 /nfs/dbraw/zinc/19/55/10/711195510.db2.gz PQGKZNXIUAZUQK-YPMHNXCESA-N 2 0 210.365 2.236 20 0 BEADRP C[NH2+]CCC[N@H+](C)CC[C@H]1CC1(Cl)Cl ZINC000399262835 711426257 /nfs/dbraw/zinc/42/62/57/711426257.db2.gz PQMUJGDFTHYXPC-VIFPVBQESA-N 2 0 239.190 2.112 20 0 BEADRP C[NH+]1CCC(C[NH2+]C[C@@H]2CCCC2(F)F)CC1 ZINC000381938003 710759302 /nfs/dbraw/zinc/75/93/02/710759302.db2.gz QKFREHLBAHIGGB-LBPRGKRZSA-N 2 0 246.345 2.353 20 0 BEADRP C[C@H]([NH3+])C1CC[NH+](CCCC2CC2)CC1 ZINC000394504315 710889437 /nfs/dbraw/zinc/88/94/37/710889437.db2.gz TVVGCAVSSMBHGG-NSHDSACASA-N 2 0 210.365 2.236 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CCC[N@H+](CCCC2CC2)C1 ZINC000394570134 711195141 /nfs/dbraw/zinc/19/51/41/711195141.db2.gz PQGKZNXIUAZUQK-WCQYABFASA-N 2 0 210.365 2.236 20 0 BEADRP C[C@H]([NH3+])[C@H]1CCC[N@H+](CCCC2CC2)C1 ZINC000394570132 711195253 /nfs/dbraw/zinc/19/52/53/711195253.db2.gz PQGKZNXIUAZUQK-AAEUAGOBSA-N 2 0 210.365 2.236 20 0 BEADRP Cc1cccc(OCCN[C@H]2CCC[NH2+][C@@H]2C)c1 ZINC000396693472 711364405 /nfs/dbraw/zinc/36/44/05/711364405.db2.gz LUNHBWMRLBKOIG-HIFRSBDPSA-N 2 0 248.370 2.104 20 0 BEADRP Cc1csc(C[NH2+]CCCCCC[NH3+])n1 ZINC000049539113 711448763 /nfs/dbraw/zinc/44/87/63/711448763.db2.gz HPJRRJZTNAIMIP-UHFFFAOYSA-N 2 0 227.377 2.060 20 0 BEADRP [NH3+]C[C@H]1CC[N@H+](CCSc2ccccc2)C1 ZINC000050249344 711493803 /nfs/dbraw/zinc/49/38/03/711493803.db2.gz UKEZDFJHILYANW-GFCCVEGCSA-N 2 0 236.384 2.059 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1CC[C@@]2(C1)CCC[NH2+]C2 ZINC000723106502 711504272 /nfs/dbraw/zinc/50/42/72/711504272.db2.gz MOFQPXWZTMTOCU-RDBSUJKOSA-N 2 0 222.376 2.108 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1C[C@@H]2CCC[C@H]([NH3+])[C@@H]2C1 ZINC000723126400 711506566 /nfs/dbraw/zinc/50/65/66/711506566.db2.gz JDTBEXNKZSKIJI-HTOAHKCRSA-N 2 0 222.376 2.092 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1C[C@@H]2CCC[C@@H]([NH3+])[C@H]2C1 ZINC000723126401 711506571 /nfs/dbraw/zinc/50/65/71/711506571.db2.gz JDTBEXNKZSKIJI-IKOXMDCHSA-N 2 0 222.376 2.092 20 0 BEADRP C([NH2+][C@H]1CC[C@@H]2CCCC[C@@H]2C1)C1C[NH2+]C1 ZINC000723659953 711532181 /nfs/dbraw/zinc/53/21/81/711532181.db2.gz VMXVIGOOHJIIJV-MJBXVCDLSA-N 2 0 222.376 2.154 20 0 BEADRP Cc1cc(C[N@@H+]2CC[C@@H](CC[NH3+])C2)ccc1F ZINC000723669547 711533544 /nfs/dbraw/zinc/53/35/44/711533544.db2.gz JKAUGJXVIBUSBB-GFCCVEGCSA-N 2 0 236.334 2.305 20 0 BEADRP C[C@@H]1C[N@H+](C[C@H]2CCCC[C@@H]2C)C[C@H]1C[NH3+] ZINC000723862702 711539784 /nfs/dbraw/zinc/53/97/84/711539784.db2.gz QSJAIXGKHHEXPK-REWJHTLYSA-N 2 0 224.392 2.339 20 0 BEADRP C[C@@H]1C[N@H+](CCC(C)(C)C)C[C@H]1CC[NH3+] ZINC000723902418 711544804 /nfs/dbraw/zinc/54/48/04/711544804.db2.gz XSADRHDVJBNZTE-VXGBXAGGSA-N 2 0 212.381 2.339 20 0 BEADRP C[C@@H]1C[N@H+](CCc2cccs2)C[C@H]1CC[NH3+] ZINC000723909740 711545194 /nfs/dbraw/zinc/54/51/94/711545194.db2.gz PZUZEZIJOCBCHZ-VXGBXAGGSA-N 2 0 238.400 2.207 20 0 BEADRP C[C@@H]1C[N@H+](Cc2ccccc2F)C[C@H]1CC[NH3+] ZINC000723910277 711545242 /nfs/dbraw/zinc/54/52/42/711545242.db2.gz YYECPUXEKCOTOG-VXGBXAGGSA-N 2 0 236.334 2.242 20 0 BEADRP C[NH+]1CCC(C[NH2+]CCC2CC=CC2)CC1 ZINC000724182431 711566597 /nfs/dbraw/zinc/56/65/97/711566597.db2.gz AQCDFEMCNOEICM-UHFFFAOYSA-N 2 0 222.376 2.274 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCC2CC=CC2)CC[N@@H+]1C ZINC000724184474 711567103 /nfs/dbraw/zinc/56/71/03/711567103.db2.gz IXZAAVISTJCOKR-OCCSQVGLSA-N 2 0 222.376 2.415 20 0 BEADRP CC[NH+]1CCC([NH2+]CCC2CC=CC2)CC1 ZINC000724204195 711569410 /nfs/dbraw/zinc/56/94/10/711569410.db2.gz YTBQRFJELPJHCT-UHFFFAOYSA-N 2 0 222.376 2.417 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]CCC2CC=CC2)C12CCC2 ZINC000724221185 711570120 /nfs/dbraw/zinc/57/01/20/711570120.db2.gz ZELNLUKWMXSHKQ-OLZOCXBDSA-N 2 0 220.360 2.202 20 0 BEADRP CC1CC([NH2+][C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)C1 ZINC000252909535 711651709 /nfs/dbraw/zinc/65/17/09/711651709.db2.gz AFBDGDOCMSEXJD-YTPFDHIKSA-N 2 0 222.376 2.295 20 0 BEADRP CC(C)OCC(C)(C)[NH2+]CC1CC[NH+](C)CC1 ZINC000396339702 711701091 /nfs/dbraw/zinc/70/10/91/711701091.db2.gz BQBBOVXRVGSMLR-UHFFFAOYSA-N 2 0 242.407 2.121 20 0 BEADRP CCCC[NH2+]C[C@@H](C(C)C)[NH+]1CCCC1 ZINC000020200895 711707872 /nfs/dbraw/zinc/70/78/72/711707872.db2.gz FSIBBZPZTOOYRL-ZDUSSCGKSA-N 2 0 212.381 2.497 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+]CC[C@@H]1CCCS1 ZINC000925722833 711726552 /nfs/dbraw/zinc/72/65/52/711726552.db2.gz NQNGSGXUJGGNEJ-QWRGUYRKSA-N 2 0 228.405 2.002 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@H]1CC[C@H](C2CC2)O1 ZINC000722316084 711735153 /nfs/dbraw/zinc/73/51/53/711735153.db2.gz LGQYWENUHGKRHD-MRVWCRGKSA-N 2 0 240.391 2.051 20 0 BEADRP CC(C)(C)CC[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000037904458 711754997 /nfs/dbraw/zinc/75/49/97/711754997.db2.gz LKGKXUMZAJWBFS-LBPRGKRZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CC[C@H]([NH3+])C1)c1cccc(O)c1 ZINC000925876254 711761799 /nfs/dbraw/zinc/76/17/99/711761799.db2.gz RYDSZHQGDANFGI-WZRBSPASSA-N 2 0 234.343 2.170 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2C[C@@H]3CCCC[C@@H]32)CC1 ZINC000895234084 711780069 /nfs/dbraw/zinc/78/00/69/711780069.db2.gz DJQCMSWEQSYFJX-KBPBESRZSA-N 2 0 222.376 2.203 20 0 BEADRP C=C(Cl)C[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000056523782 711825690 /nfs/dbraw/zinc/82/56/90/711825690.db2.gz NONCPARNVXCYRW-UHFFFAOYSA-N 2 0 230.783 2.403 20 0 BEADRP [NH3+]CCC[NH2+][C@@H]1CC[C@H]2CCCC[C@@H]2C1 ZINC000225141762 711827529 /nfs/dbraw/zinc/82/75/29/711827529.db2.gz VFIPEGQHDKRVGD-JHJVBQTASA-N 2 0 210.365 2.284 20 0 BEADRP C[C@]1(C[N@H+]2C[C@@H]3CC=CC[C@@H]3C2)CCC[NH2+]C1 ZINC000382942934 711834551 /nfs/dbraw/zinc/83/45/51/711834551.db2.gz JOESDMIVUSTGTC-ZNMIVQPWSA-N 2 0 234.387 2.274 20 0 BEADRP C[NH+]1CCC(C[NH2+]C[C@@H]2CCCCS2)CC1 ZINC000087683105 711838443 /nfs/dbraw/zinc/83/84/43/711838443.db2.gz HNQFWMMITPXKKV-ZDUSSCGKSA-N 2 0 242.432 2.204 20 0 BEADRP CC(C)OCCC[N@H+](C)C1CCC([NH3+])CC1 ZINC000382960790 711865789 /nfs/dbraw/zinc/86/57/89/711865789.db2.gz OKRRPLHAYUINAI-UHFFFAOYSA-N 2 0 228.380 2.003 20 0 BEADRP CCO[C@@H]1CCC[C@@H]([NH2+]C2CC([NH+](C)C)C2)C1 ZINC000721273134 711881507 /nfs/dbraw/zinc/88/15/07/711881507.db2.gz NMEIRHGGVXZHEB-BLYZHGLHSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCSC1)[C@@H]1CCCC[NH2+]1 ZINC000704777787 711892095 /nfs/dbraw/zinc/89/20/95/711892095.db2.gz VKZNJWIWFXPVHS-AVGNSLFASA-N 2 0 242.432 2.250 20 0 BEADRP [NH3+]CC[C@@H]1CCCC[N@@H+]1CCc1cccs1 ZINC000069721206 711893350 /nfs/dbraw/zinc/89/33/50/711893350.db2.gz HWOBIDWYDQEPSB-LBPRGKRZSA-N 2 0 238.400 2.494 20 0 BEADRP C[NH2+]CCC1CC[NH+](C/C=C/Cl)CC1 ZINC000069730601 711893877 /nfs/dbraw/zinc/89/38/77/711893877.db2.gz WFQJGILKURLBHD-QHHAFSJGSA-N 2 0 216.756 2.060 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000423373358 711957518 /nfs/dbraw/zinc/95/75/18/711957518.db2.gz RXTIOIBODATGPW-RNJOBUHISA-N 2 0 210.365 2.281 20 0 BEADRP C[N@H+](C[C@@H]1CCCC[NH2+]C1)C1CCCC1 ZINC000700256729 711989352 /nfs/dbraw/zinc/98/93/52/711989352.db2.gz JHHDFOUQTFRSII-GFCCVEGCSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)C1(Cl)CC1 ZINC000700807807 712006320 /nfs/dbraw/zinc/00/63/20/712006320.db2.gz DTQDNPZOADJTOQ-NEPJUHHUSA-N 2 0 244.810 2.468 20 0 BEADRP CC1(C)CC(C[NH2+][C@@H]2C[C@H]([NH3+])C23CCC3)C1 ZINC000702008080 712036573 /nfs/dbraw/zinc/03/65/73/712036573.db2.gz UFCLKWPIZRBXSI-NWDGAFQWSA-N 2 0 222.376 2.282 20 0 BEADRP CCC(C)(C)CC[N@@H+]1C[C@@H]2C[NH2+]C[C@]2(C)C1 ZINC000702121926 712039558 /nfs/dbraw/zinc/03/95/58/712039558.db2.gz WIXRDMRSROMOSI-GXTWGEPZSA-N 2 0 224.392 2.354 20 0 BEADRP CC(C)=CC[NH2+][C@@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C ZINC000703274141 712069386 /nfs/dbraw/zinc/06/93/86/712069386.db2.gz JZMCQPAECYHQQZ-FRRDWIJNSA-N 2 0 222.376 2.319 20 0 BEADRP C[C@]12C[NH2+]C[C@H]1C[N@H+](CC1CCCCCC1)C2 ZINC000703564212 712080363 /nfs/dbraw/zinc/08/03/63/712080363.db2.gz JEMMFPUNLMZKEX-LSDHHAIUSA-N 2 0 236.403 2.498 20 0 BEADRP C[C@@H]1CC[C@@H](C)[NH+]1C[C@@H]1CCCC[NH2+]C1 ZINC000706428793 712145955 /nfs/dbraw/zinc/14/59/55/712145955.db2.gz AQLYKZISHOXWTA-JHJVBQTASA-N 2 0 210.365 2.249 20 0 BEADRP C[C@H](CC[NH2+][C@@H]1CCCC12CC2)[NH+](C)C ZINC000706614983 712151066 /nfs/dbraw/zinc/15/10/66/712151066.db2.gz MSQHNQAZLMHSKW-VXGBXAGGSA-N 2 0 210.365 2.249 20 0 BEADRP CSC1CC([NH2+]C[C@@H](C)C[NH+]2CCCC2)C1 ZINC000706918573 712158510 /nfs/dbraw/zinc/15/85/10/712158510.db2.gz PWVKSLCYNMCZAA-PNESKVBLSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H](CN1CC[C@@H]2C[NH2+]C[C@@H]21)CC(C)(C)C ZINC000709175459 712199368 /nfs/dbraw/zinc/19/93/68/712199368.db2.gz GRCHYIMUONLUDJ-UPJWGTAASA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H](C[N@@H+]1CC[C@@H](C[NH3+])C1)CC(C)(C)C ZINC000709120939 712209202 /nfs/dbraw/zinc/20/92/02/712209202.db2.gz BADAMCPPXGMCIS-NEPJUHHUSA-N 2 0 212.381 2.339 20 0 BEADRP C[C@H]1[C@H]2CC[C@@H](C[C@H]1[NH2+]C1CCSCC1)[NH2+]2 ZINC000709283356 712219049 /nfs/dbraw/zinc/21/90/49/712219049.db2.gz MFMCFPQNTDPJOT-FTYKPCCVSA-N 2 0 240.416 2.001 20 0 BEADRP C[C@@H]1[C@H]2CC[C@@H](C[C@H]1[NH2+][C@H]1CCCC13CC3)[NH2+]2 ZINC000709371527 712220463 /nfs/dbraw/zinc/22/04/63/712220463.db2.gz MAJCOLGVYIUSRG-ITGHMWBKSA-N 2 0 234.387 2.438 20 0 BEADRP C(CC1CCC1)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000709387376 712220465 /nfs/dbraw/zinc/22/04/65/712220465.db2.gz BGSZCKVSYMPSSP-FUNVUKJBSA-N 2 0 208.349 2.049 20 0 BEADRP CS[C@H]1CC[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000709413486 712221202 /nfs/dbraw/zinc/22/12/02/712221202.db2.gz FQWNQOJGZIFCOP-ZFLPAWGISA-N 2 0 240.416 2.143 20 0 BEADRP CCCCCC[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000709408927 712221460 /nfs/dbraw/zinc/22/14/60/712221460.db2.gz VDMYIJXFGXWFOC-FUNVUKJBSA-N 2 0 210.365 2.439 20 0 BEADRP CC(C)CC[N@@H+]1C[C@@H](C[NH3+])[C@H](C(F)(F)F)C1 ZINC000709795476 712227269 /nfs/dbraw/zinc/22/72/69/712227269.db2.gz RAOPMJCQJXMOQS-NXEZZACHSA-N 2 0 238.297 2.102 20 0 BEADRP [NH3+][C@@H]1C[C@H]2C[C@@H](C1)[N@H+](CCC1CCCC1)C2 ZINC000709824928 712228844 /nfs/dbraw/zinc/22/88/44/712228844.db2.gz GWDOSLWLFZKUML-MJBXVCDLSA-N 2 0 222.376 2.378 20 0 BEADRP [NH3+][C@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1cccc(F)c1)C2 ZINC000709835219 712229418 /nfs/dbraw/zinc/22/94/18/712229418.db2.gz HYHDLQRWDBBAPV-UBHSHLNASA-N 2 0 234.318 2.137 20 0 BEADRP C[NH+]1CCC(C[NH2+]C[C@]23C[C@H]2CCCC3)CC1 ZINC000710513061 712254158 /nfs/dbraw/zinc/25/41/58/712254158.db2.gz PPZULZPNMOCLFC-CABCVRRESA-N 2 0 236.403 2.498 20 0 BEADRP C[C@H](C[N@@H+]1CC[C@@H](CC[NH3+])C1)C(C)(C)C ZINC000710719907 712255198 /nfs/dbraw/zinc/25/51/98/712255198.db2.gz RPJWQVQZNOSAAL-VXGBXAGGSA-N 2 0 212.381 2.339 20 0 BEADRP C[N@H+](CCCCCC[NH3+])CC[C@@H]1CCCCO1 ZINC000710800738 712257582 /nfs/dbraw/zinc/25/75/82/712257582.db2.gz XUBXIKAWYKFHOI-AWEZNQCLSA-N 2 0 242.407 2.397 20 0 BEADRP C[C@@H](CC[NH2+][C@H]1C[C@@H]2CC[C@@H](C2)C1)[NH+](C)C ZINC000710931259 712266216 /nfs/dbraw/zinc/26/62/16/712266216.db2.gz QINSFXWXPNBOSZ-IGQOVBAYSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@@H]1C[C@@H]2CC[C@@H](C2)C1 ZINC000711071444 712278653 /nfs/dbraw/zinc/27/86/53/712278653.db2.gz RQZLGTYNXSELRR-YIYPIFLZSA-N 2 0 224.392 2.495 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+][C@H]2C[C@@H]3CC[C@@H](C3)C2)C1 ZINC000711204758 712289021 /nfs/dbraw/zinc/28/90/21/712289021.db2.gz TXJKOQQCAQSMJR-BARDWOONSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@]23CCC[C@H]2[NH2+]CC3)C1 ZINC000711234703 712290124 /nfs/dbraw/zinc/29/01/24/712290124.db2.gz IYGVWFPYIKAIMZ-XJFOESAGSA-N 2 0 222.376 2.297 20 0 BEADRP FC[C@H]1CC[N@H+](Cc2ccc3c(c2)C[NH2+]CC3)C1 ZINC000711511841 712307793 /nfs/dbraw/zinc/30/77/93/712307793.db2.gz FLWNALPTNBNEKH-CYBMUJFWSA-N 2 0 248.345 2.124 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@@H]2C=CCC2)CC1 ZINC000711670531 712315836 /nfs/dbraw/zinc/31/58/36/712315836.db2.gz VXHNCAYMNNGETC-GFCCVEGCSA-N 2 0 208.349 2.027 20 0 BEADRP CC(C)(C)[C@@H]1C[C@H]1[N@@H+]1CC[C@H](CC[NH3+])C1 ZINC000923479478 712334621 /nfs/dbraw/zinc/33/46/21/712334621.db2.gz PPLYVMANKANESH-QJPTWQEYSA-N 2 0 210.365 2.092 20 0 BEADRP [NH3+]CC[C@@H]1CC[N@@H+]([C@@H]2C[C@H]2c2ccccc2)C1 ZINC000923480398 712335141 /nfs/dbraw/zinc/33/51/41/712335141.db2.gz YATFFCCWMYOXCQ-VHDGCEQUSA-N 2 0 230.355 2.213 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+][C@H]1CCC[C@@H]2C[C@@H]21 ZINC000378907015 712366947 /nfs/dbraw/zinc/36/69/47/712366947.db2.gz ZNMRCCKAFUCEGM-RNJOBUHISA-N 2 0 210.365 2.105 20 0 BEADRP C[C@H]1CSCC[N@H+](C[C@@]2(C)CCC[NH2+]C2)C1 ZINC000379538598 712387816 /nfs/dbraw/zinc/38/78/16/712387816.db2.gz DRSYCTADWCUIAM-OLZOCXBDSA-N 2 0 242.432 2.061 20 0 BEADRP CC(C)[N@@H+]1CC[C@H](C[NH2+][C@H]2CC[C@H]2C)C1 ZINC000379780125 712398764 /nfs/dbraw/zinc/39/87/64/712398764.db2.gz BVGPYLXRIIYPNG-UPJWGTAASA-N 2 0 210.365 2.105 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@@H]2C[C@@H]3CCCC[C@H]23)C1 ZINC000712370881 712428306 /nfs/dbraw/zinc/42/83/06/712428306.db2.gz ANJWLCCQJNMVLR-MQLXINIDSA-N 2 0 222.376 2.425 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+][C@@H]2C[C@@H]3CCCC[C@H]23)C12CCC2 ZINC000712373208 712428343 /nfs/dbraw/zinc/42/83/43/712428343.db2.gz HAHRLCOTSUQVFN-QNSTZXKLSA-N 2 0 234.387 2.425 20 0 BEADRP C[N@H+](C[C@@H]1CCC2(CCC2)O1)CC(C)(C)C[NH3+] ZINC000712437662 712429666 /nfs/dbraw/zinc/42/96/66/712429666.db2.gz KDLFJPGNFGKVPW-LBPRGKRZSA-N 2 0 240.391 2.005 20 0 BEADRP C(C[C@@H]1C[C@H]1C1CC1)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000712643471 712439336 /nfs/dbraw/zinc/43/93/36/712439336.db2.gz PBEIOXLMRCYBDC-YYJFMHSASA-N 2 0 234.387 2.295 20 0 BEADRP C[NH+]1CCC(C[NH2+]CC[C@@H]2C[C@H]2C2CC2)CC1 ZINC000712640643 712439365 /nfs/dbraw/zinc/43/93/65/712439365.db2.gz JJOBDSSVEPPABN-CABCVRRESA-N 2 0 236.403 2.354 20 0 BEADRP C(C[C@@H]1C[C@H]1C1CC1)[NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2 ZINC000712677378 712440561 /nfs/dbraw/zinc/44/05/61/712440561.db2.gz ZYJRJGOPAUGYLT-TYSGWJLXSA-N 2 0 246.398 2.009 20 0 BEADRP CC(C)CC[N@@H+]1CC[NH2+]CCC12CCC2 ZINC000713166888 712453429 /nfs/dbraw/zinc/45/34/29/712453429.db2.gz GJECAXPGYUFQHD-UHFFFAOYSA-N 2 0 210.365 2.251 20 0 BEADRP C=C/C=C/CC[N@@H+](C)CC[C@@H]([NH3+])C(C)C ZINC000713736309 712470765 /nfs/dbraw/zinc/47/07/65/712470765.db2.gz TVYVSJCCSZIGSK-KTRBRXNASA-N 2 0 210.365 2.424 20 0 BEADRP C=C/C=C\CC[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000713742573 712471100 /nfs/dbraw/zinc/47/11/00/712471100.db2.gz ZIKRLWPUKSLLTE-TYHIMRJMSA-N 2 0 220.360 2.335 20 0 BEADRP C[C@@H]1C[N@H+](C[C@H]2CCCC(C)(C)O2)CC[C@@H]1[NH3+] ZINC000714368285 712484088 /nfs/dbraw/zinc/48/40/88/712484088.db2.gz LXBMOZOZVGYZEX-UPJWGTAASA-N 2 0 240.391 2.003 20 0 BEADRP CC(C)(C[NH3+])C1CC[NH+](C/C=C\Cl)CC1 ZINC000714414305 712485549 /nfs/dbraw/zinc/48/55/49/712485549.db2.gz SNESLANGRUDWPD-UTCJRWHESA-N 2 0 230.783 2.436 20 0 BEADRP CC(C)(C[NH3+])C1CC[NH+](C/C=C/Cl)CC1 ZINC000714414307 712485792 /nfs/dbraw/zinc/48/57/92/712485792.db2.gz SNESLANGRUDWPD-ZZXKWVIFSA-N 2 0 230.783 2.436 20 0 BEADRP CC(C)(C[NH3+])C1CC[NH+](CC2CCC2)CC1 ZINC000714415124 712485861 /nfs/dbraw/zinc/48/58/61/712485861.db2.gz VWMXZBVAKRPLSA-UHFFFAOYSA-N 2 0 224.392 2.483 20 0 BEADRP CCC1([NH3+])CC[NH+]([C@@H](C)C2CCC2)CC1 ZINC000714754814 712497998 /nfs/dbraw/zinc/49/79/98/712497998.db2.gz XZBSJVXWVRWMQY-NSHDSACASA-N 2 0 210.365 2.378 20 0 BEADRP [NH3+]CC[C@H]1CCC[N@H+](CC[C@@H]2C[C@H]2C2CC2)C1 ZINC000714930376 712500689 /nfs/dbraw/zinc/50/06/89/712500689.db2.gz ANWLNGSVTRJHDY-YUELXQCFSA-N 2 0 236.403 2.483 20 0 BEADRP C[C@H]([NH3+])C1CC[NH+](CC[C@@H]2C[C@H]2C2CC2)CC1 ZINC000714814000 712501233 /nfs/dbraw/zinc/50/12/33/712501233.db2.gz VYOFIGQBOMLAPI-GLQYFDAESA-N 2 0 236.403 2.482 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1cc[nH]n1 ZINC000036900037 712513293 /nfs/dbraw/zinc/51/32/93/712513293.db2.gz AEBLOLAIKFKZGV-GFCCVEGCSA-N 2 0 238.379 2.010 20 0 BEADRP CCOC[C@@H](C)[NH2+]C1CCC(C)([NH+](C)C)CC1 ZINC000715506512 712523955 /nfs/dbraw/zinc/52/39/55/712523955.db2.gz AKKMYTPHGYHDNH-IYXRBSQSSA-N 2 0 242.407 2.264 20 0 BEADRP CCC[C@H](C[NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1)OC ZINC000715532494 712526058 /nfs/dbraw/zinc/52/60/58/712526058.db2.gz MLNDFDKCAGEFDD-MGPQQGTHSA-N 2 0 242.407 2.264 20 0 BEADRP CC[C@](C)(C[NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1)OC ZINC000715543930 712527233 /nfs/dbraw/zinc/52/72/33/712527233.db2.gz OSFVEERIKZPQLK-BFHYXJOUSA-N 2 0 242.407 2.264 20 0 BEADRP CC[NH+]1CCC([NH2+]CC[C@H]2CCCS2)CC1 ZINC000715600041 712527679 /nfs/dbraw/zinc/52/76/79/712527679.db2.gz HXWSALWKJGZUEH-CYBMUJFWSA-N 2 0 242.432 2.346 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC[C@H]2CCCS2)CC[N@@H+]1C ZINC000715603382 712527860 /nfs/dbraw/zinc/52/78/60/712527860.db2.gz PZIIYVAFCABIHT-JHJVBQTASA-N 2 0 242.432 2.344 20 0 BEADRP C[NH+]1CCC(C[NH2+]CCCCC2CC2)CC1 ZINC000716327012 712554443 /nfs/dbraw/zinc/55/44/43/712554443.db2.gz VOEIHPPOGMHOGB-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP C(CCC1CC1)C[NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32 ZINC000716340225 712555569 /nfs/dbraw/zinc/55/55/69/712555569.db2.gz CUMWHIKFYYHHGQ-BTFPBAQTSA-N 2 0 234.387 2.153 20 0 BEADRP C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C[NH2+]CC1CC[NH+](C)CC1 ZINC000716580248 712564124 /nfs/dbraw/zinc/56/41/24/712564124.db2.gz GHQBPYHCQFGLOE-UQOMUDLDSA-N 2 0 236.403 2.210 20 0 BEADRP CC[N@H+](C)C[C@@H]1CC[NH+](CCCC2CC2)C1 ZINC000813335342 712587782 /nfs/dbraw/zinc/58/77/82/712587782.db2.gz AHENPZUPACKVIL-AWEZNQCLSA-N 2 0 224.392 2.450 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC[C@@H]2CC[C@@H]3C[C@@H]32)CC[N@@H+]1C ZINC000717097424 712630936 /nfs/dbraw/zinc/63/09/36/712630936.db2.gz OZWPQHSDTQBRGH-XLWJZTARSA-N 2 0 236.403 2.495 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+]C[C@@H]1C[NH2+]CCC1(F)F ZINC000717305465 712646004 /nfs/dbraw/zinc/64/60/04/712646004.db2.gz NVFCCPNPVNIXGJ-UWVGGRQHSA-N 2 0 232.318 2.009 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]C[C@@H]2CCC=CO2)c2ccccc21 ZINC000380030304 712683148 /nfs/dbraw/zinc/68/31/48/712683148.db2.gz YVCMSVADYWBNMR-GLQYFDAESA-N 2 0 244.338 2.414 20 0 BEADRP C1=CCCC([NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)CC1 ZINC000718019522 712736769 /nfs/dbraw/zinc/73/67/69/712736769.db2.gz OGFIROAVMCLREQ-KCQAQPDRSA-N 2 0 234.387 2.463 20 0 BEADRP C1=CCCC([NH2+][C@@H]2CCC[NH2+]CC2)CC1 ZINC000718067391 712740563 /nfs/dbraw/zinc/74/05/63/712740563.db2.gz MZXOLOVUMLVOPM-CYBMUJFWSA-N 2 0 208.349 2.217 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]C2CCC=CCC2)C1 ZINC000718065933 712740931 /nfs/dbraw/zinc/74/09/31/712740931.db2.gz DRGGMGUPPJMTGF-WCQYABFASA-N 2 0 208.349 2.345 20 0 BEADRP [NH3+]C1CCC([NH2+]C2CCC=CCC2)CC1 ZINC000718068535 712741086 /nfs/dbraw/zinc/74/10/86/712741086.db2.gz UBLIJCZOFVNZKC-UHFFFAOYSA-N 2 0 208.349 2.345 20 0 BEADRP C1=CCCC([NH2+][C@@H]2[C@H]3C[C@H]4C[NH2+][C@H]2[C@H]4C3)CC1 ZINC000718097838 712742730 /nfs/dbraw/zinc/74/27/30/712742730.db2.gz LSIOTDZKJQJJMA-RCZQDCHWSA-N 2 0 232.371 2.071 20 0 BEADRP CC(F)(F)CCC[N@@H+]1CC[C@]2(C1)CCC[NH2+]C2 ZINC000718610226 712772932 /nfs/dbraw/zinc/77/29/32/712772932.db2.gz HYLFLSYCFDPBJK-CYBMUJFWSA-N 2 0 246.345 2.497 20 0 BEADRP CC(F)(F)CCC[N@@H+]1C[C@@H]2CCC[C@@H]([NH3+])[C@@H]2C1 ZINC000718583525 712775639 /nfs/dbraw/zinc/77/56/39/712775639.db2.gz KRSJONZQHOAUDX-QJPTWQEYSA-N 2 0 246.345 2.481 20 0 BEADRP CCCC[NH2+]C[C@@H](C)C[NH+]1CCCCC1 ZINC000037997636 712798120 /nfs/dbraw/zinc/79/81/20/712798120.db2.gz KAHJELKYVBWVFM-CYBMUJFWSA-N 2 0 212.381 2.498 20 0 BEADRP C[C@@H](C[NH2+]CC1CC1)C[NH+]1CCCCC1 ZINC000038041988 712801404 /nfs/dbraw/zinc/80/14/04/712801404.db2.gz MEKDJBVVIVXABN-LBPRGKRZSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@H]1[C@@H](Nc2cc[nH+]c3ccccc23)CC[N@@H+]1C ZINC000719576714 712811736 /nfs/dbraw/zinc/81/17/36/712811736.db2.gz SEALIFJDIQULKP-AAEUAGOBSA-N 2 0 241.338 2.161 20 0 BEADRP CC1(C)C[NH2+]C[C@@H]1[NH2+]C1CCCCCC1 ZINC000720779078 712865490 /nfs/dbraw/zinc/86/54/90/712865490.db2.gz FLNCCTGARQNACD-LBPRGKRZSA-N 2 0 210.365 2.297 20 0 BEADRP CC(C)CC[N@@H+]1C[C@@H](C[NH3+])[C@@H](C(F)(F)F)C1 ZINC000720806744 712866799 /nfs/dbraw/zinc/86/67/99/712866799.db2.gz RAOPMJCQJXMOQS-ZJUUUORDSA-N 2 0 238.297 2.102 20 0 BEADRP [NH3+]C[C@H]1C[N@H+](CC2CC=CC2)C[C@H]1C(F)(F)F ZINC000720878444 712873000 /nfs/dbraw/zinc/87/30/00/712873000.db2.gz SRFYJVGKYQQGQN-WDEREUQCSA-N 2 0 248.292 2.022 20 0 BEADRP CCC(CC)C[N@@H+]1CCC[C@H]2[NH2+]CC[C@@H]21 ZINC000720905480 712876553 /nfs/dbraw/zinc/87/65/53/712876553.db2.gz YVLJQBCAOGWBMU-OLZOCXBDSA-N 2 0 210.365 2.249 20 0 BEADRP CC1(C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)CC(F)(F)C1 ZINC000720914197 712877815 /nfs/dbraw/zinc/87/78/15/712877815.db2.gz ZURGAUDYIOXEOR-VHSXEESVSA-N 2 0 232.318 2.281 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH+]2CC3(C2)CCCC3)C1 ZINC001208608175 957089544 /nfs/dbraw/zinc/08/95/44/957089544.db2.gz QYBFPXUGGSZWOB-ZDUSSCGKSA-N 2 0 222.376 2.204 20 0 BEADRP C[NH+](C)[C@H]1CCCN(c2[nH+]ccc3[nH]ccc32)C1 ZINC000647866492 721886366 /nfs/dbraw/zinc/88/63/66/721886366.db2.gz XBHJNCCYRJONFW-NSHDSACASA-N 2 0 244.342 2.093 20 0 BEADRP CSCCC[NH2+]C1CCC([NH+](C)C)CC1 ZINC000309072572 959575927 /nfs/dbraw/zinc/57/59/27/959575927.db2.gz GCXDPRMYBUFAIJ-UHFFFAOYSA-N 2 0 230.421 2.202 20 0 BEADRP CC(C)CC[C@H](C)[N@@H+]1C[C@H](C)[C@H](C[NH3+])C1 ZINC000708863860 959985532 /nfs/dbraw/zinc/98/55/32/959985532.db2.gz QOQCBHPDWUPNRH-RWMBFGLXSA-N 2 0 212.381 2.338 20 0 BEADRP C[C@@H]1C[C@@H]([N@H+](CC2CC2)C2CC2)CC[NH2+]1 ZINC000709465058 960608790 /nfs/dbraw/zinc/60/87/90/960608790.db2.gz NTKHILQHDOVNNL-MFKMUULPSA-N 2 0 208.349 2.001 20 0 BEADRP CC[C@@H](C)[N@H+](CC)C[C@H]1CCCC[NH2+]C1 ZINC000697040113 963668163 /nfs/dbraw/zinc/66/81/63/963668163.db2.gz HKEARXNAGHAXBQ-OLZOCXBDSA-N 2 0 212.381 2.497 20 0 BEADRP CCCC[C@H](C)[NH2+]CC[C@@H](C)[NH+](C)C ZINC000697868673 964596104 /nfs/dbraw/zinc/59/61/04/964596104.db2.gz CKOTXFUXPXHAKE-NWDGAFQWSA-N 2 0 200.370 2.495 20 0 BEADRP CC1(CC[NH2+][C@@H]2C[C@H]([NH3+])C23CCC3)CC1 ZINC000698118048 965017720 /nfs/dbraw/zinc/01/77/20/965017720.db2.gz ZPZHLJFJXWUKGQ-WDEREUQCSA-N 2 0 208.349 2.036 20 0 BEADRP C[C@H]([NH2+][C@H]1C=CCC1)C1CC[NH+](C)CC1 ZINC000698207357 965109102 /nfs/dbraw/zinc/10/91/02/965109102.db2.gz WLVFBEALUMOTGD-AAEUAGOBSA-N 2 0 208.349 2.025 20 0 BEADRP CC[C@H](CSC)[N@H+](C)C[C@H]1CC[C@@H]([NH3+])C1 ZINC000252764168 1165773287 /nfs/dbraw/zinc/77/32/87/1165773287.db2.gz HTNAWMLQUBPKDE-QJPTWQEYSA-N 2 0 230.421 2.187 20 0 BEADRP [NH3+]C[C@@H]1C[N@H+](C[C@H]2CC=CCC2)CCC1(F)F ZINC001205736242 967807857 /nfs/dbraw/zinc/80/78/57/967807857.db2.gz WVULZPXPEZYLIN-NWDGAFQWSA-N 2 0 244.329 2.259 20 0 BEADRP COc1cccc([C@@H]2CC[N@H+](CCCC[NH3+])C2)c1 ZINC000147553438 1165893781 /nfs/dbraw/zinc/89/37/81/1165893781.db2.gz DBLYDHOIONPFTP-CQSZACIVSA-N 2 0 248.370 2.223 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCC[C@@H](C[NH3+])[C@H](C)C1 ZINC001205981473 967918740 /nfs/dbraw/zinc/91/87/40/967918740.db2.gz DHSOUPLQCVPADU-XQQFMLRXSA-N 2 0 212.381 2.339 20 0 BEADRP C[N@H+](Cc1ccoc1)Cc1cccc(C[NH3+])c1 ZINC000042447811 1165918272 /nfs/dbraw/zinc/91/82/72/1165918272.db2.gz RJSSEPIIBAXFCI-UHFFFAOYSA-N 2 0 230.311 2.370 20 0 BEADRP C[N@@H+]1CC[C@@H](C[NH2+][C@@H]2CCCC(C)(C)C2)C1 ZINC000070628979 1165939944 /nfs/dbraw/zinc/93/99/44/1165939944.db2.gz ROPAHKDLQPTULG-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@H]([NH3+])CC2)cc1 ZINC000075144789 1165998030 /nfs/dbraw/zinc/99/80/30/1165998030.db2.gz MVRXJEUNAKMTQN-AWEZNQCLSA-N 2 0 218.344 2.308 20 0 BEADRP C[N@H+](CC1CC[NH2+]CC1)C[C@]1(C)CCCS1 ZINC000327476201 1166017716 /nfs/dbraw/zinc/01/77/16/1166017716.db2.gz KUTITSIABDOCBG-ZDUSSCGKSA-N 2 0 242.432 2.204 20 0 BEADRP CCCC[N@@H+]1C[C@@H]2CC[C@H]([NH+](C)C)C[C@H]2C1 ZINC001120281391 968558145 /nfs/dbraw/zinc/55/81/45/968558145.db2.gz CGCZXNPJCQLYRQ-IHRRRGAJSA-N 2 0 224.392 2.449 20 0 BEADRP CC[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCC[C@H]2C)C1 ZINC000252742632 1166054620 /nfs/dbraw/zinc/05/46/20/1166054620.db2.gz KHYVYHPGHHOWOG-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP C(C1CCCC1)[N@@H+]1CCCC[C@@]12CC[NH2+]C2 ZINC000257702724 1166072440 /nfs/dbraw/zinc/07/24/40/1166072440.db2.gz QLWBSVHSMWRTRJ-AWEZNQCLSA-N 2 0 222.376 2.395 20 0 BEADRP C[C@H]1CC[C@H]([NH2+]C[C@H]2C[NH2+]C[C@@H](C)C2)C1 ZINC000398777299 1166090195 /nfs/dbraw/zinc/09/01/95/1166090195.db2.gz HCNLDBWWCRWZKH-RVMXOQNASA-N 2 0 210.365 2.010 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2CC[C@@](C)(CF)C2)CC1 ZINC001207391698 968746609 /nfs/dbraw/zinc/74/66/09/968746609.db2.gz MHCNLPXOOMEHIM-ZDUSSCGKSA-N 2 0 228.355 2.010 20 0 BEADRP C[NH+]1CCC(CC[NH+]2CCC(F)(F)CC2)CC1 ZINC001207480010 968799013 /nfs/dbraw/zinc/79/90/13/968799013.db2.gz SRQTVRCGRNWXRB-UHFFFAOYSA-N 2 0 246.345 2.449 20 0 BEADRP C[C@H]1CCC[N@@H+]1CCC1CC[NH+](C)CC1 ZINC001207480082 968796150 /nfs/dbraw/zinc/79/61/50/968796150.db2.gz TYNHHRKTGPCMNR-LBPRGKRZSA-N 2 0 210.365 2.203 20 0 BEADRP C[NH+]1CCC(C)(C[NH+]2CC(C)(C)C2)CC1 ZINC001208104350 969003683 /nfs/dbraw/zinc/00/36/83/969003683.db2.gz MIOAFVOMBTZGEM-UHFFFAOYSA-N 2 0 210.365 2.060 20 0 BEADRP CCC[N@H+](CC)CC1(C)CC[NH+](C)CC1 ZINC001208104349 969003249 /nfs/dbraw/zinc/00/32/49/969003249.db2.gz MFVGBYDMKMKXMX-UHFFFAOYSA-N 2 0 212.381 2.450 20 0 BEADRP CC1(C)CC[C@@H]([NH2+]C[C@@]2(C)CCC[NH2+]2)C1 ZINC000129509792 1166197455 /nfs/dbraw/zinc/19/74/55/1166197455.db2.gz VGMOPPOWLYQCAH-DGCLKSJQSA-N 2 0 210.365 2.297 20 0 BEADRP c1cc([C@@H]2CCC[N@H+]2C[C@H]2CCC[NH2+]C2)ccn1 ZINC000250157895 1166202740 /nfs/dbraw/zinc/20/27/40/1166202740.db2.gz FHJOPBPSILEVKL-ZFWWWQNUSA-N 2 0 245.370 2.218 20 0 BEADRP CCCC[N@H+](CCC)C[C@H](O)C[NH+](CC)CC ZINC001253186300 969104055 /nfs/dbraw/zinc/10/40/55/969104055.db2.gz NJAWLDYWEAHDCU-CQSZACIVSA-N 2 0 244.423 2.201 20 0 BEADRP CC[NH+]1CCC(C[N@H+](C)C2CC(C)C2)CC1 ZINC001208593559 969151694 /nfs/dbraw/zinc/15/16/94/969151694.db2.gz WKXNIPLBAKQYAB-UHFFFAOYSA-N 2 0 224.392 2.449 20 0 BEADRP CCC[N@H+](CCOC)CC1CC[NH+](CC)CC1 ZINC001208595454 969152261 /nfs/dbraw/zinc/15/22/61/969152261.db2.gz UBALLJFVWCMXEJ-UHFFFAOYSA-N 2 0 242.407 2.077 20 0 BEADRP C[C@@H]1[C@H](C)C[N@H+](CCC2CC[NH2+]CC2)[C@H]1C ZINC000399640135 1166248534 /nfs/dbraw/zinc/24/85/34/1166248534.db2.gz XFCSWCROQSJSNW-UPJWGTAASA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1CCC[N@H+](C[C@@H]2CCC[NH+](C)C2)C1 ZINC001208604153 969159097 /nfs/dbraw/zinc/15/90/97/969159097.db2.gz LRJJKCUKDQCIGZ-CHWSQXEVSA-N 2 0 210.365 2.060 20 0 BEADRP CSCC[C@@H](C)[NH2+]CCC[NH+]1CCCC1 ZINC000228916690 1166266708 /nfs/dbraw/zinc/26/67/08/1166266708.db2.gz HLXBFOXGUZOQHW-GFCCVEGCSA-N 2 0 230.421 2.204 20 0 BEADRP CO[C@@H]1CCC[C@H]([N@H+](CCC[NH3+])C(C)C)C1 ZINC000226539041 1166288191 /nfs/dbraw/zinc/28/81/91/1166288191.db2.gz FCPFWIUHKPLWFT-QWHCGFSZSA-N 2 0 228.380 2.003 20 0 BEADRP C[C@H]1C[C@H]([N@H+](C)CCC[NH3+])CC(C)(C)C1 ZINC000227741945 1166307334 /nfs/dbraw/zinc/30/73/34/1166307334.db2.gz JKIWMZIRWASWGS-RYUDHWBXSA-N 2 0 212.381 2.482 20 0 BEADRP COc1ccc(C[N@H+](C)C[C@H]2CC[C@@H]([NH3+])C2)cc1 ZINC000227807347 1166331018 /nfs/dbraw/zinc/33/10/18/1166331018.db2.gz JCZHMCMURBXNDO-UONOGXRCSA-N 2 0 248.370 2.254 20 0 BEADRP CC[C@H](C)C[N@@H+]1CC[C@@H]2[NH2+]CCC[C@@H]2C1 ZINC000226917692 1166377680 /nfs/dbraw/zinc/37/76/80/1166377680.db2.gz AVFZLSJOPKRUME-XQQFMLRXSA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)(C)CC[N@@H+]1CC[C@H]2[NH2+]CCC[C@H]2C1 ZINC000250691867 1166422422 /nfs/dbraw/zinc/42/24/22/1166422422.db2.gz KBPLCYRFBKIEBP-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2CCCCC[C@H]2C)CC[NH2+]1 ZINC000252952867 1166448551 /nfs/dbraw/zinc/44/85/51/1166448551.db2.gz PWCBBFFZNBJJBI-JHJVBQTASA-N 2 0 210.365 2.391 20 0 BEADRP CO[C@H]1CC[C@@H]([NH2+][C@H]2CCC[N@H+](C)CC2)CC1 ZINC001254515569 969686383 /nfs/dbraw/zinc/68/63/83/969686383.db2.gz YNAMSNLIZSIUHO-MELADBBJSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@H]1CCC[N@@H+]([C@@H]2CCC[NH+](C)CC2)C1 ZINC001254516482 969693302 /nfs/dbraw/zinc/69/33/02/969693302.db2.gz MUROCHZCGBCAPW-QWHCGFSZSA-N 2 0 210.365 2.203 20 0 BEADRP CC(C)OCCCC[NH2+]CC1CC[NH+](C)CC1 ZINC000224988713 1166485572 /nfs/dbraw/zinc/48/55/72/1166485572.db2.gz CBRKDLWBGLDDJL-UHFFFAOYSA-N 2 0 242.407 2.123 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH+]2CCC(CF)CC2)CC1 ZINC001254523248 969704742 /nfs/dbraw/zinc/70/47/42/969704742.db2.gz MOJMADBQEZRDET-ZDUSSCGKSA-N 2 0 228.355 2.152 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH+]2CCC[C@@H](CF)C2)CC1 ZINC001254524668 969719593 /nfs/dbraw/zinc/71/95/93/969719593.db2.gz YIOFIXUNOWACDW-STQMWFEESA-N 2 0 228.355 2.152 20 0 BEADRP CC[C@@H]1CC[N@@H+]([C@H]2CCC[NH+](C)CC2)C1 ZINC001254534600 969730179 /nfs/dbraw/zinc/73/01/79/969730179.db2.gz YCQPUWBEDCTCOA-OLZOCXBDSA-N 2 0 210.365 2.203 20 0 BEADRP C(=C/C1CC1)\C[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000378861347 1166565571 /nfs/dbraw/zinc/56/55/71/1166565571.db2.gz QVVGXEKHXSEPPN-ZQBZMKNESA-N 2 0 220.360 2.169 20 0 BEADRP CC[C@@H](C)CC[NH2+][C@@H]1CCCN(CC)C1 ZINC000394448046 1166589103 /nfs/dbraw/zinc/58/91/03/1166589103.db2.gz JYDSHHZQANKWSV-CHWSQXEVSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+][C@@H](C)C1(Cl)CC1 ZINC000695665911 1166663327 /nfs/dbraw/zinc/66/33/27/1166663327.db2.gz FFLQEXAOHNDWED-UWVGGRQHSA-N 2 0 218.772 2.076 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CCCC(F)(F)F)CC[NH2+]1 ZINC000709317850 1166690912 /nfs/dbraw/zinc/69/09/12/1166690912.db2.gz HKOODRKZLQFAAN-DTWKUNHWSA-N 2 0 224.270 2.059 20 0 BEADRP C[C@@H]1CC[C@@H]([NH+]2CCC3(C[NH+](C)C3)CC2)C1 ZINC001170152940 970465292 /nfs/dbraw/zinc/46/52/92/970465292.db2.gz YGUNCFNNKPJRDL-CHWSQXEVSA-N 2 0 222.376 2.203 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCC[C@@]2(CCC[NH2+]C2)C1 ZINC000228080226 1166750529 /nfs/dbraw/zinc/75/05/29/1166750529.db2.gz YSNBNHRHEXZVCQ-UONOGXRCSA-N 2 0 224.392 2.498 20 0 BEADRP CCCOCC[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC000233225664 1166775938 /nfs/dbraw/zinc/77/59/38/1166775938.db2.gz DTUZQCDTTRGJRD-AGUYFDCRSA-N 2 0 240.391 2.018 20 0 BEADRP [NH3+]C1CC[NH+](C[C@H]2CC3CCC2CC3)CC1 ZINC000400139481 970558265 /nfs/dbraw/zinc/55/82/65/970558265.db2.gz ZSLHDVRUOQQWDK-WXRRBKDZSA-N 2 0 222.376 2.236 20 0 BEADRP C[NH2+]CC[C@H](C)[N@@H+]1CC[C@H]2CCCC[C@@H]2C1 ZINC000251157870 1166800991 /nfs/dbraw/zinc/80/09/91/1166800991.db2.gz BUBMBTSLYOJWRO-BFHYXJOUSA-N 2 0 224.392 2.497 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]C[C@@H]1CCO[C@@H]1C ZINC001255941000 970570730 /nfs/dbraw/zinc/57/07/30/970570730.db2.gz LDMKNHPDPUEEAM-MCIONIFRSA-N 2 0 242.407 2.121 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]CCCCCCO ZINC001255943658 970577058 /nfs/dbraw/zinc/57/70/58/970577058.db2.gz PPOUGFNDVYFKCF-CQSZACIVSA-N 2 0 244.423 2.249 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]CC1CC(OC)C1 ZINC001255954849 970582743 /nfs/dbraw/zinc/58/27/43/970582743.db2.gz JHNVHKJHGGPTFM-IYXRBSQSSA-N 2 0 242.407 2.121 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]C[C@@H]1CC(C)(C)O1 ZINC001255947589 970582817 /nfs/dbraw/zinc/58/28/17/970582817.db2.gz SXBLCPNRIYUXMQ-STQMWFEESA-N 2 0 242.407 2.264 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CC[N@@H+]([C@H]2CCc3c2cccc3F)C1 ZINC000252770687 1166833424 /nfs/dbraw/zinc/83/34/24/1166833424.db2.gz LEATTXCNFOHCNM-RWSFTLGLSA-N 2 0 248.345 2.482 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+][C@H]1C[C@@H]1C1CC1 ZINC001255954456 970589321 /nfs/dbraw/zinc/58/93/21/970589321.db2.gz DSRGRQFTQFCXJE-YUTCNCBUSA-N 2 0 224.392 2.495 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+][C@@H](CCO)C(C)C ZINC001255953166 970591479 /nfs/dbraw/zinc/59/14/79/970591479.db2.gz XVKUOPQZJYXGKJ-KGLIPLIRSA-N 2 0 244.423 2.103 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[N@H+](CC)CCOC ZINC001255955974 970594658 /nfs/dbraw/zinc/59/46/58/970594658.db2.gz YIUSGXCKHVTLLN-ZDUSSCGKSA-N 2 0 230.396 2.075 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCC1(C)C)C1CC[NH2+]CC1 ZINC000400561722 970603060 /nfs/dbraw/zinc/60/30/60/970603060.db2.gz HXYNDBFYNZNHPF-PWSUYJOCSA-N 2 0 210.365 2.153 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[N@H+](C)CC1(C)COC1 ZINC001255962905 970603327 /nfs/dbraw/zinc/60/33/27/970603327.db2.gz BWOVFNHSBYWAAQ-CYBMUJFWSA-N 2 0 242.407 2.075 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[N@H+](C)CC1(C)COC1 ZINC001255962906 970604843 /nfs/dbraw/zinc/60/48/43/970604843.db2.gz BWOVFNHSBYWAAQ-ZDUSSCGKSA-N 2 0 242.407 2.075 20 0 BEADRP C[N@@H+]1CC[C@@H](c2ccc(NC=[NH2+])cc2)C1 ZINC001167871650 1166879563 /nfs/dbraw/zinc/87/95/63/1166879563.db2.gz UGKNGAGZDFQLIE-LLVKDONJSA-N 2 0 203.289 2.125 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]Cc1ccc2c(c1)C[C@@H](C)O2 ZINC000925829539 1166879427 /nfs/dbraw/zinc/87/94/27/1166879427.db2.gz CKSVZUYSRFPBBL-QJPTWQEYSA-N 2 0 248.370 2.225 20 0 BEADRP CCSC[C@H](C)[N@H+](CC)CCC[NH+](C)C ZINC001173316885 975305442 /nfs/dbraw/zinc/30/54/42/975305442.db2.gz ZVBAVPLORMKHCB-LBPRGKRZSA-N 2 0 232.437 2.402 20 0 BEADRP Cc1ccc(OCC[N@H+]2CC[C@@H]([NH3+])C[C@H]2C)cc1 ZINC000228180088 1167115041 /nfs/dbraw/zinc/11/50/41/1167115041.db2.gz MPGOWJJYQHADGT-ZIAGYGMSSA-N 2 0 248.370 2.185 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2CCCC[C@H](C[NH3+])C2)C1 ZINC000308800139 1167200600 /nfs/dbraw/zinc/20/06/00/1167200600.db2.gz DJVGPPMTVMUBFL-UPJWGTAASA-N 2 0 210.365 2.236 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2CCCC[C@@H](C[NH3+])C2)C1 ZINC000308800136 1167201567 /nfs/dbraw/zinc/20/15/67/1167201567.db2.gz DJVGPPMTVMUBFL-AGIUHOORSA-N 2 0 210.365 2.236 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+][C@H]1CCSC1 ZINC000309044779 1167244770 /nfs/dbraw/zinc/24/47/70/1167244770.db2.gz NSHHPLAJFGSSND-NEPJUHHUSA-N 2 0 230.421 2.202 20 0 BEADRP C[C@H](Cc1ccco1)[NH2+]CC1CC[NH+](C)CC1 ZINC000054241425 1167309557 /nfs/dbraw/zinc/30/95/57/1167309557.db2.gz VDLYDPRYZLDWJX-GFCCVEGCSA-N 2 0 236.359 2.142 20 0 BEADRP C[C@H]1C[C@H]([N@H+]2C[C@H]3C[NH2+]CC[C@@H]3C2)C[C@@H](C)C1 ZINC000310489185 1167783573 /nfs/dbraw/zinc/78/35/73/1167783573.db2.gz FNVFLWZCHCGECK-KHMAMNHCSA-N 2 0 236.403 2.352 20 0 BEADRP CSCC[C@H](C)[NH2+][C@H]1CCN(C(C)C)C1 ZINC000134027269 1167826930 /nfs/dbraw/zinc/82/69/30/1167826930.db2.gz WEJFHWKECCBVPP-RYUDHWBXSA-N 2 0 230.421 2.200 20 0 BEADRP CCCC[C@H](CC)C[N@@H+]1C[C@@H]2C[NH2+]CC[C@@H]21 ZINC001235256720 979009757 /nfs/dbraw/zinc/00/97/57/979009757.db2.gz GKKHGQNUBMECQU-IHRRRGAJSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[N@H+](C)CC1)c1cccnc1 ZINC000086817289 1168313256 /nfs/dbraw/zinc/31/32/56/1168313256.db2.gz CYDDIDRXYKEDOO-GXTWGEPZSA-N 2 0 233.359 2.217 20 0 BEADRP CC[C@@H](C)C[C@H](CC)[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC000085282120 1168323789 /nfs/dbraw/zinc/32/37/89/1168323789.db2.gz JTUSFFHWBKBKNJ-MQYQWHSLSA-N 2 0 224.392 2.352 20 0 BEADRP CCCCCC[C@H](C)[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC000085282015 1168325477 /nfs/dbraw/zinc/32/54/77/1168325477.db2.gz LTWBYZHNBNIHMC-MELADBBJSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH+](C)CC(C)(C)CNc1cccc(C[NH3+])c1 ZINC001168768221 1168351272 /nfs/dbraw/zinc/35/12/72/1168351272.db2.gz RISPRSONMLGZQV-UHFFFAOYSA-N 2 0 235.375 2.145 20 0 BEADRP CCCC(CCC)[NH2+]C[C@H]1CC[N@H+](C)C1 ZINC000037484550 1168418810 /nfs/dbraw/zinc/41/88/10/1168418810.db2.gz QFBWTJWQNAFPPM-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP CC(C)CC[C@@H](C)[NH2+]C[C@@H]1CC[N@H+](C)C1 ZINC000037484736 1168418284 /nfs/dbraw/zinc/41/82/84/1168418284.db2.gz ARIUGHDZUNOUIH-OLZOCXBDSA-N 2 0 212.381 2.352 20 0 BEADRP C[N@H+]1CC[C@H]2C[NH+](CCCCF)C[C@H]2CC1 ZINC001278206849 980231649 /nfs/dbraw/zinc/23/16/49/980231649.db2.gz KUCKCWHZPUXGSJ-BETUJISGSA-N 2 0 228.355 2.010 20 0 BEADRP C[C@H]1CCC[C@H]([N@H+](C)CCC[NH+](C)C)C1 ZINC000337344932 1168459324 /nfs/dbraw/zinc/45/93/24/1168459324.db2.gz ZMYRPGAQZSZVOK-STQMWFEESA-N 2 0 212.381 2.449 20 0 BEADRP C(CC[NH+]1CCCC1)C[NH2+][C@@H]1CCCOCC1 ZINC001170776487 1168594913 /nfs/dbraw/zinc/59/49/13/1168594913.db2.gz QJTMSDHGNHAEGZ-CQSZACIVSA-N 2 0 240.391 2.021 20 0 BEADRP C[C@@H]1C[N@@H+](C2CCCC2)CCC[C@H]1C[NH3+] ZINC001246559490 1168650217 /nfs/dbraw/zinc/65/02/17/1168650217.db2.gz ANIRXWNIHJRNEN-NEPJUHHUSA-N 2 0 210.365 2.236 20 0 BEADRP C1CC[C@@H]2[C@H](C1)CCC[N@@H+]2[C@H]1CCC[NH2+]C1 ZINC000226109532 1168653865 /nfs/dbraw/zinc/65/38/65/1168653865.db2.gz HBTGAYJPEGRVRI-HZSPNIEDSA-N 2 0 222.376 2.393 20 0 BEADRP C[C@H]1C[C@H]([N@@H+]2C[C@@H]3CC[NH2+][C@@H]3C2)CC(C)(C)C1 ZINC001246651492 1168656956 /nfs/dbraw/zinc/65/69/56/1168656956.db2.gz LTCHPNJDYNGZNY-XDQVBPFNSA-N 2 0 236.403 2.495 20 0 BEADRP Cc1cc(C[N@@H+]2CC[C@@H](C[NH3+])[C@@H](C)C2)cs1 ZINC001350910550 982119110 /nfs/dbraw/zinc/11/91/10/982119110.db2.gz QKGUXDIZVFRXJM-GWCFXTLKSA-N 2 0 238.400 2.473 20 0 BEADRP C[C@H]1CC[C@H](C[NH3+])N(CCCC(F)(F)F)C1 ZINC001205807289 982574498 /nfs/dbraw/zinc/57/44/98/982574498.db2.gz ZNIQEHYDLXCXPS-VHSXEESVSA-N 2 0 238.297 2.388 20 0 BEADRP CC[NH+](CC)C1CC[NH+]([C@@H](C)CCOC)CC1 ZINC000088510965 1168920990 /nfs/dbraw/zinc/92/09/90/1168920990.db2.gz JNOHAFMDEQANLM-ZDUSSCGKSA-N 2 0 242.407 2.218 20 0 BEADRP CCCCOCC[N@@H+]1CCCC[C@H]1CC[NH3+] ZINC000082594414 983104039 /nfs/dbraw/zinc/10/40/39/983104039.db2.gz VBEHNUCSYRUUFS-ZDUSSCGKSA-N 2 0 228.380 2.006 20 0 BEADRP CS[C@@H]1CCC[C@@H]([NH2+]CCCN2CCC2)C1 ZINC001354171427 983183170 /nfs/dbraw/zinc/18/31/70/983183170.db2.gz QSEPLSNSTJCZRN-CHWSQXEVSA-N 2 0 242.432 2.346 20 0 BEADRP CCC[C@H](C)C[N@@H+]1C[C@H]2C[C@@]2(C[NH+](C)C)C1 ZINC001201553692 983311816 /nfs/dbraw/zinc/31/18/16/983311816.db2.gz OVTBOMXPRKHYNJ-BFHYXJOUSA-N 2 0 224.392 2.306 20 0 BEADRP CN1CCC[C@@H]2C[N@H+](CCC(C)(C)C)C[C@H]21 ZINC001202114627 983560569 /nfs/dbraw/zinc/56/05/69/983560569.db2.gz BWIUILIIOMWULD-CHWSQXEVSA-N 2 0 224.392 2.449 20 0 BEADRP CN1CCC([N@H+](C)CCCC(F)(F)F)CC1 ZINC001202367921 983643962 /nfs/dbraw/zinc/64/39/62/983643962.db2.gz GZVCVZDGHQTAGA-UHFFFAOYSA-N 2 0 238.297 2.355 20 0 BEADRP CO[C@H]1CC[C@H](C)[N@H+](CCCCCCC[NH3+])C1 ZINC000687197957 1169122735 /nfs/dbraw/zinc/12/27/35/1169122735.db2.gz UXZMLYLYFISVFH-KBPBESRZSA-N 2 0 242.407 2.395 20 0 BEADRP Cc1csc(C[NH+]2C[C@H]3C[N@H+](C)C[C@H]3C2)c1 ZINC001137158069 984003987 /nfs/dbraw/zinc/00/39/87/984003987.db2.gz CGONRQJGWPEZRY-TXEJJXNPSA-N 2 0 236.384 2.050 20 0 BEADRP CC(C)[NH+]1CCC(Oc2cccc(C[NH3+])c2)CC1 ZINC000203869238 1169263501 /nfs/dbraw/zinc/26/35/01/1169263501.db2.gz JNQVYJXMYUOBAP-UHFFFAOYSA-N 2 0 248.370 2.397 20 0 BEADRP CC(C)OCC[C@H](C)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC001172439082 974797095 /nfs/dbraw/zinc/79/70/95/974797095.db2.gz XSMKMYPTGNXKDR-UONOGXRCSA-N 2 0 242.407 2.121 20 0 BEADRP CC(C)OCC[C@H](C)[NH2+]C(C)(C)C(C)(C)[NH3+] ZINC001172441012 974798014 /nfs/dbraw/zinc/79/80/14/974798014.db2.gz KNGHOIZUQFKYHK-NSHDSACASA-N 2 0 230.396 2.296 20 0 BEADRP CC(C)COCC[C@H](C)[NH2+]CCCC[NH+](C)C ZINC001172460557 974826364 /nfs/dbraw/zinc/82/63/64/974826364.db2.gz PGYNZNDBZXWEHQ-AWEZNQCLSA-N 2 0 244.423 2.369 20 0 BEADRP CC[C@H](C)OCC[C@@H](C)[N@@H+]1CCC[C@@H]([NH3+])CC1 ZINC001246542247 972568397 /nfs/dbraw/zinc/56/83/97/972568397.db2.gz NZNJWVZWNMQXSB-HZSPNIEDSA-N 2 0 242.407 2.393 20 0 BEADRP C[C@@H]1C[C@@H]([N@@H+]2CCCC[C@H](C)C2)CC[NH2+]1 ZINC001246557333 972772756 /nfs/dbraw/zinc/77/27/56/972772756.db2.gz KOSKHMSFXIPAOB-XQQFMLRXSA-N 2 0 210.365 2.249 20 0 BEADRP CC(C)C[NH+]1CCC2(CC[N@H+](C)C2)CC1 ZINC000147037935 1169410800 /nfs/dbraw/zinc/41/08/00/1169410800.db2.gz POQPSRBQXINKTD-UHFFFAOYSA-N 2 0 210.365 2.060 20 0 BEADRP [NH3+]C[C@@H]1CCCC[N@H+](C[C@@H]2CC=CCC2)C1 ZINC000402202316 970769257 /nfs/dbraw/zinc/76/92/57/970769257.db2.gz FFNWMHXUHCUFJO-KGLIPLIRSA-N 2 0 222.376 2.404 20 0 BEADRP CCOC1CCC([N@H+](CCC[NH3+])C(C)C)CC1 ZINC001256429116 970833797 /nfs/dbraw/zinc/83/37/97/970833797.db2.gz APQNPYXFHCGFMW-UHFFFAOYSA-N 2 0 242.407 2.393 20 0 BEADRP CCOC1CCC([NH2+]C(C)(C)C(C)(C)[NH3+])CC1 ZINC001256432152 970837248 /nfs/dbraw/zinc/83/72/48/970837248.db2.gz SBRYDAWGEDJUKZ-UHFFFAOYSA-N 2 0 242.407 2.440 20 0 BEADRP CC[C@@H](C)[N@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001256624039 970890953 /nfs/dbraw/zinc/89/09/53/970890953.db2.gz PWAGAJCAABTMGH-FKJOKYEKSA-N 2 0 210.365 2.342 20 0 BEADRP CCCCC[N@@H+]1CCC(F)(F)[C@@H](C[NH3+])C1 ZINC000403233198 970897047 /nfs/dbraw/zinc/89/70/47/970897047.db2.gz NHQXOBKTNCSHFD-JTQLQIEISA-N 2 0 220.307 2.093 20 0 BEADRP c1cc(N2CCC([N@@H+]3C[C@@H]4C[C@@H]4C3)CC2)cc[nH+]1 ZINC001256857162 970995413 /nfs/dbraw/zinc/99/54/13/970995413.db2.gz PDIFRUVMEJLDNW-BETUJISGSA-N 2 0 243.354 2.002 20 0 BEADRP C[NH2+]CC1CC[NH+](CC=C(Cl)Cl)CC1 ZINC000403640691 971002371 /nfs/dbraw/zinc/00/23/71/971002371.db2.gz PBIOEJHOIAYKDL-UHFFFAOYSA-N 2 0 237.174 2.237 20 0 BEADRP C[NH+](C)CCCC[NH2+]C1C[C@H]2CC[C@@H](C1)S2 ZINC000403650627 971006753 /nfs/dbraw/zinc/00/67/53/971006753.db2.gz UMJVDDLDGSTHTC-YHWZYXNKSA-N 2 0 242.432 2.344 20 0 BEADRP CC(C)N(c1cc2[nH]ccc2c[nH+]1)[C@H]1CC[NH2+]C1 ZINC001158020580 971022582 /nfs/dbraw/zinc/02/25/82/971022582.db2.gz AAJZKPCJIAJNDL-LBPRGKRZSA-N 2 0 244.342 2.140 20 0 BEADRP CC[C@H]1C[N@H+](CCCCCC[NH3+])[C@@H](CC)CO1 ZINC000403731887 971033404 /nfs/dbraw/zinc/03/34/04/971033404.db2.gz BABZVGRCCDWKKW-KBPBESRZSA-N 2 0 242.407 2.395 20 0 BEADRP CC[C@@H]1C[N@H+](C[C@@H]2CC[C@H]([NH3+])C2)[C@@H](CC)CO1 ZINC000403760022 971048613 /nfs/dbraw/zinc/04/86/13/971048613.db2.gz AHIXBZJDBPBPAA-ZOBORPQBSA-N 2 0 240.391 2.003 20 0 BEADRP c1cc(C2=C[NH2+]CCC2)ccc1O[C@@H]1CC[NH2+]C1 ZINC001243952415 971053504 /nfs/dbraw/zinc/05/35/04/971053504.db2.gz OYEQLXYYNJNVDW-OAHLLOKOSA-N 2 0 244.338 2.152 20 0 BEADRP Cc1ccc(CNC2CC[NH+](C(C)C)CC2)n1C ZINC001257206160 971124801 /nfs/dbraw/zinc/12/48/01/971124801.db2.gz UNQKPVUJWMRBOJ-UHFFFAOYSA-N 2 0 249.402 2.296 20 0 BEADRP CC(C)[NH+]1CCC([NH+]2CCC(F)CC2)CC1 ZINC001257214026 971127728 /nfs/dbraw/zinc/12/77/28/971127728.db2.gz ZGGAIDDQAIUPIC-UHFFFAOYSA-N 2 0 228.355 2.293 20 0 BEADRP CC(C)[NH+]1CCC(N2CCC[C@H](F)C2)CC1 ZINC001257216809 971135588 /nfs/dbraw/zinc/13/55/88/971135588.db2.gz JCAAFWRNQFMRDL-LBPRGKRZSA-N 2 0 228.355 2.293 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]C2CCCCC2)C12CCC2 ZINC000404751815 971179404 /nfs/dbraw/zinc/17/94/04/971179404.db2.gz JFFMDPVMCWVFQR-VXGBXAGGSA-N 2 0 208.349 2.179 20 0 BEADRP CCC(CC)[NH+]1CC2(C1)CC[NH+](C)CC2 ZINC001257303653 971193256 /nfs/dbraw/zinc/19/32/56/971193256.db2.gz QHRVVUVCSHTOKR-UHFFFAOYSA-N 2 0 210.365 2.203 20 0 BEADRP COc1ccc(C[NH2+][C@@H]2C[C@@H]([NH3+])C23CCC3)cc1 ZINC000405208528 971206577 /nfs/dbraw/zinc/20/65/77/971206577.db2.gz HFDIVVGTVNEVAV-ZIAGYGMSSA-N 2 0 246.354 2.055 20 0 BEADRP CCC[C@@H](C)[NH+]1CCC2(C[NH+](C)C2)CC1 ZINC001257324207 971216568 /nfs/dbraw/zinc/21/65/68/971216568.db2.gz KRVMMMLYPVYNGD-GFCCVEGCSA-N 2 0 210.365 2.203 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]C[C@@H]2CC=CCC2)C12CCC2 ZINC000405248118 971218807 /nfs/dbraw/zinc/21/88/07/971218807.db2.gz BISZGXXGXUDMMA-JHJVBQTASA-N 2 0 220.360 2.202 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2C[C@@H]([NH3+])C23CCC3)s1 ZINC000405247856 971220770 /nfs/dbraw/zinc/22/07/70/971220770.db2.gz GQQFWZNKGUPBPE-NEPJUHHUSA-N 2 0 236.384 2.416 20 0 BEADRP CCC[C@@H](C)[N@H+](CCOC)C1CCN(C)CC1 ZINC001257321746 971222014 /nfs/dbraw/zinc/22/20/14/971222014.db2.gz VWYCIIKXVSJMKM-CYBMUJFWSA-N 2 0 242.407 2.218 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2C[C@H]([NH3+])C23CCC3)cc1 ZINC000405246780 971222066 /nfs/dbraw/zinc/22/20/66/971222066.db2.gz HUQWZRXFFWUXIV-UONOGXRCSA-N 2 0 230.355 2.355 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2C[C@@H]([NH3+])C23CCC3)cc1 ZINC000405246783 971223339 /nfs/dbraw/zinc/22/33/39/971223339.db2.gz HUQWZRXFFWUXIV-ZIAGYGMSSA-N 2 0 230.355 2.355 20 0 BEADRP C[C@H](Cc1ccco1)[NH2+][C@@H]1C[C@H]([NH3+])C12CCC2 ZINC000405282322 971227778 /nfs/dbraw/zinc/22/77/78/971227778.db2.gz CHNARPUXLOHGKV-KGYLQXTDSA-N 2 0 234.343 2.070 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+]C2CCC(F)(F)CC2)C12CCC2 ZINC000405264424 971228069 /nfs/dbraw/zinc/22/80/69/971228069.db2.gz QNPJUIUGMJPRAL-WDEREUQCSA-N 2 0 244.329 2.424 20 0 BEADRP Cc1ccccc1C[NH2+][C@@H]1C[C@H]([NH3+])C12CCC2 ZINC000405269583 971229189 /nfs/dbraw/zinc/22/91/89/971229189.db2.gz TZIJZUCUMQTCPS-UONOGXRCSA-N 2 0 230.355 2.355 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]CC2(C3CC3)CCC2)C12CCC2 ZINC000405329408 971238226 /nfs/dbraw/zinc/23/82/26/971238226.db2.gz VZBGTOAXUBXCLM-CHWSQXEVSA-N 2 0 234.387 2.426 20 0 BEADRP CC(C)OCCCC[NH2+][C@@H]1C[C@H]([NH3+])C12CCC2 ZINC000405358285 971242512 /nfs/dbraw/zinc/24/25/12/971242512.db2.gz SHCGVWLFNFDVCZ-QWHCGFSZSA-N 2 0 240.391 2.051 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+][C@@H]2CC[C@H]3C[C@H]3C2)C12CCC2 ZINC000405401957 971249444 /nfs/dbraw/zinc/24/94/44/971249444.db2.gz QMCACGGJRLEYOW-YYHQMBLXSA-N 2 0 220.360 2.035 20 0 BEADRP CC(C)=CCC[NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405380321 971250840 /nfs/dbraw/zinc/25/08/40/971250840.db2.gz IVSKCVHPYXSRNM-VXGBXAGGSA-N 2 0 208.349 2.202 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]CCC2CCC2)C12CCC2 ZINC000405430963 971251722 /nfs/dbraw/zinc/25/17/22/971251722.db2.gz AWKXXUKSMIHNGU-VXGBXAGGSA-N 2 0 208.349 2.036 20 0 BEADRP CCC(C)(C)C[NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405437917 971252094 /nfs/dbraw/zinc/25/20/94/971252094.db2.gz CSSGQADGYHJOEP-GHMZBOCLSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1C[C@H]([NH3+])C12CCC2 ZINC000405509884 971264098 /nfs/dbraw/zinc/26/40/98/971264098.db2.gz SNJXBVHCCRGBPH-NOOOWODRSA-N 2 0 208.349 2.035 20 0 BEADRP COc1cccc(C[NH2+][C@H]2C[C@H]([NH3+])C23CCC3)c1 ZINC000405493503 971264870 /nfs/dbraw/zinc/26/48/70/971264870.db2.gz PNMCXMSLJNLLOC-KBPBESRZSA-N 2 0 246.354 2.055 20 0 BEADRP CC1(C[NH2+][C@@H]2C[C@H]([NH3+])C23CCC3)CCC1 ZINC000405531749 971265122 /nfs/dbraw/zinc/26/51/22/971265122.db2.gz YICCTNBNAOTAEO-WDEREUQCSA-N 2 0 208.349 2.036 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405516199 971265775 /nfs/dbraw/zinc/26/57/75/971265775.db2.gz UQJLCHUSVDKOIX-OUAUKWLOSA-N 2 0 208.349 2.035 20 0 BEADRP COc1cccc(C[NH2+][C@@H]2C[C@H]([NH3+])C23CCC3)c1 ZINC000405493506 971266689 /nfs/dbraw/zinc/26/66/89/971266689.db2.gz PNMCXMSLJNLLOC-UONOGXRCSA-N 2 0 246.354 2.055 20 0 BEADRP CC[C@H](C)[NH2+][C@H]1CC[C@H]([NH+]2CCOCC2)CC1 ZINC001257432804 971340300 /nfs/dbraw/zinc/34/03/00/971340300.db2.gz AIENKDXAUWTTET-IHRRRGAJSA-N 2 0 240.391 2.018 20 0 BEADRP Cn1ccc2c1cc[nH+]c2NCC[C@H]1CCC[NH2+]1 ZINC001158628275 971351594 /nfs/dbraw/zinc/35/15/94/971351594.db2.gz BDRPUQMTFGMWDY-LLVKDONJSA-N 2 0 244.342 2.127 20 0 BEADRP C[C@]1(C[NH3+])CCCN(c2[nH+]ccc3[nH]ccc32)C1 ZINC001158675111 971386904 /nfs/dbraw/zinc/38/69/04/971386904.db2.gz ICIKWKNNWGLWJW-CQSZACIVSA-N 2 0 244.342 2.128 20 0 BEADRP C[C@@H]1C[NH2+]CCC[C@H]1OCc1ccccc1C[NH3+] ZINC001217781394 971404601 /nfs/dbraw/zinc/40/46/01/971404601.db2.gz RQEVJOOJZOTSQE-IUODEOHRSA-N 2 0 248.370 2.050 20 0 BEADRP C[C@H]1C[NH2+]CCC[C@@H]1OCc1cccc(C[NH3+])c1 ZINC001217778174 971400812 /nfs/dbraw/zinc/40/08/12/971400812.db2.gz KPVYGRRFTAQOFQ-WFASDCNBSA-N 2 0 248.370 2.050 20 0 BEADRP [NH3+]CCC1CCC([NH2+][C@@H]2CCCSC2)CC1 ZINC001257664911 971464259 /nfs/dbraw/zinc/46/42/59/971464259.db2.gz RIIFPTGNIAJSGU-WXRRBKDZSA-N 2 0 242.432 2.379 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]1OCc1ccc(C[NH3+])cc1 ZINC001217878064 971472805 /nfs/dbraw/zinc/47/28/05/971472805.db2.gz RPXFEDPMWUOUMV-AWEZNQCLSA-N 2 0 248.370 2.050 20 0 BEADRP C[NH+](C)CC1CC[NH+]([C@H]2CCCSC2)CC1 ZINC001257678698 971481006 /nfs/dbraw/zinc/48/10/06/971481006.db2.gz XGCVCWYADHETNB-ZDUSSCGKSA-N 2 0 242.432 2.156 20 0 BEADRP C[C@H]1C[NH2+]CCC[C@H]1Oc1ccc2c(c1)C[NH2+]C2 ZINC001217989098 971561319 /nfs/dbraw/zinc/56/13/19/971561319.db2.gz LZCCFBIJPBUDBM-XHDPSFHLSA-N 2 0 246.354 2.057 20 0 BEADRP C[C@H]([NH3+])c1ccc(O[C@@H]2CC[NH2+]CC[C@H]2C)cc1 ZINC001218034117 971578286 /nfs/dbraw/zinc/57/82/86/971578286.db2.gz LYWHCHQUBUNMGG-TYNCELHUSA-N 2 0 248.370 2.473 20 0 BEADRP [NH3+]Cc1ccccc1O[C@@H]1CCC[C@@]12CC[NH2+]C2 ZINC001218089471 971597399 /nfs/dbraw/zinc/59/73/99/971597399.db2.gz FUHJXMLZRXIFQQ-CABCVRRESA-N 2 0 246.354 2.056 20 0 BEADRP [NH3+]Cc1ccc(O[C@@H]2CCC23CC[NH2+]CC3)cc1 ZINC001218079077 971597782 /nfs/dbraw/zinc/59/77/82/971597782.db2.gz CMQVOOJDJLYNEI-CQSZACIVSA-N 2 0 246.354 2.056 20 0 BEADRP C[NH2+][C@H]1CC[C@H](Oc2ccccc2C[NH3+])CC1 ZINC001218187380 971619791 /nfs/dbraw/zinc/61/97/91/971619791.db2.gz FWMBBVBKCIOUNN-JOCQHMNTSA-N 2 0 234.343 2.055 20 0 BEADRP C[NH2+][C@H]1CC[C@H](Oc2ccc(CC[NH3+])cc2)CC1 ZINC001218186709 971621300 /nfs/dbraw/zinc/62/13/00/971621300.db2.gz GRJNPONLDOGNGW-CTYIDZIISA-N 2 0 248.370 2.097 20 0 BEADRP Cc1ccccc1C[NH+]1CCC(F)(C[NH3+])CC1 ZINC001222531618 972536386 /nfs/dbraw/zinc/53/63/86/972536386.db2.gz FFLGBOGUOQVPCY-UHFFFAOYSA-N 2 0 236.334 2.258 20 0 BEADRP CC(C)[N@H+](CCC[NH3+])[C@@H]1C[C@@H]2[C@H](C1)C2(C)C ZINC001170716135 971635725 /nfs/dbraw/zinc/63/57/25/971635725.db2.gz PFAGJODHIWOWPI-XYYAHUGASA-N 2 0 224.392 2.480 20 0 BEADRP [NH3+]Cc1cccc(OC2CC3(C2)CCC[NH2+]C3)c1 ZINC001218254957 971651493 /nfs/dbraw/zinc/65/14/93/971651493.db2.gz KSVKYTAMNUJPLF-UHFFFAOYSA-N 2 0 246.354 2.056 20 0 BEADRP [NH3+]Cc1cccc(OC2CCC3(C[NH2+]C3)CC2)c1 ZINC001218263127 971666390 /nfs/dbraw/zinc/66/63/90/971666390.db2.gz XJQJHTYNBALNNZ-UHFFFAOYSA-N 2 0 246.354 2.056 20 0 BEADRP C[C@H]1CCC[N@H+](C[C@@]2(C)CCC[NH2+]C2)CC1 ZINC000216861641 971676839 /nfs/dbraw/zinc/67/68/39/971676839.db2.gz VXOJCELMRUMVMI-KBPBESRZSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H](c1cccc(O[C@@H]2CCC[NH2+]C2)c1)[NH+](C)C ZINC001218283065 971677302 /nfs/dbraw/zinc/67/73/02/971677302.db2.gz DMRUUBUJZHSMIJ-SWLSCSKDSA-N 2 0 248.370 2.440 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]1Oc1ccc2c(c1)C[NH2+]C2 ZINC001218316332 971701860 /nfs/dbraw/zinc/70/18/60/971701860.db2.gz PXRIGLKCGSIDDM-AWEZNQCLSA-N 2 0 246.354 2.057 20 0 BEADRP C[C@@H]([NH3+])c1ccc(O[C@@H]2CC[NH2+]CC2(C)C)cc1 ZINC001218317895 971705631 /nfs/dbraw/zinc/70/56/31/971705631.db2.gz RJXUNRHUVKKDRT-BXUZGUMPSA-N 2 0 248.370 2.473 20 0 BEADRP C[NH+]1CC2(C1)CC[NH+]([C@H]1C[C@@H]3[C@H](C1)C3(C)C)CC2 ZINC001170764048 971748726 /nfs/dbraw/zinc/74/87/26/971748726.db2.gz GEPVVFNNXJKHQQ-BTTYYORXSA-N 2 0 248.414 2.449 20 0 BEADRP C[C@@H]([NH3+])c1ccc(O[C@H]2C[NH2+]CCC23CC3)cc1 ZINC001218408696 971781913 /nfs/dbraw/zinc/78/19/13/971781913.db2.gz LXXLNKGXELNETI-RISCZKNCSA-N 2 0 246.354 2.227 20 0 BEADRP CCCC[N@H+](C)CCC[NH2+][C@@H]1CCCOCC1 ZINC001170775748 971800186 /nfs/dbraw/zinc/80/01/86/971800186.db2.gz LSTIWFAZXZWPRF-CQSZACIVSA-N 2 0 242.407 2.267 20 0 BEADRP Cc1csc(C[N@@H+]2CC[C@H]([NH3+])[C@@H](F)CC2)c1 ZINC001206163806 974511939 /nfs/dbraw/zinc/51/19/39/974511939.db2.gz GCTDDVXZXGKPLO-RYUDHWBXSA-N 2 0 242.363 2.318 20 0 BEADRP CC/C=C\CCC[NH+]1CCC(F)(C[NH3+])CC1 ZINC001222527518 972538650 /nfs/dbraw/zinc/53/86/50/972538650.db2.gz NEKFXQSRFOCXBL-ARJAWSKDSA-N 2 0 228.355 2.496 20 0 BEADRP C[C@H](Cc1ccco1)[N@@H+]1CCC[C@H]([NH3+])CC1 ZINC001246539077 972533536 /nfs/dbraw/zinc/53/35/36/972533536.db2.gz ATHBRRKLTHOCDE-NEPJUHHUSA-N 2 0 222.332 2.024 20 0 BEADRP CCC(CC)C[NH+]1CCC(F)(C[NH3+])CC1 ZINC001222527211 972543994 /nfs/dbraw/zinc/54/39/94/972543994.db2.gz JTLUJTZTGADPAM-UHFFFAOYSA-N 2 0 216.344 2.185 20 0 BEADRP C[C@@H]1CC[N@@H+]1Cc1cc(F)cc(C[NH+](C)C)c1 ZINC001232145040 1169682175 /nfs/dbraw/zinc/68/21/75/1169682175.db2.gz SLVFXMCDMHIPFX-LLVKDONJSA-N 2 0 236.334 2.482 20 0 BEADRP CCCCCC[C@@H](CCC)[NH2+]C[C@@H](O)C[NH3+] ZINC001172379217 974586375 /nfs/dbraw/zinc/58/63/75/974586375.db2.gz SEHFZEBJFJVBAT-OLZOCXBDSA-N 2 0 230.396 2.035 20 0 BEADRP [NH3+]C[C@@H]1CCCC[N@H+](Cc2cccc(F)c2)C1 ZINC000310567359 971975803 /nfs/dbraw/zinc/97/58/03/971975803.db2.gz YCHLTTFHXNSNJI-ZDUSSCGKSA-N 2 0 236.334 2.387 20 0 BEADRP COc1cccc(C[N@@H+]2CCCC[C@H](C[NH3+])C2)c1 ZINC000310990098 971990469 /nfs/dbraw/zinc/99/04/69/971990469.db2.gz GMISDKWDFFTVEP-CQSZACIVSA-N 2 0 248.370 2.256 20 0 BEADRP Cc1c2[nH+]c[nH]c2ccc1NCC[C@@H](C)[NH3+] ZINC001170891345 972046594 /nfs/dbraw/zinc/04/65/94/972046594.db2.gz USTXNDWPGDXVHV-MRVPVSSYSA-N 2 0 218.304 2.021 20 0 BEADRP C[C@@H]([NH3+])CCNc1cc(OC(C)(C)C)cc[nH+]1 ZINC001170895318 972051548 /nfs/dbraw/zinc/05/15/48/972051548.db2.gz RLMGBYDJFWXFQI-SNVBAGLBSA-N 2 0 237.347 2.408 20 0 BEADRP Cc1cc(C)c(C)c(N[C@H]([NH3+])CCC[NH3+])c1C ZINC001170899303 972061980 /nfs/dbraw/zinc/06/19/80/972061980.db2.gz AAWYLPXVWFZFBU-ZDUSSCGKSA-N 2 0 235.375 2.356 20 0 BEADRP Cc1cc(Cl)cc(C)c1N[C@@H]([NH3+])CCC[NH3+] ZINC001170898989 972062226 /nfs/dbraw/zinc/06/22/26/972062226.db2.gz GCFGQKLSJZYVSG-LLVKDONJSA-N 2 0 241.766 2.392 20 0 BEADRP [NH3+]CCC[C@@H]([NH3+])Nc1cccc2c1CCCC2 ZINC001170900432 972064389 /nfs/dbraw/zinc/06/43/89/972064389.db2.gz UCBOHPYHESHRGY-AWEZNQCLSA-N 2 0 233.359 2.001 20 0 BEADRP Cc1ccc(Cl)c(C)c1N[C@H]([NH3+])CCC[NH3+] ZINC001170902517 972077183 /nfs/dbraw/zinc/07/71/83/972077183.db2.gz FJURYPLHLZUUHU-NSHDSACASA-N 2 0 241.766 2.392 20 0 BEADRP CC1(C)[C@@H]2C[C@H]([NH2+][C@H]3CCCC[NH2+]C3)C[C@@H]21 ZINC001246089285 972143824 /nfs/dbraw/zinc/14/38/24/972143824.db2.gz BXGYQIFFZOUUMM-RVMXOQNASA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H](CC1CC1)[NH2+]C[C@@H]1CCC[NH2+][C@H]1C ZINC001246104970 972166576 /nfs/dbraw/zinc/16/65/76/972166576.db2.gz AHJLHNOECIPFFY-MDZLAQPJSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]1CC[C@@H](C[NH2+]C2CCCCC2)[NH2+]C1 ZINC001246115081 972176593 /nfs/dbraw/zinc/17/65/93/972176593.db2.gz QUABTAXVDRDLMV-AAEUAGOBSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1[NH2+]CCC[C@@H]1C[NH2+][C@H]1C[C@@H]2[C@H](C1)C2(C)C ZINC001246112007 972177978 /nfs/dbraw/zinc/17/79/78/972177978.db2.gz QEZLZMJXUPUWBL-VJTDZRGJSA-N 2 0 236.403 2.399 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]C[C@@H]2C[NH2+]CC[C@H]2C)C1 ZINC001246112260 972174409 /nfs/dbraw/zinc/17/44/09/972174409.db2.gz NLBAXZRBFZVIGX-MQYQWHSLSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H]1C[NH2+]C[C@H]1[NH2+][C@H]1C[C@@H](C)CC(C)(C)C1 ZINC001246116496 972181010 /nfs/dbraw/zinc/18/10/10/972181010.db2.gz MRTLBRBZQWCLME-MROQNXINSA-N 2 0 224.392 2.399 20 0 BEADRP CCCC[C@H](CC)[NH2+][C@H]1C[NH2+]CC12CC2 ZINC001246133534 972190368 /nfs/dbraw/zinc/19/03/68/972190368.db2.gz OEJBEZRYJIXBNA-RYUDHWBXSA-N 2 0 210.365 2.297 20 0 BEADRP Cc1ccccc1OCC[NH2+][C@H]1CC[NH2+][C@@H](C)C1 ZINC001246168273 972202794 /nfs/dbraw/zinc/20/27/94/972202794.db2.gz JMJWXITZQOXZOE-KBPBESRZSA-N 2 0 248.370 2.104 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@H]2C[C@H]([NH3+])C2)CC(C)(C)C1 ZINC001246190706 972211312 /nfs/dbraw/zinc/21/13/12/972211312.db2.gz RRESNSRJXWDVKA-DDHJBXDOSA-N 2 0 210.365 2.281 20 0 BEADRP C[C@H]1C[C@H]([NH2+][C@H]2C[C@H]([NH3+])C2)CC(C)(C)C1 ZINC001246190704 972213489 /nfs/dbraw/zinc/21/34/89/972213489.db2.gz RRESNSRJXWDVKA-BJDJZHNGSA-N 2 0 210.365 2.281 20 0 BEADRP CC(C)COCC[C@@H](C)[NH2+]C[C@H]1CCC[NH2+]C1 ZINC001246199572 972216409 /nfs/dbraw/zinc/21/64/09/972216409.db2.gz XFZHUXCMNWYPDO-KGLIPLIRSA-N 2 0 242.407 2.027 20 0 BEADRP CS[C@H](C)CC[N@@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC001208154606 957033402 /nfs/dbraw/zinc/03/34/02/957033402.db2.gz MVEPZLSYFWHMFU-CHWSQXEVSA-N 2 0 242.432 2.156 20 0 BEADRP CSC1CC[NH+](C[C@]2(C)CCC[NH2+]C2)CC1 ZINC000300796439 957045839 /nfs/dbraw/zinc/04/58/39/957045839.db2.gz DVECYADFJNMLDU-CYBMUJFWSA-N 2 0 242.432 2.204 20 0 BEADRP C[C@@H]1C[C@@H](C)C[NH+](C[C@@H]2CCC[N@H+](C)C2)C1 ZINC001208612294 957096140 /nfs/dbraw/zinc/09/61/40/957096140.db2.gz MFVXODISJGBEEM-MGPQQGTHSA-N 2 0 224.392 2.306 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH+]2CCC[C@H](CF)C2)C1 ZINC001208613671 957105268 /nfs/dbraw/zinc/10/52/68/957105268.db2.gz XORMEPLPFXMULV-OLZOCXBDSA-N 2 0 228.355 2.010 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH+]2CCC[C@@H](CF)C2)C1 ZINC001208613673 957106637 /nfs/dbraw/zinc/10/66/37/957106637.db2.gz XORMEPLPFXMULV-STQMWFEESA-N 2 0 228.355 2.010 20 0 BEADRP COc1ccc(C(C)(C)[NH2+]C2CC[NH2+]CC2)cc1 ZINC001246237887 972244620 /nfs/dbraw/zinc/24/46/20/972244620.db2.gz JOUTZBLFYBJRNS-UHFFFAOYSA-N 2 0 248.370 2.272 20 0 BEADRP Cc1cc(N2CC[NH+](C[C@H]3C[C@H]3C)CC2)cc[nH+]1 ZINC001209426250 957449399 /nfs/dbraw/zinc/44/93/99/957449399.db2.gz JSWOKBWMTZICGK-TZMCWYRMSA-N 2 0 245.370 2.168 20 0 BEADRP CCCC[C@@H]1C[C@H](NCC[C@H]([NH3+])CC)CC[NH2+]1 ZINC001246308889 972269684 /nfs/dbraw/zinc/26/96/84/972269684.db2.gz SXJYMRBJMWSILC-MGPQQGTHSA-N 2 0 241.423 2.014 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@H]1CCc2cccc(F)c2C1 ZINC001246313133 972272260 /nfs/dbraw/zinc/27/22/60/972272260.db2.gz JELPRQPPPPJQMM-NEPJUHHUSA-N 2 0 236.334 2.010 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@@H]1CCc2c(F)cccc2C1 ZINC001246311424 972273047 /nfs/dbraw/zinc/27/30/47/972273047.db2.gz CLTFSTUHWMKUOE-VXGBXAGGSA-N 2 0 236.334 2.010 20 0 BEADRP C[C@@H](Cc1ccco1)[NH2+]C[C@H]1CC[C@@H](C)[NH2+]C1 ZINC000397523283 957663392 /nfs/dbraw/zinc/66/33/92/957663392.db2.gz FZOUKTXISBNQFP-AGIUHOORSA-N 2 0 236.359 2.188 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@H]2CC[C@H](C)[NH2+]C2)C1 ZINC000397535112 957678933 /nfs/dbraw/zinc/67/89/33/957678933.db2.gz OJPMJGGSUIIWTO-VOAKCMCISA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H](CC(F)(F)F)[NH2+]C[C@H]1CC[C@@H](C)[NH2+]C1 ZINC000397530380 957681588 /nfs/dbraw/zinc/68/15/88/957681588.db2.gz YGMIKZRYSUENLA-UTLUCORTSA-N 2 0 238.297 2.305 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+][C@@H]2CC[C@@H](C)NC2)CC1 ZINC001246365964 972306249 /nfs/dbraw/zinc/30/62/49/972306249.db2.gz WBDZXLQYWUOUOZ-FVCCEPFGSA-N 2 0 210.365 2.295 20 0 BEADRP [NH3+]CCN1CCCC[C@@H]1c1ccccc1 ZINC000164937155 957890732 /nfs/dbraw/zinc/89/07/32/957890732.db2.gz KDWJZXNHQCXEQP-CYBMUJFWSA-N 2 0 204.317 2.172 20 0 BEADRP CC(C)C1CCC([NH2+][C@H]2CC23C[NH2+]C3)CC1 ZINC001246442274 972315305 /nfs/dbraw/zinc/31/53/05/972315305.db2.gz COMMKTYJOVIAAJ-BPCQOVAHSA-N 2 0 222.376 2.153 20 0 BEADRP CC(C)C1CCC([NH2+][C@@H]2CC23C[NH2+]C3)CC1 ZINC001246442275 972315836 /nfs/dbraw/zinc/31/58/36/972315836.db2.gz COMMKTYJOVIAAJ-WXRRBKDZSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H]1CC([NH2+][C@H]2C[C@@](C)([NH3+])C2)C[C@H](C)C1 ZINC001246458507 972329800 /nfs/dbraw/zinc/32/98/00/972329800.db2.gz HAKYSZJHASUFHR-WFFHOREQSA-N 2 0 210.365 2.281 20 0 BEADRP CCCC[C@H](C)[NH2+]C[C@@H]1C[NH2+]C[C@@H](C)C1 ZINC000398720951 958372669 /nfs/dbraw/zinc/37/26/69/958372669.db2.gz AYWDCGKCEZKRIC-AVGNSLFASA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H](Cc1ccco1)[NH2+]C[C@H]1C[NH2+]C[C@@H](C)C1 ZINC000398805630 958394083 /nfs/dbraw/zinc/39/40/83/958394083.db2.gz PHFDSOQEVYHZHT-RWMBFGLXSA-N 2 0 236.359 2.046 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@H]2CCc3sccc32)CC[NH2+]1 ZINC001246475210 972347072 /nfs/dbraw/zinc/34/70/72/972347072.db2.gz SLSPOPSQMMRRHO-SCVCMEIPSA-N 2 0 236.384 2.466 20 0 BEADRP CC[C@H](C)OCC[C@@H](C)[NH2+][C@H]1CCCC[C@H]1[NH3+] ZINC001246474700 972348346 /nfs/dbraw/zinc/34/83/46/972348346.db2.gz AWXKVOIMSAAQEX-RQJABVFESA-N 2 0 242.407 2.440 20 0 BEADRP COc1cccc([C@@H](C)C[NH2+]C2CC[NH2+]CC2)c1 ZINC001246502229 972359191 /nfs/dbraw/zinc/35/91/91/972359191.db2.gz UMZSMXWRLMZWNL-LBPRGKRZSA-N 2 0 248.370 2.140 20 0 BEADRP C[C@H]1C[C@@H]([N@@H+]2CCC23CCCC3)CC[NH2+]1 ZINC000707627662 958634056 /nfs/dbraw/zinc/63/40/56/958634056.db2.gz RRRVYQWPEYYIDB-RYUDHWBXSA-N 2 0 208.349 2.145 20 0 BEADRP CCC[NH+](CCC)C[C@@H]1CCCC[NH2+]C1 ZINC000308815987 958745907 /nfs/dbraw/zinc/74/59/07/958745907.db2.gz IMJCJBXEOFIEBV-CYBMUJFWSA-N 2 0 212.381 2.498 20 0 BEADRP C[C@H]([NH2+]C[C@]12C[C@H]1CCC2)C1CC[NH+](C)CC1 ZINC000693546478 958757289 /nfs/dbraw/zinc/75/72/89/958757289.db2.gz UESSQEMOGSAYLW-CFVMTHIKSA-N 2 0 236.403 2.497 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)S3)C1 ZINC000403674972 958788256 /nfs/dbraw/zinc/78/82/56/958788256.db2.gz PTVHJVIJVCTUQU-XQHREUISSA-N 2 0 240.416 2.273 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]C[C@@]23C[C@@H]2CCCC3)C12CCC2 ZINC000693563978 958813870 /nfs/dbraw/zinc/81/38/70/958813870.db2.gz FEVZPEZSDYYZAX-RFQIPJPRSA-N 2 0 234.387 2.426 20 0 BEADRP [NH3+]CC[C@H]1CC[N@H+](Cc2cccc(F)c2F)C1 ZINC000690738448 958857009 /nfs/dbraw/zinc/85/70/09/958857009.db2.gz HPIUWMWPCARBOS-JTQLQIEISA-N 2 0 240.297 2.136 20 0 BEADRP CCC1(C)CC[NH+](C[C@H]2C[C@@H]([NH3+])C2)CC1 ZINC000693579254 958870580 /nfs/dbraw/zinc/87/05/80/958870580.db2.gz OIPJBCMBXCJBIS-TXEJJXNPSA-N 2 0 210.365 2.236 20 0 BEADRP CC[C@@H]1CCC[N@H+](C[C@H]2C[C@@H]([NH3+])C2)CC1 ZINC000693581720 958870906 /nfs/dbraw/zinc/87/09/06/958870906.db2.gz ZYVOLOHKHKHJGE-UPJWGTAASA-N 2 0 210.365 2.236 20 0 BEADRP C[C@H](Cc1ccccn1)[NH2+]CC[C@@H]1CCC[N@@H+]1C ZINC000707961854 958881232 /nfs/dbraw/zinc/88/12/32/958881232.db2.gz VMONDLYLFQKGSE-HIFRSBDPSA-N 2 0 247.386 2.087 20 0 BEADRP C[C@@H](c1cccs1)[N@H+](C)C[C@H]1C[C@@H]([NH3+])C1 ZINC000693593226 958908154 /nfs/dbraw/zinc/90/81/54/958908154.db2.gz UTMYMIMRGPJGOV-GARJFASQSA-N 2 0 224.373 2.478 20 0 BEADRP Cc1ccc(-n2cccc2C[NH3+])c(C[NH+](C)C)c1 ZINC001167595982 959001474 /nfs/dbraw/zinc/00/14/74/959001474.db2.gz PMWBLJUXRDQWMG-UHFFFAOYSA-N 2 0 243.354 2.306 20 0 BEADRP C1=C[C@@H]2C[C@H]1C[C@@H]2C[N@@H+]1CCC[C@]12CCC[NH2+]C2 ZINC001222231888 972413623 /nfs/dbraw/zinc/41/36/23/972413623.db2.gz QJNLKQFBMNSXBZ-JJXSEGSLSA-N 2 0 246.398 2.417 20 0 BEADRP C1=C[C@@H]2C[C@H]1C[C@H]2C[N@@H+]1CCC[C@@]12CCC[NH2+]C2 ZINC001222231891 972413846 /nfs/dbraw/zinc/41/38/46/972413846.db2.gz QJNLKQFBMNSXBZ-XUWVNRHRSA-N 2 0 246.398 2.417 20 0 BEADRP [NH3+]CC[C@H]1CC[N@H+](C[C@H]2CCC(F)(F)C2)C1 ZINC000300952079 959385394 /nfs/dbraw/zinc/38/53/94/959385394.db2.gz OKCHGWJKYFRSME-QWRGUYRKSA-N 2 0 232.318 2.093 20 0 BEADRP CC(C)C[C@H](C)C[N@@H+]1CC[C@H](CC[NH3+])C1 ZINC000300993780 959489532 /nfs/dbraw/zinc/48/95/32/959489532.db2.gz WAEHFIHHWDFJQL-STQMWFEESA-N 2 0 212.381 2.339 20 0 BEADRP C[C@@H]1C[NH2+]CCC[C@H]1OCCCCCCC[NH3+] ZINC001217776062 959586845 /nfs/dbraw/zinc/58/68/45/959586845.db2.gz FDHXIOSMNPRMCX-ZIAGYGMSSA-N 2 0 242.407 2.300 20 0 BEADRP C[NH+](C)CC[C@H](OCCC[NH3+])c1cccs1 ZINC001217833718 959629654 /nfs/dbraw/zinc/62/96/54/959629654.db2.gz YMENHVVXGYVAEL-NSHDSACASA-N 2 0 242.388 2.106 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000309002549 959629958 /nfs/dbraw/zinc/62/99/58/959629958.db2.gz ZNMRCCKAFUCEGM-FVCCEPFGSA-N 2 0 210.365 2.105 20 0 BEADRP C[N@H+](CC1CC[NH+](C)CC1)C1CC(F)(F)C1 ZINC001207391623 959635787 /nfs/dbraw/zinc/63/57/87/959635787.db2.gz JIBFQYRPXANWOM-UHFFFAOYSA-N 2 0 232.318 2.058 20 0 BEADRP CCCCN1CCC[C@]2(CCCC[NH2+]2)C1 ZINC001222385315 972451037 /nfs/dbraw/zinc/45/10/37/972451037.db2.gz JKFOXORPXPRSKG-CYBMUJFWSA-N 2 0 210.365 2.395 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CCC[C@@]2(CCCC[NH2+]2)C1 ZINC001222384810 972451355 /nfs/dbraw/zinc/45/13/55/972451355.db2.gz AALPXTKBUHDCHN-MCIONIFRSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@H]1C[N@@H+](C2CCCCCC2)C[C@H]1C[NH3+] ZINC000708830348 959860035 /nfs/dbraw/zinc/86/00/35/959860035.db2.gz LPQMUIRYIALSHR-NWDGAFQWSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@H]([NH3+])c1ccc(O[C@@H]2CC[C@]23CC[NH2+]C3)cc1 ZINC001218126143 959870164 /nfs/dbraw/zinc/87/01/64/959870164.db2.gz YVPLRBDGKWYPFK-NILFDRSVSA-N 2 0 246.354 2.227 20 0 BEADRP Cc1ccc(C[N@@H+]2CCCC[C@H](C[NH3+])C2)o1 ZINC000309488517 959886975 /nfs/dbraw/zinc/88/69/75/959886975.db2.gz XQIZROQWJRQICI-GFCCVEGCSA-N 2 0 222.332 2.149 20 0 BEADRP [NH3+]CC12CC(C1)C[N@@H+]2C[C@H]1CC2CCC1CC2 ZINC000694602265 959933576 /nfs/dbraw/zinc/93/35/76/959933576.db2.gz BUHWRFDWJXARFS-WRHSUISWSA-N 2 0 234.387 2.236 20 0 BEADRP C[NH+]1CCC(C[NH2+]C[C@@H]2CCC[C@H]3C[C@H]32)CC1 ZINC000694689098 959968479 /nfs/dbraw/zinc/96/84/79/959968479.db2.gz FVSQZAVGTCVNFR-SOUVJXGZSA-N 2 0 236.403 2.354 20 0 BEADRP C[C@H]1C[N@H+](CC2(c3ccccc3)CC2)C[C@H]1C[NH3+] ZINC000708872991 959995109 /nfs/dbraw/zinc/99/51/09/959995109.db2.gz XUYOUKHCVOWTCU-UONOGXRCSA-N 2 0 244.382 2.245 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+][C@H]1CCCC2(CC2)C1 ZINC000695690576 960375638 /nfs/dbraw/zinc/37/56/38/960375638.db2.gz ODAMBDIBVMIXFX-QWHCGFSZSA-N 2 0 240.391 2.053 20 0 BEADRP C1CC12CCC([NH2+][C@@H]1[C@H]3C[C@H]4C[NH2+][C@H]1[C@H]4C3)CC2 ZINC000695766816 960445035 /nfs/dbraw/zinc/44/50/35/960445035.db2.gz CWWZODHHJOFCCG-RCZQDCHWSA-N 2 0 246.398 2.295 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[NH2+][C@@H](C)C1)C1CCCC1 ZINC000709264534 960464351 /nfs/dbraw/zinc/46/43/51/960464351.db2.gz IFNUUSONVZECMX-GVXVVHGQSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H](C[NH2+][C@H]1C[C@H]([NH3+])C12CCC2)c1ccccn1 ZINC000692744339 960564131 /nfs/dbraw/zinc/56/41/31/960564131.db2.gz GBJVNHFLEWBTOZ-XBFCOCLRSA-N 2 0 245.370 2.045 20 0 BEADRP C1CC2(C1)CC([NH2+]C1C[C@H]3CC[C@@H](C1)[NH2+]3)C2 ZINC000709444468 960615212 /nfs/dbraw/zinc/61/52/12/960615212.db2.gz BTXIDVGEBFNALK-FOSCPWQOSA-N 2 0 220.360 2.192 20 0 BEADRP C[C@@H](C[NH3+])C[N@H+](C)[C@H]1CCCC(C)(C)C1 ZINC000709525823 960633869 /nfs/dbraw/zinc/63/38/69/960633869.db2.gz RTKRSYRGDVFZRW-RYUDHWBXSA-N 2 0 212.381 2.482 20 0 BEADRP Cc1cc(C)cc(C[N@@H+]2CC[C@H](CC[NH3+])C2)c1 ZINC000125535616 960834405 /nfs/dbraw/zinc/83/44/05/960834405.db2.gz DENFXVDDTNQMRG-AWEZNQCLSA-N 2 0 232.371 2.474 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CC[C@@H](OC)C1 ZINC001167826135 961159684 /nfs/dbraw/zinc/15/96/84/961159684.db2.gz MVALTROYWCVYNB-UONOGXRCSA-N 2 0 242.407 2.218 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CC[C@@H](OC)C1 ZINC001167826136 961161825 /nfs/dbraw/zinc/16/18/25/961161825.db2.gz MVALTROYWCVYNB-ZIAGYGMSSA-N 2 0 242.407 2.218 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[N@H+](C)C1(C)COC1 ZINC001167838111 961223539 /nfs/dbraw/zinc/22/35/39/961223539.db2.gz QHSAMZVRNIFOCB-ZDUSSCGKSA-N 2 0 242.407 2.218 20 0 BEADRP C[N@@H+]1CC[C@]2(CC[NH+](C[C@H]3C[C@H]4C=C[C@@H]3C4)C2)C1 ZINC001207631436 961395972 /nfs/dbraw/zinc/39/59/72/961395972.db2.gz HQBPBKHHLRZSMD-JJXSEGSLSA-N 2 0 246.398 2.226 20 0 BEADRP CCCC[N@H+](C)CCC[NH2+][C@@H]1C[C@H]2C[C@H]2C1 ZINC001167899406 961538513 /nfs/dbraw/zinc/53/85/13/961538513.db2.gz ZVDABTCHFSKJQV-BTTYYORXSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH+](C)CCC(C)(C)[NH2+][C@H]1C[C@H]2C[C@H]2C1 ZINC001167905456 961739404 /nfs/dbraw/zinc/73/94/04/961739404.db2.gz NADKVBYNZSUCCA-GDNZZTSVSA-N 2 0 210.365 2.105 20 0 BEADRP C[N@H+](CC1CCC2(CC2)CC1)C1CC([NH3+])C1 ZINC000696195565 961862895 /nfs/dbraw/zinc/86/28/95/961862895.db2.gz NYXQYHBHWYAOJN-UHFFFAOYSA-N 2 0 222.376 2.378 20 0 BEADRP CC[C@H](C)CC[NH2+][C@@H]1C[C@H]([NH3+])C12CCC2 ZINC000696212223 961868464 /nfs/dbraw/zinc/86/84/64/961868464.db2.gz BMQQRORQNITNLN-SDDRHHMPSA-N 2 0 210.365 2.282 20 0 BEADRP Cc1c(O)cccc1C[N@@H+]1CCCC[C@H](C[NH3+])C1 ZINC001206632374 962121193 /nfs/dbraw/zinc/12/11/93/962121193.db2.gz JZEPOAXPFLAELJ-CYBMUJFWSA-N 2 0 248.370 2.261 20 0 BEADRP Cc1cc(O)cc(C[N@@H+]2CCCC[C@H](C[NH3+])C2)c1 ZINC001206632344 962127577 /nfs/dbraw/zinc/12/75/77/962127577.db2.gz JIBAJXHIDRLDOF-CYBMUJFWSA-N 2 0 248.370 2.261 20 0 BEADRP C[N@H+](CC1CC[NH+](C)CC1)[C@@H]1C[C@H]2C[C@H]2C1 ZINC001167939978 962162225 /nfs/dbraw/zinc/16/22/25/962162225.db2.gz OGRFYPNKNQJCSN-BTTYYORXSA-N 2 0 222.376 2.059 20 0 BEADRP CCC[C@H](C)C[NH+]1CC2(C1)CCC[NH2+]C2 ZINC000710012514 962213009 /nfs/dbraw/zinc/21/30/09/962213009.db2.gz BPUKZGGJRITGSP-LBPRGKRZSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@@H]1CC[NH2+]C[C@@H]1C[NH2+][C@H]1CCC(C)(C)C1 ZINC000710684566 962440809 /nfs/dbraw/zinc/44/08/09/962440809.db2.gz GPJWPNAURAZYRM-UPJWGTAASA-N 2 0 224.392 2.400 20 0 BEADRP C[NH+]1CCC2(CC[N@@H+]([C@H]3C[C@H]4C[C@H]4C3)C2)CC1 ZINC001167950598 962629983 /nfs/dbraw/zinc/62/99/83/962629983.db2.gz CZQZXEIMSSRBOS-WDNDVIMCSA-N 2 0 234.387 2.203 20 0 BEADRP C[C@H]1C[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167959898 962842184 /nfs/dbraw/zinc/84/21/84/962842184.db2.gz UMYZOAQTMHNCJC-ASJAARPFSA-N 2 0 234.387 2.390 20 0 BEADRP C[C@@H]([NH3+])CCNc1ccc2c([nH+]1)CCCC2 ZINC000712372919 962872599 /nfs/dbraw/zinc/87/25/99/962872599.db2.gz WNFXMDXRVNWTRM-SNVBAGLBSA-N 2 0 219.332 2.110 20 0 BEADRP CC(C)(C)C(=[NH2+])Nc1ccc2c(n1)CC[NH2+]C2 ZINC001155176283 963000661 /nfs/dbraw/zinc/00/06/61/963000661.db2.gz XJESSRXVJYJQOZ-UHFFFAOYSA-N 2 0 232.331 2.163 20 0 BEADRP C(C1CC1)[N@H+]1[C@@H]2CC[C@H]1CC([NH+]1CCCC1)C2 ZINC001167981760 963067496 /nfs/dbraw/zinc/06/74/96/963067496.db2.gz ITLKQQNEFNXSHV-YIONKMFJSA-N 2 0 234.387 2.488 20 0 BEADRP C[N@H+](C1CC1)C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1 ZINC001167984460 963077232 /nfs/dbraw/zinc/07/72/32/963077232.db2.gz OXWJVGYARZBMHY-YIONKMFJSA-N 2 0 234.387 2.486 20 0 BEADRP Cc1ccc(N2C[C@H]3C[C@@]3(C[NH+](C)C)C2)[nH+]c1C ZINC001156385457 963330556 /nfs/dbraw/zinc/33/05/56/963330556.db2.gz LTVIBGHFRDNGMI-UKRRQHHQSA-N 2 0 245.370 2.086 20 0 BEADRP CC1(C)CC([NH3+])CC(C)(C)N1c1cc(N)cc[nH+]1 ZINC001156772346 963458027 /nfs/dbraw/zinc/45/80/27/963458027.db2.gz BOLPMNZJBIKSSA-UHFFFAOYSA-N 2 0 248.374 2.149 20 0 BEADRP CC[NH+](CC)CCCC[NH2+][C@@H]1CCO[C@H](C)C1 ZINC001168072527 963605101 /nfs/dbraw/zinc/60/51/01/963605101.db2.gz SWNIQTKOQLWWNN-ZIAGYGMSSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@@H]([N@H+](C)C[C@@H]1CCCC[NH2+]C1)C1(C)CC1 ZINC000697013834 963640139 /nfs/dbraw/zinc/64/01/39/963640139.db2.gz AIHCYNJVRWHKCY-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]([N@H+](C)C[C@H]1CCCC[NH2+]C1)C1(C)CC1 ZINC000697013849 963640174 /nfs/dbraw/zinc/64/01/74/963640174.db2.gz AIHCYNJVRWHKCY-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CC[C@@H]([NH+](C)C)CC2)CCO1 ZINC001168100451 963705770 /nfs/dbraw/zinc/70/57/70/963705770.db2.gz CRQOQLCAKZPSIV-SYQHCUMBSA-N 2 0 240.391 2.016 20 0 BEADRP c1cc2c[nH+]c(NCC[C@H]3CCC[NH2+]3)cc2[nH]1 ZINC001158629379 963899181 /nfs/dbraw/zinc/89/91/81/963899181.db2.gz XMZHKUPEOCHJFC-LLVKDONJSA-N 2 0 230.315 2.117 20 0 BEADRP COc1cc[nH+]c(NC(C)(C)CC[NH+](C)C)c1 ZINC001158753872 963914346 /nfs/dbraw/zinc/91/43/46/963914346.db2.gz KJTYUGWKUJAKJV-UHFFFAOYSA-N 2 0 237.347 2.232 20 0 BEADRP C[N@@H+]1CCC[C@H]1CC[NH2+]C1CCCCC1 ZINC000822123799 963938123 /nfs/dbraw/zinc/93/81/23/963938123.db2.gz FKEVXQBYXGVUAV-ZDUSSCGKSA-N 2 0 210.365 2.393 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]CC[C@H]1CCC[N@@H+]1C ZINC000822123673 963938788 /nfs/dbraw/zinc/93/87/88/963938788.db2.gz ABJLJEBALCUXQJ-WCQYABFASA-N 2 0 210.365 2.249 20 0 BEADRP Cn1ccc2c1[nH+]ccc2NC1(C)CC[NH2+]CC1 ZINC001168187626 963946334 /nfs/dbraw/zinc/94/63/34/963946334.db2.gz FKHLUBXIJQOFKR-UHFFFAOYSA-N 2 0 244.342 2.127 20 0 BEADRP Cc1cnc(CC[NH3+])n1C1CCC(C)CC1 ZINC001168196672 963964344 /nfs/dbraw/zinc/96/43/44/963964344.db2.gz KICYPZUAEWHEFU-UHFFFAOYSA-N 2 0 221.348 2.444 20 0 BEADRP c1cc2c(cc1NC1=CCC[NH2+]CC1)C[NH2+]CC2 ZINC001159615314 964134810 /nfs/dbraw/zinc/13/48/10/964134810.db2.gz CSAJQIWJFAWAFT-UHFFFAOYSA-N 2 0 243.354 2.012 20 0 BEADRP CC[NH+](CC)Cc1ccccc1-n1c[nH+]cc1N ZINC001211989244 964138806 /nfs/dbraw/zinc/13/88/06/964138806.db2.gz LPUWCGBYMIIJTE-UHFFFAOYSA-N 2 0 244.342 2.296 20 0 BEADRP CC(C)c1ccc(NCC[C@@H](C)[NH3+])nc1 ZINC001159772645 964186146 /nfs/dbraw/zinc/18/61/46/964186146.db2.gz IDAVDPXGOSSSQC-SNVBAGLBSA-N 2 0 207.321 2.354 20 0 BEADRP CC[NH2+]Cc1cccc(NC2=CC[NH2+]CC2)c1 ZINC001159956119 964232823 /nfs/dbraw/zinc/23/28/23/964232823.db2.gz SFSWITQKTRIARX-UHFFFAOYSA-N 2 0 231.343 2.085 20 0 BEADRP C[NH+](C)C1CCC([NH2+]C[C@@H]2CC(C)(C)O2)CC1 ZINC001168298427 964389260 /nfs/dbraw/zinc/38/92/60/964389260.db2.gz SOMSDECMVRFCNJ-BPCQOVAHSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@H]1CC[N@@H+](C2CCC([NH+](C)C)CC2)C1 ZINC001168313407 964422680 /nfs/dbraw/zinc/42/26/80/964422680.db2.gz BRUIXRFDXKCXNC-HIFPTAJRSA-N 2 0 210.365 2.201 20 0 BEADRP C[C@@H]1CCC[N@@H+]1C1CCC([NH+](C)C)CC1 ZINC001168315959 964435828 /nfs/dbraw/zinc/43/58/28/964435828.db2.gz SJNXCQNRJHUYOU-PNESKVBLSA-N 2 0 210.365 2.344 20 0 BEADRP CC(C)(C)[C@H](C[NH3+])Nc1[nH+]ccc2[nH]ccc21 ZINC001160912302 964441505 /nfs/dbraw/zinc/44/15/05/964441505.db2.gz JENPEGLFFGUQCB-NSHDSACASA-N 2 0 232.331 2.348 20 0 BEADRP C[NH+](C)C1CCC([N@@H+]2CCn3cccc3C2)CC1 ZINC001168322989 964445733 /nfs/dbraw/zinc/44/57/33/964445733.db2.gz LSTJEGDIRPZDFF-UHFFFAOYSA-N 2 0 247.386 2.177 20 0 BEADRP CC(C)[C@@H]1C[C@H]([NH2+]CC[C@H](C)[NH+](C)C)CCO1 ZINC000697824947 964547820 /nfs/dbraw/zinc/54/78/20/964547820.db2.gz DKGLEQFJOPLZNX-MJBXVCDLSA-N 2 0 242.407 2.120 20 0 BEADRP C[C@H](CC[NH2+][C@H]1CCC[C@@H]2C[C@@H]21)[NH+](C)C ZINC000697869829 964596724 /nfs/dbraw/zinc/59/67/24/964596724.db2.gz IXSHDOMEIHBGTQ-NDBYEHHHSA-N 2 0 210.365 2.105 20 0 BEADRP C[NH+](C)CCCCNc1cccc2c1CC[C@H]2[NH3+] ZINC001161730619 964719895 /nfs/dbraw/zinc/71/98/95/964719895.db2.gz MMVYLHSFPMNPJR-CQSZACIVSA-N 2 0 247.386 2.386 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H](Nc2c[nH+]cc3cc[nH]c32)C1 ZINC001162396446 964954523 /nfs/dbraw/zinc/95/45/23/964954523.db2.gz JJMOZTVQHVQLDO-GHMZBOCLSA-N 2 0 230.315 2.245 20 0 BEADRP Cc1cc2[nH+]ccn2cc1N[C@@H]1CCC[C@@H]([NH3+])C1 ZINC001162400126 964959612 /nfs/dbraw/zinc/95/96/12/964959612.db2.gz GJZOCKBJBPKWDF-VXGBXAGGSA-N 2 0 244.342 2.325 20 0 BEADRP C[C@H]1C[NH2+]CCC[C@@H]1CNc1cccc(C[NH3+])c1 ZINC001162457129 964983608 /nfs/dbraw/zinc/98/36/08/964983608.db2.gz MVMJKLZOJRRYGC-GXTWGEPZSA-N 2 0 247.386 2.193 20 0 BEADRP CC(C)(C)C(=[NH2+])Nc1[nH+]ccc2c1CCN2 ZINC001162656811 965093511 /nfs/dbraw/zinc/09/35/11/965093511.db2.gz DAZCVUDOTARGHQ-UHFFFAOYSA-N 2 0 218.304 2.485 20 0 BEADRP CC1(C)[C@@H]2C[N@H+](C3CC[NH+](CC4CC4)CC3)C[C@@H]21 ZINC001168387793 965110508 /nfs/dbraw/zinc/11/05/08/965110508.db2.gz UPQIDGJSEKEFBS-GASCZTMLSA-N 2 0 248.414 2.449 20 0 BEADRP CSCC[N@H+](C)C1CC[NH+](CC2CC2)CC1 ZINC001168388105 965116787 /nfs/dbraw/zinc/11/67/87/965116787.db2.gz BHJCZBBOVONSRV-UHFFFAOYSA-N 2 0 242.432 2.156 20 0 BEADRP C[C@H]([NH3+])c1ccc2c(ccn2-c2c[nH+]cn2C)c1 ZINC001162910600 965206837 /nfs/dbraw/zinc/20/68/37/965206837.db2.gz VCLPYNYSCFNZFN-JTQLQIEISA-N 2 0 240.310 2.384 20 0 BEADRP CC(C)[N@@H+]1CC[C@H](Nc2cccc(N)[nH+]2)[C@H](C)C1 ZINC001163365410 965370999 /nfs/dbraw/zinc/37/09/99/965370999.db2.gz ZVKAJMURYHKZIO-NEPJUHHUSA-N 2 0 248.374 2.195 20 0 BEADRP CCCC[C@H](CC)[NH2+]CCSCC[NH3+] ZINC001257413224 1169869663 /nfs/dbraw/zinc/86/96/63/1169869663.db2.gz UQVDYDIHBIXZPQ-NSHDSACASA-N 2 0 218.410 2.237 20 0 BEADRP Cc1c(F)cccc1C[N@@H+]1CCC[C@H]([NH3+])CC1 ZINC001205093661 965716124 /nfs/dbraw/zinc/71/61/24/965716124.db2.gz DIPTWDYKOJHNRW-ZDUSSCGKSA-N 2 0 236.334 2.447 20 0 BEADRP CC(C)N(CCC[NH3+])c1cccc2c1CC[C@H]2[NH3+] ZINC001164128712 965749878 /nfs/dbraw/zinc/74/98/78/965749878.db2.gz DOWNPSAWWHBXSE-CQSZACIVSA-N 2 0 247.386 2.196 20 0 BEADRP [NH3+][C@@H]1CCC[N@H+](Cc2cc3ccccc3[nH]2)CC1 ZINC001205101193 965801345 /nfs/dbraw/zinc/80/13/45/965801345.db2.gz BFYXYLSSWRTQPA-CYBMUJFWSA-N 2 0 243.354 2.481 20 0 BEADRP C(C[N@@H+]1CC[C@H]2C[C@H]2C1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000699265298 965831831 /nfs/dbraw/zinc/83/18/31/965831831.db2.gz IEJPUDIGWNIMFR-FIEDHZCBSA-N 2 0 234.387 2.249 20 0 BEADRP Cc1c[nH+]c(N2C[C@H](C[NH3+])CC[C@H]2C)cc1C ZINC001164474579 965895939 /nfs/dbraw/zinc/89/59/39/965895939.db2.gz SBZMHFACJRXZBQ-OLZOCXBDSA-N 2 0 233.359 2.262 20 0 BEADRP CC/C=C\CCC[N@@H+]1C[C@H](C)[C@H](C[NH3+])C1 ZINC001205131227 965935882 /nfs/dbraw/zinc/93/58/82/965935882.db2.gz VAPSSOOSRBXRTC-OEFFGFFESA-N 2 0 210.365 2.259 20 0 BEADRP CC[C@@H](C)C[N@@H+]1CCCC[C@]12CC[NH2+]C2 ZINC001235123357 966008799 /nfs/dbraw/zinc/00/87/99/966008799.db2.gz JIRJCLONQSZDNO-CHWSQXEVSA-N 2 0 210.365 2.251 20 0 BEADRP Cc1ccc(NCC[C@H]2CCC[N@@H+](C)C2)[nH+]c1N ZINC001165261013 966012552 /nfs/dbraw/zinc/01/25/52/966012552.db2.gz LJNFKSFAKBTPTN-GFCCVEGCSA-N 2 0 248.374 2.116 20 0 BEADRP C[N@@H+]1CCC[C@H](CCNc2cccc(C[NH3+])c2)C1 ZINC001165279822 966023490 /nfs/dbraw/zinc/02/34/90/966023490.db2.gz ZDLHMHYNRSEKCZ-CYBMUJFWSA-N 2 0 247.386 2.289 20 0 BEADRP c1cc(C[NH+]2CCC([C@H]3CCCC[NH2+]3)CC2)c[nH]1 ZINC001235229599 966034161 /nfs/dbraw/zinc/03/41/61/966034161.db2.gz RGJRUVLWXXRTAI-OAHLLOKOSA-N 2 0 247.386 2.369 20 0 BEADRP Cc1ccc(N2CCC(C3C[NH2+]C3)CC2)[nH+]c1C ZINC001165410911 966097660 /nfs/dbraw/zinc/09/76/60/966097660.db2.gz POMAGIROBHTBRG-UHFFFAOYSA-N 2 0 245.370 2.134 20 0 BEADRP CC[N@H+](CCCC[NH3+])Cc1cccc(OC)c1 ZINC001235963624 966183618 /nfs/dbraw/zinc/18/36/18/966183618.db2.gz WXHPZWVJVXSIRE-UHFFFAOYSA-N 2 0 236.359 2.256 20 0 BEADRP CC1=C[C@@H](C)[C@@H](C[NH+]2CC(C)(C[NH3+])C2)CC1 ZINC001206711325 966198291 /nfs/dbraw/zinc/19/82/91/966198291.db2.gz IOANHGYCDOROCD-CHWSQXEVSA-N 2 0 222.376 2.259 20 0 BEADRP CC1=C[C@H](C)[C@@H](C[NH+]2CC(C)(C[NH3+])C2)CC1 ZINC001206711328 966198611 /nfs/dbraw/zinc/19/86/11/966198611.db2.gz IOANHGYCDOROCD-QWHCGFSZSA-N 2 0 222.376 2.259 20 0 BEADRP CC[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)C2CC2)C1 ZINC000253185307 966226823 /nfs/dbraw/zinc/22/68/23/966226823.db2.gz HZTREZVDQLQLLN-NEPJUHHUSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@]1(C[NH3+])CC[N@H+](C[C@H]2CC3CCC2CC3)C1 ZINC000691657807 966287963 /nfs/dbraw/zinc/28/79/63/966287963.db2.gz AIGBDFCZIYVSAN-NEXFUWMNSA-N 2 0 236.403 2.483 20 0 BEADRP C[NH2+]Cc1cccc(Nc2cccc(N)[nH+]2)c1 ZINC001167032500 966526024 /nfs/dbraw/zinc/52/60/24/966526024.db2.gz COZKYUKFNUPRIY-UHFFFAOYSA-N 2 0 228.299 2.127 20 0 BEADRP C[C@H](Cc1cccc(F)c1)[NH2+]CCCC[NH3+] ZINC000162531912 966772173 /nfs/dbraw/zinc/77/21/73/966772173.db2.gz JJYSLOQEHKATBQ-LLVKDONJSA-N 2 0 224.323 2.085 20 0 BEADRP CC[NH+]1C[C@H]2CN(Cc3ccc(F)cc3)C[C@@H]2C1 ZINC001203918036 966821237 /nfs/dbraw/zinc/82/12/37/966821237.db2.gz NCJYKDPXVCVQPP-KBPBESRZSA-N 2 0 248.345 2.209 20 0 BEADRP CCc1cc(N[C@H]2CCCC[C@@H]2[NH+](C)C)cc[nH+]1 ZINC001168602070 966969317 /nfs/dbraw/zinc/96/93/17/966969317.db2.gz AXOISBUMNZODQJ-GJZGRUSLSA-N 2 0 247.386 2.351 20 0 BEADRP C[NH+](C)C1CCC([NH2+]CCc2ccncc2)CC1 ZINC000715579155 967188065 /nfs/dbraw/zinc/18/80/65/967188065.db2.gz IRJMEYSDOMREQO-UHFFFAOYSA-N 2 0 247.386 2.087 20 0 BEADRP C[NH+](C)[C@@H]1CCC[C@H]([NH2+][C@H]2CCCOCC2)C1 ZINC000715584758 967193500 /nfs/dbraw/zinc/19/35/00/967193500.db2.gz RBFCVXPRVOZKBR-MELADBBJSA-N 2 0 240.391 2.018 20 0 BEADRP Cc1cccc(F)c1C[NH+]1CCC(C[NH3+])CC1 ZINC001205047059 967298568 /nfs/dbraw/zinc/29/85/68/967298568.db2.gz OAJIWVQNLNGYFJ-UHFFFAOYSA-N 2 0 236.334 2.305 20 0 BEADRP Cc1ccc(CN2[C@@H](C)CC[C@H]2C[NH3+])c(C)n1 ZINC001205074843 967327241 /nfs/dbraw/zinc/32/72/41/967327241.db2.gz AUCQXAUQXUJCGS-FZMZJTMJSA-N 2 0 233.359 2.010 20 0 BEADRP Cc1sccc1C[N@@H+]1CCC[C@H]([NH3+])CC1 ZINC001205123976 967352177 /nfs/dbraw/zinc/35/21/77/967352177.db2.gz IAYJVZQVNWIHQP-LBPRGKRZSA-N 2 0 224.373 2.370 20 0 BEADRP COc1cccc(C)c1C[N@@H+]1CCC[C@H]([NH3+])CC1 ZINC001205117754 967363663 /nfs/dbraw/zinc/36/36/63/967363663.db2.gz UISLUXXRFFBTLE-ZDUSSCGKSA-N 2 0 248.370 2.317 20 0 BEADRP Cc1ccc(O)cc1C[N@@H+]1CCC[C@@H]([NH3+])CC1 ZINC001205123660 967370656 /nfs/dbraw/zinc/37/06/56/967370656.db2.gz DQQMMZJGHMGMGA-CYBMUJFWSA-N 2 0 234.343 2.014 20 0 BEADRP CNc1ccc(C[N@@H+]2CCC[C@@H]([NH3+])CC2)cc1 ZINC001205123423 967371263 /nfs/dbraw/zinc/37/12/63/967371263.db2.gz AWNFMWWQLQLMPC-CYBMUJFWSA-N 2 0 233.359 2.042 20 0 BEADRP C[C@H]1C[N@H+](Cc2cccc3[nH]ccc32)C[C@H]1C[NH3+] ZINC001205135930 967383481 /nfs/dbraw/zinc/38/34/81/967383481.db2.gz HQSHSLOTIGUIMI-WCQYABFASA-N 2 0 243.354 2.195 20 0 BEADRP COc1ccc(C)c(C[N@@H+]2C[C@H](C)[C@H](C[NH3+])C2)c1 ZINC001205151544 967394797 /nfs/dbraw/zinc/39/47/97/967394797.db2.gz WRZJWNQXQAOCIG-GXTWGEPZSA-N 2 0 248.370 2.030 20 0 BEADRP CC[NH+]1CCC(C[NH2+]CCc2ccco2)CC1 ZINC001205229307 967430866 /nfs/dbraw/zinc/43/08/66/967430866.db2.gz DQMKQAIQNAPWTJ-UHFFFAOYSA-N 2 0 236.359 2.144 20 0 BEADRP C[C@@H](C[N@@H+]1CCC[C@@](C)([NH3+])CC1)C(F)(F)F ZINC001205255007 967438354 /nfs/dbraw/zinc/43/83/54/967438354.db2.gz DORUXEYVZNXBLV-VHSXEESVSA-N 2 0 238.297 2.388 20 0 BEADRP C[C@@]1([NH3+])CCC[N@H+](CCCc2cccnc2)CC1 ZINC001205257133 967447112 /nfs/dbraw/zinc/44/71/12/967447112.db2.gz SLZZCWZMHVBOOU-OAHLLOKOSA-N 2 0 247.386 2.218 20 0 BEADRP C[NH+](C)Cc1ccccc1CC[NH+]1CCCC1 ZINC001250163961 967455332 /nfs/dbraw/zinc/45/53/32/967455332.db2.gz KCRMVZVHVUNKIU-UHFFFAOYSA-N 2 0 232.371 2.387 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@H]2C[C@H]3C=C[C@@H]2C3)C[C@@H]1C[NH3+] ZINC001205297119 967494427 /nfs/dbraw/zinc/49/44/27/967494427.db2.gz ZKBTVZOWGRVMSJ-KHMAMNHCSA-N 2 0 234.387 2.115 20 0 BEADRP C[N@@H+]1CCC=C(CC[NH+]2CCCCC2)C1 ZINC001250240430 967549622 /nfs/dbraw/zinc/54/96/22/967549622.db2.gz KQDPQRDMQNNHSL-UHFFFAOYSA-N 2 0 208.349 2.124 20 0 BEADRP CS[C@@H]1CCC[C@H]([NH2+]C2CC([NH+](C)C)C2)C1 ZINC000922213693 967604006 /nfs/dbraw/zinc/60/40/06/967604006.db2.gz DVXRMNBCLAYQSW-YWPUVAFDSA-N 2 0 242.432 2.343 20 0 BEADRP CC/C=C\CC[N@@H+]1CCC[C@](F)(C[NH3+])CC1 ZINC001205545679 967692419 /nfs/dbraw/zinc/69/24/19/967692419.db2.gz LRAUEKCSKLRDFR-DHCBQETCSA-N 2 0 228.355 2.496 20 0 BEADRP C[C@H]1CC[N@H+](Cc2ccco2)CC[C@H]1C[NH3+] ZINC001205601952 967718209 /nfs/dbraw/zinc/71/82/09/967718209.db2.gz HCMMXMUGGXKSRQ-RYUDHWBXSA-N 2 0 222.332 2.086 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@H](C)[C@@H](C[NH3+])CC2)[nH]1 ZINC001205618228 967723741 /nfs/dbraw/zinc/72/37/41/967723741.db2.gz SVGJCILYBLAVRH-WCQYABFASA-N 2 0 235.375 2.130 20 0 BEADRP Cc1cc(C)c(C[N@H+]2CC[C@H](C)[C@@H](C[NH3+])CC2)[nH]1 ZINC001205617713 967725236 /nfs/dbraw/zinc/72/52/36/967725236.db2.gz MPXODMMQUGBPDJ-SMDDNHRTSA-N 2 0 249.402 2.438 20 0 BEADRP Cc1cc(C)c(C[N@@H+]2CC[C@@H](C[NH3+])[C@@H](C)CC2)[nH]1 ZINC001205617711 967729992 /nfs/dbraw/zinc/72/99/92/967729992.db2.gz MPXODMMQUGBPDJ-FZMZJTMJSA-N 2 0 249.402 2.438 20 0 BEADRP [NH3+]C[C@@H]1C[N@H+](C[C@@H]2CC=CCC2)CCC1(F)F ZINC001205736245 967807766 /nfs/dbraw/zinc/80/77/66/967807766.db2.gz WVULZPXPEZYLIN-VXGBXAGGSA-N 2 0 244.329 2.259 20 0 BEADRP [NH3+]C[C@H]1C[N@H+](C[C@H]2CC=CCC2)CCC1(F)F ZINC001205736244 967809325 /nfs/dbraw/zinc/80/93/25/967809325.db2.gz WVULZPXPEZYLIN-RYUDHWBXSA-N 2 0 244.329 2.259 20 0 BEADRP CCOC(C)(C)C[N@@H+]1CCC[C@H](C[NH3+])[C@@H](C)C1 ZINC001205982592 967930809 /nfs/dbraw/zinc/93/08/09/967930809.db2.gz MMAPRRONMHICOK-QWHCGFSZSA-N 2 0 242.407 2.108 20 0 BEADRP Cc1cc(C)c(C[N@@H+]2CCC[C@@H](C[NH3+])[C@H](C)C2)[nH]1 ZINC001205991326 967944260 /nfs/dbraw/zinc/94/42/60/967944260.db2.gz ACJOBCMETNYTFQ-OCCSQVGLSA-N 2 0 249.402 2.438 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@@H](C[NH3+])[C@H](C)C2)[nH]1 ZINC001205995478 967952617 /nfs/dbraw/zinc/95/26/17/967952617.db2.gz OIPQBBFNQYVEDB-YPMHNXCESA-N 2 0 235.375 2.130 20 0 BEADRP Cc1ccncc1C[N@@H+]1CCC[C@H](C[NH3+])[C@H](C)C1 ZINC001206003457 967957750 /nfs/dbraw/zinc/95/77/50/967957750.db2.gz IFEYKAYUHQTXJB-ZIAGYGMSSA-N 2 0 247.386 2.197 20 0 BEADRP C[C@H]1C[N@H+](Cc2cccc(N)c2)CCC[C@@H]1C[NH3+] ZINC001206013473 967965325 /nfs/dbraw/zinc/96/53/25/967965325.db2.gz ROHKQXXPBVZDSF-GXTWGEPZSA-N 2 0 247.386 2.076 20 0 BEADRP C[C@@H]1C[N@H+](Cc2ccccc2N)CCC[C@@H]1C[NH3+] ZINC001206026208 967984255 /nfs/dbraw/zinc/98/42/55/967984255.db2.gz QXMJLTNAHKHDIN-CHWSQXEVSA-N 2 0 247.386 2.076 20 0 BEADRP C[C@@H](CC[NH2+][C@H]1CCC[C@@H](C)C1)[NH+](C)C ZINC000697878749 968048594 /nfs/dbraw/zinc/04/85/94/968048594.db2.gz LMQCEVGFNWGBSM-AGIUHOORSA-N 2 0 212.381 2.495 20 0 BEADRP C[C@H]1CCC[N@H+](CC2(F)CC[NH2+]CC2)C[C@H]1C ZINC001206110294 968069145 /nfs/dbraw/zinc/06/91/45/968069145.db2.gz SPFRZHIIOFUONI-QWHCGFSZSA-N 2 0 242.382 2.446 20 0 BEADRP C[NH+](C)CC(C)(C)CNc1[nH+]ccc2c1CCN2 ZINC001168763542 968077294 /nfs/dbraw/zinc/07/72/94/968077294.db2.gz KTMAUEONXQNFBJ-UHFFFAOYSA-N 2 0 248.374 2.049 20 0 BEADRP CSCCC[N@@H+]1CCC[C@](C)(C[NH3+])CC1 ZINC001206296343 968206206 /nfs/dbraw/zinc/20/62/06/968206206.db2.gz RJPMESNWHVVXHW-LBPRGKRZSA-N 2 0 230.421 2.190 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@](C)(C[NH3+])CC2)cn1 ZINC001206312032 968219397 /nfs/dbraw/zinc/21/93/97/968219397.db2.gz YEWJQJUOXJWSMR-HNNXBMFYSA-N 2 0 247.386 2.341 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@@H]1CCc2ccccc2C1 ZINC001331820722 968248512 /nfs/dbraw/zinc/24/85/12/968248512.db2.gz ILULFXUGRZWWIP-SWLSCSKDSA-N 2 0 232.371 2.132 20 0 BEADRP C[C@@]1(C[NH3+])CCCC[N@H+](C[C@@H]2CCCCO2)C1 ZINC001206542012 968366854 /nfs/dbraw/zinc/36/68/54/968366854.db2.gz PEVATNWFQNBGIR-KBPBESRZSA-N 2 0 240.391 2.006 20 0 BEADRP C[C@]1(C[NH3+])CCCC[N@H+](Cc2ccccn2)C1 ZINC001206540181 968366918 /nfs/dbraw/zinc/36/69/18/968366918.db2.gz BAKPKQLVMVHUHE-CQSZACIVSA-N 2 0 233.359 2.033 20 0 BEADRP C[C@]1(C[NH3+])CCCC[N@H+](Cc2cccc(N)c2)C1 ZINC001206563511 968388825 /nfs/dbraw/zinc/38/88/25/968388825.db2.gz FIMGCSYDTAEMDO-OAHLLOKOSA-N 2 0 247.386 2.220 20 0 BEADRP Cc1cc(C[N@@H+]2CCCC[C@@H](C[NH3+])C2)ccc1O ZINC001206622384 968422947 /nfs/dbraw/zinc/42/29/47/968422947.db2.gz BBENJEMMSLBWDW-AWEZNQCLSA-N 2 0 248.370 2.261 20 0 BEADRP CC[NH+](CC)C[C@H](C)OCC[NH+]1CCCCC1 ZINC001206700833 968437400 /nfs/dbraw/zinc/43/74/00/968437400.db2.gz HHHKZPXXMZQLKK-AWEZNQCLSA-N 2 0 242.407 2.219 20 0 BEADRP C[NH+](C)CC(C)(C)CNc1ccccc1CC[NH3+] ZINC001168768452 968568338 /nfs/dbraw/zinc/56/83/38/968568338.db2.gz FFIOYSQCHDFFEM-UHFFFAOYSA-N 2 0 249.402 2.188 20 0 BEADRP C[NH+](C)CC(C)(C)C[N@@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC001207275243 968708513 /nfs/dbraw/zinc/70/85/13/968708513.db2.gz LELPIYTYORAEMQ-BETUJISGSA-N 2 0 224.392 2.306 20 0 BEADRP C[C@H]1C[C@@H](CF)[N@H+](CC2CC[NH+](C)CC2)C1 ZINC001207391719 968744828 /nfs/dbraw/zinc/74/48/28/968744828.db2.gz NIZXPRLGLUYUBH-AAEUAGOBSA-N 2 0 228.355 2.008 20 0 BEADRP C[NH+]1CCC(C[NH+]2CCC(CF)CC2)CC1 ZINC001207398551 968750711 /nfs/dbraw/zinc/75/07/11/968750711.db2.gz ZDDBYUIXSVDBAP-UHFFFAOYSA-N 2 0 228.355 2.010 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2Cc3ccc(F)cc3C2)CC1 ZINC001207398855 968751456 /nfs/dbraw/zinc/75/14/56/968751456.db2.gz RLTSFDYELSUKHA-UHFFFAOYSA-N 2 0 248.345 2.483 20 0 BEADRP C[N@H+](CC1CC(F)(F)C1)CC1CC[NH+](C)CC1 ZINC001207398856 968752596 /nfs/dbraw/zinc/75/25/96/968752596.db2.gz RLXKPIDJWQACBI-UHFFFAOYSA-N 2 0 246.345 2.305 20 0 BEADRP C[NH+]1CCC(C[NH+]2CCC3(CC3)CC2)CC1 ZINC001207393975 968753009 /nfs/dbraw/zinc/75/30/09/968753009.db2.gz HAPAGHTWVCEYHS-UHFFFAOYSA-N 2 0 222.376 2.204 20 0 BEADRP C[C@H]1CC[C@H]([N@H+](C)CC2CC[NH2+]CC2)CC1 ZINC001207443012 968776154 /nfs/dbraw/zinc/77/61/54/968776154.db2.gz KSAFXJWHFIIURS-MQMHXKEQSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1C[C@@H](CF)[N@H+](CCC2CC[NH+](C)CC2)C1 ZINC001207479594 968791762 /nfs/dbraw/zinc/79/17/62/968791762.db2.gz KKNDOFQPGMTYPQ-JSGCOSHPSA-N 2 0 242.382 2.398 20 0 BEADRP CCC[N@H+](CCOC)CCC1CC[NH+](C)CC1 ZINC001207479598 968794056 /nfs/dbraw/zinc/79/40/56/968794056.db2.gz KKPXDJHKEUJPSW-UHFFFAOYSA-N 2 0 242.407 2.077 20 0 BEADRP C[N@H+](CCC1CC[NH+](C)CC1)C(C)(C)C ZINC001207485875 968796462 /nfs/dbraw/zinc/79/64/62/968796462.db2.gz ZAWXWKBVFHLMPH-UHFFFAOYSA-N 2 0 212.381 2.449 20 0 BEADRP C[NH+]1CCC(CC[N@@H+]2CCC3(CC3)C2)CC1 ZINC001207482660 968796903 /nfs/dbraw/zinc/79/69/03/968796903.db2.gz ZVSDXMVDYBJJEP-UHFFFAOYSA-N 2 0 222.376 2.204 20 0 BEADRP C[NH+]1CCC(CC[NH+]2CCC(CF)CC2)CC1 ZINC001207485123 968797764 /nfs/dbraw/zinc/79/77/64/968797764.db2.gz RTRDRCNBDVDTOT-UHFFFAOYSA-N 2 0 242.382 2.400 20 0 BEADRP C[NH+]1CCC(CC[NH+]2C3CCC2CC3)CC1 ZINC001207483745 968798081 /nfs/dbraw/zinc/79/80/81/968798081.db2.gz HSDJOXJBRKUAPQ-UHFFFAOYSA-N 2 0 222.376 2.345 20 0 BEADRP C[NH+]1CCC(CC[N@@H+]2CCC[C@H](F)C2)CC1 ZINC001207482366 968798180 /nfs/dbraw/zinc/79/81/80/968798180.db2.gz BOQFVOGEOYWDMG-ZDUSSCGKSA-N 2 0 228.355 2.152 20 0 BEADRP C[NH+]1CCC(CC[N@@H+]2CCc3occc3C2)CC1 ZINC001207486533 968799421 /nfs/dbraw/zinc/79/94/21/968799421.db2.gz JUTHSPDABYBZMV-UHFFFAOYSA-N 2 0 248.370 2.370 20 0 BEADRP [NH3+][C@@H]1CCC[C@H](Nc2[nH+]ccc3[nH]ccc32)C1 ZINC001154977000 968827449 /nfs/dbraw/zinc/82/74/49/968827449.db2.gz MHYFJWSJLOYMKR-ZJUUUORDSA-N 2 0 230.315 2.245 20 0 BEADRP C[N@@H+]1CC[C@@H]2C[NH+](C[C@@H]3C[C@H]4C=C[C@@H]3C4)C[C@@H]2C1 ZINC001207620064 968840979 /nfs/dbraw/zinc/84/09/79/968840979.db2.gz HMJCRRCXOUHDCZ-OTJKEOIZSA-N 2 0 246.398 2.082 20 0 BEADRP COC(C)(C)C[N@H+](C)CCCCCCC[NH3+] ZINC000404211044 968855408 /nfs/dbraw/zinc/85/54/08/968855408.db2.gz VDQXMJAMLWFQCD-UHFFFAOYSA-N 2 0 230.396 2.252 20 0 BEADRP Cc1c[nH+]c(NC[C@@H]2CCC[NH2+]C[C@H]2C)cc1N ZINC001155034954 968860956 /nfs/dbraw/zinc/86/09/56/968860956.db2.gz ZHXBCUATWJAZLR-PWSUYJOCSA-N 2 0 248.374 2.020 20 0 BEADRP C[NH+]1CCC(C)(C[N@@H+]2C[C@H]3CC[C@@H]2C3)CC1 ZINC001208114430 968995704 /nfs/dbraw/zinc/99/57/04/968995704.db2.gz WVASJUKPZOMNKA-QWHCGFSZSA-N 2 0 222.376 2.203 20 0 BEADRP C[C@H]1CCC[N@H+](CC2(C)CC[NH+](C)CC2)C1 ZINC001208104262 969003967 /nfs/dbraw/zinc/00/39/67/969003967.db2.gz KJLZWBRAGXWAAR-ZDUSSCGKSA-N 2 0 224.392 2.450 20 0 BEADRP C[N@@H+]1CCC=C(c2ccc3c(c2)CC[NH2+]C3)C1 ZINC001241569631 969059601 /nfs/dbraw/zinc/05/96/01/969059601.db2.gz JHWSAZMCFCQYKB-UHFFFAOYSA-N 2 0 228.339 2.051 20 0 BEADRP CS[C@H](C)CC[N@@H+]1C[C@H]2CC[NH+](C)C[C@H]2C1 ZINC001208145584 969068520 /nfs/dbraw/zinc/06/85/20/969068520.db2.gz YNJPVISGSXKICW-UPJWGTAASA-N 2 0 242.432 2.012 20 0 BEADRP C[C@@H]1CC[N@@H+]1CC1(C[NH+](C)C)CCCC1 ZINC001208185287 969118701 /nfs/dbraw/zinc/11/87/01/969118701.db2.gz ZPLXZWBEQJPZAI-GFCCVEGCSA-N 2 0 210.365 2.203 20 0 BEADRP C[C@H](C[NH3+])C[N@H+](C)C1CCC2(CC2)CC1 ZINC000723428309 969146000 /nfs/dbraw/zinc/14/60/00/969146000.db2.gz XNHGGAMNIONXRJ-LLVKDONJSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@H]1C[N@H+](C[C@H]2CCC[NH+](C)C2)CCC1(F)F ZINC001208609275 969147010 /nfs/dbraw/zinc/14/70/10/969147010.db2.gz ZYJZLEJZRJHNIO-RYUDHWBXSA-N 2 0 246.345 2.305 20 0 BEADRP CC[NH+]1CCC(C[N@H+](C)Cc2ccccn2)CC1 ZINC001208595149 969151370 /nfs/dbraw/zinc/15/13/70/969151370.db2.gz QLJHDPUDEAPRIQ-UHFFFAOYSA-N 2 0 247.386 2.245 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH+]2CCc3ccccc3C2)C1 ZINC001208605070 969154897 /nfs/dbraw/zinc/15/48/97/969154897.db2.gz XZFPIMOIUQHKQO-CQSZACIVSA-N 2 0 244.382 2.387 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH+]2CC[C@@](C)(CF)C2)C1 ZINC001208607260 969161056 /nfs/dbraw/zinc/16/10/56/969161056.db2.gz KXMLWNWMGAYRBL-STQMWFEESA-N 2 0 228.355 2.010 20 0 BEADRP CC(C)C([NH2+]C[C@H](O)C[NH2+]C(C)(C)C)C(C)C ZINC001253406206 969164053 /nfs/dbraw/zinc/16/40/53/969164053.db2.gz CSPABFQTWYLVFQ-LBPRGKRZSA-N 2 0 244.423 2.006 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@H]2C=CCCC2)CC1 ZINC000234314948 969170063 /nfs/dbraw/zinc/17/00/63/969170063.db2.gz AUCKYQAAKYRPOE-ZDUSSCGKSA-N 2 0 208.349 2.027 20 0 BEADRP CCCCC[C@H](O)C[NH2+]CCC[NH+](CC)CC ZINC001253522361 969199197 /nfs/dbraw/zinc/19/91/97/969199197.db2.gz KSZHMNSDFCZXSX-AWEZNQCLSA-N 2 0 244.423 2.249 20 0 BEADRP Cc1cc2[nH]ccc2c(N(C)C2CC[NH2+]CC2)[nH+]1 ZINC001156175591 969210498 /nfs/dbraw/zinc/21/04/98/969210498.db2.gz KZIYWRZWNICDRD-UHFFFAOYSA-N 2 0 244.342 2.060 20 0 BEADRP Cc1cc(C[N@@H+]2CCC[C@H](C[NH3+])[C@@H](C)C2)ccn1 ZINC001205991628 969210969 /nfs/dbraw/zinc/21/09/69/969210969.db2.gz BCMLJZUQJNZGKH-SWLSCSKDSA-N 2 0 247.386 2.197 20 0 BEADRP CCCCC[C@H](O)C[NH2+][C@@H]1CCC[N@H+](C)CC1 ZINC001253549800 969220830 /nfs/dbraw/zinc/22/08/30/969220830.db2.gz GCEBBQNWXWIKLB-KGLIPLIRSA-N 2 0 242.407 2.002 20 0 BEADRP Cc1cncc(C[N@@H+]2CCC[C@@H](C[NH3+])[C@H](C)C2)c1 ZINC001205993510 969227059 /nfs/dbraw/zinc/22/70/59/969227059.db2.gz HZDXHXGFXVERKA-HIFRSBDPSA-N 2 0 247.386 2.197 20 0 BEADRP C[NH+](C)Cc1cccc(NC2=CC[N@H+](C)CC2)c1 ZINC001208837472 969250471 /nfs/dbraw/zinc/25/04/71/969250471.db2.gz JNDNZKJILBOUBG-UHFFFAOYSA-N 2 0 245.370 2.380 20 0 BEADRP Cc1cccnc1C[N@@H+]1CCC[C@H](C[NH3+])[C@@H](C)C1 ZINC001205996549 969352148 /nfs/dbraw/zinc/35/21/48/969352148.db2.gz XEXVYGVTGIQLPQ-UONOGXRCSA-N 2 0 247.386 2.197 20 0 BEADRP CC(C)CC[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169078823 969398536 /nfs/dbraw/zinc/39/85/36/969398536.db2.gz HPDLMMYBHNDDBF-CLLJXQQHSA-N 2 0 210.365 2.247 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]C(C)(C)C1CC1)C2 ZINC001169078324 969398655 /nfs/dbraw/zinc/39/86/55/969398655.db2.gz CUMLVMZIHPJRKQ-XYYAHUGASA-N 2 0 222.376 2.390 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccncc1 ZINC001169080441 969403082 /nfs/dbraw/zinc/40/30/82/969403082.db2.gz NMYGGOLFSINENC-CYUUQNCZSA-N 2 0 245.370 2.357 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccncc1 ZINC001169080446 969403111 /nfs/dbraw/zinc/40/31/11/969403111.db2.gz NMYGGOLFSINENC-NGFQHRJXSA-N 2 0 245.370 2.357 20 0 BEADRP C[C@H]1CCC[C@H]1[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169082294 969404152 /nfs/dbraw/zinc/40/41/52/969404152.db2.gz YOQHIUQNLZTACV-QSLWVIQJSA-N 2 0 222.376 2.390 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+][C@H]1CC13CCC3)C2 ZINC001169116575 969412568 /nfs/dbraw/zinc/41/25/68/969412568.db2.gz RDVRBPYOQUAPQL-RVMXOQNASA-N 2 0 220.360 2.144 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CCC(C)(F)CC1)C2 ZINC001169125407 969423267 /nfs/dbraw/zinc/42/32/67/969423267.db2.gz HTYXSBGUUCWABF-CLLJXQQHSA-N 2 0 240.366 2.436 20 0 BEADRP CCC[N@H+](CC)[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169125022 969426649 /nfs/dbraw/zinc/42/66/49/969426649.db2.gz WHKCAERBVZNHLL-ITGUQSILSA-N 2 0 210.365 2.344 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CC[C@@](C)(CF)C1)C2 ZINC001169126496 969431716 /nfs/dbraw/zinc/43/17/16/969431716.db2.gz VHCBWORKGPQETO-CRWXNKLISA-N 2 0 240.366 2.293 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1C[C@@H]3CCC[C@@H]3C1)C2 ZINC001169126545 969433536 /nfs/dbraw/zinc/43/35/36/969433536.db2.gz WCSDJRGANQPYBN-OYQDBORRSA-N 2 0 234.387 2.344 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CC[C@@](C)(CF)C1)C2 ZINC001169126497 969434539 /nfs/dbraw/zinc/43/45/39/969434539.db2.gz VHCBWORKGPQETO-DGAVXFQQSA-N 2 0 240.366 2.293 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+][C@@H]1C=CCCC1)C2 ZINC001169115283 969455721 /nfs/dbraw/zinc/45/57/21/969455721.db2.gz ICHMIQQWVOQYMS-YIYPIFLZSA-N 2 0 220.360 2.310 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+][C@H]1CC=CCC1)C2 ZINC001169115627 969457143 /nfs/dbraw/zinc/45/71/43/969457143.db2.gz LSDHQZBBRRRMPY-FQUUOJAGSA-N 2 0 220.360 2.310 20 0 BEADRP CC[C@@H]1CC[N@@H+]([C@H]2C[C@H]3CC[C@@H](C2)[NH+]3C)C1 ZINC001169161717 969479019 /nfs/dbraw/zinc/47/90/19/969479019.db2.gz PTBWHWPANJIJFU-MQYQWHSLSA-N 2 0 222.376 2.344 20 0 BEADRP F[C@H]1C[C@@H]2C[C@H]1C[N@@H+]2CCC[NH+]1CCCCC1 ZINC001209451112 969519756 /nfs/dbraw/zinc/51/97/56/969519756.db2.gz SQVZDLANODCBJR-IHRRRGAJSA-N 2 0 240.366 2.295 20 0 BEADRP CC[NH+]1CCC(Nc2cccc(CC[NH3+])c2)CC1 ZINC001169239259 969526050 /nfs/dbraw/zinc/52/60/50/969526050.db2.gz VHUVFRQXKHMBSF-UHFFFAOYSA-N 2 0 247.386 2.084 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH+]2CCCC[C@H](F)C2)CC1 ZINC001254516449 969690278 /nfs/dbraw/zinc/69/02/78/969690278.db2.gz MLMMHUPJBRLPSO-STQMWFEESA-N 2 0 228.355 2.295 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH+]2CCCC[C@@H](F)C2)CC1 ZINC001254516447 969692491 /nfs/dbraw/zinc/69/24/91/969692491.db2.gz MLMMHUPJBRLPSO-OLZOCXBDSA-N 2 0 228.355 2.295 20 0 BEADRP C[N@H+](CCc1ccccn1)[C@H]1CCC[NH+](C)CC1 ZINC001254516810 969694809 /nfs/dbraw/zinc/69/48/09/969694809.db2.gz PZNPTXQHKANWAO-HNNXBMFYSA-N 2 0 247.386 2.040 20 0 BEADRP C[N@H+](CCc1ccccn1)[C@@H]1CCC[NH+](C)CC1 ZINC001254516811 969700408 /nfs/dbraw/zinc/70/04/08/969700408.db2.gz PZNPTXQHKANWAO-OAHLLOKOSA-N 2 0 247.386 2.040 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH+]2CCC(CF)CC2)CC1 ZINC001254523247 969711746 /nfs/dbraw/zinc/71/17/46/969711746.db2.gz MOJMADBQEZRDET-CYBMUJFWSA-N 2 0 228.355 2.152 20 0 BEADRP C[C@@H]1C[C@H](C)C[N@H+]([C@H]2CCC[NH+](C)CC2)C1 ZINC001254524916 969715414 /nfs/dbraw/zinc/71/54/14/969715414.db2.gz DQWJPHYCYNZQFJ-MJBXVCDLSA-N 2 0 224.392 2.449 20 0 BEADRP c1cc2c[nH+]cc(NCC[C@H]3CCC[NH2+]3)c2[nH]1 ZINC001169564765 969762765 /nfs/dbraw/zinc/76/27/65/969762765.db2.gz SBOJCBLMVHHWSV-LLVKDONJSA-N 2 0 230.315 2.117 20 0 BEADRP [NH3+][C@H]1CCc2c1cccc2NCC[C@H]1CCC[NH2+]1 ZINC001169567217 969763059 /nfs/dbraw/zinc/76/30/59/969763059.db2.gz GYUKIOJNGKIYDQ-RISCZKNCSA-N 2 0 245.370 2.187 20 0 BEADRP [NH3+][C@@H]1CCc2c1cccc2NCC[C@H]1CCC[NH2+]1 ZINC001169567215 969763238 /nfs/dbraw/zinc/76/32/38/969763238.db2.gz GYUKIOJNGKIYDQ-BXUZGUMPSA-N 2 0 245.370 2.187 20 0 BEADRP CC(C)([NH3+])c1ccccc1-n1ccc(C[NH3+])c1 ZINC001169725382 969818059 /nfs/dbraw/zinc/81/80/59/969818059.db2.gz GCWQEINKHMVJIJ-UHFFFAOYSA-N 2 0 229.327 2.130 20 0 BEADRP C[NH+](C)CCC(C)(C)Nc1ncc2cc[nH]c2n1 ZINC001169716734 969829571 /nfs/dbraw/zinc/82/95/71/969829571.db2.gz VHQLOXSZXYAXFV-UHFFFAOYSA-N 2 0 247.346 2.052 20 0 BEADRP CC1(C)C[N@H+](CCCC[NH3+])CCC1(F)F ZINC001210561509 969940664 /nfs/dbraw/zinc/94/06/64/969940664.db2.gz NTXVSNHETQDMMC-UHFFFAOYSA-N 2 0 220.307 2.093 20 0 BEADRP CC1(C)CC([NH3+])CC(C)(C)[NH+]1[C@@H]1CCSC1 ZINC001255269415 970016234 /nfs/dbraw/zinc/01/62/34/970016234.db2.gz GXFBGNFRFOJSSS-LLVKDONJSA-N 2 0 242.432 2.472 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCSC1)CC(C)(C)CC[NH3+] ZINC001255275601 970026788 /nfs/dbraw/zinc/02/67/88/970026788.db2.gz ZSYROAXYRUBFPH-NWDGAFQWSA-N 2 0 244.448 2.483 20 0 BEADRP C[N@H+]1C[C@@H]2C[NH+](C3CCC(C)(C)CC3)C[C@@H]2C1 ZINC001255307476 970073704 /nfs/dbraw/zinc/07/37/04/970073704.db2.gz CQZHXHICYYSSEB-BETUJISGSA-N 2 0 236.403 2.449 20 0 BEADRP CCCC[C@H](C)[NH+]1CCC([NH3+])(CCOC)CC1 ZINC001255321594 970096115 /nfs/dbraw/zinc/09/61/15/970096115.db2.gz UMAAPCGHKRSJFT-ZDUSSCGKSA-N 2 0 242.407 2.395 20 0 BEADRP CC(C)CCC[C@H](C)NC(=[NH2+])NCCCC[NH3+] ZINC001170061446 970119611 /nfs/dbraw/zinc/11/96/11/970119611.db2.gz PXLVJCJOFPTKRM-LBPRGKRZSA-N 2 0 242.411 2.054 20 0 BEADRP [NH2+]=CN[C@@H]1CCC[N@H+](Cc2ccccc2)CC1 ZINC001255387976 970127198 /nfs/dbraw/zinc/12/71/98/970127198.db2.gz WQMOBMOGAJFUCV-CQSZACIVSA-N 2 0 231.343 2.238 20 0 BEADRP C[N@@H+]1CCC[C@@H](n2ccc3cc(C[NH3+])ccc32)C1 ZINC001255466258 970193569 /nfs/dbraw/zinc/19/35/69/970193569.db2.gz LYSOKTAQGRPGCB-CQSZACIVSA-N 2 0 243.354 2.367 20 0 BEADRP Cn1c[nH+]cc1Nc1cc[nH+]c(N2CCCC2)c1 ZINC001211246916 970194118 /nfs/dbraw/zinc/19/41/18/970194118.db2.gz ANNCIOVGGAYABB-UHFFFAOYSA-N 2 0 243.314 2.159 20 0 BEADRP COC[C@H](C)[N@H+](C)CC1CC[NH+](C(C)C)CC1 ZINC001255575845 970371404 /nfs/dbraw/zinc/37/14/04/970371404.db2.gz JVXKZBQTZAMONP-ZDUSSCGKSA-N 2 0 242.407 2.074 20 0 BEADRP C[C@H]1CC[C@H]([N@@H+]2C[C@H]3CC[NH+](C)C[C@H]3C2)C1 ZINC001170134624 970408211 /nfs/dbraw/zinc/40/82/11/970408211.db2.gz CUMNUOVRIVWWJU-CRWXNKLISA-N 2 0 222.376 2.059 20 0 BEADRP C[C@@H]1CC[C@@H]([NH+]2CC3(C2)CC[NH+](C)CC3)C1 ZINC001170147179 970439838 /nfs/dbraw/zinc/43/98/38/970439838.db2.gz APDOMUDSKVSGHB-CHWSQXEVSA-N 2 0 222.376 2.203 20 0 BEADRP C[C@H]([NH3+])c1nccn1C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001255661886 970442176 /nfs/dbraw/zinc/44/21/76/970442176.db2.gz DWPHZWXIDWHONC-ACJTYDJDSA-N 2 0 248.374 2.091 20 0 BEADRP C[C@@H]1CC[C@H]([NH+]2CCC3(C[NH+](C)C3)CC2)C1 ZINC001170152943 970464145 /nfs/dbraw/zinc/46/41/45/970464145.db2.gz YGUNCFNNKPJRDL-OLZOCXBDSA-N 2 0 222.376 2.203 20 0 BEADRP Cc1ccc(C[C@@H](C)[NH2+][C@@H]2CCC[C@@H]2[NH3+])cc1 ZINC001255782532 970485881 /nfs/dbraw/zinc/48/58/81/970485881.db2.gz AWBVXKBOWVYYQS-VHDGCEQUSA-N 2 0 232.371 2.395 20 0 BEADRP C[C@H](Cc1ccccc1F)[N@@H+](C)C[C@@H](C)C[NH3+] ZINC001255841326 970512820 /nfs/dbraw/zinc/51/28/20/970512820.db2.gz RTIAIMVEZPOHGW-NWDGAFQWSA-N 2 0 238.350 2.283 20 0 BEADRP [NH3+]C1CC[NH+](C[C@@H]2CC3CCC2CC3)CC1 ZINC000400139478 970558874 /nfs/dbraw/zinc/55/88/74/970558874.db2.gz ZSLHDVRUOQQWDK-BPCQOVAHSA-N 2 0 222.376 2.236 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]C1CC=CC1 ZINC001255940376 970571649 /nfs/dbraw/zinc/57/16/49/970571649.db2.gz AWICQJLPAFJXKC-LBPRGKRZSA-N 2 0 210.365 2.415 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]C[C@H]1CCCCO1 ZINC001255944172 970575544 /nfs/dbraw/zinc/57/55/44/970575544.db2.gz SHDFOJWMFGVXQZ-UONOGXRCSA-N 2 0 242.407 2.266 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]C[C@H]1C[C@H](F)C1 ZINC001255945044 970576550 /nfs/dbraw/zinc/57/65/50/970576550.db2.gz JCQAPXMSIDBNPH-AVGNSLFASA-N 2 0 230.371 2.445 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]CC(C)(C)OC ZINC001255943676 970578045 /nfs/dbraw/zinc/57/80/45/970578045.db2.gz PTBSNJMEQZYROF-GFCCVEGCSA-N 2 0 230.396 2.121 20 0 BEADRP CC[C@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)C1CC1 ZINC000400357171 970580613 /nfs/dbraw/zinc/58/06/13/970580613.db2.gz BSZRKEOMWADBLR-GWCFXTLKSA-N 2 0 210.365 2.153 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+][C@]1(C)CCCOC1 ZINC001255955347 970590735 /nfs/dbraw/zinc/59/07/35/970590735.db2.gz RFQMRUAWWQVZQV-UONOGXRCSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@@H]([NH2+][C@H](C)C1CC[NH2+]CC1)c1nccs1 ZINC000400463608 970590978 /nfs/dbraw/zinc/59/09/78/970590978.db2.gz SDZFHSDQVSREMH-NXEZZACHSA-N 2 0 239.388 2.182 20 0 BEADRP CCC[C@@H](CCO)[NH2+][C@@H](C)CC[NH+](CC)CC ZINC001255953191 970591164 /nfs/dbraw/zinc/59/11/64/970591164.db2.gz YMVPOHCNYVIYSP-KBPBESRZSA-N 2 0 244.423 2.248 20 0 BEADRP CC[C@H]1C[C@H]([NH2+][C@H]2CCN(C(C)C)C2)CCO1 ZINC001170197490 970594557 /nfs/dbraw/zinc/59/45/57/970594557.db2.gz OUFBVVNXLNBDQB-RDBSUJKOSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@H]1C)C1CC[NH2+]CC1 ZINC000400500184 970595602 /nfs/dbraw/zinc/59/56/02/970595602.db2.gz BVNWPNDAYIYWQZ-MDZLAQPJSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH2+][C@@H](C)C(C)(C)C)C1CC[NH2+]CC1 ZINC000400483280 970595890 /nfs/dbraw/zinc/59/58/90/970595890.db2.gz WTAVEFJODIWYHO-QWRGUYRKSA-N 2 0 212.381 2.399 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[N@@H+]1CC[C@H](C)C1 ZINC001255956751 970597550 /nfs/dbraw/zinc/59/75/50/970597550.db2.gz MCXFSMOPAAOKLB-QWHCGFSZSA-N 2 0 212.381 2.449 20 0 BEADRP COc1cccc(C[C@H](C)[NH2+][C@@H]2CCC[C@@H]2[NH3+])c1 ZINC001256154728 970672741 /nfs/dbraw/zinc/67/27/41/970672741.db2.gz AVLABJGZTGJEIG-TUKIKUTGSA-N 2 0 248.370 2.096 20 0 BEADRP CC(C)CC[C@@H](C)[N@H+](C)C[C@@H](C)C[NH3+] ZINC001256357582 970734754 /nfs/dbraw/zinc/73/47/54/970734754.db2.gz IBYATORXIZULOB-NWDGAFQWSA-N 2 0 200.370 2.338 20 0 BEADRP CC(C)CC[C@H](C)[NH2+]CCSCC[NH3+] ZINC001256358948 970756534 /nfs/dbraw/zinc/75/65/34/970756534.db2.gz YVUCQCDUTKZCLR-NSHDSACASA-N 2 0 218.410 2.093 20 0 BEADRP CSCC[C@@H](C)[N@@H+]1CCC[C@@](F)(C[NH3+])CC1 ZINC001246549574 972698199 /nfs/dbraw/zinc/69/81/99/972698199.db2.gz MMYXUUXDALAISA-NEPJUHHUSA-N 2 0 248.411 2.281 20 0 BEADRP Cc1cccc2c1CC[N@@H+]([C@@H]1CC[NH2+][C@@H](C)C1)C2 ZINC001246550302 972704117 /nfs/dbraw/zinc/70/41/17/972704117.db2.gz VIXGTXCIWCJFAA-DZGCQCFKSA-N 2 0 244.382 2.494 20 0 BEADRP C[C@]1([NH3+])CCC[N@@H+]([C@H]2CCCSC2)CC1 ZINC001246554028 972743964 /nfs/dbraw/zinc/74/39/64/972743964.db2.gz USEODRNRKORXQE-RYUDHWBXSA-N 2 0 228.405 2.085 20 0 BEADRP C[C@H]1C[N@@H+](C2CCCC2)CCC[C@@H]1C[NH3+] ZINC001246559491 972788003 /nfs/dbraw/zinc/78/80/03/972788003.db2.gz ANIRXWNIHJRNEN-NWDGAFQWSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@H](CC1CC1)[N@@H+]1CCC[C@H](C[NH3+])[C@H](C)C1 ZINC001246566914 972818655 /nfs/dbraw/zinc/81/86/55/972818655.db2.gz JVMNQNOJMLNGTE-YRGRVCCFSA-N 2 0 224.392 2.482 20 0 BEADRP CC(C)([NH3+])CNc1ccccc1C(C)(C)[NH3+] ZINC001171193932 972851504 /nfs/dbraw/zinc/85/15/04/972851504.db2.gz HSTBRXWEZUDCBL-UHFFFAOYSA-N 2 0 221.348 2.030 20 0 BEADRP C[C@@]1(C[NH3+])CCC[N@@H+]([C@@H]2C[C@H]3C[C@H]3C2)CC1 ZINC001246577791 972896145 /nfs/dbraw/zinc/89/61/45/972896145.db2.gz PPYPWULJAVSTJH-XJFOESAGSA-N 2 0 222.376 2.236 20 0 BEADRP C[C@@H](CC(F)(F)F)[N@@H+]1CCCC[C@H](C[NH3+])C1 ZINC001246596755 973010392 /nfs/dbraw/zinc/01/03/92/973010392.db2.gz VJLKEMZPRRWOHH-VHSXEESVSA-N 2 0 238.297 2.388 20 0 BEADRP C[C@H](CC(F)(F)F)[N@@H+]1CCCC[C@@H](C[NH3+])C1 ZINC001246596759 973013800 /nfs/dbraw/zinc/01/38/00/973013800.db2.gz VJLKEMZPRRWOHH-ZJUUUORDSA-N 2 0 238.297 2.388 20 0 BEADRP CC(C)C1CCC([N@@H+]2C[C@@H]3C[NH2+]CC[C@H]32)CC1 ZINC001246677670 973081760 /nfs/dbraw/zinc/08/17/60/973081760.db2.gz WWEBOSCGNKFHHB-OOJKYFRXSA-N 2 0 236.403 2.495 20 0 BEADRP CSC(C)(C)C[C@H](C)[N@@H+]1C[C@@H]2CC[C@]2([NH3+])C1 ZINC001246854706 973171548 /nfs/dbraw/zinc/17/15/48/973171548.db2.gz QQWKUJGHLLWIBQ-GVXVVHGQSA-N 2 0 242.432 2.330 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@@H+]([C@H](C)Cc2ccc(C)cc2)C1 ZINC001246863886 973190047 /nfs/dbraw/zinc/19/00/47/973190047.db2.gz LZQIQHZPHLTMDG-ZBFHGGJFSA-N 2 0 246.398 2.467 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[C@@H]2[C@H](C1)C2(F)F ZINC001328614215 973195697 /nfs/dbraw/zinc/19/56/97/973195697.db2.gz CIUCDBGMAXYPJK-KNZXXDILSA-N 2 0 244.329 2.137 20 0 BEADRP CC(C)([NH2+]C/C=C/C[NH3+])c1ccnc(Cl)c1 ZINC001160983682 973229396 /nfs/dbraw/zinc/22/93/96/973229396.db2.gz RNXXNAJHONMVBL-ONEGZZNKSA-N 2 0 239.750 2.075 20 0 BEADRP C[C@@H]1CCC[C@@H]([N@@H+]2C[C@H]3CC[C@@H](C2)[NH2+]C3)C1 ZINC001246867595 973238280 /nfs/dbraw/zinc/23/82/80/973238280.db2.gz PMPOMMLRPUTAOX-ZOBORPQBSA-N 2 0 222.376 2.249 20 0 BEADRP COC[C@@H]1CCC[N@H+](CCCCCCC[NH3+])C1 ZINC000234728611 973728658 /nfs/dbraw/zinc/72/86/58/973728658.db2.gz DUJJNUBRVWQFDE-CQSZACIVSA-N 2 0 242.407 2.254 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001329433398 973769721 /nfs/dbraw/zinc/76/97/21/973769721.db2.gz NAZQHWCFYMACHC-CHWSQXEVSA-N 2 0 222.376 2.108 20 0 BEADRP [NH3+][C@H]1CCc2c1cccc2NC[C@H]1CCCC[NH2+]1 ZINC001171334855 973867053 /nfs/dbraw/zinc/86/70/53/973867053.db2.gz KLXXGOSZMWXKGK-RISCZKNCSA-N 2 0 245.370 2.187 20 0 BEADRP CC[NH+](CC)C[C@@H](C)OC[C@@H]1CCCC[N@@H+]1C ZINC001224703953 973870570 /nfs/dbraw/zinc/87/05/70/973870570.db2.gz VYLOMZYUVHZGHO-KGLIPLIRSA-N 2 0 242.407 2.218 20 0 BEADRP [NH3+]CC1CCC([NH2+]CC[C@H]2CCCS2)CC1 ZINC001329799834 973940545 /nfs/dbraw/zinc/94/05/45/973940545.db2.gz KTPFHNQHOZRWRD-WXRRBKDZSA-N 2 0 242.432 2.379 20 0 BEADRP [NH3+]CCCC[NH2+][C@@H]1CCc2c(F)cccc2C1 ZINC001171401578 974008481 /nfs/dbraw/zinc/00/84/81/974008481.db2.gz MXUPZKJRAGLJSO-GFCCVEGCSA-N 2 0 236.334 2.012 20 0 BEADRP COCCC[NH2+]C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171618029 974114064 /nfs/dbraw/zinc/11/40/64/974114064.db2.gz UPVYSKNPIRNFLZ-UHFFFAOYSA-N 2 0 242.407 2.264 20 0 BEADRP CC(C)[NH+]1CCC(OCCCC[NH+](C)C)CC1 ZINC001224991733 974123605 /nfs/dbraw/zinc/12/36/05/974123605.db2.gz ZPXMYCLGCFSKOP-UHFFFAOYSA-N 2 0 242.407 2.218 20 0 BEADRP [NH3+][C@@H]1CC[N@H+](CCCC(F)(F)F)CC[C@H]1F ZINC001206153641 974255139 /nfs/dbraw/zinc/25/51/39/974255139.db2.gz CXAMZBPKYKONHI-RKDXNWHRSA-N 2 0 242.260 2.090 20 0 BEADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1cccnc1)C2 ZINC001172099211 974340509 /nfs/dbraw/zinc/34/05/09/974340509.db2.gz GODRFKZWHKAECZ-QDMKHBRRSA-N 2 0 245.370 2.187 20 0 BEADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]CC1(C)CC1)C2 ZINC001172100980 974347709 /nfs/dbraw/zinc/34/77/09/974347709.db2.gz VOVYWTNGXPIIOB-XYYAHUGASA-N 2 0 222.376 2.391 20 0 BEADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]CCn1cccc1)C2 ZINC001172104065 974366729 /nfs/dbraw/zinc/36/67/29/974366729.db2.gz ZIGGIQXGIPMNFZ-QKDCVEJESA-N 2 0 247.386 2.093 20 0 BEADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]CCC1CC1)C2 ZINC001172107629 974367645 /nfs/dbraw/zinc/36/76/45/974367645.db2.gz IXMOPYXNGLDHOT-BTTYYORXSA-N 2 0 222.376 2.391 20 0 BEADRP CN1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CC(C)(C)C1)C2 ZINC001172109156 974375439 /nfs/dbraw/zinc/37/54/39/974375439.db2.gz BUHCPGLHDBTZED-ITGUQSILSA-N 2 0 222.376 2.344 20 0 BEADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CC3(CCC3)C1)C2 ZINC001172121433 974387482 /nfs/dbraw/zinc/38/74/82/974387482.db2.gz QMYGBPWIAFJEHS-WDNDVIMCSA-N 2 0 234.387 2.488 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C[C@@H]2CC[N@H+](C)C2)C[C@H]1C ZINC001172367707 974648763 /nfs/dbraw/zinc/64/87/63/974648763.db2.gz LXQXEXNCOGRKQX-YIYPIFLZSA-N 2 0 224.392 2.352 20 0 BEADRP COCC1([NH2+][C@@H]2CC[N@H+](C)C(C)(C)C2)CCC1 ZINC001331294194 974673861 /nfs/dbraw/zinc/67/38/61/974673861.db2.gz AENWICQYPBRQHS-GFCCVEGCSA-N 2 0 240.391 2.018 20 0 BEADRP CCOCC[C@@H](C)[N@H+](C)C1CCC([NH3+])CC1 ZINC001172411170 974675052 /nfs/dbraw/zinc/67/50/52/974675052.db2.gz LOCAFIHTNUFEKL-PNESKVBLSA-N 2 0 228.380 2.003 20 0 BEADRP CCOCC[C@H](C)[NH2+]C1CCC([NH+](C)C)CC1 ZINC001172412689 974678106 /nfs/dbraw/zinc/67/81/06/974678106.db2.gz BMDHQKSAFQCBGY-HSBZDZAISA-N 2 0 242.407 2.264 20 0 BEADRP CCOCC[C@H](C)[NH2+]CCCCCCC[NH3+] ZINC001172419226 974692300 /nfs/dbraw/zinc/69/23/00/974692300.db2.gz JNIDTJRJHDMERR-ZDUSSCGKSA-N 2 0 230.396 2.300 20 0 BEADRP CC(C)OCC[C@@H](C)[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC001172431420 974712849 /nfs/dbraw/zinc/71/28/49/974712849.db2.gz NNCUHMFVFCEZKN-FRRDWIJNSA-N 2 0 228.380 2.050 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]Cc1cncc2ccccc21 ZINC001331420134 974714216 /nfs/dbraw/zinc/71/42/16/974714216.db2.gz UWBLNHPJIBERKB-LBPRGKRZSA-N 2 0 243.354 2.322 20 0 BEADRP CC[C@H](CC(C)C)[NH2+]C[C@H]1CC[N@H+](C)C1 ZINC001172384476 974729316 /nfs/dbraw/zinc/72/93/16/974729316.db2.gz INZHPCCJMQYRDC-CHWSQXEVSA-N 2 0 212.381 2.352 20 0 BEADRP CC(C)COCC[C@@H](C)[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC001172455482 974818839 /nfs/dbraw/zinc/81/88/39/974818839.db2.gz TZAHHOSLBXQLDV-HZSPNIEDSA-N 2 0 242.407 2.297 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]C1CCC2(CC2)CC1 ZINC001331836513 974833289 /nfs/dbraw/zinc/83/32/89/974833289.db2.gz WWAKCQHWRYFZHL-NSHDSACASA-N 2 0 210.365 2.297 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@@H]([NH2+]Cc3ccccc3)[C@@H]2C1 ZINC001204089096 974866033 /nfs/dbraw/zinc/86/60/33/974866033.db2.gz KSBIZZKVSZCIAG-RRFJBIMHSA-N 2 0 230.355 2.116 20 0 BEADRP CO[C@@H]1CCC[C@@H]([NH2+]C(C)(C)C(C)(C)[NH3+])C1 ZINC001172926264 974970369 /nfs/dbraw/zinc/97/03/69/974970369.db2.gz PCOGHHSRRCDYCU-GHMZBOCLSA-N 2 0 228.380 2.050 20 0 BEADRP CC1(C)[C@@H]([NH2+]C/C=C\C2CC2)[C@@H]2CCC[NH2+][C@@H]21 ZINC001332421419 975110362 /nfs/dbraw/zinc/11/03/62/975110362.db2.gz PVGWVAASXHLIBK-JNNWSRRJSA-N 2 0 234.387 2.319 20 0 BEADRP CCSC[C@@H](C)[N@@H+]1CCn2c(cnc2C)C1 ZINC001173302090 975200706 /nfs/dbraw/zinc/20/07/06/975200706.db2.gz OHDYNUYKJBHNPQ-SNVBAGLBSA-N 2 0 239.388 2.149 20 0 BEADRP CC[N@@H+]1CC[C@@H](n2c(C[NH3+])cc3ccccc32)C1 ZINC001173349899 975293320 /nfs/dbraw/zinc/29/33/20/975293320.db2.gz KTBXBKHKIRAYHO-CYBMUJFWSA-N 2 0 243.354 2.367 20 0 BEADRP CCSC[C@@H](C)[N@@H+]1C[C@H]2C[C@@]2(C[NH+](C)C)C1 ZINC001173315642 975305054 /nfs/dbraw/zinc/30/50/54/975305054.db2.gz RVUKSJUJEFUFDJ-JHJVBQTASA-N 2 0 242.432 2.012 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H]2CC23CCC3)CC1 ZINC000721226775 975361797 /nfs/dbraw/zinc/36/17/97/975361797.db2.gz RWYDXCHKKQALLB-CYBMUJFWSA-N 2 0 222.376 2.393 20 0 BEADRP CC(C[NH+](C)CCCF)C[N@H+](C)CCCF ZINC001333475170 975804028 /nfs/dbraw/zinc/80/40/28/975804028.db2.gz YDTZWSCLQAZWIY-UHFFFAOYSA-N 2 0 236.350 2.205 20 0 BEADRP C[NH+](C)CCc1ccc(Nc2cc[nH+]cc2)cc1 ZINC001173884830 975975046 /nfs/dbraw/zinc/97/50/46/975975046.db2.gz UBPXMIWFMLHZTG-UHFFFAOYSA-N 2 0 241.338 2.351 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC001334389961 976487574 /nfs/dbraw/zinc/48/75/74/976487574.db2.gz KQKVXBOURRWFEG-HIFRSBDPSA-N 3 0 249.402 2.054 20 0 BEADRP CC(C)=CNc1c[nH+]ccc1N1CC[NH+](C)CC1 ZINC001174556394 976864902 /nfs/dbraw/zinc/86/49/02/976864902.db2.gz FKOQGXSJOHHNFW-UHFFFAOYSA-N 2 0 246.358 2.169 20 0 BEADRP CC1(C)C[C@H]([NH3+])C[C@@H]([NH2+]C/C=C\C2CC2)C1 ZINC001335252888 976899530 /nfs/dbraw/zinc/89/95/30/976899530.db2.gz QOCASHRVWHHSCX-FGTRRKKMSA-N 2 0 222.376 2.448 20 0 BEADRP C[N@@H+]1CCC[C@@H]2CN(c3cc[nH+]cc3)CC[C@@H]21 ZINC001336391779 977655523 /nfs/dbraw/zinc/65/55/23/977655523.db2.gz NFGAWVRZIADVHU-OCCSQVGLSA-N 2 0 231.343 2.002 20 0 BEADRP COC[C@H]1CC[N@H+](Cc2cc3c[nH+]ccc3[nH]2)C1 ZINC001232010785 977839221 /nfs/dbraw/zinc/83/92/21/977839221.db2.gz AOQISHDFUCFCEV-NSHDSACASA-N 2 0 245.326 2.031 20 0 BEADRP C[N@H+](Cc1cc2c[nH+]ccc2[nH]1)CC1(C)COC1 ZINC001232014895 977840484 /nfs/dbraw/zinc/84/04/84/977840484.db2.gz WRTWSGBVUPYHOB-UHFFFAOYSA-N 2 0 245.326 2.031 20 0 BEADRP Cc1cc(C)[nH+]c(N2C[C@@H](C[NH3+])CC[C@@H]2C)c1 ZINC000721831039 978042987 /nfs/dbraw/zinc/04/29/87/978042987.db2.gz SYHDOVJHJRSFHJ-QWHCGFSZSA-N 2 0 233.359 2.262 20 0 BEADRP Cc1cccnc1N1CCC2(CC[N@@H+](C)C2)CC1 ZINC001277707318 978258192 /nfs/dbraw/zinc/25/81/92/978258192.db2.gz AGXRWOVEDJHJEW-UHFFFAOYSA-N 2 0 245.370 2.312 20 0 BEADRP C[C@@]1(C[NH3+])CCC[N@H+](C[C@H]2CCC=CO2)CC1 ZINC001206293282 978294042 /nfs/dbraw/zinc/29/40/42/978294042.db2.gz GYCVALYSUFTMPZ-ZIAGYGMSSA-N 2 0 238.375 2.130 20 0 BEADRP Cc1cc(F)cc(N[C@@H]2CC[C@@H]3C[N@@H+](C)C[C@@H]23)n1 ZINC001337431702 978334330 /nfs/dbraw/zinc/33/43/30/978334330.db2.gz LURLWJIBIUMBAM-RAIGVLPGSA-N 2 0 249.333 2.281 20 0 BEADRP C[C@@]1(C[NH3+])CCC[N@H+](Cc2nccs2)CC1 ZINC001206305103 978385775 /nfs/dbraw/zinc/38/57/75/978385775.db2.gz SYZPNMNVFDODPY-GFCCVEGCSA-N 2 0 239.388 2.094 20 0 BEADRP CC(C)[N@@H+]1CCC[C@@]2(CCC[NH+](C)C2)C1 ZINC001277796739 978652427 /nfs/dbraw/zinc/65/24/27/978652427.db2.gz ITANLRQEIQXFFR-CYBMUJFWSA-N 2 0 210.365 2.203 20 0 BEADRP Cl/C=C/C[NH2+]Cc1ccnn1-c1cc[nH+]cc1 ZINC001179747913 978750476 /nfs/dbraw/zinc/75/04/76/978750476.db2.gz QYZOJWXGWRBVEO-ORCRQEGFSA-N 2 0 248.717 2.109 20 0 BEADRP C[NH+](C)CCCOc1ccc(C[NH+]2CCC2)cc1 ZINC001204265495 978856981 /nfs/dbraw/zinc/85/69/81/978856981.db2.gz IAACNMQGTNOENW-UHFFFAOYSA-N 2 0 248.370 2.223 20 0 BEADRP CC[C@H]1CC[C@@H]([NH2+]CCCC[NH+](C)C)C1 ZINC000070643874 978860952 /nfs/dbraw/zinc/86/09/52/978860952.db2.gz ACOZKZUVNMIGQE-QWHCGFSZSA-N 2 0 212.381 2.497 20 0 BEADRP CC1=C[C@@H](C)[C@@H](CN2CC[C@@H]3[NH2+]CC[C@@H]32)CC1 ZINC001235005054 978948369 /nfs/dbraw/zinc/94/83/69/978948369.db2.gz VWBYIUXOKAPWBI-KBXIAJHMSA-N 2 0 234.387 2.415 20 0 BEADRP CC1(CN2CC[C@@H]3[NH2+]CC[C@H]32)CCCCC1 ZINC001235039643 978949878 /nfs/dbraw/zinc/94/98/78/978949878.db2.gz WZURKGSSWQGUKU-QWHCGFSZSA-N 2 0 222.376 2.393 20 0 BEADRP CC1=C[C@H](C)[C@@H](C[N@@H+]2CCC3(C[NH2+]C3)C2)CC1 ZINC001235024000 978955052 /nfs/dbraw/zinc/95/50/52/978955052.db2.gz JGHYLWARNPBBDX-UONOGXRCSA-N 2 0 234.387 2.274 20 0 BEADRP CCCC[C@@H](CC)C[N@@H+]1CC[C@H]2[NH2+]C[C@H]2C1 ZINC001235026262 978956084 /nfs/dbraw/zinc/95/60/84/978956084.db2.gz LWMWPXYUCUXCLQ-HZSPNIEDSA-N 2 0 224.392 2.497 20 0 BEADRP CCCC[N@@H+]1CCCC[C@]12CCC[NH2+]C2 ZINC001235172290 978990686 /nfs/dbraw/zinc/99/06/86/978990686.db2.gz LEHGQRBFQRMRSP-CYBMUJFWSA-N 2 0 210.365 2.395 20 0 BEADRP CCC[NH+]1CCC([C@@H]2CCCC[NH2+]2)CC1 ZINC001235233001 978999688 /nfs/dbraw/zinc/99/96/88/978999688.db2.gz LFVJGAGLWBDJFD-ZDUSSCGKSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH+]1CCC([C@@H]2CCCC[NH2+]2)CC1 ZINC001235231219 979000160 /nfs/dbraw/zinc/00/01/60/979000160.db2.gz DITYPRZQQJKYQK-YUELXQCFSA-N 2 0 236.403 2.497 20 0 BEADRP CC1=C[C@@H](C)[C@@H](CN2CC[C@H]3[NH2+]CC[C@@H]32)CC1 ZINC001235236240 979002627 /nfs/dbraw/zinc/00/26/27/979002627.db2.gz VWBYIUXOKAPWBI-TUVASFSCSA-N 2 0 234.387 2.415 20 0 BEADRP CC1=C[C@@H](C)[C@H](CN2CC[C@H]3[NH2+]CC[C@@H]32)CC1 ZINC001235236238 979003325 /nfs/dbraw/zinc/00/33/25/979003325.db2.gz VWBYIUXOKAPWBI-BARDWOONSA-N 2 0 234.387 2.415 20 0 BEADRP CC1=C[C@H](C)[C@H](CN2CC[C@H]3[NH2+]CC[C@@H]32)CC1 ZINC001235236242 979004088 /nfs/dbraw/zinc/00/40/88/979004088.db2.gz VWBYIUXOKAPWBI-XQLPTFJDSA-N 2 0 234.387 2.415 20 0 BEADRP CCC[C@@H](C)C[N@@H+]1C[C@H]2CCC[C@@]2([NH3+])C1 ZINC001235241010 979004989 /nfs/dbraw/zinc/00/49/89/979004989.db2.gz PGYLMEFOGKNULV-JHJVBQTASA-N 2 0 210.365 2.236 20 0 BEADRP [NH3+][C@H]1[C@H]2C[N@@H+](CCCC3CCCCC3)C[C@@H]12 ZINC001235283450 979016786 /nfs/dbraw/zinc/01/67/86/979016786.db2.gz OTBBWLWHFCUHBY-BTTYYORXSA-N 2 0 222.376 2.236 20 0 BEADRP CC(C)(C)c1cccc(C[N@H+]2C[C@@H]3[C@H]([NH3+])[C@@H]3C2)c1 ZINC001235284604 979018401 /nfs/dbraw/zinc/01/84/01/979018401.db2.gz NXGLQPKBJUXSKA-QDMKHBRRSA-N 2 0 244.382 2.373 20 0 BEADRP CCC[C@H](C)C[N@@H+]1CC[C@]2(C1)C[NH2+]CC[C@@H]2F ZINC001235409756 979037139 /nfs/dbraw/zinc/03/71/39/979037139.db2.gz WUTILDPETAWHJQ-MELADBBJSA-N 2 0 242.382 2.446 20 0 BEADRP CCC[C@H](C)C[N@@H+]1CC[C@@]2(C1)C[NH2+]CC[C@@H]2F ZINC001235409753 979038754 /nfs/dbraw/zinc/03/87/54/979038754.db2.gz WUTILDPETAWHJQ-IHRRRGAJSA-N 2 0 242.382 2.446 20 0 BEADRP CCCCC1CC[NH+](CCC[NH2+]C)CC1 ZINC001235433432 979046386 /nfs/dbraw/zinc/04/63/86/979046386.db2.gz WKGCYVJNFNNOGK-UHFFFAOYSA-N 2 0 212.381 2.498 20 0 BEADRP CCC[C@@H]1CCCC[N@@H+]1C[C@@H]1CNC(C)(C)O1 ZINC001235694940 979125553 /nfs/dbraw/zinc/12/55/53/979125553.db2.gz XLDHRJDPVVDNHE-OLZOCXBDSA-N 2 0 240.391 2.366 20 0 BEADRP C[C@H]1CCC[N@H+](CC[C@H]2COC(C)(C)N2)[C@H]1C ZINC001235694713 979125817 /nfs/dbraw/zinc/12/58/17/979125817.db2.gz ITAFKYVRPPQQCB-AVGNSLFASA-N 2 0 240.391 2.221 20 0 BEADRP Cc1ccc(C)c(C[N@@H+]2CCCC3(C[NH2+]C3)C2)c1 ZINC001235710707 979128652 /nfs/dbraw/zinc/12/86/52/979128652.db2.gz DRFYGSOPYVUTHP-UHFFFAOYSA-N 2 0 244.382 2.489 20 0 BEADRP [NH3+]CCCC[N@@H+]1CC[C@@H](c2ccc(F)cc2)C1 ZINC001235949272 979216625 /nfs/dbraw/zinc/21/66/25/979216625.db2.gz BTICWVVQVUAXAH-CYBMUJFWSA-N 2 0 236.334 2.354 20 0 BEADRP Cc1ccc(C)c(C[N@H+]2C[C@H]3CC[C@@H](C2)[C@@H]3[NH3+])c1 ZINC001235959331 979226731 /nfs/dbraw/zinc/22/67/31/979226731.db2.gz NSZVKMZAWSPYAV-MIFYACCESA-N 2 0 244.382 2.473 20 0 BEADRP CC1(C[N@@H+]2C[C@@H]3CC[C@@]3([NH3+])C2)CCCCC1 ZINC001235981991 979259246 /nfs/dbraw/zinc/25/92/46/979259246.db2.gz ZUAJVVIGKRLKEA-GXTWGEPZSA-N 2 0 222.376 2.380 20 0 BEADRP Cc1cc(C)cc(CN2C[C@H]3CC[C@@H](C2)[NH2+]C3)c1 ZINC001236059718 979349165 /nfs/dbraw/zinc/34/91/65/979349165.db2.gz KHCQFMSPRJCGKH-HOCLYGCPSA-N 2 0 244.382 2.487 20 0 BEADRP C([C@@H]1CCCC[NH2+]1)[NH+]1CC2CCC(CC2)C1 ZINC001236089495 979380243 /nfs/dbraw/zinc/38/02/43/979380243.db2.gz VOWUIFFAWLJZRC-RUXDESIVSA-N 2 0 222.376 2.251 20 0 BEADRP [NH3+]CCCC[NH+]1CCC(c2ccc(O)cc2)CC1 ZINC001236144082 979410297 /nfs/dbraw/zinc/41/02/97/979410297.db2.gz MMEDIZYJGCDCMR-UHFFFAOYSA-N 2 0 248.370 2.311 20 0 BEADRP Cc1ccc(C[N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)cc1 ZINC001236314000 979525374 /nfs/dbraw/zinc/52/53/74/979525374.db2.gz DVWCSNMXLYPFFA-IYBDPMFKSA-N 2 0 244.382 2.426 20 0 BEADRP CS[C@@H](C)CC[N@H+]1C[C@@H]2CC[NH2+]CC[C@@H]2C1 ZINC001236315219 979525599 /nfs/dbraw/zinc/52/55/99/979525599.db2.gz WHQWNLQJKNWGMC-RWMBFGLXSA-N 2 0 242.432 2.059 20 0 BEADRP Nc1ccc(C2CC[NH+](CCCC[NH3+])CC2)cc1 ZINC001236336529 979538315 /nfs/dbraw/zinc/53/83/15/979538315.db2.gz QNZJRKQSLLGPTJ-UHFFFAOYSA-N 2 0 247.386 2.187 20 0 BEADRP CCCC[C@H](CC)C[N@H+](C)[C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001236412465 979587788 /nfs/dbraw/zinc/58/77/88/979587788.db2.gz VEVXZWGZCWMPAK-IGQOVBAYSA-N 2 0 224.392 2.352 20 0 BEADRP C[NH+](C)Cc1cccc(-c2ccnc(C[NH3+])c2)c1 ZINC001236423305 979595097 /nfs/dbraw/zinc/59/50/97/979595097.db2.gz OCGWIGSIZUEHJO-UHFFFAOYSA-N 2 0 241.338 2.269 20 0 BEADRP C[C@H]([NH3+])CN(Cc1ccccc1)C1CCC1 ZINC001236440782 979599345 /nfs/dbraw/zinc/59/93/45/979599345.db2.gz HAACFFAXPGSQPZ-LBPRGKRZSA-N 2 0 218.344 2.388 20 0 BEADRP C[C@@]1(C[NH3+])CCCC[N@H+](Cc2ccoc2)C1 ZINC001206542367 979669986 /nfs/dbraw/zinc/66/99/86/979669986.db2.gz ZGURPBUNRHEMEB-ZDUSSCGKSA-N 2 0 222.332 2.231 20 0 BEADRP C[C@@]1([NH3+])CCC[N@H+](CCC2CCOCC2)CC1 ZINC001205255776 979739076 /nfs/dbraw/zinc/73/90/76/979739076.db2.gz KSLJUGISNUCJAO-CQSZACIVSA-N 2 0 240.391 2.006 20 0 BEADRP C[C@H]([NH3+])CN(C)Cc1c[nH]c2ccc(F)cc12 ZINC001236895085 979783585 /nfs/dbraw/zinc/78/35/85/979783585.db2.gz KPTARYRIMQJICD-VIFPVBQESA-N 2 0 235.306 2.086 20 0 BEADRP [NH3+]CCc1ccccc1-c1ccc(C[NH3+])cc1 ZINC000005764172 980248246 /nfs/dbraw/zinc/24/82/46/980248246.db2.gz DOJCNDLRIVSUFL-UHFFFAOYSA-N 2 0 226.323 2.314 20 0 BEADRP CC1CCC([NH2+][C@H]2CCCC[C@H]2[NH3+])CC1 ZINC000722650839 980308734 /nfs/dbraw/zinc/30/87/34/980308734.db2.gz XDBJXBGGIAHESA-TUUUFIMRSA-N 2 0 210.365 2.425 20 0 BEADRP c1cc2c[nH+]cc(C3=CCC[NH2+]CC3)c2[nH]1 ZINC001238941567 980381845 /nfs/dbraw/zinc/38/18/45/980381845.db2.gz OSCFXMIWZRFSHS-UHFFFAOYSA-N 2 0 213.284 2.330 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]C[C@@H]1CCC[C@@H](C)C1 ZINC001345105247 980550501 /nfs/dbraw/zinc/55/05/01/980550501.db2.gz RKBNYBXSZTVLTR-JHJVBQTASA-N 2 0 212.381 2.400 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H]1CCCC12CCC2 ZINC001345484167 980617853 /nfs/dbraw/zinc/61/78/53/980617853.db2.gz VZYCOGXNCOZACE-VXGBXAGGSA-N 2 0 210.365 2.297 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H](C)c1ccc(C)nc1C ZINC001345483542 980619095 /nfs/dbraw/zinc/61/90/95/980619095.db2.gz SPSPIODCMLASNZ-JQWIXIFHSA-N 2 0 235.375 2.205 20 0 BEADRP [NH3+]C[C@]1(F)CCC[N@H+](C[C@@H]2CC=CCC2)CC1 ZINC001205539440 980915568 /nfs/dbraw/zinc/91/55/68/980915568.db2.gz ZDTLOSJQXFDSNE-KGLIPLIRSA-N 2 0 240.366 2.496 20 0 BEADRP [NH3+]Cc1cncc(-c2ccc(C3([NH3+])CC3)cc2)c1 ZINC001239798678 980938614 /nfs/dbraw/zinc/93/86/14/980938614.db2.gz HHXQWGKWWIDRKO-UHFFFAOYSA-N 2 0 239.322 2.155 20 0 BEADRP C[C@H](Cc1ccco1)[NH2+]C1CCC(C[NH3+])CC1 ZINC001325743035 980999967 /nfs/dbraw/zinc/99/99/67/980999967.db2.gz IDULZDLECMXLOH-PNESKVBLSA-N 2 0 236.359 2.318 20 0 BEADRP COC(C)(C)CC[N@@H+]1CC[C@H](C)[C@@H](C[NH3+])CC1 ZINC001205599921 981152181 /nfs/dbraw/zinc/15/21/81/981152181.db2.gz AMWWIRHSVGSAMJ-QWHCGFSZSA-N 2 0 242.407 2.108 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]C/C=C\c1ccc(F)cc1 ZINC001348515444 981380655 /nfs/dbraw/zinc/38/06/55/981380655.db2.gz MQVQNLZNVMECKQ-VSQXVHSFSA-N 2 0 236.334 2.427 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]C[C@H]1CCOc2ccccc21 ZINC001348516705 981380774 /nfs/dbraw/zinc/38/07/74/981380774.db2.gz WKQRMLYPSZCYHR-QWHCGFSZSA-N 2 0 248.370 2.140 20 0 BEADRP C[NH+](C)Cc1cccc(C2=CC[NH2+]CC2)c1F ZINC001240470154 981407243 /nfs/dbraw/zinc/40/72/43/981407243.db2.gz BRSJZNYXVRDBFP-UHFFFAOYSA-N 2 0 234.318 2.264 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H]1CCC[C@H]1C(C)C ZINC001348839625 981454795 /nfs/dbraw/zinc/45/47/95/981454795.db2.gz DJXCQEANTNKWKK-FRRDWIJNSA-N 2 0 212.381 2.399 20 0 BEADRP c1cc([C@H]2CCC[NH2+]2)ccc1C1=CCC[NH2+]C1 ZINC001240663974 981572710 /nfs/dbraw/zinc/57/27/10/981572710.db2.gz FBCIDLLSFYBYID-OAHLLOKOSA-N 2 0 228.339 2.488 20 0 BEADRP C[C@@H]([NH3+])c1cccc(C2=CCC[NH2+]C2)c1 ZINC001240669100 981577139 /nfs/dbraw/zinc/57/71/39/981577139.db2.gz IJSJSLQFEKAOAO-SNVBAGLBSA-N 2 0 202.301 2.083 20 0 BEADRP C[C@H]([NH3+])c1cccc(C2=CCC[NH2+]C2)c1 ZINC001240669099 981577388 /nfs/dbraw/zinc/57/73/88/981577388.db2.gz IJSJSLQFEKAOAO-JTQLQIEISA-N 2 0 202.301 2.083 20 0 BEADRP Cc1ccc(C2=CCC[NH2+]C2)c(C[NH+](C)C)c1 ZINC001240670125 981579483 /nfs/dbraw/zinc/57/94/83/981579483.db2.gz FSBMENYRGWZCHQ-UHFFFAOYSA-N 2 0 230.355 2.433 20 0 BEADRP [NH3+]C1(c2ccccc2C=C2CC[NH2+]CC2)CC1 ZINC001240877047 981926748 /nfs/dbraw/zinc/92/67/48/981926748.db2.gz AIXARZFLKTVQFN-UHFFFAOYSA-N 2 0 228.339 2.401 20 0 BEADRP C(c1ccc2c(c1)C[NH2+]C2)=C1CC[NH2+]CC1 ZINC001240878206 981931883 /nfs/dbraw/zinc/93/18/83/981931883.db2.gz NHDKYLHYPYSICU-UHFFFAOYSA-N 2 0 214.312 2.057 20 0 BEADRP C[NH2+]Cc1ccccc1C=C1CC[NH2+]CC1 ZINC001240879443 981935678 /nfs/dbraw/zinc/93/56/78/981935678.db2.gz QONXDKYCVUAMEX-UHFFFAOYSA-N 2 0 216.328 2.173 20 0 BEADRP C[C@@H]([NH3+])c1ccccc1C=C1CC[NH2+]CC1 ZINC001240879240 981936170 /nfs/dbraw/zinc/93/61/70/981936170.db2.gz LOARXPBEOPMKSM-LLVKDONJSA-N 2 0 216.328 2.473 20 0 BEADRP C[N@@H+]1CCc2ccc(C=C3CC[NH2+]CC3)cc2C1 ZINC001240879272 981936226 /nfs/dbraw/zinc/93/62/26/981936226.db2.gz NKCXVURYFZVQJG-UHFFFAOYSA-N 2 0 242.366 2.441 20 0 BEADRP Cc1cc(C[N@@H+]2CC[C@H](C[NH3+])[C@@H](C)C2)cs1 ZINC001350910554 982119499 /nfs/dbraw/zinc/11/94/99/982119499.db2.gz QKGUXDIZVFRXJM-GXFFZTMASA-N 2 0 238.400 2.473 20 0 BEADRP CO[C@@H]1CC[C@H]([NH2+][C@H]2C[C@@H]([NH3+])CC(C)(C)C2)C1 ZINC001350955158 982134364 /nfs/dbraw/zinc/13/43/64/982134364.db2.gz GSNVDRTZKXVUMO-MROQNXINSA-N 2 0 240.391 2.050 20 0 BEADRP C[C@@H]1[C@H]2CC[C@@H](C[C@@H]1[NH2+][C@@H]1CCC[C@@H](F)C1)[NH2+]2 ZINC001350959245 982136744 /nfs/dbraw/zinc/13/67/44/982136744.db2.gz XNODQIRSFIWCIY-HUXGKSLCSA-N 2 0 240.366 2.386 20 0 BEADRP C[N@H+]1CC=C(c2ccc([C@@H]3CC[NH2+]C3)cc2)CC1 ZINC001241333404 982500507 /nfs/dbraw/zinc/50/05/07/982500507.db2.gz VESHRZQOPMYQHR-MRXNPFEDSA-N 2 0 242.366 2.482 20 0 BEADRP C[NH+](C)Cc1ccccc1C1=CCC[N@H+](C)C1 ZINC001241568098 982814341 /nfs/dbraw/zinc/81/43/41/982814341.db2.gz ANVVQTDMNWDYFI-UHFFFAOYSA-N 2 0 230.355 2.467 20 0 BEADRP C[N@@H+]1CCC=C(c2ccc3c[nH+]cn3c2)C1 ZINC001241569727 982815265 /nfs/dbraw/zinc/81/52/65/982815265.db2.gz NNXATRLSRMFVFS-UHFFFAOYSA-N 2 0 213.284 2.053 20 0 BEADRP C[N@@H+]1CCC=C(c2ccc3c(c2)[C@H]([NH3+])CC3)C1 ZINC001241572510 982827172 /nfs/dbraw/zinc/82/71/72/982827172.db2.gz ZKUCSLLAIKPJHC-OAHLLOKOSA-N 2 0 228.339 2.352 20 0 BEADRP C[N@@H+]1CC[C@@H]2C[NH+](C[C@H]3CC=CCC3)C[C@@H]2C1 ZINC001201412125 983215197 /nfs/dbraw/zinc/21/51/97/983215197.db2.gz UKBOQADTSIDRNP-ZNMIVQPWSA-N 2 0 234.387 2.226 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+]C/C=C/C1CC1 ZINC001354234603 983215691 /nfs/dbraw/zinc/21/56/91/983215691.db2.gz HVTZONDPKTWVCW-VPQRWHKOSA-N 2 0 220.360 2.058 20 0 BEADRP CC[NH+]1C[C@@H]2C[NH+](C[C@@H]3CC=CCC3)C[C@H]2C1 ZINC001201426245 983223291 /nfs/dbraw/zinc/22/32/91/983223291.db2.gz GHAVTSMFINVLCL-RBSFLKMASA-N 2 0 234.387 2.226 20 0 BEADRP c1cn2c(n1)CC[N@H+](C[C@H]1CC=CCC1)CC2 ZINC001201423946 983223401 /nfs/dbraw/zinc/22/34/01/983223401.db2.gz YEYDDTZUSBMVEQ-ZDUSSCGKSA-N 2 0 231.343 2.098 20 0 BEADRP C[NH+](C)C[C@@]12C[C@@H]1C[N@H+](C[C@H]1CC=CCC1)C2 ZINC001201426304 983224114 /nfs/dbraw/zinc/22/41/14/983224114.db2.gz CUQSANQMDYCELT-RRFJBIMHSA-N 2 0 234.387 2.226 20 0 BEADRP C[NH2+]Cc1ccccc1C1=C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC001242027604 983237976 /nfs/dbraw/zinc/23/79/76/983237976.db2.gz DZHYSPLORGZPBP-KGLIPLIRSA-N 2 0 228.339 2.314 20 0 BEADRP CCC[C@@H](C)C[NH+]1CCC2(C[NH+](C)C2)CC1 ZINC001201553977 983310338 /nfs/dbraw/zinc/31/03/38/983310338.db2.gz RNCFYXCJBIRXEI-CYBMUJFWSA-N 2 0 224.392 2.450 20 0 BEADRP CCC[C@H](C)C[NH+]1C[C@H]2C[NH+](CC)C[C@@H]2C1 ZINC001201563428 983332688 /nfs/dbraw/zinc/33/26/88/983332688.db2.gz PYCOVVOTZVQWJN-BFHYXJOUSA-N 2 0 224.392 2.306 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@@H]2CC[N@H+](C)C2)C[C@@H]1C ZINC000082836859 983384724 /nfs/dbraw/zinc/38/47/24/983384724.db2.gz LXQXEXNCOGRKQX-RFGFWPKPSA-N 2 0 224.392 2.352 20 0 BEADRP CCCCC[N@H+](CC)CCC[NH+](C)C ZINC001201737109 983437859 /nfs/dbraw/zinc/43/78/59/983437859.db2.gz BAFKACWBXFCXQI-UHFFFAOYSA-N 2 0 200.370 2.450 20 0 BEADRP C[NH+]1CCC(C[NH+]2CCC(C3CC3)CC2)CC1 ZINC001355322360 983474598 /nfs/dbraw/zinc/47/45/98/983474598.db2.gz WOOMTFKBHCATIP-UHFFFAOYSA-N 2 0 236.403 2.450 20 0 BEADRP C[C@@H]1CCC(C)(C)C[C@@H]1[NH2+][C@H]1C[C@@H]([NH3+])C1 ZINC001576647943 984178528 /nfs/dbraw/zinc/17/85/28/984178528.db2.gz VPPVAFJXEUYUTN-WYUUTHIRSA-N 2 0 210.365 2.281 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@@]2(C)CC[NH2+]C2)C[C@H]1C ZINC001576669904 984180031 /nfs/dbraw/zinc/18/00/31/984180031.db2.gz BZEFTJBPYCDNRQ-MQYQWHSLSA-N 2 0 224.392 2.400 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@H](CC)CCC(F)(F)F ZINC001577124763 984189527 /nfs/dbraw/zinc/18/95/27/984189527.db2.gz PJJRGYQYYLHDJH-RKDXNWHRSA-N 2 0 226.286 2.434 20 0 BEADRP CCCCC[C@@H](O)C[NH2+]CC(C)(C)C[NH+](C)C ZINC001253555306 984209051 /nfs/dbraw/zinc/20/90/51/984209051.db2.gz YKNHUSUMAYNVJJ-CYBMUJFWSA-N 2 0 244.423 2.105 20 0 BEADRP C[N@H+](CC1CCC1)CC1CC[NH+](C)CC1 ZINC001202739571 984209255 /nfs/dbraw/zinc/20/92/55/984209255.db2.gz IFHVFUMYDNBYTH-UHFFFAOYSA-N 2 0 210.365 2.060 20 0 BEADRP [NH3+]C1(c2cccc(C3=CC[NH2+]CC3)c2)CCC1 ZINC001240470092 984304773 /nfs/dbraw/zinc/30/47/73/984304773.db2.gz VMTAULQTESIHHA-UHFFFAOYSA-N 2 0 228.339 2.401 20 0 BEADRP CC[C@H]1C[N@H+](C[C@@H]2CC[C@H]([NH3+])C2)[C@@H](CC)CO1 ZINC000717960448 984369062 /nfs/dbraw/zinc/36/90/62/984369062.db2.gz AHIXBZJDBPBPAA-RFGFWPKPSA-N 2 0 240.391 2.003 20 0 BEADRP CCC[NH+]1CCC2(C[NH+](Cc3ccc[nH]3)C2)CC1 ZINC001275102894 984487119 /nfs/dbraw/zinc/48/71/19/984487119.db2.gz BSBVBCJQDBFOSR-UHFFFAOYSA-N 2 0 247.386 2.323 20 0 BEADRP CCC[NH+]1CCC2(CCC[N@H+](C)C2)CC1 ZINC001275103944 984489391 /nfs/dbraw/zinc/48/93/91/984489391.db2.gz VJILRFGCBRCEEB-UHFFFAOYSA-N 2 0 210.365 2.204 20 0 BEADRP C1=C(c2ccc(C3CC[NH2+]CC3)cc2)C[NH2+]C1 ZINC001243110958 984573797 /nfs/dbraw/zinc/57/37/97/984573797.db2.gz OVDAYYISLOSZLH-UHFFFAOYSA-N 2 0 228.339 2.140 20 0 BEADRP C1=C(c2ccc(C[NH+]3CCCCC3)cn2)C[NH2+]C1 ZINC001243115418 984584193 /nfs/dbraw/zinc/58/41/93/984584193.db2.gz KPYOVSOBSPKRAT-UHFFFAOYSA-N 2 0 243.354 2.054 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CCC[C@]2(CCC[NH+](C)C2)C1 ZINC001276032783 984789791 /nfs/dbraw/zinc/78/97/91/984789791.db2.gz LNLFTYNRKVMFDL-KFWWJZLASA-N 2 0 236.403 2.450 20 0 BEADRP CC[NH2+]C1CC[NH+]([C@@H]2C=CCCC2)CC1 ZINC001577818200 984805146 /nfs/dbraw/zinc/80/51/46/984805146.db2.gz BYJSYELSBOHXFC-CYBMUJFWSA-N 2 0 208.349 2.169 20 0 BEADRP CC[NH2+]C1CC[NH+](C[C@]2(C)CCCCO2)CC1 ZINC001577821380 984806073 /nfs/dbraw/zinc/80/60/73/984806073.db2.gz LSRDOFFOMYBSMW-AWEZNQCLSA-N 2 0 240.391 2.020 20 0 BEADRP [NH3+]CCC[C@@H]([NH2+]C[C@@H]1CCCO1)c1ccccc1 ZINC000925500808 984827833 /nfs/dbraw/zinc/82/78/33/984827833.db2.gz FSKFXNJYHRDJHC-LSDHHAIUSA-N 2 0 248.370 2.235 20 0 BEADRP CCO[C@H]1CCC[C@H]([NH2+][C@@H]2CCCC[C@H]2[NH3+])C1 ZINC001578098125 984849001 /nfs/dbraw/zinc/84/90/01/984849001.db2.gz SAAVJWNNDJMPJW-IGQOVBAYSA-N 2 0 240.391 2.194 20 0 BEADRP CCO[C@@H]1CCCC[C@H]1[NH2+][C@@H]1CC[C@@H](C[NH3+])C1 ZINC001578148911 984855801 /nfs/dbraw/zinc/85/58/01/984855801.db2.gz NSWHANSRSOOYAX-AAVRWANBSA-N 2 0 240.391 2.051 20 0 BEADRP CCC[C@H](C)[N@H+]1C[C@H]2C[NH+](CC)C[C@H]2C1 ZINC001257326528 984895105 /nfs/dbraw/zinc/89/51/05/984895105.db2.gz BITQQQYMGOOJSK-RWMBFGLXSA-N 2 0 210.365 2.059 20 0 BEADRP CC[C@H](C)[NH+]1CCC([NH3+])(Cc2cccnc2)CC1 ZINC001257433164 985007376 /nfs/dbraw/zinc/00/73/76/985007376.db2.gz FRKUKERTSLPNDW-ZDUSSCGKSA-N 2 0 247.386 2.216 20 0 BEADRP C[N@H+](CCC[NH3+])[C@H]1CCC[C@@H]1C(C)(C)C ZINC001578466475 985097361 /nfs/dbraw/zinc/09/73/61/985097361.db2.gz OERWNFQHXZDKSS-RYUDHWBXSA-N 2 0 212.381 2.482 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H]1C[C@@H]2CC[C@@H](C2)C1 ZINC001578572033 985206754 /nfs/dbraw/zinc/20/67/54/985206754.db2.gz ZUYDHGFEXUQMEJ-NDBYEHHHSA-N 2 0 210.365 2.153 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]Cc1csc(C)c1 ZINC001578571941 985214945 /nfs/dbraw/zinc/21/49/45/985214945.db2.gz XUCQAVMZVILLSZ-VIFPVBQESA-N 2 0 212.362 2.144 20 0 BEADRP COC(C)(C)CC[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC001578892873 985454412 /nfs/dbraw/zinc/45/44/12/985454412.db2.gz MCFLVOJWEOYWSS-GFCCVEGCSA-N 2 0 242.407 2.169 20 0 BEADRP c1c(C[NH2+]CCC2CC2)sc2c1C[NH2+]CC2 ZINC000688039710 985506380 /nfs/dbraw/zinc/50/63/80/985506380.db2.gz VYFSXSRMNPZWSK-UHFFFAOYSA-N 2 0 236.384 2.284 20 0 BEADRP CO[C@H](C)C[N@H+](CCCCCC[NH3+])C(C)C ZINC000688042005 985510859 /nfs/dbraw/zinc/51/08/59/985510859.db2.gz TXLIEXUJDCHBDM-CYBMUJFWSA-N 2 0 230.396 2.251 20 0 BEADRP CC[N@H+](Cc1cc2c(s1)CC[NH2+]C2)C1CC1 ZINC000688040131 985512480 /nfs/dbraw/zinc/51/24/80/985512480.db2.gz WYPWSMJUSMUQRQ-UHFFFAOYSA-N 2 0 236.384 2.378 20 0 BEADRP COC1(C[NH2+]CC2(C[NH3+])CCC2)CCCCC1 ZINC001578930042 985531558 /nfs/dbraw/zinc/53/15/58/985531558.db2.gz NSVWFOZFSNMWKJ-UHFFFAOYSA-N 2 0 240.391 2.054 20 0 BEADRP CO[C@H]1CCC[C@H]([NH2+]CCC[NH2+]C(C)C)CC1 ZINC001578936989 985541455 /nfs/dbraw/zinc/54/14/55/985541455.db2.gz HQJDNLGMVMNZFZ-KBPBESRZSA-N 2 0 242.407 2.312 20 0 BEADRP CO[C@H]1CCC[C@H]([NH2+]CC[C@@H]([NH3+])C(C)C)CC1 ZINC001578936871 985547086 /nfs/dbraw/zinc/54/70/86/985547086.db2.gz HLNZDOJPVYDZGP-MELADBBJSA-N 2 0 242.407 2.297 20 0 BEADRP COC[C@@H](CC(C)(C)C)[NH2+]CC1(C[NH3+])CCC1 ZINC001578960912 985560801 /nfs/dbraw/zinc/56/08/01/985560801.db2.gz PNWUFPRRDRIGLP-GFCCVEGCSA-N 2 0 242.407 2.156 20 0 BEADRP COC[C@H](CC(C)(C)C)[NH2+][C@H]1CC[NH2+][C@@H](C)C1 ZINC001578960531 985577582 /nfs/dbraw/zinc/57/75/82/985577582.db2.gz JJXRHMYIUFZZHL-AVGNSLFASA-N 2 0 242.407 2.168 20 0 BEADRP Nc1[nH]c2ccc(C=CC3CC[NH2+]CC3)cc2[nH+]1 ZINC001243896849 985582644 /nfs/dbraw/zinc/58/26/44/985582644.db2.gz QLBWHFAJLUVMGT-OWOJBTEDSA-N 2 0 242.326 2.158 20 0 BEADRP [NH3+]C[C@H]1CCC[N@H+](CCCC2CCC2)C1 ZINC000688370551 985625612 /nfs/dbraw/zinc/62/56/12/985625612.db2.gz HNHYNMRSJHDYLZ-CYBMUJFWSA-N 2 0 210.365 2.237 20 0 BEADRP C[NH+](C)CCOc1ccccc1C1=C[NH2+]CCC1 ZINC001243950050 985642148 /nfs/dbraw/zinc/64/21/48/985642148.db2.gz LJTKBISXAUSVFW-UHFFFAOYSA-N 2 0 246.354 2.351 20 0 BEADRP [NH3+][C@@H]1CCc2ccc(C3=C[NH2+]CCC3)cc21 ZINC001243954127 985666573 /nfs/dbraw/zinc/66/65/73/985666573.db2.gz RCCQRMLDZYMDEX-CQSZACIVSA-N 2 0 214.312 2.357 20 0 BEADRP CC[C@H](CC(F)F)C[N@@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1 ZINC000688729473 985714348 /nfs/dbraw/zinc/71/43/48/985714348.db2.gz IOSJGNHGRVMGSV-GRYCIOLGSA-N 2 0 246.345 2.209 20 0 BEADRP CC[C@@H](CC(F)F)C[N@@H+]1CC[C@H](CC[NH3+])C1 ZINC000688725589 985716678 /nfs/dbraw/zinc/71/66/78/985716678.db2.gz IQKBEMHRDDXRCG-QWRGUYRKSA-N 2 0 234.334 2.339 20 0 BEADRP COc1cccc(C[NH2+][C@@H]2C[C@@H]([NH3+])C2(C)C)c1C ZINC001579277711 985829206 /nfs/dbraw/zinc/82/92/06/985829206.db2.gz KNSHHGOORUROGB-ZIAGYGMSSA-N 2 0 248.370 2.219 20 0 BEADRP CSC1(C[N@@H+]2CC[C@@H](C[NH3+])[C@H](C)C2)CCC1 ZINC001579364905 985860892 /nfs/dbraw/zinc/86/08/92/985860892.db2.gz FOYLHZOBKRYPLE-NEPJUHHUSA-N 2 0 242.432 2.189 20 0 BEADRP CSC1(C[NH2+]CC[C@@H]2CCC[NH2+]CC2)CC1 ZINC001579364837 985861485 /nfs/dbraw/zinc/86/14/85/985861485.db2.gz CIBNGBRCZAJVPR-GFCCVEGCSA-N 2 0 242.432 2.251 20 0 BEADRP CSCC[NH+]1CCC2(CCC[C@H]2C[NH3+])CC1 ZINC001579374885 985866115 /nfs/dbraw/zinc/86/61/15/985866115.db2.gz YBGVPHYCKMHPIN-LBPRGKRZSA-N 2 0 242.432 2.190 20 0 BEADRP C[C@@H]1CC(C)(C)C[C@](C)([NH2+]CC2C[NH2+]C2)C1 ZINC001579420641 985882281 /nfs/dbraw/zinc/88/22/81/985882281.db2.gz SKACAHRRFPZETK-BXUZGUMPSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]C(C)(C)CC[NH+](C)C ZINC001258451888 985895423 /nfs/dbraw/zinc/89/54/23/985895423.db2.gz UDDQSIFQEKNWOI-NSHDSACASA-N 2 0 212.381 2.495 20 0 BEADRP Cc1ccsc1CC[NH2+][C@H]1CC[C@H](C[NH3+])C1 ZINC001579816194 986236067 /nfs/dbraw/zinc/23/60/67/986236067.db2.gz YLWYPURZTKDXHG-RYUDHWBXSA-N 2 0 238.400 2.316 20 0 BEADRP CCC[NH+]1C[C@@H]2C[NH+](CC3CCC3)C[C@H]2C1 ZINC001202791914 986310413 /nfs/dbraw/zinc/31/04/13/986310413.db2.gz GVTMKXUVCUXMBR-ZIAGYGMSSA-N 2 0 222.376 2.060 20 0 BEADRP CC[NH+]1CCC(C[N@H+](C)C(C)(C)COC)CC1 ZINC001462301321 986343390 /nfs/dbraw/zinc/34/33/90/986343390.db2.gz ZMFOCKNUMRPFBA-UHFFFAOYSA-N 2 0 242.407 2.075 20 0 BEADRP Cc1sccc1C[NH2+]C[C@H]1CC[C@@H]([NH3+])C1 ZINC001579937194 986357074 /nfs/dbraw/zinc/35/70/74/986357074.db2.gz NBVOGUSMGRVPRN-CMPLNLGQSA-N 2 0 224.373 2.274 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2C[C@H]3CCCC[C@H]32)CC1 ZINC001462406946 986377649 /nfs/dbraw/zinc/37/76/49/986377649.db2.gz DJQCMSWEQSYFJX-ZIAGYGMSSA-N 2 0 222.376 2.203 20 0 BEADRP Cn1cccc1[C@H]1CCC[N@@H+]1C[C@H]1CC[C@@H]([NH3+])C1 ZINC001579975213 986381314 /nfs/dbraw/zinc/38/13/14/986381314.db2.gz WFXSLDSBTTVIQL-GZBFAFLISA-N 2 0 247.386 2.289 20 0 BEADRP CC[C@@H]1C[N@H+](CCCCCC[NH3+])C[C@@H](C)O1 ZINC000689190731 986384757 /nfs/dbraw/zinc/38/47/57/986384757.db2.gz MUTHBKLIEHYMGQ-CHWSQXEVSA-N 2 0 228.380 2.005 20 0 BEADRP FC1(F)CCC([NH2+][C@@H]2C[C@H]3CC[C@@H]2[NH2+]3)CC1 ZINC001580026647 986422469 /nfs/dbraw/zinc/42/24/69/986422469.db2.gz FDCCDJVJZHHDGI-OUAUKWLOSA-N 2 0 230.302 2.047 20 0 BEADRP C[C@@]1(C[N@@H+]2CCC[C@H](CCF)C2)CCC[NH2+]C1 ZINC000689421679 986579135 /nfs/dbraw/zinc/57/91/35/986579135.db2.gz MGZCUYDGDYBFFS-ZIAGYGMSSA-N 2 0 242.382 2.448 20 0 BEADRP CC1(C)CC([NH3+])CC(C)(C)[NH+]1[C@@H]1CCCOC1 ZINC001254367613 986588497 /nfs/dbraw/zinc/58/84/97/986588497.db2.gz KPVRZBQLAOGIGB-GFCCVEGCSA-N 2 0 240.391 2.146 20 0 BEADRP FCC[C@@H]1CCC[N@H+](C[C@@H]2CCCC[NH2+]C2)C1 ZINC000689443492 986608246 /nfs/dbraw/zinc/60/82/46/986608246.db2.gz AVGCHCGNLPASQN-UONOGXRCSA-N 2 0 242.382 2.448 20 0 BEADRP CCCC[C@@H](CC)[N@@H+]1CC[C@H]2C[NH2+]C[C@H]21 ZINC000378661744 986610712 /nfs/dbraw/zinc/61/07/12/986610712.db2.gz BYGVETDBNLGBOU-YNEHKIRRSA-N 2 0 210.365 2.249 20 0 BEADRP [NH3+][C@@H]1CC12CC([NH2+]CC[C@H]1CC=CCC1)C2 ZINC001580164355 986634950 /nfs/dbraw/zinc/63/49/50/986634950.db2.gz HOSAMTXYTAZUMQ-RJZJGCCBSA-N 2 0 220.360 2.202 20 0 BEADRP [NH3+]C1CC([NH2+]CC2(C3CCC3)CCC2)C1 ZINC001580166546 986644743 /nfs/dbraw/zinc/64/47/43/986644743.db2.gz XHRXWUWJTDREBD-UHFFFAOYSA-N 2 0 208.349 2.036 20 0 BEADRP CO[C@H]1CCC[C@@H]([NH2+][C@H]2CCC[N@H+](C)CC2)C1 ZINC001254514863 986659917 /nfs/dbraw/zinc/65/99/17/986659917.db2.gz OWKCIVFUIUJUFF-MJBXVCDLSA-N 2 0 240.391 2.018 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH+]2CC[C@@]3(CC3(F)F)C2)CC1 ZINC001254525088 986662260 /nfs/dbraw/zinc/66/22/60/986662260.db2.gz FZKAHYKBJWAHIH-NWDGAFQWSA-N 2 0 244.329 2.202 20 0 BEADRP [NH3+]CC1(C[N@@H+]2CC[C@@H]2Cc2ccccc2)CC1 ZINC001580243974 986693398 /nfs/dbraw/zinc/69/33/98/986693398.db2.gz NGNMWYLETCDJJB-CQSZACIVSA-N 2 0 230.355 2.042 20 0 BEADRP [NH3+]CC1(C[NH2+]CCC[C@H]2C=CCC2)CC1 ZINC001580244448 986695779 /nfs/dbraw/zinc/69/57/79/986695779.db2.gz XKZMUBKMPXYQBU-LBPRGKRZSA-N 2 0 208.349 2.061 20 0 BEADRP [NH3+]CC1(C[NH2+]CCC2CC=CC2)CCC1 ZINC001580243435 986697311 /nfs/dbraw/zinc/69/73/11/986697311.db2.gz GURMXYPTNUXVRU-UHFFFAOYSA-N 2 0 208.349 2.061 20 0 BEADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@H]2C[C@]2(F)c2ccccc2)C1 ZINC001580258258 986715378 /nfs/dbraw/zinc/71/53/78/986715378.db2.gz LGXPSWIIKGJBMB-UNQGMJICSA-N 2 0 248.345 2.341 20 0 BEADRP [NH3+]CCC1CC([NH2+]CCCc2ccsc2)C1 ZINC001580287156 986734170 /nfs/dbraw/zinc/73/41/70/986734170.db2.gz SLIRJBOIAWYCSA-UHFFFAOYSA-N 2 0 238.400 2.398 20 0 BEADRP Cc1cc(C)c(C[N@H+](C)CC2CC[NH+](C)CC2)[nH]1 ZINC001137327642 986779310 /nfs/dbraw/zinc/77/93/10/986779310.db2.gz AFFBKDGYKYZEJD-UHFFFAOYSA-N 2 0 249.402 2.405 20 0 BEADRP Cc1ccc(C[C@H](C)[NH2+]C[C@H](C)C[NH3+])cc1 ZINC001255779276 987069833 /nfs/dbraw/zinc/06/98/33/987069833.db2.gz AAQYVGDNTSARTN-OLZOCXBDSA-N 2 0 220.360 2.110 20 0 BEADRP Cc1c[nH+]c(-c2ccc3c[nH+]cn3c2)cc1N ZINC001245894663 987114720 /nfs/dbraw/zinc/11/47/20/987114720.db2.gz LPAFSYDYCPUTPN-UHFFFAOYSA-N 2 0 224.267 2.287 20 0 BEADRP CSCCC[NH2+][C@@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C ZINC000693665680 987313071 /nfs/dbraw/zinc/31/30/71/987313071.db2.gz UEDLBMGMXLDDSO-GRYCIOLGSA-N 2 0 242.432 2.106 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+][C@@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C ZINC000693761924 987315668 /nfs/dbraw/zinc/31/56/68/987315668.db2.gz PTWDJZVVQCONPX-NJMOYASZSA-N 2 0 222.376 2.009 20 0 BEADRP CC[C@@]1(C)CC[N@H+](C[C@@H]2CCCC[NH2+]C2)C1 ZINC000697036855 987346202 /nfs/dbraw/zinc/34/62/02/987346202.db2.gz MSSRCJHNDAUIHS-KGLIPLIRSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H]1CC[C@@H](C)[N@H+](C[C@H]2CCCC[NH2+]C2)C1 ZINC000697052753 987347205 /nfs/dbraw/zinc/34/72/05/987347205.db2.gz QJPMGXYWYNNUTE-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP CCC1CC[NH+](C[C@@H]2CCCC[NH2+]C2)CC1 ZINC000697053760 987348228 /nfs/dbraw/zinc/34/82/28/987348228.db2.gz XDNLUXITXGHCSJ-CQSZACIVSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@@H]2CCCC[NH2+]C2)[C@H](C)C1 ZINC000697053689 987348238 /nfs/dbraw/zinc/34/82/38/987348238.db2.gz WGLGVGUZTWEZDF-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP CC1(C)[C@@H]2C[C@@H]([NH2+]CC3([NH3+])CCCC3)C[C@@H]21 ZINC001246075056 987362678 /nfs/dbraw/zinc/36/26/78/987362678.db2.gz GXMKHANAMULJBL-CNDDSTCGSA-N 2 0 222.376 2.282 20 0 BEADRP CC[C@H](C)OCC[C@H](C)[NH2+]CC1([NH3+])CCCC1 ZINC001246074548 987365535 /nfs/dbraw/zinc/36/55/35/987365535.db2.gz DPZWAXPEQGGGCO-STQMWFEESA-N 2 0 242.407 2.441 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+]CCCCCCCC[NH3+])CN1 ZINC001246079531 987372708 /nfs/dbraw/zinc/37/27/08/987372708.db2.gz KPVSASALKWWMFN-UONOGXRCSA-N 2 0 241.423 2.016 20 0 BEADRP CCC[N@H+](CC1C[C@H]2CC[C@@H](C1)[NH2+]2)C1CC1 ZINC000699309618 987373116 /nfs/dbraw/zinc/37/31/16/987373116.db2.gz AEZLHQWMUUJYNZ-YHWZYXNKSA-N 2 0 222.376 2.391 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CC2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000699314187 987374221 /nfs/dbraw/zinc/37/42/21/987374221.db2.gz JDZGVEDESPXGLI-IUKMKKQMSA-N 2 0 222.376 2.295 20 0 BEADRP Cn1ccc2cc(C[NH2+]C3CC[NH2+]CC3)ccc21 ZINC001246083204 987379960 /nfs/dbraw/zinc/37/99/60/987379960.db2.gz GDFHRQKOWIORPP-UHFFFAOYSA-N 2 0 243.354 2.020 20 0 BEADRP Cn1ccc2cc(CN[C@H]3CCC[NH2+]C3)ccc21 ZINC001246084618 987380640 /nfs/dbraw/zinc/38/06/40/987380640.db2.gz KYVYJYYEJNQJSW-AWEZNQCLSA-N 2 0 243.354 2.020 20 0 BEADRP Cn1ccc2cc(CN[C@@H]3CCC[NH2+]C3)ccc21 ZINC001246084619 987382772 /nfs/dbraw/zinc/38/27/72/987382772.db2.gz KYVYJYYEJNQJSW-CQSZACIVSA-N 2 0 243.354 2.020 20 0 BEADRP [NH3+]Cc1ccc2c(ccn2C2CC[NH2+]CC2)c1 ZINC001246083801 987382924 /nfs/dbraw/zinc/38/29/24/987382924.db2.gz KCWYGGRVRFBDHV-UHFFFAOYSA-N 2 0 229.327 2.025 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCCC[C@@H]2C)C[NH2+]1 ZINC001246092594 987396473 /nfs/dbraw/zinc/39/64/73/987396473.db2.gz FBJKHLGYWMPOIM-RNJOBUHISA-N 2 0 210.365 2.153 20 0 BEADRP CCSC[C@H](C)[NH2+]C[C@@H]1CC[C@H](C)[NH2+]C1 ZINC001246091238 987398867 /nfs/dbraw/zinc/39/88/67/987398867.db2.gz HJOISSTTYCGNMM-SDDRHHMPSA-N 2 0 230.421 2.106 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@H]2CCCC[C@@H]2C)C[NH2+]1 ZINC001246092588 987399068 /nfs/dbraw/zinc/39/90/68/987399068.db2.gz FBJKHLGYWMPOIM-LOWDOPEQSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]C[C@H]2C[NH2+]C[C@@H](C)C2)C1 ZINC001246102098 987424943 /nfs/dbraw/zinc/42/49/43/987424943.db2.gz QZTDYYDAFKHJKH-RQJABVFESA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]C[C@H]1CC[C@@H](C)[NH2+]C1 ZINC001246103928 987427434 /nfs/dbraw/zinc/42/74/34/987427434.db2.gz ZAJLHCLLSODBII-MDZLAQPJSA-N 2 0 210.365 2.153 20 0 BEADRP CCSC[C@H](C)[NH2+]C[C@@H]1CCC[NH2+][C@H]1C ZINC001246110513 987444342 /nfs/dbraw/zinc/44/43/42/987444342.db2.gz MCIWCYISKJMUIW-SRVKXCTJSA-N 2 0 230.421 2.106 20 0 BEADRP C[C@H](CC1CC1)[NH2+]C[C@@H]1CC[C@@H](C)[NH2+]C1 ZINC001246103930 987430284 /nfs/dbraw/zinc/43/02/84/987430284.db2.gz ZAJLHCLLSODBII-NQBHXWOUSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@@H](C)C[C@@H](CC)[NH2+][C@H]1C[NH2+]C[C@@H]1C ZINC001246105682 987432699 /nfs/dbraw/zinc/43/26/99/987432699.db2.gz BZPHTLXVGIGPLH-XQHKEYJVSA-N 2 0 212.381 2.399 20 0 BEADRP CC(C)CCC[C@@H](C)[NH2+][C@@H]1C[NH2+]C[C@@H]1C ZINC001246115484 987456032 /nfs/dbraw/zinc/45/60/32/987456032.db2.gz IABXRPMSTQARBD-YNEHKIRRSA-N 2 0 212.381 2.399 20 0 BEADRP CC1CCC([NH2+]C[C@@H]2C[NH2+]CC[C@@H]2C)CC1 ZINC001246117253 987457526 /nfs/dbraw/zinc/45/75/26/987457526.db2.gz YPTWZPOORIRRSU-QPPOZKHWSA-N 2 0 224.392 2.400 20 0 BEADRP C1CC12CCC([NH2+][C@@H]1C[NH2+]CC13CC3)CC2 ZINC001246133406 987489636 /nfs/dbraw/zinc/48/96/36/987489636.db2.gz NUMVBNNELROZRA-GFCCVEGCSA-N 2 0 220.360 2.051 20 0 BEADRP C1C[C@H]([NH2+][C@H]2CCC3(C2)CC[NH2+]CC3)CS1 ZINC001246133796 987489749 /nfs/dbraw/zinc/48/97/49/987489749.db2.gz QSPDMMLEPBLNNF-RYUDHWBXSA-N 2 0 240.416 2.004 20 0 BEADRP CC1(C)CCC[C@@H]([NH2+][C@@H]2C[NH2+]CC23CC3)C1 ZINC001246136403 987495692 /nfs/dbraw/zinc/49/56/92/987495692.db2.gz WTSJIXYSZFDKFS-VXGBXAGGSA-N 2 0 222.376 2.297 20 0 BEADRP CCCC[C@@H](CCC)[NH2+][C@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001246142276 987498305 /nfs/dbraw/zinc/49/83/05/987498305.db2.gz BZUNSYDGWLAUQX-FVCCEPFGSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)CCC[C@H](C)[NH2+][C@H]1[C@@H]2C[C@H]1C[NH2+]C2 ZINC001246145790 987502670 /nfs/dbraw/zinc/50/26/70/987502670.db2.gz DYSQMZKCTMJWLT-IGQOVBAYSA-N 2 0 224.392 2.399 20 0 BEADRP CC(C)C[C@@H](C)C[C@H](C)[NH2+][C@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001246150680 987506139 /nfs/dbraw/zinc/50/61/39/987506139.db2.gz XLPXBTNZQBOPPA-XHJNMGKDSA-N 2 0 224.392 2.255 20 0 BEADRP CC(C)C[C@@H](C)C[C@@H](C)[NH2+][C@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001246150679 987507852 /nfs/dbraw/zinc/50/78/52/987507852.db2.gz XLPXBTNZQBOPPA-XGFWRYKXSA-N 2 0 224.392 2.255 20 0 BEADRP CC(C)C1CCC([NH2+]C[C@]2(F)CC[NH2+]C2)CC1 ZINC001246150064 987508311 /nfs/dbraw/zinc/50/83/11/987508311.db2.gz VFPLRWUCLOBWDG-RUXDESIVSA-N 2 0 242.382 2.492 20 0 BEADRP CCC1CCC([NH2+][C@H]2C[NH2+][C@@H](C)C2)CC1 ZINC001246174037 987536711 /nfs/dbraw/zinc/53/67/11/987536711.db2.gz WDGWBOFLIVYSAX-YWPUVAFDSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CC2(F)CCCCC2)CC[NH2+]1 ZINC001246176207 987544742 /nfs/dbraw/zinc/54/47/42/987544742.db2.gz MKHXBHHLELAXIH-NWDGAFQWSA-N 2 0 228.355 2.389 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[NH2+][C@H](C)C1)c1cccc(N)c1 ZINC001246175242 987545700 /nfs/dbraw/zinc/54/57/00/987545700.db2.gz JECYUTRPXLBECJ-GYSYKLTISA-N 2 0 233.359 2.060 20 0 BEADRP Cc1ccc2c(c1)C[C@@H]([NH2+]C[C@@H]1CCC[NH2+]1)CC2 ZINC001246187591 987564276 /nfs/dbraw/zinc/56/42/76/987564276.db2.gz CLIXUDFKXBMVTF-HOTGVXAUSA-N 2 0 244.382 2.194 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)c1ccc(O)cc1 ZINC001246205130 987600626 /nfs/dbraw/zinc/60/06/26/987600626.db2.gz RQCCQHWSPPBTIQ-NTZNESFSSA-N 2 0 234.343 2.183 20 0 BEADRP C[C@@H]1CC([NH2+]C[C@H]2CCC[NH2+]C2)C[C@@H](C)C1 ZINC001246216881 987613329 /nfs/dbraw/zinc/61/33/29/987613329.db2.gz TZUOZLUVYYDJNY-AVGNSLFASA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H]1CC[C@H](NCc2ccc3[nH]ccc3c2)C[NH2+]1 ZINC001246228972 987626044 /nfs/dbraw/zinc/62/60/44/987626044.db2.gz IZVNAZQQSJNWTQ-FZMZJTMJSA-N 2 0 243.354 2.398 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CC[C@@H]3CCC[C@@H]32)CC[NH2+]1 ZINC001246232773 987628827 /nfs/dbraw/zinc/62/88/27/987628827.db2.gz ZRSXQOGTKRSLIJ-BJJPWKGXSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CCCCc2ccccn2)CC[NH2+]1 ZINC001246237242 987635760 /nfs/dbraw/zinc/63/57/60/987635760.db2.gz HEMOWHIGAUBTBO-ZFWWWQNUSA-N 2 0 247.386 2.134 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]Cc2c[nH]c3ccccc23)CC[NH2+]1 ZINC001246238270 987638411 /nfs/dbraw/zinc/63/84/11/987638411.db2.gz FPVIWBYERNKEEG-DGCLKSJQSA-N 2 0 243.354 2.398 20 0 BEADRP Cc1ccnc(CCC[NH2+][C@H]2CC[NH2+][C@@H](C)C2)c1 ZINC001246241429 987643434 /nfs/dbraw/zinc/64/34/34/987643434.db2.gz RCACJZGTGMXVLC-ZFWWWQNUSA-N 2 0 247.386 2.053 20 0 BEADRP Cc1ccc2c(c1)C[C@H]([NH2+]CC(C)(C)C[NH3+])CC2 ZINC001246242285 987646079 /nfs/dbraw/zinc/64/60/79/987646079.db2.gz CQOOJSZQFADRIL-OAHLLOKOSA-N 2 0 246.398 2.427 20 0 BEADRP C[C@@H]1C[C@@H](N2CC[C@@H]([NH3+])c3ccccc32)CC[NH2+]1 ZINC001246259600 987655428 /nfs/dbraw/zinc/65/54/28/987655428.db2.gz BERRZBUYIRMPQK-MBNYWOFBSA-N 2 0 245.370 2.037 20 0 BEADRP Fc1ccc([C@@H]2C[C@H]2[NH2+]C2CC[NH2+]CC2)cc1 ZINC001246278979 987671665 /nfs/dbraw/zinc/67/16/65/987671665.db2.gz CPQCVYPKYPPUIW-UONOGXRCSA-N 2 0 234.318 2.023 20 0 BEADRP Fc1ccc([C@@H]2C[C@@H]2[NH2+]C2CC[NH2+]CC2)cc1 ZINC001246278977 987672599 /nfs/dbraw/zinc/67/25/99/987672599.db2.gz CPQCVYPKYPPUIW-KBPBESRZSA-N 2 0 234.318 2.023 20 0 BEADRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc(N)cc1 ZINC001246282796 987675417 /nfs/dbraw/zinc/67/54/17/987675417.db2.gz CVOHVWZCBKVIRO-ZEIJEMSESA-N 2 0 245.370 2.202 20 0 BEADRP CC1(C)CCC[C@H]1[NH2+][C@H]1CCCC[NH2+]C1 ZINC001246283457 987678805 /nfs/dbraw/zinc/67/88/05/987678805.db2.gz CEIQGIYYLZREBG-NWDGAFQWSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2C[C@@H]2c2ccc(F)cc2)CC[NH2+]1 ZINC001246283666 987679268 /nfs/dbraw/zinc/67/92/68/987679268.db2.gz XENXYSUKPLCSPY-QZKOUSHUSA-N 2 0 248.345 2.412 20 0 BEADRP CCC[C@H](C)CC[C@@H](C)[NH2+]CCN(C)CC[NH3+] ZINC001246284724 987679525 /nfs/dbraw/zinc/67/95/25/987679525.db2.gz OEIBQLBXCRPIFY-UONOGXRCSA-N 2 0 243.439 2.071 20 0 BEADRP CCC[C@H](C)CC[C@H](C)[NH2+]CCN(C)CC[NH3+] ZINC001246284512 987679732 /nfs/dbraw/zinc/67/97/32/987679732.db2.gz OEIBQLBXCRPIFY-KBPBESRZSA-N 2 0 243.439 2.071 20 0 BEADRP CC[NH+](CC)C1CC[NH+](C[C@@H]2C[C@@H]2C)CC1 ZINC001116758681 987697296 /nfs/dbraw/zinc/69/72/96/987697296.db2.gz YYDJJEUGVLXKNQ-STQMWFEESA-N 2 0 224.392 2.449 20 0 BEADRP CC[C@@H]([NH3+])CCN[C@H]1C[C@@H](CC)[NH2+][C@@H](CC)C1 ZINC001246303944 987699844 /nfs/dbraw/zinc/69/98/44/987699844.db2.gz BMKGONXEVGHFFZ-MQYQWHSLSA-N 2 0 241.423 2.013 20 0 BEADRP CC[C@H]([NH3+])CCN[C@@H]1C[C@@H](CC)[NH2+][C@@H](CC)C1 ZINC001246303942 987701204 /nfs/dbraw/zinc/70/12/04/987701204.db2.gz BMKGONXEVGHFFZ-FQUUOJAGSA-N 2 0 241.423 2.013 20 0 BEADRP [NH3+]CCc1ccc2c(ccn2[C@H]2CCC[NH2+]C2)c1 ZINC001246310814 987711737 /nfs/dbraw/zinc/71/17/37/987711737.db2.gz QZQCCPUYTYVBNE-AWEZNQCLSA-N 2 0 243.354 2.067 20 0 BEADRP Cc1ccc(C[C@H](C)[NH2+]C[C@@H]([NH3+])C(C)C)cc1 ZINC001246333503 987741069 /nfs/dbraw/zinc/74/10/69/987741069.db2.gz RABNKXOZUHFBTK-DZGCQCFKSA-N 2 0 234.387 2.499 20 0 BEADRP [NH3+][C@@]12CC[C@@]([NH2+]C3CCSCC3)(C1)CCC2 ZINC001246338888 987749191 /nfs/dbraw/zinc/74/91/91/987749191.db2.gz HEFBWPIFTDDZJZ-QWHCGFSZSA-N 2 0 240.416 2.276 20 0 BEADRP [NH3+][C@@]12CC[C@@]([NH2+][C@@H]3C[C@H]4C[C@H]4C3)(C1)CCC2 ZINC001246342317 987753618 /nfs/dbraw/zinc/75/36/18/987753618.db2.gz SJUCLJJQHDXMKJ-ZUWCUPBKSA-N 2 0 220.360 2.179 20 0 BEADRP CC[NH+]1CCC(C[NH2+]CCC(C)(F)F)CC1 ZINC001474549102 987755849 /nfs/dbraw/zinc/75/58/49/987755849.db2.gz HDTHKISOFZHKNH-UHFFFAOYSA-N 2 0 234.334 2.353 20 0 BEADRP C[NH2+]CC[C@@H](C)[NH2+]CCc1c[nH]c2ccccc12 ZINC001246345653 987757222 /nfs/dbraw/zinc/75/72/22/987757222.db2.gz JSRZBYKTJCVFAQ-GFCCVEGCSA-N 2 0 245.370 2.298 20 0 BEADRP Fc1cccc(CC2([NH2+]C3CC[NH2+]CC3)CC2)c1 ZINC001246384254 987779349 /nfs/dbraw/zinc/77/93/49/987779349.db2.gz BMIVJQPJOVHLQF-UHFFFAOYSA-N 2 0 248.345 2.242 20 0 BEADRP CCCC1([NH2+][C@H]2CC[NH2+][C@H](C)C2)CCC1 ZINC001246390651 987779683 /nfs/dbraw/zinc/77/96/83/987779683.db2.gz YJWHDOPHOYMPIW-NEPJUHHUSA-N 2 0 210.365 2.439 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CC2(CC3CC3)CC2)CC[NH2+]1 ZINC001246430955 987794306 /nfs/dbraw/zinc/79/43/06/987794306.db2.gz HQZOBZJCZUKCEB-AAEUAGOBSA-N 2 0 222.376 2.297 20 0 BEADRP CC1(C)CC[C@H](C[NH2+]C2CC[NH2+]CC2)C1 ZINC001246438442 987799163 /nfs/dbraw/zinc/79/91/63/987799163.db2.gz XYPYXKQMOJFIGQ-NSHDSACASA-N 2 0 210.365 2.154 20 0 BEADRP CC(C)CCC[C@@H](C)[NH2+][C@H]1CC12C[NH2+]C2 ZINC001246445424 987802225 /nfs/dbraw/zinc/80/22/25/987802225.db2.gz OCMBLVKOBNMREV-NEPJUHHUSA-N 2 0 210.365 2.153 20 0 BEADRP c1ccc([C@@H]2CC[C@H]([NH2+][C@H]3CC34C[NH2+]C4)C2)cc1 ZINC001246446350 987805803 /nfs/dbraw/zinc/80/58/03/987805803.db2.gz RLGCVHFCUILFBC-ILXRZTDVSA-N 2 0 242.366 2.274 20 0 BEADRP CC(C)=CCC[C@H](C)[NH2+]CCCNCCC[NH3+] ZINC001246452734 987808877 /nfs/dbraw/zinc/80/88/77/987808877.db2.gz LZEPOUBXMOBZJG-AWEZNQCLSA-N 2 0 241.423 2.039 20 0 BEADRP CCCC(CCC)[NH2+]CCC[NH2+]CCCC[NH3+] ZINC001246455398 987812295 /nfs/dbraw/zinc/81/22/95/987812295.db2.gz DYJUPAASTJMDJV-UHFFFAOYSA-N 3 0 243.439 2.263 20 0 BEADRP CC[C@@H](CC(C)C)[NH2+]C[C@@H]1CC[NH2+]C[C@@H]1F ZINC001246478107 987834682 /nfs/dbraw/zinc/83/46/82/987834682.db2.gz SGDUWYSAQOEESE-AVGNSLFASA-N 2 0 230.371 2.348 20 0 BEADRP CCC[C@H](CC)[NH2+]C[C@@H]1CC[NH2+]C[C@@H]1F ZINC001246477840 987834740 /nfs/dbraw/zinc/83/47/40/987834740.db2.gz QUFYUBXACWUXCI-SRVKXCTJSA-N 2 0 216.344 2.102 20 0 BEADRP c1cc2c(s1)CC[C@@H]2[NH2+]C1CC[NH2+]CC1 ZINC001246477087 987835954 /nfs/dbraw/zinc/83/59/54/987835954.db2.gz ZRYCJLZHNYBCLV-NSHDSACASA-N 2 0 222.357 2.077 20 0 BEADRP CC[C@@H]1CC[C@@H]([NH2+]C[C@@H]2CC[NH2+]C[C@@H]2F)C1 ZINC001246478962 987837202 /nfs/dbraw/zinc/83/72/02/987837202.db2.gz ZUGITFQXVUXFOI-XQHKEYJVSA-N 2 0 228.355 2.102 20 0 BEADRP C[C@H]1CC[C@H](C)C1[NH2+][C@@H]1CC[NH2+][C@H](C)C1 ZINC001246493608 987846613 /nfs/dbraw/zinc/84/66/13/987846613.db2.gz ILPDFIFQCOYMSG-NNYUYHANSA-N 2 0 210.365 2.151 20 0 BEADRP CCCC(C[NH3+])(CCC)N[C@H]1CC[NH2+][C@H](C)C1 ZINC001246494049 987847513 /nfs/dbraw/zinc/84/75/13/987847513.db2.gz CTWBEPNOSCACRN-OLZOCXBDSA-N 2 0 241.423 2.014 20 0 BEADRP C[C@@H]1CC[C@@H](C)C1[NH2+][C@H]1CCCC[NH2+]C1 ZINC001246493388 987848441 /nfs/dbraw/zinc/84/84/41/987848441.db2.gz GOVMAEDMWJGYGY-UTUOFQBUSA-N 2 0 210.365 2.153 20 0 BEADRP CCCC(C[NH3+])(CCC)N[C@H]1CC[C@@H](C)[NH2+]C1 ZINC001246498768 987852691 /nfs/dbraw/zinc/85/26/91/987852691.db2.gz XOUHKXUOCHXUIF-OLZOCXBDSA-N 2 0 241.423 2.014 20 0 BEADRP CC[C@@H](C)C[C@@H](CC)[NH2+]C12CC([NH3+])(C1)C2 ZINC001246506490 987859192 /nfs/dbraw/zinc/85/91/92/987859192.db2.gz WFOVEZBQPWHGSE-OKZRHMCRSA-N 2 0 210.365 2.425 20 0 BEADRP CC[C@H](C[C@@H](C)CC)[NH2+]C12CC([NH3+])(C1)C2 ZINC001246506492 987859348 /nfs/dbraw/zinc/85/93/48/987859348.db2.gz WFOVEZBQPWHGSE-ZFDZMSFRSA-N 2 0 210.365 2.425 20 0 BEADRP CSC(C)(C)C[C@H](C)[N@@H+]1CC[C@@](C)([NH3+])C1 ZINC001246529491 987886731 /nfs/dbraw/zinc/88/67/31/987886731.db2.gz KNLMRLOLNYUUDW-CMPLNLGQSA-N 2 0 230.421 2.330 20 0 BEADRP CCCC[C@@H](CCC)[N@@H+]1CCO[C@@H](CC[NH3+])C1 ZINC001246536317 987893915 /nfs/dbraw/zinc/89/39/15/987893915.db2.gz ULRNRQAORQYOND-KGLIPLIRSA-N 2 0 242.407 2.395 20 0 BEADRP CC(C)OCC[C@H](C)[N@@H+]1CCC[C@@H]([NH3+])CC1 ZINC001246538413 987899078 /nfs/dbraw/zinc/89/90/78/987899078.db2.gz BVMVTEZYKXIRQR-QWHCGFSZSA-N 2 0 228.380 2.003 20 0 BEADRP CC[C@@H]1CC[C@H]([N@@H+]2CCC[C@@H]([NH3+])CC2)C1 ZINC001246539263 987906371 /nfs/dbraw/zinc/90/63/71/987906371.db2.gz GPBUZHPAQFDDKA-UPJWGTAASA-N 2 0 210.365 2.378 20 0 BEADRP CC(C)COCC[C@H](C)[N@@H+]1CCC[C@@H]([NH3+])CC1 ZINC001246541813 987912394 /nfs/dbraw/zinc/91/23/94/987912394.db2.gz NSEKRSUTZPXJSL-UONOGXRCSA-N 2 0 242.407 2.251 20 0 BEADRP Cc1ccc2c(c1)C[N@H+]([C@H]1CC[NH2+][C@@H](C)C1)CC2 ZINC001246547679 987929420 /nfs/dbraw/zinc/92/94/20/987929420.db2.gz MCZSYUFUBHUXES-BBRMVZONSA-N 2 0 244.382 2.494 20 0 BEADRP C[C@@H](Cc1cccnc1)[N@@H+]1CCC[C@@](C)([NH3+])CC1 ZINC001246548062 987938505 /nfs/dbraw/zinc/93/85/05/987938505.db2.gz FIIQWBBCFLKCNA-DZGCQCFKSA-N 2 0 247.386 2.216 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]Cc1ccc(C)c(OC)c1 ZINC001117953146 987968921 /nfs/dbraw/zinc/96/89/21/987968921.db2.gz BCISPYFSXXSSRY-LBPRGKRZSA-N 2 0 236.359 2.091 20 0 BEADRP CCOCC[C@H](C)[N@@H+]1CCC[C@@H](C[NH3+])[C@@H](C)C1 ZINC001246559226 987980643 /nfs/dbraw/zinc/98/06/43/987980643.db2.gz CLPGVGUHFFONKT-IHRRRGAJSA-N 2 0 242.407 2.108 20 0 BEADRP C[C@@H]1CC[C@@H]([N@@H+]2CCC(F)(F)[C@@H](C[NH3+])C2)C1 ZINC001246559833 987984039 /nfs/dbraw/zinc/98/40/39/987984039.db2.gz TZIRKJMWUMGSHA-OUAUKWLOSA-N 2 0 232.318 2.091 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@H](C)CCC(F)(F)F ZINC001118057448 987995844 /nfs/dbraw/zinc/99/58/44/987995844.db2.gz QVJOGXRAZMXNLL-DTWKUNHWSA-N 2 0 226.286 2.305 20 0 BEADRP CCC(CC)[N@@H+]1CC[C@@H](C)[C@@H](C[NH3+])CC1 ZINC001246561930 987997621 /nfs/dbraw/zinc/99/76/21/987997621.db2.gz USYNDFFNBYPQKT-VXGBXAGGSA-N 2 0 212.381 2.482 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2CCC(F)(F)[C@H](C)C2)CC[NH2+]1 ZINC001246562938 988006482 /nfs/dbraw/zinc/00/64/82/988006482.db2.gz IKNHWNOWWILWQV-GMTAPVOTSA-N 2 0 232.318 2.104 20 0 BEADRP C[C@@H]1CC[N@@H+]([C@@H]2CCCSC2)CC[C@@H]1C[NH3+] ZINC001246564769 988022066 /nfs/dbraw/zinc/02/20/66/988022066.db2.gz ZVISTNWUKMFYAQ-JHJVBQTASA-N 2 0 242.432 2.189 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H](C)c1ccc(F)cc1 ZINC001118121978 988026268 /nfs/dbraw/zinc/02/62/68/988026268.db2.gz MBHOKJJILFOKEZ-GHMZBOCLSA-N 2 0 224.323 2.474 20 0 BEADRP C[C@@H]1C[N@@H+]([C@H]2C[C@H]3C[C@H]3C2)CCC[C@H]1C[NH3+] ZINC001246571760 988060515 /nfs/dbraw/zinc/06/05/15/988060515.db2.gz WYZLHAYFWBAYGA-BJJPWKGXSA-N 2 0 222.376 2.092 20 0 BEADRP C[C@]1(C[NH3+])CCC[N@@H+]([C@@H]2CCCOCC2)CC1 ZINC001246574616 988070246 /nfs/dbraw/zinc/07/02/46/988070246.db2.gz IIBSCVFZIZNWKB-KGLIPLIRSA-N 2 0 240.391 2.006 20 0 BEADRP CCCCCC[C@@H](CC)[N@@H+]1CC[C@@H]([NH3+])[C@H](O)C1 ZINC001246573693 988075500 /nfs/dbraw/zinc/07/55/00/988075500.db2.gz ZBXNORFYAXWRAS-MGPQQGTHSA-N 2 0 242.407 2.129 20 0 BEADRP C[C@@]1(C[NH3+])CCC[N@@H+](C2CCCC2)CC1 ZINC001246580664 988108333 /nfs/dbraw/zinc/10/83/33/988108333.db2.gz XOLCNYMXUPWAMY-CYBMUJFWSA-N 2 0 210.365 2.380 20 0 BEADRP CC[C@H](C[C@@H](C)CC)[NH+]1CC(C[NH2+]C)C1 ZINC001246593128 988178122 /nfs/dbraw/zinc/17/81/22/988178122.db2.gz AGEVLKBEWZHKMB-WCQYABFASA-N 2 0 212.381 2.352 20 0 BEADRP CC[C@H](C[C@@H](C)CC)[NH+]1CC(C)(C[NH3+])C1 ZINC001246602426 988215968 /nfs/dbraw/zinc/21/59/68/988215968.db2.gz XIKVOOBDSNPDFT-NWDGAFQWSA-N 2 0 212.381 2.482 20 0 BEADRP C1CCC2(C1)CCC[N@@H+](C1CC[NH2+]CC1)C2 ZINC001246613022 988244792 /nfs/dbraw/zinc/24/47/92/988244792.db2.gz KFYGFIKBASBVCA-UHFFFAOYSA-N 2 0 222.376 2.395 20 0 BEADRP CCCC[C@@H](CCC)[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC001246624468 988284739 /nfs/dbraw/zinc/28/47/39/988284739.db2.gz NGDMWGNDPJPUAK-HZSPNIEDSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H](C)C[C@@H](CC)[N@@H+]1CCC2(C[NH2+]C2)C1 ZINC001246631532 988309676 /nfs/dbraw/zinc/30/96/76/988309676.db2.gz QHWNROSGGDKQJX-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H](CC(C)C)[N@@H+]1CC[C@]2(CC[NH2+]C2)C1 ZINC001246631781 988315737 /nfs/dbraw/zinc/31/57/37/988315737.db2.gz SIOPDWHSQXIUHE-KBPBESRZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1C[C@H]([N@@H+]2CC[C@H]3C[NH2+]C[C@H]32)C[C@@H](C)C1 ZINC001246634312 988320903 /nfs/dbraw/zinc/32/09/03/988320903.db2.gz BOUUIINJSAJAFI-MEBFFEOJSA-N 2 0 222.376 2.105 20 0 BEADRP C[C@@H]1CCC[C@@H]([N@@H+]2CC[C@H]3[NH2+]CC[C@H]32)C1 ZINC001246636224 988325101 /nfs/dbraw/zinc/32/51/01/988325101.db2.gz FQPZPGIEUVFHPP-FDYHWXHSSA-N 2 0 208.349 2.001 20 0 BEADRP CCCC(CCC)[N@@H+]1CC[C@@H]2[NH2+]CC[C@H]21 ZINC001246636652 988327256 /nfs/dbraw/zinc/32/72/56/988327256.db2.gz VVEXXWCRNHSJGL-QWHCGFSZSA-N 2 0 210.365 2.391 20 0 BEADRP C[C@@H]1CCC[C@H]([N@@H+]2CC[C@H]3[NH2+]CC[C@H]32)C1 ZINC001246636231 988330843 /nfs/dbraw/zinc/33/08/43/988330843.db2.gz FQPZPGIEUVFHPP-YVECIDJPSA-N 2 0 208.349 2.001 20 0 BEADRP C1C[C@@H]2[C@@H](CC[N@@H+]2C2CCCCCC2)[NH2+]1 ZINC001246642134 988347490 /nfs/dbraw/zinc/34/74/90/988347490.db2.gz ZIWUCUXKKPQASX-CHWSQXEVSA-N 2 0 208.349 2.145 20 0 BEADRP C[C@H]1CC([N@@H+]2CC[C@@H]3C[NH2+]C[C@H]3C2)C[C@H](C)C1 ZINC001246647252 988365256 /nfs/dbraw/zinc/36/52/56/988365256.db2.gz JKXBESTWCJFNSE-SYQHCUMBSA-N 2 0 236.403 2.352 20 0 BEADRP CCCCC[C@@H](C)[N@@H+]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC001246647714 988373028 /nfs/dbraw/zinc/37/30/28/988373028.db2.gz MQOOBFZIGQGXCY-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP CCCC[C@@H](CC)[N@@H+]1C[C@@H]2CC[NH2+][C@@H]2C1 ZINC001246654929 988379226 /nfs/dbraw/zinc/37/92/26/988379226.db2.gz XRPPFQXSFHRTQZ-YNEHKIRRSA-N 2 0 210.365 2.249 20 0 BEADRP CCCCC[C@@H](CC)[N@H+]1C[C@@H]2[C@@H]([NH3+])[C@@H]2C1 ZINC001246653891 988380357 /nfs/dbraw/zinc/38/03/57/988380357.db2.gz BMGXNDCTDAUABS-NDBYEHHHSA-N 2 0 210.365 2.234 20 0 BEADRP C[C@H]1C[C@H]([N@H+]2C[C@@H]3[C@H]([NH3+])[C@@H]3C2)CC(C)(C)C1 ZINC001246659785 988390516 /nfs/dbraw/zinc/39/05/16/988390516.db2.gz HENGGZJFUBQPRD-NWBUJAPZSA-N 2 0 222.376 2.090 20 0 BEADRP C[C@H]1C[C@@H]([N@H+]2C[C@@H]3[C@H]([NH3+])[C@@H]3C2)CC(C)(C)C1 ZINC001246659786 988391473 /nfs/dbraw/zinc/39/14/73/988391473.db2.gz HENGGZJFUBQPRD-OFTGVCEQSA-N 2 0 222.376 2.090 20 0 BEADRP CC1(C)CC[C@@H]([N@@H+]2C[C@H]3CCC[C@@]3([NH3+])C2)C1 ZINC001246662565 988397754 /nfs/dbraw/zinc/39/77/54/988397754.db2.gz IHPBRGJPUSIKKM-YRGRVCCFSA-N 2 0 222.376 2.378 20 0 BEADRP CCCC[C@H](CCC)[N@H+]1C[C@@H]2[C@@H]([NH3+])[C@@H]2C1 ZINC001246661464 988400330 /nfs/dbraw/zinc/40/03/30/988400330.db2.gz XRVVYGXYMYXATN-WUHRBBMRSA-N 2 0 210.365 2.234 20 0 BEADRP CCCC[C@@H](CCC)[N@H+]1C[C@@H]2[C@H]([NH3+])[C@@H]2C1 ZINC001246667071 988409576 /nfs/dbraw/zinc/40/95/76/988409576.db2.gz XRVVYGXYMYXATN-FVCCEPFGSA-N 2 0 210.365 2.234 20 0 BEADRP CCc1ccc(C[C@@H](C)[N@H+](C)CCC[NH3+])cc1 ZINC001246681804 988428596 /nfs/dbraw/zinc/42/85/96/988428596.db2.gz QSLLRKVCQKFKDA-CYBMUJFWSA-N 2 0 234.387 2.461 20 0 BEADRP C[C@@H]1C[C@H]([N@H+](C)CCOc2ccccc2)CC[NH2+]1 ZINC001246782724 988464467 /nfs/dbraw/zinc/46/44/67/988464467.db2.gz ULLLNXWVVYVOSL-ZIAGYGMSSA-N 2 0 248.370 2.138 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2CCCC3(C[NH2+]C3)C2)C[C@H]1C ZINC001246792230 988468332 /nfs/dbraw/zinc/46/83/32/988468332.db2.gz ORBVMOXMLUWNIW-MCIONIFRSA-N 2 0 236.403 2.497 20 0 BEADRP FC1(F)C[C@]12CC[N@@H+](C1C[C@H]3CC[C@@H](C1)[NH2+]3)C2 ZINC001246804722 988485540 /nfs/dbraw/zinc/48/55/40/988485540.db2.gz BPLFEVOMMVCCQM-MBYGNEARSA-N 2 0 242.313 2.001 20 0 BEADRP C[NH2+]CC[C@H](C)[N@H+](C)CCc1cccc(C)c1 ZINC001246815009 988494555 /nfs/dbraw/zinc/49/45/55/988494555.db2.gz UFVFFOUVJDCNQL-AWEZNQCLSA-N 2 0 234.387 2.467 20 0 BEADRP CCCCCC[C@H](CCC)N(CC[NH3+])CC[NH3+] ZINC001246828717 988521958 /nfs/dbraw/zinc/52/19/58/988521958.db2.gz CGZXXTRPWLIHHJ-AWEZNQCLSA-N 2 0 243.439 2.345 20 0 BEADRP CCC(CC)[N@H+](CC)[C@H](C)CC[NH2+]C ZINC001246838698 988524336 /nfs/dbraw/zinc/52/43/36/988524336.db2.gz DWTLEVBHJHPXBG-LLVKDONJSA-N 2 0 200.370 2.495 20 0 BEADRP CCCC[C@H](CC)[N@@H+]1C[C@H]2CC[NH2+]C[C@H]2C1 ZINC001246842545 988546241 /nfs/dbraw/zinc/54/62/41/988546241.db2.gz CIJQFELMXXOATR-RDBSUJKOSA-N 2 0 224.392 2.497 20 0 BEADRP CCCC(CCC)[N@@H+]1C[C@@H]2CC[NH2+]C[C@H]2C1 ZINC001246846430 988553035 /nfs/dbraw/zinc/55/30/35/988553035.db2.gz NPDAZVZRNKDCEM-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP COc1ccc([C@@H](C)[N@H+](C)C2CC[NH2+]CC2)cc1 ZINC001246853017 988569376 /nfs/dbraw/zinc/56/93/76/988569376.db2.gz QJYIVPBYMZLEPC-GFCCVEGCSA-N 2 0 248.370 2.440 20 0 BEADRP C[C@H]1C[C@H]([N@@H+]2C[C@@H]3CC[C@@]3([NH3+])C2)C[C@@H](C)C1 ZINC001246852228 988570330 /nfs/dbraw/zinc/57/03/30/988570330.db2.gz ICDFBZXQVJUZAV-MEBFFEOJSA-N 2 0 222.376 2.234 20 0 BEADRP Cc1ccc(C[C@H](C)[N@@H+]2C[C@H]3CC[C@@]3([NH3+])C2)cc1 ZINC001246858706 988594463 /nfs/dbraw/zinc/59/44/63/988594463.db2.gz HYAVMZRXHBILKG-NUEKZKHPSA-N 2 0 244.382 2.349 20 0 BEADRP Cc1ccc([C@@H]2CCC[N@@H+]2C2CC[NH2+]CC2)cn1 ZINC001246862665 988602401 /nfs/dbraw/zinc/60/24/01/988602401.db2.gz MLEPOGRKNVRYDT-HNNXBMFYSA-N 2 0 245.370 2.279 20 0 BEADRP C[C@H]1C[C@@H](N2CCc3c(F)cccc3C2)CC[NH2+]1 ZINC001246863553 988607080 /nfs/dbraw/zinc/60/70/80/988607080.db2.gz QPRLIPPBQSKXJZ-AAEUAGOBSA-N 2 0 248.345 2.324 20 0 BEADRP CCCC[C@H](CC)[N@@H+]1C[C@@H]2CC[C@]2([NH3+])C1 ZINC001246863971 988614216 /nfs/dbraw/zinc/61/42/16/988614216.db2.gz STXCJZAOWKDXBZ-AVGNSLFASA-N 2 0 210.365 2.378 20 0 BEADRP [NH3+][C@@]12CC[C@H]1C[N@@H+](C1CCCCCC1)C2 ZINC001246862767 988615673 /nfs/dbraw/zinc/61/56/73/988615673.db2.gz RHYPIDMGCSDFNF-WCQYABFASA-N 2 0 208.349 2.132 20 0 BEADRP C[C@@H]1CC([N@@H+]2C[C@H]3CC[C@@H](C2)[NH2+]C3)C[C@@H](C)C1 ZINC001246867371 988619401 /nfs/dbraw/zinc/61/94/01/988619401.db2.gz OEVQJGQZKMAOAK-XUXIUFHCSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@H]1C[C@@H]([N@@H+]2CCC[C@@H]2c2ccccn2)CC[NH2+]1 ZINC001246884318 988649805 /nfs/dbraw/zinc/64/98/05/988649805.db2.gz AIIFANYEGHNOCQ-KCQAQPDRSA-N 2 0 245.370 2.359 20 0 BEADRP CC[C@H](C[C@@H](C)CC)[N@H+](C)[C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001246949545 988789010 /nfs/dbraw/zinc/78/90/10/988789010.db2.gz UBIVQKGRMBUJER-MEBFFEOJSA-N 2 0 224.392 2.351 20 0 BEADRP CO[C@@H]1C[N@@H+]([C@H](C)C[C@@H](C)CC(C)C)C[C@@H]1N ZINC001246983887 988813679 /nfs/dbraw/zinc/81/36/79/988813679.db2.gz VTJDXDOLENTBCH-RFQIPJPRSA-N 2 0 242.407 2.105 20 0 BEADRP CC1(C)[C@@H]2C[C@@H](N3CC[C@@H]4[NH2+]CCC[C@@H]4C3)C[C@@H]21 ZINC001247016734 988845308 /nfs/dbraw/zinc/84/53/08/988845308.db2.gz XNSNGCQBUWHFIX-ZSAUSMIDSA-N 2 0 248.414 2.495 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C/C=C/C2CC2)[C@@H]2CCC[C@@H]21 ZINC001324969394 989040192 /nfs/dbraw/zinc/04/01/92/989040192.db2.gz RAXSORIWVBRDJR-OJTLBJGBSA-N 2 0 234.387 2.415 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]C[C@@H](C)CC(C)C ZINC001325267217 989137558 /nfs/dbraw/zinc/13/75/58/989137558.db2.gz KHAAIIFBUXMTCU-RYUDHWBXSA-N 2 0 200.370 2.256 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]C1CCC(CSC)CC1 ZINC001325720707 989240062 /nfs/dbraw/zinc/24/00/62/989240062.db2.gz GIFYKQDVLRNWBX-PNESKVBLSA-N 2 0 244.448 2.496 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H]1CCC[C@H](C)[C@H]1C ZINC001325741763 989242134 /nfs/dbraw/zinc/24/21/34/989242134.db2.gz MLHCKWDZUWVDSP-UMSGYPCISA-N 2 0 212.381 2.399 20 0 BEADRP CC[C@H]([NH2+]CC[C@H](C)[NH2+]C)c1ccncc1 ZINC001325723353 989242796 /nfs/dbraw/zinc/24/27/96/989242796.db2.gz RGPBKMFTAKDAJT-AAEUAGOBSA-N 2 0 221.348 2.120 20 0 BEADRP CCC1(CC)[C@H]([NH2+]CC[C@H](C)[NH2+]C)C[C@H]1OC ZINC001326037033 989335477 /nfs/dbraw/zinc/33/54/77/989335477.db2.gz UPRDWGANCDBBQT-YNEHKIRRSA-N 2 0 242.407 2.168 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]C/C=C/C1CC1 ZINC001326036393 989338980 /nfs/dbraw/zinc/33/89/80/989338980.db2.gz QKTGMJYVULWBSQ-PGLGOXFNSA-N 2 0 245.370 2.466 20 0 BEADRP COc1cc(C[NH2+][C@@H](C)C[C@H](C)[NH3+])ccc1F ZINC001326200788 989418398 /nfs/dbraw/zinc/41/83/98/989418398.db2.gz CZQKECVNQQMZOZ-UWVGGRQHSA-N 2 0 240.322 2.050 20 0 BEADRP COc1cc(C[NH2+][C@H](C)C[C@H](C)[NH3+])ccc1F ZINC001326200789 989421362 /nfs/dbraw/zinc/42/13/62/989421362.db2.gz CZQKECVNQQMZOZ-VHSXEESVSA-N 2 0 240.322 2.050 20 0 BEADRP C[NH+]1CCC(C[NH2+]CC23CCC(CC2)C3)CC1 ZINC001119952699 989499454 /nfs/dbraw/zinc/49/94/54/989499454.db2.gz CGPQSAURQHOKDW-UHFFFAOYSA-N 2 0 236.403 2.498 20 0 BEADRP C[C@H]([NH2+]Cc1cccc(C(F)F)c1)C1C[NH2+]C1 ZINC001326472845 989574462 /nfs/dbraw/zinc/57/44/62/989574462.db2.gz DWFNNNXLMXONJP-VIFPVBQESA-N 2 0 240.297 2.322 20 0 BEADRP CSCC[C@H](C)[N@@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC001258226766 991156389 /nfs/dbraw/zinc/15/63/89/991156389.db2.gz RHHBGBGAQLLMOE-STQMWFEESA-N 2 0 242.432 2.156 20 0 BEADRP CC1(C)CCC[C@@H]([NH2+]CCSCC[NH3+])C1 ZINC001258280494 991210326 /nfs/dbraw/zinc/21/03/26/991210326.db2.gz WILJOWWOOCHCKX-LLVKDONJSA-N 2 0 230.421 2.237 20 0 BEADRP CSC(C)(C)C[C@@H](C)[NH2+]C(C)(C)C[NH3+] ZINC001258314571 991238532 /nfs/dbraw/zinc/23/85/32/991238532.db2.gz FVVXQMJCRAMYNH-SECBINFHSA-N 2 0 218.410 2.234 20 0 BEADRP CSC(C)(C)C[C@H](C)[N@H+](C)C[C@H](C)C[NH3+] ZINC001258335130 991261801 /nfs/dbraw/zinc/26/18/01/991261801.db2.gz XFIUVFMPDHFRIB-MNOVXSKESA-N 2 0 232.437 2.433 20 0 BEADRP C[C@H](CC1CC1)[N@@H+]1C[C@H]2CC[NH+](C)C[C@H]2C1 ZINC001258460587 991414245 /nfs/dbraw/zinc/41/42/45/991414245.db2.gz IWKNYLRXCMONKL-BNOWGMLFSA-N 2 0 222.376 2.059 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)C[C@@]1(C)CCCCO1 ZINC001560811590 991610372 /nfs/dbraw/zinc/61/03/72/991610372.db2.gz QFLRBUZCAJCLIO-CQSZACIVSA-N 2 0 242.407 2.219 20 0 BEADRP C[C@H]1C[C@H](NC(=[NH2+])SCC[NH3+])CC(C)(C)C1 ZINC001258687123 991621158 /nfs/dbraw/zinc/62/11/58/991621158.db2.gz MRFAMBNUZQSWJL-UWVGGRQHSA-N 2 0 243.420 2.417 20 0 BEADRP C[C@@H]1C[C@@H](NC(=[NH2+])SCC[NH3+])CC(C)(C)C1 ZINC001258687122 991622903 /nfs/dbraw/zinc/62/29/03/991622903.db2.gz MRFAMBNUZQSWJL-NXEZZACHSA-N 2 0 243.420 2.417 20 0 BEADRP CCCC[C@@H](CO)[NH2+]C1CC[NH+](CCC)CC1 ZINC001258766349 991727702 /nfs/dbraw/zinc/72/77/02/991727702.db2.gz RFSYAEMWYCVBLT-AWEZNQCLSA-N 2 0 242.407 2.002 20 0 BEADRP CC[C@@H](Cc1ccccc1)[NH2+][C@@H]1CCC[C@@H]1[NH3+] ZINC001258844744 991878307 /nfs/dbraw/zinc/87/83/07/991878307.db2.gz RFVYYVADNRRQSX-SOUVJXGZSA-N 2 0 232.371 2.477 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCO[C@@H](C)C1 ZINC001258907559 991901000 /nfs/dbraw/zinc/90/10/00/991901000.db2.gz KMVMPSHGQDNYJK-KBPBESRZSA-N 2 0 242.407 2.218 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]Cc1sccc1C ZINC001261370820 992276748 /nfs/dbraw/zinc/27/67/48/992276748.db2.gz VTCVUFZHQDWFTE-JTQLQIEISA-N 2 0 212.362 2.144 20 0 BEADRP C1[NH2+]C[C@@H]2[C@H]1[C@H]2[NH2+][C@@H]1CC[C@@H]2CCCC[C@@H]2C1 ZINC001261424118 992294714 /nfs/dbraw/zinc/29/47/14/992294714.db2.gz NSTFQZLBTCRMGT-MZHQWRCYSA-N 2 0 234.387 2.153 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]1[NH2+]CCCOCc1ccccc1 ZINC001261423438 992295183 /nfs/dbraw/zinc/29/51/83/992295183.db2.gz WFVPEWXVPGLZTO-GJZGRUSLSA-N 2 0 248.370 2.063 20 0 BEADRP C1[NH2+]C[C@@H]2[C@H]1[C@H]2[NH2+][C@@H]1CC[C@H]2CCCC[C@@H]2C1 ZINC001261424117 992296117 /nfs/dbraw/zinc/29/61/17/992296117.db2.gz NSTFQZLBTCRMGT-MBIARJLFSA-N 2 0 234.387 2.153 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@@H]1CCC12CCCC2 ZINC001261424063 992298014 /nfs/dbraw/zinc/29/80/14/992298014.db2.gz MGQXDUNXMQJFPR-NWDGAFQWSA-N 2 0 210.365 2.297 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@@H]([NH2+]CCC(C)(C)C)[C@@H]2C1 ZINC001474757051 992523816 /nfs/dbraw/zinc/52/38/16/992523816.db2.gz OTAHFWVGBKLQIC-YNEHKIRRSA-N 2 0 224.392 2.352 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+]C[C@@H]1CCc2ccccc21 ZINC001262202571 992799284 /nfs/dbraw/zinc/79/92/84/992799284.db2.gz XACZCVSTOJTYLF-ZFWWWQNUSA-N 2 0 244.382 2.447 20 0 BEADRP C[NH+](C)[C@@H]1CC[C@@H]2C[N@H+](Cc3ccco3)C[C@H]2C1 ZINC001262378401 992870992 /nfs/dbraw/zinc/87/09/92/992870992.db2.gz AULHWUJQRZADQH-MGPQQGTHSA-N 2 0 248.370 2.442 20 0 BEADRP C(C[C@@H]1CC[NH2+]C1)[NH2+][C@@H]1C[C@@H]2CC[C@@H](C2)C1 ZINC001574774287 992898733 /nfs/dbraw/zinc/89/87/33/992898733.db2.gz KUFUGIUCDKMFFD-FQUUOJAGSA-N 2 0 222.376 2.154 20 0 BEADRP C1=CO[C@@H](C[NH2+]CC[C@@H]2CCC[NH2+]CC2)CC1 ZINC001574774410 992899971 /nfs/dbraw/zinc/89/99/71/992899971.db2.gz MRMWSWXFTIDJJW-ZIAGYGMSSA-N 2 0 238.375 2.049 20 0 BEADRP C1=CC[C@@H](C[NH2+][C@]23CCC[C@H]2[NH2+]CC3)CC1 ZINC001574774994 992900866 /nfs/dbraw/zinc/90/08/66/992900866.db2.gz STKHQEWNZKWAED-MCIONIFRSA-N 2 0 220.360 2.217 20 0 BEADRP C(C[N@H+](CC1CC1)C1CCC1)[C@H]1CC[NH2+]C1 ZINC001574774810 992901682 /nfs/dbraw/zinc/90/16/82/992901682.db2.gz QLIACTVQCZTVGE-GFCCVEGCSA-N 2 0 222.376 2.251 20 0 BEADRP C(CC1CCC1)[NH2+][C@]12CCC[C@H]1[NH2+]CC2 ZINC001574774274 992901704 /nfs/dbraw/zinc/90/17/04/992901704.db2.gz KTFMZIOAHVUJKJ-OLZOCXBDSA-N 2 0 208.349 2.051 20 0 BEADRP C1=C[C@H](C[NH2+]Cc2cccc3c2CC[NH2+]C3)CC1 ZINC001574773921 992902083 /nfs/dbraw/zinc/90/20/83/992902083.db2.gz GQWYOCPSWMTYJL-ZDUSSCGKSA-N 2 0 242.366 2.388 20 0 BEADRP C([NH2+][C@@H]1C[C@@H]2CCC[C@H]12)[C@H]1CCC[NH2+]CC1 ZINC001574801033 992913215 /nfs/dbraw/zinc/91/32/15/992913215.db2.gz MOUOKBUJCPVYIM-XDQVBPFNSA-N 2 0 222.376 2.154 20 0 BEADRP CC(C)(C)CC[C@@H]([NH3+])C[NH2+][C@H]1CCCC[C@@H]1O ZINC001575131074 992992763 /nfs/dbraw/zinc/99/27/63/992992763.db2.gz SFJJPJQTKQXKSP-AGIUHOORSA-N 2 0 242.407 2.033 20 0 BEADRP CC(C)(C)C[NH+](CCOCC[NH3+])CC(C)(C)C ZINC001575132687 992996909 /nfs/dbraw/zinc/99/69/09/992996909.db2.gz MAADDNVBMUYIPO-UHFFFAOYSA-N 2 0 244.423 2.356 20 0 BEADRP CC(C)(C)C[C@@H]1C[C@H]1[NH2+]CC1(C[NH3+])CC1 ZINC001575136471 992999224 /nfs/dbraw/zinc/99/92/24/992999224.db2.gz WBBOMSXJABQHRI-WDEREUQCSA-N 2 0 210.365 2.140 20 0 BEADRP CC(C)(C)O[C@H]1C[C@H]([NH2+][C@H]2CCC[C@H]([NH3+])C2)C1 ZINC001575254119 993000966 /nfs/dbraw/zinc/00/09/66/993000966.db2.gz YSOWSHOVAXULDE-CYDGBPFRSA-N 2 0 240.391 2.192 20 0 BEADRP C[C@@H](C[NH+]1CCC(C)CC1)Nc1cc[nH+]cc1 ZINC001262672911 993015076 /nfs/dbraw/zinc/01/50/76/993015076.db2.gz QVMZLNXSSALERB-ZDUSSCGKSA-N 2 0 233.359 2.036 20 0 BEADRP C[NH+](C)[C@@H]1CC[C@@H]2CN(c3cc[nH+]cc3)C[C@H]2C1 ZINC001262674991 993017853 /nfs/dbraw/zinc/01/78/53/993017853.db2.gz SHZJZUIDRQFBRZ-UMVBOHGHSA-N 2 0 245.370 2.248 20 0 BEADRP CC(C)=CC[N@H+]1CC2(C[C@@H]1C)CC[NH2+]CC2 ZINC001575391742 993036005 /nfs/dbraw/zinc/03/60/05/993036005.db2.gz QNWIMEKUNQIMGT-ZDUSSCGKSA-N 2 0 222.376 2.417 20 0 BEADRP CC(C)[C@H]1CCC[C@@H]1[NH2+][C@H]1CC[NH2+][C@@H]1C ZINC001575498653 993057325 /nfs/dbraw/zinc/05/73/25/993057325.db2.gz NESMMTZNWRKVQZ-NDBYEHHHSA-N 2 0 210.365 2.151 20 0 BEADRP C[C@H](COCC1CC1)[NH2+]Cc1ccc(C[NH3+])cc1 ZINC001576041048 993165262 /nfs/dbraw/zinc/16/52/62/993165262.db2.gz MFPMLCUOMKZVAF-GFCCVEGCSA-N 2 0 248.370 2.050 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@@H](C)[C@@H]1C[C@H]1C1CC1 ZINC001576152476 993190919 /nfs/dbraw/zinc/19/09/19/993190919.db2.gz IIYTVUUWYMKTIA-WKLONVCASA-N 2 0 210.365 2.136 20 0 BEADRP [NH3+][C@H]1CCC[N@H+](Cc2ccc3c(c2)CCC3)CC1 ZINC000378809308 993206449 /nfs/dbraw/zinc/20/64/49/993206449.db2.gz ZASUODYREVCHER-INIZCTEOSA-N 2 0 244.382 2.489 20 0 BEADRP C[C@H]([NH2+]C[C@]12CCC[C@H]1[NH2+]CC2)C1CCC1 ZINC001576246900 993232714 /nfs/dbraw/zinc/23/27/14/993232714.db2.gz ZXABQZCVVPYPHA-IACUBPJLSA-N 2 0 222.376 2.297 20 0 BEADRP CC1(C)C(C)(C)C1(C)[NH2+]C[C@]12C[C@H]1C[NH2+]C2 ZINC001576366075 993277264 /nfs/dbraw/zinc/27/72/64/993277264.db2.gz UVGOSHYLKNMDHK-IINYFYTJSA-N 2 0 222.376 2.010 20 0 BEADRP C[C@H](CC1CC1)[N@@H+]1CCCC[C@@H](C[NH3+])C1 ZINC000379855309 993289144 /nfs/dbraw/zinc/28/91/44/993289144.db2.gz BSZWEZJIMBIUCZ-YPMHNXCESA-N 2 0 210.365 2.236 20 0 BEADRP CC1(C)CCC[C@H]([NH2+]C[C@H]2[C@@H]3C[NH2+]C[C@H]23)CC1 ZINC001576427118 993302381 /nfs/dbraw/zinc/30/23/81/993302381.db2.gz RSVCXKFVYKQSTK-IGQOVBAYSA-N 2 0 236.403 2.400 20 0 BEADRP CC1(C)C[NH2+][C@H]1C1CC[NH+](CC2CCC2)CC1 ZINC001576469691 993317014 /nfs/dbraw/zinc/31/70/14/993317014.db2.gz SJFSSLLNLSBICZ-AWEZNQCLSA-N 2 0 236.403 2.497 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH2+][C@H]2C=CCCC2)CC1 ZINC000380360461 993327554 /nfs/dbraw/zinc/32/75/54/993327554.db2.gz YHHHNRMTSMSEEO-STQMWFEESA-N 2 0 208.349 2.169 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH2+][C@@H]2C=CCCC2)CC1 ZINC000380360459 993327672 /nfs/dbraw/zinc/32/76/72/993327672.db2.gz YHHHNRMTSMSEEO-OLZOCXBDSA-N 2 0 208.349 2.169 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2C[C@H](C3CC3)[C@@H]2C2CC2)CC[NH2+]1 ZINC001576598523 993362957 /nfs/dbraw/zinc/36/29/57/993362957.db2.gz MGCDWEBVEFKCJJ-BHTHQVBYSA-N 2 0 248.414 2.495 20 0 BEADRP C[C@H]1CCC[C@H](C)[N@H+](CC2(C[NH3+])CC2)C1 ZINC001576669530 993389215 /nfs/dbraw/zinc/38/92/15/993389215.db2.gz SKZMZDIYHYAIFU-RYUDHWBXSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]CC2=CC[NH2+]CC2)CC1 ZINC001576679565 993390340 /nfs/dbraw/zinc/39/03/40/993390340.db2.gz CTTTZQVBSKKTHE-TZMCWYRMSA-N 2 0 222.376 2.465 20 0 BEADRP [NH3+][C@@H]1CCC[N@H+](CCC2CCCC2)CC1 ZINC000382302644 993447165 /nfs/dbraw/zinc/44/71/65/993447165.db2.gz NVFPKRRBQBNHPH-CYBMUJFWSA-N 2 0 210.365 2.380 20 0 BEADRP CCCC[C@@H](CC)C[NH+]1CC(C[NH2+]C)C1 ZINC000382316576 993448195 /nfs/dbraw/zinc/44/81/95/993448195.db2.gz TURNMDXDXDBDAI-GFCCVEGCSA-N 2 0 212.381 2.354 20 0 BEADRP CC[C@H](C)[N@H+](CCO)C[C@@H]([NH3+])CCC(C)(C)C ZINC001576996835 993482187 /nfs/dbraw/zinc/48/21/87/993482187.db2.gz XQSDYQWDRIYWGW-STQMWFEESA-N 2 0 244.423 2.233 20 0 BEADRP CCC(CC)(C[NH3+])C[NH2+]CC1CC=CC1 ZINC001577051838 993489616 /nfs/dbraw/zinc/48/96/16/993489616.db2.gz BKFAGFQNVFLFLP-UHFFFAOYSA-N 2 0 210.365 2.307 20 0 BEADRP CC[C@@H](CSC)[N@H+](C)C[C@H]1CC[C@@H]([NH3+])C1 ZINC001577092644 993502112 /nfs/dbraw/zinc/50/21/12/993502112.db2.gz HTNAWMLQUBPKDE-TUAOUCFPSA-N 2 0 230.421 2.187 20 0 BEADRP CCC[C@@H](C)[NH+]1CCC([C@@H]2CC[NH2+]C2)CC1 ZINC001577345402 993586173 /nfs/dbraw/zinc/58/61/73/993586173.db2.gz QPXSRMHKEFBERV-TZMCWYRMSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H](Cc1ccco1)[NH2+]C[C@H]1CCC[NH2+][C@H]1C ZINC000384501865 993591777 /nfs/dbraw/zinc/59/17/77/993591777.db2.gz XGZFJQHKJRMXJW-FRRDWIJNSA-N 2 0 236.359 2.188 20 0 BEADRP C[C@H](Cc1ccco1)[NH2+]C[C@@H]1CCC[NH2+][C@@H]1C ZINC000384501867 993594649 /nfs/dbraw/zinc/59/46/49/993594649.db2.gz XGZFJQHKJRMXJW-UPJWGTAASA-N 2 0 236.359 2.188 20 0 BEADRP [NH3+]C[C@H]1CCCC[N@H+](CCc2cccs2)C1 ZINC000390470306 993790725 /nfs/dbraw/zinc/79/07/25/993790725.db2.gz HCAXZRDXPYYVTC-GFCCVEGCSA-N 2 0 238.400 2.351 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]C2CCC(C[NH3+])CC2)CCS1 ZINC001332419407 994085979 /nfs/dbraw/zinc/08/59/79/994085979.db2.gz CVDYVIGCJMRKQA-WTIISPKJSA-N 2 0 242.432 2.378 20 0 BEADRP CCC(C)(C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000020523790 1170115430 /nfs/dbraw/zinc/11/54/30/1170115430.db2.gz HVMZTHQGGVSIKU-YOGCLGLASA-N 2 0 210.365 2.390 20 0 BEADRP CC(C)C[C@H](C)[N@@H+]1C[C@H]2CC[NH+](C)C[C@H]2C1 ZINC001620483118 1170675589 /nfs/dbraw/zinc/67/55/89/1170675589.db2.gz DYCKRVVAAYYIBG-MJBXVCDLSA-N 2 0 224.392 2.305 20 0 BEADRP CC[C@H]1CC[N@H+](CC2CC[NH+](C)CC2)[C@H]1C ZINC001621270274 1170758241 /nfs/dbraw/zinc/75/82/41/1170758241.db2.gz QYSAKBDPOZMOLB-JSGCOSHPSA-N 2 0 224.392 2.449 20 0 BEADRP C[C@H]1C[C@@H]1C[N@@H+]1CCC(C)(C)NC(C)(C)C1 ZINC001621570401 1170851267 /nfs/dbraw/zinc/85/12/67/1170851267.db2.gz SYDSHKHFCQSOOU-NWDGAFQWSA-N 2 0 224.392 2.495 20 0 BEADRP c1ccc(CCC[NH2+][C@H]2CCCC[NH2+]C2)cc1 ZINC000039020034 1171104811 /nfs/dbraw/zinc/10/48/11/1171104811.db2.gz MTFNYDATMPGLRF-HNNXBMFYSA-N 2 0 232.371 2.351 20 0 BEADRP CCN(Cc1ccncc1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000040747428 1171152965 /nfs/dbraw/zinc/15/29/65/1171152965.db2.gz JKDAHHYMQJGELI-YIONKMFJSA-N 2 0 245.370 2.187 20 0 BEADRP CCN(Cc1ccccn1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000040747452 1171153428 /nfs/dbraw/zinc/15/34/28/1171153428.db2.gz SXZVCOLJVUMMLM-NNQSOWQGSA-N 2 0 245.370 2.187 20 0 BEADRP C[C@@H]1C[C@@H](C)CC[N@@H+]1CC1CC[NH2+]CC1 ZINC000051732100 1171912067 /nfs/dbraw/zinc/91/20/67/1171912067.db2.gz UWUDXSUCGTUOSV-NWDGAFQWSA-N 2 0 210.365 2.106 20 0 BEADRP CCc1ccccc1C[NH2+]CCCC[NH3+] ZINC000052202800 1171947590 /nfs/dbraw/zinc/94/75/90/1171947590.db2.gz HBVUXRQWEZYMTC-UHFFFAOYSA-N 2 0 206.333 2.078 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@H](C)CCCC(F)(F)F ZINC000414994204 398137908 /nfs/dbraw/zinc/13/79/08/398137908.db2.gz UMWSCWIMALXDDO-BDAKNGLRSA-N 2 0 226.286 2.434 20 0 BEADRP CC[NH+](CC)CCC[N@@H+]1C[C@@H](C)C[C@@H]1C ZINC000548918499 398138691 /nfs/dbraw/zinc/13/86/91/398138691.db2.gz AWNOTSNGIQMCNR-STQMWFEESA-N 2 0 212.381 2.449 20 0 BEADRP CC[NH+](CC)CCC[N@@H+]1C[C@H](C)C[C@H]1C ZINC000548918491 398138894 /nfs/dbraw/zinc/13/88/94/398138894.db2.gz AWNOTSNGIQMCNR-CHWSQXEVSA-N 2 0 212.381 2.449 20 0 BEADRP CC[C@H](COC)[NH2+]C[C@H](C)C[NH+]1CCCCC1 ZINC000079713153 136210476 /nfs/dbraw/zinc/21/04/76/136210476.db2.gz YLBGBELYZLKZCT-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP CC[C@@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)C1CC1 ZINC000083055513 349484858 /nfs/dbraw/zinc/48/48/58/349484858.db2.gz GNWFSRFGQZOYQH-BXUZGUMPSA-N 2 0 222.376 2.249 20 0 BEADRP Cc1cccnc1CN(C)CC[C@@H]([NH3+])C(C)C ZINC000161861950 349507065 /nfs/dbraw/zinc/50/70/65/349507065.db2.gz DOZWGSVYOPDWKP-CYBMUJFWSA-N 2 0 235.375 2.195 20 0 BEADRP CC1(C)[C@@H]2C[N@@H+](CCCC3CC[NH2+]CC3)C[C@@H]21 ZINC000379547960 398152781 /nfs/dbraw/zinc/15/27/81/398152781.db2.gz HXUWPPHEDKVUQJ-OKILXGFUSA-N 2 0 236.403 2.354 20 0 BEADRP COc1ccc(C2([NH2+][C@@H](C)CCC[NH3+])CC2)cc1 ZINC000422941676 398159370 /nfs/dbraw/zinc/15/93/70/398159370.db2.gz VISUBYHYDRQDTR-LBPRGKRZSA-N 2 0 248.370 2.401 20 0 BEADRP Cc1ccccc1OCC[NH2+]C1CCC([NH3+])CC1 ZINC000415089447 398159797 /nfs/dbraw/zinc/15/97/97/398159797.db2.gz XUCUPUVJFSOLPE-UHFFFAOYSA-N 2 0 248.370 2.233 20 0 BEADRP CCC1(CC)[C@H]([NH2+][C@H](C)C[C@H](C)[NH3+])C[C@@H]1OC ZINC000422943704 398159823 /nfs/dbraw/zinc/15/98/23/398159823.db2.gz RDGURCYWILVPJI-LOWDOPEQSA-N 2 0 242.407 2.296 20 0 BEADRP C[C@@H]1C[C@H](CC[NH2+][C@@H]2CCC[C@H]([NH3+])C2)CCO1 ZINC000563426366 398171128 /nfs/dbraw/zinc/17/11/28/398171128.db2.gz UDXMUTMGCGKWFY-YIYPIFLZSA-N 2 0 240.391 2.051 20 0 BEADRP C[NH+](C)C1CN(c2cc[nH+]c3cc(F)ccc32)C1 ZINC000302125791 398174796 /nfs/dbraw/zinc/17/47/96/398174796.db2.gz IHMRNEFLZPVFLQ-UHFFFAOYSA-N 2 0 245.301 2.124 20 0 BEADRP FC1(F)C[C@]12CC[N@H+](CCCn1ccnc1)C2 ZINC000649907412 398180299 /nfs/dbraw/zinc/18/02/99/398180299.db2.gz QUKVLMSAVHENCF-NSHDSACASA-N 2 0 241.285 2.004 20 0 BEADRP CC(C)C[C@H](C)C[N@@H+]1CC[C@@H]([NH3+])C[C@@H]1C ZINC000301012145 349515924 /nfs/dbraw/zinc/51/59/24/349515924.db2.gz YZIPOXSYKJSEMR-RWMBFGLXSA-N 2 0 212.381 2.480 20 0 BEADRP Cc1ccccc1OCC[NH2+][C@@H]1CCC[C@@H]1C[NH3+] ZINC000422943963 398160335 /nfs/dbraw/zinc/16/03/35/398160335.db2.gz LSNUCHAEAFPQTP-ZIAGYGMSSA-N 2 0 248.370 2.091 20 0 BEADRP Cc1ccccc1OCC[NH2+][C@@H]1CCC[C@H]1C[NH3+] ZINC000422943962 398160362 /nfs/dbraw/zinc/16/03/62/398160362.db2.gz LSNUCHAEAFPQTP-UONOGXRCSA-N 2 0 248.370 2.091 20 0 BEADRP COCCC[NH2+][C@H]1CCN[C@H](c2ccccc2)C1 ZINC000415097782 398161785 /nfs/dbraw/zinc/16/17/85/398161785.db2.gz DLOKLWPKJAGIJT-GJZGRUSLSA-N 2 0 248.370 2.106 20 0 BEADRP CC(C)C[C@H]([NH3+])C[NH2+][C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000415118353 398163133 /nfs/dbraw/zinc/16/31/33/398163133.db2.gz YBHXJBXROLAKFY-MROQNXINSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H](C[NH2+][C@H](C)C[C@H](C)[NH3+])CC(F)(F)F ZINC000423174526 398164189 /nfs/dbraw/zinc/16/41/89/398164189.db2.gz CIAXKJHKAAOLBX-HRDYMLBCSA-N 2 0 226.286 2.290 20 0 BEADRP c1ccc(C[C@@H]([NH2+]C[C@H]2CCC[NH2+]2)C2CC2)cc1 ZINC000423233404 398165278 /nfs/dbraw/zinc/16/52/78/398165278.db2.gz JTFFZQSDLFVLBA-HZPDHXFCSA-N 2 0 244.382 2.349 20 0 BEADRP C[C@@H](C[NH2+]C1CCC(C[NH3+])CC1)CC(F)F ZINC000647801269 398207783 /nfs/dbraw/zinc/20/77/83/398207783.db2.gz TZHFJSYCAAFKCD-KPPDAEKUSA-N 2 0 234.334 2.385 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCCC[C@@H]1C[NH3+])CC(F)F ZINC000647801221 398207926 /nfs/dbraw/zinc/20/79/26/398207926.db2.gz RPGXYIBZMATDBU-HBNTYKKESA-N 2 0 234.334 2.385 20 0 BEADRP CC[C@@H](F)C[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000440711800 398208389 /nfs/dbraw/zinc/20/83/89/398208389.db2.gz KIDPSDCYQGOANI-CYBMUJFWSA-N 2 0 230.371 2.398 20 0 BEADRP Cc1cc(NCC(C)(C)C[NH+](C)C)cc[nH+]1 ZINC000229559807 178157233 /nfs/dbraw/zinc/15/72/33/178157233.db2.gz LBLTUMGMXAVBBM-UHFFFAOYSA-N 2 0 221.348 2.390 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+][C@H]1CCCc2cccnc21 ZINC000643512457 398224571 /nfs/dbraw/zinc/22/45/71/398224571.db2.gz LMXSPVZPTHISJL-IHRRRGAJSA-N 2 0 245.370 2.176 20 0 BEADRP Cc1cc(NC[C@@]2(C)CCC[NH2+]C2)cc[nH+]1 ZINC000229577408 178166881 /nfs/dbraw/zinc/16/68/81/178166881.db2.gz IGIMJZRSNZNLMP-ZDUSSCGKSA-N 2 0 219.332 2.192 20 0 BEADRP CCC(CC)C[N@H+](CC)CCC[NH2+]C ZINC000042488144 168348412 /nfs/dbraw/zinc/34/84/12/168348412.db2.gz JEVYHJHADDTBSJ-UHFFFAOYSA-N 2 0 200.370 2.354 20 0 BEADRP Cc1cc(N[C@H]2C[C@H](C)[N@@H+](C3CC3)C2)cc[nH+]1 ZINC000290737952 178191778 /nfs/dbraw/zinc/19/17/78/178191778.db2.gz GUKZSDXCUSNMJS-AAEUAGOBSA-N 2 0 231.343 2.427 20 0 BEADRP CCC(CC)C[N@@H+]1CCC[C@]2(CC[NH2+]C2)C1 ZINC000352535033 168353071 /nfs/dbraw/zinc/35/30/71/168353071.db2.gz LOPZVRZKSLDAJV-CQSZACIVSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H](Cc1cccs1)[NH2+]CC1([NH3+])CCC1 ZINC000643517912 398231052 /nfs/dbraw/zinc/23/10/52/398231052.db2.gz YFLKIHYRZIWDDT-JTQLQIEISA-N 2 0 224.373 2.150 20 0 BEADRP CCC(CC)C[NH2+]CCC[NH+]1CCCC1 ZINC000020128966 168359838 /nfs/dbraw/zinc/35/98/38/168359838.db2.gz VVLPFMPCKGJJOE-UHFFFAOYSA-N 2 0 212.381 2.498 20 0 BEADRP Cc1cc([C@H](C)[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)no1 ZINC000333893845 178256168 /nfs/dbraw/zinc/25/61/68/178256168.db2.gz YROOBKCGEOCFRD-UMSGYPCISA-N 2 0 249.358 2.022 20 0 BEADRP CC(C)CCC[N@H+](C)CC(C)(C)C[NH3+] ZINC000165550688 136227349 /nfs/dbraw/zinc/22/73/49/136227349.db2.gz XNGQEQWZGPGUQW-UHFFFAOYSA-N 2 0 200.370 2.339 20 0 BEADRP Cc1csc(C[NH2+][C@@H]2CCC[C@H]2C[NH3+])c1 ZINC000344647027 136231967 /nfs/dbraw/zinc/23/19/67/136231967.db2.gz WRUFZZUWJUCIIE-CMPLNLGQSA-N 2 0 224.373 2.274 20 0 BEADRP CC(C)[N@H+](C[C@@H]1CC[NH2+]C1)C1CCCC1 ZINC000381557407 398262441 /nfs/dbraw/zinc/26/24/41/398262441.db2.gz PQUNDEAOHVCBCY-GFCCVEGCSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1Cc2ccccc21)[C@H]1CCCC[NH2+]1 ZINC000386094525 398263044 /nfs/dbraw/zinc/26/30/44/398263044.db2.gz IQMQTKVHEMHWBL-DUVNUKRYSA-N 2 0 244.382 2.447 20 0 BEADRP CCC[NH+](CCC)CCC[NH2+][C@H]1CO[C@H](C)C1 ZINC000647178683 398264570 /nfs/dbraw/zinc/26/45/70/398264570.db2.gz CYYFZGCANFIFLN-ZIAGYGMSSA-N 2 0 242.407 2.266 20 0 BEADRP CCC(CC)[N@H+](CCOC)C[C@H]1CCC[NH2+]C1 ZINC000042681750 168374273 /nfs/dbraw/zinc/37/42/73/168374273.db2.gz RSLLRDNOXXOJJV-ZDUSSCGKSA-N 2 0 242.407 2.123 20 0 BEADRP C1CC1[C@@H]1CC[C@@H]1[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000348109802 136234344 /nfs/dbraw/zinc/23/43/44/136234344.db2.gz ZITBKZLCCIZSGY-KBXIAJHMSA-N 2 0 234.387 2.391 20 0 BEADRP CCC[C@@H](C)C[N@H+](C)CCC[NH+](C)C ZINC000561971117 323009719 /nfs/dbraw/zinc/00/97/19/323009719.db2.gz YTEZKGDRLMKSCA-GFCCVEGCSA-N 2 0 200.370 2.306 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@H]2Cc3ccccc32)CC1 ZINC000037565259 538963281 /nfs/dbraw/zinc/96/32/81/538963281.db2.gz MMUOHMTURAEVNY-CQSZACIVSA-N 2 0 244.382 2.400 20 0 BEADRP C[NH2+]C[C@@H]1CCC[N@H+](CCCC(C)C)C1 ZINC000165428792 361840439 /nfs/dbraw/zinc/84/04/39/361840439.db2.gz QGKRRZMQHPDMKR-ZDUSSCGKSA-N 2 0 212.381 2.354 20 0 BEADRP Cc1ccc2c(c1)CC[C@H]2[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000335602161 136235634 /nfs/dbraw/zinc/23/56/34/136235634.db2.gz XGJBEXOZYHLALW-XHDPSFHLSA-N 2 0 230.355 2.180 20 0 BEADRP CCC(CC)[NH2+][C@H](C)C1CC[NH+](C)CC1 ZINC000037208735 538961973 /nfs/dbraw/zinc/96/19/73/538961973.db2.gz FZJXJEXQVQLMMR-LLVKDONJSA-N 2 0 212.381 2.495 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCc2cc(F)ccc21)C1C[NH2+]C1 ZINC000335602401 136235671 /nfs/dbraw/zinc/23/56/71/136235671.db2.gz ZIOQGPGZLJVWPX-YMTOWFKASA-N 2 0 234.318 2.011 20 0 BEADRP C[C@H]([NH2+][C@@H](C)C1CC[NH+](C)CC1)c1ccccn1 ZINC000037220376 538962004 /nfs/dbraw/zinc/96/20/04/538962004.db2.gz RNEZHQYWTDRPNR-STQMWFEESA-N 2 0 247.386 2.463 20 0 BEADRP [NH3+][C@H]1CCCCC[C@H]1[NH2+]CC1CC(F)(F)C1 ZINC000335611995 136237261 /nfs/dbraw/zinc/23/72/61/136237261.db2.gz NTYDJUSOCJXRRP-WDEREUQCSA-N 2 0 232.318 2.281 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]CC1CC(F)(F)C1 ZINC000335611992 136237270 /nfs/dbraw/zinc/23/72/70/136237270.db2.gz NTYDJUSOCJXRRP-GHMZBOCLSA-N 2 0 232.318 2.281 20 0 BEADRP c1ccc(C[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000106868649 398286299 /nfs/dbraw/zinc/28/62/99/398286299.db2.gz QFWSRKSYZUNQFS-LSDHHAIUSA-N 2 0 230.355 2.403 20 0 BEADRP CC(C)=CC[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000188455933 538978854 /nfs/dbraw/zinc/97/88/54/538978854.db2.gz KNSGBVISOHONSM-CHWSQXEVSA-N 2 0 208.349 2.169 20 0 BEADRP CC1(C)CCC[C@@H]1[NH2+][C@H]1CCc2nc[nH]c2C1 ZINC000336479883 342807628 /nfs/dbraw/zinc/80/76/28/342807628.db2.gz UAXSQQANBZSOBY-GWCFXTLKSA-N 2 0 233.359 2.435 20 0 BEADRP CC(C)C1([NH2+][C@@H](C)C2CC[NH+](C)CC2)CC1 ZINC000381976314 398291023 /nfs/dbraw/zinc/29/10/23/398291023.db2.gz AGULUVSUGRMHET-LBPRGKRZSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H]([NH2+][C@@H]1CSC1(C)C)C1CC[NH+](C)CC1 ZINC000381470401 539001869 /nfs/dbraw/zinc/00/18/69/539001869.db2.gz OGMPNTPZHPBAOX-CMPLNLGQSA-N 2 0 242.432 2.200 20 0 BEADRP C[C@@H]1C[C@H]([NH+]2CCC(C)(C)CC2)CC[NH2+]1 ZINC000197532331 539012396 /nfs/dbraw/zinc/01/23/96/539012396.db2.gz YJADHPWJQNQDBK-VXGBXAGGSA-N 2 0 210.365 2.249 20 0 BEADRP CCN1CCC[C@H]([NH2+][C@@H]2CCC2(C)C)C1 ZINC000308786235 342841325 /nfs/dbraw/zinc/84/13/25/342841325.db2.gz FQCPJTFBUYOTGD-NWDGAFQWSA-N 2 0 210.365 2.249 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CC2(C)CCC2)[C@@H](C)C1 ZINC000222211761 259323310 /nfs/dbraw/zinc/32/33/10/259323310.db2.gz IFGIANBTQISFAK-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP CCCCC[C@H](C)[N@@H+]1CC[C@H](C[NH2+]C)C1 ZINC000053031687 1172010123 /nfs/dbraw/zinc/01/01/23/1172010123.db2.gz XMLFMZOGZSBSIG-QWHCGFSZSA-N 2 0 212.381 2.497 20 0 BEADRP CCC[C@@H](C)CCC[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC000625096965 342852013 /nfs/dbraw/zinc/85/20/13/342852013.db2.gz HSDDUOVEMFXCHE-MCIONIFRSA-N 2 0 224.392 2.354 20 0 BEADRP CC[C@@H](C)C[N@H+](C)CCC1CC[NH2+]CC1 ZINC000037173370 342923944 /nfs/dbraw/zinc/92/39/44/342923944.db2.gz KDMKVQKIAHBUEY-GFCCVEGCSA-N 2 0 212.381 2.354 20 0 BEADRP C[C@@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1cscn1 ZINC000580312080 346893672 /nfs/dbraw/zinc/89/36/72/346893672.db2.gz JBZXBBDNZIAQFR-GHMZBOCLSA-N 2 0 239.388 2.326 20 0 BEADRP Cc1ccc(C[N@H+]2C[C@H](C[NH3+])C[C@H]2C)cc1 ZINC000228074329 398340867 /nfs/dbraw/zinc/34/08/67/398340867.db2.gz VYKQNWNZIKLTBF-OCCSQVGLSA-N 2 0 218.344 2.164 20 0 BEADRP Cc1ccc(C[N@H+]2C[C@@H](C[NH3+])C[C@H]2C)cc1 ZINC000228074348 398340877 /nfs/dbraw/zinc/34/08/77/398340877.db2.gz VYKQNWNZIKLTBF-TZMCWYRMSA-N 2 0 218.344 2.164 20 0 BEADRP CSc1ccc(C[NH2+]CCCC[NH3+])cc1 ZINC000037715167 342943428 /nfs/dbraw/zinc/94/34/28/342943428.db2.gz LALZZPRJDJUWHU-UHFFFAOYSA-N 2 0 224.373 2.237 20 0 BEADRP CSC[C@H](C)[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000229353114 398342734 /nfs/dbraw/zinc/34/27/34/398342734.db2.gz DJYDSQREWZXZJW-ZWKOPEQDSA-N 2 0 236.384 2.472 20 0 BEADRP CC[C@H](C)[NH2+]C[C@H](C)N1CCC[C@H](C)C1 ZINC000053486424 346901776 /nfs/dbraw/zinc/90/17/76/346901776.db2.gz VPTWHJVNVGHCGO-AVGNSLFASA-N 2 0 212.381 2.495 20 0 BEADRP CC[C@H](C)[NH2+]C[C@@H](C)N1CCC[C@H](C)C1 ZINC000053486418 346902373 /nfs/dbraw/zinc/90/23/73/346902373.db2.gz VPTWHJVNVGHCGO-RWMBFGLXSA-N 2 0 212.381 2.495 20 0 BEADRP CCc1cc(N2CC[C@@H](C[NH+](C)C)C2)cc[nH+]1 ZINC000450438569 529535547 /nfs/dbraw/zinc/53/55/47/529535547.db2.gz VKZALSIYUVLYKY-LBPRGKRZSA-N 2 0 233.359 2.032 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH+](C)CC[C@H](C)F)[C@@H](C)C1 ZINC000351852915 136257872 /nfs/dbraw/zinc/25/78/72/136257872.db2.gz AZTGJKZVZIHOEC-AVGNSLFASA-N 2 0 230.371 2.397 20 0 BEADRP CCCCC[C@@H](C)[NH2+]CCC[NH+](C)C ZINC000020091845 342968834 /nfs/dbraw/zinc/96/88/34/342968834.db2.gz HEEVISSHZYGBHY-GFCCVEGCSA-N 2 0 200.370 2.497 20 0 BEADRP CCN1CCC([NH2+][C@H](C)c2ccncc2)CC1 ZINC000020121034 342969703 /nfs/dbraw/zinc/96/97/03/342969703.db2.gz DEADMMXTYIKYPA-GFCCVEGCSA-N 2 0 233.359 2.217 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CC[N@@H+]([C@@H]2CCc3ccc(F)cc32)C1 ZINC000351856984 136257963 /nfs/dbraw/zinc/25/79/63/136257963.db2.gz AHWCYIIWZQIXEX-JVLSTEMRSA-N 2 0 248.345 2.482 20 0 BEADRP CSCCCCC[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000235179010 342990002 /nfs/dbraw/zinc/99/00/02/342990002.db2.gz KQYHCJBEQRIMEK-NEPJUHHUSA-N 2 0 230.421 2.379 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@H]2CC[C@H](C[NH3+])CC2)[C@@H]1C ZINC000386277435 342994151 /nfs/dbraw/zinc/99/41/51/342994151.db2.gz QECFUBVFQRVDEK-KSTCHIGDSA-N 2 0 224.392 2.386 20 0 BEADRP COc1cc(C[N@@H+]2CCC[C@@H](C[NH3+])C2)ccc1C ZINC000261782248 536749243 /nfs/dbraw/zinc/74/92/43/536749243.db2.gz FOQOHDMNSYFFBO-AWEZNQCLSA-N 2 0 248.370 2.174 20 0 BEADRP C[C@H]1C[N@H+](Cc2ccc3c(c2)C[NH2+]CC3)C[C@H]1C ZINC000211967284 343017421 /nfs/dbraw/zinc/01/74/21/343017421.db2.gz RSSAORPTRDZZSI-BETUJISGSA-N 2 0 244.382 2.420 20 0 BEADRP C[C@H](F)CC[N@@H+]1CCC[C@@H](c2ncc[nH]2)C1 ZINC000351875404 136261063 /nfs/dbraw/zinc/26/10/63/136261063.db2.gz LPONVKOGHCQZDG-WDEREUQCSA-N 2 0 225.311 2.337 20 0 BEADRP FC(F)(F)[C@H]1CCC[C@H]([NH2+][C@H]2CC[NH2+]C2)C1 ZINC000521272162 259344720 /nfs/dbraw/zinc/34/47/20/259344720.db2.gz SJVXEZYSOZHYDR-GUBZILKMSA-N 2 0 236.281 2.059 20 0 BEADRP CCC(C)(C)[C@H](C)[NH2+][C@H]1CC[NH2+]C[C@H]1C ZINC000576862102 365705004 /nfs/dbraw/zinc/70/50/04/365705004.db2.gz IYVOWCWWWUSWBB-WOPDTQHZSA-N 2 0 212.381 2.399 20 0 BEADRP COCc1ccccc1C[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000093214619 343150996 /nfs/dbraw/zinc/15/09/96/343150996.db2.gz DDLVOUMZEQGFMK-GJZGRUSLSA-N 2 0 248.370 2.193 20 0 BEADRP C([NH2+]C1C2CC3CC(C2)CC1C3)C1CC[NH2+]CC1 ZINC000094009956 343151900 /nfs/dbraw/zinc/15/19/00/343151900.db2.gz IXKREQQVYQWOFF-UHFFFAOYSA-N 2 0 248.414 2.400 20 0 BEADRP CCc1ccc(C[N@@H+]2C[C@H](C[NH3+])C[C@@H]2C)s1 ZINC000126775306 343171575 /nfs/dbraw/zinc/17/15/75/343171575.db2.gz ZVZJRIJMNSQSRI-QWRGUYRKSA-N 2 0 238.400 2.480 20 0 BEADRP C[N@H+](CC[C@H]1CCC[NH2+]C1)CC1CCCC1 ZINC000082492424 136276705 /nfs/dbraw/zinc/27/67/05/136276705.db2.gz BUKQTFOEZZWWCK-CYBMUJFWSA-N 2 0 224.392 2.498 20 0 BEADRP [NH3+]C[C@@H]1CC[N@H+](Cc2cccc3ncccc23)C1 ZINC000634687522 343241834 /nfs/dbraw/zinc/24/18/34/343241834.db2.gz OGXOUMMLBWIDLU-LBPRGKRZSA-N 2 0 241.338 2.015 20 0 BEADRP C[C@@H]1C[C@@H]([NH3+])CN1Cc1cccc2ncccc12 ZINC000634688583 343248983 /nfs/dbraw/zinc/24/89/83/343248983.db2.gz WZOVCFVKJCJQAJ-DGCLKSJQSA-N 2 0 241.338 2.156 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@@H]2CCC[C@H]3C[C@H]32)CC1 ZINC000310126583 343297589 /nfs/dbraw/zinc/29/75/89/343297589.db2.gz XAJANBPRAOLWGC-RRFJBIMHSA-N 2 0 236.403 2.497 20 0 BEADRP CCC[C@@H]([NH2+]C[C@@H](O)C[N@H+](C)CC)C(C)(C)C ZINC000584061421 343309941 /nfs/dbraw/zinc/30/99/41/343309941.db2.gz KUHSWGITAFUXMT-CHWSQXEVSA-N 2 0 244.423 2.103 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CC[C@H](C)C2)C1 ZINC000070643329 343337953 /nfs/dbraw/zinc/33/79/53/343337953.db2.gz OKIIXYJIHKVQRS-YNEHKIRRSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1CC([NH2+]CC2([NH3+])CCC2)C[C@@H](C)C1 ZINC000335650675 136305142 /nfs/dbraw/zinc/30/51/42/136305142.db2.gz WIVCMTWVDOUSSX-QWRGUYRKSA-N 2 0 210.365 2.282 20 0 BEADRP Cc1cccc(CN[C@@H]2CCCC[NH2+]C2)c1 ZINC000335641521 136308432 /nfs/dbraw/zinc/30/84/32/136308432.db2.gz HACWXNZIJLUQDE-CQSZACIVSA-N 2 0 218.344 2.227 20 0 BEADRP Cc1cccc(CN[C@H]2CCCC[NH2+]C2)c1 ZINC000335641520 136308528 /nfs/dbraw/zinc/30/85/28/136308528.db2.gz HACWXNZIJLUQDE-AWEZNQCLSA-N 2 0 218.344 2.227 20 0 BEADRP C[C@H]1CCC[N@@H+]1CC[C@H]1CCCC[NH+]1C ZINC000335698429 136327963 /nfs/dbraw/zinc/32/79/63/136327963.db2.gz NYVUYONZBKVEBD-QWHCGFSZSA-N 2 0 210.365 2.345 20 0 BEADRP CC[C@H]1CCC[C@@H](C[N@H+]2C[C@H]3C[NH2+]C[C@H]3C2)C1 ZINC000394501531 259360453 /nfs/dbraw/zinc/36/04/53/259360453.db2.gz BHVMEHSVEQMXNE-LJISPDSOSA-N 2 0 236.403 2.354 20 0 BEADRP CC(C)(C)[C@H]1CC[N@H+](C[C@]2(C)CC[NH2+]C2)C1 ZINC000166299448 136331889 /nfs/dbraw/zinc/33/18/89/136331889.db2.gz HCTCUBLMJXWPCU-GXTWGEPZSA-N 2 0 224.392 2.354 20 0 BEADRP C[N@H+](CCC[NH3+])Cc1ccc(Cl)cc1 ZINC000042437687 343437968 /nfs/dbraw/zinc/43/79/68/343437968.db2.gz BBEHILRGQJNYCO-UHFFFAOYSA-N 2 0 212.724 2.121 20 0 BEADRP CSCCC[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C)C1 ZINC000247974716 136373547 /nfs/dbraw/zinc/37/35/47/136373547.db2.gz HQCHMDAGYCLRQX-QWHCGFSZSA-N 2 0 242.432 2.156 20 0 BEADRP CCC[C@H](C)C[NH+]1CCC([C@@H](C)[NH3+])CC1 ZINC000082474747 343444231 /nfs/dbraw/zinc/44/42/31/343444231.db2.gz YAGQGJQGNHFHEZ-NWDGAFQWSA-N 2 0 212.381 2.482 20 0 BEADRP CC[C@@H]([NH2+]CCC[NH+](CC)CC)C1CC1 ZINC000083054251 343475150 /nfs/dbraw/zinc/47/51/50/343475150.db2.gz RNMYOSFTTLGSCJ-CYBMUJFWSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@H]([NH2+]CCC[NH+](C)C)C1 ZINC000082857412 343468615 /nfs/dbraw/zinc/46/86/15/343468615.db2.gz RGFBZJNRYDIFLW-FRRDWIJNSA-N 2 0 212.381 2.352 20 0 BEADRP CC(C)(C)CC[N@@H+]1CC[C@@]2(CC[NH2+]C2)C1 ZINC000083987797 343513348 /nfs/dbraw/zinc/51/33/48/343513348.db2.gz JSEAHXSPSQCWPC-CYBMUJFWSA-N 2 0 210.365 2.108 20 0 BEADRP CC[C@H]1CC[C@H]1[NH2+]Cc1ccc(C[NH3+])cc1 ZINC000580552038 365758764 /nfs/dbraw/zinc/75/87/64/365758764.db2.gz LGTPDWKHXBTWPZ-UONOGXRCSA-N 2 0 218.344 2.424 20 0 BEADRP CCN1C[C@H]([NH2+]C[C@@H](C)C(C)C)[C@@H](C)C1 ZINC000379948009 365759959 /nfs/dbraw/zinc/75/99/59/365759959.db2.gz RRSAXNBVTYVVSY-AGIUHOORSA-N 2 0 212.381 2.208 20 0 BEADRP C[C@@H]1C[C@H](C)[N@H+](CCC2CCC2)C[C@@H]1C[NH3+] ZINC000398899098 488225631 /nfs/dbraw/zinc/22/56/31/488225631.db2.gz HDQKYRDYWUNLJW-DYEKYZERSA-N 2 0 224.392 2.482 20 0 BEADRP CC1(C)CCC[C@H]1[NH2+]C1CCC([NH3+])CC1 ZINC000086857270 343630360 /nfs/dbraw/zinc/63/03/60/343630360.db2.gz QOKNVVRHVGDENS-HTAVTVPLSA-N 2 0 210.365 2.425 20 0 BEADRP CC[N@H+](CCC[NH2+]C1CCCCC1)CCOC ZINC000053499748 1172035007 /nfs/dbraw/zinc/03/50/07/1172035007.db2.gz FGYSBOUSYOXLAK-UHFFFAOYSA-N 2 0 242.407 2.267 20 0 BEADRP C/C=C\C[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000384648555 343701837 /nfs/dbraw/zinc/70/18/37/343701837.db2.gz ABXPOWKYNNQWGV-QMEKQCQASA-N 2 0 208.349 2.073 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@@H](C[NH3+])C2)c(C)c1 ZINC000044527747 343781290 /nfs/dbraw/zinc/78/12/90/343781290.db2.gz BQWKCBZTLUAYJR-AWEZNQCLSA-N 2 0 232.371 2.474 20 0 BEADRP C=Cc1ccc(C[NH+]2CCC([NH3+])CC2)cc1 ZINC000409422036 343812905 /nfs/dbraw/zinc/81/29/05/343812905.db2.gz ABOLIPBHIQCJMT-UHFFFAOYSA-N 2 0 216.328 2.253 20 0 BEADRP C(C[NH2+][C@@H]1CC[C@H]1C1CC1)C[NH+]1CCCC1 ZINC000336650621 537819245 /nfs/dbraw/zinc/81/92/45/537819245.db2.gz DTUXKSVRIRVOSE-UONOGXRCSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H](C)c1cscn1 ZINC000570562630 323063109 /nfs/dbraw/zinc/06/31/09/323063109.db2.gz IEZBALPMFORWBE-ZJUUUORDSA-N 2 0 227.377 2.311 20 0 BEADRP [NH3+][C@]12CCC[C@@H]1C[N@H+](CCCc1ccccc1)C2 ZINC000621777905 343903396 /nfs/dbraw/zinc/90/33/96/343903396.db2.gz IOPNTWHDPAVJLJ-CVEARBPZSA-N 2 0 244.382 2.432 20 0 BEADRP Cc1ncccc1C[NH2+][C@H](C)C1CC[NH+](C)CC1 ZINC000396461947 347017734 /nfs/dbraw/zinc/01/77/34/347017734.db2.gz NDWXYURUOZFJIC-GFCCVEGCSA-N 2 0 247.386 2.210 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@@H]2CCOC2(C)C)CC1 ZINC000335661845 192068265 /nfs/dbraw/zinc/06/82/65/192068265.db2.gz WSSPTHJNADYOBG-CYBMUJFWSA-N 2 0 240.391 2.016 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]([NH2+][C@@H]2CCCSC2)C1 ZINC000634732596 344106566 /nfs/dbraw/zinc/10/65/66/344106566.db2.gz KANCFADFESWRDK-NWDGAFQWSA-N 2 0 242.432 2.250 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]([NH2+][C@@H]2CCCSC2)C1 ZINC000634732598 344106979 /nfs/dbraw/zinc/10/69/79/344106979.db2.gz KANCFADFESWRDK-VXGBXAGGSA-N 2 0 242.432 2.250 20 0 BEADRP Cc1ccncc1C[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000634733912 344114621 /nfs/dbraw/zinc/11/46/21/344114621.db2.gz QZZQXRNDJCAWBA-AWEZNQCLSA-N 2 0 247.386 2.258 20 0 BEADRP CCC[C@@H](C[NH2+]C[C@H]1CC[N@@H+](C(C)C)C1)OC ZINC000395209463 362348119 /nfs/dbraw/zinc/34/81/19/362348119.db2.gz UYAVHCMSMASGMU-KGLIPLIRSA-N 2 0 242.407 2.121 20 0 BEADRP C[NH+]1CCC(CC[NH2+][C@@H]2CC[C@H]2C2CC2)CC1 ZINC000348120212 537840486 /nfs/dbraw/zinc/84/04/86/537840486.db2.gz OXSWJFWANQTQIH-LSDHHAIUSA-N 2 0 236.403 2.497 20 0 BEADRP CC(C)N(C)CC[NH2+][C@@H]1CC[C@@H]1C1CC1 ZINC000336748709 537841652 /nfs/dbraw/zinc/84/16/52/537841652.db2.gz DOJZZCHRIYYPAE-CHWSQXEVSA-N 2 0 210.365 2.105 20 0 BEADRP CC[C@@H]1CCC[C@H]1[NH2+]CCCC[NH+](C)C ZINC000132997613 344310457 /nfs/dbraw/zinc/31/04/57/344310457.db2.gz ZQCQPLYNJYSMQL-CHWSQXEVSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000093210437 344311875 /nfs/dbraw/zinc/31/18/75/344311875.db2.gz JPLZWDBXRKWRSG-FRRDWIJNSA-N 2 0 236.359 2.460 20 0 BEADRP CC[C@H](C)C[N@H+](C)CC[C@H]([NH3+])C(C)C ZINC000133306317 344317847 /nfs/dbraw/zinc/31/78/47/344317847.db2.gz YEMUEODYKFDVIA-RYUDHWBXSA-N 2 0 200.370 2.338 20 0 BEADRP C[C@@H]1C[C@@H]([NH3+])CN1Cc1cccc2cccnc21 ZINC000385100195 344326550 /nfs/dbraw/zinc/32/65/50/344326550.db2.gz PCPBCOFNHSRUFR-BXUZGUMPSA-N 2 0 241.338 2.156 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]C[C@H]2C[C@H]2C)CC1 ZINC000132820595 344308250 /nfs/dbraw/zinc/30/82/50/344308250.db2.gz GCSCAFANFWBAIW-VXGBXAGGSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@H]1CC[C@H]1C1CC1 ZINC000336768392 537845484 /nfs/dbraw/zinc/84/54/84/537845484.db2.gz UPMIDBGBNVBCDK-WXHSDQCUSA-N 2 0 210.365 2.105 20 0 BEADRP CC[C@@H](C)CN(C)CC[NH2+]C(C)(C)C ZINC000042302602 344450318 /nfs/dbraw/zinc/45/03/18/344450318.db2.gz YPLHYDAFMOQWLO-LLVKDONJSA-N 2 0 200.370 2.352 20 0 BEADRP C[C@@H]1CSC[C@@H]1[NH2+]CC[C@H]1CCCC[N@@H+]1C ZINC000381039301 344472866 /nfs/dbraw/zinc/47/28/66/344472866.db2.gz BWNSUVUOUOLXLE-UPJWGTAASA-N 2 0 242.432 2.202 20 0 BEADRP CC[C@@H]1CCCC[C@H]1[NH2+][C@H](CCC[NH3+])COC ZINC000300025145 344514061 /nfs/dbraw/zinc/51/40/61/344514061.db2.gz QSVJVBPQHAWNKJ-MGPQQGTHSA-N 2 0 242.407 2.299 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@@H]2CC2(C)C)CC1 ZINC000045115412 344560319 /nfs/dbraw/zinc/56/03/19/344560319.db2.gz ZXLCLHCFNDDDGL-GFCCVEGCSA-N 2 0 210.365 2.247 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@H](F)C1)[C@@H]1CCC[NH2+]C1 ZINC000573967518 344580234 /nfs/dbraw/zinc/58/02/34/344580234.db2.gz SOZKQKOMJUXOMT-QNWHQSFQSA-N 2 0 228.355 2.245 20 0 BEADRP Cc1cc(C[NH2+]CCCC[NH3+])c(C)s1 ZINC000049686718 344682387 /nfs/dbraw/zinc/68/23/87/344682387.db2.gz COGQYVHGMVJZLV-UHFFFAOYSA-N 2 0 212.362 2.193 20 0 BEADRP CC[C@@H](c1ccc(F)cc1)N1CC[C@H]([NH3+])C1 ZINC000050227712 344744133 /nfs/dbraw/zinc/74/41/33/344744133.db2.gz CZQXXFJWHSPESL-STQMWFEESA-N 2 0 222.307 2.310 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000569616291 344683205 /nfs/dbraw/zinc/68/32/05/344683205.db2.gz QRIDRUZBTQCGNC-AEGPPILISA-N 2 0 236.403 2.495 20 0 BEADRP CSC[C@H]1CCC[N@@H+]1CC[C@H]1CCC[NH2+]C1 ZINC000399997683 344748816 /nfs/dbraw/zinc/74/88/16/344748816.db2.gz LJDNHOMCPUFNNE-CHWSQXEVSA-N 2 0 242.432 2.204 20 0 BEADRP CC(C)N(C)C[C@H](C)[NH2+][C@H]1CC[C@H](C)C1 ZINC000380182146 344707317 /nfs/dbraw/zinc/70/73/17/344707317.db2.gz GFJVJBADYYYHHX-AVGNSLFASA-N 2 0 212.381 2.493 20 0 BEADRP CC[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH3+] ZINC000039102033 344849958 /nfs/dbraw/zinc/84/99/58/344849958.db2.gz OXJYWERKFNGMGY-KGLIPLIRSA-N 2 0 218.344 2.246 20 0 BEADRP Cc1ccc([C@@H](C)C[N@H+]2C[C@H]3C[NH2+]C[C@H]3C2)cc1 ZINC000628191882 344946353 /nfs/dbraw/zinc/94/63/53/344946353.db2.gz YGSYAXSUPOHCLI-CWRNSKLLSA-N 2 0 244.382 2.250 20 0 BEADRP [NH3+]C[C@H]1CC[C@H]([NH2+]Cc2ccc(F)cc2F)C1 ZINC000583428568 344947151 /nfs/dbraw/zinc/94/71/51/344947151.db2.gz GSARZHMAHIBHAP-CABZTGNLSA-N 2 0 240.297 2.182 20 0 BEADRP CC(C)=CC[NH2+][C@H](C)C1CC[NH+](C)CC1 ZINC000235213980 537886577 /nfs/dbraw/zinc/88/65/77/537886577.db2.gz JAYKHBNXWOWAQS-GFCCVEGCSA-N 2 0 210.365 2.273 20 0 BEADRP CCN(CCC[NH+](C)C)c1cc[nH+]c(C)c1 ZINC000425254721 192085535 /nfs/dbraw/zinc/08/55/35/192085535.db2.gz MEYWABQZWPJMJT-UHFFFAOYSA-N 2 0 221.348 2.168 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CCCC(C)(F)F ZINC000390089563 323083539 /nfs/dbraw/zinc/08/35/39/323083539.db2.gz IGKGIACKIRRQPA-SECBINFHSA-N 2 0 208.296 2.139 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CCc2ccco2)[C@H](C)C1 ZINC000155952323 345116129 /nfs/dbraw/zinc/11/61/29/345116129.db2.gz OISFXISJZCXXBA-TZMCWYRMSA-N 2 0 236.359 2.142 20 0 BEADRP FC(F)(F)CC[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000156094249 345122101 /nfs/dbraw/zinc/12/21/01/345122101.db2.gz RZFHHEKWLBLFOH-ZJUUUORDSA-N 2 0 236.281 2.155 20 0 BEADRP CC1(C)CCCN(CC23CC(C2)C[NH2+]3)CC1 ZINC000634992819 345188329 /nfs/dbraw/zinc/18/83/29/345188329.db2.gz BNSXCBPPKJQSPF-UHFFFAOYSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@H](C[N@H+]1C[C@@H](C[NH3+])[C@H](C)C1)c1ccccc1 ZINC000634998517 345198482 /nfs/dbraw/zinc/19/84/82/345198482.db2.gz GRUJHXNJCMVDAF-UMVBOHGHSA-N 2 0 232.371 2.317 20 0 BEADRP C[C@H]1C[C@H](C[NH+]2CCC(CCF)CC2)CC[NH2+]1 ZINC000634998465 345198609 /nfs/dbraw/zinc/19/86/09/345198609.db2.gz GBBCKDFSQFJXIA-GXTWGEPZSA-N 2 0 242.382 2.446 20 0 BEADRP C[C@H](Cc1ccccc1)C[N@@H+]1C[C@H](C)[C@@H](C[NH3+])C1 ZINC000634999617 345200651 /nfs/dbraw/zinc/20/06/51/345200651.db2.gz WZXDXGJGOXAFRM-YCPHGPKFSA-N 2 0 246.398 2.392 20 0 BEADRP C[C@@H]1C[N@H+](C[C@H]2CCC[C@@H](C)C2)C[C@H]1C[NH3+] ZINC000634999735 345200661 /nfs/dbraw/zinc/20/06/61/345200661.db2.gz YKJLQUOWKUPZSJ-YIYPIFLZSA-N 2 0 224.392 2.339 20 0 BEADRP C[C@@H]1C[C@H](C[NH+]2CCC(C)(F)CC2)CC[NH2+]1 ZINC000635001529 345201210 /nfs/dbraw/zinc/20/12/10/345201210.db2.gz CHZWJQQEWKSVFP-VXGBXAGGSA-N 2 0 228.355 2.199 20 0 BEADRP C[C@@H]([NH2+]Cc1cccc2c1CC[NH2+]C2)[C@@H]1C[C@H]1C ZINC000635002898 345205385 /nfs/dbraw/zinc/20/53/85/345205385.db2.gz AYSPRIQVLVUVIC-XHBSWPGZSA-N 2 0 244.382 2.466 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)c1ccccn1 ZINC000635003671 345206941 /nfs/dbraw/zinc/20/69/41/345206941.db2.gz ARALWFUIFVXNDB-JHJVBQTASA-N 2 0 233.359 2.250 20 0 BEADRP C1CC12CCC[C@H]2[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000635004435 345207722 /nfs/dbraw/zinc/20/77/22/345207722.db2.gz OKPUQSCNJGZVHD-ZGVCCVRISA-N 2 0 220.360 2.192 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+][C@@H]1CCCC12CC2 ZINC000635004306 345207753 /nfs/dbraw/zinc/20/77/53/345207753.db2.gz OGBBHHGKVYFOSK-QJPTWQEYSA-N 2 0 208.349 2.036 20 0 BEADRP CC(C)(F)C[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000635006498 345210804 /nfs/dbraw/zinc/21/08/04/345210804.db2.gz YWAONWNFLDVRLK-SDDRHHMPSA-N 2 0 228.355 2.245 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CC[C@@H]1CNc2ccccc21 ZINC000635010079 345211920 /nfs/dbraw/zinc/21/19/20/345211920.db2.gz XYXZJZPIJCJWOG-YNEHKIRRSA-N 2 0 247.386 2.301 20 0 BEADRP COCCC[C@H](C)[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000635010541 345212730 /nfs/dbraw/zinc/21/27/30/345212730.db2.gz KCJPBQAVPDBFGF-STQMWFEESA-N 2 0 242.407 2.169 20 0 BEADRP C[C@H](CC1CCC1)[NH2+][C@H](C)[C@@H]1CCC[NH2+]1 ZINC000635011371 345213811 /nfs/dbraw/zinc/21/38/11/345213811.db2.gz FBUAJSQSXDRHFU-WZRBSPASSA-N 2 0 210.365 2.295 20 0 BEADRP CC(C)[C@H](C)[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000635012631 345214554 /nfs/dbraw/zinc/21/45/54/345214554.db2.gz UUFYOVUJMJSHED-NWDGAFQWSA-N 2 0 212.381 2.399 20 0 BEADRP COC[C@@H]([NH2+][C@@H]1CC[NH2+]CC(C)(C)C1)C(C)C ZINC000635009253 345216902 /nfs/dbraw/zinc/21/69/02/345216902.db2.gz GOGVGIBIIOSHNN-CHWSQXEVSA-N 2 0 242.407 2.025 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]Cc1ccc2cccnc2c1 ZINC000635020084 345223045 /nfs/dbraw/zinc/22/30/45/345223045.db2.gz JPJUARNHGKMZPP-RYUDHWBXSA-N 2 0 243.354 2.450 20 0 BEADRP Cc1scc(C[NH2+][C@H](C)C2C[NH2+]C2)c1C ZINC000635020565 345223611 /nfs/dbraw/zinc/22/36/11/345223611.db2.gz MALULPHFFSUKFQ-SECBINFHSA-N 2 0 224.373 2.062 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+]CCc2cccc(C)c2)C1 ZINC000449089289 201806682 /nfs/dbraw/zinc/80/66/82/201806682.db2.gz JSYONNPVYLXHHP-INIZCTEOSA-N 2 0 246.398 2.469 20 0 BEADRP CCOC(C)(C)C[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@@H]1C ZINC000159172503 345413510 /nfs/dbraw/zinc/41/35/10/345413510.db2.gz YATGETYOJXOGMW-YNEHKIRRSA-N 2 0 242.407 2.120 20 0 BEADRP CC[NH+]1CCC([NH2+]CCCCOC(C)C)CC1 ZINC000228812341 345400003 /nfs/dbraw/zinc/40/00/03/345400003.db2.gz YVPMYIURIILAKG-UHFFFAOYSA-N 2 0 242.407 2.266 20 0 BEADRP CC(C)(Nc1ncnc2[nH]ccc21)c1ncc[nH]1 ZINC000641663191 362586677 /nfs/dbraw/zinc/58/66/77/362586677.db2.gz QBXFUQWVCZLZAD-UHFFFAOYSA-N 2 0 242.286 2.028 20 0 BEADRP CC(C)[N@@H+]1CC[C@H](C[NH2+]CC2(C)CC2)C1 ZINC000380295990 345469832 /nfs/dbraw/zinc/46/98/32/345469832.db2.gz CRWGXPQTHBWECT-GFCCVEGCSA-N 2 0 210.365 2.106 20 0 BEADRP CC1CCC([NH2+][C@H]2CCN(C)C[C@H]2C)CC1 ZINC000089555127 345560781 /nfs/dbraw/zinc/56/07/81/345560781.db2.gz QTHTYBOOMWTMBM-HHTDUIENSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]CCCC(C)(F)F ZINC000390243274 259383435 /nfs/dbraw/zinc/38/34/35/259383435.db2.gz PEORAJNBMCRFOP-WDEREUQCSA-N 2 0 234.334 2.352 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]CCCC(C)(F)F ZINC000390243268 259383726 /nfs/dbraw/zinc/38/37/26/259383726.db2.gz PEORAJNBMCRFOP-MNOVXSKESA-N 2 0 234.334 2.352 20 0 BEADRP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]CCCC(C)(F)F ZINC000390243270 259383811 /nfs/dbraw/zinc/38/38/11/259383811.db2.gz PEORAJNBMCRFOP-QWRGUYRKSA-N 2 0 234.334 2.352 20 0 BEADRP C[C@H]1CC[N@H+](CCC[NH+]2CCCCC2)C1 ZINC000137675897 345685194 /nfs/dbraw/zinc/68/51/94/345685194.db2.gz KBOBVPBQYQBLRQ-ZDUSSCGKSA-N 2 0 210.365 2.204 20 0 BEADRP C[C@@H]1CC[NH+](CCC[N@H+]2CC[C@@H](C)C2)C1 ZINC000146473688 345713868 /nfs/dbraw/zinc/71/38/68/345713868.db2.gz JSFSIQWVRIGBLS-CHWSQXEVSA-N 2 0 210.365 2.060 20 0 BEADRP CCCC[NH2+][C@@H](Cc1ccccc1)[C@H](C)[NH3+] ZINC000201263814 345729504 /nfs/dbraw/zinc/72/95/04/345729504.db2.gz RJOHFBHGRAQINE-JSGCOSHPSA-N 2 0 220.360 2.335 20 0 BEADRP [NH3+]CC1CC[NH+](C[C@@H]2C[C@H]2c2ccccc2)CC1 ZINC000204078867 345731871 /nfs/dbraw/zinc/73/18/71/345731871.db2.gz IIIAKYGEIKBFHQ-HOTGVXAUSA-N 2 0 244.382 2.461 20 0 BEADRP CCC[C@H](C)C[NH+]1CCC(C[NH2+]C)CC1 ZINC000051756235 346007684 /nfs/dbraw/zinc/00/76/84/346007684.db2.gz WCPPSLQUJHXVQI-LBPRGKRZSA-N 2 0 212.381 2.354 20 0 BEADRP CC(C)SCC[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000401019067 346033525 /nfs/dbraw/zinc/03/35/25/346033525.db2.gz JYCDEZXYUUMTTG-JHJVBQTASA-N 2 0 242.432 2.106 20 0 BEADRP CC(C)SCC[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000401019071 346033588 /nfs/dbraw/zinc/03/35/88/346033588.db2.gz JYCDEZXYUUMTTG-RWMBFGLXSA-N 2 0 242.432 2.106 20 0 BEADRP CCOC[C@H]1CC[N@H+](CCC[NH+](CC)CC)C1 ZINC000191803836 346064704 /nfs/dbraw/zinc/06/47/04/346064704.db2.gz STFGWMXFPZFRPY-AWEZNQCLSA-N 2 0 242.407 2.077 20 0 BEADRP C([NH2+]C1CC[NH+](CC2CC2)CC1)[C@@H]1C[C@H]1C1CC1 ZINC000574897878 346147982 /nfs/dbraw/zinc/14/79/82/346147982.db2.gz FYDWQHYTJUCREZ-HOCLYGCPSA-N 2 0 248.414 2.497 20 0 BEADRP Cc1ccccc1[C@H](C)[NH+]1C[C@H]2C[NH2+]C[C@@H]2C1 ZINC000090320071 537956479 /nfs/dbraw/zinc/95/64/79/537956479.db2.gz NZDSDZBHTWOTNB-BFHYXJOUSA-N 2 0 230.355 2.207 20 0 BEADRP C[NH+](C)CCC[N@H+](C)C[C@]1(C)CCCS1 ZINC000628277193 346286009 /nfs/dbraw/zinc/28/60/09/346286009.db2.gz GYRURWQGEWQLDM-LBPRGKRZSA-N 2 0 230.421 2.156 20 0 BEADRP CCCN(CCC[NH+](C)C)Cc1cnc(C)o1 ZINC000628279989 346291009 /nfs/dbraw/zinc/29/10/09/346291009.db2.gz KJBVFUICHVWYHO-UHFFFAOYSA-N 2 0 239.363 2.147 20 0 BEADRP C[C@@H]1CCC[N@H+](C[C@@H]2CCCC[NH2+]C2)[C@@H]1C ZINC000669378553 537968851 /nfs/dbraw/zinc/96/88/51/537968851.db2.gz GODLHYWPBQHANE-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1cccc(C[NH+]2CCC(C[NH3+])CC2)c1C ZINC000044512383 179074637 /nfs/dbraw/zinc/07/46/37/179074637.db2.gz YWMHSTVHZNVIMX-UHFFFAOYSA-N 2 0 232.371 2.474 20 0 BEADRP C[C@H]([NH3+])c1ccc(N[C@@H]2CCC[C@@H]([NH3+])C2)cc1 ZINC000574927209 346415785 /nfs/dbraw/zinc/41/57/85/346415785.db2.gz AABRFTRHNPCYQS-ZKYQVNSYSA-N 2 0 233.359 2.388 20 0 BEADRP Cc1cccc(C[N@H+]2CC[C@@H]([C@@H](C)[NH3+])C2)c1C ZINC000126889262 179079702 /nfs/dbraw/zinc/07/97/02/179079702.db2.gz ZFEKOWXRNGNBGA-UKRRQHHQSA-N 2 0 232.371 2.473 20 0 BEADRP Cc1cccc(C[N@H+]2CC[C@@H](C[NH+](C)C)C2)c1 ZINC000172197620 179079873 /nfs/dbraw/zinc/07/98/73/179079873.db2.gz RAERSHMHUOYUKT-HNNXBMFYSA-N 2 0 232.371 2.379 20 0 BEADRP Cc1cccc(C[N@@H+]2CC[C@@H]([NH3+])[C@@H](C)C2)c1C ZINC000227054614 179080063 /nfs/dbraw/zinc/08/00/63/179080063.db2.gz NAHHXYBJRFSNQO-SWLSCSKDSA-N 2 0 232.371 2.473 20 0 BEADRP Cc1cccc(C[N@@H+]2CC[C@H]([NH3+])[C@H](C)C2)c1 ZINC000049712993 179083168 /nfs/dbraw/zinc/08/31/68/179083168.db2.gz BHYVJULQJQUVOV-OCCSQVGLSA-N 2 0 218.344 2.164 20 0 BEADRP CC(C)C[C@H](C)C[NH2+][C@@H]1C[C@H]([NH3+])C1(C)C ZINC000641804249 362761344 /nfs/dbraw/zinc/76/13/44/362761344.db2.gz XDAKJJPMQDUGET-SDDRHHMPSA-N 2 0 212.381 2.384 20 0 BEADRP CC1(C)CC(C[NH2+][C@H]2C[C@@H]([NH3+])C2(C)C)C1 ZINC000641801231 362755604 /nfs/dbraw/zinc/75/56/04/362755604.db2.gz OCCJLIVAIPHKQZ-MNOVXSKESA-N 2 0 210.365 2.138 20 0 BEADRP CC1(C)c2ccccc2CC[N@H+]1CCC[NH3+] ZINC000641801726 362756678 /nfs/dbraw/zinc/75/66/78/362756678.db2.gz UESIHHUPWWOBKY-UHFFFAOYSA-N 2 0 218.344 2.129 20 0 BEADRP C[C@@H](c1cccnc1)[NH+]1CCC(CC[NH3+])CC1 ZINC000070183398 349967269 /nfs/dbraw/zinc/96/72/69/349967269.db2.gz NCYOIWGJBRIQQK-LBPRGKRZSA-N 2 0 233.359 2.203 20 0 BEADRP CC(C)C[C@@H]([NH3+])CN1C[C@@H](C)S[C@@H](C)C1 ZINC000069910055 349968717 /nfs/dbraw/zinc/96/87/17/349968717.db2.gz BUKFEYJWBWULMS-GRYCIOLGSA-N 2 0 230.421 2.186 20 0 BEADRP Cc1cccnc1CN1[C@H](C)[C@H](C)CC[C@H]1C[NH3+] ZINC000641809490 362766217 /nfs/dbraw/zinc/76/62/17/362766217.db2.gz QQADHQOFYCWAET-BNOWGMLFSA-N 2 0 247.386 2.338 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+]C1CCOCC1 ZINC000036303974 346658423 /nfs/dbraw/zinc/65/84/23/346658423.db2.gz NOCISYQKUCOJKV-ZDUSSCGKSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@H](C[NH2+][C@H](C)C1CCC1)C[NH+]1CCCC1 ZINC000178243743 346662594 /nfs/dbraw/zinc/66/25/94/346662594.db2.gz PCIZFYCSEUEDIC-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@@H]1C[C@@H](C)O[C@@H](C)C1 ZINC000300414166 346669411 /nfs/dbraw/zinc/66/94/11/346669411.db2.gz IOKHAGJBIWOBEY-BTTYYORXSA-N 2 0 242.407 2.262 20 0 BEADRP CC(C)C[C@@H](C)[NH2+]CCN1CC[C@@H](C)C1 ZINC000380065014 365837612 /nfs/dbraw/zinc/83/76/12/365837612.db2.gz BVCDBQFCCWIOAL-CHWSQXEVSA-N 2 0 212.381 2.352 20 0 BEADRP CC[C@H](C)[N@@H+]1CC[C@H](c2nccn2C)C1 ZINC000580211795 346685348 /nfs/dbraw/zinc/68/53/48/346685348.db2.gz JRYRTROLTPEAIO-QWRGUYRKSA-N 2 0 207.321 2.008 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000319427744 259393782 /nfs/dbraw/zinc/39/37/82/259393782.db2.gz PMVFOOWVJFEGOH-QSLWVIQJSA-N 2 0 224.392 2.399 20 0 BEADRP Cc1cccc(OCC[NH2+][C@H](C)CCC[NH3+])c1 ZINC000336672568 179167848 /nfs/dbraw/zinc/16/78/48/179167848.db2.gz BFSIGQSCNJYQCY-CYBMUJFWSA-N 2 0 236.359 2.091 20 0 BEADRP Cc1cccc(OCC[NH2+]C2CCC([NH3+])CC2)c1 ZINC000094088424 179168452 /nfs/dbraw/zinc/16/84/52/179168452.db2.gz CFUPIKBUKDQMDE-UHFFFAOYSA-N 2 0 248.370 2.233 20 0 BEADRP C[C@H](C[N@@H+]1C[C@H]2CCC[C@@]2([NH3+])C1)C(C)(C)C ZINC000622004563 370655636 /nfs/dbraw/zinc/65/56/36/370655636.db2.gz QMBUBOVJDSBGKU-YRGRVCCFSA-N 2 0 224.392 2.482 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]Cc2ccc3c(c2)COC3)C1 ZINC000577204756 365877527 /nfs/dbraw/zinc/87/75/27/365877527.db2.gz IFJPBQVIMMEKTK-CABCVRRESA-N 2 0 246.354 2.076 20 0 BEADRP Cc1cccc([C@@H](C)[N@@H+]2CC[C@@H](C[NH3+])C2)c1 ZINC000251201747 179180251 /nfs/dbraw/zinc/18/02/51/179180251.db2.gz UQMWVBRNPKQUTF-OLZOCXBDSA-N 2 0 218.344 2.337 20 0 BEADRP Cc1cccc([C@H](C)N2CCC[C@@H]([NH3+])C2)c1 ZINC000251183984 179193186 /nfs/dbraw/zinc/19/31/86/179193186.db2.gz JCYOGLULNHMTGV-GXTWGEPZSA-N 2 0 218.344 2.479 20 0 BEADRP Cc1cccc([C@H](C)[NH2+][C@H]2CCN(C)C2)c1 ZINC000042545814 179197470 /nfs/dbraw/zinc/19/74/70/179197470.db2.gz RCKBNSQSWSVBMR-JSGCOSHPSA-N 2 0 218.344 2.350 20 0 BEADRP C[NH2+]CC1CC[NH+](CCCC(C)C)CC1 ZINC000165423589 133658931 /nfs/dbraw/zinc/65/89/31/133658931.db2.gz VEVRCDNBVKILCN-UHFFFAOYSA-N 2 0 212.381 2.354 20 0 BEADRP Cc1ccc(CCC[NH2+]CCCC[NH+](C)C)cn1 ZINC000354211461 187374316 /nfs/dbraw/zinc/37/43/16/187374316.db2.gz NDUZRDOLQHWDPY-UHFFFAOYSA-N 2 0 249.402 2.254 20 0 BEADRP Cc1ccc(CN(C)[C@H](C)C[NH3+])cc1C ZINC000020226767 347430734 /nfs/dbraw/zinc/43/07/34/347430734.db2.gz OPRBNDCEPWHJTK-GFCCVEGCSA-N 2 0 206.333 2.082 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+]C[C@H]1CCCC1(C)C ZINC000388512080 347437083 /nfs/dbraw/zinc/43/70/83/347437083.db2.gz VSGSQZLDSIEOGX-CHWSQXEVSA-N 2 0 242.407 2.156 20 0 BEADRP [NH3+][C@H]1CCCCC[C@H]1[NH2+]CCOCC1CCC1 ZINC000577214613 365883808 /nfs/dbraw/zinc/88/38/08/365883808.db2.gz PTUSFNQEOBHVDD-UONOGXRCSA-N 2 0 240.391 2.053 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H]1CCC[C@@H]1C1CC1 ZINC000577214409 365883936 /nfs/dbraw/zinc/88/39/36/365883936.db2.gz NBBFFGYFCBTARP-OLZOCXBDSA-N 2 0 210.365 2.154 20 0 BEADRP Cc1nc(C)c([C@H](C)[NH2+]C[C@H](C)C[NH3+])s1 ZINC000054345902 347771014 /nfs/dbraw/zinc/77/10/14/347771014.db2.gz YSEXKBLJRHFAAW-SFYZADRCSA-N 2 0 227.377 2.005 20 0 BEADRP C[C@@H](Cc1ccco1)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000054241422 1172096226 /nfs/dbraw/zinc/09/62/26/1172096226.db2.gz FVKWUGHAEUDXPK-QWHCGFSZSA-N 2 0 236.359 2.142 20 0 BEADRP Cc1ccccc1[C@@H]1CCC[N@@H+]1CCOCC[NH3+] ZINC000357076466 179329045 /nfs/dbraw/zinc/32/90/45/179329045.db2.gz OXFOCOZUOQYWKB-HNNXBMFYSA-N 2 0 248.370 2.107 20 0 BEADRP CC[C@@H](C)C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000054466857 348020076 /nfs/dbraw/zinc/02/00/76/348020076.db2.gz HNSQLEUDVURXFO-ODWCKFRGSA-N 2 0 210.365 2.247 20 0 BEADRP C[NH+](C)CC1CC[NH+](CC2CCCC2)CC1 ZINC000202465997 348021142 /nfs/dbraw/zinc/02/11/42/348021142.db2.gz GQVMIUCQNJRLDK-UHFFFAOYSA-N 2 0 224.392 2.450 20 0 BEADRP CCSCC[NH2+][C@@H]1CCCN2CCCC[C@H]12 ZINC000594611916 348082301 /nfs/dbraw/zinc/08/23/01/348082301.db2.gz PGXTYLZATNFFGA-CHWSQXEVSA-N 2 0 242.432 2.346 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]CCOC(C)(C)C ZINC000308722981 323177304 /nfs/dbraw/zinc/17/73/04/323177304.db2.gz FBDIXWRTDBIDFR-JHJVBQTASA-N 2 0 242.407 2.120 20 0 BEADRP C[C@H](CSCCF)[NH2+][C@@H](C)CC[NH+](C)C ZINC000595018011 348170665 /nfs/dbraw/zinc/17/06/65/348170665.db2.gz ZMHSDIRHXFVIJF-WDEREUQCSA-N 2 0 236.400 2.007 20 0 BEADRP C[C@@H](CSCCF)[NH2+]CCCC[NH+](C)C ZINC000595012969 348185314 /nfs/dbraw/zinc/18/53/14/348185314.db2.gz HAQZOZYAUKSPSQ-NSHDSACASA-N 2 0 236.400 2.009 20 0 BEADRP Cc1cccnc1CC[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000296382286 179371429 /nfs/dbraw/zinc/37/14/29/179371429.db2.gz JQWKJMLGFQLPJP-KBPBESRZSA-N 2 0 247.386 2.005 20 0 BEADRP Cc1cccnc1C[NH+]1CCC(C[NH+](C)C)CC1 ZINC000357303155 179374254 /nfs/dbraw/zinc/37/42/54/179374254.db2.gz IANPNMRLZKUCJX-UHFFFAOYSA-N 2 0 247.386 2.164 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H]2CCS[C@@H]2C)CC1 ZINC000220841447 490149839 /nfs/dbraw/zinc/14/98/39/490149839.db2.gz KMMAYQOGBVTJCW-DGCLKSJQSA-N 2 0 242.432 2.344 20 0 BEADRP COCCCC[N@H+](C)CCC[NH+]1CCCCC1 ZINC000419378087 192132624 /nfs/dbraw/zinc/13/26/24/192132624.db2.gz CONSYYJJANNYAH-UHFFFAOYSA-N 2 0 242.407 2.221 20 0 BEADRP CSCC1(CC[NH2+][C@H]2CCC[C@@H]2C[NH3+])CC1 ZINC000596648940 348604358 /nfs/dbraw/zinc/60/43/58/348604358.db2.gz BOEUWFLMZBKRME-NEPJUHHUSA-N 2 0 242.432 2.237 20 0 BEADRP CCSC1(C[NH2+][C@@H]2CC[NH2+]CC[C@@H]2C)CC1 ZINC000596650117 348605498 /nfs/dbraw/zinc/60/54/98/348605498.db2.gz GURNUVWSIHAHOM-NWDGAFQWSA-N 2 0 242.432 2.250 20 0 BEADRP CCSC1(C[NH2+][C@H]2CCC[C@H]([NH3+])C2)CC1 ZINC000596652891 348607046 /nfs/dbraw/zinc/60/70/46/348607046.db2.gz QNRCQODGEVXXOY-QWRGUYRKSA-N 2 0 228.405 2.132 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+]C[C@H]2CCSC2)CC1(C)C ZINC000623510000 362935482 /nfs/dbraw/zinc/93/54/82/362935482.db2.gz BJPLQZVDMYWHDQ-VXGBXAGGSA-N 2 0 242.432 2.202 20 0 BEADRP CCC[C@@H](CC)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000054243865 348961086 /nfs/dbraw/zinc/96/10/86/348961086.db2.gz OQXXNDPFBGVMLY-CHWSQXEVSA-N 2 0 212.381 2.497 20 0 BEADRP CC[C@H](C)C[NH2+][C@@H]1CC[N@H+](C)[C@@H]2CCC[C@@H]21 ZINC000421873256 192398145 /nfs/dbraw/zinc/39/81/45/192398145.db2.gz HHIUTPUKYSLNGT-REWJHTLYSA-N 2 0 224.392 2.495 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CSC2(C)C)CC1(C)C ZINC000623516295 362940559 /nfs/dbraw/zinc/94/05/59/362940559.db2.gz LVMNBSJQJPTDOK-WDEREUQCSA-N 2 0 242.432 2.343 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@H]2CSC2(C)C)CC1(C)C ZINC000623516294 362940768 /nfs/dbraw/zinc/94/07/68/362940768.db2.gz LVMNBSJQJPTDOK-QWRGUYRKSA-N 2 0 242.432 2.343 20 0 BEADRP C[C@H]1CC[C@H]([NH2+][C@H]2CCC[C@H]([NH3+])C2)CC1 ZINC000253117809 349224598 /nfs/dbraw/zinc/22/45/98/349224598.db2.gz GUBGSODFOXBQMU-CYDGBPFRSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CC1(C)C)C1CC[NH+](C)CC1 ZINC000222050619 490233901 /nfs/dbraw/zinc/23/39/01/490233901.db2.gz DBINLTSRQDAGHT-AAEUAGOBSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H](c1ccncc1)[NH+]1CCC(C[NH+](C)C)CC1 ZINC000601526228 349297766 /nfs/dbraw/zinc/29/77/66/349297766.db2.gz IVNMMXAXBOLJRI-ZDUSSCGKSA-N 2 0 247.386 2.416 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000388623664 349274408 /nfs/dbraw/zinc/27/44/08/349274408.db2.gz HZXHLGKKUQGSRF-VOAKCMCISA-N 2 0 210.365 2.425 20 0 BEADRP CC[C@@H]1CCC[C@H]1[NH2+]CC1CC[NH2+]CC1 ZINC000388633899 349279271 /nfs/dbraw/zinc/27/92/71/349279271.db2.gz LWKTZYDLVDBDGJ-CHWSQXEVSA-N 2 0 210.365 2.154 20 0 BEADRP CSC1CC[NH+](C[C@H]2CC[NH2+][C@H](C)C2)CC1 ZINC000300919441 349429618 /nfs/dbraw/zinc/42/96/18/349429618.db2.gz YOKWRRGPALXOHK-NEPJUHHUSA-N 2 0 242.432 2.202 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H](C[NH2+]C(C2CC2)C2CC2)C1 ZINC000070503287 350016252 /nfs/dbraw/zinc/01/62/52/350016252.db2.gz AVKOCTOAVCRCAO-ZWNOBZJWSA-N 2 0 222.376 2.282 20 0 BEADRP Cc1sccc1C[NH2+]C[C@@H]1CCC[N@@H+](C)C1 ZINC000380982789 350106427 /nfs/dbraw/zinc/10/64/27/350106427.db2.gz IYNDMOQTYUKKRL-LBPRGKRZSA-N 2 0 238.400 2.488 20 0 BEADRP Cc1nc([C@@H](C)[NH2+]C2CCC([NH3+])CC2)cs1 ZINC000051693998 180034188 /nfs/dbraw/zinc/03/41/88/180034188.db2.gz GPGIYESHMIAEAT-MFAVDMRSSA-N 2 0 239.388 2.372 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]C[C@H]1CCCSC1 ZINC000384029353 350124560 /nfs/dbraw/zinc/12/45/60/350124560.db2.gz BRQAFALETJUUNW-FRRDWIJNSA-N 2 0 242.432 2.237 20 0 BEADRP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]CCc1cccs1 ZINC000132115799 191025877 /nfs/dbraw/zinc/02/58/77/191025877.db2.gz TWTGHOCNHXNVQK-AAEUAGOBSA-N 2 0 238.400 2.220 20 0 BEADRP CC[C@@H]([NH2+][C@@H](C)CC[NH+](C)C)C1CCOCC1 ZINC000532491504 323268902 /nfs/dbraw/zinc/26/89/02/323268902.db2.gz BSNHVBIHFSELJS-GXTWGEPZSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[C@@H](C)C[C@H]1C)C1C[NH2+]C1 ZINC000422737340 192447832 /nfs/dbraw/zinc/44/78/32/192447832.db2.gz XJVBIDQZJJVKAO-DCQANWLSSA-N 2 0 210.365 2.009 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH2+][C@@H]2CCC[C@H]3C[C@H]32)C1 ZINC000304531846 350161943 /nfs/dbraw/zinc/16/19/43/350161943.db2.gz HBHQISNRUMLMLV-IGQOVBAYSA-N 2 0 222.376 2.106 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCC[C@H]3C[C@H]32)C1 ZINC000304531852 350162537 /nfs/dbraw/zinc/16/25/37/350162537.db2.gz HBHQISNRUMLMLV-XJFOESAGSA-N 2 0 222.376 2.106 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)nc1C ZINC000313915498 350165472 /nfs/dbraw/zinc/16/54/72/350165472.db2.gz JPXMPFYUZYVRIL-OLZOCXBDSA-N 2 0 233.359 2.058 20 0 BEADRP Cc1ncc(CN[C@@H]2CC[N@H+](C)[C@H](C)C2)s1 ZINC000090720780 180155675 /nfs/dbraw/zinc/15/56/75/180155675.db2.gz JHGWWOMRUAEPCI-MWLCHTKSSA-N 2 0 239.388 2.024 20 0 BEADRP C([NH2+]C1CCCCC1)[C@H]1CC[N@@H+](C2CC2)C1 ZINC000037408431 191069461 /nfs/dbraw/zinc/06/94/61/191069461.db2.gz GFESZKCNCXKDAE-GFCCVEGCSA-N 2 0 222.376 2.393 20 0 BEADRP Cc1[nH+]ccc(NCCCC[NH3+])c1Cl ZINC000308654219 180199506 /nfs/dbraw/zinc/19/95/06/180199506.db2.gz MJKABEJMNACYOS-UHFFFAOYSA-N 2 0 213.712 2.194 20 0 BEADRP Cc1nccc(NC[C@H]2CC[N@@H+](CC(C)C)C2)n1 ZINC000130658386 180201837 /nfs/dbraw/zinc/20/18/37/180201837.db2.gz ZKTYFOWSCLRXBB-CYBMUJFWSA-N 2 0 248.374 2.175 20 0 BEADRP Cc1nccn1CCCC[N@H+]1C[C@H](C)[C@H]1C ZINC000339570158 180236068 /nfs/dbraw/zinc/23/60/68/180236068.db2.gz QKMLIGCVFMANJA-NWDGAFQWSA-N 2 0 221.348 2.312 20 0 BEADRP CCCC[C@H](COC)[NH2+]C1CCC(C[NH3+])CC1 ZINC000422762216 192457541 /nfs/dbraw/zinc/45/75/41/192457541.db2.gz SCXCREXFUBCEHE-JXQTWKCFSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H]1CCc2ccccc2C1 ZINC000422759478 192458157 /nfs/dbraw/zinc/45/81/57/192458157.db2.gz PGHQQDXYZSLXCJ-SLEUVZQESA-N 2 0 232.371 2.259 20 0 BEADRP CO[C@@H]1CCCC[C@@H]1[NH2+][C@@H](C)CCCC[NH3+] ZINC000422783445 192465346 /nfs/dbraw/zinc/46/53/46/192465346.db2.gz HLARJZUWOGBQBA-RWMBFGLXSA-N 2 0 228.380 2.051 20 0 BEADRP CC(C)(CCO)C[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000227904900 191096277 /nfs/dbraw/zinc/09/62/77/191096277.db2.gz QBNPWQQSKLCIHN-ZIAGYGMSSA-N 2 0 248.370 2.129 20 0 BEADRP Cc1cc(N[C@@H]2CC[N@@H+]3CCC[C@@H]3C2)cc[nH+]1 ZINC000162812159 350438330 /nfs/dbraw/zinc/43/83/30/350438330.db2.gz POBXYQPNWNRYIN-ZIAGYGMSSA-N 2 0 231.343 2.429 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+][C@H]2CCOC2(C)C)CC1(C)C ZINC000623537451 362956822 /nfs/dbraw/zinc/95/68/22/362956822.db2.gz YKSCGTVDUBYYDO-NEPJUHHUSA-N 2 0 240.391 2.016 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623538882 362958031 /nfs/dbraw/zinc/95/80/31/362958031.db2.gz YJKFTNWRIBNSHD-FRRDWIJNSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1SCC[C@@H]1[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000300333417 490556906 /nfs/dbraw/zinc/55/69/06/490556906.db2.gz MJFNSLXGICIUJR-RNJOBUHISA-N 2 0 240.416 2.097 20 0 BEADRP C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C1CCCC1 ZINC000054603352 1172129316 /nfs/dbraw/zinc/12/93/16/1172129316.db2.gz BFRRNUNNNSQYPI-VGPLMAKISA-N 2 0 208.349 2.144 20 0 BEADRP C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CCc1ccccc1 ZINC000054603324 1172129980 /nfs/dbraw/zinc/12/99/80/1172129980.db2.gz QISYPVCTDYOBKY-MQVJKMGUSA-N 2 0 244.382 2.444 20 0 BEADRP CC1(C)CC[C@@H]([NH2+][C@@H]2CCC[NH2+]CC2)C1 ZINC000128606721 490583090 /nfs/dbraw/zinc/58/30/90/490583090.db2.gz QOJIGNUDMVFBJB-VXGBXAGGSA-N 2 0 210.365 2.297 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000336656660 350614793 /nfs/dbraw/zinc/61/47/93/350614793.db2.gz LQAQQZDOWKKFFV-YPMHNXCESA-N 2 0 222.376 2.249 20 0 BEADRP C[C@@H]1C[C@@H](C[NH3+])C[N@@H+]1C[C@H]1CCCC[C@H]1C ZINC000346689622 365992263 /nfs/dbraw/zinc/99/22/63/365992263.db2.gz ZQPUSVQSLFJNHX-YIYPIFLZSA-N 2 0 224.392 2.482 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[N@@H+]1CCC[C@H]2C[NH2+]C[C@H]21 ZINC000394839629 350922419 /nfs/dbraw/zinc/92/24/19/350922419.db2.gz TWXGJKOMDVDABX-LXTVHRRPSA-N 2 0 236.403 2.497 20 0 BEADRP CCCN1CC[C@@H]([NH2+][C@H](C)[C@@H]2C[C@H]2C2CC2)C1 ZINC000623572976 363003769 /nfs/dbraw/zinc/00/37/69/363003769.db2.gz TZYQNNRHEUOHEK-RZFFKMDDSA-N 2 0 236.403 2.495 20 0 BEADRP CC1CC(C[NH2+][C@@H]2CC[N@H+](C)C(C)(C)C2)C1 ZINC000623575805 363006509 /nfs/dbraw/zinc/00/65/09/363006509.db2.gz QIPKHWBKPQWSKR-WXRRBKDZSA-N 2 0 224.392 2.495 20 0 BEADRP CSCC[NH2+][C@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000086501072 351165502 /nfs/dbraw/zinc/16/55/02/351165502.db2.gz KDGUJAZBECZYMI-NEPJUHHUSA-N 2 0 230.421 2.250 20 0 BEADRP CC(C)C[C@H](C)C[NH+]1C[C@H]2C[NH+](C)C[C@@H]2C1 ZINC000337200561 191137073 /nfs/dbraw/zinc/13/70/73/191137073.db2.gz FHROTHHTNXIBRX-BFHYXJOUSA-N 2 0 224.392 2.162 20 0 BEADRP CC[NH+](CC)CCC[N@H+](C)C[C@H]1CCCOC1 ZINC000177959347 366072349 /nfs/dbraw/zinc/07/23/49/366072349.db2.gz ZYVWLQSVCAYNJR-CQSZACIVSA-N 2 0 242.407 2.077 20 0 BEADRP CCC[C@@H](C[N@H+](C)C1CCN(CC)CC1)OC ZINC000637887700 351755065 /nfs/dbraw/zinc/75/50/65/351755065.db2.gz XSCIMTXSPWIHAS-AWEZNQCLSA-N 2 0 242.407 2.218 20 0 BEADRP CC(C)[C@@H](C)[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000227495670 535166494 /nfs/dbraw/zinc/16/64/94/535166494.db2.gz LLTKYUABTINAAH-GFCCVEGCSA-N 2 0 212.381 2.352 20 0 BEADRP CCCOc1cccc(C[NH2+]C2CC[NH2+]CC2)c1 ZINC000414792734 351772415 /nfs/dbraw/zinc/77/24/15/351772415.db2.gz SWQQXBGIJBAEEJ-UHFFFAOYSA-N 2 0 248.370 2.317 20 0 BEADRP C[NH+](C)C[C@H]1CC[N@H+](CC2CCSCC2)C1 ZINC000638075947 351948688 /nfs/dbraw/zinc/94/86/88/351948688.db2.gz HVOPTBASORZUOR-CYBMUJFWSA-N 2 0 242.432 2.013 20 0 BEADRP Cc1ccc(CN[C@H](C[NH3+])C2CCCCC2)nc1 ZINC000414854737 351905877 /nfs/dbraw/zinc/90/58/77/351905877.db2.gz VHHQSTNRYZDAAX-OAHLLOKOSA-N 2 0 247.386 2.387 20 0 BEADRP CCCC[C@@H](C)[NH2+]CC1=CC[N@H+](C)CC1 ZINC000336738309 351984855 /nfs/dbraw/zinc/98/48/55/351984855.db2.gz RGSGHKRGJOPWON-GFCCVEGCSA-N 2 0 210.365 2.417 20 0 BEADRP C[C@@H]([NH2+]CCC[NH+]1CCCCC1)[C@H]1CC1(F)F ZINC000638307193 352135604 /nfs/dbraw/zinc/13/56/04/352135604.db2.gz HQKXXMVNJPKCNH-VXGBXAGGSA-N 2 0 246.345 2.496 20 0 BEADRP CO[C@H](C[NH2+]CCC[N@H+](C)C(C)C)CC(C)C ZINC000638337016 352155046 /nfs/dbraw/zinc/15/50/46/352155046.db2.gz BGESOBXYEZSXSR-AWEZNQCLSA-N 2 0 244.423 2.367 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+]C[C@@H]1C[C@H]2C[C@H]2C1 ZINC000638338186 352157718 /nfs/dbraw/zinc/15/77/18/352157718.db2.gz SUWINQCOLDCTSE-BTTYYORXSA-N 2 0 224.392 2.352 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+]C[C@@H]2C[C@H]3C[C@H]3C2)C1 ZINC000638410239 352218036 /nfs/dbraw/zinc/21/80/36/352218036.db2.gz XRKAQNJBASTXQF-XQLPTFJDSA-N 2 0 236.403 2.354 20 0 BEADRP CC[N@@H+]1CCC[C@@H](C[NH2+]C[C@](C)(CC)OC)C1 ZINC000638452314 352263365 /nfs/dbraw/zinc/26/33/65/352263365.db2.gz XCLAYRJMVFJIIB-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP Cc1ccsc1C[NH2+]C[C@@H]1CCC[N@@H+](C)C1 ZINC000044535259 352352082 /nfs/dbraw/zinc/35/20/82/352352082.db2.gz HUXGGGFSKHVCBI-LBPRGKRZSA-N 2 0 238.400 2.488 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+]C[C@@H]1CCC[C@H](C)C1 ZINC000414955624 352375141 /nfs/dbraw/zinc/37/51/41/352375141.db2.gz MIMRHDPVBFORFV-YNEHKIRRSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H]([NH2+]CCC1CC[NH+](C)CC1)[C@H]1CC1(F)F ZINC000638567346 352391084 /nfs/dbraw/zinc/39/10/84/352391084.db2.gz ZKTLCWNZVIMRFY-CMPLNLGQSA-N 2 0 246.345 2.352 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2CCC[C@@H](C)[C@H]2C)CC[NH2+]1 ZINC000252931281 538103813 /nfs/dbraw/zinc/10/38/13/538103813.db2.gz BFFRSWMZRDXURF-FDYHWXHSSA-N 2 0 210.365 2.247 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2C[C@H]3C[C@H]3C2)CC[N@@H+]1C ZINC000638711288 352548873 /nfs/dbraw/zinc/54/88/73/352548873.db2.gz YLDGCOPNPRQKIZ-RGDJUOJXSA-N 2 0 222.376 2.105 20 0 BEADRP C[C@H]([NH3+])[C@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC000038917580 352567098 /nfs/dbraw/zinc/56/70/98/352567098.db2.gz MRWADXJLYWZRTH-OBJOEFQTSA-N 2 0 218.344 2.417 20 0 BEADRP CCOc1ccc(C[N@@H+]2CCC[C@H](C[NH3+])C2)cc1 ZINC000044527772 352654941 /nfs/dbraw/zinc/65/49/41/352654941.db2.gz LTWJFRAEQGUMJN-CQSZACIVSA-N 2 0 248.370 2.256 20 0 BEADRP C[N@H+](CC1CCCCC1)C[C@H]1CCC[NH2+]C1 ZINC000042495610 352622333 /nfs/dbraw/zinc/62/23/33/352622333.db2.gz WMNPUBSJBQKVFX-AWEZNQCLSA-N 2 0 224.392 2.498 20 0 BEADRP COC1([C@@H](C)[NH2+]CC[C@H]2CCC[N@@H+]2C)CCC1 ZINC000412026404 191240258 /nfs/dbraw/zinc/24/02/58/191240258.db2.gz SFFFXFRNNJKUTF-CHWSQXEVSA-N 2 0 240.391 2.018 20 0 BEADRP C1C[C@H]2CC([NH+]3CCCCCC3)C[C@@H]1[NH2+]2 ZINC000062570053 187835425 /nfs/dbraw/zinc/83/54/25/187835425.db2.gz IUTPWRHMXQCYIU-FUNVUKJBSA-N 2 0 208.349 2.145 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]CC12CCC(CC1)C2 ZINC000334259858 352871695 /nfs/dbraw/zinc/87/16/95/352871695.db2.gz RBLGVXXGRQXHMC-JLVJUDLZSA-N 2 0 236.403 2.497 20 0 BEADRP CC(C)C1(C[NH2+]CC2=CC[N@H+](C)CC2)CC1 ZINC000638838012 353022371 /nfs/dbraw/zinc/02/23/71/353022371.db2.gz BQXGNFQOIIKSGT-UHFFFAOYSA-N 2 0 222.376 2.274 20 0 BEADRP Cc1ccc(CC[NH2+]CC2=CC[N@H+](C)CC2)cc1 ZINC000638839022 353023265 /nfs/dbraw/zinc/02/32/65/353023265.db2.gz VCABPDZFKSYTCI-UHFFFAOYSA-N 2 0 244.382 2.389 20 0 BEADRP CCOC1CC(C[NH2+]CCC[NH+](CC)CC)C1 ZINC000638862420 353031239 /nfs/dbraw/zinc/03/12/39/353031239.db2.gz CZJFTQMFRLAAKB-UHFFFAOYSA-N 2 0 242.407 2.123 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H](C)[C@H]1CC1(F)F ZINC000638862731 353032283 /nfs/dbraw/zinc/03/22/83/353032283.db2.gz HSCWFGOFJVEEPL-GHMZBOCLSA-N 2 0 234.334 2.352 20 0 BEADRP CCN1CCCC[C@@H]1C[NH2+]C[C@@H]1C[C@H]1C ZINC000336757266 353158540 /nfs/dbraw/zinc/15/85/40/353158540.db2.gz JCSMMRPWLARABW-FRRDWIJNSA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)C[C@@H]1CCCCC[N@@H+]1CCOCC[NH3+] ZINC000357094039 188066319 /nfs/dbraw/zinc/06/63/19/188066319.db2.gz XVQUGLSXBVHAAC-AWEZNQCLSA-N 2 0 242.407 2.252 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]C[C@@H]2CC[C@H](C)O2)CC1 ZINC000127735989 188085050 /nfs/dbraw/zinc/08/50/50/188085050.db2.gz XEYDMXWZGFMNJA-JSGCOSHPSA-N 2 0 240.391 2.016 20 0 BEADRP CC[C@@H](c1ccccc1)N1CC[C@H]([NH2+]C)C1 ZINC000051628429 353178683 /nfs/dbraw/zinc/17/86/83/353178683.db2.gz QRRYNSSHMWMHIQ-KBPBESRZSA-N 2 0 218.344 2.431 20 0 BEADRP COc1ccc(C[N@@H+]2CC[C@@H]([NH3+])C[C@@H]2C)cc1 ZINC000049707621 188125749 /nfs/dbraw/zinc/12/57/49/188125749.db2.gz DJYGJKUQAAIGTJ-WCQYABFASA-N 2 0 234.343 2.007 20 0 BEADRP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]Cc1ccc(F)cc1 ZINC000105480682 188127011 /nfs/dbraw/zinc/12/70/11/188127011.db2.gz WQPXUVKWDCBGPF-FZMZJTMJSA-N 2 0 236.334 2.256 20 0 BEADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+]Cc2cccn2C)C1 ZINC000119081181 188154145 /nfs/dbraw/zinc/15/41/45/188154145.db2.gz OOLWYJCVZXKXKH-AWEZNQCLSA-N 2 0 249.402 2.235 20 0 BEADRP CC(C)=CC[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000228840943 188156399 /nfs/dbraw/zinc/15/63/99/188156399.db2.gz AWPLBJJNGHPMOS-MJBXVCDLSA-N 2 0 222.376 2.463 20 0 BEADRP Cc1cc(N[C@@H](C)CC[NH+](C)C)cc[nH+]1 ZINC000229565289 188159834 /nfs/dbraw/zinc/15/98/34/188159834.db2.gz MUPMMWOFJKIZOE-JTQLQIEISA-N 2 0 207.321 2.142 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@H]2CSC2(C)C)CC1 ZINC000335630157 188162359 /nfs/dbraw/zinc/16/23/59/188162359.db2.gz DHJSJZJKLWVVSD-LBPRGKRZSA-N 2 0 242.432 2.343 20 0 BEADRP CCC[C@H](CC)[NH2+]C[C@H](C)C[NH+](C)C ZINC000336681171 188164249 /nfs/dbraw/zinc/16/42/49/188164249.db2.gz HIMKVSUGUHINFC-RYUDHWBXSA-N 2 0 200.370 2.352 20 0 BEADRP C1CC([NH+]2CCC([NH2+][C@@H]3CCSC3)CC2)C1 ZINC000309354583 188167709 /nfs/dbraw/zinc/16/77/09/188167709.db2.gz NNYMKEKTGVTALH-GFCCVEGCSA-N 2 0 240.416 2.098 20 0 BEADRP C([NH2+][C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1)C1CCC1 ZINC000250674225 188220811 /nfs/dbraw/zinc/22/08/11/188220811.db2.gz WFNOYZNPIPKBKS-MGPQQGTHSA-N 2 0 222.376 2.297 20 0 BEADRP COc1ccc(C[N@@H+]2CC[C@H](C)[C@@H](C[NH3+])C2)cc1 ZINC000163389151 188222300 /nfs/dbraw/zinc/22/23/00/188222300.db2.gz AKYHEKAJWVADHZ-JSGCOSHPSA-N 2 0 248.370 2.112 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC=CCC1)C1CC[NH+](C)CC1 ZINC000084066307 538113169 /nfs/dbraw/zinc/11/31/69/538113169.db2.gz XVJKEFSSQMZRQP-TZMCWYRMSA-N 2 0 222.376 2.415 20 0 BEADRP C/C=C/C[C@@H](CO)[NH2+]CCCc1cnccc1C ZINC000289779755 188210922 /nfs/dbraw/zinc/21/09/22/188210922.db2.gz RHEBJUOZZCJASU-BWPKMQGJSA-N 2 0 248.370 2.239 20 0 BEADRP Cc1cccc(C)c1C[N@H+](C)CCC[NH3+] ZINC000122157728 324032335 /nfs/dbraw/zinc/03/23/35/324032335.db2.gz KQZYFWVGNFBMRA-UHFFFAOYSA-N 2 0 206.333 2.084 20 0 BEADRP COCc1cccc(C[N@@H+]2CC[C@@H]([NH3+])[C@H](C)C2)c1 ZINC000251941655 353293799 /nfs/dbraw/zinc/29/37/99/353293799.db2.gz ZQNBPLZTTNPUAA-IUODEOHRSA-N 2 0 248.370 2.002 20 0 BEADRP CC(C)(C)CC[N@@H+]1C[C@@H]2CCC[C@@H]([NH3+])[C@H]2C1 ZINC000252839423 353312050 /nfs/dbraw/zinc/31/20/50/353312050.db2.gz AWRUHZQSYDDKOA-RWMBFGLXSA-N 2 0 224.392 2.482 20 0 BEADRP CC[N@@H+]1CCC[C@H](C[NH2+]C2CC(C)(C)C2)C1 ZINC000336772084 353312138 /nfs/dbraw/zinc/31/21/38/353312138.db2.gz VDFYBAMGSCLKHD-GFCCVEGCSA-N 2 0 224.392 2.497 20 0 BEADRP CC[NH+]1CCC([NH2+]CCC=C(C)C)CC1 ZINC000336772671 353316814 /nfs/dbraw/zinc/31/68/14/353316814.db2.gz XXSYLMSZBLLEFO-UHFFFAOYSA-N 2 0 210.365 2.417 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](Cc3cccs3)C[C@@H]21 ZINC000230126732 353473577 /nfs/dbraw/zinc/47/35/77/353473577.db2.gz FUMKYKSMYPIVMB-KGYLQXTDSA-N 2 0 236.384 2.307 20 0 BEADRP C(C[NH+]1CCCCC1)SCC1CC[NH2+]CC1 ZINC000058258762 188485455 /nfs/dbraw/zinc/48/54/55/188485455.db2.gz DMBGJKPBXDUOBN-UHFFFAOYSA-N 2 0 242.432 2.205 20 0 BEADRP Fc1ccccc1C[N@H+]1CC[C@H]2C[NH2+]C[C@H]2CC1 ZINC000335267424 181011539 /nfs/dbraw/zinc/01/15/39/181011539.db2.gz GARLYKNGPGMKOM-BETUJISGSA-N 2 0 248.345 2.257 20 0 BEADRP CC[C@H](C)[NH2+]Cc1cn(-c2cc[nH+]cc2)nc1C ZINC000344126268 354145548 /nfs/dbraw/zinc/14/55/48/354145548.db2.gz GRTLNHBOJSZPKC-NSHDSACASA-N 2 0 244.342 2.464 20 0 BEADRP Cc1ccc(NCC[NH2+]C(C)(C)C)cn1 ZINC000230975487 363331994 /nfs/dbraw/zinc/33/19/94/363331994.db2.gz RBNLUKZLXXRPKT-UHFFFAOYSA-N 2 0 207.321 2.190 20 0 BEADRP CCSCC[NH2+]CCC[N@H+](C)C(C)C ZINC000230977573 363332225 /nfs/dbraw/zinc/33/22/25/363332225.db2.gz WKQLVBUDYMZBIR-UHFFFAOYSA-N 2 0 218.410 2.059 20 0 BEADRP C([NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)[C@@H]1C[C@H]1C1CC1 ZINC000449743391 202018296 /nfs/dbraw/zinc/01/82/96/202018296.db2.gz XFZJFYVDUMPKFH-XGUBFFRZSA-N 2 0 234.387 2.249 20 0 BEADRP C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C[C@@H]2C[C@H]3C[C@H]3C2)C1 ZINC000639178412 354253839 /nfs/dbraw/zinc/25/38/39/354253839.db2.gz LJIOFKFQHNVKFY-ARKGTOAJSA-N 2 0 248.414 2.449 20 0 BEADRP CCc1nccn1Cc1cn2cc(C)ccc2n1 ZINC000179182351 366219580 /nfs/dbraw/zinc/21/95/80/366219580.db2.gz LDFGHJIGAJEVIH-UHFFFAOYSA-N 2 0 240.310 2.450 20 0 BEADRP C([NH2+][C@H]1CCCC12CCC2)[C@H]1CCC[NH2+]1 ZINC000335128248 354774962 /nfs/dbraw/zinc/77/49/62/354774962.db2.gz GHDFMJRELIIYNO-NEPJUHHUSA-N 2 0 208.349 2.051 20 0 BEADRP C([NH2+][C@@H]1CCCC12CCC2)[C@@H]1CCC[NH2+]1 ZINC000335128250 354775059 /nfs/dbraw/zinc/77/50/59/354775059.db2.gz GHDFMJRELIIYNO-NWDGAFQWSA-N 2 0 208.349 2.051 20 0 BEADRP CC[N@H+](CC1CC1)C[C@H]1CC[NH2+][C@@H](C)C1 ZINC000233458507 363402225 /nfs/dbraw/zinc/40/22/25/363402225.db2.gz QEDHLTREQHCBGO-AAEUAGOBSA-N 2 0 210.365 2.106 20 0 BEADRP CCC(C)(C)C[NH2+]C[C@@H]([NH3+])CC(C)C ZINC000232881776 363388239 /nfs/dbraw/zinc/38/82/39/363388239.db2.gz UTOKRGYOZFMAQF-NSHDSACASA-N 2 0 200.370 2.386 20 0 BEADRP C[C@@H]1CCCCC[N@@H+]1CCc1cncn1C ZINC000335145403 354854442 /nfs/dbraw/zinc/85/44/42/354854442.db2.gz CNRTZMSOIKPGLP-GFCCVEGCSA-N 2 0 221.348 2.227 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]CC1CCCC1 ZINC000335197943 355031220 /nfs/dbraw/zinc/03/12/20/355031220.db2.gz RBMNJCASVNWZHE-YPMHNXCESA-N 2 0 210.365 2.154 20 0 BEADRP [NH3+][C@H]1CCCCC[C@@H]1[NH2+]CC1CCCC1 ZINC000335197964 355031262 /nfs/dbraw/zinc/03/12/62/355031262.db2.gz RIKKWLSXBRQXPC-STQMWFEESA-N 2 0 210.365 2.426 20 0 BEADRP CC1(C)CCC([NH2+][C@@H]2CCC[C@@H]2[NH3+])CC1 ZINC000335217483 355056577 /nfs/dbraw/zinc/05/65/77/355056577.db2.gz OLDKXGFMORTJIS-NWDGAFQWSA-N 2 0 210.365 2.425 20 0 BEADRP C[NH+](C)C1CC[NH+](CCC(C)(C)C)CC1 ZINC000113500064 355110056 /nfs/dbraw/zinc/11/00/56/355110056.db2.gz PPNHHMUECLOYBN-UHFFFAOYSA-N 2 0 212.381 2.449 20 0 BEADRP c1ccc(C2([NH2+]C[C@H]3CCC[NH2+]C3)CC2)cc1 ZINC000346964724 355172393 /nfs/dbraw/zinc/17/23/93/355172393.db2.gz BROSSGKZCKNEFE-ZDUSSCGKSA-N 2 0 230.355 2.265 20 0 BEADRP Fc1ccc(C2([NH2+]C[C@H]3CCC[NH2+]C3)CC2)cc1 ZINC000346988562 355189415 /nfs/dbraw/zinc/18/94/15/355189415.db2.gz RGLPRJHGPOPYHI-LBPRGKRZSA-N 2 0 248.345 2.404 20 0 BEADRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)[C@@H]1CC1(F)F ZINC000639245727 355274932 /nfs/dbraw/zinc/27/49/32/355274932.db2.gz BDXPBJKEAAFUSQ-AZWZAMPBSA-N 2 0 244.329 2.245 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]Cc2ccc3c[nH+]cn3c2)CS1 ZINC000639257216 355301873 /nfs/dbraw/zinc/30/18/73/355301873.db2.gz RPHUHHZVBHULPW-CMPLNLGQSA-N 2 0 247.367 2.318 20 0 BEADRP CC[C@@](C)(C[NH2+]Cc1ccc2c[nH+]cn2c1)OC ZINC000639257361 355302781 /nfs/dbraw/zinc/30/27/81/355302781.db2.gz SUDFKBHWUIUBGZ-AWEZNQCLSA-N 2 0 247.342 2.239 20 0 BEADRP C[NH+](C)C1CCC([NH2+]CCC[C@@H]2CCO2)CC1 ZINC000639277394 355355342 /nfs/dbraw/zinc/35/53/42/355355342.db2.gz VUZSAHPVRICOSC-JXQTWKCFSA-N 2 0 240.391 2.018 20 0 BEADRP [NH3+]CCC[NH+]1CCC(OCC2CCCC2)CC1 ZINC000414706792 191552007 /nfs/dbraw/zinc/55/20/07/191552007.db2.gz MVTMHYDRPHEUQV-UHFFFAOYSA-N 2 0 240.391 2.006 20 0 BEADRP CCOc1ccccc1C[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000414825422 191587835 /nfs/dbraw/zinc/58/78/35/191587835.db2.gz CDYOYQQXYNMJHO-ZDUSSCGKSA-N 2 0 248.370 2.175 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]Cc1ccc(F)cc1C ZINC000414843104 191597539 /nfs/dbraw/zinc/59/75/39/191597539.db2.gz PQCITACPNFKPER-JTQLQIEISA-N 2 0 224.323 2.079 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000414992432 191643825 /nfs/dbraw/zinc/64/38/25/191643825.db2.gz ROXAHGCGLPFZDX-GUBZILKMSA-N 2 0 238.297 2.434 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CC[C@H](C[NH3+])C1 ZINC000415051894 191653757 /nfs/dbraw/zinc/65/37/57/191653757.db2.gz ZZAXNKSEWHZXJU-XQHKEYJVSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]C[C@@H]1CCOc2ccccc21 ZINC000415024634 191655840 /nfs/dbraw/zinc/65/58/40/191655840.db2.gz PGZZWTHMFDZEIC-OLZOCXBDSA-N 2 0 248.370 2.270 20 0 BEADRP [NH3+]C[C@H]1CC[C@H](C[NH2+]C[C@@H]2CCSC2)CC1 ZINC000415025505 191656501 /nfs/dbraw/zinc/65/65/01/191656501.db2.gz QIFJZQIEKAQTTF-AVGNSLFASA-N 2 0 242.432 2.094 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]Cc1cc(F)cc(Cl)c1 ZINC000414878550 191611710 /nfs/dbraw/zinc/61/17/10/191611710.db2.gz OFNVXTZKNCVODM-MRVPVSSYSA-N 2 0 230.714 2.164 20 0 BEADRP Cc1nc2ccc(C[NH2+][C@@H](C)CC[NH3+])cc2s1 ZINC000414887268 191615732 /nfs/dbraw/zinc/61/57/32/191615732.db2.gz DFOPLEOQAPZIEB-VIFPVBQESA-N 2 0 249.383 2.432 20 0 BEADRP C[C@@H](Cc1ccoc1)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000583545700 355521915 /nfs/dbraw/zinc/52/19/15/355521915.db2.gz LAYHAKNSZXFPJU-GXTWGEPZSA-N 2 0 236.359 2.142 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000583545703 355522359 /nfs/dbraw/zinc/52/23/59/355522359.db2.gz LAYHAKNSZXFPJU-TZMCWYRMSA-N 2 0 236.359 2.142 20 0 BEADRP CC(C)OCC(C)(C)[NH2+]C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000415121835 191684763 /nfs/dbraw/zinc/68/47/63/191684763.db2.gz KTHAKAIWYUQCNF-CHWSQXEVSA-N 2 0 242.407 2.168 20 0 BEADRP [NH3+]C[C@H]1CC[C@@H]([NH2+]Cc2cc(F)ccc2F)C1 ZINC000415030709 191658141 /nfs/dbraw/zinc/65/81/41/191658141.db2.gz FWWBSKCKDJMUOO-JOYOIKCWSA-N 2 0 240.297 2.182 20 0 BEADRP Cc1ccc(F)cc1C[NH2+][C@@H]1CC[C@@H](C[NH3+])C1 ZINC000415046833 191662001 /nfs/dbraw/zinc/66/20/01/191662001.db2.gz VJGGMDDBGBTBLE-BXUZGUMPSA-N 2 0 236.334 2.351 20 0 BEADRP CC(C)CC[C@](C)(O)C[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000583575717 355657333 /nfs/dbraw/zinc/65/73/33/355657333.db2.gz PYKWVNHSQQSGLX-RDBSUJKOSA-N 2 0 242.407 2.033 20 0 BEADRP CC(C)C[NH+]1CCC([NH2+][C@@H]2CCSC2)CC1 ZINC000166578474 355697146 /nfs/dbraw/zinc/69/71/46/355697146.db2.gz XZOCXCXLUHJANY-CYBMUJFWSA-N 2 0 242.432 2.202 20 0 BEADRP c1nc2c([nH]1)C[C@H]([NH2+][C@@H]1CCC13CCC3)CC2 ZINC000336003074 134048034 /nfs/dbraw/zinc/04/80/34/134048034.db2.gz OTIDYXKKXMOUKO-ZWNOBZJWSA-N 2 0 231.343 2.189 20 0 BEADRP CS[C@H]1CC[C@@H]1[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000425350450 191819363 /nfs/dbraw/zinc/81/93/63/191819363.db2.gz LOHMZWWGUVLZGU-RYUDHWBXSA-N 2 0 242.432 2.202 20 0 BEADRP CC[C@](C)(C[NH2+]C[C@@H]1CCCC[N@H+](C)C1)OC ZINC000639345773 355791793 /nfs/dbraw/zinc/79/17/93/355791793.db2.gz ACOBQQIGVLEMGR-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP Cc1ccc(C[N@H+]2C[C@@H](C[NH3+])C[C@@H]2C)cc1F ZINC000216048345 355800538 /nfs/dbraw/zinc/80/05/38/355800538.db2.gz AANOTBDSQYHWSN-WCQYABFASA-N 2 0 236.334 2.303 20 0 BEADRP Cc1ccc(C[N@H+]2C[C@H](C[NH3+])C[C@@H]2C)c(C)c1 ZINC000216042831 355802776 /nfs/dbraw/zinc/80/27/76/355802776.db2.gz GZXLNDPIBQVYBH-KBPBESRZSA-N 2 0 232.371 2.473 20 0 BEADRP CCC1([NH+](C)C)CC[NH+](C[C@@H]2C[C@H]2C)CC1 ZINC000639378188 355911440 /nfs/dbraw/zinc/91/14/40/355911440.db2.gz FAHVPWONPKWEMS-OLZOCXBDSA-N 2 0 224.392 2.449 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]CCCC2CCOCC2)C1 ZINC000582228972 355992311 /nfs/dbraw/zinc/99/23/11/355992311.db2.gz GKVSWVXCHYJPNZ-KBPBESRZSA-N 2 0 240.391 2.053 20 0 BEADRP CC(C)N(C)CC[NH2+][C@@H]1CCCC12CC2 ZINC000583641979 355948012 /nfs/dbraw/zinc/94/80/12/355948012.db2.gz KRVMVTGYTBVSGQ-GFCCVEGCSA-N 2 0 210.365 2.249 20 0 BEADRP CCN1CC[C@H]2CC[C@@H](C1)[N@@H+]2C[C@@H]1C[C@@H]1C ZINC000351232411 355965353 /nfs/dbraw/zinc/96/53/53/355965353.db2.gz XWSUUNCHDFJHKY-FQUUOJAGSA-N 2 0 222.376 2.201 20 0 BEADRP C[NH+](C)CCC1CC[NH+](CCCCF)CC1 ZINC000351859474 356097020 /nfs/dbraw/zinc/09/70/20/356097020.db2.gz WRWJWRGZPBMMFT-UHFFFAOYSA-N 2 0 230.371 2.400 20 0 BEADRP COc1cccc2c1CC[C@@H]2[NH2+][C@H](C)CCC[NH3+] ZINC000422887167 192497786 /nfs/dbraw/zinc/49/77/86/192497786.db2.gz KENNDBHBIFBXAD-RISCZKNCSA-N 2 0 248.370 2.400 20 0 BEADRP CCc1cccc(C[N@@H+]2CC[C@H](C[NH3+])C2)c1 ZINC000420298745 192205229 /nfs/dbraw/zinc/20/52/29/192205229.db2.gz SMZFYNVKNNNXND-CQSZACIVSA-N 2 0 218.344 2.030 20 0 BEADRP CCc1cccc(C[N@@H+]2CC[C@H](C[NH2+]C)C2)c1 ZINC000420297068 192205894 /nfs/dbraw/zinc/20/58/94/192205894.db2.gz QVVIJBGNEFSLDM-OAHLLOKOSA-N 2 0 232.371 2.290 20 0 BEADRP CCc1cccc(C[N@@H+]2CC[C@H]([C@H](C)[NH3+])C2)c1 ZINC000420302426 192206589 /nfs/dbraw/zinc/20/65/89/192206589.db2.gz GAXPOEPHCSXRPQ-WFASDCNBSA-N 2 0 232.371 2.418 20 0 BEADRP CCc1cccc(C[N@@H+]2CC[C@@H]([C@@H](C)[NH3+])C2)c1 ZINC000420302424 192207024 /nfs/dbraw/zinc/20/70/24/192207024.db2.gz GAXPOEPHCSXRPQ-IUODEOHRSA-N 2 0 232.371 2.418 20 0 BEADRP COc1cccc2c1CC[C@H]2[NH2+][C@H](C)CCC[NH3+] ZINC000422887165 192497081 /nfs/dbraw/zinc/49/70/81/192497081.db2.gz KENNDBHBIFBXAD-BXUZGUMPSA-N 2 0 248.370 2.400 20 0 BEADRP C[C@@H]1C[C@@H](C[NH3+])C[N@@H+]1CCCc1ccsc1 ZINC000420316220 192213101 /nfs/dbraw/zinc/21/31/01/192213101.db2.gz LTTGZTURKISMBO-YPMHNXCESA-N 2 0 238.400 2.350 20 0 BEADRP COc1ccc([C@@H](C[NH3+])C[N@@H+]2CC[C@H](C)C2)cc1 ZINC000420317665 192213520 /nfs/dbraw/zinc/21/35/20/192213520.db2.gz NPZDNQOBOLFFPA-JSGCOSHPSA-N 2 0 248.370 2.079 20 0 BEADRP C[C@H]1CCCC[C@@H]1OCC[N@H+](C)C1CC([NH3+])C1 ZINC000420331887 192213788 /nfs/dbraw/zinc/21/37/88/192213788.db2.gz MSHPCCSPRHOZGO-ABXWRUBCSA-N 2 0 240.391 2.003 20 0 BEADRP CCCCC[N@@H+]1CCC[C@@H]([C@@H]2CC[NH2+]C2)C1 ZINC000420331974 192213837 /nfs/dbraw/zinc/21/38/37/192213837.db2.gz CJEJVYJODXASAW-ZIAGYGMSSA-N 2 0 224.392 2.498 20 0 BEADRP COc1ccccc1[C@@H](C)[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000420371677 192213879 /nfs/dbraw/zinc/21/38/79/192213879.db2.gz KWQVAWZESSFEDQ-OLZOCXBDSA-N 2 0 248.370 2.345 20 0 BEADRP C[N@H+](CCOC1CCCCCC1)C1CC([NH3+])C1 ZINC000420335247 192214534 /nfs/dbraw/zinc/21/45/34/192214534.db2.gz PMYVNIMKRIDVFD-UHFFFAOYSA-N 2 0 240.391 2.147 20 0 BEADRP C[N@H+](CCCc1ccncc1)[C@@H]1CCC[NH2+]CC1 ZINC000420305030 192208422 /nfs/dbraw/zinc/20/84/22/192208422.db2.gz FTQKTLGMZMGRSD-OAHLLOKOSA-N 2 0 247.386 2.088 20 0 BEADRP C[C@@H]1CCC[C@H](C)[N@H+](CC[C@H]2CC[NH2+]C2)C1 ZINC000420305660 192208576 /nfs/dbraw/zinc/20/85/76/192208576.db2.gz PTKXXBMWMFZTJU-HZSPNIEDSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1cnc([C@H](C)[N@@H+]2CCC[C@H](CC[NH3+])C2)o1 ZINC000420305468 192209345 /nfs/dbraw/zinc/20/93/45/192209345.db2.gz GKKKDZFDJFZYOU-NWDGAFQWSA-N 2 0 237.347 2.105 20 0 BEADRP [NH3+]CC[C@@H]1CCCC[N@@H+]1CC[C@@H]1CCCCO1 ZINC000420307712 192209668 /nfs/dbraw/zinc/20/96/68/192209668.db2.gz CDTUGCHEWSGGHJ-KBPBESRZSA-N 2 0 240.391 2.149 20 0 BEADRP C[C@@H]([NH3+])[C@@H]1CC[N@H+](CCCCC(F)(F)F)C1 ZINC000420312230 192209971 /nfs/dbraw/zinc/20/99/71/192209971.db2.gz RYRRBPFRLOPQTK-NXEZZACHSA-N 2 0 238.297 2.388 20 0 BEADRP CCc1cccc(C[N@@H+]2CC[C@@H]3[NH2+]CC[C@H]3C2)c1 ZINC000420313975 192211971 /nfs/dbraw/zinc/21/19/71/192211971.db2.gz KODAWDBFNKVBBB-HOTGVXAUSA-N 2 0 244.382 2.433 20 0 BEADRP CCSCC[N@@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1 ZINC000420328344 192229998 /nfs/dbraw/zinc/22/99/98/192229998.db2.gz MHXCHPCZPQNTLG-STQMWFEESA-N 2 0 242.432 2.061 20 0 BEADRP C[C@@H]1C[C@H](C[NH3+])C[N@@H+]1CCCCC(F)(F)F ZINC000420326091 192230241 /nfs/dbraw/zinc/23/02/41/192230241.db2.gz XAWZREKVUNHOHL-NXEZZACHSA-N 2 0 238.297 2.388 20 0 BEADRP c1cc([C@@H]2CCC[N@H+]2CC[C@@H]2CC[NH2+]C2)ccn1 ZINC000420363491 192223568 /nfs/dbraw/zinc/22/35/68/192223568.db2.gz PHBXAVVNPDHRNG-ZFWWWQNUSA-N 2 0 245.370 2.218 20 0 BEADRP CC[C@H]1Cc2ccccc2C[N@@H+]1CCC[NH2+]C ZINC000420365633 192224241 /nfs/dbraw/zinc/22/42/41/192224241.db2.gz SKCYICOJCIDCAW-HNNXBMFYSA-N 2 0 232.371 2.433 20 0 BEADRP CCC1(CC)CCC[N@H+](CCOCC[NH3+])CC1 ZINC000420381559 192235747 /nfs/dbraw/zinc/23/57/47/192235747.db2.gz XWMIMIJGIZFQCE-UHFFFAOYSA-N 2 0 242.407 2.254 20 0 BEADRP C[NH2+]CCC[N@H+](C)[C@@H]1CCc2ccc(F)cc21 ZINC000420392606 192236956 /nfs/dbraw/zinc/23/69/56/192236956.db2.gz VZLYWOPXFSRDHX-CQSZACIVSA-N 2 0 236.334 2.354 20 0 BEADRP C[NH2+]CCC[N@H+](C)CCCc1ccsc1 ZINC000420394859 192237304 /nfs/dbraw/zinc/23/73/04/192237304.db2.gz SDTNPLIMSAGANI-UHFFFAOYSA-N 2 0 226.389 2.222 20 0 BEADRP CCCC[N@@H+]1CCCC[C@H]1[C@H]1CC[NH2+]C1 ZINC000420409532 192239000 /nfs/dbraw/zinc/23/90/00/192239000.db2.gz XFHIXICTTJSTMH-STQMWFEESA-N 2 0 210.365 2.251 20 0 BEADRP C[C@@H]([NH2+]C[C@H](C)[NH3+])C(C)(C)c1ccccc1 ZINC000420411525 192239796 /nfs/dbraw/zinc/23/97/96/192239796.db2.gz RTDGAHDIGOZBKI-NWDGAFQWSA-N 2 0 220.360 2.290 20 0 BEADRP C[C@@H]([NH2+]C[C@H](C)[NH3+])[C@H](C)c1ccccc1 ZINC000420417328 192240974 /nfs/dbraw/zinc/24/09/74/192240974.db2.gz WJVMFVFYXCDKBC-SDDRHHMPSA-N 2 0 206.333 2.115 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCC[NH2+]C1)c1cccnc1 ZINC000420379295 192233372 /nfs/dbraw/zinc/23/33/72/192233372.db2.gz VAKWARVCVAYKRB-QWHCGFSZSA-N 2 0 233.359 2.122 20 0 BEADRP Cc1cc(C)c(C[N@@H+]2C[C@@H](O)C(C)(C)C2)c(C)n1 ZINC000639618633 356535768 /nfs/dbraw/zinc/53/57/68/356535768.db2.gz QSHQNJJQPFMYDT-CQSZACIVSA-N 2 0 248.370 2.210 20 0 BEADRP CCc1cc(N2CCC[C@@H]([NH+](C)C)C2)cc[nH+]1 ZINC000336192237 134123666 /nfs/dbraw/zinc/12/36/66/134123666.db2.gz ICQADENSEVUUKG-CQSZACIVSA-N 2 0 233.359 2.174 20 0 BEADRP C([C@@H]1CCC[NH2+]C1)[N@@H+]1CCC[C@@H]1C1CCC1 ZINC000336197083 134126902 /nfs/dbraw/zinc/12/69/02/134126902.db2.gz KGEHHXQTCKIYLX-TZMCWYRMSA-N 2 0 222.376 2.251 20 0 BEADRP CCc1cc(N2CC[NH+](C3CCC3)CC2)cc[nH+]1 ZINC000336203201 134131165 /nfs/dbraw/zinc/13/11/65/134131165.db2.gz LFLXWFHEONEWCI-UHFFFAOYSA-N 2 0 245.370 2.319 20 0 BEADRP COc1ccc(C2([NH2+][C@@H](C)C[C@H](C)[NH3+])CC2)cc1 ZINC000422934477 192510230 /nfs/dbraw/zinc/51/02/30/192510230.db2.gz JMJOYJBSKHUBDC-RYUDHWBXSA-N 2 0 248.370 2.400 20 0 BEADRP CCCC(O)(CCC)C[NH2+][C@@H](C)CCC[NH3+] ZINC000422976469 192514179 /nfs/dbraw/zinc/51/41/79/192514179.db2.gz IHPFQMSPEDFMJV-LBPRGKRZSA-N 2 0 230.396 2.035 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]CCCC(F)(F)F ZINC000422968229 192530738 /nfs/dbraw/zinc/53/07/38/192530738.db2.gz QSUULEAQMAIMSV-NXEZZACHSA-N 2 0 238.297 2.307 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H]1CCO[C@@H](C(C)(C)C)C1 ZINC000423020525 192542987 /nfs/dbraw/zinc/54/29/87/192542987.db2.gz BUGJMQATQBEHBK-WUHRBBMRSA-N 2 0 242.407 2.296 20 0 BEADRP COC1CCC(CC[NH2+][C@@H](C)C[C@@H](C)[NH3+])CC1 ZINC000423036693 192548082 /nfs/dbraw/zinc/54/80/82/192548082.db2.gz LHKVAFMZXAKUFM-KBHBFKLGSA-N 2 0 242.407 2.297 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]C[C@@](C)(O)C1CCCCC1 ZINC000423072310 192559217 /nfs/dbraw/zinc/55/92/17/192559217.db2.gz JDTMIXLKDTWXDI-SGMGOOAPSA-N 2 0 242.407 2.033 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H]1CCC12CCCC2 ZINC000423073263 192559780 /nfs/dbraw/zinc/55/97/80/192559780.db2.gz IICBVBKIZXCZIA-VXGBXAGGSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@H]2CCCCC[C@H]2[NH3+])C1 ZINC000423059624 192555219 /nfs/dbraw/zinc/55/52/19/192555219.db2.gz GDFCTCYXBUHPPX-XQHKEYJVSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@@H]1CC[N@H+](Cc2ccsc2)C[C@@H]1C[NH3+] ZINC000167604188 134152750 /nfs/dbraw/zinc/15/27/50/134152750.db2.gz XKBUNVDUFAERAO-PWSUYJOCSA-N 2 0 224.373 2.165 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCc2ccc(F)cc21)C1C[NH2+]C1 ZINC000582235569 356652013 /nfs/dbraw/zinc/65/20/13/356652013.db2.gz FGOSZUYCMDHRCO-OTYXRUKQSA-N 2 0 234.318 2.011 20 0 BEADRP C[C@@H]1CCC[C@H]1C[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000423109823 192571962 /nfs/dbraw/zinc/57/19/62/192571962.db2.gz VBLCZLOSMADGMP-ZBBUEOHVSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](C)C(C)(F)F ZINC000389453476 356676864 /nfs/dbraw/zinc/67/68/64/356676864.db2.gz VSHFGQKAWSXKER-IUCAKERBSA-N 2 0 208.296 2.137 20 0 BEADRP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]CC1CCSCC1 ZINC000167691520 134153914 /nfs/dbraw/zinc/15/39/14/134153914.db2.gz NZWHJVMLTLSMDL-AAEUAGOBSA-N 2 0 242.432 2.059 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H]2CCCCC[C@H]2[NH3+])cn1 ZINC000563951296 356664822 /nfs/dbraw/zinc/66/48/22/356664822.db2.gz XUXHHLIASPAJBJ-HUUCEWRRSA-N 2 0 247.386 2.182 20 0 BEADRP [NH3+]CC1CCC([NH2+]C[C@@H]2CCCSC2)CC1 ZINC000423119595 192576131 /nfs/dbraw/zinc/57/61/31/192576131.db2.gz FAAMNWSQEAHPKQ-CPCZMJQVSA-N 2 0 242.432 2.237 20 0 BEADRP C[NH+](C)C[C@H]1CC[N@H+](CC2=CCCCC2)C1 ZINC000450410542 202158045 /nfs/dbraw/zinc/15/80/45/202158045.db2.gz ZELLQCUZULJREI-CQSZACIVSA-N 2 0 222.376 2.370 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CCc2ccccn2)CC1(C)C ZINC000623336601 356724727 /nfs/dbraw/zinc/72/47/27/356724727.db2.gz ZFAYUOVVQDSOGJ-AWEZNQCLSA-N 2 0 247.386 2.087 20 0 BEADRP C[C@H]1C[C@@H]([NH+]2CC(C)(C)OC(C)(C)C2)CC[NH2+]1 ZINC000226427738 538610890 /nfs/dbraw/zinc/61/08/90/538610890.db2.gz BHQXZLPBSKAQPN-RYUDHWBXSA-N 2 0 240.391 2.016 20 0 BEADRP Cc1cccnc1CCC[NH2+][C@H](C)C[C@H](C)[NH3+] ZINC000423151929 192592194 /nfs/dbraw/zinc/59/21/94/192592194.db2.gz KWJHBJWTSQHKAK-QWHCGFSZSA-N 2 0 235.375 2.038 20 0 BEADRP CCOCCCC[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623362610 356812686 /nfs/dbraw/zinc/81/26/86/356812686.db2.gz BCBAZDSTCIFUJC-ZDUSSCGKSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@@H](C)[C@@H]1C[C@H]1C1CC1 ZINC000623384177 356909082 /nfs/dbraw/zinc/90/90/82/356909082.db2.gz REESCWCYGZPNFA-XWUBHJNHSA-N 2 0 224.392 2.351 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C[C@H]2CCCCO2)CC1(C)C ZINC000623377440 356896467 /nfs/dbraw/zinc/89/64/67/356896467.db2.gz ZAARRMJNQDBTMJ-QWHCGFSZSA-N 2 0 240.391 2.018 20 0 BEADRP CCC(C)(C)CC[N@@H+]1CCC[C@H]1C[NH2+]C ZINC000261552916 535350994 /nfs/dbraw/zinc/35/09/94/535350994.db2.gz SBKRNRRZJPYGCU-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP CC[C@H]([NH2+]CCC[NH2+]C)c1cccc(OC)c1 ZINC000423201646 192625458 /nfs/dbraw/zinc/62/54/58/192625458.db2.gz PIRILPDKAQBBFL-AWEZNQCLSA-N 2 0 236.359 2.345 20 0 BEADRP FC(F)C1CCC([NH2+]C[C@@H]2CCC[NH2+]C2)CC1 ZINC000423210571 192629531 /nfs/dbraw/zinc/62/95/31/192629531.db2.gz JXJQZFCFZPSBEM-VOMCLLRMSA-N 2 0 246.345 2.400 20 0 BEADRP CCC1CC([NH2+]CC2CC[NH+](CC)CC2)C1 ZINC000390544500 357103058 /nfs/dbraw/zinc/10/30/58/357103058.db2.gz MIDDSAQAXCVGJI-UHFFFAOYSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]CCN1CC[C@@H](C)C1 ZINC000389932602 357069616 /nfs/dbraw/zinc/06/96/16/357069616.db2.gz LMWYJLMLIPRAMX-UPJWGTAASA-N 2 0 210.365 2.106 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+]C2CCSCC2)CC1(C)C ZINC000623404902 357140269 /nfs/dbraw/zinc/14/02/69/357140269.db2.gz PRUYWRNYGDFPPR-GFCCVEGCSA-N 2 0 242.432 2.344 20 0 BEADRP c1ccc2c(c1)CC[C@H]2[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000423246071 192650032 /nfs/dbraw/zinc/65/00/32/192650032.db2.gz JUPKWHWOKXGBKQ-IUODEOHRSA-N 2 0 230.355 2.263 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@@H]2CCCSC2)CC1 ZINC000304573618 357168019 /nfs/dbraw/zinc/16/80/19/357168019.db2.gz XHHOUKIQHWDMSO-LBPRGKRZSA-N 2 0 242.432 2.204 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]C[C@@H]2CCCC2(F)F)C1 ZINC000390872665 357119218 /nfs/dbraw/zinc/11/92/18/357119218.db2.gz POUWKOKRRMDEJJ-AXFHLTTASA-N 2 0 232.318 2.281 20 0 BEADRP CC[C@H]1CCC[C@H]1[NH2+]CCC1=CC[NH2+]CC1 ZINC000583687703 357120173 /nfs/dbraw/zinc/12/01/73/357120173.db2.gz JMYZXYQJGVFSOP-UONOGXRCSA-N 2 0 222.376 2.465 20 0 BEADRP Cc1cc(CN[C@H]2CC[N@@H+]3CCCC[C@H]23)ccn1 ZINC000391169760 357125022 /nfs/dbraw/zinc/12/50/22/357125022.db2.gz FQQXUPXYXKQYBK-LSDHHAIUSA-N 2 0 245.370 2.106 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CCC[C@@H]2C[C@@]21C ZINC000423277039 192670335 /nfs/dbraw/zinc/67/03/35/192670335.db2.gz PJGCQSRCUGGPLN-LOWDOPEQSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]1CSC[C@H]1[NH2+]C[C@@H]1CCCC[N@H+](C)C1 ZINC000628425916 357254316 /nfs/dbraw/zinc/25/43/16/357254316.db2.gz ZCZQTAQWMOVJPQ-FRRDWIJNSA-N 2 0 242.432 2.059 20 0 BEADRP CCC[C@H]([NH2+]C[C@@H](C)C[NH2+]C)C1CCC1 ZINC000423280637 192673039 /nfs/dbraw/zinc/67/30/39/192673039.db2.gz VAPKRCHQNGAOLU-AAEUAGOBSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H]([NH2+]C1C[C@@H](C)O[C@H](C)C1)[C@H]1CCCC[NH2+]1 ZINC000582480736 357316947 /nfs/dbraw/zinc/31/69/47/357316947.db2.gz SPPVTESGEFCQHW-NRWUCQMLSA-N 2 0 240.391 2.063 20 0 BEADRP CC[C@H]([NH2+]CC1CC[NH2+]CC1)[C@@H]1C[C@@H]1C ZINC000582540533 357338926 /nfs/dbraw/zinc/33/89/26/357338926.db2.gz SRJSSEWORPFYSQ-UHTWSYAYSA-N 2 0 210.365 2.010 20 0 BEADRP CCO[C@@H]1C[C@@H]([NH2+]C[C@@H](C)C[NH3+])C1(CC)CC ZINC000423298653 192686732 /nfs/dbraw/zinc/68/67/32/192686732.db2.gz AMXSXQYWMBMDQH-YNEHKIRRSA-N 2 0 242.407 2.155 20 0 BEADRP CCOC[C@@H]1CCC[C@H]1[NH2+]CCC[NH2+]C(C)C ZINC000582899111 357425320 /nfs/dbraw/zinc/42/53/20/357425320.db2.gz YQPPILHVGODZGU-UONOGXRCSA-N 2 0 242.407 2.169 20 0 BEADRP Cc1ccc(CCC[N@@H+](C)CCC[NH+](C)C)cn1 ZINC000582753323 357380703 /nfs/dbraw/zinc/38/07/03/357380703.db2.gz YGTYHFYGNHQILT-UHFFFAOYSA-N 2 0 249.402 2.206 20 0 BEADRP Cc1ncc(CNc2cc3c(c[nH+]2)CCC3)n1C ZINC000583095112 357478966 /nfs/dbraw/zinc/47/89/66/357478966.db2.gz XDNPSYUOTJSICK-UHFFFAOYSA-N 2 0 242.326 2.224 20 0 BEADRP CC(C)CC[NH+]1CCC([C@H]2CCC[NH2+]2)CC1 ZINC000063197540 357593458 /nfs/dbraw/zinc/59/34/58/357593458.db2.gz JBBVLXGGRYTXHK-CQSZACIVSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH+](C)CCOCC[NH2+][C@H]1CCCC(C)(C)C1 ZINC000231676044 357618243 /nfs/dbraw/zinc/61/82/43/357618243.db2.gz DBDSYGHMNJSRJZ-ZDUSSCGKSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@H]([NH2+]CC1CC[NH2+]CC1)[C@H]1CC1(C)C ZINC000397757176 357675541 /nfs/dbraw/zinc/67/55/41/357675541.db2.gz DGUXIIHDMTZIRT-CMPLNLGQSA-N 2 0 210.365 2.010 20 0 BEADRP CC(C)[NH+](CCSCC[NH+](C)C)C(C)C ZINC000192142656 357824379 /nfs/dbraw/zinc/82/43/79/357824379.db2.gz GZVZARMPNQASCO-UHFFFAOYSA-N 2 0 232.437 2.400 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H](C)c1sc(C)nc1C ZINC000086070548 357818046 /nfs/dbraw/zinc/81/80/46/357818046.db2.gz UUJDSZMFMCCYKP-IUCAKERBSA-N 2 0 241.404 2.266 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H](C)c1sc(C)nc1C ZINC000086070544 357818253 /nfs/dbraw/zinc/81/82/53/357818253.db2.gz UUJDSZMFMCCYKP-DTWKUNHWSA-N 2 0 241.404 2.266 20 0 BEADRP CC[C@@H]([NH2+]CCC[NH+](CC)CC)[C@H]1CCCO1 ZINC000191611577 357778981 /nfs/dbraw/zinc/77/89/81/357778981.db2.gz DYIQLGIZOCPFHD-ZIAGYGMSSA-N 2 0 242.407 2.266 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+]C[C@H]1CCC[C@@H](C)C1 ZINC000234792211 357828735 /nfs/dbraw/zinc/82/87/35/357828735.db2.gz NHVMIWDSWPHATR-RDBSUJKOSA-N 2 0 242.407 2.156 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+][C@@H]1CCCC(C)(C)C1 ZINC000234806016 357830715 /nfs/dbraw/zinc/83/07/15/357830715.db2.gz FZOLRVPOVZCANT-OLZOCXBDSA-N 2 0 242.407 2.299 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+][C@@H]1CC[C@@H](C)C[C@@H]1C ZINC000234808123 357831728 /nfs/dbraw/zinc/83/17/28/357831728.db2.gz QVSMPQDQXSQHAQ-ZOBORPQBSA-N 2 0 242.407 2.155 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+][C@H](C)C1CCCCC1 ZINC000234810193 357831759 /nfs/dbraw/zinc/83/17/59/357831759.db2.gz QFRPXVHUDXXJSW-OCCSQVGLSA-N 2 0 242.407 2.299 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+][C@H](C)CCC(C)C ZINC000234748201 357834295 /nfs/dbraw/zinc/83/42/95/357834295.db2.gz ZTKZJIXWPITSOF-CHWSQXEVSA-N 2 0 230.396 2.155 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+][C@@H](C)CCC(C)C ZINC000234738145 357834771 /nfs/dbraw/zinc/83/47/71/357834771.db2.gz ZTKZJIXWPITSOF-QWHCGFSZSA-N 2 0 230.396 2.155 20 0 BEADRP C[C@H](CCc1ccccc1)[NH2+]C[C@H]1CCC[NH2+]1 ZINC000235425469 357868833 /nfs/dbraw/zinc/86/88/33/357868833.db2.gz TZQRLYFZWULRPA-UKRRQHHQSA-N 2 0 232.371 2.349 20 0 BEADRP C[N@H+](CCC[NH3+])Cc1cccc2cccnc21 ZINC000020246149 357931704 /nfs/dbraw/zinc/93/17/04/357931704.db2.gz HCKUXVRYRMPLIL-UHFFFAOYSA-N 2 0 229.327 2.015 20 0 BEADRP COCc1ccc(C[NH2+][C@H]2CCC[C@H]([NH3+])C2)cc1 ZINC000584517359 358028972 /nfs/dbraw/zinc/02/89/72/358028972.db2.gz VXYYTBQSEBVEFX-GJZGRUSLSA-N 2 0 248.370 2.193 20 0 BEADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)CC2CC2)C1 ZINC000229692385 491119222 /nfs/dbraw/zinc/11/92/22/491119222.db2.gz HRPADKIECJKYNH-JSGCOSHPSA-N 2 0 224.392 2.495 20 0 BEADRP Cc1ccc(CN2CCC[C@H]2C[NH3+])c(C)c1 ZINC000168805579 134247126 /nfs/dbraw/zinc/24/71/26/134247126.db2.gz BMAPWJDSBYMSDL-AWEZNQCLSA-N 2 0 218.344 2.227 20 0 BEADRP C[C@H](Cc1cccs1)[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000168723736 134247287 /nfs/dbraw/zinc/24/72/87/134247287.db2.gz ROZVKNNGDLVYSZ-VXGBXAGGSA-N 2 0 238.400 2.411 20 0 BEADRP Cc1cccc(C[NH2+][C@@H]2CCC[NH2+]CC2)c1 ZINC000168709954 134246557 /nfs/dbraw/zinc/24/65/57/134246557.db2.gz PBNQGKADPWPKGX-CQSZACIVSA-N 2 0 218.344 2.227 20 0 BEADRP C(C[NH2+]C(C1CC1)C1CC1)C[NH+]1CCCC1 ZINC000037466711 358070623 /nfs/dbraw/zinc/07/06/23/358070623.db2.gz FDVXRAXLNIUCAO-UHFFFAOYSA-N 2 0 222.376 2.251 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+]CC2CC2)c2ccccc21 ZINC000169232650 134249770 /nfs/dbraw/zinc/24/97/70/134249770.db2.gz MUEQIPSIOVLDGY-QWHCGFSZSA-N 2 0 202.301 2.131 20 0 BEADRP CSCCC[NH2+][C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000169241954 134250277 /nfs/dbraw/zinc/25/02/77/134250277.db2.gz ROIQVIAFHNZAHT-STQMWFEESA-N 2 0 236.384 2.474 20 0 BEADRP COc1cc(C)ccc1[C@H](C)[NH2+]CCCC[NH3+] ZINC000037715519 358092299 /nfs/dbraw/zinc/09/22/99/358092299.db2.gz VTLRNQFRWVQODH-LBPRGKRZSA-N 2 0 236.359 2.393 20 0 BEADRP CS[C@H](C)C[NH2+][C@H](C)C1CC[NH+](C)CC1 ZINC000090726323 363597352 /nfs/dbraw/zinc/59/73/52/363597352.db2.gz SGNCVLZVJYFPNS-GHMZBOCLSA-N 2 0 230.421 2.058 20 0 BEADRP C[C@H](C[NH2+][C@H](C)Cc1cccs1)C[NH+](C)C ZINC000390372784 491122108 /nfs/dbraw/zinc/12/21/08/491122108.db2.gz WIAAKQJBKNOCTN-VXGBXAGGSA-N 2 0 240.416 2.466 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@H]([NH3+])C1)c1ccncc1 ZINC000086402247 491123823 /nfs/dbraw/zinc/12/38/23/491123823.db2.gz VDNWWONLSFYFKI-WCFLWFBJSA-N 2 0 219.332 2.002 20 0 BEADRP C([C@@H]1CCC[NH2+]C1)[N@H+](C1CC1)C1CCCC1 ZINC000226435590 358339879 /nfs/dbraw/zinc/33/98/79/358339879.db2.gz FNJZHTOBJFDSGU-GFCCVEGCSA-N 2 0 222.376 2.393 20 0 BEADRP C([C@H]1CCC[NH2+]C1)[N@@H+]1CC[C@@H]2CCCC[C@@H]21 ZINC000226437325 358339895 /nfs/dbraw/zinc/33/98/95/358339895.db2.gz FBMBTGOZXWCKOA-IHRRRGAJSA-N 2 0 222.376 2.251 20 0 BEADRP CC(C)[N@H+](CC1CC1)CC1CC[NH2+]CC1 ZINC000042593569 358353150 /nfs/dbraw/zinc/35/31/50/358353150.db2.gz LWIPMEFQGZNCTD-UHFFFAOYSA-N 2 0 210.365 2.106 20 0 BEADRP C[NH+]1CCC(C)(C[NH2+]C(C2CC2)C2CC2)CC1 ZINC000227497636 358358584 /nfs/dbraw/zinc/35/85/84/358358584.db2.gz WKOQKRRAYXZXFF-UHFFFAOYSA-N 2 0 236.403 2.497 20 0 BEADRP COC[C@H]([NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21)C(C)C ZINC000227541425 358359744 /nfs/dbraw/zinc/35/97/44/358359744.db2.gz QLNLWLKGTYEBDZ-ILXRZTDVSA-N 2 0 248.370 2.392 20 0 BEADRP Cc1cccc(C[N@H+](C)CCC[NH3+])c1C ZINC000227744874 358362981 /nfs/dbraw/zinc/36/29/81/358362981.db2.gz VEYKVCXRHNLTKQ-UHFFFAOYSA-N 2 0 206.333 2.084 20 0 BEADRP C[C@@H](CC[N@H+](C)CCC[NH3+])c1ccccc1 ZINC000227744509 358363138 /nfs/dbraw/zinc/36/31/38/358363138.db2.gz KODNGUBUBKGHTO-ZDUSSCGKSA-N 2 0 220.360 2.461 20 0 BEADRP CC[NH+]1CCC(C[NH2+]C2CCSCC2)CC1 ZINC000044517703 358388598 /nfs/dbraw/zinc/38/85/98/358388598.db2.gz DZHYBVYHIHHNLI-UHFFFAOYSA-N 2 0 242.432 2.204 20 0 BEADRP CCC[C@H](C)[NH2+]CC1CC[NH+](CC)CC1 ZINC000044517262 358388817 /nfs/dbraw/zinc/38/88/17/358388817.db2.gz KLZDWACVMQYVJR-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@@H](C)C(C)C)CC1 ZINC000044517468 358388936 /nfs/dbraw/zinc/38/89/36/358388936.db2.gz LRLGGKNFJJUYBA-LBPRGKRZSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1ccncc1 ZINC000044535022 358389680 /nfs/dbraw/zinc/38/96/80/358389680.db2.gz IUUHDEBWQKNNHR-STQMWFEESA-N 2 0 233.359 2.074 20 0 BEADRP CC[C@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)C(C)C ZINC000044533304 358389725 /nfs/dbraw/zinc/38/97/25/358389725.db2.gz TWUMGMMGQQATDM-OLZOCXBDSA-N 2 0 212.381 2.352 20 0 BEADRP CN(C)C1(C[NH2+][C@H]2CCCOCC2)CCCC1 ZINC000132032950 358704264 /nfs/dbraw/zinc/70/42/64/358704264.db2.gz NCGSRVHYPHSKHW-ZDUSSCGKSA-N 2 0 240.391 2.020 20 0 BEADRP C[C@H](c1ccc(F)c(F)c1)[N@H+](C)CCC[NH3+] ZINC000133199220 358748244 /nfs/dbraw/zinc/74/82/44/358748244.db2.gz MKPVCQGVOUAEMX-SECBINFHSA-N 2 0 228.286 2.306 20 0 BEADRP C[C@@H](c1ccc(F)c(F)c1)[N@H+](C)CCC[NH3+] ZINC000133199004 358748293 /nfs/dbraw/zinc/74/82/93/358748293.db2.gz MKPVCQGVOUAEMX-VIFPVBQESA-N 2 0 228.286 2.306 20 0 BEADRP C[N@H+](CCCF)CC[C@@H]1CCCC[NH+]1C ZINC000133836795 358769874 /nfs/dbraw/zinc/76/98/74/358769874.db2.gz UFKSOCAYYMWFSL-LBPRGKRZSA-N 2 0 216.344 2.152 20 0 BEADRP COC[C@@H]([NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1)C(C)C ZINC000623430566 358820041 /nfs/dbraw/zinc/82/00/41/358820041.db2.gz YAQGOOJZSDECMI-CHWSQXEVSA-N 2 0 242.407 2.120 20 0 BEADRP FCCC[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000134870305 358808703 /nfs/dbraw/zinc/80/87/03/358808703.db2.gz VIKBEPBGGQMULS-OCCSQVGLSA-N 2 0 240.366 2.295 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)C2CCCC2)C1 ZINC000054080428 358850906 /nfs/dbraw/zinc/85/09/06/358850906.db2.gz LZAIZORQRWKKMC-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]CC(C2CC2)C2CC2)C1 ZINC000086404707 358968220 /nfs/dbraw/zinc/96/82/20/358968220.db2.gz SXPHMFZZMFGWJD-OLZOCXBDSA-N 2 0 222.376 2.282 20 0 BEADRP CC(C)CC[C@@H]1CC[C@@H]([NH2+]CC2C[NH2+]C2)C1 ZINC000423310721 192697721 /nfs/dbraw/zinc/69/77/21/192697721.db2.gz AVTWDKSCEOZMIZ-TZMCWYRMSA-N 2 0 224.392 2.400 20 0 BEADRP CCCCOCC[NH+]1CCC(CC[NH2+]C)CC1 ZINC000070189922 359044169 /nfs/dbraw/zinc/04/41/69/359044169.db2.gz MAISUEAHKUEYHF-UHFFFAOYSA-N 2 0 242.407 2.125 20 0 BEADRP CC(C)[C@@H]1C[C@H]([NH2+]CCCC[NH+](C)C)CCO1 ZINC000070360764 359051471 /nfs/dbraw/zinc/05/14/71/359051471.db2.gz SBPGHNHEHWLTPF-KGLIPLIRSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H]1Cc2ccc(F)cc2[C@H]1[NH2+]C[C@@H]1CC[NH2+]C1 ZINC000423333658 192713150 /nfs/dbraw/zinc/71/31/50/192713150.db2.gz HZBQNJQDEXIIJH-HFAKWTLXSA-N 2 0 248.345 2.258 20 0 BEADRP [NH3+]CCCC[NH2+][C@H]1CCC[C@@H]1CCCF ZINC000423332280 192713413 /nfs/dbraw/zinc/71/34/13/192713413.db2.gz QRXQXGAQRIHIDS-NEPJUHHUSA-N 2 0 216.344 2.233 20 0 BEADRP C[C@H]([NH2+]CCCC[NH3+])C1C(C)(C)C1(C)C ZINC000423332268 192713506 /nfs/dbraw/zinc/71/35/06/192713506.db2.gz QRABCSXOYHGJMW-JTQLQIEISA-N 2 0 212.381 2.386 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]C[C@H]1CCCS1 ZINC000246482038 359116298 /nfs/dbraw/zinc/11/62/98/359116298.db2.gz GQOHRAQPBBWBEP-FDYHWXHSSA-N 2 0 242.432 2.200 20 0 BEADRP COCCCC[N@H+](C)C1CC[NH+](C(C)C)CC1 ZINC000074353325 359116412 /nfs/dbraw/zinc/11/64/12/359116412.db2.gz XXMJZAXKYBSPAR-UHFFFAOYSA-N 2 0 242.407 2.218 20 0 BEADRP CC(C)C1CC([NH2+]CC2(C)CC[NH2+]CC2)C1 ZINC000423330843 192712223 /nfs/dbraw/zinc/71/22/23/192712223.db2.gz NWDPAAVUMLFKOW-UHFFFAOYSA-N 2 0 224.392 2.400 20 0 BEADRP Cc1cncc([C@H](C)[NH2+]CC2(C)CC[NH2+]CC2)c1 ZINC000423345328 192720145 /nfs/dbraw/zinc/72/01/45/192720145.db2.gz YTCMIDYJTCGEES-ZDUSSCGKSA-N 2 0 247.386 2.430 20 0 BEADRP CO[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1)C(C)(C)C ZINC000247136606 359196665 /nfs/dbraw/zinc/19/66/65/359196665.db2.gz QPQOCXBSLAJZDJ-YNEHKIRRSA-N 2 0 242.407 2.120 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CC2=CC[NH2+]CC2)[C@H](C)C1 ZINC000423345904 192723345 /nfs/dbraw/zinc/72/33/45/192723345.db2.gz OMOZJAIZPRRESD-YRGRVCCFSA-N 2 0 222.376 2.320 20 0 BEADRP CCCCOCC[NH2+][C@H]1CC[N@H+](CC)C[C@H]1C ZINC000247102376 359194343 /nfs/dbraw/zinc/19/43/43/359194343.db2.gz SLKJOVXCXFVEHJ-KGLIPLIRSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@@H]1C[C@@H](C)C[NH+](CC[C@H]2CCC[N@@H+]2C)C1 ZINC000246747033 359160955 /nfs/dbraw/zinc/16/09/55/359160955.db2.gz HNXRRYUWJZSYEN-MGPQQGTHSA-N 2 0 224.392 2.449 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)[C@@H]1C[C@H]1C ZINC000423419042 192749397 /nfs/dbraw/zinc/74/93/97/192749397.db2.gz IHNWFKOMZWFCOH-XVIXHAIJSA-N 2 0 224.392 2.386 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)[C@H]1CC1(C)C ZINC000423445359 192772600 /nfs/dbraw/zinc/77/26/00/192772600.db2.gz RVESXSCXRLBYEP-YXCITZCRSA-N 2 0 236.403 2.399 20 0 BEADRP CC[C@@H]1CC[C@@H](C)C[C@@H]1[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000423449294 192773721 /nfs/dbraw/zinc/77/37/21/192773721.db2.gz GCRUOLWBVSFMQV-TVQXOTEMSA-N 2 0 222.376 2.009 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H]1CC[C@@H]1C1CCC1 ZINC000423452367 192774150 /nfs/dbraw/zinc/77/41/50/192774150.db2.gz JPJUZKVGJQUNRJ-RAIGVLPGSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[C@H]([NH3+])C1)c1ccncc1 ZINC000423465837 192781954 /nfs/dbraw/zinc/78/19/54/192781954.db2.gz HYDHLFMIVWVNMD-OBJOEFQTSA-N 2 0 233.359 2.250 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[C@@H]([NH3+])C1)C1(C)CC1 ZINC000423473770 192785691 /nfs/dbraw/zinc/78/56/91/192785691.db2.gz OBTSELLHXGNVRK-QJPTWQEYSA-N 2 0 210.365 2.282 20 0 BEADRP C(C[NH2+][C@H]1CC[C@H]1C1CC1)C[C@@H]1CCC[NH2+]1 ZINC000423490419 192792252 /nfs/dbraw/zinc/79/22/52/192792252.db2.gz XTQSGQOQEAVZBT-IHRRRGAJSA-N 2 0 222.376 2.297 20 0 BEADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@@H]2CCC23CCCC3)C1 ZINC000423506800 192799017 /nfs/dbraw/zinc/79/90/17/192799017.db2.gz MIKWYZKWAKKRBG-FRRDWIJNSA-N 2 0 222.376 2.426 20 0 BEADRP CC[C@H]([NH2+]CCC1=CC[NH2+]CC1)C1CCC1 ZINC000423540197 192807800 /nfs/dbraw/zinc/80/78/00/192807800.db2.gz QBAHSQATNJYLEY-AWEZNQCLSA-N 2 0 222.376 2.465 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2CCS[C@@H](C)CC2)CC[NH2+]1 ZINC000379545545 359541520 /nfs/dbraw/zinc/54/15/20/359541520.db2.gz YZESPCWETWGNNT-FRRDWIJNSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]C[C@@H]1CC12CCSCC2 ZINC000423564697 192812775 /nfs/dbraw/zinc/81/27/75/192812775.db2.gz YADHTHRCLWTXAS-SRVKXCTJSA-N 2 0 242.432 2.235 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000423559718 192812978 /nfs/dbraw/zinc/81/29/78/192812978.db2.gz UGQFNGBGGBZNDK-ZSAUSMIDSA-N 2 0 236.403 2.399 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000423566413 192815267 /nfs/dbraw/zinc/81/52/67/192815267.db2.gz ZJQOAGHXODJUEG-FAAHXZRKSA-N 2 0 248.370 2.188 20 0 BEADRP C[C@@H](C[NH2+][C@@H](C)C1CC[NH+](C)CC1)C1CC1 ZINC000132958561 491143800 /nfs/dbraw/zinc/14/38/00/491143800.db2.gz QAGWRMDAEJLANU-RYUDHWBXSA-N 2 0 224.392 2.352 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]C[C@H](C)C2CC2)CC1 ZINC000132956813 491143821 /nfs/dbraw/zinc/14/38/21/491143821.db2.gz QOEFZCOXVUFGQB-LBPRGKRZSA-N 2 0 224.392 2.495 20 0 BEADRP CSCC[NH2+][C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000169241650 359877956 /nfs/dbraw/zinc/87/79/56/359877956.db2.gz NORLPCYEWBZECI-RYUDHWBXSA-N 2 0 222.357 2.084 20 0 BEADRP CCC1(CC)CC[N@H+](C[C@@H]2CCC[NH2+]C2)C1 ZINC000087254627 359904374 /nfs/dbraw/zinc/90/43/74/359904374.db2.gz XJBCAXZXKGEGOI-CYBMUJFWSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCCC[C@@H]1C[NH3+])c1ccncc1 ZINC000089139913 359991594 /nfs/dbraw/zinc/99/15/94/359991594.db2.gz OOERCCOLKHSXKL-IACUBPJLSA-N 2 0 233.359 2.250 20 0 BEADRP Cc1cccc(CC[NH2+][C@@H]2CCC[C@@H]2C[NH3+])c1 ZINC000089150525 359993606 /nfs/dbraw/zinc/99/36/06/359993606.db2.gz ADWXGDFNDNTWQZ-HUUCEWRRSA-N 2 0 232.371 2.255 20 0 BEADRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]Cc1ccc(F)cc1F ZINC000089150509 359993743 /nfs/dbraw/zinc/99/37/43/359993743.db2.gz YUVZIHCJVIHTER-NOZJJQNGSA-N 2 0 240.297 2.182 20 0 BEADRP COc1cccc(C[NH2+][C@@H]2CCCC[C@@H]2C[NH3+])c1 ZINC000089144601 359992677 /nfs/dbraw/zinc/99/26/77/359992677.db2.gz HGLJZYKPAIQEFO-UKRRQHHQSA-N 2 0 248.370 2.302 20 0 BEADRP COc1cccc(C[NH2+][C@H]2CCCC[C@H]2C[NH3+])c1 ZINC000089144607 359993164 /nfs/dbraw/zinc/99/31/64/359993164.db2.gz HGLJZYKPAIQEFO-ZFWWWQNUSA-N 2 0 248.370 2.302 20 0 BEADRP CC(C)COCCC[NH2+][C@@H]1CCCC[C@H]1C[NH3+] ZINC000089140452 359993173 /nfs/dbraw/zinc/99/31/73/359993173.db2.gz OWIPJBZMQJSRIS-UONOGXRCSA-N 2 0 242.407 2.156 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@@H]1CC[C@H]1C1CC1 ZINC000309323172 491146857 /nfs/dbraw/zinc/14/68/57/491146857.db2.gz FQTSLOLDAYQWLA-UONOGXRCSA-N 2 0 224.392 2.495 20 0 BEADRP CCC(CC)[N@H+](CCOC)CC[C@@H]1CC[NH2+]C1 ZINC000089749290 360037329 /nfs/dbraw/zinc/03/73/29/360037329.db2.gz PMEDPOWHTMISMZ-ZDUSSCGKSA-N 2 0 242.407 2.123 20 0 BEADRP COC[C@H](C)C[NH2+][C@@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000093516222 360255536 /nfs/dbraw/zinc/25/55/36/360255536.db2.gz WNXBFUHQRUSFIV-RDBSUJKOSA-N 2 0 242.407 2.169 20 0 BEADRP COc1ccc2c(c1)CC[C@H]2[NH2+]CCC[NH+](C)C ZINC000631562360 360986708 /nfs/dbraw/zinc/98/67/08/360986708.db2.gz WVNBHPRFBRIXFS-OAHLLOKOSA-N 2 0 248.370 2.224 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+][C@H]1CCC[C@@H](C)[C@@H]1C ZINC000629407589 361055527 /nfs/dbraw/zinc/05/55/27/361055527.db2.gz FEKBEYQUKKYZEB-QNWJLWSRSA-N 2 0 210.365 2.151 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1[NH2+][C@@H]1CCCC[C@@H]1C ZINC000629390396 361037732 /nfs/dbraw/zinc/03/77/32/361037732.db2.gz DXGNJMGBZWWQMZ-WUHRBBMRSA-N 2 0 210.365 2.295 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1[NH2+][C@H]1CCC[C@H](C)C1 ZINC000629390216 361037888 /nfs/dbraw/zinc/03/78/88/361037888.db2.gz ANRDGSIDMLDRBB-ZDEQEGDKSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@@H](CC1CCCC1)[NH2+]CC1([NH3+])CCOCC1 ZINC000629387859 361040110 /nfs/dbraw/zinc/04/01/10/361040110.db2.gz LLCKFRWVGQYEDU-LBPRGKRZSA-N 2 0 240.391 2.053 20 0 BEADRP CCCC1CCC([NH2+]CCOCC[NH2+]C)CC1 ZINC000629392039 361041426 /nfs/dbraw/zinc/04/14/26/361041426.db2.gz IEBDSAOLSMXOHP-UHFFFAOYSA-N 2 0 242.407 2.171 20 0 BEADRP [NH3+]CCCOCC[NH2+]Cc1ccccc1C1CC1 ZINC000629399197 361046959 /nfs/dbraw/zinc/04/69/59/361046959.db2.gz CQGRDBGYHPDTNB-UHFFFAOYSA-N 2 0 248.370 2.019 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+]C[C@H]1CCCC[C@H]1C ZINC000629408688 361059608 /nfs/dbraw/zinc/05/96/08/361059608.db2.gz YQAPAEYPJJESOA-YVECIDJPSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]1CC[C@@H](NCc2cccc3c2CCC3)C[NH2+]1 ZINC000629418376 361063266 /nfs/dbraw/zinc/06/32/66/361063266.db2.gz XKFSKMJUQQXZOG-SWLSCSKDSA-N 2 0 244.382 2.405 20 0 BEADRP C[C@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)C1CCC1 ZINC000414970568 219885341 /nfs/dbraw/zinc/88/53/41/219885341.db2.gz VDDZDBYUIYSHSO-WCQYABFASA-N 2 0 210.365 2.297 20 0 BEADRP CCC[C@@H](C)CCC[N@@H+]1CC[C@@H](C[NH3+])C1 ZINC000629511420 361105752 /nfs/dbraw/zinc/10/57/52/361105752.db2.gz ILYMBJYWXVFXCP-OLZOCXBDSA-N 2 0 212.381 2.483 20 0 BEADRP CCC[C@@H](C)CCC[N@@H+]1CC[C@H](C[NH3+])C1 ZINC000629511419 361106099 /nfs/dbraw/zinc/10/60/99/361106099.db2.gz ILYMBJYWXVFXCP-CHWSQXEVSA-N 2 0 212.381 2.483 20 0 BEADRP Cc1ccc2ncc(CN(C)CCC[NH3+])cc2c1 ZINC000629515962 361109873 /nfs/dbraw/zinc/10/98/73/361109873.db2.gz XAWYPTMGSFKZEZ-UHFFFAOYSA-N 2 0 243.354 2.324 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1[NH2+][C@H](C)CCC1CC1 ZINC000629526951 361131975 /nfs/dbraw/zinc/13/19/75/361131975.db2.gz FVDANOFZHOXHJU-KGYLQXTDSA-N 2 0 210.365 2.295 20 0 BEADRP CC[C@@H]([NH2+]CCOCC[NH2+]C)c1cccs1 ZINC000629529310 361138786 /nfs/dbraw/zinc/13/87/86/361138786.db2.gz ZCJJMYPPEWACCV-LLVKDONJSA-N 2 0 242.388 2.025 20 0 BEADRP CC[C@@H]1C[C@@H](C)CC[C@@H]1[NH2+]CCOCC[NH2+]C ZINC000629529553 361143461 /nfs/dbraw/zinc/14/34/61/361143461.db2.gz GTEIKJKUDKXVDD-MJBXVCDLSA-N 2 0 242.407 2.027 20 0 BEADRP C[NH2+]CCOCC[NH2+][C@H]1C[C@@H](C)c2ccccc21 ZINC000629530528 361144533 /nfs/dbraw/zinc/14/45/33/361144533.db2.gz JEHMYWIIVYZJLI-DOMZBBRYSA-N 2 0 248.370 2.061 20 0 BEADRP C[NH2+]CCOCC[NH2+][C@@H]1C[C@@H](C)c2ccccc21 ZINC000629530529 361144589 /nfs/dbraw/zinc/14/45/89/361144589.db2.gz JEHMYWIIVYZJLI-IUODEOHRSA-N 2 0 248.370 2.061 20 0 BEADRP C[NH2+]CCOCC[NH2+][C@H]1CCC[C@H](C(C)C)C1 ZINC000629530813 361145876 /nfs/dbraw/zinc/14/58/76/361145876.db2.gz RXLSPDVDCSOKTQ-KBPBESRZSA-N 2 0 242.407 2.027 20 0 BEADRP CCC(F)(F)C(C)(C)C[NH2+][C@H](C)C1C[NH2+]C1 ZINC000629531379 361148933 /nfs/dbraw/zinc/14/89/33/361148933.db2.gz IXKBPSLZDWMYCE-SECBINFHSA-N 2 0 234.334 2.255 20 0 BEADRP Cc1ccc(C(C)(C)C[NH2+][C@@H]2CCC[C@@H]2[NH3+])nc1 ZINC000629525222 361125770 /nfs/dbraw/zinc/12/57/70/361125770.db2.gz WWWIYSOPGNXZNT-QWHCGFSZSA-N 2 0 247.386 2.137 20 0 BEADRP CC[C@H]1CCCC[C@@H]1[NH2+]CC1([NH3+])CCOCC1 ZINC000629524752 361125895 /nfs/dbraw/zinc/12/58/95/361125895.db2.gz OIABDGKTMQRCBO-STQMWFEESA-N 2 0 240.391 2.053 20 0 BEADRP CC[C@@H]1CCC[C@H]1[NH2+][C@@H]1CC[NH2+][C@H]1CC ZINC000629526281 361127418 /nfs/dbraw/zinc/12/74/18/361127418.db2.gz OTEGGOFFBJMZGW-YVECIDJPSA-N 2 0 210.365 2.295 20 0 BEADRP CC[NH2+]CC1CC[NH+](CCSCC)CC1 ZINC000158582899 361204762 /nfs/dbraw/zinc/20/47/62/361204762.db2.gz WRIYQLKNNIYVOS-UHFFFAOYSA-N 2 0 230.421 2.061 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]CC[C@H]1CC1(F)F ZINC000622043657 370674319 /nfs/dbraw/zinc/67/43/19/370674319.db2.gz HBERAUSNUKQYJT-VWYCJHECSA-N 2 0 232.318 2.009 20 0 BEADRP [NH3+]C1(C[NH2+]CCCCOc2ccccc2)CCC1 ZINC000342134345 181331839 /nfs/dbraw/zinc/33/18/39/181331839.db2.gz JZZDAGQEGIVYKY-UHFFFAOYSA-N 2 0 248.370 2.317 20 0 BEADRP COC1(C[C@@H](C)[NH2+][C@@H](C)CC[NH+](C)C)CCC1 ZINC000429524654 201112812 /nfs/dbraw/zinc/11/28/12/201112812.db2.gz XVUKMYMGIMUNMQ-QWHCGFSZSA-N 2 0 242.407 2.264 20 0 BEADRP [NH3+]C1(C[NH2+]CCSc2ccccc2)CCC1 ZINC000342088870 181332478 /nfs/dbraw/zinc/33/24/78/181332478.db2.gz ATGIAIYVCACEIZ-UHFFFAOYSA-N 2 0 236.384 2.250 20 0 BEADRP [NH3+]CCCOCC[NH2+][C@@H]1CCCC12CCCC2 ZINC000629536241 361398669 /nfs/dbraw/zinc/39/86/69/361398669.db2.gz FPXCHJZOGGQPMC-CYBMUJFWSA-N 2 0 240.391 2.054 20 0 BEADRP CC[C@@H]([NH2+]CCOCCC[NH3+])c1ccccc1 ZINC000629536765 361399615 /nfs/dbraw/zinc/39/96/15/361399615.db2.gz GJVOHVRJYWISRJ-CQSZACIVSA-N 2 0 236.359 2.093 20 0 BEADRP CC[C@H]([NH2+]CCOCCC[NH3+])c1cccs1 ZINC000629536802 361399893 /nfs/dbraw/zinc/39/98/93/361399893.db2.gz HNSGRIGHJDGKQH-NSHDSACASA-N 2 0 242.388 2.154 20 0 BEADRP CC(C)[C@@H]1CCC[C@H]([NH2+]CCOCCC[NH3+])C1 ZINC000629536519 361400111 /nfs/dbraw/zinc/40/01/11/361400111.db2.gz GNQMOUOGPWFFCT-KGLIPLIRSA-N 2 0 242.407 2.156 20 0 BEADRP C[C@H]([NH2+]CCOCCC[NH3+])C1C(C)(C)C1(C)C ZINC000629537764 361401122 /nfs/dbraw/zinc/40/11/22/361401122.db2.gz KRBHMPBBBGUCNV-NSHDSACASA-N 2 0 242.407 2.012 20 0 BEADRP C[C@@H]([NH2+]CCOCCC[NH3+])[C@@H]1CCCC[C@H]1C ZINC000629538569 361403896 /nfs/dbraw/zinc/40/38/96/361403896.db2.gz NWPVYKNOZVEMEL-MGPQQGTHSA-N 2 0 242.407 2.156 20 0 BEADRP CC[C@H](C)[C@H]([NH3+])C(=O)Nc1ccc([C@@H](C)[NH3+])cc1 ZINC000429581587 201118134 /nfs/dbraw/zinc/11/81/34/201118134.db2.gz USDHWQPKHDGZCK-CWSCBRNRSA-N 2 0 249.358 2.018 20 0 BEADRP C[C@@H]([NH3+])c1ccc(NC(=O)[C@@H]([NH3+])C(C)(C)C)cc1 ZINC000429593164 201121900 /nfs/dbraw/zinc/12/19/00/201121900.db2.gz VGMGOBHJHVFPPQ-BXKDBHETSA-N 2 0 249.358 2.018 20 0 BEADRP CC[C@H]([NH2+]C1C[C@@H](C)O[C@H](C)C1)[C@@H]1CCC[NH2+]1 ZINC000579461674 366812968 /nfs/dbraw/zinc/81/29/68/366812968.db2.gz MZZRUXTVXZYNEH-RFHZTLPTSA-N 2 0 240.391 2.063 20 0 BEADRP CCC1(CC)[C@@H]([NH2+]CCC[NH+](C)C)C[C@@H]1OC ZINC000181392993 366807114 /nfs/dbraw/zinc/80/71/14/366807114.db2.gz AGNDGOLUKZELMQ-STQMWFEESA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)[C@@H]1CCCO1 ZINC000429978434 201136619 /nfs/dbraw/zinc/13/66/19/201136619.db2.gz DVDPJPPVGNKOTR-RYSNWHEDSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@H](CCCC(F)(F)F)[NH2+][C@@H]1CC[NH2+][C@H]1C ZINC000629544334 361421531 /nfs/dbraw/zinc/42/15/31/361421531.db2.gz JWTNNYUBKWTILG-KXUCPTDWSA-N 2 0 238.297 2.448 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+][C@H](C1CC1)C1CCCC1 ZINC000629544273 361423524 /nfs/dbraw/zinc/42/35/24/361423524.db2.gz HGTVOESKEOTSKD-GDLCADMTSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@@H](N[C@@H]1CC[NH2+][C@H]1C)c1ccc(F)c(F)c1 ZINC000629547066 361430282 /nfs/dbraw/zinc/43/02/82/361430282.db2.gz FTZRJLRYHXAWFA-VYUIOLGVSA-N 2 0 240.297 2.366 20 0 BEADRP C[C@@H]1C[NH+](CC[C@H]2CC[NH2+]C2)C[C@@H](C)C1(F)F ZINC000629554302 361439889 /nfs/dbraw/zinc/43/98/89/361439889.db2.gz ZINSNLOLPXMIFK-IJLUTSLNSA-N 2 0 246.345 2.209 20 0 BEADRP CC(C)C[N@@H+]1CC[C@H](C(F)(F)F)[C@@H](C[NH3+])C1 ZINC000629563981 361458363 /nfs/dbraw/zinc/45/83/63/361458363.db2.gz IUOSXGIKQBVYGU-UWVGGRQHSA-N 2 0 238.297 2.102 20 0 BEADRP C(C[NH+](C1CC1)C1CC1)C1CC[NH2+]CC1 ZINC000629567324 361458778 /nfs/dbraw/zinc/45/87/78/361458778.db2.gz JZTJJNBTODMBGT-UHFFFAOYSA-N 2 0 208.349 2.003 20 0 BEADRP C[C@@H]1CCC[C@H](CC[N@H+](C)CCOCC[NH3+])C1 ZINC000629576873 361467429 /nfs/dbraw/zinc/46/74/29/361467429.db2.gz DRTBLMQPXGDSLA-ZIAGYGMSSA-N 2 0 242.407 2.110 20 0 BEADRP C(C[N@@H+]1CCCC2(CC2)CC1)[C@@H]1CC[NH2+]C1 ZINC000629587077 361475933 /nfs/dbraw/zinc/47/59/33/361475933.db2.gz XOCSIHQXIIQDOK-ZDUSSCGKSA-N 2 0 222.376 2.252 20 0 BEADRP C[C@]12C[NH2+]C[C@@]1(C)C[N@H+](CCCC1CCC1)C2 ZINC000629593162 361484620 /nfs/dbraw/zinc/48/46/20/361484620.db2.gz GTXIMMOHRAYFKN-GASCZTMLSA-N 2 0 236.403 2.498 20 0 BEADRP FC1(F)CCC[N@H+](CC[C@H]2CC[NH2+]C2)CC1 ZINC000629558476 361452658 /nfs/dbraw/zinc/45/26/58/361452658.db2.gz IKGPQARLLCQCLY-LLVKDONJSA-N 2 0 232.318 2.107 20 0 BEADRP CC[C@H](C)[N@@H+]1CC[C@@H](C(F)(F)F)[C@@H](C[NH3+])C1 ZINC000629562479 361456720 /nfs/dbraw/zinc/45/67/20/361456720.db2.gz NJTGPKHQWSSJMX-LPEHRKFASA-N 2 0 238.297 2.244 20 0 BEADRP COC1(C[NH2+]C[C@@H](N)c2ccccc2)CCCC1 ZINC000629647652 361537386 /nfs/dbraw/zinc/53/73/86/361537386.db2.gz DBCVRMANCCFORA-CQSZACIVSA-N 2 0 248.370 2.235 20 0 BEADRP C[C@@]1(C[N@@H+]2CCCC(F)(F)CC2)CC[NH2+]C1 ZINC000629655212 361560234 /nfs/dbraw/zinc/56/02/34/361560234.db2.gz UKMINWLJQPPENA-LLVKDONJSA-N 2 0 232.318 2.107 20 0 BEADRP C[C@@H]([NH3+])c1ccc(C[NH2+]CC2=CCCOC2)cc1 ZINC000629647912 361538764 /nfs/dbraw/zinc/53/87/64/361538764.db2.gz KCEUINMDEUNPBC-GFCCVEGCSA-N 2 0 246.354 2.143 20 0 BEADRP C[C@@H]([NH3+])c1ccc(C[NH2+]Cc2ccn(C)c2)cc1 ZINC000629648669 361541698 /nfs/dbraw/zinc/54/16/98/361541698.db2.gz YTMIPDIPDULOQS-GFCCVEGCSA-N 2 0 243.354 2.335 20 0 BEADRP Cc1ccc(CCC[NH2+][C@@H]2CC[C@H](C)NC2)cn1 ZINC000629659773 361564350 /nfs/dbraw/zinc/56/43/50/361564350.db2.gz GTQPDJHTPKMLHH-DZGCQCFKSA-N 2 0 247.386 2.053 20 0 BEADRP C[C@@H]1C[N@@H+](C[C@@]2(C)CC[NH2+]C2)C[C@H](C)C1(F)F ZINC000629649983 361546062 /nfs/dbraw/zinc/54/60/62/361546062.db2.gz MWPMTDCBVGJAAY-TUAOUCFPSA-N 2 0 246.345 2.209 20 0 BEADRP Cc1cnccc1C[NH2+]Cc1ccc(C[NH3+])cc1 ZINC000629650326 361548507 /nfs/dbraw/zinc/54/85/07/361548507.db2.gz RGHNAFVRJLRAFY-UHFFFAOYSA-N 2 0 241.338 2.139 20 0 BEADRP C[C@@H]1C[C@@H](C[N@@H+]2CCCC(F)(F)CC2)CC[NH2+]1 ZINC000629652788 361551451 /nfs/dbraw/zinc/55/14/51/361551451.db2.gz BIOVLGAXYBWQNA-NEPJUHHUSA-N 2 0 246.345 2.496 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+]CC(C)(C)C)C1 ZINC000163800891 361579497 /nfs/dbraw/zinc/57/94/97/361579497.db2.gz KDMLGBXXXIQIKZ-LBPRGKRZSA-N 2 0 212.381 2.354 20 0 BEADRP CC[C@@H]1CCC[C@H](C[N@H+](C)CCOCC[NH3+])C1 ZINC000629667998 361588372 /nfs/dbraw/zinc/58/83/72/361588372.db2.gz ZAIUKPYABRYGCE-KGLIPLIRSA-N 2 0 242.407 2.110 20 0 BEADRP CC[C@@H]1CCC[C@@H](C[N@H+](C)CCOCC[NH3+])C1 ZINC000629668000 361588681 /nfs/dbraw/zinc/58/86/81/361588681.db2.gz ZAIUKPYABRYGCE-ZIAGYGMSSA-N 2 0 242.407 2.110 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+]C[C@H]1CCC[C@H](C)C1 ZINC000629672447 361614091 /nfs/dbraw/zinc/61/40/91/361614091.db2.gz SDVACCIKBVSEIY-ZDEQEGDKSA-N 2 0 210.365 2.153 20 0 BEADRP C[NH2+]C[C@H]1CC[N@H+](C[C@@H](C)Cc2ccccc2)C1 ZINC000435377071 201264831 /nfs/dbraw/zinc/26/48/31/201264831.db2.gz XUHHPSSGITZWTN-GOEBONIOSA-N 2 0 246.398 2.407 20 0 BEADRP CC[N@H+](Cc1ncccc1C)[C@@H]1CCC[NH2+]CC1 ZINC000435378947 201265363 /nfs/dbraw/zinc/26/53/63/201265363.db2.gz HDTMFFRFMHBKRT-CQSZACIVSA-N 2 0 247.386 2.354 20 0 BEADRP [NH3+]C1CCC([NH2+]C2Cc3ccccc3C2)CC1 ZINC000051693819 181341629 /nfs/dbraw/zinc/34/16/29/181341629.db2.gz KATAMBXSUIXGCV-UHFFFAOYSA-N 2 0 230.355 2.013 20 0 BEADRP C[C@H]([NH2+]CCC[NH+]1CCCCC1)[C@@H]1CCCO1 ZINC000154413634 201277520 /nfs/dbraw/zinc/27/75/20/201277520.db2.gz HTCLUIDSMNLLHL-KBPBESRZSA-N 2 0 240.391 2.020 20 0 BEADRP c1cc(C[C@@H]2CC[NH2+]C2)cc(C2=CC[NH2+]CC2)c1 ZINC000629723536 361664727 /nfs/dbraw/zinc/66/47/27/361664727.db2.gz OOCCITWDGHQFSN-AWEZNQCLSA-N 2 0 242.366 2.215 20 0 BEADRP c1cc(C2=CC[NH2+]CC2)cc(C2=CC[NH2+]CC2)c1 ZINC000629723937 361665837 /nfs/dbraw/zinc/66/58/37/361665837.db2.gz URJORGRIOXPDGV-UHFFFAOYSA-N 2 0 240.350 2.440 20 0 BEADRP CC[C@@H]1Cc2c(cccc2C2=CC[NH2+]CC2)C[NH2+]1 ZINC000629723621 361666097 /nfs/dbraw/zinc/66/60/97/361666097.db2.gz QSBUBCZGIUQSAG-CQSZACIVSA-N 2 0 242.366 2.488 20 0 BEADRP CC[N@H+](CCC(F)(F)F)[C@H]1CCC[NH2+]CC1 ZINC000435626916 201278555 /nfs/dbraw/zinc/27/85/55/201278555.db2.gz LZSOHVMLLSXHLX-JTQLQIEISA-N 2 0 238.297 2.403 20 0 BEADRP CC[N@H+](Cc1cccc(N)c1)[C@H]1CCC[NH2+]CC1 ZINC000435612985 201278722 /nfs/dbraw/zinc/27/87/22/201278722.db2.gz ILJZADQUCNMDIZ-HNNXBMFYSA-N 2 0 247.386 2.233 20 0 BEADRP CC[N@H+](CCCOC(C)C)[C@H]1CCC[NH2+]CC1 ZINC000435615275 201279708 /nfs/dbraw/zinc/27/97/08/201279708.db2.gz PCKWINQKMTZFBF-AWEZNQCLSA-N 2 0 242.407 2.266 20 0 BEADRP CC[N@H+](CCCCCOC)[C@H]1CCC[NH2+]CC1 ZINC000435612307 201279933 /nfs/dbraw/zinc/27/99/33/201279933.db2.gz FMQIEEOGWYDWAB-AWEZNQCLSA-N 2 0 242.407 2.267 20 0 BEADRP C[NH2+]CCC[N@H+](C[C@H]1CCCO1)C1CCCC1 ZINC000435881571 201290548 /nfs/dbraw/zinc/29/05/48/201290548.db2.gz VMTOSGCLSAVZDG-CQSZACIVSA-N 2 0 240.391 2.020 20 0 BEADRP C[NH2+]CCC[N@@H+]1Cc2ccccc2C[C@H]1C ZINC000435878765 201292460 /nfs/dbraw/zinc/29/24/60/201292460.db2.gz FUUWPMKIGYSZES-GFCCVEGCSA-N 2 0 218.344 2.043 20 0 BEADRP C[NH2+]CCC[N@@H+]1C[C@@H](c2ccccc2)C[C@@H]1C ZINC000435871734 201293041 /nfs/dbraw/zinc/29/30/41/201293041.db2.gz LJDMVYQHYQLNOR-ZFWWWQNUSA-N 2 0 232.371 2.474 20 0 BEADRP CCC[C@@H](Cc1ccccc1)[NH2+]CCC[NH3+] ZINC000437769472 201372345 /nfs/dbraw/zinc/37/23/45/201372345.db2.gz FFNYCGGARSPUKG-AWEZNQCLSA-N 2 0 220.360 2.336 20 0 BEADRP C[C@@H](CC1CCOCC1)[NH2+]C1CCC([NH3+])CC1 ZINC000437797170 201374227 /nfs/dbraw/zinc/37/42/27/201374227.db2.gz IFBJZIIWDDTZDI-XGNXJENSSA-N 2 0 240.391 2.051 20 0 BEADRP [NH3+]CCC[NH2+][C@H]1CCC[C@H]1c1ccc(F)cc1 ZINC000437793041 201375198 /nfs/dbraw/zinc/37/51/98/201375198.db2.gz MSIDOQKCNOZYRK-KBPBESRZSA-N 2 0 236.334 2.400 20 0 BEADRP CC[NH+](CC)CCC[N@@H+]1CCC[C@@H](C)C1 ZINC000170793360 364245206 /nfs/dbraw/zinc/24/52/06/364245206.db2.gz ROUJKXLTOJKVGX-CYBMUJFWSA-N 2 0 212.381 2.450 20 0 BEADRP CSC[C@H](C)[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@H]1C ZINC000133964885 364381215 /nfs/dbraw/zinc/38/12/15/364381215.db2.gz QAFINOGIMHLPGJ-WRWGMCAJSA-N 2 0 230.421 2.056 20 0 BEADRP CC[NH+]1CCC([NH2+]CCC(C)(F)F)CC1 ZINC000357707935 366863650 /nfs/dbraw/zinc/86/36/50/366863650.db2.gz KFQFYZIALLDWAL-UHFFFAOYSA-N 2 0 220.307 2.106 20 0 BEADRP CCOC1CC([NH2+]CCCC[N@H+](C)C2CC2)C1 ZINC000453408750 202764971 /nfs/dbraw/zinc/76/49/71/202764971.db2.gz SXEUSKRATGBXGM-UHFFFAOYSA-N 2 0 240.391 2.018 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1CCCc2c(OC)cccc21 ZINC000573315677 364795144 /nfs/dbraw/zinc/79/51/44/364795144.db2.gz PNQQJEKBFDUIAT-CQSZACIVSA-N 2 0 248.370 2.272 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]CCCNc2ccccc2)C1 ZINC000573742776 364907720 /nfs/dbraw/zinc/90/77/20/364907720.db2.gz ZBMBYCGPSUHOLH-HIFRSBDPSA-N 2 0 247.386 2.348 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@H]2Cc3ccccc32)CC[N@@H+]1C ZINC000247118866 541416372 /nfs/dbraw/zinc/41/63/72/541416372.db2.gz UJPRUQVFDISSBM-BPLDGKMQSA-N 2 0 244.382 2.399 20 0 BEADRP [NH3+]CCC[N@H+](Cc1ccc(F)cc1)C1CC1 ZINC000036732078 181379943 /nfs/dbraw/zinc/37/99/43/181379943.db2.gz DOVHTGOBZQAMGN-UHFFFAOYSA-N 2 0 222.307 2.139 20 0 BEADRP CC(C)C[N@H+](C)CCC[NH+]1CCCCC1 ZINC000444574280 193050542 /nfs/dbraw/zinc/05/05/42/193050542.db2.gz PHMHDRBPICPCIN-UHFFFAOYSA-N 2 0 212.381 2.450 20 0 BEADRP CC[C@@H]([NH2+]CCC[NH+]1CCCC1)[C@@H]1CCCO1 ZINC000182330852 366887127 /nfs/dbraw/zinc/88/71/27/366887127.db2.gz CUKRRPJXKRCUNA-KGLIPLIRSA-N 2 0 240.391 2.020 20 0 BEADRP C[N@H+](CCC[NH3+])CC1CCC(C)(C)CC1 ZINC000379890394 365337795 /nfs/dbraw/zinc/33/77/95/365337795.db2.gz ZZTZDFVIGXJQKP-UHFFFAOYSA-N 2 0 212.381 2.483 20 0 BEADRP CC[C@H]([NH2+]CC[C@@H]1CCC[N@@H+]1C)[C@@H]1CCCO1 ZINC000182264430 366879186 /nfs/dbraw/zinc/87/91/86/366879186.db2.gz OPIULKKYDMHDCR-IHRRRGAJSA-N 2 0 240.391 2.018 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000575871284 365397217 /nfs/dbraw/zinc/39/72/17/365397217.db2.gz BAUJEVQTHLLXBR-KGLIPLIRSA-N 2 0 236.403 2.497 20 0 BEADRP C[N@H+](CC[C@@H]1CCC[NH2+]C1)Cc1cccc(O)c1 ZINC000576016231 365452190 /nfs/dbraw/zinc/45/21/90/365452190.db2.gz NLAIXZSVWJXSPF-ZDUSSCGKSA-N 2 0 248.370 2.214 20 0 BEADRP COCC[C@@H](C)[NH2+]CC[C@@H](C)[NH+]1CCCCC1 ZINC000184509158 367080952 /nfs/dbraw/zinc/08/09/52/367080952.db2.gz RXKYJFXLVJEERP-ZIAGYGMSSA-N 2 0 242.407 2.266 20 0 BEADRP CC(C)C[C@@H](N)C[N@@H+]1C[C@@H](C)CC1(C)C ZINC000380576897 367245986 /nfs/dbraw/zinc/24/59/86/367245986.db2.gz VIWIKQWORONPNJ-NWDGAFQWSA-N 2 0 212.381 2.480 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@@H](C)C(C)(C)CC ZINC000581304714 367333924 /nfs/dbraw/zinc/33/39/24/367333924.db2.gz CJZLLZJOGUBTQI-MNOVXSKESA-N 2 0 200.370 2.399 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[C@@H]([NH3+])C1)c1ccoc1 ZINC000581185198 367285847 /nfs/dbraw/zinc/28/58/47/367285847.db2.gz GIVUDSVPLZCSTI-GMXVVIOVSA-N 2 0 222.332 2.448 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[NH2+]C1)[C@@H]1CC2CCC1CC2 ZINC000382203939 367498243 /nfs/dbraw/zinc/49/82/43/367498243.db2.gz SBCVHUPVBMGWSG-MGYRSQIZSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]C[C@@H]1CCCC1(F)F ZINC000381833842 367460494 /nfs/dbraw/zinc/46/04/94/367460494.db2.gz GLFNUFFZEGEUEW-WOPDTQHZSA-N 2 0 246.345 2.352 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H]1CC12CC2 ZINC000581424107 367465445 /nfs/dbraw/zinc/46/54/45/367465445.db2.gz WEIPMPADMSFXCD-GXFFZTMASA-N 2 0 231.343 2.052 20 0 BEADRP CC[C@H]([NH2+]CCC[NH2+]C1CC1)C1CCC1 ZINC000382587890 367544761 /nfs/dbraw/zinc/54/47/61/367544761.db2.gz VZRYRLUZRYBFGY-ZDUSSCGKSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]1CCCC[C@@H]1[NH2+]CCC[NH2+]C1CC1 ZINC000382602025 367547951 /nfs/dbraw/zinc/54/79/51/367547951.db2.gz SLNHVBZATCPRIT-AAEUAGOBSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]1CCCC[C@H]1[NH2+]CCC[NH2+]C1CC1 ZINC000382602027 367548623 /nfs/dbraw/zinc/54/86/23/367548623.db2.gz SLNHVBZATCPRIT-WCQYABFASA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@@H]([NH2+]C1CC[NH2+]CC1)C1CCCC1 ZINC000382784984 367556768 /nfs/dbraw/zinc/55/67/68/367556768.db2.gz JVVPUYKJTVIBEC-CYBMUJFWSA-N 2 0 210.365 2.297 20 0 BEADRP CCC(C)(C)[C@@H](C)[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000565710420 325946578 /nfs/dbraw/zinc/94/65/78/325946578.db2.gz RCAIZGXKQCXDAU-NEPJUHHUSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H](c1ccncc1)[N@H+](C)C[C@H]1CC[NH2+][C@H](C)C1 ZINC000383922999 367660247 /nfs/dbraw/zinc/66/02/47/367660247.db2.gz HXOXLXGVPCRTBH-MCIONIFRSA-N 2 0 247.386 2.463 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@@H]1CCCSC1 ZINC000384175985 367674598 /nfs/dbraw/zinc/67/45/98/367674598.db2.gz VNMJSDOKGNSFRH-NEPJUHHUSA-N 2 0 230.421 2.237 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCC[NH+]2CCCCC2)[C@H](C)O1 ZINC000385004769 367770816 /nfs/dbraw/zinc/77/08/16/367770816.db2.gz WEJBSAMKUBYYPR-HZSPNIEDSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@H](CCCO)C[NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000384661496 367712952 /nfs/dbraw/zinc/71/29/52/367712952.db2.gz BHHYIPFWWQTSEQ-DFBGVHRSSA-N 2 0 248.370 2.129 20 0 BEADRP C[C@H](CCCO)C[NH2+][C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000384661498 367713461 /nfs/dbraw/zinc/71/34/61/367713461.db2.gz BHHYIPFWWQTSEQ-UGFHNGPFSA-N 2 0 248.370 2.129 20 0 BEADRP CC[NH2+]CC1CC[NH+](Cc2ccncc2C)CC1 ZINC000385082744 367787041 /nfs/dbraw/zinc/78/70/41/367787041.db2.gz ZEGYYUBCNQTGQI-UHFFFAOYSA-N 2 0 247.386 2.212 20 0 BEADRP CSc1ccc(C[N@H+](C)C2CC([NH3+])C2)cc1 ZINC000385099299 367790508 /nfs/dbraw/zinc/79/05/08/367790508.db2.gz ZJAOOPSWGNBIBF-UHFFFAOYSA-N 2 0 236.384 2.330 20 0 BEADRP Cc1cnccc1C[NH2+]C[C@@H]1CC[N@@H+](C(C)C)C1 ZINC000385175751 367804616 /nfs/dbraw/zinc/80/46/16/367804616.db2.gz MTIKGMOLGJIFLM-AWEZNQCLSA-N 2 0 247.386 2.210 20 0 BEADRP CSCC1CCC([NH2+][C@H](C)[C@H](C)[NH3+])CC1 ZINC000385864406 367871145 /nfs/dbraw/zinc/87/11/45/367871145.db2.gz STCINPPKCRNPHI-DMOGRIERSA-N 2 0 230.421 2.234 20 0 BEADRP C[C@H]([N@H+](C)C[C@H]1CC[NH2+][C@H](C)C1)C1(C)CC1 ZINC000385481897 367835279 /nfs/dbraw/zinc/83/52/79/367835279.db2.gz YUGXCMWLKUZVIN-AGIUHOORSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCC[C@H]2C[NH3+])[C@H]1C ZINC000385617902 367847193 /nfs/dbraw/zinc/84/71/93/367847193.db2.gz ICDWINKKKHJHTB-SJHCENCUSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@@]2(C)CCC[NH2+]C2)[C@H]1C ZINC000386090845 367911311 /nfs/dbraw/zinc/91/13/11/367911311.db2.gz FVSQYSOAOFXZSM-VOAKCMCISA-N 2 0 210.365 2.010 20 0 BEADRP CCCCOCCC[NH2+][C@@H](C)[C@@H]1CCCC[NH2+]1 ZINC000386367309 367956808 /nfs/dbraw/zinc/95/68/08/367956808.db2.gz AUKLDDMUSMSKOF-KBPBESRZSA-N 2 0 242.407 2.313 20 0 BEADRP C[C@H](NCCc1ccccc1)[C@@H]1CCCC[NH2+]1 ZINC000386612498 368001407 /nfs/dbraw/zinc/00/14/07/368001407.db2.gz WVZWSYKKDJXZSA-ZFWWWQNUSA-N 2 0 232.371 2.349 20 0 BEADRP COCCC(C)(C)C[NH2+][C@H](C)[C@@H]1CCCC[NH2+]1 ZINC000386468229 367978890 /nfs/dbraw/zinc/97/88/90/367978890.db2.gz QCCSVSIAFMCKPI-OLZOCXBDSA-N 2 0 242.407 2.169 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@H]1CC12CCCC2 ZINC000386904377 368034329 /nfs/dbraw/zinc/03/43/29/368034329.db2.gz BUBLCZZBUMNFJI-RYUDHWBXSA-N 2 0 210.365 2.426 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CC12CCCC2 ZINC000387025119 368041788 /nfs/dbraw/zinc/04/17/88/368041788.db2.gz NGAYLCGCKNEZAR-RWMBFGLXSA-N 2 0 222.376 2.426 20 0 BEADRP CC[C@H]([NH2+][C@H](C)C[C@H]1CCCCC[NH2+]1)[C@@H](C)O ZINC000386835790 368025500 /nfs/dbraw/zinc/02/55/00/368025500.db2.gz IOKZGIZXRVLWKV-SYQHCUMBSA-N 2 0 242.407 2.046 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC12CCCC2 ZINC000387155261 368072296 /nfs/dbraw/zinc/07/22/96/368072296.db2.gz QAVXEBPTMQLYIX-SDDRHHMPSA-N 2 0 208.349 2.036 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H]2CC[NH2+]CC[C@H]2C)o1 ZINC000581997320 368098318 /nfs/dbraw/zinc/09/83/18/368098318.db2.gz WOCVBBBMJKYFMA-BXUZGUMPSA-N 2 0 236.359 2.108 20 0 BEADRP C[NH+](C)CCCC(C)(C)[NH2+]Cc1cccnc1 ZINC000387354783 368158458 /nfs/dbraw/zinc/15/84/58/368158458.db2.gz SUFGVRJYSKTZAZ-UHFFFAOYSA-N 2 0 235.375 2.292 20 0 BEADRP C[C@@H](C[N@H+](C)C[C@@H]1CC[NH2+]C1)C(C)(C)C ZINC000399697689 368487033 /nfs/dbraw/zinc/48/70/33/368487033.db2.gz BLUJAYOHLSOWSY-NWDGAFQWSA-N 2 0 212.381 2.210 20 0 BEADRP Cc1ccc(CCN[C@H](C)[C@H]2CCCC[NH2+]2)o1 ZINC000567260373 326152227 /nfs/dbraw/zinc/15/22/27/326152227.db2.gz PZTNGAJHAZMDBF-TZMCWYRMSA-N 2 0 236.359 2.251 20 0 BEADRP Cc1cc(C)c(C[N@@H+]2CC[C@H]([NH3+])[C@@H](C)C2)c(C)n1 ZINC000631821613 368973197 /nfs/dbraw/zinc/97/31/97/368973197.db2.gz DGOPOYZBPSHHRH-NHYWBVRUSA-N 2 0 247.386 2.176 20 0 BEADRP Cc1cnccc1C[NH2+]C[C@@H]1CCCC[N@@H+](C)C1 ZINC000623657449 368998114 /nfs/dbraw/zinc/99/81/14/368998114.db2.gz RCKIVWFEQBFODX-AWEZNQCLSA-N 2 0 247.386 2.212 20 0 BEADRP [NH3+][C@@H]1CCCC[C@H]1[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC000631829396 369005109 /nfs/dbraw/zinc/00/51/09/369005109.db2.gz PROHAYICPURBFD-GMTAPVOTSA-N 2 0 232.318 2.281 20 0 BEADRP Cc1ccc(C[N@H+]2C[C@H](C)[C@H](C[NH3+])C2)c(C)c1 ZINC000631837281 369096300 /nfs/dbraw/zinc/09/63/00/369096300.db2.gz QPGYCBVYQTXIHP-DZGCQCFKSA-N 2 0 232.371 2.330 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)C1CC1 ZINC000459779698 203366315 /nfs/dbraw/zinc/36/63/15/203366315.db2.gz LNDYZWCONYDWEF-RYUDHWBXSA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)C2CC2)C1 ZINC000165293292 203383857 /nfs/dbraw/zinc/38/38/57/203383857.db2.gz VKQGXOPBVUMMTB-STQMWFEESA-N 2 0 224.392 2.495 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)C2CC2)C1 ZINC000165265670 203384262 /nfs/dbraw/zinc/38/42/62/203384262.db2.gz XHSPPKIHNBZQIZ-RYUDHWBXSA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)OC[C@@H](C)[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC000459784001 203368730 /nfs/dbraw/zinc/36/87/30/203368730.db2.gz NSWPMSRNVOFYRG-ZIAGYGMSSA-N 2 0 242.407 2.121 20 0 BEADRP C[N@@H+]1CCC[C@@H](CC[NH2+]C[C@H]2CCSC2)C1 ZINC000459794363 203370647 /nfs/dbraw/zinc/37/06/47/203370647.db2.gz UMBJWLKKCMPLEN-QWHCGFSZSA-N 2 0 242.432 2.061 20 0 BEADRP C[N@@H+]1CCC[C@H](CC[NH2+]C[C@H]2CCSC2)C1 ZINC000459794361 203370993 /nfs/dbraw/zinc/37/09/93/203370993.db2.gz UMBJWLKKCMPLEN-CHWSQXEVSA-N 2 0 242.432 2.061 20 0 BEADRP CCCc1ccc(C[NH+]2C[C@H]3C[NH2+]C[C@@H]3C2)cc1 ZINC000620278348 369794822 /nfs/dbraw/zinc/79/48/22/369794822.db2.gz NVKHDLAONOFRHR-HZPDHXFCSA-N 2 0 244.382 2.290 20 0 BEADRP CC1CC(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)C1 ZINC000621384335 370328272 /nfs/dbraw/zinc/32/82/72/370328272.db2.gz CCIHNBZXGNMDBN-NWINJMCUSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CC[C@@H]2CC2(F)F)CC[N@@H+]1C ZINC000621770569 370512766 /nfs/dbraw/zinc/51/27/66/370512766.db2.gz TWRSSIHORPTSIH-MXWKQRLJSA-N 2 0 232.318 2.104 20 0 BEADRP CC1CC(C[NH2+][C@@H]2CC[N@H+](C)[C@@H]3CCC[C@@H]32)C1 ZINC000621770700 370513515 /nfs/dbraw/zinc/51/35/15/370513515.db2.gz WFDRFPFFVSSKDE-CLACGNGHSA-N 2 0 236.403 2.495 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CC[C@@H]2CC2(F)F)[C@H](C)C1 ZINC000621734733 370491759 /nfs/dbraw/zinc/49/17/59/370491759.db2.gz VBKKYYBHNVFCTK-UTUOFQBUSA-N 2 0 246.345 2.352 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CC[C@@H]2CC2(F)F)[C@@H](C)C1 ZINC000621734732 370491943 /nfs/dbraw/zinc/49/19/43/370491943.db2.gz VBKKYYBHNVFCTK-TUAOUCFPSA-N 2 0 246.345 2.352 20 0 BEADRP [NH3+][C@]12CCC[C@H]1C[N@H+](CCc1ccccc1)C2 ZINC000621779042 370528315 /nfs/dbraw/zinc/52/83/15/370528315.db2.gz YXGQNIDZNHJHRW-GJZGRUSLSA-N 2 0 230.355 2.042 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+][C@H](C)[C@H]1CCCCO1 ZINC000623858810 371129280 /nfs/dbraw/zinc/12/92/80/371129280.db2.gz WOMFMHBBQFCXKY-ZIAGYGMSSA-N 2 0 242.407 2.264 20 0 BEADRP CCC(CC)[NH2+]C[C@@H]1CCCC[N@H+](C)C1 ZINC000624120452 371321102 /nfs/dbraw/zinc/32/11/02/371321102.db2.gz ZLROMBRVIKKLNY-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP CC(C)[C@@H](C)[NH2+]C[C@H]1CCCC[N@H+](C)C1 ZINC000624120445 371321263 /nfs/dbraw/zinc/32/12/63/371321263.db2.gz ZKEXPWFGPDJRIO-CHWSQXEVSA-N 2 0 212.381 2.352 20 0 BEADRP CCC(CC)[NH2+]C[C@H]1CCCC[N@H+](C)C1 ZINC000624120451 371321921 /nfs/dbraw/zinc/32/19/21/371321921.db2.gz ZLROMBRVIKKLNY-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP Cc1cc(CNCCC[N@@H+](C)CC(C)C)on1 ZINC000631167662 372215582 /nfs/dbraw/zinc/21/55/82/372215582.db2.gz OZJCRGYDDVOMQP-UHFFFAOYSA-N 2 0 239.363 2.051 20 0 BEADRP C[C@@H](C[NH2+][C@H]1CCCc2ncccc21)C[NH+](C)C ZINC000631629759 372468973 /nfs/dbraw/zinc/46/89/73/372468973.db2.gz DGZYRUYANXHKCY-WFASDCNBSA-N 2 0 247.386 2.246 20 0 BEADRP C[C@@H](C[NH2+][C@@H]1CCCc2ncccc21)C[NH+](C)C ZINC000631629758 372469829 /nfs/dbraw/zinc/46/98/29/372469829.db2.gz DGZYRUYANXHKCY-SWLSCSKDSA-N 2 0 247.386 2.246 20 0 BEADRP C[C@@H](c1ccncc1)N1CCCCC[C@H]([NH3+])C1 ZINC000631834324 372619189 /nfs/dbraw/zinc/61/91/89/372619189.db2.gz VBHAMWJUZCCCNC-JSGCOSHPSA-N 2 0 233.359 2.346 20 0 BEADRP C[C@@H](c1ccccn1)N1CCCCC[C@@H]([NH3+])C1 ZINC000631834281 372619233 /nfs/dbraw/zinc/61/92/33/372619233.db2.gz UBYWLOYZHIJNRQ-QWHCGFSZSA-N 2 0 233.359 2.346 20 0 BEADRP CC[NH2+]CCN1CC[C@H]2CCCC[C@H]2C1 ZINC000245225386 373198743 /nfs/dbraw/zinc/19/87/43/373198743.db2.gz UFUBHSPJVRCYBR-OLZOCXBDSA-N 2 0 210.365 2.108 20 0 BEADRP CSC1(C[NH2+]CC[C@H]2CCC[N@H+](C)C2)CC1 ZINC000459784601 206016453 /nfs/dbraw/zinc/01/64/53/206016453.db2.gz OCGVQQDXSREGOF-GFCCVEGCSA-N 2 0 242.432 2.204 20 0 BEADRP CSC1(C[NH2+]CC[C@@H]2CCC[N@H+](C)C2)CC1 ZINC000459784603 206016556 /nfs/dbraw/zinc/01/65/56/206016556.db2.gz OCGVQQDXSREGOF-LBPRGKRZSA-N 2 0 242.432 2.204 20 0 BEADRP CCC[C@@H](C)C[NH+]1CCC2(CC[NH2+]C2)CC1 ZINC000430915578 206062628 /nfs/dbraw/zinc/06/26/28/206062628.db2.gz QPTHCZJLYGJZPD-CYBMUJFWSA-N 2 0 224.392 2.498 20 0 BEADRP CCCC[C@H](C)[N@H+](C)CCc1cncn1C ZINC000459497239 206131273 /nfs/dbraw/zinc/13/12/73/206131273.db2.gz IWIXHTNUKXASGN-LBPRGKRZSA-N 2 0 223.364 2.473 20 0 BEADRP C[C@@H](CC[NH3+])[NH2+]Cc1coc2ccccc12 ZINC000220512828 134309705 /nfs/dbraw/zinc/30/97/05/134309705.db2.gz PAHYPLOHNGHXBX-JTQLQIEISA-N 2 0 218.300 2.260 20 0 BEADRP CCC[N@H+](C)C[C@H]1CC[NH+](CCC2CC2)C1 ZINC000336668548 169078253 /nfs/dbraw/zinc/07/82/53/169078253.db2.gz PCQOUJZYDNKCQT-CQSZACIVSA-N 2 0 224.392 2.450 20 0 BEADRP CCC[N@H+](CC)CCNC(=[NH2+])Nc1ccccc1 ZINC000081781430 169120262 /nfs/dbraw/zinc/12/02/62/169120262.db2.gz LUGFDRNPAXZQRH-UHFFFAOYSA-N 2 0 248.374 2.355 20 0 BEADRP CCC[N@H+](CCC(C)C)C1CC[NH2+]CC1 ZINC000037653863 169139689 /nfs/dbraw/zinc/13/96/89/169139689.db2.gz BUAKKPGKURUIER-UHFFFAOYSA-N 2 0 212.381 2.497 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H](C)C(C)C)CC1 ZINC000020189759 169189872 /nfs/dbraw/zinc/18/98/72/169189872.db2.gz KRXRSZZRQWLKMB-LBPRGKRZSA-N 2 0 212.381 2.495 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H]2C[C@@H](C)[C@H]2C)CC1 ZINC000309428920 169190043 /nfs/dbraw/zinc/19/00/43/169190043.db2.gz YWQOZTAOPPLOIS-YRGRVCCFSA-N 2 0 224.392 2.495 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H](C)C2CC2)CC1 ZINC000020189721 169190382 /nfs/dbraw/zinc/19/03/82/169190382.db2.gz UMGXLDAKCAPAJL-LLVKDONJSA-N 2 0 210.365 2.249 20 0 BEADRP c1c[nH]c([C@@H]2CCC[N@@H+](CCOCC3CC3)C2)n1 ZINC000336732548 183327343 /nfs/dbraw/zinc/32/73/43/183327343.db2.gz SMDSEQURLSJECE-CYBMUJFWSA-N 2 0 249.358 2.016 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+]CC2(SC)CC2)C1 ZINC000336775835 169206858 /nfs/dbraw/zinc/20/68/58/169206858.db2.gz CURNRDASJNVYAR-LBPRGKRZSA-N 2 0 242.432 2.204 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+]C2CC(C)(C)C2)C1 ZINC000336781279 169207600 /nfs/dbraw/zinc/20/76/00/169207600.db2.gz UFNCUIPRWCHFME-LBPRGKRZSA-N 2 0 224.392 2.497 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+]C[C@H]2CCSC2)C1 ZINC000309942947 169207933 /nfs/dbraw/zinc/20/79/33/169207933.db2.gz CGXZLYTYHQSSOW-CHWSQXEVSA-N 2 0 242.432 2.061 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](C)C(C)(C)OC)C1 ZINC000340197241 169208463 /nfs/dbraw/zinc/20/84/63/169208463.db2.gz DRSAVNJZBYNLOT-CHWSQXEVSA-N 2 0 242.407 2.121 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)C(C)(C)OC)C1 ZINC000340197244 169209310 /nfs/dbraw/zinc/20/93/10/169209310.db2.gz DRSAVNJZBYNLOT-QWHCGFSZSA-N 2 0 242.407 2.121 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CCC2(C)C)C1 ZINC000309946591 169209471 /nfs/dbraw/zinc/20/94/71/169209471.db2.gz DOXOSQANLWWOOE-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP c1ccc(C2CC[NH+](C[C@H]3CC[NH2+]C3)CC2)cc1 ZINC000169798599 183390696 /nfs/dbraw/zinc/39/06/96/183390696.db2.gz OHMAMUXDYVWLOM-AWEZNQCLSA-N 2 0 244.382 2.476 20 0 BEADRP c1ccc2c(c1)CC[C@H]([NH2+]C[C@@H]1CCC[NH2+]C1)C2 ZINC000132241351 183446141 /nfs/dbraw/zinc/44/61/41/183446141.db2.gz KUATWQTZEKAICM-CJNGLKHVSA-N 2 0 244.382 2.133 20 0 BEADRP CCC[C@@H](C)[NH2+]CCCn1ccnc1C ZINC000268846630 169369467 /nfs/dbraw/zinc/36/94/67/169369467.db2.gz JCRAPOQSVJVQNH-LLVKDONJSA-N 2 0 209.337 2.360 20 0 BEADRP CCC[C@@H](C)C[N@@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000336656405 169358107 /nfs/dbraw/zinc/35/81/07/169358107.db2.gz LFMMKJKHLZKALP-CYBMUJFWSA-N 2 0 224.392 2.498 20 0 BEADRP CO[C@H](C)C[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000182384415 134344745 /nfs/dbraw/zinc/34/47/45/134344745.db2.gz BGMXSJDGVIPULZ-CYBMUJFWSA-N 2 0 242.407 2.075 20 0 BEADRP CCC[C@H](C)C[N@@H+]1C[C@@H]2CC[C@@H]([NH3+])[C@@H]2C1 ZINC000336712251 169481887 /nfs/dbraw/zinc/48/18/87/169481887.db2.gz UXNXDUWPIJSGEL-WUHRBBMRSA-N 2 0 210.365 2.092 20 0 BEADRP CC(C)C[C@@H](C[NH2+]C[C@H]1CCSC1)N(C)C ZINC000224307742 134345977 /nfs/dbraw/zinc/34/59/77/134345977.db2.gz WSKJQQXTTRIFIC-OLZOCXBDSA-N 2 0 244.448 2.305 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@@]2(C)CCCS2)CC[N@@H+]1C ZINC000224566552 134348595 /nfs/dbraw/zinc/34/85/95/134348595.db2.gz SPGWQVHLELUAQB-JHJVBQTASA-N 2 0 242.432 2.344 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+]C[C@@H](C)C[NH+]1CCCC1 ZINC000309448323 171059052 /nfs/dbraw/zinc/05/90/52/171059052.db2.gz KLIBXGDXHUCYLI-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP [NH3+]C[C@H]1CCCCN1C[C@H]1CCC(F)(F)C1 ZINC000301020438 383848223 /nfs/dbraw/zinc/84/82/23/383848223.db2.gz ZSWOBXWADCFZCG-WDEREUQCSA-N 2 0 232.318 2.235 20 0 BEADRP C[C@@H]1OCC[C@H]1[NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000119892264 383913211 /nfs/dbraw/zinc/91/32/11/383913211.db2.gz KZUBRNOTIIBNDQ-CMPLNLGQSA-N 2 0 240.391 2.063 20 0 BEADRP C[NH+](C)CCC[NH2+]C1CC(c2ccccc2)C1 ZINC000036840437 383914375 /nfs/dbraw/zinc/91/43/75/383914375.db2.gz LIITYTHSENUROB-UHFFFAOYSA-N 2 0 232.371 2.474 20 0 BEADRP C[C@H](O)CCC[NH2+][C@@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000227591082 134385395 /nfs/dbraw/zinc/38/53/95/134385395.db2.gz KIBVOUWEJBCZPR-IHRRRGAJSA-N 2 0 242.407 2.048 20 0 BEADRP Cc1ncc([C@H](C)[NH2+][C@H]2CC[C@@H](C[NH3+])C2)s1 ZINC000643542728 383984395 /nfs/dbraw/zinc/98/43/95/383984395.db2.gz LKZMUSQWJIFFFQ-GDPRMGEGSA-N 2 0 239.388 2.230 20 0 BEADRP [NH3+]CC[C@H]1CCCC[N@@H+]1Cc1cccs1 ZINC000070534354 383935834 /nfs/dbraw/zinc/93/58/34/383935834.db2.gz IIZDIHPJDBSMKF-LLVKDONJSA-N 2 0 224.373 2.451 20 0 BEADRP CC(C)(C)C[N@@H+]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC000072167904 384017888 /nfs/dbraw/zinc/01/78/88/384017888.db2.gz GLTCEZRXURMIEY-ZDUSSCGKSA-N 2 0 210.365 2.108 20 0 BEADRP CCC[C@@H](C)C[N@@H+]1CC[C@]2(C1)CCC[NH2+]C2 ZINC000564973529 384051873 /nfs/dbraw/zinc/05/18/73/384051873.db2.gz NRQKIIISPOKHPD-ZIAGYGMSSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)[C@H]1C[C@H]1C ZINC000643549012 384038142 /nfs/dbraw/zinc/03/81/42/384038142.db2.gz YYMQXTFLMZFURU-NDBYEHHHSA-N 2 0 222.376 2.295 20 0 BEADRP CO[C@H](C[NH2+]C(C)(C)CCC[NH+](C)C)C1CC1 ZINC000400268405 384038601 /nfs/dbraw/zinc/03/86/01/384038601.db2.gz LKYOPGYJSHZKTC-CYBMUJFWSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)[C@@H]1C ZINC000643548785 384038903 /nfs/dbraw/zinc/03/89/03/384038903.db2.gz VEQKJTLVHHFPMI-LPWJVIDDSA-N 2 0 222.376 2.295 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000643549039 384039831 /nfs/dbraw/zinc/03/98/31/384039831.db2.gz ZJEOUXFIOBDNFN-AGIUHOORSA-N 2 0 222.376 2.439 20 0 BEADRP COc1ccc([C@@H](C)[N@H+](C)CCC[NH3+])cc1 ZINC000227744288 134392254 /nfs/dbraw/zinc/39/22/54/134392254.db2.gz ZKDIMNBAQPZYBP-LLVKDONJSA-N 2 0 222.332 2.037 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H]1CC[C@@H](C)C1 ZINC000070748374 384136081 /nfs/dbraw/zinc/13/60/81/384136081.db2.gz CIAKVSYCOLMDBW-CHWSQXEVSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H]([NH3+])C1CC[NH+](C[C@H]2CCC(F)(F)C2)CC1 ZINC000302377896 384153194 /nfs/dbraw/zinc/15/31/94/384153194.db2.gz HYIXJUNLOULTFB-MNOVXSKESA-N 2 0 246.345 2.481 20 0 BEADRP C[C@H]([NH3+])C1CC[NH+](C[C@@H]2CCC(F)(F)C2)CC1 ZINC000302377898 384153849 /nfs/dbraw/zinc/15/38/49/384153849.db2.gz HYIXJUNLOULTFB-WDEREUQCSA-N 2 0 246.345 2.481 20 0 BEADRP C[C@H]([NH2+]CCCC[NH+](C)C)c1cncs1 ZINC000132994699 384221070 /nfs/dbraw/zinc/22/10/70/384221070.db2.gz MVALCZYLKAYMJN-JTQLQIEISA-N 2 0 227.377 2.136 20 0 BEADRP CSCCC[N@H+](C)[C@H]1CCN(C)[C@H](C)C1 ZINC000173527580 384225211 /nfs/dbraw/zinc/22/52/11/384225211.db2.gz FXDIFAZOSYUKDS-NEPJUHHUSA-N 2 0 230.421 2.154 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H]1CO[C@@H](C)C1 ZINC000401899766 384242903 /nfs/dbraw/zinc/24/29/03/384242903.db2.gz CTNQPRMCOCABBF-MELADBBJSA-N 2 0 242.407 2.264 20 0 BEADRP CCOC[C@H](C)[NH2+][C@@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000093516169 384246062 /nfs/dbraw/zinc/24/60/62/384246062.db2.gz FMTKTDGDVANNIN-IHRRRGAJSA-N 2 0 242.407 2.312 20 0 BEADRP c1coc(CN2CC[C@H](C[NH+]3CCCC3)C2)c1 ZINC000093596909 384250915 /nfs/dbraw/zinc/25/09/15/384250915.db2.gz OIGXDBGFQVNQJN-CYBMUJFWSA-N 2 0 234.343 2.197 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H]2CCC[C@H]3C[C@H]32)C1 ZINC000558700119 384252407 /nfs/dbraw/zinc/25/24/07/384252407.db2.gz PJECVSPMODDHMB-XQLPTFJDSA-N 2 0 236.403 2.497 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](CC3CCCC3)C[C@H]21 ZINC000228471104 384252771 /nfs/dbraw/zinc/25/27/71/384252771.db2.gz WLFFXPIBHJRZDU-MGPQQGTHSA-N 2 0 222.376 2.236 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3F)C[C@H]21 ZINC000228473985 384257272 /nfs/dbraw/zinc/25/72/72/384257272.db2.gz BKFMLEFIOYCBQP-UXIGCNINSA-N 2 0 248.345 2.385 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]C[C@@H]2CC[C@@H]3C[C@@H]3C2)C1 ZINC000403345044 384260941 /nfs/dbraw/zinc/26/09/41/384260941.db2.gz JROVBPHKGMLYNA-RGDJUOJXSA-N 2 0 222.376 2.282 20 0 BEADRP C[N@H+](CC1CCC1)C[C@H]1CCC[NH+](C)C1 ZINC000173791754 384262483 /nfs/dbraw/zinc/26/24/83/384262483.db2.gz MUWSTYFZMZBCRY-ZDUSSCGKSA-N 2 0 210.365 2.060 20 0 BEADRP CC[C@H]([NH2+]CC1CC[NH+](C)CC1)C1CC1 ZINC000083056079 384278262 /nfs/dbraw/zinc/27/82/62/384278262.db2.gz FULHQODTNVURHP-ZDUSSCGKSA-N 2 0 210.365 2.106 20 0 BEADRP CCCC[N@H+](CC)C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000300056883 384285300 /nfs/dbraw/zinc/28/53/00/384285300.db2.gz VPMCHYHOFSVVDF-CHWSQXEVSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000159041773 384297150 /nfs/dbraw/zinc/29/71/50/384297150.db2.gz FCODEVGEWKTVMJ-CHWSQXEVSA-N 2 0 245.370 2.296 20 0 BEADRP CC1CC([NH2+]Cc2cccc3c2CC[NH2+]C3)C1 ZINC000163740829 384350367 /nfs/dbraw/zinc/35/03/67/384350367.db2.gz MRUYNKYMYSSAKT-UHFFFAOYSA-N 2 0 230.355 2.220 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)CO1 ZINC000401979193 384359965 /nfs/dbraw/zinc/35/99/65/384359965.db2.gz ZJRACUSDOSFLLY-MNOVXSKESA-N 2 0 240.391 2.063 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH+](C)CC(C)C)[C@H](C)C1 ZINC000174778225 384361954 /nfs/dbraw/zinc/36/19/54/384361954.db2.gz LMYVGJUYUHMYBT-OLZOCXBDSA-N 2 0 212.381 2.305 20 0 BEADRP CC(C)[C@H]1CCC[N@@H+]1C[C@@H]1CCC[NH2+]C1 ZINC000084126068 384371083 /nfs/dbraw/zinc/37/10/83/384371083.db2.gz FNLXSRQDEQGQDY-CHWSQXEVSA-N 2 0 210.365 2.106 20 0 BEADRP CC1(C)[C@H]([NH3+])C[C@@H]1[NH2+]CCCc1ccccc1 ZINC000405431074 384330425 /nfs/dbraw/zinc/33/04/25/384330425.db2.gz AXRFRLMRLQEOND-KGLIPLIRSA-N 2 0 232.371 2.335 20 0 BEADRP CC(C)[C@H]([NH3+])CC[N@H+](C)C[C@H]1CCSC1 ZINC000300232773 384330871 /nfs/dbraw/zinc/33/08/71/384330871.db2.gz NAULQEGMBFCWCL-VXGBXAGGSA-N 2 0 230.421 2.045 20 0 BEADRP C(CC1CC[NH2+]CC1)C[NH+]1CCCCC1 ZINC000034350950 384392394 /nfs/dbraw/zinc/39/23/94/384392394.db2.gz KMFDUBLMWFXIOU-UHFFFAOYSA-N 2 0 210.365 2.252 20 0 BEADRP C[C@H]([NH2+]CCCC[NH+](C)C)c1ccccn1 ZINC000045663108 384402246 /nfs/dbraw/zinc/40/22/46/384402246.db2.gz YRJXFSHYTHJGQC-LBPRGKRZSA-N 2 0 221.348 2.074 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CCC[C@@H]2C[NH3+])C1 ZINC000084218675 384376978 /nfs/dbraw/zinc/37/69/78/384376978.db2.gz YJQHBJYHXIZKCU-FVCCEPFGSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@H]1Nc1ccccn1 ZINC000084213449 384377343 /nfs/dbraw/zinc/37/73/43/384377343.db2.gz SWILFNYZLYLOQU-GHMZBOCLSA-N 2 0 205.305 2.011 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]C2Cc3ccccc3C2)C1 ZINC000236314209 384387390 /nfs/dbraw/zinc/38/73/90/384387390.db2.gz BLTQVEPPMJVNQZ-ZIAGYGMSSA-N 2 0 230.355 2.013 20 0 BEADRP C[C@]1(C[N@@H+]2CCC[C@H]2c2ccccn2)CC[NH2+]C1 ZINC000647513932 384428591 /nfs/dbraw/zinc/42/85/91/384428591.db2.gz VFSUKTQOSUAQAF-GJZGRUSLSA-N 2 0 245.370 2.218 20 0 BEADRP [NH3+][C@H]1CCCN(CCCCC2CCOCC2)C1 ZINC000305898090 384429213 /nfs/dbraw/zinc/42/92/13/384429213.db2.gz SUYAMRCBBBDFJJ-AWEZNQCLSA-N 2 0 240.391 2.006 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)CC(F)F ZINC000647227018 384437053 /nfs/dbraw/zinc/43/70/53/384437053.db2.gz MHPXLQQJUSHISC-SRVKXCTJSA-N 2 0 246.345 2.494 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+]CCc1ccc2[nH]ccc2c1 ZINC000569330259 384471542 /nfs/dbraw/zinc/47/15/42/384471542.db2.gz DYVQYGRAFVHQJS-DZGCQCFKSA-N 2 0 243.354 2.180 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H]2CC=C(C)CC2)C1 ZINC000556816630 384502688 /nfs/dbraw/zinc/50/26/88/384502688.db2.gz FMIXTCSQHNRAQL-KBPBESRZSA-N 2 0 222.376 2.417 20 0 BEADRP CCC[C@H](C)[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000037485346 384506930 /nfs/dbraw/zinc/50/69/30/384506930.db2.gz KLFYBJYPRHYDQQ-NWDGAFQWSA-N 2 0 210.365 2.249 20 0 BEADRP CCC(CC)C[NH2+][C@@H]1CC[NH2+]CC[C@@H]1C ZINC000422863274 384487312 /nfs/dbraw/zinc/48/73/12/384487312.db2.gz RNXPPDVLBYQAGJ-WCQYABFASA-N 2 0 212.381 2.400 20 0 BEADRP CC1=CC[C@H]([NH2+]CCN2CC[C@H](C)C2)CC1 ZINC000556833865 384516142 /nfs/dbraw/zinc/51/61/42/384516142.db2.gz NWBACSFLSNBBEM-KBPBESRZSA-N 2 0 222.376 2.417 20 0 BEADRP CO[C@H](C)[C@@H](C)[NH2+]C1CC[NH+](CC(C)C)CC1 ZINC000358016540 384516393 /nfs/dbraw/zinc/51/63/93/384516393.db2.gz GSVMZWVJFGBLQW-CHWSQXEVSA-N 2 0 242.407 2.120 20 0 BEADRP FC1(F)CC([NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)C1 ZINC000309484232 384542954 /nfs/dbraw/zinc/54/29/54/384542954.db2.gz FRNJNHCAKCDLGK-MWLCHTKSSA-N 2 0 230.302 2.001 20 0 BEADRP C1[C@H]2CCC[C@@H]([NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)[C@@H]12 ZINC000306073393 384543196 /nfs/dbraw/zinc/54/31/96/384543196.db2.gz DNFJOCUWIWKGKC-ARILJUKYSA-N 2 0 234.387 2.391 20 0 BEADRP C[NH+](C)CCCC1CC[NH+](CC2CC2)CC1 ZINC000123231876 384543848 /nfs/dbraw/zinc/54/38/48/384543848.db2.gz YQFQBCCRYVDMHA-UHFFFAOYSA-N 2 0 224.392 2.450 20 0 BEADRP FC1(F)CC([NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)C1 ZINC000309484233 384543936 /nfs/dbraw/zinc/54/39/36/384543936.db2.gz FRNJNHCAKCDLGK-ONGXEEELSA-N 2 0 230.302 2.001 20 0 BEADRP Cc1ccc(F)cc1C[N@@H+]1CC[C@](C)(C[NH3+])C1 ZINC000235786429 384577986 /nfs/dbraw/zinc/57/79/86/384577986.db2.gz LQWXVXDRWPCHBV-CQSZACIVSA-N 2 0 236.334 2.305 20 0 BEADRP C(C1CCCCC1)[N@@H+]1CC[C@H]2CC[NH2+][C@H]2C1 ZINC000643065746 384579760 /nfs/dbraw/zinc/57/97/60/384579760.db2.gz FRZCFKWPZVTQNQ-KGLIPLIRSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H](CC[NH+](C)C)C(C)(C)C)CO1 ZINC000647184041 384604123 /nfs/dbraw/zinc/60/41/23/384604123.db2.gz ZGDZUUDNCFXBPU-FRRDWIJNSA-N 2 0 242.407 2.120 20 0 BEADRP CC(C)C[C@@H](C)C[NH+]1CCC(C)([NH3+])CC1 ZINC000647530793 384621736 /nfs/dbraw/zinc/62/17/36/384621736.db2.gz GFVMEVHKOAOLFD-GFCCVEGCSA-N 2 0 212.381 2.482 20 0 BEADRP Cc1ccc(CCC[NH+]2CCC(C)([NH3+])CC2)cn1 ZINC000647530823 384622704 /nfs/dbraw/zinc/62/27/04/384622704.db2.gz IXMGMSWEVQJAHR-UHFFFAOYSA-N 2 0 247.386 2.136 20 0 BEADRP C[C@H]([NH3+])C1CC[NH+](Cc2cccc(F)c2)CC1 ZINC000111727053 384624844 /nfs/dbraw/zinc/62/48/44/384624844.db2.gz HEIXSWKMVIXGQT-NSHDSACASA-N 2 0 236.334 2.385 20 0 BEADRP CS[C@H]1CC[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000309843853 384664840 /nfs/dbraw/zinc/66/48/40/384664840.db2.gz FRZJGCDKIVRGRC-LLUNPGSJSA-N 2 0 240.416 2.095 20 0 BEADRP Cc1ccc(CN2CC[C@H]3CC[NH2+][C@@H]3C2)c(C)c1 ZINC000647532812 384638466 /nfs/dbraw/zinc/63/84/66/384638466.db2.gz DWDDWQCHYNKQNB-GDBMZVCRSA-N 2 0 244.382 2.487 20 0 BEADRP CC1(C)SC[C@@H]1[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000309815621 384642517 /nfs/dbraw/zinc/64/25/17/384642517.db2.gz VFHHABUJJJNSRB-UTUOFQBUSA-N 2 0 240.416 2.097 20 0 BEADRP C[C@@H]1CCC[C@H](C[N@@H+]2CC[C@@H]3CC[NH2+][C@@H]3C2)C1 ZINC000647534538 384645298 /nfs/dbraw/zinc/64/52/98/384645298.db2.gz QDUWHPUUIDELQL-CBBWQLFWSA-N 2 0 236.403 2.497 20 0 BEADRP CC(C)[NH+](CCC[NH2+][C@H]1CO[C@H](C)C1)C(C)C ZINC000647188932 384647217 /nfs/dbraw/zinc/64/72/17/384647217.db2.gz SAMRRBJUBPVUSJ-ZIAGYGMSSA-N 2 0 242.407 2.262 20 0 BEADRP CC[C@@H](C)C[N@H+](CC)CC1CC[NH2+]CC1 ZINC000086437746 384651693 /nfs/dbraw/zinc/65/16/93/384651693.db2.gz OPIZXJZQNPVOLV-GFCCVEGCSA-N 2 0 212.381 2.354 20 0 BEADRP c1cn(CCC[NH2+]C[C@@H]2CC[C@H]3C[C@H]3C2)cn1 ZINC000403414312 384655555 /nfs/dbraw/zinc/65/55/55/384655555.db2.gz VBYYAVZLXHCBHJ-HZSPNIEDSA-N 2 0 233.359 2.299 20 0 BEADRP COc1ccc(C[NH2+]C[C@H]2CCC[N@H+](C)C2)cc1 ZINC000044535835 384657124 /nfs/dbraw/zinc/65/71/24/384657124.db2.gz LFWHBDPHFJIDBB-CQSZACIVSA-N 2 0 248.370 2.127 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]C[C@@H]2CCC[N@H+](C)C2)C1 ZINC000044535217 384659723 /nfs/dbraw/zinc/65/97/23/384659723.db2.gz JQNCSLPKMWJRKT-HZSPNIEDSA-N 2 0 224.392 2.497 20 0 BEADRP CCCCOCCC[NH2+][C@H]1CC[N@H+](C)C[C@H]1C ZINC000359360696 384726179 /nfs/dbraw/zinc/72/61/79/384726179.db2.gz HVDWNJUTYINRMG-KGLIPLIRSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)C[N@@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000647543250 384712259 /nfs/dbraw/zinc/71/22/59/384712259.db2.gz KAALCUQFAKAUCO-KGLIPLIRSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC000647543426 384712316 /nfs/dbraw/zinc/71/23/16/384712316.db2.gz NFWZQPWIANTLLS-CBBWQLFWSA-N 2 0 236.403 2.354 20 0 BEADRP C(C1CC1)[N@@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC000647544065 384716832 /nfs/dbraw/zinc/71/68/32/384716832.db2.gz VZNMMOGASAABMA-KBPBESRZSA-N 2 0 222.376 2.108 20 0 BEADRP CSC1(C[NH2+]C2CCCC2)CC[NH+](C)CC1 ZINC000309728971 384779249 /nfs/dbraw/zinc/77/92/49/384779249.db2.gz YZUUNUYTBRJBPP-UHFFFAOYSA-N 2 0 242.432 2.346 20 0 BEADRP CCCC[N@H+](C)CC1CC[NH+](CC)CC1 ZINC000104946944 384741268 /nfs/dbraw/zinc/74/12/68/384741268.db2.gz XDBZXABOZIMTDV-UHFFFAOYSA-N 2 0 212.381 2.450 20 0 BEADRP C[NH2+]CCC[NH2+][C@H]1CCc2ccc(F)cc21 ZINC000423198106 384750829 /nfs/dbraw/zinc/75/08/29/384750829.db2.gz DDKALDFGVUWTRU-ZDUSSCGKSA-N 2 0 222.307 2.012 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]Cc1ccc2cnccc2c1 ZINC000647552276 384756169 /nfs/dbraw/zinc/75/61/69/384756169.db2.gz ORAZQCJKKCLVJT-NWDGAFQWSA-N 2 0 243.354 2.450 20 0 BEADRP C[C@@H](C[NH2+]CC(C)(C)C)Cn1ccnc1 ZINC000163814970 384759104 /nfs/dbraw/zinc/75/91/04/384759104.db2.gz QQNCTENQMJDQCW-NSHDSACASA-N 2 0 209.337 2.155 20 0 BEADRP C[NH+](C)CCC[NH2+][C@@H]1CS[C@@H](C(C)(C)C)C1 ZINC000309980458 384759793 /nfs/dbraw/zinc/75/97/93/384759793.db2.gz VYEUZAWHSGVHNM-NWDGAFQWSA-N 2 0 244.448 2.448 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)C(C)(C)C)C1 ZINC000163290739 384789457 /nfs/dbraw/zinc/78/94/57/384789457.db2.gz NHGVLOTUEQJQHI-NWDGAFQWSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H](CCC1CC1)[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000398197579 384838333 /nfs/dbraw/zinc/83/83/33/384838333.db2.gz DFYCISKINUNFDU-DGCLKSJQSA-N 2 0 210.365 2.297 20 0 BEADRP CCC[NH2+]CCN[C@@H]1CCc2ccc(F)cc21 ZINC000423312299 384796748 /nfs/dbraw/zinc/79/67/48/384796748.db2.gz RNAHXXCQBPVKHC-CQSZACIVSA-N 2 0 236.334 2.402 20 0 BEADRP C[C@H](CCC1CC1)[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000398087834 384799560 /nfs/dbraw/zinc/79/95/60/384799560.db2.gz OIXUWNZVIAKZEC-RAIGVLPGSA-N 2 0 210.365 2.425 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+]CC1(C)CC[NH2+]CC1 ZINC000423322939 384807698 /nfs/dbraw/zinc/80/76/98/384807698.db2.gz HONHFLIZPQOOTG-STQMWFEESA-N 2 0 224.392 2.400 20 0 BEADRP Cc1ccc(C[N@H+]2C[C@@H](C)[C@](C)(C[NH3+])C2)s1 ZINC000335263312 384880660 /nfs/dbraw/zinc/88/06/60/384880660.db2.gz UWRYLOIOKGWHIP-ZWNOBZJWSA-N 2 0 238.400 2.473 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@@H]([NH3+])C1)c1ccc(F)cn1 ZINC000423366751 384840832 /nfs/dbraw/zinc/84/08/32/384840832.db2.gz CFLGJIVJRLMHNO-WCQGTBRESA-N 2 0 237.322 2.141 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@H]([NH3+])C1)C1CCSCC1 ZINC000423392457 384853166 /nfs/dbraw/zinc/85/31/66/384853166.db2.gz QFIITLSECDGRNR-WCFLWFBJSA-N 2 0 242.432 2.378 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+][C@H]1CC[NH2+]C[C@H]1C ZINC000423409071 384855591 /nfs/dbraw/zinc/85/55/91/384855591.db2.gz YMOGHPJDXQAMEX-VOAKCMCISA-N 2 0 210.365 2.009 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+]C[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000403777748 384856728 /nfs/dbraw/zinc/85/67/28/384856728.db2.gz WSSQVDUXUFWAFY-SYQHCUMBSA-N 2 0 224.392 2.352 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CCCC[C@H]2C[NH3+])nc1C ZINC000314214868 384860514 /nfs/dbraw/zinc/86/05/14/384860514.db2.gz UAQORMYYJXKYKL-DZGCQCFKSA-N 2 0 247.386 2.306 20 0 BEADRP C[C@@H](CC[NH2+][C@H]1CO[C@H](C)C1)[NH+]1CCCCC1 ZINC000647201081 384889143 /nfs/dbraw/zinc/88/91/43/384889143.db2.gz ZUDQYYNJNXVMLR-BFHYXJOUSA-N 2 0 240.391 2.018 20 0 BEADRP Fc1cccc(C[NH2+]CC[C@@H]2CCC[NH2+]C2)c1 ZINC000259004132 384954753 /nfs/dbraw/zinc/95/47/53/384954753.db2.gz MPYGACCUKSEFAF-LBPRGKRZSA-N 2 0 236.334 2.305 20 0 BEADRP Clc1ccc(C[NH2+]CC[C@H]2CC[NH2+]C2)cc1 ZINC000259021985 384956930 /nfs/dbraw/zinc/95/69/30/384956930.db2.gz NYRUYDFYPJDZRE-LBPRGKRZSA-N 2 0 238.762 2.429 20 0 BEADRP C[C@@H]1C[C@H]([NH3+])CC[N@@H+]1CCc1ccccc1 ZINC000049708922 384897776 /nfs/dbraw/zinc/89/77/76/384897776.db2.gz NSBXMYHTQVVHAT-TZMCWYRMSA-N 2 0 218.344 2.041 20 0 BEADRP CCC[NH+]1CCC([NH2+]C[C@H](OC)C(C)C)CC1 ZINC000310201527 384903321 /nfs/dbraw/zinc/90/33/21/384903321.db2.gz AYJATNIRSJJMBH-AWEZNQCLSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CCc1cccc(F)c1 ZINC000310215333 384904896 /nfs/dbraw/zinc/90/48/96/384904896.db2.gz FBBZJHSKKKLXJE-GFCCVEGCSA-N 2 0 238.350 2.475 20 0 BEADRP CC[C@H](CSC)[NH2+][C@H](C)CCCC[NH3+] ZINC000308661014 384905464 /nfs/dbraw/zinc/90/54/64/384905464.db2.gz PUCNFKKZHASZDS-GHMZBOCLSA-N 2 0 218.410 2.235 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]C[C@H]2CCC[N@H+](C)C2)C1 ZINC000251749439 384915821 /nfs/dbraw/zinc/91/58/21/384915821.db2.gz JQNCSLPKMWJRKT-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@H]([NH2+][C@H](C)CN(C)C(C)C)[C@H]1CCOC1 ZINC000310236588 384917165 /nfs/dbraw/zinc/91/71/65/384917165.db2.gz AJENJELJLLXGHH-RDBSUJKOSA-N 2 0 242.407 2.120 20 0 BEADRP Cc1ccsc1CC[NH2+][C@H]1CCC[C@@H]1[NH3+] ZINC000258800991 384936513 /nfs/dbraw/zinc/93/65/13/384936513.db2.gz CDTDFWSRGMEPPS-QWRGUYRKSA-N 2 0 224.373 2.068 20 0 BEADRP Cc1ccc(C[NH2+]C[C@@H]2CCC[NH2+]C2)cc1C ZINC000258861154 384946746 /nfs/dbraw/zinc/94/67/46/384946746.db2.gz AAAUHPVBZOZHLU-OAHLLOKOSA-N 2 0 232.371 2.393 20 0 BEADRP C[C@@H]1CC[C@H](C[N@@H+]2CCC[C@@H](C)[C@H]2CC[NH3+])O1 ZINC000404274803 384966249 /nfs/dbraw/zinc/96/62/49/384966249.db2.gz AHFGYRZBYAPEPR-AAVRWANBSA-N 2 0 240.391 2.003 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000058041097 384979054 /nfs/dbraw/zinc/97/90/54/384979054.db2.gz IMUMZPSUQCFIOJ-GXTWGEPZSA-N 2 0 218.344 2.246 20 0 BEADRP C[N@H+](C[C@@H]1CCC[NH2+]C1)C1Cc2ccccc2C1 ZINC000226436965 385021820 /nfs/dbraw/zinc/02/18/20/385021820.db2.gz VMKRNJATFJZCIC-CYBMUJFWSA-N 2 0 244.382 2.085 20 0 BEADRP CO[C@H](C)CC[NH2+][C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000310336332 384988195 /nfs/dbraw/zinc/98/81/95/384988195.db2.gz MWHPQWUYCLJHPY-SWHYSGLUSA-N 2 0 234.343 2.146 20 0 BEADRP C[C@@H]([NH2+]C1CCCCC1)[C@H]1CCC[NH2+]C1 ZINC000129792431 385012772 /nfs/dbraw/zinc/01/27/72/385012772.db2.gz QZAHXWCKDGAGDS-NEPJUHHUSA-N 2 0 210.365 2.297 20 0 BEADRP Cc1ccsc1C[N@H+](C)CC[C@@H]1CC[NH2+]C1 ZINC000259171532 384964559 /nfs/dbraw/zinc/96/45/59/384964559.db2.gz YRCAAKDTXCKJOK-LBPRGKRZSA-N 2 0 238.400 2.488 20 0 BEADRP COCc1cccc(C[NH2+][C@H]2C[C@@H]([NH3+])C2(C)C)c1 ZINC000404758037 385050817 /nfs/dbraw/zinc/05/08/17/385050817.db2.gz APZJHAXAENVOJD-KGLIPLIRSA-N 2 0 248.370 2.048 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+][C@H]1C[C@H](C)C[C@H](C)C1 ZINC000300023294 385054914 /nfs/dbraw/zinc/05/49/14/385054914.db2.gz DVGSJFCKLVMNAF-RQJABVFESA-N 2 0 242.407 2.155 20 0 BEADRP Cc1cccc(C[NH2+][C@H]2C[C@@H]([NH3+])C2(C)C)c1 ZINC000404781579 385059542 /nfs/dbraw/zinc/05/95/42/385059542.db2.gz NKGGWAXUSVIZLX-OLZOCXBDSA-N 2 0 218.344 2.210 20 0 BEADRP CC(C)[C@@H]1C[C@@H]([NH2+]CCCC[NH+](C)C)CS1 ZINC000336678800 385073855 /nfs/dbraw/zinc/07/38/55/385073855.db2.gz QOWWHUJFZXZENG-OLZOCXBDSA-N 2 0 244.448 2.448 20 0 BEADRP CC(C)[C@H]1C[C@H]([NH2+]CCCC[NH+](C)C)CS1 ZINC000336678801 385074590 /nfs/dbraw/zinc/07/45/90/385074590.db2.gz QOWWHUJFZXZENG-QWHCGFSZSA-N 2 0 244.448 2.448 20 0 BEADRP CS[C@H](C)C[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@H]1C ZINC000090726298 385035085 /nfs/dbraw/zinc/03/50/85/385035085.db2.gz CIFBWXJYROYSBR-WRWGMCAJSA-N 2 0 230.421 2.056 20 0 BEADRP CS[C@H](C)C[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@H]1C ZINC000090726296 385037231 /nfs/dbraw/zinc/03/72/31/385037231.db2.gz CIFBWXJYROYSBR-DDHJBXDOSA-N 2 0 230.421 2.056 20 0 BEADRP C[C@H]([NH2+]CC1CC[NH2+]CC1)c1cccs1 ZINC000086700331 385041628 /nfs/dbraw/zinc/04/16/28/385041628.db2.gz RFZOMOHLMDLWHW-JTQLQIEISA-N 2 0 224.373 2.398 20 0 BEADRP CC1(C)[C@H]([NH2+]CCC2CCCC2)C[C@@H]1[NH3+] ZINC000404878101 385120458 /nfs/dbraw/zinc/12/04/58/385120458.db2.gz YBSAQZIJUXMZSO-NWDGAFQWSA-N 2 0 210.365 2.282 20 0 BEADRP C[NH+](C)CC(C)(C)C[NH2+][C@H]1CCCSC1 ZINC000061570870 385122999 /nfs/dbraw/zinc/12/29/99/385122999.db2.gz OMWVPYKKXRQPQP-NSHDSACASA-N 2 0 230.421 2.059 20 0 BEADRP Cc1ccc(CN2CCCC[C@H]2[C@H](C)[NH3+])nc1 ZINC000227353366 385129463 /nfs/dbraw/zinc/12/94/63/385129463.db2.gz DHAJBYAICGADGF-JSGCOSHPSA-N 2 0 233.359 2.092 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@H]2CC[C@H]2C)CC1 ZINC000308827257 385194753 /nfs/dbraw/zinc/19/47/53/385194753.db2.gz SMVXJYZLIVOENE-YPMHNXCESA-N 2 0 210.365 2.247 20 0 BEADRP C[C@H](C[NH2+][C@@H](C)c1ccncc1)C[NH+]1CCCC1 ZINC000062077885 385153722 /nfs/dbraw/zinc/15/37/22/385153722.db2.gz GCOLSOMOVMLPGT-KGLIPLIRSA-N 2 0 247.386 2.464 20 0 BEADRP C1CC12C[C@H]2[NH2+][C@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000424373160 385154224 /nfs/dbraw/zinc/15/42/24/385154224.db2.gz IZVPWJXHJSGRMG-ZDEQEGDKSA-N 2 0 220.360 2.049 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C(C)C)C2CC2)C1 ZINC000222052886 385173769 /nfs/dbraw/zinc/17/37/69/385173769.db2.gz ILCPYOIJGLQQJT-OCCSQVGLSA-N 2 0 224.392 2.352 20 0 BEADRP CC[N@H+](C)CCNc1cc[nH+]c(C)c1Cl ZINC000308849046 385209583 /nfs/dbraw/zinc/20/95/83/385209583.db2.gz MGWZXKDYOJZLBA-UHFFFAOYSA-N 2 0 227.739 2.407 20 0 BEADRP CCCC[NH+]1CCC([NH2+][C@@H](C)[C@@H](C)OC)CC1 ZINC000130018936 385212329 /nfs/dbraw/zinc/21/23/29/385212329.db2.gz GLZWZSKOLHBPGA-QWHCGFSZSA-N 2 0 242.407 2.264 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+][C@H]1CCCSC1 ZINC000252714391 385221206 /nfs/dbraw/zinc/22/12/06/385221206.db2.gz RVVIQCLXNZALAC-NDBYEHHHSA-N 2 0 242.432 2.200 20 0 BEADRP C[C@@H]1CC[N@H+](CC2CCCCC2)C[C@@H]1C[NH3+] ZINC000164647140 385225854 /nfs/dbraw/zinc/22/58/54/385225854.db2.gz OWAHAIVCQBLUKP-OCCSQVGLSA-N 2 0 224.392 2.483 20 0 BEADRP CCc1cc(NC2CC[NH+](C)CC2)cc[nH+]1 ZINC000307771054 385256881 /nfs/dbraw/zinc/25/68/81/385256881.db2.gz NUUZVABEXRGANG-UHFFFAOYSA-N 2 0 219.332 2.150 20 0 BEADRP C[C@H](C[NH2+][C@@H](C)[C@@H]1CC1(C)C)C[NH+](C)C ZINC000308881020 385235705 /nfs/dbraw/zinc/23/57/05/385235705.db2.gz UJVFUTQTIYIFQT-WOPDTQHZSA-N 2 0 212.381 2.208 20 0 BEADRP CCC1CC([NH2+]CCC[NH+]2CCCC2)C1 ZINC000308963009 385315984 /nfs/dbraw/zinc/31/59/84/385315984.db2.gz SMNUVQUXMFYATL-UHFFFAOYSA-N 2 0 210.365 2.251 20 0 BEADRP c1cn(CC[N@@H+]2CCCc3ccccc3C2)cn1 ZINC000131243272 385321332 /nfs/dbraw/zinc/32/13/32/385321332.db2.gz UWVQUVJQUZHLEW-UHFFFAOYSA-N 2 0 241.338 2.332 20 0 BEADRP CC[C@H]1CCC[C@H](C[N@@H+]2CCCNCC2)C1 ZINC000346679774 385261012 /nfs/dbraw/zinc/26/10/12/385261012.db2.gz ATFAJTWAGNAPFJ-KBPBESRZSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]Cc1cccs1 ZINC000336698771 385322764 /nfs/dbraw/zinc/32/27/64/385322764.db2.gz VSUBBRYHECCPIB-JTQLQIEISA-N 2 0 212.362 2.355 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]CC1CCC(C)(C)CC1 ZINC000308930763 385300983 /nfs/dbraw/zinc/30/09/83/385300983.db2.gz RFDALGBCLHKUAW-LLVKDONJSA-N 2 0 212.381 2.387 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H]1CCCc2sccc21 ZINC000308976460 385329127 /nfs/dbraw/zinc/32/91/27/385329127.db2.gz IPUOYGCWHAPBCK-MWLCHTKSSA-N 2 0 224.373 2.310 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCC[NH+]2CCCC2)[C@H]1C ZINC000308975992 385329397 /nfs/dbraw/zinc/32/93/97/385329397.db2.gz ILICCWGQNOLDCX-FRRDWIJNSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H](C[NH2+][C@H](C)C1CCC1)N(C)C1CC1 ZINC000178783057 385330171 /nfs/dbraw/zinc/33/01/71/385330171.db2.gz CKQLJXCTICSKJW-GHMZBOCLSA-N 2 0 210.365 2.247 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@H]1CCCc2sccc21 ZINC000308976461 385330607 /nfs/dbraw/zinc/33/06/07/385330607.db2.gz IPUOYGCWHAPBCK-ONGXEEELSA-N 2 0 224.373 2.310 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CC[C@@H]2CCCCO2)CC[N@@H+]1C ZINC000180255828 385389415 /nfs/dbraw/zinc/38/94/15/385389415.db2.gz OLSMRPWOAZGNDL-RDBSUJKOSA-N 2 0 240.391 2.018 20 0 BEADRP Cc1cc(C)cc(C[N@H+]2CC[C@H]([C@H](C)[NH3+])C2)c1 ZINC000228201046 385362023 /nfs/dbraw/zinc/36/20/23/385362023.db2.gz RBLQPORCPZTZAD-ZFWWWQNUSA-N 2 0 232.371 2.473 20 0 BEADRP Cc1cc([C@@H](C)[NH2+]C[C@H](C)C[NH3+])c(C)o1 ZINC000309016086 385371298 /nfs/dbraw/zinc/37/12/98/385371298.db2.gz ZMBLRPKBQSCHMK-PSASIEDQSA-N 2 0 210.321 2.142 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@@]1(C)CCCS1 ZINC000309019307 385372796 /nfs/dbraw/zinc/37/27/96/385372796.db2.gz STLMVNQUEMKNNU-VXGBXAGGSA-N 2 0 230.421 2.379 20 0 BEADRP CCSCC[NH2+]CCC[NH+]1CCCCC1 ZINC000308973694 385327529 /nfs/dbraw/zinc/32/75/29/385327529.db2.gz AOUBAHODQNWASG-UHFFFAOYSA-N 2 0 230.421 2.205 20 0 BEADRP C[C@@H]1[C@H]([NH2+]CCC(C)(C)C)CCCN1C ZINC000309090944 385414144 /nfs/dbraw/zinc/41/41/44/385414144.db2.gz BEQRFHPLZDKSIE-VXGBXAGGSA-N 2 0 212.381 2.495 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CC2(SC)CC2)[C@H](C)C1 ZINC000193824414 385414255 /nfs/dbraw/zinc/41/42/55/385414255.db2.gz AUXBKSGEKVYTBZ-NEPJUHHUSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H]1C[C@H]1C[NH2+]C1CCC([NH+](C)C)CC1 ZINC000309113490 385423418 /nfs/dbraw/zinc/42/34/18/385423418.db2.gz KOIQPVLQEMKQKZ-IALDZJHCSA-N 2 0 210.365 2.105 20 0 BEADRP Cc1ccsc1C[NH+]1C[C@H]2C[N@H+](C)C[C@H]2C1 ZINC000194535858 385439859 /nfs/dbraw/zinc/43/98/59/385439859.db2.gz ZYIHBNLCDBEBPZ-TXEJJXNPSA-N 2 0 236.384 2.050 20 0 BEADRP COCCC(C)(C)C[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000183934466 385483768 /nfs/dbraw/zinc/48/37/68/385483768.db2.gz GNTQCZBBKZQHNI-OLZOCXBDSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H](CCc1ccccc1)[NH2+][C@@H](C)[C@H](C)[NH3+] ZINC000309247897 385497642 /nfs/dbraw/zinc/49/76/42/385497642.db2.gz NWXLMYVFWXSMOX-AGIUHOORSA-N 2 0 220.360 2.333 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC2(C)CC[NH+](C)CC2)[C@@H]1C ZINC000309275798 385507564 /nfs/dbraw/zinc/50/75/64/385507564.db2.gz DSSGMGNLLUGMEJ-UPJWGTAASA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+]C1CCC(C(F)(F)F)CC1 ZINC000309322349 385532349 /nfs/dbraw/zinc/53/23/49/385532349.db2.gz HIYIKCDAWQASOX-IDKOKCKLSA-N 2 0 238.297 2.292 20 0 BEADRP CC(C)(C)C[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000309334944 385533711 /nfs/dbraw/zinc/53/37/11/385533711.db2.gz IRHRIPLSKQOVHH-UHFFFAOYSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)(C)CCC[N@@H+]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000309339100 385537971 /nfs/dbraw/zinc/53/79/71/385537971.db2.gz KGRPNFROILTXGK-CHWSQXEVSA-N 2 0 224.392 2.354 20 0 BEADRP CC(C)(C)CCC[N@@H+]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000309339102 385539162 /nfs/dbraw/zinc/53/91/62/385539162.db2.gz KGRPNFROILTXGK-OLZOCXBDSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@H](CCc1ccccc1)[NH2+]CC(C)(C)[NH3+] ZINC000309350316 385542104 /nfs/dbraw/zinc/54/21/04/385542104.db2.gz MJCUNGUOWQFBMH-GFCCVEGCSA-N 2 0 220.360 2.335 20 0 BEADRP Cc1sccc1C[NH2+]CC1CC[NH+](C)CC1 ZINC000309355047 385547619 /nfs/dbraw/zinc/54/76/19/385547619.db2.gz CGZJVWKYTTUNMA-UHFFFAOYSA-N 2 0 238.400 2.488 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CCc1ccccc1 ZINC000309309353 385526185 /nfs/dbraw/zinc/52/61/85/385526185.db2.gz DTOXDCLBQYASDJ-ZDUSSCGKSA-N 2 0 220.360 2.336 20 0 BEADRP CCOC[C@@H]([NH2+][C@@H](C)CCCC[NH3+])C(C)C ZINC000336645513 385551822 /nfs/dbraw/zinc/55/18/22/385551822.db2.gz DCEWDNJSXMNSRB-QWHCGFSZSA-N 2 0 230.396 2.155 20 0 BEADRP Cc1c[nH+]ccc1N[C@H]1CCC[N@H+](C)[C@@H]1C ZINC000309375708 385555589 /nfs/dbraw/zinc/55/55/89/385555589.db2.gz COWGXTJESPAESA-YPMHNXCESA-N 2 0 219.332 2.285 20 0 BEADRP c1ccc(CN[C@@H]2CC[N@@H+]3CCCC[C@H]23)cc1 ZINC000036996690 385594833 /nfs/dbraw/zinc/59/48/33/385594833.db2.gz MCCRATQBGIGFLN-HUUCEWRRSA-N 2 0 230.355 2.403 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCCc2ccccn2)CC[N@@H+]1C ZINC000181493590 385580661 /nfs/dbraw/zinc/58/06/61/385580661.db2.gz CUCFFOIDOBUUEB-UKRRQHHQSA-N 2 0 247.386 2.087 20 0 BEADRP C[N@@H+](CCc1ccncc1)CC[C@@H]1CCC[NH+]1C ZINC000181497620 385581283 /nfs/dbraw/zinc/58/12/83/385581283.db2.gz VGKNTIKTAWIGSF-HNNXBMFYSA-N 2 0 247.386 2.040 20 0 BEADRP C[C@H]([NH2+]CCC[NH+]1CCCC1)[C@H]1CC1(C)C ZINC000309444124 385583978 /nfs/dbraw/zinc/58/39/78/385583978.db2.gz KXKPWEVJLZHUNY-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP COCCC[C@@H](C)[NH2+]CCC[N@H+](C)C(C)C ZINC000309450770 385584968 /nfs/dbraw/zinc/58/49/68/385584968.db2.gz LBPZJGPMESWYDS-CYBMUJFWSA-N 2 0 230.396 2.121 20 0 BEADRP [NH3+]CCCC[NH2+][C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000082862879 385591237 /nfs/dbraw/zinc/59/12/37/385591237.db2.gz DKHAPZUUMFTRIE-UWVGGRQHSA-N 2 0 238.297 2.436 20 0 BEADRP C[C@H](C[NH2+]C[C@H]1CCC[NH2+]1)Cc1ccccc1 ZINC000414849124 385614811 /nfs/dbraw/zinc/61/48/11/385614811.db2.gz QQQKQQVYSCCJSL-DZGCQCFKSA-N 2 0 232.371 2.207 20 0 BEADRP CCCC[NH+]1CCC([NH2+]C[C@H]2C[C@H]2C)CC1 ZINC000336724475 385615838 /nfs/dbraw/zinc/61/58/38/385615838.db2.gz FJDPJSYXCFGAST-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)[C@H]1C[C@@H]([NH2+]CCCC[NH+](C)C)CS1 ZINC000336678799 385618340 /nfs/dbraw/zinc/61/83/40/385618340.db2.gz QOWWHUJFZXZENG-CHWSQXEVSA-N 2 0 244.448 2.448 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]C[C@H](C)c1ccc(F)cc1 ZINC000414848798 385619892 /nfs/dbraw/zinc/61/98/92/385619892.db2.gz XJSPDPKOJCANAQ-RYUDHWBXSA-N 2 0 238.350 2.374 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CCC[C@H](C)[C@H]1C ZINC000414849770 385630330 /nfs/dbraw/zinc/63/03/30/385630330.db2.gz YNPNLMCOVZJLQZ-WUHRBBMRSA-N 2 0 212.381 2.256 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]Cc1ccc(F)c(F)c1 ZINC000309476433 385607643 /nfs/dbraw/zinc/60/76/43/385607643.db2.gz VBLGPZIHDHXHOC-SECBINFHSA-N 2 0 228.286 2.182 20 0 BEADRP CC[C@@H](C)[NH+]1CCC([C@@H]2CCC[NH2+]2)CC1 ZINC000063197443 385612051 /nfs/dbraw/zinc/61/20/51/385612051.db2.gz RNFNZQWYRDDDJC-YPMHNXCESA-N 2 0 210.365 2.249 20 0 BEADRP C(C[NH2+][C@@H]1CCC12CCC2)C[NH+]1CCCC1 ZINC000336683578 385648019 /nfs/dbraw/zinc/64/80/19/385648019.db2.gz SJQJNYQYBWHMQO-CYBMUJFWSA-N 2 0 222.376 2.395 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+]C[C@@H](C)CC)C1 ZINC000093064967 385651044 /nfs/dbraw/zinc/65/10/44/385651044.db2.gz XAFHMGNHQRVWDG-STQMWFEESA-N 2 0 212.381 2.354 20 0 BEADRP CCSCC[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000309521987 385659259 /nfs/dbraw/zinc/65/92/59/385659259.db2.gz ARNCOFVTPYJONS-UHFFFAOYSA-N 2 0 242.432 2.204 20 0 BEADRP CCS[C@H]1CCCC[N@H+](CCC[NH2+]C)C1 ZINC000309540730 385673602 /nfs/dbraw/zinc/67/36/02/385673602.db2.gz YFCLINMSDPHISE-LBPRGKRZSA-N 2 0 230.421 2.204 20 0 BEADRP Cc1nc(C[NH2+]CCC[C@@H]2CCC[NH2+]2)cs1 ZINC000309539893 385674627 /nfs/dbraw/zinc/67/46/27/385674627.db2.gz GFXLIYXOJDBDJE-LLVKDONJSA-N 2 0 239.388 2.073 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]C[C@@H](C)CC(C)C ZINC000414853098 385682160 /nfs/dbraw/zinc/68/21/60/385682160.db2.gz RTDPPQPTILGKGH-RYUDHWBXSA-N 2 0 200.370 2.114 20 0 BEADRP C([NH2+][C@@H]1CCCC[C@@H]1C1CC1)[C@@H]1CCC[NH2+]1 ZINC000414853780 385690525 /nfs/dbraw/zinc/69/05/25/385690525.db2.gz YCKAIYSETACBFS-BFHYXJOUSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)c1cncs1 ZINC000309561755 385699407 /nfs/dbraw/zinc/69/94/07/385699407.db2.gz LEWCCBSVPGTQPC-SNVBAGLBSA-N 2 0 237.372 2.056 20 0 BEADRP CCC1(C[NH2+][C@H](C)CCCC[NH3+])CCOCC1 ZINC000336687731 385705963 /nfs/dbraw/zinc/70/59/63/385705963.db2.gz GSYMENLNZHRJSD-CYBMUJFWSA-N 2 0 242.407 2.300 20 0 BEADRP CCCC[C@@H](COC)[NH2+][C@H](CN)CC(C)C ZINC000414856407 385712377 /nfs/dbraw/zinc/71/23/77/385712377.db2.gz YXUULHHYEOLDFX-STQMWFEESA-N 2 0 230.396 2.155 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H](C)CCc1ccsc1 ZINC000414857302 385727598 /nfs/dbraw/zinc/72/75/98/385727598.db2.gz CNZNZNYHHMPWEF-NSHDSACASA-N 2 0 226.389 2.268 20 0 BEADRP Cc1cccc(C[NH2+][C@H](C)[C@@H]2CCC[NH2+]C2)c1 ZINC000414857827 385732291 /nfs/dbraw/zinc/73/22/91/385732291.db2.gz QHCKKUWBHDJRTF-UKRRQHHQSA-N 2 0 232.371 2.473 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000488291036 385734036 /nfs/dbraw/zinc/73/40/36/385734036.db2.gz GVRPXNXETTZCDX-HZSPNIEDSA-N 2 0 222.376 2.060 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H](C)CCc1ccc(F)cc1 ZINC000414858612 385736562 /nfs/dbraw/zinc/73/65/62/385736562.db2.gz KGOCQTNNOCADSX-LBPRGKRZSA-N 2 0 238.350 2.346 20 0 BEADRP CC(C)C[C@H]([NH3+])CNCC1([NH3+])CCCCCC1 ZINC000414858456 385737109 /nfs/dbraw/zinc/73/71/09/385737109.db2.gz JKTPIFBAODUGJG-ZDUSSCGKSA-N 2 0 241.423 2.001 20 0 BEADRP C[C@@H]([NH2+]Cc1ccsc1)[C@@H]1CCC[NH2+]C1 ZINC000414859859 385739255 /nfs/dbraw/zinc/73/92/55/385739255.db2.gz UTNREXLVBZHBCP-ZYHUDNBSSA-N 2 0 224.373 2.226 20 0 BEADRP CC1(C)CC(C[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)C1 ZINC000647795000 385742707 /nfs/dbraw/zinc/74/27/07/385742707.db2.gz HNAPOYJXRVIWKK-MELADBBJSA-N 2 0 236.403 2.400 20 0 BEADRP C[C@H]([NH2+]Cc1cccc(F)c1)[C@H]1CCC[NH2+]C1 ZINC000414861242 385744971 /nfs/dbraw/zinc/74/49/71/385744971.db2.gz WHSBEKGGAVUHRU-AAEUAGOBSA-N 2 0 236.334 2.303 20 0 BEADRP C[NH2+]CCC[NH2+]C[C@H](C)CCc1ccccc1 ZINC000414861635 385752734 /nfs/dbraw/zinc/75/27/34/385752734.db2.gz SLZFSNRIMZIWDA-CQSZACIVSA-N 2 0 234.387 2.454 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]Cc1cccs1 ZINC000336698776 385753474 /nfs/dbraw/zinc/75/34/74/385753474.db2.gz VSUBBRYHECCPIB-SNVBAGLBSA-N 2 0 212.362 2.355 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1C[C@H](c2ccccc2)[C@@H]1C ZINC000414864690 385764736 /nfs/dbraw/zinc/76/47/36/385764736.db2.gz ZTXLLUGLWLVKKR-AEGPPILISA-N 2 0 232.371 2.378 20 0 BEADRP CC(C)[C@@H]1CC[C@H]([NH2+][C@@H]2CC[NH2+]C2)C[C@H]1C ZINC000414865521 385768725 /nfs/dbraw/zinc/76/87/25/385768725.db2.gz DALAORDJZASFSE-RQJABVFESA-N 2 0 224.392 2.399 20 0 BEADRP Cc1c[nH+]ccc1NCC1=CC[N@H+](C)CC1 ZINC000309653276 385772317 /nfs/dbraw/zinc/77/23/17/385772317.db2.gz OXAYLFALOWFIQU-UHFFFAOYSA-N 2 0 217.316 2.064 20 0 BEADRP CC(C)[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[NH2+]C[C@H]1C ZINC000414944870 385784424 /nfs/dbraw/zinc/78/44/24/385784424.db2.gz QORUWWDPXWGEBD-RQJABVFESA-N 2 0 224.392 2.399 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CCOC1CCCC1 ZINC000336654095 385719051 /nfs/dbraw/zinc/71/90/51/385719051.db2.gz JYORVRDMYGEAQI-LBPRGKRZSA-N 2 0 228.380 2.053 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]CCCCF)c2ccccc21 ZINC000336654132 385721893 /nfs/dbraw/zinc/72/18/93/385721893.db2.gz JZQRZLUTXVCBHU-CHWSQXEVSA-N 2 0 222.307 2.471 20 0 BEADRP C[NH2+]CCC[NH2+]Cc1ccc(OCC2CC2)cc1 ZINC000414857224 385724092 /nfs/dbraw/zinc/72/40/92/385724092.db2.gz BYMYWPBDILUBHN-UHFFFAOYSA-N 2 0 248.370 2.175 20 0 BEADRP C([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)[C@@H]1C[C@H]1C1CCC1 ZINC000647799405 385799238 /nfs/dbraw/zinc/79/92/38/385799238.db2.gz FLEIQXWUVLUEPF-GVRJEKJASA-N 2 0 248.414 2.400 20 0 BEADRP C[C@@H](C[NH2+][C@H](C)CCCC[NH3+])CC(F)F ZINC000647800457 385806564 /nfs/dbraw/zinc/80/65/64/385806564.db2.gz BNLSTIFIFHXZAH-NXEZZACHSA-N 2 0 222.323 2.385 20 0 BEADRP CC1(C)CCC[C@H](C[NH2+][C@H]2CC[NH2+]C2)C1 ZINC000414867926 385810090 /nfs/dbraw/zinc/81/00/90/385810090.db2.gz GVNXBNQYBSBIRC-RYUDHWBXSA-N 2 0 210.365 2.154 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H](C)C[NH3+])c1ccccc1OC ZINC000336716540 385811343 /nfs/dbraw/zinc/81/13/43/385811343.db2.gz QDHSRUGIFNRBQG-WCQYABFASA-N 2 0 236.359 2.331 20 0 BEADRP C[C@H]([NH2+]CCC[NH+](C)C)C1CCSCC1 ZINC000186913352 385811883 /nfs/dbraw/zinc/81/18/83/385811883.db2.gz VERARTPFSZGRHM-NSHDSACASA-N 2 0 230.421 2.059 20 0 BEADRP C[C@@H]([NH2+]C[C@@H](C)CC(F)F)[C@@H]1CCC[NH2+]1 ZINC000647801553 385812007 /nfs/dbraw/zinc/81/20/07/385812007.db2.gz YHJIKSWIJOICPY-AEJSXWLSSA-N 2 0 220.307 2.008 20 0 BEADRP C[C@H](C[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)CC(F)F ZINC000647801604 385814060 /nfs/dbraw/zinc/81/40/60/385814060.db2.gz YYOWLLOBWGLOGV-GKDVJIACSA-N 2 0 232.318 2.150 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+]C[C@H]1CCCN1C ZINC000271377292 385822604 /nfs/dbraw/zinc/82/26/04/385822604.db2.gz HVIOHNWNLKUTKR-QWHCGFSZSA-N 2 0 233.359 2.135 20 0 BEADRP C[C@H]([NH2+]CCC[NH+]1CCCC1)[C@@]1(C)CCCO1 ZINC000340178856 385824004 /nfs/dbraw/zinc/82/40/04/385824004.db2.gz AVAMBBISYJFEBE-UONOGXRCSA-N 2 0 240.391 2.020 20 0 BEADRP C[C@@H]([NH2+]CCC[NH+]1CCCC1)[C@@]1(C)CCCO1 ZINC000340178857 385824554 /nfs/dbraw/zinc/82/45/54/385824554.db2.gz AVAMBBISYJFEBE-ZIAGYGMSSA-N 2 0 240.391 2.020 20 0 BEADRP COCc1cccc(C[NH2+][C@H]2CC[NH2+][C@@H](C)C2)c1 ZINC000414952444 385826133 /nfs/dbraw/zinc/82/61/33/385826133.db2.gz QSTCZMYEAMXXEM-WFASDCNBSA-N 2 0 248.370 2.063 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCC[C@@H]2C)CC[NH2+]1 ZINC000414954545 385829720 /nfs/dbraw/zinc/82/97/20/385829720.db2.gz SQSCZDJTWXXKFS-UMSGYPCISA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]Cc1ccc(OCC2CC2)cc1 ZINC000414869109 385832038 /nfs/dbraw/zinc/83/20/38/385832038.db2.gz ABHFOVHHKMHKPI-GFCCVEGCSA-N 2 0 248.370 2.160 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+]CCCCOc1ccccc1 ZINC000414871641 385858104 /nfs/dbraw/zinc/85/81/04/385858104.db2.gz DRVZLYQJOVNNCP-ZDUSSCGKSA-N 2 0 236.359 2.030 20 0 BEADRP CC[C@H](Cc1ccccc1)[NH2+][C@@H]1CCCNC1 ZINC000414870300 385848557 /nfs/dbraw/zinc/84/85/57/385848557.db2.gz SFJVIAZQXIDHDA-HUUCEWRRSA-N 2 0 232.371 2.349 20 0 BEADRP CCC[C@H](C[N@H+](C)[C@H]1CCN(C)[C@@H](C)C1)OC ZINC000638115762 385851466 /nfs/dbraw/zinc/85/14/66/385851466.db2.gz FYYOFSZPRHDMAM-MELADBBJSA-N 2 0 242.407 2.216 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CC2([NH3+])CCC2)C[C@H]1C ZINC000414870847 385852705 /nfs/dbraw/zinc/85/27/05/385852705.db2.gz CREZVGNJRXDANR-IJLUTSLNSA-N 2 0 210.365 2.282 20 0 BEADRP CCC[NH2+]CC[NH2+][C@@H]1CC[C@H](C)[C@H](C)C1 ZINC000414874962 385892340 /nfs/dbraw/zinc/89/23/40/385892340.db2.gz TZSBUKVGZJMXCY-YNEHKIRRSA-N 2 0 212.381 2.400 20 0 BEADRP Cc1ccncc1C[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000414967668 385929749 /nfs/dbraw/zinc/92/97/49/385929749.db2.gz QREHDFATELFDSB-AWEZNQCLSA-N 2 0 233.359 2.012 20 0 BEADRP COc1ccccc1C[C@H](C)[NH2+]CC1([NH3+])CCC1 ZINC000414877441 385921079 /nfs/dbraw/zinc/92/10/79/385921079.db2.gz MXVZANFNUHVDHK-LBPRGKRZSA-N 2 0 248.370 2.097 20 0 BEADRP [NH3+]CC1CCC([NH2+][C@@H]2CC=CCC2)CC1 ZINC000335034215 385923238 /nfs/dbraw/zinc/92/32/38/385923238.db2.gz KSSMBALFYYMKGZ-OTTFEQOBSA-N 2 0 208.349 2.202 20 0 BEADRP C([NH2+]C1CCC2(CC2)CC1)[C@@H]1CCC[NH2+]1 ZINC000335034840 385923384 /nfs/dbraw/zinc/92/33/84/385923384.db2.gz ZEXHFUVDUHCDFQ-LBPRGKRZSA-N 2 0 208.349 2.051 20 0 BEADRP CCC[NH2+]CC[NH2+]C[C@H](C)CC(C)C ZINC000414877318 385925440 /nfs/dbraw/zinc/92/54/40/385925440.db2.gz XOBBIGIOZSPIPC-GFCCVEGCSA-N 2 0 200.370 2.258 20 0 BEADRP CCOc1ccccc1CN[C@H]1CC[NH2+]C[C@@H]1C ZINC000414966959 385925916 /nfs/dbraw/zinc/92/59/16/385925916.db2.gz XCCPGDKXWOUVCW-JSGCOSHPSA-N 2 0 248.370 2.173 20 0 BEADRP CCCC[N@@H+]1CC[C@]2(C1)CCC[NH+](C)C2 ZINC000335038400 385927583 /nfs/dbraw/zinc/92/75/83/385927583.db2.gz QALSWPDQFPIQHP-CYBMUJFWSA-N 2 0 210.365 2.204 20 0 BEADRP COc1ccc2oc(C[NH2+]C[C@H](C)C[NH3+])cc2c1 ZINC000414873259 385873396 /nfs/dbraw/zinc/87/33/96/385873396.db2.gz GWTBVMRUSZCFRM-SNVBAGLBSA-N 2 0 248.326 2.126 20 0 BEADRP CC[N@H+](C)C[C@H]1CC[NH+](C[C@@](C)(CC)OC)C1 ZINC000638136051 385878800 /nfs/dbraw/zinc/87/88/00/385878800.db2.gz WRBKHOVNMJTZTO-ZIAGYGMSSA-N 2 0 242.407 2.075 20 0 BEADRP CC[N@H+](C)C[C@@H]1CC[NH+](C[C@](C)(CC)OC)C1 ZINC000638136046 385879574 /nfs/dbraw/zinc/87/95/74/385879574.db2.gz WRBKHOVNMJTZTO-KBPBESRZSA-N 2 0 242.407 2.075 20 0 BEADRP C([NH2+][C@@H]1CCCC12CCC2)[C@@H]1CCC[NH2+]C1 ZINC000335018792 385978508 /nfs/dbraw/zinc/97/85/08/385978508.db2.gz LAAFMFHCNPDONI-CHWSQXEVSA-N 2 0 222.376 2.298 20 0 BEADRP C([NH2+]C1CCC2(CC2)CC1)[C@H]1CCC[NH2+]C1 ZINC000335019747 385978824 /nfs/dbraw/zinc/97/88/24/385978824.db2.gz SEHMLVCTVUBPPX-LBPRGKRZSA-N 2 0 222.376 2.298 20 0 BEADRP CCSCC[C@@H](C)[N@H+](C)CC(C)(C)[NH3+] ZINC000336748257 385983072 /nfs/dbraw/zinc/98/30/72/385983072.db2.gz DBSNJROSYCTFSE-SNVBAGLBSA-N 2 0 218.410 2.187 20 0 BEADRP Cc1cc(N)cc(C[NH2+]C[C@H]2CC[NH2+][C@H](C)C2)c1 ZINC000414972417 385983949 /nfs/dbraw/zinc/98/39/49/385983949.db2.gz XWWPWTFTFBTCFD-OLZOCXBDSA-N 2 0 247.386 2.055 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]C1CCCCC1 ZINC000335023352 385984467 /nfs/dbraw/zinc/98/44/67/385984467.db2.gz GTFDJBWASBJQJE-YPMHNXCESA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]C[C@H](C)c1ccc(F)cc1 ZINC000414877737 385931141 /nfs/dbraw/zinc/93/11/41/385931141.db2.gz NEHZRLSKBPIVTB-MNOVXSKESA-N 2 0 224.323 2.114 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCCc2ccccc21)C1C[NH2+]C1 ZINC000335039061 385931606 /nfs/dbraw/zinc/93/16/06/385931606.db2.gz LSRUKJYEDZEDBO-IAQYHMDHSA-N 2 0 230.355 2.262 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+]Cc1cc(F)cc(Cl)c1 ZINC000414878552 385934700 /nfs/dbraw/zinc/93/47/00/385934700.db2.gz OFNVXTZKNCVODM-QMMMGPOBSA-N 2 0 230.714 2.164 20 0 BEADRP Cc1ccc2c(c1)[C@@H]([NH2+]C1CC[NH2+]CC1)CC2 ZINC000335043652 385935677 /nfs/dbraw/zinc/93/56/77/385935677.db2.gz QSNPXPLYYNTILT-HNNXBMFYSA-N 2 0 230.355 2.324 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[NH2+]C[C@H]1C)[C@H]1CC1(C)C ZINC000397775112 385938964 /nfs/dbraw/zinc/93/89/64/385938964.db2.gz IBNOOGJUFAAIOI-KKOKHZNYSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[NH2+]C[C@H]1C)[C@H]1CC1(C)C ZINC000397775113 385939349 /nfs/dbraw/zinc/93/93/49/385939349.db2.gz IBNOOGJUFAAIOI-KXNHARMFSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@H](CC[NH3+])[NH2+]Cc1cnc(C2CCC2)s1 ZINC000414879168 385939315 /nfs/dbraw/zinc/93/93/15/385939315.db2.gz IDDQBGZNRRCHHK-SECBINFHSA-N 2 0 239.388 2.238 20 0 BEADRP CC[C@H](C)C[C@H](CC)[NH2+]C[C@H](C)C[NH3+] ZINC000414879116 385945815 /nfs/dbraw/zinc/94/58/15/385945815.db2.gz PCGDSXCIRFPUNY-TUAOUCFPSA-N 2 0 200.370 2.386 20 0 BEADRP [NH3+]C1(CN[C@H]2CCc3cc(F)ccc32)CCC1 ZINC000335052519 385951031 /nfs/dbraw/zinc/95/10/31/385951031.db2.gz LTRZIHXQTWTEJU-ZDUSSCGKSA-N 2 0 234.318 2.284 20 0 BEADRP C[C@H]1Cc2ccccc2[C@H]1[NH2+]CC1([NH3+])CCC1 ZINC000335056827 385955763 /nfs/dbraw/zinc/95/57/63/385955763.db2.gz ZEUHWLRMBQYUFJ-FZMZJTMJSA-N 2 0 230.355 2.391 20 0 BEADRP Cc1c[nH+]ccc1N1CC[C@]2(C1)CCC[N@@H+](C)C2 ZINC000335056008 385955975 /nfs/dbraw/zinc/95/59/75/385955975.db2.gz SQPROYDOXRYESD-OAHLLOKOSA-N 2 0 245.370 2.312 20 0 BEADRP C[C@H]([NH2+]CCCC[N@H+](C)C1CC1)[C@@H]1C[C@H]1C ZINC000414146337 385993903 /nfs/dbraw/zinc/99/39/03/385993903.db2.gz KYMBWVPWAXNXBQ-MBNYWOFBSA-N 2 0 224.392 2.495 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H](C)[C@H]1CCCOC1 ZINC000338299320 385959980 /nfs/dbraw/zinc/95/99/80/385959980.db2.gz ZGSLUHUTRDRJIO-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)C1CCC([NH2+]C[C@H](C)C[NH3+])CC1 ZINC000414879960 385961194 /nfs/dbraw/zinc/96/11/94/385961194.db2.gz QAYRXQGCLHVHQT-PNESKVBLSA-N 2 0 212.381 2.386 20 0 BEADRP C[C@H](c1cccnc1)[N@@H+]1CCC[C@H]([C@H](C)[NH3+])C1 ZINC000251290038 385962700 /nfs/dbraw/zinc/96/27/00/385962700.db2.gz VFUWQVSYVZGFEA-SCRDCRAPSA-N 2 0 233.359 2.202 20 0 BEADRP CC[C@@H](C[NH2+]C[C@H](C)C[NH3+])c1ccccc1 ZINC000414879989 385963160 /nfs/dbraw/zinc/96/31/60/385963160.db2.gz QFOWJKLSJZRESR-OLZOCXBDSA-N 2 0 220.360 2.365 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCC[C@H]1C1CC1)C[NH+](C)C ZINC000336749622 385997321 /nfs/dbraw/zinc/99/73/21/385997321.db2.gz UIGXOOCJHJODND-XBFCOCLRSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)c1ccncc1 ZINC000414168741 386013642 /nfs/dbraw/zinc/01/36/42/386013642.db2.gz ALBZJVPCLYPJRD-UONOGXRCSA-N 2 0 247.386 2.464 20 0 BEADRP COC(C)(C)[C@H](C)[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC000414169826 386016764 /nfs/dbraw/zinc/01/67/64/386016764.db2.gz BODLPBZMNOWFFD-QWHCGFSZSA-N 2 0 242.407 2.121 20 0 BEADRP [NH3+]C1(C[NH2+]CC2CCCCCC2)CCC1 ZINC000414883151 386019947 /nfs/dbraw/zinc/01/99/47/386019947.db2.gz MVKRIIUCZXGKCJ-UHFFFAOYSA-N 2 0 210.365 2.428 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]CC2=CC[NH2+]CC2)C1 ZINC000335061870 386026649 /nfs/dbraw/zinc/02/66/49/386026649.db2.gz YSUODMGFCMOKGM-DGCLKSJQSA-N 2 0 208.349 2.074 20 0 BEADRP C[C@@H](CCc1ccccc1)[NH2+]C[C@H]([NH3+])C1CC1 ZINC000414883828 386035760 /nfs/dbraw/zinc/03/57/60/386035760.db2.gz DQDWMGNMBRUZMM-WFASDCNBSA-N 2 0 232.371 2.335 20 0 BEADRP COCCC[C@@H](C)[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC000414201712 386036642 /nfs/dbraw/zinc/03/66/42/386036642.db2.gz YIGAOKKZAOLQSX-ZIAGYGMSSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)C1(C)CC1 ZINC000414202935 386040997 /nfs/dbraw/zinc/04/09/97/386040997.db2.gz ZONDGVKEAGMPBV-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCc2nc[nH]c2C1)c1cscn1 ZINC000334432462 386050674 /nfs/dbraw/zinc/05/06/74/386050674.db2.gz WVYUERJSKXESID-BDAKNGLRSA-N 2 0 248.355 2.074 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCc2nc[nH]c2C1)c1cscn1 ZINC000334432470 386050754 /nfs/dbraw/zinc/05/07/54/386050754.db2.gz WVYUERJSKXESID-RKDXNWHRSA-N 2 0 248.355 2.074 20 0 BEADRP C[C@@H]1C[C@H]1C[NH2+]CC(C)(C)C[NH+]1CCCC1 ZINC000336749557 385996052 /nfs/dbraw/zinc/99/60/52/385996052.db2.gz UDHZSZJALGGDAS-OLZOCXBDSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H](CC[NH3+])[NH2+]CCCCOc1ccccc1 ZINC000414888734 386104977 /nfs/dbraw/zinc/10/49/77/386104977.db2.gz FLXSJHHIIVPDBR-ZDUSSCGKSA-N 2 0 236.359 2.173 20 0 BEADRP c1ccc2c(c1)CC[C@H]2[NH2+]C1CC[NH2+]CC1 ZINC000038040686 386116814 /nfs/dbraw/zinc/11/68/14/386116814.db2.gz JGOIQLVNQBIZQU-CQSZACIVSA-N 2 0 216.328 2.016 20 0 BEADRP CCC[N@@H+]1CC[C@@H](CNCc2ccoc2C)C1 ZINC000414320280 386118099 /nfs/dbraw/zinc/11/80/99/386118099.db2.gz SFTMJEPLFDMJJH-ZDUSSCGKSA-N 2 0 236.359 2.410 20 0 BEADRP CC[C@@H]1CCC[C@H](C[NH2+][C@@H]2CC[NH2+]C2)C1 ZINC000414886756 386078404 /nfs/dbraw/zinc/07/84/04/386078404.db2.gz QLCFCVGOBWXTGT-FRRDWIJNSA-N 2 0 210.365 2.154 20 0 BEADRP FC1(F)CC[C@@H](C[N@@H+]2CC[C@]3(CC[NH2+]C3)C2)C1 ZINC000310087561 386082405 /nfs/dbraw/zinc/08/24/05/386082405.db2.gz BLOPNIZDEWTGOT-NEPJUHHUSA-N 2 0 244.329 2.107 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@@H](C)CCc1ccsc1 ZINC000414984336 386091670 /nfs/dbraw/zinc/09/16/70/386091670.db2.gz GDMCCDZGPRUZDM-JQWIXIFHSA-N 2 0 226.389 2.396 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H](C)[C@@H](C)c1ccccc1 ZINC000414887750 386095225 /nfs/dbraw/zinc/09/52/25/386095225.db2.gz ZKEHWASEYRQDAF-JHJVBQTASA-N 2 0 220.360 2.363 20 0 BEADRP C[C@@H](C[NH2+]C[C@H]([NH3+])C1CC1)c1ccc(F)cc1 ZINC000414888488 386098629 /nfs/dbraw/zinc/09/86/29/386098629.db2.gz JWVJCZSSWLFINI-HZMBPMFUSA-N 2 0 236.334 2.256 20 0 BEADRP C[C@H](CCc1ccsc1)[NH2+]C[C@H]([NH3+])C1CC1 ZINC000414891867 386147018 /nfs/dbraw/zinc/14/70/18/386147018.db2.gz OTDSKJMVJCQRJE-MFKMUULPSA-N 2 0 238.400 2.396 20 0 BEADRP COc1ccc([C@H]2CCC[N@@H+]2CCC[NH3+])cc1 ZINC000414676026 386148851 /nfs/dbraw/zinc/14/88/51/386148851.db2.gz UQKJKCWNJZNAKW-CQSZACIVSA-N 2 0 234.343 2.181 20 0 BEADRP CC[C@H]([NH3+])C[NH2+]C[C@H](C)c1ccccc1 ZINC000414991466 386153193 /nfs/dbraw/zinc/15/31/93/386153193.db2.gz QEZBNIRZFQQXGO-AAEUAGOBSA-N 2 0 206.333 2.117 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]C1CCSCC1 ZINC000335159249 386154713 /nfs/dbraw/zinc/15/47/13/386154713.db2.gz WANPDROCSPOFRT-VXGBXAGGSA-N 2 0 228.405 2.132 20 0 BEADRP C[N@H+](CCC[NH3+])[C@H]1CCCc2ccccc21 ZINC000106164357 386156803 /nfs/dbraw/zinc/15/68/03/386156803.db2.gz CHZJADGLZLIALG-AWEZNQCLSA-N 2 0 218.344 2.345 20 0 BEADRP CC[NH+](CC)[C@@H]1CCN(c2cc[nH+]c(C)c2)C1 ZINC000274951877 386165901 /nfs/dbraw/zinc/16/59/01/386165901.db2.gz VIKCOOREQJIFHP-CQSZACIVSA-N 2 0 233.359 2.311 20 0 BEADRP [NH3+]CCC[N@H+](C1CC1)[C@@H]1CCc2ccccc21 ZINC000414685952 386174348 /nfs/dbraw/zinc/17/43/48/386174348.db2.gz FJBBFDKQJKUQMZ-OAHLLOKOSA-N 2 0 230.355 2.487 20 0 BEADRP CC[N@H+](C)Cc1cn(-c2cc[nH+]cc2)nc1C ZINC000346189792 386181116 /nfs/dbraw/zinc/18/11/16/386181116.db2.gz ZLIPRMGQNNTKJX-UHFFFAOYSA-N 2 0 230.315 2.027 20 0 BEADRP Cc1ccccc1C[C@@H]1CCC[N@@H+]1CCC[NH3+] ZINC000414691618 386188432 /nfs/dbraw/zinc/18/84/32/386188432.db2.gz JXPDYPDNUAMDJT-HNNXBMFYSA-N 2 0 232.371 2.351 20 0 BEADRP CC[C@H](C)C[NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1 ZINC000093079485 386124786 /nfs/dbraw/zinc/12/47/86/386124786.db2.gz PNCAQOZWCDDGES-XQQFMLRXSA-N 2 0 212.381 2.495 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+][C@@H]1C[C@H]1c1ccco1 ZINC000414328833 386125568 /nfs/dbraw/zinc/12/55/68/386125568.db2.gz CTMJQMQISORYRZ-XGFWRYKXSA-N 2 0 248.370 2.454 20 0 BEADRP Cc1cncc([C@@H](C)[NH2+]CCCC[NH+](C)C)c1 ZINC000274633398 386131932 /nfs/dbraw/zinc/13/19/32/386131932.db2.gz RVWJHCMFDVKVJL-CYBMUJFWSA-N 2 0 235.375 2.382 20 0 BEADRP CCN(CC[NH2+][C@H](C)C(C)(C)C)C1CC1 ZINC000155875449 386136976 /nfs/dbraw/zinc/13/69/76/386136976.db2.gz ZLPUZFSCCVHXRU-LLVKDONJSA-N 2 0 212.381 2.495 20 0 BEADRP COc1ccc([C@@H](C)[N@H+](C)C[C@@H]2CC[NH2+]C2)cc1 ZINC000647874677 386142217 /nfs/dbraw/zinc/14/22/17/386142217.db2.gz MMPZRICYWGCPKN-CHWSQXEVSA-N 2 0 248.370 2.298 20 0 BEADRP c1ccc(C[C@H]2CCC[N@H+]2C[C@H]2CC[NH2+]C2)cc1 ZINC000647874686 386142945 /nfs/dbraw/zinc/14/29/45/386142945.db2.gz MQURZDAIBZDRQO-JKSUJKDBSA-N 2 0 244.382 2.303 20 0 BEADRP Fc1cccc(CN(C[C@H]2CC[NH2+]C2)C2CC2)c1 ZINC000647874845 386144098 /nfs/dbraw/zinc/14/40/98/386144098.db2.gz CTHZUGWZRIZMPC-ZDUSSCGKSA-N 2 0 248.345 2.400 20 0 BEADRP CCCC[N@H+](CCOC)C[C@H]1CC[NH2+][C@H](C)C1 ZINC000414701166 386202004 /nfs/dbraw/zinc/20/20/04/386202004.db2.gz UBNVRQYRPRSPKU-KGLIPLIRSA-N 2 0 242.407 2.123 20 0 BEADRP [NH3+]CCC[N@@H+]1CCCC2(CCCCC2)C1 ZINC000414697075 386203016 /nfs/dbraw/zinc/20/30/16/386203016.db2.gz PVFDHJSLRZLXAZ-UHFFFAOYSA-N 2 0 210.365 2.382 20 0 BEADRP CC[N@H+](C[C@@H]1CC[NH2+][C@@H](C)C1)C1CCC1 ZINC000414704294 386213796 /nfs/dbraw/zinc/21/37/96/386213796.db2.gz MVBZBSBYDOSZIV-NWDGAFQWSA-N 2 0 210.365 2.249 20 0 BEADRP CC(C)(C)c1cnc(C[NH2+]CCCC[NH3+])s1 ZINC000414897177 386215556 /nfs/dbraw/zinc/21/55/56/386215556.db2.gz BDNXDDXFALFGAP-UHFFFAOYSA-N 2 0 241.404 2.269 20 0 BEADRP [NH3+][C@@H](CNCc1cc2cc(F)ccc2o1)C1CC1 ZINC000414897300 386218040 /nfs/dbraw/zinc/21/80/40/386218040.db2.gz RCYLTERYJJZQFW-ZDUSSCGKSA-N 2 0 248.301 2.399 20 0 BEADRP C[C@@H](C[NH2+]C[C@H]1CCC[NH2+]C1)c1ccccc1 ZINC000132020624 386218427 /nfs/dbraw/zinc/21/84/27/386218427.db2.gz ZBZUNAZLFPKGCF-KBPBESRZSA-N 2 0 232.371 2.379 20 0 BEADRP CCN1C[C@H]([NH2+][C@H](C)CC(C)(C)OC)[C@@H](C)C1 ZINC000347141904 386260111 /nfs/dbraw/zinc/26/01/11/386260111.db2.gz HXKPWOLKDLYGLD-XQQFMLRXSA-N 2 0 242.407 2.120 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[NH2+]C1)c1cccc(O)c1 ZINC000132167584 386226456 /nfs/dbraw/zinc/22/64/56/386226456.db2.gz DKXHJSHHDLEMAY-NWDGAFQWSA-N 2 0 234.343 2.042 20 0 BEADRP CC(C)(C)C[C@@H]1CCC[N@@H+]1C[C@H]1CC[NH2+]C1 ZINC000647882635 386234264 /nfs/dbraw/zinc/23/42/64/386234264.db2.gz HSGABDGIDCGDKI-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1SCC[N@H+](CCC2CC[NH2+]CC2)[C@H]1C ZINC000132525906 386241382 /nfs/dbraw/zinc/24/13/82/386241382.db2.gz YPQKENNBTPTURS-RYUDHWBXSA-N 2 0 242.432 2.202 20 0 BEADRP Fc1ccc2c(c1)CC[N@@H+](CC1CC[NH2+]CC1)C2 ZINC000297312733 386241456 /nfs/dbraw/zinc/24/14/56/386241456.db2.gz IBCYCIJBYLBOCL-UHFFFAOYSA-N 2 0 248.345 2.183 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2C[C@H]2C2CC[NH2+]CC2)cc1 ZINC000415003185 386246404 /nfs/dbraw/zinc/24/64/04/386246404.db2.gz FJYCZJDWSKCSSP-JKSUJKDBSA-N 2 0 244.382 2.473 20 0 BEADRP C[C@H]1C[N@H+](CCC[NH3+])CC[C@H]1c1ccccc1 ZINC000414718842 386248722 /nfs/dbraw/zinc/24/87/22/386248722.db2.gz ZTOKFJGVMVMGRD-DZGCQCFKSA-N 2 0 232.371 2.461 20 0 BEADRP CC[N@H+](CC[C@H]1CCC[NH+]1C)C1CCC1 ZINC000336646633 386253673 /nfs/dbraw/zinc/25/36/73/386253673.db2.gz KWQAYOICEVKXTH-GFCCVEGCSA-N 2 0 210.365 2.345 20 0 BEADRP CC[C@H]1CCC[N@@H+]1CC[C@@H]1CCC[NH+]1C ZINC000336645802 386255430 /nfs/dbraw/zinc/25/54/30/386255430.db2.gz IYLMZJBEEUMYET-STQMWFEESA-N 2 0 210.365 2.345 20 0 BEADRP C[C@H](CC1CC1)[NH2+]C[C@H]1CCC[C@H]([NH3+])C1 ZINC000415003610 386261359 /nfs/dbraw/zinc/26/13/59/386261359.db2.gz NIWGKIKHJYVGQD-WXHSDQCUSA-N 2 0 210.365 2.282 20 0 BEADRP CCC[N@H+](CCC[NH3+])[C@@H]1C[C@H](OCC)C1(C)C ZINC000414693091 386194593 /nfs/dbraw/zinc/19/45/93/386194593.db2.gz DLNHAMLHEMFOJN-OLZOCXBDSA-N 2 0 242.407 2.251 20 0 BEADRP CC[C@H](C)[C@H]1CCCC[N@@H+]1C[C@@H]1CC[NH2+]C1 ZINC000647886676 386298945 /nfs/dbraw/zinc/29/89/45/386298945.db2.gz IMVIJOYOMSBCBK-BFHYXJOUSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]C[C@H]2CC[NH2+]C2)[C@H]1C ZINC000414901513 386307206 /nfs/dbraw/zinc/30/72/06/386307206.db2.gz GBTTVJUPKBTFPE-VOAKCMCISA-N 2 0 210.365 2.010 20 0 BEADRP CC[C@@H](C)C[N@H+](CC)CCC[NH+](C)C ZINC000336669494 386312521 /nfs/dbraw/zinc/31/25/21/386312521.db2.gz DWYGPIPNQUMSBW-GFCCVEGCSA-N 2 0 200.370 2.306 20 0 BEADRP [NH3+]CCCC[NH2+]Cc1cccc(OC(F)F)c1 ZINC000414902094 386322802 /nfs/dbraw/zinc/32/28/02/386322802.db2.gz JMTSPDMZDLTRQN-UHFFFAOYSA-N 2 0 244.285 2.117 20 0 BEADRP COc1ccc(CN(C2CC2)[C@@H]2CC[NH2+]C2)cc1 ZINC000347155549 386264051 /nfs/dbraw/zinc/26/40/51/386264051.db2.gz CYHLWURDDWMNGL-CQSZACIVSA-N 2 0 246.354 2.022 20 0 BEADRP CC(C)c1cnc(C[NH2+]CCCC[NH3+])s1 ZINC000414903819 386345298 /nfs/dbraw/zinc/34/52/98/386345298.db2.gz LTQAZEVKRVMXFS-UHFFFAOYSA-N 2 0 227.377 2.095 20 0 BEADRP CCO[C@@H](CC[NH+](C)C)C[NH2+]CCC(C)(C)C ZINC000188278326 386347284 /nfs/dbraw/zinc/34/72/84/386347284.db2.gz PALPJEQUQVJOMP-ZDUSSCGKSA-N 2 0 244.423 2.369 20 0 BEADRP Cc1ccc([C@@]2(C)CC[N@H+](CCC[NH3+])C2)cc1 ZINC000414747095 386351818 /nfs/dbraw/zinc/35/18/18/386351818.db2.gz RRDCHXDIDVCQCW-HNNXBMFYSA-N 2 0 232.371 2.307 20 0 BEADRP C[C@H](CCCC(F)(F)F)[NH2+][C@H](C)[C@H](C)[NH3+] ZINC000415007334 386357528 /nfs/dbraw/zinc/35/75/28/386357528.db2.gz CPXGNJFFYVGKPG-HRDYMLBCSA-N 2 0 226.286 2.433 20 0 BEADRP C([C@@H]1CC[NH2+]C1)[NH+]1CCC(C2CCCC2)CC1 ZINC000647889959 386362541 /nfs/dbraw/zinc/36/25/41/386362541.db2.gz ALZDNXIMCHIHQO-CYBMUJFWSA-N 2 0 236.403 2.498 20 0 BEADRP Fc1cccc([C@@H]2CCN2C[C@H]2CC[NH2+]C2)c1 ZINC000647890038 386364226 /nfs/dbraw/zinc/36/42/26/386364226.db2.gz IQBKAUMETFJGEQ-FZMZJTMJSA-N 2 0 234.318 2.182 20 0 BEADRP C[C@]1(c2ccccc2)CC[N@H+](C[C@H]2CC[NH2+]C2)C1 ZINC000647890172 386367670 /nfs/dbraw/zinc/36/76/70/386367670.db2.gz WSOIPYCXMNFCPP-HOCLYGCPSA-N 2 0 244.382 2.260 20 0 BEADRP C[C@H]([NH2+]CC(C)(C)C[NH+]1CCCC1)C1CC1 ZINC000336743225 386370792 /nfs/dbraw/zinc/37/07/92/386370792.db2.gz OUWVEXLUPNHSJM-LBPRGKRZSA-N 2 0 224.392 2.497 20 0 BEADRP COC(C)(C)CC[N@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000336695681 386374622 /nfs/dbraw/zinc/37/46/22/386374622.db2.gz OEJPZEDCLYUITP-CYBMUJFWSA-N 2 0 242.407 2.075 20 0 BEADRP CC1(C)C[N@H+](CCC[NH3+])CC[C@H]1C(F)(F)F ZINC000414751762 386377716 /nfs/dbraw/zinc/37/77/16/386377716.db2.gz AZAUAHCTPOJFGF-SECBINFHSA-N 2 0 238.297 2.246 20 0 BEADRP C[C@@H]1[C@H](Cc2ccccc2)CC[N@@H+]1CCC[NH3+] ZINC000414740227 386329673 /nfs/dbraw/zinc/32/96/73/386329673.db2.gz JRCHLIUSXOGVSI-HIFRSBDPSA-N 2 0 232.371 2.288 20 0 BEADRP COCCC1(C[NH2+][C@@H](C)CCCC[NH3+])CCC1 ZINC000415006782 386338892 /nfs/dbraw/zinc/33/88/92/386338892.db2.gz AFULPXSIXRUCTG-ZDUSSCGKSA-N 2 0 242.407 2.300 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+]Cc1ccc(F)cc1 ZINC000335279282 386392014 /nfs/dbraw/zinc/39/20/14/386392014.db2.gz OYHOWFNDIIWKEO-AVJIGQEQSA-N 2 0 248.345 2.431 20 0 BEADRP CCCc1cccc(C[NH2+]CCCC[NH3+])c1 ZINC000414909295 386404170 /nfs/dbraw/zinc/40/41/70/386404170.db2.gz QVVUVDKYTXPLJE-UHFFFAOYSA-N 2 0 220.360 2.468 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]Cc2ccc(F)c(F)c2)C1 ZINC000093215564 386406698 /nfs/dbraw/zinc/40/66/98/386406698.db2.gz DHLPWEFTDVFWTA-GHMZBOCLSA-N 2 0 240.297 2.324 20 0 BEADRP C[N@H+](CC1CC1)C[C@@H]1CC[NH+](CCC2CC2)C1 ZINC000336706976 386409872 /nfs/dbraw/zinc/40/98/72/386409872.db2.gz LDBWWMUMSVXPBI-HNNXBMFYSA-N 2 0 236.403 2.450 20 0 BEADRP C[C@H](CC1CCOCC1)[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000414909742 386416147 /nfs/dbraw/zinc/41/61/47/386416147.db2.gz CJRMHTJPEXAJOL-BNOWGMLFSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H](C[C@H]1CCC[NH2+]1)[NH2+]CCc1ccccc1 ZINC000093462327 386416352 /nfs/dbraw/zinc/41/63/52/386416352.db2.gz QURXJOUDYSAHGI-DZGCQCFKSA-N 2 0 232.371 2.349 20 0 BEADRP C[NH+](C)[C@H]1CCC[N@H+](CCc2cccnc2)CC1 ZINC000277262348 386421543 /nfs/dbraw/zinc/42/15/43/386421543.db2.gz RAPJYKZASVZDRS-HNNXBMFYSA-N 2 0 247.386 2.040 20 0 BEADRP CC[C@@H]1C[N@H+](Cc2ccc(C)nc2C)CC[C@H]1[NH3+] ZINC000647934381 386473671 /nfs/dbraw/zinc/47/36/71/386473671.db2.gz CQEPVKNIAQYODB-UKRRQHHQSA-N 2 0 247.386 2.258 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]Cc1cc(O)cc(F)c1 ZINC000415011268 386483219 /nfs/dbraw/zinc/48/32/19/386483219.db2.gz HGAYNBYKMAJJFM-JTQLQIEISA-N 2 0 240.322 2.138 20 0 BEADRP CCOc1ccccc1C[NH2+][C@@H]1CC[C@@H](C[NH3+])C1 ZINC000415044367 386529276 /nfs/dbraw/zinc/52/92/76/386529276.db2.gz SJLUIOIKKRTGSP-TZMCWYRMSA-N 2 0 248.370 2.302 20 0 BEADRP C[N@H+](C/C=C/c1ccc(F)cc1)C1CC([NH3+])C1 ZINC000414779454 386491003 /nfs/dbraw/zinc/49/10/03/386491003.db2.gz REVONVMBYBFKDV-NSCUHMNNSA-N 2 0 234.318 2.260 20 0 BEADRP COC[C@H](CC(C)C)[NH2+]C[C@@H]1CCC[C@H]([NH3+])C1 ZINC000415014635 386500277 /nfs/dbraw/zinc/50/02/77/386500277.db2.gz ZYUMULKSTTTXNW-RDBSUJKOSA-N 2 0 242.407 2.155 20 0 BEADRP C[C@H]1CCC[C@@H]1[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000415014758 386500980 /nfs/dbraw/zinc/50/09/80/386500980.db2.gz XKAYHQJUDBUKIV-DOERSZECSA-N 2 0 222.376 2.153 20 0 BEADRP COC[C@@H](CC(C)C)[NH2+][C@@H](C)CCCC[NH3+] ZINC000415015641 386501372 /nfs/dbraw/zinc/50/13/72/386501372.db2.gz ONPIEBBTJKMPQN-QWHCGFSZSA-N 2 0 230.396 2.155 20 0 BEADRP CC(C)[C@@H]1C[C@H](C[NH2+][C@H](C)CCC[NH3+])CCO1 ZINC000415017450 386501972 /nfs/dbraw/zinc/50/19/72/386501972.db2.gz FMOFCOGGIOMMOP-MCIONIFRSA-N 2 0 242.407 2.155 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]Cc1cccc2c[nH]nc21 ZINC000415018118 386503699 /nfs/dbraw/zinc/50/36/99/386503699.db2.gz TUCCXAZXFUULII-NSHDSACASA-N 2 0 246.358 2.170 20 0 BEADRP CC(C)CC[N@@H+]1CCC[C@@H]([C@@H]2CC[NH2+]C2)C1 ZINC000414783687 386508096 /nfs/dbraw/zinc/50/80/96/386508096.db2.gz QIRTVPPXCGCHHO-ZIAGYGMSSA-N 2 0 224.392 2.354 20 0 BEADRP CC(C)c1cnc(C[NH2+][C@@H](C)CCC[NH3+])s1 ZINC000415019767 386508178 /nfs/dbraw/zinc/50/81/78/386508178.db2.gz ITVHDODGPORRKF-JTQLQIEISA-N 2 0 241.404 2.484 20 0 BEADRP CC(C)CC[N@@H+]1CCC[C@@H]([C@H]2CC[NH2+]C2)C1 ZINC000414783685 386508456 /nfs/dbraw/zinc/50/84/56/386508456.db2.gz QIRTVPPXCGCHHO-UONOGXRCSA-N 2 0 224.392 2.354 20 0 BEADRP Cc1ccc(CCC[NH2+][C@H](C)CCC[NH3+])cn1 ZINC000415020088 386509422 /nfs/dbraw/zinc/50/94/22/386509422.db2.gz IXUUYRFNJBBLLJ-GFCCVEGCSA-N 2 0 235.375 2.040 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C[C@@H]2C[C@H]2C2CC2)[C@H]2CCC[C@H]21 ZINC000453382902 386510540 /nfs/dbraw/zinc/51/05/40/386510540.db2.gz LXBFBWLBWXKZJU-XFIYOXNOSA-N 2 0 248.414 2.495 20 0 BEADRP COc1ccccc1/C=C\CN(C)C1CC([NH3+])C1 ZINC000414783350 386510997 /nfs/dbraw/zinc/51/09/97/386510997.db2.gz YYZWBITTYOLSFN-ALCCZGGFSA-N 2 0 246.354 2.130 20 0 BEADRP Cc1ccsc1C[NH2+][C@H]1CC[C@H](C[NH3+])C1 ZINC000415032295 386519483 /nfs/dbraw/zinc/51/94/83/386519483.db2.gz HYFVZXCYLJTBSC-QWRGUYRKSA-N 2 0 224.373 2.274 20 0 BEADRP Cc1ccncc1C[N@@H+]1CCCC[C@H]1CC[NH3+] ZINC000135500149 386520641 /nfs/dbraw/zinc/52/06/41/386520641.db2.gz VUYJDYFDEVHCLJ-AWEZNQCLSA-N 2 0 233.359 2.093 20 0 BEADRP Cc1ccc(F)c(C[NH2+][C@H]2CC[C@H](C[NH3+])C2)c1 ZINC000415034624 386521096 /nfs/dbraw/zinc/52/10/96/386521096.db2.gz KBTIYJNPUPCJSL-AAEUAGOBSA-N 2 0 236.334 2.351 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CCCC[C@@H]1[C@H]1CC[NH2+]C1 ZINC000415033818 386521266 /nfs/dbraw/zinc/52/12/66/386521266.db2.gz CCAALLDVQFTLCJ-XJFOESAGSA-N 2 0 222.376 2.106 20 0 BEADRP C[C@H](CCC1CC1)[NH2+][C@H]1CC[C@@H](C[NH3+])C1 ZINC000415033152 386521586 /nfs/dbraw/zinc/52/15/86/386521586.db2.gz IQJPQBOMVXDZLZ-RTXFEEFZSA-N 2 0 210.365 2.282 20 0 BEADRP CCSCC[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000336780082 386522119 /nfs/dbraw/zinc/52/21/19/386522119.db2.gz QJFTZHJHNBFVHG-UHFFFAOYSA-N 2 0 242.432 2.204 20 0 BEADRP [NH3+]C[C@H]1CC[C@@H]([NH2+]Cc2c(F)cccc2F)C1 ZINC000415037386 386524212 /nfs/dbraw/zinc/52/42/12/386524212.db2.gz MGPYEKUCTOZQAY-VHSXEESVSA-N 2 0 240.297 2.182 20 0 BEADRP CC(C)Oc1cccc(C[NH2+]C2CC[NH2+]CC2)c1 ZINC000414787930 386530514 /nfs/dbraw/zinc/53/05/14/386530514.db2.gz MBTUWXAUWXCLBO-UHFFFAOYSA-N 2 0 248.370 2.315 20 0 BEADRP CC[N@H+](C)C[C@@H]1CCN([C@H](C)c2cccnc2)C1 ZINC000266624835 386458793 /nfs/dbraw/zinc/45/87/93/386458793.db2.gz NFTPFXPBLVSPAJ-KGLIPLIRSA-N 2 0 247.386 2.416 20 0 BEADRP CC[N@H+](CC[C@@H]1CCC[NH2+]C1)Cc1ccccn1 ZINC000094916675 386462867 /nfs/dbraw/zinc/46/28/67/386462867.db2.gz XOPUFNPFJZCSHV-AWEZNQCLSA-N 2 0 247.386 2.293 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@H]1CCC[C@H]1C(C)C ZINC000414799085 386576561 /nfs/dbraw/zinc/57/65/61/386576561.db2.gz RBHIHPVOVWAWOY-XQQFMLRXSA-N 2 0 212.381 2.384 20 0 BEADRP CCCC[C@H](COC)[NH2+][C@H]1CCCC[C@@H]1C[NH3+] ZINC000414800785 386586360 /nfs/dbraw/zinc/58/63/60/386586360.db2.gz LJOFKNZRPMESHP-MCIONIFRSA-N 2 0 242.407 2.299 20 0 BEADRP Cc1ccccc1C[C@H](C)[NH2+]C[C@@H]([NH3+])C(C)C ZINC000414800596 386587871 /nfs/dbraw/zinc/58/78/71/386587871.db2.gz SEXYALYYPMQVNC-DZGCQCFKSA-N 2 0 234.387 2.499 20 0 BEADRP C[C@H](Cc1ccccc1F)[NH2+]CC(C)(C)[NH3+] ZINC000414800333 386588588 /nfs/dbraw/zinc/58/85/88/386588588.db2.gz HPNIMANFMGWWMM-SNVBAGLBSA-N 2 0 224.323 2.084 20 0 BEADRP Cc1[nH+]ccc(N[C@@H](C)CC[NH+](C)C)c1Cl ZINC000336644149 386589607 /nfs/dbraw/zinc/58/96/07/386589607.db2.gz BVNQIJRXBALCGH-VIFPVBQESA-N 2 0 241.766 2.217 20 0 BEADRP C[C@H](CC1CC1)[NH2+]C[C@H]1CC[NH2+][C@@H](C)C1 ZINC000415079569 386591006 /nfs/dbraw/zinc/59/10/06/386591006.db2.gz IJAMIRMEINRIHV-LOWVWBTDSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H](Cc1ccccc1F)[NH2+][C@@H](CN)C1CC1 ZINC000414799804 386592054 /nfs/dbraw/zinc/59/20/54/386592054.db2.gz DXOBBHAZXAUPOM-HZMBPMFUSA-N 2 0 236.334 2.084 20 0 BEADRP C[C@@H](Cc1ccccc1F)[NH2+][C@H](CN)C1CC1 ZINC000414799807 386593009 /nfs/dbraw/zinc/59/30/09/386593009.db2.gz DXOBBHAZXAUPOM-IINYFYTJSA-N 2 0 236.334 2.084 20 0 BEADRP [NH3+]CC1CCC([NH2+]CCc2cccs2)CC1 ZINC000415081566 386593955 /nfs/dbraw/zinc/59/39/55/386593955.db2.gz KWCSFAREMDZPKX-UHFFFAOYSA-N 2 0 238.400 2.398 20 0 BEADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+]Cc2ncc(Cl)s2)C1 ZINC000415045502 386531267 /nfs/dbraw/zinc/53/12/67/386531267.db2.gz UDKVTEREIJTVBJ-HTQZYQBOSA-N 2 0 245.779 2.014 20 0 BEADRP C[C@@H](CCC1CCCC1)[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000415046557 386532364 /nfs/dbraw/zinc/53/23/64/386532364.db2.gz XMLJUQPJDMULCJ-SCUASFONSA-N 2 0 222.376 2.153 20 0 BEADRP Cc1ccc(F)cc1C[NH2+][C@@H]1CC[C@H](C[NH3+])C1 ZINC000415046836 386534759 /nfs/dbraw/zinc/53/47/59/386534759.db2.gz VJGGMDDBGBTBLE-SMDDNHRTSA-N 2 0 236.334 2.351 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@H]1CC[C@@H](C)C[C@@H]1C ZINC000414790926 386540562 /nfs/dbraw/zinc/54/05/62/386540562.db2.gz HFGNSSUKQJAIGI-XQHKEYJVSA-N 2 0 212.381 2.384 20 0 BEADRP C[C@@H]1C[N@@H+]([C@H]2CCC[C@@H]2C2CC2)C[C@@]1(C)C[NH3+] ZINC000415060104 386541742 /nfs/dbraw/zinc/54/17/42/386541742.db2.gz TYVVEGCICQJTNV-REBRKWNGSA-N 2 0 236.403 2.482 20 0 BEADRP C([NH2+][C@@H]1CCCCC12CCCC2)C1C[NH2+]C1 ZINC000335461704 386543470 /nfs/dbraw/zinc/54/34/70/386543470.db2.gz LNRADJSNVKCLRR-CYBMUJFWSA-N 2 0 222.376 2.298 20 0 BEADRP Cc1ccc(C)c2c1CCC[C@@H]2[NH2+]CC1C[NH2+]C1 ZINC000335461749 386544003 /nfs/dbraw/zinc/54/40/03/386544003.db2.gz NVGSDUHMJPEOTA-HNNXBMFYSA-N 2 0 244.382 2.490 20 0 BEADRP C(C[NH2+]C1CC1)C[NH2+][C@H]1CCC[C@H]1C1CC1 ZINC000415064260 386544120 /nfs/dbraw/zinc/54/41/20/386544120.db2.gz CDUMNPHXWGDTAG-KBPBESRZSA-N 2 0 222.376 2.297 20 0 BEADRP C(=C\c1ccccc1)\C[NH2+]CCC[NH2+]C1CC1 ZINC000415063611 386544605 /nfs/dbraw/zinc/54/46/05/386544605.db2.gz APTUHVOCROJRIW-YWEYNIOJSA-N 2 0 230.355 2.432 20 0 BEADRP C[C@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)C1CCC1 ZINC000414918542 386545873 /nfs/dbraw/zinc/54/58/73/386545873.db2.gz UTTMZOABGIYFFC-WCQYABFASA-N 2 0 210.365 2.154 20 0 BEADRP Cc1ccccc1C1([NH2+]C[C@H]2CC[NH2+]C2)CC1 ZINC000647995280 386547689 /nfs/dbraw/zinc/54/76/89/386547689.db2.gz LICCIBKDXATOFO-ZDUSSCGKSA-N 2 0 230.355 2.183 20 0 BEADRP CC[C@H]1CCC[C@@H](C[NH2+][C@@H]2[C@H]3C[NH2+]C[C@H]32)C1 ZINC000415065736 386547851 /nfs/dbraw/zinc/54/78/51/386547851.db2.gz SDVKEIAZTVTFIK-MEBFFEOJSA-N 2 0 222.376 2.010 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCCC[C@H]1[C@@H]1CC[NH2+]C1 ZINC000415053107 386553568 /nfs/dbraw/zinc/55/35/68/386553568.db2.gz NZOOVTCGKDKULK-MJBXVCDLSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)CC[C@@H](C)[NH2+]C[C@H]([NH3+])C(C)C ZINC000414791274 386553556 /nfs/dbraw/zinc/55/35/56/386553556.db2.gz HMYMTISQZDSKPF-NEPJUHHUSA-N 2 0 200.370 2.384 20 0 BEADRP COc1ccc(C)cc1C[NH2+][C@@H]1CCC[C@@H]1C[NH3+] ZINC000414791212 386554660 /nfs/dbraw/zinc/55/46/60/386554660.db2.gz HIZFUVVBXZUNDU-TZMCWYRMSA-N 2 0 248.370 2.221 20 0 BEADRP C([NH2+][C@H]1CCCC[NH2+]C1)C1CCCCC1 ZINC000415073162 386560262 /nfs/dbraw/zinc/56/02/62/386560262.db2.gz XZZGHUCBZMUOHV-ZDUSSCGKSA-N 2 0 210.365 2.298 20 0 BEADRP CCC[C@H](C)[NH2+]C[C@@H](C)C[NH+]1CCCC1 ZINC000062078121 386561543 /nfs/dbraw/zinc/56/15/43/386561543.db2.gz RGROBZWMNSNWSK-OLZOCXBDSA-N 2 0 212.381 2.497 20 0 BEADRP CC[C@@H]([NH2+]C1CCC(C[NH3+])CC1)[C@H]1CCCO1 ZINC000415074628 386567226 /nfs/dbraw/zinc/56/72/26/386567226.db2.gz DAOQGSVKBNVUHZ-NWINJMCUSA-N 2 0 240.391 2.051 20 0 BEADRP C(C1CCC1)[N@@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC000647976492 386572434 /nfs/dbraw/zinc/57/24/34/386572434.db2.gz PMUQGZKWINISHH-LSDHHAIUSA-N 2 0 236.403 2.498 20 0 BEADRP CO[C@H]1CCCC[C@H]1[NH2+]C1CCC(C[NH3+])CC1 ZINC000415074380 386573984 /nfs/dbraw/zinc/57/39/84/386573984.db2.gz CKUGCHMTHJCION-PQAZSJQKSA-N 2 0 240.391 2.051 20 0 BEADRP CCC1CCC([NH2+][C@H](CN)C2CC2)CC1 ZINC000414809858 386621330 /nfs/dbraw/zinc/62/13/30/386621330.db2.gz URRQUVIITBEEMJ-KGPNIALWSA-N 2 0 210.365 2.282 20 0 BEADRP CCOc1ccccc1C[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000414924389 386623360 /nfs/dbraw/zinc/62/33/60/386623360.db2.gz KBYJASYTZZQJRS-UONOGXRCSA-N 2 0 248.370 2.445 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[NH2+]C1)C1CCC(F)(F)CC1 ZINC000335498954 386625963 /nfs/dbraw/zinc/62/59/63/386625963.db2.gz ZQVFLSCSDVMWDP-KOLCDFICSA-N 2 0 232.318 2.152 20 0 BEADRP CC(C)C[C@H]([NH3+])C[NH2+][C@@]1(C)CC=CCC1 ZINC000415105866 386626428 /nfs/dbraw/zinc/62/64/28/386626428.db2.gz GRIURAGCTPKKIZ-STQMWFEESA-N 2 0 210.365 2.448 20 0 BEADRP CC(C)C[C@@H]([NH3+])C[NH2+][C@]1(C)CC=CCC1 ZINC000415105863 386626708 /nfs/dbraw/zinc/62/67/08/386626708.db2.gz GRIURAGCTPKKIZ-CHWSQXEVSA-N 2 0 210.365 2.448 20 0 BEADRP CC(C)(C)[C@@H]1CCC[C@H]1[NH2+][C@@H]1CC[NH2+]C1 ZINC000415123490 386627659 /nfs/dbraw/zinc/62/76/59/386627659.db2.gz NAAQURRZVSJOMF-IJLUTSLNSA-N 2 0 210.365 2.153 20 0 BEADRP Cc1ccc(N[C@H]2CCC[NH2+]C2)c(C[NH+](C)C)c1 ZINC000415126707 386628776 /nfs/dbraw/zinc/62/87/76/386628776.db2.gz UYCFNTBAKBEOOE-AWEZNQCLSA-N 2 0 247.386 2.221 20 0 BEADRP C[C@@H]1CC(C)(C)C[C@@H]1[NH2+]CC1=CC[NH2+]CC1 ZINC000335502115 386629730 /nfs/dbraw/zinc/62/97/30/386629730.db2.gz VUSNKGMPXMVXQC-YPMHNXCESA-N 2 0 222.376 2.320 20 0 BEADRP C[C@@H]1Cc2ccccc2[C@@H]1[NH2+]CC1=CC[NH2+]CC1 ZINC000335501395 386629938 /nfs/dbraw/zinc/62/99/38/386629938.db2.gz SNUPNBQDHQVURT-MLGOLLRUSA-N 2 0 242.366 2.429 20 0 BEADRP Cc1ccc(C[NH2+][C@H](CN)C2CC2)c(C)c1 ZINC000414810349 386631222 /nfs/dbraw/zinc/63/12/22/386631222.db2.gz VGLNKJASFPCJQU-CQSZACIVSA-N 2 0 218.344 2.130 20 0 BEADRP C1=C(C[NH2+][C@H]2CCCC23CCC3)CC[NH2+]C1 ZINC000335506355 386636376 /nfs/dbraw/zinc/63/63/76/386636376.db2.gz YRRDWRWBNXEDDK-ZDUSSCGKSA-N 2 0 220.360 2.219 20 0 BEADRP C[NH2+]CCCN(C)C/C=C/c1ccccc1OC ZINC000415134518 386640251 /nfs/dbraw/zinc/64/02/51/386640251.db2.gz ORFPQSOOSPMJJD-RMKNXTFCSA-N 2 0 248.370 2.250 20 0 BEADRP CCOc1ccc(C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)cc1 ZINC000414925338 386641189 /nfs/dbraw/zinc/64/11/89/386641189.db2.gz LOUVAYPEQJWNGH-ZIAGYGMSSA-N 2 0 248.370 2.445 20 0 BEADRP Cc1ccc(C[N@@H+](C)C2CC[NH2+]CC2)cc1C ZINC000049669103 386645778 /nfs/dbraw/zinc/64/57/78/386645778.db2.gz JDMPKKBFNPBFIF-UHFFFAOYSA-N 2 0 232.371 2.487 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCCc2c(F)cccc21)C1C[NH2+]C1 ZINC000335511432 386646957 /nfs/dbraw/zinc/64/69/57/386646957.db2.gz HXYRJXSWRKPBAB-MEBBXXQBSA-N 2 0 248.345 2.401 20 0 BEADRP C[C@H]([NH3+])c1ccc(C[NH2+]CC[C@H]2CCOC2)cc1 ZINC000414815381 386648391 /nfs/dbraw/zinc/64/83/91/386648391.db2.gz PGJVJSNQMLQWHP-JSGCOSHPSA-N 2 0 248.370 2.223 20 0 BEADRP Cc1cccc(C)c1CC[NH2+]C1CC[NH2+]CC1 ZINC000415085980 386604069 /nfs/dbraw/zinc/60/40/69/386604069.db2.gz RDIAENCJQNRAPE-UHFFFAOYSA-N 2 0 232.371 2.188 20 0 BEADRP C(C[NH+]1CCC2(CC[NH2+]2)CC1)C1CCCC1 ZINC000335488207 386605021 /nfs/dbraw/zinc/60/50/21/386605021.db2.gz OZXLBWHWYFRAPW-UHFFFAOYSA-N 2 0 222.376 2.395 20 0 BEADRP CC[C@H]([NH2+][C@H](C)C[C@@H]1CCC[NH2+]1)[C@@H]1CCCO1 ZINC000415090106 386609972 /nfs/dbraw/zinc/60/99/72/386609972.db2.gz ZYCYCQWUYYYGEV-RFGFWPKPSA-N 2 0 240.391 2.064 20 0 BEADRP C[C@H]1C[C@H](C[NH2+]Cc2cccc(F)c2)CC[NH2+]1 ZINC000415091322 386610628 /nfs/dbraw/zinc/61/06/28/386610628.db2.gz YWXHFZTYHGLMFW-WCQYABFASA-N 2 0 236.334 2.303 20 0 BEADRP CCOC[C@H]([NH2+][C@@H](C)CCCC[NH3+])C(C)C ZINC000336645514 386612449 /nfs/dbraw/zinc/61/24/49/386612449.db2.gz DCEWDNJSXMNSRB-STQMWFEESA-N 2 0 230.396 2.155 20 0 BEADRP CCOC[C@H]([NH2+][C@H](C)CCCC[NH3+])C(C)C ZINC000336645512 386612830 /nfs/dbraw/zinc/61/28/30/386612830.db2.gz DCEWDNJSXMNSRB-OLZOCXBDSA-N 2 0 230.396 2.155 20 0 BEADRP CCOCCC1(C[NH2+]CC(C)(C)[NH3+])CCCC1 ZINC000415093574 386613235 /nfs/dbraw/zinc/61/32/35/386613235.db2.gz VTGYHDKBKUFDMU-UHFFFAOYSA-N 2 0 242.407 2.300 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@@H](C)c1ccc(F)cc1F ZINC000336645451 386613677 /nfs/dbraw/zinc/61/36/77/386613677.db2.gz ATNHTQDELNXYOK-IUCAKERBSA-N 2 0 228.286 2.210 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCCC[NH2+]C1)C1CCSCC1 ZINC000335493672 386614124 /nfs/dbraw/zinc/61/41/24/386614124.db2.gz CCVAPOQULHFZFQ-DGCLKSJQSA-N 2 0 242.432 2.250 20 0 BEADRP C1CC2(C1)CC[C@H]2[NH2+][C@H]1CCCC[NH2+]C1 ZINC000335495438 386616182 /nfs/dbraw/zinc/61/61/82/386616182.db2.gz IYSYJGYMVOFAGN-NWDGAFQWSA-N 2 0 208.349 2.051 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CC[NH2+][C@H](C)C1)c1ccccn1 ZINC000415107420 386616338 /nfs/dbraw/zinc/61/63/38/386616338.db2.gz NYVMSLGNBBZDAF-FRRDWIJNSA-N 2 0 233.359 2.120 20 0 BEADRP C[C@@H](C[NH2+]CC(C)(C)[NH3+])c1ccc(F)cc1F ZINC000415098548 386616654 /nfs/dbraw/zinc/61/66/54/386616654.db2.gz FOEWWTANPCMUDD-VIFPVBQESA-N 2 0 242.313 2.395 20 0 BEADRP C[NH+]1CCC([C@H]2CC[N@H+](CC3CC3)C2)CC1 ZINC000335521429 386662651 /nfs/dbraw/zinc/66/26/51/386662651.db2.gz UGCZIIXUOGYNPQ-AWEZNQCLSA-N 2 0 222.376 2.060 20 0 BEADRP CC1(C)CCC([NH2+]CC2=CC[NH2+]CC2)CC1 ZINC000335523235 386664105 /nfs/dbraw/zinc/66/41/05/386664105.db2.gz YGDBEPWIBCWMLH-UHFFFAOYSA-N 2 0 222.376 2.465 20 0 BEADRP Fc1ccc2c(c1)CC[C@H]2[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000335523196 386664315 /nfs/dbraw/zinc/66/43/15/386664315.db2.gz XMUSSNDKLVDOMY-IAQYHMDHSA-N 2 0 248.345 2.402 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@H]1CCCC[C@@H]1C1CC1 ZINC000414818854 386667941 /nfs/dbraw/zinc/66/79/41/386667941.db2.gz FYSMGUUPHMKGBN-UHTWSYAYSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H]1CCCC[C@H]1C1CC1 ZINC000414818855 386668081 /nfs/dbraw/zinc/66/80/81/386668081.db2.gz FYSMGUUPHMKGBN-WCFLWFBJSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@H]2CCCOCC2)cc1 ZINC000414818951 386668905 /nfs/dbraw/zinc/66/89/05/386668905.db2.gz XGLSEKQTKGNRDO-WFASDCNBSA-N 2 0 248.370 2.365 20 0 BEADRP CC1(C)CCC[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000414824462 386682509 /nfs/dbraw/zinc/68/25/09/386682509.db2.gz FXNJVWGQQHCJTC-ZGVCCVRISA-N 2 0 222.376 2.438 20 0 BEADRP C[C@H](CCc1ccsc1)[NH2+]C[C@@H]1CCC[NH2+]1 ZINC000414821458 386678566 /nfs/dbraw/zinc/67/85/66/386678566.db2.gz CFNSGBIRDCIXDV-YPMHNXCESA-N 2 0 238.400 2.411 20 0 BEADRP C[C@H](CCc1ccsc1)[NH2+]C[C@H]1CCC[NH2+]1 ZINC000414821454 386678605 /nfs/dbraw/zinc/67/86/05/386678605.db2.gz CFNSGBIRDCIXDV-DGCLKSJQSA-N 2 0 238.400 2.411 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H](C)CCc1ccccc1 ZINC000414823866 386680544 /nfs/dbraw/zinc/68/05/44/386680544.db2.gz POEXPFVPDZYDKO-STQMWFEESA-N 2 0 220.360 2.335 20 0 BEADRP C[C@@H](CCC1CC1)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000414823977 386680770 /nfs/dbraw/zinc/68/07/70/386680770.db2.gz FGUZYJOLQZJDLR-RAQOOLMWSA-N 2 0 222.376 2.438 20 0 BEADRP CCCC[C@H](COC)[NH2+][C@@H](C)[C@H]1CCC[NH2+]C1 ZINC000414823776 386681166 /nfs/dbraw/zinc/68/11/66/386681166.db2.gz PJOHSRSCFPTQPO-MELADBBJSA-N 2 0 242.407 2.169 20 0 BEADRP CCC1CCC([NH2+]C[C@@H](C)C[NH2+]C)CC1 ZINC000414833025 386709980 /nfs/dbraw/zinc/70/99/80/386709980.db2.gz FXGASDLPJVJWMB-HIFPTAJRSA-N 2 0 212.381 2.400 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]C/C=C/c1ccc(F)cc1 ZINC000414830682 386710365 /nfs/dbraw/zinc/71/03/65/386710365.db2.gz CGQLAUARAJEWEB-AAOUONPWSA-N 2 0 236.334 2.284 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H](C)CC1CCCC1 ZINC000414833084 386711255 /nfs/dbraw/zinc/71/12/55/386711255.db2.gz GCGBQZBLHZZGIT-NWDGAFQWSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H](C)CCc1ccc(F)cc1 ZINC000414823336 386684903 /nfs/dbraw/zinc/68/49/03/386684903.db2.gz OEBXHKWPAGSLDC-RYUDHWBXSA-N 2 0 238.350 2.474 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H]1CCC[C@@H](C2CC2)C1 ZINC000414825136 386689267 /nfs/dbraw/zinc/68/92/67/386689267.db2.gz SANZXOQVZJTACX-CYZMBNFOSA-N 2 0 210.365 2.282 20 0 BEADRP C(=C\c1ccccc1)\C[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000414825504 386691871 /nfs/dbraw/zinc/69/18/71/386691871.db2.gz CJPMFIXXHPKSQQ-IJVDHGTGSA-N 2 0 230.355 2.289 20 0 BEADRP CC[C@@H](C)[N@@H+]1CC[C@H](OCC[NH+](CC)CC)C1 ZINC000337260811 386695928 /nfs/dbraw/zinc/69/59/28/386695928.db2.gz XKODXWDSCRPPTK-KGLIPLIRSA-N 2 0 242.407 2.218 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]C[C@H](C)c1nccs1 ZINC000336648754 386698735 /nfs/dbraw/zinc/69/87/35/386698735.db2.gz GPXYATAARUKJPL-QWRGUYRKSA-N 2 0 241.404 2.354 20 0 BEADRP Clc1csc(C[NH2+]CC[C@H]2CC[NH2+]C2)c1 ZINC000414829990 386705569 /nfs/dbraw/zinc/70/55/69/386705569.db2.gz LKXFENHUGYMUPF-SECBINFHSA-N 2 0 244.791 2.491 20 0 BEADRP CCNCC[NH2+][C@@H]1C[C@@H](C)CC(C)(C)C1 ZINC000414830247 386706130 /nfs/dbraw/zinc/70/61/30/386706130.db2.gz NRTAWVNNNDKWJP-VXGBXAGGSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H](C[NH2+]CC[C@@H]1CC[NH2+]C1)c1ccccc1 ZINC000414830394 386707096 /nfs/dbraw/zinc/70/70/96/386707096.db2.gz LYZMTDYEPLMDKF-UONOGXRCSA-N 2 0 232.371 2.379 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]C/C=C\c1ccc(F)cc1 ZINC000414830685 386708805 /nfs/dbraw/zinc/70/88/05/386708805.db2.gz CGQLAUARAJEWEB-MVZIDQBPSA-N 2 0 236.334 2.284 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H](C)C1CCCCC1 ZINC000414840551 386739169 /nfs/dbraw/zinc/73/91/69/386739169.db2.gz MLJPTCMGYKXLKN-VXGBXAGGSA-N 2 0 212.381 2.400 20 0 BEADRP CC[C@H](C[N@@H+]1C[C@@H](C)[C@@H]([NH3+])C1)c1ccccc1 ZINC000340692949 386713532 /nfs/dbraw/zinc/71/35/32/386713532.db2.gz WNSMXQITFCZKTH-NFAWXSAZSA-N 2 0 232.371 2.459 20 0 BEADRP Fc1ccccc1CC[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000414834029 386719749 /nfs/dbraw/zinc/71/97/49/386719749.db2.gz SIWSBKDZGXIRJB-PBWFPOADSA-N 2 0 248.345 2.241 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H](C)CCc1ccccc1 ZINC000414834267 386724752 /nfs/dbraw/zinc/72/47/52/386724752.db2.gz HFQVSLXUGMIPFA-KGLIPLIRSA-N 2 0 234.387 2.453 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]Cc1cccc(C)c1C ZINC000414835917 386729714 /nfs/dbraw/zinc/72/97/14/386729714.db2.gz ISQFVGZAQJJTIA-LLVKDONJSA-N 2 0 220.360 2.249 20 0 BEADRP Cc1cccc(C)c1C[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000414839990 386745091 /nfs/dbraw/zinc/74/50/91/386745091.db2.gz WXJMMSANERRHEZ-AWEZNQCLSA-N 2 0 232.371 2.393 20 0 BEADRP CC(C)C[C@H](C)C[NH2+]C1(C)CC[NH2+]CC1 ZINC000414930016 386746499 /nfs/dbraw/zinc/74/64/99/386746499.db2.gz AJVUBRICUWSKKP-LBPRGKRZSA-N 2 0 212.381 2.400 20 0 BEADRP COC[C@H](CC(C)C)[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000414841447 386753748 /nfs/dbraw/zinc/75/37/48/386753748.db2.gz OIHZDIYRIJTBBL-KGLIPLIRSA-N 2 0 242.407 2.027 20 0 BEADRP CC(C)[C@@H]1CCC[C@H]1[NH2+]C[C@H]1CCC[NH2+]1 ZINC000414841292 386754890 /nfs/dbraw/zinc/75/48/90/386754890.db2.gz HOBFVCBRHQVGPR-FRRDWIJNSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000414841255 386755577 /nfs/dbraw/zinc/75/55/77/386755577.db2.gz ZBUQDSDYOROJFI-PNKOWGENSA-N 2 0 208.349 2.048 20 0 BEADRP C[C@H](CC1CC1)[NH2+]CC1([NH3+])CCCCC1 ZINC000414842921 386758205 /nfs/dbraw/zinc/75/82/05/386758205.db2.gz NLKHJYMVVXMGSG-LLVKDONJSA-N 2 0 210.365 2.426 20 0 BEADRP c1ccc2c(c1)CC([NH2+]CC[C@H]1CCC[NH2+]C1)C2 ZINC000414842598 386762042 /nfs/dbraw/zinc/76/20/42/386762042.db2.gz PFDOBEBWBSYSGJ-CYBMUJFWSA-N 2 0 244.382 2.133 20 0 BEADRP CSC1(C[NH2+]C[C@@H]2C[C@@H]2C)CC[NH+](C)CC1 ZINC000336668789 386791279 /nfs/dbraw/zinc/79/12/79/386791279.db2.gz GJLKTDGZOJPCOQ-RYUDHWBXSA-N 2 0 242.432 2.059 20 0 BEADRP [NH3+]C[C@@H]1CCCN1Cc1ccc2ccccc2n1 ZINC000020247163 386791999 /nfs/dbraw/zinc/79/19/99/386791999.db2.gz ROKFNJVWCBKKEO-AWEZNQCLSA-N 2 0 241.338 2.158 20 0 BEADRP CO[C@H](C)CC[NH2+][C@@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000336665771 386770344 /nfs/dbraw/zinc/77/03/44/386770344.db2.gz ZDDODYITPHTZJY-BFHYXJOUSA-N 2 0 242.407 2.312 20 0 BEADRP CO[C@H](C)CC[NH2+][C@@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000336665801 386770408 /nfs/dbraw/zinc/77/04/08/386770408.db2.gz ZDDODYITPHTZJY-MJBXVCDLSA-N 2 0 242.407 2.312 20 0 BEADRP Cc1ccncc1C[N@@H+]1C[C@H](C[NH3+])[C@H](C)C[C@H]1C ZINC000397259232 386774321 /nfs/dbraw/zinc/77/43/21/386774321.db2.gz GQAFCUSFRGGFQM-MCIONIFRSA-N 2 0 247.386 2.195 20 0 BEADRP COc1cc(C[NH2+][C@H]2CC[NH2+]C[C@@H]2C)ccc1C ZINC000414933237 386788731 /nfs/dbraw/zinc/78/87/31/386788731.db2.gz DJXUDISQLUHSTQ-JSGCOSHPSA-N 2 0 248.370 2.091 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+]CCSCc1ccccc1 ZINC000336670472 386803733 /nfs/dbraw/zinc/80/37/33/386803733.db2.gz RVKYEXMMSGTGBI-CYBMUJFWSA-N 2 0 238.400 2.247 20 0 BEADRP CC[N@H+](C[C@@H]1CCC[NH2+]C1)C1CC(C)(C)C1 ZINC000395300359 386809459 /nfs/dbraw/zinc/80/94/59/386809459.db2.gz QNRUKUPNSIHYPF-GFCCVEGCSA-N 2 0 224.392 2.497 20 0 BEADRP CCOc1ccc(C[NH2+]C[C@@H](C)C[NH2+]C)cc1 ZINC000414846198 386810516 /nfs/dbraw/zinc/81/05/16/386810516.db2.gz UHOUUEOODUYKNR-LBPRGKRZSA-N 2 0 236.359 2.030 20 0 BEADRP CCOc1ccc(C[NH2+]C[C@H](C)C[NH2+]C)cc1 ZINC000414846197 386811214 /nfs/dbraw/zinc/81/12/14/386811214.db2.gz UHOUUEOODUYKNR-GFCCVEGCSA-N 2 0 236.359 2.030 20 0 BEADRP CC[C@@H](Cc1ccccc1)[NH2+]C[C@@H](C)C[NH2+]C ZINC000414847153 386831525 /nfs/dbraw/zinc/83/15/25/386831525.db2.gz VIMOMEFUEMFBAE-ZFWWWQNUSA-N 2 0 234.387 2.453 20 0 BEADRP C[C@@H](C[NH2+][C@@H](C)CCc1ccco1)C[NH+](C)C ZINC000293364115 386835319 /nfs/dbraw/zinc/83/53/19/386835319.db2.gz HOELPCQAKDREFK-STQMWFEESA-N 2 0 238.375 2.388 20 0 BEADRP CC[C@H](C[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21)OC ZINC000336674084 386841361 /nfs/dbraw/zinc/84/13/61/386841361.db2.gz BVPHRXYUJSGEOA-DDTOSNHZSA-N 2 0 234.343 2.146 20 0 BEADRP C[C@H]1Cc2ccccc2C[N@@H+]1CC[C@H]1CC[NH2+]C1 ZINC000334784451 386842783 /nfs/dbraw/zinc/84/27/83/386842783.db2.gz MDDJVTCGPAZOEP-UONOGXRCSA-N 2 0 244.382 2.433 20 0 BEADRP CCN1CCCC[C@@H]1C[NH2+][C@@H]1CC[C@@H]1SC ZINC000425343416 386856572 /nfs/dbraw/zinc/85/65/72/386856572.db2.gz IFXNJAQUKNRXJE-UPJWGTAASA-N 2 0 242.432 2.344 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@@H]1CC[C@@H](C)C[C@H]1C ZINC000414937893 386857356 /nfs/dbraw/zinc/85/73/56/386857356.db2.gz CTFAYSLCCXFWMZ-FDYHWXHSSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCC2(C)C)CC[NH2+]1 ZINC000414939933 386875344 /nfs/dbraw/zinc/87/53/44/386875344.db2.gz BKUGRDWJBHIVLM-IJLUTSLNSA-N 2 0 210.365 2.295 20 0 BEADRP CC1CC([NH2+]CC2([NH3+])CCCCCC2)C1 ZINC000334836340 386878896 /nfs/dbraw/zinc/87/88/96/386878896.db2.gz FYQZCZCNCWWOBX-UHFFFAOYSA-N 2 0 210.365 2.426 20 0 BEADRP Cc1ccccc1C[NH2+]C1(C)CC[NH2+]CC1 ZINC000334840976 386886432 /nfs/dbraw/zinc/88/64/32/386886432.db2.gz FFWRZPVJDFHDCU-UHFFFAOYSA-N 2 0 218.344 2.227 20 0 BEADRP Cc1cc(NCC2([NH+](C)C)CCCCC2)cc[nH+]1 ZINC000358130073 386896707 /nfs/dbraw/zinc/89/67/07/386896707.db2.gz SJODQNOMIZQEBQ-UHFFFAOYSA-N 2 0 247.386 2.488 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC[NH2+]C[C@H]1C)Cc1ccccc1 ZINC000414943917 386900781 /nfs/dbraw/zinc/90/07/81/386900781.db2.gz OOBAHWILXJOVSE-LZWOXQAQSA-N 2 0 246.398 2.453 20 0 BEADRP Cc1cccc(C[NH2+][C@H]2CC[NH2+]C[C@@H]2C)c1C ZINC000334857195 386909262 /nfs/dbraw/zinc/90/92/62/386909262.db2.gz LSGQOHCCGOXRKC-WFASDCNBSA-N 2 0 232.371 2.391 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CC[NH2+]C[C@@H]2C)cc1C ZINC000334857330 386909643 /nfs/dbraw/zinc/90/96/43/386909643.db2.gz NEPOYLPQYAEHLU-DZGCQCFKSA-N 2 0 232.371 2.391 20 0 BEADRP Cc1cc(C[NH2+][C@H]2CC[NH2+]C[C@@H]2C)c(C)s1 ZINC000334856181 386909718 /nfs/dbraw/zinc/90/97/18/386909718.db2.gz GVHYMJHAPQSVPL-ZANVPECISA-N 2 0 238.400 2.453 20 0 BEADRP Cc1cccc(C)c1C[NH2+][C@@H]1CC[NH2+]C[C@H]1C ZINC000334857824 386911540 /nfs/dbraw/zinc/91/15/40/386911540.db2.gz OTFKQCBYWONIJO-UKRRQHHQSA-N 2 0 232.371 2.391 20 0 BEADRP Cc1ccccc1C[NH2+][C@H]1CC[NH2+][C@@H](C)C1 ZINC000334866453 386923891 /nfs/dbraw/zinc/92/38/91/386923891.db2.gz WNJMFFPKSNPTAV-JSGCOSHPSA-N 2 0 218.344 2.225 20 0 BEADRP c1cc(C[N@@H+]2CCCC[C@@H]2[C@H]2CC[NH2+]C2)ccn1 ZINC000334868524 386926253 /nfs/dbraw/zinc/92/62/53/386926253.db2.gz LKQYYGFUGQJFSM-LSDHHAIUSA-N 2 0 245.370 2.046 20 0 BEADRP c1cc(C[N@@H+]2CCCC[C@H]2[C@H]2CC[NH2+]C2)ccn1 ZINC000334868522 386926398 /nfs/dbraw/zinc/92/63/98/386926398.db2.gz LKQYYGFUGQJFSM-GJZGRUSLSA-N 2 0 245.370 2.046 20 0 BEADRP c1ccc(C[N@@H+]2CCCC[C@@H]2[C@H]2CC[NH2+]C2)nc1 ZINC000334869661 386927850 /nfs/dbraw/zinc/92/78/50/386927850.db2.gz RMLOORFZAOORPT-DZGCQCFKSA-N 2 0 245.370 2.046 20 0 BEADRP c1ccc(C[N@@H+]2CCCC[C@H]2[C@@H]2CC[NH2+]C2)nc1 ZINC000334869662 386928343 /nfs/dbraw/zinc/92/83/43/386928343.db2.gz RMLOORFZAOORPT-HIFRSBDPSA-N 2 0 245.370 2.046 20 0 BEADRP [NH3+]C1(C[NH2+]C2CCSCC2)CCCCC1 ZINC000334819035 386947658 /nfs/dbraw/zinc/94/76/58/386947658.db2.gz QHZLUUTXLFBUMO-UHFFFAOYSA-N 2 0 228.405 2.133 20 0 BEADRP CC[N@H+](C)C[C@@H]1CC[NH+](CCCCCF)C1 ZINC000341885625 386983699 /nfs/dbraw/zinc/98/36/99/386983699.db2.gz FRAWBDLIOAAYIG-ZDUSSCGKSA-N 2 0 230.371 2.400 20 0 BEADRP Cc1c[nH+]ccc1NCC(C)(C)C[NH+]1CCCC1 ZINC000358901629 387030227 /nfs/dbraw/zinc/03/02/27/387030227.db2.gz JXQMUCKMNURTNX-UHFFFAOYSA-N 2 0 247.386 2.346 20 0 BEADRP Cc1cc[nH+]c(NCC2(C)CC[NH2+]CC2)c1 ZINC000160009953 387040375 /nfs/dbraw/zinc/04/03/75/387040375.db2.gz JEHHGISNOSXTFO-UHFFFAOYSA-N 2 0 219.332 2.192 20 0 BEADRP Cc1c[nH+]ccc1N[C@H](C)[C@H]1CCC[NH2+]C1 ZINC000070047577 387043939 /nfs/dbraw/zinc/04/39/39/387043939.db2.gz GCJQXGUWTITQJW-NEPJUHHUSA-N 2 0 219.332 2.190 20 0 BEADRP Cc1c[nH+]ccc1NCC[C@H]1CCC[NH2+]C1 ZINC000070047650 387044331 /nfs/dbraw/zinc/04/43/31/387044331.db2.gz UVJBITDMWNLPIM-GFCCVEGCSA-N 2 0 219.332 2.192 20 0 BEADRP C[C@H]([NH3+])CN1CCC(c2ccsc2)CC1 ZINC000334966809 387049432 /nfs/dbraw/zinc/04/94/32/387049432.db2.gz GTXXASMFPTWELU-JTQLQIEISA-N 2 0 224.373 2.275 20 0 BEADRP CC[C@H]1CCC[N@H+](CC2CC[NH2+]CC2)CC1 ZINC000070613550 387069851 /nfs/dbraw/zinc/06/98/51/387069851.db2.gz JYSATIXALATYNK-ZDUSSCGKSA-N 2 0 224.392 2.498 20 0 BEADRP CCO[C@@H]1C[C@@H]([NH2+]C[C@H](C)C[NH3+])C1(CC)CC ZINC000423298651 387130264 /nfs/dbraw/zinc/13/02/64/387130264.db2.gz AMXSXQYWMBMDQH-JHJVBQTASA-N 2 0 242.407 2.155 20 0 BEADRP CC(C)[C@@H]([NH2+]C[C@@H](C)C[NH3+])c1ccc(F)cn1 ZINC000423298506 387130321 /nfs/dbraw/zinc/13/03/21/387130321.db2.gz AIDAJWIXMHIIOQ-GXFFZTMASA-N 2 0 239.338 2.102 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@@H]1CCc2c1c(F)ccc2F ZINC000423298557 387130436 /nfs/dbraw/zinc/13/04/36/387130436.db2.gz ONTJCPJZKKFEJJ-QPUJVOFHSA-N 2 0 240.297 2.137 20 0 BEADRP C[C@@H]([NH3+])C1CC[NH+](Cc2ccccc2F)CC1 ZINC000111611455 387084615 /nfs/dbraw/zinc/08/46/15/387084615.db2.gz UHIYNIMWYVVVTB-LLVKDONJSA-N 2 0 236.334 2.385 20 0 BEADRP C[C@@H]([NH3+])C1CC[NH+](CCOc2ccccc2)CC1 ZINC000111611974 387084777 /nfs/dbraw/zinc/08/47/77/387084777.db2.gz ZJORRFZHERDOSG-CYBMUJFWSA-N 2 0 248.370 2.125 20 0 BEADRP [NH3+]CC[C@@H]1CCC[N@H+](Cc2ccc(F)cc2)C1 ZINC000070975627 387085186 /nfs/dbraw/zinc/08/51/86/387085186.db2.gz UXDGEDUUESMTNK-LBPRGKRZSA-N 2 0 236.334 2.387 20 0 BEADRP CC(C)C1CC([NH2+][C@@H]2CC[NH2+]C[C@@H]2C)C1 ZINC000335004463 387098725 /nfs/dbraw/zinc/09/87/25/387098725.db2.gz DCMGDUZAEWCTFX-YWPUVAFDSA-N 2 0 210.365 2.009 20 0 BEADRP C1=C(C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)CCCC1 ZINC000335005784 387099107 /nfs/dbraw/zinc/09/91/07/387099107.db2.gz IQACLVPHNPEPCA-PBWFPOADSA-N 2 0 220.360 2.359 20 0 BEADRP CC(C)C1CC([NH2+][C@@H]2CC[NH2+]C[C@H]2C)C1 ZINC000335004460 387099888 /nfs/dbraw/zinc/09/98/88/387099888.db2.gz DCMGDUZAEWCTFX-IKWCTNDRSA-N 2 0 210.365 2.009 20 0 BEADRP CSC[C@H](C)[NH2+][C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000127342270 387100090 /nfs/dbraw/zinc/10/00/90/387100090.db2.gz DJYDSQREWZXZJW-XDTLVQLUSA-N 2 0 236.384 2.472 20 0 BEADRP C[C@H](Cc1ccccc1)C[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC000359460142 387105786 /nfs/dbraw/zinc/10/57/86/387105786.db2.gz VXUNRDFYNRUECY-BMFZPTHFSA-N 2 0 244.382 2.016 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+]C1CCC2(CC2)CC1 ZINC000335011975 387106522 /nfs/dbraw/zinc/10/65/22/387106522.db2.gz WPKUSXZDRQDFQS-NWDGAFQWSA-N 2 0 208.349 2.179 20 0 BEADRP Cc1c[nH+]ccc1NCC[NH+]1[C@@H](C)CCC[C@@H]1C ZINC000359478826 387108174 /nfs/dbraw/zinc/10/81/74/387108174.db2.gz GHVYGMONLJANBK-KBPBESRZSA-N 2 0 247.386 2.487 20 0 BEADRP CCC[C@@H]([NH2+]CC1C[NH2+]C1)c1ccc(OC)cc1 ZINC000423300047 387131830 /nfs/dbraw/zinc/13/18/30/387131830.db2.gz CYDNHBYIWXGNTR-OAHLLOKOSA-N 2 0 248.370 2.345 20 0 BEADRP CC(C)CCOCC[N@@H+]1CCC[C@@H](CC[NH3+])C1 ZINC000070074170 387118594 /nfs/dbraw/zinc/11/85/94/387118594.db2.gz DYFOLNYXZWMXKA-AWEZNQCLSA-N 2 0 242.407 2.110 20 0 BEADRP c1ccc2c(c1)CCC[C@H]2C[NH2+]C1CC[NH2+]CC1 ZINC000335026350 387119488 /nfs/dbraw/zinc/11/94/88/387119488.db2.gz ZGYUEFIOKSJOFP-AWEZNQCLSA-N 2 0 244.382 2.448 20 0 BEADRP Cc1cc(C)c(C[NH2+][C@H]2CC[NH2+]CC[C@@H]2C)cn1 ZINC000335028858 387122215 /nfs/dbraw/zinc/12/22/15/387122215.db2.gz ZHURDHLQIYOFBN-NHYWBVRUSA-N 2 0 247.386 2.176 20 0 BEADRP Cc1cc(C)c(C[NH2+][C@@H]2CC[NH2+]CC[C@@H]2C)cn1 ZINC000335028859 387122622 /nfs/dbraw/zinc/12/26/22/387122622.db2.gz ZHURDHLQIYOFBN-XHDPSFHLSA-N 2 0 247.386 2.176 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCCC(C)(C)C1)C1C[NH2+]C1 ZINC000335030501 387124108 /nfs/dbraw/zinc/12/41/08/387124108.db2.gz QCSYZEHNMGILLR-PWSUYJOCSA-N 2 0 210.365 2.153 20 0 BEADRP CCOc1ccccc1C[N@@H+]1C[C@@H](C[NH3+])C[C@H]1C ZINC000250508301 387124850 /nfs/dbraw/zinc/12/48/50/387124850.db2.gz GWXAQLAIUSSMOU-CHWSQXEVSA-N 2 0 248.370 2.254 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H](C)[C@H]2C[C@@H]2C)CC1 ZINC000321351242 387126223 /nfs/dbraw/zinc/12/62/23/387126223.db2.gz CRYYMFZBLZMCFG-SCRDCRAPSA-N 2 0 224.392 2.495 20 0 BEADRP Cc1ccc([C@@H]2CCC[C@H]2[NH2+]CC2C[NH2+]C2)cc1 ZINC000423298761 387129140 /nfs/dbraw/zinc/12/91/40/387129140.db2.gz AFYDAFMHLXTROT-JKSUJKDBSA-N 2 0 244.382 2.440 20 0 BEADRP C[NH+](C)CC1CC[NH+]([C@@H]2C=CCCC2)CC1 ZINC000336228684 387068057 /nfs/dbraw/zinc/06/80/57/387068057.db2.gz DIBWUYMVNDNDRX-CQSZACIVSA-N 2 0 222.376 2.369 20 0 BEADRP Cc1csc(C[NH2+]C[C@@H]2CCC[C@H]([NH3+])C2)n1 ZINC000070503302 387068259 /nfs/dbraw/zinc/06/82/59/387068259.db2.gz BNLPELABTYDWGD-MNOVXSKESA-N 2 0 239.388 2.059 20 0 BEADRP CC(C)CC[C@@H]1CCC[C@@H]1[NH2+]CC1C[NH2+]C1 ZINC000423305814 387141733 /nfs/dbraw/zinc/14/17/33/387141733.db2.gz RSEMBBVLXUFDED-KBPBESRZSA-N 2 0 224.392 2.400 20 0 BEADRP Cc1ccc(C[C@H]([NH2+]CC2C[NH2+]C2)C(C)C)cc1 ZINC000423305514 387141806 /nfs/dbraw/zinc/14/18/06/387141806.db2.gz QXRWZRYFRWIOTB-INIZCTEOSA-N 2 0 246.398 2.371 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H](C)C1CCC(F)(F)CC1 ZINC000423306523 387142335 /nfs/dbraw/zinc/14/23/35/387142335.db2.gz LPOXTYKBUAQDIM-NXEZZACHSA-N 2 0 234.334 2.385 20 0 BEADRP Cc1cc([C@H]([NH2+]CC2C[NH2+]C2)C2CC2)ccc1F ZINC000423308363 387144381 /nfs/dbraw/zinc/14/43/81/387144381.db2.gz XPFIZHAMDVETKW-OAHLLOKOSA-N 2 0 248.345 2.394 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H]1CCCc2cc(F)ccc21 ZINC000423308125 387144472 /nfs/dbraw/zinc/14/44/72/387144472.db2.gz NXLPTCXTWSSUDX-YGRLFVJLSA-N 2 0 236.334 2.388 20 0 BEADRP Cc1ccc([C@H](C)[NH2+]CC2C[NH2+]C2)c(C)c1 ZINC000423309074 387145507 /nfs/dbraw/zinc/14/55/07/387145507.db2.gz YSTWDJGAWBSZST-LBPRGKRZSA-N 2 0 218.344 2.173 20 0 BEADRP CC[C@@H]1CCCC[C@@H]1[NH2+]C[C@@H]([NH3+])C1CC1 ZINC000423310663 387146317 /nfs/dbraw/zinc/14/63/17/387146317.db2.gz APDJGHVLDVYFFX-RTXFEEFZSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@@H](C)c1cccc(F)c1F ZINC000423310018 387146570 /nfs/dbraw/zinc/14/65/70/387146570.db2.gz RCTMCBVMZVSSGD-IUCAKERBSA-N 2 0 228.286 2.210 20 0 BEADRP CC[C@@H]1CCCC[C@@H]1[NH2+]C[C@H]([NH3+])C1CC1 ZINC000423310664 387149760 /nfs/dbraw/zinc/14/97/60/387149760.db2.gz APDJGHVLDVYFFX-WXHSDQCUSA-N 2 0 210.365 2.282 20 0 BEADRP CC[C@H]([NH2+]CC1C[NH2+]C1)c1cccc(C)c1 ZINC000423312880 387151444 /nfs/dbraw/zinc/15/14/44/387151444.db2.gz DYHHILBGKPBCEF-AWEZNQCLSA-N 2 0 218.344 2.255 20 0 BEADRP [NH3+][C@H](C[NH2+][C@@H]1CCCC12CCC2)C1CC1 ZINC000423313894 387151728 /nfs/dbraw/zinc/15/17/28/387151728.db2.gz GGVGFOWCXAXBKZ-VXGBXAGGSA-N 2 0 208.349 2.036 20 0 BEADRP Cc1c([C@@H](C)[NH2+]C[C@H](C)C[NH3+])cnn1C(C)C ZINC000423313240 387152407 /nfs/dbraw/zinc/15/24/07/387152407.db2.gz WQRCTPDLTBOXAH-GHMZBOCLSA-N 2 0 238.379 2.018 20 0 BEADRP CC(C)CC[C@@H]([NH2+]CC1C[NH2+]C1)C1CC1 ZINC000423314834 387153900 /nfs/dbraw/zinc/15/39/00/387153900.db2.gz HWEUQVGLOSRSAE-CYBMUJFWSA-N 2 0 210.365 2.010 20 0 BEADRP [NH3+][C@@H](C[NH2+][C@@H]1CCC12CCCC2)C1CC1 ZINC000423318367 387159614 /nfs/dbraw/zinc/15/96/14/387159614.db2.gz KXEDPNPXRLUECB-NWDGAFQWSA-N 2 0 208.349 2.036 20 0 BEADRP C[C@H]([NH2+]CC1(C)CC[NH2+]CC1)c1ccco1 ZINC000423318600 387159807 /nfs/dbraw/zinc/15/98/07/387159807.db2.gz CPIZXQFJAUMTGF-NSHDSACASA-N 2 0 222.332 2.320 20 0 BEADRP CCC1(CC)[C@@H]([NH2+]CC2([NH3+])CCC2)C[C@@H]1OC ZINC000423319995 387160876 /nfs/dbraw/zinc/16/08/76/387160876.db2.gz FYGGTZKPXHESDL-RYUDHWBXSA-N 2 0 240.391 2.051 20 0 BEADRP [NH3+][C@H](C[NH2+][C@@H](C1CC1)C1CCCC1)C1CC1 ZINC000423320663 387160978 /nfs/dbraw/zinc/16/09/78/387160978.db2.gz MJOROROILCQEGO-ZIAGYGMSSA-N 2 0 222.376 2.282 20 0 BEADRP [NH3+]CCCC[NH2+][C@@H]1CCCc2c(O)cccc21 ZINC000423328089 387170553 /nfs/dbraw/zinc/17/05/53/387170553.db2.gz NTGLASDEALMKCZ-CYBMUJFWSA-N 2 0 234.343 2.098 20 0 BEADRP C[C@@H]([NH2+]CC1(C)CC[NH2+]CC1)c1ccncc1 ZINC000423328303 387171110 /nfs/dbraw/zinc/17/11/10/387171110.db2.gz LZMMOCRPXQXZIN-GFCCVEGCSA-N 2 0 233.359 2.122 20 0 BEADRP C[C@H]([NH2+]CC1=CC[NH2+]CC1)c1cccs1 ZINC000423342356 387193484 /nfs/dbraw/zinc/19/34/84/387193484.db2.gz KVKZIJWLQMCVLP-JTQLQIEISA-N 2 0 222.357 2.318 20 0 BEADRP CCO[C@@H]1C[C@H]([NH2+]CCCC[NH3+])C1(CC)CC ZINC000423330646 387175923 /nfs/dbraw/zinc/17/59/23/387175923.db2.gz PMQVMENYYLJADC-QWHCGFSZSA-N 2 0 242.407 2.299 20 0 BEADRP Cc1ccccc1C[C@@H]([NH2+]CC1C[NH2+]C1)C1CC1 ZINC000423333162 387179331 /nfs/dbraw/zinc/17/93/31/387179331.db2.gz VMJXLXUWKXLABJ-MRXNPFEDSA-N 2 0 244.382 2.125 20 0 BEADRP C[C@@H]1Cc2ccc(F)cc2[C@H]1[NH2+]C[C@H]1CC[NH2+]C1 ZINC000423333663 387179926 /nfs/dbraw/zinc/17/99/26/387179926.db2.gz HZBQNJQDEXIIJH-ZETOZRRWSA-N 2 0 248.345 2.258 20 0 BEADRP C[C@H]([NH2+]CC1C[NH2+]C1)[C@@H]1CCCC[C@H]1C ZINC000423334545 387181513 /nfs/dbraw/zinc/18/15/13/387181513.db2.gz WREWZSXIFUHTGE-NTZNESFSSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]([NH2+]CC1(C)CC[NH2+]CC1)C1(C)CC1 ZINC000423337057 387182740 /nfs/dbraw/zinc/18/27/40/387182740.db2.gz SWTPUDSBYUVELH-LLVKDONJSA-N 2 0 210.365 2.154 20 0 BEADRP CC[C@H]1CCCC[C@H]1[NH2+]CC1=CC[NH2+]CC1 ZINC000423344382 387193831 /nfs/dbraw/zinc/19/38/31/387193831.db2.gz MSKSSUVTSBHVJH-UONOGXRCSA-N 2 0 222.376 2.465 20 0 BEADRP C[C@@H](CCC(F)(F)F)[NH2+]CC1=CC[NH2+]CC1 ZINC000423335399 387184341 /nfs/dbraw/zinc/18/43/41/387184341.db2.gz GFICWUMNQJGTKP-VIFPVBQESA-N 2 0 236.281 2.227 20 0 BEADRP Cc1ccccc1C[C@@H](C)[NH2+]CC1=CC[NH2+]CC1 ZINC000423337998 387185246 /nfs/dbraw/zinc/18/52/46/387185246.db2.gz HYBIUCUZTZTQQM-CQSZACIVSA-N 2 0 244.382 2.435 20 0 BEADRP CC(C)=CCC[C@H](C)[NH2+]C[C@@H]([NH3+])C1CC1 ZINC000423339967 387188775 /nfs/dbraw/zinc/18/87/75/387188775.db2.gz ZZZLGQDADCQVHG-WCQYABFASA-N 2 0 210.365 2.448 20 0 BEADRP [NH3+]CCCC[NH2+][C@@H]1CCc2c1c(F)ccc2F ZINC000423340524 387190628 /nfs/dbraw/zinc/19/06/28/387190628.db2.gz XIHFLNPLJVRZQH-GFCCVEGCSA-N 2 0 240.297 2.281 20 0 BEADRP C[C@@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)c1cccc(O)c1 ZINC000423341735 387190836 /nfs/dbraw/zinc/19/08/36/387190836.db2.gz MUDWVIXFJRGLLY-DOMZBBRYSA-N 2 0 248.370 2.433 20 0 BEADRP Fc1ccc([C@H]2CCC[C@@H]2[NH2+]CC2C[NH2+]C2)cc1 ZINC000423300741 387133141 /nfs/dbraw/zinc/13/31/41/387133141.db2.gz FGMLCSBYASDAIJ-CABCVRRESA-N 2 0 248.345 2.271 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H](C)c1nccc2ccccc21 ZINC000423302660 387134816 /nfs/dbraw/zinc/13/48/16/387134816.db2.gz HSLFYHRVYKLBCT-NEPJUHHUSA-N 2 0 243.354 2.480 20 0 BEADRP Cc1ccc(CN(C)CC[C@@H]([NH3+])C(C)C)cn1 ZINC000228859945 387135019 /nfs/dbraw/zinc/13/50/19/387135019.db2.gz NQKDPGXJEONEIG-CQSZACIVSA-N 2 0 235.375 2.195 20 0 BEADRP c1ccc([C@@H]2CCC[C@@H]2[NH2+]CC2C[NH2+]C2)cc1 ZINC000423303571 387137134 /nfs/dbraw/zinc/13/71/34/387137134.db2.gz LZDJQUZWAVVYSH-GJZGRUSLSA-N 2 0 230.355 2.132 20 0 BEADRP CCCC[C@H](C[NH3+])N[C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000423303407 387137142 /nfs/dbraw/zinc/13/71/42/387137142.db2.gz XBKDXESYTBRTLL-BYCMXARLSA-N 2 0 247.386 2.238 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+]C[C@@H](C)C[NH3+])[C@H](C)C2 ZINC000423302989 387138100 /nfs/dbraw/zinc/13/81/00/387138100.db2.gz IGLUTSJYWZEFKX-YWPYICTPSA-N 2 0 232.371 2.413 20 0 BEADRP Cc1cc([C@H](C)[NH2+]CC2C[NH2+]C2)cc(C)c1F ZINC000423304841 387138861 /nfs/dbraw/zinc/13/88/61/387138861.db2.gz PDDKYAAMWWFCOF-NSHDSACASA-N 2 0 236.334 2.313 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H](C)C1C(C)(C)C1(C)C ZINC000423304791 387139406 /nfs/dbraw/zinc/13/94/06/387139406.db2.gz ZLWXVNYICVFHOO-ZJUUUORDSA-N 2 0 212.381 2.242 20 0 BEADRP CC(C)CC[C@H]([NH2+]C[C@H](C)C[NH3+])C1CC1 ZINC000423306064 387141318 /nfs/dbraw/zinc/14/13/18/387141318.db2.gz LDAFPLXTWKVSNE-YPMHNXCESA-N 2 0 212.381 2.386 20 0 BEADRP CC(C)(C)[C@@H]1CC[C@H]1[NH2+]CC1=CC[NH2+]CC1 ZINC000423351468 387202912 /nfs/dbraw/zinc/20/29/12/387202912.db2.gz IDFNMEYROICPPP-CHWSQXEVSA-N 2 0 222.376 2.320 20 0 BEADRP CC[C@H]([NH2+]CC[C@H]1CCC[NH2+]1)[C@H]1C[C@@H]1C ZINC000423354780 387204824 /nfs/dbraw/zinc/20/48/24/387204824.db2.gz GWYDWZXVTCLDJG-RNJOBUHISA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@@H]1CCCc2cc(N)ccc21 ZINC000423354979 387205483 /nfs/dbraw/zinc/20/54/83/387205483.db2.gz DLIFMHKVIOBPOC-FIXISWKDSA-N 2 0 247.386 2.362 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H]1CCCc2cc(N)ccc21 ZINC000423354982 387205972 /nfs/dbraw/zinc/20/59/72/387205972.db2.gz DLIFMHKVIOBPOC-ZIBATOQPSA-N 2 0 247.386 2.362 20 0 BEADRP C[C@@H]([NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21)[C@H]1CCCC[C@H]1C ZINC000423425836 387252679 /nfs/dbraw/zinc/25/26/79/387252679.db2.gz HGQQKHNJIBLGQS-PRFQISJJSA-N 2 0 222.376 2.009 20 0 BEADRP Cc1cncc([C@H](C)[NH2+][C@H]2CC[NH2+]C[C@H]2C)c1 ZINC000423363215 387214703 /nfs/dbraw/zinc/21/47/03/387214703.db2.gz BOJGTQKOUJTPJJ-DYEKYZERSA-N 2 0 233.359 2.039 20 0 BEADRP CC[N@H+](C)C[C@@H]1CCN(Cc2ncccc2C)C1 ZINC000093178910 387218121 /nfs/dbraw/zinc/21/81/21/387218121.db2.gz NABVUUZITKKYKQ-AWEZNQCLSA-N 2 0 247.386 2.164 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCC23CCC3)CC[NH2+]1 ZINC000423367299 387219488 /nfs/dbraw/zinc/21/94/88/387219488.db2.gz ADJVCKYKFPPFDF-GRYCIOLGSA-N 2 0 208.349 2.049 20 0 BEADRP COCC1CCC([NH2+][C@H]2CCC[C@H]([NH3+])C2)CC1 ZINC000423368813 387221224 /nfs/dbraw/zinc/22/12/24/387221224.db2.gz NPNOGEPQLPFAHN-YIOUJQMASA-N 2 0 240.391 2.051 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[NH2+][C@H](C)C1)C1CCSCC1 ZINC000423371772 387222869 /nfs/dbraw/zinc/22/28/69/387222869.db2.gz FQWAEWGIWLHJSL-MDZLAQPJSA-N 2 0 242.432 2.248 20 0 BEADRP C(C[C@H]1CCC[NH2+]1)[NH2+][C@H]1CCC12CCC2 ZINC000423371389 387224232 /nfs/dbraw/zinc/22/42/32/387224232.db2.gz VEYOTFMLQCZUQC-NEPJUHHUSA-N 2 0 208.349 2.051 20 0 BEADRP COc1cccc([C@H](C)[NH2+][C@@H]2CC[NH2+][C@H](C)C2)c1 ZINC000423372697 387227634 /nfs/dbraw/zinc/22/76/34/387227634.db2.gz IKTDGTPKHASWCF-MBNYWOFBSA-N 2 0 248.370 2.486 20 0 BEADRP CO[C@H](c1ccccc1)[C@@H](C)[NH2+]CCCC[NH3+] ZINC000423325248 387228878 /nfs/dbraw/zinc/22/88/78/387228878.db2.gz LHJXHHSDUVIRCH-OCCSQVGLSA-N 2 0 236.359 2.091 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]2C[N@H+](Cc3cccc(F)c3)C[C@@H]21 ZINC000230048685 387229349 /nfs/dbraw/zinc/22/93/49/387229349.db2.gz WBTDBTBXAMNBMC-AEGPPILISA-N 2 0 248.345 2.385 20 0 BEADRP COc1ccc([C@H](C)[NH2+][C@H]2CC[NH2+][C@@H](C)C2)cc1 ZINC000423398223 387233018 /nfs/dbraw/zinc/23/30/18/387233018.db2.gz VDBYKDPINWEYRS-OBJOEFQTSA-N 2 0 248.370 2.486 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C2CC(F)(F)C2)[C@@H]2CCC[C@H]21 ZINC000353589577 387235856 /nfs/dbraw/zinc/23/58/56/387235856.db2.gz QPASCCIQXJCPGO-SDDRHHMPSA-N 2 0 244.329 2.247 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+]C[C@H]1CCC[C@H](C)C1 ZINC000300663611 387237588 /nfs/dbraw/zinc/23/75/88/387237588.db2.gz NHVMIWDSWPHATR-IHRRRGAJSA-N 2 0 242.407 2.156 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]Cc1cccc2c1CCCN2 ZINC000423411953 387245493 /nfs/dbraw/zinc/24/54/93/387245493.db2.gz GQCSNESKORPBBM-VXGBXAGGSA-N 2 0 247.386 2.260 20 0 BEADRP CC(C)[C@@H]1CCC[C@H]([NH2+][C@@H]2[C@H]3C[NH2+]C[C@H]32)C1 ZINC000423430236 387253743 /nfs/dbraw/zinc/25/37/43/387253743.db2.gz KSUATGJIRZMREP-BJJPWKGXSA-N 2 0 222.376 2.009 20 0 BEADRP CC[C@@H]1CC[C@H](C)C[C@H]1[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000423424938 387252098 /nfs/dbraw/zinc/25/20/98/387252098.db2.gz GCRUOLWBVSFMQV-XADZXUCXSA-N 2 0 222.376 2.009 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CC2=CC[NH2+]CC2)[C@H](C)C1 ZINC000423345901 387194601 /nfs/dbraw/zinc/19/46/01/387194601.db2.gz OMOZJAIZPRRESD-BZPMIXESSA-N 2 0 222.376 2.320 20 0 BEADRP C[C@@H]([NH2+]CC1(C)CC[NH2+]CC1)c1cccnc1 ZINC000423346235 387195250 /nfs/dbraw/zinc/19/52/50/387195250.db2.gz ZOLKDUMLQYBTKW-GFCCVEGCSA-N 2 0 233.359 2.122 20 0 BEADRP Cc1cc([C@H](C)[NH2+]C[C@H]2CCC[C@H]([NH3+])C2)no1 ZINC000423463429 387310552 /nfs/dbraw/zinc/31/05/52/387310552.db2.gz FYJSUAZZTHOCMI-SRVKXCTJSA-N 2 0 237.347 2.151 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H]1CCCc2c(O)cccc21 ZINC000423464367 387313089 /nfs/dbraw/zinc/31/30/89/387313089.db2.gz VUAQKWPFYCYPPS-RISCZKNCSA-N 2 0 248.370 2.487 20 0 BEADRP Cc1cc([C@@H](C)[NH2+]CCC[C@H]2CCC[NH2+]2)no1 ZINC000423467590 387315816 /nfs/dbraw/zinc/31/58/16/387315816.db2.gz BKSOKRYHWUDLBM-NEPJUHHUSA-N 2 0 237.347 2.166 20 0 BEADRP CC(C)CC[C@@H]1CC[C@H]([NH2+][C@@H]2[C@H]3C[NH2+]C[C@H]32)C1 ZINC000423429128 387254782 /nfs/dbraw/zinc/25/47/82/387254782.db2.gz LALHRSUBNQKBOE-SEBNEYGDSA-N 2 0 236.403 2.399 20 0 BEADRP COCC[C@@H]1CCC[C@@H]1[NH2+][C@H](C)CCCC[NH3+] ZINC000423428877 387255163 /nfs/dbraw/zinc/25/51/63/387255163.db2.gz JQSAYOMNFCFLOM-RDBSUJKOSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCCC2CC2)CC[N@@H+]1C ZINC000161713314 387260131 /nfs/dbraw/zinc/26/01/31/387260131.db2.gz WSAYBROODFHCRM-YPMHNXCESA-N 2 0 210.365 2.249 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCC[NH2+]1)C1CCCC1 ZINC000423378770 387260525 /nfs/dbraw/zinc/26/05/25/387260525.db2.gz ZVBAEFPCRDTJAO-WCQYABFASA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H]3C[C@@]32C)CC[NH2+]1 ZINC000423382726 387264325 /nfs/dbraw/zinc/26/43/25/387264325.db2.gz ONZDUIGBWGFSAR-KSTCHIGDSA-N 2 0 222.376 2.295 20 0 BEADRP Cc1ncc([C@@H](C)[NH2+]CC2CC[NH2+]CC2)s1 ZINC000643497690 387270744 /nfs/dbraw/zinc/27/07/44/387270744.db2.gz UEHCWLWAIKBFHO-SECBINFHSA-N 2 0 239.388 2.102 20 0 BEADRP Cn1ccnc1[C@@H]1CC[N@H+](Cc2cccs2)C1 ZINC000336446158 387275349 /nfs/dbraw/zinc/27/53/49/387275349.db2.gz YMFHQNGMISKHOX-LLVKDONJSA-N 2 0 247.367 2.471 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+][C@H]1CC[NH2+]C[C@H]1C ZINC000423392776 387277692 /nfs/dbraw/zinc/27/76/92/387277692.db2.gz MAOGMEDVYFHVPO-DYEKYZERSA-N 2 0 233.359 2.039 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@@H]1CC[C@H]1C1CCC1 ZINC000423392730 387278073 /nfs/dbraw/zinc/27/80/73/387278073.db2.gz LXEXYUVDIAMNCO-VZZFWQQMSA-N 2 0 222.376 2.153 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[NH2+][C@@H](C)C1)C1CCC1 ZINC000423392098 387279393 /nfs/dbraw/zinc/27/93/93/387279393.db2.gz XLCQTPIPMGMLPB-UHTWSYAYSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)[C@@H]1C[C@H]1C ZINC000423435517 387285922 /nfs/dbraw/zinc/28/59/22/387285922.db2.gz OTSDAEFSAFPAFZ-GPXIKIIXSA-N 2 0 222.376 2.009 20 0 BEADRP C1CCC2(C1)CCCC[C@@H]2[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000423435162 387286687 /nfs/dbraw/zinc/28/66/87/387286687.db2.gz QWLXVYLPCUONJY-RFQIPJPRSA-N 2 0 234.387 2.297 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)CCCC[NH3+])c1ccc(F)cn1 ZINC000423438359 387288394 /nfs/dbraw/zinc/28/83/94/387288394.db2.gz RIPJGUXWZMHJBJ-WDEREUQCSA-N 2 0 239.338 2.389 20 0 BEADRP CC[C@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)[C@@H]1C[C@H]1C ZINC000423437822 387288665 /nfs/dbraw/zinc/28/86/65/387288665.db2.gz QVBDFSNGYMGWKK-JSFFLRCESA-N 2 0 236.403 2.399 20 0 BEADRP C[C@H]([NH3+])[C@H](C)[NH2+][C@@H]1CCC[C@@H]1CCCF ZINC000423441264 387289525 /nfs/dbraw/zinc/28/95/25/387289525.db2.gz BESAOVKQPCWNNY-NNYUYHANSA-N 2 0 216.344 2.230 20 0 BEADRP C[C@H]([NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21)C1CCC(F)(F)CC1 ZINC000423443993 387292491 /nfs/dbraw/zinc/29/24/91/387292491.db2.gz WCNKALRDDGUWJN-OHBODLIOSA-N 2 0 244.329 2.008 20 0 BEADRP C[C@@H]([NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21)C1CCC(F)(F)CC1 ZINC000423443994 387292562 /nfs/dbraw/zinc/29/25/62/387292562.db2.gz WCNKALRDDGUWJN-YJQGPUDQSA-N 2 0 244.329 2.008 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000423442104 387293216 /nfs/dbraw/zinc/29/32/16/387293216.db2.gz UVWOSLYSMQCTLT-BYCMXARLSA-N 3 0 247.386 2.238 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)CCC[NH3+])C1CCSCC1 ZINC000423451790 387299039 /nfs/dbraw/zinc/29/90/39/387299039.db2.gz IYNFCGJFHICHGR-WDEREUQCSA-N 2 0 230.421 2.235 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H]1CC[C@H]1C1CCC1 ZINC000423452366 387299866 /nfs/dbraw/zinc/29/98/66/387299866.db2.gz JPJUZKVGJQUNRJ-KGYLQXTDSA-N 2 0 210.365 2.282 20 0 BEADRP CO[C@H](C)[C@H](C)[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000360500747 387301046 /nfs/dbraw/zinc/30/10/46/387301046.db2.gz OJLZJTSUFCFHSP-NWDGAFQWSA-N 2 0 240.391 2.016 20 0 BEADRP CCCC[C@@H](C)[C@@H](C)[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000423454390 387302052 /nfs/dbraw/zinc/30/20/52/387302052.db2.gz LOAZXTDEYORYOM-KVSVUVNWSA-N 2 0 210.365 2.009 20 0 BEADRP CCO[C@@H]1C[C@H]([NH2+][C@H](C)[C@H](C)[NH3+])C12CCCC2 ZINC000423453818 387302164 /nfs/dbraw/zinc/30/21/64/387302164.db2.gz YHCZLOGMNJERAV-QNWHQSFQSA-N 2 0 240.391 2.050 20 0 BEADRP C[C@@H]([NH3+])[C@H](C)[NH2+]C1CCC(C(F)F)CC1 ZINC000423455283 387303292 /nfs/dbraw/zinc/30/32/92/387303292.db2.gz CGDYKQJRWDPODX-XHHQTKHESA-N 2 0 220.307 2.136 20 0 BEADRP CC[C@@H]([NH2+][C@H](C)CCC[NH3+])c1ccc(F)cn1 ZINC000423457764 387305699 /nfs/dbraw/zinc/30/56/99/387305699.db2.gz PMOCTIPCSNEPFL-ZYHUDNBSSA-N 2 0 239.338 2.389 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCCC12CCCC2)[C@H](C)[NH3+] ZINC000423457487 387305959 /nfs/dbraw/zinc/30/59/59/387305959.db2.gz FXSHSNBPYMNILU-QJPTWQEYSA-N 2 0 210.365 2.425 20 0 BEADRP CCC[C@H](C)C[N@@H+]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC000352539756 387308016 /nfs/dbraw/zinc/30/80/16/387308016.db2.gz CMAJSUOCDKYPOS-KBPBESRZSA-N 2 0 224.392 2.498 20 0 BEADRP CC[C@H]([NH3+])C[NH2+]C1CCC(C(F)F)CC1 ZINC000423461017 387309300 /nfs/dbraw/zinc/30/93/00/387309300.db2.gz JFSSAWJCRAMTJT-KYHHOPLUSA-N 2 0 220.307 2.137 20 0 BEADRP Cc1ccnc([C@H](C)[NH2+]CCC2=CC[NH2+]CC2)c1 ZINC000423537055 387363033 /nfs/dbraw/zinc/36/30/33/387363033.db2.gz IWCJDRZGDSAARJ-ZDUSSCGKSA-N 2 0 245.370 2.350 20 0 BEADRP CC(C)C1CC([NH2+]CCC2=CC[NH2+]CC2)C1 ZINC000423540126 387365478 /nfs/dbraw/zinc/36/54/78/387365478.db2.gz PYEOMOSFYSAWRX-UHFFFAOYSA-N 2 0 222.376 2.320 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCCC[NH2+]C1)[C@@H]1CC1(C)C ZINC000423541767 387365724 /nfs/dbraw/zinc/36/57/24/387365724.db2.gz AAFOMUUPLFDZHI-TUAOUCFPSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]([NH2+]CCC1=CC[NH2+]CC1)c1nccs1 ZINC000423543317 387367769 /nfs/dbraw/zinc/36/77/69/387367769.db2.gz UYNSNTKAAFXCLR-SNVBAGLBSA-N 2 0 237.372 2.104 20 0 BEADRP Cc1ccncc1[C@@H](C)[NH2+]CCC1=CC[NH2+]CC1 ZINC000423542749 387367838 /nfs/dbraw/zinc/36/78/38/387367838.db2.gz UDDDILQEYWRMKH-CYBMUJFWSA-N 2 0 245.370 2.350 20 0 BEADRP CCC[C@H](N[C@H](C)C1C[NH2+]C1)c1ccccn1 ZINC000643453405 387368931 /nfs/dbraw/zinc/36/89/31/387368931.db2.gz QFBGVMYKUVGYQZ-RISCZKNCSA-N 2 0 233.359 2.120 20 0 BEADRP CC[C@@H]1C[C@H]([NH2+][C@@H]2CCCC[C@H]2C[NH3+])CCO1 ZINC000423547644 387370685 /nfs/dbraw/zinc/37/06/85/387370685.db2.gz LOLMCLJUFKXLDE-REWJHTLYSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H](CCC1CC1)[NH2+]CCC1=CC[NH2+]CC1 ZINC000423546970 387371037 /nfs/dbraw/zinc/37/10/37/387371037.db2.gz ZUBZHRZCZVIQKJ-LBPRGKRZSA-N 2 0 222.376 2.465 20 0 BEADRP C[C@@H]1CCC[C@H]1[NH2+]CCC1=CC[NH2+]CC1 ZINC000423559191 387375050 /nfs/dbraw/zinc/37/50/50/387375050.db2.gz OQJSCHNZUIBMNX-DGCLKSJQSA-N 2 0 208.349 2.074 20 0 BEADRP CC(C)C[C@H]([NH3+])C[NH2+]C(C)(C)C(C)C ZINC000515516801 387384699 /nfs/dbraw/zinc/38/46/99/387384699.db2.gz MABYSSMIOKUMOK-NSHDSACASA-N 2 0 200.370 2.384 20 0 BEADRP C[C@H]1CCC[C@@H]1[NH2+]CCC1=CC[NH2+]CC1 ZINC000423559190 387375960 /nfs/dbraw/zinc/37/59/60/387375960.db2.gz OQJSCHNZUIBMNX-AAEUAGOBSA-N 2 0 208.349 2.074 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CCCC[NH2+]C1 ZINC000423569257 387379084 /nfs/dbraw/zinc/37/90/84/387379084.db2.gz VZEMLTIMEVHOFB-UPJWGTAASA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1ccccn1 ZINC000423474362 387321810 /nfs/dbraw/zinc/32/18/10/387321810.db2.gz HFZZVPZCMNNBSK-STQMWFEESA-N 2 0 233.359 2.264 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]C[C@@H]1CCC[C@H]([NH3+])C1 ZINC000423476760 387324334 /nfs/dbraw/zinc/32/43/34/387324334.db2.gz RIBCVUDDQPTJMV-NDBYEHHHSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1ccncc1 ZINC000423477760 387324633 /nfs/dbraw/zinc/32/46/33/387324633.db2.gz KITUDVZOMFYHEP-TZMCWYRMSA-N 2 0 233.359 2.264 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)CCCC[NH3+])c1cncs1 ZINC000423430593 387326065 /nfs/dbraw/zinc/32/60/65/387326065.db2.gz LDKLPOHMAPQQRK-VHSXEESVSA-N 2 0 227.377 2.311 20 0 BEADRP C[C@H](CCCc1cccnc1)[NH2+][C@H](C)[C@H](C)[NH3+] ZINC000423479484 387326107 /nfs/dbraw/zinc/32/61/07/387326107.db2.gz VKNKQTRSILGRLN-FRRDWIJNSA-N 2 0 235.375 2.118 20 0 BEADRP C[C@@H]([NH3+])[C@H](C)[NH2+][C@H](C)CCCc1cccnc1 ZINC000423479486 387327868 /nfs/dbraw/zinc/32/78/68/387327868.db2.gz VKNKQTRSILGRLN-UPJWGTAASA-N 2 0 235.375 2.118 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@H]1CCCC12CCCC2 ZINC000423486009 387331308 /nfs/dbraw/zinc/33/13/08/387331308.db2.gz ZJMZUIVMBBGNRF-NEPJUHHUSA-N 2 0 210.365 2.426 20 0 BEADRP CCC1CC([NH2+]CCC[C@@H]2CCC[NH2+]2)C1 ZINC000423484911 387331526 /nfs/dbraw/zinc/33/15/26/387331526.db2.gz RHPBJGGLPMRUKJ-CPCZMJQVSA-N 2 0 210.365 2.297 20 0 BEADRP CCO[C@@H]1C[C@H]([NH2+]C[C@H]([NH3+])CC)C12CCCC2 ZINC000423485993 387331574 /nfs/dbraw/zinc/33/15/74/387331574.db2.gz ZIJBLYSXNPDVBZ-FRRDWIJNSA-N 2 0 240.391 2.051 20 0 BEADRP C(C[NH2+][C@H]1CCC12CCC2)C[C@H]1CCC[NH2+]1 ZINC000423487222 387334559 /nfs/dbraw/zinc/33/45/59/387334559.db2.gz TYJQAOGPUSEAFD-OLZOCXBDSA-N 2 0 222.376 2.441 20 0 BEADRP Cc1ccc([C@H](C)[NH2+][C@H]2CC[C@H](C[NH3+])C2)o1 ZINC000423492220 387336006 /nfs/dbraw/zinc/33/60/06/387336006.db2.gz MFXDMRBKKQJABO-SRVKXCTJSA-N 2 0 222.332 2.366 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[C@H](C[NH3+])C1)[C@@H]1C[C@@H]1C ZINC000423493497 387338061 /nfs/dbraw/zinc/33/80/61/387338061.db2.gz BPOHDTJLDFAVBF-YYHQMBLXSA-N 2 0 210.365 2.138 20 0 BEADRP Cc1cncc([C@H](C)[NH2+][C@H]2CC[C@@H](C[NH3+])C2)c1 ZINC000423502198 387342388 /nfs/dbraw/zinc/34/23/88/387342388.db2.gz JSBKXKIXSQIDKL-SCRDCRAPSA-N 2 0 233.359 2.168 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C2(C3CC3)CC2)CN1C1CC1 ZINC000309805231 387343791 /nfs/dbraw/zinc/34/37/91/387343791.db2.gz RZQZBFHRVDTBAH-PWSUYJOCSA-N 2 0 220.360 2.144 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000423508073 387345175 /nfs/dbraw/zinc/34/51/75/387345175.db2.gz KKVMLRGJPCNXPT-YDHLFZDLSA-N 3 0 249.402 2.182 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000423508056 387346212 /nfs/dbraw/zinc/34/62/12/387346212.db2.gz KKVMLRGJPCNXPT-GUTXKFCHSA-N 3 0 249.402 2.182 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H](C)[C@H]1C[C@@H]1C ZINC000322002900 387346754 /nfs/dbraw/zinc/34/67/54/387346754.db2.gz HDLLEAMLQZYHLW-XQQFMLRXSA-N 2 0 212.381 2.352 20 0 BEADRP CC[C@H]([NH2+]C1CCC([NH3+])CC1)[C@H]1C[C@@H]1C ZINC000322006403 387349340 /nfs/dbraw/zinc/34/93/40/387349340.db2.gz HRQRJIVNKMTLCS-JSPGJAJPSA-N 2 0 210.365 2.281 20 0 BEADRP CCSCC[N@@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000121865770 387425295 /nfs/dbraw/zinc/42/52/95/387425295.db2.gz RUWVDMSCNJBRQB-CYBMUJFWSA-N 2 0 242.432 2.157 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+][C@@H](C)C1C[NH2+]C1)CC2 ZINC000643468991 387425393 /nfs/dbraw/zinc/42/53/93/387425393.db2.gz WRQRVNYTXPVSDP-XHDPSFHLSA-N 2 0 230.355 2.180 20 0 BEADRP CC(C)(C[NH2+][C@@H]1CCC[C@@H]1[NH3+])[C@H]1CCCCO1 ZINC000643466641 387388744 /nfs/dbraw/zinc/38/87/44/387388744.db2.gz JYRJEMKWEAHLRI-YNEHKIRRSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CC(C)(C)[C@@H]1CCCCO1 ZINC000643466826 387389259 /nfs/dbraw/zinc/38/92/59/387389259.db2.gz PTCAOPJZMLWNHQ-AVGNSLFASA-N 2 0 242.407 2.297 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]C[C@@H](C)C(C)(C)C ZINC000643455206 387390320 /nfs/dbraw/zinc/39/03/20/387390320.db2.gz GOPYPALBKMLZEJ-OUAUKWLOSA-N 2 0 200.370 2.384 20 0 BEADRP CO[C@H](C)[C@H](C)[NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1 ZINC000361071062 387396986 /nfs/dbraw/zinc/39/69/86/387396986.db2.gz ZVGFHAZYWLXNTB-BFHYXJOUSA-N 2 0 242.407 2.120 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]Cc1nccc2ccccc21 ZINC000643468534 387410312 /nfs/dbraw/zinc/41/03/12/387410312.db2.gz UOSDRESPNCEYNM-NEPJUHHUSA-N 2 0 243.354 2.450 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]Cc1nccc2ccccc21 ZINC000643468537 387410370 /nfs/dbraw/zinc/41/03/70/387410370.db2.gz UOSDRESPNCEYNM-VXGBXAGGSA-N 2 0 243.354 2.450 20 0 BEADRP Cc1ccc(F)c(C[NH+]2CCC(C[NH3+])CC2)c1 ZINC000084946733 387498601 /nfs/dbraw/zinc/49/86/01/387498601.db2.gz YZYCMDXPTWLSSM-UHFFFAOYSA-N 2 0 236.334 2.305 20 0 BEADRP CC1(C)C[C@@H]([NH2+]CCC[NH+]2CCCCC2)CO1 ZINC000396815085 387498683 /nfs/dbraw/zinc/49/86/83/387498683.db2.gz SFXYRJJWXDOMIL-CYBMUJFWSA-N 2 0 240.391 2.020 20 0 BEADRP Cc1ncc([C@@H](C)[NH2+]CC[C@H]2CC[NH2+]C2)s1 ZINC000643509311 387502939 /nfs/dbraw/zinc/50/29/39/387502939.db2.gz XTKAZJPAICFORS-MWLCHTKSSA-N 2 0 239.388 2.102 20 0 BEADRP C[C@@H](C[NH2+][C@H](C)CCC[NH3+])CC(F)(F)F ZINC000396922148 387516263 /nfs/dbraw/zinc/51/62/63/387516263.db2.gz GSFTUUXWYWCTFP-RKDXNWHRSA-N 2 0 226.286 2.292 20 0 BEADRP CC[C@]1(C)CC[N@H+](C[C@@H]2CC[NH2+][C@@H](C)C2)C1 ZINC000399498853 387532788 /nfs/dbraw/zinc/53/27/88/387532788.db2.gz XDIIBABDEWAASW-BFHYXJOUSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1CC[N@H+](CC2(F)CC2)C[C@H]1n1ccnc1 ZINC000527220055 387535103 /nfs/dbraw/zinc/53/51/03/387535103.db2.gz RQXBENSFSZHNFW-NWDGAFQWSA-N 2 0 237.322 2.268 20 0 BEADRP CO[C@@H](C)[C@H](C)[NH2+]CC1(C[NH+](C)C)CCCC1 ZINC000355069925 387474102 /nfs/dbraw/zinc/47/41/02/387474102.db2.gz SIWBFYJHEQPLFR-STQMWFEESA-N 2 0 242.407 2.121 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](CCCCCF)C[C@@H]21 ZINC000304454833 387482034 /nfs/dbraw/zinc/48/20/34/387482034.db2.gz YQCXOTJPHUITKO-FRRDWIJNSA-N 2 0 228.355 2.185 20 0 BEADRP Cc1occc1C[NH2+][C@@H]1CC[NH2+]CC[C@@H]1C ZINC000643472163 387484164 /nfs/dbraw/zinc/48/41/64/387484164.db2.gz CADONYGCKAKZKT-GXFFZTMASA-N 2 0 222.332 2.066 20 0 BEADRP C[C@H](CC1CC1)[NH2+]CCC1CC[NH+](C)CC1 ZINC000122138467 387485769 /nfs/dbraw/zinc/48/57/69/387485769.db2.gz KSYLUCCLXIPCJG-GFCCVEGCSA-N 2 0 224.392 2.497 20 0 BEADRP C[N@H+](CCCCF)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000375754955 387580168 /nfs/dbraw/zinc/58/01/68/387580168.db2.gz DYOXKUFTXHCHFG-FUNVUKJBSA-N 2 0 228.355 2.293 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+]CCCC(F)(F)F ZINC000123893615 387598298 /nfs/dbraw/zinc/59/82/98/387598298.db2.gz SMJKDMUMNOPJIX-NXEZZACHSA-N 2 0 238.297 2.436 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@@H]1CCc2c1cc(F)cc2F ZINC000643514846 387600135 /nfs/dbraw/zinc/60/01/35/387600135.db2.gz QHBQOCDLMILPKE-ISVAXAHUSA-N 2 0 240.297 2.137 20 0 BEADRP COCCCCC[N@@H+]1C[C@H](C[NH3+])[C@@H](C)C[C@@H]1C ZINC000422640732 387611194 /nfs/dbraw/zinc/61/11/94/387611194.db2.gz WAARMPRBJJSJSQ-IHRRRGAJSA-N 2 0 242.407 2.108 20 0 BEADRP CCc1nc([C@@H](C)[NH2+][C@@H](C)CCC[NH3+])cs1 ZINC000422703039 387618953 /nfs/dbraw/zinc/61/89/53/387618953.db2.gz GSBKQKXFMKYOJF-VHSXEESVSA-N 2 0 241.404 2.484 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCCC[C@H]1C)C1C[NH2+]C1 ZINC000422707163 387620892 /nfs/dbraw/zinc/62/08/92/387620892.db2.gz VUZMJWPHNPWNBX-GRYCIOLGSA-N 2 0 210.365 2.010 20 0 BEADRP CC[C@H](C)[C@H](O)C[NH2+][C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000422713320 387626043 /nfs/dbraw/zinc/62/60/43/387626043.db2.gz PMMBLURXPYXBSB-FBUXBERBSA-N 2 0 248.370 2.128 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CCO[C@H]1CCCC[C@@H]1C ZINC000422711437 387626199 /nfs/dbraw/zinc/62/61/99/387626199.db2.gz NCIWDGGMNUOZLP-MJBXVCDLSA-N 2 0 242.407 2.299 20 0 BEADRP CC[C@H](C)[C@H](O)C[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000422713319 387626672 /nfs/dbraw/zinc/62/66/72/387626672.db2.gz PMMBLURXPYXBSB-CJYSPXJISA-N 2 0 248.370 2.128 20 0 BEADRP C[C@]1(C[NH2+][C@@H]2C[C@H]([NH3+])c3ccccc32)CCOC1 ZINC000397153313 387547837 /nfs/dbraw/zinc/54/78/37/387547837.db2.gz LIENLMBGBQGXIZ-RRFJBIMHSA-N 2 0 246.354 2.147 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]CCc2ccco2)CC1 ZINC000035121620 387549136 /nfs/dbraw/zinc/54/91/36/387549136.db2.gz JJUMQFLHTRLVNN-UHFFFAOYSA-N 2 0 236.359 2.285 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)nc1 ZINC000399681348 387565158 /nfs/dbraw/zinc/56/51/58/387565158.db2.gz QMRKWKXDZGXPJN-DZGCQCFKSA-N 2 0 247.386 2.005 20 0 BEADRP CC(C)CCOCC[NH2+][C@@H]1CC[NH2+]CC[C@@H]1C ZINC000422790316 387694593 /nfs/dbraw/zinc/69/45/93/387694593.db2.gz XOWPPFYMDQJVOE-UONOGXRCSA-N 2 0 242.407 2.027 20 0 BEADRP CC(C)[C@](C)(CN)[NH2+]CCN(C)c1ccccc1 ZINC000430588461 387629992 /nfs/dbraw/zinc/62/99/92/387629992.db2.gz ZHRDUXWHCJQFBB-HNNXBMFYSA-N 2 0 249.402 2.086 20 0 BEADRP Cc1ccccc1C[NH2+][C@@](C)(C[NH3+])C1CC1 ZINC000430586927 387630115 /nfs/dbraw/zinc/63/01/15/387630115.db2.gz XQMSYORXXHVKKH-AWEZNQCLSA-N 2 0 218.344 2.212 20 0 BEADRP C[C@@H]1CCCC[C@@H]1OCCN1CCC[C@H]1C[NH3+] ZINC000430593105 387631728 /nfs/dbraw/zinc/63/17/28/387631728.db2.gz DDPJCMFQLQAVTR-RDBSUJKOSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCCC[C@H]1C)C1C[NH2+]C1 ZINC000422726157 387635512 /nfs/dbraw/zinc/63/55/12/387635512.db2.gz DGOJYWOXTRTAMO-FRRDWIJNSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]([NH2+]CC(C)(C)c1cccs1)C1C[NH2+]C1 ZINC000422738544 387646262 /nfs/dbraw/zinc/64/62/62/387646262.db2.gz JSCOANHSRUPZTM-SNVBAGLBSA-N 2 0 238.400 2.223 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CCC[C@@H](C)C1)C1C[NH2+]C1 ZINC000422741249 387648660 /nfs/dbraw/zinc/64/86/60/387648660.db2.gz DBHYFYBYHBNFAW-AGIUHOORSA-N 2 0 224.392 2.400 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H]2CCCc3ccccc3C2)CCC1 ZINC000643518016 387649575 /nfs/dbraw/zinc/64/95/75/387649575.db2.gz RRJPADSMZSBNPU-OAHLLOKOSA-N 2 0 244.382 2.405 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CCOC1CCCCCC1 ZINC000422751594 387656496 /nfs/dbraw/zinc/65/64/96/387656496.db2.gz BPWZCLZRRXOLLM-CYBMUJFWSA-N 2 0 242.407 2.443 20 0 BEADRP Cc1ccccc1CC[NH2+][C@H](C)C[C@@H](C)[NH3+] ZINC000422749864 387656623 /nfs/dbraw/zinc/65/66/23/387656623.db2.gz BFSQIZBMBUCPOP-CHWSQXEVSA-N 2 0 220.360 2.253 20 0 BEADRP COc1cc(C[NH2+][C@H](C)C[C@@H](C)[NH3+])ccc1C ZINC000422753126 387658156 /nfs/dbraw/zinc/65/81/56/387658156.db2.gz DQGKNGBSBMZICD-VXGBXAGGSA-N 2 0 236.359 2.219 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]CCc1cccc(Cl)c1 ZINC000422758391 387660211 /nfs/dbraw/zinc/66/02/11/387660211.db2.gz IYIXGXRXXGDAKT-OLZOCXBDSA-N 2 0 238.762 2.352 20 0 BEADRP C[C@@H]([NH2+][C@H]1C[C@H](C)C[C@H](C)C1)C1C[NH2+]C1 ZINC000422756983 387660857 /nfs/dbraw/zinc/66/08/57/387660857.db2.gz CTASOMUVLPXCHF-XZUYRWCXSA-N 2 0 210.365 2.009 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+]CCSc1ccccc1 ZINC000422756390 387661107 /nfs/dbraw/zinc/66/11/07/387661107.db2.gz CICKDKIUDCTSDV-QWHCGFSZSA-N 2 0 236.384 2.248 20 0 BEADRP Cc1ccccc1OCCC[N@@H+]1CC[C@H](C[NH3+])C1 ZINC000430924293 387661996 /nfs/dbraw/zinc/66/19/96/387661996.db2.gz AATSZAWQOYAEAX-CQSZACIVSA-N 2 0 248.370 2.045 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CCc1ccccc1F ZINC000422766363 387666723 /nfs/dbraw/zinc/66/67/23/387666723.db2.gz PXNOUENBSNTSED-GHMZBOCLSA-N 2 0 224.323 2.084 20 0 BEADRP CC(C)[C@H](C)C[NH2+][C@@H]1CC[NH2+]CC[C@H]1C ZINC000422772763 387670175 /nfs/dbraw/zinc/67/01/75/387670175.db2.gz SVINCNQCXLYDNY-JHJVBQTASA-N 2 0 212.381 2.256 20 0 BEADRP Cc1ccc([C@H](C)C[NH2+][C@H](C)C2C[NH2+]C2)cc1 ZINC000422773344 387670329 /nfs/dbraw/zinc/67/03/29/387670329.db2.gz YKPQAGRMKXDCFB-CHWSQXEVSA-N 2 0 232.371 2.296 20 0 BEADRP CC[C@H]([NH2+]C[C@H](C)C(C)C)[C@@H]1CCC[NH2+]1 ZINC000422774632 387672099 /nfs/dbraw/zinc/67/20/99/387672099.db2.gz XURLALZVJHHOEE-AVGNSLFASA-N 2 0 212.381 2.399 20 0 BEADRP COc1cc(CC[NH2+][C@@H]2CCC[C@@H]2[NH3+])ccc1C ZINC000422775114 387672217 /nfs/dbraw/zinc/67/22/17/387672217.db2.gz ACSQLWNKLLLWRN-UONOGXRCSA-N 2 0 248.370 2.016 20 0 BEADRP COc1cc(CC[NH2+][C@@H]2CCC[C@H]2[NH3+])ccc1C ZINC000422775115 387672347 /nfs/dbraw/zinc/67/23/47/387672347.db2.gz ACSQLWNKLLLWRN-ZIAGYGMSSA-N 2 0 248.370 2.016 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCC[NH2+]CC1)c1ccncc1 ZINC000422775773 387672880 /nfs/dbraw/zinc/67/28/80/387672880.db2.gz CGXRBJLRVIKLMZ-KGLIPLIRSA-N 2 0 233.359 2.264 20 0 BEADRP CC(C)COCCC[NH2+][C@H]1CCCCC[C@@H]1[NH3+] ZINC000422781379 387680046 /nfs/dbraw/zinc/68/00/46/387680046.db2.gz ITNLZLLBXWRWFT-KBPBESRZSA-N 2 0 242.407 2.299 20 0 BEADRP Cc1ccc(O[C@H](C)C[NH2+][C@H]2CCC[C@H]2[NH3+])cc1 ZINC000422781119 387680698 /nfs/dbraw/zinc/68/06/98/387680698.db2.gz DREJBZWSMXWKBY-YUELXQCFSA-N 2 0 248.370 2.232 20 0 BEADRP CC(C)COCCC[NH2+][C@@H]1CCCCC[C@@H]1[NH3+] ZINC000422781381 387680966 /nfs/dbraw/zinc/68/09/66/387680966.db2.gz ITNLZLLBXWRWFT-UONOGXRCSA-N 2 0 242.407 2.299 20 0 BEADRP Cc1cc(C[NH2+]CC2(C)CC[NH+](C)CC2)ccn1 ZINC000527689710 387684951 /nfs/dbraw/zinc/68/49/51/387684951.db2.gz FRIVKULAQXIGOV-UHFFFAOYSA-N 2 0 247.386 2.212 20 0 BEADRP C1=CCC(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)C1 ZINC000527742484 387686771 /nfs/dbraw/zinc/68/67/71/387686771.db2.gz BQNDOLTUBLAUGA-ZIAGYGMSSA-N 2 0 220.360 2.169 20 0 BEADRP CO[C@@H](C[NH2+][C@@H](C)CCC[NH3+])c1ccccc1 ZINC000422743245 387690772 /nfs/dbraw/zinc/69/07/72/387690772.db2.gz SXYIEMOBILRKJE-JSGCOSHPSA-N 2 0 236.359 2.091 20 0 BEADRP CC(C)COCCC[NH2+][C@H]1CC[NH2+]CC[C@H]1C ZINC000422795071 387696629 /nfs/dbraw/zinc/69/66/29/387696629.db2.gz ZPFIJJYQQFAXNM-KGLIPLIRSA-N 2 0 242.407 2.027 20 0 BEADRP C[C@@H]([NH2+]C[C@]1(C)CCCS1)[C@H]1CCCC[NH2+]1 ZINC000422870741 387750062 /nfs/dbraw/zinc/75/00/62/387750062.db2.gz CBVUJVZQMCDJAY-UPJWGTAASA-N 2 0 242.432 2.392 20 0 BEADRP CC[C@H]1CCC[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000422872307 387753337 /nfs/dbraw/zinc/75/33/37/387753337.db2.gz GNVKNQUDYPHVDQ-BEUHCMRWSA-N 2 0 222.376 2.438 20 0 BEADRP COc1cc(C)ccc1C[NH2+][C@@H]1CCC[C@@H]1C[NH3+] ZINC000422872257 387753375 /nfs/dbraw/zinc/75/33/75/387753375.db2.gz GINHAFOZPLQMLI-TZMCWYRMSA-N 2 0 248.370 2.221 20 0 BEADRP CC[C@@H]1CCC[C@H]1[NH2+][C@@H](C)[C@@H]1CCC[NH2+]1 ZINC000422877797 387754604 /nfs/dbraw/zinc/75/46/04/387754604.db2.gz RSAIEVRAIFJBHI-QNWHQSFQSA-N 2 0 210.365 2.295 20 0 BEADRP CCCCOCC[NH2+][C@H]1CCCCC[C@H]1[NH3+] ZINC000422792810 387697012 /nfs/dbraw/zinc/69/70/12/387697012.db2.gz ZMDNBDBZDNPHAM-OLZOCXBDSA-N 2 0 228.380 2.053 20 0 BEADRP CO[C@H](C[NH2+][C@@H]1CCCC[C@H]1C[NH3+])C(C)(C)C ZINC000422801764 387700925 /nfs/dbraw/zinc/70/09/25/387700925.db2.gz AMYVHYXBLAGMMY-YNEHKIRRSA-N 2 0 242.407 2.155 20 0 BEADRP C[C@H]([NH2+][C@@H](c1ccccc1)C1CC1)C1C[NH2+]C1 ZINC000422805062 387701071 /nfs/dbraw/zinc/70/10/71/387701071.db2.gz LOVUNPZMVQEPJB-NHYWBVRUSA-N 2 0 230.355 2.335 20 0 BEADRP Cc1cccc(C[NH2+][C@H](C)C[C@@H](C)[NH3+])c1 ZINC000422801500 387702368 /nfs/dbraw/zinc/70/23/68/387702368.db2.gz FOTKQBFYUHLZKG-VXGBXAGGSA-N 2 0 206.333 2.210 20 0 BEADRP CCCC[NH+]1CCC([NH2+][C@@H](C)CCOC)CC1 ZINC000045025172 387703165 /nfs/dbraw/zinc/70/31/65/387703165.db2.gz DTOSCGWUTUKHIH-ZDUSSCGKSA-N 2 0 242.407 2.266 20 0 BEADRP COCC[C@H](C)[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000045037127 387703926 /nfs/dbraw/zinc/70/39/26/387703926.db2.gz VJFFJVLZLOKXNX-LBPRGKRZSA-N 2 0 242.407 2.264 20 0 BEADRP CO[C@H](C[NH2+][C@@H]1CCCCC[C@@H]1[NH3+])C(C)(C)C ZINC000422805392 387704253 /nfs/dbraw/zinc/70/42/53/387704253.db2.gz GPGPHUBJWJUNFY-YNEHKIRRSA-N 2 0 242.407 2.297 20 0 BEADRP COCc1ccc(C[NH2+][C@H](C)C[C@@H](C)[NH3+])cc1 ZINC000422807009 387706064 /nfs/dbraw/zinc/70/60/64/387706064.db2.gz LOMJRABGOLZIOT-VXGBXAGGSA-N 2 0 236.359 2.048 20 0 BEADRP CCSCC[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000422810374 387708787 /nfs/dbraw/zinc/70/87/87/387708787.db2.gz RRVGLMSSAPTTAF-ACJTYDJDSA-N 2 0 242.432 2.391 20 0 BEADRP C[C@H](Cc1cccs1)[NH2+][C@H](C)C[C@H](C)[NH3+] ZINC000422809412 387709374 /nfs/dbraw/zinc/70/93/74/387709374.db2.gz PQLCXJTXHUUGCC-HBNTYKKESA-N 2 0 226.389 2.395 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CCc1ccsc1 ZINC000422811265 387709452 /nfs/dbraw/zinc/70/94/52/387709452.db2.gz TZYBHQXODGAJQV-VHSXEESVSA-N 2 0 212.362 2.006 20 0 BEADRP CO[C@H](C[NH2+][C@@H](C)CCCC[NH3+])C(C)(C)C ZINC000422812125 387710780 /nfs/dbraw/zinc/71/07/80/387710780.db2.gz PYALAPYLOZYXGG-NWDGAFQWSA-N 2 0 230.396 2.155 20 0 BEADRP COCc1ccccc1C[NH2+][C@H](C)C[C@@H](C)[NH3+] ZINC000422812662 387711729 /nfs/dbraw/zinc/71/17/29/387711729.db2.gz YDPMDFIMESNQLB-VXGBXAGGSA-N 2 0 236.359 2.048 20 0 BEADRP Cc1ncc([C@H](C)[NH2+][C@H]2CCC[NH2+]CC2)s1 ZINC000643521744 387716339 /nfs/dbraw/zinc/71/63/39/387716339.db2.gz APMOTZWMAOBBSG-ONGXEEELSA-N 2 0 239.388 2.244 20 0 BEADRP C1CC2(C1)CC[C@H]2[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000643522290 387719180 /nfs/dbraw/zinc/71/91/80/387719180.db2.gz KVCNRJHSZNLIGS-VXGBXAGGSA-N 2 0 208.349 2.051 20 0 BEADRP Cc1ccncc1[C@@H](C)[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000643521883 387721773 /nfs/dbraw/zinc/72/17/73/387721773.db2.gz DUWRCDITCLYARB-CHWSQXEVSA-N 2 0 233.359 2.183 20 0 BEADRP CCS[C@@H]1CCCC[C@@H]1[NH2+][C@H](C)C1C[NH2+]C1 ZINC000422831270 387723477 /nfs/dbraw/zinc/72/34/77/387723477.db2.gz DHLYJHJWIRAQOC-KGYLQXTDSA-N 2 0 242.432 2.248 20 0 BEADRP Cc1cc(C[NH2+][C@H](C)C[C@H](C)[NH3+])ccc1F ZINC000422789687 387732543 /nfs/dbraw/zinc/73/25/43/387732543.db2.gz BKZLHXBQMLPSON-WDEREUQCSA-N 2 0 224.323 2.350 20 0 BEADRP C([NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)[C@@H]1CCCS1 ZINC000128074624 387734621 /nfs/dbraw/zinc/73/46/21/387734621.db2.gz RUXARMORPGJVPC-AVGNSLFASA-N 2 0 240.416 2.098 20 0 BEADRP COCc1cccc(C[NH2+][C@H](C)C[C@@H](C)[NH3+])c1 ZINC000422879381 387755950 /nfs/dbraw/zinc/75/59/50/387755950.db2.gz KHUITWSUTCHGBV-VXGBXAGGSA-N 2 0 236.359 2.048 20 0 BEADRP Cc1cccc(CC[NH2+][C@H](C)C[C@H](C)[NH3+])c1 ZINC000422853523 387737578 /nfs/dbraw/zinc/73/75/78/387737578.db2.gz YZQSOPVBLLIKMC-QWHCGFSZSA-N 2 0 220.360 2.253 20 0 BEADRP Cc1ncc([C@H](C)[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)s1 ZINC000643524240 387737972 /nfs/dbraw/zinc/73/79/72/387737972.db2.gz XYZHHMVPZBYVNZ-JMJZKYOTSA-N 2 0 239.388 2.372 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)[C@H]1CC12CC2 ZINC000527862170 387738389 /nfs/dbraw/zinc/73/83/89/387738389.db2.gz NKFANLPBBKSVMO-YNEHKIRRSA-N 2 0 222.376 2.106 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]C[C@@H]1CCOc2ccccc21 ZINC000422889575 387762287 /nfs/dbraw/zinc/76/22/87/387762287.db2.gz PWJVVRKHZBJQGA-IACUBPJLSA-N 2 0 246.354 2.022 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1CCC[C@H]2OCC[C@@H]21 ZINC000422890115 387763518 /nfs/dbraw/zinc/76/35/18/387763518.db2.gz RFXMTTFTFNJWRM-AAVRWANBSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@H]([NH3+])C[NH2+][C@H]1CC[C@](C)(c2ccccc2)C1 ZINC000643527913 387763710 /nfs/dbraw/zinc/76/37/10/387763710.db2.gz VFOQJTGRWZRDLW-QEJZJMRPSA-N 2 0 232.371 2.434 20 0 BEADRP CCC1(C[NH2+][C@@H]2CCC[C@@H]2[NH3+])CCCC1 ZINC000422891226 387764190 /nfs/dbraw/zinc/76/41/90/387764190.db2.gz UVSJWHLXZBIDDE-NWDGAFQWSA-N 2 0 210.365 2.426 20 0 BEADRP CC(C)C[C@H](C)C[C@@H](C)[NH2+]C[C@@H](C)[NH3+] ZINC000643527121 387764246 /nfs/dbraw/zinc/76/42/46/387764246.db2.gz JYVUJTRHRQSIQS-QJPTWQEYSA-N 2 0 200.370 2.384 20 0 BEADRP Cc1nc(CC[NH2+][C@@H](C)CCC[NH3+])sc1C ZINC000422896658 387766454 /nfs/dbraw/zinc/76/64/54/387766454.db2.gz YLTNQALXEFMWJW-VIFPVBQESA-N 2 0 241.404 2.019 20 0 BEADRP C[C@H]([NH3+])C[NH2+][C@@H]1CCCCC12CCCC2 ZINC000643527598 387766619 /nfs/dbraw/zinc/76/66/19/387766619.db2.gz OZYABOPWSTVTKP-NWDGAFQWSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@H](C[C@@H]1CCCO1)[NH2+][C@@H]1CCCC[C@H]1C[NH3+] ZINC000422904444 387767608 /nfs/dbraw/zinc/76/76/08/387767608.db2.gz PYLOCCUTFQRFSC-ZOBORPQBSA-N 2 0 240.391 2.051 20 0 BEADRP COc1ccc([C@H]([NH2+]C[C@@H](C)[NH3+])C(C)C)cc1 ZINC000643528281 387767937 /nfs/dbraw/zinc/76/79/37/387767937.db2.gz GPKZPYPWVMOBEP-BXUZGUMPSA-N 2 0 236.359 2.329 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCc2ccccc21)[C@H]1CCC[NH2+]1 ZINC000422909012 387769087 /nfs/dbraw/zinc/76/90/87/387769087.db2.gz NITNSTQYKYTYMU-DUVNUKRYSA-N 2 0 244.382 2.447 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCc2ccccc21)[C@H]1CCC[NH2+]1 ZINC000422909017 387770101 /nfs/dbraw/zinc/77/01/01/387770101.db2.gz NITNSTQYKYTYMU-JGGQBBKZSA-N 2 0 244.382 2.447 20 0 BEADRP C[C@H](CCc1cccc(F)c1)[NH2+]C[C@H](C)[NH3+] ZINC000643528558 387770705 /nfs/dbraw/zinc/77/07/05/387770705.db2.gz LJPLUEOYCJDFLM-WDEREUQCSA-N 2 0 224.323 2.084 20 0 BEADRP CC[C@H](COC)[NH2+]CC1(C[NH+](C)C)CCCC1 ZINC000129475421 387771453 /nfs/dbraw/zinc/77/14/53/387771453.db2.gz RZFHBUQCVLMMOH-CYBMUJFWSA-N 2 0 242.407 2.123 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+][C@@H]1C[C@H]1Cc1ccccc1 ZINC000422921150 387774902 /nfs/dbraw/zinc/77/49/02/387774902.db2.gz NMHOFHDEWHDCIZ-APIJFGDWSA-N 2 0 230.355 2.087 20 0 BEADRP CC[C@H]([NH2+]CC1(CC)CC1)[C@@H]1CCC[NH2+]1 ZINC000422920954 387775412 /nfs/dbraw/zinc/77/54/12/387775412.db2.gz OCBLYCCKDRTVCA-RYUDHWBXSA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@@H]([NH2+]CC1(CC)CC1)[C@@H]1CCC[NH2+]1 ZINC000422920953 387776059 /nfs/dbraw/zinc/77/60/59/387776059.db2.gz OCBLYCCKDRTVCA-NEPJUHHUSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]([NH3+])C[NH2+][C@@H]1CCCC12CCCCC2 ZINC000643529607 387776724 /nfs/dbraw/zinc/77/67/24/387776724.db2.gz GEDDXKIVKAPUMB-NWDGAFQWSA-N 2 0 210.365 2.426 20 0 BEADRP CC[C@@H]([NH2+]CC1(C)CCC1)[C@@H]1CCC[NH2+]1 ZINC000422923433 387776937 /nfs/dbraw/zinc/77/69/37/387776937.db2.gz WCGNOMMNLOKBOJ-NEPJUHHUSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H]1C[C@H]1Cc1ccccc1 ZINC000422926849 387779176 /nfs/dbraw/zinc/77/91/76/387779176.db2.gz XQNHMEKAABQLTK-YUELXQCFSA-N 2 0 232.371 2.335 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H]1C[C@@H]1Cc1ccccc1 ZINC000422926847 387779522 /nfs/dbraw/zinc/77/95/22/387779522.db2.gz XQNHMEKAABQLTK-SNPRPXQTSA-N 2 0 232.371 2.335 20 0 BEADRP CC(C)CC1(C[NH2+][C@@H]2CCC[C@@H]2[NH3+])CC1 ZINC000422932571 387781602 /nfs/dbraw/zinc/78/16/02/387781602.db2.gz ZNMWBAZHJPLKNE-NWDGAFQWSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)CC(CC(C)C)[NH2+][C@H]1CC[NH2+]C1 ZINC000422936299 387783340 /nfs/dbraw/zinc/78/33/40/387783340.db2.gz BGRCRBCNPZYBTK-LBPRGKRZSA-N 2 0 212.381 2.399 20 0 BEADRP CC[C@H](C)C[NH2+]CCC[N@@H+]1CCCO[C@H](C)C1 ZINC000432355721 387784040 /nfs/dbraw/zinc/78/40/40/387784040.db2.gz FRBJMOZQWFEERC-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H](C)C[C@@H]1CCCO1 ZINC000422899724 387785103 /nfs/dbraw/zinc/78/51/03/387785103.db2.gz IDURCOONUSERTA-AGIUHOORSA-N 2 0 228.380 2.051 20 0 BEADRP C[C@@H](C[C@@H]1CCCO1)[NH2+]C1CCC(C[NH3+])CC1 ZINC000422901671 387787266 /nfs/dbraw/zinc/78/72/66/387787266.db2.gz LMIISWKSJPZOSW-ABXWRUBCSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)[C@H]1CC12CC2 ZINC000527918347 387788478 /nfs/dbraw/zinc/78/84/78/387788478.db2.gz WDLKUYWBIJRZNZ-MELADBBJSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@H]1CCc2c1cccc2O ZINC000422980838 387791797 /nfs/dbraw/zinc/79/17/97/387791797.db2.gz RHPNZVOBKJHJFU-FZMZJTMJSA-N 2 0 248.370 2.487 20 0 BEADRP Cc1ccc(CC[NH2+][C@H](C)C[C@H](C)[NH3+])cc1 ZINC000422983692 387792920 /nfs/dbraw/zinc/79/29/20/387792920.db2.gz UOAOYCHECGCDAX-QWHCGFSZSA-N 2 0 220.360 2.253 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H](C)C[C@@H](C)[NH3+])cc1 ZINC000422983691 387793019 /nfs/dbraw/zinc/79/30/19/387793019.db2.gz UOAOYCHECGCDAX-OLZOCXBDSA-N 2 0 220.360 2.253 20 0 BEADRP C[C@H](Cc1ccc(O)cc1)[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000422982959 387793556 /nfs/dbraw/zinc/79/35/56/387793556.db2.gz YHIQSLKAFJNKEN-SDDRHHMPSA-N 2 0 236.359 2.039 20 0 BEADRP C[C@H](CC[N@@H+]1CC[C@H](C[NH3+])C1)c1ccccc1 ZINC000050245564 387794195 /nfs/dbraw/zinc/79/41/95/387794195.db2.gz KRYJPHUVKDNLFB-ZIAGYGMSSA-N 2 0 232.371 2.461 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+][C@H]1CCCC(F)(F)C1 ZINC000422986616 387795078 /nfs/dbraw/zinc/79/50/78/387795078.db2.gz CWTQPLXCCOXENH-IVZWLZJFSA-N 2 0 218.291 2.034 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]C[C@@H]1[C@@H]2Cc3ccccc3[C@H]12 ZINC000422987853 387798392 /nfs/dbraw/zinc/79/83/92/387798392.db2.gz HNXZHHOZCZHIGK-CAPXZKIUSA-N 2 0 244.382 2.289 20 0 BEADRP COCCC1(C[NH2+][C@H]2CCCCC[C@@H]2[NH3+])CC1 ZINC000422992856 387799680 /nfs/dbraw/zinc/79/96/80/387799680.db2.gz RSRQYMMRIAOVFC-STQMWFEESA-N 2 0 240.391 2.053 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+][C@@H]1CC=CCC1 ZINC000422991134 387800538 /nfs/dbraw/zinc/80/05/38/387800538.db2.gz OHYOMKDOEAKCIF-JHJVBQTASA-N 2 0 208.349 2.345 20 0 BEADRP CCC(CC)[C@H](CC[NH2+][C@@H](C)C1C[NH2+]C1)OC ZINC000422995563 387802604 /nfs/dbraw/zinc/80/26/04/387802604.db2.gz KJJJPETUQVBIJO-FZMZJTMJSA-N 2 0 242.407 2.025 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]CCCc1ccccn1 ZINC000422998355 387804293 /nfs/dbraw/zinc/80/42/93/387804293.db2.gz PZQWYDAJXYISOD-CABCVRRESA-N 2 0 247.386 2.264 20 0 BEADRP COc1cc(C)cc(C[NH2+][C@@H](C)C[C@H](C)[NH3+])c1 ZINC000423001628 387807473 /nfs/dbraw/zinc/80/74/73/387807473.db2.gz IFLVWLNMDFMNES-RYUDHWBXSA-N 2 0 236.359 2.219 20 0 BEADRP COC[C@H]([NH2+][C@H](C)C[C@@H](C)[NH3+])c1ccccc1 ZINC000422954308 387808880 /nfs/dbraw/zinc/80/88/80/387808880.db2.gz HYFXDZAUCMFGCT-BZPMIXESSA-N 2 0 236.359 2.090 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]C[C@H]1CC1(C)C ZINC000422954360 387809132 /nfs/dbraw/zinc/80/91/32/387809132.db2.gz IJTQIKNFZXAKBJ-IJLUTSLNSA-N 2 0 210.365 2.010 20 0 BEADRP COC[C@H]([NH2+][C@@H](C)CCC[NH3+])c1ccccc1 ZINC000422956674 387809467 /nfs/dbraw/zinc/80/94/67/387809467.db2.gz QDXBSYQYOAOUNM-JSGCOSHPSA-N 2 0 236.359 2.091 20 0 BEADRP Cc1nc(CC[NH2+][C@H](C)C[C@H](C)[NH3+])sc1C ZINC000422889362 387759350 /nfs/dbraw/zinc/75/93/50/387759350.db2.gz GBUOJFTZKCLMKI-DTWKUNHWSA-N 2 0 241.404 2.018 20 0 BEADRP CC(C)[C@H]1CC[C@@H](C)C[C@H]1[NH2+]C[C@H](C)[NH3+] ZINC000643526739 387759491 /nfs/dbraw/zinc/75/94/91/387759491.db2.gz FQHJREMIYXVZHA-YVECIDJPSA-N 2 0 212.381 2.384 20 0 BEADRP Cc1nc(C)c(CC[NH2+][C@H](C)C[C@@H](C)[NH3+])s1 ZINC000422885577 387759579 /nfs/dbraw/zinc/75/95/79/387759579.db2.gz HAWHDSGJYLVQTN-RKDXNWHRSA-N 2 0 241.404 2.018 20 0 BEADRP Cc1nc(CC[NH2+][C@@H](C)C[C@@H](C)[NH3+])sc1C ZINC000422889361 387760526 /nfs/dbraw/zinc/76/05/26/387760526.db2.gz GBUOJFTZKCLMKI-BDAKNGLRSA-N 2 0 241.404 2.018 20 0 BEADRP Cc1nc(C)c(CC[NH2+][C@H](C)CCC[NH3+])s1 ZINC000422888717 387761083 /nfs/dbraw/zinc/76/10/83/387761083.db2.gz NPDJNCAGBONMAI-SECBINFHSA-N 2 0 241.404 2.019 20 0 BEADRP C[C@@H]1C[C@H]1C[N@@H+]1CCC[C@H]([NH+](C)C)CC1 ZINC000432796992 387821615 /nfs/dbraw/zinc/82/16/15/387821615.db2.gz JMJIMIQSQHVICG-AGIUHOORSA-N 2 0 210.365 2.059 20 0 BEADRP C[C@H](Cc1ccc(O)cc1)[NH2+][C@@H](C)[C@@H]1CCC[NH2+]1 ZINC000422976104 387827284 /nfs/dbraw/zinc/82/72/84/387827284.db2.gz UQISMFQKNZFOSB-XUJVJEKNSA-N 2 0 248.370 2.053 20 0 BEADRP CC(C)[C@H](O)C(C)(C)C[NH2+][C@H](C)CCCC[NH3+] ZINC000423006616 387828980 /nfs/dbraw/zinc/82/89/80/387828980.db2.gz WBDGFIJYTJIBEQ-OLZOCXBDSA-N 2 0 244.423 2.137 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H](C)[C@H]1COc2ccccc21 ZINC000423007239 387829193 /nfs/dbraw/zinc/82/91/93/387829193.db2.gz XDHHXSSSFNDMMH-ZJQBRPOHSA-N 2 0 248.370 2.267 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@@H](CCO)C1CCCCC1 ZINC000423011066 387833035 /nfs/dbraw/zinc/83/30/35/387833035.db2.gz YUYUXZZSGMNGDL-JSGCOSHPSA-N 2 0 242.407 2.035 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H](CCO)C1CCCCC1 ZINC000423011067 387833526 /nfs/dbraw/zinc/83/35/26/387833526.db2.gz YUYUXZZSGMNGDL-OCCSQVGLSA-N 2 0 242.407 2.035 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@H](CCO)C1CCCCC1 ZINC000423010865 387834595 /nfs/dbraw/zinc/83/45/95/387834595.db2.gz YUYUXZZSGMNGDL-GXTWGEPZSA-N 2 0 242.407 2.035 20 0 BEADRP CC[C@@H](CSC)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000423011171 387834698 /nfs/dbraw/zinc/83/46/98/387834698.db2.gz ANQLXGUWVUZOLJ-WSMDXJOWSA-N 2 0 228.405 2.001 20 0 BEADRP Cc1ccc(CC[N@H+]2C[C@H](C[NH3+])C[C@@H]2C)cc1 ZINC000442763712 387834898 /nfs/dbraw/zinc/83/48/98/387834898.db2.gz JBIZKZFUJNSJKW-ZFWWWQNUSA-N 2 0 232.371 2.207 20 0 BEADRP CC(C)CSCCC[NH2+][C@@H]1CCC[C@@H]1[NH3+] ZINC000423013901 387836110 /nfs/dbraw/zinc/83/61/10/387836110.db2.gz NTKMIJJOXLLKKG-NWDGAFQWSA-N 2 0 230.421 2.235 20 0 BEADRP Cc1cnccc1CC[NH2+][C@H]1CCCC[C@H]1C[NH3+] ZINC000423014108 387836351 /nfs/dbraw/zinc/83/63/51/387836351.db2.gz OHNPXPQKGPCWDU-GJZGRUSLSA-N 2 0 247.386 2.040 20 0 BEADRP CC(C)CSCCC[NH2+][C@@H](C)C[C@@H](C)[NH3+] ZINC000423014865 387838257 /nfs/dbraw/zinc/83/82/57/387838257.db2.gz PYEQKZWFPSIPSP-NEPJUHHUSA-N 2 0 232.437 2.481 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]C1CCC(F)(F)CC1 ZINC000423015256 387839682 /nfs/dbraw/zinc/83/96/82/387839682.db2.gz QOQQNVUDZJXWSN-BDAKNGLRSA-N 2 0 220.307 2.280 20 0 BEADRP CO[C@@H]1[C@H](C)[C@@H]([NH2+][C@H](C)CCCC[NH3+])C1(C)C ZINC000423019004 387841938 /nfs/dbraw/zinc/84/19/38/387841938.db2.gz STOBOIVRBFLITQ-FDYHWXHSSA-N 2 0 242.407 2.153 20 0 BEADRP CC[C@@H]([NH2+]CCCCOC(C)C)[C@@H]1CCC[NH2+]1 ZINC000423027610 387843564 /nfs/dbraw/zinc/84/35/64/387843564.db2.gz DQTQDIDFWCMZBE-KGLIPLIRSA-N 2 0 242.407 2.312 20 0 BEADRP CC(C)(C)[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@@H]2[NH3+])CCO1 ZINC000423031271 387845125 /nfs/dbraw/zinc/84/51/25/387845125.db2.gz WXPUKOQJWPPIRE-VOAKCMCISA-N 2 0 240.391 2.050 20 0 BEADRP COCCC(C)(C)C[NH2+][C@@H]1CC[NH2+]CC[C@@H]1C ZINC000423030338 387846455 /nfs/dbraw/zinc/84/64/55/387846455.db2.gz BIDZIYZIBICQPI-QWHCGFSZSA-N 2 0 242.407 2.027 20 0 BEADRP CC(C)OCCCC[NH2+][C@@H]1CC[NH2+]CC[C@@H]1C ZINC000423031532 387847267 /nfs/dbraw/zinc/84/72/67/387847267.db2.gz LGBGSPBQFUXURI-UONOGXRCSA-N 2 0 242.407 2.169 20 0 BEADRP Cc1cnc([C@H](C)C[NH2+][C@H]2CCC[C@H]2[NH3+])s1 ZINC000423031792 387847467 /nfs/dbraw/zinc/84/74/67/387847467.db2.gz DQTBHZQJOVIAQO-IEBDPFPHSA-N 2 0 239.388 2.024 20 0 BEADRP CS[C@H](C[NH2+][C@@H]1CCC[C@H]1[NH3+])C(C)(C)C ZINC000423031921 387848422 /nfs/dbraw/zinc/84/84/22/387848422.db2.gz LQTSCSQGIJZZAO-GMTAPVOTSA-N 2 0 230.421 2.234 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000643533998 387850242 /nfs/dbraw/zinc/85/02/42/387850242.db2.gz JGCHSKUPZGIWPX-OCCSQVGLSA-N 2 0 248.370 2.332 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)C(C)C ZINC000643533807 387850383 /nfs/dbraw/zinc/85/03/83/387850383.db2.gz FEOZRFAEYWSZEK-NWDGAFQWSA-N 2 0 210.365 2.153 20 0 BEADRP Cc1cnc([C@H](C)C[NH2+][C@H](C)C[C@H](C)[NH3+])s1 ZINC000423035770 387850709 /nfs/dbraw/zinc/85/07/09/387850709.db2.gz KDESHAYYLLBSHN-KXUCPTDWSA-N 2 0 241.404 2.270 20 0 BEADRP Cc1cnc([C@H](C)C[NH2+][C@@H](C)C[C@H](C)[NH3+])s1 ZINC000423035772 387850934 /nfs/dbraw/zinc/85/09/34/387850934.db2.gz KDESHAYYLLBSHN-UTLUCORTSA-N 2 0 241.404 2.270 20 0 BEADRP [NH3+]CC1CCC([NH2+]CC[C@@H]2CCCCO2)CC1 ZINC000423038569 387852797 /nfs/dbraw/zinc/85/27/97/387852797.db2.gz DAQUTILBRZIGLW-RUXDESIVSA-N 2 0 240.391 2.053 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CCCCO1)[C@@H]1CCCC[NH2+]1 ZINC000423039218 387853484 /nfs/dbraw/zinc/85/34/84/387853484.db2.gz DZGDQUWOSNSQHS-RDBSUJKOSA-N 2 0 240.391 2.066 20 0 BEADRP CC(C)C[C@@H]1C[C@H]([NH2+][C@H](C)CCC[NH3+])CCO1 ZINC000423043291 387855682 /nfs/dbraw/zinc/85/56/82/387855682.db2.gz OEGFKRQBSKSHKG-MGPQQGTHSA-N 2 0 242.407 2.297 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+][C@@H]1CC12CCCC2 ZINC000423075242 387874265 /nfs/dbraw/zinc/87/42/65/387874265.db2.gz OCHLOTDDMFBMHK-FRRDWIJNSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]C[C@](C)(O)C1CCCCC1 ZINC000423072309 387874272 /nfs/dbraw/zinc/87/42/72/387874272.db2.gz JDTMIXLKDTWXDI-SCRDCRAPSA-N 2 0 242.407 2.033 20 0 BEADRP CC(C)O[C@@H]1C[C@@H]([NH2+][C@H](C)CCC[NH3+])C1(C)C ZINC000423046448 387857463 /nfs/dbraw/zinc/85/74/63/387857463.db2.gz FFZODYILQWCUJK-JHJVBQTASA-N 2 0 242.407 2.296 20 0 BEADRP CCc1cccc(C[N@H+]2C[C@H]3C[NH+](C)C[C@H]3C2)c1 ZINC000193606537 387859171 /nfs/dbraw/zinc/85/91/71/387859171.db2.gz SPXBULGKVAQJPK-IYBDPMFKSA-N 2 0 244.382 2.242 20 0 BEADRP C1[C@@H]([NH2+][C@@H]2CCC23CCCC3)C12CC[NH2+]CC2 ZINC000643534685 387859620 /nfs/dbraw/zinc/85/96/20/387859620.db2.gz ABRJHRYVSVZOKZ-CHWSQXEVSA-N 2 0 234.387 2.441 20 0 BEADRP C[C@@H](C[NH2+][C@@H]1CC[NH2+]CC[C@H]1C)C(F)(F)F ZINC000423052051 387860310 /nfs/dbraw/zinc/86/03/10/387860310.db2.gz OYUHSVCZIIFHOA-KXUCPTDWSA-N 2 0 238.297 2.163 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@H](C)c1ccncc1 ZINC000643460233 387874473 /nfs/dbraw/zinc/87/44/73/387874473.db2.gz DAHTXFAIXIVOGK-QWHCGFSZSA-N 2 0 235.375 2.292 20 0 BEADRP CC[C@@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)C1CCC1 ZINC000643535871 387865592 /nfs/dbraw/zinc/86/55/92/387865592.db2.gz KHVLXEPPCXGCNB-CHWSQXEVSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)[C@H]1CC1(C)C ZINC000643536034 387865909 /nfs/dbraw/zinc/86/59/09/387865909.db2.gz MHZJJEFYTYBIGX-QJPTWQEYSA-N 2 0 222.376 2.153 20 0 BEADRP Cc1cc(NC[C@H]2CC[N@@H+]2C2CCCC2)cc[nH+]1 ZINC000528205926 387868258 /nfs/dbraw/zinc/86/82/58/387868258.db2.gz ATLFPJQGAODOMQ-OAHLLOKOSA-N 2 0 245.370 2.241 20 0 BEADRP CC[C@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1ccncc1 ZINC000643536621 387868566 /nfs/dbraw/zinc/86/85/66/387868566.db2.gz SWIKIIWLEGGYDI-KBPBESRZSA-N 2 0 245.370 2.264 20 0 BEADRP CCC(O)(CC)CC[NH2+][C@@H]1CCCCC[C@@H]1[NH3+] ZINC000423065802 387868953 /nfs/dbraw/zinc/86/89/53/387868953.db2.gz CMMCAQKADDCQRT-QWHCGFSZSA-N 2 0 242.407 2.177 20 0 BEADRP CC(C)=CC[NH2+][C@H](C)c1ccc(C[NH3+])nc1C ZINC000423067733 387869173 /nfs/dbraw/zinc/86/91/73/387869173.db2.gz IECNQTCVQVEAQH-LLVKDONJSA-N 2 0 233.359 2.466 20 0 BEADRP CCC[C@H](C)C[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000157783754 387872201 /nfs/dbraw/zinc/87/22/01/387872201.db2.gz ZAJNUGLUQJHGEL-YNEHKIRRSA-N 2 0 212.381 2.495 20 0 BEADRP COCC[C@@H]([NH2+][C@@H](C)[C@@H]1CCC[NH2+]1)C(C)(C)C ZINC000423105911 387890302 /nfs/dbraw/zinc/89/03/02/387890302.db2.gz CRCMPFXSYHMATJ-RWMBFGLXSA-N 2 0 242.407 2.168 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@H]1CCO[C@@H](C2CC2)C1 ZINC000423054580 387892005 /nfs/dbraw/zinc/89/20/05/387892005.db2.gz VAGIAWWYEUYZRR-KWCYVHTRSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CC1(C(F)(F)F)CC1 ZINC000423111598 387892409 /nfs/dbraw/zinc/89/24/09/387892409.db2.gz QQWGPYQWDBUNRC-SECBINFHSA-N 2 0 238.297 2.436 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CCc1ccc2[nH]ccc2c1 ZINC000423109804 387893170 /nfs/dbraw/zinc/89/31/70/387893170.db2.gz UZBWRDWZCJNXPJ-NWDGAFQWSA-N 2 0 245.370 2.426 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@H](C)c1ccc2n[nH]cc2c1 ZINC000423108691 387893326 /nfs/dbraw/zinc/89/33/26/387893326.db2.gz MNTUIIYWLNJULP-HBNTYKKESA-N 2 0 246.358 2.339 20 0 BEADRP COCC1(C[NH2+][C@@H]2CCCCC[C@H]2[NH3+])CCC1 ZINC000423110670 387893424 /nfs/dbraw/zinc/89/34/24/387893424.db2.gz IGLPQMJBCVOMIC-CHWSQXEVSA-N 2 0 240.391 2.053 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@@H](C)c1ccc2n[nH]cc2c1 ZINC000423108684 387893640 /nfs/dbraw/zinc/89/36/40/387893640.db2.gz MNTUIIYWLNJULP-AXFHLTTASA-N 2 0 246.358 2.339 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H](C)c1ccc2n[nH]cc2c1 ZINC000423108686 387894413 /nfs/dbraw/zinc/89/44/13/387894413.db2.gz MNTUIIYWLNJULP-DCAQKATOSA-N 2 0 246.358 2.339 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CCCC(F)(F)C1)C1C[NH2+]C1 ZINC000423117799 387898941 /nfs/dbraw/zinc/89/89/41/387898941.db2.gz XHAXUVSYCJXESC-NXEZZACHSA-N 2 0 232.318 2.009 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCC1(C)C)[C@@H]1CCC[NH2+]1 ZINC000423111949 387896201 /nfs/dbraw/zinc/89/62/01/387896201.db2.gz RIXKGOXWWOSRCI-SDDRHHMPSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@@H]([NH2+]CC1CCC(F)(F)CC1)C1C[NH2+]C1 ZINC000423111828 387897102 /nfs/dbraw/zinc/89/71/02/387897102.db2.gz JJJKPOQXBGMIET-SECBINFHSA-N 2 0 232.318 2.009 20 0 BEADRP COCC[C@H]([NH2+][C@@H](C)C[C@H](C)[NH3+])C(C)(C)C ZINC000423116775 387897878 /nfs/dbraw/zinc/89/78/78/387897878.db2.gz RLSNJDIKOVNTKM-SRVKXCTJSA-N 2 0 230.396 2.153 20 0 BEADRP COCC[C@@H]([NH2+][C@@H](C)CCC[NH3+])C(C)(C)C ZINC000423117680 387898994 /nfs/dbraw/zinc/89/89/94/387898994.db2.gz WPWYCVURVCPYEP-NWDGAFQWSA-N 2 0 230.396 2.155 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCCCC[C@H]1[NH3+])c1ccncc1 ZINC000643460226 387875629 /nfs/dbraw/zinc/87/56/29/387875629.db2.gz CORXTPCROLADHC-YUELXQCFSA-N 2 0 247.386 2.435 20 0 BEADRP CCCNc1ccc(C[NH2+][C@@H](C)C2C[NH2+]C2)cc1 ZINC000423076281 387876515 /nfs/dbraw/zinc/87/65/15/387876515.db2.gz QTARGDQBFNPZFG-LBPRGKRZSA-N 2 0 247.386 2.206 20 0 BEADRP COC1CCC(C)(C[NH2+][C@@H](C)CCC[NH3+])CC1 ZINC000423082833 387877833 /nfs/dbraw/zinc/87/78/33/387877833.db2.gz DVRZQMSPOWXMGP-HSBZDZAISA-N 2 0 242.407 2.299 20 0 BEADRP CC[C@H]([NH2+]CCC1(C)CC1)[C@@H]1CCC[NH2+]1 ZINC000423083222 387878510 /nfs/dbraw/zinc/87/85/10/387878510.db2.gz FQOPRNKHOGLDBN-RYUDHWBXSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@H]1CCCc2cccnc21 ZINC000643539328 387879714 /nfs/dbraw/zinc/87/97/14/387879714.db2.gz MYBKSWPHTPJCRB-AAEUAGOBSA-N 2 0 233.359 2.176 20 0 BEADRP CC[C@H](Cc1cccs1)[NH2+][C@H](C)[C@@H](C)[NH3+] ZINC000643539943 387880835 /nfs/dbraw/zinc/88/08/35/387880835.db2.gz YEJBDATZTGDBQM-GMTAPVOTSA-N 2 0 226.389 2.395 20 0 BEADRP C[C@@H]1C[C@@H](C)[N@H+](CCC2CC[NH2+]CC2)C1 ZINC000157893814 387881647 /nfs/dbraw/zinc/88/16/47/387881647.db2.gz MCRPDVMSLZZPJJ-VXGBXAGGSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]([NH2+][C@H]1C[C@H](c2ccccc2F)C1)C1C[NH2+]C1 ZINC000423092066 387882767 /nfs/dbraw/zinc/88/27/67/387882767.db2.gz AIHWJESRFCLVLE-GVXVVHGQSA-N 2 0 248.345 2.269 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@H]1CCCc2ccccc2C1 ZINC000643540806 387882901 /nfs/dbraw/zinc/88/29/01/387882901.db2.gz VIZJOEIYSXOWKU-CABCVRRESA-N 2 0 232.371 2.261 20 0 BEADRP Fc1ccccc1CCC[NH2+]C1CC[NH2+]CC1 ZINC000423093132 387883098 /nfs/dbraw/zinc/88/30/98/387883098.db2.gz FWWFEMPCGFJJOH-UHFFFAOYSA-N 2 0 236.334 2.100 20 0 BEADRP C[C@@H]([NH2+][C@H]1C[C@H](c2ccccc2F)C1)C1C[NH2+]C1 ZINC000423092067 387883692 /nfs/dbraw/zinc/88/36/92/387883692.db2.gz AIHWJESRFCLVLE-NQBHXWOUSA-N 2 0 248.345 2.269 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC000423095193 387885208 /nfs/dbraw/zinc/88/52/08/387885208.db2.gz LPGRFRWWFNRXKY-NXEZZACHSA-N 2 0 220.307 2.139 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CCCc1ccccc1F ZINC000423095433 387885663 /nfs/dbraw/zinc/88/56/63/387885663.db2.gz MDLLCPIJBMXXPA-VXGBXAGGSA-N 2 0 238.350 2.474 20 0 BEADRP Cc1cccc(CCC[NH2+][C@H](C)C[C@@H](C)[NH3+])n1 ZINC000423098470 387887720 /nfs/dbraw/zinc/88/77/20/387887720.db2.gz CTWFEXJYUYMZJC-DGCLKSJQSA-N 2 0 235.375 2.038 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+][C@@H]2CC[NH2+]CC[C@H]2C)C1 ZINC000423101935 387888463 /nfs/dbraw/zinc/88/84/63/387888463.db2.gz WOJZJTZIKKLENX-YIYPIFLZSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]([NH3+])[C@@H](Cc1ccccc1)[NH2+]CCCCF ZINC000423141736 387918697 /nfs/dbraw/zinc/91/86/97/387918697.db2.gz RNULSZPPQLVYBM-TZMCWYRMSA-N 2 0 238.350 2.284 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H]1CC[C@H]1C ZINC000423116158 387899370 /nfs/dbraw/zinc/89/93/70/387899370.db2.gz ZRTPHBCBTMPAGT-OLUVUFQESA-N 2 0 233.359 2.298 20 0 BEADRP CCOCC(C)(C)C[NH2+][C@@H]1CC[NH2+]CC[C@@H]1C ZINC000423121175 387900843 /nfs/dbraw/zinc/90/08/43/387900843.db2.gz IDEHMAXNKITTJC-QWHCGFSZSA-N 2 0 242.407 2.027 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]Cc1c(F)cc(F)cc1F ZINC000423126117 387905650 /nfs/dbraw/zinc/90/56/50/387905650.db2.gz ARTBWTDHUULSQW-MRVPVSSYSA-N 2 0 246.276 2.321 20 0 BEADRP CO[C@H](C)[C@@H](C)[NH2+][C@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000423125609 387905665 /nfs/dbraw/zinc/90/56/65/387905665.db2.gz AKZUMSHHSGBLFG-AAVRWANBSA-N 2 0 242.407 2.310 20 0 BEADRP C[NH+](C)C1CC[NH+](CC2CC(C)(C)C2)CC1 ZINC000528351407 387907083 /nfs/dbraw/zinc/90/70/83/387907083.db2.gz PGBSZCNYEPSNFB-UHFFFAOYSA-N 2 0 224.392 2.449 20 0 BEADRP CC(C)(CC[NH2+][C@H]1CCC[C@@H]1[NH3+])C1CC1 ZINC000423128769 387907416 /nfs/dbraw/zinc/90/74/16/387907416.db2.gz DLBJQNAHVLMXGN-RYUDHWBXSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)[C@H]([NH2+][C@@H]1CC[C@@H](C[NH3+])C1)C1CC1 ZINC000514667499 387909560 /nfs/dbraw/zinc/90/95/60/387909560.db2.gz VXRZIZQFWPYCCS-RTXFEEFZSA-N 2 0 210.365 2.138 20 0 BEADRP COCC1(C[NH2+][C@H](C)C[C@H](C)[NH3+])CCCCC1 ZINC000423134763 387911444 /nfs/dbraw/zinc/91/14/44/387911444.db2.gz FHDUTIUQXGPHAP-QWHCGFSZSA-N 2 0 242.407 2.299 20 0 BEADRP Cc1cccc2c1OC[C@H]([NH2+][C@H](C)CCC[NH3+])C2 ZINC000423133306 387911616 /nfs/dbraw/zinc/91/16/16/387911616.db2.gz CUFQCYWMCIIBJJ-TZMCWYRMSA-N 2 0 248.370 2.016 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CCCC1(C)C)C1C[NH2+]C1 ZINC000423135908 387913843 /nfs/dbraw/zinc/91/38/43/387913843.db2.gz OOWYJNXGPSXSFC-PWSUYJOCSA-N 2 0 210.365 2.010 20 0 BEADRP CC[C@H]1CC[C@H]([NH2+][C@@H]2CCC[C@H]2[NH3+])CC1 ZINC000423137675 387914633 /nfs/dbraw/zinc/91/46/33/387914633.db2.gz WTXPNXIDXJDJRV-FDYHWXHSSA-N 2 0 210.365 2.425 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CCCCC1(F)F ZINC000423150834 387929522 /nfs/dbraw/zinc/92/95/22/387929522.db2.gz ZHTWFQRVULGLNG-MXWKQRLJSA-N 2 0 232.318 2.281 20 0 BEADRP CC(C)[C@@H]1C[C@H]1C[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000423150953 387929856 /nfs/dbraw/zinc/92/98/56/387929856.db2.gz JJFXBMXTNMIBLP-MWWBDVBNSA-N 2 0 222.376 2.151 20 0 BEADRP Cc1cccnc1CCC[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000423151930 387930230 /nfs/dbraw/zinc/93/02/30/387930230.db2.gz KWJHBJWTSQHKAK-STQMWFEESA-N 2 0 235.375 2.038 20 0 BEADRP CC/C=C/C[NH2+][C@H](C)c1ccc(C[NH3+])nc1C ZINC000423152191 387930614 /nfs/dbraw/zinc/93/06/14/387930614.db2.gz DXTNKMUTDPPGFP-MVIFTORASA-N 2 0 233.359 2.466 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+][C@H]1CC[NH2+]CC[C@@H]1C ZINC000423152704 387931999 /nfs/dbraw/zinc/93/19/99/387931999.db2.gz MAOPHLLJZFBCHV-RNJOBUHISA-N 2 0 210.365 2.010 20 0 BEADRP FC1(F)CCC[C@H]1C[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000423153916 387932379 /nfs/dbraw/zinc/93/23/79/387932379.db2.gz OCIQJMLLDYWSHA-WSMDXJOWSA-N 2 0 244.329 2.294 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CCCC(C)(C)C1)C1C[NH2+]C1 ZINC000423157873 387935948 /nfs/dbraw/zinc/93/59/48/387935948.db2.gz BTKCKWBMIWQKOV-VXGBXAGGSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]C[C@H]1CCCC1(F)F ZINC000423156385 387936582 /nfs/dbraw/zinc/93/65/82/387936582.db2.gz SILLMZKOBQILJP-UTUOFQBUSA-N 2 0 246.345 2.400 20 0 BEADRP Cc1csc(C[NH2+][C@@H](C)C[C@H](C)[NH3+])c1 ZINC000423156940 387936870 /nfs/dbraw/zinc/93/68/70/387936870.db2.gz UPFUWTXGICGBLE-UWVGGRQHSA-N 2 0 212.362 2.272 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]C[C@H]1CSc2ccccc21 ZINC000423142905 387920393 /nfs/dbraw/zinc/92/03/93/387920393.db2.gz BPHRLAIRYCANDY-CYZMBNFOSA-N 2 0 248.395 2.345 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@H]2CC=CCC2)CC[N@@H+]1C ZINC000156121120 387920509 /nfs/dbraw/zinc/92/05/09/387920509.db2.gz MZSIJNWCHHIZIM-HZSPNIEDSA-N 2 0 222.376 2.415 20 0 BEADRP Cc1cccc2c1OC[C@H]([NH2+][C@@H](C)C[C@H](C)[NH3+])C2 ZINC000423144412 387921534 /nfs/dbraw/zinc/92/15/34/387921534.db2.gz YWIZXVORNITQEH-SGMGOOAPSA-N 2 0 248.370 2.014 20 0 BEADRP CC[C@@H]([NH2+][C@H](C)CCCC[NH3+])C(F)F ZINC000423146000 387922204 /nfs/dbraw/zinc/92/22/04/387922204.db2.gz NKKYCAAHYFAZFO-RKDXNWHRSA-N 2 0 208.296 2.137 20 0 BEADRP CC1(F)CC([NH2+][C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)C1 ZINC000423146255 387923076 /nfs/dbraw/zinc/92/30/76/387923076.db2.gz OWEBHPSCFNDBDV-XLICRZQSSA-N 2 0 240.366 2.387 20 0 BEADRP CC1(F)CC([NH2+][C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)C1 ZINC000423146253 387923316 /nfs/dbraw/zinc/92/33/16/387923316.db2.gz OWEBHPSCFNDBDV-DEULPLRUSA-N 2 0 240.366 2.387 20 0 BEADRP Cc1cccnc1CCC[NH2+][C@@H](C)[C@H]1CCC[NH2+]1 ZINC000423147084 387924438 /nfs/dbraw/zinc/92/44/38/387924438.db2.gz CBRIDKZPZXXSEM-DZGCQCFKSA-N 2 0 247.386 2.053 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+]CCCC(C)(F)F ZINC000423147499 387925089 /nfs/dbraw/zinc/92/50/89/387925089.db2.gz SGXCKAVDFKJWLV-QWRGUYRKSA-N 2 0 234.334 2.400 20 0 BEADRP CC[C@H]([NH2+]CCC[NH+]1CCCC1)[C@@H]1C[C@@H]1C ZINC000321169715 387951988 /nfs/dbraw/zinc/95/19/88/387951988.db2.gz YIDSGSWUGBDKKV-MJBXVCDLSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)C[C@@H]1C[C@H]1[NH2+][C@H](C)[C@H]1CCC[NH2+]1 ZINC000423167752 387952097 /nfs/dbraw/zinc/95/20/97/387952097.db2.gz FUKSZYKCTHTFNF-FDYHWXHSSA-N 2 0 210.365 2.151 20 0 BEADRP C[C@@H]([NH2+]C1CCC(C[NH3+])CC1)C(C)(F)F ZINC000423158631 387939332 /nfs/dbraw/zinc/93/93/32/387939332.db2.gz OJPHLWAWLPXIAK-XNWIYYODSA-N 2 0 220.307 2.137 20 0 BEADRP C[C@H]([NH2+]CC1(C2CCC2)CCC1)C1C[NH2+]C1 ZINC000423159077 387940018 /nfs/dbraw/zinc/94/00/18/387940018.db2.gz FFJFNSSHRDKXCW-NSHDSACASA-N 2 0 222.376 2.154 20 0 BEADRP CC[C@@H]1CCCC[C@H]1C[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000423160375 387942117 /nfs/dbraw/zinc/94/21/17/387942117.db2.gz QRYRLCZNIMGSNO-XQQFMLRXSA-N 2 0 224.392 2.400 20 0 BEADRP CCn1cc([C@H](C)[NH2+][C@H](C)CCCC[NH3+])cn1 ZINC000423162500 387943151 /nfs/dbraw/zinc/94/31/51/387943151.db2.gz PPMHODCNCUAHNF-NEPJUHHUSA-N 2 0 238.379 2.071 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]CCC[C@@H]1CCOC1 ZINC000423161059 387943273 /nfs/dbraw/zinc/94/32/73/387943273.db2.gz NDNMFXBYWUUMLM-MGPQQGTHSA-N 2 0 240.391 2.053 20 0 BEADRP CC[C@@]1(C(C)C)C[C@H]1[NH2+]C1CC[NH2+]CC1 ZINC000423162125 387944472 /nfs/dbraw/zinc/94/44/72/387944472.db2.gz KNFSGTQRJQWPHD-OLZOCXBDSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)[C@H]1C[C@H]1C ZINC000321098379 387946871 /nfs/dbraw/zinc/94/68/71/387946871.db2.gz ONXSTUJIIKINSD-BYNQJWBRSA-N 2 0 222.376 2.105 20 0 BEADRP CC[C@H]([NH2+]CC1CC[NH+](C)CC1)[C@H]1C[C@@H]1C ZINC000321096237 387946948 /nfs/dbraw/zinc/94/69/48/387946948.db2.gz ODMMUELXAMYRND-UBHSHLNASA-N 2 0 224.392 2.352 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)[C@H]1C[C@@H]1C ZINC000321097754 387947290 /nfs/dbraw/zinc/94/72/90/387947290.db2.gz OKQWFHGOOLBSSH-JURCDPSOSA-N 2 0 236.403 2.495 20 0 BEADRP CC[N@H+](C)C[C@H]1CC[NH+]([C@@H]2C=CCCC2)C1 ZINC000245466132 387947669 /nfs/dbraw/zinc/94/76/69/387947669.db2.gz YVCXIVFZSRNSGZ-ZIAGYGMSSA-N 2 0 222.376 2.369 20 0 BEADRP COCCC[C@H](C)[NH2+]CC1([NH3+])CCCCC1 ZINC000423176085 387961161 /nfs/dbraw/zinc/96/11/61/387961161.db2.gz FZRICZHINDJYKV-LBPRGKRZSA-N 2 0 228.380 2.053 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCC[C@@H]1[NH3+])CC(F)(F)F ZINC000423175256 387961598 /nfs/dbraw/zinc/96/15/98/387961598.db2.gz DNTZOEWUBHUZGD-XHNCKOQMSA-N 2 0 224.270 2.044 20 0 BEADRP CCC[C@H]([NH2+]C1CC[NH2+]CC1)c1cccnc1 ZINC000423179628 387965715 /nfs/dbraw/zinc/96/57/15/387965715.db2.gz HQGSKPUCJMRNNT-AWEZNQCLSA-N 2 0 233.359 2.264 20 0 BEADRP Cc1ccc2c(c1)[C@@H]([NH2+]CCC[NH3+])[C@@H](C)C2 ZINC000423179951 387966566 /nfs/dbraw/zinc/96/65/66/387966566.db2.gz DOUCHXGZAQTHSF-FZMZJTMJSA-N 2 0 218.344 2.167 20 0 BEADRP C[C@@H](Cc1coc2ccccc12)[NH2+]CCC[NH3+] ZINC000423187625 387972324 /nfs/dbraw/zinc/97/23/24/387972324.db2.gz KXVWTXHXBOCETO-NSHDSACASA-N 2 0 232.327 2.302 20 0 BEADRP CC[C@@H]([NH2+]C1CC[NH2+]CC1)c1cccc(OC)c1 ZINC000423186402 387970955 /nfs/dbraw/zinc/97/09/55/387970955.db2.gz NYNXTVJBLFXMNZ-OAHLLOKOSA-N 2 0 248.370 2.488 20 0 BEADRP C[NH2+]CCC[NH2+]C1C2CC3CC(C2)CC1C3 ZINC000423186653 387970970 /nfs/dbraw/zinc/97/09/70/387970970.db2.gz LLDQUQGUVUDUCH-UHFFFAOYSA-N 2 0 222.376 2.010 20 0 BEADRP C[NH2+]CCC[NH2+][C@H]1CCCc2ccccc21 ZINC000423187822 387971034 /nfs/dbraw/zinc/97/10/34/387971034.db2.gz MXZAUQIBTDZPMD-AWEZNQCLSA-N 2 0 218.344 2.263 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1C[C@H]1C1CC1)[C@H]1CCCC[NH2+]1 ZINC000423170277 387956890 /nfs/dbraw/zinc/95/68/90/387956890.db2.gz XQYZSSYQQLKKCP-VZZFWQQMSA-N 2 0 222.376 2.153 20 0 BEADRP [NH3+][C@H]1CCCCC[C@@H]1[NH2+]C[C@@H]1C[C@H]1C1CC1 ZINC000423170959 387956976 /nfs/dbraw/zinc/95/69/76/387956976.db2.gz ZCDNVKUFHBDXEZ-XUXIUFHCSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@@H]1CCc2c(F)cccc2[C@@H]1[NH2+]CCC[NH3+] ZINC000423195176 387979585 /nfs/dbraw/zinc/97/95/85/387979585.db2.gz SKUWTLKKTSHRIH-QMTHXVAHSA-N 2 0 236.334 2.388 20 0 BEADRP C[C@@H]1CCc2c(F)cccc2[C@H]1[NH2+]CCC[NH3+] ZINC000423195177 387979590 /nfs/dbraw/zinc/97/95/90/387979590.db2.gz SKUWTLKKTSHRIH-YGRLFVJLSA-N 2 0 236.334 2.388 20 0 BEADRP CC[C@H]([NH2+]CCC[NH3+])c1cccc(OC)c1 ZINC000423196018 387981214 /nfs/dbraw/zinc/98/12/14/387981214.db2.gz UHZGTQLKENWQQA-ZDUSSCGKSA-N 2 0 222.332 2.085 20 0 BEADRP C[C@H]([NH2+]CCC[NH3+])C1CCC(F)(F)CC1 ZINC000423196772 387981467 /nfs/dbraw/zinc/98/14/67/387981467.db2.gz WELYDCBNAAKOCY-VIFPVBQESA-N 2 0 220.307 2.139 20 0 BEADRP FCCC[C@@H]1CCC[C@@H]1[NH2+]C1CC[NH2+]CC1 ZINC000423189743 387972805 /nfs/dbraw/zinc/97/28/05/387972805.db2.gz RJDJLUBKTACGKL-AAEUAGOBSA-N 2 0 228.355 2.246 20 0 BEADRP C[NH+](C)CCC[NH2+][C@@H](C1CC1)C1CCCC1 ZINC000453059930 387972945 /nfs/dbraw/zinc/97/29/45/387972945.db2.gz QUIZIQXEESWCKC-CQSZACIVSA-N 2 0 224.392 2.497 20 0 BEADRP FCCC[C@H]1CCC[C@H]1[NH2+]C1CC[NH2+]CC1 ZINC000423189744 387973067 /nfs/dbraw/zinc/97/30/67/387973067.db2.gz RJDJLUBKTACGKL-DGCLKSJQSA-N 2 0 228.355 2.246 20 0 BEADRP C[NH+](C)CCC[NH2+][C@H](C1CC1)C1CCCC1 ZINC000453059923 387973627 /nfs/dbraw/zinc/97/36/27/387973627.db2.gz QUIZIQXEESWCKC-AWEZNQCLSA-N 2 0 224.392 2.497 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](C2CC2)C2CCC2)C1 ZINC000453068861 387977879 /nfs/dbraw/zinc/97/78/79/387977879.db2.gz TVYMFRFXPSYVCW-WFASDCNBSA-N 2 0 236.403 2.497 20 0 BEADRP CCCC[C@H](C)[C@H](C)[NH2+]CCC[NH2+]C ZINC000423201439 387987539 /nfs/dbraw/zinc/98/75/39/387987539.db2.gz ORJRCERJMKJQOX-RYUDHWBXSA-N 2 0 200.370 2.400 20 0 BEADRP C[NH2+]CCC[NH2+][C@H]1CCCNc2ccccc21 ZINC000423201469 387987650 /nfs/dbraw/zinc/98/76/50/387987650.db2.gz OVCJMJHLVHYYTF-AWEZNQCLSA-N 2 0 233.359 2.133 20 0 BEADRP CC[C@@H]1CC[C@@H](C)C[C@H]1[NH2+]CCC[NH2+]C ZINC000423201624 387988334 /nfs/dbraw/zinc/98/83/34/387988334.db2.gz PFNCVMVJSMDBDX-JHJVBQTASA-N 2 0 212.381 2.400 20 0 BEADRP CC[C@H](C)C[N@H+](CC)[C@H]1CCC[NH2+]CC1 ZINC000251798060 135078305 /nfs/dbraw/zinc/07/83/05/135078305.db2.gz KHIXURKDGLDEJI-STQMWFEESA-N 2 0 212.381 2.497 20 0 BEADRP C[NH2+]CCC[NH2+][C@H]1CCCc2cc(F)ccc21 ZINC000423203280 387989632 /nfs/dbraw/zinc/98/96/32/387989632.db2.gz SGZSZCBOFDZWLT-AWEZNQCLSA-N 2 0 236.334 2.402 20 0 BEADRP CC(C)(C)[C@@H]1CC[C@@H]1[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000423208367 387992863 /nfs/dbraw/zinc/99/28/63/387992863.db2.gz HTRPWSVCKICAHC-XQQFMLRXSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+][C@@H]1C[C@H]1C1CCC1 ZINC000424369727 387993569 /nfs/dbraw/zinc/99/35/69/387993569.db2.gz CFXQFNJODNOIHF-DOERSZECSA-N 2 0 222.376 2.153 20 0 BEADRP CC[C@@H]([NH2+]CCC[NH3+])c1cccc(OC)c1 ZINC000423196017 387982244 /nfs/dbraw/zinc/98/22/44/387982244.db2.gz UHZGTQLKENWQQA-CYBMUJFWSA-N 2 0 222.332 2.085 20 0 BEADRP C[NH2+]CCC[NH2+][C@H](C)c1ccccc1N(C)C ZINC000423197848 387984830 /nfs/dbraw/zinc/98/48/30/387984830.db2.gz BMEBRSDCTWSWGI-GFCCVEGCSA-N 2 0 235.375 2.013 20 0 BEADRP CCC[C@@H](C)[C@@H](CC)[NH2+]CCC[NH2+]C ZINC000423199119 387985991 /nfs/dbraw/zinc/98/59/91/387985991.db2.gz JCLPXYJJCYKJJV-VXGBXAGGSA-N 2 0 200.370 2.400 20 0 BEADRP CCCCO[C@@H]1C[C@H]([NH2+]CCC[NH2+]C)C1(C)C ZINC000423200345 387986048 /nfs/dbraw/zinc/98/60/48/387986048.db2.gz LXVJLUUHBZJCRI-QWHCGFSZSA-N 2 0 242.407 2.169 20 0 BEADRP C[NH2+]CCC[NH2+][C@H](CCC(C)C)C1CC1 ZINC000423200397 387986380 /nfs/dbraw/zinc/98/63/80/387986380.db2.gz MDVAJUKAVDMYQJ-CYBMUJFWSA-N 2 0 212.381 2.400 20 0 BEADRP CC[C@H]([NH2+][C@@H](C)[C@H]1CCC[NH2+]C1)C1CC1 ZINC000423215281 387997352 /nfs/dbraw/zinc/99/73/52/387997352.db2.gz MVYLCEYVQKNHOP-DRZSPHRISA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@H]([NH2+][C@H](C)[C@@H]1CCC[NH2+]C1)[C@@H]1C[C@H]1C ZINC000423215937 387997680 /nfs/dbraw/zinc/99/76/80/387997680.db2.gz NUWIJEVQRSGBFO-KSTCHIGDSA-N 2 0 224.392 2.399 20 0 BEADRP Cc1cncc([C@@H](C)[NH2+]C[C@@H]2CCC[NH2+]C2)c1 ZINC000423214043 387998403 /nfs/dbraw/zinc/99/84/03/387998403.db2.gz OFPGYPRJHZNAOL-CHWSQXEVSA-N 2 0 233.359 2.040 20 0 BEADRP CC[C@H]([NH2+][C@H](C)[C@@H]1CCC[NH2+]C1)[C@@H]1C[C@@H]1C ZINC000423215939 387998413 /nfs/dbraw/zinc/99/84/13/387998413.db2.gz NUWIJEVQRSGBFO-MRTXSQPYSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H]1C[C@H]1C1CCC1 ZINC000424375369 387998447 /nfs/dbraw/zinc/99/84/47/387998447.db2.gz MYEWDDQAYCZNOI-WCFLWFBJSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+][C@@H]1C[C@H]1C1CCC1 ZINC000424376124 387998939 /nfs/dbraw/zinc/99/89/39/387998939.db2.gz OORBRKTULWOGIW-RFQIPJPRSA-N 2 0 222.376 2.425 20 0 BEADRP CC(C)CC[C@@H]([NH2+][C@@H]1CC[NH2+]C1)C1CC1 ZINC000423216996 387998932 /nfs/dbraw/zinc/99/89/32/387998932.db2.gz RCAGKLJZFRCENM-CHWSQXEVSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[NH2+]C1)c1ccncc1 ZINC000423220188 388000633 /nfs/dbraw/zinc/00/06/33/388000633.db2.gz UYFYASNZVJJZNU-OBJOEFQTSA-N 2 0 233.359 2.120 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1C[C@H]1C1CCC1)[C@H]1CCC[NH2+]1 ZINC000424382584 388000726 /nfs/dbraw/zinc/00/07/26/388000726.db2.gz SFNKNGPBJLGTCI-DOERSZECSA-N 2 0 222.376 2.153 20 0 BEADRP CC[C@H]([NH2+]C[C@H]1CCC[NH2+]C1)c1ccncc1 ZINC000423217705 388000746 /nfs/dbraw/zinc/00/07/46/388000746.db2.gz UJWBRUNOEVQGKW-JSGCOSHPSA-N 2 0 233.359 2.122 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]C[C@@H]1C[C@H]1C1CCC1 ZINC000424385522 388000967 /nfs/dbraw/zinc/00/09/67/388000967.db2.gz WHFFNUWQYBYFEG-WXHSDQCUSA-N 2 0 210.365 2.140 20 0 BEADRP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1)c1ccncc1 ZINC000423220191 388001192 /nfs/dbraw/zinc/00/11/92/388001192.db2.gz UYFYASNZVJJZNU-SGMGOOAPSA-N 2 0 233.359 2.120 20 0 BEADRP C[C@H]([NH3+])[C@@H](Cc1ccccc1)[NH2+][C@@H]1C[C@H]2C[C@H]2C1 ZINC000424382323 388001238 /nfs/dbraw/zinc/00/12/38/388001238.db2.gz SAWYKKOVCTVRMP-HVQZGBDUSA-N 2 0 244.382 2.333 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]C[C@@H]1C[C@H]1C1CCC1 ZINC000424385521 388001347 /nfs/dbraw/zinc/00/13/47/388001347.db2.gz WHFFNUWQYBYFEG-DRZSPHRISA-N 2 0 210.365 2.140 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1C[C@H]1C1CCC1)[C@@H]1CCC[NH2+]1 ZINC000424382588 388001848 /nfs/dbraw/zinc/00/18/48/388001848.db2.gz SFNKNGPBJLGTCI-SAXRGWBVSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC12CCC2)[C@H]1CCC[NH2+]C1 ZINC000423221093 388001901 /nfs/dbraw/zinc/00/19/01/388001901.db2.gz WFNAUWOCNFVBDM-AVGNSLFASA-N 2 0 222.376 2.297 20 0 BEADRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]C[C@@H]1C[C@H]1C1CCC1 ZINC000424382236 388001978 /nfs/dbraw/zinc/00/19/78/388001978.db2.gz RXIWRTXCSBYYOH-ZOBORPQBSA-N 2 0 222.376 2.140 20 0 BEADRP CC[N@@H+]1C[C@@H](C)[C@H](Nc2ccc3c(c2)CCN3)C1 ZINC000423222101 388002577 /nfs/dbraw/zinc/00/25/77/388002577.db2.gz ZRVRZFMNICRMQJ-IAQYHMDHSA-N 2 0 245.370 2.407 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@H]1CCC[C@H](c2cccnc2)C1 ZINC000423222635 388003838 /nfs/dbraw/zinc/00/38/38/388003838.db2.gz BXQZYKYFDAJPDR-YDHLFZDLSA-N 2 0 247.386 2.435 20 0 BEADRP CC[C@H]([NH2+]CC1=CC[N@H+](C)CC1)c1ccncc1 ZINC000453182893 388004295 /nfs/dbraw/zinc/00/42/95/388004295.db2.gz SRHPFTUUMXCDGC-HNNXBMFYSA-N 2 0 245.370 2.384 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@H]1CCC[C@@H](c2cccnc2)C1 ZINC000423222632 388004383 /nfs/dbraw/zinc/00/43/83/388004383.db2.gz BXQZYKYFDAJPDR-GUTXKFCHSA-N 2 0 247.386 2.435 20 0 BEADRP Cc1cccc2c1CC[C@@H]2[NH2+]CC[C@H](C)[NH3+] ZINC000423223413 388005835 /nfs/dbraw/zinc/00/58/35/388005835.db2.gz GJZZWAJRBRAWQS-FZMZJTMJSA-N 2 0 218.344 2.309 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H](C)c1ccc(F)c(F)c1 ZINC000423224558 388006062 /nfs/dbraw/zinc/00/60/62/388006062.db2.gz CLVGCFVFESTQHY-IUCAKERBSA-N 2 0 228.286 2.353 20 0 BEADRP FCCC[C@@H]1CCC[C@H]1[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000423241592 388023763 /nfs/dbraw/zinc/02/37/63/388023763.db2.gz DIKAIMKNCXBSCC-HZSPNIEDSA-N 2 0 242.382 2.494 20 0 BEADRP Cc1nc([C@@H](C)[NH2+]CC[C@H]2CC[NH2+]C2)cs1 ZINC000423240725 388023901 /nfs/dbraw/zinc/02/39/01/388023901.db2.gz CRDWUFCCAZXSQE-MWLCHTKSSA-N 2 0 239.388 2.102 20 0 BEADRP CO[C@H](c1ccccc1)[C@@H](C)[NH2+]CC[C@H](C)[NH3+] ZINC000423227205 388011350 /nfs/dbraw/zinc/01/13/50/388011350.db2.gz UVNZJBCRKUMVQD-SCRDCRAPSA-N 2 0 236.359 2.090 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@H]1CCCC12CCCC2 ZINC000423228026 388013788 /nfs/dbraw/zinc/01/37/88/388013788.db2.gz XXXVTZZCIUVHID-RYUDHWBXSA-N 2 0 210.365 2.426 20 0 BEADRP CCOC[C@H]1CCC[C@H]1[NH2+]C1CCC([NH3+])CC1 ZINC000423233762 388018948 /nfs/dbraw/zinc/01/89/48/388018948.db2.gz OQXMWGDDRWPGAW-BLYZHGLHSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H](CC(C)(C)C)[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000423238389 388023109 /nfs/dbraw/zinc/02/31/09/388023109.db2.gz ACZVINVNVPZTIO-NWDGAFQWSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H]1CCC[C@H](C)[C@H]1[NH2+]C[C@@H]1CCC[NH2+]1 ZINC000423239575 388023192 /nfs/dbraw/zinc/02/31/92/388023192.db2.gz SHILLKFPUJWPMD-QNWHQSFQSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)(C)[C@@H]1CC[C@H]1[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000423249694 388032115 /nfs/dbraw/zinc/03/21/15/388032115.db2.gz PKWHXURPXJHPMG-YNEHKIRRSA-N 2 0 224.392 2.400 20 0 BEADRP C[N@@H+]1CCCC[C@H]1CC[NH+]1C2CCC1CC2 ZINC000533237355 388033993 /nfs/dbraw/zinc/03/39/93/388033993.db2.gz QTNBTJPCXIYXFK-HSBZDZAISA-N 2 0 222.376 2.488 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@@H]([NH2+]CC[C@@H]2CC[NH2+]C2)C1 ZINC000423252071 388034221 /nfs/dbraw/zinc/03/42/21/388034221.db2.gz TULHNNKOBXLWIT-RFGFWPKPSA-N 2 0 224.392 2.400 20 0 BEADRP CC(C)C1CC([NH2+]CC[C@@H]2CC[NH2+]C2)C1 ZINC000423253571 388034804 /nfs/dbraw/zinc/03/48/04/388034804.db2.gz WFHWKTJYVDSUCZ-HIFPTAJRSA-N 2 0 210.365 2.010 20 0 BEADRP CC[C@@H]([NH2+]CC[C@@H]1CC[NH2+]C1)C1CCC1 ZINC000423254354 388035125 /nfs/dbraw/zinc/03/51/25/388035125.db2.gz XTAYSXIFAJEFCZ-WCQYABFASA-N 2 0 210.365 2.154 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H]1CCc2c1cccc2OC ZINC000423256424 388037343 /nfs/dbraw/zinc/03/73/43/388037343.db2.gz BXKWSHQMMGQBAD-BXUZGUMPSA-N 2 0 248.370 2.128 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CCC[NH2+]C1)c1cccc(O)c1 ZINC000423262073 388039826 /nfs/dbraw/zinc/03/98/26/388039826.db2.gz UFIFDLUSJGINLH-CHWSQXEVSA-N 2 0 248.370 2.433 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)C(C)(C)C ZINC000423261917 388039847 /nfs/dbraw/zinc/03/98/47/388039847.db2.gz TYAZJGGPCBPWBW-RYUDHWBXSA-N 2 0 212.381 2.400 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CCC12CCCC2 ZINC000423266129 388044674 /nfs/dbraw/zinc/04/46/74/388044674.db2.gz CWQPXDZAIASFHS-NWDGAFQWSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCC[NH2+]C1)c1ccncc1 ZINC000423262282 388040879 /nfs/dbraw/zinc/04/08/79/388040879.db2.gz UXLDJUJEJIWGJF-QWHCGFSZSA-N 2 0 233.359 2.122 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@H]1CC[C@@H]1C(C)(C)C ZINC000423264883 388042038 /nfs/dbraw/zinc/04/20/38/388042038.db2.gz CLFHWHRVRQCFED-TUAOUCFPSA-N 2 0 212.381 2.384 20 0 BEADRP CC(C)O[C@@H]1C[C@H]([NH2+]C[C@@H]([NH3+])C(C)C)C1(C)C ZINC000423263342 388042924 /nfs/dbraw/zinc/04/29/24/388042924.db2.gz AZMOFQPZXHWVTA-FRRDWIJNSA-N 2 0 242.407 2.151 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000423243541 388026338 /nfs/dbraw/zinc/02/63/38/388026338.db2.gz GLWJSLUVFVYBBL-STQMWFEESA-N 2 0 233.359 2.040 20 0 BEADRP FCCC[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1CCC[NH2+]1 ZINC000423245960 388028578 /nfs/dbraw/zinc/02/85/78/388028578.db2.gz YZJSTHJMJJBSPV-RWMBFGLXSA-N 2 0 228.355 2.246 20 0 BEADRP Cc1ccnc([C@H](C)[NH2+]CC[C@@H]2CC[NH2+]C2)c1 ZINC000423247269 388030815 /nfs/dbraw/zinc/03/08/15/388030815.db2.gz KYBWZXBNXYKPEO-STQMWFEESA-N 2 0 233.359 2.040 20 0 BEADRP C(C[C@@H]1CC[NH2+]C1)[NH2+]C1CCC2(CC2)CC1 ZINC000423249532 388032012 /nfs/dbraw/zinc/03/20/12/388032012.db2.gz ORTOSVMTADXVIS-LBPRGKRZSA-N 2 0 222.376 2.298 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H]1CC(C)(C)C[C@H]1C ZINC000423273275 388053340 /nfs/dbraw/zinc/05/33/40/388053340.db2.gz KNOLHKKIHJPQJX-TUAOUCFPSA-N 2 0 212.381 2.256 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H](C)c1cccc(F)c1 ZINC000423274644 388055775 /nfs/dbraw/zinc/05/57/75/388055775.db2.gz MHAQTOYKKYWKQQ-GHMZBOCLSA-N 2 0 224.323 2.332 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H](C)c1cccs1 ZINC000423275161 388056308 /nfs/dbraw/zinc/05/63/08/388056308.db2.gz MPYRJNVOOCGUMJ-ZJUUUORDSA-N 2 0 212.362 2.254 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]C1CCc2ccccc2CC1 ZINC000423277287 388058865 /nfs/dbraw/zinc/05/88/65/388058865.db2.gz PQCVPESGSMROGA-ZDUSSCGKSA-N 2 0 246.398 2.379 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H]1CCCC12CCC2 ZINC000423278848 388060410 /nfs/dbraw/zinc/06/04/10/388060410.db2.gz RRVRPTFNQCKTRO-RYUDHWBXSA-N 2 0 210.365 2.154 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000423279403 388060547 /nfs/dbraw/zinc/06/05/47/388060547.db2.gz SJTPNYRPNRQNKX-UPJWGTAASA-N 2 0 210.365 2.154 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H]1CC[C@H]1C1CCC1 ZINC000423280611 388062255 /nfs/dbraw/zinc/06/22/55/388062255.db2.gz UXMUPOCNCWJEAM-DRZSPHRISA-N 2 0 210.365 2.010 20 0 BEADRP CCC([NH3+])(CC)C[NH2+][C@H]1CCC12CCC2 ZINC000423281239 388063459 /nfs/dbraw/zinc/06/34/59/388063459.db2.gz BAFAAXVUGPLKPT-NSHDSACASA-N 2 0 210.365 2.426 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]C[C@@H]1C[C@H]1C1CC1 ZINC000453382602 388065764 /nfs/dbraw/zinc/06/57/64/388065764.db2.gz ZGAWKLKUJCFQBH-VJFWYMLFSA-N 2 0 236.403 2.351 20 0 BEADRP CCOC[C@H]1CCC[C@@H]1[NH2+]CC([NH3+])(CC)CC ZINC000423283874 388066962 /nfs/dbraw/zinc/06/69/62/388066962.db2.gz FSSSKUXRIHJAOT-OLZOCXBDSA-N 2 0 242.407 2.299 20 0 BEADRP CCc1ccc(C[N@@H+]2CC[C@@]3(CC[NH2+]C3)C2)cc1 ZINC000084072925 388070093 /nfs/dbraw/zinc/07/00/93/388070093.db2.gz RPBABASJPCHYJY-MRXNPFEDSA-N 2 0 244.382 2.434 20 0 BEADRP C[C@H]1CC[C@H](C)[N@H+](CCC2CC[NH2+]CC2)C1 ZINC000084048323 388070151 /nfs/dbraw/zinc/07/01/51/388070151.db2.gz OKOUGHNLHWSCFE-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)([NH3+])C[NH2+][C@@H]1CCC[C@@H](c2cccnc2)C1 ZINC000423287676 388073616 /nfs/dbraw/zinc/07/36/16/388073616.db2.gz NVAAYUCKNMYPAY-TZMCWYRMSA-N 2 0 247.386 2.435 20 0 BEADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@H](C)CCCC[NH3+])cc1 ZINC000423290711 388074198 /nfs/dbraw/zinc/07/41/98/388074198.db2.gz FDHKYNDYBYMOGS-CHWSQXEVSA-N 3 0 249.402 2.313 20 0 BEADRP CCO[C@@H]1C[C@@H]([NH2+]CC(C)(C)[NH3+])C12CCCC2 ZINC000423289596 388074364 /nfs/dbraw/zinc/07/43/64/388074364.db2.gz XUQKDOFLRKUHPN-VXGBXAGGSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)[C@H]1CCOC1 ZINC000423292778 388075862 /nfs/dbraw/zinc/07/58/62/388075862.db2.gz OJOAYWXUFSZLET-ZOWXZIJZSA-N 2 0 248.370 2.221 20 0 BEADRP CCOc1ccccc1[C@@H](C)[NH2+]C[C@H](C)C[NH3+] ZINC000423294056 388076038 /nfs/dbraw/zinc/07/60/38/388076038.db2.gz BCAFETOABXVAMG-VXGBXAGGSA-N 2 0 236.359 2.331 20 0 BEADRP C[C@@H]1CCC[C@H](C[NH+]2CCC(C[NH3+])CC2)C1 ZINC000084344470 388076881 /nfs/dbraw/zinc/07/68/81/388076881.db2.gz JXMQOBJKNWUKKV-OCCSQVGLSA-N 2 0 224.392 2.483 20 0 BEADRP CCc1ccc(C[NH2+]C2CC[NH2+]CC2)cc1 ZINC000084487057 388079149 /nfs/dbraw/zinc/07/91/49/388079149.db2.gz KNCCDIJULWENCY-UHFFFAOYSA-N 2 0 218.344 2.091 20 0 BEADRP Cc1ccsc1[C@@H](C)[NH2+]C[C@H](C)C[NH3+] ZINC000423298117 388079936 /nfs/dbraw/zinc/07/99/36/388079936.db2.gz NEYUSWNWBPGUGI-PSASIEDQSA-N 2 0 212.362 2.302 20 0 BEADRP CC[C@H]([NH2+]C[C@H](C)C[NH3+])c1cccc(OC)c1 ZINC000423297490 388080236 /nfs/dbraw/zinc/08/02/36/388080236.db2.gz KNBIJURYJRTRNM-RISCZKNCSA-N 2 0 236.359 2.331 20 0 BEADRP CCC[C@@H]([NH2+]C[C@@H](C)C[NH3+])c1cccnc1 ZINC000423298432 388080301 /nfs/dbraw/zinc/08/03/01/388080301.db2.gz AACGURXOQKDCDV-WCQYABFASA-N 2 0 221.348 2.107 20 0 BEADRP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]CCC1CC(F)(F)C1 ZINC000453432676 388082009 /nfs/dbraw/zinc/08/20/09/388082009.db2.gz SBRCTWXFJFAMAX-JQWIXIFHSA-N 2 0 246.345 2.352 20 0 BEADRP CCO[C@@H]1C[C@@H]([NH2+][C@@H](C)CC[NH+](C)C)C1(C)C ZINC000085397922 388087614 /nfs/dbraw/zinc/08/76/14/388087614.db2.gz XBEJJXFMNBEPLX-YNEHKIRRSA-N 2 0 242.407 2.120 20 0 BEADRP C[C@@H]1C[C@H]1C[NH2+]CCCC[N@H+](C)C1CC1 ZINC000453593806 388088099 /nfs/dbraw/zinc/08/80/99/388088099.db2.gz HSZOLIWMWXNPRL-NEPJUHHUSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]1C[C@H]1C[NH2+]CCCC[N@H+](C)C1CC1 ZINC000453593808 388088998 /nfs/dbraw/zinc/08/89/98/388088998.db2.gz HSZOLIWMWXNPRL-RYUDHWBXSA-N 2 0 210.365 2.106 20 0 BEADRP C[N@H+](CCCC[NH2+]Cc1cccc(O)c1)C1CC1 ZINC000453606106 388090903 /nfs/dbraw/zinc/09/09/03/388090903.db2.gz UQIJNVJUMMYOTK-UHFFFAOYSA-N 2 0 248.370 2.356 20 0 BEADRP C[C@@H](C1CC1)[N@H+](CC1CC[NH2+]CC1)C1CC1 ZINC000086702091 388106396 /nfs/dbraw/zinc/10/63/96/388106396.db2.gz AFNZHKSFAWKEKD-NSHDSACASA-N 2 0 222.376 2.249 20 0 BEADRP CC(C)[N@H+](CC1CCC1)CC1CC[NH2+]CC1 ZINC000086703451 388106900 /nfs/dbraw/zinc/10/69/00/388106900.db2.gz HFAKGVYNTGEMLQ-UHFFFAOYSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H](CCN[C@@H]1CC[NH2+]C1)c1ccccc1 ZINC000086729951 388108406 /nfs/dbraw/zinc/10/84/06/388108406.db2.gz BCXJVEYGINOXNH-TZMCWYRMSA-N 2 0 218.344 2.132 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H]1C[C@@H](OC(C)C)C1(C)C ZINC000423266962 388045396 /nfs/dbraw/zinc/04/53/96/388045396.db2.gz DMNAFMLJFLMRDR-RWMBFGLXSA-N 2 0 242.407 2.024 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1c2ccccc2C[C@@H]1C ZINC000423267429 388046285 /nfs/dbraw/zinc/04/62/85/388046285.db2.gz DZEGAAHELRUIEK-HUBLWGQQSA-N 2 0 232.371 2.365 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H](C)c1ccc(F)cc1 ZINC000423269491 388046954 /nfs/dbraw/zinc/04/69/54/388046954.db2.gz GYZPQRGSXIXRJB-GHMZBOCLSA-N 2 0 224.323 2.332 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1C[C@H](C)CC[C@H]1C ZINC000423269173 388047785 /nfs/dbraw/zinc/04/77/85/388047785.db2.gz GWEOJGNOYLZEJE-YVECIDJPSA-N 2 0 212.381 2.256 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H](C)c1ccc(F)cc1 ZINC000423269493 388048353 /nfs/dbraw/zinc/04/83/53/388048353.db2.gz GYZPQRGSXIXRJB-QWRGUYRKSA-N 2 0 224.323 2.332 20 0 BEADRP CC/C=C/C[NH2+][C@@H]1CC[N@H+](C)[C@@H]2CCC[C@@H]21 ZINC000453332241 388048962 /nfs/dbraw/zinc/04/89/62/388048962.db2.gz VTNFZKLMTDQAFK-TUCADOHPSA-N 2 0 222.376 2.415 20 0 BEADRP CC[C@@H]1CC[C@H](C)C[C@H]1[NH2+][C@H]1CC[NH2+]C1 ZINC000423213880 388050054 /nfs/dbraw/zinc/05/00/54/388050054.db2.gz LVEJYLCQJPMURG-QNWHQSFQSA-N 2 0 210.365 2.153 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CCC(C)(F)F)[C@H](C)C1 ZINC000449354691 388179987 /nfs/dbraw/zinc/17/99/87/388179987.db2.gz QMSZPVNBDOJOGQ-MNOVXSKESA-N 2 0 234.334 2.352 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+]CC(C)(C)C[NH+](C)C ZINC000449060720 388137741 /nfs/dbraw/zinc/13/77/41/388137741.db2.gz GQECQTVYSMMBDH-GFCCVEGCSA-N 2 0 238.375 2.388 20 0 BEADRP COCC1CCC([NH2+]CCCC[NH+](C)C)CC1 ZINC000449104935 388143041 /nfs/dbraw/zinc/14/30/41/388143041.db2.gz HAQNHZZDPXVWHJ-UHFFFAOYSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@H](C)c1nccs1 ZINC000336662351 388260178 /nfs/dbraw/zinc/26/01/78/388260178.db2.gz CKAAWGCLKWEHFE-NXEZZACHSA-N 2 0 227.377 2.311 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)CCCC[NH3+])c1nccs1 ZINC000336662363 388260202 /nfs/dbraw/zinc/26/02/02/388260202.db2.gz CKAAWGCLKWEHFE-VHSXEESVSA-N 2 0 227.377 2.311 20 0 BEADRP [NH3+]CC12CCC(CC1)C[N@@H+]2CCc1ccccc1 ZINC000516584058 388358230 /nfs/dbraw/zinc/35/82/30/388358230.db2.gz NCKTZOTXOSZUEG-UHFFFAOYSA-N 2 0 244.382 2.432 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C(C)C)C2CC2)C1 ZINC000163304804 388360104 /nfs/dbraw/zinc/36/01/04/388360104.db2.gz ILCPYOIJGLQQJT-TZMCWYRMSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@H](CN)[NH2+][C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000235463399 388369350 /nfs/dbraw/zinc/36/93/50/388369350.db2.gz JCMULZMCBMJUIK-HLTSFMKQSA-N 2 0 224.270 2.044 20 0 BEADRP C[C@]1(C[NH3+])CC[N@H+](CC2CCCCC2)C1 ZINC000235706796 388374537 /nfs/dbraw/zinc/37/45/37/388374537.db2.gz KXLRCEVTXWWCNA-CYBMUJFWSA-N 2 0 210.365 2.237 20 0 BEADRP C[NH+](C)CCCC[NH2+]C[C@]1(C)CCCS1 ZINC000327643446 388381373 /nfs/dbraw/zinc/38/13/73/388381373.db2.gz RUDQKLZULNMLBR-LBPRGKRZSA-N 2 0 230.421 2.204 20 0 BEADRP C[C@@H]1C[C@@H](C[NH3+])C[N@@H+]1C[C@H]1CCC(F)(F)C1 ZINC000300799604 388395250 /nfs/dbraw/zinc/39/52/50/388395250.db2.gz CTRMBHOSIKMXJO-VWYCJHECSA-N 2 0 232.318 2.091 20 0 BEADRP C[N@H+](C[C@H]1CCC(F)(F)C1)C1CC[NH2+]CC1 ZINC000300961929 388396135 /nfs/dbraw/zinc/39/61/35/388396135.db2.gz POVQHHJHIXMXNI-JTQLQIEISA-N 2 0 232.318 2.106 20 0 BEADRP Cc1cnccc1C[NH2+]CCC1CC[NH+](C)CC1 ZINC000294722061 388403871 /nfs/dbraw/zinc/40/38/71/388403871.db2.gz BVYRONQFOSJYPZ-UHFFFAOYSA-N 2 0 247.386 2.212 20 0 BEADRP CCC(C)(C)OCC[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000308550695 388442494 /nfs/dbraw/zinc/44/24/94/388442494.db2.gz WONAKGMROFODTE-CHWSQXEVSA-N 2 0 242.407 2.264 20 0 BEADRP Cc1cccnc1CC[NH2+][C@H](C)CCCC[NH3+] ZINC000404952059 388447773 /nfs/dbraw/zinc/44/77/73/388447773.db2.gz QUWIHABCCBOTMX-CYBMUJFWSA-N 2 0 235.375 2.040 20 0 BEADRP Fc1cccc(C[N@H+]2CC[C@H]3C[NH2+]C[C@H]3CC2)c1 ZINC000335267497 388448993 /nfs/dbraw/zinc/44/89/93/388448993.db2.gz IKVHMPJVAUUNRO-OKILXGFUSA-N 2 0 248.345 2.257 20 0 BEADRP Cc1cccnc1CC[NH2+][C@H]1CCCC[C@@H]1C[NH3+] ZINC000405034070 388449596 /nfs/dbraw/zinc/44/95/96/388449596.db2.gz QHEGYZKHVJBSRS-HIFRSBDPSA-N 2 0 247.386 2.040 20 0 BEADRP COCC[C@@H](C)[NH2+][C@H](CC[NH+](C)C)C(C)(C)C ZINC000176078669 388450241 /nfs/dbraw/zinc/45/02/41/388450241.db2.gz WXLBYJNPRLYMDV-CHWSQXEVSA-N 2 0 244.423 2.367 20 0 BEADRP CCc1ccc([C@@H](C)[NH2+]C[C@H](C)C[NH3+])cc1 ZINC000336673904 388461180 /nfs/dbraw/zinc/46/11/80/388461180.db2.gz OVTNHVDXOIUFED-VXGBXAGGSA-N 2 0 220.360 2.494 20 0 BEADRP C[C@@H]([NH3+])[C@@H]1CCCC[N@@H+]1CCCCCF ZINC000336674020 388461365 /nfs/dbraw/zinc/46/13/65/388461365.db2.gz GYPLAGBCPJIJTE-NEPJUHHUSA-N 2 0 216.344 2.328 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H](C)c1ccc(OC)cc1 ZINC000515483275 256747752 /nfs/dbraw/zinc/74/77/52/256747752.db2.gz DBYZPVJYWDYZLM-GFCCVEGCSA-N 2 0 236.359 2.345 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCN(C)[C@@H](C)C2)[C@H]1C ZINC000336702971 388465085 /nfs/dbraw/zinc/46/50/85/388465085.db2.gz QEGHCHDQGXSKQL-SJHCENCUSA-N 2 0 210.365 2.103 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C1Cc2ccccc2C1 ZINC000336712621 388466651 /nfs/dbraw/zinc/46/66/51/388466651.db2.gz OCENCNAFDIGITM-GFCCVEGCSA-N 2 0 232.371 2.261 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H]2CCc3c2cccc3O)C1 ZINC000573107551 388421067 /nfs/dbraw/zinc/42/10/67/388421067.db2.gz XRUMUZVHYPKKKG-UHIISALHSA-N 2 0 246.354 2.239 20 0 BEADRP CC(C)(C)[NH+]1CCC([NH2+][C@H]2CCCOC2)CC1 ZINC000070464822 388436903 /nfs/dbraw/zinc/43/69/03/388436903.db2.gz FOZODTOOQCJPOB-ZDUSSCGKSA-N 2 0 240.391 2.018 20 0 BEADRP CC[C@](C)(C[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@@H]1C)OC ZINC000322511801 388437090 /nfs/dbraw/zinc/43/70/90/388437090.db2.gz JBNQTNIHAQSPDG-IGQOVBAYSA-N 2 0 242.407 2.120 20 0 BEADRP COc1cccc2c1CCC[C@H]2[NH2+]CCCC[NH3+] ZINC000517356212 388547648 /nfs/dbraw/zinc/54/76/48/388547648.db2.gz LKVLDQNQOXJXGS-CQSZACIVSA-N 2 0 248.370 2.401 20 0 BEADRP F[C@@H]1CCC[C@@H]1N[C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000340529467 388492699 /nfs/dbraw/zinc/49/26/99/388492699.db2.gz JVIAENNPGYMVAX-LPWJVIDDSA-N 2 0 226.339 2.093 20 0 BEADRP Cc1csc(C[NH2+][C@H]2CCC[C@H]2C[NH3+])c1 ZINC000344647029 388508868 /nfs/dbraw/zinc/50/88/68/388508868.db2.gz WRUFZZUWJUCIIE-JQWIXIFHSA-N 2 0 224.373 2.274 20 0 BEADRP C[C@@H](CCC1CC1)[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000398043902 388516088 /nfs/dbraw/zinc/51/60/88/388516088.db2.gz AESVLYRUNXIUIZ-AAEUAGOBSA-N 2 0 210.365 2.154 20 0 BEADRP c1ccc([C@@H]2CCC[N@H+]2CC[C@H]2CC[NH2+]C2)nc1 ZINC000516973476 388530178 /nfs/dbraw/zinc/53/01/78/388530178.db2.gz UMTBJOILTKSCND-HIFRSBDPSA-N 2 0 245.370 2.218 20 0 BEADRP C[C@@H]1CC[N@H+](CC[C@H]2CCC[NH+]2C)C[C@@H]1C ZINC000245558746 388589194 /nfs/dbraw/zinc/58/91/94/388589194.db2.gz BHAIOBIZDVCTJN-HZSPNIEDSA-N 2 0 224.392 2.449 20 0 BEADRP CO[C@H](C[N@@H+]1CC[C@H]([NH3+])C[C@H]1C)c1ccccc1 ZINC000379171136 388594945 /nfs/dbraw/zinc/59/49/45/388594945.db2.gz DIKNAXKSMCFXGE-VHDGCEQUSA-N 2 0 248.370 2.186 20 0 BEADRP CCc1ccc(C[NH2+][C@@H](C)CC[NH3+])s1 ZINC000220498367 388604459 /nfs/dbraw/zinc/60/44/59/388604459.db2.gz OESHLSUCDGOKDJ-VIFPVBQESA-N 2 0 212.362 2.137 20 0 BEADRP CCc1ccc(C[NH2+][C@H](C)CC[NH3+])s1 ZINC000220498438 388605239 /nfs/dbraw/zinc/60/52/39/388605239.db2.gz OESHLSUCDGOKDJ-SECBINFHSA-N 2 0 212.362 2.137 20 0 BEADRP CC(C)[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)C1CC1 ZINC000401055225 388605305 /nfs/dbraw/zinc/60/53/05/388605305.db2.gz DIGZRSDIHXBIOA-TUVASFSCSA-N 2 0 236.403 2.399 20 0 BEADRP C[C@@H]1C[N@H+](CC[C@@H]2CCCC[NH+]2C)[C@H]1C ZINC000550307206 388605384 /nfs/dbraw/zinc/60/53/84/388605384.db2.gz RLLOCUSZKOQWCM-AGIUHOORSA-N 2 0 210.365 2.201 20 0 BEADRP Cc1cncc([C@H](C)[NH2+]C[C@H]2CCCN2C)c1 ZINC000184302860 388575663 /nfs/dbraw/zinc/57/56/63/388575663.db2.gz DDZJNWRVHPHAEK-GXTWGEPZSA-N 2 0 233.359 2.135 20 0 BEADRP CC[C@@H]1CC[N@H+](CCC[NH+](CC)CC)C1 ZINC000191806945 388670543 /nfs/dbraw/zinc/67/05/43/388670543.db2.gz DEMSMHYOZLQUGP-CYBMUJFWSA-N 2 0 212.381 2.450 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CC[C@H]2CCCCO2)CC[N@@H+]1C ZINC000248415647 388678330 /nfs/dbraw/zinc/67/83/30/388678330.db2.gz OLSMRPWOAZGNDL-HZSPNIEDSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@@H](CC1CC1)[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000530178831 388621153 /nfs/dbraw/zinc/62/11/53/388621153.db2.gz OKRLVJDNBWOOSB-CMPLNLGQSA-N 2 0 208.349 2.049 20 0 BEADRP C[C@H](CCc1ccco1)N[C@@H]1CC[NH2+]C12CCC2 ZINC000530178663 388621752 /nfs/dbraw/zinc/62/17/52/388621752.db2.gz PNNCRCNOMWMRSK-TZMCWYRMSA-N 2 0 248.370 2.475 20 0 BEADRP C1CC2(C1)[NH2+]CC[C@H]2[NH2+]C1CCCCC1 ZINC000530179234 388622109 /nfs/dbraw/zinc/62/21/09/388622109.db2.gz WIUCCMZOMURHBU-GFCCVEGCSA-N 2 0 208.349 2.193 20 0 BEADRP CCSCCC[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000228809510 388625535 /nfs/dbraw/zinc/62/55/35/388625535.db2.gz UUSDBDCPOYMSRM-NWDGAFQWSA-N 2 0 230.421 2.202 20 0 BEADRP C[C@H]1CC(F)(F)CC[N@@H+]1CC1CC[NH2+]CC1 ZINC000530208508 388626175 /nfs/dbraw/zinc/62/61/75/388626175.db2.gz UGQNGIFFXHIJDP-JTQLQIEISA-N 2 0 232.318 2.106 20 0 BEADRP C[N@H+](CC1CC(C)(C)C1)CC(C)(C)C[NH3+] ZINC000530212156 388627516 /nfs/dbraw/zinc/62/75/16/388627516.db2.gz PELJMJOAWCGANP-UHFFFAOYSA-N 2 0 212.381 2.339 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CC[C@H]2C[C@H]2C1)[C@H]1CCC[NH2+]1 ZINC000530212360 388628148 /nfs/dbraw/zinc/62/81/48/388628148.db2.gz RGDGSGAFINLVGS-MEBFFEOJSA-N 2 0 222.376 2.153 20 0 BEADRP CCC[C@@H](C[NH2+]C1CCC(C[NH3+])CC1)OCC ZINC000530214257 388629316 /nfs/dbraw/zinc/62/93/16/388629316.db2.gz WGUBFVCZQNLVTJ-RUXDESIVSA-N 2 0 242.407 2.299 20 0 BEADRP CCC[N@H+](Cc1ccncc1C)C1CC[NH2+]CC1 ZINC000530215730 388629592 /nfs/dbraw/zinc/62/95/92/388629592.db2.gz IHNIKPLEOBMLGG-UHFFFAOYSA-N 2 0 247.386 2.354 20 0 BEADRP C1=CCC(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)C1 ZINC000530216528 388630396 /nfs/dbraw/zinc/63/03/96/388630396.db2.gz QBUPHBIZEAAUEM-QLFBSQMISA-N 2 0 234.387 2.463 20 0 BEADRP C[C@H]([NH2+]CC1CC=CC1)[C@H]1CCCC[NH2+]1 ZINC000530217415 388630931 /nfs/dbraw/zinc/63/09/31/388630931.db2.gz STIMROBEFVYYAC-WCQYABFASA-N 2 0 208.349 2.073 20 0 BEADRP CC[C@@H]([NH2+][C@H]1CC[NH2+]C12CCC2)C1CC1 ZINC000530219343 388631740 /nfs/dbraw/zinc/63/17/40/388631740.db2.gz LKMQZBZOSXVDCB-NEPJUHHUSA-N 2 0 208.349 2.049 20 0 BEADRP CC1(C)CC(C[N@@H+]2CC[C@H]3[NH2+]CC[C@H]3C2)C1 ZINC000530220176 388631963 /nfs/dbraw/zinc/63/19/63/388631963.db2.gz LUBUQLGBXQZEDN-QWHCGFSZSA-N 2 0 222.376 2.106 20 0 BEADRP CC[C@@H]([NH2+][C@@H]1CC[NH2+]C12CCC2)C1CC1 ZINC000530219350 388632277 /nfs/dbraw/zinc/63/22/77/388632277.db2.gz LKMQZBZOSXVDCB-VXGBXAGGSA-N 2 0 208.349 2.049 20 0 BEADRP C1CC1C([NH2+][C@@H]1CC[NH2+]C12CCC2)C1CC1 ZINC000530224179 388634394 /nfs/dbraw/zinc/63/43/94/388634394.db2.gz VCXSEPZVWWCAKA-GFCCVEGCSA-N 2 0 220.360 2.049 20 0 BEADRP C[C@@H]1CC(F)(F)CC[N@@H+]1CCC1CC[NH2+]CC1 ZINC000530233600 388636382 /nfs/dbraw/zinc/63/63/82/388636382.db2.gz YKGQSHXOEXZHOT-LLVKDONJSA-N 2 0 246.345 2.496 20 0 BEADRP C[C@H]1CC(F)(F)CC[N@@H+]1CC[C@@H]1CCC[NH2+]C1 ZINC000530233560 388636658 /nfs/dbraw/zinc/63/66/58/388636658.db2.gz WYORXZBTEBOTBF-RYUDHWBXSA-N 2 0 246.345 2.496 20 0 BEADRP C[C@H]1CC(F)(F)CC[N@@H+]1CC[C@@H]1CC[NH2+]C1 ZINC000530233638 388636835 /nfs/dbraw/zinc/63/68/35/388636835.db2.gz ZJKAFZUQXFLUQI-QWRGUYRKSA-N 2 0 232.318 2.106 20 0 BEADRP C[C@@H]1CC(F)(F)CC[N@@H+]1CC[C@@H]1CCC[NH2+]C1 ZINC000530233307 388637147 /nfs/dbraw/zinc/63/71/47/388637147.db2.gz WYORXZBTEBOTBF-NEPJUHHUSA-N 2 0 246.345 2.496 20 0 BEADRP Cc1ncccc1C[NH2+][C@H](C)C[C@@H]1CCC[NH2+]1 ZINC000530243343 388638923 /nfs/dbraw/zinc/63/89/23/388638923.db2.gz HPBUZPFAJKISHS-RISCZKNCSA-N 2 0 233.359 2.010 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCSC)[C@@H](C)C1 ZINC000246789508 388651384 /nfs/dbraw/zinc/65/13/84/388651384.db2.gz MGALPTRIMWGCIE-NWDGAFQWSA-N 2 0 230.421 2.012 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)C2CCC2)C1 ZINC000247137903 388659725 /nfs/dbraw/zinc/65/97/25/388659725.db2.gz SDQJFFZKWWRFBI-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@H](C)C2CC2)[C@@H](C)C1 ZINC000247311425 388661979 /nfs/dbraw/zinc/66/19/79/388661979.db2.gz KAAVRKKGRUQBIK-LOWVWBTDSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1)C1CC1 ZINC000227609275 388753162 /nfs/dbraw/zinc/75/31/62/388753162.db2.gz MKZKTHNKXUDWNL-CYZMBNFOSA-N 2 0 210.365 2.247 20 0 BEADRP CC(C)[NH2+]Cc1ccc(C[NH+](C)C)c(F)c1 ZINC000126089907 388688448 /nfs/dbraw/zinc/68/84/48/388688448.db2.gz DQEPQKCTEGRPSC-UHFFFAOYSA-N 2 0 224.323 2.385 20 0 BEADRP Cc1ccc(CNC2CC[NH+](C3CC3)CC2)nc1 ZINC000126960802 388709973 /nfs/dbraw/zinc/70/99/73/388709973.db2.gz AAIKPHCGCPEFDW-UHFFFAOYSA-N 2 0 245.370 2.106 20 0 BEADRP [NH3+]CCC[N@@H+](Cc1ccccc1)C[C@@H]1CCCO1 ZINC000230001196 388810015 /nfs/dbraw/zinc/81/00/15/388810015.db2.gz PGKOEAXZHDIZHJ-HNNXBMFYSA-N 2 0 248.370 2.016 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000252173819 388761250 /nfs/dbraw/zinc/76/12/50/388761250.db2.gz ONXDOIKKFHVVQH-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H](C1CC1)[N@H+](C)CC[C@H]1CCC[NH+]1C ZINC000252656620 388769757 /nfs/dbraw/zinc/76/97/57/388769757.db2.gz KKOOLZVGFCUJIQ-WCQYABFASA-N 2 0 210.365 2.201 20 0 BEADRP CCC(CC)C[N@@H+]1CC[C@@H](C)[C@@H](C[NH3+])C1 ZINC000228988278 388778063 /nfs/dbraw/zinc/77/80/63/388778063.db2.gz ISLWBCJGLUPLAK-YPMHNXCESA-N 2 0 212.381 2.339 20 0 BEADRP C[C@@H](CN[C@@H](C)c1ccc(F)cn1)C[NH+](C)C ZINC000293616284 388855753 /nfs/dbraw/zinc/85/57/53/388855753.db2.gz JJUJGCBHDCXUJA-QWRGUYRKSA-N 2 0 239.338 2.069 20 0 BEADRP COc1cccnc1NC1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000322333969 388864923 /nfs/dbraw/zinc/86/49/23/388864923.db2.gz AANVBJRPWJLZRO-YOGCLGLASA-N 2 0 247.342 2.127 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]CCCC1CC1 ZINC000129728168 388868161 /nfs/dbraw/zinc/86/81/61/388868161.db2.gz NBLLYTJEBVIXJH-YPMHNXCESA-N 2 0 210.365 2.106 20 0 BEADRP [NH3+]Cc1cccc(OC[C@H]2CC[C@H](C[NH3+])CC2)c1 ZINC000565594644 388957600 /nfs/dbraw/zinc/95/76/00/388957600.db2.gz ZXCNOVUYKZICPY-JOCQHMNTSA-N 2 0 248.370 2.289 20 0 BEADRP COC[C@H](C)C[NH2+]Cc1ccc([C@H](C)[NH3+])cc1 ZINC000565762690 388967317 /nfs/dbraw/zinc/96/73/17/388967317.db2.gz CXBKYTPNCPKYKJ-NEPJUHHUSA-N 2 0 236.359 2.078 20 0 BEADRP Cc1cc(F)ccc1C[NH2+][C@H](C)C[C@H](C)[NH3+] ZINC000565951147 388980258 /nfs/dbraw/zinc/98/02/58/388980258.db2.gz KRJKKJXFABFKHF-WDEREUQCSA-N 2 0 224.323 2.350 20 0 BEADRP Cc1ccsc1C[NH2+]CC1=CC[N@H+](C)CC1 ZINC000271792723 389025248 /nfs/dbraw/zinc/02/52/48/389025248.db2.gz HDPSFSKDZMLRBI-UHFFFAOYSA-N 2 0 236.384 2.408 20 0 BEADRP C[C@@H](NCCC[NH+](C)C)c1ccc(Cl)cn1 ZINC000274862559 389049765 /nfs/dbraw/zinc/04/97/65/389049765.db2.gz DBKJXPLBPAJVLP-SNVBAGLBSA-N 2 0 241.766 2.337 20 0 BEADRP C(C[N@@H+]1CC[C@@H]2C[NH2+]C[C@H]2C1)C1CCCC1 ZINC000261560699 533365568 /nfs/dbraw/zinc/36/55/68/533365568.db2.gz AEJADTCRJHQOOG-KGLIPLIRSA-N 2 0 222.376 2.108 20 0 BEADRP c1cc2c(o1)CCC[C@@H]2[NH2+]CC1=CC[NH2+]CC1 ZINC000335500124 133868129 /nfs/dbraw/zinc/86/81/29/133868129.db2.gz MMPUFSHMHZTMHH-ZDUSSCGKSA-N 2 0 232.327 2.166 20 0 BEADRP C[C@H](CCCC(F)(F)F)[NH2+]CCCC[NH3+] ZINC000166664151 133956744 /nfs/dbraw/zinc/95/67/44/133956744.db2.gz BWLSAZARANVQFS-SECBINFHSA-N 2 0 226.286 2.436 20 0 BEADRP C[C@@H](F)CC[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000351860767 133986911 /nfs/dbraw/zinc/98/69/11/133986911.db2.gz YSHYGIKCMUCLLZ-GFCCVEGCSA-N 2 0 230.371 2.398 20 0 BEADRP C[C@H](F)CC[N@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000352050003 134045912 /nfs/dbraw/zinc/04/59/12/134045912.db2.gz PHZKIIJNTKAAHR-NWDGAFQWSA-N 2 0 216.344 2.008 20 0 BEADRP C[C@@H](F)CC[N@@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000352051354 134048092 /nfs/dbraw/zinc/04/80/92/134048092.db2.gz ZJQXEEBMTKIPAA-CHWSQXEVSA-N 2 0 228.355 2.152 20 0 BEADRP CC[NH+]1CCCC2(CCC[N@@H+](CC)C2)C1 ZINC000336009297 134050419 /nfs/dbraw/zinc/05/04/19/134050419.db2.gz FAZIAEKKNHZIFY-UHFFFAOYSA-N 2 0 210.365 2.204 20 0 BEADRP Cc1oncc1CN(C)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000336137642 134096451 /nfs/dbraw/zinc/09/64/51/134096451.db2.gz WIXHLVVALCTQTL-PBWFPOADSA-N 2 0 249.358 2.040 20 0 BEADRP C([NH2+]C1CCCCCCC1)[C@H]1CCC[NH2+]1 ZINC000216542603 134150167 /nfs/dbraw/zinc/15/01/67/134150167.db2.gz JLJWYIRLUWEXMV-CYBMUJFWSA-N 2 0 210.365 2.441 20 0 BEADRP C[C@@H]([NH3+])[C@H]1CC[N@H+](CC2CCC(C)CC2)C1 ZINC000168520175 134225338 /nfs/dbraw/zinc/22/53/38/134225338.db2.gz CMCMKDNEIOXJQH-HHTDUIENSA-N 2 0 224.392 2.482 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000168702312 134246549 /nfs/dbraw/zinc/24/65/49/134246549.db2.gz XMAXGFPILDAGTE-UPJWGTAASA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H](c1cccc(F)c1)N1CCC[C@@H]([NH3+])C1 ZINC000217505786 134248974 /nfs/dbraw/zinc/24/89/74/134248974.db2.gz ZMDZCWJWCILZHW-GXFFZTMASA-N 2 0 222.307 2.310 20 0 BEADRP C[Si](C)(C)C[N@@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000172652032 134266922 /nfs/dbraw/zinc/26/69/22/134266922.db2.gz KDQXEIRTYYXFBK-CYBMUJFWSA-N 2 0 240.467 2.282 20 0 BEADRP CC[N@@H+]1CC[C@H]2CC[C@@H](C1)N2C/C=C/Cl ZINC000175593129 134288008 /nfs/dbraw/zinc/28/80/08/134288008.db2.gz XDKTWDFQOAUADG-HNFQPOCMSA-N 2 0 228.767 2.298 20 0 BEADRP C[C@@H](CC[NH3+])[NH2+]Cc1ccc(F)c(Cl)c1 ZINC000220545071 134309540 /nfs/dbraw/zinc/30/95/40/134309540.db2.gz LKRQGBRVENWSQU-QMMMGPOBSA-N 2 0 230.714 2.306 20 0 BEADRP Cc1ccc(C)c(C[NH2+][C@@H](C)CC[NH3+])c1 ZINC000220538753 134309827 /nfs/dbraw/zinc/30/98/27/134309827.db2.gz OYZJOALBAMBAQR-LBPRGKRZSA-N 2 0 206.333 2.130 20 0 BEADRP Cc1ccc(C[NH2+][C@@H](C)CC[NH3+])cc1Cl ZINC000220509759 134309867 /nfs/dbraw/zinc/30/98/67/134309867.db2.gz WNGYTTAGDNZALK-JTQLQIEISA-N 2 0 226.751 2.475 20 0 BEADRP CC(C)CCOCCN1CCC[C@@H](C)[C@@H]1C[NH3+] ZINC000221456567 134324753 /nfs/dbraw/zinc/32/47/53/134324753.db2.gz XPMDIPCGHYBKTL-KGLIPLIRSA-N 2 0 242.407 2.108 20 0 BEADRP C[C@H](CC1CC1)[NH2+][C@H]1CCN2CCCC[C@@H]12 ZINC000222021039 134329277 /nfs/dbraw/zinc/32/92/77/134329277.db2.gz SIYXPCRGCOCYCW-XBFCOCLRSA-N 2 0 222.376 2.391 20 0 BEADRP CC(C)C[C@H]([NH3+])CN1CCS[C@@H](C)[C@@H]1C ZINC000222023474 134329309 /nfs/dbraw/zinc/32/93/09/134329309.db2.gz UQAZTKASZSXQCB-SRVKXCTJSA-N 2 0 230.421 2.186 20 0 BEADRP C[NH+]1CCC(C)(C[NH2+]C[C@@H]2CCSC2)CC1 ZINC000226345367 134360998 /nfs/dbraw/zinc/36/09/98/134360998.db2.gz WJKSQMCUISNEIJ-LBPRGKRZSA-N 2 0 242.432 2.061 20 0 BEADRP CC[C@@H]1CCC[C@@H]([NH2+]CCOCC[NH+](C)C)C1 ZINC000226744853 134370719 /nfs/dbraw/zinc/37/07/19/134370719.db2.gz RTPJOXBCXXWEAZ-ZIAGYGMSSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+]CC2(C)CC[NH+](C)CC2)C1 ZINC000227328951 134377891 /nfs/dbraw/zinc/37/78/91/134377891.db2.gz KLOCHTRTLXIZOI-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP COC[C@H](C)C[NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000227540171 134382721 /nfs/dbraw/zinc/38/27/21/134382721.db2.gz UKTPNPCHGRIBIU-HONMWMINSA-N 2 0 234.343 2.003 20 0 BEADRP CC(C)C1CCC([N@H+](C)CCC[NH3+])CC1 ZINC000227745034 134392141 /nfs/dbraw/zinc/39/21/41/134392141.db2.gz MBLLRYUWJOJKIJ-UHFFFAOYSA-N 2 0 212.381 2.482 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+][C@H]1CCC[C@@H](C)CC1 ZINC000234701364 134582895 /nfs/dbraw/zinc/58/28/95/134582895.db2.gz SZHOXNSTORKSAP-RDBSUJKOSA-N 2 0 242.407 2.299 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+][C@@H](C)C1CCCCC1 ZINC000234799367 134583791 /nfs/dbraw/zinc/58/37/91/134583791.db2.gz QFRPXVHUDXXJSW-JSGCOSHPSA-N 2 0 242.407 2.299 20 0 BEADRP [NH3+]CCCC[NH2+][C@H]1CCc2c1cccc2F ZINC000214684098 134790152 /nfs/dbraw/zinc/79/01/52/134790152.db2.gz ABZQDQPSNAHBOZ-ZDUSSCGKSA-N 2 0 222.307 2.142 20 0 BEADRP C[C@H]1C[C@H](C[N@H+](C)C2CC(C)(C)C2)CC[NH2+]1 ZINC000334623376 134839439 /nfs/dbraw/zinc/83/94/39/134839439.db2.gz UHPKNIHBNHWLAC-NWDGAFQWSA-N 2 0 224.392 2.495 20 0 BEADRP CCOC(C)(C)C[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000249128305 135034539 /nfs/dbraw/zinc/03/45/39/135034539.db2.gz RMQKLACBZCGNJY-STQMWFEESA-N 2 0 240.391 2.018 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H]2CCCC2(C)C)C1 ZINC000250346258 135052685 /nfs/dbraw/zinc/05/26/85/135052685.db2.gz QNAAKZYHTIAQJO-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)OCCC[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000250577304 135053810 /nfs/dbraw/zinc/05/38/10/135053810.db2.gz FOPUAUSBUNVECE-KBPBESRZSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@H]1C[N@H+](CC2CCCCC2)CC[C@H]1[NH3+] ZINC000251706342 135074562 /nfs/dbraw/zinc/07/45/62/135074562.db2.gz JDTXEYQOJHLZCZ-WCQYABFASA-N 2 0 210.365 2.236 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@H]1CCCC[C@H]1C ZINC000252096432 135083583 /nfs/dbraw/zinc/08/35/83/135083583.db2.gz FMZIHPBZNLKUQT-UPJWGTAASA-N 2 0 212.381 2.495 20 0 BEADRP C[N@H+](CCc1cccs1)C[C@H]1CCC[NH2+]C1 ZINC000086440969 135085311 /nfs/dbraw/zinc/08/53/11/135085311.db2.gz DTPKPYABQUVLLD-LBPRGKRZSA-N 2 0 238.400 2.222 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)CS1 ZINC000252203613 135086798 /nfs/dbraw/zinc/08/67/98/135086798.db2.gz WTPMYMMZSMBWGU-MROQNXINSA-N 2 0 240.416 2.097 20 0 BEADRP C[C@H]1CCC[C@@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000252219233 135087522 /nfs/dbraw/zinc/08/75/22/135087522.db2.gz YOQHIUQNLZTACV-WYTNZGFTSA-N 2 0 222.376 2.390 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+][C@H]1CCCC[C@H]1C[NH3+] ZINC000252215431 135088201 /nfs/dbraw/zinc/08/82/01/135088201.db2.gz XNDMLUZBOMACPW-VOAKCMCISA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+][C@H]1CC1(C)C ZINC000252440879 135090026 /nfs/dbraw/zinc/09/00/26/135090026.db2.gz XOLBYBXNFITZAE-KKOKHZNYSA-N 2 0 210.365 2.103 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)C1 ZINC000252513593 135092457 /nfs/dbraw/zinc/09/24/57/135092457.db2.gz ZMTKJJBHRHCCOM-ZOBORPQBSA-N 2 0 222.376 2.391 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CCCOC(C)C)[C@@H](C)C1 ZINC000252644010 135093483 /nfs/dbraw/zinc/09/34/83/135093483.db2.gz HYMMUXZRUMTPQI-KBPBESRZSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H](Cc1cccs1)[NH2+]CC1CC[NH2+]CC1 ZINC000086700594 135095227 /nfs/dbraw/zinc/09/52/27/135095227.db2.gz XWLOZEAVKKLASW-LLVKDONJSA-N 2 0 238.400 2.268 20 0 BEADRP Oc1ccc(C[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)cc1 ZINC000252675202 135095309 /nfs/dbraw/zinc/09/53/09/135095309.db2.gz YBWMVOTYQJDMMG-KBPBESRZSA-N 2 0 246.354 2.109 20 0 BEADRP C[C@@H]1OCC[C@@H]1[NH2+]CCC[N@@H+]1CCCC[C@H]1C ZINC000252691062 135097394 /nfs/dbraw/zinc/09/73/94/135097394.db2.gz WUSWMRASACCZSY-RDBSUJKOSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]CCc1ccsc1 ZINC000252713463 135100752 /nfs/dbraw/zinc/10/07/52/135100752.db2.gz PFBQWHJAOVUXTE-WCQYABFASA-N 2 0 238.400 2.220 20 0 BEADRP CC1CC([NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)C1 ZINC000252733123 135104716 /nfs/dbraw/zinc/10/47/16/135104716.db2.gz YACIYMGCMGWNQR-KPFVRQRISA-N 2 0 208.349 2.001 20 0 BEADRP Cc1ccsc1C[NH2+][C@H]1CC[NH2+]C[C@H]1C ZINC000261531016 135108682 /nfs/dbraw/zinc/10/86/82/135108682.db2.gz DWXJUYNIXBLYCU-MNOVXSKESA-N 2 0 224.373 2.144 20 0 BEADRP CCC(CC)C[N@@H+]1C[C@@H]2CCC[C@@H]([NH3+])[C@H]2C1 ZINC000252843102 135113319 /nfs/dbraw/zinc/11/33/19/135113319.db2.gz CXNWCHNUDGIZSF-MELADBBJSA-N 2 0 224.392 2.482 20 0 BEADRP CCC[N@H+](CC[C@H]1CCCO1)C1CC[NH2+]CC1 ZINC000087266358 135116802 /nfs/dbraw/zinc/11/68/02/135116802.db2.gz WFXNFGIBVOUTFY-CQSZACIVSA-N 2 0 240.391 2.020 20 0 BEADRP C[C@H]([NH2+][C@H]1CCCC[C@H]1C[NH3+])C1CCC1 ZINC000252981503 135118484 /nfs/dbraw/zinc/11/84/84/135118484.db2.gz RKPYDSVNVOOOGP-DRZSPHRISA-N 2 0 210.365 2.282 20 0 BEADRP CC[C@H](O)CC[NH2+][C@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000253020148 135119462 /nfs/dbraw/zinc/11/94/62/135119462.db2.gz JNZOXZPTWHZEHK-MCIONIFRSA-N 2 0 242.407 2.048 20 0 BEADRP Cc1ccsc1C[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000087308685 135121719 /nfs/dbraw/zinc/12/17/19/135121719.db2.gz DCMLLIWHCXKKSE-MNOVXSKESA-N 2 0 224.373 2.416 20 0 BEADRP C[C@H]1CC[C@H]([NH2+][C@H]2CCC[NH2+]CC2)CC1 ZINC000253128193 135122208 /nfs/dbraw/zinc/12/22/08/135122208.db2.gz MWAJVHMXEGSCOA-AVGNSLFASA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]1CC[C@H]([NH2+][C@@H]2CCC[C@@H]2C[NH3+])CC1 ZINC000253118332 135122398 /nfs/dbraw/zinc/12/23/98/135122398.db2.gz HAOOSEZGYOBHKQ-FDYHWXHSSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]1CC[N@H+](Cc2ccc(F)cc2)C[C@H]1C[NH3+] ZINC000253181247 135122902 /nfs/dbraw/zinc/12/29/02/135122902.db2.gz FEBDUFSVLGLESC-WCQYABFASA-N 2 0 236.334 2.242 20 0 BEADRP C[C@H]1CC[N@H+](CC2CCCC2)C[C@H]1C[NH3+] ZINC000253207831 135124639 /nfs/dbraw/zinc/12/46/39/135124639.db2.gz HTQOJEGDNHYITG-WCQYABFASA-N 2 0 210.365 2.093 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@]3(CC[NH2+]C3)C2)s1 ZINC000257645076 135137550 /nfs/dbraw/zinc/13/75/50/135137550.db2.gz BVSSXABOMLFLMZ-ZDUSSCGKSA-N 2 0 236.384 2.242 20 0 BEADRP Fc1cccc(C[N@@H+]2CCC3(C2)CC[NH2+]CC3)c1 ZINC000257649100 135138568 /nfs/dbraw/zinc/13/85/68/135138568.db2.gz CTYMFEDBKJHAQA-UHFFFAOYSA-N 2 0 248.345 2.401 20 0 BEADRP C[NH+](C)CCC[NH2+]CCC1CCCCC1 ZINC000087473320 135142350 /nfs/dbraw/zinc/14/23/50/135142350.db2.gz YATHKTLEFUSAIF-UHFFFAOYSA-N 2 0 212.381 2.498 20 0 BEADRP C[NH2+]CCCN(C)Cc1ccc(F)c(F)c1 ZINC000087472300 135143360 /nfs/dbraw/zinc/14/33/60/135143360.db2.gz FJHIWLLQKFXGSH-UHFFFAOYSA-N 2 0 228.286 2.006 20 0 BEADRP C[NH2+]CCCN(C)[C@@H](C)c1ccc(F)cc1 ZINC000087472202 135143434 /nfs/dbraw/zinc/14/34/34/135143434.db2.gz CFBHNOFPISDGDM-NSHDSACASA-N 2 0 224.323 2.428 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CC[NH2+]C[C@@H]1C ZINC000261530649 135158049 /nfs/dbraw/zinc/15/80/49/135158049.db2.gz CYYRJSOLBOGOQU-MROQNXINSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+][C@H]1CCCC[C@H]1C ZINC000261530648 135158054 /nfs/dbraw/zinc/15/80/54/135158054.db2.gz CYYRJSOLBOGOQU-FVCCEPFGSA-N 2 0 210.365 2.153 20 0 BEADRP CC1(C)CC[C@H]1[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000261531568 135161157 /nfs/dbraw/zinc/16/11/57/135161157.db2.gz HAZUMUGSLKMAEA-VXGBXAGGSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[NH2+]C1)C1CCCC1 ZINC000087647313 135161353 /nfs/dbraw/zinc/16/13/53/135161353.db2.gz LYBKILNMIGMTHZ-RYUDHWBXSA-N 2 0 210.365 2.154 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]C[C@@H]1CCCCS1 ZINC000087682940 135164753 /nfs/dbraw/zinc/16/47/53/135164753.db2.gz MXKZNYGZJMQMJP-AVGNSLFASA-N 2 0 242.432 2.379 20 0 BEADRP C[C@@H]1CCC[C@H](C[NH2+]C[C@H]2CCC[NH2+]C2)C1 ZINC000261534325 135166745 /nfs/dbraw/zinc/16/67/45/135166745.db2.gz PVNWYCUYEUDGIX-RDBSUJKOSA-N 2 0 224.392 2.402 20 0 BEADRP C[C@@H]1[C@H]([NH3+])CC[N@@H+]1CC1CCCCCC1 ZINC000261534855 135168435 /nfs/dbraw/zinc/16/84/35/135168435.db2.gz NFHFCLSXMCWUMF-DGCLKSJQSA-N 2 0 210.365 2.378 20 0 BEADRP C[C@@H]1C[C@H](C[NH+]2C[C@H]3CCC[C@@H]3C2)CC[NH2+]1 ZINC000261534998 135168776 /nfs/dbraw/zinc/16/87/76/135168776.db2.gz VLRLSDLJSDDBBN-AAVRWANBSA-N 2 0 222.376 2.106 20 0 BEADRP [NH3+]CCCC[NH2+]Cc1coc2ccccc12 ZINC000087780772 135168784 /nfs/dbraw/zinc/16/87/84/135168784.db2.gz VKTCKVQWLBCZAM-UHFFFAOYSA-N 2 0 218.300 2.261 20 0 BEADRP C[NH2+]CC1CC[NH+](CC2(C)CCC2)CC1 ZINC000261536364 135171255 /nfs/dbraw/zinc/17/12/55/135171255.db2.gz RJUYDWUYBMDDDQ-UHFFFAOYSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@@H]1CC[C@H]([N@H+](C)C[C@@H]2CCC[NH2+]C2)C1 ZINC000261536748 135172359 /nfs/dbraw/zinc/17/23/59/135172359.db2.gz STWCNQFYYRDJCH-UPJWGTAASA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1CCC[C@H]1C[NH2+][C@H]1CCC[NH2+]CC1 ZINC000261538310 135175175 /nfs/dbraw/zinc/17/51/75/135175175.db2.gz XRHLLWRCHKVNGJ-AGIUHOORSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H]1C[NH2+]CC[C@H]1[NH2+]CC1CCCCC1 ZINC000261538481 135176372 /nfs/dbraw/zinc/17/63/72/135176372.db2.gz YGBVPRXODRERLQ-WCQYABFASA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1C[N@H+](CCC2CCCCC2)C[C@H]1[NH3+] ZINC000261538909 135176798 /nfs/dbraw/zinc/17/67/98/135176798.db2.gz ZTDWQJFLWKRRLN-DGCLKSJQSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@@H]1CC[C@H](C)[N@H+](CC[C@@H]2CCC[NH2+]C2)C1 ZINC000084048144 135178416 /nfs/dbraw/zinc/17/84/16/135178416.db2.gz OURFWNYDKLTFAK-RDBSUJKOSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[N@@H+]([C@@H]2CCCc3ccccc32)C[C@H]1[NH3+] ZINC000261540054 135178719 /nfs/dbraw/zinc/17/87/19/135178719.db2.gz DEILVRRDRKFJOK-KCPJHIHWSA-N 2 0 230.355 2.343 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@H]1CCc2ccccc21 ZINC000261540970 135179903 /nfs/dbraw/zinc/17/99/03/135179903.db2.gz ASTKXPSEOHVVSF-UGFHNGPFSA-N 2 0 230.355 2.262 20 0 BEADRP C[N@H+](C[C@@H]1CCC[NH2+]C1)C1(C)CCCC1 ZINC000261543091 135183775 /nfs/dbraw/zinc/18/37/75/135183775.db2.gz HKMQICMORIHXTI-GFCCVEGCSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@@H]1[C@@H]([NH3+])CCN1Cc1ccc(C2CC2)cc1 ZINC000261544047 135185119 /nfs/dbraw/zinc/18/51/19/135185119.db2.gz DNVRPUTVNLAKCK-ABAIWWIYSA-N 2 0 230.355 2.486 20 0 BEADRP CC[C@@H]1[C@H](C)CC[N@@H+]1C[C@H]1CCC[NH2+]C1 ZINC000261548322 135186653 /nfs/dbraw/zinc/18/66/53/135186653.db2.gz NKKWLYVOQIBZHK-FRRDWIJNSA-N 2 0 210.365 2.106 20 0 BEADRP Cc1ncsc1C[NH+]1CCC([C@H](C)[NH3+])CC1 ZINC000084149521 135188148 /nfs/dbraw/zinc/18/81/48/135188148.db2.gz BGQAIOORAWURKC-VIFPVBQESA-N 2 0 239.388 2.011 20 0 BEADRP C[C@@H]1CC[C@@H]([N@H+](C)C[C@]2(C)CC[NH2+]C2)C1 ZINC000261552340 135191408 /nfs/dbraw/zinc/19/14/08/135191408.db2.gz RDFBAFBXKNMERM-JHJVBQTASA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1CCC[C@H](C[N@@H+]2CC[C@@H]3C[NH2+]C[C@H]3C2)C1 ZINC000261552266 135191568 /nfs/dbraw/zinc/19/15/68/135191568.db2.gz MUTRJUVAGIAKIB-BARDWOONSA-N 2 0 236.403 2.354 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]C1CCCCC1 ZINC000084215373 135192322 /nfs/dbraw/zinc/19/23/22/135192322.db2.gz UZWDNUCEGSYSIH-WCQYABFASA-N 2 0 210.365 2.426 20 0 BEADRP C[C@@H](C[N@@H+]1CC[C@](C)(C[NH3+])C1)c1ccccc1 ZINC000261553591 135192779 /nfs/dbraw/zinc/19/27/79/135192779.db2.gz OBNHSEOTJIGQMB-DZGCQCFKSA-N 2 0 232.371 2.461 20 0 BEADRP C(C1CCCCCC1)[N@@H+]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000261553550 135193039 /nfs/dbraw/zinc/19/30/39/135193039.db2.gz NZMDATUUTGIFAF-LSDHHAIUSA-N 2 0 236.403 2.498 20 0 BEADRP Cc1ccc(C[N@@H+]2C[C@@H]3CC[C@H]([NH3+])[C@H]3C2)c(C)c1 ZINC000261556316 135196128 /nfs/dbraw/zinc/19/61/28/135196128.db2.gz BWSNHHYCPGYUKB-JYJNAYRXSA-N 2 0 244.382 2.473 20 0 BEADRP C[C@H]1[C@@H]([NH3+])CCN1c1cc[nH+]c2ccccc21 ZINC000261556768 135196875 /nfs/dbraw/zinc/19/68/75/135196875.db2.gz RAJLZYZSAUFQMG-JQWIXIFHSA-N 2 0 227.311 2.161 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]1[NH2+]Cc1ccc(F)cc1 ZINC000261557486 135198189 /nfs/dbraw/zinc/19/81/89/135198189.db2.gz RUDMLMWHZLONDB-CYBMUJFWSA-N 2 0 236.334 2.303 20 0 BEADRP CCOc1ccc(CN2CC[C@@H]([NH3+])[C@@H]2C)cc1 ZINC000261558407 135199698 /nfs/dbraw/zinc/19/96/98/135199698.db2.gz SHXRZSDQJYXLIH-SMDDNHRTSA-N 2 0 234.343 2.007 20 0 BEADRP Fc1cccc(CN2CC[C@@H]3[NH2+]CC[C@@H]3C2)c1 ZINC000261563400 135205632 /nfs/dbraw/zinc/20/56/32/135205632.db2.gz XBCRYJORSRBKLU-OCCSQVGLSA-N 2 0 234.318 2.010 20 0 BEADRP C(C[N@@H+]1CC[C@H]2[NH2+]CC[C@H]2C1)C1CCCC1 ZINC000261571346 135212883 /nfs/dbraw/zinc/21/28/83/135212883.db2.gz HMQJUTVSHNCZPV-UONOGXRCSA-N 2 0 222.376 2.251 20 0 BEADRP Cc1cccc(C[NH2+][C@@H]2CC[NH2+]C[C@H]2C)c1 ZINC000261571598 135214211 /nfs/dbraw/zinc/21/42/11/135214211.db2.gz HOQAGQXZIZVGDP-TZMCWYRMSA-N 2 0 218.344 2.083 20 0 BEADRP CCOc1ccccc1C[N@@H+]1CC[C@@](C)(C[NH3+])C1 ZINC000261572622 135215170 /nfs/dbraw/zinc/21/51/70/135215170.db2.gz LVHGZQMHBWDYQX-HNNXBMFYSA-N 2 0 248.370 2.256 20 0 BEADRP Cc1ccc(C[N@@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@H]3C2)cc1F ZINC000261575514 135216827 /nfs/dbraw/zinc/21/68/27/135216827.db2.gz NDJLJECDSMWMIU-KCQAQPDRSA-N 2 0 248.345 2.303 20 0 BEADRP COCC(C)(C)C[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000261576192 135217221 /nfs/dbraw/zinc/21/72/21/135217221.db2.gz NMJPTVXILSGSIB-UONOGXRCSA-N 2 0 248.370 2.393 20 0 BEADRP COCC(C)(C)C[NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000261576191 135217395 /nfs/dbraw/zinc/21/73/95/135217395.db2.gz NMJPTVXILSGSIB-KGLIPLIRSA-N 2 0 248.370 2.393 20 0 BEADRP CC[C@@H]1CCCC[N@@H+]1CC[C@@H]1CC[NH2+]C1 ZINC000084384652 135217880 /nfs/dbraw/zinc/21/78/80/135217880.db2.gz NEBSOIGYISMSQM-QWHCGFSZSA-N 2 0 210.365 2.251 20 0 BEADRP CC[C@H]1CCCC[N@@H+]1CC[C@@H]1CC[NH2+]C1 ZINC000084384655 135218109 /nfs/dbraw/zinc/21/81/09/135218109.db2.gz NEBSOIGYISMSQM-STQMWFEESA-N 2 0 210.365 2.251 20 0 BEADRP C(C[C@H]1CC[NH2+]C1)[NH2+]C1CCCCCC1 ZINC000084384922 135218308 /nfs/dbraw/zinc/21/83/08/135218308.db2.gz YSPHHSKAKNBQBR-GFCCVEGCSA-N 2 0 210.365 2.298 20 0 BEADRP C[C@H]1CCC[N@H+](CC[C@@H]2CC[NH2+]C2)CC1 ZINC000084385914 135218364 /nfs/dbraw/zinc/21/83/64/135218364.db2.gz VOSPQWKXVQJGNG-STQMWFEESA-N 2 0 210.365 2.108 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+][C@H]2CC[NH2+]C[C@H]2C)[C@@H]1C ZINC000261579861 135220824 /nfs/dbraw/zinc/22/08/24/135220824.db2.gz MMOFBQOOYKBZPI-XGFWRYKXSA-N 2 0 224.392 2.399 20 0 BEADRP Cc1ccoc1C[NH2+][C@@H]1CCCC[C@H]1C[NH3+] ZINC000261579550 135220933 /nfs/dbraw/zinc/22/09/33/135220933.db2.gz MHMYHGZACUBKOJ-NWDGAFQWSA-N 2 0 222.332 2.195 20 0 BEADRP Cc1cccc(C)c1C[N@@H+]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000261583458 135223999 /nfs/dbraw/zinc/22/39/99/135223999.db2.gz RUAYTSLCBHWOSE-LSDHHAIUSA-N 2 0 244.382 2.345 20 0 BEADRP Cc1cc(C)cc(C[N@@H+]2C[C@@H]3CC[C@H]([NH3+])[C@@H]3C2)c1 ZINC000261583187 135224463 /nfs/dbraw/zinc/22/44/63/135224463.db2.gz RQZSOLQXXCRMCT-XHSDSOJGSA-N 2 0 244.382 2.473 20 0 BEADRP C[C@H](C[N@@H+]1C[C@@H]2CC[C@@H]([NH3+])[C@@H]2C1)c1ccccc1 ZINC000261585224 135225743 /nfs/dbraw/zinc/22/57/43/135225743.db2.gz SWEFSVPLJLCQKM-SLBVQIDZSA-N 2 0 244.382 2.459 20 0 BEADRP COc1cccc([C@H](C)[NH2+][C@H]2CC[NH2+]C[C@@H]2C)c1 ZINC000261585293 135226412 /nfs/dbraw/zinc/22/64/12/135226412.db2.gz SZFKQRKXAGJVRU-HUBLWGQQSA-N 2 0 248.370 2.344 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]1[NH2+]CCOc1ccccc1 ZINC000261588009 135229162 /nfs/dbraw/zinc/22/91/62/135229162.db2.gz VIIINMWDRAYCST-AWEZNQCLSA-N 2 0 248.370 2.043 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@H]3C[NH2+]C[C@H]3C2)c(C)c1 ZINC000261589546 135230133 /nfs/dbraw/zinc/23/01/33/135230133.db2.gz WIULJQVIKAIZNY-HOCLYGCPSA-N 2 0 244.382 2.345 20 0 BEADRP Cc1[nH+]ccc(N2CC[C@@](C)(C[NH3+])C2)c1Cl ZINC000261590133 135230752 /nfs/dbraw/zinc/23/07/52/135230752.db2.gz UJCCBDPUFDYRMZ-LBPRGKRZSA-N 2 0 239.750 2.219 20 0 BEADRP Cc1[nH+]ccc(N2CC[C@](C)(C[NH3+])C2)c1Cl ZINC000261590129 135231324 /nfs/dbraw/zinc/23/13/24/135231324.db2.gz UJCCBDPUFDYRMZ-GFCCVEGCSA-N 2 0 239.750 2.219 20 0 BEADRP Cc1cc(C[N@@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@H]3C2)ccc1F ZINC000261592130 135233045 /nfs/dbraw/zinc/23/30/45/135233045.db2.gz YIEBXURHNIYXSA-KCQAQPDRSA-N 2 0 248.345 2.303 20 0 BEADRP C[C@@H]1CC[N@H+](CCC2CCCC2)C[C@H]1C[NH3+] ZINC000261599727 135237759 /nfs/dbraw/zinc/23/77/59/135237759.db2.gz ZZCHRKGNHGFAAW-TZMCWYRMSA-N 2 0 224.392 2.483 20 0 BEADRP CCC1(C[NH2+]C2CCC([NH3+])CC2)CCOCC1 ZINC000261548051 135241928 /nfs/dbraw/zinc/24/19/28/135241928.db2.gz JAAPRUDSSMJLFS-UHFFFAOYSA-N 2 0 240.391 2.053 20 0 BEADRP C[C@H](C[N@@H+]1CC[C@H](C[NH3+])C1)c1ccc(F)cc1 ZINC000261652306 135242534 /nfs/dbraw/zinc/24/25/34/135242534.db2.gz BCXWNZFTRRUMCB-VXGBXAGGSA-N 2 0 236.334 2.210 20 0 BEADRP C[C@@H]1CCC[C@H](CC[N@@H+]2CCC[NH2+]CC2)C1 ZINC000078806683 135243694 /nfs/dbraw/zinc/24/36/94/135243694.db2.gz WYCZOPFJAUQWGY-ZIAGYGMSSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H]1CC[C@]2(CC[N@H+](C[C@@]3(C)CC[NH2+]C3)C2)C1 ZINC000261742110 135248905 /nfs/dbraw/zinc/24/89/05/135248905.db2.gz IPYBQJWJXJRRKF-ILXRZTDVSA-N 2 0 236.403 2.498 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH+]1CCC([C@H]2CCC[NH2+]2)CC1 ZINC000261760769 135250987 /nfs/dbraw/zinc/25/09/87/135250987.db2.gz CYDVLUXSSZRSKX-MRVWCRGKSA-N 2 0 222.376 2.106 20 0 BEADRP CCC[N@H+](C[C@H]1CCSC1)C1CC[NH2+]CC1 ZINC000261778117 135251577 /nfs/dbraw/zinc/25/15/77/135251577.db2.gz FHEOXBJQOGOTDL-GFCCVEGCSA-N 2 0 242.432 2.204 20 0 BEADRP C[C@@H]1C[N@H+](C[C@]2(C)CC[NH2+]C2)[C@H]2CCCC[C@@H]12 ZINC000261914140 135262197 /nfs/dbraw/zinc/26/21/97/135262197.db2.gz YYQKIYCZXFZKPH-CBBWQLFWSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]1C[N@H+](C[C@]2(C)CC[NH2+]C2)[C@@H]2CCCC[C@H]21 ZINC000261914143 135262498 /nfs/dbraw/zinc/26/24/98/135262498.db2.gz YYQKIYCZXFZKPH-LXTVHRRPSA-N 2 0 236.403 2.497 20 0 BEADRP CCc1cccc(F)c1CN1C[C@@H](C)[C@H]([NH3+])C1 ZINC000261964072 135266796 /nfs/dbraw/zinc/26/67/96/135266796.db2.gz HOEVBLRMYFBDPR-QMTHXVAHSA-N 2 0 236.334 2.167 20 0 BEADRP C[NH2+]CCC1CC[NH+](Cc2cccc(N)c2)CC1 ZINC000261971314 135268394 /nfs/dbraw/zinc/26/83/94/135268394.db2.gz DERJPXRVYGTWBW-UHFFFAOYSA-N 2 0 247.386 2.090 20 0 BEADRP C[C@@H]1CCC[C@@H](C)[N@H+](C[C@@]2(C)CC[NH2+]C2)C1 ZINC000262043236 135275732 /nfs/dbraw/zinc/27/57/32/135275732.db2.gz PJMDZKLQCWQFGX-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP CC[NH+](CC)CCOCC[NH2+][C@@H]1CCC1(C)C ZINC000342574582 135290850 /nfs/dbraw/zinc/29/08/50/135290850.db2.gz ISFLQZWAUVDGTE-CYBMUJFWSA-N 2 0 242.407 2.123 20 0 BEADRP [NH3+]C[C@H]1CCC[N@H+](Cc2ccc3c(c2)CCC3)C1 ZINC000078793931 135395593 /nfs/dbraw/zinc/39/55/93/135395593.db2.gz KJKXIHGVGYADEX-CQSZACIVSA-N 2 0 244.382 2.346 20 0 BEADRP Cc1c[nH+]ccc1N1C[C@@H]([NH+]2CCCC2)C[C@@H]1C ZINC000334455338 135417919 /nfs/dbraw/zinc/41/79/19/135417919.db2.gz OCOSGPUQOJNGBN-KBPBESRZSA-N 2 0 245.370 2.453 20 0 BEADRP [NH3+]CCCC[NH2+][C@@H]1CCC[C@@H](C2CC2)C1 ZINC000081635526 135428813 /nfs/dbraw/zinc/42/88/13/135428813.db2.gz MECRISAHVXUBEQ-CHWSQXEVSA-N 2 0 210.365 2.284 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]C[C@H]1CC=CCC1 ZINC000084221219 135468481 /nfs/dbraw/zinc/46/84/81/135468481.db2.gz NOGGAAPXNSETRA-RWMBFGLXSA-N 2 0 208.349 2.060 20 0 BEADRP COc1ccc(C[N@H+](C)CC[C@H]2CC[NH2+]C2)cc1 ZINC000089749228 135541682 /nfs/dbraw/zinc/54/16/82/135541682.db2.gz OAMMWTLRRLWVRU-CYBMUJFWSA-N 2 0 248.370 2.127 20 0 BEADRP Cc1cccc(C[NH2+][C@H]2CC[NH2+]CC[C@@H]2C)c1 ZINC000335025421 135866911 /nfs/dbraw/zinc/86/69/11/135866911.db2.gz RREWFJMJOPTARB-ZFWWWQNUSA-N 2 0 232.371 2.473 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCCc2sccc21)C1C[NH2+]C1 ZINC000335062192 135886239 /nfs/dbraw/zinc/88/62/39/135886239.db2.gz YUVAADFOVVIXOG-BXKDBHETSA-N 2 0 236.384 2.323 20 0 BEADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@H](CC)C1CC1 ZINC000166050464 135930268 /nfs/dbraw/zinc/93/02/68/135930268.db2.gz MNIOGYZBSAICOW-ZIAGYGMSSA-N 2 0 242.407 2.121 20 0 BEADRP CC(C)(C)[NH+]1CCC([NH2+][C@@H]2CC23CC3)CC1 ZINC000335281843 136000231 /nfs/dbraw/zinc/00/02/31/136000231.db2.gz ZPAMCAPWMQZCGW-GFCCVEGCSA-N 2 0 222.376 2.391 20 0 BEADRP [NH3+][C@@H]1CCCC[C@H]1NCc1c(F)cccc1F ZINC000335282229 136000392 /nfs/dbraw/zinc/00/03/92/136000392.db2.gz VCVNZNSXASURJP-CHWSQXEVSA-N 2 0 240.297 2.324 20 0 BEADRP CSC1(C[N@H+](C)CC2CC[NH+](C)CC2)CC1 ZINC000347807675 136013488 /nfs/dbraw/zinc/01/34/88/136013488.db2.gz GYLYJAHMHJSKOL-UHFFFAOYSA-N 2 0 242.432 2.156 20 0 BEADRP C[C@@H]1CC[C@@H]([NH+]2CCC(C[NH+](C)C)CC2)C1 ZINC000335318198 136025863 /nfs/dbraw/zinc/02/58/63/136025863.db2.gz KAKDUWIHZISZLE-TZMCWYRMSA-N 2 0 224.392 2.449 20 0 BEADRP CC(C)(C)[NH+]1CCC([NH2+][C@H]2C[C@H]2C(F)F)CC1 ZINC000348296407 136062947 /nfs/dbraw/zinc/06/29/47/136062947.db2.gz VZYNNEHGCJUVJV-MNOVXSKESA-N 2 0 246.345 2.493 20 0 BEADRP CC(C)(C)[NH+]1CCC([NH2+][C@H]2C[C@@H]2C(F)F)CC1 ZINC000348296408 136062978 /nfs/dbraw/zinc/06/29/78/136062978.db2.gz VZYNNEHGCJUVJV-QWRGUYRKSA-N 2 0 246.345 2.493 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]CCOCC[NH+](CC)CC ZINC000348396023 136076235 /nfs/dbraw/zinc/07/62/35/136076235.db2.gz MGJHASJRNLULOG-KGLIPLIRSA-N 2 0 242.407 2.123 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]C2CC(C)(F)C2)[C@H](C)C1 ZINC000335373320 136084440 /nfs/dbraw/zinc/08/44/40/136084440.db2.gz HXQCGKVKYSFLMR-CQLXCSJHSA-N 2 0 228.355 2.197 20 0 BEADRP CC1(F)CC([NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)C1 ZINC000335373835 136084598 /nfs/dbraw/zinc/08/45/98/136084598.db2.gz OHBCBYZXPSWXOA-IGJPJIBNSA-N 2 0 226.339 2.093 20 0 BEADRP Cc1cc(N)cc(C[NH2+][C@@H]2CC[NH2+]CC[C@H]2C)c1 ZINC000335363900 136094925 /nfs/dbraw/zinc/09/49/25/136094925.db2.gz UAJUFNFNOKJHHD-IUODEOHRSA-N 2 0 247.386 2.055 20 0 BEADRP c1cc(N2CCC([NH2+][C@H]3CC34CC4)CC2)cc[nH+]1 ZINC000335548315 136097285 /nfs/dbraw/zinc/09/72/85/136097285.db2.gz ABZISZSJTOYESG-AWEZNQCLSA-N 2 0 243.354 2.193 20 0 BEADRP Cc1ccc2c(c1)[C@@H]([NH2+]CC1C[NH2+]C1)CCC2 ZINC000335552527 136098369 /nfs/dbraw/zinc/09/83/69/136098369.db2.gz OFPGFGBYBDEDEI-HNNXBMFYSA-N 2 0 230.355 2.181 20 0 BEADRP Cc1ccsc1[C@@H](C)[NH2+]C1CC[NH2+]CC1 ZINC000335567012 136107796 /nfs/dbraw/zinc/10/77/96/136107796.db2.gz IBDXBTWKFJIHIF-SNVBAGLBSA-N 2 0 224.373 2.459 20 0 BEADRP c1ccc2c(c1)NCCC[C@@H]2[NH2+]C1CC[NH2+]CC1 ZINC000335568919 136108845 /nfs/dbraw/zinc/10/88/45/136108845.db2.gz OPNIDFANBOGZSY-HNNXBMFYSA-N 2 0 245.370 2.275 20 0 BEADRP CC[C@@H](C)C[N@@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC000335571539 136109734 /nfs/dbraw/zinc/10/97/34/136109734.db2.gz FLVRDMSGMPPFBC-CHWSQXEVSA-N 2 0 210.365 2.060 20 0 BEADRP C[C@@H]1Cc2ccccc2[C@H]1[NH2+]CC(C)(C)[NH3+] ZINC000335599086 136113750 /nfs/dbraw/zinc/11/37/50/136113750.db2.gz NCVNKOCNDLRPLD-MFKMUULPSA-N 2 0 218.344 2.247 20 0 BEADRP C[C@H]1Cc2ccccc2[C@@H]1[NH2+]CC(C)(C)[NH3+] ZINC000335599085 136113761 /nfs/dbraw/zinc/11/37/61/136113761.db2.gz NCVNKOCNDLRPLD-GXFFZTMASA-N 2 0 218.344 2.247 20 0 BEADRP C[C@H]1Cc2ccccc2[C@H]1[NH2+]CC(C)(C)[NH3+] ZINC000335599083 136113913 /nfs/dbraw/zinc/11/39/13/136113913.db2.gz NCVNKOCNDLRPLD-GWCFXTLKSA-N 2 0 218.344 2.247 20 0 BEADRP C[C@H]1C[C@H](N)C[N@@H+]1CCC(C)(C)C1CC1 ZINC000405983529 397778321 /nfs/dbraw/zinc/77/83/21/397778321.db2.gz BJERUDWDKUNUDD-JQWIXIFHSA-N 2 0 210.365 2.234 20 0 BEADRP C[C@@H]1C[C@@H](C[NH3+])C[N@@H+]1C[C@@H]1C[C@H]1c1ccccc1 ZINC000414657549 398006030 /nfs/dbraw/zinc/00/60/30/398006030.db2.gz HQYGHMLFZCKXMH-VRKREXBASA-N 2 0 244.382 2.459 20 0 BEADRP Cc1[nH+]ccc(N(C)CC[NH+](C)C)c1Cl ZINC000354033396 398046427 /nfs/dbraw/zinc/04/64/27/398046427.db2.gz AVMGVHILOMKHAM-UHFFFAOYSA-N 2 0 227.739 2.041 20 0 BEADRP Cc1ccc(C[C@H]2CCC[N@@H+]2CCC[NH3+])cc1 ZINC000414689039 398018629 /nfs/dbraw/zinc/01/86/29/398018629.db2.gz FGWUNUOTIKVYEF-OAHLLOKOSA-N 2 0 232.371 2.351 20 0 BEADRP CCc1ccc(C[N@@H+]2CC[C@](C)(C[NH3+])C2)cc1 ZINC000234158921 398023110 /nfs/dbraw/zinc/02/31/10/398023110.db2.gz NMSLLMBMAWXMKV-OAHLLOKOSA-N 2 0 232.371 2.420 20 0 BEADRP CC[C@H]([NH2+]CC1=CC[N@H+](C)CC1)C(C)C ZINC000336732676 398024934 /nfs/dbraw/zinc/02/49/34/398024934.db2.gz LWAHTIHKOJXWQW-ZDUSSCGKSA-N 2 0 210.365 2.273 20 0 BEADRP C(C1CCCC1)[N@@H+]1CCC[C@@H]([C@H]2CC[NH2+]C2)C1 ZINC000414777372 398035492 /nfs/dbraw/zinc/03/54/92/398035492.db2.gz IENQWQOEBYKJOS-LSDHHAIUSA-N 2 0 236.403 2.498 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+]C[C@@H]1CCC[C@@H](C)C1 ZINC000414792078 398038736 /nfs/dbraw/zinc/03/87/36/398038736.db2.gz IMQJEGDAABTTSW-JHJVBQTASA-N 2 0 212.381 2.386 20 0 BEADRP Cc1cc(C)cc(C[NH+]2CCC(C[NH3+])CC2)c1 ZINC000038076857 397974418 /nfs/dbraw/zinc/97/44/18/397974418.db2.gz TYDXMZVQKQVBQJ-UHFFFAOYSA-N 2 0 232.371 2.474 20 0 BEADRP C[C@H](CC1CC1)[NH2+][C@H](C)[C@H]1CCC[NH2+]C1 ZINC000414817727 398042421 /nfs/dbraw/zinc/04/24/21/398042421.db2.gz BOJPSUKBSUYLNT-WZRBSPASSA-N 2 0 210.365 2.153 20 0 BEADRP CCC[C@H](C)C[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000414855178 398062782 /nfs/dbraw/zinc/06/27/82/398062782.db2.gz VVXKVRXRQWICPM-STQMWFEESA-N 2 0 212.381 2.402 20 0 BEADRP C[C@H](Cc1cccs1)[NH2+][C@@H](C)[C@H](C)[NH3+] ZINC000389297143 398068688 /nfs/dbraw/zinc/06/86/88/398068688.db2.gz GZLDWBYAPUDLEI-UTLUCORTSA-N 2 0 212.362 2.004 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@H]([NH3+])c3ccccc32)[C@@H](C)O1 ZINC000384635433 398100485 /nfs/dbraw/zinc/10/04/85/398100485.db2.gz RWCBCLWIBJTKBP-QRZGQJJPSA-N 2 0 246.354 2.287 20 0 BEADRP C1[C@@H]2C[C@@H]([NH2+][C@H]3CCC[C@H]3[C@@H]3CCC[NH2+]3)C[C@H]12 ZINC000397732293 398122771 /nfs/dbraw/zinc/12/27/71/398122771.db2.gz DOMGTMBZGSJMEV-IWTMDLJTSA-N 2 0 234.387 2.295 20 0 BEADRP C[C@H](c1ccccn1)[N@@H+]1C[C@H]2CC[NH+](C)C[C@H]2C1 ZINC001647978158 1172785636 /nfs/dbraw/zinc/78/56/36/1172785636.db2.gz YNZAYMWZQSUWNM-MCIONIFRSA-N 2 0 245.370 2.026 20 0 BEADRP C[C@H](CCC1CC1)[NH2+][C@@H]1CC[NH2+]C[C@@H]1C ZINC000398111059 322864448 /nfs/dbraw/zinc/86/44/48/322864448.db2.gz XETCOIZCYZINFU-DMDPSCGWSA-N 2 0 210.365 2.153 20 0 BEADRP [NH3+][C@H]1CCC[C@@H](C[NH2+]Cc2ccsc2)C1 ZINC000063147378 1172801932 /nfs/dbraw/zinc/80/19/32/1172801932.db2.gz NEKWJVZABGSRKT-PWSUYJOCSA-N 2 0 224.373 2.355 20 0 BEADRP CC(C)Oc1ccc(C[NH2+]C[C@H](C)C[NH3+])cc1 ZINC000258753306 322877087 /nfs/dbraw/zinc/87/70/87/322877087.db2.gz MGXKBIKGKWOSPQ-GFCCVEGCSA-N 2 0 236.359 2.158 20 0 BEADRP C(C[C@@H]1CC[NH2+]C1)[NH2+]CC1CCCCC1 ZINC000258909609 322878477 /nfs/dbraw/zinc/87/84/77/322878477.db2.gz FBZMJHSUIPACEY-CYBMUJFWSA-N 2 0 210.365 2.156 20 0 BEADRP CC(C)(C[NH2+][C@H]1CCC[C@@H]1[NH3+])C1CCC1 ZINC000258988133 322880688 /nfs/dbraw/zinc/88/06/88/322880688.db2.gz MKXPORWBYZOVCE-RYUDHWBXSA-N 2 0 210.365 2.282 20 0 BEADRP C[N@H+]1CC=C(C[NH2+][C@H]2CCC[C@@H]3C[C@@H]32)CC1 ZINC000392262188 487535886 /nfs/dbraw/zinc/53/58/86/487535886.db2.gz IVJMFMAPYMNJAY-RDBSUJKOSA-N 2 0 220.360 2.027 20 0 BEADRP FC1(F)CC[NH+](CC[C@H]2CCC[NH2+]C2)CC1 ZINC000259441221 322881918 /nfs/dbraw/zinc/88/19/18/322881918.db2.gz JVESYGZHYTVPTN-LLVKDONJSA-N 2 0 232.318 2.107 20 0 BEADRP CC(C)OCCCC[NH2+][C@@H]1CC[N@H+](C)C[C@H]1C ZINC000341277154 167206395 /nfs/dbraw/zinc/20/63/95/167206395.db2.gz KFIIORXNPSJKSN-ZIAGYGMSSA-N 2 0 242.407 2.121 20 0 BEADRP CC(C)OC[C@@H](C)[NH2+]C[C@H](C)C[NH+]1CCCC1 ZINC000337337568 167254699 /nfs/dbraw/zinc/25/46/99/167254699.db2.gz MZNRRAAMIQVYAV-UONOGXRCSA-N 2 0 242.407 2.121 20 0 BEADRP CC(C)OC[C@H](C)[NH2+]CCC[NH+]1CCCCC1 ZINC000337344830 167263007 /nfs/dbraw/zinc/26/30/07/167263007.db2.gz ULTLOAQFPMQMCY-AWEZNQCLSA-N 2 0 242.407 2.266 20 0 BEADRP COCC[C@@H](C)[N@H+](C)CC[C@H]1CCCC[NH+]1C ZINC000531780036 487601185 /nfs/dbraw/zinc/60/11/85/487601185.db2.gz ZEBCUCWWHIPQQA-ZIAGYGMSSA-N 2 0 242.407 2.218 20 0 BEADRP Cc1ccncc1C[NH2+][C@H](C)C1CC[NH+](C)CC1 ZINC000162640026 487601619 /nfs/dbraw/zinc/60/16/19/487601619.db2.gz JEGWUEMMEAPIPO-CYBMUJFWSA-N 2 0 247.386 2.210 20 0 BEADRP [NH3+]CCC1CC[NH+](CCOc2ccccc2)CC1 ZINC000043458251 487603447 /nfs/dbraw/zinc/60/34/47/487603447.db2.gz MWXZEEVGKCTRRH-UHFFFAOYSA-N 2 0 248.370 2.126 20 0 BEADRP CC[C@H](CC(F)F)C[N@@H+]1CC[C@H]([C@H](C)[NH3+])C1 ZINC000662267745 409569696 /nfs/dbraw/zinc/56/96/96/409569696.db2.gz YIDDHVDQEMDAMA-AXFHLTTASA-N 2 0 234.334 2.337 20 0 BEADRP C[C@H]([NH3+])[C@H]1CCC[N@H+](C[C@@H]2C[C@H]3C[C@H]3C2)C1 ZINC000662244085 409533244 /nfs/dbraw/zinc/53/32/44/409533244.db2.gz GLQCSASNHIOFRR-YHQUGGNUSA-N 2 0 222.376 2.092 20 0 BEADRP C[C@H]([NH3+])C1CC[NH+](CC2CC=CC2)CC1 ZINC000662244756 409535959 /nfs/dbraw/zinc/53/59/59/409535959.db2.gz HAFAIGODNSODKO-NSHDSACASA-N 2 0 208.349 2.012 20 0 BEADRP CC1(C)CCCC[C@@H]1C[N@@H+]1CC[C@@H](C[NH3+])C1 ZINC000662247741 409549199 /nfs/dbraw/zinc/54/91/99/409549199.db2.gz ZOBYZJRQMOZNMJ-QWHCGFSZSA-N 2 0 224.392 2.483 20 0 BEADRP [NH3+][C@@H]1CCCC[C@H]1[NH2+]C[C@@H]1CC[C@H]2C[C@H]2C1 ZINC000662284840 409618403 /nfs/dbraw/zinc/61/84/03/409618403.db2.gz ZBAOMDHDNDXYFS-XVIXHAIJSA-N 2 0 222.376 2.282 20 0 BEADRP CC(C)[C@@H]([NH2+]CCC[NH3+])c1ccccc1F ZINC000662303288 409627812 /nfs/dbraw/zinc/62/78/12/409627812.db2.gz VBULWWXOCDYWOB-CYBMUJFWSA-N 2 0 224.323 2.461 20 0 BEADRP CC[C@@H]1C[N@H+](CCC=C(C)C)CC[C@@H]1[NH3+] ZINC000662269673 409572114 /nfs/dbraw/zinc/57/21/14/409572114.db2.gz CVFFTEVARRAWNN-OLZOCXBDSA-N 2 0 210.365 2.402 20 0 BEADRP [NH3+]CC[C@@H]1CCCC[N@@H+]1C[C@@H]1C[C@H]2C[C@H]2C1 ZINC000662272612 409579111 /nfs/dbraw/zinc/57/91/11/409579111.db2.gz GXRCAYTYSXGQPE-CRWXNKLISA-N 2 0 222.376 2.236 20 0 BEADRP C[N@H+](Cc1cccs1)[C@@H]1CCC[NH2+]CC1 ZINC000082666683 409850493 /nfs/dbraw/zinc/85/04/93/409850493.db2.gz JZZJJDDLCCAHSZ-LLVKDONJSA-N 2 0 224.373 2.322 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H]1CCOC(C)(C)C1 ZINC000070344704 410015303 /nfs/dbraw/zinc/01/53/03/410015303.db2.gz ZNSWEGPOGDPZKB-CYBMUJFWSA-N 2 0 242.407 2.266 20 0 BEADRP CC1(C[NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)CC1 ZINC000663343770 410150365 /nfs/dbraw/zinc/15/03/65/410150365.db2.gz FAUITJXSTHSYOQ-CQSZACIVSA-N 2 0 236.403 2.498 20 0 BEADRP c1ccc([C@@H]2C[C@H]2C[NH2+]CC23CC(C2)C[NH2+]3)cc1 ZINC000663499146 410275631 /nfs/dbraw/zinc/27/56/31/410275631.db2.gz AZCRMDVDHKPSJV-ZTTSNEECSA-N 2 0 242.366 2.132 20 0 BEADRP C[C@H](C[NH2+]CC12CC(C1)C[NH2+]2)Cc1ccccc1 ZINC000663498969 410275904 /nfs/dbraw/zinc/27/59/04/410275904.db2.gz SOIVVRZAOGNNGU-JEYLPNPQSA-N 2 0 244.382 2.207 20 0 BEADRP C[C@@H]([NH3+])[C@H]1CC[N@H+](Cc2cccc3c2CCC3)C1 ZINC000650703282 410335255 /nfs/dbraw/zinc/33/52/55/410335255.db2.gz SNYHTYYKMFNUCV-OCCSQVGLSA-N 2 0 244.382 2.344 20 0 BEADRP CC1([NH3+])CC[NH+](CCc2ccccc2)CC1 ZINC000071520962 410340621 /nfs/dbraw/zinc/34/06/21/410340621.db2.gz SHDDDURCXQJUPJ-UHFFFAOYSA-N 2 0 218.344 2.042 20 0 BEADRP [NH3+]CC1(CC[NH2+]Cc2cccc(F)c2)CC1 ZINC000650712061 410342652 /nfs/dbraw/zinc/34/26/52/410342652.db2.gz PGZGZZSHHJCGEV-UHFFFAOYSA-N 2 0 222.307 2.044 20 0 BEADRP CCOc1ccccc1C[NH2+]CCC1(C[NH3+])CC1 ZINC000650711838 410342997 /nfs/dbraw/zinc/34/29/97/410342997.db2.gz FYRVRTFLFZDSDT-UHFFFAOYSA-N 2 0 248.370 2.304 20 0 BEADRP C[NH2+]Cc1ccccc1C[NH2+]Cc1ccncc1 ZINC000650718825 410356054 /nfs/dbraw/zinc/35/60/54/410356054.db2.gz XIHODDBKXXWFMS-UHFFFAOYSA-N 2 0 241.338 2.091 20 0 BEADRP Cc1cc(F)ccc1C[NH2+]CCC1(C[NH3+])CC1 ZINC000650712829 410345111 /nfs/dbraw/zinc/34/51/11/410345111.db2.gz WPFQZLXVYMTVEW-UHFFFAOYSA-N 2 0 236.334 2.353 20 0 BEADRP CC1(C)CCC[C@@H]1[NH2+]CCC1(C[NH3+])CC1 ZINC000650713676 410345736 /nfs/dbraw/zinc/34/57/36/410345736.db2.gz ZOLKGHXUUZYYIA-NSHDSACASA-N 2 0 210.365 2.284 20 0 BEADRP C[NH2+]Cc1ccccc1C[NH2+]C[C@@H]1C[C@H]1C ZINC000650720310 410358124 /nfs/dbraw/zinc/35/81/24/410358124.db2.gz LEPLBIUSAKMETE-RISCZKNCSA-N 2 0 218.344 2.152 20 0 BEADRP CC(C)C[C@H]([NH3+])CN1C[C@@H](C)OCC12CCC2 ZINC000650720710 410361631 /nfs/dbraw/zinc/36/16/31/410361631.db2.gz ZENQAOVXMRFHND-OLZOCXBDSA-N 2 0 240.391 2.003 20 0 BEADRP CC(C)C[C@H]([NH3+])CN1C[C@H](C)OCC12CCC2 ZINC000650720712 410361647 /nfs/dbraw/zinc/36/16/47/410361647.db2.gz ZENQAOVXMRFHND-STQMWFEESA-N 2 0 240.391 2.003 20 0 BEADRP COc1ccccc1[C@@H](C)[NH2+]CCC1(C[NH3+])CC1 ZINC000650742773 410378814 /nfs/dbraw/zinc/37/88/14/410378814.db2.gz DCUCKRXCEKKHHX-GFCCVEGCSA-N 2 0 248.370 2.475 20 0 BEADRP C[C@@H]([NH2+]CCC1(C[NH3+])CC1)C1CCCC1 ZINC000650743929 410380997 /nfs/dbraw/zinc/38/09/97/410380997.db2.gz BOJRMNYMJLYZRX-LLVKDONJSA-N 2 0 210.365 2.284 20 0 BEADRP C[C@H]([NH2+]CCC1(C[NH3+])CC1)c1ccoc1 ZINC000650744586 410381005 /nfs/dbraw/zinc/38/10/05/410381005.db2.gz RHFHLVZCLXXECB-JTQLQIEISA-N 2 0 208.305 2.059 20 0 BEADRP CC[C@H]1CCC[C@H]1[NH2+]CCC1(C[NH3+])CC1 ZINC000650745648 410382421 /nfs/dbraw/zinc/38/24/21/410382421.db2.gz LCTMRAMXGYTLBX-NWDGAFQWSA-N 2 0 210.365 2.284 20 0 BEADRP [NH3+]CC1(CC[NH2+][C@H]2CCC23CCC3)CC1 ZINC000650746376 410383136 /nfs/dbraw/zinc/38/31/36/410383136.db2.gz ARTWXXIAYVUOPR-NSHDSACASA-N 2 0 208.349 2.038 20 0 BEADRP [NH3+]CC1(CC[NH2+][C@@H](C2CC2)C2CCC2)CC1 ZINC000650748089 410387561 /nfs/dbraw/zinc/38/75/61/410387561.db2.gz MWZZCLUDLZHWHV-CYBMUJFWSA-N 2 0 222.376 2.284 20 0 BEADRP [NH3+]CC1(CC[NH2+][C@H]2CCCC23CCC3)CC1 ZINC000650748366 410390706 /nfs/dbraw/zinc/39/07/06/410390706.db2.gz SIYUIWHNSVIZBM-LBPRGKRZSA-N 2 0 222.376 2.428 20 0 BEADRP C[NH2+]Cc1ccccc1C[NH2+][C@H]1CCO[C@@H](C)C1 ZINC000650757304 410404695 /nfs/dbraw/zinc/40/46/95/410404695.db2.gz UFWSULNAISQWTR-WFASDCNBSA-N 2 0 248.370 2.063 20 0 BEADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H](C)[C@@H]1CCCO1 ZINC000650756716 410405437 /nfs/dbraw/zinc/40/54/37/410405437.db2.gz IILRISZQFDFOFL-WFASDCNBSA-N 2 0 248.370 2.063 20 0 BEADRP C[NH2+]Cc1ccccc1C[NH2+][C@H](C)[C@H]1CCCO1 ZINC000650756714 410405523 /nfs/dbraw/zinc/40/55/23/410405523.db2.gz IILRISZQFDFOFL-IUODEOHRSA-N 2 0 248.370 2.063 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)C(C)(C)C ZINC000650760430 410407730 /nfs/dbraw/zinc/40/77/30/410407730.db2.gz CVGDWUYQCLWXQT-MROQNXINSA-N 2 0 224.392 2.399 20 0 BEADRP C(CC1CC[NH2+]CC1)[NH2+][C@H]1CCC12CCC2 ZINC000650761487 410409807 /nfs/dbraw/zinc/40/98/07/410409807.db2.gz AGWHHFZEQGFMGS-ZDUSSCGKSA-N 2 0 222.376 2.298 20 0 BEADRP C(CC1CC[NH2+]CC1)[NH2+][C@@H]1CCC12CCC2 ZINC000650761486 410410390 /nfs/dbraw/zinc/41/03/90/410410390.db2.gz AGWHHFZEQGFMGS-CYBMUJFWSA-N 2 0 222.376 2.298 20 0 BEADRP C[C@@H]([NH2+]CCC1CC[NH2+]CC1)c1cccc(O)c1 ZINC000650763202 410411368 /nfs/dbraw/zinc/41/13/68/410411368.db2.gz UPVZRLLURUPWTH-GFCCVEGCSA-N 2 0 248.370 2.433 20 0 BEADRP C[C@H]1CCC[C@H]1[NH2+]CCC1CC[NH2+]CC1 ZINC000650763553 410414537 /nfs/dbraw/zinc/41/45/37/410414537.db2.gz DFYWMQMVOHJZRL-WCQYABFASA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H](CCNc1cc[nH+]c2ccccc12)[NH+](C)C ZINC000664243854 410531732 /nfs/dbraw/zinc/53/17/32/410531732.db2.gz NBFKUBKLOPMMPY-LBPRGKRZSA-N 2 0 243.354 2.409 20 0 BEADRP CC1(C)[C@H]([NH3+])C[C@H]1[NH2+]CCCOc1ccccc1 ZINC000404784589 410571039 /nfs/dbraw/zinc/57/10/39/410571039.db2.gz PAFIFGKAVUOHQS-ZIAGYGMSSA-N 2 0 248.370 2.171 20 0 BEADRP Nc1cccc(C[NH2+][C@@H]2CCCCC[C@@H]2[NH3+])c1 ZINC000665232822 410724842 /nfs/dbraw/zinc/72/48/42/410724842.db2.gz VCDSEOMOOZVRAP-UONOGXRCSA-N 2 0 233.359 2.018 20 0 BEADRP C[NH2+]C[C@@H](C)[NH2+]C1C2CC3CC(C2)CC1C3 ZINC000665294361 410782815 /nfs/dbraw/zinc/78/28/15/410782815.db2.gz NAPWQWGWJACTDL-UIBFTYAWSA-N 2 0 222.376 2.009 20 0 BEADRP C[NH2+]C[C@H](C)N[C@H](C)c1sc(C)nc1C ZINC000665295676 410800502 /nfs/dbraw/zinc/80/05/02/410800502.db2.gz HQJSOVCGUFLJRX-JGVFFNPUSA-N 2 0 227.377 2.018 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH2+]C[C@@H]1CCCO1 ZINC000020049030 169776753 /nfs/dbraw/zinc/77/67/53/169776753.db2.gz OOVJGHUDCNPUTI-KBPBESRZSA-N 2 0 242.407 2.266 20 0 BEADRP CC(C)C[NH+]1CCC([NH2+]C(C)(C)C)CC1 ZINC000073652847 166967019 /nfs/dbraw/zinc/96/70/19/166967019.db2.gz LYAJAHCRINUXPP-UHFFFAOYSA-N 2 0 212.381 2.495 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@@H]2C[C@@H]21)C1CC[NH+](C)CC1 ZINC000396445412 410883398 /nfs/dbraw/zinc/88/33/98/410883398.db2.gz DKQLUYHHQOMBBZ-PMOUVXMZSA-N 2 0 236.403 2.495 20 0 BEADRP CC[C@@H]1CC[C@H](C)C[C@@H]1[NH2+][C@H](C)C[NH2+]C ZINC000665297630 410818039 /nfs/dbraw/zinc/81/80/39/410818039.db2.gz JBDIVHPLYZLPHC-LOWDOPEQSA-N 2 0 212.381 2.399 20 0 BEADRP C[NH2+]C[C@H](C)[NH2+][C@@H](C)C1CCC(F)(F)CC1 ZINC000665297596 410819908 /nfs/dbraw/zinc/81/99/08/410819908.db2.gz IVZIECRZLJHAKU-UWVGGRQHSA-N 2 0 234.334 2.398 20 0 BEADRP CC(C)C[NH2+]CCC[NH+]1CCC(C)CC1 ZINC000020146244 167003611 /nfs/dbraw/zinc/00/36/11/167003611.db2.gz WIGNFLAVQBSYEV-UHFFFAOYSA-N 2 0 212.381 2.354 20 0 BEADRP CC(C)C[NH2+][C@@H]1CC[N@H+](C)[C@@H]2CCC[C@H]21 ZINC000367617971 167011703 /nfs/dbraw/zinc/01/17/03/167011703.db2.gz NZQPVXUNUSVPPF-YNEHKIRRSA-N 2 0 210.365 2.105 20 0 BEADRP CC(C)C[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000250557519 167012033 /nfs/dbraw/zinc/01/20/33/167012033.db2.gz FCUDGHZDYQXJOD-JHJVBQTASA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)C[NH2+][C@@H]1CC[N@H+](C)[C@H]2CCC[C@@H]21 ZINC000367617969 167012405 /nfs/dbraw/zinc/01/24/05/167012405.db2.gz NZQPVXUNUSVPPF-UPJWGTAASA-N 2 0 210.365 2.105 20 0 BEADRP CC(C)[NH2+]Cc1ccc(OCC[NH+](C)C)cc1 ZINC000033465879 167118667 /nfs/dbraw/zinc/11/86/67/167118667.db2.gz GXRGYJHLYLSOHJ-UHFFFAOYSA-N 2 0 236.359 2.125 20 0 BEADRP CC(C)OC[C@@H](C)[NH2+][C@H]1CCC[C@H]([NH+](C)C)C1 ZINC000337348557 167259739 /nfs/dbraw/zinc/25/97/39/167259739.db2.gz ZBPDHKAFFLOSDY-RDBSUJKOSA-N 2 0 242.407 2.262 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[NH2+]CC1)[C@H]1CC1(C)C ZINC000397752825 410934440 /nfs/dbraw/zinc/93/44/40/410934440.db2.gz CGYKLESZRGZHJH-QJPTWQEYSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)C[N@H+](C)CCCNc1ccccn1 ZINC000651363691 410953690 /nfs/dbraw/zinc/95/36/90/410953690.db2.gz FCUQRFCKHNNUED-UHFFFAOYSA-N 2 0 221.348 2.471 20 0 BEADRP CC(C)[C@@H]1CCCC[C@H]1[NH2+][C@@H]1CC[NH2+]C1 ZINC000126023570 167468439 /nfs/dbraw/zinc/46/84/39/167468439.db2.gz JHDLNWFINJHWCL-FRRDWIJNSA-N 2 0 210.365 2.153 20 0 BEADRP CCC1([NH2+][C@@H](C)C2CC[NH+](C)CC2)CC1 ZINC000651396578 410978177 /nfs/dbraw/zinc/97/81/77/410978177.db2.gz OCAXTLLDDUHUDX-NSHDSACASA-N 2 0 210.365 2.249 20 0 BEADRP CCCCC[N@@H+]1CC[C@]2(C1)CCC[NH2+]C2 ZINC000309821301 410985253 /nfs/dbraw/zinc/98/52/53/410985253.db2.gz FPBXTOJLKMWFAD-CYBMUJFWSA-N 2 0 210.365 2.252 20 0 BEADRP C[C@@H](C[NH2+]C[C@H]1CCC[NH2+]C1)C(C)(C)C ZINC000162704176 487620004 /nfs/dbraw/zinc/62/00/04/487620004.db2.gz BRXXXKIFMIVWFQ-RYUDHWBXSA-N 2 0 212.381 2.258 20 0 BEADRP CC(C)CC[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000400936404 411163099 /nfs/dbraw/zinc/16/30/99/411163099.db2.gz QWKCWAATIBEFOH-JHJVBQTASA-N 2 0 210.365 2.010 20 0 BEADRP COC[C@H](CC(C)(C)C)[NH2+][C@H]1CCCN(C)C1 ZINC000651684981 411135929 /nfs/dbraw/zinc/13/59/29/411135929.db2.gz DYWQHMXBYGJZDR-STQMWFEESA-N 2 0 242.407 2.121 20 0 BEADRP C[NH+](C)CCOc1ccc(C2=CC[NH2+]CC2)cc1 ZINC000108245885 411143197 /nfs/dbraw/zinc/14/31/97/411143197.db2.gz KAPPABWWOXQETA-UHFFFAOYSA-N 2 0 246.354 2.004 20 0 BEADRP CC(C)(CCN1CC[C@H]2CC[NH2+][C@@H]2C1)C1CC1 ZINC000655940720 411160515 /nfs/dbraw/zinc/16/05/15/411160515.db2.gz GBKDZEPKCPAAMN-TZMCWYRMSA-N 2 0 236.403 2.497 20 0 BEADRP CC(C)(CCN1CC[C@@H]2CC[NH2+][C@@H]2C1)C1CC1 ZINC000655940716 411160556 /nfs/dbraw/zinc/16/05/56/411160556.db2.gz GBKDZEPKCPAAMN-GXTWGEPZSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H](c1ccccn1)N1CC2CCC1(C[NH3+])CC2 ZINC000655942644 411161428 /nfs/dbraw/zinc/16/14/28/411161428.db2.gz WPMPAYMTRDBGOB-OPFPJEHXSA-N 2 0 245.370 2.346 20 0 BEADRP CCSCCC[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000401001767 411162475 /nfs/dbraw/zinc/16/24/75/411162475.db2.gz BUDIUFFGIGYKAL-RWMBFGLXSA-N 2 0 242.432 2.107 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)C1CC1 ZINC000400993547 411168655 /nfs/dbraw/zinc/16/86/55/411168655.db2.gz ZPDMTCIWMVTUJI-FMKGYKFTSA-N 2 0 222.376 2.010 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)C1CCC1 ZINC000400989539 411168682 /nfs/dbraw/zinc/16/86/82/411168682.db2.gz XIHPXBQJWWVQTJ-SCUASFONSA-N 2 0 222.376 2.153 20 0 BEADRP CC(F)(F)CCC[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000401001296 411168745 /nfs/dbraw/zinc/16/87/45/411168745.db2.gz MVYAOBOTJQVJIB-GRYCIOLGSA-N 2 0 246.345 2.400 20 0 BEADRP COC[C@@H](CC(C)(C)C)[NH2+]C[C@@H](C)C[NH+](C)C ZINC000652201029 411171185 /nfs/dbraw/zinc/17/11/85/411171185.db2.gz RFWRLBNXXAWREZ-CHWSQXEVSA-N 2 0 244.423 2.225 20 0 BEADRP CCC(CC)[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000401038275 411173649 /nfs/dbraw/zinc/17/36/49/411173649.db2.gz IJUDTTMKSHPQNH-GMXVVIOVSA-N 2 0 210.365 2.153 20 0 BEADRP CCC(CC)[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000401038280 411173650 /nfs/dbraw/zinc/17/36/50/411173650.db2.gz IJUDTTMKSHPQNH-NTZNESFSSA-N 2 0 210.365 2.153 20 0 BEADRP FC1(F)CC(C[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)C1 ZINC000401040856 411174308 /nfs/dbraw/zinc/17/43/08/411174308.db2.gz TYFXYXXGPJATSY-IJLUTSLNSA-N 2 0 244.329 2.009 20 0 BEADRP CC[C@H](C)[NH2+]CCC[N@H+](C)CC(C)C ZINC000652221212 411175312 /nfs/dbraw/zinc/17/53/12/411175312.db2.gz SZNJJQUVCVTSHM-LBPRGKRZSA-N 2 0 200.370 2.352 20 0 BEADRP CC(C)C[N@H+](C)CCC[NH2+][C@@H](C)[C@@H]1CCCO1 ZINC000652221935 411175741 /nfs/dbraw/zinc/17/57/41/411175741.db2.gz AIQRZAKXYBCGJH-KBPBESRZSA-N 2 0 242.407 2.121 20 0 BEADRP COC[C@@H]([NH2+]CCC[N@H+](C)CC(C)C)C(C)C ZINC000652221996 411175764 /nfs/dbraw/zinc/17/57/64/411175764.db2.gz BTPGNTAPPRKIQH-CQSZACIVSA-N 2 0 244.423 2.225 20 0 BEADRP CC(C)C[N@H+](C)CCC[NH2+][C@H](C)[C@@H]1CCCO1 ZINC000652221936 411176104 /nfs/dbraw/zinc/17/61/04/411176104.db2.gz AIQRZAKXYBCGJH-KGLIPLIRSA-N 2 0 242.407 2.121 20 0 BEADRP COC[C@@H](CC(C)(C)C)[NH2+][C@H]1CCC[NH2+]CC1 ZINC000656193732 411199857 /nfs/dbraw/zinc/19/98/57/411199857.db2.gz QSLCSFGWEBBFLN-QWHCGFSZSA-N 2 0 242.407 2.169 20 0 BEADRP COC[C@@H](CC(C)(C)C)[NH2+]CC1CC[NH2+]CC1 ZINC000656193330 411200342 /nfs/dbraw/zinc/20/03/42/411200342.db2.gz GLFVUHJJKIZHAZ-CYBMUJFWSA-N 2 0 242.407 2.027 20 0 BEADRP C[C@H](Cc1ccccn1)[NH2+][C@H](C)C[C@H]1CCC[NH2+]1 ZINC000656193319 411200408 /nfs/dbraw/zinc/20/04/08/411200408.db2.gz GCGODLMABMJLTI-UMVBOHGHSA-N 2 0 247.386 2.133 20 0 BEADRP CC[C@H]([NH2+][C@H]1CCC[C@H]([NH3+])C1)C1CCOCC1 ZINC000656197066 411201553 /nfs/dbraw/zinc/20/15/53/411201553.db2.gz BBEPFJGDOUUTOT-IHRRRGAJSA-N 2 0 240.391 2.051 20 0 BEADRP CCC[C@H](C)[C@@H]1CCC[N@@H+]1C[C@H]1CC[NH2+]C1 ZINC000652343558 411208100 /nfs/dbraw/zinc/20/81/00/411208100.db2.gz WIOQRHMZQYYXJM-IHRRRGAJSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)CC[C@H]1CCC[N@@H+]1C[C@@H]1CC[NH2+]C1 ZINC000652343516 411208289 /nfs/dbraw/zinc/20/82/89/411208289.db2.gz OSBPNTCCVVXXRW-ZIAGYGMSSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1cnc(CCNc2cc[nH+]c(C)c2)c(C)c1 ZINC000656210653 411210681 /nfs/dbraw/zinc/21/06/81/411210681.db2.gz CTGBNUAANOVZLN-UHFFFAOYSA-N 2 0 241.338 2.478 20 0 BEADRP Cc1cc(N[C@H]2CCC[N@@H+]3CCCC[C@@H]23)cc[nH+]1 ZINC000656226755 411213036 /nfs/dbraw/zinc/21/30/36/411213036.db2.gz OAWJTKRTNXJYQG-GJZGRUSLSA-N 2 0 245.370 2.241 20 0 BEADRP C[C@H]1CCC[N@H+](Cc2cccc(N)c2)[C@H]1CC[NH3+] ZINC000652356110 411215137 /nfs/dbraw/zinc/21/51/37/411215137.db2.gz SCDOEEXXZNIFLV-WFASDCNBSA-N 2 0 247.386 2.218 20 0 BEADRP CC[C@@H](C)[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000658356603 411231982 /nfs/dbraw/zinc/23/19/82/411231982.db2.gz KCTWMDUFALOIOM-GFCCVEGCSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]C[C@H]1Cc2ccccc21 ZINC000310272088 411232006 /nfs/dbraw/zinc/23/20/06/411232006.db2.gz NQUXHGOUWRGMIX-GXTWGEPZSA-N 2 0 232.371 2.433 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H](C1CC1)C1CCCC1 ZINC000423202857 411238103 /nfs/dbraw/zinc/23/81/03/411238103.db2.gz RMUJJMUYOMBEJB-CYBMUJFWSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1CCC[C@@H]1C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000400880126 411165510 /nfs/dbraw/zinc/16/55/10/411165510.db2.gz ADODZBDEQZKZMT-ARILJUKYSA-N 2 0 236.403 2.400 20 0 BEADRP CCC(CC)C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000400969782 411166572 /nfs/dbraw/zinc/16/65/72/411166572.db2.gz OTVSBKPRWGPZMY-MELADBBJSA-N 2 0 224.392 2.400 20 0 BEADRP CCC1(C[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)CC1 ZINC000400977165 411167538 /nfs/dbraw/zinc/16/75/38/411167538.db2.gz PSEMTKIPPOVMGM-JHJVBQTASA-N 2 0 222.376 2.154 20 0 BEADRP c1csc(C[N@@H+](C[C@@H]2CC[NH2+]C2)C2CC2)c1 ZINC000051890050 411284856 /nfs/dbraw/zinc/28/48/56/411284856.db2.gz ZCGUHTVAPDNOIP-LLVKDONJSA-N 2 0 236.384 2.322 20 0 BEADRP CCCC[NH+](CCCC)C[C@@H]1CC[NH2+]C1 ZINC000051889408 411284947 /nfs/dbraw/zinc/28/49/47/411284947.db2.gz PRQCWOZWFFMUCU-CYBMUJFWSA-N 2 0 212.381 2.498 20 0 BEADRP CCCCC[N@H+](C[C@@H]1CC[NH2+]C1)C(C)C ZINC000051889787 411285889 /nfs/dbraw/zinc/28/58/89/411285889.db2.gz RTIZFLQHVGZQDV-CYBMUJFWSA-N 2 0 212.381 2.497 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]C[C@]2(C)CC2(F)F)[C@H](C)C1 ZINC000658220094 411299547 /nfs/dbraw/zinc/29/95/47/411299547.db2.gz OXOSJYMRQCLCQR-WOPDTQHZSA-N 2 0 246.345 2.352 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@@]2(C)CC2(F)F)CC1 ZINC000658222938 411301924 /nfs/dbraw/zinc/30/19/24/411301924.db2.gz YVNBSVQHHWJJQH-LLVKDONJSA-N 2 0 232.318 2.106 20 0 BEADRP CC[C@H]([NH2+]CC[C@@H]1CCC[N@@H+]1C)C1CC1 ZINC000658236336 411306007 /nfs/dbraw/zinc/30/60/07/411306007.db2.gz INWQLCYMKMXVCQ-STQMWFEESA-N 2 0 210.365 2.249 20 0 BEADRP C[C@H]([NH2+][C@@]1(C)CC1(C)C)C1CC[NH+](C)CC1 ZINC000658309057 411331057 /nfs/dbraw/zinc/33/10/57/411331057.db2.gz SJWYWWTYNIGMTH-FZMZJTMJSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]([NH2+][C@@]1(C)CC1(C)C)C1CC[NH+](C)CC1 ZINC000658309059 411331062 /nfs/dbraw/zinc/33/10/62/411331062.db2.gz SJWYWWTYNIGMTH-RISCZKNCSA-N 2 0 224.392 2.495 20 0 BEADRP CC(C)=CCC[NH+]1CCC([NH+](C)C)CC1 ZINC000659838634 411318102 /nfs/dbraw/zinc/31/81/02/411318102.db2.gz NPWBCYXITZVKLU-UHFFFAOYSA-N 2 0 210.365 2.369 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@H]2C(C)(C)C2(F)F)CC[N@@H+]1C ZINC000658279763 411319440 /nfs/dbraw/zinc/31/94/40/411319440.db2.gz CPDBQPQESAMTIX-MXWKQRLJSA-N 2 0 246.345 2.350 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+]CCCC[NH+](C)C)CS1 ZINC000655703020 411253153 /nfs/dbraw/zinc/25/31/53/411253153.db2.gz IWNWOEKZWLNYHK-NWDGAFQWSA-N 2 0 230.421 2.202 20 0 BEADRP Cc1ccncc1CC[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000658127170 411254140 /nfs/dbraw/zinc/25/41/40/411254140.db2.gz SEFHSWLNTFSASC-ZFWWWQNUSA-N 2 0 247.386 2.005 20 0 BEADRP CCCCC[N@@H+]1CC[C@@]2(C1)CCC[NH2+]C2 ZINC000309821303 411259785 /nfs/dbraw/zinc/25/97/85/411259785.db2.gz FPBXTOJLKMWFAD-ZDUSSCGKSA-N 2 0 210.365 2.252 20 0 BEADRP C[C@H](C[NH2+]C1CCC(C[NH3+])CC1)c1ccccn1 ZINC000656783364 411360116 /nfs/dbraw/zinc/36/01/16/411360116.db2.gz PXILKUNQNPBPFK-IYXRBSQSSA-N 2 0 247.386 2.292 20 0 BEADRP C[C@H](C[NH2+]C[C@H]1CC[NH2+][C@H](C)C1)c1ccccn1 ZINC000656783643 411360789 /nfs/dbraw/zinc/36/07/89/411360789.db2.gz SDQVNSYKGNLUSH-MCIONIFRSA-N 2 0 247.386 2.163 20 0 BEADRP Cc1cccc(C)c1CN(C)CC(C)(C)[NH3+] ZINC000656784131 411361502 /nfs/dbraw/zinc/36/15/02/411361502.db2.gz YWEUVPWHSJEHJV-UHFFFAOYSA-N 2 0 220.360 2.473 20 0 BEADRP C[C@@H](C[NH2+]C[C@@H]1CC[NH2+][C@H](C)C1)c1ccccn1 ZINC000656783642 411361772 /nfs/dbraw/zinc/36/17/72/411361772.db2.gz SDQVNSYKGNLUSH-BFHYXJOUSA-N 2 0 247.386 2.163 20 0 BEADRP FC1(C[NH+]2CCC([C@H]3CCC[NH2+]C3)CC2)CC1 ZINC000656785868 411364866 /nfs/dbraw/zinc/36/48/66/411364866.db2.gz KHNNQJWDZMUNFR-ZDUSSCGKSA-N 2 0 240.366 2.200 20 0 BEADRP [NH3+]CCC[N@@H+]1CCCC2(CCCC2)CC1 ZINC000656787373 411366008 /nfs/dbraw/zinc/36/60/08/411366008.db2.gz JPKQBCQMCNHHQO-UHFFFAOYSA-N 2 0 210.365 2.382 20 0 BEADRP CC1CCC([NH2+]CC2([NH3+])CCCC2)CC1 ZINC000656789118 411368674 /nfs/dbraw/zinc/36/86/74/411368674.db2.gz JQYXHAJPIMLDTN-UHFFFAOYSA-N 2 0 210.365 2.426 20 0 BEADRP CCCC[C@H](COC)[NH2+]CC1([NH3+])CCCC1 ZINC000656789573 411369560 /nfs/dbraw/zinc/36/95/60/411369560.db2.gz RDPRQSPSUOGHRC-GFCCVEGCSA-N 2 0 228.380 2.053 20 0 BEADRP CC(C)[C@@H]1C[C@@H]([NH2+]CC2([NH3+])CCCC2)CCO1 ZINC000656789278 411369607 /nfs/dbraw/zinc/36/96/07/411369607.db2.gz LEKDXBAPUSROAY-STQMWFEESA-N 2 0 240.391 2.051 20 0 BEADRP C[N@@H+]1CCCC[C@@H]1CC[NH+]1CC[C@H]2C[C@H]2C1 ZINC000661975811 411342501 /nfs/dbraw/zinc/34/25/01/411342501.db2.gz STSGPHTUINADRB-MELADBBJSA-N 2 0 222.376 2.203 20 0 BEADRP C[NH2+]CC1CC[NH+]([C@H](C)c2ccncc2)CC1 ZINC000063158783 411344327 /nfs/dbraw/zinc/34/43/27/411344327.db2.gz UXGRLFWVVCFHTB-GFCCVEGCSA-N 2 0 233.359 2.074 20 0 BEADRP CC1CCC([NH2+]CC2=CC[N@H+](C)CC2)CC1 ZINC000335604042 168162424 /nfs/dbraw/zinc/16/24/24/168162424.db2.gz HABRMRGGLQVHCS-UHFFFAOYSA-N 2 0 222.376 2.417 20 0 BEADRP C[C@H]1CCC[N@H+](Cc2ccncc2)[C@H]1CC[NH3+] ZINC000404275699 411387861 /nfs/dbraw/zinc/38/78/61/411387861.db2.gz APSIPQYDZYADKL-JSGCOSHPSA-N 2 0 233.359 2.031 20 0 BEADRP C[C@H]1CCC[N@H+](Cc2ccncc2)[C@@H]1CC[NH3+] ZINC000404275698 411387514 /nfs/dbraw/zinc/38/75/14/411387514.db2.gz APSIPQYDZYADKL-GXTWGEPZSA-N 2 0 233.359 2.031 20 0 BEADRP C[C@@H]1CCC[N@H+](CCc2cccnc2)[C@@H]1CC[NH3+] ZINC000404278378 411387711 /nfs/dbraw/zinc/38/77/11/411387711.db2.gz CFKZIHIIIGFBKE-UKRRQHHQSA-N 2 0 247.386 2.073 20 0 BEADRP Cc1ccc(C[N@H+]2CCC[C@H](C)[C@H]2CC[NH3+])nc1 ZINC000404407972 411394154 /nfs/dbraw/zinc/39/41/54/411394154.db2.gz AZRWPCPQFPQRID-DZGCQCFKSA-N 2 0 247.386 2.339 20 0 BEADRP CC[C@@H]1C[N@H+](Cc2ccc(OC)cc2)CC[C@@H]1[NH3+] ZINC000130728707 411409529 /nfs/dbraw/zinc/40/95/29/411409529.db2.gz MLFBPYQMOPIRBW-HIFRSBDPSA-N 2 0 248.370 2.254 20 0 BEADRP C[C@@H]1C[N@H+](C[C@@H]2CC[NH2+]C2)CCc2ccccc21 ZINC000404880771 411410776 /nfs/dbraw/zinc/41/07/76/411410776.db2.gz FVQYXAYFJZRMOH-ZIAGYGMSSA-N 2 0 244.382 2.258 20 0 BEADRP FC1(F)CC12CC[NH+](C[C@@H]1CCC[NH2+]C1)CC2 ZINC000405046943 411414781 /nfs/dbraw/zinc/41/47/81/411414781.db2.gz FOVJMVWMNLGNQJ-LLVKDONJSA-N 2 0 244.329 2.107 20 0 BEADRP FC1(F)CC12CC[NH+](CC[C@H]1CC[NH2+]C1)CC2 ZINC000405123059 411418491 /nfs/dbraw/zinc/41/84/91/411418491.db2.gz XOMSXFKGRHFHMM-LLVKDONJSA-N 2 0 244.329 2.107 20 0 BEADRP FC1(F)CC12CC[NH+](CC[C@@H]1CC[NH2+]C1)CC2 ZINC000405123062 411418855 /nfs/dbraw/zinc/41/88/55/411418855.db2.gz XOMSXFKGRHFHMM-NSHDSACASA-N 2 0 244.329 2.107 20 0 BEADRP c1cc(C[NH2+]C2CCCC2)n(-c2cc[nH+]cc2)n1 ZINC000657286099 411444648 /nfs/dbraw/zinc/44/46/48/411444648.db2.gz HPLOIPZETFALRS-UHFFFAOYSA-N 2 0 242.326 2.300 20 0 BEADRP CC[C@H]1C[C@H]([NH2+]C2CC[NH+](C(C)C)CC2)CO1 ZINC000657294088 411450071 /nfs/dbraw/zinc/45/00/71/411450071.db2.gz CYUSROVXKNZVOY-KBPBESRZSA-N 2 0 240.391 2.016 20 0 BEADRP CC(C)[NH2+]C1CC[NH+](C[C@@H]2C[C@H]3C[C@H]3C2)CC1 ZINC000660065483 411532729 /nfs/dbraw/zinc/53/27/29/411532729.db2.gz XEZCVKFXVGGKBA-BTTYYORXSA-N 2 0 236.403 2.495 20 0 BEADRP CC1(C)CCCC[C@@H]1C[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC000659850914 411476997 /nfs/dbraw/zinc/47/69/97/411476997.db2.gz WSHZNBZKMMGSCH-HZSPNIEDSA-N 2 0 236.403 2.354 20 0 BEADRP CSC1(C[NH2+]Cc2ccc3c[nH+]cn3c2)CC1 ZINC000297477201 411481989 /nfs/dbraw/zinc/48/19/89/411481989.db2.gz JJJMMHINRPQZTP-UHFFFAOYSA-N 2 0 247.367 2.320 20 0 BEADRP C[NH+](C)C[C@H]1CC[N@H+](CCC2CCC2)C1 ZINC000659926163 411501116 /nfs/dbraw/zinc/50/11/16/411501116.db2.gz MFANXSIZSWMNBU-CYBMUJFWSA-N 2 0 210.365 2.060 20 0 BEADRP CC1(C)C[C@H]([N@@H+]2CCC[C@@H](c3ncc[nH]3)C2)CO1 ZINC000660077857 411534243 /nfs/dbraw/zinc/53/42/43/411534243.db2.gz QOWOZFALETTWOD-NEPJUHHUSA-N 2 0 249.358 2.157 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)CS1 ZINC000655802675 411518338 /nfs/dbraw/zinc/51/83/38/411518338.db2.gz HIJHTYAWBLWDGZ-LPWJVIDDSA-N 2 0 242.432 2.200 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655804059 411519435 /nfs/dbraw/zinc/51/94/35/411519435.db2.gz NQYFYYMDLJQZNE-BNOWGMLFSA-N 2 0 236.359 2.140 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1cncs1 ZINC000655805775 411520156 /nfs/dbraw/zinc/52/01/56/411520156.db2.gz LAFBGVLKURWYNJ-GARJFASQSA-N 2 0 239.388 2.134 20 0 BEADRP CC[N@H+](C)C[C@H]1CC[NH+](CCC2CCC2)C1 ZINC000659990138 411521062 /nfs/dbraw/zinc/52/10/62/411521062.db2.gz YFKHBIJRHXRCPN-CQSZACIVSA-N 2 0 224.392 2.450 20 0 BEADRP CC[N@H+](C)C[C@@H]1CC[NH+](CCC2CCC2)C1 ZINC000659990136 411521455 /nfs/dbraw/zinc/52/14/55/411521455.db2.gz YFKHBIJRHXRCPN-AWEZNQCLSA-N 2 0 224.392 2.450 20 0 BEADRP COc1ccccc1C[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655825514 411527135 /nfs/dbraw/zinc/52/71/35/411527135.db2.gz GAIUEMZOSCXUFI-XBXGTLAGSA-N 2 0 248.370 2.125 20 0 BEADRP CC/C=C/C[NH2+]Cc1ccnn1-c1cc[nH+]cc1 ZINC000657480189 411528333 /nfs/dbraw/zinc/52/83/33/411528333.db2.gz SQABNAFQCRGZDL-ONEGZZNKSA-N 2 0 242.326 2.323 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H]2CCC2(C)C)C1 ZINC000308785939 170009438 /nfs/dbraw/zinc/00/94/38/170009438.db2.gz FNOTUNHGBBKSLK-RYUDHWBXSA-N 2 0 210.365 2.106 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CCC2(C)CC2)[C@@H](C)C1 ZINC000309465821 170011343 /nfs/dbraw/zinc/01/13/43/170011343.db2.gz PGMQVWHAKVLQAX-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP CC[N@@H+]1CC[C@@H](NCc2cnccc2C)[C@H](C)C1 ZINC000354498485 170012966 /nfs/dbraw/zinc/01/29/66/170012966.db2.gz JPEQTURNMXVFNZ-UKRRQHHQSA-N 2 0 247.386 2.210 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CCc2ccco2)[C@@H](C)C1 ZINC000359425944 170013079 /nfs/dbraw/zinc/01/30/79/170013079.db2.gz OISFXISJZCXXBA-GXTWGEPZSA-N 2 0 236.359 2.142 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2cccc(O)c2)C1 ZINC000037644095 170016204 /nfs/dbraw/zinc/01/62/04/170016204.db2.gz DBVQTCPPJBSYMT-QWHCGFSZSA-N 2 0 248.370 2.385 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+]Cc2ccccc2)C1 ZINC000037484258 170017210 /nfs/dbraw/zinc/01/72/10/170017210.db2.gz OFKHHAZDBGZKKG-CQSZACIVSA-N 2 0 218.344 2.118 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH+](C)CC2CC2)C[C@H]1C ZINC000336648180 170019518 /nfs/dbraw/zinc/01/95/18/170019518.db2.gz NRSAZOIPPIDPJF-YPMHNXCESA-N 2 0 210.365 2.201 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H]2CC[C@@H](C)C2)[C@H](C)C1 ZINC000309620839 170021765 /nfs/dbraw/zinc/02/17/65/170021765.db2.gz FFNHLSVBHCUBBS-SYQHCUMBSA-N 2 0 224.392 2.495 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H]2CC2(C)C)[C@@H](C)C1 ZINC000309043410 170022012 /nfs/dbraw/zinc/02/20/12/170022012.db2.gz MUAGHNVKEZFJBD-SDDRHHMPSA-N 2 0 210.365 2.105 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H]2CC[C@@H](F)C2)[C@@H](C)C1 ZINC000336778103 170022476 /nfs/dbraw/zinc/02/24/76/170022476.db2.gz KIXGLWUAOLWXGN-LOWDOPEQSA-N 2 0 228.355 2.197 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H]2CC[C@@H]2C)[C@H](C)C1 ZINC000336746411 170022550 /nfs/dbraw/zinc/02/25/50/170022550.db2.gz BKLBCAXYAGYYME-LOWDOPEQSA-N 2 0 210.365 2.105 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H]2CSC2(C)C)[C@@H](C)C1 ZINC000336779646 170023044 /nfs/dbraw/zinc/02/30/44/170023044.db2.gz PABRWJZNXNEKRN-SDDRHHMPSA-N 2 0 242.432 2.200 20 0 BEADRP CC[NH2+]CC1CC[NH+](C[C@@H]2CCSC2)CC1 ZINC000224620386 170112070 /nfs/dbraw/zinc/11/20/70/170112070.db2.gz XVHYIUVEKDSMDO-ZDUSSCGKSA-N 2 0 242.432 2.061 20 0 BEADRP CC[NH2+]CCN[C@H](C)c1sc(C)nc1C ZINC000044651749 170116198 /nfs/dbraw/zinc/11/61/98/170116198.db2.gz ZYJOAFFXYTWRAF-MRVPVSSYSA-N 2 0 227.377 2.020 20 0 BEADRP CCOCC(C)(C)C[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000310183465 170352604 /nfs/dbraw/zinc/35/26/04/170352604.db2.gz ODYOOODAMDWANH-OLZOCXBDSA-N 2 0 242.407 2.121 20 0 BEADRP CC[N@@H+]1CCC[C@@H]1CNc1[nH+]ccc2[nH]ccc21 ZINC000663319910 411623913 /nfs/dbraw/zinc/62/39/13/411623913.db2.gz WFFYGQFOVYGEFS-LLVKDONJSA-N 2 0 244.342 2.459 20 0 BEADRP Cc1c[nH+]ccc1NC[C@H](C(C)C)[NH+]1CCCC1 ZINC000663378915 411642685 /nfs/dbraw/zinc/64/26/85/411642685.db2.gz JSCYXTNCYOKTGI-OAHLLOKOSA-N 2 0 247.386 2.344 20 0 BEADRP Cc1cc(NC[C@@H](C(C)C)[NH+]2CCCC2)cc[nH+]1 ZINC000663377432 411642800 /nfs/dbraw/zinc/64/28/00/411642800.db2.gz ACRLREAOLRRBQJ-HNNXBMFYSA-N 2 0 247.386 2.344 20 0 BEADRP C[C@]1(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)CC1(F)F ZINC000657663446 411576306 /nfs/dbraw/zinc/57/63/06/411576306.db2.gz BOOHCBWMERGZBC-GRYCIOLGSA-N 2 0 244.329 2.248 20 0 BEADRP C1C[C@@H]2[C@H](C1)[C@@H]2[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000657734108 411587737 /nfs/dbraw/zinc/58/77/37/411587737.db2.gz FNPDESKYLFJAOM-VJTDZRGJSA-N 2 0 220.360 2.001 20 0 BEADRP C[C@@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)C1CC1 ZINC000657813294 411603386 /nfs/dbraw/zinc/60/33/86/411603386.db2.gz NLPMGDXFMXGVQT-GFCCVEGCSA-N 2 0 236.403 2.497 20 0 BEADRP COC1([C@H](C)[NH2+]CC(C)(C)C[NH+](C)C)CCC1 ZINC000657818579 411605971 /nfs/dbraw/zinc/60/59/71/411605971.db2.gz WGMDULMRLIIKGC-LBPRGKRZSA-N 2 0 242.407 2.121 20 0 BEADRP CC(C)=CCC[NH+]1CC[C@@]2(CC[N@@H+](C)C2)C1 ZINC000660615305 411608210 /nfs/dbraw/zinc/60/82/10/411608210.db2.gz FQQIRWQGMWNGRP-CQSZACIVSA-N 2 0 222.376 2.370 20 0 BEADRP C[N@@H+]1CC[C@]2(CC[NH+](C[C@@H]3CC[C@@H]4C[C@@H]4C3)C2)C1 ZINC000660616154 411608289 /nfs/dbraw/zinc/60/82/89/411608289.db2.gz HMUGPRNTJQJCBI-WCVJEAGWSA-N 2 0 248.414 2.450 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+]C1CC(CF)(CF)C1 ZINC000657831320 411608850 /nfs/dbraw/zinc/60/88/50/411608850.db2.gz VOGJOWKEGDTSMU-UHFFFAOYSA-N 2 0 248.361 2.394 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+][C@@H]1CCCSCC1 ZINC000657858834 411612788 /nfs/dbraw/zinc/61/27/88/411612788.db2.gz MHAFNKJBSFTMRO-NWDGAFQWSA-N 2 0 230.421 2.202 20 0 BEADRP CCCC[N@@H+]1CCC[C@]2(CC[NH+](C)C2)C1 ZINC000660656767 411614563 /nfs/dbraw/zinc/61/45/63/411614563.db2.gz XPWBGUYTNYFMLJ-CYBMUJFWSA-N 2 0 210.365 2.204 20 0 BEADRP C[N@@H+]1CC[C@]2(C1)CCC[NH+](CCC1CC1)C2 ZINC000660657796 411615068 /nfs/dbraw/zinc/61/50/68/411615068.db2.gz AJAUEZKLBFLDMT-AWEZNQCLSA-N 2 0 222.376 2.204 20 0 BEADRP CC[C@H](C)[N@@H+]1CCC[C@@]2(CC[NH+](C)C2)C1 ZINC000660662369 411615669 /nfs/dbraw/zinc/61/56/69/411615669.db2.gz IXACTWLAMYJZHK-STQMWFEESA-N 2 0 210.365 2.203 20 0 BEADRP CC[C@@H](C)[NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000663470557 411667977 /nfs/dbraw/zinc/66/79/77/411667977.db2.gz VBRVOMHKTWJRJU-TZMCWYRMSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+]CC12CC(C1)C[NH2+]2 ZINC000663497591 411678465 /nfs/dbraw/zinc/67/84/65/411678465.db2.gz HTFNFLVERWUXNM-XNWIYYODSA-N 2 0 236.281 2.059 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CC23CC(C2)C[NH2+]3)[C@H](C)C1 ZINC000663497819 411679658 /nfs/dbraw/zinc/67/96/58/411679658.db2.gz KGKHFYFPOJTHQD-LRUBOHGLSA-N 2 0 222.376 2.153 20 0 BEADRP CCCC[C@@H](COC)[NH2+]CC[C@@H]([NH3+])C(C)C ZINC000663502007 411685512 /nfs/dbraw/zinc/68/55/12/411685512.db2.gz CUBGFRBWBQEPMU-QWHCGFSZSA-N 2 0 230.396 2.155 20 0 BEADRP C[NH2+]C[C@@H](C)[NH2+]CC1CCC(C)(C)CC1 ZINC000663509445 411692148 /nfs/dbraw/zinc/69/21/48/411692148.db2.gz KTQXVWTXKMFVNE-LLVKDONJSA-N 2 0 212.381 2.400 20 0 BEADRP C[NH+]1CCC(CNc2[nH+]ccc3[nH]ccc32)CC1 ZINC000663520541 411697217 /nfs/dbraw/zinc/69/72/17/411697217.db2.gz LRVXEEUYRWTFPQ-UHFFFAOYSA-N 2 0 244.342 2.317 20 0 BEADRP CC1(C)C[C@@]1([NH2+]CCC[NH3+])c1ccccc1 ZINC000663514981 411697522 /nfs/dbraw/zinc/69/75/22/411697522.db2.gz XMCMHJJPDBEXRS-CQSZACIVSA-N 2 0 218.344 2.250 20 0 BEADRP CCC(C)(C)[C@H](C)[NH2+]C[C@@H](O)C[N@H+](C)C(C)C ZINC000661231553 411738179 /nfs/dbraw/zinc/73/81/79/411738179.db2.gz NXAZCLHHNYMOSO-QWHCGFSZSA-N 2 0 244.423 2.102 20 0 BEADRP C(C1CC[NH2+]CC1)[N@@H+]1CCC[C@H](C2CCC2)C1 ZINC000662229388 412033024 /nfs/dbraw/zinc/03/30/24/412033024.db2.gz IWDCZFKENGYSOK-HNNXBMFYSA-N 2 0 236.403 2.498 20 0 BEADRP CC[C@H](CC(F)F)C[N@@H+]1CC[C@@H]([NH3+])[C@H](C)C1 ZINC000662245505 412041959 /nfs/dbraw/zinc/04/19/59/412041959.db2.gz RTNWMUKWTVGKCO-GMTAPVOTSA-N 2 0 234.334 2.337 20 0 BEADRP CC[C@H](C[NH2+][C@](C)(CN)C1CC1)CC(F)F ZINC000662247382 412044302 /nfs/dbraw/zinc/04/43/02/412044302.db2.gz GCZDTGSTWVJVHR-JOYOIKCWSA-N 2 0 234.334 2.385 20 0 BEADRP C[C@H]1C[N@H+](CCCC2CCC2)CC[C@H]1[NH3+] ZINC000662246979 412044825 /nfs/dbraw/zinc/04/48/25/412044825.db2.gz XOMQADSQKJIGDI-WCQYABFASA-N 2 0 210.365 2.236 20 0 BEADRP CC[C@H](CC(F)F)CN1CCC[C@@H]([NH2+]C)C1 ZINC000662247197 412045264 /nfs/dbraw/zinc/04/52/64/412045264.db2.gz VHUUSLAFMWWLCV-GHMZBOCLSA-N 2 0 234.334 2.352 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+]C1CCC([NH3+])CC1 ZINC000229635423 170991208 /nfs/dbraw/zinc/99/12/08/170991208.db2.gz CDDVDRWNVAXSTF-XVSSEFHLSA-N 2 0 210.365 2.425 20 0 BEADRP CC[C@H](CC(F)F)C[N@@H+]1C[C@H](C[NH3+])C[C@H]1C ZINC000662263450 412056357 /nfs/dbraw/zinc/05/63/57/412056357.db2.gz BHSBLUQHHPYEKX-MXWKQRLJSA-N 2 0 234.334 2.337 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]CCN1CCCCC1 ZINC000336766152 171042171 /nfs/dbraw/zinc/04/21/71/171042171.db2.gz RIACPNCLAMBDQG-OLZOCXBDSA-N 2 0 210.365 2.251 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000310018933 171043918 /nfs/dbraw/zinc/04/39/18/171043918.db2.gz MGCCUOQCNXHRPB-SCRDCRAPSA-N 2 0 222.376 2.249 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000309612748 171045400 /nfs/dbraw/zinc/04/54/00/171045400.db2.gz AQWVQYUFZYSFPU-RFGFWPKPSA-N 2 0 222.376 2.391 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+]CCC[N@H+](C)C(C)C ZINC000336771825 171058458 /nfs/dbraw/zinc/05/84/58/171058458.db2.gz WZUVBHZLWLONQL-CHWSQXEVSA-N 2 0 212.381 2.495 20 0 BEADRP C([C@@H]1C[C@H]2C[C@H]2C1)[N@@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1 ZINC000662275043 412067351 /nfs/dbraw/zinc/06/73/51/412067351.db2.gz QGIIEEAXLLLLRO-GVRJEKJASA-N 2 0 248.414 2.354 20 0 BEADRP CC(C)=CCC[N@@H+]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC000662278475 412070706 /nfs/dbraw/zinc/07/07/06/412070706.db2.gz YBEMZFUVVHBASO-AWEZNQCLSA-N 2 0 222.376 2.418 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCC[C@@H](c2ccccc2)C1 ZINC000662284861 412077081 /nfs/dbraw/zinc/07/70/81/412077081.db2.gz QDBKRAXRLMYGHP-OAHLLOKOSA-N 2 0 232.371 2.476 20 0 BEADRP c1ccc([C@H]2CCC[N@@H+](C[C@H]3CC[NH2+]C3)C2)cc1 ZINC000662282507 412073419 /nfs/dbraw/zinc/07/34/19/412073419.db2.gz AZFZFKFYHOWDPE-HOCLYGCPSA-N 2 0 244.382 2.476 20 0 BEADRP C[C@@H]1C[C@H](C)[N@H+](C[C@@H]2C[C@H]3C[C@H]3C2)C[C@@H]1C[NH3+] ZINC000662283834 412074330 /nfs/dbraw/zinc/07/43/30/412074330.db2.gz QICMVCVIGSAZPJ-DXUDUQDWSA-N 2 0 236.403 2.338 20 0 BEADRP [NH3+][C@@H]1CCCC[C@H]1[NH2+]CCOCc1ccccc1 ZINC000662283828 412074536 /nfs/dbraw/zinc/07/45/36/412074536.db2.gz QGRXUSZLHQVLLU-HUUCEWRRSA-N 2 0 248.370 2.063 20 0 BEADRP CC[C@H](C)C[NH+]1CCC(OCC[NH+](C)C)CC1 ZINC000336707412 171279637 /nfs/dbraw/zinc/27/96/37/171279637.db2.gz GXAURVJFNYLLIE-ZDUSSCGKSA-N 2 0 242.407 2.075 20 0 BEADRP CC[C@H](C)C[C@H](C)[NH2+][C@@H]1CN(C)C[C@H]1C ZINC000308954355 171298120 /nfs/dbraw/zinc/29/81/20/171298120.db2.gz QCLRYEVGGRVYSN-QNWHQSFQSA-N 2 0 212.381 2.351 20 0 BEADRP CC[C@H](C)[N@@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000337256632 171320793 /nfs/dbraw/zinc/32/07/93/171320793.db2.gz SMVXTMXOIQISSJ-GXTWGEPZSA-N 2 0 224.392 2.449 20 0 BEADRP CC[C@H](C)[NH2+]CC(C)(C)C[NH+]1CCCC1 ZINC000309088027 171340327 /nfs/dbraw/zinc/34/03/27/171340327.db2.gz BFALUAVBQGMRQW-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP CC[C@H](C)[NH2+]C[C@H](C)C[NH+]1CCCCC1 ZINC000038041624 171341237 /nfs/dbraw/zinc/34/12/37/171341237.db2.gz BJQOVXMHKXNMNK-STQMWFEESA-N 2 0 212.381 2.497 20 0 BEADRP CC[C@H](C)[NH+]1CCC([C@H]2CCC[NH2+]C2)CC1 ZINC000662291318 412079771 /nfs/dbraw/zinc/07/97/71/412079771.db2.gz DNDCZGFYYKTLGY-JSGCOSHPSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@H](C)[C@H](C[NH2+]C1CC[NH+](CC)CC1)OC ZINC000362976820 171392433 /nfs/dbraw/zinc/39/24/33/171392433.db2.gz MFJBAPFFUKWDSE-JSGCOSHPSA-N 2 0 242.407 2.121 20 0 BEADRP CC[C@H](C)[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1)OC ZINC000362974925 171393107 /nfs/dbraw/zinc/39/31/07/171393107.db2.gz CCHNPYVECONCFP-FQUUOJAGSA-N 2 0 242.407 2.120 20 0 BEADRP CCc1ccc(CCN2CC3CC2(C[NH3+])C3)cc1 ZINC000662304668 412088790 /nfs/dbraw/zinc/08/87/90/412088790.db2.gz UFYJVWDPKXBWFJ-UHFFFAOYSA-N 2 0 244.382 2.215 20 0 BEADRP CC[N@H+](CCC[NH2+]C)Cc1ccc(C)cc1 ZINC000662304052 412089021 /nfs/dbraw/zinc/08/90/21/412089021.db2.gz DNRGUYKKBMMVRX-UHFFFAOYSA-N 2 0 220.360 2.426 20 0 BEADRP C[NH2+]CCC[N@@H+]1CC[C@@H](C2CCCCC2)C1 ZINC000662305977 412090435 /nfs/dbraw/zinc/09/04/35/412090435.db2.gz MKWWHFHNTMQODN-CQSZACIVSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@H]1CCCC[C@H]1C[N@@H+]1CC2CC1(C[NH3+])C2 ZINC000662306307 412090604 /nfs/dbraw/zinc/09/06/04/412090604.db2.gz QEZUUWLVEZLVRM-AHPWVWPOSA-N 2 0 222.376 2.236 20 0 BEADRP CC(C)(CC[N@@H+]1CC2CC1(C[NH3+])C2)C1CC1 ZINC000662305234 412091463 /nfs/dbraw/zinc/09/14/63/412091463.db2.gz FKGBBLQDHCKHOX-UHFFFAOYSA-N 2 0 222.376 2.236 20 0 BEADRP [NH3+]CC12CC(C1)C[N@@H+]2CC1CCCCCC1 ZINC000662307315 412093011 /nfs/dbraw/zinc/09/30/11/412093011.db2.gz ZXIXEZDGOPGHNY-UHFFFAOYSA-N 2 0 222.376 2.380 20 0 BEADRP FCC[C@H]1CCC[N@H+](CC[C@H]2CCC[NH2+]C2)C1 ZINC000662312695 412094768 /nfs/dbraw/zinc/09/47/68/412094768.db2.gz YZFNCJNMYYYBBR-ZIAGYGMSSA-N 2 0 242.382 2.448 20 0 BEADRP FCC[C@@H]1CCC[N@H+](CCC2CC[NH2+]CC2)C1 ZINC000662310624 412094774 /nfs/dbraw/zinc/09/47/74/412094774.db2.gz LSYHKHFZOQLDIG-AWEZNQCLSA-N 2 0 242.382 2.448 20 0 BEADRP C(C[N@@H+]1CCC[C@@H](C2CCC2)C1)[C@@H]1CC[NH2+]C1 ZINC000662317270 412098224 /nfs/dbraw/zinc/09/82/24/412098224.db2.gz OBGLBTOOXMSJLK-DZGCQCFKSA-N 2 0 236.403 2.498 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCO[C@H](CCC[NH+](C)C)C1 ZINC000662319149 412098897 /nfs/dbraw/zinc/09/88/97/412098897.db2.gz FMIAHFDZJBGLFE-UONOGXRCSA-N 2 0 242.407 2.075 20 0 BEADRP C[NH2+]CCC[N@H+](C)C[C@@H]1CCc2ccccc21 ZINC000662324382 412102361 /nfs/dbraw/zinc/10/23/61/412102361.db2.gz WTEKODURVZWMTK-AWEZNQCLSA-N 2 0 232.371 2.258 20 0 BEADRP c1ccc(C23CC(C2)C[N@H+]3C[C@@H]2CC[NH2+]C2)cc1 ZINC000662328527 412104622 /nfs/dbraw/zinc/10/46/22/412104622.db2.gz RPPAUNBWWAEVMH-VQCLRJIVSA-N 2 0 242.366 2.217 20 0 BEADRP Cn1cncc1-c1ccc(F)c(C[NH+](C)C)c1 ZINC000665199602 412131798 /nfs/dbraw/zinc/13/17/98/412131798.db2.gz OVQNWNVTENDBTE-UHFFFAOYSA-N 2 0 233.290 2.288 20 0 BEADRP C[N@@H+]1CCCC[C@H]1CC[NH+]1CC2CC1(C)C2 ZINC000662382578 412134050 /nfs/dbraw/zinc/13/40/50/412134050.db2.gz ZPNNREKYJRSUFW-MOKVOYLWSA-N 2 0 222.376 2.345 20 0 BEADRP C[C@H]([NH2+]Cc1ccc2occc2c1)C1C[NH2+]C1 ZINC000665238447 412178775 /nfs/dbraw/zinc/17/87/75/412178775.db2.gz YSYBTJBUJBEQTA-JTQLQIEISA-N 2 0 230.311 2.130 20 0 BEADRP Cc1ccncc1CC[NH2+][C@@H]1CCCCC[C@H]1[NH3+] ZINC000665239020 412180858 /nfs/dbraw/zinc/18/08/58/412180858.db2.gz KGJYFWYXDDQNTO-HUUCEWRRSA-N 2 0 247.386 2.182 20 0 BEADRP C[C@H]([NH2+][C@@H]1Cc2ccccc2[C@@H]1C)[C@@H]1CCC[NH2+]1 ZINC000665244149 412187319 /nfs/dbraw/zinc/18/73/19/412187319.db2.gz HHLMCWWZTPDTQX-GVAFMPQTSA-N 2 0 244.382 2.445 20 0 BEADRP C[C@@H]([NH2+]CC1([NH3+])CCCC1)C1CCSCC1 ZINC000665248352 412193494 /nfs/dbraw/zinc/19/34/94/412193494.db2.gz VLKMUIBDZLISHE-LLVKDONJSA-N 2 0 242.432 2.379 20 0 BEADRP COC[C@H]([NH2+]CC1([NH3+])CCCC1)C1CCCC1 ZINC000665247468 412193618 /nfs/dbraw/zinc/19/36/18/412193618.db2.gz CHEVAHBBHJEKJF-ZDUSSCGKSA-N 2 0 240.391 2.053 20 0 BEADRP C[C@@H]1CCC[C@H](C[NH2+][C@H]2CCCCC[C@H]2[NH3+])O1 ZINC000665264652 412207578 /nfs/dbraw/zinc/20/75/78/412207578.db2.gz FLQUQBLQPUOMLF-SYQHCUMBSA-N 2 0 240.391 2.194 20 0 BEADRP C[C@]1(C[NH2+][C@H]2CCCC[C@H]2C[NH3+])CC1(F)F ZINC000665265729 412208506 /nfs/dbraw/zinc/20/85/06/412208506.db2.gz ZWTYMEJWXRNBAJ-GARJFASQSA-N 2 0 232.318 2.139 20 0 BEADRP C[C@@H]1CCC[C@H](C[NH2+][C@@H]2CCCC[C@@H]2C[NH3+])O1 ZINC000665265179 412209416 /nfs/dbraw/zinc/20/94/16/412209416.db2.gz RMCLGTNGSZFTPN-AAVRWANBSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H]([NH2+]CC[C@]1(C)CC1(F)F)[C@@H]1CCC[NH2+]1 ZINC000665267285 412210198 /nfs/dbraw/zinc/21/01/98/412210198.db2.gz TXKFEXDWFCFLPH-OUAUKWLOSA-N 2 0 232.318 2.152 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CC[C@]1(C)CC1(F)F ZINC000665266915 412210243 /nfs/dbraw/zinc/21/02/43/412210243.db2.gz LTQLQQNPADMTMK-LPEHRKFASA-N 2 0 220.307 2.137 20 0 BEADRP C[C@]1(CC[NH2+][C@H]2CCC[C@H]2C[NH3+])CC1(F)F ZINC000665266821 412210582 /nfs/dbraw/zinc/21/05/82/412210582.db2.gz KIWVYMVKOIAFAC-DCAQKATOSA-N 2 0 232.318 2.139 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+][C@H](C)C1C[NH2+]C1)[C@@H](C)C2 ZINC000665272482 412213309 /nfs/dbraw/zinc/21/33/09/412213309.db2.gz GFSCIPORJXSFBF-HWWQOWPSSA-N 2 0 244.382 2.426 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CCc1noc2ccccc12 ZINC000665231880 412170087 /nfs/dbraw/zinc/17/00/87/412170087.db2.gz ABCAZDPKJYFCDC-MNOVXSKESA-N 2 0 247.342 2.086 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]1[NH2+]C1CCC2(CC2(F)F)CC1 ZINC000665274350 412216870 /nfs/dbraw/zinc/21/68/70/412216870.db2.gz OOJQBATTXPGHCJ-YECOWLKZSA-N 2 0 244.329 2.424 20 0 BEADRP C[C@H]([NH2+]C1CCC2(CC2(F)F)CC1)C1C[NH2+]C1 ZINC000665274639 412217448 /nfs/dbraw/zinc/21/74/48/412217448.db2.gz UZVJAURCWXXQPA-GCVQQVDUSA-N 2 0 244.329 2.152 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+]C1CCC2(CC2(F)F)CC1 ZINC000665274348 412218056 /nfs/dbraw/zinc/21/80/56/412218056.db2.gz OOJQBATTXPGHCJ-LVFLEHKBSA-N 2 0 244.329 2.424 20 0 BEADRP CO[C@H](C[NH2+][C@H]1CCC[C@@H]([NH3+])C1)C1CCCC1 ZINC000665275764 412219271 /nfs/dbraw/zinc/21/92/71/412219271.db2.gz RCBRABSKMWWZFP-HZSPNIEDSA-N 2 0 240.391 2.051 20 0 BEADRP CO[C@H](C[NH2+][C@H](C)CCCC[NH3+])C1CCCC1 ZINC000665275712 412219431 /nfs/dbraw/zinc/21/94/31/412219431.db2.gz PSUVFVPDEKRSLI-TZMCWYRMSA-N 2 0 242.407 2.299 20 0 BEADRP CC1(C)C[C@@]1(C)[NH2+]C1CCC(C[NH3+])CC1 ZINC000665275569 412219680 /nfs/dbraw/zinc/21/96/80/412219680.db2.gz MWTRULROYGCNTK-GCZXYKMCSA-N 2 0 210.365 2.282 20 0 BEADRP CC1(C)C[C@@]1(C)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000665276053 412219930 /nfs/dbraw/zinc/21/99/30/412219930.db2.gz XOEFDKOVMNPCMZ-FIOVSDBCSA-N 2 0 208.349 2.048 20 0 BEADRP CCC(C)(C)[C@H](C)[NH2+]CC12CC(C1)C[NH2+]2 ZINC000665279669 412222452 /nfs/dbraw/zinc/22/24/52/412222452.db2.gz JDAIAXJKIAXMBI-ZBOXLXRLSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@@H](C)[C@H](C)[NH2+]CC[C@@H]([NH3+])C(C)C ZINC000665279327 412222973 /nfs/dbraw/zinc/22/29/73/412222973.db2.gz ANAABICCSJWKKR-GRYCIOLGSA-N 2 0 200.370 2.384 20 0 BEADRP CC[C@@H]1CCCC[C@@H]1[NH2+]CC12CC(C1)C[NH2+]2 ZINC000665278786 412223506 /nfs/dbraw/zinc/22/35/06/412223506.db2.gz OUTFCAZSGBTKKA-DKNRTOFZSA-N 2 0 222.376 2.297 20 0 BEADRP CCC[C@@H]([NH2+]CC12CC(C1)C[NH2+]2)C1CCC1 ZINC000665280275 412224218 /nfs/dbraw/zinc/22/42/18/412224218.db2.gz XSJXHOQUHFJVLD-HRDQMINSSA-N 2 0 222.376 2.297 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+][C@@H](C)C(C)(C)C ZINC000665281129 412225821 /nfs/dbraw/zinc/22/58/21/412225821.db2.gz VKXBUIMQJLKPIX-WDEREUQCSA-N 2 0 200.370 2.384 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+][C@H](C)c1ccccn1 ZINC000665281346 412227025 /nfs/dbraw/zinc/22/70/25/412227025.db2.gz ZYPFJVVZUWDTAN-VXGBXAGGSA-N 2 0 221.348 2.106 20 0 BEADRP c1coc(CCC[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)c1 ZINC000665283720 412229475 /nfs/dbraw/zinc/22/94/75/412229475.db2.gz SWGFDKUNEMOIQW-BFHYXJOUSA-N 2 0 248.370 2.190 20 0 BEADRP CO[C@H](C[NH2+][C@@H](C)C[C@@H](C)[NH3+])C1CCCCC1 ZINC000665284038 412229645 /nfs/dbraw/zinc/22/96/45/412229645.db2.gz ZKGQUJILDRGBID-MBNYWOFBSA-N 2 0 242.407 2.297 20 0 BEADRP CC(C)[C@H]([NH3+])CCN[C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000665283716 412229924 /nfs/dbraw/zinc/22/99/24/412229924.db2.gz SUFVRJHMSPORKC-ILXRZTDVSA-N 2 0 247.386 2.094 20 0 BEADRP C[NH2+]C[C@H](C)[NH2+][C@H](C)[C@@H]1CCCC[C@H]1C ZINC000665297314 412237838 /nfs/dbraw/zinc/23/78/38/412237838.db2.gz CYIHLQWSMVYRMH-YVECIDJPSA-N 2 0 212.381 2.399 20 0 BEADRP C[NH2+]C[C@H](C)[NH2+][C@@H]1CCCC[C@@H]1C(C)C ZINC000665295468 412242605 /nfs/dbraw/zinc/24/26/05/412242605.db2.gz DTIRZASTWYVXRH-YNEHKIRRSA-N 2 0 212.381 2.399 20 0 BEADRP C[NH2+]C[C@H](C)[NH2+][C@@H]1CCCC12CCCC2 ZINC000665297304 412244350 /nfs/dbraw/zinc/24/43/50/412244350.db2.gz CXDBMLQYHYSNBZ-NWDGAFQWSA-N 2 0 210.365 2.297 20 0 BEADRP C[NH2+]C[C@H](C)[NH2+][C@@H]1CCC[C@@H](C(C)C)C1 ZINC000665298547 412246369 /nfs/dbraw/zinc/24/63/69/412246369.db2.gz XWYCVXTXYSQIQP-YNEHKIRRSA-N 2 0 212.381 2.399 20 0 BEADRP C[NH2+]C[C@H](C)[NH2+][C@H]1CCC[C@H](C(C)C)C1 ZINC000665298544 412246833 /nfs/dbraw/zinc/24/68/33/412246833.db2.gz XWYCVXTXYSQIQP-AVGNSLFASA-N 2 0 212.381 2.399 20 0 BEADRP CC(C)(C[NH2+][C@H]1CCC[C@H]1[NH3+])CC(F)(F)F ZINC000665301230 412250272 /nfs/dbraw/zinc/25/02/72/412250272.db2.gz RWZAMJFDKQUWEC-BDAKNGLRSA-N 2 0 238.297 2.434 20 0 BEADRP CCc1nccn1Cc1nccn1C(F)F ZINC000108658054 172027173 /nfs/dbraw/zinc/02/71/73/172027173.db2.gz XGMSOYBKLPHTAC-UHFFFAOYSA-N 2 0 226.230 2.085 20 0 BEADRP C[NH+](C)C1CCC([NH2+]C[C@H]2CCSC2)CC1 ZINC000336779705 172405713 /nfs/dbraw/zinc/40/57/13/172405713.db2.gz PHPOTGWPJMMPDW-PNESKVBLSA-N 2 0 242.432 2.202 20 0 BEADRP C[NH+](C)CCCC[NH2+]Cc1cccs1 ZINC000045598330 172429460 /nfs/dbraw/zinc/42/94/60/172429460.db2.gz ULOMTQOTNWMOOZ-UHFFFAOYSA-N 2 0 212.362 2.180 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@H]1CC[C@H]1C1CCC1 ZINC000309909405 172430560 /nfs/dbraw/zinc/43/05/60/172430560.db2.gz LTJTVPRCEDSZIW-KBPBESRZSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH+]1CCC(C[NH2+]C2(C)CCCC2)CC1 ZINC000054243541 172984891 /nfs/dbraw/zinc/98/48/91/172984891.db2.gz CZDCURZLERRQFJ-UHFFFAOYSA-N 2 0 210.365 2.251 20 0 BEADRP C[NH+]1CCC(C[NH2+]Cc2cccc(F)c2)CC1 ZINC000044515154 172986380 /nfs/dbraw/zinc/98/63/80/172986380.db2.gz KOOLRLDJGUVKLZ-UHFFFAOYSA-N 2 0 236.334 2.257 20 0 BEADRP C[NH+]1CCC2(CCC[N@H+](CCCF)C2)CC1 ZINC000374179494 173002833 /nfs/dbraw/zinc/00/28/33/173002833.db2.gz UAUSHVMFFFKAJP-UHFFFAOYSA-N 2 0 228.355 2.154 20 0 BEADRP C[NH+]1CCC2(CCC[N@H+](CC3CC3)C2)CC1 ZINC000369702655 173002910 /nfs/dbraw/zinc/00/29/10/173002910.db2.gz JYTVQOKKXIIMTP-UHFFFAOYSA-N 2 0 222.376 2.204 20 0 BEADRP C[N@@H+]1CCCN(c2cc[nH+]c3ccccc32)CC1 ZINC000264684444 173019730 /nfs/dbraw/zinc/01/97/30/173019730.db2.gz XVVWIKUKFBGTBV-UHFFFAOYSA-N 2 0 241.338 2.377 20 0 BEADRP C[N@H+](CCC1CC1)C[C@H]1CCC[NH+](C)C1 ZINC000336645587 173040508 /nfs/dbraw/zinc/04/05/08/173040508.db2.gz IEIWFUKXQUDSNO-ZDUSSCGKSA-N 2 0 210.365 2.060 20 0 BEADRP C[N@@H+]1CCC[C@H]2C[NH+](CC3CCC3)CC[C@@H]21 ZINC000336585045 173059644 /nfs/dbraw/zinc/05/96/44/173059644.db2.gz BIGZDHSREYJGTI-KBPBESRZSA-N 2 0 222.376 2.203 20 0 BEADRP C[N@@H+]1CCC[C@H]2C[NH+](CCC3CC3)CC[C@H]21 ZINC000335904938 173060305 /nfs/dbraw/zinc/06/03/05/173060305.db2.gz NYEYWFWAYBDVLA-UONOGXRCSA-N 2 0 222.376 2.203 20 0 BEADRP C[N@@H+]1CC[C@@]2(CC[NH+](CCc3ccccc3)C2)C1 ZINC000292206517 173139659 /nfs/dbraw/zinc/13/96/59/173139659.db2.gz SSLSTGICNMTMTP-MRXNPFEDSA-N 2 0 244.382 2.257 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CC2CCC2)[C@H]2CCC[C@@H]21 ZINC000309501066 173152497 /nfs/dbraw/zinc/15/24/97/173152497.db2.gz ZTNQMCHRWHERJX-RDBSUJKOSA-N 2 0 222.376 2.249 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CC2(C)CC2)[C@@H]2CCC[C@@H]21 ZINC000336770476 173153071 /nfs/dbraw/zinc/15/30/71/173153071.db2.gz SXOQOIXBJNQVTM-AVGNSLFASA-N 2 0 222.376 2.249 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CC2(C)CC2)[C@H]2CCC[C@@H]21 ZINC000336770475 173153537 /nfs/dbraw/zinc/15/35/37/173153537.db2.gz SXOQOIXBJNQVTM-AGIUHOORSA-N 2 0 222.376 2.249 20 0 BEADRP C[N@@H+]1CC[C@]2(CC[NH+](CC3CC(F)(F)C3)C2)C1 ZINC000336268432 173166366 /nfs/dbraw/zinc/16/63/66/173166366.db2.gz LDPCAYYBVBMALG-LBPRGKRZSA-N 2 0 244.329 2.059 20 0 BEADRP C[N@@H+]1CC[C@]2(CC[NH+](CCC(C)(C)C)C2)C1 ZINC000336280403 173168560 /nfs/dbraw/zinc/16/85/60/173168560.db2.gz CVUIVKFNWLDFAC-AWEZNQCLSA-N 2 0 224.392 2.450 20 0 BEADRP C[NH2+]C1CC[NH+](C[C@H]2CCCC[C@@H]2C)CC1 ZINC000042864245 173322551 /nfs/dbraw/zinc/32/25/51/173322551.db2.gz SGTDZEQRHDGHTK-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC(C)(C)C ZINC000054628701 173323904 /nfs/dbraw/zinc/32/39/04/173323904.db2.gz KYWASHCOVJPCQH-YOGCLGLASA-N 2 0 210.365 2.247 20 0 BEADRP C[NH2+]CC1CC[NH+](CCc2ccccc2)CC1 ZINC000011889217 173338398 /nfs/dbraw/zinc/33/83/98/173338398.db2.gz VRNXWXUZHRTKTI-UHFFFAOYSA-N 2 0 232.371 2.161 20 0 BEADRP C[NH2+]CC1CC[NH+](Cc2ccccc2C)CC1 ZINC000011889149 173338480 /nfs/dbraw/zinc/33/84/80/173338480.db2.gz DXFQNGVOZCUQMI-UHFFFAOYSA-N 2 0 232.371 2.426 20 0 BEADRP C[NH2+]CCC[N@H+](C)[C@H](C)c1ccccc1 ZINC000077299952 173346051 /nfs/dbraw/zinc/34/60/51/173346051.db2.gz UHVUAVYWAXSXBP-GFCCVEGCSA-N 2 0 206.333 2.289 20 0 BEADRP C[NH2+]CCC[N@H+](C)[C@@H]1CCc2ccccc2C1 ZINC000124798621 173346420 /nfs/dbraw/zinc/34/64/20/173346420.db2.gz MCSHONRMXBZQES-OAHLLOKOSA-N 2 0 232.371 2.085 20 0 BEADRP C[NH2+]C[C@@H]1CCC[N@H+](CC2CCCCC2)C1 ZINC000011888651 173367654 /nfs/dbraw/zinc/36/76/54/173367654.db2.gz AJWAQCQDRDZESL-AWEZNQCLSA-N 2 0 224.392 2.498 20 0 BEADRP C[NH2+]C[C@@H]1CCC[N@@H+](C2CCC(C)CC2)C1 ZINC000040591850 173367709 /nfs/dbraw/zinc/36/77/09/173367709.db2.gz HACMNYTVYYRJQE-MOKVOYLWSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH2+]C[C@@H]1CCCN1CCOc1cccc(C)c1 ZINC000019933439 173368803 /nfs/dbraw/zinc/36/88/03/173368803.db2.gz SLYQFCFRMMZVKV-AWEZNQCLSA-N 2 0 248.370 2.058 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](CCCc2ccccc2)C1 ZINC000011892049 173369789 /nfs/dbraw/zinc/36/97/89/173369789.db2.gz YBNCTWRPIRHPKI-HNNXBMFYSA-N 2 0 232.371 2.161 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](Cc2ccc(OC)c(C)c2)C1 ZINC000071142504 173370279 /nfs/dbraw/zinc/37/02/79/173370279.db2.gz JPTRKFDCWTXOIS-AWEZNQCLSA-N 2 0 248.370 2.045 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](C[C@@H]2CCC[C@H](C)C2)C1 ZINC000251672428 173370487 /nfs/dbraw/zinc/37/04/87/173370487.db2.gz GNDJYIUWQFTCNE-MJBXVCDLSA-N 2 0 224.392 2.354 20 0 BEADRP C[NH2+]C[C@H]1CCCN1C[C@@H](C)c1ccccc1 ZINC000133013164 173380015 /nfs/dbraw/zinc/38/00/15/173380015.db2.gz FNKILNQUMLSMIB-UKRRQHHQSA-N 2 0 232.371 2.474 20 0 BEADRP C[NH2+]C[C@H]1CCC[N@@H+]1C[C@@H](C)CC(C)C ZINC000300967074 173380273 /nfs/dbraw/zinc/38/02/73/173380273.db2.gz RPZLXPUGISVTFU-QWHCGFSZSA-N 2 0 212.381 2.352 20 0 BEADRP C[NH2+]C[C@H]1CC[N@H+](Cc2cccc(C)c2)C1 ZINC000011891907 173382208 /nfs/dbraw/zinc/38/22/08/173382208.db2.gz CGHVQMJPGMGXRG-CQSZACIVSA-N 2 0 218.344 2.036 20 0 BEADRP C[NH2+]C[C@@H]1CCC[N@H+](CCC=C(C)C)C1 ZINC000662238831 487626906 /nfs/dbraw/zinc/62/69/06/487626906.db2.gz XXMJTTROLVDWET-ZDUSSCGKSA-N 2 0 210.365 2.274 20 0 BEADRP CCC1(CC)CC[N@H+](C[C@H]2CC[NH2+]C2)C1 ZINC000087254654 487628054 /nfs/dbraw/zinc/62/80/54/487628054.db2.gz ZCWLKDLBLOQKIV-LBPRGKRZSA-N 2 0 210.365 2.108 20 0 BEADRP COCCCCC[N@@H+]1CCCC[C@@H]1CC[NH3+] ZINC000352496516 174178426 /nfs/dbraw/zinc/17/84/26/174178426.db2.gz WWYNKQLWEPMRGG-CYBMUJFWSA-N 2 0 228.380 2.006 20 0 BEADRP COCCC[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000123414966 174229382 /nfs/dbraw/zinc/22/93/82/174229382.db2.gz UNMMXZYOGJWPPF-UHFFFAOYSA-N 2 0 242.407 2.077 20 0 BEADRP COCCC[C@H](C)[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000363546412 174264101 /nfs/dbraw/zinc/26/41/01/174264101.db2.gz RKZOAPLDPKJKKU-MJBXVCDLSA-N 2 0 240.391 2.018 20 0 BEADRP COCC[C@@H](C)[NH2+]CC(C)(C)C[NH+]1CCCC1 ZINC000357877164 174382164 /nfs/dbraw/zinc/38/21/64/174382164.db2.gz NNGZWMLQDXMNKX-CYBMUJFWSA-N 2 0 242.407 2.123 20 0 BEADRP COC[C@@H]([NH2+]C1CCC([NH3+])CC1)c1ccccc1 ZINC000234685194 174481308 /nfs/dbraw/zinc/48/13/08/174481308.db2.gz IKLHGQBNXHOCGD-YMAMQOFZSA-N 2 0 248.370 2.234 20 0 BEADRP COc1ccc(C[N@H+](C)[C@@H]2CCC[NH2+]CC2)cc1 ZINC000113712529 175096358 /nfs/dbraw/zinc/09/63/58/175096358.db2.gz WLHZGLSKYAPCPF-CQSZACIVSA-N 2 0 248.370 2.269 20 0 BEADRP COc1ccc(C[N@@H+]2CC[C@H]([C@@H](C)[NH3+])C2)cc1C ZINC000126873029 175102817 /nfs/dbraw/zinc/10/28/17/175102817.db2.gz JRARVLLLAJZYFS-OCCSQVGLSA-N 2 0 248.370 2.173 20 0 BEADRP COc1ccc2c(c1)CCC[C@@H]2[NH2+]CCCC[NH3+] ZINC000037715077 175207979 /nfs/dbraw/zinc/20/79/79/175207979.db2.gz NQWPVURHKUFSSH-HNNXBMFYSA-N 2 0 248.370 2.401 20 0 BEADRP COc1cccc(C[N@H+](C)CC(C)(C)C[NH3+])c1 ZINC000051286029 175253527 /nfs/dbraw/zinc/25/35/27/175253527.db2.gz VGOFLIOMPSODBY-UHFFFAOYSA-N 2 0 236.359 2.112 20 0 BEADRP COc1cccc(C[N@@H+]2CC[C@@H]([NH3+])C[C@H]2C)c1 ZINC000049713131 175259631 /nfs/dbraw/zinc/25/96/31/175259631.db2.gz PPNDBIXHMNCWLQ-DGCLKSJQSA-N 2 0 234.343 2.007 20 0 BEADRP COc1cccc([C@H](C)[NH2+]C[C@H]2CCCN2C)c1 ZINC000177253568 175293800 /nfs/dbraw/zinc/29/38/00/175293800.db2.gz PEQFXBUCOAWLQW-GXTWGEPZSA-N 2 0 248.370 2.440 20 0 BEADRP COc1ccccc1C[N@@H+]1CC[C@@H](C)[C@@H](C[NH3+])C1 ZINC000163488177 175328049 /nfs/dbraw/zinc/32/80/49/175328049.db2.gz WKBONDJEZHGZOB-OCCSQVGLSA-N 2 0 248.370 2.112 20 0 BEADRP COc1ccccc1C[N@@H+]1CCCC[C@H]1CC[NH3+] ZINC000070074070 175328140 /nfs/dbraw/zinc/32/81/40/175328140.db2.gz WETASUQCQJWPHM-AWEZNQCLSA-N 2 0 248.370 2.399 20 0 BEADRP COc1ccccc1C[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000093209372 175331618 /nfs/dbraw/zinc/33/16/18/175331618.db2.gz FBMQDGFQGCOZEV-OLZOCXBDSA-N 2 0 234.343 2.055 20 0 BEADRP CSC1(C[NH2+]C[C@@H]2C[C@H]2C)CC[NH+](C)CC1 ZINC000336668787 175451361 /nfs/dbraw/zinc/45/13/61/175451361.db2.gz GJLKTDGZOJPCOQ-NEPJUHHUSA-N 2 0 242.432 2.059 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H]2CCC[C@@H]3C[C@@H]32)C1 ZINC000668294948 487630891 /nfs/dbraw/zinc/63/08/91/487630891.db2.gz GWYDYLYUVPDOJF-DGTMBMJNSA-N 2 0 222.376 2.105 20 0 BEADRP CS[C@@H]1CCC[C@H]([NH2+][C@@H](C)CCC[NH3+])C1 ZINC000336675008 175549329 /nfs/dbraw/zinc/54/93/29/175549329.db2.gz HECAWENVHJQVOK-SDDRHHMPSA-N 2 0 230.421 2.378 20 0 BEADRP C[C@@H]([NH2+]CCC1CC[NH+](C)CC1)C1(C)CC1 ZINC000122141572 175872603 /nfs/dbraw/zinc/87/26/03/175872603.db2.gz CCWMQBAWKFQSHP-GFCCVEGCSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]([NH2+]CCCC[NH+](C)C)C(C)(C)C ZINC000336648945 175873635 /nfs/dbraw/zinc/87/36/35/175873635.db2.gz HBOZXOVKKWBYNZ-LLVKDONJSA-N 2 0 200.370 2.352 20 0 BEADRP C[C@@H](c1ccccn1)N(C)C[C@@H]1CCC[NH2+]C1 ZINC000095068224 176026993 /nfs/dbraw/zinc/02/69/93/176026993.db2.gz AEVYYNQGMOLKNQ-QWHCGFSZSA-N 2 0 233.359 2.074 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[N@H+]1C[C@@H]2[NH2+]CCC[C@H]2C1 ZINC000346158795 176076157 /nfs/dbraw/zinc/07/61/57/176076157.db2.gz AJRHWVIPXWLCCF-KBXIAJHMSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]1CCC[C@@H](C)C1[NH2+]CC1=CC[NH2+]CC1 ZINC000335499598 176113666 /nfs/dbraw/zinc/11/36/66/176113666.db2.gz HJEALSNUWSXJLE-VXGBXAGGSA-N 2 0 222.376 2.320 20 0 BEADRP C[C@@H]1CCC[C@@H](C[N@H+]2C[C@H]3C[NH+](C)C[C@H]3C2)C1 ZINC000193597382 176118191 /nfs/dbraw/zinc/11/81/91/176118191.db2.gz UNPGWLMRUGPGBO-TUVASFSCSA-N 2 0 236.403 2.306 20 0 BEADRP C[C@@H]1CCC[C@H](CCN[C@H]2CC[NH2+]C2)C1 ZINC000251604803 176137723 /nfs/dbraw/zinc/13/77/23/176137723.db2.gz CUXNURRAYIXTJP-UPJWGTAASA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]C2CCC([NH3+])CC2)C1 ZINC000051692917 176143612 /nfs/dbraw/zinc/14/36/12/176143612.db2.gz GJVDRBRZSYDSON-XVSSEFHLSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@@H]1CC[NH2+]C[C@H]1NCc1ccc(Cl)s1 ZINC000334863237 176186207 /nfs/dbraw/zinc/18/62/07/176186207.db2.gz LWCUYTWXUDDNLO-PSASIEDQSA-N 2 0 244.791 2.489 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CCC[C@@H]2CCC[NH2+]2)C1 ZINC000308979404 176212497 /nfs/dbraw/zinc/21/24/97/176212497.db2.gz HQOQAWNRKJXHMO-FRRDWIJNSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+][C@@H]2CC[N@H+](C)C[C@H]2C)C1 ZINC000336673289 176227049 /nfs/dbraw/zinc/22/70/49/176227049.db2.gz AKEPWHNPDBBDFQ-YIYPIFLZSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C2CC[NH2+]CC2)[C@H](C)C1 ZINC000069675256 176232963 /nfs/dbraw/zinc/23/29/63/176232963.db2.gz VPWYBMUIIVTFQE-WZRBSPASSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]CCC1(C)CC1 ZINC000336763772 176271083 /nfs/dbraw/zinc/27/10/83/176271083.db2.gz PNIBBQFTASDSIT-VXGBXAGGSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]CCC1(C)CC1 ZINC000309767178 176278621 /nfs/dbraw/zinc/27/86/21/176278621.db2.gz JRPIXFPFXLUVHB-UPJWGTAASA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+][C@@H]1CC1(C)C ZINC000045117132 176278733 /nfs/dbraw/zinc/27/87/33/176278733.db2.gz XOLBYBXNFITZAE-WISYIIOYSA-N 2 0 210.365 2.103 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+][C@@H]1CSC1(C)C ZINC000309823375 176280792 /nfs/dbraw/zinc/28/07/92/176280792.db2.gz WVTQGNGZADXBRE-DDHJBXDOSA-N 2 0 242.432 2.199 20 0 BEADRP C[C@@H]1C[N@H+](CC2CCCCC2)CC[C@@H]1[NH3+] ZINC000049710704 176286755 /nfs/dbraw/zinc/28/67/55/176286755.db2.gz JDTXEYQOJHLZCZ-YPMHNXCESA-N 2 0 210.365 2.236 20 0 BEADRP C[C@@H]1C[N@H+](CC[C@H]2CCC[NH2+]C2)C(C)(C)C1 ZINC000335664603 176293694 /nfs/dbraw/zinc/29/36/94/176293694.db2.gz UIYFUXVTSOJEHF-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H](c1ccccc1)[N@@H+]1CC[C@H]([NH3+])[C@H](C)C1 ZINC000251604119 176317281 /nfs/dbraw/zinc/31/72/81/176317281.db2.gz DEXULUOWZSCBAU-BZPMIXESSA-N 2 0 218.344 2.417 20 0 BEADRP C[C@@H]1CN(c2cc[nH+]c3ccccc32)C[C@@H]1[NH3+] ZINC000235387802 176319777 /nfs/dbraw/zinc/31/97/77/176319777.db2.gz FOEYTZBFVYKWDI-PWSUYJOCSA-N 2 0 227.311 2.018 20 0 BEADRP C[C@@H]1C[C@@H](C[NH3+])C[N@@H+]1CCCC(C)(C)C ZINC000300958956 176367798 /nfs/dbraw/zinc/36/77/98/176367798.db2.gz YFAGVUXRAUIKNV-NEPJUHHUSA-N 2 0 212.381 2.482 20 0 BEADRP C[C@@H]1C[C@@H](C[N@@H+]2C[C@@H]3CCC[C@@H]3C2)CC[NH2+]1 ZINC000235414084 176369024 /nfs/dbraw/zinc/36/90/24/176369024.db2.gz VLRLSDLJSDDBBN-RQJABVFESA-N 2 0 222.376 2.106 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000336769806 176397822 /nfs/dbraw/zinc/39/78/22/176397822.db2.gz VWNZRIWJHUFLQP-FVCCEPFGSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]Cc1ccc(F)cc1 ZINC000309325272 176618387 /nfs/dbraw/zinc/61/83/87/176618387.db2.gz HUJGYUOEWCPNSC-LLVKDONJSA-N 2 0 224.323 2.433 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H](C)c1ccccc1 ZINC000336659059 176620775 /nfs/dbraw/zinc/62/07/75/176620775.db2.gz BMCHECFBNHFIKW-VXGBXAGGSA-N 2 0 206.333 2.465 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@H](C)Cc1ccc(F)cc1 ZINC000310201250 176620807 /nfs/dbraw/zinc/62/08/07/176620807.db2.gz BWRNYTLONURTFA-VXGBXAGGSA-N 2 0 238.350 2.474 20 0 BEADRP C[C@H]([NH2+]CC1CC[NH+](C)CC1)[C@H]1CC1(C)C ZINC000336749003 176838574 /nfs/dbraw/zinc/83/85/74/176838574.db2.gz TUVQBZBOIJSGCN-WCQYABFASA-N 2 0 224.392 2.352 20 0 BEADRP C[C@H]([NH2+]CCC[NH3+])[C@@H](C)c1ccccc1 ZINC000309376645 176844572 /nfs/dbraw/zinc/84/45/72/176844572.db2.gz CTKALDBATMGIKM-NEPJUHHUSA-N 2 0 206.333 2.117 20 0 BEADRP C[C@H](c1cccs1)[N@H+](C)C[C@@H]1CC[NH2+]C1 ZINC000051889977 177048852 /nfs/dbraw/zinc/04/88/52/177048852.db2.gz UWQCPGDFYYIQES-GHMZBOCLSA-N 2 0 224.373 2.350 20 0 BEADRP C[C@@H]1C[C@H]1C[NH2+]CCC[N@@H+]1CCCC[C@@H]1C ZINC000309732275 177075220 /nfs/dbraw/zinc/07/52/20/177075220.db2.gz BLMSQLBBNLNNAT-RDBSUJKOSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1CCC[C@H](C[N@H+]2C[C@H]3C[NH+](C)C[C@H]3C2)C1 ZINC000193597366 177133067 /nfs/dbraw/zinc/13/30/67/177133067.db2.gz UNPGWLMRUGPGBO-ZQDZILKHSA-N 2 0 236.403 2.306 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@H]([NH2+]C[C@@H]2CCCN2C)C1 ZINC000300369314 177184094 /nfs/dbraw/zinc/18/40/94/177184094.db2.gz WYEIWLSRMYLTKX-ZOBORPQBSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H]1CC[C@H]([NH2+]CCC2CC[NH+](C)CC2)C1 ZINC000122000490 177204984 /nfs/dbraw/zinc/20/49/84/177204984.db2.gz KWFFJIRLPRZMRV-JSGCOSHPSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1C[N@H+](CCCC(C)(C)C)CC[C@@H]1[NH3+] ZINC000300836079 177248140 /nfs/dbraw/zinc/24/81/40/177248140.db2.gz INTNPPMNVQNEMS-RYUDHWBXSA-N 2 0 212.381 2.482 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]CCCCF ZINC000336713661 177330350 /nfs/dbraw/zinc/33/03/50/177330350.db2.gz VSEKDGSSWCAMSE-GRYCIOLGSA-N 2 0 216.344 2.054 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]CCC(C)(F)F ZINC000357719313 177330755 /nfs/dbraw/zinc/33/07/55/177330755.db2.gz ZAPRIVTYXVMETN-OUAUKWLOSA-N 2 0 234.334 2.350 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]CC1(C(F)F)CC1 ZINC000359003343 177330837 /nfs/dbraw/zinc/33/08/37/177330837.db2.gz QTAMMOKJHFZPCH-OUAUKWLOSA-N 2 0 246.345 2.350 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]CC1CCC1 ZINC000036908573 177331359 /nfs/dbraw/zinc/33/13/59/177331359.db2.gz JKIVNZGGCZWCHQ-NTZNESFSSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]Cc2ccccc2)CC[N@@H+]1C ZINC000073655701 177331600 /nfs/dbraw/zinc/33/16/00/177331600.db2.gz KZTLAVPYGULHBC-JSGCOSHPSA-N 2 0 218.344 2.259 20 0 BEADRP C[C@H]1C[C@@H]1C[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000336782347 177344614 /nfs/dbraw/zinc/34/46/14/177344614.db2.gz XIPKFPWUVBHEFK-WCQYABFASA-N 2 0 222.376 2.106 20 0 BEADRP C[C@H]1C[C@@H]1C[NH2+]CC(C)(C)C[NH+]1CCCC1 ZINC000336749559 177344996 /nfs/dbraw/zinc/34/49/96/177344996.db2.gz UDHZSZJALGGDAS-QWHCGFSZSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@H]1C[C@H](C)C[NH+](CCC[NH2+]Cc2cc[nH]c2)C1 ZINC000086251048 177359033 /nfs/dbraw/zinc/35/90/33/177359033.db2.gz XTJQBEUQYQCMBW-KBPBESRZSA-N 2 0 249.402 2.472 20 0 BEADRP C[C@H]1C[C@H](C[N@@H+]2CCCC2(C)C)CC[NH2+]1 ZINC000235661578 177362034 /nfs/dbraw/zinc/36/20/34/177362034.db2.gz SKCSDAHEWGIHIJ-NWDGAFQWSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@H]1C[C@H](C[N@@H+]2CCC[C@@H](C)CC2)CC[NH2+]1 ZINC000235311382 177362416 /nfs/dbraw/zinc/36/24/16/177362416.db2.gz IASXGRNIGYYJPC-HZSPNIEDSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]CC1CCC1 ZINC000036908571 177368847 /nfs/dbraw/zinc/36/88/47/177368847.db2.gz JKIVNZGGCZWCHQ-MDZLAQPJSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CC2CCSCC2)CC[N@@H+]1C ZINC000133658116 177368915 /nfs/dbraw/zinc/36/89/15/177368915.db2.gz HSGPWRDXQASNIR-WCQYABFASA-N 2 0 242.432 2.202 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CCN(C)C)c2ccccc21 ZINC000290402047 177369329 /nfs/dbraw/zinc/36/93/29/177369329.db2.gz SYVDJRVBMODTSI-FZMZJTMJSA-N 2 0 218.344 2.386 20 0 BEADRP C[C@H]1Cc2ccccc2[C@@H]1[NH2+]CCC[NH+](C)C ZINC000151926962 177390530 /nfs/dbraw/zinc/39/05/30/177390530.db2.gz JWNOBWXTIOWJET-SWLSCSKDSA-N 2 0 232.371 2.461 20 0 BEADRP C[C@H]1C[C@H]1C[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000488324046 225372695 /nfs/dbraw/zinc/37/26/95/225372695.db2.gz CPGFRFKLHPNIRK-ZFWWWQNUSA-N 2 0 236.403 2.450 20 0 BEADRP C[C@H](C[NH2+][C@@H](C)[C@H]1CCC[NH2+]1)CC(F)(F)F ZINC000400473787 226344261 /nfs/dbraw/zinc/34/42/61/226344261.db2.gz YZTJHIQBGDLQDH-LPEHRKFASA-N 2 0 238.297 2.305 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@@H](C)C1)[C@H]1CCC[NH2+]1 ZINC000400630250 226347984 /nfs/dbraw/zinc/34/79/84/226347984.db2.gz LPLFJCSAWJOUJS-MROQNXINSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)c1ccncc1 ZINC000401035678 226352780 /nfs/dbraw/zinc/35/27/80/226352780.db2.gz YTZUPICPADDAGY-ZGKBOVNRSA-N 2 0 245.370 2.120 20 0 BEADRP C[C@H]([N@@H+]1C[C@@H](C)[C@](C)(C[NH3+])C1)C1(C)CC1 ZINC000309033365 229309864 /nfs/dbraw/zinc/30/98/64/229309864.db2.gz DCWBJDDCTDHJHW-NTZNESFSSA-N 2 0 210.365 2.092 20 0 BEADRP C[C@H](C[N@@H+]1CC[C@H]([NH3+])C[C@H]1C)C(C)(C)C ZINC000162971357 487675607 /nfs/dbraw/zinc/67/56/07/487675607.db2.gz OSQMGWAKOYHMCE-UTUOFQBUSA-N 2 0 212.381 2.480 20 0 BEADRP C[C@H](C[N@@H+]1CC[C@@H]([NH3+])C[C@H]1C)C(C)(C)C ZINC000162971124 487675719 /nfs/dbraw/zinc/67/57/19/487675719.db2.gz OSQMGWAKOYHMCE-IJLUTSLNSA-N 2 0 212.381 2.480 20 0 BEADRP CC[C@@H](C)C[N@H+](CC)C[C@H](O)C[NH+](C)C(C)C ZINC000383842539 487677641 /nfs/dbraw/zinc/67/76/41/487677641.db2.gz ZQXQYXCBICDIEI-ZIAGYGMSSA-N 2 0 244.423 2.056 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+]C[C@@]2(C)CCCS2)C1 ZINC000087792728 487686513 /nfs/dbraw/zinc/68/65/13/487686513.db2.gz YUTMPNUTEHAENN-CHWSQXEVSA-N 2 0 242.432 2.204 20 0 BEADRP C[NH+]1CCC(C[NH2+]C[C@@]2(C)CCCS2)CC1 ZINC000087792805 487686666 /nfs/dbraw/zinc/68/66/66/487686666.db2.gz YZPHPYRDDCXMRD-CYBMUJFWSA-N 2 0 242.432 2.204 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCC[C@H]([NH3+])C1)C1CCC1 ZINC000324956795 262798762 /nfs/dbraw/zinc/79/87/62/262798762.db2.gz VWAMDECPCFTVCQ-XQQFMLRXSA-N 2 0 210.365 2.425 20 0 BEADRP CC(C)C[C@@H]1CCC[N@@H+]1CC[C@@H]1CC[NH2+]C1 ZINC000396780021 262821551 /nfs/dbraw/zinc/82/15/51/262821551.db2.gz URZICZSHJUQPIL-KBPBESRZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]([NH2+]CC1(C)CC[NH+](C)CC1)[C@@H]1CC12CC2 ZINC000527889012 262890931 /nfs/dbraw/zinc/89/09/31/262890931.db2.gz WQJQZHCYROVFAB-OLZOCXBDSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)[C@@H]1CC12CC2 ZINC000527918345 262894899 /nfs/dbraw/zinc/89/48/99/262894899.db2.gz WDLKUYWBIJRZNZ-IHRRRGAJSA-N 2 0 236.403 2.497 20 0 BEADRP C[NH2+]CCC[NH2+]CC(C)(C)c1ccccc1 ZINC000163330785 487712916 /nfs/dbraw/zinc/71/29/16/487712916.db2.gz IEUQIUDRGQRXLY-UHFFFAOYSA-N 2 0 220.360 2.163 20 0 BEADRP CC[C@@H]1C[C@H]([NH2+]CCC[N@H+](C)C(C)C)CCO1 ZINC000226340019 487714460 /nfs/dbraw/zinc/71/44/60/487714460.db2.gz JIAGANJGGRZTTH-ZIAGYGMSSA-N 2 0 242.407 2.264 20 0 BEADRP C[C@H](C[NH+]1CCC(C)([NH3+])CC1)C(C)(C)C ZINC000309739892 487723458 /nfs/dbraw/zinc/72/34/58/487723458.db2.gz DCCJXSGKEKZVHR-LLVKDONJSA-N 2 0 212.381 2.482 20 0 BEADRP FC(F)C1CC([NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)C1 ZINC000681112202 487730700 /nfs/dbraw/zinc/73/07/00/487730700.db2.gz BTCWWZWMLVIQLK-POSLAHMBSA-N 2 0 244.329 2.247 20 0 BEADRP C[C@@H](c1ccncc1)[N@@H+]1CC[C@@H](C)[C@@H](C[NH3+])C1 ZINC000163484601 487732647 /nfs/dbraw/zinc/73/26/47/487732647.db2.gz JYLRZAJAQQIHCS-DYEKYZERSA-N 2 0 233.359 2.059 20 0 BEADRP CC[C@@]1(C)CCC[N@H+](C[C@H]2CC[NH2+]C2)C1 ZINC000379462403 487734216 /nfs/dbraw/zinc/73/42/16/487734216.db2.gz UKWLVJVPNUJENT-STQMWFEESA-N 2 0 210.365 2.108 20 0 BEADRP CC(C)(C)[C@H]1CCC[N@@H+]1C[C@H]1CC[NH2+]C1 ZINC000250691603 487739196 /nfs/dbraw/zinc/73/91/96/487739196.db2.gz JWBAPILCSYUBKG-NWDGAFQWSA-N 2 0 210.365 2.106 20 0 BEADRP C([C@H]1CC[NH2+]C1)[N@@H+]1CCC[C@H]1C1CCCC1 ZINC000251023196 487745769 /nfs/dbraw/zinc/74/57/69/487745769.db2.gz FKKGFYYKAWFZGY-JSGCOSHPSA-N 2 0 222.376 2.251 20 0 BEADRP [NH3+]C[C@]12CCC[C@H]1C[N@H+](Cc1cccc(F)c1)C2 ZINC000310975138 487746839 /nfs/dbraw/zinc/74/68/39/487746839.db2.gz ITYDBDFJOSTAJH-ZFWWWQNUSA-N 2 0 248.345 2.387 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@@H]([NH3+])C1)c1cccc(O)c1 ZINC000222959075 487748168 /nfs/dbraw/zinc/74/81/68/487748168.db2.gz BMXILSSBTGFDMS-UHTWSYAYSA-N 2 0 234.343 2.313 20 0 BEADRP C[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)[C@@H]1CC1(F)F ZINC000666229498 487764871 /nfs/dbraw/zinc/76/48/71/487764871.db2.gz OTDYRUWBKJZLNR-YYJSSNLHSA-N 2 0 246.345 2.493 20 0 BEADRP CC[C@@H]1C[N@@H+]([C@H](C)c2ccncc2)CC[C@H]1[NH3+] ZINC000251585603 487772104 /nfs/dbraw/zinc/77/21/04/487772104.db2.gz CMWOQXROWDZXLO-YRGRVCCFSA-N 2 0 233.359 2.202 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1)c1ccncc1 ZINC000675926986 487793244 /nfs/dbraw/zinc/79/32/44/487793244.db2.gz KAAQCZPAILROKT-IPYPFGDCSA-N 2 0 247.386 2.257 20 0 BEADRP C[N@@H+]1CCC[C@H](CC[NH2+][C@H]2CC[C@H]2C2CC2)C1 ZINC000459799667 487800447 /nfs/dbraw/zinc/80/04/47/487800447.db2.gz YVRRDOGOSXHFLN-SNPRPXQTSA-N 2 0 236.403 2.497 20 0 BEADRP CC[C@H]1C[N@H+](Cc2ccccc2OC)CC[C@H]1[NH3+] ZINC000251923469 487807684 /nfs/dbraw/zinc/80/76/84/487807684.db2.gz YQFJSYOITMWXLP-GXTWGEPZSA-N 2 0 248.370 2.254 20 0 BEADRP C[C@@H]1CCC[C@H]([N@H+](C)C[C@H]2CC[NH2+]C2)C1 ZINC000251953165 487809535 /nfs/dbraw/zinc/80/95/35/487809535.db2.gz XABDLEAURPRWHR-AGIUHOORSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@]1(c2ccc(F)cc2)CC[N@H+](CCC[NH3+])C1 ZINC000414740124 487820451 /nfs/dbraw/zinc/82/04/51/487820451.db2.gz JKZUTDHQKFBQRJ-CQSZACIVSA-N 2 0 236.334 2.138 20 0 BEADRP COc1cccc([C@@H]2C[C@@H](C)C[N@@H+]2CCC[NH3+])c1 ZINC000414740202 487820490 /nfs/dbraw/zinc/82/04/90/487820490.db2.gz KTPNDLRVHIOJJB-DOMZBBRYSA-N 2 0 248.370 2.427 20 0 BEADRP COc1ccc2c(c1)C[C@H](C)[N@@H+](CCC[NH3+])[C@H]2C ZINC000414753537 487821497 /nfs/dbraw/zinc/82/14/97/487821497.db2.gz DUHPAQMWWMJJBB-RYUDHWBXSA-N 2 0 248.370 2.352 20 0 BEADRP CC[C@H](C)[N@@H+]1CCC[C@H]([C@H]2CCC[NH2+]2)C1 ZINC000252419008 487824149 /nfs/dbraw/zinc/82/41/49/487824149.db2.gz XSRTUPIIARLOOR-RWMBFGLXSA-N 2 0 210.365 2.249 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@H](C)CSC(C)(C)C ZINC000817979550 586861103 /nfs/dbraw/zinc/86/11/03/586861103.db2.gz LOGQAQGTVVYRME-ZJUUUORDSA-N 2 0 218.410 2.234 20 0 BEADRP [NH3+]CCC[NH2+]CCc1cc(Cl)cc(Cl)c1 ZINC000415086986 487836021 /nfs/dbraw/zinc/83/60/21/487836021.db2.gz SLIHWKORNINFNH-UHFFFAOYSA-N 2 0 247.169 2.474 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000403339375 322949145 /nfs/dbraw/zinc/94/91/45/322949145.db2.gz IMDLCRGKSADQRM-DGTMBMJNSA-N 2 0 222.376 2.140 20 0 BEADRP CC(C)[C@H](C)[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000401141573 528971679 /nfs/dbraw/zinc/97/16/79/528971679.db2.gz GXMFZNZDBKDRQO-QNWHQSFQSA-N 2 0 210.365 2.009 20 0 BEADRP [NH3+]CCC[NH2+]C1(c2ccc(F)cc2)CCC1 ZINC000666652270 487852205 /nfs/dbraw/zinc/85/22/05/487852205.db2.gz ZUMZKGMRPBNOQP-UHFFFAOYSA-N 2 0 222.307 2.143 20 0 BEADRP Cc1ccc(C[N@@H+](C)C[C@H]2CC[NH2+][C@@H](C)C2)nc1 ZINC000666693929 487861900 /nfs/dbraw/zinc/86/19/00/487861900.db2.gz JIUVLWMVVJYQBQ-KBPBESRZSA-N 2 0 247.386 2.210 20 0 BEADRP [NH3+]CCC1CC[NH+](CC[C@@H]2CCCCO2)CC1 ZINC000564461030 322959676 /nfs/dbraw/zinc/95/96/76/322959676.db2.gz GVROHIMBFNWEOO-AWEZNQCLSA-N 2 0 240.391 2.006 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+]C[C@@H]1CCOc2ccccc21 ZINC000666741415 487869225 /nfs/dbraw/zinc/86/92/25/487869225.db2.gz QSSFMGHPVYOZOY-GXTWGEPZSA-N 2 0 248.370 2.126 20 0 BEADRP C[C@H](CC1CCC1)[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000666853959 487872386 /nfs/dbraw/zinc/87/23/86/487872386.db2.gz UKPMHOYIKAJRCI-RAIGVLPGSA-N 2 0 210.365 2.425 20 0 BEADRP Fc1cccc(C[NH2+]CC[C@H]2CC[NH2+]C2)c1F ZINC000666787380 487880118 /nfs/dbraw/zinc/88/01/18/487880118.db2.gz BLSHRNKDXUSVLP-SNVBAGLBSA-N 2 0 240.297 2.054 20 0 BEADRP C[C@@H](Cc1ccsc1)[NH2+]C[C@H]([NH3+])C1CC1 ZINC000666835092 487883516 /nfs/dbraw/zinc/88/35/16/487883516.db2.gz ZNUMTQKNACCAGG-CABZTGNLSA-N 2 0 224.373 2.006 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+][C@H]2CC23CC[NH2+]CC3)C1 ZINC000666954075 487891621 /nfs/dbraw/zinc/89/16/21/487891621.db2.gz PCQXMQXUNNQPLT-UPJWGTAASA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H](CC1CCC1)[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000666953740 487891657 /nfs/dbraw/zinc/89/16/57/487891657.db2.gz GORCUQYISKUIKN-DGCLKSJQSA-N 2 0 222.376 2.297 20 0 BEADRP Fc1ccccc1C[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000666952543 487891854 /nfs/dbraw/zinc/89/18/54/487891854.db2.gz ZYQQUXPJVUYBMX-ZDUSSCGKSA-N 2 0 234.318 2.057 20 0 BEADRP CC(C)C[C@H](C)C[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000666955544 487892796 /nfs/dbraw/zinc/89/27/96/487892796.db2.gz YJLHOGUBEONHQD-STQMWFEESA-N 2 0 224.392 2.400 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+]C[C@@H](C)C(C)(C)C ZINC000666878584 487895266 /nfs/dbraw/zinc/89/52/66/487895266.db2.gz OYQOWEDPXLOFNO-GHMZBOCLSA-N 2 0 200.370 2.256 20 0 BEADRP C[C@H](CC1CCC1)[NH2+][C@H]1CC[NH2+]C[C@@H]1C ZINC000666880449 487895592 /nfs/dbraw/zinc/89/55/92/487895592.db2.gz NCSSKPYCEMXRIP-LOWVWBTDSA-N 2 0 210.365 2.153 20 0 BEADRP CC1(C[NH2+]CCC[C@@H]2CCC[NH2+]2)CCC1 ZINC000336750461 487897139 /nfs/dbraw/zinc/89/71/39/487897139.db2.gz FWKBIGWRYLJYKC-GFCCVEGCSA-N 2 0 210.365 2.298 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)C1CCC1 ZINC000666993714 487902367 /nfs/dbraw/zinc/90/23/67/487902367.db2.gz GCICGJIIJAOKGT-WCQYABFASA-N 2 0 222.376 2.439 20 0 BEADRP Cc1ccc(F)c(C[NH2+][C@@H]2CC23CC[NH2+]CC3)c1 ZINC000666952281 487913846 /nfs/dbraw/zinc/91/38/46/487913846.db2.gz OBZGLCSDBNHAHL-CQSZACIVSA-N 2 0 248.345 2.366 20 0 BEADRP Cc1cccc(C[NH2+][C@@H]2CC23CC[NH2+]CC3)c1 ZINC000666950959 487913200 /nfs/dbraw/zinc/91/32/00/487913200.db2.gz UALKRJUTKJTVIW-CQSZACIVSA-N 2 0 230.355 2.227 20 0 BEADRP CCC[C@H](C)C[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000666952366 487914363 /nfs/dbraw/zinc/91/43/63/487914363.db2.gz SYSWMWKGCIKWRM-NWDGAFQWSA-N 2 0 210.365 2.154 20 0 BEADRP CCC[C@H](CC)[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000666953900 487916012 /nfs/dbraw/zinc/91/60/12/487916012.db2.gz KLLVCWNOSAGTJD-RYUDHWBXSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[NH2+]C1(C)C)C(C)(C)C ZINC000666966503 487919825 /nfs/dbraw/zinc/91/98/25/487919825.db2.gz YNERLDFBCZPQFQ-GHMZBOCLSA-N 2 0 212.381 2.399 20 0 BEADRP [NH3+]C[C@H]1CC[C@@H]([NH2+]Cc2cccc(F)c2F)C1 ZINC000666962227 487920190 /nfs/dbraw/zinc/92/01/90/487920190.db2.gz UDDCNUICJHPROH-GXSJLCMTSA-N 2 0 240.297 2.182 20 0 BEADRP C[C@H](CC1CCC1)[NH2+][C@@H]1CCCC[NH2+]C1 ZINC000666993015 487923441 /nfs/dbraw/zinc/92/34/41/487923441.db2.gz WSLBDZGRPHPNFX-DGCLKSJQSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCCC[NH2+]C1)C(C)(C)C ZINC000666993005 487923598 /nfs/dbraw/zinc/92/35/98/487923598.db2.gz UHBUHGDJSUZWQO-VXGBXAGGSA-N 2 0 212.381 2.400 20 0 BEADRP CC(C)(C)C[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000666998369 487924409 /nfs/dbraw/zinc/92/44/09/487924409.db2.gz PSLOJAMSIMGNOT-NSHDSACASA-N 2 0 210.365 2.297 20 0 BEADRP C1CC2(C1)C[C@@H]([NH2+][C@H]1CCCSC1)CC[NH2+]2 ZINC000666995664 487924465 /nfs/dbraw/zinc/92/44/65/487924465.db2.gz VPUHEODVETWDBB-RYUDHWBXSA-N 2 0 240.416 2.146 20 0 BEADRP C[C@@H](CC1CC1)[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000666995392 487924792 /nfs/dbraw/zinc/92/47/92/487924792.db2.gz MTKUJDDFJCPDBK-AAEUAGOBSA-N 2 0 222.376 2.439 20 0 BEADRP CC1(C)CCC[N@H+](C[C@H]2CC[NH2+]C2)CC1 ZINC000083680597 487927712 /nfs/dbraw/zinc/92/77/12/487927712.db2.gz PCSQBOQVHJAHHA-LBPRGKRZSA-N 2 0 210.365 2.108 20 0 BEADRP CC(C)C[C@@H]([NH3+])C[N@@H+]1CC[C@@H](C2CCC2)C1 ZINC000667060730 487929660 /nfs/dbraw/zinc/92/96/60/487929660.db2.gz HZIYSMVTKOUQFW-ZIAGYGMSSA-N 2 0 224.392 2.482 20 0 BEADRP FC1(F)C[C@]12CC[N@H+](CCC1CC[NH2+]CC1)C2 ZINC000652364259 487933202 /nfs/dbraw/zinc/93/32/02/487933202.db2.gz BQGHOECVWZRJLX-LBPRGKRZSA-N 2 0 244.329 2.107 20 0 BEADRP FC1(F)C[C@@]12CC[N@H+](CCC1CC[NH2+]CC1)C2 ZINC000652364258 487933324 /nfs/dbraw/zinc/93/33/24/487933324.db2.gz BQGHOECVWZRJLX-GFCCVEGCSA-N 2 0 244.329 2.107 20 0 BEADRP C[NH2+]CCC[N@H+](C)Cc1cccc2cnccc21 ZINC000667054946 487934681 /nfs/dbraw/zinc/93/46/81/487934681.db2.gz PWJDMZONKRKLEF-UHFFFAOYSA-N 2 0 243.354 2.276 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2CC[C@@H](C3CCC3)C2)CC[NH2+]1 ZINC000667060772 487935609 /nfs/dbraw/zinc/93/56/09/487935609.db2.gz YGSUZTHQOJNHTM-UMVBOHGHSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H](CC1CCC1)[NH2+]C1CCC([NH3+])CC1 ZINC000229694555 487937472 /nfs/dbraw/zinc/93/74/72/487937472.db2.gz RPCXILIBANVLMO-PKSQDBQZSA-N 2 0 210.365 2.425 20 0 BEADRP C(C1CCC1)[N@@H+]1CCC[C@H]([C@@H]2CCC[NH2+]2)C1 ZINC000083839906 487941750 /nfs/dbraw/zinc/94/17/50/487941750.db2.gz YMTNIUSCZAGENU-KBPBESRZSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@H]2CCCC2(F)F)CC[N@@H+]1C ZINC000394491615 323055425 /nfs/dbraw/zinc/05/54/25/323055425.db2.gz CPDFKCAMEVZNRW-IJLUTSLNSA-N 2 0 246.345 2.494 20 0 BEADRP CC(C)[C@@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)C1CC1 ZINC000570562623 323063069 /nfs/dbraw/zinc/06/30/69/323063069.db2.gz HYLGVVWJPCIRHO-ZIAGYGMSSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H](C)Cc1ccsc1 ZINC000570663006 323066453 /nfs/dbraw/zinc/06/64/53/323066453.db2.gz YDMPPAXXSNSNLR-UWVGGRQHSA-N 2 0 212.362 2.006 20 0 BEADRP Cc1cccnc1C[N@@H+]1C[C@H](C[NH3+])[C@@H](C)C[C@@H]1C ZINC000397254630 323077312 /nfs/dbraw/zinc/07/73/12/323077312.db2.gz FAYJGITWBMYPMX-IHRRRGAJSA-N 2 0 247.386 2.195 20 0 BEADRP C[C@@H](C[NH2+][C@H]1CCCC12CCC2)C[NH+](C)C ZINC000394829904 323086062 /nfs/dbraw/zinc/08/60/62/323086062.db2.gz TUVDINLIAAGHMB-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]Cc1cnc(C2CC2)s1 ZINC000563135903 323094874 /nfs/dbraw/zinc/09/48/74/323094874.db2.gz VYQHOZXYYOHHPS-BDAKNGLRSA-N 2 0 239.388 2.236 20 0 BEADRP COC[C@@H](C)C[NH2+]CC[NH2+]C1CCCCCC1 ZINC000563430581 323125026 /nfs/dbraw/zinc/12/50/26/323125026.db2.gz BIOSDNGBBUFGKM-ZDUSSCGKSA-N 2 0 242.407 2.171 20 0 BEADRP CCSCC[C@H](C)[NH2+]Cc1cnc(C)n1C ZINC000563441653 323126667 /nfs/dbraw/zinc/12/66/67/323126667.db2.gz STNYONNVFCBSPO-JTQLQIEISA-N 2 0 241.404 2.350 20 0 BEADRP CCSCC[C@@H](C)[NH2+]Cc1cnc(C)n1C ZINC000563441658 323126703 /nfs/dbraw/zinc/12/67/03/323126703.db2.gz STNYONNVFCBSPO-SNVBAGLBSA-N 2 0 241.404 2.350 20 0 BEADRP CC(C)[C@H]([NH2+]C[C@H]1CCC[NH2+]C1)C1CC1 ZINC000324209177 323136165 /nfs/dbraw/zinc/13/61/65/323136165.db2.gz CQGUHTDKGKSPFH-AAEUAGOBSA-N 2 0 210.365 2.010 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H](C)CC(C)(C)C ZINC000571312833 323141117 /nfs/dbraw/zinc/14/11/17/323141117.db2.gz HDXWOXYULJLIFY-NSHDSACASA-N 2 0 200.370 2.400 20 0 BEADRP C([NH2+][C@H]1CC[C@H]1C1CCC1)C1CC[NH2+]CC1 ZINC000571514116 323146445 /nfs/dbraw/zinc/14/64/45/323146445.db2.gz FSLPUNSEQAAJFK-KBPBESRZSA-N 2 0 222.376 2.154 20 0 BEADRP C([NH2+][C@@H]1CC[C@@H]1C1CCC1)C1CC[NH2+]CC1 ZINC000571514119 323146450 /nfs/dbraw/zinc/14/64/50/323146450.db2.gz FSLPUNSEQAAJFK-ZIAGYGMSSA-N 2 0 222.376 2.154 20 0 BEADRP CCOc1ccc(C[NH2+][C@@H]2CCC[NH2+]CC2)cc1 ZINC000414919283 323152053 /nfs/dbraw/zinc/15/20/53/323152053.db2.gz UREKYCNXSYXFSX-CQSZACIVSA-N 2 0 248.370 2.317 20 0 BEADRP CC[C@H]1CCC[C@H]1[NH2+]CCC[N@H+](C)CCOC ZINC000531940478 323155948 /nfs/dbraw/zinc/15/59/48/323155948.db2.gz ABPVOGTWFPBYOT-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)o1 ZINC000531940794 323156011 /nfs/dbraw/zinc/15/60/11/323156011.db2.gz MRBLERYZRSCBKY-WCQYABFASA-N 2 0 236.359 2.203 20 0 BEADRP C[C@@H]([NH2+]CC1CC[NH+](C)CC1)c1cscn1 ZINC000161190421 323160987 /nfs/dbraw/zinc/16/09/87/323160987.db2.gz NYMYSPCSXFLCBP-SNVBAGLBSA-N 2 0 239.388 2.136 20 0 BEADRP C[C@@H]1C[NH+](CC[C@H]2CCC[N@@H+]2C)C[C@@H](C)S1 ZINC000535469761 323173311 /nfs/dbraw/zinc/17/33/11/323173311.db2.gz VNOFLIJHDVSIMK-JHJVBQTASA-N 2 0 242.432 2.297 20 0 BEADRP COc1ccc(C[N@@H+]2C[C@@H](C[NH3+])C[C@H]2C)cc1C ZINC000250874405 323174199 /nfs/dbraw/zinc/17/41/99/323174199.db2.gz HVAODTRYECNVOX-TZMCWYRMSA-N 2 0 248.370 2.173 20 0 BEADRP CC(C)[C@H]([NH2+][C@@H]1CC[NH2+]C[C@H]1C)C1CC1 ZINC000323953515 323188326 /nfs/dbraw/zinc/18/83/26/323188326.db2.gz AAYXGQJTRYINKS-RTXFEEFZSA-N 2 0 210.365 2.009 20 0 BEADRP CCC[C@@H](C[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)OCC ZINC000530209423 323209913 /nfs/dbraw/zinc/20/99/13/323209913.db2.gz HNGAOOOKVHLJJM-PIGZVRMJSA-N 2 0 240.391 2.064 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]CC[C@H]1CCCOC1 ZINC000530212681 323216498 /nfs/dbraw/zinc/21/64/98/323216498.db2.gz RXEGVFGUMRKCIN-MCIONIFRSA-N 2 0 240.391 2.053 20 0 BEADRP C1CC1[C@@H]([NH2+][C@H]1CC[NH2+]C12CCC2)C1CCC1 ZINC000530214819 323216951 /nfs/dbraw/zinc/21/69/51/323216951.db2.gz CYWFIGSNQIGHJP-KBPBESRZSA-N 2 0 234.387 2.439 20 0 BEADRP CC(C)[C@H]([NH2+][C@@H]1CC[NH2+]C12CCC2)C1CC1 ZINC000530225900 323219001 /nfs/dbraw/zinc/21/90/01/323219001.db2.gz XZJLQYZVELGMEI-OLZOCXBDSA-N 2 0 222.376 2.295 20 0 BEADRP CC(C)[C@H]([NH2+]CCC[NH+]1CCCC1)C1CC1 ZINC000309375057 323349280 /nfs/dbraw/zinc/34/92/80/323349280.db2.gz RAIDHGOVLJMJLW-AWEZNQCLSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1occc1C[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000321110953 323376714 /nfs/dbraw/zinc/37/67/14/323376714.db2.gz UQBXTBNKOTXLEH-UHFFFAOYSA-N 2 0 236.359 2.410 20 0 BEADRP CC[C@]1(C)CC[N@H+](C[C@H]2CC[NH2+][C@@H](C)C2)C1 ZINC000399498856 323393906 /nfs/dbraw/zinc/39/39/06/323393906.db2.gz XDIIBABDEWAASW-MELADBBJSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@]1(C)CC[N@H+](C[C@@H]2CC[NH2+][C@H](C)C2)C1 ZINC000399498857 323393765 /nfs/dbraw/zinc/39/37/65/323393765.db2.gz XDIIBABDEWAASW-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]([NH2+]CCC[NH+]1CCCC1)[C@H]1CC12CC2 ZINC000527845021 323703274 /nfs/dbraw/zinc/70/32/74/323703274.db2.gz HPXHMLYYKOYRAV-CHWSQXEVSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@@H]1CCC[C@H]1[NH2+]CCC1CC[NH+](C)CC1 ZINC000122079205 324025772 /nfs/dbraw/zinc/02/57/72/324025772.db2.gz WVFNHRHETGZGOS-TZMCWYRMSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)C(C)(C)C ZINC000133322024 325286356 /nfs/dbraw/zinc/28/63/56/325286356.db2.gz UFNNQNMKVZLSJX-VXGBXAGGSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)C1CCC1 ZINC000133404771 325293850 /nfs/dbraw/zinc/29/38/50/325293850.db2.gz ZRLRJUMLAAGYPE-NEPJUHHUSA-N 2 0 210.365 2.106 20 0 BEADRP CC[NH+](CC)C[C@@H]1CC[N@H+](CC(C)C)C1 ZINC000076003685 325325484 /nfs/dbraw/zinc/32/54/84/325325484.db2.gz ZRKWVTOJHJSJDV-ZDUSSCGKSA-N 2 0 212.381 2.306 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]CCOC2CCCCC2)C1 ZINC000093216149 325734551 /nfs/dbraw/zinc/73/45/51/325734551.db2.gz IXZOULNDXDFNFY-STQMWFEESA-N 2 0 240.391 2.195 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCC[C@H]([NH3+])C1)C(F)(F)F ZINC000566481336 326051153 /nfs/dbraw/zinc/05/11/53/326051153.db2.gz HFOXFYKQQASXJW-VGMNWLOBSA-N 2 0 224.270 2.044 20 0 BEADRP Cc1ccc(CC[NH2+][C@H](C)CCCC[NH3+])cn1 ZINC000566791105 326082564 /nfs/dbraw/zinc/08/25/64/326082564.db2.gz QSKDVWOVGHNKID-GFCCVEGCSA-N 2 0 235.375 2.040 20 0 BEADRP C[C@H](Cc1ccsc1)[NH2+][C@@H]1CC[C@@H](C[NH3+])C1 ZINC000567220628 326144113 /nfs/dbraw/zinc/14/41/13/326144113.db2.gz HHUSJJQLNFUYMQ-NQBHXWOUSA-N 2 0 238.400 2.396 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H](C)CCC(C)C ZINC000567638962 326236432 /nfs/dbraw/zinc/23/64/32/326236432.db2.gz AYKLWNZEOXWBPB-GFCCVEGCSA-N 2 0 200.370 2.400 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CC(C2CC2)C2CC2)CC[N@@H+]1C ZINC000156602395 326236803 /nfs/dbraw/zinc/23/68/03/326236803.db2.gz IUESWCRPDJRQHM-SMDDNHRTSA-N 2 0 236.403 2.495 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]CCOCC2CCCC2)C1 ZINC000313267564 326261104 /nfs/dbraw/zinc/26/11/04/326261104.db2.gz UILWAJQMDCEMIC-ZIAGYGMSSA-N 2 0 240.391 2.053 20 0 BEADRP CC[C@H](COC)[NH2+]CC[C@H](C)[NH+]1CCCCC1 ZINC000157358429 326270846 /nfs/dbraw/zinc/27/08/46/326270846.db2.gz BJYBONJCNPBWMI-UONOGXRCSA-N 2 0 242.407 2.266 20 0 BEADRP Cc1ccc(F)c(C[NH2+][C@@H](C)C[C@H](C)[NH3+])c1 ZINC000567871139 326274023 /nfs/dbraw/zinc/27/40/23/326274023.db2.gz SBNPFWMKQISYAS-QWRGUYRKSA-N 2 0 224.323 2.350 20 0 BEADRP Cc1ccc(CC[NH2+][C@H]2CCCC[C@H]2C[NH3+])cn1 ZINC000567889954 326277175 /nfs/dbraw/zinc/27/71/75/326277175.db2.gz OPVDTGUHLRFPOT-GJZGRUSLSA-N 2 0 247.386 2.040 20 0 BEADRP Cc1ccc(CC[NH2+][C@H]2CCC[C@H]([NH3+])C2)cc1 ZINC000568248481 326334103 /nfs/dbraw/zinc/33/41/03/326334103.db2.gz SGWHHHOAJIYABY-GJZGRUSLSA-N 2 0 232.371 2.397 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+][C@@H]2CCC[C@H]2OC(F)F)C1 ZINC000568248075 326334324 /nfs/dbraw/zinc/33/43/24/326334324.db2.gz GVHYLXGXGFDZRK-LNFKQOIKSA-N 2 0 248.317 2.006 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H]2CCC[C@H]2OC(F)F)C1 ZINC000568248074 326334422 /nfs/dbraw/zinc/33/44/22/326334422.db2.gz GVHYLXGXGFDZRK-LMLFDSFASA-N 2 0 248.317 2.006 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCCC12CC2)C[NH+](C)C ZINC000568277316 326340016 /nfs/dbraw/zinc/34/00/16/326340016.db2.gz VNFQAFWJGBKORS-NEPJUHHUSA-N 2 0 210.365 2.106 20 0 BEADRP CO[C@H]1C[C@@H]([N@H+](C)CCCc2ccc(C)nc2)C1 ZINC000568682349 326372220 /nfs/dbraw/zinc/37/22/20/326372220.db2.gz VRKWYKHXLLBMNU-GASCZTMLSA-N 2 0 248.370 2.432 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]CC(C1CC1)C1CC1 ZINC000568749071 326374668 /nfs/dbraw/zinc/37/46/68/326374668.db2.gz UPUCSORANXLJAS-IAQYHMDHSA-N 2 0 236.403 2.400 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H]1CCc2cc(F)ccc21 ZINC000568987664 326385046 /nfs/dbraw/zinc/38/50/46/326385046.db2.gz LAAMVFMFSBVYEL-CQSZACIVSA-N 2 0 236.334 2.402 20 0 BEADRP Cc1ccc(F)cc1C[NH2+][C@H](C)C[C@H](C)[NH3+] ZINC000569002508 326386237 /nfs/dbraw/zinc/38/62/37/326386237.db2.gz BXRQKQBANDQAKS-WDEREUQCSA-N 2 0 224.323 2.350 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H]1CCc2ccc(F)cc21 ZINC000569106072 326390308 /nfs/dbraw/zinc/39/03/08/326390308.db2.gz BKHSAQAGVBJAOX-CQSZACIVSA-N 2 0 236.334 2.402 20 0 BEADRP Cc1ccc(C[N@H+](C)C[C@H]2CC[NH2+]C2)s1 ZINC000309636517 488004359 /nfs/dbraw/zinc/00/43/59/488004359.db2.gz MSMVTDNRZZZNEO-NSHDSACASA-N 2 0 224.373 2.098 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CC2=CCCC2)CC[N@@H+]1C ZINC000401173886 488018107 /nfs/dbraw/zinc/01/81/07/488018107.db2.gz UWKIDIDXDNCMFL-YPMHNXCESA-N 2 0 208.349 2.169 20 0 BEADRP CCCC[C@@H](C)[NH2+][C@H](C)CC[NH+](C)C ZINC000049554154 488018838 /nfs/dbraw/zinc/01/88/38/488018838.db2.gz DLDYLXCBJIPGBJ-VXGBXAGGSA-N 2 0 200.370 2.495 20 0 BEADRP CC[C@@H]1C[N@H+](CCOc2ccccc2)CC[C@@H]1[NH3+] ZINC000147493640 488029475 /nfs/dbraw/zinc/02/94/75/488029475.db2.gz NKLWUJXOMGINSY-HIFRSBDPSA-N 2 0 248.370 2.125 20 0 BEADRP CC[C@H]1C[N@H+](CCOc2ccccc2)CC[C@@H]1[NH3+] ZINC000147493839 488029400 /nfs/dbraw/zinc/02/94/00/488029400.db2.gz NKLWUJXOMGINSY-ZFWWWQNUSA-N 2 0 248.370 2.125 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CCCC[C@H]2C[NH3+])o1 ZINC000084216718 488037356 /nfs/dbraw/zinc/03/73/56/488037356.db2.gz HGWHQHJMYNQJCY-WCQYABFASA-N 2 0 222.332 2.195 20 0 BEADRP CC(C)[C@H](C)[NH2+]Cc1ccc(C[NH3+])cc1F ZINC000319022198 488038074 /nfs/dbraw/zinc/03/80/74/488038074.db2.gz RBODIUSNGHBORC-JTQLQIEISA-N 2 0 224.323 2.419 20 0 BEADRP COc1c(C)cccc1C[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000656200853 488066983 /nfs/dbraw/zinc/06/69/83/488066983.db2.gz SDFXNLIHINUENN-KGLIPLIRSA-N 2 0 248.370 2.363 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](C)Cc1ccccn1 ZINC000656200801 488066840 /nfs/dbraw/zinc/06/68/40/488066840.db2.gz FLNLIMYXLKOUCK-STQMWFEESA-N 2 0 235.375 2.120 20 0 BEADRP Fc1ccccc1CN1CC[C@@]2(C1)CCC[NH2+]C2 ZINC000257701796 488084530 /nfs/dbraw/zinc/08/45/30/488084530.db2.gz QGEZARGJOMIGLK-HNNXBMFYSA-N 2 0 248.345 2.401 20 0 BEADRP Fc1ccccc1CN1CC[C@]2(C1)CCC[NH2+]C2 ZINC000257701797 488084358 /nfs/dbraw/zinc/08/43/58/488084358.db2.gz QGEZARGJOMIGLK-OAHLLOKOSA-N 2 0 248.345 2.401 20 0 BEADRP CC[C@@H]1CC[N@H+](Cc2cnc3n2CCC3)C1 ZINC000667698042 488091488 /nfs/dbraw/zinc/09/14/88/488091488.db2.gz VWUBOFMURPPJRW-LLVKDONJSA-N 2 0 219.332 2.061 20 0 BEADRP C(CC1CC[NH2+]CC1)C[NH+]1C[C@H]2CCC[C@@H]2C1 ZINC000159949126 488093885 /nfs/dbraw/zinc/09/38/85/488093885.db2.gz BQXYXQKWAFRBMN-HUUCEWRRSA-N 2 0 236.403 2.498 20 0 BEADRP C(CC1CC[NH2+]CC1)C[N@@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC000159948842 488094052 /nfs/dbraw/zinc/09/40/52/488094052.db2.gz BQXYXQKWAFRBMN-GASCZTMLSA-N 2 0 236.403 2.498 20 0 BEADRP C[N@H+](C[C@@H]1CC[C@H]2C[C@H]2C1)C1CC[NH2+]CC1 ZINC000403171512 488116567 /nfs/dbraw/zinc/11/65/67/488116567.db2.gz KMMKHNHDXOKLKH-FRRDWIJNSA-N 2 0 222.376 2.106 20 0 BEADRP CC[NH+](CC)CCCN1CC[C@@H](C(F)F)C1 ZINC000683141899 488117700 /nfs/dbraw/zinc/11/77/00/488117700.db2.gz QAKPILZOQIIMBI-LLVKDONJSA-N 2 0 234.334 2.305 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+]C(C2CC2)C2CC2)C1 ZINC000151104156 488117784 /nfs/dbraw/zinc/11/77/84/488117784.db2.gz YAWJHERVWZOXEW-GFCCVEGCSA-N 2 0 236.403 2.497 20 0 BEADRP CC[NH+](CC)CCCN1CC[C@H](C(F)F)C1 ZINC000683141901 488118438 /nfs/dbraw/zinc/11/84/38/488118438.db2.gz QAKPILZOQIIMBI-NSHDSACASA-N 2 0 234.334 2.305 20 0 BEADRP C([C@@H]1CC[C@H]2C[C@H]2C1)[N@@H+]1CC[C@]2(CC[NH2+]C2)C1 ZINC000403587560 488127332 /nfs/dbraw/zinc/12/73/32/488127332.db2.gz DFLNRESMCIUZQB-BARDWOONSA-N 2 0 234.387 2.108 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCCN(C)C1)[C@H]1CC1(C)C ZINC000397653406 488128544 /nfs/dbraw/zinc/12/85/44/488128544.db2.gz MGAZSFYNXJMOMP-UPJWGTAASA-N 2 0 224.392 2.495 20 0 BEADRP CC[C@@H]1C[N@H+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC[C@@H]1[NH3+] ZINC000403627710 488129148 /nfs/dbraw/zinc/12/91/48/488129148.db2.gz MITJONIZFSLLQQ-ZSAUSMIDSA-N 2 0 236.403 2.482 20 0 BEADRP C1[C@@H]([NH2+]C2CCCCC2)C12CC[NH2+]CC2 ZINC000390051123 488131400 /nfs/dbraw/zinc/13/14/00/488131400.db2.gz GFCDXEDVFJDHIN-GFCCVEGCSA-N 2 0 208.349 2.051 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]1[NH2+]CCC1CCC1 ZINC000300828308 487538600 /nfs/dbraw/zinc/53/86/00/487538600.db2.gz JXELRXPQPULPCR-LBPRGKRZSA-N 2 0 210.365 2.154 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]C[C@@H]1Cc2ccccc21 ZINC000227137692 487553003 /nfs/dbraw/zinc/55/30/03/487553003.db2.gz YAYUQTHOLNSXAG-DZKIICNBSA-N 2 0 244.382 2.433 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH2+][C@H]2CCC[C@@H]3C[C@@H]32)C1 ZINC000382102335 487531424 /nfs/dbraw/zinc/53/14/24/487531424.db2.gz HBHQISNRUMLMLV-CRWXNKLISA-N 2 0 222.376 2.106 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]C[C@@H](C)C(C)(C)C ZINC000379505417 488140545 /nfs/dbraw/zinc/14/05/45/488140545.db2.gz OHSDEIMVTWBVGW-MNOVXSKESA-N 2 0 200.370 2.386 20 0 BEADRP CCN(CC[NH3+])Cc1cccc(OC(C)C)c1 ZINC000231818955 487477575 /nfs/dbraw/zinc/47/75/75/487477575.db2.gz SETMKFODGOMACP-UHFFFAOYSA-N 2 0 236.359 2.254 20 0 BEADRP C[N@H+](CC[C@H]1CC[NH2+]C1)CCC(C)(C)C ZINC000258883563 488141821 /nfs/dbraw/zinc/14/18/21/488141821.db2.gz BXVXLYGEXDEASA-GFCCVEGCSA-N 2 0 212.381 2.354 20 0 BEADRP C[C@@H]1C[C@H](C[NH3+])C[N@@H+]1CCC(C)(C)C1CC1 ZINC000405967615 487495798 /nfs/dbraw/zinc/49/57/98/487495798.db2.gz SGUILRAHMAVFPG-VXGBXAGGSA-N 2 0 224.392 2.482 20 0 BEADRP C[C@H]1[C@@H]([NH3+])CC[N@@H+]1CCC(C)(C)C1CC1 ZINC000405954966 487497167 /nfs/dbraw/zinc/49/71/67/487497167.db2.gz JPALWQQSRGDZDU-JQWIXIFHSA-N 2 0 210.365 2.234 20 0 BEADRP C[C@@H]1C[N@H+](CCC(C)(C)C2CC2)C[C@H]1[NH3+] ZINC000405955624 487497476 /nfs/dbraw/zinc/49/74/76/487497476.db2.gz KGCOENBVLGRLOC-ZYHUDNBSSA-N 2 0 210.365 2.092 20 0 BEADRP CC(C)CC[N@H+](C)C[C@@H]1CC[NH2+][C@@H](C)C1 ZINC000300056255 487499165 /nfs/dbraw/zinc/49/91/65/487499165.db2.gz OLWLZWUYGMVJAW-QWHCGFSZSA-N 2 0 212.381 2.352 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)C1 ZINC000304562954 487511766 /nfs/dbraw/zinc/51/17/66/487511766.db2.gz LOBJZUAVAZXHEG-YIYPIFLZSA-N 2 0 222.376 2.106 20 0 BEADRP C([C@@H]1C[C@H]2C[C@H]2C1)[NH+]1CCC([C@H]2CC[NH2+]C2)CC1 ZINC000662274627 487523589 /nfs/dbraw/zinc/52/35/89/487523589.db2.gz YBRYQLOFMZGWGX-HNKHHVNMSA-N 2 0 248.414 2.354 20 0 BEADRP C([C@@H]1C[C@H]2C[C@H]2C1)[NH+]1CCC([C@H]2CCC[NH2+]2)CC1 ZINC000662273900 490044763 /nfs/dbraw/zinc/04/47/63/490044763.db2.gz AZCFWFHTKNUYIF-SLBVQIDZSA-N 2 0 248.414 2.497 20 0 BEADRP Cc1cc(N2CCC[C@@H]([NH2+]C(C)C)C2)cc[nH+]1 ZINC000681384390 487790106 /nfs/dbraw/zinc/79/01/06/487790106.db2.gz QTEHLCJPNQGDAZ-CYBMUJFWSA-N 2 0 233.359 2.357 20 0 BEADRP Cc1cccc2ncc(C[N@@H+]3CC[C@@H]4C[C@@H]4C3)n21 ZINC000668675892 488095660 /nfs/dbraw/zinc/09/56/60/488095660.db2.gz ILVBSSILVDLWPN-CHWSQXEVSA-N 2 0 241.338 2.485 20 0 BEADRP [NH3+]CCC1CC[NH+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC000403750730 488136251 /nfs/dbraw/zinc/13/62/51/488136251.db2.gz OXYOWKJTRNDVSS-KFWWJZLASA-N 2 0 236.403 2.483 20 0 BEADRP C(C1CC1)N1CC[C@@H]([NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)C1 ZINC000667859192 488140639 /nfs/dbraw/zinc/14/06/39/488140639.db2.gz HXBNAAZKLKQOKG-APIJFGDWSA-N 2 0 234.387 2.249 20 0 BEADRP C[NH+](C)CCC[NH2+]C[C@H]1CCc2ccccc2C1 ZINC000223450585 488162970 /nfs/dbraw/zinc/16/29/70/488162970.db2.gz MHCFZVLDURMEJG-AWEZNQCLSA-N 2 0 246.398 2.333 20 0 BEADRP CC(C)=CCC[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000400962606 488178144 /nfs/dbraw/zinc/17/81/44/488178144.db2.gz AZVQTONEWKUFIA-MELADBBJSA-N 2 0 222.376 2.320 20 0 BEADRP c1nc2n(c1C[N@@H+]1CCCC3(CC3)C1)CCC2 ZINC000667998842 488179149 /nfs/dbraw/zinc/17/91/49/488179149.db2.gz LACWUHOAQPUCNL-UHFFFAOYSA-N 2 0 231.343 2.205 20 0 BEADRP Cc1cc(NC[C@@H]2CC[N@@H+]2C(C)(C)C)cc[nH+]1 ZINC000664142850 488185736 /nfs/dbraw/zinc/18/57/36/488185736.db2.gz NUAFEYOLKDXRMB-ZDUSSCGKSA-N 2 0 233.359 2.097 20 0 BEADRP [NH3+]CC[C@@H]1CCCC[N@@H+]1CCC1CCC1 ZINC000398626329 488220776 /nfs/dbraw/zinc/22/07/76/488220776.db2.gz HXPHVHJFWXJSAG-ZDUSSCGKSA-N 2 0 210.365 2.380 20 0 BEADRP C[C@@H]([NH3+])C1CC[NH+](CCC2CCC2)CC1 ZINC000398799770 488224619 /nfs/dbraw/zinc/22/46/19/488224619.db2.gz NKSFFVYUIYMPEG-LLVKDONJSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@@H]1C[C@@H](C)[N@H+](CCC2CCC2)C[C@H]1C[NH3+] ZINC000398899104 488225419 /nfs/dbraw/zinc/22/54/19/488225419.db2.gz HDQKYRDYWUNLJW-YRGRVCCFSA-N 2 0 224.392 2.482 20 0 BEADRP CCC1([NH2+][C@@H]2CCN(C)[C@H](C)C2)CCOCC1 ZINC000679152023 488313585 /nfs/dbraw/zinc/31/35/85/488313585.db2.gz XPBSZAUGHZZREQ-CHWSQXEVSA-N 2 0 240.391 2.018 20 0 BEADRP C(=C\C[N@H+]1CC=CCC1)\C[NH+]1CC=CCC1 ZINC000679322270 490112767 /nfs/dbraw/zinc/11/27/67/490112767.db2.gz YIXYOJUFEHVRFK-FPLPWBNLSA-N 2 0 218.344 2.066 20 0 BEADRP C([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)C1CCCC1 ZINC000400942751 490129024 /nfs/dbraw/zinc/12/90/24/490129024.db2.gz BUGRDFCOCMYNSD-BFHYXJOUSA-N 2 0 222.376 2.154 20 0 BEADRP COc1ccc(C[N@@H+]2CC[C@H]([NH3+])C[C@H]2C)cc1C ZINC000252688237 490198305 /nfs/dbraw/zinc/19/83/05/490198305.db2.gz NPWDWYQKWPHRBG-OCCSQVGLSA-N 2 0 248.370 2.315 20 0 BEADRP COc1ccc(C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)c(C)c1 ZINC000577887120 490221035 /nfs/dbraw/zinc/22/10/35/490221035.db2.gz FIDLLDYWYHAFMA-KGLIPLIRSA-N 2 0 248.370 2.363 20 0 BEADRP COc1ccc(C[N@H+](C)C2CC[NH2+]CC2)cc1C ZINC000084574678 490230346 /nfs/dbraw/zinc/23/03/46/490230346.db2.gz XNIYBJYXNLJPEA-UHFFFAOYSA-N 2 0 248.370 2.187 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CC1(C)C)C1CC[NH+](C)CC1 ZINC000222050724 490466314 /nfs/dbraw/zinc/46/63/14/490466314.db2.gz DBINLTSRQDAGHT-WCQYABFASA-N 2 0 224.392 2.352 20 0 BEADRP CC1(C)CC[C@@H]([NH2+][C@H]2CCC[NH2+]CC2)C1 ZINC000128607205 490583038 /nfs/dbraw/zinc/58/30/38/490583038.db2.gz QOJIGNUDMVFBJB-NWDGAFQWSA-N 2 0 210.365 2.297 20 0 BEADRP C[NH+]1CCC(C)(C[NH2+]Cc2ccc(O)cc2)CC1 ZINC000227541591 491062905 /nfs/dbraw/zinc/06/29/05/491062905.db2.gz PNSSYMQUBKATNT-UHFFFAOYSA-N 2 0 248.370 2.214 20 0 BEADRP CC(C)(C)CC[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000400945306 491069128 /nfs/dbraw/zinc/06/91/28/491069128.db2.gz FIKGGUGATGOVSI-JHJVBQTASA-N 2 0 224.392 2.400 20 0 BEADRP CC(C)(C)CC[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000400945310 491069133 /nfs/dbraw/zinc/06/91/33/491069133.db2.gz FIKGGUGATGOVSI-RWMBFGLXSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCCS1)C1CC[NH+](C)CC1 ZINC000087667950 491091237 /nfs/dbraw/zinc/09/12/37/491091237.db2.gz WLVOMAXEKYGJFA-AAEUAGOBSA-N 2 0 242.432 2.202 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@H]1CCC[C@@H]2C[C@@H]21 ZINC000393911800 491094231 /nfs/dbraw/zinc/09/42/31/491094231.db2.gz UVSCMMZSQTZCPH-AGIUHOORSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCSC1)C1CC[NH+](C)CC1 ZINC000228552540 491095572 /nfs/dbraw/zinc/09/55/72/491095572.db2.gz VBXBIPPJPXSPMY-NWDGAFQWSA-N 2 0 242.432 2.059 20 0 BEADRP CC(C)(C[NH2+][C@@H]1CCC[C@@H]1[NH3+])c1cccs1 ZINC000259086653 491101948 /nfs/dbraw/zinc/10/19/48/491101948.db2.gz RNHWPKGUEOARJT-WDEREUQCSA-N 2 0 238.400 2.495 20 0 BEADRP COCC[C@@H](C)[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000088523261 491104532 /nfs/dbraw/zinc/10/45/32/491104532.db2.gz MIRNCFAPZPXONA-CYBMUJFWSA-N 2 0 242.407 2.075 20 0 BEADRP Cc1c[nH+]ccc1N[C@H]1CC[N@@H+](C2CC2)C1 ZINC000070047293 491117612 /nfs/dbraw/zinc/11/76/12/491117612.db2.gz VNDVFXAAEZWMMH-NSHDSACASA-N 2 0 217.316 2.039 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CCC2CC2)[C@H](C)C1 ZINC000090118305 491123014 /nfs/dbraw/zinc/12/30/14/491123014.db2.gz SVFYJPMEJDTZRF-DGCLKSJQSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]([NH2+]CC1(C2CC2)CC1)C1CC[NH+](C)CC1 ZINC000090773026 491129626 /nfs/dbraw/zinc/12/96/26/491129626.db2.gz QDHDUJIAVCRYSZ-LBPRGKRZSA-N 2 0 236.403 2.497 20 0 BEADRP CCN(CC)CC[NH2+][C@H](C)CC1CCC1 ZINC000132052765 491133986 /nfs/dbraw/zinc/13/39/86/491133986.db2.gz AAGCFTZVPJMPAF-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@@H]1CCC[N@H+](CCCC[NH2+]C2CSC2)C1 ZINC000309783640 491156448 /nfs/dbraw/zinc/15/64/48/491156448.db2.gz NLLAXCCZDAWYJU-GFCCVEGCSA-N 2 0 242.432 2.204 20 0 BEADRP CC[C@@H](C)C[N@H+](CC)CC[C@H]1CC[NH2+]C1 ZINC000251857880 535509080 /nfs/dbraw/zinc/50/90/80/535509080.db2.gz OALCMGZWMITPMO-CHWSQXEVSA-N 2 0 212.381 2.354 20 0 BEADRP C[C@H]([NH2+]CC1CCCCC1)[C@H]1CCC[NH2+]1 ZINC000400635438 533837778 /nfs/dbraw/zinc/83/77/78/533837778.db2.gz MREBKPCYLHAFFX-WCQYABFASA-N 2 0 210.365 2.297 20 0 BEADRP CS[C@@H]1CCC[C@H]([NH2+][C@@H](C)[C@@H]2CCC[NH2+]2)C1 ZINC000400345497 533961285 /nfs/dbraw/zinc/96/12/85/533961285.db2.gz KDMVPOLFLCCCOR-RVMXOQNASA-N 2 0 242.432 2.391 20 0 BEADRP C[C@@H]1C[C@H]1C[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000488324043 534019159 /nfs/dbraw/zinc/01/91/59/534019159.db2.gz CPGFRFKLHPNIRK-HIFRSBDPSA-N 2 0 236.403 2.450 20 0 BEADRP CC[C@@H](COC)[NH2+]CCC[N@@H+]1CCCC[C@@H]1C ZINC000079706457 535761514 /nfs/dbraw/zinc/76/15/14/535761514.db2.gz LUMXGLFRGMPURO-KBPBESRZSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@@H]1OCC[C@@]1(C)[NH2+]CCC[NH+]1CCCCC1 ZINC000494218081 534187851 /nfs/dbraw/zinc/18/78/51/534187851.db2.gz ZVHFYAXECCEQCC-UONOGXRCSA-N 2 0 240.391 2.020 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)C1 ZINC000400960211 534257935 /nfs/dbraw/zinc/25/79/35/534257935.db2.gz IKEQGJMBRZOPER-XHJNMGKDSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)C1 ZINC000400960203 534257972 /nfs/dbraw/zinc/25/79/72/534257972.db2.gz IKEQGJMBRZOPER-PEBLQZBPSA-N 2 0 222.376 2.153 20 0 BEADRP CCc1ccc(C[N@@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@@H]3C2)cc1 ZINC000261587431 536180405 /nfs/dbraw/zinc/18/04/05/536180405.db2.gz VBPDECJCQVLOEJ-ARFHVFGLSA-N 2 0 244.382 2.418 20 0 BEADRP CC(C)CC[C@@H](C)[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000087646111 534913745 /nfs/dbraw/zinc/91/37/45/534913745.db2.gz SVFFDSYYQDXKEY-OLZOCXBDSA-N 2 0 212.381 2.400 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH+](C)C[C@@H]2C[C@@H]2C)[C@@H](C)C1 ZINC000488311712 527830792 /nfs/dbraw/zinc/83/07/92/527830792.db2.gz JUGZDWNKHNVVDO-XUXIUFHCSA-N 2 0 224.392 2.305 20 0 BEADRP CCC[C@H](C)C[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000414915586 528034325 /nfs/dbraw/zinc/03/43/25/528034325.db2.gz ZRXWQASBQSIQJY-QWHCGFSZSA-N 2 0 212.381 2.402 20 0 BEADRP CCC(C)(C)OCC[NH2+][C@H]1CC[N@H+](C)C[C@H]1C ZINC000308715881 528592633 /nfs/dbraw/zinc/59/26/33/528592633.db2.gz BDQPBCKLVUCEBI-OLZOCXBDSA-N 2 0 242.407 2.121 20 0 BEADRP CC(C)[NH+]1CCC([N@H+](C)C[C@@H]2C[C@@H]2C)CC1 ZINC000488354937 528990743 /nfs/dbraw/zinc/99/07/43/528990743.db2.gz WYFWKMZAESQJGI-STQMWFEESA-N 2 0 224.392 2.447 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000401163571 529242467 /nfs/dbraw/zinc/24/24/67/529242467.db2.gz PMVFOOWVJFEGOH-HTVCTNPSSA-N 2 0 224.392 2.399 20 0 BEADRP CC(C)OCCC[N@H+](C)CC[C@H]1CCC[NH+]1C ZINC000348205866 535325052 /nfs/dbraw/zinc/32/50/52/535325052.db2.gz ZFFIWPZNAASUGD-CQSZACIVSA-N 2 0 242.407 2.218 20 0 BEADRP CC(C)C[C@H]1CCC[N@@H+]1C[C@@]1(C)CC[NH2+]C1 ZINC000261687662 535327131 /nfs/dbraw/zinc/32/71/31/535327131.db2.gz ASIQRXNYXNVFDM-KGLIPLIRSA-N 2 0 224.392 2.497 20 0 BEADRP CCC(C)(C)CC[N@@H+]1CC[C@@H]([NH3+])[C@H](C)C1 ZINC000261554485 535351304 /nfs/dbraw/zinc/35/13/04/535351304.db2.gz UGIBISMUQVEHSQ-VXGBXAGGSA-N 2 0 212.381 2.482 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@H]2CC2(C)C)CC1 ZINC000223812878 535473687 /nfs/dbraw/zinc/47/36/87/535473687.db2.gz XLGOSJSNSHGTFL-LLVKDONJSA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@@H](C)C[N@H+](CC)C[C@H]1CCC[NH2+]C1 ZINC000251844465 535509209 /nfs/dbraw/zinc/50/92/09/535509209.db2.gz LYOJSVUYWGMXOV-OLZOCXBDSA-N 2 0 212.381 2.354 20 0 BEADRP CCc1ccccc1C[NH2+]C1CC[NH2+]CC1 ZINC000082774588 535939496 /nfs/dbraw/zinc/93/94/96/535939496.db2.gz TWOWSVOEVSICKE-UHFFFAOYSA-N 2 0 218.344 2.091 20 0 BEADRP CC[C@H](COC)[NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000079707274 536121771 /nfs/dbraw/zinc/12/17/71/536121771.db2.gz SVVDAXKQKLKJBE-LLVKDONJSA-N 2 0 242.407 2.310 20 0 BEADRP CCc1cc(N2CCC([NH+](C)C)CC2)cc[nH+]1 ZINC000335585772 536144888 /nfs/dbraw/zinc/14/48/88/536144888.db2.gz XYKMMYZAGNTPGO-UHFFFAOYSA-N 2 0 233.359 2.174 20 0 BEADRP CN1CCC([NH2+][C@@H]2CCCC23CCC3)CC1 ZINC000335658335 536344516 /nfs/dbraw/zinc/34/45/16/536344516.db2.gz UWOVPTOIIGGBRF-CYBMUJFWSA-N 2 0 222.376 2.393 20 0 BEADRP C[N@@H+]1CCC[C@@H]1CC[NH+]1CC[C@@H](C2CC2)C1 ZINC000348072815 536370499 /nfs/dbraw/zinc/37/04/99/536370499.db2.gz KVDDBXDTMMDJRG-ZIAGYGMSSA-N 2 0 222.376 2.203 20 0 BEADRP COCCC[C@@H](C)[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000180405109 536655277 /nfs/dbraw/zinc/65/52/77/536655277.db2.gz NNCNLMONMDTNKP-CYBMUJFWSA-N 2 0 242.407 2.264 20 0 BEADRP CO[C@@H]1CC[C@H]([NH2+][C@H]2C[C@@H]([NH3+])c3ccccc32)C1 ZINC000261576242 536706492 /nfs/dbraw/zinc/70/64/92/536706492.db2.gz NOAVOPBXPCMETB-DRABBMOASA-N 2 0 246.354 2.288 20 0 BEADRP COC(C)(C)C[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000178469012 536887746 /nfs/dbraw/zinc/88/77/46/536887746.db2.gz WZJKLEWIPBNNET-UHFFFAOYSA-N 2 0 242.407 2.264 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000853240264 588728251 /nfs/dbraw/zinc/72/82/51/588728251.db2.gz OFXGKLOJWMOKPI-YUELXQCFSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000853240262 588728303 /nfs/dbraw/zinc/72/83/03/588728303.db2.gz OFXGKLOJWMOKPI-SNPRPXQTSA-N 2 0 236.403 2.497 20 0 BEADRP CC[C@H]1C[C@H](C[NH2+]CC[C@@H]([NH3+])C(C)C)CCO1 ZINC000853247178 588729243 /nfs/dbraw/zinc/72/92/43/588729243.db2.gz FUHIXARPIOEQHE-HZSPNIEDSA-N 2 0 242.407 2.155 20 0 BEADRP C1C[C@H]([NH2+][C@H]2CC[C@H]3CCCC[C@@H]3C2)C[NH2+]1 ZINC000854222333 588780259 /nfs/dbraw/zinc/78/02/59/588780259.db2.gz DQEKDOYOTGQRDT-MQYQWHSLSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@H]1C[C@H](O)c2ccccc21 ZINC000854229226 588780930 /nfs/dbraw/zinc/78/09/30/588780930.db2.gz IIFYLJAKMIEOJG-UGFHNGPFSA-N 2 0 248.370 2.272 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CC[C@@H]2C2CC2)C1 ZINC000348089608 582495767 /nfs/dbraw/zinc/49/57/67/582495767.db2.gz UBUDWFOKDOFFKN-BPLDGKMQSA-N 2 0 236.403 2.497 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2CCCC2(C)C)CC1 ZINC000891870243 582732309 /nfs/dbraw/zinc/73/23/09/582732309.db2.gz QFOZTPURMOYAPV-UHFFFAOYSA-N 2 0 210.365 2.203 20 0 BEADRP CCCSC[C@@H](C)[NH2+]CCC[NH+](C)C ZINC000892429048 582885100 /nfs/dbraw/zinc/88/51/00/582885100.db2.gz BLNJZQXTFLPSKX-LLVKDONJSA-N 2 0 218.410 2.059 20 0 BEADRP CCCSC[C@@H](C)[NH2+]CCCC[NH+](C)C ZINC000892740623 582974579 /nfs/dbraw/zinc/97/45/79/582974579.db2.gz KDHDAPMABQGEEA-GFCCVEGCSA-N 2 0 232.437 2.450 20 0 BEADRP C[NH2+]CCN(C)CC[C@H]1CCc2ccccc21 ZINC000852749556 583017003 /nfs/dbraw/zinc/01/70/03/583017003.db2.gz MMZOBZKZZBJMAY-CQSZACIVSA-N 2 0 232.371 2.258 20 0 BEADRP C[C@H]1CSCC[N@H+](CC2CC[NH+](C)CC2)C1 ZINC000894009019 583269963 /nfs/dbraw/zinc/26/99/63/583269963.db2.gz JSIULDSUBAHDJG-GFCCVEGCSA-N 2 0 242.432 2.013 20 0 BEADRP C[NH+]1CCC(C[NH2+]C2(C(F)F)CCCC2)CC1 ZINC000894526759 583477976 /nfs/dbraw/zinc/47/79/76/583477976.db2.gz NTOUCZKOJWBPHP-UHFFFAOYSA-N 2 0 246.345 2.496 20 0 BEADRP C[C@H]1[C@@H](C)[N@@H+](CC2CC[NH+](C)CC2)C[C@H]1C ZINC000894959558 583559320 /nfs/dbraw/zinc/55/93/20/583559320.db2.gz YIRCEFYWDLFQIZ-JHJVBQTASA-N 2 0 224.392 2.305 20 0 BEADRP Cc1cc(C[NH2+]CC2CC[NH+](C)CC2)cc(C)n1 ZINC000894966999 583560097 /nfs/dbraw/zinc/56/00/97/583560097.db2.gz WYFDDPSVKRUYKG-UHFFFAOYSA-N 2 0 247.386 2.130 20 0 BEADRP C[C@@H]([NH2+]CCCC[N@H+](C)C1CC1)c1cnccn1 ZINC000894968896 583560419 /nfs/dbraw/zinc/56/04/19/583560419.db2.gz ZMGDRDMMKXIBBU-GFCCVEGCSA-N 2 0 248.374 2.002 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H]1CC[C@@H]1C1CC1 ZINC000336775301 583582588 /nfs/dbraw/zinc/58/25/88/583582588.db2.gz YQLRBDVDSJKBTB-ZIAGYGMSSA-N 2 0 224.392 2.497 20 0 BEADRP CCCSC[C@@H](C)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000895205630 583625670 /nfs/dbraw/zinc/62/56/70/583625670.db2.gz RBZVLTWDECYVPC-UPJWGTAASA-N 2 0 244.448 2.448 20 0 BEADRP Cc1ccncc1CCC[NH2+]CC[C@H](C)[NH+](C)C ZINC000895294474 583638177 /nfs/dbraw/zinc/63/81/77/583638177.db2.gz QCQUHPHQIUOGOM-AWEZNQCLSA-N 2 0 249.402 2.252 20 0 BEADRP C[C@@H](CC1CCOCC1)[NH2+]CC[C@H](C)[NH+](C)C ZINC000895292956 583639261 /nfs/dbraw/zinc/63/92/61/583639261.db2.gz DZDCXYDTVQNHRT-STQMWFEESA-N 2 0 242.407 2.121 20 0 BEADRP COC1CCC(C[NH2+]CC[C@H](C)[NH+](C)C)CC1 ZINC000895429782 583669268 /nfs/dbraw/zinc/66/92/68/583669268.db2.gz VAALKMJAZWINNZ-HSBZDZAISA-N 2 0 242.407 2.121 20 0 BEADRP C[NH+]1CCC(C[NH+]2CC(CC3CC3)C2)CC1 ZINC000895516223 583683091 /nfs/dbraw/zinc/68/30/91/583683091.db2.gz QIUKUXPIXGUHRZ-UHFFFAOYSA-N 2 0 222.376 2.060 20 0 BEADRP CC(C)([NH2+]Cc1cnc[nH]1)[C@H](O)c1ccccc1 ZINC000895663628 583702579 /nfs/dbraw/zinc/70/25/79/583702579.db2.gz ZGCQKBOKNZYNPU-CYBMUJFWSA-N 2 0 245.326 2.012 20 0 BEADRP C[NH+]1CCC(C[NH+]2CCC(CCF)CC2)CC1 ZINC000895740842 583714024 /nfs/dbraw/zinc/71/40/24/583714024.db2.gz RPHRUZGHISNLRQ-UHFFFAOYSA-N 2 0 242.382 2.400 20 0 BEADRP C[C@@H]1[C@@H]([NH2+]C[C@@H]2C[C@H]2c2ccccc2)CCN1C ZINC000896555598 583811396 /nfs/dbraw/zinc/81/13/96/583811396.db2.gz PGJPIEQZJSNZCZ-OEAJRASXSA-N 2 0 244.382 2.472 20 0 BEADRP C[C@H]1[C@H]([NH2+]CC2Cc3ccccc3C2)CCN1C ZINC000896555563 583811518 /nfs/dbraw/zinc/81/15/18/583811518.db2.gz OPRMNVFOZGQDSW-BLLLJJGKSA-N 2 0 244.382 2.084 20 0 BEADRP Cc1ccc(CCC[NH2+][C@H]2CCN(C)[C@H]2C)cn1 ZINC000896555944 583811589 /nfs/dbraw/zinc/81/15/89/583811589.db2.gz SKIMVAFFDBRXHJ-ZFWWWQNUSA-N 2 0 247.386 2.005 20 0 BEADRP COc1ccc([C@H](C)[NH2+][C@@H]2CCN(C)C2)c(C)c1 ZINC000840721723 583920687 /nfs/dbraw/zinc/92/06/87/583920687.db2.gz WFBVPVUEXIQMLW-QWHCGFSZSA-N 2 0 248.370 2.358 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CC(C)(C)C2CC2)CC[N@@H+]1C ZINC000897437952 583983611 /nfs/dbraw/zinc/98/36/11/583983611.db2.gz QEFXKVLKTQNATL-WCQYABFASA-N 2 0 224.392 2.495 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H]2C[C@@H]3CCC[C@H]23)[C@@H](C)C1 ZINC000897955918 584065625 /nfs/dbraw/zinc/06/56/25/584065625.db2.gz YZUXVYCFHVOUNC-YYFQZIEXSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@@H]1CC[C@@H](C)[C@@H]([NH2+]C[C@H]2C[C@H]([NH3+])C2)C1 ZINC000873255605 584128110 /nfs/dbraw/zinc/12/81/10/584128110.db2.gz ICHYFNYGVSPDFH-VEGXAWMVSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)C1CCCCC1 ZINC000873255019 584128359 /nfs/dbraw/zinc/12/83/59/584128359.db2.gz DBSWHSLNKVZMEC-GMXVVIOVSA-N 2 0 210.365 2.282 20 0 BEADRP CC1(C)CO[C@H](C[NH2+][C@@H]2CCCCC[C@H]2[NH3+])C1 ZINC000873281694 584128551 /nfs/dbraw/zinc/12/85/51/584128551.db2.gz OWFGOQFWLKTRLY-YNEHKIRRSA-N 2 0 240.391 2.051 20 0 BEADRP CC1(C)CO[C@H](C[NH2+][C@H]2CCCCC[C@H]2[NH3+])C1 ZINC000873281693 584128835 /nfs/dbraw/zinc/12/88/35/584128835.db2.gz OWFGOQFWLKTRLY-XQQFMLRXSA-N 2 0 240.391 2.051 20 0 BEADRP C[N@@H+]1CCCC[C@H](C[NH2+][C@H]2CC[C@@H]2C2CC2)C1 ZINC000858490873 588960335 /nfs/dbraw/zinc/96/03/35/588960335.db2.gz RILDURTXFMOXBB-YUELXQCFSA-N 2 0 236.403 2.497 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]([NH2+]C[C@H]2CCCS2)C1 ZINC000902346749 584559428 /nfs/dbraw/zinc/55/94/28/584559428.db2.gz POHNMBZDMAGIIX-NWDGAFQWSA-N 2 0 242.432 2.250 20 0 BEADRP CSCC[C@H](C)[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000902328455 584561206 /nfs/dbraw/zinc/56/12/06/584561206.db2.gz KVONVHZXRKCSDP-RYUDHWBXSA-N 2 0 244.448 2.496 20 0 BEADRP CCC[C@@H]([NH2+]CC1([NH3+])CC1)C1CCCC1 ZINC000902407782 584574570 /nfs/dbraw/zinc/57/45/70/584574570.db2.gz URHDHOVOPLYGGV-GFCCVEGCSA-N 2 0 210.365 2.426 20 0 BEADRP COc1ccc([C@@H](C)[NH2+][C@H](C)C2C[NH2+]C2)cc1C ZINC000902407458 584574988 /nfs/dbraw/zinc/57/49/88/584574988.db2.gz ZMMYRWZXEZNGBK-VXGBXAGGSA-N 2 0 248.370 2.262 20 0 BEADRP CCC[C@H](C[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1)OC ZINC000902389227 584580785 /nfs/dbraw/zinc/58/07/85/584580785.db2.gz TTYFTWRBQCYEEQ-CHWSQXEVSA-N 2 0 242.407 2.169 20 0 BEADRP CC1CC(C[NH2+][C@H]2CC[NH2+]CC(C)(C)C2)C1 ZINC000902395818 584585182 /nfs/dbraw/zinc/58/51/82/584585182.db2.gz FSXHTSHOLARDOA-BPCQOVAHSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+][C@H](C)c1ccc2c(c1)CCO2 ZINC000902405366 584588621 /nfs/dbraw/zinc/58/86/21/584588621.db2.gz MSXXOWBRPMAEAB-IJLUTSLNSA-N 2 0 248.370 2.398 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+][C@H](C)c1ccc2c(c1)CCO2 ZINC000902405364 584588786 /nfs/dbraw/zinc/58/87/86/584588786.db2.gz MSXXOWBRPMAEAB-GRYCIOLGSA-N 2 0 248.370 2.398 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H]2CC[C@@H]3CCCC[C@H]3C2)CC1 ZINC000902415550 584589484 /nfs/dbraw/zinc/58/94/84/584589484.db2.gz IKKJRYSHNZHFME-RWMBFGLXSA-N 2 0 222.376 2.426 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CC[C@@H]1CCC(C)(C)CO1 ZINC000902428680 584595050 /nfs/dbraw/zinc/59/50/50/584595050.db2.gz GCLDVCMIOBXGLE-AVGNSLFASA-N 2 0 242.407 2.297 20 0 BEADRP CC(C)(C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)C1CC1 ZINC000902432239 584595310 /nfs/dbraw/zinc/59/53/10/584595310.db2.gz OWJOCPDTBMGSJV-OUCADQQQSA-N 2 0 236.403 2.400 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)S2 ZINC000902445858 584599006 /nfs/dbraw/zinc/59/90/06/584599006.db2.gz MWDRDXSSCPGUNY-QUDJTUOCSA-N 2 0 228.405 2.128 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)S2 ZINC000902445856 584599154 /nfs/dbraw/zinc/59/91/54/584599154.db2.gz MWDRDXSSCPGUNY-IACCCYARSA-N 2 0 228.405 2.128 20 0 BEADRP C[C@H](NCC1([NH3+])CC1)c1ccc2c(c1)CCC2 ZINC000902414518 584600193 /nfs/dbraw/zinc/60/01/93/584600193.db2.gz CEOMHGCHEUYRCV-NSHDSACASA-N 2 0 230.355 2.317 20 0 BEADRP Cc1cccc(C[C@@H]([NH2+]CC2(N)CC2)C2CC2)c1 ZINC000902414625 584600234 /nfs/dbraw/zinc/60/02/34/584600234.db2.gz YRMFFAQOPGBVDT-OAHLLOKOSA-N 2 0 244.382 2.397 20 0 BEADRP CCO[C@H]1C[C@H]([NH2+]CC2([NH3+])CC2)C1(CC)CC ZINC000902414536 584600415 /nfs/dbraw/zinc/60/04/15/584600415.db2.gz WSYSMGYZKDLWIT-RYUDHWBXSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@H]1CCCC[C@H]1[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902472719 584601412 /nfs/dbraw/zinc/60/14/12/584601412.db2.gz GFJVSAVZOJHVKI-CKIKVBCHSA-N 2 0 208.349 2.048 20 0 BEADRP C1C[C@@H]2[NH2+][C@H]1C[C@H]2[NH2+]C1C2CC3CC(C2)CC1C3 ZINC000902472491 584601505 /nfs/dbraw/zinc/60/15/05/584601505.db2.gz BAUASSZKSUYNOJ-JSWGIKQKSA-N 2 0 246.398 2.294 20 0 BEADRP C[C@@H](CCC(F)(F)F)[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902474178 584601995 /nfs/dbraw/zinc/60/19/95/584601995.db2.gz DCOLUERKJUKOKH-QCLAVDOMSA-N 2 0 236.281 2.200 20 0 BEADRP C[C@@H]1CCC[C@@H](C)C1[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902474614 584602114 /nfs/dbraw/zinc/60/21/14/584602114.db2.gz GFSBCSXKHDJQJH-NJMOYASZSA-N 2 0 222.376 2.294 20 0 BEADRP CC[C@H]1CCC[C@@H]([NH2+][C@@H]2C[C@H]3CC[C@@H]2[NH2+]3)C1 ZINC000902474474 584602343 /nfs/dbraw/zinc/60/23/43/584602343.db2.gz FOPVYEHJMIKGJA-MQLXINIDSA-N 2 0 222.376 2.438 20 0 BEADRP CC1CCC([NH2+][C@H]2C[NH2+]CC2(C)C)CC1 ZINC000902447733 584604574 /nfs/dbraw/zinc/60/45/74/584604574.db2.gz VGWPYZXQLPXZGA-MCIGGMRASA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)(C)[C@@H]1CC[C@@H]1[NH2+][C@H]1C[NH2+]CC1(C)C ZINC000902447503 584604684 /nfs/dbraw/zinc/60/46/84/584604684.db2.gz YPSXDOJMFFMBFA-WOPDTQHZSA-N 2 0 224.392 2.399 20 0 BEADRP CC1(C)C[NH2+]C[C@@H]1[NH2+][C@@H](C1CC1)C1CCC1 ZINC000902447550 584604989 /nfs/dbraw/zinc/60/49/89/584604989.db2.gz ZLXUKTCQXDCLIZ-QWHCGFSZSA-N 2 0 222.376 2.153 20 0 BEADRP CC[C@@H]1CCC[C@H]1[NH2+][C@@H]1C[NH2+]CC1(C)C ZINC000902448117 584605137 /nfs/dbraw/zinc/60/51/37/584605137.db2.gz CJTNEHCTMGCTTM-IJLUTSLNSA-N 2 0 210.365 2.153 20 0 BEADRP C1CC2(C1)[NH2+]CC[C@@H]2[NH2+][C@H]1C[C@H]2CCC[C@H]21 ZINC000902453080 584608106 /nfs/dbraw/zinc/60/81/06/584608106.db2.gz CCZDWXCZWPQYNP-NDBYEHHHSA-N 2 0 220.360 2.049 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCCC2(CC2)C1)[C@@H]1CCC[NH2+]1 ZINC000902455219 584609112 /nfs/dbraw/zinc/60/91/12/584609112.db2.gz WWEKUBFVAFTXGF-UPJWGTAASA-N 2 0 222.376 2.439 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CCC=CCCC1)C1C[NH2+]C1 ZINC000902454810 584609405 /nfs/dbraw/zinc/60/94/05/584609405.db2.gz IKKBDDIHQOGTPM-CHWSQXEVSA-N 2 0 222.376 2.320 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+][C@H]1CCCC2(CC2)C1 ZINC000902455780 584609703 /nfs/dbraw/zinc/60/97/03/584609703.db2.gz YYWDZILGKGLGOC-RYUDHWBXSA-N 2 0 222.376 2.439 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCCC2(CC2)C1)[C@H]1CCC[NH2+]1 ZINC000902455218 584609744 /nfs/dbraw/zinc/60/97/44/584609744.db2.gz WWEKUBFVAFTXGF-JHJVBQTASA-N 2 0 222.376 2.439 20 0 BEADRP CC[C@H]([NH2+][C@@H]1C[C@@H]2CCC[C@H]12)[C@@H]1CCC[NH2+]1 ZINC000902459185 584610894 /nfs/dbraw/zinc/61/08/94/584610894.db2.gz YLAVISXYYIZOPX-HTVCTNPSSA-N 2 0 222.376 2.295 20 0 BEADRP CC1(C)CCC[C@H](C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)O1 ZINC000902461202 584611368 /nfs/dbraw/zinc/61/13/68/584611368.db2.gz LXEHLFWVZSHEQL-FRRDWIJNSA-N 2 0 240.391 2.194 20 0 BEADRP C1CC1[C@@H]([NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2)C1CCCC1 ZINC000902461761 584611787 /nfs/dbraw/zinc/61/17/87/584611787.db2.gz RHYWBBQMKLBXKP-YJNKXOJESA-N 2 0 234.387 2.438 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]C[C@@H]1CCCC(C)(C)O1 ZINC000902462638 584612060 /nfs/dbraw/zinc/61/20/60/584612060.db2.gz WOBJWPJOLAQZQS-STQMWFEESA-N 2 0 242.407 2.441 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@H]([NH2+][C@@H]2C[C@@H]3CC[C@H]2[NH2+]3)C1 ZINC000902462984 584612466 /nfs/dbraw/zinc/61/24/66/584612466.db2.gz YLNXSWLIRCAFNO-GSZZWUTPSA-N 2 0 222.376 2.294 20 0 BEADRP CCCC(CCC)[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902464699 584613327 /nfs/dbraw/zinc/61/33/27/584613327.db2.gz BROQYWFVMGUVFH-YNEHKIRRSA-N 2 0 210.365 2.438 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@@H]2C[C@@H]3CC[C@H]2[NH2+]3)[C@H]1C ZINC000902465891 584613708 /nfs/dbraw/zinc/61/37/08/584613708.db2.gz HIBYDIQCAAKJHP-BBMNEWJDSA-N 2 0 222.376 2.294 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@@H]2C[C@@H]3CC[C@H]2[NH2+]3)[C@@H]1C ZINC000902465898 584613803 /nfs/dbraw/zinc/61/38/03/584613803.db2.gz HIBYDIQCAAKJHP-UYYXNEDZSA-N 2 0 222.376 2.294 20 0 BEADRP FCCC[C@@H]1CCC[C@H]1[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902467610 584614489 /nfs/dbraw/zinc/61/44/89/584614489.db2.gz PNQVAKVWKCXYGA-MQLXINIDSA-N 2 0 240.366 2.387 20 0 BEADRP FCCC[C@H]1CCC[C@H]1[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902467612 584614678 /nfs/dbraw/zinc/61/46/78/584614678.db2.gz PNQVAKVWKCXYGA-XGFWRYKXSA-N 2 0 240.366 2.387 20 0 BEADRP C1CC2(C1)CCC[C@@H]2[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902468277 584614887 /nfs/dbraw/zinc/61/48/87/584614887.db2.gz SWNKBHHGQFPTLM-XQHKEYJVSA-N 2 0 220.360 2.192 20 0 BEADRP FCCC[C@@H]1CCC[C@H]1[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902469368 584615314 /nfs/dbraw/zinc/61/53/14/584615314.db2.gz PNQVAKVWKCXYGA-ODXJTPSBSA-N 2 0 240.366 2.387 20 0 BEADRP FCCC[C@H]1CCC[C@H]1[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902469370 584615340 /nfs/dbraw/zinc/61/53/40/584615340.db2.gz PNQVAKVWKCXYGA-XVIXHAIJSA-N 2 0 240.366 2.387 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@@H]2C[C@@H]3CC[C@H]2[NH2+]3)C1 ZINC000902469283 584615481 /nfs/dbraw/zinc/61/54/81/584615481.db2.gz VUOXQZRVHZKHQU-KSSYENDESA-N 2 0 208.349 2.048 20 0 BEADRP C1CC(C([NH2+][C@@H]2C[C@H]3CC[C@@H]2[NH2+]3)C2CCC2)C1 ZINC000902469237 584615787 /nfs/dbraw/zinc/61/57/87/584615787.db2.gz ZKCITMMDLWSHNL-HZSPNIEDSA-N 2 0 234.387 2.438 20 0 BEADRP C[C@H]1CCC[C@@H]([NH2+][C@@H]2C[C@@H]3CC[C@H]2[NH2+]3)C1 ZINC000902469284 584615799 /nfs/dbraw/zinc/61/57/99/584615799.db2.gz VUOXQZRVHZKHQU-OBPIAQAESA-N 2 0 208.349 2.048 20 0 BEADRP C[C@H]1CCC[C@H]([NH2+][C@@H]2C[C@@H]3CC[C@H]2[NH2+]3)C1 ZINC000902469282 584615938 /nfs/dbraw/zinc/61/59/38/584615938.db2.gz VUOXQZRVHZKHQU-JZRPKSSGSA-N 2 0 208.349 2.048 20 0 BEADRP CC[C@H]1CCC[C@H]1[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902471314 584616479 /nfs/dbraw/zinc/61/64/79/584616479.db2.gz MVPABWCNFDHBDF-KIJLLGNVSA-N 2 0 208.349 2.048 20 0 BEADRP CC[C@H]1CCCC[C@H]1[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902470482 584616850 /nfs/dbraw/zinc/61/68/50/584616850.db2.gz YOVOAPNUAKDCFW-ODXJTPSBSA-N 2 0 222.376 2.438 20 0 BEADRP Cc1nc([C@@H](C)[NH2+][C@H]2C[C@H](C[NH3+])C2)c(C)s1 ZINC000902489950 584617690 /nfs/dbraw/zinc/61/76/90/584617690.db2.gz QKRAXXFNKXQDKT-AVPPRXQKSA-N 2 0 239.388 2.148 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+][C@H]2CCc3ccc(F)cc32)C1 ZINC000902490501 584617924 /nfs/dbraw/zinc/61/79/24/584617924.db2.gz VRIBWCSQHGEHID-WFBYXXMGSA-N 2 0 234.318 2.140 20 0 BEADRP C[C@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1ccc(F)cc1 ZINC000902490521 584618072 /nfs/dbraw/zinc/61/80/72/584618072.db2.gz VZAVINSYTWFTIA-KWBADKCTSA-N 2 0 222.307 2.214 20 0 BEADRP C[C@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1ccccc1N(C)C ZINC000902490865 584618230 /nfs/dbraw/zinc/61/82/30/584618230.db2.gz VMTLSVVWOZJGRI-AVGNSLFASA-N 2 0 247.386 2.141 20 0 BEADRP C[C@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1ccnc(Cl)c1 ZINC000902491695 584618434 /nfs/dbraw/zinc/61/84/34/584618434.db2.gz YLCKVVDCQLDQAR-QXEWZRGKSA-N 2 0 239.750 2.123 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H]1CCCCC[NH2+]1)C1CC1 ZINC000902482431 584623765 /nfs/dbraw/zinc/62/37/65/584623765.db2.gz LDWMDRWWCLFHEE-QWHCGFSZSA-N 2 0 210.365 2.297 20 0 BEADRP CO[C@@H]1CCC[C@H]([NH2+]C[C@H]2CCCCC[NH2+]2)C1 ZINC000902482420 584623800 /nfs/dbraw/zinc/62/38/00/584623800.db2.gz LDVCYJWBJIRZEM-BFHYXJOUSA-N 2 0 240.391 2.066 20 0 BEADRP Cc1cc([C@@H](C)[NH2+][C@H]2C[C@H](C[NH3+])C2)oc1C ZINC000902484130 584624764 /nfs/dbraw/zinc/62/47/64/584624764.db2.gz DKBUFMLMRYDNLZ-YUSALJHKSA-N 2 0 222.332 2.284 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@H]2C[C@H](C[NH3+])C2)[C@@H](C)C1 ZINC000902485356 584624895 /nfs/dbraw/zinc/62/48/95/584624895.db2.gz JXTJJECHTITXKL-MLGHIDQZSA-N 2 0 210.365 2.138 20 0 BEADRP CCOc1cccc([C@H](C)[NH2+][C@H]2C[C@H](C[NH3+])C2)c1 ZINC000902486406 584625308 /nfs/dbraw/zinc/62/53/08/584625308.db2.gz GUGIUKHDMZJIMK-OBJOEFQTSA-N 2 0 248.370 2.473 20 0 BEADRP C[C@@H]1CC[C@@H](C)[C@H]([NH2+][C@H]2C[C@H](C[NH3+])C2)C1 ZINC000902486128 584625524 /nfs/dbraw/zinc/62/55/24/584625524.db2.gz PWEUGWCPUMLQNC-SYLRKERUSA-N 2 0 210.365 2.138 20 0 BEADRP CC1(C)CCC[C@H]([NH2+][C@H]2C[C@H](C[NH3+])C2)C1 ZINC000902486745 584625824 /nfs/dbraw/zinc/62/58/24/584625824.db2.gz RRTOKVMTCQKFEW-SRVKXCTJSA-N 2 0 210.365 2.282 20 0 BEADRP Cc1ccccc1[C@@H](C)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902486613 584626085 /nfs/dbraw/zinc/62/60/85/584626085.db2.gz APNTZENVTRHOER-JHJVBQTASA-N 2 0 218.344 2.383 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+][C@H]2CCCc3sccc32)C1 ZINC000902487477 584626375 /nfs/dbraw/zinc/62/63/75/584626375.db2.gz HGJDJVYUMUWARF-NHCYSSNCSA-N 2 0 236.384 2.452 20 0 BEADRP CCc1cccnc1[C@@H](C)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902488449 584626543 /nfs/dbraw/zinc/62/65/43/584626543.db2.gz YJMJWOQJCSOVQF-NQBHXWOUSA-N 2 0 233.359 2.032 20 0 BEADRP CC[C@H]1CCCC[C@H]1[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902487338 584626554 /nfs/dbraw/zinc/62/65/54/584626554.db2.gz SZMNLHCJUNHPLH-ZDEQEGDKSA-N 2 0 210.365 2.282 20 0 BEADRP Cc1nc(C)c([C@@H](C)[NH2+][C@H]2C[C@H](C[NH3+])C2)s1 ZINC000902487705 584627009 /nfs/dbraw/zinc/62/70/09/584627009.db2.gz LVFKMSWHAALDBD-FBIMIBRVSA-N 2 0 239.388 2.148 20 0 BEADRP Cc1ccccc1C[C@H](C)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902489361 584627357 /nfs/dbraw/zinc/62/73/57/584627357.db2.gz PKZGDSXAFMYXGG-YDHLFZDLSA-N 2 0 232.371 2.253 20 0 BEADRP C[C@@H](CCc1ccccc1)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902488610 584627424 /nfs/dbraw/zinc/62/74/24/584627424.db2.gz NOGVAXKOIIIEKW-QEJZJMRPSA-N 2 0 232.371 2.335 20 0 BEADRP Cc1ncccc1CC[NH2+][C@H](C)CCCC[NH3+] ZINC000902514103 584629520 /nfs/dbraw/zinc/62/95/20/584629520.db2.gz PWQHUWCUKSFFHS-GFCCVEGCSA-N 2 0 235.375 2.040 20 0 BEADRP Cc1ncccc1CC[NH2+][C@@H]1CCCC[C@@H]1C[NH3+] ZINC000902514649 584629574 /nfs/dbraw/zinc/62/95/74/584629574.db2.gz TWCHXZDUFPHWJB-HUUCEWRRSA-N 2 0 247.386 2.040 20 0 BEADRP Cl/C=C/C[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000902516018 584630410 /nfs/dbraw/zinc/63/04/10/584630410.db2.gz BROZXZFZGONTGT-YNLMUREESA-N 2 0 228.767 2.249 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+]C1C[C@H]2CCC[C@@H]2C1 ZINC000902780763 584669776 /nfs/dbraw/zinc/66/97/76/584669776.db2.gz SAHJFJQFFRTGSL-JHJVBQTASA-N 2 0 224.392 2.495 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+]C2C[C@H]3CCC[C@@H]3C2)C1 ZINC000902796982 584674686 /nfs/dbraw/zinc/67/46/86/584674686.db2.gz SARCGRACNOVHRP-MGPQQGTHSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H](C[NH2+]C1C[C@@H]2CCC[C@H]2C1)C[NH+](C)C ZINC000902999212 584715165 /nfs/dbraw/zinc/71/51/65/584715165.db2.gz MRAKNVWDEAUTNQ-AGIUHOORSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C1CC1 ZINC000903079324 584724610 /nfs/dbraw/zinc/72/46/10/584724610.db2.gz LXSOTDNWKYVAEN-IZQGUMMNSA-N 2 0 234.387 2.390 20 0 BEADRP C1=C[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C2CC2)CC1 ZINC000903199672 584734797 /nfs/dbraw/zinc/73/47/97/584734797.db2.gz LSYGVCMARNSSBH-YPRXJGMQSA-N 2 0 232.371 2.452 20 0 BEADRP CC(C)(F)C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C1CC1 ZINC000903209636 584737040 /nfs/dbraw/zinc/73/70/40/584737040.db2.gz MJTQYGFAQSEHFK-VGPLMAKISA-N 2 0 240.366 2.482 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@H+]1Cc2ccccc2[C@@H](C)C1 ZINC000903427275 584760965 /nfs/dbraw/zinc/76/09/65/584760965.db2.gz ULAYWIJGKMTJJS-IPYPFGDCSA-N 2 0 244.382 2.461 20 0 BEADRP C[C@@H]1C[N@H+](Cc2ccc3cc[nH]c3c2)CC[C@H]1[NH3+] ZINC000903425252 584761131 /nfs/dbraw/zinc/76/11/31/584761131.db2.gz YNMIEXWSIYVZSE-BXUZGUMPSA-N 2 0 243.354 2.337 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@@H+]1CCC[C@H]1C(C)(C)C ZINC000903435083 584761972 /nfs/dbraw/zinc/76/19/72/584761972.db2.gz NFUVHSAHIXMKSG-AGIUHOORSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@@H+]1CCc2ccccc2[C@H]1C ZINC000903434868 584762089 /nfs/dbraw/zinc/76/20/89/584762089.db2.gz LVQGWFVZZYXVEW-NFAWXSAZSA-N 2 0 244.382 2.461 20 0 BEADRP C[C@@H]1Cc2ccccc2CN1C[C@H]1CCC[NH2+]1 ZINC000903440415 584763177 /nfs/dbraw/zinc/76/31/77/584763177.db2.gz XAMLJKHLZAFGAF-IUODEOHRSA-N 2 0 230.355 2.185 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CC[C@H]([NH3+])C1 ZINC000903458513 584765247 /nfs/dbraw/zinc/76/52/47/584765247.db2.gz BTHZIXRYABQUQI-NDBYEHHHSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+][C@@H]1CCCC[C@H]1[NH2+]C[C@H]1C[C@@H]2[C@H](C1)C2(F)F ZINC000903459105 584765721 /nfs/dbraw/zinc/76/57/21/584765721.db2.gz BMIVFTSRPJTNDL-IYKVGLELSA-N 2 0 244.329 2.137 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1 ZINC000903453834 584772710 /nfs/dbraw/zinc/77/27/10/584772710.db2.gz NJEYFYSEIRDEMP-KBXIAJHMSA-N 2 0 236.403 2.354 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[N@@H+]2CCC[C@H]2c2cccnc2)C1 ZINC000903454436 584773723 /nfs/dbraw/zinc/77/37/23/584773723.db2.gz CBZSBCUYMLQFMF-CFVMTHIKSA-N 2 0 245.370 2.346 20 0 BEADRP CC(C)=CCC[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000903470377 584774629 /nfs/dbraw/zinc/77/46/29/584774629.db2.gz AKHWBPDOWXSKON-LBPRGKRZSA-N 2 0 208.349 2.217 20 0 BEADRP C(C[NH2+][C@H]1CC[NH2+]C12CCC2)CC1CCC1 ZINC000903471443 584775599 /nfs/dbraw/zinc/77/55/99/584775599.db2.gz JBDMKAPUKOGHPY-ZDUSSCGKSA-N 2 0 222.376 2.441 20 0 BEADRP C(CC1CCC1)[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000903472904 584776204 /nfs/dbraw/zinc/77/62/04/584776204.db2.gz WPZBGJIHPIWJIV-LBPRGKRZSA-N 2 0 208.349 2.051 20 0 BEADRP COc1cccc2c1C[N@H+](C[C@@H]1CC[C@H]([NH3+])C1)C2 ZINC000903474017 584777021 /nfs/dbraw/zinc/77/70/21/584777021.db2.gz FHUMNLHQVAZKGJ-YPMHNXCESA-N 2 0 246.354 2.138 20 0 BEADRP CC1(C)[C@H]([NH3+])C[C@H]1[NH2+]Cc1ccc2cc[nH]c2c1 ZINC000903482635 584778854 /nfs/dbraw/zinc/77/88/54/584778854.db2.gz NLTINWCFGNZOCY-ZIAGYGMSSA-N 2 0 243.354 2.383 20 0 BEADRP C(CC1CCC1)[NH2+][C@@H]1CC[NH2+]C12CCCC2 ZINC000903482236 584778890 /nfs/dbraw/zinc/77/88/90/584778890.db2.gz ZQTQGGFKLKMGLR-CYBMUJFWSA-N 2 0 222.376 2.441 20 0 BEADRP CC(C)OCCC[NH2+][C@H]1CC[NH2+]C12CCCC2 ZINC000903484045 584779281 /nfs/dbraw/zinc/77/92/81/584779281.db2.gz OMTYRPUYIDKGKC-ZDUSSCGKSA-N 2 0 240.391 2.066 20 0 BEADRP CC1(C)CN(CCCCC(F)(F)F)C[C@H]1[NH3+] ZINC000903556571 584782766 /nfs/dbraw/zinc/78/27/66/584782766.db2.gz AGLXUGURCVJVGZ-SECBINFHSA-N 2 0 238.297 2.388 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2CF)C1 ZINC000903716757 584791596 /nfs/dbraw/zinc/79/15/96/584791596.db2.gz RPWVINHITUHUTA-LBPRGKRZSA-N 2 0 236.334 2.197 20 0 BEADRP CCCC[N@H+](CCOC)C[C@@H]1CCCC[NH2+]C1 ZINC000903729708 584792826 /nfs/dbraw/zinc/79/28/26/584792826.db2.gz QWPUYEXSNHXPGO-CQSZACIVSA-N 2 0 242.407 2.125 20 0 BEADRP CC1([NH3+])CC[NH+](Cc2ccccc2CF)CC1 ZINC000903745685 584794456 /nfs/dbraw/zinc/79/44/56/584794456.db2.gz NXOVJVOLFTUOCI-UHFFFAOYSA-N 2 0 236.334 2.469 20 0 BEADRP CC1CC(C[N@@H+]2CCC[C@@H](CC[NH3+])C2)C1 ZINC000903748030 584795125 /nfs/dbraw/zinc/79/51/25/584795125.db2.gz YCEFAPYQNSUMIJ-CPCZMJQVSA-N 2 0 210.365 2.093 20 0 BEADRP CC1CC(C[N@@H+]2CCCC[C@H]2[C@H]2CC[NH2+]C2)C1 ZINC000903752461 584795281 /nfs/dbraw/zinc/79/52/81/584795281.db2.gz SSGLFIPHTABYHI-WUCCLRPBSA-N 2 0 236.403 2.497 20 0 BEADRP CC1CC(C[NH+]2CCC3(CC[NH2+]C3)CC2)C1 ZINC000903750368 584795553 /nfs/dbraw/zinc/79/55/53/584795553.db2.gz YYYFZPOAXKKUGY-UHFFFAOYSA-N 2 0 222.376 2.108 20 0 BEADRP FC1(F)C[C@]12CC[N@H+](C[C@@H]1CCCC[NH2+]C1)C2 ZINC000903768790 584798377 /nfs/dbraw/zinc/79/83/77/584798377.db2.gz QVVYUOSUXMZFHI-NEPJUHHUSA-N 2 0 244.329 2.107 20 0 BEADRP NC[C@]12CC[C@H]1CCC[N@@H+]2CCc1ccccc1 ZINC000903795033 584799405 /nfs/dbraw/zinc/79/94/05/584799405.db2.gz HXXZJBYKJVMXCS-HZPDHXFCSA-N 2 0 244.382 2.432 20 0 BEADRP C1=CC[C@@H]2C[N@@H+](C[C@H]3CCCC[NH2+]C3)C[C@@H]2C1 ZINC000903778045 584799449 /nfs/dbraw/zinc/79/94/49/584799449.db2.gz JFYAOWZPFTYNKU-SOUVJXGZSA-N 2 0 234.387 2.274 20 0 BEADRP CC1(C)[C@@H]([NH3+])C[C@@H]1[NH2+]Cc1ccccc1CF ZINC000903783172 584800151 /nfs/dbraw/zinc/80/01/51/584800151.db2.gz VTKFUWGTJSDQFM-STQMWFEESA-N 2 0 236.334 2.372 20 0 BEADRP CC1(C)[C@H]([NH2+]Cc2ccccc2CF)C[C@@H]1[NH3+] ZINC000903783171 584800327 /nfs/dbraw/zinc/80/03/27/584800327.db2.gz VTKFUWGTJSDQFM-QWHCGFSZSA-N 2 0 236.334 2.372 20 0 BEADRP [NH3+]CC1([C@@H]2CCCC[N@@H+]2CCCF)CCC1 ZINC000903810301 584803689 /nfs/dbraw/zinc/80/36/89/584803689.db2.gz ADIUMQMVASQPIG-LBPRGKRZSA-N 2 0 228.355 2.330 20 0 BEADRP C[C@]12C[N@H+](C[C@@H]3CCC[NH2+]C3)C[C@H]1[C@H]1CC[C@@H]2C1 ZINC000903827768 584805013 /nfs/dbraw/zinc/80/50/13/584805013.db2.gz WRIGUBBUYLXCDW-DGADGQDISA-N 2 0 248.414 2.354 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@@H+]1C[C@@H]2[C@@H]3CC[C@@H](C3)[C@]2(C)C1 ZINC000903826870 584805053 /nfs/dbraw/zinc/80/50/53/584805053.db2.gz MAZJGIMVAWGKCT-XMEMRUQMSA-N 2 0 248.414 2.210 20 0 BEADRP Cc1cccnc1[C@@H]([NH2+]CCC[NH3+])C(C)(C)C ZINC000903829617 584805417 /nfs/dbraw/zinc/80/54/17/584805417.db2.gz IKPSYVGPZMNWAA-CYBMUJFWSA-N 2 0 235.375 2.416 20 0 BEADRP FCCC1C[C@H]2CC[C@@H](C1)[N@H+]2C[C@H]1CC[NH2+]C1 ZINC000903831896 584806273 /nfs/dbraw/zinc/80/62/73/584806273.db2.gz MZTBQIPTSQFLHD-PBNFFQIGSA-N 2 0 240.366 2.199 20 0 BEADRP C[C@@H]1CC=CC[C@H]1[NH2+]C[C@H]1CCCC[NH2+]C1 ZINC000903850537 584808301 /nfs/dbraw/zinc/80/83/01/584808301.db2.gz UEVYFJRVDAXMRM-HZSPNIEDSA-N 2 0 222.376 2.320 20 0 BEADRP CC(C)C[C@H](C)C[N@@H+]1CCC[C@]12CC[NH2+]C2 ZINC000903872281 584815171 /nfs/dbraw/zinc/81/51/71/584815171.db2.gz YGSBZOAJFBGTFW-UONOGXRCSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@]1(C)CCCN(C[C@@H]([NH3+])CC(F)F)C1 ZINC000903894985 584819954 /nfs/dbraw/zinc/81/99/54/584819954.db2.gz JBSAZXWBRUXVHG-CMPLNLGQSA-N 2 0 234.334 2.481 20 0 BEADRP C[C@@H]1C[N@H+](C[C@H]([NH3+])CC(F)F)[C@H]2CCCC[C@H]12 ZINC000903903513 584821297 /nfs/dbraw/zinc/82/12/97/584821297.db2.gz UXFQUUBPMLZLGQ-KKOKHZNYSA-N 2 0 246.345 2.479 20 0 BEADRP C[C@H]([NH2+]CC1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccccn1 ZINC000903928201 584824637 /nfs/dbraw/zinc/82/46/37/584824637.db2.gz XOIFGIWVOJFFFT-FUDCBSFHSA-N 2 0 245.370 2.263 20 0 BEADRP C1=C[C@H]([NH2+]Cc2cccc3c2CC[NH2+]C3)CC1 ZINC000903933275 584824772 /nfs/dbraw/zinc/82/47/72/584824772.db2.gz NWMBORYYINYDCJ-AWEZNQCLSA-N 2 0 228.339 2.141 20 0 BEADRP CC1(C[N@@H+]2CCCC[C@]3(CC[NH2+]C3)C2)CC1 ZINC000903960033 584827449 /nfs/dbraw/zinc/82/74/49/584827449.db2.gz VKOFIAMPJUBKKO-CQSZACIVSA-N 2 0 222.376 2.252 20 0 BEADRP CC1(C)CCC[C@@H]1[NH2+]C[C@@H]1C[NH2+]CCC1(F)F ZINC000903957952 584827594 /nfs/dbraw/zinc/82/75/94/584827594.db2.gz UYTVHLHWWBMAKP-QWRGUYRKSA-N 2 0 246.345 2.400 20 0 BEADRP COc1ccc(C[NH2+]CCC(C)(C)[NH3+])c(F)c1 ZINC000903940009 584828826 /nfs/dbraw/zinc/82/88/26/584828826.db2.gz SUIDTLDFRMKQBL-UHFFFAOYSA-N 2 0 240.322 2.051 20 0 BEADRP C[C@@H](CCC(F)(F)F)[NH2+]CCC(C)(C)[NH3+] ZINC000903939749 584828876 /nfs/dbraw/zinc/82/88/76/584828876.db2.gz LOLYALGLHDTNKE-QMMMGPOBSA-N 2 0 226.286 2.434 20 0 BEADRP CC(C)C[C@H]([NH3+])C[NH2+]C1CCC=CCC1 ZINC000903962897 584829060 /nfs/dbraw/zinc/82/90/60/584829060.db2.gz LVXTVZINDNHVBI-LBPRGKRZSA-N 2 0 210.365 2.448 20 0 BEADRP CCC[C@@H](C)C[NH2+]C[C@@H]1C[NH2+]CCC1(F)F ZINC000903955771 584832001 /nfs/dbraw/zinc/83/20/01/584832001.db2.gz YPKOCPJPAGZDMO-MNOVXSKESA-N 2 0 234.334 2.257 20 0 BEADRP CCC[C@@H](C)C[NH2+]C[C@H]1C[NH2+]CCC1(F)F ZINC000903955770 584832217 /nfs/dbraw/zinc/83/22/17/584832217.db2.gz YPKOCPJPAGZDMO-GHMZBOCLSA-N 2 0 234.334 2.257 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+]CC1CCCCC1 ZINC000903974225 584832462 /nfs/dbraw/zinc/83/24/62/584832462.db2.gz MKUSKRKDKCXHDE-TZMCWYRMSA-N 2 0 224.392 2.402 20 0 BEADRP COc1ccc(C[NH2+]CC[C@@H]2C[NH2+]C[C@H]2C)cc1 ZINC000903973565 584832683 /nfs/dbraw/zinc/83/26/83/584832683.db2.gz GTHGPDFRLGTNOV-TZMCWYRMSA-N 2 0 248.370 2.030 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+][C@@H]1CCC[C@H](C)C1 ZINC000903975093 584832739 /nfs/dbraw/zinc/83/27/39/584832739.db2.gz XBRAPMLRFROLAJ-REWJHTLYSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+]CC1CCCCC1 ZINC000903964289 584833875 /nfs/dbraw/zinc/83/38/75/584833875.db2.gz IAYPKJOTCSYMQJ-YPMHNXCESA-N 2 0 210.365 2.012 20 0 BEADRP Cc1cc(F)ccc1C[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000903964508 584833945 /nfs/dbraw/zinc/83/39/45/584833945.db2.gz KLKSHCSIGUWEEJ-YPMHNXCESA-N 2 0 236.334 2.079 20 0 BEADRP Cc1ccc(C[NH2+]C[C@@H]2C[NH2+]C[C@H]2C)c(C)c1 ZINC000903964665 584834133 /nfs/dbraw/zinc/83/41/33/584834133.db2.gz NYTSXRHQFUGLLQ-HIFRSBDPSA-N 2 0 232.371 2.249 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+][C@@H]1CCC[C@@H](C2CC2)C1 ZINC000903965092 584834311 /nfs/dbraw/zinc/83/43/11/584834311.db2.gz ZWNMIGZRUZIJRT-FMKGYKFTSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+]C[C@H]1CCC[C@@H](C)C1 ZINC000903965024 584834513 /nfs/dbraw/zinc/83/45/13/584834513.db2.gz YLAFTAMIGKZEJC-FVCCEPFGSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+]C1CCC(C)CC1 ZINC000903966775 584834577 /nfs/dbraw/zinc/83/45/77/584834577.db2.gz BYZQDUVRPWNSQH-QBHFIFKDSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+][C@@H]1CC[C@@H](C)C[C@H]1C ZINC000903965020 584834580 /nfs/dbraw/zinc/83/45/80/584834580.db2.gz YHXJEIJDYIDYDB-SYLRKERUSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+]C[C@@H]1CCC[C@H](C)C1 ZINC000903965026 584834680 /nfs/dbraw/zinc/83/46/80/584834680.db2.gz YLAFTAMIGKZEJC-UMSGYPCISA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+]Cc1cc(Cl)cs1 ZINC000903968698 584834882 /nfs/dbraw/zinc/83/48/82/584834882.db2.gz ZJMFFURGFSZESL-BDAKNGLRSA-N 2 0 244.791 2.347 20 0 BEADRP C[C@H](C[NH2+]C[C@@H]1C[NH2+]C[C@H]1C)c1ccccc1 ZINC000903967736 584835004 /nfs/dbraw/zinc/83/50/04/584835004.db2.gz MNSMUVSTCGFMAN-UMVBOHGHSA-N 2 0 232.371 2.235 20 0 BEADRP CC(C)CC[C@H](C)[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000903968006 584835074 /nfs/dbraw/zinc/83/50/74/584835074.db2.gz OUUTXKISEXIKBN-AGIUHOORSA-N 2 0 212.381 2.256 20 0 BEADRP C[C@@H](CC1CCCC1)[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000903967084 584835084 /nfs/dbraw/zinc/83/50/84/584835084.db2.gz GSACVUSBFSILPH-DYEKYZERSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1C[C@H](C[NH2+]C(C)(C)/C=C\Cl)CC[NH2+]1 ZINC000903988095 584836003 /nfs/dbraw/zinc/83/60/03/584836003.db2.gz NPKSAUBRCIXXEK-ADRPCIBZSA-N 2 0 230.783 2.495 20 0 BEADRP C[C@@H]1c2ccccc2CC[N@H+]1C[C@H]1C[C@@H]([NH3+])C1 ZINC000904317166 584864142 /nfs/dbraw/zinc/86/41/42/584864142.db2.gz CUIXBLSIQSFCJW-BZPMIXESSA-N 2 0 230.355 2.343 20 0 BEADRP COc1ccc(C[N@H+](C)C[C@H]2C[C@@H]([NH3+])C2)cc1C ZINC000904317399 584864367 /nfs/dbraw/zinc/86/43/67/584864367.db2.gz VSZSAWPVAGDVKA-OKILXGFUSA-N 2 0 248.370 2.173 20 0 BEADRP Cc1cnc(C(C)(C)[NH2+]C[C@H]2C[C@@H]([NH3+])C2)s1 ZINC000904329684 584865848 /nfs/dbraw/zinc/86/58/48/584865848.db2.gz QNIRCTAJZIWFQJ-AOOOYVTPSA-N 2 0 239.388 2.014 20 0 BEADRP CC[C@@](C)(CCO)[NH2+]C[C@H]([NH3+])CCC(C)(C)C ZINC000904329462 584865906 /nfs/dbraw/zinc/86/59/06/584865906.db2.gz NWHXJVAEHRXGJV-OCCSQVGLSA-N 2 0 244.423 2.281 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+]C2(c3ccccc3F)CC2)C1 ZINC000904329207 584866174 /nfs/dbraw/zinc/86/61/74/584866174.db2.gz MTBLUUGLZCDNEJ-PHIMTYICSA-N 2 0 234.318 2.142 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[N@@H+]2CCCC3(CCCC3)C2)C1 ZINC000904341800 584867164 /nfs/dbraw/zinc/86/71/64/584867164.db2.gz WFLVGDONGDKGGG-BETUJISGSA-N 2 0 222.376 2.380 20 0 BEADRP CCC([NH3+])(CC)CNC[C@@H]([NH3+])CCC(C)(C)C ZINC000904350685 584869266 /nfs/dbraw/zinc/86/92/66/584869266.db2.gz PAKHVJGGCMDKHP-LBPRGKRZSA-N 2 0 243.439 2.247 20 0 BEADRP CCCC[C@@H](C[NH3+])NC[C@@H]([NH3+])CCC(C)(C)C ZINC000904350889 584869286 /nfs/dbraw/zinc/86/92/86/584869286.db2.gz RXARTPBFROFUIA-STQMWFEESA-N 2 0 243.439 2.247 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@@H]([NH3+])CCC(C)(C)C ZINC000904354841 584871012 /nfs/dbraw/zinc/87/10/12/584871012.db2.gz JOXBXAPQGHUIRP-OLZOCXBDSA-N 3 0 243.439 2.247 20 0 BEADRP Cc1ccc(NC[C@H]2C[C@@H]([NH3+])C2)c(C[NH+](C)C)c1 ZINC000904360333 584871677 /nfs/dbraw/zinc/87/16/77/584871677.db2.gz ZNDIVDPZSHHDCE-XBXGTLAGSA-N 2 0 247.386 2.206 20 0 BEADRP CC(C)(C)CC[C@H]([NH3+])C[NH2+]C[C@@H]1CCCCO1 ZINC000904367923 584872682 /nfs/dbraw/zinc/87/26/82/584872682.db2.gz KEVGUPGNBSADJI-STQMWFEESA-N 2 0 242.407 2.299 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@@H]([NH3+])CCC(C)(C)C)[C@H](C)O1 ZINC000904384297 584877519 /nfs/dbraw/zinc/87/75/19/584877519.db2.gz JORBMVNANGSDMZ-VOAKCMCISA-N 2 0 242.407 2.296 20 0 BEADRP [NH3+]CC1CC([NH2+][C@H]2c3ccccc3CC[C@H]2F)C1 ZINC000904386022 584877848 /nfs/dbraw/zinc/87/78/48/584877848.db2.gz MZEISRLQRYBSNO-YQWPXRDNSA-N 2 0 248.345 2.339 20 0 BEADRP Cc1cccc(C[N@@H+]2C[C@@H]3CC[NH2+]C[C@@H]3C2)c1C ZINC000904421065 584881924 /nfs/dbraw/zinc/88/19/24/584881924.db2.gz NJUFVONDSNJQKJ-JKSUJKDBSA-N 2 0 244.382 2.345 20 0 BEADRP C[C@@H]1CC[C@H]1[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC000839183330 585096599 /nfs/dbraw/zinc/09/65/99/585096599.db2.gz WMLNHWITVFCXMH-FRRDWIJNSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC000839183333 585096795 /nfs/dbraw/zinc/09/67/95/585096795.db2.gz WMLNHWITVFCXMH-UPJWGTAASA-N 2 0 210.365 2.106 20 0 BEADRP C[N@H+](CC1CC1)C[C@H]1CCN(C/C=C/Cl)C1 ZINC000747530976 585180206 /nfs/dbraw/zinc/18/02/06/585180206.db2.gz ASXONKRLFQMDAK-ZABGRMTBSA-N 2 0 242.794 2.403 20 0 BEADRP FC(F)C1CC([NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)C1 ZINC000768675895 585541565 /nfs/dbraw/zinc/54/15/65/585541565.db2.gz WXYOZPMIVMYVHX-WHXUTIOJSA-N 2 0 244.329 2.104 20 0 BEADRP C[NH+](C)[C@H]1CCC[C@H]([NH2+]C2CC(C(F)F)C2)C1 ZINC000769528245 585558635 /nfs/dbraw/zinc/55/86/35/585558635.db2.gz UVNQZSGLPGKCLI-ADPBJBESSA-N 2 0 246.345 2.493 20 0 BEADRP COC1CCC(C[NH2+][C@@H](C)CC[NH+](C)C)CC1 ZINC000769534697 585558917 /nfs/dbraw/zinc/55/89/17/585558917.db2.gz JOEBCGDBYCXVES-HSBZDZAISA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H](C1CC1)[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000777910270 585723634 /nfs/dbraw/zinc/72/36/34/585723634.db2.gz GNCJLRNTPGMZGT-GFCCVEGCSA-N 2 0 224.392 2.449 20 0 BEADRP C[C@H](CCO)[NH2+]CCCCC[NH+]1CCCCC1 ZINC000779404456 585753558 /nfs/dbraw/zinc/75/35/58/585753558.db2.gz KTVWHTGFOBVVIP-CQSZACIVSA-N 2 0 242.407 2.003 20 0 BEADRP C[C@H](C1CC1)[N@H+](C)CC1CC[NH+](C)CC1 ZINC000782183612 585810541 /nfs/dbraw/zinc/81/05/41/585810541.db2.gz NCXKZKJCAZZENP-LLVKDONJSA-N 2 0 210.365 2.059 20 0 BEADRP CC[N@H+](C)C[C@@H]1CC[NH+]([C@H](C)C2CC2)C1 ZINC000782191546 585811714 /nfs/dbraw/zinc/81/17/14/585811714.db2.gz XAVGKFIIMJSRHD-NEPJUHHUSA-N 2 0 210.365 2.059 20 0 BEADRP C[C@H]1C[C@H](C)C[NH+](CC2CC[NH+](C)CC2)C1 ZINC000788471716 585925450 /nfs/dbraw/zinc/92/54/50/585925450.db2.gz YVABGPKDJVUHNZ-STQMWFEESA-N 2 0 224.392 2.306 20 0 BEADRP CSCC[C@@H](C)[N@H+](C)CC1CC[NH+](C)CC1 ZINC000788493326 585925615 /nfs/dbraw/zinc/92/56/15/585925615.db2.gz JMWUCRZDJSPQON-GFCCVEGCSA-N 2 0 244.448 2.402 20 0 BEADRP CSC[C@H]1CCC[N@@H+]1CC1CC[NH+](C)CC1 ZINC000788489303 585925700 /nfs/dbraw/zinc/92/57/00/585925700.db2.gz XHFBIDAJFFGHFE-CYBMUJFWSA-N 2 0 242.432 2.156 20 0 BEADRP C[NH+]1CCC(C[NH+]2Cc3ccccc3C2)CC1 ZINC000790079415 585957536 /nfs/dbraw/zinc/95/75/36/585957536.db2.gz DWKZTVCNEMHNOI-UHFFFAOYSA-N 2 0 230.355 2.344 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CCCC2(CC[NH+](C)CC2)C1 ZINC000798956980 586154616 /nfs/dbraw/zinc/15/46/16/586154616.db2.gz SECRWKPFDCMKQF-ZIAGYGMSSA-N 2 0 236.403 2.450 20 0 BEADRP CC(C)C(=O)CC[NH+]1CCC(c2c[nH]cn2)CC1 ZINC000808737590 586485667 /nfs/dbraw/zinc/48/56/67/586485667.db2.gz DTBBZLZTFXXQJM-UHFFFAOYSA-N 2 0 249.358 2.204 20 0 BEADRP CC(C)[N@@H+]1CC[C@H](C[NH2+]C2CC(C(F)F)C2)C1 ZINC000809735548 586515153 /nfs/dbraw/zinc/51/51/53/586515153.db2.gz KHXBLCHEDJUCQI-VOMCLLRMSA-N 2 0 246.345 2.350 20 0 BEADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+]C2CC(C(F)F)C2)C1 ZINC000809735547 586515218 /nfs/dbraw/zinc/51/52/18/586515218.db2.gz KHXBLCHEDJUCQI-UNXYVOJBSA-N 2 0 246.345 2.350 20 0 BEADRP C[C@@H]([NH2+]C[C@@H](C)C(C)(C)C)[C@H]1CCC[NH2+]1 ZINC000817893530 586833748 /nfs/dbraw/zinc/83/37/48/586833748.db2.gz FMSLVYFCBGGEGV-IJLUTSLNSA-N 2 0 212.381 2.399 20 0 BEADRP CSC(C)(C)C[NH2+][C@H]1CC[NH2+]CC[C@H]1C ZINC000817899293 586835871 /nfs/dbraw/zinc/83/58/71/586835871.db2.gz KVYLSWBWOOJYLP-MNOVXSKESA-N 2 0 230.421 2.106 20 0 BEADRP CSCCCCCC[NH2+][C@H]1CCC[C@@H]1[NH3+] ZINC000817922093 586840716 /nfs/dbraw/zinc/84/07/16/586840716.db2.gz PTTIYACAALEELO-RYUDHWBXSA-N 2 0 230.421 2.379 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1CCc2cc(C)ccc21 ZINC000817942172 586844938 /nfs/dbraw/zinc/84/49/38/586844938.db2.gz YBWMAZLIQTWQGN-CQSZACIVSA-N 2 0 218.344 2.181 20 0 BEADRP CC[C@H]1CC[C@@H]1[NH2+]Cc1ccc(CC[NH3+])cc1 ZINC000817947863 586846932 /nfs/dbraw/zinc/84/69/32/586846932.db2.gz DCIQZOUNHGIYMY-GJZGRUSLSA-N 2 0 232.371 2.466 20 0 BEADRP Cc1ccc2c(c1)CC[C@H]2[NH2+]CC(C)(C)[NH3+] ZINC000817960796 586847037 /nfs/dbraw/zinc/84/70/37/586847037.db2.gz QKDDEBWJPMBKAS-CYBMUJFWSA-N 2 0 218.344 2.309 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+]Cc1ccc(CC[NH3+])cc1 ZINC000817947864 586847087 /nfs/dbraw/zinc/84/70/87/586847087.db2.gz DCIQZOUNHGIYMY-HUUCEWRRSA-N 2 0 232.371 2.466 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H](C)c1ccc2c(c1)CCO2 ZINC000817953716 586849165 /nfs/dbraw/zinc/84/91/65/586849165.db2.gz UDLGYNDZJDXUHO-QWRGUYRKSA-N 2 0 234.343 2.009 20 0 BEADRP CC[C@H]([NH2+]CC(C)(C)[NH3+])c1ccc2c(c1)CCO2 ZINC000817961252 586853215 /nfs/dbraw/zinc/85/32/15/586853215.db2.gz ZQVPBYCDJVAJAA-ZDUSSCGKSA-N 2 0 248.370 2.400 20 0 BEADRP CC[C@@H]([NH2+]C[C@H](C)C[NH3+])c1ccc2c(c1)CCO2 ZINC000817961985 586853402 /nfs/dbraw/zinc/85/34/02/586853402.db2.gz FTXYJVXFIRQFNX-BXUZGUMPSA-N 2 0 248.370 2.257 20 0 BEADRP Cc1cc(F)ccc1[C@@H](C)[NH2+]CC1C[NH2+]C1 ZINC000817964505 586853739 /nfs/dbraw/zinc/85/37/39/586853739.db2.gz ATKWVZHMMNYHJG-SNVBAGLBSA-N 2 0 222.307 2.004 20 0 BEADRP COc1cc(C)c([C@@H](C)[NH2+]CC2C[NH2+]C2)cc1C ZINC000817965338 586853776 /nfs/dbraw/zinc/85/37/76/586853776.db2.gz OSMKYRUXRXKOSN-GFCCVEGCSA-N 2 0 248.370 2.182 20 0 BEADRP CCCCC[C@H](C)[NH2+]CC1=CC[NH2+]CC1 ZINC000817968742 586856337 /nfs/dbraw/zinc/85/63/37/586856337.db2.gz WRNDWLPJHMTDHU-LBPRGKRZSA-N 2 0 210.365 2.465 20 0 BEADRP C[C@H]([NH3+])C[NH2+][C@@H]1CC[C@@H]2CCCC[C@@H]2C1 ZINC000817971266 586857295 /nfs/dbraw/zinc/85/72/95/586857295.db2.gz LNBBKTHCMGCMOI-WUHRBBMRSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H](CSC(C)(C)C)[NH2+][C@H]1CC[NH2+]C[C@H]1C ZINC000817972124 586859092 /nfs/dbraw/zinc/85/90/92/586859092.db2.gz TWQVAQQSGIGASU-UTUOFQBUSA-N 2 0 244.448 2.494 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@@H](C)CSC(C)(C)C ZINC000817979548 586861794 /nfs/dbraw/zinc/86/17/94/586861794.db2.gz LOGQAQGTVVYRME-VHSXEESVSA-N 2 0 218.410 2.234 20 0 BEADRP Cc1ccc(OCC[NH2+][C@@H]2CCCC[C@H]2[NH3+])cc1 ZINC000818340722 586887255 /nfs/dbraw/zinc/88/72/55/586887255.db2.gz RIRFBVRFBRNHAK-HUUCEWRRSA-N 2 0 248.370 2.233 20 0 BEADRP CO[C@H]1CC[C@@H]([NH+]2CCC([NH2+]C(C)C)CC2)C1 ZINC000821390351 587115435 /nfs/dbraw/zinc/11/54/35/587115435.db2.gz AFXDWTYFTXKLFW-KGLIPLIRSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@@H](CCCc1cccnc1)[NH2+][C@H]1CCN(C)C1 ZINC000834566695 587759535 /nfs/dbraw/zinc/75/95/35/587759535.db2.gz QHAQKAHDUCKMMJ-ZFWWWQNUSA-N 2 0 247.386 2.087 20 0 BEADRP C[N@H+](CCCC[NH2+]C[C@H]1CCC=CO1)C1CC1 ZINC000835064741 587779938 /nfs/dbraw/zinc/77/99/38/587779938.db2.gz YIYPKFNDHFSQJH-CQSZACIVSA-N 2 0 238.375 2.143 20 0 BEADRP c1ccc2c(c1)cncc2CNC[C@@H]1CCC[NH2+]1 ZINC000841035161 587937251 /nfs/dbraw/zinc/93/72/51/587937251.db2.gz INORUIMQMGUYND-AWEZNQCLSA-N 2 0 241.338 2.076 20 0 BEADRP C[C@@H](CC[NH3+])[NH2+]Cc1ccc2c(c1)CC(C)(C)O2 ZINC000841053108 587939718 /nfs/dbraw/zinc/93/97/18/587939718.db2.gz ZONDDWNLOLOVBA-NSHDSACASA-N 2 0 248.370 2.227 20 0 BEADRP C[C@H](CC[NH3+])[NH2+]Cc1cncc2ccccc21 ZINC000841052696 587939747 /nfs/dbraw/zinc/93/97/47/587939747.db2.gz WBVMZQQTFISJAO-LLVKDONJSA-N 2 0 229.327 2.062 20 0 BEADRP CCCCCC[C@@H](C)[NH2+]C[C@H]1C[NH2+]CCCO1 ZINC000841085442 587945698 /nfs/dbraw/zinc/94/56/98/587945698.db2.gz CLDOZFCXAJZUFY-ZIAGYGMSSA-N 2 0 242.407 2.313 20 0 BEADRP Cc1cc([C@H]2CCC[N@@H+]2CC[C@@H]2CC[NH2+]C2)no1 ZINC000842471441 588028526 /nfs/dbraw/zinc/02/85/26/588028526.db2.gz BJRKOSCIOVSKER-GXTWGEPZSA-N 2 0 249.358 2.120 20 0 BEADRP CC(C)[C@H]1C[C@H]([NH2+]CCCCCC[NH3+])CCO1 ZINC000843128188 588083082 /nfs/dbraw/zinc/08/30/82/588083082.db2.gz VEHNXNBHDLVEPE-ZIAGYGMSSA-N 2 0 242.407 2.299 20 0 BEADRP CCc1ncc(C[NH2+]CCCCCC[NH3+])s1 ZINC000843126752 588084709 /nfs/dbraw/zinc/08/47/09/588084709.db2.gz ITWLREAGWPYHMD-UHFFFAOYSA-N 2 0 241.404 2.314 20 0 BEADRP C[C@@H]([NH2+]CCCCCC[NH3+])c1cncc(F)c1 ZINC000843340322 588100861 /nfs/dbraw/zinc/10/08/61/588100861.db2.gz AYRWEFQFFRITPC-LLVKDONJSA-N 2 0 239.338 2.390 20 0 BEADRP [NH3+]CCCCCC[NH2+][C@@H]1CC[C@@H]1C1CC1 ZINC000843340291 588101037 /nfs/dbraw/zinc/10/10/37/588101037.db2.gz ABTHIWKSLYBSED-CHWSQXEVSA-N 2 0 210.365 2.284 20 0 BEADRP CCn1ccnc1[C@H](C)[NH2+]CCCCCC[NH3+] ZINC000843342095 588101197 /nfs/dbraw/zinc/10/11/97/588101197.db2.gz NHTBIMGUEQWRPL-LBPRGKRZSA-N 2 0 238.379 2.073 20 0 BEADRP C[C@@H]([NH2+]CCCCCC[NH3+])c1cccnc1 ZINC000843342906 588101334 /nfs/dbraw/zinc/10/13/34/588101334.db2.gz VAKWETIIOGLQFY-GFCCVEGCSA-N 2 0 221.348 2.251 20 0 BEADRP C[N@H+](CCC[NH3+])CCOC1CCCCCC1 ZINC000843351187 588102511 /nfs/dbraw/zinc/10/25/11/588102511.db2.gz JMLUKPZIKMHEQP-UHFFFAOYSA-N 2 0 228.380 2.006 20 0 BEADRP [NH3+]C[C@@H]1CCC[N@H+](Cc2cccc3c2CCC3)C1 ZINC000844901691 588218966 /nfs/dbraw/zinc/21/89/66/588218966.db2.gz HWHLYBHVMLAFOZ-ZDUSSCGKSA-N 2 0 244.382 2.346 20 0 BEADRP Cc1cccc(NC(=[NH2+])NCCCC[NH+](C)C)c1 ZINC000848990109 588426699 /nfs/dbraw/zinc/42/66/99/588426699.db2.gz ZJXSWDYUYBTELN-UHFFFAOYSA-N 2 0 248.374 2.273 20 0 BEADRP CC(C)NC(=[NH2+])NCCC[NH+](C(C)C)C(C)C ZINC000849010827 588435180 /nfs/dbraw/zinc/43/51/80/588435180.db2.gz MXXQGWKDUGJXHU-UHFFFAOYSA-N 2 0 242.411 2.018 20 0 BEADRP c1cc(C[NH2+][C@@H]2C=CCC2)n(-c2cc[nH+]cc2)n1 ZINC000850359756 588539991 /nfs/dbraw/zinc/53/99/91/588539991.db2.gz QNYKYKIVNODNNY-GFCCVEGCSA-N 2 0 240.310 2.076 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@@H]2C=CCC2)[C@@H]2CCC[C@H]21 ZINC000850506206 588552710 /nfs/dbraw/zinc/55/27/10/588552710.db2.gz CLCOFTAKLSGUJG-ZOBORPQBSA-N 2 0 220.360 2.167 20 0 BEADRP ClC(Cl)=CC[N@@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000852747027 588699222 /nfs/dbraw/zinc/69/92/22/588699222.db2.gz VENZBBLJFJSJIQ-UHFFFAOYSA-N 2 0 249.185 2.381 20 0 BEADRP [NH3+]CCCCCCC[N@@H+]1CCCC[C@H]1CCO ZINC000852755635 588700541 /nfs/dbraw/zinc/70/05/41/588700541.db2.gz WIFWYDMVDPKQTB-AWEZNQCLSA-N 2 0 242.407 2.133 20 0 BEADRP [NH3+]CCCCCCC[N@@H+]1CCCC[C@@H]1CCO ZINC000852755636 588700685 /nfs/dbraw/zinc/70/06/85/588700685.db2.gz WIFWYDMVDPKQTB-CQSZACIVSA-N 2 0 242.407 2.133 20 0 BEADRP C([NH2+][C@@H]1CC[NH2+]C12CCC2)C1CCCC1 ZINC000863482755 589292789 /nfs/dbraw/zinc/29/27/89/589292789.db2.gz KTTMFCYTFFYBJJ-GFCCVEGCSA-N 2 0 208.349 2.051 20 0 BEADRP C[C@@H]([NH3+])CN(C)Cc1nccc2ccccc21 ZINC000863652089 589307642 /nfs/dbraw/zinc/30/76/42/589307642.db2.gz QFWAFYJURWTLAJ-LLVKDONJSA-N 2 0 229.327 2.014 20 0 BEADRP C[NH+](C)CCC[NH2+]C/C=C\c1cccc(F)c1 ZINC000885894579 589470626 /nfs/dbraw/zinc/47/06/26/589470626.db2.gz YXPIFWQQEXAZLI-DAXSKMNVSA-N 2 0 236.334 2.380 20 0 BEADRP CS[C@H]1C[C@H]([NH2+]C2CC[NH+](C(C)C)CC2)C1 ZINC000866486515 589496491 /nfs/dbraw/zinc/49/64/91/589496491.db2.gz JZPLPZUPGYFDAI-JOCQHMNTSA-N 2 0 242.432 2.343 20 0 BEADRP C(CC1CC1)C[NH+]1CCC([C@@H]2CC[NH2+]C2)CC1 ZINC000866666742 589509300 /nfs/dbraw/zinc/50/93/00/589509300.db2.gz WCYUEWDADKVWCZ-OAHLLOKOSA-N 2 0 236.403 2.498 20 0 BEADRP CCCC[N@@H+]1CC[C@@](C[NH3+])(C(C)(C)C)C1 ZINC000866703335 589513739 /nfs/dbraw/zinc/51/37/39/589513739.db2.gz LMTXGACBHOBLBV-ZDUSSCGKSA-N 2 0 212.381 2.483 20 0 BEADRP CCSCC[N@@H+]1CC[C@](C[NH3+])(C(C)(C)C)C1 ZINC000866704997 589514416 /nfs/dbraw/zinc/51/44/16/589514416.db2.gz RTWFRNDWAQDMMD-CYBMUJFWSA-N 2 0 244.448 2.436 20 0 BEADRP CC[C@@H](C)[N@@H+]1CC[C@@](C[NH3+])(C(C)(C)C)C1 ZINC000866708244 589514626 /nfs/dbraw/zinc/51/46/26/589514626.db2.gz QGQNRHSHGFKIAT-YPMHNXCESA-N 2 0 212.381 2.482 20 0 BEADRP Cc1cncc([C@H]2CCC[N@@H+]2C[C@@H]2CC[NH2+]C2)c1 ZINC000866720419 589515308 /nfs/dbraw/zinc/51/53/08/589515308.db2.gz KXFDCEHTRCPLMI-UKRRQHHQSA-N 2 0 245.370 2.136 20 0 BEADRP Cc1ccc(CC[N@@H+]2C[C@@H]3C[NH2+]C[C@]3(C)C2)cc1 ZINC000872153218 589884725 /nfs/dbraw/zinc/88/47/25/589884725.db2.gz CHAZQUWJXKYCBS-JKSUJKDBSA-N 2 0 244.382 2.079 20 0 BEADRP Cc1cnc([C@H](C)[N@H+](C)CCCCCC[NH3+])o1 ZINC000872155870 589886480 /nfs/dbraw/zinc/88/64/80/589886480.db2.gz ZDKYURBYFHJREK-LBPRGKRZSA-N 2 0 239.363 2.495 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CC[NH2+]CC(C)(C)C2)cn1 ZINC000872251842 589900455 /nfs/dbraw/zinc/90/04/55/589900455.db2.gz OEVYYFVFRXFGFL-AWEZNQCLSA-N 2 0 247.386 2.258 20 0 BEADRP C[NH+](C)[C@H](CNc1cc[nH+]cc1C1CC1)C1CC1 ZINC000872443470 589939864 /nfs/dbraw/zinc/93/98/64/589939864.db2.gz QXBZHQLYLDZYTI-OAHLLOKOSA-N 2 0 245.370 2.133 20 0 BEADRP C[NH+](C)C1(CNc2cc[nH+]cc2C2CC2)CCC1 ZINC000872517058 589946663 /nfs/dbraw/zinc/94/66/63/589946663.db2.gz DPOCOORSNXQIGB-UHFFFAOYSA-N 2 0 245.370 2.277 20 0 BEADRP c1cc(NCC[N@H+]2CC=CCC2)c(C2CC2)c[nH+]1 ZINC000872527104 589947213 /nfs/dbraw/zinc/94/72/13/589947213.db2.gz KQAJZQNZTFQFAF-UHFFFAOYSA-N 2 0 243.354 2.055 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](CNc2cc[nH+]cc2C2CC2)C1 ZINC000872588653 589955036 /nfs/dbraw/zinc/95/50/36/589955036.db2.gz ISKNORSTWREDJT-BJHJDKERSA-N 2 0 245.370 2.133 20 0 BEADRP CC(C)C[C@@H]([NH3+])CNc1ccc([C@@H]2C[C@H]2[NH3+])cc1 ZINC000873216803 589998217 /nfs/dbraw/zinc/99/82/17/589998217.db2.gz XYTVVPSUJCUBRD-VHDGCEQUSA-N 2 0 247.386 2.287 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+][C@@H]2CCCC[C@@H]2F)C1 ZINC000873217628 589998286 /nfs/dbraw/zinc/99/82/86/589998286.db2.gz MNCABZDSHFMZSD-WHOHXGKFSA-N 2 0 214.328 2.127 20 0 BEADRP [NH3+]C1CCC([NH2+][C@@H]2CCCC[C@@H]2F)CC1 ZINC000873218195 589998487 /nfs/dbraw/zinc/99/84/87/589998487.db2.gz ZGELMRLMAIGSBE-MMVSWEMESA-N 2 0 214.328 2.127 20 0 BEADRP C([NH2+][C@@]12CCC[C@H]1[NH2+]CC2)C1CCCCC1 ZINC000873229647 589998685 /nfs/dbraw/zinc/99/86/85/589998685.db2.gz DGGWYXYZDJWCDC-ZIAGYGMSSA-N 2 0 222.376 2.441 20 0 BEADRP CC(C)C[C@H]([NH3+])CN1CC[C@@H]2CSC[C@@H]2C1 ZINC000873221958 589999815 /nfs/dbraw/zinc/99/98/15/589999815.db2.gz VCWKGORQTZUNDY-AGIUHOORSA-N 2 0 242.432 2.045 20 0 BEADRP CC(C)C[C@H]([NH3+])CN1CC[C@H]2CSC[C@@H]2C1 ZINC000873221959 589999871 /nfs/dbraw/zinc/99/98/71/589999871.db2.gz VCWKGORQTZUNDY-AVGNSLFASA-N 2 0 242.432 2.045 20 0 BEADRP CC(C)C[C@H]([NH3+])CN1CC[C@H]2CSC[C@H]2C1 ZINC000873221961 590000010 /nfs/dbraw/zinc/00/00/10/590000010.db2.gz VCWKGORQTZUNDY-XQQFMLRXSA-N 2 0 242.432 2.045 20 0 BEADRP CCC[C@H](C)C[NH2+][C@]12CCC[C@H]1[NH2+]CC2 ZINC000873229724 590001624 /nfs/dbraw/zinc/00/16/24/590001624.db2.gz FDZYGZAJVWAQML-XQQFMLRXSA-N 2 0 210.365 2.297 20 0 BEADRP CCC[C@H](C)C[NH2+][C@@]12CCC[C@@H]1[NH2+]CC2 ZINC000873229723 590001853 /nfs/dbraw/zinc/00/18/53/590001853.db2.gz FDZYGZAJVWAQML-RWMBFGLXSA-N 2 0 210.365 2.297 20 0 BEADRP CC(C)(C)CC[NH2+][C@@]12CCC[C@@H]1[NH2+]CC2 ZINC000873232336 590003039 /nfs/dbraw/zinc/00/30/39/590003039.db2.gz WSSALVBCKZKCFE-WCQYABFASA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CCSC1)[C@H]1CCCC[NH2+]1 ZINC000873236291 590004273 /nfs/dbraw/zinc/00/42/73/590004273.db2.gz VKZNJWIWFXPVHS-FRRDWIJNSA-N 2 0 242.432 2.250 20 0 BEADRP CC[C@H]([NH2+]CC[C@H]1CCSC1)[C@@H]1CCC[NH2+]1 ZINC000873235514 590004310 /nfs/dbraw/zinc/00/43/10/590004310.db2.gz NIQUBURMSPTYOG-AVGNSLFASA-N 2 0 242.432 2.250 20 0 BEADRP [NH3+]C[C@H]1CC[C@H]([NH2+][C@H]2CC[C@H]2C2CC2)CC1 ZINC000873238865 590005165 /nfs/dbraw/zinc/00/51/65/590005165.db2.gz IJERLFTVFFPPFI-PYJNHQTQSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H]1CCCC[C@@H]1F ZINC000873239045 590005377 /nfs/dbraw/zinc/00/53/77/590005377.db2.gz MTQACTABOITQEF-SDDRHHMPSA-N 2 0 216.344 2.374 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+][C@@H]1CCCC[C@@H]1F ZINC000873238970 590005997 /nfs/dbraw/zinc/00/59/97/590005997.db2.gz KQSVPWGASAJAKJ-YVECIDJPSA-N 2 0 228.355 2.374 20 0 BEADRP Cc1cc([C@H](C)[NH2+]C[C@H]2C[C@@H]([NH3+])C2)cs1 ZINC000873248908 590007482 /nfs/dbraw/zinc/00/74/82/590007482.db2.gz GXTISEWEPPEWHN-JBLDHEPKSA-N 2 0 224.373 2.444 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@@H]2CCCc3ccccc3C2)C1 ZINC000873249980 590007632 /nfs/dbraw/zinc/00/76/32/590007632.db2.gz OJQIBVTWFHPPGC-UHOFOFEASA-N 2 0 244.382 2.261 20 0 BEADRP CC(C)(C[NH2+][C@H]1CCC[C@H]1[NH3+])C(C)(F)F ZINC000873250691 590008068 /nfs/dbraw/zinc/00/80/68/590008068.db2.gz GXUKGUPRXWWJJB-BDAKNGLRSA-N 2 0 220.307 2.137 20 0 BEADRP CC1(C)CCC[C@H]([NH2+]C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000873251672 590008113 /nfs/dbraw/zinc/00/81/13/590008113.db2.gz MXYJCLAYLPCGAG-TUAOUCFPSA-N 2 0 210.365 2.282 20 0 BEADRP CC1(C)CCCC[C@@H]1[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873251392 590008393 /nfs/dbraw/zinc/00/83/93/590008393.db2.gz LYOLKQQXXASAJO-TUAOUCFPSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@H]2C[C@H]([NH3+])C2)[C@H](C)C1 ZINC000873258487 590008511 /nfs/dbraw/zinc/00/85/11/590008511.db2.gz RNQUMRGMMYZKEM-VEGXAWMVSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@H]1Cc2ccccc2[C@@H]1[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873252829 590008870 /nfs/dbraw/zinc/00/88/70/590008870.db2.gz WEYSDJGPSPHSIF-HTTKSJEASA-N 2 0 230.355 2.247 20 0 BEADRP COc1ccc([C@H](C)[NH2+]C[C@H]2C[C@@H]([NH3+])C2)c(C)c1 ZINC000873251894 590009153 /nfs/dbraw/zinc/00/91/53/590009153.db2.gz YBFWSFHPQRHJNH-RWMBFGLXSA-N 2 0 248.370 2.392 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1cc(F)ccc1F ZINC000873253766 590009341 /nfs/dbraw/zinc/00/93/41/590009341.db2.gz DTKURWLVYMBUGN-ATZCPNFKSA-N 2 0 240.297 2.353 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@@H]2CCC[C@H](C3CC3)C2)C1 ZINC000873254194 590009428 /nfs/dbraw/zinc/00/94/28/590009428.db2.gz MZTNMQSFCSGLDH-SCUASFONSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@H](Cc1ccsc1)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873253674 590009654 /nfs/dbraw/zinc/00/96/54/590009654.db2.gz BWQRJWPLAXNLST-JLLWLGSASA-N 2 0 224.373 2.006 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@H]2CCC[C@@H](C3CC3)C2)C1 ZINC000873254195 590009717 /nfs/dbraw/zinc/00/97/17/590009717.db2.gz MZTNMQSFCSGLDH-ZZVYKPCYSA-N 2 0 222.376 2.282 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)CC2 ZINC000873254216 590009721 /nfs/dbraw/zinc/00/97/21/590009721.db2.gz NNYHGUZDJDSHSZ-OSAQELSMSA-N 2 0 230.355 2.309 20 0 BEADRP C[C@H](CSC(C)(C)C)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873254003 590009796 /nfs/dbraw/zinc/00/97/96/590009796.db2.gz IWMWHQQSMSXVNC-MXWKQRLJSA-N 2 0 230.421 2.234 20 0 BEADRP CC[C@@H]1CCCC[C@H]1[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873253168 590009865 /nfs/dbraw/zinc/00/98/65/590009865.db2.gz ZPZVJLJEDOIAMP-FVCCEPFGSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1cccc(F)c1F ZINC000873254895 590010105 /nfs/dbraw/zinc/01/01/05/590010105.db2.gz AQPZWAMSRXHWQJ-OPRDCNLKSA-N 2 0 240.297 2.353 20 0 BEADRP Cc1ccccc1C[C@H](C)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873255100 590010175 /nfs/dbraw/zinc/01/01/75/590010175.db2.gz DARVMKJOKLXBOU-YDHLFZDLSA-N 2 0 232.371 2.253 20 0 BEADRP Cc1ccccc1C[C@@H](C)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873255099 590010229 /nfs/dbraw/zinc/01/02/29/590010229.db2.gz DARVMKJOKLXBOU-UMVBOHGHSA-N 2 0 232.371 2.253 20 0 BEADRP C[C@@H]1CC(C)(C)C[C@H]1[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873255259 590010307 /nfs/dbraw/zinc/01/03/07/590010307.db2.gz FMQBQXHCGRBNAY-DDHJBXDOSA-N 2 0 210.365 2.138 20 0 BEADRP Cc1ccsc1[C@@H](C)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873254624 590010442 /nfs/dbraw/zinc/01/04/42/590010442.db2.gz YNPUKRBPBGDTCQ-MXWKQRLJSA-N 2 0 224.373 2.444 20 0 BEADRP CC[C@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)C1CCCC1 ZINC000873256514 590011441 /nfs/dbraw/zinc/01/14/41/590011441.db2.gz OSKOBLVGVBUVOI-DRZSPHRISA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+][C@@H]2CCCc3ccccc3C2)C1 ZINC000873256494 590011494 /nfs/dbraw/zinc/01/14/94/590011494.db2.gz OJQIBVTWFHPPGC-DAXOMENPSA-N 2 0 244.382 2.261 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1cc(F)cc(F)c1 ZINC000873257048 590011553 /nfs/dbraw/zinc/01/15/53/590011553.db2.gz DOKOURWWYDXKNF-JRKPZEMJSA-N 2 0 240.297 2.353 20 0 BEADRP COc1ccc(C)cc1[C@H](C)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873257188 590011560 /nfs/dbraw/zinc/01/15/60/590011560.db2.gz FJVQFZLQWAUZBO-AVGNSLFASA-N 2 0 248.370 2.392 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1cc(F)ccc1F ZINC000873257058 590011686 /nfs/dbraw/zinc/01/16/86/590011686.db2.gz DTKURWLVYMBUGN-FXPVBKGRSA-N 2 0 240.297 2.353 20 0 BEADRP COc1ccsc1[C@H](C)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873256772 590011731 /nfs/dbraw/zinc/01/17/31/590011731.db2.gz NTJFYBUVDLZSCI-GUBZILKMSA-N 2 0 240.372 2.145 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+][C@@H]2CCCc3ccccc32)C1 ZINC000873256658 590011753 /nfs/dbraw/zinc/01/17/53/590011753.db2.gz BXJMVPBJXVUYHV-UXIGCNINSA-N 2 0 230.355 2.391 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccccc1 ZINC000873256451 590011760 /nfs/dbraw/zinc/01/17/60/590011760.db2.gz OAJRSNPMTWZTHI-GMXVVIOVSA-N 2 0 204.317 2.075 20 0 BEADRP COc1cc(C)ccc1[C@H](C)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873258146 590012100 /nfs/dbraw/zinc/01/21/00/590012100.db2.gz NCKCQZHCMGFLCY-AVGNSLFASA-N 2 0 248.370 2.392 20 0 BEADRP CCOc1ccc([C@@H](C)[NH2+]C[C@H]2C[C@H]([NH3+])C2)cc1 ZINC000873258156 590012169 /nfs/dbraw/zinc/01/21/69/590012169.db2.gz NDNZLGADJABGOW-YRGRVCCFSA-N 2 0 248.370 2.473 20 0 BEADRP CCOc1ccccc1[C@@H](C)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873257605 590012366 /nfs/dbraw/zinc/01/23/66/590012366.db2.gz JAKXPYNTWIAMIK-JHJVBQTASA-N 2 0 248.370 2.473 20 0 BEADRP C[C@H]1Cc2ccccc2[C@@H]1[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873257967 590012462 /nfs/dbraw/zinc/01/24/62/590012462.db2.gz WEYSDJGPSPHSIF-TZQJONAQSA-N 2 0 230.355 2.247 20 0 BEADRP CC(C)C[C@@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1ccccn1 ZINC000873258289 590012668 /nfs/dbraw/zinc/01/26/68/590012668.db2.gz ZMSFYKIHALQRCU-UMVBOHGHSA-N 2 0 247.386 2.496 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+][C@@H]2CCc3cc(F)ccc32)C1 ZINC000873258756 590013162 /nfs/dbraw/zinc/01/31/62/590013162.db2.gz UFPRCEQPDFSFDD-GAJTVXKRSA-N 2 0 234.318 2.140 20 0 BEADRP C([NH2+][C@@H]1CCC12CCC2)[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000873262130 590014474 /nfs/dbraw/zinc/01/44/74/590014474.db2.gz VRYLLEIZDTWSKL-XJFOESAGSA-N 2 0 234.387 2.439 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[C@H]1C1CC1)C1CC[NH2+]CC1 ZINC000873269150 590015723 /nfs/dbraw/zinc/01/57/23/590015723.db2.gz MSEIFWBPFLXYLD-SWHYSGLUSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]([NH2+][C@H](C)C1CC[NH2+]CC1)c1ccoc1 ZINC000873267422 590015799 /nfs/dbraw/zinc/01/57/99/590015799.db2.gz CGJKYFXDJABWPJ-GHMZBOCLSA-N 2 0 222.332 2.318 20 0 BEADRP CC[C@H]([NH2+][C@H](C)C1CC[NH2+]CC1)[C@H]1C[C@@H]1C ZINC000873270638 590015946 /nfs/dbraw/zinc/01/59/46/590015946.db2.gz YRHGFCWHUWIQHL-XCCSTKFXSA-N 2 0 224.392 2.399 20 0 BEADRP CC[C@H]([NH2+][C@H](C)C1CC[NH2+]CC1)[C@@H]1C[C@H]1C ZINC000873270635 590016390 /nfs/dbraw/zinc/01/63/90/590016390.db2.gz YRHGFCWHUWIQHL-OXHZDVMGSA-N 2 0 224.392 2.399 20 0 BEADRP CC[C@H]([NH2+]CCC(C)(C)COC)[C@@H]1CCC[NH2+]1 ZINC000873279213 590017675 /nfs/dbraw/zinc/01/76/75/590017675.db2.gz DYZRHLZDTFRUON-STQMWFEESA-N 2 0 242.407 2.169 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+]CCC[C@H]1C=CCC1 ZINC000873280912 590018278 /nfs/dbraw/zinc/01/82/78/590018278.db2.gz FAHNCRAAJKCKMZ-KBPBESRZSA-N 2 0 240.391 2.076 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+]CCC[C@H]1C=CCC1 ZINC000873280914 590018453 /nfs/dbraw/zinc/01/84/53/590018453.db2.gz FAHNCRAAJKCKMZ-UONOGXRCSA-N 2 0 240.391 2.076 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]Cc1cccc2ncccc12 ZINC000873283882 590019776 /nfs/dbraw/zinc/01/97/76/590019776.db2.gz LOVMACHSGMZTLO-UKRRQHHQSA-N 2 0 241.338 2.204 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H](C)C(C)C ZINC000019943018 590053414 /nfs/dbraw/zinc/05/34/14/590053414.db2.gz IVCHXNXRZHUOKC-LBPRGKRZSA-N 2 0 200.370 2.352 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@@H](C)[C@H]2CCCO2)CC1 ZINC000020205745 590086114 /nfs/dbraw/zinc/08/61/14/590086114.db2.gz DUTVBASHOSXSQJ-GXTWGEPZSA-N 2 0 240.391 2.016 20 0 BEADRP CSC(C)(C)CC[N@@H+]1CC[C@@H](C[NH+](C)C)C1 ZINC000876730198 590234148 /nfs/dbraw/zinc/23/41/48/590234148.db2.gz BZSBTYNITVRTLI-LBPRGKRZSA-N 2 0 244.448 2.402 20 0 BEADRP CSC(C)(C)CC[N@@H+]1CC[C@H](C[NH+](C)C)C1 ZINC000876730197 590234219 /nfs/dbraw/zinc/23/42/19/590234219.db2.gz BZSBTYNITVRTLI-GFCCVEGCSA-N 2 0 244.448 2.402 20 0 BEADRP C[NH+](C)C[C@H]1CC[N@H+](CC2(C)CCCC2)C1 ZINC000876730077 590234296 /nfs/dbraw/zinc/23/42/96/590234296.db2.gz BOPUEPUHDYXIAQ-CYBMUJFWSA-N 2 0 224.392 2.450 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1)[C@@H]1CC1(F)F ZINC000877073696 590278305 /nfs/dbraw/zinc/27/83/05/590278305.db2.gz QRGYZRBQUYSKBE-USZNOCQGSA-N 2 0 246.345 2.493 20 0 BEADRP C[NH+](C)[C@@H]1CCC[C@H]([NH2+]CCC[C@H]2CCO2)C1 ZINC000877074130 590278469 /nfs/dbraw/zinc/27/84/69/590278469.db2.gz ZSTBVNOCRSZXFP-MJBXVCDLSA-N 2 0 240.391 2.018 20 0 BEADRP C[N@@H+]1CC[C@H]2C[NH+](CC3(C)CCC3)CC[C@H]21 ZINC000877738385 590404552 /nfs/dbraw/zinc/40/45/52/590404552.db2.gz BIZNZLSLIKUGBS-QWHCGFSZSA-N 2 0 222.376 2.203 20 0 BEADRP CC(C)CC[N@@H+]1CC[C@@H]2[C@@H](CC[NH+]2C)C1 ZINC000877740163 590406066 /nfs/dbraw/zinc/40/60/66/590406066.db2.gz IUCZJLMTGKADSU-QWHCGFSZSA-N 2 0 210.365 2.059 20 0 BEADRP C[NH+](C)C[C@H]1CC[N@H+](CC2CC3(CCC3)C2)C1 ZINC000878105265 590494779 /nfs/dbraw/zinc/49/47/79/590494779.db2.gz ZANDLTNUOSUUIG-CYBMUJFWSA-N 2 0 236.403 2.450 20 0 BEADRP C=C/C=C\CC[N@H+]1CC[C@H](C[NH+](C)C)C1 ZINC000878103597 590495387 /nfs/dbraw/zinc/49/53/87/590495387.db2.gz GMXBCEJXXFXAKP-CFHLNLSMSA-N 2 0 208.349 2.002 20 0 BEADRP Cc1ccc(CN2CC[C@@H]3[C@H]2CCC[N@H+]3C)nc1 ZINC000880138549 590939233 /nfs/dbraw/zinc/93/92/33/590939233.db2.gz YJCCXXNXWBVLRS-HUUCEWRRSA-N 2 0 245.370 2.059 20 0 BEADRP CC(C)[N@@H+]1CCN(c2cc[nH+]cc2)[C@H](C)C1 ZINC000880260379 590979619 /nfs/dbraw/zinc/97/96/19/590979619.db2.gz BYXRQBBJINCDFN-GFCCVEGCSA-N 2 0 219.332 2.001 20 0 BEADRP C[N@@H+]1CCCC[C@@H]1CC[NH+]1CC[C@H](CF)C1 ZINC000880295309 590989190 /nfs/dbraw/zinc/98/91/90/590989190.db2.gz JWBVFNTVTPONEU-CHWSQXEVSA-N 2 0 228.355 2.152 20 0 BEADRP CC1(C)CC[C@H]([NH2+][C@H]2CCC[C@@H]2C[NH3+])C1 ZINC000128602962 591140037 /nfs/dbraw/zinc/14/00/37/591140037.db2.gz DIFWHHWQDABYPI-WOPDTQHZSA-N 2 0 210.365 2.282 20 0 BEADRP C[NH2+][C@H]1CCN(Cc2ccc(C3CC3)cc2)C1 ZINC000128900252 591176798 /nfs/dbraw/zinc/17/67/98/591176798.db2.gz NVTMKDWXXIZURB-HNNXBMFYSA-N 2 0 230.355 2.358 20 0 BEADRP Fc1ccc(C[NH2+][C@H]2CCC[NH2+]CC2)cc1F ZINC000129194389 591266906 /nfs/dbraw/zinc/26/69/06/591266906.db2.gz ZSJZLWPMSZDDPU-NSHDSACASA-N 2 0 240.297 2.197 20 0 BEADRP CCCC[N@H+](C)CCNc1ncnc(C)c1C ZINC000881976920 591284751 /nfs/dbraw/zinc/28/47/51/591284751.db2.gz OSVIHHURDZJTRG-UHFFFAOYSA-N 2 0 236.363 2.237 20 0 BEADRP [NH3+]C[C@H]1CC[N@H+](Cc2coc3ccccc23)C1 ZINC000131030553 591542780 /nfs/dbraw/zinc/54/27/80/591542780.db2.gz QCLXBQJIMLRZGB-LLVKDONJSA-N 2 0 230.311 2.213 20 0 BEADRP CCN1CC[C@@H]1C[NH2+][C@H](C)CCC(F)(F)F ZINC000883354819 591626596 /nfs/dbraw/zinc/62/65/96/591626596.db2.gz CSBOWVTUDUKVRI-NXEZZACHSA-N 2 0 238.297 2.401 20 0 BEADRP [NH3+]CC1CC[NH+](CC[C@@H]2CCCC2(F)F)CC1 ZINC000883416546 591653025 /nfs/dbraw/zinc/65/30/25/591653025.db2.gz XVBLXCXXKVGJRI-LBPRGKRZSA-N 2 0 246.345 2.483 20 0 BEADRP C[N@H+](CC[C@@H]1CCCC1(F)F)C1CC([NH3+])C1 ZINC000883429157 591660111 /nfs/dbraw/zinc/66/01/11/591660111.db2.gz NDBGVGFEITVNKA-WHXUTIOJSA-N 2 0 232.318 2.233 20 0 BEADRP C[C@]1(C[NH3+])CC[N@H+](CC[C@H]2CCCC2(F)F)C1 ZINC000883428201 591660354 /nfs/dbraw/zinc/66/03/54/591660354.db2.gz NXIVYRLGDRRYBW-VXGBXAGGSA-N 2 0 246.345 2.483 20 0 BEADRP C=C/C=C\CC[N@@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1 ZINC000883429360 591660766 /nfs/dbraw/zinc/66/07/66/591660766.db2.gz SOXWCNWDZCMVTE-OVNWPICBSA-N 2 0 234.387 2.440 20 0 BEADRP Cc1ccccc1OCC[N@H+]1CC[C@H]([NH3+])C[C@@H]1C ZINC000131970124 591680530 /nfs/dbraw/zinc/68/05/30/591680530.db2.gz BOKZDPXUVZSEBS-KBPBESRZSA-N 2 0 248.370 2.185 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[NH2+]C1)c1cccc(F)c1 ZINC000132027267 591684458 /nfs/dbraw/zinc/68/44/58/591684458.db2.gz QPXXIGZAUWEOEX-RYUDHWBXSA-N 2 0 236.334 2.476 20 0 BEADRP CN(CC[C@@H]1CCCC[N@@H+]1C)Cc1ccncc1 ZINC000075861536 592312704 /nfs/dbraw/zinc/31/27/04/592312704.db2.gz QKPKOOZXETWDJF-HNNXBMFYSA-N 2 0 247.386 2.388 20 0 BEADRP CN(CC[C@H]1CCCC[N@@H+]1C)Cc1ccccn1 ZINC000075860152 592313175 /nfs/dbraw/zinc/31/31/75/592313175.db2.gz GPZYGALZQOBNNF-OAHLLOKOSA-N 2 0 247.386 2.388 20 0 BEADRP [NH3+][C@@]12CCC[C@@H]1C[N@H+](CC[C@@H]1C[C@H]1C1CC1)C2 ZINC000886841408 592363213 /nfs/dbraw/zinc/36/32/13/592363213.db2.gz KNYZBHWIQPQYDY-APIJFGDWSA-N 2 0 234.387 2.236 20 0 BEADRP C[C@H]1CC[N@H+](CCC[NH3+])[C@H]1c1ccccc1 ZINC000886857790 592370333 /nfs/dbraw/zinc/37/03/33/592370333.db2.gz ADBFLKNMYIMBQP-GXTWGEPZSA-N 2 0 218.344 2.418 20 0 BEADRP C(C1CCC1)[N@@H+]1CCCC[C@@]2(CC[NH2+]C2)C1 ZINC000886870314 592375563 /nfs/dbraw/zinc/37/55/63/592375563.db2.gz VMWPTDTVJNRMKX-AWEZNQCLSA-N 2 0 222.376 2.252 20 0 BEADRP C([C@@H]1C[C@H]2C[C@H]2C1)[N@@H+]1CCCC[C@@]2(CC[NH2+]C2)C1 ZINC000886874849 592376595 /nfs/dbraw/zinc/37/65/95/592376595.db2.gz YFZVXTBWYFHQHT-FZKCQIBNSA-N 2 0 248.414 2.498 20 0 BEADRP C[C@H]1CN(c2cc[nH+]cc2)CC[N@@H+]1CCC1CC1 ZINC000887132783 592449342 /nfs/dbraw/zinc/44/93/42/592449342.db2.gz MUZLOJAIBWQRBG-ZDUSSCGKSA-N 2 0 245.370 2.392 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CCC2CCC2)[C@@H](C)C1 ZINC000222261931 592473529 /nfs/dbraw/zinc/47/35/29/592473529.db2.gz AQOKPWXPDOWZQA-GXTWGEPZSA-N 2 0 224.392 2.497 20 0 BEADRP CO[C@@H]1C[N@H+](CCCCCCC[NH3+])CC[C@H]1C ZINC000300004930 592499817 /nfs/dbraw/zinc/49/98/17/592499817.db2.gz KSNULFSRECTKKI-ZIAGYGMSSA-N 2 0 242.407 2.252 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+]C[C@@H]1CCC[C@H]2C[C@H]21 ZINC000925708329 634399728 /nfs/dbraw/zinc/39/97/28/634399728.db2.gz KVAXQVHWQVAVLZ-RVMXOQNASA-N 2 0 222.376 2.153 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+][C@@H]2C[C@H]2C2CCC2)C12CCC2 ZINC000925707725 634395101 /nfs/dbraw/zinc/39/51/01/634395101.db2.gz QZXNVASNDYFOIH-QNWHQSFQSA-N 2 0 220.360 2.035 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+][C@@H]2C[C@H]2C2CCC2)C12CCC2 ZINC000925707727 634396974 /nfs/dbraw/zinc/39/69/74/634396974.db2.gz QZXNVASNDYFOIH-UMSGYPCISA-N 2 0 220.360 2.035 20 0 BEADRP C[C@@H]1SCC[C@@H]1[NH2+][C@H]1CC[NH2+]C12CCCC2 ZINC000925713803 634416520 /nfs/dbraw/zinc/41/65/20/634416520.db2.gz UJHQXTAQSAFNOM-SRVKXCTJSA-N 2 0 240.416 2.145 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@H](CCC[NH3+])c2ccccc2)CO1 ZINC000925712943 634417502 /nfs/dbraw/zinc/41/75/02/634417502.db2.gz QNBLBWDKLUSHSP-BPLDGKMQSA-N 2 0 248.370 2.234 20 0 BEADRP C[C@]1(C[NH2+][C@H]2[C@@H]3[NH2+]C[C@H]4C[C@H]2C[C@H]34)C[C@H]2C[C@H]2C1 ZINC000925720550 634460575 /nfs/dbraw/zinc/46/05/75/634460575.db2.gz YVCTWNYHYUPCGD-CUZWCKFLSA-N 2 0 246.398 2.009 20 0 BEADRP [NH3+]CCOCC[NH+]1CCC2(CCCCC2)CC1 ZINC000093232467 634475420 /nfs/dbraw/zinc/47/54/20/634475420.db2.gz RAXNDKSZPZEUCQ-UHFFFAOYSA-N 2 0 240.391 2.008 20 0 BEADRP C1=C[C@H](CCC[NH2+][C@H]2[C@@H]3[NH2+]C[C@H]4C[C@H]2C[C@H]34)CC1 ZINC000925730801 634559534 /nfs/dbraw/zinc/55/95/34/634559534.db2.gz QBYDEKCFBNKQNS-RWHKXBQASA-N 2 0 246.398 2.319 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1C=CCC1)[C@@H]1CCC[NH2+]1 ZINC000925731450 634563806 /nfs/dbraw/zinc/56/38/06/634563806.db2.gz KSEGKQQYKIEFDB-AGIUHOORSA-N 2 0 208.349 2.073 20 0 BEADRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]CC1(CC2CC2)CC1 ZINC000925732457 634574453 /nfs/dbraw/zinc/57/44/53/634574453.db2.gz BEGUKURZNOSUFY-OLZOCXBDSA-N 2 0 222.376 2.284 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CC[C@@H]1CC[C@H]2C[C@H]21 ZINC000925804574 635357771 /nfs/dbraw/zinc/35/77/71/635357771.db2.gz JUVYXUOLCGYYDX-VLJOUNFMSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H]1C[C@H]1[C@@H]1C[C@H]1[NH2+][C@H]1CC[NH2+]C12CCCC2 ZINC000925824392 635412647 /nfs/dbraw/zinc/41/26/47/635412647.db2.gz SKACZQRCZKZPRZ-RGDJUOJXSA-N 2 0 234.387 2.295 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@H]1[C@@H]1C[C@H]1C)[C@@H]1CCC[NH2+]C1 ZINC000925824385 635413964 /nfs/dbraw/zinc/41/39/64/635413964.db2.gz SIUPASGFAXNWGQ-CLHCLYRXSA-N 2 0 222.376 2.009 20 0 BEADRP CCC[N@H+](CCCCCCO)C1CC[NH2+]CC1 ZINC000226439847 635433074 /nfs/dbraw/zinc/43/30/74/635433074.db2.gz IUBBDTCABZZSLW-UHFFFAOYSA-N 2 0 242.407 2.003 20 0 BEADRP CC(C)[C@@H](C)[NH2+]C[C@]12CCC[C@H]1[NH2+]CC2 ZINC000925842938 635507922 /nfs/dbraw/zinc/50/79/22/635507922.db2.gz OSUCSPDPOLQLTP-JHJVBQTASA-N 2 0 210.365 2.153 20 0 BEADRP CCC[C@H](C)[NH2+]Cc1ccc(CC[NH3+])cc1 ZINC000233337651 635532681 /nfs/dbraw/zinc/53/26/81/635532681.db2.gz OGUDJXKVXQKPHG-LBPRGKRZSA-N 2 0 220.360 2.466 20 0 BEADRP C[C@H]([NH2+][C@H]1CCS[C@H](C)C1)[C@H]1CCCC[NH2+]1 ZINC000925861587 635557583 /nfs/dbraw/zinc/55/75/83/635557583.db2.gz QJQXRVLDKSDYJN-MROQNXINSA-N 2 0 242.432 2.391 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]C2CCC([NH3+])CC2)CCS1 ZINC000925861806 635557687 /nfs/dbraw/zinc/55/76/87/635557687.db2.gz STLQXENCRTXOOJ-XKGSQUFQSA-N 2 0 228.405 2.130 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+][C@H]1CCCc2cccnc21 ZINC000925871680 635587891 /nfs/dbraw/zinc/58/78/91/635587891.db2.gz DKFLBYSPMJICBX-WZRBSPASSA-N 2 0 233.359 2.174 20 0 BEADRP C1=CCCC(C[NH2+][C@@H]2CCC[NH2+]CC2)CC1 ZINC000925881043 635608240 /nfs/dbraw/zinc/60/82/40/635608240.db2.gz QGDJVXPJWXBRGM-CQSZACIVSA-N 2 0 222.376 2.465 20 0 BEADRP CC(C)[C@@H]1CCC[N@@H+]1CC1CC[NH+](C)CC1 ZINC000891618375 631410797 /nfs/dbraw/zinc/41/07/97/631410797.db2.gz PUTXQXVVTGSQIA-AWEZNQCLSA-N 2 0 224.392 2.449 20 0 BEADRP C[C@@H](CC(F)(F)F)[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000235086987 631473812 /nfs/dbraw/zinc/47/38/12/631473812.db2.gz RUNFIZUEJZDYRL-DTWKUNHWSA-N 2 0 224.270 2.059 20 0 BEADRP C[C@H]([NH2+]CCC1CCC1)C1CC[NH+](C)CC1 ZINC000090233835 631526163 /nfs/dbraw/zinc/52/61/63/631526163.db2.gz WKPYBYVUFKXALE-LBPRGKRZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H](C[NH2+]C[C@@H]1CCC=CO1)C[NH+]1CCCC1 ZINC000062078929 631646069 /nfs/dbraw/zinc/64/60/69/631646069.db2.gz FYJRGXBPNXZONH-KGLIPLIRSA-N 2 0 238.375 2.001 20 0 BEADRP C[C@@H]1CC[N@H+](CC2CC[NH+](C)CC2)[C@H]1C ZINC000892212796 631787052 /nfs/dbraw/zinc/78/70/52/631787052.db2.gz UMCXTCYVOLKYRG-NEPJUHHUSA-N 2 0 210.365 2.059 20 0 BEADRP C[C@@H]1CC[N@H+](CC2CC[NH+](C)CC2)[C@@H]1C ZINC000892212799 631787506 /nfs/dbraw/zinc/78/75/06/631787506.db2.gz UMCXTCYVOLKYRG-VXGBXAGGSA-N 2 0 210.365 2.059 20 0 BEADRP COc1ccc(C)cc1C[NH2+]C1CCC([NH3+])CC1 ZINC000051693860 631869789 /nfs/dbraw/zinc/86/97/89/631869789.db2.gz TYCFWZDOZYXONB-UHFFFAOYSA-N 2 0 248.370 2.363 20 0 BEADRP C[C@@H](C[C@H]1CCC[NH2+]1)[NH2+]CC1(C)CCC1 ZINC000235130710 631984993 /nfs/dbraw/zinc/98/49/93/631984993.db2.gz GWXJCEAINNVAMH-NWDGAFQWSA-N 2 0 210.365 2.297 20 0 BEADRP C[N@H+](CC[C@H]1CCC[NH2+]C1)C1CCCC1 ZINC000051918951 632012430 /nfs/dbraw/zinc/01/24/30/632012430.db2.gz BTSQQPUSDOANIA-GFCCVEGCSA-N 2 0 210.365 2.251 20 0 BEADRP C[N@H+](CC[C@@H]1CCC[NH2+]C1)C1CCCC1 ZINC000051918949 632012986 /nfs/dbraw/zinc/01/29/86/632012986.db2.gz BTSQQPUSDOANIA-LBPRGKRZSA-N 2 0 210.365 2.251 20 0 BEADRP C[N@H+](CC[C@@H]1CCC[NH2+]C1)CC(C)(C)C ZINC000051919604 632013882 /nfs/dbraw/zinc/01/38/82/632013882.db2.gz KOUUQCDTXUPYTD-LBPRGKRZSA-N 2 0 212.381 2.354 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2CCC(C)(C)C2)CC[NH2+]1 ZINC000235367156 632028057 /nfs/dbraw/zinc/02/80/57/632028057.db2.gz XFVUNXCSFJMTLP-VXGBXAGGSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCC[NH2+]1)C1CCCCC1 ZINC000235515959 632043975 /nfs/dbraw/zinc/04/39/75/632043975.db2.gz IOJVZDKMAPNRCJ-WCQYABFASA-N 2 0 210.365 2.297 20 0 BEADRP C[NH+](C)CCC[NH2+][C@@H]1CC2CCC1CC2 ZINC000308898353 632107283 /nfs/dbraw/zinc/10/72/83/632107283.db2.gz BFQVBEZBONZCAY-WXRRBKDZSA-N 2 0 210.365 2.106 20 0 BEADRP [NH3+]CC[C@@H]1CC[N@H+](Cc2ccc(F)cc2F)C1 ZINC000125546679 632108710 /nfs/dbraw/zinc/10/87/10/632108710.db2.gz LZXFCZHVMWBTOP-SNVBAGLBSA-N 2 0 240.297 2.136 20 0 BEADRP C[C@H](C[NH2+][C@H]1[C@H](C)CC[C@@H]1C)N(C)C1CC1 ZINC000924968498 635815774 /nfs/dbraw/zinc/81/57/74/635815774.db2.gz ZJNIZLLXBTVSJW-CZXHOFHRSA-N 2 0 224.392 2.493 20 0 BEADRP CS[C@@H]1CCC[C@@H]([NH2+][C@@H]2CCC[NH2+]CC2)C1 ZINC000235178958 632460463 /nfs/dbraw/zinc/46/04/63/632460463.db2.gz AFMCSOSOKCQECM-JHJVBQTASA-N 2 0 242.432 2.392 20 0 BEADRP CC[C@H]1CCC[N@@H+]1C[C@@]1(C)CCC[NH2+]C1 ZINC000219757721 632566456 /nfs/dbraw/zinc/56/64/56/632566456.db2.gz DFFDOAQXEMRDRC-STQMWFEESA-N 2 0 210.365 2.251 20 0 BEADRP C[C@@H]1C[C@H](C[N@@H+]2CCCC2(C)C)CC[NH2+]1 ZINC000235367479 632679900 /nfs/dbraw/zinc/67/99/00/632679900.db2.gz SKCSDAHEWGIHIJ-VXGBXAGGSA-N 2 0 210.365 2.249 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]CCCCCCO)c2ccccc21 ZINC000236318834 632919051 /nfs/dbraw/zinc/91/90/51/632919051.db2.gz NGRDHUCKRKXIIA-GJZGRUSLSA-N 2 0 248.370 2.274 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](C)Cc1ccco1 ZINC000309352113 632963274 /nfs/dbraw/zinc/96/32/74/632963274.db2.gz MQHJDMCBJNITIU-RYUDHWBXSA-N 2 0 224.348 2.318 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+]CC2(C)CCCC2)C1 ZINC000309372363 632987491 /nfs/dbraw/zinc/98/74/91/632987491.db2.gz PPCMUMIGCRFXDA-ZDUSSCGKSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@H]([NH2+]Cc1ccccc1)C1CC[NH2+]CC1 ZINC000306866602 635976465 /nfs/dbraw/zinc/97/64/65/635976465.db2.gz ODXCYRFKFMODGN-LBPRGKRZSA-N 2 0 218.344 2.164 20 0 BEADRP CSC[C@@H](C)[NH2+][C@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C ZINC000925502366 633826494 /nfs/dbraw/zinc/82/64/94/633826494.db2.gz GVEBZRFFQQYYCC-WYUUTHIRSA-N 2 0 242.432 2.104 20 0 BEADRP CCCC[C@H](COC)[NH2+][C@H]1C[C@@H]([NH3+])C12CCC2 ZINC000925503612 633830744 /nfs/dbraw/zinc/83/07/44/633830744.db2.gz KQIRACGWZXBUFZ-UPJWGTAASA-N 2 0 240.391 2.051 20 0 BEADRP CSCC[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000925506854 633841027 /nfs/dbraw/zinc/84/10/27/633841027.db2.gz SWFYXPCHKWZGLG-CYBMUJFWSA-N 2 0 238.400 2.419 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+][C@@H]1CCc2ccccc2C1 ZINC000925509923 633848858 /nfs/dbraw/zinc/84/88/58/633848858.db2.gz PYKKDBGWGQBQHD-CABCVRRESA-N 2 0 244.382 2.274 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2C[C@H]([NH3+])C23CCC3)cc1F ZINC000925524435 633899229 /nfs/dbraw/zinc/89/92/29/633899229.db2.gz TXNPJLKZVJPPGH-UONOGXRCSA-N 2 0 248.345 2.494 20 0 BEADRP CO[C@H](C[NH2+][C@H]1C[C@@H]([NH3+])CC(C)(C)C1)C(C)C ZINC000925526376 633908753 /nfs/dbraw/zinc/90/87/53/633908753.db2.gz IGQVDJHGWLAEMQ-FRRDWIJNSA-N 2 0 242.407 2.153 20 0 BEADRP CCSCC[C@H](C)[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000925528141 633916606 /nfs/dbraw/zinc/91/66/06/633916606.db2.gz TUBPHMFGIMRKET-NWDGAFQWSA-N 2 0 242.432 2.392 20 0 BEADRP CCSCC[C@@H](C)[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000925528143 633917304 /nfs/dbraw/zinc/91/73/04/633917304.db2.gz TUBPHMFGIMRKET-VXGBXAGGSA-N 2 0 242.432 2.392 20 0 BEADRP C[C@]1(C[NH2+][C@@H]2CC[NH2+]C23CCC3)CCCS1 ZINC000925550821 633995531 /nfs/dbraw/zinc/99/55/31/633995531.db2.gz CPIVJEBWGWFTPR-VXGBXAGGSA-N 2 0 240.416 2.146 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2C[C@@H]([NH3+])CC(C)(C)C2)cn1 ZINC000925563179 634048481 /nfs/dbraw/zinc/04/84/81/634048481.db2.gz SKYBFKMYKVEGMV-KGLIPLIRSA-N 2 0 247.386 2.386 20 0 BEADRP CCC1(C[NH2+][C@@H]2CC[NH2+]C23CCC3)CC1 ZINC000925581044 634086288 /nfs/dbraw/zinc/08/62/88/634086288.db2.gz VBWBDQGCLZCBFG-LLVKDONJSA-N 2 0 208.349 2.051 20 0 BEADRP C1CC2(C1)[NH2+]CC[C@H]2[NH2+][C@@H]1CC2CCC1CC2 ZINC000925675902 634263493 /nfs/dbraw/zinc/26/34/93/634263493.db2.gz HDWFSKYGQBKRSC-NWINJMCUSA-N 2 0 234.387 2.439 20 0 BEADRP CCC[C@H](C[NH2+][C@@H]1C[C@H]([NH3+])CC(C)(C)C1)OC ZINC000925680242 634279420 /nfs/dbraw/zinc/27/94/20/634279420.db2.gz NPBBVTYPMLBCJM-YNEHKIRRSA-N 2 0 242.407 2.297 20 0 BEADRP CCC1([NH2+][C@H]2C[C@H]([NH3+])CC(C)(C)C2)CC1 ZINC000925681346 634280954 /nfs/dbraw/zinc/28/09/54/634280954.db2.gz XGDLPOQJQDCATH-QWRGUYRKSA-N 2 0 210.365 2.425 20 0 BEADRP [NH3+]C[C@@H]1CCCN1c1cc[nH+]c2ccccc21 ZINC000053663508 634292550 /nfs/dbraw/zinc/29/25/50/634292550.db2.gz LKXQHLIREUTJRE-NSHDSACASA-N 2 0 227.311 2.162 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+]CCC1CC(F)(F)C1 ZINC000925684694 634293890 /nfs/dbraw/zinc/29/38/90/634293890.db2.gz IWHKKKXGIOOQFW-JTQLQIEISA-N 2 0 232.318 2.152 20 0 BEADRP FC1(F)CC(CC[NH2+][C@@H]2CC[NH2+]C23CCC3)C1 ZINC000925684978 634294338 /nfs/dbraw/zinc/29/43/38/634294338.db2.gz KARURDWAVCVFTH-LLVKDONJSA-N 2 0 244.329 2.296 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+][C@@H]2CCCC[C@H]2F)C12CCC2 ZINC000925692838 634323159 /nfs/dbraw/zinc/32/31/59/634323159.db2.gz RJQSTMYYKJTBPJ-WISYIIOYSA-N 2 0 226.339 2.127 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+][C@@H]2C[C@@H]([NH3+])CC(C)(C)C2)O1 ZINC000925696921 634357197 /nfs/dbraw/zinc/35/71/97/634357197.db2.gz VTCWZEOFBRVSTP-FDYHWXHSSA-N 2 0 240.391 2.050 20 0 BEADRP C[C@@H]1C[C@H]1[C@H]1C[C@H]1C[NH2+][C@H]1CC[NH2+]CC[C@H]1C ZINC000925771821 635211080 /nfs/dbraw/zinc/21/10/80/635211080.db2.gz DFZVEXHNEBRPSA-JEWKUQAESA-N 2 0 236.403 2.256 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[NH2+]C[C@H]1C)[C@@H]1CCCC[C@H]1C ZINC000925783652 635292825 /nfs/dbraw/zinc/29/28/25/635292825.db2.gz KOCIZMIMSLXSNA-RKQHYHRCSA-N 2 0 224.392 2.399 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1C[NH2+]C[C@H]1C)C1CCC1 ZINC000925783979 635296411 /nfs/dbraw/zinc/29/64/11/635296411.db2.gz HICKGGILJZQLOM-WXHSDQCUSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]1C[C@@H](N[C@@H]2C[NH2+]C[C@H]2C)c2ccccc21 ZINC000925786225 635305810 /nfs/dbraw/zinc/30/58/10/635305810.db2.gz SHTJVWCYJMNMNI-YIKOMLBNSA-N 2 0 230.355 2.432 20 0 BEADRP C[NH+](C)CCC[NH2+][C@H]1CCOC2(CCCC2)C1 ZINC000094366475 635313453 /nfs/dbraw/zinc/31/34/53/635313453.db2.gz IZFGONLQBLXNPV-ZDUSSCGKSA-N 2 0 240.391 2.020 20 0 BEADRP C[C@H](Cc1cccs1)[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000925792889 635324265 /nfs/dbraw/zinc/32/42/65/635324265.db2.gz WYQSWGSXRPLFFH-UTUOFQBUSA-N 2 0 238.400 2.124 20 0 BEADRP CC[C@@H]([NH2+]CC[C@@H]1C[NH2+]C[C@H]1C)C1CC1 ZINC000925802157 635350933 /nfs/dbraw/zinc/35/09/33/635350933.db2.gz XXKZMBNPTQPBIO-RAIGVLPGSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+][C@H]1CCC[C@H]1CCF ZINC000925802033 635351160 /nfs/dbraw/zinc/35/11/60/635351160.db2.gz CSBOJYVVRFBUGR-RQJABVFESA-N 2 0 242.382 2.350 20 0 BEADRP COC[C@H](C[NH2+][C@H](C)[C@@H]1CCCC[NH2+]1)C(C)C ZINC000925874432 635595271 /nfs/dbraw/zinc/59/52/71/635595271.db2.gz RKCNJGZZEZPBHY-RDBSUJKOSA-N 2 0 242.407 2.025 20 0 BEADRP C[C@@H]1C[N@H+](CCCCCC[NH3+])CC(C)(C)O1 ZINC000041681572 637016687 /nfs/dbraw/zinc/01/66/87/637016687.db2.gz RUDQWPYWCIAORB-GFCCVEGCSA-N 2 0 228.380 2.005 20 0 BEADRP C[C@H]1C[N@H+](CCCCCCC[NH3+])CC(C)(C)O1 ZINC000041681551 637017195 /nfs/dbraw/zinc/01/71/95/637017195.db2.gz ACPGEJAKXNQNDU-ZDUSSCGKSA-N 2 0 242.407 2.395 20 0 BEADRP C[C@@H](C[C@@H]1CCC[NH2+]1)[NH2+][C@H]1CC[C@@H](C)C1 ZINC000128497645 637081012 /nfs/dbraw/zinc/08/10/12/637081012.db2.gz DAURMCVEJUAISJ-VOAKCMCISA-N 2 0 210.365 2.295 20 0 BEADRP CCO[C@@H]1CCC[N@H+](CCCCCCC[NH3+])C1 ZINC000042425576 637243519 /nfs/dbraw/zinc/24/35/19/637243519.db2.gz CUSORLYUPGWVEM-CQSZACIVSA-N 2 0 242.407 2.397 20 0 BEADRP CC(C)C[N@H+](CC1CC[NH2+]CC1)C(C)C ZINC000042593397 637291074 /nfs/dbraw/zinc/29/10/74/637291074.db2.gz GKGTVQRVSFWHLD-UHFFFAOYSA-N 2 0 212.381 2.352 20 0 BEADRP CNc1ccccc1C[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000902615671 637314755 /nfs/dbraw/zinc/31/47/55/637314755.db2.gz HFSQTDSKVBZKSY-XBXGTLAGSA-N 2 0 247.386 2.158 20 0 BEADRP Cc1cc(C)nc(C[N@@H+]2CC[C@@H](C[NH3+])[C@@H](C)C2)c1 ZINC000903789399 637384374 /nfs/dbraw/zinc/38/43/74/637384374.db2.gz WLZFPKSMIOVVJU-JSGCOSHPSA-N 2 0 247.386 2.115 20 0 BEADRP CC1(C)CCC(C[NH2+]CC2([NH3+])CC2)CC1 ZINC000904448536 637414312 /nfs/dbraw/zinc/41/43/12/637414312.db2.gz ATKSPHHMBIELEN-UHFFFAOYSA-N 2 0 210.365 2.284 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CC[NH2+][C@H](C)C1)c1cncs1 ZINC000904468360 637422248 /nfs/dbraw/zinc/42/22/48/637422248.db2.gz AKEAXSQEHSGJIZ-MXWKQRLJSA-N 2 0 239.388 2.182 20 0 BEADRP c1cc(OCCC2CC[NH2+]CC2)cc2c1C[NH2+]C2 ZINC000905613395 637866591 /nfs/dbraw/zinc/86/65/91/637866591.db2.gz BNEVSNWXCUXQGM-UHFFFAOYSA-N 2 0 246.354 2.058 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]Cc2cccc3ccccc32)C1 ZINC000906507791 638179639 /nfs/dbraw/zinc/17/96/39/638179639.db2.gz CJHPESILQXIRFR-HDJSIYSDSA-N 2 0 226.323 2.419 20 0 BEADRP CCCOc1ccc(C[NH2+][C@H]2C[C@H]([NH3+])C2)cc1 ZINC000906508324 638179937 /nfs/dbraw/zinc/17/99/37/638179937.db2.gz NAJQQQYTQFWFGY-JOCQHMNTSA-N 2 0 234.343 2.055 20 0 BEADRP [NH3+]C1CC(NCc2ccc(F)cc2Cl)C1 ZINC000906509507 638180798 /nfs/dbraw/zinc/18/07/98/638180798.db2.gz GVYBISNYHQFJEK-UHFFFAOYSA-N 2 0 228.698 2.058 20 0 BEADRP [NH3+]C1CC([NH2+]Cc2coc3ccccc23)C1 ZINC000906510164 638182857 /nfs/dbraw/zinc/18/28/57/638182857.db2.gz OPIWFXABXUGNGC-UHFFFAOYSA-N 2 0 216.284 2.012 20 0 BEADRP [NH3+]C1CC([NH2+]C/C=C\c2ccc(F)cc2F)C1 ZINC000906510711 638183986 /nfs/dbraw/zinc/18/39/86/638183986.db2.gz RVKQAIGPFPXGOV-UPHRSURJSA-N 2 0 238.281 2.057 20 0 BEADRP CCSc1cccc(C[NH2+][C@H]2C[C@H]([NH3+])C2)c1 ZINC000906516348 638186288 /nfs/dbraw/zinc/18/62/88/638186288.db2.gz FMVJQMSZTUKKJN-HAQNSBGRSA-N 2 0 236.384 2.378 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+][C@H]2CC[C@@H](Cc3ccccc3)C2)C1 ZINC000906518845 638187009 /nfs/dbraw/zinc/18/70/09/638187009.db2.gz RTHCOXLWLZVHKK-VGWMRTNUSA-N 2 0 244.382 2.477 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+][C@@H]2CC[C@@H](Cc3ccccc3)C2)C1 ZINC000906518842 638187060 /nfs/dbraw/zinc/18/70/60/638187060.db2.gz RTHCOXLWLZVHKK-JONQDZQNSA-N 2 0 244.382 2.477 20 0 BEADRP CC(C)c1ccc(CC[NH2+][C@H]2C[C@H]([NH3+])C2)cc1 ZINC000906519359 638189762 /nfs/dbraw/zinc/18/97/62/638189762.db2.gz ZPRSMFGJRPRUME-SHTZXODSSA-N 2 0 232.371 2.432 20 0 BEADRP CC(C)C(N)=[NH+]OCC[C@H]1CCCC[N@@H+]1C ZINC000906502959 638197177 /nfs/dbraw/zinc/19/71/77/638197177.db2.gz LYYCZRBMNNGEML-LLVKDONJSA-N 2 0 227.352 2.015 20 0 BEADRP CCCC[NH2+]C[C@@H]1CCN1C1CCCC1 ZINC000906534483 638202367 /nfs/dbraw/zinc/20/23/67/638202367.db2.gz RKKMTHPJVQWGAD-ZDUSSCGKSA-N 2 0 210.365 2.393 20 0 BEADRP C[NH2+]CCCCC(=O)Nc1ccc([C@H](C)[NH3+])cc1 ZINC000911844451 639854836 /nfs/dbraw/zinc/85/48/36/639854836.db2.gz GKFHPXSXTOZUQE-NSHDSACASA-N 2 0 249.358 2.035 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C[C@@H]2CCCCC[NH2+]2)C1 ZINC000129393904 639987203 /nfs/dbraw/zinc/98/72/03/639987203.db2.gz UDXLALDOCZBSJW-UPJWGTAASA-N 2 0 210.365 2.297 20 0 BEADRP CC1CC(C[N@@H+]2C[C@@]3(C)CN(C)C[C@@]3(C)C2)C1 ZINC000931311335 640145477 /nfs/dbraw/zinc/14/54/77/640145477.db2.gz HJDKRUGPVVXUNO-ZMYVRHLSSA-N 2 0 236.403 2.306 20 0 BEADRP CC[C@@H](C)C[N@@H+]1C[C@@]2(C)CN(C)C[C@@]2(C)C1 ZINC000931309853 640146608 /nfs/dbraw/zinc/14/66/08/640146608.db2.gz HFYYONGDMCBAFE-MCIONIFRSA-N 2 0 224.392 2.306 20 0 BEADRP C[N@@H+]1CC[C@@H]2C[NH+](Cc3ccccc3)C[C@@H]2C1 ZINC000931425574 640193363 /nfs/dbraw/zinc/19/33/63/640193363.db2.gz GKGNVUQTSAWLNI-CABCVRRESA-N 2 0 230.355 2.070 20 0 BEADRP C[N@@H+]1CC[C@@H]2C[NH+](CC3CCCCC3)C[C@@H]2C1 ZINC000931429388 640200010 /nfs/dbraw/zinc/20/00/10/640200010.db2.gz GSRVPYVBFBXPQK-CABCVRRESA-N 2 0 236.403 2.450 20 0 BEADRP C[N@@H+]1CC[C@@H]2C[NH+](CCCC3CC3)C[C@@H]2C1 ZINC000931442289 640208420 /nfs/dbraw/zinc/20/84/20/640208420.db2.gz BDUAYKUQWFFJFA-KGLIPLIRSA-N 2 0 222.376 2.060 20 0 BEADRP C[N@@H+]1CC[C@@H]2CN(CCCC(C)(F)F)CC[C@@H]21 ZINC000931545659 640266476 /nfs/dbraw/zinc/26/64/76/640266476.db2.gz GGMKZMFRSWBUER-NEPJUHHUSA-N 2 0 246.345 2.448 20 0 BEADRP CC[C@@H]1C[C@H]1CN1CC[C@H]2[C@@H](CC[N@@H+]2C)C1 ZINC000931545806 640268276 /nfs/dbraw/zinc/26/82/76/640268276.db2.gz GJPZUCFKFZDNSZ-RFGFWPKPSA-N 2 0 222.376 2.059 20 0 BEADRP COC(C)(C)C[C@@H](C)[NH2+]CC1CC[NH+](C)CC1 ZINC000044515877 640400099 /nfs/dbraw/zinc/40/00/99/640400099.db2.gz WLKGNMWWYOSWMJ-GFCCVEGCSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+][C@H]1CCCC[C@H]1C ZINC000721123532 711488548 /nfs/dbraw/zinc/48/85/48/711488548.db2.gz XPBTWURDHMCQFJ-SYQHCUMBSA-N 2 0 224.392 2.400 20 0 BEADRP C[N@H+](Cc1ccsc1)C1CCC([NH3+])CC1 ZINC000055144349 640438602 /nfs/dbraw/zinc/43/86/02/640438602.db2.gz IGGUHEXRVCQFIN-UHFFFAOYSA-N 2 0 224.373 2.450 20 0 BEADRP CSCC[C@H](C)[N@H+](C)C[C@@]1(C)CCC[NH2+]C1 ZINC000222341599 640482519 /nfs/dbraw/zinc/48/25/19/640482519.db2.gz CITRJNVQDBHUGK-STQMWFEESA-N 2 0 244.448 2.450 20 0 BEADRP C[C@@H]1C[C@@H](C)[N@H+](C[C@@]2(C)CCC[NH2+]C2)C1 ZINC000222612823 640494494 /nfs/dbraw/zinc/49/44/94/640494494.db2.gz SAQMVCPTEJXAAY-UPJWGTAASA-N 2 0 210.365 2.106 20 0 BEADRP c1ccc2c(c1)cncc2CN1CCC[NH2+]CC1 ZINC000165067373 640530405 /nfs/dbraw/zinc/53/04/05/640530405.db2.gz RQNMXXRQTABXTN-UHFFFAOYSA-N 2 0 241.338 2.030 20 0 BEADRP C[N@H+](CCC[NH3+])Cc1cncc2ccccc21 ZINC000165086903 640532162 /nfs/dbraw/zinc/53/21/62/640532162.db2.gz IZAYSUQNKGKEAU-UHFFFAOYSA-N 2 0 229.327 2.015 20 0 BEADRP CC(C)[C@H]1CC[N@H+](CCC[NH2+]C2CC2)C1 ZINC000166049797 640608288 /nfs/dbraw/zinc/60/82/88/640608288.db2.gz POUWHQWQTCVVHM-LBPRGKRZSA-N 2 0 210.365 2.106 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CC(C)(C)SC)[C@@H](C)C1 ZINC000224403104 640616558 /nfs/dbraw/zinc/61/65/58/640616558.db2.gz GREXUTXZCBMEMX-RYUDHWBXSA-N 2 0 244.448 2.448 20 0 BEADRP C[C@@H](c1ccccc1)[N@@H+]1CC[C@@H](CC[NH3+])C1 ZINC000227029891 640809259 /nfs/dbraw/zinc/80/92/59/640809259.db2.gz VUQMMBROUBKCLF-QWHCGFSZSA-N 2 0 218.344 2.418 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1CC=CCC1 ZINC000227074615 640815355 /nfs/dbraw/zinc/81/53/55/640815355.db2.gz NOGGAAPXNSETRA-FRRDWIJNSA-N 2 0 208.349 2.060 20 0 BEADRP CC(C)[C@H]1CC[N@H+](C[C@@]2(C)CCC[NH2+]C2)C1 ZINC000228738446 640892571 /nfs/dbraw/zinc/89/25/71/640892571.db2.gz UHPWXOGUEXGRPN-KBPBESRZSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC[C@@H](C)C1)C1CC[NH+](C)CC1 ZINC000228909689 640904974 /nfs/dbraw/zinc/90/49/74/640904974.db2.gz PMYPMQXMFGVOAF-YRGRVCCFSA-N 2 0 224.392 2.495 20 0 BEADRP [NH3+]C1CC([NH2+][C@@H]2CCC[C@@H](C(F)(F)F)C2)C1 ZINC000087651571 640957257 /nfs/dbraw/zinc/95/72/57/640957257.db2.gz UXARPYILYBLTDX-PRWFHZCQSA-N 2 0 236.281 2.187 20 0 BEADRP C[C@H](C[NH2+][C@@H](C)C1CC1)C[NH+]1CCCC1 ZINC000062077351 641018653 /nfs/dbraw/zinc/01/86/53/641018653.db2.gz IADIBYAEKCXQIV-NEPJUHHUSA-N 2 0 210.365 2.106 20 0 BEADRP CC1CC[NH+](C[C@]2(C)CCC[NH2+]C2)CC1 ZINC000062861590 641099896 /nfs/dbraw/zinc/09/98/96/641099896.db2.gz TYBCDKCOVKUTEW-CYBMUJFWSA-N 2 0 210.365 2.108 20 0 BEADRP C[N@H+](CC(C)(C)C)C[C@@]1(C)CCC[NH2+]C1 ZINC000062867736 641102530 /nfs/dbraw/zinc/10/25/30/641102530.db2.gz FVJRTXAQENZGRP-ZDUSSCGKSA-N 2 0 212.381 2.354 20 0 BEADRP CC1(C)CC[NH+](C[C@@]2(C)CCC[NH2+]C2)CC1 ZINC000062868017 641102977 /nfs/dbraw/zinc/10/29/77/641102977.db2.gz HJSONDIXWQOZLQ-AWEZNQCLSA-N 2 0 224.392 2.498 20 0 BEADRP CC[NH+]1CCC(C[NH2+]Cc2ccoc2)CC1 ZINC000063047460 641122712 /nfs/dbraw/zinc/12/27/12/641122712.db2.gz DPNYGQMAZAHJJO-UHFFFAOYSA-N 2 0 222.332 2.101 20 0 BEADRP c1ccc([C@@H]2CC[N@@H+](C[C@@H]3CCC[NH2+]C3)C2)cc1 ZINC000050599370 641192458 /nfs/dbraw/zinc/19/24/58/641192458.db2.gz GMSNDDHMMIXEQL-GDBMZVCRSA-N 2 0 244.382 2.476 20 0 BEADRP Cc1cccc(OCC[NH2+][C@@H]2CCC[C@H]2C[NH3+])c1 ZINC000089150417 641477370 /nfs/dbraw/zinc/47/73/70/641477370.db2.gz QWXINCUIBFGYNY-DZGCQCFKSA-N 2 0 248.370 2.091 20 0 BEADRP CC[C@H]1CO[C@H](C)C[N@@H+]1CCCCCC[NH3+] ZINC000042452027 641551676 /nfs/dbraw/zinc/55/16/76/641551676.db2.gz VJAPJVZTJPQNLF-OLZOCXBDSA-N 2 0 228.380 2.005 20 0 BEADRP CC[C@H]1CO[C@@H](C)C[N@@H+]1CCCCCCC[NH3+] ZINC000042452103 641552288 /nfs/dbraw/zinc/55/22/88/641552288.db2.gz GQAXKTIRMLKWPH-KBPBESRZSA-N 2 0 242.407 2.395 20 0 BEADRP CC1(C)CCC[C@@H]([NH2+]C[C@@H]2CCC[NH2+]2)C1 ZINC000232781965 641675005 /nfs/dbraw/zinc/67/50/05/641675005.db2.gz JQTDUQWIOUNOBD-NEPJUHHUSA-N 2 0 210.365 2.297 20 0 BEADRP [NH3+]CC[C@H]1CC[N@H+](CCc2cccc(F)c2)C1 ZINC000075173797 641745932 /nfs/dbraw/zinc/74/59/32/641745932.db2.gz HZAFFMRSPGZBGP-ZDUSSCGKSA-N 2 0 236.334 2.039 20 0 BEADRP CC[C@H](C)C[NH2+]C[C@@H]1CCC[N@H+](CC)C1 ZINC000093066492 642454315 /nfs/dbraw/zinc/45/43/15/642454315.db2.gz KBXRDTDIEWVEPK-STQMWFEESA-N 2 0 212.381 2.354 20 0 BEADRP CC(C)C(C[NH+]1C[C@H]2C[NH2+]C[C@@H]2C1)C(C)C ZINC000304334337 642509705 /nfs/dbraw/zinc/50/97/05/642509705.db2.gz DRKIJHLHANNBRO-CHWSQXEVSA-N 2 0 224.392 2.066 20 0 BEADRP CC(C)C(C[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1)C(C)C ZINC000304334334 642510116 /nfs/dbraw/zinc/51/01/16/642510116.db2.gz DRKIJHLHANNBRO-BETUJISGSA-N 2 0 224.392 2.066 20 0 BEADRP C[C@H](C[C@@H]1CCC[NH2+]1)[NH2+][C@H]1CC[C@@H](C)C1 ZINC000253234112 642632554 /nfs/dbraw/zinc/63/25/54/642632554.db2.gz DAURMCVEJUAISJ-NDBYEHHHSA-N 2 0 210.365 2.295 20 0 BEADRP CC1(C[NH2+][C@@H]2CCCC[C@@H]2C[NH3+])CCC1 ZINC000233019508 642643718 /nfs/dbraw/zinc/64/37/18/642643718.db2.gz WEZYVDQDMLRODJ-VXGBXAGGSA-N 2 0 210.365 2.284 20 0 BEADRP CC1(C)CCC[N@H+](CC[C@@H]2CCC[NH2+]C2)C1 ZINC000069793394 642913646 /nfs/dbraw/zinc/91/36/46/642913646.db2.gz CCCGHPUHSXHGKX-ZDUSSCGKSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@H](C[C@H]1CCC[NH2+]1)[NH2+][C@H]1CC[C@@H](C)C1 ZINC000253234111 642946107 /nfs/dbraw/zinc/94/61/07/642946107.db2.gz DAURMCVEJUAISJ-LPWJVIDDSA-N 2 0 210.365 2.295 20 0 BEADRP COCC1CC[NH+](CCCCCCC[NH3+])CC1 ZINC000070084602 642968986 /nfs/dbraw/zinc/96/89/86/642968986.db2.gz NMPMPZCKCRUJAU-UHFFFAOYSA-N 2 0 242.407 2.254 20 0 BEADRP CC[C@@H]1C[C@H](C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)CCO1 ZINC000414910523 643085732 /nfs/dbraw/zinc/08/57/32/643085732.db2.gz DBWJVNFIWZCMPH-AAVRWANBSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H](CCc1ccco1)[NH2+]CCC(C)(C)[NH3+] ZINC000304568137 643127395 /nfs/dbraw/zinc/12/73/95/643127395.db2.gz HPBZZPLHLMOAGM-NSHDSACASA-N 2 0 224.348 2.318 20 0 BEADRP [NH3+]CC[C@@H]1CC[N@H+](Cc2cc(F)cc(F)c2)C1 ZINC000097918783 643213117 /nfs/dbraw/zinc/21/31/17/643213117.db2.gz IOZDSSHQKFRSNE-SNVBAGLBSA-N 2 0 240.297 2.136 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1ncc[nH]1 ZINC000049714543 643219741 /nfs/dbraw/zinc/21/97/41/643219741.db2.gz MTMLPZAROAEYDS-GFCCVEGCSA-N 2 0 238.379 2.010 20 0 BEADRP C[N@H+](CC1CCCC1)C[C@]1(C)CCC[NH2+]C1 ZINC000082493389 643327084 /nfs/dbraw/zinc/32/70/84/643327084.db2.gz ADEUNTZEQHKVIE-CQSZACIVSA-N 2 0 224.392 2.498 20 0 BEADRP CC[C@H]1CCC[N@H+](C[C@@H]2C[NH2+]C[C@H]2C)CC1 ZINC000234064843 643393312 /nfs/dbraw/zinc/39/33/12/643393312.db2.gz TZDNPELXSUSSRQ-RDBSUJKOSA-N 2 0 224.392 2.354 20 0 BEADRP CCc1ccc(C[NH2+]C[C@@H]2CCC[NH2+]C2)cc1 ZINC000234188548 643573989 /nfs/dbraw/zinc/57/39/89/643573989.db2.gz VYGWJEBMKICUCT-OAHLLOKOSA-N 2 0 232.371 2.338 20 0 BEADRP Cc1cc(NC(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)ccn1 ZINC000289532525 643577333 /nfs/dbraw/zinc/57/73/33/643577333.db2.gz NLPFNLRWQKZWPO-RYUDHWBXSA-N 2 0 247.342 2.059 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@@H]1C[NH3+])C1CCCC1 ZINC000084222273 643650113 /nfs/dbraw/zinc/65/01/13/643650113.db2.gz LOBYTSRXOANCBY-UHTWSYAYSA-N 2 0 210.365 2.282 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CCC[C@H]2C[NH3+])s1 ZINC000084221306 643651679 /nfs/dbraw/zinc/65/16/79/643651679.db2.gz VUWIWYGLJFUFEV-CMPLNLGQSA-N 2 0 224.373 2.274 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+][C@@H]2CCCOCC2)c2ccccc21 ZINC000261554998 643663385 /nfs/dbraw/zinc/66/33/85/643663385.db2.gz BEQSXUGPDHYSOC-KCPJHIHWSA-N 2 0 246.354 2.290 20 0 BEADRP C[N@H+](CC1CCCC1)C[C@@H]1CC[C@H]([NH3+])C1 ZINC000085015939 643678605 /nfs/dbraw/zinc/67/86/05/643678605.db2.gz SXWATUBDPPCWEA-OLZOCXBDSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@H]1CCC[N@H+](C[C@@H]2CC[C@H]([NH3+])C2)CC1 ZINC000085015938 643679109 /nfs/dbraw/zinc/67/91/09/643679109.db2.gz FZJVRFLNXRELIB-XQQFMLRXSA-N 2 0 210.365 2.236 20 0 BEADRP C[N@@H+](Cc1ccccc1)C[C@@H]1CC[C@H]([NH3+])C1 ZINC000085014332 643679851 /nfs/dbraw/zinc/67/98/51/643679851.db2.gz HVZGKJDOAKYJOV-KGLIPLIRSA-N 2 0 218.344 2.246 20 0 BEADRP C[C@@H]1CCC[C@@H](C)[NH+]1C[C@@H]1CC[C@H]([NH3+])C1 ZINC000085014435 643680507 /nfs/dbraw/zinc/68/05/07/643680507.db2.gz URFQBDLLKUTDQI-LPWJVIDDSA-N 2 0 210.365 2.377 20 0 BEADRP CCCCOCC[N@H+](C)C1CCC([NH3+])CC1 ZINC000085870034 643824783 /nfs/dbraw/zinc/82/47/83/643824783.db2.gz YDJCTAAYTWUKAJ-UHFFFAOYSA-N 2 0 228.380 2.005 20 0 BEADRP CS[C@@H]1CCC[C@H]([NH2+]C[C@@H](C)C[NH+](C)C)C1 ZINC000922140083 643870408 /nfs/dbraw/zinc/87/04/08/643870408.db2.gz NKCNZJDKEHEOEX-FRRDWIJNSA-N 2 0 244.448 2.448 20 0 BEADRP C[N@H+](CCc1cccs1)C[C@@H]1CC[C@H]([NH3+])C1 ZINC000086442288 644136426 /nfs/dbraw/zinc/13/64/26/644136426.db2.gz KPFBYRWYDRMDBA-NEPJUHHUSA-N 2 0 238.400 2.350 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21)[C@@H]1CCCO1 ZINC000131948594 644149925 /nfs/dbraw/zinc/14/99/25/644149925.db2.gz CBNLGONBJZJDIS-HPEDKQMDSA-N 2 0 246.354 2.288 20 0 BEADRP CC[N@H+](CCC1C[C@H]2CC[C@@H](C1)[NH2+]2)C1CC1 ZINC000086573165 644152215 /nfs/dbraw/zinc/15/22/15/644152215.db2.gz IZYRGHZOSGLNLF-YHWZYXNKSA-N 2 0 222.376 2.391 20 0 BEADRP CC1(C)CCC[C@@H]1[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000226990308 644152541 /nfs/dbraw/zinc/15/25/41/644152541.db2.gz BWYNURIUZDFMIQ-UTUOFQBUSA-N 2 0 210.365 2.425 20 0 BEADRP CC[N@H+](CCC[NH2+]C1CC1)CCc1ccccn1 ZINC000923321204 644349971 /nfs/dbraw/zinc/34/99/71/644349971.db2.gz ADERPQRAOBVYQX-UHFFFAOYSA-N 2 0 247.386 2.088 20 0 BEADRP Cc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@@H]2C[NH3+])o1 ZINC000084219217 644420611 /nfs/dbraw/zinc/42/06/11/644420611.db2.gz DXXSUNNSNXKZDW-QJPTWQEYSA-N 2 0 222.332 2.366 20 0 BEADRP CCCCCC[C@H](O)C[NH2+][C@H]1C[C@@H]([NH3+])C1(C)C ZINC000923420264 644424590 /nfs/dbraw/zinc/42/45/90/644424590.db2.gz HFLSFXKHIWXGLI-XQQFMLRXSA-N 2 0 242.407 2.033 20 0 BEADRP C[C@H]1CCCC[C@@H]1C[N@@H+]1CC[C@@H]2CC[NH2+][C@@H]2C1 ZINC000923455565 644436185 /nfs/dbraw/zinc/43/61/85/644436185.db2.gz YAAYCYPJVHIZHV-BYNSBNAKSA-N 2 0 236.403 2.497 20 0 BEADRP CCO[C@H]1C[C@@H]([NH2+]C2CCC([NH3+])CC2)C1(C)C ZINC000085398253 644439680 /nfs/dbraw/zinc/43/96/80/644439680.db2.gz BMFWILSUFCRWET-TUUUFIMRSA-N 2 0 240.391 2.050 20 0 BEADRP C[C@H]1C[N@H+](CCC2CCC2)CC[C@@H]1C[NH3+] ZINC000923488014 644461846 /nfs/dbraw/zinc/46/18/46/644461846.db2.gz CTMFUAXHURKRJK-WCQYABFASA-N 2 0 210.365 2.093 20 0 BEADRP Cc1cccc(C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)c1 ZINC000086402337 644465823 /nfs/dbraw/zinc/46/58/23/644465823.db2.gz JSINSVLNEQRIHX-KGLIPLIRSA-N 2 0 218.344 2.355 20 0 BEADRP Cc1cccc(C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)c1 ZINC000086402331 644466947 /nfs/dbraw/zinc/46/69/47/644466947.db2.gz JSINSVLNEQRIHX-UONOGXRCSA-N 2 0 218.344 2.355 20 0 BEADRP Cc1cccc(C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)c1 ZINC000086402335 644467217 /nfs/dbraw/zinc/46/72/17/644467217.db2.gz JSINSVLNEQRIHX-ZIAGYGMSSA-N 2 0 218.344 2.355 20 0 BEADRP C[C@@H]1C[N@H+](CC[C@@H]2C[C@H]2C2CC2)CC[C@@H]1C[NH3+] ZINC000923491934 644468132 /nfs/dbraw/zinc/46/81/32/644468132.db2.gz KUSZMMWIBSJDPJ-NGFQHRJXSA-N 2 0 236.403 2.339 20 0 BEADRP COc1cccc(C[N@@H+]2CC[C@H](C[NH3+])[C@H](C)C2)c1 ZINC000923498552 644473392 /nfs/dbraw/zinc/47/33/92/644473392.db2.gz OTXWEAPOSASSOA-TZMCWYRMSA-N 2 0 248.370 2.112 20 0 BEADRP c1ccc([C@@H]2C[C@@H]2[N@@H+]2C[C@@H]3CC[NH2+]C[C@@H]3C2)cc1 ZINC000923515606 644479490 /nfs/dbraw/zinc/47/94/90/644479490.db2.gz IJRQFGTUUUPCHL-FZKCQIBNSA-N 2 0 242.366 2.084 20 0 BEADRP Cc1ccc(F)cc1C[N@@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1 ZINC000923516384 644479510 /nfs/dbraw/zinc/47/95/10/644479510.db2.gz BOFDFBBKVSCWCH-GXTWGEPZSA-N 2 0 248.345 2.175 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[N@@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1 ZINC000923518951 644483140 /nfs/dbraw/zinc/48/31/40/644483140.db2.gz HIWPOJOMFQZTPR-APIJFGDWSA-N 2 0 236.403 2.354 20 0 BEADRP CCc1cccc(C[N@@H+]2C[C@@H]3CC[NH2+]C[C@@H]3C2)c1 ZINC000923521173 644483554 /nfs/dbraw/zinc/48/35/54/644483554.db2.gz JSSGDBVLCQUQJF-JKSUJKDBSA-N 2 0 244.382 2.290 20 0 BEADRP [NH3+]CCCCCCC[N@@H+]1CCCCC[C@@H]1CO ZINC000923530426 644486866 /nfs/dbraw/zinc/48/68/66/644486866.db2.gz ISQRCYCTIMOCIT-CQSZACIVSA-N 2 0 242.407 2.133 20 0 BEADRP CC(C)[C@@H](C)[N@@H+]1CC[C@@]2(C1)CCCC[NH2+]2 ZINC000923533720 644490517 /nfs/dbraw/zinc/49/05/17/644490517.db2.gz NTCZIMVQRRNAMK-CHWSQXEVSA-N 2 0 210.365 2.249 20 0 BEADRP C([C@@H]1C[C@H]2C[C@H]2C1)[N@@H+]1CC[C@@]2(C1)CCCC[NH2+]2 ZINC000923532716 644490649 /nfs/dbraw/zinc/49/06/49/644490649.db2.gz GENNGJWAGANDAJ-LXTVHRRPSA-N 2 0 234.387 2.251 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]C2CC[NH2+]CC2)[C@H]1C ZINC000245224840 644517126 /nfs/dbraw/zinc/51/71/26/644517126.db2.gz GLILUBLVMICMFH-MDZLAQPJSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@@H]1CCC[N@@H+]1CC[C@H]1CCC[NH2+]C1 ZINC000251914045 644830168 /nfs/dbraw/zinc/83/01/68/644830168.db2.gz XXHXHORAPOSYLZ-CHWSQXEVSA-N 2 0 210.365 2.251 20 0 BEADRP CC[C@H]1CCC[N@@H+]1CC[C@H]1CCC[NH2+]C1 ZINC000251914047 644830735 /nfs/dbraw/zinc/83/07/35/644830735.db2.gz XXHXHORAPOSYLZ-OLZOCXBDSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]Cc2cccc(C[NH+](C)C)c2)CO1 ZINC000647169849 644838205 /nfs/dbraw/zinc/83/82/05/644838205.db2.gz DHYMAJCLNAJWAM-IUODEOHRSA-N 2 0 248.370 2.015 20 0 BEADRP CCC(CC)C[N@@H+]1CC[C@]2(CCC[NH2+]2)C1 ZINC000415136425 644886451 /nfs/dbraw/zinc/88/64/51/644886451.db2.gz HJILAGUXCBHDEY-CYBMUJFWSA-N 2 0 210.365 2.251 20 0 BEADRP CSCC[C@H](C)[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000252703301 644886738 /nfs/dbraw/zinc/88/67/38/644886738.db2.gz RONSUOKOILJVQF-XQQFMLRXSA-N 2 0 242.432 2.344 20 0 BEADRP C[C@@]1(C[N@@H+]2CCC3(CCCC3)C2)CC[NH2+]C1 ZINC000304419083 644904281 /nfs/dbraw/zinc/90/42/81/644904281.db2.gz QSJMHKIAYMLQJG-CYBMUJFWSA-N 2 0 222.376 2.252 20 0 BEADRP C[C@]1(CC[NH2+][C@@H]2CCC[C@@H]2[NH3+])C[C@]1(F)Cl ZINC000844925463 645350268 /nfs/dbraw/zinc/35/02/68/645350268.db2.gz VCFJBISNPXHNRZ-ZRUFSTJUSA-N 2 0 234.746 2.161 20 0 BEADRP C(CC1CC[NH2+]CC1)[NH2+][C@H]1CC[C@H]1C1CC1 ZINC000844927379 645350475 /nfs/dbraw/zinc/35/04/75/645350475.db2.gz ZOUJSSVFTDKRAN-KBPBESRZSA-N 2 0 222.376 2.154 20 0 BEADRP C/C=C/C[NH2+][C@@H]1CCCN2CCCC[C@@H]12 ZINC000926764232 645412663 /nfs/dbraw/zinc/41/26/63/645412663.db2.gz CIPXRLVCRTXPGW-XDYXTIEYSA-N 2 0 208.349 2.169 20 0 BEADRP CCC[NH2+][C@@H]1CC[NH2+]C[C@@H]1C1CCCC1 ZINC000925487328 645465526 /nfs/dbraw/zinc/46/55/26/645465526.db2.gz CIAUVUZZQVLPHM-CHWSQXEVSA-N 2 0 210.365 2.154 20 0 BEADRP C[NH2+]CCN(C)CC[C@@H]1CCc2ccccc21 ZINC000852749554 645487399 /nfs/dbraw/zinc/48/73/99/645487399.db2.gz MMZOBZKZZBJMAY-AWEZNQCLSA-N 2 0 232.371 2.258 20 0 BEADRP C[C@@H]1CN(C2CC2)C[C@H]1[NH2+]CCC1CC=CC1 ZINC000926951951 645498502 /nfs/dbraw/zinc/49/85/02/645498502.db2.gz HLRCAXZNJPRGEA-IUODEOHRSA-N 2 0 234.387 2.415 20 0 BEADRP CC(C)[NH2+]C1CCC(C)([NH+]2CCC2)CC1 ZINC000927040259 645530953 /nfs/dbraw/zinc/53/09/53/645530953.db2.gz ZRHVRWLJBUCQGM-UHFFFAOYSA-N 2 0 210.365 2.391 20 0 BEADRP CC(C)C[NH2+][C@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C ZINC000925493104 645705696 /nfs/dbraw/zinc/70/56/96/645705696.db2.gz JZPACIXYLGYUFR-WOPDTQHZSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@@H]([NH2+]C1CCC([NH3+])CC1)c1ccc(F)cn1 ZINC000134008601 645869849 /nfs/dbraw/zinc/86/98/49/645869849.db2.gz WJOAHBXHKHZRLH-OIKLOGQESA-N 2 0 237.322 2.141 20 0 BEADRP C[C@H](C[NH2+][C@H](CCC[NH3+])c1ccccc1)N(C)C ZINC000925494608 645924226 /nfs/dbraw/zinc/92/42/26/645924226.db2.gz KPXMDYGPIKHYNU-UKRRQHHQSA-N 2 0 249.402 2.006 20 0 BEADRP COCC[NH2+][C@H](C)c1cccc(C[NH+](C)C)c1 ZINC000924537466 646056299 /nfs/dbraw/zinc/05/62/99/646056299.db2.gz IYCAQRUWYZCYJK-GFCCVEGCSA-N 2 0 236.359 2.045 20 0 BEADRP CSCC[NH2+]C1CC[NH+](CCC(C)C)CC1 ZINC000924550555 646066657 /nfs/dbraw/zinc/06/66/57/646066657.db2.gz GTZQNLLPHRIIJP-UHFFFAOYSA-N 2 0 244.448 2.450 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H]2C[C@H]3C=C[C@@H]2CC3)C1 ZINC000924706901 646092373 /nfs/dbraw/zinc/09/23/73/646092373.db2.gz RQXOEBCYKGIQLT-XQLPTFJDSA-N 2 0 234.387 2.273 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H]2C[C@H]3C=C[C@@H]2CC3)C1 ZINC000924706898 646092905 /nfs/dbraw/zinc/09/29/05/646092905.db2.gz RQXOEBCYKGIQLT-BYNSBNAKSA-N 2 0 234.387 2.273 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@H]1C[C@H]2C=C[C@@H]1CC2 ZINC000924851668 646119488 /nfs/dbraw/zinc/11/94/88/646119488.db2.gz FLJNJTQRGOZFJT-RQJABVFESA-N 2 0 222.376 2.271 20 0 BEADRP CC1(C)C[C@@H]([NH2+]C[C@@H]2CCCCO2)C[C@@H]([NH3+])C1 ZINC000925477555 646290129 /nfs/dbraw/zinc/29/01/29/646290129.db2.gz BUJKYPMOGHAOLB-AGIUHOORSA-N 2 0 240.391 2.051 20 0 BEADRP CC1(C)C[C@H]([NH3+])C[C@@H]([NH2+]C[C@@H]2CCCCO2)C1 ZINC000925477563 646290431 /nfs/dbraw/zinc/29/04/31/646290431.db2.gz BUJKYPMOGHAOLB-UPJWGTAASA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H]1CCC[C@H](C)[C@H]1[NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32 ZINC000925481344 646295103 /nfs/dbraw/zinc/29/51/03/646295103.db2.gz NLOYVXFJYWUIKU-DXFYZWRZSA-N 2 0 248.414 2.397 20 0 BEADRP CC(C)C[NH2+][C@@H]1CC[NH2+]C[C@@H]1C1CCCC1 ZINC000925492072 646299539 /nfs/dbraw/zinc/29/95/39/646299539.db2.gz FGZJGNXGXAAVML-ZIAGYGMSSA-N 2 0 224.392 2.400 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@H+](C)C1CCN(CC)CC1 ZINC000929777460 646305356 /nfs/dbraw/zinc/30/53/56/646305356.db2.gz BCJLMPGNHNQFSN-OLZOCXBDSA-N 2 0 224.392 2.449 20 0 BEADRP CC(C)OCCC[NH2+][C@@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925506836 646305771 /nfs/dbraw/zinc/30/57/71/646305771.db2.gz SLIITLHEKYRRIC-CHWSQXEVSA-N 2 0 242.407 2.297 20 0 BEADRP CC[NH+](CC)CCN[C@@H](c1ccccc1)[C@H](C)[NH3+] ZINC000925505485 646305836 /nfs/dbraw/zinc/30/58/36/646305836.db2.gz UJINXFYTBFFBDC-DZGCQCFKSA-N 2 0 249.402 2.006 20 0 BEADRP CSC[C@H](C)[NH2+][C@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925505289 646305839 /nfs/dbraw/zinc/30/58/39/646305839.db2.gz QFTLKPJJICWUMD-AXFHLTTASA-N 2 0 230.421 2.234 20 0 BEADRP CS[C@@H]1CC[C@@H]([NH2+][C@@H]2CC[NH2+]C23CCC3)C1 ZINC000925520920 646312181 /nfs/dbraw/zinc/31/21/81/646312181.db2.gz BHRLHNMEULFCHB-IJLUTSLNSA-N 2 0 240.416 2.145 20 0 BEADRP CCCCOCC[NH2+][C@@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925517939 646313189 /nfs/dbraw/zinc/31/31/89/646313189.db2.gz CPRFUSXIAHRVBL-QWHCGFSZSA-N 2 0 242.407 2.299 20 0 BEADRP COCCCCC[NH2+][C@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925531518 646320376 /nfs/dbraw/zinc/32/03/76/646320376.db2.gz ZFCKOUKUZWSBIK-STQMWFEESA-N 2 0 242.407 2.299 20 0 BEADRP CC1(C)C[C@H]([NH3+])C[C@@H]([NH2+]CCc2cccnc2)C1 ZINC000925536382 646321228 /nfs/dbraw/zinc/32/12/28/646321228.db2.gz OFFSCAHNDHGDFJ-ZIAGYGMSSA-N 2 0 247.386 2.120 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@H]([NH3+])CC(C)(C)C1)[C@@H]1CCCO1 ZINC000925538298 646322665 /nfs/dbraw/zinc/32/26/65/646322665.db2.gz TZNGWWFFEYEEQY-RVMXOQNASA-N 2 0 240.391 2.050 20 0 BEADRP CCC1(C[NH2+][C@@H]2CC[NH2+]C23CCC3)CCC1 ZINC000925543603 646325118 /nfs/dbraw/zinc/32/51/18/646325118.db2.gz VPTLYNILSMONPV-GFCCVEGCSA-N 2 0 222.376 2.441 20 0 BEADRP CC1(C)C[C@@H]([NH2+]C[C@H]2CCCS2)C[C@@H]([NH3+])C1 ZINC000925552614 646328262 /nfs/dbraw/zinc/32/82/62/646328262.db2.gz LIQLQWQWRYHKET-GRYCIOLGSA-N 2 0 242.432 2.378 20 0 BEADRP CC1(C[NH2+][C@H]2[C@@H]3CCC[NH2+][C@@H]3C2(C)C)CC1 ZINC000925575341 646341155 /nfs/dbraw/zinc/34/11/55/646341155.db2.gz FPEMWAVFXCAGQH-WOPDTQHZSA-N 2 0 222.376 2.153 20 0 BEADRP CC[C@H](O)CCC[NH2+][C@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925582713 646346090 /nfs/dbraw/zinc/34/60/90/646346090.db2.gz ZCIXVYCZBPMZEG-AGIUHOORSA-N 2 0 242.407 2.033 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCOC1)c1cccc(C[NH+](C)C)c1 ZINC000925614789 646362541 /nfs/dbraw/zinc/36/25/41/646362541.db2.gz CKHUEWBNMCLBLK-IUODEOHRSA-N 2 0 248.370 2.188 20 0 BEADRP C1=CC[C@@H](C[NH2+][C@H]2CC[NH2+]C23CCC3)CC1 ZINC000925618856 646365009 /nfs/dbraw/zinc/36/50/09/646365009.db2.gz YQMICPZXFDFKHX-OLZOCXBDSA-N 2 0 220.360 2.217 20 0 BEADRP FCCC[NH2+][C@H]1CC[NH2+]C[C@H]1C1CCCC1 ZINC000925621069 646367074 /nfs/dbraw/zinc/36/70/74/646367074.db2.gz YHEWPQARQHKHSR-STQMWFEESA-N 2 0 228.355 2.104 20 0 BEADRP C1=CC[C@H]([NH2+][C@@H]2CC[NH2+]C23CCCC3)CC1 ZINC000925620691 646367502 /nfs/dbraw/zinc/36/75/02/646367502.db2.gz XGZIUCJMFFRFJK-QWHCGFSZSA-N 2 0 220.360 2.359 20 0 BEADRP Cc1cncc(C[NH2+][C@@H]2C[C@H]([NH3+])CC(C)(C)C2)c1 ZINC000925629720 646373791 /nfs/dbraw/zinc/37/37/91/646373791.db2.gz NLSKUEAOQWTIMX-UONOGXRCSA-N 2 0 247.386 2.386 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2C[C@H]([NH3+])CC(C)(C)C2)CCO1 ZINC000925632212 646376401 /nfs/dbraw/zinc/37/64/01/646376401.db2.gz VPRVQWRGANJTTL-XQHKEYJVSA-N 2 0 240.391 2.050 20 0 BEADRP CC1(C)C[C@@H]([NH2+][C@@H]2CCCOCC2)C[C@@H]([NH3+])C1 ZINC000925636483 646379560 /nfs/dbraw/zinc/37/95/60/646379560.db2.gz SRLLOTZNQRNNQP-UPJWGTAASA-N 2 0 240.391 2.051 20 0 BEADRP CC1(C)C[C@H]([NH3+])C[C@@H]([NH2+]C2CC(F)(F)C2)C1 ZINC000925651485 646391218 /nfs/dbraw/zinc/39/12/18/646391218.db2.gz DKHKASJHYIMKGR-RKDXNWHRSA-N 2 0 232.318 2.280 20 0 BEADRP C[C@@H]1CSC[C@@H]1[NH2+][C@@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925671083 646399573 /nfs/dbraw/zinc/39/95/73/646399573.db2.gz QEXAJBPIFOYDTK-KKOKHZNYSA-N 2 0 242.432 2.234 20 0 BEADRP C([NH2+][C@@H]1CC[NH2+]C12CCC2)[C@H]1CCCSC1 ZINC000925672816 646401031 /nfs/dbraw/zinc/40/10/31/646401031.db2.gz KGQNEDAHQVJQEL-VXGBXAGGSA-N 2 0 240.416 2.004 20 0 BEADRP C([NH2+][C@@H]1CC[NH2+]C12CCC2)[C@@H]1CCCSC1 ZINC000925672814 646402461 /nfs/dbraw/zinc/40/24/61/646402461.db2.gz KGQNEDAHQVJQEL-NWDGAFQWSA-N 2 0 240.416 2.004 20 0 BEADRP C([NH2+][C@H]1CC[NH2+]C12CCC2)[C@H]1CCCSC1 ZINC000925672813 646402817 /nfs/dbraw/zinc/40/28/17/646402817.db2.gz KGQNEDAHQVJQEL-NEPJUHHUSA-N 2 0 240.416 2.004 20 0 BEADRP FCCCC[NH2+][C@@H]1CC[NH2+]C12CCCC2 ZINC000925677602 646406482 /nfs/dbraw/zinc/40/64/82/646406482.db2.gz VWZHPABTBAYPOM-LLVKDONJSA-N 2 0 214.328 2.000 20 0 BEADRP C[C@H](CCCCO)[NH2+][C@@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925678617 646406764 /nfs/dbraw/zinc/40/67/64/646406764.db2.gz DQBPKEKJAILHII-JHJVBQTASA-N 2 0 242.407 2.033 20 0 BEADRP CC[C@@H]1OCC[C@H]1[NH2+][C@@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925684427 646410820 /nfs/dbraw/zinc/41/08/20/646410820.db2.gz AYBCDKDPJOSGLR-LOWDOPEQSA-N 2 0 240.391 2.050 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]CCC2CC(F)(F)C2)C12CCC2 ZINC000925685641 646411702 /nfs/dbraw/zinc/41/17/02/646411702.db2.gz NWVMNATUYTYQBK-QWRGUYRKSA-N 2 0 244.329 2.281 20 0 BEADRP CC1(C)C[C@H]([NH3+])C[C@@H]([NH2+][C@H]2CC23CC3)C1 ZINC000925702445 646427483 /nfs/dbraw/zinc/42/74/83/646427483.db2.gz CZFMMEGWMAWLQF-MXWKQRLJSA-N 2 0 208.349 2.035 20 0 BEADRP Cc1cc(C[NH2+][C@H]2C[C@@H]([NH3+])C23CCC3)cc(C)n1 ZINC000925706579 646430377 /nfs/dbraw/zinc/43/03/77/646430377.db2.gz MPQMVWYRPSUXFT-KGLIPLIRSA-N 2 0 245.370 2.058 20 0 BEADRP CC(C)(F)CC[NH2+][C@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C ZINC000925708465 646431910 /nfs/dbraw/zinc/43/19/10/646431910.db2.gz MDQHRPAXQYDVFG-WOPDTQHZSA-N 2 0 242.382 2.491 20 0 BEADRP C([NH2+][C@@H]1CC[NH2+]C12CCC2)[C@H]1CCC[C@@H]2C[C@@H]21 ZINC000925708297 646432628 /nfs/dbraw/zinc/43/26/28/646432628.db2.gz KPBWJDUKMZSCPP-YIYPIFLZSA-N 2 0 234.387 2.297 20 0 BEADRP CC1(C)C[C@H]([NH3+])C[C@@H]([NH2+][C@H]2C=CCC2)C1 ZINC000925710190 646434390 /nfs/dbraw/zinc/43/43/90/646434390.db2.gz HYXSQSIJBIMUSY-GRYCIOLGSA-N 2 0 208.349 2.201 20 0 BEADRP [NH3+][C@H]1C[C@@H]([NH2+]CC2CCC(F)CC2)C12CCC2 ZINC000925711283 646437622 /nfs/dbraw/zinc/43/76/22/646437622.db2.gz LYIQHEJDUNLJEV-IFWUJCSASA-N 2 0 240.366 2.374 20 0 BEADRP CC(C)(F)C[NH2+][C@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925723881 646438180 /nfs/dbraw/zinc/43/81/80/646438180.db2.gz DDXJPGPQWXTNOJ-ZJUUUORDSA-N 2 0 216.344 2.230 20 0 BEADRP C[C@H](N)[C@@H]([NH2+]CCCCCC[NH3+])c1ccccc1 ZINC000925713404 646439299 /nfs/dbraw/zinc/43/92/99/646439299.db2.gz RVWBYZXSLGEPPO-DZGCQCFKSA-N 2 0 249.402 2.184 20 0 BEADRP C[C@]1(CC[NH2+][C@H]2C[C@H]([NH3+])C23CCC3)CC1(F)F ZINC000925712722 646439422 /nfs/dbraw/zinc/43/94/22/646439422.db2.gz ZIQOWBOKHPRJSD-DCAQKATOSA-N 2 0 244.329 2.281 20 0 BEADRP Cc1ncccc1C[NH2+][C@@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925718993 646442757 /nfs/dbraw/zinc/44/27/57/646442757.db2.gz PBHUBFGODSDBBO-ZIAGYGMSSA-N 2 0 247.386 2.386 20 0 BEADRP CC1(C)[C@H]([NH2+]C[C@@H]2C=CCC2)[C@@H]2CCC[NH2+][C@@H]21 ZINC000925731016 646453406 /nfs/dbraw/zinc/45/34/06/646453406.db2.gz IURIOVSCAXCGHD-YIYPIFLZSA-N 2 0 234.387 2.319 20 0 BEADRP C[C@@H]([NH2+]C[C@@]1(C)CC1(C)C)[C@H]1CCC[NH2+]1 ZINC000925733424 646455869 /nfs/dbraw/zinc/45/58/69/646455869.db2.gz ITSYDYRSSIATMW-NQBHXWOUSA-N 2 0 210.365 2.153 20 0 BEADRP CC1(C)C[C@]1(C)C[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000925733357 646456314 /nfs/dbraw/zinc/45/63/14/646456314.db2.gz HGSDDFFXJLZTFL-DGCLKSJQSA-N 2 0 222.376 2.297 20 0 BEADRP CCC[C@H](C)CC[NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32 ZINC000925734956 646458278 /nfs/dbraw/zinc/45/82/78/646458278.db2.gz WDXPVZNQSPURAZ-GXYBRJDSSA-N 2 0 236.403 2.399 20 0 BEADRP C[C@H]([NH2+]CC1(CC2CC2)CC1)[C@@H]1CC[NH2+]C1 ZINC000925734774 646459172 /nfs/dbraw/zinc/45/91/72/646459172.db2.gz ULQYAGSBJKCRBV-WCQYABFASA-N 2 0 222.376 2.154 20 0 BEADRP CC(C)([NH3+])CC[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000925736438 646460812 /nfs/dbraw/zinc/46/08/12/646460812.db2.gz GOHCYQAJLKHUSZ-CQSZACIVSA-N 2 0 249.402 2.184 20 0 BEADRP CC(C)n1cc([C@H](C)[NH2+]CCC(C)(C)[NH3+])cn1 ZINC000925742203 646461840 /nfs/dbraw/zinc/46/18/40/646461840.db2.gz ZLRUNGHMIFNGSM-NSHDSACASA-N 2 0 238.379 2.242 20 0 BEADRP CCO[C@H]1C[C@@H]([NH2+]CCC(C)(C)[NH3+])C12CCC2 ZINC000925741820 646462936 /nfs/dbraw/zinc/46/29/36/646462936.db2.gz NQCFZMDBNFHPOA-NEPJUHHUSA-N 2 0 240.391 2.051 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+][C@@H]1C[C@@H]2CCCC[C@H]12 ZINC000925763921 646465976 /nfs/dbraw/zinc/46/59/76/646465976.db2.gz DNZQDWXDGKXYHI-IEECTRCBSA-N 2 0 208.349 2.035 20 0 BEADRP CCC1([NH3+])CC[NH+]([C@H](C)[C@@H]2CCCOC2)CC1 ZINC000925760066 646466703 /nfs/dbraw/zinc/46/67/03/646466703.db2.gz NYPZGDLOKZACRF-CHWSQXEVSA-N 2 0 240.391 2.005 20 0 BEADRP C1=CCCC([NH2+][C@H]2CC[NH2+]C23CCC3)CC1 ZINC000925778891 646477832 /nfs/dbraw/zinc/47/78/32/646477832.db2.gz GXRUSBWVMKTMTP-ZDUSSCGKSA-N 2 0 220.360 2.359 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[NH2+]CCC1(F)F)C1CCCC1 ZINC000925781654 646479389 /nfs/dbraw/zinc/47/93/89/646479389.db2.gz JDGKEYHOFWYSQZ-CMPLNLGQSA-N 2 0 246.345 2.400 20 0 BEADRP CCCC[C@@H](C)[C@H](C)[NH2+][C@@H]1C[NH2+]C[C@H]1C ZINC000925785503 646481696 /nfs/dbraw/zinc/48/16/96/646481696.db2.gz PLJRYAGMRCVNHY-FVCCEPFGSA-N 2 0 212.381 2.399 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H]1C[NH2+]CCC1(F)F)C1CC1 ZINC000925786927 646482461 /nfs/dbraw/zinc/48/24/61/646482461.db2.gz XYPWZCIEZYHKAE-WDEREUQCSA-N 2 0 232.318 2.009 20 0 BEADRP CCC[C@H]([NH2+]C[C@@H]1C[NH2+]C[C@H]1C)C1CCC1 ZINC000925787173 646483191 /nfs/dbraw/zinc/48/31/91/646483191.db2.gz WQERTERVKJTKHL-XBFCOCLRSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+]C1[C@H](C)CCC[C@H]1C ZINC000925792136 646484302 /nfs/dbraw/zinc/48/43/02/646484302.db2.gz TZWUMYRGEHURIT-LPWJVIDDSA-N 2 0 224.392 2.256 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@H]1CCc2ccc(F)cc21 ZINC000925791476 646484694 /nfs/dbraw/zinc/48/46/94/646484694.db2.gz QOVZOZCDZWFGBY-GMXABZIVSA-N 2 0 248.345 2.258 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+]CC[C@@H]1C[NH2+]C[C@H]1C ZINC000925795668 646487368 /nfs/dbraw/zinc/48/73/68/646487368.db2.gz HSYWLTLTDTYXDH-SYQHCUMBSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]Cc1nccc2c1CCCC2 ZINC000925804732 646488265 /nfs/dbraw/zinc/48/82/65/646488265.db2.gz CEUQHOHEVGEGBM-NEPJUHHUSA-N 2 0 247.386 2.176 20 0 BEADRP CSC1CCC(C[NH2+][C@H]2CCC[C@H]2[NH3+])CC1 ZINC000925803372 646488383 /nfs/dbraw/zinc/48/83/83/646488383.db2.gz YOLFYLBLFDLGLP-TUUUFIMRSA-N 2 0 242.432 2.378 20 0 BEADRP [NH3+]C1CCC([NH2+]C[C@@H]2C[C@H]2C(F)(F)F)CC1 ZINC000925831630 646500912 /nfs/dbraw/zinc/50/09/12/646500912.db2.gz KNZJUYOLSJYJOR-AUXWQGHOSA-N 2 0 236.281 2.044 20 0 BEADRP C[C@@H]([NH2+]C[C@]12CCC[C@H]1[NH2+]CC2)c1ccncc1 ZINC000925846107 646509495 /nfs/dbraw/zinc/50/94/95/646509495.db2.gz OPFOVQBKHDBUTI-BPLDGKMQSA-N 2 0 245.370 2.264 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCSC2(CCC2)C1 ZINC000925860631 646513217 /nfs/dbraw/zinc/51/32/17/646513217.db2.gz IYOFYWDBPRZQAB-UTUOFQBUSA-N 2 0 240.416 2.274 20 0 BEADRP COC[C@H](C[NH2+][C@H]1CCCCC[C@@H]1[NH3+])C(C)C ZINC000925874234 646523298 /nfs/dbraw/zinc/52/32/98/646523298.db2.gz QASXSWNSYHKFPE-IHRRRGAJSA-N 2 0 242.407 2.155 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+][C@H]2CCCc3cccnc32)C1 ZINC000925871771 646524587 /nfs/dbraw/zinc/52/45/87/646524587.db2.gz HDHFVTKIZIWUNC-IHRRRGAJSA-N 2 0 245.370 2.319 20 0 BEADRP COC[C@H](C[NH2+][C@H]1CCCC[C@H]1C[NH3+])C(C)C ZINC000925875110 646526414 /nfs/dbraw/zinc/52/64/14/646526414.db2.gz ZRAWAQILYCUPEK-IHRRRGAJSA-N 2 0 242.407 2.012 20 0 BEADRP C[C@H](Cc1ccsc1)[NH2+]C[C@@H]1CC[C@H]([NH3+])C1 ZINC000925876079 646526691 /nfs/dbraw/zinc/52/66/91/646526691.db2.gz QODWHKNKUQQCAI-WZRBSPASSA-N 2 0 238.400 2.396 20 0 BEADRP Cc1ccc([C@H](C)[NH2+]C[C@@H]2CC[C@H]([NH3+])C2)o1 ZINC000925877315 646527270 /nfs/dbraw/zinc/52/72/70/646527270.db2.gz OGKWVMKMZSYYKH-TUAOUCFPSA-N 2 0 222.332 2.366 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[NH2+][C@@H](C2CC2)C2CCC2)C1 ZINC000925879515 646528612 /nfs/dbraw/zinc/52/86/12/646528612.db2.gz GNSOUGYPCZDSGN-ZLKJLUDKSA-N 2 0 222.376 2.282 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1CC[C@H]([NH3+])C1)[C@@H]1C[C@@H]1C ZINC000925879485 646529463 /nfs/dbraw/zinc/52/94/63/646529463.db2.gz FQYLSTPUVGBBGO-OFTGVCEQSA-N 2 0 210.365 2.138 20 0 BEADRP CC(C)[C@H]1CC[C@@H]1[NH2+]C[C@@H]1CC[C@H]([NH3+])C1 ZINC000925879398 646529686 /nfs/dbraw/zinc/52/96/86/646529686.db2.gz DAZMBEHVLPZDQW-XQHKEYJVSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H]([NH2+]CC1CCC=CCC1)[C@@H]1CC[NH2+]C1 ZINC000925882190 646529730 /nfs/dbraw/zinc/52/97/30/646529730.db2.gz ZAOBKIBRRGIIHT-TZMCWYRMSA-N 2 0 222.376 2.320 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[NH2+][C@H]2CCC[C@H]2CCF)C1 ZINC000925881148 646530394 /nfs/dbraw/zinc/53/03/94/646530394.db2.gz YECFMCUCLLOXDM-RVMXOQNASA-N 2 0 228.355 2.232 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[NH2+][C@H]2CC[C@H]2C2CCC2)C1 ZINC000925880611 646531033 /nfs/dbraw/zinc/53/10/33/646531033.db2.gz UONFVHAPIMJPRV-GHYVTOPFSA-N 2 0 222.376 2.282 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[NH2+][C@@H]2CC[C@H]2C2CCC2)C1 ZINC000925880609 646531513 /nfs/dbraw/zinc/53/15/13/646531513.db2.gz UONFVHAPIMJPRV-AHLTXXRQSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCc2nc[nH]c2C1)c1ccns1 ZINC000926451159 646641796 /nfs/dbraw/zinc/64/17/96/646641796.db2.gz WPBOFRKQLDPJQW-BDAKNGLRSA-N 2 0 248.355 2.074 20 0 BEADRP C[C@H](C[NH2+][C@@H](C)C1CC(F)(F)C1)C[NH+](C)C ZINC000926475778 646653880 /nfs/dbraw/zinc/65/38/80/646653880.db2.gz WRQLENAYLVIRRR-ZJUUUORDSA-N 2 0 234.334 2.208 20 0 BEADRP CC[C@H]([NH2+][C@H](C)CCCC[NH3+])[C@@H]1CCCOC1 ZINC000724008808 711555234 /nfs/dbraw/zinc/55/52/34/711555234.db2.gz MKPRTJDYRLBESJ-MCIONIFRSA-N 2 0 242.407 2.299 20 0 BEADRP CC[C@H]1CC[C@@H](C)[N@@H+]1CCC[NH2+]C1CC1 ZINC000136085702 711684196 /nfs/dbraw/zinc/68/41/96/711684196.db2.gz BPMBZLJZZDIQJM-YPMHNXCESA-N 2 0 210.365 2.391 20 0 BEADRP C[C@H](CCC1CC1)[NH2+]CC[C@@H]1C[NH2+]C[C@H]1C ZINC000722507737 711760163 /nfs/dbraw/zinc/76/01/63/711760163.db2.gz IFJVBYPHLJVSNU-YRGRVCCFSA-N 2 0 224.392 2.400 20 0 BEADRP CSC(C)(C)C[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000159987299 711805360 /nfs/dbraw/zinc/80/53/60/711805360.db2.gz FIDBJERYUMMKLC-NWDGAFQWSA-N 2 0 242.432 2.344 20 0 BEADRP CC1(C)C[C@]1(C)C[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000701986296 712035345 /nfs/dbraw/zinc/03/53/45/712035345.db2.gz NWLFNIWKRXJCNJ-DMDPSCGWSA-N 2 0 210.365 2.282 20 0 BEADRP CSC1CC([NH2+][C@H]2CC[N@@H+]3CCCC[C@H]23)C1 ZINC000706929181 712161700 /nfs/dbraw/zinc/16/17/00/712161700.db2.gz OTPLVKLXKORXCO-IFWUJCSASA-N 2 0 240.416 2.097 20 0 BEADRP CC(C)[C@H]1C[N@H+](CCC[NH2+]C2CC2)CCS1 ZINC000707165772 712165822 /nfs/dbraw/zinc/16/58/22/712165822.db2.gz DHNKKMKOMJGEKV-CYBMUJFWSA-N 2 0 242.432 2.202 20 0 BEADRP C(C[C@@H]1CCSC1)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000709351248 712220121 /nfs/dbraw/zinc/22/01/21/712220121.db2.gz LJGKBPOWFFJAPB-FKJOKYEKSA-N 2 0 240.416 2.002 20 0 BEADRP C[C@@H](C[N@@H+]1CC[C@@H](CC[NH3+])C1)C(C)(C)C ZINC000710719905 712255739 /nfs/dbraw/zinc/25/57/39/712255739.db2.gz RPJWQVQZNOSAAL-NWDGAFQWSA-N 2 0 212.381 2.339 20 0 BEADRP C[N@H+](CCCCCC[NH3+])C[C@H]1CC(C)(C)CO1 ZINC000710763706 712256579 /nfs/dbraw/zinc/25/65/79/712256579.db2.gz AHSFTEHKTGNAOY-CYBMUJFWSA-N 2 0 242.407 2.252 20 0 BEADRP C[C@H](C[N@@H+]1CC[C@H](CC[NH3+])C1)C(C)(C)C ZINC000710719904 712255821 /nfs/dbraw/zinc/25/58/21/712255821.db2.gz RPJWQVQZNOSAAL-NEPJUHHUSA-N 2 0 212.381 2.339 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1C=CCC1)[C@H]1CCCC[NH2+]1 ZINC000711719203 712319369 /nfs/dbraw/zinc/31/93/69/712319369.db2.gz LTDYEMPQCXLTDJ-YNEHKIRRSA-N 2 0 208.349 2.073 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@H]2C=CCC2)CC[N@@H+]1C ZINC000711666889 712318678 /nfs/dbraw/zinc/31/86/78/712318678.db2.gz JGDDTCREHRTUFF-FRRDWIJNSA-N 2 0 208.349 2.025 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1C[C@H]1C1CC1)[C@H]1CCC[NH2+]1 ZINC000712665804 712439894 /nfs/dbraw/zinc/43/98/94/712439894.db2.gz DTXWGOZTURQICB-AHLTXXRQSA-N 2 0 222.376 2.153 20 0 BEADRP C=C/C=C/CC[NH2+][C@H]1CC[NH2+]CC1(C)C ZINC000713464419 712460839 /nfs/dbraw/zinc/46/08/39/712460839.db2.gz JSGYHVNZIVNYSQ-FYJFLYSWSA-N 2 0 208.349 2.096 20 0 BEADRP C=C/C=C\CC[N@H+]1C[C@@H]2CCC[C@H]([NH3+])[C@H]2C1 ZINC000713741418 712471494 /nfs/dbraw/zinc/47/14/94/712471494.db2.gz UNIIIYURTYLSOC-JJVDHKILSA-N 2 0 220.360 2.178 20 0 BEADRP CC1(C)CCC[C@H](CN2CCCC[C@H]2C[NH3+])O1 ZINC000714332676 712482169 /nfs/dbraw/zinc/48/21/69/712482169.db2.gz XOONDTDWMVOKRK-QWHCGFSZSA-N 2 0 240.391 2.147 20 0 BEADRP C[C@H]([NH3+])[C@H]1CC[N@H+](C[C@H]2CCCC(C)(C)O2)C1 ZINC000714375371 712484656 /nfs/dbraw/zinc/48/46/56/712484656.db2.gz UFDZXQYYZGCQHZ-RWMBFGLXSA-N 2 0 240.391 2.003 20 0 BEADRP C[NH+]1CCC(C[NH2+]CC[C@@H]2CCCS2)CC1 ZINC000715784375 712532527 /nfs/dbraw/zinc/53/25/27/712532527.db2.gz VAMZVHLCKKPPJD-ZDUSSCGKSA-N 2 0 242.432 2.204 20 0 BEADRP C[C@@H]([NH2+]CCCCC1CC1)[C@@H]1CCC[NH2+]1 ZINC000716371508 712556817 /nfs/dbraw/zinc/55/68/17/712556817.db2.gz XJKORCAWCURDGN-YPMHNXCESA-N 2 0 210.365 2.297 20 0 BEADRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]CCCCC1CC1 ZINC000716412072 712559111 /nfs/dbraw/zinc/55/91/11/712559111.db2.gz GOOWIQICFNLJSZ-OLZOCXBDSA-N 2 0 210.365 2.284 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CC[C@@H]1CC(C)(C)CO1 ZINC000717291425 712645445 /nfs/dbraw/zinc/64/54/45/712645445.db2.gz JVMNOSJANFULTC-CHWSQXEVSA-N 2 0 242.407 2.299 20 0 BEADRP CC(F)(F)CCC[N@@H+]1CCC[C@@H](C[NH3+])C1 ZINC000718570711 712775161 /nfs/dbraw/zinc/77/51/61/712775161.db2.gz KKNRIBJQRJOSPO-JTQLQIEISA-N 2 0 220.307 2.093 20 0 BEADRP COCC(C)(C)CC[NH2+][C@H]1CCCC[C@@H]1C[NH3+] ZINC000718668908 712776857 /nfs/dbraw/zinc/77/68/57/712776857.db2.gz YWBVHJRVHODQQG-OLZOCXBDSA-N 2 0 242.407 2.156 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC2(C)CC(F)(F)C2)CC[N@@H+]1C ZINC000720934282 712879947 /nfs/dbraw/zinc/87/99/47/712879947.db2.gz FUVCJNYCPMLIEE-GHMZBOCLSA-N 2 0 246.345 2.494 20 0 BEADRP C[C@H]1[C@@H](C)[N@@H+](CCC2CC[NH2+]CC2)C[C@H]1C ZINC000399640132 1166247967 /nfs/dbraw/zinc/24/79/67/1166247967.db2.gz XFCSWCROQSJSNW-JHJVBQTASA-N 2 0 224.392 2.352 20 0 BEADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CC[C@H]2C)C1 ZINC000381531625 710651173 /nfs/dbraw/zinc/65/11/73/710651173.db2.gz ZIPXNWAKXMKKGR-MGPQQGTHSA-N 2 0 224.392 2.495 20 0 BEADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H]2CC[C@H]2C)C1 ZINC000381531623 710651523 /nfs/dbraw/zinc/65/15/23/710651523.db2.gz ZIPXNWAKXMKKGR-HZSPNIEDSA-N 2 0 224.392 2.495 20 0 BEADRP CC/C=C/C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000384830621 710998533 /nfs/dbraw/zinc/99/85/33/710998533.db2.gz GTVIBDOPYJZRDY-HSRIHCBGSA-N 2 0 208.349 2.167 20 0 BEADRP CC[C@@H]1[C@H](C)CC[N@@H+]1C[C@@H]1CC[C@H]([NH3+])C1 ZINC000384027251 710987943 /nfs/dbraw/zinc/98/79/43/710987943.db2.gz ZADJYYRMRJDQRX-FVCCEPFGSA-N 2 0 210.365 2.234 20 0 BEADRP C(C[NH2+]C1CC1)C[N@@H+]1[C@H]2CC[C@@H]1CCC2 ZINC000380668795 712902267 /nfs/dbraw/zinc/90/22/67/712902267.db2.gz KHAIKQRZRLTUNQ-BETUJISGSA-N 2 0 208.349 2.145 20 0 BEADRP C[C@H]1CCSCC[N@@H+]1C[C@@]1(C)CCC[NH2+]C1 ZINC000385583962 711014833 /nfs/dbraw/zinc/01/48/33/711014833.db2.gz XYKQVEMFCLBLRE-STQMWFEESA-N 2 0 242.432 2.204 20 0 BEADRP C([NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2)C(C1CC1)C1CC1 ZINC000385586986 711014870 /nfs/dbraw/zinc/01/48/70/711014870.db2.gz HFRKBDVSGKOVED-RDUHTLEXSA-N 2 0 246.398 2.009 20 0 BEADRP C([NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32)C(C1CC1)C1CC1 ZINC000385586987 711015344 /nfs/dbraw/zinc/01/53/44/711015344.db2.gz HFRKBDVSGKOVED-UNPMEBSKSA-N 2 0 246.398 2.009 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000389618886 711083733 /nfs/dbraw/zinc/08/37/33/711083733.db2.gz HVAMZKZPMZIBPM-LPWJVIDDSA-N 2 0 210.365 2.247 20 0 BEADRP CC[N@H+](C[C@@H]1CC[C@H]([NH3+])C1)[C@H](C)C(C)C ZINC000390503923 711121478 /nfs/dbraw/zinc/12/14/78/711121478.db2.gz WBNIYYCVGDYJTA-UPJWGTAASA-N 2 0 212.381 2.480 20 0 BEADRP CC(C)C[NH+]1CCC([NH2+][C@@H]2CC[C@H]2C)CC1 ZINC000390575065 711126433 /nfs/dbraw/zinc/12/64/33/711126433.db2.gz OFFLJHHPHXMFML-TZMCWYRMSA-N 2 0 224.392 2.495 20 0 BEADRP C[N@H+]1CC=C(C[NH2+]CC2(C)CCCC2)CC1 ZINC000392784545 711152599 /nfs/dbraw/zinc/15/25/99/711152599.db2.gz UDPLZGJKNJNFSE-UHFFFAOYSA-N 2 0 222.376 2.418 20 0 BEADRP COC(C)(C)[C@@H](C)[NH2+][C@H](C)C1CC[NH+](C)CC1 ZINC000396445652 711221081 /nfs/dbraw/zinc/22/10/81/711221081.db2.gz PGFDGRJHNLQOMX-VXGBXAGGSA-N 2 0 242.407 2.120 20 0 BEADRP C[C@H](CCC1CC1)[NH2+][C@@H]1[C@H]2C[C@H]3C[NH2+][C@H]1[C@H]3C2 ZINC000398175804 711404292 /nfs/dbraw/zinc/40/42/92/711404292.db2.gz VULDHNKVSKILSK-BBAYZTIDSA-N 2 0 234.387 2.151 20 0 BEADRP C[C@H](CCC1CC1)[NH2+][C@H]1[C@@H]2[NH2+]C[C@@H]3C[C@H]1C[C@@H]32 ZINC000398175815 711404446 /nfs/dbraw/zinc/40/44/46/711404446.db2.gz VULDHNKVSKILSK-PCTWNACOSA-N 2 0 234.387 2.151 20 0 BEADRP CC[C@@H]1C[C@H](C)C[N@@H+]1C[C@@H]1CC[C@H]([NH3+])C1 ZINC000399145564 711422392 /nfs/dbraw/zinc/42/23/92/711422392.db2.gz DKTBHRPLVKANDO-QNWHQSFQSA-N 2 0 210.365 2.234 20 0 BEADRP CNc1ccc(C)cc1C[NH2+][C@@H](C)CC[NH+](C)C ZINC000902132452 710879475 /nfs/dbraw/zinc/87/94/75/710879475.db2.gz LBTJQNHNIQPSNT-ZDUSSCGKSA-N 2 0 249.402 2.467 20 0 BEADRP C[C@@H](CC[NH3+])[NH2+]Cc1cnc2ccccc2c1 ZINC000383193131 710979240 /nfs/dbraw/zinc/97/92/40/710979240.db2.gz SISMSHLCOSICRB-NSHDSACASA-N 2 0 229.327 2.062 20 0 BEADRP CC[C@H]1[C@@H](C)CC[N@@H+]1CCC[NH2+]C1CC1 ZINC000383629483 710984824 /nfs/dbraw/zinc/98/48/24/710984824.db2.gz VPBUXESKMDTAMC-AAEUAGOBSA-N 2 0 210.365 2.249 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@H+](C)CC[C@H]([NH3+])C(C)C ZINC000723082413 711501122 /nfs/dbraw/zinc/50/11/22/711501122.db2.gz YZUQQZHXUVDJBV-AGIUHOORSA-N 2 0 212.381 2.338 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1CCCC[C@@H]1CC[NH3+] ZINC000723081288 711501210 /nfs/dbraw/zinc/50/12/10/711501210.db2.gz UIEBQOGSYPRRCZ-FRRDWIJNSA-N 2 0 210.365 2.236 20 0 BEADRP CC[NH2+]CC1CC[NH+](C[C@@H]2C[C@H]2CC)CC1 ZINC000723087379 711501460 /nfs/dbraw/zinc/50/14/60/711501460.db2.gz FIPHGAHREPVTQG-KGLIPLIRSA-N 2 0 224.392 2.354 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1CCC[C@@H]([C@H]2CCC[NH2+]2)C1 ZINC000723132744 711506580 /nfs/dbraw/zinc/50/65/80/711506580.db2.gz CMXYLIOAFQATHT-APIJFGDWSA-N 2 0 236.403 2.497 20 0 BEADRP CCc1ccccc1C[N@@H+]1CC[C@@H](CC[NH3+])C1 ZINC000723670058 711532992 /nfs/dbraw/zinc/53/29/92/711532992.db2.gz NUBIUVPKHFTHBR-CYBMUJFWSA-N 2 0 232.371 2.420 20 0 BEADRP Cc1cccc(C[N@@H+]2CC[C@H](CC[NH3+])C2)c1C ZINC000723670466 711533036 /nfs/dbraw/zinc/53/30/36/711533036.db2.gz SNMFTLVJICEKDX-AWEZNQCLSA-N 2 0 232.371 2.474 20 0 BEADRP CCOc1cccc(C[N@@H+]2CC[C@H](CC[NH3+])C2)c1 ZINC000723690148 711533914 /nfs/dbraw/zinc/53/39/14/711533914.db2.gz MLQPVVYUKPPMGI-ZDUSSCGKSA-N 2 0 248.370 2.256 20 0 BEADRP C[C@H](c1ccccn1)[N@@H+]1C[C@@H](C)[C@H](CC[NH3+])C1 ZINC000723891848 711544032 /nfs/dbraw/zinc/54/40/32/711544032.db2.gz OMSAPIJMLRVVPH-JHJVBQTASA-N 2 0 233.359 2.059 20 0 BEADRP C[C@@H](c1cccnc1)[N@@H+]1C[C@@H](C)[C@H](CC[NH3+])C1 ZINC000723892584 711544258 /nfs/dbraw/zinc/54/42/58/711544258.db2.gz SCZOCLUOTOVCOU-MBNYWOFBSA-N 2 0 233.359 2.059 20 0 BEADRP Cc1ccsc1C[N@H+]1C[C@@H](C)[C@H](CC[NH3+])C1 ZINC000723892265 711544295 /nfs/dbraw/zinc/54/42/95/711544295.db2.gz VRKBFHBOBZXXRT-VXGBXAGGSA-N 2 0 238.400 2.473 20 0 BEADRP CCCC1(C[NH2+][C@H]2[C@@H]3[NH2+]C[C@H]4C[C@H]2C[C@H]34)CC1 ZINC000383303502 711550602 /nfs/dbraw/zinc/55/06/02/711550602.db2.gz MIHZRTRDDSDZET-MEBFFEOJSA-N 2 0 234.387 2.153 20 0 BEADRP CC[C@@H]([NH2+]CCCC[NH+](C)C)[C@@H]1CCCOC1 ZINC000724006215 711554595 /nfs/dbraw/zinc/55/45/95/711554595.db2.gz JRUMKVVNSBAQOG-ZIAGYGMSSA-N 2 0 242.407 2.123 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]CCC2CC=CC2)C1 ZINC000724201125 711569150 /nfs/dbraw/zinc/56/91/50/711569150.db2.gz STROWWKLOHOURW-STQMWFEESA-N 2 0 208.349 2.202 20 0 BEADRP C1=CCC(CC[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000724199799 711569200 /nfs/dbraw/zinc/56/92/00/711569200.db2.gz IOMIZDJVWJWWDK-PBWFPOADSA-N 2 0 220.360 2.215 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CCC1CC=CC1 ZINC000724209491 711570483 /nfs/dbraw/zinc/57/04/83/711570483.db2.gz WQKGFHYTKNEEQS-LBPRGKRZSA-N 2 0 210.365 2.450 20 0 BEADRP CCc1ccccc1C[N@@H+]1CC[C@H](C[NH3+])C1 ZINC000052204671 711607664 /nfs/dbraw/zinc/60/76/64/711607664.db2.gz MXNRFBFMXMYBMP-GFCCVEGCSA-N 2 0 218.344 2.030 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH+]1CCC(F)(C2CC2)CC1 ZINC000724806398 711616113 /nfs/dbraw/zinc/61/61/13/711616113.db2.gz KVXADIYZSUQLDV-NEPJUHHUSA-N 2 0 240.366 2.056 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]CC2CCC(F)CC2)C12CCC2 ZINC000925711286 711711436 /nfs/dbraw/zinc/71/14/36/711711436.db2.gz LYIQHEJDUNLJEV-TUUUFIMRSA-N 2 0 240.366 2.374 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+][C@@H]1CCCC12CC2 ZINC000925723860 711727559 /nfs/dbraw/zinc/72/75/59/711727559.db2.gz CMMYHXLGZJDZQN-NFMDPKQHSA-N 2 0 234.387 2.425 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@H](c2ccccn2)C2CC2)C1 ZINC000925821452 711756186 /nfs/dbraw/zinc/75/61/86/711756186.db2.gz JGYRCOZNAFYDMZ-IPYPFGDCSA-N 2 0 245.370 2.392 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+][C@H]1CCC1(C)C ZINC000722509457 711760253 /nfs/dbraw/zinc/76/02/53/711760253.db2.gz UNQNEQRIWHXULR-UTUOFQBUSA-N 2 0 210.365 2.010 20 0 BEADRP CCC(CC)C[NH2+]CC[C@@H]1C[NH2+]C[C@H]1C ZINC000722509580 711760261 /nfs/dbraw/zinc/76/02/61/711760261.db2.gz WBXOGPUHRDTXHC-DGCLKSJQSA-N 2 0 212.381 2.258 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]CCCCCCO)c2ccccc21 ZINC000236303296 711761524 /nfs/dbraw/zinc/76/15/24/711761524.db2.gz NGRDHUCKRKXIIA-HUUCEWRRSA-N 2 0 248.370 2.274 20 0 BEADRP C[C@@H]([NH2+]C[C@]12C[C@H]1CCC2)[C@H]1CCCC[NH2+]1 ZINC000925879810 711761884 /nfs/dbraw/zinc/76/18/84/711761884.db2.gz CNLCJTIYFZOPSW-SYQHCUMBSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]([NH2+]C[C@]12C[C@H]1CCC2)[C@@H]1CCCC[NH2+]1 ZINC000925879809 711761967 /nfs/dbraw/zinc/76/19/67/711761967.db2.gz CNLCJTIYFZOPSW-MQYQWHSLSA-N 2 0 222.376 2.297 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H]1CC[C@H]([NH3+])C1)c1ccncc1 ZINC000925879741 711762076 /nfs/dbraw/zinc/76/20/76/711762076.db2.gz JNTMQKGCSSKQNC-KWCYVHTRSA-N 2 0 233.359 2.250 20 0 BEADRP [NH3+]C[C@H]1CC[N@H+](Cc2cc3ccccc3o2)C1 ZINC000050245181 711789140 /nfs/dbraw/zinc/78/91/40/711789140.db2.gz KVPHBMNUXOBWQQ-LLVKDONJSA-N 2 0 230.311 2.213 20 0 BEADRP [NH3+]CC[C@@H]1CC[N@H+](Cc2ccc3c(c2)CCC3)C1 ZINC000125511059 711794301 /nfs/dbraw/zinc/79/43/01/711794301.db2.gz KMFXUTQRKPQGMA-CYBMUJFWSA-N 2 0 244.382 2.346 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[N@@H+]2CCOc3ccccc3C2)C1 ZINC000227802569 711832948 /nfs/dbraw/zinc/83/29/48/711832948.db2.gz WTENUTPPORALLC-GXTWGEPZSA-N 2 0 246.354 2.008 20 0 BEADRP CC(C)C1(C[NH2+][C@@H]2CCC[C@H]2C[NH3+])CC1 ZINC000232721292 711845548 /nfs/dbraw/zinc/84/55/48/711845548.db2.gz COTHKTSTCQJBRA-NWDGAFQWSA-N 2 0 210.365 2.140 20 0 BEADRP CC1(C)CC(C[N@@H+]2CC[C@@]3(C2)CCC[NH2+]C3)C1 ZINC000530219201 711937910 /nfs/dbraw/zinc/93/79/10/711937910.db2.gz OPDSMGFERGUNJT-HNNXBMFYSA-N 2 0 236.403 2.498 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000530216026 711938059 /nfs/dbraw/zinc/93/80/59/711938059.db2.gz LYDPGWVAMMGFGG-RWMBFGLXSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@@H](C[N@@H+]1CCCO[C@H](C[NH3+])C1)CC(C)(C)C ZINC000709179873 711978127 /nfs/dbraw/zinc/97/81/27/711978127.db2.gz VCHZTLBBVNVQNA-CHWSQXEVSA-N 2 0 242.407 2.108 20 0 BEADRP CSCC[C@H](C)[N@H+](C)C[C@H]1CCCC[NH2+]C1 ZINC000700402476 711992446 /nfs/dbraw/zinc/99/24/46/711992446.db2.gz CFZNAAFXTJZHGK-STQMWFEESA-N 2 0 244.448 2.450 20 0 BEADRP CSCC[C@@H](C)[N@H+](C)C[C@@H]1CCCC[NH2+]C1 ZINC000700402469 711992532 /nfs/dbraw/zinc/99/25/32/711992532.db2.gz CFZNAAFXTJZHGK-CHWSQXEVSA-N 2 0 244.448 2.450 20 0 BEADRP C[C@H](CC[NH2+]C[C@@H]1CC[C@H]2C[C@H]2C1)[NH+](C)C ZINC000700472536 711994318 /nfs/dbraw/zinc/99/43/18/711994318.db2.gz RZYAQXOLIMBXQO-YIYPIFLZSA-N 2 0 224.392 2.352 20 0 BEADRP CSC(C)(C)CC[NH2+]CC[C@H](C)[NH+](C)C ZINC000700476526 711994435 /nfs/dbraw/zinc/99/44/35/711994435.db2.gz HGKOOIHSDGNNOP-NSHDSACASA-N 2 0 232.437 2.448 20 0 BEADRP C[C@H](CC[NH2+][C@H]1CCOC2(CCC2)C1)[NH+](C)C ZINC000700604727 712001281 /nfs/dbraw/zinc/00/12/81/712001281.db2.gz DSSNQQFXIJRZNK-OLZOCXBDSA-N 2 0 240.391 2.018 20 0 BEADRP CC[C@](C)([NH2+]CC1CC[NH+](C)CC1)C1CC1 ZINC000701074784 712013615 /nfs/dbraw/zinc/01/36/15/712013615.db2.gz HYOSOIBCEMYUPD-AWEZNQCLSA-N 2 0 224.392 2.497 20 0 BEADRP CC1(C)C[C@]1(C)C[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000701986300 712035268 /nfs/dbraw/zinc/03/52/68/712035268.db2.gz NWLFNIWKRXJCNJ-GMXVVIOVSA-N 2 0 210.365 2.282 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@]2(C)CC2(C)C)CC1 ZINC000702019934 712036781 /nfs/dbraw/zinc/03/67/81/712036781.db2.gz XGFNFPSRIBAZAZ-CYBMUJFWSA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)C[C@H](C)C[N@@H+]1C[C@@H]2C[NH2+]C[C@]2(C)C1 ZINC000702054621 712037271 /nfs/dbraw/zinc/03/72/71/712037271.db2.gz YDSQZDMTDHDZLW-MELADBBJSA-N 2 0 224.392 2.210 20 0 BEADRP C[C@]12C[NH2+]C[C@H]1C[N@H+](CCCc1ccccc1)C2 ZINC000702104033 712039029 /nfs/dbraw/zinc/03/90/29/712039029.db2.gz IRXMOXCRMOAZRW-JKSUJKDBSA-N 2 0 244.382 2.161 20 0 BEADRP C(C[NH2+]C1CC1)C[N@@H+]1CCCC2(CC2)CC1 ZINC000702542378 712055115 /nfs/dbraw/zinc/05/51/15/712055115.db2.gz FSJJKDOTKPIHSE-UHFFFAOYSA-N 2 0 222.376 2.395 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[N@@H+]2CCCC(F)(F)CC2)C1 ZINC000702813997 712061294 /nfs/dbraw/zinc/06/12/94/712061294.db2.gz XPCXKHZGWNBQGC-WDEREUQCSA-N 2 0 232.318 2.235 20 0 BEADRP C[C@@H]1CCCC[N@H+](C[C@@H]2CCCC[NH2+]C2)C1 ZINC000703211909 712068322 /nfs/dbraw/zinc/06/83/22/712068322.db2.gz HRWDVYVROHUVLB-ZIAGYGMSSA-N 2 0 224.392 2.498 20 0 BEADRP CCC[C@@H]1CCCC[N@@H+]1C[C@H]1C[C@@H]([NH3+])C1 ZINC000703447521 712075835 /nfs/dbraw/zinc/07/58/35/712075835.db2.gz LVZWXAISRKHMIO-FRRDWIJNSA-N 2 0 210.365 2.378 20 0 BEADRP C[C@@H]1CCC[N@@H+]1CC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000703804424 712088408 /nfs/dbraw/zinc/08/84/08/712088408.db2.gz GHLFIXXZWFNYSY-ODWCKFRGSA-N 2 0 208.349 2.001 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CCSC1)[C@@H]1CCCC[NH2+]1 ZINC000704777800 712116574 /nfs/dbraw/zinc/11/65/74/712116574.db2.gz VKZNJWIWFXPVHS-XQQFMLRXSA-N 2 0 242.432 2.250 20 0 BEADRP CC[NH+]1CCC([NH2+]CC[C@H]2CCSC2)CC1 ZINC000704797539 712117652 /nfs/dbraw/zinc/11/76/52/712117652.db2.gz NRKPWWPDCSJVAH-LBPRGKRZSA-N 2 0 242.432 2.204 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]CCC2(F)CCC2)C12CCC2 ZINC000705282020 712126966 /nfs/dbraw/zinc/12/69/66/712126966.db2.gz XINIDPRJMIMLHU-QWRGUYRKSA-N 2 0 226.339 2.128 20 0 BEADRP FC1(F)CCC[N@H+](C[C@@H]2CCCC[NH2+]C2)CC1 ZINC000705778102 712137191 /nfs/dbraw/zinc/13/71/91/712137191.db2.gz IESPMSQIPFJEIO-GFCCVEGCSA-N 2 0 246.345 2.497 20 0 BEADRP C[C@H]1CC[C@H](C)[NH+]1CC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000706457207 712145255 /nfs/dbraw/zinc/14/52/55/712145255.db2.gz UKENNZSHKZRQLD-WSOGJNRSSA-N 2 0 222.376 2.390 20 0 BEADRP CC[N@H+](C[C@@H]1C[NH2+]C[C@H]1C)[C@@H](C)C(C)C ZINC000706480995 712147178 /nfs/dbraw/zinc/14/71/78/712147178.db2.gz NVXUFOSJNOKPMN-AGIUHOORSA-N 2 0 212.381 2.208 20 0 BEADRP CC1(C)CC(C[NH2+][C@H]2[C@@H]3[NH2+]C[C@@H]4C[C@H]2C[C@@H]43)C1 ZINC000706525867 712149121 /nfs/dbraw/zinc/14/91/21/712149121.db2.gz PRVULDUNIZVYQY-QSLWVIQJSA-N 2 0 234.387 2.009 20 0 BEADRP CC1(C)CC(C[NH2+][C@H]2[C@@H]3[NH2+]C[C@H]4C[C@H]2C[C@H]34)C1 ZINC000706525861 712149304 /nfs/dbraw/zinc/14/93/04/712149304.db2.gz PRVULDUNIZVYQY-MEBFFEOJSA-N 2 0 234.387 2.009 20 0 BEADRP C[NH+]1CCC(C[NH2+]C[C@H]2CCCC23CC3)CC1 ZINC000707100138 712164739 /nfs/dbraw/zinc/16/47/39/712164739.db2.gz IQHMXOTUEGPVDZ-CQSZACIVSA-N 2 0 236.403 2.498 20 0 BEADRP C[C@@H]1[C@H]2CC[C@@H](C[C@@H]1[NH2+][C@@H]1CC13CCCC3)[NH2+]2 ZINC000709389788 712220905 /nfs/dbraw/zinc/22/09/05/712220905.db2.gz SPWJAIZIYQRGNT-XHJNMGKDSA-N 2 0 234.387 2.438 20 0 BEADRP C[C@@H]1[C@H]2CC[C@@H](C[C@H]1[NH2+]C1CCCCC1)[NH2+]2 ZINC000709432886 712221767 /nfs/dbraw/zinc/22/17/67/712221767.db2.gz FSUALWQUPCACLV-YXCITZCRSA-N 2 0 222.376 2.438 20 0 BEADRP C[C@@H]1[C@H]2CC[C@@H](C[C@@H]1[NH2+][C@H]1CCC1(C)C)[NH2+]2 ZINC000709433550 712221806 /nfs/dbraw/zinc/22/18/06/712221806.db2.gz HEMYZISDQRNYFC-FHUSYTEZSA-N 2 0 222.376 2.294 20 0 BEADRP [NH3+][C@@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1cccc(F)c1)C2 ZINC000709835220 712229291 /nfs/dbraw/zinc/22/92/91/712229291.db2.gz HYHDLQRWDBBAPV-YUTCNCBUSA-N 2 0 234.318 2.137 20 0 BEADRP [NH3+][C@@H]1C[C@H]2C[C@@H](C1)[N@H+](C[C@@H]1CC[C@@H]3C[C@@H]3C1)C2 ZINC000709862450 712229783 /nfs/dbraw/zinc/22/97/83/712229783.db2.gz NIKZKNRVMNGQPH-DXUDUQDWSA-N 2 0 234.387 2.234 20 0 BEADRP C1=CCC(C[N@@H+]2CC[C@]3(C2)CCC[NH2+]C3)C1 ZINC000709919933 712232517 /nfs/dbraw/zinc/23/25/17/712232517.db2.gz OAGSLJOBUOKMOK-CQSZACIVSA-N 2 0 220.360 2.028 20 0 BEADRP C[C@H](CC1CCC1)[NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2 ZINC000710271215 712250191 /nfs/dbraw/zinc/25/01/91/712250191.db2.gz JONRCCHLISUANM-RAIGVLPGSA-N 2 0 222.376 2.425 20 0 BEADRP C[N@H+](CCCCCC[NH3+])Cc1cccc(O)c1 ZINC000710713826 712254757 /nfs/dbraw/zinc/25/47/57/712254757.db2.gz LASNPXYPKKBRSS-UHFFFAOYSA-N 2 0 236.359 2.343 20 0 BEADRP C[C@H](CC[NH2+][C@H]1C[C@@H]2CC[C@@H](C2)C1)[NH+](C)C ZINC000710931260 712266007 /nfs/dbraw/zinc/26/60/07/712266007.db2.gz QINSFXWXPNBOSZ-MQYQWHSLSA-N 2 0 224.392 2.495 20 0 BEADRP FC[C@H]1CCC[N@H+](CC2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000711442186 712300907 /nfs/dbraw/zinc/30/09/07/712300907.db2.gz IORZAUXUQBILBP-RLAWYHOSSA-N 2 0 240.366 2.199 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]C[C@H]1C=CCC1 ZINC000711670431 712316037 /nfs/dbraw/zinc/31/60/37/712316037.db2.gz VGTOVEJDAHSAHF-AVGNSLFASA-N 2 0 208.349 2.060 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C[C@H]2C=CCC2)CC[N@@H+]1C ZINC000711666887 712318687 /nfs/dbraw/zinc/31/86/87/712318687.db2.gz JGDDTCREHRTUFF-AGIUHOORSA-N 2 0 208.349 2.025 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C=CCC1)[C@@H]1CCCC[NH2+]1 ZINC000711719198 712319173 /nfs/dbraw/zinc/31/91/73/712319173.db2.gz LTDYEMPQCXLTDJ-AVGNSLFASA-N 2 0 208.349 2.073 20 0 BEADRP C1=C[C@H](C[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)CC1 ZINC000711719517 712319205 /nfs/dbraw/zinc/31/92/05/712319205.db2.gz NLZVNXMHPCJCER-MJBXVCDLSA-N 2 0 220.360 2.169 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1C=CCC1)[C@@H]1CCCC[NH2+]1 ZINC000711719201 712319583 /nfs/dbraw/zinc/31/95/83/712319583.db2.gz LTDYEMPQCXLTDJ-XQQFMLRXSA-N 2 0 208.349 2.073 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C=CCC1)C1CC[NH+](C)CC1 ZINC000711725534 712322129 /nfs/dbraw/zinc/32/21/29/712322129.db2.gz AWOXHUWLBLFUKF-STQMWFEESA-N 2 0 222.376 2.273 20 0 BEADRP CC[C@@H]1CCCN(C[C@H]([NH3+])CC(F)F)C1 ZINC000379783102 712398773 /nfs/dbraw/zinc/39/87/73/712398773.db2.gz GUGLZUIIEOBDGJ-NXEZZACHSA-N 2 0 220.307 2.091 20 0 BEADRP C[C@H]1CC[C@@H]1[NH2+]CCCCn1ccnc1 ZINC000379780211 712398754 /nfs/dbraw/zinc/39/87/54/712398754.db2.gz BZXSKLAPOGMFBU-RYUDHWBXSA-N 2 0 207.321 2.051 20 0 BEADRP C([C@H]1CCC[NH2+]1)N1CCC2(CCCC2)C1 ZINC000379782588 712398839 /nfs/dbraw/zinc/39/88/39/712398839.db2.gz OJRVDPPPHPFYLG-GFCCVEGCSA-N 2 0 208.349 2.005 20 0 BEADRP C[C@@H]1CCCN1CC[NH2+][C@@H]1CC[C@@H]1C1CC1 ZINC000390436037 712417222 /nfs/dbraw/zinc/41/72/22/712417222.db2.gz SDWLKFGTJPNAOF-MRVWCRGKSA-N 2 0 222.376 2.249 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+][C@@H]2C[C@@H]3CCCC[C@H]23)C1 ZINC000712370884 712428180 /nfs/dbraw/zinc/42/81/80/712428180.db2.gz ANJWLCCQJNMVLR-PDWCTOEPSA-N 2 0 222.376 2.425 20 0 BEADRP [NH3+]C[C@H]1CCC[C@H]1[NH2+][C@@H]1C[C@@H]2CCCC[C@H]12 ZINC000712378709 712428706 /nfs/dbraw/zinc/42/87/06/712428706.db2.gz RHUPXNVQXLIWRY-MEBFFEOJSA-N 2 0 222.376 2.282 20 0 BEADRP CC[N@@H+]1CC[C@H]1CNc1cc[nH+]c2ccccc12 ZINC000712594797 712436070 /nfs/dbraw/zinc/43/60/70/712436070.db2.gz MIXQZSRHFHXZSW-LBPRGKRZSA-N 2 0 241.338 2.163 20 0 BEADRP C[C@H]1C[C@@H]([NH3+])CC[N@@H+]1CC[C@@H]1C[C@H]1C1CC1 ZINC000712692081 712448264 /nfs/dbraw/zinc/44/82/64/712448264.db2.gz IETXOMSSCWPXKB-GHYVTOPFSA-N 2 0 222.376 2.234 20 0 BEADRP C[C@H]1C[C@H]([NH3+])CC[N@@H+]1CC[C@@H]1C[C@H]1C1CC1 ZINC000712692079 712448317 /nfs/dbraw/zinc/44/83/17/712448317.db2.gz IETXOMSSCWPXKB-ASEORRQLSA-N 2 0 222.376 2.234 20 0 BEADRP C=C/C=C\CC[N@H+]1CCC[C@H]([C@@H](C)[NH3+])C1 ZINC000713700478 712469324 /nfs/dbraw/zinc/46/93/24/712469324.db2.gz CENYBCZWMXCIQY-CIUCYMIDSA-N 2 0 208.349 2.178 20 0 BEADRP CC1(C)CCC[C@@H](C[NH+]2CCC(C[NH3+])CC2)O1 ZINC000714376181 712485054 /nfs/dbraw/zinc/48/50/54/712485054.db2.gz XSEGAKCDQCTQPX-ZDUSSCGKSA-N 2 0 240.391 2.005 20 0 BEADRP CC[C@H](C)[NH+]1CCC(C(C)(C)C[NH3+])CC1 ZINC000714408195 712485733 /nfs/dbraw/zinc/48/57/33/712485733.db2.gz CCEYQEHXVGBACQ-NSHDSACASA-N 2 0 212.381 2.482 20 0 BEADRP CC(C)C1CC([NH2+][C@@H](C)C2CC[NH2+]CC2)C1 ZINC000714621379 712488887 /nfs/dbraw/zinc/48/88/87/712488887.db2.gz YVFIQICDOCFPJA-XGNXJENSSA-N 2 0 224.392 2.399 20 0 BEADRP CC[C@H]1C[N@H+](CCCCCCC[NH3+])CCO1 ZINC000036770112 712494614 /nfs/dbraw/zinc/49/46/14/712494614.db2.gz NANGEKXMUDYCNI-ZDUSSCGKSA-N 2 0 228.380 2.006 20 0 BEADRP CCC1([NH3+])CC[NH+]([C@H](C)C2CCC2)CC1 ZINC000714754812 712498009 /nfs/dbraw/zinc/49/80/09/712498009.db2.gz XZBSJVXWVRWMQY-LLVKDONJSA-N 2 0 210.365 2.378 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CCC[N@H+](CC[C@@H]2C[C@H]2C2CC2)C1 ZINC000714815057 712500880 /nfs/dbraw/zinc/50/08/80/712500880.db2.gz YYAJOPGHISXIEK-MYPMTAMASA-N 2 0 236.403 2.482 20 0 BEADRP [NH3+]CC[C@@H]1CC[N@H+](CC[C@@H]2C[C@H]2C2CC2)C1 ZINC000714868837 712502351 /nfs/dbraw/zinc/50/23/51/712502351.db2.gz YTLSNHHSWTYGFA-BNOWGMLFSA-N 2 0 222.376 2.093 20 0 BEADRP C[NH2+]C[C@@H]1CCC[N@H+](CC[C@@H]2C[C@H]2C2CC2)C1 ZINC000714866278 712502610 /nfs/dbraw/zinc/50/26/10/712502610.db2.gz PVSLYSYNIYFFQU-CFVMTHIKSA-N 2 0 236.403 2.354 20 0 BEADRP C(C[N@@H+]1CCC2(C1)CC[NH2+]CC2)[C@@H]1C[C@H]1C1CC1 ZINC000714873855 712502635 /nfs/dbraw/zinc/50/26/35/712502635.db2.gz XIQNMHSQJSBMDV-CABCVRRESA-N 2 0 248.414 2.498 20 0 BEADRP CO[C@@H](C)[C@H](C)[NH2+]C1CCC(C)([NH+](C)C)CC1 ZINC000715511216 712524258 /nfs/dbraw/zinc/52/42/58/712524258.db2.gz UMFHELYOPGRIFD-FEPKRQSRSA-N 2 0 242.407 2.262 20 0 BEADRP C[NH+](C)C1(C)CCC([NH2+]Cc2cccnc2)CC1 ZINC000715511929 712524330 /nfs/dbraw/zinc/52/43/30/712524330.db2.gz YFICUVNIAPWBQC-UHFFFAOYSA-N 2 0 247.386 2.434 20 0 BEADRP CO[C@H]1CCC[C@H]1[NH2+]C1CCC([NH+](C)C)CC1 ZINC000715551266 712528398 /nfs/dbraw/zinc/52/83/98/712528398.db2.gz HEFBLDNYNAFDHX-PQAZSJQKSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]C2CCC(C)([NH+](C)C)CC2)CO1 ZINC000715569349 712529164 /nfs/dbraw/zinc/52/91/64/712529164.db2.gz APVRRMDCMLLDDL-RJZJGCCBSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C[NH2+][C@@H]1CCCC[C@@H]1C[NH3+] ZINC000716582886 712564082 /nfs/dbraw/zinc/56/40/82/712564082.db2.gz LQJUIPGNIIESLH-PLJUSGQGSA-N 2 0 236.403 2.386 20 0 BEADRP C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C[NH2+][C@H]1CCCC[C@H]1C[NH3+] ZINC000716582878 712564085 /nfs/dbraw/zinc/56/40/85/712564085.db2.gz LQJUIPGNIIESLH-DXUDUQDWSA-N 2 0 236.403 2.386 20 0 BEADRP C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000716528149 712567270 /nfs/dbraw/zinc/56/72/70/712567270.db2.gz CMXWUNUGCUQNPL-ZMBAKOJHSA-N 2 0 248.414 2.256 20 0 BEADRP C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000716546521 712567556 /nfs/dbraw/zinc/56/75/56/712567556.db2.gz PTMZAUSDWZPSMY-IZMFDJJNSA-N 2 0 222.376 2.138 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@H]1[C@H]1C[C@H]1C)[C@@H]1CCCC[NH2+]1 ZINC000716630910 712568285 /nfs/dbraw/zinc/56/82/85/712568285.db2.gz ATAGNTRXLCHCLL-DXUDUQDWSA-N 2 0 236.403 2.399 20 0 BEADRP C(C[C@@H]1CC[C@H]2C[C@H]21)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000717005312 712604126 /nfs/dbraw/zinc/60/41/26/712604126.db2.gz ZZYVSHXOMDELMJ-AUIHWATRSA-N 2 0 234.387 2.295 20 0 BEADRP C[C@H](CC1CCC1)[NH2+]C[C@@H]1C[NH2+]CCC1(F)F ZINC000717335329 712649197 /nfs/dbraw/zinc/64/91/97/712649197.db2.gz NKGQPZFKDBJXOB-PWSUYJOCSA-N 2 0 246.345 2.400 20 0 BEADRP C[C@H]([NH2+]C1CCC=CCC1)[C@@H]1CCC[NH2+]1 ZINC000718020716 712736941 /nfs/dbraw/zinc/73/69/41/712736941.db2.gz VVZIAKPUBUUPTQ-AAEUAGOBSA-N 2 0 208.349 2.215 20 0 BEADRP Cc1coc(C[NH2+]CC2CC[NH+](C)CC2)c1 ZINC000718036588 712737271 /nfs/dbraw/zinc/73/72/71/712737271.db2.gz SKJCPOLJDYWSFP-UHFFFAOYSA-N 2 0 222.332 2.019 20 0 BEADRP C1=CCCC([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)CC1 ZINC000718125578 712746116 /nfs/dbraw/zinc/74/61/16/712746116.db2.gz ZAONBHRKTYEXRO-PBWFPOADSA-N 2 0 220.360 2.358 20 0 BEADRP CC(F)(F)CCC[N@@H+]1C[C@@H]2CCC[C@@H]([NH3+])[C@H]2C1 ZINC000718583528 712775399 /nfs/dbraw/zinc/77/53/99/712775399.db2.gz KRSJONZQHOAUDX-SDDRHHMPSA-N 2 0 246.345 2.481 20 0 BEADRP CO[C@@H]1CCC[C@H]([NH2+]CC[C@@H](C)[NH+](C)C)CC1 ZINC000718774410 712782594 /nfs/dbraw/zinc/78/25/94/712782594.db2.gz HUVLAJXYBAHQLK-HZSPNIEDSA-N 2 0 242.407 2.264 20 0 BEADRP C[C@@H](C[NH2+][C@@H](C)C1CC1)C[NH+]1CCCCC1 ZINC000038041774 712801421 /nfs/dbraw/zinc/80/14/21/712801421.db2.gz RPTNWAKTFJXHQR-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)C[C@@H](C)C[N@@H+]1C[C@@H]2C[NH2+]C[C@]2(C)C1 ZINC000720863124 712871265 /nfs/dbraw/zinc/87/12/65/712871265.db2.gz YDSQZDMTDHDZLW-HZSPNIEDSA-N 2 0 224.392 2.210 20 0 BEADRP CCCCCCN1CCC[C@H]2[NH2+]CC[C@H]21 ZINC000720902197 712876175 /nfs/dbraw/zinc/87/61/75/712876175.db2.gz DVRFOCVNVHJZCV-CHWSQXEVSA-N 2 0 210.365 2.393 20 0 BEADRP C[NH+]1CCC(C[NH2+]CC2(C)CC(F)(F)C2)CC1 ZINC000720934643 712879925 /nfs/dbraw/zinc/87/99/25/712879925.db2.gz IYYAVQWSJLMOCM-UHFFFAOYSA-N 2 0 246.345 2.353 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CC2(C)CC(F)(F)C2)CC[N@@H+]1C ZINC000720934288 712880227 /nfs/dbraw/zinc/88/02/27/712880227.db2.gz FUVCJNYCPMLIEE-QWRGUYRKSA-N 2 0 246.345 2.494 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+][C@@H]1CCCC[C@H]1C ZINC000721123521 712891394 /nfs/dbraw/zinc/89/13/94/712891394.db2.gz XPBTWURDHMCQFJ-AAVRWANBSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]([NH2+]CCN1CCC[C@@H]1C)C1CCC1 ZINC000380354065 712892879 /nfs/dbraw/zinc/89/28/79/712892879.db2.gz WHKOPDFPNJLOJR-NWDGAFQWSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)CN1c1[nH+]ccc2[nH]ccc21 ZINC000663763896 719156752 /nfs/dbraw/zinc/15/67/52/719156752.db2.gz ITUMRTUHPBBCCF-GHMZBOCLSA-N 2 0 244.342 2.092 20 0 BEADRP Cl/C=C\C[N@@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000692954042 957043695 /nfs/dbraw/zinc/04/36/95/957043695.db2.gz GNOLVKQRLPFNFF-IUAZIXFQSA-N 2 0 242.794 2.451 20 0 BEADRP Cc1ccc(N(C)CC2CC[NH+](C)CC2)[nH+]c1C ZINC001165041259 721932953 /nfs/dbraw/zinc/93/29/53/721932953.db2.gz NEQDKJCRPHPDGB-UHFFFAOYSA-N 2 0 247.386 2.476 20 0 BEADRP Cc1ccc(N2CCC(C[NH+](C)C)CC2)[nH+]c1C ZINC001165042779 721944791 /nfs/dbraw/zinc/94/47/91/721944791.db2.gz WSECVZDOSJXAAQ-UHFFFAOYSA-N 2 0 247.386 2.476 20 0 BEADRP C[C@H](c1ccccc1)[N@H+](C)C[C@H]1C[C@@H]([NH3+])C1 ZINC000693567019 958858407 /nfs/dbraw/zinc/85/84/07/958858407.db2.gz FYINJYVTAVPRMX-BZPMIXESSA-N 2 0 218.344 2.417 20 0 BEADRP CC[C@@H]1CCCCC[N@@H+]1C[C@H]1C[C@@H]([NH3+])C1 ZINC000693577150 958868227 /nfs/dbraw/zinc/86/82/27/958868227.db2.gz BWMHRGIQKFVTHU-FRRDWIJNSA-N 2 0 210.365 2.378 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]CC2(C3CC3)CC2)C12CCC2 ZINC000405258566 959424221 /nfs/dbraw/zinc/42/42/21/959424221.db2.gz HUCMFZNZYPMVDH-VXGBXAGGSA-N 2 0 220.360 2.036 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)C1(Cl)CC1 ZINC000695655873 960326695 /nfs/dbraw/zinc/32/66/95/960326695.db2.gz OCLSTRVJNWHJLR-SRVKXCTJSA-N 2 0 242.794 2.363 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)C1(Cl)CC1 ZINC000695654754 960327298 /nfs/dbraw/zinc/32/72/98/960327298.db2.gz JGADJIDWGKDPFY-MNOVXSKESA-N 2 0 242.794 2.220 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)C1(Cl)CC1 ZINC000695654753 960327703 /nfs/dbraw/zinc/32/77/03/960327703.db2.gz JGADJIDWGKDPFY-GHMZBOCLSA-N 2 0 242.794 2.220 20 0 BEADRP CC(C)([NH3+])CC[NH2+]C1CCC2(CC2)CC1 ZINC000695646083 960320138 /nfs/dbraw/zinc/32/01/38/960320138.db2.gz FGPKLPKZFMDMCZ-UHFFFAOYSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@]1([NH3+])CCC[N@H+](CCC(F)(F)F)CC1 ZINC001205254803 967443655 /nfs/dbraw/zinc/44/36/55/967443655.db2.gz BMIHDERNEKAGOA-VIFPVBQESA-N 2 0 224.270 2.142 20 0 BEADRP CC[N@@H+]1CCCC[C@H]1CC[NH+]1CCCC1 ZINC000146962941 1165875666 /nfs/dbraw/zinc/87/56/66/1165875666.db2.gz ZOWDIFWFDKXUNU-ZDUSSCGKSA-N 2 0 210.365 2.347 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH2+]C2CCCCC2)CC1 ZINC000075135658 1165886841 /nfs/dbraw/zinc/88/68/41/1165886841.db2.gz NGBRGWRBHKHQDU-ZDUSSCGKSA-N 2 0 210.365 2.393 20 0 BEADRP C[N@@H+]1CC[C@@H](C[NH2+][C@H]2CCCC(C)(C)C2)C1 ZINC000070628978 1165939403 /nfs/dbraw/zinc/93/94/03/1165939403.db2.gz ROPAHKDLQPTULG-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP [NH3+]C[C@@H]1CC[N@H+](Cc2cccc3cccnc32)C1 ZINC000050249095 1165989811 /nfs/dbraw/zinc/98/98/11/1165989811.db2.gz ZMKCZEBQAOBWLY-LBPRGKRZSA-N 2 0 241.338 2.015 20 0 BEADRP C[NH+](C)CC(C)(C)C[NH+]1CCCCCC1 ZINC001207275924 968711483 /nfs/dbraw/zinc/71/14/83/968711483.db2.gz QRGIMTPOTHIBEX-UHFFFAOYSA-N 2 0 212.381 2.450 20 0 BEADRP C[NH+](C)CC(C)(C)C[N@@H+]1CCC[C@H]2C[C@H]21 ZINC001207283590 968716172 /nfs/dbraw/zinc/71/61/72/968716172.db2.gz AHNKKKVETOFFJT-NWDGAFQWSA-N 2 0 210.365 2.059 20 0 BEADRP C[NH+](C)CC(C)(C)C[N@@H+]1C[C@@H]2C[C@H]1C[C@H]2F ZINC001207282850 968717041 /nfs/dbraw/zinc/71/70/41/968717041.db2.gz WNBJPSXWBSPBNP-SDDRHHMPSA-N 2 0 228.355 2.007 20 0 BEADRP CO[C@@H]1CC[N@H+](CC(C)(C)C[NH+](C)C)[C@H](C)C1 ZINC001207284144 968717393 /nfs/dbraw/zinc/71/73/93/968717393.db2.gz KIERBJURAMPPAC-CHWSQXEVSA-N 2 0 242.407 2.074 20 0 BEADRP C[NH+]1CCC(C[NH+]2C[C@H]3CCC[C@@H]3C2)CC1 ZINC001207392360 968750531 /nfs/dbraw/zinc/75/05/31/968750531.db2.gz ZRSQUMVLKLJVFN-ZIAGYGMSSA-N 2 0 222.376 2.060 20 0 BEADRP C[NH+]1CCC(CC[N@@H+]2CCC(C)(C)C2)CC1 ZINC001207484483 968797081 /nfs/dbraw/zinc/79/70/81/968797081.db2.gz MDHFUYHCYFWEIG-UHFFFAOYSA-N 2 0 224.392 2.450 20 0 BEADRP C[N@H+](CCC1CC[NH+](C)CC1)CC1CCC1 ZINC001207483697 968797102 /nfs/dbraw/zinc/79/71/02/968797102.db2.gz HJYSYGCSKTWYTQ-UHFFFAOYSA-N 2 0 224.392 2.450 20 0 BEADRP C[NH+]1CCC(C)(C[NH+]2CCCCC2)CC1 ZINC001208102609 969002003 /nfs/dbraw/zinc/00/20/03/969002003.db2.gz GLCQNVZGXHUZEP-UHFFFAOYSA-N 2 0 210.365 2.204 20 0 BEADRP CC1CC[NH+](CC2(C)CC[NH+](C)CC2)CC1 ZINC001208104636 969004340 /nfs/dbraw/zinc/00/43/40/969004340.db2.gz OUGRORDIBIDJCF-UHFFFAOYSA-N 2 0 224.392 2.450 20 0 BEADRP C[N@H+](CC1CCC1)CC1(C)CC[NH+](C)CC1 ZINC001208113287 969007904 /nfs/dbraw/zinc/00/79/04/969007904.db2.gz GZEIBTAMLHDLAA-UHFFFAOYSA-N 2 0 224.392 2.450 20 0 BEADRP C[NH+]1CCC(C)(C[N@@H+]2CCC[C@@H](CF)C2)CC1 ZINC001208113284 969009200 /nfs/dbraw/zinc/00/92/00/969009200.db2.gz GTTURVJKFGCBMR-ZDUSSCGKSA-N 2 0 242.382 2.400 20 0 BEADRP Cc1cc(N2CCC3(CC[N@@H+](C)C3)CC2)cc[nH+]1 ZINC000224245508 1166219172 /nfs/dbraw/zinc/21/91/72/1166219172.db2.gz YJKGMOJCCFIBQV-UHFFFAOYSA-N 2 0 245.370 2.312 20 0 BEADRP CSCC[C@@H](C)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000228873520 1166223730 /nfs/dbraw/zinc/22/37/30/1166223730.db2.gz MUPGEYUWBCQWLZ-NEPJUHHUSA-N 2 0 230.421 2.059 20 0 BEADRP C[C@H]1CC[N@H+](CC2(C[NH+](C)C)CCCC2)C1 ZINC001208185290 969119271 /nfs/dbraw/zinc/11/92/71/969119271.db2.gz ZPVHCWKQHZQQOP-ZDUSSCGKSA-N 2 0 224.392 2.450 20 0 BEADRP C[C@@H]1CCC[N@H+](C[C@H]2CCC[NH+](C)C2)C1 ZINC001208604154 969158024 /nfs/dbraw/zinc/15/80/24/969158024.db2.gz LRJJKCUKDQCIGZ-OLZOCXBDSA-N 2 0 210.365 2.060 20 0 BEADRP CC[C@@H]1CC[N@H+](CC2CC[NH+](CC)CC2)C1 ZINC001208604760 969158074 /nfs/dbraw/zinc/15/80/74/969158074.db2.gz UBOKANDDMXFNEL-CYBMUJFWSA-N 2 0 224.392 2.450 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]Cc1csc(C)c1C ZINC000399780611 1166253724 /nfs/dbraw/zinc/25/37/24/1166253724.db2.gz RGGBEKQLXSQOMC-VIFPVBQESA-N 2 0 226.389 2.310 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]Cc1csc(C)c1C ZINC000399780609 1166255511 /nfs/dbraw/zinc/25/55/11/1166255511.db2.gz RGGBEKQLXSQOMC-SECBINFHSA-N 2 0 226.389 2.310 20 0 BEADRP CCC[NH+]1C[C@H]2C[NH+](CCC3CC3)C[C@@H]2C1 ZINC001208687126 969196031 /nfs/dbraw/zinc/19/60/31/969196031.db2.gz PRRQCDORRIQYAU-KBPBESRZSA-N 2 0 222.376 2.060 20 0 BEADRP CCO[C@H]1CCC[N@H+](CC(C)(C)C[NH+](C)C)C1 ZINC001207285217 1166274432 /nfs/dbraw/zinc/27/44/32/1166274432.db2.gz DFMZUJRECBXWFE-ZDUSSCGKSA-N 2 0 242.407 2.075 20 0 BEADRP CC(C)([NH3+])c1ccccc1-n1cccc1C[NH3+] ZINC001167595572 1166297340 /nfs/dbraw/zinc/29/73/40/1166297340.db2.gz FLJXPRJONWIVFY-UHFFFAOYSA-N 2 0 229.327 2.130 20 0 BEADRP [NH3+]CCC[N@H+](C1CCCCC1)[C@H]1CCCOC1 ZINC000224833600 1166336502 /nfs/dbraw/zinc/33/65/02/1166336502.db2.gz JZLVPYNVCSLTOD-AWEZNQCLSA-N 2 0 240.391 2.149 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]CCC1CC1)C2 ZINC001169098600 969389617 /nfs/dbraw/zinc/38/96/17/969389617.db2.gz JOJCVAXEZFOTBJ-XYYAHUGASA-N 2 0 208.349 2.001 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]C1CC(C)(C)C1)C2 ZINC001169101514 969398232 /nfs/dbraw/zinc/39/82/32/969398232.db2.gz TVMAUXHXXSPYDW-UOJUARBOSA-N 2 0 222.376 2.390 20 0 BEADRP C[C@H]1CC[C@H]([NH2+]CC2CC[NH+](C)CC2)CC1 ZINC000253136523 1166384124 /nfs/dbraw/zinc/38/41/24/1166384124.db2.gz SKGGQJGTSMSWMM-MQMHXKEQSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)CC[N@@H+]1CC[C@H]2[NH2+]CCC[C@H]2C1 ZINC000250599426 1166413023 /nfs/dbraw/zinc/41/30/23/1166413023.db2.gz QOFSURIPVBSVAS-QWHCGFSZSA-N 2 0 210.365 2.106 20 0 BEADRP [NH3+]CCCC[N@@H+]1CC[C@H]2CCCC[C@H]2C1 ZINC000250793876 1166430839 /nfs/dbraw/zinc/43/08/39/1166430839.db2.gz ABKZHWMVHLQCIZ-OLZOCXBDSA-N 2 0 210.365 2.237 20 0 BEADRP C[N@H+](C1CCCC1)[C@H]1CCC[NH+](C)CC1 ZINC001254524595 969707927 /nfs/dbraw/zinc/70/79/27/969707927.db2.gz XJXSHMLPJFIALP-ZDUSSCGKSA-N 2 0 210.365 2.345 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH+]2C3CCC2CC3)CC1 ZINC001254523360 969708449 /nfs/dbraw/zinc/70/84/49/969708449.db2.gz OLVLLZXVEPZPAK-HIFPTAJRSA-N 2 0 208.349 2.098 20 0 BEADRP C[C@H]1C[N@H+]([C@H]2CCC[NH+](C)CC2)C2(CC2)C1 ZINC001254530047 969729985 /nfs/dbraw/zinc/72/99/85/969729985.db2.gz UDMHKGVOPLFVEW-OLZOCXBDSA-N 2 0 222.376 2.345 20 0 BEADRP C[C@@H]1C[N@H+]([C@H]2CCC[NH+](C)CC2)C2(CC2)C1 ZINC001254530049 969733885 /nfs/dbraw/zinc/73/38/85/969733885.db2.gz UDMHKGVOPLFVEW-STQMWFEESA-N 2 0 222.376 2.345 20 0 BEADRP C[NH+]1CCC(CCC[NH2+][C@H]2CCSC2)CC1 ZINC001255273997 970027300 /nfs/dbraw/zinc/02/73/00/970027300.db2.gz KBONIDYJRYHGDZ-ZDUSSCGKSA-N 2 0 242.432 2.204 20 0 BEADRP Cc1c[nH+]c(N[C@@H]2CCC[C@H]([NH3+])C2)c(C)c1 ZINC000394756794 1166592103 /nfs/dbraw/zinc/59/21/03/1166592103.db2.gz YKXSKOSYKVUZHV-NWDGAFQWSA-N 2 0 219.332 2.380 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH2+][C@H]2CCC(F)(F)C2)CC1 ZINC000309538355 1166644902 /nfs/dbraw/zinc/64/49/02/1166644902.db2.gz FYUCDCBDIAIBPC-MNOVXSKESA-N 2 0 232.318 2.248 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)CC[NH+](C)C)C1(Cl)CC1 ZINC000695665914 1166663572 /nfs/dbraw/zinc/66/35/72/1166663572.db2.gz FFLQEXAOHNDWED-VHSXEESVSA-N 2 0 218.772 2.076 20 0 BEADRP CC(C)[C@@H]1CCC[N@@H+]1[C@@H]1CC[NH2+][C@H](C)C1 ZINC000252965023 1166759410 /nfs/dbraw/zinc/75/94/10/1166759410.db2.gz WWQYFFWTGKXLIQ-UPJWGTAASA-N 2 0 210.365 2.247 20 0 BEADRP Cc1cc(C[N@H+]2CC[C@H]([C@@H](C)[NH3+])C2)cs1 ZINC000379804127 1166788911 /nfs/dbraw/zinc/78/89/11/1166788911.db2.gz NGYUNVRQWFYTBL-PWSUYJOCSA-N 2 0 224.373 2.226 20 0 BEADRP C[NH2+]CC[C@H](C)[N@@H+]1CC[C@H]2CCCC[C@H]2C1 ZINC000251157872 1166800937 /nfs/dbraw/zinc/80/09/37/1166800937.db2.gz BUBMBTSLYOJWRO-MJBXVCDLSA-N 2 0 224.392 2.497 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]C1(COC)CCC1 ZINC001255942275 970574434 /nfs/dbraw/zinc/57/44/34/970574434.db2.gz FBJZACWFOSZOHX-CYBMUJFWSA-N 2 0 242.407 2.266 20 0 BEADRP CCCC[C@@H](CO)[NH2+][C@H](C)CC[NH+](CC)CC ZINC001255946615 970579914 /nfs/dbraw/zinc/57/99/14/970579914.db2.gz XDPBKEYENHUSBF-KGLIPLIRSA-N 2 0 244.423 2.248 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+][C@H]1CCCC(=O)C1 ZINC001255948064 970583330 /nfs/dbraw/zinc/58/33/30/970583330.db2.gz DLIAROKYRQDEJJ-OLZOCXBDSA-N 2 0 240.391 2.208 20 0 BEADRP CC(C)=CCC[C@H](C)[NH2+][C@@H]1C[NH2+]C[C@H]1C ZINC000925786880 1166835001 /nfs/dbraw/zinc/83/50/01/1166835001.db2.gz QIDPAMYBIJQVHF-FRRDWIJNSA-N 2 0 210.365 2.319 20 0 BEADRP C[C@H]([NH2+]C1CCCCC1)C1CC[NH2+]CC1 ZINC000400747265 970622931 /nfs/dbraw/zinc/62/29/31/970622931.db2.gz URTXGVQTXAEJFP-NSHDSACASA-N 2 0 210.365 2.297 20 0 BEADRP C(CC1CCC1)[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000400961322 970649396 /nfs/dbraw/zinc/64/93/96/970649396.db2.gz ISLRZWQQFPOTBT-MELADBBJSA-N 2 0 222.376 2.154 20 0 BEADRP CC[C@@H]1CC[C@H](C)[N@H+](CC2CC[NH2+]CC2)C1 ZINC000304348752 1166913770 /nfs/dbraw/zinc/91/37/70/1166913770.db2.gz KDWXWKCUNQPUNX-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP CCCOC1CCC([NH2+]CCC[NH+](C)C)CC1 ZINC001173087007 975021114 /nfs/dbraw/zinc/02/11/14/975021114.db2.gz YFKAQKLJPVCKRH-UHFFFAOYSA-N 2 0 242.407 2.266 20 0 BEADRP C[N@H+](C1CC1)C1CC[NH+]([C@H]2C[C@H]3C[C@H]3C2)CC1 ZINC001167956825 1167019713 /nfs/dbraw/zinc/01/97/13/1167019713.db2.gz UPCOIZNDHZWMHK-JYAVWHMHSA-N 2 0 234.387 2.344 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2C[C@@H]3CC[NH2+]C[C@H]3C2)C[C@@H]1C ZINC000310397864 1167068268 /nfs/dbraw/zinc/06/82/68/1167068268.db2.gz MIFPGUTWJHAJDJ-QTVXIADOSA-N 2 0 236.403 2.352 20 0 BEADRP CC[N@@H+]1CCC[C@H](C[NH2+][C@H](C)[C@H]2CC2(F)F)C1 ZINC001333338322 975678876 /nfs/dbraw/zinc/67/88/76/975678876.db2.gz OHEPKJYQWQFTHC-IJLUTSLNSA-N 2 0 246.345 2.352 20 0 BEADRP [NH3+]CCCC[N@@H+]1CCC2(C1)CCCCC2 ZINC000308941152 1167224063 /nfs/dbraw/zinc/22/40/63/1167224063.db2.gz RYXVFMDUJWXGKX-UHFFFAOYSA-N 2 0 210.365 2.382 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+][C@@H]1CCSC1 ZINC000309044780 1167243943 /nfs/dbraw/zinc/24/39/43/1167243943.db2.gz NSHHPLAJFGSSND-NWDGAFQWSA-N 2 0 230.421 2.202 20 0 BEADRP c1cc(NC2CC[NH+](C3CC3)CC2)cc[nH+]1 ZINC000309333581 1167293054 /nfs/dbraw/zinc/29/30/54/1167293054.db2.gz IJLMDZYHYAWFTK-UHFFFAOYSA-N 2 0 217.316 2.120 20 0 BEADRP CC[C@H](C)C[N@@H+]1CC[C@@H]2[NH2+]CCC[C@H]2C1 ZINC000251532974 1167336474 /nfs/dbraw/zinc/33/64/74/1167336474.db2.gz AVFZLSJOPKRUME-AVGNSLFASA-N 2 0 210.365 2.106 20 0 BEADRP [NH3+]CC1CCC([NH2+]CCC2CC=CC2)CC1 ZINC001335265551 976909476 /nfs/dbraw/zinc/90/94/76/976909476.db2.gz ACBIWEZMRKWXLF-UHFFFAOYSA-N 2 0 222.376 2.450 20 0 BEADRP CSC(C)(C)CC[NH+]1CCC(C[NH3+])CC1 ZINC000385294414 1167388985 /nfs/dbraw/zinc/38/89/85/1167388985.db2.gz IXBWQBYHGWMYFR-UHFFFAOYSA-N 2 0 230.421 2.189 20 0 BEADRP C[C@@H]1CC[C@@H]([NH+]2CCC(C[NH3+])CC2)C[C@H]1C ZINC000251634192 1167452068 /nfs/dbraw/zinc/45/20/68/1167452068.db2.gz DWJSHRFMKXXRCY-YRGRVCCFSA-N 2 0 224.392 2.482 20 0 BEADRP CCC[N@H+](C)C[C@@H]1CCN(c2cc[nH+]cc2)C1 ZINC001120779004 1167699328 /nfs/dbraw/zinc/69/93/28/1167699328.db2.gz WTFYGLGUGDPGER-ZDUSSCGKSA-N 2 0 233.359 2.250 20 0 BEADRP CCC[C@@H](C[N@H+](C)C1CCC([NH3+])CC1)OC ZINC000386437190 1167710432 /nfs/dbraw/zinc/71/04/32/1167710432.db2.gz MFBLKWMQNZIVPZ-BPCQOVAHSA-N 2 0 228.380 2.003 20 0 BEADRP C[C@H](Cc1cccc(F)c1)[NH2+][C@@H]1CCC[C@@H]1[NH3+] ZINC001168475855 1167766630 /nfs/dbraw/zinc/76/66/30/1167766630.db2.gz QLNBQXCZFCQVBR-DDTOSNHZSA-N 2 0 236.334 2.226 20 0 BEADRP CC1(C)C[C@@H]([N@@H+]2CCCC[C@@H](C[NH3+])C2)CCO1 ZINC000310449332 1167774476 /nfs/dbraw/zinc/77/44/76/1167774476.db2.gz XRJQEQNYZTUYCW-STQMWFEESA-N 2 0 240.391 2.005 20 0 BEADRP CCC[N@H+](CCC[NH3+])[C@H]1CCC[C@H](OC)C1 ZINC000069846603 978763767 /nfs/dbraw/zinc/76/37/67/978763767.db2.gz QBEYDSJLKQOUCJ-STQMWFEESA-N 2 0 228.380 2.005 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+][C@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC001340062643 978960277 /nfs/dbraw/zinc/96/02/77/978960277.db2.gz HIYWARVGHFWZQM-RHYQMDGZSA-N 2 0 210.365 2.281 20 0 BEADRP C[N@H+](CC[C@@H]1CCCC[NH2+]1)C[C@H]1CC1(C)C ZINC001235959555 979230238 /nfs/dbraw/zinc/23/02/38/979230238.db2.gz YRUHZIIAFDIEPQ-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H]1CCCC[N@@H+]1[C@@H]1CC[NH2+][C@@H](C)C1 ZINC000229541134 1168331219 /nfs/dbraw/zinc/33/12/19/1168331219.db2.gz FMAHAOQRSOBZIB-YNEHKIRRSA-N 2 0 210.365 2.391 20 0 BEADRP CCOc1cc(CN(C)C[C@H](C)[NH3+])ccc1C ZINC001236908397 979794437 /nfs/dbraw/zinc/79/44/37/979794437.db2.gz HNTHJTKXMKGUBW-LBPRGKRZSA-N 2 0 236.359 2.173 20 0 BEADRP C[C@@H]1C[C@H]([NH+]2Cc3ccccc3C2)CC[NH2+]1 ZINC000229546179 1168353673 /nfs/dbraw/zinc/35/36/73/1168353673.db2.gz PDQYUKZCRLKZPH-BXUZGUMPSA-N 2 0 216.328 2.143 20 0 BEADRP CC[C@H](C)[C@H](C)[N@@H+]1CC[C@@H](C)[C@@H](C[NH3+])C1 ZINC000229064108 1168361381 /nfs/dbraw/zinc/36/13/81/1168361381.db2.gz SWOANKSCHUHPSS-RNJOBUHISA-N 2 0 212.381 2.338 20 0 BEADRP C[C@H]1CCC[C@H]([NH2+]C[C@@H]2CC[N@H+](C)C2)C1 ZINC000037484634 1168418372 /nfs/dbraw/zinc/41/83/72/1168418372.db2.gz BBTVVGXGKRDVLS-AVGNSLFASA-N 2 0 210.365 2.106 20 0 BEADRP C[NH2+]CC[C@@H](C)[NH2+]Cc1ccc(C)cc1C ZINC000323221718 1168433237 /nfs/dbraw/zinc/43/32/37/1168433237.db2.gz MCMYIIUXSFCVRD-CYBMUJFWSA-N 2 0 220.360 2.391 20 0 BEADRP CC[C@@H]1CCCC[C@@H]1C[N@H+](C)CCC[NH3+] ZINC000401452305 1168441473 /nfs/dbraw/zinc/44/14/73/1168441473.db2.gz PWCPJKUJUNRDBL-CHWSQXEVSA-N 2 0 212.381 2.483 20 0 BEADRP C[NH+](C)C1CCC([N@H+](C)CC2CC2)CC1 ZINC000202465973 1168458105 /nfs/dbraw/zinc/45/81/05/1168458105.db2.gz HOPCTYFQWXMTBW-UHFFFAOYSA-N 2 0 210.365 2.201 20 0 BEADRP C[C@H]1CCC[C@@H]([N@H+](C)CCC[NH+](C)C)C1 ZINC000337344931 1168459378 /nfs/dbraw/zinc/45/93/78/1168459378.db2.gz ZMYRPGAQZSZVOK-QWHCGFSZSA-N 2 0 212.381 2.449 20 0 BEADRP Cc1cccc2c1C1(C[C@H]2[NH3+])CC[NH2+]CC1 ZINC001239321417 980530111 /nfs/dbraw/zinc/53/01/11/980530111.db2.gz RETVYYZIJKWQDP-GFCCVEGCSA-N 2 0 216.328 2.020 20 0 BEADRP Cc1cc2[nH]ccc2c(N2C[C@@H](C)[NH2+][C@@H](C)C2)[nH+]1 ZINC001158180707 1168544519 /nfs/dbraw/zinc/54/45/19/1168544519.db2.gz YNJQYQFTSNXTIU-PHIMTYICSA-N 2 0 244.342 2.058 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@H](C)CC(C)(C)C ZINC001348853681 981461231 /nfs/dbraw/zinc/46/12/31/981461231.db2.gz URSMHWGEPCZUFK-WDEREUQCSA-N 2 0 200.370 2.399 20 0 BEADRP CO[C@H]1CCC[C@H]([NH2+]CCCCCCC[NH3+])C1 ZINC001172922871 1168683702 /nfs/dbraw/zinc/68/37/02/1168683702.db2.gz JKMKHKYVGPBJGR-KBPBESRZSA-N 2 0 242.407 2.443 20 0 BEADRP CCc1nc(C)c(CN2C[C@@H]3C[C@@H]3[C@@H](F)C2)[nH]1 ZINC001203236184 1168777457 /nfs/dbraw/zinc/77/74/57/1168777457.db2.gz FHQWPSCUIURSJG-DCAQKATOSA-N 2 0 237.322 2.070 20 0 BEADRP CC[NH+]1C[C@H]2C[NH+](CCC(C)(C)C)C[C@@H]2C1 ZINC001202114950 983567815 /nfs/dbraw/zinc/56/78/15/983567815.db2.gz JRQXXACXUQWJLC-STQMWFEESA-N 2 0 224.392 2.306 20 0 BEADRP C[N@H+](CC1CC=CC1)C1CCC([NH3+])CC1 ZINC000692037576 1169114911 /nfs/dbraw/zinc/11/49/11/1169114911.db2.gz MKVSGYDUBMTUPZ-UHFFFAOYSA-N 2 0 208.349 2.154 20 0 BEADRP CCOCC[C@H](C)[NH2+][C@H]1CC[C@@H]([NH+](C)C)CC1 ZINC001172418071 974690606 /nfs/dbraw/zinc/69/06/06/974690606.db2.gz BMDHQKSAFQCBGY-MELADBBJSA-N 2 0 242.407 2.264 20 0 BEADRP CCC[N@H+](CCC[NH3+])[C@@H](C)CCOC(C)C ZINC001172432853 974718713 /nfs/dbraw/zinc/71/87/13/974718713.db2.gz CYAXMEHWCKTZOY-ZDUSSCGKSA-N 2 0 230.396 2.251 20 0 BEADRP CC(C)OCC[C@@H](C)[N@H+](C)C1CCC([NH3+])CC1 ZINC001172449219 974814269 /nfs/dbraw/zinc/81/42/69/974814269.db2.gz QQDZANGCNKQTND-IYXRBSQSSA-N 2 0 242.407 2.392 20 0 BEADRP CC(C)COCC[C@H](C)[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC001172463797 974828645 /nfs/dbraw/zinc/82/86/45/974828645.db2.gz TZAHHOSLBXQLDV-IHRRRGAJSA-N 2 0 242.407 2.297 20 0 BEADRP [NH3+]C[C@H]1CCCC[N@H+](C[C@@H]2CC=CCC2)C1 ZINC000402202321 970768141 /nfs/dbraw/zinc/76/81/41/970768141.db2.gz FFNWMHXUHCUFJO-ZIAGYGMSSA-N 2 0 222.376 2.404 20 0 BEADRP CC[N@H+](CCCCCC[NH3+])[C@@H]1CCCOC1 ZINC000402642570 970818858 /nfs/dbraw/zinc/81/88/58/970818858.db2.gz FNDHPZUMTNUGCL-CYBMUJFWSA-N 2 0 228.380 2.006 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)[C@H](C)Cc1ccccn1 ZINC001256425714 970834755 /nfs/dbraw/zinc/83/47/55/970834755.db2.gz JEDDVRJYPLKMGT-CQSZACIVSA-N 2 0 249.402 2.286 20 0 BEADRP CC[N@H+](CCCCCCC[NH3+])[C@H]1CCCOC1 ZINC000402762867 970852311 /nfs/dbraw/zinc/85/23/11/970852311.db2.gz FUCBZENYLXCBKM-AWEZNQCLSA-N 2 0 242.407 2.397 20 0 BEADRP COCC(C)(C)[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC001256558582 970864426 /nfs/dbraw/zinc/86/44/26/970864426.db2.gz RHDORTZZMMJPJS-UHFFFAOYSA-N 2 0 242.407 2.264 20 0 BEADRP CCC[C@@H](C)C[N@@H+]1CCC(F)(F)[C@H](C[NH3+])C1 ZINC000403136475 970882318 /nfs/dbraw/zinc/88/23/18/970882318.db2.gz BWWZNONVSCAWDX-GHMZBOCLSA-N 2 0 234.334 2.339 20 0 BEADRP C[C@@H]1CCC[N@@H+](C2C[C@H]3CC[C@@H](C2)[NH+]3C)C1 ZINC001256621153 970886857 /nfs/dbraw/zinc/88/68/57/970886857.db2.gz LGOKUHAUQIJXDM-HABKJSAYSA-N 2 0 222.376 2.344 20 0 BEADRP CCC[N@H+](CC)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001256621564 970887403 /nfs/dbraw/zinc/88/74/03/970887403.db2.gz WHKCAERBVZNHLL-FUNVUKJBSA-N 2 0 210.365 2.344 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@@H]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC000403401831 970935196 /nfs/dbraw/zinc/93/51/96/970935196.db2.gz SGTMILYNLVJISD-MGPQQGTHSA-N 2 0 222.376 2.106 20 0 BEADRP C[C@@H](Cc1ccncc1)[NH2+]CCCCC[NH+](C)C ZINC001256720819 970941055 /nfs/dbraw/zinc/94/10/55/970941055.db2.gz YVAYXYPWBHERPM-AWEZNQCLSA-N 2 0 249.402 2.334 20 0 BEADRP [NH3+]C[C@@H]1CCC[N@H+](C[C@@H]2CC[C@H]3C[C@H]3C2)C1 ZINC000403507828 970956647 /nfs/dbraw/zinc/95/66/47/970956647.db2.gz BGRWPZMOARQIBQ-ZOBORPQBSA-N 2 0 222.376 2.093 20 0 BEADRP C[C@@H]1CC[N@@H+]1C1CCN(c2cc[nH+]cc2)CC1 ZINC001256855784 970996340 /nfs/dbraw/zinc/99/63/40/970996340.db2.gz VXVNTZKDJTWSRE-GFCCVEGCSA-N 2 0 231.343 2.145 20 0 BEADRP c1cc(N2CCC([NH+]3CCCC3)CC2)cc[nH+]1 ZINC001256855117 970998179 /nfs/dbraw/zinc/99/81/79/970998179.db2.gz DWHICEDQECNJGZ-UHFFFAOYSA-N 2 0 231.343 2.146 20 0 BEADRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)S2 ZINC000403654063 971005367 /nfs/dbraw/zinc/00/53/67/971005367.db2.gz IBOYQVIKHLSNLX-XYTAGDGMSA-N 2 0 240.416 2.130 20 0 BEADRP C(=C/C1CC[NH2+]CC1)\c1cccc2c1C[NH2+]CC2 ZINC001243895973 971017451 /nfs/dbraw/zinc/01/74/51/971017451.db2.gz JLVJDUIIYYKXKW-SNAWJCMRSA-N 2 0 242.366 2.345 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCCCCCC[NH3+])C[C@H](C)O1 ZINC001257078354 971072282 /nfs/dbraw/zinc/07/22/82/971072282.db2.gz JCWBNKWGMBOVPZ-BTTYYORXSA-N 2 0 242.407 2.441 20 0 BEADRP C[C@H]1CC([NH2+]CCCCCCC[NH3+])C[C@H](C)O1 ZINC001257078356 971074922 /nfs/dbraw/zinc/07/49/22/971074922.db2.gz JCWBNKWGMBOVPZ-STQMWFEESA-N 2 0 242.407 2.441 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)C1C[C@H](C)O[C@@H](C)C1 ZINC001257101298 971116244 /nfs/dbraw/zinc/11/62/44/971116244.db2.gz GISKVYMLXJQGGZ-STQMWFEESA-N 2 0 242.407 2.216 20 0 BEADRP CCC(CC)[NH+]1CCC([NH3+])(CCOC)CC1 ZINC001257291955 971177764 /nfs/dbraw/zinc/17/77/64/971177764.db2.gz ZACRGIRDESHYJZ-UHFFFAOYSA-N 2 0 228.380 2.005 20 0 BEADRP CCC(CC)[N@H+](C1COC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001257292194 971180648 /nfs/dbraw/zinc/18/06/48/971180648.db2.gz TZSWOBKSJCIVII-AULYBMBSSA-N 2 0 240.391 2.146 20 0 BEADRP CC1(C)[C@H]([NH2+]CCc2cccs2)C[C@@H]1[NH3+] ZINC000404842981 971183899 /nfs/dbraw/zinc/18/38/99/971183899.db2.gz CHPDXWHVAMUQDX-WDEREUQCSA-N 2 0 224.373 2.006 20 0 BEADRP CCC[C@H](C)[NH2+][C@H]1C[C@H]2CC[N@H+](C1)[C@@H]2C ZINC001257309390 971202378 /nfs/dbraw/zinc/20/23/78/971202378.db2.gz KOHSMWUVVXFVFC-LOWDOPEQSA-N 2 0 210.365 2.247 20 0 BEADRP CCC1(C[NH2+][C@H]2C[C@H]([NH3+])C23CCC3)CCC1 ZINC000405201040 971208455 /nfs/dbraw/zinc/20/84/55/971208455.db2.gz AOAUARYTPCZZCG-RYUDHWBXSA-N 2 0 222.376 2.426 20 0 BEADRP CS[C@@H]1CC[C@H]([NH2+][C@H]2C[C@H]([NH3+])C23CCC3)C1 ZINC000405230983 971211673 /nfs/dbraw/zinc/21/16/73/971211673.db2.gz AUUJTZPENWOZMI-USZNOCQGSA-N 2 0 240.416 2.130 20 0 BEADRP CS[C@@H]1CC[C@H]([NH2+][C@@H]2C[C@@H]([NH3+])C23CCC3)C1 ZINC000405230981 971216436 /nfs/dbraw/zinc/21/64/36/971216436.db2.gz AUUJTZPENWOZMI-IRCOFANPSA-N 2 0 240.416 2.130 20 0 BEADRP Cc1cccc(C[NH2+][C@H]2C[C@H]([NH3+])C23CCC3)c1 ZINC000405256267 971220011 /nfs/dbraw/zinc/22/00/11/971220011.db2.gz MLIMGADDYRHEQO-KBPBESRZSA-N 2 0 230.355 2.355 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]CCc2cccs2)C12CCC2 ZINC000405261660 971226493 /nfs/dbraw/zinc/22/64/93/971226493.db2.gz NLNSWSUMSVFBSK-RYUDHWBXSA-N 2 0 236.384 2.150 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]CCc2ccccc2)C12CCC2 ZINC000405247934 971222722 /nfs/dbraw/zinc/22/27/22/971222722.db2.gz IFRLGQSHKLTBBN-KGLIPLIRSA-N 2 0 230.355 2.089 20 0 BEADRP CSC1(C[NH2+][C@H]2C[C@H]([NH3+])C23CCC3)CCC1 ZINC000405281382 971225205 /nfs/dbraw/zinc/22/52/05/971225205.db2.gz ZPYASJRWRYRHFP-QWRGUYRKSA-N 2 0 240.416 2.132 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]CC(C2CC2)C2CC2)C12CCC2 ZINC000405282569 971225566 /nfs/dbraw/zinc/22/55/66/971225566.db2.gz CKNPDFFIZXTCJB-KGLIPLIRSA-N 2 0 234.387 2.282 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]C2CCC(F)(F)CC2)C12CCC2 ZINC000405264422 971225687 /nfs/dbraw/zinc/22/56/87/971225687.db2.gz QNPJUIUGMJPRAL-MNOVXSKESA-N 2 0 244.329 2.424 20 0 BEADRP CCSCC[C@H](C)[NH2+][C@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405278871 971228305 /nfs/dbraw/zinc/22/83/05/971228305.db2.gz YJFKYHGNVXJJJH-TUAOUCFPSA-N 2 0 242.432 2.378 20 0 BEADRP CC1(C)[C@H]([NH3+])C[C@H]1[NH2+]CCc1cccc(F)c1 ZINC000405309453 971230329 /nfs/dbraw/zinc/23/03/29/971230329.db2.gz ZWHKSYUPRFXVPF-CHWSQXEVSA-N 2 0 236.334 2.084 20 0 BEADRP C[C@H](CCC1CC1)[NH2+][C@@H]1C[C@H]([NH3+])C12CCC2 ZINC000405304453 971232900 /nfs/dbraw/zinc/23/29/00/971232900.db2.gz LKLNQCHGCXGVBU-KGYLQXTDSA-N 2 0 222.376 2.425 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+][C@@H]2CC23CCCC3)C12CCC2 ZINC000405302373 971233973 /nfs/dbraw/zinc/23/39/73/971233973.db2.gz JERNBFITEPTBLP-IJLUTSLNSA-N 2 0 220.360 2.179 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]Cc2ccc(F)cc2)C12CCC2 ZINC000405325416 971235011 /nfs/dbraw/zinc/23/50/11/971235011.db2.gz UCIDWZYOXJHMME-CHWSQXEVSA-N 2 0 234.318 2.185 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+][C@H]2CC3CCC2CC3)C12CCC2 ZINC000405332910 971235435 /nfs/dbraw/zinc/23/54/35/971235435.db2.gz XKFMONOQKZGRBU-LFGDDXOXSA-N 2 0 234.387 2.425 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+][C@H]1C[C@H]([NH3+])C12CCC2 ZINC000405333928 971235624 /nfs/dbraw/zinc/23/56/24/971235624.db2.gz FQYSCPJTMCSBGK-VOAKCMCISA-N 2 0 222.376 2.425 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405333930 971237267 /nfs/dbraw/zinc/23/72/67/971237267.db2.gz FQYSCPJTMCSBGK-YVECIDJPSA-N 2 0 222.376 2.425 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+][C@@H]2C[C@@H]([NH3+])C23CCC3)C1 ZINC000405348586 971237848 /nfs/dbraw/zinc/23/78/48/971237848.db2.gz MLUUHVPJTBUJQK-YVECIDJPSA-N 2 0 222.376 2.282 20 0 BEADRP CC1(C[NH2+][C@H]2C[C@@H]([NH3+])C23CCC3)CCCC1 ZINC000405355445 971243276 /nfs/dbraw/zinc/24/32/76/971243276.db2.gz QPTHUUZGNDDXMB-NEPJUHHUSA-N 2 0 222.376 2.426 20 0 BEADRP C[C@@H]([NH2+][C@H]1C[C@@H]([NH3+])C12CCC2)C1CCCC1 ZINC000405356469 971243338 /nfs/dbraw/zinc/24/33/38/971243338.db2.gz RHXHTQRWDMFCEP-RTXFEEFZSA-N 2 0 222.376 2.425 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+][C@H]2C[C@@H]([NH3+])C23CCC3)C1 ZINC000405348433 971244009 /nfs/dbraw/zinc/24/40/09/971244009.db2.gz MLUUHVPJTBUJQK-XQHKEYJVSA-N 2 0 222.376 2.282 20 0 BEADRP CCCCCC[C@H](CC)[NH2+]CCOCC[NH3+] ZINC001170578461 971244143 /nfs/dbraw/zinc/24/41/43/971244143.db2.gz IRXMVIHFJPRJBG-ZDUSSCGKSA-N 2 0 230.396 2.300 20 0 BEADRP C[C@H]1CC[C@H]([NH2+][C@@H]2C[C@H]([NH3+])C23CCC3)CC1 ZINC000405376507 971247395 /nfs/dbraw/zinc/24/73/95/971247395.db2.gz BMRMGLRTOZBWGS-ZDEQEGDKSA-N 2 0 222.376 2.425 20 0 BEADRP CC(C)C1(C[NH2+][C@H]2C[C@H]([NH3+])C23CCC3)CC1 ZINC000405372914 971249927 /nfs/dbraw/zinc/24/99/27/971249927.db2.gz ZODRFVUZCXMXAF-RYUDHWBXSA-N 2 0 222.376 2.282 20 0 BEADRP CCCCCC[NH2+][C@H]1C[C@@H]([NH3+])C12CCC2 ZINC000405466710 971257579 /nfs/dbraw/zinc/25/75/79/971257579.db2.gz JZRVLCIALRDEJG-NEPJUHHUSA-N 2 0 210.365 2.426 20 0 BEADRP CCC1(C[NH2+][C@H]2C[C@@H]([NH3+])C23CCC3)CC1 ZINC000405480224 971257378 /nfs/dbraw/zinc/25/73/78/971257378.db2.gz MXOHATGBQPPNCA-MNOVXSKESA-N 2 0 208.349 2.036 20 0 BEADRP [NH3+]CCC1CCC([NH2+]C2CCCC2)CC1 ZINC001257345693 971254596 /nfs/dbraw/zinc/25/45/96/971254596.db2.gz GRJWOQLIXSHVLJ-UHFFFAOYSA-N 2 0 210.365 2.426 20 0 BEADRP C[NH+](C)[C@H]1CC[C@H]([NH2+]C2CCCC2)CC1 ZINC001257345662 971255765 /nfs/dbraw/zinc/25/57/65/971255765.db2.gz FPYQHFFKRMUMEJ-JOCQHMNTSA-N 2 0 210.365 2.391 20 0 BEADRP CCCCCC[NH2+][C@H]1C[C@H]([NH3+])C12CCC2 ZINC000405466712 971262012 /nfs/dbraw/zinc/26/20/12/971262012.db2.gz JZRVLCIALRDEJG-RYUDHWBXSA-N 2 0 210.365 2.426 20 0 BEADRP CCC1(C[NH2+][C@H]2C[C@H]([NH3+])C23CCC3)CC1 ZINC000405480226 971262097 /nfs/dbraw/zinc/26/20/97/971262097.db2.gz MXOHATGBQPPNCA-QWRGUYRKSA-N 2 0 208.349 2.036 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+][C@H]1C[C@H]([NH3+])C12CCC2 ZINC000405509891 971267097 /nfs/dbraw/zinc/26/70/97/971267097.db2.gz SNJXBVHCCRGBPH-RHYQMDGZSA-N 2 0 208.349 2.035 20 0 BEADRP CC[N@H+](C)C1CC[NH+](C2CCCC2)CC1 ZINC001257354751 971267123 /nfs/dbraw/zinc/26/71/23/971267123.db2.gz IDQPXKYLYMOZMQ-UHFFFAOYSA-N 2 0 210.365 2.345 20 0 BEADRP CCCCCC[C@@H](CC)[NH2+]CCN(C)CC[NH3+] ZINC001170585730 971277297 /nfs/dbraw/zinc/27/72/97/971277297.db2.gz GSJKGMXLVPXAMP-CQSZACIVSA-N 2 0 243.439 2.216 20 0 BEADRP CCCCCC[C@H](CC)[NH2+]CCN(C)CC[NH3+] ZINC001170585729 971277555 /nfs/dbraw/zinc/27/75/55/971277555.db2.gz GSJKGMXLVPXAMP-AWEZNQCLSA-N 2 0 243.439 2.216 20 0 BEADRP CC[C@@H](C)[NH2+]CC1CC[NH+](C(C)C)CC1 ZINC001257429805 971336636 /nfs/dbraw/zinc/33/66/36/971336636.db2.gz ZPXNEJQROZNMTL-GFCCVEGCSA-N 2 0 212.381 2.495 20 0 BEADRP CC[C@@H](C)C[C@H](CC)[NH+]1CC2(C1)CC[NH2+]C2 ZINC000724058038 971381027 /nfs/dbraw/zinc/38/10/27/971381027.db2.gz WFXIFAJMTPNKEU-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP CC[N@H+]1C[C@@H]2C[NH+](C3CCCCC3)C[C@@H]2C1 ZINC001257467096 971389678 /nfs/dbraw/zinc/38/96/78/971389678.db2.gz UWYVOZAPIBRXKR-BETUJISGSA-N 2 0 222.376 2.203 20 0 BEADRP C[NH+]1C(C)(C)CC([NH2+]C2CSC2)CC1(C)C ZINC001171621095 974111704 /nfs/dbraw/zinc/11/17/04/974111704.db2.gz JWCKRPNLYDGWTC-UHFFFAOYSA-N 2 0 242.432 2.343 20 0 BEADRP [NH3+]CCCCCCCO[C@@H]1C[NH2+]CCC[C@@H]1F ZINC001217772373 971397900 /nfs/dbraw/zinc/39/79/00/971397900.db2.gz BHPIAWFYFXPEPH-QWHCGFSZSA-N 2 0 246.370 2.002 20 0 BEADRP C[C@H]1C[NH2+]CCC[C@@H]1OCc1ccc(C[NH3+])cc1 ZINC001217772187 971398083 /nfs/dbraw/zinc/39/80/83/971398083.db2.gz ANSXENFKHGDMJM-WFASDCNBSA-N 2 0 248.370 2.050 20 0 BEADRP [NH3+]Cc1ccccc1C[NH2+][C@H]1CCCSC1 ZINC001257663507 971464037 /nfs/dbraw/zinc/46/40/37/971464037.db2.gz APUPCBFBPUGURP-ZDUSSCGKSA-N 2 0 236.384 2.131 20 0 BEADRP CCC[N@H+](C)C1CC[NH+](CC(C)C)CC1 ZINC001258011278 971551918 /nfs/dbraw/zinc/55/19/18/971551918.db2.gz JEVYAFGIUVRXRP-UHFFFAOYSA-N 2 0 212.381 2.449 20 0 BEADRP CC(C)C[NH+]1CCC(n2ccc(C[NH3+])c2)CC1 ZINC001258006850 971552979 /nfs/dbraw/zinc/55/29/79/971552979.db2.gz MGBAEPJFZHGXHP-UHFFFAOYSA-N 2 0 235.375 2.240 20 0 BEADRP CC(C)C[NH+]1CCC(n2cccc2CC[NH3+])CC1 ZINC001258005369 971554994 /nfs/dbraw/zinc/55/49/94/971554994.db2.gz POQNRQBLCRETOF-UHFFFAOYSA-N 2 0 249.402 2.282 20 0 BEADRP C[C@H]([NH3+])c1ccc(O[C@H]2CCC[NH2+]C[C@@H]2C)cc1 ZINC001217996149 971566151 /nfs/dbraw/zinc/56/61/51/971566151.db2.gz QPSOROSLPFKVLO-HUBLWGQQSA-N 2 0 248.370 2.473 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1Oc1ccc2c(c1)C[NH2+]C2 ZINC001218028379 971577120 /nfs/dbraw/zinc/57/71/20/971577120.db2.gz FORGIQDPBXLDQC-NHYWBVRUSA-N 2 0 246.354 2.057 20 0 BEADRP [NH3+]Cc1ccc(OC2CC3(C2)CC[NH2+]CC3)cc1 ZINC001218106808 971600573 /nfs/dbraw/zinc/60/05/73/971600573.db2.gz VLICEZIHRVDTDY-UHFFFAOYSA-N 2 0 246.354 2.056 20 0 BEADRP CC1(C)[C@@H]2C[C@H]([NH2+][C@@H]3CCC[C@H]([NH3+])C3)C[C@@H]21 ZINC001170709673 971611729 /nfs/dbraw/zinc/61/17/29/971611729.db2.gz CDWUZRJZGFAUHU-OFTGVCEQSA-N 2 0 222.376 2.281 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH2+][C@@H]2C[C@@H]3[C@H](C2)C3(C)C)CC1 ZINC001170721691 971642397 /nfs/dbraw/zinc/64/23/97/971642397.db2.gz YLAOSUQMMSKZBK-SYQHCUMBSA-N 2 0 236.403 2.495 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH2+][C@H]2C[C@@H]3[C@H](C2)C3(C)C)CC1 ZINC001170721694 971645832 /nfs/dbraw/zinc/64/58/32/971645832.db2.gz YLAOSUQMMSKZBK-YIYPIFLZSA-N 2 0 236.403 2.495 20 0 BEADRP CC(C)[N@@H+]1CC[C@H](Oc2cccc(C[NH3+])c2)C1 ZINC001218291948 971688965 /nfs/dbraw/zinc/68/89/65/971688965.db2.gz MKLXMRYFDARYQX-AWEZNQCLSA-N 2 0 234.343 2.007 20 0 BEADRP C[NH+](C)C1CCC(Oc2cccc(C[NH3+])c2)CC1 ZINC001218301378 971698024 /nfs/dbraw/zinc/69/80/24/971698024.db2.gz GPQQYQZKSHAVCG-UHFFFAOYSA-N 2 0 248.370 2.397 20 0 BEADRP CCSCC[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172102707 974358770 /nfs/dbraw/zinc/35/87/70/974358770.db2.gz OKBFBGMNCLSQPV-CLLJXQQHSA-N 2 0 242.432 2.344 20 0 BEADRP C[C@@H]([NH3+])c1ccc(O[C@H]2CC[NH2+]CC2(C)C)cc1 ZINC001218317898 971705877 /nfs/dbraw/zinc/70/58/77/971705877.db2.gz RJXUNRHUVKKDRT-RISCZKNCSA-N 2 0 248.370 2.473 20 0 BEADRP C[N@@H+]1CC[C@]2(CC[NH+]([C@@H]3C[C@@H]4[C@H](C3)C4(C)C)C2)C1 ZINC001170763742 971748236 /nfs/dbraw/zinc/74/82/36/971748236.db2.gz CMBDVZHDGKKAGA-AYDFFVQHSA-N 2 0 248.414 2.449 20 0 BEADRP CC1(C)C[C@H](Oc2cccc3c2C[NH2+]C3)CC[NH2+]1 ZINC001218477795 971827942 /nfs/dbraw/zinc/82/79/42/971827942.db2.gz ROKDXKKCZDNTTK-GFCCVEGCSA-N 2 0 246.354 2.199 20 0 BEADRP CC[C@H](C)OCC[C@H](C)[N@H+](C)C[C@@H](C)C[NH3+] ZINC001172326025 974530130 /nfs/dbraw/zinc/53/01/30/974530130.db2.gz ABXKNBXOUHCQKK-AVGNSLFASA-N 2 0 230.396 2.107 20 0 BEADRP [NH3+]CC1(F)CC[NH+](CCC2CCCC2)CC1 ZINC001222526862 972541509 /nfs/dbraw/zinc/54/15/09/972541509.db2.gz GQFYPQMMHMBWPY-UHFFFAOYSA-N 2 0 228.355 2.330 20 0 BEADRP C[NH+](C)[C@H]1CCC[C@H](Nc2cc[nH+]cc2)C1 ZINC000309981941 971907786 /nfs/dbraw/zinc/90/77/86/971907786.db2.gz WLVYGQGBBVVANU-STQMWFEESA-N 2 0 219.332 2.366 20 0 BEADRP COc1ccccc1C[N@@H+]1CCCC[C@@H](C[NH3+])C1 ZINC000311002592 971987975 /nfs/dbraw/zinc/98/79/75/971987975.db2.gz IQFIFEVQOFPCKT-ZDUSSCGKSA-N 2 0 248.370 2.256 20 0 BEADRP [NH3+]C[C@H]1CCCC[N@H+](CCOc2ccccc2)C1 ZINC000311211275 971993441 /nfs/dbraw/zinc/99/34/41/971993441.db2.gz LCQULTGPAAWBEZ-CQSZACIVSA-N 2 0 248.370 2.126 20 0 BEADRP CC[C@]([NH3+])(CO)Nc1ccc2c(C)ccnc2c1 ZINC001170864078 971999410 /nfs/dbraw/zinc/99/94/10/971999410.db2.gz RBYSBZRNCDDSGQ-CQSZACIVSA-N 2 0 245.326 2.012 20 0 BEADRP Cc1cc2cc[nH]c2c(NCC[C@@H](C)[NH3+])[nH+]1 ZINC001170889881 972039191 /nfs/dbraw/zinc/03/91/91/972039191.db2.gz WYUBQUHKTWBQTE-MRVPVSSYSA-N 2 0 218.304 2.021 20 0 BEADRP C[C@@H]([NH3+])CCNc1cc[nH+]c(N2CCCCC2)c1 ZINC001170891197 972046696 /nfs/dbraw/zinc/04/66/96/972046696.db2.gz QXQBUVHGTULORT-GFCCVEGCSA-N 2 0 248.374 2.221 20 0 BEADRP [NH3+]CCC[C@H]([NH3+])Nc1ccc(F)c2ccccc12 ZINC001170898530 972052707 /nfs/dbraw/zinc/05/27/07/972052707.db2.gz CWPCGARFFKINMZ-CQSZACIVSA-N 2 0 247.317 2.415 20 0 BEADRP CCc1cccc(CC)c1N[C@H]([NH3+])CCC[NH3+] ZINC001170906949 972079561 /nfs/dbraw/zinc/07/95/61/972079561.db2.gz ZADBUWJQQKEANZ-ZDUSSCGKSA-N 2 0 235.375 2.247 20 0 BEADRP Cc1ccc(C[C@@H](C)[NH2+]C2CC[NH2+]CC2)cc1 ZINC001246077794 972131628 /nfs/dbraw/zinc/13/16/28/972131628.db2.gz KQVPDZXEQIUERG-CYBMUJFWSA-N 2 0 232.371 2.268 20 0 BEADRP CC[C@@H]1CC[C@H]([NH2+]C[C@@H]2C[NH2+]C[C@H](C)C2)C1 ZINC001246103862 972164499 /nfs/dbraw/zinc/16/44/99/972164499.db2.gz TZLCKVBNRJGOLZ-MQYQWHSLSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1[NH2+]CCC[C@H]1C[NH2+][C@H]1C[C@@H]2[C@H](C1)C2(C)C ZINC001246112008 972176629 /nfs/dbraw/zinc/17/66/29/972176629.db2.gz QEZLZMJXUPUWBL-YHQUGGNUSA-N 2 0 236.403 2.399 20 0 BEADRP C[C@H]1C[NH2+]C[C@H]1[NH2+][C@@H]1C[C@H](C)CC(C)(C)C1 ZINC001246116497 972179673 /nfs/dbraw/zinc/17/96/73/972179673.db2.gz MRTLBRBZQWCLME-WUHRBBMRSA-N 2 0 224.392 2.399 20 0 BEADRP CCCC[C@@H](CC)[NH2+][C@@H]1C[NH2+]CC12CC2 ZINC001246133536 972191939 /nfs/dbraw/zinc/19/19/39/972191939.db2.gz OEJBEZRYJIXBNA-VXGBXAGGSA-N 2 0 210.365 2.297 20 0 BEADRP CCCC[C@@H](CC(C)C)[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001246148936 972194312 /nfs/dbraw/zinc/19/43/12/972194312.db2.gz OMKRWWJULFOSTE-IGQOVBAYSA-N 2 0 224.392 2.399 20 0 BEADRP Cc1cc2[nH]ccc2c(NC[C@@H]2CCCC[NH2+]2)[nH+]1 ZINC001160148235 972218594 /nfs/dbraw/zinc/21/85/94/972218594.db2.gz PPBKTXLDKNCCKE-NSHDSACASA-N 2 0 244.342 2.425 20 0 BEADRP COC1(C[N@H+](C)CCCCCC[NH3+])CCCC1 ZINC000710797068 956873843 /nfs/dbraw/zinc/87/38/43/956873843.db2.gz FQJHAYNCSHQRAQ-UHFFFAOYSA-N 2 0 242.407 2.397 20 0 BEADRP Cc1c(F)cccc1C[NH2+][C@H]1CC[NH2+][C@H](C)C1 ZINC001246228295 972233152 /nfs/dbraw/zinc/23/31/52/972233152.db2.gz XALGBHYKEIYBOR-MFKMUULPSA-N 2 0 236.334 2.364 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)CC[C@H](C)SC ZINC001208149260 957029227 /nfs/dbraw/zinc/02/92/27/957029227.db2.gz MWALOSVQLGTODE-LBPRGKRZSA-N 2 0 232.437 2.402 20 0 BEADRP CC[C@H]1CCC[N@H+](C[C@H]2CCC[NH+](C)C2)C1 ZINC001208608375 957086192 /nfs/dbraw/zinc/08/61/92/957086192.db2.gz IDQJGGCMPZXSIJ-KBPBESRZSA-N 2 0 224.392 2.450 20 0 BEADRP C[C@@H]1CCCC[N@H+](C[C@H]2CCC[NH+](C)C2)C1 ZINC001208607294 957088861 /nfs/dbraw/zinc/08/88/61/957088861.db2.gz LHZBQFMSYMRETG-KGLIPLIRSA-N 2 0 224.392 2.450 20 0 BEADRP C[C@@H]1C[C@H](C)C[N@@H+](C[C@H]2CCC[NH+](C)C2)C1 ZINC001208612295 957101131 /nfs/dbraw/zinc/10/11/31/957101131.db2.gz MFVXODISJGBEEM-MJBXVCDLSA-N 2 0 224.392 2.306 20 0 BEADRP CC(C)C([NH2+][C@@H]1CCCC[NH2+]C1)C(C)C ZINC001246236600 972242586 /nfs/dbraw/zinc/24/25/86/972242586.db2.gz MRJOMJZXTJCFHO-GFCCVEGCSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]Cc1cccc2c1OCC2 ZINC000692968330 957162513 /nfs/dbraw/zinc/16/25/13/957162513.db2.gz XCDANVPWQPOHPB-GFCCVEGCSA-N 2 0 248.370 2.229 20 0 BEADRP CCCC[C@@H]1C[C@@H](NCC[C@H]([NH3+])CC)CC[NH2+]1 ZINC001246308888 972271011 /nfs/dbraw/zinc/27/10/11/972271011.db2.gz SXJYMRBJMWSILC-MCIONIFRSA-N 2 0 241.423 2.014 20 0 BEADRP C[NH+](C)CCCC[NH2+]Cc1cccc2c1OCC2 ZINC000693079195 957651283 /nfs/dbraw/zinc/65/12/83/957651283.db2.gz HRKSXXZFPNRVBN-UHFFFAOYSA-N 2 0 248.370 2.053 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+]C2CCCCC2)C[NH2+]1 ZINC000397543170 957682360 /nfs/dbraw/zinc/68/23/60/957682360.db2.gz ZAPBZJVGIOZXED-NEPJUHHUSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]1C[C@H]([NH2+]Cc2ccc3ocnc3c2)CC[NH2+]1 ZINC001246332462 972295805 /nfs/dbraw/zinc/29/58/05/972295805.db2.gz MGBPVLOFNZLYOK-CMPLNLGQSA-N 2 0 245.326 2.058 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc3ncoc3c2)CC[NH2+]1 ZINC001246335592 972296491 /nfs/dbraw/zinc/29/64/91/972296491.db2.gz ZPTCXCWDNHTPGS-PWSUYJOCSA-N 2 0 245.326 2.058 20 0 BEADRP Cc1ccc(C[C@@H](C)[NH2+]C[C@@H]([NH3+])C(C)C)cc1 ZINC001246333505 972296583 /nfs/dbraw/zinc/29/65/83/972296583.db2.gz RABNKXOZUHFBTK-UKRRQHHQSA-N 2 0 234.387 2.499 20 0 BEADRP CC[C@]1([NH2+][C@@H]2CCC[C@H](C)C2)CC[NH2+]C1 ZINC001246461889 972335205 /nfs/dbraw/zinc/33/52/05/972335205.db2.gz QHBGXPVPTHBTDF-XQQFMLRXSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H](CC(F)(F)F)[NH2+]C[C@H]1C[NH2+]C[C@@H](C)C1 ZINC000398645027 958339462 /nfs/dbraw/zinc/33/94/62/958339462.db2.gz BVOLTLWMYWIHCP-LPEHRKFASA-N 2 0 238.297 2.163 20 0 BEADRP C[NH2+][C@H]1C[C@@H]([NH2+][C@@H]2CCc3ccc(C)cc3C2)C1 ZINC001246493530 972352059 /nfs/dbraw/zinc/35/20/59/972352059.db2.gz BYRFDXKJAYGSAP-OAGGEKHMSA-N 2 0 244.382 2.192 20 0 BEADRP C([NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23)[C@@]12C[C@@H]1CCCC2 ZINC000693529201 958718364 /nfs/dbraw/zinc/71/83/64/958718364.db2.gz WDZGHGBTZPWXCI-AHWCTLNISA-N 2 0 246.398 2.153 20 0 BEADRP Cc1nc(C)c([C@@H](C)[NH2+]C[C@H]2C[C@@H]([NH3+])C2)s1 ZINC000693543999 958744940 /nfs/dbraw/zinc/74/49/40/958744940.db2.gz DIUBRACRGFBOBI-ONOSFVFSSA-N 2 0 239.388 2.148 20 0 BEADRP C[C@H](C[NH2+]C1C[C@H]2CC[C@@H](C1)S2)C[NH+](C)C ZINC000403636659 958752704 /nfs/dbraw/zinc/75/27/04/958752704.db2.gz NQWNDWCVIVZHEE-ODWCKFRGSA-N 2 0 242.432 2.200 20 0 BEADRP C([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)[C@]12C[C@H]1CCC2 ZINC000693570707 958865491 /nfs/dbraw/zinc/86/54/91/958865491.db2.gz ZKNWNGZWAJZENO-RYPNDVFKSA-N 2 0 234.387 2.154 20 0 BEADRP CC(C)(C)[C@H]1CC[N@H+](C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000693578100 958868057 /nfs/dbraw/zinc/86/80/57/958868057.db2.gz JBBUAUFYLDPQAJ-SDDRHHMPSA-N 2 0 210.365 2.092 20 0 BEADRP C[C@H]1CCC[C@@H]([N@H+](C)C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000693579984 958870194 /nfs/dbraw/zinc/87/01/94/958870194.db2.gz RJVFKKJWQKFCJX-WUHRBBMRSA-N 2 0 210.365 2.234 20 0 BEADRP C[C@@H]1CCC[C@@H]([N@H+](C)C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000693579975 958870863 /nfs/dbraw/zinc/87/08/63/958870863.db2.gz RJVFKKJWQKFCJX-FVCCEPFGSA-N 2 0 210.365 2.234 20 0 BEADRP C[NH+]1CCC(C[NH2+]C[C@]23C[C@H]2CCC3)CC1 ZINC000693622479 959022580 /nfs/dbraw/zinc/02/25/80/959022580.db2.gz RIIGTHQJTWJMLI-KGLIPLIRSA-N 2 0 222.376 2.108 20 0 BEADRP Cc1ccc(C[C@H](C)N2CC[C@](C)([NH3+])C2)cc1 ZINC001246526786 972397029 /nfs/dbraw/zinc/39/70/29/972397029.db2.gz BTBZSQIMPJGXKD-ZFWWWQNUSA-N 2 0 232.371 2.349 20 0 BEADRP Cc1ccc(C[C@@H](C)N2CC[C@@](C)([NH3+])C2)cc1 ZINC001246526781 972398389 /nfs/dbraw/zinc/39/83/89/972398389.db2.gz BTBZSQIMPJGXKD-UKRRQHHQSA-N 2 0 232.371 2.349 20 0 BEADRP CC(F)(F)CC[NH2+][C@@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C ZINC000693714848 959223209 /nfs/dbraw/zinc/22/32/09/959223209.db2.gz BFRCELXKOFUDPW-OUAUKWLOSA-N 2 0 246.345 2.398 20 0 BEADRP CC[C@@H](C)C[N@@H+]1CCC[C@]12CCC[NH2+]C2 ZINC001222232897 972415828 /nfs/dbraw/zinc/41/58/28/972415828.db2.gz YKXBGZNFJAGNPV-OLZOCXBDSA-N 2 0 210.365 2.251 20 0 BEADRP CC(C)C[NH2+]Cc1cccc2c1CC[NH2+]C2 ZINC000125649216 959286821 /nfs/dbraw/zinc/28/68/21/959286821.db2.gz DIXJRDPJBRSABU-UHFFFAOYSA-N 2 0 218.344 2.078 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[NH2+][C@@H]2CCC23CCCC3)C1 ZINC000693888146 959479295 /nfs/dbraw/zinc/47/92/95/959479295.db2.gz OZAPXHGZQNSZNL-YNEHKIRRSA-N 2 0 222.376 2.426 20 0 BEADRP C[C@@H](NCC[C@@H]1CCC[N@@H+]1C)c1cncs1 ZINC000693892813 959483263 /nfs/dbraw/zinc/48/32/63/959483263.db2.gz DQKHKBXEQZVGIR-MNOVXSKESA-N 2 0 239.388 2.278 20 0 BEADRP C(C1CC[NH2+]CC1)[NH+]1CCC2(CCC2)CC1 ZINC000308741920 959494028 /nfs/dbraw/zinc/49/40/28/959494028.db2.gz VTTLIKSFPBKZJJ-UHFFFAOYSA-N 2 0 222.376 2.252 20 0 BEADRP [NH3+]CCCCCCCO[C@H]1CC[C@@]12CC[NH2+]C2 ZINC001217808558 959619174 /nfs/dbraw/zinc/61/91/74/959619174.db2.gz MTEWFGIUHZCCRT-KBPBESRZSA-N 2 0 240.391 2.054 20 0 BEADRP Cc1cccc2c1CC[C@H]([N@@H+]1CC[C@](C)([NH3+])C1)C2 ZINC001246532154 972445079 /nfs/dbraw/zinc/44/50/79/972445079.db2.gz UMHJDLRHOHQENJ-HOCLYGCPSA-N 2 0 244.382 2.275 20 0 BEADRP C([NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23)[C@H]1CCC[C@@H]2C[C@@H]21 ZINC000694274866 959816135 /nfs/dbraw/zinc/81/61/35/959816135.db2.gz ALPUVLITTNPRFG-VSPOPZGASA-N 2 0 246.398 2.009 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)C12CCC2 ZINC000694362893 959840724 /nfs/dbraw/zinc/84/07/24/959840724.db2.gz XNFASBSKGYGBIK-MLGHIDQZSA-N 2 0 220.360 2.035 20 0 BEADRP Cc1ccc(C[N@@H+]2CCCC[C@@H](C[NH3+])C2)o1 ZINC000309488519 959887245 /nfs/dbraw/zinc/88/72/45/959887245.db2.gz XQIZROQWJRQICI-LBPRGKRZSA-N 2 0 222.332 2.149 20 0 BEADRP C[C@H]1C[N@@H+]([C@H]2CC[C@@H](C)[C@H](C)C2)C[C@H]1C[NH3+] ZINC000708870668 959991073 /nfs/dbraw/zinc/99/10/73/959991073.db2.gz MNKURBWAUIAWSS-RGDJUOJXSA-N 2 0 224.392 2.338 20 0 BEADRP C1=C[C@@H]2C[C@H]1C[C@@H]2C[N@@H+]1CC[C@]2(C1)CCCC[NH2+]2 ZINC001222422478 972473374 /nfs/dbraw/zinc/47/33/74/972473374.db2.gz VBLWAPXEEVNXIA-JJXSEGSLSA-N 2 0 246.398 2.417 20 0 BEADRP CC(C)OC1CC[NH+](C[C@@H]2CC[C@H]([NH3+])C2)CC1 ZINC000695109801 960101052 /nfs/dbraw/zinc/10/10/52/960101052.db2.gz FOFYCPMYTRPZKE-OLZOCXBDSA-N 2 0 240.391 2.003 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+][C@@H]2CCCC(F)(F)C2)C12CCC2 ZINC000695112746 960106894 /nfs/dbraw/zinc/10/68/94/960106894.db2.gz MFHFMFWVCAXKOR-GMTAPVOTSA-N 2 0 244.329 2.424 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+][C@@H]1CCCC2(CC2)C1 ZINC000695690179 960375831 /nfs/dbraw/zinc/37/58/31/960375831.db2.gz ODAMBDIBVMIXFX-OLZOCXBDSA-N 2 0 240.391 2.053 20 0 BEADRP C1CC12CCC[C@H]([NH2+][C@H]1[C@@H]3[NH2+]C[C@@H]4C[C@H]1C[C@@H]43)C2 ZINC000695700209 960382981 /nfs/dbraw/zinc/38/29/81/960382981.db2.gz MFUYDCITWRGZLE-GXYBRJDSSA-N 2 0 246.398 2.295 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](CC2CCC3(CC3)CC2)C1 ZINC000695717251 960399519 /nfs/dbraw/zinc/39/95/19/960399519.db2.gz IJSRBIPCVWANGJ-AWEZNQCLSA-N 2 0 236.403 2.498 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCCC2(CC2)C1)[C@@H]1CCC[NH2+]1 ZINC000695725400 960404931 /nfs/dbraw/zinc/40/49/31/960404931.db2.gz WWEKUBFVAFTXGF-XQQFMLRXSA-N 2 0 222.376 2.439 20 0 BEADRP C[C@@H]1CCCC[N@@H+]1CCCNc1c[nH+]cn1C ZINC001167751965 960541091 /nfs/dbraw/zinc/54/10/91/960541091.db2.gz QEOHOLFDCWGTSB-GFCCVEGCSA-N 2 0 236.363 2.097 20 0 BEADRP C[C@H](C[NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2)c1ccccn1 ZINC000692744338 960566060 /nfs/dbraw/zinc/56/60/60/960566060.db2.gz GBJVNHFLEWBTOZ-MRVWCRGKSA-N 2 0 245.370 2.045 20 0 BEADRP FC1(F)CC[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000709401140 960573052 /nfs/dbraw/zinc/57/30/52/960573052.db2.gz AYYAYGKJEBJRLY-JDUUOCRZSA-N 2 0 230.302 2.047 20 0 BEADRP Cc1c[nH]c(C[NH+]2CCC(C[NH+](C)C)CC2)c1C ZINC001140859599 960634333 /nfs/dbraw/zinc/63/43/33/960634333.db2.gz BFVKRPTWANPOJR-UHFFFAOYSA-N 2 0 249.402 2.405 20 0 BEADRP Cc1c[nH]c(C[NH+]2C[C@H]3CC[N@@H+](C)C[C@H]3C2)c1C ZINC001140859893 960636536 /nfs/dbraw/zinc/63/65/36/960636536.db2.gz DYIRCFUDLHJFKK-KGLIPLIRSA-N 2 0 247.386 2.015 20 0 BEADRP C[C@@H](Cc1ccco1)[N@@H+]1CCC[C@H]([NH3+])CC1 ZINC001246539079 972530349 /nfs/dbraw/zinc/53/03/49/972530349.db2.gz ATHBRRKLTHOCDE-RYUDHWBXSA-N 2 0 222.332 2.024 20 0 BEADRP C[N@H+](CCF)Cc1cccc(-n2ccnc2)c1 ZINC001141245318 961020371 /nfs/dbraw/zinc/02/03/71/961020371.db2.gz IVWGXVVRKWHPRM-UHFFFAOYSA-N 2 0 233.290 2.274 20 0 BEADRP [NH3+]CCC1CCC([NH2+][C@H]2C[C@H]3C[C@H]3C2)CC1 ZINC001167914435 961182291 /nfs/dbraw/zinc/18/22/91/961182291.db2.gz VJUAQVUZRMCUSW-XEJFGBPMSA-N 2 0 222.376 2.282 20 0 BEADRP [NH2+]=CNc1cccc2c1C1(C=C2)CC[NH2+]CC1 ZINC001167866127 961342901 /nfs/dbraw/zinc/34/29/01/961342901.db2.gz ZKGUGOAXWFWTBQ-UHFFFAOYSA-N 2 0 227.311 2.354 20 0 BEADRP C[C@H](Cc1ccccc1Cl)[NH2+]C1CC([NH3+])C1 ZINC000087651393 961600164 /nfs/dbraw/zinc/60/01/64/961600164.db2.gz ZNAPBAAPKJSQFJ-OIKLOGQESA-N 2 0 238.762 2.350 20 0 BEADRP C[C@H](Cc1ccc(Cl)cc1)[NH2+]C1CC([NH3+])C1 ZINC000087651395 961602740 /nfs/dbraw/zinc/60/27/40/961602740.db2.gz OKDCXGMLIIBTLI-UHEGKEBESA-N 2 0 238.762 2.350 20 0 BEADRP [NH3+]Cc1ccccc1C[NH2+][C@H]1C[C@H]2C[C@H]2C1 ZINC001167908254 961805714 /nfs/dbraw/zinc/80/57/14/961805714.db2.gz CEVICBIJCOWMKY-WDNDVIMCSA-N 2 0 216.328 2.033 20 0 BEADRP C[NH+]1CCC(CCC[NH2+][C@H]2C[C@H]3C[C@H]3C2)CC1 ZINC001167915017 961839335 /nfs/dbraw/zinc/83/93/35/961839335.db2.gz ZJSGOYAFPQGIBU-FICVDOATSA-N 2 0 236.403 2.497 20 0 BEADRP c1cc(N2CC[NH+]([C@H]3C[C@H]4C[C@H]4C3)CC2)cc[nH+]1 ZINC001167923761 961992597 /nfs/dbraw/zinc/99/25/97/961992597.db2.gz ITRNCSKUNNVBGT-NHAGDIPZSA-N 2 0 243.354 2.002 20 0 BEADRP Cc1cc(C[N@@H+]2CCCC[C@H](C[NH3+])C2)cnc1C ZINC001206632293 962123953 /nfs/dbraw/zinc/12/39/53/962123953.db2.gz IKTSCTZTUUOJQJ-CQSZACIVSA-N 2 0 247.386 2.259 20 0 BEADRP C[C@@H]1CC[C@@H]([N@H+](C)CC2CC[NH+](C)CC2)C1 ZINC000093088602 963294847 /nfs/dbraw/zinc/29/48/47/963294847.db2.gz OYJNFIGVDDRGHY-TZMCWYRMSA-N 2 0 224.392 2.449 20 0 BEADRP Cc1c[nH+]c(NCC[C@H]2CCC[N@@H+](C)C2)c(N)c1 ZINC001156390429 963329576 /nfs/dbraw/zinc/32/95/76/963329576.db2.gz YIYQILNQCXAXNK-GFCCVEGCSA-N 2 0 248.374 2.116 20 0 BEADRP CC(C)[NH+]1CCC(CNc2cc(N)cc[nH+]2)CC1 ZINC001156495153 963371348 /nfs/dbraw/zinc/37/13/48/963371348.db2.gz RMAHRYHMOFMLHB-UHFFFAOYSA-N 2 0 248.374 2.196 20 0 BEADRP Cc1c[nH+]c(NC2(C)CC[NH2+]CC2)cc1C ZINC001157402869 963598917 /nfs/dbraw/zinc/59/89/17/963598917.db2.gz HRNUVDJLAXQPIS-UHFFFAOYSA-N 2 0 219.332 2.252 20 0 BEADRP CC[NH+](CC)CCCC[NH2+][C@H]1CCO[C@@H](C)C1 ZINC001168072524 963605667 /nfs/dbraw/zinc/60/56/67/963605667.db2.gz SWNIQTKOQLWWNN-KBPBESRZSA-N 2 0 242.407 2.266 20 0 BEADRP CCCC[N@H+](C)CCC[NH2+][C@@H]1CCO[C@H](C)C1 ZINC001168075752 963615785 /nfs/dbraw/zinc/61/57/85/963615785.db2.gz QNFXQWAFPUFXMK-ZIAGYGMSSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CCCCCCC[NH3+])CCO1 ZINC001168086376 963656316 /nfs/dbraw/zinc/65/63/16/963656316.db2.gz FKANKVNNUOTNMX-STQMWFEESA-N 2 0 228.380 2.053 20 0 BEADRP CC[C@@H](C)C[N@H+](C)C[C@H]1CCCC[NH2+]C1 ZINC000697043913 963667638 /nfs/dbraw/zinc/66/76/38/963667638.db2.gz XPIYHECUAPIJEY-OLZOCXBDSA-N 2 0 212.381 2.354 20 0 BEADRP C[NH2+]CC[C@H](C)[NH2+]C[C@@H]1CCCC[C@@H]1C ZINC000714413443 963689648 /nfs/dbraw/zinc/68/96/48/963689648.db2.gz QRZAFQBJYAAXBO-AVGNSLFASA-N 2 0 212.381 2.400 20 0 BEADRP Cc1cc2[nH]ccc2c(NCC[C@H]2CCC[NH2+]2)[nH+]1 ZINC001158628218 963897486 /nfs/dbraw/zinc/89/74/86/963897486.db2.gz ZSSWDEKZSHJSAO-LLVKDONJSA-N 2 0 244.342 2.425 20 0 BEADRP c1c(NC2=C[NH2+]CCC2)onc1[C@H]1CCCC[NH2+]1 ZINC001159313937 964055382 /nfs/dbraw/zinc/05/53/82/964055382.db2.gz VUTJDDOIRXCJCT-LLVKDONJSA-N 2 0 248.330 2.126 20 0 BEADRP Cc1cccc2[nH+]cc(NC=C3CC[NH2+]CC3)n21 ZINC001159363834 964067462 /nfs/dbraw/zinc/06/74/62/964067462.db2.gz AUWAICSGIDVPFK-UHFFFAOYSA-N 2 0 242.326 2.322 20 0 BEADRP C1=C(Nc2cccc(C3CC[NH2+]CC3)c2)C[NH2+]C1 ZINC001159756724 964180591 /nfs/dbraw/zinc/18/05/91/964180591.db2.gz FBLKOXFJNMCHNE-UHFFFAOYSA-N 2 0 243.354 2.053 20 0 BEADRP COc1ccc2ccc(NCC[C@@H](C)[NH3+])nc2c1 ZINC001159773086 964186254 /nfs/dbraw/zinc/18/62/54/964186254.db2.gz VOVUJTLPXLFXTI-SNVBAGLBSA-N 2 0 245.326 2.393 20 0 BEADRP c1cc([C@@H]2CC[NH2+]C2)ccc1NC1=C[NH2+]CCC1 ZINC001159776744 964192333 /nfs/dbraw/zinc/19/23/33/964192333.db2.gz HOOMDVYVQKALET-CYBMUJFWSA-N 2 0 243.354 2.400 20 0 BEADRP Cn1ccc2c1cc[nH+]c2NC[C@@H]1CCCC[NH2+]1 ZINC001160144529 964253963 /nfs/dbraw/zinc/25/39/63/964253963.db2.gz GEUZSSHLYYXNJT-NSHDSACASA-N 2 0 244.342 2.127 20 0 BEADRP c1cc2c[nH+]c(NC[C@H]3CCCC[NH2+]3)cc2[nH]1 ZINC001160145196 964255162 /nfs/dbraw/zinc/25/51/62/964255162.db2.gz OPHRGMDDSYZQLU-LLVKDONJSA-N 2 0 230.315 2.117 20 0 BEADRP C[NH+](C)C1CCC([NH2+]CC(=O)C(C)(C)C)CC1 ZINC001168295248 964387695 /nfs/dbraw/zinc/38/76/95/964387695.db2.gz YRDSXWUUXJIABH-UHFFFAOYSA-N 2 0 240.391 2.064 20 0 BEADRP Cc1ccc(C[NH2+]C2CCC([NH+](C)C)CC2)n1C ZINC001168297585 964393530 /nfs/dbraw/zinc/39/35/30/964393530.db2.gz FFRPVSPFKRVLLM-UHFFFAOYSA-N 2 0 249.402 2.296 20 0 BEADRP Cc1c[nH+]c(NCc2ccccc2C[NH3+])cc1N ZINC001160908731 964440758 /nfs/dbraw/zinc/44/07/58/964440758.db2.gz VQUQAELIPUZHCH-UHFFFAOYSA-N 2 0 242.326 2.043 20 0 BEADRP Cn1ccc2c1cc[nH+]c2N[C@@H](C[NH3+])C(C)(C)C ZINC001160911896 964440894 /nfs/dbraw/zinc/44/08/94/964440894.db2.gz FTVIKKXZFYRABX-LBPRGKRZSA-N 2 0 246.358 2.359 20 0 BEADRP C[NH+](C)C1CCC(n2ccc3c2CC[NH2+]C3)CC1 ZINC001168329520 964459720 /nfs/dbraw/zinc/45/97/20/964459720.db2.gz WKDDFLPCAGVMTJ-UHFFFAOYSA-N 2 0 247.386 2.179 20 0 BEADRP C[N@H+](CCCCCC[NH3+])C[C@@H]1C[C@H]2C[C@H]2C1 ZINC000697814031 964537639 /nfs/dbraw/zinc/53/76/39/964537639.db2.gz STKHSXIHTLVJTG-BTTYYORXSA-N 2 0 224.392 2.483 20 0 BEADRP CC(C)C[C@H](C)[NH2+]CC[C@@H](C)[NH+](C)C ZINC000697869428 964597346 /nfs/dbraw/zinc/59/73/46/964597346.db2.gz GXOSROIGSOJFEE-NWDGAFQWSA-N 2 0 200.370 2.351 20 0 BEADRP C[C@H](CC[NH2+]C[C@H]1CC=CCC1)[NH+](C)C ZINC000697877835 964604694 /nfs/dbraw/zinc/60/46/94/964604694.db2.gz FPBGTFPLRADVLR-OLZOCXBDSA-N 2 0 210.365 2.273 20 0 BEADRP C[C@H](CC[NH2+][C@H]1CCCC1(C)C)[NH+](C)C ZINC000697877969 964605497 /nfs/dbraw/zinc/60/54/97/964605497.db2.gz GMVAESHAZPAGQG-NEPJUHHUSA-N 2 0 212.381 2.495 20 0 BEADRP Cc1ccccc1C[NH2+]CC[C@H](C)[NH+](C)C ZINC000697890477 964642501 /nfs/dbraw/zinc/64/25/01/964642501.db2.gz VXKQPKMZBALZOK-ZDUSSCGKSA-N 2 0 220.360 2.425 20 0 BEADRP C[C@@H]([NH2+][C@H](C)C1CC[NH2+]CC1)c1cscn1 ZINC000697892761 964652511 /nfs/dbraw/zinc/65/25/11/964652511.db2.gz QTYXYHZGBUOPDO-NXEZZACHSA-N 2 0 239.388 2.182 20 0 BEADRP C(C1CC1)[NH+]1CCC([NH2+][C@@H]2C[C@H]2C2CC2)CC1 ZINC001168370848 964925322 /nfs/dbraw/zinc/92/53/22/964925322.db2.gz GCAHIJUXBHSNST-LSDHHAIUSA-N 2 0 234.387 2.249 20 0 BEADRP C[N@@H+]1CCC[C@@](C)(Nc2cc3[nH]ccc3c[nH+]2)C1 ZINC001162340161 964936736 /nfs/dbraw/zinc/93/67/36/964936736.db2.gz ADTWZCZGISLWTI-CQSZACIVSA-N 2 0 244.342 2.459 20 0 BEADRP Cc1cc2[nH+]ccn2cc1N[C@@H]1CCC[C@H]([NH3+])C1 ZINC001162400124 964959405 /nfs/dbraw/zinc/95/94/05/964959405.db2.gz GJZOCKBJBPKWDF-NWDGAFQWSA-N 2 0 244.342 2.325 20 0 BEADRP Cn1ccc2c1[nH+]ccc2N[C@H]1CCC[C@H]([NH3+])C1 ZINC001162405697 964966370 /nfs/dbraw/zinc/96/63/70/964966370.db2.gz WUQCXSYDBXOSEL-QWRGUYRKSA-N 2 0 244.342 2.255 20 0 BEADRP FC1CC[NH+](C2CC[NH+](CC3CC3)CC2)CC1 ZINC001168373384 964976660 /nfs/dbraw/zinc/97/66/60/964976660.db2.gz QDCHWBJCZYZMED-UHFFFAOYSA-N 2 0 240.366 2.295 20 0 BEADRP Cc1cc(NC[C@@H]2CCC[NH2+]C[C@@H]2C)cc(C)[nH+]1 ZINC001162457462 964985231 /nfs/dbraw/zinc/98/52/31/964985231.db2.gz PHOYEQQGDFQTMT-FZMZJTMJSA-N 2 0 247.386 2.168 20 0 BEADRP C[C@@H]1C[NH2+]CCC[C@H]1CNc1cccc(C[NH3+])c1 ZINC001162457131 964985347 /nfs/dbraw/zinc/98/53/47/964985347.db2.gz MVMJKLZOJRRYGC-OCCSQVGLSA-N 2 0 247.386 2.193 20 0 BEADRP Cc1c2[nH+]c[nH]c2ccc1NC[C@H]1C[NH2+][C@H](C)C1 ZINC001162556723 965048791 /nfs/dbraw/zinc/04/87/91/965048791.db2.gz RZUUPXYGKRCQDW-MWLCHTKSSA-N 2 0 244.342 2.281 20 0 BEADRP C[C@@H]1C[C@@H](CNc2cccc3c2CC[C@H]3[NH3+])C[NH2+]1 ZINC001162559960 965052833 /nfs/dbraw/zinc/05/28/33/965052833.db2.gz URYLXUZEMGMHQK-JTNHKYCSSA-N 2 0 245.370 2.043 20 0 BEADRP C[C@H]1[NH2+]CC[C@H]1Nc1ccc([C@H]2CCC[NH2+]2)cc1 ZINC001162677900 965108143 /nfs/dbraw/zinc/10/81/43/965108143.db2.gz VTOCYJHEEBCVDZ-KCPJHIHWSA-N 2 0 245.370 2.273 20 0 BEADRP C[C@H]1[NH2+]CC[C@H]1Nc1ccccc1C(C)(C)[NH3+] ZINC001162676800 965108576 /nfs/dbraw/zinc/10/85/76/965108576.db2.gz WBWUTHJNUIZCPV-ZYHUDNBSSA-N 2 0 233.359 2.043 20 0 BEADRP Cc1cccnc1CN[C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000250992772 965191006 /nfs/dbraw/zinc/19/10/06/965191006.db2.gz PLGSIMVYMBZANR-KGLIPLIRSA-N 2 0 245.370 2.106 20 0 BEADRP C[NH+](C)CC1CCC(Nc2ncccc2N)CC1 ZINC001163298474 965324606 /nfs/dbraw/zinc/32/46/06/965324606.db2.gz BOXUIRJFIXAZQD-UHFFFAOYSA-N 2 0 248.374 2.196 20 0 BEADRP CC(C)[N@@H+]1CC[C@H](Nc2cc(N)cc[nH+]2)[C@@H](C)C1 ZINC001163356959 965362275 /nfs/dbraw/zinc/36/22/75/965362275.db2.gz HQBRJADVCVMUEN-AAEUAGOBSA-N 2 0 248.374 2.195 20 0 BEADRP C[C@@H](C[NH+](C)C)Nc1ccccc1C(C)(C)[NH3+] ZINC001163782944 965590611 /nfs/dbraw/zinc/59/06/11/965590611.db2.gz VAOOBPALAMSQRJ-NSHDSACASA-N 2 0 235.375 2.242 20 0 BEADRP Cn1c[nH+]cc1NCc1cccc(C[NH+](C)C)c1 ZINC001163993577 965684549 /nfs/dbraw/zinc/68/45/49/965684549.db2.gz MQHARIPCAQVCSG-UHFFFAOYSA-N 2 0 244.342 2.094 20 0 BEADRP [NH3+][C@H]1CCC[N@H+](Cc2ccc3[nH]ccc3c2)CC1 ZINC001205094379 965726996 /nfs/dbraw/zinc/72/69/96/965726996.db2.gz LUIIOHHAFZIZFN-AWEZNQCLSA-N 2 0 243.354 2.481 20 0 BEADRP C[C@@H]1C[C@@H](C)C[NH+](CC2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000699206720 965816296 /nfs/dbraw/zinc/81/62/96/965816296.db2.gz YXJAWKQNMIICLW-MLQJFRMTSA-N 2 0 236.403 2.495 20 0 BEADRP [NH3+]CCCCCCC[N@@H+]1CC[C@@H]2C[C@@H]2C1 ZINC000699248607 965823818 /nfs/dbraw/zinc/82/38/18/965823818.db2.gz XGGILGIBRIIKFI-CHWSQXEVSA-N 2 0 210.365 2.237 20 0 BEADRP CNc1ccccc1C[N@@H+]1CCC[C@@H]([NH3+])CC1 ZINC001205117805 965871111 /nfs/dbraw/zinc/87/11/11/965871111.db2.gz VWZXVFWTFFKKHO-CYBMUJFWSA-N 2 0 233.359 2.042 20 0 BEADRP CCc1ccc(C[N@@H+]2C[C@H]3CC[NH+](C)C[C@H]3C2)o1 ZINC001204390217 965874144 /nfs/dbraw/zinc/87/41/44/965874144.db2.gz FCEQHDURXAIRTO-OLZOCXBDSA-N 2 0 248.370 2.226 20 0 BEADRP Cc1c[nH+]c(N2C[C@H](C[NH3+])CC[C@@H]2C)cc1C ZINC001164474581 965895449 /nfs/dbraw/zinc/89/54/49/965895449.db2.gz SBZMHFACJRXZBQ-STQMWFEESA-N 2 0 233.359 2.262 20 0 BEADRP CC1=C[C@@H](C)[C@H](CN2CC[C@@H]3[NH2+]CC[C@H]32)CC1 ZINC001235039599 965986855 /nfs/dbraw/zinc/98/68/55/965986855.db2.gz VWBYIUXOKAPWBI-CBBWQLFWSA-N 2 0 234.387 2.415 20 0 BEADRP Cc1c[nH+]c(N2CC[C@@]3(C2)CCC[NH2+]C3)cc1C ZINC001165244575 966007234 /nfs/dbraw/zinc/00/72/34/966007234.db2.gz SIVIRWCHDHATCH-HNNXBMFYSA-N 2 0 245.370 2.278 20 0 BEADRP C1=C[C@@H]2C[C@H]1C[C@@H]2C[N@@H+]1CCCC[C@@]12CC[NH2+]C2 ZINC001235124238 966008294 /nfs/dbraw/zinc/00/82/94/966008294.db2.gz LIFMWFYSFIMCAN-JJXSEGSLSA-N 2 0 246.398 2.417 20 0 BEADRP CCc1cc(NCC[C@@H]2CCC[N@H+](C)C2)cc[nH+]1 ZINC001165300922 966037864 /nfs/dbraw/zinc/03/78/64/966037864.db2.gz UQWJGAPUSVSKIW-ZDUSSCGKSA-N 2 0 247.386 2.210 20 0 BEADRP CC1=C[C@@H](C)[C@H](C[N@H+]2CC[C@@H]([NH3+])[C@H]2C)CC1 ZINC001205171114 966204070 /nfs/dbraw/zinc/20/40/70/966204070.db2.gz KRNPMNNURRBRGZ-YIYPIFLZSA-N 2 0 222.376 2.400 20 0 BEADRP CC[C@H]1CC[C@H](C)[N@@H+]1CCC[NH2+]C1CC1 ZINC000136085630 966372639 /nfs/dbraw/zinc/37/26/39/966372639.db2.gz BPMBZLJZZDIQJM-AAEUAGOBSA-N 2 0 210.365 2.391 20 0 BEADRP C[NH+]1CC2(C1)CC[NH+](Cc1ccccc1F)CC2 ZINC001203357895 966612959 /nfs/dbraw/zinc/61/29/59/966612959.db2.gz ZSDGWULEECDVFB-UHFFFAOYSA-N 2 0 248.345 2.353 20 0 BEADRP Cc1ccc([C@@H](C)CCN(C)C[C@H](C)[NH3+])o1 ZINC001236885978 966614120 /nfs/dbraw/zinc/61/41/20/966614120.db2.gz YQAJHPZGWCGAMF-QWRGUYRKSA-N 2 0 224.348 2.361 20 0 BEADRP C[NH+]1CCC2(C[NH+](Cc3cccc(F)c3)C2)CC1 ZINC001203789064 966777118 /nfs/dbraw/zinc/77/71/18/966777118.db2.gz GTWUDNOVACICHG-UHFFFAOYSA-N 2 0 248.345 2.353 20 0 BEADRP Nc1c[nH+]cn1-c1ccc(C[NH+]2CCCC2)cc1 ZINC001203787019 966780832 /nfs/dbraw/zinc/78/08/32/966780832.db2.gz ZOWQKKJABHTZLD-UHFFFAOYSA-N 2 0 242.326 2.050 20 0 BEADRP CC[NH+]1C[C@@H]2CN(Cc3ccc(F)cc3)C[C@H]2C1 ZINC001203918038 966820938 /nfs/dbraw/zinc/82/09/38/966820938.db2.gz NCJYKDPXVCVQPP-ZIAGYGMSSA-N 2 0 248.345 2.209 20 0 BEADRP CC(C)[C@H]1CCC[N@@H+]1CC[C@@H]1CCC[NH2+]C1 ZINC000084126119 966928472 /nfs/dbraw/zinc/92/84/72/966928472.db2.gz XDVGEVPANYXWQM-UONOGXRCSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1cncc(C[NH2+]C2CCC([NH+](C)C)CC2)c1 ZINC000715585301 967194836 /nfs/dbraw/zinc/19/48/36/967194836.db2.gz VJLSPBREFBPIAX-UHFFFAOYSA-N 2 0 247.386 2.352 20 0 BEADRP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+][C@H]2CCCOCC2)C1 ZINC000715584754 967195817 /nfs/dbraw/zinc/19/58/17/967195817.db2.gz RBFCVXPRVOZKBR-BFHYXJOUSA-N 2 0 240.391 2.018 20 0 BEADRP [NH3+]CC1CC[NH+](CC2CCC(F)(F)CC2)CC1 ZINC001205025808 967299392 /nfs/dbraw/zinc/29/93/92/967299392.db2.gz HKKDLGJYUIFBGH-UHFFFAOYSA-N 2 0 246.345 2.483 20 0 BEADRP Cc1cc(C[N@@H+]2CCC[C@H]([NH3+])CC2)ccc1F ZINC001205093861 967341346 /nfs/dbraw/zinc/34/13/46/967341346.db2.gz GUURFZQXXYBLRR-ZDUSSCGKSA-N 2 0 236.334 2.447 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@@H]([NH3+])CC2)cc1O ZINC001205116527 967363877 /nfs/dbraw/zinc/36/38/77/967363877.db2.gz BHGZNNBOEYKENF-CYBMUJFWSA-N 2 0 234.343 2.014 20 0 BEADRP Cc1cc(C[N@@H+]2CCC[C@@H]([NH3+])CC2)cnc1C ZINC001205117106 967367184 /nfs/dbraw/zinc/36/71/84/967367184.db2.gz KSMIRLYDGLJKHM-CQSZACIVSA-N 2 0 233.359 2.012 20 0 BEADRP C[C@H]1C[N@H+](Cc2cccc3ccoc32)C[C@H]1C[NH3+] ZINC001205150570 967397899 /nfs/dbraw/zinc/39/78/99/967397899.db2.gz FVFLYYJGEWFGLB-SMDDNHRTSA-N 2 0 244.338 2.459 20 0 BEADRP C[C@]1([NH3+])CCC[N@H+](CCOc2ccccc2)CC1 ZINC001205255837 967447386 /nfs/dbraw/zinc/44/73/86/967447386.db2.gz LRVQPSSDGDHPBI-HNNXBMFYSA-N 2 0 248.370 2.269 20 0 BEADRP COc1cccc(C[N@@H+]2CCC[C@](C)([NH3+])CC2)c1 ZINC001205266654 967455382 /nfs/dbraw/zinc/45/53/82/967455382.db2.gz VLZYTCTZSYCTQQ-HNNXBMFYSA-N 2 0 248.370 2.399 20 0 BEADRP C[C@]1([NH3+])CCC[N@H+](Cc2cccc(O)c2)CC1 ZINC001205266744 967456300 /nfs/dbraw/zinc/45/63/00/967456300.db2.gz XDPRLQDDQVOWBJ-AWEZNQCLSA-N 2 0 234.343 2.096 20 0 BEADRP Cc1cc(C)c(C[N@@H+]2CCC[C@](C)([NH3+])CC2)[nH]1 ZINC001205264789 967457048 /nfs/dbraw/zinc/45/70/48/967457048.db2.gz MLKIBCCHLODNGU-AWEZNQCLSA-N 2 0 235.375 2.335 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@@](C)([NH3+])CC2)[nH]1 ZINC001205265254 967458979 /nfs/dbraw/zinc/45/89/79/967458979.db2.gz PCZMFBVRGYZMGH-CYBMUJFWSA-N 2 0 221.348 2.026 20 0 BEADRP C[NH+](C)Cc1cccc(CC[NH+]2CCCC2)c1 ZINC001250166327 967463686 /nfs/dbraw/zinc/46/36/86/967463686.db2.gz KGDPHGRVZHLIKK-UHFFFAOYSA-N 2 0 232.371 2.387 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@](C)([NH3+])CC2)cn1 ZINC001205273242 967465491 /nfs/dbraw/zinc/46/54/91/967465491.db2.gz IQATYQCDYIWKKV-AWEZNQCLSA-N 2 0 233.359 2.093 20 0 BEADRP Cc1cc(C[N@@H+]2CCC[C@](C)([NH3+])CC2)cc(C)n1 ZINC001205280811 967470971 /nfs/dbraw/zinc/47/09/71/967470971.db2.gz JMRHZZTWMRNTPH-HNNXBMFYSA-N 2 0 247.386 2.402 20 0 BEADRP Cc1cc(O)cc(C[N@@H+]2CCC[C@](C)([NH3+])CC2)c1 ZINC001205281527 967475900 /nfs/dbraw/zinc/47/59/00/967475900.db2.gz ULYGCISKMJRWLZ-HNNXBMFYSA-N 2 0 248.370 2.404 20 0 BEADRP CS[C@@H](C)CC[N@@H+]1CCC[C@@](F)(C[NH3+])CC1 ZINC001205546027 967690302 /nfs/dbraw/zinc/69/03/02/967690302.db2.gz PDGGCIWHBLMORE-RYUDHWBXSA-N 2 0 248.411 2.281 20 0 BEADRP Cc1cnccc1C[N@H+]1CC[C@@H](C)[C@@H](C[NH3+])CC1 ZINC001205602631 967719562 /nfs/dbraw/zinc/71/95/62/967719562.db2.gz KSPGCQQEZVNOMB-TZMCWYRMSA-N 2 0 247.386 2.197 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@@H](C)[C@H](C[NH3+])CC2)[nH]1 ZINC001205618229 967729091 /nfs/dbraw/zinc/72/90/91/967729091.db2.gz SVGJCILYBLAVRH-YPMHNXCESA-N 2 0 235.375 2.130 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@H](C)[C@@H](C[NH3+])CC2)nc1 ZINC001205626751 967736958 /nfs/dbraw/zinc/73/69/58/967736958.db2.gz IVWSSYLWYITVOC-UONOGXRCSA-N 2 0 247.386 2.197 20 0 BEADRP Cc1cc[nH+]c(N[C@@H]2CCC[C@H]([NH3+])C2)c1C ZINC001162390941 967823041 /nfs/dbraw/zinc/82/30/41/967823041.db2.gz KCNYTORFAPBCGN-NWDGAFQWSA-N 2 0 219.332 2.380 20 0 BEADRP C[C@@H]1C[N@H+](CCC(F)(F)F)CCC[C@@H]1C[NH3+] ZINC001205984633 967931011 /nfs/dbraw/zinc/93/10/11/967931011.db2.gz SQWMARVTWJOKTJ-NXEZZACHSA-N 2 0 238.297 2.246 20 0 BEADRP CCCCC[N@@H+]1CCC[C@H](C[NH3+])[C@H](C)C1 ZINC001205984686 967932303 /nfs/dbraw/zinc/93/23/03/967932303.db2.gz UEBGOAMDNHBMQM-CHWSQXEVSA-N 2 0 212.381 2.483 20 0 BEADRP Cc1cccnc1C[N@@H+]1CCC[C@@H](C[NH3+])[C@H](C)C1 ZINC001205996548 967947017 /nfs/dbraw/zinc/94/70/17/967947017.db2.gz XEXVYGVTGIQLPQ-KGLIPLIRSA-N 2 0 247.386 2.197 20 0 BEADRP Cc1ccc(C[N@@H+]2CCC[C@@H](C[NH3+])[C@@H](C)C2)[nH]1 ZINC001205995474 967947831 /nfs/dbraw/zinc/94/78/31/967947831.db2.gz OIPQBBFNQYVEDB-AAEUAGOBSA-N 2 0 235.375 2.130 20 0 BEADRP Cc1c[nH]c(C[N@@H+]2CCC[C@@H](C[NH3+])[C@@H](C)C2)c1C ZINC001206004359 967962851 /nfs/dbraw/zinc/96/28/51/967962851.db2.gz RWSGPBFJRVLWJX-JSGCOSHPSA-N 2 0 249.402 2.438 20 0 BEADRP C[C@@H]1CCC[N@H+](CC2(F)CC[NH2+]CC2)C[C@@H]1C ZINC001206110293 968068204 /nfs/dbraw/zinc/06/82/04/968068204.db2.gz SPFRZHIIOFUONI-OLZOCXBDSA-N 2 0 242.382 2.446 20 0 BEADRP Cc1cc2[nH]ccc2c(N(C)CCC[NH+](C)C)[nH+]1 ZINC001163595485 968079988 /nfs/dbraw/zinc/07/99/88/968079988.db2.gz GMCUFTDAEWTLHH-UHFFFAOYSA-N 2 0 246.358 2.259 20 0 BEADRP C[C@@H](C[NH+](C)C)Nc1ccc(C2([NH3+])CCC2)cc1 ZINC001163776553 968115609 /nfs/dbraw/zinc/11/56/09/968115609.db2.gz DDFULAVRQVCUNN-LBPRGKRZSA-N 2 0 247.386 2.387 20 0 BEADRP Cc1ccc(C)c(N(CCC[NH3+])C(C)C)[nH+]1 ZINC001164122303 968174018 /nfs/dbraw/zinc/17/40/18/968174018.db2.gz DECBYXFEMPKRGF-UHFFFAOYSA-N 2 0 221.348 2.262 20 0 BEADRP CCc1ccc(CN2CCC[NH2+]C[C@@H]2C)cc1 ZINC001206257661 968176624 /nfs/dbraw/zinc/17/66/24/968176624.db2.gz GPLYPFUYXSSUIB-ZDUSSCGKSA-N 2 0 232.371 2.433 20 0 BEADRP C[C@@]1(C[NH3+])CCC[N@H+](Cc2ccoc2)CC1 ZINC001206296732 968204513 /nfs/dbraw/zinc/20/45/13/968204513.db2.gz UJMJKAYXENEDJQ-CYBMUJFWSA-N 2 0 222.332 2.231 20 0 BEADRP CS[C@@H](C)CC[N@@H+]1CCCC[C@@](F)(CN)C1 ZINC001206334964 968237079 /nfs/dbraw/zinc/23/70/79/968237079.db2.gz BIVFUTXTSFMPHV-NWDGAFQWSA-N 2 0 248.411 2.281 20 0 BEADRP C[C@]1(C[NH3+])CCCC[N@H+](C[C@@H]2CCCCO2)C1 ZINC001206542014 968355282 /nfs/dbraw/zinc/35/52/82/968355282.db2.gz PEVATNWFQNBGIR-UONOGXRCSA-N 2 0 240.391 2.006 20 0 BEADRP Cc1cc(C[N@@H+]2CCCC[C@](C)(C[NH3+])C2)ccn1 ZINC001206550222 968374817 /nfs/dbraw/zinc/37/48/17/968374817.db2.gz XVGNZZWQMLDTJC-OAHLLOKOSA-N 2 0 247.386 2.341 20 0 BEADRP Cc1ccc(C[N@@H+]2CCCC[C@@](C)(C[NH3+])C2)cn1 ZINC001206555984 968379322 /nfs/dbraw/zinc/37/93/22/968379322.db2.gz LMEOVODWTCRCMC-HNNXBMFYSA-N 2 0 247.386 2.341 20 0 BEADRP [NH3+]CCC[C@H]([NH2+]C[C@H]1CCOC1)c1ccccc1 ZINC001119699275 968457538 /nfs/dbraw/zinc/45/75/38/968457538.db2.gz MGVZMLUZGDQOOJ-HIFRSBDPSA-N 2 0 248.370 2.093 20 0 BEADRP CC[C@H](C)[N@H+](C)CC(C)(C)C[NH+](C)C ZINC001207279387 968709393 /nfs/dbraw/zinc/70/93/93/968709393.db2.gz LGKQPDXVJGACIH-NSHDSACASA-N 2 0 200.370 2.305 20 0 BEADRP C[NH+](C)CC(C)(C)C[N@@H+]1CCC(C)(C)C1 ZINC001207286482 968719742 /nfs/dbraw/zinc/71/97/42/968719742.db2.gz UBRVHWQMFGVWNQ-UHFFFAOYSA-N 2 0 212.381 2.306 20 0 BEADRP CC[N@@H+](Cc1ccncc1)CC1CC[NH+](C)CC1 ZINC001207392191 968745908 /nfs/dbraw/zinc/74/59/08/968745908.db2.gz VVOOBIUWTWWYFE-UHFFFAOYSA-N 2 0 247.386 2.245 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2CC[C@@](C)(F)[C@H](F)C2)CC1 ZINC001207395039 968751487 /nfs/dbraw/zinc/75/14/87/968751487.db2.gz OJXSXWNQMFYGCH-CHWSQXEVSA-N 2 0 246.345 2.100 20 0 BEADRP C[C@@H]1CC[N@H+](CC2CC[NH+](C)CC2)[C@@H](C)C1 ZINC001207398309 968752322 /nfs/dbraw/zinc/75/23/22/968752322.db2.gz HBRQOIGDVHWSCL-OLZOCXBDSA-N 2 0 224.392 2.449 20 0 BEADRP C[C@@H]1C[N@H+](CC2CC[NH+](C)CC2)C2(CC2)C1 ZINC001207399819 968752871 /nfs/dbraw/zinc/75/28/71/968752871.db2.gz UWPNQMWQEZESLD-LBPRGKRZSA-N 2 0 222.376 2.203 20 0 BEADRP FC1CC2(C1)CC[NH+](CC1CC[NH2+]CC1)CC2 ZINC001207435312 968767948 /nfs/dbraw/zinc/76/79/48/968767948.db2.gz DNTYCUGSOKFUPN-UHFFFAOYSA-N 2 0 240.366 2.200 20 0 BEADRP C(C1CC[NH2+]CC1)[N@@H+]1CC[C@H]2CCC[C@H]2C1 ZINC001207436016 968768414 /nfs/dbraw/zinc/76/84/14/968768414.db2.gz RZNCDFWHZQUDPA-KGLIPLIRSA-N 2 0 222.376 2.108 20 0 BEADRP C[C@@H]1CCC[N@H+](C[C@H]2CCCC[NH2+]C2)CC1 ZINC000829276001 968829043 /nfs/dbraw/zinc/82/90/43/968829043.db2.gz RLPKSISKKRXXLQ-KGLIPLIRSA-N 2 0 224.392 2.498 20 0 BEADRP C[N@H+](C[C@H]1C[C@H]2C=C[C@@H]1C2)CC1CC[NH+](C)CC1 ZINC001207626418 968840968 /nfs/dbraw/zinc/84/09/68/968840968.db2.gz FCCXXHNSCUBALW-ARFHVFGLSA-N 2 0 248.414 2.472 20 0 BEADRP CC[N@H+]1C[C@@H]2C[NH+](C[C@H]3C[C@H]4C=C[C@@H]3C4)C[C@@H]2C1 ZINC001207633789 968852697 /nfs/dbraw/zinc/85/26/97/968852697.db2.gz AHMDPMKVRROYAA-CQJMVSDSSA-N 2 0 246.398 2.082 20 0 BEADRP C([NH2+]C1CCCCC1)[C@@H]1C[NH+]2CCC1CC2 ZINC001207723185 968868551 /nfs/dbraw/zinc/86/85/51/968868551.db2.gz CLLGJAREENCFTE-CYBMUJFWSA-N 2 0 222.376 2.251 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+]C[C@@H]1C[NH+]2CCC1CC2 ZINC001207723697 968868609 /nfs/dbraw/zinc/86/86/09/968868609.db2.gz MUPSPEHMLSTJOB-SGMGOOAPSA-N 2 0 224.392 2.352 20 0 BEADRP CCC[C@H](O)C[NH2+][C@H](C)CCC[NH+](CC)CC ZINC001252801005 968984479 /nfs/dbraw/zinc/98/44/79/968984479.db2.gz SFFNUVSRVUWLTL-KGLIPLIRSA-N 2 0 244.423 2.248 20 0 BEADRP C[N@H+](Cc1ccccn1)CC1(C)CC[NH+](C)CC1 ZINC001208102561 968995889 /nfs/dbraw/zinc/99/58/89/968995889.db2.gz GAZXIANGBCSPKC-UHFFFAOYSA-N 2 0 247.386 2.245 20 0 BEADRP C[C@H]1CC[N@H+](CC2(C)CC[NH+](C)CC2)C1 ZINC001208108635 969000109 /nfs/dbraw/zinc/00/01/09/969000109.db2.gz XBTGEINTBIDWJU-LBPRGKRZSA-N 2 0 210.365 2.060 20 0 BEADRP C[N@H+](Cc1cccnc1)CC1(C)CC[NH+](C)CC1 ZINC001208102974 969001016 /nfs/dbraw/zinc/00/10/16/969001016.db2.gz ITBXLXDEGKIDSC-UHFFFAOYSA-N 2 0 247.386 2.245 20 0 BEADRP C[NH+]1CCC(C)(C[N@@H+]2CCc3occc3C2)CC1 ZINC001208110229 969007224 /nfs/dbraw/zinc/00/72/24/969007224.db2.gz XKCAHPQQTDMMJP-UHFFFAOYSA-N 2 0 248.370 2.370 20 0 BEADRP C[NH+]1CCC(C)(C[N@@H+]2C[C@@H]3C[C@@H]3[C@@H](F)C2)CC1 ZINC001208110433 969008946 /nfs/dbraw/zinc/00/89/46/969008946.db2.gz RSPORCQFCDEAGD-AVGNSLFASA-N 2 0 240.366 2.008 20 0 BEADRP C[NH+]1CCC(C)(C[N@H+]2C[C@@H]3[C@H](C2)C3(C)C)CC1 ZINC001208114179 969009142 /nfs/dbraw/zinc/00/91/42/969009142.db2.gz TUGDHEIQIHVDGC-BETUJISGSA-N 2 0 236.403 2.306 20 0 BEADRP CCCC[N@H+](CCC)C[C@@H](O)C[NH+](CC)CC ZINC001253186299 969103755 /nfs/dbraw/zinc/10/37/55/969103755.db2.gz NJAWLDYWEAHDCU-AWEZNQCLSA-N 2 0 244.423 2.201 20 0 BEADRP C[C@@H](C[NH3+])C[N@H+](C)C1CCC2(CC2)CC1 ZINC000723428310 969145879 /nfs/dbraw/zinc/14/58/79/969145879.db2.gz XNHGGAMNIONXRJ-NSHDSACASA-N 2 0 210.365 2.236 20 0 BEADRP CC[NH+]1CCC(C[N@H+](C)CC2CC2)CC1 ZINC001208594786 969152690 /nfs/dbraw/zinc/15/26/90/969152690.db2.gz NQTBYRBXQFCHHS-UHFFFAOYSA-N 2 0 210.365 2.060 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH+]2CCc3ccccc3C2)C1 ZINC001208605069 969154569 /nfs/dbraw/zinc/15/45/69/969154569.db2.gz XZFPIMOIUQHKQO-AWEZNQCLSA-N 2 0 244.382 2.387 20 0 BEADRP Cc1cncc(C[N@@H+]2CCC[C@@H](C[NH3+])[C@@H](C)C2)c1 ZINC001205993524 969228580 /nfs/dbraw/zinc/22/85/80/969228580.db2.gz HZDXHXGFXVERKA-ZFWWWQNUSA-N 2 0 247.386 2.197 20 0 BEADRP C[C@@H]1C[N@H+](Cc2cccc(O)c2)CCC[C@@H]1C[NH3+] ZINC001205994872 969249675 /nfs/dbraw/zinc/24/96/75/969249675.db2.gz MRXXEWXQTKUXRF-TZMCWYRMSA-N 2 0 248.370 2.199 20 0 BEADRP CCCC[NH+]1CCC([N@H+](C)CCCOC)CC1 ZINC001209055990 969338822 /nfs/dbraw/zinc/33/88/22/969338822.db2.gz LATPEQGRKLLGEN-UHFFFAOYSA-N 2 0 242.407 2.219 20 0 BEADRP CCC[C@H](C)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169099621 969389824 /nfs/dbraw/zinc/38/98/24/969389824.db2.gz CPXDLEUJNIEIRU-ZDEQEGDKSA-N 2 0 210.365 2.390 20 0 BEADRP CC[C@H](C)C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169078822 969396211 /nfs/dbraw/zinc/39/62/11/969396211.db2.gz HNSQLEUDVURXFO-ZDEQEGDKSA-N 2 0 210.365 2.247 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]C1CCC(F)CC1)C2 ZINC001169079665 969396296 /nfs/dbraw/zinc/39/62/96/969396296.db2.gz KIRXHLZLGCJSQN-UMHABRDISA-N 2 0 240.366 2.482 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+][C@H]1CC[C@@H](F)CC1)C2 ZINC001169079240 969399224 /nfs/dbraw/zinc/39/92/24/969399224.db2.gz KIRXHLZLGCJSQN-KYGRNUTJSA-N 2 0 240.366 2.482 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+][C@@H]1CCC[C@@H](F)C1)C2 ZINC001169081360 969405091 /nfs/dbraw/zinc/40/50/91/969405091.db2.gz RYWKNOQICIUYQJ-KSTCHIGDSA-N 2 0 240.366 2.482 20 0 BEADRP C[C@H]1CCC[N@@H+]([C@H]2C[C@H]3CC[C@@H](C2)[NH+]3C)C1 ZINC001169123420 969418878 /nfs/dbraw/zinc/41/88/78/969418878.db2.gz LGOKUHAUQIJXDM-IGQOVBAYSA-N 2 0 222.376 2.344 20 0 BEADRP CC(C)C[N@H+](C)[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169123850 969421824 /nfs/dbraw/zinc/42/18/24/969421824.db2.gz NFWFIHGJHDRVBL-CLLJXQQHSA-N 2 0 210.365 2.199 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H](N1CC3CCC1CC3)C2 ZINC001169142637 969451098 /nfs/dbraw/zinc/45/10/98/969451098.db2.gz DYSMVBOPNLXHGR-YJIWRGBVSA-N 2 0 234.387 2.486 20 0 BEADRP C[C@H]1CC(C[N@H+](C)CCC[NH+](C)C)C[C@H](C)O1 ZINC001209378722 969451526 /nfs/dbraw/zinc/45/15/26/969451526.db2.gz MWGRDQYMHRVDGH-STQMWFEESA-N 2 0 242.407 2.074 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](N1Cc3ccncc3C1)C2 ZINC001169142314 969451812 /nfs/dbraw/zinc/45/18/12/969451812.db2.gz TUBQULHGCYYCIX-FICVDOATSA-N 2 0 243.354 2.022 20 0 BEADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+][C@H]1CC=CCC1)C2 ZINC001169115631 969454556 /nfs/dbraw/zinc/45/45/56/969454556.db2.gz LSDHQZBBRRRMPY-XDQVBPFNSA-N 2 0 220.360 2.310 20 0 BEADRP CC[NH+]1CCC([NH2+]CCc2cccc(O)c2)CC1 ZINC001169221436 969491895 /nfs/dbraw/zinc/49/18/95/969491895.db2.gz DJTLBXHUMOJAFZ-UHFFFAOYSA-N 2 0 248.370 2.009 20 0 BEADRP C[C@H](C[NH3+])C[N@H+](C)C1CCc2ccccc2CC1 ZINC001254454865 969641633 /nfs/dbraw/zinc/64/16/33/969641633.db2.gz JCHPOKAHKOPQIB-CYBMUJFWSA-N 2 0 246.398 2.461 20 0 BEADRP C[N@@H+]1CCC[C@H](Nc2cccc(C[NH3+])c2)CC1 ZINC001254500147 969657082 /nfs/dbraw/zinc/65/70/82/969657082.db2.gz GFKAUMZVRKFAOA-ZDUSSCGKSA-N 2 0 233.359 2.042 20 0 BEADRP C[C@H]1CCC[C@H]1[NH2+][C@H]1CCC[N@H+](C)CC1 ZINC001254500673 969658024 /nfs/dbraw/zinc/65/80/24/969658024.db2.gz XXOKNWRMXQAIGF-RWMBFGLXSA-N 2 0 210.365 2.249 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH2+]C[C@H]2CCC(F)(F)C2)CC1 ZINC001254499209 969659481 /nfs/dbraw/zinc/65/94/81/969659481.db2.gz COOIREBYZWWATD-RYUDHWBXSA-N 2 0 246.345 2.496 20 0 BEADRP CO[C@H]1CC[C@H]([NH2+][C@@H]2CCC[N@H+](C)CC2)CC1 ZINC001254505057 969671237 /nfs/dbraw/zinc/67/12/37/969671237.db2.gz YNAMSNLIZSIUHO-MGPQQGTHSA-N 2 0 240.391 2.018 20 0 BEADRP Cc1ccnc(CC[NH2+][C@H]2CCC[N@@H+](C)CC2)c1 ZINC001254505892 969672578 /nfs/dbraw/zinc/67/25/78/969672578.db2.gz KZHHZWMYXQUVCU-AWEZNQCLSA-N 2 0 247.386 2.006 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[N@H+](C)CC1)c1ccc(N)cc1 ZINC001254506812 969672971 /nfs/dbraw/zinc/67/29/71/969672971.db2.gz ATXGNMISESYXHR-SWLSCSKDSA-N 2 0 247.386 2.404 20 0 BEADRP CO[C@H]1CC[C@H]([NH2+][C@H]2CCC[N@H+](C)CC2)CC1 ZINC001254505056 969674035 /nfs/dbraw/zinc/67/40/35/969674035.db2.gz YNAMSNLIZSIUHO-IHRRRGAJSA-N 2 0 240.391 2.018 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH+]2CCCC[C@@H](F)C2)CC1 ZINC001254516446 969687971 /nfs/dbraw/zinc/68/79/71/969687971.db2.gz MLMMHUPJBRLPSO-CHWSQXEVSA-N 2 0 228.355 2.295 20 0 BEADRP C[N@@H+]1CCC[C@H]([NH+]2CCC[C@@H](C(F)F)C2)CC1 ZINC001254525425 969715115 /nfs/dbraw/zinc/71/51/15/969715115.db2.gz IETKYSJNCQSNSZ-NEPJUHHUSA-N 2 0 246.345 2.448 20 0 BEADRP C[N@H+](CCc1cccnc1)[C@@H]1CCC[NH+](C)CC1 ZINC001254525448 969717265 /nfs/dbraw/zinc/71/72/65/969717265.db2.gz ISMBUIRCJDXTGJ-OAHLLOKOSA-N 2 0 247.386 2.040 20 0 BEADRP Cc1ccc(C)c(NCC[C@H]2CCC[NH2+]2)[nH+]1 ZINC001169558403 969756715 /nfs/dbraw/zinc/75/67/15/969756715.db2.gz AORDKYBARCFMJS-GFCCVEGCSA-N 2 0 219.332 2.252 20 0 BEADRP CC/C=C\CCC[N@@H+]1CC[NH2+][C@H](C)CC1 ZINC001210474236 969899479 /nfs/dbraw/zinc/89/94/79/969899479.db2.gz FFHXXWUDPURPLT-DSYXLKISSA-N 2 0 210.365 2.417 20 0 BEADRP CC=C(C)Nc1c[nH+]ccc1N1CC[NH+](C)CC1 ZINC001210793660 970035678 /nfs/dbraw/zinc/03/56/78/970035678.db2.gz XTTOWOKEVACUNH-UUILKARUSA-N 2 0 246.358 2.169 20 0 BEADRP CN(c1cccc(C2=[NH+]CCC2)c1)C(C)(C)C[NH3+] ZINC001170060269 970115016 /nfs/dbraw/zinc/11/50/16/970115016.db2.gz MQJDLIFTJVCACH-UHFFFAOYSA-N 2 0 245.370 2.443 20 0 BEADRP Cc1cc2cc(C[NH3+])ccc2n1[C@@H]1CC[N@@H+](C)C1 ZINC001255414127 970136001 /nfs/dbraw/zinc/13/60/01/970136001.db2.gz QLBXUFAQEQESJX-CQSZACIVSA-N 2 0 243.354 2.285 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CC23CC[NH+](CC2)CC3)C1 ZINC001170099472 970282580 /nfs/dbraw/zinc/28/25/80/970282580.db2.gz ASGRCVKYJNUSII-CHWSQXEVSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+]C[C@H]2CCC[N@H+](C)C2)C1 ZINC001170103234 970298052 /nfs/dbraw/zinc/29/80/52/970298052.db2.gz DSABJECGWJNNGA-YNEHKIRRSA-N 2 0 210.365 2.106 20 0 BEADRP CC1(C)C[C@H]([NH2+]Cc2ccccc2C[NH3+])CCO1 ZINC001255530011 970298268 /nfs/dbraw/zinc/29/82/68/970298268.db2.gz YGHMUCQFMMDHGL-CQSZACIVSA-N 2 0 248.370 2.193 20 0 BEADRP C[C@@H]1CC[C@@H]([N@H+](C)C2CCN(C)CC2)C1 ZINC001170124229 970368544 /nfs/dbraw/zinc/36/85/44/970368544.db2.gz FVPPQXYIYHLJOA-DGCLKSJQSA-N 2 0 210.365 2.201 20 0 BEADRP COC[C@@H](C)[N@H+](C)CC1CC[NH+](C(C)C)CC1 ZINC001255575844 970368926 /nfs/dbraw/zinc/36/89/26/970368926.db2.gz JVXKZBQTZAMONP-CYBMUJFWSA-N 2 0 242.407 2.074 20 0 BEADRP CC[C@H]1C[C@@H]([N@H+](CCC[NH3+])C(C)C)CCO1 ZINC001170171047 970543838 /nfs/dbraw/zinc/54/38/38/970543838.db2.gz OOUKXELEWBAUAR-STQMWFEESA-N 2 0 228.380 2.003 20 0 BEADRP [NH3+]C[C@@H]1CC[N@H+](C[C@H]2CC3CCC2CC3)C1 ZINC000400131571 970550556 /nfs/dbraw/zinc/55/05/56/970550556.db2.gz VGFZHIKAIFMQNU-GNRIBBGQSA-N 2 0 222.376 2.093 20 0 BEADRP CC[C@H]1C[C@H]([NH2+]Cc2ccccc2C[NH3+])CCO1 ZINC001170181156 970551008 /nfs/dbraw/zinc/55/10/08/970551008.db2.gz DZOZLSDNRXZWRH-CABCVRRESA-N 2 0 248.370 2.193 20 0 BEADRP Cc1ncc(C[N@H+](C)CCCCCC[NH3+])s1 ZINC000400187163 970559503 /nfs/dbraw/zinc/55/95/03/970559503.db2.gz XJHZVKMUEIEWFB-UHFFFAOYSA-N 2 0 241.404 2.402 20 0 BEADRP CC[C@H]1C[C@H]([NH2+]C(C)(C)C(C)(C)[NH3+])CCO1 ZINC001170183390 970560178 /nfs/dbraw/zinc/56/01/78/970560178.db2.gz RIXNQZBNKMOOBA-MNOVXSKESA-N 2 0 228.380 2.050 20 0 BEADRP CC[C@@H]1C[C@H]([NH2+][C@H]2CCC[N@H+](C)CC2)CCO1 ZINC001170171619 970564327 /nfs/dbraw/zinc/56/43/27/970564327.db2.gz UDTRZWWFLCSWJE-BFHYXJOUSA-N 2 0 240.391 2.018 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]CCOC(C)C ZINC001255941319 970568683 /nfs/dbraw/zinc/56/86/83/970568683.db2.gz OGUBPVIUIJFFPA-CYBMUJFWSA-N 2 0 230.396 2.121 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[NH2+]CC1(C)CC1 ZINC001255940936 970569838 /nfs/dbraw/zinc/56/98/38/970569838.db2.gz JJHSVOAFJBCULS-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+]CCc1ccccn1 ZINC001255940297 970570518 /nfs/dbraw/zinc/57/05/18/970570518.db2.gz WCPTYEFYRJHKPJ-AWEZNQCLSA-N 2 0 249.402 2.334 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)N(CCC[NH3+])C(C)C ZINC001255940438 970571790 /nfs/dbraw/zinc/57/17/90/970571790.db2.gz CALIYQBIJQYBGQ-CQSZACIVSA-N 2 0 243.439 2.166 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)C1CCC1 ZINC000400335977 970572523 /nfs/dbraw/zinc/57/25/23/970572523.db2.gz AFSIUSSOHYEWBC-MNOVXSKESA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)c1ccccn1)C1CC[NH2+]CC1 ZINC000400317497 970573875 /nfs/dbraw/zinc/57/38/75/970573875.db2.gz ANFRKGIOBDOARF-NEPJUHHUSA-N 2 0 233.359 2.120 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+][C@@H](C)C1CC[NH2+]CC1 ZINC000400335795 970578229 /nfs/dbraw/zinc/57/82/29/970578229.db2.gz FYIWMLOGRPXATH-SRVKXCTJSA-N 2 0 212.381 2.399 20 0 BEADRP CC[C@@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)C1CC1 ZINC000400357172 970580913 /nfs/dbraw/zinc/58/09/13/970580913.db2.gz BSZRKEOMWADBLR-GXFFZTMASA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]([NH2+]Cc1ccsc1)C1CC[NH2+]CC1 ZINC000400359661 970580975 /nfs/dbraw/zinc/58/09/75/970580975.db2.gz PRMZBCVLDLDZFZ-SNVBAGLBSA-N 2 0 224.373 2.226 20 0 BEADRP C[C@@H]([NH2+][C@H](C)C1CC[NH2+]CC1)c1cccnc1 ZINC000400390770 970584965 /nfs/dbraw/zinc/58/49/65/970584965.db2.gz ZXEZDLLDEVCCJW-VXGBXAGGSA-N 2 0 233.359 2.120 20 0 BEADRP C[C@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)c1cccnc1 ZINC000400390768 970585175 /nfs/dbraw/zinc/58/51/75/970585175.db2.gz ZXEZDLLDEVCCJW-RYUDHWBXSA-N 2 0 233.359 2.120 20 0 BEADRP CC[NH+](CC)CC[C@H](C)[NH2+][C@H]1C[C@H]1C1CC1 ZINC001255954455 970590759 /nfs/dbraw/zinc/59/07/59/970590759.db2.gz DSRGRQFTQFCXJE-UBHSHLNASA-N 2 0 224.392 2.495 20 0 BEADRP CC(C)CCC[NH2+][C@@H](C)C1CC[NH2+]CC1 ZINC000400448994 970592353 /nfs/dbraw/zinc/59/23/53/970592353.db2.gz OESNIQDFSFZIDR-LBPRGKRZSA-N 2 0 212.381 2.400 20 0 BEADRP Cc1cc(NC[C@H]2CCCC[NH2+]2)cc(C)[nH+]1 ZINC000304450951 970596326 /nfs/dbraw/zinc/59/63/26/970596326.db2.gz VTUSLVVXQUINLL-GFCCVEGCSA-N 2 0 219.332 2.252 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)n1ccc2c1CC[NH2+]C2 ZINC001255972341 970606074 /nfs/dbraw/zinc/60/60/74/970606074.db2.gz PSDRFQSBJITPBX-CYBMUJFWSA-N 2 0 249.402 2.427 20 0 BEADRP [NH3+]Cc1cccc(NC2CC[NH+](C3CC3)CC2)c1 ZINC001256067320 970630670 /nfs/dbraw/zinc/63/06/70/970630670.db2.gz KLQHGDMBVJWLEP-UHFFFAOYSA-N 2 0 245.370 2.184 20 0 BEADRP C[NH+]1CC(CNc2cccc(C3=[NH+]CCC3)c2)C1 ZINC001170259638 970644354 /nfs/dbraw/zinc/64/43/54/970644354.db2.gz YMXDFUWYAJVVBJ-UHFFFAOYSA-N 2 0 243.354 2.243 20 0 BEADRP CSCC[C@H](C)[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000401025313 970653895 /nfs/dbraw/zinc/65/38/95/970653895.db2.gz NGHNGPMZJSSWRT-WUHRBBMRSA-N 2 0 242.432 2.106 20 0 BEADRP C[C@@H]1[C@@H](C)CCC[N@H+]1C1CCN(C)CC1 ZINC001256207229 970711385 /nfs/dbraw/zinc/71/13/85/970711385.db2.gz DAHXUSYAADEEHS-NWDGAFQWSA-N 2 0 210.365 2.201 20 0 BEADRP CC(C)[C@H]1CCC[N@@H+]1C1CCN(C)CC1 ZINC001256211035 970718782 /nfs/dbraw/zinc/71/87/82/970718782.db2.gz QFUCFJVSAVNRHH-CYBMUJFWSA-N 2 0 210.365 2.201 20 0 BEADRP Cc1cccc2c1CC[N@@H+]([C@H]1CC[NH2+][C@H](C)C1)C2 ZINC001246550314 972699086 /nfs/dbraw/zinc/69/90/86/972699086.db2.gz VIXGTXCIWCJFAA-HIFRSBDPSA-N 2 0 244.382 2.494 20 0 BEADRP Cc1cccc2c1CC[N@@H+]([C@H]1CC[NH2+][C@@H](C)C1)C2 ZINC001246550318 972702812 /nfs/dbraw/zinc/70/28/12/972702812.db2.gz VIXGTXCIWCJFAA-ZFWWWQNUSA-N 2 0 244.382 2.494 20 0 BEADRP C[C@@H]1CC([N@@H+]2CCC[C@](C)([NH3+])CC2)C[C@@H](C)O1 ZINC001246550488 972711631 /nfs/dbraw/zinc/71/16/31/972711631.db2.gz JNKCTQURIROZRE-BZPMIXESSA-N 2 0 240.391 2.146 20 0 BEADRP COC1CCC([N@@H+]2CCC[C@](C)([NH3+])CC2)CC1 ZINC001246553391 972751367 /nfs/dbraw/zinc/75/13/67/972751367.db2.gz RKBGGVAEFGIRAT-RUXDESIVSA-N 2 0 240.391 2.147 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@@H](C)CCCc1cccnc1 ZINC001327840119 972753190 /nfs/dbraw/zinc/75/31/90/972753190.db2.gz MSBNIDSBLMMHAO-KBPBESRZSA-N 2 0 249.402 2.380 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@H](C)CCc1ccco1 ZINC001327840254 972755680 /nfs/dbraw/zinc/75/56/80/972755680.db2.gz NIHHZPSMZQRNJA-NWDGAFQWSA-N 2 0 224.348 2.188 20 0 BEADRP C[NH2+]Cc1ccc2c(ccn2C2CC[NH2+]CC2)c1 ZINC001246575644 972878517 /nfs/dbraw/zinc/87/85/17/972878517.db2.gz NGDLNTXQGZFZMG-UHFFFAOYSA-N 2 0 243.354 2.285 20 0 BEADRP c1ccc(C[C@@H]2CCN([C@@H]3CCC[NH2+]C3)C2)cc1 ZINC001246789640 973097663 /nfs/dbraw/zinc/09/76/63/973097663.db2.gz DANSNFKKIRBENB-JKSUJKDBSA-N 2 0 244.382 2.303 20 0 BEADRP CC1(C)CCC[C@H]([N@@H+]2C[C@@H]3CC[NH2+]C[C@H]3C2)C1 ZINC001246848420 973152566 /nfs/dbraw/zinc/15/25/66/973152566.db2.gz VIAJSSHAJFGBNE-IHRRRGAJSA-N 2 0 236.403 2.497 20 0 BEADRP CC1(C)CCC[C@H]([N@@H+]2C[C@@H]3CC[NH2+]C[C@@H]3C2)C1 ZINC001246848424 973153801 /nfs/dbraw/zinc/15/38/01/973153801.db2.gz VIAJSSHAJFGBNE-MJBXVCDLSA-N 2 0 236.403 2.497 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]C[C@H]1CCCC[C@H]1C ZINC001328676847 973221917 /nfs/dbraw/zinc/22/19/17/973221917.db2.gz HVBMQZMTSGLGTQ-JHJVBQTASA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H]1CCC[C@H]([N@@H+]2C[C@H]3CC[C@@H](C2)[NH2+]C3)C1 ZINC001246867593 973235321 /nfs/dbraw/zinc/23/53/21/973235321.db2.gz PMPOMMLRPUTAOX-XUXIUFHCSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2C[C@H]3CC[C@@H](C2)[NH2+]C3)C[C@@H]1C ZINC001246870044 973247608 /nfs/dbraw/zinc/24/76/08/973247608.db2.gz YDIUWPDLKVJLOP-QTVXIADOSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]Cc1ccc2c(c1)CCC2 ZINC001328681534 973269375 /nfs/dbraw/zinc/26/93/75/973269375.db2.gz NJYWCFLDWGZDGI-GFCCVEGCSA-N 2 0 232.371 2.392 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H](C)c1ccc2c(c1)CCO2 ZINC001329022298 973434511 /nfs/dbraw/zinc/43/45/11/973434511.db2.gz CZSGLWPFAORSAK-NEPJUHHUSA-N 2 0 248.370 2.128 20 0 BEADRP C[C@H]1C[C@@H]1C[N@@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001329433400 973769656 /nfs/dbraw/zinc/76/96/56/973769656.db2.gz NAZQHWCFYMACHC-QWHCGFSZSA-N 2 0 222.376 2.108 20 0 BEADRP Cc1c2[nH+]c[nH]c2ccc1NC[C@H]1CCCC[NH2+]1 ZINC001171333485 973856614 /nfs/dbraw/zinc/85/66/14/973856614.db2.gz DZJDQLKUILNARL-LLVKDONJSA-N 2 0 244.342 2.425 20 0 BEADRP C[C@H]([NH3+])c1ccc(NC[C@@H]2CCCC[NH2+]2)cc1 ZINC001171335065 973868787 /nfs/dbraw/zinc/86/87/87/973868787.db2.gz SALNNTWCWOUEHK-FZMZJTMJSA-N 2 0 233.359 2.260 20 0 BEADRP CO[C@@H](C)C[NH2+]C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171623252 974114920 /nfs/dbraw/zinc/11/49/20/974114920.db2.gz QEYOZHKTCZYRPH-NSHDSACASA-N 2 0 242.407 2.262 20 0 BEADRP CC[NH+](CC)C[C@H](C)OCCCC[NH+](C)C ZINC001224992879 974123305 /nfs/dbraw/zinc/12/33/05/974123305.db2.gz VBYQTEXFEAXKOG-ZDUSSCGKSA-N 2 0 230.396 2.075 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+][C@@H]2Cc3cccc(F)c3C2)C1 ZINC001171783120 974172585 /nfs/dbraw/zinc/17/25/85/974172585.db2.gz KMKDATUIJBEPIS-RWMBFGLXSA-N 2 0 248.345 2.152 20 0 BEADRP N[C@@H]1CC[N@H+](C[C@H]2CC=CCC2)CC[C@H]1F ZINC001206155568 974329060 /nfs/dbraw/zinc/32/90/60/974329060.db2.gz MGGVDBYUVHOCRS-YNEHKIRRSA-N 2 0 226.339 2.104 20 0 BEADRP CCCOCC[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172104282 974365437 /nfs/dbraw/zinc/36/54/37/974365437.db2.gz DTUZQCDTTRGJRD-BTTYYORXSA-N 2 0 240.391 2.018 20 0 BEADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1ccoc1)C2 ZINC001172104772 974368385 /nfs/dbraw/zinc/36/83/85/974368385.db2.gz GAYPWFWSNCXZNH-BTTYYORXSA-N 2 0 234.343 2.385 20 0 BEADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H](n1cccc1CC[NH3+])C2 ZINC001172113367 974378786 /nfs/dbraw/zinc/37/87/86/974378786.db2.gz CKYKJECCAVAAPC-FICVDOATSA-N 2 0 247.386 2.177 20 0 BEADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CC3CC(C3)C1)C2 ZINC001172122340 974392863 /nfs/dbraw/zinc/39/28/63/974392863.db2.gz ACPSJVOXFUABLX-YJIWRGBVSA-N 2 0 234.387 2.344 20 0 BEADRP CC[N@@H+]1CC[C@H](Oc2ccc(C[NH+](C)C)cc2)C1 ZINC001225330967 974410094 /nfs/dbraw/zinc/41/00/94/974410094.db2.gz UXPUVDHSNGZARW-HNNXBMFYSA-N 2 0 248.370 2.221 20 0 BEADRP CC1(C)C[C@H]([NH2+]CCCCCCC[NH3+])CO1 ZINC001172278697 974496556 /nfs/dbraw/zinc/49/65/56/974496556.db2.gz WECDRXBWRQMVGX-LBPRGKRZSA-N 2 0 228.380 2.053 20 0 BEADRP CC[C@H](C)OCC[C@H](C)[NH2+]CCC[NH+](C)C ZINC001172315466 974521862 /nfs/dbraw/zinc/52/18/62/974521862.db2.gz KFYWCBYUMNUOCR-STQMWFEESA-N 2 0 230.396 2.121 20 0 BEADRP CCCCCC[C@@H](CCC)[NH2+]C[C@H](O)C[NH3+] ZINC001172379216 974585238 /nfs/dbraw/zinc/58/52/38/974585238.db2.gz SEHFZEBJFJVBAT-CHWSQXEVSA-N 2 0 230.396 2.035 20 0 BEADRP CCOCC[C@@H](C)[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC001172410558 974673107 /nfs/dbraw/zinc/67/31/07/974673107.db2.gz HUPCLGUULQNZKY-KGLIPLIRSA-N 2 0 242.407 2.123 20 0 BEADRP COCC1([NH2+][C@H]2CC[N@H+](C)C(C)(C)C2)CCC1 ZINC001331294200 974674238 /nfs/dbraw/zinc/67/42/38/974674238.db2.gz AENWICQYPBRQHS-LBPRGKRZSA-N 2 0 240.391 2.018 20 0 BEADRP CCOCC[C@H](C)[NH2+]C1CCC(CC[NH3+])CC1 ZINC001172414200 974680876 /nfs/dbraw/zinc/68/08/76/974680876.db2.gz FBUFGGOXGBFMEZ-HSBZDZAISA-N 2 0 242.407 2.299 20 0 BEADRP CCOCC[C@H](C)[N@H+](C)CC1CC[NH+](C)CC1 ZINC001172425072 974700890 /nfs/dbraw/zinc/70/08/90/974700890.db2.gz STGFYTBOHUPQGI-ZDUSSCGKSA-N 2 0 242.407 2.075 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]Cc1ccc2ncccc2c1 ZINC001331419319 974712071 /nfs/dbraw/zinc/71/20/71/974712071.db2.gz QKTGMCQFVXPYBC-GFCCVEGCSA-N 2 0 243.354 2.322 20 0 BEADRP CC[C@H](CC(C)C)[NH2+]CCC[NH+](C)C ZINC001172384370 974729591 /nfs/dbraw/zinc/72/95/91/974729591.db2.gz UCWYUMXUXHFLLB-GFCCVEGCSA-N 2 0 200.370 2.352 20 0 BEADRP CC(C)OCC[C@H](C)[N@H+](CCC[NH3+])C(C)C ZINC001172434953 974744490 /nfs/dbraw/zinc/74/44/90/974744490.db2.gz WCZNMJNNONNWJH-ZDUSSCGKSA-N 2 0 230.396 2.249 20 0 BEADRP CC[C@@H](CC(C)C)[N@H+](C)C[C@H](C)C[NH3+] ZINC001172394487 974746433 /nfs/dbraw/zinc/74/64/33/974746433.db2.gz VKQXHTTWFXWJOA-NEPJUHHUSA-N 2 0 200.370 2.338 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@@H](C)C1CCSCC1 ZINC001331833960 974830741 /nfs/dbraw/zinc/83/07/41/974830741.db2.gz KAEJBYIAPOZHFS-QWRGUYRKSA-N 2 0 230.421 2.106 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H]1CC(C)(C)C[C@H]1C ZINC001331836973 974831675 /nfs/dbraw/zinc/83/16/75/974831675.db2.gz YHEPXTGLEPLSEF-IJLUTSLNSA-N 2 0 212.381 2.399 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@H]([NH2+]Cc3ccccc3)[C@H]2C1 ZINC001204089095 974865439 /nfs/dbraw/zinc/86/54/39/974865439.db2.gz KSBIZZKVSZCIAG-KKUMJFAQSA-N 2 0 230.355 2.116 20 0 BEADRP NCC1([NH2+][C@H]2CC[C@@H](c3ccccc3)C2)CC1 ZINC001172557020 974869512 /nfs/dbraw/zinc/86/95/12/974869512.db2.gz NZYXVUSHAXNHRU-KGLIPLIRSA-N 2 0 230.355 2.404 20 0 BEADRP Cc1ccc2c(c1)C[C@H]([NH2+]CCC[NH+](C)C)CC2 ZINC001172824220 974944869 /nfs/dbraw/zinc/94/48/69/974944869.db2.gz RKWXDQFGVFOYJA-MRXNPFEDSA-N 2 0 246.398 2.394 20 0 BEADRP Cc1ccc2c(c1)C[C@@H]([NH2+]CC1CN(C)C1)CC2 ZINC001172840883 974954778 /nfs/dbraw/zinc/95/47/78/974954778.db2.gz FBXHCRQTQNVHAM-INIZCTEOSA-N 2 0 244.382 2.004 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)[C@H]1CCC[C@@H](OC)C1 ZINC001172951535 975007740 /nfs/dbraw/zinc/00/77/40/975007740.db2.gz RGOGUERIASWQJG-UONOGXRCSA-N 2 0 242.407 2.218 20 0 BEADRP CC1(C)[C@@H]([NH2+]C/C=C/C2CC2)[C@@H]2CCC[NH2+][C@@H]21 ZINC001332421421 975110459 /nfs/dbraw/zinc/11/04/59/975110459.db2.gz PVGWVAASXHLIBK-XUFMCNDDSA-N 2 0 234.387 2.319 20 0 BEADRP CCSC[C@H](C)[N@H+](C)CCC[NH+](C)C ZINC001173297386 975185273 /nfs/dbraw/zinc/18/52/73/975185273.db2.gz FTXMAVMCEQWSNN-NSHDSACASA-N 2 0 218.410 2.012 20 0 BEADRP CC[C@@H]1CC[C@H]([NH+]2C[C@@H]3C[NH+](CC)C[C@H]3C2)C1 ZINC001173282508 975241043 /nfs/dbraw/zinc/24/10/43/975241043.db2.gz GWSGTUNOXMNYNU-QPSCCSFWSA-N 2 0 236.403 2.449 20 0 BEADRP CC[N@@H+]1CC[C@H](n2ccc3c2cccc3C[NH3+])C1 ZINC001173347546 975288496 /nfs/dbraw/zinc/28/84/96/975288496.db2.gz DPZSSQWTOJCQAF-ZDUSSCGKSA-N 2 0 243.354 2.367 20 0 BEADRP Cc1ccc(CC[NH2+][C@H]2C[C@H]([NH3+])C23CCC3)cc1 ZINC001332877636 975304857 /nfs/dbraw/zinc/30/48/57/975304857.db2.gz IPQWTGWOGMJESN-GJZGRUSLSA-N 2 0 244.382 2.397 20 0 BEADRP C[N@H+]1C[C@H]2CC[C@@H](C1)C2[NH2+][C@@H]1CCC[C@@H](F)C1 ZINC001332897841 975313615 /nfs/dbraw/zinc/31/36/15/975313615.db2.gz LPYNKALKDMUNLU-DYPLGBCKSA-N 2 0 240.366 2.197 20 0 BEADRP C[NH+](C)C1CCC([NH2+][C@@H]2CC23CCC3)CC1 ZINC000721228176 975366105 /nfs/dbraw/zinc/36/61/05/975366105.db2.gz YDUZCRLTZXOGIJ-WXRRBKDZSA-N 2 0 222.376 2.391 20 0 BEADRP COC1(C[NH2+]CCCC[N@H+](C)C2CC2)CCC1 ZINC001333370378 975720199 /nfs/dbraw/zinc/72/01/99/975720199.db2.gz IEPYVQLNBMCEKK-UHFFFAOYSA-N 2 0 240.391 2.020 20 0 BEADRP C([C@H]1CCC[NH2+]C1)[N@@H+]1C[C@H](C2CC2)C[C@@H]1C1CC1 ZINC001333529759 975833694 /nfs/dbraw/zinc/83/36/94/975833694.db2.gz QWICAXAWCMFCLG-APHBMKBZSA-N 2 0 248.414 2.497 20 0 BEADRP c1cc(Nc2cc[nH+]c(N3CCCC3)c2)cc[nH+]1 ZINC001173881583 975925712 /nfs/dbraw/zinc/92/57/12/975925712.db2.gz ZTJFLPLCDXBSLK-UHFFFAOYSA-N 2 0 240.310 2.242 20 0 BEADRP C[N@@H+]1CCc2ccc(Nc3cc[nH+]cc3)cc2C1 ZINC001173884074 975964238 /nfs/dbraw/zinc/96/42/38/975964238.db2.gz FYVLTAPNPXWISH-UHFFFAOYSA-N 2 0 239.322 2.235 20 0 BEADRP C[NH+](C)[C@@H]1CC[C@@H]2C[N@H+](CC3(C)CC3)C[C@@H]2C1 ZINC001335133586 976860787 /nfs/dbraw/zinc/86/07/87/976860787.db2.gz JLWNSWFLYXVDNE-HZSPNIEDSA-N 2 0 236.403 2.449 20 0 BEADRP CCC[C@@H](C)[N@@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC000429015167 976981030 /nfs/dbraw/zinc/98/10/30/976981030.db2.gz XGDYMJUCCIUBIY-OLZOCXBDSA-N 2 0 210.365 2.203 20 0 BEADRP CC(C)C[C@@H](C[NH+]1CCCC1)Nc1cc[nH+]cc1 ZINC001336399551 977660812 /nfs/dbraw/zinc/66/08/12/977660812.db2.gz MSHGZTMQBLKUDJ-HNNXBMFYSA-N 2 0 247.386 2.426 20 0 BEADRP c1cc(NCC2CC[NH+](CC3CC3)CC2)cc[nH+]1 ZINC001336406313 977665361 /nfs/dbraw/zinc/66/53/61/977665361.db2.gz LQKLRHAYHGGGON-UHFFFAOYSA-N 2 0 245.370 2.037 20 0 BEADRP COCC[N@H+](Cc1cc2c[nH+]ccc2[nH]1)C(C)C ZINC001232013740 977839270 /nfs/dbraw/zinc/83/92/70/977839270.db2.gz DMQVKBNLYXAQOU-UHFFFAOYSA-N 2 0 247.342 2.420 20 0 BEADRP CO[C@@H]1CCC[N@H+](Cc2cc3c[nH+]ccc3[nH]2)C1 ZINC001232011742 977840639 /nfs/dbraw/zinc/84/06/39/977840639.db2.gz OKNCCSNIECMAKS-CYBMUJFWSA-N 2 0 245.326 2.174 20 0 BEADRP C[C@H]1C[N@H+](Cc2cc3c[nH+]ccc3[nH]2)CCCO1 ZINC001232012161 977841535 /nfs/dbraw/zinc/84/15/35/977841535.db2.gz UIJFPGOLDJPJJY-NSHDSACASA-N 2 0 245.326 2.174 20 0 BEADRP C[NH+]1CCC(C[NH2+]C23CCC(CC2)C3)CC1 ZINC001336749921 977915569 /nfs/dbraw/zinc/91/55/69/977915569.db2.gz BDQZPIMNHFVMKW-UHFFFAOYSA-N 2 0 222.376 2.251 20 0 BEADRP Cn1c[nH+]cc1Nc1ccc(C[NH+](C)C)cc1 ZINC001176292263 978013634 /nfs/dbraw/zinc/01/36/34/978013634.db2.gz LSSWPZIRHKEKIB-UHFFFAOYSA-N 2 0 230.315 2.225 20 0 BEADRP Cc1cc(C)[nH+]c(NCC[C@H]2CCC[NH2+]2)c1 ZINC000721827378 978043763 /nfs/dbraw/zinc/04/37/63/978043763.db2.gz IVPBYAMJOSTGIX-GFCCVEGCSA-N 2 0 219.332 2.252 20 0 BEADRP Cc1cc(C)[nH+]c(NC2(C)CC[NH2+]CC2)c1 ZINC000721825955 978045346 /nfs/dbraw/zinc/04/53/46/978045346.db2.gz DXBMMAJBKMKJNE-UHFFFAOYSA-N 2 0 219.332 2.252 20 0 BEADRP C[C@@]1(C[NH3+])CCC[N@H+](CC2CCC2)CC1 ZINC001206292492 978284941 /nfs/dbraw/zinc/28/49/41/978284941.db2.gz CBAKLTCCZIDPKF-CYBMUJFWSA-N 2 0 210.365 2.237 20 0 BEADRP Cc1cccc(C[N@@H+]2CCC[C@@](C)(C[NH3+])CC2)n1 ZINC001206293980 978293414 /nfs/dbraw/zinc/29/34/14/978293414.db2.gz IGMXDJUFHFOGNY-OAHLLOKOSA-N 2 0 247.386 2.341 20 0 BEADRP C[C@]1(C[NH3+])CCC[N@H+](Cc2ccc(O)cc2)CC1 ZINC001206293382 978295391 /nfs/dbraw/zinc/29/53/91/978295391.db2.gz HKADTXSMGYEYGP-HNNXBMFYSA-N 2 0 248.370 2.343 20 0 BEADRP C[C@@]1(C[NH3+])CCC[N@H+](Cc2ccc(O)cc2)CC1 ZINC001206293392 978296143 /nfs/dbraw/zinc/29/61/43/978296143.db2.gz HKADTXSMGYEYGP-OAHLLOKOSA-N 2 0 248.370 2.343 20 0 BEADRP c1cc(N2CCC[C@H]([NH+]3CCCC3)C2)cc[nH+]1 ZINC001337652087 978442863 /nfs/dbraw/zinc/44/28/63/978442863.db2.gz WRHZVJAQXWQLAP-AWEZNQCLSA-N 2 0 231.343 2.146 20 0 BEADRP C[NH+]1CCC([C@H]2CCN(c3cc[nH+]cc3)C2)CC1 ZINC001337654650 978443549 /nfs/dbraw/zinc/44/35/49/978443549.db2.gz HDJRJHMKVBLCMA-AWEZNQCLSA-N 2 0 245.370 2.250 20 0 BEADRP C[N@H+](CCNc1cc[nH+]cc1)C1CCCCC1 ZINC001337707505 978467112 /nfs/dbraw/zinc/46/71/12/978467112.db2.gz ODUIYPAKBBBSIJ-UHFFFAOYSA-N 2 0 233.359 2.180 20 0 BEADRP CN(CC[C@H]1CCCC[N@@H+]1C)c1cc[nH+]cc1 ZINC001337710267 978469967 /nfs/dbraw/zinc/46/99/67/978469967.db2.gz SNKHOSSDMHCELL-CYBMUJFWSA-N 2 0 233.359 2.392 20 0 BEADRP CC[C@@H](C)[N@H+]1C[C@@H]2CC[NH+](C)CC[C@@H]2C1 ZINC001277808541 978701294 /nfs/dbraw/zinc/70/12/94/978701294.db2.gz YOYFMTMIZZZSBQ-UPJWGTAASA-N 2 0 210.365 2.059 20 0 BEADRP Cc1cccc(C[NH2+][C@@H]2CC[C@H]3C[N@@H+](C)C[C@@H]32)c1 ZINC001179818652 978760888 /nfs/dbraw/zinc/76/08/88/978760888.db2.gz ZFHBCDFYJIVSTM-HRCADAONSA-N 2 0 244.382 2.425 20 0 BEADRP CC1=C[C@@H](C)[C@@H](C[N@@H+]2CC[C@H]3[NH2+]C[C@H]3C2)CC1 ZINC001235025472 978954917 /nfs/dbraw/zinc/95/49/17/978954917.db2.gz BZMLWXFEZDYROA-APIJFGDWSA-N 2 0 234.387 2.273 20 0 BEADRP C[C@@H]1C[C@H]1C[N@@H+]1CCCC[C@@]12CCC[NH2+]C2 ZINC001235176300 978990786 /nfs/dbraw/zinc/99/07/86/978990786.db2.gz ZYZGNYNNUMFXQZ-RDBSUJKOSA-N 2 0 222.376 2.251 20 0 BEADRP CC1=C[C@H](C)[C@@H](C[N@@H+]2C[C@@H]3CC[NH2+][C@@H]3C2)CC1 ZINC001235189211 978991771 /nfs/dbraw/zinc/99/17/71/978991771.db2.gz XSGUAPZLSMQTMR-LJISPDSOSA-N 2 0 234.387 2.273 20 0 BEADRP C[C@@H]1C[C@H]1C[NH+]1CCC([C@H]2CCCC[NH2+]2)CC1 ZINC001235231218 978998568 /nfs/dbraw/zinc/99/85/68/978998568.db2.gz DITYPRZQQJKYQK-VHDGCEQUSA-N 2 0 236.403 2.497 20 0 BEADRP CC1=CC[C@H](CC[N@H+]2C[C@@H]3[C@@H]([NH3+])[C@@H]3C2)C1(C)C ZINC001235209968 978998704 /nfs/dbraw/zinc/99/87/04/978998704.db2.gz GTSSRNQIZOKSQN-MQYQWHSLSA-N 2 0 234.387 2.258 20 0 BEADRP CCCC[C@H](CC)C[N@H+]1C[C@@H]2[C@@H]([NH3+])[C@@H]2C1 ZINC001235210541 979001033 /nfs/dbraw/zinc/00/10/33/979001033.db2.gz LUBSBRGFOTUZPH-WUHRBBMRSA-N 2 0 210.365 2.092 20 0 BEADRP CCC[C@H](C)C[N@@H+]1CC[C@@]2(C1)C[NH2+]CC[C@H]2F ZINC001235409758 979037441 /nfs/dbraw/zinc/03/74/41/979037441.db2.gz WUTILDPETAWHJQ-MJBXVCDLSA-N 2 0 242.382 2.446 20 0 BEADRP CCC(CC)C[N@@H+]1CC[C@]2(C1)C[NH2+]CC[C@@H]2F ZINC001235404154 979038486 /nfs/dbraw/zinc/03/84/86/979038486.db2.gz MTHQUWHGGKRQOU-UONOGXRCSA-N 2 0 242.382 2.446 20 0 BEADRP [NH3+]CCCC[N@@H+]1CC[C@H](c2ccccc2F)C1 ZINC001235727641 979133488 /nfs/dbraw/zinc/13/34/88/979133488.db2.gz VLOJBZNUWONRON-LBPRGKRZSA-N 2 0 236.334 2.354 20 0 BEADRP CC/C=C\CCCCCCN(CC[NH3+])CC[NH3+] ZINC001235877549 979178148 /nfs/dbraw/zinc/17/81/48/979178148.db2.gz QSYNFQIYUQNBLS-ARJAWSKDSA-N 2 0 241.423 2.123 20 0 BEADRP COc1ccccc1[C@@H](C)[N@H+](C)CCCC[NH3+] ZINC001235963534 979232577 /nfs/dbraw/zinc/23/25/77/979232577.db2.gz WLXXRFNHCYHWPH-GFCCVEGCSA-N 2 0 236.359 2.427 20 0 BEADRP C[C@H](C[N@@H+]1C[C@H]2CC[C@@]2([NH3+])C1)c1ccccc1 ZINC001235976607 979242769 /nfs/dbraw/zinc/24/27/69/979242769.db2.gz AJMBNGWFBNUNCJ-BPLDGKMQSA-N 2 0 230.355 2.213 20 0 BEADRP CC1=C[C@H](C)[C@H](C[N@@H+]2C[C@@H]3CC[C@@]3([NH3+])C2)CC1 ZINC001235977794 979244123 /nfs/dbraw/zinc/24/41/23/979244123.db2.gz HYKUKIJAQUAQFP-ZQDZILKHSA-N 2 0 234.387 2.402 20 0 BEADRP CC1(C[N@@H+]2C[C@@H]3CC[C@]3([NH3+])C2)CCCCC1 ZINC001235981992 979257413 /nfs/dbraw/zinc/25/74/13/979257413.db2.gz ZUAJVVIGKRLKEA-JSGCOSHPSA-N 2 0 222.376 2.380 20 0 BEADRP [NH3+][C@]12CC[C@H]1C[N@H+](CCC1CCCCC1)C2 ZINC001235981866 979258023 /nfs/dbraw/zinc/25/80/23/979258023.db2.gz YHJYLFCVUTWSDR-KBPBESRZSA-N 2 0 222.376 2.380 20 0 BEADRP Cc1ccc([C@@H]2CCC[N@@H+]2CCCC[NH3+])cn1 ZINC001236042555 979334829 /nfs/dbraw/zinc/33/48/29/979334829.db2.gz QGCXRBJNIQKHJW-AWEZNQCLSA-N 2 0 233.359 2.266 20 0 BEADRP Nc1ccc2c(c1)C[N@@H+](CCCCCC[NH3+])CC2 ZINC001236234348 979457263 /nfs/dbraw/zinc/45/72/63/979457263.db2.gz XSRUIQCKXBHLIH-UHFFFAOYSA-N 2 0 247.386 2.146 20 0 BEADRP CCC(CC)C[N@H+]1C[C@@H]2CC[NH2+]CC[C@@H]2C1 ZINC001236314145 979524753 /nfs/dbraw/zinc/52/47/53/979524753.db2.gz HSSNBULHNKSSJZ-OKILXGFUSA-N 2 0 224.392 2.354 20 0 BEADRP Cc1c(N)cc[nH+]c1-c1cccc2c1CC[NH2+]C2 ZINC001236343071 979541275 /nfs/dbraw/zinc/54/12/75/979541275.db2.gz HSUIMRNGCYDXOM-UHFFFAOYSA-N 2 0 239.322 2.285 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@@H]2C[C@H]2C2CCC2)CC1 ZINC001182497776 979546008 /nfs/dbraw/zinc/54/60/08/979546008.db2.gz DQRNJCRTGHKQKF-LSDHHAIUSA-N 2 0 236.403 2.497 20 0 BEADRP C[N@H+](CCCC1CCCCC1)[C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001236410747 979587296 /nfs/dbraw/zinc/58/72/96/979587296.db2.gz KMAYFEMORZSQTF-FICVDOATSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H]([NH3+])CN(C)Cc1ccc(F)c2ccoc21 ZINC001236909056 979794207 /nfs/dbraw/zinc/79/42/07/979794207.db2.gz OOUPANFCABBOJA-VIFPVBQESA-N 2 0 236.290 2.351 20 0 BEADRP Cc1ncc(C[N@@H+]2CCC[C@](C)([NH3+])CC2)s1 ZINC001205265321 979816028 /nfs/dbraw/zinc/81/60/28/979816028.db2.gz PTPABFSRCDAFSA-LBPRGKRZSA-N 2 0 239.388 2.155 20 0 BEADRP CCc1ccc(C[N@@H+]2CCC[C@](C)([NH3+])CC2)nc1 ZINC001205280805 979882317 /nfs/dbraw/zinc/88/23/17/979882317.db2.gz JHXQJTBBVFOFML-HNNXBMFYSA-N 2 0 247.386 2.347 20 0 BEADRP C1=CC[C@@H](C[NH2+]C[C@@H]2C[NH+]3CCC2CC3)CC1 ZINC001184135743 979945621 /nfs/dbraw/zinc/94/56/21/979945621.db2.gz VPMJAMFFALEXTC-UKRRQHHQSA-N 2 0 234.387 2.274 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH3+])CC21CC[NH2+]CC1 ZINC001239318280 980528088 /nfs/dbraw/zinc/52/80/88/980528088.db2.gz PZNMVIZBULFTPU-CYBMUJFWSA-N 2 0 216.328 2.020 20 0 BEADRP Cc1ccc(NC(=[NH2+])NC[C@H](C)C[NH+](C)C)cc1 ZINC001346588296 980866178 /nfs/dbraw/zinc/86/61/78/980866178.db2.gz DJEUQAFMPHDZCG-LBPRGKRZSA-N 2 0 248.374 2.129 20 0 BEADRP CC(C)C[NH+]1CCC([NH2+][C@@H]2C[C@H]2C2CC2)CC1 ZINC000716667519 981065955 /nfs/dbraw/zinc/06/59/55/981065955.db2.gz NRHJMWKJIVGDDX-LSDHHAIUSA-N 2 0 236.403 2.495 20 0 BEADRP COC(C)(C)CC[N@H+]1CC[C@@H](C[NH3+])[C@@H](C)CC1 ZINC001205599927 981153045 /nfs/dbraw/zinc/15/30/45/981153045.db2.gz AMWWIRHSVGSAMJ-STQMWFEESA-N 2 0 242.407 2.108 20 0 BEADRP C[C@@H](CNc1cc[nH+]cc1)[N@@H+]1CCC[C@H](C)C1 ZINC001347773132 981168739 /nfs/dbraw/zinc/16/87/39/981168739.db2.gz UBXIWHSLLFJHHY-STQMWFEESA-N 2 0 233.359 2.036 20 0 BEADRP CCOC(C)(C)C[N@@H+]1CC[C@H](C)[C@@H](C[NH3+])CC1 ZINC001205604856 981181973 /nfs/dbraw/zinc/18/19/73/981181973.db2.gz YFIVJSRBGHOIRV-QWHCGFSZSA-N 2 0 242.407 2.108 20 0 BEADRP Cc1c[nH]c(C[N@@H+]2CC[C@@H](C[NH3+])[C@@H](C)CC2)c1C ZINC001205625258 981267972 /nfs/dbraw/zinc/26/79/72/981267972.db2.gz ANUJZYQKDVSXTA-FZMZJTMJSA-N 2 0 249.402 2.438 20 0 BEADRP Cc1c[nH]c(C[N@H+]2CC[C@@H](C)[C@H](C[NH3+])CC2)c1C ZINC001205625259 981270750 /nfs/dbraw/zinc/27/07/50/981270750.db2.gz ANUJZYQKDVSXTA-RISCZKNCSA-N 2 0 249.402 2.438 20 0 BEADRP C[NH+](C)CCOc1ccccc1C1=CC[NH2+]CC1 ZINC001240466806 981401949 /nfs/dbraw/zinc/40/19/49/981401949.db2.gz ICGJMCYTZFAMMR-UHFFFAOYSA-N 2 0 246.354 2.004 20 0 BEADRP [NH3+]C1(c2ccccc2C2=CC[NH2+]CC2)CCC1 ZINC001240469529 981405245 /nfs/dbraw/zinc/40/52/45/981405245.db2.gz AJVSNGOOMSBBTO-UHFFFAOYSA-N 2 0 228.339 2.401 20 0 BEADRP [NH3+]C1(c2ccccc2C2=CC[NH2+]CC2)CC1 ZINC001240469600 981406237 /nfs/dbraw/zinc/40/62/37/981406237.db2.gz FGPVZXOXZFTFRF-UHFFFAOYSA-N 2 0 214.312 2.011 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@H](C)CC(C)(C)C ZINC001348853493 981458573 /nfs/dbraw/zinc/45/85/73/981458573.db2.gz URSMHWGEPCZUFK-GHMZBOCLSA-N 2 0 200.370 2.399 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@@H](C)c1ccc2c(c1)CCO2 ZINC001348852455 981459338 /nfs/dbraw/zinc/45/93/38/981459338.db2.gz MJIUJLHUGPLTPZ-RYUDHWBXSA-N 2 0 248.370 2.270 20 0 BEADRP C[NH+](C)CCOc1cccc(C2=CCC[NH2+]C2)c1 ZINC001240669662 981577406 /nfs/dbraw/zinc/57/74/06/981577406.db2.gz PRTOWLPSEYZHIP-UHFFFAOYSA-N 2 0 246.354 2.004 20 0 BEADRP c1ccc([C@@H]2C[C@H]2C[NH2+]CC2CC[NH2+]CC2)cc1 ZINC001580895579 981726271 /nfs/dbraw/zinc/72/62/71/981726271.db2.gz MXCZFAAMLOTPFN-HOTGVXAUSA-N 2 0 244.382 2.379 20 0 BEADRP CCC[C@@H](C)[NH2+]C1CC[NH+](CCCOC)CC1 ZINC000159117019 981827403 /nfs/dbraw/zinc/82/74/03/981827403.db2.gz JMCPZKZSGFZQSN-CYBMUJFWSA-N 2 0 242.407 2.266 20 0 BEADRP C[N@@H+]1CCc2cc(C=C3CC[NH2+]CC3)ccc2C1 ZINC001240878375 981931093 /nfs/dbraw/zinc/93/10/93/981931093.db2.gz GWEQTBKWFWQYMH-UHFFFAOYSA-N 2 0 242.366 2.441 20 0 BEADRP C[C@H]([NH3+])c1cccc(C=C2CC[NH2+]CC2)c1 ZINC001240878813 981933135 /nfs/dbraw/zinc/93/31/35/981933135.db2.gz OOEUWWAECUFDDC-NSHDSACASA-N 2 0 216.328 2.473 20 0 BEADRP [NH3+][C@H]1CCc2c1cccc2C=C1CC[NH2+]CC1 ZINC001240878351 981933380 /nfs/dbraw/zinc/93/33/80/981933380.db2.gz FVQSVCOWQHCADX-HNNXBMFYSA-N 2 0 228.339 2.399 20 0 BEADRP CCC[NH2+]CCN[C@@H](CCC[NH3+])c1ccccc1 ZINC001350955948 982134752 /nfs/dbraw/zinc/13/47/52/982134752.db2.gz KLMQSRRFPRSTBB-HNNXBMFYSA-N 2 0 249.402 2.056 20 0 BEADRP [NH3+]CC1CCC([NH2+]C[C@@H]2C=CCC2)CC1 ZINC001350958866 982139225 /nfs/dbraw/zinc/13/92/25/982139225.db2.gz VEFZXHOKSDCZAV-OTTFEQOBSA-N 2 0 208.349 2.060 20 0 BEADRP [NH3+]CC[C@H]1CC[N@H+](C[C@H]2CC3CCC2CC3)C1 ZINC000691700866 982226149 /nfs/dbraw/zinc/22/61/49/982226149.db2.gz KXVHQTBGQPHYSR-OOJKYFRXSA-N 2 0 236.403 2.483 20 0 BEADRP [NH3+]CC[C@@H]1CC[N@H+](C[C@H]2CC3CCC2CC3)C1 ZINC000691700864 982227342 /nfs/dbraw/zinc/22/73/42/982227342.db2.gz KXVHQTBGQPHYSR-HXSCFSKGSA-N 2 0 236.403 2.483 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H](C)Cc1ccc(F)cc1 ZINC001326035814 982376659 /nfs/dbraw/zinc/37/66/59/982376659.db2.gz BTUAZUIIRJUTHN-NEPJUHHUSA-N 2 0 238.350 2.344 20 0 BEADRP CC(C)C[N@@H+]1C[C@@H]2CC[C@@H]([NH+](C)C)C[C@@H]2C1 ZINC001352113634 982473201 /nfs/dbraw/zinc/47/32/01/982473201.db2.gz TUJRLEINIGBMQF-BFHYXJOUSA-N 2 0 224.392 2.305 20 0 BEADRP C[N@H+]1CC=C(c2ccccc2C2([NH3+])CC2)CC1 ZINC001241330115 982491275 /nfs/dbraw/zinc/49/12/75/982491275.db2.gz JOFNEEVWZCWTOY-UHFFFAOYSA-N 2 0 228.339 2.353 20 0 BEADRP C[C@@H]([NH3+])c1cccc(C2=CC[N@H+](C)CC2)c1 ZINC001241330518 982492181 /nfs/dbraw/zinc/49/21/81/982492181.db2.gz UVPYQNMTBBZXBH-LLVKDONJSA-N 2 0 216.328 2.425 20 0 BEADRP C[N@H+]1CC=C(c2ccc3c(c2)[C@@H]([NH3+])CC3)CC1 ZINC001241331716 982495132 /nfs/dbraw/zinc/49/51/32/982495132.db2.gz BTNHQUURDNUUOC-HNNXBMFYSA-N 2 0 228.339 2.352 20 0 BEADRP CNc1ccccc1CN1C[C@@H](C)CC[C@@H]1C[NH3+] ZINC001205838156 982699104 /nfs/dbraw/zinc/69/91/04/982699104.db2.gz BABYIKWGRISICC-GXTWGEPZSA-N 2 0 247.386 2.288 20 0 BEADRP CCC(C)(C)[NH+]1CCN(c2cc[nH+]cc2)CC1 ZINC001354028984 983116879 /nfs/dbraw/zinc/11/68/79/983116879.db2.gz KQLIDKVUKFSRJD-UHFFFAOYSA-N 2 0 233.359 2.392 20 0 BEADRP CCc1ccc(N(CC)CCC[NH+](C)C)nc1 ZINC001354171197 983183344 /nfs/dbraw/zinc/18/33/44/983183344.db2.gz JPKGFHMMVMFSOB-UHFFFAOYSA-N 2 0 235.375 2.422 20 0 BEADRP CC[N@H+]1C[C@@H]2C[NH+](CC3CCCCC3)C[C@@H]2C1 ZINC001201401261 983204544 /nfs/dbraw/zinc/20/45/44/983204544.db2.gz FPQKUSCDJOBWQV-GASCZTMLSA-N 2 0 236.403 2.450 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+]C/C=C\C1CC1 ZINC001354234583 983214755 /nfs/dbraw/zinc/21/47/55/983214755.db2.gz HVTZONDPKTWVCW-QZHHADFISA-N 2 0 220.360 2.058 20 0 BEADRP CCC(CC)C[NH+]1C[C@H]2C[NH+](CC)C[C@@H]2C1 ZINC001201534209 983327683 /nfs/dbraw/zinc/32/76/83/983327683.db2.gz DSWAXHLETSZXTF-ZIAGYGMSSA-N 2 0 224.392 2.306 20 0 BEADRP CC[N@@H+]1CCCC[C@@H]1C[C@@H]1CCC[NH+]1C ZINC001201586902 983349724 /nfs/dbraw/zinc/34/97/24/983349724.db2.gz WNGVAPXNOWYUDP-QWHCGFSZSA-N 2 0 210.365 2.345 20 0 BEADRP CN1CCC[C@H]2C[N@H+](CCc3ccccc3)C[C@@H]21 ZINC001201606093 983371932 /nfs/dbraw/zinc/37/19/32/983371932.db2.gz IJZYYHDXBSEGEN-HOTGVXAUSA-N 2 0 244.382 2.255 20 0 BEADRP CCCCC[N@@H+]1C[C@@H]2CCCN(C)[C@@H]2C1 ZINC001201737330 983442569 /nfs/dbraw/zinc/44/25/69/983442569.db2.gz IQEHDCHAHXTDRX-QWHCGFSZSA-N 2 0 210.365 2.203 20 0 BEADRP C[C@H](Cc1ccc(O)cc1)[NH2+]C[C@H]1CC[C@@H]([NH3+])C1 ZINC001576052622 984145517 /nfs/dbraw/zinc/14/55/17/984145517.db2.gz LZEAPCMONUBVIK-KWCYVHTRSA-N 2 0 248.370 2.040 20 0 BEADRP C[C@@H]1CCC[C@H](C2C[NH+](C[C@@]34C[C@@H]3C[NH2+]C4)C2)C1 ZINC001576668823 984178735 /nfs/dbraw/zinc/17/87/35/984178735.db2.gz GUPWOZLOJIWQBI-CLWVCHIJSA-N 2 0 248.414 2.354 20 0 BEADRP CC[C@H]([NH3+])C[NH2+][C@@H](CC)CCC(F)(F)F ZINC001577124762 984190820 /nfs/dbraw/zinc/19/08/20/984190820.db2.gz PJJRGYQYYLHDJH-IUCAKERBSA-N 2 0 226.286 2.434 20 0 BEADRP CC[C@H](CCC(F)(F)F)[NH2+]C[C@@H]([NH3+])CC ZINC001577124761 984191283 /nfs/dbraw/zinc/19/12/83/984191283.db2.gz PJJRGYQYYLHDJH-DTWKUNHWSA-N 2 0 226.286 2.434 20 0 BEADRP CSCCC[N@@H+]1CCC[C@@H](C[NH3+])[C@H](C)C1 ZINC001205984502 984217188 /nfs/dbraw/zinc/21/71/88/984217188.db2.gz SJLDELXFGLMRQL-NEPJUHHUSA-N 2 0 230.421 2.046 20 0 BEADRP C[NH2+]Cc1ccc(-c2cc(N)cc[nH+]2)cc1 ZINC001242989123 984353477 /nfs/dbraw/zinc/35/34/77/984353477.db2.gz VFKMWTXJWDZKJQ-UHFFFAOYSA-N 2 0 213.284 2.050 20 0 BEADRP CCCC[NH+]1CCC2(CC[N@H+](C)C2)CC1 ZINC001275115850 984492202 /nfs/dbraw/zinc/49/22/02/984492202.db2.gz NMRZAFURGKXBCY-UHFFFAOYSA-N 2 0 210.365 2.204 20 0 BEADRP C[NH2+][C@@]12CC[C@@]([NH2+]Cc3cc[nH]c3)(C1)CCC2 ZINC001276103520 984814670 /nfs/dbraw/zinc/81/46/70/984814670.db2.gz KOSGVINZZSCTNZ-UONOGXRCSA-N 2 0 233.359 2.169 20 0 BEADRP CCC[C@H](CC)[N@H+]1C[C@H]2C[NH+](C)C[C@H]2C1 ZINC001257266666 984865352 /nfs/dbraw/zinc/86/53/52/984865352.db2.gz QOKBLMPDIRCUBY-XQQFMLRXSA-N 2 0 210.365 2.059 20 0 BEADRP CC[C@H]([NH2+]CC1C[NH2+]C1)c1ccc(C)c(F)c1 ZINC001578234415 984884934 /nfs/dbraw/zinc/88/49/34/984884934.db2.gz YYKLXSIQXMDQFB-AWEZNQCLSA-N 2 0 236.334 2.394 20 0 BEADRP CCc1ccc(C[NH2+]C2CC3(CC([NH3+])C3)C2)o1 ZINC001578259722 984902568 /nfs/dbraw/zinc/90/25/68/984902568.db2.gz HMMAEXGJTRYUEE-UHFFFAOYSA-N 2 0 234.343 2.202 20 0 BEADRP CC1CC(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)C1 ZINC000691917248 984942295 /nfs/dbraw/zinc/94/22/95/984942295.db2.gz LAKULXNWGDZRAG-ZRRUAHMRSA-N 2 0 222.376 2.247 20 0 BEADRP CCCCC[C@H](C)NC(=[NH2+])SCC[NH3+] ZINC001257501911 985125386 /nfs/dbraw/zinc/12/53/86/985125386.db2.gz NDPJCXVFLDMGPK-VIFPVBQESA-N 2 0 217.382 2.171 20 0 BEADRP CC[N@H+](CCC[NH+](C)C)[C@H]1CCCSC1 ZINC001257682903 985274194 /nfs/dbraw/zinc/27/41/94/985274194.db2.gz KPFBFXSMZZUTSM-LBPRGKRZSA-N 2 0 230.421 2.156 20 0 BEADRP CNc1ccccc1C[NH2+][C@H]1C[C@H]([NH3+])C12CCC2 ZINC001578764561 985333878 /nfs/dbraw/zinc/33/38/78/985333878.db2.gz YROSKFNUNUMIEY-KBPBESRZSA-N 2 0 245.370 2.088 20 0 BEADRP CC(C)C[C@H](C)C[C@@H](C)[NH2+]CCOCC[NH3+] ZINC001258054409 985354664 /nfs/dbraw/zinc/35/46/64/985354664.db2.gz COFHZKFJBRPKOZ-QWHCGFSZSA-N 2 0 230.396 2.012 20 0 BEADRP C[N@H+](CCOC(C)(C)C)C[C@@H]1CCCC[NH2+]C1 ZINC000690053573 985367219 /nfs/dbraw/zinc/36/72/19/985367219.db2.gz JAVFTDMHHUYBGB-CYBMUJFWSA-N 2 0 242.407 2.123 20 0 BEADRP C[NH2+]Cc1ccc(/C=C/C2CC[NH2+]CC2)cc1 ZINC001243896613 985583235 /nfs/dbraw/zinc/58/32/35/985583235.db2.gz KJZOKGQMNNSZGT-NSCUHMNNSA-N 2 0 230.355 2.419 20 0 BEADRP C(C[NH2+]C1CC1)C[N@@H+]1CCC[C@@H]1C1CCC1 ZINC000688239843 985585724 /nfs/dbraw/zinc/58/57/24/985585724.db2.gz NAGZOXYOLVFRDH-CQSZACIVSA-N 2 0 222.376 2.393 20 0 BEADRP CSCC[C@H](C)[NH2+]CCC1CC[NH+](C)CC1 ZINC001258198956 985602870 /nfs/dbraw/zinc/60/28/70/985602870.db2.gz UASZCFLBLCSOKF-LBPRGKRZSA-N 2 0 244.448 2.450 20 0 BEADRP C[NH+]1CCC(C[NH2+]CCCC2CCC2)CC1 ZINC000688424052 985633468 /nfs/dbraw/zinc/63/34/68/985633468.db2.gz XNHCUODNWXZPSD-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP COc1ccc(C2=C[NH2+]CCC2)c(C[NH+](C)C)c1 ZINC001243951196 985653228 /nfs/dbraw/zinc/65/32/28/985653228.db2.gz CHNDFDLHRUNOEJ-UHFFFAOYSA-N 2 0 246.354 2.481 20 0 BEADRP CC[C@H](CC(F)F)C[N@@H+]1CC[C@@H](CC[NH3+])C1 ZINC000688725585 985714713 /nfs/dbraw/zinc/71/47/13/985714713.db2.gz IQKBEMHRDDXRCG-GHMZBOCLSA-N 2 0 234.334 2.339 20 0 BEADRP CO[C@H]1CCCC[C@@H]1[NH2+]CCCCCC[NH3+] ZINC001579130331 985808220 /nfs/dbraw/zinc/80/82/20/985808220.db2.gz SQIWXJLPVFBDEU-STQMWFEESA-N 2 0 228.380 2.053 20 0 BEADRP CCCCC[C@H](CC)[NH2+]CCC[N@H+](C)CCO ZINC001258435283 985880501 /nfs/dbraw/zinc/88/05/01/985880501.db2.gz JVSMJYYTMMEZQA-AWEZNQCLSA-N 2 0 244.423 2.249 20 0 BEADRP C[C@@H]1C[N@H+](CC2CC3(CCC3)C2)C[C@H]1C[NH3+] ZINC001579440290 985928387 /nfs/dbraw/zinc/92/83/87/985928387.db2.gz TXQUUQWEBOHLPO-DGCLKSJQSA-N 2 0 222.376 2.093 20 0 BEADRP C[C@@H](CC1CC1)[N@@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC001258473542 985938111 /nfs/dbraw/zinc/93/81/11/985938111.db2.gz NKSKXIOMMNKXRW-GXTWGEPZSA-N 2 0 222.376 2.203 20 0 BEADRP C[C@]1(CN[C@@H]2CC[NH2+]C2)C[C@@H]1c1ccccc1 ZINC001579509440 986054856 /nfs/dbraw/zinc/05/48/56/986054856.db2.gz OTFYMFDQGKDVFQ-RBSFLKMASA-N 2 0 230.355 2.132 20 0 BEADRP C[C@]12C[N@H+](C[C@H]3CC[C@@H]([NH3+])C3)C[C@H]1[C@H]1C=C[C@@H]2C1 ZINC001579510086 986060152 /nfs/dbraw/zinc/06/01/52/986060152.db2.gz SVYFXSWOYXRAQP-UGYDUONOSA-N 2 0 246.398 2.258 20 0 BEADRP Cc1ccc(CC[NH2+]CCC2=CC[NH2+]CC2)cc1 ZINC001579686969 986172801 /nfs/dbraw/zinc/17/28/01/986172801.db2.gz BSVHXYKKEFCUFU-UHFFFAOYSA-N 2 0 244.382 2.437 20 0 BEADRP CC[C@H](C)C[C@H](CC)[NH2+]CCC[N@H+](C)CCO ZINC001258786945 986205245 /nfs/dbraw/zinc/20/52/45/986205245.db2.gz DAZCZUFGDAPCPU-KBPBESRZSA-N 2 0 244.423 2.105 20 0 BEADRP Cc1ccc2cc(C[NH2+][C@H]3C[C@@H]([NH3+])C3)ccc2n1 ZINC001579739927 986209894 /nfs/dbraw/zinc/20/98/94/986209894.db2.gz FQLQWNVABWJSFU-OKILXGFUSA-N 2 0 241.338 2.123 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2CC[C@H](C)[C@@H]2C)CC1 ZINC001461886974 986213907 /nfs/dbraw/zinc/21/39/07/986213907.db2.gz KMHMGFYPKRRJGE-STQMWFEESA-N 2 0 224.392 2.449 20 0 BEADRP Cc1cccnc1[C@H](C)[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC001579808112 986223071 /nfs/dbraw/zinc/22/30/71/986223071.db2.gz ZKLGXQFVVGMIOP-KBPBESRZSA-N 2 0 247.386 2.430 20 0 BEADRP Cc1cccnc1[C@@H](C)[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC001579808114 986226549 /nfs/dbraw/zinc/22/65/49/986226549.db2.gz ZKLGXQFVVGMIOP-KGLIPLIRSA-N 2 0 247.386 2.430 20 0 BEADRP Cc1ccsc1CC[NH2+][C@@H]1CC[C@H](C[NH3+])C1 ZINC001579816192 986238535 /nfs/dbraw/zinc/23/85/35/986238535.db2.gz YLWYPURZTKDXHG-NWDGAFQWSA-N 2 0 238.400 2.316 20 0 BEADRP Cc1coc(C[NH2+]C2(C3CC[NH2+]CC3)CC2)c1 ZINC001579831105 986257059 /nfs/dbraw/zinc/25/70/59/986257059.db2.gz YCMGYRXVAQALCG-UHFFFAOYSA-N 2 0 234.343 2.210 20 0 BEADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CC(C)C1 ZINC001258907057 986311608 /nfs/dbraw/zinc/31/16/08/986311608.db2.gz DOKOWUYUXJUYKN-ZDUSSCGKSA-N 2 0 212.381 2.449 20 0 BEADRP C[NH2+]Cc1cccc(-c2[nH+]ccc(N)c2C)c1F ZINC001244857698 986403900 /nfs/dbraw/zinc/40/39/00/986403900.db2.gz NFQITRVQROWSAG-UHFFFAOYSA-N 2 0 245.301 2.498 20 0 BEADRP FCCC1C[C@H]2CC[C@@H](C1)[N@H+]2CCC1C[NH2+]C1 ZINC001580027267 986423812 /nfs/dbraw/zinc/42/38/12/986423812.db2.gz OXWYFSQUBIYYQS-QXMXGUDHSA-N 2 0 240.366 2.199 20 0 BEADRP Fc1ccc(/C=C/C[NH2+]CC2CC[NH2+]CC2)cc1 ZINC001580029792 986431406 /nfs/dbraw/zinc/43/14/06/986431406.db2.gz BIHQEGYIRPJIMF-OWOJBTEDSA-N 2 0 248.345 2.428 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@H]([NH2+][C@@H]3CC[C@H]3C3CCC3)[C@@H]2C1 ZINC001462674649 986501636 /nfs/dbraw/zinc/50/16/36/986501636.db2.gz YXXHIYMLCXKQJR-RBZJEDDUSA-N 2 0 248.414 2.495 20 0 BEADRP FCC[C@H]1CCC[N@H+](C[C@H]2CCCC[NH2+]C2)C1 ZINC000689443485 986610539 /nfs/dbraw/zinc/61/05/39/986610539.db2.gz AVGCHCGNLPASQN-KGLIPLIRSA-N 2 0 242.382 2.448 20 0 BEADRP [NH3+][C@]12CCC[C@@H]1C[N@H+](CC1CC3(CCC3)C1)C2 ZINC001580158560 986632049 /nfs/dbraw/zinc/63/20/49/986632049.db2.gz SUKBRYOTICYQAQ-HIFRSBDPSA-N 2 0 234.387 2.380 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH+]2CCC[C@@H](F)CC2)CC1 ZINC001254517558 986651299 /nfs/dbraw/zinc/65/12/99/986651299.db2.gz VKZZPMXRRGCDMA-CHWSQXEVSA-N 2 0 228.355 2.295 20 0 BEADRP C[N@@H+]1CCC[C@@H]([NH+]2CC[C@@]3(CC3(F)F)C2)CC1 ZINC001254525094 986672034 /nfs/dbraw/zinc/67/20/34/986672034.db2.gz FZKAHYKBJWAHIH-VXGBXAGGSA-N 2 0 244.329 2.202 20 0 BEADRP [NH3+]CCC[N@@H+]1CCCC[C@H]1Cc1ccc(O)cc1 ZINC001580298692 986736906 /nfs/dbraw/zinc/73/69/06/986736906.db2.gz YIRRYLTWRHGKKN-AWEZNQCLSA-N 2 0 248.370 2.138 20 0 BEADRP [NH3+]C[C@H]1CC[C@H]([NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)CC1 ZINC001580331716 986768412 /nfs/dbraw/zinc/76/84/12/986768412.db2.gz FNCXEMJNGXKSRB-XGFWRYKXSA-N 2 0 222.376 2.282 20 0 BEADRP [NH3+]Cc1cccc(C[NH2+][C@@H]2C=CCCC2)c1 ZINC001580343070 986780555 /nfs/dbraw/zinc/78/05/55/986780555.db2.gz VXCOMHBNJMEWBD-CQSZACIVSA-N 2 0 216.328 2.344 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[N@@H+]2CC[C@H]2c2ccc(F)cc2)C1 ZINC001580419069 986839193 /nfs/dbraw/zinc/83/91/93/986839193.db2.gz RKPGJGIHXBLNNE-GDLCADMTSA-N 2 0 234.318 2.310 20 0 BEADRP C[N@@H+]1CC[C@@H](n2c(CC[NH3+])cc3ccccc32)C1 ZINC001255424625 986943807 /nfs/dbraw/zinc/94/38/07/986943807.db2.gz ZIOUPXFRCZDFFO-CQSZACIVSA-N 2 0 243.354 2.019 20 0 BEADRP C[C@H]([NH3+])c1cccc(-c2ccncc2C[NH3+])c1 ZINC001245563050 986959289 /nfs/dbraw/zinc/95/92/89/986959289.db2.gz XHBLTIFTYPTLQM-JTQLQIEISA-N 2 0 227.311 2.227 20 0 BEADRP C[NH+](C)CCCCC[NH2+][C@H]1CCOC(C)(C)C1 ZINC001255527896 987007141 /nfs/dbraw/zinc/00/71/41/987007141.db2.gz ZJTBRHUGEIJZNV-ZDUSSCGKSA-N 2 0 242.407 2.266 20 0 BEADRP COC[C@H](C)[NH+]1CCC([NH3+])(CC2CCC2)CC1 ZINC001255563184 987012631 /nfs/dbraw/zinc/01/26/31/987012631.db2.gz RCLBMQOXIHYLDU-LBPRGKRZSA-N 2 0 240.391 2.005 20 0 BEADRP CC[NH+](CC)CC[C@@H](C)[N@@H+]1CCC[C@@H](OC)C1 ZINC001255954440 987099399 /nfs/dbraw/zinc/09/93/99/987099399.db2.gz DOQOVZANTXYCGZ-ZIAGYGMSSA-N 2 0 242.407 2.218 20 0 BEADRP C[C@H]([NH3+])[C@H]1CC[N@H+](C[C@H]2CC3CCC2CC3)C1 ZINC000691657810 987288151 /nfs/dbraw/zinc/28/81/51/987288151.db2.gz AIQKXNBCFRNUME-HKKVPVCXSA-N 2 0 236.403 2.482 20 0 BEADRP CC[C@@H]1[C@@H](C)CC[N@@H+]1C[C@H]1CCCC[NH2+]C1 ZINC000697017472 987345238 /nfs/dbraw/zinc/34/52/38/987345238.db2.gz SPJYCACUJLJFEM-MELADBBJSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H]1C[N@H+](C[C@H]2CCCC[NH2+]C2)CCS1 ZINC000697054785 987346400 /nfs/dbraw/zinc/34/64/00/987346400.db2.gz FZCGTSYJMJSPRA-QWHCGFSZSA-N 2 0 242.432 2.204 20 0 BEADRP c1ccc2c(c1)CN(C[C@@H]1CCCC[NH2+]C1)C2 ZINC000697058589 987346652 /nfs/dbraw/zinc/34/66/52/987346652.db2.gz RMENEDHRIMETCE-CYBMUJFWSA-N 2 0 230.355 2.392 20 0 BEADRP CC[N@H+](CC1CC1)C[C@H]1CCCC[NH2+]C1 ZINC000697040312 987347618 /nfs/dbraw/zinc/34/76/18/987347618.db2.gz HZRKADQZWCGDPM-ZDUSSCGKSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@@H]1CC(F)(F)CC[N@@H+]1C[C@@H]1CCCC[NH2+]C1 ZINC000697640487 987363288 /nfs/dbraw/zinc/36/32/88/987363288.db2.gz GPYSLCKTCIYFSV-VXGBXAGGSA-N 2 0 246.345 2.496 20 0 BEADRP CC[C@H](C)OCC[C@@H](C)[NH2+]CC1([NH3+])CCCC1 ZINC001246074546 987364225 /nfs/dbraw/zinc/36/42/25/987364225.db2.gz DPZWAXPEQGGGCO-OLZOCXBDSA-N 2 0 242.407 2.441 20 0 BEADRP CC(C)OCC[C@H](C)[NH2+]CC1([NH3+])CCCC1 ZINC001246077395 987368022 /nfs/dbraw/zinc/36/80/22/987368022.db2.gz WCKKWKUMBZKNCK-LBPRGKRZSA-N 2 0 228.380 2.051 20 0 BEADRP C[C@H](Cc1cccc(F)c1)[NH2+]C1CC[NH2+]CC1 ZINC001246077183 987369531 /nfs/dbraw/zinc/36/95/31/987369531.db2.gz HWEZHIGQGYOVEF-LLVKDONJSA-N 2 0 236.334 2.098 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]C2(C)CCCCC2)CC[NH2+]1 ZINC001246080748 987375416 /nfs/dbraw/zinc/37/54/16/987375416.db2.gz JQASRWZKMWPGNU-RYUDHWBXSA-N 2 0 210.365 2.439 20 0 BEADRP Cc1cc2cc(C[NH3+])ccc2n1[C@H]1CCC[NH2+]C1 ZINC001246084128 987379831 /nfs/dbraw/zinc/37/98/31/987379831.db2.gz WCYOPXSWMXRIAS-AWEZNQCLSA-N 2 0 243.354 2.333 20 0 BEADRP CC[C@H](C)OCC[C@@H](C)[NH2+][C@@H]1CCCC[NH2+]C1 ZINC001246089917 987395247 /nfs/dbraw/zinc/39/52/47/987395247.db2.gz HSSDPYFAKQWJQJ-HZSPNIEDSA-N 2 0 242.407 2.312 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H]2CC[NH2+][C@@H](C)C2)cc1 ZINC001246094065 987403107 /nfs/dbraw/zinc/40/31/07/987403107.db2.gz FORSHUAZPVABPG-DZGCQCFKSA-N 2 0 232.371 2.268 20 0 BEADRP C[C@@H]1CC[C@@H](C[NH2+]C2Cc3ccccc3C2)C[NH2+]1 ZINC001246095088 987405207 /nfs/dbraw/zinc/40/52/07/987405207.db2.gz JSJHPOTWGPEVBL-CHWSQXEVSA-N 2 0 244.382 2.132 20 0 BEADRP CC(C)OCC[C@@H](C)[NH2+]C[C@H]1CC[C@@H](C)C[NH2+]1 ZINC001246106241 987438481 /nfs/dbraw/zinc/43/84/81/987438481.db2.gz OROGYVYEPMNFJI-MGPQQGTHSA-N 2 0 242.407 2.168 20 0 BEADRP C[C@H]1C[NH2+]C[C@@H]1[NH2+][C@H]1C[C@@H](C)CC(C)(C)C1 ZINC001246108743 987440768 /nfs/dbraw/zinc/44/07/68/987440768.db2.gz MRTLBRBZQWCLME-VOAKCMCISA-N 2 0 224.392 2.399 20 0 BEADRP CCSC[C@H](C)[NH2+]C[C@H]1CCC[NH2+][C@H]1C ZINC001246110509 987445480 /nfs/dbraw/zinc/44/54/80/987445480.db2.gz MCIWCYISKJMUIW-SDDRHHMPSA-N 2 0 230.421 2.106 20 0 BEADRP C[C@H]1CCC[C@H]([NH2+][C@H]2CCCC[NH2+]C2)C1 ZINC001246117624 987461414 /nfs/dbraw/zinc/46/14/14/987461414.db2.gz RZPNTTPNBWRBBY-AVGNSLFASA-N 2 0 210.365 2.297 20 0 BEADRP CC1(C)CCC([NH2+][C@H]2C[NH2+]CC23CC3)CC1 ZINC001246134714 987488148 /nfs/dbraw/zinc/48/81/48/987488148.db2.gz RWFZNQAVCXCNFI-LBPRGKRZSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@H]2C[NH2+]CC23CC3)C[C@H]1C ZINC001246135228 987490163 /nfs/dbraw/zinc/49/01/63/987490163.db2.gz SYORIVJODBGVPE-NDBYEHHHSA-N 2 0 222.376 2.153 20 0 BEADRP CCCC[C@H](CCC)[NH2+][C@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001246142280 987499913 /nfs/dbraw/zinc/49/99/13/987499913.db2.gz BZUNSYDGWLAUQX-RVMXOQNASA-N 2 0 210.365 2.153 20 0 BEADRP CCC[C@@H](C)CC[C@H](C)[NH2+][C@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001246147118 987501976 /nfs/dbraw/zinc/50/19/76/987501976.db2.gz LBHJASKSCWHGJJ-XHJNMGKDSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+][C@H]2CC[C@@H]3C[NH2+]C[C@@H]32)C[C@H]1C ZINC001246145117 987505022 /nfs/dbraw/zinc/50/50/22/987505022.db2.gz OUBHXAJDEAXXHB-MBIARJLFSA-N 2 0 236.403 2.399 20 0 BEADRP CC[C@@H]1CC([NH2+]CCCCC[NH3+])C[C@@H](CC)[NH2+]1 ZINC001246165449 987526211 /nfs/dbraw/zinc/52/62/11/987526211.db2.gz QZYLXNUSIUCFRF-CHWSQXEVSA-N 3 0 241.423 2.014 20 0 BEADRP C[C@@H]1C[C@H](n2c(C[NH3+])cc3ccccc32)CC[NH2+]1 ZINC001246164798 987526709 /nfs/dbraw/zinc/52/67/09/987526709.db2.gz BKOUPDQUXQWDBC-DGCLKSJQSA-N 2 0 243.354 2.413 20 0 BEADRP C[C@H]1CC[C@H](n2ccc3ccc(C[NH3+])cc32)C[NH2+]1 ZINC001246170271 987534429 /nfs/dbraw/zinc/53/44/29/987534429.db2.gz QOPBQKRCTRGDKD-FZMZJTMJSA-N 2 0 243.354 2.413 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CCCc2cccs2)CC[NH2+]1 ZINC001246171514 987538049 /nfs/dbraw/zinc/53/80/49/987538049.db2.gz WHLQINKITSLFKF-RYUDHWBXSA-N 2 0 238.400 2.411 20 0 BEADRP C[C@@H]([NH2+]C1C[C@@H](C)[NH2+][C@H](C)C1)c1cccc(N)c1 ZINC001246177564 987548244 /nfs/dbraw/zinc/54/82/44/987548244.db2.gz UGHLVUHRIYOBPG-IJLUTSLNSA-N 2 0 247.386 2.448 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CC[NH2+]2)CC(C)(C)C1 ZINC001246192674 987577387 /nfs/dbraw/zinc/57/73/87/987577387.db2.gz JHPGLFIUQJOVBS-WOPDTQHZSA-N 2 0 210.365 2.153 20 0 BEADRP Cc1cccc2c1CC[C@H]([NH2+]C[C@@H]1CCC[NH2+]1)C2 ZINC001246196386 987590262 /nfs/dbraw/zinc/59/02/62/987590262.db2.gz WNIFTBWSROALRJ-GJZGRUSLSA-N 2 0 244.382 2.194 20 0 BEADRP CC[C@H](C)OCC[C@H](C)[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC001246204995 987600580 /nfs/dbraw/zinc/60/05/80/987600580.db2.gz KGOQARZDIXJMSC-IGQOVBAYSA-N 2 0 242.407 2.440 20 0 BEADRP CCCC[C@@H](CCC)[NH2+][C@@H]1CC[NH2+]C[C@H]1OC ZINC001246217376 987613819 /nfs/dbraw/zinc/61/38/19/987613819.db2.gz FVNGSBGYNAXZCE-MGPQQGTHSA-N 2 0 242.407 2.312 20 0 BEADRP Cc1ccc(CN[C@@H]2CC[NH2+][C@@H](C)C2)c(F)c1 ZINC001246229572 987627378 /nfs/dbraw/zinc/62/73/78/987627378.db2.gz DJRYTQIPPNGYOA-WCQYABFASA-N 2 0 236.334 2.364 20 0 BEADRP C[C@@H](CCCC(C)(C)O)[NH2+][C@H]1CC[NH2+][C@H](C)C1 ZINC001246230730 987630370 /nfs/dbraw/zinc/63/03/70/987630370.db2.gz LLTSJXCPBKRQKN-XQQFMLRXSA-N 2 0 242.407 2.046 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@H]2CCCc3ncccc32)CC[NH2+]1 ZINC001246231921 987630489 /nfs/dbraw/zinc/63/04/89/987630489.db2.gz UZPDONRNTVNOIL-XUJVJEKNSA-N 2 0 245.370 2.189 20 0 BEADRP CC(C)C([NH2+][C@@H]1CC[NH2+][C@H](C)C1)C(C)C ZINC001246237594 987635145 /nfs/dbraw/zinc/63/51/45/987635145.db2.gz PDQAQZMPOJCSAW-VXGBXAGGSA-N 2 0 212.381 2.397 20 0 BEADRP CC[C@@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)c1ccncc1 ZINC001246238573 987638595 /nfs/dbraw/zinc/63/85/95/987638595.db2.gz QACGCKPEFBMGBP-MRVWCRGKSA-N 2 0 233.359 2.263 20 0 BEADRP CC[C@@H]([NH2+][C@H]1CC[NH2+][C@H](C)C1)c1cccnc1 ZINC001246240654 987642119 /nfs/dbraw/zinc/64/21/19/987642119.db2.gz SSGUVKUBVZBWMC-KWCYVHTRSA-N 2 0 233.359 2.263 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]C2CCCCCCC2)C[NH2+]1 ZINC001246242300 987645347 /nfs/dbraw/zinc/64/53/47/987645347.db2.gz DCMVDFQFPFSAHH-WCQYABFASA-N 2 0 210.365 2.439 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CC(C)(C)C[NH3+])C[C@@H]1C ZINC001246243445 987646683 /nfs/dbraw/zinc/64/66/83/987646683.db2.gz GKEFDWYGYPYNCF-WOPDTQHZSA-N 2 0 212.381 2.386 20 0 BEADRP CCCC[C@H]1C[C@@H](NCCC(C)(C)[NH3+])CC[NH2+]1 ZINC001246271911 987658244 /nfs/dbraw/zinc/65/82/44/987658244.db2.gz JGHCJVOMSDHPLH-STQMWFEESA-N 2 0 241.423 2.014 20 0 BEADRP CC[C@@H]1C[C@H](NCCC(C)(C)[NH3+])C[C@H](CC)[NH2+]1 ZINC001246273662 987670238 /nfs/dbraw/zinc/67/02/38/987670238.db2.gz QNYQVQFZGHGTNS-ITGUQSILSA-N 2 0 241.423 2.013 20 0 BEADRP CC1(C)CCC[C@@H]1[NH2+][C@H]1CCCC[NH2+]C1 ZINC001246283459 987679801 /nfs/dbraw/zinc/67/98/01/987679801.db2.gz CEIQGIYYLZREBG-RYUDHWBXSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H]1CCc2cccc(F)c2C1 ZINC001246303263 987701901 /nfs/dbraw/zinc/70/19/01/987701901.db2.gz FSFRIJWRAPYGFN-CMPLNLGQSA-N 2 0 236.334 2.010 20 0 BEADRP CC[NH+]1CCC(C[NH+]2C[C@@H](C)[C@H](C)C2)CC1 ZINC001474370322 987702354 /nfs/dbraw/zinc/70/23/54/987702354.db2.gz XHFKPXATGCTOKO-CHWSQXEVSA-N 2 0 224.392 2.306 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@@H]1CCc2ccc(C)cc2C1 ZINC001246312045 987710990 /nfs/dbraw/zinc/71/09/90/987710990.db2.gz FAJQUJUFSYRORH-HUUCEWRRSA-N 2 0 232.371 2.179 20 0 BEADRP CCCOC1CCC([NH2+]C[C@H]([NH3+])CC)CC1 ZINC001246310905 987712226 /nfs/dbraw/zinc/71/22/26/987712226.db2.gz AGOSXEFBNAJTBB-PNESKVBLSA-N 2 0 228.380 2.051 20 0 BEADRP C[C@@H]1C[C@@H](n2ccc3cccc(C[NH3+])c32)CC[NH2+]1 ZINC001246325903 987730704 /nfs/dbraw/zinc/73/07/04/987730704.db2.gz KISDGNYIKRWDEW-RISCZKNCSA-N 2 0 243.354 2.413 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C(C)(C)c2ccncc2)CC[NH2+]1 ZINC001246329026 987733701 /nfs/dbraw/zinc/73/37/01/987733701.db2.gz MWGLSKBINULLTL-YPMHNXCESA-N 2 0 233.359 2.047 20 0 BEADRP CCCC[C@@H]1C[C@@H](NC(C)(C)CC[NH3+])CC[NH2+]1 ZINC001246357823 987763203 /nfs/dbraw/zinc/76/32/03/987763203.db2.gz ASTHAITYFFKGAQ-OLZOCXBDSA-N 2 0 241.423 2.014 20 0 BEADRP CC[C@@H]1CC(NC(C)(C)CC[NH3+])C[C@@H](CC)[NH2+]1 ZINC001246362487 987767063 /nfs/dbraw/zinc/76/70/63/987767063.db2.gz LWPQJQLCRDVLFV-VXGBXAGGSA-N 2 0 241.423 2.013 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+][C@@H]2CCCC[NH2+]C2)CC1 ZINC001246363048 987772632 /nfs/dbraw/zinc/77/26/32/987772632.db2.gz OPSPVZOOYBNHSQ-FRRDWIJNSA-N 2 0 210.365 2.297 20 0 BEADRP COCc1ccc(C[NH2+][C@H]2CC[NH2+][C@@H](C)C2)cc1 ZINC001246368039 987773267 /nfs/dbraw/zinc/77/32/67/987773267.db2.gz NPVDZHBTXALIFR-WFASDCNBSA-N 2 0 248.370 2.063 20 0 BEADRP Fc1ccc2c(c1)C[C@@H]([NH2+]C1CC[NH2+]CC1)CC2 ZINC001246399567 987783620 /nfs/dbraw/zinc/78/36/20/987783620.db2.gz ZKOOEWOGJYJDOU-HNNXBMFYSA-N 2 0 248.345 2.025 20 0 BEADRP c1ccc2c(c1)CC[C@H]2C[NH2+][C@@H]1CCCC[NH2+]C1 ZINC001246418608 987790904 /nfs/dbraw/zinc/79/09/04/987790904.db2.gz DUAZVJBUJIJFOB-LSDHHAIUSA-N 2 0 244.382 2.448 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]C(C)(C)Cc2ccccn2)CC[NH2+]1 ZINC001246432851 987793711 /nfs/dbraw/zinc/79/37/11/987793711.db2.gz IDRFBNURGBYYEM-STQMWFEESA-N 2 0 247.386 2.133 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CC2(CC3CC3)CC2)CC[NH2+]1 ZINC001246430957 987795380 /nfs/dbraw/zinc/79/53/80/987795380.db2.gz HQZOBZJCZUKCEB-WCQYABFASA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCC(C)(C)C2)C[NH2+]1 ZINC001246437248 987798695 /nfs/dbraw/zinc/79/86/95/987798695.db2.gz UMQDKCHMZIZFBS-IJLUTSLNSA-N 2 0 210.365 2.153 20 0 BEADRP Fc1ccccc1CC1(N[C@@H]2CCC[NH2+]C2)CC1 ZINC001246440442 987799533 /nfs/dbraw/zinc/79/95/33/987799533.db2.gz UBUATPUKZRQQSJ-CYBMUJFWSA-N 2 0 248.345 2.242 20 0 BEADRP CCC[C@@H](Cc1ccccc1)[NH2+][C@H]1CC12C[NH2+]C2 ZINC001246445419 987802950 /nfs/dbraw/zinc/80/29/50/987802950.db2.gz OBKNGTSORBKMQX-GJZGRUSLSA-N 2 0 244.382 2.349 20 0 BEADRP CC(C)=CCC[C@@H](C)[NH2+][C@@H]1CC12C[NH2+]C2 ZINC001246446829 987804676 /nfs/dbraw/zinc/80/46/76/987804676.db2.gz UGCNJZDOFRQJDB-VXGBXAGGSA-N 2 0 208.349 2.073 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2Cc3ccc(F)cc3C2)CC[NH2+]1 ZINC001246451896 987809572 /nfs/dbraw/zinc/80/95/72/987809572.db2.gz IFIOPLPUHFROKX-WKPIXPDZSA-N 2 0 248.345 2.023 20 0 BEADRP CC(C)CC[C@H](C)[NH2+]CCC[NH2+]CCCC[NH3+] ZINC001246455475 987813726 /nfs/dbraw/zinc/81/37/26/987813726.db2.gz FOHPNZUKRUNEMD-AWEZNQCLSA-N 3 0 243.439 2.119 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+][C@H]2C[C@@](C)([NH3+])C2)C[C@@H]1C ZINC001246460738 987820212 /nfs/dbraw/zinc/82/02/12/987820212.db2.gz MUCBLPDSXMTJLN-MLGHIDQZSA-N 2 0 210.365 2.281 20 0 BEADRP CCCCC[C@H](CC)[NH2+][C@H]1CN[C@H](COC)C1 ZINC001246463846 987824195 /nfs/dbraw/zinc/82/41/95/987824195.db2.gz HQGGQBRCXIEQIO-MJBXVCDLSA-N 2 0 242.407 2.312 20 0 BEADRP CC(C)[NH2+]CC[NH2+][C@@H]1CC[C@H](C)[C@H](C)C1 ZINC001246467634 987825326 /nfs/dbraw/zinc/82/53/26/987825326.db2.gz ZJJFXJNEVGWQBZ-YNEHKIRRSA-N 2 0 212.381 2.399 20 0 BEADRP CCOC1CCC([NH2+][C@H]2CCCC[C@H]2[NH3+])CC1 ZINC001246475319 987831983 /nfs/dbraw/zinc/83/19/83/987831983.db2.gz DZUIWLRXAMIKPF-PQAZSJQKSA-N 2 0 240.391 2.194 20 0 BEADRP CCCC(CCC)[NH2+]C[C@@H]1CC[NH2+]C[C@@H]1F ZINC001246474874 987832396 /nfs/dbraw/zinc/83/23/96/987832396.db2.gz BVTMIVSMGKDKTR-AAEUAGOBSA-N 2 0 230.371 2.492 20 0 BEADRP CC(C)CC[C@@H](C)[NH2+]C[C@@H]1CC[NH2+]C[C@@H]1F ZINC001246474836 987832887 /nfs/dbraw/zinc/83/28/87/987832887.db2.gz BQQRPORORIKCTE-AGIUHOORSA-N 2 0 230.371 2.348 20 0 BEADRP C[C@H]1CCC[C@H]([NH2+]C[C@@H]2CC[NH2+]C[C@@H]2F)C1 ZINC001246477313 987834911 /nfs/dbraw/zinc/83/49/11/987834911.db2.gz NWICJZDNJAXNNZ-CYDGBPFRSA-N 2 0 228.355 2.102 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+][C@H]2CCCC[C@H]2[NH3+])C1 ZINC001246478298 987837175 /nfs/dbraw/zinc/83/71/75/987837175.db2.gz NVQUPGQWFQHGHG-LPWJVIDDSA-N 2 0 210.365 2.425 20 0 BEADRP CC[C@H]1CC[C@@H]([NH2+]C[C@@H]2CC[NH2+]C[C@@H]2F)C1 ZINC001246478956 987838367 /nfs/dbraw/zinc/83/83/67/987838367.db2.gz ZUGITFQXVUXFOI-RVMXOQNASA-N 2 0 228.355 2.102 20 0 BEADRP F[C@H]1C[NH2+]CC[C@H]1C[NH2+]C1CCCCCC1 ZINC001246478540 987839300 /nfs/dbraw/zinc/83/93/00/987839300.db2.gz WTIYHDRRMGPEJI-AAEUAGOBSA-N 2 0 228.355 2.246 20 0 BEADRP C[NH2+][C@H]1C[C@@H]([NH2+]C2C[C@H](C)C[C@@H](C)C2)C1 ZINC001246494795 987849311 /nfs/dbraw/zinc/84/93/11/987849311.db2.gz HTBLJIUNSHFWBL-UZWSLXQKSA-N 2 0 210.365 2.151 20 0 BEADRP CC[C@@H](Cc1ccccc1)[NH2+][C@H]1C[C@@H]([NH2+]C)C1 ZINC001246496364 987850048 /nfs/dbraw/zinc/85/00/48/987850048.db2.gz MYALZVZRYRYQRQ-SOUVJXGZSA-N 2 0 232.371 2.348 20 0 BEADRP C[NH2+][C@H]1C[C@@H]([NH2+][C@H]2CCc3c(C)cccc3C2)C1 ZINC001246496214 987850066 /nfs/dbraw/zinc/85/00/66/987850066.db2.gz NNFVKQZKIDPQQP-SOUVJXGZSA-N 2 0 244.382 2.192 20 0 BEADRP C[NH2+][C@H]1C[C@@H]([NH2+][C@@H](C)CCC=C(C)C)C1 ZINC001246495018 987850340 /nfs/dbraw/zinc/85/03/40/987850340.db2.gz JCMQCZMQVGTARB-RWMBFGLXSA-N 2 0 210.365 2.461 20 0 BEADRP C[NH2+][C@H]1C[C@@H]([NH2+][C@@H]2CC[C@H](C)[C@@H](C)C2)C1 ZINC001246496631 987851153 /nfs/dbraw/zinc/85/11/53/987851153.db2.gz PEMDERSRFFMBNC-IEECTRCBSA-N 2 0 210.365 2.151 20 0 BEADRP C[NH2+][C@H]1C[C@@H]([NH2+][C@H](C)Cc2ccc(C)cc2)C1 ZINC001246499036 987853300 /nfs/dbraw/zinc/85/33/00/987853300.db2.gz RLYQEELPIZHYRM-YUELXQCFSA-N 2 0 232.371 2.266 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CCCc3ccncc32)CC[NH2+]1 ZINC001246501641 987855906 /nfs/dbraw/zinc/85/59/06/987855906.db2.gz BCJUWANASIIMGJ-KYOSRNDESA-N 2 0 245.370 2.189 20 0 BEADRP Cc1cncc([C@H]([NH2+]C2CC[NH2+]CC2)C2CC2)c1 ZINC001246513378 987863653 /nfs/dbraw/zinc/86/36/53/987863653.db2.gz DRXGEWYPPRHBHI-OAHLLOKOSA-N 2 0 245.370 2.183 20 0 BEADRP CC(C)[C@@H]([NH2+]C1CC[NH2+]CC1)c1ccncc1 ZINC001246515936 987865291 /nfs/dbraw/zinc/86/52/91/987865291.db2.gz PCSVSDRWMMVISF-CQSZACIVSA-N 2 0 233.359 2.120 20 0 BEADRP CSC(C)(C)C[C@@H](C)[N@@H+]1CC[C@@](C)([NH3+])C1 ZINC001246529494 987885893 /nfs/dbraw/zinc/88/58/93/987885893.db2.gz KNLMRLOLNYUUDW-ZYHUDNBSSA-N 2 0 230.421 2.330 20 0 BEADRP CSC(C)(C)C[C@@H](C)[N@@H+]1CC[C@](C)([NH3+])C1 ZINC001246529493 987886393 /nfs/dbraw/zinc/88/63/93/987886393.db2.gz KNLMRLOLNYUUDW-PWSUYJOCSA-N 2 0 230.421 2.330 20 0 BEADRP CCCCC[C@@H](CC)[N@@H+]1CCO[C@H](CC[NH3+])C1 ZINC001246535694 987895583 /nfs/dbraw/zinc/89/55/83/987895583.db2.gz OTSUEILOINSQML-ZIAGYGMSSA-N 2 0 242.407 2.395 20 0 BEADRP C[C@H]1C[N@@H+]([C@@H]2CC[C@@H](C)[C@H](C)C2)C[C@H]1C[NH3+] ZINC001246541670 987910102 /nfs/dbraw/zinc/91/01/02/987910102.db2.gz MNKURBWAUIAWSS-RKQHYHRCSA-N 2 0 224.392 2.338 20 0 BEADRP CC[C@@H](CC(C)C)[N@@H+]1C[C@H](C)[C@H](C[NH3+])C1 ZINC001246540989 987913091 /nfs/dbraw/zinc/91/30/91/987913091.db2.gz LITKAQKPZYYPBP-XQQFMLRXSA-N 2 0 212.381 2.338 20 0 BEADRP CC[C@H](CC(C)C)[NH+]1CCC(C[NH3+])CC1 ZINC001246541762 987914507 /nfs/dbraw/zinc/91/45/07/987914507.db2.gz ZMZCDGOHQXSBLG-CYBMUJFWSA-N 2 0 212.381 2.482 20 0 BEADRP CCCC[C@H](CC)[N@@H+]1CCC[C@](O)(C[NH3+])CC1 ZINC001246545131 987917484 /nfs/dbraw/zinc/91/74/84/987917484.db2.gz TYZFCTJJCOJLSZ-UONOGXRCSA-N 2 0 242.407 2.131 20 0 BEADRP Cc1ccc(C[C@H](C)[N@@H+]2C[C@H](C)[C@H](C[NH3+])C2)cc1 ZINC001246544727 987919328 /nfs/dbraw/zinc/91/93/28/987919328.db2.gz YKAYBTQKAXMKEV-OFQRWUPVSA-N 2 0 246.398 2.453 20 0 BEADRP Cc1ccc2c(c1)C[C@H]([N@H+]1CC[C@@H]([NH3+])[C@H]1C)CC2 ZINC001246546107 987927236 /nfs/dbraw/zinc/92/72/36/987927236.db2.gz YGKRPQSEBQNIFO-DAXOMENPSA-N 2 0 244.382 2.274 20 0 BEADRP CO[C@@H]1CCC[C@@H]([N@@H+]2CCC[C@](C)([NH3+])CC2)C1 ZINC001246546812 987929082 /nfs/dbraw/zinc/92/90/82/987929082.db2.gz AKRHKGCNEADANT-MCIONIFRSA-N 2 0 240.391 2.147 20 0 BEADRP C[C@H](CC1CC1)[N@@H+]1CCC[C@](C)([NH3+])CC1 ZINC001246548367 987934669 /nfs/dbraw/zinc/93/46/69/987934669.db2.gz GIAITTQLRHXXJW-YPMHNXCESA-N 2 0 210.365 2.378 20 0 BEADRP C[NH2+]C[C@@H]1CCC[N@@H+]([C@H]2C[C@@H]3[C@H](C2)C3(C)C)C1 ZINC001246549937 987946855 /nfs/dbraw/zinc/94/68/55/987946855.db2.gz LAQBWAJWQVJKGT-FQUUOJAGSA-N 2 0 236.403 2.352 20 0 BEADRP CC1(C)C[C@@H]([N@@H+]2CCC[C@@](C)([NH3+])CC2)CCO1 ZINC001246552070 987951143 /nfs/dbraw/zinc/95/11/43/987951143.db2.gz NRBVZNCPKHXICI-GXTWGEPZSA-N 2 0 240.391 2.147 20 0 BEADRP CSCC[C@@H](C)[N@@H+]1CCC[C@](C)([NH3+])CC1 ZINC001246552935 987951972 /nfs/dbraw/zinc/95/19/72/987951972.db2.gz QDXBDAMEBHOKGZ-NEPJUHHUSA-N 2 0 230.421 2.331 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]C/C=C/c1ccccc1OC ZINC001117953790 987967080 /nfs/dbraw/zinc/96/70/80/987967080.db2.gz PVEZAIXHRHYTJS-STMXVASLSA-N 2 0 248.370 2.296 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]C/C=C/c1ccccc1OC ZINC001117953788 987969533 /nfs/dbraw/zinc/96/95/33/987969533.db2.gz PVEZAIXHRHYTJS-CFNZNRNTSA-N 2 0 248.370 2.296 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]C/C=C\c1ccccc1OC ZINC001117953791 987969825 /nfs/dbraw/zinc/96/98/25/987969825.db2.gz PVEZAIXHRHYTJS-WOLRVDTOSA-N 2 0 248.370 2.296 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H](C)CCC(F)(F)F ZINC001118057446 987993418 /nfs/dbraw/zinc/99/34/18/987993418.db2.gz QVJOGXRAZMXNLL-BDAKNGLRSA-N 2 0 226.286 2.305 20 0 BEADRP CCC(CC)[N@@H+]1CC[C@@H](C)[C@H](C[NH3+])CC1 ZINC001246561923 987998617 /nfs/dbraw/zinc/99/86/17/987998617.db2.gz USYNDFFNBYPQKT-NEPJUHHUSA-N 2 0 212.381 2.482 20 0 BEADRP CCC(CC)[N@@H+]1CC[C@H](C)[C@@H](C[NH3+])CC1 ZINC001246561924 987998637 /nfs/dbraw/zinc/99/86/37/987998637.db2.gz USYNDFFNBYPQKT-NWDGAFQWSA-N 2 0 212.381 2.482 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H](C)c1ccc(OC)cc1 ZINC001118060131 987998884 /nfs/dbraw/zinc/99/88/84/987998884.db2.gz WRVLZGQEBAHPKJ-NEPJUHHUSA-N 2 0 236.359 2.344 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H](C)c1ccnc(Cl)c1 ZINC001118059796 987999235 /nfs/dbraw/zinc/99/92/35/987999235.db2.gz STQOJPSTTQKVSU-VHSXEESVSA-N 2 0 241.766 2.241 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2CC[C@@H](C)[C@@H](C[NH3+])CC2)C1 ZINC001246561458 987999710 /nfs/dbraw/zinc/99/97/10/987999710.db2.gz SUMGDYFFCQGTCT-SYQHCUMBSA-N 2 0 224.392 2.482 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H]1CCc2c1cccc2F ZINC001118060120 987999716 /nfs/dbraw/zinc/99/97/16/987999716.db2.gz WHLNQSTWAYMGCC-QMTHXVAHSA-N 2 0 236.334 2.401 20 0 BEADRP CCCCC(CCCC)[N@@H+]1CC[C@@H]([NH3+])[C@H](O)C1 ZINC001246562801 988001419 /nfs/dbraw/zinc/00/14/19/988001419.db2.gz ZMOVRTBITNFCSS-ZIAGYGMSSA-N 2 0 242.407 2.129 20 0 BEADRP CCC(C)(C)[C@H](C)[NH2+]CC[C@@H](C)[NH2+]C ZINC001118121689 988017846 /nfs/dbraw/zinc/01/78/46/988017846.db2.gz HKQZFMJXHKXYBX-MNOVXSKESA-N 2 0 200.370 2.399 20 0 BEADRP C[C@@H]1C[C@@H]([N@@H+]2CC[C@H](C)C(F)(F)CC2)CC[NH2+]1 ZINC001246563960 988010991 /nfs/dbraw/zinc/01/09/91/988010991.db2.gz DMGBCWRJVBQELN-TUAOUCFPSA-N 2 0 246.345 2.494 20 0 BEADRP CC1([NH2+][C@@H]2C[C@@H]([NH3+])c3ccccc32)CC1 ZINC001118118924 988019081 /nfs/dbraw/zinc/01/90/81/988019081.db2.gz KQDNVEDJDQBJML-VXGBXAGGSA-N 2 0 202.301 2.273 20 0 BEADRP CCC(C)(C)[C@@H](C)[NH2+]CC[C@H](C)[NH2+]C ZINC001118121691 988021374 /nfs/dbraw/zinc/02/13/74/988021374.db2.gz HKQZFMJXHKXYBX-WDEREUQCSA-N 2 0 200.370 2.399 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+]CCCCOc1ccccc1 ZINC001118119618 988023375 /nfs/dbraw/zinc/02/33/75/988023375.db2.gz OJQHWXMBYDLWRC-LSDHHAIUSA-N 2 0 248.370 2.315 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H](C)c1ccc(F)cc1 ZINC001118121979 988029373 /nfs/dbraw/zinc/02/93/73/988029373.db2.gz MBHOKJJILFOKEZ-MNOVXSKESA-N 2 0 224.323 2.474 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2CCC[C@@H](C)[C@H](C)C2)CC[NH2+]1 ZINC001246578140 988087863 /nfs/dbraw/zinc/08/78/63/988087863.db2.gz YJQMPHGCOLYBLB-AAVRWANBSA-N 2 0 224.392 2.495 20 0 BEADRP CC1(C)[C@@H]2C[C@H]([N@@H+]3CCCC[C@@H](C[NH3+])C3)C[C@@H]21 ZINC001246584946 988136034 /nfs/dbraw/zinc/13/60/34/988136034.db2.gz XBBWFQLWPIYKRX-FQUUOJAGSA-N 2 0 236.403 2.482 20 0 BEADRP C[C@]1(C[NH3+])CCCC[N@@H+]([C@@H]2C[C@H]3C[C@H]3C2)C1 ZINC001246585014 988136529 /nfs/dbraw/zinc/13/65/29/988136529.db2.gz NRZXXXUJXNWLTQ-XJFOESAGSA-N 2 0 222.376 2.236 20 0 BEADRP CC1(C[N@@H+]2CCCC3(CC[NH2+]CC3)C2)CC1 ZINC001118243512 988149178 /nfs/dbraw/zinc/14/91/78/988149178.db2.gz UPXSJPMNVRZMGV-UHFFFAOYSA-N 2 0 222.376 2.252 20 0 BEADRP C[C@H](Cc1ccccn1)[N@@H+]1CCCC[C@@H](C[NH3+])C1 ZINC001246592530 988180228 /nfs/dbraw/zinc/18/02/28/988180228.db2.gz KBGCQTOZJRHHAP-KGLIPLIRSA-N 2 0 247.386 2.073 20 0 BEADRP C[C@H]1C[C@H]([N@@H+]2CCCC[C@@](C)(C[NH3+])C2)CCO1 ZINC001246594250 988187439 /nfs/dbraw/zinc/18/74/39/988187439.db2.gz PIEDEAYFKWHYIY-MJBXVCDLSA-N 2 0 240.391 2.005 20 0 BEADRP CCCCC[C@@H](CC)[NH+]1CC(C[NH2+]C)C1 ZINC001246597069 988196492 /nfs/dbraw/zinc/19/64/92/988196492.db2.gz LRFGBXSQGRQHKX-CYBMUJFWSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@H]1CC([NH+]2CC(C)(C[NH3+])C2)C[C@H](C)C1 ZINC001246599697 988202779 /nfs/dbraw/zinc/20/27/79/988202779.db2.gz PWBHJUYAGIKRRD-GHMZBOCLSA-N 2 0 210.365 2.092 20 0 BEADRP CC(C)=CCC[C@@H](C)[NH+]1CC(C)(C[NH3+])C1 ZINC001246601432 988206180 /nfs/dbraw/zinc/20/61/80/988206180.db2.gz VGQSVTVEDCHLSX-GFCCVEGCSA-N 2 0 210.365 2.402 20 0 BEADRP C[C@@H]1C[C@@H]([NH+]2CC(C)(C[NH3+])C2)CC(C)(C)C1 ZINC001246601274 988207961 /nfs/dbraw/zinc/20/79/61/988207961.db2.gz UNTSXLUKAHVPAW-VXGBXAGGSA-N 2 0 224.392 2.482 20 0 BEADRP CC[C@@H](C)C[C@H](CC)[NH+]1CC(C)(C[NH3+])C1 ZINC001246602425 988217633 /nfs/dbraw/zinc/21/76/33/988217633.db2.gz XIKVOOBDSNPDFT-NEPJUHHUSA-N 2 0 212.381 2.482 20 0 BEADRP CC(C)CCC[C@H](C)N1CC2(C[NH2+]C2)C1 ZINC001246611247 988224483 /nfs/dbraw/zinc/22/44/83/988224483.db2.gz BMGKWOAPJMZTSC-LBPRGKRZSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2CC[C@H]3C[NH2+]CC[C@H]32)C[C@H]1C ZINC001246617539 988250523 /nfs/dbraw/zinc/25/05/23/988250523.db2.gz DBILPCBQUSZUSJ-NIFZNCRKSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@@H]1CC[C@@H]([N@@H+]2CC[C@H]3C[NH2+]CC[C@H]32)C[C@@H]1C ZINC001246617538 988256566 /nfs/dbraw/zinc/25/65/66/988256566.db2.gz DBILPCBQUSZUSJ-GZBLMMOJSA-N 2 0 236.403 2.495 20 0 BEADRP CC1(C)CCC[C@H]([N@@H+]2CC[C@@H]3[NH2+]CC[C@H]32)C1 ZINC001246629779 988305896 /nfs/dbraw/zinc/30/58/96/988305896.db2.gz GLOOVYGWHCNHOJ-RWMBFGLXSA-N 2 0 222.376 2.391 20 0 BEADRP CC[C@@H](CC(C)C)[N@@H+]1CC[C@@H]2CC[NH2+][C@@H]2C1 ZINC001246634032 988313623 /nfs/dbraw/zinc/31/36/23/988313623.db2.gz GSLARTRLUBTHBW-MELADBBJSA-N 2 0 224.392 2.495 20 0 BEADRP CCCC[C@@H](CC)[N@@H+]1CC[C@H]2[NH2+]CC[C@H]21 ZINC001246634931 988314189 /nfs/dbraw/zinc/31/41/89/988314189.db2.gz BLWVYKGJPCPNQT-JHJVBQTASA-N 2 0 210.365 2.391 20 0 BEADRP CC[C@H](Cc1ccccc1)N1CC[C@H]2[NH2+]CC[C@H]21 ZINC001246636304 988331154 /nfs/dbraw/zinc/33/11/54/988331154.db2.gz GEGGVJOEUIMRKL-BZUAXINKSA-N 2 0 244.382 2.444 20 0 BEADRP C[C@H]1C[C@@H]([N@H+]2C[C@@H]3CC(F)(F)C[C@@H]3C2)CC[NH2+]1 ZINC001246636637 988331544 /nfs/dbraw/zinc/33/15/44/988331544.db2.gz DFAIOMYZQYYYNN-YFKTTZPYSA-N 2 0 244.329 2.104 20 0 BEADRP CC[C@@H](Cc1ccccc1)N1CC[C@H]2[NH2+]CC[C@H]21 ZINC001246636300 988331674 /nfs/dbraw/zinc/33/16/74/988331674.db2.gz GEGGVJOEUIMRKL-ARFHVFGLSA-N 2 0 244.382 2.444 20 0 BEADRP CC1(C)CC[C@H]([N@@H+]2CC[C@H]3[NH2+]CC[C@H]32)C1 ZINC001246638519 988338983 /nfs/dbraw/zinc/33/89/83/988338983.db2.gz LXMAQSREJVZZSX-QJPTWQEYSA-N 2 0 208.349 2.001 20 0 BEADRP CC[C@@H](CC(C)C)[N@@H+]1CC[C@@H]2[NH2+]CC[C@H]21 ZINC001246638659 988342992 /nfs/dbraw/zinc/34/29/92/988342992.db2.gz BSZFQDLWTPNLJJ-RWMBFGLXSA-N 2 0 210.365 2.247 20 0 BEADRP CC[C@H]1CC[C@@H]([N@@H+]2CC[C@@H]3[NH2+]CC[C@H]32)C1 ZINC001246644306 988353976 /nfs/dbraw/zinc/35/39/76/988353976.db2.gz SBRGLLAOYXLWIT-QNWHQSFQSA-N 2 0 208.349 2.001 20 0 BEADRP CC[C@@H](C)C[C@H](CC)[N@@H+]1CC[C@H]2C[NH2+]C[C@H]21 ZINC001246643815 988354781 /nfs/dbraw/zinc/35/47/81/988354781.db2.gz DJBDXGRZCKIJRS-ZOBORPQBSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1CC[C@@H]([N@@H+]2CC[C@@H]3[NH2+]CC[C@H]32)C[C@H]1C ZINC001246647145 988364219 /nfs/dbraw/zinc/36/42/19/988364219.db2.gz ZEYVORMFGNMNBC-XGFWRYKXSA-N 2 0 222.376 2.247 20 0 BEADRP CC[C@@H](CC(C)C)[N@@H+]1C[C@@H]2CC[NH2+][C@@H]2C1 ZINC001246649151 988373588 /nfs/dbraw/zinc/37/35/88/988373588.db2.gz ALOGTNNSRSGCFN-RWMBFGLXSA-N 2 0 210.365 2.105 20 0 BEADRP CC[C@@H](C)C[C@@H](CC)[N@@H+]1C[C@@H]2CC[NH2+][C@@H]2C1 ZINC001246653444 988375036 /nfs/dbraw/zinc/37/50/36/988375036.db2.gz SZABWMCKKATUHC-XJFOESAGSA-N 2 0 224.392 2.495 20 0 BEADRP CC1(C)CCC[C@@H]([N@@H+]2C[C@@H]3CC[NH2+][C@@H]3C2)C1 ZINC001246654682 988377850 /nfs/dbraw/zinc/37/78/50/988377850.db2.gz WPEDCILGFNLRPK-YNEHKIRRSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@@H]1CC[C@H]([N@@H+]2CC[C@@H]3CCC[C@H]3C2)C[NH2+]1 ZINC001246655753 988385409 /nfs/dbraw/zinc/38/54/09/988385409.db2.gz KPWDWZPXUFMISZ-RFGFWPKPSA-N 2 0 222.376 2.249 20 0 BEADRP CC[C@H]1CC[C@H]([N@@H+]2C[C@H]3CCC[NH2+][C@H]3C2)C1 ZINC001246662293 988398052 /nfs/dbraw/zinc/39/80/52/988398052.db2.gz ZJCUOSUOCJVSCZ-CRWXNKLISA-N 2 0 222.376 2.249 20 0 BEADRP CC1(C)CC[C@H]([N@@H+]2C[C@H]3CCC[C@@]3([NH3+])C2)C1 ZINC001246662564 988400687 /nfs/dbraw/zinc/40/06/87/988400687.db2.gz IHPBRGJPUSIKKM-MBNYWOFBSA-N 2 0 222.376 2.378 20 0 BEADRP CCc1ccc(C[C@H](C)[N@H+]2C[C@@H]3[C@H]([NH3+])[C@@H]3C2)cc1 ZINC001246667058 988411460 /nfs/dbraw/zinc/41/14/60/988411460.db2.gz XPUHYORMDQDULT-KSYCFECVSA-N 2 0 244.382 2.069 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2C[C@@H]3C[NH2+]CC[C@@H]32)CC(C)(C)C1 ZINC001246672750 988414598 /nfs/dbraw/zinc/41/45/98/988414598.db2.gz LGJIRXWEVMKIAM-RFGFWPKPSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2C[C@@H]3C[NH2+]CC[C@H]32)CC(C)(C)C1 ZINC001246672753 988415289 /nfs/dbraw/zinc/41/52/89/988415289.db2.gz LGJIRXWEVMKIAM-ZOBORPQBSA-N 2 0 236.403 2.495 20 0 BEADRP CCc1cc(NC[C@@H]2CCC[N@@H+](CC)C2)cc[nH+]1 ZINC001118579328 988461982 /nfs/dbraw/zinc/46/19/82/988461982.db2.gz DTKDJSRWFKLBQB-ZDUSSCGKSA-N 2 0 247.386 2.210 20 0 BEADRP FC(F)[C@H]1CCC[N@@H+](C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC001246805219 988483327 /nfs/dbraw/zinc/48/33/27/988483327.db2.gz CGAMJUBQZXBNHO-WSMDXJOWSA-N 2 0 244.329 2.247 20 0 BEADRP C[C@@H]1C[C@@H]([N@@H+]2CCC[C@@H](C(F)F)C2)CC[NH2+]1 ZINC001246810670 988491909 /nfs/dbraw/zinc/49/19/09/988491909.db2.gz YOMQIUPEFALBEJ-MXWKQRLJSA-N 2 0 232.318 2.104 20 0 BEADRP CCCCC[C@@H](CCC)[N@@H+]1CCO[C@@H](C[NH3+])C1 ZINC001246823405 988512735 /nfs/dbraw/zinc/51/27/35/988512735.db2.gz GFSMVEDUALUGSB-KGLIPLIRSA-N 2 0 242.407 2.395 20 0 BEADRP CC(C)CC[C@H](C)[N@@H+]1C[C@@H]2CC[NH2+]C[C@H]2C1 ZINC001246842683 988546589 /nfs/dbraw/zinc/54/65/89/988546589.db2.gz DAGDJKVRDDUYOU-IHRRRGAJSA-N 2 0 224.392 2.352 20 0 BEADRP CC1(C)CCC([N@@H+]2C[C@@H]3CC[C@@]3([NH3+])C2)CC1 ZINC001246859858 988593145 /nfs/dbraw/zinc/59/31/45/988593145.db2.gz KWMLIRXMHSHVCQ-SMDDNHRTSA-N 2 0 222.376 2.378 20 0 BEADRP CC(C)CC[C@H](C)[N@@H+]1C[C@@H]2CC[C@]2([NH3+])C1 ZINC001246862120 988597603 /nfs/dbraw/zinc/59/76/03/988597603.db2.gz QBMRWEPKEWYPEA-AVGNSLFASA-N 2 0 210.365 2.234 20 0 BEADRP CCC[C@@H](CC)[N@@H+]1C[C@H]2CC[C@@H](C1)[NH2+]C2 ZINC001246862807 988608792 /nfs/dbraw/zinc/60/87/92/988608792.db2.gz DRGCVQCDCYOLRA-RWMBFGLXSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@H]1CC([N@@H+]2C[C@H]3CC[C@@H](C2)[NH2+]C3)C[C@H](C)C1 ZINC001246867369 988623234 /nfs/dbraw/zinc/62/32/34/988623234.db2.gz OEVQJGQZKMAOAK-MQYQWHSLSA-N 2 0 236.403 2.495 20 0 BEADRP CC[C@H]1CC[C@@H]([N@@H+]2C[C@H]3CC[C@@H](C2)[NH2+]C3)C1 ZINC001246869916 988626883 /nfs/dbraw/zinc/62/68/83/988626883.db2.gz XKPSIEJAOZTTIT-XDQVBPFNSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@H]1CCC[C@@H]([N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)C1 ZINC001246928725 988749752 /nfs/dbraw/zinc/74/97/52/988749752.db2.gz BTMCBCPGVNNINB-BYNSBNAKSA-N 2 0 236.403 2.497 20 0 BEADRP CC1CCC([N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)CC1 ZINC001246929241 988752023 /nfs/dbraw/zinc/75/20/23/988752023.db2.gz DJOUSTSXQFAINA-HFDVOGEKSA-N 2 0 236.403 2.497 20 0 BEADRP C[N@H+]([C@@H]1[C@H]2C[NH2+]C[C@H]21)C1CCCCCCC1 ZINC001246939039 988765829 /nfs/dbraw/zinc/76/58/29/988765829.db2.gz ACUABZDPSTTYAG-WDNDVIMCSA-N 2 0 222.376 2.249 20 0 BEADRP CCSC[C@H](C)[N@H+]1C[C@@H]2CC[NH2+]CC[C@@H]2C1 ZINC001246939696 988771318 /nfs/dbraw/zinc/77/13/18/988771318.db2.gz GVLAVKIRLCSWFQ-RWMBFGLXSA-N 2 0 242.432 2.059 20 0 BEADRP Cc1cccnc1C[NH2+]CC[C@H]1CCC[N@@H+](C)C1 ZINC001324757230 988973045 /nfs/dbraw/zinc/97/30/45/988973045.db2.gz JEWXVMJXCSMZBU-CQSZACIVSA-N 2 0 247.386 2.212 20 0 BEADRP CCc1ccc(C[NH2+]CC[C@@H](C)[NH2+]C)s1 ZINC001325321331 989158203 /nfs/dbraw/zinc/15/82/03/989158203.db2.gz VCPVAQNDHVJDRX-SNVBAGLBSA-N 2 0 226.389 2.398 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@H](C)c1cccc(OC)c1 ZINC001325742689 989246641 /nfs/dbraw/zinc/24/66/41/989246641.db2.gz GKLUOIIULGTJPC-NWDGAFQWSA-N 2 0 236.359 2.344 20 0 BEADRP CC[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)C2(Cl)CC2)C1 ZINC001119623185 989254450 /nfs/dbraw/zinc/25/44/50/989254450.db2.gz FWZKVHVFIQLMFM-NEPJUHHUSA-N 2 0 244.810 2.468 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+][C@H](C1CC1)C1CCC1 ZINC001325755720 989254454 /nfs/dbraw/zinc/25/44/54/989254454.db2.gz GONUSIWMBVRYEF-GWCFXTLKSA-N 2 0 210.365 2.153 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]C/C=C\C1CC1 ZINC001326036391 989335801 /nfs/dbraw/zinc/33/58/01/989335801.db2.gz QKTGMJYVULWBSQ-BYCRGOAPSA-N 2 0 245.370 2.466 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H]1CC[C@H]1C(C)(C)C ZINC001326474134 989567719 /nfs/dbraw/zinc/56/77/19/989567719.db2.gz SNLBDURIBAEZCH-IJLUTSLNSA-N 2 0 212.381 2.399 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]C1[C@@H](C)CCC[C@@H]1C ZINC001326472533 989574587 /nfs/dbraw/zinc/57/45/87/989574587.db2.gz AJYDABSZHPZNDT-SDDRHHMPSA-N 2 0 212.381 2.399 20 0 BEADRP FC(F)(F)CCC[NH2+][C@H]1CCn2ccnc2C1 ZINC001120039857 989575070 /nfs/dbraw/zinc/57/50/70/989575070.db2.gz MKJUZPUPAPECCB-VIFPVBQESA-N 2 0 247.264 2.130 20 0 BEADRP CC(C)[NH+]1CCC(N(C)c2cc[nH+]cc2)CC1 ZINC001120860910 989931383 /nfs/dbraw/zinc/93/13/83/989931383.db2.gz XGJBTQPUOUAPOT-UHFFFAOYSA-N 2 0 233.359 2.391 20 0 BEADRP [NH3+]Cc1cc(-c2cccc(C[NH3+])c2)cs1 ZINC001123364540 990561991 /nfs/dbraw/zinc/56/19/91/990561991.db2.gz LXYDGQSDACZBOR-UHFFFAOYSA-N 2 0 218.325 2.333 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CCSCC[NH3+])C[C@@H](C)C1 ZINC001258157112 991043286 /nfs/dbraw/zinc/04/32/86/991043286.db2.gz ZNDATSREOMRAKY-GDNZZTSVSA-N 2 0 230.421 2.093 20 0 BEADRP C[C@@H](Cc1ccco1)[NH2+]C(C)(C)C(C)(C)[NH3+] ZINC001258181031 991081852 /nfs/dbraw/zinc/08/18/52/991081852.db2.gz HPZLZGUOYZZILU-JTQLQIEISA-N 2 0 224.348 2.316 20 0 BEADRP CCCCN(C)CC[NH2+][C@@H](C)CCSC ZINC001258199300 991115845 /nfs/dbraw/zinc/11/58/45/991115845.db2.gz FCNZUWLZGMCWMV-LBPRGKRZSA-N 2 0 232.437 2.450 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@H](C)CCSC)CC1 ZINC001258202574 991119458 /nfs/dbraw/zinc/11/94/58/991119458.db2.gz ORCVMSMQKLVUPV-GFCCVEGCSA-N 2 0 244.448 2.450 20 0 BEADRP CSCC[C@@H](C)[N@@H+]1C[C@H]2CC[NH+](C)C[C@H]2C1 ZINC001258215378 991134841 /nfs/dbraw/zinc/13/48/41/991134841.db2.gz BFMROGRSDWLZNO-UPJWGTAASA-N 2 0 242.432 2.012 20 0 BEADRP CSCC[C@H](C)[N@@H+]1C[C@H]2CC[NH+](C)C[C@H]2C1 ZINC001258215379 991138214 /nfs/dbraw/zinc/13/82/14/991138214.db2.gz BFMROGRSDWLZNO-XQQFMLRXSA-N 2 0 242.432 2.012 20 0 BEADRP CSCC[C@H](C)[NH+]1CCC(C[NH+](C)C)CC1 ZINC001258219984 991143670 /nfs/dbraw/zinc/14/36/70/991143670.db2.gz NFMPVOWEPXEXLU-LBPRGKRZSA-N 2 0 244.448 2.402 20 0 BEADRP CSC(C)(C)C[C@H](C)[NH2+]C[C@@H](C)C[NH3+] ZINC001258333931 991259799 /nfs/dbraw/zinc/25/97/99/991259799.db2.gz QISIDTPLZGASIB-UWVGGRQHSA-N 2 0 218.410 2.091 20 0 BEADRP C1[C@H]2CCC[C@H]([NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)[C@@H]12 ZINC001560500815 991486776 /nfs/dbraw/zinc/48/67/76/991486776.db2.gz DNFJOCUWIWKGKC-ZSAUSMIDSA-N 2 0 234.387 2.391 20 0 BEADRP CCC[C@H](Cc1ccccc1)[N@@H+]1CC[C@H](N)C1 ZINC001258648999 991583820 /nfs/dbraw/zinc/58/38/20/991583820.db2.gz ATTBYRYHCAQSLZ-LSDHHAIUSA-N 2 0 232.371 2.431 20 0 BEADRP CCC(CC)[NH2+]C[C@H]1C[NH+]2CCC1CC2 ZINC001561034404 991693026 /nfs/dbraw/zinc/69/30/26/991693026.db2.gz PCFLGIHZBLVVMP-LBPRGKRZSA-N 2 0 210.365 2.106 20 0 BEADRP CCC[NH+]1CCC([NH2+]C[C@H]2CC(C)(C)O2)CC1 ZINC001258766540 991722915 /nfs/dbraw/zinc/72/29/15/991722915.db2.gz XRQGFOAXSLNADF-CYBMUJFWSA-N 2 0 240.391 2.018 20 0 BEADRP CCC[NH+]1CCC([N@@H+]2CCC3(CC3)C2)CC1 ZINC001258772295 991740316 /nfs/dbraw/zinc/74/03/16/991740316.db2.gz MMTIXCCPSAISIA-UHFFFAOYSA-N 2 0 222.376 2.347 20 0 BEADRP CC[C@H](C)C[C@H](CC)NC(=[NH2+])SCC[NH3+] ZINC001258780577 991748673 /nfs/dbraw/zinc/74/86/73/991748673.db2.gz PIIKMBUUPZHGSC-UWVGGRQHSA-N 2 0 231.409 2.417 20 0 BEADRP C[NH+](C)[C@H](CNc1cc[nH+]cc1)c1ccccc1 ZINC001318998032 991762861 /nfs/dbraw/zinc/76/28/61/991762861.db2.gz XBSGBVOVNDCDTP-OAHLLOKOSA-N 2 0 241.338 2.218 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]C1(CC)COC1 ZINC001258899022 991890761 /nfs/dbraw/zinc/89/07/61/991890761.db2.gz BBJPNFIFNCMYPP-CYBMUJFWSA-N 2 0 242.407 2.266 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H](CO)C(C)C ZINC001258896265 991891024 /nfs/dbraw/zinc/89/10/24/991891024.db2.gz JTWXWDCIRXWHBX-KGLIPLIRSA-N 2 0 244.423 2.103 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]CC1CSC1 ZINC001258899898 991892463 /nfs/dbraw/zinc/89/24/63/991892463.db2.gz VYAAPSLDUIENKD-GFCCVEGCSA-N 2 0 244.448 2.450 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1ccno1 ZINC001258897987 991892518 /nfs/dbraw/zinc/89/25/18/991892518.db2.gz QPIWNLNVOPTEOH-GFCCVEGCSA-N 2 0 239.363 2.275 20 0 BEADRP CCC(=O)C[NH2+][C@H](C)CCC[NH+](CC)CC ZINC001258902101 991896219 /nfs/dbraw/zinc/89/62/19/991896219.db2.gz ANARZPLNBDZVKT-GFCCVEGCSA-N 2 0 228.380 2.066 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]C/C=C/c1ccccc1 ZINC001261370262 992277619 /nfs/dbraw/zinc/27/76/19/992277619.db2.gz CWONDIGYJZRLHL-YSKGHYERSA-N 2 0 218.344 2.287 20 0 BEADRP C[NH2+][C@@H](C)CC[NH2+]C/C=C/c1ccccc1 ZINC001261370260 992278394 /nfs/dbraw/zinc/27/83/94/992278394.db2.gz CWONDIGYJZRLHL-PPGNKHEKSA-N 2 0 218.344 2.287 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+]Cc1sccc1C ZINC001261370821 992280890 /nfs/dbraw/zinc/28/08/90/992280890.db2.gz VTCVUFZHQDWFTE-SNVBAGLBSA-N 2 0 212.362 2.144 20 0 BEADRP C[NH2+][C@H](C)CC[NH2+][C@@H]1C[C@H](C)CC[C@@H]1C ZINC001261424083 992291654 /nfs/dbraw/zinc/29/16/54/992291654.db2.gz MQRDXSFRECWTRA-YVECIDJPSA-N 2 0 212.381 2.399 20 0 BEADRP CSCC[C@@H](C)[NH2+]C1CCC(C[NH3+])CC1 ZINC001261423400 992295068 /nfs/dbraw/zinc/29/50/68/992295068.db2.gz VBYCRFZZMKVABQ-VOMCLLRMSA-N 2 0 230.421 2.235 20 0 BEADRP CSCC[C@H](C)[NH2+]C1CCC(C[NH3+])CC1 ZINC001261423399 992297471 /nfs/dbraw/zinc/29/74/71/992297471.db2.gz VBYCRFZZMKVABQ-UNXYVOJBSA-N 2 0 230.421 2.235 20 0 BEADRP [NH3+]CC1CCC([NH2+]CC[C@@H]2CCSC2)CC1 ZINC001261903639 992567402 /nfs/dbraw/zinc/56/74/02/992567402.db2.gz GELBLBMHGQWOFJ-OTTFEQOBSA-N 2 0 242.432 2.237 20 0 BEADRP CC1=CCC[C@H](C)[C@@H]1C[NH2+][C@@]1(C)CC[NH2+]C1 ZINC001573624542 992655202 /nfs/dbraw/zinc/65/52/02/992655202.db2.gz DFANJODFGQYOCM-MJBXVCDLSA-N 2 0 222.376 2.320 20 0 BEADRP C1=CC[C@H](C[NH2+][C@]23CCC[C@H]2[NH2+]CC3)CC1 ZINC001574774995 992903179 /nfs/dbraw/zinc/90/31/79/992903179.db2.gz STKHQEWNZKWAED-MJBXVCDLSA-N 2 0 220.360 2.217 20 0 BEADRP C1[C@H]([NH2+]C2CC3(C2)CCCC3)C12CC[NH2+]CC2 ZINC001574798997 992910942 /nfs/dbraw/zinc/91/09/42/992910942.db2.gz BVFCHXWXECGCOT-ZDUSSCGKSA-N 2 0 234.387 2.441 20 0 BEADRP C/C(=C/c1ccccc1)C[NH2+][C@H]1C[C@H]([NH3+])C1 ZINC001574979948 992958464 /nfs/dbraw/zinc/95/84/64/992958464.db2.gz NWARLLRFQNZURW-WJPHOXBBSA-N 2 0 216.328 2.169 20 0 BEADRP CCC(CC)[C@@H](CNc1cc[nH+]cc1)[NH+](C)C ZINC001262672663 993014916 /nfs/dbraw/zinc/01/49/16/993014916.db2.gz HTVZOLJLJRCTNL-CQSZACIVSA-N 2 0 235.375 2.282 20 0 BEADRP CC(C)(C[NH2+][C@H]1C[C@H]([NH3+])C1(C)C)C1CC1 ZINC001575334959 993015659 /nfs/dbraw/zinc/01/56/59/993015659.db2.gz WLJALPAQBGFRQQ-QWRGUYRKSA-N 2 0 210.365 2.138 20 0 BEADRP CCC(CC)[C@H](CNc1cc[nH+]cc1)[NH+](C)C ZINC001262672662 993016054 /nfs/dbraw/zinc/01/60/54/993016054.db2.gz HTVZOLJLJRCTNL-AWEZNQCLSA-N 2 0 235.375 2.282 20 0 BEADRP CC(C)([NH3+])C[NH2+][C@@H]1CC[C@H]2CCC[C@H]2C1 ZINC001575357674 993025223 /nfs/dbraw/zinc/02/52/23/993025223.db2.gz DTVBBEXJTBGQPG-GRYCIOLGSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)[C@@H](C[NH3+])C[N@@H+]1CC[C@@H](C2CCC2)C1 ZINC001575423816 993042215 /nfs/dbraw/zinc/04/22/15/993042215.db2.gz YPBYGDFYDFQJPZ-KGLIPLIRSA-N 2 0 224.392 2.339 20 0 BEADRP CC(C)[C@H]1CCC[C@@H]1[NH2+][C@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC001575497225 993055500 /nfs/dbraw/zinc/05/55/00/993055500.db2.gz CWNZDDBPJWBSJM-DGTMBMJNSA-N 2 0 222.376 2.294 20 0 BEADRP CC(C)[C@H]1CCC[C@H]1[NH2+][C@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC001575497227 993057357 /nfs/dbraw/zinc/05/73/57/993057357.db2.gz CWNZDDBPJWBSJM-POQQGIQPSA-N 2 0 222.376 2.294 20 0 BEADRP CC(C)C[C@@H]1C[C@H]1[NH2+][C@H]1C[C@@H]([NH3+])C1(C)C ZINC001575633494 993088148 /nfs/dbraw/zinc/08/81/48/993088148.db2.gz BMHFOVHSGNRHMO-KKOKHZNYSA-N 2 0 210.365 2.136 20 0 BEADRP C[C@H](CCc1ccccc1)C[NH2+]CC1C[NH2+]C1 ZINC001575965593 993143838 /nfs/dbraw/zinc/14/38/38/993143838.db2.gz AGIUXFGRXKIFFV-CYBMUJFWSA-N 2 0 232.371 2.064 20 0 BEADRP CC1(C)[C@H]([NH3+])C[C@H]1[NH2+]CC12CCC(CC1)C2 ZINC001576381710 993292965 /nfs/dbraw/zinc/29/29/65/993292965.db2.gz DUXBGGQWKYGNAQ-CBKZZEEASA-N 2 0 222.376 2.282 20 0 BEADRP CC1(C)CCC[C@@H](C[NH+]2CC3(C2)CC[NH2+]C3)C1 ZINC001576426469 993303358 /nfs/dbraw/zinc/30/33/58/993303358.db2.gz IOKKTYXEVTZJSW-CYBMUJFWSA-N 2 0 236.403 2.498 20 0 BEADRP C[C@]1(C[N@@H+]2CCCCC[C@H]([NH3+])C2)CCCCO1 ZINC001576502661 993323647 /nfs/dbraw/zinc/32/36/47/993323647.db2.gz DVHZOBNXMMAFGJ-UONOGXRCSA-N 2 0 240.391 2.149 20 0 BEADRP CC1=CCC[C@@H](C)[C@H]1C[NH2+][C@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC001576554810 993341521 /nfs/dbraw/zinc/34/15/21/993341521.db2.gz BLYVWGSECFLRPT-MRLBHPIUSA-N 2 0 234.387 2.461 20 0 BEADRP C[C@@H]1C[C@@H](C[NH2+]CC[C@H]2CCCS2)CC[NH2+]1 ZINC001576596919 993360410 /nfs/dbraw/zinc/36/04/10/993360410.db2.gz CASDAQZDUZWSBU-FRRDWIJNSA-N 2 0 242.432 2.250 20 0 BEADRP C[C@@H]1CC[C@@H](C)[C@@H]([NH2+][C@H]2C[C@H]3CC[C@@H]2[NH2+]3)C1 ZINC001576648385 993385030 /nfs/dbraw/zinc/38/50/30/993385030.db2.gz YLNXSWLIRCAFNO-TVQXOTEMSA-N 2 0 222.376 2.294 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@H]2C[C@H](C[NH3+])C2)CC1 ZINC001576680550 993391548 /nfs/dbraw/zinc/39/15/48/993391548.db2.gz OYXLVMOIDZZAOZ-FVCCEPFGSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]CCC2C[NH2+]C2)[C@H]1C ZINC001576679986 993391657 /nfs/dbraw/zinc/39/16/57/993391657.db2.gz HCVUNTLONSEQTO-MDZLAQPJSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@H]2CC[C@@H]([NH3+])C2)C[C@H]1C ZINC001576732438 993407791 /nfs/dbraw/zinc/40/77/91/993407791.db2.gz UHEVJINALQQPCX-FVCCEPFGSA-N 2 0 210.365 2.092 20 0 BEADRP C[C@@H]1C[C@@H]([N@H+]2C[C@@H]3CCCC[C@@H]3C2)CC[NH2+]1 ZINC000381877408 993430017 /nfs/dbraw/zinc/43/00/17/993430017.db2.gz NMNXCDDLJRNACS-MQYQWHSLSA-N 2 0 222.376 2.249 20 0 BEADRP CC[C@H](C)[C@@H](C)[NH2+]C[C@@H]1CCC[NH2+]CC1 ZINC001576962893 993471302 /nfs/dbraw/zinc/47/13/02/993471302.db2.gz WJPAVHVECSBRON-YNEHKIRRSA-N 2 0 212.381 2.400 20 0 BEADRP [NH3+]C[C@H]1CCCC[N@H+](Cc2ccccc2F)C1 ZINC000383487759 993494920 /nfs/dbraw/zinc/49/49/20/993494920.db2.gz AFSHDGWDCGAHTJ-GFCCVEGCSA-N 2 0 236.334 2.387 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+]C1CC(c2cccc(F)c2)C1 ZINC001577124500 993509873 /nfs/dbraw/zinc/50/98/73/993509873.db2.gz DYTBNMYZOBISCL-HRDQMINSSA-N 2 0 236.334 2.399 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+]CC1C2CC3CC(C2)CC1C3 ZINC001577124433 993512023 /nfs/dbraw/zinc/51/20/23/993512023.db2.gz ANHGYWJOJPQEDY-DUTNFGBUSA-N 2 0 236.403 2.386 20 0 BEADRP [NH3+]CCCC[N@@H+]1CC[C@@H](OCc2ccccc2)C1 ZINC000383986457 993531229 /nfs/dbraw/zinc/53/12/29/993531229.db2.gz AUYLDGSUBBHUGY-OAHLLOKOSA-N 2 0 248.370 2.016 20 0 BEADRP CC[C@@H]([NH2+]CCCCCC[NH3+])[C@@H]1CCCO1 ZINC001577175601 993532601 /nfs/dbraw/zinc/53/26/01/993532601.db2.gz CJRKYLMJBBOASF-OLZOCXBDSA-N 2 0 228.380 2.053 20 0 BEADRP CC[C@H]([NH2+]CCCCCC[NH3+])[C@@H]1CCCO1 ZINC001577175603 993533661 /nfs/dbraw/zinc/53/36/61/993533661.db2.gz CJRKYLMJBBOASF-STQMWFEESA-N 2 0 228.380 2.053 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@H]2CCC[NH2+][C@H]2C)C1 ZINC000384206573 993557684 /nfs/dbraw/zinc/55/76/84/993557684.db2.gz BUJKILLMWRIDJM-XQHKEYJVSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@H]1CCCC[C@@H]1C[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001577255363 993563891 /nfs/dbraw/zinc/56/38/91/993563891.db2.gz UXCOCAYRDVZLML-MEBFFEOJSA-N 2 0 222.376 2.010 20 0 BEADRP CC[C@@H]1CC[N@H+](CCC2CC[NH2+]CC2)[C@@H]1C ZINC001577263387 993567108 /nfs/dbraw/zinc/56/71/08/993567108.db2.gz RMWFVMXRIMBMTH-TZMCWYRMSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H](CC(F)(F)F)[NH2+]C[C@H]1CCC[NH2+][C@H]1C ZINC000384344979 993572632 /nfs/dbraw/zinc/57/26/32/993572632.db2.gz CZOINTIMUAOCMU-KXUCPTDWSA-N 2 0 238.297 2.305 20 0 BEADRP C[C@H](CC(F)(F)F)[NH2+]C[C@@H]1CCC[NH2+][C@H]1C ZINC000384344981 993577384 /nfs/dbraw/zinc/57/73/84/993577384.db2.gz CZOINTIMUAOCMU-UTLUCORTSA-N 2 0 238.297 2.305 20 0 BEADRP CCC[C@@H](C)[NH+]1CCC([C@H]2CC[NH2+]C2)CC1 ZINC001577345401 993584539 /nfs/dbraw/zinc/58/45/39/993584539.db2.gz QPXSRMHKEFBERV-OCCSQVGLSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1cccc(C)c1C[N@H+]1CC[NH2+]C[C@@H](C)C1 ZINC000385292878 993656256 /nfs/dbraw/zinc/65/62/56/993656256.db2.gz GQCBIOTWDFJIKK-GFCCVEGCSA-N 2 0 232.371 2.345 20 0 BEADRP N#Cc1ccc(C[N@H+]2CCCC[C@H](C[NH3+])C2)cc1 ZINC000386338141 993684752 /nfs/dbraw/zinc/68/47/52/993684752.db2.gz LDDNTCPFYKSRAP-OAHLLOKOSA-N 2 0 243.354 2.119 20 0 BEADRP [NH3+]C[C@@H]1CCCC[N@H+](CCCC(F)(F)F)C1 ZINC000390495847 993790670 /nfs/dbraw/zinc/79/06/70/993790670.db2.gz RFFXGKREZDHTBX-JTQLQIEISA-N 2 0 238.297 2.390 20 0 BEADRP C[N@H+]1CC=C(C[NH2+]CCCC(F)(F)F)CC1 ZINC000392889128 993888399 /nfs/dbraw/zinc/88/83/99/993888399.db2.gz MRMRATSTLWCLLA-UHFFFAOYSA-N 2 0 236.281 2.180 20 0 BEADRP CC1CCC([NH+]2CCC(C)([NH3+])CC2)CC1 ZINC000393758274 994002757 /nfs/dbraw/zinc/00/27/57/994002757.db2.gz JIHDQMKEYCUXMY-UHFFFAOYSA-N 2 0 210.365 2.378 20 0 BEADRP C[N@H+]1C[C@H]2CC[C@@H](C1)C2[NH2+][C@@H]1CCC[C@H](F)C1 ZINC001332897842 994391280 /nfs/dbraw/zinc/39/12/80/994391280.db2.gz LPYNKALKDMUNLU-IZXDZPFWSA-N 2 0 240.366 2.197 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CC2(C)CCCC2)CC[NH2+]1 ZINC000821987773 994418033 /nfs/dbraw/zinc/41/80/33/994418033.db2.gz GOPKLBLPXNWZQL-RYUDHWBXSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CCC[N@@H+]1C)C1(C)CC1 ZINC000822125231 994418962 /nfs/dbraw/zinc/41/89/62/994418962.db2.gz RYOJCQFGHWWNOL-VXGBXAGGSA-N 2 0 210.365 2.249 20 0 BEADRP CC(C)C[C@@H](C)[N@@H+]1C[C@H]2CC[NH+](C)C[C@H]2C1 ZINC001620483117 1170673956 /nfs/dbraw/zinc/67/39/56/1170673956.db2.gz DYCKRVVAAYYIBG-MCIONIFRSA-N 2 0 224.392 2.305 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@@H]([NH2+]C3CCCCC3)[C@H]2C1 ZINC001621107914 1170715526 /nfs/dbraw/zinc/71/55/26/1170715526.db2.gz CQWDGDSIFGGARO-FPMFFAJLSA-N 2 0 222.376 2.249 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@H]([NH2+]C3CCCCC3)[C@H]2C1 ZINC001621107916 1170717850 /nfs/dbraw/zinc/71/78/50/1170717850.db2.gz CQWDGDSIFGGARO-UBHSHLNASA-N 2 0 222.376 2.249 20 0 BEADRP C[NH+]1CCC(C)(C[NH2+][C@@H]2C[C@@H]3CCC[C@H]23)CC1 ZINC001621194469 1170734397 /nfs/dbraw/zinc/73/43/97/1170734397.db2.gz UTLCEOHUJZKOCL-MELADBBJSA-N 2 0 236.403 2.497 20 0 BEADRP C[N@@H+]1C[C@@H]2CC[C@H]([NH2+][C@@H]3CCC34CCC4)[C@H]2C1 ZINC001621570236 1170855563 /nfs/dbraw/zinc/85/55/63/1170855563.db2.gz NZOXIQQEMNPGEH-XDQVBPFNSA-N 2 0 234.387 2.249 20 0 BEADRP C([C@@H]1CCC[NH2+]1)[N@@H+]1CCC[C@H]2CCCC[C@H]21 ZINC000036827222 1170919348 /nfs/dbraw/zinc/91/93/48/1170919348.db2.gz RYYKXPYZNYPFLF-HZSPNIEDSA-N 2 0 222.376 2.393 20 0 BEADRP C[C@H]1CCCC[N@@H+]1CCCNc1cc(N)cc[nH+]1 ZINC000043568350 1171302753 /nfs/dbraw/zinc/30/27/53/1171302753.db2.gz UKHPBYVEVIOMNA-LBPRGKRZSA-N 2 0 248.374 2.340 20 0 BEADRP C[NH2+]CCC[NH+]1CCC(C(C)(C)C)CC1 ZINC000050347833 1171796727 /nfs/dbraw/zinc/79/67/27/1171796727.db2.gz BJXPFTRITGHYOS-UHFFFAOYSA-N 2 0 212.381 2.354 20 0 BEADRP C1=C(CC[NH+]2C[C@H]3C[NH2+]C[C@@H]3C2)CCCC1 ZINC000385161156 398137565 /nfs/dbraw/zinc/13/75/65/398137565.db2.gz LGXHNRLEPRCWSA-ZIAGYGMSSA-N 2 0 220.360 2.028 20 0 BEADRP CCCC[NH+]1CCC([NH2+][C@@H](CC)COC)CC1 ZINC000079712270 136210415 /nfs/dbraw/zinc/21/04/15/136210415.db2.gz DBBGUFDIWZLABK-ZDUSSCGKSA-N 2 0 242.407 2.266 20 0 BEADRP CO[C@H](C[N@@H+]1C[C@H](C[NH3+])C[C@@H]1C)c1ccccc1 ZINC000379241320 398141455 /nfs/dbraw/zinc/14/14/55/398141455.db2.gz WZKTUCDRJVNGKP-KCQAQPDRSA-N 2 0 248.370 2.043 20 0 BEADRP C(C[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)CC1CC1 ZINC000161703218 538917272 /nfs/dbraw/zinc/91/72/72/538917272.db2.gz PFODZOTXPQGLFC-KGLIPLIRSA-N 2 0 222.376 2.393 20 0 BEADRP Cc1cc(C[N@H+]2CC[C@@H]([C@@H](C)[NH3+])C2)ccc1F ZINC000126909424 178000722 /nfs/dbraw/zinc/00/07/22/178000722.db2.gz HIWVPSGJCIQHNE-DGCLKSJQSA-N 2 0 236.334 2.303 20 0 BEADRP Cc1cc(C[N@H+]2C[C@@H](C[NH3+])C[C@H]2C)ccc1F ZINC000228060235 178004908 /nfs/dbraw/zinc/00/49/08/178004908.db2.gz VVVJAAIQBYLOBH-DGCLKSJQSA-N 2 0 236.334 2.303 20 0 BEADRP CCOCCC1(C[NH2+][C@H](C)C[C@H](C)[NH3+])CCC1 ZINC000422942829 398159336 /nfs/dbraw/zinc/15/93/36/398159336.db2.gz QGJMBVDQQYPFRB-QWHCGFSZSA-N 2 0 242.407 2.299 20 0 BEADRP Cc1cc(C[NH2+]C[C@@H](C)C[NH+](C)C)ccc1F ZINC000291704644 178021960 /nfs/dbraw/zinc/02/19/60/178021960.db2.gz KNAHRHKZZDOKPJ-LLVKDONJSA-N 2 0 238.350 2.421 20 0 BEADRP COC1CCC([NH2+]C[C@H]2CCC[C@H]([NH3+])C2)CC1 ZINC000415012466 398153842 /nfs/dbraw/zinc/15/38/42/398153842.db2.gz XHMRDXLEWDZWAX-FEPKRQSRSA-N 2 0 240.391 2.051 20 0 BEADRP CC[C@H]([NH2+][C@@H](C)C[C@@H]1CCCO1)[C@@H]1CCC[NH2+]1 ZINC000422906995 398157109 /nfs/dbraw/zinc/15/71/09/398157109.db2.gz WCLMIDOJRUFDLB-XUXIUFHCSA-N 2 0 240.391 2.064 20 0 BEADRP Cc1cc(C[NH2+]CCCC[NH+](C)C)cs1 ZINC000294722074 178020610 /nfs/dbraw/zinc/02/06/10/178020610.db2.gz BWGHCRVHMHDQDI-UHFFFAOYSA-N 2 0 226.389 2.488 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]C[C@@H]1CC=CCC1 ZINC000422976842 398161182 /nfs/dbraw/zinc/16/11/82/398161182.db2.gz VQBKKHYNAZVXCW-MGPQQGTHSA-N 2 0 222.376 2.320 20 0 BEADRP COCCC[NH2+][C@H]1CCN[C@@H](c2ccccc2)C1 ZINC000415097784 398161331 /nfs/dbraw/zinc/16/13/31/398161331.db2.gz DLOKLWPKJAGIJT-LSDHHAIUSA-N 2 0 248.370 2.106 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CC(C)(C)c1cccnc1 ZINC000423174140 398163980 /nfs/dbraw/zinc/16/39/80/398163980.db2.gz BJMDFBSDABUQEY-CYBMUJFWSA-N 2 0 249.402 2.466 20 0 BEADRP Cc1cc(Cl)ccc1CN(C)CC[NH3+] ZINC000234278335 178067070 /nfs/dbraw/zinc/06/70/70/178067070.db2.gz RSUGYGYEEWUQKJ-UHFFFAOYSA-N 2 0 212.724 2.039 20 0 BEADRP Cc1cc(Cl)ccc1CN1C[C@@H](C)[C@@H]([NH3+])C1 ZINC000235357421 178067206 /nfs/dbraw/zinc/06/72/06/178067206.db2.gz XBGPOQWFJDSJPL-MFKMUULPSA-N 2 0 238.762 2.427 20 0 BEADRP Cc1cc(F)ccc1C[N@H+]1CC[C@@H]([C@@H](C)[NH3+])C1 ZINC000126928443 178086153 /nfs/dbraw/zinc/08/61/53/178086153.db2.gz PIQNNGBSKFCRMP-DGCLKSJQSA-N 2 0 236.334 2.303 20 0 BEADRP Cc1cc(F)ccc1C[NH2+]C[C@H](C)C[NH+](C)C ZINC000291686094 178087340 /nfs/dbraw/zinc/08/73/40/178087340.db2.gz IIROVARTLONXAE-NSHDSACASA-N 2 0 238.350 2.421 20 0 BEADRP Cc1cc(F)ccc1C[NH2+]C[C@@H](C)C[NH+](C)C ZINC000291686092 178087481 /nfs/dbraw/zinc/08/74/81/178087481.db2.gz IIROVARTLONXAE-LLVKDONJSA-N 2 0 238.350 2.421 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CN(C)C[C@H]1C)C1CCCCC1 ZINC000336747143 398190556 /nfs/dbraw/zinc/19/05/56/398190556.db2.gz RURVMIPOHKFHAO-YRGRVCCFSA-N 2 0 224.392 2.495 20 0 BEADRP Cc1cc(N2CCC[NH2+]CC2)c2ccccc2[nH+]1 ZINC000035697515 178115377 /nfs/dbraw/zinc/11/53/77/178115377.db2.gz JQCNKRUGSCMMQA-UHFFFAOYSA-N 2 0 241.338 2.343 20 0 BEADRP CCC[C@@H](C[NH2+]C[C@H](C)C[NH+]1CCCC1)OC ZINC000386162605 398198985 /nfs/dbraw/zinc/19/89/85/398198985.db2.gz VDNCLZARAJGCFH-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP FC1(CC[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)CCC1 ZINC000647796770 398201654 /nfs/dbraw/zinc/20/16/54/398201654.db2.gz NBIZHHULIBHZAH-JHJVBQTASA-N 2 0 240.366 2.246 20 0 BEADRP Cc1cc(N2C[C@@H]([NH+]3CCCC3)C[C@H]2C)cc[nH+]1 ZINC000286206193 178120705 /nfs/dbraw/zinc/12/07/05/178120705.db2.gz CATFQGMZEDRUML-HIFRSBDPSA-N 2 0 245.370 2.453 20 0 BEADRP C[C@@H]1CC[N@H+](CCCC2CC[NH2+]CC2)[C@@H]1C ZINC000380602288 398202245 /nfs/dbraw/zinc/20/22/45/398202245.db2.gz HJGSJNOUCVGFNQ-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]Cc2cccc3c2CC[NH2+]C3)[C@H]1C ZINC000386302696 398204937 /nfs/dbraw/zinc/20/49/37/398204937.db2.gz VRPBRQCVSJMVGW-BFQNTYOBSA-N 2 0 244.382 2.466 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+]CCCC(C)(C)C ZINC000313287844 343983224 /nfs/dbraw/zinc/98/32/24/343983224.db2.gz XWTINYDLIZRNSZ-GFCCVEGCSA-N 2 0 230.396 2.156 20 0 BEADRP CCOc1ccccc1C[NH2+]C1CCC([NH3+])CC1 ZINC000051693388 398213919 /nfs/dbraw/zinc/21/39/19/398213919.db2.gz DJGARWYRDFQRII-UHFFFAOYSA-N 2 0 248.370 2.445 20 0 BEADRP C[C@@H](c1ccncc1)[N@H+]1CC[C@H]2C[NH2+]C[C@H]2CC1 ZINC000386507586 398211038 /nfs/dbraw/zinc/21/10/38/398211038.db2.gz LYQHTXFWGLELIF-AEGPPILISA-N 2 0 245.370 2.074 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCCc2cccnc21 ZINC000643512458 398224495 /nfs/dbraw/zinc/22/44/95/398224495.db2.gz LMXSPVZPTHISJL-MELADBBJSA-N 2 0 245.370 2.176 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]Cc1noc2ccccc12 ZINC000576411494 365590740 /nfs/dbraw/zinc/59/07/40/365590740.db2.gz FWVCUPDTEXPZRD-JTQLQIEISA-N 2 0 233.315 2.045 20 0 BEADRP Cc1cc(N[C@@H]2C[C@@H](C)[N@@H+](C3CC3)C2)cc[nH+]1 ZINC000290737954 178183238 /nfs/dbraw/zinc/18/32/38/178183238.db2.gz GUKZSDXCUSNMJS-DGCLKSJQSA-N 2 0 231.343 2.427 20 0 BEADRP Cc1cc(N[C@H](C)CC[NH+](C)C)cc[nH+]1 ZINC000229565295 178185271 /nfs/dbraw/zinc/18/52/71/178185271.db2.gz MUPMMWOFJKIZOE-SNVBAGLBSA-N 2 0 207.321 2.142 20 0 BEADRP Cc1cc(N[C@H](C[NH3+])C2CCCC2)cc[nH+]1 ZINC000235852649 178187468 /nfs/dbraw/zinc/18/74/68/178187468.db2.gz ICDDXWFIJYCPLC-CYBMUJFWSA-N 2 0 219.332 2.319 20 0 BEADRP Cc1ccc(C[NH2+][C@@](C)(C[NH3+])C2CC2)cc1 ZINC000430575564 398229631 /nfs/dbraw/zinc/22/96/31/398229631.db2.gz VMBNHYSJAMGPQZ-AWEZNQCLSA-N 2 0 218.344 2.212 20 0 BEADRP CCC(CC)C[N@@H+]1CC[C@H]2[NH2+]CC[C@H]2C1 ZINC000336713144 168352201 /nfs/dbraw/zinc/35/22/01/168352201.db2.gz VJPYILLMAYXVGC-QWHCGFSZSA-N 2 0 210.365 2.106 20 0 BEADRP Cc1ccc(C[NH2+][C@](C)(C[NH3+])C2CC2)cc1 ZINC000430576021 398228830 /nfs/dbraw/zinc/22/88/30/398228830.db2.gz VMBNHYSJAMGPQZ-CQSZACIVSA-N 2 0 218.344 2.212 20 0 BEADRP CCC[C@H](C)[N@@H+]1CC[C@H](C[NH+](C)CC)C1 ZINC000187707540 259304158 /nfs/dbraw/zinc/30/41/58/259304158.db2.gz SUOIYUUXAWCDRU-QWHCGFSZSA-N 2 0 212.381 2.449 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C2CCC([NH+](C)C)CC2)[C@@H]1C ZINC000421364954 192333171 /nfs/dbraw/zinc/33/31/71/192333171.db2.gz ABWQOWBCFJNZIK-AYZDXNEBSA-N 2 0 224.392 2.493 20 0 BEADRP Cc1cc([C@H](C)[NH2+]C[C@@H](C)C[NH3+])c(C)o1 ZINC000309016089 178248070 /nfs/dbraw/zinc/24/80/70/178248070.db2.gz ZMBLRPKBQSCHMK-WPRPVWTQSA-N 2 0 210.321 2.142 20 0 BEADRP CCc1ccc(C[N@@H+]2CC[C@H]([C@H](C)[NH3+])C2)cc1 ZINC000252788804 136227187 /nfs/dbraw/zinc/22/71/87/136227187.db2.gz XINJRGVYNJBMMG-WFASDCNBSA-N 2 0 232.371 2.418 20 0 BEADRP c1ccc2c(c1)CC[C@H]2[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000643534306 398239731 /nfs/dbraw/zinc/23/97/31/398239731.db2.gz QBRSYXQEXFOXSF-HUUCEWRRSA-N 2 0 242.366 2.406 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]C[C@H]2COc3ccccc32)C1 ZINC000576718177 365669232 /nfs/dbraw/zinc/66/92/32/365669232.db2.gz UXVVGVKTTRTFHU-YNEHKIRRSA-N 2 0 246.354 2.022 20 0 BEADRP CCC[NH+](CCC)CCC[NH2+][C@@H]1CO[C@H](C)C1 ZINC000647178681 398264446 /nfs/dbraw/zinc/26/44/46/398264446.db2.gz CYYFZGCANFIFLN-KGLIPLIRSA-N 2 0 242.407 2.266 20 0 BEADRP CCC(CC)[N@H+](CCOC)CC1CC[NH2+]CC1 ZINC000042681738 168373981 /nfs/dbraw/zinc/37/39/81/168373981.db2.gz GRMCOZVOBBFUGY-UHFFFAOYSA-N 2 0 242.407 2.123 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@H]1CCC[C@H]2C[C@H]21 ZINC000378751120 346827361 /nfs/dbraw/zinc/82/73/61/346827361.db2.gz UVSCMMZSQTZCPH-XQQFMLRXSA-N 2 0 210.365 2.106 20 0 BEADRP CCC[C@@H]1C[C@H]1[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@H]1C ZINC000393529037 259314594 /nfs/dbraw/zinc/31/45/94/259314594.db2.gz VNTJYJUWWWZKQF-DHGKCCLASA-N 2 0 224.392 2.493 20 0 BEADRP CC(C)CCC[NH2+][C@H](C)CC[NH+](C)C ZINC000165219869 361836886 /nfs/dbraw/zinc/83/68/86/361836886.db2.gz NBAFDGFQFZMGQW-GFCCVEGCSA-N 2 0 200.370 2.352 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]C[C@H]1CCCC[N@H+](C)C1 ZINC000624124195 346854723 /nfs/dbraw/zinc/85/47/23/346854723.db2.gz ZSSHLMDDESGQDW-MCIONIFRSA-N 2 0 224.392 2.497 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@@H]2Cc3ccccc32)CC1 ZINC000037565258 538963466 /nfs/dbraw/zinc/96/34/66/538963466.db2.gz MMUOHMTURAEVNY-AWEZNQCLSA-N 2 0 244.382 2.400 20 0 BEADRP C[C@H]([NH2+]C(C1CC1)C1CC1)C1CC[NH+](C)CC1 ZINC000037220969 538961907 /nfs/dbraw/zinc/96/19/07/538961907.db2.gz YCEYGYZQMKJGHX-NSHDSACASA-N 2 0 236.403 2.495 20 0 BEADRP Cc1ccc(CNC[C@H]2CCCC[N@@H+](C)C2)o1 ZINC000623654524 398279994 /nfs/dbraw/zinc/27/99/94/398279994.db2.gz BJMHIZXADHWSSQ-CYBMUJFWSA-N 2 0 236.359 2.410 20 0 BEADRP C(C[NH2+]C(C1CC1)C1CC1)C[C@H]1CCC[NH2+]1 ZINC000309592689 342729282 /nfs/dbraw/zinc/72/92/82/342729282.db2.gz HKECHPRTFODWAL-CYBMUJFWSA-N 2 0 222.376 2.297 20 0 BEADRP CC1(C)CCC[N@@H+]1CCC[NH+]1CCCC1 ZINC000583949622 342734754 /nfs/dbraw/zinc/73/47/54/342734754.db2.gz LJODZTKMIPFNON-UHFFFAOYSA-N 2 0 210.365 2.347 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)[C@H]1C[C@H]1C ZINC000321136984 342751190 /nfs/dbraw/zinc/75/11/90/342751190.db2.gz URTIDVHFBVBIRZ-RFGFWPKPSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CCC[N@H+](C[C@H]2CCC(F)(F)C2)C1 ZINC000382309831 361895098 /nfs/dbraw/zinc/89/50/98/361895098.db2.gz ICPILYPPTRBBKM-SDDRHHMPSA-N 2 0 246.345 2.481 20 0 BEADRP CC(C)=CC[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000188455961 538978708 /nfs/dbraw/zinc/97/87/08/538978708.db2.gz KNSGBVISOHONSM-QWHCGFSZSA-N 2 0 208.349 2.169 20 0 BEADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(O)cc2)C1 ZINC000040620671 538972131 /nfs/dbraw/zinc/97/21/31/538972131.db2.gz YVJUKIXQTHFUDQ-AWEZNQCLSA-N 2 0 248.370 2.212 20 0 BEADRP CC(C)[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(O)cc2)C1 ZINC000040620668 538972446 /nfs/dbraw/zinc/97/24/46/538972446.db2.gz YVJUKIXQTHFUDQ-CQSZACIVSA-N 2 0 248.370 2.212 20 0 BEADRP C[C@@H]([N@H+](C)C[C@H]1CC[NH2+][C@H](C)C1)C1(C)CC1 ZINC000385481904 342805195 /nfs/dbraw/zinc/80/51/95/342805195.db2.gz YUGXCMWLKUZVIN-UPJWGTAASA-N 2 0 224.392 2.495 20 0 BEADRP CC(C)C1([NH2+][C@H](C)C2CC[NH+](C)CC2)CC1 ZINC000381976305 398290893 /nfs/dbraw/zinc/29/08/93/398290893.db2.gz AGULUVSUGRMHET-GFCCVEGCSA-N 2 0 224.392 2.495 20 0 BEADRP Cc1nccn1CC[NH2+]C(C(C)C)C(C)C ZINC000380819315 538993079 /nfs/dbraw/zinc/99/30/79/538993079.db2.gz LWYNNVKELPJQIF-UHFFFAOYSA-N 2 0 223.364 2.462 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[C@H]1C)C1CC[NH+](C)CC1 ZINC000379774276 538980363 /nfs/dbraw/zinc/98/03/63/538980363.db2.gz CCGPYMYBGXIEGR-WZRBSPASSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC(F)(F)C1)C1CC[NH+](C)CC1 ZINC000379918903 538981726 /nfs/dbraw/zinc/98/17/26/538981726.db2.gz PPYAFLGEUZIOAH-CMPLNLGQSA-N 2 0 246.345 2.494 20 0 BEADRP C/C=C/C[NH2+][C@@H]1CC[N@H+](C)[C@@H]2CCC[C@H]21 ZINC000624199679 342843346 /nfs/dbraw/zinc/84/33/46/342843346.db2.gz VLZLVMVKNOOHOW-PZQWPYDESA-N 2 0 208.349 2.025 20 0 BEADRP CC(C)[N@H+](CC1CC1)C[C@@H]1CC[NH2+][C@@H](C)C1 ZINC000232637889 342867843 /nfs/dbraw/zinc/86/78/43/342867843.db2.gz KLMGDXXPIXYCHO-GXTWGEPZSA-N 2 0 224.392 2.495 20 0 BEADRP CCO[C@@H]1C[C@H]([NH2+]CCC[NH2+]C(C)C)C1(C)C ZINC000233765169 342912292 /nfs/dbraw/zinc/91/22/92/342912292.db2.gz YYXWWJYPWUQFBQ-QWHCGFSZSA-N 2 0 242.407 2.168 20 0 BEADRP C[C@H]([NH2+][C@H]1C[C@@H](C)[N@H+](C)C[C@H]1C)C1CC1 ZINC000036908631 342913907 /nfs/dbraw/zinc/91/39/07/342913907.db2.gz WUSBWJKUCHKNBM-DCQANWLSSA-N 2 0 210.365 2.103 20 0 BEADRP CSC1(C[NH2+]CCN2CCC[C@@H](C)C2)CC1 ZINC000309867595 398324926 /nfs/dbraw/zinc/32/49/26/398324926.db2.gz PDSGMFJTQMPVSP-GFCCVEGCSA-N 2 0 242.432 2.204 20 0 BEADRP CC1(C)COC[C@@H]1N[C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000313054178 259330245 /nfs/dbraw/zinc/33/02/45/259330245.db2.gz HQVDZAPEYVMUPO-IHRRRGAJSA-N 2 0 246.354 2.146 20 0 BEADRP Cc1ccc([C@H](C)[NH2+]CCCC[NH3+])s1 ZINC000037715094 342943351 /nfs/dbraw/zinc/94/33/51/342943351.db2.gz ODMAVXTVYXXCCY-JTQLQIEISA-N 2 0 212.362 2.446 20 0 BEADRP CC(C)[C@H](C)[NH2+]CC(C)(C)C[NH+](C)C ZINC000019905807 342962685 /nfs/dbraw/zinc/96/26/85/342962685.db2.gz RCBDOJQZHPLJIX-NSHDSACASA-N 2 0 200.370 2.208 20 0 BEADRP CCc1cc(NC[C@H](C)[NH+](C)C)cc[nH+]1 ZINC000307768282 529557523 /nfs/dbraw/zinc/55/75/23/529557523.db2.gz JOYWCFRGTYXYJR-JTQLQIEISA-N 2 0 207.321 2.006 20 0 BEADRP C[C@@H](F)CC[NH+]1CCC(C[NH+](C)C)CC1 ZINC000351849231 136257596 /nfs/dbraw/zinc/25/75/96/136257596.db2.gz DFCSJCXWSDTDGE-LLVKDONJSA-N 2 0 216.344 2.008 20 0 BEADRP C[NH+](C)CC1CC[NH+](CCCCF)CC1 ZINC000351852768 136257818 /nfs/dbraw/zinc/25/78/18/136257818.db2.gz LIZFQUXPZGBYJR-UHFFFAOYSA-N 2 0 216.344 2.010 20 0 BEADRP C[C@H]([NH3+])[C@H]1CC[N@@H+]([C@H]2CCc3ccc(F)cc32)C1 ZINC000351856986 136258475 /nfs/dbraw/zinc/25/84/75/136258475.db2.gz AHWCYIIWZQIXEX-WBIUFABUSA-N 2 0 248.345 2.482 20 0 BEADRP C[C@H](Cc1ccc(F)cc1)[NH2+]CCCC[NH3+] ZINC000162531678 349726123 /nfs/dbraw/zinc/72/61/23/349726123.db2.gz ZIOGOJMWBBEPJY-LLVKDONJSA-N 2 0 224.323 2.085 20 0 BEADRP Cc1ccc(C[NH2+]C[C@H]2CCC[N@@H+](C)C2)cc1 ZINC000044535122 343008915 /nfs/dbraw/zinc/00/89/15/343008915.db2.gz PGJMMWNAQDBFPD-OAHLLOKOSA-N 2 0 232.371 2.426 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCC[C@@H]([NH3+])C1)c1nccs1 ZINC000235462456 343038966 /nfs/dbraw/zinc/03/89/66/343038966.db2.gz IQMFYHCVYKACOW-GMTAPVOTSA-N 2 0 239.388 2.106 20 0 BEADRP C[C@@H]1C[N@@H+](CCn2ccnc2)C[C@H](C)C1(F)F ZINC000625656199 344025762 /nfs/dbraw/zinc/02/57/62/344025762.db2.gz ZVPZDRNEFVWLLQ-PHIMTYICSA-N 2 0 243.301 2.106 20 0 BEADRP CC(C)CC[C@H](C)[NH2+][C@@H]1CC[NH2+]C[C@@H]1C ZINC000308846778 346924084 /nfs/dbraw/zinc/92/40/84/346924084.db2.gz LPLUATDLUAEKDU-RWMBFGLXSA-N 2 0 212.381 2.399 20 0 BEADRP CC[C@@H](C)[C@@H](C)[NH2+]C1CCN(CC)CC1 ZINC000038098011 343063914 /nfs/dbraw/zinc/06/39/14/343063914.db2.gz JCJGIRBUXZFRFE-VXGBXAGGSA-N 2 0 212.381 2.495 20 0 BEADRP CCC(C)(C)[C@H](C)[NH2+][C@@H]1CC[NH2+]C[C@@H]1C ZINC000576862100 365706000 /nfs/dbraw/zinc/70/60/00/365706000.db2.gz IYVOWCWWWUSWBB-SDDRHHMPSA-N 2 0 212.381 2.399 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@@H](C)C2CCC2)CC1 ZINC000309938339 343099907 /nfs/dbraw/zinc/09/99/07/343099907.db2.gz AUGMEVJMYNVPQT-LBPRGKRZSA-N 2 0 224.392 2.497 20 0 BEADRP CC[N@H+](C)C[C@H]1CC[NH+](C2CCCC2)C1 ZINC000120109272 343108710 /nfs/dbraw/zinc/10/87/10/343108710.db2.gz FEGZLYWWVUJZLL-GFCCVEGCSA-N 2 0 210.365 2.203 20 0 BEADRP CC[C@@H]1CCC[N@H+](C[C@H]2CCC[NH2+]C2)C1 ZINC000251613279 343125306 /nfs/dbraw/zinc/12/53/06/343125306.db2.gz DQMJOFRFMSIZNX-OLZOCXBDSA-N 2 0 210.365 2.108 20 0 BEADRP Cc1cccc(CC[NH2+][C@@H]2CCC[C@H]([NH3+])C2)c1 ZINC000093215802 343151313 /nfs/dbraw/zinc/15/13/13/343151313.db2.gz NDSSOEYVZJXMRE-LSDHHAIUSA-N 2 0 232.371 2.397 20 0 BEADRP Cc1cccc(OCC[NH2+][C@H]2CCC[C@@H]([NH3+])C2)c1 ZINC000093215590 343151320 /nfs/dbraw/zinc/15/13/20/343151320.db2.gz FPEWPCMBEIEHRL-KGLIPLIRSA-N 2 0 248.370 2.233 20 0 BEADRP C[C@@H]([NH2+]CC1CC[NH2+]CC1)c1ccccc1F ZINC000094010226 343151646 /nfs/dbraw/zinc/15/16/46/343151646.db2.gz CVBULDFYSQALHM-LLVKDONJSA-N 2 0 236.334 2.476 20 0 BEADRP CC(C)[N@@H+](Cc1ccccn1)CC1CC[NH2+]CC1 ZINC000094021165 343152504 /nfs/dbraw/zinc/15/25/04/343152504.db2.gz AZSLTBXLYVTGCZ-UHFFFAOYSA-N 2 0 247.386 2.292 20 0 BEADRP CCc1ccc(C[N@@H+]2C[C@@H](C[NH3+])C[C@@H]2C)s1 ZINC000126775496 343171490 /nfs/dbraw/zinc/17/14/90/343171490.db2.gz ZVZJRIJMNSQSRI-WDEREUQCSA-N 2 0 238.400 2.480 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000132022782 343187546 /nfs/dbraw/zinc/18/75/46/343187546.db2.gz RPPVQIPEDIFZJA-CHWSQXEVSA-N 2 0 236.359 2.190 20 0 BEADRP CCC[C@H](C)C[N@@H+]1CCC[C@H](CC[NH3+])C1 ZINC000069626589 343286042 /nfs/dbraw/zinc/28/60/42/343286042.db2.gz QWLXGMQOWMZGIR-QWHCGFSZSA-N 2 0 212.381 2.483 20 0 BEADRP CCC(CC)C[N@@H+]1CCC[C@@H]([C@@H](C)[NH3+])C1 ZINC000069724636 343290015 /nfs/dbraw/zinc/29/00/15/343290015.db2.gz VUYFQPMJLFLXLU-DGCLKSJQSA-N 2 0 212.381 2.482 20 0 BEADRP [NH3+]CCC[NH2+][C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000069381543 343277713 /nfs/dbraw/zinc/27/77/13/343277713.db2.gz IJAWRVGOGPHHBA-RKDXNWHRSA-N 2 0 224.270 2.046 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]C1CCC(C(F)F)CC1 ZINC000335617740 136296450 /nfs/dbraw/zinc/29/64/50/136296450.db2.gz YVXQLAOCVJSVIM-LXKPXOPUSA-N 2 0 232.318 2.280 20 0 BEADRP [NH3+]C1(C[NH2+]CCCc2cccc(F)c2)CCC1 ZINC000348747156 136296479 /nfs/dbraw/zinc/29/64/79/136296479.db2.gz HWPNNVPAQKMLOX-UHFFFAOYSA-N 2 0 236.334 2.229 20 0 BEADRP CC1(C[NH2+]CC2([NH3+])CCCCC2)CCC1 ZINC000232857978 136292673 /nfs/dbraw/zinc/29/26/73/136292673.db2.gz USHMVWNDIYAYGM-UHFFFAOYSA-N 2 0 210.365 2.428 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCC[NH2+]C1)c1ccoc1 ZINC000569833804 323042455 /nfs/dbraw/zinc/04/24/55/323042455.db2.gz AENDGVUMUWHBCK-NWDGAFQWSA-N 2 0 222.332 2.320 20 0 BEADRP C[C@H]1C[C@@H]([NH3+])CC[N@@H+]1CCCOc1ccccc1 ZINC000052092378 343300487 /nfs/dbraw/zinc/30/04/87/343300487.db2.gz PNKMOBPFELNHOS-KBPBESRZSA-N 2 0 248.370 2.267 20 0 BEADRP CC(C)c1ncc(C[NH2+][C@H](C)C[C@H](C)[NH3+])s1 ZINC000584053362 343307388 /nfs/dbraw/zinc/30/73/88/343307388.db2.gz IYFOTJWYCYKKSY-VHSXEESVSA-N 2 0 241.404 2.482 20 0 BEADRP CCC[C@H]([NH2+]C[C@H](O)C[N@H+](C)CC)C(C)(C)C ZINC000584061424 343309910 /nfs/dbraw/zinc/30/99/10/343309910.db2.gz KUHSWGITAFUXMT-STQMWFEESA-N 2 0 244.423 2.103 20 0 BEADRP Cc1ccc(C[NH2+]C2CCN(C)CC2)c(C)c1 ZINC000037248662 343340970 /nfs/dbraw/zinc/34/09/70/343340970.db2.gz OLMSEVBLRKMFGS-UHFFFAOYSA-N 2 0 232.371 2.487 20 0 BEADRP C[C@@H]1C[C@H](C)[N@H+](C[C@@H]2CCSC2)C[C@@H]1C[NH3+] ZINC000397252916 323043138 /nfs/dbraw/zinc/04/31/38/323043138.db2.gz DHOZJYSHRXSKHC-VOAKCMCISA-N 2 0 242.432 2.045 20 0 BEADRP Cc1ccc(CNC[C@H]2CC[N@@H+](C3CC3)C2)o1 ZINC000037408313 343344725 /nfs/dbraw/zinc/34/47/25/343344725.db2.gz MSGRZRWQQGXTLQ-GFCCVEGCSA-N 2 0 234.343 2.162 20 0 BEADRP c1ccc2c(c1)CC[C@H]2C[NH2+]C1CC[NH2+]CC1 ZINC000335650432 136304570 /nfs/dbraw/zinc/30/45/70/136304570.db2.gz OJLUEJOCRCJSCD-ZDUSSCGKSA-N 2 0 230.355 2.058 20 0 BEADRP CCC[C@@H](C)C[NH+]1CCC([C@@H](C)[NH3+])CC1 ZINC000082474746 343444357 /nfs/dbraw/zinc/44/43/57/343444357.db2.gz YAGQGJQGNHFHEZ-VXGBXAGGSA-N 2 0 212.381 2.482 20 0 BEADRP CC[C@@H]([NH2+]CC(C)(C)C[NH+](C)C)C1CC1 ZINC000083054094 343475317 /nfs/dbraw/zinc/47/53/17/343475317.db2.gz XZNJMGRETJOLED-GFCCVEGCSA-N 2 0 212.381 2.352 20 0 BEADRP CC[C@H](c1ccc(F)cc1)[NH+]1C[C@@H]2C[NH2+]C[C@H]2C1 ZINC000251057691 343492536 /nfs/dbraw/zinc/49/25/36/343492536.db2.gz HIMFLNDJATVPDK-KCQAQPDRSA-N 2 0 248.345 2.428 20 0 BEADRP [NH3+]CC[C@H]1CCCC[N@@H+]1CCC1CCC1 ZINC000398626327 488220788 /nfs/dbraw/zinc/22/07/88/488220788.db2.gz HXPHVHJFWXJSAG-CYBMUJFWSA-N 2 0 210.365 2.380 20 0 BEADRP CC(C)[C@@H]1CCC[N@@H+]1CC1CC[NH2+]CC1 ZINC000084126113 343522370 /nfs/dbraw/zinc/52/23/70/343522370.db2.gz ZHCBZNDBNUMBLH-ZDUSSCGKSA-N 2 0 210.365 2.106 20 0 BEADRP CC[N@@H+]1CCC[C@@H](C[NH2+]CC2(C)CC2)C1 ZINC000379974363 365770405 /nfs/dbraw/zinc/77/04/05/365770405.db2.gz CTADPKYEGWMQNE-LBPRGKRZSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@@H](C)Cc1ccsc1 ZINC000379976749 365772711 /nfs/dbraw/zinc/77/27/11/365772711.db2.gz QVUALFNMFKZJMP-QWRGUYRKSA-N 2 0 226.389 2.396 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+][C@@H]1CCc2ccccc2C1 ZINC000049554208 343602754 /nfs/dbraw/zinc/60/27/54/343602754.db2.gz HZRUXQBFVIHDJL-XJKSGUPXSA-N 2 0 246.398 2.474 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]C2CCCC2)[C@@H](C)C1 ZINC000221695031 346962997 /nfs/dbraw/zinc/96/29/97/346962997.db2.gz OOYRDELLAVVNMI-AAEUAGOBSA-N 2 0 210.365 2.249 20 0 BEADRP COc1cc[nH+]c(NCc2nc(C)c(C)[nH]2)c1 ZINC000517758787 343711048 /nfs/dbraw/zinc/71/10/48/343711048.db2.gz FCWDHUGGIOUPMX-UHFFFAOYSA-N 2 0 232.287 2.042 20 0 BEADRP CCC1(C[NH2+][C@@H]2CC[N@H+](C)C[C@@H]2C)CC1 ZINC000090219468 343750019 /nfs/dbraw/zinc/75/00/19/343750019.db2.gz OAQAORWHXKEUOQ-NWDGAFQWSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CCC[C@]2(CC[NH+](C)C2)C1 ZINC000625450602 343777901 /nfs/dbraw/zinc/77/79/01/343777901.db2.gz QNIJEONGNVVCGL-MGPQQGTHSA-N 2 0 222.376 2.060 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+]CC1=CC[N@H+](C)CC1 ZINC000336665061 537817783 /nfs/dbraw/zinc/81/77/83/537817783.db2.gz LKBNVBQAPVKWGX-UONOGXRCSA-N 2 0 222.376 2.273 20 0 BEADRP C[NH+](C)CC(C)(C)C[NH2+]CC1(C)CCC1 ZINC000336701370 537827553 /nfs/dbraw/zinc/82/75/53/537827553.db2.gz PQZWNAUGGIHMDO-UHFFFAOYSA-N 2 0 212.381 2.354 20 0 BEADRP [NH3+][C@@]12CCC[C@@H]1C[N@H+](CCCc1ccccc1)C2 ZINC000621777907 343903587 /nfs/dbraw/zinc/90/35/87/343903587.db2.gz IOPNTWHDPAVJLJ-HZPDHXFCSA-N 2 0 244.382 2.432 20 0 BEADRP CC[NH+]1CCC(N[C@@H]2COc3ccccc32)CC1 ZINC000070528544 343952539 /nfs/dbraw/zinc/95/25/39/343952539.db2.gz PPHKWMLSNLFDFB-CQSZACIVSA-N 2 0 246.354 2.194 20 0 BEADRP CC(C)(C)C[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000634732486 344107403 /nfs/dbraw/zinc/10/74/03/344107403.db2.gz HOSSPSFMUCNMAP-NSHDSACASA-N 2 0 212.381 2.400 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]([NH2+]C2CCCC2)C1 ZINC000634733167 344108084 /nfs/dbraw/zinc/10/80/84/344108084.db2.gz YSCXOPCDSQLTJC-LBPRGKRZSA-N 2 0 210.365 2.297 20 0 BEADRP CC(C)CCC[NH2+][C@]12CCC[C@@H]1C[NH2+]C2 ZINC000634733841 344114533 /nfs/dbraw/zinc/11/45/33/344114533.db2.gz PLGBRFJISBPTCK-OLZOCXBDSA-N 2 0 210.365 2.154 20 0 BEADRP C[N@H+](C[C@@H]1CCSC1)C[C@H]1CCC[NH+](C)C1 ZINC000495060199 529956993 /nfs/dbraw/zinc/95/69/93/529956993.db2.gz PZLZHIVKCRPXJB-STQMWFEESA-N 2 0 242.432 2.013 20 0 BEADRP CC1(C)CC[C@@H]([NH2+]CC[C@H]2CC[NH2+]C2)C1 ZINC000129538638 344213590 /nfs/dbraw/zinc/21/35/90/344213590.db2.gz LPLWZBQZGZJUEG-VXGBXAGGSA-N 2 0 210.365 2.154 20 0 BEADRP CCC(CC)C[NH2+]CC1(C)CC[NH2+]CC1 ZINC000130444974 344221562 /nfs/dbraw/zinc/22/15/62/344221562.db2.gz NNXCBXGGOIBAIJ-UHFFFAOYSA-N 2 0 212.381 2.402 20 0 BEADRP CC[C@H](c1ccccc1)[NH+]1C[C@H]2C[NH2+]C[C@@H]2C1 ZINC000088249785 344238200 /nfs/dbraw/zinc/23/82/00/344238200.db2.gz BCXCOULHNIDEGW-RBSFLKMASA-N 2 0 230.355 2.289 20 0 BEADRP C[C@@H]1C[C@@H]([NH3+])CN1CCCOCc1ccccc1 ZINC000385069945 344314450 /nfs/dbraw/zinc/31/44/50/344314450.db2.gz HLUONAXBUJHOGW-UKRRQHHQSA-N 2 0 248.370 2.015 20 0 BEADRP C[C@H](c1ccc(F)cc1)[N@H+](C)CCC[NH3+] ZINC000133206146 344315510 /nfs/dbraw/zinc/31/55/10/344315510.db2.gz MKRVAEDYEGLLSI-SNVBAGLBSA-N 2 0 210.296 2.167 20 0 BEADRP CC(C)[C@@H]([NH3+])CC[N@H+](C)CC1CCCC1 ZINC000133307690 344317688 /nfs/dbraw/zinc/31/76/88/344317688.db2.gz KJKONOVXQWRLKX-ZDUSSCGKSA-N 2 0 212.381 2.482 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000387729682 347047112 /nfs/dbraw/zinc/04/71/12/347047112.db2.gz RSAZZNODOKKJFZ-QNWHQSFQSA-N 2 0 210.365 2.105 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000387729683 347047184 /nfs/dbraw/zinc/04/71/84/347047184.db2.gz RSAZZNODOKKJFZ-RNJOBUHISA-N 2 0 210.365 2.105 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CCc1ccc(F)cc1F ZINC000584285624 344419733 /nfs/dbraw/zinc/41/97/33/344419733.db2.gz VMPIVKFNKSBTDD-VHSXEESVSA-N 2 0 242.313 2.223 20 0 BEADRP CCc1ccc(CN2C[C@H]([NH3+])C[C@@H]2C)cc1 ZINC000385200210 344376601 /nfs/dbraw/zinc/37/66/01/344376601.db2.gz QYHMDURVEVIISZ-SMDDNHRTSA-N 2 0 218.344 2.171 20 0 BEADRP C[C@@H]1C[C@H](C[NH+]2C[C@H](C)S[C@@H](C)C2)CC[NH2+]1 ZINC000300056914 344384201 /nfs/dbraw/zinc/38/42/01/344384201.db2.gz WFBPDXIQSQSZEK-MROQNXINSA-N 2 0 242.432 2.200 20 0 BEADRP Cc1cc(N[C@H]2CC[NH2+]CC(C)(C)C2)nc(C)n1 ZINC000634813592 344399205 /nfs/dbraw/zinc/39/92/05/344399205.db2.gz QOCIVSJXFNJAHB-LBPRGKRZSA-N 2 0 248.374 2.284 20 0 BEADRP CCN1CCCC[C@H]1C[NH2+]CC1(SC)CC1 ZINC000309962723 344481975 /nfs/dbraw/zinc/48/19/75/344481975.db2.gz MCFZJIHKTPIDAU-LBPRGKRZSA-N 2 0 242.432 2.346 20 0 BEADRP Cc1ccc(C[NH2+][C@H](C)CC[NH+](C)C)s1 ZINC000049553556 344653200 /nfs/dbraw/zinc/65/32/00/344653200.db2.gz DBZNFDXQBLULRJ-SNVBAGLBSA-N 2 0 226.389 2.486 20 0 BEADRP CC(C)=CC[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C)C1 ZINC000158649510 344707224 /nfs/dbraw/zinc/70/72/24/344707224.db2.gz KZTPLPXCGNGXHF-ZIAGYGMSSA-N 2 0 222.376 2.369 20 0 BEADRP CSC1(C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)CCC1 ZINC000235094745 344782899 /nfs/dbraw/zinc/78/28/99/344782899.db2.gz NIZILLLCRWFDHJ-WDEREUQCSA-N 2 0 228.405 2.132 20 0 BEADRP COC1CCC([NH2+]Cc2ccc(C[NH3+])cc2)CC1 ZINC000583381193 344857388 /nfs/dbraw/zinc/85/73/88/344857388.db2.gz ATKLFBOVQPSIJZ-UHFFFAOYSA-N 2 0 248.370 2.193 20 0 BEADRP C[NH+]1CCC(C)(C[NH2+][C@H]2CC[C@@H]2C2CC2)CC1 ZINC000348377525 537878379 /nfs/dbraw/zinc/87/83/79/537878379.db2.gz NDOWMLYBPPPPJC-KGLIPLIRSA-N 2 0 236.403 2.497 20 0 BEADRP CC(C)=CC[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000249518016 537878945 /nfs/dbraw/zinc/87/89/45/537878945.db2.gz KNSGBVISOHONSM-OLZOCXBDSA-N 2 0 208.349 2.169 20 0 BEADRP C[NH+]1CCC(C)(C[NH2+][C@@H]2CC[C@@H]2C2CC2)CC1 ZINC000348377529 537879248 /nfs/dbraw/zinc/87/92/48/537879248.db2.gz NDOWMLYBPPPPJC-ZIAGYGMSSA-N 2 0 236.403 2.497 20 0 BEADRP Cc1ccc([C@H](C)C[NH+]2C[C@H]3C[NH2+]C[C@@H]3C2)cc1 ZINC000628191883 344946637 /nfs/dbraw/zinc/94/66/37/344946637.db2.gz YGSYAXSUPOHCLI-FVQBIDKESA-N 2 0 244.382 2.250 20 0 BEADRP C[C@@H](c1cccs1)[N@H+](C)C[C@H]1CC[NH2+]C1 ZINC000248089930 345036937 /nfs/dbraw/zinc/03/69/37/345036937.db2.gz UWQCPGDFYYIQES-QWRGUYRKSA-N 2 0 224.373 2.350 20 0 BEADRP C([NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)C1CCC1 ZINC000250677954 192369844 /nfs/dbraw/zinc/36/98/44/192369844.db2.gz XBZMINNYVZZJGS-STQMWFEESA-N 2 0 208.349 2.003 20 0 BEADRP C[C@@H]1C[C@H]2CCCC[C@H]2[N@@H+]1CC12CC(C1)C[NH2+]2 ZINC000634993398 345190378 /nfs/dbraw/zinc/19/03/78/345190378.db2.gz SZDBDWLWLYZWFG-HNBOJAAESA-N 2 0 234.387 2.391 20 0 BEADRP C[C@@H]1CC2(CCC2)C[N@@H+]1CC12CC(C1)C[NH2+]2 ZINC000634995190 345183814 /nfs/dbraw/zinc/18/38/14/345183814.db2.gz XVZWEWWRTCMDKL-LKSINWNRSA-N 2 0 220.360 2.003 20 0 BEADRP c1ccc2c(c1)CC[C@@H]2C[NH2+]CC12CC(C1)C[NH2+]2 ZINC000634996046 345185995 /nfs/dbraw/zinc/18/59/95/345185995.db2.gz XUKKDKBUKHWRNZ-CXOJTPOUSA-N 2 0 242.366 2.058 20 0 BEADRP C1=CC[C@H]([NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)CC1 ZINC000156129879 345130141 /nfs/dbraw/zinc/13/01/41/345130141.db2.gz BDPAISBURWTYQS-BFHYXJOUSA-N 2 0 220.360 2.312 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCCCS2)CC[N@@H+]1C ZINC000156157724 345133692 /nfs/dbraw/zinc/13/36/92/345133692.db2.gz OGCPYAHJXZQHBB-AGIUHOORSA-N 2 0 242.432 2.344 20 0 BEADRP C([N@@H+]1CCC2(C1)CCCCC2)C12CC(C1)C[NH2+]2 ZINC000634993095 345188833 /nfs/dbraw/zinc/18/88/33/345188833.db2.gz LAJZTASSMYLPBX-UHFFFAOYSA-N 2 0 234.387 2.395 20 0 BEADRP C[C@@H]1CN(CC23CC(C2)C[NH2+]3)CC(C)(C)C1 ZINC000634993813 345191851 /nfs/dbraw/zinc/19/18/51/345191851.db2.gz HGDKLISMDVJPHK-DCBWTQNWSA-N 2 0 222.376 2.106 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H]2CCCC23CC3)C1 ZINC000634997012 345194067 /nfs/dbraw/zinc/19/40/67/345194067.db2.gz BCVLGXNBMHOFKJ-GRYCIOLGSA-N 2 0 208.349 2.179 20 0 BEADRP [NH3+]C1CCC([NH2+][C@H]2CCCC23CC3)CC1 ZINC000634997774 345195455 /nfs/dbraw/zinc/19/54/55/345195455.db2.gz SFVKOMHSIRGKMG-MCIGGMRASA-N 2 0 208.349 2.179 20 0 BEADRP COc1ccc(C[N@@H+]2C[C@H](C)[C@H](C[NH3+])C2)cc1C ZINC000634998151 345197053 /nfs/dbraw/zinc/19/70/53/345197053.db2.gz BMDVDFQNAVSIOM-GXTWGEPZSA-N 2 0 248.370 2.030 20 0 BEADRP C[C@H](C[N@@H+]1C[C@H](C)[C@H](C[NH3+])C1)c1ccccc1 ZINC000634998518 345198341 /nfs/dbraw/zinc/19/83/41/345198341.db2.gz GRUJHXNJCMVDAF-VNHYZAJKSA-N 2 0 232.371 2.317 20 0 BEADRP C[C@@H]1C[C@@H](C[NH2+][C@@H]2CCCC23CC3)CC[NH2+]1 ZINC000634999315 345199678 /nfs/dbraw/zinc/19/96/78/345199678.db2.gz SGKZSBSZJVTOND-FRRDWIJNSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H]([NH2+][C@H]1CCCC12CC2)[C@@H]1CCCC[NH2+]1 ZINC000635003284 345205409 /nfs/dbraw/zinc/20/54/09/345205409.db2.gz HTYBMDQOTWSZSA-AVGNSLFASA-N 2 0 222.376 2.439 20 0 BEADRP C[C@@H]([NH2+]Cc1cccc2c1CC[NH2+]C2)[C@H]1C[C@H]1C ZINC000635002896 345205772 /nfs/dbraw/zinc/20/57/72/345205772.db2.gz AYSPRIQVLVUVIC-HSMVNMDESA-N 2 0 244.382 2.466 20 0 BEADRP C[C@H]([NH2+][C@H]1CCCC12CC2)[C@H]1CCCC[NH2+]1 ZINC000635003289 345205784 /nfs/dbraw/zinc/20/57/84/345205784.db2.gz HTYBMDQOTWSZSA-XQQFMLRXSA-N 2 0 222.376 2.439 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCCC12CC2)[C@H]1CCCC[NH2+]1 ZINC000635003288 345205830 /nfs/dbraw/zinc/20/58/30/345205830.db2.gz HTYBMDQOTWSZSA-UPJWGTAASA-N 2 0 222.376 2.439 20 0 BEADRP C[C@@H](CC1CC1)[NH2+][C@H]1CC[C@H](C[NH3+])CC1 ZINC000635004158 345207071 /nfs/dbraw/zinc/20/70/71/345207071.db2.gz COCLSGSRAKTWMS-DRZSPHRISA-N 2 0 210.365 2.282 20 0 BEADRP CC1(C)CC[C@H]1[NH2+][C@H]1CC[C@H](C[NH3+])CC1 ZINC000635004964 345208351 /nfs/dbraw/zinc/20/83/51/345208351.db2.gz KZVULMAGPODGFM-IJLUTSLNSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)c1ccoc1 ZINC000635005541 345209676 /nfs/dbraw/zinc/20/96/76/345209676.db2.gz JFHOKUKYWUJOGB-NQBHXWOUSA-N 2 0 222.332 2.448 20 0 BEADRP Cc1ncc([C@H](C)[NH2+][C@H](C)C[C@H](C)[NH3+])s1 ZINC000635006335 345210508 /nfs/dbraw/zinc/21/05/08/345210508.db2.gz MDFABEYSOMKLKH-YIZRAAEISA-N 2 0 227.377 2.228 20 0 BEADRP Cc1ccc(C[NH2+]C2CCC(C[NH3+])CC2)o1 ZINC000635006608 345211492 /nfs/dbraw/zinc/21/14/92/345211492.db2.gz CAEVWGDSLFSRDY-UHFFFAOYSA-N 2 0 222.332 2.195 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]Cc1cccc2[nH]ccc21 ZINC000635011325 345213445 /nfs/dbraw/zinc/21/34/45/345213445.db2.gz DTQGNLQGLGWGRB-MNOVXSKESA-N 2 0 231.343 2.383 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]Cc1cccc2[nH]ccc21 ZINC000635011327 345213907 /nfs/dbraw/zinc/21/39/07/345213907.db2.gz DTQGNLQGLGWGRB-WDEREUQCSA-N 2 0 231.343 2.383 20 0 BEADRP C[C@@H](CC1CCC1)[NH2+][C@@H](C)[C@@H]1CCC[NH2+]1 ZINC000635011366 345213980 /nfs/dbraw/zinc/21/39/80/345213980.db2.gz FBUAJSQSXDRHFU-GVXVVHGQSA-N 2 0 210.365 2.295 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1C[C@H]1C(F)(F)F ZINC000635012445 345214388 /nfs/dbraw/zinc/21/43/88/345214388.db2.gz MLOJOKWEWMBNNH-QCLAVDOMSA-N 2 0 236.281 2.044 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@H]2CC[C@H](C[NH3+])CC2)[C@@H]1C ZINC000635007688 345215162 /nfs/dbraw/zinc/21/51/62/345215162.db2.gz XDQRHVCFEWBHAL-SYLRKERUSA-N 2 0 210.365 2.138 20 0 BEADRP COC[C@@H](CC(C)C)[NH2+][C@H]1CC[C@H](C[NH3+])CC1 ZINC000635008770 345216345 /nfs/dbraw/zinc/21/63/45/345216345.db2.gz VGDQYVOLPVAMMD-MGPQQGTHSA-N 2 0 242.407 2.155 20 0 BEADRP [NH3+]C[C@H]1CC[C@H]([NH2+]C(C2CC2)C2CC2)CC1 ZINC000635009319 345216857 /nfs/dbraw/zinc/21/68/57/345216857.db2.gz XTKJOEQUMSFUAG-MJHDQNEOSA-N 2 0 222.376 2.282 20 0 BEADRP COC[C@H]([NH2+][C@@H]1CC[NH2+]CC(C)(C)C1)C(C)C ZINC000635009256 345216863 /nfs/dbraw/zinc/21/68/63/345216863.db2.gz GOGVGIBIIOSHNN-OLZOCXBDSA-N 2 0 242.407 2.025 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1C[C@H]1C(F)(F)F ZINC000635014246 345219238 /nfs/dbraw/zinc/21/92/38/345219238.db2.gz ZMWSQCBDJAGDBE-IWSPIJDZSA-N 2 0 224.270 2.044 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+]CCCC(C)C)C1 ZINC000162089318 345260436 /nfs/dbraw/zinc/26/04/36/345260436.db2.gz IWNCHVWOEANBIM-CYBMUJFWSA-N 2 0 212.381 2.354 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CC(C)(C)C)[C@@H](C)C1 ZINC000246893625 345276708 /nfs/dbraw/zinc/27/67/08/345276708.db2.gz FMWNDGYPTPCJLG-RYUDHWBXSA-N 2 0 212.381 2.352 20 0 BEADRP CCC1CC[NH+](CC2CC[NH2+]CC2)CC1 ZINC000042447388 168526141 /nfs/dbraw/zinc/52/61/41/168526141.db2.gz NJQSDJZYFICWJE-UHFFFAOYSA-N 2 0 210.365 2.108 20 0 BEADRP CCOC(C)(C)C[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@@H]1C ZINC000159172179 345413518 /nfs/dbraw/zinc/41/35/18/345413518.db2.gz YATGETYOJXOGMW-RWMBFGLXSA-N 2 0 242.407 2.120 20 0 BEADRP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]CC1(C2CC2)CCC1 ZINC000090724228 345575628 /nfs/dbraw/zinc/57/56/28/345575628.db2.gz JWINGNHVDHBKRN-JSGCOSHPSA-N 2 0 236.403 2.497 20 0 BEADRP CC[NH+]1CCC(N(C)Cc2ncccc2C)CC1 ZINC000093178530 345659445 /nfs/dbraw/zinc/65/94/45/345659445.db2.gz FSJINQTYXLYFNZ-UHFFFAOYSA-N 2 0 247.386 2.306 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1 ZINC000319086444 259384096 /nfs/dbraw/zinc/38/40/96/259384096.db2.gz CFDFSSKWACRCEZ-ZDEQEGDKSA-N 2 0 212.381 2.399 20 0 BEADRP [NH3+]CCCC[NH2+]C/C=C/c1ccccc1 ZINC000200655772 345728715 /nfs/dbraw/zinc/72/87/15/345728715.db2.gz QMXUPEOIQOABGZ-RMKNXTFCSA-N 2 0 204.317 2.028 20 0 BEADRP COc1ccc(C[NH2+][C@@H]2CCC[C@H]2C[NH3+])c(C)c1 ZINC000562960246 345839963 /nfs/dbraw/zinc/83/99/63/345839963.db2.gz LYJGHGILMKNJHJ-SWLSCSKDSA-N 2 0 248.370 2.221 20 0 BEADRP Cc1ncc(CNC2C[C@H]3CCC[C@@H](C2)[N@H+]3C)o1 ZINC000628222539 345956258 /nfs/dbraw/zinc/95/62/58/345956258.db2.gz WGFSNMRDRMWNKW-YHWZYXNKSA-N 2 0 249.358 2.088 20 0 BEADRP C[C@H]1C[C@H](NCc2cnc(C3CC3)o2)CC[N@@H+]1C ZINC000628223410 345964250 /nfs/dbraw/zinc/96/42/50/345964250.db2.gz CYPPSQQJZIHXGW-CMPLNLGQSA-N 2 0 249.358 2.124 20 0 BEADRP C[C@H](Cc1ccsc1)[NH2+]C[C@H](C)C[NH+](C)C ZINC000381455936 345937167 /nfs/dbraw/zinc/93/71/67/345937167.db2.gz IJRPRCURNRACCP-NWDGAFQWSA-N 2 0 240.416 2.466 20 0 BEADRP CCc1cc(NC[C@H]2CCC[N@H+](C)C2)cc[nH+]1 ZINC000307767796 345949828 /nfs/dbraw/zinc/94/98/28/345949828.db2.gz IYLDFPNBLHJXDN-GFCCVEGCSA-N 2 0 233.359 2.398 20 0 BEADRP CSCCCC[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000401010345 346032991 /nfs/dbraw/zinc/03/29/91/346032991.db2.gz GPDFRWWBKCLYHP-YNEHKIRRSA-N 2 0 242.432 2.107 20 0 BEADRP CCCC[N@H+](CC)CC[C@H]1CCC[NH2+]C1 ZINC000051918844 346207452 /nfs/dbraw/zinc/20/74/52/346207452.db2.gz SBKCSPLFWFUIHV-CYBMUJFWSA-N 2 0 212.381 2.498 20 0 BEADRP Cc1cccc(C)c1CN1C[C@@H](C)[C@@H]([NH3+])C1 ZINC000235339521 179034554 /nfs/dbraw/zinc/03/45/54/179034554.db2.gz JCKHJDLGGWBNON-OCCSQVGLSA-N 2 0 218.344 2.082 20 0 BEADRP Cc1cccc(C)c1C[NH+]1CCC([NH3+])CC1 ZINC000135077244 179035353 /nfs/dbraw/zinc/03/53/53/179035353.db2.gz VAGHSWOLWWGCLX-UHFFFAOYSA-N 2 0 218.344 2.227 20 0 BEADRP CC(C)[C@H]([NH2+][C@H]1CC[NH2+][C@H](C)C1)C1CC1 ZINC000563348532 323119931 /nfs/dbraw/zinc/11/99/31/323119931.db2.gz BTFIMBDCIPTINL-WXHSDQCUSA-N 2 0 210.365 2.151 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000069662166 349952462 /nfs/dbraw/zinc/95/24/62/349952462.db2.gz UXGRXJAZNSKQMP-AAEUAGOBSA-N 2 0 210.365 2.106 20 0 BEADRP Cc1cccc(C[N@H+](C)C[C@H]2CCC[NH2+]C2)c1 ZINC000042435907 179065860 /nfs/dbraw/zinc/06/58/60/179065860.db2.gz ZHZUEBQSNRJURV-HNNXBMFYSA-N 2 0 232.371 2.426 20 0 BEADRP Cc1cccc(C[N@@H+]2CC[C@@H]([NH3+])[C@H](C)C2)c1C ZINC000094338766 179078849 /nfs/dbraw/zinc/07/88/49/179078849.db2.gz NAHHXYBJRFSNQO-IUODEOHRSA-N 2 0 232.371 2.473 20 0 BEADRP Cc1cccc(C[N@@H+]2CC[C@@H]([NH3+])[C@H](C)C2)c1 ZINC000049712994 179080556 /nfs/dbraw/zinc/08/05/56/179080556.db2.gz BHYVJULQJQUVOV-TZMCWYRMSA-N 2 0 218.344 2.164 20 0 BEADRP Cc1cccc(C[N@H+]2CC[C@H](C)[C@@H](C[NH3+])C2)c1 ZINC000229060508 179081658 /nfs/dbraw/zinc/08/16/58/179081658.db2.gz PZQZIZURPBSUOU-ZFWWWQNUSA-N 2 0 232.371 2.412 20 0 BEADRP Cc1cccc(C[N@H+]2C[C@H](C[NH3+])C[C@H]2C)c1C ZINC000228066882 179083515 /nfs/dbraw/zinc/08/35/15/179083515.db2.gz USOJHFQEAMHYFS-OCCSQVGLSA-N 2 0 232.371 2.473 20 0 BEADRP CC1(C)[C@H]([NH3+])C[C@H]1[NH2+]C[C@H]1CCC(F)(F)C1 ZINC000641800907 362753009 /nfs/dbraw/zinc/75/30/09/362753009.db2.gz ILLSEOSFNBARGU-IVZWLZJFSA-N 2 0 232.318 2.137 20 0 BEADRP C[C@@H]1CCC(C)(C)[N@@H+]1CC[C@H]1CC[NH2+]C1 ZINC000641801055 362753588 /nfs/dbraw/zinc/75/35/88/362753588.db2.gz LYCMVCPFFJSVAM-VXGBXAGGSA-N 2 0 210.365 2.249 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H]2C[C@@H]([NH3+])C2(C)C)cc1 ZINC000641802611 362754864 /nfs/dbraw/zinc/75/48/64/362754864.db2.gz NRLCTDJBUFCHLZ-ZIAGYGMSSA-N 2 0 232.371 2.253 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2C[C@H]([NH3+])C2(C)C)cc1F ZINC000641801790 362756865 /nfs/dbraw/zinc/75/68/65/362756865.db2.gz VQPOUHTZYJORFB-STQMWFEESA-N 2 0 236.334 2.350 20 0 BEADRP Cc1cc(C)c(C[NH2+][C@@H]2C[C@@H]([NH3+])C2(C)C)c(C)n1 ZINC000641801994 362758431 /nfs/dbraw/zinc/75/84/31/362758431.db2.gz XIYXCMDIPPMNQX-ZIAGYGMSSA-N 2 0 247.386 2.222 20 0 BEADRP CC1(C)[C@H]([NH3+])C[C@@H]1[NH2+]CCCC1CCC1 ZINC000641802164 362758522 /nfs/dbraw/zinc/75/85/22/362758522.db2.gz YLBAULFOKHMPDH-NEPJUHHUSA-N 2 0 210.365 2.282 20 0 BEADRP Cc1ccc(F)cc1C[NH2+][C@H]1C[C@H]([NH3+])C1(C)C ZINC000641802355 362759965 /nfs/dbraw/zinc/75/99/65/362759965.db2.gz JMMMLVJWBPDGMK-STQMWFEESA-N 2 0 236.334 2.350 20 0 BEADRP Cc1cc(CN2[C@H](C)[C@H](C)CC[C@H]2C[NH3+])ccn1 ZINC000641806402 362763955 /nfs/dbraw/zinc/76/39/55/362763955.db2.gz RQZBKVHLRBCZFM-KYOSRNDESA-N 2 0 247.386 2.338 20 0 BEADRP Cc1ncccc1CN1[C@@H](C)[C@H](C)CC[C@H]1C[NH3+] ZINC000641809497 362766158 /nfs/dbraw/zinc/76/61/58/362766158.db2.gz QRXSWCIHEBFFKW-ZLDLUXBVSA-N 2 0 247.386 2.338 20 0 BEADRP COC[C@@H](C)C[NH2+][C@H](CC[NH+](C)C)C(C)(C)C ZINC000187912220 346648782 /nfs/dbraw/zinc/64/87/82/346648782.db2.gz DKOKQKKMLYWWGC-QWHCGFSZSA-N 2 0 244.423 2.225 20 0 BEADRP C[C@H](C[NH2+][C@@H](C)C1CCC1)C[NH+]1CCCC1 ZINC000178243721 346662964 /nfs/dbraw/zinc/66/29/64/346662964.db2.gz PCIZFYCSEUEDIC-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1CCC[N@H+](CCCc2cncn2C)CC1 ZINC000580657636 365852397 /nfs/dbraw/zinc/85/23/97/365852397.db2.gz SYYMLJOOXIUCDL-ZDUSSCGKSA-N 2 0 235.375 2.475 20 0 BEADRP COC[C@H](C)C[NH2+]CCC[NH+](C(C)C)C(C)C ZINC000188094934 346752583 /nfs/dbraw/zinc/75/25/83/346752583.db2.gz MXSHSEIONCXLIU-CQSZACIVSA-N 2 0 244.423 2.367 20 0 BEADRP Cc1cccc(OCC[N@H+]2CC[C@H]([C@@H](C)[NH3+])C2)c1 ZINC000163194483 179168466 /nfs/dbraw/zinc/16/84/66/179168466.db2.gz IWDJZXHEHHTUFB-KGLIPLIRSA-N 2 0 248.370 2.043 20 0 BEADRP Cc1cc(F)ccc1CN1C[C@@H]2CCC[C@@]2([NH3+])C1 ZINC000622004666 370655483 /nfs/dbraw/zinc/65/54/83/370655483.db2.gz SHDLVZOGITZRBL-DZGCQCFKSA-N 2 0 248.345 2.447 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]Cc2ccc3c(c2)COC3)C1 ZINC000577204759 365875546 /nfs/dbraw/zinc/87/55/46/365875546.db2.gz IFJPBQVIMMEKTK-LSDHHAIUSA-N 2 0 246.354 2.076 20 0 BEADRP CCC(C)(C)[C@H](C)[NH2+]CCC[N@H+](C)CCOC ZINC000582044732 347126161 /nfs/dbraw/zinc/12/61/61/347126161.db2.gz GKEGGHMFVITZCD-ZDUSSCGKSA-N 2 0 244.423 2.369 20 0 BEADRP Cc1cccc([C@@H](C)[N@@H+]2CC[C@H](C[NH3+])C2)c1 ZINC000050245512 179180306 /nfs/dbraw/zinc/18/03/06/179180306.db2.gz UQMWVBRNPKQUTF-CHWSQXEVSA-N 2 0 218.344 2.337 20 0 BEADRP CCN1CCC([NH2+][C@H]2CC[C@@H]2C2CC2)CC1 ZINC000336753579 347222175 /nfs/dbraw/zinc/22/21/75/347222175.db2.gz FBGLCNLMODQANJ-KGLIPLIRSA-N 2 0 222.376 2.249 20 0 BEADRP CC[C@H](C)[C@@H](C)[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000319245571 347340279 /nfs/dbraw/zinc/34/02/79/347340279.db2.gz WZTIUWXMZSDMDH-XQQFMLRXSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+]CCC[NH2+]C1CC1 ZINC000382602028 347372286 /nfs/dbraw/zinc/37/22/86/347372286.db2.gz SLNHVBZATCPRIT-YPMHNXCESA-N 2 0 210.365 2.297 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+]C[C@H]1CCCC1(C)C ZINC000388512082 347437543 /nfs/dbraw/zinc/43/75/43/347437543.db2.gz VSGSQZLDSIEOGX-OLZOCXBDSA-N 2 0 242.407 2.156 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@H](C)C1CCCC1 ZINC000054081239 347445416 /nfs/dbraw/zinc/44/54/16/347445416.db2.gz PNRVXCNJSRGDBR-VXGBXAGGSA-N 2 0 212.381 2.495 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000319487592 259396291 /nfs/dbraw/zinc/39/62/91/259396291.db2.gz GWCWRXMCIJWVGW-RWMBFGLXSA-N 2 0 212.381 2.400 20 0 BEADRP CC[C@H](C)[C@@H](C)[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000319487603 259396314 /nfs/dbraw/zinc/39/63/14/259396314.db2.gz GWCWRXMCIJWVGW-YNEHKIRRSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@@H]1CC[NH+](C/C=C/C[N@H+]2CC[C@H](C)C2)C1 ZINC000196818344 347522264 /nfs/dbraw/zinc/52/22/64/347522264.db2.gz QRABICHAEBIDEA-ISANGGDFSA-N 2 0 222.376 2.226 20 0 BEADRP CC(C)[C@H]([NH3+])CC[N@H+](C)CC(C)(C)C ZINC000227732297 535063892 /nfs/dbraw/zinc/06/38/92/535063892.db2.gz PAHRFDNOWJBWKF-LLVKDONJSA-N 2 0 200.370 2.338 20 0 BEADRP Cc1ccccc1CC[NH2+][C@H](C)CCC[NH3+] ZINC000309379469 179267587 /nfs/dbraw/zinc/26/75/87/179267587.db2.gz GIAJXFPSIHFLHI-CYBMUJFWSA-N 2 0 220.360 2.255 20 0 BEADRP Cc1ccccc1C[N@H+](C)C[C@@H]1CCC[NH2+]C1 ZINC000042436130 179269984 /nfs/dbraw/zinc/26/99/84/179269984.db2.gz NMLWZEONSPXPAG-CQSZACIVSA-N 2 0 232.371 2.426 20 0 BEADRP CC[N@H+](CCSC)CC[C@@H]1CCC[NH+]1C ZINC000592201473 347753997 /nfs/dbraw/zinc/75/39/97/347753997.db2.gz HBOXPSGLBRMVGX-LBPRGKRZSA-N 2 0 230.421 2.156 20 0 BEADRP Cc1ccccc1C[C@H](C)[NH2+][C@@H]1CCN(C)C1 ZINC000061989162 179290934 /nfs/dbraw/zinc/29/09/34/179290934.db2.gz HNFBPYLOHAUOFT-DZGCQCFKSA-N 2 0 232.371 2.220 20 0 BEADRP CC[C@H]([NH2+]C1CC[NH2+]CC1)c1ccc(OC)cc1 ZINC000038041173 348038286 /nfs/dbraw/zinc/03/82/86/348038286.db2.gz ODEMIXJLEYIEPY-HNNXBMFYSA-N 2 0 248.370 2.488 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)CSCCF)C1 ZINC000595010212 348160049 /nfs/dbraw/zinc/16/00/49/348160049.db2.gz IZPGPNKGEUGIND-VXGBXAGGSA-N 2 0 248.411 2.009 20 0 BEADRP CCSC1(C[NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)CC1 ZINC000595100235 348195053 /nfs/dbraw/zinc/19/50/53/348195053.db2.gz QDCHLMZEFHPJME-NWDGAFQWSA-N 2 0 242.432 2.344 20 0 BEADRP CCSC1(C[NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)CC1 ZINC000595100237 348195263 /nfs/dbraw/zinc/19/52/63/348195263.db2.gz QDCHLMZEFHPJME-VXGBXAGGSA-N 2 0 242.432 2.344 20 0 BEADRP C[C@H]1CSCC[N@@H+]1CCCC1CC[NH2+]CC1 ZINC000069762547 490158683 /nfs/dbraw/zinc/15/86/83/490158683.db2.gz RNMVITPPDBEQQL-LBPRGKRZSA-N 2 0 242.432 2.204 20 0 BEADRP CCOC(C)(C)C[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623502465 362926931 /nfs/dbraw/zinc/92/69/31/362926931.db2.gz KNPOAAFEOFSAJM-LBPRGKRZSA-N 2 0 242.407 2.264 20 0 BEADRP Cc1cc[nH+]c(NC[C@@H]2CCC[C@H]([NH3+])C2)c1 ZINC000227673131 179447161 /nfs/dbraw/zinc/44/71/61/179447161.db2.gz MOKGXEHAKHULOK-NEPJUHHUSA-N 2 0 219.332 2.319 20 0 BEADRP Cc1ccsc1C[NH2+]CCCC[NH+](C)C ZINC000045598338 179547488 /nfs/dbraw/zinc/54/74/88/179547488.db2.gz YNYIKMJRLFMINR-UHFFFAOYSA-N 2 0 226.389 2.488 20 0 BEADRP CCSC1(C[NH2+][C@@H]2CCCC[C@H]2C[NH3+])CC1 ZINC000596649014 348605199 /nfs/dbraw/zinc/60/51/99/348605199.db2.gz ACGDEQWQABVQRJ-NWDGAFQWSA-N 2 0 242.432 2.379 20 0 BEADRP CCSC1(C[NH2+][C@H]2CCCC[C@@H]2C[NH3+])CC1 ZINC000596649011 348605323 /nfs/dbraw/zinc/60/53/23/348605323.db2.gz ACGDEQWQABVQRJ-NEPJUHHUSA-N 2 0 242.432 2.379 20 0 BEADRP CCSC1(C[NH2+][C@H](CC)[C@@H]2CCC[NH2+]2)CC1 ZINC000596652332 348607225 /nfs/dbraw/zinc/60/72/25/348607225.db2.gz PQIRDOXLODOWIB-NEPJUHHUSA-N 2 0 242.432 2.392 20 0 BEADRP CCC(CC)[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000227497392 535078412 /nfs/dbraw/zinc/07/84/12/535078412.db2.gz KMLBTJYDLXSZEG-UHFFFAOYSA-N 2 0 212.381 2.497 20 0 BEADRP C[NH+](C)C[C@H]1CC[N@H+](CC2(C)CCC2)C1 ZINC000432829411 192373089 /nfs/dbraw/zinc/37/30/89/192373089.db2.gz PUZAPBOQYQFKAD-GFCCVEGCSA-N 2 0 210.365 2.060 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+]C2CC(F)(F)C2)CC1(C)C ZINC000623507341 362931718 /nfs/dbraw/zinc/93/17/18/362931718.db2.gz FOJFKDXMBWXTON-SECBINFHSA-N 2 0 232.318 2.247 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH3+])[C@H]1c1cccs1 ZINC000101429199 348890872 /nfs/dbraw/zinc/89/08/72/348890872.db2.gz DPKWXOKHANQUNA-ONGXEEELSA-N 2 0 210.346 2.090 20 0 BEADRP CCC(CC)[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000130223291 535082770 /nfs/dbraw/zinc/08/27/70/535082770.db2.gz AMBGMZFHRRFJPT-QWHCGFSZSA-N 2 0 210.365 2.391 20 0 BEADRP C(C[C@H]1CCC[NH2+]C1)[NH2+]C(C1CC1)C1CC1 ZINC000054309192 348975190 /nfs/dbraw/zinc/97/51/90/348975190.db2.gz GSQFFFCQRSEGCU-LLVKDONJSA-N 2 0 222.376 2.154 20 0 BEADRP CCC[C@@H](CC)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000054243863 348960783 /nfs/dbraw/zinc/96/07/83/348960783.db2.gz OQXXNDPFBGVMLY-QWHCGFSZSA-N 2 0 212.381 2.497 20 0 BEADRP C[N@@H+](Cc1ccsc1)CC1CC[NH2+]CC1 ZINC000021949583 490219611 /nfs/dbraw/zinc/21/96/11/490219611.db2.gz HMGQNCHDEJZKLA-UHFFFAOYSA-N 2 0 224.373 2.180 20 0 BEADRP CSC1(C[NH2+][C@H]2CC[N@H+](C)C(C)(C)C2)CC1 ZINC000598976678 349070158 /nfs/dbraw/zinc/07/01/58/349070158.db2.gz ZLJISTRMITWPIQ-NSHDSACASA-N 2 0 242.432 2.344 20 0 BEADRP CC[C@@H](C)[N@@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000248372850 349125337 /nfs/dbraw/zinc/12/53/37/349125337.db2.gz DDKNNRVTFYQVCL-OLZOCXBDSA-N 2 0 210.365 2.203 20 0 BEADRP CCCCN1CCCC[C@H]1[C@H]1CCC[NH2+]1 ZINC000249905240 349165525 /nfs/dbraw/zinc/16/55/25/349165525.db2.gz YBPBQUFGULXXQW-OLZOCXBDSA-N 2 0 210.365 2.393 20 0 BEADRP C[C@@H]1CSC[C@H]1[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623521703 362942960 /nfs/dbraw/zinc/94/29/60/362942960.db2.gz CJTQDWCIBSNVHW-GRYCIOLGSA-N 2 0 242.432 2.200 20 0 BEADRP C[C@@H]1CC[C@H]1[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623524325 362944933 /nfs/dbraw/zinc/94/49/33/362944933.db2.gz OASJFEAYKRVBPG-IJLUTSLNSA-N 2 0 210.365 2.247 20 0 BEADRP C[C@H](c1ccncc1)[NH+]1CCC(C[NH+](C)C)CC1 ZINC000601526227 349298005 /nfs/dbraw/zinc/29/80/05/349298005.db2.gz IVNMMXAXBOLJRI-CYBMUJFWSA-N 2 0 247.386 2.416 20 0 BEADRP CC[C@H]1CCC[C@H]1[NH2+]CC1CC[NH2+]CC1 ZINC000388633901 349279286 /nfs/dbraw/zinc/27/92/86/349279286.db2.gz LWKTZYDLVDBDGJ-QWHCGFSZSA-N 2 0 210.365 2.154 20 0 BEADRP Cc1c[nH+]ccc1NC[C@H]1CC[N@@H+](C2CC2)C1 ZINC000070489531 350014851 /nfs/dbraw/zinc/01/48/51/350014851.db2.gz CYBWNBZGGVJRSC-GFCCVEGCSA-N 2 0 231.343 2.286 20 0 BEADRP CC[C@H]([NH2+]CCC[NH+](CC)CC)[C@H]1CCOC1 ZINC000131453848 191014701 /nfs/dbraw/zinc/01/47/01/191014701.db2.gz NNVUWGQZUIUAIU-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]CC(C)(C)C[NH+](C)C ZINC000131886979 191017757 /nfs/dbraw/zinc/01/77/57/191017757.db2.gz SVEPCUZRUDKDIN-NSHDSACASA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@H](O)C1CCCCC1 ZINC000422708196 192437160 /nfs/dbraw/zinc/43/71/60/192437160.db2.gz XKJXNMREQJBAAE-OCCSQVGLSA-N 2 0 242.407 2.035 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)CC2CC2)C1 ZINC000132427462 191032883 /nfs/dbraw/zinc/03/28/83/191032883.db2.gz WUOLIKCKIWIPNN-AAEUAGOBSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H](CC1CC1)[NH2+]C[C@H](C)C[NH+]1CCCC1 ZINC000132430432 191033092 /nfs/dbraw/zinc/03/30/92/191033092.db2.gz GKOBYFLVQYMMFP-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H]1C[N@H+](CCOCCC(C)C)CC[C@@H]1[NH3+] ZINC000147517692 538057107 /nfs/dbraw/zinc/05/71/07/538057107.db2.gz CLAJCXVFQVBKOT-KGLIPLIRSA-N 2 0 242.407 2.108 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCC[C@H]3C[C@H]32)C1 ZINC000304531847 350162208 /nfs/dbraw/zinc/16/22/08/350162208.db2.gz HBHQISNRUMLMLV-RQJABVFESA-N 2 0 222.376 2.106 20 0 BEADRP [NH3+]CC1CCC([NH2+]Cc2ccccc2F)CC1 ZINC000422740946 192448636 /nfs/dbraw/zinc/44/86/36/192448636.db2.gz CQVOYRULFKAMEY-UHFFFAOYSA-N 2 0 236.334 2.433 20 0 BEADRP [NH3+]C1CCC([NH2+][C@H](C2CC2)C2CCC2)CC1 ZINC000324777316 323281824 /nfs/dbraw/zinc/28/18/24/323281824.db2.gz FPFQYEBOZLJFEM-RUXDESIVSA-N 2 0 222.376 2.425 20 0 BEADRP C[C@@H]([NH2+]CC[C@H]1CCC[C@@H](C)C1)C1C[NH2+]C1 ZINC000422741251 192449426 /nfs/dbraw/zinc/44/94/26/192449426.db2.gz DBHYFYBYHBNFAW-JHJVBQTASA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@@H](C1CC1)C1CCC1 ZINC000324790577 323282876 /nfs/dbraw/zinc/28/28/76/323282876.db2.gz JURBLZZWGVVSIU-DDTOSNHZSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H](F)CC[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623533113 362952373 /nfs/dbraw/zinc/95/23/73/362952373.db2.gz TXTZGDBRMSKNIH-GHMZBOCLSA-N 2 0 216.344 2.197 20 0 BEADRP Cc1ncccc1N[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000226832451 180228164 /nfs/dbraw/zinc/22/81/64/180228164.db2.gz GHJCZCWODRTUHJ-JQWIXIFHSA-N 2 0 219.332 2.285 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]Cc1ccccc1F ZINC000422771602 192460739 /nfs/dbraw/zinc/46/07/39/192460739.db2.gz XLLIERXGFDBVSV-UWVGGRQHSA-N 2 0 210.296 2.041 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CC[N@H+](CCCOc2ccccc2)C1 ZINC000163172099 350508927 /nfs/dbraw/zinc/50/89/27/350508927.db2.gz GZEWUYAOGDGPGK-UONOGXRCSA-N 2 0 248.370 2.125 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]CC(C)(C)C(F)(F)F ZINC000577482291 365963732 /nfs/dbraw/zinc/96/37/32/365963732.db2.gz PPTYLGNRXQQYBY-QMMMGPOBSA-N 2 0 226.286 2.292 20 0 BEADRP C[C@@H](CCc1ccco1)[NH2+][C@H]1CCCC[NH2+]C1 ZINC000577483168 365965252 /nfs/dbraw/zinc/96/52/52/365965252.db2.gz UWVOEBOFIANZEP-STQMWFEESA-N 2 0 236.359 2.332 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+][C@H]1CCCC[NH2+]C1 ZINC000577483165 365965430 /nfs/dbraw/zinc/96/54/30/365965430.db2.gz UWVOEBOFIANZEP-OLZOCXBDSA-N 2 0 236.359 2.332 20 0 BEADRP CC1(C)CCC[N@@H+]1CCC1CC[NH2+]CC1 ZINC000063067424 350570071 /nfs/dbraw/zinc/57/00/71/350570071.db2.gz WTSMBUMIRCIDLH-UHFFFAOYSA-N 2 0 210.365 2.251 20 0 BEADRP CC[NH+]1CCC(Nc2cc[nH+]c(C)c2)CC1 ZINC000229564019 350579841 /nfs/dbraw/zinc/57/98/41/350579841.db2.gz KZRIIRWXINHMJW-UHFFFAOYSA-N 2 0 219.332 2.286 20 0 BEADRP CC[N@@H+]1CCC[C@H]1CNc1cc[nH+]c(C)c1 ZINC000229560675 350579981 /nfs/dbraw/zinc/57/99/81/350579981.db2.gz LVQWOMDEGLFNRV-ZDUSSCGKSA-N 2 0 219.332 2.286 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000336656646 350614306 /nfs/dbraw/zinc/61/43/06/350614306.db2.gz LQAQQZDOWKKFFV-AAEUAGOBSA-N 2 0 222.376 2.249 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CC23CC3)CC1(C)C ZINC000623554620 362974959 /nfs/dbraw/zinc/97/49/59/362974959.db2.gz GZZUOMHELDPEFI-WDEREUQCSA-N 2 0 208.349 2.001 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+][C@H]2CC23CC3)CC1(C)C ZINC000623554618 362975419 /nfs/dbraw/zinc/97/54/19/362975419.db2.gz GZZUOMHELDPEFI-MNOVXSKESA-N 2 0 208.349 2.001 20 0 BEADRP C[C@@H]1C[C@H](C[NH3+])C[N@@H+]1C[C@H]1CCCC[C@H]1C ZINC000346689618 365991981 /nfs/dbraw/zinc/99/19/81/365991981.db2.gz ZQPUSVQSLFJNHX-AAVRWANBSA-N 2 0 224.392 2.482 20 0 BEADRP C[C@@H]1SCC[C@@H]1[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623558518 362981301 /nfs/dbraw/zinc/98/13/01/362981301.db2.gz AGILQMCDTQNJIW-TUAOUCFPSA-N 2 0 242.432 2.343 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000336683716 350919712 /nfs/dbraw/zinc/91/97/12/350919712.db2.gz ZIJBGEABSBEWRO-AGIUHOORSA-N 2 0 222.376 2.391 20 0 BEADRP CCO[C@H]1C[C@H]([NH2+][C@H]2CC[N@H+](C)C(C)(C)C2)C1 ZINC000623564114 362990415 /nfs/dbraw/zinc/99/04/15/362990415.db2.gz SKCAYAIUBGUULX-AVGNSLFASA-N 2 0 240.391 2.016 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]C[C@H](C)C2CC2)[C@@H](C)C1 ZINC000252708828 538099913 /nfs/dbraw/zinc/09/99/13/538099913.db2.gz BFKMJMZKCAWKPO-OBJOEFQTSA-N 2 0 224.392 2.352 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+][C@H]2[C@@H]3CCC[C@@H]32)CC1(C)C ZINC000623572200 363001419 /nfs/dbraw/zinc/00/14/19/363001419.db2.gz USPUTNMZZPVBDO-NDBYEHHHSA-N 2 0 222.376 2.247 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+]CC[C@H]2CC2(F)F)CC1(C)C ZINC000623575978 363005524 /nfs/dbraw/zinc/00/55/24/363005524.db2.gz YIPCNDXYUCEMRE-WDEREUQCSA-N 2 0 246.345 2.494 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]CC[C@@H]2CC2(F)F)CC1(C)C ZINC000623575976 363006047 /nfs/dbraw/zinc/00/60/47/363006047.db2.gz YIPCNDXYUCEMRE-MNOVXSKESA-N 2 0 246.345 2.494 20 0 BEADRP CC(C)[C@@H](C)[N@H+](C)C[C@H]1CC[NH2+][C@H](C)C1 ZINC000261530861 535161736 /nfs/dbraw/zinc/16/17/36/535161736.db2.gz DIDRAFOUPUORSR-UPJWGTAASA-N 2 0 212.381 2.351 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]CCCC1CC1 ZINC000577740197 366049435 /nfs/dbraw/zinc/04/94/35/366049435.db2.gz NKPUCYADLDSTIU-YPMHNXCESA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H]1Cc2ccccc2[C@H]1[NH2+]CC1=CC[NH2+]CC1 ZINC000335501394 133868335 /nfs/dbraw/zinc/86/83/35/133868335.db2.gz SNUPNBQDHQVURT-LRDDRELGSA-N 2 0 242.366 2.429 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CCC[C@H]2C[NH3+])cc1F ZINC000414792912 351773056 /nfs/dbraw/zinc/77/30/56/351773056.db2.gz JIWLQKJZWVLZOB-GXTWGEPZSA-N 2 0 236.334 2.351 20 0 BEADRP C[C@@H]1CCC[C@H]1[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000414843508 351830121 /nfs/dbraw/zinc/83/01/21/351830121.db2.gz QAPODJVEDFYESO-FRRDWIJNSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]([NH2+]CC1([NH3+])CCCCC1)C1CCC1 ZINC000414847468 351856481 /nfs/dbraw/zinc/85/64/81/351856481.db2.gz VAAYAVJNOBOUDS-LLVKDONJSA-N 2 0 210.365 2.426 20 0 BEADRP C[NH+](C)C[C@@H]1CC[N@H+](CC2CCSCC2)C1 ZINC000638075948 351948976 /nfs/dbraw/zinc/94/89/76/351948976.db2.gz HVOPTBASORZUOR-ZDUSSCGKSA-N 2 0 242.432 2.013 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@@H]2C[C@H]3C[C@H]3C2)CC1 ZINC000638289781 352125647 /nfs/dbraw/zinc/12/56/47/352125647.db2.gz CIYLJLHZKFXARZ-CLLJXQQHSA-N 2 0 222.376 2.106 20 0 BEADRP CC[C@H](C)[C@H](C[NH2+]CCC[N@H+](C)C(C)C)OC ZINC000638337032 352155449 /nfs/dbraw/zinc/15/54/49/352155449.db2.gz BOUGLVCJNMSXDN-KBPBESRZSA-N 2 0 244.423 2.367 20 0 BEADRP CC(C)[N@H+](C)CCC[NH2+]CC1CCSCC1 ZINC000638338547 352159030 /nfs/dbraw/zinc/15/90/30/352159030.db2.gz YMMFTENADYCAJU-UHFFFAOYSA-N 2 0 244.448 2.450 20 0 BEADRP C([NH2+]C[C@@H]1C[C@H]2C[C@H]2C1)[C@H]1CC[N@@H+](C2CC2)C1 ZINC000638358338 352170264 /nfs/dbraw/zinc/17/02/64/352170264.db2.gz CDIOXWAXYKULJA-YIYPIFLZSA-N 2 0 234.387 2.106 20 0 BEADRP C([NH2+][C@H]1CCN2CCCC[C@H]12)[C@@H]1C[C@H]2C[C@H]2C1 ZINC000638368363 352179602 /nfs/dbraw/zinc/17/96/02/352179602.db2.gz JQJCAVJUMOGHIF-AIEDFZFUSA-N 2 0 234.387 2.249 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)[C@H]1CC1(F)F ZINC000638377103 352188885 /nfs/dbraw/zinc/18/88/85/352188885.db2.gz NHZOOZHKGNMECT-IRCOFANPSA-N 2 0 244.329 2.247 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CS[C@H](C)C2)C1 ZINC000638409120 352218468 /nfs/dbraw/zinc/21/84/68/352218468.db2.gz JIAWTVFEPBANFB-UPJWGTAASA-N 2 0 242.432 2.202 20 0 BEADRP CC[N@@H+]1CCC[C@H](C[NH2+]C[C@](C)(CC)OC)C1 ZINC000638452315 352263050 /nfs/dbraw/zinc/26/30/50/352263050.db2.gz XCLAYRJMVFJIIB-KGLIPLIRSA-N 2 0 242.407 2.123 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc(F)cc2)C1 ZINC000044535825 352351781 /nfs/dbraw/zinc/35/17/81/352351781.db2.gz UGFRGTAIOXYTNA-ZDUSSCGKSA-N 2 0 236.334 2.257 20 0 BEADRP CCc1ccc(C[NH2+][C@H]2CC[NH2+][C@H](C)C2)cc1 ZINC000414944568 352367506 /nfs/dbraw/zinc/36/75/06/352367506.db2.gz HATYUZJYSSWCJI-DOMZBBRYSA-N 2 0 232.371 2.479 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@@H](C)[C@@H]2CC2(F)F)CC1 ZINC000638562677 352387672 /nfs/dbraw/zinc/38/76/72/352387672.db2.gz AUWSPQIUGKFBEO-JQWIXIFHSA-N 2 0 246.345 2.352 20 0 BEADRP C[C@@H]1C[C@H]([N@@H+]2CCC[C@H](C)[C@@H]2C)CC[NH2+]1 ZINC000252931282 538103655 /nfs/dbraw/zinc/10/36/55/538103655.db2.gz BFFRSWMZRDXURF-QNWHQSFQSA-N 2 0 210.365 2.247 20 0 BEADRP CC(C)C[C@@H](C)[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000336666803 187817557 /nfs/dbraw/zinc/81/75/57/187817557.db2.gz DRSRBFQTJTYXEU-CHWSQXEVSA-N 2 0 212.381 2.400 20 0 BEADRP CC(C)[C@@H]1C[C@H]([NH2+]C2CCC([NH3+])CC2)CCO1 ZINC000070361134 187871422 /nfs/dbraw/zinc/87/14/22/187871422.db2.gz GQNYVJBRMKNFHP-PQAZSJQKSA-N 2 0 240.391 2.050 20 0 BEADRP CC[C@@H](C)C[N@@H+]1CC[C@]2(C1)CCC[NH+](C)C2 ZINC000334217510 352817774 /nfs/dbraw/zinc/81/77/74/352817774.db2.gz HGCXOSIFIKYVRS-ZIAGYGMSSA-N 2 0 224.392 2.450 20 0 BEADRP C[N@@H+]1CCC[C@]2(CC[NH+](C3CCCC3)C2)C1 ZINC000334267528 352903042 /nfs/dbraw/zinc/90/30/42/352903042.db2.gz ZULMVAAIYGOVKX-AWEZNQCLSA-N 2 0 222.376 2.347 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H](C)[C@@H]1CC1(F)F ZINC000638862732 353031914 /nfs/dbraw/zinc/03/19/14/353031914.db2.gz HSCWFGOFJVEEPL-MNOVXSKESA-N 2 0 234.334 2.352 20 0 BEADRP CCN1CCC([NH2+][C@@H]2CC[C@H]2C2CC2)CC1 ZINC000336753580 353107542 /nfs/dbraw/zinc/10/75/42/353107542.db2.gz FBGLCNLMODQANJ-UONOGXRCSA-N 2 0 222.376 2.249 20 0 BEADRP CC(C)C[C@H](C[NH2+]C1CCSCC1)N(C)C ZINC000035234384 188060571 /nfs/dbraw/zinc/06/05/71/188060571.db2.gz KLBXISBHZKSRKY-CYBMUJFWSA-N 2 0 244.448 2.448 20 0 BEADRP C(C[N@@H+]1CCC2(CCC2)C1)[C@@H]1CCC[NH2+]C1 ZINC000335663575 188083179 /nfs/dbraw/zinc/08/31/79/188083179.db2.gz NVFKDLMGDXQTIX-ZDUSSCGKSA-N 2 0 222.376 2.252 20 0 BEADRP Cc1ccc2[nH+]ccc(NCCCC[NH3+])c2c1 ZINC000420226631 192179177 /nfs/dbraw/zinc/17/91/77/192179177.db2.gz ARMXJKKHMWPTMU-UHFFFAOYSA-N 2 0 229.327 2.116 20 0 BEADRP CC(C)[C@H]1C[C@@H]([NH2+]CCC[NH+](C)C)CS1 ZINC000336759376 353169538 /nfs/dbraw/zinc/16/95/38/353169538.db2.gz LGZNPMCOTGOGQE-VXGBXAGGSA-N 2 0 230.421 2.058 20 0 BEADRP C[NH+]1CCC(C)(C[NH2+]C[C@@H]2C[C@H]3C[C@H]3C2)CC1 ZINC000638963419 353173485 /nfs/dbraw/zinc/17/34/85/353173485.db2.gz ZDVAEBRBYFDZIU-BTTYYORXSA-N 2 0 236.403 2.354 20 0 BEADRP C[C@H](CCc1ccccc1)[NH2+]CCCC[NH3+] ZINC000037714754 358476479 /nfs/dbraw/zinc/47/64/79/358476479.db2.gz SAQWZHXYSRLJHY-CYBMUJFWSA-N 2 0 220.360 2.336 20 0 BEADRP C[C@@H]1OCC[C@@H]1[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C ZINC000121221572 324005668 /nfs/dbraw/zinc/00/56/68/324005668.db2.gz LVABDRWHUDKYFP-AVGNSLFASA-N 2 0 242.407 2.120 20 0 BEADRP CC(C)C[C@H](C)C[N@@H+]1C[C@H]2CCC[NH2+][C@H]2C1 ZINC000300987395 188171964 /nfs/dbraw/zinc/17/19/64/188171964.db2.gz VBERXDRECRSPLG-MJBXVCDLSA-N 2 0 224.392 2.352 20 0 BEADRP Cc1ccncc1C[N@H+](C)CCCn1ccnc1 ZINC000271674607 188198934 /nfs/dbraw/zinc/19/89/34/188198934.db2.gz IVTRRQJHZSNLSV-UHFFFAOYSA-N 2 0 244.342 2.109 20 0 BEADRP CC(C)[C@H](C)[NH2+]C1CCC([NH+](C)C)CC1 ZINC000336763801 188174588 /nfs/dbraw/zinc/17/45/88/188174588.db2.gz PPOKQRIMQQQFBG-HIFPTAJRSA-N 2 0 212.381 2.493 20 0 BEADRP C([NH2+][C@H]1CCC12CCC2)[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000337399691 188186758 /nfs/dbraw/zinc/18/67/58/188186758.db2.gz PEZLIFTZOIISPA-JSGCOSHPSA-N 2 0 234.387 2.393 20 0 BEADRP CC[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)C2CCC2)C1 ZINC000336768279 353279416 /nfs/dbraw/zinc/27/94/16/353279416.db2.gz QSIOFSOHALNVRB-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP C1CCC([NH2+][C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)C1 ZINC000251459682 188221009 /nfs/dbraw/zinc/22/10/09/188221009.db2.gz UOQKBALSUKDNER-MGPQQGTHSA-N 2 0 222.376 2.439 20 0 BEADRP C(C1CC1)[NH+]1CCC([NH+]2CCCCC2)CC1 ZINC000336489680 188229775 /nfs/dbraw/zinc/22/97/75/188229775.db2.gz VHTRDWLXBQXFNW-UHFFFAOYSA-N 2 0 222.376 2.347 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+][C@@H]2CCCC[C@H]2O)c2ccccc21 ZINC000252771844 353304020 /nfs/dbraw/zinc/30/40/20/353304020.db2.gz IOQNHHSXIVDSAY-APIJFGDWSA-N 2 0 246.354 2.024 20 0 BEADRP CC[N@@H+]1CCC[C@@H](C[NH2+]C2CC(C)(C)C2)C1 ZINC000336772085 353312198 /nfs/dbraw/zinc/31/21/98/353312198.db2.gz VDFYBAMGSCLKHD-LBPRGKRZSA-N 2 0 224.392 2.497 20 0 BEADRP F[C@@H]1CC[C@H]([NH2+]Cc2cccc3nccn32)C1 ZINC000334502592 353342679 /nfs/dbraw/zinc/34/26/79/353342679.db2.gz FIFADGXPSAVRSQ-MNOVXSKESA-N 2 0 233.290 2.315 20 0 BEADRP Cc1cc(C[N@@H+](C)C2CC[NH2+]CC2)ccc1F ZINC000084534697 353379313 /nfs/dbraw/zinc/37/93/13/353379313.db2.gz RFWBETXLFGEVQZ-UHFFFAOYSA-N 2 0 236.334 2.318 20 0 BEADRP CC[N@@H+]1CCC[C@H](C[NH2+]C[C@@H]2CCSC2)C1 ZINC000336773921 353420560 /nfs/dbraw/zinc/42/05/60/353420560.db2.gz WLNLAMAGYRFKIQ-OLZOCXBDSA-N 2 0 242.432 2.061 20 0 BEADRP CC[NH+](CC)CCC[NH2+]CC1(C)CCC1 ZINC000308979235 491050971 /nfs/dbraw/zinc/05/09/71/491050971.db2.gz JOURJJDWJSZTJE-UHFFFAOYSA-N 2 0 212.381 2.498 20 0 BEADRP CC[C@H]1C[C@@H](C)C[N@@H+]1CCCn1ccnc1 ZINC000343306097 353525466 /nfs/dbraw/zinc/52/54/66/353525466.db2.gz UPDMOSXZSHPAFQ-OLZOCXBDSA-N 2 0 221.348 2.394 20 0 BEADRP CC[N@H+](C)C[C@H]1CCN(C/C=C(/C)Cl)C1 ZINC000528396505 324220425 /nfs/dbraw/zinc/22/04/25/324220425.db2.gz IEPCQZHTWCRWDB-DKRCXCIFSA-N 2 0 230.783 2.403 20 0 BEADRP CCC[N@H+](CC1CC1)C[C@@H]1CC[NH2+][C@@H](C)C1 ZINC000233033263 353788599 /nfs/dbraw/zinc/78/85/99/353788599.db2.gz REMWBNMXUDUQCZ-GXTWGEPZSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@H](C)Cc1ccsc1 ZINC000199999872 363269988 /nfs/dbraw/zinc/26/99/88/363269988.db2.gz NJEDPLGURYKDPS-MWLCHTKSSA-N 2 0 212.362 2.006 20 0 BEADRP C([NH2+]C1CC([NH+]2CCCCC2)C1)C1CC1 ZINC000308924230 188524347 /nfs/dbraw/zinc/52/43/47/188524347.db2.gz CVDILJQFYMZWMH-UHFFFAOYSA-N 2 0 208.349 2.003 20 0 BEADRP CC(C)C[C@H](C)C[C@@H](C)[NH2+]CCC[NH3+] ZINC000308851066 188523159 /nfs/dbraw/zinc/52/31/59/188523159.db2.gz RGWMNOWTMHRVHI-NWDGAFQWSA-N 2 0 200.370 2.386 20 0 BEADRP C[NH+](C)CCC[N@H+](C)C[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000639167194 354048297 /nfs/dbraw/zinc/04/82/97/354048297.db2.gz BNISTLICHCKKLE-MCIONIFRSA-N 2 0 224.392 2.306 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)C1CC(F)(F)C1 ZINC000529548276 324336632 /nfs/dbraw/zinc/33/66/32/324336632.db2.gz KFQZUIFTMAEQBX-MNOVXSKESA-N 2 0 246.345 2.352 20 0 BEADRP CCC[N@H+](CCC[C@@H]1CCO1)CCC[NH+](C)C ZINC000639175106 354191497 /nfs/dbraw/zinc/19/14/97/354191497.db2.gz IOUNHPSAEUWHCM-CQSZACIVSA-N 2 0 242.407 2.219 20 0 BEADRP CC1CC([NH2+]CCC[NH+]2CCCCC2)C1 ZINC000231787189 363352670 /nfs/dbraw/zinc/35/26/70/363352670.db2.gz CGSGGLWLHSSBJE-UHFFFAOYSA-N 2 0 210.365 2.251 20 0 BEADRP CC1CC([NH2+]CC2(C)CC[NH+](C)CC2)C1 ZINC000231790553 363354059 /nfs/dbraw/zinc/35/40/59/363354059.db2.gz FDYMLSMYVALFJZ-UHFFFAOYSA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@](C)(C[N@H+](C)[C@H]1CCN(C)C[C@H]1C)OC ZINC000639179542 354272764 /nfs/dbraw/zinc/27/27/64/354272764.db2.gz UCTSGLMUNNYPBY-HZSPNIEDSA-N 2 0 242.407 2.074 20 0 BEADRP C[C@H]1C[N@H+](CC[C@@H]2CCC[NH+]2C)CCC1(F)F ZINC000334685095 354431148 /nfs/dbraw/zinc/43/11/48/354431148.db2.gz VNEDBJLLOZSNGF-RYUDHWBXSA-N 2 0 246.345 2.448 20 0 BEADRP CC[C@H](C)C[N@H+](C)C[C@@H]1CC[NH2+][C@@H](C)C1 ZINC000233998350 363413623 /nfs/dbraw/zinc/41/36/23/363413623.db2.gz WSMPAVRNPXUQOV-RWMBFGLXSA-N 2 0 212.381 2.352 20 0 BEADRP CC[C@H](C[NH2+][C@H](C)[C@H]1CCCO1)N1CCCC1 ZINC000346468355 354954159 /nfs/dbraw/zinc/95/41/59/354954159.db2.gz AISDELLJPJYLDX-MGPQQGTHSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1)[C@@H]1CCCO1 ZINC000346559512 354968354 /nfs/dbraw/zinc/96/83/54/354968354.db2.gz OOEUZKWYGZFRKV-CRWXNKLISA-N 2 0 240.391 2.016 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1)[C@H]1CCCO1 ZINC000346559517 354968630 /nfs/dbraw/zinc/96/86/30/354968630.db2.gz OOEUZKWYGZFRKV-REWJHTLYSA-N 2 0 240.391 2.016 20 0 BEADRP C[NH+](C)[C@@H]1CCC[N@H+](C[C@@H]2CCSC2)CC1 ZINC000335196467 355029856 /nfs/dbraw/zinc/02/98/56/355029856.db2.gz WHQAXQVMOZSSMG-QWHCGFSZSA-N 2 0 242.432 2.156 20 0 BEADRP C[NH+](C)[C@H]1CCC[N@H+](C[C@@H]2CCSC2)CC1 ZINC000335196475 355029871 /nfs/dbraw/zinc/02/98/71/355029871.db2.gz WHQAXQVMOZSSMG-STQMWFEESA-N 2 0 242.432 2.156 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]CC1CCCC1 ZINC000335197962 355031036 /nfs/dbraw/zinc/03/10/36/355031036.db2.gz RIKKWLSXBRQXPC-OLZOCXBDSA-N 2 0 210.365 2.426 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]CC1CCCC1 ZINC000335197961 355031405 /nfs/dbraw/zinc/03/14/05/355031405.db2.gz RIKKWLSXBRQXPC-CHWSQXEVSA-N 2 0 210.365 2.426 20 0 BEADRP CN(C)c1ccccc1C[N@H+](C)CC(C)(C)C[NH3+] ZINC000346692973 355076373 /nfs/dbraw/zinc/07/63/73/355076373.db2.gz KDKPNLBHBXXXME-UHFFFAOYSA-N 2 0 249.402 2.169 20 0 BEADRP C[N@H+](CCCc1ccccc1)CC(C)(C)[NH3+] ZINC000346821019 355124963 /nfs/dbraw/zinc/12/49/63/355124963.db2.gz KQSHZTBCHHNYKR-UHFFFAOYSA-N 2 0 220.360 2.288 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@H](C)[C@H]2C[C@H]2C)CC1 ZINC000321645037 491074413 /nfs/dbraw/zinc/07/44/13/491074413.db2.gz VCADHACBDOTYQR-BZPMIXESSA-N 2 0 224.392 2.352 20 0 BEADRP CC(C)([NH3+])C[N@@H+]1CC[C@H](Cc2ccccc2)C1 ZINC000346848849 355138009 /nfs/dbraw/zinc/13/80/09/355138009.db2.gz OHYXVMRIIMSYMF-CQSZACIVSA-N 2 0 232.371 2.288 20 0 BEADRP Fc1cccc(C2([NH2+]CC3CC[NH2+]CC3)CC2)c1 ZINC000346972468 355208295 /nfs/dbraw/zinc/20/82/95/355208295.db2.gz HOXMRAMNPUPZPF-UHFFFAOYSA-N 2 0 248.345 2.404 20 0 BEADRP C[C@H]1Cc2ccccc2C[N@@H+]1C[C@H]1CCC[NH2+]C1 ZINC000346975485 355209089 /nfs/dbraw/zinc/20/90/89/355209089.db2.gz JEOZXBLISFPACL-KBPBESRZSA-N 2 0 244.382 2.433 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCc2c1cccc2F)C1C[NH2+]C1 ZINC000335257367 355193448 /nfs/dbraw/zinc/19/34/48/355193448.db2.gz GDJJQVROGOYNKV-LKFCYVNXSA-N 2 0 234.318 2.011 20 0 BEADRP C[C@@H]1C[N@H+](C[C@@H]2CCC[NH2+]C2)[C@@H]2CCCC[C@@H]21 ZINC000347008690 355202313 /nfs/dbraw/zinc/20/23/13/355202313.db2.gz RVOZTYNRKJMBFL-KBUPBQIOSA-N 2 0 236.403 2.497 20 0 BEADRP CCSCC[C@@H](C)[N@H+](C)C[C@H]1CCC[NH2+]C1 ZINC000347012159 355204419 /nfs/dbraw/zinc/20/44/19/355204419.db2.gz UUSFBSJTNKRNJK-OLZOCXBDSA-N 2 0 244.448 2.450 20 0 BEADRP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)[C@H]1CC1(F)F ZINC000639245730 355275008 /nfs/dbraw/zinc/27/50/08/355275008.db2.gz BDXPBJKEAAFUSQ-RIEIUKCASA-N 2 0 244.329 2.245 20 0 BEADRP C[C@@H]1CC2(C[N@@H+]1Cc1cccnc1)CC[NH2+]CC2 ZINC000335281421 355271969 /nfs/dbraw/zinc/27/19/69/355271969.db2.gz PYWZRYGCJDPEDN-CYBMUJFWSA-N 2 0 245.370 2.046 20 0 BEADRP C[C@H]1CC2(C[N@@H+]1Cc1cccnc1)CC[NH2+]CC2 ZINC000335281423 355272097 /nfs/dbraw/zinc/27/20/97/355272097.db2.gz PYWZRYGCJDPEDN-ZDUSSCGKSA-N 2 0 245.370 2.046 20 0 BEADRP C[C@H]1C[C@H]([NH2+]Cc2ccc3c[nH+]cn3c2)CS1 ZINC000639257220 355301754 /nfs/dbraw/zinc/30/17/54/355301754.db2.gz RPHUHHZVBHULPW-JQWIXIFHSA-N 2 0 247.367 2.318 20 0 BEADRP CCC[C@@H](C[NH2+]Cc1ccc2c[nH+]cn2c1)OC ZINC000639257448 355301825 /nfs/dbraw/zinc/30/18/25/355301825.db2.gz UFZZQVYWKBGLEH-AWEZNQCLSA-N 2 0 247.342 2.239 20 0 BEADRP CC[C@](C)(C[NH2+]Cc1ccc2c[nH+]cn2c1)OC ZINC000639257363 355302832 /nfs/dbraw/zinc/30/28/32/355302832.db2.gz SUDFKBHWUIUBGZ-CQSZACIVSA-N 2 0 247.342 2.239 20 0 BEADRP CC[C@](C)(C[NH2+]CC[C@@H]1CCC[N@H+](C)C1)OC ZINC000639258128 355305035 /nfs/dbraw/zinc/30/50/35/355305035.db2.gz ZWRVMHPHBFYMFM-UONOGXRCSA-N 2 0 242.407 2.123 20 0 BEADRP CC[NH+](CC)CCOCC[NH2+][C@H]1CC[C@H](C)C1 ZINC000349698007 355413669 /nfs/dbraw/zinc/41/36/69/355413669.db2.gz XGSLGOXABVLFBI-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)(C)C[N@@H+]1CCC[C@@H]([C@@H]2CC[NH2+]C2)C1 ZINC000414783748 191567501 /nfs/dbraw/zinc/56/75/01/191567501.db2.gz QMJOFFZZXNFTGM-CHWSQXEVSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+]C[C@H]1CCC[NH2+]1 ZINC000414820345 191582333 /nfs/dbraw/zinc/58/23/33/191582333.db2.gz AMUJHORBCOENIZ-RKDXNWHRSA-N 2 0 224.270 2.059 20 0 BEADRP CCCC[C@H](COC)[NH2+][C@H](C)[C@H]1CCC[NH2+]C1 ZINC000414823775 191585660 /nfs/dbraw/zinc/58/56/60/191585660.db2.gz PJOHSRSCFPTQPO-HZSPNIEDSA-N 2 0 242.407 2.169 20 0 BEADRP CC(C)[C@@H]1CCC[C@@H]1[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000414825553 191587013 /nfs/dbraw/zinc/58/70/13/191587013.db2.gz COKPPFNMJYYVLR-RDBSUJKOSA-N 2 0 224.392 2.400 20 0 BEADRP CCC[C@H](CC)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000414827419 191589533 /nfs/dbraw/zinc/58/95/33/191589533.db2.gz KQLVJQJMRNIQEA-ACJTYDJDSA-N 2 0 210.365 2.438 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]Cc1cccc(C)c1C ZINC000414835918 191594726 /nfs/dbraw/zinc/59/47/26/191594726.db2.gz ISQFVGZAQJJTIA-NSHDSACASA-N 2 0 220.360 2.249 20 0 BEADRP CC[C@@H](Cc1ccccc1)[NH2+]C[C@H]1CCC[NH2+]1 ZINC000414841892 191597087 /nfs/dbraw/zinc/59/70/87/191597087.db2.gz IFSIESOFPUGREP-LSDHHAIUSA-N 2 0 232.371 2.349 20 0 BEADRP Cc1ccsc1C[NH2+][C@H]1CC[C@@H](C[NH3+])C1 ZINC000415032293 191657427 /nfs/dbraw/zinc/65/74/27/191657427.db2.gz HYFVZXCYLJTBSC-MNOVXSKESA-N 2 0 224.373 2.274 20 0 BEADRP CCCC[C@H](COC)[NH2+]C[C@@H]1CCC[C@H]([NH3+])C1 ZINC000415005116 191647401 /nfs/dbraw/zinc/64/74/01/191647401.db2.gz OYBOGVUARCLIBU-HZSPNIEDSA-N 2 0 242.407 2.299 20 0 BEADRP CCOc1ccc(C[NH2+][C@@H]2CC[C@H](C[NH3+])C2)cc1 ZINC000415029944 191657513 /nfs/dbraw/zinc/65/75/13/191657513.db2.gz FDSBXTXJIAMHHE-UONOGXRCSA-N 2 0 248.370 2.302 20 0 BEADRP CC(C)C[C@H](C)C[NH2+][C@H](C)CCC[NH3+] ZINC000415025737 191656357 /nfs/dbraw/zinc/65/63/57/191656357.db2.gz RMQCNHLMXCZTPB-NWDGAFQWSA-N 2 0 200.370 2.386 20 0 BEADRP C[C@H](CCC1CC1)[NH2+][C@@H]1CC[C@@H](C[NH3+])C1 ZINC000415033151 191657694 /nfs/dbraw/zinc/65/76/94/191657694.db2.gz IQJPQBOMVXDZLZ-RAIGVLPGSA-N 2 0 210.365 2.282 20 0 BEADRP C[NH2+]Cc1cccc(N[C@H](C)C[C@H]2CCC[NH2+]2)c1 ZINC000414869485 191608319 /nfs/dbraw/zinc/60/83/19/191608319.db2.gz QXCUYJXLRYQRHH-TZMCWYRMSA-N 2 0 247.386 2.349 20 0 BEADRP C[NH2+]Cc1cccc(NC[C@H]2CC[NH2+][C@H](C)C2)c1 ZINC000414874711 191610712 /nfs/dbraw/zinc/61/07/12/191610712.db2.gz YYFINYGUDQCIHT-OCCSQVGLSA-N 2 0 247.386 2.206 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H]1CCCC[C@@H]1C1CC1 ZINC000414881051 191613517 /nfs/dbraw/zinc/61/35/17/191613517.db2.gz RWDUEMARWQFVED-RAIGVLPGSA-N 2 0 210.365 2.140 20 0 BEADRP Cc1cc(C[NH2+][C@H]2CC[C@H](C[NH3+])C2)ccc1F ZINC000415027011 191657055 /nfs/dbraw/zinc/65/70/55/191657055.db2.gz APEMPNHTHVSNKN-AAEUAGOBSA-N 2 0 236.334 2.351 20 0 BEADRP C[C@@H]1CC2(C[N@@H+]1CC1(C)CC1)CC[NH2+]CC2 ZINC000583559178 355610100 /nfs/dbraw/zinc/61/01/00/355610100.db2.gz JAWZETUXQNMVBU-GFCCVEGCSA-N 2 0 222.376 2.251 20 0 BEADRP CC(C)[C@H]1C[N@H+](C[C@H]2CCC[NH2+]C2)CCS1 ZINC000335837726 355566822 /nfs/dbraw/zinc/56/68/22/355566822.db2.gz NYCBVLMCRPBMAQ-QWHCGFSZSA-N 2 0 242.432 2.059 20 0 BEADRP C[C@@H]1C[C@@H](C[NH2+]CCc2ccccc2)CC[NH2+]1 ZINC000415078737 191671678 /nfs/dbraw/zinc/67/16/78/191671678.db2.gz GWHAWWBSUBFZCM-HIFRSBDPSA-N 2 0 232.371 2.207 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCN1C(C)(C)C)[C@@H]1CC1(F)F ZINC000639302787 355650459 /nfs/dbraw/zinc/65/04/59/355650459.db2.gz ITPPYNBYSDEHCR-AXFHLTTASA-N 2 0 246.345 2.493 20 0 BEADRP CCCN1CCC[C@@H]1C[NH2+][C@H](C)CCCOC ZINC000353986615 355748010 /nfs/dbraw/zinc/74/80/10/355748010.db2.gz JZTGXDZHBUIQAE-ZIAGYGMSSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCCC[N@H+](C)C2)CS1 ZINC000639346599 355793111 /nfs/dbraw/zinc/79/31/11/355793111.db2.gz HMKUZJWSOYHEFS-FRRDWIJNSA-N 2 0 242.432 2.202 20 0 BEADRP Cc1cccc2c1CC[C@H]2[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000583625049 355893677 /nfs/dbraw/zinc/89/36/77/355893677.db2.gz AHPUFHWMKFOAFA-XHDPSFHLSA-N 2 0 230.355 2.180 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+]CC2(C)CC2)C1 ZINC000309063707 355988924 /nfs/dbraw/zinc/98/89/24/355988924.db2.gz YEFRHUOXKZKEBR-LBPRGKRZSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@@H]1C[C@H]1C[N@@H+]1CC[C@H](Oc2ccncc2)C1 ZINC000351471953 355996189 /nfs/dbraw/zinc/99/61/89/355996189.db2.gz NIIQRMBMUPKVHS-DYEKYZERSA-N 2 0 232.327 2.191 20 0 BEADRP C[C@H]1C[N@H+](CCCc2ccsc2)CC[C@H]1[NH3+] ZINC000420296020 192204534 /nfs/dbraw/zinc/20/45/34/192204534.db2.gz WLBHZYFXJWROCO-WCQYABFASA-N 2 0 238.400 2.350 20 0 BEADRP CCCC[N@H+](CCOC)CC[C@H]1CCC[NH2+]C1 ZINC000420298176 192204942 /nfs/dbraw/zinc/20/49/42/192204942.db2.gz GYDTYAUQUFRVCB-CQSZACIVSA-N 2 0 242.407 2.125 20 0 BEADRP C[C@@H]([NH3+])C[N@@H+]1CCC[C@@H]1CCc1ccccc1 ZINC000420297421 192204983 /nfs/dbraw/zinc/20/49/83/192204983.db2.gz DIIBBELAXOBEGU-UKRRQHHQSA-N 2 0 232.371 2.431 20 0 BEADRP CC[N@H+](CC[C@@H]1CC[NH2+]C1)[C@H](C)C(C)C ZINC000420295763 192205788 /nfs/dbraw/zinc/20/57/88/192205788.db2.gz CQJMFDHACRFTMD-OLZOCXBDSA-N 2 0 212.381 2.352 20 0 BEADRP CC[N@H+](CC[C@H]1CCC[NH2+]C1)C1CCC1 ZINC000420302527 192206834 /nfs/dbraw/zinc/20/68/34/192206834.db2.gz MLKUEKFPEDKORV-GFCCVEGCSA-N 2 0 210.365 2.251 20 0 BEADRP CC[N@H+](CC[C@@H]1CCCO1)[C@H]1CCC[NH2+]CC1 ZINC000420300988 192206940 /nfs/dbraw/zinc/20/69/40/192206940.db2.gz ABEHWVCBGQZIDF-KBPBESRZSA-N 2 0 240.391 2.020 20 0 BEADRP C[NH+](C)[C@@H]1CCC[N@H+](CC2CCC2)CC1 ZINC000336120951 134091155 /nfs/dbraw/zinc/09/11/55/134091155.db2.gz GJAFYROZJUEDIZ-CYBMUJFWSA-N 2 0 210.365 2.203 20 0 BEADRP C[C@H]1C[C@H](C[NH3+])C[N@@H+]1CCCc1ccsc1 ZINC000420316219 192213316 /nfs/dbraw/zinc/21/33/16/192213316.db2.gz LTTGZTURKISMBO-WCQYABFASA-N 2 0 238.400 2.350 20 0 BEADRP CCc1cccc(C[N@@H+]2CC[C@@]3(CC[NH2+]C3)C2)c1 ZINC000420315724 192213405 /nfs/dbraw/zinc/21/34/05/192213405.db2.gz XIAJKKYEFDQQPI-MRXNPFEDSA-N 2 0 244.382 2.434 20 0 BEADRP CCCC[N@@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1 ZINC000420334283 192214023 /nfs/dbraw/zinc/21/40/23/192214023.db2.gz GBIJBCCDZWIECC-OLZOCXBDSA-N 2 0 210.365 2.108 20 0 BEADRP C[N@H+](CC[C@H]1CCCCO1)[C@H]1CCC[NH2+]CC1 ZINC000420318414 192214286 /nfs/dbraw/zinc/21/42/86/192214286.db2.gz WBEQBIYRLQOHTG-UONOGXRCSA-N 2 0 240.391 2.020 20 0 BEADRP [NH3+]CC1CCC([NH2+]CC2CCCC2)CC1 ZINC000422895782 192500501 /nfs/dbraw/zinc/50/05/01/192500501.db2.gz GPFPEQZBKNCSHF-UHFFFAOYSA-N 2 0 210.365 2.284 20 0 BEADRP CCCC[N@@H+]1CCC[C@@H]([C@@H]2CC[NH2+]C2)C1 ZINC000420334282 192215270 /nfs/dbraw/zinc/21/52/70/192215270.db2.gz GBIJBCCDZWIECC-CHWSQXEVSA-N 2 0 210.365 2.108 20 0 BEADRP [NH3+]C1(C[NH2+]CCCCC2CCOCC2)CCC1 ZINC000420301541 192207553 /nfs/dbraw/zinc/20/75/53/192207553.db2.gz FFLATQCYHUZGKE-UHFFFAOYSA-N 2 0 240.391 2.054 20 0 BEADRP [NH3+]CC[C@H]1CCCC[N@@H+]1CC[C@@H]1CCCCO1 ZINC000420307713 192208446 /nfs/dbraw/zinc/20/84/46/192208446.db2.gz CDTUGCHEWSGGHJ-KGLIPLIRSA-N 2 0 240.391 2.149 20 0 BEADRP COc1ccc([C@@H](C[NH3+])C[N@@H+]2CCC[C@H]2C)cc1 ZINC000420306612 192208901 /nfs/dbraw/zinc/20/89/01/192208901.db2.gz QNBBTOONRRNWPM-OCCSQVGLSA-N 2 0 248.370 2.222 20 0 BEADRP C[N@H+](CC[C@H]1CCC[NH2+]C1)C(C1CC1)C1CC1 ZINC000420304833 192209409 /nfs/dbraw/zinc/20/94/09/192209409.db2.gz OSKZJSLGFMCXLS-GFCCVEGCSA-N 2 0 236.403 2.497 20 0 BEADRP CO[C@H](C)C[N@H+](CC[C@H]1CCC[NH2+]C1)C(C)C ZINC000420307610 192209421 /nfs/dbraw/zinc/20/94/21/192209421.db2.gz RNVPFAFZGIYJSK-ZIAGYGMSSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H]1CCC[C@@H](C)[N@H+](CC[C@H]2CC[NH2+]C2)C1 ZINC000420305663 192209536 /nfs/dbraw/zinc/20/95/36/192209536.db2.gz PTKXXBMWMFZTJU-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]([NH3+])C[N@@H+]1CC[C@@H](Cc2ccccc2)[C@H]1C ZINC000420310950 192210428 /nfs/dbraw/zinc/21/04/28/192210428.db2.gz VMAGIFXIGLEBBK-GUTXKFCHSA-N 2 0 232.371 2.287 20 0 BEADRP Cc1ccc(C[N@@H+]2CCCC[C@@H]2CC[NH3+])c(C)n1 ZINC000420308302 192211505 /nfs/dbraw/zinc/21/15/05/192211505.db2.gz CWUXTVUSNAMSGJ-OAHLLOKOSA-N 2 0 247.386 2.402 20 0 BEADRP CCc1cccc(C[N@@H+]2CC[C@H]3C[NH2+]C[C@@H]3C2)c1 ZINC000420314915 192212500 /nfs/dbraw/zinc/21/25/00/192212500.db2.gz LRGRCELNJNUTQJ-JKSUJKDBSA-N 2 0 244.382 2.290 20 0 BEADRP CCc1cccc(C[N@H+](C)C2CC([NH3+])C2)c1 ZINC000420323979 192228155 /nfs/dbraw/zinc/22/81/55/192228155.db2.gz BVBIHQOCNWGLOI-UHFFFAOYSA-N 2 0 218.344 2.171 20 0 BEADRP CC(C)(C)CCC[N@@H+]1CCNC[C@@](C)(F)C1 ZINC000420329598 192229392 /nfs/dbraw/zinc/22/93/92/192229392.db2.gz JZLZEPDZSMGOSU-CYBMUJFWSA-N 2 0 230.371 2.446 20 0 BEADRP Cc1ccccc1CCC[N@@H+](C)C1CC([NH3+])C1 ZINC000420327021 192230665 /nfs/dbraw/zinc/23/06/65/192230665.db2.gz GESXFDSKFRZNIT-UHFFFAOYSA-N 2 0 232.371 2.349 20 0 BEADRP CC(C)[C@H]([NH2+]C[C@@H](C)[NH3+])c1ccccc1 ZINC000420382893 192234989 /nfs/dbraw/zinc/23/49/89/192234989.db2.gz YYYQCQXHWOLZLA-YPMHNXCESA-N 2 0 206.333 2.321 20 0 BEADRP Cc1ccc(CC[N@H+]2CC[C@@H](C)[C@@H](C[NH3+])C2)cc1 ZINC000420408094 192238888 /nfs/dbraw/zinc/23/88/88/192238888.db2.gz OWXZEAQXPHNQEF-ZBFHGGJFSA-N 2 0 246.398 2.454 20 0 BEADRP C[C@@H]([NH3+])C[NH2+][C@@H](C)C(C)(C)c1ccccc1 ZINC000420411524 192239834 /nfs/dbraw/zinc/23/98/34/192239834.db2.gz RTDGAHDIGOZBKI-NEPJUHHUSA-N 2 0 220.360 2.290 20 0 BEADRP CC(C)CC[C@H]1CCC[C@@H]1[NH2+]CCOCC[NH3+] ZINC000420417312 192240387 /nfs/dbraw/zinc/24/03/87/192240387.db2.gz WIVFRPFLJZHNED-KGLIPLIRSA-N 2 0 242.407 2.156 20 0 BEADRP CC(C)[C@@H]1CCCC[C@H]1[NH2+]C[C@@H]1CC[NH2+]C1 ZINC000420421205 192242448 /nfs/dbraw/zinc/24/24/48/192242448.db2.gz YNJXKJMFQJOALK-HZSPNIEDSA-N 2 0 224.392 2.400 20 0 BEADRP CCCC[NH+]1CCC([C@H]2OCCC[C@@H]2[NH3+])CC1 ZINC000420374623 192231560 /nfs/dbraw/zinc/23/15/60/192231560.db2.gz HPWYUXWLPGTTHA-UONOGXRCSA-N 2 0 240.391 2.005 20 0 BEADRP Cc1cc(C)c(C[N@@H+]2CCC[C@@](C)(O)C2)c(C)n1 ZINC000639556290 356459304 /nfs/dbraw/zinc/45/93/04/356459304.db2.gz YJQMVZVZFAEDFO-OAHLLOKOSA-N 2 0 248.370 2.354 20 0 BEADRP [NH3+]C1CCC([NH2+][C@H]2CCC[C@@H]2C2CC2)CC1 ZINC000336165710 134113145 /nfs/dbraw/zinc/11/31/45/134113145.db2.gz VGASIBRIFFOXQS-PQAZSJQKSA-N 2 0 222.376 2.425 20 0 BEADRP c1cc(N2CCC[N@@H+](CCC3CC3)CC2)cc[nH+]1 ZINC000639683195 356593689 /nfs/dbraw/zinc/59/36/89/356593689.db2.gz ROERKDJELJLXNT-UHFFFAOYSA-N 2 0 245.370 2.394 20 0 BEADRP CC(C)CC(C)(C)C[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000422922591 192507099 /nfs/dbraw/zinc/50/70/99/192507099.db2.gz UCOAVTNUVNUXET-NSHDSACASA-N 2 0 212.381 2.256 20 0 BEADRP CCC[C@@H](C)C[NH+]1CCC(C[NH2+]C)CC1 ZINC000051756233 535326570 /nfs/dbraw/zinc/32/65/70/535326570.db2.gz WCPPSLQUJHXVQI-GFCCVEGCSA-N 2 0 212.381 2.354 20 0 BEADRP CC(C)(CO)CCC[NH2+][C@H]1CCCCC[C@@H]1[NH3+] ZINC000423006414 192535913 /nfs/dbraw/zinc/53/59/13/192535913.db2.gz OPINTHXFXASKAY-STQMWFEESA-N 2 0 242.407 2.035 20 0 BEADRP C[C@@H]([NH2+]C1CCC(C[NH3+])CC1)[C@@H]1CCCCO1 ZINC000423041004 192550202 /nfs/dbraw/zinc/55/02/02/192550202.db2.gz IHVSVMMKNFOHCG-RYSNWHEDSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@H]1CCC12CCCC2 ZINC000423073262 192559961 /nfs/dbraw/zinc/55/99/61/192559961.db2.gz IICBVBKIZXCZIA-RYUDHWBXSA-N 2 0 210.365 2.426 20 0 BEADRP CCC[N@@H+]1CC[C@H](CNc2cc[nH+]c(CC)c2)C1 ZINC000450272333 202115606 /nfs/dbraw/zinc/11/56/06/202115606.db2.gz BGJNYBNNCRKACD-CYBMUJFWSA-N 2 0 247.386 2.210 20 0 BEADRP CSCCCCC[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000423056065 192554235 /nfs/dbraw/zinc/55/42/35/192554235.db2.gz WWYUWMLNWQNJQT-QWRGUYRKSA-N 2 0 218.410 2.235 20 0 BEADRP CC[C@@H](C)[N@@H+]1CCC2(C1)CC[NH+](C)CC2 ZINC000639756256 356660680 /nfs/dbraw/zinc/66/06/80/356660680.db2.gz TUHJPGNBXDDEOM-GFCCVEGCSA-N 2 0 210.365 2.203 20 0 BEADRP C[C@H]1CC[N@H+](Cc2ccsc2)C[C@@H]1C[NH3+] ZINC000167604273 134152923 /nfs/dbraw/zinc/15/29/23/134152923.db2.gz XKBUNVDUFAERAO-JQWIXIFHSA-N 2 0 224.373 2.165 20 0 BEADRP CCc1cc(N(C)C[C@@H]2CCC[N@H+](C)C2)cc[nH+]1 ZINC000450333630 202131806 /nfs/dbraw/zinc/13/18/06/202131806.db2.gz QJLPMJXSXXSSDQ-CYBMUJFWSA-N 2 0 247.386 2.422 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CCC[C@@H](C)[C@H]1C)C1C[NH2+]C1 ZINC000423101639 192568768 /nfs/dbraw/zinc/56/87/68/192568768.db2.gz WEFRXSNJZQOQKI-FDYHWXHSSA-N 2 0 224.392 2.256 20 0 BEADRP C[C@H]1C[C@@H]1C[N@@H+]1CCC2(C1)CC[NH+](C)CC2 ZINC000639757071 356663652 /nfs/dbraw/zinc/66/36/52/356663652.db2.gz FANOKISXSYABJS-QWHCGFSZSA-N 2 0 222.376 2.060 20 0 BEADRP Cc1ccc(CC[NH2+][C@H]2CCCCC[C@H]2[NH3+])cn1 ZINC000563951294 356664631 /nfs/dbraw/zinc/66/46/31/356664631.db2.gz XUXHHLIASPAJBJ-CABCVRRESA-N 2 0 247.386 2.182 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CCC(F)(F)C1 ZINC000423095819 192565163 /nfs/dbraw/zinc/56/51/63/192565163.db2.gz NBZPZLWTEIQICK-DCAQKATOSA-N 2 0 232.318 2.139 20 0 BEADRP COCC[C@H]([NH2+][C@H](C)[C@@H]1CC[NH2+]C1)C(C)(C)C ZINC000423116575 192574519 /nfs/dbraw/zinc/57/45/19/192574519.db2.gz QLEYDPLXJDHKNJ-UPJWGTAASA-N 2 0 242.407 2.025 20 0 BEADRP [NH3+]CC1CCC([NH2+]CC2CC(F)(F)C2)CC1 ZINC000423123199 192575033 /nfs/dbraw/zinc/57/50/33/192575033.db2.gz DKUOQODBKVCRKG-UHFFFAOYSA-N 2 0 232.318 2.139 20 0 BEADRP CC(C)[C@H](C)[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000130158941 325019693 /nfs/dbraw/zinc/01/96/93/325019693.db2.gz YZWZUEDYMBGUHJ-YNEHKIRRSA-N 2 0 210.365 2.247 20 0 BEADRP CC(C)CC[N@@H+]1CCC2(C1)CC[NH+](C)CC2 ZINC000639758538 356668726 /nfs/dbraw/zinc/66/87/26/356668726.db2.gz ULMMJJWYDNJBMI-UHFFFAOYSA-N 2 0 224.392 2.450 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+]CCc2ccccn2)CC1(C)C ZINC000623336602 356724779 /nfs/dbraw/zinc/72/47/79/356724779.db2.gz ZFAYUOVVQDSOGJ-CQSZACIVSA-N 2 0 247.386 2.087 20 0 BEADRP C[N@H+](CC1CC(F)(F)C1)C[C@@H]1CCC[NH+](C)C1 ZINC000450430637 202165826 /nfs/dbraw/zinc/16/58/26/202165826.db2.gz UAVKROHUMJEIFT-LLVKDONJSA-N 2 0 246.345 2.305 20 0 BEADRP CC[C@H]([NH2+][C@H]1C[C@@H](OC(C)C)C1)[C@@H]1CCC[NH2+]1 ZINC000423162379 192598594 /nfs/dbraw/zinc/59/85/94/192598594.db2.gz KXDZCFROJBUGTI-CRWXNKLISA-N 2 0 240.391 2.063 20 0 BEADRP CC[C@]1(C(C)C)C[C@@H]1[NH2+][C@H](CCC[NH3+])COC ZINC000423160955 192599415 /nfs/dbraw/zinc/59/94/15/192599415.db2.gz IDGNBQGQQRNLST-HZSPNIEDSA-N 2 0 242.407 2.155 20 0 BEADRP C([C@@H]1CCCC[NH2+]C1)[NH+]1CCCCCC1 ZINC000257651212 538740136 /nfs/dbraw/zinc/74/01/36/538740136.db2.gz GAKLNLFHTKMVHK-CYBMUJFWSA-N 2 0 210.365 2.252 20 0 BEADRP C[C@@H](C[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1)C1CC1 ZINC000623375492 356894759 /nfs/dbraw/zinc/89/47/59/356894759.db2.gz PZFTWUNHJZWXSK-AAEUAGOBSA-N 2 0 224.392 2.495 20 0 BEADRP CCCCOCC[NH2+][C@H]1CC[N@H+](CC)C[C@@H]1C ZINC000119592431 357029005 /nfs/dbraw/zinc/02/90/05/357029005.db2.gz SLKJOVXCXFVEHJ-KBPBESRZSA-N 2 0 242.407 2.123 20 0 BEADRP CC[C@H]([NH2+]CC[C@@H](C)[NH3+])c1ccccc1OC ZINC000423223663 192635554 /nfs/dbraw/zinc/63/55/54/192635554.db2.gz HBCHXQAZKFLLJM-YPMHNXCESA-N 2 0 236.359 2.473 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+]CC1CCCCCC1 ZINC000389656907 357011461 /nfs/dbraw/zinc/01/14/61/357011461.db2.gz SFBKEUMRNBARFU-AWEZNQCLSA-N 2 0 242.407 2.300 20 0 BEADRP C[C@H]1CCN(CC[NH2+][C@H]2CCCC2(C)C)C1 ZINC000390653475 357109305 /nfs/dbraw/zinc/10/93/05/357109305.db2.gz PYQHRUVJOAUKKR-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP C(C[C@H]1CC[NH2+]C1)[NH2+][C@@H]1CCCC12CCC2 ZINC000423245481 192648488 /nfs/dbraw/zinc/64/84/88/192648488.db2.gz JAJHSXVTQRBDAK-CHWSQXEVSA-N 2 0 222.376 2.298 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000389985076 357079146 /nfs/dbraw/zinc/07/91/46/357079146.db2.gz LQOQQENCGBIGTI-UPJWGTAASA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@@H]([NH2+]CC[C@H]1CCC[NH2+]C1)C1CC1 ZINC000423256069 192654576 /nfs/dbraw/zinc/65/45/76/192654576.db2.gz DIODFGCOEBYHGQ-DGCLKSJQSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H]([NH2+]Cc1ccc(C[NH3+])cc1)C1CCC1 ZINC000582421020 357143826 /nfs/dbraw/zinc/14/38/26/357143826.db2.gz SIDVJBWLHBEQJX-NSHDSACASA-N 2 0 218.344 2.424 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)C(C)(C)C ZINC000423261915 192658052 /nfs/dbraw/zinc/65/80/52/192658052.db2.gz TYAZJGGPCBPWBW-NEPJUHHUSA-N 2 0 212.381 2.400 20 0 BEADRP CC(C)[C@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1cccnc1 ZINC000423243885 192649468 /nfs/dbraw/zinc/64/94/68/192649468.db2.gz GSQYGRZCUIMTFZ-HIFRSBDPSA-N 2 0 247.386 2.368 20 0 BEADRP Fc1ccc2c(c1)CC[C@H]2[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000423249261 192652023 /nfs/dbraw/zinc/65/20/23/192652023.db2.gz OITSFVJRALOYFC-XHDPSFHLSA-N 2 0 248.345 2.402 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000423264420 192658804 /nfs/dbraw/zinc/65/88/04/192658804.db2.gz YSVDLPZCFPZMPJ-KBPBESRZSA-N 2 0 247.386 2.430 20 0 BEADRP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]CC1CC(C)(C)C1 ZINC000393802926 357300149 /nfs/dbraw/zinc/30/01/49/357300149.db2.gz UPCRDYUVFNVJHH-WCQYABFASA-N 2 0 224.392 2.352 20 0 BEADRP CO[C@H](C)[C@H](C)[NH2+]Cc1ccc([C@@H](C)[NH3+])cc1 ZINC000423296446 192684907 /nfs/dbraw/zinc/68/49/07/192684907.db2.gz ZGNPQJFNZNEWLP-GRYCIOLGSA-N 2 0 236.359 2.219 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[C@@H](C)O[C@@H](C)C1)[C@H]1CCCC[NH2+]1 ZINC000582480737 357316877 /nfs/dbraw/zinc/31/68/77/357316877.db2.gz SPPVTESGEFCQHW-XVIXHAIJSA-N 2 0 240.391 2.063 20 0 BEADRP CC[C@H]([NH2+]CC1CC[NH2+]CC1)[C@@H]1C[C@H]1C ZINC000582540532 357338324 /nfs/dbraw/zinc/33/83/24/357338324.db2.gz SRJSSEWORPFYSQ-RTXFEEFZSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@H]([NH2+]CC(C)(C)[NH3+])C1C(C)(C)C1(C)C ZINC000423288545 192680875 /nfs/dbraw/zinc/68/08/75/192680875.db2.gz SRPXJLOPNZCLNI-VIFPVBQESA-N 2 0 212.381 2.384 20 0 BEADRP CC[C@H]([NH2+][C@H]1CCC[C@H](F)C1)[C@@H]1CCC[NH2+]1 ZINC000582606937 357349335 /nfs/dbraw/zinc/34/93/35/357349335.db2.gz ZZPPBYXOJVSCQQ-CYDGBPFRSA-N 2 0 228.355 2.387 20 0 BEADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H](C)[C@@H]2CCOC2)cc1 ZINC000423292776 192681842 /nfs/dbraw/zinc/68/18/42/192681842.db2.gz OJOAYWXUFSZLET-SLEUVZQESA-N 2 0 248.370 2.221 20 0 BEADRP C[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1)c1ccncc1 ZINC000582667165 357358500 /nfs/dbraw/zinc/35/85/00/357358500.db2.gz XSDMFBIKEQAWSA-GFCCVEGCSA-N 2 0 241.338 2.391 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]C1CC(C)(C)C1 ZINC000395193028 357416677 /nfs/dbraw/zinc/41/66/77/357416677.db2.gz ZCSATZOTOPTCNG-NQBHXWOUSA-N 2 0 224.392 2.493 20 0 BEADRP CC(F)(F)CC[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000583064806 357472189 /nfs/dbraw/zinc/47/21/89/357472189.db2.gz IUSIQOCRNMCCKV-UHFFFAOYSA-N 2 0 246.345 2.496 20 0 BEADRP CC[NH+]1CCC([NH2+]CC(C)(C)CCOC)CC1 ZINC000230896068 357578289 /nfs/dbraw/zinc/57/82/89/357578289.db2.gz CHBAFUSZBAGVLW-UHFFFAOYSA-N 2 0 242.407 2.123 20 0 BEADRP Cc1ccc(C[N@H+](C)CCC[NH3+])c(C)c1 ZINC000106887123 363586658 /nfs/dbraw/zinc/58/66/58/363586658.db2.gz YQZZQOKOTHSHOU-UHFFFAOYSA-N 2 0 206.333 2.084 20 0 BEADRP Cc1c[nH+]ccc1N1CC[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000191981518 357818606 /nfs/dbraw/zinc/81/86/06/357818606.db2.gz GURQRSSYGSKYPR-OLZOCXBDSA-N 2 0 231.343 2.063 20 0 BEADRP Cc1c[nH+]ccc1N1CC[C@@H]([NH+]2CCCC2)C1 ZINC000191980377 357818694 /nfs/dbraw/zinc/81/86/94/357818694.db2.gz MZYDOBOWVDMASP-CYBMUJFWSA-N 2 0 231.343 2.065 20 0 BEADRP CSC1(C[NH2+]CC2CC[NH+](C)CC2)CCC1 ZINC000235227550 357858224 /nfs/dbraw/zinc/85/82/24/357858224.db2.gz SYFLSDNAHDYKTB-UHFFFAOYSA-N 2 0 242.432 2.204 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+][C@@H](C)CCC(C)C ZINC000234799804 357828669 /nfs/dbraw/zinc/82/86/69/357828669.db2.gz ZTKZJIXWPITSOF-STQMWFEESA-N 2 0 230.396 2.155 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+][C@@H]1CCCC(C)(C)C1 ZINC000234743988 357834758 /nfs/dbraw/zinc/83/47/58/357834758.db2.gz FZOLRVPOVZCANT-CHWSQXEVSA-N 2 0 242.407 2.299 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@@H]([C@@H](C)[NH3+])C2)s1 ZINC000168501640 134224769 /nfs/dbraw/zinc/22/47/69/134224769.db2.gz ZFGHCPBRMVQXCP-GHMZBOCLSA-N 2 0 224.373 2.226 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]CCC2(F)CCC2)C1 ZINC000583763861 357938324 /nfs/dbraw/zinc/93/83/24/357938324.db2.gz MQLGIPDSUMFQBZ-GHMZBOCLSA-N 2 0 214.328 2.128 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H](c1ccc(F)cc1)C1CC1 ZINC000423304359 192691848 /nfs/dbraw/zinc/69/18/48/192691848.db2.gz YLEVYPPEJCRYPM-QMTHXVAHSA-N 2 0 236.334 2.461 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CCC[NH2+]CC2)C1 ZINC000168716965 134246555 /nfs/dbraw/zinc/24/65/55/134246555.db2.gz ICPPAPNNHHPOIQ-UPJWGTAASA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@]1(C[NH2+][C@H]2CCC[NH2+]CC2)CCCS1 ZINC000168774259 134247923 /nfs/dbraw/zinc/24/79/23/134247923.db2.gz WFKCVLPTDWTVHJ-RYUDHWBXSA-N 2 0 228.405 2.004 20 0 BEADRP C[C@H](c1ccc(F)cc1)N1CCC[C@@H]([NH3+])C1 ZINC000217500376 134248739 /nfs/dbraw/zinc/24/87/39/134248739.db2.gz QXVRYYIYZWXXMF-ZWNOBZJWSA-N 2 0 222.307 2.310 20 0 BEADRP C[C@H](N[C@@H]1CC[N@@H+]2CCCC[C@@H]12)c1cccnc1 ZINC000217677287 134249437 /nfs/dbraw/zinc/24/94/37/134249437.db2.gz SQYDKVRHQXZCJM-CFVMTHIKSA-N 2 0 245.370 2.359 20 0 BEADRP c1ccc2c(c1)CC[NH+](C[C@@H]1CCC[NH2+]C1)CC2 ZINC000079572128 358106205 /nfs/dbraw/zinc/10/62/05/358106205.db2.gz KOQFORUGCHSTJU-CQSZACIVSA-N 2 0 244.382 2.087 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]C2CC([NH+](C)C)C2)C1 ZINC000584790302 358180128 /nfs/dbraw/zinc/18/01/28/358180128.db2.gz LNYAFTBZEXOAHE-IALDZJHCSA-N 2 0 210.365 2.247 20 0 BEADRP CC(C)OCCCC[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000224969760 358241952 /nfs/dbraw/zinc/24/19/52/358241952.db2.gz KUSBPPIWHCNXCD-QWHCGFSZSA-N 2 0 228.380 2.051 20 0 BEADRP CC(C)[N@@H+]1CC[C@H](C[NH2+][C@@H](C)C2CC2)C1 ZINC000040621456 358243074 /nfs/dbraw/zinc/24/30/74/358243074.db2.gz AHDNCOBMGLDNLK-NWDGAFQWSA-N 2 0 210.365 2.105 20 0 BEADRP C[Si](C)(C)C[N@@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000172652041 134266977 /nfs/dbraw/zinc/26/69/77/134266977.db2.gz KDQXEIRTYYXFBK-ZDUSSCGKSA-N 2 0 240.467 2.282 20 0 BEADRP C[C@@H]1C[NH+](CC[C@H]2CCC[NH2+]C2)C[C@@H](C)S1 ZINC000226670222 358342665 /nfs/dbraw/zinc/34/26/65/358342665.db2.gz MQHKKZVZXIQPKM-JHJVBQTASA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H]([NH2+]CC1(C2CC2)CC1)C1CC[NH+](C)CC1 ZINC000090773027 491129612 /nfs/dbraw/zinc/12/96/12/491129612.db2.gz QDHDUJIAVCRYSZ-GFCCVEGCSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]([N@H+](C)C[C@@H]1CCC[NH2+]C1)C(C)(C)C ZINC000042781604 358358227 /nfs/dbraw/zinc/35/82/27/358358227.db2.gz HJRDZGYJMGOCRP-VXGBXAGGSA-N 2 0 212.381 2.352 20 0 BEADRP C[N@H+](CCC[NH3+])Cc1ccc(C2CC2)cc1 ZINC000227742911 358362804 /nfs/dbraw/zinc/36/28/04/358362804.db2.gz QYOUCNSCFVUPJS-UHFFFAOYSA-N 2 0 218.344 2.345 20 0 BEADRP CC[N@H+](C)C[C@@H]1CC[NH+](CCC(C)C)C1 ZINC000173884796 134278461 /nfs/dbraw/zinc/27/84/61/134278461.db2.gz RKOGXESOLJSIGM-ZDUSSCGKSA-N 2 0 212.381 2.306 20 0 BEADRP CC[N@H+](C)C[C@@H]1CC[NH+](CCCCCOC)C1 ZINC000173924560 134276448 /nfs/dbraw/zinc/27/64/48/134276448.db2.gz WPDOTTRXRMDAHK-AWEZNQCLSA-N 2 0 242.407 2.077 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+]C2Cc3ccccc3C2)C1 ZINC000044533419 358390017 /nfs/dbraw/zinc/39/00/17/358390017.db2.gz ZXQMJJDWXIIQIJ-CYBMUJFWSA-N 2 0 244.382 2.085 20 0 BEADRP CC1(C)CN(c2cc[nH+]c3ccccc32)CC[NH2+]1 ZINC000212763939 358621334 /nfs/dbraw/zinc/62/13/34/358621334.db2.gz YODWBROGFGQQBJ-UHFFFAOYSA-N 2 0 241.338 2.423 20 0 BEADRP C[C@H]1C[C@@H](C[NH3+])C[N@@H+]1CCCOc1ccccc1 ZINC000131597807 358684570 /nfs/dbraw/zinc/68/45/70/358684570.db2.gz OOXZVUSMUMBUDU-KBPBESRZSA-N 2 0 248.370 2.125 20 0 BEADRP C[C@H]1C[C@H](C[NH3+])C[N@@H+]1CCCOc1ccccc1 ZINC000131597386 358684713 /nfs/dbraw/zinc/68/47/13/358684713.db2.gz OOXZVUSMUMBUDU-UONOGXRCSA-N 2 0 248.370 2.125 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+]C1Cc2ccccc2C1 ZINC000049553887 358694331 /nfs/dbraw/zinc/69/43/31/358694331.db2.gz GVFQCMNOCOEOSF-GFCCVEGCSA-N 2 0 232.371 2.084 20 0 BEADRP FCCC[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000133004117 358743606 /nfs/dbraw/zinc/74/36/06/358743606.db2.gz DYABPCWGNZTDCB-CYBMUJFWSA-N 2 0 228.355 2.296 20 0 BEADRP CC[NH+]1CCC([NH2+]CC2CCSCC2)CC1 ZINC000133675801 358763405 /nfs/dbraw/zinc/76/34/05/358763405.db2.gz CHIGNJFCAYDSRQ-UHFFFAOYSA-N 2 0 242.432 2.204 20 0 BEADRP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]CCc1ccsc1 ZINC000132298999 358714667 /nfs/dbraw/zinc/71/46/67/358714667.db2.gz PFBQWHJAOVUXTE-AAEUAGOBSA-N 2 0 238.400 2.220 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]CCc1ccsc1 ZINC000132298795 358714768 /nfs/dbraw/zinc/71/47/68/358714768.db2.gz PFBQWHJAOVUXTE-YPMHNXCESA-N 2 0 238.400 2.220 20 0 BEADRP Cc1ccccc1C[N@@H+]1CC[C@H]([NH3+])[C@@H](C)C1 ZINC000219836518 134292349 /nfs/dbraw/zinc/29/23/49/134292349.db2.gz RYRFEPQYAFWMQG-JSGCOSHPSA-N 2 0 218.344 2.164 20 0 BEADRP C[C@@H]([NH2+]Cc1ccoc1)C1CC[NH+](C)CC1 ZINC000132532645 491136560 /nfs/dbraw/zinc/13/65/60/491136560.db2.gz PRRVCSGUFLDFEH-LLVKDONJSA-N 2 0 222.332 2.100 20 0 BEADRP C[C@H]1CCCC[C@H]1C[NH2+]CCN1CCCC1 ZINC000134841690 358807947 /nfs/dbraw/zinc/80/79/47/358807947.db2.gz NMAZHTIALYSFNM-KBPBESRZSA-N 2 0 224.392 2.498 20 0 BEADRP CCCOc1cccc(C[NH2+][C@H](C)CC[NH3+])c1 ZINC000136133161 358865167 /nfs/dbraw/zinc/86/51/67/358865167.db2.gz HSCCLXSNVSMCDB-GFCCVEGCSA-N 2 0 236.359 2.302 20 0 BEADRP C[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1)[C@@H]1CCCOC1 ZINC000578324012 366512394 /nfs/dbraw/zinc/51/23/94/366512394.db2.gz CJHVTTGBNIRXMJ-IUODEOHRSA-N 2 0 248.370 2.050 20 0 BEADRP C[N@@H+]1CC[C@@H]([NH2+]CCC2CC2)CC1(C)C ZINC000623432692 358946168 /nfs/dbraw/zinc/94/61/68/358946168.db2.gz FTEWZKWWZIRVHS-GFCCVEGCSA-N 2 0 210.365 2.249 20 0 BEADRP [NH3+][C@H](C[NH2+]C(C1CCC1)C1CCC1)C1CC1 ZINC000423320171 192704234 /nfs/dbraw/zinc/70/42/34/192704234.db2.gz MBWQJVBTGRJITA-CYBMUJFWSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)C1 ZINC000070643345 359060639 /nfs/dbraw/zinc/06/06/39/359060639.db2.gz AQBRMURSNBXWDD-FRRDWIJNSA-N 2 0 222.376 2.249 20 0 BEADRP [NH3+]CCCC[NH2+][C@H]1CCc2ccc(F)cc21 ZINC000423331636 192711937 /nfs/dbraw/zinc/71/19/37/192711937.db2.gz MRRMHCVWJVZOSR-ZDUSSCGKSA-N 2 0 222.307 2.142 20 0 BEADRP Cc1cccc2c1CC[C@H]2[NH2+]CCCC[NH3+] ZINC000423345668 192721967 /nfs/dbraw/zinc/72/19/67/192721967.db2.gz YBPNIACIWBXSJX-CQSZACIVSA-N 2 0 218.344 2.311 20 0 BEADRP C[C@@H]1CC[C@@H](C)[C@H]([NH2+]CC2=CC[NH2+]CC2)C1 ZINC000423362767 192731423 /nfs/dbraw/zinc/73/14/23/192731423.db2.gz YBZIMOKBFDDNQM-YRGRVCCFSA-N 2 0 222.376 2.320 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]Cc1cccc2c1CCCN2 ZINC000423411950 192747306 /nfs/dbraw/zinc/74/73/06/192747306.db2.gz GQCSNESKORPBBM-NWDGAFQWSA-N 2 0 247.386 2.260 20 0 BEADRP COCCC[C@H](C)[NH2+]C[C@H]1CC[C@H](C[NH3+])CC1 ZINC000423427958 192752030 /nfs/dbraw/zinc/75/20/30/192752030.db2.gz QXFRZISSCBHDAW-IHRRRGAJSA-N 2 0 242.407 2.156 20 0 BEADRP CO[C@H](C[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1)C(C)C ZINC000623436966 359329943 /nfs/dbraw/zinc/32/99/43/359329943.db2.gz LSXRXXOVEQABHH-QWHCGFSZSA-N 2 0 242.407 2.120 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[C@@H]([NH3+])C1)[C@H]1C[C@H]1C ZINC000423461390 192778700 /nfs/dbraw/zinc/77/87/00/192778700.db2.gz CISOZPMWAAEDQD-MLGHIDQZSA-N 2 0 210.365 2.138 20 0 BEADRP Cc1ccc([C@H](C)[NH2+][C@@H]2CC[C@H](C[NH3+])C2)o1 ZINC000423492219 192793939 /nfs/dbraw/zinc/79/39/39/192793939.db2.gz MFXDMRBKKQJABO-SDDRHHMPSA-N 2 0 222.332 2.366 20 0 BEADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@@H](C2CC2)C2CCC2)C1 ZINC000423511309 192799306 /nfs/dbraw/zinc/79/93/06/192799306.db2.gz PXZWVJVKMGFLBC-DDTOSNHZSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@H](Cc1ccsc1)[NH2+][C@H](C)[C@H](C)[NH3+] ZINC000379542094 359540597 /nfs/dbraw/zinc/54/05/97/359540597.db2.gz QUTUZVRXRHLLJV-KXUCPTDWSA-N 2 0 212.362 2.004 20 0 BEADRP C[C@@H]([NH3+])[C@H](C)[NH2+][C@H](C)Cc1ccsc1 ZINC000379542092 359540750 /nfs/dbraw/zinc/54/07/50/359540750.db2.gz QUTUZVRXRHLLJV-BBBLOLIVSA-N 2 0 212.362 2.004 20 0 BEADRP C[C@H]1C[C@H](C[N@@H+]2CCSC[C@@H](C)C2)CC[NH2+]1 ZINC000379554243 359541660 /nfs/dbraw/zinc/54/16/60/359541660.db2.gz ZXCVMBKYZWSOOR-RWMBFGLXSA-N 2 0 242.432 2.059 20 0 BEADRP CC(C)[C@H]1CC[C@H]1[NH2+]CCC1=CC[NH2+]CC1 ZINC000423540922 192809128 /nfs/dbraw/zinc/80/91/28/192809128.db2.gz RDISZQNPILSETO-ZIAGYGMSSA-N 2 0 222.376 2.320 20 0 BEADRP C[C@@H]1CSCCN(CC[NH2+]C(C)(C)C)C1 ZINC000379573540 359548993 /nfs/dbraw/zinc/54/89/93/359548993.db2.gz XORFGXZLEUWSAM-NSHDSACASA-N 2 0 230.421 2.059 20 0 BEADRP COCC1(C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)CCCC1 ZINC000580451113 359558642 /nfs/dbraw/zinc/55/86/42/359558642.db2.gz YSFAMHVRGQZDLP-OLZOCXBDSA-N 2 0 240.391 2.053 20 0 BEADRP CC[NH2+]CC1CC[NH+](CCCOC(C)C)CC1 ZINC000430580794 192876533 /nfs/dbraw/zinc/87/65/33/192876533.db2.gz MZZFLRREGDOTFR-UHFFFAOYSA-N 2 0 242.407 2.123 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]C2CC(C)C2)[C@H](C)C1 ZINC000130382058 359693240 /nfs/dbraw/zinc/69/32/40/359693240.db2.gz ZITIMHXPCDOWNA-KPFVRQRISA-N 2 0 210.365 2.105 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H]2CCCC23CC3)C1 ZINC000578454353 366573649 /nfs/dbraw/zinc/57/36/49/366573649.db2.gz XLDZAYNGWDHVOO-OLZOCXBDSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@H](CC1CCC1)[NH2+][C@@H](C)CC[NH+](C)C ZINC000133008091 491145212 /nfs/dbraw/zinc/14/52/12/491145212.db2.gz LGQHKXCDSFYVLL-NWDGAFQWSA-N 2 0 212.381 2.495 20 0 BEADRP CCC1(CC)CC[N@H+](CC2CC[NH2+]CC2)C1 ZINC000087254658 359904388 /nfs/dbraw/zinc/90/43/88/359904388.db2.gz RMQPXKQDWQORGL-UHFFFAOYSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@@H]2CCC[NH2+]C2)C[C@@H]1C ZINC000087647415 359922598 /nfs/dbraw/zinc/92/25/98/359922598.db2.gz ACNARBXHXSZUKL-RQJABVFESA-N 2 0 224.392 2.400 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CCC(C)(C)C2)C1 ZINC000087771090 359926670 /nfs/dbraw/zinc/92/66/70/359926670.db2.gz GHOCQOSCAARFEI-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H]2CCC(C)(C)C2)C1 ZINC000087771092 359926728 /nfs/dbraw/zinc/92/67/28/359926728.db2.gz GHOCQOSCAARFEI-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@@H]([NH3+])C1)c1cccnc1 ZINC000088169835 359939329 /nfs/dbraw/zinc/93/93/29/359939329.db2.gz VWNHKFSYIJLCTR-UHTWSYAYSA-N 2 0 219.332 2.002 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]CCc1ccccc1 ZINC000089139565 359991552 /nfs/dbraw/zinc/99/15/52/359991552.db2.gz JVHGYNWOXVOSFF-LSDHHAIUSA-N 2 0 232.371 2.336 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]CCc1ccc(O)cc1 ZINC000089145572 359992765 /nfs/dbraw/zinc/99/27/65/359992765.db2.gz YJNWSRBUINMXBC-DZGCQCFKSA-N 2 0 248.370 2.042 20 0 BEADRP Cc1cccc(CC[NH2+][C@H]2CCC[C@@H]2C[NH3+])c1 ZINC000089150526 359993945 /nfs/dbraw/zinc/99/39/45/359993945.db2.gz ADWXGDFNDNTWQZ-CABCVRRESA-N 2 0 232.371 2.255 20 0 BEADRP CCCC1(C[NH2+][C@H]2CC[N@H+](C)C[C@@H]2C)CC1 ZINC000090402162 360072353 /nfs/dbraw/zinc/07/23/53/360072353.db2.gz HHUHOUJKNOHLQW-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP COc1ccc2c(c1)[C@@H]([NH2+]CCCC[NH3+])CC2 ZINC000092836327 360202243 /nfs/dbraw/zinc/20/22/43/360202243.db2.gz SFVOHKFMFMXKRU-AWEZNQCLSA-N 2 0 234.343 2.011 20 0 BEADRP Cc1ncccc1CN(C)C[C@H]1CCC[N@H+](C)C1 ZINC000092253878 360158913 /nfs/dbraw/zinc/15/89/13/360158913.db2.gz NOBYXWKNHJFGIT-AWEZNQCLSA-N 2 0 247.386 2.164 20 0 BEADRP COc1ccc2c(c1)[C@H]([NH2+]CCCC[NH3+])CCC2 ZINC000092383692 360165876 /nfs/dbraw/zinc/16/58/76/360165876.db2.gz ZFVVQEUOOFNGLO-OAHLLOKOSA-N 2 0 248.370 2.401 20 0 BEADRP CC[C@H](C)C[NH2+]C1CC[NH+](CCCOC)CC1 ZINC000093066873 360213768 /nfs/dbraw/zinc/21/37/68/360213768.db2.gz RTNMCOPYTRXJPO-ZDUSSCGKSA-N 2 0 242.407 2.123 20 0 BEADRP [NH3+]CCCOC1CC[NH+](CC2CCCC2)CC1 ZINC000094070702 360294641 /nfs/dbraw/zinc/29/46/41/360294641.db2.gz PSVZOAYVFRDIAV-UHFFFAOYSA-N 2 0 240.391 2.006 20 0 BEADRP c1ccc([C@@H]2CC[N@H+]2C2CC[NH2+]CC2)cc1 ZINC000141962069 360461581 /nfs/dbraw/zinc/46/15/81/360461581.db2.gz FNHCIWSEFQNPSP-AWEZNQCLSA-N 2 0 216.328 2.185 20 0 BEADRP CC1CC([NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)C1 ZINC000161779068 360552653 /nfs/dbraw/zinc/55/26/53/360552653.db2.gz YACIYMGCMGWNQR-POOIEITISA-N 2 0 208.349 2.001 20 0 BEADRP CC1(C)C[C@@H]1[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000156074107 360946171 /nfs/dbraw/zinc/94/61/71/360946171.db2.gz JDGVJWITKWXVMH-TUAOUCFPSA-N 2 0 208.349 2.001 20 0 BEADRP C[C@H]([NH3+])c1ccc(C[NH2+]CC[C@@H]2CCOC2)cc1 ZINC000414815379 200767002 /nfs/dbraw/zinc/76/70/02/200767002.db2.gz PGJVJSNQMLQWHP-GXTWGEPZSA-N 2 0 248.370 2.223 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CC2CCCC2)CC[N@@H+]1C ZINC000155880622 360932732 /nfs/dbraw/zinc/93/27/32/360932732.db2.gz LRDUKCGLVODQIS-WCQYABFASA-N 2 0 210.365 2.249 20 0 BEADRP CC[C@@H]1CCC[C@@H]([NH2+]C[C@@H]([NH3+])C2CC2)C1 ZINC000414895065 200777399 /nfs/dbraw/zinc/77/73/99/200777399.db2.gz VPDZFLTUQXDDOK-RAIGVLPGSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H]1C[C@H](C)CC(C)(C)C1 ZINC000414882308 200774314 /nfs/dbraw/zinc/77/43/14/200774314.db2.gz UABUVFZZEQUROJ-TUAOUCFPSA-N 2 0 212.381 2.386 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+]C1CCC(C)(C)CC1 ZINC000629407514 361055479 /nfs/dbraw/zinc/05/54/79/361055479.db2.gz CBNQKZMGDCOZAC-CMPLNLGQSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+][C@@H]1CCC[C@@H](C)[C@H]1C ZINC000629407590 361055545 /nfs/dbraw/zinc/05/55/45/361055545.db2.gz FEKBEYQUKKYZEB-UJPOAAIJSA-N 2 0 210.365 2.151 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+][C@@H]1CCC[C@@H](C)[C@@H]1C ZINC000629407587 361055687 /nfs/dbraw/zinc/05/56/87/361055687.db2.gz FEKBEYQUKKYZEB-KSSYENDESA-N 2 0 210.365 2.151 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+][C@H]1CC[C@@H](C)C[C@H]1C ZINC000629407673 361056544 /nfs/dbraw/zinc/05/65/44/361056544.db2.gz HSSABVYBYMRZBP-NAWOPXAZSA-N 2 0 210.365 2.151 20 0 BEADRP C[C@@H](CCC(F)(F)F)[NH2+][C@@H]1CC[NH2+][C@H]1C ZINC000629408036 361056622 /nfs/dbraw/zinc/05/66/22/361056622.db2.gz OXUVZYQSEMZPAL-XHNCKOQMSA-N 2 0 224.270 2.057 20 0 BEADRP CC1(C)CCC[C@H]([NH2+]CC2([NH3+])CCOCC2)C1 ZINC000629387258 361039172 /nfs/dbraw/zinc/03/91/72/361039172.db2.gz GIYSEIZSKPRABN-LBPRGKRZSA-N 2 0 240.391 2.053 20 0 BEADRP C[NH2+]CCOCC[NH2+][C@H]1CCC(C)(C)C[C@@H]1C ZINC000629404196 361049832 /nfs/dbraw/zinc/04/98/32/361049832.db2.gz LROGNINQQFUUFR-STQMWFEESA-N 2 0 242.407 2.027 20 0 BEADRP CCCC1CCC([NH2+]CCOCCC[NH3+])CC1 ZINC000629398839 361049865 /nfs/dbraw/zinc/04/98/65/361049865.db2.gz ZGCWTLNSJSMAKV-UHFFFAOYSA-N 2 0 242.407 2.300 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+][C@@H]1CCCCC1(C)C ZINC000629405444 361052656 /nfs/dbraw/zinc/05/26/56/361052656.db2.gz AYJPMSABMZYCFG-QJPTWQEYSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+][C@@H]1CC[C@@H](C)C[C@H]1C ZINC000629407675 361057265 /nfs/dbraw/zinc/05/72/65/361057265.db2.gz HSSABVYBYMRZBP-UJPOAAIJSA-N 2 0 210.365 2.151 20 0 BEADRP CC[C@H]([NH2+][C@@H](CCC[NH3+])COC)C(C)(C)C ZINC000422856449 200855567 /nfs/dbraw/zinc/85/55/67/200855567.db2.gz FKBLDRYHJDBIBV-RYUDHWBXSA-N 2 0 230.396 2.155 20 0 BEADRP C[C@@H]1CC[C@H](NCc2cccc3c2CCC3)C[NH2+]1 ZINC000629418374 361062798 /nfs/dbraw/zinc/06/27/98/361062798.db2.gz XKFSKMJUQQXZOG-DOMZBBRYSA-N 2 0 244.382 2.405 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1[NH2+][C@H](C(C)C)C1CC1 ZINC000629526169 361128148 /nfs/dbraw/zinc/12/81/48/361128148.db2.gz MBASBFRGMVVSJS-YNEHKIRRSA-N 2 0 210.365 2.151 20 0 BEADRP CC[C@@H]1[NH2+]CC[C@H]1[NH2+][C@@H]1CCC[C@H]2C[C@]21C ZINC000629527933 361134848 /nfs/dbraw/zinc/13/48/48/361134848.db2.gz JVBYZJDPGTZXIV-ODXJTPSBSA-N 2 0 222.376 2.295 20 0 BEADRP C[NH2+]CCOCC[NH2+][C@@H]1CCC[C@@H](C(C)C)C1 ZINC000629530816 361145548 /nfs/dbraw/zinc/14/55/48/361145548.db2.gz RXLSPDVDCSOKTQ-ZIAGYGMSSA-N 2 0 242.407 2.027 20 0 BEADRP CCO[C@@H](C[N@@H+]1CCCC[C@@H]1CC[NH3+])C1CC1 ZINC000629531656 361149038 /nfs/dbraw/zinc/14/90/38/361149038.db2.gz SUIWLOSJSLONAX-KGLIPLIRSA-N 2 0 240.391 2.005 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+][C@@H]1C[C@H]1C1CCC1 ZINC000424369729 200922764 /nfs/dbraw/zinc/92/27/64/200922764.db2.gz CFXQFNJODNOIHF-VZZFWQQMSA-N 2 0 222.376 2.153 20 0 BEADRP Cc1ccc(C(C)(C)C[NH2+][C@H](C)C[C@H](C)[NH3+])nc1 ZINC000629524617 361125678 /nfs/dbraw/zinc/12/56/78/361125678.db2.gz UAPZYZPNVOJJMI-QWHCGFSZSA-N 2 0 249.402 2.383 20 0 BEADRP Cc1ccc(C(C)(C)C[NH2+][C@H]2CCC[C@H]2[NH3+])nc1 ZINC000629525221 361126036 /nfs/dbraw/zinc/12/60/36/361126036.db2.gz WWWIYSOPGNXZNT-OLZOCXBDSA-N 2 0 247.386 2.137 20 0 BEADRP COC[C@H](C)[N@H+](C)CCCC[NH+]1CCCCC1 ZINC000640533516 361301219 /nfs/dbraw/zinc/30/12/19/361301219.db2.gz UFFIXPNEXTUDKP-AWEZNQCLSA-N 2 0 242.407 2.219 20 0 BEADRP COCCC[N@H+](C)CCCC[NH+]1CCCCC1 ZINC000640530283 361301256 /nfs/dbraw/zinc/30/12/56/361301256.db2.gz BAOXYODUMZPCFF-UHFFFAOYSA-N 2 0 242.407 2.221 20 0 BEADRP CO[C@@H](C)C[N@H+](C)CCCC[NH+]1CCCCC1 ZINC000640533869 361301666 /nfs/dbraw/zinc/30/16/66/361301666.db2.gz XTSKCURUBLDNMR-AWEZNQCLSA-N 2 0 242.407 2.219 20 0 BEADRP CC1CC(C[NH2+][C@@H]2CC[NH2+]CC[C@H]2C)C1 ZINC000622044444 370672979 /nfs/dbraw/zinc/67/29/79/370672979.db2.gz FSVHQJDOIGLPOY-POOIEITISA-N 2 0 210.365 2.010 20 0 BEADRP [NH3+]CC1CCC([NH2+]CC[C@@H]2CC2(F)F)CC1 ZINC000622043770 370675482 /nfs/dbraw/zinc/67/54/82/370675482.db2.gz KZTBOZWEKNYMNW-HSOILSAZSA-N 2 0 232.318 2.139 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CC1(F)F)[C@H]1CCCC[NH2+]1 ZINC000622043663 370675970 /nfs/dbraw/zinc/67/59/70/370675970.db2.gz HFLQJAMDQSNUNR-HBNTYKKESA-N 2 0 232.318 2.152 20 0 BEADRP CC[C@@H](Cc1cccs1)[NH2+]CC[C@H](C)[NH3+] ZINC000622045617 370679661 /nfs/dbraw/zinc/67/96/61/370679661.db2.gz GMOWCNZCXVSJSM-QWRGUYRKSA-N 2 0 226.389 2.396 20 0 BEADRP CCO[C@H]1C[C@@H]([NH2+]CC[C@H](C)[NH3+])C1(CC)CC ZINC000622045472 370679694 /nfs/dbraw/zinc/67/96/94/370679694.db2.gz XGJAQCHGVGFXRJ-XQQFMLRXSA-N 2 0 242.407 2.297 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@@H]2CCCN(C)C2)[C@H](C)C1 ZINC000082858904 491156676 /nfs/dbraw/zinc/15/66/76/491156676.db2.gz ILPMNIHYDYQXDZ-SYQHCUMBSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H](Cc1ccsc1)[NH2+][C@H]1CC[NH2+][C@H](C)C1 ZINC000579328727 366759380 /nfs/dbraw/zinc/75/93/80/366759380.db2.gz PBPKENYUYYPVQY-MDZLAQPJSA-N 2 0 238.400 2.409 20 0 BEADRP C[C@@H](Cc1ccsc1)[NH2+][C@@H]1CC[NH2+][C@H](C)C1 ZINC000579328733 366759748 /nfs/dbraw/zinc/75/97/48/366759748.db2.gz PBPKENYUYYPVQY-NTZNESFSSA-N 2 0 238.400 2.409 20 0 BEADRP C[NH+](C)[C@@H]1CCC[N@H+](CCC2CC2)CC1 ZINC000429528147 201112381 /nfs/dbraw/zinc/11/23/81/201112381.db2.gz IPAWIRWBVBRHLC-CYBMUJFWSA-N 2 0 210.365 2.203 20 0 BEADRP C[C@H]([NH2+]CCOCCC[NH3+])[C@@H]1CCCC[C@H]1C ZINC000629538565 361403418 /nfs/dbraw/zinc/40/34/18/361403418.db2.gz NWPVYKNOZVEMEL-HZSPNIEDSA-N 2 0 242.407 2.156 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+][C@H]1CC[C@H]1C(C)(C)C ZINC000629543802 361413342 /nfs/dbraw/zinc/41/33/42/361413342.db2.gz BQULZLDWYBGSAW-QCNOEVLYSA-N 2 0 210.365 2.151 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1[NH2+][C@@H]1CCC[C@@H]1CCCF ZINC000629544262 361422840 /nfs/dbraw/zinc/42/28/40/361422840.db2.gz HENDHUWBVRWUGS-UMSGYPCISA-N 2 0 228.355 2.245 20 0 BEADRP CCOc1ccc([C@H](C)N[C@@H]2CC[NH2+][C@H]2C)cc1 ZINC000629546475 361427348 /nfs/dbraw/zinc/42/73/48/361427348.db2.gz YKCHVMRCLDYKGM-SLEUVZQESA-N 2 0 248.370 2.486 20 0 BEADRP C[C@@H]1[NH2+]CC[C@H]1N[C@H]1CCCc2ccc(O)cc21 ZINC000629546421 361428082 /nfs/dbraw/zinc/42/80/82/361428082.db2.gz PPMPXRAKWJFQDI-VQISRLSMSA-N 2 0 246.354 2.110 20 0 BEADRP CC(C)[C@H]1CCC[C@@H]([NH2+][C@@H]2CC[NH2+]C2)C1 ZINC000629553238 361438107 /nfs/dbraw/zinc/43/81/07/361438107.db2.gz QWCMMFGDBNGKSZ-YNEHKIRRSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCCC12CC2)[C@@H]1CCC[NH2+]1 ZINC000629554282 361439863 /nfs/dbraw/zinc/43/98/63/361439863.db2.gz HGYIPMFUXMZEAZ-XQQFMLRXSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CCCC12CC2)[C@H]1CCC[NH2+]1 ZINC000629554283 361440049 /nfs/dbraw/zinc/44/00/49/361440049.db2.gz HGYIPMFUXMZEAZ-YNEHKIRRSA-N 2 0 222.376 2.297 20 0 BEADRP CC(C)[C@@H]1CCCC[C@@H]1[NH2+]CCOCCC[NH3+] ZINC000629541475 361416499 /nfs/dbraw/zinc/41/64/99/361416499.db2.gz PEXZPMKJPMLTGF-KBPBESRZSA-N 2 0 242.407 2.156 20 0 BEADRP C[C@H]1CCC[C@H](CC[N@H+](C)CCOCC[NH3+])C1 ZINC000629576872 361468256 /nfs/dbraw/zinc/46/82/56/361468256.db2.gz DRTBLMQPXGDSLA-UONOGXRCSA-N 2 0 242.407 2.110 20 0 BEADRP C[NH2+]CCC[NH2+]Cc1ccc(Cl)c(C)c1 ZINC000163337534 361456624 /nfs/dbraw/zinc/45/66/24/361456624.db2.gz QHFUXLKCVAVMAV-UHFFFAOYSA-N 2 0 226.751 2.348 20 0 BEADRP CCCC[N@@H+]1CC[C@@H](C(F)(F)F)[C@H](C[NH3+])C1 ZINC000629567151 361456990 /nfs/dbraw/zinc/45/69/90/361456990.db2.gz WYTMXXXWRGYDPO-NXEZZACHSA-N 2 0 238.297 2.246 20 0 BEADRP [NH3+]C1(C[NH2+]CCC2CCCCC2)CCOCC1 ZINC000629655688 361560106 /nfs/dbraw/zinc/56/01/06/361560106.db2.gz XVZLMHQKDKSMAY-UHFFFAOYSA-N 2 0 240.391 2.054 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)C(C)(C)C ZINC000152459489 201200956 /nfs/dbraw/zinc/20/09/56/201200956.db2.gz VGHMXPUWMHNNPU-NWDGAFQWSA-N 2 0 224.392 2.495 20 0 BEADRP COC1(C[NH2+]CCC[C@@H]2CCC[NH2+]2)CCCC1 ZINC000629649151 361543724 /nfs/dbraw/zinc/54/37/24/361543724.db2.gz JPCCDPNAWFCGBX-CYBMUJFWSA-N 2 0 240.391 2.067 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CC1=Cc2ccccc2OC1 ZINC000629649606 361544785 /nfs/dbraw/zinc/54/47/85/361544785.db2.gz WUHAXVKHRIKBGG-GFCCVEGCSA-N 2 0 246.354 2.179 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CC1=Cc2ccccc2OC1 ZINC000629649753 361546457 /nfs/dbraw/zinc/54/64/57/361546457.db2.gz FWTLRGPOHTYNRJ-NEPJUHHUSA-N 2 0 246.354 2.178 20 0 BEADRP C[C@@H]1C[N@@H+](C[C@]2(C)CC[NH2+]C2)C[C@H](C)C1(F)F ZINC000629649981 361546728 /nfs/dbraw/zinc/54/67/28/361546728.db2.gz MWPMTDCBVGJAAY-GRYCIOLGSA-N 2 0 246.345 2.209 20 0 BEADRP C[N@H+](CCCC1CCCCC1)CCOCC[NH3+] ZINC000629663244 361595896 /nfs/dbraw/zinc/59/58/96/361595896.db2.gz HZDJJCDRWKXZSQ-UHFFFAOYSA-N 2 0 242.407 2.254 20 0 BEADRP [NH3+]C1CCC([NH2+]C[C@@H]2CCCCS2)CC1 ZINC000087683680 181341640 /nfs/dbraw/zinc/34/16/40/181341640.db2.gz SFNKDDOVEJLRHL-MCIGGMRASA-N 2 0 228.405 2.132 20 0 BEADRP CO[C@H](c1ccc(C2=CC[NH2+]CC2)cc1)[C@H](C)[NH3+] ZINC000629723270 361664599 /nfs/dbraw/zinc/66/45/99/361664599.db2.gz LUOURNACHWBYNT-NHYWBVRUSA-N 2 0 246.354 2.098 20 0 BEADRP [NH3+]CC1(c2cccc(C3=CC[NH2+]CC3)c2)CC1 ZINC000629724157 361664614 /nfs/dbraw/zinc/66/46/14/361664614.db2.gz YXQVJRILPYOYNO-UHFFFAOYSA-N 2 0 228.339 2.054 20 0 BEADRP CCC[N@H+](Cc1ccccn1)[C@@H]1CCC[NH2+]CC1 ZINC000435615361 201278755 /nfs/dbraw/zinc/27/87/55/201278755.db2.gz HNHWHLSWJOZUCZ-OAHLLOKOSA-N 2 0 247.386 2.436 20 0 BEADRP [NH3+]C1CCC([NH2+][C@H]2CCOc3ccccc32)CC1 ZINC000051693378 181342430 /nfs/dbraw/zinc/34/24/30/181342430.db2.gz HKJGXWYWUITBNM-YIZWMMSDSA-N 2 0 246.354 2.370 20 0 BEADRP CC[C@@H]([NH3+])Cc1ccc(C2=CC[NH2+]CC2)cc1 ZINC000629722898 361663746 /nfs/dbraw/zinc/66/37/46/361663746.db2.gz GTRKCYSDZQUHCL-OAHLLOKOSA-N 2 0 230.355 2.343 20 0 BEADRP C[NH2+]CCC[N@@H+]1CC[C@H](Cc2ccccc2)C1 ZINC000435880142 201293856 /nfs/dbraw/zinc/29/38/56/201293856.db2.gz NOGYXIYAAPBKKE-OAHLLOKOSA-N 2 0 232.371 2.161 20 0 BEADRP C[NH2+]CCC[N@@H+]1C[C@H](c2ccccc2)C[C@@H]1C ZINC000435871730 201294106 /nfs/dbraw/zinc/29/41/06/201294106.db2.gz LJDMVYQHYQLNOR-DZGCQCFKSA-N 2 0 232.371 2.474 20 0 BEADRP [NH3+]CCC[NH2+][C@@H]1CCC[C@@H]1c1ccccc1 ZINC000437779780 201371285 /nfs/dbraw/zinc/37/12/85/201371285.db2.gz CAJVAUYCYWRIBJ-ZIAGYGMSSA-N 2 0 218.344 2.261 20 0 BEADRP [NH3+]CC1CCC([NH2+]C2CCCCC2)CC1 ZINC000334841359 181364185 /nfs/dbraw/zinc/36/41/85/181364185.db2.gz HGWRQCBWTCJTGO-UHFFFAOYSA-N 2 0 210.365 2.426 20 0 BEADRP Cc1ncc(C[NH+]2CCC(CC[NH3+])CC2)s1 ZINC000069730055 541386174 /nfs/dbraw/zinc/38/61/74/541386174.db2.gz SSVGOZNQYIKRSK-UHFFFAOYSA-N 2 0 239.388 2.012 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]CCCNc2ccccc2)C1 ZINC000573742777 364908252 /nfs/dbraw/zinc/90/82/52/364908252.db2.gz ZBMBYCGPSUHOLH-UKRRQHHQSA-N 2 0 247.386 2.348 20 0 BEADRP [NH3+]CCCC[N@@H+]1CCC[C@H]2CCCC[C@@H]21 ZINC000036826511 181376670 /nfs/dbraw/zinc/37/66/70/181376670.db2.gz WRNWAXPGEMRLNZ-OLZOCXBDSA-N 2 0 210.365 2.380 20 0 BEADRP COc1cccc2c1CCC[C@@H]2N[C@@H](C)[C@H](C)[NH3+] ZINC000573953363 364953889 /nfs/dbraw/zinc/95/38/89/364953889.db2.gz ZVYPQCGCOSRBJV-MJVIPROJSA-N 2 0 248.370 2.398 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]Cc1ccc(C(F)F)cc1 ZINC000574139058 364994346 /nfs/dbraw/zinc/99/43/46/364994346.db2.gz XHKDKQXYWMGDSJ-SECBINFHSA-N 2 0 228.286 2.309 20 0 BEADRP [NH3+]CCCN1CCc2ccc(Cl)cc2C1 ZINC000082790925 181381091 /nfs/dbraw/zinc/38/10/91/181381091.db2.gz XHWHUAHXLDZPIQ-UHFFFAOYSA-N 2 0 224.735 2.047 20 0 BEADRP C[C@H](C[N@H+](C)CCC[NH3+])c1ccc(F)cc1 ZINC000574277868 365026159 /nfs/dbraw/zinc/02/61/59/365026159.db2.gz VDEGMHSNZZHNBV-LLVKDONJSA-N 2 0 224.323 2.210 20 0 BEADRP NCC[NH2+][C@@H]1CCCC[C@@H]1c1ccccc1 ZINC000037712966 181397896 /nfs/dbraw/zinc/39/78/96/181397896.db2.gz WSIHFHHYIQOIDR-ZIAGYGMSSA-N 2 0 218.344 2.261 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[C@H](C[NH3+])C1 ZINC000574802195 365145643 /nfs/dbraw/zinc/14/56/43/365145643.db2.gz AUZSXYLOJRVUKE-LOWDOPEQSA-N 2 0 210.365 2.282 20 0 BEADRP CC[C@@H]1CCC[C@@H]1[NH2+][C@H]1CC[C@@H](C[NH3+])C1 ZINC000574802197 365145801 /nfs/dbraw/zinc/14/58/01/365145801.db2.gz AUZSXYLOJRVUKE-NDBYEHHHSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)(C)[NH+]1CCC([NH2+]C2CCOCC2)CC1 ZINC000037786496 365274826 /nfs/dbraw/zinc/27/48/26/365274826.db2.gz JLRJERHIZQWSIQ-UHFFFAOYSA-N 2 0 240.391 2.018 20 0 BEADRP CC[N@@H+]1CCC[C@@H](C[NH2+][C@@H]2CCC[C@H]3C[C@H]32)C1 ZINC000575197935 365238402 /nfs/dbraw/zinc/23/84/02/365238402.db2.gz RJOHMYOFTQJNCL-BYNSBNAKSA-N 2 0 236.403 2.497 20 0 BEADRP CC[C@H]([NH2+]CC[C@@H]1CCC[N@@H+]1C)[C@H]1CCCO1 ZINC000182264468 366879063 /nfs/dbraw/zinc/87/90/63/366879063.db2.gz OPIULKKYDMHDCR-MELADBBJSA-N 2 0 240.391 2.018 20 0 BEADRP CC[C@H]([NH3+])CNCc1ccnc2ccccc12 ZINC000576009991 365448376 /nfs/dbraw/zinc/44/83/76/365448376.db2.gz AUJRQFCYPBEQBH-LBPRGKRZSA-N 2 0 229.327 2.062 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H]1C[C@@H](C)CC[C@H]1C ZINC000576099196 365482612 /nfs/dbraw/zinc/48/26/12/365482612.db2.gz HEHUBINCOWDRDZ-YNEHKIRRSA-N 2 0 212.381 2.400 20 0 BEADRP CC[NH2+]CCC[NH2+][C@H](C)Cc1ccccc1F ZINC000579701382 366982707 /nfs/dbraw/zinc/98/27/07/366982707.db2.gz VKCVONNJZAJMIE-GFCCVEGCSA-N 2 0 238.350 2.346 20 0 BEADRP C[N@@H+](C/C=C/c1ccc(F)cc1F)CCC[NH3+] ZINC000579711712 366987803 /nfs/dbraw/zinc/98/78/03/366987803.db2.gz GGHVXACHMBSYGF-DUXPYHPUSA-N 2 0 240.297 2.259 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CC2CCC1CC2)C1C[NH2+]C1 ZINC000564988683 325840833 /nfs/dbraw/zinc/84/08/33/325840833.db2.gz NSYDROGYTNPUTO-IKWCTNDRSA-N 2 0 222.376 2.010 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1C[C@H]1C1CC1)c1cnccc1N ZINC000579822512 367024336 /nfs/dbraw/zinc/02/43/36/367024336.db2.gz XNLZXMSECIRUHK-DLOVCJGASA-N 2 0 231.343 2.191 20 0 BEADRP CC[C@H]([NH3+])CN[C@@H](C)c1ccc(C)cc1OC ZINC000579822675 367024360 /nfs/dbraw/zinc/02/43/60/367024360.db2.gz GSVWPNLBGPRPTA-RYUDHWBXSA-N 2 0 236.359 2.392 20 0 BEADRP COCC[C@H](C)[NH2+]CC[C@@H](C)[NH+]1CCCCC1 ZINC000184509143 367081268 /nfs/dbraw/zinc/08/12/68/367081268.db2.gz RXKYJFXLVJEERP-UONOGXRCSA-N 2 0 242.407 2.266 20 0 BEADRP C[NH2+]Cc1ccc(N[C@@H]2CCC[C@@H]([NH3+])C2)cc1 ZINC000579978707 367114106 /nfs/dbraw/zinc/11/41/06/367114106.db2.gz AHQUTWOZNMYUJD-TZMCWYRMSA-N 2 0 233.359 2.088 20 0 BEADRP c1ccc(CC[N@@H+]2CCC[C@H]3C[NH2+]CC[C@H]32)cc1 ZINC000631887139 370835180 /nfs/dbraw/zinc/83/51/80/370835180.db2.gz OCGUHYSEZDXCRR-JKSUJKDBSA-N 2 0 244.382 2.303 20 0 BEADRP CC(C)C[C@@H]([NH3+])C[N@@H+]1CCC2(CCC2)C1 ZINC000380523124 367228872 /nfs/dbraw/zinc/22/88/72/367228872.db2.gz UNAJXPIFLYKSDS-GFCCVEGCSA-N 2 0 210.365 2.236 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H]1C[C@H](OC(C)C)C1(C)C ZINC000581065717 367249574 /nfs/dbraw/zinc/24/95/74/367249574.db2.gz HYJJQPGFLQAQPH-OLZOCXBDSA-N 2 0 242.407 2.168 20 0 BEADRP CC[NH2+]CCC[NH2+][C@@H]1C[C@@H](OC(C)C)C1(C)C ZINC000581065716 367250115 /nfs/dbraw/zinc/25/01/15/367250115.db2.gz HYJJQPGFLQAQPH-CHWSQXEVSA-N 2 0 242.407 2.168 20 0 BEADRP C[N@@H+]1CCCC[C@@H]1CC[NH2+]C1(C2CC2)CC1 ZINC000381324237 367381685 /nfs/dbraw/zinc/38/16/85/367381685.db2.gz QCTMYFRURAQWFW-CYBMUJFWSA-N 2 0 222.376 2.393 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@@H]2C[C@H](C)[C@@H]2C)CC1 ZINC000381382787 367391565 /nfs/dbraw/zinc/39/15/65/367391565.db2.gz LDMOLYZDDDTLHL-SGMGOOAPSA-N 2 0 224.392 2.352 20 0 BEADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)C2CCC2)C1 ZINC000381465738 367410809 /nfs/dbraw/zinc/41/08/09/367410809.db2.gz LDDZZYCVWBMIAG-STQMWFEESA-N 2 0 224.392 2.495 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H]1CC12CC2 ZINC000581424108 367464877 /nfs/dbraw/zinc/46/48/77/367464877.db2.gz WEIPMPADMSFXCD-MFKMUULPSA-N 2 0 231.343 2.052 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H]1CC12CC2 ZINC000581424106 367465504 /nfs/dbraw/zinc/46/55/04/367465504.db2.gz WEIPMPADMSFXCD-GWCFXTLKSA-N 2 0 231.343 2.052 20 0 BEADRP CC[C@@H]1CCC[C@H]1[NH2+]CCC[NH2+]C1CC1 ZINC000382526914 367531725 /nfs/dbraw/zinc/53/17/25/367531725.db2.gz BOXMJLABJLPPDS-DGCLKSJQSA-N 2 0 210.365 2.297 20 0 BEADRP COc1cccc([C@@H](C)[NH2+]CCC[NH2+]C2CC2)c1 ZINC000382562059 367540200 /nfs/dbraw/zinc/54/02/00/367540200.db2.gz WMBHXEVWOQWHBI-GFCCVEGCSA-N 2 0 248.370 2.488 20 0 BEADRP C(C[NH2+][C@@H](C1CC1)C1CCC1)C[NH2+]C1CC1 ZINC000382587104 367545020 /nfs/dbraw/zinc/54/50/20/367545020.db2.gz USTLPUKHTZPXSW-CQSZACIVSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000581601941 367625457 /nfs/dbraw/zinc/62/54/57/367625457.db2.gz CBZARWSYEXKWEP-CHWSQXEVSA-N 2 0 236.359 2.332 20 0 BEADRP Cc1ccc(C[N@H+]2C[C@@H](C)[C@](C)(C[NH3+])C2)cc1 ZINC000383471216 367626297 /nfs/dbraw/zinc/62/62/97/367626297.db2.gz PNWZBRBSNZWXBQ-UKRRQHHQSA-N 2 0 232.371 2.412 20 0 BEADRP CCC[C@H](C)[C@H]1CCC[N@@H+]1CCC[NH2+]C ZINC000581612322 367634759 /nfs/dbraw/zinc/63/47/59/367634759.db2.gz LVGZUFLGDTUUPD-QWHCGFSZSA-N 2 0 212.381 2.497 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCCSC1)[C@@H]1CCCC[NH2+]1 ZINC000384095213 367672211 /nfs/dbraw/zinc/67/22/11/367672211.db2.gz CXYXMIGLJNMLMB-AVGNSLFASA-N 2 0 242.432 2.250 20 0 BEADRP CC[C@@H]1[C@H](C)CC[N@@H+]1C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000384156542 367673138 /nfs/dbraw/zinc/67/31/38/367673138.db2.gz LPKOOOMJKVLJIL-AAVRWANBSA-N 2 0 224.392 2.495 20 0 BEADRP CC/C=C/C[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000384834133 367738871 /nfs/dbraw/zinc/73/88/71/367738871.db2.gz HLNHQVLOAIORBG-AATRIKPKSA-N 2 0 210.365 2.415 20 0 BEADRP CC/C=C\C[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@H]1C ZINC000384866943 367746358 /nfs/dbraw/zinc/74/63/58/367746358.db2.gz NZEHXOUCVMZTQD-JIWOSTRHSA-N 2 0 210.365 2.271 20 0 BEADRP C[N@H+](C/C=C\c1ccccc1)C1CC([NH3+])C1 ZINC000384876246 367749455 /nfs/dbraw/zinc/74/94/55/367749455.db2.gz PQFNGTMUXYLIIP-YVMONPNESA-N 2 0 216.328 2.121 20 0 BEADRP CSCCC[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000068998333 370870968 /nfs/dbraw/zinc/87/09/68/370870968.db2.gz KELWGPKINRNHAU-NSHDSACASA-N 2 0 230.421 2.059 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@H]2C[C@@H](C)O[C@@H]2C)CC1 ZINC000384971900 367767854 /nfs/dbraw/zinc/76/78/54/367767854.db2.gz TWDUZEPHNBJHFC-BZPMIXESSA-N 2 0 240.391 2.015 20 0 BEADRP C[N@H+](CCSc1ccccc1)C1CC([NH3+])C1 ZINC000385012345 367772812 /nfs/dbraw/zinc/77/28/12/367772812.db2.gz NMBWQBAKYJKURR-UHFFFAOYSA-N 2 0 236.384 2.200 20 0 BEADRP [NH3+][C@@H]1CC[C@@H]2C[N@H+](C/C=C\c3ccccc3)C[C@@H]12 ZINC000385774193 367863366 /nfs/dbraw/zinc/86/33/66/367863366.db2.gz WEYFXHHMOUYZGT-ZLPVVSKCSA-N 2 0 242.366 2.369 20 0 BEADRP Cc1cc(C[NH2+]C[C@H](C)C[NH3+])c(C)s1 ZINC000581773456 367824680 /nfs/dbraw/zinc/82/46/80/367824680.db2.gz AZKMQEXSLBNUTK-MRVPVSSYSA-N 2 0 212.362 2.049 20 0 BEADRP C[C@H]([N@H+](C)CC[C@@H]1CCC[NH2+]C1)C1(C)CC1 ZINC000385417292 367827340 /nfs/dbraw/zinc/82/73/40/367827340.db2.gz ZHKIHCMJHOJTFF-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CC2([NH3+])CCCCC2)[C@@H]1C ZINC000386085143 367909973 /nfs/dbraw/zinc/90/99/73/367909973.db2.gz DTWBGWABCBXYDW-UTUOFQBUSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCC[C@@H]2CCC[NH2+]2)[C@H]1C ZINC000386094020 367910577 /nfs/dbraw/zinc/91/05/77/367910577.db2.gz GJKZRQOBXXYBKE-VOAKCMCISA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCC[C@@H]2CCC[NH2+]2)[C@@H]1C ZINC000386094018 367911500 /nfs/dbraw/zinc/91/15/00/367911500.db2.gz GJKZRQOBXXYBKE-NDBYEHHHSA-N 2 0 210.365 2.153 20 0 BEADRP CSC1(C[NH2+][C@H](C)[C@@H]2CCCC[NH2+]2)CCC1 ZINC000386598232 367997859 /nfs/dbraw/zinc/99/78/59/367997859.db2.gz UBAONMAWVJGHDF-NEPJUHHUSA-N 2 0 242.432 2.392 20 0 BEADRP COCCC(C)(C)C[NH2+][C@H](C)[C@H]1CCCC[NH2+]1 ZINC000386468227 367978443 /nfs/dbraw/zinc/97/84/43/367978443.db2.gz QCCSVSIAFMCKPI-CHWSQXEVSA-N 2 0 242.407 2.169 20 0 BEADRP C(C[NH2+]C[C@@H]1C[C@H]2C[C@H]2C1)C[NH+]1CCCC1 ZINC000252856337 368162751 /nfs/dbraw/zinc/16/27/51/368162751.db2.gz KSIKYLKAFLHYCY-BTTYYORXSA-N 2 0 222.376 2.108 20 0 BEADRP Cc1cc(C)c(C[N@@H+]2CC[C@H]([NH3+])[C@H](C)C2)c(C)n1 ZINC000631821611 368973181 /nfs/dbraw/zinc/97/31/81/368973181.db2.gz DGOPOYZBPSHHRH-ABAIWWIYSA-N 2 0 247.386 2.176 20 0 BEADRP C[N@@H+]1CCCC[C@H](C[NH2+]CC2(C)CCC2)C1 ZINC000623656911 368995628 /nfs/dbraw/zinc/99/56/28/368995628.db2.gz FLDYARZZRAGUFB-CYBMUJFWSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)[C@H]1C[C@H]1C ZINC000623657270 368997778 /nfs/dbraw/zinc/99/77/78/368997778.db2.gz MNZNXGOUYWTIMB-MQYQWHSLSA-N 2 0 224.392 2.352 20 0 BEADRP CC[C@H](C)C[NH2+]C[C@@H]1CCCC[N@H+](C)C1 ZINC000623657781 368998960 /nfs/dbraw/zinc/99/89/60/368998960.db2.gz YXPRIKOCMUWOGH-STQMWFEESA-N 2 0 212.381 2.354 20 0 BEADRP C[N@@H+]1CCCC[C@@H](C[NH2+]CC(C)(C)C)C1 ZINC000623656520 368992760 /nfs/dbraw/zinc/99/27/60/368992760.db2.gz VYVWTDRIHWTFJI-LBPRGKRZSA-N 2 0 212.381 2.354 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C[C@@H]2CCCC[N@H+](C)C2)C1 ZINC000623656019 368993575 /nfs/dbraw/zinc/99/35/75/368993575.db2.gz LBWDAIHWDVZINL-HZSPNIEDSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1ccsc1C[N@@H+](C)CCc1cncn1C ZINC000459293375 203246954 /nfs/dbraw/zinc/24/69/54/203246954.db2.gz JWQLXEFPDWVBHQ-UHFFFAOYSA-N 2 0 249.383 2.465 20 0 BEADRP C[C@H]([NH2+]CC(C1CC1)C1CC1)[C@@H]1CCC[NH2+]1 ZINC000400631315 369351830 /nfs/dbraw/zinc/35/18/30/369351830.db2.gz LTBKAWNRIMEAJT-HZMBPMFUSA-N 2 0 222.376 2.153 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]CCOCC2CCCC2)C1 ZINC000313267551 326261148 /nfs/dbraw/zinc/26/11/48/326261148.db2.gz UILWAJQMDCEMIC-KGLIPLIRSA-N 2 0 240.391 2.053 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CC[C@@H]2CCC[N@H+](C)C2)C1 ZINC000459732734 203344883 /nfs/dbraw/zinc/34/48/83/203344883.db2.gz MSQMRISNRYGPIN-RDBSUJKOSA-N 2 0 224.392 2.497 20 0 BEADRP C[N@@H+]1CCC[C@H](CC[NH2+]Cc2ccco2)C1 ZINC000459731310 203345382 /nfs/dbraw/zinc/34/53/82/203345382.db2.gz LKRNUWPVKGHLLU-GFCCVEGCSA-N 2 0 222.332 2.101 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)c1ccccn1 ZINC000459737332 203346281 /nfs/dbraw/zinc/34/62/81/203346281.db2.gz QYFSBWACOJJVCO-KBPBESRZSA-N 2 0 247.386 2.464 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]CCOCC2CCCC2)C1 ZINC000313267557 326261032 /nfs/dbraw/zinc/26/10/32/326261032.db2.gz UILWAJQMDCEMIC-UONOGXRCSA-N 2 0 240.391 2.053 20 0 BEADRP CC1(C)CC(CN2CCC[C@@H]3C[NH2+]CC[C@@H]32)C1 ZINC000631889446 370976005 /nfs/dbraw/zinc/97/60/05/370976005.db2.gz GHLORJRQVBYHBA-KGLIPLIRSA-N 2 0 236.403 2.497 20 0 BEADRP Cc1ncccc1C[NH2+]CC[C@H]1CCC[N@@H+](C)C1 ZINC000459738459 203350363 /nfs/dbraw/zinc/35/03/63/203350363.db2.gz RUAMNXNLQSRODL-CQSZACIVSA-N 2 0 247.386 2.212 20 0 BEADRP CCC[NH+]1CCC(C[NH2+][C@@H](C)C2CC2)CC1 ZINC000165292946 203383668 /nfs/dbraw/zinc/38/36/68/203383668.db2.gz NKTOYLQJPZVONT-LBPRGKRZSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1cc(CN2CCCC[C@H]2[C@H](C)[NH3+])ccn1 ZINC000621773962 370518985 /nfs/dbraw/zinc/51/89/85/370518985.db2.gz HDOABOUUNYZBDA-JSGCOSHPSA-N 2 0 233.359 2.092 20 0 BEADRP Cc1cc(C[N@@H+]2CCCC[C@@H]2CC[NH3+])ccn1 ZINC000621775664 370522702 /nfs/dbraw/zinc/52/27/02/370522702.db2.gz WCDDWMFKCVEZEV-CQSZACIVSA-N 2 0 233.359 2.093 20 0 BEADRP Cc1cc(C[N@H+]2CCC[C@H](C)[C@@H]2CC[NH3+])ccn1 ZINC000621776328 370524655 /nfs/dbraw/zinc/52/46/55/370524655.db2.gz JCDVDBSOLBTJKP-WFASDCNBSA-N 2 0 247.386 2.339 20 0 BEADRP [NH3+][C@]12CCC[C@@H]1C[N@H+](CCC1CCCC1)C2 ZINC000621781269 370529792 /nfs/dbraw/zinc/52/97/92/370529792.db2.gz BOANVBXGJBODHR-KGLIPLIRSA-N 2 0 222.376 2.380 20 0 BEADRP [NH3+][C@@]12CCC[C@H]1C[N@H+](CCC1CCCC1)C2 ZINC000621781270 370530323 /nfs/dbraw/zinc/53/03/23/370530323.db2.gz BOANVBXGJBODHR-UONOGXRCSA-N 2 0 222.376 2.380 20 0 BEADRP Cc1ccc(CC[N@@H+]2C[C@H]3CCC[C@]3([NH3+])C2)cc1 ZINC000621782843 370531794 /nfs/dbraw/zinc/53/17/94/370531794.db2.gz TVGOQMRIPVEGAX-CVEARBPZSA-N 2 0 244.382 2.351 20 0 BEADRP CC(C)C(C)(C)[NH2+]C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000568727303 326373521 /nfs/dbraw/zinc/37/35/21/326373521.db2.gz RXXVXAXWZYYCAX-VXGBXAGGSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@@H]([NH2+]CC(C)(C)C[NH+](C)C)[C@@H]1CCCCO1 ZINC000623849202 371126043 /nfs/dbraw/zinc/12/60/43/371126043.db2.gz YWZXEZLSBUQCQM-OLZOCXBDSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)C1CCC1 ZINC000624121366 371322858 /nfs/dbraw/zinc/32/28/58/371322858.db2.gz UTCUETFJAMOVIR-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP COC(C)(C)[C@H](C)[NH2+]C[C@H]1CCCC[N@H+](C)C1 ZINC000624123197 371324429 /nfs/dbraw/zinc/32/44/29/371324429.db2.gz HSICNQFWVAIFLH-QWHCGFSZSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@H]2CCCC[N@H+](C)C2)[C@H]1C ZINC000624124121 371324898 /nfs/dbraw/zinc/32/48/98/371324898.db2.gz XTDSHSXYNFRKQQ-RQJABVFESA-N 2 0 224.392 2.352 20 0 BEADRP C[N@@H+]1CCCC[C@@H](C[NH2+]C2CC(C)(C)C2)C1 ZINC000624123450 371325208 /nfs/dbraw/zinc/32/52/08/371325208.db2.gz MDTSSDGUHJLHKU-LBPRGKRZSA-N 2 0 224.392 2.497 20 0 BEADRP C[N@@H+]1CCC[C@@H]1CC[NH+]1CCC2(CCC2)C1 ZINC000162256840 371641138 /nfs/dbraw/zinc/64/11/38/371641138.db2.gz IRTCYPVMGRGTSZ-CYBMUJFWSA-N 2 0 222.376 2.347 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]Cc2ccccc2)C12CCC2 ZINC000405376888 372156306 /nfs/dbraw/zinc/15/63/06/372156306.db2.gz BQCBAMXXVGRKBG-STQMWFEESA-N 2 0 216.328 2.046 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCCc2ncccc21)C[NH+](C)C ZINC000631629756 372469166 /nfs/dbraw/zinc/46/91/66/372469166.db2.gz DGZYRUYANXHKCY-DOMZBBRYSA-N 2 0 247.386 2.246 20 0 BEADRP [NH3+][C@]12CCC[C@@H]1C[N@H+](C[C@@H]1CCC(F)(F)C1)C2 ZINC000631829878 372613017 /nfs/dbraw/zinc/61/30/17/372613017.db2.gz CLTHGTRRPQQNHL-UTUOFQBUSA-N 2 0 244.329 2.235 20 0 BEADRP Cc1ncc(CN2CCCCC[C@H]([NH3+])C2)s1 ZINC000631834183 372618641 /nfs/dbraw/zinc/61/86/41/372618641.db2.gz QYBPYWSWUBMJTG-NSHDSACASA-N 2 0 239.388 2.155 20 0 BEADRP CCO[C@@H](C[N@@H+]1CCCCC[C@H]([NH3+])C1)C1CC1 ZINC000631835332 372622237 /nfs/dbraw/zinc/62/22/37/372622237.db2.gz SAWBHTAUXOWYSQ-KBPBESRZSA-N 2 0 240.391 2.005 20 0 BEADRP FCCC1CC[NH+](CC[C@H]2CCC[NH2+]C2)CC1 ZINC000631836677 372624744 /nfs/dbraw/zinc/62/47/44/372624744.db2.gz DYYMELYDFXCFAY-CQSZACIVSA-N 2 0 242.382 2.448 20 0 BEADRP FCCC1CC[NH+](CC2CC[NH2+]CC2)CC1 ZINC000631836801 372625214 /nfs/dbraw/zinc/62/52/14/372625214.db2.gz HCMRDRGPUBHCQB-UHFFFAOYSA-N 2 0 228.355 2.058 20 0 BEADRP C[C@@H]1C[N@H+](Cc2ccc3c(c2)CCC3)C[C@H]1C[NH3+] ZINC000631837295 372626971 /nfs/dbraw/zinc/62/69/71/372626971.db2.gz ADCWMLSDGJHGNN-MLGOLLRUSA-N 2 0 244.382 2.202 20 0 BEADRP Cc1ccc(C[N@H+]2C[C@H](C)[C@H](C[NH3+])C2)cc1C ZINC000631837643 372629860 /nfs/dbraw/zinc/62/98/60/372629860.db2.gz DMPVVFJVZVNNRC-DZGCQCFKSA-N 2 0 232.371 2.330 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCC[C@H]2C[NH2+]CC[C@H]21 ZINC000631887535 372681408 /nfs/dbraw/zinc/68/14/08/372681408.db2.gz NVKONUTZIAXXLH-RWMBFGLXSA-N 2 0 210.365 2.106 20 0 BEADRP Cc1cc(C)c(C[NH2+][C@@H](C)CC[NH3+])c(C)c1 ZINC000220497247 134305837 /nfs/dbraw/zinc/30/58/37/134305837.db2.gz AHQYOXCXKVQSKI-ZDUSSCGKSA-N 2 0 220.360 2.439 20 0 BEADRP C[C@@H]1CCCC[C@H]1[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000414907687 205782248 /nfs/dbraw/zinc/78/22/48/205782248.db2.gz QWGAFWOKLPBYHC-JHJVBQTASA-N 2 0 210.365 2.297 20 0 BEADRP CC(C)(C)CC[NH2+]CCCC[NH+]1CCOCC1 ZINC000187673328 205811925 /nfs/dbraw/zinc/81/19/25/205811925.db2.gz LVFHDKIWSZZCHZ-UHFFFAOYSA-N 2 0 242.407 2.125 20 0 BEADRP CCc1cccc(C[N@@H+]2CC[C@@](C)(C[NH3+])C2)c1 ZINC000420307791 206024339 /nfs/dbraw/zinc/02/43/39/206024339.db2.gz CLLGXNGOGBVXLF-HNNXBMFYSA-N 2 0 232.371 2.420 20 0 BEADRP [NH3+][C@@H]1CCCC[C@H]1[NH2+]CCCc1ccccc1 ZINC000424328812 206037383 /nfs/dbraw/zinc/03/73/83/206037383.db2.gz FUKASAGQCRDGOK-HUUCEWRRSA-N 2 0 232.371 2.479 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCCC[C@H]1[NH3+])[C@H]1CC1(C)C ZINC000424369426 206039151 /nfs/dbraw/zinc/03/91/51/206039151.db2.gz BUNZTNPTDQRVSO-IRCOFANPSA-N 2 0 210.365 2.281 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCCC[C@H]1[NH3+])[C@@H]1CC1(C)C ZINC000424369428 206039697 /nfs/dbraw/zinc/03/96/97/206039697.db2.gz BUNZTNPTDQRVSO-NNYUYHANSA-N 2 0 210.365 2.281 20 0 BEADRP COC1(C[C@H](C)[NH2+][C@H](C)CC[NH+](C)C)CCC1 ZINC000429524653 206061231 /nfs/dbraw/zinc/06/12/31/206061231.db2.gz XVUKMYMGIMUNMQ-OLZOCXBDSA-N 2 0 242.407 2.264 20 0 BEADRP CCC[N@H+](C)Cc1cn(-c2cc[nH+]cc2)nc1C ZINC000346222396 169081575 /nfs/dbraw/zinc/08/15/75/169081575.db2.gz SITUBSBLXVJARE-UHFFFAOYSA-N 2 0 244.342 2.418 20 0 BEADRP Oc1ccc(C[NH2+]CCC[NH+]2CCCCC2)cc1 ZINC000020128686 183270020 /nfs/dbraw/zinc/27/00/20/183270020.db2.gz DJKSQFVKVWWVNL-UHFFFAOYSA-N 2 0 248.370 2.358 20 0 BEADRP CCC[NH+](CCC)CCC[NH2+]C(C)C ZINC000037480267 169147551 /nfs/dbraw/zinc/14/75/51/169147551.db2.gz USJJEJCBWVYONT-UHFFFAOYSA-N 2 0 200.370 2.497 20 0 BEADRP CCC[NH+]1CCC([NH2+]CC(C)(C)COC)CC1 ZINC000310445746 169188226 /nfs/dbraw/zinc/18/82/26/169188226.db2.gz RAMQVLGTYSAGFT-UHFFFAOYSA-N 2 0 242.407 2.123 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H]2CSC[C@H]2C)CC1 ZINC000304575762 169189904 /nfs/dbraw/zinc/18/99/04/169189904.db2.gz XQVOAAAVJHQVHV-YPMHNXCESA-N 2 0 242.432 2.202 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H]2CC[C@H]2SC)CC1 ZINC000336682069 169190006 /nfs/dbraw/zinc/19/00/06/169190006.db2.gz DFNVARZACSFRKP-CHWSQXEVSA-N 2 0 242.432 2.344 20 0 BEADRP c1cc(C[NH+]2CCC([C@@H]3CCC[NH2+]3)CC2)ccn1 ZINC000063197525 183339598 /nfs/dbraw/zinc/33/95/98/183339598.db2.gz UUDLRRBVNVORNL-HNNXBMFYSA-N 2 0 245.370 2.046 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+]C2CC(CC)C2)C1 ZINC000336779299 169206698 /nfs/dbraw/zinc/20/66/98/169206698.db2.gz NWVPPYRPJVSWCT-ROKHWSDSSA-N 2 0 224.392 2.497 20 0 BEADRP c1cc(C[NH2+]CC[C@@H]2CCC[NH2+]C2)cs1 ZINC000063147351 183350017 /nfs/dbraw/zinc/35/00/17/183350017.db2.gz UORRBEXCRHDENH-NSHDSACASA-N 2 0 224.373 2.227 20 0 BEADRP c1[nH+]cn2cc(C[NH2+]C[C@H]3CCSC3)ccc12 ZINC000297497639 183375788 /nfs/dbraw/zinc/37/57/88/183375788.db2.gz LBQAFHZVNHXFGW-GFCCVEGCSA-N 2 0 247.367 2.177 20 0 BEADRP CC[C@@H](C)[C@@H](C)[N@@H+]1C[C@H]2CC[NH+](C)C[C@H]2C1 ZINC001644099397 1172521801 /nfs/dbraw/zinc/52/18/01/1172521801.db2.gz PICIYNDEBMLFQJ-SYQHCUMBSA-N 2 0 224.392 2.305 20 0 BEADRP c1ccc2c(c1)CC[C@H]2[NH2+]CC1CC[NH2+]CC1 ZINC000094009574 183446063 /nfs/dbraw/zinc/44/60/63/183446063.db2.gz XCMHFTYDMPFPKT-OAHLLOKOSA-N 2 0 230.355 2.263 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CCn2ccnc2)[C@@H](C)C1 ZINC000222024388 134329425 /nfs/dbraw/zinc/32/94/25/134329425.db2.gz QQEOIGYCDUNGIR-AGIUHOORSA-N 2 0 221.348 2.297 20 0 BEADRP CSC[C@H](C)[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@@H]1C ZINC000223742497 134339060 /nfs/dbraw/zinc/33/90/60/134339060.db2.gz QAFINOGIMHLPGJ-NNYUYHANSA-N 2 0 230.421 2.056 20 0 BEADRP C[C@H](C[NH2+]C[C@H]1CCSC1)C[NH+]1CCCC1 ZINC000224420494 134347090 /nfs/dbraw/zinc/34/70/90/134347090.db2.gz QLSQJDHRDHJLOA-CHWSQXEVSA-N 2 0 242.432 2.061 20 0 BEADRP C[C@@H](CC1CC1)[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000227496670 134381360 /nfs/dbraw/zinc/38/13/60/134381360.db2.gz JECDVPKLEFNLFW-LBPRGKRZSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]([N@@H+]1C[C@@H](C)[C@](C)(C[NH3+])C1)C1(C)CC1 ZINC000309033364 533012749 /nfs/dbraw/zinc/01/27/49/533012749.db2.gz DCWBJDDCTDHJHW-NQBHXWOUSA-N 2 0 210.365 2.092 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCC(C)(C)C2)C1 ZINC000087771480 383865712 /nfs/dbraw/zinc/86/57/12/383865712.db2.gz PPPFFLUGQOLAIT-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)o1 ZINC000401109881 383933887 /nfs/dbraw/zinc/93/38/87/383933887.db2.gz GXLWTLVBTGYFQI-JHJVBQTASA-N 2 0 234.343 2.066 20 0 BEADRP C[C@H](Cc1cccs1)[NH2+][C@H]1CC[C@@H](C[NH3+])C1 ZINC000643542624 383981312 /nfs/dbraw/zinc/98/13/12/383981312.db2.gz SKNPIDJQVFTGRZ-UTUOFQBUSA-N 2 0 238.400 2.396 20 0 BEADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@H]2CCCc3cccnc32)C1 ZINC000643542766 383983953 /nfs/dbraw/zinc/98/39/53/383983953.db2.gz XJPFCUFVWYPJRA-BNOWGMLFSA-N 2 0 245.370 2.176 20 0 BEADRP Cc1ccc([C@H](C)[NH2+][C@@H]2CC[C@@H](C[NH3+])C2)c(C)n1 ZINC000643542786 383984320 /nfs/dbraw/zinc/98/43/20/383984320.db2.gz ZQSCPSHUKJGPOC-BFHYXJOUSA-N 2 0 247.386 2.476 20 0 BEADRP CO[C@@H]1CCC[C@@H]([NH2+]CCC[C@@H]2CCC[NH2+]2)C1 ZINC000643541882 383940790 /nfs/dbraw/zinc/94/07/90/383940790.db2.gz KRPBQSSJBHQWAM-BFHYXJOUSA-N 2 0 240.391 2.066 20 0 BEADRP CO[C@@H]1CCC[C@H]([NH2+]CCC[C@@H]2CCC[NH2+]2)C1 ZINC000643541884 383940840 /nfs/dbraw/zinc/94/08/40/383940840.db2.gz KRPBQSSJBHQWAM-MELADBBJSA-N 2 0 240.391 2.066 20 0 BEADRP CS[C@H]1CCCC[N@H+](CC2CC[NH2+]CC2)C1 ZINC000336460632 383951735 /nfs/dbraw/zinc/95/17/35/383951735.db2.gz QFNGEKQFXOGUJB-ZDUSSCGKSA-N 2 0 242.432 2.204 20 0 BEADRP [NH3+]CC[C@@H]1CCCC[N@@H+]1CCC(F)(F)F ZINC000070914861 383958930 /nfs/dbraw/zinc/95/89/30/383958930.db2.gz UUSXFYLDWDXHOQ-VIFPVBQESA-N 2 0 224.270 2.142 20 0 BEADRP CCc1ccc(C[NH2+]C2CCN(C)CC2)cc1 ZINC000037248648 383965206 /nfs/dbraw/zinc/96/52/06/383965206.db2.gz BSPHVLMYUIDVTP-UHFFFAOYSA-N 2 0 232.371 2.433 20 0 BEADRP C[C@H](CC1CCC1)[NH2+]CCC1=CC[NH2+]CC1 ZINC000643545543 384008244 /nfs/dbraw/zinc/00/82/44/384008244.db2.gz VKTGZAHMTPFJCF-GFCCVEGCSA-N 2 0 222.376 2.465 20 0 BEADRP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]Cc1ccccc1 ZINC000073653777 384029411 /nfs/dbraw/zinc/02/94/11/384029411.db2.gz IOHGIIBXOUYHLW-JSGCOSHPSA-N 2 0 218.344 2.116 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000643547398 384033811 /nfs/dbraw/zinc/03/38/11/384033811.db2.gz DTWINHLYJVGBFH-OCCSQVGLSA-N 2 0 248.370 2.475 20 0 BEADRP CCC1(C[NH2+][C@@H]2C[C@H](C)[N@H+](C)C[C@@H]2C)CC1 ZINC000090219707 384035861 /nfs/dbraw/zinc/03/58/61/384035861.db2.gz FPZGULZXHNXWJL-RWMBFGLXSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CC[NH2+]C3(CCC3)C2)[C@H]1C ZINC000643548787 384038992 /nfs/dbraw/zinc/03/89/92/384038992.db2.gz VEQKJTLVHHFPMI-VOAKCMCISA-N 2 0 222.376 2.295 20 0 BEADRP CCCC[NH+]1CCC([NH2+]Cc2cc[nH]c2)CC1 ZINC000090994683 384089014 /nfs/dbraw/zinc/08/90/14/384089014.db2.gz BVPXUPWHEHJDEN-UHFFFAOYSA-N 2 0 235.375 2.369 20 0 BEADRP Cc1cc(CN2CCCC23CC[NH+](C)CC3)no1 ZINC000336528450 384062308 /nfs/dbraw/zinc/06/23/08/384062308.db2.gz BHWWROWEVWTJEN-UHFFFAOYSA-N 2 0 249.358 2.043 20 0 BEADRP [NH3+]C[C@@H]1CCN(Cc2ccc(Cl)cc2F)C1 ZINC000163175329 384069319 /nfs/dbraw/zinc/06/93/19/384069319.db2.gz FCAMMLPCTXFNIB-VIFPVBQESA-N 2 0 242.725 2.260 20 0 BEADRP C[C@@H]([NH3+])C1CC[NH+](C[C@@H]2CCC(F)(F)C2)CC1 ZINC000302377895 384153149 /nfs/dbraw/zinc/15/31/49/384153149.db2.gz HYIXJUNLOULTFB-GHMZBOCLSA-N 2 0 246.345 2.481 20 0 BEADRP CC[C@@H]1C[N@H+](C[C@@H]2CCC(F)(F)C2)CC[C@H]1[NH3+] ZINC000302380963 384155833 /nfs/dbraw/zinc/15/58/33/384155833.db2.gz IGZVMKUIJDWMAZ-IJLUTSLNSA-N 2 0 246.345 2.481 20 0 BEADRP COc1ccc(C[N@H+](C)CC2CC[NH2+]CC2)cc1 ZINC000042442230 384219319 /nfs/dbraw/zinc/21/93/19/384219319.db2.gz XXKFNTRUCZSXRO-UHFFFAOYSA-N 2 0 248.370 2.127 20 0 BEADRP CC[C@@H]1C[N@H+](CC2(OC)CCCC2)CC[C@H]1[NH3+] ZINC000319456329 384249330 /nfs/dbraw/zinc/24/93/30/384249330.db2.gz OCXSXEAPRMUKQX-CHWSQXEVSA-N 2 0 240.391 2.005 20 0 BEADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H]2CCC[C@H]3C[C@H]32)C1 ZINC000558700117 384252277 /nfs/dbraw/zinc/25/22/77/384252277.db2.gz PJECVSPMODDHMB-BYNSBNAKSA-N 2 0 236.403 2.497 20 0 BEADRP CC[C@](C)(C[NH2+]C[C@@H](C)C[NH+]1CCCC1)OC ZINC000319536619 384253078 /nfs/dbraw/zinc/25/30/78/384253078.db2.gz AXNBFQLWKBSQPC-ZIAGYGMSSA-N 2 0 242.407 2.123 20 0 BEADRP CC(C)[C@H](C)[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000319502732 384257251 /nfs/dbraw/zinc/25/72/51/384257251.db2.gz JEDBJFRVNMTNAK-NWDGAFQWSA-N 2 0 210.365 2.295 20 0 BEADRP CC[NH+](CC)C[C@H]1CC[N@H+](CCCSC)C1 ZINC000174215604 384306785 /nfs/dbraw/zinc/30/67/85/384306785.db2.gz YQLDJDBBVBVYGW-CYBMUJFWSA-N 2 0 244.448 2.403 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1CC[N@H+](CC)C1)C1CC1 ZINC000083055489 384278823 /nfs/dbraw/zinc/27/88/23/384278823.db2.gz UFFBWFOMBNABCF-AAEUAGOBSA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)CCOCC[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000119518661 384279765 /nfs/dbraw/zinc/27/97/65/384279765.db2.gz XZHWNNRZIWAMPW-KBPBESRZSA-N 2 0 242.407 2.121 20 0 BEADRP CC[C@H](C)C[N@H+](C)C[C@H]1CC[NH2+][C@H](C)C1 ZINC000300056940 384283220 /nfs/dbraw/zinc/28/32/20/384283220.db2.gz WSMPAVRNPXUQOV-XQQFMLRXSA-N 2 0 212.381 2.352 20 0 BEADRP Cc1cc[nH+]c(NCC(C)(C)C[NH+](C)C)c1 ZINC000043561404 384284722 /nfs/dbraw/zinc/28/47/22/384284722.db2.gz SMZLMVLLNYOHEL-UHFFFAOYSA-N 2 0 221.348 2.390 20 0 BEADRP C[C@H]1C[C@@H]1C[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000159041885 384297715 /nfs/dbraw/zinc/29/77/15/384297715.db2.gz FCODEVGEWKTVMJ-QWHCGFSZSA-N 2 0 245.370 2.296 20 0 BEADRP CCCCOCC[N@@H+]1C[C@H](C[NH3+])[C@@H](C)C[C@H]1C ZINC000397338385 384299185 /nfs/dbraw/zinc/29/91/85/384299185.db2.gz ZAYQNTLECAVDDW-MJBXVCDLSA-N 2 0 242.407 2.108 20 0 BEADRP CCCCOCC[N@@H+]1C[C@H](C[NH3+])[C@@H](C)C[C@@H]1C ZINC000397338383 384299312 /nfs/dbraw/zinc/29/93/12/384299312.db2.gz ZAYQNTLECAVDDW-IHRRRGAJSA-N 2 0 242.407 2.108 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@H]1CCC12CCC2 ZINC000308830944 384336056 /nfs/dbraw/zinc/33/60/56/384336056.db2.gz GERBBSIPSSZBBG-NEPJUHHUSA-N 2 0 210.365 2.249 20 0 BEADRP CC[NH+](CC)CCC[NH2+]CC1(SC)CC1 ZINC000308836476 384339005 /nfs/dbraw/zinc/33/90/05/384339005.db2.gz WOLHNFPNWYVYEF-UHFFFAOYSA-N 2 0 230.421 2.204 20 0 BEADRP C/C=C/C[NH2+][C@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000384731854 384362209 /nfs/dbraw/zinc/36/22/09/384362209.db2.gz JVAYRUGJWSTPJC-HNFMAKEJSA-N 2 0 210.365 2.463 20 0 BEADRP CN1CCC([NH2+]CC23CCC(CC2)C3)CC1 ZINC000335599752 384370302 /nfs/dbraw/zinc/37/03/02/384370302.db2.gz KDAPSBDQQBYOOP-UHFFFAOYSA-N 2 0 222.376 2.251 20 0 BEADRP C[NH+]1CCC(C)(C[NH2+]C2CC(C)(C)C2)CC1 ZINC000335600525 384370378 /nfs/dbraw/zinc/37/03/78/384370378.db2.gz IJTYUEPXJSDKOV-UHFFFAOYSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1ccc(NC(=O)CC[C@@H]2CC[NH2+]C2)c(C)n1 ZINC000134587301 384370951 /nfs/dbraw/zinc/37/09/51/384370951.db2.gz UDLKHUMWTQHNFQ-GFCCVEGCSA-N 2 0 247.342 2.027 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CC[NH2+]C1)c1cccs1 ZINC000095068384 384330124 /nfs/dbraw/zinc/33/01/24/384330124.db2.gz SGONINODYFRNLP-VHSXEESVSA-N 2 0 210.346 2.008 20 0 BEADRP CC(C)[C@H]1CCC[N@@H+]1CC[C@@H]1CC[NH2+]C1 ZINC000084386272 384392451 /nfs/dbraw/zinc/39/24/51/384392451.db2.gz DHVUDBOQQPPAHM-QWHCGFSZSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)cc1 ZINC000521369808 384426536 /nfs/dbraw/zinc/42/65/36/384426536.db2.gz FKNYPVWVLNWWOW-GLQYFDAESA-N 3 0 247.386 2.066 20 0 BEADRP Cc1ccc(F)cc1C[N@H+]1C[C@H](C[NH3+])C[C@H]1C ZINC000229060361 384414303 /nfs/dbraw/zinc/41/43/03/384414303.db2.gz GPUHAFLUPPMMJQ-NEPJUHHUSA-N 2 0 236.334 2.303 20 0 BEADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)cc1 ZINC000521369810 384426938 /nfs/dbraw/zinc/42/69/38/384426938.db2.gz FKNYPVWVLNWWOW-NILFDRSVSA-N 3 0 247.386 2.066 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@@H]1Nc1ccccn1 ZINC000084213450 384377601 /nfs/dbraw/zinc/37/76/01/384377601.db2.gz SWILFNYZLYLOQU-MNOVXSKESA-N 2 0 205.305 2.011 20 0 BEADRP CCCC[N@H+](CC[C@@H]1CC[NH2+]C1)C1CC1 ZINC000084385226 384391202 /nfs/dbraw/zinc/39/12/02/384391202.db2.gz ANFROEKORSERCL-LBPRGKRZSA-N 2 0 210.365 2.251 20 0 BEADRP CC(C)[C@@H]([NH3+])CNCc1ccsc1Cl ZINC000312749712 384458042 /nfs/dbraw/zinc/45/80/42/384458042.db2.gz UKVXNXQNDJCPJT-VIFPVBQESA-N 2 0 232.780 2.474 20 0 BEADRP [NH3+][C@@H]1CCCN(CCCCC2CCOCC2)C1 ZINC000305898091 384428838 /nfs/dbraw/zinc/42/88/38/384428838.db2.gz SUYAMRCBBBDFJJ-CQSZACIVSA-N 2 0 240.391 2.006 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]CCc2ccncc2)CC1 ZINC000048261215 384483264 /nfs/dbraw/zinc/48/32/64/384483264.db2.gz QVVRFKCSTDCBAG-UHFFFAOYSA-N 2 0 247.386 2.087 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@H](C[NH+](C)C)C2)cc1 ZINC000172197681 384546954 /nfs/dbraw/zinc/54/69/54/384546954.db2.gz LGNCCCZDXBVFCK-OAHLLOKOSA-N 2 0 232.371 2.379 20 0 BEADRP C[NH2+]CC1CC[NH+](C[C@H]2CCC(F)(F)C2)CC1 ZINC000305918561 384551221 /nfs/dbraw/zinc/55/12/21/384551221.db2.gz BHKZXSQGBCZTGH-LBPRGKRZSA-N 2 0 246.345 2.353 20 0 BEADRP C[NH2+][C@@H]1CCN(Cc2ccc(C)c(C)c2)C1 ZINC000150058337 384555164 /nfs/dbraw/zinc/55/51/64/384555164.db2.gz MVMJMMPQCYYCPJ-CQSZACIVSA-N 2 0 218.344 2.097 20 0 BEADRP C[NH+](C)CC(C)(C)C[NH2+]Cc1cccs1 ZINC000019905713 384555226 /nfs/dbraw/zinc/55/52/26/384555226.db2.gz NLGCDEUFDXPHLI-UHFFFAOYSA-N 2 0 226.389 2.426 20 0 BEADRP CCC[N@H+](C)C[C@H]1CC[NH+](CCCF)C1 ZINC000151336904 384564078 /nfs/dbraw/zinc/56/40/78/384564078.db2.gz FNGTVSHNVPXKQD-GFCCVEGCSA-N 2 0 216.344 2.010 20 0 BEADRP CS[C@H](C)C[NH2+][C@@H]1CC[N@H+](C)[C@H]2CCC[C@@H]21 ZINC000309721405 384566823 /nfs/dbraw/zinc/56/68/23/384566823.db2.gz WCJIQIRQHSKRIO-LPWJVIDDSA-N 2 0 242.432 2.200 20 0 BEADRP CS[C@H](C)C[NH2+][C@@H]1CC[N@H+](C)[C@@H]2CCC[C@H]21 ZINC000309721407 384566999 /nfs/dbraw/zinc/56/69/99/384566999.db2.gz WCJIQIRQHSKRIO-YVECIDJPSA-N 2 0 242.432 2.200 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21)[C@@H]1CCOC1 ZINC000222817221 384608093 /nfs/dbraw/zinc/60/80/93/384608093.db2.gz MUOOIXVAXABZBU-RBDSIQFVSA-N 2 0 246.354 2.146 20 0 BEADRP CN(CCc1ccccn1)CC[C@H]1CCC[N@@H+]1C ZINC000162397514 384616081 /nfs/dbraw/zinc/61/60/81/384616081.db2.gz XRJDFOWETIAFQZ-OAHLLOKOSA-N 2 0 247.386 2.040 20 0 BEADRP CN(CCc1ccccn1)CC[C@@H]1CCC[N@@H+]1C ZINC000162397643 384616954 /nfs/dbraw/zinc/61/69/54/384616954.db2.gz XRJDFOWETIAFQZ-HNNXBMFYSA-N 2 0 247.386 2.040 20 0 BEADRP CC(C)=CC[N@@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000150819658 384626457 /nfs/dbraw/zinc/62/64/57/384626457.db2.gz XYOYHNDGCVSERP-AWEZNQCLSA-N 2 0 222.376 2.370 20 0 BEADRP CC(C)C[C@H](C)C[N@@H+]1CC[C@H]([NH3+])[C@@H](C)C1 ZINC000300831785 384598432 /nfs/dbraw/zinc/59/84/32/384598432.db2.gz CCWIQMWOKXTLTP-AVGNSLFASA-N 2 0 212.381 2.338 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]C[C@@H]1CCCC(C)(C)C1 ZINC000556932275 384663350 /nfs/dbraw/zinc/66/33/50/384663350.db2.gz NEOSOOUHKHOTIB-VXGBXAGGSA-N 2 0 212.381 2.387 20 0 BEADRP CCC[C@H]1[C@H](C)CCC[N@@H+]1CCC[NH2+]C ZINC000309852656 384670409 /nfs/dbraw/zinc/67/04/09/384670409.db2.gz YQEKRGJPOBHMKI-OLZOCXBDSA-N 2 0 212.381 2.497 20 0 BEADRP CSCCC[NH+]1CCC([NH2+]C(C)C)CC1 ZINC000173309483 384672929 /nfs/dbraw/zinc/67/29/29/384672929.db2.gz NHPCSXVAWDPZNT-UHFFFAOYSA-N 2 0 230.421 2.202 20 0 BEADRP c1ccc([C@@H]2CC[N@@H+](C3CC[NH2+]CC3)C2)cc1 ZINC000050599380 384636310 /nfs/dbraw/zinc/63/63/10/384636310.db2.gz DMIAJSIFTOLYMV-CQSZACIVSA-N 2 0 230.355 2.228 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CC[N@H+](CCCC(C)(C)C)C1 ZINC000300896318 384638831 /nfs/dbraw/zinc/63/88/31/384638831.db2.gz QGPQAXIKNMGPCI-NWDGAFQWSA-N 2 0 212.381 2.482 20 0 BEADRP C[C@H]([NH3+])[C@H]1CC[N@H+](CCCC(C)(C)C)C1 ZINC000300896321 384639022 /nfs/dbraw/zinc/63/90/22/384639022.db2.gz QGPQAXIKNMGPCI-RYUDHWBXSA-N 2 0 212.381 2.482 20 0 BEADRP C[N@H+]1CC=C(C[NH2+]C[C@@H]2CC=CCC2)CC1 ZINC000271809416 384647343 /nfs/dbraw/zinc/64/73/43/384647343.db2.gz KQHDQUCDKQEUKN-CYBMUJFWSA-N 2 0 220.360 2.194 20 0 BEADRP CC(C)[NH+](CCC[NH2+][C@@H]1CO[C@H](C)C1)C(C)C ZINC000647188930 384647722 /nfs/dbraw/zinc/64/77/22/384647722.db2.gz SAMRRBJUBPVUSJ-KGLIPLIRSA-N 2 0 242.407 2.262 20 0 BEADRP CC[C@@H](C)C[N@H+](CC)C[C@@H]1CCC[NH2+]C1 ZINC000086437718 384649609 /nfs/dbraw/zinc/64/96/09/384649609.db2.gz LYOJSVUYWGMXOV-CHWSQXEVSA-N 2 0 212.381 2.354 20 0 BEADRP COc1ccc(C[NH2+]CC2=CC[N@H+](C)CC2)cc1 ZINC000271888082 384653203 /nfs/dbraw/zinc/65/32/03/384653203.db2.gz NVEKIIHLMPDRHK-UHFFFAOYSA-N 2 0 246.354 2.047 20 0 BEADRP Cc1ccccc1C[NH2+]C[C@@H]1CCC[N@@H+](C)C1 ZINC000044535116 384657949 /nfs/dbraw/zinc/65/79/49/384657949.db2.gz SCBSJXNDMCUQFA-AWEZNQCLSA-N 2 0 232.371 2.426 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]C[C@@H]2CCC[N@H+](C)C2)C1 ZINC000044535213 384659237 /nfs/dbraw/zinc/65/92/37/384659237.db2.gz JQNCSLPKMWJRKT-RDBSUJKOSA-N 2 0 224.392 2.497 20 0 BEADRP C[N@H+](CCC[NH3+])Cc1ccc(C(F)F)cc1 ZINC000124622783 384661453 /nfs/dbraw/zinc/66/14/53/384661453.db2.gz MLFYBQYZMINVAE-UHFFFAOYSA-N 2 0 228.286 2.405 20 0 BEADRP CCC[NH+]1CCC([N@H+](C)CC(C)C)CC1 ZINC000171930242 384677338 /nfs/dbraw/zinc/67/73/38/384677338.db2.gz UEUVDGQCNABMRA-UHFFFAOYSA-N 2 0 212.381 2.449 20 0 BEADRP CCCC1CCC([NH2+][C@@H]2CC[NH2+]C2)CC1 ZINC000086729389 384679488 /nfs/dbraw/zinc/67/94/88/384679488.db2.gz BCLWNNAYYYPSCV-WXRRBKDZSA-N 2 0 210.365 2.297 20 0 BEADRP CC(F)(F)CC[NH2+][C@H]1CCCC[C@@H]1C[NH3+] ZINC000357716677 384683621 /nfs/dbraw/zinc/68/36/21/384683621.db2.gz OWQBZLCFGJGDKC-ZJUUUORDSA-N 2 0 220.307 2.139 20 0 BEADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccn(C)c2)C1 ZINC000125014216 384689975 /nfs/dbraw/zinc/68/99/75/384689975.db2.gz VNBPPOWUMQAXHP-AWEZNQCLSA-N 2 0 249.402 2.235 20 0 BEADRP [NH3+]C[C@H]1CCC[N@H+](CCCc2ccccc2)C1 ZINC000011888465 384705531 /nfs/dbraw/zinc/70/55/31/384705531.db2.gz TYMOOFGSAIJCFV-OAHLLOKOSA-N 2 0 232.371 2.290 20 0 BEADRP CCSCCC[NH2+][C@H]1CC[N@H+](CC)C[C@H]1C ZINC000309679386 384718796 /nfs/dbraw/zinc/71/87/96/384718796.db2.gz ZBILEYDAZHJJPQ-OLZOCXBDSA-N 2 0 244.448 2.450 20 0 BEADRP [NH3+]CCC[NH2+]C1(c2cccc(F)c2)CCC1 ZINC000647552944 384778861 /nfs/dbraw/zinc/77/88/61/384778861.db2.gz AZCPLEKEZUDLJZ-UHFFFAOYSA-N 2 0 222.307 2.143 20 0 BEADRP C[C@@]1([NH2+]CC2CC[NH2+]CC2)CC=CCC1 ZINC000334853301 384741435 /nfs/dbraw/zinc/74/14/35/384741435.db2.gz JGCPMKDLDQVZRB-CYBMUJFWSA-N 2 0 208.349 2.074 20 0 BEADRP CC(C)CC[NH2+][C@@H]1CC[N@H+](C)[C@@H]2CCC[C@@H]21 ZINC000375852033 384825465 /nfs/dbraw/zinc/82/54/65/384825465.db2.gz NBBOPOWNCLCSCR-MGPQQGTHSA-N 2 0 224.392 2.495 20 0 BEADRP CC(C)CC[NH2+][C@@H]1CC[N@H+](C)[C@@H]2CCC[C@H]21 ZINC000375852031 384825945 /nfs/dbraw/zinc/82/59/45/384825945.db2.gz NBBOPOWNCLCSCR-BFHYXJOUSA-N 2 0 224.392 2.495 20 0 BEADRP Cc1ccc(CN[C@H]2CC[N@H+](C)[C@H](C)C2)nc1C ZINC000314149337 384828708 /nfs/dbraw/zinc/82/87/08/384828708.db2.gz KSOJBPBDTBWESB-OCCSQVGLSA-N 2 0 247.386 2.271 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H]2CC[C@H]2C2CCC2)C1 ZINC000423360604 384835804 /nfs/dbraw/zinc/83/58/04/384835804.db2.gz FWOKTAAENASYJF-ZOBORPQBSA-N 2 0 222.376 2.425 20 0 BEADRP CC(C)[C@@H]1CC[C@H]1[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000423243975 384785542 /nfs/dbraw/zinc/78/55/42/384785542.db2.gz HAHPVDAOXQVEHR-FRRDWIJNSA-N 2 0 210.365 2.010 20 0 BEADRP Cc1cc(C)cc(C[N@H+](C)CCC[NH3+])c1 ZINC000038076701 384785871 /nfs/dbraw/zinc/78/58/71/384785871.db2.gz FABCOFJIFXQTGM-UHFFFAOYSA-N 2 0 206.333 2.084 20 0 BEADRP CCN(CC[NH2+]C(C1CC1)C1CC1)C1CC1 ZINC000053377236 384786778 /nfs/dbraw/zinc/78/67/78/384786778.db2.gz QJMRBJURAACUJN-UHFFFAOYSA-N 2 0 222.376 2.249 20 0 BEADRP Cc1cnc(C[NH2+][C@H](C)CCCC[NH3+])s1 ZINC000379893212 384801444 /nfs/dbraw/zinc/80/14/44/384801444.db2.gz FYJBHUIGQCVXEE-SECBINFHSA-N 2 0 227.377 2.059 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+]CC1CC(C)(C)C1 ZINC000564826475 384804070 /nfs/dbraw/zinc/80/40/70/384804070.db2.gz PUBIMJFDICXKJZ-AAEUAGOBSA-N 2 0 224.392 2.400 20 0 BEADRP CCCC[N@H+](C[C@@H]1CCC[NH2+]C1)C1CC1 ZINC000042491302 384807596 /nfs/dbraw/zinc/80/75/96/384807596.db2.gz ZZJAGAYGIBTLPM-GFCCVEGCSA-N 2 0 210.365 2.251 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+]C[C@@H]2CC[C@@H]3C[C@@H]3C2)C1 ZINC000403862765 384880431 /nfs/dbraw/zinc/88/04/31/384880431.db2.gz WSURMDYGKVRAJZ-TUVASFSCSA-N 2 0 236.403 2.354 20 0 BEADRP Fc1ccc2c(c1)[C@H]([NH2+]C[C@H]1CCC[NH2+]C1)CC2 ZINC000335516220 384883987 /nfs/dbraw/zinc/88/39/87/384883987.db2.gz JEWCTRRVQBTQLG-XHDPSFHLSA-N 2 0 248.345 2.402 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@H]([NH3+])C1)c1cccc(CO)c1 ZINC000423376898 384849662 /nfs/dbraw/zinc/84/96/62/384849662.db2.gz JFWWSVNWHWOYPO-CQDKDKBSSA-N 2 0 248.370 2.099 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+][C@@H]1CC[NH2+]C[C@@H]1C ZINC000423409070 384856340 /nfs/dbraw/zinc/85/63/40/384856340.db2.gz YMOGHPJDXQAMEX-RVMXOQNASA-N 2 0 210.365 2.009 20 0 BEADRP C[C@@H](CC[NH2+][C@@H]1CO[C@H](C)C1)[NH+]1CCCCC1 ZINC000647201084 384889117 /nfs/dbraw/zinc/88/91/17/384889117.db2.gz ZUDQYYNJNXVMLR-MJBXVCDLSA-N 2 0 240.391 2.018 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+][C@@H]1CC[C@@H]1C1CC1 ZINC000423462829 384960963 /nfs/dbraw/zinc/96/09/63/384960963.db2.gz POEGSZWDKGBRHQ-KXCXXGIZSA-N 2 0 234.387 2.281 20 0 BEADRP COc1ccc(CC[N@@H+]2CC[C@H]([NH3+])C[C@@H]2C)cc1 ZINC000049707596 384898413 /nfs/dbraw/zinc/89/84/13/384898413.db2.gz XRWCGEOGVYZXEM-JSGCOSHPSA-N 2 0 248.370 2.049 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000423446568 384899939 /nfs/dbraw/zinc/89/99/39/384899939.db2.gz SPOXKRGNPHVPJF-ZQDZILKHSA-N 2 0 236.403 2.399 20 0 BEADRP C[C@@H]([NH3+])[C@@H]1CCC[N@H+](Cc2cccc(F)c2)C1 ZINC000111763715 384902780 /nfs/dbraw/zinc/90/27/80/384902780.db2.gz HUMWVAHQAOEDDW-DGCLKSJQSA-N 2 0 236.334 2.385 20 0 BEADRP CC[NH2+]CC1CC[NH+](Cc2ccc(C)cn2)CC1 ZINC000156608262 384904643 /nfs/dbraw/zinc/90/46/43/384904643.db2.gz JYDXFPKTVWKLON-UHFFFAOYSA-N 2 0 247.386 2.212 20 0 BEADRP CC[C@H]([NH2+][C@H](C)CN(C)C(C)C)[C@@H]1CCOC1 ZINC000310236582 384917825 /nfs/dbraw/zinc/91/78/25/384917825.db2.gz AJENJELJLLXGHH-MCIONIFRSA-N 2 0 242.407 2.120 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC(C)(C)OC1(C)C)C[NH+](C)C ZINC000310254471 384926759 /nfs/dbraw/zinc/92/67/59/384926759.db2.gz OWADLSAUFKUFKO-NEPJUHHUSA-N 2 0 242.407 2.120 20 0 BEADRP C[C@@H](C[NH2+][C@@H]1CC(C)(C)OC1(C)C)C[NH+](C)C ZINC000310254472 384927905 /nfs/dbraw/zinc/92/79/05/384927905.db2.gz OWADLSAUFKUFKO-NWDGAFQWSA-N 2 0 242.407 2.120 20 0 BEADRP C[C@@H](NC[C@@H]1CCC[N@H+](C)C1)c1ccoc1 ZINC000087290075 384936259 /nfs/dbraw/zinc/93/62/59/384936259.db2.gz GIVRKPQGKQCSNU-NEPJUHHUSA-N 2 0 222.332 2.272 20 0 BEADRP CSCC[C@H](C)[N@H+](C)CC[C@@H]1CCC[NH2+]C1 ZINC000164183106 384936899 /nfs/dbraw/zinc/93/68/99/384936899.db2.gz IBLBEKZCDIDESR-STQMWFEESA-N 2 0 244.448 2.450 20 0 BEADRP Cc1ccc(CC[N@@H+](C)CC(C)(C)C[NH3+])cc1 ZINC000258756721 384938902 /nfs/dbraw/zinc/93/89/02/384938902.db2.gz MOJLGQHEDSLBBG-UHFFFAOYSA-N 2 0 234.387 2.454 20 0 BEADRP F[C@H]1CC[C@H]([NH2+]C2CC[NH+](CC3CC3)CC2)C1 ZINC000557446928 384945297 /nfs/dbraw/zinc/94/52/97/384945297.db2.gz VRPQMWLRVWHMOS-JSGCOSHPSA-N 2 0 240.366 2.341 20 0 BEADRP Cc1cc(C)c(C[NH2+]CC(C)(C)[NH3+])c(C)c1 ZINC000258766503 384945209 /nfs/dbraw/zinc/94/52/09/384945209.db2.gz HMNVFITZZGRDTP-UHFFFAOYSA-N 2 0 220.360 2.439 20 0 BEADRP Fc1ccc(C[NH2+]CC[C@H]2CC[NH2+]C2)cc1F ZINC000258873260 384947359 /nfs/dbraw/zinc/94/73/59/384947359.db2.gz AWRCYKZGMMGOMD-SNVBAGLBSA-N 2 0 240.297 2.054 20 0 BEADRP Cc1ccc(C[N@H+]2CC[C@H]([NH3+])C[C@@H]2C)s1 ZINC000050225605 384986355 /nfs/dbraw/zinc/98/63/55/384986355.db2.gz XDFPYVIBHICQNK-ONGXEEELSA-N 2 0 224.373 2.368 20 0 BEADRP C[NH+](C)CCCC(C)(C)[NH2+]Cc1ccns1 ZINC000404433096 384991110 /nfs/dbraw/zinc/99/11/10/384991110.db2.gz AJLFOUXCPGFKGY-UHFFFAOYSA-N 2 0 241.404 2.353 20 0 BEADRP c1ccc(C[NH2+]CCC[C@@H]2CCC[NH2+]2)cc1 ZINC000306496631 385001535 /nfs/dbraw/zinc/00/15/35/385001535.db2.gz XZGVRKBUMXHMCC-CQSZACIVSA-N 2 0 218.344 2.308 20 0 BEADRP [NH3+]CCC[NH2+][C@@H]1CCCC12CCCCC2 ZINC000312983563 385016273 /nfs/dbraw/zinc/01/62/73/385016273.db2.gz DVVRWYOBPLYQHI-GFCCVEGCSA-N 2 0 210.365 2.428 20 0 BEADRP CC(C)[C@H]1CC[C@@H](C)C[C@@H]1[NH2+][C@@H]1CC[NH2+]C1 ZINC000226435036 385019713 /nfs/dbraw/zinc/01/97/13/385019713.db2.gz XDURAUDPZJQLCS-SYQHCUMBSA-N 2 0 224.392 2.399 20 0 BEADRP COc1cccc([C@H](C)[NH2+][C@H]2C[C@H]([NH3+])C2(C)C)c1 ZINC000404759381 385051546 /nfs/dbraw/zinc/05/15/46/385051546.db2.gz BHHBBSQUIFHBIA-BPNCWPANSA-N 2 0 248.370 2.472 20 0 BEADRP CCN(C)CC[NH2+][C@@H]1CCCCC1(C)C ZINC000086845105 385051679 /nfs/dbraw/zinc/05/16/79/385051679.db2.gz CNNWDHRCFMSENW-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP CC1(C)[C@H]([NH2+]CC2CCCCC2)C[C@@H]1[NH3+] ZINC000404783215 385065014 /nfs/dbraw/zinc/06/50/14/385065014.db2.gz DGZLXPPDWDQTFS-NWDGAFQWSA-N 2 0 210.365 2.282 20 0 BEADRP CC1(C)[C@@H]([NH3+])C[C@@H]1[NH2+]CC1CCCCC1 ZINC000404783216 385065092 /nfs/dbraw/zinc/06/50/92/385065092.db2.gz DGZLXPPDWDQTFS-RYUDHWBXSA-N 2 0 210.365 2.282 20 0 BEADRP Cc1c[nH+]ccc1N[C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000226880658 385066993 /nfs/dbraw/zinc/06/69/93/385066993.db2.gz IVPOFJXYCKRAHG-NWDGAFQWSA-N 2 0 219.332 2.285 20 0 BEADRP CC1=CC[C@H]([NH2+][C@H](C)CC[NH+](C)C)CC1 ZINC000518411650 385079339 /nfs/dbraw/zinc/07/93/39/385079339.db2.gz RCZYMRYKQMDKIS-OLZOCXBDSA-N 2 0 210.365 2.415 20 0 BEADRP CC(C)[C@@H]1CC[C@@H]1[NH2+][C@H]1CCCC[NH2+]C1 ZINC000423567887 385029400 /nfs/dbraw/zinc/02/94/00/385029400.db2.gz VGLMBZKCAPEEFQ-AVGNSLFASA-N 2 0 210.365 2.153 20 0 BEADRP CCOc1ccc(C[N@@H+]2CC[C@@H]([NH3+])[C@@H](C)C2)cc1 ZINC000227055199 385087238 /nfs/dbraw/zinc/08/72/38/385087238.db2.gz BTFFKLRFYNDOMV-SWLSCSKDSA-N 2 0 248.370 2.254 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+][C@@H]1CC[C@H](C)C[C@@H]1C ZINC000300025153 385093883 /nfs/dbraw/zinc/09/38/83/385093883.db2.gz QVSMPQDQXSQHAQ-XDQVBPFNSA-N 2 0 242.407 2.155 20 0 BEADRP CC(C)CCC[N@@H+]1CC[C@@H]2[NH2+]CC[C@H]2C1 ZINC000308823641 385193952 /nfs/dbraw/zinc/19/39/52/385193952.db2.gz HFEDIZAONRTMOW-STQMWFEESA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H](C[NH2+]C[C@H]1CCC[NH2+]1)c1ccccc1 ZINC000235115614 385196162 /nfs/dbraw/zinc/19/61/62/385196162.db2.gz UVTLDDMWTYUECZ-GXTWGEPZSA-N 2 0 218.344 2.132 20 0 BEADRP CSC1(C[NH2+]CCCC[NH+](C)C)CCC1 ZINC000308830285 385197933 /nfs/dbraw/zinc/19/79/33/385197933.db2.gz SZUFFQNBXLGRGA-UHFFFAOYSA-N 2 0 230.421 2.204 20 0 BEADRP CC(C)[N@H+](C)CCN[C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000227540422 385158296 /nfs/dbraw/zinc/15/82/96/385158296.db2.gz JUSCZQKTPWFNLG-HUUCEWRRSA-N 2 0 247.386 2.061 20 0 BEADRP CC/C=C\CC[N@@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC000644784174 385168411 /nfs/dbraw/zinc/16/84/11/385168411.db2.gz GTXSFJOHKOJEKF-WSNITJDQSA-N 2 0 222.376 2.370 20 0 BEADRP CCSCCC[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@@H]1C ZINC000300990043 385221497 /nfs/dbraw/zinc/22/14/97/385221497.db2.gz VSZFFQNMZRHCCS-RWMBFGLXSA-N 2 0 244.448 2.448 20 0 BEADRP CC(C)C[C@@H](C)C[C@@H](C)[NH2+]CCC[NH3+] ZINC000308851068 385221676 /nfs/dbraw/zinc/22/16/76/385221676.db2.gz RGWMNOWTMHRVHI-VXGBXAGGSA-N 2 0 200.370 2.386 20 0 BEADRP C[C@@H]1CC[N@H+](CC2CCCC2)C[C@@H]1C[NH3+] ZINC000164652215 385224010 /nfs/dbraw/zinc/22/40/10/385224010.db2.gz HTQOJEGDNHYITG-YPMHNXCESA-N 2 0 210.365 2.093 20 0 BEADRP C[C@H](CCC1CC1)[NH2+][C@@H](C)CC[NH+](C)C ZINC000308874020 385238770 /nfs/dbraw/zinc/23/87/70/385238770.db2.gz RVYACOQPMFJNJB-NEPJUHHUSA-N 2 0 212.381 2.495 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H]2CCC[C@H]3C[C@H]32)C1 ZINC000304562946 385239082 /nfs/dbraw/zinc/23/90/82/385239082.db2.gz LOBJZUAVAZXHEG-RQJABVFESA-N 2 0 222.376 2.106 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CC1CCSCC1 ZINC000308889694 385244255 /nfs/dbraw/zinc/24/42/55/385244255.db2.gz XTAHAIYLUQEPQR-NSHDSACASA-N 2 0 230.421 2.237 20 0 BEADRP Cc1ccc(C[N@H+]2C[C@H](C[NH3+])C[C@H]2C)cc1C ZINC000228064149 385323940 /nfs/dbraw/zinc/32/39/40/385323940.db2.gz XERLLWGCXCOUPZ-HIFRSBDPSA-N 2 0 232.371 2.473 20 0 BEADRP C[C@@H]([NH2+]CCCC[NH3+])c1ccc(F)cc1F ZINC000037714961 385309769 /nfs/dbraw/zinc/30/97/69/385309769.db2.gz DCEXBPAWNYUVMP-SECBINFHSA-N 2 0 228.286 2.354 20 0 BEADRP CN1CCC([NH2+][C@@H]2CCC23CCC3)CC1 ZINC000308950201 385311625 /nfs/dbraw/zinc/31/16/25/385311625.db2.gz OVLXXNFZQNYFSJ-GFCCVEGCSA-N 2 0 208.349 2.003 20 0 BEADRP C[N@H+]1CC=C(C[NH2+][C@H]2CCC2(C)C)CC1 ZINC000308950227 385312123 /nfs/dbraw/zinc/31/21/23/385312123.db2.gz OWUPLNSRBKJBKC-LBPRGKRZSA-N 2 0 208.349 2.027 20 0 BEADRP [NH3+]C[C@H]1CC[N@H+](Cc2ccnc3ccccc23)C1 ZINC000065461366 385314761 /nfs/dbraw/zinc/31/47/61/385314761.db2.gz OFQDAAAUSJUOQN-GFCCVEGCSA-N 2 0 241.338 2.015 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C2CCC2)[C@H]2CCC[C@H]21 ZINC000308924853 385297500 /nfs/dbraw/zinc/29/75/00/385297500.db2.gz HXXNZNYTIBFCLI-FRRDWIJNSA-N 2 0 208.349 2.001 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)C1(C)CC1 ZINC000037485297 385301584 /nfs/dbraw/zinc/30/15/84/385301584.db2.gz BTKOKAVPNQUBFC-RYUDHWBXSA-N 2 0 222.376 2.249 20 0 BEADRP C[C@@H]([NH2+]C[C@@H](C)C[NH3+])c1ccccc1F ZINC000308993929 385335815 /nfs/dbraw/zinc/33/58/15/385335815.db2.gz OSWUDVYFKQBCGF-VHSXEESVSA-N 2 0 210.296 2.071 20 0 BEADRP C[NH+](C)CCC[NH2+][C@H]1CCCNc2ccccc21 ZINC000192593058 385365217 /nfs/dbraw/zinc/36/52/17/385365217.db2.gz ZCIHTLFBUXAXNH-HNNXBMFYSA-N 2 0 247.386 2.475 20 0 BEADRP Cc1ccc(C[N@H+]2C[C@H](C[NH3+])C[C@H]2C)c(C)c1 ZINC000228065131 385325318 /nfs/dbraw/zinc/32/53/18/385325318.db2.gz GZXLNDPIBQVYBH-KGLIPLIRSA-N 2 0 232.371 2.473 20 0 BEADRP CC(C)C1(C[NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)CC1 ZINC000181263119 385405140 /nfs/dbraw/zinc/40/51/40/385405140.db2.gz DKPQENVAVJJFCJ-STQMWFEESA-N 2 0 224.392 2.495 20 0 BEADRP CC(C)N(C)C[C@@H](C)[NH2+]C[C@H]1CCSC1 ZINC000309075398 385406124 /nfs/dbraw/zinc/40/61/24/385406124.db2.gz JRNMQYZXWATVMF-VXGBXAGGSA-N 2 0 230.421 2.058 20 0 BEADRP CSC1(C[NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)CCC1 ZINC000193801984 385413220 /nfs/dbraw/zinc/41/32/20/385413220.db2.gz HGZFGNLTYXVSTL-NEPJUHHUSA-N 2 0 242.432 2.344 20 0 BEADRP C(C[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1)C1CCCCCC1 ZINC000394611653 385418354 /nfs/dbraw/zinc/41/83/54/385418354.db2.gz HZTJQJSNBCGMRO-GASCZTMLSA-N 2 0 236.403 2.498 20 0 BEADRP CC(C)=CCC[NH2+][C@H]1CC[N@@H+](C)C[C@H]1C ZINC000309145772 385438630 /nfs/dbraw/zinc/43/86/30/385438630.db2.gz VCOQMJZTAISERF-OLZOCXBDSA-N 2 0 210.365 2.273 20 0 BEADRP CCCCN(C)C[C@H](C)[NH2+][C@H](C)C1CC1 ZINC000309172068 385447659 /nfs/dbraw/zinc/44/76/59/385447659.db2.gz LOEORWAWVVRYAX-NWDGAFQWSA-N 2 0 212.381 2.495 20 0 BEADRP CCCCN(C)C[C@@H](C)[NH2+][C@H](C)C1CC1 ZINC000309172070 385448921 /nfs/dbraw/zinc/44/89/21/385448921.db2.gz LOEORWAWVVRYAX-VXGBXAGGSA-N 2 0 212.381 2.495 20 0 BEADRP CCC1CC([NH2+][C@H]2CCN(C)[C@H](C)C2)C1 ZINC000309176629 385451179 /nfs/dbraw/zinc/45/11/79/385451179.db2.gz MXTLLXBUADMFJA-IGJPJIBNSA-N 2 0 210.365 2.247 20 0 BEADRP C[C@@H]1[C@H]([NH2+][C@@H]2CCC2(C)C)CCCN1C ZINC000309144296 385434947 /nfs/dbraw/zinc/43/49/47/385434947.db2.gz URDQASBANGIECO-IJLUTSLNSA-N 2 0 210.365 2.247 20 0 BEADRP C[C@@H]1[C@@H]([NH2+][C@H]2CCC2(C)C)CCCN1C ZINC000309144298 385435143 /nfs/dbraw/zinc/43/51/43/385435143.db2.gz URDQASBANGIECO-WOPDTQHZSA-N 2 0 210.365 2.247 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCc2ccc(O)cc2)CC[N@@H+]1C ZINC000156113418 385436536 /nfs/dbraw/zinc/43/65/36/385436536.db2.gz STRYNYQFCVQJRC-TZMCWYRMSA-N 2 0 248.370 2.007 20 0 BEADRP CCC(CC)C[NH2+][C@H]1CC[NH2+]CC[C@@H]1C ZINC000422863272 385464490 /nfs/dbraw/zinc/46/44/90/385464490.db2.gz RNXPPDVLBYQAGJ-AAEUAGOBSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H](CCc1ccccc1)[NH2+][C@H](C)[C@H](C)[NH3+] ZINC000309247898 385497488 /nfs/dbraw/zinc/49/74/88/385497488.db2.gz NWXLMYVFWXSMOX-FRRDWIJNSA-N 2 0 220.360 2.333 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCN(C)C2CCCC2)[C@H]1C ZINC000309257497 385501423 /nfs/dbraw/zinc/50/14/23/385501423.db2.gz ARKMMSNHEBZPSY-DYEKYZERSA-N 2 0 224.392 2.495 20 0 BEADRP COC(C)(C)[C@H](C)[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000302509840 385534506 /nfs/dbraw/zinc/53/45/06/385534506.db2.gz VCUVECROUXEYJS-RWMBFGLXSA-N 2 0 240.391 2.016 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000319020013 385539015 /nfs/dbraw/zinc/53/90/15/385539015.db2.gz QSQKDZZZCNABLS-SDDRHHMPSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H](CCc1ccccc1)[NH2+]C[C@@H](C)C[NH3+] ZINC000309341400 385541260 /nfs/dbraw/zinc/54/12/60/385541260.db2.gz LCRHFOHXBPTHBA-QWHCGFSZSA-N 2 0 220.360 2.192 20 0 BEADRP Cc1ccsc1CC[NH2+][C@H]1CN(C)C[C@H]1C ZINC000309356245 385548319 /nfs/dbraw/zinc/54/83/19/385548319.db2.gz AFOJIIFAJLVQBM-NEPJUHHUSA-N 2 0 238.400 2.139 20 0 BEADRP Cc1c[nH+]ccc1N[C@@H]1CCC[N@H+](C)[C@H]1C ZINC000309375703 385555910 /nfs/dbraw/zinc/55/59/10/385555910.db2.gz COWGXTJESPAESA-WCQYABFASA-N 2 0 219.332 2.285 20 0 BEADRP CCSCC[NH2+]C[C@H](C)C[NH+]1CCCCC1 ZINC000309409118 385572613 /nfs/dbraw/zinc/57/26/13/385572613.db2.gz BMKRBKZJGZKVNS-ZDUSSCGKSA-N 2 0 244.448 2.451 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)CCC[NH3+])c1cccc(O)c1 ZINC000336649818 385594740 /nfs/dbraw/zinc/59/47/40/385594740.db2.gz HBLUCWYFFVIUTH-WDEREUQCSA-N 2 0 222.332 2.170 20 0 BEADRP c1ccc([C@H]([NH2+]C2CC[NH2+]CC2)C2CC2)cc1 ZINC000038041212 385599503 /nfs/dbraw/zinc/59/95/03/385599503.db2.gz SEYBDHBWNKXQIL-HNNXBMFYSA-N 2 0 230.355 2.479 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@H](C)Cc1ccccc1C ZINC000414848358 385614710 /nfs/dbraw/zinc/61/47/10/385614710.db2.gz WUSYOGZZOSGAHC-GXTWGEPZSA-N 2 0 234.387 2.371 20 0 BEADRP CC(C)[C@@H]1C[C@H]([NH2+]CCCC[NH+](C)C)CS1 ZINC000336678802 385619180 /nfs/dbraw/zinc/61/91/80/385619180.db2.gz QOWWHUJFZXZENG-STQMWFEESA-N 2 0 244.448 2.448 20 0 BEADRP CCCC[C@@H](COC)[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000414848842 385620340 /nfs/dbraw/zinc/62/03/40/385620340.db2.gz XNLYTSZVYBHGFB-KGLIPLIRSA-N 2 0 242.407 2.171 20 0 BEADRP CC(C)[C@H](C)[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000336652109 385641805 /nfs/dbraw/zinc/64/18/05/385641805.db2.gz FLBGEPHZCYVJOJ-LBPRGKRZSA-N 2 0 224.392 2.495 20 0 BEADRP C1CCC2(C1)CCC[C@H]2[NH2+]C1CC[NH2+]CC1 ZINC000335452730 385650977 /nfs/dbraw/zinc/65/09/77/385650977.db2.gz RKOABOJARSXNJA-CYBMUJFWSA-N 2 0 222.376 2.441 20 0 BEADRP C[C@@H]([NH2+]Cc1ccc(F)cc1)[C@@H]1CCC[NH2+]C1 ZINC000414851873 385658559 /nfs/dbraw/zinc/65/85/59/385658559.db2.gz JLVWGJCBTSYUPH-DGCLKSJQSA-N 2 0 236.334 2.303 20 0 BEADRP C[C@H]([NH2+]Cc1ccc(F)cc1)[C@@H]1CCC[NH2+]C1 ZINC000414851877 385659257 /nfs/dbraw/zinc/65/92/57/385659257.db2.gz JLVWGJCBTSYUPH-WCQYABFASA-N 2 0 236.334 2.303 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CCC(C)C)[C@@H](C)C1 ZINC000221703207 385689433 /nfs/dbraw/zinc/68/94/33/385689433.db2.gz GHFFQHKDQDJCJY-QWHCGFSZSA-N 2 0 212.381 2.352 20 0 BEADRP COCC[C@H]1CCC[C@H]1[NH2+]CCCC[NH+](C)C ZINC000337500038 385693248 /nfs/dbraw/zinc/69/32/48/385693248.db2.gz AOKMYXNIOAUHRT-ZIAGYGMSSA-N 2 0 242.407 2.123 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)o1 ZINC000647792828 385695692 /nfs/dbraw/zinc/69/56/92/385695692.db2.gz AEXKJEUXUPRZQN-MGPQQGTHSA-N 2 0 248.370 2.108 20 0 BEADRP Cc1csc(C[NH2+]CCC[C@@H]2CCC[NH2+]2)n1 ZINC000336686138 385698113 /nfs/dbraw/zinc/69/81/13/385698113.db2.gz UMXGIPUPCODKIT-LLVKDONJSA-N 2 0 239.388 2.073 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@H]2CCC[C@@H]21)C1CC1 ZINC000309576750 385709817 /nfs/dbraw/zinc/70/98/17/385709817.db2.gz PEBXKBQERWLNBE-ASEORRQLSA-N 2 0 222.376 2.247 20 0 BEADRP CCCC[C@@H](COC)[NH2+][C@@H](CN)CC(C)C ZINC000414856406 385711279 /nfs/dbraw/zinc/71/12/79/385711279.db2.gz YXUULHHYEOLDFX-QWHCGFSZSA-N 2 0 230.396 2.155 20 0 BEADRP CCCC[C@H](COC)[NH2+][C@@H](CN)CC(C)C ZINC000414856404 385711749 /nfs/dbraw/zinc/71/17/49/385711749.db2.gz YXUULHHYEOLDFX-CHWSQXEVSA-N 2 0 230.396 2.155 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]Cc1ccc(C(F)(F)F)cc1 ZINC000336691042 385727536 /nfs/dbraw/zinc/72/75/36/385727536.db2.gz HLSBAXFOWOYFTF-SECBINFHSA-N 2 0 246.276 2.390 20 0 BEADRP CCCc1cccc(C[NH2+]CCC[NH2+]C)c1 ZINC000414857530 385729422 /nfs/dbraw/zinc/72/94/22/385729422.db2.gz DSGVBJOVZQHHJV-UHFFFAOYSA-N 2 0 220.360 2.338 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000414858949 385734277 /nfs/dbraw/zinc/73/42/77/385734277.db2.gz LQUDVNLADCUDAO-NXEZZACHSA-N 2 0 238.297 2.307 20 0 BEADRP C[NH2+]CCC[NH2+]CCSCc1ccccc1 ZINC000414858666 385736478 /nfs/dbraw/zinc/73/64/78/385736478.db2.gz KLQHPUXROSMDDD-UHFFFAOYSA-N 2 0 238.400 2.119 20 0 BEADRP CC[C@H]1CCC[C@@H](C[NH2+]CCC[NH2+]C)C1 ZINC000414859805 385738644 /nfs/dbraw/zinc/73/86/44/385738644.db2.gz NXECSKXEWXHLQI-QWHCGFSZSA-N 2 0 212.381 2.402 20 0 BEADRP CC1(C)CC(C[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)C1 ZINC000647794998 385741454 /nfs/dbraw/zinc/74/14/54/385741454.db2.gz HNAPOYJXRVIWKK-BFHYXJOUSA-N 2 0 236.403 2.400 20 0 BEADRP C[C@H]([NH2+]Cc1cccs1)[C@H]1CCC[NH2+]C1 ZINC000414860813 385743471 /nfs/dbraw/zinc/74/34/71/385743471.db2.gz VVIXUENGQCTBEX-QWRGUYRKSA-N 2 0 224.373 2.226 20 0 BEADRP C[NH2+]CCC[NH2+][C@H](C)[C@H](C)c1ccccc1 ZINC000414861668 385751424 /nfs/dbraw/zinc/75/14/24/385751424.db2.gz SSHMKSQTACKNKQ-QWHCGFSZSA-N 2 0 220.360 2.378 20 0 BEADRP C[C@H](CCC1CC1)[NH2+]CC1CC[NH+](C)CC1 ZINC000186321680 385755600 /nfs/dbraw/zinc/75/56/00/385755600.db2.gz KLDGHBYBSYDCHB-GFCCVEGCSA-N 2 0 224.392 2.497 20 0 BEADRP C([NH2+][C@@H]1CCC[C@@H]1C1CC1)[C@@H]1CCC[NH2+]C1 ZINC000414863897 385762306 /nfs/dbraw/zinc/76/23/06/385762306.db2.gz YKTLSCUCRXOUMG-MRVWCRGKSA-N 2 0 222.376 2.154 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]CCCOC1CCCCC1 ZINC000336701715 385769989 /nfs/dbraw/zinc/76/99/89/385769989.db2.gz JWPJUDGCUGYRQX-ZDUSSCGKSA-N 2 0 242.407 2.443 20 0 BEADRP CC(C)[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCCNC1 ZINC000414866511 385779838 /nfs/dbraw/zinc/77/98/38/385779838.db2.gz NATUJLVBXAPYSU-AGIUHOORSA-N 2 0 210.365 2.153 20 0 BEADRP CSC1(C[NH2+][C@H](C)C2CC2)CC[NH+](C)CC1 ZINC000336709519 385797770 /nfs/dbraw/zinc/79/77/70/385797770.db2.gz RIFVQVRKHMZCIG-LLVKDONJSA-N 2 0 242.432 2.202 20 0 BEADRP CC(C)C1(C[N@@H+]2CC[C@@H](C[NH+](C)C)C2)CC1 ZINC000638077465 385797808 /nfs/dbraw/zinc/79/78/08/385797808.db2.gz TYKVHWIDTYXSNZ-ZDUSSCGKSA-N 2 0 224.392 2.306 20 0 BEADRP c1coc([C@@H]2C[C@H]2[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)c1 ZINC000647799625 385800826 /nfs/dbraw/zinc/80/08/26/385800826.db2.gz MPMISCQSQRJMRU-ODXJTPSBSA-N 2 0 246.354 2.113 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CCc3ccccc3C2)CC[NH2+]1 ZINC000414947436 385802871 /nfs/dbraw/zinc/80/28/71/385802871.db2.gz KVBFWHLEHRSJIX-UHOFOFEASA-N 2 0 244.382 2.274 20 0 BEADRP C[C@@H](C[NH2+][C@@H]1CCC(C)(C)C1)C[NH+](C)C ZINC000336713369 385806397 /nfs/dbraw/zinc/80/63/97/385806397.db2.gz VLRRGEPZQAKKME-NWDGAFQWSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H](C[NH2+][C@H](C)[C@H]1CCCC[NH2+]1)CC(F)F ZINC000647800559 385807445 /nfs/dbraw/zinc/80/74/45/385807445.db2.gz FGYWEMBRTHSLFL-GMTAPVOTSA-N 2 0 234.334 2.398 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]Cc1ccc(F)cc1 ZINC000336716042 385814289 /nfs/dbraw/zinc/81/42/89/385814289.db2.gz WXDFRIYWJAFBQW-JTQLQIEISA-N 2 0 210.296 2.043 20 0 BEADRP CC(C)[C@H]1CCC[N@@H+]1CC1CC[NH2+]CC1 ZINC000084126116 385857226 /nfs/dbraw/zinc/85/72/26/385857226.db2.gz ZHCBZNDBNUMBLH-CYBMUJFWSA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@H](C[NH+]1CCC(CC[NH+](C)C)CC1)OC ZINC000412980994 385819538 /nfs/dbraw/zinc/81/95/38/385819538.db2.gz ZIVWVKGXRWSDCR-CQSZACIVSA-N 2 0 242.407 2.075 20 0 BEADRP Cc1ccncc1[C@@H](C)[NH2+]CC1=CC[N@H+](C)CC1 ZINC000271869224 385857538 /nfs/dbraw/zinc/85/75/38/385857538.db2.gz MGJIZVSSHZHGNS-CYBMUJFWSA-N 2 0 245.370 2.303 20 0 BEADRP CC[C@@H](C[N@H+](C)CC[C@H]1CCCC[NH+]1C)OC ZINC000412977221 385823257 /nfs/dbraw/zinc/82/32/57/385823257.db2.gz LBLIFVUXXYPOTP-KGLIPLIRSA-N 2 0 242.407 2.218 20 0 BEADRP CC[C@@H](C[N@H+](C)CC[C@@H]1CCCC[NH+]1C)OC ZINC000412977220 385823688 /nfs/dbraw/zinc/82/36/88/385823688.db2.gz LBLIFVUXXYPOTP-KBPBESRZSA-N 2 0 242.407 2.218 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+]C[C@H](C)CC(C)C ZINC000414953236 385831711 /nfs/dbraw/zinc/83/17/11/385831711.db2.gz JJNFWJDZKYGGKG-VXGBXAGGSA-N 2 0 200.370 2.256 20 0 BEADRP Cc1oc2ccccc2c1C[NH2+]C[C@H](C)C[NH3+] ZINC000414869589 385837282 /nfs/dbraw/zinc/83/72/82/385837282.db2.gz ARADTSKHQNCXDN-SNVBAGLBSA-N 2 0 232.327 2.426 20 0 BEADRP C[NH2+]Cc1cccc(N[C@H](C)C[C@@H]2CCC[NH2+]2)c1 ZINC000414869483 385838125 /nfs/dbraw/zinc/83/81/25/385838125.db2.gz QXCUYJXLRYQRHH-OCCSQVGLSA-N 2 0 247.386 2.349 20 0 BEADRP CCC1CC([NH2+]CC2CC[NH+](C)CC2)C1 ZINC000336725298 385838434 /nfs/dbraw/zinc/83/84/34/385838434.db2.gz GCWLUPMIRFMCJI-UHFFFAOYSA-N 2 0 210.365 2.106 20 0 BEADRP FC1CCC(C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)CC1 ZINC000647804791 385839134 /nfs/dbraw/zinc/83/91/34/385839134.db2.gz ZDJBGKUAOZWUED-LJZITESISA-N 2 0 240.366 2.387 20 0 BEADRP C[C@@H]1SCC[C@@H]1[NH2+][C@H]1CCCCC[C@@H]1[NH3+] ZINC000647804204 385841000 /nfs/dbraw/zinc/84/10/00/385841000.db2.gz LJLAVHQDEVUWHI-BJDJZHNGSA-N 2 0 228.405 2.130 20 0 BEADRP C[C@H]([NH2+]CCN1CCCCC1)[C@H]1CC1(C)C ZINC000336741040 385846989 /nfs/dbraw/zinc/84/69/89/385846989.db2.gz MVSGRZQHDYYGDL-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@H](Cc1ccccc1)[NH2+]C[C@H](C)C[NH3+] ZINC000414870694 385849666 /nfs/dbraw/zinc/84/96/66/385849666.db2.gz CDUSHZDIAVOZLV-TZMCWYRMSA-N 2 0 220.360 2.192 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]CC2([NH3+])CCC2)C[C@@H]1C ZINC000414870846 385852787 /nfs/dbraw/zinc/85/27/87/385852787.db2.gz CREZVGNJRXDANR-GRYCIOLGSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)C1([NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)CC1 ZINC000647797903 385792765 /nfs/dbraw/zinc/79/27/65/385792765.db2.gz GUPGWCKHNOLXIU-JHJVBQTASA-N 2 0 222.376 2.153 20 0 BEADRP CCOc1ccc(C[NH2+][C@H]2CC[NH2+][C@@H](C)C2)cc1 ZINC000414945790 385793009 /nfs/dbraw/zinc/79/30/09/385793009.db2.gz IWKVQKWDNFKORQ-JSGCOSHPSA-N 2 0 248.370 2.315 20 0 BEADRP CC(C)CC1(C[NH2+][C@H]2CN(C)C[C@@H]2C)CC1 ZINC000309697495 385797411 /nfs/dbraw/zinc/79/74/11/385797411.db2.gz RTZBPFWQOCTRGQ-STQMWFEESA-N 2 0 224.392 2.352 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]C/C=C\c1ccc(F)cc1 ZINC000414874696 385886216 /nfs/dbraw/zinc/88/62/16/385886216.db2.gz IUSVSTPNYRQPGU-OTDNITJGSA-N 2 0 222.307 2.023 20 0 BEADRP C[C@H](N[C@@H]1CC[N@@H+]2CCCC[C@@H]12)c1ccncc1 ZINC000217676914 385891066 /nfs/dbraw/zinc/89/10/66/385891066.db2.gz BDWFGICOJHVPJC-CFVMTHIKSA-N 2 0 245.370 2.359 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H]1CCC[C@@H](C2CC2)C1 ZINC000414875695 385901656 /nfs/dbraw/zinc/90/16/56/385901656.db2.gz KHHKDUSDHNHNSP-RAIGVLPGSA-N 2 0 210.365 2.140 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H]1CCC[C@H](C2CC2)C1 ZINC000414875697 385901663 /nfs/dbraw/zinc/90/16/63/385901663.db2.gz KHHKDUSDHNHNSP-WXHSDQCUSA-N 2 0 210.365 2.140 20 0 BEADRP Cc1cc(N)cc(C[NH2+][C@H](C)C[C@@H]2CCC[NH2+]2)c1 ZINC000414964000 385902427 /nfs/dbraw/zinc/90/24/27/385902427.db2.gz LKFKSBAJPBAJPO-DOMZBBRYSA-N 2 0 247.386 2.197 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+]C/C=C\c1ccc(F)cc1 ZINC000414964270 385902939 /nfs/dbraw/zinc/90/29/39/385902939.db2.gz UQGMCOZCQFWLTN-QADGWQRPSA-N 2 0 248.345 2.427 20 0 BEADRP CS[C@@H]1CC[C@@H]1[NH2+]C1CCC([NH+](C)C)CC1 ZINC000336721720 385906601 /nfs/dbraw/zinc/90/66/01/385906601.db2.gz ZZNZWYQSQVQUMX-IFWUJCSASA-N 2 0 242.432 2.343 20 0 BEADRP CCC[NH2+]CC[NH2+][C@@H]1CCC[C@H]1C(C)C ZINC000414876386 385907566 /nfs/dbraw/zinc/90/75/66/385907566.db2.gz VTHFQUSULYUELM-QWHCGFSZSA-N 2 0 212.381 2.400 20 0 BEADRP FC1(F)CC(C[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)C1 ZINC000334492155 385908252 /nfs/dbraw/zinc/90/82/52/385908252.db2.gz FCEYWOREDMHCNS-NWDGAFQWSA-N 2 0 244.329 2.248 20 0 BEADRP CC(C)=CCC[NH2+][C@H](C)[C@@H]1CCCC[NH2+]1 ZINC000397769937 385912403 /nfs/dbraw/zinc/91/24/03/385912403.db2.gz UPRNRMIJVLQEFL-OLZOCXBDSA-N 2 0 210.365 2.463 20 0 BEADRP CC(C)Cc1ncc(C[NH2+]C[C@H](C)C[NH3+])s1 ZINC000414876984 385916791 /nfs/dbraw/zinc/91/67/91/385916791.db2.gz MDZBKFLISFMEDF-SNVBAGLBSA-N 2 0 241.404 2.026 20 0 BEADRP C([NH2+][C@H]1CCCC12CCCC2)[C@H]1CCC[NH2+]1 ZINC000335033070 385921739 /nfs/dbraw/zinc/92/17/39/385921739.db2.gz OFSBQNVQNBLIQX-OLZOCXBDSA-N 2 0 222.376 2.441 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+]C[C@@H](C)c1ccc(F)cc1 ZINC000414877739 385930106 /nfs/dbraw/zinc/93/01/06/385930106.db2.gz NEHZRLSKBPIVTB-WDEREUQCSA-N 2 0 224.323 2.114 20 0 BEADRP CN(CCC[N@H+](C)CCCF)Cc1ccco1 ZINC000285458812 385927432 /nfs/dbraw/zinc/92/74/32/385927432.db2.gz ADNPKDMSQRVHDD-UHFFFAOYSA-N 2 0 242.338 2.393 20 0 BEADRP [NH3+]C1(C[NH2+][C@H]2CCCC[C@H]2C2CC2)CCC1 ZINC000414872141 385862457 /nfs/dbraw/zinc/86/24/57/385862457.db2.gz FJKZIBMUKPURCZ-STQMWFEESA-N 2 0 222.376 2.426 20 0 BEADRP C[C@H]([NH2+][C@H]1CCSc2ccccc21)C1C[NH2+]C1 ZINC000335037955 385927774 /nfs/dbraw/zinc/92/77/74/385927774.db2.gz JURKQJKZKBFICW-GWCFXTLKSA-N 2 0 248.395 2.421 20 0 BEADRP C[NH2+]Cc1cccc(NCC[NH2+]C(C)(C)C)c1 ZINC000414872222 385865625 /nfs/dbraw/zinc/86/56/25/385865625.db2.gz WESKFVVWQACMHB-UHFFFAOYSA-N 2 0 235.375 2.206 20 0 BEADRP CC[C@@H]1CCC[C@@H](C[NH2+]C[C@H](C)C[NH3+])C1 ZINC000414873723 385878927 /nfs/dbraw/zinc/87/89/27/385878927.db2.gz HTKFKYYDKJPQOU-JHJVBQTASA-N 2 0 212.381 2.387 20 0 BEADRP [NH3+][C@H]1CCCCC[C@H]1[NH2+]CC1CCSCC1 ZINC000335019264 385979112 /nfs/dbraw/zinc/97/91/12/385979112.db2.gz NAPONXLLUPLIIR-QWHCGFSZSA-N 2 0 242.432 2.379 20 0 BEADRP CC1(C)CCC[C@H]([NH2+]CC2([NH3+])CCC2)C1 ZINC000335021766 385982589 /nfs/dbraw/zinc/98/25/89/385982589.db2.gz FBCOECIWLYFVQJ-NSHDSACASA-N 2 0 210.365 2.426 20 0 BEADRP C[C@@H](CCCC(F)(F)F)[NH2+][C@H]1CC[NH2+]C1 ZINC000414881443 385992231 /nfs/dbraw/zinc/99/22/31/385992231.db2.gz KZULKNWMIJSKHV-IUCAKERBSA-N 2 0 224.270 2.059 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+]Cc1ccc(F)cc1 ZINC000335039077 385931469 /nfs/dbraw/zinc/93/14/69/385931469.db2.gz LWVKLXAGZJMOPS-FZMZJTMJSA-N 2 0 236.334 2.303 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@H]1CCC[C@H]1C1CC1 ZINC000414967623 385932021 /nfs/dbraw/zinc/93/20/21/385932021.db2.gz XWHKVTAUWJPBHA-WXHSDQCUSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1Cc2ccccc2[C@@H]1[NH2+]CC1([NH3+])CCC1 ZINC000335056826 385956890 /nfs/dbraw/zinc/95/68/90/385956890.db2.gz ZEUHWLRMBQYUFJ-BXUZGUMPSA-N 2 0 230.355 2.391 20 0 BEADRP C[C@H](c1cccnc1)[N@@H+]1CCC[C@@H]([C@H](C)[NH3+])C1 ZINC000251290035 385960521 /nfs/dbraw/zinc/96/05/21/385960521.db2.gz VFUWQVSYVZGFEA-OUCADQQQSA-N 2 0 233.359 2.202 20 0 BEADRP CC[NH+](CC)CCC[N@H+](C[C@@H](C)OC)C(C)C ZINC000338312365 385962697 /nfs/dbraw/zinc/96/26/97/385962697.db2.gz ICASEHYLYPZRCZ-CQSZACIVSA-N 2 0 244.423 2.464 20 0 BEADRP C[C@@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)C1CCC1 ZINC000414970567 385963184 /nfs/dbraw/zinc/96/31/84/385963184.db2.gz VDDZDBYUIYSHSO-DGCLKSJQSA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@H]1CC[C@H]1[NH2+]CCC[NH+](CC)CC ZINC000336747099 385969042 /nfs/dbraw/zinc/96/90/42/385969042.db2.gz BTAQXWULSKWFFV-QWHCGFSZSA-N 2 0 212.381 2.497 20 0 BEADRP CC[NH+](CC)CCC[N@H+](C)[C@H]1CC1(C)C ZINC000338361588 385970982 /nfs/dbraw/zinc/97/09/82/385970982.db2.gz COQWTPLMAKPDOV-LBPRGKRZSA-N 2 0 212.381 2.449 20 0 BEADRP CCC[C@@H](C)C[NH2+]CC1(COC)CC[NH2+]CC1 ZINC000414971284 385972910 /nfs/dbraw/zinc/97/29/10/385972910.db2.gz IOTQFQPPZUXGHI-CYBMUJFWSA-N 2 0 242.407 2.028 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H](C)CCCC(F)(F)F ZINC000414882298 386012549 /nfs/dbraw/zinc/01/25/49/386012549.db2.gz TXWAMIURNVDRHG-RKDXNWHRSA-N 2 0 226.286 2.292 20 0 BEADRP CC[C@@H]([NH3+])CNCc1ccccc1OC(C)C ZINC000414976118 386014489 /nfs/dbraw/zinc/01/44/89/386014489.db2.gz HKSVXDLBUNQOBW-CYBMUJFWSA-N 2 0 236.359 2.301 20 0 BEADRP CC[C@H]([NH3+])CNCc1coc2ccccc12 ZINC000414977033 386029015 /nfs/dbraw/zinc/02/90/15/386029015.db2.gz JJZSNQVRQNRYEY-NSHDSACASA-N 2 0 218.300 2.260 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)[C@H]1C[C@H]1C ZINC000414191445 386030878 /nfs/dbraw/zinc/03/08/78/386030878.db2.gz RYPGHNVLTJJKGS-MQYQWHSLSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)C1(C)CC1 ZINC000414202932 386039689 /nfs/dbraw/zinc/03/96/89/386039689.db2.gz ZONDGVKEAGMPBV-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)[C@H]1C[C@H]1C ZINC000414159821 386045638 /nfs/dbraw/zinc/04/56/38/386045638.db2.gz YTEIEWYEWOYAJE-XUJVJEKNSA-N 2 0 236.403 2.495 20 0 BEADRP C[NH2+]Cc1ccc(NC[C@H]2CC[NH2+][C@@H](C)C2)cc1 ZINC000414979042 386050511 /nfs/dbraw/zinc/05/05/11/386050511.db2.gz TUZNTUAVZIQGJD-JSGCOSHPSA-N 2 0 247.386 2.206 20 0 BEADRP C(C[NH2+][C@@H]1CCCSC1)C[C@@H]1CCC[NH2+]1 ZINC000414982081 386064564 /nfs/dbraw/zinc/06/45/64/386064564.db2.gz YIIPNNFSKMPHQH-NWDGAFQWSA-N 2 0 228.405 2.004 20 0 BEADRP Cc1cncc([C@H](C)[NH2+]CC2=CC[N@H+](C)CC2)c1 ZINC000274352043 386091945 /nfs/dbraw/zinc/09/19/45/386091945.db2.gz GMZXRWSXGODEKH-ZDUSSCGKSA-N 2 0 245.370 2.303 20 0 BEADRP [NH3+]CCC[N@@H+]1CCC[C@H]1c1cccc(F)c1 ZINC000414676186 386149872 /nfs/dbraw/zinc/14/98/72/386149872.db2.gz NBIDMNZHQLMHLX-ZDUSSCGKSA-N 2 0 222.307 2.311 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[C@H]([NH3+])C1)C1CCC1 ZINC000414991375 386153252 /nfs/dbraw/zinc/15/32/52/386153252.db2.gz BBPJVLLZIWIYNY-LOWVWBTDSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H](CCc1ccccc1)C[NH2+][C@H]1CC[NH2+]C1 ZINC000414893254 386154895 /nfs/dbraw/zinc/15/48/95/386154895.db2.gz YYHYHOCMTMXVOI-ZFWWWQNUSA-N 2 0 232.371 2.207 20 0 BEADRP C[C@H](CC[NH3+])[NH2+]C/C=C/c1ccc(F)cc1 ZINC000414892670 386154948 /nfs/dbraw/zinc/15/49/48/386154948.db2.gz XHURBMVZEPANCK-KXMPLOMGSA-N 2 0 222.307 2.166 20 0 BEADRP COc1ccccc1C[NH2+]C[C@H]1CCC[C@H]([NH3+])C1 ZINC000414992329 386156592 /nfs/dbraw/zinc/15/65/92/386156592.db2.gz KHUNJYFOVNQMCW-JSGCOSHPSA-N 2 0 248.370 2.302 20 0 BEADRP [NH3+][C@H](C[NH2+][C@@H]1CCCC[C@H]1C1CC1)C1CC1 ZINC000414894260 386170881 /nfs/dbraw/zinc/17/08/81/386170881.db2.gz SQJSBYRHXKTXDW-BFHYXJOUSA-N 2 0 222.376 2.282 20 0 BEADRP CC(C)Oc1ccccc1C[NH2+]C[C@H](C)C[NH3+] ZINC000414894352 386173251 /nfs/dbraw/zinc/17/32/51/386173251.db2.gz ZNQPHPDMTCKNMW-GFCCVEGCSA-N 2 0 236.359 2.158 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]C[C@H]([NH3+])C2CC2)[C@H]1C ZINC000414894823 386177865 /nfs/dbraw/zinc/17/78/65/386177865.db2.gz UKRMUOOQBIQXNA-URBCHYCLSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H](CCCC(F)(F)F)[NH2+]C[C@@H]([NH3+])C1CC1 ZINC000414895255 386182854 /nfs/dbraw/zinc/18/28/54/386182854.db2.gz WKBXEVRWQMWLJB-WCBMZHEXSA-N 2 0 238.297 2.434 20 0 BEADRP CC[C@@H]1CCC[C@H]([NH2+]C[C@H]([NH3+])C2CC2)C1 ZINC000414895067 386188036 /nfs/dbraw/zinc/18/80/36/386188036.db2.gz VPDZFLTUQXDDOK-WXHSDQCUSA-N 2 0 210.365 2.282 20 0 BEADRP CC[C@H](C)C[NH2+][C@H]1CCC[C@H]([NH+](C)C)C1 ZINC000093079488 386124575 /nfs/dbraw/zinc/12/45/75/386124575.db2.gz PNCAQOZWCDDGES-AVGNSLFASA-N 2 0 212.381 2.495 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H]2C[C@H]2c2ccco2)[C@@H](C)C1 ZINC000414335094 386126688 /nfs/dbraw/zinc/12/66/88/386126688.db2.gz IZMKKGFLGZRAAZ-RFQIPJPRSA-N 2 0 248.370 2.455 20 0 BEADRP [NH3+]CCC[N@@H+]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000414691845 386189111 /nfs/dbraw/zinc/18/91/11/386189111.db2.gz JVTCFIGXPKGYNV-LBPRGKRZSA-N 2 0 238.762 2.478 20 0 BEADRP CC(C)Oc1ccccc1C[NH2+][C@@H](C)CC[NH3+] ZINC000414890269 386128853 /nfs/dbraw/zinc/12/88/53/386128853.db2.gz UFIXWPNYZLFEAV-LBPRGKRZSA-N 2 0 236.359 2.301 20 0 BEADRP C[N@@H+]1CCC[C@]2(CC[NH+](CCC3CC3)C2)C1 ZINC000334466646 386129130 /nfs/dbraw/zinc/12/91/30/386129130.db2.gz DKKRPNMXFLUQCP-AWEZNQCLSA-N 2 0 222.376 2.204 20 0 BEADRP C[C@@H](CC1CCCC1)[NH2+]C[C@H]([NH3+])C1CC1 ZINC000414891351 386140560 /nfs/dbraw/zinc/14/05/60/386140560.db2.gz NXFMCBFDRFXBKX-GWCFXTLKSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H](CC[NH3+])[NH2+][C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000414891521 386143756 /nfs/dbraw/zinc/14/37/56/386143756.db2.gz ILSJYNNAPOKQIJ-BBBLOLIVSA-N 2 0 238.297 2.434 20 0 BEADRP C[NH+](C)CC1CC[NH+](CC2(C)CCC2)CC1 ZINC000340285295 386203991 /nfs/dbraw/zinc/20/39/91/386203991.db2.gz XARQZLJCLOPRPM-UHFFFAOYSA-N 2 0 224.392 2.450 20 0 BEADRP [NH3+]CCC[N@@H+]1CCC[C@H]1Cc1cccc(F)c1 ZINC000414699542 386205611 /nfs/dbraw/zinc/20/56/11/386205611.db2.gz IRIJVWMTSLEJOB-AWEZNQCLSA-N 2 0 236.334 2.181 20 0 BEADRP C[C@H](CC[NH3+])[NH2+]C[C@@H](C)c1ccc(F)cc1 ZINC000414896771 386206861 /nfs/dbraw/zinc/20/68/61/386206861.db2.gz PUWPHBFCOIWFSQ-GHMZBOCLSA-N 2 0 224.323 2.256 20 0 BEADRP CCOc1ccc(C[NH2+][C@H](C)CC[NH3+])cc1F ZINC000414897263 386215706 /nfs/dbraw/zinc/21/57/06/386215706.db2.gz QXILYHKCNQQBGA-SNVBAGLBSA-N 2 0 240.322 2.051 20 0 BEADRP Oc1ccc([C@H]2CCC[N@@H+]2C[C@H]2CC[NH2+]C2)cc1 ZINC000647882071 386217397 /nfs/dbraw/zinc/21/73/97/386217397.db2.gz HZYHKDVUJAMRDZ-SWLSCSKDSA-N 2 0 246.354 2.139 20 0 BEADRP Oc1ccc([C@@H]2CCC[N@@H+]2C[C@@H]2CC[NH2+]C2)cc1 ZINC000647882069 386218808 /nfs/dbraw/zinc/21/88/08/386218808.db2.gz HZYHKDVUJAMRDZ-DOMZBBRYSA-N 2 0 246.354 2.139 20 0 BEADRP Cc1cccc(CN(C2CC2)[C@H]2CC[NH2+]C2)c1 ZINC000347142658 386260070 /nfs/dbraw/zinc/26/00/70/386260070.db2.gz XAGRWAZVLKGETJ-HNNXBMFYSA-N 2 0 230.355 2.321 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000339066402 386233676 /nfs/dbraw/zinc/23/36/76/386233676.db2.gz BZKLPLKIBXGSBJ-YUELXQCFSA-N 2 0 248.370 2.427 20 0 BEADRP C(C[C@H]1CCC[NH2+]1)[NH2+][C@@H]1CCC[C@@H]1C1CC1 ZINC000414898992 386238663 /nfs/dbraw/zinc/23/86/63/386238663.db2.gz BPIFSDQZXGIONK-MGPQQGTHSA-N 2 0 222.376 2.297 20 0 BEADRP CSCCC[NH+]1CCC(C[NH+](C)C)CC1 ZINC000336643200 386247762 /nfs/dbraw/zinc/24/77/62/386247762.db2.gz BUSSVCDHTIRXPN-UHFFFAOYSA-N 2 0 230.421 2.013 20 0 BEADRP C[C@H]1C[N@H+](CCC[NH3+])CC[C@@H]1c1ccccc1 ZINC000414718846 386249835 /nfs/dbraw/zinc/24/98/35/386249835.db2.gz ZTOKFJGVMVMGRD-ZFWWWQNUSA-N 2 0 232.371 2.461 20 0 BEADRP COc1ccc(C[NH2+]C[C@@H]2CCC[C@@H]([NH3+])C2)cc1 ZINC000415003469 386253793 /nfs/dbraw/zinc/25/37/93/386253793.db2.gz XFQNXUBNXKMAGO-ZIAGYGMSSA-N 2 0 248.370 2.302 20 0 BEADRP CC[N@H+](C[C@H]1CC[NH2+]C1)[C@@H](C)c1cccc(O)c1 ZINC000647880368 386196885 /nfs/dbraw/zinc/19/68/85/386196885.db2.gz NSWXFNYNFLZJHY-STQMWFEESA-N 2 0 248.370 2.385 20 0 BEADRP CC[N@H+](C)C[C@@H]1CC[NH+](CCSC(C)C)C1 ZINC000336663030 386281643 /nfs/dbraw/zinc/28/16/43/386281643.db2.gz AGRDFTLLEZUWOB-ZDUSSCGKSA-N 2 0 244.448 2.402 20 0 BEADRP CC[NH+](CC)C[C@H]1CC[N@H+](CCC2CC2)C1 ZINC000336666805 386294334 /nfs/dbraw/zinc/29/43/34/386294334.db2.gz LHAIIHWPAULLAW-CQSZACIVSA-N 2 0 224.392 2.450 20 0 BEADRP CC[C@H](C)[C@@H]1CCCC[N@@H+]1C[C@@H]1CC[NH2+]C1 ZINC000647886679 386298935 /nfs/dbraw/zinc/29/89/35/386298935.db2.gz IMVIJOYOMSBCBK-MJBXVCDLSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@H](C)[C@H]1CCCC[N@@H+]1C[C@H]1CC[NH2+]C1 ZINC000647886678 386299564 /nfs/dbraw/zinc/29/95/64/386299564.db2.gz IMVIJOYOMSBCBK-MELADBBJSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CC[C@H]([N@H+](C)C[C@H]2CC[NH2+][C@@H](C)C2)C1 ZINC000414737034 386305300 /nfs/dbraw/zinc/30/53/00/386305300.db2.gz IFTNPZXSIFWRBR-RFGFWPKPSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@@H]([NH2+]CCCCOc1ccccc1)[C@H](C)[NH3+] ZINC000415005882 386312228 /nfs/dbraw/zinc/31/22/28/386312228.db2.gz AXEJZDLHBCIQBI-QWHCGFSZSA-N 2 0 236.359 2.171 20 0 BEADRP C[C@@H]1C[C@@H]2CCCC[C@H]2[N@@H+]1C[C@@H]1CC[NH2+]C1 ZINC000647884996 386270775 /nfs/dbraw/zinc/27/07/75/386270775.db2.gz VJZIPQPXLXQQED-YIYPIFLZSA-N 2 0 222.376 2.249 20 0 BEADRP Cc1cc(Cl)ccc1C[NH2+]C1CC[NH2+]CC1 ZINC000335276738 386341176 /nfs/dbraw/zinc/34/11/76/386341176.db2.gz HXTONLDKHJDGEO-UHFFFAOYSA-N 2 0 238.762 2.490 20 0 BEADRP CCC[C@@H]1[C@@H](C)CCC[N@@H+]1C[C@H]1CC[NH2+]C1 ZINC000647889971 386362554 /nfs/dbraw/zinc/36/25/54/386362554.db2.gz CDCZOTCMALWEMK-MELADBBJSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)C[C@H]1CCC[N@H+](C[C@@H]2CC[NH2+]C2)C1 ZINC000647890133 386367529 /nfs/dbraw/zinc/36/75/29/386367529.db2.gz TWIFOQDGLBBYHH-ZIAGYGMSSA-N 2 0 224.392 2.354 20 0 BEADRP CC[N@H+](C)C[C@H]1CC[NH+](CCC2CC2)C1 ZINC000336696111 386374443 /nfs/dbraw/zinc/37/44/43/386374443.db2.gz IHIWISKNEILLDL-CYBMUJFWSA-N 2 0 210.365 2.060 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]CC1(C2CC2)CCC1 ZINC000391466627 386326716 /nfs/dbraw/zinc/32/67/16/386326716.db2.gz QJAWKAMHTIVXGP-WCQYABFASA-N 2 0 222.376 2.284 20 0 BEADRP Cc1ccccc1CC[NH2+][C@H]1CC[N@@H+](C)C[C@@H]1C ZINC000157049200 386329254 /nfs/dbraw/zinc/32/92/54/386329254.db2.gz RLJLOZDBQALZOY-HOCLYGCPSA-N 2 0 246.398 2.467 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](CC3CCCC3)C[C@@H]21 ZINC000230045022 386335863 /nfs/dbraw/zinc/33/58/63/386335863.db2.gz WLFFXPIBHJRZDU-HZSPNIEDSA-N 2 0 222.376 2.236 20 0 BEADRP CCCC[N@@H+]1CC2(C[C@@H]1C)CC[NH2+]CC2 ZINC000335275950 386337045 /nfs/dbraw/zinc/33/70/45/386337045.db2.gz BXYMURNAXIZUKQ-LBPRGKRZSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@@H]2C[C@H]2C2CC[NH2+]CC2)C1 ZINC000415008837 386391684 /nfs/dbraw/zinc/39/16/84/386391684.db2.gz NEJRQJGVXMNHMR-VZZFWQQMSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+][C@@H]2C[C@H]2C2CC[NH2+]CC2)C1 ZINC000415008836 386392215 /nfs/dbraw/zinc/39/22/15/386392215.db2.gz NEJRQJGVXMNHMR-RUZUBIRVSA-N 2 0 222.376 2.153 20 0 BEADRP Cc1ccc(CCC[N@@H+](C)C2CC[NH2+]CC2)cn1 ZINC000339409280 386413787 /nfs/dbraw/zinc/41/37/87/386413787.db2.gz YGYWSFKFKRFHSZ-UHFFFAOYSA-N 2 0 247.386 2.006 20 0 BEADRP c1coc(CC[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)c1 ZINC000093451635 386414020 /nfs/dbraw/zinc/41/40/20/386414020.db2.gz ACTOBCLKHMPQNO-KFWWJZLASA-N 2 0 248.370 2.332 20 0 BEADRP C[C@H](CC1CCOCC1)[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000414909746 386415480 /nfs/dbraw/zinc/41/54/80/386415480.db2.gz CJRMHTJPEXAJOL-KWCYVHTRSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H](C[C@@H]1CCC[NH2+]1)[NH2+]CCc1ccccc1 ZINC000093462325 386417131 /nfs/dbraw/zinc/41/71/31/386417131.db2.gz QURXJOUDYSAHGI-ZFWWWQNUSA-N 2 0 232.371 2.349 20 0 BEADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+][C@@H]1CCCOC1 ZINC000093521174 386418556 /nfs/dbraw/zinc/41/85/56/386418556.db2.gz LVQWYOFXJINCOT-HZSPNIEDSA-N 2 0 240.391 2.066 20 0 BEADRP C[NH+](C)[C@@H]1CCC[N@H+](CCc2ccccn2)CC1 ZINC000277272178 386425157 /nfs/dbraw/zinc/42/51/57/386425157.db2.gz RRFJQCLPCCNSCV-OAHLLOKOSA-N 2 0 247.386 2.040 20 0 BEADRP C[C@H](CCc1ccsc1)[NH2+]CCCC[NH3+] ZINC000414910043 386430721 /nfs/dbraw/zinc/43/07/21/386430721.db2.gz ROMFJKUZVURZQI-LLVKDONJSA-N 2 0 226.389 2.398 20 0 BEADRP CC[C@@H]1C[C@H](C)C[N@@H+]1C[C@@H]1CC[NH2+][C@@H](C)C1 ZINC000399173387 386434181 /nfs/dbraw/zinc/43/41/81/386434181.db2.gz PBOMNUQGPBJWFZ-IGQOVBAYSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H](CN(C)C)[NH2+][C@H](C)C1CCSCC1 ZINC000336742165 386476929 /nfs/dbraw/zinc/47/69/29/386476929.db2.gz WOPIUVZEZVCQSK-GHMZBOCLSA-N 2 0 230.421 2.058 20 0 BEADRP C[C@@H]([NH3+])[C@@H](C)[NH2+][C@H](C)CCC(F)(F)F ZINC000415013123 386494687 /nfs/dbraw/zinc/49/46/87/386494687.db2.gz KFKHSMVJSWWSHZ-BWZBUEFSSA-N 2 0 212.259 2.043 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000415015225 386499252 /nfs/dbraw/zinc/49/92/52/386499252.db2.gz AOJGKIXOGGPOMZ-HZSPNIEDSA-N 3 0 241.423 2.014 20 0 BEADRP COc1ccsc1C[NH2+][C@H](C)CCCC[NH3+] ZINC000415014585 386500601 /nfs/dbraw/zinc/50/06/01/386500601.db2.gz MTKIXTMLQVXOKQ-SNVBAGLBSA-N 2 0 242.388 2.364 20 0 BEADRP COc1ccsc1C[NH2+][C@@H](C)CCCC[NH3+] ZINC000415014583 386501347 /nfs/dbraw/zinc/50/13/47/386501347.db2.gz MTKIXTMLQVXOKQ-JTQLQIEISA-N 2 0 242.388 2.364 20 0 BEADRP C[C@H](CC1CCCC1)[NH2+]C1CC[NH2+]CC1 ZINC000414781970 386501443 /nfs/dbraw/zinc/50/14/43/386501443.db2.gz OBUJDYVVTISBIB-LLVKDONJSA-N 2 0 210.365 2.297 20 0 BEADRP CC(C)[C@H]1C[C@H](C[NH2+][C@H](C)CCC[NH3+])CCO1 ZINC000415017451 386502659 /nfs/dbraw/zinc/50/26/59/386502659.db2.gz FMOFCOGGIOMMOP-MGPQQGTHSA-N 2 0 242.407 2.155 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]C/C=C/c1ccccc1 ZINC000414787881 386529771 /nfs/dbraw/zinc/52/97/71/386529771.db2.gz CVORLGAERQDORQ-YKHJJTLOSA-N 2 0 230.355 2.417 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]C/C=C\c1ccccc1 ZINC000415017807 386503522 /nfs/dbraw/zinc/50/35/22/386503522.db2.gz GDJGLBCOFWDJOH-AGEOTTOMSA-N 2 0 218.344 2.417 20 0 BEADRP C[C@@H](CCC(F)(F)F)[NH2+]CCCC[NH3+] ZINC000414914943 386505896 /nfs/dbraw/zinc/50/58/96/386505896.db2.gz YNQMGFCMSFYEIX-QMMMGPOBSA-N 2 0 212.259 2.046 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+]CC1CCCCC1 ZINC000415049799 386507167 /nfs/dbraw/zinc/50/71/67/386507167.db2.gz YEAJADQCBFEPIQ-LBPRGKRZSA-N 2 0 210.365 2.297 20 0 BEADRP c1c[nH]c(C2CC[NH+](C[C@H]3CCC=CO3)CC2)n1 ZINC000278279611 386508608 /nfs/dbraw/zinc/50/86/08/386508608.db2.gz SWAIWAZHLQUZKA-CYBMUJFWSA-N 2 0 247.342 2.282 20 0 BEADRP Cc1ccc(CCC[NH2+][C@@H](C)CCCC[NH3+])cn1 ZINC000415019780 386509739 /nfs/dbraw/zinc/50/97/39/386509739.db2.gz WGIKVSOKPKHRPE-ZDUSSCGKSA-N 2 0 249.402 2.430 20 0 BEADRP CCOc1ccc(C[NH2+][C@H](C)CCC[NH3+])cc1 ZINC000415023645 386513827 /nfs/dbraw/zinc/51/38/27/386513827.db2.gz NESSSGCDIVTEFK-GFCCVEGCSA-N 2 0 236.359 2.302 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]C[C@H]1CCOc2ccccc21 ZINC000415024632 386513895 /nfs/dbraw/zinc/51/38/95/386513895.db2.gz PGZZWTHMFDZEIC-CHWSQXEVSA-N 2 0 248.370 2.270 20 0 BEADRP C[C@@H](C[NH2+][C@H](C)CCC[NH3+])CC1CCOCC1 ZINC000415025456 386514004 /nfs/dbraw/zinc/51/40/04/386514004.db2.gz QZQRTPZRRYFLEM-CHWSQXEVSA-N 2 0 242.407 2.156 20 0 BEADRP CC(C)CCC[C@H](C)[NH2+]C[C@H]1C[NH2+]CCCO1 ZINC000415028819 386516060 /nfs/dbraw/zinc/51/60/60/386516060.db2.gz AGXZGOAHRPOSRO-UONOGXRCSA-N 2 0 242.407 2.169 20 0 BEADRP CCOc1ccc(C[NH2+][C@H]2CC[C@@H](C[NH3+])C2)cc1 ZINC000415029943 386516259 /nfs/dbraw/zinc/51/62/59/386516259.db2.gz FDSBXTXJIAMHHE-KGLIPLIRSA-N 2 0 248.370 2.302 20 0 BEADRP Cc1cc(F)ccc1C[NH2+][C@H]1CC[C@H](C[NH3+])C1 ZINC000415043420 386530164 /nfs/dbraw/zinc/53/01/64/386530164.db2.gz RWSJNCUWCPSYSA-FZMZJTMJSA-N 2 0 236.334 2.351 20 0 BEADRP COc1ccc(C)cc1C[NH2+][C@@H]1CC[C@@H](C[NH3+])C1 ZINC000415031130 386520073 /nfs/dbraw/zinc/52/00/73/386520073.db2.gz GMHFIIRHLJNYFK-TZMCWYRMSA-N 2 0 248.370 2.221 20 0 BEADRP Cc1ccc(F)c(C[NH2+][C@@H]2CC[C@@H](C[NH3+])C2)c1 ZINC000415034627 386521522 /nfs/dbraw/zinc/52/15/22/386521522.db2.gz KBTIYJNPUPCJSL-DGCLKSJQSA-N 2 0 236.334 2.351 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]C/C=C\c1ccccc1 ZINC000414787877 386530484 /nfs/dbraw/zinc/53/04/84/386530484.db2.gz CVORLGAERQDORQ-DNWYELSFSA-N 2 0 230.355 2.417 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CC[C@@H](C[NH3+])C2)cc1 ZINC000415036898 386523916 /nfs/dbraw/zinc/52/39/16/386523916.db2.gz LTDQMFHXCRGVQG-ZIAGYGMSSA-N 2 0 218.344 2.212 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2[C@H]3C[NH2+]C[C@H]32)CC(C)(C)C1 ZINC000415037745 386524503 /nfs/dbraw/zinc/52/45/03/386524503.db2.gz NDLNOZSMXNUZMV-KVSVUVNWSA-N 2 0 222.376 2.009 20 0 BEADRP C(CC1CCCCCC1)[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000415037269 386524556 /nfs/dbraw/zinc/52/45/56/386524556.db2.gz MTLKPCFWGUNLNI-WDNDVIMCSA-N 2 0 222.376 2.154 20 0 BEADRP Cc1cccc(C[NH2+][C@@H]2CC[C@@H](C[NH3+])C2)c1 ZINC000415038421 386524743 /nfs/dbraw/zinc/52/47/43/386524743.db2.gz NJNGCQZSJSVJMG-TZMCWYRMSA-N 2 0 218.344 2.212 20 0 BEADRP CC(C)CC[N@@H+]1CCCC[C@@H]1[C@H]1CC[NH2+]C1 ZINC000415041295 386526519 /nfs/dbraw/zinc/52/65/19/386526519.db2.gz LJESLLVSXGLUME-UONOGXRCSA-N 2 0 224.392 2.497 20 0 BEADRP CCOc1cccc(C[NH2+][C@H]2CC[C@@H](C[NH3+])C2)c1 ZINC000415039874 386526774 /nfs/dbraw/zinc/52/67/74/386526774.db2.gz OMDFRQXKJLKIMT-OCCSQVGLSA-N 2 0 248.370 2.302 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+]C[C@@H](C)CC1CCOCC1 ZINC000414786433 386527325 /nfs/dbraw/zinc/52/73/25/386527325.db2.gz BEDBGPNPNGLEKC-GXTWGEPZSA-N 2 0 242.407 2.012 20 0 BEADRP C1CC2(C1)CCC[C@@H]2[NH2+]C1CC[NH2+]CC1 ZINC000335453910 386528035 /nfs/dbraw/zinc/52/80/35/386528035.db2.gz XNXNUOJZVJLUBY-LBPRGKRZSA-N 2 0 208.349 2.051 20 0 BEADRP Cc1ccc(CCC[NH2+]CC[C@H]2CCC[NH2+]2)cn1 ZINC000414911568 386455547 /nfs/dbraw/zinc/45/55/47/386455547.db2.gz WLIHHFXIFWQAJU-OAHLLOKOSA-N 2 0 247.386 2.054 20 0 BEADRP CCOc1ccc(C[N@@H+]2CC[C@@H]([NH3+])[C@H](C)C2)cc1 ZINC000094338824 386456680 /nfs/dbraw/zinc/45/66/80/386456680.db2.gz BTFFKLRFYNDOMV-IUODEOHRSA-N 2 0 248.370 2.254 20 0 BEADRP CC[N@H+](C)C[C@H]1CCN([C@H](C)c2cccnc2)C1 ZINC000266624837 386458870 /nfs/dbraw/zinc/45/88/70/386458870.db2.gz NFTPFXPBLVSPAJ-ZIAGYGMSSA-N 2 0 247.386 2.416 20 0 BEADRP Cc1cc(C[NH2+]C[C@@]2(C)CC[NH2+]C2)ccc1F ZINC000415077066 386576683 /nfs/dbraw/zinc/57/66/83/386576683.db2.gz DOOMCGXBZKOABJ-AWEZNQCLSA-N 2 0 236.334 2.223 20 0 BEADRP CCCC[C@H](COC)[NH2+][C@H]1CCCC[C@H]1C[NH3+] ZINC000414800788 386585952 /nfs/dbraw/zinc/58/59/52/386585952.db2.gz LJOFKNZRPMESHP-MJBXVCDLSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@@]1(C[NH2+]C[C@@H]2CCc3ccccc32)CC[NH2+]C1 ZINC000415077695 386586147 /nfs/dbraw/zinc/58/61/47/386586147.db2.gz HVLQIYNQWWNGNV-GOEBONIOSA-N 2 0 244.382 2.306 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@H](C)c1ccccn1 ZINC000336644144 386586270 /nfs/dbraw/zinc/58/62/70/386586270.db2.gz BUURXPOQQGXHLM-VXGBXAGGSA-N 2 0 221.348 2.250 20 0 BEADRP CCCC[C@H](COC)[NH2+][C@@H]1CCCC[C@H]1C[NH3+] ZINC000414800784 386587645 /nfs/dbraw/zinc/58/76/45/386587645.db2.gz LJOFKNZRPMESHP-BFHYXJOUSA-N 2 0 242.407 2.299 20 0 BEADRP Cc1ccccc1OCC[NH2+][C@H]1CCC[NH2+]CC1 ZINC000415082326 386598530 /nfs/dbraw/zinc/59/85/30/386598530.db2.gz LUDRTVXJLQYKTC-AWEZNQCLSA-N 2 0 248.370 2.106 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+]C[C@H](C)Cc1ccccc1 ZINC000414801016 386589510 /nfs/dbraw/zinc/58/95/10/386589510.db2.gz SUNLWVPYHZRKPB-UKRRQHHQSA-N 2 0 234.387 2.438 20 0 BEADRP CCCC[N@H+]1C[C@@H](c2ccccc2)[C@@H](C[NH3+])C1 ZINC000337043373 386592203 /nfs/dbraw/zinc/59/22/03/386592203.db2.gz CVEFKETZJLARFP-GJZGRUSLSA-N 2 0 232.371 2.461 20 0 BEADRP C[C@H](Cc1ccccc1F)[NH2+][C@H](CN)C1CC1 ZINC000414799811 386593087 /nfs/dbraw/zinc/59/30/87/386593087.db2.gz DXOBBHAZXAUPOM-QMTHXVAHSA-N 2 0 236.334 2.084 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]Cc1cc(F)cc(F)c1 ZINC000414788612 386532713 /nfs/dbraw/zinc/53/27/13/386532713.db2.gz DQLQMMNEIBDXQD-GWCFXTLKSA-N 2 0 240.297 2.182 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1 ZINC000414789066 386534974 /nfs/dbraw/zinc/53/49/74/386534974.db2.gz XUFANYGWCGZELO-IHRRRGAJSA-N 2 0 224.392 2.354 20 0 BEADRP CC1(C)CCC[C@@H]1[C@@H]1CC[N@H+](CCN)C1 ZINC000647995413 386539381 /nfs/dbraw/zinc/53/93/81/386539381.db2.gz VVLGEQQQTKVPKV-VXGBXAGGSA-N 2 0 210.365 2.093 20 0 BEADRP CCCC[N@@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000647975304 386550206 /nfs/dbraw/zinc/55/02/06/386550206.db2.gz VNNXJHPPAJRXTC-ZIAGYGMSSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)c1cccnc1)[C@@H]1CCC[NH2+]C1 ZINC000415081707 386597316 /nfs/dbraw/zinc/59/73/16/386597316.db2.gz KUSBBUSRDCDSOR-OUCADQQQSA-N 2 0 233.359 2.120 20 0 BEADRP CC[C@H](C)C[N@@H+]1CCCC[C@@H]1[C@@H]1CC[NH2+]C1 ZINC000415053102 386554209 /nfs/dbraw/zinc/55/42/09/386554209.db2.gz NZOOVTCGKDKULK-BFHYXJOUSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+][C@H]2CCCC[NH2+]C2)C1 ZINC000415071001 386555062 /nfs/dbraw/zinc/55/50/62/386555062.db2.gz RZPNTTPNBWRBBY-AGIUHOORSA-N 2 0 210.365 2.297 20 0 BEADRP COc1ccc(C)cc1C[NH2+][C@H]1CCC[C@H]1C[NH3+] ZINC000414791208 386555691 /nfs/dbraw/zinc/55/56/91/386555691.db2.gz HIZFUVVBXZUNDU-JSGCOSHPSA-N 2 0 248.370 2.221 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+]Cc1ccccc1Cl ZINC000308591867 386566538 /nfs/dbraw/zinc/56/65/38/386566538.db2.gz VVZFTJZTNZGREN-VIFPVBQESA-N 2 0 212.724 2.024 20 0 BEADRP CC(C)C[C@H]([NH3+])CNc1ccc([C@@H](C)[NH3+])cc1 ZINC000414809665 386621020 /nfs/dbraw/zinc/62/10/20/386621020.db2.gz VYSVDNWQCIOKNZ-YPMHNXCESA-N 2 0 235.375 2.492 20 0 BEADRP C[C@@H]([NH3+])c1ccc(C[NH2+]CC2CC2)cc1 ZINC000414808160 386622309 /nfs/dbraw/zinc/62/23/09/386622309.db2.gz KLARGXLZUSSGJD-SNVBAGLBSA-N 2 0 204.317 2.206 20 0 BEADRP Cc1cccc(CC[NH2+]C[C@]2(C)CC[NH2+]C2)c1 ZINC000415103687 386623437 /nfs/dbraw/zinc/62/34/37/386623437.db2.gz KRNLBABHNJYFDB-HNNXBMFYSA-N 2 0 232.371 2.127 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[NH2+]C1)C1CCC(F)(F)CC1 ZINC000335498956 386625297 /nfs/dbraw/zinc/62/52/97/386625297.db2.gz ZQVFLSCSDVMWDP-ONGXEEELSA-N 2 0 232.318 2.152 20 0 BEADRP C[C@H]1CCC[C@H](C)C1[NH2+]CC1=CC[NH2+]CC1 ZINC000335499597 386626010 /nfs/dbraw/zinc/62/60/10/386626010.db2.gz HJEALSNUWSXJLE-RYUDHWBXSA-N 2 0 222.376 2.320 20 0 BEADRP CCC([NH3+])(CC)C[NH2+][C@@H](C)CC1CCOCC1 ZINC000414809259 386627990 /nfs/dbraw/zinc/62/79/90/386627990.db2.gz LVFMTJAQNLUURI-LBPRGKRZSA-N 2 0 242.407 2.299 20 0 BEADRP CC(C)C[C@@H]([NH3+])C[NH2+]C(C)(C)COC(C)C ZINC000415115531 386630100 /nfs/dbraw/zinc/63/01/00/386630100.db2.gz DWCSMYORBVZADI-GFCCVEGCSA-N 2 0 230.396 2.153 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CC[N@H+](C[C@H]2CCC(F)(F)C2)C1 ZINC000300924116 386633538 /nfs/dbraw/zinc/63/35/38/386633538.db2.gz LRFSLUTWBMJOTR-GARJFASQSA-N 2 0 232.318 2.091 20 0 BEADRP CCOc1ccc(C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)cc1 ZINC000414925337 386637683 /nfs/dbraw/zinc/63/76/83/386637683.db2.gz LOUVAYPEQJWNGH-UONOGXRCSA-N 2 0 248.370 2.445 20 0 BEADRP C[N@H+](CCCC[NH2+]Cc1ccco1)C1CC1 ZINC000453595684 386643085 /nfs/dbraw/zinc/64/30/85/386643085.db2.gz KMCSFKWWPGUCCX-UHFFFAOYSA-N 2 0 222.332 2.244 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCCc2c(F)cccc21)C1C[NH2+]C1 ZINC000335511417 386645006 /nfs/dbraw/zinc/64/50/06/386645006.db2.gz HXYRJXSWRKPBAB-BMIGLBTASA-N 2 0 248.345 2.401 20 0 BEADRP FCCC[N@@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC000647978567 386606981 /nfs/dbraw/zinc/60/69/81/386606981.db2.gz UWORQOSCYUECBA-STQMWFEESA-N 2 0 228.355 2.058 20 0 BEADRP COC1CCC([NH2+][C@@H]2CCCC[C@@H]2C[NH3+])CC1 ZINC000414805366 386611536 /nfs/dbraw/zinc/61/15/36/386611536.db2.gz POZSNNNWDOPWOB-BLYZHGLHSA-N 2 0 240.391 2.051 20 0 BEADRP CCC(CC)(CCO)C[NH2+]C1CCC([NH3+])CC1 ZINC000415090765 386611605 /nfs/dbraw/zinc/61/16/05/386611605.db2.gz ZNELUZVSCKRNCB-UHFFFAOYSA-N 2 0 242.407 2.035 20 0 BEADRP CC[C@H]([NH2+][C@H](C)C[C@@H]1CCC[NH2+]1)[C@H]1CCCO1 ZINC000415090108 386611670 /nfs/dbraw/zinc/61/16/70/386611670.db2.gz ZYCYCQWUYYYGEV-ZOBORPQBSA-N 2 0 240.391 2.064 20 0 BEADRP CC[C@@H](COC)[NH2+]Cc1ccc([C@@H](C)[NH3+])cc1 ZINC000414805275 386612515 /nfs/dbraw/zinc/61/25/15/386612515.db2.gz AJTSWJSDAQYHKH-RISCZKNCSA-N 2 0 236.359 2.221 20 0 BEADRP CC(C)C[C@@H]([NH3+])CNCc1ccc([C@H](C)[NH3+])cc1 ZINC000414819863 386661816 /nfs/dbraw/zinc/66/18/16/386661816.db2.gz ZVNZSQLAJLKVFP-SWLSCSKDSA-N 2 0 249.402 2.169 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@H]1CCCC[C@H]1C1CC1 ZINC000414818853 386666773 /nfs/dbraw/zinc/66/67/73/386666773.db2.gz FYSMGUUPHMKGBN-DRZSPHRISA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]([NH2+]CC1CC[NH2+]CC1)c1ccccc1 ZINC000041231934 386666835 /nfs/dbraw/zinc/66/68/35/386666835.db2.gz CCQBPQBESONPKL-LBPRGKRZSA-N 2 0 218.344 2.337 20 0 BEADRP CCCC[C@H](COC)[NH2+][C@H](C)[C@@H]1CCC[NH2+]C1 ZINC000414823777 386679848 /nfs/dbraw/zinc/67/98/48/386679848.db2.gz PJOHSRSCFPTQPO-MGPQQGTHSA-N 2 0 242.407 2.169 20 0 BEADRP COc1cc(C[NH2+]CC[C@H]2CC[NH2+]C2)ccc1C ZINC000414833062 386709268 /nfs/dbraw/zinc/70/92/68/386709268.db2.gz PAULDGCWPZEVAY-CYBMUJFWSA-N 2 0 248.370 2.093 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@@H](C)CC1CCCC1 ZINC000414833082 386710670 /nfs/dbraw/zinc/71/06/70/386710670.db2.gz GCGBQZBLHZZGIT-NEPJUHHUSA-N 2 0 212.381 2.400 20 0 BEADRP Cc1ccc(CN2CC[C@]3(CC[N@@H+](C)C3)C2)o1 ZINC000292691861 386710783 /nfs/dbraw/zinc/71/07/83/386710783.db2.gz BMVUYVOCJORSFN-AWEZNQCLSA-N 2 0 234.343 2.116 20 0 BEADRP Clc1ccccc1C[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000414824844 386684197 /nfs/dbraw/zinc/68/41/97/386684197.db2.gz BGZSLCZCNRMVHC-LLVKDONJSA-N 2 0 238.762 2.429 20 0 BEADRP CCCC[C@@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000414826618 386686895 /nfs/dbraw/zinc/68/68/95/386686895.db2.gz JHJLLRZHEKRCCQ-FKJOKYEKSA-N 2 0 210.365 2.438 20 0 BEADRP CC(C)[C@@H]1CCC[C@H]1[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000414825550 386691524 /nfs/dbraw/zinc/69/15/24/386691524.db2.gz COKPPFNMJYYVLR-MELADBBJSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]CC[C@@H]2CC[NH2+]C2)[C@H]1C ZINC000414827512 386693463 /nfs/dbraw/zinc/69/34/63/386693463.db2.gz HDXQXKYXDSLMEA-RFGFWPKPSA-N 2 0 224.392 2.400 20 0 BEADRP Cc1cccc(C[NH2+]C[C@@H]2CCC[NH2+]C2)c1C ZINC000414827910 386699117 /nfs/dbraw/zinc/69/91/17/386699117.db2.gz KZHGSUIDAAOYQW-CQSZACIVSA-N 2 0 232.371 2.393 20 0 BEADRP C[C@H](C1CCC1)[N@H+](C)CCn1ccnc1 ZINC000357045331 386700158 /nfs/dbraw/zinc/70/01/58/386700158.db2.gz WOJVYZCDBXXVNP-LLVKDONJSA-N 2 0 207.321 2.004 20 0 BEADRP C[C@H]([NH3+])CC[NH2+]Cc1ccc(C2CC2)cc1 ZINC000414827198 386700108 /nfs/dbraw/zinc/70/01/08/386700108.db2.gz XJOXCELSTPELQB-NSHDSACASA-N 2 0 218.344 2.391 20 0 BEADRP CCNCC[NH2+][C@@H]1C[C@H](C)CC(C)(C)C1 ZINC000414830240 386704947 /nfs/dbraw/zinc/70/49/47/386704947.db2.gz NRTAWVNNNDKWJP-NWDGAFQWSA-N 2 0 212.381 2.400 20 0 BEADRP C(CC1CCCC1)C[N@@H+]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000357068179 386707417 /nfs/dbraw/zinc/70/74/17/386707417.db2.gz DKWFPLQEUWACPA-CABCVRRESA-N 2 0 236.403 2.498 20 0 BEADRP Cc1c[nH+]ccc1NCC[N@@H+](C)C1CCCCC1 ZINC000357185900 386733779 /nfs/dbraw/zinc/73/37/79/386733779.db2.gz JJXIJZJFUYDSKN-UHFFFAOYSA-N 2 0 247.386 2.488 20 0 BEADRP C[C@H]1CCC[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000414833891 386715795 /nfs/dbraw/zinc/71/57/95/386715795.db2.gz RUFXIJYFRLKPCC-GVWAJWJKSA-N 2 0 208.349 2.048 20 0 BEADRP C[C@H]1CCC[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000414832526 386716748 /nfs/dbraw/zinc/71/67/48/386716748.db2.gz QRKPHNDDIQDLBD-IZXDZPFWSA-N 2 0 222.376 2.438 20 0 BEADRP C1CC1[C@@H]1CCC[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000414831924 386716816 /nfs/dbraw/zinc/71/68/16/386716816.db2.gz QJWSLNRTYNZUIC-FIBILERRSA-N 2 0 234.387 2.438 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000414832531 386716844 /nfs/dbraw/zinc/71/68/44/386716844.db2.gz QRKPHNDDIQDLBD-ZBBUEOHVSA-N 2 0 222.376 2.438 20 0 BEADRP CC(C)CC[C@@H](C)[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000414831828 386717883 /nfs/dbraw/zinc/71/78/83/386717883.db2.gz NYSYOEOIGOZIJF-CHWSQXEVSA-N 2 0 212.381 2.400 20 0 BEADRP COC(C)(C)[C@H](C)[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000302509837 386718614 /nfs/dbraw/zinc/71/86/14/386718614.db2.gz VCUVECROUXEYJS-AVGNSLFASA-N 2 0 240.391 2.016 20 0 BEADRP CCCC(CCC)[NH2+]C[C@@H](C)C[NH2+]C ZINC000414832720 386718977 /nfs/dbraw/zinc/71/89/77/386718977.db2.gz FQJDYWVMDBYYCP-NSHDSACASA-N 2 0 200.370 2.400 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H](C)CCc1ccccc1 ZINC000414834271 386724569 /nfs/dbraw/zinc/72/45/69/386724569.db2.gz HFQVSLXUGMIPFA-ZIAGYGMSSA-N 2 0 234.387 2.453 20 0 BEADRP C[NH+](C)CCSCC[C@@H]1CCCC[N@@H+]1C ZINC000340697114 386728631 /nfs/dbraw/zinc/72/86/31/386728631.db2.gz OTAUOFYIQCEWPK-LBPRGKRZSA-N 2 0 230.421 2.156 20 0 BEADRP CCCC[C@@H](CC)[NH2+]C[C@H](C)C[NH2+]C ZINC000414840840 386752449 /nfs/dbraw/zinc/75/24/49/386752449.db2.gz NPPCPPDOCSEUPT-VXGBXAGGSA-N 2 0 200.370 2.400 20 0 BEADRP CCC(CC)C[NH2+][C@@H](C)[C@H]1CCC[NH2+]C1 ZINC000414842545 386759676 /nfs/dbraw/zinc/75/96/76/386759676.db2.gz BKHOABKXGVYNQH-AAEUAGOBSA-N 2 0 212.381 2.400 20 0 BEADRP CCSCC[C@H](C)[N@H+](C)C[C@]1(C)CC[NH2+]C1 ZINC000340712623 386759871 /nfs/dbraw/zinc/75/98/71/386759871.db2.gz PNEKRJAQTYOIDQ-QWHCGFSZSA-N 2 0 244.448 2.450 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)C1CCC1 ZINC000414842625 386763664 /nfs/dbraw/zinc/76/36/64/386763664.db2.gz PFRIMCCHLWDATN-RYUDHWBXSA-N 2 0 210.365 2.154 20 0 BEADRP c1ccc2nc(CN3CCC[NH2+]CC3)ccc2c1 ZINC000020244486 386789415 /nfs/dbraw/zinc/78/94/15/386789415.db2.gz AQFZDZSBMGHULO-UHFFFAOYSA-N 2 0 241.338 2.030 20 0 BEADRP CC[C@@H](C)[NH+]1CCN(c2cc[nH+]cc2C)CC1 ZINC000450863685 386790541 /nfs/dbraw/zinc/79/05/41/386790541.db2.gz TXTONACWWJGDND-CYBMUJFWSA-N 2 0 233.359 2.311 20 0 BEADRP CSC1(C[NH2+]C[C@H]2C[C@H]2C)CC[NH+](C)CC1 ZINC000336668790 386793192 /nfs/dbraw/zinc/79/31/92/386793192.db2.gz GJLKTDGZOJPCOQ-VXGBXAGGSA-N 2 0 242.432 2.059 20 0 BEADRP c1nc2c([nH]1)C[C@H]([NH2+][C@H]1CCC[C@@H]1C1CC1)CC2 ZINC000353652838 386773855 /nfs/dbraw/zinc/77/38/55/386773855.db2.gz XUGWSOUWNUTZOJ-UPJWGTAASA-N 2 0 245.370 2.435 20 0 BEADRP CC(C)C[C@@H](C)[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000336666806 386775884 /nfs/dbraw/zinc/77/58/84/386775884.db2.gz DRSRBFQTJTYXEU-OLZOCXBDSA-N 2 0 212.381 2.400 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+][C@@H](C)Cc1cccs1 ZINC000336667707 386786123 /nfs/dbraw/zinc/78/61/23/386786123.db2.gz DVLVZVFIKPUURO-MNOVXSKESA-N 2 0 226.389 2.396 20 0 BEADRP CC[C@H](C)[NH+]1CCN(c2cc[nH+]cc2C)CC1 ZINC000450863691 386788033 /nfs/dbraw/zinc/78/80/33/386788033.db2.gz TXTONACWWJGDND-ZDUSSCGKSA-N 2 0 233.359 2.311 20 0 BEADRP CC[C@@H](C)N(C)CC[NH2+][C@H]1CCOC(C)(C)C1 ZINC000300670856 386801714 /nfs/dbraw/zinc/80/17/14/386801714.db2.gz XWYUCUWIFQDRMR-OLZOCXBDSA-N 2 0 242.407 2.264 20 0 BEADRP C[NH+](C)[C@@H]1CCC[C@H]([NH2+][C@H]2COC(C)(C)C2)C1 ZINC000417959258 386825680 /nfs/dbraw/zinc/82/56/80/386825680.db2.gz LPGYIAOLQDSPCB-YNEHKIRRSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@H](CCC1CC1)[NH2+]CCC[NH2+]C1CC1 ZINC000398472847 386826843 /nfs/dbraw/zinc/82/68/43/386826843.db2.gz OQOAFDPHLNNHTL-LLVKDONJSA-N 2 0 210.365 2.297 20 0 BEADRP CCCCC[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@H]1C ZINC000249335652 386828931 /nfs/dbraw/zinc/82/89/31/386828931.db2.gz YUXAOOKQNMXUKB-JHJVBQTASA-N 2 0 212.381 2.495 20 0 BEADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CC[C@@H]2SC)C1 ZINC000425339404 386839981 /nfs/dbraw/zinc/83/99/81/386839981.db2.gz CMWXOWQZOJUBOP-UPJWGTAASA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H]1Cc2ccccc2C[N@@H+]1CC[C@H]1CC[NH2+]C1 ZINC000334784452 386842168 /nfs/dbraw/zinc/84/21/68/386842168.db2.gz MDDJVTCGPAZOEP-ZIAGYGMSSA-N 2 0 244.382 2.433 20 0 BEADRP CCN1CCCC[C@@H]1C[NH2+][C@H]1CC[C@H]1SC ZINC000425343414 386857294 /nfs/dbraw/zinc/85/72/94/386857294.db2.gz IFXNJAQUKNRXJE-FRRDWIJNSA-N 2 0 242.432 2.344 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)CC[NH+](C)C)C1CCSCC1 ZINC000336744608 386869280 /nfs/dbraw/zinc/86/92/80/386869280.db2.gz QIEXTXIWYDWZBN-NWDGAFQWSA-N 2 0 244.448 2.448 20 0 BEADRP CCc1cccnc1NCc1ncc(C)n1C ZINC000341270120 386871788 /nfs/dbraw/zinc/87/17/88/386871788.db2.gz BMBIYGGSCUOMPZ-UHFFFAOYSA-N 2 0 230.315 2.298 20 0 BEADRP CC(C)OC1CC([NH2+]CCC[NH+]2CCCC2)C1 ZINC000428078715 386883714 /nfs/dbraw/zinc/88/37/14/386883714.db2.gz SRPWQPBFWSZQBW-UHFFFAOYSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@H]1C[NH2+]CC[C@H]1[NH2+]Cc1cc(Cl)cs1 ZINC000334839791 386884455 /nfs/dbraw/zinc/88/44/55/386884455.db2.gz BCIYHYLTXHFBCE-GZMMTYOYSA-N 2 0 244.791 2.489 20 0 BEADRP C[C@@H](C[NH3+])NCc1ccc(C(C)(C)C)s1 ZINC000414941782 386886013 /nfs/dbraw/zinc/88/60/13/386886013.db2.gz JHXVKYIODPCUCV-VIFPVBQESA-N 2 0 226.389 2.482 20 0 BEADRP CCOC[C@@H](C)[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000341476053 386916937 /nfs/dbraw/zinc/91/69/37/386916937.db2.gz CCKPXZNYLPDMBC-GFCCVEGCSA-N 2 0 240.391 2.018 20 0 BEADRP Fc1cccc2c1CC[C@H]2[NH2+]CC1CC[NH2+]CC1 ZINC000334863383 386917976 /nfs/dbraw/zinc/91/79/76/386917976.db2.gz NVQCBBDESCSYAP-OAHLLOKOSA-N 2 0 248.345 2.402 20 0 BEADRP Fc1cccc2c1CC[C@@H]2[NH2+]CC1CC[NH2+]CC1 ZINC000334863375 386918270 /nfs/dbraw/zinc/91/82/70/386918270.db2.gz NVQCBBDESCSYAP-HNNXBMFYSA-N 2 0 248.345 2.402 20 0 BEADRP [NH3+][C@@H]1CCC[C@H](C[NH2+]C2Cc3ccccc3C2)C1 ZINC000334851126 386900563 /nfs/dbraw/zinc/90/05/63/386900563.db2.gz ZWSFFXFLSLQNCP-SWLSCSKDSA-N 2 0 244.382 2.261 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H](C[NH2+]C2Cc3ccccc3C2)C1 ZINC000334851124 386900710 /nfs/dbraw/zinc/90/07/10/386900710.db2.gz ZWSFFXFLSLQNCP-IUODEOHRSA-N 2 0 244.382 2.261 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CC[NH2+]C[C@H]2C)c(C)c1 ZINC000334853610 386904912 /nfs/dbraw/zinc/90/49/12/386904912.db2.gz FAKOIAUYVCNPIO-HIFRSBDPSA-N 2 0 232.371 2.391 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CC[NH2+]C[C@@H]2C)cc1F ZINC000334858391 386910385 /nfs/dbraw/zinc/91/03/85/386910385.db2.gz SHNZKRHZWWMLEX-FZMZJTMJSA-N 2 0 236.334 2.222 20 0 BEADRP Cc1cccc(C)c1C[NH2+][C@H]1CC[NH2+]C[C@H]1C ZINC000334857823 386910397 /nfs/dbraw/zinc/91/03/97/386910397.db2.gz OTFKQCBYWONIJO-HIFRSBDPSA-N 2 0 232.371 2.391 20 0 BEADRP Cc1cc(F)ccc1C[NH2+][C@H]1CC[NH2+]C[C@@H]1C ZINC000334859669 386912423 /nfs/dbraw/zinc/91/24/23/386912423.db2.gz ZWOXBBQUGZXNCL-FZMZJTMJSA-N 2 0 236.334 2.222 20 0 BEADRP c1cncc(C[N@@H+]2CCCC[C@H]2[C@H]2CC[NH2+]C2)c1 ZINC000334867976 386925993 /nfs/dbraw/zinc/92/59/93/386925993.db2.gz HEOBKYZNFJNTQQ-GJZGRUSLSA-N 2 0 245.370 2.046 20 0 BEADRP C[C@@H]([NH2+]CC1CC[NH2+]CC1)c1cccc(O)c1 ZINC000094010172 386929866 /nfs/dbraw/zinc/92/98/66/386929866.db2.gz JDWITTNSRAVPQK-LLVKDONJSA-N 2 0 234.343 2.042 20 0 BEADRP C[C@H]1C[C@H](C[N@@H+]2CCCC23CCC3)CC[NH2+]1 ZINC000334816833 386942669 /nfs/dbraw/zinc/94/26/69/386942669.db2.gz BXKZKMZPOMJAIM-QWHCGFSZSA-N 2 0 222.376 2.393 20 0 BEADRP CC(C)(C)C[C@H](O)C[NH2+][C@@H]1CCCCC[C@H]1[NH3+] ZINC000332018339 386942812 /nfs/dbraw/zinc/94/28/12/386942812.db2.gz QNTCPCDHUQXRPN-YNEHKIRRSA-N 2 0 242.407 2.033 20 0 BEADRP C[C@H]1CCC[C@H]1[NH2+]CC1([NH3+])CCCCC1 ZINC000334816901 386942983 /nfs/dbraw/zinc/94/29/83/386942983.db2.gz CZIATLSZKGAXGS-NWDGAFQWSA-N 2 0 210.365 2.426 20 0 BEADRP Cc1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)s1 ZINC000334879719 386943166 /nfs/dbraw/zinc/94/31/66/386943166.db2.gz DEAGATIPLVWKFM-FOSCPWQOSA-N 2 0 236.384 2.429 20 0 BEADRP CC[C@H](Cc1ccccc1)[NH2+]CCCC[NH3+] ZINC000116385741 386943825 /nfs/dbraw/zinc/94/38/25/386943825.db2.gz VPRAHMRJCNYUAA-CQSZACIVSA-N 2 0 220.360 2.336 20 0 BEADRP CC[C@@H](Cc1ccccc1)[NH2+]CCn1ccnc1 ZINC000116386698 386944894 /nfs/dbraw/zinc/94/48/94/386944894.db2.gz AIDCLTXQCWRLGK-HNNXBMFYSA-N 2 0 243.354 2.494 20 0 BEADRP CSC1(C[N@@H+]2CCC[C@H]([NH+](C)C)CC2)CC1 ZINC000367317258 386991639 /nfs/dbraw/zinc/99/16/39/386991639.db2.gz JGDWBFHHAGTCBX-LBPRGKRZSA-N 2 0 242.432 2.298 20 0 BEADRP c1ccc(CCC[N@@H+]2CC[C@@H]3C[NH2+]C[C@H]3C2)cc1 ZINC000336786236 386992984 /nfs/dbraw/zinc/99/29/84/386992984.db2.gz BLSBULBRIMFOLM-CVEARBPZSA-N 2 0 244.382 2.161 20 0 BEADRP CO[C@@H](C)CC[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000358666571 386996892 /nfs/dbraw/zinc/99/68/92/386996892.db2.gz QCTUEPMATFXKOE-LBPRGKRZSA-N 2 0 242.407 2.264 20 0 BEADRP C[C@H]([NH2+]CCC[NH+]1CCCC1)[C@H]1C[C@H]1C ZINC000321898900 386998021 /nfs/dbraw/zinc/99/80/21/386998021.db2.gz NCANEAXTABIYIQ-AGIUHOORSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]([NH3+])C1CC[NH+](Cc2ccc(F)cc2)CC1 ZINC000104436283 387004263 /nfs/dbraw/zinc/00/42/63/387004263.db2.gz ULIMPFUMTNWNOY-LLVKDONJSA-N 2 0 236.334 2.385 20 0 BEADRP CN(Cc1ccc2c(c1)CCC2)[C@H](C[NH3+])C1CC1 ZINC000160042640 387041888 /nfs/dbraw/zinc/04/18/88/387041888.db2.gz VUBGBFSPYDFGPP-MRXNPFEDSA-N 2 0 244.382 2.344 20 0 BEADRP [NH3+]CC[C@H]1CCC[N@H+](Cc2cccc(F)c2)C1 ZINC000070074205 387043467 /nfs/dbraw/zinc/04/34/67/387043467.db2.gz ANRRTNRCUIFBLO-GFCCVEGCSA-N 2 0 236.334 2.387 20 0 BEADRP Cc1csc(C[NH2+]C[C@@H]2CCC[C@@H]([NH3+])C2)n1 ZINC000070503304 387066868 /nfs/dbraw/zinc/06/68/68/387066868.db2.gz BNLPELABTYDWGD-GHMZBOCLSA-N 2 0 239.388 2.059 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CC2CC(F)(F)C2)[C@H](C)C1 ZINC000425957014 387045601 /nfs/dbraw/zinc/04/56/01/387045601.db2.gz ZNQKZYYBVOWSPW-ZYHUDNBSSA-N 2 0 246.345 2.352 20 0 BEADRP C[C@@H]([NH3+])CN1CCC(c2ccsc2)CC1 ZINC000334966811 387049731 /nfs/dbraw/zinc/04/97/31/387049731.db2.gz GTXXASMFPTWELU-SNVBAGLBSA-N 2 0 224.373 2.275 20 0 BEADRP Cc1cc(C)c2c(c1)CN(C[C@H](C)[NH3+])CC2 ZINC000334967707 387051593 /nfs/dbraw/zinc/05/15/93/387051593.db2.gz JHQNMKFIVJYJTR-LBPRGKRZSA-N 2 0 218.344 2.009 20 0 BEADRP C(C[N@@H+]1C[C@@H]2CCC[C@@H]2C1)C1CC[NH2+]CC1 ZINC000126264370 387013140 /nfs/dbraw/zinc/01/31/40/387013140.db2.gz TVXBEYFWKNUNMU-OKILXGFUSA-N 2 0 222.376 2.108 20 0 BEADRP Fc1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000334880853 387023605 /nfs/dbraw/zinc/02/36/05/387023605.db2.gz GUJCCLKNPHYUKE-PBWFPOADSA-N 2 0 234.318 2.198 20 0 BEADRP COc1ccc2c(c1)[C@@H]([NH2+]C[C@H](C)C[NH3+])CCC2 ZINC000423299661 387130302 /nfs/dbraw/zinc/13/03/02/387130302.db2.gz QJJIIBHNFMCLKT-ABAIWWIYSA-N 2 0 248.370 2.257 20 0 BEADRP CCCC[C@H](C)[C@@H](C)[NH2+]C[C@H](C)C[NH3+] ZINC000423299830 387130485 /nfs/dbraw/zinc/13/04/85/387130485.db2.gz CEAXQGRRBNURJR-GRYCIOLGSA-N 2 0 200.370 2.386 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H]1c2cc(F)ccc2C[C@H]1C ZINC000423298618 387130853 /nfs/dbraw/zinc/13/08/53/387130853.db2.gz OUZDOYHPIWWCAR-GPCCPHFNSA-N 2 0 236.334 2.243 20 0 BEADRP C[C@@H]([NH3+])[C@H]1CCC[N@H+](Cc2ccc(F)cc2)C1 ZINC000070977047 387086320 /nfs/dbraw/zinc/08/63/20/387086320.db2.gz YWFCVJBBGWFRJN-YPMHNXCESA-N 2 0 236.334 2.385 20 0 BEADRP CC(C)CCC[N@@H+]1C[C@@H]2CCC[C@@H]([NH3+])[C@@H]2C1 ZINC000228545984 387103358 /nfs/dbraw/zinc/10/33/58/387103358.db2.gz NSIDJBWTQFTMLK-BFHYXJOUSA-N 2 0 224.392 2.482 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+]C1CCC2(CC2)CC1 ZINC000335007601 387103650 /nfs/dbraw/zinc/10/36/50/387103650.db2.gz PARVQYVPHSYBED-DGCLKSJQSA-N 2 0 222.376 2.297 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H]2CC[C@H](OC)C2)CC1 ZINC000188817773 387105939 /nfs/dbraw/zinc/10/59/39/387105939.db2.gz MGCBSLNPGAJOTL-KBPBESRZSA-N 2 0 240.391 2.018 20 0 BEADRP [NH3+][C@H]1CCCCC[C@@H]1[NH2+]Cc1ccccc1 ZINC000335025403 387117020 /nfs/dbraw/zinc/11/70/20/387117020.db2.gz RMDSFCOGNNJQEO-KBPBESRZSA-N 2 0 218.344 2.436 20 0 BEADRP C[N@H+](Cc1ccc(F)cc1)[C@@H]1CCC[NH2+]CC1 ZINC000113712686 387119839 /nfs/dbraw/zinc/11/98/39/387119839.db2.gz XPHPALXWUBCYHP-CQSZACIVSA-N 2 0 236.334 2.400 20 0 BEADRP CCOc1cccc(C[N@@H+]2C[C@H](C[NH3+])C[C@H]2C)c1 ZINC000250507083 387124528 /nfs/dbraw/zinc/12/45/28/387124528.db2.gz FQZNAAUGYWLEPT-OCCSQVGLSA-N 2 0 248.370 2.254 20 0 BEADRP CC[C@@H]1CC[C@H](C)C[C@H]1[NH2+]C[C@H](C)C[NH3+] ZINC000423299911 387132330 /nfs/dbraw/zinc/13/23/30/387132330.db2.gz CQHQTWTXEIYSNU-UMSGYPCISA-N 2 0 212.381 2.386 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H]1CCCOc2ccccc21 ZINC000423301171 387132332 /nfs/dbraw/zinc/13/23/32/387132332.db2.gz SQPBPNMUQCYBED-YPMHNXCESA-N 2 0 234.343 2.085 20 0 BEADRP CCCC[C@H]1CCC[C@H]1[NH2+]CC1C[NH2+]C1 ZINC000423301273 387132449 /nfs/dbraw/zinc/13/24/49/387132449.db2.gz HBIPVSNNTQHOGL-QWHCGFSZSA-N 2 0 210.365 2.154 20 0 BEADRP Cc1cccc2c1CC[C@@H]2[NH2+]C[C@H](C)C[NH3+] ZINC000423298576 387128996 /nfs/dbraw/zinc/12/89/96/387128996.db2.gz OOPXJBIGCBAAFW-YGRLFVJLSA-N 2 0 218.344 2.167 20 0 BEADRP CC(C)[C@@H]([NH2+]C[C@H](C)C[NH3+])c1ccc(F)cn1 ZINC000423298508 387129473 /nfs/dbraw/zinc/12/94/73/387129473.db2.gz AIDAJWIXMHIIOQ-ZWNOBZJWSA-N 2 0 239.338 2.102 20 0 BEADRP CCO[C@@H]1C[C@H]([NH2+]C[C@H](C)C[NH3+])C1(CC)CC ZINC000423298650 387129489 /nfs/dbraw/zinc/12/94/89/387129489.db2.gz AMXSXQYWMBMDQH-FRRDWIJNSA-N 2 0 242.407 2.155 20 0 BEADRP CCCC[N@H+](CCOC)CCC1CC[NH2+]CC1 ZINC000359213812 387067704 /nfs/dbraw/zinc/06/77/04/387067704.db2.gz GOPVZMHQJKSZJE-UHFFFAOYSA-N 2 0 242.407 2.125 20 0 BEADRP [NH3+]CC[C@@H]1CCC[N@H+](CCOc2ccccc2)C1 ZINC000070533449 387068183 /nfs/dbraw/zinc/06/81/83/387068183.db2.gz VPJKLIRPBAFYLU-AWEZNQCLSA-N 2 0 248.370 2.126 20 0 BEADRP FC(F)(F)CCN1CCC[C@]2(CC[NH2+]C2)C1 ZINC000334980886 387068533 /nfs/dbraw/zinc/06/85/33/387068533.db2.gz PYLFMQUETVPAOO-SNVBAGLBSA-N 2 0 236.281 2.014 20 0 BEADRP CC[C@H]([NH2+]C[C@H](C)C[NH3+])c1cccc(F)c1 ZINC000423305635 387141503 /nfs/dbraw/zinc/14/15/03/387141503.db2.gz KUDYPFCZMFNYRK-MFKMUULPSA-N 2 0 224.323 2.461 20 0 BEADRP CC[C@@H]([NH2+]CC1C[NH2+]C1)c1ccc(C)cc1 ZINC000423306134 387141578 /nfs/dbraw/zinc/14/15/78/387141578.db2.gz SBGFMJNQYJMYNT-CQSZACIVSA-N 2 0 218.344 2.255 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H](C)C1CCC(F)(F)CC1 ZINC000423306526 387142312 /nfs/dbraw/zinc/14/23/12/387142312.db2.gz LPOXTYKBUAQDIM-ZJUUUORDSA-N 2 0 234.334 2.385 20 0 BEADRP CC[C@@H]1C[C@H](C)CC[C@@H]1[NH2+]CC1C[NH2+]C1 ZINC000423307347 387143710 /nfs/dbraw/zinc/14/37/10/387143710.db2.gz VTFNBDJTMJMKDH-RTXFEEFZSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@@H]1Cc2ccccc2O1 ZINC000336792699 387146783 /nfs/dbraw/zinc/14/67/83/387146783.db2.gz TTYBROPMVHMJAS-OCCSQVGLSA-N 2 0 248.370 2.097 20 0 BEADRP CC[C@H]([NH2+]C[C@@H](C)C[NH3+])c1ccsc1 ZINC000423309231 387147129 /nfs/dbraw/zinc/14/71/29/387147129.db2.gz PXVYTPPUSWFWFV-ONGXEEELSA-N 2 0 212.362 2.384 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@H]1CCCc2ccc(F)cc21 ZINC000423310629 387147194 /nfs/dbraw/zinc/14/71/94/387147194.db2.gz SDIVLVBKKWAWCU-HZMBPMFUSA-N 2 0 236.334 2.388 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@@H]1CCCc2ccc(F)cc21 ZINC000423310631 387147223 /nfs/dbraw/zinc/14/72/23/387147223.db2.gz SDIVLVBKKWAWCU-QMTHXVAHSA-N 2 0 236.334 2.388 20 0 BEADRP CC(C)[C@@H](Cc1ccccc1)[NH2+]C[C@@H](C)C[NH3+] ZINC000423312774 387152046 /nfs/dbraw/zinc/15/20/46/387152046.db2.gz VSFXWEFRBNKUSP-DZGCQCFKSA-N 2 0 234.387 2.438 20 0 BEADRP Cc1c([C@H](C)[NH2+]C[C@H](C)C[NH3+])cnn1C(C)C ZINC000423313241 387152084 /nfs/dbraw/zinc/15/20/84/387152084.db2.gz WQRCTPDLTBOXAH-MNOVXSKESA-N 2 0 238.379 2.018 20 0 BEADRP CC(C)[C@@H]1CCC[C@@H]([NH2+]C[C@H](C)C[NH3+])C1 ZINC000423312958 387152095 /nfs/dbraw/zinc/15/20/95/387152095.db2.gz VVKCYCSMMMYRQB-JHJVBQTASA-N 2 0 212.381 2.386 20 0 BEADRP CCC[NH2+]CC[NH2+][C@H](C)CCCc1cccnc1 ZINC000423313763 387152381 /nfs/dbraw/zinc/15/23/81/387152381.db2.gz UTMJTHDOYPJUJZ-CQSZACIVSA-N 2 0 249.402 2.382 20 0 BEADRP [NH3+][C@@H](C[NH2+]C1C2CC3CC(C2)CC1C3)C1CC1 ZINC000423315174 387153282 /nfs/dbraw/zinc/15/32/82/387153282.db2.gz IPZUPRDGKFEZCR-RQDKRIMHSA-N 2 0 234.387 2.138 20 0 BEADRP C[N@@H+]1CCC[C@H]1CC[NH+]1CCCC2(CC2)C1 ZINC000187006242 387154271 /nfs/dbraw/zinc/15/42/71/387154271.db2.gz XNTXCLHTMKNITR-ZDUSSCGKSA-N 2 0 222.376 2.347 20 0 BEADRP CC(C)O[C@H]1C[C@@H]([NH2+]CC2([NH3+])CCC2)C1(C)C ZINC000423315956 387156687 /nfs/dbraw/zinc/15/66/87/387156687.db2.gz BHVDIRCNJSDQDW-NEPJUHHUSA-N 2 0 240.391 2.050 20 0 BEADRP [NH3+][C@H](C[NH2+][C@@H](c1ccccc1)C1CC1)C1CC1 ZINC000423315571 387157075 /nfs/dbraw/zinc/15/70/75/387157075.db2.gz IZROADLRKUHREH-CABCVRRESA-N 2 0 230.355 2.465 20 0 BEADRP CCC[NH2+]CC[NH2+][C@H](C1CC1)C1CCC1 ZINC000423315814 387157580 /nfs/dbraw/zinc/15/75/80/387157580.db2.gz XPFODFKEPVDJSI-ZDUSSCGKSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@]12C[C@H]1CCC[C@H]2[NH2+]CC1([NH3+])CCC1 ZINC000423319399 387160005 /nfs/dbraw/zinc/16/00/05/387160005.db2.gz FEHAWWCDEIIRKW-UTUOFQBUSA-N 2 0 208.349 2.036 20 0 BEADRP Cc1nc2c(s1)[C@@H]([NH2+]CCCC[NH3+])CCC2 ZINC000423321204 387161654 /nfs/dbraw/zinc/16/16/54/387161654.db2.gz FASHRAOTNHRPCA-JTQLQIEISA-N 2 0 239.388 2.157 20 0 BEADRP CC1(C)CCC[C@@H]([NH2+]C[C@@H]([NH3+])C2CC2)C1 ZINC000423322658 387164378 /nfs/dbraw/zinc/16/43/78/387164378.db2.gz OBZBUDDLNNZOSK-VXGBXAGGSA-N 2 0 210.365 2.282 20 0 BEADRP CC1(C)CCC[C@H]([NH2+]C[C@H]([NH3+])C2CC2)C1 ZINC000423322657 387164661 /nfs/dbraw/zinc/16/46/61/387164661.db2.gz OBZBUDDLNNZOSK-RYUDHWBXSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)[C@@H]([NH2+]CCCC[NH3+])c1cccnc1 ZINC000423323926 387167493 /nfs/dbraw/zinc/16/74/93/387167493.db2.gz JQHDFRDWMNUFPI-CYBMUJFWSA-N 2 0 221.348 2.107 20 0 BEADRP CC(C)[C@@H]1C[C@H]1C[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000571777087 387168923 /nfs/dbraw/zinc/16/89/23/387168923.db2.gz QWLDUUOZMLOCSK-LOWDOPEQSA-N 2 0 210.365 2.138 20 0 BEADRP [NH3+]C1(C[NH2+][C@H](Cc2ccccc2)C2CC2)CCC1 ZINC000423329254 387173089 /nfs/dbraw/zinc/17/30/89/387173089.db2.gz OKNRYHCCUUETPH-OAHLLOKOSA-N 2 0 244.382 2.479 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@@H]([NH2+]CC2([NH3+])CCC2)C1 ZINC000423331002 387176290 /nfs/dbraw/zinc/17/62/90/387176290.db2.gz OBIJCCNNJMRQFR-WOPDTQHZSA-N 2 0 210.365 2.282 20 0 BEADRP CCC[C@H]([NH2+]CCCC[NH3+])c1cccnc1 ZINC000423332860 387177809 /nfs/dbraw/zinc/17/78/09/387177809.db2.gz RIOOSMGQULXNTK-ZDUSSCGKSA-N 2 0 221.348 2.251 20 0 BEADRP CC[C@H]([NH2+]CC1C[NH2+]C1)c1ccsc1 ZINC000423331796 387178746 /nfs/dbraw/zinc/17/87/46/387178746.db2.gz UWQBKPOIQSLYII-NSHDSACASA-N 2 0 210.346 2.008 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]CC1(C)CC[NH2+]CC1 ZINC000423332986 387178984 /nfs/dbraw/zinc/17/89/84/387178984.db2.gz PPDCIGLCKQHHPU-NEPJUHHUSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CCC[C@H]2C[NH+](C)CC[C@H]21 ZINC000571842985 387180566 /nfs/dbraw/zinc/18/05/66/387180566.db2.gz YUXDJVKZWFCMJM-XJFOESAGSA-N 2 0 222.376 2.059 20 0 BEADRP CC(C)C[C@@H]([NH2+]CCCC[NH3+])c1ccccn1 ZINC000423337477 387186055 /nfs/dbraw/zinc/18/60/55/387186055.db2.gz VPPRHSRGEXECCY-CQSZACIVSA-N 2 0 235.375 2.497 20 0 BEADRP CC[C@@H]1CC[C@H](C)C[C@H]1[NH2+]CC1C[NH2+]C1 ZINC000423339201 387187517 /nfs/dbraw/zinc/18/75/17/387187517.db2.gz ZIZDSPBOUYEDGA-CYZMBNFOSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]([NH2+]CC1(C)CC[NH2+]CC1)c1ccccn1 ZINC000423338868 387188452 /nfs/dbraw/zinc/18/84/52/387188452.db2.gz VABSMTUGRQCTHT-GFCCVEGCSA-N 2 0 233.359 2.122 20 0 BEADRP C[C@@H]([NH2+]CC1(C)CC[NH2+]CC1)[C@@H]1CC1(C)C ZINC000423341594 387189248 /nfs/dbraw/zinc/18/92/48/387189248.db2.gz WNDACFGUWWSBRO-NEPJUHHUSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]([NH2+]CC1(C)CC[NH2+]CC1)[C@H]1CC1(C)C ZINC000423341597 387191288 /nfs/dbraw/zinc/19/12/88/387191288.db2.gz WNDACFGUWWSBRO-VXGBXAGGSA-N 2 0 224.392 2.400 20 0 BEADRP c1ccc(C[C@@H]2CCC[C@H]2[NH2+]CC2C[NH2+]C2)cc1 ZINC000423301538 387133044 /nfs/dbraw/zinc/13/30/44/387133044.db2.gz HKHRHVOOWUBGJH-JKSUJKDBSA-N 2 0 244.382 2.207 20 0 BEADRP CC(C)[C@H]1CC[C@@H](C)C[C@H]1[NH2+]CC1C[NH2+]C1 ZINC000423302182 387134333 /nfs/dbraw/zinc/13/43/33/387134333.db2.gz JEJYIQVZLPFBOE-MRVWCRGKSA-N 2 0 224.392 2.256 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@@H](C)c1nccc2ccccc21 ZINC000423302662 387134779 /nfs/dbraw/zinc/13/47/79/387134779.db2.gz HSLFYHRVYKLBCT-RYUDHWBXSA-N 2 0 243.354 2.480 20 0 BEADRP CCC[C@@H]([NH2+]C[C@H](C)C[NH3+])C(C)(C)C ZINC000423302339 387135391 /nfs/dbraw/zinc/13/53/91/387135391.db2.gz HDYSKEBIIOAASR-GHMZBOCLSA-N 2 0 200.370 2.386 20 0 BEADRP COc1ccc([C@@H](C)[NH2+]C[C@H](C)C[NH3+])c(F)c1 ZINC000423303905 387137378 /nfs/dbraw/zinc/13/73/78/387137378.db2.gz XQLXONZVJHFBEH-NXEZZACHSA-N 2 0 240.322 2.080 20 0 BEADRP COc1ccc([C@H](C)[NH2+]C[C@@H](C)C[NH3+])c(F)c1 ZINC000423303906 387137919 /nfs/dbraw/zinc/13/79/19/387137919.db2.gz XQLXONZVJHFBEH-UWVGGRQHSA-N 2 0 240.322 2.080 20 0 BEADRP c1ccc([C@H]2CC[C@@H]([NH2+]CC3C[NH2+]C3)C2)cc1 ZINC000423304413 387140012 /nfs/dbraw/zinc/14/00/12/387140012.db2.gz NUJYCFYHQDHZIC-LSDHHAIUSA-N 2 0 230.355 2.132 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@@H](c1ccc(F)cc1)C1CC1 ZINC000423304358 387140322 /nfs/dbraw/zinc/14/03/22/387140322.db2.gz YLEVYPPEJCRYPM-IINYFYTJSA-N 2 0 236.334 2.461 20 0 BEADRP C[C@@H]([NH2+]CC1C[NH2+]C1)C(C)(C)c1ccccc1 ZINC000423305292 387140503 /nfs/dbraw/zinc/14/05/03/387140503.db2.gz QLBWLXYPRUUCQR-GFCCVEGCSA-N 2 0 232.371 2.162 20 0 BEADRP Cc1cc([C@@H](C)[NH2+]CC2=CC[NH2+]CC2)oc1C ZINC000423352555 387203016 /nfs/dbraw/zinc/20/30/16/387203016.db2.gz KQEYSYBRSZYRGI-LLVKDONJSA-N 2 0 234.343 2.467 20 0 BEADRP C[C@@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)c1cccnc1 ZINC000423351169 387203523 /nfs/dbraw/zinc/20/35/23/387203523.db2.gz YQHMLPQYSROWQJ-OCCSQVGLSA-N 2 0 233.359 2.122 20 0 BEADRP CC(C)(C)[C@H]1CC[C@@H]1[NH2+]CC1=CC[NH2+]CC1 ZINC000423351471 387203545 /nfs/dbraw/zinc/20/35/45/387203545.db2.gz IDFNMEYROICPPP-STQMWFEESA-N 2 0 222.376 2.320 20 0 BEADRP C[C@H]([NH2+]CC1=CC[NH2+]CC1)c1ccsc1 ZINC000423350443 387203609 /nfs/dbraw/zinc/20/36/09/387203609.db2.gz ZOJKEFHWWJGFTQ-JTQLQIEISA-N 2 0 222.357 2.318 20 0 BEADRP C[NH+](C)C1CCC([NH2+]Cc2ccccn2)CC1 ZINC000353451098 387204585 /nfs/dbraw/zinc/20/45/85/387204585.db2.gz WEZIPXKXZMXTGA-UHFFFAOYSA-N 2 0 233.359 2.044 20 0 BEADRP CC[C@H]([NH2+]CC[C@H]1CCC[NH2+]1)C1CCC1 ZINC000423353408 387205051 /nfs/dbraw/zinc/20/50/51/387205051.db2.gz DBHBTIRTZYPMBC-OLZOCXBDSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@H]1CCCc2cc(N)ccc21 ZINC000423354980 387205589 /nfs/dbraw/zinc/20/55/89/387205589.db2.gz DLIFMHKVIOBPOC-PGUXBMHVSA-N 2 0 247.386 2.362 20 0 BEADRP CC[C@H]([NH2+]CC1=CC[NH2+]CC1)c1ccncc1 ZINC000423353290 387205684 /nfs/dbraw/zinc/20/56/84/387205684.db2.gz LOQPPUZYMVPDQV-AWEZNQCLSA-N 2 0 231.343 2.042 20 0 BEADRP C(C[C@H]1CCC[NH2+]1)[NH2+][C@H]1CC[C@H]1C1CCC1 ZINC000423359293 387209478 /nfs/dbraw/zinc/20/94/78/387209478.db2.gz ORXZETKZCJRJTQ-RDBSUJKOSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H](Cc1ccccc1F)[NH2+]CC1=CC[NH2+]CC1 ZINC000423358105 387210740 /nfs/dbraw/zinc/21/07/40/387210740.db2.gz SZSYRUQNGYJBEU-LBPRGKRZSA-N 2 0 248.345 2.266 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](C)c1ccncc1F ZINC000423428902 387254005 /nfs/dbraw/zinc/25/40/05/387254005.db2.gz JRVXMRCEORLYCX-QWRGUYRKSA-N 2 0 239.338 2.389 20 0 BEADRP Cc1ccc(C[N@H+](C)CC2CC[NH+](C)CC2)nc1 ZINC000120258279 387216345 /nfs/dbraw/zinc/21/63/45/387216345.db2.gz ULDNHDIPLBMYKI-UHFFFAOYSA-N 2 0 247.386 2.164 20 0 BEADRP CC[C@H]([NH2+][C@H]1CC[NH2+]C[C@H]1C)c1ccncc1 ZINC000423364606 387216817 /nfs/dbraw/zinc/21/68/17/387216817.db2.gz CNTOHMZDXWYFOT-XBFCOCLRSA-N 2 0 233.359 2.120 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)[C@H]1CC1(C)C ZINC000423368977 387220266 /nfs/dbraw/zinc/22/02/66/387220266.db2.gz BMMPSGBDYIQTDR-WRWGMCAJSA-N 2 0 210.365 2.151 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@H]1CC[C@@H]1C(C)(C)C ZINC000423372968 387227245 /nfs/dbraw/zinc/22/72/45/387227245.db2.gz BREVZXPPVIMERZ-WOPDTQHZSA-N 2 0 212.381 2.399 20 0 BEADRP CO[C@@H](c1ccccc1)[C@H](C)[NH2+]CCCC[NH3+] ZINC000423325245 387229351 /nfs/dbraw/zinc/22/93/51/387229351.db2.gz LHJXHHSDUVIRCH-GXTWGEPZSA-N 2 0 236.359 2.091 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@H]1CCc2cc(F)ccc21 ZINC000423402063 387238685 /nfs/dbraw/zinc/23/86/85/387238685.db2.gz RFUUYYZHRJTFOZ-ONERCXAPSA-N 2 0 248.345 2.401 20 0 BEADRP C[C@@H]([NH2+]CCN1CCCC1(C)C)[C@H]1CCCO1 ZINC000063074099 387247746 /nfs/dbraw/zinc/24/77/46/387247746.db2.gz AEORBYSNRBZWGE-CHWSQXEVSA-N 2 0 240.391 2.018 20 0 BEADRP C1C[C@@H]([NH2+][C@@H]2[C@H]3C[NH2+]C[C@H]32)C2(C1)CCCCC2 ZINC000423423965 387250837 /nfs/dbraw/zinc/25/08/37/387250837.db2.gz FBYHVLFKQJQZSF-RQJABVFESA-N 2 0 234.387 2.297 20 0 BEADRP Cc1ccnc([C@@H](C)[NH2+]CC2(C)CC[NH2+]CC2)c1 ZINC000423346114 387194736 /nfs/dbraw/zinc/19/47/36/387194736.db2.gz ZJLBAEGAKWSWHV-CYBMUJFWSA-N 2 0 247.386 2.430 20 0 BEADRP CC[C@@H](Cc1cccs1)[NH2+]C1CC[NH2+]CC1 ZINC000643496208 387197617 /nfs/dbraw/zinc/19/76/17/387197617.db2.gz ZXZNFOOAUXEDTP-NSHDSACASA-N 2 0 238.400 2.411 20 0 BEADRP CC(C)[C@@H]([NH2+][C@@H](C)CCC[NH3+])c1cccnc1 ZINC000423463802 387312399 /nfs/dbraw/zinc/31/23/99/387312399.db2.gz VJDFGACOVOSOBR-GXTWGEPZSA-N 2 0 235.375 2.496 20 0 BEADRP CC(C)[C@H]([NH2+][C@@H](C)CCC[NH3+])c1cccnc1 ZINC000423463803 387313029 /nfs/dbraw/zinc/31/30/29/387313029.db2.gz VJDFGACOVOSOBR-JSGCOSHPSA-N 2 0 235.375 2.496 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+]C1CCc2ccccc2CC1 ZINC000423465683 387313052 /nfs/dbraw/zinc/31/30/52/387313052.db2.gz MZEMGOXAKJQFST-CQSZACIVSA-N 2 0 232.371 2.261 20 0 BEADRP Cc1cncc([C@H](C)[NH2+][C@@H](C)CCC[NH3+])c1 ZINC000423466308 387314606 /nfs/dbraw/zinc/31/46/06/387314606.db2.gz XCSBOXWAYOEECJ-RYUDHWBXSA-N 2 0 221.348 2.168 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@@H]1CCCc2ccc(O)cc21 ZINC000423467363 387314775 /nfs/dbraw/zinc/31/47/75/387314775.db2.gz XKYUOYFBTASLFB-XHDPSFHLSA-N 2 0 248.370 2.487 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+]C[C@@H]1CCC[C@@H]([NH3+])C1 ZINC000423467413 387315964 /nfs/dbraw/zinc/31/59/64/387315964.db2.gz IVSKKEREXFXQIG-YRGRVCCFSA-N 2 0 236.359 2.318 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@H]1CCC12CCC2 ZINC000423428120 387255253 /nfs/dbraw/zinc/25/52/53/387255253.db2.gz JCIWNQLZXCTJJF-NEPJUHHUSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@@H]1C[C@H]1[NH2+]C1CCN(Cc2cccnc2)CC1 ZINC000120558296 387255872 /nfs/dbraw/zinc/25/58/72/387255872.db2.gz RJRXLWNUIJSZSZ-IUODEOHRSA-N 2 0 245.370 2.044 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@@H]1CCC[C@H]2C[C@]21C ZINC000423377716 387260748 /nfs/dbraw/zinc/26/07/48/387260748.db2.gz FFYIJVZUKHRVTE-YVECIDJPSA-N 2 0 210.365 2.153 20 0 BEADRP COc1ccc([C@H]([NH2+][C@@H](C)CN)C(C)C)cc1 ZINC000423380413 387263127 /nfs/dbraw/zinc/26/31/27/387263127.db2.gz YRSKUIBECDJYMX-SMDDNHRTSA-N 2 0 236.359 2.329 20 0 BEADRP CC[C@@H](N[C@@H](C)C[NH3+])c1cccc(OC)c1 ZINC000423380321 387263384 /nfs/dbraw/zinc/26/33/84/387263384.db2.gz YHRUBJVDFQGHLA-GXFFZTMASA-N 2 0 222.332 2.083 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[NH2+]C[C@@H]1C)[C@H]1C[C@@H]1C ZINC000423385676 387267268 /nfs/dbraw/zinc/26/72/68/387267268.db2.gz GWVAJBVJNOEYNW-PJSNJIKXSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@H]1CC(C)(C)C[C@@H]1[NH2+][C@H]1CC[NH2+]C[C@H]1C ZINC000423384416 387269025 /nfs/dbraw/zinc/26/90/25/387269025.db2.gz FXGFCNFPEGTXAJ-RNJOBUHISA-N 2 0 224.392 2.399 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@@H]1CC(C)(C)C[C@@H]1C ZINC000423388054 387271289 /nfs/dbraw/zinc/27/12/89/387271289.db2.gz SXNZOYBEXPKXOP-QJPTWQEYSA-N 2 0 212.381 2.399 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@H](C1CC1)C1CCC1 ZINC000423386908 387271469 /nfs/dbraw/zinc/27/14/69/387271469.db2.gz LQBRMKRQCVRJTG-MFKMUULPSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H](C2CC2)C2CCC2)CC[NH2+]1 ZINC000423388157 387273851 /nfs/dbraw/zinc/27/38/51/387273851.db2.gz TZBXPDYGUAJKAP-HONMWMINSA-N 2 0 222.376 2.295 20 0 BEADRP CC[NH2+][C@H](C)C[NH2+][C@H]1CC[C@H]1C1CCC1 ZINC000423389497 387274256 /nfs/dbraw/zinc/27/42/56/387274256.db2.gz NNNOYCCHXCYISV-WXHSDQCUSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@H](Cc1cccs1)[NH2+]CCC[NH2+]C ZINC000643498382 387277501 /nfs/dbraw/zinc/27/75/01/387277501.db2.gz ONOCWAVEGYYCQW-LLVKDONJSA-N 2 0 226.389 2.268 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@H]1CC[C@@H]1C1CCC1 ZINC000423392731 387278746 /nfs/dbraw/zinc/27/87/46/387278746.db2.gz LXEXYUVDIAMNCO-ZZVYKPCYSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@H]([NH2+][C@H]2CC[NH2+]C[C@@H]2C)C1 ZINC000423394074 387279448 /nfs/dbraw/zinc/27/94/48/387279448.db2.gz MRIQIWDODFCIOO-IKOXMDCHSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@@H]1CC[C@@H]1C1CCC1 ZINC000423392728 387279518 /nfs/dbraw/zinc/27/95/18/387279518.db2.gz LXEXYUVDIAMNCO-RUZUBIRVSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC23CCCC3)CC[NH2+]1 ZINC000423394537 387281044 /nfs/dbraw/zinc/28/10/44/387281044.db2.gz ZWQCCFNKDHPXPJ-JHJVBQTASA-N 2 0 222.376 2.439 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000423432028 387283068 /nfs/dbraw/zinc/28/30/68/387283068.db2.gz JBSVFIQWRUQAFF-VZZFWQQMSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H](C[NH2+][C@H](C)[C@@H]1C[C@@H]1C)C[NH+]1CCCC1 ZINC000321594242 387284405 /nfs/dbraw/zinc/28/44/05/387284405.db2.gz PODKFRNQQCYMGN-XJFOESAGSA-N 2 0 224.392 2.352 20 0 BEADRP CCC[C@H](C)[C@H](CC)[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000423437411 387288573 /nfs/dbraw/zinc/28/85/73/387288573.db2.gz QLTRSKVIOFGWJW-IEECTRCBSA-N 2 0 210.365 2.009 20 0 BEADRP CCO[C@@H]1C[C@H]([NH2+][C@H](C)[C@@H](C)[NH3+])C1(CC)CC ZINC000423439756 387290425 /nfs/dbraw/zinc/29/04/25/387290425.db2.gz IBNYYBBHXIOYHV-FVCCEPFGSA-N 2 0 242.407 2.296 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)[C@@H]1CC1(C)C ZINC000423445358 387295493 /nfs/dbraw/zinc/29/54/93/387295493.db2.gz RVESXSCXRLBYEP-VZZFWQQMSA-N 2 0 236.403 2.399 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)[C@H]1CC1(C)C ZINC000423445357 387295537 /nfs/dbraw/zinc/29/55/37/387295537.db2.gz RVESXSCXRLBYEP-SCUASFONSA-N 2 0 236.403 2.399 20 0 BEADRP CC(C)[C@@H](C)[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000423447164 387296556 /nfs/dbraw/zinc/29/65/56/387296556.db2.gz TVSHKWOTMMZJLW-KGYLQXTDSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@@H]([NH2+][C@@H](Cc1ccccc1)C1CC1)[C@H](C)[NH3+] ZINC000423450165 387299082 /nfs/dbraw/zinc/29/90/82/387299082.db2.gz SOFPJQYXDKNSSG-ZOWXZIJZSA-N 2 0 232.371 2.333 20 0 BEADRP C[C@H]([NH3+])[C@H](C)[NH2+][C@@H]1CCCC[C@H]1C1CC1 ZINC000423452766 387299119 /nfs/dbraw/zinc/29/91/19/387299119.db2.gz WWEGYCFCQMQODP-XRRVDJEJSA-N 2 0 210.365 2.281 20 0 BEADRP CO[C@@H](C)[C@H](C)[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000360500748 387301229 /nfs/dbraw/zinc/30/12/29/387301229.db2.gz OJLZJTSUFCFHSP-RYUDHWBXSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]Cc1ccc2c(c1)CCCN2 ZINC000423453165 387302672 /nfs/dbraw/zinc/30/26/72/387302672.db2.gz XIDMOAIQWXENAV-GFCCVEGCSA-N 2 0 247.386 2.262 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+][C@H]1CCC12CCC2 ZINC000423457579 387305617 /nfs/dbraw/zinc/30/56/17/387305617.db2.gz IMYRGBCHSDQABG-VZANTVGXSA-N 2 0 234.387 2.425 20 0 BEADRP COc1ccc2c(c1)[C@H]([NH2+][C@H](C)CCC[NH3+])CC2 ZINC000423460983 387308171 /nfs/dbraw/zinc/30/81/71/387308171.db2.gz SIYJBYUCGKYNES-IAQYHMDHSA-N 2 0 248.370 2.400 20 0 BEADRP C[C@@H]1C[N@@H+](CC[C@@H]2CCC[NH+]2C)C[C@H](C)S1 ZINC000162060932 387309030 /nfs/dbraw/zinc/30/90/30/387309030.db2.gz VNOFLIJHDVSIMK-XQQFMLRXSA-N 2 0 242.432 2.297 20 0 BEADRP C1=C(CC[NH2+][C@@H]2CC[C@H]2C2CCC2)CC[NH2+]C1 ZINC000423534550 387360333 /nfs/dbraw/zinc/36/03/33/387360333.db2.gz ACOBNMRXAKVZPV-LSDHHAIUSA-N 2 0 234.387 2.465 20 0 BEADRP C[C@H]([NH2+]CCC1=CC[NH2+]CC1)c1cccnc1 ZINC000423537704 387362826 /nfs/dbraw/zinc/36/28/26/387362826.db2.gz KRGKIJXOWKOEHI-LBPRGKRZSA-N 2 0 231.343 2.042 20 0 BEADRP Cc1cncc([C@@H](C)[NH2+]CCC2=CC[NH2+]CC2)c1 ZINC000423537987 387363179 /nfs/dbraw/zinc/36/31/79/387363179.db2.gz LPOBVGVZNVSGCJ-CYBMUJFWSA-N 2 0 245.370 2.350 20 0 BEADRP C1CC1[C@H]1CC[C@@H]1[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000423538684 387364110 /nfs/dbraw/zinc/36/41/10/387364110.db2.gz GVRGPIJYNYZQHM-KHMAMNHCSA-N 2 0 234.387 2.153 20 0 BEADRP C[C@@H]([NH2+]CCC1=CC[NH2+]CC1)c1ccc(F)cn1 ZINC000423538643 387364286 /nfs/dbraw/zinc/36/42/86/387364286.db2.gz NRVPCFSHMDEJAV-LLVKDONJSA-N 2 0 249.333 2.181 20 0 BEADRP C[C@H]([NH2+]CCC1=CC[NH2+]CC1)C1(C)CC1 ZINC000423540866 387365694 /nfs/dbraw/zinc/36/56/94/387365694.db2.gz QYIZUNJPKPZLDE-NSHDSACASA-N 2 0 208.349 2.074 20 0 BEADRP C[C@H]([NH2+]CCC1=CC[NH2+]CC1)c1cncc(F)c1 ZINC000423545115 387367901 /nfs/dbraw/zinc/36/79/01/387367901.db2.gz XQAIJZOFIDJLRO-NSHDSACASA-N 2 0 249.333 2.181 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+]CCC1=CC[NH2+]CC1 ZINC000423542750 387367997 /nfs/dbraw/zinc/36/79/97/387367997.db2.gz UDDDILQEYWRMKH-ZDUSSCGKSA-N 2 0 245.370 2.350 20 0 BEADRP C(C[NH2+]C1CC1)C[NH2+][C@@H]1CC[C@@H]1C1CCC1 ZINC000423547391 387369599 /nfs/dbraw/zinc/36/95/99/387369599.db2.gz GBVZUBKTQIPHPM-ZIAGYGMSSA-N 2 0 222.376 2.297 20 0 BEADRP Cc1cc(C[NH2+][C@H]2CCCC[C@H]2C[NH3+])cc(C)n1 ZINC000423548890 387369725 /nfs/dbraw/zinc/36/97/25/387369725.db2.gz NAZZABMVZSNTTQ-GJZGRUSLSA-N 2 0 247.386 2.306 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]CCC2=CC[NH2+]CC2)C1 ZINC000423547908 387370107 /nfs/dbraw/zinc/37/01/07/387370107.db2.gz GDLMDEYSHXYQAY-OCCSQVGLSA-N 2 0 222.376 2.465 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]C[C@@H]1CC12CCSCC2 ZINC000423547209 387370701 /nfs/dbraw/zinc/37/07/01/387370701.db2.gz LEWAGNPDBZOVDQ-NEPJUHHUSA-N 2 0 242.432 2.237 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]C[C@H]1Cc2ccccc21 ZINC000643453646 387371239 /nfs/dbraw/zinc/37/12/39/387371239.db2.gz OVLJGZUXLVNJDY-GMXVVIOVSA-N 2 0 218.344 2.042 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1Cc2ccccc21)[C@@H]1CCC[NH2+]1 ZINC000643453649 387371719 /nfs/dbraw/zinc/37/17/19/387371719.db2.gz PEOKZEDOZXISFR-KYOSRNDESA-N 2 0 230.355 2.056 20 0 BEADRP CC[C@@H]1C[C@H]([NH2+][C@H]2CCCCC[C@H]2[NH3+])CCO1 ZINC000423554058 387373627 /nfs/dbraw/zinc/37/36/27/387373627.db2.gz RGMLGIXQYGVVNJ-SYQHCUMBSA-N 2 0 240.391 2.194 20 0 BEADRP C[C@H]1CCC[C@H]1[NH2+]CCC1=CC[NH2+]CC1 ZINC000423559192 387375174 /nfs/dbraw/zinc/37/51/74/387375174.db2.gz OQJSCHNZUIBMNX-WCQYABFASA-N 2 0 208.349 2.074 20 0 BEADRP CC(C)C1CC([NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)C1 ZINC000423555580 387375775 /nfs/dbraw/zinc/37/57/75/387375775.db2.gz XZQWRJAURBBOHG-FMUKHGEOSA-N 2 0 236.403 2.399 20 0 BEADRP C[C@@H]1CCCC[C@H]1[NH2+]CCC1=CC[NH2+]CC1 ZINC000423567170 387377031 /nfs/dbraw/zinc/37/70/31/387377031.db2.gz UXEDHUSUYNIONL-TZMCWYRMSA-N 2 0 222.376 2.465 20 0 BEADRP C[C@H]1CC[C@H]([NH2+]CCC2=CC[NH2+]CC2)C1 ZINC000423561850 387377503 /nfs/dbraw/zinc/37/75/03/387377503.db2.gz QHGGBVBPRJHVMR-AAEUAGOBSA-N 2 0 208.349 2.074 20 0 BEADRP CC1CCC([NH2+]CCC2=CC[NH2+]CC2)CC1 ZINC000423567047 387378001 /nfs/dbraw/zinc/37/80/01/387378001.db2.gz UMJIIUQJBNGYOZ-UHFFFAOYSA-N 2 0 222.376 2.465 20 0 BEADRP C[C@H]([NH2+]CCC[NH2+]C1CC1)C1CCSCC1 ZINC000423573156 387378984 /nfs/dbraw/zinc/37/89/84/387378984.db2.gz YZKBXTXJJGLQHF-NSHDSACASA-N 2 0 242.432 2.250 20 0 BEADRP CCCC[N@H+](CCOC)CC[C@@H]1CCC[NH+]1C ZINC000121244499 387319425 /nfs/dbraw/zinc/31/94/25/387319425.db2.gz XYQHJGNBUCQHBV-AWEZNQCLSA-N 2 0 242.407 2.219 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]CCC[C@@H]2CCC[NH2+]2)c2nccn21 ZINC000423472789 387319638 /nfs/dbraw/zinc/31/96/38/387319638.db2.gz GEFLBDPKKUIPIO-AGIUHOORSA-N 2 0 248.374 2.011 20 0 BEADRP C[C@@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1ccccn1 ZINC000423474357 387321455 /nfs/dbraw/zinc/32/14/55/387321455.db2.gz HFZZVPZCMNNBSK-CHWSQXEVSA-N 2 0 233.359 2.264 20 0 BEADRP CCO[C@@H]1C[C@@H]([NH2+]C[C@H]([NH3+])CC)C1(CC)CC ZINC000423477843 387324264 /nfs/dbraw/zinc/32/42/64/387324264.db2.gz UEKGISGVKANQGH-JHJVBQTASA-N 2 0 242.407 2.297 20 0 BEADRP CC(C)[C@@H](Cc1ccccc1)[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000423430597 387325945 /nfs/dbraw/zinc/32/59/45/387325945.db2.gz LDMMYSLSMVHGTJ-QXSJWSMHSA-N 2 0 244.382 2.061 20 0 BEADRP CC(C)[C@H](Cc1ccccc1)[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC000423430598 387326686 /nfs/dbraw/zinc/32/66/86/387326686.db2.gz LDMMYSLSMVHGTJ-XUWVNRHRSA-N 2 0 244.382 2.061 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCC23CCC3)C1 ZINC000390434501 387326614 /nfs/dbraw/zinc/32/66/14/387326614.db2.gz RIBXNODXNWHORH-OLZOCXBDSA-N 2 0 222.376 2.251 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000423483054 387328454 /nfs/dbraw/zinc/32/84/54/387328454.db2.gz PSFQPXUMGHZIHS-FRRDWIJNSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[C@H]([NH3+])C1)c1ccccn1 ZINC000423484150 387328851 /nfs/dbraw/zinc/32/88/51/387328851.db2.gz ZVKCRPKZIJDPMU-XQQFMLRXSA-N 2 0 233.359 2.250 20 0 BEADRP CC[C@H]([NH2+]CC1=CC[N@H+](C)CC1)[C@@H]1C[C@H]1C ZINC000321951511 387328995 /nfs/dbraw/zinc/32/89/95/387328995.db2.gz WXPPKSGZQDMQBF-BNOWGMLFSA-N 2 0 222.376 2.273 20 0 BEADRP CC(C)[C@H]([NH2+][C@H]1CC[C@@H](C[NH3+])C1)c1cccnc1 ZINC000423491904 387335707 /nfs/dbraw/zinc/33/57/07/387335707.db2.gz KRVFQOTZGBWVSR-SNPRPXQTSA-N 2 0 247.386 2.496 20 0 BEADRP CCCC[C@H](C)[C@H](C)[NH2+]C[C@@H]1C[NH2+]CCCO1 ZINC000423492164 387335899 /nfs/dbraw/zinc/33/58/99/387335899.db2.gz LYRVASGHYNKSJU-IHRRRGAJSA-N 2 0 242.407 2.169 20 0 BEADRP Cc1ccc([C@H](C)[NH2+][C@@H]2CC[C@@H](C[NH3+])C2)o1 ZINC000423492218 387336232 /nfs/dbraw/zinc/33/62/32/387336232.db2.gz MFXDMRBKKQJABO-QJPTWQEYSA-N 2 0 222.332 2.366 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[C@H](C[NH3+])C1)[C@H]1C[C@@H]1C ZINC000423493496 387338284 /nfs/dbraw/zinc/33/82/84/387338284.db2.gz BPOHDTJLDFAVBF-WJTVCTBASA-N 2 0 210.365 2.138 20 0 BEADRP Cc1cncc([C@H](C)[NH2+][C@H]2CC[C@H](C[NH3+])C2)c1 ZINC000423502196 387342791 /nfs/dbraw/zinc/34/27/91/387342791.db2.gz JSBKXKIXSQIDKL-OBJOEFQTSA-N 2 0 233.359 2.168 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000423508070 387344945 /nfs/dbraw/zinc/34/49/45/387344945.db2.gz KKVMLRGJPCNXPT-GZBFAFLISA-N 3 0 249.402 2.182 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H](C)[C@@H]1C[C@@H]1C ZINC000322002901 387346361 /nfs/dbraw/zinc/34/63/61/387346361.db2.gz HDLLEAMLQZYHLW-YNEHKIRRSA-N 2 0 212.381 2.352 20 0 BEADRP Cc1ccnc([C@H](C)[N@@H+]2C[C@@H](C)[C@](C)(C[NH3+])C2)c1 ZINC000423516237 387351144 /nfs/dbraw/zinc/35/11/44/387351144.db2.gz WGIUOJWPTNCIFF-VNHYZAJKSA-N 2 0 247.386 2.368 20 0 BEADRP CSC1(C[NH2+][C@H]2CC[N@H+](C)C[C@@H]2C)CCC1 ZINC000304004850 387427872 /nfs/dbraw/zinc/42/78/72/387427872.db2.gz SYEMWLFCOLLZIC-RYUDHWBXSA-N 2 0 242.432 2.202 20 0 BEADRP Cc1ccc(CCC[N@@H+](C)CC2(O)CCC2)cn1 ZINC000354685732 387416129 /nfs/dbraw/zinc/41/61/29/387416129.db2.gz ZTSUTRXEFWGGFF-UHFFFAOYSA-N 2 0 248.370 2.169 20 0 BEADRP C[C@@H](C[NH2+][C@H](C)[C@@H]1CCCC[NH2+]1)C1CC1 ZINC000643468285 387418122 /nfs/dbraw/zinc/41/81/22/387418122.db2.gz IBILQXKYVZLGMM-LOWVWBTDSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H](C[NH2+][C@@H](C)[C@H]1CCCC[NH2+]1)C1CC1 ZINC000643468283 387418390 /nfs/dbraw/zinc/41/83/90/387418390.db2.gz IBILQXKYVZLGMM-GMXVVIOVSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@H]([NH2+]C[C@H](C)C1CC1)[C@@H]1CCC[NH2+]1 ZINC000643468349 387418955 /nfs/dbraw/zinc/41/89/55/387418955.db2.gz SYEDNKKBLJKCDK-DRZSPHRISA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC[NH2+]CC[C@H]1C)C1CC1 ZINC000643468336 387419524 /nfs/dbraw/zinc/41/95/24/387419524.db2.gz QLXGMZYGROJWIK-WZRBSPASSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@H](Cc1cccs1)[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000643509245 387505345 /nfs/dbraw/zinc/50/53/45/387505345.db2.gz NSOPNFDGPFUCEV-NEPJUHHUSA-N 2 0 238.400 2.268 20 0 BEADRP CO[C@@H]1CCC[C@H]([NH2+][C@@H]2CCCC[C@@H]2C[NH3+])C1 ZINC000643475300 387509723 /nfs/dbraw/zinc/50/97/23/387509723.db2.gz CDZLOZZTSGAYSM-XJFOESAGSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCC[C@H]1C[NH3+])CC(F)(F)F ZINC000396917963 387515693 /nfs/dbraw/zinc/51/56/93/387515693.db2.gz VXZHOEQCXKNEFM-LPEHRKFASA-N 2 0 238.297 2.292 20 0 BEADRP CO[C@@H]1CCCC[C@H]1[NH2+]CC[C@@H]1CCC[N@@H+]1C ZINC000361748982 387529334 /nfs/dbraw/zinc/52/93/34/387529334.db2.gz CRUKYFZISLRMCM-BFHYXJOUSA-N 2 0 240.391 2.018 20 0 BEADRP CC[C@]1(C)CC[N@H+](C[C@H]2CC[NH2+][C@H](C)C2)C1 ZINC000399498854 387532821 /nfs/dbraw/zinc/53/28/21/387532821.db2.gz XDIIBABDEWAASW-HZSPNIEDSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H](CCc1ccsc1)[NH2+]CCNC1CC1 ZINC000643507811 387479892 /nfs/dbraw/zinc/47/98/92/387479892.db2.gz PXZYQXMWKHNSQL-LLVKDONJSA-N 2 0 238.400 2.411 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]2C[N@H+](CCCCCF)C[C@H]21 ZINC000304454836 387483176 /nfs/dbraw/zinc/48/31/76/387483176.db2.gz YQCXOTJPHUITKO-YNEHKIRRSA-N 2 0 228.355 2.185 20 0 BEADRP CC(C)[NH2+]CCCN[C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000643508496 387486615 /nfs/dbraw/zinc/48/66/15/387486615.db2.gz TWORRUOCINUWMI-CABCVRRESA-N 2 0 247.386 2.109 20 0 BEADRP CC[N@H+](C)C[C@@H]1CCN(CCC(F)(F)F)C1 ZINC000355881384 387590065 /nfs/dbraw/zinc/59/00/65/387590065.db2.gz PTTWUJSNQAPNAO-JTQLQIEISA-N 2 0 238.297 2.212 20 0 BEADRP CCCCOCC[N@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000355889004 387590855 /nfs/dbraw/zinc/59/08/55/387590855.db2.gz JONSMKIVIFZSGA-CQSZACIVSA-N 2 0 242.407 2.077 20 0 BEADRP CC(C)[C@H]([NH3+])C[NH2+][C@@H](C)Cc1cccs1 ZINC000643511613 387593502 /nfs/dbraw/zinc/59/35/02/387593502.db2.gz LEVINDVWEQCGQJ-CMPLNLGQSA-N 2 0 226.389 2.252 20 0 BEADRP CC[C@@H](Cc1cccs1)[NH2+]C[C@@H](C)C[NH3+] ZINC000643514660 387599169 /nfs/dbraw/zinc/59/91/69/387599169.db2.gz LILBHLYEJGHKGM-QWRGUYRKSA-N 2 0 226.389 2.254 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCC[C@@H](C)C1)[C@H]1CCC[NH2+]1 ZINC000422702784 387617324 /nfs/dbraw/zinc/61/73/24/387617324.db2.gz LPLFJCSAWJOUJS-FDYHWXHSSA-N 2 0 210.365 2.295 20 0 BEADRP CC[C@H](Cc1ccccc1)[NH2+][C@H](C)C1C[NH2+]C1 ZINC000422702867 387617420 /nfs/dbraw/zinc/61/74/20/387617420.db2.gz GDYOIUUUYSWLHQ-IUODEOHRSA-N 2 0 232.371 2.205 20 0 BEADRP CC[C@@H](Cc1ccccc1)[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000422702869 387618114 /nfs/dbraw/zinc/61/81/14/387618114.db2.gz GDYOIUUUYSWLHQ-WFASDCNBSA-N 2 0 232.371 2.205 20 0 BEADRP C[C@H]([NH3+])[C@H](Cc1ccccc1)[NH2+]C[C@H]1C[C@H]1C ZINC000422703611 387618240 /nfs/dbraw/zinc/61/82/40/387618240.db2.gz NOHSNAPWVHTFMR-OSRDXIQISA-N 2 0 232.371 2.191 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCC[C@@H](C)C1)[C@@H]1CCC[NH2+]1 ZINC000422702786 387618421 /nfs/dbraw/zinc/61/84/21/387618421.db2.gz LPLFJCSAWJOUJS-XQHKEYJVSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H]([NH3+])[C@H](Cc1ccccc1)[NH2+]C[C@H]1C[C@@H]1C ZINC000422703612 387619264 /nfs/dbraw/zinc/61/92/64/387619264.db2.gz NOHSNAPWVHTFMR-VIRABCJISA-N 2 0 232.371 2.191 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]C[C@@H]1C[C@@H]1C ZINC000422701917 387619390 /nfs/dbraw/zinc/61/93/90/387619390.db2.gz JKRUDGOAADDBFC-NHCYSSNCSA-N 2 0 233.359 2.155 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CC1CCC1 ZINC000422709108 387623819 /nfs/dbraw/zinc/62/38/19/387623819.db2.gz CSMDNEUFKVDKAQ-JTQLQIEISA-N 2 0 233.359 2.299 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CC1CCC1 ZINC000422709109 387624151 /nfs/dbraw/zinc/62/41/51/387624151.db2.gz CSMDNEUFKVDKAQ-SNVBAGLBSA-N 2 0 233.359 2.299 20 0 BEADRP CC[C@H](C)[C@H](O)C[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000422713315 387624750 /nfs/dbraw/zinc/62/47/50/387624750.db2.gz PMMBLURXPYXBSB-BSLXNSKLSA-N 2 0 248.370 2.128 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]Cc1cccc(N(C)C)c1 ZINC000422711934 387625950 /nfs/dbraw/zinc/62/59/50/387625950.db2.gz HVKZHEYSVAQYPW-CYBMUJFWSA-N 2 0 249.402 2.360 20 0 BEADRP CC[N@H+](CCC[NH2+]C)Cc1ccccc1 ZINC000042409461 387627769 /nfs/dbraw/zinc/62/77/69/387627769.db2.gz OUQOZFQDCFCCAG-UHFFFAOYSA-N 2 0 206.333 2.118 20 0 BEADRP CC(C)n1cc([C@@H](C)[NH2+][C@@H](C)CCC[NH3+])cn1 ZINC000422716661 387627938 /nfs/dbraw/zinc/62/79/38/387627938.db2.gz UVUMOLPHXXGASQ-NWDGAFQWSA-N 2 0 238.379 2.242 20 0 BEADRP C[C@@](C[NH3+])(NCc1ccc(F)c(F)c1)C1CC1 ZINC000430597588 387629948 /nfs/dbraw/zinc/62/99/48/387629948.db2.gz QPBFZQXOQAUBJL-ZDUSSCGKSA-N 2 0 240.297 2.182 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+][C@@H](C)C2C[NH2+]C2)cc1 ZINC000422718639 387631926 /nfs/dbraw/zinc/63/19/26/387631926.db2.gz LQHGRNLAVAVCGS-NEPJUHHUSA-N 2 0 218.344 2.254 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]Cc1ccc(F)cc1 ZINC000422726836 387635197 /nfs/dbraw/zinc/63/51/97/387635197.db2.gz GBRLFURZZWMGFV-NXEZZACHSA-N 2 0 210.296 2.041 20 0 BEADRP CCOCCCC[NH2+][C@@H]1CCCCC[C@@H]1[NH3+] ZINC000422726202 387636739 /nfs/dbraw/zinc/63/67/39/387636739.db2.gz ZIFPCODOJHGFHD-QWHCGFSZSA-N 2 0 228.380 2.053 20 0 BEADRP CCCCOCCC[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000422726506 387636926 /nfs/dbraw/zinc/63/69/26/387636926.db2.gz FBNXAVLCZMJHIF-PBWFPOADSA-N 2 0 240.391 2.066 20 0 BEADRP CCOCCCC[NH2+][C@H]1CCCCC[C@H]1[NH3+] ZINC000422726201 387637009 /nfs/dbraw/zinc/63/70/09/387637009.db2.gz ZIFPCODOJHGFHD-OLZOCXBDSA-N 2 0 228.380 2.053 20 0 BEADRP CCOCCCC[NH2+][C@@H]1CCCCC[C@H]1[NH3+] ZINC000422726100 387637019 /nfs/dbraw/zinc/63/70/19/387637019.db2.gz ZIFPCODOJHGFHD-CHWSQXEVSA-N 2 0 228.380 2.053 20 0 BEADRP C[NH+](C)[C@@H]1CCC[N@H+](C[C@H]2CCC=CO2)CC1 ZINC000376475694 387638249 /nfs/dbraw/zinc/63/82/49/387638249.db2.gz BPNLQFIYHSROMQ-ZIAGYGMSSA-N 2 0 238.375 2.095 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CCc1c[nH]c2ccccc12 ZINC000422732988 387640789 /nfs/dbraw/zinc/64/07/89/387640789.db2.gz PYRVXJHJTPAPFB-VXGBXAGGSA-N 2 0 245.370 2.426 20 0 BEADRP [NH3+][C@H]1CCCCC[C@@H]1[NH2+]CCC1CCOCC1 ZINC000422734383 387643509 /nfs/dbraw/zinc/64/35/09/387643509.db2.gz SELVTTAGCNOMDZ-KBPBESRZSA-N 2 0 240.391 2.053 20 0 BEADRP CCCC[C@@H](CC)C[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000422741442 387647257 /nfs/dbraw/zinc/64/72/57/387647257.db2.gz DRHQUVFSAKHYDU-NWDGAFQWSA-N 2 0 212.381 2.400 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)[C@@H]2C[C@H]2C2CC2)C1 ZINC000527639398 387648605 /nfs/dbraw/zinc/64/86/05/387648605.db2.gz CAKNMCPHBNGGHK-NEBZKDRISA-N 2 0 236.403 2.352 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]1[NH2+]CCc1ccccc1Cl ZINC000422788515 387652817 /nfs/dbraw/zinc/65/28/17/387652817.db2.gz VMARNGRWBIDXOS-STQMWFEESA-N 2 0 238.762 2.352 20 0 BEADRP C[C@H]([NH2+]Cc1ccc(Cl)cc1)C1C[NH2+]C1 ZINC000422748973 387653547 /nfs/dbraw/zinc/65/35/47/387653547.db2.gz WXPDTKWKWFKWQF-VIFPVBQESA-N 2 0 224.735 2.038 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]CCOC1CCCCCC1 ZINC000422751595 387656451 /nfs/dbraw/zinc/65/64/51/387656451.db2.gz BPWZCLZRRXOLLM-ZDUSSCGKSA-N 2 0 242.407 2.443 20 0 BEADRP Cc1ccc(C[NH2+][C@@H](C)C[C@H](C)[NH3+])cc1 ZINC000422756415 387657449 /nfs/dbraw/zinc/65/74/49/387657449.db2.gz IQYPDOLVNHZAAU-RYUDHWBXSA-N 2 0 206.333 2.210 20 0 BEADRP CSCCCC[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000422754752 387657743 /nfs/dbraw/zinc/65/77/43/387657743.db2.gz JZNKIHZJABIPJM-FOSCPWQOSA-N 2 0 228.405 2.002 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)N[C@@H](CC[NH+](C)C)C(C)(C)C ZINC000422756215 387657867 /nfs/dbraw/zinc/65/78/67/387657867.db2.gz HLFAORZFNLTDBU-AVGNSLFASA-N 2 0 243.439 2.068 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)N[C@H](CC[NH+](C)C)C(C)(C)C ZINC000422756221 387658034 /nfs/dbraw/zinc/65/80/34/387658034.db2.gz HLFAORZFNLTDBU-RWMBFGLXSA-N 2 0 243.439 2.068 20 0 BEADRP C[C@@H]([NH2+]CCCNc1ccccc1)[C@H]1CCC[NH2+]1 ZINC000422758689 387659978 /nfs/dbraw/zinc/65/99/78/387659978.db2.gz OFESJAAXBVYZGA-UKRRQHHQSA-N 2 0 247.386 2.219 20 0 BEADRP CCc1ccc(CC[N@@H+]2CC[C@H]([NH3+])[C@H](C)C2)cc1 ZINC000430953864 387663333 /nfs/dbraw/zinc/66/33/33/387663333.db2.gz DBSYYHOIQGLIPA-CJNGLKHVSA-N 2 0 246.398 2.461 20 0 BEADRP Cc1ccccc1O[C@H](C)C[NH2+][C@H]1CCC[C@H]1[NH3+] ZINC000422795547 387695721 /nfs/dbraw/zinc/69/57/21/387695721.db2.gz VYCUWKIIKOHHGF-MCIONIFRSA-N 2 0 248.370 2.232 20 0 BEADRP CC(C)COCCC[NH2+][C@H]1CC[NH2+]CC[C@@H]1C ZINC000422795070 387695753 /nfs/dbraw/zinc/69/57/53/387695753.db2.gz ZPFIJJYQQFAXNM-KBPBESRZSA-N 2 0 242.407 2.027 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CCc1ccccc1F ZINC000422766365 387666075 /nfs/dbraw/zinc/66/60/75/387666075.db2.gz PXNOUENBSNTSED-MNOVXSKESA-N 2 0 224.323 2.084 20 0 BEADRP CC(C)OCCC[NH2+][C@@H]1CCCCC[C@H]1[NH3+] ZINC000422773421 387670547 /nfs/dbraw/zinc/67/05/47/387670547.db2.gz ZVRPOTUNHNKTNS-CHWSQXEVSA-N 2 0 228.380 2.051 20 0 BEADRP CC[C@@H](COC)[NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1 ZINC000125971118 387670571 /nfs/dbraw/zinc/67/05/71/387670571.db2.gz MIOZSOGTWIPLKV-KBPBESRZSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CCCN(C)c1ccccc1 ZINC000422771207 387671097 /nfs/dbraw/zinc/67/10/97/387671097.db2.gz XEHNNMNWXLPJCO-UONOGXRCSA-N 2 0 249.402 2.228 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]Cc1ccccc1F ZINC000422771603 387671281 /nfs/dbraw/zinc/67/12/81/387671281.db2.gz XLLIERXGFDBVSV-VHSXEESVSA-N 2 0 210.296 2.041 20 0 BEADRP CC[C@H]([NH2+][C@H]1CCC[NH2+]CC1)c1ccncc1 ZINC000422775772 387671717 /nfs/dbraw/zinc/67/17/17/387671717.db2.gz CGXRBJLRVIKLMZ-KBPBESRZSA-N 2 0 233.359 2.264 20 0 BEADRP CCOc1cccc([C@@H](C)[NH2+][C@H](C)C2C[NH2+]C2)c1 ZINC000422779796 387679418 /nfs/dbraw/zinc/67/94/18/387679418.db2.gz JEGHBAIPTGEXME-VXGBXAGGSA-N 2 0 248.370 2.344 20 0 BEADRP C[C@@H](CC1CCC1)[NH2+]CC1=CC[NH2+]CC1 ZINC000643520159 387679571 /nfs/dbraw/zinc/67/95/71/387679571.db2.gz QQTWZDFSUVUSRR-NSHDSACASA-N 2 0 208.349 2.074 20 0 BEADRP CC[C@H]([NH2+][C@H](C)C[C@@H](C)[NH3+])c1ccncc1 ZINC000422782380 387680146 /nfs/dbraw/zinc/68/01/46/387680146.db2.gz LWIVASRYAJXYJD-WZRBSPASSA-N 2 0 221.348 2.248 20 0 BEADRP C[C@@H](CCc1ccco1)[NH2+]CC1=CC[NH2+]CC1 ZINC000643520149 387680437 /nfs/dbraw/zinc/68/04/37/387680437.db2.gz POELSGKDZIPQMQ-LBPRGKRZSA-N 2 0 234.343 2.110 20 0 BEADRP [NH3+][C@H]1CCC[C@H]1[NH2+]CCCOC1CCCCC1 ZINC000422783486 387682525 /nfs/dbraw/zinc/68/25/25/387682525.db2.gz LEBQYWRUUCMMTM-UONOGXRCSA-N 2 0 240.391 2.195 20 0 BEADRP C[C@@H](C[NH2+][C@@H](C)C1C[NH2+]C1)Cc1cccs1 ZINC000422787679 387686155 /nfs/dbraw/zinc/68/61/55/387686155.db2.gz UWXVEIIILVOPBN-MNOVXSKESA-N 2 0 238.400 2.124 20 0 BEADRP C1=CCC(C[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)C1 ZINC000527742478 387686808 /nfs/dbraw/zinc/68/68/08/387686808.db2.gz BQNDOLTUBLAUGA-KBPBESRZSA-N 2 0 220.360 2.169 20 0 BEADRP C1=CCC(C[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)C1 ZINC000527742482 387687470 /nfs/dbraw/zinc/68/74/70/387687470.db2.gz BQNDOLTUBLAUGA-UONOGXRCSA-N 2 0 220.360 2.169 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCC[C@H]1[NH3+])c1ccc(F)cc1 ZINC000422744191 387689516 /nfs/dbraw/zinc/68/95/16/387689516.db2.gz SOGZBOHENDYSGU-HONMWMINSA-N 2 0 236.334 2.399 20 0 BEADRP CO[C@H](C[NH2+][C@H](C)C[C@H](C)[NH3+])c1ccccc1 ZINC000422743326 387691269 /nfs/dbraw/zinc/69/12/69/387691269.db2.gz TYGDYDWCDJZCDO-OUCADQQQSA-N 2 0 236.359 2.090 20 0 BEADRP CC(C)COCCC[NH2+]C1CCC(C[NH3+])CC1 ZINC000422790868 387694064 /nfs/dbraw/zinc/69/40/64/387694064.db2.gz ULKXJHWCTBMDML-UHFFFAOYSA-N 2 0 242.407 2.156 20 0 BEADRP C[C@H](Cc1cccs1)[NH2+][C@H]1CC[NH2+][C@H](C)C1 ZINC000643525501 387747639 /nfs/dbraw/zinc/74/76/39/387747639.db2.gz YXOWWLGUEKBPKA-UTUOFQBUSA-N 2 0 238.400 2.409 20 0 BEADRP COc1cc(C)ccc1C[NH2+][C@H](C)CCC[NH3+] ZINC000422871987 387748964 /nfs/dbraw/zinc/74/89/64/387748964.db2.gz FEOSBAJUDSSTAQ-GFCCVEGCSA-N 2 0 236.359 2.221 20 0 BEADRP C[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)[C@H]1CC12CC2 ZINC000527846511 387752578 /nfs/dbraw/zinc/75/25/78/387752578.db2.gz FPKRAKOIHQRHSD-OUCADQQQSA-N 2 0 234.387 2.249 20 0 BEADRP CSc1ccc(C[NH2+][C@H](C)C2C[NH2+]C2)cc1 ZINC000422876750 387753909 /nfs/dbraw/zinc/75/39/09/387753909.db2.gz GKYVZJJUUWYCQW-SNVBAGLBSA-N 2 0 236.384 2.106 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[C@@H]2CCC[C@H]2C1 ZINC000422796207 387699582 /nfs/dbraw/zinc/69/95/82/387699582.db2.gz XSIHVGSLRODTEE-QNSTZXKLSA-N 2 0 222.376 2.425 20 0 BEADRP C[C@H]([NH2+]Cc1cc(F)cc(F)c1)[C@H]1CC[NH2+]C1 ZINC000422803496 387701656 /nfs/dbraw/zinc/70/16/56/387701656.db2.gz IYNQLCLXSSNQEY-ONGXEEELSA-N 2 0 240.297 2.052 20 0 BEADRP CCSCC[C@@H](C)[NH2+][C@H](C)[C@@H]1CCC[NH2+]1 ZINC000422802556 387701954 /nfs/dbraw/zinc/70/19/54/387701954.db2.gz DQFCKCXPSBTGKL-UTUOFQBUSA-N 2 0 230.421 2.248 20 0 BEADRP CCSCC[C@@H](C)[NH2+][C@H](C)[C@H]1CCC[NH2+]1 ZINC000422802555 387703109 /nfs/dbraw/zinc/70/31/09/387703109.db2.gz DQFCKCXPSBTGKL-IJLUTSLNSA-N 2 0 230.421 2.248 20 0 BEADRP COCC[C@H](C)[NH2+]C[C@@H](C)C[NH+]1CCCCC1 ZINC000045037475 387703504 /nfs/dbraw/zinc/70/35/04/387703504.db2.gz ABVYPXZFGVKVDP-KGLIPLIRSA-N 2 0 242.407 2.123 20 0 BEADRP CO[C@H](C[NH2+][C@@H]1CCCCC[C@H]1[NH3+])C(C)(C)C ZINC000422805390 387704237 /nfs/dbraw/zinc/70/42/37/387704237.db2.gz GPGPHUBJWJUNFY-JHJVBQTASA-N 2 0 242.407 2.297 20 0 BEADRP CCCCN(C)CC[NH2+][C@H](C)C1(C)CC1 ZINC000163521733 387704525 /nfs/dbraw/zinc/70/45/25/387704525.db2.gz UOAMVTWVHOHPHO-GFCCVEGCSA-N 2 0 212.381 2.497 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]1[NH2+]CC1(c2ccccc2)CC1 ZINC000422808427 387708100 /nfs/dbraw/zinc/70/81/00/387708100.db2.gz LDKNQQHAVSBAAC-KBPBESRZSA-N 2 0 230.355 2.188 20 0 BEADRP Cc1ccc2[nH]c(C[NH2+][C@@H](C)CCC[NH3+])nc2c1 ZINC000422808687 387709265 /nfs/dbraw/zinc/70/92/65/387709265.db2.gz LIMXSXQTWGXPPV-NSHDSACASA-N 2 0 246.358 2.088 20 0 BEADRP CCO[C@H](CC[NH2+][C@H](C)C[C@H](C)[NH3+])C(C)C ZINC000422810825 387709306 /nfs/dbraw/zinc/70/93/06/387709306.db2.gz NYJSDEVNFYZRCQ-YNEHKIRRSA-N 2 0 230.396 2.153 20 0 BEADRP CCO[C@H](CC[NH2+][C@H](C)C[C@@H](C)[NH3+])C(C)C ZINC000422810823 387709368 /nfs/dbraw/zinc/70/93/68/387709368.db2.gz NYJSDEVNFYZRCQ-JHJVBQTASA-N 2 0 230.396 2.153 20 0 BEADRP CCO[C@H](CC[NH2+][C@H]1CCC[C@H]1C[NH3+])C(C)C ZINC000422811899 387711371 /nfs/dbraw/zinc/71/13/71/387711371.db2.gz PUSGYKYYWDHIEF-MELADBBJSA-N 2 0 242.407 2.155 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)C1C[NH2+]C1)[C@@H](C)c1ccccc1 ZINC000422817837 387715447 /nfs/dbraw/zinc/71/54/47/387715447.db2.gz DXRTWTCVZKKCEA-UPJWGTAASA-N 2 0 232.371 2.376 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CCc1cc(F)ccc1F ZINC000422819855 387716333 /nfs/dbraw/zinc/71/63/33/387716333.db2.gz JCSJIGZPZIAJMX-UWVGGRQHSA-N 2 0 242.313 2.223 20 0 BEADRP C[C@H]([NH2+]CCCOC1CCCC1)[C@H]1CCC[NH2+]1 ZINC000422822890 387716435 /nfs/dbraw/zinc/71/64/35/387716435.db2.gz BSTMORMGLDEYGK-GXTWGEPZSA-N 2 0 240.391 2.066 20 0 BEADRP Cc1ncc([C@H](C)[NH2+][C@@H]2CCC[NH2+]CC2)s1 ZINC000643521741 387717294 /nfs/dbraw/zinc/71/72/94/387717294.db2.gz APMOTZWMAOBBSG-GXSJLCMTSA-N 2 0 239.388 2.244 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[NH2+]CC1)C1CCSCC1 ZINC000643522569 387719510 /nfs/dbraw/zinc/71/95/10/387719510.db2.gz PNMJAISLZFFNCE-AAEUAGOBSA-N 2 0 242.432 2.250 20 0 BEADRP C1CC2(C1)CCC[C@H]2[NH2+][C@H]1CCC[NH2+]CC1 ZINC000643522771 387722278 /nfs/dbraw/zinc/72/22/78/387722278.db2.gz FFZMVVYBMYRENG-QWHCGFSZSA-N 2 0 222.376 2.441 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCC[NH2+]CC1)[C@@H]1C[C@H]1C ZINC000643522967 387723799 /nfs/dbraw/zinc/72/37/99/387723799.db2.gz QSIIMYCWLIVITC-LPWJVIDDSA-N 2 0 210.365 2.153 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]CCCOC1CCCC1 ZINC000422834754 387724780 /nfs/dbraw/zinc/72/47/80/387724780.db2.gz XKQANKHVNIBJFS-JSGCOSHPSA-N 2 0 240.391 2.053 20 0 BEADRP c1coc(CC[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)c1 ZINC000127807176 387725729 /nfs/dbraw/zinc/72/57/29/387725729.db2.gz OUOOAHJYDHTKBJ-CHWSQXEVSA-N 2 0 234.343 2.039 20 0 BEADRP Cn1ccc(C[NH2+]C[C@H]2CCN2C2CCCC2)c1 ZINC000527805811 387728649 /nfs/dbraw/zinc/72/86/49/387728649.db2.gz IFTWGZOYNKQCOL-OAHLLOKOSA-N 2 0 247.386 2.132 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@H](C)Cc1ccncc1 ZINC000422835135 387729378 /nfs/dbraw/zinc/72/93/78/387729378.db2.gz IJROUFDVHPIASO-CHWSQXEVSA-N 2 0 235.375 2.120 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCCC1(C)C)[C@H]1CCC[NH2+]1 ZINC000422839644 387729489 /nfs/dbraw/zinc/72/94/89/387729489.db2.gz RAVSBGBICMONQP-IJLUTSLNSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CCc1cc(F)cc(F)c1 ZINC000422842232 387731016 /nfs/dbraw/zinc/73/10/16/387731016.db2.gz FLLRRXQAGPVGRR-VHSXEESVSA-N 2 0 242.313 2.223 20 0 BEADRP CC(C)CCOCC[NH2+][C@H]1CCCCC[C@H]1[NH3+] ZINC000422788941 387732309 /nfs/dbraw/zinc/73/23/09/387732309.db2.gz WFHCSKMGLITYLM-KGLIPLIRSA-N 2 0 242.407 2.299 20 0 BEADRP C[C@H](CC[NH2+][C@H](C)C1C[NH2+]C1)c1ccccc1 ZINC000422856583 387741060 /nfs/dbraw/zinc/74/10/60/387741060.db2.gz WZNGIVGOFRCUKD-CHWSQXEVSA-N 2 0 232.371 2.378 20 0 BEADRP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]CCc1ccccc1 ZINC000128188839 387741063 /nfs/dbraw/zinc/74/10/63/387741063.db2.gz IFKNTQHOSCZARD-ZFWWWQNUSA-N 2 0 232.371 2.159 20 0 BEADRP C[C@@H]([NH3+])C[NH2+][C@@H](C)CCCC(F)(F)F ZINC000643527583 387765521 /nfs/dbraw/zinc/76/55/21/387765521.db2.gz OSWWBWTVZRDGFM-SFYZADRCSA-N 2 0 212.259 2.044 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]C[C@@H]1CCc2ccccc21 ZINC000422909134 387768682 /nfs/dbraw/zinc/76/86/82/387768682.db2.gz NKBGUJAIULGZMX-NWANDNLSSA-N 2 0 230.355 2.186 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CCc2ccccc21)[C@@H]1CCC[NH2+]1 ZINC000422909014 387769094 /nfs/dbraw/zinc/76/90/94/387769094.db2.gz NITNSTQYKYTYMU-INWMFGNUSA-N 2 0 244.382 2.447 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CCc2ccccc21 ZINC000422910692 387769158 /nfs/dbraw/zinc/76/91/58/387769158.db2.gz RJOOOBGUSGJSIO-DZKIICNBSA-N 2 0 244.382 2.433 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CCc2ccccc21)[C@H]1CCC[NH2+]1 ZINC000422909015 387769865 /nfs/dbraw/zinc/76/98/65/387769865.db2.gz NITNSTQYKYTYMU-IVMMDQJWSA-N 2 0 244.382 2.447 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]C[C@H]1CCc2ccccc21 ZINC000422910695 387769907 /nfs/dbraw/zinc/76/99/07/387769907.db2.gz RJOOOBGUSGJSIO-SQWLQELKSA-N 2 0 244.382 2.433 20 0 BEADRP C[C@H](CCc1ccc(F)cc1)[NH2+]C[C@H](C)[NH3+] ZINC000643529032 387772771 /nfs/dbraw/zinc/77/27/71/387772771.db2.gz SZELAAFIKWTLKJ-WDEREUQCSA-N 2 0 224.323 2.084 20 0 BEADRP Cc1cc([C@@H](C)[NH2+][C@H](C)C2C[NH2+]C2)ccc1F ZINC000422918116 387773424 /nfs/dbraw/zinc/77/34/24/387773424.db2.gz GPWRPNLYWMQRTC-GHMZBOCLSA-N 2 0 236.334 2.393 20 0 BEADRP CC(C)C1(C[NH2+][C@H]2CC[NH2+]CC[C@@H]2C)CC1 ZINC000422921476 387775037 /nfs/dbraw/zinc/77/50/37/387775037.db2.gz QANUJSFTBZQRPO-STQMWFEESA-N 2 0 224.392 2.400 20 0 BEADRP CC(C)C1(C[NH2+][C@H]2CC[NH2+]CC[C@H]2C)CC1 ZINC000422921474 387776144 /nfs/dbraw/zinc/77/61/44/387776144.db2.gz QANUJSFTBZQRPO-OLZOCXBDSA-N 2 0 224.392 2.400 20 0 BEADRP Cc1cccc(CC[C@H](C)[NH2+]C[C@H](C)[NH3+])c1 ZINC000643529382 387777621 /nfs/dbraw/zinc/77/76/21/387777621.db2.gz ZBXOFGVXRLTGHV-STQMWFEESA-N 2 0 220.360 2.253 20 0 BEADRP C[C@@H]([NH3+])C[NH2+][C@@H]1CCCC12CCCCC2 ZINC000643529609 387777779 /nfs/dbraw/zinc/77/77/79/387777779.db2.gz GEDDXKIVKAPUMB-VXGBXAGGSA-N 2 0 210.365 2.426 20 0 BEADRP Cc1cc(C)cc(C[C@@H](C)[NH2+][C@@H](C)C2C[NH2+]C2)c1 ZINC000422923155 387777987 /nfs/dbraw/zinc/77/79/87/387777987.db2.gz RHFKXHXBMASYFE-KGLIPLIRSA-N 2 0 246.398 2.432 20 0 BEADRP Cc1cccc(OCC[NH2+][C@H](C)C[C@@H](C)[NH3+])c1 ZINC000422927841 387779334 /nfs/dbraw/zinc/77/93/34/387779334.db2.gz HIFDBGHWULVIKX-CHWSQXEVSA-N 2 0 236.359 2.089 20 0 BEADRP COc1ccc(C[NH2+][C@H](C)C[C@H](C)[NH3+])c(F)c1 ZINC000422932355 387780583 /nfs/dbraw/zinc/78/05/83/387780583.db2.gz ZBHZTNILNHGJDU-VHSXEESVSA-N 2 0 240.322 2.050 20 0 BEADRP COc1ccc(C[NH2+][C@@H](C)C[C@H](C)[NH3+])c(F)c1 ZINC000422932353 387781626 /nfs/dbraw/zinc/78/16/26/387781626.db2.gz ZBHZTNILNHGJDU-UWVGGRQHSA-N 2 0 240.322 2.050 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+]CC1(C2CC2)CC1 ZINC000422937758 387783639 /nfs/dbraw/zinc/78/36/39/387783639.db2.gz OPWOBFKZMOXHQJ-WCQYABFASA-N 2 0 222.376 2.154 20 0 BEADRP CCOc1ccc(C[NH2+][C@@H](C)C[C@@H](C)[NH3+])cc1 ZINC000422901483 387785368 /nfs/dbraw/zinc/78/53/68/387785368.db2.gz LAPXVQVHBZCESG-NEPJUHHUSA-N 2 0 236.359 2.301 20 0 BEADRP CC(C)CC[C@](C)(O)C[NH2+][C@@H](C)CCCC[NH3+] ZINC000422979262 387788791 /nfs/dbraw/zinc/78/87/91/387788791.db2.gz MJWWXSSAIGUDGJ-KBPBESRZSA-N 2 0 244.423 2.281 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+][C@@H]1CC=CCC1 ZINC000422986711 387795203 /nfs/dbraw/zinc/79/52/03/387795203.db2.gz HENDSFOIGIUVQS-UPJWGTAASA-N 2 0 208.349 2.073 20 0 BEADRP CCC[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1)OCC ZINC000527934692 387795775 /nfs/dbraw/zinc/79/57/75/387795775.db2.gz SZSVQYPRCSWBCR-BFHYXJOUSA-N 2 0 242.407 2.264 20 0 BEADRP C[C@@H]1C[C@H](C[NH2+][C@H]2CCCCC[C@H]2[NH3+])CCO1 ZINC000422985567 387796582 /nfs/dbraw/zinc/79/65/82/387796582.db2.gz FIKMFECAKCDVRV-SYQHCUMBSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@@H]([NH2+]CC1C2CC3CC(C2)CC1C3)C1C[NH2+]C1 ZINC000422989777 387798196 /nfs/dbraw/zinc/79/81/96/387798196.db2.gz MMBSVLBSSPRZCD-YVWFZZAJSA-N 2 0 248.414 2.256 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CCC[C@H]1CCCC[C@@H]1O ZINC000422988944 387798944 /nfs/dbraw/zinc/79/89/44/387798944.db2.gz JYCSKAKYMGBRES-MCIONIFRSA-N 2 0 242.407 2.035 20 0 BEADRP CC(C)(CCCO)C[NH2+][C@H]1CCCCC[C@@H]1[NH3+] ZINC000422992011 387799450 /nfs/dbraw/zinc/79/94/50/387799450.db2.gz PLGBLVXQBKMBBG-STQMWFEESA-N 2 0 242.407 2.035 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC=CCC1)[C@H]1CCCC[NH2+]1 ZINC000422990515 387799625 /nfs/dbraw/zinc/79/96/25/387799625.db2.gz NQUMITAELWXBJG-FRRDWIJNSA-N 2 0 208.349 2.215 20 0 BEADRP COCCC1(C[NH2+][C@@H]2CCCCC[C@@H]2[NH3+])CC1 ZINC000422992855 387799870 /nfs/dbraw/zinc/79/98/70/387799870.db2.gz RSRQYMMRIAOVFC-QWHCGFSZSA-N 2 0 240.391 2.053 20 0 BEADRP FC1(F)CCC[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000422992864 387800682 /nfs/dbraw/zinc/80/06/82/387800682.db2.gz RUZGISCUHBKAFF-PSIUFMSWSA-N 2 0 244.329 2.437 20 0 BEADRP CC[C@H]([NH2+][C@H]1CC=CCC1)[C@@H]1CCC[NH2+]1 ZINC000422997682 387801598 /nfs/dbraw/zinc/80/15/98/387801598.db2.gz VHFJSTCRFOQMQE-AVGNSLFASA-N 2 0 208.349 2.215 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+]CCCc1ccccn1 ZINC000422994484 387802620 /nfs/dbraw/zinc/80/26/20/387802620.db2.gz HVWWTTNLNQOXOJ-UKRRQHHQSA-N 2 0 247.386 2.121 20 0 BEADRP CCC(CC)[C@@H](CC[NH2+][C@H](C)C1C[NH2+]C1)OC ZINC000422995561 387802866 /nfs/dbraw/zinc/80/28/66/387802866.db2.gz KJJJPETUQVBIJO-BXUZGUMPSA-N 2 0 242.407 2.025 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+][C@@H]1CCCC(F)(F)C1 ZINC000422995790 387803010 /nfs/dbraw/zinc/80/30/10/387803010.db2.gz ZEUSMBDFXHKKBQ-HBNTYKKESA-N 2 0 232.318 2.281 20 0 BEADRP [NH3+][C@H]1CCCCC[C@@H]1[NH2+]CCCc1ccccn1 ZINC000422998356 387804550 /nfs/dbraw/zinc/80/45/50/387804550.db2.gz PZQWYDAJXYISOD-GJZGRUSLSA-N 2 0 247.386 2.264 20 0 BEADRP CCC[C@H](CCO)C[NH2+][C@H]1CCCCC[C@@H]1[NH3+] ZINC000423002334 387807786 /nfs/dbraw/zinc/80/77/86/387807786.db2.gz FUZZHUVITLFZLZ-RDBSUJKOSA-N 2 0 242.407 2.035 20 0 BEADRP COc1cccc(CCC[NH2+][C@@H]2CCC[C@@H]2[NH3+])c1 ZINC000422949484 387808141 /nfs/dbraw/zinc/80/81/41/387808141.db2.gz VGFBBEZNNWKGEH-LSDHHAIUSA-N 2 0 248.370 2.097 20 0 BEADRP CC[C@@H]([NH2+]C[C@H]1CC1(C)C)[C@@H]1CCC[NH2+]1 ZINC000422954597 387808840 /nfs/dbraw/zinc/80/88/40/387808840.db2.gz JGGUCRXLEQXDSP-UTUOFQBUSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]([NH2+][C@H]1c2ccccc2C[C@H]1C)C1C[NH2+]C1 ZINC000422958052 387808904 /nfs/dbraw/zinc/80/89/04/387808904.db2.gz OHICMUZESSMQHN-UEKVPHQBSA-N 2 0 230.355 2.117 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CC1(C)C)[C@H]1CCCC[NH2+]1 ZINC000422954773 387809821 /nfs/dbraw/zinc/80/98/21/387809821.db2.gz JQHZTZLVKPOQFY-GRYCIOLGSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CCc1cccc(F)c1F ZINC000422961014 387811103 /nfs/dbraw/zinc/81/11/03/387811103.db2.gz YDRJDAAVLFPSGC-NXEZZACHSA-N 2 0 242.313 2.223 20 0 BEADRP Cc1ccc(C[C@H](C)[NH2+][C@@H](C)C2C[NH2+]C2)c(C)c1 ZINC000422886253 387759298 /nfs/dbraw/zinc/75/92/98/387759298.db2.gz INVWIWMMJBINOT-KBPBESRZSA-N 2 0 246.398 2.432 20 0 BEADRP CC[C@@H](Cc1cccs1)[NH2+]C[C@@H](C)[NH3+] ZINC000643526862 387761258 /nfs/dbraw/zinc/76/12/58/387761258.db2.gz AUTONPBYJQLUJJ-ZJUUUORDSA-N 2 0 212.362 2.006 20 0 BEADRP C[C@@H]([NH2+]C[C@H](C)[NH3+])C1CCC(F)(F)CC1 ZINC000643526945 387761514 /nfs/dbraw/zinc/76/15/14/387761514.db2.gz HUMPIUVBZZEBCB-DTWKUNHWSA-N 2 0 220.307 2.137 20 0 BEADRP FC(F)(F)CCC[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000422971944 387820572 /nfs/dbraw/zinc/82/05/72/387820572.db2.gz ZEOXYZYVAZGQLP-ULKQDVFKSA-N 2 0 236.281 2.202 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+]C/C=C/c1ccccc1 ZINC000422973230 387821135 /nfs/dbraw/zinc/82/11/35/387821135.db2.gz BLSSYDOQGOAGDL-PPYMECGQSA-N 2 0 248.370 2.043 20 0 BEADRP C[C@H]([NH2+]CCCCc1ccccc1)C1C[NH2+]C1 ZINC000643458233 387821217 /nfs/dbraw/zinc/82/12/17/387821217.db2.gz CBBFINYKQZEZDB-ZDUSSCGKSA-N 2 0 232.371 2.207 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+]C/C=C\c1ccccc1 ZINC000422973232 387821972 /nfs/dbraw/zinc/82/19/72/387821972.db2.gz BLSSYDOQGOAGDL-WUKHSURWSA-N 2 0 248.370 2.043 20 0 BEADRP CCCC(O)(CCC)C[NH2+][C@@H]1CCC[C@@H]1C[NH3+] ZINC000422974980 387823619 /nfs/dbraw/zinc/82/36/19/387823619.db2.gz FVTBDCJFIAHTPN-CHWSQXEVSA-N 2 0 242.407 2.035 20 0 BEADRP CCC(CC)(CO)C[NH2+][C@@H]1CCCCC[C@@H]1[NH3+] ZINC000423003469 387826098 /nfs/dbraw/zinc/82/60/98/387826098.db2.gz MGCOALGUNMECBC-QWHCGFSZSA-N 2 0 242.407 2.035 20 0 BEADRP C[C@H](Cc1ccc(O)cc1)[NH2+][C@H](C)[C@@H]1CCC[NH2+]1 ZINC000422976100 387826549 /nfs/dbraw/zinc/82/65/49/387826549.db2.gz UQISMFQKNZFOSB-JMSVASOKSA-N 2 0 248.370 2.053 20 0 BEADRP Cc1cc(C)c(CC[NH2+][C@@H](C)C2C[NH2+]C2)c(C)c1 ZINC000423006763 387827936 /nfs/dbraw/zinc/82/79/36/387827936.db2.gz WHKSAVAFSLFWET-AWEZNQCLSA-N 2 0 246.398 2.352 20 0 BEADRP CCCC[C@@H]([NH3+])C(=O)Nc1ccc([C@@H](C)[NH3+])cc1 ZINC000442722569 387828216 /nfs/dbraw/zinc/82/82/16/387828216.db2.gz XQEBQPKIZJUNTH-ZWNOBZJWSA-N 2 0 249.358 2.162 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]CC1(C2CC2)CCC1 ZINC000423005637 387829362 /nfs/dbraw/zinc/82/93/62/387829362.db2.gz SPAPQHPRYQMPFF-VXGBXAGGSA-N 2 0 208.349 2.036 20 0 BEADRP C[C@H]([NH2+][C@H](c1cccnc1)C1CC1)[C@H]1CC[NH2+]C1 ZINC000423009478 387833499 /nfs/dbraw/zinc/83/34/99/387833499.db2.gz CXWMAHPTRNOXPI-WHOFXGATSA-N 2 0 245.370 2.120 20 0 BEADRP CC(C)CSCCC[NH2+][C@@H](C)[C@H]1CCC[NH2+]1 ZINC000423009818 387834226 /nfs/dbraw/zinc/83/42/26/387834226.db2.gz DZQOTFQJIBAXRQ-QWHCGFSZSA-N 2 0 244.448 2.496 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]C1CCC(F)(F)CC1 ZINC000423010691 387834550 /nfs/dbraw/zinc/83/45/50/387834550.db2.gz HCUPHEQUVQTYKZ-VIFPVBQESA-N 2 0 220.307 2.281 20 0 BEADRP CC[C@H]([NH2+]CCc1ccncc1C)[C@@H]1CCC[NH2+]1 ZINC000423012010 387835919 /nfs/dbraw/zinc/83/59/19/387835919.db2.gz JYBHKOIZXOFCHL-GJZGRUSLSA-N 2 0 247.386 2.053 20 0 BEADRP Cc1ccsc1CC[NH2+][C@H](C)C[C@H](C)[NH3+] ZINC000423014952 387838152 /nfs/dbraw/zinc/83/81/52/387838152.db2.gz JPAIKTYFRSYIRM-WDEREUQCSA-N 2 0 226.389 2.314 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]C1CCC(F)(F)CC1 ZINC000423015257 387838492 /nfs/dbraw/zinc/83/84/92/387838492.db2.gz QOQQNVUDZJXWSN-DTWKUNHWSA-N 2 0 220.307 2.280 20 0 BEADRP COc1cc(F)cc(C[NH2+][C@H](C)CCC[NH3+])c1 ZINC000423015381 387839197 /nfs/dbraw/zinc/83/91/97/387839197.db2.gz KOTQFWAIJCYQOI-SNVBAGLBSA-N 2 0 240.322 2.051 20 0 BEADRP CC[C@H]([NH2+][C@@H](C)CCCC[NH3+])[C@@H]1CCCO1 ZINC000423017568 387841704 /nfs/dbraw/zinc/84/17/04/387841704.db2.gz WQWNLAIHLVEREJ-AVGNSLFASA-N 2 0 228.380 2.051 20 0 BEADRP CC[C@H]([NH2+][C@H]1CC1(C)C)[C@H]1CCCC[NH2+]1 ZINC000423027124 387844231 /nfs/dbraw/zinc/84/42/31/387844231.db2.gz OHZLVFQWMIGWAH-TUAOUCFPSA-N 2 0 210.365 2.295 20 0 BEADRP CS[C@H](C[NH2+][C@H](C)[C@@H]1CCC[NH2+]1)C(C)(C)C ZINC000423025903 387844773 /nfs/dbraw/zinc/84/47/73/387844773.db2.gz AGIKMNRPPJPYJF-GRYCIOLGSA-N 2 0 244.448 2.494 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]C[C@H]1CCCCS1 ZINC000423029075 387845267 /nfs/dbraw/zinc/84/52/67/387845267.db2.gz HPCLHZDZBVWAPZ-UPJWGTAASA-N 2 0 242.432 2.250 20 0 BEADRP COCCC(C)(C)C[NH2+][C@@H]1CC[NH2+]CC[C@H]1C ZINC000423030336 387846709 /nfs/dbraw/zinc/84/67/09/387846709.db2.gz BIDZIYZIBICQPI-CHWSQXEVSA-N 2 0 242.407 2.027 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1ccccc1 ZINC000643533691 387849217 /nfs/dbraw/zinc/84/92/17/387849217.db2.gz BTSKUESEHQJEHF-OCCSQVGLSA-N 2 0 230.355 2.479 20 0 BEADRP CC[C@@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)C(C)C ZINC000643533809 387849816 /nfs/dbraw/zinc/84/98/16/387849816.db2.gz FEOZRFAEYWSZEK-VXGBXAGGSA-N 2 0 210.365 2.153 20 0 BEADRP COCCC(C)(C)C[NH2+][C@@H]1CCCCC[C@H]1[NH3+] ZINC000423035709 387850502 /nfs/dbraw/zinc/85/05/02/387850502.db2.gz JTMZRWIJHNPWBT-CHWSQXEVSA-N 2 0 242.407 2.299 20 0 BEADRP C([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)[C@@H]1CCCCS1 ZINC000423037463 387850770 /nfs/dbraw/zinc/85/07/70/387850770.db2.gz VZNVQULMNNASET-HNGCFSAESA-N 2 0 240.416 2.145 20 0 BEADRP Cc1cnc([C@H](C)C[NH2+][C@H](C)CCC[NH3+])s1 ZINC000423037650 387850918 /nfs/dbraw/zinc/85/09/18/387850918.db2.gz NHMVUKFOJYEEPH-NXEZZACHSA-N 2 0 241.404 2.272 20 0 BEADRP Cc1cnc([C@H](C)C[NH2+][C@@H](C)CCC[NH3+])s1 ZINC000423037653 387851473 /nfs/dbraw/zinc/85/14/73/387851473.db2.gz NHMVUKFOJYEEPH-ZJUUUORDSA-N 2 0 241.404 2.272 20 0 BEADRP CC(C)OCCCC[NH2+][C@@H]1CCCCC[C@@H]1[NH3+] ZINC000423036396 387851977 /nfs/dbraw/zinc/85/19/77/387851977.db2.gz TYSYJHMCNSBAGF-UONOGXRCSA-N 2 0 242.407 2.441 20 0 BEADRP CS[C@H](C[NH2+][C@@H]1CCC[C@@H]1C[NH3+])C(C)(C)C ZINC000423038979 387852724 /nfs/dbraw/zinc/85/27/24/387852724.db2.gz ZKLSFPRWHKQNJU-IJLUTSLNSA-N 2 0 244.448 2.481 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[C@@H](C)[C@H](C)C1)C1C[NH2+]C1 ZINC000423040756 387854004 /nfs/dbraw/zinc/85/40/04/387854004.db2.gz VCBOQZMLLBIDSY-DCQANWLSSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@@H]([NH2+]CCC[C@H]1CCCCO1)[C@@H]1CCC[NH2+]1 ZINC000423041670 387854763 /nfs/dbraw/zinc/85/47/63/387854763.db2.gz XQHTYDSSVUKAPC-MCIONIFRSA-N 2 0 240.391 2.066 20 0 BEADRP CC[C@H]([NH2+]CC[C@H]1CCCCO1)[C@@H]1CCC[NH2+]1 ZINC000423043315 387854929 /nfs/dbraw/zinc/85/49/29/387854929.db2.gz OHKKOTZKFCLRHP-RDBSUJKOSA-N 2 0 240.391 2.066 20 0 BEADRP C[C@H](C[NH2+]C1CCC(C[NH3+])CC1)C(F)(F)F ZINC000423044373 387855010 /nfs/dbraw/zinc/85/50/10/387855010.db2.gz AKJWLTAMZSSIRJ-XNWIYYODSA-N 2 0 238.297 2.292 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCCCC[C@H]1[NH3+])c1ccncc1 ZINC000643460223 387874256 /nfs/dbraw/zinc/87/42/56/387874256.db2.gz CORXTPCROLADHC-BPLDGKMQSA-N 2 0 247.386 2.435 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)CCC1CC1)[C@@H]1CCC[NH2+]1 ZINC000423045730 387857784 /nfs/dbraw/zinc/85/77/84/387857784.db2.gz DIWLZQQWPBFXJY-LOWVWBTDSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@@H](CCC1CC1)[NH2+][C@@H](C)[C@@H]1CCC[NH2+]1 ZINC000423045729 387858269 /nfs/dbraw/zinc/85/82/69/387858269.db2.gz DIWLZQQWPBFXJY-GVXVVHGQSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CCCCC[C@@H]1[NH3+])C(F)(F)F ZINC000423052225 387859217 /nfs/dbraw/zinc/85/92/17/387859217.db2.gz PFUSZPBAOHIJNZ-KXUCPTDWSA-N 2 0 238.297 2.434 20 0 BEADRP CC(C)C[C@@H]1OCCC[C@H]1[NH2+][C@@H](C)CCC[NH3+] ZINC000423052535 387859630 /nfs/dbraw/zinc/85/96/30/387859630.db2.gz QDUGJFOCHJOHBI-MJBXVCDLSA-N 2 0 242.407 2.297 20 0 BEADRP C[C@H]([NH2+]Cc1ccc(C(F)F)cc1)C1C[NH2+]C1 ZINC000423052610 387859740 /nfs/dbraw/zinc/85/97/40/387859740.db2.gz QYRASFJETVWEDN-VIFPVBQESA-N 2 0 240.297 2.322 20 0 BEADRP CC(C)O[C@@H]1C[C@@H]([NH2+][C@@H](C)C[C@H](C)[NH3+])C1(C)C ZINC000423053760 387862059 /nfs/dbraw/zinc/86/20/59/387862059.db2.gz SVRFRCIVXBATDV-WUHRBBMRSA-N 2 0 242.407 2.294 20 0 BEADRP CC(C)O[C@H]1C[C@H]([NH2+][C@@H](C)C[C@H](C)[NH3+])C1(C)C ZINC000423053758 387862571 /nfs/dbraw/zinc/86/25/71/387862571.db2.gz SVRFRCIVXBATDV-CYDGBPFRSA-N 2 0 242.407 2.294 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCCC[C@@H]1C[NH3+])C(F)(F)F ZINC000423056961 387863053 /nfs/dbraw/zinc/86/30/53/387863053.db2.gz YMNWYHWVEPYEAV-BBBLOLIVSA-N 2 0 238.297 2.292 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)[C@H]1C[C@H]1C ZINC000643535360 387863194 /nfs/dbraw/zinc/86/31/94/387863194.db2.gz CGRGGSDWSCLXFU-MROQNXINSA-N 2 0 222.376 2.153 20 0 BEADRP c1cc2c(o1)CCC[C@@H]2[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000643535588 387864086 /nfs/dbraw/zinc/86/40/86/387864086.db2.gz NJEMWYNBWLKPQT-JSGCOSHPSA-N 2 0 246.354 2.389 20 0 BEADRP CC[C@H]([NH2+]CCN1CCCC1)[C@@H]1C[C@@H]1C ZINC000322062908 387874584 /nfs/dbraw/zinc/87/45/84/387874584.db2.gz RJGCVGINYCGTNZ-XQQFMLRXSA-N 2 0 210.365 2.106 20 0 BEADRP Cc1cncc([C@@H](C)[NH2+][C@H]2CC23CC[NH2+]CC3)c1 ZINC000643535841 387865369 /nfs/dbraw/zinc/86/53/69/387865369.db2.gz PJMPRACDDYCWRD-OCCSQVGLSA-N 2 0 245.370 2.183 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+][C@H]2CCCC[C@@H]2O)c2ccccc21 ZINC000423060604 387865613 /nfs/dbraw/zinc/86/56/13/387865613.db2.gz IOQNHHSXIVDSAY-BARDWOONSA-N 2 0 246.354 2.024 20 0 BEADRP CC(C)C(C)(C)C[NH2+][C@H]1CCOC[C@@H]1[C@H](C)[NH3+] ZINC000423059055 387865855 /nfs/dbraw/zinc/86/58/55/387865855.db2.gz KVPNHXQPODWRSN-XQQFMLRXSA-N 2 0 242.407 2.011 20 0 BEADRP CC(C)C(C)(C)C[NH2+][C@@H](C)C[C@@H](C)[NH3+] ZINC000423060313 387866080 /nfs/dbraw/zinc/86/60/80/387866080.db2.gz OEJPINXTEWDOLP-MNOVXSKESA-N 2 0 200.370 2.384 20 0 BEADRP C1CC12CCC([NH2+][C@H]1CC13CC[NH2+]CC3)CC2 ZINC000643536195 387867268 /nfs/dbraw/zinc/86/72/68/387867268.db2.gz NSJQHZLXGHEWJZ-ZDUSSCGKSA-N 2 0 234.387 2.441 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)C1CCCC1 ZINC000643536951 387869397 /nfs/dbraw/zinc/86/93/97/387869397.db2.gz XLZIJKNCTYMDDP-DGCLKSJQSA-N 2 0 222.376 2.297 20 0 BEADRP CC(C)C(C[NH2+][C@@H]1CCC[C@@H]1[NH3+])C(C)C ZINC000423068347 387870648 /nfs/dbraw/zinc/87/06/48/387870648.db2.gz JVCONBBQWJWBHW-QWHCGFSZSA-N 2 0 212.381 2.384 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]Cc1ccc2c(n1)CCCC2 ZINC000423072052 387871761 /nfs/dbraw/zinc/87/17/61/387871761.db2.gz GOBLCTOFBYJIAP-NEPJUHHUSA-N 2 0 247.386 2.176 20 0 BEADRP CC(C)C(C[NH2+][C@@H](C)C1C[NH2+]C1)C(C)C ZINC000423073241 387874826 /nfs/dbraw/zinc/87/48/26/387874826.db2.gz RBCWLGHPGCXTGP-NSHDSACASA-N 2 0 212.381 2.112 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H]1CCCc2occc21 ZINC000422964189 387814967 /nfs/dbraw/zinc/81/49/67/387814967.db2.gz KPKOLBBDULEISN-JBLDHEPKSA-N 2 0 222.332 2.372 20 0 BEADRP CCC(CC)[C@H](CN[C@@H](C)C[C@@H](C)[NH3+])[NH+](C)C ZINC000422965471 387816344 /nfs/dbraw/zinc/81/63/44/387816344.db2.gz OTPRGTVAFWKSEK-DYEKYZERSA-N 2 0 243.439 2.068 20 0 BEADRP CCC(CC)[C@H](CN[C@H](C)C[C@H](C)[NH3+])[NH+](C)C ZINC000422965473 387816527 /nfs/dbraw/zinc/81/65/27/387816527.db2.gz OTPRGTVAFWKSEK-SCRDCRAPSA-N 2 0 243.439 2.068 20 0 BEADRP C[C@@H](CCc1ccco1)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000422967863 387816643 /nfs/dbraw/zinc/81/66/43/387816643.db2.gz UOSKPIPMNLOPRQ-ICIURTGMSA-N 2 0 248.370 2.473 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]CCC1(F)CCC1 ZINC000423103005 387889532 /nfs/dbraw/zinc/88/95/32/387889532.db2.gz FWRRGSRNMJPVPV-NEPJUHHUSA-N 2 0 228.355 2.246 20 0 BEADRP COCC[C@@H]([NH2+][C@H](C)[C@@H]1CCC[NH2+]1)C(C)(C)C ZINC000423105909 387890828 /nfs/dbraw/zinc/89/08/28/387890828.db2.gz CRCMPFXSYHMATJ-FRRDWIJNSA-N 2 0 242.407 2.168 20 0 BEADRP C[C@@H]1C[C@@H](CC[NH2+][C@@H]2CCC[C@@H]2[NH3+])C[C@H](C)O1 ZINC000423106839 387892085 /nfs/dbraw/zinc/89/20/85/387892085.db2.gz DLVCCCPPJLKORV-ZUWCUPBKSA-N 2 0 240.391 2.050 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCC1(C)C)[C@@H]1CCCC[NH2+]1 ZINC000423109977 387892746 /nfs/dbraw/zinc/89/27/46/387892746.db2.gz OHHNMWGJKIJTPJ-WOPDTQHZSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@@H]1CCc2ccccc2OC1 ZINC000423108746 387893548 /nfs/dbraw/zinc/89/35/48/387893548.db2.gz GHBPWCQZILPWNX-GXTWGEPZSA-N 2 0 248.370 2.097 20 0 BEADRP C[C@H]1CCC[C@@H]1C[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000423109821 387893670 /nfs/dbraw/zinc/89/36/70/387893670.db2.gz VBLCZLOSMADGMP-IZXDZPFWSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CC1(C(F)(F)F)CCC1 ZINC000423111865 387896210 /nfs/dbraw/zinc/89/62/10/387896210.db2.gz RABOSKXSZDCJKM-RKDXNWHRSA-N 2 0 238.297 2.434 20 0 BEADRP COCC[C@H]([NH2+][C@@H](C)[C@H]1CC[NH2+]C1)C(C)(C)C ZINC000423116574 387897981 /nfs/dbraw/zinc/89/79/81/387897981.db2.gz QLEYDPLXJDHKNJ-AVGNSLFASA-N 2 0 242.407 2.025 20 0 BEADRP COC[C@H](CCC[NH3+])[NH2+][C@@H]1CCC12CCCC2 ZINC000423074533 387875190 /nfs/dbraw/zinc/87/51/90/387875190.db2.gz LYDNUDURPHPXOY-QWHCGFSZSA-N 2 0 240.391 2.053 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+]C1CCC2(CC2)CC1 ZINC000423077291 387876636 /nfs/dbraw/zinc/87/66/36/387876636.db2.gz SVNYPFXZCPGIIZ-CYBMUJFWSA-N 2 0 240.391 2.053 20 0 BEADRP COC1CCC(C)(C[NH2+][C@H](C)CCC[NH3+])CC1 ZINC000423082834 387879584 /nfs/dbraw/zinc/87/95/84/387879584.db2.gz DVRZQMSPOWXMGP-IYXRBSQSSA-N 2 0 242.407 2.299 20 0 BEADRP COC1CCC(C)(C[NH2+][C@H]2CCC[C@H]2[NH3+])CC1 ZINC000423086998 387880560 /nfs/dbraw/zinc/88/05/60/387880560.db2.gz ONHPWSZRAWHEQK-DKNRTOFZSA-N 2 0 240.391 2.051 20 0 BEADRP CSC1(C[NH2+][C@H]2CCCCC[C@@H]2[NH3+])CC1 ZINC000423085915 387880644 /nfs/dbraw/zinc/88/06/44/387880644.db2.gz KTDKKXNRJIVSAM-QWRGUYRKSA-N 2 0 228.405 2.132 20 0 BEADRP C[C@H]([NH2+]CCC1(C)CC1)[C@H]1CCCC[NH2+]1 ZINC000423088362 387880704 /nfs/dbraw/zinc/88/07/04/387880704.db2.gz RRWPZKRVDUDGCK-NWDGAFQWSA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+][C@@H](CC)Cc1cccs1 ZINC000643540330 387880933 /nfs/dbraw/zinc/88/09/33/387880933.db2.gz YNBYXVSRFRSLJN-MNOVXSKESA-N 2 0 226.389 2.396 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@H]1CCCC12CCOCC2 ZINC000423118018 387898515 /nfs/dbraw/zinc/89/85/15/387898515.db2.gz YHOFMQQFMPKYHH-AVGNSLFASA-N 2 0 240.391 2.051 20 0 BEADRP CSC1(C[NH2+][C@H]2CC[NH2+]CC[C@H]2C)CCC1 ZINC000423086185 387881090 /nfs/dbraw/zinc/88/10/90/387881090.db2.gz LMOKRNSDDNXTCR-NEPJUHHUSA-N 2 0 242.432 2.250 20 0 BEADRP COC1CCC(C)(C[NH2+][C@@H](C)C[C@@H](C)[NH3+])CC1 ZINC000423089852 387882932 /nfs/dbraw/zinc/88/29/32/387882932.db2.gz WDTFONJYSSFSDF-KBHBFKLGSA-N 2 0 242.407 2.297 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@H]1C1CC1)[C@H]1CCC[NH2+]C1 ZINC000423092752 387882982 /nfs/dbraw/zinc/88/29/82/387882982.db2.gz DHAXNBNCIJTJHK-DOERSZECSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC[C@@H]1C1CC1)[C@H]1CCC[NH2+]C1 ZINC000423092754 387883726 /nfs/dbraw/zinc/88/37/26/387883726.db2.gz DHAXNBNCIJTJHK-SCUASFONSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1CCC(F)(F)C1)[C@H]1CCC[NH2+]1 ZINC000423095212 387885396 /nfs/dbraw/zinc/88/53/96/387885396.db2.gz LQGHJTMTNXFDSL-GMTAPVOTSA-N 2 0 232.318 2.152 20 0 BEADRP COCC[C@H]([NH2+][C@H](C)CCC[NH3+])C(C)(C)C ZINC000423117679 387898738 /nfs/dbraw/zinc/89/87/38/387898738.db2.gz WPWYCVURVCPYEP-NEPJUHHUSA-N 2 0 230.396 2.155 20 0 BEADRP Cc1cccc(CCC[NH2+][C@H]2CCC[C@H]2C[NH3+])n1 ZINC000423100158 387886918 /nfs/dbraw/zinc/88/69/18/387886918.db2.gz GJVIGPILYRZDQH-ZFWWWQNUSA-N 2 0 247.386 2.040 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@H]1CC[C@H]1C1CC1 ZINC000423100693 387886982 /nfs/dbraw/zinc/88/69/82/387886982.db2.gz VLVSMBZODSOLRI-WXHSDQCUSA-N 2 0 210.365 2.282 20 0 BEADRP COCC[C@H]([NH2+][C@H](C)[C@H]1CC[NH2+]C1)C(C)(C)C ZINC000423116573 387898760 /nfs/dbraw/zinc/89/87/60/387898760.db2.gz QLEYDPLXJDHKNJ-AGIUHOORSA-N 2 0 242.407 2.025 20 0 BEADRP C[C@@H]1CCC[C@@H]1C[NH2+][C@@H]1CC[NH2+]CC[C@@H]1C ZINC000423098110 387888003 /nfs/dbraw/zinc/88/80/03/387888003.db2.gz KGFUOJPHXGRNSK-XJFOESAGSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CCC[C@@H](C)[C@@H]1C)C1C[NH2+]C1 ZINC000423101644 387888800 /nfs/dbraw/zinc/88/88/00/387888800.db2.gz WEFRXSNJZQOQKI-YVECIDJPSA-N 2 0 224.392 2.256 20 0 BEADRP Cc1cccnc1C(C)(C)C[NH2+][C@H](C)CCC[NH3+] ZINC000423141697 387918250 /nfs/dbraw/zinc/91/82/50/387918250.db2.gz RJNWOBXDNWOMTJ-CYBMUJFWSA-N 2 0 249.402 2.385 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CC1(C(F)(F)F)CCC1 ZINC000423115862 387899086 /nfs/dbraw/zinc/89/90/86/387899086.db2.gz YXNLEUNLBFFJHY-SECBINFHSA-N 2 0 238.297 2.436 20 0 BEADRP COCC(C)(C)CCC[NH2+][C@H]1CCC[C@H]1C[NH3+] ZINC000423121495 387900352 /nfs/dbraw/zinc/90/03/52/387900352.db2.gz INSHYGMRFVLSBC-STQMWFEESA-N 2 0 242.407 2.156 20 0 BEADRP CCOCC(C)(C)C[NH2+][C@@H]1CC[NH2+]CC[C@H]1C ZINC000423121173 387900506 /nfs/dbraw/zinc/90/05/06/387900506.db2.gz IDEHMAXNKITTJC-CHWSQXEVSA-N 2 0 242.407 2.027 20 0 BEADRP COCC(C)(C)CCC[NH2+][C@@H]1CCC[C@@H]1C[NH3+] ZINC000423121492 387901347 /nfs/dbraw/zinc/90/13/47/387901347.db2.gz INSHYGMRFVLSBC-CHWSQXEVSA-N 2 0 242.407 2.156 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]C[C@@H]1CCCSC1 ZINC000423119357 387901730 /nfs/dbraw/zinc/90/17/30/387901730.db2.gz DQTDHPXXMCUYIQ-XQQFMLRXSA-N 2 0 242.432 2.379 20 0 BEADRP C[C@@H]([NH2+]CC(C)(C)C(C)(C)C)C1C[NH2+]C1 ZINC000423126765 387904543 /nfs/dbraw/zinc/90/45/43/387904543.db2.gz IYLHNRUWXVOKLH-SNVBAGLBSA-N 2 0 212.381 2.256 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[C@H](F)C1)[C@@H]1CCCC[NH2+]1 ZINC000423129217 387906924 /nfs/dbraw/zinc/90/69/24/387906924.db2.gz QWFFHISOUWFSEM-RNJOBUHISA-N 2 0 228.355 2.387 20 0 BEADRP CC(C)(CC[NH2+][C@@H]1CCC[C@@H]1[NH3+])C1CC1 ZINC000423128768 387907328 /nfs/dbraw/zinc/90/73/28/387907328.db2.gz DLBJQNAHVLMXGN-NWDGAFQWSA-N 2 0 210.365 2.282 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H]1CCCSC1)[C@@H]1CCC[NH2+]1 ZINC000423131946 387908731 /nfs/dbraw/zinc/90/87/31/387908731.db2.gz UCNVGRSOGZHSNI-XQQFMLRXSA-N 2 0 242.432 2.250 20 0 BEADRP CC(C)[C@H]([NH2+][C@H]1CC[C@@H](C[NH3+])C1)C1CC1 ZINC000514667501 387909303 /nfs/dbraw/zinc/90/93/03/387909303.db2.gz VXRZIZQFWPYCCS-WXHSDQCUSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H]([NH2+][C@H]1CC2CCC1CC2)[C@H]1CCC[NH2+]1 ZINC000423138923 387915671 /nfs/dbraw/zinc/91/56/71/387915671.db2.gz YVEBUJKQOROWDE-DQRRXLOISA-N 2 0 222.376 2.295 20 0 BEADRP CC[C@@H]1CCC[C@@H]1C[NH2+][C@H](C)C1C[NH2+]C1 ZINC000423151854 387929255 /nfs/dbraw/zinc/92/92/55/387929255.db2.gz CZZSZLWGRCNWHX-IJLUTSLNSA-N 2 0 210.365 2.010 20 0 BEADRP Cc1cccnc1CC[NH2+][C@@H]1CCCCC[C@@H]1[NH3+] ZINC000423151966 387930656 /nfs/dbraw/zinc/93/06/56/387930656.db2.gz LAJIHAIZTSXXRZ-DZGCQCFKSA-N 2 0 247.386 2.182 20 0 BEADRP Cc1cccnc1CCC[NH2+][C@@H]1CCC[C@@H]1C[NH3+] ZINC000423155545 387934423 /nfs/dbraw/zinc/93/44/23/387934423.db2.gz QQWMARWJKGRSLO-UKRRQHHQSA-N 2 0 247.386 2.040 20 0 BEADRP Cc1cccnc1C(C)(C)C[NH2+]C1CC[NH2+]CC1 ZINC000423143563 387920895 /nfs/dbraw/zinc/92/08/95/387920895.db2.gz XHWRJYYBTPRIJE-UHFFFAOYSA-N 2 0 247.386 2.009 20 0 BEADRP CC(F)(F)CC[NH2+][C@@H]1CCCCC[C@H]1[NH3+] ZINC000423142943 387921098 /nfs/dbraw/zinc/92/10/98/387921098.db2.gz BVSJGFSMWRUCRX-NXEZZACHSA-N 2 0 220.307 2.281 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]C[C@@H]1CCCC1(F)F ZINC000423146641 387921711 /nfs/dbraw/zinc/92/17/11/387921711.db2.gz BAGKFZYVMDYAIM-AEJSXWLSSA-N 2 0 220.307 2.137 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]CCC(C)(F)F ZINC000423145039 387923247 /nfs/dbraw/zinc/92/32/47/387923247.db2.gz ITUGVDSJMWHURG-NXEZZACHSA-N 2 0 220.307 2.009 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CC(C)(C)c1ccccn1 ZINC000423145014 387923476 /nfs/dbraw/zinc/92/34/76/387923476.db2.gz IPTYPCJJFVEWAG-GFCCVEGCSA-N 2 0 235.375 2.076 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CCOC2CCCC2)CC[N@@H+]1C ZINC000156146970 387925906 /nfs/dbraw/zinc/92/59/06/387925906.db2.gz RUICNPXDCJYEDF-QWHCGFSZSA-N 2 0 240.391 2.018 20 0 BEADRP CC(C)O[C@H]1C[C@@H]([NH2+][C@@H]2CCCC[C@H]2C[NH3+])C1 ZINC000423170242 387954293 /nfs/dbraw/zinc/95/42/93/387954293.db2.gz XODAPFOZHRVMIF-IGQOVBAYSA-N 2 0 240.391 2.050 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[C@H]1C1CC1)C1C[NH2+]C1 ZINC000423168706 387954652 /nfs/dbraw/zinc/95/46/52/387954652.db2.gz HYRVUPQRWCCGIA-JKOKRWQUSA-N 2 0 222.376 2.010 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+]CCC1CC(F)(F)C1 ZINC000423169157 387954898 /nfs/dbraw/zinc/95/48/98/387954898.db2.gz VOKSMTRCNBCBTC-JQWIXIFHSA-N 2 0 246.345 2.400 20 0 BEADRP CC[C@]1(C(C)C)C[C@H]1[NH2+][C@H](C)C1C[NH2+]C1 ZINC000423169466 387955226 /nfs/dbraw/zinc/95/52/26/387955226.db2.gz VXEJGOWTWGCOCB-RAIGVLPGSA-N 2 0 210.365 2.009 20 0 BEADRP C[N@@H+]1CCC[C@@H](C[NH2+]CC2CCCCC2)C1 ZINC000044535277 387938554 /nfs/dbraw/zinc/93/85/54/387938554.db2.gz SGEVKUMOJBZSJO-AWEZNQCLSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1C[C@H]1C1CC1)[C@H]1CCCC[NH2+]1 ZINC000423170272 387956147 /nfs/dbraw/zinc/95/61/47/387956147.db2.gz XQYZSSYQQLKKCP-DOERSZECSA-N 2 0 222.376 2.153 20 0 BEADRP CC[C@]1(C(C)C)C[C@@H]1[NH2+][C@@H](CCC[NH3+])COC ZINC000423160956 387940776 /nfs/dbraw/zinc/94/07/76/387940776.db2.gz IDGNBQGQQRNLST-MELADBBJSA-N 2 0 242.407 2.155 20 0 BEADRP CCn1cc([C@H](C)[NH2+][C@@H](C)CCCC[NH3+])cn1 ZINC000423162502 387942953 /nfs/dbraw/zinc/94/29/53/387942953.db2.gz PPMHODCNCUAHNF-RYUDHWBXSA-N 2 0 238.379 2.071 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H]2CCCC[C@@H]2C[NH3+])nc1 ZINC000423162662 387943205 /nfs/dbraw/zinc/94/32/05/387943205.db2.gz LLBNHWNAADXRAW-UKRRQHHQSA-N 2 0 247.386 2.040 20 0 BEADRP CCC1([NH2+][C@@H](C)c2ccc(C[NH3+])nc2C)CC1 ZINC000423163983 387944835 /nfs/dbraw/zinc/94/48/35/387944835.db2.gz WIOSOXVAQQAHAJ-NSHDSACASA-N 2 0 233.359 2.442 20 0 BEADRP Cc1ccc(CC[NH2+]C2CCC(C[NH3+])CC2)nc1 ZINC000423164438 387947818 /nfs/dbraw/zinc/94/78/18/387947818.db2.gz OQKNQWXUQGULCR-UHFFFAOYSA-N 2 0 247.386 2.040 20 0 BEADRP CCC[C@@H]([NH2+][C@H](C)C1C[NH2+]C1)C(C)(C)C ZINC000423164627 387948283 /nfs/dbraw/zinc/94/82/83/387948283.db2.gz XGUKXFFGNJBZKZ-ZYHUDNBSSA-N 2 0 212.381 2.399 20 0 BEADRP CC[C@@H]1OCC[C@H]1[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000423166483 387949716 /nfs/dbraw/zinc/94/97/16/387949716.db2.gz CSVKKRJCNDOKLI-YJNKXOJESA-N 2 0 246.354 2.288 20 0 BEADRP CO[C@H]1c2ccccc2C[C@H]1[NH2+][C@@H](C)C[C@H](C)[NH3+] ZINC000423171891 387959139 /nfs/dbraw/zinc/95/91/39/387959139.db2.gz QLCKASQGBRMOCL-AZHAFVHUSA-N 2 0 248.370 2.014 20 0 BEADRP C[C@@H]([NH2+]C1(C2CCC2)CCC1)[C@H]1CCC[NH2+]1 ZINC000423172669 387959915 /nfs/dbraw/zinc/95/99/15/387959915.db2.gz UPZLVGGQCCFCFS-DGCLKSJQSA-N 2 0 222.376 2.439 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]1[NH2+][C@@H]1C[C@H]1c1ccccc1F ZINC000423171533 387960279 /nfs/dbraw/zinc/96/02/79/387960279.db2.gz OVLASXNPMJYUQO-DOERSZECSA-N 2 0 234.318 2.151 20 0 BEADRP CSC[C@@H]1CCC[N@@H+]1CC[C@H]1CCC[NH+]1C ZINC000245574844 387961130 /nfs/dbraw/zinc/96/11/30/387961130.db2.gz ARGGKVNYOWZTOQ-OLZOCXBDSA-N 2 0 242.432 2.298 20 0 BEADRP C[C@H](Cc1ccoc1)[NH2+]CC1([NH3+])CCCCC1 ZINC000423175064 387961287 /nfs/dbraw/zinc/96/12/87/387961287.db2.gz CSWKIJRZLPUNON-GFCCVEGCSA-N 2 0 236.359 2.462 20 0 BEADRP CC[C@@H](C)C[N@H+](C)CC[C@H]1CCC[NH+]1C ZINC000245589792 387963697 /nfs/dbraw/zinc/96/36/97/387963697.db2.gz FYJRRRQXCOKMFO-CHWSQXEVSA-N 2 0 212.381 2.449 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+]CCC[NH3+])[C@H](C)C2 ZINC000423179941 387966722 /nfs/dbraw/zinc/96/67/22/387966722.db2.gz DOUCHXGZAQTHSF-BXUZGUMPSA-N 2 0 218.344 2.167 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1C[C@H]1c1ccco1 ZINC000423185529 387969450 /nfs/dbraw/zinc/96/94/50/387969450.db2.gz NWHYQZPCQCSSIM-QNWHQSFQSA-N 2 0 234.343 2.243 20 0 BEADRP C[C@@H]1C[C@H](C[NH2+][C@@H]2CCCCC[C@@H]2[NH3+])[C@@H](C)O1 ZINC000423183597 387969740 /nfs/dbraw/zinc/96/97/40/387969740.db2.gz MSDBSSKNCFJJES-XGFWRYKXSA-N 2 0 240.391 2.050 20 0 BEADRP [NH3+]CCC[NH2+][C@H]1CC[C@H](c2ccccc2)C1 ZINC000423193914 387980624 /nfs/dbraw/zinc/98/06/24/387980624.db2.gz QZVOJWFFACVTDQ-KBPBESRZSA-N 2 0 218.344 2.261 20 0 BEADRP C[C@@H]([NH2+]CCC[NH3+])C1CCC(F)(F)CC1 ZINC000423196771 387981199 /nfs/dbraw/zinc/98/11/99/387981199.db2.gz WELYDCBNAAKOCY-SECBINFHSA-N 2 0 220.307 2.139 20 0 BEADRP CC(C)(C[NH2+][C@H]1CCC[C@@H]1C[NH3+])c1cccnc1 ZINC000423196499 387981262 /nfs/dbraw/zinc/98/12/62/387981262.db2.gz ZVVPLCTWUUERAA-OCCSQVGLSA-N 2 0 247.386 2.076 20 0 BEADRP C[C@@H](CCCc1cccnc1)[NH2+]CCC[NH+](C)C ZINC000453054722 387973888 /nfs/dbraw/zinc/97/38/88/387973888.db2.gz HZSGSOVZPMRHHW-AWEZNQCLSA-N 2 0 249.402 2.334 20 0 BEADRP C[NH2+]CCC[NH2+][C@H](C)c1ccc(F)cc1 ZINC000423191599 387975853 /nfs/dbraw/zinc/97/58/53/387975853.db2.gz SZBCXJVCTCJUKZ-SNVBAGLBSA-N 2 0 210.296 2.086 20 0 BEADRP CC(C)C[C@H]([NH2+]CCC[NH3+])c1ccccn1 ZINC000423191749 387976720 /nfs/dbraw/zinc/97/67/20/387976720.db2.gz PEABHVQRMFTKMI-ZDUSSCGKSA-N 2 0 221.348 2.107 20 0 BEADRP c1coc([C@@H]2C[C@H]2[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)c1 ZINC000423192816 387977938 /nfs/dbraw/zinc/97/79/38/387977938.db2.gz UXVATNSDWZHXRU-NRUFJFEESA-N 2 0 232.327 2.008 20 0 BEADRP CC[C@@H]([NH2+]CCC[NH2+]C)c1cccc(OC)c1 ZINC000423201647 387987570 /nfs/dbraw/zinc/98/75/70/387987570.db2.gz PIRILPDKAQBBFL-CQSZACIVSA-N 2 0 236.359 2.345 20 0 BEADRP C[C@@H]([NH2+]CC1([NH3+])CCCCCC1)[C@@H]1CCOC1 ZINC000423201433 387987934 /nfs/dbraw/zinc/98/79/34/387987934.db2.gz ORFQPDLOSHWBOY-CHWSQXEVSA-N 2 0 240.391 2.053 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1CCCc2cc(F)ccc21 ZINC000423203282 387988985 /nfs/dbraw/zinc/98/89/85/387988985.db2.gz SGZSZCBOFDZWLT-CQSZACIVSA-N 2 0 236.334 2.402 20 0 BEADRP C[NH2+]CCC[NH2+][C@H]1CCCc2nc(C)sc21 ZINC000423204514 387989007 /nfs/dbraw/zinc/98/90/07/387989007.db2.gz UNHPLPZDKJHEAG-JTQLQIEISA-N 2 0 239.388 2.028 20 0 BEADRP COCCC[C@H](C)[NH2+]CC1([NH3+])CCCCCC1 ZINC000423203211 387989026 /nfs/dbraw/zinc/98/90/26/387989026.db2.gz RXYYGXXUGQYIRF-ZDUSSCGKSA-N 2 0 242.407 2.443 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CC2([NH3+])CCCCCC2)[C@@H](C)O1 ZINC000423204552 387989066 /nfs/dbraw/zinc/98/90/66/387989066.db2.gz URJYHAJBJJWZTG-JHJVBQTASA-N 2 0 240.391 2.194 20 0 BEADRP CC(C)[C@H]1C[C@@H]([NH2+][C@@H]2CCCC[C@H]2[NH3+])CCO1 ZINC000424364956 387989905 /nfs/dbraw/zinc/98/99/05/387989905.db2.gz FOZANZCAIQVMRL-REWJHTLYSA-N 2 0 240.391 2.050 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)c1cccc(O)c1)[C@H]1CCC[NH2+]C1 ZINC000423205776 387991287 /nfs/dbraw/zinc/99/12/87/387991287.db2.gz BKPODQGDTSTVAM-SCRDCRAPSA-N 2 0 248.370 2.431 20 0 BEADRP FCCC[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000423204734 387991296 /nfs/dbraw/zinc/99/12/96/387991296.db2.gz DQAUTQNQFMKAAC-HZSPNIEDSA-N 2 0 242.382 2.494 20 0 BEADRP CO[C@H](C)[C@H](C)[NH2+]CC1([NH3+])CCCCCC1 ZINC000423207687 387992825 /nfs/dbraw/zinc/99/28/25/387992825.db2.gz YEFLYOSHUCXCGT-NWDGAFQWSA-N 2 0 228.380 2.051 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@H]1C1CCC1)[C@@H]1CCCC[NH2+]1 ZINC000424370549 387994593 /nfs/dbraw/zinc/99/45/93/387994593.db2.gz DQDGGZGNTHVTNS-DOERSZECSA-N 2 0 222.376 2.295 20 0 BEADRP CCC(CC)C[N@@H+]1CCC[C@H]([C@H](C)[NH3+])C1 ZINC000250785081 135058771 /nfs/dbraw/zinc/05/87/71/135058771.db2.gz VUYFQPMJLFLXLU-AAEUAGOBSA-N 2 0 212.381 2.482 20 0 BEADRP C[C@H]([NH2+]CCC[NH3+])[C@@H]1C[C@H]1c1ccccc1 ZINC000423196237 387982297 /nfs/dbraw/zinc/98/22/97/387982297.db2.gz UXTKUBYUAFPHCU-UBHSHLNASA-N 2 0 218.344 2.117 20 0 BEADRP CC1(C)Cc2occc2[C@@H]([NH2+]CCC[NH3+])C1 ZINC000423197151 387982657 /nfs/dbraw/zinc/98/26/57/387982657.db2.gz YDCSWAMXSRHNTB-NSHDSACASA-N 2 0 222.332 2.232 20 0 BEADRP C[NH2+]CCC[NH2+][C@H]1c2ccccc2C[C@H]1C ZINC000423198248 387983203 /nfs/dbraw/zinc/98/32/03/387983203.db2.gz DVKKJDWKGULPSU-BXUZGUMPSA-N 2 0 218.344 2.119 20 0 BEADRP CCc1nc2c(s1)[C@@H]([NH2+]CCC[NH3+])CCC2 ZINC000423197468 387983503 /nfs/dbraw/zinc/98/35/03/387983503.db2.gz ZNSPXAWGYDDLGD-VIFPVBQESA-N 2 0 239.388 2.021 20 0 BEADRP C[NH2+]CCC[NH2+][C@H]1c2cc(F)ccc2C[C@H]1C ZINC000423198044 387983679 /nfs/dbraw/zinc/98/36/79/387983679.db2.gz CQCSXBIAIGQWPX-QMTHXVAHSA-N 2 0 236.334 2.258 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H](C)c1ccccc1N(C)C ZINC000423197849 387983725 /nfs/dbraw/zinc/98/37/25/387983725.db2.gz BMEBRSDCTWSWGI-LBPRGKRZSA-N 2 0 235.375 2.013 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1CCSc2ccccc21 ZINC000423198286 387983918 /nfs/dbraw/zinc/98/39/18/387983918.db2.gz FAPMXNPWXPJPSM-GFCCVEGCSA-N 2 0 236.384 2.423 20 0 BEADRP C[C@@H]([NH2+]CC1([NH3+])CCCCCC1)[C@@H]1CCCO1 ZINC000423198819 387983957 /nfs/dbraw/zinc/98/39/57/387983957.db2.gz ICHQBGINITYKHA-OLZOCXBDSA-N 2 0 240.391 2.195 20 0 BEADRP C[NH2+]CCC[NH2+][C@H]1C[C@H](OCC(C)C)C1(C)C ZINC000423198065 387984173 /nfs/dbraw/zinc/98/41/73/387984173.db2.gz CUIFOYQCGAXFIM-STQMWFEESA-N 2 0 242.407 2.025 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[NH2+]C1)C1CCSCC1 ZINC000423210083 387995682 /nfs/dbraw/zinc/99/56/82/387995682.db2.gz JPJSTADEPCQPIE-NWDGAFQWSA-N 2 0 242.432 2.107 20 0 BEADRP C[NH2+]CCC[NH2+][C@@H]1C[C@H](C)c2ccccc21 ZINC000423198923 387985177 /nfs/dbraw/zinc/98/51/77/387985177.db2.gz IRGFUFCSSOKADX-SMDDNHRTSA-N 2 0 218.344 2.434 20 0 BEADRP C[NH2+]CCC[NH2+]C1CCc2ccccc2CC1 ZINC000423199142 387985355 /nfs/dbraw/zinc/98/53/55/387985355.db2.gz JFNVBXZWYIXKIO-UHFFFAOYSA-N 2 0 232.371 2.133 20 0 BEADRP C[NH2+]CCC[NH2+][C@H]1C[C@@H](C)c2ccccc21 ZINC000423198922 387985425 /nfs/dbraw/zinc/98/54/25/387985425.db2.gz IRGFUFCSSOKADX-RISCZKNCSA-N 2 0 218.344 2.434 20 0 BEADRP CCCCO[C@H]1C[C@@H]([NH2+]CCC[NH2+]C)C1(C)C ZINC000423200344 387986285 /nfs/dbraw/zinc/98/62/85/387986285.db2.gz LXVJLUUHBZJCRI-OLZOCXBDSA-N 2 0 242.407 2.169 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+][C@H](C)[C@H]1CCC[NH2+]C1 ZINC000423214313 387997407 /nfs/dbraw/zinc/99/74/07/387997407.db2.gz LDNGBPZCILXVKQ-RDBSUJKOSA-N 2 0 247.386 2.429 20 0 BEADRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+]C[C@@H]1C[C@H]1C1CCC1 ZINC000424372768 387997846 /nfs/dbraw/zinc/99/78/46/387997846.db2.gz HLBQDHXIWJQNFE-MXAVVETBSA-N 2 0 236.403 2.400 20 0 BEADRP C1[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)[C@@H]1C1CCC1 ZINC000424373905 387998945 /nfs/dbraw/zinc/99/89/45/387998945.db2.gz KEIKBFGTMZUJMR-PJIALRRASA-N 2 0 220.360 2.048 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCCC[C@H]1[NH3+])[C@@H]1C[C@@H]1C ZINC000424376168 387999148 /nfs/dbraw/zinc/99/91/48/387999148.db2.gz OUBLBIYOYPPHSS-CKIKVBCHSA-N 2 0 210.365 2.281 20 0 BEADRP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)C1(C)CC1 ZINC000423216753 387999225 /nfs/dbraw/zinc/99/92/25/387999225.db2.gz QSWMLVAIXOTDBV-YIBTVLSRSA-N 2 0 208.349 2.048 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1 ZINC000423216866 387999439 /nfs/dbraw/zinc/99/94/39/387999439.db2.gz PFUIWXFGHZXKSF-LOWDOPEQSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCCC[C@H]1[NH3+])[C@@H]1C[C@H]1C ZINC000424376172 387999625 /nfs/dbraw/zinc/99/96/25/387999625.db2.gz OUBLBIYOYPPHSS-NJMOYASZSA-N 2 0 210.365 2.281 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+][C@@H]1C[C@H]2C[C@H]2C1 ZINC000424386027 388001471 /nfs/dbraw/zinc/00/14/71/388001471.db2.gz XCNTZLGNXRLXNJ-MLGHIDQZSA-N 2 0 208.349 2.035 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H](c1cccnc1)C1CCC1 ZINC000423222767 388003637 /nfs/dbraw/zinc/00/36/37/388003637.db2.gz CMDYSHYOCTTXBN-SMDDNHRTSA-N 2 0 233.359 2.250 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H](C1CC1)C1CCCC1 ZINC000423222610 388004643 /nfs/dbraw/zinc/00/46/43/388004643.db2.gz BWBHQLGZYHKXKX-GXFFZTMASA-N 2 0 210.365 2.282 20 0 BEADRP COc1ccc2c(c1)[C@H]([NH2+]CC[C@H](C)[NH3+])CC2 ZINC000423224582 388006247 /nfs/dbraw/zinc/00/62/47/388006247.db2.gz CMUGYABGEVLKHR-IINYFYTJSA-N 2 0 234.343 2.009 20 0 BEADRP CCCCO[C@@H]1C[C@@H]([NH2+]CC[C@H](C)[NH3+])C1(C)C ZINC000423225233 388007363 /nfs/dbraw/zinc/00/73/63/388007363.db2.gz LURWZBYMPMUOIV-YNEHKIRRSA-N 2 0 242.407 2.297 20 0 BEADRP COc1ccc([C@H](C)[NH2+]CC[C@H](C)[NH3+])cc1F ZINC000423226269 388010090 /nfs/dbraw/zinc/01/00/90/388010090.db2.gz QCAJBCWBMNEAPH-UWVGGRQHSA-N 2 0 240.322 2.222 20 0 BEADRP [NH3+][C@@H]1CCCC[C@H]1[NH2+][C@@H]1CC[C@H]1C1CCC1 ZINC000424372245 387996506 /nfs/dbraw/zinc/99/65/06/387996506.db2.gz HQVYXYPUTFJWRS-REWJHTLYSA-N 2 0 222.376 2.425 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]C2CC(C)(F)C2)[C@@H]2CCC[C@H]21 ZINC000453244814 388023691 /nfs/dbraw/zinc/02/36/91/388023691.db2.gz ZFZJWGIQBMLSQY-VWGAPNJBSA-N 2 0 240.366 2.339 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@H]1c2cc(F)ccc2C[C@@H]1C ZINC000423227039 388011817 /nfs/dbraw/zinc/01/18/17/388011817.db2.gz UAPHKEQGWBLEJT-PKFCDNJMSA-N 2 0 236.334 2.386 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H]1CCC[C@@H]1CCCF ZINC000423227598 388012127 /nfs/dbraw/zinc/01/21/27/388012127.db2.gz WIEGCMDNNHYPJE-QJPTWQEYSA-N 2 0 216.344 2.232 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H]1c2cc(F)ccc2C[C@@H]1C ZINC000423227037 388012149 /nfs/dbraw/zinc/01/21/49/388012149.db2.gz UAPHKEQGWBLEJT-BHDSKKPTSA-N 2 0 236.334 2.386 20 0 BEADRP CCC[N@H+](C)C[C@H]1CC[NH+](CC2CC2)C1 ZINC000156630543 388013025 /nfs/dbraw/zinc/01/30/25/388013025.db2.gz WDLWPLOVQWTOFC-CYBMUJFWSA-N 2 0 210.365 2.060 20 0 BEADRP C[C@H](CCCc1cccnc1)[NH2+]CC[C@H](C)[NH3+] ZINC000423228336 388013636 /nfs/dbraw/zinc/01/36/36/388013636.db2.gz ZEQNLSKULSSMPR-QWHCGFSZSA-N 2 0 235.375 2.120 20 0 BEADRP C[C@@H]([NH2+]CC[C@H](C)[NH3+])c1ccccc1F ZINC000423229501 388015869 /nfs/dbraw/zinc/01/58/69/388015869.db2.gz HGYJAKNAQBPEKU-VHSXEESVSA-N 2 0 210.296 2.214 20 0 BEADRP COc1cccc2c1CC[C@@H]2[NH2+]CC[C@H](C)[NH3+] ZINC000423229648 388015923 /nfs/dbraw/zinc/01/59/23/388015923.db2.gz HMIJQRIAPMJNKP-GWCFXTLKSA-N 2 0 234.343 2.009 20 0 BEADRP C[C@H]([NH3+])CC[NH2+][C@@H](C)c1cccc(F)c1 ZINC000423232508 388017545 /nfs/dbraw/zinc/01/75/45/388017545.db2.gz MWSLFINCCHDPJV-UWVGGRQHSA-N 2 0 210.296 2.214 20 0 BEADRP COCC[C@@H]1CCC[C@@H]1[NH2+]C1CCC([NH3+])CC1 ZINC000423233789 388018849 /nfs/dbraw/zinc/01/88/49/388018849.db2.gz OTZJWHLFTAECHE-ABXWRUBCSA-N 2 0 240.391 2.051 20 0 BEADRP CNCC[NH2+][C@@H]1CC[C@@H](c2ccccc2)C1 ZINC000423235445 388019544 /nfs/dbraw/zinc/01/95/44/388019544.db2.gz AZHRNDYUHOCEAL-ZIAGYGMSSA-N 2 0 218.344 2.132 20 0 BEADRP CC(C)[C@@](C)(C[NH3+])[NH2+]Cc1ccccc1 ZINC000082390063 388033273 /nfs/dbraw/zinc/03/32/73/388033273.db2.gz HBKGSSLRBQURFL-CYBMUJFWSA-N 2 0 206.333 2.150 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CCCc2ccc(O)cc21 ZINC000423255507 388036968 /nfs/dbraw/zinc/03/69/68/388036968.db2.gz AGODOKZPSFVGLI-XHDPSFHLSA-N 2 0 248.370 2.215 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC[N@H+](C)[C@H]2CCC[C@H]21)C1CC1 ZINC000453292788 388037123 /nfs/dbraw/zinc/03/71/23/388037123.db2.gz PEBXKBQERWLNBE-CABNGKKXSA-N 2 0 222.376 2.247 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC[N@H+](C)[C@@H]2CCC[C@@H]21)C1CC1 ZINC000453292789 388037525 /nfs/dbraw/zinc/03/75/25/388037525.db2.gz PEBXKBQERWLNBE-FMKGYKFTSA-N 2 0 222.376 2.247 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H](CN)C1CCCCC1 ZINC000423262187 388039976 /nfs/dbraw/zinc/03/99/76/388039976.db2.gz LYEAELALORBXBM-OCCSQVGLSA-N 2 0 241.423 2.001 20 0 BEADRP Cc1ccncc1[C@@H](C)[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000423264423 388041321 /nfs/dbraw/zinc/04/13/21/388041321.db2.gz YSVDLPZCFPZMPJ-ZIAGYGMSSA-N 2 0 247.386 2.430 20 0 BEADRP CC(C)C[C@H](C[NH3+])N[C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000423264668 388042283 /nfs/dbraw/zinc/04/22/83/388042283.db2.gz QAJGXMMLCKGGRJ-BYCMXARLSA-N 2 0 247.386 2.094 20 0 BEADRP CC(C)O[C@@H]1C[C@@H]([NH2+]C[C@H]([NH3+])C(C)C)C1(C)C ZINC000423263345 388042626 /nfs/dbraw/zinc/04/26/26/388042626.db2.gz AZMOFQPZXHWVTA-YNEHKIRRSA-N 2 0 242.407 2.151 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1ccsc1 ZINC000423243110 388027086 /nfs/dbraw/zinc/02/70/86/388027086.db2.gz GFYUPFUGZDHEPI-MNOVXSKESA-N 2 0 224.373 2.398 20 0 BEADRP C[C@H]([NH2+]CC[C@@H]1CC[NH2+]C1)C1CCSCC1 ZINC000423245473 388028185 /nfs/dbraw/zinc/02/81/85/388028185.db2.gz IZYUDMRPJLMEBA-RYUDHWBXSA-N 2 0 242.432 2.107 20 0 BEADRP C[C@@H]1CCC[C@H](C)[C@H]1[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000423244575 388028289 /nfs/dbraw/zinc/02/82/89/388028289.db2.gz HSZZMKPQCRKERY-RQJABVFESA-N 2 0 224.392 2.400 20 0 BEADRP C(C[C@@H]1CC[NH2+]C1)[NH2+]C1C2CC3CC(C2)CC1C3 ZINC000423246422 388030533 /nfs/dbraw/zinc/03/05/33/388030533.db2.gz JZKQAQLZOVKWKD-MGWQBKBZSA-N 2 0 248.414 2.400 20 0 BEADRP CC(C)[C@@H]([NH3+])C[NH2+][C@H]1C[C@H](C)CC[C@@H]1C ZINC000423276324 388057033 /nfs/dbraw/zinc/05/70/33/388057033.db2.gz OINRAWBGDKLEMJ-VOAKCMCISA-N 2 0 212.381 2.384 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CCC12CCC2 ZINC000423275934 388057191 /nfs/dbraw/zinc/05/71/91/388057191.db2.gz MJFSUVQLOXKFAH-RWMBFGLXSA-N 2 0 222.376 2.426 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+]C1CCc2ccccc2CC1 ZINC000423277286 388057718 /nfs/dbraw/zinc/05/77/18/388057718.db2.gz PQCVPESGSMROGA-CYBMUJFWSA-N 2 0 246.398 2.379 20 0 BEADRP CCC1(CC)[C@H]([NH2+]C[C@H]([NH3+])C(C)C)C[C@H]1OC ZINC000423277652 388057893 /nfs/dbraw/zinc/05/78/93/388057893.db2.gz PPUPOWQEZQOPNN-YNEHKIRRSA-N 2 0 242.407 2.153 20 0 BEADRP CSCC1CCC([NH2+]C[C@@H]([NH3+])C(C)C)CC1 ZINC000423278266 388059946 /nfs/dbraw/zinc/05/99/46/388059946.db2.gz QLVTYRNNYJLUPZ-WXRRBKDZSA-N 2 0 244.448 2.481 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CCCC(C)(C)C1 ZINC000423280280 388062213 /nfs/dbraw/zinc/06/22/13/388062213.db2.gz UISHVJHHUHJQTF-NWDGAFQWSA-N 2 0 212.381 2.400 20 0 BEADRP CCC[C@@H]([NH2+]C[C@H](C)C[NH2+]C)C1CCC1 ZINC000423280638 388062772 /nfs/dbraw/zinc/06/27/72/388062772.db2.gz VAPKRCHQNGAOLU-DGCLKSJQSA-N 2 0 212.381 2.400 20 0 BEADRP COc1ccc2c(c1)CCC[C@@H]2[NH2+]CC(C)(C)[NH3+] ZINC000423281783 388064029 /nfs/dbraw/zinc/06/40/29/388064029.db2.gz BQXRVEQFXBVBHS-AWEZNQCLSA-N 2 0 248.370 2.400 20 0 BEADRP CCOC[C@@H]1CCC[C@@H]1[NH2+]CC([NH3+])(CC)CC ZINC000423283876 388067234 /nfs/dbraw/zinc/06/72/34/388067234.db2.gz FSSSKUXRIHJAOT-STQMWFEESA-N 2 0 242.407 2.299 20 0 BEADRP CC[C@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)[C@H]1C[C@H]1C ZINC000423284338 388067276 /nfs/dbraw/zinc/06/72/76/388067276.db2.gz YDGAFRZSNCBTJU-RFGFWPKPSA-N 2 0 224.392 2.400 20 0 BEADRP C(C[C@H]1CCC[NH2+]C1)[NH2+][C@@H]1CCC12CCC2 ZINC000423285068 388068451 /nfs/dbraw/zinc/06/84/51/388068451.db2.gz ZGDLNYKPMUHUCZ-CHWSQXEVSA-N 2 0 222.376 2.298 20 0 BEADRP CC[C@@H](F)C[NH+]1CCC(C[NH+](C)C)CC1 ZINC000440700898 388071846 /nfs/dbraw/zinc/07/18/46/388071846.db2.gz ZLOISITULIOSHG-GFCCVEGCSA-N 2 0 216.344 2.008 20 0 BEADRP CC(C)[C@H](C)[NH2+]CCCC[N@H+](C)C1CC1 ZINC000453398180 388072467 /nfs/dbraw/zinc/07/24/67/388072467.db2.gz KHXIKXVRSQEMIZ-LBPRGKRZSA-N 2 0 212.381 2.495 20 0 BEADRP CC(C)([NH3+])C[NH2+][C@H]1CCC[C@H](c2cccnc2)C1 ZINC000423287674 388072870 /nfs/dbraw/zinc/07/28/70/388072870.db2.gz NVAAYUCKNMYPAY-JSGCOSHPSA-N 2 0 247.386 2.435 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)NCC[NH2+]C1CCCCCC1 ZINC000423288242 388072905 /nfs/dbraw/zinc/07/29/05/388072905.db2.gz RECDVMNVEGUKLU-STQMWFEESA-N 2 0 241.423 2.014 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)NCC[NH2+]C1CCCCCC1 ZINC000423288239 388072924 /nfs/dbraw/zinc/07/29/24/388072924.db2.gz RECDVMNVEGUKLU-CHWSQXEVSA-N 2 0 241.423 2.014 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])NCC[NH2+]C1CCCCCC1 ZINC000423288241 388073644 /nfs/dbraw/zinc/07/36/44/388073644.db2.gz RECDVMNVEGUKLU-QWHCGFSZSA-N 2 0 241.423 2.014 20 0 BEADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@H]2C[C@@H](C)O[C@H]2C)cc1 ZINC000423289894 388074369 /nfs/dbraw/zinc/07/43/69/388074369.db2.gz BXUABONHVNKOKS-FJJYHAOUSA-N 2 0 248.370 2.362 20 0 BEADRP Cc1cccc(C[NH2+][C@@H]2CCC[C@H]2C[NH3+])c1 ZINC000084218111 388074736 /nfs/dbraw/zinc/07/47/36/388074736.db2.gz AVZBYRCZTWTJEO-UONOGXRCSA-N 2 0 218.344 2.212 20 0 BEADRP CC(C)CO[C@H]1C[C@@H]([NH2+]CC(C)(C)[NH3+])C1(C)C ZINC000423290369 388075029 /nfs/dbraw/zinc/07/50/29/388075029.db2.gz ZVPBVTYNUZSPEP-NEPJUHHUSA-N 2 0 242.407 2.153 20 0 BEADRP C[N@H+](CCCC[NH2+]C1CCCC1)C1CC1 ZINC000453406412 388075249 /nfs/dbraw/zinc/07/52/49/388075249.db2.gz CVUUYXFHSCJTMG-UHFFFAOYSA-N 2 0 210.365 2.393 20 0 BEADRP CCOc1ccccc1[C@@H](C)[NH2+]C[C@@H](C)C[NH3+] ZINC000423294054 388076405 /nfs/dbraw/zinc/07/64/05/388076405.db2.gz BCAFETOABXVAMG-NWDGAFQWSA-N 2 0 236.359 2.331 20 0 BEADRP C[C@@H]([NH2+]C[C@@H](C)C[NH3+])c1cc2c(s1)CCC2 ZINC000423294813 388077428 /nfs/dbraw/zinc/07/74/28/388077428.db2.gz CUFCCGPWYUAFDK-VHSXEESVSA-N 2 0 238.400 2.482 20 0 BEADRP Cc1ccc2c(c1)[C@@H]([NH2+]C[C@H](C)C[NH3+])CCCO2 ZINC000423296883 388078253 /nfs/dbraw/zinc/07/82/53/388078253.db2.gz HWBVQSTUCHIECS-OCCSQVGLSA-N 2 0 248.370 2.393 20 0 BEADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@H]2CCO[C@H](C)C2)cc1 ZINC000423295914 388078336 /nfs/dbraw/zinc/07/83/36/388078336.db2.gz XTTYTTZTOLTYAE-XUJVJEKNSA-N 2 0 248.370 2.363 20 0 BEADRP C[C@@H]([NH3+])c1ccc(C[NH2+]C2CCC(O)CC2)cc1 ZINC000423296354 388078728 /nfs/dbraw/zinc/07/87/28/388078728.db2.gz YXOXEJWHQZQNIX-VCANKDNSSA-N 2 0 248.370 2.099 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@H]1CC(C)(C)Cc2occc21 ZINC000423297007 388078955 /nfs/dbraw/zinc/07/89/55/388078955.db2.gz IIZCPLGCAQHSPI-JQWIXIFHSA-N 2 0 236.359 2.478 20 0 BEADRP CC[NH+]1CCC([NH2+]CCC2CC(F)(F)C2)CC1 ZINC000453430589 388081398 /nfs/dbraw/zinc/08/13/98/388081398.db2.gz RACOAWUZYDQFDG-UHFFFAOYSA-N 2 0 246.345 2.496 20 0 BEADRP CC(C)CO[C@@H]1C[C@H]([NH2+]CCCC[NH3+])C1(C)C ZINC000085400660 388087062 /nfs/dbraw/zinc/08/70/62/388087062.db2.gz GRXGKIFNPPFZCL-QWHCGFSZSA-N 2 0 242.407 2.155 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]([NH2+]Cc2ccc(F)cc2)C1 ZINC000086401978 388101307 /nfs/dbraw/zinc/10/13/07/388101307.db2.gz DUWYZRDMEYIYJF-QWHCGFSZSA-N 2 0 222.307 2.185 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]Cc2ccccc2)C1 ZINC000086401671 388101677 /nfs/dbraw/zinc/10/16/77/388101677.db2.gz CRTKMMPQFUSCPW-STQMWFEESA-N 2 0 204.317 2.046 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@H]([NH3+])C1)c1cccnc1 ZINC000086402309 388101715 /nfs/dbraw/zinc/10/17/15/388101715.db2.gz VWNHKFSYIJLCTR-DRZSPHRISA-N 2 0 219.332 2.002 20 0 BEADRP CC(C)[C@@H]([NH2+][C@H]1CCC[NH2+]CC1)C1CC1 ZINC000324262467 388115794 /nfs/dbraw/zinc/11/57/94/388115794.db2.gz LXTTZTYLJAWNKJ-QWHCGFSZSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@@H]2CS[C@H](C)C2)CC1 ZINC000086934586 388111400 /nfs/dbraw/zinc/11/14/00/388111400.db2.gz FHDANSFJEHFFIG-YPMHNXCESA-N 2 0 242.432 2.343 20 0 BEADRP C[NH2+]C[C@@H](C)C[NH2+][C@H](Cc1ccccc1)C1CC1 ZINC000423271208 388048665 /nfs/dbraw/zinc/04/86/65/388048665.db2.gz IRXOIACKTSVQIU-CZUORRHYSA-N 2 0 246.398 2.453 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]C1CCC(CSC)CC1 ZINC000423271655 388050768 /nfs/dbraw/zinc/05/07/68/388050768.db2.gz JEPVDFGAFWMSSY-HIFPTAJRSA-N 2 0 244.448 2.353 20 0 BEADRP CCCN1CCC[C@H]1C[NH2+][C@@H]1C[C@H](C)O[C@@H]1C ZINC000449322363 388172501 /nfs/dbraw/zinc/17/25/01/388172501.db2.gz XFHNTRXAPBJWRK-RFQIPJPRSA-N 2 0 240.391 2.016 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CCC(C)(F)F)[C@@H](C)C1 ZINC000449354693 388179919 /nfs/dbraw/zinc/17/99/19/388179919.db2.gz QMSZPVNBDOJOGQ-WDEREUQCSA-N 2 0 234.334 2.352 20 0 BEADRP CC[C@H]([NH2+]CC1CC[NH2+]CC1)C1CCC1 ZINC000324920450 388127408 /nfs/dbraw/zinc/12/74/08/388127408.db2.gz LDJNRPWPRHHXOC-ZDUSSCGKSA-N 2 0 210.365 2.154 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)Cc2ccoc2)C1 ZINC000449089320 388140682 /nfs/dbraw/zinc/14/06/82/388140682.db2.gz JWELQWYAMXSTDC-JSGCOSHPSA-N 2 0 236.359 2.142 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@H](CCO)C(C)(C)C ZINC000191822544 388254693 /nfs/dbraw/zinc/25/46/93/388254693.db2.gz DUXXPCUFABYOLQ-CYBMUJFWSA-N 2 0 244.423 2.105 20 0 BEADRP CC(C)CCC[N@@H+]1CC[C@H](C)[C@@H](C[NH3+])C1 ZINC000164659608 388242731 /nfs/dbraw/zinc/24/27/31/388242731.db2.gz VLLGTZBBXFOEDW-STQMWFEESA-N 2 0 212.381 2.339 20 0 BEADRP CC1(C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)CCCC1 ZINC000086404243 388348528 /nfs/dbraw/zinc/34/85/28/388348528.db2.gz JWTCIMSZIBUOQC-VXGBXAGGSA-N 2 0 210.365 2.426 20 0 BEADRP [NH3+]CCCC[NH2+]Cc1ccc(F)cc1Cl ZINC000236211333 388378271 /nfs/dbraw/zinc/37/82/71/388378271.db2.gz LPMORWMVYIHQLB-UHFFFAOYSA-N 2 0 230.714 2.308 20 0 BEADRP Cc1cnccc1CC[N@@H+](C)C[C@H]1CCCOC1 ZINC000572872620 388383237 /nfs/dbraw/zinc/38/32/37/388383237.db2.gz GNTIUIQIRGTHIG-CQSZACIVSA-N 2 0 248.370 2.291 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CC[N@H+](C[C@@H]2CCC(F)(F)C2)C1 ZINC000300924121 388386833 /nfs/dbraw/zinc/38/68/33/388386833.db2.gz LRFSLUTWBMJOTR-HBNTYKKESA-N 2 0 232.318 2.091 20 0 BEADRP [NH3+]CC1CC[NH+](C[C@H]2CCC(F)(F)C2)CC1 ZINC000300817520 388395234 /nfs/dbraw/zinc/39/52/34/388395234.db2.gz FYVICRCDZRMPAL-NSHDSACASA-N 2 0 232.318 2.093 20 0 BEADRP C[N@H+](C[C@@H]1CCC(F)(F)C1)C1CC[NH2+]CC1 ZINC000300961931 388395352 /nfs/dbraw/zinc/39/53/52/388395352.db2.gz POVQHHJHIXMXNI-SNVBAGLBSA-N 2 0 232.318 2.106 20 0 BEADRP CCC[C@@H]([NH2+]Cc1cnc[nH]1)C1CCC1 ZINC000322719545 388444969 /nfs/dbraw/zinc/44/49/69/388444969.db2.gz SPOKDDUSMPTICC-GFCCVEGCSA-N 2 0 207.321 2.468 20 0 BEADRP Cc1cccnc1CC[NH2+][C@@H](C)CCCC[NH3+] ZINC000404952068 388447771 /nfs/dbraw/zinc/44/77/71/388447771.db2.gz QUWIHABCCBOTMX-ZDUSSCGKSA-N 2 0 235.375 2.040 20 0 BEADRP Cc1ccc(C[N@@H+]2C[C@H](C[NH3+])[C@H](C)C[C@@H]2C)nc1 ZINC000397264799 388455767 /nfs/dbraw/zinc/45/57/67/388455767.db2.gz IQWDKXVMOISJGX-RDBSUJKOSA-N 2 0 247.386 2.195 20 0 BEADRP C[N@H+](Cc1ccc2ncccc2c1)C1CC([NH3+])C1 ZINC000336233451 388456695 /nfs/dbraw/zinc/45/66/95/388456695.db2.gz NDIHEEFUVZXKST-UHFFFAOYSA-N 2 0 241.338 2.156 20 0 BEADRP CCc1ccc([C@@H](C)[NH2+]C[C@@H](C)C[NH3+])cc1 ZINC000336673902 388461271 /nfs/dbraw/zinc/46/12/71/388461271.db2.gz OVTNHVDXOIUFED-NWDGAFQWSA-N 2 0 220.360 2.494 20 0 BEADRP CCc1ccc([C@H](C)[NH2+]C[C@@H](C)C[NH3+])cc1 ZINC000336673903 388461587 /nfs/dbraw/zinc/46/15/87/388461587.db2.gz OVTNHVDXOIUFED-RYUDHWBXSA-N 2 0 220.360 2.494 20 0 BEADRP CCOc1ccc([C@@H](C)[NH2+]C[C@@H](C)C[NH3+])cc1 ZINC000336705561 388465002 /nfs/dbraw/zinc/46/50/02/388465002.db2.gz LCOPWXNACSVPQR-NWDGAFQWSA-N 2 0 236.359 2.331 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCN(C)[C@H](C)C2)[C@H]1C ZINC000336702888 388465527 /nfs/dbraw/zinc/46/55/27/388465527.db2.gz QEGHCHDQGXSKQL-LBELIVKGSA-N 2 0 210.365 2.103 20 0 BEADRP CCC[C@H](C)C[N@@H+]1C[C@@H]2CC[C@@H]([NH3+])[C@H]2C1 ZINC000336712253 388466903 /nfs/dbraw/zinc/46/69/03/388466903.db2.gz UXNXDUWPIJSGEL-ZDEQEGDKSA-N 2 0 210.365 2.092 20 0 BEADRP CCO[C@@H]1C[C@@H]([NH2+][C@H](C)CCCC[NH3+])C1(C)C ZINC000336731443 388471050 /nfs/dbraw/zinc/47/10/50/388471050.db2.gz YVKANEPVOAWDRV-JHJVBQTASA-N 2 0 242.407 2.297 20 0 BEADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@H](C)[C@@H](C)CC ZINC000165939885 388413286 /nfs/dbraw/zinc/41/32/86/388413286.db2.gz HOOIHZKBFAMATP-BFHYXJOUSA-N 2 0 244.423 2.367 20 0 BEADRP CC[C@H](C)[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000166321189 388425150 /nfs/dbraw/zinc/42/51/50/388425150.db2.gz OCMUBIISZKNONS-NSHDSACASA-N 2 0 210.365 2.249 20 0 BEADRP CCC[NH+]1CCC([NH2+]C[C@](C)(CC)OC)CC1 ZINC000322548011 388437719 /nfs/dbraw/zinc/43/77/19/388437719.db2.gz UVXAIDHDTCYPQV-AWEZNQCLSA-N 2 0 242.407 2.266 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CCCc1cccs1 ZINC000517123142 388538316 /nfs/dbraw/zinc/53/83/16/388538316.db2.gz WPYIASBXQIQRGC-WDEREUQCSA-N 2 0 226.389 2.396 20 0 BEADRP CCC[C@H](C[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)OC ZINC000356333473 388548375 /nfs/dbraw/zinc/54/83/75/388548375.db2.gz KYNXDFPWMLXFCU-MELADBBJSA-N 2 0 240.391 2.018 20 0 BEADRP CCC[C@H](C[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@H]1C)OC ZINC000356333488 388548526 /nfs/dbraw/zinc/54/85/26/388548526.db2.gz LDCBHIKUWFPZAU-XJFOESAGSA-N 2 0 242.407 2.120 20 0 BEADRP CCC[C@H](C[NH2+]C1CC[NH+](C(C)C)CC1)OC ZINC000356340350 388548875 /nfs/dbraw/zinc/54/88/75/388548875.db2.gz SIXLECZAKKXXLW-CQSZACIVSA-N 2 0 242.407 2.264 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@@H](C)[N@H+](C)C[C@@H]2C)CS1 ZINC000397796012 388499697 /nfs/dbraw/zinc/49/96/97/388499697.db2.gz ANLLFKJMHIAKMH-CKIKVBCHSA-N 2 0 242.432 2.199 20 0 BEADRP CCC[C@H]([NH2+]CCN(C)C)[C@H]1CC1(C)C ZINC000397853323 388506635 /nfs/dbraw/zinc/50/66/35/388506635.db2.gz SMYDREKUJYQFCF-NEPJUHHUSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H]1C[C@H](C)[NH+]1CCC[NH+]1CCCCC1 ZINC000548096656 388510555 /nfs/dbraw/zinc/51/05/55/388510555.db2.gz FFIZROGSFNYSAR-STQMWFEESA-N 2 0 210.365 2.345 20 0 BEADRP c1ccc([C@@H]2CCC[N@H+]2CC[C@@H]2CC[NH2+]C2)nc1 ZINC000516973478 256809000 /nfs/dbraw/zinc/80/90/00/256809000.db2.gz UMTBJOILTKSCND-ZFWWWQNUSA-N 2 0 245.370 2.218 20 0 BEADRP CC(C)CCC[N@H+](C)CCC[NH+](C)C ZINC000516815403 388519109 /nfs/dbraw/zinc/51/91/09/388519109.db2.gz PHMDVMMDYMWAMU-UHFFFAOYSA-N 2 0 200.370 2.306 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[N@@H+]1C[C@@H]2CC[C@@H]([NH3+])[C@H]2C1 ZINC000346842695 388520472 /nfs/dbraw/zinc/52/04/72/388520472.db2.gz IKDRWOKRBYQDHF-NIFZNCRKSA-N 2 0 236.403 2.482 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CCCc1cccs1 ZINC000517123139 256815498 /nfs/dbraw/zinc/81/54/98/256815498.db2.gz WPYIASBXQIQRGC-GHMZBOCLSA-N 2 0 226.389 2.396 20 0 BEADRP CC[C@H](C)C[N@H+](C)C1CCN(CC)CC1 ZINC000088492348 388530906 /nfs/dbraw/zinc/53/09/06/388530906.db2.gz ZWFAEEKPQIRXQC-LBPRGKRZSA-N 2 0 212.381 2.449 20 0 BEADRP CC[N@@H+]1CC[C@H](CN[C@H](C)c2ccoc2)C1 ZINC000245867570 388609054 /nfs/dbraw/zinc/60/90/54/388609054.db2.gz MFJGSSMDRUOYIC-VXGBXAGGSA-N 2 0 222.332 2.272 20 0 BEADRP Cc1ccccc1OCC[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000517588785 388555434 /nfs/dbraw/zinc/55/54/34/388555434.db2.gz SVARTAXHWJCBSQ-KBPBESRZSA-N 2 0 248.370 2.233 20 0 BEADRP CS[C@H]1CC[N@H+](CC[C@H]2CCCC[NH+]2C)C1 ZINC000521192233 388564742 /nfs/dbraw/zinc/56/47/42/388564742.db2.gz OCILFBUQBHIHSM-OLZOCXBDSA-N 2 0 242.432 2.298 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH+](C)CC(C)C)[C@@H](C)C1 ZINC000245426802 388579080 /nfs/dbraw/zinc/57/90/80/388579080.db2.gz LMYVGJUYUHMYBT-QWHCGFSZSA-N 2 0 212.381 2.305 20 0 BEADRP CC/C=C/CC[N@@H+]1CC[C@@H](C[NH+](C)C)C1 ZINC000184553053 388579237 /nfs/dbraw/zinc/57/92/37/388579237.db2.gz RBWKHNLHBQMAJB-GFUIURDCSA-N 2 0 210.365 2.226 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]C[C@@H]2CCCS2)[C@@H](C)C1 ZINC000224554217 388665815 /nfs/dbraw/zinc/66/58/15/388665815.db2.gz BLRTYROITLZHRK-AVGNSLFASA-N 2 0 242.432 2.202 20 0 BEADRP CC1=CC[C@@H]([NH2+]C[C@H]2CCC[N@@H+](C)C2)CC1 ZINC000552117519 388670787 /nfs/dbraw/zinc/67/07/87/388670787.db2.gz PPZPIWQILHKFIS-ZIAGYGMSSA-N 2 0 222.376 2.417 20 0 BEADRP C[C@@H]1CC([NH2+][C@@H]2CCCC[C@@H]2C[NH3+])C[C@@H](C)O1 ZINC000521983280 388672673 /nfs/dbraw/zinc/67/26/73/388672673.db2.gz NTEBJVOAECPJMX-HKUMRIAESA-N 2 0 240.391 2.050 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+][C@@H]2CC[NH2+]C23CCC3)C1 ZINC000530179677 388622861 /nfs/dbraw/zinc/62/28/61/388622861.db2.gz ZUJMZHFLQZCKPP-JHJVBQTASA-N 2 0 222.376 2.439 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]C[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000530207039 388626991 /nfs/dbraw/zinc/62/69/91/388626991.db2.gz CMVXMVQCCVVXOK-ZSAUSMIDSA-N 2 0 236.403 2.400 20 0 BEADRP COCCC1CC[NH+]([C@H]2CCC[C@@H]([NH3+])C2)CC1 ZINC000530212178 388627411 /nfs/dbraw/zinc/62/74/11/388627411.db2.gz PLINAWMOTKNOGJ-KGLIPLIRSA-N 2 0 240.391 2.005 20 0 BEADRP CC(C)OC1CCC([NH2+]C2CC[NH2+]CC2)CC1 ZINC000530214771 388628648 /nfs/dbraw/zinc/62/86/48/388628648.db2.gz CRAHKSZQYFRIIZ-UHFFFAOYSA-N 2 0 240.391 2.064 20 0 BEADRP C[C@H]([NH3+])C1CC[NH+](CC2CC(C)(C)C2)CC1 ZINC000530213110 388629121 /nfs/dbraw/zinc/62/91/21/388629121.db2.gz VCFYFIGKIPIBLD-NSHDSACASA-N 2 0 224.392 2.482 20 0 BEADRP CC[C@@H]([NH2+][C@H]1CC[NH2+]C12CCC2)C(C)C ZINC000530217452 388629940 /nfs/dbraw/zinc/62/99/40/388629940.db2.gz GQBWZNLADXFZKB-NEPJUHHUSA-N 2 0 210.365 2.295 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[NH2+]C12CCC2)[C@@H]1C[C@H]1C ZINC000530216139 388630051 /nfs/dbraw/zinc/63/00/51/388630051.db2.gz MVYIMMVHRFWUKG-FVCCEPFGSA-N 2 0 222.376 2.295 20 0 BEADRP C[C@H]([NH2+][C@H]1CC[NH2+]C12CCC2)C(C)(C)C ZINC000530216297 388630537 /nfs/dbraw/zinc/63/05/37/388630537.db2.gz AFADZDBNTDVFDJ-QWRGUYRKSA-N 2 0 210.365 2.295 20 0 BEADRP C1CC([C@@H]2CC[C@@H]2[NH2+][C@H]2CC[NH2+]C23CCC3)C1 ZINC000530217703 388630690 /nfs/dbraw/zinc/63/06/90/388630690.db2.gz VRYOIYBVXHVECZ-IHRRRGAJSA-N 2 0 234.387 2.439 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CC[NH2+]C12CCC2)C1CC1 ZINC000530219345 388631264 /nfs/dbraw/zinc/63/12/64/388631264.db2.gz LKMQZBZOSXVDCB-NWDGAFQWSA-N 2 0 208.349 2.049 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CC2(CC)CC2)[C@H](C)C1 ZINC000246330072 388631418 /nfs/dbraw/zinc/63/14/18/388631418.db2.gz GAIUJVUPQZQEKY-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP CC1(C)CC(C[N@@H+]2CC[C@H]3[NH2+]CC[C@@H]3C2)C1 ZINC000530219953 388632254 /nfs/dbraw/zinc/63/22/54/388632254.db2.gz LUBUQLGBXQZEDN-CHWSQXEVSA-N 2 0 222.376 2.106 20 0 BEADRP C[C@@H]1C[C@@H](C[NH3+])C[N@@H+]1CC1CC(C)(C)C1 ZINC000530225154 388635025 /nfs/dbraw/zinc/63/50/25/388635025.db2.gz WUSFEQSWPMLIBB-MNOVXSKESA-N 2 0 210.365 2.092 20 0 BEADRP C[C@@H]1C[C@H](C[NH3+])C[N@@H+]1CC1CC(C)(C)C1 ZINC000530225151 388635456 /nfs/dbraw/zinc/63/54/56/388635456.db2.gz WUSFEQSWPMLIBB-GHMZBOCLSA-N 2 0 210.365 2.092 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H]2CC=CCC2)[C@H](C)C1 ZINC000246457762 388637700 /nfs/dbraw/zinc/63/77/00/388637700.db2.gz PQEQXRXDTAPIBQ-MCIONIFRSA-N 2 0 222.376 2.415 20 0 BEADRP C[C@H](C[C@H]1CCC[NH2+]1)[NH2+]C[C@@H](C)c1ccncc1 ZINC000530242721 388637841 /nfs/dbraw/zinc/63/78/41/388637841.db2.gz CTIUGBLDDHKXOK-UMVBOHGHSA-N 2 0 247.386 2.305 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH+](C)CC2CCC2)[C@@H](C)C1 ZINC000246487033 388639337 /nfs/dbraw/zinc/63/93/37/388639337.db2.gz IDHMLTMCCNZIHW-JSGCOSHPSA-N 2 0 224.392 2.449 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CC2CCC2)[C@@H](C)C1 ZINC000222821413 388645216 /nfs/dbraw/zinc/64/52/16/388645216.db2.gz DLVDLELQCTZUIC-AAEUAGOBSA-N 2 0 210.365 2.106 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CC2CCC2)[C@@H](C)C1 ZINC000222821349 388645225 /nfs/dbraw/zinc/64/52/25/388645225.db2.gz DLVDLELQCTZUIC-WCQYABFASA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CC=CCC2)CC[N@@H+]1C ZINC000222825003 388645288 /nfs/dbraw/zinc/64/52/88/388645288.db2.gz MZSIJNWCHHIZIM-MGPQQGTHSA-N 2 0 222.376 2.415 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CC=CCC2)CC[N@@H+]1C ZINC000222824882 388645667 /nfs/dbraw/zinc/64/56/67/388645667.db2.gz MZSIJNWCHHIZIM-MCIONIFRSA-N 2 0 222.376 2.415 20 0 BEADRP C[C@@H](C[NH2+]C(C1CC1)C1CC1)C[NH+]1CCCC1 ZINC000062077365 388649229 /nfs/dbraw/zinc/64/92/29/388649229.db2.gz IXYSBJAGTQSKKT-LBPRGKRZSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1)C1CC1 ZINC000227609286 388753139 /nfs/dbraw/zinc/75/31/39/388753139.db2.gz MKZKTHNKXUDWNL-WCFLWFBJSA-N 2 0 210.365 2.247 20 0 BEADRP COC[C@@H]([NH2+]CC[C@H]1CCCC[N@@H+]1C)C(C)C ZINC000086700184 388690447 /nfs/dbraw/zinc/69/04/47/388690447.db2.gz IBXWHIZYGKGFTE-ZIAGYGMSSA-N 2 0 242.407 2.121 20 0 BEADRP C(C1CC1)[NH+]1CCC([NH2+]C2(C3CC3)CC2)CC1 ZINC000538554447 388701936 /nfs/dbraw/zinc/70/19/36/388701936.db2.gz TTXAGKSTLHWNMR-UHFFFAOYSA-N 2 0 234.387 2.393 20 0 BEADRP CC[N@H+](C[C@H]1CCC[NH2+]C1)[C@@H](C)C(C)C ZINC000226437213 388719339 /nfs/dbraw/zinc/71/93/39/388719339.db2.gz UPBZWXISNFUCNT-STQMWFEESA-N 2 0 212.381 2.352 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+][C@H]2C[C@@H]2C(F)F)[C@H]2CCC[C@@H]21 ZINC000554095444 388799075 /nfs/dbraw/zinc/79/90/75/388799075.db2.gz FNDHLNSTAPQOMF-DGORSVRFSA-N 2 0 244.329 2.102 20 0 BEADRP CCc1ccc(CN(C)CCC[NH+](C)C)cn1 ZINC000554875793 388834480 /nfs/dbraw/zinc/83/44/80/388834480.db2.gz RMCNWUNTYXZOAE-UHFFFAOYSA-N 2 0 235.375 2.028 20 0 BEADRP C[C@@H]1CCC[C@@H]1C[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000300240683 388834965 /nfs/dbraw/zinc/83/49/65/388834965.db2.gz FQUDZKXOQKKKDA-FVCCEPFGSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]CCCC1CC1 ZINC000129728372 388868726 /nfs/dbraw/zinc/86/87/26/388868726.db2.gz NBLLYTJEBVIXJH-AAEUAGOBSA-N 2 0 210.365 2.106 20 0 BEADRP C([NH2+][C@H]1CCCC12CC2)[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000565242670 388930593 /nfs/dbraw/zinc/93/05/93/388930593.db2.gz GVQSIDLWXWHNPR-JSGCOSHPSA-N 2 0 234.387 2.393 20 0 BEADRP c1ccc([C@@H]2CCC[N@H+]2C[C@@H]2CCC[NH2+]C2)nc1 ZINC000564975601 388904221 /nfs/dbraw/zinc/90/42/21/388904221.db2.gz LEXJVSDCZHSTDN-HIFRSBDPSA-N 2 0 245.370 2.218 20 0 BEADRP C[C@H](NCCC[NH+](C)C)c1ccc(Cl)cn1 ZINC000274862557 389049057 /nfs/dbraw/zinc/04/90/57/389049057.db2.gz DBKJXPLBPAJVLP-JTQLQIEISA-N 2 0 241.766 2.337 20 0 BEADRP COCCCCC[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000300408600 533233586 /nfs/dbraw/zinc/23/35/86/533233586.db2.gz CAOAORRTKFXVRY-KBPBESRZSA-N 2 0 240.391 2.020 20 0 BEADRP CC[N@H+](C)C[C@H]1CCN(c2cc[nH+]c(C)c2)C1 ZINC000274358461 169707047 /nfs/dbraw/zinc/70/70/47/169707047.db2.gz MLEXVUVMIOPWAP-CYBMUJFWSA-N 2 0 233.359 2.168 20 0 BEADRP C(C[N@@H+]1CC[C@@H]2[NH2+]CC[C@@H]2C1)C1CCCC1 ZINC000261571345 533363997 /nfs/dbraw/zinc/36/39/97/533363997.db2.gz HMQJUTVSHNCZPV-KGLIPLIRSA-N 2 0 222.376 2.251 20 0 BEADRP C([NH2+][C@@H]1CCC12CCCC2)[C@@H]1CCC[NH2+]C1 ZINC000335519370 533368848 /nfs/dbraw/zinc/36/88/48/533368848.db2.gz ORFCYKRNHMUYAR-CHWSQXEVSA-N 2 0 222.376 2.298 20 0 BEADRP C([NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)C1CCCC1 ZINC000251586194 533370684 /nfs/dbraw/zinc/37/06/84/533370684.db2.gz YYUPDPZZLUYRJG-KGLIPLIRSA-N 2 0 222.376 2.393 20 0 BEADRP C([C@@H]1CCC[NH2+]C1)[N@@H+]1CCCC12CCC2 ZINC000261548855 533375947 /nfs/dbraw/zinc/37/59/47/533375947.db2.gz NYSMREDTCMIVQB-GFCCVEGCSA-N 2 0 208.349 2.005 20 0 BEADRP Cc1cc(N2CC[NH2+][C@@H](C)C2)c2ccccc2[nH+]1 ZINC000052783497 132229484 /nfs/dbraw/zinc/22/94/84/132229484.db2.gz DWZGWZISVZYJBI-LBPRGKRZSA-N 2 0 241.338 2.341 20 0 BEADRP C[C@@H]1CN(c2cc[nH+]c3ccccc32)CC[NH2+]1 ZINC000052783560 132229567 /nfs/dbraw/zinc/22/95/67/132229567.db2.gz FEXVNISSKILHAR-LLVKDONJSA-N 2 0 227.311 2.033 20 0 BEADRP C[C@H]1CC[C@H]1[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000334317524 132296249 /nfs/dbraw/zinc/29/62/49/132296249.db2.gz VAOUZCKDNVAKTM-SWLSCSKDSA-N 2 0 245.370 2.439 20 0 BEADRP CC[N@H+](C)C[C@H]1CC[NH+](CC[C@H](C)F)C1 ZINC000352003345 134034357 /nfs/dbraw/zinc/03/43/57/134034357.db2.gz LLXTYQZFSNGIHB-NWDGAFQWSA-N 2 0 216.344 2.008 20 0 BEADRP C[C@H](F)CC[N@@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000352051356 134048086 /nfs/dbraw/zinc/04/80/86/134048086.db2.gz ZJQXEEBMTKIPAA-QWHCGFSZSA-N 2 0 228.355 2.152 20 0 BEADRP C[C@@H]1CC[C@@]2(CC[N@H+](CC3CC[NH2+]CC3)C2)C1 ZINC000336054446 134065668 /nfs/dbraw/zinc/06/56/68/134065668.db2.gz AURFSMYCRYCJHB-UKRRQHHQSA-N 2 0 236.403 2.498 20 0 BEADRP CCc1cc(N2CC[C@@H]([NH+]3CC=CC3)C2)cc[nH+]1 ZINC000336188721 134122494 /nfs/dbraw/zinc/12/24/94/134122494.db2.gz VTDNPXHVFOVIHH-OAHLLOKOSA-N 2 0 243.354 2.095 20 0 BEADRP CCc1cc(N2CC[C@@]3(CC[N@H+](C)C3)C2)cc[nH+]1 ZINC000336201594 134130800 /nfs/dbraw/zinc/13/08/00/134130800.db2.gz ZTLMDJDLBSEUCS-OAHLLOKOSA-N 2 0 245.370 2.176 20 0 BEADRP C[C@@H]([NH3+])[C@@H]1CC[N@H+](CC2CCC(C)CC2)C1 ZINC000168520283 134225404 /nfs/dbraw/zinc/22/54/04/134225404.db2.gz CMCMKDNEIOXJQH-FKZOYECMSA-N 2 0 224.392 2.482 20 0 BEADRP Cc1cc(CN2CCC[C@@H]2C[NH3+])ccc1F ZINC000168797242 134247782 /nfs/dbraw/zinc/24/77/82/134247782.db2.gz CDJZQKMRQRUBLQ-GFCCVEGCSA-N 2 0 222.307 2.057 20 0 BEADRP Cc1csc([C@@H](C)N[C@H]2CCC[NH2+]CC2)n1 ZINC000168758978 134247829 /nfs/dbraw/zinc/24/78/29/134247829.db2.gz RSWHLDDYOOJHQD-MNOVXSKESA-N 2 0 239.388 2.244 20 0 BEADRP C[C@H](CC[NH3+])[NH2+]Cc1cc2ccccc2o1 ZINC000220489365 134305430 /nfs/dbraw/zinc/30/54/30/134305430.db2.gz QTEYVLYNKXTLAF-SNVBAGLBSA-N 2 0 218.300 2.260 20 0 BEADRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@H](C)C1CCC1 ZINC000178377521 134309192 /nfs/dbraw/zinc/30/91/92/134309192.db2.gz OXQREBQKAOWKCT-OCCSQVGLSA-N 2 0 242.407 2.121 20 0 BEADRP Cc1ccc(C[NH2+][C@H](C)CC[NH3+])c(C)c1 ZINC000220516532 134309509 /nfs/dbraw/zinc/30/95/09/134309509.db2.gz BBSUBJIQLDUDAO-GFCCVEGCSA-N 2 0 206.333 2.130 20 0 BEADRP CCc1ccc(C[NH2+][C@@H](C)CC[NH3+])cc1 ZINC000220516289 134309619 /nfs/dbraw/zinc/30/96/19/134309619.db2.gz XAPXJJLDMJFHBG-NSHDSACASA-N 2 0 206.333 2.076 20 0 BEADRP CC(C)C[C@@H]1CC[N@H+](CC2CC[NH2+]CC2)C1 ZINC000178972781 134313939 /nfs/dbraw/zinc/31/39/39/134313939.db2.gz UZCCXRFDIFCJRS-AWEZNQCLSA-N 2 0 224.392 2.354 20 0 BEADRP CCSCC[C@H](C)[N@H+](C)CC1CC[NH2+]CC1 ZINC000178976807 134314300 /nfs/dbraw/zinc/31/43/00/134314300.db2.gz MGNWOQZJCMTOGY-LBPRGKRZSA-N 2 0 244.448 2.450 20 0 BEADRP C(C1CC[NH2+]CC1)[N@@H+]1CCC[C@@H]1C1CCC1 ZINC000178971075 134314371 /nfs/dbraw/zinc/31/43/71/134314371.db2.gz NVKDJDYBEJYSMM-CQSZACIVSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@H]([NH2+][C@@H]1CCN2CCCC[C@@H]12)C1CCC1 ZINC000222017559 134329313 /nfs/dbraw/zinc/32/93/13/134329313.db2.gz PCFDYXAUDCLCGS-YUTCNCBUSA-N 2 0 222.376 2.391 20 0 BEADRP CCSCC[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C)C1 ZINC000224012858 134343905 /nfs/dbraw/zinc/34/39/05/134343905.db2.gz CATCVZCDHXHIPW-STQMWFEESA-N 2 0 242.432 2.156 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CC[C@@H](C)C2)C1 ZINC000227197415 134375228 /nfs/dbraw/zinc/37/52/28/134375228.db2.gz OKIIXYJIHKVQRS-JHJVBQTASA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H](C[NH2+][C@@H]1CC[C@@H](C)C1)C[NH+]1CCCC1 ZINC000227203563 134375996 /nfs/dbraw/zinc/37/59/96/134375996.db2.gz VJXAVWFAEDEYKP-HZSPNIEDSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]([NH2+]CC1(C)CC[NH+](C)CC1)C1CC1 ZINC000227498173 134381241 /nfs/dbraw/zinc/38/12/41/134381241.db2.gz RDEJPTBZDCLUBA-LLVKDONJSA-N 2 0 210.365 2.106 20 0 BEADRP CCN(C)CC[NH2+]C[C@H]1CCC[C@@H](C)C1 ZINC000227552041 134383415 /nfs/dbraw/zinc/38/34/15/134383415.db2.gz OHKRTDLXXXAIOO-OLZOCXBDSA-N 2 0 212.381 2.354 20 0 BEADRP C[C@@H](CC[NH+](C)C)[NH2+][C@@H](C)C1CCCC1 ZINC000054081233 134387060 /nfs/dbraw/zinc/38/70/60/134387060.db2.gz PNRVXCNJSRGDBR-RYUDHWBXSA-N 2 0 212.381 2.495 20 0 BEADRP Cc1ccc(C[NH2+]CC2(C)CC[NH+](C)CC2)cn1 ZINC000231383637 134542322 /nfs/dbraw/zinc/54/23/22/134542322.db2.gz LJYJKKBYBNQOSV-UHFFFAOYSA-N 2 0 247.386 2.212 20 0 BEADRP CC[NH+]1CCC([NH2+]CCC(F)(F)F)CC1 ZINC000059313343 134789720 /nfs/dbraw/zinc/78/97/20/134789720.db2.gz IYSKUDIDYAQKMJ-UHFFFAOYSA-N 2 0 224.270 2.013 20 0 BEADRP C[C@@H]([NH3+])C1CC[NH+](CC2CCCC2)CC1 ZINC000082474717 134970777 /nfs/dbraw/zinc/97/07/77/134970777.db2.gz WKIZCNUVXBMWTQ-LLVKDONJSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C[C@H]2CCC(C)(C)O2)CC[N@@H+]1C ZINC000248570035 135004559 /nfs/dbraw/zinc/00/45/59/135004559.db2.gz LNRMPFLVNKRSEH-FRRDWIJNSA-N 2 0 240.391 2.016 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@H]2CCC(C)(C)O2)CC[N@@H+]1C ZINC000248570039 135005010 /nfs/dbraw/zinc/00/50/10/135005010.db2.gz LNRMPFLVNKRSEH-JHJVBQTASA-N 2 0 240.391 2.016 20 0 BEADRP CC(C)(C)[C@H]1CCC[N@H+](CCC[NH3+])CC1 ZINC000070652724 135005606 /nfs/dbraw/zinc/00/56/06/135005606.db2.gz ZFUNVBHLIYGHKK-LBPRGKRZSA-N 2 0 212.381 2.483 20 0 BEADRP CCN(C)CC[NH2+][C@H]1C[C@@H](OC(C)C)C1(C)C ZINC000248727752 135020396 /nfs/dbraw/zinc/02/03/96/135020396.db2.gz CWUPJPBVOZIXOA-QWHCGFSZSA-N 2 0 242.407 2.120 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2cncc(C)c2)C1 ZINC000248754028 135020488 /nfs/dbraw/zinc/02/04/88/135020488.db2.gz UQXLZRBTYBDKIQ-KGLIPLIRSA-N 2 0 247.386 2.382 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)C2(C)CC2)C1 ZINC000249380218 135037877 /nfs/dbraw/zinc/03/78/77/135037877.db2.gz PVVZWCUMLHUSID-NEPJUHHUSA-N 2 0 210.365 2.106 20 0 BEADRP CCCCOCCN1CCCC[C@H]1[C@H](C)[NH3+] ZINC000249881575 135047290 /nfs/dbraw/zinc/04/72/90/135047290.db2.gz NZMIFGFGABLXBG-STQMWFEESA-N 2 0 228.380 2.005 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H]2CCC[C@@H]2C)C1 ZINC000250257090 135052034 /nfs/dbraw/zinc/05/20/34/135052034.db2.gz JFCSKVSNNWQWRT-XQQFMLRXSA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)[C@H](C)C[NH2+][C@H]1CCCC[C@H]1C[NH3+] ZINC000251285186 135068147 /nfs/dbraw/zinc/06/81/47/135068147.db2.gz FDQYHCSGRCLJME-AGIUHOORSA-N 2 0 212.381 2.386 20 0 BEADRP C[C@@H]1C[N@H+](CCCc2ccccc2)CC[C@H]1[NH3+] ZINC000251615886 135072474 /nfs/dbraw/zinc/07/24/74/135072474.db2.gz DRNWZLBWEXEPDR-UKRRQHHQSA-N 2 0 232.371 2.288 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]Cc2ccsc2)C1 ZINC000086404137 135083340 /nfs/dbraw/zinc/08/33/40/135083340.db2.gz MKWDGXXQKGBXIT-QWRGUYRKSA-N 2 0 210.346 2.108 20 0 BEADRP C[C@@H](C[C@@H]1CCC[NH2+]1)[NH2+]C1CCCCC1 ZINC000086494723 135086738 /nfs/dbraw/zinc/08/67/38/135086738.db2.gz XAXBDPOENKOGLX-AAEUAGOBSA-N 2 0 210.365 2.439 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)CS1 ZINC000252203615 135086851 /nfs/dbraw/zinc/08/68/51/135086851.db2.gz WTPMYMMZSMBWGU-VOAKCMCISA-N 2 0 240.416 2.097 20 0 BEADRP C[C@H](C[C@@H]1CCC[NH2+]1)[NH2+]C1CCCCC1 ZINC000086494725 135087419 /nfs/dbraw/zinc/08/74/19/135087419.db2.gz XAXBDPOENKOGLX-YPMHNXCESA-N 2 0 210.365 2.439 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+][C@H]1CC1(C)C ZINC000252440880 135090002 /nfs/dbraw/zinc/09/00/02/135090002.db2.gz XOLBYBXNFITZAE-WYUUTHIRSA-N 2 0 210.365 2.103 20 0 BEADRP C[C@H]1CC[C@H]([N@H+](C)CC2CC[NH2+]CC2)C1 ZINC000086701590 135093989 /nfs/dbraw/zinc/09/39/89/135093989.db2.gz DRZJUWLMSHKWQF-AAEUAGOBSA-N 2 0 210.365 2.106 20 0 BEADRP C1CCC([NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)C1 ZINC000252675435 135095987 /nfs/dbraw/zinc/09/59/87/135095987.db2.gz ZTUBPWUGZCJWMQ-STQMWFEESA-N 2 0 208.349 2.145 20 0 BEADRP C[C@H](c1ccccn1)[N@@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000257669488 135100960 /nfs/dbraw/zinc/10/09/60/135100960.db2.gz DLRCSKRMKWYPMG-CYBMUJFWSA-N 2 0 245.370 2.218 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]C[C@@]1(C)CCCS1 ZINC000252717052 135102293 /nfs/dbraw/zinc/10/22/93/135102293.db2.gz ZQMWPIMOALWDCD-JHJVBQTASA-N 2 0 242.432 2.202 20 0 BEADRP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]CC1(C)CCCC1 ZINC000252729731 135103680 /nfs/dbraw/zinc/10/36/80/135103680.db2.gz IAPZSHYFRUURSX-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP CC1(C[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)CCC1 ZINC000252731753 135104458 /nfs/dbraw/zinc/10/44/58/135104458.db2.gz RJYGCKZYEQMESY-STQMWFEESA-N 2 0 222.376 2.393 20 0 BEADRP CC[C@H](C)C[N@@H+]1C[C@@H]2CCC[C@@H]([NH3+])[C@H]2C1 ZINC000252875212 135115056 /nfs/dbraw/zinc/11/50/56/135115056.db2.gz VOJJTLOLMKSIDR-ZDEQEGDKSA-N 2 0 210.365 2.092 20 0 BEADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]Cc1cccc(F)c1 ZINC000252892584 135116496 /nfs/dbraw/zinc/11/64/96/135116496.db2.gz NYOWOXNMTHBALP-BXUZGUMPSA-N 2 0 236.334 2.256 20 0 BEADRP Cc1ccsc1C[NH2+][C@H]1CCC[C@H]1C[NH3+] ZINC000087308571 135121633 /nfs/dbraw/zinc/12/16/33/135121633.db2.gz HNJBGGSMMDTOLC-QWRGUYRKSA-N 2 0 224.373 2.274 20 0 BEADRP Cc1cscc1C[NH2+][C@H]1CCC[C@H]1C[NH3+] ZINC000087309290 135121946 /nfs/dbraw/zinc/12/19/46/135121946.db2.gz QCAVPNNNLJUQGG-JQWIXIFHSA-N 2 0 224.373 2.274 20 0 BEADRP C[C@H]1CC[C@H]([NH2+][C@H]2CCC[C@H]2C[NH3+])CC1 ZINC000253118331 135122202 /nfs/dbraw/zinc/12/22/02/135122202.db2.gz HAOOSEZGYOBHKQ-CYDGBPFRSA-N 2 0 210.365 2.282 20 0 BEADRP Cc1ccsc1C[NH2+]CCC[NH2+]C1CC1 ZINC000087309914 135122512 /nfs/dbraw/zinc/12/25/12/135122512.db2.gz XMISOAVNCORAEH-UHFFFAOYSA-N 2 0 224.373 2.288 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+][C@@H]2C[C@H](C)[N@H+](C)C[C@H]2C)C1 ZINC000253279352 135125733 /nfs/dbraw/zinc/12/57/33/135125733.db2.gz JXRCHDMRMSOKSP-PEBLQZBPSA-N 2 0 224.392 2.493 20 0 BEADRP Cc1cc(C)cc(C[N@@H+]2CC[C@@]3(CC[NH2+]C3)C2)c1 ZINC000257712245 135140790 /nfs/dbraw/zinc/14/07/90/135140790.db2.gz TVAOOOMHXZPLEV-MRXNPFEDSA-N 2 0 244.382 2.489 20 0 BEADRP Cc1ccsc1C[N@@H+]1CC[C@@]2(CC[NH2+]C2)C1 ZINC000257739731 135141214 /nfs/dbraw/zinc/14/12/14/135141214.db2.gz YRVXABDGTABFLC-CYBMUJFWSA-N 2 0 236.384 2.242 20 0 BEADRP C[NH2+]CCCN(C)Cc1cc(Cl)cs1 ZINC000087472195 135141516 /nfs/dbraw/zinc/14/15/16/135141516.db2.gz SFLKGXNDGNKIKD-UHFFFAOYSA-N 2 0 232.780 2.443 20 0 BEADRP C[NH2+]CCCN(C)Cc1cc(F)ccc1F ZINC000087472258 135143032 /nfs/dbraw/zinc/14/30/32/135143032.db2.gz HWZPJBALTWDHMA-UHFFFAOYSA-N 2 0 228.286 2.006 20 0 BEADRP C[NH2+]CCCN(C)Cc1cc(C)sc1C ZINC000087472325 135143247 /nfs/dbraw/zinc/14/32/47/135143247.db2.gz NTQXBKMNBFDAER-UHFFFAOYSA-N 2 0 226.389 2.406 20 0 BEADRP C[NH2+]CCCN(C)[C@H](C)c1cccc(F)c1 ZINC000087472249 135143481 /nfs/dbraw/zinc/14/34/81/135143481.db2.gz QRTJQYLJZCVUDH-LLVKDONJSA-N 2 0 224.323 2.428 20 0 BEADRP CC[NH2+]CCNc1cc[nH+]c(C)c1Cl ZINC000261529415 135155476 /nfs/dbraw/zinc/15/54/76/135155476.db2.gz RWXGPYHRRPTBLA-UHFFFAOYSA-N 2 0 213.712 2.065 20 0 BEADRP CC1(C[N@@H+]2CCC[C@H](CC[NH3+])C2)CCC1 ZINC000261530138 135157110 /nfs/dbraw/zinc/15/71/10/135157110.db2.gz CBZLHOMRLOOPRT-GFCCVEGCSA-N 2 0 210.365 2.237 20 0 BEADRP C[C@@H](C1CC1)[N@H+](C)C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000261530766 135158558 /nfs/dbraw/zinc/15/85/58/135158558.db2.gz CZKPCMOMCASSEL-GRYCIOLGSA-N 2 0 210.365 2.105 20 0 BEADRP Cc1ccsc1C[NH2+][C@H]1CC[NH2+]C[C@@H]1C ZINC000261531017 135159296 /nfs/dbraw/zinc/15/92/96/135159296.db2.gz DWXJUYNIXBLYCU-QWRGUYRKSA-N 2 0 224.373 2.144 20 0 BEADRP CC1(C)CC[C@H]1[NH2+]CC1([NH3+])CCCCC1 ZINC000261531495 135161045 /nfs/dbraw/zinc/16/10/45/135161045.db2.gz GTLOHGINEITRAR-LLVKDONJSA-N 2 0 210.365 2.426 20 0 BEADRP CC(C)(C)CC[N@@H+]1C[C@@H]2CC[C@H]([NH3+])[C@H]2C1 ZINC000261532248 135162701 /nfs/dbraw/zinc/16/27/01/135162701.db2.gz JTHYWZKNPJBADQ-SRVKXCTJSA-N 2 0 210.365 2.092 20 0 BEADRP C[C@@H]1C[C@H](C[N@H+](C)CCC2CC2)CC[NH2+]1 ZINC000261533287 135164889 /nfs/dbraw/zinc/16/48/89/135164889.db2.gz KQAGFIPUOKFHDR-DGCLKSJQSA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@@H]1C[N@H+](C[C@H]2CC[NH2+][C@H](C)C2)CCS1 ZINC000261533413 135164906 /nfs/dbraw/zinc/16/49/06/135164906.db2.gz IHCGJTOYNRXHTN-FRRDWIJNSA-N 2 0 242.432 2.202 20 0 BEADRP Cc1ccc(C)c(CN2C[C@@H](C)[C@H]([NH3+])C2)c1 ZINC000261534254 135166590 /nfs/dbraw/zinc/16/65/90/135166590.db2.gz PASPCRFCOCPAPP-TZMCWYRMSA-N 2 0 218.344 2.082 20 0 BEADRP CC1(C)CC[C@@H]1[NH2+]C[C@H]1CCC[C@@H]([NH3+])C1 ZINC000261535058 135168647 /nfs/dbraw/zinc/16/86/47/135168647.db2.gz NPEFDBDQWIEZCJ-TUAOUCFPSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]([NH3+])[C@H]1CC[N@H+](CCC2CCCC2)C1 ZINC000261535559 135169443 /nfs/dbraw/zinc/16/94/43/135169443.db2.gz ONXWXSRLUDJVDF-AAEUAGOBSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@@H]1CCC(C)(C)C1 ZINC000261536362 135171297 /nfs/dbraw/zinc/17/12/97/135171297.db2.gz RJROZGJAIQMICC-UTUOFQBUSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1CC[C@@H]([N@H+](C)C[C@H]2CCC[NH2+]C2)C1 ZINC000261536747 135172595 /nfs/dbraw/zinc/17/25/95/135172595.db2.gz STWCNQFYYRDJCH-FRRDWIJNSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1CCC[C@@H]1C[NH2+][C@H]1CCC[NH2+]CC1 ZINC000261538312 135175602 /nfs/dbraw/zinc/17/56/02/135175602.db2.gz XRHLLWRCHKVNGJ-UPJWGTAASA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H]1CC([NH2+]C[C@H]2CCC[NH2+]2)C[C@H](C)C1 ZINC000261538227 135175781 /nfs/dbraw/zinc/17/57/81/135175781.db2.gz XMZHASAWCUCKSG-IJLUTSLNSA-N 2 0 210.365 2.153 20 0 BEADRP Cc1ccc(F)c(C[N@H+]2C[C@@H](C[NH3+])C[C@H]2C)c1 ZINC000261540999 135179745 /nfs/dbraw/zinc/17/97/45/135179745.db2.gz IEJPKAJUBJCVDZ-VXGBXAGGSA-N 2 0 236.334 2.303 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@](C)(C[NH3+])C2)c(C)c1 ZINC000261540950 135179972 /nfs/dbraw/zinc/17/99/72/135179972.db2.gz ARQZMUWYKRFGPB-OAHLLOKOSA-N 2 0 232.371 2.474 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@@H]1CCc2ccccc21 ZINC000261540967 135180349 /nfs/dbraw/zinc/18/03/49/135180349.db2.gz ASTKXPSEOHVVSF-BYCMXARLSA-N 2 0 230.355 2.262 20 0 BEADRP Cc1ccc(F)c(C[N@H+]2C[C@H](C[NH3+])C[C@H]2C)c1 ZINC000261540998 135180478 /nfs/dbraw/zinc/18/04/78/135180478.db2.gz IEJPKAJUBJCVDZ-NEPJUHHUSA-N 2 0 236.334 2.303 20 0 BEADRP Cc1cc(C[N@@H+]2CC[C@@](C)(C[NH3+])C2)ccc1F ZINC000261542089 135182717 /nfs/dbraw/zinc/18/27/17/135182717.db2.gz BSFKLTPYJBGGRB-AWEZNQCLSA-N 2 0 236.334 2.305 20 0 BEADRP C[C@@H]1CCC[C@H](C[N@@H+]2CC[C@H]3C[NH2+]C[C@@H]3C2)C1 ZINC000261552267 135191552 /nfs/dbraw/zinc/19/15/52/135191552.db2.gz MUTRJUVAGIAKIB-CBBWQLFWSA-N 2 0 236.403 2.354 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]C1CCCCC1 ZINC000084215374 135192347 /nfs/dbraw/zinc/19/23/47/135192347.db2.gz UZWDNUCEGSYSIH-AAEUAGOBSA-N 2 0 210.365 2.426 20 0 BEADRP CCC(C)(C)CC[N@@H+]1CCC[C@@H](C[NH3+])C1 ZINC000261555409 135194873 /nfs/dbraw/zinc/19/48/73/135194873.db2.gz UXAMVHGLYGSGNO-LBPRGKRZSA-N 2 0 212.381 2.483 20 0 BEADRP Cc1ccc(C[N@@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@H]3C2)c(C)c1 ZINC000261556315 135196162 /nfs/dbraw/zinc/19/61/62/135196162.db2.gz BWSNHHYCPGYUKB-HRCADAONSA-N 2 0 244.382 2.473 20 0 BEADRP C[C@@H]1COCC[C@@H]1[NH2+][C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000261558243 135198573 /nfs/dbraw/zinc/19/85/73/135198573.db2.gz DBXMRYFZEVHEII-KJEVXHAQSA-N 2 0 246.354 2.146 20 0 BEADRP C[C@@H]1CCC[C@@H](C[N@@H+]2CC[C@@]3(CC[NH2+]C3)C2)C1 ZINC000261560152 135200756 /nfs/dbraw/zinc/20/07/56/135200756.db2.gz UFZXTCGQTKOVBL-RBSFLKMASA-N 2 0 236.403 2.498 20 0 BEADRP Cc1cccc(C)c1C[N@@H+]1CC[C@@]2(CC[NH2+]C2)C1 ZINC000261561040 135201946 /nfs/dbraw/zinc/20/19/46/135201946.db2.gz FRYYUSRDJCWHSM-MRXNPFEDSA-N 2 0 244.382 2.489 20 0 BEADRP Cc1ccccc1C[N@@H+]1CC[C@H]2[NH2+]CC[C@@H]2C1 ZINC000261561680 135202481 /nfs/dbraw/zinc/20/24/81/135202481.db2.gz VPESSKODPJYVGW-HUUCEWRRSA-N 2 0 230.355 2.179 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@H]3[NH2+]CC[C@@H]3C2)c(C)c1 ZINC000261562772 135204316 /nfs/dbraw/zinc/20/43/16/135204316.db2.gz GQAOJNDEPBCGAN-HZPDHXFCSA-N 2 0 244.382 2.487 20 0 BEADRP CC1CCC(C[N@@H+]2CC[C@@]3(CC[NH2+]C3)C2)CC1 ZINC000261562894 135204778 /nfs/dbraw/zinc/20/47/78/135204778.db2.gz WRFBCNGOUAIHDE-YMAMQOFZSA-N 2 0 236.403 2.498 20 0 BEADRP C[C@@H](C[NH3+])N(C)Cc1ccccc1C(F)(F)F ZINC000261563367 135205429 /nfs/dbraw/zinc/20/54/29/135205429.db2.gz WZKIMYUHEOLYHZ-VIFPVBQESA-N 2 0 246.276 2.484 20 0 BEADRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+]C1C2CC3CC(C2)CC1C3 ZINC000261565146 135206774 /nfs/dbraw/zinc/20/67/74/135206774.db2.gz HQTBZGOZCRAUJH-YINFPWJTSA-N 2 0 248.414 2.399 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CC[NH2+]C[C@H]2C)cc1 ZINC000261567796 135209192 /nfs/dbraw/zinc/20/91/92/135209192.db2.gz FDECRWUYGUMLAU-TZMCWYRMSA-N 2 0 218.344 2.083 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CC[NH2+]C[C@@H]2C)cc1 ZINC000261567794 135209841 /nfs/dbraw/zinc/20/98/41/135209841.db2.gz FDECRWUYGUMLAU-JSGCOSHPSA-N 2 0 218.344 2.083 20 0 BEADRP Cc1ccsc1C[N@@H+]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000261568129 135210125 /nfs/dbraw/zinc/21/01/25/135210125.db2.gz FJIZEPMXSQVYJB-NWDGAFQWSA-N 2 0 236.384 2.098 20 0 BEADRP Cc1ccsc1C[N@@H+]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000261568133 135210652 /nfs/dbraw/zinc/21/06/52/135210652.db2.gz FJIZEPMXSQVYJB-VXGBXAGGSA-N 2 0 236.384 2.098 20 0 BEADRP Cc1ccsc1C[N@@H+]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000261568128 135210665 /nfs/dbraw/zinc/21/06/65/135210665.db2.gz FJIZEPMXSQVYJB-NEPJUHHUSA-N 2 0 236.384 2.098 20 0 BEADRP Cc1cccc(C[N@@H+]2CC[C@@H]3C[NH2+]C[C@@H]3C2)c1C ZINC000261569476 135211653 /nfs/dbraw/zinc/21/16/53/135211653.db2.gz JWNAPEQBXWNWAX-GDBMZVCRSA-N 2 0 244.382 2.345 20 0 BEADRP C[C@H]([NH3+])[C@H](C)[NH2+]C1CCC(C(F)(F)F)CC1 ZINC000261568935 135211704 /nfs/dbraw/zinc/21/17/04/135211704.db2.gz FZRAZBAQRLAIOS-DKEVHCRPSA-N 2 0 238.297 2.433 20 0 BEADRP COc1ccc([C@H](C)[NH2+][C@H]2CC[NH2+]C[C@@H]2C)cc1 ZINC000261571449 135213428 /nfs/dbraw/zinc/21/34/28/135213428.db2.gz LBJOXEMJARCBEZ-HUBLWGQQSA-N 2 0 248.370 2.344 20 0 BEADRP C[C@H](Cc1ccc(F)cc1)[NH2+][C@@H](C)[C@H](C)[NH3+] ZINC000261572842 135214564 /nfs/dbraw/zinc/21/45/64/135214564.db2.gz IJKRPGZGKQCBNE-VWYCJHECSA-N 2 0 224.323 2.082 20 0 BEADRP Cc1ccc(C)c(C[N@@H+]2CC[C@H]3[NH2+]CC[C@H]3C2)c1 ZINC000261574271 135215453 /nfs/dbraw/zinc/21/54/53/135215453.db2.gz MQROYXJMEJMJKV-GOEBONIOSA-N 2 0 244.382 2.487 20 0 BEADRP [NH3+][C@@H]1CC[C@@H]2C[N@H+](CC3CCCCC3)C[C@@H]12 ZINC000261574656 135216372 /nfs/dbraw/zinc/21/63/72/135216372.db2.gz JKCGDQCQVPLBHE-MGPQQGTHSA-N 2 0 222.376 2.236 20 0 BEADRP C[C@@H]1CCC[N@H+](CC[C@@H]2CC[NH2+]C2)CC1 ZINC000084385910 135218329 /nfs/dbraw/zinc/21/83/29/135218329.db2.gz VOSPQWKXVQJGNG-OLZOCXBDSA-N 2 0 210.365 2.108 20 0 BEADRP Cc1ccoc1C[NH2+][C@@H]1CCCC[C@@H]1C[NH3+] ZINC000261579552 135220339 /nfs/dbraw/zinc/22/03/39/135220339.db2.gz MHMYHGZACUBKOJ-VXGBXAGGSA-N 2 0 222.332 2.195 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@H]([NH3+])c3ccccc32)CCO1 ZINC000261580989 135221356 /nfs/dbraw/zinc/22/13/56/135221356.db2.gz QGVDSYPBTDDYBZ-HKCMKHECSA-N 2 0 246.354 2.288 20 0 BEADRP CC1CCC(C[N@@H+]2CC[C@](C)(C[NH3+])C2)CC1 ZINC000261582346 135223011 /nfs/dbraw/zinc/22/30/11/135223011.db2.gz OFQSGIOBFCROEL-JXQTWKCFSA-N 2 0 224.392 2.483 20 0 BEADRP CCOc1ccc(C[N@@H+]2CC[C@@](C)(C[NH3+])C2)cc1 ZINC000261583107 135224432 /nfs/dbraw/zinc/22/44/32/135224432.db2.gz RNQNHBDEPXEVGV-HNNXBMFYSA-N 2 0 248.370 2.256 20 0 BEADRP CC1(C)C[NH2+]CC[C@H]1[NH2+]CCOc1ccccc1 ZINC000261588010 135229192 /nfs/dbraw/zinc/22/91/92/135229192.db2.gz VIIINMWDRAYCST-CQSZACIVSA-N 2 0 248.370 2.043 20 0 BEADRP C[C@@H]1CC[C@@]2(CC[N@H+](CC(C)(C)[NH3+])C2)C1 ZINC000261589646 135229973 /nfs/dbraw/zinc/22/99/73/135229973.db2.gz UAABZOQFBFNGIW-DGCLKSJQSA-N 2 0 210.365 2.236 20 0 BEADRP Cc1cccc(C[NH2+][C@](C)(C[NH3+])C(C)C)c1 ZINC000261591389 135232014 /nfs/dbraw/zinc/23/20/14/135232014.db2.gz VELCNSHHETYFIO-CQSZACIVSA-N 2 0 220.360 2.458 20 0 BEADRP Cc1[nH+]ccc(N2C[C@@H](C[NH3+])C[C@@H]2C)c1Cl ZINC000261592000 135232894 /nfs/dbraw/zinc/23/28/94/135232894.db2.gz VQDOZLMQYSZORV-WCBMZHEXSA-N 2 0 239.750 2.217 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@@H]3C[NH2+]C[C@@H]3C2)s1 ZINC000261597506 135236579 /nfs/dbraw/zinc/23/65/79/135236579.db2.gz ZDOLFHVFOUEKDZ-VXGBXAGGSA-N 2 0 236.384 2.098 20 0 BEADRP [NH3+][C@@H]1C[C@@H]([NH2+]C[C@H]2CCSC2)c2ccccc21 ZINC000261547269 135239874 /nfs/dbraw/zinc/23/98/74/135239874.db2.gz HVTRAKQEGALVOG-LERXQTSPSA-N 2 0 248.395 2.474 20 0 BEADRP C[C@@H]1CCC[C@H](C[N@@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@@H]3C2)C1 ZINC000261547435 135240117 /nfs/dbraw/zinc/24/01/17/135240117.db2.gz IAFVTQCAASSGGK-GZBLMMOJSA-N 2 0 236.403 2.482 20 0 BEADRP CCC[N@H+](C[C@H]1C[C@@H]1C)C1CC[NH2+]CC1 ZINC000261547316 135240189 /nfs/dbraw/zinc/24/01/89/135240189.db2.gz MCHPFPOSWMXQQB-NWDGAFQWSA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@@H]1C[C@@H](C)C[N@@H+]1C[C@@]1(C)CC[NH2+]C1 ZINC000261548188 135241763 /nfs/dbraw/zinc/24/17/63/135241763.db2.gz NHHZWWZUPAFXHY-UPJWGTAASA-N 2 0 210.365 2.106 20 0 BEADRP CC1(C)CCC[N@H+](CC[C@@H]2CC[NH2+]C2)C1 ZINC000084386041 135244734 /nfs/dbraw/zinc/24/47/34/135244734.db2.gz YDABRZQDFMNXKU-LBPRGKRZSA-N 2 0 210.365 2.108 20 0 BEADRP C[C@H]1CC2(CCC2)C[N@@H+]1C[C@]1(C)CC[NH2+]C1 ZINC000261740110 135248844 /nfs/dbraw/zinc/24/88/44/135248844.db2.gz IHBACOPDXKTAJN-QWHCGFSZSA-N 2 0 222.376 2.251 20 0 BEADRP CC[N@H+](C)C[C@H]1CC[NH+](Cc2cccc(N)c2)C1 ZINC000261748580 135250051 /nfs/dbraw/zinc/25/00/51/135250051.db2.gz VYYYQCKNYHUBMZ-CQSZACIVSA-N 2 0 247.386 2.042 20 0 BEADRP Cc1ccc2cc(CN(C)[C@@H](C)C[NH3+])ccc2n1 ZINC000261805608 135254378 /nfs/dbraw/zinc/25/43/78/135254378.db2.gz HHKOJJJUKANYBR-LBPRGKRZSA-N 2 0 243.354 2.322 20 0 BEADRP C[C@@]1(C[NH3+])CC[N@@H+]([C@@H]2CCc3ccc(F)cc32)C1 ZINC000261815864 135255124 /nfs/dbraw/zinc/25/51/24/135255124.db2.gz PCMFQBMUHYHXNT-CABCVRRESA-N 2 0 248.345 2.484 20 0 BEADRP C[C@@H]1C[N@H+](CC2CC[NH2+]CC2)CC(C)(C)C1 ZINC000261829518 135256540 /nfs/dbraw/zinc/25/65/40/135256540.db2.gz IXXVULRTIVWKPG-LBPRGKRZSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@]1(C[N@@H+]2CCC[C@H]2C2CCC2)CC[NH2+]C1 ZINC000261866178 135258326 /nfs/dbraw/zinc/25/83/26/135258326.db2.gz NVPDWSBMSHJHAD-UONOGXRCSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@@]1(C[N@@H+]2CCC[C@@H]2C2CCC2)CC[NH2+]C1 ZINC000261866179 135258508 /nfs/dbraw/zinc/25/85/08/135258508.db2.gz NVPDWSBMSHJHAD-ZIAGYGMSSA-N 2 0 222.376 2.251 20 0 BEADRP CC[C@]1(C)CCC[N@H+](C[C@@]2(C)CC[NH2+]C2)C1 ZINC000261918606 135262548 /nfs/dbraw/zinc/26/25/48/135262548.db2.gz ZZFDMFIRTSZNFN-KGLIPLIRSA-N 2 0 224.392 2.498 20 0 BEADRP Cc1ccc2c(c1)C[N@@H+](CC1CC[NH2+]CC1)C2 ZINC000261937964 135264064 /nfs/dbraw/zinc/26/40/64/135264064.db2.gz MHKRPMFQUZLEIX-UHFFFAOYSA-N 2 0 230.355 2.310 20 0 BEADRP C[C@H]1C[C@H]1CN(CC[NH3+])Cc1ccccc1 ZINC000261943960 135264937 /nfs/dbraw/zinc/26/49/37/135264937.db2.gz NDDYWENBQGVLOO-JSGCOSHPSA-N 2 0 218.344 2.103 20 0 BEADRP CC[C@@H]1CCC[C@H](C[N@H+]2C[C@H]([NH3+])[C@@H](C)C2)C1 ZINC000261961713 135266959 /nfs/dbraw/zinc/26/69/59/135266959.db2.gz HJGBMLNDKDXVHO-CRWXNKLISA-N 2 0 224.392 2.482 20 0 BEADRP CC[N@H+](C[C@H]1CCSC1)[C@@H]1CCC[NH2+]CC1 ZINC000261995538 135270644 /nfs/dbraw/zinc/27/06/44/135270644.db2.gz SULOQBLFOQKYPQ-CHWSQXEVSA-N 2 0 242.432 2.204 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@@H]2CCC[NH2+]C2)CC12CCC2 ZINC000262012353 135271958 /nfs/dbraw/zinc/27/19/58/135271958.db2.gz VEJYUCKSNDTXOY-ZIAGYGMSSA-N 2 0 236.403 2.498 20 0 BEADRP COc1cc(C[NH+]2CCC(C[NH3+])CC2)ccc1C ZINC000262006590 135272262 /nfs/dbraw/zinc/27/22/62/135272262.db2.gz URZKTCLIWYVWAR-UHFFFAOYSA-N 2 0 248.370 2.174 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@@]2(C)CC[NH2+]C2)C[C@@H](C)C1 ZINC000262018974 135273359 /nfs/dbraw/zinc/27/33/59/135273359.db2.gz MZAIOAJVQDWRDN-RDBSUJKOSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H]1Cc2ccccc2C[N@@H+]1C[C@]1(C)CC[NH2+]C1 ZINC000262118911 135279561 /nfs/dbraw/zinc/27/95/61/135279561.db2.gz XDZSNOYQAKZAKZ-CZUORRHYSA-N 2 0 244.382 2.433 20 0 BEADRP CC(C)(C)[C@H]1CCC[N@@H+]1C[C@@]1(C)CC[NH2+]C1 ZINC000262110976 135279854 /nfs/dbraw/zinc/27/98/54/135279854.db2.gz WKHVMTRERXNDMK-OCCSQVGLSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[N@@H+]1CC[C@]2(CC[NH2+]C2)C1 ZINC000262122204 135280661 /nfs/dbraw/zinc/28/06/61/135280661.db2.gz XJDGNGXMHKAPOG-KFWWJZLASA-N 2 0 236.403 2.498 20 0 BEADRP C[C@@H]1SCCN(CC[NH3+])[C@H]1c1ccccc1 ZINC000262952179 135324616 /nfs/dbraw/zinc/32/46/16/135324616.db2.gz JTWNYDGYAHEMCB-WCQYABFASA-N 2 0 236.384 2.124 20 0 BEADRP CCC(CC)C[N@H+]1C[C@@H]2[NH2+]CCC[C@H]2C1 ZINC000299893312 135381402 /nfs/dbraw/zinc/38/14/02/135381402.db2.gz KBMZFPYRLFLGLF-STQMWFEESA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCc2nc[nH]c2C1)c1nccs1 ZINC000334404859 135393512 /nfs/dbraw/zinc/39/35/12/135393512.db2.gz HBJLATHWPZMGEK-RKDXNWHRSA-N 2 0 248.355 2.074 20 0 BEADRP C[C@]1(C[N@@H+]2CCC[C@H]3CCC[C@@H]32)CC[NH2+]C1 ZINC000083701577 135455726 /nfs/dbraw/zinc/45/57/26/135455726.db2.gz OQVPWCOLWYBJOC-RDBSUJKOSA-N 2 0 222.376 2.251 20 0 BEADRP FC1(F)CCC[C@@H](C[NH2+]C2CC[NH2+]CC2)C1 ZINC000335023580 135879862 /nfs/dbraw/zinc/87/98/62/135879862.db2.gz SCHAPCOVRDISKW-SNVBAGLBSA-N 2 0 232.318 2.154 20 0 BEADRP C[C@H]1CCCC[C@H]1[NH2+]CC1=CC[NH2+]CC1 ZINC000335061434 135885997 /nfs/dbraw/zinc/88/59/97/135885997.db2.gz TZPALTRFODUKGT-WCQYABFASA-N 2 0 208.349 2.074 20 0 BEADRP C[C@H]1CCCN1Cc1ncc(CN(C)C)s1 ZINC000347769790 136008763 /nfs/dbraw/zinc/00/87/63/136008763.db2.gz HUTJQQALAJXTSH-JTQLQIEISA-N 2 0 239.388 2.189 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H]2C[C@H]2C(F)F)CC1 ZINC000348150421 136039842 /nfs/dbraw/zinc/03/98/42/136039842.db2.gz LCECRWBWFKUZHI-MNOVXSKESA-N 2 0 232.318 2.104 20 0 BEADRP C[C@@H]1CCCC[C@H]1C[N@H+](C)C1CC[NH2+]CC1 ZINC000335336880 136044352 /nfs/dbraw/zinc/04/43/52/136044352.db2.gz VNOOMWHPTMTKEF-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1CCCC[C@@H]1C[N@H+](C)C1CC[NH2+]CC1 ZINC000335336881 136044423 /nfs/dbraw/zinc/04/44/23/136044423.db2.gz VNOOMWHPTMTKEF-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP Cc1cnc([C@@H](C)[NH+]2CCC3(CC[NH2+]C3)CC2)o1 ZINC000335393399 136091647 /nfs/dbraw/zinc/09/16/47/136091647.db2.gz COXZQCCTHSQQLN-GFCCVEGCSA-N 2 0 249.358 2.120 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+]CC2C[NH2+]C2)c2ccccc21 ZINC000335551938 136098453 /nfs/dbraw/zinc/09/84/53/136098453.db2.gz LNJGAAHTZOCBNH-XHDPSFHLSA-N 2 0 230.355 2.434 20 0 BEADRP CC1(C)C[C@@H]([NH2+]CC2C[NH2+]C2)c2ccccc21 ZINC000335553519 136098646 /nfs/dbraw/zinc/09/86/46/136098646.db2.gz ZPXZLZHIXTXTJW-CQSZACIVSA-N 2 0 230.355 2.218 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]C1CC(c2ccccc2)C1 ZINC000335562405 136106702 /nfs/dbraw/zinc/10/67/02/136106702.db2.gz VZMNMPHSWGCCRV-NEXFUWMNSA-N 2 0 230.355 2.402 20 0 BEADRP Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3NCC[NH3+] ZINC000335563631 136106922 /nfs/dbraw/zinc/10/69/22/136106922.db2.gz GSRLYANSNMMYEA-AWEZNQCLSA-N 2 0 243.354 2.402 20 0 BEADRP C[C@@H]([NH2+]C1CC[NH2+]CC1)C1C(C)(C)C1(C)C ZINC000335571088 136109881 /nfs/dbraw/zinc/10/98/81/136109881.db2.gz ZEIXZJZOPXXSCM-SNVBAGLBSA-N 2 0 224.392 2.399 20 0 BEADRP C[NH2+]C[C@@H]1C[C@H](F)CN1C[C@H](C)C(C)(C)C ZINC000647540548 397782461 /nfs/dbraw/zinc/78/24/61/397782461.db2.gz ZRDHJTGCQQGMCN-SRVKXCTJSA-N 2 0 230.371 2.300 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@H]1CCSc2ccccc21 ZINC000309254520 397854994 /nfs/dbraw/zinc/85/49/94/397854994.db2.gz AFHWYLJEXYVGQC-JQWIXIFHSA-N 2 0 236.384 2.408 20 0 BEADRP C[C@@H](C[NH3+])C[NH2+][C@@H]1CCSc2ccccc21 ZINC000309254517 397855332 /nfs/dbraw/zinc/85/53/32/397855332.db2.gz AFHWYLJEXYVGQC-CMPLNLGQSA-N 2 0 236.384 2.408 20 0 BEADRP CN(C)c1cccc(C[NH2+][C@H]2CCC[C@H]([NH3+])C2)c1 ZINC000517177190 397939787 /nfs/dbraw/zinc/93/97/87/397939787.db2.gz XEMNFEMXOPJOBN-KBPBESRZSA-N 2 0 247.386 2.112 20 0 BEADRP C[C@H]1CCC[C@H](CC[N@H+](C)CCC[NH3+])C1 ZINC000390477606 397891195 /nfs/dbraw/zinc/89/11/95/397891195.db2.gz LJEXWSGWVJYGOE-QWHCGFSZSA-N 2 0 212.381 2.483 20 0 BEADRP CC(C)C[C@H](C)[N@@H+]1CC[C@H](C[NH+](C)C)C1 ZINC000355693239 397918113 /nfs/dbraw/zinc/91/81/13/397918113.db2.gz VBYXETRAMKOWCI-QWHCGFSZSA-N 2 0 212.381 2.305 20 0 BEADRP C[C@H]([NH2+]CCC[NH+]1CCCC1)[C@H]1CCCCO1 ZINC000383087826 397998876 /nfs/dbraw/zinc/99/88/76/397998876.db2.gz KPPLKLDYCSGGMG-UONOGXRCSA-N 2 0 240.391 2.020 20 0 BEADRP COc1cccc([C@@H]2CCC[N@@H+]2CCC[NH3+])c1 ZINC000414676912 398015955 /nfs/dbraw/zinc/01/59/55/398015955.db2.gz IEHATUYDDRQZQE-AWEZNQCLSA-N 2 0 234.343 2.181 20 0 BEADRP CCc1ccc(C[N@@H+]2CC[C@@](C)(C[NH3+])C2)cc1 ZINC000234157748 398023536 /nfs/dbraw/zinc/02/35/36/398023536.db2.gz NMSLLMBMAWXMKV-HNNXBMFYSA-N 2 0 232.371 2.420 20 0 BEADRP CSC1(C[NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)CCC1 ZINC000193801953 398029297 /nfs/dbraw/zinc/02/92/97/398029297.db2.gz HGZFGNLTYXVSTL-VXGBXAGGSA-N 2 0 242.432 2.344 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]CC1(CO)CCCCC1 ZINC000383620584 398031107 /nfs/dbraw/zinc/03/11/07/398031107.db2.gz VBWHVTSZABVCRE-CYBMUJFWSA-N 2 0 242.407 2.036 20 0 BEADRP Cc1cc(C)cc(C[N@@H+]2CCC[C@@H](C[NH3+])C2)c1 ZINC000038076856 397973643 /nfs/dbraw/zinc/97/36/43/397973643.db2.gz DKLFHWFQAIVQTC-AWEZNQCLSA-N 2 0 232.371 2.474 20 0 BEADRP CC(C)[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000414858846 398066031 /nfs/dbraw/zinc/06/60/31/398066031.db2.gz SPZPIOXXLOHYNH-HZSPNIEDSA-N 2 0 224.392 2.400 20 0 BEADRP CCSCC[C@H](C)[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000222254375 398095610 /nfs/dbraw/zinc/09/56/10/398095610.db2.gz MNLBAAQZLANUKR-TUAOUCFPSA-N 2 0 230.421 2.378 20 0 BEADRP C[C@@H](Cc1ccoc1)[NH2+][C@@H]1CCN(CC2CC2)C1 ZINC000648450098 398051883 /nfs/dbraw/zinc/05/18/83/398051883.db2.gz SWHOBRNZFHQSHL-SWLSCSKDSA-N 2 0 248.370 2.285 20 0 BEADRP CCC(CC)(CC)[NH2+]C[C@@H](O)C[N@H+](C)C(C)C ZINC000383923122 398052593 /nfs/dbraw/zinc/05/25/93/398052593.db2.gz DEKYVQSOYWXSTI-CYBMUJFWSA-N 2 0 244.423 2.246 20 0 BEADRP CC[C@@H]1CCC[C@@H]([NH2+]C[C@H](C)C[NH2+]C)C1 ZINC000414850673 398057653 /nfs/dbraw/zinc/05/76/53/398057653.db2.gz ZRHRAXXISDCTKD-JHJVBQTASA-N 2 0 212.381 2.400 20 0 BEADRP CCOc1cccc(C[NH2+][C@@H]2CC[NH2+][C@@H](C)C2)c1 ZINC000414945751 398121222 /nfs/dbraw/zinc/12/12/22/398121222.db2.gz IVAQVSYJIRENHS-GXTWGEPZSA-N 2 0 248.370 2.315 20 0 BEADRP CC[C@@H]([NH2+]CCC[NH+](C)C)[C@H]1CC1(C)C ZINC000397674533 398121273 /nfs/dbraw/zinc/12/12/73/398121273.db2.gz GSHPHXDCJJDEFW-VXGBXAGGSA-N 2 0 212.381 2.352 20 0 BEADRP COc1ccc(C)cc1C[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000414932465 398111826 /nfs/dbraw/zinc/11/18/26/398111826.db2.gz VTQYHCCQCTUQAW-ZIAGYGMSSA-N 2 0 248.370 2.363 20 0 BEADRP CC[C@H]1C[N@H+](CC2(C)CCC2)CC[C@@H]1[NH3+] ZINC000389693481 398125432 /nfs/dbraw/zinc/12/54/32/398125432.db2.gz IFOAPNIPAXYCBQ-RYUDHWBXSA-N 2 0 210.365 2.236 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCCC[C@@H]1CC(C)C ZINC000336709860 173347460 /nfs/dbraw/zinc/34/74/60/173347460.db2.gz RJCYTJNUVDBYIC-CYBMUJFWSA-N 2 0 212.381 2.497 20 0 BEADRP CC(C)[NH2+]C1CC[NH+](C[C@@H]2CCSC2)CC1 ZINC000336675029 167095637 /nfs/dbraw/zinc/09/56/37/167095637.db2.gz PDTRCWWOCSJMJZ-LBPRGKRZSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1ccccc1 ZINC000258632719 322875654 /nfs/dbraw/zinc/87/56/54/322875654.db2.gz DBRYBGPBRLSUSX-OLZOCXBDSA-N 2 0 218.344 2.337 20 0 BEADRP CSc1ccc(C[NH2+]C[C@H](C)C[NH3+])cc1 ZINC000258767601 322877620 /nfs/dbraw/zinc/87/76/20/322877620.db2.gz NUIHAMTVDYLACZ-SNVBAGLBSA-N 2 0 224.373 2.093 20 0 BEADRP Fc1ccc(C[NH2+]CC[C@@H]2CC[NH2+]C2)cc1F ZINC000258873257 322879142 /nfs/dbraw/zinc/87/91/42/322879142.db2.gz AWRCYKZGMMGOMD-JTQLQIEISA-N 2 0 240.297 2.054 20 0 BEADRP Cc1cc(C[NH2+]CC[C@H]2CC[NH2+]C2)ccc1F ZINC000258975517 322880268 /nfs/dbraw/zinc/88/02/68/322880268.db2.gz KPQDWGYTCILFFA-GFCCVEGCSA-N 2 0 236.334 2.223 20 0 BEADRP Fc1cccc(C[NH2+]CC[C@H]2CCC[NH2+]C2)c1 ZINC000259004129 322881078 /nfs/dbraw/zinc/88/10/78/322881078.db2.gz MPYGACCUKSEFAF-GFCCVEGCSA-N 2 0 236.334 2.305 20 0 BEADRP Cc1ccc(F)c(C[NH2+][C@H]2CCC[C@H]([NH3+])C2)c1 ZINC000334843194 487569786 /nfs/dbraw/zinc/56/97/86/487569786.db2.gz CSVWNXPCSNRFEN-STQMWFEESA-N 2 0 236.334 2.494 20 0 BEADRP Cc1cc(F)ccc1C[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000334843088 487570276 /nfs/dbraw/zinc/57/02/76/487570276.db2.gz BGMFTFAXTLQPJN-UONOGXRCSA-N 2 0 236.334 2.494 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CCC[NH+]2CCCCC2)CS1 ZINC000086934483 487590779 /nfs/dbraw/zinc/59/07/79/487590779.db2.gz XAKSNOVJLZIJKD-STQMWFEESA-N 2 0 242.432 2.346 20 0 BEADRP CC1CCC([NH2+][C@@H]2CC[C@H]3C[N@H+](C)C[C@@H]32)CC1 ZINC001651698334 1172976469 /nfs/dbraw/zinc/97/64/69/1172976469.db2.gz VIELEPHZLKWKGJ-NNVWEFMASA-N 2 0 236.403 2.495 20 0 BEADRP Cc1ccccc1C[NH2+][C@@H]1CC[C@H]2C[N@@H+](C)C[C@@H]21 ZINC001651697439 1172977945 /nfs/dbraw/zinc/97/79/45/1172977945.db2.gz AACROSYEHBDTJL-HRCADAONSA-N 2 0 244.382 2.425 20 0 BEADRP CC[C@@H]1CC[C@@H](C)[N@H+](C[C@@H]2CC[NH2+]C2)C1 ZINC000308965245 487601946 /nfs/dbraw/zinc/60/19/46/487601946.db2.gz LYJNKKINJOAFMZ-JHJVBQTASA-N 2 0 210.365 2.106 20 0 BEADRP COCC[C@H](C)[N@H+](C)CC[C@H]1CCCC[NH+]1C ZINC000531780035 487602326 /nfs/dbraw/zinc/60/23/26/487602326.db2.gz ZEBCUCWWHIPQQA-UONOGXRCSA-N 2 0 242.407 2.218 20 0 BEADRP CC[NH+]1CCC(C[N@@H+]2CC[C@H](C3CC3)C2)CC1 ZINC001651862627 1172996204 /nfs/dbraw/zinc/99/62/04/1172996204.db2.gz LCKHSBVJOQYORZ-HNNXBMFYSA-N 2 0 236.403 2.450 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]2C[N@H+](CC3CC=CC3)C[C@@H]21 ZINC000662265074 409560218 /nfs/dbraw/zinc/56/02/18/409560218.db2.gz FUCICWBUZLRUSN-MELADBBJSA-N 2 0 220.360 2.012 20 0 BEADRP C([C@@H]1CCC[NH2+]C1)[N@@H+]1CCC[C@@H](C2CCC2)C1 ZINC000662318400 409636795 /nfs/dbraw/zinc/63/67/95/409636795.db2.gz ZQUHWOWGAVSRIQ-UKRRQHHQSA-N 2 0 236.403 2.498 20 0 BEADRP CO[C@@H](C[NH+]1CCC(C)([NH3+])CC1)c1ccccc1 ZINC000662270479 409572747 /nfs/dbraw/zinc/57/27/47/409572747.db2.gz LKQOTXFGGWENRV-AWEZNQCLSA-N 2 0 248.370 2.187 20 0 BEADRP CC(C)=CCC[N@H+]1CC[C@H](C)[C@@H](C[NH3+])C1 ZINC000662282666 409608089 /nfs/dbraw/zinc/60/80/89/409608089.db2.gz PRRMRGUIPJKGAF-STQMWFEESA-N 2 0 210.365 2.259 20 0 BEADRP C[NH+]1CCC(CC[NH2+][C@H]2CCC[C@@H]3C[C@@H]32)CC1 ZINC000383373642 487614296 /nfs/dbraw/zinc/61/42/96/487614296.db2.gz ZGSLAQCFDIVPMJ-ILXRZTDVSA-N 2 0 236.403 2.497 20 0 BEADRP CC1(C)CC[C@H]1[NH2+]CCC1CC[NH2+]CC1 ZINC000309049754 410209154 /nfs/dbraw/zinc/20/91/54/410209154.db2.gz OWPQQJZMUKLBBB-GFCCVEGCSA-N 2 0 210.365 2.154 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+][C@H]1CCO[C@H](C(C)C)C1 ZINC000663498385 410275879 /nfs/dbraw/zinc/27/58/79/410275879.db2.gz BJLOIJJDMLCQQE-MJBXVCDLSA-N 2 0 242.407 2.153 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+][C@H](C)CC1CCOCC1 ZINC000663503028 410277549 /nfs/dbraw/zinc/27/75/49/410277549.db2.gz MBSNHJKZVXGATB-TZMCWYRMSA-N 2 0 242.407 2.155 20 0 BEADRP C[C@@H]1CCC[C@@H](C[NH2+]CC23CC(C2)C[NH2+]3)C1 ZINC000663501526 410278286 /nfs/dbraw/zinc/27/82/86/410278286.db2.gz XJXPHQPFQHGPPL-IWMBGFJWSA-N 2 0 222.376 2.154 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]Cc1cccc2c1CCC2 ZINC000650704294 410335511 /nfs/dbraw/zinc/33/55/11/410335511.db2.gz RSQRWMLHKAZJRZ-NWDGAFQWSA-N 2 0 232.371 2.391 20 0 BEADRP [NH3+]C[C@H]1CC[C@H]([NH2+]Cc2cccc3c2CCC3)C1 ZINC000650704035 410336189 /nfs/dbraw/zinc/33/61/89/410336189.db2.gz DBMOAMQBONXWCU-WFASDCNBSA-N 2 0 244.382 2.392 20 0 BEADRP Cc1ccccc1C[NH2+]CCC1(C[NH3+])CC1 ZINC000650711916 410343217 /nfs/dbraw/zinc/34/32/17/410343217.db2.gz IYGBJRWMXAIQTH-UHFFFAOYSA-N 2 0 218.344 2.214 20 0 BEADRP [NH3+]CC1(CC[NH2+]C/C=C\c2ccccc2)CC1 ZINC000650712499 410343304 /nfs/dbraw/zinc/34/33/04/410343304.db2.gz GOKATNWQEYGGFS-DAXSKMNVSA-N 2 0 230.355 2.418 20 0 BEADRP [NH3+]CC1(CC[NH2+][C@@H]2CCc3ccccc3C2)CC1 ZINC000650713933 410345807 /nfs/dbraw/zinc/34/58/07/410345807.db2.gz JIZNYTMUZWTRAQ-OAHLLOKOSA-N 2 0 244.382 2.263 20 0 BEADRP C[C@@H](CCC1CC1)[NH2+]CCC1(C[NH3+])CC1 ZINC000650714054 410347662 /nfs/dbraw/zinc/34/76/62/410347662.db2.gz OZXNTHATEYDQEK-NSHDSACASA-N 2 0 210.365 2.284 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCC2CC[NH+](C)CC2)CS1 ZINC000125129266 410314421 /nfs/dbraw/zinc/31/44/21/410314421.db2.gz SWPDCWRXWNGRKM-DGCLKSJQSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@H]1CCC[C@@H]1[NH2+]CCC1CC[NH2+]CC1 ZINC000650763551 410415345 /nfs/dbraw/zinc/41/53/45/410415345.db2.gz DFYWMQMVOHJZRL-AAEUAGOBSA-N 2 0 210.365 2.154 20 0 BEADRP C[NH2+]Cc1ccccc1C[NH2+]Cc1cncs1 ZINC000650719453 410358542 /nfs/dbraw/zinc/35/85/42/410358542.db2.gz QOVGGVUOPJZTNG-UHFFFAOYSA-N 2 0 247.367 2.152 20 0 BEADRP Cc1ccccc1[C@@H]1C[C@H]1[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000650741405 410372293 /nfs/dbraw/zinc/37/22/93/410372293.db2.gz CUKBGVUOELRRAB-TUKIKUTGSA-N 2 0 230.355 2.048 20 0 BEADRP [NH3+]CC1(CC[NH2+][C@@H]2CCc3ccccc32)CC1 ZINC000650742985 410377202 /nfs/dbraw/zinc/37/72/02/410377202.db2.gz JSDSNTSBNRAERD-CQSZACIVSA-N 2 0 230.355 2.393 20 0 BEADRP C[C@@H]([NH2+]CCC1(C[NH3+])CC1)c1ccco1 ZINC000650743036 410377310 /nfs/dbraw/zinc/37/73/10/410377310.db2.gz KVWAIMWGKPFLTD-SNVBAGLBSA-N 2 0 208.305 2.059 20 0 BEADRP C[C@H](CCc1ccco1)[NH2+]CCC1(C[NH3+])CC1 ZINC000650743604 410377690 /nfs/dbraw/zinc/37/76/90/410377690.db2.gz XJAZLUZBTHPWFA-GFCCVEGCSA-N 2 0 236.359 2.319 20 0 BEADRP Cc1ccncc1[C@@H](C)[NH2+]CCC1(C[NH3+])CC1 ZINC000650745244 410380782 /nfs/dbraw/zinc/38/07/82/410380782.db2.gz CDDVBVUJROATFJ-GFCCVEGCSA-N 2 0 233.359 2.170 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+]CCC2(C[NH3+])CC2)c(C)n1 ZINC000650746085 410384547 /nfs/dbraw/zinc/38/45/47/410384547.db2.gz VVIFTABRIDGKHG-GFCCVEGCSA-N 2 0 247.386 2.478 20 0 BEADRP C[C@H]([NH2+]CCC1(C[NH3+])CC1)[C@H]1CC1(C)C ZINC000650747093 410385554 /nfs/dbraw/zinc/38/55/54/410385554.db2.gz RIVUZJKZRLYNLB-WDEREUQCSA-N 2 0 210.365 2.140 20 0 BEADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H]1C[C@@H](C)O[C@@H]1C ZINC000650755227 410402547 /nfs/dbraw/zinc/40/25/47/410402547.db2.gz AEWGBRONGJPPCY-LALPHHSUSA-N 2 0 248.370 2.062 20 0 BEADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H]1C[C@H](C)O[C@H]1C ZINC000650755228 410402944 /nfs/dbraw/zinc/40/29/44/410402944.db2.gz AEWGBRONGJPPCY-SLEUVZQESA-N 2 0 248.370 2.062 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)C(C)(C)C ZINC000650760428 410407864 /nfs/dbraw/zinc/40/78/64/410407864.db2.gz CVGDWUYQCLWXQT-FDYHWXHSSA-N 2 0 224.392 2.399 20 0 BEADRP CC[C@H]1CC[C@@H]1[NH2+]CCC1CC[NH2+]CC1 ZINC000650761626 410410675 /nfs/dbraw/zinc/41/06/75/410410675.db2.gz FLWCMOUJPQTWBA-STQMWFEESA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]([NH2+]CCC1CC[NH2+]CC1)[C@H]1CC1(C)C ZINC000650762874 410412125 /nfs/dbraw/zinc/41/21/25/410412125.db2.gz MRFIMEGAQMAPPK-DGCLKSJQSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@@H]([NH2+]CCC1CC[NH2+]CC1)c1cncs1 ZINC000650764217 410413956 /nfs/dbraw/zinc/41/39/56/410413956.db2.gz SZLLSGUDYPEXDA-SNVBAGLBSA-N 2 0 239.388 2.183 20 0 BEADRP COc1ccc(CC[NH+]2CCC(C)([NH3+])CC2)cc1 ZINC000071563575 410458653 /nfs/dbraw/zinc/45/86/53/410458653.db2.gz YCTWEFODWROMKO-UHFFFAOYSA-N 2 0 248.370 2.051 20 0 BEADRP C[C@H](CCNc1[nH+]ccc2[nH]ccc21)[NH+](C)C ZINC000664243353 410528313 /nfs/dbraw/zinc/52/83/13/410528313.db2.gz DXQVRDXBDAGKKO-SNVBAGLBSA-N 2 0 232.331 2.315 20 0 BEADRP CCC[C@@H](C[NH2+][C@H](C)C1CC[NH+](C)CC1)OC ZINC000393534672 410746475 /nfs/dbraw/zinc/74/64/75/410746475.db2.gz ZTKXEPJIFKLVAQ-OCCSQVGLSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H](C[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccccn1 ZINC000665232166 410724157 /nfs/dbraw/zinc/72/41/57/410724157.db2.gz HIQKTUMRMPOXRR-ICIURTGMSA-N 2 0 245.370 2.058 20 0 BEADRP C[C@H](C[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccccn1 ZINC000665232165 410725037 /nfs/dbraw/zinc/72/50/37/410725037.db2.gz HIQKTUMRMPOXRR-HABKJSAYSA-N 2 0 245.370 2.058 20 0 BEADRP CC[C@H]([NH2+]CC[C@@H]([NH3+])C(C)C)[C@@H]1C[C@H]1C ZINC000665282972 410762737 /nfs/dbraw/zinc/76/27/37/410762737.db2.gz FNTZTUVXHNWLQV-LPWJVIDDSA-N 2 0 212.381 2.384 20 0 BEADRP CC[C@H]([NH2+]CC[C@@H]([NH3+])C(C)C)[C@H]1C[C@H]1C ZINC000665282974 410764243 /nfs/dbraw/zinc/76/42/43/410764243.db2.gz FNTZTUVXHNWLQV-XQHKEYJVSA-N 2 0 212.381 2.384 20 0 BEADRP C[NH2+]C[C@H](C)[NH2+][C@H]1CCC[C@@H](c2cccnc2)C1 ZINC000665297725 410816829 /nfs/dbraw/zinc/81/68/29/410816829.db2.gz KJFZKWOTYPAQDX-GUTXKFCHSA-N 2 0 247.386 2.305 20 0 BEADRP C[NH2+]C[C@H](C)N[C@@H](C)c1sc(C)nc1C ZINC000665295678 410801144 /nfs/dbraw/zinc/80/11/44/410801144.db2.gz HQJSOVCGUFLJRX-YUMQZZPRSA-N 2 0 227.377 2.018 20 0 BEADRP C[NH+](C)CCCC(C)(C)[NH2+]Cc1nccs1 ZINC000395742678 410863350 /nfs/dbraw/zinc/86/33/50/410863350.db2.gz VTWFCPFOKHLWFF-UHFFFAOYSA-N 2 0 241.404 2.353 20 0 BEADRP C[NH2+]C[C@H](C)[NH2+][C@H](C)C1CCC(F)(F)CC1 ZINC000665297597 410818901 /nfs/dbraw/zinc/81/89/01/410818901.db2.gz IVZIECRZLJHAKU-VHSXEESVSA-N 2 0 234.334 2.398 20 0 BEADRP CC(C)C[NH2+]C[C@@H](C)C[NH+]1CCCCC1 ZINC000037997563 167004187 /nfs/dbraw/zinc/00/41/87/167004187.db2.gz HOFOWIJJLBUOSF-CYBMUJFWSA-N 2 0 212.381 2.354 20 0 BEADRP CC(C)C[NH2+]CC[C@@H](C)[NH+]1CCCCC1 ZINC000052421359 167004783 /nfs/dbraw/zinc/00/47/83/167004783.db2.gz QDGAPFQKFSIART-CYBMUJFWSA-N 2 0 212.381 2.497 20 0 BEADRP CC(C)[NH2+]C1CC[NH+](C[C@H]2CCSC2)CC1 ZINC000336675028 167094716 /nfs/dbraw/zinc/09/47/16/167094716.db2.gz PDTRCWWOCSJMJZ-GFCCVEGCSA-N 2 0 242.432 2.202 20 0 BEADRP CC(C)C[C@H]1CCC[N@@H+]1C[C@H]1CC[NH2+]C1 ZINC000396981340 410908933 /nfs/dbraw/zinc/90/89/33/410908933.db2.gz UKGKWMKVRJBXAG-QWHCGFSZSA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)OCCC[N@@H+]1CCC[C@@H]([NH+](C)C)CC1 ZINC000365402016 167211188 /nfs/dbraw/zinc/21/11/88/167211188.db2.gz IJHXWXXPGJHLTB-CQSZACIVSA-N 2 0 242.407 2.218 20 0 BEADRP CC(C)SCC[NH2+][C@H](C)CCCC[NH3+] ZINC000336680789 167332917 /nfs/dbraw/zinc/33/29/17/167332917.db2.gz GXBBJASVXVOPAO-LLVKDONJSA-N 2 0 218.410 2.235 20 0 BEADRP CC(C)[C@@H](C)C[NH2+][C@@H](C)CCCC[NH3+] ZINC000308637291 167362179 /nfs/dbraw/zinc/36/21/79/167362179.db2.gz BKDBDQRAXGTSCX-RYUDHWBXSA-N 2 0 200.370 2.386 20 0 BEADRP CCC[C@@H](C[NH2+]C1CCC([NH+](C)C)CC1)OC ZINC000651373026 410957907 /nfs/dbraw/zinc/95/79/07/410957907.db2.gz LBULIRMVCIQSEO-RUXDESIVSA-N 2 0 242.407 2.264 20 0 BEADRP CCC1([NH2+][C@H](C)C2CC[NH+](C)CC2)CC1 ZINC000651396577 410978341 /nfs/dbraw/zinc/97/83/41/410978341.db2.gz OCAXTLLDDUHUDX-LLVKDONJSA-N 2 0 210.365 2.249 20 0 BEADRP Cc1ncccc1CNCCC[N@@H+](C)CC(C)C ZINC000651866164 411147829 /nfs/dbraw/zinc/14/78/29/411147829.db2.gz XIUJJYWGJDZTIU-UHFFFAOYSA-N 2 0 249.402 2.458 20 0 BEADRP CC(C)C[N@H+](C)CCCNCC1(F)CC1 ZINC000651866051 411147998 /nfs/dbraw/zinc/14/79/98/411147998.db2.gz RYCUOPMDKIPYMC-UHFFFAOYSA-N 2 0 216.344 2.056 20 0 BEADRP CC(C)CC[N@H+](C[C@@H]1CCC[NH2+]C1)C1CC1 ZINC000109279759 411149910 /nfs/dbraw/zinc/14/99/10/411149910.db2.gz PKVUPVBJRDBEKP-CYBMUJFWSA-N 2 0 224.392 2.497 20 0 BEADRP CC[N@H+](C)C[C@H]1CC[NH+](CC2CC=CC2)C1 ZINC000659989852 411158093 /nfs/dbraw/zinc/15/80/93/411158093.db2.gz UYRFLLUYSIKYGV-CQSZACIVSA-N 2 0 222.376 2.226 20 0 BEADRP C[C@H](c1ccccn1)N1CC2CCC1(C[NH3+])CC2 ZINC000655942643 411161312 /nfs/dbraw/zinc/16/13/12/411161312.db2.gz WPMPAYMTRDBGOB-DNOWBOINSA-N 2 0 245.370 2.346 20 0 BEADRP C[C@H]([NH3+])C1CC[NH+]([C@@H](C)c2ccncc2)CC1 ZINC000110643845 411113196 /nfs/dbraw/zinc/11/31/96/411113196.db2.gz OOFAFFHNQDKINQ-RYUDHWBXSA-N 2 0 233.359 2.202 20 0 BEADRP CC(F)(F)CCC[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000401001310 411168257 /nfs/dbraw/zinc/16/82/57/411168257.db2.gz MVYAOBOTJQVJIB-SDDRHHMPSA-N 2 0 246.345 2.400 20 0 BEADRP C1=C(C[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)CCCC1 ZINC000401003410 411168605 /nfs/dbraw/zinc/16/86/05/411168605.db2.gz AINFASIROIJZHX-SOUVJXGZSA-N 2 0 234.387 2.465 20 0 BEADRP C[C@H](C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)C1CC1 ZINC000400993549 411168664 /nfs/dbraw/zinc/16/86/64/411168664.db2.gz ZPDMTCIWMVTUJI-RUZUBIRVSA-N 2 0 222.376 2.010 20 0 BEADRP COC[C@H](CC(C)(C)C)[NH2+]C[C@@H](C)C[NH+](C)C ZINC000652201030 411171105 /nfs/dbraw/zinc/17/11/05/411171105.db2.gz RFWRLBNXXAWREZ-OLZOCXBDSA-N 2 0 244.423 2.225 20 0 BEADRP Cc1cccc(C[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)c1 ZINC000401032036 411173477 /nfs/dbraw/zinc/17/34/77/411173477.db2.gz XEZUYHWMWVSQFI-BZUAXINKSA-N 2 0 244.382 2.473 20 0 BEADRP C[N@@H+]1CCC[C@@H]2C[NH+](C[C@@H]3C[C@H]4C[C@H]4C3)CC[C@H]21 ZINC000660012296 411173832 /nfs/dbraw/zinc/17/38/32/411173832.db2.gz SQHRIZRNLLIPMM-IBEHDNSVSA-N 2 0 248.414 2.449 20 0 BEADRP CC(C)[C@H](C)[NH2+][C@@H]1CCN(C(C)(C)C)C1 ZINC000658091076 411242729 /nfs/dbraw/zinc/24/27/29/411242729.db2.gz KTLYZRCSZTUTCP-NWDGAFQWSA-N 2 0 212.381 2.493 20 0 BEADRP Fc1cccc(C[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)c1 ZINC000401079154 411176113 /nfs/dbraw/zinc/17/61/13/411176113.db2.gz QGNJIKCVTASXTH-GZBFAFLISA-N 2 0 248.345 2.303 20 0 BEADRP c1cc(C[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)cs1 ZINC000401082185 411176700 /nfs/dbraw/zinc/17/67/00/411176700.db2.gz SEPBEUKJVCOPMO-FRRDWIJNSA-N 2 0 236.384 2.226 20 0 BEADRP Cc1ccoc1C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000401120731 411177801 /nfs/dbraw/zinc/17/78/01/411177801.db2.gz JINJAUSTJQXHJH-RWMBFGLXSA-N 2 0 234.343 2.066 20 0 BEADRP CCC(CC)[N@H+](C[C@@H]1CC[NH2+]C1)C1CC1 ZINC000310035435 411194127 /nfs/dbraw/zinc/19/41/27/411194127.db2.gz TYJGDFKUSZDNHQ-LLVKDONJSA-N 2 0 210.365 2.249 20 0 BEADRP COC[C@@H](CC(C)(C)C)[NH2+]C1CCC([NH3+])CC1 ZINC000656193376 411198260 /nfs/dbraw/zinc/19/82/60/411198260.db2.gz IJORDUUFJXDZHT-WXRRBKDZSA-N 2 0 242.407 2.297 20 0 BEADRP C[C@@H](C[NH2+][C@H]1CCCSCC1)C[NH+](C)C ZINC000658018451 411198432 /nfs/dbraw/zinc/19/84/32/411198432.db2.gz QSYPHZIEBYZAJB-RYUDHWBXSA-N 2 0 230.421 2.059 20 0 BEADRP COC[C@@H](CC(C)(C)C)[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000656193730 411200027 /nfs/dbraw/zinc/20/00/27/411200027.db2.gz QSLCSFGWEBBFLN-CHWSQXEVSA-N 2 0 242.407 2.169 20 0 BEADRP CCOC1CC(CC[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)C1 ZINC000656198658 411203060 /nfs/dbraw/zinc/20/30/60/411203060.db2.gz BVIUKVDUMYHSMH-CEUNDQEZSA-N 2 0 240.391 2.051 20 0 BEADRP COc1c(C)cccc1CN[C@@H](C)[C@H]1CC[NH2+]C1 ZINC000656201312 411206198 /nfs/dbraw/zinc/20/61/98/411206198.db2.gz VGRQSIDQNNCPRC-STQMWFEESA-N 2 0 248.370 2.091 20 0 BEADRP COc1c(C)cccc1CN[C@@H](C)[C@H]1CCC[NH2+]1 ZINC000656201407 411206405 /nfs/dbraw/zinc/20/64/05/411206405.db2.gz WYLGIZXXYWMVBW-GXTWGEPZSA-N 2 0 248.370 2.234 20 0 BEADRP CC[C@H]([NH2+][C@@H](C)CCCC[NH3+])[C@H]1CCCCO1 ZINC000656201850 411207183 /nfs/dbraw/zinc/20/71/83/411207183.db2.gz SYTYIFAYVBMHQY-MELADBBJSA-N 2 0 242.407 2.441 20 0 BEADRP CC[C@H]([NH2+][C@H](C)CCCC[NH3+])[C@H]1CCCCO1 ZINC000656201847 411207557 /nfs/dbraw/zinc/20/75/57/411207557.db2.gz SYTYIFAYVBMHQY-HZSPNIEDSA-N 2 0 242.407 2.441 20 0 BEADRP C[N@H+](CCOC(C)(C)C)CC[C@H]1CCC[NH2+]C1 ZINC000652343745 411208052 /nfs/dbraw/zinc/20/80/52/411208052.db2.gz RMDVGQGBGUWJTF-CYBMUJFWSA-N 2 0 242.407 2.123 20 0 BEADRP CCCC[N@@H+]1CCC[C@H]([C@H]2C[C@@H]([NH3+])CCO2)C1 ZINC000652346353 411209009 /nfs/dbraw/zinc/20/90/09/411209009.db2.gz ZOZVRFAJZHSLEW-MELADBBJSA-N 2 0 240.391 2.005 20 0 BEADRP CC[C@H](C)[N@@H+]1CCC[C@H]([C@@H]2C[C@@H]([NH3+])CCO2)C1 ZINC000652349533 411210943 /nfs/dbraw/zinc/21/09/43/411210943.db2.gz ROOFPXFKPUEHRV-XUXIUFHCSA-N 2 0 240.391 2.003 20 0 BEADRP CC[C@H](C)[N@@H+]1CCC[C@H]([C@H]2C[C@H]([NH3+])CCO2)C1 ZINC000652349531 411211037 /nfs/dbraw/zinc/21/10/37/411211037.db2.gz ROOFPXFKPUEHRV-IGQOVBAYSA-N 2 0 240.391 2.003 20 0 BEADRP CC(C)OCCC[N@@H+]1CCC[C@H](C)[C@@H]1CC[NH3+] ZINC000652355010 411214461 /nfs/dbraw/zinc/21/44/61/411214461.db2.gz MRFVCJVZZFABEV-KBPBESRZSA-N 2 0 242.407 2.251 20 0 BEADRP CC(C)OCCC[N@@H+]1CCC[C@@H](C)[C@@H]1CC[NH3+] ZINC000652355011 411214961 /nfs/dbraw/zinc/21/49/61/411214961.db2.gz MRFVCJVZZFABEV-KGLIPLIRSA-N 2 0 242.407 2.251 20 0 BEADRP Cc1c[nH+]ccc1N[C@H]1CCC[N@@H+]2CCCC[C@@H]12 ZINC000656226291 411215161 /nfs/dbraw/zinc/21/51/61/411215161.db2.gz LPYMHMQMSGUQNE-GJZGRUSLSA-N 2 0 245.370 2.241 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]CCC(C)(C)C)C1 ZINC000656269765 411220330 /nfs/dbraw/zinc/22/03/30/411220330.db2.gz UKLBBLPXBSVOHH-TXEJJXNPSA-N 2 0 212.381 2.352 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@H](C)c2ccccn2)CC1 ZINC000658062564 411228510 /nfs/dbraw/zinc/22/85/10/411228510.db2.gz ODVPMLKKGGFYID-ZDUSSCGKSA-N 2 0 247.386 2.259 20 0 BEADRP Cc1noc(C)c1[C@@H](C)[NH2+][C@H](C)CCCC[NH3+] ZINC000310262094 411231516 /nfs/dbraw/zinc/23/15/16/411231516.db2.gz MBBFHFCYCIFFBL-NXEZZACHSA-N 2 0 239.363 2.460 20 0 BEADRP Cc1noc(C)c1[C@@H](C)[NH2+][C@@H](C)CCCC[NH3+] ZINC000310262096 411232009 /nfs/dbraw/zinc/23/20/09/411232009.db2.gz MBBFHFCYCIFFBL-VHSXEESVSA-N 2 0 239.363 2.460 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+]CCCOC1CCCC1 ZINC000422826966 411232825 /nfs/dbraw/zinc/23/28/25/411232825.db2.gz MDDJJZSOVJBEPB-LBPRGKRZSA-N 2 0 228.380 2.053 20 0 BEADRP Cc1nc([C@H](C)[NH2+][C@H](C)CCC[NH3+])cs1 ZINC000422883428 411233122 /nfs/dbraw/zinc/23/31/22/411233122.db2.gz BZNHQZSFVBYZER-BDAKNGLRSA-N 2 0 227.377 2.230 20 0 BEADRP C[C@@H]([NH2+]CC1(c2ccc(F)cc2)CC1)C1C[NH2+]C1 ZINC000422905153 411233161 /nfs/dbraw/zinc/23/31/61/411233161.db2.gz YQXGYNGOJDXEPV-LLVKDONJSA-N 2 0 248.345 2.055 20 0 BEADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CCCOC1CCCC1 ZINC000422827474 411233895 /nfs/dbraw/zinc/23/38/95/411233895.db2.gz MZNRJNUXAGGTCV-VXGBXAGGSA-N 2 0 228.380 2.051 20 0 BEADRP Cc1ccc(C[C@H]([NH2+]CC2C[NH2+]C2)C2CC2)cc1 ZINC000423306722 411237363 /nfs/dbraw/zinc/23/73/63/411237363.db2.gz UJYLOPMWJQFMBL-INIZCTEOSA-N 2 0 244.382 2.125 20 0 BEADRP CC(C)[C@H]1CCCC[C@H]1[NH2+]CC1C[NH2+]C1 ZINC000423307025 411238015 /nfs/dbraw/zinc/23/80/15/411238015.db2.gz UZKLMJWBWFGPAN-CHWSQXEVSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@H](C[NH3+])C[NH2+][C@H]1CCC[C@H](c2cccnc2)C1 ZINC000423307127 411238756 /nfs/dbraw/zinc/23/87/56/411238756.db2.gz MMZLZRVGLLBHLI-IPYPFGDCSA-N 2 0 247.386 2.292 20 0 BEADRP CC(C)[C@H]1CCCC[C@@H]1[NH2+]CC1C[NH2+]C1 ZINC000423307026 411238762 /nfs/dbraw/zinc/23/87/62/411238762.db2.gz UZKLMJWBWFGPAN-OLZOCXBDSA-N 2 0 210.365 2.010 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CCC[NH+]2CCCC2)CS1 ZINC000655694861 411239810 /nfs/dbraw/zinc/23/98/10/411239810.db2.gz HUFTVEBDYQFHOE-OLZOCXBDSA-N 2 0 242.432 2.346 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000400880759 411165626 /nfs/dbraw/zinc/16/56/26/411165626.db2.gz ANEQHHFHHSUBPN-RKQHYHRCSA-N 2 0 222.376 2.010 20 0 BEADRP CC(C)(C)C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000400950689 411166783 /nfs/dbraw/zinc/16/67/83/411166783.db2.gz WSIAIMFTLBWUHO-SDDRHHMPSA-N 2 0 210.365 2.010 20 0 BEADRP C1=CC[C@H]([NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)CC1 ZINC000400979965 411167097 /nfs/dbraw/zinc/16/70/97/411167097.db2.gz RGRKSZYPNXMZPY-XDQVBPFNSA-N 2 0 220.360 2.073 20 0 BEADRP C1=CC[C@H]([NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)CC1 ZINC000400979967 411167547 /nfs/dbraw/zinc/16/75/47/411167547.db2.gz RGRKSZYPNXMZPY-ZOBORPQBSA-N 2 0 220.360 2.073 20 0 BEADRP CCC1(C[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)CC1 ZINC000400977167 411167869 /nfs/dbraw/zinc/16/78/69/411167869.db2.gz PSEMTKIPPOVMGM-RWMBFGLXSA-N 2 0 222.376 2.154 20 0 BEADRP C[N@H+](C[C@H]1CC[NH2+]C1)CC1CCCCC1 ZINC000051889668 411285899 /nfs/dbraw/zinc/28/58/99/411285899.db2.gz OTRFTXIJRNRZPT-ZDUSSCGKSA-N 2 0 210.365 2.108 20 0 BEADRP c1csc(C[N@@H+](C[C@H]2CC[NH2+]C2)C2CC2)c1 ZINC000051890052 411285932 /nfs/dbraw/zinc/28/59/32/411285932.db2.gz ZCGUHTVAPDNOIP-NSHDSACASA-N 2 0 236.384 2.322 20 0 BEADRP CC(C)C[NH+](CC(C)C)C[C@@H]1CC[NH2+]C1 ZINC000051889593 411285983 /nfs/dbraw/zinc/28/59/83/411285983.db2.gz NFJJCXRWLCVPEW-CYBMUJFWSA-N 2 0 212.381 2.210 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CCC2CC[NH2+]CC2)C1 ZINC000129416949 411286289 /nfs/dbraw/zinc/28/62/89/411286289.db2.gz QWSNTJRAVYOGRX-YPMHNXCESA-N 2 0 210.365 2.154 20 0 BEADRP CCC1(C)CC[NH+](C[C@H]2CC[NH2+]C2)CC1 ZINC000062954021 411329032 /nfs/dbraw/zinc/32/90/32/411329032.db2.gz WLYHSVGLBNEZRW-LBPRGKRZSA-N 2 0 210.365 2.108 20 0 BEADRP CCC[NH+]1CCC([NH2+]CCc2ccoc2)CC1 ZINC000658196479 411289693 /nfs/dbraw/zinc/28/96/93/411289693.db2.gz BDPNKMRMPIDBNO-UHFFFAOYSA-N 2 0 236.359 2.286 20 0 BEADRP C[C@@H]([NH2+]C[C@@]1(C)CC1(F)F)C1CC[NH+](C)CC1 ZINC000658217297 411296581 /nfs/dbraw/zinc/29/65/81/411296581.db2.gz FXIDYWJEBMWCRN-ZYHUDNBSSA-N 2 0 246.345 2.352 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@@]2(C)CC2(F)F)CC[N@@H+]1C ZINC000658218631 411298324 /nfs/dbraw/zinc/29/83/24/411298324.db2.gz KJLQNQYKDFGRCZ-GMTAPVOTSA-N 2 0 232.318 2.104 20 0 BEADRP CC[NH+]1CCC([NH2+]C[C@@H]2CCC[C@@H](C)O2)CC1 ZINC000658222932 411302412 /nfs/dbraw/zinc/30/24/12/411302412.db2.gz YSVTXOAIFXPLRQ-OCCSQVGLSA-N 2 0 240.391 2.018 20 0 BEADRP C[C@@H](c1ccccn1)[N@@H+]1C[C@@H]2CCC[C@]2(C[NH3+])C1 ZINC000402865055 411319573 /nfs/dbraw/zinc/31/95/73/411319573.db2.gz HORZNFLBPSRGMN-YDHLFZDLSA-N 2 0 245.370 2.203 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]CC2=CCCC2)[C@@H](C)C1 ZINC000658292655 411325894 /nfs/dbraw/zinc/32/58/94/411325894.db2.gz FSUIYMCXJKBWPT-GXTWGEPZSA-N 2 0 222.376 2.417 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC[C@H](C)SC1)C[NH+](C)C ZINC000655769879 411252008 /nfs/dbraw/zinc/25/20/08/411252008.db2.gz RFKTVQZBYLBNNF-WOPDTQHZSA-N 2 0 230.421 2.058 20 0 BEADRP CC1CC([NH2+]CC2CC[NH+](CC3CC3)CC2)C1 ZINC000658352924 411356103 /nfs/dbraw/zinc/35/61/03/411356103.db2.gz ADCAKLVVTHVUOJ-UHFFFAOYSA-N 2 0 236.403 2.497 20 0 BEADRP FC1(C[N@@H+]2CCC[C@H](C3CC[NH2+]CC3)C2)CC1 ZINC000656782550 411359716 /nfs/dbraw/zinc/35/97/16/411359716.db2.gz HKGKKZPZPDNPCO-ZDUSSCGKSA-N 2 0 240.366 2.200 20 0 BEADRP CC[N@@H+]1CC[C@@H]([NH2+]Cc2cccc(N)c2)[C@H](C)C1 ZINC000656785303 411359727 /nfs/dbraw/zinc/35/97/27/411359727.db2.gz NCSWBHUFVCBKCT-IUODEOHRSA-N 2 0 247.386 2.089 20 0 BEADRP C[C@@H](C[NH2+]C1CCC(C[NH3+])CC1)c1ccccn1 ZINC000656783363 411359934 /nfs/dbraw/zinc/35/99/34/411359934.db2.gz PXILKUNQNPBPFK-HSBZDZAISA-N 2 0 247.386 2.292 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]Cc2cccc(N)c2)[C@@H](C)C1 ZINC000656785308 411360487 /nfs/dbraw/zinc/36/04/87/411360487.db2.gz NCSWBHUFVCBKCT-WFASDCNBSA-N 2 0 247.386 2.089 20 0 BEADRP CC1(C[NH+]2CCC([C@@H]3CCC[NH2+]C3)CC2)CC1 ZINC000656786103 411364038 /nfs/dbraw/zinc/36/40/38/411364038.db2.gz KMNFGKRXEWZAOS-CQSZACIVSA-N 2 0 236.403 2.498 20 0 BEADRP C[C@H](c1ccncc1)[N@@H+]1C[C@@H]2CCC[C@H]([NH3+])[C@@H]2C1 ZINC000125348709 411364214 /nfs/dbraw/zinc/36/42/14/411364214.db2.gz QMCRWCQNUWMDCQ-BEAPCOKYSA-N 2 0 245.370 2.202 20 0 BEADRP C[C@]1(C[NH+]2CCC(C3CCC3)CC2)CC[NH2+]C1 ZINC000656787570 411366511 /nfs/dbraw/zinc/36/65/11/411366511.db2.gz NQPNJYNTFXBFOL-HNNXBMFYSA-N 2 0 236.403 2.498 20 0 BEADRP C[C@@]1(C[NH+]2CCC(c3ccco3)CC2)CC[NH2+]C1 ZINC000656787914 411367162 /nfs/dbraw/zinc/36/71/62/411367162.db2.gz YYRYOMDWJNPONT-OAHLLOKOSA-N 2 0 248.370 2.459 20 0 BEADRP C[C@H]1CC(C)(C)CC[C@@H]1[NH2+][C@H]1CC[NH2+]C1 ZINC000656788231 411367585 /nfs/dbraw/zinc/36/75/85/411367585.db2.gz XTTFRFQIQSMPEX-SRVKXCTJSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H](CC1CCC1)[NH2+]CC1([NH3+])CCCC1 ZINC000656789376 411368651 /nfs/dbraw/zinc/36/86/51/411368651.db2.gz NOHYHQRJRQVNLF-LLVKDONJSA-N 2 0 210.365 2.426 20 0 BEADRP C[C@@H](CC1CCC1)[NH2+]CC1([NH3+])CCCC1 ZINC000656789377 411369332 /nfs/dbraw/zinc/36/93/32/411369332.db2.gz NOHYHQRJRQVNLF-NSHDSACASA-N 2 0 210.365 2.426 20 0 BEADRP C[C@@H]1C[C@@H](C[N@@H+]2CCC[C@H](CCF)C2)CC[NH2+]1 ZINC000656790832 411370038 /nfs/dbraw/zinc/37/00/38/411370038.db2.gz BITBVESPENEHOB-MCIONIFRSA-N 2 0 242.382 2.446 20 0 BEADRP [NH3+]CCC[N@@H+]1CC[C@H](C2CCCCC2)C1 ZINC000656790635 411371139 /nfs/dbraw/zinc/37/11/39/411371139.db2.gz FQLXAUVCVXEVES-ZDUSSCGKSA-N 2 0 210.365 2.237 20 0 BEADRP [NH3+]C1(C[NH2+][C@H]2CCc3ccccc3C2)CCCC1 ZINC000656789680 411371239 /nfs/dbraw/zinc/37/12/39/411371239.db2.gz VFHDCAIZDWBXJP-HNNXBMFYSA-N 2 0 244.382 2.405 20 0 BEADRP FCC[C@H]1CCC[N@H+](CC2CC[NH2+]CC2)C1 ZINC000656791805 411371659 /nfs/dbraw/zinc/37/16/59/411371659.db2.gz KHGRUQIYHTUUFF-GFCCVEGCSA-N 2 0 228.355 2.058 20 0 BEADRP C[N@@H+]1CCCC[C@@H]1CC[NH+]1CC[C@@H]2C[C@@H]2C1 ZINC000661975813 411342463 /nfs/dbraw/zinc/34/24/63/411342463.db2.gz STSGPHTUINADRB-MGPQQGTHSA-N 2 0 222.376 2.203 20 0 BEADRP CC1(C[NH+]2CCC3(CC[NH2+]C3)CC2)CCC1 ZINC000336298032 168023158 /nfs/dbraw/zinc/02/31/58/168023158.db2.gz YPPZDIDBXRSCDG-UHFFFAOYSA-N 2 0 222.376 2.252 20 0 BEADRP CC1(C[NH2+]C2CCCCC2)CC[NH2+]CC1 ZINC000062841747 168041019 /nfs/dbraw/zinc/04/10/19/168041019.db2.gz VIVLCULITCZTDQ-UHFFFAOYSA-N 2 0 210.365 2.298 20 0 BEADRP CC1(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)CC1 ZINC000300359373 168045303 /nfs/dbraw/zinc/04/53/03/168045303.db2.gz OVMULWGSSVCFKN-NEPJUHHUSA-N 2 0 208.349 2.003 20 0 BEADRP CC1([NH2+]C[C@@H]2CCC[NH2+]C2)CCCCC1 ZINC000045047232 168063082 /nfs/dbraw/zinc/06/30/82/168063082.db2.gz GWSHLHJRPRAEQB-GFCCVEGCSA-N 2 0 210.365 2.298 20 0 BEADRP CC1([NH2+]Cc2ccc(F)cc2)CC[NH2+]CC1 ZINC000334840184 168063254 /nfs/dbraw/zinc/06/32/54/168063254.db2.gz AOWCZLHUTFODFF-UHFFFAOYSA-N 2 0 222.307 2.057 20 0 BEADRP CC1CCC(C[N@@H+]2CC[C@@H]([NH3+])[C@H](C)C2)CC1 ZINC000063145741 168154035 /nfs/dbraw/zinc/15/40/35/168154035.db2.gz MKTSOJLVKAKZHW-FKZOYECMSA-N 2 0 224.392 2.482 20 0 BEADRP C[C@H]1CN(C)C[C@@H]1[NH2+]C1CCC(C)CC1 ZINC000336751638 168165255 /nfs/dbraw/zinc/16/52/55/168165255.db2.gz GODSGZHAAVXPRL-MVKMKZAISA-N 2 0 210.365 2.105 20 0 BEADRP CC1CCC([NH2+][C@H]2CCCN(C)C2)CC1 ZINC000040671725 168165497 /nfs/dbraw/zinc/16/54/97/168165497.db2.gz GBLIKIJJPZYQAK-BPCQOVAHSA-N 2 0 210.365 2.249 20 0 BEADRP C[NH+](C)CC(C)(C)C[NH2+][C@H]1CCOC(C)(C)C1 ZINC000070343393 411389943 /nfs/dbraw/zinc/38/99/43/411389943.db2.gz UCNONAAIXFYNGV-LBPRGKRZSA-N 2 0 242.407 2.121 20 0 BEADRP CC[C@H]1C[C@H]([NH2+]CCC[NH+](CC)CC)CCO1 ZINC000070344707 411391449 /nfs/dbraw/zinc/39/14/49/411391449.db2.gz DJJDPTRXGMARQR-KGLIPLIRSA-N 2 0 242.407 2.266 20 0 BEADRP CC[C@H]1C[C@H]([NH2+]CCC[NH+]2CCCC2)CCO1 ZINC000070346243 411391902 /nfs/dbraw/zinc/39/19/02/411391902.db2.gz CIONQECJLPLYPO-KGLIPLIRSA-N 2 0 240.391 2.020 20 0 BEADRP CCC(C)(C)CC[N@@H+]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000357075964 168276058 /nfs/dbraw/zinc/27/60/58/168276058.db2.gz JNKMEHOBIWIRMS-CHWSQXEVSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H]1CCC[N@H+](CCc2cccnc2)[C@H]1CC[NH3+] ZINC000404278377 411387485 /nfs/dbraw/zinc/38/74/85/411387485.db2.gz CFKZIHIIIGFBKE-HIFRSBDPSA-N 2 0 247.386 2.073 20 0 BEADRP C[C@@H]1CCC[N@H+](Cc2ccncc2)[C@H]1CC[NH3+] ZINC000404275700 411387502 /nfs/dbraw/zinc/38/75/02/411387502.db2.gz APSIPQYDZYADKL-OCCSQVGLSA-N 2 0 233.359 2.031 20 0 BEADRP C[C@@H]1CCC[N@H+](Cc2ccncc2)[C@@H]1CC[NH3+] ZINC000404275701 411387736 /nfs/dbraw/zinc/38/77/36/411387736.db2.gz APSIPQYDZYADKL-TZMCWYRMSA-N 2 0 233.359 2.031 20 0 BEADRP CC[C@H]1C[C@@H]([NH2+]CCC[NH+]2CCCC2)CCO1 ZINC000070346245 411392059 /nfs/dbraw/zinc/39/20/59/411392059.db2.gz CIONQECJLPLYPO-KBPBESRZSA-N 2 0 240.391 2.020 20 0 BEADRP CC(C)COCC[N@@H+]1CCC[C@@H](C)[C@@H]1CC[NH3+] ZINC000404406128 411394126 /nfs/dbraw/zinc/39/41/26/411394126.db2.gz UZLWCNFQDNEXNM-KGLIPLIRSA-N 2 0 242.407 2.108 20 0 BEADRP Cc1ccc(C[N@H+]2CCC[C@H](C)[C@@H]2CC[NH3+])nc1 ZINC000404407991 411394289 /nfs/dbraw/zinc/39/42/89/411394289.db2.gz AZRWPCPQFPQRID-ZFWWWQNUSA-N 2 0 247.386 2.339 20 0 BEADRP Cc1ccncc1C[N@H+]1CCC[C@@H](C)[C@@H]1CC[NH3+] ZINC000404410476 411395613 /nfs/dbraw/zinc/39/56/13/411395613.db2.gz CESGPANJFKOMOZ-HIFRSBDPSA-N 2 0 247.386 2.339 20 0 BEADRP Cc1ccc(C[N@H+]2CCC[C@@H](C)[C@@H]2CC[NH3+])cn1 ZINC000404431441 411396142 /nfs/dbraw/zinc/39/61/42/411396142.db2.gz OTYRJTZEUWDYRR-DOMZBBRYSA-N 2 0 247.386 2.339 20 0 BEADRP CC[N@H+](CC[C@@H]1CCC[NH2+]C1)CC(C)C ZINC000051918974 169873037 /nfs/dbraw/zinc/87/30/37/169873037.db2.gz LAXQYNPOHZWJJC-ZDUSSCGKSA-N 2 0 212.381 2.354 20 0 BEADRP C[C@@H]1C[C@@H](C[N@H+](C)C(C2CC2)C2CC2)CC[NH2+]1 ZINC000414689750 411439893 /nfs/dbraw/zinc/43/98/93/411439893.db2.gz GVFHWZLLHGMGDN-NEPJUHHUSA-N 2 0 236.403 2.495 20 0 BEADRP CC[C@@H]1C[C@@H]([NH2+]C2CC[NH+](C(C)C)CC2)CO1 ZINC000657294091 411450040 /nfs/dbraw/zinc/45/00/40/411450040.db2.gz CYUSROVXKNZVOY-ZIAGYGMSSA-N 2 0 240.391 2.016 20 0 BEADRP c1cc(C[NH2+]CCC2CC2)n(-c2cc[nH+]cc2)n1 ZINC000657379269 411486842 /nfs/dbraw/zinc/48/68/42/411486842.db2.gz SAJICXJTBXTREH-UHFFFAOYSA-N 2 0 242.326 2.157 20 0 BEADRP COC1CCC([NH2+][C@H](C)CCCC[NH3+])CC1 ZINC000415011683 411488176 /nfs/dbraw/zinc/48/81/76/411488176.db2.gz HURKXOLOWWYBDE-PNESKVBLSA-N 2 0 228.380 2.051 20 0 BEADRP C[C@H](C[NH2+]CC(C)(C)[NH3+])Cc1cccs1 ZINC000415088256 411491020 /nfs/dbraw/zinc/49/10/20/411491020.db2.gz VZQMFTGAKOXOFY-JTQLQIEISA-N 2 0 226.389 2.254 20 0 BEADRP CC[NH+]1CCC(CC[NH2+][C@@H](C)CCOC)CC1 ZINC000121806222 169951264 /nfs/dbraw/zinc/95/12/64/169951264.db2.gz DFDXMFZVGAUKSF-ZDUSSCGKSA-N 2 0 242.407 2.123 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@@H]2CCCSC2)CC1 ZINC000061589310 169952106 /nfs/dbraw/zinc/95/21/06/169952106.db2.gz SBZKIGNIDABVMO-CYBMUJFWSA-N 2 0 242.432 2.204 20 0 BEADRP CC[NH+]1CCC(C[NH+]2CCC(C)CC2)CC1 ZINC000360220859 169952319 /nfs/dbraw/zinc/95/23/19/169952319.db2.gz ADQNBRCHGBHTCL-UHFFFAOYSA-N 2 0 224.392 2.450 20 0 BEADRP CC[C@H]1C[C@H]([NH2+]C2CCC([NH+](C)C)CC2)CO1 ZINC000657493465 411534277 /nfs/dbraw/zinc/53/42/77/411534277.db2.gz DIRPNJUYQCOAOH-YIOUJQMASA-N 2 0 240.391 2.016 20 0 BEADRP C([C@H]1CC[N@H+](C[C@@H]2C[C@H]3C[C@H]3C2)C1)[NH+]1CCCC1 ZINC000659949029 411508497 /nfs/dbraw/zinc/50/84/97/411508497.db2.gz UDPRPRAZKXFNKQ-LVQVYYBASA-N 2 0 248.414 2.450 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)CS1 ZINC000655802676 411518906 /nfs/dbraw/zinc/51/89/06/411518906.db2.gz HIJHTYAWBLWDGZ-NDBYEHHHSA-N 2 0 242.432 2.200 20 0 BEADRP C[C@H]1CC[C@@H]1[NH2+]Cc1ccnn1-c1cc[nH+]cc1 ZINC000657466223 411519014 /nfs/dbraw/zinc/51/90/14/411519014.db2.gz QWOJIRFPIZWXSX-FZMZJTMJSA-N 2 0 242.326 2.155 20 0 BEADRP C[C@H](CCC1CC1)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655804426 411519061 /nfs/dbraw/zinc/51/90/61/411519061.db2.gz YLPRHKXNZFKFCW-BNOWGMLFSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H](CC1CC1)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655805451 411519297 /nfs/dbraw/zinc/51/92/97/411519297.db2.gz HLVGIHRAPVJAOU-RTXFEEFZSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1nccs1 ZINC000655805378 411519438 /nfs/dbraw/zinc/51/94/38/411519438.db2.gz MVDNBKPSSVJHTA-GARJFASQSA-N 2 0 239.388 2.134 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H]2CC[C@H]2C2CCC2)C1 ZINC000655804428 411519518 /nfs/dbraw/zinc/51/95/18/411519518.db2.gz YNUXHNCBTRZEDL-ATGSNQNLSA-N 2 0 236.403 2.495 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H]2CCCC2(C)C)C1 ZINC000655805106 411519601 /nfs/dbraw/zinc/51/96/01/411519601.db2.gz BXSMNWXNIVHQPV-FRRDWIJNSA-N 2 0 224.392 2.495 20 0 BEADRP CC[C@H]1CCC[C@@H]1[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655805415 411519631 /nfs/dbraw/zinc/51/96/31/411519631.db2.gz NLPWLSHHLDTFQR-FQUUOJAGSA-N 2 0 224.392 2.495 20 0 BEADRP C[C@H]1CC[C@@H]([NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)C1 ZINC000655805875 411520311 /nfs/dbraw/zinc/52/03/11/411520311.db2.gz MRQDEJNWCYPTPE-WUHRBBMRSA-N 2 0 210.365 2.105 20 0 BEADRP CCC[C@@H](CC)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655805978 411520356 /nfs/dbraw/zinc/52/03/56/411520356.db2.gz VQVOUUTWRXWSIX-UPJWGTAASA-N 2 0 212.381 2.495 20 0 BEADRP CC[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)C(C)C ZINC000655807249 411521042 /nfs/dbraw/zinc/52/10/42/411521042.db2.gz IZOMRBSJOWUPQZ-FRRDWIJNSA-N 2 0 212.381 2.351 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]C2CCCCC2)C1 ZINC000655807319 411521454 /nfs/dbraw/zinc/52/14/54/411521454.db2.gz KHLRCGZBSZEPNU-BJHJDKERSA-N 2 0 210.365 2.249 20 0 BEADRP Cc1ccc(C[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)o1 ZINC000655826074 411525384 /nfs/dbraw/zinc/52/53/84/411525384.db2.gz PLPXGAJMMGAHKR-TXEJJXNPSA-N 2 0 222.332 2.018 20 0 BEADRP C1=CCC(C[NH+]2CCN(c3cc[nH+]cc3)CC2)C1 ZINC000660003208 411526243 /nfs/dbraw/zinc/52/62/43/411526243.db2.gz GUJNLAMAVUEZJY-UHFFFAOYSA-N 2 0 243.354 2.170 20 0 BEADRP CC(C)CCC[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655826021 411527343 /nfs/dbraw/zinc/52/73/43/411527343.db2.gz COWNLOZKOSFJSG-BETUJISGSA-N 2 0 212.381 2.352 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]Cc2ccc(F)cc2)C1 ZINC000655826399 411529662 /nfs/dbraw/zinc/52/96/62/411529662.db2.gz UXECUXGQKTZZIO-XBXGTLAGSA-N 2 0 236.334 2.256 20 0 BEADRP c1nc2n(c1C[NH2+][C@H](C1CC1)C1CCC1)CCC2 ZINC000657486988 411530575 /nfs/dbraw/zinc/53/05/75/411530575.db2.gz FABKBJIQEHLESH-HNNXBMFYSA-N 2 0 245.370 2.498 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cccc(O)c2)C1 ZINC000037644096 170008281 /nfs/dbraw/zinc/00/82/81/170008281.db2.gz DBVQTCPPJBSYMT-STQMWFEESA-N 2 0 248.370 2.385 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+]C2CCC(C)CC2)C1 ZINC000037484173 170008326 /nfs/dbraw/zinc/00/83/26/170008326.db2.gz PITVDHRDZDCJRZ-MOKVOYLWSA-N 2 0 224.392 2.497 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(OC)cc2)C1 ZINC000037643745 170015835 /nfs/dbraw/zinc/01/58/35/170015835.db2.gz HFYVBKZQCLMAQM-CQSZACIVSA-N 2 0 248.370 2.127 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+]C[C@@H]2CC=CCC2)C1 ZINC000224996949 170015914 /nfs/dbraw/zinc/01/59/14/170015914.db2.gz MHZUPRZVHCWLDL-ZIAGYGMSSA-N 2 0 222.376 2.274 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H]2CCC23CCC3)C1 ZINC000309953721 170016261 /nfs/dbraw/zinc/01/62/61/170016261.db2.gz HIKPEQRBDDCSHZ-OLZOCXBDSA-N 2 0 222.376 2.251 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CCCC[C@@H]2C)C1 ZINC000037484182 170016698 /nfs/dbraw/zinc/01/66/98/170016698.db2.gz SHRLFQISWGSLBP-BFHYXJOUSA-N 2 0 224.392 2.497 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]C2CC(F)(F)C2)[C@@H](C)C1 ZINC000309676851 170020517 /nfs/dbraw/zinc/02/05/17/170020517.db2.gz YBGGHOUPZHIMMU-ONGXEEELSA-N 2 0 232.318 2.104 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]C[C@@H]2CC2(C)C)[C@H](C)C1 ZINC000309426292 170021353 /nfs/dbraw/zinc/02/13/53/170021353.db2.gz FIFFYMMZZJRRNB-AGIUHOORSA-N 2 0 224.392 2.352 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H]2CC[C@@H](C)C2)[C@@H](C)C1 ZINC000309620837 170022250 /nfs/dbraw/zinc/02/22/50/170022250.db2.gz FFNHLSVBHCUBBS-RQJABVFESA-N 2 0 224.392 2.495 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H]2CC[C@H](F)C2)[C@@H](C)C1 ZINC000336778105 170022264 /nfs/dbraw/zinc/02/22/64/170022264.db2.gz KIXGLWUAOLWXGN-RVMXOQNASA-N 2 0 228.355 2.197 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H]2CCC2(C)C)[C@@H](C)C1 ZINC000336778036 170022438 /nfs/dbraw/zinc/02/24/38/170022438.db2.gz KFTMDVOLWASZIW-RWMBFGLXSA-N 2 0 224.392 2.495 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H]2CC[C@H](C)C2)[C@H](C)C1 ZINC000309620833 170022808 /nfs/dbraw/zinc/02/28/08/170022808.db2.gz FFNHLSVBHCUBBS-DGAVXFQQSA-N 2 0 224.392 2.495 20 0 BEADRP CC[NH2+]CC1CC[NH+](CCCCCF)CC1 ZINC000304313772 170110966 /nfs/dbraw/zinc/11/09/66/170110966.db2.gz BHGVLAUGDIOBHT-UHFFFAOYSA-N 2 0 230.371 2.448 20 0 BEADRP CC[NH2+]CC1CC[NH+](C[C@H]2CCSC2)CC1 ZINC000224620425 170111796 /nfs/dbraw/zinc/11/17/96/170111796.db2.gz XVHYIUVEKDSMDO-CYBMUJFWSA-N 2 0 242.432 2.061 20 0 BEADRP CC[NH2+]CC1CC[NH+](C[C@@H](C)CC)CC1 ZINC000053659214 170111877 /nfs/dbraw/zinc/11/18/77/170111877.db2.gz LPNHWZKMWKWBPD-LBPRGKRZSA-N 2 0 212.381 2.354 20 0 BEADRP CC[NH2+]CC1CC[NH+]([C@H](C)c2ccncc2)CC1 ZINC000131498708 411546291 /nfs/dbraw/zinc/54/62/91/411546291.db2.gz KLHCEEVUOHHJIE-CYBMUJFWSA-N 2 0 247.386 2.464 20 0 BEADRP CCOCCC[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000121651794 170371567 /nfs/dbraw/zinc/37/15/67/170371567.db2.gz PJHJEZNIZVLGKO-UHFFFAOYSA-N 2 0 242.407 2.077 20 0 BEADRP c1cc(C[NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)c[nH]1 ZINC000663344975 411633290 /nfs/dbraw/zinc/63/32/90/411633290.db2.gz DIJDVEXQYUAAJG-OAHLLOKOSA-N 2 0 247.386 2.226 20 0 BEADRP C([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)C1CC1 ZINC000663347069 411634289 /nfs/dbraw/zinc/63/42/89/411634289.db2.gz YWUIKBXVRYDWCM-CQSZACIVSA-N 2 0 222.376 2.108 20 0 BEADRP C[N@H+](CCC[NH+]1CCCC1)C[C@@H]1C[C@H]2C[C@H]2C1 ZINC000660463392 411588667 /nfs/dbraw/zinc/58/86/67/411588667.db2.gz CCMWCVMGJSAEDO-QDMKHBRRSA-N 2 0 236.403 2.450 20 0 BEADRP c1ncn2c1CN([C@H]1C[C@H]1c1ccccc1)CC2 ZINC000660582577 411602977 /nfs/dbraw/zinc/60/29/77/411602977.db2.gz WDCJQBYWCOBRGP-GJZGRUSLSA-N 2 0 239.322 2.255 20 0 BEADRP CC[NH+](CC)CCC[NH2+]C1CC(CF)(CF)C1 ZINC000657815047 411604191 /nfs/dbraw/zinc/60/41/91/411604191.db2.gz GCFRREPKGSMTOI-UHFFFAOYSA-N 2 0 248.361 2.396 20 0 BEADRP C[C@@H]([NH2+]CCC[NH+](C)C)C(C)(C)C(F)F ZINC000657816061 411604908 /nfs/dbraw/zinc/60/49/08/411604908.db2.gz HNLGBZWRSKNFEY-SECBINFHSA-N 2 0 222.323 2.208 20 0 BEADRP COC1([C@@H](C)[NH2+]CCC[N@H+](C)C(C)C)CCC1 ZINC000657829872 411609244 /nfs/dbraw/zinc/60/92/44/411609244.db2.gz ATTJOQAHOZGALA-CYBMUJFWSA-N 2 0 242.407 2.264 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CCCSCC2)C1 ZINC000657843491 411610573 /nfs/dbraw/zinc/61/05/73/411610573.db2.gz ZDNNABBLQLFZOC-CHWSQXEVSA-N 2 0 242.432 2.204 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@H]1CCCSCC1 ZINC000657858832 411612654 /nfs/dbraw/zinc/61/26/54/411612654.db2.gz MHAFNKJBSFTMRO-NEPJUHHUSA-N 2 0 230.421 2.202 20 0 BEADRP CC(C)CC[N@@H+]1CCC[C@]2(CC[NH+](C)C2)C1 ZINC000660653567 411613717 /nfs/dbraw/zinc/61/37/17/411613717.db2.gz BNPCHSIBLAGYGS-CQSZACIVSA-N 2 0 224.392 2.450 20 0 BEADRP C[NH+]1CCC(C[NH2+]C2CC(CF)(CF)C2)CC1 ZINC000657874020 411614928 /nfs/dbraw/zinc/61/49/28/411614928.db2.gz XSYDNTZMYBXVNT-UHFFFAOYSA-N 2 0 246.345 2.006 20 0 BEADRP CC[C@@H](C)[N@H+](CC)CCCn1ccnc1 ZINC000661103801 411707304 /nfs/dbraw/zinc/70/73/04/411707304.db2.gz CFRNTCHOUUDXAY-GFCCVEGCSA-N 2 0 209.337 2.394 20 0 BEADRP CC1CC([NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)C1 ZINC000663466386 411666488 /nfs/dbraw/zinc/66/64/88/411666488.db2.gz SCDYGVWMVNZYHT-HNFVBEJKSA-N 2 0 236.403 2.497 20 0 BEADRP C([NH2+][C@@H]1CCCC[C@@H]1C1CC1)C12CC(C1)C[NH2+]2 ZINC000663497284 411678376 /nfs/dbraw/zinc/67/83/76/411678376.db2.gz CSWLDTULWRSCTL-INTODGSJSA-N 2 0 234.387 2.297 20 0 BEADRP C([NH2+]C1CCCCCC1)C12CC(C1)C[NH2+]2 ZINC000663497363 411678642 /nfs/dbraw/zinc/67/86/42/411678642.db2.gz FVDLOPBQQQTVTO-UHFFFAOYSA-N 2 0 208.349 2.051 20 0 BEADRP Cc1ccccc1C[C@@H](C)[NH2+]CC12CC(C1)C[NH2+]2 ZINC000663497073 411678895 /nfs/dbraw/zinc/67/88/95/411678895.db2.gz BBSCUVKERYKDQZ-VQCLRJIVSA-N 2 0 244.382 2.268 20 0 BEADRP C([NH2+][C@H]1CCCC[C@H]1C1CC1)C12CC(C1)C[NH2+]2 ZINC000663497283 411679330 /nfs/dbraw/zinc/67/93/30/411679330.db2.gz CSWLDTULWRSCTL-IFFKYPLHSA-N 2 0 234.387 2.297 20 0 BEADRP C[C@@H](Cc1ccc(F)cc1)[NH2+]CC12CC(C1)C[NH2+]2 ZINC000663497550 411679375 /nfs/dbraw/zinc/67/93/75/411679375.db2.gz HEEWQDWVWCUBEM-ZOODHJKOSA-N 2 0 248.345 2.098 20 0 BEADRP CC[C@@H]1CCC[C@H]([NH2+]CC23CC(C2)C[NH2+]3)C1 ZINC000663497777 411679593 /nfs/dbraw/zinc/67/95/93/411679593.db2.gz JVPPRTLRGUKHNS-ZIHBUVQPSA-N 2 0 222.376 2.297 20 0 BEADRP C([NH2+][C@H]1CCC[C@H](C2CC2)C1)C12CC(C1)C[NH2+]2 ZINC000663498569 411680558 /nfs/dbraw/zinc/68/05/58/411680558.db2.gz QENBSCXGIGXVPI-IFFKYPLHSA-N 2 0 234.387 2.297 20 0 BEADRP COC[C@H](CC(C)C)[NH2+]CC[C@@H]([NH3+])C(C)C ZINC000663502391 411686529 /nfs/dbraw/zinc/68/65/29/411686529.db2.gz HSYHSNFGWSEULS-QWHCGFSZSA-N 2 0 230.396 2.011 20 0 BEADRP C[NH2+]C[C@H](C)[NH2+][C@H]1CCCC[C@H]1C1CC1 ZINC000663510729 411691453 /nfs/dbraw/zinc/69/14/53/411691453.db2.gz RTFRFRVOQGBFHO-DRZSPHRISA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@H](C[C@@H](C)CC)[NH2+][C@@H](C)C[NH2+]C ZINC000663514826 411697558 /nfs/dbraw/zinc/69/75/58/411697558.db2.gz UKOQVGFPTSSVHV-SDDRHHMPSA-N 2 0 200.370 2.399 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](CNc2[nH+]ccc3[nH]ccc32)C1 ZINC000664074473 411840693 /nfs/dbraw/zinc/84/06/93/411840693.db2.gz RRWSYOFEDNMQOJ-PHIMTYICSA-N 2 0 244.342 2.315 20 0 BEADRP Cc1cccc(NCC[C@H](C)[NH+](C)C)[nH+]1 ZINC000664243166 411894899 /nfs/dbraw/zinc/89/48/99/411894899.db2.gz JGQVKYDTVVNNFP-NSHDSACASA-N 2 0 207.321 2.142 20 0 BEADRP C[C@H](CC[N@@H+]1CC[C@@H]2C[C@@H]2C1)[NH+]1CC[C@H]2C[C@H]2C1 ZINC000661970396 411927852 /nfs/dbraw/zinc/92/78/52/411927852.db2.gz LFXKSGXKZNGCPF-LJIZCISZSA-N 2 0 248.414 2.449 20 0 BEADRP CCc1cc(NC[C@H]2CC[N@@H+]2C(C)(C)C)cc[nH+]1 ZINC000664139584 411868633 /nfs/dbraw/zinc/86/86/33/411868633.db2.gz WUWRTCHHSQWNKU-CQSZACIVSA-N 2 0 247.386 2.351 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](CCCC2CCC2)C1 ZINC000662244146 412039299 /nfs/dbraw/zinc/03/92/99/412039299.db2.gz DHIFCVGZEZZVHG-ZDUSSCGKSA-N 2 0 210.365 2.108 20 0 BEADRP [NH3+][C@H]1CCN(CC[C@@H]2CCc3ccccc32)C1 ZINC000662245869 412043504 /nfs/dbraw/zinc/04/35/04/412043504.db2.gz VARFUDWGKIFWPP-KBPBESRZSA-N 2 0 230.355 2.140 20 0 BEADRP C[C@H]1C[C@H](C[NH3+])C[N@@H+]1CCCC1CCC1 ZINC000662265502 412056739 /nfs/dbraw/zinc/05/67/39/412056739.db2.gz PRZLWABROQEWKW-WCQYABFASA-N 2 0 210.365 2.236 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]C1CCN(C2CC2)CC1 ZINC000336738336 171042317 /nfs/dbraw/zinc/04/23/17/171042317.db2.gz OBQQLLZWKNRXDS-RISCZKNCSA-N 2 0 222.376 2.391 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]CC1CC[NH+](C)CC1 ZINC000336766195 171042706 /nfs/dbraw/zinc/04/27/06/171042706.db2.gz RKOSTJQRYWNFKZ-OLZOCXBDSA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@@H]1CC[C@H]1[NH2+]C[C@@H]1CCC[N@H+](CC)C1 ZINC000310036766 171059605 /nfs/dbraw/zinc/05/96/05/171059605.db2.gz UNXCJDIKDNUZMF-BFHYXJOUSA-N 2 0 224.392 2.497 20 0 BEADRP C1=CCC(C[N@@H+]2CCC[C@H]([C@@H]3CC[NH2+]C3)C2)C1 ZINC000662275281 412067169 /nfs/dbraw/zinc/06/71/69/412067169.db2.gz YVTBUCACEUDQEM-CABCVRRESA-N 2 0 234.387 2.274 20 0 BEADRP CO[C@H](C[N@H+](C)C1CC([NH3+])C1)C1CCCCC1 ZINC000662274561 412067229 /nfs/dbraw/zinc/06/72/29/412067229.db2.gz VXTLBNIZOBWORD-JXQTWKCFSA-N 2 0 240.391 2.003 20 0 BEADRP CO[C@@H](C[N@H+](C)C1CC([NH3+])C1)C1CCCCC1 ZINC000662274562 412067733 /nfs/dbraw/zinc/06/77/33/412067733.db2.gz VXTLBNIZOBWORD-RUXDESIVSA-N 2 0 240.391 2.003 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]1[NH2+]C[C@@H]1C[C@H]2C[C@H]2C1 ZINC000662278164 412070866 /nfs/dbraw/zinc/07/08/66/412070866.db2.gz XAKHIWVKFUKSII-RNJOBUHISA-N 2 0 222.376 2.010 20 0 BEADRP CC(C)=CCC[N@@H+]1CCC[C@]2(CC[NH2+]C2)C1 ZINC000662278476 412070913 /nfs/dbraw/zinc/07/09/13/412070913.db2.gz YBEMZFUVVHBASO-CQSZACIVSA-N 2 0 222.376 2.418 20 0 BEADRP CC[C@@]1(C)CC[N@H+](CCC2CC[NH2+]CC2)C1 ZINC000359192476 171201371 /nfs/dbraw/zinc/20/13/71/171201371.db2.gz PKWHINSKKVKAIA-AWEZNQCLSA-N 2 0 224.392 2.498 20 0 BEADRP C[C@@H]1CCC[N@H+](CC2CC=CC2)[C@H]1CC[NH3+] ZINC000662285851 412078035 /nfs/dbraw/zinc/07/80/35/412078035.db2.gz NSCGGZTULOXDKW-OCCSQVGLSA-N 2 0 222.376 2.402 20 0 BEADRP C[C@@H]1C[C@H](C)[N@H+](C[C@@H]2C[C@H]3C[C@H]3C2)C[C@H]1C[NH3+] ZINC000662283829 412074620 /nfs/dbraw/zinc/07/46/20/412074620.db2.gz QICMVCVIGSAZPJ-ARSDKDGVSA-N 2 0 236.403 2.338 20 0 BEADRP CC[C@H](C)C[N@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000121125139 171273201 /nfs/dbraw/zinc/27/32/01/171273201.db2.gz ZGLSWMYAQQSKGY-QWHCGFSZSA-N 2 0 212.381 2.306 20 0 BEADRP CC[C@H](C)C[N@H+](C)CC1CC[NH+](C)CC1 ZINC000120266394 171273356 /nfs/dbraw/zinc/27/33/56/171273356.db2.gz ACFQZXOQVFZYOH-LBPRGKRZSA-N 2 0 212.381 2.306 20 0 BEADRP CC[C@H](C)C[NH2+]CC(C)(C)C[NH+](C)C ZINC000020087875 171284001 /nfs/dbraw/zinc/28/40/01/171284001.db2.gz FURUDYNUKMRHJB-NSHDSACASA-N 2 0 200.370 2.210 20 0 BEADRP CC[C@H](C)C[NH2+][C@H]1CC[N@H+](CC)C[C@H]1C ZINC000309220313 171288273 /nfs/dbraw/zinc/28/82/73/171288273.db2.gz VDABTMBQWNUWGD-XQQFMLRXSA-N 2 0 212.381 2.352 20 0 BEADRP CC[C@H](C)C[C@H](C)[NH2+][C@H]1CN(C)C[C@@H]1C ZINC000308954354 171297919 /nfs/dbraw/zinc/29/79/19/171297919.db2.gz QCLRYEVGGRVYSN-CYDGBPFRSA-N 2 0 212.381 2.351 20 0 BEADRP CC[C@H](C)C[C@H](C)[NH2+][C@H](CCC[NH3+])COC ZINC000300024073 171298376 /nfs/dbraw/zinc/29/83/76/171298376.db2.gz JVNOBQFSYGXVFK-RWMBFGLXSA-N 2 0 230.396 2.155 20 0 BEADRP CC[C@H](C)[NH+]1CCC([C@H]2CCC[NH2+]2)CC1 ZINC000063197446 171317253 /nfs/dbraw/zinc/31/72/53/171317253.db2.gz RNFNZQWYRDDDJC-WCQYABFASA-N 2 0 210.365 2.249 20 0 BEADRP CC[C@H](C)[N@@H+]1CCC[C@@H](c2ncc[nH]2)C1 ZINC000273133993 171317469 /nfs/dbraw/zinc/31/74/69/171317469.db2.gz VLBDSGGTNJABFH-WDEREUQCSA-N 2 0 207.321 2.388 20 0 BEADRP [NH3+]CCC1CC[NH+](C[C@@H]2C[C@H]3C[C@H]3C2)CC1 ZINC000662284913 412078622 /nfs/dbraw/zinc/07/86/22/412078622.db2.gz QVOMYRDNFAUOOD-BTTYYORXSA-N 2 0 222.376 2.093 20 0 BEADRP CC[C@H](C)[NH2+]CCc1cn2ccccc2n1 ZINC000130643199 171341050 /nfs/dbraw/zinc/34/10/50/171341050.db2.gz OQMLESJQWNHBMZ-NSHDSACASA-N 2 0 217.316 2.265 20 0 BEADRP FCCC[N@@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000662293046 412080287 /nfs/dbraw/zinc/08/02/87/412080287.db2.gz IYQKPTRUHJANFF-CYBMUJFWSA-N 2 0 228.355 2.058 20 0 BEADRP CC[C@H](C)[C@@H](C[NH2+]C1CC[NH+](CC)CC1)OC ZINC000362976819 171368806 /nfs/dbraw/zinc/36/88/06/171368806.db2.gz MFJBAPFFUKWDSE-GXTWGEPZSA-N 2 0 242.407 2.121 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+]CCCC[NH+](C)C ZINC000045663732 171389036 /nfs/dbraw/zinc/38/90/36/171389036.db2.gz AAYZRUKGPNNXKR-RYUDHWBXSA-N 2 0 200.370 2.352 20 0 BEADRP CC[C@H](C)[C@H](C[NH2+][C@@H]1CCCC[C@H]1C[NH3+])OC ZINC000362974752 171392802 /nfs/dbraw/zinc/39/28/02/171392802.db2.gz BPWJVYBYVPLZIE-FQUUOJAGSA-N 2 0 242.407 2.155 20 0 BEADRP c1coc(C2CC[NH+](C[C@@H]3CC[NH2+]C3)CC2)c1 ZINC000662299247 412087088 /nfs/dbraw/zinc/08/70/88/412087088.db2.gz WAKBEKORNFEQNY-GFCCVEGCSA-N 2 0 234.343 2.069 20 0 BEADRP Cc1ccccc1CCCN1CC2CC1(C[NH3+])C2 ZINC000662304396 412089541 /nfs/dbraw/zinc/08/95/41/412089541.db2.gz QSOCWESHENYVLK-UHFFFAOYSA-N 2 0 244.382 2.351 20 0 BEADRP C[C@H]1CCCC[C@@H]1C[N@@H+]1CC2CC1(C[NH3+])C2 ZINC000662306311 412091433 /nfs/dbraw/zinc/09/14/33/412091433.db2.gz QEZUUWLVEZLVRM-RJZJGCCBSA-N 2 0 222.376 2.236 20 0 BEADRP C([C@@H]1CC[NH2+]C1)[N@@H+]1CC[C@@H](C2CCCCC2)C1 ZINC000662305439 412091770 /nfs/dbraw/zinc/09/17/70/412091770.db2.gz HPXQXOMYECBDKN-UKRRQHHQSA-N 2 0 236.403 2.498 20 0 BEADRP CCC1(CC)CCC[N@H+](C[C@H]2CC[NH2+]C2)C1 ZINC000662308680 412092979 /nfs/dbraw/zinc/09/29/79/412092979.db2.gz COGHRFQCJOYCAU-ZDUSSCGKSA-N 2 0 224.392 2.498 20 0 BEADRP CCC(CC)CCC[N@H+](C)C[C@@](C)(O)C[NH2+]C ZINC000662317735 412098013 /nfs/dbraw/zinc/09/80/13/412098013.db2.gz RMJGTMBTRRWDQN-AWEZNQCLSA-N 2 0 244.423 2.105 20 0 BEADRP C[N@@H+](C[C@@H]1CCc2ccccc21)C[C@H]1CC[NH2+]C1 ZINC000662322550 412100896 /nfs/dbraw/zinc/10/08/96/412100896.db2.gz NAFDBNYXEDMZFS-ZFWWWQNUSA-N 2 0 244.382 2.258 20 0 BEADRP CC12CC(C1)C[N@@H+]2Cc1ccc2c(c1)C[NH2+]CC2 ZINC000662337071 412108128 /nfs/dbraw/zinc/10/81/28/412108128.db2.gz JCMZWOOVQMSEBS-UHFFFAOYSA-N 2 0 242.366 2.317 20 0 BEADRP CC[C@@H]1C[C@@H](C)CC[C@H]1[NH2+][C@H]1CC[NH2+]C1 ZINC000665242739 412176066 /nfs/dbraw/zinc/17/60/66/412176066.db2.gz JCLYVLMQJXVSEH-QNWHQSFQSA-N 2 0 210.365 2.153 20 0 BEADRP CC[C@H](C)CC[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000665238384 412178593 /nfs/dbraw/zinc/17/85/93/412178593.db2.gz XGCZGQJMJXBMTN-RFQIPJPRSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H]([NH2+][C@@H]1Cc2ccccc2[C@@H]1C)[C@H]1CCC[NH2+]1 ZINC000665244152 412187203 /nfs/dbraw/zinc/18/72/03/412187203.db2.gz HHLMCWWZTPDTQX-YXAMBPQSSA-N 2 0 244.382 2.445 20 0 BEADRP C[C@H]([NH2+]CC1([NH3+])CCCC1)[C@@H]1CC1(C)C ZINC000665246825 412191547 /nfs/dbraw/zinc/19/15/47/412191547.db2.gz OYYDGTODHTZNOX-QWRGUYRKSA-N 2 0 210.365 2.282 20 0 BEADRP COCC1CCC([NH2+]CC2([NH3+])CCCC2)CC1 ZINC000665247272 412193252 /nfs/dbraw/zinc/19/32/52/412193252.db2.gz YYRAADYHVAKJQY-UHFFFAOYSA-N 2 0 240.391 2.053 20 0 BEADRP CC(C)(F)CC[NH2+][C@@H]1CCCCC[C@@H]1[NH3+] ZINC000665261791 412204489 /nfs/dbraw/zinc/20/44/89/412204489.db2.gz LKPMHRMWNONLPG-WDEREUQCSA-N 2 0 216.344 2.374 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+][C@@H]1CCc2ccccc21 ZINC000665262252 412205195 /nfs/dbraw/zinc/20/51/95/412205195.db2.gz XCEPZKVALARYFS-UHIISALHSA-N 2 0 218.344 2.389 20 0 BEADRP C([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)[C@H]1CCC[C@H]2C[C@H]21 ZINC000665263399 412205425 /nfs/dbraw/zinc/20/54/25/412205425.db2.gz LSRWKKJEQCCNBT-RCZWDNKTSA-N 2 0 248.414 2.400 20 0 BEADRP COCc1csc(C[NH2+][C@H](C)C[C@@H](C)[NH3+])c1 ZINC000665263454 412206169 /nfs/dbraw/zinc/20/61/69/412206169.db2.gz MLCXYXHZRCZNBV-NXEZZACHSA-N 2 0 242.388 2.110 20 0 BEADRP c1cc(CC[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)co1 ZINC000665262930 412206335 /nfs/dbraw/zinc/20/63/35/412206335.db2.gz CGVJYZHFORFSGQ-KFWWJZLASA-N 2 0 248.370 2.332 20 0 BEADRP C[C@@H]([NH2+]CCCC1CCC1)[C@@H]1CCC[NH2+]1 ZINC000665267489 412211117 /nfs/dbraw/zinc/21/11/17/412211117.db2.gz XOFSRDPNADRGNI-YPMHNXCESA-N 2 0 210.365 2.297 20 0 BEADRP C1=C(C[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)CCC1 ZINC000665274620 412218220 /nfs/dbraw/zinc/21/82/20/412218220.db2.gz UQSJRPKCTZDIIN-BFHYXJOUSA-N 2 0 220.360 2.074 20 0 BEADRP CO[C@H](C[NH2+][C@@H]1CCC[C@@H]([NH3+])C1)C1CCCC1 ZINC000665275766 412218780 /nfs/dbraw/zinc/21/87/80/412218780.db2.gz RCBRABSKMWWZFP-MGPQQGTHSA-N 2 0 240.391 2.051 20 0 BEADRP CC(C)=CCC[C@H](C)[NH2+]CC12CC(C1)C[NH2+]2 ZINC000665276790 412218871 /nfs/dbraw/zinc/21/88/71/412218871.db2.gz MWHAHHMMMUOZMZ-HSBZDZAISA-N 2 0 222.376 2.463 20 0 BEADRP CO[C@@H](C[NH2+][C@H](C)CCCC[NH3+])C1CCCC1 ZINC000665275711 412219782 /nfs/dbraw/zinc/21/97/82/412219782.db2.gz PSUVFVPDEKRSLI-OCCSQVGLSA-N 2 0 242.407 2.299 20 0 BEADRP CC1(C)C[C@]1(C)[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000665275445 412219976 /nfs/dbraw/zinc/21/99/76/412219976.db2.gz KYCGBLPQBPLLGP-BYNQJWBRSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]1CCC[C@H](C)[C@H]1[NH2+]CC12CC(C1)C[NH2+]2 ZINC000665277551 412221102 /nfs/dbraw/zinc/22/11/02/412221102.db2.gz FHIXUYNPPSMRPT-KWPGZKHISA-N 2 0 222.376 2.153 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@H]([NH2+]CC23CC(C2)C[NH2+]3)C1 ZINC000665279648 412222545 /nfs/dbraw/zinc/22/25/45/412222545.db2.gz IJEVFMARUQCIJN-NFMDPKQHSA-N 2 0 222.376 2.153 20 0 BEADRP C([NH2+]C1CCC2(CC2)CC1)C12CC(C1)C[NH2+]2 ZINC000665279593 412222556 /nfs/dbraw/zinc/22/25/56/412222556.db2.gz GRIXISBSAIOOIU-UHFFFAOYSA-N 2 0 220.360 2.051 20 0 BEADRP C([NH2+]C(C1CCC1)C1CCC1)C12CC(C1)C[NH2+]2 ZINC000665279611 412222899 /nfs/dbraw/zinc/22/28/99/412222899.db2.gz HENMFGHIHYBGON-UHFFFAOYSA-N 2 0 234.387 2.297 20 0 BEADRP CC[C@H]1CCCC[C@@H]1[NH2+]CC12CC(C1)C[NH2+]2 ZINC000665278787 412223238 /nfs/dbraw/zinc/22/32/38/412223238.db2.gz OUTFCAZSGBTKKA-QPPOZKHWSA-N 2 0 222.376 2.297 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+][C@@H](C(C)C)C1CC1 ZINC000665281313 412226531 /nfs/dbraw/zinc/22/65/31/412226531.db2.gz ZMMTZQBQHFMYLY-OLZOCXBDSA-N 2 0 212.381 2.384 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+][C@H]1CCCc2cccnc21 ZINC000665282205 412227439 /nfs/dbraw/zinc/22/74/39/412227439.db2.gz SVOYUKVQXJYRGU-KGLIPLIRSA-N 2 0 247.386 2.422 20 0 BEADRP CC(C)[C@H]([NH3+])CCN[C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000665283719 412228634 /nfs/dbraw/zinc/22/86/34/412228634.db2.gz SUFVRJHMSPORKC-RBSFLKMASA-N 2 0 247.386 2.094 20 0 BEADRP COc1cccc(C[NH2+][C@@H](C)C[C@@H](C)[NH3+])c1C ZINC000665294829 412241058 /nfs/dbraw/zinc/24/10/58/412241058.db2.gz XIGIGBULIMNYGX-MNOVXSKESA-N 2 0 236.359 2.219 20 0 BEADRP C[NH2+]C[C@@H](C)[NH2+][C@H](C)C1C(C)(C)C1(C)C ZINC000665296707 412243906 /nfs/dbraw/zinc/24/39/06/412243906.db2.gz WZMOHBPTTIPVBM-NXEZZACHSA-N 2 0 212.381 2.255 20 0 BEADRP CC[C@H]1CC[C@H]1[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000336741158 171647836 /nfs/dbraw/zinc/64/78/36/171647836.db2.gz QUKSPISXMHRAEQ-QWHCGFSZSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH+](C)C1CCC([NH2+][C@H]2CCCOCC2)CC1 ZINC000336380133 172404952 /nfs/dbraw/zinc/40/49/52/172404952.db2.gz SXPKMQDDOVQVJT-HSBZDZAISA-N 2 0 240.391 2.018 20 0 BEADRP C[NH+](C)CC1CC[NH+](CCOC(C)(C)C)CC1 ZINC000336717132 172425656 /nfs/dbraw/zinc/42/56/56/172425656.db2.gz XWEXQFLZBKIQAE-UHFFFAOYSA-N 2 0 242.407 2.075 20 0 BEADRP C[N@@H+]1CCC[C@H]1CC[NH+]1CCCCCC1 ZINC000124616938 173050888 /nfs/dbraw/zinc/05/08/88/173050888.db2.gz UBPLILOIEIEQRR-ZDUSSCGKSA-N 2 0 210.365 2.347 20 0 BEADRP C[N@@H+]1CC[C@@]2(CC[NH+](CC3CC(F)(F)C3)C2)C1 ZINC000336268431 173137742 /nfs/dbraw/zinc/13/77/42/173137742.db2.gz LDPCAYYBVBMALG-GFCCVEGCSA-N 2 0 244.329 2.059 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]Cc2ccco2)[C@H]2CCC[C@@H]21 ZINC000367619986 173151614 /nfs/dbraw/zinc/15/16/14/173151614.db2.gz XMQUOFYVMVJZKM-RDBSUJKOSA-N 2 0 234.343 2.242 20 0 BEADRP C[N@@H+]1CC[C@H]([NH2+]Cc2ccoc2)[C@@H]2CCC[C@H]21 ZINC000367527914 173154975 /nfs/dbraw/zinc/15/49/75/173154975.db2.gz UHCYEEHGFMMIJS-MELADBBJSA-N 2 0 234.343 2.242 20 0 BEADRP C[NH2+]C1CC[NH+](CC2CCC(C)CC2)CC1 ZINC000063145716 173322515 /nfs/dbraw/zinc/32/25/15/173322515.db2.gz JESYLEIACSEUBZ-UHFFFAOYSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH2+]C1CC[NH+](C[C@@H]2CCC[C@@H](C)C2)CC1 ZINC000234346039 173323365 /nfs/dbraw/zinc/32/33/65/173323365.db2.gz PNKGTKHDIOWYRG-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP C[NH2+]CCC1CC[NH+]([C@H](C)c2cccnc2)CC1 ZINC000070188722 173343085 /nfs/dbraw/zinc/34/30/85/173343085.db2.gz OEGKDJBJIOKHNH-CYBMUJFWSA-N 2 0 247.386 2.464 20 0 BEADRP C[NH2+]CCC[N@@H+]1CCC[C@H]1c1ccsc1 ZINC000309629240 173346728 /nfs/dbraw/zinc/34/67/28/173346728.db2.gz JZISHDHFCXARGZ-LBPRGKRZSA-N 2 0 224.373 2.495 20 0 BEADRP C[NH2+]CCC[NH2+]C/C=C/c1ccc(F)cc1 ZINC000083352153 173349074 /nfs/dbraw/zinc/34/90/74/173349074.db2.gz VAPGVSLGYJDEKW-DUXPYHPUSA-N 2 0 222.307 2.038 20 0 BEADRP C[NH2+]CCC[NH2+]Cc1cccc(C(F)(F)F)c1 ZINC000083375072 173349481 /nfs/dbraw/zinc/34/94/81/173349481.db2.gz JSRVFRKFMAKHGG-UHFFFAOYSA-N 2 0 246.276 2.405 20 0 BEADRP C[NH2+]CCN(C)[C@H]1CCCc2ccccc21 ZINC000069801117 173353703 /nfs/dbraw/zinc/35/37/03/173353703.db2.gz YWPLLXHNMNVREP-AWEZNQCLSA-N 2 0 218.344 2.215 20 0 BEADRP C[NH2+]C[C@@H]1CCC[N@H+](CCC(C)(C)C)C1 ZINC000040601053 173367616 /nfs/dbraw/zinc/36/76/16/173367616.db2.gz SJLPYUCFNUVRSH-LBPRGKRZSA-N 2 0 212.381 2.354 20 0 BEADRP C[NH2+]C[C@@H]1CCC[N@H+](CC2CCCC2)C1 ZINC000042375123 173368268 /nfs/dbraw/zinc/36/82/68/173368268.db2.gz RYLQTDUYNCVYLE-ZDUSSCGKSA-N 2 0 210.365 2.108 20 0 BEADRP C[NH2+]C[C@@H]1CC[N@H+](Cc2sccc2C)C1 ZINC000070798635 173371283 /nfs/dbraw/zinc/37/12/83/173371283.db2.gz PXCIQRYYTAQEFO-NSHDSACASA-N 2 0 224.373 2.098 20 0 BEADRP C[NH2+]C[C@H]1CCN(C/C=C/c2ccccc2)C1 ZINC000071147422 173381010 /nfs/dbraw/zinc/38/10/10/173381010.db2.gz PNVHGPMKHOVKRV-SBJJXXPASA-N 2 0 230.355 2.241 20 0 BEADRP C[NH2+]C[C@H]1CC[N@H+](Cc2ccc3c(c2)CCC3)C1 ZINC000070499616 173382259 /nfs/dbraw/zinc/38/22/59/173382259.db2.gz JXEKONALGQNRPW-CQSZACIVSA-N 2 0 244.382 2.217 20 0 BEADRP COC1(C[NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)CCCC1 ZINC000336655250 174003814 /nfs/dbraw/zinc/00/38/14/174003814.db2.gz JCVRGXFDFNAUSM-QWHCGFSZSA-N 2 0 240.391 2.018 20 0 BEADRP COCC[C@@H]1CCC[C@@H]1[NH2+]CCN(C)C(C)C ZINC000337387139 174397014 /nfs/dbraw/zinc/39/70/14/174397014.db2.gz IKSQIMOABMDTBV-KBPBESRZSA-N 2 0 242.407 2.121 20 0 BEADRP COc1ccc(C)cc1C[N@@H+]1CC[C@H]([C@@H](C)[NH3+])C1 ZINC000163209807 175074566 /nfs/dbraw/zinc/07/45/66/175074566.db2.gz ZKKNUYLSCFVGML-OLZOCXBDSA-N 2 0 248.370 2.173 20 0 BEADRP COc1ccc(C[NH2+][C@H]2CC[N@H+](C)C[C@@H]2C)cc1 ZINC000105480714 175112271 /nfs/dbraw/zinc/11/22/71/175112271.db2.gz DXMIZAQHJGFTMO-WFASDCNBSA-N 2 0 248.370 2.125 20 0 BEADRP COc1ccc(C[NH2+][C@H]2CC[N@H+](C)C[C@H]2C)cc1 ZINC000105480712 175112346 /nfs/dbraw/zinc/11/23/46/175112346.db2.gz DXMIZAQHJGFTMO-DOMZBBRYSA-N 2 0 248.370 2.125 20 0 BEADRP COc1cccc(C[N@H+](C)CC2CC[NH2+]CC2)c1 ZINC000042442298 175255467 /nfs/dbraw/zinc/25/54/67/175255467.db2.gz PHTVALIQGOYHTR-UHFFFAOYSA-N 2 0 248.370 2.127 20 0 BEADRP COc1cccc(C[N@@H+]2CCC[C@@H]([C@@H](C)[NH3+])C2)c1 ZINC000111695790 175258266 /nfs/dbraw/zinc/25/82/66/175258266.db2.gz GUWXPNDUXZQJOC-TZMCWYRMSA-N 2 0 248.370 2.254 20 0 BEADRP COc1cccc([C@H](C)[N@@H+]2CC[C@@H](C[NH3+])C2)c1 ZINC000224194779 175292544 /nfs/dbraw/zinc/29/25/44/175292544.db2.gz VCXTXKXNJZLDCD-RYUDHWBXSA-N 2 0 234.343 2.037 20 0 BEADRP COc1ccccc1[C@H](C)[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000128878305 175351841 /nfs/dbraw/zinc/35/18/41/175351841.db2.gz CQOLCLDPLXWAOA-QWHCGFSZSA-N 2 0 248.370 2.488 20 0 BEADRP CSC1(C[NH2+][C@H]2CCC[C@H]([NH+](C)C)C2)CC1 ZINC000309728988 175454017 /nfs/dbraw/zinc/45/40/17/175454017.db2.gz ZABOWUIHRNPWNX-RYUDHWBXSA-N 2 0 242.432 2.344 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+]CCc1ccc(F)cc1 ZINC000310442622 175663418 /nfs/dbraw/zinc/66/34/18/175663418.db2.gz WDDVFTXWGKWVTQ-LBPRGKRZSA-N 2 0 238.350 2.475 20 0 BEADRP C[C@@H]([NH2+]C[C@@H](C)C[NH3+])c1cccc(F)c1 ZINC000308972842 175708601 /nfs/dbraw/zinc/70/86/01/175708601.db2.gz HFXJGVYXYOVKKC-VHSXEESVSA-N 2 0 210.296 2.071 20 0 BEADRP C[C@@H]([NH2+]CCCC[NH+](C)C)c1cccc(O)c1 ZINC000045663498 175874834 /nfs/dbraw/zinc/87/48/34/175874834.db2.gz SSIJCIRBVKFWJC-GFCCVEGCSA-N 2 0 236.359 2.385 20 0 BEADRP C[C@@H]([NH2+]CCC[NH+]1CCCC1)[C@H]1CC1(C)C ZINC000309444122 175876377 /nfs/dbraw/zinc/87/63/77/175876377.db2.gz KXKPWEVJLZHUNY-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP CC(C)C[N@H+](C[C@@H]1CC[NH2+]C1)C1CCCC1 ZINC000087286701 487632539 /nfs/dbraw/zinc/63/25/39/487632539.db2.gz DEMHOEHIPGBDJB-CYBMUJFWSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H](c1ccccn1)[N@H+](C)CC1CC[NH2+]CC1 ZINC000094011045 176026574 /nfs/dbraw/zinc/02/65/74/176026574.db2.gz KLJIBVNLPWHNNS-LBPRGKRZSA-N 2 0 233.359 2.074 20 0 BEADRP C[C@@H]1CCCC[C@@H]1C[N@@H+]1CC[C@H](C[NH3+])C1 ZINC000042864490 176076996 /nfs/dbraw/zinc/07/69/96/176076996.db2.gz MUDOHBMQSDVBSE-JHJVBQTASA-N 2 0 210.365 2.093 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+]CC1=CC[N@H+](C)CC1 ZINC000335607811 176080720 /nfs/dbraw/zinc/08/07/20/176080720.db2.gz HVBMYMZDXBTGKI-OCCSQVGLSA-N 2 0 222.376 2.417 20 0 BEADRP C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000222891064 176081977 /nfs/dbraw/zinc/08/19/77/176081977.db2.gz PNVTXFIWCYSUKC-LPWJVIDDSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@@H]1CCCC[C@H]1C[N@@H+]1CC[C@H](C[NH3+])C1 ZINC000042864495 176084290 /nfs/dbraw/zinc/08/42/90/176084290.db2.gz MUDOHBMQSDVBSE-UPJWGTAASA-N 2 0 210.365 2.093 20 0 BEADRP C[C@@H]1CCCC[C@H]1C[NH+]1CCC([NH3+])CC1 ZINC000042864224 176084860 /nfs/dbraw/zinc/08/48/60/176084860.db2.gz MSOIOGBQIGFUAE-NEPJUHHUSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH+]2CCC(C[NH3+])CC2)C1 ZINC000044511957 176120305 /nfs/dbraw/zinc/12/03/05/176120305.db2.gz CONRXVQGEDTUMS-DGCLKSJQSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+]CC(C)(C)C[NH+](C)C ZINC000083389618 176130715 /nfs/dbraw/zinc/13/07/15/176130715.db2.gz FGSAQLGDUXHPGX-NEPJUHHUSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCCC[C@H]1C[NH3+] ZINC000252215429 176131633 /nfs/dbraw/zinc/13/16/33/176131633.db2.gz XNDMLUZBOMACPW-MROQNXINSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@@H]1CCC[C@H](C[NH2+]C2CC[NH2+]CC2)C1 ZINC000235366979 176138774 /nfs/dbraw/zinc/13/87/74/176138774.db2.gz AZNKFFCOWTVZBM-NEPJUHHUSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCC[C@@H](C)C1)C[NH+](C)C ZINC000336655855 176144438 /nfs/dbraw/zinc/14/44/38/176144438.db2.gz ABWPWNHMHVEWOJ-UPJWGTAASA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H]1CC[C@@H](C)[N@H+](CC[C@H]2CC[NH2+]C2)C1 ZINC000251876418 176197512 /nfs/dbraw/zinc/19/75/12/176197512.db2.gz QWZKGKFWHLKVCX-JHJVBQTASA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000336717142 176217883 /nfs/dbraw/zinc/21/78/83/176217883.db2.gz XUVHLWQQVGGQPA-NDBYEHHHSA-N 2 0 208.349 2.001 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+][C@H]2CC[N@H+](C)C[C@H]2C)C1 ZINC000336673287 176227371 /nfs/dbraw/zinc/22/73/71/176227371.db2.gz AKEPWHNPDBBDFQ-MQYQWHSLSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]CC2(C)CC[NH2+]CC2)C1 ZINC000129443106 176232935 /nfs/dbraw/zinc/23/29/35/176232935.db2.gz BTKGIAVEDAEQTH-NEPJUHHUSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]C[C@@H]1CCSC1 ZINC000300230005 176278355 /nfs/dbraw/zinc/27/83/55/176278355.db2.gz NPCBEIXOGQZEPK-NDBYEHHHSA-N 2 0 242.432 2.058 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]C1CCCC1 ZINC000036907481 176279116 /nfs/dbraw/zinc/27/91/16/176279116.db2.gz DPAJTUCYATWMFY-WZRBSPASSA-N 2 0 210.365 2.247 20 0 BEADRP C[C@@H]1C[N@H+](CCc2ccc(F)cc2)CC[C@@H]1[NH3+] ZINC000049708186 176293571 /nfs/dbraw/zinc/29/35/71/176293571.db2.gz LKJRAQRTOSXBCU-RISCZKNCSA-N 2 0 236.334 2.037 20 0 BEADRP C[C@H]1C[N@H+](CC[C@H]2CCC[NH+]2C)C[C@H]1C ZINC000336650832 176294457 /nfs/dbraw/zinc/29/44/57/176294457.db2.gz TYIXCIYRMDZWGD-FRRDWIJNSA-N 2 0 210.365 2.059 20 0 BEADRP C[C@@H]1C[C@@H](C)C[NH+](CCCCCC[NH3+])C1 ZINC000020073476 176360693 /nfs/dbraw/zinc/36/06/93/176360693.db2.gz GDQBXGRTHSJATN-CHWSQXEVSA-N 2 0 212.381 2.483 20 0 BEADRP C[C@@H]1C[C@@H](C[N@@H+]2CCCC2(C)C)CC[NH2+]1 ZINC000235380851 176369256 /nfs/dbraw/zinc/36/92/56/176369256.db2.gz SKCSDAHEWGIHIJ-NEPJUHHUSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@@H]1C[C@@H](C[NH2+]C2CCCCC2)CC[NH2+]1 ZINC000235383567 176370121 /nfs/dbraw/zinc/37/01/21/176370121.db2.gz BHKUCAXBACCRSY-NEPJUHHUSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]C[C@]2(C)CCCS2)CC[N@@H+]1C ZINC000120399205 176376523 /nfs/dbraw/zinc/37/65/23/176376523.db2.gz SPGWQVHLELUAQB-AGIUHOORSA-N 2 0 242.432 2.344 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+]C1CCC([NH+](C)C)CC1 ZINC000309113491 176395793 /nfs/dbraw/zinc/39/57/93/176395793.db2.gz KOIQPVLQEMKQKZ-OKZRHMCRSA-N 2 0 210.365 2.105 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+][C@@H]1CC[N@H+](C)[C@H]2CCC[C@H]21 ZINC000309775595 176397801 /nfs/dbraw/zinc/39/78/01/176397801.db2.gz LPSZJWSLJCBQIJ-RGDJUOJXSA-N 2 0 222.376 2.105 20 0 BEADRP C[C@H](CCC1CC1)[NH2+][C@H](C)CC[NH+](C)C ZINC000308874029 176617097 /nfs/dbraw/zinc/61/70/97/176617097.db2.gz RVYACOQPMFJNJB-VXGBXAGGSA-N 2 0 212.381 2.495 20 0 BEADRP C[C@H](CCC[NH3+])[NH2+]CCSc1ccccc1 ZINC000309428872 176620099 /nfs/dbraw/zinc/62/00/99/176620099.db2.gz MCVGTCLOHPGAMH-GFCCVEGCSA-N 2 0 238.400 2.496 20 0 BEADRP C[C@H]([NH2+]C1CCC([NH3+])CC1)C1CCCC1 ZINC000054081556 176828694 /nfs/dbraw/zinc/82/86/94/176828694.db2.gz RWLRZIIUOFIXNE-PKSQDBQZSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@H]([NH2+]C1CCCC1)C1CC[NH+](C)CC1 ZINC000037208720 176829515 /nfs/dbraw/zinc/82/95/15/176829515.db2.gz LXVIQRISZYGMIB-NSHDSACASA-N 2 0 210.365 2.249 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H](C)c1ccncc1 ZINC000309252829 176909459 /nfs/dbraw/zinc/90/94/59/176909459.db2.gz AMPHVSAJWGBADS-NEPJUHHUSA-N 2 0 221.348 2.250 20 0 BEADRP C[C@H](c1cccnc1)[N@@H+]1CCC[C@H](CC[NH3+])C1 ZINC000070169737 177045865 /nfs/dbraw/zinc/04/58/65/177045865.db2.gz GDEORWNAMOOVFX-CHWSQXEVSA-N 2 0 233.359 2.203 20 0 BEADRP C[C@H]1CCCCC[N@@H+]1CC1CC[NH2+]CC1 ZINC000069944970 177069943 /nfs/dbraw/zinc/06/99/43/177069943.db2.gz ZKYBDANLMGFETA-LBPRGKRZSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@H]1CCCC[N@@H+]1CCC[NH2+][C@@H]1CCSC1 ZINC000019912921 177074809 /nfs/dbraw/zinc/07/48/09/177074809.db2.gz SMJFOKQZKVIBGJ-QWHCGFSZSA-N 2 0 242.432 2.346 20 0 BEADRP C[C@@H]1C[C@@H](C[N@@H+]2CCCC[C@@H]2C)CC[NH2+]1 ZINC000235381031 177076702 /nfs/dbraw/zinc/07/67/02/177076702.db2.gz OBLVBDRSHHJVOE-AGIUHOORSA-N 2 0 210.365 2.249 20 0 BEADRP C[C@H]1CCC[C@@H](C[NH2+]CCC[NH+](C)C)C1 ZINC000084340532 177119531 /nfs/dbraw/zinc/11/95/31/177119531.db2.gz HFLLLCVUGKTIJD-QWHCGFSZSA-N 2 0 212.381 2.354 20 0 BEADRP C[C@H]1CCC[C@@H]([NH2+]C2CCC([NH3+])CC2)C1 ZINC000051692922 177122712 /nfs/dbraw/zinc/12/27/12/177122712.db2.gz GJVDRBRZSYDSON-YWPUVAFDSA-N 2 0 210.365 2.425 20 0 BEADRP C[C@H]1C[N@H+](CC2CCCCC2)CC[C@@H]1[NH3+] ZINC000049710705 177246293 /nfs/dbraw/zinc/24/62/93/177246293.db2.gz JDTXEYQOJHLZCZ-AAEUAGOBSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@H]1CSC[C@H]1[NH2+]C1CCC([NH+](C)C)CC1 ZINC000309817774 177306679 /nfs/dbraw/zinc/30/66/79/177306679.db2.gz VQUSSSKAIQDQMC-YWPUVAFDSA-N 2 0 242.432 2.200 20 0 BEADRP C[C@H]1CSC[C@H]1[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000304538742 177306753 /nfs/dbraw/zinc/30/67/53/177306753.db2.gz RYEVCDITLVYMNL-NWDGAFQWSA-N 2 0 242.432 2.059 20 0 BEADRP C[C@@H]1C[C@H](C)[C@@H](C)[N@H+](C[C@@H]2CCC[NH2+]C2)C1 ZINC000229420706 177313236 /nfs/dbraw/zinc/31/32/36/177313236.db2.gz LESAHKZIPUPBGK-XJFOESAGSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@@H]1C[C@H](C)[C@@H](C)[N@H+](CC2CC[NH2+]CC2)C1 ZINC000229421077 177313740 /nfs/dbraw/zinc/31/37/40/177313740.db2.gz DYOKXNYRPWMRNI-FRRDWIJNSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@H]1C[C@@H](C[N@H+](C)CC(C)(C)C)CC[NH2+]1 ZINC000235657591 177323401 /nfs/dbraw/zinc/32/34/01/177323401.db2.gz FCYPYXKPLZXTPS-RYUDHWBXSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H]1C[C@@H](C[NH+]2CCC(C)(C)CC2)CC[NH2+]1 ZINC000235698666 177325106 /nfs/dbraw/zinc/32/51/06/177325106.db2.gz TUFVVJRPBBRDJW-STQMWFEESA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]1C[C@@H]([NH3+])CC[N@@H+]1CCC1CCCC1 ZINC000049713046 177326420 /nfs/dbraw/zinc/32/64/20/177326420.db2.gz OCGLWQCRBLRXMP-AAEUAGOBSA-N 2 0 210.365 2.378 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CCC2(F)CCC2)CC[N@@H+]1C ZINC000309808496 177331095 /nfs/dbraw/zinc/33/10/95/177331095.db2.gz SUFSYYKKHQJNID-RYUDHWBXSA-N 2 0 228.355 2.341 20 0 BEADRP C[C@H]1C[C@@H]([NH2+]CCc2ccccc2O)CC[N@@H+]1C ZINC000154920269 177332532 /nfs/dbraw/zinc/33/25/32/177332532.db2.gz IHAAYCHBXCUWIN-JSGCOSHPSA-N 2 0 248.370 2.007 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C2CC[NH2+]CC2)[C@@H](C)C1 ZINC000226170910 177357020 /nfs/dbraw/zinc/35/70/20/177357020.db2.gz VPWYBMUIIVTFQE-NTZNESFSSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H]1C[C@H](C[NH3+])C[N@@H+]1CC1CCCCC1 ZINC000122312674 177361289 /nfs/dbraw/zinc/36/12/89/177361289.db2.gz CGUUJETWSSGYCW-WCQYABFASA-N 2 0 210.365 2.236 20 0 BEADRP C[C@H]1C[C@H](C[NH3+])C[N@@H+]1Cc1ccc2c(c1)CCC2 ZINC000131760200 177361559 /nfs/dbraw/zinc/36/15/59/177361559.db2.gz OXGZFWVRIBTNJD-GXTWGEPZSA-N 2 0 244.382 2.344 20 0 BEADRP C[C@H]1C[C@H](C[NH+]2CCCCCC2)CC[NH2+]1 ZINC000235661647 177362188 /nfs/dbraw/zinc/36/21/88/177362188.db2.gz FVAWEZGWWQQVMN-QWHCGFSZSA-N 2 0 210.365 2.251 20 0 BEADRP C[C@H]1C[C@H](C[NH2+]C2(C)CCCC2)CC[NH2+]1 ZINC000235663220 177362396 /nfs/dbraw/zinc/36/23/96/177362396.db2.gz WWYNKOJFJWMGOR-NWDGAFQWSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]1C[C@H](C[NH2+]C2CCCCC2)CC[NH2+]1 ZINC000235663776 177362447 /nfs/dbraw/zinc/36/24/47/177362447.db2.gz BHKUCAXBACCRSY-NWDGAFQWSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@H]1C[C@H]([NH2+]CCN(C)C)CC(C)(C)C1 ZINC000019279441 177369334 /nfs/dbraw/zinc/36/93/34/177369334.db2.gz VDBLEXLJBNFLJP-RYUDHWBXSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]CCCCF ZINC000336713684 177369413 /nfs/dbraw/zinc/36/94/13/177369413.db2.gz VSEKDGSSWCAMSE-WOPDTQHZSA-N 2 0 216.344 2.054 20 0 BEADRP C[C@H]1C[C@H](NCC[NH3+])c2ccsc2S1 ZINC000127644706 177369618 /nfs/dbraw/zinc/36/96/18/177369618.db2.gz RUVXIKULOIVMEG-CBAPKCEASA-N 2 0 228.386 2.222 20 0 BEADRP C[C@@H]1C[C@@H]([NH2+]CCC2CC[NH+](C)CC2)[C@H]1C ZINC000336686218 177431794 /nfs/dbraw/zinc/43/17/94/177431794.db2.gz UQHMKAMHOCYEAI-MBNYWOFBSA-N 2 0 224.392 2.352 20 0 BEADRP C[C@]1(C[NH2+]Cc2cccs2)CCC[NH2+]C1 ZINC000062862189 177462923 /nfs/dbraw/zinc/46/29/23/177462923.db2.gz QJKZGYXYMQDYBE-LBPRGKRZSA-N 2 0 224.373 2.227 20 0 BEADRP C([C@H]1CC[NH2+]C1)[N@@H+]1CCC[C@@H]1C1CCCC1 ZINC000225984977 487642585 /nfs/dbraw/zinc/64/25/85/487642585.db2.gz FKKGFYYKAWFZGY-GXTWGEPZSA-N 2 0 222.376 2.251 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@@H](C)[C@@H]2CC2(F)F)CC1 ZINC000666226650 487645059 /nfs/dbraw/zinc/64/50/59/487645059.db2.gz BQADOJZPLAFUCQ-JQWIXIFHSA-N 2 0 246.345 2.493 20 0 BEADRP CC(C)[NH+]1CCC([NH2+][C@H](C)[C@H]2CC2(F)F)CC1 ZINC000666226654 487645127 /nfs/dbraw/zinc/64/51/27/487645127.db2.gz BQADOJZPLAFUCQ-ZYHUDNBSSA-N 2 0 246.345 2.493 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@H](C)[C@H]2CC2(F)F)CC1 ZINC000666227575 487648454 /nfs/dbraw/zinc/64/84/54/487648454.db2.gz OOLXVPJXBGIWDE-ZYHUDNBSSA-N 2 0 246.345 2.494 20 0 BEADRP C[C@H]([NH2+][C@@H]1CC2CCC1CC2)[C@H]1CCC[NH2+]1 ZINC000400690096 226349619 /nfs/dbraw/zinc/34/96/19/226349619.db2.gz YVEBUJKQOROWDE-YOMYCBHVSA-N 2 0 222.376 2.295 20 0 BEADRP CCCCOCC[N@@H+]1C[C@H](C[NH3+])[C@H](C)C[C@@H]1C ZINC000397338386 262730083 /nfs/dbraw/zinc/73/00/83/262730083.db2.gz ZAYQNTLECAVDDW-RDBSUJKOSA-N 2 0 242.407 2.108 20 0 BEADRP C[C@@H](C[NH2+]CC[C@@H]1CC[NH2+]C1)C(C)(C)C ZINC000162946163 487672370 /nfs/dbraw/zinc/67/23/70/487672370.db2.gz YQXFCZGIRDLCFU-NWDGAFQWSA-N 2 0 212.381 2.258 20 0 BEADRP C[NH2+]C[C@H]1CC[N@H+](C[C@H](C)C(C)(C)C)C1 ZINC000162989324 487676991 /nfs/dbraw/zinc/67/69/91/487676991.db2.gz RXFKURYNWJQPFN-NWDGAFQWSA-N 2 0 212.381 2.210 20 0 BEADRP FCCCC[N@@H+]1CCC[C@H](n2ccnc2)C1 ZINC000671680514 487686564 /nfs/dbraw/zinc/68/65/64/487686564.db2.gz IIHADWDXLJJCGX-LBPRGKRZSA-N 2 0 225.311 2.270 20 0 BEADRP CCC[N@H+](Cc1cncc(C)c1)C1CC[NH2+]CC1 ZINC000228618445 487690403 /nfs/dbraw/zinc/69/04/03/487690403.db2.gz HOFVRSRGFGNVDP-UHFFFAOYSA-N 2 0 247.386 2.354 20 0 BEADRP CC[C@@H]1C[C@H](C)C[N@@H+]1CC[C@H]1CC[NH2+]C1 ZINC000399148422 262777184 /nfs/dbraw/zinc/77/71/84/262777184.db2.gz GCVIQBLCXQRYEQ-YNEHKIRRSA-N 2 0 210.365 2.106 20 0 BEADRP CCC[C@@H](C)[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000233279145 487704548 /nfs/dbraw/zinc/70/45/48/487704548.db2.gz IDVMMLVBKMBHLU-VXGBXAGGSA-N 2 0 210.365 2.439 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]C[C@@H]1CCC[C@@H](C)C1 ZINC000414851161 487709773 /nfs/dbraw/zinc/70/97/73/487709773.db2.gz OQANYDUFWXNJIL-FRRDWIJNSA-N 2 0 212.381 2.258 20 0 BEADRP C[NH2+]C[C@H](C)C[NH2+]C[C@@H]1CCC[C@H](C)C1 ZINC000414851162 487710419 /nfs/dbraw/zinc/71/04/19/487710419.db2.gz OQANYDUFWXNJIL-RWMBFGLXSA-N 2 0 212.381 2.258 20 0 BEADRP CCCOc1ccc(C[N@@H+]2CC[C@H](C[NH3+])C2)cc1 ZINC000052920449 487732658 /nfs/dbraw/zinc/73/26/58/487732658.db2.gz QAJZATKFMFKIEX-CQSZACIVSA-N 2 0 248.370 2.256 20 0 BEADRP C[C@H](c1ccncc1)[N@@H+]1CCC[C@H]([C@H](C)[NH3+])C1 ZINC000251266709 487753062 /nfs/dbraw/zinc/75/30/62/487753062.db2.gz MUUPRRMLDMJSTE-SCRDCRAPSA-N 2 0 233.359 2.202 20 0 BEADRP CC[C@@H]1C[N@@H+]([C@H](C)c2ccncc2)CC[C@@H]1[NH3+] ZINC000251585584 487772071 /nfs/dbraw/zinc/77/20/71/487772071.db2.gz CMWOQXROWDZXLO-BZPMIXESSA-N 2 0 233.359 2.202 20 0 BEADRP [NH3+]C[C@]12CCC[C@H]1C[N@H+](Cc1ccccc1F)C2 ZINC000385231109 487774302 /nfs/dbraw/zinc/77/43/02/487774302.db2.gz GYWSWSXDPRGNPR-ZFWWWQNUSA-N 2 0 248.345 2.387 20 0 BEADRP C[C@H](c1cccnc1)[N@@H+]1C[C@@H]2CCC[C@]2(C[NH3+])C1 ZINC000385302053 487780063 /nfs/dbraw/zinc/78/00/63/487780063.db2.gz VGYZTJOXFSAWTN-SNPRPXQTSA-N 2 0 245.370 2.203 20 0 BEADRP C[C@H](C[NH2+]CC[C@@H]1CC[NH2+]C1)C(C)(C)C ZINC000162946275 487793599 /nfs/dbraw/zinc/79/35/99/487793599.db2.gz YQXFCZGIRDLCFU-VXGBXAGGSA-N 2 0 212.381 2.258 20 0 BEADRP CC[C@@H]1C[N@H+](Cc2ccc(OC)cc2)CC[C@H]1[NH3+] ZINC000251770957 487797030 /nfs/dbraw/zinc/79/70/30/487797030.db2.gz MLFBPYQMOPIRBW-UKRRQHHQSA-N 2 0 248.370 2.254 20 0 BEADRP CC[C@@H](C)[N@H+](CC)CC[C@H]1CCC[NH2+]C1 ZINC000251863235 487803854 /nfs/dbraw/zinc/80/38/54/487803854.db2.gz OSROTPFDVIGAMR-CHWSQXEVSA-N 2 0 212.381 2.497 20 0 BEADRP CC[C@H]1C[N@H+](Cc2cccc(OC)c2)CC[C@H]1[NH3+] ZINC000251922087 487807996 /nfs/dbraw/zinc/80/79/96/487807996.db2.gz YOBRXQPRMUSGAU-DZGCQCFKSA-N 2 0 248.370 2.254 20 0 BEADRP Cc1cccc([C@H]2CC[N@H+](CCC[NH3+])C2)c1 ZINC000414739951 487820289 /nfs/dbraw/zinc/82/02/89/487820289.db2.gz CMRQNHSLHMBRKK-AWEZNQCLSA-N 2 0 218.344 2.133 20 0 BEADRP CCC[C@H](C[NH2+]CCC1CC[NH+](C)CC1)OC ZINC000386152049 487828833 /nfs/dbraw/zinc/82/88/33/487828833.db2.gz SIHYHUNLOVAJIT-CQSZACIVSA-N 2 0 242.407 2.123 20 0 BEADRP Cc1ccc(CCC[NH2+][C@H]2CCC[C@@H]([NH3+])C2)cn1 ZINC000414932889 487830216 /nfs/dbraw/zinc/83/02/16/487830216.db2.gz WDMANDTWGROWHG-CABCVRRESA-N 2 0 247.386 2.182 20 0 BEADRP COCCN(CC[NH2+]C(C)(C)C)C1CCCC1 ZINC000666624803 487847258 /nfs/dbraw/zinc/84/72/58/487847258.db2.gz OTMHBWJGMKGNFN-UHFFFAOYSA-N 2 0 242.407 2.266 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]C[C@@H]2CC[C@H]3C[C@H]3C2)C1 ZINC000403345040 322954525 /nfs/dbraw/zinc/95/45/25/322954525.db2.gz JROVBPHKGMLYNA-ITGHMWBKSA-N 2 0 222.376 2.282 20 0 BEADRP CCc1ccc(C[NH2+][C@@H]2CC[NH2+]C[C@H]2C)s1 ZINC000309331797 487867256 /nfs/dbraw/zinc/86/72/56/487867256.db2.gz IYPGJGPJIAKXAB-ZWNOBZJWSA-N 2 0 238.400 2.398 20 0 BEADRP CC(C)(C[NH2+]C[C@H]([NH3+])C1CC1)c1ccccc1 ZINC000666834256 487881598 /nfs/dbraw/zinc/88/15/98/487881598.db2.gz LOPSKEFVNJAJAE-AWEZNQCLSA-N 2 0 232.371 2.291 20 0 BEADRP c1ccc(C2CC2)c(CN[C@@H]2CCC[NH2+]C2)c1 ZINC000666814163 487884877 /nfs/dbraw/zinc/88/48/77/487884877.db2.gz QQIMVEURDSBANP-CQSZACIVSA-N 2 0 230.355 2.406 20 0 BEADRP CC(C)(C[NH2+]CC1([NH3+])CCC1)c1ccccc1 ZINC000666828742 487888169 /nfs/dbraw/zinc/88/81/69/487888169.db2.gz CXCCIXMJFWNYNX-UHFFFAOYSA-N 2 0 232.371 2.435 20 0 BEADRP C[C@@H](CCC(F)(F)F)[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000666858016 487891681 /nfs/dbraw/zinc/89/16/81/487891681.db2.gz SVUPTBDQLGHCMX-VHSXEESVSA-N 2 0 238.297 2.449 20 0 BEADRP CC[C@@H]([NH3+])C[NH2+]CC(C)(C)c1ccccc1 ZINC000666910414 487901789 /nfs/dbraw/zinc/90/17/89/487901789.db2.gz DYIUIGGSHPTOIW-CYBMUJFWSA-N 2 0 220.360 2.291 20 0 BEADRP CN1CC(C[N@H+](C)C/C=C/c2ccc(F)cc2)C1 ZINC000668539738 487904594 /nfs/dbraw/zinc/90/45/94/487904594.db2.gz KHHPBNLKDGVILH-ONEGZZNKSA-N 2 0 248.345 2.332 20 0 BEADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H]1C[C@@H](C)O[C@@H](C)C1 ZINC000666936658 487907817 /nfs/dbraw/zinc/90/78/17/487907817.db2.gz VYBXUTOBQPQUJF-RVMXOQNASA-N 2 0 228.380 2.050 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2CC23CC[NH2+]CC3)cc1F ZINC000666952315 487913964 /nfs/dbraw/zinc/91/39/64/487913964.db2.gz QODUKAGYLAYISW-AWEZNQCLSA-N 2 0 248.345 2.366 20 0 BEADRP CCC[C@@H](C)C[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000666952365 487914023 /nfs/dbraw/zinc/91/40/23/487914023.db2.gz SYSWMWKGCIKWRM-NEPJUHHUSA-N 2 0 210.365 2.154 20 0 BEADRP C[C@@H]1CCCC[C@H]1[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000666954055 487916104 /nfs/dbraw/zinc/91/61/04/487916104.db2.gz ONZUDKWXBNDKJD-UPJWGTAASA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H](CCC1CC1)[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000666953884 487916134 /nfs/dbraw/zinc/91/61/34/487916134.db2.gz KBEGJEBWEKKFKH-AAEUAGOBSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@@H]1CCC[N@H+](CC[C@H]2CCCO2)[C@@H]1CC[NH3+] ZINC000404296872 487917311 /nfs/dbraw/zinc/91/73/11/487917311.db2.gz OBYNMRCZALQCJE-MGPQQGTHSA-N 2 0 240.391 2.005 20 0 BEADRP CC(C)[C@H]1CCCC[C@H]1[NH2+][C@@H]1CC[NH2+]C1 ZINC000126023793 487938736 /nfs/dbraw/zinc/93/87/36/487938736.db2.gz JHDLNWFINJHWCL-JHJVBQTASA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]CCOCC[NH+](C)C)CC1 ZINC000235288655 487939636 /nfs/dbraw/zinc/93/96/36/487939636.db2.gz ZEQBXCGKKDZRQM-ZIAGYGMSSA-N 2 0 242.407 2.123 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]Cc1ccnc2ccccc12 ZINC000564970365 322984223 /nfs/dbraw/zinc/98/42/23/322984223.db2.gz JTFBWNZQOYZSRT-RYUDHWBXSA-N 2 0 243.354 2.450 20 0 BEADRP CCC[C@@H](C)[N@@H+]1CC[C@H](c2nccn2C)C1 ZINC000564736271 323014364 /nfs/dbraw/zinc/01/43/64/323014364.db2.gz NQRFKYRAPDDCRK-NEPJUHHUSA-N 2 0 221.348 2.398 20 0 BEADRP Cn1cncc1CC[N@H+](C1CC1)C1CCCC1 ZINC000562680909 323027127 /nfs/dbraw/zinc/02/71/27/323027127.db2.gz OUQYYWOOGHKBSB-UHFFFAOYSA-N 2 0 233.359 2.370 20 0 BEADRP CC[C@H]([NH2+]CCC[NH2+]C(C)C)[C@H]1C[C@@H]1C ZINC000562956421 323034821 /nfs/dbraw/zinc/03/48/21/323034821.db2.gz SUMPYHRWEXDVAL-AVGNSLFASA-N 2 0 212.381 2.399 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]CCCc1cccs1 ZINC000569801914 323041082 /nfs/dbraw/zinc/04/10/82/323041082.db2.gz RXQZBSBBKMFFBB-AAEUAGOBSA-N 2 0 238.400 2.398 20 0 BEADRP C[N@@H+]1CCC[C@H]2C[NH+](CC3(C)CC3)CC[C@H]21 ZINC000569904072 323043992 /nfs/dbraw/zinc/04/39/92/323043992.db2.gz CVXSMHBKIYJEFW-QWHCGFSZSA-N 2 0 222.376 2.203 20 0 BEADRP C[NH+](C)C1CC([NH2+]C[C@@H]2CC=CCC2)C1 ZINC000569987609 323046681 /nfs/dbraw/zinc/04/66/81/323046681.db2.gz CEKBWNBKPIHXOH-PNESKVBLSA-N 2 0 208.349 2.025 20 0 BEADRP CC(C)[C@H](C)[NH2+]C[C@@H](N)c1ccccc1 ZINC000319631699 323085506 /nfs/dbraw/zinc/08/55/06/323085506.db2.gz ZOWRILNDYPAEQC-WCQYABFASA-N 2 0 206.333 2.321 20 0 BEADRP C[C@H]1CCCC[C@H]1C[N@@H+]1CC[C@@H]2C[NH2+]C[C@@H]21 ZINC000394824365 323085697 /nfs/dbraw/zinc/08/56/97/323085697.db2.gz JEDMBDYJGQQACR-CRWXNKLISA-N 2 0 222.376 2.106 20 0 BEADRP C[C@H](C[NH2+][C@H]1CCC[C@H]2C[C@H]21)C[NH+]1CCCC1 ZINC000408510379 323120589 /nfs/dbraw/zinc/12/05/89/323120589.db2.gz NFIWDWRFZSIXOJ-BARDWOONSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]([NH2+]C[C@@H]1C[C@H]1c1ccccc1)[C@H](C)[NH3+] ZINC000415009643 323152541 /nfs/dbraw/zinc/15/25/41/323152541.db2.gz GDPDHYFFKWDLCO-XCCSTKFXSA-N 2 0 218.344 2.115 20 0 BEADRP CC[C@H]([NH2+]CCCC[NH+](C)C)C1CCOCC1 ZINC000531963250 323158824 /nfs/dbraw/zinc/15/88/24/323158824.db2.gz GJTNTRPSJONUNV-AWEZNQCLSA-N 2 0 242.407 2.123 20 0 BEADRP CCC1CC([NH2+]CCN2CC[C@@H](C)C2)C1 ZINC000308970603 323182821 /nfs/dbraw/zinc/18/28/21/323182821.db2.gz ZDPUPJKZXDJSPP-PNESKVBLSA-N 2 0 210.365 2.106 20 0 BEADRP CC(C)[C@H]([NH2+]CCCC[NH+](C)C)C1CC1 ZINC000308987547 323183551 /nfs/dbraw/zinc/18/35/51/323183551.db2.gz KELKTZADLQCXOS-ZDUSSCGKSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@H](O)C[C@H](C)C[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000398578336 323186758 /nfs/dbraw/zinc/18/67/58/323186758.db2.gz LAPFPTIBGQDUBM-LWWSYDQCSA-N 2 0 248.370 2.128 20 0 BEADRP CC(C)(CO)CC[NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000395120823 323187883 /nfs/dbraw/zinc/18/78/83/323187883.db2.gz GOKMNWXNKYQMNR-KGLIPLIRSA-N 2 0 248.370 2.129 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]CC[C@@H]1CC=CCC1 ZINC000530217071 323217196 /nfs/dbraw/zinc/21/71/96/323217196.db2.gz FCFVPJNMQIDJIK-HZSPNIEDSA-N 2 0 222.376 2.450 20 0 BEADRP Cc1ccc(CC[NH2+][C@H]2CC[N@@H+](C)C[C@@H]2C)o1 ZINC000532450368 323265022 /nfs/dbraw/zinc/26/50/22/323265022.db2.gz CVFGAVALJIIATO-FZMZJTMJSA-N 2 0 236.359 2.060 20 0 BEADRP CC[C@@H]([NH2+][C@H](C)CC[NH+](C)C)C1CCOCC1 ZINC000532491507 323269017 /nfs/dbraw/zinc/26/90/17/323269017.db2.gz BSNHVBIHFSELJS-TZMCWYRMSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H]([NH2+]C(C1CCC1)C1CCC1)[C@H](C)[NH3+] ZINC000324774580 323283305 /nfs/dbraw/zinc/28/33/05/323283305.db2.gz DTPWIVULHWLFIP-VHSXEESVSA-N 2 0 210.365 2.281 20 0 BEADRP C[C@@H]([NH2+]CCC[NH+]1CCCC1)[C@@H]1C[C@H]1C ZINC000321898906 323390518 /nfs/dbraw/zinc/39/05/18/323390518.db2.gz NCANEAXTABIYIQ-JHJVBQTASA-N 2 0 210.365 2.106 20 0 BEADRP C[NH+](C)CCCC[NH2+]C(C1CC1)C1CC1 ZINC000045663410 323845041 /nfs/dbraw/zinc/84/50/41/323845041.db2.gz XGEUEKSOFUXTAZ-UHFFFAOYSA-N 2 0 210.365 2.106 20 0 BEADRP C[C@H]1CCC[C@H]1[NH2+]CCC1CC[NH+](C)CC1 ZINC000122079440 324026103 /nfs/dbraw/zinc/02/61/03/324026103.db2.gz WVFNHRHETGZGOS-GXTWGEPZSA-N 2 0 224.392 2.497 20 0 BEADRP COCC1([NH2+][C@H](C)C[C@H]2CCCCC[NH2+]2)CC1 ZINC000517730963 324176537 /nfs/dbraw/zinc/17/65/37/324176537.db2.gz ROFIFPVGFFKMLB-CHWSQXEVSA-N 2 0 240.391 2.066 20 0 BEADRP COCC1([NH2+][C@@H](C)C[C@@H]2CCCCC[NH2+]2)CC1 ZINC000517730966 324176632 /nfs/dbraw/zinc/17/66/32/324176632.db2.gz ROFIFPVGFFKMLB-STQMWFEESA-N 2 0 240.391 2.066 20 0 BEADRP CCCCC[N@@H+]1C[C@H](C[NH3+])[C@@H](C)C[C@@H]1C ZINC000397339383 324213199 /nfs/dbraw/zinc/21/31/99/324213199.db2.gz VBHNJPVWBHBDFS-AVGNSLFASA-N 2 0 212.381 2.482 20 0 BEADRP CC1(C)CC(C[NH+]2CCC(C[NH3+])CC2)C1 ZINC000530208316 324524431 /nfs/dbraw/zinc/52/44/31/324524431.db2.gz RSWRTOLTLAZOKV-UHFFFAOYSA-N 2 0 210.365 2.093 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+]CC1CC=CC1 ZINC000530215989 324532662 /nfs/dbraw/zinc/53/26/62/324532662.db2.gz LKHRGPUYSXWMOP-OLZOCXBDSA-N 2 0 208.349 2.060 20 0 BEADRP C[C@@H]([NH2+]CC[C@@H]1CC=CCC1)[C@@H]1CCC[NH2+]1 ZINC000530217552 324535050 /nfs/dbraw/zinc/53/50/50/324535050.db2.gz HXBMABMNCBNPFG-MCIONIFRSA-N 2 0 222.376 2.463 20 0 BEADRP C[C@H](C[C@@H]1CCC[NH2+]1)[NH2+]C[C@@H](C)c1ccncc1 ZINC000530242718 324553445 /nfs/dbraw/zinc/55/34/45/324553445.db2.gz CTIUGBLDDHKXOK-NFAWXSAZSA-N 2 0 247.386 2.305 20 0 BEADRP C[C@@H](C[NH2+]C[C@@H]1CC[NH2+][C@H](C)C1)c1ccncc1 ZINC000530244367 324554738 /nfs/dbraw/zinc/55/47/38/324554738.db2.gz KPDBKKFQYBDFNN-BFHYXJOUSA-N 2 0 247.386 2.163 20 0 BEADRP C[C@@H]([NH2+]CC1CC[NH+](C)CC1)C(C)(C)C ZINC000126357251 324694720 /nfs/dbraw/zinc/69/47/20/324694720.db2.gz CNJJBPSFYFDZRN-LLVKDONJSA-N 2 0 212.381 2.352 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@@H]2CCC[N@H+](C)C2)C1 ZINC000070643707 325020274 /nfs/dbraw/zinc/02/02/74/325020274.db2.gz DSABJECGWJNNGA-AGIUHOORSA-N 2 0 210.365 2.106 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H](C)C1CCOCC1 ZINC000131472386 325154989 /nfs/dbraw/zinc/15/49/89/325154989.db2.gz PJJHNFWGCKUZLM-ZDUSSCGKSA-N 2 0 242.407 2.123 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]CCC2CCCC2)C1 ZINC000086403282 325614388 /nfs/dbraw/zinc/61/43/88/325614388.db2.gz WDQFDVNLLKGOGP-STQMWFEESA-N 2 0 210.365 2.426 20 0 BEADRP COC[C@@H](C)C[NH2+]CCCCC[NH+]1CCCC1 ZINC000552363130 325625581 /nfs/dbraw/zinc/62/55/81/325625581.db2.gz CQPJVJCWIFUOKW-AWEZNQCLSA-N 2 0 242.407 2.125 20 0 BEADRP CCC(C)(C)[C@H](C)[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000565710425 325946627 /nfs/dbraw/zinc/94/66/27/325946627.db2.gz RCAIZGXKQCXDAU-NWDGAFQWSA-N 2 0 212.381 2.400 20 0 BEADRP CC(C)[C@H]([NH3+])CNCc1cccc(F)c1F ZINC000566961465 326097193 /nfs/dbraw/zinc/09/71/93/326097193.db2.gz UXVALRINKHSXRD-LLVKDONJSA-N 2 0 228.286 2.038 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+][C@H]2CC[C@@H]2C2CC2)C1 ZINC000309987664 326178326 /nfs/dbraw/zinc/17/83/26/326178326.db2.gz ZEXSSEKPTANXGG-BNOWGMLFSA-N 2 0 222.376 2.106 20 0 BEADRP C[C@@]1(c2ccccc2)CC[C@H](N[C@H]2CC[NH2+]C2)C1 ZINC000567487370 326202706 /nfs/dbraw/zinc/20/27/06/326202706.db2.gz LEMGKGIQCSBGBA-HRCADAONSA-N 2 0 244.382 2.448 20 0 BEADRP COC[C@H](CC(C)C)[NH2+]CCC[NH2+]C(C)C ZINC000567490170 326203700 /nfs/dbraw/zinc/20/37/00/326203700.db2.gz XCCYQIAQUTZIRV-ZDUSSCGKSA-N 2 0 230.396 2.025 20 0 BEADRP Cc1ccc2c(c1)[C@H]([NH2+][C@@H](C)C[C@H](C)[NH3+])CO2 ZINC000567648430 326238878 /nfs/dbraw/zinc/23/88/78/326238878.db2.gz QJVJSFRGARDJIB-GMXVVIOVSA-N 2 0 234.343 2.144 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]CCC[C@H]2CCCCO2)C1 ZINC000568249011 326334801 /nfs/dbraw/zinc/33/48/01/326334801.db2.gz DTCFWNNMAMNELH-HZSPNIEDSA-N 2 0 240.391 2.195 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+]CCC[C@@H]2CCCCO2)C1 ZINC000568249014 326334809 /nfs/dbraw/zinc/33/48/09/326334809.db2.gz DTCFWNNMAMNELH-RDBSUJKOSA-N 2 0 240.391 2.195 20 0 BEADRP CC(C)C(C)(C)[NH2+]C[C@@H]1CC[NH2+][C@@H](C)C1 ZINC000568727301 326373755 /nfs/dbraw/zinc/37/37/55/326373755.db2.gz RXXVXAXWZYYCAX-NWDGAFQWSA-N 2 0 212.381 2.399 20 0 BEADRP CCC(C)(C)[C@H](C)[NH2+]CCC[NH+](C)C ZINC000569190888 326394364 /nfs/dbraw/zinc/39/43/64/326394364.db2.gz IMFOITSKWLLPCY-NSHDSACASA-N 2 0 200.370 2.352 20 0 BEADRP Cc1ccc(CC[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)o1 ZINC000677236881 488003664 /nfs/dbraw/zinc/00/36/64/488003664.db2.gz VLBTZYFYIMMGPE-ZIAGYGMSSA-N 2 0 248.370 2.347 20 0 BEADRP CC1(C[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)CCC1 ZINC000400964498 488011761 /nfs/dbraw/zinc/01/17/61/488011761.db2.gz JYPYJIBJUPGAPI-JHJVBQTASA-N 2 0 222.376 2.154 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2CCCC[C@@H]2C[NH3+])o1 ZINC000084216716 488037828 /nfs/dbraw/zinc/03/78/28/488037828.db2.gz HGWHQHJMYNQJCY-DGCLKSJQSA-N 2 0 222.332 2.195 20 0 BEADRP C[C@@H](CCc1ccccc1)[NH2+]CC12CC(C1)C[NH2+]2 ZINC000663497083 488045840 /nfs/dbraw/zinc/04/58/40/488045840.db2.gz BFOIFAOCEVBEAA-JEYLPNPQSA-N 2 0 244.382 2.349 20 0 BEADRP CC(C)CC[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC000084478513 488053897 /nfs/dbraw/zinc/05/38/97/488053897.db2.gz UQBUNANRKPVVNO-GFCCVEGCSA-N 2 0 212.381 2.495 20 0 BEADRP CC[C@H]1C[N@H+](Cc2cccs2)CC[C@@H]1[NH3+] ZINC000166087426 488054311 /nfs/dbraw/zinc/05/43/11/488054311.db2.gz QZIHNVAVIARPDN-JQWIXIFHSA-N 2 0 224.373 2.307 20 0 BEADRP COc1c(C)cccc1C[NH2+][C@H](C)C[C@H](C)[NH3+] ZINC000656200807 488066345 /nfs/dbraw/zinc/06/63/45/488066345.db2.gz QZEJWNANYCYLTA-NWDGAFQWSA-N 2 0 236.359 2.219 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H](C)Cc1ccccn1 ZINC000656200797 488066874 /nfs/dbraw/zinc/06/68/74/488066874.db2.gz FLNLIMYXLKOUCK-OLZOCXBDSA-N 2 0 235.375 2.120 20 0 BEADRP CC[C@@H]1CC[N@H+](CCCC2CC[NH2+]CC2)C1 ZINC000166327935 488074749 /nfs/dbraw/zinc/07/47/49/488074749.db2.gz OVIWBDNQTBPXQW-CYBMUJFWSA-N 2 0 224.392 2.498 20 0 BEADRP Cc1ccnc(CN(C)C[C@H]2CCC[N@H+](C)C2)c1 ZINC000683010002 488089360 /nfs/dbraw/zinc/08/93/60/488089360.db2.gz BEOOTMXSNPJAFD-AWEZNQCLSA-N 2 0 247.386 2.164 20 0 BEADRP CC(C)C[C@@H]([NH3+])C(=O)Nc1ccc([C@H](C)[NH3+])cc1 ZINC000669512427 488118883 /nfs/dbraw/zinc/11/88/83/488118883.db2.gz SGGWSVGFBJVDFK-GXFFZTMASA-N 2 0 249.358 2.018 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CC[N@H+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)C1 ZINC000403506644 488124113 /nfs/dbraw/zinc/12/41/13/488124113.db2.gz BAQZPTLXGCIHPS-MRTXSQPYSA-N 2 0 222.376 2.092 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)C[C@H]1C[NH3+] ZINC000403676142 488130178 /nfs/dbraw/zinc/13/01/78/488130178.db2.gz VQKPSJBUTWGCDH-ARILJUKYSA-N 2 0 236.403 2.339 20 0 BEADRP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](C[C@@H]3CC[C@@H]4C[C@@H]4C3)C[C@@H]21 ZINC000403697565 488132329 /nfs/dbraw/zinc/13/23/29/488132329.db2.gz BMFJUTMJHJCEHR-FGZZBPHYSA-N 2 0 248.414 2.482 20 0 BEADRP C[C@H]([NH3+])C1CC[NH+](C[C@@H]2CC[C@H]3C[C@H]3C2)CC1 ZINC000403690936 488132521 /nfs/dbraw/zinc/13/25/21/488132521.db2.gz YRYWONFGFQZXFK-MYZSUADSSA-N 2 0 236.403 2.482 20 0 BEADRP c1cc(C[NH+]2C[C@@H]3C[NH2+]C[C@H]3C2)cc(C2CC2)c1 ZINC000094522263 487538051 /nfs/dbraw/zinc/53/80/51/487538051.db2.gz JVXFIFBWPSWNAN-HOTGVXAUSA-N 2 0 242.366 2.215 20 0 BEADRP C[C@@H]1C[N@H+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC[C@@H]1[NH3+] ZINC000403448159 487544018 /nfs/dbraw/zinc/54/40/18/487544018.db2.gz XMBYBCVMRXEWDR-POQQGIQPSA-N 2 0 222.376 2.092 20 0 BEADRP CC(C)N(C)CC[NH2+][C@H]1CCC[C@@H]2C[C@@H]21 ZINC000382184660 487533265 /nfs/dbraw/zinc/53/32/65/487533265.db2.gz AQSSUTLVWGMEDC-AGIUHOORSA-N 2 0 210.365 2.105 20 0 BEADRP CCCCN(C)CC[NH2+][C@H]1CCC[C@@H]2C[C@@H]21 ZINC000667860638 488140251 /nfs/dbraw/zinc/14/02/51/488140251.db2.gz VHMAMHPYLRAFEB-RDBSUJKOSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@@H]1C[N@H+](CCc2ccccc2)CC[C@@H]1[NH3+] ZINC000022130142 487478347 /nfs/dbraw/zinc/47/83/47/487478347.db2.gz JBWFBMMQKGBHTC-CABCVRRESA-N 2 0 232.371 2.288 20 0 BEADRP C[N@@H+]1CCC[C@H](CC[NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)C1 ZINC000668236710 487518771 /nfs/dbraw/zinc/51/87/71/487518771.db2.gz UOSBEYXVALMPSV-APIJFGDWSA-N 2 0 236.403 2.497 20 0 BEADRP C[N@@H+]1CCC[C@@H](CC[NH2+][C@H]2CCC[C@@H]3C[C@@H]32)C1 ZINC000668236713 487519107 /nfs/dbraw/zinc/51/91/07/487519107.db2.gz UOSBEYXVALMPSV-XGUBFFRZSA-N 2 0 236.403 2.497 20 0 BEADRP CC(C)=CCC[N@H+]1CC[C@H]2C[NH2+]C[C@H]2CC1 ZINC000662274143 487523120 /nfs/dbraw/zinc/52/31/20/487523120.db2.gz RIWQBWNFNZCPPN-OKILXGFUSA-N 2 0 222.376 2.274 20 0 BEADRP CC[C@H](CC(F)F)C[N@H+](C)C1CC([NH3+])C1 ZINC000662274265 487523143 /nfs/dbraw/zinc/52/31/43/487523143.db2.gz SJSIHNYCMFDKSY-XNWIYYODSA-N 2 0 220.307 2.089 20 0 BEADRP C([C@@H]1C[C@H]2C[C@H]2C1)[NH+]1CCC([C@@H]2CCC[NH2+]2)CC1 ZINC000662273902 490044662 /nfs/dbraw/zinc/04/46/62/490044662.db2.gz AZCFWFHTKNUYIF-UKMLZYKCSA-N 2 0 248.414 2.497 20 0 BEADRP C[N@H+]1CC=C(C[NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)CC1 ZINC000392262187 487535292 /nfs/dbraw/zinc/53/52/92/487535292.db2.gz IVJMFMAPYMNJAY-HZSPNIEDSA-N 2 0 220.360 2.027 20 0 BEADRP Cc1cc(N2CCC[C@H]([NH2+]C(C)C)C2)cc[nH+]1 ZINC000681384391 487789923 /nfs/dbraw/zinc/78/99/23/487789923.db2.gz QTEHLCJPNQGDAZ-ZDUSSCGKSA-N 2 0 233.359 2.357 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H]2[C@@H]3CCC[C@@H]32)CC1 ZINC000668669233 488088454 /nfs/dbraw/zinc/08/84/54/488088454.db2.gz OXXJQTYFGMUPAO-BTTYYORXSA-N 2 0 222.376 2.249 20 0 BEADRP CN(C)C(C)(C)C[NH2+][C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000379781836 488152007 /nfs/dbraw/zinc/15/20/07/488152007.db2.gz CQGCUQFUCVOJEC-GRYCIOLGSA-N 2 0 210.365 2.105 20 0 BEADRP CC(C)=CCC[NH2+][C@@H]1CC[NH2+]CC1(C)C ZINC000397871224 488160464 /nfs/dbraw/zinc/16/04/64/488160464.db2.gz IXMDTFOCEYJJBD-GFCCVEGCSA-N 2 0 210.365 2.320 20 0 BEADRP C[N@@H+]1CCCC[C@@H]1CC[NH+]1CC[C@@H](C(F)F)C1 ZINC000677729300 488204341 /nfs/dbraw/zinc/20/43/41/488204341.db2.gz BUNUNYHOHPUMGE-VXGBXAGGSA-N 2 0 246.345 2.448 20 0 BEADRP C[C@@H](CCC1CC1)[NH2+]CC1([NH3+])CCCC1 ZINC000398230161 488215427 /nfs/dbraw/zinc/21/54/27/488215427.db2.gz RZKSCNVZYKBSSI-NSHDSACASA-N 2 0 210.365 2.426 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]2C[N@H+](CCC3CCC3)C[C@H]21 ZINC000398648920 488221398 /nfs/dbraw/zinc/22/13/98/488221398.db2.gz KOQRZXPAAWOLSL-BFHYXJOUSA-N 2 0 222.376 2.236 20 0 BEADRP C[C@H]([NH3+])[C@H]1CCC[N@H+](CCC2CCC2)C1 ZINC000398799002 488224633 /nfs/dbraw/zinc/22/46/33/488224633.db2.gz NDJLOEGAYJAMKA-AAEUAGOBSA-N 2 0 210.365 2.236 20 0 BEADRP C[C@@H](C[NH+](C)C)Nc1cc[nH+]c2c(O)cccc12 ZINC000672344934 488253076 /nfs/dbraw/zinc/25/30/76/488253076.db2.gz VXCVPXIZVKFPQW-JTQLQIEISA-N 2 0 245.326 2.302 20 0 BEADRP C[N@H+](C[C@@H]1C[C@H]2C[C@H]2C1)C[C@@H]1CCC[NH+](C)C1 ZINC000659949737 490113159 /nfs/dbraw/zinc/11/31/59/490113159.db2.gz VTYZPKAXOHUPHL-APIJFGDWSA-N 2 0 236.403 2.306 20 0 BEADRP C[N@@H+]1CCC[C@H](CC[NH2+]CC2(C)CCC2)C1 ZINC000459726322 490132836 /nfs/dbraw/zinc/13/28/36/490132836.db2.gz BQMLYWFNXLRPPQ-CYBMUJFWSA-N 2 0 224.392 2.498 20 0 BEADRP CCC[NH+]1CCC([NH2+][C@@H]2CCS[C@H]2C)CC1 ZINC000220841588 490149913 /nfs/dbraw/zinc/14/99/13/490149913.db2.gz KMMAYQOGBVTJCW-WCQYABFASA-N 2 0 242.432 2.344 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H]1CCC[C@@H](OC)C1 ZINC000070325873 490206767 /nfs/dbraw/zinc/20/67/67/490206767.db2.gz JNHZTKZBHGWEIA-ZIAGYGMSSA-N 2 0 242.407 2.266 20 0 BEADRP Cc1cccc(CC[NH2+][C@H](C)C[C@@H]2CCC[NH2+]2)n1 ZINC000415111189 490214757 /nfs/dbraw/zinc/21/47/57/490214757.db2.gz UCYNSSHDNIBOCN-HIFRSBDPSA-N 2 0 247.386 2.053 20 0 BEADRP Cc1cccc(CC[NH2+][C@H](C)C[C@H]2CCC[NH2+]2)n1 ZINC000415111191 490214889 /nfs/dbraw/zinc/21/48/89/490214889.db2.gz UCYNSSHDNIBOCN-UKRRQHHQSA-N 2 0 247.386 2.053 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000403630829 490219849 /nfs/dbraw/zinc/21/98/49/490219849.db2.gz FBIUMXLRKSOSCG-FDYHWXHSSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1CC[C@H]2C[C@H]2C1 ZINC000403630832 490219872 /nfs/dbraw/zinc/21/98/72/490219872.db2.gz FBIUMXLRKSOSCG-MROQNXINSA-N 2 0 210.365 2.282 20 0 BEADRP C[NH2+]CCC[N@H+](C)Cc1ccnc2ccccc12 ZINC000124744742 490401479 /nfs/dbraw/zinc/40/14/79/490401479.db2.gz VBZUCMKRYGJRKH-UHFFFAOYSA-N 2 0 243.354 2.276 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1CC1(C)C)C1CC[NH+](C)CC1 ZINC000222050669 490466090 /nfs/dbraw/zinc/46/60/90/490466090.db2.gz DBINLTSRQDAGHT-DGCLKSJQSA-N 2 0 224.392 2.352 20 0 BEADRP C([C@@H]1C[C@H]2C[C@H]2C1)[N@@H+]1CCCC[C@@H]1[C@H]1CC[NH2+]C1 ZINC000662275365 491085687 /nfs/dbraw/zinc/08/56/87/491085687.db2.gz BIORHJFHZDXEDQ-ARKGTOAJSA-N 2 0 248.414 2.497 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCSC1)C1CC[NH+](C)CC1 ZINC000228552528 491095561 /nfs/dbraw/zinc/09/55/61/491095561.db2.gz VBXBIPPJPXSPMY-RYUDHWBXSA-N 2 0 242.432 2.059 20 0 BEADRP C[C@@H]1C[C@H]([NH2+]C[C@@H]2Cc3ccccc32)CC[N@@H+]1C ZINC000121596499 491106569 /nfs/dbraw/zinc/10/65/69/491106569.db2.gz UJPRUQVFDISSBM-VHDGCEQUSA-N 2 0 244.382 2.399 20 0 BEADRP CC[C@@H]1CC[C@@H](C)[N@H+](CC[C@H]2CC[NH2+]C2)C1 ZINC000304319110 491109967 /nfs/dbraw/zinc/10/99/67/491109967.db2.gz FJFBNEGDHWERFR-MGPQQGTHSA-N 2 0 224.392 2.497 20 0 BEADRP CC[C@H](C)[NH2+]Cc1ccc(C[NH3+])cc1F ZINC000086682311 491124108 /nfs/dbraw/zinc/12/41/08/491124108.db2.gz TUVFFLVNIUDEGE-VIFPVBQESA-N 2 0 210.296 2.173 20 0 BEADRP CC1=CCC[C@@H](C)[C@@H]1C[N@H+](C)CC1CN(C)C1 ZINC000668538700 491127280 /nfs/dbraw/zinc/12/72/80/491127280.db2.gz AJAZHAXIQWLOSX-UKRRQHHQSA-N 2 0 236.403 2.472 20 0 BEADRP C[C@@H](CC1CCC1)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000133406146 491153337 /nfs/dbraw/zinc/15/33/37/491153337.db2.gz HERDWVCQHCTQSK-JSGCOSHPSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[C@@H]1C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C)C1 ZINC000488310704 533722805 /nfs/dbraw/zinc/72/28/05/533722805.db2.gz HJMONTNTFAWEAR-AAVRWANBSA-N 2 0 222.376 2.059 20 0 BEADRP C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000400987788 533795127 /nfs/dbraw/zinc/79/51/27/533795127.db2.gz WIRCYEOTEMFWCJ-ITGHMWBKSA-N 2 0 222.376 2.153 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+]C/C=C\c1ccncc1 ZINC000486964945 533892334 /nfs/dbraw/zinc/89/23/34/533892334.db2.gz IZEYAURUUHORTE-DSYXLKISSA-N 2 0 233.359 2.025 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)[C@H]1C ZINC000401108373 533965221 /nfs/dbraw/zinc/96/52/21/533965221.db2.gz GMBYZQHPGSZNTP-LEZGYBIHSA-N 2 0 222.376 2.009 20 0 BEADRP C[C@H]([NH2+][C@H]1CCc2ccccc2C1)[C@@H]1CCC[NH2+]1 ZINC000400347002 534013111 /nfs/dbraw/zinc/01/31/11/534013111.db2.gz HUVFUDUMNZSXJK-RCBQFDQVSA-N 2 0 244.382 2.274 20 0 BEADRP CC(C)[C@@H]1CC[N@@H+]1CC1CC[NH+](C)CC1 ZINC000892403615 582877433 /nfs/dbraw/zinc/87/74/33/582877433.db2.gz OPIYXLDEFYFKJW-ZDUSSCGKSA-N 2 0 210.365 2.059 20 0 BEADRP C(=C/c1ccncc1)\C[NH2+]CCC[NH+]1CCCC1 ZINC000486980728 527469330 /nfs/dbraw/zinc/46/93/30/527469330.db2.gz OKPDILKALMZDJI-HWKANZROSA-N 2 0 245.370 2.170 20 0 BEADRP CC(C)C1(C[NH2+][C@H](C)[C@@H]2CCC[NH2+]2)CC1 ZINC000400681882 527615043 /nfs/dbraw/zinc/61/50/43/527615043.db2.gz XBOPUHJXIZSUAN-NEPJUHHUSA-N 2 0 210.365 2.153 20 0 BEADRP CC(C)C1(C[NH2+][C@H](C)[C@H]2CCC[NH2+]2)CC1 ZINC000400681889 527615621 /nfs/dbraw/zinc/61/56/21/527615621.db2.gz XBOPUHJXIZSUAN-VXGBXAGGSA-N 2 0 210.365 2.153 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH+](C)C[C@@H]2C[C@@H]2C)[C@H](C)C1 ZINC000488311709 527830907 /nfs/dbraw/zinc/83/09/07/527830907.db2.gz JUGZDWNKHNVVDO-CRWXNKLISA-N 2 0 224.392 2.305 20 0 BEADRP CC[N@H+](C)C[C@H]1CC[NH+](C[C@@H]2CCSC2)C1 ZINC000494960059 527836968 /nfs/dbraw/zinc/83/69/68/527836968.db2.gz XPQLSXMEVCJQLA-OLZOCXBDSA-N 2 0 242.432 2.013 20 0 BEADRP CCCC1(C[NH2+][C@H](C)[C@@H]2CCC[NH2+]2)CC1 ZINC000400674377 528061972 /nfs/dbraw/zinc/06/19/72/528061972.db2.gz VFTBDRAHHSMWIQ-NEPJUHHUSA-N 2 0 210.365 2.297 20 0 BEADRP CC[NH+](CC)C[C@@H]1CC[N@H+](C[C@H]2C[C@H]2C)C1 ZINC000488351655 528176587 /nfs/dbraw/zinc/17/65/87/528176587.db2.gz FSKVYUXDQYLKJT-HZSPNIEDSA-N 2 0 224.392 2.306 20 0 BEADRP CC[NH+](CC)C[C@@H]1CC[N@H+](C[C@H]2C[C@@H]2C)C1 ZINC000488351659 528176796 /nfs/dbraw/zinc/17/67/96/528176796.db2.gz FSKVYUXDQYLKJT-MELADBBJSA-N 2 0 224.392 2.306 20 0 BEADRP CC(C)(C)[C@@H]1CCC[N@@H+]1CC1CC[NH2+]CC1 ZINC000257769296 535075028 /nfs/dbraw/zinc/07/50/28/535075028.db2.gz HCZOXZOSZOAYBD-ZDUSSCGKSA-N 2 0 224.392 2.497 20 0 BEADRP CC1(C[NH2+][C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)CC1 ZINC000261533042 535158206 /nfs/dbraw/zinc/15/82/06/535158206.db2.gz GFYJRLHVLPZXMT-YNEHKIRRSA-N 2 0 222.376 2.297 20 0 BEADRP CC1(C)CCC[C@H]1[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000168770150 535309121 /nfs/dbraw/zinc/30/91/21/535309121.db2.gz VQBZZFNQTVKSCA-VXGBXAGGSA-N 2 0 210.365 2.297 20 0 BEADRP CC(C)OCCC[N@H+](C)CC[C@@H]1CCC[NH+]1C ZINC000348205864 535324803 /nfs/dbraw/zinc/32/48/03/535324803.db2.gz ZFFIWPZNAASUGD-AWEZNQCLSA-N 2 0 242.407 2.218 20 0 BEADRP CCC(C)(C)[N@H+](C)C[C@H]1CC[NH2+][C@@H](C)C1 ZINC000232827468 535356060 /nfs/dbraw/zinc/35/60/60/535356060.db2.gz NPAIHMJSYRRMLS-RYUDHWBXSA-N 2 0 212.381 2.495 20 0 BEADRP CCC[C@H](C)[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000227497852 535653736 /nfs/dbraw/zinc/65/37/36/535653736.db2.gz SIFJNXDVHOKWDX-LBPRGKRZSA-N 2 0 212.381 2.497 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CCC(F)(F)F)[C@@H](C)C1 ZINC000224510960 535768451 /nfs/dbraw/zinc/76/84/51/535768451.db2.gz YUTKJCWMDZNYID-UWVGGRQHSA-N 2 0 238.297 2.259 20 0 BEADRP CC[N@H+](C[C@@H]1CCSC1)[C@H]1CCC[NH2+]CC1 ZINC000261995550 535773421 /nfs/dbraw/zinc/77/34/21/535773421.db2.gz SULOQBLFOQKYPQ-STQMWFEESA-N 2 0 242.432 2.204 20 0 BEADRP CC[C@@H]([NH2+]C1CCC([NH3+])CC1)c1nccs1 ZINC000086730381 535802795 /nfs/dbraw/zinc/80/27/95/535802795.db2.gz RHGQEURIVLGCGG-VQXHTEKXSA-N 2 0 239.388 2.454 20 0 BEADRP CC[C@@H]1C[N@H+](CC[C@@H]2CCC[NH2+]C2)CCS1 ZINC000164179293 535860391 /nfs/dbraw/zinc/86/03/91/535860391.db2.gz AOSMSEJPAJJCTA-QWHCGFSZSA-N 2 0 242.432 2.204 20 0 BEADRP C[NH+](C)C[C@H]1CC[N@H+](CC23CCC(CC2)C3)C1 ZINC000347775876 535964503 /nfs/dbraw/zinc/96/45/03/535964503.db2.gz GTPXDZYAIAICFO-SHARSMKWSA-N 2 0 236.403 2.450 20 0 BEADRP CC[C@@]1(C)CCC[N@H+](CC2CC[NH2+]CC2)C1 ZINC000178973857 536036901 /nfs/dbraw/zinc/03/69/01/536036901.db2.gz MWFYTGBUHMNYEE-AWEZNQCLSA-N 2 0 224.392 2.498 20 0 BEADRP CCN(CC[NH2+][C@@H]1CCC[C@@H](OC)C1)C1CC1 ZINC000233441155 566361740 /nfs/dbraw/zinc/36/17/40/566361740.db2.gz HECFJNHCCBHNAF-TZMCWYRMSA-N 2 0 240.391 2.018 20 0 BEADRP CCc1cccc(C[NH+]2CCC([NH3+])CC2)c1 ZINC000335110900 566402214 /nfs/dbraw/zinc/40/22/14/566402214.db2.gz PQQLWSKKXNGXKE-UHFFFAOYSA-N 2 0 218.344 2.172 20 0 BEADRP C[NH2+]C[C@H](C)[NH2+][C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000853248942 588729038 /nfs/dbraw/zinc/72/90/38/588729038.db2.gz LZUKKXGFSOBOBP-LPEHRKFASA-N 2 0 238.297 2.305 20 0 BEADRP CC(C)[C@H]([NH3+])CC[NH2+]Cc1ccc2c[nH]nc2c1 ZINC000853247640 588729079 /nfs/dbraw/zinc/72/90/79/588729079.db2.gz VYTYXIWSVHWZNY-CYBMUJFWSA-N 2 0 246.358 2.026 20 0 BEADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H]1C=CCC1 ZINC000854221338 588780374 /nfs/dbraw/zinc/78/03/74/588780374.db2.gz KNLNOIUUESTZIF-PWSUYJOCSA-N 2 0 231.343 2.218 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H]2C[C@H](O)c3ccccc32)C1 ZINC000854228997 588780928 /nfs/dbraw/zinc/78/09/28/588780928.db2.gz FRVLBMLQOPHIKZ-BVIHXZOGSA-N 2 0 246.354 2.024 20 0 BEADRP c1cc(N2CC[NH+](C3CCCC3)CC2)cc[nH+]1 ZINC000127890891 582594111 /nfs/dbraw/zinc/59/41/11/582594111.db2.gz DHMHYOIAYHSHFW-UHFFFAOYSA-N 2 0 231.343 2.146 20 0 BEADRP C[C@@H]1C[C@@H](C)[N@H+](CC2CC[NH+](C)CC2)C1 ZINC000892105239 582792623 /nfs/dbraw/zinc/79/26/23/582792623.db2.gz XSWFJTQSIBHGRP-VXGBXAGGSA-N 2 0 210.365 2.059 20 0 BEADRP CC[C@H]1C[C@H](C[NH2+]CC2([NH3+])CCCC2)CCO1 ZINC000849349559 582849029 /nfs/dbraw/zinc/84/90/29/582849029.db2.gz AGYUFFFULSZEHO-OLZOCXBDSA-N 2 0 240.391 2.053 20 0 BEADRP C[NH+](C)CCC[NH2+]C[C@H]1CCc2ccccc21 ZINC000892427679 582884581 /nfs/dbraw/zinc/88/45/81/582884581.db2.gz SXDNOSYPJAWXAV-CQSZACIVSA-N 2 0 232.371 2.258 20 0 BEADRP COC1CCC(C[NH2+]CCCC[NH+](C)C)CC1 ZINC000892740138 582974569 /nfs/dbraw/zinc/97/45/69/582974569.db2.gz IYUKFQBUCORQNH-UHFFFAOYSA-N 2 0 242.407 2.123 20 0 BEADRP CC[C@@H]1CCC[C@H](C[NH+]2C[C@@H]3C[NH2+]C[C@H]3C2)C1 ZINC000394501539 582988908 /nfs/dbraw/zinc/98/89/08/582988908.db2.gz BHVMEHSVEQMXNE-QPSCCSFWSA-N 2 0 236.403 2.354 20 0 BEADRP Cc1cncc(C[NH2+][C@H](C)C2CC[NH+](C)CC2)c1 ZINC000396450904 583082773 /nfs/dbraw/zinc/08/27/73/583082773.db2.gz GNLBOTYFPGPHPS-CYBMUJFWSA-N 2 0 247.386 2.210 20 0 BEADRP COC[C@H]([NH2+]CCCCCC[NH3+])C1CCCC1 ZINC000843340334 583215185 /nfs/dbraw/zinc/21/51/85/583215185.db2.gz BDKHHISYUWUMPC-AWEZNQCLSA-N 2 0 242.407 2.300 20 0 BEADRP [NH3+][C@]12CCC[C@H]1CN(CCc1cccs1)C2 ZINC000857086549 588887087 /nfs/dbraw/zinc/88/70/87/588887087.db2.gz LRRMGOWWVLEMJF-AAEUAGOBSA-N 2 0 236.384 2.104 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH+]1CCC2(CC[NH+](C)CC2)CC1 ZINC000877683907 583342739 /nfs/dbraw/zinc/34/27/39/583342739.db2.gz ARZMWMOWJNCXHK-ZIAGYGMSSA-N 2 0 236.403 2.450 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]CC[C@H]1CC1(Cl)Cl ZINC000857253691 588901398 /nfs/dbraw/zinc/90/13/98/588901398.db2.gz RLGKADOSOZJDRI-DJLDLDEBSA-N 2 0 237.174 2.040 20 0 BEADRP CC[C@H](CSC)[N@H+](C)CC1CC[NH+](C)CC1 ZINC000894494543 583474095 /nfs/dbraw/zinc/47/40/95/583474095.db2.gz FZMRRFOMXKVYBU-CYBMUJFWSA-N 2 0 244.448 2.402 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2CCCc3occc3C2)CC1 ZINC000894527233 583477666 /nfs/dbraw/zinc/47/76/66/583477666.db2.gz KYFXPDUXBBSAFD-UHFFFAOYSA-N 2 0 248.370 2.370 20 0 BEADRP C[C@@H]1C[N@H+](CC2CC[NH+](C)CC2)CCC1(F)F ZINC000894533319 583479013 /nfs/dbraw/zinc/47/90/13/583479013.db2.gz FWDVYXLZZKVMOR-LLVKDONJSA-N 2 0 246.345 2.305 20 0 BEADRP C[NH+]1CCC(C[N@@H+]2CCC[C@](C)(F)C2)CC1 ZINC000894659282 583504212 /nfs/dbraw/zinc/50/42/12/583504212.db2.gz QAWJSFSKNCCWMV-ZDUSSCGKSA-N 2 0 228.355 2.152 20 0 BEADRP c1nc(CNc2cc3c(c[nH+]2)CCCC3)c[nH]1 ZINC000894816907 583525624 /nfs/dbraw/zinc/52/56/24/583525624.db2.gz XWYWBXXSFVLCEI-UHFFFAOYSA-N 2 0 228.299 2.296 20 0 BEADRP CN1CC(C[N@H+](C)C/C=C\c2cccc(F)c2)C1 ZINC000895261483 583634575 /nfs/dbraw/zinc/63/45/75/583634575.db2.gz YEHBYOCSEMSWEP-XQRVVYSFSA-N 2 0 248.345 2.332 20 0 BEADRP C[C@H](CSCCF)[NH2+]CC[C@H](C)[NH+](C)C ZINC000895291534 583637009 /nfs/dbraw/zinc/63/70/09/583637009.db2.gz FWZOGPGAWVNBRQ-MNOVXSKESA-N 2 0 236.400 2.007 20 0 BEADRP C[C@@H](CC[NH2+]C[C@@H]1CC1(Cl)Cl)[NH+](C)C ZINC000895292087 583637614 /nfs/dbraw/zinc/63/76/14/583637614.db2.gz MBNKWFPSUMWJKJ-IUCAKERBSA-N 2 0 239.190 2.110 20 0 BEADRP COC1(C[C@H](C)[NH2+]CC[C@H](C)[NH+](C)C)CCC1 ZINC000895294579 583638164 /nfs/dbraw/zinc/63/81/64/583638164.db2.gz RTRGIIKZZHEZSI-STQMWFEESA-N 2 0 242.407 2.264 20 0 BEADRP CC[C@@H]1C[C@@H](C[NH2+]CC[C@H](C)[NH+](C)C)CCO1 ZINC000895296939 583641504 /nfs/dbraw/zinc/64/15/04/583641504.db2.gz RDXPYHAUHHXTMB-MELADBBJSA-N 2 0 242.407 2.121 20 0 BEADRP CCCSC[C@H](C)[NH2+]CC[C@@H](C)[NH+](C)C ZINC000895429951 583668918 /nfs/dbraw/zinc/66/89/18/583668918.db2.gz ZRLLWVJPOORITN-NWDGAFQWSA-N 2 0 232.437 2.448 20 0 BEADRP CCCSC[C@@H](C)[NH2+]CC[C@@H](C)[NH+](C)C ZINC000895429953 583669242 /nfs/dbraw/zinc/66/92/42/583669242.db2.gz ZRLLWVJPOORITN-VXGBXAGGSA-N 2 0 232.437 2.448 20 0 BEADRP CC1=CC[C@H]([NH2+][C@H]2CCN(C)[C@H]2C)CC1 ZINC000896555928 583811577 /nfs/dbraw/zinc/81/15/77/583811577.db2.gz SFECNPUGHGDLBH-AVGNSLFASA-N 2 0 208.349 2.167 20 0 BEADRP C[NH+](C)CC1CC[NH+](C/C=C/Cl)CC1 ZINC000727932310 583837810 /nfs/dbraw/zinc/83/78/10/583837810.db2.gz ZSLLUACDJYNGBN-ZZXKWVIFSA-N 2 0 216.756 2.013 20 0 BEADRP CC(C)C1(C[N@@H+]2C[C@@H]3C[NH+](C)C[C@]3(C)C2)CC1 ZINC000897620029 584032367 /nfs/dbraw/zinc/03/23/67/584032367.db2.gz DMUKADCTADHFAX-UONOGXRCSA-N 2 0 236.403 2.306 20 0 BEADRP C1[C@H]2CCC[C@H]2[C@H]1[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000897955449 584065428 /nfs/dbraw/zinc/06/54/28/584065428.db2.gz UVAGLQKMQOTMSJ-QMIVOQANSA-N 2 0 234.387 2.391 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+][C@@H]2C[C@@H]3CCC[C@H]23)[C@H](C)C1 ZINC000897955914 584065880 /nfs/dbraw/zinc/06/58/80/584065880.db2.gz YZUXVYCFHVOUNC-CAEXGNQWSA-N 2 0 236.403 2.495 20 0 BEADRP C[C@@H]1CC=CC[C@H]1[NH2+]CC1CC[NH+](C)CC1 ZINC000898223081 584101560 /nfs/dbraw/zinc/10/15/60/584101560.db2.gz NNQQQUZKMDPNMK-TZMCWYRMSA-N 2 0 222.376 2.273 20 0 BEADRP C[C@H]1C[C@@H]1C[N@H+](C)CC(C)(C)C[NH+](C)C ZINC000898307730 584109738 /nfs/dbraw/zinc/10/97/38/584109738.db2.gz GHZFSZFXTLSHEB-NWDGAFQWSA-N 2 0 212.381 2.162 20 0 BEADRP C(CC1CC1)C[N@@H+]1CCC[C@@H]([C@H]2CC[NH2+]C2)C1 ZINC000866666086 584121602 /nfs/dbraw/zinc/12/16/02/584121602.db2.gz NFJZEHRPFQNKHD-LSDHHAIUSA-N 2 0 236.403 2.498 20 0 BEADRP [NH3+]Cc1ccc(-c2ccc3c(c2)C[C@@H]([NH3+])C3)s1 ZINC000899323622 584196653 /nfs/dbraw/zinc/19/66/53/584196653.db2.gz SQMSAFAQMLJCCZ-LBPRGKRZSA-N 2 0 244.363 2.300 20 0 BEADRP CSCC[C@@H](C)[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000902328447 584560829 /nfs/dbraw/zinc/56/08/29/584560829.db2.gz KVONVHZXRKCSDP-NEPJUHHUSA-N 2 0 244.448 2.496 20 0 BEADRP CSC[C@@H](C)[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000902331944 584563079 /nfs/dbraw/zinc/56/30/79/584563079.db2.gz WZTVKGSMGXHNFH-MNOVXSKESA-N 2 0 230.421 2.106 20 0 BEADRP Cc1cncc(C[NH2+][C@H]2CC[NH2+]CC(C)(C)C2)c1 ZINC000902371239 584566049 /nfs/dbraw/zinc/56/60/49/584566049.db2.gz OBMYWDHIHXSFBO-AWEZNQCLSA-N 2 0 247.386 2.258 20 0 BEADRP [NH3+]C1(C[NH2+][C@@H]2CCCc3ccccc3C2)CC1 ZINC000902407098 584574197 /nfs/dbraw/zinc/57/41/97/584574197.db2.gz PHEVXXKKAQRZAS-CQSZACIVSA-N 2 0 230.355 2.015 20 0 BEADRP CC1(C)C[C@@H]1[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000902391053 584581928 /nfs/dbraw/zinc/58/19/28/584581928.db2.gz SBWKCIFLOWNQAB-MNOVXSKESA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@]1(C[NH2+][C@@H]2CC[NH2+]CC(C)(C)C2)CC1(F)F ZINC000902400959 584586896 /nfs/dbraw/zinc/58/68/96/584586896.db2.gz YNVUEIOHUWZOMK-PWSUYJOCSA-N 2 0 246.345 2.400 20 0 BEADRP CC(C)[C@H]1CCC[C@H]([NH2+]CC2([NH3+])CC2)C1 ZINC000902404065 584587997 /nfs/dbraw/zinc/58/79/97/584587997.db2.gz BNYFXYBUIJBJIZ-RYUDHWBXSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)[C@@H]1CCC[C@@H]([NH2+]CC2([NH3+])CC2)C1 ZINC000902404066 584588168 /nfs/dbraw/zinc/58/81/68/584588168.db2.gz BNYFXYBUIJBJIZ-VXGBXAGGSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)(C[NH2+][C@H]1C[C@@H]([NH3+])C12CCC2)C1CC1 ZINC000902432842 584595689 /nfs/dbraw/zinc/59/56/89/584595689.db2.gz QWKPDVLUYXPUGA-NEPJUHHUSA-N 2 0 222.376 2.282 20 0 BEADRP CC(C)(C[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)C1CC1 ZINC000902434785 584595945 /nfs/dbraw/zinc/59/59/45/584595945.db2.gz ZOPFLMXQRLOLFH-FUNVUKJBSA-N 2 0 222.376 2.295 20 0 BEADRP CCC(C)(C)[C@@H](C)[NH2+][C@@H]1C[NH2+]CC1(C)C ZINC000902440902 584597625 /nfs/dbraw/zinc/59/76/25/584597625.db2.gz BEOYVNGAYPWNPJ-GHMZBOCLSA-N 2 0 212.381 2.399 20 0 BEADRP C[C@H]([NH2+][C@H]1C[NH2+]CC1(C)C)C1CCSCC1 ZINC000902443173 584598584 /nfs/dbraw/zinc/59/85/84/584598584.db2.gz KJHZLFMXRUKFJZ-JQWIXIFHSA-N 2 0 242.432 2.106 20 0 BEADRP C[C@@H](CCC1CC1)[NH2+][C@H]1C[NH2+]CC1(C)C ZINC000902444857 584599033 /nfs/dbraw/zinc/59/90/33/584599033.db2.gz OVHNVZLBAXJWAG-JQWIXIFHSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]C1C[C@H]2CC[C@@H](C1)S2 ZINC000902445857 584599069 /nfs/dbraw/zinc/59/90/69/584599069.db2.gz MWDRDXSSCPGUNY-JQYRIEHKSA-N 2 0 228.405 2.128 20 0 BEADRP CCO[C@@H]1C[C@H]([NH2+]CC2([NH3+])CC2)C1(CC)CC ZINC000902414535 584600603 /nfs/dbraw/zinc/60/06/03/584600603.db2.gz WSYSMGYZKDLWIT-NWDGAFQWSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2)C1CCCCC1 ZINC000902472855 584601406 /nfs/dbraw/zinc/60/14/06/584601406.db2.gz JJULLSJBYGLZFO-AHLTXXRQSA-N 2 0 222.376 2.438 20 0 BEADRP C[C@@H]1CC([NH2+][C@@H]2C[C@H]3CC[C@@H]2[NH2+]3)C[C@@H](C)C1 ZINC000902476833 584602737 /nfs/dbraw/zinc/60/27/37/584602737.db2.gz PVZJMBYHYYMXLZ-CVNCSBKSSA-N 2 0 222.376 2.294 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2)C1CCCC1 ZINC000902476029 584602943 /nfs/dbraw/zinc/60/29/43/584602943.db2.gz MCDQKRZFIAYQOP-ZBAXXZLZSA-N 2 0 208.349 2.048 20 0 BEADRP CC1(C)CCCC[C@@H]1[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902475958 584602954 /nfs/dbraw/zinc/60/29/54/584602954.db2.gz KKBQYARTPWIILZ-XQHKEYJVSA-N 2 0 222.376 2.438 20 0 BEADRP CC1(C)C[NH2+]C[C@H]1[NH2+][C@H](C1CC1)C1CCC1 ZINC000902447549 584604760 /nfs/dbraw/zinc/60/47/60/584604760.db2.gz ZLXUKTCQXDCLIZ-OLZOCXBDSA-N 2 0 222.376 2.153 20 0 BEADRP CC1(C)C[NH2+]C[C@@H]1[NH2+][C@H]1CCCC12CCC2 ZINC000902447566 584605067 /nfs/dbraw/zinc/60/50/67/584605067.db2.gz ZQWBILILAGTDCJ-RYUDHWBXSA-N 2 0 222.376 2.297 20 0 BEADRP CC(C)(C)[C@@H]1CC[C@H]1[NH2+][C@H]1C[NH2+]CC1(C)C ZINC000902447502 584605189 /nfs/dbraw/zinc/60/51/89/584605189.db2.gz YPSXDOJMFFMBFA-UTUOFQBUSA-N 2 0 224.392 2.399 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[NH2+]CC1(C)C)C1CCCC1 ZINC000902448734 584605256 /nfs/dbraw/zinc/60/52/56/584605256.db2.gz HZDBHCVCLKYFGL-ZYHUDNBSSA-N 2 0 210.365 2.153 20 0 BEADRP CC1(C)CCC[C@H]1[NH2+][C@@H]1C[NH2+]CC1(C)C ZINC000902448904 584605309 /nfs/dbraw/zinc/60/53/09/584605309.db2.gz JFRDRJIZSHMLHY-GHMZBOCLSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]([NH2+][C@H]1CCSC(C)(C)C1)[C@H]1CCC[NH2+]1 ZINC000902450045 584606129 /nfs/dbraw/zinc/60/61/29/584606129.db2.gz CBWZHSFVSQGIST-GRYCIOLGSA-N 2 0 242.432 2.391 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]1[NH2+][C@@H]1CCCC2(CC2)C1 ZINC000902450017 584606413 /nfs/dbraw/zinc/60/64/13/584606413.db2.gz BRDOTKFJUQAGMJ-IJLUTSLNSA-N 2 0 208.349 2.179 20 0 BEADRP CC1(C)C[C@H]([NH2+][C@@H]2CCC[C@@H]2C[NH3+])CCS1 ZINC000902451175 584606589 /nfs/dbraw/zinc/60/65/89/584606589.db2.gz GHFLTWQNMPIBIO-IJLUTSLNSA-N 2 0 242.432 2.378 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@H]1CCCC2(CC2)C1 ZINC000902450405 584607003 /nfs/dbraw/zinc/60/70/03/584607003.db2.gz DBYLETOSIKYIDH-TUAOUCFPSA-N 2 0 210.365 2.425 20 0 BEADRP C1[C@H]2CCC[C@@H]2[C@H]1[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000902453468 584607894 /nfs/dbraw/zinc/60/78/94/584607894.db2.gz DBZWMRDYUSKMJU-JEWKUQAESA-N 2 0 234.387 2.153 20 0 BEADRP C1[C@H]2CCC[C@@H]2[C@H]1[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000902453470 584607935 /nfs/dbraw/zinc/60/79/35/584607935.db2.gz DBZWMRDYUSKMJU-MBIARJLFSA-N 2 0 234.387 2.153 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1C[C@H]2CCC[C@H]21 ZINC000902453493 584607956 /nfs/dbraw/zinc/60/79/56/584607956.db2.gz DGCOOBHLDACQBB-FDYHWXHSSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+][C@@H]1C[C@@H]2CCC[C@@H]12 ZINC000902453428 584607994 /nfs/dbraw/zinc/60/79/94/584607994.db2.gz CSPDCHMYUKJEPR-MQLXINIDSA-N 2 0 222.376 2.425 20 0 BEADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H]2C[C@@H]3CCC[C@@H]23)C1 ZINC000902455434 584609297 /nfs/dbraw/zinc/60/92/97/584609297.db2.gz LZZUHZBATFXQKN-OBPIAQAESA-N 2 0 208.349 2.035 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+][C@@H]1C[C@H]2CCC[C@H]21 ZINC000902456460 584609958 /nfs/dbraw/zinc/60/99/58/584609958.db2.gz PBAIGSUIPPEPJS-JTNTXRCJSA-N 2 0 234.387 2.281 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+][C@@H]1C[C@@H]2CCC[C@H]12 ZINC000902456475 584610258 /nfs/dbraw/zinc/61/02/58/584610258.db2.gz PBAIGSUIPPEPJS-YXVYFARHSA-N 2 0 234.387 2.281 20 0 BEADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+][C@@H]1C[C@@H]2CCC[C@H]12 ZINC000902458635 584610918 /nfs/dbraw/zinc/61/09/18/584610918.db2.gz WWWFSEWJTOXJDG-IKOXMDCHSA-N 2 0 222.376 2.153 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1C[C@@H]2CCC[C@H]12 ZINC000902459119 584611158 /nfs/dbraw/zinc/61/11/58/584611158.db2.gz XGRDUTMVBIHHPB-HTVCTNPSSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@@H]1CC[C@@H](C)[C@H]([NH2+][C@@H]2C[C@@H]3CC[C@H]2[NH2+]3)C1 ZINC000902462983 584612111 /nfs/dbraw/zinc/61/21/11/584612111.db2.gz YLNXSWLIRCAFNO-BUCHIQEDSA-N 2 0 222.376 2.294 20 0 BEADRP C1CC1[C@@H]1CCCC[C@H]1[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902463636 584612352 /nfs/dbraw/zinc/61/23/52/584612352.db2.gz AERUVHRGIZAXCH-VQJWOFKYSA-N 2 0 234.387 2.438 20 0 BEADRP CCC(C)(C)[C@H](C)[NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2 ZINC000902466838 584614820 /nfs/dbraw/zinc/61/48/20/584614820.db2.gz NMQXRZQUDPBDFZ-WHOHXGKFSA-N 2 0 210.365 2.294 20 0 BEADRP C1CC([C@H]2CC[C@@H]2[NH2+][C@@H]2C[C@H]3CC[C@@H]2[NH2+]3)C1 ZINC000902467583 584615054 /nfs/dbraw/zinc/61/50/54/584615054.db2.gz OYORRMAFKJNXQV-PEBLQZBPSA-N 2 0 220.360 2.048 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+][C@@H]2C[C@H]3CC[C@@H]2[NH2+]3)[C@H](C)C1 ZINC000902469172 584615374 /nfs/dbraw/zinc/61/53/74/584615374.db2.gz YOXYJNCGPKQTEZ-UCKQBZRPSA-N 2 0 222.376 2.294 20 0 BEADRP FCCC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902469369 584615784 /nfs/dbraw/zinc/61/57/84/584615784.db2.gz PNQVAKVWKCXYGA-QSLWVIQJSA-N 2 0 240.366 2.387 20 0 BEADRP CC[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC000902470481 584616234 /nfs/dbraw/zinc/61/62/34/584616234.db2.gz YOVOAPNUAKDCFW-MBJXGIAVSA-N 2 0 222.376 2.438 20 0 BEADRP C[C@@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1ccc2c(c1)COC2 ZINC000902490806 584618315 /nfs/dbraw/zinc/61/83/15/584618315.db2.gz UBWYGAROZZZWNU-UEKVPHQBSA-N 2 0 246.354 2.105 20 0 BEADRP C[C@@H]1CC=CC[C@H]1[NH2+][C@H]1C[C@H]([NH3+])C12CCC2 ZINC000902502455 584620551 /nfs/dbraw/zinc/62/05/51/584620551.db2.gz FUKCYTITTWXCMD-NDBYEHHHSA-N 2 0 220.360 2.201 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1CC=CC[C@H]1C ZINC000902504335 584621438 /nfs/dbraw/zinc/62/14/38/584621438.db2.gz OASPKCLBHKJASM-JHJVBQTASA-N 2 0 210.365 2.448 20 0 BEADRP C[C@@H]1CC=CC[C@H]1[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000902505795 584621644 /nfs/dbraw/zinc/62/16/44/584621644.db2.gz UCWOQSYDESEANA-MROQNXINSA-N 2 0 208.349 2.201 20 0 BEADRP Cc1ncccc1CC[NH2+][C@H]1CCCCC[C@H]1[NH3+] ZINC000902511754 584623243 /nfs/dbraw/zinc/62/32/43/584623243.db2.gz FJUIARWQAJYKLH-CABCVRRESA-N 2 0 247.386 2.182 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+][C@H]2CCC[C@H]2CCCF)C1 ZINC000902485674 584625204 /nfs/dbraw/zinc/62/52/04/584625204.db2.gz MKYLGOBVUYJVRM-CYDGBPFRSA-N 2 0 228.355 2.232 20 0 BEADRP COc1ccsc1[C@H](C)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902486055 584625446 /nfs/dbraw/zinc/62/54/46/584625446.db2.gz OMJQJQZFDHMPMV-GUBZILKMSA-N 2 0 240.372 2.145 20 0 BEADRP C[C@@H]1CC[C@@H](C)[C@@H]([NH2+][C@H]2C[C@H](C[NH3+])C2)C1 ZINC000902486129 584625525 /nfs/dbraw/zinc/62/55/25/584625525.db2.gz PWEUGWCPUMLQNC-VEGXAWMVSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@H]1C[C@H]([NH2+][C@H]2C[C@H](C[NH3+])C2)C[C@@H](C)C1 ZINC000902486645 584626088 /nfs/dbraw/zinc/62/60/88/584626088.db2.gz HPXAVNKJRMYRAD-FOPUMGAHSA-N 2 0 210.365 2.138 20 0 BEADRP Cc1ccc([C@H](C)[NH2+][C@H]2C[C@H](C[NH3+])C2)c(C)n1 ZINC000902487644 584626649 /nfs/dbraw/zinc/62/66/49/584626649.db2.gz LIOQYHMCQDIBQL-AVGNSLFASA-N 2 0 233.359 2.086 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+][C@H]2CCC23CCCC3)C1 ZINC000902487986 584626655 /nfs/dbraw/zinc/62/66/55/584626655.db2.gz WKWOSLCZMKQTND-SRVKXCTJSA-N 2 0 208.349 2.036 20 0 BEADRP [NH3+]C[C@H]1C[C@H]([NH2+]C2CCC(C(F)F)CC2)C1 ZINC000902488683 584627467 /nfs/dbraw/zinc/62/74/67/584627467.db2.gz ZXLZTASRKDVZNO-NFEIZINCSA-N 2 0 232.318 2.137 20 0 BEADRP Cc1ccsc1[C@H](C)[NH2+][C@H]1C[C@H](C[NH3+])C1 ZINC000902488789 584627477 /nfs/dbraw/zinc/62/74/77/584627477.db2.gz NUEKVLXTGGEYBR-DCAQKATOSA-N 2 0 224.373 2.444 20 0 BEADRP Cl/C=C/C[NH2+][C@@H]1CC[NH2+]C[C@@H]1C1CCCC1 ZINC000902522003 584631490 /nfs/dbraw/zinc/63/14/90/584631490.db2.gz VECBEQKBQQKNLE-SJXJOUCVSA-N 2 0 242.794 2.497 20 0 BEADRP Cl/C=C\C[NH2+][C@@H]1CC[NH2+]C[C@H]1C1CCCC1 ZINC000902522004 584631629 /nfs/dbraw/zinc/63/16/29/584631629.db2.gz VECBEQKBQQKNLE-VOYABRKTSA-N 2 0 242.794 2.497 20 0 BEADRP C[NH+](C)CCC[NH2+]C1C[C@H]2CCC[C@@H]2C1 ZINC000902721401 584660037 /nfs/dbraw/zinc/66/00/37/584660037.db2.gz ZYMBQBAFKHCAKV-VXGBXAGGSA-N 2 0 210.365 2.106 20 0 BEADRP C[N@@H+]1CCCC[C@H]1CCN1CCC[C@@H](F)C1 ZINC000903002140 584716251 /nfs/dbraw/zinc/71/62/51/584716251.db2.gz WUOVXZFABKJGLJ-OLZOCXBDSA-N 2 0 228.355 2.295 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]C2C[C@H]3CCC[C@@H]3C2)C1 ZINC000903043422 584720734 /nfs/dbraw/zinc/72/07/34/584720734.db2.gz YQIQGFGGAYHBDW-BHPKHCPMSA-N 2 0 236.403 2.495 20 0 BEADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]C2C[C@@H]3CCC[C@H]3C2)C1 ZINC000903043423 584721092 /nfs/dbraw/zinc/72/10/92/584721092.db2.gz YQIQGFGGAYHBDW-PWNZVWSESA-N 2 0 236.403 2.495 20 0 BEADRP C[C@@H](C[NH2+]C1CC2(CCC2)C1)C[NH+](C)C ZINC000903174861 584732757 /nfs/dbraw/zinc/73/27/57/584732757.db2.gz NTAUCLMEKCZBDS-NSHDSACASA-N 2 0 210.365 2.106 20 0 BEADRP C[C@@H]1C[C@H]1[C@@H]1C[C@H]1[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000903252496 584738935 /nfs/dbraw/zinc/73/89/35/584738935.db2.gz DITRWFOBDWPRHK-LWGJEFJTSA-N 2 0 234.387 2.247 20 0 BEADRP C[C@H]([NH2+][C@@H]1C[C@@H]2CCC[C@@H]12)C1CC[NH+](C)CC1 ZINC000903319212 584746198 /nfs/dbraw/zinc/74/61/98/584746198.db2.gz TZJSPUBRFBGCBO-SPWCGHHHSA-N 2 0 236.403 2.495 20 0 BEADRP CC(C)[N@H+](C[C@@H]1C[NH2+]C[C@H]1C)C1CCCC1 ZINC000903430911 584761556 /nfs/dbraw/zinc/76/15/56/584761556.db2.gz IGTFUHKPYNYGNN-OLZOCXBDSA-N 2 0 224.392 2.495 20 0 BEADRP C[N@H+](Cc1ccc2cc[nH]c2c1)C1CC[NH2+]CC1 ZINC000903421694 584763976 /nfs/dbraw/zinc/76/39/76/584763976.db2.gz RUGJSICDJMGAAA-UHFFFAOYSA-N 2 0 243.354 2.352 20 0 BEADRP C[NH2+]C[C@H]1CC[N@H+](Cc2ccc3cc[nH]c3c2)C1 ZINC000903422641 584764530 /nfs/dbraw/zinc/76/45/30/584764530.db2.gz HGZOJUUOGFXUON-CYBMUJFWSA-N 2 0 243.354 2.209 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1C[NH2+]C[C@H]1C)C1CCCC1 ZINC000903458813 584766076 /nfs/dbraw/zinc/76/60/76/584766076.db2.gz KJRKYEIRDVHKMM-MDZLAQPJSA-N 2 0 210.365 2.010 20 0 BEADRP CC[C@@H]1C[C@H]1C[N@@H+]1CCCC[C@@H]1[C@H]1CC[NH2+]C1 ZINC000903454127 584772572 /nfs/dbraw/zinc/77/25/72/584772572.db2.gz VNFPXWVCVABOPR-CBBWQLFWSA-N 2 0 236.403 2.497 20 0 BEADRP C=C/C=C\CC[NH2+][C@H]1CC[NH2+]C12CCCC2 ZINC000903481843 584778159 /nfs/dbraw/zinc/77/81/59/584778159.db2.gz OCUVPMIAPFRUPI-SCOBNMCVSA-N 2 0 220.360 2.383 20 0 BEADRP CC1(C)CN(CCCc2ccsc2)C[C@H]1[NH3+] ZINC000903556868 584783294 /nfs/dbraw/zinc/78/32/94/584783294.db2.gz IMVURHQXDWIJDP-GFCCVEGCSA-N 2 0 238.400 2.350 20 0 BEADRP C[C@]12C[N@H+](CC3CC[NH2+]CC3)C[C@H]1[C@H]1C=C[C@@H]2C1 ZINC000903707900 584791362 /nfs/dbraw/zinc/79/13/62/584791362.db2.gz UWBVXMZVVIPVRL-XUWVNRHRSA-N 2 0 246.398 2.130 20 0 BEADRP CC1CC(C[N@@H+]2CCCC[C@@H]2[C@@H]2CC[NH2+]C2)C1 ZINC000903752458 584795729 /nfs/dbraw/zinc/79/57/29/584795729.db2.gz SSGLFIPHTABYHI-NEXFUWMNSA-N 2 0 236.403 2.497 20 0 BEADRP CC1CC(C[N@@H+]2CCCC[C@@H]2[C@H]2CC[NH2+]C2)C1 ZINC000903752460 584795752 /nfs/dbraw/zinc/79/57/52/584795752.db2.gz SSGLFIPHTABYHI-PFSRBDOWSA-N 2 0 236.403 2.497 20 0 BEADRP CC1CC(C[N@@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]3)C2)C1 ZINC000903740886 584796308 /nfs/dbraw/zinc/79/63/08/584796308.db2.gz LTJDSCSDCWYTFY-CVSAEHQPSA-N 2 0 236.403 2.497 20 0 BEADRP CC1CC(C[N@@H+]2C[C@@H]3CCC[C@H]([NH3+])[C@@H]3C2)C1 ZINC000903743087 584796904 /nfs/dbraw/zinc/79/69/04/584796904.db2.gz IEPBWOKAWSQDSP-LFGDDXOXSA-N 2 0 222.376 2.092 20 0 BEADRP C[N@H+](C[C@@H]1CC1(C)C)C[C@@H]1CCCC[NH2+]C1 ZINC000903769892 584797740 /nfs/dbraw/zinc/79/77/40/584797740.db2.gz QXQRTESYMMNWKE-OLZOCXBDSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@@H]1C[C@H]([NH3+])CC[N@@H+]1Cc1ccccc1CF ZINC000903767213 584798298 /nfs/dbraw/zinc/79/82/98/584798298.db2.gz FSIFYUYSBGDQMF-BXUZGUMPSA-N 2 0 236.334 2.468 20 0 BEADRP NC[C@@]12CC[C@@H]1CCC[N@@H+]2CCc1ccccc1 ZINC000903795032 584799098 /nfs/dbraw/zinc/79/90/98/584799098.db2.gz HXXZJBYKJVMXCS-HOTGVXAUSA-N 2 0 244.382 2.432 20 0 BEADRP CC1(C)[C@H]([NH3+])C[C@H]1[NH2+]Cc1ccccc1CF ZINC000903783169 584800325 /nfs/dbraw/zinc/80/03/25/584800325.db2.gz VTKFUWGTJSDQFM-CHWSQXEVSA-N 2 0 236.334 2.372 20 0 BEADRP [NH3+][C@@H]1C[C@H]2C[C@@H](C1)[N@H+](CCc1cccs1)C2 ZINC000903843244 584807747 /nfs/dbraw/zinc/80/77/47/584807747.db2.gz GNNGGQSOCBFYNW-TUAOUCFPSA-N 2 0 236.384 2.102 20 0 BEADRP C[C@@H]1CC=CC[C@H]1[NH2+]CCC[NH2+]C1CC1 ZINC000903850394 584808372 /nfs/dbraw/zinc/80/83/72/584808372.db2.gz PQPRHMQHJJJNGA-DGCLKSJQSA-N 2 0 208.349 2.073 20 0 BEADRP Cc1cc(C)nc(CN2CC[C@H]3CC[C@@]32C[NH3+])c1 ZINC000903862624 584812934 /nfs/dbraw/zinc/81/29/34/584812934.db2.gz AUHYGBABKRSADG-UKRRQHHQSA-N 2 0 245.370 2.012 20 0 BEADRP CC[C@@]1(C)CCCN(C[C@H]([NH3+])CC(F)F)C1 ZINC000903894987 584819558 /nfs/dbraw/zinc/81/95/58/584819558.db2.gz JBSAZXWBRUXVHG-PWSUYJOCSA-N 2 0 234.334 2.481 20 0 BEADRP [NH3+][C@@H](CC(F)F)CN1CC[C@@H](C2CCC2)C1 ZINC000903929153 584824351 /nfs/dbraw/zinc/82/43/51/584824351.db2.gz AZYCGOWJADZVPY-MNOVXSKESA-N 2 0 232.318 2.091 20 0 BEADRP [NH3+][C@@H](CC(F)F)CN1CC[C@H](C2CCC2)C1 ZINC000903929154 584824638 /nfs/dbraw/zinc/82/46/38/584824638.db2.gz AZYCGOWJADZVPY-QWRGUYRKSA-N 2 0 232.318 2.091 20 0 BEADRP [NH3+][C@@H](C[NH2+]CC1CCC(F)CC1)CC(F)F ZINC000903932105 584825168 /nfs/dbraw/zinc/82/51/68/584825168.db2.gz MJIVKVNZAQGNOK-UDNWOFFPSA-N 2 0 238.297 2.087 20 0 BEADRP CC(C)([NH3+])CC[NH2+]Cc1cc(F)c(F)c(F)c1 ZINC000903938432 584826543 /nfs/dbraw/zinc/82/65/43/584826543.db2.gz AESBZCGLYZFFFP-UHFFFAOYSA-N 2 0 246.276 2.321 20 0 BEADRP C[C@@H]([NH3+])c1ccc(NC[C@H]([NH3+])CC(F)F)cc1 ZINC000903918165 584827032 /nfs/dbraw/zinc/82/70/32/584827032.db2.gz UDFYFTWZOUNRDZ-PSASIEDQSA-N 2 0 243.301 2.101 20 0 BEADRP C[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1C[NH2+]CCC1(F)F ZINC000903957394 584827822 /nfs/dbraw/zinc/82/78/22/584827822.db2.gz QKOXLZPLIAKFOI-OUAUKWLOSA-N 2 0 232.318 2.009 20 0 BEADRP CC1CCC([NH2+]C[C@@H]2C[NH2+]CCC2(F)F)CC1 ZINC000903956248 584831883 /nfs/dbraw/zinc/83/18/83/584831883.db2.gz JVUSCTMVKKKZBS-CXQJBGSLSA-N 2 0 246.345 2.400 20 0 BEADRP C[C@@H]1CCC[C@H]([NH2+]C[C@H]2C[NH2+]CCC2(F)F)C1 ZINC000903956076 584832067 /nfs/dbraw/zinc/83/20/67/584832067.db2.gz GNKSIXYXCFYOKO-UTUOFQBUSA-N 2 0 246.345 2.400 20 0 BEADRP C[C@@H]1CCC[C@@H]([NH2+]C[C@@H]2C[NH2+]CCC2(F)F)C1 ZINC000903956074 584832224 /nfs/dbraw/zinc/83/22/24/584832224.db2.gz GNKSIXYXCFYOKO-GRYCIOLGSA-N 2 0 246.345 2.400 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1C[NH2+]CCC1(F)F)C1CCC1 ZINC000903956121 584832324 /nfs/dbraw/zinc/83/23/24/584832324.db2.gz HEZZNDYGNPSCHH-ONGXEEELSA-N 2 0 232.318 2.009 20 0 BEADRP C[C@H]1CCC[C@H]1[NH2+]CC[C@@H]1C[NH2+]C[C@H]1C ZINC000903974801 584832718 /nfs/dbraw/zinc/83/27/18/584832718.db2.gz SUWLNCIMODYCTP-UMSGYPCISA-N 2 0 210.365 2.010 20 0 BEADRP CCCC[C@H](COC)[NH2+]CC[C@@H]1C[NH2+]C[C@H]1C ZINC000903978874 584833015 /nfs/dbraw/zinc/83/30/15/584833015.db2.gz NXDPZUZAAHELEW-MGPQQGTHSA-N 2 0 242.407 2.027 20 0 BEADRP CC[C@H](C[C@@H](C)CC)[NH2+][C@@H]1C[NH2+]C[C@H]1C ZINC000903963608 584833514 /nfs/dbraw/zinc/83/35/14/584833514.db2.gz BZPHTLXVGIGPLH-UMSGYPCISA-N 2 0 212.381 2.399 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+][C@@H]1CCC[C@@H](C)[C@@H]1C ZINC000903964110 584833918 /nfs/dbraw/zinc/83/39/18/584833918.db2.gz LXPUGVWQDGQARB-UJPOAAIJSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+][C@H]1CC[C@@H](C)[C@H](C)C1 ZINC000903964095 584834210 /nfs/dbraw/zinc/83/42/10/584834210.db2.gz LJADWHKUEKEHNH-NJMOYASZSA-N 2 0 210.365 2.009 20 0 BEADRP CC[C@@H](Cc1ccccc1)[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000903967746 584834886 /nfs/dbraw/zinc/83/48/86/584834886.db2.gz MXURHVLIJABDNK-KBMXLJTQSA-N 2 0 246.398 2.453 20 0 BEADRP CC(C)[N@H+](C)C[C@H]([NH3+])CCC(C)(C)C ZINC000904301639 584861195 /nfs/dbraw/zinc/86/11/95/584861195.db2.gz KZUAPSVFJVRRRJ-LLVKDONJSA-N 2 0 200.370 2.480 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[N@@H+]2CCC[C@@H]2Cc2ccccc2)C1 ZINC000904307928 584863017 /nfs/dbraw/zinc/86/30/17/584863017.db2.gz YZUUQFLOLUVSEI-OWCLPIDISA-N 2 0 244.382 2.431 20 0 BEADRP C[C@H](c1cccc(O)c1)[N@H+](C)C[C@H]1C[C@@H]([NH3+])C1 ZINC000904320790 584863948 /nfs/dbraw/zinc/86/39/48/584863948.db2.gz PGTYURGJHAXRBS-WZRBSPASSA-N 2 0 234.343 2.122 20 0 BEADRP Cc1cccc([C@@H]2CCC[N@@H+]2C[C@H]2C[C@@H]([NH3+])C2)n1 ZINC000904322139 584864610 /nfs/dbraw/zinc/86/46/10/584864610.db2.gz PUTNLXFZMAXZTN-GUTXKFCHSA-N 2 0 245.370 2.264 20 0 BEADRP C[N@H+](C[C@H]([NH3+])CCC(C)(C)C)C[C@@H]1CCOC1 ZINC000904326954 584865263 /nfs/dbraw/zinc/86/52/63/584865263.db2.gz UOTZOKFAWBKNDD-QWHCGFSZSA-N 2 0 242.407 2.108 20 0 BEADRP C[C@@H]1C[N@H+](C[C@H]2C[C@@H]([NH3+])C2)[C@H]2CCCC[C@@H]12 ZINC000904330683 584866095 /nfs/dbraw/zinc/86/60/95/584866095.db2.gz AKVGUKXDOOBUCG-DGTMBMJNSA-N 2 0 222.376 2.234 20 0 BEADRP C[C@@H]1C[C@H](c2cccnc2)[N@H+](C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000904341784 584866976 /nfs/dbraw/zinc/86/69/76/584866976.db2.gz VXVXBZCPKMRNAY-RJZRQDKASA-N 2 0 245.370 2.202 20 0 BEADRP Cc1ccc(C)c(C[N@H+](C)C[C@H]2C[C@@H]([NH3+])C2)c1 ZINC000904345505 584868618 /nfs/dbraw/zinc/86/86/18/584868618.db2.gz IRDOMRFLYVAAAR-OTVXOJSOSA-N 2 0 232.371 2.473 20 0 BEADRP CC(C)C[C@H](C[NH3+])NC[C@@H]([NH3+])CCC(C)(C)C ZINC000904353384 584869891 /nfs/dbraw/zinc/86/98/91/584869891.db2.gz LEODYFCZBNRQLW-QWHCGFSZSA-N 3 0 243.439 2.103 20 0 BEADRP C[C@H](C[NH3+])C[NH2+]Cc1ccc(C(F)F)c(F)c1 ZINC000904353621 584870354 /nfs/dbraw/zinc/87/03/54/584870354.db2.gz OWQVIDSRAWCMMJ-MRVPVSSYSA-N 2 0 246.276 2.448 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+]CCc2cccc(Cl)c2)C1 ZINC000904359853 584871624 /nfs/dbraw/zinc/87/16/24/584871624.db2.gz FUWFJVVALBRNGL-BJHJDKERSA-N 2 0 238.762 2.209 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+]CCc2ccccc2Cl)C1 ZINC000904359555 584871650 /nfs/dbraw/zinc/87/16/50/584871650.db2.gz AZXVAPFYHJARAA-KLPPZKSPSA-N 2 0 238.762 2.209 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+]CCCc2cccc(F)c2)C1 ZINC000904359828 584871655 /nfs/dbraw/zinc/87/16/55/584871655.db2.gz DTGSFNMLDLXKOO-XBXGTLAGSA-N 2 0 236.334 2.085 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+]Cc2ccccc2Cl)C1 ZINC000904362178 584872102 /nfs/dbraw/zinc/87/21/02/584872102.db2.gz HVCOWSWZLYVRTB-JGZJWPJOSA-N 2 0 224.735 2.167 20 0 BEADRP CC(C)(C)CC[C@H]([NH3+])C[NH2+][C@@H]1CCCOCC1 ZINC000904367527 584872658 /nfs/dbraw/zinc/87/26/58/584872658.db2.gz DQANOELGXLBOFU-QWHCGFSZSA-N 2 0 242.407 2.299 20 0 BEADRP CC(C)C[NH2+]C[C@H]([NH3+])CCC(C)(C)C ZINC000904367522 584872774 /nfs/dbraw/zinc/87/27/74/584872774.db2.gz DMMLLJQPYURWON-LLVKDONJSA-N 2 0 200.370 2.386 20 0 BEADRP CCOCc1ccccc1C[NH2+]C1CC(C[NH3+])C1 ZINC000904369088 584872871 /nfs/dbraw/zinc/87/28/71/584872871.db2.gz XHAAMMZDBSXTLY-UHFFFAOYSA-N 2 0 248.370 2.050 20 0 BEADRP C[C@@]1(C[N@@H+]2CC[C@@H](C3CCC3)C2)CCC[NH2+]C1 ZINC000904372694 584874087 /nfs/dbraw/zinc/87/40/87/584874087.db2.gz GRIGVQYNELRCEF-HUUCEWRRSA-N 2 0 236.403 2.498 20 0 BEADRP C[C@@H](C[NH2+]C[C@H]1C[C@@H]([NH3+])C1)Cc1cccs1 ZINC000904363992 584874170 /nfs/dbraw/zinc/87/41/70/584874170.db2.gz HUOOWQSJWBCGRB-UTUOFQBUSA-N 2 0 238.400 2.254 20 0 BEADRP Cc1cc(F)ccc1CC[NH2+]C1CC(C[NH3+])C1 ZINC000904363306 584874451 /nfs/dbraw/zinc/87/44/51/584874451.db2.gz DQZXSKLHYHHDRA-UHFFFAOYSA-N 2 0 236.334 2.004 20 0 BEADRP C[C@]1(C[NH2+]CCc2ccccc2)CCC[NH2+]C1 ZINC000904364688 584875048 /nfs/dbraw/zinc/87/50/48/584875048.db2.gz ORMNZSOVGXASNF-HNNXBMFYSA-N 2 0 232.371 2.208 20 0 BEADRP COc1ccc([C@H](C)[NH2+]CCC[NH3+])cc1C ZINC000904389598 584875176 /nfs/dbraw/zinc/87/51/76/584875176.db2.gz OKAXLKAAWGFDMN-NSHDSACASA-N 2 0 222.332 2.003 20 0 BEADRP [NH3+]CC[C@@H]1CC[N@H+](C[C@@H]2C[C@H]2c2ccccc2)C1 ZINC000904406509 584878289 /nfs/dbraw/zinc/87/82/89/584878289.db2.gz XMZPOFUAJMLHHK-KBMXLJTQSA-N 2 0 244.382 2.461 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@@H](C[NH3+])[C@@H](C)C2)s1 ZINC000904412778 584879770 /nfs/dbraw/zinc/87/97/70/584879770.db2.gz XPOVGVRLOZEMHS-JQWIXIFHSA-N 2 0 238.400 2.473 20 0 BEADRP C[C@H]1C[N@H+](Cc2cccs2)CC[C@@H]1C[NH3+] ZINC000904412844 584879929 /nfs/dbraw/zinc/87/99/29/584879929.db2.gz XTGVCKCWFCJMGY-WDEREUQCSA-N 2 0 224.373 2.165 20 0 BEADRP Cc1cc(F)ccc1C[N@@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1 ZINC000904420591 584882407 /nfs/dbraw/zinc/88/24/07/584882407.db2.gz ATYNHAQQWJZAGV-UONOGXRCSA-N 2 0 248.345 2.175 20 0 BEADRP C[NH+](C)CCCC1CC[NH+](CCF)CC1 ZINC000767004900 585512682 /nfs/dbraw/zinc/51/26/82/585512682.db2.gz VPONSUWFLNBDEE-UHFFFAOYSA-N 2 0 216.344 2.010 20 0 BEADRP C[NH+](C)CC1CC[NH+](Cc2ccoc2)CC1 ZINC000768303501 585535082 /nfs/dbraw/zinc/53/50/82/585535082.db2.gz UPDKMYKHQGPQMO-UHFFFAOYSA-N 2 0 222.332 2.053 20 0 BEADRP C[C@H](C[NH2+]C1CC(C(F)F)C1)C[NH+]1CCCC1 ZINC000768676981 585541704 /nfs/dbraw/zinc/54/17/04/585541704.db2.gz GECUWJCGCQVHOK-VOMCLLRMSA-N 2 0 246.345 2.352 20 0 BEADRP CC[NH+]1CCC(C[NH2+]C2CC(C(F)F)C2)CC1 ZINC000769512752 585558304 /nfs/dbraw/zinc/55/83/04/585558304.db2.gz RTGGARPAXOJNHG-UHFFFAOYSA-N 2 0 246.345 2.352 20 0 BEADRP COC1CCC(C[NH2+][C@H](C)CC[NH+](C)C)CC1 ZINC000769534699 585559027 /nfs/dbraw/zinc/55/90/27/585559027.db2.gz JOEBCGDBYCXVES-IYXRBSQSSA-N 2 0 242.407 2.121 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)c1ccc[nH]1)C1CC[NH+](C)CC1 ZINC000773118788 585631712 /nfs/dbraw/zinc/63/17/12/585631712.db2.gz QJEKMNOEUMTJCY-NEPJUHHUSA-N 2 0 235.375 2.396 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)C1CC[NH+](C)CC1)c1ccc[nH]1 ZINC000773118792 585631808 /nfs/dbraw/zinc/63/18/08/585631808.db2.gz QJEKMNOEUMTJCY-NWDGAFQWSA-N 2 0 235.375 2.396 20 0 BEADRP C[C@@H]([NH2+][C@H](C)C1CC[NH+](C)CC1)c1ccc[nH]1 ZINC000773118799 585631877 /nfs/dbraw/zinc/63/18/77/585631877.db2.gz QJEKMNOEUMTJCY-VXGBXAGGSA-N 2 0 235.375 2.396 20 0 BEADRP CC[N@@H+]1CCC[C@H](C[NH2+]C[C@@H]2CCC=CO2)C1 ZINC000774988685 585669976 /nfs/dbraw/zinc/66/99/76/585669976.db2.gz FNNIGHGXKYCZPY-KGLIPLIRSA-N 2 0 238.375 2.001 20 0 BEADRP C[C@H](CCO)[NH2+]CCCC[N@@H+]1CCCC[C@H]1C ZINC000779341419 585751695 /nfs/dbraw/zinc/75/16/95/585751695.db2.gz MLIORNHSTDKUFO-ZIAGYGMSSA-N 2 0 242.407 2.002 20 0 BEADRP C[C@@H](CCO)[NH2+]CCCC[N@@H+]1CCCC[C@@H]1C ZINC000779341416 585751822 /nfs/dbraw/zinc/75/18/22/585751822.db2.gz MLIORNHSTDKUFO-KBPBESRZSA-N 2 0 242.407 2.002 20 0 BEADRP CCc1cc(NCC[N@@H+]2CCC[C@@H]2C)nc(C)n1 ZINC000782148161 585808576 /nfs/dbraw/zinc/80/85/76/585808576.db2.gz LBMIVFRHNKSIQF-NSHDSACASA-N 2 0 248.374 2.244 20 0 BEADRP C[C@@H](C1CC1)[NH+]1CCC(n2ccnc2)CC1 ZINC000782180012 585809905 /nfs/dbraw/zinc/80/99/05/585809905.db2.gz BPVAUTJFJBOBFY-NSHDSACASA-N 2 0 219.332 2.319 20 0 BEADRP C[C@H](C1CC1)[NH+]1CCC(c2ncc[nH]2)CC1 ZINC000782180096 585809958 /nfs/dbraw/zinc/80/99/58/585809958.db2.gz DKZALHKYNBJOAO-SNVBAGLBSA-N 2 0 219.332 2.388 20 0 BEADRP CC[N@H+](C)C[C@@H]1CC[NH+]([C@@H](C)C2CC2)C1 ZINC000782191548 585811361 /nfs/dbraw/zinc/81/13/61/585811361.db2.gz XAVGKFIIMJSRHD-RYUDHWBXSA-N 2 0 210.365 2.059 20 0 BEADRP C[C@H]1CCCC[N@@H+]1CC1CC[NH+](C)CC1 ZINC000788471093 585925158 /nfs/dbraw/zinc/92/51/58/585925158.db2.gz UEYGHDUUEWYJHY-LBPRGKRZSA-N 2 0 210.365 2.203 20 0 BEADRP C[C@@H]1CCCC[N@@H+]1CC1CC[NH+](C)CC1 ZINC000788471091 585925186 /nfs/dbraw/zinc/92/51/86/585925186.db2.gz UEYGHDUUEWYJHY-GFCCVEGCSA-N 2 0 210.365 2.203 20 0 BEADRP C[N@H+](CC1CC[NH+](C)CC1)C(C1CC1)C1CC1 ZINC000788476657 585925340 /nfs/dbraw/zinc/92/53/40/585925340.db2.gz SEUDBRJCFFFYMB-UHFFFAOYSA-N 2 0 236.403 2.449 20 0 BEADRP C[NH+]1CCC([C@H]2CC[N@H+](Cc3ccoc3)C2)CC1 ZINC000809756113 586517703 /nfs/dbraw/zinc/51/77/03/586517703.db2.gz PXESPSWXOGXBDW-HNNXBMFYSA-N 2 0 248.370 2.443 20 0 BEADRP C[C@@H](CCC[NH3+])[NH2+][C@@H](C)c1ccc2c(c1)CCO2 ZINC000817901505 586835761 /nfs/dbraw/zinc/83/57/61/586835761.db2.gz WNLOHSVNSYICEM-RYUDHWBXSA-N 2 0 248.370 2.400 20 0 BEADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]CCNc1ccccc1 ZINC000817900312 586836273 /nfs/dbraw/zinc/83/62/73/586836273.db2.gz MFPGFLSIOUBNCF-HUUCEWRRSA-N 2 0 247.386 2.348 20 0 BEADRP CCN(C)c1ccccc1C[NH2+][C@H](C)C[C@H](C)[NH3+] ZINC000817902623 586836323 /nfs/dbraw/zinc/83/63/23/586836323.db2.gz VMVWALXNJWZMFI-QWHCGFSZSA-N 2 0 249.402 2.358 20 0 BEADRP [NH3+][C@H]1CCCCC[C@@H]1[NH2+]CCNc1ccccc1 ZINC000817900310 586836334 /nfs/dbraw/zinc/83/63/34/586836334.db2.gz MFPGFLSIOUBNCF-GJZGRUSLSA-N 2 0 247.386 2.348 20 0 BEADRP CSC(C)(C)C[NH2+][C@H]1CCCCC[C@@H]1[NH3+] ZINC000817900316 586836339 /nfs/dbraw/zinc/83/63/39/586836339.db2.gz ODHXNDRQGVGNSF-QWRGUYRKSA-N 2 0 230.421 2.378 20 0 BEADRP [NH3+][C@H]1CCCCC[C@H]1[NH2+]CCC1CCC1 ZINC000817907876 586836890 /nfs/dbraw/zinc/83/68/90/586836890.db2.gz YBTPFUXVVYFQCQ-QWHCGFSZSA-N 2 0 210.365 2.426 20 0 BEADRP Cc1cccc(OCCC[NH2+][C@@H]2CCC[C@@H]2[NH3+])c1 ZINC000817907777 586837407 /nfs/dbraw/zinc/83/74/07/586837407.db2.gz WETJPPWQBRKENW-LSDHHAIUSA-N 2 0 248.370 2.233 20 0 BEADRP CC[C@@H]([NH2+]CCC[NH3+])c1ccc2c(c1)CCCO2 ZINC000817939087 586843819 /nfs/dbraw/zinc/84/38/19/586843819.db2.gz YRQOPSQIPLSXCM-CQSZACIVSA-N 2 0 248.370 2.401 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]C[C@]1(C)CC1(Cl)Cl ZINC000817937598 586844599 /nfs/dbraw/zinc/84/45/99/586844599.db2.gz SRHIGGCGZODMHT-CIUDSAMLSA-N 2 0 239.190 2.286 20 0 BEADRP C[C@@H](CSC(C)(C)C)[NH2+]CC1CC[NH2+]CC1 ZINC000817941220 586845401 /nfs/dbraw/zinc/84/54/01/586845401.db2.gz NPCAKCHIUJXQEO-NSHDSACASA-N 2 0 244.448 2.496 20 0 BEADRP CC[C@H]([NH2+]CCC[NH2+]C)c1ccc2c(c1)CCO2 ZINC000817941331 586845443 /nfs/dbraw/zinc/84/54/43/586845443.db2.gz SUAVFEYYHRVALB-AWEZNQCLSA-N 2 0 248.370 2.272 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+]Cc1ccc(CC[NH3+])cc1 ZINC000817947862 586846685 /nfs/dbraw/zinc/84/66/85/586846685.db2.gz DCIQZOUNHGIYMY-CABCVRRESA-N 2 0 232.371 2.466 20 0 BEADRP CC[C@H]([NH2+]Cc1ccc(CC[NH3+])cc1)C1CC1 ZINC000817949943 586847437 /nfs/dbraw/zinc/84/74/37/586847437.db2.gz URIANJCRQNJNIH-HNNXBMFYSA-N 2 0 232.371 2.466 20 0 BEADRP C[C@@H]([NH2+]CC[C@H](C)[NH3+])c1ccc2c(c1)CCO2 ZINC000817953717 586848979 /nfs/dbraw/zinc/84/89/79/586848979.db2.gz UDLGYNDZJDXUHO-WDEREUQCSA-N 2 0 234.343 2.009 20 0 BEADRP C[C@@H](CSC(C)(C)C)[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000817955531 586850172 /nfs/dbraw/zinc/85/01/72/586850172.db2.gz YAZAKHHLYVBZGP-NWDGAFQWSA-N 2 0 244.448 2.496 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H](C)C[NH3+])c1ccc2c(c1)CCO2 ZINC000817961988 586853333 /nfs/dbraw/zinc/85/33/33/586853333.db2.gz FTXYJVXFIRQFNX-SMDDNHRTSA-N 2 0 248.370 2.257 20 0 BEADRP C[C@H]([NH3+])C[NH2+][C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000817971336 586856187 /nfs/dbraw/zinc/85/61/87/586856187.db2.gz CLSWXNOFFSFQRR-XHNCKOQMSA-N 2 0 224.270 2.044 20 0 BEADRP CC(C)(C)[C@@H](CN)[NH2+]CCc1cccs1 ZINC000842475215 588029004 /nfs/dbraw/zinc/02/90/04/588029004.db2.gz LLCQFSAQUSZBSB-LLVKDONJSA-N 2 0 226.389 2.254 20 0 BEADRP [NH3+]CCCCCCC[N@@H+]1CCOC[C@H]1C1CC1 ZINC000842475983 588029556 /nfs/dbraw/zinc/02/95/56/588029556.db2.gz CPUSAXZDHWDGAR-AWEZNQCLSA-N 2 0 240.391 2.006 20 0 BEADRP [NH3+]CCCCCCC[N@@H+]1CCOC[C@@H]1C1CC1 ZINC000842475984 588029930 /nfs/dbraw/zinc/02/99/30/588029930.db2.gz CPUSAXZDHWDGAR-CQSZACIVSA-N 2 0 240.391 2.006 20 0 BEADRP Cc1cc(C[NH2+][C@@H](C)C[C@@H](C)[NH3+])cnc1Cl ZINC000843126846 588084355 /nfs/dbraw/zinc/08/43/55/588084355.db2.gz AGIVVRSEZAEMEJ-ZJUUUORDSA-N 2 0 241.766 2.259 20 0 BEADRP Cc1cc(C[NH2+][C@H](C)C[C@@H](C)[NH3+])cnc1Cl ZINC000843126792 588084766 /nfs/dbraw/zinc/08/47/66/588084766.db2.gz AGIVVRSEZAEMEJ-NXEZZACHSA-N 2 0 241.766 2.259 20 0 BEADRP C[C@H]([NH2+]CCCCCC[NH3+])c1ccco1 ZINC000843342346 588101118 /nfs/dbraw/zinc/10/11/18/588101118.db2.gz KTFOBHHQLHCNFA-NSHDSACASA-N 2 0 210.321 2.449 20 0 BEADRP Cc1cc([C@@H](C)[NH2+]CCCCCC[NH3+])no1 ZINC000843340801 588101235 /nfs/dbraw/zinc/10/12/35/588101235.db2.gz FFQOXOMPJNTQLZ-LLVKDONJSA-N 2 0 225.336 2.153 20 0 BEADRP [NH3+]C1C[C@H]2CCC[C@@H](C1)N2C/C=C/Cl ZINC000846219472 588260629 /nfs/dbraw/zinc/26/06/29/588260629.db2.gz BJVBAZDIWULMIU-HFYMGGNWSA-N 2 0 214.740 2.083 20 0 BEADRP C[C@H]1C[C@H]([NH3+])CC[N@@H+]1Cc1ccc2c(c1)COC2 ZINC000846699881 588283398 /nfs/dbraw/zinc/28/33/98/588283398.db2.gz YBKFBJUEHSMURG-XHDPSFHLSA-N 2 0 246.354 2.028 20 0 BEADRP C[C@@H]1C[C@@H]([NH3+])CC[N@@H+]1Cc1ccc2c(c1)COC2 ZINC000846699873 588283443 /nfs/dbraw/zinc/28/34/43/588283443.db2.gz YBKFBJUEHSMURG-ABAIWWIYSA-N 2 0 246.354 2.028 20 0 BEADRP C[C@H](O)c1ccc(C[NH2+][C@H]2CCC[C@H]([NH3+])C2)cc1 ZINC000848717888 588408095 /nfs/dbraw/zinc/40/80/95/588408095.db2.gz XACUTDYKDVGZBW-CQDKDKBSSA-N 2 0 248.370 2.099 20 0 BEADRP CCCCCCNC(=[NH2+])NCCCC[NH+](C)C ZINC000848990095 588426582 /nfs/dbraw/zinc/42/65/82/588426582.db2.gz YOXIZEPVCGMGOG-UHFFFAOYSA-N 2 0 242.411 2.022 20 0 BEADRP C[C@@H]([NH2+]Cc1cnc2n1CCC2)c1ccc[nH]1 ZINC000850229243 588530613 /nfs/dbraw/zinc/53/06/13/588530613.db2.gz YFHORPYUBARQNB-SNVBAGLBSA-N 2 0 230.315 2.008 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000850583359 588561748 /nfs/dbraw/zinc/56/17/48/588561748.db2.gz NPHQSRJHXCQBSU-DOMZBBRYSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H]1CC[C@@H]1[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000850583362 588561810 /nfs/dbraw/zinc/56/18/10/588561810.db2.gz NPHQSRJHXCQBSU-WFASDCNBSA-N 2 0 236.403 2.497 20 0 BEADRP [NH3+]CCCCCC[N@@H+]1CC[C@]2(C1)CCCOC2 ZINC000852760476 588700641 /nfs/dbraw/zinc/70/06/41/588700641.db2.gz GKDLDALETVAZNQ-AWEZNQCLSA-N 2 0 240.391 2.008 20 0 BEADRP [NH3+]CCCCCC[N@@H+]1CC[C@@]2(C1)CCCOC2 ZINC000852760477 588700688 /nfs/dbraw/zinc/70/06/88/588700688.db2.gz GKDLDALETVAZNQ-CQSZACIVSA-N 2 0 240.391 2.008 20 0 BEADRP CC12CC(C1)C[N@@H+]2CCCCCCC[NH3+] ZINC000852763046 588701059 /nfs/dbraw/zinc/70/10/59/588701059.db2.gz FPCOBLMRXMPRET-UHFFFAOYSA-N 2 0 210.365 2.380 20 0 BEADRP C[NH+](C)C1CC[NH+](C[C@]2(C)CCCS2)CC1 ZINC000862223423 589195866 /nfs/dbraw/zinc/19/58/66/589195866.db2.gz PLWFHKFCUFDOMB-ZDUSSCGKSA-N 2 0 242.432 2.298 20 0 BEADRP CC[C@H]([NH2+]CCOCC[NH2+]C)C1CCCCC1 ZINC000863542006 589297024 /nfs/dbraw/zinc/29/70/24/589297024.db2.gz DEVFNHXIPPWNOQ-AWEZNQCLSA-N 2 0 242.407 2.171 20 0 BEADRP CCC(CC)NC(=[NH2+])NCCC[NH+](CC)CC ZINC000864450861 589364592 /nfs/dbraw/zinc/36/45/92/589364592.db2.gz APLXTJKENBVIFP-UHFFFAOYSA-N 2 0 242.411 2.021 20 0 BEADRP CS[C@H]1C[C@H]([NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)C1 ZINC000865733258 589459185 /nfs/dbraw/zinc/45/91/85/589459185.db2.gz GSQRQQHTWZHUQP-CYDGBPFRSA-N 2 0 240.416 2.097 20 0 BEADRP C(CC1CC1)C[N@@H+]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC000866665834 589509467 /nfs/dbraw/zinc/50/94/67/589509467.db2.gz IKVXVEQVBAKNSF-AWEZNQCLSA-N 2 0 222.376 2.252 20 0 BEADRP [NH3+]CCCCCC[N@@H+]1CC[C@@H]2CSC[C@@H]2C1 ZINC000866704866 589513867 /nfs/dbraw/zinc/51/38/67/589513867.db2.gz ZAFAXPRKSYZRKG-OLZOCXBDSA-N 2 0 242.432 2.190 20 0 BEADRP CC(C)(C)[C@]1(C[NH3+])CC[N@H+](CC2CC2)C1 ZINC000866709337 589514251 /nfs/dbraw/zinc/51/42/51/589514251.db2.gz WLLPYBLUEKSGOM-ZDUSSCGKSA-N 2 0 210.365 2.093 20 0 BEADRP CCOCCC[N@@H+]1CC[C@@](C[NH3+])(C(C)(C)C)C1 ZINC000866705531 589514307 /nfs/dbraw/zinc/51/43/07/589514307.db2.gz BVKZNHWTVNIJID-AWEZNQCLSA-N 2 0 242.407 2.110 20 0 BEADRP C[C@@H]1C[C@H]1C[N@@H+]1CC[C@](C[NH3+])(C(C)(C)C)C1 ZINC000866706702 589514326 /nfs/dbraw/zinc/51/43/26/589514326.db2.gz CBRCWGPTCHANEN-MBNYWOFBSA-N 2 0 224.392 2.339 20 0 BEADRP CC(C)([NH3+])C[N@@H+]1CCC[C@@H](OC2CCC2)CC1 ZINC000872257566 589901643 /nfs/dbraw/zinc/90/16/43/589901643.db2.gz TVIQUBNDECWVCI-CYBMUJFWSA-N 2 0 240.391 2.147 20 0 BEADRP C[NH+]1CCC(CNc2cc[nH+]cc2C2CC2)CC1 ZINC000872437866 589938839 /nfs/dbraw/zinc/93/88/39/589938839.db2.gz KGEOMKYMFCFZOO-UHFFFAOYSA-N 2 0 245.370 2.135 20 0 BEADRP C[C@H](CCC(F)(F)F)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873251758 589997821 /nfs/dbraw/zinc/99/78/21/589997821.db2.gz NZDRVOPBALJRDB-HLTSFMKQSA-N 2 0 224.270 2.044 20 0 BEADRP [NH3+][C@@H]1C[C@H]1c1ccc(N[C@@H]2CCC[NH2+]CC2)cc1 ZINC000873216809 589998137 /nfs/dbraw/zinc/99/81/37/589998137.db2.gz YGXHVWWFDXENJQ-VHDGCEQUSA-N 2 0 245.370 2.055 20 0 BEADRP C[C@@H]([NH2+][C@@H]1CCC[C@@H]1C)C1CC[NH2+]CC1 ZINC000873219924 589998566 /nfs/dbraw/zinc/99/85/66/589998566.db2.gz BVNWPNDAYIYWQZ-DMDPSCGWSA-N 2 0 210.365 2.153 20 0 BEADRP CCCC[C@H](COC)[NH2+][C@H](C)C1CC[NH2+]CC1 ZINC000873220090 589998948 /nfs/dbraw/zinc/99/89/48/589998948.db2.gz JBBGZMZNDPYKOD-TZMCWYRMSA-N 2 0 242.407 2.169 20 0 BEADRP CCCC[C@H](COC)[NH2+][C@@H](C)C1CC[NH2+]CC1 ZINC000873220086 589999079 /nfs/dbraw/zinc/99/90/79/589999079.db2.gz JBBGZMZNDPYKOD-GXTWGEPZSA-N 2 0 242.407 2.169 20 0 BEADRP Cn1ccc(C[N@@H+]2CC[C@@](C[NH3+])(C(C)(C)C)C2)c1 ZINC000873223923 590000315 /nfs/dbraw/zinc/00/03/15/590000315.db2.gz UUWGTQXMCJSUGW-HNNXBMFYSA-N 2 0 249.402 2.222 20 0 BEADRP CC(C)([NH3+])C[N@@H+]1CC[C@@]2(CCc3ccccc32)C1 ZINC000873226874 590000651 /nfs/dbraw/zinc/00/06/51/590000651.db2.gz CUGGEASLSNVCDP-INIZCTEOSA-N 2 0 244.382 2.314 20 0 BEADRP C([NH2+][C@]12CCC[C@H]1[NH2+]CC2)C1CCCCC1 ZINC000873229645 590001385 /nfs/dbraw/zinc/00/13/85/590001385.db2.gz DGGWYXYZDJWCDC-KGLIPLIRSA-N 2 0 222.376 2.441 20 0 BEADRP CO[C@H](c1ccccc1)[C@@H](C)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873248636 590006466 /nfs/dbraw/zinc/00/64/66/590006466.db2.gz CISVZULNZXASCX-UXOAXIEHSA-N 2 0 248.370 2.090 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+]C[C@H]2C[C@@H]([NH3+])C2)c(C)n1 ZINC000873250294 590007373 /nfs/dbraw/zinc/00/73/73/590007373.db2.gz GNBORFZZXCRNON-RTXFEEFZSA-N 2 0 233.359 2.086 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+]C(C2CCC2)C2CCC2)C1 ZINC000873249049 590007680 /nfs/dbraw/zinc/00/76/80/590007680.db2.gz HQLDDRJWHIEWJR-GSJFWJNXSA-N 2 0 222.376 2.282 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@H]2CCCC23CCCC3)C1 ZINC000873249101 590007686 /nfs/dbraw/zinc/00/76/86/590007686.db2.gz IIZWSJLWRPEYRE-XQQFMLRXSA-N 2 0 222.376 2.426 20 0 BEADRP CCC[C@@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)C1CCC1 ZINC000873250338 590008507 /nfs/dbraw/zinc/00/85/07/590008507.db2.gz PECIZHDJZAHPBX-KGYLQXTDSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)[C@@H]1CCC[C@H]1[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873253020 590008761 /nfs/dbraw/zinc/00/87/61/590008761.db2.gz XRBMTWWQDZWWDO-QNWHQSFQSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H]1CC[C@@H]([NH2+]C[C@H]2C[C@@H]([NH3+])C2)[C@@H](C)C1 ZINC000873252422 590008776 /nfs/dbraw/zinc/00/87/76/590008776.db2.gz RNQUMRGMMYZKEM-RXGFPQBGSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@H]2C[C@@H]([NH3+])C2)[C@H](C)C1 ZINC000873252420 590008993 /nfs/dbraw/zinc/00/89/93/590008993.db2.gz RNQUMRGMMYZKEM-KVSVUVNWSA-N 2 0 210.365 2.138 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccccc1N(C)C ZINC000873252654 590009049 /nfs/dbraw/zinc/00/90/49/590009049.db2.gz USRGGKCXSHGGGY-UPJWGTAASA-N 2 0 247.386 2.141 20 0 BEADRP C[C@H]1Cc2ccccc2[C@H]1[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873252830 590009073 /nfs/dbraw/zinc/00/90/73/590009073.db2.gz WEYSDJGPSPHSIF-MEDZGJRSSA-N 2 0 230.355 2.247 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1cc(F)ccc1F ZINC000873253767 590009377 /nfs/dbraw/zinc/00/93/77/590009377.db2.gz DTKURWLVYMBUGN-KKZNHRDASA-N 2 0 240.297 2.353 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@H]2CCCOc3ccccc32)C1 ZINC000873254210 590009406 /nfs/dbraw/zinc/00/94/06/590009406.db2.gz NFURSPRREYRLMV-SCRDCRAPSA-N 2 0 246.354 2.227 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccc2c(c1)COC2 ZINC000873253895 590009671 /nfs/dbraw/zinc/00/96/71/590009671.db2.gz GTXBIRLQFOKZSQ-ZIBATOQPSA-N 2 0 246.354 2.105 20 0 BEADRP CC[C@@H]1CCC[C@H]([NH2+]C[C@H]2C[C@@H]([NH3+])C2)C1 ZINC000873254274 590009686 /nfs/dbraw/zinc/00/96/86/590009686.db2.gz PDOFKFPQWFHYQJ-NDBYEHHHSA-N 2 0 210.365 2.282 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccnc(Cl)c1 ZINC000873254337 590009786 /nfs/dbraw/zinc/00/97/86/590009786.db2.gz QXJMVJGMHMQSNP-ATZCPNFKSA-N 2 0 239.750 2.123 20 0 BEADRP CC[C@H](Cc1cccs1)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873254637 590009969 /nfs/dbraw/zinc/00/99/69/590009969.db2.gz YVGYRSHTLXGXSK-GRYCIOLGSA-N 2 0 238.400 2.396 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@@H]2CCc3c2cccc3F)C1 ZINC000873254603 590010070 /nfs/dbraw/zinc/01/00/70/590010070.db2.gz YBOJGXRNZVBGPZ-ISTVAULSSA-N 2 0 234.318 2.140 20 0 BEADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@@H]2CCCc3sccc32)C1 ZINC000873255045 590010188 /nfs/dbraw/zinc/01/01/88/590010188.db2.gz DQFGGAUPSWKVGU-JFGNBEQYSA-N 2 0 236.384 2.452 20 0 BEADRP COc1ccccc1[C@H](C)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873255330 590010286 /nfs/dbraw/zinc/01/02/86/590010286.db2.gz GJHMFGMAHUEHCO-SDDRHHMPSA-N 2 0 234.343 2.083 20 0 BEADRP CC(C)(C)[C@@H]1CC[C@@H]1[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873255853 590010559 /nfs/dbraw/zinc/01/05/59/590010559.db2.gz IYVYPYRDRDQZOZ-KKOKHZNYSA-N 2 0 210.365 2.138 20 0 BEADRP CC[C@@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccccc1 ZINC000873255869 590010676 /nfs/dbraw/zinc/01/06/76/590010676.db2.gz JMSJBBPUUXMTKH-KWCYVHTRSA-N 2 0 218.344 2.465 20 0 BEADRP Cc1ccc([C@H](C)[NH2+]C[C@H]2C[C@@H]([NH3+])C2)cc1 ZINC000873256145 590010750 /nfs/dbraw/zinc/01/07/50/590010750.db2.gz MEZOTVJROQFAJS-SGMGOOAPSA-N 2 0 218.344 2.383 20 0 BEADRP COc1ccc([C@@H](C)[NH2+]C[C@H]2C[C@@H]([NH3+])C2)cc1 ZINC000873255634 590010791 /nfs/dbraw/zinc/01/07/91/590010791.db2.gz IMSBOOCXYGCKND-WZRBSPASSA-N 2 0 234.343 2.083 20 0 BEADRP CCOc1ccc([C@@H](C)[NH2+]C[C@H]2C[C@@H]([NH3+])C2)cc1 ZINC000873256252 590010940 /nfs/dbraw/zinc/01/09/40/590010940.db2.gz NDNZLGADJABGOW-BZPMIXESSA-N 2 0 248.370 2.473 20 0 BEADRP CC(C)(C)[C@H]1CC[C@@H]1[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873255850 590011250 /nfs/dbraw/zinc/01/12/50/590011250.db2.gz IYVYPYRDRDQZOZ-BJDJZHNGSA-N 2 0 210.365 2.138 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+][C@@H]2CCC[C@H](C3CC3)C2)C1 ZINC000873256300 590011266 /nfs/dbraw/zinc/01/12/66/590011266.db2.gz MZTNMQSFCSGLDH-DOERSZECSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@@H](CCC(F)(F)F)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873256778 590011371 /nfs/dbraw/zinc/01/13/71/590011371.db2.gz NZDRVOPBALJRDB-CIUDSAMLSA-N 2 0 224.270 2.044 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccc2c(c1)CCO2 ZINC000873256929 590011539 /nfs/dbraw/zinc/01/15/39/590011539.db2.gz RCGXIFLJVMFKJT-GYSYKLTISA-N 2 0 246.354 2.009 20 0 BEADRP COc1ccccc1[C@@H](C)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873257262 590011550 /nfs/dbraw/zinc/01/15/50/590011550.db2.gz GJHMFGMAHUEHCO-IJLUTSLNSA-N 2 0 234.343 2.083 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+][C@@H]2CCCNc3ccccc32)C1 ZINC000873256787 590011791 /nfs/dbraw/zinc/01/17/91/590011791.db2.gz OFFIOEDLNONAHT-LALPHHSUSA-N 2 0 245.370 2.260 20 0 BEADRP Cc1ccc2c(c1)CC[C@H]2[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873257200 590011816 /nfs/dbraw/zinc/01/18/16/590011816.db2.gz FRWXMRMVQJOLMK-UXIGCNINSA-N 2 0 230.355 2.309 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1ccsc1 ZINC000873256610 590011847 /nfs/dbraw/zinc/01/18/47/590011847.db2.gz BCGFBOQSOXIULL-QXEWZRGKSA-N 2 0 210.346 2.136 20 0 BEADRP C[C@H](CCCc1cccnc1)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873257353 590012156 /nfs/dbraw/zinc/01/21/56/590012156.db2.gz SZZFRGAJAYIILO-BPLDGKMQSA-N 2 0 247.386 2.120 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1ccc(F)cc1 ZINC000873258112 590012176 /nfs/dbraw/zinc/01/21/76/590012176.db2.gz MVFBMRQRDVARPR-KWBADKCTSA-N 2 0 222.307 2.214 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+]C2CCc3ccccc3CC2)C1 ZINC000873257788 590012205 /nfs/dbraw/zinc/01/22/05/590012205.db2.gz XMDSJXARKYPGQV-NNUKFRKNSA-N 2 0 244.382 2.261 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1cccs1 ZINC000873257391 590012210 /nfs/dbraw/zinc/01/22/10/590012210.db2.gz UKIVWNPORSWYKJ-BBBLOLIVSA-N 2 0 210.346 2.136 20 0 BEADRP C[C@H](CC1CCCC1)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873258244 590012472 /nfs/dbraw/zinc/01/24/72/590012472.db2.gz YVKPBDJNRBEJOC-RAIGVLPGSA-N 2 0 210.365 2.282 20 0 BEADRP C([NH2+]C1CCCCC1)[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000873258046 590012480 /nfs/dbraw/zinc/01/24/80/590012480.db2.gz LNEYRBZITRXFPA-UBSAEIQESA-N 2 0 222.376 2.439 20 0 BEADRP CCC1CCC([NH2+]C[C@H]2C[C@H]([NH3+])C2)CC1 ZINC000873257476 590012517 /nfs/dbraw/zinc/01/25/17/590012517.db2.gz ICWQHJDOIGTWRF-XQSKIALTSA-N 2 0 210.365 2.282 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+][C@H]2CCc3ccccc32)C1 ZINC000873258984 590012940 /nfs/dbraw/zinc/01/29/40/590012940.db2.gz XNTNGMIFHFMION-JKOKRWQUSA-N 2 0 216.328 2.001 20 0 BEADRP CC[C@H]1CCCC[C@@H]1[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873259118 590012967 /nfs/dbraw/zinc/01/29/67/590012967.db2.gz ZPZVJLJEDOIAMP-CYDGBPFRSA-N 2 0 210.365 2.282 20 0 BEADRP CC(C)[C@H]1CCC[C@@H]1[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873258195 590012978 /nfs/dbraw/zinc/01/29/78/590012978.db2.gz XRBMTWWQDZWWDO-LPWJVIDDSA-N 2 0 210.365 2.138 20 0 BEADRP [NH3+][C@H]1C[C@H](C[NH2+][C@H](c2cccnc2)C2CCC2)C1 ZINC000873259140 590013546 /nfs/dbraw/zinc/01/35/46/590013546.db2.gz ZXPOIDONMASEPN-CQDKDKBSSA-N 2 0 245.370 2.250 20 0 BEADRP CC(C)[C@H](C)[NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000873259963 590013631 /nfs/dbraw/zinc/01/36/31/590013631.db2.gz PNNRNRXGSKRFJY-RVMXOQNASA-N 2 0 210.365 2.151 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)c1ccoc1)C1CC[NH2+]CC1 ZINC000873267424 590015419 /nfs/dbraw/zinc/01/54/19/590015419.db2.gz CGJKYFXDJABWPJ-MNOVXSKESA-N 2 0 222.332 2.318 20 0 BEADRP Cc1ccncc1[C@H](C)[NH2+][C@H](C)C1CC[NH2+]CC1 ZINC000873268588 590015581 /nfs/dbraw/zinc/01/55/81/590015581.db2.gz XLZUEKXRFBHTIC-OLZOCXBDSA-N 2 0 247.386 2.429 20 0 BEADRP CC[C@@H](C)[C@H](C)[NH2+][C@@H](C)C1CC[NH2+]CC1 ZINC000873269335 590015621 /nfs/dbraw/zinc/01/56/21/590015621.db2.gz FYIWMLOGRPXATH-WOPDTQHZSA-N 2 0 212.381 2.399 20 0 BEADRP Cc1cncc([C@H](C)[NH2+][C@@H](C)C2CC[NH2+]CC2)c1 ZINC000873271967 590015889 /nfs/dbraw/zinc/01/58/89/590015889.db2.gz NQDBZYHYTKKZHC-STQMWFEESA-N 2 0 247.386 2.429 20 0 BEADRP Cc1cc([C@@H](C)[NH2+][C@@H](C)C2CC[NH2+]CC2)no1 ZINC000873271621 590015911 /nfs/dbraw/zinc/01/59/11/590015911.db2.gz KGMRNJDPDQHWRY-WDEREUQCSA-N 2 0 237.347 2.022 20 0 BEADRP C[C@H]([NH2+][C@H]1CCC12CCC2)C1CC[NH2+]CC1 ZINC000873272270 590016201 /nfs/dbraw/zinc/01/62/01/590016201.db2.gz RFCJVYCSNKIPGQ-AAEUAGOBSA-N 2 0 222.376 2.297 20 0 BEADRP CC[C@@H]1CC[C@@H]1[NH2+][C@@H](C)C1CC[NH2+]CC1 ZINC000873272245 590016273 /nfs/dbraw/zinc/01/62/73/590016273.db2.gz QUMXYHLBELIVNK-LOWVWBTDSA-N 2 0 210.365 2.153 20 0 BEADRP C[C@@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)c1ccoc1 ZINC000873270999 590016453 /nfs/dbraw/zinc/01/64/53/590016453.db2.gz CGJKYFXDJABWPJ-WDEREUQCSA-N 2 0 222.332 2.318 20 0 BEADRP CC[C@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)[C@@H]1C[C@@H]1C ZINC000873273154 590016959 /nfs/dbraw/zinc/01/69/59/590016959.db2.gz YRHGFCWHUWIQHL-VTPLQMEGSA-N 2 0 224.392 2.399 20 0 BEADRP COc1ccccc1[C@@H](C)[NH2+][C@H](C)C[C@@H](C)[NH3+] ZINC000873273587 590016966 /nfs/dbraw/zinc/01/69/66/590016966.db2.gz JATDGUDWOBOXPK-IJLUTSLNSA-N 2 0 236.359 2.472 20 0 BEADRP C[C@H](CCCC[NH3+])[NH2+]C[C@@H]1C[C@H]2CCC[C@@H]2O1 ZINC000873282167 590018837 /nfs/dbraw/zinc/01/88/37/590018837.db2.gz QZDDNVDCFHOEOK-MQYQWHSLSA-N 2 0 240.391 2.051 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CCC[C@@H]1C=CCC1 ZINC000873281673 590018910 /nfs/dbraw/zinc/01/89/10/590018910.db2.gz OLCVDSUGQYOGQC-RWMBFGLXSA-N 2 0 210.365 2.448 20 0 BEADRP [NH3+][C@H]1CCC[C@@H]1[NH2+]C1CC(Nc2ccccc2)C1 ZINC000873295324 590024466 /nfs/dbraw/zinc/02/44/66/590024466.db2.gz FRYUMYSBLRYALE-WUCCLRPBSA-N 2 0 245.370 2.099 20 0 BEADRP CC(C)[NH+]1CCC([NH2+]C2CCCC2)CC1 ZINC000019883335 590032449 /nfs/dbraw/zinc/03/24/49/590032449.db2.gz BIUOYOIYUAMTMN-UHFFFAOYSA-N 2 0 210.365 2.391 20 0 BEADRP CC[C@@H](C)C[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000020189447 590083289 /nfs/dbraw/zinc/08/32/89/590083289.db2.gz SRBVELMIHKSAQS-GFCCVEGCSA-N 2 0 212.381 2.495 20 0 BEADRP C([C@H]1CCC[NH2+]C1)[NH+]1CCCCCCC1 ZINC000020266247 590093958 /nfs/dbraw/zinc/09/39/58/590093958.db2.gz LDPSEVMDESXUQV-ZDUSSCGKSA-N 2 0 210.365 2.252 20 0 BEADRP CC[C@H](C)[C@H](C[NH2+]C[C@H]1CCCN1CC)OC ZINC000876882029 590253160 /nfs/dbraw/zinc/25/31/60/590253160.db2.gz XPVXHUXSDOATPF-MJBXVCDLSA-N 2 0 242.407 2.121 20 0 BEADRP CCC[NH+]1CCC([NH2+]CCCCCCO)CC1 ZINC000126239259 590256130 /nfs/dbraw/zinc/25/61/30/590256130.db2.gz PSOTUHUHEFWNBK-UHFFFAOYSA-N 2 0 242.407 2.003 20 0 BEADRP COC[C@@H]([NH2+]C[C@H](C)N1CCCCC1)C(C)C ZINC000126431727 590302686 /nfs/dbraw/zinc/30/26/86/590302686.db2.gz PPRYLSSIVSSJQW-UONOGXRCSA-N 2 0 242.407 2.121 20 0 BEADRP CC[C@H](C)C[N@@H+]1CC[C@@H]2[C@H](CC[NH+]2C)C1 ZINC000877742961 590409126 /nfs/dbraw/zinc/40/91/26/590409126.db2.gz SHYKWBFDSJOVBK-YNEHKIRRSA-N 2 0 210.365 2.059 20 0 BEADRP C[NH+](C)C1CC[NH+](CCCC2CC2)CC1 ZINC000877959634 590458447 /nfs/dbraw/zinc/45/84/47/590458447.db2.gz PIMSKXARMQAPEV-UHFFFAOYSA-N 2 0 210.365 2.203 20 0 BEADRP C[NH+](C)C[C@@H]1CC[N@H+](CCCC2CC2)C1 ZINC000878104828 590495320 /nfs/dbraw/zinc/49/53/20/590495320.db2.gz QHXMKYABYXUKHE-ZDUSSCGKSA-N 2 0 210.365 2.060 20 0 BEADRP CCC[NH+]1CCC2(CC[NH+](C)CC2)CC1 ZINC000879248839 590720803 /nfs/dbraw/zinc/72/08/03/590720803.db2.gz VVISFAXAJJVOJO-UHFFFAOYSA-N 2 0 210.365 2.204 20 0 BEADRP Cc1ccc(CN2CC[C@H]3[C@H]2CCC[N@H+]3C)nc1 ZINC000880138550 590940234 /nfs/dbraw/zinc/94/02/34/590940234.db2.gz YJCCXXNXWBVLRS-LSDHHAIUSA-N 2 0 245.370 2.059 20 0 BEADRP Cc1ccc(CN2CC[C@@H]3[C@@H]2CCC[N@H+]3C)nc1 ZINC000880138547 590940844 /nfs/dbraw/zinc/94/08/44/590940844.db2.gz YJCCXXNXWBVLRS-CABCVRRESA-N 2 0 245.370 2.059 20 0 BEADRP CC[NH+](CC)CCC[N@H+](C)C1(COC)CCC1 ZINC000880185588 590954660 /nfs/dbraw/zinc/95/46/60/590954660.db2.gz VLXMPAQRYHYKTO-UHFFFAOYSA-N 2 0 242.407 2.219 20 0 BEADRP C[C@H]1C[N@H+](CC2CCC2)CCN1c1cc[nH+]cc1 ZINC000880259089 590978701 /nfs/dbraw/zinc/97/87/01/590978701.db2.gz MKHNKCYSTJKYHC-ZDUSSCGKSA-N 2 0 245.370 2.392 20 0 BEADRP CCC[N@@H+]1CCN(c2cc[nH+]cc2)[C@@H](C)C1 ZINC000880262450 590981006 /nfs/dbraw/zinc/98/10/06/590981006.db2.gz ZSKBWWGAGYOBCQ-LBPRGKRZSA-N 2 0 219.332 2.002 20 0 BEADRP C[C@H]1C[C@@H]1C[NH+]1CCC(C)([NH+]2CCC2)CC1 ZINC000880476118 591053259 /nfs/dbraw/zinc/05/32/59/591053259.db2.gz NTMHJIDGNQOVOG-QWHCGFSZSA-N 2 0 222.376 2.203 20 0 BEADRP [NH3+]C[C@@H]1CC[N@H+](Cc2coc3ccccc23)C1 ZINC000131030693 591542387 /nfs/dbraw/zinc/54/23/87/591542387.db2.gz QCLXBQJIMLRZGB-NSHDSACASA-N 2 0 230.311 2.213 20 0 BEADRP [NH3+]C[C@H]1CCCN1Cc1coc2ccccc12 ZINC000131407215 591608611 /nfs/dbraw/zinc/60/86/11/591608611.db2.gz DWLQYAJQHHFVTK-GFCCVEGCSA-N 2 0 230.311 2.356 20 0 BEADRP CCN1CC[C@@H]1C[NH2+][C@H](C)CC1(OC)CCC1 ZINC000883355834 591625709 /nfs/dbraw/zinc/62/57/09/591625709.db2.gz YTBDGJJNFMCOID-CHWSQXEVSA-N 2 0 240.391 2.018 20 0 BEADRP C=C/C=C/CC[N@@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000883424622 591658345 /nfs/dbraw/zinc/65/83/45/591658345.db2.gz YCNLGTBRHWSFPZ-ONEGZZNKSA-N 2 0 220.360 2.194 20 0 BEADRP FC1(F)CCC[C@@H]1CCN1CC[C@@H]2C[NH2+]C[C@@H]21 ZINC000883429588 591660603 /nfs/dbraw/zinc/66/06/03/591660603.db2.gz ZQNWDWZISMIFNT-UTUOFQBUSA-N 2 0 244.329 2.106 20 0 BEADRP FC1(F)CCC[C@H]1CCN1CC[C@@H]2C[NH2+]C[C@@H]21 ZINC000883429589 591660973 /nfs/dbraw/zinc/66/09/73/591660973.db2.gz ZQNWDWZISMIFNT-WOPDTQHZSA-N 2 0 244.329 2.106 20 0 BEADRP C=C/C=C/CC[N@@H+]1CCC[C@]2(CC[NH2+]C2)C1 ZINC000883429909 591661864 /nfs/dbraw/zinc/66/18/64/591661864.db2.gz HZRJEFBBPYKIBK-RDFMZFSFSA-N 2 0 220.360 2.194 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]C[C@@H]2CCCOC2)c2ccccc21 ZINC000132029213 591685158 /nfs/dbraw/zinc/68/51/58/591685158.db2.gz YXMMVVYDQGMHBT-GLQYFDAESA-N 2 0 246.354 2.147 20 0 BEADRP CCc1nccc(NC[C@H]2CCCC[N@H+](C)C2)n1 ZINC000884564902 591982545 /nfs/dbraw/zinc/98/25/45/591982545.db2.gz UJGQFHQUSYLSLJ-GFCCVEGCSA-N 2 0 248.374 2.183 20 0 BEADRP Cc1coc(C[NH2+]CC[C@H]2CCC[N@@H+](C)C2)c1 ZINC000886142508 592163002 /nfs/dbraw/zinc/16/30/02/592163002.db2.gz DRDDWUTWAYEQBX-CYBMUJFWSA-N 2 0 236.359 2.410 20 0 BEADRP C[NH+]1CCC(C)(C[NH2+]C[C@H]2CCC=CO2)CC1 ZINC000219485711 592225992 /nfs/dbraw/zinc/22/59/92/592225992.db2.gz CGABCTAEZBKDRQ-CYBMUJFWSA-N 2 0 238.375 2.001 20 0 BEADRP C[C@@H](CC(F)(F)F)[NH2+]C1CCC([NH3+])CC1 ZINC000220816923 592356956 /nfs/dbraw/zinc/35/69/56/592356956.db2.gz FHRSKVWVXOGYBG-UEJVZZJDSA-N 2 0 224.270 2.187 20 0 BEADRP CS[C@@H]1CC[C@H]([NH2+][C@H]2CCCC[C@@H]2C[NH3+])C1 ZINC000300387869 592510162 /nfs/dbraw/zinc/51/01/62/592510162.db2.gz NHDAINSJQPXXNM-XQHKEYJVSA-N 2 0 242.432 2.378 20 0 BEADRP CC1(C)C[NH2+]CC[C@@H]1[NH2+]CCCC1CC1 ZINC000300833806 592521445 /nfs/dbraw/zinc/52/14/45/592521445.db2.gz KVVLDJJRCQRVKZ-LBPRGKRZSA-N 2 0 210.365 2.154 20 0 BEADRP CC(C)(C)C[C@@H]1C[C@H]1[NH2+][C@H]1[C@@H]2[NH2+]C[C@H]3C[C@H]1C[C@H]23 ZINC000925707214 634393354 /nfs/dbraw/zinc/39/33/54/634393354.db2.gz DIAIGJYQCIYTGS-NZDOLIBDSA-N 2 0 248.414 2.397 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+][C@@H]2C[C@H]2C2CCC2)C12CCC2 ZINC000925707726 634395541 /nfs/dbraw/zinc/39/55/41/634395541.db2.gz QZXNVASNDYFOIH-RNJOBUHISA-N 2 0 220.360 2.035 20 0 BEADRP CC1(C)C[C@H]([NH3+])C[C@@H]([NH2+]Cc2cccc(N)c2)C1 ZINC000925714678 634431577 /nfs/dbraw/zinc/43/15/77/634431577.db2.gz USGLLNWVXHBYMA-ZIAGYGMSSA-N 2 0 247.386 2.264 20 0 BEADRP [NH3+]CC[C@H]1CC[N@H+](Cc2ccc3c(c2)CCC3)C1 ZINC000125510772 634525516 /nfs/dbraw/zinc/52/55/16/634525516.db2.gz KMFXUTQRKPQGMA-ZDUSSCGKSA-N 2 0 244.382 2.346 20 0 BEADRP CC1(C[NH2+][C@H]2CC[NH2+]C23CCC3)CC(F)(F)C1 ZINC000925733854 634582172 /nfs/dbraw/zinc/58/21/72/634582172.db2.gz LPTORYLZGLNKQC-JTQLQIEISA-N 2 0 244.329 2.296 20 0 BEADRP CC(C)(C[NH2+][C@@H]1CCC[NH2+]CC1)CC(F)F ZINC000925734228 634583938 /nfs/dbraw/zinc/58/39/38/634583938.db2.gz PBGXGGLVUFQWNW-SNVBAGLBSA-N 2 0 234.334 2.400 20 0 BEADRP CCC[C@H](C)CC[NH2+][C@@H]1CCOC[C@@H]1[C@H](C)[NH3+] ZINC000925734999 634584727 /nfs/dbraw/zinc/58/47/27/634584727.db2.gz XAUXIRMOSBBRDF-IGQOVBAYSA-N 2 0 242.407 2.155 20 0 BEADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CC(C)(C)CC(F)F ZINC000925734746 634585433 /nfs/dbraw/zinc/58/54/33/634585433.db2.gz UIVCKKJRYNJLIT-DTWKUNHWSA-N 2 0 222.323 2.383 20 0 BEADRP Cc1ncc([C@H](C)[NH2+]CCC(C)(C)[NH3+])s1 ZINC000925740051 634601452 /nfs/dbraw/zinc/60/14/52/634601452.db2.gz GPWHBRIBZQIECL-QMMMGPOBSA-N 2 0 227.377 2.230 20 0 BEADRP C[C@@H]1C[C@H]1[C@@H]1C[C@H]1[NH2+][C@@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C ZINC000925821674 635398385 /nfs/dbraw/zinc/39/83/85/635398385.db2.gz HNRLNZBDFFQXFB-AJSSQEGLSA-N 2 0 248.414 2.397 20 0 BEADRP C[C@@H]1C[C@H]1[C@@H]1C[C@H]1[NH2+][C@H]1C[C@@H]2CC[C@@H]([NH2+]2)[C@@H]1C ZINC000925822886 635403390 /nfs/dbraw/zinc/40/33/90/635403390.db2.gz LUKMXXYBDBDRPY-IPTDIXAVSA-N 2 0 234.387 2.150 20 0 BEADRP C[C@@H]1C[C@H]1[C@@H]1C[C@H]1[NH2+][C@@H]1CCCC[C@@H]1C[NH3+] ZINC000925823012 635406079 /nfs/dbraw/zinc/40/60/79/635406079.db2.gz NNEVJDBMQBXZNT-YOVYLDAJSA-N 2 0 222.376 2.138 20 0 BEADRP [NH3+][C@@H]1C[C@H]([NH2+]C[C@@H]2C[C@H]2C(F)(F)F)C12CCC2 ZINC000925831922 635469840 /nfs/dbraw/zinc/46/98/40/635469840.db2.gz MWHUHSROSQMZQM-JLIMGVALSA-N 2 0 248.292 2.044 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@H]([NH3+])C23CCC3)CCS1 ZINC000925857569 635549102 /nfs/dbraw/zinc/54/91/02/635549102.db2.gz HNMQXSJGEZPXDO-WISYIIOYSA-N 2 0 240.416 2.130 20 0 BEADRP CC[C@H]([NH2+]C[C@]12C[C@H]1CCC2)[C@@H]1CCC[NH2+]1 ZINC000925881812 635610057 /nfs/dbraw/zinc/61/00/57/635610057.db2.gz VDBAYRUPNZSCTB-RFGFWPKPSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H]([NH2+]C[C@]12C[C@H]1CCC2)[C@H]1CCC[NH2+]C1 ZINC000925881431 635610416 /nfs/dbraw/zinc/61/04/16/635610416.db2.gz RQDLEIWEQCCWAG-FQUUOJAGSA-N 2 0 222.376 2.154 20 0 BEADRP Cc1ncc([C@@H](C)[NH2+]C[C@@H]2CC[C@H]([NH3+])C2)s1 ZINC000925883330 635610465 /nfs/dbraw/zinc/61/04/65/635610465.db2.gz VEOPVNARZIJEOB-IEBDPFPHSA-N 2 0 239.388 2.230 20 0 BEADRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]CC1CCC=CCC1 ZINC000925882143 635610503 /nfs/dbraw/zinc/61/05/03/635610503.db2.gz XOPSCLFYSLDVBU-ZIAGYGMSSA-N 2 0 222.376 2.450 20 0 BEADRP C[C@@H]([NH2+]C[C@]12C[C@H]1CCC2)[C@H]1CCC[NH2+]C1 ZINC000925881434 635610691 /nfs/dbraw/zinc/61/06/91/635610691.db2.gz RQDLEIWEQCCWAG-RQJABVFESA-N 2 0 222.376 2.154 20 0 BEADRP C[C@H]([NH2+]C[C@]12C[C@H]1CCC2)[C@@H]1CCC[NH2+]C1 ZINC000925881429 635611335 /nfs/dbraw/zinc/61/13/35/635611335.db2.gz RQDLEIWEQCCWAG-DGAVXFQQSA-N 2 0 222.376 2.154 20 0 BEADRP CCC1(C)CC[NH+](C[C@@H]2C[NH2+]C[C@H]2C)CC1 ZINC000082560898 631407429 /nfs/dbraw/zinc/40/74/29/631407429.db2.gz USLGKLGMAGUBTF-OLZOCXBDSA-N 2 0 224.392 2.354 20 0 BEADRP CO[C@@H](C)C[NH2+]C1CC[NH+](CCC(C)C)CC1 ZINC000926247760 631501789 /nfs/dbraw/zinc/50/17/89/631501789.db2.gz WXZYWQJNOWCSMD-ZDUSSCGKSA-N 2 0 242.407 2.121 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[NH+]2CCc3ccccc3CC2)C1 ZINC000091542711 631540999 /nfs/dbraw/zinc/54/09/99/631540999.db2.gz WEBFBEKKPYPCEL-XJKSGUPXSA-N 2 0 244.382 2.215 20 0 BEADRP Cc1ccc([C@@H](C)[NH2+]CCC(C)(C)[NH3+])o1 ZINC000308854656 631695000 /nfs/dbraw/zinc/69/50/00/631695000.db2.gz IDNJKYBWSGNPHG-SNVBAGLBSA-N 2 0 210.321 2.366 20 0 BEADRP C[C@H](Cc1cccs1)[NH2+]CCC(C)(C)[NH3+] ZINC000308969383 631773249 /nfs/dbraw/zinc/77/32/49/631773249.db2.gz OKALMWJVOPSTMR-SNVBAGLBSA-N 2 0 226.389 2.396 20 0 BEADRP C[C@H]1CC[N@H+](CC2CC[NH+](C)CC2)[C@H]1C ZINC000892212798 631786968 /nfs/dbraw/zinc/78/69/68/631786968.db2.gz UMCXTCYVOLKYRG-RYUDHWBXSA-N 2 0 210.365 2.059 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@H]1CCOC12CCCC2 ZINC000934395044 631820542 /nfs/dbraw/zinc/82/05/42/631820542.db2.gz IYNLJCQCUIFBEA-ZDUSSCGKSA-N 2 0 240.391 2.020 20 0 BEADRP CC(C)C[N@H+](CC[C@@H]1CCC[NH2+]C1)C1CC1 ZINC000051919294 632012232 /nfs/dbraw/zinc/01/22/32/632012232.db2.gz QBQBCYJTPABAKJ-ZDUSSCGKSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1CCC[NH2+]1)C1CCCCC1 ZINC000235530367 632045687 /nfs/dbraw/zinc/04/56/87/632045687.db2.gz IOJVZDKMAPNRCJ-AAEUAGOBSA-N 2 0 210.365 2.297 20 0 BEADRP CC(C)[NH+](CCNC(=[NH2+])NC(C)(C)C)C(C)C ZINC000052040836 632052064 /nfs/dbraw/zinc/05/20/64/632052064.db2.gz GLPPMQHYPFXGSE-UHFFFAOYSA-N 2 0 242.411 2.018 20 0 BEADRP C[C@H]1CC[N@H+](CCC2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000251718967 635706496 /nfs/dbraw/zinc/70/64/96/635706496.db2.gz PPDICNYAKYCLDD-FUDCBSFHSA-N 2 0 222.376 2.249 20 0 BEADRP CC(C)[C@@H](C)[N@H+](C)C[C@@]1(C)CCC[NH2+]C1 ZINC000219755026 632565309 /nfs/dbraw/zinc/56/53/09/632565309.db2.gz POZKBXFBYCFORJ-OLZOCXBDSA-N 2 0 212.381 2.352 20 0 BEADRP CC[C@@H]1CCC[N@H+](C[C@@]2(C)CCC[NH2+]C2)C1 ZINC000219755970 632565625 /nfs/dbraw/zinc/56/56/25/632565625.db2.gz XBYYMBDUUDYABM-KGLIPLIRSA-N 2 0 224.392 2.498 20 0 BEADRP CSC1CC([NH2+]CC[C@@H]2CCC[N@H+](C)C2)C1 ZINC000926571715 632569480 /nfs/dbraw/zinc/56/94/80/632569480.db2.gz AUGJBMXUFGNBMT-HIFPTAJRSA-N 2 0 242.432 2.202 20 0 BEADRP C[C@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)C1(Cl)CC1 ZINC000926573779 632570956 /nfs/dbraw/zinc/57/09/56/632570956.db2.gz QBVPQSPIFUDYCR-NWDGAFQWSA-N 2 0 244.810 2.468 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@@H+]1CCC[C@H]1C1CCCC1 ZINC000235263699 632591871 /nfs/dbraw/zinc/59/18/71/632591871.db2.gz WXYHQOUBTSAQGF-SNPRPXQTSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@@H]1CC[C@@H]1[NH2+]CC(C)(C)C[NH+]1CCCC1 ZINC000309761831 632667020 /nfs/dbraw/zinc/66/70/20/632667020.db2.gz IVMRXQJOHKBYEF-OLZOCXBDSA-N 2 0 224.392 2.497 20 0 BEADRP C[N@H+]1C[C@H]2CC[C@@H](C1)C2[NH2+][C@@H]1C[C@H]1C1CCC1 ZINC000926617398 632710436 /nfs/dbraw/zinc/71/04/36/632710436.db2.gz XXBSATHJSHOBKJ-DRWKLNATSA-N 2 0 234.387 2.105 20 0 BEADRP C[C@@H]1C[C@H](C[N@H+]2C[C@@H]3CC=CC[C@@H]3C2)CC[NH2+]1 ZINC000310339639 632723473 /nfs/dbraw/zinc/72/34/73/632723473.db2.gz NRXAQMBWCAOXTI-TUVASFSCSA-N 2 0 234.387 2.273 20 0 BEADRP CC1(C)CC[C@H]1[NH2+]Cc1ccc(CC[NH3+])cc1 ZINC000310387641 632733670 /nfs/dbraw/zinc/73/36/70/632733670.db2.gz QTOVLNWYEUZMKH-CQSZACIVSA-N 2 0 232.371 2.466 20 0 BEADRP C[N@@H+]1CCC[C@H](C[NH2+][C@H]2C[C@H]3C=C[C@@H]2CC3)C1 ZINC000925012921 635848456 /nfs/dbraw/zinc/84/84/56/635848456.db2.gz XSIKXARIZMZJKI-YJNKXOJESA-N 2 0 234.387 2.273 20 0 BEADRP C[NH+]1CCC(C[NH2+]CCC2CC(F)(F)C2)CC1 ZINC000894804944 635926259 /nfs/dbraw/zinc/92/62/59/635926259.db2.gz UBGAPPCCUZYMSN-UHFFFAOYSA-N 2 0 246.345 2.353 20 0 BEADRP C[C@@H]1CC[C@H]1[NH2+]CC(C)(C)C[NH+]1CCCC1 ZINC000309761827 633242858 /nfs/dbraw/zinc/24/28/58/633242858.db2.gz IVMRXQJOHKBYEF-CHWSQXEVSA-N 2 0 224.392 2.497 20 0 BEADRP C[N@@H+]1CC[C@@]2(CC[NH+](CC3(C)CCC3)C2)C1 ZINC000334907634 636068533 /nfs/dbraw/zinc/06/85/33/636068533.db2.gz SPXRQZVKAWNHIX-CQSZACIVSA-N 2 0 222.376 2.204 20 0 BEADRP C[C@H]1C[C@H]([NH2+][C@H]2[C@@H]3[NH2+]C[C@@H]4C[C@H]2C[C@@H]43)C[C@@H](C)C1 ZINC000328576960 633779170 /nfs/dbraw/zinc/77/91/70/633779170.db2.gz ZSFZWHFUHQUNMY-QVFPMHOFSA-N 2 0 248.414 2.397 20 0 BEADRP CC1(C)[NH2+]CC[C@H]1[NH2+][C@@H]1CCc2ccccc2C1 ZINC000925509925 633849040 /nfs/dbraw/zinc/84/90/40/633849040.db2.gz PYKKDBGWGQBQHD-HUUCEWRRSA-N 2 0 244.382 2.274 20 0 BEADRP Cc1cc(C[NH2+][C@@H]2C[C@@H]([NH3+])C23CCC3)ccc1F ZINC000925512669 633854072 /nfs/dbraw/zinc/85/40/72/633854072.db2.gz AHGMPEWKLXOJLS-ZIAGYGMSSA-N 2 0 248.345 2.494 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H](C)COC ZINC000053172203 633876907 /nfs/dbraw/zinc/87/69/07/633876907.db2.gz FTKIIWICHRJONH-CHWSQXEVSA-N 2 0 230.396 2.121 20 0 BEADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H](C)COC ZINC000053172200 633877187 /nfs/dbraw/zinc/87/71/87/633877187.db2.gz FTKIIWICHRJONH-OLZOCXBDSA-N 2 0 230.396 2.121 20 0 BEADRP C[N@H+]1C[C@H]2CC[C@@H](C1)C2[NH2+]CCC1CCC1 ZINC000925519705 633878578 /nfs/dbraw/zinc/87/85/78/633878578.db2.gz VJKRRPMQYLDIHA-PBWFPOADSA-N 2 0 222.376 2.106 20 0 BEADRP CS[C@@H]1CC[C@H]([NH2+][C@@H]2CC[NH2+]C2(C)C)C1 ZINC000925523683 633897117 /nfs/dbraw/zinc/89/71/17/633897117.db2.gz NKYHCQJTJBZKJJ-HBNTYKKESA-N 2 0 228.405 2.001 20 0 BEADRP Cc1ccc(C[NH2+][C@H]2C[C@@H]([NH3+])C23CCC3)cc1F ZINC000925524434 633899966 /nfs/dbraw/zinc/89/99/66/633899966.db2.gz TXNPJLKZVJPPGH-KGLIPLIRSA-N 2 0 248.345 2.494 20 0 BEADRP C[C@H](C1CC1)[N@@H+]1CC[C@]2(C1)CCC[NH+](C)C2 ZINC000930576001 633906466 /nfs/dbraw/zinc/90/64/66/633906466.db2.gz AVXSLDMLKSYHIE-TZMCWYRMSA-N 2 0 222.376 2.203 20 0 BEADRP C[C@H](C[NH2+][C@@H]1C[C@H]([NH3+])C12CCC2)c1ccncc1 ZINC000925541111 633955740 /nfs/dbraw/zinc/95/57/40/633955740.db2.gz HMUUOVTWYREYSU-KWCYVHTRSA-N 2 0 245.370 2.045 20 0 BEADRP C[C@]1(C[NH2+][C@H]2CC[NH2+]C23CCC3)CCCS1 ZINC000925550819 633995635 /nfs/dbraw/zinc/99/56/35/633995635.db2.gz CPIVJEBWGWFTPR-NWDGAFQWSA-N 2 0 240.416 2.146 20 0 BEADRP Cc1ccc(C[NH2+][C@@H]2C[C@H]([NH3+])CC(C)(C)C2)cn1 ZINC000925563189 634048550 /nfs/dbraw/zinc/04/85/50/634048550.db2.gz SKYBFKMYKVEGMV-UONOGXRCSA-N 2 0 247.386 2.386 20 0 BEADRP CC1(C[NH2+][C@H]2C[C@@H]([NH3+])CC(C)(C)C2)CC1 ZINC000925576692 634077446 /nfs/dbraw/zinc/07/74/46/634077446.db2.gz MBCLOXREKHVDET-MNOVXSKESA-N 2 0 210.365 2.282 20 0 BEADRP CCCC1(C[NH2+][C@@H]2CC[NH2+]C2(C)C)CC1 ZINC000925589398 634100740 /nfs/dbraw/zinc/10/07/40/634100740.db2.gz YGXGUINDVLATNS-LLVKDONJSA-N 2 0 210.365 2.297 20 0 BEADRP CC1CC([NH2+][C@@H]2CC[NH2+]C23CCCC3)C1 ZINC000925577337 634079447 /nfs/dbraw/zinc/07/94/47/634079447.db2.gz QPELWMVWPBHJCL-HTAVTVPLSA-N 2 0 208.349 2.049 20 0 BEADRP CS[C@H](C)C[NH2+][C@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925588611 634100044 /nfs/dbraw/zinc/10/00/44/634100044.db2.gz YHJRDOBRVCXPLM-VWYCJHECSA-N 2 0 230.421 2.234 20 0 BEADRP CS[C@H](C)C[NH2+][C@@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925588608 634100141 /nfs/dbraw/zinc/10/01/41/634100141.db2.gz YHJRDOBRVCXPLM-GMTAPVOTSA-N 2 0 230.421 2.234 20 0 BEADRP C[C@@]1(C[N@H+]2C[C@@H]3CCCC[C@@H]3C2)CCC[NH2+]C1 ZINC000310555054 634160399 /nfs/dbraw/zinc/16/03/99/634160399.db2.gz HUZBXPHKSZYJRG-QLFBSQMISA-N 2 0 236.403 2.498 20 0 BEADRP C[C@@H]1CC[C@@H](C[NH2+][C@H]2CC[NH2+]C2(C)C)C1 ZINC000925664291 634236754 /nfs/dbraw/zinc/23/67/54/634236754.db2.gz XVINGDRHRKFTCN-UTUOFQBUSA-N 2 0 210.365 2.153 20 0 BEADRP C[NH+]1CCC(C[NH2+]CCCC(F)(F)F)CC1 ZINC000123591727 634248637 /nfs/dbraw/zinc/24/86/37/634248637.db2.gz YNQNZMWUTBKRSU-UHFFFAOYSA-N 2 0 238.297 2.260 20 0 BEADRP CC[C@H]([NH2+][C@H]1C[C@@H]([NH3+])CC(C)(C)C1)C(C)(C)O ZINC000925674447 634257850 /nfs/dbraw/zinc/25/78/50/634257850.db2.gz JPZGAKPTHGUNHU-WOPDTQHZSA-N 2 0 242.407 2.032 20 0 BEADRP CC[C@@H]1C[C@H]1C[NH2+][C@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C ZINC000925682559 634283394 /nfs/dbraw/zinc/28/33/94/634283394.db2.gz CPSVANGSPCLFPN-BJJPWKGXSA-N 2 0 236.403 2.399 20 0 BEADRP C[C@@H]1CC[C@H](C[NH2+][C@H]2C[C@H]([NH3+])CC(C)(C)C2)O1 ZINC000925696923 634358387 /nfs/dbraw/zinc/35/83/87/634358387.db2.gz VTCWZEOFBRVSTP-MROQNXINSA-N 2 0 240.391 2.050 20 0 BEADRP C[C@H]1C[C@@H]1[C@H]1C[C@H]1C[NH2+][C@H]1CC[NH2+]CC[C@H]1C ZINC000925771823 635212248 /nfs/dbraw/zinc/21/22/48/635212248.db2.gz DFZVEXHNEBRPSA-XZBVAUNFSA-N 2 0 236.403 2.256 20 0 BEADRP CC(C)([NH3+])CC[NH2+]Cc1ccccc1F ZINC000258923111 635226084 /nfs/dbraw/zinc/22/60/84/635226084.db2.gz OQZMHTXCPHRDGA-UHFFFAOYSA-N 2 0 210.296 2.043 20 0 BEADRP C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C[NH2+][C@@H]1CC[NH2+]C1(C)C ZINC000925774487 635235614 /nfs/dbraw/zinc/23/56/14/635235614.db2.gz VZMHTZWOYLLOSE-KSSYENDESA-N 2 0 222.376 2.009 20 0 BEADRP FC1(F)CC[NH2+]C[C@@H]1C[NH2+][C@@H]1CC[C@@H]1C1CC1 ZINC000925778184 635265228 /nfs/dbraw/zinc/26/52/28/635265228.db2.gz RWNCMSKWMMCJRZ-IJLUTSLNSA-N 2 0 244.329 2.009 20 0 BEADRP Cc1cc(C)cc(C[N@@H+]2CC[C@H]([NH3+])[C@H](C)C2)c1 ZINC000094338967 635298737 /nfs/dbraw/zinc/29/87/37/635298737.db2.gz ZMRSGTGXXAFISQ-HIFRSBDPSA-N 2 0 232.371 2.473 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1[NH2+][C@@H]1C[C@H](C)CC[C@@H]1C ZINC000925784353 635300018 /nfs/dbraw/zinc/30/00/18/635300018.db2.gz MTVCTSZYMIHUEO-NZEXEKPDSA-N 2 0 210.365 2.009 20 0 BEADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CC[C@@H]1C[C@H]1C1CC1 ZINC000925803438 635352497 /nfs/dbraw/zinc/35/24/97/635352497.db2.gz ZKBWVPGRPFFGIF-DJIHRAIXSA-N 2 0 210.365 2.138 20 0 BEADRP CC[C@@H]([NH2+]C[C@H](COC)C(C)C)[C@@H]1CCC[NH2+]1 ZINC000925874937 635594971 /nfs/dbraw/zinc/59/49/71/635594971.db2.gz XPNMCEPOFMBRRC-MCIONIFRSA-N 2 0 242.407 2.025 20 0 BEADRP COC[C@@H](C[NH2+][C@H](C)[C@@H]1CCCC[NH2+]1)C(C)C ZINC000925874408 635595808 /nfs/dbraw/zinc/59/58/08/635595808.db2.gz RKCNJGZZEZPBHY-MCIONIFRSA-N 2 0 242.407 2.025 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@H]2C[C@H]3C=C[C@@H]2CC3)CC1 ZINC000924962048 635808530 /nfs/dbraw/zinc/80/85/30/635808530.db2.gz CNRDJYGWPXZCKR-CFVMTHIKSA-N 2 0 234.387 2.273 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@@H]2C[C@H]3C=C[C@@H]2CC3)CC1 ZINC000924962059 635808593 /nfs/dbraw/zinc/80/85/93/635808593.db2.gz CNRDJYGWPXZCKR-NWANDNLSSA-N 2 0 234.387 2.273 20 0 BEADRP CC(C)[NH+](CCC[NH2+][C@H]1COC[C@@H]1C)C(C)C ZINC000925197110 636376533 /nfs/dbraw/zinc/37/65/33/636376533.db2.gz QBOTWPZFSQEDEK-KBPBESRZSA-N 2 0 242.407 2.120 20 0 BEADRP C[C@H](C[NH2+][C@H](C)CCc1cccnc1)C[NH+](C)C ZINC000866364825 636883110 /nfs/dbraw/zinc/88/31/10/636883110.db2.gz QBZNNUXKIWUGEW-ZIAGYGMSSA-N 2 0 249.402 2.190 20 0 BEADRP FC(F)(F)[C@@H]1CCC[C@@H]([NH2+][C@@H]2CC[NH2+]C2)C1 ZINC000086727883 636889585 /nfs/dbraw/zinc/88/95/85/636889585.db2.gz SJVXEZYSOZHYDR-OPRDCNLKSA-N 2 0 236.281 2.059 20 0 BEADRP CCCCC[C@H](C)[NH2+]C[C@H](O)C[NH+]1CCCC1 ZINC000042238388 637091224 /nfs/dbraw/zinc/09/12/24/637091224.db2.gz XDDMXMRMFTYOEK-KBPBESRZSA-N 2 0 242.407 2.002 20 0 BEADRP CC[N@H+](CCCCCCC[NH3+])C[C@H]1CCCO1 ZINC000042471409 637269501 /nfs/dbraw/zinc/26/95/01/637269501.db2.gz NHXKLAPBXSOMKM-CQSZACIVSA-N 2 0 242.407 2.397 20 0 BEADRP CNc1ccccc1C[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000902266768 637288061 /nfs/dbraw/zinc/28/80/61/637288061.db2.gz UHFQBHOHBPMOPX-TZMCWYRMSA-N 2 0 247.386 2.301 20 0 BEADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H]2C[C@H]3CCC[C@H]3C2)C1 ZINC000902751913 637331092 /nfs/dbraw/zinc/33/10/92/637331092.db2.gz DBDKQPGZXWIPKU-XQLPTFJDSA-N 2 0 236.403 2.497 20 0 BEADRP C[C@H](C[NH2+]CCC(C)(C)[NH3+])C(C)(C)C ZINC000162999823 637344157 /nfs/dbraw/zinc/34/41/57/637344157.db2.gz JAVCLZJMCIVVNY-SNVBAGLBSA-N 2 0 200.370 2.386 20 0 BEADRP C[C@@]1(C[N@@H+]2C[C@@H]3[C@@H]4CC[C@@H](C4)[C@]3(C)C2)CC[NH2+]C1 ZINC000904465274 637409559 /nfs/dbraw/zinc/40/95/59/637409559.db2.gz ZDDOAYMULAFAKJ-JKJDWNRSSA-N 2 0 248.414 2.354 20 0 BEADRP CC[C@H]1CCC[C@H](C[NH2+]CC2([NH3+])CC2)C1 ZINC000904449087 637412634 /nfs/dbraw/zinc/41/26/34/637412634.db2.gz FZSBZEKJNYGODB-RYUDHWBXSA-N 2 0 210.365 2.284 20 0 BEADRP CC[C@@H]1CCC[C@H](C[NH2+]CC2([NH3+])CC2)C1 ZINC000904449085 637415073 /nfs/dbraw/zinc/41/50/73/637415073.db2.gz FZSBZEKJNYGODB-NEPJUHHUSA-N 2 0 210.365 2.284 20 0 BEADRP CC(C)C[C@@H]([NH3+])C[N@@H+]1C[C@@H]2CSC[C@]2(C)C1 ZINC000904476770 637428000 /nfs/dbraw/zinc/42/80/00/637428000.db2.gz RCOJWBJLDCQWQF-UPJWGTAASA-N 2 0 242.432 2.045 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]Cc2ccccc2C(F)(F)F)C1 ZINC000906508290 638179175 /nfs/dbraw/zinc/17/91/75/638179175.db2.gz LFMJVEBJURYPKR-MGCOHNPYSA-N 2 0 244.260 2.285 20 0 BEADRP CCCOc1cccc(C[NH2+][C@H]2C[C@H]([NH3+])C2)c1 ZINC000906507537 638180358 /nfs/dbraw/zinc/18/03/58/638180358.db2.gz AACREKMIWNNDTF-JOCQHMNTSA-N 2 0 234.343 2.055 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]Cc2cccc(C(F)(F)F)c2)C1 ZINC000906508711 638182057 /nfs/dbraw/zinc/18/20/57/638182057.db2.gz VYVYWBOLJBATPR-XYPYZODXSA-N 2 0 244.260 2.285 20 0 BEADRP [NH3+]C1CC([NH2+][C@@H]2CC[C@H](Cc3ccccc3)C2)C1 ZINC000906511070 638182989 /nfs/dbraw/zinc/18/29/89/638182989.db2.gz RTHCOXLWLZVHKK-YHNBSYBMSA-N 2 0 244.382 2.477 20 0 BEADRP CCCc1cccc(C[NH2+]C2CC([NH3+])C2)c1 ZINC000906511515 638185923 /nfs/dbraw/zinc/18/59/23/638185923.db2.gz YLZFABUZNVFLFB-UHFFFAOYSA-N 2 0 218.344 2.218 20 0 BEADRP CC[C@@H](C[NH2+][C@H]1C[C@H]([NH3+])C1)c1ccccc1 ZINC000906516270 638186239 /nfs/dbraw/zinc/18/62/39/638186239.db2.gz AKNRPROZUPCGMU-UBHSHLNASA-N 2 0 218.344 2.260 20 0 BEADRP C[C@H](C[NH2+][C@H]1C[C@H]([NH3+])C1)c1ccc(F)cc1 ZINC000906517977 638187842 /nfs/dbraw/zinc/18/78/42/638187842.db2.gz LSTSCBWGSXOMJP-OASPWFOLSA-N 2 0 222.307 2.009 20 0 BEADRP Cc1nc2ccc(C[NH2+][C@H]3C[C@H]([NH3+])C3)cc2s1 ZINC000906518526 638187857 /nfs/dbraw/zinc/18/78/57/638187857.db2.gz QXJLVGBQCBSQFS-XYPYZODXSA-N 2 0 247.367 2.184 20 0 BEADRP CCCCC[C@@H](C)[NH2+]CC1([NH3+])CCOCC1 ZINC000149788113 639157879 /nfs/dbraw/zinc/15/78/79/639157879.db2.gz ZFFQKHBCGILANK-GFCCVEGCSA-N 2 0 228.380 2.053 20 0 BEADRP Cc1ccccc1C[NH+]1C[C@H]2CC[N@@H+](C)C[C@H]2C1 ZINC000931430993 640200210 /nfs/dbraw/zinc/20/02/10/640200210.db2.gz UOYJMQVERIFJCB-CVEARBPZSA-N 2 0 244.382 2.379 20 0 BEADRP CC/C=C/CC[N@@H+]1C[C@@H]2CC[NH+](C)C[C@@H]2C1 ZINC000931435469 640203773 /nfs/dbraw/zinc/20/37/73/640203773.db2.gz DXYOLJINUXRKMC-OOPLNXAUSA-N 2 0 222.376 2.226 20 0 BEADRP CC(C)CCC[N@@H+]1C[C@@H]2CC[NH+](C)C[C@@H]2C1 ZINC000931439291 640207027 /nfs/dbraw/zinc/20/70/27/640207027.db2.gz TYTVZSGHUYDBGT-UONOGXRCSA-N 2 0 224.392 2.306 20 0 BEADRP CC1CC(CN2CC[C@H]3[C@@H](CC[N@@H+]3C)C2)C1 ZINC000931547309 640266314 /nfs/dbraw/zinc/26/63/14/640266314.db2.gz QJTAXPCAYGHPFY-HOAMVYINSA-N 2 0 222.376 2.059 20 0 BEADRP C[N@@H+]1CC[C@H]2CN(CCCC(C)(F)F)CC[C@@H]21 ZINC000931545661 640266634 /nfs/dbraw/zinc/26/66/34/640266634.db2.gz GGMKZMFRSWBUER-RYUDHWBXSA-N 2 0 246.345 2.448 20 0 BEADRP C=C/C=C\CC[N@H+]1[C@@H]2CC[C@H]1CCN(C)C2 ZINC000931719900 640335680 /nfs/dbraw/zinc/33/56/80/640335680.db2.gz OXKJUMOMJAHRDE-OQOSRZTISA-N 2 0 220.360 2.287 20 0 BEADRP CC[C@@H](C[C@@](C)(O)CC)[NH2+]CCCC[NH+](C)C ZINC000924856340 640351218 /nfs/dbraw/zinc/35/12/18/640351218.db2.gz WMERTRRTAHDIIU-KBPBESRZSA-N 2 0 244.423 2.248 20 0 BEADRP CC[C@@H](C[C@](C)(O)CC)[NH2+]CCCC[NH+](C)C ZINC000924856343 640351709 /nfs/dbraw/zinc/35/17/09/640351709.db2.gz WMERTRRTAHDIIU-UONOGXRCSA-N 2 0 244.423 2.248 20 0 BEADRP C[NH+]1CCC(C[NH2+]CCC(C)(C)C)CC1 ZINC000044518032 640398322 /nfs/dbraw/zinc/39/83/22/640398322.db2.gz QILZQCYEVQOYBD-UHFFFAOYSA-N 2 0 212.381 2.354 20 0 BEADRP Cc1ccc(C[NH2+]CC2CC[NH+](C)CC2)o1 ZINC000044515389 640399245 /nfs/dbraw/zinc/39/92/45/640399245.db2.gz DXDHVBMNFSNIOZ-UHFFFAOYSA-N 2 0 222.332 2.019 20 0 BEADRP C[C@@H]([NH2+]CC1CC[NH+](C)CC1)c1ccccn1 ZINC000044515449 640399984 /nfs/dbraw/zinc/39/99/84/640399984.db2.gz IATDVCREKXWQIW-GFCCVEGCSA-N 2 0 233.359 2.074 20 0 BEADRP C[NH+](C)CCCC[NH2+][C@H](c1ccccn1)C1CC1 ZINC000932376670 640505570 /nfs/dbraw/zinc/50/55/70/640505570.db2.gz FFKFKMDXBBLCMH-HNNXBMFYSA-N 2 0 247.386 2.464 20 0 BEADRP C[C@@H](C[NH2+]C1CCCC1)C[NH+]1CCCC1 ZINC000057994367 640659582 /nfs/dbraw/zinc/65/95/82/640659582.db2.gz RCPGUZYIZVRVCK-LBPRGKRZSA-N 2 0 210.365 2.251 20 0 BEADRP C[N@@H+]1C[C@@H]2C[NH+](CC[C@@H]3C[C@H]3C3CC3)C[C@]2(C)C1 ZINC000933734877 640759656 /nfs/dbraw/zinc/75/96/56/640759656.db2.gz SNGBVJZJJKEDKS-WCVJEAGWSA-N 2 0 248.414 2.306 20 0 BEADRP Cc1ccccc1C[N@@H+](C)C[C@@H]1C[NH2+]C[C@H]1C ZINC000227016441 640808861 /nfs/dbraw/zinc/80/88/61/640808861.db2.gz SSVDUVPVOMMYDF-HIFRSBDPSA-N 2 0 232.371 2.282 20 0 BEADRP Cc1ccc(C)c(C[N@@H+]2CC[C@@H]([NH3+])[C@@H](C)C2)c1 ZINC000227055705 640814344 /nfs/dbraw/zinc/81/43/44/640814344.db2.gz CNATUTXXMAPJHG-DZGCQCFKSA-N 2 0 232.371 2.473 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC000227170986 640817003 /nfs/dbraw/zinc/81/70/03/640817003.db2.gz MMMVVORZNAAQQD-RFGFWPKPSA-N 2 0 222.376 2.106 20 0 BEADRP Cc1ccc(C[N@@H+](C)C2CCC([NH3+])CC2)cn1 ZINC000228859482 640901264 /nfs/dbraw/zinc/90/12/64/640901264.db2.gz CASOWRSCACPSNN-UHFFFAOYSA-N 2 0 233.359 2.092 20 0 BEADRP CO[C@@H]1C[N@H+](CCCCCCC[NH3+])CC[C@@H]1C ZINC000230310669 641046656 /nfs/dbraw/zinc/04/66/56/641046656.db2.gz KSNULFSRECTKKI-UONOGXRCSA-N 2 0 242.407 2.252 20 0 BEADRP C[C@@H]1CC[C@@H](C[NH2+]CC2CC[NH+](C)CC2)C1 ZINC000230411991 641052962 /nfs/dbraw/zinc/05/29/62/641052962.db2.gz ANRJPGYCJHOIOI-TZMCWYRMSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@H]1CCC[C@H]1C[NH2+]CC1CC[NH+](C)CC1 ZINC000230664541 641081938 /nfs/dbraw/zinc/08/19/38/641081938.db2.gz MRXRTSUCEKRWSP-JSGCOSHPSA-N 2 0 224.392 2.354 20 0 BEADRP C[C@]1(C[NH+]2CCCCCC2)CCC[NH2+]C1 ZINC000062861649 641101327 /nfs/dbraw/zinc/10/13/27/641101327.db2.gz APWLYCSLUVQFHW-ZDUSSCGKSA-N 2 0 210.365 2.252 20 0 BEADRP CC[NH+](CC)CCC[NH2+][C@@H](C)Cc1cccnc1 ZINC000934231602 641110372 /nfs/dbraw/zinc/11/03/72/641110372.db2.gz WBDFGJBSQMEEMZ-AWEZNQCLSA-N 2 0 249.402 2.334 20 0 BEADRP [NH3+][C@H]1CCC[C@H]([NH2+]CCSC(F)(F)F)C1 ZINC000231938005 641217038 /nfs/dbraw/zinc/21/70/38/641217038.db2.gz DQKBVOCMSUDGCY-YUMQZZPRSA-N 2 0 242.310 2.099 20 0 BEADRP C[N@H+](CCCCCC[NH3+])C[C@H]1CCCCO1 ZINC000042466630 641551411 /nfs/dbraw/zinc/55/14/11/641551411.db2.gz WALCPGYBJJCNAJ-CYBMUJFWSA-N 2 0 228.380 2.006 20 0 BEADRP C[N@H+](CCCCCCC[NH3+])C[C@H]1CCCCO1 ZINC000042466669 641552692 /nfs/dbraw/zinc/55/26/92/641552692.db2.gz ALJVPGYCBYPJKH-CQSZACIVSA-N 2 0 242.407 2.397 20 0 BEADRP C[C@@H]1C[C@@H]1C[NH2+][C@@H]1CC[NH2+]C[C@H]1C1CCCC1 ZINC000925472186 642390619 /nfs/dbraw/zinc/39/06/19/642390619.db2.gz AYURWSFHGMQMMW-REBRKWNGSA-N 2 0 236.403 2.400 20 0 BEADRP CCC[N@H+](CCOCC(C)C)C1CC[NH2+]CC1 ZINC000233027562 642645174 /nfs/dbraw/zinc/64/51/74/642645174.db2.gz ULENRJVNMDYMQP-UHFFFAOYSA-N 2 0 242.407 2.123 20 0 BEADRP CCC1(C[NH2+][C@H]2CCCC[C@H]2C[NH3+])CC1 ZINC000233096556 642649437 /nfs/dbraw/zinc/64/94/37/642649437.db2.gz KYKNZZRFLVEDDX-RYUDHWBXSA-N 2 0 210.365 2.284 20 0 BEADRP CC[N@H+](CC(C)C)C[C@@H]1CC[NH2+][C@@H](C)C1 ZINC000233459995 642672376 /nfs/dbraw/zinc/67/23/76/642672376.db2.gz UBVWLVHWMKHXQM-QWHCGFSZSA-N 2 0 212.381 2.352 20 0 BEADRP CCO[C@@H]1C[C@@H]([NH2+]CCCCCC[NH3+])C1(C)C ZINC000233742908 642691699 /nfs/dbraw/zinc/69/16/99/642691699.db2.gz QDEIVPQSCDUSQK-CHWSQXEVSA-N 2 0 242.407 2.299 20 0 BEADRP CC[C@@H]1CCC[C@@H]([NH2+]C[C@@H]2CCC[NH2+]2)C1 ZINC000233923030 642706625 /nfs/dbraw/zinc/70/66/25/642706625.db2.gz LAIOAKFFYIYTPX-UPJWGTAASA-N 2 0 210.365 2.297 20 0 BEADRP CC[C@@H]1CCCC[C@@H]1[NH2+]C[C@@H]1CCC[NH2+]1 ZINC000233904845 642707558 /nfs/dbraw/zinc/70/75/58/642707558.db2.gz UXMBZFHWTXMKMS-AGIUHOORSA-N 2 0 210.365 2.297 20 0 BEADRP C[C@@H]1C[NH+](CCCCCC[NH3+])C[C@@H](C)S1 ZINC000069910034 642932285 /nfs/dbraw/zinc/93/22/85/642932285.db2.gz SQJHSOBCUBVQSX-VXGBXAGGSA-N 2 0 230.421 2.331 20 0 BEADRP C[NH+](C)CCC1CC[NH+](Cc2ccoc2)CC1 ZINC000092381289 643122794 /nfs/dbraw/zinc/12/27/94/643122794.db2.gz NUQYZRQUNMNQHO-UHFFFAOYSA-N 2 0 236.359 2.443 20 0 BEADRP CC[C@H](C)C[N@H+](CC)C[C@@H]1C[NH2+]C[C@H]1C ZINC000234007559 643176608 /nfs/dbraw/zinc/17/66/08/643176608.db2.gz YLWOODJKQSKPET-XQQFMLRXSA-N 2 0 212.381 2.210 20 0 BEADRP C[N@H+](CC1CCCC1)C1CCC([NH3+])CC1 ZINC000082492440 643327028 /nfs/dbraw/zinc/32/70/28/643327028.db2.gz PHNBWXYSAIBFEM-UHFFFAOYSA-N 2 0 210.365 2.378 20 0 BEADRP C[NH2+]C[C@H]1CCC[N@H+](CCc2cccs2)C1 ZINC000082602426 643353573 /nfs/dbraw/zinc/35/35/73/643353573.db2.gz MLNLMZWHASRVET-GFCCVEGCSA-N 2 0 238.400 2.222 20 0 BEADRP C[C@@H]1CC([NH2+]C2CC[NH2+]CC2)C[C@@H](C)C1 ZINC000082834911 643384688 /nfs/dbraw/zinc/38/46/88/643384688.db2.gz IGZACBDQKKCLEO-QWRGUYRKSA-N 2 0 210.365 2.153 20 0 BEADRP CCc1ccc(C[NH2+][C@H]2CCC[C@H]2C[NH3+])cc1 ZINC000234150742 643533431 /nfs/dbraw/zinc/53/34/31/643533431.db2.gz YNCBUWBCNGHUSR-GJZGRUSLSA-N 2 0 232.371 2.466 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+]CCC(F)(F)F ZINC000084216773 643650605 /nfs/dbraw/zinc/65/06/05/643650605.db2.gz ZXORTTFZPRVETQ-BDAKNGLRSA-N 2 0 224.270 2.046 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]C[C@H]1CC=CCC1 ZINC000084216609 643650618 /nfs/dbraw/zinc/65/06/18/643650618.db2.gz BZASSFVPXIYXQK-IHRRRGAJSA-N 2 0 222.376 2.450 20 0 BEADRP CC1(C[NH2+][C@H]2CCC[C@H]2C[NH3+])CCCC1 ZINC000084222020 643651097 /nfs/dbraw/zinc/65/10/97/643651097.db2.gz WTFHSDCPEGQPSB-RYUDHWBXSA-N 2 0 210.365 2.284 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CC=CCC1 ZINC000084217155 643651733 /nfs/dbraw/zinc/65/17/33/643651733.db2.gz RBKJUNLGYOPURY-AVGNSLFASA-N 2 0 208.349 2.202 20 0 BEADRP Cc1cc(C)cc(C[N@@H+]2CC[C@H](C[NH3+])C2)c1 ZINC000050245547 643661726 /nfs/dbraw/zinc/66/17/26/643661726.db2.gz CWSAHOCOKYKJDB-CYBMUJFWSA-N 2 0 218.344 2.084 20 0 BEADRP CC(C)[N@H+](CC1CC1)C[C@@H]1CC[C@H]([NH3+])C1 ZINC000085015376 643678537 /nfs/dbraw/zinc/67/85/37/643678537.db2.gz PHBBPLHYVAEASG-OLZOCXBDSA-N 2 0 210.365 2.234 20 0 BEADRP C[C@H]1C[C@H](C)C[NH+](C[C@@H]2CC[C@H]([NH3+])C2)C1 ZINC000085014380 643680037 /nfs/dbraw/zinc/68/00/37/643680037.db2.gz WYDDCNDIOALUIC-RVMXOQNASA-N 2 0 210.365 2.092 20 0 BEADRP CC[C@H](C)[C@@H](C)[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000252439460 643809037 /nfs/dbraw/zinc/80/90/37/643809037.db2.gz OZWIZDBLMKUSEG-YNEHKIRRSA-N 2 0 224.392 2.495 20 0 BEADRP CC[C@H](C)[C@H](C)[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000252439459 643808637 /nfs/dbraw/zinc/80/86/37/643808637.db2.gz OZWIZDBLMKUSEG-RWMBFGLXSA-N 2 0 224.392 2.495 20 0 BEADRP CC[C@H](C)C[N@H+](CC)C[C@@H]1CC[C@H]([NH3+])C1 ZINC000086440177 644137275 /nfs/dbraw/zinc/13/72/75/644137275.db2.gz LPZOZHPUVBIUSX-XQQFMLRXSA-N 2 0 212.381 2.482 20 0 BEADRP CCCCCC[C@H](O)C[NH2+][C@@](C)(C[NH3+])C1CC1 ZINC000923295664 644332510 /nfs/dbraw/zinc/33/25/10/644332510.db2.gz DGWIHGLJZPMTGM-KBPBESRZSA-N 2 0 242.407 2.035 20 0 BEADRP CCCCCC[C@@H](O)C[NH2+][C@@](C)(C[NH3+])C1CC1 ZINC000923295665 644333259 /nfs/dbraw/zinc/33/32/59/644333259.db2.gz DGWIHGLJZPMTGM-KGLIPLIRSA-N 2 0 242.407 2.035 20 0 BEADRP CC(C)[N@H+](CCC[NH2+]C1CC1)C1CCC1 ZINC000923313681 644339805 /nfs/dbraw/zinc/33/98/05/644339805.db2.gz JTXAZRFILCGGDQ-UHFFFAOYSA-N 2 0 210.365 2.391 20 0 BEADRP [NH3+]C1(C[NH2+]C[C@@H]2CC3CCC2CC3)CCC1 ZINC000923330534 644349961 /nfs/dbraw/zinc/34/99/61/644349961.db2.gz AMOWGPZGWCHCIW-BPCQOVAHSA-N 2 0 222.376 2.284 20 0 BEADRP C[C@H]([NH3+])[C@@H]1CC[N@H+](CCc2cccc(F)c2)C1 ZINC000923333055 644354987 /nfs/dbraw/zinc/35/49/87/644354987.db2.gz SWWDHBFOGNKJMD-WCQYABFASA-N 2 0 236.334 2.037 20 0 BEADRP C[NH+]1CCC(C[NH2+][C@H]2CC=CCC2)CC1 ZINC000084066707 644418000 /nfs/dbraw/zinc/41/80/00/644418000.db2.gz OGKMVZCJECFCIF-ZDUSSCGKSA-N 2 0 208.349 2.027 20 0 BEADRP C[C@@H]1CC[C@@H](C)[N@H+](CC[C@@H]2CC[NH2+]C2)C1 ZINC000084386256 644421975 /nfs/dbraw/zinc/42/19/75/644421975.db2.gz QWZKGKFWHLKVCX-UPJWGTAASA-N 2 0 210.365 2.106 20 0 BEADRP CC[C@H]1CCC[N@H+](CC[C@@H]2CC[NH2+]C2)C1 ZINC000084384847 644423922 /nfs/dbraw/zinc/42/39/22/644423922.db2.gz LSRKSKBSNXYOBT-STQMWFEESA-N 2 0 210.365 2.108 20 0 BEADRP C[C@@H]1CCC(C)(C)[N@@H+]1CCC[NH2+]C1CC1 ZINC000923420438 644425562 /nfs/dbraw/zinc/42/55/62/644425562.db2.gz IUWIDPMXXJABRW-LLVKDONJSA-N 2 0 210.365 2.391 20 0 BEADRP C[C@H]1CCCC[C@H]1C[N@@H+]1CC[C@@H]2CC[NH2+][C@@H]2C1 ZINC000923455567 644434644 /nfs/dbraw/zinc/43/46/44/644434644.db2.gz YAAYCYPJVHIZHV-ZQDZILKHSA-N 2 0 236.403 2.497 20 0 BEADRP CCCCC[NH+]1CCC2(CO[C@@H](C[NH3+])C2)CC1 ZINC000923457807 644437152 /nfs/dbraw/zinc/43/71/52/644437152.db2.gz KDVXGBMHUQTIMD-CYBMUJFWSA-N 2 0 240.391 2.006 20 0 BEADRP [NH3+]CC[C@@H]1CC[N@H+](CC[C@@H]2CCCC2(F)F)C1 ZINC000923480685 644459322 /nfs/dbraw/zinc/45/93/22/644459322.db2.gz ZLRFWHRQACVXHC-NEPJUHHUSA-N 2 0 246.345 2.483 20 0 BEADRP C[C@H](c1ccncc1)[N@@H+]1CC[C@H](C[NH3+])[C@H](C)C1 ZINC000923500275 644472510 /nfs/dbraw/zinc/47/25/10/644472510.db2.gz NDAXBXDKJAZILY-YRGRVCCFSA-N 2 0 233.359 2.059 20 0 BEADRP FCCC[NH+]1CCC([C@H]2CCC[NH2+]CC2)CC1 ZINC000923507447 644474715 /nfs/dbraw/zinc/47/47/15/644474715.db2.gz OGWMLOIEGDZWMK-ZDUSSCGKSA-N 2 0 242.382 2.448 20 0 BEADRP C[C@@H](c1cccnc1)[N@@H+]1CC[C@H](C[NH3+])[C@H](C)C1 ZINC000923501294 644474755 /nfs/dbraw/zinc/47/47/55/644474755.db2.gz PYLHVKMNDQBUGI-FRRDWIJNSA-N 2 0 233.359 2.059 20 0 BEADRP Cc1ccc(C[N@@H+]2CC[C@H](C[NH3+])[C@H](C)C2)cc1 ZINC000923505095 644475789 /nfs/dbraw/zinc/47/57/89/644475789.db2.gz YEKFYGGMDFKZSR-UKRRQHHQSA-N 2 0 232.371 2.412 20 0 BEADRP C[C@H]1C[N@H+](Cc2ccccc2F)CC[C@@H]1C[NH3+] ZINC000923504201 644476417 /nfs/dbraw/zinc/47/64/17/644476417.db2.gz PWNHQOLPDZCBNO-NWDGAFQWSA-N 2 0 236.334 2.242 20 0 BEADRP C[C@@H]1C[N@H+](Cc2ccc(F)cc2)CC[C@H]1C[NH3+] ZINC000923503680 644477198 /nfs/dbraw/zinc/47/71/98/644477198.db2.gz KTUJCNZISMZDIP-YPMHNXCESA-N 2 0 236.334 2.242 20 0 BEADRP C[C@@H](c1ccccc1)[N@@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1 ZINC000923519730 644483606 /nfs/dbraw/zinc/48/36/06/644483606.db2.gz HBBZAEJCEGHSDR-AEGPPILISA-N 2 0 230.355 2.289 20 0 BEADRP C[NH2+]CCC[N@@H+]1C[C@H](C2CC2)C[C@@H]1C1CC1 ZINC000923526682 644484905 /nfs/dbraw/zinc/48/49/05/644484905.db2.gz RXXPNFZSPCABPS-ZIAGYGMSSA-N 2 0 222.376 2.106 20 0 BEADRP Cc1nc(C[NH2+]CCCC[NH+](C)C)sc1C ZINC000087375848 644492799 /nfs/dbraw/zinc/49/27/99/644492799.db2.gz WISZUHLLEJYLEQ-UHFFFAOYSA-N 2 0 241.404 2.191 20 0 BEADRP Cc1csc(C[N@@H+]2CCC[C@H](CC[NH3+])C2)n1 ZINC000087393678 644495642 /nfs/dbraw/zinc/49/56/42/644495642.db2.gz MOQNBOLSUMYNBP-LLVKDONJSA-N 2 0 239.388 2.012 20 0 BEADRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+]CCOc1ccccc1 ZINC000089145803 644536949 /nfs/dbraw/zinc/53/69/49/644536949.db2.gz YDEIBPPIIWZNFA-HIFRSBDPSA-N 2 0 248.370 2.173 20 0 BEADRP Cc1cccc(C[N@H+](C)CC[C@@H]2CC[NH2+]C2)c1 ZINC000089749183 644565206 /nfs/dbraw/zinc/56/52/06/644565206.db2.gz UBJLARHAKPHPCW-AWEZNQCLSA-N 2 0 232.371 2.426 20 0 BEADRP COc1ccccc1C[N@H+](C)C[C@@H]1CC[C@H]([NH3+])C1 ZINC000091546095 644629606 /nfs/dbraw/zinc/62/96/06/644629606.db2.gz LZFFWKOXUDKBKW-OCCSQVGLSA-N 2 0 248.370 2.254 20 0 BEADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]C1CCOCC1 ZINC000093514913 644694610 /nfs/dbraw/zinc/69/46/10/644694610.db2.gz MWNOLZXOWAEZED-OCCSQVGLSA-N 2 0 240.391 2.066 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+][C@H]1CCc2ccccc21 ZINC000250851438 644784148 /nfs/dbraw/zinc/78/41/48/644784148.db2.gz MAZDANFVIUBXLZ-QEJZJMRPSA-N 2 0 230.355 2.391 20 0 BEADRP C([NH2+][C@@H]1CCC[C@@H]1[C@H]1CCCC[NH2+]1)C1CC1 ZINC000250896423 644785005 /nfs/dbraw/zinc/78/50/05/644785005.db2.gz YQHOUZQDMVWJLZ-MGPQQGTHSA-N 2 0 222.376 2.297 20 0 BEADRP CC[C@](C)(O)C[NH2+][C@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000251281319 644800466 /nfs/dbraw/zinc/80/04/66/644800466.db2.gz OGXKOFLCXXDOJV-MCIONIFRSA-N 2 0 242.407 2.048 20 0 BEADRP [NH3+][C@@H]1CC[C@H](C[N@@H+]2CCC[C@H]3CCC[C@@H]32)C1 ZINC000251294420 644800526 /nfs/dbraw/zinc/80/05/26/644800526.db2.gz NZSLPMSNWYSLSQ-DGAVXFQQSA-N 2 0 222.376 2.378 20 0 BEADRP CC[C@H]1CCC[N@H+](CC[C@H]2CC[NH2+]C2)CC1 ZINC000251691228 644816621 /nfs/dbraw/zinc/81/66/21/644816621.db2.gz IJTWVYMJHXWYNI-UONOGXRCSA-N 2 0 224.392 2.498 20 0 BEADRP C([C@@H]1CCC[NH2+]C1)[N@@H+]1CCC2(CCCC2)C1 ZINC000303390819 644820061 /nfs/dbraw/zinc/82/00/61/644820061.db2.gz BVOKYTCRNLSDCY-CYBMUJFWSA-N 2 0 222.376 2.252 20 0 BEADRP C[C@@H]1CC[C@H]([NH2+]C[C@H]2CCC[NH2+]C2)[C@H](C)C1 ZINC000252100164 644835203 /nfs/dbraw/zinc/83/52/03/644835203.db2.gz IGYZBENVAABSJN-MQYQWHSLSA-N 2 0 224.392 2.400 20 0 BEADRP C[C@H]1CC([NH2+]C[C@H]2CCC[NH2+]C2)C[C@H](C)C1 ZINC000252183798 644841080 /nfs/dbraw/zinc/84/10/80/644841080.db2.gz TZUOZLUVYYDJNY-UPJWGTAASA-N 2 0 224.392 2.400 20 0 BEADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H]2CCCC[C@@H]2C)C1 ZINC000252439763 644851543 /nfs/dbraw/zinc/85/15/43/644851543.db2.gz SHRLFQISWGSLBP-MJBXVCDLSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[N@@H+]1CCC2(CCCC2)C1 ZINC000304316928 644889850 /nfs/dbraw/zinc/88/98/50/644889850.db2.gz BRBWPKOHRHSWNH-OLZOCXBDSA-N 2 0 222.376 2.108 20 0 BEADRP C[C@@H]([NH3+])[C@@H]1CC[N@H+](C[C@H]2CCC[C@@H](C)C2)C1 ZINC000252754387 644900691 /nfs/dbraw/zinc/90/06/91/644900691.db2.gz BBLMGAFLDVWLFC-YIYPIFLZSA-N 2 0 224.392 2.482 20 0 BEADRP C[C@H]([NH2+]CCC(C)(C)[NH3+])c1cccc(O)c1 ZINC000304581043 644917595 /nfs/dbraw/zinc/91/75/95/644917595.db2.gz JRPAFSKXZLZYNE-JTQLQIEISA-N 2 0 222.332 2.170 20 0 BEADRP CSC1CC([NH2+]CCC[N@H+](C)CC(C)C)C1 ZINC000926644278 645332281 /nfs/dbraw/zinc/33/22/81/645332281.db2.gz FNLGGVXIHLJIFO-UHFFFAOYSA-N 2 0 244.448 2.448 20 0 BEADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1ccns1 ZINC000926666123 645343820 /nfs/dbraw/zinc/34/38/20/645343820.db2.gz QGRDSRRARCOJFN-GARJFASQSA-N 2 0 239.388 2.134 20 0 BEADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1ccns1 ZINC000926666124 645344390 /nfs/dbraw/zinc/34/43/90/645344390.db2.gz QGRDSRRARCOJFN-MXWKQRLJSA-N 2 0 239.388 2.134 20 0 BEADRP C[C@H]([NH2+]CC[C@@]1(C)C[C@@]1(F)Cl)[C@@H]1CCC[NH2+]1 ZINC000844923176 645348666 /nfs/dbraw/zinc/34/86/66/645348666.db2.gz HZGMRXOLAPWDPY-BJDJZHNGSA-N 2 0 248.773 2.421 20 0 BEADRP C[C@H]([NH2+]CC[C@@]1(C)C[C@]1(F)Cl)[C@H]1CCC[NH2+]1 ZINC000844923182 645349137 /nfs/dbraw/zinc/34/91/37/645349137.db2.gz HZGMRXOLAPWDPY-WHOHXGKFSA-N 2 0 248.773 2.421 20 0 BEADRP C[C@]1(CC[NH2+][C@@H]2CCC[C@H]2C[NH3+])C[C@@]1(F)Cl ZINC000844926576 645350830 /nfs/dbraw/zinc/35/08/30/645350830.db2.gz YULIPSJORMGUFA-USZNOCQGSA-N 2 0 248.773 2.408 20 0 BEADRP CCC[NH2+][C@H]1CC[NH2+]C[C@@H]1C1CCCC1 ZINC000925487330 645465849 /nfs/dbraw/zinc/46/58/49/645465849.db2.gz CIAUVUZZQVLPHM-OLZOCXBDSA-N 2 0 210.365 2.154 20 0 BEADRP CC[N@@H+]1CC[C@H]([NH2+]CCC(C)(C)OC)[C@H](C)C1 ZINC000866503730 645729396 /nfs/dbraw/zinc/72/93/96/645729396.db2.gz VTACXWYQWOGZQB-OLZOCXBDSA-N 2 0 242.407 2.121 20 0 BEADRP Cc1ccc(F)c(C[N@H+]2C[C@H](C[NH3+])C[C@@H]2C)c1 ZINC000220337850 645890010 /nfs/dbraw/zinc/89/00/10/645890010.db2.gz IEJPKAJUBJCVDZ-RYUDHWBXSA-N 2 0 236.334 2.303 20 0 BEADRP [NH3+][C@@H]1CCCC[C@H]1[NH2+]CC[C@@H]1C[C@H]1C1CC1 ZINC000886839334 645891804 /nfs/dbraw/zinc/89/18/04/645891804.db2.gz BWLNAKYSLUQMKC-XJFOESAGSA-N 2 0 222.376 2.282 20 0 BEADRP C[C@H](CC[NH+](C)C)[NH2+][C@@H]1C[C@H]2C=C[C@@H]1CC2 ZINC000924851669 646118600 /nfs/dbraw/zinc/11/86/00/646118600.db2.gz FLJNJTQRGOZFJT-XJFOESAGSA-N 2 0 222.376 2.271 20 0 BEADRP CC(C)CC[NH+]1CCC([NH2+][C@H]2C[C@H]2C)CC1 ZINC000924952581 646140635 /nfs/dbraw/zinc/14/06/35/646140635.db2.gz XJJMTGSLYDGUFP-OCCSQVGLSA-N 2 0 224.392 2.495 20 0 BEADRP CC[NH+]1CCC(C[NH2+][C@H](C)c2ncco2)CC1 ZINC000924955223 646142253 /nfs/dbraw/zinc/14/22/53/646142253.db2.gz NUUFSSPMSMTBRM-LLVKDONJSA-N 2 0 237.347 2.057 20 0 BEADRP C[C@@H]1CC[C@H](C)[C@H]1[NH2+]CC1CC[NH+](C)CC1 ZINC000924963221 646143710 /nfs/dbraw/zinc/14/37/10/646143710.db2.gz JDEPNFOUADJGSE-IMRBUKKESA-N 2 0 224.392 2.352 20 0 BEADRP C1=C[C@@H]2CC[C@H]1C[C@H]2[NH2+][C@@H]1CCN(CC2CC2)C1 ZINC000925009260 646157648 /nfs/dbraw/zinc/15/76/48/646157648.db2.gz BKOWTHHLGUAOSC-LCGIIJARSA-N 2 0 246.398 2.415 20 0 BEADRP CC1(C)[C@@H]([NH2+]CC2CCC2)[C@@H]2CCC[NH2+][C@@H]21 ZINC000925484376 646297263 /nfs/dbraw/zinc/29/72/63/646297263.db2.gz DLUYBUQKDFSJDE-AGIUHOORSA-N 2 0 222.376 2.153 20 0 BEADRP C([NH2+][C@H]1CC[NH2+]C12CCC2)C1CCSCC1 ZINC000925486337 646297918 /nfs/dbraw/zinc/29/79/18/646297918.db2.gz HDJRPHKBCLJOLH-LBPRGKRZSA-N 2 0 240.416 2.004 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1NC[C@@H]1Cc2ccccc21 ZINC000925490778 646298670 /nfs/dbraw/zinc/29/86/70/646298670.db2.gz OVTRTVVBCCDVPG-JSGCOSHPSA-N 2 0 230.355 2.056 20 0 BEADRP CC1(C)C[C@@H]([NH2+]Cc2cccnc2)C[C@@H]([NH3+])C1 ZINC000925494067 646301106 /nfs/dbraw/zinc/30/11/06/646301106.db2.gz MZNDAPHUPGHAGB-OLZOCXBDSA-N 2 0 233.359 2.077 20 0 BEADRP CC1(C)C[C@@H]([NH3+])C[C@@H]([NH2+]C2CCCC2)C1 ZINC000925495977 646301292 /nfs/dbraw/zinc/30/12/92/646301292.db2.gz RHBYRDSTYUJBPQ-CMPLNLGQSA-N 2 0 210.365 2.425 20 0 BEADRP CSCC[C@H](C)[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000925510385 646308803 /nfs/dbraw/zinc/30/88/03/646308803.db2.gz VPQHAOVGCHDDME-QWRGUYRKSA-N 2 0 228.405 2.002 20 0 BEADRP CS[C@@H]1CC[C@H]([NH2+][C@@H]2CC[NH2+]C23CCC3)C1 ZINC000925520921 646312968 /nfs/dbraw/zinc/31/29/68/646312968.db2.gz BHRLHNMEULFCHB-QJPTWQEYSA-N 2 0 240.416 2.145 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+]CCC1CCCC1 ZINC000925520080 646313710 /nfs/dbraw/zinc/31/37/10/646313710.db2.gz URCKXEBGVWHHCY-LBPRGKRZSA-N 2 0 210.365 2.297 20 0 BEADRP COCCCCC[NH2+][C@@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925531516 646320218 /nfs/dbraw/zinc/32/02/18/646320218.db2.gz ZFCKOUKUZWSBIK-QWHCGFSZSA-N 2 0 242.407 2.299 20 0 BEADRP CC1(C)C[C@@H]([NH2+][C@@H]2CCCSC2)C[C@@H]([NH3+])C1 ZINC000925530671 646320255 /nfs/dbraw/zinc/32/02/55/646320255.db2.gz LGVHAODPAXKEMH-UTUOFQBUSA-N 2 0 242.432 2.378 20 0 BEADRP C([NH2+][C@H]1CC[NH2+]C[C@H]1C1CCCC1)C1CC1 ZINC000925535037 646321756 /nfs/dbraw/zinc/32/17/56/646321756.db2.gz BBCVLLJUXFRRNN-KBPBESRZSA-N 2 0 222.376 2.154 20 0 BEADRP C[C@H](C[NH2+][C@H]1CC[NH2+]C12CCCC2)C1CC1 ZINC000925583417 646344694 /nfs/dbraw/zinc/34/46/94/646344694.db2.gz FFZQTFNHJGHMFB-YPMHNXCESA-N 2 0 222.376 2.297 20 0 BEADRP CC(C)C1(C[NH2+][C@@H]2CC[NH2+]C23CCC3)CC1 ZINC000925579672 646345435 /nfs/dbraw/zinc/34/54/35/646345435.db2.gz NUUFCDZTZBEJJU-GFCCVEGCSA-N 2 0 222.376 2.297 20 0 BEADRP CC[C@H](O)CCC[NH2+][C@@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925582716 646347535 /nfs/dbraw/zinc/34/75/35/646347535.db2.gz ZCIXVYCZBPMZEG-UPJWGTAASA-N 2 0 242.407 2.033 20 0 BEADRP C[C@@H](C[NH2+][C@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C)C1CC1 ZINC000925585973 646347767 /nfs/dbraw/zinc/34/77/67/646347767.db2.gz QLRDQYOHZVLJLK-GHYVTOPFSA-N 2 0 236.403 2.399 20 0 BEADRP CC1(C)C[C@@H]1C[NH2+][C@@H]1CC[NH2+]C12CCCC2 ZINC000925593533 646348075 /nfs/dbraw/zinc/34/80/75/646348075.db2.gz CKVBUUZIXMRVHF-VXGBXAGGSA-N 2 0 222.376 2.297 20 0 BEADRP CC1CC(C[NH+]2CCN(c3cc[nH+]cc3)CC2)C1 ZINC000929834297 646348560 /nfs/dbraw/zinc/34/85/60/646348560.db2.gz JLWDLOUCEYDHSP-UHFFFAOYSA-N 2 0 245.370 2.250 20 0 BEADRP C1CC([NH2+][C@H]2CC[NH2+]C[C@@H]2C2CCCC2)C1 ZINC000925593393 646350517 /nfs/dbraw/zinc/35/05/17/646350517.db2.gz GGQBTUVBDVPIED-KGLIPLIRSA-N 2 0 222.376 2.297 20 0 BEADRP C[C@H]1CC[C@H]([NH2+][C@@H]2CC[NH2+]C2(C)C)CC1 ZINC000925596277 646350877 /nfs/dbraw/zinc/35/08/77/646350877.db2.gz RTJDQFKLDRLEKH-IJLUTSLNSA-N 2 0 210.365 2.295 20 0 BEADRP C[C@H]1CC[C@H]([NH2+][C@H]2CC[NH2+]C2(C)C)CC1 ZINC000925596278 646351417 /nfs/dbraw/zinc/35/14/17/646351417.db2.gz RTJDQFKLDRLEKH-SRVKXCTJSA-N 2 0 210.365 2.295 20 0 BEADRP CC1(C)[C@H]([NH2+]CCc2ccco2)[C@@H]2CCC[NH2+][C@@H]21 ZINC000925611975 646360221 /nfs/dbraw/zinc/36/02/21/646360221.db2.gz OZPCXETZOWVMCC-HZSPNIEDSA-N 2 0 248.370 2.188 20 0 BEADRP CC1(C)[C@@H]([NH2+][C@H]2CC=CCC2)[C@@H]2CCC[NH2+][C@@H]21 ZINC000925619334 646368234 /nfs/dbraw/zinc/36/82/34/646368234.db2.gz MRXTYNIINVICLO-CRWXNKLISA-N 2 0 234.387 2.461 20 0 BEADRP CSCCCCC[NH2+][C@@H]1CC[NH2+]C1(C)C ZINC000925647546 646387816 /nfs/dbraw/zinc/38/78/16/646387816.db2.gz YWSSPJZVNHFKJR-LLVKDONJSA-N 2 0 230.421 2.250 20 0 BEADRP CC1(C)C[C@@H]([NH2+]C[C@@H]2CCSC2)C[C@@H]([NH3+])C1 ZINC000925652875 646392048 /nfs/dbraw/zinc/39/20/48/646392048.db2.gz HWQHPGLTCUWOFW-TUAOUCFPSA-N 2 0 242.432 2.235 20 0 BEADRP [NH3+]CCC[C@H]([NH2+]CCF)c1ccccc1 ZINC000925655172 646393380 /nfs/dbraw/zinc/39/33/80/646393380.db2.gz QOTUTSGUSCEDPE-LBPRGKRZSA-N 2 0 210.296 2.026 20 0 BEADRP C([NH2+][C@H]1CC[NH2+]C12CCC2)[C@@H]1CCCSC1 ZINC000925672815 646400638 /nfs/dbraw/zinc/40/06/38/646400638.db2.gz KGQNEDAHQVJQEL-RYUDHWBXSA-N 2 0 240.416 2.004 20 0 BEADRP COCC(C)(C)C[NH2+][C@@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925674734 646405039 /nfs/dbraw/zinc/40/50/39/646405039.db2.gz SODMAPABABTTFM-VXGBXAGGSA-N 2 0 242.407 2.155 20 0 BEADRP FCCCC[NH2+][C@H]1CC[NH2+]C12CCCC2 ZINC000925677603 646407404 /nfs/dbraw/zinc/40/74/04/646407404.db2.gz VWZHPABTBAYPOM-NSHDSACASA-N 2 0 214.328 2.000 20 0 BEADRP C[C@H](CCCCO)[NH2+][C@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925678615 646407604 /nfs/dbraw/zinc/40/76/04/646407604.db2.gz DQBPKEKJAILHII-AGIUHOORSA-N 2 0 242.407 2.033 20 0 BEADRP CO[C@@H]1CCC[C@H]1[NH2+][C@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925683549 646410808 /nfs/dbraw/zinc/41/08/08/646410808.db2.gz SIDUUBIDLJZJAL-YVECIDJPSA-N 2 0 240.391 2.050 20 0 BEADRP COCC[C@H](C)C[NH2+][C@@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925685495 646413205 /nfs/dbraw/zinc/41/32/05/646413205.db2.gz JSKAQLHXTIXZDD-RWMBFGLXSA-N 2 0 242.407 2.155 20 0 BEADRP CC1(C)[C@H]([NH2+]C[C@@H]2C[C@H]2C2CC2)[C@@H]2CCC[NH2+][C@@H]21 ZINC000925689432 646417274 /nfs/dbraw/zinc/41/72/74/646417274.db2.gz GTSBBGMPPPCKFB-AIEDFZFUSA-N 2 0 248.414 2.399 20 0 BEADRP C1CC12C[C@H]2[NH2+][C@H]1CC[NH2+]C[C@H]1C1CCCC1 ZINC000925703479 646427735 /nfs/dbraw/zinc/42/77/35/646427735.db2.gz GEJBGHPKNCCJOV-MELADBBJSA-N 2 0 234.387 2.297 20 0 BEADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+][C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000925707203 646430880 /nfs/dbraw/zinc/43/08/80/646430880.db2.gz DALXZWHVLYDQCF-BGGNASPJSA-N 2 0 234.387 2.281 20 0 BEADRP C1[C@@H]([NH2+][C@@H]2CC[NH2+]C23CCCC3)[C@@H]1C1CCC1 ZINC000925706864 646431385 /nfs/dbraw/zinc/43/13/85/646431385.db2.gz OLSIPTYDUYMITE-BFHYXJOUSA-N 2 0 234.387 2.439 20 0 BEADRP C1=C[C@H]([NH2+][C@H]2CC[NH2+]C[C@H]2C2CCCC2)CC1 ZINC000925708675 646432366 /nfs/dbraw/zinc/43/23/66/646432366.db2.gz CZMUKHXBKTXYQL-KKUMJFAQSA-N 2 0 234.387 2.463 20 0 BEADRP CC1(C)C[C@@H]([NH3+])C[C@H]([NH2+]CCc2ccoc2)C1 ZINC000925709035 646434630 /nfs/dbraw/zinc/43/46/30/646434630.db2.gz NRAAXZIZOOCWHS-STQMWFEESA-N 2 0 236.359 2.318 20 0 BEADRP CC1(C)C[C@]1(C)[NH2+][C@@H]1C[C@H]([NH3+])C12CCC2 ZINC000925716880 646440780 /nfs/dbraw/zinc/44/07/80/646440780.db2.gz RNXWKDPQJZVJPT-UMNHJUIQSA-N 2 0 208.349 2.035 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+]CC[C@@H]1CC=CCC1 ZINC000925718090 646442857 /nfs/dbraw/zinc/44/28/57/646442857.db2.gz GJPWPRBEKPANCZ-OLZOCXBDSA-N 2 0 222.376 2.463 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+]C[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000925720076 646444093 /nfs/dbraw/zinc/44/40/93/646444093.db2.gz FHOAGPNZAYWYSM-NDBYEHHHSA-N 2 0 222.376 2.153 20 0 BEADRP CC1(C)[NH2+]CC[C@@H]1[NH2+][C@@H]1CCCC12CC2 ZINC000925723577 646448537 /nfs/dbraw/zinc/44/85/37/646448537.db2.gz BPRZTYAWBZRBNZ-WDEREUQCSA-N 2 0 208.349 2.049 20 0 BEADRP CC1(C)C[C@H]([NH3+])C[C@@H]([NH2+]C[C@@H]2C=CCC2)C1 ZINC000925732214 646455656 /nfs/dbraw/zinc/45/56/56/646455656.db2.gz PBPLTVPSXPFENY-JHJVBQTASA-N 2 0 222.376 2.448 20 0 BEADRP CCC[C@H](C)CC[NH2+][C@H](C)[C@@H]1CC[NH2+]C1 ZINC000925735248 646458121 /nfs/dbraw/zinc/45/81/21/646458121.db2.gz XVXLJCVSQMVVKC-YNEHKIRRSA-N 2 0 212.381 2.400 20 0 BEADRP CC(C)O[C@@H]1C[C@H]([NH2+]CCC(C)(C)[NH3+])C1(C)C ZINC000925736511 646460282 /nfs/dbraw/zinc/46/02/82/646460282.db2.gz AWLIPVMTQLWBJB-NWDGAFQWSA-N 2 0 242.407 2.296 20 0 BEADRP CO[C@H]1C[C@H](C[NH2+][C@H](c2ccccc2)[C@@H](C)N)C1 ZINC000925735464 646460830 /nfs/dbraw/zinc/46/08/30/646460830.db2.gz GGSGAWWFUCDFCO-GBOPCIDUSA-N 2 0 248.370 2.090 20 0 BEADRP CC[C@H]1CCCC[C@@H]1[NH2+][C@@H]1C[NH2+]C[C@H]1C ZINC000925784412 646463655 /nfs/dbraw/zinc/46/36/55/646463655.db2.gz NJBMFBRECJEWBO-MROQNXINSA-N 2 0 210.365 2.153 20 0 BEADRP CCC(C)(C)[C@H](C)[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000925785275 646465274 /nfs/dbraw/zinc/46/52/74/646465274.db2.gz MXGXVIJUNYLOTL-WOPDTQHZSA-N 2 0 212.381 2.256 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1C[NH2+]CCC1(F)F)[C@@H]1C[C@H]1C ZINC000925778300 646474453 /nfs/dbraw/zinc/47/44/53/646474453.db2.gz SIWZECZXXKHIST-KXNHARMFSA-N 2 0 246.345 2.255 20 0 BEADRP [NH3+][C@H]1C[C@H]([NH2+]CC[C@H]2CCCO2)c2ccccc21 ZINC000925775711 646475743 /nfs/dbraw/zinc/47/57/43/646475743.db2.gz RMIQFRCFJJALNI-UGFHNGPFSA-N 2 0 246.354 2.290 20 0 BEADRP C[C@@H](CC(C)(C)C)[NH2+]C[C@@H]1C[NH2+]C[C@H]1C ZINC000925785475 646481020 /nfs/dbraw/zinc/48/10/20/646481020.db2.gz NMHLAVSLMVHGJT-WOPDTQHZSA-N 2 0 212.381 2.256 20 0 BEADRP CCCC[C@H](C)[C@@H](C)[NH2+][C@@H]1C[NH2+]C[C@H]1C ZINC000925785509 646481712 /nfs/dbraw/zinc/48/17/12/646481712.db2.gz PLJRYAGMRCVNHY-UMSGYPCISA-N 2 0 212.381 2.399 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@@H]1CCC[C@H]1CCCF ZINC000925786523 646483687 /nfs/dbraw/zinc/48/36/87/646483687.db2.gz SXEAPMUTDJAXSM-ZOBORPQBSA-N 2 0 242.382 2.350 20 0 BEADRP C[C@@H]([NH2+][C@@H]1C[NH2+]C[C@H]1C)C1CCC(F)(F)CC1 ZINC000925786749 646483782 /nfs/dbraw/zinc/48/37/82/646483782.db2.gz VTMJQZGYFPMNII-CKYFFXLPSA-N 2 0 246.345 2.398 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1C[NH2+][C@H]1CCCC12CCC2 ZINC000925786496 646483806 /nfs/dbraw/zinc/48/38/06/646483806.db2.gz SQTZNCCYEAXVLH-AGIUHOORSA-N 2 0 222.376 2.154 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1C[NH2+]CCC1(F)F)C1CC1 ZINC000925786925 646483811 /nfs/dbraw/zinc/48/38/11/646483811.db2.gz XYPWZCIEZYHKAE-QWRGUYRKSA-N 2 0 232.318 2.009 20 0 BEADRP CC[C@H]([NH2+]CC[C@@H]1C[NH2+]C[C@H]1C)[C@@H]1C[C@@H]1C ZINC000925797035 646484442 /nfs/dbraw/zinc/48/44/42/646484442.db2.gz SWJVBQVBLLFONZ-MRTXSQPYSA-N 2 0 224.392 2.256 20 0 BEADRP C[C@H]([NH2+]C[C@@H]1C[NH2+]C[C@H]1C)c1cccc(F)c1 ZINC000925790043 646485928 /nfs/dbraw/zinc/48/59/28/646485928.db2.gz FKWWYWOBYUHRJD-MDZLAQPJSA-N 2 0 236.334 2.332 20 0 BEADRP CSC1CCC(C[NH2+][C@@H]2CCC[C@H]2[NH3+])CC1 ZINC000925803370 646488768 /nfs/dbraw/zinc/48/87/68/646488768.db2.gz YOLFYLBLFDLGLP-FIYWTHMPSA-N 2 0 242.432 2.378 20 0 BEADRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+][C@@H]1CCCc2occc21 ZINC000925803856 646488824 /nfs/dbraw/zinc/48/88/24/646488824.db2.gz WQINZIVKCDFSRC-YRGRVCCFSA-N 2 0 248.370 2.492 20 0 BEADRP CC[C@H]([NH2+][C@@H]1C[C@H]1[C@@H]1C[C@H]1C)[C@@H]1CCC[NH2+]1 ZINC000925820038 646493614 /nfs/dbraw/zinc/49/36/14/646493614.db2.gz BTMFBJCXMKBTOQ-NKTODWNOSA-N 2 0 222.376 2.151 20 0 BEADRP C[C@@H]1C[C@H]1[C@@H]1C[C@H]1[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000925825202 646497784 /nfs/dbraw/zinc/49/77/84/646497784.db2.gz YAKYDZMXLJNWKT-LLMNZUDISA-N 2 0 234.387 2.009 20 0 BEADRP C1=CCC(CC[NH2+][C@@H]2CC[NH2+]C23CCC3)C1 ZINC000925834596 646502565 /nfs/dbraw/zinc/50/25/65/646502565.db2.gz ZERHZPCZRZBNQV-CYBMUJFWSA-N 2 0 220.360 2.217 20 0 BEADRP FC(F)(F)[C@@H]1C[C@H]1C[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000925834539 646502802 /nfs/dbraw/zinc/50/28/02/646502802.db2.gz YOKIRZLLYVHHBA-FCGXGWFWSA-N 2 0 248.292 2.057 20 0 BEADRP CCC[C@H](O)CC[NH2+][C@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925856096 646511726 /nfs/dbraw/zinc/51/17/26/646511726.db2.gz JEZGXRAYDTXMDA-AVGNSLFASA-N 2 0 242.407 2.033 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[NH2+]CC[C@@H]2C)CCS1 ZINC000925860888 646513586 /nfs/dbraw/zinc/51/35/86/646513586.db2.gz LMJRXPFFIQWVRL-UMSGYPCISA-N 2 0 242.432 2.248 20 0 BEADRP C[C@H]([NH2+][C@H]1CCSC2(CCC2)C1)C1C[NH2+]C1 ZINC000925862079 646514564 /nfs/dbraw/zinc/51/45/64/646514564.db2.gz XNYDVKRKQSGNPZ-JQWIXIFHSA-N 2 0 240.416 2.002 20 0 BEADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[NH2+]CC[C@H]2C)CCS1 ZINC000925860885 646514948 /nfs/dbraw/zinc/51/49/48/646514948.db2.gz LMJRXPFFIQWVRL-FDYHWXHSSA-N 2 0 242.432 2.248 20 0 BEADRP C[C@@H](CC1CCC1)[NH2+]C[C@@H]1CC[C@H]([NH3+])C1 ZINC000925876067 646526465 /nfs/dbraw/zinc/52/64/65/646526465.db2.gz QLTGWAXPWQPQAB-UHTWSYAYSA-N 2 0 210.365 2.282 20 0 BEADRP CC[C@@H]([NH2+]C[C@@H]1CC[C@H]([NH3+])C1)C1CCC1 ZINC000925880109 646529540 /nfs/dbraw/zinc/52/95/40/646529540.db2.gz ODLIEPHPDUVXDK-KGYLQXTDSA-N 2 0 210.365 2.282 20 0 BEADRP CC[C@H]([NH2+]C[C@@H]1CC[C@H]([NH3+])C1)C1CCC1 ZINC000925880110 646529585 /nfs/dbraw/zinc/52/95/85/646529585.db2.gz ODLIEPHPDUVXDK-WXHSDQCUSA-N 2 0 210.365 2.282 20 0 BEADRP COC[C@@H](CCC[NH3+])[NH2+]CC1CCC=CCC1 ZINC000925879988 646529882 /nfs/dbraw/zinc/52/98/82/646529882.db2.gz FRTMRPMNBJHOAC-CQSZACIVSA-N 2 0 240.391 2.076 20 0 BEADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]C[C@]12C[C@H]1CCC2 ZINC000925882231 646530429 /nfs/dbraw/zinc/53/04/29/646530429.db2.gz ZWOBYHKENVCJPI-DGAVXFQQSA-N 2 0 222.376 2.284 20 0 BEADRP C[N@H+]1C[C@H]2CC[C@@H](C1)C2[NH2+][C@@H]1CCC1(C)C ZINC000926421138 646634214 /nfs/dbraw/zinc/63/42/14/646634214.db2.gz LBWXKOSAVDAEPY-DAAZQVBGSA-N 2 0 222.376 2.105 20 0 BEADRP CC(C)N(C)C[C@@H](C)[NH2+][C@@H](C)Cc1ccccn1 ZINC000926451169 646642141 /nfs/dbraw/zinc/64/21/41/646642141.db2.gz WRCBVUJKTZVIRO-UONOGXRCSA-N 2 0 249.402 2.331 20 0 BEADRP CC[C@H]([NH2+][C@@H]1CCC[C@H]([NH3+])C1)[C@@H]1CCCOC1 ZINC000723986900 711551186 /nfs/dbraw/zinc/55/11/86/711551186.db2.gz LXDNEZGPUBYMJK-RQJABVFESA-N 2 0 240.391 2.051 20 0 BEADRP FC1(C2CC2)CC[NH+](CC[C@H]2CC[NH2+]C2)CC1 ZINC000724799473 711615422 /nfs/dbraw/zinc/61/54/22/711615422.db2.gz AKAPDWCRLAVRCZ-GFCCVEGCSA-N 2 0 240.366 2.200 20 0 BEADRP C[C@@H]([NH2+]CC1(C)CC(F)(F)C1)[C@@H]1CCC[NH2+]1 ZINC000720899259 711686689 /nfs/dbraw/zinc/68/66/89/711686689.db2.gz GKMNSUCWCFSUHQ-ZJUUUORDSA-N 2 0 232.318 2.152 20 0 BEADRP C[N@H+](C[C@@]1(C)CCC[NH2+]C1)C1CC(C)(C)C1 ZINC000395458740 711694650 /nfs/dbraw/zinc/69/46/50/711694650.db2.gz DCXKFVCCBOJNGD-AWEZNQCLSA-N 2 0 224.392 2.497 20 0 BEADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CC1CCC=CCC1 ZINC000925880062 711762067 /nfs/dbraw/zinc/76/20/67/711762067.db2.gz HBVTYMIDAOIMRM-NEPJUHHUSA-N 2 0 210.365 2.448 20 0 BEADRP COC[C@H](C[N@H+](C)C1CCC([NH3+])CC1)C(C)C ZINC000721911905 711917538 /nfs/dbraw/zinc/91/75/38/711917538.db2.gz LCPSIWXHPIMSER-HSBZDZAISA-N 2 0 242.407 2.107 20 0 BEADRP COC[C@H](C[N@@H+]1CCCC[C@@H]1CC[NH3+])C(C)C ZINC000721959268 711948146 /nfs/dbraw/zinc/94/81/46/711948146.db2.gz HGMRSTZDTFIJAJ-UONOGXRCSA-N 2 0 242.407 2.108 20 0 BEADRP C[NH+]1CCC(C[NH2+]C2(C3CCC3)CC2)CC1 ZINC000700160202 711987324 /nfs/dbraw/zinc/98/73/24/711987324.db2.gz NTIRLJDYWMVBFE-UHFFFAOYSA-N 2 0 222.376 2.251 20 0 BEADRP C[C@@H](CC1CCC1)[NH2+]CC[C@H](C)[NH+](C)C ZINC000700456703 711996222 /nfs/dbraw/zinc/99/62/22/711996222.db2.gz WVQKSVYDLCIKBS-RYUDHWBXSA-N 2 0 212.381 2.495 20 0 BEADRP C[C@@H]([NH2+]CCCC[NH+](C)C)C1(Cl)CC1 ZINC000702335950 712047904 /nfs/dbraw/zinc/04/79/04/712047904.db2.gz NQEMNAZMJUWGPB-SNVBAGLBSA-N 2 0 218.772 2.078 20 0 BEADRP C[C@@H]([NH2+]CC1(C)CC[NH+](C)CC1)C1(Cl)CC1 ZINC000702412769 712051834 /nfs/dbraw/zinc/05/18/34/712051834.db2.gz FGEPNJHYUVEXSQ-LLVKDONJSA-N 2 0 244.810 2.468 20 0 BEADRP CCC[N@H+](CC)CC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000703806157 712089266 /nfs/dbraw/zinc/08/92/66/712089266.db2.gz ODIIGJCTBHQGMW-YHWZYXNKSA-N 2 0 210.365 2.249 20 0 BEADRP CC[NH+]1CCC([NH2+]CC[C@@H]2CCSC2)CC1 ZINC000704797536 712117667 /nfs/dbraw/zinc/11/76/67/712117667.db2.gz NRKPWWPDCSJVAH-GFCCVEGCSA-N 2 0 242.432 2.204 20 0 BEADRP CSC1CC([NH2+]C[C@H]2CC[N@@H+](C(C)C)C2)C1 ZINC000706920675 712160840 /nfs/dbraw/zinc/16/08/40/712160840.db2.gz XJZQLFJWWPIFQW-PNESKVBLSA-N 2 0 242.432 2.200 20 0 BEADRP CC1(C)CO[C@@H](C[N@@H+]2CCCC[C@H]2CC[NH3+])C1 ZINC000708326001 712187584 /nfs/dbraw/zinc/18/75/84/712187584.db2.gz ZBTPOEPRXBBSNA-QWHCGFSZSA-N 2 0 240.391 2.005 20 0 BEADRP C([NH2+]C1CCCC1)[C@]12CCC[C@H]1[NH2+]CC2 ZINC000711378559 712296022 /nfs/dbraw/zinc/29/60/22/712296022.db2.gz MLQPFUIMKGYNPV-CHWSQXEVSA-N 2 0 208.349 2.051 20 0 BEADRP C[C@@H]1CC[N@H+](C[C@@]2(C)CCC[NH2+]C2)CCS1 ZINC000379545346 712387805 /nfs/dbraw/zinc/38/78/05/712387805.db2.gz YOWUKECNSUZYDY-OLZOCXBDSA-N 2 0 242.432 2.204 20 0 BEADRP CC1([NH3+])CC[NH+](C[C@H]2CCCC(C)(C)O2)CC1 ZINC000714329789 712482387 /nfs/dbraw/zinc/48/23/87/712482387.db2.gz JXYSQHXHUREXQT-GFCCVEGCSA-N 2 0 240.391 2.147 20 0 BEADRP C[C@]1(C[NH3+])CC[N@H+](C[C@@H]2CCCC(C)(C)O2)C1 ZINC000714375217 712484317 /nfs/dbraw/zinc/48/43/17/712484317.db2.gz SEHQGDIAUYSEIS-GXTWGEPZSA-N 2 0 240.391 2.005 20 0 BEADRP CC1(C)CCC[C@H](C[N@@H+]2CCC[C@@H](C[NH3+])C2)O1 ZINC000714373037 712484344 /nfs/dbraw/zinc/48/43/44/712484344.db2.gz BDIZJUPVVNTPEK-QWHCGFSZSA-N 2 0 240.391 2.005 20 0 BEADRP CC1(C)CCC[C@@H](C[N@@H+]2CCC[C@H](C[NH3+])C2)O1 ZINC000714373033 712484352 /nfs/dbraw/zinc/48/43/52/712484352.db2.gz BDIZJUPVVNTPEK-OLZOCXBDSA-N 2 0 240.391 2.005 20 0 BEADRP C[NH+](C)C1(C)CCC([NH2+]Cc2cocn2)CC1 ZINC000715552817 712528144 /nfs/dbraw/zinc/52/81/44/712528144.db2.gz OUOGUFTUFJESFO-UHFFFAOYSA-N 2 0 237.347 2.027 20 0 BEADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]CCCCC1CC1 ZINC000716412077 712559200 /nfs/dbraw/zinc/55/92/00/712559200.db2.gz GOOWIQICFNLJSZ-QWHCGFSZSA-N 2 0 210.365 2.284 20 0 BEADRP CC1(C)CC[C@@H]([NH2+]C[C@H]2C[NH2+]CCC2(F)F)C1 ZINC000717317975 712646552 /nfs/dbraw/zinc/64/65/52/712646552.db2.gz UHNUJEAHBRWBCP-GHMZBOCLSA-N 2 0 246.345 2.400 20 0 BEADRP C[C@H](CCC1CC1)[NH2+]C[C@@H]1C[NH2+]CCC1(F)F ZINC000717348731 712649949 /nfs/dbraw/zinc/64/99/49/712649949.db2.gz JPOSAUOUTYKQNB-PWSUYJOCSA-N 2 0 246.345 2.400 20 0 BEADRP CCCC[C@@H](C)[NH2+]C[C@H]1CC[N@H+](CC)C1 ZINC000037484314 712650798 /nfs/dbraw/zinc/65/07/98/712650798.db2.gz GALKURQDIPGZHO-CHWSQXEVSA-N 2 0 212.381 2.497 20 0 BEADRP CC(F)(F)CCC[N@@H+]1C[C@@]2(C)C[NH2+]C[C@@]2(C)C1 ZINC000718631669 712773894 /nfs/dbraw/zinc/77/38/94/712773894.db2.gz FLGQDLDHHFHSJG-TXEJJXNPSA-N 2 0 246.345 2.353 20 0 BEADRP COCC(C)(C)CC[NH2+][C@H](C)[C@@H]1CCCC[NH2+]1 ZINC000718713870 712777898 /nfs/dbraw/zinc/77/78/98/712777898.db2.gz AERMGYYXQGDSPS-OLZOCXBDSA-N 2 0 242.407 2.169 20 0 BEADRP COCC(C)(C)CC[NH2+][C@@H](C)[C@@H]1CCCC[NH2+]1 ZINC000718713873 712777905 /nfs/dbraw/zinc/77/79/05/712777905.db2.gz AERMGYYXQGDSPS-STQMWFEESA-N 2 0 242.407 2.169 20 0 BEADRP CSCC1CC[NH+](CCC[NH2+]C2CC2)CC1 ZINC000719270402 712802746 /nfs/dbraw/zinc/80/27/46/712802746.db2.gz WIECNFWMAHSRHA-UHFFFAOYSA-N 2 0 242.432 2.204 20 0 BEADRP CC1(C[NH2+][C@H]2CCC[C@@H]2C[NH3+])CC(F)(F)C1 ZINC000720912888 712877891 /nfs/dbraw/zinc/87/78/91/712877891.db2.gz QYRPJRNIKFHNFM-ZJUUUORDSA-N 2 0 232.318 2.139 20 0 BEADRP CC[C@@H]([NH3+])C[NH+]1CCC(C(C)(C)C)CC1 ZINC000050346377 1166303695 /nfs/dbraw/zinc/30/36/95/1166303695.db2.gz ZCRLFYZFLUFIPQ-GFCCVEGCSA-N 2 0 212.381 2.482 20 0 BEADRP